data_4K3Y # _entry.id 4K3Y # _audit_conform.dict_name mmcif_pdbx.dic _audit_conform.dict_version 5.281 _audit_conform.dict_location http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic # loop_ _database_2.database_id _database_2.database_code PDB 4K3Y RCSB RCSB078860 WWPDB D_1000078860 # _pdbx_database_related.db_name PDB _pdbx_database_related.db_id 4K3X _pdbx_database_related.details . _pdbx_database_related.content_type unspecified # _pdbx_database_status.status_code REL _pdbx_database_status.entry_id 4K3Y _pdbx_database_status.recvd_initial_deposition_date 2013-04-11 _pdbx_database_status.deposit_site RCSB _pdbx_database_status.process_site RCSB _pdbx_database_status.status_code_sf REL _pdbx_database_status.status_code_mr ? _pdbx_database_status.SG_entry ? _pdbx_database_status.status_code_cs ? _pdbx_database_status.methods_development_category ? _pdbx_database_status.pdb_format_compatible Y # loop_ _audit_author.name _audit_author.pdbx_ordinal 'Zhu, X.' 1 'Wilson, I.A.' 2 # _citation.id primary _citation.title 'New world bats harbor diverse influenza a viruses.' _citation.journal_abbrev 'Plos Pathog.' _citation.journal_volume 9 _citation.page_first e1003657 _citation.page_last e1003657 _citation.year 2013 _citation.journal_id_ASTM ? _citation.country US _citation.journal_id_ISSN 1553-7366 _citation.journal_id_CSD ? _citation.book_publisher ? _citation.pdbx_database_id_PubMed 24130481 _citation.pdbx_database_id_DOI 10.1371/journal.ppat.1003657 # loop_ _citation_author.citation_id _citation_author.name _citation_author.ordinal primary 'Tong, S.' 1 primary 'Zhu, X.' 2 primary 'Li, Y.' 3 primary 'Shi, M.' 4 primary 'Zhang, J.' 5 primary 'Bourgeois, M.' 6 primary 'Yang, H.' 7 primary 'Chen, X.' 8 primary 'Recuenco, S.' 9 primary 'Gomez, J.' 10 primary 'Chen, L.M.' 11 primary 'Johnson, A.' 12 primary 'Tao, Y.' 13 primary 'Dreyfus, C.' 14 primary 'Yu, W.' 15 primary 'McBride, R.' 16 primary 'Carney, P.J.' 17 primary 'Gilbert, A.T.' 18 primary 'Chang, J.' 19 primary 'Guo, Z.' 20 primary 'Davis, C.T.' 21 primary 'Paulson, J.C.' 22 primary 'Stevens, J.' 23 primary 'Rupprecht, C.E.' 24 primary 'Holmes, E.C.' 25 primary 'Wilson, I.A.' 26 primary 'Donis, R.O.' 27 # _cell.entry_id 4K3Y _cell.length_a 181.290 _cell.length_b 181.290 _cell.length_c 136.597 _cell.angle_alpha 90.00 _cell.angle_beta 90.00 _cell.angle_gamma 120.00 _cell.Z_PDB 24 _cell.pdbx_unique_axis ? _cell.length_a_esd ? _cell.length_b_esd ? _cell.length_c_esd ? _cell.angle_alpha_esd ? _cell.angle_beta_esd ? _cell.angle_gamma_esd ? # _symmetry.entry_id 4K3Y _symmetry.space_group_name_H-M 'P 61' _symmetry.pdbx_full_space_group_name_H-M ? _symmetry.cell_setting ? _symmetry.Int_Tables_number 169 _symmetry.space_group_name_Hall ? # loop_ _entity.id _entity.type _entity.src_method _entity.pdbx_description _entity.formula_weight _entity.pdbx_number_of_molecules _entity.pdbx_ec _entity.pdbx_mutation _entity.pdbx_fragment _entity.details 1 polymer man neuraminidase 40294.918 4 ? ? ectodomain ? 2 non-polymer man N-ACETYL-D-GLUCOSAMINE 221.208 12 ? ? ? ? 3 non-polymer man BETA-D-MANNOSE 180.156 3 ? ? ? ? 4 non-polymer syn 'CALCIUM ION' 40.078 4 ? ? ? ? 5 non-polymer man ALPHA-L-FUCOSE 164.156 1 ? ? ? ? 6 non-polymer man ALPHA-D-MANNOSE 180.156 1 ? ? ? ? 7 water nat water 18.015 117 ? ? ? ? # _entity_poly.entity_id 1 _entity_poly.type 'polypeptide(L)' _entity_poly.nstd_linkage no _entity_poly.nstd_monomer no _entity_poly.pdbx_seq_one_letter_code ;GSPSRATPLVLGENLCSINGWVPTYRGEGTTGKIPDEQMLTRQNFVSCSDKECRRFFVSMGYGTTTNFADLIVSEQMNVY SVKLGDPPTPDKLKFEAVGWSASSCHDGFQWTVLSVAGDGFVSILYGGIITDTIHPTNGGPLRTQASSCICNDGTCYTII ADGTTYTASSHRLYRLVNGTSAGWKALDTTGFNFEFPTCYYTSGKVKCTGTNLWNDAKRPFLEFDQSFTYTFKEPCLGFL GDTPRGIDTTNYCDKTTTEGEGGIQGFMIEGSNSWIGRIINPGSKKGFEIYKFLGTLFSVQTVGNRNYQLLSNSTIGRSG LYQPAYESRDCQELCFWIEIAATTKAGLSSNDLITFCGTGGSMPDVNWG ; _entity_poly.pdbx_seq_one_letter_code_can ;GSPSRATPLVLGENLCSINGWVPTYRGEGTTGKIPDEQMLTRQNFVSCSDKECRRFFVSMGYGTTTNFADLIVSEQMNVY SVKLGDPPTPDKLKFEAVGWSASSCHDGFQWTVLSVAGDGFVSILYGGIITDTIHPTNGGPLRTQASSCICNDGTCYTII ADGTTYTASSHRLYRLVNGTSAGWKALDTTGFNFEFPTCYYTSGKVKCTGTNLWNDAKRPFLEFDQSFTYTFKEPCLGFL GDTPRGIDTTNYCDKTTTEGEGGIQGFMIEGSNSWIGRIINPGSKKGFEIYKFLGTLFSVQTVGNRNYQLLSNSTIGRSG LYQPAYESRDCQELCFWIEIAATTKAGLSSNDLITFCGTGGSMPDVNWG ; _entity_poly.pdbx_strand_id A,B,C,D _entity_poly.pdbx_target_identifier ? # loop_ _entity_poly_seq.entity_id _entity_poly_seq.num _entity_poly_seq.mon_id _entity_poly_seq.hetero 1 1 GLY n 1 2 SER n 1 3 PRO n 1 4 SER n 1 5 ARG n 1 6 ALA n 1 7 THR n 1 8 PRO n 1 9 LEU n 1 10 VAL n 1 11 LEU n 1 12 GLY n 1 13 GLU n 1 14 ASN n 1 15 LEU n 1 16 CYS n 1 17 SER n 1 18 ILE n 1 19 ASN n 1 20 GLY n 1 21 TRP n 1 22 VAL n 1 23 PRO n 1 24 THR n 1 25 TYR n 1 26 ARG n 1 27 GLY n 1 28 GLU n 1 29 GLY n 1 30 THR n 1 31 THR n 1 32 GLY n 1 33 LYS n 1 34 ILE n 1 35 PRO n 1 36 ASP n 1 37 GLU n 1 38 GLN n 1 39 MET n 1 40 LEU n 1 41 THR n 1 42 ARG n 1 43 GLN n 1 44 ASN n 1 45 PHE n 1 46 VAL n 1 47 SER n 1 48 CYS n 1 49 SER n 1 50 ASP n 1 51 LYS n 1 52 GLU n 1 53 CYS n 1 54 ARG n 1 55 ARG n 1 56 PHE n 1 57 PHE n 1 58 VAL n 1 59 SER n 1 60 MET n 1 61 GLY n 1 62 TYR n 1 63 GLY n 1 64 THR n 1 65 THR n 1 66 THR n 1 67 ASN n 1 68 PHE n 1 69 ALA n 1 70 ASP n 1 71 LEU n 1 72 ILE n 1 73 VAL n 1 74 SER n 1 75 GLU n 1 76 GLN n 1 77 MET n 1 78 ASN n 1 79 VAL n 1 80 TYR n 1 81 SER n 1 82 VAL n 1 83 LYS n 1 84 LEU n 1 85 GLY n 1 86 ASP n 1 87 PRO n 1 88 PRO n 1 89 THR n 1 90 PRO n 1 91 ASP n 1 92 LYS n 1 93 LEU n 1 94 LYS n 1 95 PHE n 1 96 GLU n 1 97 ALA n 1 98 VAL n 1 99 GLY n 1 100 TRP n 1 101 SER n 1 102 ALA n 1 103 SER n 1 104 SER n 1 105 CYS n 1 106 HIS n 1 107 ASP n 1 108 GLY n 1 109 PHE n 1 110 GLN n 1 111 TRP n 1 112 THR n 1 113 VAL n 1 114 LEU n 1 115 SER n 1 116 VAL n 1 117 ALA n 1 118 GLY n 1 119 ASP n 1 120 GLY n 1 121 PHE n 1 122 VAL n 1 123 SER n 1 124 ILE n 1 125 LEU n 1 126 TYR n 1 127 GLY n 1 128 GLY n 1 129 ILE n 1 130 ILE n 1 131 THR n 1 132 ASP n 1 133 THR n 1 134 ILE n 1 135 HIS n 1 136 PRO n 1 137 THR n 1 138 ASN n 1 139 GLY n 1 140 GLY n 1 141 PRO n 1 142 LEU n 1 143 ARG n 1 144 THR n 1 145 GLN n 1 146 ALA n 1 147 SER n 1 148 SER n 1 149 CYS n 1 150 ILE n 1 151 CYS n 1 152 ASN n 1 153 ASP n 1 154 GLY n 1 155 THR n 1 156 CYS n 1 157 TYR n 1 158 THR n 1 159 ILE n 1 160 ILE n 1 161 ALA n 1 162 ASP n 1 163 GLY n 1 164 THR n 1 165 THR n 1 166 TYR n 1 167 THR n 1 168 ALA n 1 169 SER n 1 170 SER n 1 171 HIS n 1 172 ARG n 1 173 LEU n 1 174 TYR n 1 175 ARG n 1 176 LEU n 1 177 VAL n 1 178 ASN n 1 179 GLY n 1 180 THR n 1 181 SER n 1 182 ALA n 1 183 GLY n 1 184 TRP n 1 185 LYS n 1 186 ALA n 1 187 LEU n 1 188 ASP n 1 189 THR n 1 190 THR n 1 191 GLY n 1 192 PHE n 1 193 ASN n 1 194 PHE n 1 195 GLU n 1 196 PHE n 1 197 PRO n 1 198 THR n 1 199 CYS n 1 200 TYR n 1 201 TYR n 1 202 THR n 1 203 SER n 1 204 GLY n 1 205 LYS n 1 206 VAL n 1 207 LYS n 1 208 CYS n 1 209 THR n 1 210 GLY n 1 211 THR n 1 212 ASN n 1 213 LEU n 1 214 TRP n 1 215 ASN n 1 216 ASP n 1 217 ALA n 1 218 LYS n 1 219 ARG n 1 220 PRO n 1 221 PHE n 1 222 LEU n 1 223 GLU n 1 224 PHE n 1 225 ASP n 1 226 GLN n 1 227 SER n 1 228 PHE n 1 229 THR n 1 230 TYR n 1 231 THR n 1 232 PHE n 1 233 LYS n 1 234 GLU n 1 235 PRO n 1 236 CYS n 1 237 LEU n 1 238 GLY n 1 239 PHE n 1 240 LEU n 1 241 GLY n 1 242 ASP n 1 243 THR n 1 244 PRO n 1 245 ARG n 1 246 GLY n 1 247 ILE n 1 248 ASP n 1 249 THR n 1 250 THR n 1 251 ASN n 1 252 TYR n 1 253 CYS n 1 254 ASP n 1 255 LYS n 1 256 THR n 1 257 THR n 1 258 THR n 1 259 GLU n 1 260 GLY n 1 261 GLU n 1 262 GLY n 1 263 GLY n 1 264 ILE n 1 265 GLN n 1 266 GLY n 1 267 PHE n 1 268 MET n 1 269 ILE n 1 270 GLU n 1 271 GLY n 1 272 SER n 1 273 ASN n 1 274 SER n 1 275 TRP n 1 276 ILE n 1 277 GLY n 1 278 ARG n 1 279 ILE n 1 280 ILE n 1 281 ASN n 1 282 PRO n 1 283 GLY n 1 284 SER n 1 285 LYS n 1 286 LYS n 1 287 GLY n 1 288 PHE n 1 289 GLU n 1 290 ILE n 1 291 TYR n 1 292 LYS n 1 293 PHE n 1 294 LEU n 1 295 GLY n 1 296 THR n 1 297 LEU n 1 298 PHE n 1 299 SER n 1 300 VAL n 1 301 GLN n 1 302 THR n 1 303 VAL n 1 304 GLY n 1 305 ASN n 1 306 ARG n 1 307 ASN n 1 308 TYR n 1 309 GLN n 1 310 LEU n 1 311 LEU n 1 312 SER n 1 313 ASN n 1 314 SER n 1 315 THR n 1 316 ILE n 1 317 GLY n 1 318 ARG n 1 319 SER n 1 320 GLY n 1 321 LEU n 1 322 TYR n 1 323 GLN n 1 324 PRO n 1 325 ALA n 1 326 TYR n 1 327 GLU n 1 328 SER n 1 329 ARG n 1 330 ASP n 1 331 CYS n 1 332 GLN n 1 333 GLU n 1 334 LEU n 1 335 CYS n 1 336 PHE n 1 337 TRP n 1 338 ILE n 1 339 GLU n 1 340 ILE n 1 341 ALA n 1 342 ALA n 1 343 THR n 1 344 THR n 1 345 LYS n 1 346 ALA n 1 347 GLY n 1 348 LEU n 1 349 SER n 1 350 SER n 1 351 ASN n 1 352 ASP n 1 353 LEU n 1 354 ILE n 1 355 THR n 1 356 PHE n 1 357 CYS n 1 358 GLY n 1 359 THR n 1 360 GLY n 1 361 GLY n 1 362 SER n 1 363 MET n 1 364 PRO n 1 365 ASP n 1 366 VAL n 1 367 ASN n 1 368 TRP n 1 369 GLY n # _entity_src_gen.entity_id 1 _entity_src_gen.pdbx_src_id 1 _entity_src_gen.pdbx_alt_source_flag sample _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 'A/flat-faced bat/Peru/033/2010(H18N11)' _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 'Influenza A virus' _entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id 11320 _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 'cabbage looper' _entity_src_gen.pdbx_host_org_scientific_name 'Trichoplusia ni' _entity_src_gen.pdbx_host_org_ncbi_taxonomy_id 7111 _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 HI5 _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 baculovirus _entity_src_gen.pdbx_host_org_vector ? _entity_src_gen.host_org_details ? _entity_src_gen.expression_system_id ? _entity_src_gen.plasmid_name pfastbacHT-A _entity_src_gen.plasmid_details ? _entity_src_gen.pdbx_description ? # _struct_ref.id 1 _struct_ref.db_name PDB _struct_ref.db_code 4K3Y _struct_ref.pdbx_db_accession 4K3Y _struct_ref.entity_id 1 _struct_ref.pdbx_align_begin 1 _struct_ref.pdbx_seq_one_letter_code ;GSPSRATPLVLGENLCSINGWVPTYRGEGTTGKIPDEQMLTRQNFVSCSDKECRRFFVSMGYGTTTNFADLIVSEQMNVY SVKLGDPPTPDKLKFEAVGWSASSCHDGFQWTVLSVAGDGFVSILYGGIITDTIHPTNGGPLRTQASSCICNDGTCYTII ADGTTYTASSHRLYRLVNGTSAGWKALDTTGFNFEFPTCYYTSGKVKCTGTNLWNDAKRPFLEFDQSFTYTFKEPCLGFL GDTPRGIDTTNYCDKTTTEGEGGIQGFMIEGSNSWIGRIINPGSKKGFEIYKFLGTLFSVQTVGNRNYQLLSNSTIGRSG LYQPAYESRDCQELCFWIEIAATTKAGLSSNDLITFCGTGGSMPDVNWG ; _struct_ref.pdbx_db_isoform ? # 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 4K3Y A 1 ? 369 ? 4K3Y 77 ? 459 ? 77 459 2 1 4K3Y B 1 ? 369 ? 4K3Y 77 ? 459 ? 77 459 3 1 4K3Y C 1 ? 369 ? 4K3Y 77 ? 459 ? 77 459 4 1 4K3Y D 1 ? 369 ? 4K3Y 77 ? 459 ? 77 459 # 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 BMA D-saccharide . BETA-D-MANNOSE ? 'C6 H12 O6' 180.156 CA non-polymer . 'CALCIUM ION' ? 'Ca 2' 40.078 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 MAN D-saccharide . ALPHA-D-MANNOSE ? 'C6 H12 O6' 180.156 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.entry_id 4K3Y _exptl.method 'X-RAY DIFFRACTION' _exptl.crystals_number 1 # _exptl_crystal.id 1 _exptl_crystal.density_meas ? _exptl_crystal.density_Matthews 4.02 _exptl_crystal.density_percent_sol 69.40 _exptl_crystal.description ? _exptl_crystal.F_000 ? _exptl_crystal.preparation ? # _exptl_crystal_grow.crystal_id 1 _exptl_crystal_grow.method 'VAPOR DIFFUSION' _exptl_crystal_grow.temp 295 _exptl_crystal_grow.temp_details ? _exptl_crystal_grow.pH 8.0 _exptl_crystal_grow.pdbx_details '0.2 M potassium sulfate, 18% PEG3350, pH 8.0, VAPOR DIFFUSION, temperature 295K' _exptl_crystal_grow.pdbx_pH_range ? # _diffrn.id 1 _diffrn.ambient_temp 100 _diffrn.ambient_temp_details ? _diffrn.crystal_id 1 # _diffrn_detector.diffrn_id 1 _diffrn_detector.detector PIXEL _diffrn_detector.type 'DECTRIS PILATUS 6M' _diffrn_detector.pdbx_collection_date 2012-05-22 _diffrn_detector.details ? # _diffrn_radiation.diffrn_id 1 _diffrn_radiation.wavelength_id 1 _diffrn_radiation.pdbx_monochromatic_or_laue_m_l M _diffrn_radiation.monochromator 'Liquid nitrogen-cooled double crystal Si(111)' _diffrn_radiation.pdbx_diffrn_protocol 'SINGLE WAVELENGTH' _diffrn_radiation.pdbx_scattering_type x-ray # _diffrn_radiation_wavelength.id 1 _diffrn_radiation_wavelength.wavelength 0.97950 _diffrn_radiation_wavelength.wt 1.0 # _diffrn_source.diffrn_id 1 _diffrn_source.source SYNCHROTRON _diffrn_source.type 'SSRL BEAMLINE BL12-2' _diffrn_source.pdbx_synchrotron_site SSRL _diffrn_source.pdbx_synchrotron_beamline BL12-2 _diffrn_source.pdbx_wavelength ? _diffrn_source.pdbx_wavelength_list 0.97950 # _reflns.entry_id 4K3Y _reflns.observed_criterion_sigma_I -3 _reflns.observed_criterion_sigma_F ? _reflns.d_resolution_low 50 _reflns.d_resolution_high 2.68 _reflns.number_obs 70321 _reflns.number_all ? _reflns.percent_possible_obs 98.4 _reflns.pdbx_Rmerge_I_obs ? _reflns.pdbx_Rsym_value 0.08 _reflns.pdbx_netI_over_sigmaI ? _reflns.B_iso_Wilson_estimate ? _reflns.pdbx_redundancy ? _reflns.R_free_details ? _reflns.limit_h_max ? _reflns.limit_h_min ? _reflns.limit_k_max ? _reflns.limit_k_min ? _reflns.limit_l_max ? _reflns.limit_l_min ? _reflns.observed_criterion_F_max ? _reflns.observed_criterion_F_min ? _reflns.pdbx_chi_squared ? _reflns.pdbx_scaling_rejects ? _reflns.pdbx_ordinal 1 _reflns.pdbx_diffrn_id 1 # _reflns_shell.d_res_high 2.68 _reflns_shell.d_res_low 2.73 _reflns_shell.percent_possible_all 99.6 _reflns_shell.Rmerge_I_obs ? _reflns_shell.pdbx_Rsym_value ? _reflns_shell.meanI_over_sigI_obs ? _reflns_shell.pdbx_redundancy ? _reflns_shell.percent_possible_obs ? _reflns_shell.number_unique_all ? _reflns_shell.number_measured_all ? _reflns_shell.number_measured_obs ? _reflns_shell.number_unique_obs ? _reflns_shell.pdbx_chi_squared ? _reflns_shell.pdbx_ordinal 1 _reflns_shell.pdbx_diffrn_id 1 # _refine.entry_id 4K3Y _refine.ls_number_reflns_obs 70273 _refine.ls_number_reflns_all ? _refine.pdbx_ls_sigma_I ? _refine.pdbx_ls_sigma_F 1.35 _refine.pdbx_data_cutoff_high_absF ? _refine.pdbx_data_cutoff_low_absF ? _refine.pdbx_data_cutoff_high_rms_absF ? _refine.ls_d_res_low 48.870 _refine.ls_d_res_high 2.682 _refine.ls_percent_reflns_obs 98.45 _refine.ls_R_factor_obs 0.1804 _refine.ls_R_factor_all ? _refine.ls_R_factor_R_work 0.1783 _refine.ls_R_factor_R_free 0.2195 _refine.ls_R_factor_R_free_error ? _refine.ls_R_factor_R_free_error_details ? _refine.ls_percent_reflns_R_free 5.05 _refine.ls_number_reflns_R_free 3547 _refine.ls_number_parameters ? _refine.ls_number_restraints ? _refine.occupancy_min ? _refine.occupancy_max ? _refine.correlation_coeff_Fo_to_Fc ? _refine.correlation_coeff_Fo_to_Fc_free ? _refine.B_iso_mean ? _refine.aniso_B[1][1] 4.6559 _refine.aniso_B[2][2] 4.6559 _refine.aniso_B[3][3] -9.3119 _refine.aniso_B[1][2] -0.0000 _refine.aniso_B[1][3] -0.0000 _refine.aniso_B[2][3] -0.0000 _refine.solvent_model_details 'FLAT BULK SOLVENT MODEL' _refine.solvent_model_param_ksol 0.320 _refine.solvent_model_param_bsol 44.547 _refine.pdbx_solvent_vdw_probe_radii 1.00 _refine.pdbx_solvent_ion_probe_radii ? _refine.pdbx_solvent_shrinkage_radii 0.73 _refine.pdbx_ls_cross_valid_method THROUGHOUT _refine.details ? _refine.pdbx_starting_model 'PDB ENTRY 4GDI' _refine.pdbx_method_to_determine_struct 'MOLECULAR REPLACEMENT' _refine.pdbx_isotropic_thermal_model ? _refine.pdbx_stereochemistry_target_values ML _refine.pdbx_stereochem_target_val_spec_case ? _refine.pdbx_R_Free_selection_details RANDOM _refine.pdbx_overall_ESU_R ? _refine.pdbx_overall_ESU_R_Free ? _refine.overall_SU_ML 0.93 _refine.pdbx_overall_phase_error 24.06 _refine.overall_SU_B ? _refine.overall_SU_R_Cruickshank_DPI ? _refine.ls_redundancy_reflns_obs ? _refine.B_iso_min ? _refine.B_iso_max ? _refine.overall_SU_R_free ? _refine.ls_wR_factor_R_free ? _refine.ls_wR_factor_R_work ? _refine.overall_FOM_free_R_set ? _refine.overall_FOM_work_R_set ? _refine.pdbx_diffrn_id 1 _refine.pdbx_refine_id 'X-RAY DIFFRACTION' _refine.pdbx_TLS_residual_ADP_flag ? _refine.pdbx_overall_SU_R_free_Cruickshank_DPI ? _refine.pdbx_overall_SU_R_Blow_DPI ? _refine.pdbx_overall_SU_R_free_Blow_DPI ? # _refine_hist.pdbx_refine_id 'X-RAY DIFFRACTION' _refine_hist.cycle_id LAST _refine_hist.pdbx_number_atoms_protein 10896 _refine_hist.pdbx_number_atoms_nucleic_acid 0 _refine_hist.pdbx_number_atoms_ligand 226 _refine_hist.number_atoms_solvent 117 _refine_hist.number_atoms_total 11239 _refine_hist.d_res_high 2.682 _refine_hist.d_res_low 48.870 # loop_ _refine_ls_restr.type _refine_ls_restr.dev_ideal _refine_ls_restr.dev_ideal_target _refine_ls_restr.weight _refine_ls_restr.number _refine_ls_restr.pdbx_restraint_function _refine_ls_restr.pdbx_refine_id f_bond_d 0.009 ? ? 11431 ? 'X-RAY DIFFRACTION' f_angle_d 1.258 ? ? 15504 ? 'X-RAY DIFFRACTION' f_dihedral_angle_d 21.503 ? ? 4096 ? 'X-RAY DIFFRACTION' f_chiral_restr 0.086 ? ? 1719 ? 'X-RAY DIFFRACTION' f_plane_restr 0.005 ? ? 1973 ? 'X-RAY DIFFRACTION' # loop_ _refine_ls_shell.pdbx_total_number_of_bins_used _refine_ls_shell.d_res_high _refine_ls_shell.d_res_low _refine_ls_shell.number_reflns_R_work _refine_ls_shell.R_factor_R_work _refine_ls_shell.percent_reflns_obs _refine_ls_shell.R_factor_R_free _refine_ls_shell.R_factor_R_free_error _refine_ls_shell.percent_reflns_R_free _refine_ls_shell.number_reflns_R_free _refine_ls_shell.number_reflns_all _refine_ls_shell.R_factor_all _refine_ls_shell.number_reflns_obs _refine_ls_shell.redundancy_reflns_obs _refine_ls_shell.pdbx_refine_id . 2.682 2.7183 2647 0.3539 99.0 0.4022 . . 135 . . . . 'X-RAY DIFFRACTION' . 2.7183 2.7571 2680 0.3166 100.0 0.4088 . . 170 . . . . 'X-RAY DIFFRACTION' . 2.7571 2.7983 2670 0.2987 99.0 0.3917 . . 139 . . . . 'X-RAY DIFFRACTION' . 2.7983 2.8420 2712 0.2790 100.0 0.3225 . . 135 . . . . 'X-RAY DIFFRACTION' . 2.8420 2.8886 2666 0.2602 99.0 0.3383 . . 138 . . . . 'X-RAY DIFFRACTION' . 2.8886 2.9384 2697 0.2735 100.0 0.3719 . . 145 . . . . 'X-RAY DIFFRACTION' . 2.9384 2.9918 2647 0.2532 98.0 0.2978 . . 148 . . . . 'X-RAY DIFFRACTION' . 2.9918 3.0494 2666 0.2417 98.0 0.3069 . . 133 . . . . 'X-RAY DIFFRACTION' . 3.0494 3.1116 2630 0.2229 97.0 0.3249 . . 150 . . . . 'X-RAY DIFFRACTION' . 3.1116 3.1792 2674 0.2144 99.0 0.2689 . . 148 . . . . 'X-RAY DIFFRACTION' . 3.1792 3.2532 2688 0.2011 100.0 0.2834 . . 135 . . . . 'X-RAY DIFFRACTION' . 3.2532 3.3345 2695 0.1994 100.0 0.2466 . . 148 . . . . 'X-RAY DIFFRACTION' . 3.3345 3.4246 2686 0.1887 99.0 0.2520 . . 144 . . . . 'X-RAY DIFFRACTION' . 3.4246 3.5254 2670 0.1796 99.0 0.1969 . . 157 . . . . 'X-RAY DIFFRACTION' . 3.5254 3.6391 2672 0.1730 99.0 0.2168 . . 136 . . . . 'X-RAY DIFFRACTION' . 3.6391 3.7692 2631 0.1690 96.0 0.2220 . . 121 . . . . 'X-RAY DIFFRACTION' . 3.7692 3.9200 2649 0.1570 98.0 0.1858 . . 138 . . . . 'X-RAY DIFFRACTION' . 3.9200 4.0983 2705 0.1477 100.0 0.1843 . . 144 . . . . 'X-RAY DIFFRACTION' . 4.0983 4.3143 2700 0.1382 99.0 0.1644 . . 126 . . . . 'X-RAY DIFFRACTION' . 4.3143 4.5844 2678 0.1155 99.0 0.1333 . . 146 . . . . 'X-RAY DIFFRACTION' . 4.5844 4.9381 2639 0.1242 96.0 0.1813 . . 136 . . . . 'X-RAY DIFFRACTION' . 4.9381 5.4344 2660 0.1424 97.0 0.1730 . . 143 . . . . 'X-RAY DIFFRACTION' . 5.4344 6.2194 2702 0.1696 99.0 0.2157 . . 142 . . . . 'X-RAY DIFFRACTION' . 6.2194 7.8306 2588 0.1951 94.0 0.2336 . . 134 . . . . 'X-RAY DIFFRACTION' . 7.8306 48.8781 2674 0.1867 97.0 0.1934 . . 156 . . . . 'X-RAY DIFFRACTION' # _struct.entry_id 4K3Y _struct.title 'Crystal structure of a subtype N11 neuraminidase-like protein of A/flat-faced bat/Peru/033/2010 (H18N11)' _struct.pdbx_descriptor neuraminidase _struct.pdbx_model_details ? _struct.pdbx_CASP_flag ? _struct.pdbx_model_type_details ? # _struct_keywords.entry_id 4K3Y _struct_keywords.pdbx_keywords 'VIRAL PROTEIN' _struct_keywords.text 'influenza virus, neuraminidase-like, N11, beta propeller, 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 1 ? E N N 2 ? F N N 2 ? G N N 3 ? H N N 4 ? I N N 2 ? J N N 2 ? K N N 2 ? L N N 2 ? M N N 4 ? N N N 2 ? O N N 2 ? P N N 2 ? Q N N 5 ? R N N 2 ? S N N 3 ? T N N 6 ? U N N 4 ? V N N 2 ? W N N 2 ? X N N 3 ? Y N N 4 ? Z N N 7 ? AA N N 7 ? BA N N 7 ? CA N N 7 ? # _struct_biol.id 1 _struct_biol.details ? # loop_ _struct_conf.conf_type_id _struct_conf.id _struct_conf.pdbx_PDB_helix_id _struct_conf.beg_label_comp_id _struct_conf.beg_label_asym_id _struct_conf.beg_label_seq_id _struct_conf.pdbx_beg_PDB_ins_code _struct_conf.end_label_comp_id _struct_conf.end_label_asym_id _struct_conf.end_label_seq_id _struct_conf.pdbx_end_PDB_ins_code _struct_conf.beg_auth_comp_id _struct_conf.beg_auth_asym_id _struct_conf.beg_auth_seq_id _struct_conf.end_auth_comp_id _struct_conf.end_auth_asym_id _struct_conf.end_auth_seq_id _struct_conf.pdbx_PDB_helix_class _struct_conf.details _struct_conf.pdbx_PDB_helix_length HELX_P HELX_P1 1 GLU A 28 ? GLY A 32 ? GLU A 104 GLY A 108 5 ? 5 HELX_P HELX_P2 2 THR A 89 ? LEU A 93 ? THR A 168 LEU A 171 5 ? 5 HELX_P HELX_P3 3 THR A 165 ? SER A 169 ? THR A 246 SER A 250 5 ? 5 HELX_P HELX_P4 4 GLU C 28 ? THR C 31 ? GLU C 104 THR C 107 5 ? 4 HELX_P HELX_P5 5 THR C 89 ? LEU C 93 ? THR C 168 LEU C 171 5 ? 5 HELX_P HELX_P6 6 THR C 165 ? SER C 169 ? THR C 246 SER C 250 5 ? 5 HELX_P HELX_P7 7 THR D 89 ? LEU D 93 ? THR D 168 LEU D 171 5 ? 5 # _struct_conf_type.id HELX_P _struct_conf_type.criteria ? _struct_conf_type.reference ? # loop_ _struct_conn.id _struct_conn.conn_type_id _struct_conn.pdbx_leaving_atom_flag _struct_conn.pdbx_PDB_id _struct_conn.ptnr1_label_asym_id _struct_conn.ptnr1_label_comp_id _struct_conn.ptnr1_label_seq_id _struct_conn.ptnr1_label_atom_id _struct_conn.pdbx_ptnr1_label_alt_id _struct_conn.pdbx_ptnr1_PDB_ins_code _struct_conn.pdbx_ptnr1_standard_comp_id _struct_conn.ptnr1_symmetry _struct_conn.ptnr2_label_asym_id _struct_conn.ptnr2_label_comp_id _struct_conn.ptnr2_label_seq_id _struct_conn.ptnr2_label_atom_id _struct_conn.pdbx_ptnr2_label_alt_id _struct_conn.pdbx_ptnr2_PDB_ins_code _struct_conn.ptnr1_auth_asym_id _struct_conn.ptnr1_auth_comp_id _struct_conn.ptnr1_auth_seq_id _struct_conn.ptnr2_auth_asym_id _struct_conn.ptnr2_auth_comp_id _struct_conn.ptnr2_auth_seq_id _struct_conn.ptnr2_symmetry _struct_conn.pdbx_ptnr3_label_atom_id _struct_conn.pdbx_ptnr3_label_seq_id _struct_conn.pdbx_ptnr3_label_comp_id _struct_conn.pdbx_ptnr3_label_asym_id _struct_conn.pdbx_ptnr3_label_alt_id _struct_conn.pdbx_ptnr3_PDB_ins_code _struct_conn.details _struct_conn.pdbx_dist_value _struct_conn.pdbx_value_order disulf1 disulf ? ? A CYS 16 SG ? ? ? 1_555 A CYS 331 SG ? ? A CYS 92 A CYS 417 1_555 ? ? ? ? ? ? ? 2.034 ? disulf2 disulf ? ? A CYS 48 SG ? ? ? 1_555 A CYS 53 SG ? ? A CYS 124 A CYS 129 1_555 ? ? ? ? ? ? ? 2.064 ? disulf3 disulf ? ? A CYS 105 SG ? ? ? 1_555 A CYS 149 SG ? ? A CYS 183 A CYS 230 1_555 ? ? ? ? ? ? ? 2.041 ? disulf4 disulf ? ? A CYS 151 SG ? ? ? 1_555 A CYS 156 SG ? ? A CYS 232 A CYS 237 1_555 ? ? ? ? ? ? ? 2.039 ? disulf5 disulf ? ? A CYS 199 SG ? ? ? 1_555 A CYS 208 SG ? ? A CYS 280 A CYS 289 1_555 ? ? ? ? ? ? ? 2.071 ? disulf6 disulf ? ? A CYS 236 SG ? ? ? 1_555 A CYS 253 SG ? ? A CYS 318 A CYS 337 1_555 ? ? ? ? ? ? ? 2.043 ? disulf7 disulf ? ? A CYS 335 SG ? ? ? 1_555 A CYS 357 SG ? ? A CYS 421 A CYS 447 1_555 ? ? ? ? ? ? ? 2.066 ? disulf8 disulf ? ? B CYS 16 SG ? ? ? 1_555 B CYS 331 SG ? ? B CYS 92 B CYS 417 1_555 ? ? ? ? ? ? ? 2.040 ? disulf9 disulf ? ? B CYS 48 SG ? ? ? 1_555 B CYS 53 SG ? ? B CYS 124 B CYS 129 1_555 ? ? ? ? ? ? ? 2.043 ? disulf10 disulf ? ? B CYS 105 SG ? ? ? 1_555 B CYS 149 SG ? ? B CYS 183 B CYS 230 1_555 ? ? ? ? ? ? ? 2.051 ? disulf11 disulf ? ? B CYS 151 SG ? ? ? 1_555 B CYS 156 SG ? ? B CYS 232 B CYS 237 1_555 ? ? ? ? ? ? ? 2.049 ? disulf12 disulf ? ? B CYS 199 SG ? ? ? 1_555 B CYS 208 SG ? ? B CYS 280 B CYS 289 1_555 ? ? ? ? ? ? ? 2.058 ? disulf13 disulf ? ? B CYS 236 SG ? ? ? 1_555 B CYS 253 SG ? ? B CYS 318 B CYS 337 1_555 ? ? ? ? ? ? ? 2.039 ? disulf14 disulf ? ? B CYS 335 SG ? ? ? 1_555 B CYS 357 SG ? ? B CYS 421 B CYS 447 1_555 ? ? ? ? ? ? ? 2.056 ? disulf15 disulf ? ? C CYS 16 SG ? ? ? 1_555 C CYS 331 SG ? ? C CYS 92 C CYS 417 1_555 ? ? ? ? ? ? ? 2.043 ? disulf16 disulf ? ? C CYS 48 SG ? ? ? 1_555 C CYS 53 SG ? ? C CYS 124 C CYS 129 1_555 ? ? ? ? ? ? ? 2.063 ? disulf17 disulf ? ? C CYS 105 SG ? ? ? 1_555 C CYS 149 SG ? ? C CYS 183 C CYS 230 1_555 ? ? ? ? ? ? ? 2.009 ? disulf18 disulf ? ? C CYS 151 SG ? ? ? 1_555 C CYS 156 SG ? ? C CYS 232 C CYS 237 1_555 ? ? ? ? ? ? ? 2.027 ? disulf19 disulf ? ? C CYS 199 SG ? ? ? 1_555 C CYS 208 SG ? ? C CYS 280 C CYS 289 1_555 ? ? ? ? ? ? ? 2.132 ? disulf20 disulf ? ? C CYS 236 SG ? ? ? 1_555 C CYS 253 SG ? ? C CYS 318 C CYS 337 1_555 ? ? ? ? ? ? ? 2.039 ? disulf21 disulf ? ? C CYS 335 SG ? ? ? 1_555 C CYS 357 SG ? ? C CYS 421 C CYS 447 1_555 ? ? ? ? ? ? ? 2.046 ? disulf22 disulf ? ? D CYS 16 SG ? ? ? 1_555 D CYS 331 SG ? ? D CYS 92 D CYS 417 1_555 ? ? ? ? ? ? ? 1.995 ? disulf23 disulf ? ? D CYS 48 SG ? ? ? 1_555 D CYS 53 SG ? ? D CYS 124 D CYS 129 1_555 ? ? ? ? ? ? ? 2.051 ? disulf24 disulf ? ? D CYS 105 SG ? ? ? 1_555 D CYS 149 SG ? ? D CYS 183 D CYS 230 1_555 ? ? ? ? ? ? ? 2.039 ? disulf25 disulf ? ? D CYS 151 SG ? ? ? 1_555 D CYS 156 SG ? ? D CYS 232 D CYS 237 1_555 ? ? ? ? ? ? ? 2.033 ? disulf26 disulf ? ? D CYS 199 SG ? ? ? 1_555 D CYS 208 SG ? ? D CYS 280 D CYS 289 1_555 ? ? ? ? ? ? ? 2.040 ? disulf27 disulf ? ? D CYS 236 SG ? ? ? 1_555 D CYS 253 SG ? ? D CYS 318 D CYS 337 1_555 ? ? ? ? ? ? ? 2.033 ? disulf28 disulf ? ? D CYS 335 SG ? ? ? 1_555 D CYS 357 SG ? ? D CYS 421 D CYS 447 1_555 ? ? ? ? ? ? ? 2.053 ? covale1 covale ? ? A ASN 178 ND2 ? ? ? 1_555 E NAG . C1 ? ? A ASN 259 A NAG 601 1_555 ? ? ? ? ? ? ? 1.392 ? covale2 covale ? ? E NAG . O4 ? ? ? 1_555 F NAG . C1 ? ? A NAG 601 A NAG 602 1_555 ? ? ? ? ? ? ? 1.432 ? covale3 covale ? ? P NAG . O4 ? ? ? 1_555 R NAG . C1 ? ? C NAG 603 C NAG 605 1_555 ? ? ? ? ? ? ? 1.433 ? covale4 covale ? ? P NAG . O6 ? ? ? 1_555 Q FUC . C1 ? ? C NAG 603 C FUC 604 1_555 ? ? ? ? ? ? ? 1.437 ? covale5 covale ? ? N NAG . O4 ? ? ? 1_555 O NAG . C1 ? ? C NAG 601 C NAG 602 1_555 ? ? ? ? ? ? ? 1.440 ? covale6 covale ? ? K NAG . O4 ? ? ? 1_555 L NAG . C1 ? ? B NAG 603 B NAG 604 1_555 ? ? ? ? ? ? ? 1.441 ? covale7 covale ? ? D ASN 178 ND2 ? ? ? 1_555 V NAG . C1 ? ? D ASN 259 D NAG 601 1_555 ? ? ? ? ? ? ? 1.441 ? covale8 covale ? ? I NAG . O4 ? ? ? 1_555 J NAG . C1 ? ? B NAG 601 B NAG 602 1_555 ? ? ? ? ? ? ? 1.441 ? covale9 covale ? ? C ASN 313 ND2 ? ? ? 1_555 P NAG . C1 ? ? C ASN 401 C NAG 603 1_555 ? ? ? ? ? ? ? 1.442 ? covale10 covale ? ? V NAG . O4 ? ? ? 1_555 W NAG . C1 ? ? D NAG 601 D NAG 602 1_555 ? ? ? ? ? ? ? 1.443 ? covale11 covale ? ? B ASN 313 ND2 ? ? ? 1_555 K NAG . C1 ? ? B ASN 401 B NAG 603 1_555 ? ? ? ? ? ? ? 1.443 ? covale12 covale ? ? S BMA . O3 ? ? ? 1_555 T MAN . C1 ? ? C BMA 606 C MAN 607 1_555 ? ? ? ? ? ? ? 1.443 ? covale13 covale ? ? C ASN 178 ND2 ? ? ? 1_555 N NAG . C1 ? ? C ASN 259 C NAG 601 1_555 ? ? ? ? ? ? ? 1.443 ? covale14 covale ? ? B ASN 178 ND2 ? ? ? 1_555 I NAG . C1 ? ? B ASN 259 B NAG 601 1_555 ? ? ? ? ? ? ? 1.444 ? covale15 covale ? ? R NAG . O4 ? ? ? 1_555 S BMA . C1 ? ? C NAG 605 C BMA 606 1_555 ? ? ? ? ? ? ? 1.446 ? covale16 covale ? ? F NAG . O4 ? ? ? 1_555 G BMA . C1 ? ? A NAG 602 A BMA 603 1_555 ? ? ? ? ? ? ? 1.454 ? covale17 covale ? ? W NAG . O4 ? ? ? 1_555 X BMA . C1 ? ? D NAG 602 D BMA 603 1_555 ? ? ? ? ? ? ? 1.454 ? metalc1 metalc ? ? D ASN 212 O ? ? ? 1_555 Y CA . CA ? ? D ASN 293 D CA 604 1_555 ? ? ? ? ? ? ? 1.931 ? metalc2 metalc ? ? D ASP 216 O ? ? ? 1_555 Y CA . CA ? ? D ASP 297 D CA 604 1_555 ? ? ? ? ? ? ? 2.366 ? metalc3 metalc ? ? D ASP 242 OD2 ? ? ? 1_555 Y CA . CA ? ? D ASP 324 D CA 604 1_555 ? ? ? ? ? ? ? 2.509 ? metalc4 metalc ? ? D GLY 262 O ? ? ? 1_555 Y CA . CA ? ? D GLY 347 D CA 604 1_555 ? ? ? ? ? ? ? 2.755 ? metalc5 metalc ? ? B ASN 212 O ? ? ? 1_555 M CA . CA ? ? B ASN 293 B CA 605 1_555 ? ? ? ? ? ? ? 2.785 ? metalc6 metalc ? ? C GLY 262 O ? ? ? 1_555 U CA . CA ? ? C GLY 347 C CA 608 1_555 ? ? ? ? ? ? ? 2.798 ? metalc7 metalc ? ? A ASP 216 O ? ? ? 1_555 H CA . CA ? ? A ASP 297 A CA 604 1_555 ? ? ? ? ? ? ? 2.824 ? metalc8 metalc ? ? A ASN 212 O ? ? ? 1_555 H CA . CA ? ? A ASN 293 A CA 604 1_555 ? ? ? ? ? ? ? 2.832 ? metalc9 metalc ? ? A GLY 262 O ? ? ? 1_555 H CA . CA ? ? A GLY 347 A CA 604 1_555 ? ? ? ? ? ? ? 2.848 ? metalc10 metalc ? ? C ASN 212 O ? ? ? 1_555 U CA . CA ? ? C ASN 293 C CA 608 1_555 ? ? ? ? ? ? ? 2.849 ? metalc11 metalc ? ? C ASP 216 O ? ? ? 1_555 U CA . CA ? ? C ASP 297 C CA 608 1_555 ? ? ? ? ? ? ? 2.863 ? metalc12 metalc ? ? B GLY 262 O ? ? ? 1_555 M CA . CA ? ? B GLY 347 B CA 605 1_555 ? ? ? ? ? ? ? 2.888 ? metalc13 metalc ? ? D GLY 260 O ? ? ? 1_555 Y CA . CA ? ? D GLY 345 D CA 604 1_555 ? ? ? ? ? ? ? 2.909 ? metalc14 metalc ? ? A GLY 260 O ? ? ? 1_555 H CA . CA ? ? A GLY 345 A CA 604 1_555 ? ? ? ? ? ? ? 2.952 ? metalc15 metalc ? ? A ASP 242 OD2 ? ? ? 1_555 H CA . CA ? ? A ASP 324 A CA 604 1_555 ? ? ? ? ? ? ? 2.955 ? metalc16 metalc ? ? B ASP 216 O ? ? ? 1_555 M CA . CA ? ? B ASP 297 B CA 605 1_555 ? ? ? ? ? ? ? 2.967 ? metalc17 metalc ? ? B GLY 260 O ? ? ? 1_555 M CA . CA ? ? B GLY 345 B CA 605 1_555 ? ? ? ? ? ? ? 2.977 ? metalc18 metalc ? ? C GLY 260 O ? ? ? 1_555 U CA . CA ? ? C GLY 345 C CA 608 1_555 ? ? ? ? ? ? ? 3.016 ? metalc19 metalc ? ? B ASP 242 OD2 ? ? ? 1_555 M CA . CA ? ? B ASP 324 B CA 605 1_555 ? ? ? ? ? ? ? 3.043 ? metalc20 metalc ? ? C ASP 242 OD2 ? ? ? 1_555 U CA . CA ? ? C ASP 324 C CA 608 1_555 ? ? ? ? ? ? ? 3.130 ? # loop_ _struct_conn_type.id _struct_conn_type.criteria _struct_conn_type.reference disulf ? ? covale ? ? metalc ? ? # loop_ _struct_mon_prot_cis.pdbx_id _struct_mon_prot_cis.label_comp_id _struct_mon_prot_cis.label_seq_id _struct_mon_prot_cis.label_asym_id _struct_mon_prot_cis.label_alt_id _struct_mon_prot_cis.pdbx_PDB_ins_code _struct_mon_prot_cis.auth_comp_id _struct_mon_prot_cis.auth_seq_id _struct_mon_prot_cis.auth_asym_id _struct_mon_prot_cis.pdbx_label_comp_id_2 _struct_mon_prot_cis.pdbx_label_seq_id_2 _struct_mon_prot_cis.pdbx_label_asym_id_2 _struct_mon_prot_cis.pdbx_PDB_ins_code_2 _struct_mon_prot_cis.pdbx_auth_comp_id_2 _struct_mon_prot_cis.pdbx_auth_seq_id_2 _struct_mon_prot_cis.pdbx_auth_asym_id_2 _struct_mon_prot_cis.pdbx_PDB_model_num _struct_mon_prot_cis.pdbx_omega_angle 1 GLY 140 A . ? GLY 221 A PRO 141 A ? PRO 222 A 1 -9.16 2 THR 243 A . ? THR 325 A PRO 244 A ? PRO 326 A 1 5.42 3 GLY 140 B . ? GLY 221 B PRO 141 B ? PRO 222 B 1 1.59 4 THR 243 B . ? THR 325 B PRO 244 B ? PRO 326 B 1 3.84 5 GLY 140 C . ? GLY 221 C PRO 141 C ? PRO 222 C 1 3.17 6 THR 243 C . ? THR 325 C PRO 244 C ? PRO 326 C 1 8.32 7 GLY 140 D . ? GLY 221 D PRO 141 D ? PRO 222 D 1 -12.49 8 THR 243 D . ? THR 325 D PRO 244 D ? PRO 326 D 1 9.86 # loop_ _struct_sheet.id _struct_sheet.type _struct_sheet.number_strands _struct_sheet.details A ? 7 ? B ? 4 ? C ? 4 ? D ? 4 ? E ? 4 ? F ? 7 ? G ? 4 ? H ? 4 ? I ? 4 ? J ? 4 ? K ? 7 ? L ? 4 ? M ? 4 ? N ? 4 ? O ? 4 ? P ? 4 ? Q ? 7 ? R ? 4 ? S ? 4 ? T ? 4 ? U ? 4 ? # loop_ _struct_sheet_order.sheet_id _struct_sheet_order.range_id_1 _struct_sheet_order.range_id_2 _struct_sheet_order.offset _struct_sheet_order.sense A 1 2 ? anti-parallel A 2 3 ? anti-parallel A 3 4 ? anti-parallel A 4 5 ? anti-parallel A 5 6 ? anti-parallel A 6 7 ? anti-parallel B 1 2 ? anti-parallel B 2 3 ? anti-parallel B 3 4 ? anti-parallel C 1 2 ? anti-parallel C 2 3 ? anti-parallel C 3 4 ? anti-parallel D 1 2 ? anti-parallel D 2 3 ? anti-parallel D 3 4 ? anti-parallel E 1 2 ? anti-parallel E 2 3 ? anti-parallel E 3 4 ? anti-parallel F 1 2 ? anti-parallel F 2 3 ? anti-parallel F 3 4 ? anti-parallel F 4 5 ? anti-parallel F 5 6 ? anti-parallel F 6 7 ? anti-parallel G 1 2 ? anti-parallel G 2 3 ? anti-parallel G 3 4 ? anti-parallel H 1 2 ? anti-parallel H 2 3 ? anti-parallel H 3 4 ? anti-parallel I 1 2 ? anti-parallel I 2 3 ? anti-parallel I 3 4 ? anti-parallel J 1 2 ? anti-parallel J 2 3 ? anti-parallel J 3 4 ? anti-parallel K 1 2 ? anti-parallel K 2 3 ? anti-parallel K 3 4 ? anti-parallel K 4 5 ? anti-parallel K 5 6 ? anti-parallel K 6 7 ? anti-parallel L 1 2 ? anti-parallel L 2 3 ? anti-parallel L 3 4 ? anti-parallel M 1 2 ? anti-parallel M 2 3 ? anti-parallel M 3 4 ? anti-parallel N 1 2 ? anti-parallel N 2 3 ? anti-parallel N 3 4 ? anti-parallel O 1 2 ? anti-parallel O 2 3 ? anti-parallel O 3 4 ? anti-parallel P 1 2 ? anti-parallel P 2 3 ? anti-parallel P 3 4 ? parallel Q 1 2 ? anti-parallel Q 2 3 ? anti-parallel Q 3 4 ? anti-parallel Q 4 5 ? anti-parallel Q 5 6 ? anti-parallel Q 6 7 ? anti-parallel R 1 2 ? anti-parallel R 2 3 ? anti-parallel R 3 4 ? anti-parallel S 1 2 ? anti-parallel S 2 3 ? anti-parallel S 3 4 ? anti-parallel T 1 2 ? anti-parallel T 2 3 ? anti-parallel T 3 4 ? anti-parallel U 1 2 ? anti-parallel U 2 3 ? anti-parallel U 3 4 ? anti-parallel # loop_ _struct_sheet_range.sheet_id _struct_sheet_range.id _struct_sheet_range.beg_label_comp_id _struct_sheet_range.beg_label_asym_id _struct_sheet_range.beg_label_seq_id _struct_sheet_range.pdbx_beg_PDB_ins_code _struct_sheet_range.end_label_comp_id _struct_sheet_range.end_label_asym_id _struct_sheet_range.end_label_seq_id _struct_sheet_range.pdbx_end_PDB_ins_code _struct_sheet_range.beg_auth_comp_id _struct_sheet_range.beg_auth_asym_id _struct_sheet_range.beg_auth_seq_id _struct_sheet_range.end_auth_comp_id _struct_sheet_range.end_auth_asym_id _struct_sheet_range.end_auth_seq_id A 1 GLY A 20 ? ARG A 26 ? GLY A 96 ARG A 102 A 2 SER A 349 ? THR A 359 ? SER A 439 THR A 449 A 3 CYS A 335 ? THR A 343 ? CYS A 421 THR A 429 A 4 ARG A 306 ? TYR A 322 ? ARG A 393 TYR A 410 A 5 LYS A 286 ? LEU A 294 ? LYS A 372 LEU A 380 A 6 ASN A 273 ? ASN A 281 ? ASN A 359 ASN A 367 A 7 MET A 268 ? ILE A 269 ? MET A 353 ILE A 354 B 1 ARG A 42 ? CYS A 48 ? ARG A 118 CYS A 124 B 2 CYS A 53 ? SER A 59 ? CYS A 129 SER A 135 B 3 ASN A 78 ? LYS A 83 ? ASN A 157 LYS A 162 B 4 LYS A 94 ? VAL A 98 ? LYS A 172 VAL A 176 C 1 SER A 101 ? HIS A 106 ? SER A 179 HIS A 184 C 2 TRP A 111 ? ALA A 117 ? TRP A 189 ALA A 195 C 3 PHE A 121 ? TYR A 126 ? PHE A 202 TYR A 207 C 4 ILE A 129 ? ILE A 134 ? ILE A 210 ILE A 215 D 1 ILE A 150 ? ASN A 152 ? ILE A 231 ASN A 233 D 2 THR A 155 ? ASP A 162 ? THR A 236 ASP A 243 D 3 SER A 170 ? VAL A 177 ? SER A 251 VAL A 258 D 4 THR A 180 ? LEU A 187 ? THR A 261 LEU A 268 E 1 GLU A 195 ? THR A 202 ? GLU A 276 THR A 283 E 2 LYS A 205 ? THR A 211 ? LYS A 286 THR A 292 E 3 PHE A 221 ? PHE A 224 ? PHE A 302 PHE A 305 E 4 TYR A 230 ? LYS A 233 ? TYR A 312 LYS A 315 F 1 GLY B 20 ? ARG B 26 ? GLY B 96 ARG B 102 F 2 SER B 349 ? THR B 359 ? SER B 439 THR B 449 F 3 CYS B 335 ? THR B 343 ? CYS B 421 THR B 429 F 4 ASN B 307 ? TYR B 322 ? ASN B 394 TYR B 410 F 5 LYS B 286 ? LEU B 294 ? LYS B 372 LEU B 380 F 6 ASN B 273 ? ILE B 279 ? ASN B 359 ILE B 365 F 7 MET B 268 ? ILE B 269 ? MET B 353 ILE B 354 G 1 ARG B 42 ? CYS B 48 ? ARG B 118 CYS B 124 G 2 CYS B 53 ? SER B 59 ? CYS B 129 SER B 135 G 3 ASN B 78 ? LYS B 83 ? ASN B 157 LYS B 162 G 4 PHE B 95 ? VAL B 98 ? PHE B 173 VAL B 176 H 1 SER B 101 ? HIS B 106 ? SER B 179 HIS B 184 H 2 TRP B 111 ? ALA B 117 ? TRP B 189 ALA B 195 H 3 PHE B 121 ? TYR B 126 ? PHE B 202 TYR B 207 H 4 ILE B 129 ? ILE B 134 ? ILE B 210 ILE B 215 I 1 ILE B 150 ? ASN B 152 ? ILE B 231 ASN B 233 I 2 THR B 155 ? ASP B 162 ? THR B 236 ASP B 243 I 3 SER B 170 ? VAL B 177 ? SER B 251 VAL B 258 I 4 THR B 180 ? LEU B 187 ? THR B 261 LEU B 268 J 1 GLU B 195 ? THR B 202 ? GLU B 276 THR B 283 J 2 LYS B 205 ? THR B 211 ? LYS B 286 THR B 292 J 3 PHE B 221 ? PHE B 224 ? PHE B 302 PHE B 305 J 4 TYR B 230 ? LYS B 233 ? TYR B 312 LYS B 315 K 1 GLY C 20 ? ARG C 26 ? GLY C 96 ARG C 102 K 2 SER C 349 ? THR C 359 ? SER C 439 THR C 449 K 3 CYS C 335 ? THR C 343 ? CYS C 421 THR C 429 K 4 ARG C 306 ? TYR C 322 ? ARG C 393 TYR C 410 K 5 LYS C 286 ? LEU C 294 ? LYS C 372 LEU C 380 K 6 ASN C 273 ? ASN C 281 ? ASN C 359 ASN C 367 K 7 MET C 268 ? ILE C 269 ? MET C 353 ILE C 354 L 1 LEU C 40 ? CYS C 48 ? LEU C 116 CYS C 124 L 2 CYS C 53 ? GLY C 61 ? CYS C 129 GLY C 137 L 3 ASN C 78 ? LYS C 83 ? ASN C 157 LYS C 162 L 4 LYS C 94 ? VAL C 98 ? LYS C 172 VAL C 176 M 1 SER C 101 ? HIS C 106 ? SER C 179 HIS C 184 M 2 TRP C 111 ? ALA C 117 ? TRP C 189 ALA C 195 M 3 PHE C 121 ? TYR C 126 ? PHE C 202 TYR C 207 M 4 ILE C 129 ? ILE C 134 ? ILE C 210 ILE C 215 N 1 ILE C 150 ? ASN C 152 ? ILE C 231 ASN C 233 N 2 THR C 155 ? ASP C 162 ? THR C 236 ASP C 243 N 3 SER C 170 ? VAL C 177 ? SER C 251 VAL C 258 N 4 THR C 180 ? LEU C 187 ? THR C 261 LEU C 268 O 1 GLU C 195 ? THR C 202 ? GLU C 276 THR C 283 O 2 LYS C 205 ? THR C 211 ? LYS C 286 THR C 292 O 3 PHE C 221 ? PHE C 224 ? PHE C 302 PHE C 305 O 4 TYR C 230 ? LYS C 233 ? TYR C 312 LYS C 315 P 1 GLY D 20 ? ARG D 26 ? GLY D 96 ARG D 102 P 2 SER D 349 ? THR D 359 ? SER D 439 THR D 449 P 3 CYS D 335 ? THR D 344 ? CYS D 421 THR D 430 P 4 LYS D 33 ? ILE D 34 ? LYS D 109 ILE D 110 Q 1 GLY D 20 ? ARG D 26 ? GLY D 96 ARG D 102 Q 2 SER D 349 ? THR D 359 ? SER D 439 THR D 449 Q 3 CYS D 335 ? THR D 344 ? CYS D 421 THR D 430 Q 4 ASN D 307 ? TYR D 322 ? ASN D 394 TYR D 410 Q 5 LYS D 286 ? PHE D 293 ? LYS D 372 PHE D 379 Q 6 SER D 274 ? ILE D 279 ? SER D 360 ILE D 365 Q 7 MET D 268 ? ILE D 269 ? MET D 353 ILE D 354 R 1 ARG D 42 ? CYS D 48 ? ARG D 118 CYS D 124 R 2 CYS D 53 ? SER D 59 ? CYS D 129 SER D 135 R 3 ASN D 78 ? LYS D 83 ? ASN D 157 LYS D 162 R 4 LYS D 94 ? VAL D 98 ? LYS D 172 VAL D 176 S 1 SER D 101 ? HIS D 106 ? SER D 179 HIS D 184 S 2 TRP D 111 ? ALA D 117 ? TRP D 189 ALA D 195 S 3 PHE D 121 ? TYR D 126 ? PHE D 202 TYR D 207 S 4 ILE D 129 ? ILE D 134 ? ILE D 210 ILE D 215 T 1 ILE D 150 ? ASN D 152 ? ILE D 231 ASN D 233 T 2 THR D 155 ? ASP D 162 ? THR D 236 ASP D 243 T 3 SER D 170 ? VAL D 177 ? SER D 251 VAL D 258 T 4 THR D 180 ? LEU D 187 ? THR D 261 LEU D 268 U 1 GLU D 195 ? THR D 202 ? GLU D 276 THR D 283 U 2 LYS D 205 ? THR D 211 ? LYS D 286 THR D 292 U 3 PHE D 221 ? PHE D 224 ? PHE D 302 PHE D 305 U 4 TYR D 230 ? LYS D 233 ? TYR D 312 LYS D 315 # loop_ _pdbx_struct_sheet_hbond.sheet_id _pdbx_struct_sheet_hbond.range_id_1 _pdbx_struct_sheet_hbond.range_id_2 _pdbx_struct_sheet_hbond.range_1_label_atom_id _pdbx_struct_sheet_hbond.range_1_label_comp_id _pdbx_struct_sheet_hbond.range_1_label_asym_id _pdbx_struct_sheet_hbond.range_1_label_seq_id _pdbx_struct_sheet_hbond.range_1_PDB_ins_code _pdbx_struct_sheet_hbond.range_1_auth_atom_id _pdbx_struct_sheet_hbond.range_1_auth_comp_id _pdbx_struct_sheet_hbond.range_1_auth_asym_id _pdbx_struct_sheet_hbond.range_1_auth_seq_id _pdbx_struct_sheet_hbond.range_2_label_atom_id _pdbx_struct_sheet_hbond.range_2_label_comp_id _pdbx_struct_sheet_hbond.range_2_label_asym_id _pdbx_struct_sheet_hbond.range_2_label_seq_id _pdbx_struct_sheet_hbond.range_2_PDB_ins_code _pdbx_struct_sheet_hbond.range_2_auth_atom_id _pdbx_struct_sheet_hbond.range_2_auth_comp_id _pdbx_struct_sheet_hbond.range_2_auth_asym_id _pdbx_struct_sheet_hbond.range_2_auth_seq_id A 1 2 N VAL A 22 ? N VAL A 98 O CYS A 357 ? O CYS A 447 A 2 3 O SER A 350 ? O SER A 440 N ALA A 342 ? N ALA A 428 A 3 4 O GLU A 339 ? O GLU A 425 N ARG A 318 ? N ARG A 406 A 4 5 O ARG A 306 ? O ARG A 393 N LYS A 292 ? N LYS A 378 A 5 6 O PHE A 293 ? O PHE A 379 N SER A 274 ? N SER A 360 A 6 7 O TRP A 275 ? O TRP A 361 N ILE A 269 ? N ILE A 354 B 1 2 N ARG A 42 ? N ARG A 118 O VAL A 58 ? O VAL A 134 B 2 3 N PHE A 57 ? N PHE A 133 O TYR A 80 ? O TYR A 159 B 3 4 N VAL A 79 ? N VAL A 158 O ALA A 97 ? O ALA A 175 C 1 2 N SER A 103 ? N SER A 181 O LEU A 114 ? O LEU A 192 C 2 3 N VAL A 113 ? N VAL A 191 O LEU A 125 ? O LEU A 206 C 3 4 N ILE A 124 ? N ILE A 205 O ASP A 132 ? O ASP A 213 D 1 2 N ASN A 152 ? N ASN A 233 O THR A 155 ? O THR A 236 D 2 3 N THR A 158 ? N THR A 239 O TYR A 174 ? O TYR A 255 D 3 4 N VAL A 177 ? N VAL A 258 O THR A 180 ? O THR A 261 E 1 2 N GLU A 195 ? N GLU A 276 O THR A 211 ? O THR A 292 E 2 3 N CYS A 208 ? N CYS A 289 O LEU A 222 ? O LEU A 303 E 3 4 N PHE A 221 ? N PHE A 302 O LYS A 233 ? O LYS A 315 F 1 2 N TYR B 25 ? N TYR B 101 O THR B 355 ? O THR B 445 F 2 3 O PHE B 356 ? O PHE B 446 N PHE B 336 ? N PHE B 422 F 3 4 O GLU B 339 ? O GLU B 425 N ARG B 318 ? N ARG B 406 F 4 5 O TYR B 308 ? O TYR B 395 N ILE B 290 ? N ILE B 376 F 5 6 O PHE B 293 ? O PHE B 379 N SER B 274 ? N SER B 360 F 6 7 O TRP B 275 ? O TRP B 361 N ILE B 269 ? N ILE B 354 G 1 2 N ARG B 42 ? N ARG B 118 O VAL B 58 ? O VAL B 134 G 2 3 N ARG B 55 ? N ARG B 131 O VAL B 82 ? O VAL B 161 G 3 4 N VAL B 79 ? N VAL B 158 O ALA B 97 ? O ALA B 175 H 1 2 N SER B 103 ? N SER B 181 O LEU B 114 ? O LEU B 192 H 2 3 N VAL B 113 ? N VAL B 191 O LEU B 125 ? O LEU B 206 H 3 4 N ILE B 124 ? N ILE B 205 O ASP B 132 ? O ASP B 213 I 1 2 N ILE B 150 ? N ILE B 231 O TYR B 157 ? O TYR B 238 I 2 3 N CYS B 156 ? N CYS B 237 O LEU B 176 ? O LEU B 257 I 3 4 N ARG B 175 ? N ARG B 256 O GLY B 183 ? O GLY B 264 J 1 2 N TYR B 200 ? N TYR B 281 O LYS B 207 ? O LYS B 288 J 2 3 N CYS B 208 ? N CYS B 289 O LEU B 222 ? O LEU B 303 J 3 4 N GLU B 223 ? N GLU B 304 O THR B 231 ? O THR B 313 K 1 2 N TYR C 25 ? N TYR C 101 O THR C 355 ? O THR C 445 K 2 3 O SER C 350 ? O SER C 440 N ALA C 342 ? N ALA C 428 K 3 4 O ALA C 341 ? O ALA C 427 N THR C 315 ? N THR C 403 K 4 5 O TYR C 308 ? O TYR C 395 N ILE C 290 ? N ILE C 376 K 5 6 O GLU C 289 ? O GLU C 375 N ARG C 278 ? N ARG C 364 K 6 7 O TRP C 275 ? O TRP C 361 N ILE C 269 ? N ILE C 354 L 1 2 N SER C 47 ? N SER C 123 O ARG C 54 ? O ARG C 130 L 2 3 N PHE C 57 ? N PHE C 133 O TYR C 80 ? O TYR C 159 L 3 4 N VAL C 79 ? N VAL C 158 O GLU C 96 ? O GLU C 174 M 1 2 N SER C 101 ? N SER C 179 O VAL C 116 ? O VAL C 194 M 2 3 N VAL C 113 ? N VAL C 191 O LEU C 125 ? O LEU C 206 M 3 4 N TYR C 126 ? N TYR C 207 O ILE C 129 ? O ILE C 210 N 1 2 N ILE C 150 ? N ILE C 231 O TYR C 157 ? O TYR C 238 N 2 3 N CYS C 156 ? N CYS C 237 O LEU C 176 ? O LEU C 257 N 3 4 N ARG C 175 ? N ARG C 256 O ALA C 182 ? O ALA C 263 O 1 2 N TYR C 200 ? N TYR C 281 O LYS C 207 ? O LYS C 288 O 2 3 N VAL C 206 ? N VAL C 287 O PHE C 224 ? O PHE C 305 O 3 4 N PHE C 221 ? N PHE C 302 O LYS C 233 ? O LYS C 315 P 1 2 N VAL D 22 ? N VAL D 98 O CYS D 357 ? O CYS D 447 P 2 3 O ASP D 352 ? O ASP D 442 N ILE D 340 ? N ILE D 426 P 3 4 O THR D 343 ? O THR D 429 N ILE D 34 ? N ILE D 110 Q 1 2 N VAL D 22 ? N VAL D 98 O CYS D 357 ? O CYS D 447 Q 2 3 O ASP D 352 ? O ASP D 442 N ILE D 340 ? N ILE D 426 Q 3 4 O GLU D 339 ? O GLU D 425 N ARG D 318 ? N ARG D 406 Q 4 5 O TYR D 308 ? O TYR D 395 N ILE D 290 ? N ILE D 376 Q 5 6 O GLU D 289 ? O GLU D 375 N ARG D 278 ? N ARG D 364 Q 6 7 O TRP D 275 ? O TRP D 361 N ILE D 269 ? N ILE D 354 R 1 2 N ARG D 42 ? N ARG D 118 O VAL D 58 ? O VAL D 134 R 2 3 N ARG D 55 ? N ARG D 131 O VAL D 82 ? O VAL D 161 R 3 4 N VAL D 79 ? N VAL D 158 O ALA D 97 ? O ALA D 175 S 1 2 N CYS D 105 ? N CYS D 183 O THR D 112 ? O THR D 190 S 2 3 N SER D 115 ? N SER D 193 O SER D 123 ? O SER D 204 S 3 4 N TYR D 126 ? N TYR D 207 O ILE D 129 ? O ILE D 210 T 1 2 N ILE D 150 ? N ILE D 231 O TYR D 157 ? O TYR D 238 T 2 3 N CYS D 156 ? N CYS D 237 O LEU D 176 ? O LEU D 257 T 3 4 N ARG D 175 ? N ARG D 256 O ALA D 182 ? O ALA D 263 U 1 2 N THR D 202 ? N THR D 283 O LYS D 205 ? O LYS D 286 U 2 3 N CYS D 208 ? N CYS D 289 O LEU D 222 ? O LEU D 303 U 3 4 N PHE D 221 ? N PHE D 302 O LYS D 233 ? O LYS D 315 # 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 ? ? ? ? 5 'BINDING SITE FOR RESIDUE CA A 604' AC2 Software ? ? ? ? 5 'BINDING SITE FOR RESIDUE CA B 605' AC3 Software ? ? ? ? 5 'BINDING SITE FOR RESIDUE CA C 608' AC4 Software ? ? ? ? 5 'BINDING SITE FOR RESIDUE CA D 604' AC5 Software ? ? ? ? 4 'BINDING SITE FOR CHAIN A OF SUGAR BOUND TO ASN A 259 RESIDUES 601 TO 603' AC6 Software ? ? ? ? 3 'BINDING SITE FOR CHAIN B OF SUGAR BOUND TO ASN B 259 RESIDUES 601 TO 602' AC7 Software ? ? ? ? 6 'BINDING SITE FOR CHAIN B OF SUGAR BOUND TO ASN B 401 RESIDUES 603 TO 604' AC8 Software ? ? ? ? 4 'BINDING SITE FOR CHAIN C OF SUGAR BOUND TO ASN C 259 RESIDUES 601 TO 602' AC9 Software ? ? ? ? 5 'BINDING SITE FOR CHAIN C OF SUGAR BOUND TO ASN C 401 RESIDUES 603 TO 607' BC1 Software ? ? ? ? 2 'BINDING SITE FOR CHAIN D OF SUGAR BOUND TO ASN D 259 RESIDUES 601 TO 603' # 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 5 ASN A 212 ? ASN A 293 . ? 1_555 ? 2 AC1 5 ASP A 216 ? ASP A 297 . ? 1_555 ? 3 AC1 5 ASP A 242 ? ASP A 324 . ? 1_555 ? 4 AC1 5 GLY A 260 ? GLY A 345 . ? 1_555 ? 5 AC1 5 GLY A 262 ? GLY A 347 . ? 1_555 ? 6 AC2 5 ASN B 212 ? ASN B 293 . ? 1_555 ? 7 AC2 5 ASP B 216 ? ASP B 297 . ? 1_555 ? 8 AC2 5 ASP B 242 ? ASP B 324 . ? 1_555 ? 9 AC2 5 GLY B 260 ? GLY B 345 . ? 1_555 ? 10 AC2 5 GLY B 262 ? GLY B 347 . ? 1_555 ? 11 AC3 5 ASN C 212 ? ASN C 293 . ? 1_555 ? 12 AC3 5 ASP C 216 ? ASP C 297 . ? 1_555 ? 13 AC3 5 ASP C 242 ? ASP C 324 . ? 1_555 ? 14 AC3 5 GLY C 260 ? GLY C 345 . ? 1_555 ? 15 AC3 5 GLY C 262 ? GLY C 347 . ? 1_555 ? 16 AC4 5 ASN D 212 ? ASN D 293 . ? 1_555 ? 17 AC4 5 ASP D 216 ? ASP D 297 . ? 1_555 ? 18 AC4 5 ASP D 242 ? ASP D 324 . ? 1_555 ? 19 AC4 5 GLY D 260 ? GLY D 345 . ? 1_555 ? 20 AC4 5 GLY D 262 ? GLY D 347 . ? 1_555 ? 21 AC5 4 ALA A 6 ? ALA A 82 . ? 1_555 ? 22 AC5 4 PHE A 109 ? PHE A 187 . ? 1_555 ? 23 AC5 4 ASN A 178 ? ASN A 259 . ? 1_555 ? 24 AC5 4 SER C 328 ? SER C 415 . ? 1_555 ? 25 AC6 3 ALA B 6 ? ALA B 82 . ? 1_555 ? 26 AC6 3 PHE B 109 ? PHE B 187 . ? 1_555 ? 27 AC6 3 ASN B 178 ? ASN B 259 . ? 1_555 ? 28 AC7 6 ASN B 313 ? ASN B 401 . ? 1_555 ? 29 AC7 6 ASN B 367 ? ASN B 457 . ? 1_555 ? 30 AC7 6 HOH AA . ? HOH B 726 . ? 1_555 ? 31 AC7 6 SER D 74 ? SER D 150 . ? 1_555 ? 32 AC7 6 GLU D 75 ? GLU D 151 . ? 1_555 ? 33 AC7 6 GLN D 76 ? GLN D 152 . ? 1_555 ? 34 AC8 4 ALA C 6 ? ALA C 82 . ? 1_555 ? 35 AC8 4 VAL C 177 ? VAL C 258 . ? 1_555 ? 36 AC8 4 ASN C 178 ? ASN C 259 . ? 1_555 ? 37 AC8 4 SER D 328 ? SER D 415 . ? 1_555 ? 38 AC9 5 SER A 74 ? SER A 150 . ? 1_555 ? 39 AC9 5 GLU A 75 ? GLU A 151 . ? 1_555 ? 40 AC9 5 GLN A 76 ? GLN A 152 . ? 1_555 ? 41 AC9 5 ASN C 313 ? ASN C 401 . ? 1_555 ? 42 AC9 5 GLY C 369 ? GLY C 459 . ? 1_555 ? 43 BC1 2 SER B 328 ? SER B 415 . ? 1_555 ? 44 BC1 2 ASN D 178 ? ASN D 259 . ? 1_555 ? # _database_PDB_matrix.entry_id 4K3Y _database_PDB_matrix.origx[1][1] 1.000000 _database_PDB_matrix.origx[1][2] 0.000000 _database_PDB_matrix.origx[1][3] 0.000000 _database_PDB_matrix.origx[2][1] 0.000000 _database_PDB_matrix.origx[2][2] 1.000000 _database_PDB_matrix.origx[2][3] 0.000000 _database_PDB_matrix.origx[3][1] 0.000000 _database_PDB_matrix.origx[3][2] 0.000000 _database_PDB_matrix.origx[3][3] 1.000000 _database_PDB_matrix.origx_vector[1] 0.00000 _database_PDB_matrix.origx_vector[2] 0.00000 _database_PDB_matrix.origx_vector[3] 0.00000 # _atom_sites.entry_id 4K3Y _atom_sites.fract_transf_matrix[1][1] 0.005516 _atom_sites.fract_transf_matrix[1][2] 0.003185 _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] 0.006369 _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] 0.007321 _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 CA 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 . ALA A 1 6 ? 110.850 -31.377 26.818 1.00 80.73 ? 82 ALA A N 1 ATOM 2 C CA . ALA A 1 6 ? 109.970 -32.010 25.762 1.00 93.43 ? 82 ALA A CA 1 ATOM 3 C C . ALA A 1 6 ? 110.207 -33.552 25.724 1.00 92.89 ? 82 ALA A C 1 ATOM 4 O O . ALA A 1 6 ? 111.397 -34.007 25.533 1.00 88.65 ? 82 ALA A O 1 ATOM 5 C CB . ALA A 1 6 ? 110.230 -31.394 24.325 1.00 67.50 ? 82 ALA A CB 1 ATOM 6 N N . THR A 1 7 ? 109.119 -34.329 25.890 1.00 89.23 ? 83 THR A N 1 ATOM 7 C CA . THR A 1 7 ? 109.172 -35.783 26.139 1.00 88.08 ? 83 THR A CA 1 ATOM 8 C C . THR A 1 7 ? 108.088 -36.491 25.306 1.00 82.37 ? 83 THR A C 1 ATOM 9 O O . THR A 1 7 ? 107.048 -35.883 25.025 1.00 78.84 ? 83 THR A O 1 ATOM 10 C CB . THR A 1 7 ? 108.964 -36.074 27.649 1.00 89.03 ? 83 THR A CB 1 ATOM 11 O OG1 . THR A 1 7 ? 108.515 -37.423 27.837 1.00 106.25 ? 83 THR A OG1 1 ATOM 12 C CG2 . THR A 1 7 ? 107.892 -35.137 28.221 1.00 78.69 ? 83 THR A CG2 1 ATOM 13 N N . PRO A 1 8 ? 108.314 -37.770 24.915 1.00 72.10 ? 84 PRO A N 1 ATOM 14 C CA . PRO A 1 8 ? 107.297 -38.499 24.138 1.00 62.31 ? 84 PRO A CA 1 ATOM 15 C C . PRO A 1 8 ? 105.987 -38.634 24.888 1.00 67.58 ? 84 PRO A C 1 ATOM 16 O O . PRO A 1 8 ? 105.982 -38.973 26.070 1.00 75.49 ? 84 PRO A O 1 ATOM 17 C CB . PRO A 1 8 ? 107.916 -39.885 23.949 1.00 64.04 ? 84 PRO A CB 1 ATOM 18 C CG . PRO A 1 8 ? 109.376 -39.641 23.999 1.00 72.49 ? 84 PRO A CG 1 ATOM 19 C CD . PRO A 1 8 ? 109.561 -38.545 25.038 1.00 69.33 ? 84 PRO A CD 1 ATOM 20 N N . LEU A 1 9 ? 104.896 -38.362 24.200 1.00 75.57 ? 85 LEU A N 1 ATOM 21 C CA . LEU A 1 9 ? 103.579 -38.604 24.753 1.00 69.27 ? 85 LEU A CA 1 ATOM 22 C C . LEU A 1 9 ? 103.359 -40.104 24.939 1.00 72.07 ? 85 LEU A C 1 ATOM 23 O O . LEU A 1 9 ? 103.552 -40.904 24.020 1.00 74.97 ? 85 LEU A O 1 ATOM 24 C CB . LEU A 1 9 ? 102.521 -38.020 23.826 1.00 63.09 ? 85 LEU A CB 1 ATOM 25 C CG . LEU A 1 9 ? 101.066 -38.033 24.272 1.00 65.56 ? 85 LEU A CG 1 ATOM 26 C CD1 . LEU A 1 9 ? 100.459 -36.709 23.856 1.00 74.98 ? 85 LEU A CD1 1 ATOM 27 C CD2 . LEU A 1 9 ? 100.306 -39.196 23.624 1.00 54.96 ? 85 LEU A CD2 1 ATOM 28 N N . VAL A 1 10 ? 102.968 -40.487 26.142 1.00 69.06 ? 86 VAL A N 1 ATOM 29 C CA . VAL A 1 10 ? 102.632 -41.871 26.389 1.00 70.24 ? 86 VAL A CA 1 ATOM 30 C C . VAL A 1 10 ? 101.262 -41.953 27.071 1.00 70.63 ? 86 VAL A C 1 ATOM 31 O O . VAL A 1 10 ? 100.980 -41.228 28.022 1.00 73.45 ? 86 VAL A O 1 ATOM 32 C CB . VAL A 1 10 ? 103.739 -42.565 27.192 1.00 60.39 ? 86 VAL A CB 1 ATOM 33 C CG1 . VAL A 1 10 ? 104.314 -41.607 28.209 1.00 58.63 ? 86 VAL A CG1 1 ATOM 34 C CG2 . VAL A 1 10 ? 103.209 -43.810 27.855 1.00 59.57 ? 86 VAL A CG2 1 ATOM 35 N N . LEU A 1 11 ? 100.397 -42.806 26.539 1.00 67.61 ? 87 LEU A N 1 ATOM 36 C CA . LEU A 1 11 ? 99.041 -42.922 27.050 1.00 64.85 ? 87 LEU A CA 1 ATOM 37 C C . LEU A 1 11 ? 98.962 -43.949 28.180 1.00 68.01 ? 87 LEU A C 1 ATOM 38 O O . LEU A 1 11 ? 99.903 -44.712 28.429 1.00 63.43 ? 87 LEU A O 1 ATOM 39 C CB . LEU A 1 11 ? 98.085 -43.328 25.927 1.00 66.26 ? 87 LEU A CB 1 ATOM 40 C CG . LEU A 1 11 ? 98.031 -42.480 24.651 1.00 70.63 ? 87 LEU A CG 1 ATOM 41 C CD1 . LEU A 1 11 ? 97.907 -43.380 23.429 1.00 61.88 ? 87 LEU A CD1 1 ATOM 42 C CD2 . LEU A 1 11 ? 96.875 -41.481 24.700 1.00 70.56 ? 87 LEU A CD2 1 ATOM 43 N N . GLY A 1 12 ? 97.821 -43.973 28.854 1.00 60.79 ? 88 GLY A N 1 ATOM 44 C CA . GLY A 1 12 ? 97.601 -44.910 29.932 1.00 54.10 ? 88 GLY A CA 1 ATOM 45 C C . GLY A 1 12 ? 97.366 -46.340 29.481 1.00 61.69 ? 88 GLY A C 1 ATOM 46 O O . GLY A 1 12 ? 96.643 -46.610 28.505 1.00 56.64 ? 88 GLY A O 1 ATOM 47 N N . GLU A 1 13 ? 97.962 -47.269 30.223 1.00 63.58 ? 89 GLU A N 1 ATOM 48 C CA . GLU A 1 13 ? 97.773 -48.684 29.959 1.00 56.78 ? 89 GLU A CA 1 ATOM 49 C C . GLU A 1 13 ? 96.362 -49.168 30.283 1.00 55.85 ? 89 GLU A C 1 ATOM 50 O O . GLU A 1 13 ? 95.879 -50.121 29.660 1.00 57.62 ? 89 GLU A O 1 ATOM 51 C CB . GLU A 1 13 ? 98.825 -49.503 30.706 1.00 49.48 ? 89 GLU A CB 1 ATOM 52 C CG . GLU A 1 13 ? 100.150 -49.576 29.967 1.00 57.43 ? 89 GLU A CG 1 ATOM 53 C CD . GLU A 1 13 ? 99.986 -50.069 28.540 1.00 73.58 ? 89 GLU A CD 1 ATOM 54 O OE1 . GLU A 1 13 ? 99.387 -51.152 28.339 1.00 83.59 ? 89 GLU A OE1 1 ATOM 55 O OE2 . GLU A 1 13 ? 100.443 -49.361 27.622 1.00 66.57 ? 89 GLU A OE2 1 ATOM 56 N N . ASN A 1 14 ? 95.696 -48.502 31.230 1.00 52.37 ? 90 ASN A N 1 ATOM 57 C CA . ASN A 1 14 ? 94.376 -48.958 31.675 1.00 59.45 ? 90 ASN A CA 1 ATOM 58 C C . ASN A 1 14 ? 93.302 -47.909 31.488 1.00 54.81 ? 90 ASN A C 1 ATOM 59 O O . ASN A 1 14 ? 93.476 -46.762 31.910 1.00 58.32 ? 90 ASN A O 1 ATOM 60 C CB . ASN A 1 14 ? 94.409 -49.378 33.153 1.00 63.71 ? 90 ASN A CB 1 ATOM 61 C CG . ASN A 1 14 ? 95.533 -50.340 33.456 1.00 71.30 ? 90 ASN A CG 1 ATOM 62 O OD1 . ASN A 1 14 ? 96.429 -50.021 34.241 1.00 67.98 ? 90 ASN A OD1 1 ATOM 63 N ND2 . ASN A 1 14 ? 95.502 -51.526 32.827 1.00 64.23 ? 90 ASN A ND2 1 ATOM 64 N N . LEU A 1 15 ? 92.188 -48.296 30.867 1.00 44.57 ? 91 LEU A N 1 ATOM 65 C CA . LEU A 1 15 ? 91.095 -47.347 30.672 1.00 48.22 ? 91 LEU A CA 1 ATOM 66 C C . LEU A 1 15 ? 90.417 -46.999 31.998 1.00 61.27 ? 91 LEU A C 1 ATOM 67 O O . LEU A 1 15 ? 90.327 -47.854 32.908 1.00 53.74 ? 91 LEU A O 1 ATOM 68 C CB . LEU A 1 15 ? 90.054 -47.918 29.709 1.00 51.30 ? 91 LEU A CB 1 ATOM 69 C CG . LEU A 1 15 ? 90.442 -47.970 28.223 1.00 52.99 ? 91 LEU A CG 1 ATOM 70 C CD1 . LEU A 1 15 ? 89.360 -48.617 27.365 1.00 45.53 ? 91 LEU A CD1 1 ATOM 71 C CD2 . LEU A 1 15 ? 90.764 -46.576 27.711 1.00 47.84 ? 91 LEU A CD2 1 ATOM 72 N N . CYS A 1 16 ? 89.939 -45.760 32.125 1.00 51.58 ? 92 CYS A N 1 ATOM 73 C CA . CYS A 1 16 ? 88.959 -45.483 33.184 1.00 47.94 ? 92 CYS A CA 1 ATOM 74 C C . CYS A 1 16 ? 87.735 -46.348 32.933 1.00 59.12 ? 92 CYS A C 1 ATOM 75 O O . CYS A 1 16 ? 87.397 -46.648 31.786 1.00 68.79 ? 92 CYS A O 1 ATOM 76 C CB . CYS A 1 16 ? 88.558 -44.000 33.265 1.00 43.56 ? 92 CYS A CB 1 ATOM 77 S SG . CYS A 1 16 ? 89.961 -42.793 33.453 1.00 81.21 ? 92 CYS A SG 1 ATOM 78 N N . SER A 1 17 ? 87.107 -46.798 34.010 1.00 60.39 ? 93 SER A N 1 ATOM 79 C CA . SER A 1 17 ? 85.859 -47.525 33.896 1.00 56.05 ? 93 SER A CA 1 ATOM 80 C C . SER A 1 17 ? 84.798 -46.536 33.389 1.00 66.29 ? 93 SER A C 1 ATOM 81 O O . SER A 1 17 ? 84.760 -45.372 33.824 1.00 69.82 ? 93 SER A O 1 ATOM 82 C CB . SER A 1 17 ? 85.474 -48.120 35.251 1.00 55.32 ? 93 SER A CB 1 ATOM 83 O OG . SER A 1 17 ? 84.275 -48.880 35.182 1.00 70.31 ? 93 SER A OG 1 ATOM 84 N N . ILE A 1 18 ? 83.964 -46.976 32.447 1.00 56.11 ? 94 ILE A N 1 ATOM 85 C CA . ILE A 1 18 ? 82.971 -46.081 31.856 1.00 50.82 ? 94 ILE A CA 1 ATOM 86 C C . ILE A 1 18 ? 81.556 -46.576 32.087 1.00 50.50 ? 94 ILE A C 1 ATOM 87 O O . ILE A 1 18 ? 81.219 -47.706 31.742 1.00 56.19 ? 94 ILE A O 1 ATOM 88 C CB . ILE A 1 18 ? 83.197 -45.894 30.333 1.00 51.23 ? 94 ILE A CB 1 ATOM 89 C CG1 . ILE A 1 18 ? 84.576 -45.281 30.065 1.00 49.67 ? 94 ILE A CG1 1 ATOM 90 C CG2 . ILE A 1 18 ? 82.107 -45.016 29.725 1.00 43.92 ? 94 ILE A CG2 1 ATOM 91 C CD1 . ILE A 1 18 ? 84.953 -45.252 28.593 1.00 47.94 ? 94 ILE A CD1 1 ATOM 92 N N . ASN A 1 19 ? 80.720 -45.721 32.662 1.00 48.42 ? 95 ASN A N 1 ATOM 93 C CA . ASN A 1 19 ? 79.343 -46.113 32.934 1.00 54.64 ? 95 ASN A CA 1 ATOM 94 C C . ASN A 1 19 ? 78.361 -45.137 32.315 1.00 55.56 ? 95 ASN A C 1 ATOM 95 O O . ASN A 1 19 ? 77.151 -45.363 32.332 1.00 64.72 ? 95 ASN A O 1 ATOM 96 C CB . ASN A 1 19 ? 79.123 -46.254 34.454 1.00 51.24 ? 95 ASN A CB 1 ATOM 97 C CG . ASN A 1 19 ? 79.967 -47.359 35.049 1.00 51.83 ? 95 ASN A CG 1 ATOM 98 O OD1 . ASN A 1 19 ? 79.944 -48.506 34.561 1.00 59.15 ? 95 ASN A OD1 1 ATOM 99 N ND2 . ASN A 1 19 ? 80.760 -47.022 36.074 1.00 64.46 ? 95 ASN A ND2 1 ATOM 100 N N . GLY A 1 20 ? 78.898 -44.054 31.764 1.00 52.25 ? 96 GLY A N 1 ATOM 101 C CA . GLY A 1 20 ? 78.092 -43.040 31.115 1.00 56.12 ? 96 GLY A CA 1 ATOM 102 C C . GLY A 1 20 ? 78.959 -41.974 30.474 1.00 56.30 ? 96 GLY A C 1 ATOM 103 O O . GLY A 1 20 ? 80.190 -42.044 30.518 1.00 49.82 ? 96 GLY A O 1 ATOM 104 N N . TRP A 1 21 ? 78.308 -40.973 29.892 1.00 54.39 ? 97 TRP A N 1 ATOM 105 C CA . TRP A 1 21 ? 78.991 -40.011 29.053 1.00 46.63 ? 97 TRP A CA 1 ATOM 106 C C . TRP A 1 21 ? 78.557 -38.600 29.360 1.00 55.05 ? 97 TRP A C 1 ATOM 107 O O . TRP A 1 21 ? 77.399 -38.341 29.710 1.00 39.79 ? 97 TRP A O 1 ATOM 108 C CB . TRP A 1 21 ? 78.736 -40.327 27.582 1.00 40.62 ? 97 TRP A CB 1 ATOM 109 C CG . TRP A 1 21 ? 79.192 -41.698 27.231 1.00 36.38 ? 97 TRP A CG 1 ATOM 110 C CD1 . TRP A 1 21 ? 78.439 -42.846 27.234 1.00 42.53 ? 97 TRP A CD1 1 ATOM 111 C CD2 . TRP A 1 21 ? 80.521 -42.087 26.868 1.00 41.96 ? 97 TRP A CD2 1 ATOM 112 N NE1 . TRP A 1 21 ? 79.221 -43.929 26.870 1.00 50.74 ? 97 TRP A NE1 1 ATOM 113 C CE2 . TRP A 1 21 ? 80.501 -43.495 26.641 1.00 51.30 ? 97 TRP A CE2 1 ATOM 114 C CE3 . TRP A 1 21 ? 81.723 -41.382 26.698 1.00 37.20 ? 97 TRP A CE3 1 ATOM 115 C CZ2 . TRP A 1 21 ? 81.642 -44.216 26.257 1.00 39.18 ? 97 TRP A CZ2 1 ATOM 116 C CZ3 . TRP A 1 21 ? 82.864 -42.090 26.308 1.00 37.37 ? 97 TRP A CZ3 1 ATOM 117 C CH2 . TRP A 1 21 ? 82.814 -43.500 26.095 1.00 49.08 ? 97 TRP A CH2 1 ATOM 118 N N . VAL A 1 22 ? 79.508 -37.689 29.198 1.00 51.40 ? 98 VAL A N 1 ATOM 119 C CA . VAL A 1 22 ? 79.335 -36.325 29.621 1.00 42.53 ? 98 VAL A CA 1 ATOM 120 C C . VAL A 1 22 ? 79.846 -35.384 28.523 1.00 44.07 ? 98 VAL A C 1 ATOM 121 O O . VAL A 1 22 ? 80.965 -35.533 28.027 1.00 46.43 ? 98 VAL A O 1 ATOM 122 C CB . VAL A 1 22 ? 80.070 -36.099 30.983 1.00 52.36 ? 98 VAL A CB 1 ATOM 123 C CG1 . VAL A 1 22 ? 80.289 -34.616 31.280 1.00 62.19 ? 98 VAL A CG1 1 ATOM 124 C CG2 . VAL A 1 22 ? 79.285 -36.734 32.100 1.00 62.34 ? 98 VAL A CG2 1 ATOM 125 N N . PRO A 1 23 ? 79.025 -34.396 28.145 1.00 47.32 ? 99 PRO A N 1 ATOM 126 C CA . PRO A 1 23 ? 79.427 -33.442 27.109 1.00 50.79 ? 99 PRO A CA 1 ATOM 127 C C . PRO A 1 23 ? 80.593 -32.576 27.555 1.00 50.32 ? 99 PRO A C 1 ATOM 128 O O . PRO A 1 23 ? 80.597 -32.067 28.672 1.00 53.06 ? 99 PRO A O 1 ATOM 129 C CB . PRO A 1 23 ? 78.182 -32.566 26.940 1.00 47.65 ? 99 PRO A CB 1 ATOM 130 C CG . PRO A 1 23 ? 77.493 -32.656 28.236 1.00 46.96 ? 99 PRO A CG 1 ATOM 131 C CD . PRO A 1 23 ? 77.693 -34.078 28.691 1.00 47.98 ? 99 PRO A CD 1 ATOM 132 N N . THR A 1 24 ? 81.570 -32.413 26.674 1.00 48.08 ? 100 THR A N 1 ATOM 133 C CA . THR A 1 24 ? 82.678 -31.509 26.922 1.00 45.14 ? 100 THR A CA 1 ATOM 134 C C . THR A 1 24 ? 82.674 -30.368 25.920 1.00 42.48 ? 100 THR A C 1 ATOM 135 O O . THR A 1 24 ? 83.489 -29.455 26.027 1.00 50.80 ? 100 THR A O 1 ATOM 136 C CB . THR A 1 24 ? 84.038 -32.237 26.919 1.00 46.00 ? 100 THR A CB 1 ATOM 137 O OG1 . THR A 1 24 ? 84.106 -33.142 25.808 1.00 58.20 ? 100 THR A OG1 1 ATOM 138 C CG2 . THR A 1 24 ? 84.188 -33.033 28.200 1.00 39.48 ? 100 THR A CG2 1 ATOM 139 N N . TYR A 1 25 ? 81.741 -30.419 24.965 1.00 45.50 ? 101 TYR A N 1 ATOM 140 C CA . TYR A 1 25 ? 81.584 -29.373 23.944 1.00 43.55 ? 101 TYR A CA 1 ATOM 141 C C . TYR A 1 25 ? 80.316 -29.596 23.127 1.00 46.26 ? 101 TYR A C 1 ATOM 142 O O . TYR A 1 25 ? 80.066 -30.705 22.647 1.00 50.38 ? 101 TYR A O 1 ATOM 143 C CB . TYR A 1 25 ? 82.785 -29.366 22.995 1.00 50.30 ? 101 TYR A CB 1 ATOM 144 C CG . TYR A 1 25 ? 82.707 -28.390 21.835 1.00 61.52 ? 101 TYR A CG 1 ATOM 145 C CD1 . TYR A 1 25 ? 82.688 -27.021 22.059 1.00 50.43 ? 101 TYR A CD1 1 ATOM 146 C CD2 . TYR A 1 25 ? 82.707 -28.839 20.516 1.00 65.84 ? 101 TYR A CD2 1 ATOM 147 C CE1 . TYR A 1 25 ? 82.647 -26.129 21.019 1.00 51.83 ? 101 TYR A CE1 1 ATOM 148 C CE2 . TYR A 1 25 ? 82.670 -27.946 19.458 1.00 66.52 ? 101 TYR A CE2 1 ATOM 149 C CZ . TYR A 1 25 ? 82.641 -26.587 19.718 1.00 66.84 ? 101 TYR A CZ 1 ATOM 150 O OH . TYR A 1 25 ? 82.611 -25.667 18.688 1.00 54.56 ? 101 TYR A OH 1 ATOM 151 N N . ARG A 1 26 ? 79.524 -28.539 22.978 1.00 53.94 ? 102 ARG A N 1 ATOM 152 C CA . ARG A 1 26 ? 78.332 -28.546 22.132 1.00 60.89 ? 102 ARG A CA 1 ATOM 153 C C . ARG A 1 26 ? 78.509 -27.403 21.172 1.00 66.60 ? 102 ARG A C 1 ATOM 154 O O . ARG A 1 26 ? 78.544 -26.247 21.588 1.00 104.26 ? 102 ARG A O 1 ATOM 155 C CB . ARG A 1 26 ? 77.097 -28.310 22.980 1.00 62.28 ? 102 ARG A CB 1 ATOM 156 C CG . ARG A 1 26 ? 77.074 -29.177 24.214 1.00 61.21 ? 102 ARG A CG 1 ATOM 157 C CD . ARG A 1 26 ? 76.044 -28.704 25.178 1.00 70.50 ? 102 ARG A CD 1 ATOM 158 N NE . ARG A 1 26 ? 74.703 -29.074 24.754 1.00 85.61 ? 102 ARG A NE 1 ATOM 159 C CZ . ARG A 1 26 ? 73.608 -28.533 25.268 1.00 95.71 ? 102 ARG A CZ 1 ATOM 160 N NH1 . ARG A 1 26 ? 73.720 -27.596 26.208 1.00 89.74 ? 102 ARG A NH1 1 ATOM 161 N NH2 . ARG A 1 26 ? 72.414 -28.919 24.837 1.00 89.67 ? 102 ARG A NH2 1 ATOM 162 N N . GLY A 1 27 ? 78.630 -27.715 19.895 1.00 49.85 ? 103 GLY A N 1 ATOM 163 C CA . GLY A 1 27 ? 79.191 -26.766 18.946 1.00 60.33 ? 103 GLY A CA 1 ATOM 164 C C . GLY A 1 27 ? 78.431 -25.471 18.770 1.00 70.89 ? 103 GLY A C 1 ATOM 165 O O . GLY A 1 27 ? 77.505 -25.173 19.520 1.00 81.25 ? 103 GLY A O 1 ATOM 166 N N . GLU A 1 28 ? 78.801 -24.693 17.760 1.00 71.26 ? 104 GLU A N 1 ATOM 167 C CA . GLU A 1 28 ? 78.222 -23.362 17.656 1.00 75.30 ? 104 GLU A CA 1 ATOM 168 C C . GLU A 1 28 ? 76.734 -23.327 17.264 1.00 58.63 ? 104 GLU A C 1 ATOM 169 O O . GLU A 1 28 ? 76.123 -22.259 17.241 1.00 60.64 ? 104 GLU A O 1 ATOM 170 C CB . GLU A 1 28 ? 79.086 -22.441 16.784 1.00 89.56 ? 104 GLU A CB 1 ATOM 171 C CG . GLU A 1 28 ? 80.192 -21.721 17.566 1.00 86.85 ? 104 GLU A CG 1 ATOM 172 C CD . GLU A 1 28 ? 81.177 -22.699 18.170 1.00 91.12 ? 104 GLU A CD 1 ATOM 173 O OE1 . GLU A 1 28 ? 81.379 -23.758 17.544 1.00 91.33 ? 104 GLU A OE1 1 ATOM 174 O OE2 . GLU A 1 28 ? 81.734 -22.429 19.262 1.00 90.49 ? 104 GLU A OE2 1 ATOM 175 N N . GLY A 1 29 ? 76.143 -24.490 17.004 1.00 61.46 ? 105 GLY A N 1 ATOM 176 C CA . GLY A 1 29 ? 74.732 -24.545 16.664 1.00 84.99 ? 105 GLY A CA 1 ATOM 177 C C . GLY A 1 29 ? 73.743 -24.868 17.781 1.00 93.95 ? 105 GLY A C 1 ATOM 178 O O . GLY A 1 29 ? 72.714 -25.493 17.528 1.00 98.78 ? 105 GLY A O 1 ATOM 179 N N . THR A 1 30 ? 74.030 -24.444 19.009 1.00 95.38 ? 106 THR A N 1 ATOM 180 C CA . THR A 1 30 ? 73.112 -24.681 20.132 1.00 101.01 ? 106 THR A CA 1 ATOM 181 C C . THR A 1 30 ? 71.941 -23.700 20.089 1.00 104.17 ? 106 THR A C 1 ATOM 182 O O . THR A 1 30 ? 70.872 -23.945 20.658 1.00 97.80 ? 106 THR A O 1 ATOM 183 C CB . THR A 1 30 ? 73.826 -24.580 21.511 1.00 93.17 ? 106 THR A CB 1 ATOM 184 O OG1 . THR A 1 30 ? 74.924 -23.663 21.424 1.00 97.81 ? 106 THR A OG1 1 ATOM 185 C CG2 . THR A 1 30 ? 74.350 -25.940 21.955 1.00 86.33 ? 106 THR A CG2 1 ATOM 186 N N . THR A 1 31 ? 72.163 -22.589 19.396 1.00 110.08 ? 107 THR A N 1 ATOM 187 C CA . THR A 1 31 ? 71.159 -21.555 19.205 1.00 103.96 ? 107 THR A CA 1 ATOM 188 C C . THR A 1 31 ? 70.200 -21.955 18.073 1.00 104.06 ? 107 THR A C 1 ATOM 189 O O . THR A 1 31 ? 69.271 -21.213 17.739 1.00 105.52 ? 107 THR A O 1 ATOM 190 C CB . THR A 1 31 ? 71.844 -20.194 18.895 1.00 114.92 ? 107 THR A CB 1 ATOM 191 O OG1 . THR A 1 31 ? 71.362 -19.664 17.652 1.00 116.43 ? 107 THR A OG1 1 ATOM 192 C CG2 . THR A 1 31 ? 73.366 -20.370 18.801 1.00 108.89 ? 107 THR A CG2 1 ATOM 193 N N . GLY A 1 32 ? 70.420 -23.139 17.506 1.00 95.73 ? 108 GLY A N 1 ATOM 194 C CA . GLY A 1 32 ? 69.676 -23.563 16.342 1.00 87.01 ? 108 GLY A CA 1 ATOM 195 C C . GLY A 1 32 ? 70.414 -23.282 15.041 1.00 92.92 ? 108 GLY A C 1 ATOM 196 O O . GLY A 1 32 ? 70.256 -24.031 14.068 1.00 95.38 ? 108 GLY A O 1 ATOM 197 N N . LYS A 1 33 ? 71.214 -22.210 15.013 1.00 89.87 ? 109 LYS A N 1 ATOM 198 C CA . LYS A 1 33 ? 71.902 -21.781 13.782 1.00 79.75 ? 109 LYS A CA 1 ATOM 199 C C . LYS A 1 33 ? 73.358 -21.369 13.972 1.00 75.13 ? 109 LYS A C 1 ATOM 200 O O . LYS A 1 33 ? 73.722 -20.760 14.977 1.00 82.72 ? 109 LYS A O 1 ATOM 201 C CB . LYS A 1 33 ? 71.154 -20.620 13.125 1.00 74.31 ? 109 LYS A CB 1 ATOM 202 C CG . LYS A 1 33 ? 70.485 -20.988 11.837 1.00 89.05 ? 109 LYS A CG 1 ATOM 203 C CD . LYS A 1 33 ? 69.010 -20.695 11.910 1.00 103.89 ? 109 LYS A CD 1 ATOM 204 C CE . LYS A 1 33 ? 68.317 -21.106 10.635 1.00 112.88 ? 109 LYS A CE 1 ATOM 205 N NZ . LYS A 1 33 ? 66.846 -21.157 10.828 1.00 116.52 ? 109 LYS A NZ 1 ATOM 206 N N . ILE A 1 34 ? 74.179 -21.678 12.976 1.00 70.24 ? 110 ILE A N 1 ATOM 207 C CA . ILE A 1 34 ? 75.595 -21.328 13.012 1.00 72.99 ? 110 ILE A CA 1 ATOM 208 C C . ILE A 1 34 ? 75.845 -19.947 12.398 1.00 67.03 ? 110 ILE A C 1 ATOM 209 O O . ILE A 1 34 ? 75.337 -19.644 11.319 1.00 79.13 ? 110 ILE A O 1 ATOM 210 C CB . ILE A 1 34 ? 76.446 -22.400 12.284 1.00 68.36 ? 110 ILE A CB 1 ATOM 211 C CG1 . ILE A 1 34 ? 76.101 -23.794 12.818 1.00 70.48 ? 110 ILE A CG1 1 ATOM 212 C CG2 . ILE A 1 34 ? 77.939 -22.115 12.425 1.00 56.77 ? 110 ILE A CG2 1 ATOM 213 C CD1 . ILE A 1 34 ? 77.203 -24.792 12.604 1.00 64.72 ? 110 ILE A CD1 1 ATOM 214 N N . PRO A 1 35 ? 76.624 -19.102 13.092 1.00 65.48 ? 111 PRO A N 1 ATOM 215 C CA . PRO A 1 35 ? 77.026 -17.774 12.607 1.00 65.81 ? 111 PRO A CA 1 ATOM 216 C C . PRO A 1 35 ? 77.731 -17.834 11.246 1.00 75.89 ? 111 PRO A C 1 ATOM 217 O O . PRO A 1 35 ? 78.588 -18.698 11.022 1.00 75.66 ? 111 PRO A O 1 ATOM 218 C CB . PRO A 1 35 ? 78.011 -17.295 13.676 1.00 57.49 ? 111 PRO A CB 1 ATOM 219 C CG . PRO A 1 35 ? 77.671 -18.044 14.872 1.00 57.78 ? 111 PRO A CG 1 ATOM 220 C CD . PRO A 1 35 ? 77.171 -19.386 14.429 1.00 59.97 ? 111 PRO A CD 1 ATOM 221 N N . ASP A 1 36 ? 77.394 -16.917 10.345 1.00 75.52 ? 112 ASP A N 1 ATOM 222 C CA . ASP A 1 36 ? 77.902 -17.017 8.979 1.00 74.62 ? 112 ASP A CA 1 ATOM 223 C C . ASP A 1 36 ? 79.368 -16.624 8.813 1.00 72.11 ? 112 ASP A C 1 ATOM 224 O O . ASP A 1 36 ? 79.940 -16.843 7.744 1.00 73.67 ? 112 ASP A O 1 ATOM 225 C CB . ASP A 1 36 ? 77.017 -16.236 8.006 1.00 83.78 ? 112 ASP A CB 1 ATOM 226 C CG . ASP A 1 36 ? 75.730 -16.975 7.668 1.00 103.97 ? 112 ASP A CG 1 ATOM 227 O OD1 . ASP A 1 36 ? 75.759 -17.895 6.811 1.00 109.85 ? 112 ASP A OD1 1 ATOM 228 O OD2 . ASP A 1 36 ? 74.688 -16.614 8.251 1.00 102.81 ? 112 ASP A OD2 1 ATOM 229 N N . GLU A 1 37 ? 79.982 -16.087 9.867 1.00 72.44 ? 113 GLU A N 1 ATOM 230 C CA . GLU A 1 37 ? 81.387 -15.685 9.800 1.00 74.69 ? 113 GLU A CA 1 ATOM 231 C C . GLU A 1 37 ? 82.285 -16.902 9.947 1.00 69.46 ? 113 GLU A C 1 ATOM 232 O O . GLU A 1 37 ? 83.473 -16.856 9.637 1.00 74.45 ? 113 GLU A O 1 ATOM 233 C CB . GLU A 1 37 ? 81.715 -14.646 10.876 1.00 78.14 ? 113 GLU A CB 1 ATOM 234 C CG . GLU A 1 37 ? 80.628 -13.589 11.056 1.00 89.66 ? 113 GLU A CG 1 ATOM 235 C CD . GLU A 1 37 ? 79.559 -14.017 12.054 1.00 102.97 ? 113 GLU A CD 1 ATOM 236 O OE1 . GLU A 1 37 ? 79.927 -14.364 13.202 1.00 91.53 ? 113 GLU A OE1 1 ATOM 237 O OE2 . GLU A 1 37 ? 78.358 -14.020 11.692 1.00 107.32 ? 113 GLU A OE2 1 ATOM 238 N N . GLN A 1 38 ? 81.693 -18.000 10.402 1.00 63.58 ? 114 GLN A N 1 ATOM 239 C CA . GLN A 1 38 ? 82.403 -19.259 10.563 1.00 56.84 ? 114 GLN A CA 1 ATOM 240 C C . GLN A 1 38 ? 82.564 -20.031 9.258 1.00 67.10 ? 114 GLN A C 1 ATOM 241 O O . GLN A 1 38 ? 81.665 -20.043 8.394 1.00 65.69 ? 114 GLN A O 1 ATOM 242 C CB . GLN A 1 38 ? 81.684 -20.135 11.575 1.00 57.12 ? 114 GLN A CB 1 ATOM 243 C CG . GLN A 1 38 ? 81.961 -19.729 13.000 1.00 71.32 ? 114 GLN A CG 1 ATOM 244 C CD . GLN A 1 38 ? 81.066 -20.432 13.978 1.00 70.78 ? 114 GLN A CD 1 ATOM 245 O OE1 . GLN A 1 38 ? 80.538 -19.809 14.899 1.00 81.12 ? 114 GLN A OE1 1 ATOM 246 N NE2 . GLN A 1 38 ? 80.883 -21.738 13.789 1.00 63.06 ? 114 GLN A NE2 1 ATOM 247 N N . MET A 1 39 ? 83.718 -20.681 9.132 1.00 48.63 ? 115 MET A N 1 ATOM 248 C CA . MET A 1 39 ? 84.004 -21.513 7.979 1.00 51.08 ? 115 MET A CA 1 ATOM 249 C C . MET A 1 39 ? 83.042 -22.689 7.860 1.00 58.86 ? 115 MET A C 1 ATOM 250 O O . MET A 1 39 ? 82.662 -23.306 8.863 1.00 64.11 ? 115 MET A O 1 ATOM 251 C CB . MET A 1 39 ? 85.425 -22.057 8.073 1.00 50.20 ? 115 MET A CB 1 ATOM 252 C CG . MET A 1 39 ? 86.499 -21.094 7.645 1.00 59.91 ? 115 MET A CG 1 ATOM 253 S SD . MET A 1 39 ? 87.850 -21.940 6.784 1.00 90.29 ? 115 MET A SD 1 ATOM 254 C CE . MET A 1 39 ? 87.610 -21.356 5.108 1.00 97.67 ? 115 MET A CE 1 ATOM 255 N N . LEU A 1 40 ? 82.641 -22.987 6.630 1.00 64.74 ? 116 LEU A N 1 ATOM 256 C CA . LEU A 1 40 ? 81.940 -24.232 6.347 1.00 64.30 ? 116 LEU A CA 1 ATOM 257 C C . LEU A 1 40 ? 82.917 -25.395 6.565 1.00 62.64 ? 116 LEU A C 1 ATOM 258 O O . LEU A 1 40 ? 83.915 -25.542 5.866 1.00 73.94 ? 116 LEU A O 1 ATOM 259 C CB . LEU A 1 40 ? 81.386 -24.222 4.928 1.00 64.64 ? 116 LEU A CB 1 ATOM 260 C CG . LEU A 1 40 ? 80.019 -23.563 4.709 1.00 64.26 ? 116 LEU A CG 1 ATOM 261 C CD1 . LEU A 1 40 ? 79.561 -22.839 5.956 1.00 61.84 ? 116 LEU A CD1 1 ATOM 262 C CD2 . LEU A 1 40 ? 80.031 -22.617 3.499 1.00 64.85 ? 116 LEU A CD2 1 ATOM 263 N N . THR A 1 41 ? 82.616 -26.216 7.553 1.00 59.02 ? 117 THR A N 1 ATOM 264 C CA . THR A 1 41 ? 83.551 -27.204 8.072 1.00 50.02 ? 117 THR A CA 1 ATOM 265 C C . THR A 1 41 ? 83.127 -28.609 7.616 1.00 50.41 ? 117 THR A C 1 ATOM 266 O O . THR A 1 41 ? 81.933 -28.892 7.454 1.00 48.56 ? 117 THR A O 1 ATOM 267 C CB . THR A 1 41 ? 83.595 -27.112 9.620 1.00 48.30 ? 117 THR A CB 1 ATOM 268 O OG1 . THR A 1 41 ? 83.967 -28.373 10.164 1.00 65.37 ? 117 THR A OG1 1 ATOM 269 C CG2 . THR A 1 41 ? 82.207 -26.770 10.167 1.00 55.80 ? 117 THR A CG2 1 ATOM 270 N N . ARG A 1 42 ? 84.097 -29.491 7.409 1.00 52.14 ? 118 ARG A N 1 ATOM 271 C CA . ARG A 1 42 ? 83.829 -30.766 6.748 1.00 57.25 ? 118 ARG A CA 1 ATOM 272 C C . ARG A 1 42 ? 84.864 -31.801 7.220 1.00 57.85 ? 118 ARG A C 1 ATOM 273 O O . ARG A 1 42 ? 86.013 -31.444 7.522 1.00 56.67 ? 118 ARG A O 1 ATOM 274 C CB . ARG A 1 42 ? 83.913 -30.529 5.225 1.00 61.23 ? 118 ARG A CB 1 ATOM 275 C CG . ARG A 1 42 ? 83.326 -31.600 4.330 1.00 74.21 ? 118 ARG A CG 1 ATOM 276 C CD . ARG A 1 42 ? 83.201 -31.113 2.879 1.00 85.11 ? 118 ARG A CD 1 ATOM 277 N NE . ARG A 1 42 ? 81.868 -30.574 2.590 1.00 107.67 ? 118 ARG A NE 1 ATOM 278 C CZ . ARG A 1 42 ? 81.616 -29.604 1.711 1.00 123.79 ? 118 ARG A CZ 1 ATOM 279 N NH1 . ARG A 1 42 ? 82.611 -29.054 1.025 1.00 127.49 ? 118 ARG A NH1 1 ATOM 280 N NH2 . ARG A 1 42 ? 80.369 -29.177 1.519 1.00 125.27 ? 118 ARG A NH2 1 ATOM 281 N N . GLN A 1 43 ? 84.462 -33.071 7.286 1.00 43.25 ? 119 GLN A N 1 ATOM 282 C CA . GLN A 1 43 ? 85.339 -34.141 7.794 1.00 40.26 ? 119 GLN A CA 1 ATOM 283 C C . GLN A 1 43 ? 85.934 -33.768 9.163 1.00 48.73 ? 119 GLN A C 1 ATOM 284 O O . GLN A 1 43 ? 87.147 -33.910 9.384 1.00 39.72 ? 119 GLN A O 1 ATOM 285 C CB . GLN A 1 43 ? 86.472 -34.492 6.798 1.00 49.73 ? 119 GLN A CB 1 ATOM 286 C CG . GLN A 1 43 ? 86.947 -35.976 6.858 1.00 68.23 ? 119 GLN A CG 1 ATOM 287 C CD . GLN A 1 43 ? 88.481 -36.151 6.901 1.00 70.06 ? 119 GLN A CD 1 ATOM 288 O OE1 . GLN A 1 43 ? 89.061 -36.858 6.071 1.00 72.77 ? 119 GLN A OE1 1 ATOM 289 N NE2 . GLN A 1 43 ? 89.129 -35.530 7.885 1.00 56.44 ? 119 GLN A NE2 1 ATOM 290 N N . ASN A 1 44 ? 85.079 -33.303 10.078 1.00 46.88 ? 120 ASN A N 1 ATOM 291 C CA . ASN A 1 44 ? 85.514 -32.971 11.431 1.00 43.43 ? 120 ASN A CA 1 ATOM 292 C C . ASN A 1 44 ? 85.996 -34.169 12.266 1.00 49.42 ? 120 ASN A C 1 ATOM 293 O O . ASN A 1 44 ? 85.391 -35.250 12.249 1.00 56.35 ? 120 ASN A O 1 ATOM 294 C CB . ASN A 1 44 ? 84.380 -32.279 12.182 1.00 48.14 ? 120 ASN A CB 1 ATOM 295 C CG . ASN A 1 44 ? 84.189 -30.847 11.758 1.00 47.02 ? 120 ASN A CG 1 ATOM 296 O OD1 . ASN A 1 44 ? 84.941 -29.963 12.173 1.00 48.68 ? 120 ASN A OD1 1 ATOM 297 N ND2 . ASN A 1 44 ? 83.166 -30.598 10.948 1.00 41.51 ? 120 ASN A ND2 1 ATOM 298 N N . PHE A 1 45 ? 87.085 -33.972 13.001 1.00 46.45 ? 121 PHE A N 1 ATOM 299 C CA . PHE A 1 45 ? 87.480 -34.927 14.038 1.00 39.80 ? 121 PHE A CA 1 ATOM 300 C C . PHE A 1 45 ? 88.305 -34.214 15.104 1.00 46.66 ? 121 PHE A C 1 ATOM 301 O O . PHE A 1 45 ? 88.752 -33.070 14.907 1.00 43.10 ? 121 PHE A O 1 ATOM 302 C CB . PHE A 1 45 ? 88.269 -36.108 13.454 1.00 42.18 ? 121 PHE A CB 1 ATOM 303 C CG . PHE A 1 45 ? 89.647 -35.740 12.960 1.00 47.34 ? 121 PHE A CG 1 ATOM 304 C CD1 . PHE A 1 45 ? 89.821 -35.160 11.700 1.00 38.17 ? 121 PHE A CD1 1 ATOM 305 C CD2 . PHE A 1 45 ? 90.774 -35.969 13.761 1.00 44.43 ? 121 PHE A CD2 1 ATOM 306 C CE1 . PHE A 1 45 ? 91.098 -34.828 11.247 1.00 45.89 ? 121 PHE A CE1 1 ATOM 307 C CE2 . PHE A 1 45 ? 92.056 -35.642 13.319 1.00 40.19 ? 121 PHE A CE2 1 ATOM 308 C CZ . PHE A 1 45 ? 92.223 -35.073 12.067 1.00 50.28 ? 121 PHE A CZ 1 ATOM 309 N N . VAL A 1 46 ? 88.500 -34.891 16.236 1.00 50.62 ? 122 VAL A N 1 ATOM 310 C CA . VAL A 1 46 ? 89.239 -34.321 17.358 1.00 42.54 ? 122 VAL A CA 1 ATOM 311 C C . VAL A 1 46 ? 90.507 -35.134 17.591 1.00 47.96 ? 122 VAL A C 1 ATOM 312 O O . VAL A 1 46 ? 90.489 -36.372 17.499 1.00 49.94 ? 122 VAL A O 1 ATOM 313 C CB . VAL A 1 46 ? 88.390 -34.311 18.661 1.00 40.75 ? 122 VAL A CB 1 ATOM 314 C CG1 . VAL A 1 46 ? 89.198 -33.735 19.840 1.00 38.49 ? 122 VAL A CG1 1 ATOM 315 C CG2 . VAL A 1 46 ? 87.120 -33.515 18.456 1.00 32.92 ? 122 VAL A CG2 1 ATOM 316 N N . SER A 1 47 ? 91.609 -34.441 17.869 1.00 34.00 ? 123 SER A N 1 ATOM 317 C CA . SER A 1 47 ? 92.829 -35.110 18.316 1.00 44.88 ? 123 SER A CA 1 ATOM 318 C C . SER A 1 47 ? 93.492 -34.284 19.418 1.00 45.84 ? 123 SER A C 1 ATOM 319 O O . SER A 1 47 ? 93.371 -33.052 19.445 1.00 53.30 ? 123 SER A O 1 ATOM 320 C CB . SER A 1 47 ? 93.796 -35.345 17.150 1.00 47.04 ? 123 SER A CB 1 ATOM 321 O OG . SER A 1 47 ? 94.704 -36.402 17.446 1.00 53.66 ? 123 SER A OG 1 ATOM 322 N N . CYS A 1 48 ? 94.185 -34.946 20.336 1.00 51.04 ? 124 CYS A N 1 ATOM 323 C CA . CYS A 1 48 ? 94.730 -34.215 21.481 1.00 53.86 ? 124 CYS A CA 1 ATOM 324 C C . CYS A 1 48 ? 96.241 -34.290 21.531 1.00 61.85 ? 124 CYS A C 1 ATOM 325 O O . CYS A 1 48 ? 96.847 -35.319 21.193 1.00 60.04 ? 124 CYS A O 1 ATOM 326 C CB . CYS A 1 48 ? 94.133 -34.726 22.799 1.00 44.15 ? 124 CYS A CB 1 ATOM 327 S SG . CYS A 1 48 ? 92.316 -34.806 22.790 1.00 61.78 ? 124 CYS A SG 1 ATOM 328 N N . SER A 1 49 ? 96.846 -33.177 21.925 1.00 56.54 ? 125 SER A N 1 ATOM 329 C CA . SER A 1 49 ? 98.280 -33.136 22.181 1.00 54.87 ? 125 SER A CA 1 ATOM 330 C C . SER A 1 49 ? 98.535 -33.255 23.673 1.00 67.46 ? 125 SER A C 1 ATOM 331 O O . SER A 1 49 ? 97.638 -33.561 24.466 1.00 76.03 ? 125 SER A O 1 ATOM 332 C CB . SER A 1 49 ? 98.888 -31.827 21.685 1.00 56.32 ? 125 SER A CB 1 ATOM 333 O OG . SER A 1 49 ? 98.286 -30.692 22.304 1.00 59.90 ? 125 SER A OG 1 ATOM 334 N N . ASP A 1 50 ? 99.777 -32.989 24.042 1.00 88.41 ? 126 ASP A N 1 ATOM 335 C CA . ASP A 1 50 ? 100.202 -32.998 25.430 1.00 102.19 ? 126 ASP A CA 1 ATOM 336 C C . ASP A 1 50 ? 99.731 -31.764 26.211 1.00 91.70 ? 126 ASP A C 1 ATOM 337 O O . ASP A 1 50 ? 100.115 -31.594 27.362 1.00 91.81 ? 126 ASP A O 1 ATOM 338 C CB . ASP A 1 50 ? 101.731 -33.078 25.470 1.00 112.06 ? 126 ASP A CB 1 ATOM 339 C CG . ASP A 1 50 ? 102.404 -32.028 24.577 1.00 115.18 ? 126 ASP A CG 1 ATOM 340 O OD1 . ASP A 1 50 ? 101.709 -31.299 23.832 1.00 108.45 ? 126 ASP A OD1 1 ATOM 341 O OD2 . ASP A 1 50 ? 103.646 -31.935 24.623 1.00 116.47 ? 126 ASP A OD2 1 ATOM 342 N N . LYS A 1 51 ? 98.905 -30.915 25.594 1.00 86.84 ? 127 LYS A N 1 ATOM 343 C CA . LYS A 1 51 ? 98.539 -29.632 26.189 1.00 71.37 ? 127 LYS A CA 1 ATOM 344 C C . LYS A 1 51 ? 97.111 -29.199 25.845 1.00 63.56 ? 127 LYS A C 1 ATOM 345 O O . LYS A 1 51 ? 96.527 -28.358 26.527 1.00 52.51 ? 127 LYS A O 1 ATOM 346 C CB . LYS A 1 51 ? 99.520 -28.543 25.746 1.00 66.17 ? 127 LYS A CB 1 ATOM 347 C CG . LYS A 1 51 ? 99.028 -27.735 24.549 1.00 81.40 ? 127 LYS A CG 1 ATOM 348 C CD . LYS A 1 51 ? 100.041 -26.651 24.166 1.00 91.98 ? 127 LYS A CD 1 ATOM 349 C CE . LYS A 1 51 ? 99.430 -25.622 23.208 1.00 75.79 ? 127 LYS A CE 1 ATOM 350 N NZ . LYS A 1 51 ? 100.088 -24.290 23.363 1.00 79.14 ? 127 LYS A NZ 1 ATOM 351 N N . GLU A 1 52 ? 96.546 -29.766 24.787 1.00 58.92 ? 128 GLU A N 1 ATOM 352 C CA . GLU A 1 52 ? 95.209 -29.360 24.379 1.00 62.76 ? 128 GLU A CA 1 ATOM 353 C C . GLU A 1 52 ? 94.534 -30.399 23.488 1.00 63.55 ? 128 GLU A C 1 ATOM 354 O O . GLU A 1 52 ? 95.166 -31.359 23.016 1.00 63.45 ? 128 GLU A O 1 ATOM 355 C CB . GLU A 1 52 ? 95.253 -27.993 23.662 1.00 57.69 ? 128 GLU A CB 1 ATOM 356 C CG . GLU A 1 52 ? 96.037 -28.024 22.367 1.00 64.14 ? 128 GLU A CG 1 ATOM 357 C CD . GLU A 1 52 ? 96.144 -26.670 21.697 1.00 76.02 ? 128 GLU A CD 1 ATOM 358 O OE1 . GLU A 1 52 ? 95.591 -25.685 22.241 1.00 75.81 ? 128 GLU A OE1 1 ATOM 359 O OE2 . GLU A 1 52 ? 96.790 -26.594 20.623 1.00 79.55 ? 128 GLU A OE2 1 ATOM 360 N N . CYS A 1 53 ? 93.241 -30.196 23.274 1.00 49.51 ? 129 CYS A N 1 ATOM 361 C CA . CYS A 1 53 ? 92.516 -30.953 22.273 1.00 47.23 ? 129 CYS A CA 1 ATOM 362 C C . CYS A 1 53 ? 92.184 -30.034 21.107 1.00 56.69 ? 129 CYS A C 1 ATOM 363 O O . CYS A 1 53 ? 91.798 -28.865 21.314 1.00 46.77 ? 129 CYS A O 1 ATOM 364 C CB . CYS A 1 53 ? 91.258 -31.580 22.869 1.00 46.61 ? 129 CYS A CB 1 ATOM 365 S SG . CYS A 1 53 ? 91.634 -33.116 23.759 1.00 71.72 ? 129 CYS A SG 1 ATOM 366 N N . ARG A 1 54 ? 92.368 -30.541 19.885 1.00 46.82 ? 130 ARG A N 1 ATOM 367 C CA . ARG A 1 54 ? 92.092 -29.727 18.710 1.00 42.51 ? 130 ARG A CA 1 ATOM 368 C C . ARG A 1 54 ? 90.997 -30.325 17.830 1.00 46.45 ? 130 ARG A C 1 ATOM 369 O O . ARG A 1 54 ? 90.864 -31.557 17.701 1.00 44.66 ? 130 ARG A O 1 ATOM 370 C CB . ARG A 1 54 ? 93.355 -29.510 17.874 1.00 53.37 ? 130 ARG A CB 1 ATOM 371 C CG . ARG A 1 54 ? 94.493 -28.816 18.570 1.00 37.92 ? 130 ARG A CG 1 ATOM 372 C CD . ARG A 1 54 ? 95.360 -28.073 17.552 1.00 37.35 ? 130 ARG A CD 1 ATOM 373 N NE . ARG A 1 54 ? 95.535 -26.671 17.945 1.00 51.24 ? 130 ARG A NE 1 ATOM 374 C CZ . ARG A 1 54 ? 95.107 -25.628 17.248 1.00 55.76 ? 130 ARG A CZ 1 ATOM 375 N NH1 . ARG A 1 54 ? 94.490 -25.799 16.087 1.00 46.49 ? 130 ARG A NH1 1 ATOM 376 N NH2 . ARG A 1 54 ? 95.312 -24.402 17.707 1.00 84.74 ? 130 ARG A NH2 1 ATOM 377 N N . ARG A 1 55 ? 90.229 -29.425 17.221 1.00 41.04 ? 131 ARG A N 1 ATOM 378 C CA . ARG A 1 55 ? 89.264 -29.771 16.185 1.00 48.47 ? 131 ARG A CA 1 ATOM 379 C C . ARG A 1 55 ? 89.922 -29.626 14.815 1.00 49.86 ? 131 ARG A C 1 ATOM 380 O O . ARG A 1 55 ? 90.310 -28.525 14.424 1.00 57.49 ? 131 ARG A O 1 ATOM 381 C CB . ARG A 1 55 ? 88.053 -28.822 16.263 1.00 47.43 ? 131 ARG A CB 1 ATOM 382 C CG . ARG A 1 55 ? 86.753 -29.451 15.816 1.00 44.35 ? 131 ARG A CG 1 ATOM 383 C CD . ARG A 1 55 ? 86.058 -28.647 14.745 1.00 49.30 ? 131 ARG A CD 1 ATOM 384 N NE . ARG A 1 55 ? 85.044 -27.762 15.311 1.00 58.04 ? 131 ARG A NE 1 ATOM 385 C CZ . ARG A 1 55 ? 83.874 -27.490 14.739 1.00 60.60 ? 131 ARG A CZ 1 ATOM 386 N NH1 . ARG A 1 55 ? 83.541 -28.042 13.576 1.00 45.18 ? 131 ARG A NH1 1 ATOM 387 N NH2 . ARG A 1 55 ? 83.032 -26.659 15.334 1.00 69.26 ? 131 ARG A NH2 1 ATOM 388 N N . PHE A 1 56 ? 90.068 -30.733 14.097 1.00 55.22 ? 132 PHE A N 1 ATOM 389 C CA . PHE A 1 56 ? 90.555 -30.692 12.715 1.00 49.43 ? 132 PHE A CA 1 ATOM 390 C C . PHE A 1 56 ? 89.388 -30.879 11.770 1.00 54.60 ? 132 PHE A C 1 ATOM 391 O O . PHE A 1 56 ? 88.432 -31.624 12.058 1.00 55.52 ? 132 PHE A O 1 ATOM 392 C CB . PHE A 1 56 ? 91.553 -31.810 12.438 1.00 38.56 ? 132 PHE A CB 1 ATOM 393 C CG . PHE A 1 56 ? 92.849 -31.650 13.137 1.00 42.02 ? 132 PHE A CG 1 ATOM 394 C CD1 . PHE A 1 56 ? 92.955 -31.915 14.495 1.00 47.11 ? 132 PHE A CD1 1 ATOM 395 C CD2 . PHE A 1 56 ? 93.975 -31.234 12.442 1.00 41.28 ? 132 PHE A CD2 1 ATOM 396 C CE1 . PHE A 1 56 ? 94.170 -31.761 15.152 1.00 53.95 ? 132 PHE A CE1 1 ATOM 397 C CE2 . PHE A 1 56 ? 95.194 -31.074 13.085 1.00 37.47 ? 132 PHE A CE2 1 ATOM 398 C CZ . PHE A 1 56 ? 95.293 -31.338 14.441 1.00 52.78 ? 132 PHE A CZ 1 ATOM 399 N N . PHE A 1 57 ? 89.483 -30.217 10.626 1.00 52.84 ? 133 PHE A N 1 ATOM 400 C CA . PHE A 1 57 ? 88.460 -30.315 9.596 1.00 52.19 ? 133 PHE A CA 1 ATOM 401 C C . PHE A 1 57 ? 89.051 -29.852 8.270 1.00 57.12 ? 133 PHE A C 1 ATOM 402 O O . PHE A 1 57 ? 90.159 -29.290 8.204 1.00 48.07 ? 133 PHE A O 1 ATOM 403 C CB . PHE A 1 57 ? 87.257 -29.433 9.947 1.00 38.18 ? 133 PHE A CB 1 ATOM 404 C CG . PHE A 1 57 ? 87.629 -27.992 10.144 1.00 55.57 ? 133 PHE A CG 1 ATOM 405 C CD1 . PHE A 1 57 ? 88.020 -27.529 11.406 1.00 42.40 ? 133 PHE A CD1 1 ATOM 406 C CD2 . PHE A 1 57 ? 87.648 -27.106 9.062 1.00 47.69 ? 133 PHE A CD2 1 ATOM 407 C CE1 . PHE A 1 57 ? 88.409 -26.204 11.594 1.00 43.16 ? 133 PHE A CE1 1 ATOM 408 C CE2 . PHE A 1 57 ? 88.030 -25.776 9.246 1.00 50.15 ? 133 PHE A CE2 1 ATOM 409 C CZ . PHE A 1 57 ? 88.411 -25.322 10.517 1.00 51.79 ? 133 PHE A CZ 1 ATOM 410 N N . VAL A 1 58 ? 88.283 -30.076 7.217 1.00 59.52 ? 134 VAL A N 1 ATOM 411 C CA . VAL A 1 58 ? 88.653 -29.630 5.895 1.00 50.97 ? 134 VAL A CA 1 ATOM 412 C C . VAL A 1 58 ? 87.669 -28.543 5.488 1.00 49.96 ? 134 VAL A C 1 ATOM 413 O O . VAL A 1 58 ? 86.488 -28.592 5.873 1.00 45.35 ? 134 VAL A O 1 ATOM 414 C CB . VAL A 1 58 ? 88.633 -30.820 4.923 1.00 50.96 ? 134 VAL A CB 1 ATOM 415 C CG1 . VAL A 1 58 ? 88.736 -30.362 3.483 1.00 55.92 ? 134 VAL A CG1 1 ATOM 416 C CG2 . VAL A 1 58 ? 89.772 -31.772 5.267 1.00 48.00 ? 134 VAL A CG2 1 ATOM 417 N N . SER A 1 59 ? 88.143 -27.540 4.750 1.00 52.01 ? 135 SER A N 1 ATOM 418 C CA . SER A 1 59 ? 87.230 -26.517 4.232 1.00 59.64 ? 135 SER A CA 1 ATOM 419 C C . SER A 1 59 ? 87.691 -25.853 2.934 1.00 68.13 ? 135 SER A C 1 ATOM 420 O O . SER A 1 59 ? 88.872 -25.906 2.591 1.00 63.64 ? 135 SER A O 1 ATOM 421 C CB . SER A 1 59 ? 86.985 -25.448 5.296 1.00 65.69 ? 135 SER A CB 1 ATOM 422 O OG . SER A 1 59 ? 85.961 -24.562 4.887 1.00 86.12 ? 135 SER A OG 1 ATOM 423 N N . MET A 1 60 ? 86.747 -25.245 2.215 1.00 74.92 ? 136 MET A N 1 ATOM 424 C CA . MET A 1 60 ? 87.083 -24.316 1.135 1.00 74.88 ? 136 MET A CA 1 ATOM 425 C C . MET A 1 60 ? 86.894 -22.862 1.600 1.00 94.00 ? 136 MET A C 1 ATOM 426 O O . MET A 1 60 ? 87.866 -22.115 1.707 1.00 108.31 ? 136 MET A O 1 ATOM 427 C CB . MET A 1 60 ? 86.228 -24.559 -0.102 1.00 58.62 ? 136 MET A CB 1 ATOM 428 C CG . MET A 1 60 ? 86.370 -25.902 -0.771 1.00 62.93 ? 136 MET A CG 1 ATOM 429 S SD . MET A 1 60 ? 85.305 -25.880 -2.244 1.00 75.18 ? 136 MET A SD 1 ATOM 430 C CE . MET A 1 60 ? 84.852 -27.602 -2.396 1.00 106.98 ? 136 MET A CE 1 ATOM 431 N N . GLY A 1 61 ? 85.648 -22.478 1.891 1.00 96.39 ? 137 GLY A N 1 ATOM 432 C CA . GLY A 1 61 ? 85.333 -21.132 2.355 1.00 104.98 ? 137 GLY A CA 1 ATOM 433 C C . GLY A 1 61 ? 84.336 -20.961 3.503 1.00 103.33 ? 137 GLY A C 1 ATOM 434 O O . GLY A 1 61 ? 84.316 -21.737 4.470 1.00 92.54 ? 137 GLY A O 1 ATOM 435 N N . TYR A 1 62 ? 83.496 -19.932 3.378 1.00 106.33 ? 138 TYR A N 1 ATOM 436 C CA . TYR A 1 62 ? 82.690 -19.424 4.491 1.00 109.99 ? 138 TYR A CA 1 ATOM 437 C C . TYR A 1 62 ? 81.200 -19.399 4.151 1.00 106.30 ? 138 TYR A C 1 ATOM 438 O O . TYR A 1 62 ? 80.390 -18.813 4.876 1.00 95.17 ? 138 TYR A O 1 ATOM 439 C CB . TYR A 1 62 ? 83.165 -18.009 4.873 1.00 109.90 ? 138 TYR A CB 1 ATOM 440 C CG . TYR A 1 62 ? 84.608 -17.933 5.349 1.00 118.65 ? 138 TYR A CG 1 ATOM 441 C CD1 . TYR A 1 62 ? 85.668 -17.939 4.447 1.00 127.09 ? 138 TYR A CD1 1 ATOM 442 C CD2 . TYR A 1 62 ? 84.906 -17.860 6.700 1.00 126.34 ? 138 TYR A CD2 1 ATOM 443 C CE1 . TYR A 1 62 ? 86.985 -17.877 4.882 1.00 135.31 ? 138 TYR A CE1 1 ATOM 444 C CE2 . TYR A 1 62 ? 86.219 -17.794 7.145 1.00 135.89 ? 138 TYR A CE2 1 ATOM 445 C CZ . TYR A 1 62 ? 87.255 -17.809 6.233 1.00 141.48 ? 138 TYR A CZ 1 ATOM 446 O OH . TYR A 1 62 ? 88.558 -17.748 6.681 1.00 142.15 ? 138 TYR A OH 1 ATOM 447 N N . VAL A 1 73 ? 85.425 -33.414 -3.224 1.00 90.60 ? 149 VAL A N 1 ATOM 448 C CA . VAL A 1 73 ? 86.810 -33.371 -3.703 1.00 96.05 ? 149 VAL A CA 1 ATOM 449 C C . VAL A 1 73 ? 87.095 -32.162 -4.616 1.00 97.22 ? 149 VAL A C 1 ATOM 450 O O . VAL A 1 73 ? 86.604 -32.086 -5.749 1.00 101.43 ? 149 VAL A O 1 ATOM 451 C CB . VAL A 1 73 ? 87.206 -34.691 -4.429 1.00 108.55 ? 149 VAL A CB 1 ATOM 452 C CG1 . VAL A 1 73 ? 88.621 -34.611 -4.971 1.00 103.93 ? 149 VAL A CG1 1 ATOM 453 C CG2 . VAL A 1 73 ? 87.068 -35.882 -3.491 1.00 104.97 ? 149 VAL A CG2 1 ATOM 454 N N . SER A 1 74 ? 87.899 -31.227 -4.114 1.00 82.01 ? 150 SER A N 1 ATOM 455 C CA . SER A 1 74 ? 88.277 -30.036 -4.866 1.00 64.91 ? 150 SER A CA 1 ATOM 456 C C . SER A 1 74 ? 89.738 -29.660 -4.647 1.00 56.91 ? 150 SER A C 1 ATOM 457 O O . SER A 1 74 ? 90.293 -29.865 -3.571 1.00 63.56 ? 150 SER A O 1 ATOM 458 C CB . SER A 1 74 ? 87.392 -28.860 -4.465 1.00 68.38 ? 150 SER A CB 1 ATOM 459 O OG . SER A 1 74 ? 88.140 -27.655 -4.435 1.00 62.85 ? 150 SER A OG 1 ATOM 460 N N . GLU A 1 75 ? 90.346 -29.078 -5.674 1.00 67.04 ? 151 GLU A N 1 ATOM 461 C CA . GLU A 1 75 ? 91.740 -28.616 -5.632 1.00 53.76 ? 151 GLU A CA 1 ATOM 462 C C . GLU A 1 75 ? 91.959 -27.559 -4.558 1.00 47.09 ? 151 GLU A C 1 ATOM 463 O O . GLU A 1 75 ? 93.099 -27.201 -4.249 1.00 47.04 ? 151 GLU A O 1 ATOM 464 C CB . GLU A 1 75 ? 92.138 -28.002 -6.987 1.00 64.84 ? 151 GLU A CB 1 ATOM 465 C CG . GLU A 1 75 ? 93.095 -28.829 -7.847 1.00 84.39 ? 151 GLU A CG 1 ATOM 466 C CD . GLU A 1 75 ? 93.403 -28.161 -9.197 1.00 94.61 ? 151 GLU A CD 1 ATOM 467 O OE1 . GLU A 1 75 ? 93.380 -26.908 -9.268 1.00 85.45 ? 151 GLU A OE1 1 ATOM 468 O OE2 . GLU A 1 75 ? 93.666 -28.891 -10.184 1.00 89.03 ? 151 GLU A OE2 1 ATOM 469 N N . GLN A 1 76 ? 90.871 -27.034 -4.003 1.00 54.74 ? 152 GLN A N 1 ATOM 470 C CA . GLN A 1 76 ? 91.004 -25.874 -3.141 1.00 52.88 ? 152 GLN A CA 1 ATOM 471 C C . GLN A 1 76 ? 90.553 -26.091 -1.689 1.00 51.62 ? 152 GLN A C 1 ATOM 472 O O . GLN A 1 76 ? 90.449 -25.139 -0.911 1.00 59.48 ? 152 GLN A O 1 ATOM 473 C CB . GLN A 1 76 ? 90.396 -24.605 -3.799 1.00 57.80 ? 152 GLN A CB 1 ATOM 474 C CG . GLN A 1 76 ? 88.909 -24.625 -4.139 1.00 69.15 ? 152 GLN A CG 1 ATOM 475 C CD . GLN A 1 76 ? 88.481 -23.400 -4.980 1.00 76.27 ? 152 GLN A CD 1 ATOM 476 O OE1 . GLN A 1 76 ? 87.703 -22.549 -4.529 1.00 85.23 ? 152 GLN A OE1 1 ATOM 477 N NE2 . GLN A 1 76 ? 88.994 -23.315 -6.199 1.00 65.97 ? 152 GLN A NE2 1 ATOM 478 N N . MET A 1 77 ? 90.329 -27.348 -1.316 1.00 53.63 ? 156 MET A N 1 ATOM 479 C CA . MET A 1 77 ? 90.131 -27.694 0.092 1.00 48.11 ? 156 MET A CA 1 ATOM 480 C C . MET A 1 77 ? 91.440 -27.746 0.850 1.00 47.70 ? 156 MET A C 1 ATOM 481 O O . MET A 1 77 ? 92.446 -28.292 0.367 1.00 50.18 ? 156 MET A O 1 ATOM 482 C CB . MET A 1 77 ? 89.398 -29.018 0.242 1.00 49.18 ? 156 MET A CB 1 ATOM 483 C CG . MET A 1 77 ? 88.098 -29.008 -0.477 1.00 62.45 ? 156 MET A CG 1 ATOM 484 S SD . MET A 1 77 ? 86.751 -29.591 0.517 1.00 92.87 ? 156 MET A SD 1 ATOM 485 C CE . MET A 1 77 ? 85.995 -30.714 -0.683 1.00 46.77 ? 156 MET A CE 1 ATOM 486 N N . ASN A 1 78 ? 91.407 -27.150 2.040 1.00 55.61 ? 157 ASN A N 1 ATOM 487 C CA . ASN A 1 78 ? 92.523 -27.194 2.969 1.00 56.91 ? 157 ASN A CA 1 ATOM 488 C C . ASN A 1 78 ? 92.175 -27.948 4.230 1.00 51.64 ? 157 ASN A C 1 ATOM 489 O O . ASN A 1 78 ? 90.998 -28.183 4.522 1.00 51.20 ? 157 ASN A O 1 ATOM 490 C CB . ASN A 1 78 ? 92.970 -25.783 3.306 1.00 54.04 ? 157 ASN A CB 1 ATOM 491 C CG . ASN A 1 78 ? 93.530 -25.069 2.100 1.00 57.74 ? 157 ASN A CG 1 ATOM 492 O OD1 . ASN A 1 78 ? 94.173 -25.691 1.250 1.00 56.78 ? 157 ASN A OD1 1 ATOM 493 N ND2 . ASN A 1 78 ? 93.291 -23.767 2.009 1.00 58.91 ? 157 ASN A ND2 1 ATOM 494 N N . VAL A 1 79 ? 93.206 -28.365 4.951 1.00 53.44 ? 158 VAL A N 1 ATOM 495 C CA . VAL A 1 79 ? 93.028 -28.896 6.295 1.00 52.18 ? 158 VAL A CA 1 ATOM 496 C C . VAL A 1 79 ? 93.340 -27.773 7.288 1.00 48.54 ? 158 VAL A C 1 ATOM 497 O O . VAL A 1 79 ? 94.400 -27.134 7.228 1.00 48.83 ? 158 VAL A O 1 ATOM 498 C CB . VAL A 1 79 ? 93.947 -30.102 6.559 1.00 55.22 ? 158 VAL A CB 1 ATOM 499 C CG1 . VAL A 1 79 ? 93.465 -30.884 7.792 1.00 47.17 ? 158 VAL A CG1 1 ATOM 500 C CG2 . VAL A 1 79 ? 93.993 -31.005 5.337 1.00 47.09 ? 158 VAL A CG2 1 ATOM 501 N N . TYR A 1 80 ? 92.399 -27.500 8.180 1.00 44.98 ? 159 TYR A N 1 ATOM 502 C CA . TYR A 1 80 ? 92.665 -26.555 9.263 1.00 47.42 ? 159 TYR A CA 1 ATOM 503 C C . TYR A 1 80 ? 92.406 -27.224 10.604 1.00 47.66 ? 159 TYR A C 1 ATOM 504 O O . TYR A 1 80 ? 91.741 -28.270 10.688 1.00 60.46 ? 159 TYR A O 1 ATOM 505 C CB . TYR A 1 80 ? 91.770 -25.310 9.159 1.00 48.73 ? 159 TYR A CB 1 ATOM 506 C CG . TYR A 1 80 ? 91.798 -24.569 7.829 1.00 50.97 ? 159 TYR A CG 1 ATOM 507 C CD1 . TYR A 1 80 ? 92.713 -23.540 7.598 1.00 43.99 ? 159 TYR A CD1 1 ATOM 508 C CD2 . TYR A 1 80 ? 90.881 -24.877 6.814 1.00 53.58 ? 159 TYR A CD2 1 ATOM 509 C CE1 . TYR A 1 80 ? 92.722 -22.849 6.394 1.00 48.28 ? 159 TYR A CE1 1 ATOM 510 C CE2 . TYR A 1 80 ? 90.887 -24.195 5.610 1.00 51.20 ? 159 TYR A CE2 1 ATOM 511 C CZ . TYR A 1 80 ? 91.807 -23.181 5.412 1.00 56.43 ? 159 TYR A CZ 1 ATOM 512 O OH . TYR A 1 80 ? 91.818 -22.502 4.228 1.00 51.79 ? 159 TYR A OH 1 ATOM 513 N N . SER A 1 81 ? 92.924 -26.616 11.659 1.00 49.62 ? 160 SER A N 1 ATOM 514 C CA . SER A 1 81 ? 92.460 -26.968 12.995 1.00 54.04 ? 160 SER A CA 1 ATOM 515 C C . SER A 1 81 ? 92.165 -25.706 13.790 1.00 46.42 ? 160 SER A C 1 ATOM 516 O O . SER A 1 81 ? 92.715 -24.636 13.480 1.00 46.17 ? 160 SER A O 1 ATOM 517 C CB . SER A 1 81 ? 93.476 -27.846 13.739 1.00 40.69 ? 160 SER A CB 1 ATOM 518 O OG . SER A 1 81 ? 94.608 -27.081 14.132 1.00 50.72 ? 160 SER A OG 1 ATOM 519 N N . VAL A 1 82 ? 91.280 -25.831 14.785 1.00 42.99 ? 161 VAL A N 1 ATOM 520 C CA . VAL A 1 82 ? 91.199 -24.844 15.874 1.00 38.49 ? 161 VAL A CA 1 ATOM 521 C C . VAL A 1 82 ? 91.307 -25.569 17.194 1.00 43.41 ? 161 VAL A C 1 ATOM 522 O O . VAL A 1 82 ? 91.246 -26.801 17.259 1.00 54.70 ? 161 VAL A O 1 ATOM 523 C CB . VAL A 1 82 ? 89.859 -24.068 15.882 1.00 41.35 ? 161 VAL A CB 1 ATOM 524 C CG1 . VAL A 1 82 ? 89.682 -23.276 14.583 1.00 34.59 ? 161 VAL A CG1 1 ATOM 525 C CG2 . VAL A 1 82 ? 88.693 -25.039 16.103 1.00 44.72 ? 161 VAL A CG2 1 ATOM 526 N N . LYS A 1 83 ? 91.451 -24.806 18.264 1.00 53.93 ? 162 LYS A N 1 ATOM 527 C CA . LYS A 1 83 ? 91.415 -25.412 19.578 1.00 53.76 ? 162 LYS A CA 1 ATOM 528 C C . LYS A 1 83 ? 89.987 -25.875 19.880 1.00 52.63 ? 162 LYS A C 1 ATOM 529 O O . LYS A 1 83 ? 89.013 -25.150 19.578 1.00 42.40 ? 162 LYS A O 1 ATOM 530 C CB . LYS A 1 83 ? 91.855 -24.424 20.634 1.00 60.22 ? 162 LYS A CB 1 ATOM 531 C CG . LYS A 1 83 ? 92.118 -25.097 21.950 1.00 58.63 ? 162 LYS A CG 1 ATOM 532 C CD . LYS A 1 83 ? 91.911 -24.139 23.075 1.00 62.79 ? 162 LYS A CD 1 ATOM 533 C CE . LYS A 1 83 ? 92.631 -24.631 24.307 1.00 71.51 ? 162 LYS A CE 1 ATOM 534 N NZ . LYS A 1 83 ? 93.248 -23.477 25.011 1.00 84.15 ? 162 LYS A NZ 1 ATOM 535 N N . LEU A 1 84 ? 89.861 -27.077 20.454 1.00 38.25 ? 163 LEU A N 1 ATOM 536 C CA . LEU A 1 84 ? 88.541 -27.599 20.778 1.00 49.68 ? 163 LEU A CA 1 ATOM 537 C C . LEU A 1 84 ? 87.835 -26.580 21.662 1.00 53.84 ? 163 LEU A C 1 ATOM 538 O O . LEU A 1 84 ? 88.366 -26.179 22.703 1.00 63.57 ? 163 LEU A O 1 ATOM 539 C CB . LEU A 1 84 ? 88.619 -28.955 21.477 1.00 51.06 ? 163 LEU A CB 1 ATOM 540 C CG . LEU A 1 84 ? 87.222 -29.520 21.720 1.00 48.23 ? 163 LEU A CG 1 ATOM 541 C CD1 . LEU A 1 84 ? 86.382 -29.488 20.438 1.00 49.47 ? 163 LEU A CD1 1 ATOM 542 C CD2 . LEU A 1 84 ? 87.314 -30.928 22.275 1.00 39.08 ? 163 LEU A CD2 1 ATOM 543 N N . GLY A 1 85 ? 86.666 -26.125 21.219 1.00 45.06 ? 164 GLY A N 1 ATOM 544 C CA . GLY A 1 85 ? 85.949 -25.087 21.944 1.00 46.58 ? 164 GLY A CA 1 ATOM 545 C C . GLY A 1 85 ? 86.020 -23.704 21.310 1.00 60.89 ? 164 GLY A C 1 ATOM 546 O O . GLY A 1 85 ? 85.098 -22.893 21.483 1.00 55.88 ? 164 GLY A O 1 ATOM 547 N N . ASP A 1 86 ? 87.103 -23.411 20.589 1.00 55.77 ? 165 ASP A N 1 ATOM 548 C CA . ASP A 1 86 ? 87.119 -22.195 19.780 1.00 57.19 ? 165 ASP A CA 1 ATOM 549 C C . ASP A 1 86 ? 86.228 -22.395 18.552 1.00 61.17 ? 165 ASP A C 1 ATOM 550 O O . ASP A 1 86 ? 86.108 -23.509 18.039 1.00 62.01 ? 165 ASP A O 1 ATOM 551 C CB . ASP A 1 86 ? 88.547 -21.788 19.390 1.00 64.34 ? 165 ASP A CB 1 ATOM 552 C CG . ASP A 1 86 ? 89.394 -21.399 20.601 1.00 78.52 ? 165 ASP A CG 1 ATOM 553 O OD1 . ASP A 1 86 ? 88.816 -21.230 21.700 1.00 77.76 ? 165 ASP A OD1 1 ATOM 554 O OD2 . ASP A 1 86 ? 90.629 -21.261 20.458 1.00 78.08 ? 165 ASP A OD2 1 ATOM 555 N N . PRO A 1 87 ? 85.542 -21.327 18.123 1.00 65.60 ? 166 PRO A N 1 ATOM 556 C CA . PRO A 1 87 ? 84.746 -21.393 16.889 1.00 64.90 ? 166 PRO A CA 1 ATOM 557 C C . PRO A 1 87 ? 85.638 -21.177 15.667 1.00 70.29 ? 166 PRO A C 1 ATOM 558 O O . PRO A 1 87 ? 86.577 -20.379 15.733 1.00 77.47 ? 166 PRO A O 1 ATOM 559 C CB . PRO A 1 87 ? 83.755 -20.233 17.050 1.00 54.53 ? 166 PRO A CB 1 ATOM 560 C CG . PRO A 1 87 ? 84.458 -19.257 17.953 1.00 51.88 ? 166 PRO A CG 1 ATOM 561 C CD . PRO A 1 87 ? 85.317 -20.079 18.882 1.00 47.87 ? 166 PRO A CD 1 ATOM 562 N N . PRO A 1 88 ? 85.361 -21.894 14.567 1.00 62.73 ? 167 PRO A N 1 ATOM 563 C CA . PRO A 1 88 ? 86.185 -21.787 13.354 1.00 56.17 ? 167 PRO A CA 1 ATOM 564 C C . PRO A 1 88 ? 86.025 -20.454 12.617 1.00 59.05 ? 167 PRO A C 1 ATOM 565 O O . PRO A 1 88 ? 85.436 -20.401 11.540 1.00 75.30 ? 167 PRO A O 1 ATOM 566 C CB . PRO A 1 88 ? 85.682 -22.937 12.485 1.00 54.48 ? 167 PRO A CB 1 ATOM 567 C CG . PRO A 1 88 ? 84.290 -23.212 12.990 1.00 66.21 ? 167 PRO A CG 1 ATOM 568 C CD . PRO A 1 88 ? 84.331 -22.942 14.454 1.00 56.00 ? 167 PRO A CD 1 ATOM 569 N N . THR A 1 89 ? 86.568 -19.395 13.202 1.00 56.84 ? 168 THR A N 1 ATOM 570 C CA . THR A 1 89 ? 86.610 -18.072 12.586 1.00 66.86 ? 168 THR A CA 1 ATOM 571 C C . THR A 1 89 ? 88.030 -17.829 12.077 1.00 77.57 ? 168 THR A C 1 ATOM 572 O O . THR A 1 89 ? 88.969 -18.498 12.534 1.00 64.56 ? 168 THR A O 1 ATOM 573 C CB . THR A 1 89 ? 86.234 -16.964 13.604 1.00 58.28 ? 168 THR A CB 1 ATOM 574 O OG1 . THR A 1 89 ? 87.215 -16.914 14.652 1.00 69.66 ? 168 THR A OG1 1 ATOM 575 C CG2 . THR A 1 89 ? 84.874 -17.239 14.208 1.00 49.73 ? 168 THR A CG2 1 ATOM 576 N N . PRO A 1 90 ? 88.187 -16.892 11.117 1.00 87.47 ? 169 PRO A N 1 ATOM 577 C CA . PRO A 1 90 ? 89.496 -16.546 10.543 1.00 88.83 ? 169 PRO A CA 1 ATOM 578 C C . PRO A 1 90 ? 90.590 -16.330 11.582 1.00 82.85 ? 169 PRO A C 1 ATOM 579 O O . PRO A 1 90 ? 91.708 -16.812 11.395 1.00 76.08 ? 169 PRO A O 1 ATOM 580 C CB . PRO A 1 90 ? 89.201 -15.239 9.807 1.00 92.52 ? 169 PRO A CB 1 ATOM 581 C CG . PRO A 1 90 ? 87.807 -15.440 9.307 1.00 93.12 ? 169 PRO A CG 1 ATOM 582 C CD . PRO A 1 90 ? 87.090 -16.220 10.390 1.00 87.56 ? 169 PRO A CD 1 ATOM 583 N N . ASP A 1 91 ? 90.255 -15.623 12.657 1.00 88.46 ? 170 ASP A N 1 ATOM 584 C CA . ASP A 1 91 ? 91.182 -15.346 13.749 1.00 95.30 ? 170 ASP A CA 1 ATOM 585 C C . ASP A 1 91 ? 91.802 -16.629 14.289 1.00 83.41 ? 170 ASP A C 1 ATOM 586 O O . ASP A 1 91 ? 93.019 -16.729 14.469 1.00 84.03 ? 170 ASP A O 1 ATOM 587 C CB . ASP A 1 91 ? 90.438 -14.645 14.901 1.00 119.28 ? 170 ASP A CB 1 ATOM 588 C CG . ASP A 1 91 ? 89.359 -13.679 14.416 1.00 133.66 ? 170 ASP A CG 1 ATOM 589 O OD1 . ASP A 1 91 ? 89.054 -13.665 13.201 1.00 132.12 ? 170 ASP A OD1 1 ATOM 590 O OD2 . ASP A 1 91 ? 88.805 -12.940 15.260 1.00 140.60 ? 170 ASP A OD2 1 ATOM 591 N N . LYS A 1 92 A 90.942 -17.615 14.520 1.00 75.43 ? 170 LYS A N 1 ATOM 592 C CA . LYS A 1 92 A 91.282 -18.790 15.311 1.00 78.23 ? 170 LYS A CA 1 ATOM 593 C C . LYS A 1 92 A 91.815 -19.985 14.497 1.00 73.36 ? 170 LYS A C 1 ATOM 594 O O . LYS A 1 92 A 92.244 -20.995 15.069 1.00 66.29 ? 170 LYS A O 1 ATOM 595 C CB . LYS A 1 92 A 90.054 -19.205 16.138 1.00 74.29 ? 170 LYS A CB 1 ATOM 596 C CG . LYS A 1 92 A 89.584 -18.155 17.140 1.00 72.86 ? 170 LYS A CG 1 ATOM 597 C CD . LYS A 1 92 A 90.394 -18.233 18.443 1.00 81.48 ? 170 LYS A CD 1 ATOM 598 C CE . LYS A 1 92 A 89.774 -17.428 19.582 1.00 76.52 ? 170 LYS A CE 1 ATOM 599 N NZ . LYS A 1 92 A 88.284 -17.372 19.477 1.00 92.01 ? 170 LYS A NZ 1 ATOM 600 N N . LEU A 1 93 ? 91.796 -19.866 13.171 1.00 75.89 ? 171 LEU A N 1 ATOM 601 C CA . LEU A 1 93 ? 92.264 -20.945 12.293 1.00 66.26 ? 171 LEU A CA 1 ATOM 602 C C . LEU A 1 93 ? 93.780 -21.131 12.247 1.00 62.75 ? 171 LEU A C 1 ATOM 603 O O . LEU A 1 93 ? 94.556 -20.173 12.290 1.00 74.67 ? 171 LEU A O 1 ATOM 604 C CB . LEU A 1 93 ? 91.782 -20.720 10.870 1.00 52.41 ? 171 LEU A CB 1 ATOM 605 C CG . LEU A 1 93 ? 90.569 -21.528 10.450 1.00 59.25 ? 171 LEU A CG 1 ATOM 606 C CD1 . LEU A 1 93 ? 89.467 -21.379 11.458 1.00 61.99 ? 171 LEU A CD1 1 ATOM 607 C CD2 . LEU A 1 93 ? 90.114 -21.030 9.110 1.00 76.67 ? 171 LEU A CD2 1 ATOM 608 N N . LYS A 1 94 ? 94.181 -22.390 12.169 1.00 53.20 ? 172 LYS A N 1 ATOM 609 C CA . LYS A 1 94 ? 95.552 -22.769 11.860 1.00 54.55 ? 172 LYS A CA 1 ATOM 610 C C . LYS A 1 94 ? 95.534 -23.573 10.557 1.00 57.48 ? 172 LYS A C 1 ATOM 611 O O . LYS A 1 94 ? 94.892 -24.636 10.470 1.00 51.90 ? 172 LYS A O 1 ATOM 612 C CB . LYS A 1 94 ? 96.127 -23.651 12.965 1.00 48.24 ? 172 LYS A CB 1 ATOM 613 C CG . LYS A 1 94 ? 97.485 -24.243 12.644 1.00 49.00 ? 172 LYS A CG 1 ATOM 614 C CD . LYS A 1 94 ? 98.051 -24.994 13.851 1.00 64.95 ? 172 LYS A CD 1 ATOM 615 C CE . LYS A 1 94 ? 99.510 -25.367 13.637 1.00 57.70 ? 172 LYS A CE 1 ATOM 616 N NZ . LYS A 1 94 ? 100.303 -24.172 13.204 1.00 71.85 ? 172 LYS A NZ 1 ATOM 617 N N . PHE A 1 95 ? 96.222 -23.066 9.541 1.00 51.63 ? 173 PHE A N 1 ATOM 618 C CA . PHE A 1 95 ? 96.442 -23.862 8.354 1.00 50.50 ? 173 PHE A CA 1 ATOM 619 C C . PHE A 1 95 ? 97.263 -25.120 8.710 1.00 51.63 ? 173 PHE A C 1 ATOM 620 O O . PHE A 1 95 ? 98.328 -25.035 9.348 1.00 45.94 ? 173 PHE A O 1 ATOM 621 C CB . PHE A 1 95 ? 97.158 -23.049 7.278 1.00 37.92 ? 173 PHE A CB 1 ATOM 622 C CG . PHE A 1 95 ? 97.310 -23.788 5.985 1.00 44.31 ? 173 PHE A CG 1 ATOM 623 C CD1 . PHE A 1 95 ? 98.415 -24.614 5.755 1.00 34.96 ? 173 PHE A CD1 1 ATOM 624 C CD2 . PHE A 1 95 ? 96.321 -23.695 5.006 1.00 42.96 ? 173 PHE A CD2 1 ATOM 625 C CE1 . PHE A 1 95 ? 98.528 -25.323 4.559 1.00 42.01 ? 173 PHE A CE1 1 ATOM 626 C CE2 . PHE A 1 95 ? 96.438 -24.396 3.809 1.00 36.72 ? 173 PHE A CE2 1 ATOM 627 C CZ . PHE A 1 95 ? 97.543 -25.202 3.583 1.00 39.24 ? 173 PHE A CZ 1 ATOM 628 N N . GLU A 1 96 ? 96.761 -26.284 8.306 1.00 38.60 ? 174 GLU A N 1 ATOM 629 C CA . GLU A 1 96 ? 97.493 -27.537 8.508 1.00 46.46 ? 174 GLU A CA 1 ATOM 630 C C . GLU A 1 96 ? 98.100 -28.091 7.200 1.00 48.83 ? 174 GLU A C 1 ATOM 631 O O . GLU A 1 96 ? 99.293 -28.398 7.151 1.00 47.65 ? 174 GLU A O 1 ATOM 632 C CB . GLU A 1 96 ? 96.613 -28.597 9.214 1.00 51.81 ? 174 GLU A CB 1 ATOM 633 C CG . GLU A 1 96 ? 96.073 -28.174 10.597 1.00 50.66 ? 174 GLU A CG 1 ATOM 634 C CD . GLU A 1 96 ? 97.147 -28.131 11.705 1.00 65.53 ? 174 GLU A CD 1 ATOM 635 O OE1 . GLU A 1 96 ? 98.347 -28.358 11.412 1.00 58.27 ? 174 GLU A OE1 1 ATOM 636 O OE2 . GLU A 1 96 ? 96.783 -27.873 12.883 1.00 67.26 ? 174 GLU A OE2 1 ATOM 637 N N . ALA A 1 97 ? 97.291 -28.195 6.145 1.00 45.55 ? 175 ALA A N 1 ATOM 638 C CA . ALA A 1 97 ? 97.742 -28.788 4.882 1.00 49.58 ? 175 ALA A CA 1 ATOM 639 C C . ALA A 1 97 ? 96.757 -28.501 3.762 1.00 54.76 ? 175 ALA A C 1 ATOM 640 O O . ALA A 1 97 ? 95.652 -27.996 3.999 1.00 56.99 ? 175 ALA A O 1 ATOM 641 C CB . ALA A 1 97 ? 97.947 -30.316 5.021 1.00 36.87 ? 175 ALA A CB 1 ATOM 642 N N . VAL A 1 98 ? 97.173 -28.828 2.541 1.00 45.52 ? 176 VAL A N 1 ATOM 643 C CA . VAL A 1 98 ? 96.270 -28.838 1.415 1.00 47.45 ? 176 VAL A CA 1 ATOM 644 C C . VAL A 1 98 ? 95.760 -30.271 1.318 1.00 55.84 ? 176 VAL A C 1 ATOM 645 O O . VAL A 1 98 ? 96.555 -31.220 1.369 1.00 50.36 ? 176 VAL A O 1 ATOM 646 C CB . VAL A 1 98 ? 97.010 -28.441 0.114 1.00 56.40 ? 176 VAL A CB 1 ATOM 647 C CG1 . VAL A 1 98 ? 96.104 -28.605 -1.118 1.00 47.90 ? 176 VAL A CG1 1 ATOM 648 C CG2 . VAL A 1 98 ? 97.556 -27.012 0.217 1.00 51.19 ? 176 VAL A CG2 1 ATOM 649 N N . GLY A 1 99 ? 94.445 -30.440 1.217 1.00 43.13 ? 177 GLY A N 1 ATOM 650 C CA . GLY A 1 99 ? 93.884 -31.769 1.064 1.00 43.97 ? 177 GLY A CA 1 ATOM 651 C C . GLY A 1 99 ? 92.421 -31.819 1.444 1.00 47.32 ? 177 GLY A C 1 ATOM 652 O O . GLY A 1 99 ? 91.890 -30.844 1.985 1.00 40.76 ? 177 GLY A O 1 ATOM 653 N N . TRP A 1 100 ? 91.771 -32.951 1.169 1.00 43.36 ? 178 TRP A N 1 ATOM 654 C CA . TRP A 1 100 ? 90.327 -33.074 1.375 1.00 39.90 ? 178 TRP A CA 1 ATOM 655 C C . TRP A 1 100 ? 90.007 -34.224 2.333 1.00 49.64 ? 178 TRP A C 1 ATOM 656 O O . TRP A 1 100 ? 88.849 -34.460 2.688 1.00 49.42 ? 178 TRP A O 1 ATOM 657 C CB . TRP A 1 100 ? 89.630 -33.283 0.028 1.00 41.45 ? 178 TRP A CB 1 ATOM 658 C CG . TRP A 1 100 ? 90.117 -34.514 -0.701 1.00 48.59 ? 178 TRP A CG 1 ATOM 659 C CD1 . TRP A 1 100 ? 89.827 -35.819 -0.398 1.00 49.69 ? 178 TRP A CD1 1 ATOM 660 C CD2 . TRP A 1 100 ? 90.979 -34.555 -1.845 1.00 53.73 ? 178 TRP A CD2 1 ATOM 661 N NE1 . TRP A 1 100 ? 90.454 -36.666 -1.281 1.00 57.88 ? 178 TRP A NE1 1 ATOM 662 C CE2 . TRP A 1 100 ? 91.164 -35.918 -2.185 1.00 62.79 ? 178 TRP A CE2 1 ATOM 663 C CE3 . TRP A 1 100 ? 91.610 -33.571 -2.620 1.00 55.25 ? 178 TRP A CE3 1 ATOM 664 C CZ2 . TRP A 1 100 ? 91.957 -36.326 -3.270 1.00 61.70 ? 178 TRP A CZ2 1 ATOM 665 C CZ3 . TRP A 1 100 ? 92.408 -33.980 -3.707 1.00 54.57 ? 178 TRP A CZ3 1 ATOM 666 C CH2 . TRP A 1 100 ? 92.571 -35.345 -4.014 1.00 59.00 ? 178 TRP A CH2 1 ATOM 667 N N . SER A 1 101 ? 91.050 -34.947 2.723 1.00 51.22 ? 179 SER A N 1 ATOM 668 C CA . SER A 1 101 ? 90.938 -36.056 3.664 1.00 54.05 ? 179 SER A CA 1 ATOM 669 C C . SER A 1 101 ? 92.127 -35.952 4.614 1.00 52.99 ? 179 SER A C 1 ATOM 670 O O . SER A 1 101 ? 93.277 -35.859 4.171 1.00 53.94 ? 179 SER A O 1 ATOM 671 C CB . SER A 1 101 ? 90.965 -37.395 2.916 1.00 53.76 ? 179 SER A CB 1 ATOM 672 O OG . SER A 1 101 ? 90.719 -38.507 3.773 1.00 58.43 ? 179 SER A OG 1 ATOM 673 N N . ALA A 1 102 ? 91.876 -35.949 5.917 1.00 44.02 ? 180 ALA A N 1 ATOM 674 C CA . ALA A 1 102 ? 92.998 -35.861 6.833 1.00 45.11 ? 180 ALA A CA 1 ATOM 675 C C . ALA A 1 102 ? 92.894 -36.715 8.087 1.00 48.71 ? 180 ALA A C 1 ATOM 676 O O . ALA A 1 102 ? 91.800 -37.049 8.560 1.00 48.33 ? 180 ALA A O 1 ATOM 677 C CB . ALA A 1 102 ? 93.296 -34.415 7.192 1.00 52.66 ? 180 ALA A CB 1 ATOM 678 N N . SER A 1 103 ? 94.064 -37.070 8.601 1.00 42.78 ? 181 SER A N 1 ATOM 679 C CA . SER A 1 103 ? 94.197 -37.705 9.896 1.00 41.91 ? 181 SER A CA 1 ATOM 680 C C . SER A 1 103 ? 95.322 -37.005 10.650 1.00 44.71 ? 181 SER A C 1 ATOM 681 O O . SER A 1 103 ? 96.341 -36.644 10.049 1.00 48.79 ? 181 SER A O 1 ATOM 682 C CB . SER A 1 103 ? 94.529 -39.187 9.724 1.00 48.34 ? 181 SER A CB 1 ATOM 683 O OG . SER A 1 103 ? 94.879 -39.749 10.984 1.00 45.48 ? 181 SER A OG 1 ATOM 684 N N . SER A 1 104 ? 95.170 -36.808 11.957 1.00 49.04 ? 182 SER A N 1 ATOM 685 C CA . SER A 1 104 ? 96.316 -36.296 12.714 1.00 45.96 ? 182 SER A CA 1 ATOM 686 C C . SER A 1 104 ? 96.425 -36.856 14.101 1.00 46.07 ? 182 SER A C 1 ATOM 687 O O . SER A 1 104 ? 95.475 -37.440 14.638 1.00 56.83 ? 182 SER A O 1 ATOM 688 C CB . SER A 1 104 ? 96.328 -34.763 12.773 1.00 49.38 ? 182 SER A CB 1 ATOM 689 O OG . SER A 1 104 ? 95.193 -34.269 13.450 1.00 48.81 ? 182 SER A OG 1 ATOM 690 N N . CYS A 1 105 ? 97.611 -36.663 14.667 1.00 51.02 ? 183 CYS A N 1 ATOM 691 C CA . CYS A 1 105 ? 97.934 -37.110 16.015 1.00 37.77 ? 183 CYS A CA 1 ATOM 692 C C . CYS A 1 105 ? 99.228 -36.454 16.470 1.00 45.71 ? 183 CYS A C 1 ATOM 693 O O . CYS A 1 105 ? 100.093 -36.126 15.648 1.00 53.36 ? 183 CYS A O 1 ATOM 694 C CB . CYS A 1 105 ? 98.097 -38.638 16.056 1.00 36.38 ? 183 CYS A CB 1 ATOM 695 S SG . CYS A 1 105 ? 99.107 -39.319 14.689 1.00 55.95 ? 183 CYS A SG 1 ATOM 696 N N . HIS A 1 106 ? 99.367 -36.298 17.785 1.00 48.65 ? 184 HIS A N 1 ATOM 697 C CA . HIS A 1 106 ? 100.529 -35.650 18.377 1.00 47.26 ? 184 HIS A CA 1 ATOM 698 C C . HIS A 1 106 ? 101.361 -36.673 19.174 1.00 49.09 ? 184 HIS A C 1 ATOM 699 O O . HIS A 1 106 ? 100.796 -37.510 19.888 1.00 60.55 ? 184 HIS A O 1 ATOM 700 C CB . HIS A 1 106 ? 100.054 -34.509 19.277 1.00 51.38 ? 184 HIS A CB 1 ATOM 701 C CG . HIS A 1 106 ? 101.116 -33.528 19.618 1.00 56.46 ? 184 HIS A CG 1 ATOM 702 N ND1 . HIS A 1 106 ? 102.144 -33.810 20.512 1.00 54.27 ? 184 HIS A ND1 1 ATOM 703 C CD2 . HIS A 1 106 ? 101.338 -32.260 19.199 1.00 50.66 ? 184 HIS A CD2 1 ATOM 704 C CE1 . HIS A 1 106 ? 102.932 -32.768 20.615 1.00 53.13 ? 184 HIS A CE1 1 ATOM 705 N NE2 . HIS A 1 106 ? 102.466 -31.802 19.825 1.00 52.82 ? 184 HIS A NE2 1 ATOM 706 N N . ASP A 1 107 ? 102.689 -36.595 19.060 1.00 42.08 ? 185 ASP A N 1 ATOM 707 C CA . ASP A 1 107 ? 103.591 -37.595 19.657 1.00 48.20 ? 185 ASP A CA 1 ATOM 708 C C . ASP A 1 107 ? 104.351 -37.077 20.889 1.00 60.38 ? 185 ASP A C 1 ATOM 709 O O . ASP A 1 107 ? 105.225 -37.767 21.429 1.00 52.27 ? 185 ASP A O 1 ATOM 710 C CB . ASP A 1 107 ? 104.631 -38.065 18.633 1.00 36.77 ? 185 ASP A CB 1 ATOM 711 C CG . ASP A 1 107 ? 105.580 -36.923 18.179 1.00 68.29 ? 185 ASP A CG 1 ATOM 712 O OD1 . ASP A 1 107 ? 105.427 -35.756 18.638 1.00 57.14 ? 185 ASP A OD1 1 ATOM 713 O OD2 . ASP A 1 107 ? 106.478 -37.197 17.345 1.00 58.07 ? 185 ASP A OD2 1 ATOM 714 N N . GLY A 1 108 ? 104.045 -35.856 21.306 1.00 53.38 ? 186 GLY A N 1 ATOM 715 C CA . GLY A 1 108 ? 104.822 -35.218 22.339 1.00 55.56 ? 186 GLY A CA 1 ATOM 716 C C . GLY A 1 108 ? 105.741 -34.137 21.799 1.00 62.21 ? 186 GLY A C 1 ATOM 717 O O . GLY A 1 108 ? 106.081 -33.193 22.518 1.00 68.54 ? 186 GLY A O 1 ATOM 718 N N . PHE A 1 109 ? 106.145 -34.240 20.537 1.00 62.69 ? 187 PHE A N 1 ATOM 719 C CA . PHE A 1 109 ? 107.015 -33.199 19.988 1.00 45.32 ? 187 PHE A CA 1 ATOM 720 C C . PHE A 1 109 ? 106.308 -32.248 19.023 1.00 50.84 ? 187 PHE A C 1 ATOM 721 O O . PHE A 1 109 ? 106.534 -31.030 19.030 1.00 40.83 ? 187 PHE A O 1 ATOM 722 C CB . PHE A 1 109 ? 108.249 -33.822 19.338 1.00 36.96 ? 187 PHE A CB 1 ATOM 723 C CG . PHE A 1 109 ? 108.918 -34.859 20.201 1.00 55.28 ? 187 PHE A CG 1 ATOM 724 C CD1 . PHE A 1 109 ? 109.386 -34.526 21.472 1.00 50.47 ? 187 PHE A CD1 1 ATOM 725 C CD2 . PHE A 1 109 ? 109.067 -36.169 19.754 1.00 57.40 ? 187 PHE A CD2 1 ATOM 726 C CE1 . PHE A 1 109 ? 109.993 -35.476 22.275 1.00 50.14 ? 187 PHE A CE1 1 ATOM 727 C CE2 . PHE A 1 109 ? 109.674 -37.128 20.558 1.00 68.55 ? 187 PHE A CE2 1 ATOM 728 C CZ . PHE A 1 109 ? 110.134 -36.782 21.820 1.00 61.33 ? 187 PHE A CZ 1 ATOM 729 N N . GLN A 1 110 ? 105.416 -32.806 18.222 1.00 56.23 ? 188 GLN A N 1 ATOM 730 C CA . GLN A 1 110 ? 104.941 -32.097 17.059 1.00 47.35 ? 188 GLN A CA 1 ATOM 731 C C . GLN A 1 110 ? 103.681 -32.779 16.548 1.00 44.28 ? 188 GLN A C 1 ATOM 732 O O . GLN A 1 110 ? 103.456 -33.972 16.794 1.00 53.04 ? 188 GLN A O 1 ATOM 733 C CB . GLN A 1 110 ? 106.055 -32.160 16.010 1.00 46.70 ? 188 GLN A CB 1 ATOM 734 C CG . GLN A 1 110 ? 106.387 -30.892 15.294 1.00 61.24 ? 188 GLN A CG 1 ATOM 735 C CD . GLN A 1 110 ? 106.932 -29.797 16.180 1.00 57.12 ? 188 GLN A CD 1 ATOM 736 O OE1 . GLN A 1 110 ? 108.045 -29.891 16.719 1.00 49.65 ? 188 GLN A OE1 1 ATOM 737 N NE2 . GLN A 1 110 ? 106.161 -28.727 16.310 1.00 51.91 ? 188 GLN A NE2 1 ATOM 738 N N . TRP A 1 111 ? 102.844 -32.024 15.849 1.00 49.77 ? 189 TRP A N 1 ATOM 739 C CA . TRP A 1 111 ? 101.703 -32.623 15.164 1.00 38.04 ? 189 TRP A CA 1 ATOM 740 C C . TRP A 1 111 ? 102.179 -33.332 13.920 1.00 42.31 ? 189 TRP A C 1 ATOM 741 O O . TRP A 1 111 ? 103.017 -32.808 13.176 1.00 67.57 ? 189 TRP A O 1 ATOM 742 C CB . TRP A 1 111 ? 100.666 -31.562 14.798 1.00 37.07 ? 189 TRP A CB 1 ATOM 743 C CG . TRP A 1 111 ? 99.854 -31.163 15.983 1.00 48.24 ? 189 TRP A CG 1 ATOM 744 C CD1 . TRP A 1 111 ? 100.020 -30.053 16.764 1.00 39.05 ? 189 TRP A CD1 1 ATOM 745 C CD2 . TRP A 1 111 ? 98.765 -31.897 16.551 1.00 57.56 ? 189 TRP A CD2 1 ATOM 746 N NE1 . TRP A 1 111 ? 99.080 -30.041 17.775 1.00 45.13 ? 189 TRP A NE1 1 ATOM 747 C CE2 . TRP A 1 111 ? 98.303 -31.166 17.671 1.00 57.56 ? 189 TRP A CE2 1 ATOM 748 C CE3 . TRP A 1 111 ? 98.130 -33.097 16.214 1.00 51.39 ? 189 TRP A CE3 1 ATOM 749 C CZ2 . TRP A 1 111 ? 97.234 -31.603 18.466 1.00 49.89 ? 189 TRP A CZ2 1 ATOM 750 C CZ3 . TRP A 1 111 ? 97.068 -33.532 17.003 1.00 63.15 ? 189 TRP A CZ3 1 ATOM 751 C CH2 . TRP A 1 111 ? 96.633 -32.788 18.119 1.00 56.48 ? 189 TRP A CH2 1 ATOM 752 N N . THR A 1 112 ? 101.677 -34.544 13.727 1.00 52.71 ? 190 THR A N 1 ATOM 753 C CA . THR A 1 112 ? 101.786 -35.232 12.451 1.00 55.75 ? 190 THR A CA 1 ATOM 754 C C . THR A 1 112 ? 100.420 -35.060 11.807 1.00 54.85 ? 190 THR A C 1 ATOM 755 O O . THR A 1 112 ? 99.388 -35.378 12.420 1.00 58.17 ? 190 THR A O 1 ATOM 756 C CB . THR A 1 112 ? 102.089 -36.745 12.625 1.00 53.14 ? 190 THR A CB 1 ATOM 757 O OG1 . THR A 1 112 ? 103.473 -36.931 12.933 1.00 56.27 ? 190 THR A OG1 1 ATOM 758 C CG2 . THR A 1 112 ? 101.782 -37.514 11.356 1.00 42.14 ? 190 THR A CG2 1 ATOM 759 N N . VAL A 1 113 ? 100.400 -34.524 10.592 1.00 53.25 ? 191 VAL A N 1 ATOM 760 C CA . VAL A 1 113 ? 99.149 -34.437 9.841 1.00 53.14 ? 191 VAL A CA 1 ATOM 761 C C . VAL A 1 113 ? 99.273 -35.155 8.495 1.00 55.87 ? 191 VAL A C 1 ATOM 762 O O . VAL A 1 113 ? 100.169 -34.853 7.696 1.00 59.41 ? 191 VAL A O 1 ATOM 763 C CB . VAL A 1 113 ? 98.714 -32.979 9.637 1.00 43.17 ? 191 VAL A CB 1 ATOM 764 C CG1 . VAL A 1 113 ? 97.459 -32.912 8.791 1.00 44.84 ? 191 VAL A CG1 1 ATOM 765 C CG2 . VAL A 1 113 ? 98.504 -32.302 10.980 1.00 41.65 ? 191 VAL A CG2 1 ATOM 766 N N . LEU A 1 114 ? 98.388 -36.121 8.268 1.00 47.32 ? 192 LEU A N 1 ATOM 767 C CA . LEU A 1 114 ? 98.356 -36.867 7.011 1.00 42.48 ? 192 LEU A CA 1 ATOM 768 C C . LEU A 1 114 ? 97.252 -36.328 6.122 1.00 57.09 ? 192 LEU A C 1 ATOM 769 O O . LEU A 1 114 ? 96.082 -36.294 6.531 1.00 56.81 ? 192 LEU A O 1 ATOM 770 C CB . LEU A 1 114 ? 98.084 -38.336 7.260 1.00 38.69 ? 192 LEU A CB 1 ATOM 771 C CG . LEU A 1 114 ? 99.185 -39.069 8.004 1.00 50.03 ? 192 LEU A CG 1 ATOM 772 C CD1 . LEU A 1 114 ? 98.897 -39.102 9.542 1.00 46.28 ? 192 LEU A CD1 1 ATOM 773 C CD2 . LEU A 1 114 ? 99.318 -40.459 7.410 1.00 38.91 ? 192 LEU A CD2 1 ATOM 774 N N . SER A 1 115 ? 97.609 -35.922 4.904 1.00 57.46 ? 193 SER A N 1 ATOM 775 C CA . SER A 1 115 ? 96.620 -35.311 4.025 1.00 51.87 ? 193 SER A CA 1 ATOM 776 C C . SER A 1 115 ? 96.609 -35.826 2.581 1.00 49.48 ? 193 SER A C 1 ATOM 777 O O . SER A 1 115 ? 97.655 -35.891 1.917 1.00 47.37 ? 193 SER A O 1 ATOM 778 C CB . SER A 1 115 ? 96.763 -33.790 4.049 1.00 45.56 ? 193 SER A CB 1 ATOM 779 O OG . SER A 1 115 ? 95.732 -33.219 3.270 1.00 61.99 ? 193 SER A OG 1 ATOM 780 N N . VAL A 1 116 ? 95.409 -36.171 2.114 1.00 45.87 ? 194 VAL A N 1 ATOM 781 C CA . VAL A 1 116 ? 95.161 -36.536 0.716 1.00 53.98 ? 194 VAL A CA 1 ATOM 782 C C . VAL A 1 116 ? 94.893 -35.307 -0.171 1.00 59.32 ? 194 VAL A C 1 ATOM 783 O O . VAL A 1 116 ? 93.889 -34.610 -0.000 1.00 58.25 ? 194 VAL A O 1 ATOM 784 C CB . VAL A 1 116 ? 93.942 -37.461 0.585 1.00 51.59 ? 194 VAL A CB 1 ATOM 785 C CG1 . VAL A 1 116 ? 93.819 -37.973 -0.840 1.00 40.45 ? 194 VAL A CG1 1 ATOM 786 C CG2 . VAL A 1 116 ? 94.040 -38.609 1.577 1.00 50.42 ? 194 VAL A CG2 1 ATOM 787 N N . ALA A 1 117 ? 95.783 -35.068 -1.130 1.00 62.63 ? 195 ALA A N 1 ATOM 788 C CA . ALA A 1 117 ? 95.646 -33.948 -2.051 1.00 58.17 ? 195 ALA A CA 1 ATOM 789 C C . ALA A 1 117 ? 96.061 -34.337 -3.475 1.00 61.27 ? 195 ALA A C 1 ATOM 790 O O . ALA A 1 117 ? 96.307 -35.518 -3.762 1.00 60.89 ? 195 ALA A O 1 ATOM 791 C CB . ALA A 1 117 ? 96.462 -32.759 -1.557 1.00 50.25 ? 195 ALA A CB 1 ATOM 792 N N . GLY A 1 118 ? 96.145 -33.340 -4.357 1.00 55.26 ? 196 GLY A N 1 ATOM 793 C CA . GLY A 1 118 ? 96.556 -33.567 -5.737 1.00 40.47 ? 196 GLY A CA 1 ATOM 794 C C . GLY A 1 118 ? 95.713 -34.586 -6.499 1.00 47.01 ? 196 GLY A C 1 ATOM 795 O O . GLY A 1 118 ? 94.498 -34.397 -6.670 1.00 50.02 ? 196 GLY A O 1 ATOM 796 N N . ASP A 1 119 ? 96.364 -35.662 -6.952 1.00 40.42 ? 200 ASP A N 1 ATOM 797 C CA . ASP A 1 119 ? 95.711 -36.739 -7.694 1.00 47.84 ? 200 ASP A CA 1 ATOM 798 C C . ASP A 1 119 ? 95.328 -37.872 -6.731 1.00 63.11 ? 200 ASP A C 1 ATOM 799 O O . ASP A 1 119 ? 95.000 -38.997 -7.156 1.00 60.57 ? 200 ASP A O 1 ATOM 800 C CB . ASP A 1 119 ? 96.641 -37.266 -8.799 1.00 55.74 ? 200 ASP A CB 1 ATOM 801 C CG . ASP A 1 119 ? 97.898 -37.976 -8.246 1.00 72.86 ? 200 ASP A CG 1 ATOM 802 O OD1 . ASP A 1 119 ? 98.370 -37.633 -7.136 1.00 73.11 ? 200 ASP A OD1 1 ATOM 803 O OD2 . ASP A 1 119 ? 98.422 -38.885 -8.937 1.00 81.50 ? 200 ASP A OD2 1 ATOM 804 N N . GLY A 1 120 ? 95.395 -37.575 -5.432 1.00 53.65 ? 201 GLY A N 1 ATOM 805 C CA . GLY A 1 120 ? 95.006 -38.531 -4.414 1.00 51.75 ? 201 GLY A CA 1 ATOM 806 C C . GLY A 1 120 ? 96.158 -39.230 -3.709 1.00 51.26 ? 201 GLY A C 1 ATOM 807 O O . GLY A 1 120 ? 96.031 -40.396 -3.304 1.00 52.81 ? 201 GLY A O 1 ATOM 808 N N . PHE A 1 121 ? 97.289 -38.542 -3.551 1.00 41.88 ? 202 PHE A N 1 ATOM 809 C CA . PHE A 1 121 ? 98.369 -39.104 -2.731 1.00 47.64 ? 202 PHE A CA 1 ATOM 810 C C . PHE A 1 121 ? 98.326 -38.489 -1.326 1.00 52.97 ? 202 PHE A C 1 ATOM 811 O O . PHE A 1 121 ? 97.714 -37.439 -1.131 1.00 49.17 ? 202 PHE A O 1 ATOM 812 C CB . PHE A 1 121 ? 99.735 -38.833 -3.364 1.00 48.05 ? 202 PHE A CB 1 ATOM 813 C CG . PHE A 1 121 ? 100.103 -37.376 -3.398 1.00 48.08 ? 202 PHE A CG 1 ATOM 814 C CD1 . PHE A 1 121 ? 99.701 -36.568 -4.454 1.00 60.35 ? 202 PHE A CD1 1 ATOM 815 C CD2 . PHE A 1 121 ? 100.844 -36.810 -2.367 1.00 54.07 ? 202 PHE A CD2 1 ATOM 816 C CE1 . PHE A 1 121 ? 100.034 -35.216 -4.479 1.00 68.17 ? 202 PHE A CE1 1 ATOM 817 C CE2 . PHE A 1 121 ? 101.173 -35.458 -2.379 1.00 54.14 ? 202 PHE A CE2 1 ATOM 818 C CZ . PHE A 1 121 ? 100.766 -34.659 -3.432 1.00 55.48 ? 202 PHE A CZ 1 ATOM 819 N N . VAL A 1 122 ? 98.974 -39.113 -0.344 1.00 45.51 ? 203 VAL A N 1 ATOM 820 C CA . VAL A 1 122 ? 99.030 -38.441 0.944 1.00 50.89 ? 203 VAL A CA 1 ATOM 821 C C . VAL A 1 122 ? 100.372 -37.810 1.233 1.00 56.28 ? 203 VAL A C 1 ATOM 822 O O . VAL A 1 122 ? 101.428 -38.353 0.896 1.00 50.19 ? 203 VAL A O 1 ATOM 823 C CB . VAL A 1 122 ? 98.509 -39.276 2.172 1.00 54.94 ? 203 VAL A CB 1 ATOM 824 C CG1 . VAL A 1 122 ? 97.280 -40.120 1.794 1.00 46.82 ? 203 VAL A CG1 1 ATOM 825 C CG2 . VAL A 1 122 ? 99.604 -40.126 2.777 1.00 59.91 ? 203 VAL A CG2 1 ATOM 826 N N . SER A 1 123 ? 100.301 -36.634 1.847 1.00 59.05 ? 204 SER A N 1 ATOM 827 C CA . SER A 1 123 ? 101.484 -35.936 2.326 1.00 63.23 ? 204 SER A CA 1 ATOM 828 C C . SER A 1 123 ? 101.499 -35.924 3.857 1.00 53.59 ? 204 SER A C 1 ATOM 829 O O . SER A 1 123 ? 100.524 -35.554 4.504 1.00 55.21 ? 204 SER A O 1 ATOM 830 C CB . SER A 1 123 ? 101.521 -34.508 1.777 1.00 62.78 ? 204 SER A CB 1 ATOM 831 O OG . SER A 1 123 ? 100.506 -34.338 0.802 1.00 74.37 ? 204 SER A OG 1 ATOM 832 N N . ILE A 1 124 ? 102.616 -36.346 4.425 1.00 41.77 ? 205 ILE A N 1 ATOM 833 C CA . ILE A 1 124 ? 102.810 -36.267 5.853 1.00 49.15 ? 205 ILE A CA 1 ATOM 834 C C . ILE A 1 124 ? 103.509 -34.960 6.218 1.00 51.63 ? 205 ILE A C 1 ATOM 835 O O . ILE A 1 124 ? 104.625 -34.700 5.762 1.00 50.69 ? 205 ILE A O 1 ATOM 836 C CB . ILE A 1 124 ? 103.636 -37.473 6.348 1.00 53.90 ? 205 ILE A CB 1 ATOM 837 C CG1 . ILE A 1 124 ? 102.994 -38.776 5.838 1.00 59.21 ? 205 ILE A CG1 1 ATOM 838 C CG2 . ILE A 1 124 ? 103.728 -37.454 7.854 1.00 48.10 ? 205 ILE A CG2 1 ATOM 839 C CD1 . ILE A 1 124 ? 103.540 -40.042 6.456 1.00 50.27 ? 205 ILE A CD1 1 ATOM 840 N N . LEU A 1 125 ? 102.852 -34.138 7.035 1.00 54.40 ? 206 LEU A N 1 ATOM 841 C CA . LEU A 1 125 ? 103.482 -32.923 7.558 1.00 53.60 ? 206 LEU A CA 1 ATOM 842 C C . LEU A 1 125 ? 103.783 -33.062 9.040 1.00 52.70 ? 206 LEU A C 1 ATOM 843 O O . LEU A 1 125 ? 102.926 -33.494 9.806 1.00 59.24 ? 206 LEU A O 1 ATOM 844 C CB . LEU A 1 125 ? 102.606 -31.699 7.324 1.00 47.27 ? 206 LEU A CB 1 ATOM 845 C CG . LEU A 1 125 ? 102.433 -31.323 5.854 1.00 63.77 ? 206 LEU A CG 1 ATOM 846 C CD1 . LEU A 1 125 ? 101.199 -32.005 5.283 1.00 61.21 ? 206 LEU A CD1 1 ATOM 847 C CD2 . LEU A 1 125 ? 102.349 -29.822 5.701 1.00 76.90 ? 206 LEU A CD2 1 ATOM 848 N N . TYR A 1 126 ? 104.996 -32.683 9.440 1.00 48.06 ? 207 TYR A N 1 ATOM 849 C CA . TYR A 1 126 ? 105.422 -32.794 10.831 1.00 40.48 ? 207 TYR A CA 1 ATOM 850 C C . TYR A 1 126 ? 105.901 -31.439 11.356 1.00 56.36 ? 207 TYR A C 1 ATOM 851 O O . TYR A 1 126 ? 106.946 -30.939 10.936 1.00 63.94 ? 207 TYR A O 1 ATOM 852 C CB . TYR A 1 126 ? 106.536 -33.814 10.936 1.00 42.65 ? 207 TYR A CB 1 ATOM 853 C CG . TYR A 1 126 ? 106.877 -34.192 12.350 1.00 48.51 ? 207 TYR A CG 1 ATOM 854 C CD1 . TYR A 1 126 ? 106.015 -34.979 13.101 1.00 39.21 ? 207 TYR A CD1 1 ATOM 855 C CD2 . TYR A 1 126 ? 108.061 -33.763 12.942 1.00 47.58 ? 207 TYR A CD2 1 ATOM 856 C CE1 . TYR A 1 126 ? 106.324 -35.348 14.408 1.00 53.83 ? 207 TYR A CE1 1 ATOM 857 C CE2 . TYR A 1 126 ? 108.383 -34.119 14.250 1.00 57.27 ? 207 TYR A CE2 1 ATOM 858 C CZ . TYR A 1 126 ? 107.515 -34.916 14.982 1.00 62.35 ? 207 TYR A CZ 1 ATOM 859 O OH . TYR A 1 126 ? 107.834 -35.265 16.280 1.00 57.61 ? 207 TYR A OH 1 ATOM 860 N N . GLY A 1 127 ? 105.163 -30.863 12.304 1.00 60.89 ? 208 GLY A N 1 ATOM 861 C CA . GLY A 1 127 ? 105.244 -29.427 12.505 1.00 62.26 ? 208 GLY A CA 1 ATOM 862 C C . GLY A 1 127 ? 104.528 -28.957 11.276 1.00 76.38 ? 208 GLY A C 1 ATOM 863 O O . GLY A 1 127 ? 103.408 -29.421 10.997 1.00 96.80 ? 208 GLY A O 1 ATOM 864 N N . GLY A 1 128 ? 105.165 -28.104 10.492 1.00 61.97 ? 209 GLY A N 1 ATOM 865 C CA . GLY A 1 128 ? 104.591 -27.818 9.179 1.00 66.83 ? 209 GLY A CA 1 ATOM 866 C C . GLY A 1 128 ? 105.539 -28.121 8.038 1.00 64.12 ? 209 GLY A C 1 ATOM 867 O O . GLY A 1 128 ? 105.689 -27.314 7.127 1.00 71.67 ? 209 GLY A O 1 ATOM 868 N N . ILE A 1 129 ? 106.186 -29.279 8.092 1.00 64.27 ? 210 ILE A N 1 ATOM 869 C CA . ILE A 1 129 ? 107.202 -29.618 7.113 1.00 71.32 ? 210 ILE A CA 1 ATOM 870 C C . ILE A 1 129 ? 106.864 -30.966 6.511 1.00 67.69 ? 210 ILE A C 1 ATOM 871 O O . ILE A 1 129 ? 106.416 -31.855 7.231 1.00 60.23 ? 210 ILE A O 1 ATOM 872 C CB . ILE A 1 129 ? 108.570 -29.652 7.783 1.00 72.09 ? 210 ILE A CB 1 ATOM 873 C CG1 . ILE A 1 129 ? 108.890 -28.259 8.316 1.00 67.41 ? 210 ILE A CG1 1 ATOM 874 C CG2 . ILE A 1 129 ? 109.641 -30.114 6.809 1.00 82.62 ? 210 ILE A CG2 1 ATOM 875 C CD1 . ILE A 1 129 ? 109.237 -28.260 9.752 1.00 83.42 ? 210 ILE A CD1 1 ATOM 876 N N . ILE A 1 130 ? 107.035 -31.112 5.198 1.00 68.21 ? 211 ILE A N 1 ATOM 877 C CA . ILE A 1 130 ? 106.787 -32.402 4.573 1.00 64.86 ? 211 ILE A CA 1 ATOM 878 C C . ILE A 1 130 ? 107.859 -33.349 5.050 1.00 56.97 ? 211 ILE A C 1 ATOM 879 O O . ILE A 1 130 ? 109.043 -33.027 5.016 1.00 73.02 ? 211 ILE A O 1 ATOM 880 C CB . ILE A 1 130 ? 106.786 -32.338 3.048 1.00 63.04 ? 211 ILE A CB 1 ATOM 881 C CG1 . ILE A 1 130 ? 105.781 -31.304 2.576 1.00 86.42 ? 211 ILE A CG1 1 ATOM 882 C CG2 . ILE A 1 130 ? 106.379 -33.663 2.462 1.00 50.67 ? 211 ILE A CG2 1 ATOM 883 C CD1 . ILE A 1 130 ? 106.402 -30.291 1.678 1.00 105.48 ? 211 ILE A CD1 1 ATOM 884 N N . THR A 1 131 ? 107.435 -34.511 5.523 1.00 48.18 ? 212 THR A N 1 ATOM 885 C CA . THR A 1 131 ? 108.377 -35.481 6.044 1.00 63.35 ? 212 THR A CA 1 ATOM 886 C C . THR A 1 131 ? 108.290 -36.765 5.245 1.00 68.59 ? 212 THR A C 1 ATOM 887 O O . THR A 1 131 ? 109.233 -37.564 5.234 1.00 61.56 ? 212 THR A O 1 ATOM 888 C CB . THR A 1 131 ? 108.149 -35.751 7.534 1.00 58.39 ? 212 THR A CB 1 ATOM 889 O OG1 . THR A 1 131 ? 106.743 -35.902 7.791 1.00 62.95 ? 212 THR A OG1 1 ATOM 890 C CG2 . THR A 1 131 ? 108.699 -34.587 8.338 1.00 52.56 ? 212 THR A CG2 1 ATOM 891 N N . ASP A 1 132 ? 107.153 -36.952 4.581 1.00 56.91 ? 213 ASP A N 1 ATOM 892 C CA . ASP A 1 132 ? 106.986 -38.077 3.677 1.00 56.76 ? 213 ASP A CA 1 ATOM 893 C C . ASP A 1 132 ? 105.759 -37.830 2.820 1.00 56.18 ? 213 ASP A C 1 ATOM 894 O O . ASP A 1 132 ? 104.892 -37.037 3.191 1.00 55.94 ? 213 ASP A O 1 ATOM 895 C CB . ASP A 1 132 ? 106.839 -39.394 4.456 1.00 66.02 ? 213 ASP A CB 1 ATOM 896 C CG . ASP A 1 132 ? 107.710 -40.508 3.893 1.00 86.33 ? 213 ASP A CG 1 ATOM 897 O OD1 . ASP A 1 132 ? 107.806 -40.614 2.648 1.00 90.41 ? 213 ASP A OD1 1 ATOM 898 O OD2 . ASP A 1 132 ? 108.310 -41.271 4.695 1.00 89.54 ? 213 ASP A OD2 1 ATOM 899 N N . THR A 1 133 ? 105.717 -38.488 1.661 1.00 51.15 ? 214 THR A N 1 ATOM 900 C CA . THR A 1 133 ? 104.509 -38.599 0.852 1.00 49.74 ? 214 THR A CA 1 ATOM 901 C C . THR A 1 133 ? 104.265 -40.085 0.631 1.00 54.04 ? 214 THR A C 1 ATOM 902 O O . THR A 1 133 ? 105.197 -40.880 0.713 1.00 60.79 ? 214 THR A O 1 ATOM 903 C CB . THR A 1 133 ? 104.650 -37.919 -0.537 1.00 61.51 ? 214 THR A CB 1 ATOM 904 O OG1 . THR A 1 133 ? 105.816 -38.425 -1.198 1.00 59.27 ? 214 THR A OG1 1 ATOM 905 C CG2 . THR A 1 133 ? 104.749 -36.397 -0.400 1.00 43.50 ? 214 THR A CG2 1 ATOM 906 N N . ILE A 1 134 ? 103.020 -40.457 0.355 1.00 55.30 ? 215 ILE A N 1 ATOM 907 C CA . ILE A 1 134 ? 102.677 -41.834 0.027 1.00 50.59 ? 215 ILE A CA 1 ATOM 908 C C . ILE A 1 134 ? 101.794 -41.790 -1.215 1.00 53.41 ? 215 ILE A C 1 ATOM 909 O O . ILE A 1 134 ? 100.882 -40.965 -1.288 1.00 55.89 ? 215 ILE A O 1 ATOM 910 C CB . ILE A 1 134 ? 101.918 -42.504 1.199 1.00 50.71 ? 215 ILE A CB 1 ATOM 911 C CG1 . ILE A 1 134 ? 102.846 -42.655 2.402 1.00 44.44 ? 215 ILE A CG1 1 ATOM 912 C CG2 . ILE A 1 134 ? 101.369 -43.872 0.789 1.00 33.96 ? 215 ILE A CG2 1 ATOM 913 C CD1 . ILE A 1 134 ? 102.137 -42.644 3.726 1.00 43.86 ? 215 ILE A CD1 1 ATOM 914 N N . HIS A 1 135 ? 102.055 -42.652 -2.196 1.00 56.98 ? 216 HIS A N 1 ATOM 915 C CA . HIS A 1 135 ? 101.269 -42.617 -3.440 1.00 55.88 ? 216 HIS A CA 1 ATOM 916 C C . HIS A 1 135 ? 100.441 -43.875 -3.660 1.00 61.53 ? 216 HIS A C 1 ATOM 917 O O . HIS A 1 135 ? 100.877 -44.979 -3.320 1.00 68.38 ? 216 HIS A O 1 ATOM 918 C CB . HIS A 1 135 ? 102.161 -42.336 -4.654 1.00 51.49 ? 216 HIS A CB 1 ATOM 919 C CG . HIS A 1 135 ? 102.825 -41.004 -4.606 1.00 63.41 ? 216 HIS A CG 1 ATOM 920 N ND1 . HIS A 1 135 ? 103.910 -40.735 -3.790 1.00 67.12 ? 216 HIS A ND1 1 ATOM 921 C CD2 . HIS A 1 135 ? 102.537 -39.835 -5.233 1.00 76.85 ? 216 HIS A CD2 1 ATOM 922 C CE1 . HIS A 1 135 ? 104.266 -39.475 -3.928 1.00 78.80 ? 216 HIS A CE1 1 ATOM 923 N NE2 . HIS A 1 135 ? 103.445 -38.906 -4.799 1.00 91.25 ? 216 HIS A NE2 1 ATOM 924 N N . PRO A 1 136 ? 99.232 -43.707 -4.218 1.00 63.23 ? 217 PRO A N 1 ATOM 925 C CA . PRO A 1 136 ? 98.388 -44.877 -4.483 1.00 59.40 ? 217 PRO A CA 1 ATOM 926 C C . PRO A 1 136 ? 99.092 -45.869 -5.400 1.00 55.22 ? 217 PRO A C 1 ATOM 927 O O . PRO A 1 136 ? 99.971 -45.502 -6.191 1.00 56.87 ? 217 PRO A O 1 ATOM 928 C CB . PRO A 1 136 ? 97.140 -44.283 -5.156 1.00 47.79 ? 217 PRO A CB 1 ATOM 929 C CG . PRO A 1 136 ? 97.582 -42.930 -5.664 1.00 55.40 ? 217 PRO A CG 1 ATOM 930 C CD . PRO A 1 136 ? 98.593 -42.450 -4.649 1.00 58.33 ? 217 PRO A CD 1 ATOM 931 N N . THR A 1 137 ? 98.674 -47.124 -5.283 1.00 55.95 ? 218 THR A N 1 ATOM 932 C CA . THR A 1 137 ? 99.327 -48.257 -5.914 1.00 46.92 ? 218 THR A CA 1 ATOM 933 C C . THR A 1 137 ? 98.258 -49.192 -6.466 1.00 53.65 ? 218 THR A C 1 ATOM 934 O O . THR A 1 137 ? 98.502 -49.907 -7.436 1.00 46.30 ? 218 THR A O 1 ATOM 935 C CB . THR A 1 137 ? 100.203 -48.978 -4.865 1.00 53.63 ? 218 THR A CB 1 ATOM 936 O OG1 . THR A 1 137 ? 101.470 -48.315 -4.794 1.00 51.88 ? 218 THR A OG1 1 ATOM 937 C CG2 . THR A 1 137 ? 100.402 -50.469 -5.185 1.00 72.24 ? 218 THR A CG2 1 ATOM 938 N N . ASN A 1 138 ? 97.081 -49.191 -5.833 1.00 56.32 ? 219 ASN A N 1 ATOM 939 C CA . ASN A 1 138 ? 95.950 -49.973 -6.314 1.00 54.88 ? 219 ASN A CA 1 ATOM 940 C C . ASN A 1 138 ? 94.915 -49.088 -6.991 1.00 61.09 ? 219 ASN A C 1 ATOM 941 O O . ASN A 1 138 ? 93.722 -49.411 -7.027 1.00 71.89 ? 219 ASN A O 1 ATOM 942 C CB . ASN A 1 138 ? 95.285 -50.738 -5.182 1.00 63.31 ? 219 ASN A CB 1 ATOM 943 C CG . ASN A 1 138 ? 95.947 -52.040 -4.904 1.00 96.39 ? 219 ASN A CG 1 ATOM 944 O OD1 . ASN A 1 138 ? 97.138 -52.224 -5.177 1.00 98.63 ? 219 ASN A OD1 1 ATOM 945 N ND2 . ASN A 1 138 ? 95.180 -52.972 -4.345 1.00 115.54 ? 219 ASN A ND2 1 ATOM 946 N N . GLY A 1 139 ? 95.360 -47.950 -7.498 1.00 57.62 ? 220 GLY A N 1 ATOM 947 C CA . GLY A 1 139 ? 94.477 -47.156 -8.317 1.00 61.82 ? 220 GLY A CA 1 ATOM 948 C C . GLY A 1 139 ? 93.885 -45.893 -7.723 1.00 63.75 ? 220 GLY A C 1 ATOM 949 O O . GLY A 1 139 ? 93.226 -45.131 -8.449 1.00 63.33 ? 220 GLY A O 1 ATOM 950 N N . GLY A 1 140 ? 94.108 -45.659 -6.429 1.00 52.78 ? 221 GLY A N 1 ATOM 951 C CA . GLY A 1 140 ? 93.682 -44.419 -5.802 1.00 47.44 ? 221 GLY A CA 1 ATOM 952 C C . GLY A 1 140 ? 92.177 -44.170 -5.747 1.00 47.25 ? 221 GLY A C 1 ATOM 953 O O . GLY A 1 140 ? 91.373 -45.012 -6.178 1.00 49.69 ? 221 GLY A O 1 ATOM 954 N N . PRO A 1 141 ? 91.778 -43.042 -5.130 1.00 52.33 ? 222 PRO A N 1 ATOM 955 C CA . PRO A 1 141 ? 92.736 -42.212 -4.372 1.00 55.32 ? 222 PRO A CA 1 ATOM 956 C C . PRO A 1 141 ? 92.977 -42.834 -2.999 1.00 44.86 ? 222 PRO A C 1 ATOM 957 O O . PRO A 1 141 ? 92.176 -43.668 -2.546 1.00 49.88 ? 222 PRO A O 1 ATOM 958 C CB . PRO A 1 141 ? 91.993 -40.884 -4.204 1.00 48.23 ? 222 PRO A CB 1 ATOM 959 C CG . PRO A 1 141 ? 90.539 -41.308 -4.107 1.00 53.25 ? 222 PRO A CG 1 ATOM 960 C CD . PRO A 1 141 ? 90.380 -42.602 -4.923 1.00 47.96 ? 222 PRO A CD 1 ATOM 961 N N . LEU A 1 142 ? 94.076 -42.463 -2.358 1.00 47.89 ? 223 LEU A N 1 ATOM 962 C CA . LEU A 1 142 ? 94.306 -42.893 -0.977 1.00 50.11 ? 223 LEU A CA 1 ATOM 963 C C . LEU A 1 142 ? 93.272 -42.254 -0.048 1.00 52.53 ? 223 LEU A C 1 ATOM 964 O O . LEU A 1 142 ? 92.738 -41.170 -0.317 1.00 52.48 ? 223 LEU A O 1 ATOM 965 C CB . LEU A 1 142 ? 95.731 -42.577 -0.525 1.00 39.48 ? 223 LEU A CB 1 ATOM 966 C CG . LEU A 1 142 ? 96.769 -43.343 -1.358 1.00 55.20 ? 223 LEU A CG 1 ATOM 967 C CD1 . LEU A 1 142 ? 98.181 -43.179 -0.796 1.00 33.65 ? 223 LEU A CD1 1 ATOM 968 C CD2 . LEU A 1 142 ? 96.385 -44.832 -1.483 1.00 42.40 ? 223 LEU A CD2 1 ATOM 969 N N . ARG A 1 143 ? 92.953 -42.952 1.026 1.00 50.93 ? 224 ARG A N 1 ATOM 970 C CA . ARG A 1 143 ? 92.010 -42.425 1.999 1.00 56.89 ? 224 ARG A CA 1 ATOM 971 C C . ARG A 1 143 ? 92.583 -42.542 3.412 1.00 57.88 ? 224 ARG A C 1 ATOM 972 O O . ARG A 1 143 ? 92.961 -43.636 3.851 1.00 62.04 ? 224 ARG A O 1 ATOM 973 C CB . ARG A 1 143 ? 90.701 -43.200 1.926 1.00 52.83 ? 224 ARG A CB 1 ATOM 974 C CG . ARG A 1 143 ? 89.848 -42.930 0.706 1.00 49.45 ? 224 ARG A CG 1 ATOM 975 C CD . ARG A 1 143 ? 88.967 -44.174 0.418 1.00 34.06 ? 224 ARG A CD 1 ATOM 976 N NE . ARG A 1 143 ? 89.599 -44.943 -0.625 1.00 60.11 ? 224 ARG A NE 1 ATOM 977 C CZ . ARG A 1 143 ? 89.668 -46.263 -0.685 1.00 62.02 ? 224 ARG A CZ 1 ATOM 978 N NH1 . ARG A 1 143 ? 89.111 -47.020 0.241 1.00 53.40 ? 224 ARG A NH1 1 ATOM 979 N NH2 . ARG A 1 143 ? 90.290 -46.820 -1.711 1.00 71.22 ? 224 ARG A NH2 1 ATOM 980 N N . THR A 1 144 ? 92.654 -41.415 4.113 1.00 48.38 ? 225 THR A N 1 ATOM 981 C CA . THR A 1 144 ? 93.033 -41.405 5.525 1.00 44.08 ? 225 THR A CA 1 ATOM 982 C C . THR A 1 144 ? 91.889 -41.970 6.353 1.00 46.37 ? 225 THR A C 1 ATOM 983 O O . THR A 1 144 ? 90.798 -42.200 5.838 1.00 62.38 ? 225 THR A O 1 ATOM 984 C CB . THR A 1 144 ? 93.304 -39.981 6.015 1.00 46.31 ? 225 THR A CB 1 ATOM 985 O OG1 . THR A 1 144 ? 92.078 -39.235 6.024 1.00 47.19 ? 225 THR A OG1 1 ATOM 986 C CG2 . THR A 1 144 ? 94.331 -39.294 5.120 1.00 36.51 ? 225 THR A CG2 1 ATOM 987 N N . GLN A 1 145 ? 92.124 -42.174 7.640 1.00 58.74 ? 226 GLN A N 1 ATOM 988 C CA . GLN A 1 145 ? 91.100 -42.766 8.493 1.00 58.16 ? 226 GLN A CA 1 ATOM 989 C C . GLN A 1 145 ? 90.076 -41.734 8.977 1.00 51.96 ? 226 GLN A C 1 ATOM 990 O O . GLN A 1 145 ? 89.110 -42.089 9.679 1.00 45.01 ? 226 GLN A O 1 ATOM 991 C CB . GLN A 1 145 ? 91.745 -43.486 9.669 1.00 43.84 ? 226 GLN A CB 1 ATOM 992 C CG . GLN A 1 145 ? 92.796 -42.652 10.384 1.00 48.68 ? 226 GLN A CG 1 ATOM 993 C CD . GLN A 1 145 ? 93.447 -43.420 11.513 1.00 51.61 ? 226 GLN A CD 1 ATOM 994 O OE1 . GLN A 1 145 ? 94.655 -43.654 11.502 1.00 56.38 ? 226 GLN A OE1 1 ATOM 995 N NE2 . GLN A 1 145 ? 92.644 -43.832 12.486 1.00 54.42 ? 226 GLN A NE2 1 ATOM 996 N N . ALA A 1 146 ? 90.292 -40.471 8.593 1.00 39.21 ? 227 ALA A N 1 ATOM 997 C CA . ALA A 1 146 ? 89.328 -39.401 8.868 1.00 44.54 ? 227 ALA A CA 1 ATOM 998 C C . ALA A 1 146 ? 88.978 -39.318 10.370 1.00 44.63 ? 227 ALA A C 1 ATOM 999 O O . ALA A 1 146 ? 87.801 -39.216 10.764 1.00 46.92 ? 227 ALA A O 1 ATOM 1000 C CB . ALA A 1 146 ? 88.051 -39.597 8.015 1.00 30.84 ? 227 ALA A CB 1 ATOM 1001 N N . SER A 1 147 ? 90.032 -39.330 11.183 1.00 47.16 ? 228 SER A N 1 ATOM 1002 C CA . SER A 1 147 ? 89.955 -39.541 12.621 1.00 52.65 ? 228 SER A CA 1 ATOM 1003 C C . SER A 1 147 ? 91.346 -39.337 13.201 1.00 50.01 ? 228 SER A C 1 ATOM 1004 O O . SER A 1 147 ? 92.319 -39.210 12.455 1.00 45.89 ? 228 SER A O 1 ATOM 1005 C CB . SER A 1 147 ? 89.516 -40.980 12.916 1.00 50.74 ? 228 SER A CB 1 ATOM 1006 O OG . SER A 1 147 ? 89.354 -41.155 14.308 1.00 63.14 ? 228 SER A OG 1 ATOM 1007 N N . SER A 1 148 ? 91.455 -39.322 14.528 1.00 44.47 ? 229 SER A N 1 ATOM 1008 C CA . SER A 1 148 ? 92.761 -39.176 15.156 1.00 35.92 ? 229 SER A CA 1 ATOM 1009 C C . SER A 1 148 ? 93.579 -40.424 14.895 1.00 47.05 ? 229 SER A C 1 ATOM 1010 O O . SER A 1 148 ? 93.044 -41.543 14.926 1.00 47.49 ? 229 SER A O 1 ATOM 1011 C CB . SER A 1 148 ? 92.620 -38.987 16.671 1.00 47.24 ? 229 SER A CB 1 ATOM 1012 O OG . SER A 1 148 ? 93.896 -38.886 17.297 1.00 47.96 ? 229 SER A OG 1 ATOM 1013 N N . CYS A 1 149 ? 94.868 -40.244 14.623 1.00 39.58 ? 230 CYS A N 1 ATOM 1014 C CA . CYS A 1 149 ? 95.767 -41.386 14.604 1.00 40.06 ? 230 CYS A CA 1 ATOM 1015 C C . CYS A 1 149 ? 96.354 -41.561 16.010 1.00 55.26 ? 230 CYS A C 1 ATOM 1016 O O . CYS A 1 149 ? 96.059 -40.763 16.906 1.00 56.31 ? 230 CYS A O 1 ATOM 1017 C CB . CYS A 1 149 ? 96.823 -41.286 13.489 1.00 43.03 ? 230 CYS A CB 1 ATOM 1018 S SG . CYS A 1 149 ? 97.695 -39.711 13.269 1.00 53.52 ? 230 CYS A SG 1 ATOM 1019 N N . ILE A 1 150 ? 97.138 -42.612 16.226 1.00 55.96 ? 231 ILE A N 1 ATOM 1020 C CA . ILE A 1 150 ? 97.531 -42.947 17.593 1.00 48.61 ? 231 ILE A CA 1 ATOM 1021 C C . ILE A 1 150 ? 99.025 -42.874 17.804 1.00 57.00 ? 231 ILE A C 1 ATOM 1022 O O . ILE A 1 150 ? 99.797 -43.648 17.226 1.00 52.23 ? 231 ILE A O 1 ATOM 1023 C CB . ILE A 1 150 ? 97.086 -44.354 18.013 1.00 53.05 ? 231 ILE A CB 1 ATOM 1024 C CG1 . ILE A 1 150 ? 95.572 -44.531 17.855 1.00 56.24 ? 231 ILE A CG1 1 ATOM 1025 C CG2 . ILE A 1 150 ? 97.529 -44.614 19.449 1.00 50.66 ? 231 ILE A CG2 1 ATOM 1026 C CD1 . ILE A 1 150 ? 94.738 -43.809 18.905 1.00 49.47 ? 231 ILE A CD1 1 ATOM 1027 N N . CYS A 1 151 ? 99.435 -41.938 18.644 1.00 59.50 ? 232 CYS A N 1 ATOM 1028 C CA . CYS A 1 151 ? 100.831 -41.872 19.014 1.00 60.75 ? 232 CYS A CA 1 ATOM 1029 C C . CYS A 1 151 ? 101.028 -42.428 20.403 1.00 61.22 ? 232 CYS A C 1 ATOM 1030 O O . CYS A 1 151 ? 100.270 -42.133 21.325 1.00 68.61 ? 232 CYS A O 1 ATOM 1031 C CB . CYS A 1 151 ? 101.364 -40.447 18.944 1.00 64.84 ? 232 CYS A CB 1 ATOM 1032 S SG . CYS A 1 151 ? 101.420 -39.774 17.281 1.00 69.18 ? 232 CYS A SG 1 ATOM 1033 N N . ASN A 1 152 ? 102.054 -43.250 20.540 1.00 55.93 ? 233 ASN A N 1 ATOM 1034 C CA . ASN A 1 152 ? 102.429 -43.747 21.840 1.00 53.69 ? 233 ASN A CA 1 ATOM 1035 C C . ASN A 1 152 ? 103.920 -44.031 21.912 1.00 59.37 ? 233 ASN A C 1 ATOM 1036 O O . ASN A 1 152 ? 104.480 -44.729 21.055 1.00 61.88 ? 233 ASN A O 1 ATOM 1037 C CB . ASN A 1 152 ? 101.627 -44.991 22.182 1.00 52.94 ? 233 ASN A CB 1 ATOM 1038 C CG . ASN A 1 152 ? 101.820 -45.413 23.599 1.00 62.13 ? 233 ASN A CG 1 ATOM 1039 O OD1 . ASN A 1 152 ? 101.868 -44.578 24.508 1.00 68.05 ? 233 ASN A OD1 1 ATOM 1040 N ND2 . ASN A 1 152 ? 101.947 -46.714 23.808 1.00 72.35 ? 233 ASN A ND2 1 ATOM 1041 N N . ASP A 1 153 ? 104.549 -43.466 22.938 1.00 58.90 ? 234 ASP A N 1 ATOM 1042 C CA . ASP A 1 153 ? 105.985 -43.592 23.176 1.00 62.50 ? 234 ASP A CA 1 ATOM 1043 C C . ASP A 1 153 ? 106.857 -43.295 21.943 1.00 60.03 ? 234 ASP A C 1 ATOM 1044 O O . ASP A 1 153 ? 107.792 -44.028 21.639 1.00 61.93 ? 234 ASP A O 1 ATOM 1045 C CB . ASP A 1 153 ? 106.308 -44.970 23.762 1.00 69.86 ? 234 ASP A CB 1 ATOM 1046 C CG . ASP A 1 153 ? 107.530 -44.949 24.661 1.00 87.98 ? 234 ASP A CG 1 ATOM 1047 O OD1 . ASP A 1 153 ? 107.834 -43.879 25.240 1.00 85.84 ? 234 ASP A OD1 1 ATOM 1048 O OD2 . ASP A 1 153 ? 108.186 -46.007 24.791 1.00 99.61 ? 234 ASP A OD2 1 ATOM 1049 N N . GLY A 1 154 ? 106.544 -42.222 21.228 1.00 62.20 ? 235 GLY A N 1 ATOM 1050 C CA . GLY A 1 154 ? 107.387 -41.796 20.125 1.00 54.77 ? 235 GLY A CA 1 ATOM 1051 C C . GLY A 1 154 ? 106.958 -42.249 18.739 1.00 66.17 ? 235 GLY A C 1 ATOM 1052 O O . GLY A 1 154 ? 107.336 -41.621 17.743 1.00 70.71 ? 235 GLY A O 1 ATOM 1053 N N . THR A 1 155 ? 106.180 -43.331 18.664 1.00 52.17 ? 236 THR A N 1 ATOM 1054 C CA . THR A 1 155 ? 105.705 -43.834 17.383 1.00 48.60 ? 236 THR A CA 1 ATOM 1055 C C . THR A 1 155 ? 104.233 -43.522 17.143 1.00 46.30 ? 236 THR A C 1 ATOM 1056 O O . THR A 1 155 ? 103.406 -43.677 18.034 1.00 41.57 ? 236 THR A O 1 ATOM 1057 C CB . THR A 1 155 ? 105.872 -45.369 17.260 1.00 47.11 ? 236 THR A CB 1 ATOM 1058 O OG1 . THR A 1 155 ? 107.246 -45.728 17.449 1.00 53.36 ? 236 THR A OG1 1 ATOM 1059 C CG2 . THR A 1 155 ? 105.403 -45.843 15.888 1.00 48.91 ? 236 THR A CG2 1 ATOM 1060 N N . CYS A 1 156 ? 103.898 -43.112 15.925 1.00 51.22 ? 237 CYS A N 1 ATOM 1061 C CA . CYS A 1 156 ? 102.491 -42.960 15.567 1.00 54.01 ? 237 CYS A CA 1 ATOM 1062 C C . CYS A 1 156 ? 102.021 -44.082 14.658 1.00 45.66 ? 237 CYS A C 1 ATOM 1063 O O . CYS A 1 156 ? 102.795 -44.645 13.884 1.00 48.87 ? 237 CYS A O 1 ATOM 1064 C CB . CYS A 1 156 ? 102.251 -41.594 14.941 1.00 52.51 ? 237 CYS A CB 1 ATOM 1065 S SG . CYS A 1 156 ? 102.923 -40.285 16.001 1.00 78.05 ? 237 CYS A SG 1 ATOM 1066 N N . TYR A 1 157 ? 100.750 -44.428 14.781 1.00 49.64 ? 238 TYR A N 1 ATOM 1067 C CA . TYR A 1 157 ? 100.184 -45.497 13.965 1.00 46.76 ? 238 TYR A CA 1 ATOM 1068 C C . TYR A 1 157 ? 98.962 -44.988 13.229 1.00 45.20 ? 238 TYR A C 1 ATOM 1069 O O . TYR A 1 157 ? 98.161 -44.216 13.774 1.00 53.40 ? 238 TYR A O 1 ATOM 1070 C CB . TYR A 1 157 ? 99.817 -46.702 14.828 1.00 41.73 ? 238 TYR A CB 1 ATOM 1071 C CG . TYR A 1 157 ? 100.973 -47.171 15.639 1.00 48.03 ? 238 TYR A CG 1 ATOM 1072 C CD1 . TYR A 1 157 ? 101.944 -47.994 15.077 1.00 50.19 ? 238 TYR A CD1 1 ATOM 1073 C CD2 . TYR A 1 157 ? 101.120 -46.775 16.962 1.00 51.77 ? 238 TYR A CD2 1 ATOM 1074 C CE1 . TYR A 1 157 ? 103.027 -48.430 15.820 1.00 64.64 ? 238 TYR A CE1 1 ATOM 1075 C CE2 . TYR A 1 157 ? 102.198 -47.205 17.714 1.00 60.79 ? 238 TYR A CE2 1 ATOM 1076 C CZ . TYR A 1 157 ? 103.148 -48.032 17.141 1.00 70.22 ? 238 TYR A CZ 1 ATOM 1077 O OH . TYR A 1 157 ? 104.225 -48.461 17.876 1.00 74.73 ? 238 TYR A OH 1 ATOM 1078 N N . THR A 1 158 ? 98.821 -45.409 11.983 1.00 45.39 ? 239 THR A N 1 ATOM 1079 C CA . THR A 1 158 ? 97.698 -44.935 11.197 1.00 56.07 ? 239 THR A CA 1 ATOM 1080 C C . THR A 1 158 ? 97.328 -45.986 10.170 1.00 56.05 ? 239 THR A C 1 ATOM 1081 O O . THR A 1 158 ? 98.076 -46.950 9.963 1.00 53.89 ? 239 THR A O 1 ATOM 1082 C CB . THR A 1 158 ? 98.014 -43.562 10.547 1.00 55.46 ? 239 THR A CB 1 ATOM 1083 O OG1 . THR A 1 158 ? 96.793 -42.891 10.218 1.00 41.51 ? 239 THR A OG1 1 ATOM 1084 C CG2 . THR A 1 158 ? 98.900 -43.725 9.305 1.00 49.13 ? 239 THR A CG2 1 ATOM 1085 N N . ILE A 1 159 ? 96.162 -45.830 9.553 1.00 54.76 ? 240 ILE A N 1 ATOM 1086 C CA . ILE A 1 159 ? 95.714 -46.809 8.567 1.00 54.35 ? 240 ILE A CA 1 ATOM 1087 C C . ILE A 1 159 ? 95.248 -46.105 7.310 1.00 43.58 ? 240 ILE A C 1 ATOM 1088 O O . ILE A 1 159 ? 94.470 -45.148 7.378 1.00 50.38 ? 240 ILE A O 1 ATOM 1089 C CB . ILE A 1 159 ? 94.600 -47.723 9.140 1.00 48.74 ? 240 ILE A CB 1 ATOM 1090 C CG1 . ILE A 1 159 ? 95.142 -48.556 10.316 1.00 37.58 ? 240 ILE A CG1 1 ATOM 1091 C CG2 . ILE A 1 159 ? 94.061 -48.654 8.051 1.00 49.05 ? 240 ILE A CG2 1 ATOM 1092 C CD1 . ILE A 1 159 ? 94.078 -49.006 11.326 1.00 41.47 ? 240 ILE A CD1 1 ATOM 1093 N N . ILE A 1 160 ? 95.731 -46.570 6.162 1.00 54.67 ? 241 ILE A N 1 ATOM 1094 C CA . ILE A 1 160 ? 95.425 -45.914 4.884 1.00 48.30 ? 241 ILE A CA 1 ATOM 1095 C C . ILE A 1 160 ? 94.785 -46.885 3.891 1.00 44.55 ? 241 ILE A C 1 ATOM 1096 O O . ILE A 1 160 ? 95.222 -48.027 3.751 1.00 50.13 ? 241 ILE A O 1 ATOM 1097 C CB . ILE A 1 160 ? 96.681 -45.250 4.269 1.00 41.95 ? 241 ILE A CB 1 ATOM 1098 C CG1 . ILE A 1 160 ? 97.233 -44.170 5.206 1.00 43.92 ? 241 ILE A CG1 1 ATOM 1099 C CG2 . ILE A 1 160 ? 96.369 -44.608 2.918 1.00 39.47 ? 241 ILE A CG2 1 ATOM 1100 C CD1 . ILE A 1 160 ? 98.487 -43.479 4.661 1.00 42.79 ? 241 ILE A CD1 1 ATOM 1101 N N . ALA A 1 161 ? 93.740 -46.429 3.207 1.00 41.03 ? 242 ALA A N 1 ATOM 1102 C CA . ALA A 1 161 ? 93.048 -47.281 2.247 1.00 48.75 ? 242 ALA A CA 1 ATOM 1103 C C . ALA A 1 161 ? 93.342 -46.888 0.789 1.00 44.91 ? 242 ALA A C 1 ATOM 1104 O O . ALA A 1 161 ? 93.459 -45.700 0.465 1.00 50.59 ? 242 ALA A O 1 ATOM 1105 C CB . ALA A 1 161 ? 91.551 -47.257 2.512 1.00 34.70 ? 242 ALA A CB 1 ATOM 1106 N N . ASP A 1 162 ? 93.449 -47.893 -0.079 1.00 52.37 ? 243 ASP A N 1 ATOM 1107 C CA . ASP A 1 162 ? 93.567 -47.684 -1.522 1.00 54.73 ? 243 ASP A CA 1 ATOM 1108 C C . ASP A 1 162 ? 92.498 -48.535 -2.191 1.00 57.81 ? 243 ASP A C 1 ATOM 1109 O O . ASP A 1 162 ? 91.692 -49.165 -1.492 1.00 50.57 ? 243 ASP A O 1 ATOM 1110 C CB . ASP A 1 162 ? 94.951 -48.089 -2.033 1.00 50.87 ? 243 ASP A CB 1 ATOM 1111 C CG . ASP A 1 162 ? 95.270 -47.495 -3.405 1.00 71.11 ? 243 ASP A CG 1 ATOM 1112 O OD1 . ASP A 1 162 ? 94.333 -47.016 -4.088 1.00 84.12 ? 243 ASP A OD1 1 ATOM 1113 O OD2 . ASP A 1 162 ? 96.456 -47.515 -3.807 1.00 60.46 ? 243 ASP A OD2 1 ATOM 1114 N N . GLY A 1 163 ? 92.468 -48.534 -3.526 1.00 59.78 ? 244 GLY A N 1 ATOM 1115 C CA . GLY A 1 163 ? 91.466 -49.274 -4.270 1.00 57.88 ? 244 GLY A CA 1 ATOM 1116 C C . GLY A 1 163 ? 90.375 -48.368 -4.802 1.00 61.42 ? 244 GLY A C 1 ATOM 1117 O O . GLY A 1 163 ? 89.925 -47.451 -4.112 1.00 55.92 ? 244 GLY A O 1 ATOM 1118 N N . THR A 1 164 ? 89.929 -48.634 -6.025 1.00 67.64 ? 245 THR A N 1 ATOM 1119 C CA . THR A 1 164 ? 88.972 -47.747 -6.682 1.00 57.50 ? 245 THR A CA 1 ATOM 1120 C C . THR A 1 164 ? 87.522 -48.066 -6.297 1.00 56.71 ? 245 THR A C 1 ATOM 1121 O O . THR A 1 164 ? 86.638 -47.235 -6.482 1.00 61.52 ? 245 THR A O 1 ATOM 1122 C CB . THR A 1 164 ? 89.151 -47.760 -8.215 1.00 58.48 ? 245 THR A CB 1 ATOM 1123 O OG1 . THR A 1 164 ? 88.792 -49.049 -8.737 1.00 64.14 ? 245 THR A OG1 1 ATOM 1124 C CG2 . THR A 1 164 ? 90.615 -47.431 -8.598 1.00 42.63 ? 245 THR A CG2 1 ATOM 1125 N N . THR A 1 165 ? 87.290 -49.262 -5.755 1.00 53.61 ? 246 THR A N 1 ATOM 1126 C CA . THR A 1 165 ? 85.965 -49.659 -5.251 1.00 67.62 ? 246 THR A CA 1 ATOM 1127 C C . THR A 1 165 ? 86.046 -50.334 -3.890 1.00 62.35 ? 246 THR A C 1 ATOM 1128 O O . THR A 1 165 ? 87.041 -50.975 -3.562 1.00 67.02 ? 246 THR A O 1 ATOM 1129 C CB . THR A 1 165 ? 85.285 -50.692 -6.152 1.00 80.94 ? 246 THR A CB 1 ATOM 1130 O OG1 . THR A 1 165 ? 86.252 -51.676 -6.551 1.00 86.30 ? 246 THR A OG1 1 ATOM 1131 C CG2 . THR A 1 165 ? 84.682 -50.029 -7.365 1.00 93.19 ? 246 THR A CG2 1 ATOM 1132 N N . TYR A 1 166 ? 84.962 -50.235 -3.129 1.00 57.22 ? 247 TYR A N 1 ATOM 1133 C CA . TYR A 1 166 ? 84.890 -50.779 -1.771 1.00 47.06 ? 247 TYR A CA 1 ATOM 1134 C C . TYR A 1 166 ? 84.775 -52.295 -1.815 1.00 55.80 ? 247 TYR A C 1 ATOM 1135 O O . TYR A 1 166 ? 85.009 -52.988 -0.827 1.00 67.67 ? 247 TYR A O 1 ATOM 1136 C CB . TYR A 1 166 ? 83.736 -50.113 -1.022 1.00 51.22 ? 247 TYR A CB 1 ATOM 1137 C CG . TYR A 1 166 ? 83.989 -48.622 -0.860 1.00 89.20 ? 247 TYR A CG 1 ATOM 1138 C CD1 . TYR A 1 166 ? 85.221 -48.154 -0.393 1.00 96.36 ? 247 TYR A CD1 1 ATOM 1139 C CD2 . TYR A 1 166 ? 83.027 -47.680 -1.215 1.00 104.40 ? 247 TYR A CD2 1 ATOM 1140 C CE1 . TYR A 1 166 ? 85.479 -46.790 -0.256 1.00 98.39 ? 247 TYR A CE1 1 ATOM 1141 C CE2 . TYR A 1 166 ? 83.280 -46.301 -1.081 1.00 106.88 ? 247 TYR A CE2 1 ATOM 1142 C CZ . TYR A 1 166 ? 84.511 -45.869 -0.598 1.00 98.14 ? 247 TYR A CZ 1 ATOM 1143 O OH . TYR A 1 166 ? 84.780 -44.524 -0.453 1.00 82.82 ? 247 TYR A OH 1 ATOM 1144 N N . THR A 1 167 ? 84.470 -52.795 -3.003 1.00 49.08 ? 248 THR A N 1 ATOM 1145 C CA . THR A 1 167 ? 84.342 -54.225 -3.259 1.00 74.85 ? 248 THR A CA 1 ATOM 1146 C C . THR A 1 167 ? 85.718 -54.849 -3.500 1.00 73.88 ? 248 THR A C 1 ATOM 1147 O O . THR A 1 167 ? 85.872 -56.082 -3.482 1.00 65.78 ? 248 THR A O 1 ATOM 1148 C CB . THR A 1 167 ? 83.430 -54.477 -4.488 1.00 83.79 ? 248 THR A CB 1 ATOM 1149 O OG1 . THR A 1 167 ? 83.772 -53.552 -5.538 1.00 75.78 ? 248 THR A OG1 1 ATOM 1150 C CG2 . THR A 1 167 ? 81.949 -54.303 -4.109 1.00 58.74 ? 248 THR A CG2 1 ATOM 1151 N N . ALA A 1 168 ? 86.704 -53.985 -3.740 1.00 58.96 ? 249 ALA A N 1 ATOM 1152 C CA . ALA A 1 168 ? 88.090 -54.407 -3.887 1.00 56.44 ? 249 ALA A CA 1 ATOM 1153 C C . ALA A 1 168 ? 89.008 -53.341 -3.304 1.00 67.64 ? 249 ALA A C 1 ATOM 1154 O O . ALA A 1 168 ? 89.837 -52.747 -4.016 1.00 60.57 ? 249 ALA A O 1 ATOM 1155 C CB . ALA A 1 168 ? 88.420 -54.652 -5.342 1.00 55.83 ? 249 ALA A CB 1 ATOM 1156 N N . SER A 1 169 ? 88.837 -53.095 -2.005 1.00 72.09 ? 250 SER A N 1 ATOM 1157 C CA . SER A 1 169 ? 89.647 -52.120 -1.277 1.00 57.83 ? 250 SER A CA 1 ATOM 1158 C C . SER A 1 169 ? 90.868 -52.809 -0.674 1.00 56.78 ? 250 SER A C 1 ATOM 1159 O O . SER A 1 169 ? 90.848 -54.017 -0.406 1.00 60.77 ? 250 SER A O 1 ATOM 1160 C CB . SER A 1 169 ? 88.828 -51.472 -0.163 1.00 56.75 ? 250 SER A CB 1 ATOM 1161 O OG . SER A 1 169 ? 88.517 -52.417 0.848 1.00 69.27 ? 250 SER A OG 1 ATOM 1162 N N . SER A 1 170 ? 91.931 -52.039 -0.474 1.00 52.07 ? 251 SER A N 1 ATOM 1163 C CA . SER A 1 170 ? 93.163 -52.547 0.130 1.00 57.85 ? 251 SER A CA 1 ATOM 1164 C C . SER A 1 170 ? 93.513 -51.661 1.335 1.00 55.40 ? 251 SER A C 1 ATOM 1165 O O . SER A 1 170 ? 93.298 -50.441 1.306 1.00 45.14 ? 251 SER A O 1 ATOM 1166 C CB . SER A 1 170 ? 94.310 -52.563 -0.901 1.00 49.84 ? 251 SER A CB 1 ATOM 1167 O OG . SER A 1 170 ? 94.801 -51.248 -1.188 1.00 49.00 ? 251 SER A OG 1 ATOM 1168 N N . HIS A 1 171 ? 94.039 -52.260 2.399 1.00 54.99 ? 252 HIS A N 1 ATOM 1169 C CA . HIS A 1 171 ? 94.301 -51.480 3.609 1.00 51.29 ? 252 HIS A CA 1 ATOM 1170 C C . HIS A 1 171 ? 95.686 -51.724 4.194 1.00 48.23 ? 252 HIS A C 1 ATOM 1171 O O . HIS A 1 171 ? 96.179 -52.853 4.251 1.00 60.31 ? 252 HIS A O 1 ATOM 1172 C CB . HIS A 1 171 ? 93.170 -51.679 4.630 1.00 43.97 ? 252 HIS A CB 1 ATOM 1173 C CG . HIS A 1 171 ? 91.808 -51.447 4.046 1.00 52.08 ? 252 HIS A CG 1 ATOM 1174 N ND1 . HIS A 1 171 ? 91.205 -50.201 4.032 1.00 55.79 ? 252 HIS A ND1 1 ATOM 1175 C CD2 . HIS A 1 171 ? 90.963 -52.282 3.394 1.00 50.27 ? 252 HIS A CD2 1 ATOM 1176 C CE1 . HIS A 1 171 ? 90.034 -50.294 3.429 1.00 45.15 ? 252 HIS A CE1 1 ATOM 1177 N NE2 . HIS A 1 171 ? 89.857 -51.539 3.034 1.00 48.43 ? 252 HIS A NE2 1 ATOM 1178 N N . ARG A 1 172 ? 96.324 -50.636 4.596 1.00 46.67 ? 253 ARG A N 1 ATOM 1179 C CA . ARG A 1 172 ? 97.695 -50.688 5.080 1.00 48.53 ? 253 ARG A CA 1 ATOM 1180 C C . ARG A 1 172 ? 97.854 -50.015 6.423 1.00 59.71 ? 253 ARG A C 1 ATOM 1181 O O . ARG A 1 172 ? 97.339 -48.914 6.670 1.00 66.60 ? 253 ARG A O 1 ATOM 1182 C CB . ARG A 1 172 ? 98.646 -50.027 4.086 1.00 38.81 ? 253 ARG A CB 1 ATOM 1183 C CG . ARG A 1 172 ? 99.248 -50.980 3.088 1.00 40.14 ? 253 ARG A CG 1 ATOM 1184 C CD . ARG A 1 172 ? 99.930 -50.212 1.981 1.00 46.57 ? 253 ARG A CD 1 ATOM 1185 N NE . ARG A 1 172 ? 100.230 -51.050 0.823 1.00 55.93 ? 253 ARG A NE 1 ATOM 1186 C CZ . ARG A 1 172 ? 101.155 -50.743 -0.079 1.00 60.61 ? 253 ARG A CZ 1 ATOM 1187 N NH1 . ARG A 1 172 ? 101.857 -49.630 0.073 1.00 56.04 ? 253 ARG A NH1 1 ATOM 1188 N NH2 . ARG A 1 172 ? 101.385 -51.545 -1.119 1.00 63.65 ? 253 ARG A NH2 1 ATOM 1189 N N . LEU A 1 173 ? 98.602 -50.685 7.284 1.00 57.10 ? 254 LEU A N 1 ATOM 1190 C CA . LEU A 1 173 ? 98.869 -50.219 8.637 1.00 56.55 ? 254 LEU A CA 1 ATOM 1191 C C . LEU A 1 173 ? 100.232 -49.523 8.608 1.00 55.88 ? 254 LEU A C 1 ATOM 1192 O O . LEU A 1 173 ? 101.238 -50.160 8.285 1.00 60.71 ? 254 LEU A O 1 ATOM 1193 C CB . LEU A 1 173 ? 98.985 -51.449 9.517 1.00 63.14 ? 254 LEU A CB 1 ATOM 1194 C CG . LEU A 1 173 ? 98.703 -51.414 11.009 1.00 66.71 ? 254 LEU A CG 1 ATOM 1195 C CD1 . LEU A 1 173 ? 97.285 -51.815 11.182 1.00 87.25 ? 254 LEU A CD1 1 ATOM 1196 C CD2 . LEU A 1 173 ? 99.568 -52.405 11.735 1.00 63.76 ? 254 LEU A CD2 1 ATOM 1197 N N . TYR A 1 174 ? 100.285 -48.234 8.934 1.00 57.23 ? 255 TYR A N 1 ATOM 1198 C CA . TYR A 1 174 ? 101.552 -47.489 8.895 1.00 49.74 ? 255 TYR A CA 1 ATOM 1199 C C . TYR A 1 174 ? 102.106 -47.155 10.283 1.00 51.08 ? 255 TYR A C 1 ATOM 1200 O O . TYR A 1 174 ? 101.355 -46.759 11.184 1.00 55.49 ? 255 TYR A O 1 ATOM 1201 C CB . TYR A 1 174 ? 101.388 -46.185 8.079 1.00 43.50 ? 255 TYR A CB 1 ATOM 1202 C CG . TYR A 1 174 ? 101.425 -46.406 6.581 1.00 52.81 ? 255 TYR A CG 1 ATOM 1203 C CD1 . TYR A 1 174 ? 100.268 -46.726 5.867 1.00 48.29 ? 255 TYR A CD1 1 ATOM 1204 C CD2 . TYR A 1 174 ? 102.623 -46.307 5.881 1.00 50.22 ? 255 TYR A CD2 1 ATOM 1205 C CE1 . TYR A 1 174 ? 100.306 -46.933 4.493 1.00 59.20 ? 255 TYR A CE1 1 ATOM 1206 C CE2 . TYR A 1 174 ? 102.674 -46.516 4.510 1.00 61.54 ? 255 TYR A CE2 1 ATOM 1207 C CZ . TYR A 1 174 ? 101.514 -46.833 3.813 1.00 67.26 ? 255 TYR A CZ 1 ATOM 1208 O OH . TYR A 1 174 ? 101.578 -47.059 2.444 1.00 66.87 ? 255 TYR A OH 1 ATOM 1209 N N . ARG A 1 175 ? 103.419 -47.295 10.453 1.00 53.52 ? 256 ARG A N 1 ATOM 1210 C CA . ARG A 1 175 ? 104.080 -46.757 11.646 1.00 55.29 ? 256 ARG A CA 1 ATOM 1211 C C . ARG A 1 175 ? 104.918 -45.549 11.258 1.00 55.33 ? 256 ARG A C 1 ATOM 1212 O O . ARG A 1 175 ? 105.589 -45.540 10.225 1.00 55.13 ? 256 ARG A O 1 ATOM 1213 C CB . ARG A 1 175 ? 104.911 -47.809 12.392 1.00 59.25 ? 256 ARG A CB 1 ATOM 1214 C CG . ARG A 1 175 ? 106.345 -48.019 11.926 1.00 51.05 ? 256 ARG A CG 1 ATOM 1215 C CD . ARG A 1 175 ? 107.115 -48.946 12.889 1.00 53.99 ? 256 ARG A CD 1 ATOM 1216 N NE . ARG A 1 175 ? 106.774 -50.354 12.698 1.00 45.21 ? 256 ARG A NE 1 ATOM 1217 C CZ . ARG A 1 175 ? 106.280 -51.142 13.651 1.00 64.71 ? 256 ARG A CZ 1 ATOM 1218 N NH1 . ARG A 1 175 ? 106.089 -50.662 14.878 1.00 78.72 ? 256 ARG A NH1 1 ATOM 1219 N NH2 . ARG A 1 175 ? 105.985 -52.412 13.385 1.00 65.38 ? 256 ARG A NH2 1 ATOM 1220 N N . LEU A 1 176 ? 104.842 -44.506 12.071 1.00 51.94 ? 257 LEU A N 1 ATOM 1221 C CA . LEU A 1 176 ? 105.451 -43.217 11.726 1.00 48.85 ? 257 LEU A CA 1 ATOM 1222 C C . LEU A 1 176 ? 106.344 -42.732 12.868 1.00 52.88 ? 257 LEU A C 1 ATOM 1223 O O . LEU A 1 176 ? 105.941 -42.789 14.045 1.00 45.90 ? 257 LEU A O 1 ATOM 1224 C CB . LEU A 1 176 ? 104.352 -42.178 11.461 1.00 46.73 ? 257 LEU A CB 1 ATOM 1225 C CG . LEU A 1 176 ? 103.905 -41.854 10.036 1.00 63.62 ? 257 LEU A CG 1 ATOM 1226 C CD1 . LEU A 1 176 ? 103.572 -43.104 9.279 1.00 51.49 ? 257 LEU A CD1 1 ATOM 1227 C CD2 . LEU A 1 176 ? 102.691 -40.942 10.077 1.00 61.83 ? 257 LEU A CD2 1 ATOM 1228 N N . VAL A 1 177 ? 107.544 -42.259 12.530 1.00 57.52 ? 258 VAL A N 1 ATOM 1229 C CA . VAL A 1 177 ? 108.440 -41.679 13.533 1.00 48.44 ? 258 VAL A CA 1 ATOM 1230 C C . VAL A 1 177 ? 108.922 -40.283 13.160 1.00 61.26 ? 258 VAL A C 1 ATOM 1231 O O . VAL A 1 177 ? 109.591 -40.089 12.130 1.00 62.39 ? 258 VAL A O 1 ATOM 1232 C CB . VAL A 1 177 ? 109.642 -42.572 13.823 1.00 45.79 ? 258 VAL A CB 1 ATOM 1233 C CG1 . VAL A 1 177 ? 110.658 -41.806 14.668 1.00 42.56 ? 258 VAL A CG1 1 ATOM 1234 C CG2 . VAL A 1 177 ? 109.183 -43.849 14.521 1.00 35.54 ? 258 VAL A CG2 1 ATOM 1235 N N . ASN A 1 178 ? 108.572 -39.321 14.014 1.00 65.20 ? 259 ASN A N 1 ATOM 1236 C CA . ASN A 1 178 ? 108.774 -37.903 13.732 1.00 55.61 ? 259 ASN A CA 1 ATOM 1237 C C . ASN A 1 178 ? 108.289 -37.524 12.326 1.00 55.33 ? 259 ASN A C 1 ATOM 1238 O O . ASN A 1 178 ? 108.895 -36.699 11.635 1.00 64.85 ? 259 ASN A O 1 ATOM 1239 C CB . ASN A 1 178 ? 110.237 -37.509 13.949 1.00 51.04 ? 259 ASN A CB 1 ATOM 1240 C CG . ASN A 1 178 ? 110.739 -37.837 15.355 1.00 61.41 ? 259 ASN A CG 1 ATOM 1241 O OD1 . ASN A 1 178 ? 109.953 -37.985 16.307 1.00 54.34 ? 259 ASN A OD1 1 ATOM 1242 N ND2 . ASN A 1 178 ? 112.070 -37.950 15.485 1.00 74.33 ? 259 ASN A ND2 1 ATOM 1243 N N . GLY A 1 179 ? 107.196 -38.151 11.906 1.00 60.05 ? 260 GLY A N 1 ATOM 1244 C CA . GLY A 1 179 ? 106.578 -37.831 10.634 1.00 56.47 ? 260 GLY A CA 1 ATOM 1245 C C . GLY A 1 179 ? 107.083 -38.590 9.422 1.00 60.11 ? 260 GLY A C 1 ATOM 1246 O O . GLY A 1 179 ? 106.478 -38.506 8.356 1.00 57.83 ? 260 GLY A O 1 ATOM 1247 N N . THR A 1 180 ? 108.193 -39.315 9.549 1.00 56.02 ? 261 THR A N 1 ATOM 1248 C CA . THR A 1 180 ? 108.652 -40.123 8.410 1.00 57.30 ? 261 THR A CA 1 ATOM 1249 C C . THR A 1 180 ? 108.165 -41.564 8.570 1.00 61.67 ? 261 THR A C 1 ATOM 1250 O O . THR A 1 180 ? 108.063 -42.075 9.691 1.00 65.05 ? 261 THR A O 1 ATOM 1251 C CB . THR A 1 180 ? 110.197 -40.080 8.199 1.00 76.68 ? 261 THR A CB 1 ATOM 1252 O OG1 . THR A 1 180 ? 110.830 -41.058 9.029 1.00 83.16 ? 261 THR A OG1 1 ATOM 1253 C CG2 . THR A 1 180 ? 110.758 -38.693 8.526 1.00 85.96 ? 261 THR A CG2 1 ATOM 1254 N N . SER A 1 181 ? 107.846 -42.216 7.458 1.00 56.98 ? 262 SER A N 1 ATOM 1255 C CA . SER A 1 181 ? 107.426 -43.608 7.536 1.00 60.35 ? 262 SER A CA 1 ATOM 1256 C C . SER A 1 181 ? 108.542 -44.542 8.049 1.00 61.70 ? 262 SER A C 1 ATOM 1257 O O . SER A 1 181 ? 109.662 -44.564 7.527 1.00 65.91 ? 262 SER A O 1 ATOM 1258 C CB . SER A 1 181 ? 106.892 -44.113 6.198 1.00 51.18 ? 262 SER A CB 1 ATOM 1259 O OG . SER A 1 181 ? 106.489 -45.464 6.332 1.00 61.99 ? 262 SER A OG 1 ATOM 1260 N N . ALA A 1 182 ? 108.227 -45.300 9.089 1.00 57.62 ? 263 ALA A N 1 ATOM 1261 C CA . ALA A 1 182 ? 109.141 -46.314 9.584 1.00 54.80 ? 263 ALA A CA 1 ATOM 1262 C C . ALA A 1 182 ? 108.664 -47.684 9.134 1.00 59.70 ? 263 ALA A C 1 ATOM 1263 O O . ALA A 1 182 ? 109.132 -48.705 9.634 1.00 64.97 ? 263 ALA A O 1 ATOM 1264 C CB . ALA A 1 182 ? 109.247 -46.255 11.100 1.00 42.17 ? 263 ALA A CB 1 ATOM 1265 N N . GLY A 1 183 ? 107.724 -47.699 8.193 1.00 57.61 ? 264 GLY A N 1 ATOM 1266 C CA . GLY A 1 183 ? 107.257 -48.945 7.616 1.00 50.55 ? 264 GLY A CA 1 ATOM 1267 C C . GLY A 1 183 ? 105.745 -49.119 7.597 1.00 59.52 ? 264 GLY A C 1 ATOM 1268 O O . GLY A 1 183 ? 105.004 -48.356 8.238 1.00 52.20 ? 264 GLY A O 1 ATOM 1269 N N . TRP A 1 184 ? 105.288 -50.125 6.843 1.00 55.04 ? 265 TRP A N 1 ATOM 1270 C CA . TRP A 1 184 ? 103.873 -50.494 6.811 1.00 40.97 ? 265 TRP A CA 1 ATOM 1271 C C . TRP A 1 184 ? 103.675 -52.010 6.706 1.00 47.68 ? 265 TRP A C 1 ATOM 1272 O O . TRP A 1 184 ? 104.619 -52.760 6.450 1.00 50.24 ? 265 TRP A O 1 ATOM 1273 C CB . TRP A 1 184 ? 103.124 -49.778 5.669 1.00 38.10 ? 265 TRP A CB 1 ATOM 1274 C CG . TRP A 1 184 ? 103.662 -50.096 4.301 1.00 45.69 ? 265 TRP A CG 1 ATOM 1275 C CD1 . TRP A 1 184 ? 104.600 -49.383 3.604 1.00 53.64 ? 265 TRP A CD1 1 ATOM 1276 C CD2 . TRP A 1 184 ? 103.305 -51.219 3.462 1.00 41.55 ? 265 TRP A CD2 1 ATOM 1277 N NE1 . TRP A 1 184 ? 104.846 -49.986 2.382 1.00 56.80 ? 265 TRP A NE1 1 ATOM 1278 C CE2 . TRP A 1 184 ? 104.069 -51.111 2.270 1.00 49.61 ? 265 TRP A CE2 1 ATOM 1279 C CE3 . TRP A 1 184 ? 102.415 -52.290 3.602 1.00 40.16 ? 265 TRP A CE3 1 ATOM 1280 C CZ2 . TRP A 1 184 ? 103.962 -52.043 1.211 1.00 38.65 ? 265 TRP A CZ2 1 ATOM 1281 C CZ3 . TRP A 1 184 ? 102.312 -53.224 2.555 1.00 48.64 ? 265 TRP A CZ3 1 ATOM 1282 C CH2 . TRP A 1 184 ? 103.082 -53.091 1.375 1.00 39.11 ? 265 TRP A CH2 1 ATOM 1283 N N . LYS A 1 185 ? 102.435 -52.443 6.906 1.00 52.12 ? 266 LYS A N 1 ATOM 1284 C CA . LYS A 1 185 ? 102.066 -53.845 6.815 1.00 49.60 ? 266 LYS A CA 1 ATOM 1285 C C . LYS A 1 185 ? 100.734 -53.961 6.076 1.00 55.94 ? 266 LYS A C 1 ATOM 1286 O O . LYS A 1 185 ? 99.754 -53.282 6.417 1.00 51.72 ? 266 LYS A O 1 ATOM 1287 C CB . LYS A 1 185 ? 101.919 -54.426 8.229 1.00 47.85 ? 266 LYS A CB 1 ATOM 1288 C CG . LYS A 1 185 ? 101.439 -55.886 8.307 1.00 39.80 ? 266 LYS A CG 1 ATOM 1289 C CD . LYS A 1 185 ? 102.268 -56.616 9.348 1.00 50.66 ? 266 LYS A CD 1 ATOM 1290 C CE . LYS A 1 185 ? 101.795 -58.015 9.632 1.00 55.54 ? 266 LYS A CE 1 ATOM 1291 N NZ . LYS A 1 185 ? 102.662 -58.586 10.710 1.00 68.27 ? 266 LYS A NZ 1 ATOM 1292 N N . ALA A 1 186 ? 100.694 -54.804 5.053 1.00 56.38 ? 267 ALA A N 1 ATOM 1293 C CA . ALA A 1 186 ? 99.424 -55.120 4.411 1.00 58.46 ? 267 ALA A CA 1 ATOM 1294 C C . ALA A 1 186 ? 98.491 -55.822 5.409 1.00 52.49 ? 267 ALA A C 1 ATOM 1295 O O . ALA A 1 186 ? 98.877 -56.785 6.064 1.00 55.19 ? 267 ALA A O 1 ATOM 1296 C CB . ALA A 1 186 ? 99.644 -55.995 3.174 1.00 42.82 ? 267 ALA A CB 1 ATOM 1297 N N . LEU A 1 187 ? 97.269 -55.323 5.535 1.00 53.69 ? 268 LEU A N 1 ATOM 1298 C CA . LEU A 1 187 ? 96.265 -55.984 6.353 1.00 56.31 ? 268 LEU A CA 1 ATOM 1299 C C . LEU A 1 187 ? 95.485 -56.937 5.453 1.00 61.40 ? 268 LEU A C 1 ATOM 1300 O O . LEU A 1 187 ? 95.116 -56.574 4.335 1.00 70.28 ? 268 LEU A O 1 ATOM 1301 C CB . LEU A 1 187 ? 95.337 -54.939 6.983 1.00 50.14 ? 268 LEU A CB 1 ATOM 1302 C CG . LEU A 1 187 ? 96.025 -53.972 7.960 1.00 52.66 ? 268 LEU A CG 1 ATOM 1303 C CD1 . LEU A 1 187 ? 95.236 -52.655 8.144 1.00 36.76 ? 268 LEU A CD1 1 ATOM 1304 C CD2 . LEU A 1 187 ? 96.287 -54.655 9.325 1.00 53.59 ? 268 LEU A CD2 1 ATOM 1305 N N . ASP A 1 188 ? 95.251 -58.163 5.901 1.00 62.80 ? 269 ASP A N 1 ATOM 1306 C CA . ASP A 1 188 ? 94.399 -59.052 5.114 1.00 62.78 ? 269 ASP A CA 1 ATOM 1307 C C . ASP A 1 188 ? 92.932 -58.650 5.330 1.00 62.06 ? 269 ASP A C 1 ATOM 1308 O O . ASP A 1 188 ? 92.355 -58.901 6.388 1.00 54.75 ? 269 ASP A O 1 ATOM 1309 C CB . ASP A 1 188 ? 94.659 -60.529 5.454 1.00 51.49 ? 269 ASP A CB 1 ATOM 1310 C CG . ASP A 1 188 ? 93.700 -61.483 4.743 1.00 70.58 ? 269 ASP A CG 1 ATOM 1311 O OD1 . ASP A 1 188 ? 93.042 -61.072 3.760 1.00 73.30 ? 269 ASP A OD1 1 ATOM 1312 O OD2 . ASP A 1 188 ? 93.609 -62.657 5.168 1.00 76.60 ? 269 ASP A OD2 1 ATOM 1313 N N . THR A 1 189 ? 92.349 -57.999 4.325 1.00 63.38 ? 270 THR A N 1 ATOM 1314 C CA . THR A 1 189 ? 90.947 -57.594 4.380 1.00 65.75 ? 270 THR A CA 1 ATOM 1315 C C . THR A 1 189 ? 90.133 -58.308 3.316 1.00 62.06 ? 270 THR A C 1 ATOM 1316 O O . THR A 1 189 ? 89.187 -57.757 2.758 1.00 64.77 ? 270 THR A O 1 ATOM 1317 C CB . THR A 1 189 ? 90.774 -56.073 4.208 1.00 66.30 ? 270 THR A CB 1 ATOM 1318 O OG1 . THR A 1 189 ? 91.282 -55.663 2.924 1.00 57.40 ? 270 THR A OG1 1 ATOM 1319 C CG2 . THR A 1 189 ? 91.499 -55.334 5.333 1.00 56.24 ? 270 THR A CG2 1 ATOM 1320 N N . THR A 1 190 ? 90.520 -59.544 3.040 1.00 68.81 ? 271 THR A N 1 ATOM 1321 C CA . THR A 1 190 ? 89.782 -60.388 2.117 1.00 73.91 ? 271 THR A CA 1 ATOM 1322 C C . THR A 1 190 ? 88.352 -60.590 2.583 1.00 75.68 ? 271 THR A C 1 ATOM 1323 O O . THR A 1 190 ? 88.103 -60.887 3.759 1.00 76.58 ? 271 THR A O 1 ATOM 1324 C CB . THR A 1 190 ? 90.460 -61.744 1.963 1.00 71.53 ? 271 THR A CB 1 ATOM 1325 O OG1 . THR A 1 190 ? 91.794 -61.532 1.486 1.00 82.67 ? 271 THR A OG1 1 ATOM 1326 C CG2 . THR A 1 190 ? 89.699 -62.617 0.972 1.00 63.16 ? 271 THR A CG2 1 ATOM 1327 N N . GLY A 1 191 ? 87.414 -60.405 1.658 1.00 67.56 ? 272 GLY A N 1 ATOM 1328 C CA . GLY A 1 191 ? 86.016 -60.647 1.947 1.00 58.22 ? 272 GLY A CA 1 ATOM 1329 C C . GLY A 1 191 ? 85.292 -59.453 2.526 1.00 66.85 ? 272 GLY A C 1 ATOM 1330 O O . GLY A 1 191 ? 84.071 -59.486 2.648 1.00 70.99 ? 272 GLY A O 1 ATOM 1331 N N . PHE A 1 192 ? 86.021 -58.401 2.892 1.00 60.86 ? 273 PHE A N 1 ATOM 1332 C CA . PHE A 1 192 ? 85.353 -57.213 3.432 1.00 62.02 ? 273 PHE A CA 1 ATOM 1333 C C . PHE A 1 192 ? 86.062 -55.898 3.132 1.00 54.33 ? 273 PHE A C 1 ATOM 1334 O O . PHE A 1 192 ? 87.099 -55.874 2.478 1.00 56.54 ? 273 PHE A O 1 ATOM 1335 C CB . PHE A 1 192 ? 85.073 -57.349 4.949 1.00 59.25 ? 273 PHE A CB 1 ATOM 1336 C CG . PHE A 1 192 ? 86.316 -57.381 5.811 1.00 59.45 ? 273 PHE A CG 1 ATOM 1337 C CD1 . PHE A 1 192 ? 87.100 -58.537 5.880 1.00 58.48 ? 273 PHE A CD1 1 ATOM 1338 C CD2 . PHE A 1 192 ? 86.699 -56.259 6.565 1.00 60.94 ? 273 PHE A CD2 1 ATOM 1339 C CE1 . PHE A 1 192 ? 88.254 -58.582 6.680 1.00 51.66 ? 273 PHE A CE1 1 ATOM 1340 C CE2 . PHE A 1 192 ? 87.849 -56.289 7.373 1.00 60.25 ? 273 PHE A CE2 1 ATOM 1341 C CZ . PHE A 1 192 ? 88.627 -57.455 7.432 1.00 65.15 ? 273 PHE A CZ 1 ATOM 1342 N N . ASN A 1 193 ? 85.477 -54.813 3.630 1.00 50.36 ? 274 ASN A N 1 ATOM 1343 C CA . ASN A 1 193 ? 85.960 -53.451 3.417 1.00 46.09 ? 274 ASN A CA 1 ATOM 1344 C C . ASN A 1 193 ? 86.130 -52.756 4.793 1.00 61.91 ? 274 ASN A C 1 ATOM 1345 O O . ASN A 1 193 ? 85.374 -53.038 5.732 1.00 44.72 ? 274 ASN A O 1 ATOM 1346 C CB . ASN A 1 193 ? 84.946 -52.730 2.518 1.00 51.67 ? 274 ASN A CB 1 ATOM 1347 C CG . ASN A 1 193 ? 85.094 -51.221 2.529 1.00 59.76 ? 274 ASN A CG 1 ATOM 1348 O OD1 . ASN A 1 193 ? 84.176 -50.498 2.946 1.00 59.70 ? 274 ASN A OD1 1 ATOM 1349 N ND2 . ASN A 1 193 ? 86.229 -50.733 2.040 1.00 50.13 ? 274 ASN A ND2 1 ATOM 1350 N N . PHE A 1 194 ? 87.111 -51.861 4.921 1.00 54.86 ? 275 PHE A N 1 ATOM 1351 C CA . PHE A 1 194 ? 87.518 -51.360 6.235 1.00 49.46 ? 275 PHE A CA 1 ATOM 1352 C C . PHE A 1 194 ? 87.850 -49.874 6.165 1.00 48.86 ? 275 PHE A C 1 ATOM 1353 O O . PHE A 1 194 ? 89.025 -49.468 6.255 1.00 49.63 ? 275 PHE A O 1 ATOM 1354 C CB . PHE A 1 194 ? 88.748 -52.153 6.743 1.00 47.11 ? 275 PHE A CB 1 ATOM 1355 C CG . PHE A 1 194 ? 89.048 -51.962 8.216 1.00 52.88 ? 275 PHE A CG 1 ATOM 1356 C CD1 . PHE A 1 194 ? 88.134 -52.364 9.184 1.00 57.56 ? 275 PHE A CD1 1 ATOM 1357 C CD2 . PHE A 1 194 ? 90.255 -51.412 8.634 1.00 48.38 ? 275 PHE A CD2 1 ATOM 1358 C CE1 . PHE A 1 194 ? 88.408 -52.202 10.538 1.00 51.65 ? 275 PHE A CE1 1 ATOM 1359 C CE2 . PHE A 1 194 ? 90.536 -51.248 9.991 1.00 51.65 ? 275 PHE A CE2 1 ATOM 1360 C CZ . PHE A 1 194 ? 89.607 -51.640 10.941 1.00 48.35 ? 275 PHE A CZ 1 ATOM 1361 N N . GLU A 1 195 ? 86.818 -49.058 5.993 1.00 46.69 ? 276 GLU A N 1 ATOM 1362 C CA . GLU A 1 195 ? 87.024 -47.615 5.835 1.00 48.76 ? 276 GLU A CA 1 ATOM 1363 C C . GLU A 1 195 ? 87.015 -46.805 7.146 1.00 51.02 ? 276 GLU A C 1 ATOM 1364 O O . GLU A 1 195 ? 86.341 -47.175 8.114 1.00 41.55 ? 276 GLU A O 1 ATOM 1365 C CB . GLU A 1 195 ? 85.984 -47.049 4.874 1.00 53.32 ? 276 GLU A CB 1 ATOM 1366 C CG . GLU A 1 195 ? 86.000 -47.688 3.478 1.00 65.09 ? 276 GLU A CG 1 ATOM 1367 C CD . GLU A 1 195 ? 87.231 -47.333 2.651 1.00 60.53 ? 276 GLU A CD 1 ATOM 1368 O OE1 . GLU A 1 195 ? 87.621 -46.139 2.574 1.00 68.28 ? 276 GLU A OE1 1 ATOM 1369 O OE2 . GLU A 1 195 ? 87.807 -48.262 2.058 1.00 65.50 ? 276 GLU A OE2 1 ATOM 1370 N N . PHE A 1 196 ? 87.759 -45.700 7.164 1.00 54.37 ? 277 PHE A N 1 ATOM 1371 C CA . PHE A 1 196 ? 87.694 -44.743 8.277 1.00 47.11 ? 277 PHE A CA 1 ATOM 1372 C C . PHE A 1 196 ? 87.841 -45.342 9.681 1.00 55.56 ? 277 PHE A C 1 ATOM 1373 O O . PHE A 1 196 ? 87.035 -45.044 10.587 1.00 39.65 ? 277 PHE A O 1 ATOM 1374 C CB . PHE A 1 196 ? 86.366 -43.991 8.232 1.00 48.25 ? 277 PHE A CB 1 ATOM 1375 C CG . PHE A 1 196 ? 85.914 -43.661 6.855 1.00 56.52 ? 277 PHE A CG 1 ATOM 1376 C CD1 . PHE A 1 196 ? 86.677 -42.832 6.043 1.00 65.77 ? 277 PHE A CD1 1 ATOM 1377 C CD2 . PHE A 1 196 ? 84.730 -44.171 6.370 1.00 47.94 ? 277 PHE A CD2 1 ATOM 1378 C CE1 . PHE A 1 196 ? 86.270 -42.526 4.770 1.00 58.62 ? 277 PHE A CE1 1 ATOM 1379 C CE2 . PHE A 1 196 ? 84.309 -43.866 5.108 1.00 46.05 ? 277 PHE A CE2 1 ATOM 1380 C CZ . PHE A 1 196 ? 85.086 -43.048 4.295 1.00 58.08 ? 277 PHE A CZ 1 ATOM 1381 N N . PRO A 1 197 ? 88.864 -46.182 9.883 1.00 56.03 ? 278 PRO A N 1 ATOM 1382 C CA . PRO A 1 197 ? 88.959 -46.737 11.234 1.00 50.50 ? 278 PRO A CA 1 ATOM 1383 C C . PRO A 1 197 ? 89.159 -45.628 12.259 1.00 53.26 ? 278 PRO A C 1 ATOM 1384 O O . PRO A 1 197 ? 89.980 -44.732 12.059 1.00 53.88 ? 278 PRO A O 1 ATOM 1385 C CB . PRO A 1 197 ? 90.194 -47.639 11.156 1.00 54.65 ? 278 PRO A CB 1 ATOM 1386 C CG . PRO A 1 197 ? 91.004 -47.052 10.020 1.00 52.68 ? 278 PRO A CG 1 ATOM 1387 C CD . PRO A 1 197 ? 90.001 -46.570 9.031 1.00 43.72 ? 278 PRO A CD 1 ATOM 1388 N N . THR A 1 198 ? 88.384 -45.677 13.337 1.00 50.84 ? 279 THR A N 1 ATOM 1389 C CA . THR A 1 198 ? 88.569 -44.752 14.440 1.00 39.68 ? 279 THR A CA 1 ATOM 1390 C C . THR A 1 198 ? 89.043 -45.569 15.665 1.00 49.38 ? 279 THR A C 1 ATOM 1391 O O . THR A 1 198 ? 88.528 -46.669 15.966 1.00 48.19 ? 279 THR A O 1 ATOM 1392 C CB . THR A 1 198 ? 87.285 -43.932 14.689 1.00 45.89 ? 279 THR A CB 1 ATOM 1393 O OG1 . THR A 1 198 ? 87.510 -42.936 15.708 1.00 43.07 ? 279 THR A OG1 1 ATOM 1394 C CG2 . THR A 1 198 ? 86.110 -44.868 15.057 1.00 49.24 ? 279 THR A CG2 1 ATOM 1395 N N . CYS A 1 199 ? 90.059 -45.050 16.341 1.00 35.91 ? 280 CYS A N 1 ATOM 1396 C CA . CYS A 1 199 ? 90.864 -45.892 17.227 1.00 50.80 ? 280 CYS A CA 1 ATOM 1397 C C . CYS A 1 199 ? 91.090 -45.388 18.660 1.00 48.98 ? 280 CYS A C 1 ATOM 1398 O O . CYS A 1 199 ? 90.875 -44.202 18.981 1.00 39.29 ? 280 CYS A O 1 ATOM 1399 C CB . CYS A 1 199 ? 92.232 -46.135 16.564 1.00 36.55 ? 280 CYS A CB 1 ATOM 1400 S SG . CYS A 1 199 ? 92.125 -46.829 14.890 1.00 65.30 ? 280 CYS A SG 1 ATOM 1401 N N . TYR A 1 200 ? 91.548 -46.307 19.509 1.00 43.67 ? 281 TYR A N 1 ATOM 1402 C CA . TYR A 1 200 ? 92.047 -45.958 20.852 1.00 44.44 ? 281 TYR A CA 1 ATOM 1403 C C . TYR A 1 200 ? 93.120 -46.938 21.303 1.00 41.06 ? 281 TYR A C 1 ATOM 1404 O O . TYR A 1 200 ? 93.155 -48.087 20.852 1.00 49.00 ? 281 TYR A O 1 ATOM 1405 C CB . TYR A 1 200 ? 90.920 -45.932 21.885 1.00 39.28 ? 281 TYR A CB 1 ATOM 1406 C CG . TYR A 1 200 ? 90.221 -47.264 22.097 1.00 49.51 ? 281 TYR A CG 1 ATOM 1407 C CD1 . TYR A 1 200 ? 89.341 -47.769 21.144 1.00 51.48 ? 281 TYR A CD1 1 ATOM 1408 C CD2 . TYR A 1 200 ? 90.420 -48.004 23.268 1.00 47.15 ? 281 TYR A CD2 1 ATOM 1409 C CE1 . TYR A 1 200 ? 88.685 -48.976 21.345 1.00 50.76 ? 281 TYR A CE1 1 ATOM 1410 C CE2 . TYR A 1 200 ? 89.759 -49.215 23.480 1.00 48.95 ? 281 TYR A CE2 1 ATOM 1411 C CZ . TYR A 1 200 ? 88.890 -49.690 22.507 1.00 57.87 ? 281 TYR A CZ 1 ATOM 1412 O OH . TYR A 1 200 ? 88.226 -50.875 22.682 1.00 52.95 ? 281 TYR A OH 1 ATOM 1413 N N . TYR A 1 201 ? 93.993 -46.487 22.194 1.00 51.04 ? 282 TYR A N 1 ATOM 1414 C CA . TYR A 1 201 ? 95.015 -47.358 22.761 1.00 52.00 ? 282 TYR A CA 1 ATOM 1415 C C . TYR A 1 201 ? 94.644 -47.896 24.153 1.00 48.49 ? 282 TYR A C 1 ATOM 1416 O O . TYR A 1 201 ? 94.148 -47.141 24.977 1.00 46.54 ? 282 TYR A O 1 ATOM 1417 C CB . TYR A 1 201 ? 96.319 -46.588 22.868 1.00 52.88 ? 282 TYR A CB 1 ATOM 1418 C CG . TYR A 1 201 ? 97.408 -47.430 23.459 1.00 57.04 ? 282 TYR A CG 1 ATOM 1419 C CD1 . TYR A 1 201 ? 98.007 -48.436 22.710 1.00 55.34 ? 282 TYR A CD1 1 ATOM 1420 C CD2 . TYR A 1 201 ? 97.821 -47.244 24.775 1.00 49.47 ? 282 TYR A CD2 1 ATOM 1421 C CE1 . TYR A 1 201 ? 99.003 -49.214 23.248 1.00 65.63 ? 282 TYR A CE1 1 ATOM 1422 C CE2 . TYR A 1 201 ? 98.803 -48.020 25.320 1.00 49.50 ? 282 TYR A CE2 1 ATOM 1423 C CZ . TYR A 1 201 ? 99.393 -49.000 24.557 1.00 62.15 ? 282 TYR A CZ 1 ATOM 1424 O OH . TYR A 1 201 ? 100.377 -49.763 25.107 1.00 60.66 ? 282 TYR A OH 1 ATOM 1425 N N . THR A 1 202 ? 94.893 -49.183 24.407 1.00 51.83 ? 283 THR A N 1 ATOM 1426 C CA . THR A 1 202 ? 94.838 -49.737 25.773 1.00 63.44 ? 283 THR A CA 1 ATOM 1427 C C . THR A 1 202 ? 95.475 -51.141 25.907 1.00 71.35 ? 283 THR A C 1 ATOM 1428 O O . THR A 1 202 ? 95.446 -51.930 24.954 1.00 69.19 ? 283 THR A O 1 ATOM 1429 C CB . THR A 1 202 ? 93.396 -49.740 26.343 1.00 69.50 ? 283 THR A CB 1 ATOM 1430 O OG1 . THR A 1 202 ? 93.440 -49.685 27.776 1.00 88.64 ? 283 THR A OG1 1 ATOM 1431 C CG2 . THR A 1 202 ? 92.626 -50.969 25.880 1.00 61.48 ? 283 THR A CG2 1 ATOM 1432 N N . SER A 1 203 ? 96.051 -51.435 27.081 1.00 65.56 ? 284 SER A N 1 ATOM 1433 C CA . SER A 1 203 ? 96.716 -52.726 27.344 1.00 59.40 ? 284 SER A CA 1 ATOM 1434 C C . SER A 1 203 ? 97.647 -53.170 26.210 1.00 60.27 ? 284 SER A C 1 ATOM 1435 O O . SER A 1 203 ? 97.530 -54.293 25.705 1.00 54.95 ? 284 SER A O 1 ATOM 1436 C CB . SER A 1 203 ? 95.692 -53.836 27.570 1.00 56.67 ? 284 SER A CB 1 ATOM 1437 O OG . SER A 1 203 ? 94.730 -53.459 28.524 1.00 75.67 ? 284 SER A OG 1 ATOM 1438 N N . GLY A 1 204 ? 98.548 -52.288 25.790 1.00 48.29 ? 285 GLY A N 1 ATOM 1439 C CA . GLY A 1 204 ? 99.474 -52.634 24.739 1.00 49.35 ? 285 GLY A CA 1 ATOM 1440 C C . GLY A 1 204 ? 98.883 -52.806 23.339 1.00 63.41 ? 285 GLY A C 1 ATOM 1441 O O . GLY A 1 204 ? 99.578 -53.281 22.427 1.00 60.23 ? 285 GLY A O 1 ATOM 1442 N N . LYS A 1 205 ? 97.620 -52.433 23.141 1.00 57.90 ? 286 LYS A N 1 ATOM 1443 C CA . LYS A 1 205 ? 97.037 -52.554 21.806 1.00 46.09 ? 286 LYS A CA 1 ATOM 1444 C C . LYS A 1 205 ? 96.326 -51.288 21.318 1.00 53.01 ? 286 LYS A C 1 ATOM 1445 O O . LYS A 1 205 ? 95.698 -50.564 22.103 1.00 48.10 ? 286 LYS A O 1 ATOM 1446 C CB . LYS A 1 205 ? 96.078 -53.754 21.749 1.00 50.12 ? 286 LYS A CB 1 ATOM 1447 C CG . LYS A 1 205 ? 96.759 -55.114 21.911 1.00 46.19 ? 286 LYS A CG 1 ATOM 1448 C CD . LYS A 1 205 ? 95.789 -56.266 21.606 1.00 59.11 ? 286 LYS A CD 1 ATOM 1449 C CE . LYS A 1 205 ? 96.169 -57.557 22.312 1.00 60.25 ? 286 LYS A CE 1 ATOM 1450 N NZ . LYS A 1 205 ? 97.651 -57.718 22.414 1.00 74.50 ? 286 LYS A NZ 1 ATOM 1451 N N . VAL A 1 206 ? 96.451 -51.017 20.020 1.00 63.50 ? 287 VAL A N 1 ATOM 1452 C CA . VAL A 1 206 ? 95.562 -50.067 19.350 1.00 56.18 ? 287 VAL A CA 1 ATOM 1453 C C . VAL A 1 206 ? 94.347 -50.845 18.851 1.00 52.64 ? 287 VAL A C 1 ATOM 1454 O O . VAL A 1 206 ? 94.476 -51.914 18.240 1.00 50.04 ? 287 VAL A O 1 ATOM 1455 C CB . VAL A 1 206 ? 96.241 -49.357 18.180 1.00 54.23 ? 287 VAL A CB 1 ATOM 1456 C CG1 . VAL A 1 206 ? 95.260 -48.432 17.490 1.00 43.69 ? 287 VAL A CG1 1 ATOM 1457 C CG2 . VAL A 1 206 ? 97.441 -48.568 18.668 1.00 54.81 ? 287 VAL A CG2 1 ATOM 1458 N N . LYS A 1 207 ? 93.163 -50.342 19.171 1.00 55.17 ? 288 LYS A N 1 ATOM 1459 C CA . LYS A 1 207 ? 91.927 -51.011 18.784 1.00 47.44 ? 288 LYS A CA 1 ATOM 1460 C C . LYS A 1 207 ? 91.082 -50.066 17.931 1.00 48.52 ? 288 LYS A C 1 ATOM 1461 O O . LYS A 1 207 ? 90.952 -48.860 18.214 1.00 51.42 ? 288 LYS A O 1 ATOM 1462 C CB . LYS A 1 207 ? 91.169 -51.498 20.019 1.00 53.63 ? 288 LYS A CB 1 ATOM 1463 C CG . LYS A 1 207 ? 92.048 -52.221 21.028 1.00 58.80 ? 288 LYS A CG 1 ATOM 1464 C CD . LYS A 1 207 ? 91.203 -52.933 22.079 1.00 58.78 ? 288 LYS A CD 1 ATOM 1465 C CE . LYS A 1 207 ? 92.059 -53.601 23.148 1.00 58.69 ? 288 LYS A CE 1 ATOM 1466 N NZ . LYS A 1 207 ? 91.277 -54.606 23.936 1.00 61.80 ? 288 LYS A NZ 1 ATOM 1467 N N . CYS A 1 208 ? 90.522 -50.611 16.863 1.00 54.03 ? 289 CYS A N 1 ATOM 1468 C CA . CYS A 1 208 ? 89.959 -49.767 15.814 1.00 47.02 ? 289 CYS A CA 1 ATOM 1469 C C . CYS A 1 208 ? 88.637 -50.301 15.314 1.00 46.32 ? 289 CYS A C 1 ATOM 1470 O O . CYS A 1 208 ? 88.476 -51.517 15.081 1.00 45.69 ? 289 CYS A O 1 ATOM 1471 C CB . CYS A 1 208 ? 90.944 -49.688 14.638 1.00 41.47 ? 289 CYS A CB 1 ATOM 1472 S SG . CYS A 1 208 ? 92.502 -48.861 15.022 1.00 66.00 ? 289 CYS A SG 1 ATOM 1473 N N . THR A 1 209 ? 87.692 -49.381 15.161 1.00 40.54 ? 290 THR A N 1 ATOM 1474 C CA . THR A 1 209 ? 86.417 -49.696 14.537 1.00 48.47 ? 290 THR A CA 1 ATOM 1475 C C . THR A 1 209 ? 86.360 -49.016 13.184 1.00 48.24 ? 290 THR A C 1 ATOM 1476 O O . THR A 1 209 ? 86.625 -47.817 13.070 1.00 42.02 ? 290 THR A O 1 ATOM 1477 C CB . THR A 1 209 ? 85.260 -49.192 15.356 1.00 53.36 ? 290 THR A CB 1 ATOM 1478 O OG1 . THR A 1 209 ? 85.278 -49.853 16.621 1.00 52.62 ? 290 THR A OG1 1 ATOM 1479 C CG2 . THR A 1 209 ? 83.951 -49.487 14.633 1.00 63.14 ? 290 THR A CG2 1 ATOM 1480 N N . GLY A 1 210 ? 86.038 -49.793 12.158 1.00 46.85 ? 291 GLY A N 1 ATOM 1481 C CA . GLY A 1 210 ? 85.998 -49.260 10.820 1.00 47.66 ? 291 GLY A CA 1 ATOM 1482 C C . GLY A 1 210 ? 84.607 -49.347 10.237 1.00 53.17 ? 291 GLY A C 1 ATOM 1483 O O . GLY A 1 210 ? 83.671 -49.851 10.892 1.00 51.87 ? 291 GLY A O 1 ATOM 1484 N N . THR A 1 211 ? 84.464 -48.857 9.002 1.00 57.77 ? 292 THR A N 1 ATOM 1485 C CA . THR A 1 211 ? 83.178 -48.907 8.321 1.00 35.34 ? 292 THR A CA 1 ATOM 1486 C C . THR A 1 211 ? 83.276 -49.761 7.073 1.00 51.31 ? 292 THR A C 1 ATOM 1487 O O . THR A 1 211 ? 84.120 -49.512 6.203 1.00 52.36 ? 292 THR A O 1 ATOM 1488 C CB . THR A 1 211 ? 82.674 -47.518 7.960 1.00 42.41 ? 292 THR A CB 1 ATOM 1489 O OG1 . THR A 1 211 ? 82.892 -46.626 9.059 1.00 63.46 ? 292 THR A OG1 1 ATOM 1490 C CG2 . THR A 1 211 ? 81.196 -47.570 7.642 1.00 46.11 ? 292 THR A CG2 1 ATOM 1491 N N . ASN A 1 212 ? 82.422 -50.781 7.006 1.00 50.43 ? 293 ASN A N 1 ATOM 1492 C CA . ASN A 1 212 ? 82.301 -51.620 5.817 1.00 51.07 ? 293 ASN A CA 1 ATOM 1493 C C . ASN A 1 212 ? 81.214 -51.071 4.906 1.00 59.29 ? 293 ASN A C 1 ATOM 1494 O O . ASN A 1 212 ? 80.018 -51.163 5.247 1.00 61.01 ? 293 ASN A O 1 ATOM 1495 C CB . ASN A 1 212 ? 81.920 -53.043 6.203 1.00 56.07 ? 293 ASN A CB 1 ATOM 1496 C CG . ASN A 1 212 ? 82.179 -54.030 5.084 1.00 69.81 ? 293 ASN A CG 1 ATOM 1497 O OD1 . ASN A 1 212 ? 82.241 -53.656 3.909 1.00 62.53 ? 293 ASN A OD1 1 ATOM 1498 N ND2 . ASN A 1 212 ? 82.352 -55.297 5.444 1.00 74.74 ? 293 ASN A ND2 1 ATOM 1499 N N . LEU A 1 213 ? 81.625 -50.511 3.761 1.00 51.19 ? 294 LEU A N 1 ATOM 1500 C CA . LEU A 1 213 ? 80.691 -49.920 2.788 1.00 50.03 ? 294 LEU A CA 1 ATOM 1501 C C . LEU A 1 213 ? 80.172 -50.931 1.782 1.00 52.89 ? 294 LEU A C 1 ATOM 1502 O O . LEU A 1 213 ? 79.338 -50.622 0.934 1.00 57.03 ? 294 LEU A O 1 ATOM 1503 C CB . LEU A 1 213 ? 81.330 -48.757 2.043 1.00 40.22 ? 294 LEU A CB 1 ATOM 1504 C CG . LEU A 1 213 ? 81.849 -47.668 2.968 1.00 49.72 ? 294 LEU A CG 1 ATOM 1505 C CD1 . LEU A 1 213 ? 82.859 -46.830 2.251 1.00 50.16 ? 294 LEU A CD1 1 ATOM 1506 C CD2 . LEU A 1 213 ? 80.708 -46.800 3.441 1.00 46.29 ? 294 LEU A CD2 1 ATOM 1507 N N . TRP A 1 214 ? 80.666 -52.152 1.910 1.00 65.52 ? 295 TRP A N 1 ATOM 1508 C CA . TRP A 1 214 ? 80.438 -53.189 0.927 1.00 59.12 ? 295 TRP A CA 1 ATOM 1509 C C . TRP A 1 214 ? 79.351 -54.154 1.384 1.00 60.79 ? 295 TRP A C 1 ATOM 1510 O O . TRP A 1 214 ? 78.260 -54.194 0.807 1.00 61.28 ? 295 TRP A O 1 ATOM 1511 C CB . TRP A 1 214 ? 81.759 -53.936 0.683 1.00 56.42 ? 295 TRP A CB 1 ATOM 1512 C CG . TRP A 1 214 ? 81.671 -55.133 -0.232 1.00 63.89 ? 295 TRP A CG 1 ATOM 1513 C CD1 . TRP A 1 214 ? 80.626 -55.483 -1.040 1.00 68.65 ? 295 TRP A CD1 1 ATOM 1514 C CD2 . TRP A 1 214 ? 82.679 -56.129 -0.434 1.00 71.55 ? 295 TRP A CD2 1 ATOM 1515 N NE1 . TRP A 1 214 ? 80.922 -56.630 -1.728 1.00 74.49 ? 295 TRP A NE1 1 ATOM 1516 C CE2 . TRP A 1 214 ? 82.175 -57.049 -1.371 1.00 74.30 ? 295 TRP A CE2 1 ATOM 1517 C CE3 . TRP A 1 214 ? 83.958 -56.333 0.091 1.00 70.17 ? 295 TRP A CE3 1 ATOM 1518 C CZ2 . TRP A 1 214 ? 82.903 -58.153 -1.793 1.00 68.81 ? 295 TRP A CZ2 1 ATOM 1519 C CZ3 . TRP A 1 214 ? 84.680 -57.432 -0.328 1.00 66.36 ? 295 TRP A CZ3 1 ATOM 1520 C CH2 . TRP A 1 214 ? 84.152 -58.327 -1.261 1.00 70.04 ? 295 TRP A CH2 1 ATOM 1521 N N . ASN A 1 215 ? 79.644 -54.925 2.427 1.00 59.23 ? 296 ASN A N 1 ATOM 1522 C CA . ASN A 1 215 ? 78.820 -56.088 2.744 1.00 59.92 ? 296 ASN A CA 1 ATOM 1523 C C . ASN A 1 215 ? 78.544 -56.338 4.224 1.00 56.54 ? 296 ASN A C 1 ATOM 1524 O O . ASN A 1 215 ? 78.311 -57.480 4.627 1.00 79.26 ? 296 ASN A O 1 ATOM 1525 C CB . ASN A 1 215 ? 79.468 -57.342 2.136 1.00 64.81 ? 296 ASN A CB 1 ATOM 1526 C CG . ASN A 1 215 ? 80.909 -57.531 2.586 1.00 72.89 ? 296 ASN A CG 1 ATOM 1527 O OD1 . ASN A 1 215 ? 81.353 -56.928 3.568 1.00 87.38 ? 296 ASN A OD1 1 ATOM 1528 N ND2 . ASN A 1 215 ? 81.650 -58.360 1.862 1.00 68.29 ? 296 ASN A ND2 1 ATOM 1529 N N . ASP A 1 216 ? 78.561 -55.301 5.047 1.00 49.41 ? 297 ASP A N 1 ATOM 1530 C CA . ASP A 1 216 ? 78.271 -55.551 6.455 1.00 61.20 ? 297 ASP A CA 1 ATOM 1531 C C . ASP A 1 216 ? 77.631 -54.386 7.185 1.00 60.18 ? 297 ASP A C 1 ATOM 1532 O O . ASP A 1 216 ? 78.201 -53.307 7.219 1.00 71.68 ? 297 ASP A O 1 ATOM 1533 C CB . ASP A 1 216 ? 79.542 -55.980 7.192 1.00 68.89 ? 297 ASP A CB 1 ATOM 1534 C CG . ASP A 1 216 ? 79.267 -56.402 8.630 1.00 74.67 ? 297 ASP A CG 1 ATOM 1535 O OD1 . ASP A 1 216 ? 78.116 -56.796 8.958 1.00 68.33 ? 297 ASP A OD1 1 ATOM 1536 O OD2 . ASP A 1 216 ? 80.208 -56.355 9.449 1.00 87.20 ? 297 ASP A OD2 1 ATOM 1537 N N . ALA A 1 217 ? 76.468 -54.649 7.789 1.00 65.29 ? 298 ALA A N 1 ATOM 1538 C CA . ALA A 1 217 ? 75.725 -53.695 8.621 1.00 65.86 ? 298 ALA A CA 1 ATOM 1539 C C . ALA A 1 217 ? 76.244 -53.588 10.073 1.00 70.78 ? 298 ALA A C 1 ATOM 1540 O O . ALA A 1 217 ? 75.910 -52.635 10.805 1.00 65.18 ? 298 ALA A O 1 ATOM 1541 C CB . ALA A 1 217 ? 74.256 -54.045 8.626 1.00 59.58 ? 298 ALA A CB 1 ATOM 1542 N N . LYS A 1 218 ? 77.029 -54.581 10.495 1.00 61.69 ? 299 LYS A N 1 ATOM 1543 C CA . LYS A 1 218 ? 77.872 -54.439 11.681 1.00 53.87 ? 299 LYS A CA 1 ATOM 1544 C C . LYS A 1 218 ? 79.202 -53.750 11.307 1.00 65.92 ? 299 LYS A C 1 ATOM 1545 O O . LYS A 1 218 ? 79.537 -53.608 10.120 1.00 54.69 ? 299 LYS A O 1 ATOM 1546 C CB . LYS A 1 218 ? 78.178 -55.806 12.278 1.00 51.09 ? 299 LYS A CB 1 ATOM 1547 C CG . LYS A 1 218 ? 76.999 -56.587 12.895 1.00 49.53 ? 299 LYS A CG 1 ATOM 1548 C CD . LYS A 1 218 ? 77.521 -58.004 13.145 1.00 50.68 ? 299 LYS A CD 1 ATOM 1549 C CE . LYS A 1 218 ? 76.542 -58.954 13.776 1.00 65.06 ? 299 LYS A CE 1 ATOM 1550 N NZ . LYS A 1 218 ? 77.228 -60.281 13.861 1.00 66.68 ? 299 LYS A NZ 1 ATOM 1551 N N . ARG A 1 219 ? 79.968 -53.321 12.307 1.00 67.40 ? 300 ARG A N 1 ATOM 1552 C CA . ARG A 1 219 ? 81.280 -52.739 12.018 1.00 54.33 ? 300 ARG A CA 1 ATOM 1553 C C . ARG A 1 219 ? 82.429 -53.721 12.250 1.00 54.35 ? 300 ARG A C 1 ATOM 1554 O O . ARG A 1 219 ? 82.460 -54.412 13.265 1.00 65.03 ? 300 ARG A O 1 ATOM 1555 C CB . ARG A 1 219 ? 81.502 -51.477 12.833 1.00 46.09 ? 300 ARG A CB 1 ATOM 1556 C CG . ARG A 1 219 ? 80.377 -50.473 12.691 1.00 45.97 ? 300 ARG A CG 1 ATOM 1557 C CD . ARG A 1 219 ? 80.674 -49.220 13.507 1.00 53.29 ? 300 ARG A CD 1 ATOM 1558 N NE . ARG A 1 219 ? 79.768 -48.123 13.173 1.00 61.66 ? 300 ARG A NE 1 ATOM 1559 C CZ . ARG A 1 219 ? 79.826 -47.431 12.040 1.00 55.11 ? 300 ARG A CZ 1 ATOM 1560 N NH1 . ARG A 1 219 ? 80.755 -47.710 11.124 1.00 53.93 ? 300 ARG A NH1 1 ATOM 1561 N NH2 . ARG A 1 219 ? 78.957 -46.459 11.824 1.00 48.72 ? 300 ARG A NH2 1 ATOM 1562 N N . PRO A 1 220 ? 83.375 -53.796 11.294 1.00 53.37 ? 301 PRO A N 1 ATOM 1563 C CA . PRO A 1 220 ? 84.590 -54.603 11.484 1.00 46.31 ? 301 PRO A CA 1 ATOM 1564 C C . PRO A 1 220 ? 85.474 -54.031 12.591 1.00 56.56 ? 301 PRO A C 1 ATOM 1565 O O . PRO A 1 220 ? 85.565 -52.796 12.773 1.00 52.26 ? 301 PRO A O 1 ATOM 1566 C CB . PRO A 1 220 ? 85.310 -54.483 10.137 1.00 47.68 ? 301 PRO A CB 1 ATOM 1567 C CG . PRO A 1 220 ? 84.786 -53.194 9.539 1.00 55.22 ? 301 PRO A CG 1 ATOM 1568 C CD . PRO A 1 220 ? 83.338 -53.154 9.965 1.00 52.14 ? 301 PRO A CD 1 ATOM 1569 N N . PHE A 1 221 ? 86.122 -54.928 13.328 1.00 50.31 ? 302 PHE A N 1 ATOM 1570 C CA . PHE A 1 221 ? 86.984 -54.507 14.403 1.00 48.41 ? 302 PHE A CA 1 ATOM 1571 C C . PHE A 1 221 ? 88.420 -54.967 14.169 1.00 55.58 ? 302 PHE A C 1 ATOM 1572 O O . PHE A 1 221 ? 88.667 -56.018 13.567 1.00 59.53 ? 302 PHE A O 1 ATOM 1573 C CB . PHE A 1 221 ? 86.450 -55.019 15.733 1.00 56.67 ? 302 PHE A CB 1 ATOM 1574 C CG . PHE A 1 221 ? 87.032 -54.316 16.927 1.00 47.56 ? 302 PHE A CG 1 ATOM 1575 C CD1 . PHE A 1 221 ? 86.596 -53.043 17.280 1.00 62.81 ? 302 PHE A CD1 1 ATOM 1576 C CD2 . PHE A 1 221 ? 88.018 -54.924 17.698 1.00 55.59 ? 302 PHE A CD2 1 ATOM 1577 C CE1 . PHE A 1 221 ? 87.134 -52.372 18.399 1.00 58.70 ? 302 PHE A CE1 1 ATOM 1578 C CE2 . PHE A 1 221 ? 88.563 -54.268 18.814 1.00 60.77 ? 302 PHE A CE2 1 ATOM 1579 C CZ . PHE A 1 221 ? 88.119 -52.989 19.160 1.00 53.51 ? 302 PHE A CZ 1 ATOM 1580 N N . LEU A 1 222 ? 89.365 -54.169 14.653 1.00 43.87 ? 303 LEU A N 1 ATOM 1581 C CA . LEU A 1 222 ? 90.776 -54.453 14.452 1.00 51.84 ? 303 LEU A CA 1 ATOM 1582 C C . LEU A 1 222 ? 91.533 -54.149 15.731 1.00 52.30 ? 303 LEU A C 1 ATOM 1583 O O . LEU A 1 222 ? 91.311 -53.106 16.358 1.00 51.53 ? 303 LEU A O 1 ATOM 1584 C CB . LEU A 1 222 ? 91.333 -53.571 13.322 1.00 47.45 ? 303 LEU A CB 1 ATOM 1585 C CG . LEU A 1 222 ? 92.633 -53.937 12.592 1.00 52.42 ? 303 LEU A CG 1 ATOM 1586 C CD1 . LEU A 1 222 ? 93.676 -52.879 12.809 1.00 56.64 ? 303 LEU A CD1 1 ATOM 1587 C CD2 . LEU A 1 222 ? 93.181 -55.338 12.931 1.00 42.95 ? 303 LEU A CD2 1 ATOM 1588 N N . GLU A 1 223 ? 92.409 -55.062 16.132 1.00 46.70 ? 304 GLU A N 1 ATOM 1589 C CA . GLU A 1 223 ? 93.391 -54.725 17.147 1.00 59.47 ? 304 GLU A CA 1 ATOM 1590 C C . GLU A 1 223 ? 94.782 -55.124 16.684 1.00 63.39 ? 304 GLU A C 1 ATOM 1591 O O . GLU A 1 223 ? 94.964 -56.104 15.947 1.00 57.49 ? 304 GLU A O 1 ATOM 1592 C CB . GLU A 1 223 ? 93.057 -55.349 18.504 1.00 68.01 ? 304 GLU A CB 1 ATOM 1593 C CG . GLU A 1 223 ? 93.169 -56.869 18.557 1.00 86.79 ? 304 GLU A CG 1 ATOM 1594 C CD . GLU A 1 223 ? 92.862 -57.440 19.943 1.00 97.62 ? 304 GLU A CD 1 ATOM 1595 O OE1 . GLU A 1 223 ? 92.004 -56.847 20.648 1.00 96.83 ? 304 GLU A OE1 1 ATOM 1596 O OE2 . GLU A 1 223 ? 93.486 -58.467 20.326 1.00 86.27 ? 304 GLU A OE2 1 ATOM 1597 N N . PHE A 1 224 ? 95.759 -54.337 17.112 1.00 58.20 ? 305 PHE A N 1 ATOM 1598 C CA . PHE A 1 224 ? 97.153 -54.645 16.846 1.00 54.96 ? 305 PHE A CA 1 ATOM 1599 C C . PHE A 1 224 ? 98.065 -54.086 17.933 1.00 51.01 ? 305 PHE A C 1 ATOM 1600 O O . PHE A 1 224 ? 97.688 -53.171 18.682 1.00 53.53 ? 305 PHE A O 1 ATOM 1601 C CB . PHE A 1 224 ? 97.584 -54.134 15.466 1.00 42.50 ? 305 PHE A CB 1 ATOM 1602 C CG . PHE A 1 224 ? 97.485 -52.636 15.303 1.00 49.90 ? 305 PHE A CG 1 ATOM 1603 C CD1 . PHE A 1 224 ? 98.559 -51.805 15.627 1.00 57.90 ? 305 PHE A CD1 1 ATOM 1604 C CD2 . PHE A 1 224 ? 96.325 -52.055 14.802 1.00 48.19 ? 305 PHE A CD2 1 ATOM 1605 C CE1 . PHE A 1 224 ? 98.469 -50.414 15.467 1.00 55.09 ? 305 PHE A CE1 1 ATOM 1606 C CE2 . PHE A 1 224 ? 96.228 -50.674 14.626 1.00 43.61 ? 305 PHE A CE2 1 ATOM 1607 C CZ . PHE A 1 224 ? 97.301 -49.850 14.959 1.00 44.33 ? 305 PHE A CZ 1 ATOM 1608 N N . ASP A 1 225 ? 99.265 -54.651 18.001 1.00 50.39 ? 306 ASP A N 1 ATOM 1609 C CA . ASP A 1 225 ? 100.288 -54.218 18.943 1.00 52.02 ? 306 ASP A CA 1 ATOM 1610 C C . ASP A 1 225 ? 101.389 -53.546 18.133 1.00 57.69 ? 306 ASP A C 1 ATOM 1611 O O . ASP A 1 225 ? 101.233 -53.344 16.928 1.00 59.50 ? 306 ASP A O 1 ATOM 1612 C CB . ASP A 1 225 ? 100.836 -55.415 19.735 1.00 53.64 ? 306 ASP A CB 1 ATOM 1613 C CG . ASP A 1 225 ? 101.541 -56.452 18.843 1.00 73.50 ? 306 ASP A CG 1 ATOM 1614 O OD1 . ASP A 1 225 ? 101.602 -56.282 17.600 1.00 72.57 ? 306 ASP A OD1 1 ATOM 1615 O OD2 . ASP A 1 225 ? 102.024 -57.461 19.395 1.00 69.12 ? 306 ASP A OD2 1 ATOM 1616 N N . GLN A 1 226 ? 102.509 -53.235 18.772 1.00 62.35 ? 307 GLN A N 1 ATOM 1617 C CA . GLN A 1 226 ? 103.542 -52.450 18.117 1.00 58.88 ? 307 GLN A CA 1 ATOM 1618 C C . GLN A 1 226 ? 104.432 -53.287 17.200 1.00 64.26 ? 307 GLN A C 1 ATOM 1619 O O . GLN A 1 226 ? 105.217 -52.739 16.422 1.00 56.87 ? 307 GLN A O 1 ATOM 1620 C CB . GLN A 1 226 ? 104.376 -51.734 19.160 1.00 69.03 ? 307 GLN A CB 1 ATOM 1621 C CG . GLN A 1 226 ? 104.740 -52.607 20.330 1.00 85.93 ? 307 GLN A CG 1 ATOM 1622 C CD . GLN A 1 226 ? 105.994 -52.132 21.011 1.00 102.21 ? 307 GLN A CD 1 ATOM 1623 O OE1 . GLN A 1 226 ? 106.645 -51.186 20.555 1.00 102.76 ? 307 GLN A OE1 1 ATOM 1624 N NE2 . GLN A 1 226 ? 106.352 -52.788 22.108 1.00 106.43 ? 307 GLN A NE2 1 ATOM 1625 N N . SER A 1 227 ? 104.305 -54.610 17.296 1.00 67.74 ? 309 SER A N 1 ATOM 1626 C CA . SER A 1 227 ? 105.017 -55.520 16.404 1.00 66.66 ? 309 SER A CA 1 ATOM 1627 C C . SER A 1 227 ? 104.178 -55.761 15.152 1.00 69.37 ? 309 SER A C 1 ATOM 1628 O O . SER A 1 227 ? 104.482 -56.633 14.327 1.00 83.42 ? 309 SER A O 1 ATOM 1629 C CB . SER A 1 227 ? 105.285 -56.843 17.115 1.00 80.08 ? 309 SER A CB 1 ATOM 1630 O OG . SER A 1 227 ? 106.100 -56.638 18.253 1.00 90.05 ? 309 SER A OG 1 ATOM 1631 N N . PHE A 1 228 ? 103.114 -54.975 15.036 1.00 57.54 ? 310 PHE A N 1 ATOM 1632 C CA . PHE A 1 228 ? 102.116 -55.115 13.990 1.00 54.43 ? 310 PHE A CA 1 ATOM 1633 C C . PHE A 1 228 ? 101.548 -56.518 13.889 1.00 56.94 ? 310 PHE A C 1 ATOM 1634 O O . PHE A 1 228 ? 101.142 -56.949 12.804 1.00 54.90 ? 310 PHE A O 1 ATOM 1635 C CB . PHE A 1 228 ? 102.650 -54.670 12.637 1.00 59.88 ? 310 PHE A CB 1 ATOM 1636 C CG . PHE A 1 228 ? 102.714 -53.191 12.474 1.00 58.42 ? 310 PHE A CG 1 ATOM 1637 C CD1 . PHE A 1 228 ? 102.362 -52.353 13.518 1.00 58.24 ? 310 PHE A CD1 1 ATOM 1638 C CD2 . PHE A 1 228 ? 103.110 -52.630 11.269 1.00 62.09 ? 310 PHE A CD2 1 ATOM 1639 C CE1 . PHE A 1 228 ? 102.403 -50.976 13.365 1.00 63.03 ? 310 PHE A CE1 1 ATOM 1640 C CE2 . PHE A 1 228 ? 103.159 -51.251 11.117 1.00 61.65 ? 310 PHE A CE2 1 ATOM 1641 C CZ . PHE A 1 228 ? 102.799 -50.425 12.162 1.00 53.91 ? 310 PHE A CZ 1 ATOM 1642 N N . THR A 1 229 ? 101.528 -57.228 15.013 1.00 57.74 ? 311 THR A N 1 ATOM 1643 C CA . THR A 1 229 ? 100.761 -58.453 15.099 1.00 50.49 ? 311 THR A CA 1 ATOM 1644 C C . THR A 1 229 ? 99.302 -58.048 15.250 1.00 63.34 ? 311 THR A C 1 ATOM 1645 O O . THR A 1 229 ? 98.954 -57.270 16.163 1.00 63.25 ? 311 THR A O 1 ATOM 1646 C CB . THR A 1 229 ? 101.207 -59.303 16.282 1.00 62.37 ? 311 THR A CB 1 ATOM 1647 O OG1 . THR A 1 229 ? 102.388 -60.030 15.913 1.00 74.74 ? 311 THR A OG1 1 ATOM 1648 C CG2 . THR A 1 229 ? 100.106 -60.281 16.659 1.00 42.63 ? 311 THR A CG2 1 ATOM 1649 N N . TYR A 1 230 ? 98.445 -58.551 14.361 1.00 58.49 ? 312 TYR A N 1 ATOM 1650 C CA . TYR A 1 230 ? 97.070 -58.039 14.313 1.00 56.23 ? 312 TYR A CA 1 ATOM 1651 C C . TYR A 1 230 ? 95.972 -59.094 14.211 1.00 50.35 ? 312 TYR A C 1 ATOM 1652 O O . TYR A 1 230 ? 96.200 -60.226 13.795 1.00 50.02 ? 312 TYR A O 1 ATOM 1653 C CB . TYR A 1 230 ? 96.908 -57.007 13.185 1.00 53.01 ? 312 TYR A CB 1 ATOM 1654 C CG . TYR A 1 230 ? 96.836 -57.605 11.787 1.00 64.28 ? 312 TYR A CG 1 ATOM 1655 C CD1 . TYR A 1 230 ? 95.622 -58.051 11.257 1.00 55.02 ? 312 TYR A CD1 1 ATOM 1656 C CD2 . TYR A 1 230 ? 97.975 -57.715 10.996 1.00 40.30 ? 312 TYR A CD2 1 ATOM 1657 C CE1 . TYR A 1 230 ? 95.549 -58.603 9.990 1.00 44.24 ? 312 TYR A CE1 1 ATOM 1658 C CE2 . TYR A 1 230 ? 97.908 -58.258 9.716 1.00 66.98 ? 312 TYR A CE2 1 ATOM 1659 C CZ . TYR A 1 230 ? 96.688 -58.704 9.220 1.00 60.94 ? 312 TYR A CZ 1 ATOM 1660 O OH . TYR A 1 230 ? 96.604 -59.243 7.951 1.00 65.38 ? 312 TYR A OH 1 ATOM 1661 N N . THR A 1 231 ? 94.769 -58.685 14.582 1.00 56.54 ? 313 THR A N 1 ATOM 1662 C CA . THR A 1 231 ? 93.604 -59.548 14.503 1.00 58.05 ? 313 THR A CA 1 ATOM 1663 C C . THR A 1 231 ? 92.364 -58.736 14.140 1.00 68.72 ? 313 THR A C 1 ATOM 1664 O O . THR A 1 231 ? 92.046 -57.720 14.778 1.00 57.31 ? 313 THR A O 1 ATOM 1665 C CB . THR A 1 231 ? 93.346 -60.302 15.835 1.00 57.07 ? 313 THR A CB 1 ATOM 1666 O OG1 . THR A 1 231 ? 94.516 -61.045 16.207 1.00 66.24 ? 313 THR A OG1 1 ATOM 1667 C CG2 . THR A 1 231 ? 92.175 -61.259 15.680 1.00 46.66 ? 313 THR A CG2 1 ATOM 1668 N N . PHE A 1 232 ? 91.673 -59.180 13.098 1.00 69.73 ? 314 PHE A N 1 ATOM 1669 C CA . PHE A 1 232 ? 90.377 -58.613 12.767 1.00 58.21 ? 314 PHE A CA 1 ATOM 1670 C C . PHE A 1 232 ? 89.304 -59.386 13.526 1.00 53.54 ? 314 PHE A C 1 ATOM 1671 O O . PHE A 1 232 ? 89.344 -60.621 13.628 1.00 59.19 ? 314 PHE A O 1 ATOM 1672 C CB . PHE A 1 232 ? 90.124 -58.655 11.249 1.00 40.47 ? 314 PHE A CB 1 ATOM 1673 C CG . PHE A 1 232 ? 90.656 -57.454 10.509 1.00 45.42 ? 314 PHE A CG 1 ATOM 1674 C CD1 . PHE A 1 232 ? 90.163 -56.182 10.780 1.00 45.76 ? 314 PHE A CD1 1 ATOM 1675 C CD2 . PHE A 1 232 ? 91.635 -57.590 9.537 1.00 41.49 ? 314 PHE A CD2 1 ATOM 1676 C CE1 . PHE A 1 232 ? 90.633 -55.067 10.088 1.00 37.98 ? 314 PHE A CE1 1 ATOM 1677 C CE2 . PHE A 1 232 ? 92.115 -56.483 8.851 1.00 50.43 ? 314 PHE A CE2 1 ATOM 1678 C CZ . PHE A 1 232 ? 91.615 -55.220 9.130 1.00 53.40 ? 314 PHE A CZ 1 ATOM 1679 N N . LYS A 1 233 ? 88.340 -58.654 14.055 1.00 47.61 ? 315 LYS A N 1 ATOM 1680 C CA . LYS A 1 233 ? 87.267 -59.276 14.804 1.00 56.42 ? 315 LYS A CA 1 ATOM 1681 C C . LYS A 1 233 ? 85.924 -58.785 14.310 1.00 56.19 ? 315 LYS A C 1 ATOM 1682 O O . LYS A 1 233 ? 85.779 -57.629 13.906 1.00 52.73 ? 315 LYS A O 1 ATOM 1683 C CB . LYS A 1 233 ? 87.409 -58.958 16.302 1.00 61.07 ? 315 LYS A CB 1 ATOM 1684 C CG . LYS A 1 233 ? 88.656 -59.545 16.974 1.00 56.96 ? 315 LYS A CG 1 ATOM 1685 C CD . LYS A 1 233 ? 88.311 -59.998 18.390 1.00 72.52 ? 315 LYS A CD 1 ATOM 1686 C CE . LYS A 1 233 ? 89.551 -60.161 19.250 1.00 79.02 ? 315 LYS A CE 1 ATOM 1687 N NZ . LYS A 1 233 ? 90.121 -58.839 19.605 1.00 88.15 ? 315 LYS A NZ 1 ATOM 1688 N N . GLU A 1 234 ? 84.941 -59.672 14.358 1.00 58.21 ? 316 GLU A N 1 ATOM 1689 C CA . GLU A 1 234 ? 83.567 -59.327 14.026 1.00 54.31 ? 316 GLU A CA 1 ATOM 1690 C C . GLU A 1 234 ? 82.693 -59.395 15.289 1.00 54.95 ? 316 GLU A C 1 ATOM 1691 O O . GLU A 1 234 ? 82.596 -60.448 15.924 1.00 74.34 ? 316 GLU A O 1 ATOM 1692 C CB . GLU A 1 234 ? 83.047 -60.286 12.957 1.00 57.08 ? 316 GLU A CB 1 ATOM 1693 C CG . GLU A 1 234 ? 81.639 -60.004 12.497 1.00 61.36 ? 316 GLU A CG 1 ATOM 1694 C CD . GLU A 1 234 ? 81.544 -58.798 11.580 1.00 76.39 ? 316 GLU A CD 1 ATOM 1695 O OE1 . GLU A 1 234 ? 82.563 -58.421 10.952 1.00 88.20 ? 316 GLU A OE1 1 ATOM 1696 O OE2 . GLU A 1 234 ? 80.437 -58.226 11.489 1.00 81.26 ? 316 GLU A OE2 1 ATOM 1697 N N . PRO A 1 235 ? 82.055 -58.268 15.657 1.00 58.32 ? 317 PRO A N 1 ATOM 1698 C CA . PRO A 1 235 ? 81.188 -58.181 16.842 1.00 61.49 ? 317 PRO A CA 1 ATOM 1699 C C . PRO A 1 235 ? 80.042 -59.172 16.729 1.00 68.87 ? 317 PRO A C 1 ATOM 1700 O O . PRO A 1 235 ? 79.439 -59.315 15.651 1.00 69.46 ? 317 PRO A O 1 ATOM 1701 C CB . PRO A 1 235 ? 80.630 -56.752 16.769 1.00 52.53 ? 317 PRO A CB 1 ATOM 1702 C CG . PRO A 1 235 ? 80.675 -56.409 15.305 1.00 51.54 ? 317 PRO A CG 1 ATOM 1703 C CD . PRO A 1 235 ? 81.962 -57.052 14.827 1.00 58.65 ? 317 PRO A CD 1 ATOM 1704 N N . CYS A 1 236 ? 79.751 -59.850 17.833 1.00 73.73 ? 318 CYS A N 1 ATOM 1705 C CA . CYS A 1 236 ? 78.768 -60.926 17.829 1.00 69.78 ? 318 CYS A CA 1 ATOM 1706 C C . CYS A 1 236 ? 77.375 -60.456 18.260 1.00 72.84 ? 318 CYS A C 1 ATOM 1707 O O . CYS A 1 236 ? 76.490 -61.268 18.494 1.00 82.11 ? 318 CYS A O 1 ATOM 1708 C CB . CYS A 1 236 ? 79.263 -62.099 18.690 1.00 54.97 ? 318 CYS A CB 1 ATOM 1709 S SG . CYS A 1 236 ? 80.737 -62.966 18.030 1.00 91.47 ? 318 CYS A SG 1 ATOM 1710 N N . LEU A 1 237 ? 77.186 -59.141 18.314 1.00 61.05 ? 319 LEU A N 1 ATOM 1711 C CA . LEU A 1 237 ? 75.974 -58.538 18.855 1.00 48.84 ? 319 LEU A CA 1 ATOM 1712 C C . LEU A 1 237 ? 74.999 -58.082 17.777 1.00 63.15 ? 319 LEU A C 1 ATOM 1713 O O . LEU A 1 237 ? 75.386 -57.360 16.857 1.00 75.61 ? 319 LEU A O 1 ATOM 1714 C CB . LEU A 1 237 ? 76.363 -57.342 19.715 1.00 50.82 ? 319 LEU A CB 1 ATOM 1715 C CG . LEU A 1 237 ? 77.252 -57.739 20.901 1.00 56.05 ? 319 LEU A CG 1 ATOM 1716 C CD1 . LEU A 1 237 ? 77.647 -56.552 21.789 1.00 40.93 ? 319 LEU A CD1 1 ATOM 1717 C CD2 . LEU A 1 237 ? 76.538 -58.811 21.714 1.00 50.83 ? 319 LEU A CD2 1 ATOM 1718 N N . GLY A 1 238 ? 73.731 -58.475 17.910 1.00 69.27 ? 320 GLY A N 1 ATOM 1719 C CA . GLY A 1 238 ? 72.685 -58.101 16.964 1.00 69.12 ? 320 GLY A CA 1 ATOM 1720 C C . GLY A 1 238 ? 72.267 -56.636 16.962 1.00 82.42 ? 320 GLY A C 1 ATOM 1721 O O . GLY A 1 238 ? 71.421 -56.241 16.162 1.00 96.56 ? 320 GLY A O 1 ATOM 1722 N N . PHE A 1 239 ? 72.853 -55.838 17.856 1.00 74.47 ? 321 PHE A N 1 ATOM 1723 C CA . PHE A 1 239 ? 72.697 -54.378 17.866 1.00 54.47 ? 321 PHE A CA 1 ATOM 1724 C C . PHE A 1 239 ? 73.631 -53.800 16.788 1.00 60.08 ? 321 PHE A C 1 ATOM 1725 O O . PHE A 1 239 ? 74.833 -53.591 17.028 1.00 58.37 ? 321 PHE A O 1 ATOM 1726 C CB . PHE A 1 239 ? 73.081 -53.867 19.260 1.00 56.44 ? 321 PHE A CB 1 ATOM 1727 C CG . PHE A 1 239 ? 72.650 -52.456 19.565 1.00 58.18 ? 321 PHE A CG 1 ATOM 1728 C CD1 . PHE A 1 239 ? 71.326 -52.163 19.832 1.00 50.61 ? 321 PHE A CD1 1 ATOM 1729 C CD2 . PHE A 1 239 ? 73.590 -51.428 19.649 1.00 59.13 ? 321 PHE A CD2 1 ATOM 1730 C CE1 . PHE A 1 239 ? 70.930 -50.854 20.142 1.00 57.30 ? 321 PHE A CE1 1 ATOM 1731 C CE2 . PHE A 1 239 ? 73.206 -50.128 19.957 1.00 49.99 ? 321 PHE A CE2 1 ATOM 1732 C CZ . PHE A 1 239 ? 71.874 -49.835 20.202 1.00 47.73 ? 321 PHE A CZ 1 ATOM 1733 N N . LEU A 1 240 ? 73.082 -53.565 15.594 1.00 54.76 ? 322 LEU A N 1 ATOM 1734 C CA . LEU A 1 240 ? 73.892 -53.196 14.424 1.00 46.89 ? 322 LEU A CA 1 ATOM 1735 C C . LEU A 1 240 ? 74.351 -51.742 14.481 1.00 51.22 ? 322 LEU A C 1 ATOM 1736 O O . LEU A 1 240 ? 73.547 -50.839 14.732 1.00 66.19 ? 322 LEU A O 1 ATOM 1737 C CB . LEU A 1 240 ? 73.102 -53.439 13.145 1.00 56.33 ? 322 LEU A CB 1 ATOM 1738 C CG . LEU A 1 240 ? 72.310 -54.743 13.137 1.00 60.48 ? 322 LEU A CG 1 ATOM 1739 C CD1 . LEU A 1 240 ? 71.496 -54.831 11.876 1.00 51.81 ? 322 LEU A CD1 1 ATOM 1740 C CD2 . LEU A 1 240 ? 73.251 -55.940 13.276 1.00 71.52 ? 322 LEU A CD2 1 ATOM 1741 N N . GLY A 1 241 ? 75.640 -51.518 14.236 1.00 50.47 ? 323 GLY A N 1 ATOM 1742 C CA . GLY A 1 241 ? 76.235 -50.206 14.449 1.00 52.16 ? 323 GLY A CA 1 ATOM 1743 C C . GLY A 1 241 ? 76.193 -49.295 13.231 1.00 67.07 ? 323 GLY A C 1 ATOM 1744 O O . GLY A 1 241 ? 76.096 -48.059 13.365 1.00 67.85 ? 323 GLY A O 1 ATOM 1745 N N . ASP A 1 242 ? 76.255 -49.889 12.039 1.00 55.06 ? 324 ASP A N 1 ATOM 1746 C CA . ASP A 1 242 ? 76.296 -49.086 10.830 1.00 54.53 ? 324 ASP A CA 1 ATOM 1747 C C . ASP A 1 242 ? 74.961 -48.432 10.494 1.00 56.16 ? 324 ASP A C 1 ATOM 1748 O O . ASP A 1 242 ? 73.896 -48.836 10.981 1.00 51.88 ? 324 ASP A O 1 ATOM 1749 C CB . ASP A 1 242 ? 76.783 -49.898 9.607 1.00 56.39 ? 324 ASP A CB 1 ATOM 1750 C CG . ASP A 1 242 ? 77.745 -49.106 8.728 1.00 61.95 ? 324 ASP A CG 1 ATOM 1751 O OD1 . ASP A 1 242 ? 77.663 -47.854 8.760 1.00 65.14 ? 324 ASP A OD1 1 ATOM 1752 O OD2 . ASP A 1 242 ? 78.582 -49.730 8.033 1.00 74.68 ? 324 ASP A OD2 1 ATOM 1753 N N . THR A 1 243 ? 75.061 -47.410 9.646 1.00 53.01 ? 325 THR A N 1 ATOM 1754 C CA . THR A 1 243 ? 73.931 -46.741 9.022 1.00 64.78 ? 325 THR A CA 1 ATOM 1755 C C . THR A 1 243 ? 74.335 -46.536 7.559 1.00 66.83 ? 325 THR A C 1 ATOM 1756 O O . THR A 1 243 ? 75.331 -45.859 7.281 1.00 66.71 ? 325 THR A O 1 ATOM 1757 C CB . THR A 1 243 ? 73.642 -45.369 9.701 1.00 57.01 ? 325 THR A CB 1 ATOM 1758 O OG1 . THR A 1 243 ? 73.287 -45.573 11.076 1.00 75.84 ? 325 THR A OG1 1 ATOM 1759 C CG2 . THR A 1 243 ? 72.498 -44.655 9.020 1.00 47.97 ? 325 THR A CG2 1 ATOM 1760 N N . PRO A 1 244 ? 73.565 -47.107 6.615 1.00 62.43 ? 326 PRO A N 1 ATOM 1761 C CA . PRO A 1 244 ? 72.303 -47.822 6.839 1.00 65.95 ? 326 PRO A CA 1 ATOM 1762 C C . PRO A 1 244 ? 72.449 -49.227 7.425 1.00 68.20 ? 326 PRO A C 1 ATOM 1763 O O . PRO A 1 244 ? 73.564 -49.757 7.556 1.00 67.13 ? 326 PRO A O 1 ATOM 1764 C CB . PRO A 1 244 ? 71.734 -47.947 5.424 1.00 55.80 ? 326 PRO A CB 1 ATOM 1765 C CG . PRO A 1 244 ? 72.935 -48.043 4.558 1.00 47.33 ? 326 PRO A CG 1 ATOM 1766 C CD . PRO A 1 244 ? 73.928 -47.086 5.182 1.00 61.59 ? 326 PRO A CD 1 ATOM 1767 N N . ARG A 1 245 ? 71.292 -49.808 7.752 1.00 59.56 ? 327 ARG A N 1 ATOM 1768 C CA . ARG A 1 245 ? 71.182 -51.116 8.384 1.00 58.84 ? 327 ARG A CA 1 ATOM 1769 C C . ARG A 1 245 ? 69.701 -51.503 8.429 1.00 69.06 ? 327 ARG A C 1 ATOM 1770 O O . ARG A 1 245 ? 68.828 -50.633 8.330 1.00 63.20 ? 327 ARG A O 1 ATOM 1771 C CB . ARG A 1 245 ? 71.748 -51.081 9.816 1.00 53.65 ? 327 ARG A CB 1 ATOM 1772 C CG . ARG A 1 245 ? 70.907 -50.245 10.814 1.00 43.08 ? 327 ARG A CG 1 ATOM 1773 C CD . ARG A 1 245 ? 71.413 -50.433 12.225 1.00 59.69 ? 327 ARG A CD 1 ATOM 1774 N NE . ARG A 1 245 ? 70.622 -49.715 13.227 1.00 67.48 ? 327 ARG A NE 1 ATOM 1775 C CZ . ARG A 1 245 ? 70.757 -48.416 13.496 1.00 63.29 ? 327 ARG A CZ 1 ATOM 1776 N NH1 . ARG A 1 245 ? 71.642 -47.681 12.827 1.00 52.75 ? 327 ARG A NH1 1 ATOM 1777 N NH2 . ARG A 1 245 ? 69.995 -47.847 14.420 1.00 55.71 ? 327 ARG A NH2 1 ATOM 1778 N N . GLY A 1 246 ? 69.423 -52.797 8.595 1.00 67.58 ? 328 GLY A N 1 ATOM 1779 C CA . GLY A 1 246 ? 68.061 -53.279 8.733 1.00 63.90 ? 328 GLY A CA 1 ATOM 1780 C C . GLY A 1 246 ? 67.644 -53.454 10.184 1.00 77.39 ? 328 GLY A C 1 ATOM 1781 O O . GLY A 1 246 ? 68.139 -52.762 11.076 1.00 88.85 ? 328 GLY A O 1 ATOM 1782 N N . ILE A 1 247 ? 66.722 -54.381 10.419 1.00 75.47 ? 329 ILE A N 1 ATOM 1783 C CA . ILE A 1 247 ? 66.224 -54.656 11.758 1.00 65.23 ? 329 ILE A CA 1 ATOM 1784 C C . ILE A 1 247 ? 67.326 -55.326 12.574 1.00 67.16 ? 329 ILE A C 1 ATOM 1785 O O . ILE A 1 247 ? 68.128 -56.089 12.019 1.00 59.94 ? 329 ILE A O 1 ATOM 1786 C CB . ILE A 1 247 ? 65.001 -55.589 11.691 1.00 79.17 ? 329 ILE A CB 1 ATOM 1787 C CG1 . ILE A 1 247 ? 64.015 -55.051 10.671 1.00 82.16 ? 329 ILE A CG1 1 ATOM 1788 C CG2 . ILE A 1 247 ? 64.320 -55.716 13.052 1.00 86.17 ? 329 ILE A CG2 1 ATOM 1789 C CD1 . ILE A 1 247 ? 63.596 -53.626 10.948 1.00 77.94 ? 329 ILE A CD1 1 ATOM 1790 N N . ASP A 1 248 ? 67.368 -55.041 13.878 1.00 61.27 ? 330 ASP A N 1 ATOM 1791 C CA . ASP A 1 248 ? 68.321 -55.696 14.770 1.00 59.80 ? 330 ASP A CA 1 ATOM 1792 C C . ASP A 1 248 ? 68.104 -57.210 14.773 1.00 70.60 ? 330 ASP A C 1 ATOM 1793 O O . ASP A 1 248 ? 66.965 -57.687 14.716 1.00 67.55 ? 330 ASP A O 1 ATOM 1794 C CB . ASP A 1 248 ? 68.228 -55.133 16.193 1.00 51.19 ? 330 ASP A CB 1 ATOM 1795 C CG . ASP A 1 248 ? 68.943 -53.791 16.345 1.00 73.32 ? 330 ASP A CG 1 ATOM 1796 O OD1 . ASP A 1 248 ? 69.767 -53.442 15.457 1.00 80.43 ? 330 ASP A OD1 1 ATOM 1797 O OD2 . ASP A 1 248 ? 68.686 -53.091 17.361 1.00 63.77 ? 330 ASP A OD2 1 ATOM 1798 N N . THR A 1 249 ? 69.199 -57.967 14.826 1.00 74.12 ? 333 THR A N 1 ATOM 1799 C CA . THR A 1 249 ? 69.123 -59.426 14.709 1.00 73.61 ? 333 THR A CA 1 ATOM 1800 C C . THR A 1 249 ? 69.449 -60.132 16.025 1.00 66.58 ? 333 THR A C 1 ATOM 1801 O O . THR A 1 249 ? 69.775 -59.499 17.026 1.00 75.95 ? 333 THR A O 1 ATOM 1802 C CB . THR A 1 249 ? 70.060 -59.965 13.584 1.00 78.58 ? 333 THR A CB 1 ATOM 1803 O OG1 . THR A 1 249 ? 71.385 -60.156 14.101 1.00 96.48 ? 333 THR A OG1 1 ATOM 1804 C CG2 . THR A 1 249 ? 70.113 -58.990 12.407 1.00 62.80 ? 333 THR A CG2 1 ATOM 1805 N N . THR A 1 250 ? 69.350 -61.454 16.017 1.00 79.58 ? 334 THR A N 1 ATOM 1806 C CA . THR A 1 250 ? 69.843 -62.256 17.125 1.00 83.43 ? 334 THR A CA 1 ATOM 1807 C C . THR A 1 250 ? 71.366 -62.172 17.104 1.00 78.97 ? 334 THR A C 1 ATOM 1808 O O . THR A 1 250 ? 71.962 -61.728 16.123 1.00 81.22 ? 334 THR A O 1 ATOM 1809 C CB . THR A 1 250 ? 69.416 -63.731 16.983 1.00 84.80 ? 334 THR A CB 1 ATOM 1810 O OG1 . THR A 1 250 ? 70.221 -64.368 15.981 1.00 84.93 ? 334 THR A OG1 1 ATOM 1811 C CG2 . THR A 1 250 ? 67.956 -63.823 16.565 1.00 89.87 ? 334 THR A CG2 1 ATOM 1812 N N . ASN A 1 251 ? 72.006 -62.604 18.176 1.00 70.79 ? 335 ASN A N 1 ATOM 1813 C CA . ASN A 1 251 ? 73.454 -62.538 18.235 1.00 64.01 ? 335 ASN A CA 1 ATOM 1814 C C . ASN A 1 251 ? 74.144 -63.678 17.485 1.00 74.04 ? 335 ASN A C 1 ATOM 1815 O O . ASN A 1 251 ? 73.876 -64.857 17.741 1.00 73.33 ? 335 ASN A O 1 ATOM 1816 C CB . ASN A 1 251 ? 73.921 -62.484 19.693 1.00 64.56 ? 335 ASN A CB 1 ATOM 1817 C CG . ASN A 1 251 ? 73.550 -61.180 20.367 1.00 75.39 ? 335 ASN A CG 1 ATOM 1818 O OD1 . ASN A 1 251 ? 73.224 -60.195 19.703 1.00 81.20 ? 335 ASN A OD1 1 ATOM 1819 N ND2 . ASN A 1 251 ? 73.606 -61.162 21.690 1.00 81.83 ? 335 ASN A ND2 1 ATOM 1820 N N . TYR A 1 252 ? 75.015 -63.320 16.543 1.00 76.15 ? 336 TYR A N 1 ATOM 1821 C CA . TYR A 1 252 ? 75.884 -64.297 15.879 1.00 65.42 ? 336 TYR A CA 1 ATOM 1822 C C . TYR A 1 252 ? 77.252 -63.733 15.535 1.00 69.82 ? 336 TYR A C 1 ATOM 1823 O O . TYR A 1 252 ? 77.462 -62.521 15.557 1.00 68.00 ? 336 TYR A O 1 ATOM 1824 C CB . TYR A 1 252 ? 75.237 -64.885 14.634 1.00 68.45 ? 336 TYR A CB 1 ATOM 1825 C CG . TYR A 1 252 ? 74.644 -63.891 13.664 1.00 71.47 ? 336 TYR A CG 1 ATOM 1826 C CD1 . TYR A 1 252 ? 75.420 -63.304 12.662 1.00 62.07 ? 336 TYR A CD1 1 ATOM 1827 C CD2 . TYR A 1 252 ? 73.293 -63.567 13.724 1.00 66.65 ? 336 TYR A CD2 1 ATOM 1828 C CE1 . TYR A 1 252 ? 74.860 -62.407 11.753 1.00 65.33 ? 336 TYR A CE1 1 ATOM 1829 C CE2 . TYR A 1 252 ? 72.725 -62.678 12.821 1.00 69.16 ? 336 TYR A CE2 1 ATOM 1830 C CZ . TYR A 1 252 ? 73.510 -62.102 11.838 1.00 70.44 ? 336 TYR A CZ 1 ATOM 1831 O OH . TYR A 1 252 ? 72.937 -61.221 10.953 1.00 70.81 ? 336 TYR A OH 1 ATOM 1832 N N . CYS A 1 253 ? 78.181 -64.615 15.194 1.00 82.05 ? 337 CYS A N 1 ATOM 1833 C CA . CYS A 1 253 ? 79.576 -64.203 15.095 1.00 82.28 ? 337 CYS A CA 1 ATOM 1834 C C . CYS A 1 253 ? 80.046 -63.716 13.720 1.00 76.75 ? 337 CYS A C 1 ATOM 1835 O O . CYS A 1 253 ? 81.133 -63.142 13.594 1.00 85.59 ? 337 CYS A O 1 ATOM 1836 C CB . CYS A 1 253 ? 80.509 -65.283 15.675 1.00 76.32 ? 337 CYS A CB 1 ATOM 1837 S SG . CYS A 1 253 ? 81.006 -64.884 17.379 1.00 186.17 ? 337 CYS A SG 1 ATOM 1838 N N . ASP A 1 254 ? 79.235 -63.920 12.692 1.00 72.63 ? 339 ASP A N 1 ATOM 1839 C CA . ASP A 1 254 ? 79.632 -63.446 11.374 1.00 81.01 ? 339 ASP A CA 1 ATOM 1840 C C . ASP A 1 254 ? 78.818 -62.255 10.889 1.00 77.98 ? 339 ASP A C 1 ATOM 1841 O O . ASP A 1 254 ? 78.001 -61.692 11.620 1.00 81.40 ? 339 ASP A O 1 ATOM 1842 C CB . ASP A 1 254 ? 79.651 -64.572 10.334 1.00 88.51 ? 339 ASP A CB 1 ATOM 1843 C CG . ASP A 1 254 ? 78.675 -65.672 10.651 1.00 104.90 ? 339 ASP A CG 1 ATOM 1844 O OD1 . ASP A 1 254 ? 77.736 -65.419 11.438 1.00 116.19 ? 339 ASP A OD1 1 ATOM 1845 O OD2 . ASP A 1 254 ? 78.854 -66.787 10.110 1.00 102.93 ? 339 ASP A OD2 1 ATOM 1846 N N . LYS A 1 255 ? 79.069 -61.870 9.647 1.00 78.86 ? 340 LYS A N 1 ATOM 1847 C CA . LYS A 1 255 ? 78.596 -60.602 9.122 1.00 66.31 ? 340 LYS A CA 1 ATOM 1848 C C . LYS A 1 255 ? 77.095 -60.548 8.965 1.00 69.62 ? 340 LYS A C 1 ATOM 1849 O O . LYS A 1 255 ? 76.453 -61.545 8.626 1.00 85.46 ? 340 LYS A O 1 ATOM 1850 C CB . LYS A 1 255 ? 79.235 -60.347 7.760 1.00 64.97 ? 340 LYS A CB 1 ATOM 1851 C CG . LYS A 1 255 ? 80.353 -59.327 7.802 1.00 72.52 ? 340 LYS A CG 1 ATOM 1852 C CD . LYS A 1 255 ? 81.719 -59.923 7.511 1.00 79.46 ? 340 LYS A CD 1 ATOM 1853 C CE . LYS A 1 255 ? 81.806 -60.573 6.136 1.00 77.45 ? 340 LYS A CE 1 ATOM 1854 N NZ . LYS A 1 255 ? 81.284 -59.681 5.072 1.00 88.23 ? 340 LYS A NZ 1 ATOM 1855 N N . THR A 1 256 ? 76.533 -59.375 9.213 1.00 77.25 ? 341 THR A N 1 ATOM 1856 C CA . THR A 1 256 ? 75.164 -59.120 8.806 1.00 74.42 ? 341 THR A CA 1 ATOM 1857 C C . THR A 1 256 ? 75.220 -58.452 7.439 1.00 72.92 ? 341 THR A C 1 ATOM 1858 O O . THR A 1 256 ? 75.580 -57.276 7.311 1.00 68.19 ? 341 THR A O 1 ATOM 1859 C CB . THR A 1 256 ? 74.421 -58.243 9.811 1.00 67.42 ? 341 THR A CB 1 ATOM 1860 O OG1 . THR A 1 256 ? 74.335 -58.942 11.064 1.00 68.93 ? 341 THR A OG1 1 ATOM 1861 C CG2 . THR A 1 256 ? 73.016 -57.912 9.286 1.00 48.64 ? 341 THR A CG2 1 ATOM 1862 N N . THR A 1 257 ? 74.870 -59.220 6.414 1.00 73.94 ? 342 THR A N 1 ATOM 1863 C CA . THR A 1 257 ? 75.029 -58.782 5.033 1.00 74.61 ? 342 THR A CA 1 ATOM 1864 C C . THR A 1 257 ? 73.847 -57.946 4.555 1.00 73.20 ? 342 THR A C 1 ATOM 1865 O O . THR A 1 257 ? 73.965 -57.180 3.596 1.00 77.38 ? 342 THR A O 1 ATOM 1866 C CB . THR A 1 257 ? 75.202 -59.987 4.098 1.00 73.04 ? 342 THR A CB 1 ATOM 1867 O OG1 . THR A 1 257 ? 74.116 -60.895 4.305 1.00 75.70 ? 342 THR A OG1 1 ATOM 1868 C CG2 . THR A 1 257 ? 76.515 -60.703 4.388 1.00 69.22 ? 342 THR A CG2 1 ATOM 1869 N N . THR A 1 258 ? 72.712 -58.100 5.231 1.00 66.20 ? 343 THR A N 1 ATOM 1870 C CA . THR A 1 258 ? 71.478 -57.416 4.855 1.00 66.52 ? 343 THR A CA 1 ATOM 1871 C C . THR A 1 258 ? 71.613 -55.919 5.070 1.00 61.89 ? 343 THR A C 1 ATOM 1872 O O . THR A 1 258 ? 71.919 -55.483 6.176 1.00 69.26 ? 343 THR A O 1 ATOM 1873 C CB . THR A 1 258 ? 70.290 -57.920 5.696 1.00 73.73 ? 343 THR A CB 1 ATOM 1874 O OG1 . THR A 1 258 ? 70.330 -59.358 5.794 1.00 77.64 ? 343 THR A OG1 1 ATOM 1875 C CG2 . THR A 1 258 ? 68.974 -57.463 5.077 1.00 66.86 ? 343 THR A CG2 1 ATOM 1876 N N . GLU A 1 259 ? 71.376 -55.140 4.014 1.00 63.10 ? 344 GLU A N 1 ATOM 1877 C CA . GLU A 1 259 ? 71.571 -53.687 4.037 1.00 70.05 ? 344 GLU A CA 1 ATOM 1878 C C . GLU A 1 259 ? 73.022 -53.320 4.378 1.00 78.70 ? 344 GLU A C 1 ATOM 1879 O O . GLU A 1 259 ? 73.296 -52.255 4.945 1.00 87.54 ? 344 GLU A O 1 ATOM 1880 C CB . GLU A 1 259 ? 70.595 -53.016 5.012 1.00 80.19 ? 344 GLU A CB 1 ATOM 1881 C CG . GLU A 1 259 ? 69.135 -53.021 4.564 1.00 80.02 ? 344 GLU A CG 1 ATOM 1882 C CD . GLU A 1 259 ? 68.487 -51.646 4.695 1.00 97.50 ? 344 GLU A CD 1 ATOM 1883 O OE1 . GLU A 1 259 ? 68.980 -50.686 4.052 1.00 89.76 ? 344 GLU A OE1 1 ATOM 1884 O OE2 . GLU A 1 259 ? 67.481 -51.529 5.441 1.00 104.24 ? 344 GLU A OE2 1 ATOM 1885 N N . GLY A 1 260 ? 73.945 -54.212 4.023 1.00 74.34 ? 345 GLY A N 1 ATOM 1886 C CA . GLY A 1 260 ? 75.345 -54.061 4.376 1.00 59.90 ? 345 GLY A CA 1 ATOM 1887 C C . GLY A 1 260 ? 76.148 -53.204 3.411 1.00 65.31 ? 345 GLY A C 1 ATOM 1888 O O . GLY A 1 260 ? 77.356 -53.048 3.577 1.00 80.00 ? 345 GLY A O 1 ATOM 1889 N N . GLU A 1 261 ? 75.497 -52.657 2.390 1.00 62.22 ? 346 GLU A N 1 ATOM 1890 C CA . GLU A 1 261 ? 76.185 -51.761 1.467 1.00 59.91 ? 346 GLU A CA 1 ATOM 1891 C C . GLU A 1 261 ? 76.004 -50.340 1.976 1.00 58.11 ? 346 GLU A C 1 ATOM 1892 O O . GLU A 1 261 ? 75.004 -50.046 2.634 1.00 63.67 ? 346 GLU A O 1 ATOM 1893 C CB . GLU A 1 261 ? 75.634 -51.900 0.041 1.00 54.56 ? 346 GLU A CB 1 ATOM 1894 C CG . GLU A 1 261 ? 76.479 -51.202 -1.033 1.00 65.76 ? 346 GLU A CG 1 ATOM 1895 C CD . GLU A 1 261 ? 75.963 -51.436 -2.460 1.00 89.76 ? 346 GLU A CD 1 ATOM 1896 O OE1 . GLU A 1 261 ? 74.833 -51.959 -2.616 1.00 94.45 ? 346 GLU A OE1 1 ATOM 1897 O OE2 . GLU A 1 261 ? 76.695 -51.097 -3.424 1.00 87.44 ? 346 GLU A OE2 1 ATOM 1898 N N . GLY A 1 262 ? 76.955 -49.458 1.673 1.00 56.02 ? 347 GLY A N 1 ATOM 1899 C CA . GLY A 1 262 ? 76.940 -48.113 2.224 1.00 60.31 ? 347 GLY A CA 1 ATOM 1900 C C . GLY A 1 262 ? 77.527 -48.086 3.632 1.00 61.48 ? 347 GLY A C 1 ATOM 1901 O O . GLY A 1 262 ? 78.193 -49.025 4.049 1.00 58.83 ? 347 GLY A O 1 ATOM 1902 N N . GLY A 1 263 ? 77.295 -47.010 4.369 1.00 50.61 ? 348 GLY A N 1 ATOM 1903 C CA . GLY A 1 263 ? 77.803 -46.937 5.720 1.00 47.09 ? 348 GLY A CA 1 ATOM 1904 C C . GLY A 1 263 ? 78.312 -45.559 6.069 1.00 54.89 ? 348 GLY A C 1 ATOM 1905 O O . GLY A 1 263 ? 78.436 -44.704 5.202 1.00 55.51 ? 348 GLY A O 1 ATOM 1906 N N . ILE A 1 264 ? 78.605 -45.342 7.346 1.00 55.70 ? 349 ILE A N 1 ATOM 1907 C CA . ILE A 1 264 ? 79.083 -44.046 7.825 1.00 47.21 ? 349 ILE A CA 1 ATOM 1908 C C . ILE A 1 264 ? 80.069 -44.286 8.971 1.00 49.26 ? 349 ILE A C 1 ATOM 1909 O O . ILE A 1 264 ? 79.925 -45.254 9.716 1.00 51.71 ? 349 ILE A O 1 ATOM 1910 C CB . ILE A 1 264 ? 77.893 -43.164 8.272 1.00 52.98 ? 349 ILE A CB 1 ATOM 1911 C CG1 . ILE A 1 264 ? 78.321 -41.700 8.426 1.00 55.90 ? 349 ILE A CG1 1 ATOM 1912 C CG2 . ILE A 1 264 ? 77.226 -43.719 9.546 1.00 46.91 ? 349 ILE A CG2 1 ATOM 1913 C CD1 . ILE A 1 264 ? 77.152 -40.727 8.339 1.00 53.97 ? 349 ILE A CD1 1 ATOM 1914 N N . GLN A 1 265 ? 81.085 -43.439 9.095 1.00 44.73 ? 350 GLN A N 1 ATOM 1915 C CA . GLN A 1 265 ? 82.098 -43.642 10.126 1.00 41.66 ? 350 GLN A CA 1 ATOM 1916 C C . GLN A 1 265 ? 81.467 -43.627 11.500 1.00 56.66 ? 350 GLN A C 1 ATOM 1917 O O . GLN A 1 265 ? 80.625 -42.769 11.792 1.00 60.19 ? 350 GLN A O 1 ATOM 1918 C CB . GLN A 1 265 ? 83.166 -42.558 10.053 1.00 46.16 ? 350 GLN A CB 1 ATOM 1919 C CG . GLN A 1 265 ? 84.414 -42.801 10.910 1.00 49.96 ? 350 GLN A CG 1 ATOM 1920 C CD . GLN A 1 265 ? 85.408 -41.656 10.762 1.00 48.86 ? 350 GLN A CD 1 ATOM 1921 O OE1 . GLN A 1 265 ? 85.007 -40.515 10.524 1.00 48.81 ? 350 GLN A OE1 1 ATOM 1922 N NE2 . GLN A 1 265 ? 86.705 -41.958 10.880 1.00 47.63 ? 350 GLN A NE2 1 ATOM 1923 N N . GLY A 1 266 ? 81.890 -44.578 12.335 1.00 58.97 ? 351 GLY A N 1 ATOM 1924 C CA . GLY A 1 266 ? 81.388 -44.726 13.693 1.00 47.21 ? 351 GLY A CA 1 ATOM 1925 C C . GLY A 1 266 ? 82.276 -45.659 14.497 1.00 46.63 ? 351 GLY A C 1 ATOM 1926 O O . GLY A 1 266 ? 83.287 -46.156 13.994 1.00 49.35 ? 351 GLY A O 1 ATOM 1927 N N . PHE A 1 267 ? 81.909 -45.920 15.745 1.00 46.09 ? 352 PHE A N 1 ATOM 1928 C CA . PHE A 1 267 ? 82.829 -46.614 16.645 1.00 46.54 ? 352 PHE A CA 1 ATOM 1929 C C . PHE A 1 267 ? 82.112 -47.575 17.558 1.00 52.13 ? 352 PHE A C 1 ATOM 1930 O O . PHE A 1 267 ? 80.925 -47.403 17.859 1.00 56.90 ? 352 PHE A O 1 ATOM 1931 C CB . PHE A 1 267 ? 83.564 -45.595 17.534 1.00 45.43 ? 352 PHE A CB 1 ATOM 1932 C CG . PHE A 1 267 ? 82.651 -44.789 18.404 1.00 46.88 ? 352 PHE A CG 1 ATOM 1933 C CD1 . PHE A 1 267 ? 82.296 -45.239 19.683 1.00 48.19 ? 352 PHE A CD1 1 ATOM 1934 C CD2 . PHE A 1 267 ? 82.137 -43.575 17.942 1.00 45.20 ? 352 PHE A CD2 1 ATOM 1935 C CE1 . PHE A 1 267 ? 81.433 -44.489 20.485 1.00 49.63 ? 352 PHE A CE1 1 ATOM 1936 C CE2 . PHE A 1 267 ? 81.279 -42.819 18.739 1.00 52.76 ? 352 PHE A CE2 1 ATOM 1937 C CZ . PHE A 1 267 ? 80.924 -43.275 20.014 1.00 52.04 ? 352 PHE A CZ 1 ATOM 1938 N N . MET A 1 268 ? 82.851 -48.585 18.000 1.00 52.01 ? 353 MET A N 1 ATOM 1939 C CA . MET A 1 268 ? 82.477 -49.377 19.167 1.00 45.34 ? 353 MET A CA 1 ATOM 1940 C C . MET A 1 268 ? 83.662 -49.279 20.104 1.00 51.72 ? 353 MET A C 1 ATOM 1941 O O . MET A 1 268 ? 84.761 -48.927 19.661 1.00 54.51 ? 353 MET A O 1 ATOM 1942 C CB . MET A 1 268 ? 82.231 -50.826 18.763 1.00 49.52 ? 353 MET A CB 1 ATOM 1943 C CG . MET A 1 268 ? 81.280 -51.004 17.591 1.00 42.86 ? 353 MET A CG 1 ATOM 1944 S SD . MET A 1 268 ? 81.418 -52.693 17.021 1.00 57.87 ? 353 MET A SD 1 ATOM 1945 C CE . MET A 1 268 ? 79.809 -52.898 16.224 1.00 140.15 ? 353 MET A CE 1 ATOM 1946 N N . ILE A 1 269 ? 83.430 -49.537 21.390 1.00 56.77 ? 354 ILE A N 1 ATOM 1947 C CA . ILE A 1 269 ? 84.495 -49.610 22.383 1.00 49.21 ? 354 ILE A CA 1 ATOM 1948 C C . ILE A 1 269 ? 84.422 -50.990 22.991 1.00 60.01 ? 354 ILE A C 1 ATOM 1949 O O . ILE A 1 269 ? 83.369 -51.395 23.484 1.00 62.64 ? 354 ILE A O 1 ATOM 1950 C CB . ILE A 1 269 ? 84.301 -48.604 23.531 1.00 45.13 ? 354 ILE A CB 1 ATOM 1951 C CG1 . ILE A 1 269 ? 84.336 -47.168 23.007 1.00 41.61 ? 354 ILE A CG1 1 ATOM 1952 C CG2 . ILE A 1 269 ? 85.356 -48.811 24.630 1.00 35.77 ? 354 ILE A CG2 1 ATOM 1953 C CD1 . ILE A 1 269 ? 83.765 -46.173 23.982 1.00 43.43 ? 354 ILE A CD1 1 ATOM 1954 N N . GLU A 1 270 ? 85.530 -51.718 22.957 1.00 62.07 ? 355 GLU A N 1 ATOM 1955 C CA . GLU A 1 270 ? 85.569 -52.998 23.637 1.00 62.14 ? 355 GLU A CA 1 ATOM 1956 C C . GLU A 1 270 ? 86.374 -52.916 24.928 1.00 55.53 ? 355 GLU A C 1 ATOM 1957 O O . GLU A 1 270 ? 87.526 -52.491 24.938 1.00 67.52 ? 355 GLU A O 1 ATOM 1958 C CB . GLU A 1 270 ? 86.108 -54.080 22.719 1.00 59.69 ? 355 GLU A CB 1 ATOM 1959 C CG . GLU A 1 270 ? 85.484 -55.420 23.022 1.00 63.22 ? 355 GLU A CG 1 ATOM 1960 C CD . GLU A 1 270 ? 86.524 -56.387 23.432 1.00 78.93 ? 355 GLU A CD 1 ATOM 1961 O OE1 . GLU A 1 270 ? 87.718 -56.018 23.392 1.00 72.29 ? 355 GLU A OE1 1 ATOM 1962 O OE2 . GLU A 1 270 ? 86.129 -57.523 23.803 1.00 93.05 ? 355 GLU A OE2 1 ATOM 1963 N N . GLY A 1 271 ? 85.743 -53.304 26.024 1.00 60.13 ? 356 GLY A N 1 ATOM 1964 C CA . GLY A 1 271 ? 86.349 -53.197 27.345 1.00 63.97 ? 356 GLY A CA 1 ATOM 1965 C C . GLY A 1 271 ? 85.653 -54.142 28.298 1.00 58.19 ? 356 GLY A C 1 ATOM 1966 O O . GLY A 1 271 ? 84.854 -54.973 27.849 1.00 57.40 ? 356 GLY A O 1 ATOM 1967 N N . SER A 1 272 ? 85.937 -54.040 29.598 1.00 66.34 ? 357 SER A N 1 ATOM 1968 C CA . SER A 1 272 ? 85.213 -54.871 30.567 1.00 66.00 ? 357 SER A CA 1 ATOM 1969 C C . SER A 1 272 ? 83.741 -54.467 30.494 1.00 62.21 ? 357 SER A C 1 ATOM 1970 O O . SER A 1 272 ? 82.830 -55.290 30.650 1.00 67.34 ? 357 SER A O 1 ATOM 1971 C CB . SER A 1 272 ? 85.786 -54.733 31.977 1.00 74.61 ? 357 SER A CB 1 ATOM 1972 O OG . SER A 1 272 ? 85.617 -53.421 32.492 1.00 101.35 ? 357 SER A OG 1 ATOM 1973 N N . ASN A 1 273 ? 83.528 -53.179 30.253 1.00 58.32 ? 359 ASN A N 1 ATOM 1974 C CA . ASN A 1 273 ? 82.265 -52.688 29.728 1.00 67.65 ? 359 ASN A CA 1 ATOM 1975 C C . ASN A 1 273 ? 82.502 -52.392 28.270 1.00 60.77 ? 359 ASN A C 1 ATOM 1976 O O . ASN A 1 273 ? 83.471 -51.701 27.935 1.00 53.03 ? 359 ASN A O 1 ATOM 1977 C CB . ASN A 1 273 ? 81.844 -51.401 30.441 1.00 69.59 ? 359 ASN A CB 1 ATOM 1978 C CG . ASN A 1 273 ? 81.368 -51.656 31.847 1.00 78.49 ? 359 ASN A CG 1 ATOM 1979 O OD1 . ASN A 1 273 ? 81.175 -52.818 32.248 1.00 75.11 ? 359 ASN A OD1 1 ATOM 1980 N ND2 . ASN A 1 273 ? 81.156 -50.575 32.609 1.00 78.86 ? 359 ASN A ND2 1 ATOM 1981 N N . SER A 1 274 ? 81.641 -52.904 27.398 1.00 57.66 ? 360 SER A N 1 ATOM 1982 C CA . SER A 1 274 ? 81.735 -52.532 25.987 1.00 55.65 ? 360 SER A CA 1 ATOM 1983 C C . SER A 1 274 ? 80.624 -51.577 25.572 1.00 47.46 ? 360 SER A C 1 ATOM 1984 O O . SER A 1 274 ? 79.592 -51.502 26.231 1.00 50.64 ? 360 SER A O 1 ATOM 1985 C CB . SER A 1 274 ? 81.767 -53.763 25.092 1.00 48.04 ? 360 SER A CB 1 ATOM 1986 O OG . SER A 1 274 ? 83.021 -54.405 25.217 1.00 64.60 ? 360 SER A OG 1 ATOM 1987 N N . TRP A 1 275 ? 80.845 -50.841 24.487 1.00 52.37 ? 361 TRP A N 1 ATOM 1988 C CA . TRP A 1 275 ? 79.841 -49.898 23.997 1.00 50.06 ? 361 TRP A CA 1 ATOM 1989 C C . TRP A 1 275 ? 79.678 -49.957 22.495 1.00 51.35 ? 361 TRP A C 1 ATOM 1990 O O . TRP A 1 275 ? 80.624 -50.235 21.761 1.00 60.69 ? 361 TRP A O 1 ATOM 1991 C CB . TRP A 1 275 ? 80.217 -48.473 24.367 1.00 44.16 ? 361 TRP A CB 1 ATOM 1992 C CG . TRP A 1 275 ? 80.367 -48.225 25.842 1.00 52.33 ? 361 TRP A CG 1 ATOM 1993 C CD1 . TRP A 1 275 ? 81.479 -48.448 26.603 1.00 51.63 ? 361 TRP A CD1 1 ATOM 1994 C CD2 . TRP A 1 275 ? 79.384 -47.663 26.725 1.00 53.12 ? 361 TRP A CD2 1 ATOM 1995 N NE1 . TRP A 1 275 ? 81.249 -48.066 27.903 1.00 64.54 ? 361 TRP A NE1 1 ATOM 1996 C CE2 . TRP A 1 275 ? 79.968 -47.578 28.002 1.00 63.11 ? 361 TRP A CE2 1 ATOM 1997 C CE3 . TRP A 1 275 ? 78.067 -47.223 26.558 1.00 51.46 ? 361 TRP A CE3 1 ATOM 1998 C CZ2 . TRP A 1 275 ? 79.283 -47.077 29.103 1.00 62.73 ? 361 TRP A CZ2 1 ATOM 1999 C CZ3 . TRP A 1 275 ? 77.390 -46.730 27.648 1.00 60.88 ? 361 TRP A CZ3 1 ATOM 2000 C CH2 . TRP A 1 275 ? 77.996 -46.660 28.904 1.00 61.49 ? 361 TRP A CH2 1 ATOM 2001 N N . ILE A 1 276 ? 78.461 -49.696 22.039 1.00 59.35 ? 362 ILE A N 1 ATOM 2002 C CA . ILE A 1 276 ? 78.220 -49.466 20.624 1.00 49.25 ? 362 ILE A CA 1 ATOM 2003 C C . ILE A 1 276 ? 77.410 -48.189 20.471 1.00 57.46 ? 362 ILE A C 1 ATOM 2004 O O . ILE A 1 276 ? 76.302 -48.073 21.011 1.00 68.81 ? 362 ILE A O 1 ATOM 2005 C CB . ILE A 1 276 ? 77.453 -50.603 19.995 1.00 52.83 ? 362 ILE A CB 1 ATOM 2006 C CG1 . ILE A 1 276 ? 78.277 -51.882 20.048 1.00 50.55 ? 362 ILE A CG1 1 ATOM 2007 C CG2 . ILE A 1 276 ? 77.118 -50.266 18.568 1.00 49.01 ? 362 ILE A CG2 1 ATOM 2008 C CD1 . ILE A 1 276 ? 77.601 -53.043 19.394 1.00 45.17 ? 362 ILE A CD1 1 ATOM 2009 N N . GLY A 1 277 ? 77.995 -47.215 19.780 1.00 43.80 ? 363 GLY A N 1 ATOM 2010 C CA . GLY A 1 277 ? 77.290 -46.003 19.409 1.00 50.03 ? 363 GLY A CA 1 ATOM 2011 C C . GLY A 1 277 ? 76.742 -46.124 17.984 1.00 59.71 ? 363 GLY A C 1 ATOM 2012 O O . GLY A 1 277 ? 77.420 -46.612 17.058 1.00 67.11 ? 363 GLY A O 1 ATOM 2013 N N . ARG A 1 278 ? 75.499 -45.690 17.810 1.00 51.63 ? 364 ARG A N 1 ATOM 2014 C CA . ARG A 1 278 ? 74.881 -45.693 16.502 1.00 46.29 ? 364 ARG A CA 1 ATOM 2015 C C . ARG A 1 278 ? 73.856 -44.586 16.357 1.00 53.80 ? 364 ARG A C 1 ATOM 2016 O O . ARG A 1 278 ? 73.424 -43.961 17.348 1.00 54.11 ? 364 ARG A O 1 ATOM 2017 C CB . ARG A 1 278 ? 74.220 -47.042 16.216 1.00 48.65 ? 364 ARG A CB 1 ATOM 2018 C CG . ARG A 1 278 ? 72.799 -47.177 16.734 1.00 51.85 ? 364 ARG A CG 1 ATOM 2019 C CD . ARG A 1 278 ? 72.460 -48.636 16.851 1.00 51.75 ? 364 ARG A CD 1 ATOM 2020 N NE . ARG A 1 278 ? 71.050 -48.908 17.102 1.00 57.23 ? 364 ARG A NE 1 ATOM 2021 C CZ . ARG A 1 278 ? 70.537 -50.136 17.068 1.00 60.88 ? 364 ARG A CZ 1 ATOM 2022 N NH1 . ARG A 1 278 ? 71.335 -51.163 16.813 1.00 66.70 ? 364 ARG A NH1 1 ATOM 2023 N NH2 . ARG A 1 278 ? 69.245 -50.345 17.296 1.00 60.55 ? 364 ARG A NH2 1 ATOM 2024 N N . ILE A 1 279 ? 73.507 -44.347 15.096 1.00 56.08 ? 365 ILE A N 1 ATOM 2025 C CA . ILE A 1 279 ? 72.410 -43.481 14.714 1.00 52.00 ? 365 ILE A CA 1 ATOM 2026 C C . ILE A 1 279 ? 71.118 -44.252 15.001 1.00 57.82 ? 365 ILE A C 1 ATOM 2027 O O . ILE A 1 279 ? 70.999 -45.424 14.629 1.00 57.19 ? 365 ILE A O 1 ATOM 2028 C CB . ILE A 1 279 ? 72.530 -43.115 13.217 1.00 51.74 ? 365 ILE A CB 1 ATOM 2029 C CG1 . ILE A 1 279 ? 73.874 -42.439 12.965 1.00 49.80 ? 365 ILE A CG1 1 ATOM 2030 C CG2 . ILE A 1 279 ? 71.378 -42.224 12.743 1.00 44.56 ? 365 ILE A CG2 1 ATOM 2031 C CD1 . ILE A 1 279 ? 74.025 -41.831 11.579 1.00 50.33 ? 365 ILE A CD1 1 ATOM 2032 N N . ILE A 1 280 ? 70.169 -43.598 15.676 1.00 57.88 ? 366 ILE A N 1 ATOM 2033 C CA . ILE A 1 280 ? 68.932 -44.246 16.115 1.00 57.14 ? 366 ILE A CA 1 ATOM 2034 C C . ILE A 1 280 ? 68.015 -44.605 14.943 1.00 64.81 ? 366 ILE A C 1 ATOM 2035 O O . ILE A 1 280 ? 67.689 -45.774 14.744 1.00 58.32 ? 366 ILE A O 1 ATOM 2036 C CB . ILE A 1 280 ? 68.173 -43.383 17.148 1.00 56.83 ? 366 ILE A CB 1 ATOM 2037 C CG1 . ILE A 1 280 ? 69.029 -43.204 18.405 1.00 59.82 ? 366 ILE A CG1 1 ATOM 2038 C CG2 . ILE A 1 280 ? 66.835 -44.028 17.503 1.00 50.87 ? 366 ILE A CG2 1 ATOM 2039 C CD1 . ILE A 1 280 ? 68.549 -42.121 19.325 1.00 52.06 ? 366 ILE A CD1 1 ATOM 2040 N N . ASN A 1 281 ? 67.598 -43.600 14.176 1.00 77.43 ? 367 ASN A N 1 ATOM 2041 C CA . ASN A 1 281 ? 66.820 -43.839 12.964 1.00 71.05 ? 367 ASN A CA 1 ATOM 2042 C C . ASN A 1 281 ? 67.717 -43.864 11.717 1.00 61.53 ? 367 ASN A C 1 ATOM 2043 O O . ASN A 1 281 ? 68.192 -42.825 11.260 1.00 66.38 ? 367 ASN A O 1 ATOM 2044 C CB . ASN A 1 281 ? 65.703 -42.790 12.831 1.00 74.62 ? 367 ASN A CB 1 ATOM 2045 C CG . ASN A 1 281 ? 64.600 -43.216 11.866 1.00 98.84 ? 367 ASN A CG 1 ATOM 2046 O OD1 . ASN A 1 281 ? 64.863 -43.736 10.776 1.00 109.35 ? 367 ASN A OD1 1 ATOM 2047 N ND2 . ASN A 1 281 ? 63.354 -42.985 12.264 1.00 101.12 ? 367 ASN A ND2 1 ATOM 2048 N N . PRO A 1 282 ? 67.962 -45.059 11.163 1.00 60.44 ? 368 PRO A N 1 ATOM 2049 C CA . PRO A 1 282 ? 68.823 -45.153 9.972 1.00 64.51 ? 368 PRO A CA 1 ATOM 2050 C C . PRO A 1 282 ? 68.287 -44.400 8.747 1.00 69.50 ? 368 PRO A C 1 ATOM 2051 O O . PRO A 1 282 ? 69.081 -43.935 7.919 1.00 74.53 ? 368 PRO A O 1 ATOM 2052 C CB . PRO A 1 282 ? 68.872 -46.654 9.697 1.00 62.45 ? 368 PRO A CB 1 ATOM 2053 C CG . PRO A 1 282 ? 68.663 -47.271 11.039 1.00 55.84 ? 368 PRO A CG 1 ATOM 2054 C CD . PRO A 1 282 ? 67.651 -46.384 11.719 1.00 48.34 ? 368 PRO A CD 1 ATOM 2055 N N . GLY A 1 283 ? 66.964 -44.272 8.640 1.00 71.90 ? 369 GLY A N 1 ATOM 2056 C CA . GLY A 1 283 ? 66.332 -43.612 7.504 1.00 63.24 ? 369 GLY A CA 1 ATOM 2057 C C . GLY A 1 283 ? 66.481 -42.100 7.519 1.00 67.87 ? 369 GLY A C 1 ATOM 2058 O O . GLY A 1 283 ? 67.214 -41.535 6.689 1.00 69.92 ? 369 GLY A O 1 ATOM 2059 N N . SER A 1 284 ? 65.765 -41.435 8.429 1.00 62.48 ? 370 SER A N 1 ATOM 2060 C CA . SER A 1 284 ? 66.032 -40.021 8.699 1.00 63.32 ? 370 SER A CA 1 ATOM 2061 C C . SER A 1 284 ? 67.211 -40.095 9.616 1.00 70.34 ? 370 SER A C 1 ATOM 2062 O O . SER A 1 284 ? 67.081 -40.608 10.735 1.00 104.62 ? 370 SER A O 1 ATOM 2063 C CB . SER A 1 284 ? 64.880 -39.365 9.454 1.00 72.17 ? 370 SER A CB 1 ATOM 2064 O OG . SER A 1 284 ? 64.840 -39.786 10.814 1.00 78.63 ? 370 SER A OG 1 ATOM 2065 N N . LYS A 1 285 ? 68.368 -39.623 9.189 1.00 46.91 ? 371 LYS A N 1 ATOM 2066 C CA . LYS A 1 285 ? 69.554 -39.874 10.014 1.00 61.45 ? 371 LYS A CA 1 ATOM 2067 C C . LYS A 1 285 ? 69.495 -39.136 11.390 1.00 62.59 ? 371 LYS A C 1 ATOM 2068 O O . LYS A 1 285 ? 70.426 -38.431 11.785 1.00 69.59 ? 371 LYS A O 1 ATOM 2069 C CB . LYS A 1 285 ? 70.844 -39.593 9.216 1.00 63.36 ? 371 LYS A CB 1 ATOM 2070 C CG . LYS A 1 285 ? 71.285 -40.778 8.320 1.00 77.32 ? 371 LYS A CG 1 ATOM 2071 C CD . LYS A 1 285 ? 72.008 -40.353 7.027 1.00 94.50 ? 371 LYS A CD 1 ATOM 2072 C CE . LYS A 1 285 ? 71.543 -41.177 5.811 1.00 110.15 ? 371 LYS A CE 1 ATOM 2073 N NZ . LYS A 1 285 ? 70.166 -40.815 5.336 1.00 112.58 ? 371 LYS A NZ 1 ATOM 2074 N N . LYS A 1 286 ? 68.400 -39.341 12.126 1.00 56.07 ? 372 LYS A N 1 ATOM 2075 C CA . LYS A 1 286 ? 68.134 -38.598 13.359 1.00 67.33 ? 372 LYS A CA 1 ATOM 2076 C C . LYS A 1 286 ? 68.437 -39.403 14.622 1.00 58.63 ? 372 LYS A C 1 ATOM 2077 O O . LYS A 1 286 ? 68.150 -40.613 14.687 1.00 59.91 ? 372 LYS A O 1 ATOM 2078 C CB . LYS A 1 286 ? 66.680 -38.100 13.393 1.00 75.61 ? 372 LYS A CB 1 ATOM 2079 C CG . LYS A 1 286 ? 66.395 -36.997 12.379 1.00 91.58 ? 372 LYS A CG 1 ATOM 2080 C CD . LYS A 1 286 ? 65.354 -36.004 12.906 1.00 104.02 ? 372 LYS A CD 1 ATOM 2081 C CE . LYS A 1 286 ? 65.177 -34.798 11.975 1.00 98.82 ? 372 LYS A CE 1 ATOM 2082 N NZ . LYS A 1 286 ? 65.971 -33.589 12.388 1.00 86.37 ? 372 LYS A NZ 1 ATOM 2083 N N . GLY A 1 287 ? 69.034 -38.720 15.606 1.00 52.32 ? 373 GLY A N 1 ATOM 2084 C CA . GLY A 1 287 ? 69.264 -39.278 16.935 1.00 56.74 ? 373 GLY A CA 1 ATOM 2085 C C . GLY A 1 287 ? 70.527 -40.111 17.098 1.00 60.19 ? 373 GLY A C 1 ATOM 2086 O O . GLY A 1 287 ? 70.977 -40.796 16.164 1.00 52.43 ? 373 GLY A O 1 ATOM 2087 N N . PHE A 1 288 ? 71.107 -40.065 18.292 1.00 56.60 ? 374 PHE A N 1 ATOM 2088 C CA . PHE A 1 288 ? 72.282 -40.881 18.569 1.00 60.95 ? 374 PHE A CA 1 ATOM 2089 C C . PHE A 1 288 ? 72.153 -41.600 19.917 1.00 63.48 ? 374 PHE A C 1 ATOM 2090 O O . PHE A 1 288 ? 71.876 -40.973 20.952 1.00 59.10 ? 374 PHE A O 1 ATOM 2091 C CB . PHE A 1 288 ? 73.563 -40.034 18.502 1.00 50.04 ? 374 PHE A CB 1 ATOM 2092 C CG . PHE A 1 288 ? 74.824 -40.848 18.535 1.00 51.47 ? 374 PHE A CG 1 ATOM 2093 C CD1 . PHE A 1 288 ? 75.304 -41.449 17.384 1.00 48.03 ? 374 PHE A CD1 1 ATOM 2094 C CD2 . PHE A 1 288 ? 75.526 -41.029 19.722 1.00 49.75 ? 374 PHE A CD2 1 ATOM 2095 C CE1 . PHE A 1 288 ? 76.475 -42.216 17.404 1.00 42.63 ? 374 PHE A CE1 1 ATOM 2096 C CE2 . PHE A 1 288 ? 76.694 -41.789 19.749 1.00 51.39 ? 374 PHE A CE2 1 ATOM 2097 C CZ . PHE A 1 288 ? 77.170 -42.385 18.583 1.00 44.01 ? 374 PHE A CZ 1 ATOM 2098 N N . GLU A 1 289 ? 72.340 -42.917 19.896 1.00 57.55 ? 375 GLU A N 1 ATOM 2099 C CA . GLU A 1 289 ? 72.291 -43.711 21.123 1.00 48.82 ? 375 GLU A CA 1 ATOM 2100 C C . GLU A 1 289 ? 73.623 -44.433 21.352 1.00 50.69 ? 375 GLU A C 1 ATOM 2101 O O . GLU A 1 289 ? 74.351 -44.752 20.406 1.00 53.85 ? 375 GLU A O 1 ATOM 2102 C CB . GLU A 1 289 ? 71.115 -44.708 21.094 1.00 50.60 ? 375 GLU A CB 1 ATOM 2103 C CG . GLU A 1 289 ? 71.203 -45.799 20.015 1.00 51.31 ? 375 GLU A CG 1 ATOM 2104 C CD . GLU A 1 289 ? 69.871 -46.518 19.801 1.00 71.17 ? 375 GLU A CD 1 ATOM 2105 O OE1 . GLU A 1 289 ? 69.078 -46.576 20.771 1.00 63.38 ? 375 GLU A OE1 1 ATOM 2106 O OE2 . GLU A 1 289 ? 69.608 -47.013 18.669 1.00 80.99 ? 375 GLU A OE2 1 ATOM 2107 N N . ILE A 1 290 ? 73.956 -44.658 22.617 1.00 51.22 ? 376 ILE A N 1 ATOM 2108 C CA . ILE A 1 290 ? 75.140 -45.438 22.956 1.00 51.58 ? 376 ILE A CA 1 ATOM 2109 C C . ILE A 1 290 ? 74.830 -46.355 24.126 1.00 57.87 ? 376 ILE A C 1 ATOM 2110 O O . ILE A 1 290 ? 74.220 -45.960 25.133 1.00 59.65 ? 376 ILE A O 1 ATOM 2111 C CB . ILE A 1 290 ? 76.397 -44.567 23.220 1.00 42.69 ? 376 ILE A CB 1 ATOM 2112 C CG1 . ILE A 1 290 ? 77.646 -45.450 23.255 1.00 45.10 ? 376 ILE A CG1 1 ATOM 2113 C CG2 . ILE A 1 290 ? 76.233 -43.695 24.482 1.00 42.35 ? 376 ILE A CG2 1 ATOM 2114 C CD1 . ILE A 1 290 ? 78.924 -44.674 23.516 1.00 50.39 ? 376 ILE A CD1 1 ATOM 2115 N N . TYR A 1 291 ? 75.280 -47.589 23.977 1.00 61.48 ? 377 TYR A N 1 ATOM 2116 C CA . TYR A 1 291 ? 74.675 -48.705 24.660 1.00 59.60 ? 377 TYR A CA 1 ATOM 2117 C C . TYR A 1 291 ? 75.764 -49.557 25.324 1.00 64.45 ? 377 TYR A C 1 ATOM 2118 O O . TYR A 1 291 ? 76.652 -50.090 24.639 1.00 55.09 ? 377 TYR A O 1 ATOM 2119 C CB . TYR A 1 291 ? 73.887 -49.496 23.605 1.00 56.28 ? 377 TYR A CB 1 ATOM 2120 C CG . TYR A 1 291 ? 72.983 -50.570 24.132 1.00 65.44 ? 377 TYR A CG 1 ATOM 2121 C CD1 . TYR A 1 291 ? 72.694 -50.665 25.484 1.00 69.29 ? 377 TYR A CD1 1 ATOM 2122 C CD2 . TYR A 1 291 ? 72.427 -51.507 23.274 1.00 66.77 ? 377 TYR A CD2 1 ATOM 2123 C CE1 . TYR A 1 291 ? 71.868 -51.662 25.966 1.00 73.95 ? 377 TYR A CE1 1 ATOM 2124 C CE2 . TYR A 1 291 ? 71.605 -52.507 23.745 1.00 67.69 ? 377 TYR A CE2 1 ATOM 2125 C CZ . TYR A 1 291 ? 71.328 -52.580 25.092 1.00 69.34 ? 377 TYR A CZ 1 ATOM 2126 O OH . TYR A 1 291 ? 70.507 -53.574 25.562 1.00 68.71 ? 377 TYR A OH 1 ATOM 2127 N N . LYS A 1 292 ? 75.705 -49.670 26.653 1.00 60.74 ? 378 LYS A N 1 ATOM 2128 C CA . LYS A 1 292 ? 76.709 -50.432 27.384 1.00 53.64 ? 378 LYS A CA 1 ATOM 2129 C C . LYS A 1 292 ? 76.354 -51.905 27.410 1.00 52.80 ? 378 LYS A C 1 ATOM 2130 O O . LYS A 1 292 ? 75.185 -52.252 27.513 1.00 56.17 ? 378 LYS A O 1 ATOM 2131 C CB . LYS A 1 292 ? 76.881 -49.907 28.810 1.00 54.65 ? 378 LYS A CB 1 ATOM 2132 C CG . LYS A 1 292 ? 78.030 -50.560 29.573 1.00 56.25 ? 378 LYS A CG 1 ATOM 2133 C CD . LYS A 1 292 ? 78.290 -49.885 30.920 1.00 72.18 ? 378 LYS A CD 1 ATOM 2134 C CE . LYS A 1 292 ? 77.413 -50.420 32.052 1.00 70.67 ? 378 LYS A CE 1 ATOM 2135 N NZ . LYS A 1 292 ? 77.596 -49.563 33.256 1.00 66.40 ? 378 LYS A NZ 1 ATOM 2136 N N . PHE A 1 293 ? 77.377 -52.755 27.292 1.00 58.35 ? 379 PHE A N 1 ATOM 2137 C CA . PHE A 1 293 ? 77.246 -54.201 27.427 1.00 59.52 ? 379 PHE A CA 1 ATOM 2138 C C . PHE A 1 293 ? 78.193 -54.714 28.498 1.00 68.73 ? 379 PHE A C 1 ATOM 2139 O O . PHE A 1 293 ? 79.306 -54.193 28.654 1.00 72.12 ? 379 PHE A O 1 ATOM 2140 C CB . PHE A 1 293 ? 77.610 -54.891 26.120 1.00 60.49 ? 379 PHE A CB 1 ATOM 2141 C CG . PHE A 1 293 ? 76.646 -54.636 25.017 1.00 69.64 ? 379 PHE A CG 1 ATOM 2142 C CD1 . PHE A 1 293 ? 76.709 -53.455 24.285 1.00 61.30 ? 379 PHE A CD1 1 ATOM 2143 C CD2 . PHE A 1 293 ? 75.680 -55.584 24.693 1.00 68.90 ? 379 PHE A CD2 1 ATOM 2144 C CE1 . PHE A 1 293 ? 75.816 -53.223 23.253 1.00 62.39 ? 379 PHE A CE1 1 ATOM 2145 C CE2 . PHE A 1 293 ? 74.788 -55.355 23.664 1.00 69.83 ? 379 PHE A CE2 1 ATOM 2146 C CZ . PHE A 1 293 ? 74.860 -54.174 22.938 1.00 65.55 ? 379 PHE A CZ 1 ATOM 2147 N N . LEU A 1 294 ? 77.769 -55.750 29.219 1.00 65.85 ? 380 LEU A N 1 ATOM 2148 C CA . LEU A 1 294 ? 78.621 -56.323 30.255 1.00 62.37 ? 380 LEU A CA 1 ATOM 2149 C C . LEU A 1 294 ? 79.492 -57.434 29.678 1.00 63.03 ? 380 LEU A C 1 ATOM 2150 O O . LEU A 1 294 ? 79.125 -58.620 29.725 1.00 65.44 ? 380 LEU A O 1 ATOM 2151 C CB . LEU A 1 294 ? 77.781 -56.849 31.420 1.00 63.67 ? 380 LEU A CB 1 ATOM 2152 C CG . LEU A 1 294 ? 76.828 -55.835 32.050 1.00 65.35 ? 380 LEU A CG 1 ATOM 2153 C CD1 . LEU A 1 294 ? 75.924 -56.528 33.052 1.00 66.55 ? 380 LEU A CD1 1 ATOM 2154 C CD2 . LEU A 1 294 ? 77.592 -54.681 32.700 1.00 58.64 ? 380 LEU A CD2 1 ATOM 2155 N N . GLY A 1 295 ? 80.642 -57.045 29.127 1.00 53.66 ? 381 GLY A N 1 ATOM 2156 C CA . GLY A 1 295 ? 81.557 -57.995 28.518 1.00 57.47 ? 381 GLY A CA 1 ATOM 2157 C C . GLY A 1 295 ? 81.974 -57.671 27.089 1.00 68.80 ? 381 GLY A C 1 ATOM 2158 O O . GLY A 1 295 ? 81.731 -56.576 26.579 1.00 59.97 ? 381 GLY A O 1 ATOM 2159 N N . THR A 1 296 ? 82.610 -58.648 26.452 1.00 64.49 ? 382 THR A N 1 ATOM 2160 C CA . THR A 1 296 ? 83.229 -58.474 25.147 1.00 56.44 ? 382 THR A CA 1 ATOM 2161 C C . THR A 1 296 ? 82.183 -58.271 24.052 1.00 64.46 ? 382 THR A C 1 ATOM 2162 O O . THR A 1 296 ? 81.110 -58.881 24.086 1.00 61.12 ? 382 THR A O 1 ATOM 2163 C CB . THR A 1 296 ? 84.142 -59.705 24.795 1.00 58.22 ? 382 THR A CB 1 ATOM 2164 O OG1 . THR A 1 296 ? 84.841 -59.477 23.563 1.00 61.19 ? 382 THR A OG1 1 ATOM 2165 C CG2 . THR A 1 296 ? 83.330 -60.992 24.672 1.00 52.04 ? 382 THR A CG2 1 ATOM 2166 N N . LEU A 1 297 ? 82.497 -57.413 23.080 1.00 59.16 ? 383 LEU A N 1 ATOM 2167 C CA . LEU A 1 297 ? 81.665 -57.299 21.886 1.00 56.35 ? 383 LEU A CA 1 ATOM 2168 C C . LEU A 1 297 ? 81.653 -58.611 21.084 1.00 54.19 ? 383 LEU A C 1 ATOM 2169 O O . LEU A 1 297 ? 80.800 -58.796 20.221 1.00 56.92 ? 383 LEU A O 1 ATOM 2170 C CB . LEU A 1 297 ? 82.160 -56.159 20.993 1.00 53.46 ? 383 LEU A CB 1 ATOM 2171 C CG . LEU A 1 297 ? 82.083 -54.736 21.553 1.00 60.79 ? 383 LEU A CG 1 ATOM 2172 C CD1 . LEU A 1 297 ? 82.990 -53.786 20.770 1.00 49.67 ? 383 LEU A CD1 1 ATOM 2173 C CD2 . LEU A 1 297 ? 80.645 -54.207 21.574 1.00 51.68 ? 383 LEU A CD2 1 ATOM 2174 N N . PHE A 1 298 ? 82.588 -59.517 21.380 1.00 54.06 ? 384 PHE A N 1 ATOM 2175 C CA . PHE A 1 298 ? 82.810 -60.710 20.548 1.00 57.56 ? 384 PHE A CA 1 ATOM 2176 C C . PHE A 1 298 ? 82.430 -62.039 21.173 1.00 61.83 ? 384 PHE A C 1 ATOM 2177 O O . PHE A 1 298 ? 83.095 -63.049 20.963 1.00 72.73 ? 384 PHE A O 1 ATOM 2178 C CB . PHE A 1 298 ? 84.259 -60.742 20.106 1.00 49.92 ? 384 PHE A CB 1 ATOM 2179 C CG . PHE A 1 298 ? 84.761 -59.401 19.727 1.00 56.11 ? 384 PHE A CG 1 ATOM 2180 C CD1 . PHE A 1 298 ? 84.387 -58.823 18.515 1.00 60.43 ? 384 PHE A CD1 1 ATOM 2181 C CD2 . PHE A 1 298 ? 85.542 -58.679 20.601 1.00 58.06 ? 384 PHE A CD2 1 ATOM 2182 C CE1 . PHE A 1 298 ? 84.826 -57.560 18.173 1.00 49.95 ? 384 PHE A CE1 1 ATOM 2183 C CE2 . PHE A 1 298 ? 85.982 -57.418 20.269 1.00 60.60 ? 384 PHE A CE2 1 ATOM 2184 C CZ . PHE A 1 298 ? 85.626 -56.853 19.060 1.00 55.35 ? 384 PHE A CZ 1 ATOM 2185 N N . SER A 1 299 ? 81.354 -62.015 21.947 1.00 65.54 ? 385 SER A N 1 ATOM 2186 C CA . SER A 1 299 ? 80.704 -63.215 22.447 1.00 69.25 ? 385 SER A CA 1 ATOM 2187 C C . SER A 1 299 ? 79.195 -63.045 22.270 1.00 73.94 ? 385 SER A C 1 ATOM 2188 O O . SER A 1 299 ? 78.649 -61.957 22.510 1.00 76.46 ? 385 SER A O 1 ATOM 2189 C CB . SER A 1 299 ? 81.027 -63.438 23.927 1.00 69.52 ? 385 SER A CB 1 ATOM 2190 O OG . SER A 1 299 ? 80.396 -64.607 24.430 1.00 64.07 ? 385 SER A OG 1 ATOM 2191 N N . VAL A 1 300 ? 78.522 -64.106 21.836 1.00 69.63 ? 387 VAL A N 1 ATOM 2192 C CA . VAL A 1 300 ? 77.061 -64.097 21.777 1.00 80.62 ? 387 VAL A CA 1 ATOM 2193 C C . VAL A 1 300 ? 76.430 -63.934 23.178 1.00 84.46 ? 387 VAL A C 1 ATOM 2194 O O . VAL A 1 300 ? 75.420 -63.249 23.355 1.00 76.54 ? 387 VAL A O 1 ATOM 2195 C CB . VAL A 1 300 ? 76.544 -65.358 21.063 1.00 81.49 ? 387 VAL A CB 1 ATOM 2196 C CG1 . VAL A 1 300 ? 75.065 -65.541 21.320 1.00 101.33 ? 387 VAL A CG1 1 ATOM 2197 C CG2 . VAL A 1 300 ? 76.805 -65.243 19.578 1.00 77.71 ? 387 VAL A CG2 1 ATOM 2198 N N . GLN A 1 301 ? 77.075 -64.532 24.171 1.00 87.42 ? 388 GLN A N 1 ATOM 2199 C CA . GLN A 1 301 ? 76.569 -64.532 25.531 1.00 90.30 ? 388 GLN A CA 1 ATOM 2200 C C . GLN A 1 301 ? 76.503 -63.172 26.225 1.00 84.05 ? 388 GLN A C 1 ATOM 2201 O O . GLN A 1 301 ? 75.820 -63.058 27.237 1.00 89.19 ? 388 GLN A O 1 ATOM 2202 C CB . GLN A 1 301 ? 77.393 -65.479 26.405 1.00 92.86 ? 388 GLN A CB 1 ATOM 2203 C CG . GLN A 1 301 ? 77.515 -66.889 25.874 1.00 90.21 ? 388 GLN A CG 1 ATOM 2204 C CD . GLN A 1 301 ? 78.474 -67.712 26.710 1.00 115.36 ? 388 GLN A CD 1 ATOM 2205 O OE1 . GLN A 1 301 ? 79.029 -67.229 27.706 1.00 120.10 ? 388 GLN A OE1 1 ATOM 2206 N NE2 . GLN A 1 301 ? 78.677 -68.961 26.314 1.00 123.77 ? 388 GLN A NE2 1 ATOM 2207 N N . THR A 1 302 ? 77.202 -62.149 25.729 1.00 76.31 ? 390 THR A N 1 ATOM 2208 C CA . THR A 1 302 ? 77.188 -60.848 26.433 1.00 72.44 ? 390 THR A CA 1 ATOM 2209 C C . THR A 1 302 ? 75.858 -60.105 26.235 1.00 67.99 ? 390 THR A C 1 ATOM 2210 O O . THR A 1 302 ? 75.206 -60.258 25.194 1.00 71.94 ? 390 THR A O 1 ATOM 2211 C CB . THR A 1 302 ? 78.405 -59.946 26.091 1.00 64.85 ? 390 THR A CB 1 ATOM 2212 O OG1 . THR A 1 302 ? 78.157 -59.237 24.878 1.00 87.62 ? 390 THR A OG1 1 ATOM 2213 C CG2 . THR A 1 302 ? 79.682 -60.779 25.965 1.00 57.47 ? 390 THR A CG2 1 ATOM 2214 N N . VAL A 1 303 ? 75.472 -59.297 27.226 1.00 73.86 ? 391 VAL A N 1 ATOM 2215 C CA . VAL A 1 303 ? 74.049 -58.983 27.433 1.00 76.32 ? 391 VAL A CA 1 ATOM 2216 C C . VAL A 1 303 ? 73.514 -57.587 27.143 1.00 77.85 ? 391 VAL A C 1 ATOM 2217 O O . VAL A 1 303 ? 72.485 -57.448 26.463 1.00 96.60 ? 391 VAL A O 1 ATOM 2218 C CB . VAL A 1 303 ? 73.574 -59.382 28.842 1.00 70.27 ? 391 VAL A CB 1 ATOM 2219 C CG1 . VAL A 1 303 ? 72.912 -60.734 28.795 1.00 57.68 ? 391 VAL A CG1 1 ATOM 2220 C CG2 . VAL A 1 303 ? 74.743 -59.360 29.835 1.00 81.45 ? 391 VAL A CG2 1 ATOM 2221 N N . GLY A 1 304 ? 74.160 -56.555 27.672 1.00 48.14 ? 392 GLY A N 1 ATOM 2222 C CA . GLY A 1 304 ? 73.601 -55.223 27.484 1.00 64.33 ? 392 GLY A CA 1 ATOM 2223 C C . GLY A 1 304 ? 72.908 -54.750 28.748 1.00 68.87 ? 392 GLY A C 1 ATOM 2224 O O . GLY A 1 304 ? 72.029 -55.414 29.294 1.00 74.76 ? 392 GLY A O 1 ATOM 2225 N N . ASN A 1 305 A 73.321 -53.583 29.210 1.00 58.46 ? 392 ASN A N 1 ATOM 2226 C CA . ASN A 1 305 A 73.069 -53.161 30.568 1.00 59.59 ? 392 ASN A CA 1 ATOM 2227 C C . ASN A 1 305 A 72.360 -51.824 30.609 1.00 58.75 ? 392 ASN A C 1 ATOM 2228 O O . ASN A 1 305 A 71.520 -51.598 31.477 1.00 61.29 ? 392 ASN A O 1 ATOM 2229 C CB . ASN A 1 305 A 74.412 -53.060 31.322 1.00 74.95 ? 392 ASN A CB 1 ATOM 2230 C CG . ASN A 1 305 A 74.239 -52.725 32.783 1.00 76.97 ? 392 ASN A CG 1 ATOM 2231 O OD1 . ASN A 1 305 A 74.679 -51.667 33.247 1.00 77.49 ? 392 ASN A OD1 1 ATOM 2232 N ND2 . ASN A 1 305 A 73.585 -53.628 33.522 1.00 80.47 ? 392 ASN A ND2 1 ATOM 2233 N N . ARG A 1 306 ? 72.703 -50.939 29.674 1.00 53.54 ? 393 ARG A N 1 ATOM 2234 C CA . ARG A 1 306 ? 72.145 -49.595 29.664 1.00 60.34 ? 393 ARG A CA 1 ATOM 2235 C C . ARG A 1 306 ? 72.305 -48.873 28.345 1.00 68.12 ? 393 ARG A C 1 ATOM 2236 O O . ARG A 1 306 ? 73.407 -48.795 27.787 1.00 66.81 ? 393 ARG A O 1 ATOM 2237 C CB . ARG A 1 306 ? 72.788 -48.739 30.752 1.00 73.31 ? 393 ARG A CB 1 ATOM 2238 C CG . ARG A 1 306 ? 71.831 -48.355 31.842 1.00 78.37 ? 393 ARG A CG 1 ATOM 2239 C CD . ARG A 1 306 ? 72.060 -46.935 32.254 1.00 69.19 ? 393 ARG A CD 1 ATOM 2240 N NE . ARG A 1 306 ? 71.021 -46.057 31.735 1.00 77.02 ? 393 ARG A NE 1 ATOM 2241 C CZ . ARG A 1 306 ? 70.607 -44.953 32.350 1.00 77.81 ? 393 ARG A CZ 1 ATOM 2242 N NH1 . ARG A 1 306 ? 71.144 -44.590 33.517 1.00 56.70 ? 393 ARG A NH1 1 ATOM 2243 N NH2 . ARG A 1 306 ? 69.659 -44.216 31.788 1.00 69.90 ? 393 ARG A NH2 1 ATOM 2244 N N . ASN A 1 307 ? 71.203 -48.304 27.871 1.00 70.85 ? 394 ASN A N 1 ATOM 2245 C CA . ASN A 1 307 ? 71.233 -47.580 26.612 1.00 61.52 ? 394 ASN A CA 1 ATOM 2246 C C . ASN A 1 307 ? 70.886 -46.095 26.760 1.00 61.03 ? 394 ASN A C 1 ATOM 2247 O O . ASN A 1 307 ? 69.732 -45.739 27.025 1.00 64.41 ? 394 ASN A O 1 ATOM 2248 C CB . ASN A 1 307 ? 70.311 -48.260 25.591 1.00 53.24 ? 394 ASN A CB 1 ATOM 2249 C CG . ASN A 1 307 ? 70.371 -47.603 24.219 1.00 61.82 ? 394 ASN A CG 1 ATOM 2250 O OD1 . ASN A 1 307 ? 71.409 -47.080 23.804 1.00 59.30 ? 394 ASN A OD1 1 ATOM 2251 N ND2 . ASN A 1 307 ? 69.253 -47.621 23.514 1.00 62.41 ? 394 ASN A ND2 1 ATOM 2252 N N . TYR A 1 308 ? 71.888 -45.239 26.569 1.00 51.90 ? 395 TYR A N 1 ATOM 2253 C CA . TYR A 1 308 ? 71.694 -43.791 26.624 1.00 52.66 ? 395 TYR A CA 1 ATOM 2254 C C . TYR A 1 308 ? 71.335 -43.173 25.270 1.00 66.02 ? 395 TYR A C 1 ATOM 2255 O O . TYR A 1 308 ? 72.139 -43.208 24.333 1.00 64.11 ? 395 TYR A O 1 ATOM 2256 C CB . TYR A 1 308 ? 72.960 -43.110 27.154 1.00 57.15 ? 395 TYR A CB 1 ATOM 2257 C CG . TYR A 1 308 ? 73.329 -43.438 28.592 1.00 53.14 ? 395 TYR A CG 1 ATOM 2258 C CD1 . TYR A 1 308 ? 72.784 -42.723 29.648 1.00 56.11 ? 395 TYR A CD1 1 ATOM 2259 C CD2 . TYR A 1 308 ? 74.251 -44.437 28.887 1.00 55.95 ? 395 TYR A CD2 1 ATOM 2260 C CE1 . TYR A 1 308 ? 73.133 -43.002 30.960 1.00 57.65 ? 395 TYR A CE1 1 ATOM 2261 C CE2 . TYR A 1 308 ? 74.609 -44.722 30.187 1.00 50.21 ? 395 TYR A CE2 1 ATOM 2262 C CZ . TYR A 1 308 ? 74.046 -44.002 31.222 1.00 57.85 ? 395 TYR A CZ 1 ATOM 2263 O OH . TYR A 1 308 ? 74.394 -44.279 32.528 1.00 71.61 ? 395 TYR A OH 1 ATOM 2264 N N . GLN A 1 309 ? 70.131 -42.605 25.176 1.00 71.67 ? 396 GLN A N 1 ATOM 2265 C CA . GLN A 1 309 ? 69.725 -41.779 24.029 1.00 55.56 ? 396 GLN A CA 1 ATOM 2266 C C . GLN A 1 309 ? 70.310 -40.368 24.208 1.00 55.81 ? 396 GLN A C 1 ATOM 2267 O O . GLN A 1 309 ? 69.659 -39.500 24.788 1.00 62.91 ? 396 GLN A O 1 ATOM 2268 C CB . GLN A 1 309 ? 68.191 -41.673 23.970 1.00 53.26 ? 396 GLN A CB 1 ATOM 2269 C CG . GLN A 1 309 ? 67.496 -42.249 22.731 1.00 77.63 ? 396 GLN A CG 1 ATOM 2270 C CD . GLN A 1 309 ? 67.076 -43.707 22.895 1.00 94.46 ? 396 GLN A CD 1 ATOM 2271 O OE1 . GLN A 1 309 ? 67.194 -44.277 23.981 1.00 107.21 ? 396 GLN A OE1 1 ATOM 2272 N NE2 . GLN A 1 309 ? 66.588 -44.318 21.808 1.00 83.48 ? 396 GLN A NE2 1 ATOM 2273 N N . LEU A 1 310 ? 71.526 -40.125 23.721 1.00 55.02 ? 397 LEU A N 1 ATOM 2274 C CA . LEU A 1 310 ? 72.175 -38.825 23.917 1.00 44.80 ? 397 LEU A CA 1 ATOM 2275 C C . LEU A 1 310 ? 71.584 -37.689 23.075 1.00 48.44 ? 397 LEU A C 1 ATOM 2276 O O . LEU A 1 310 ? 71.541 -36.541 23.521 1.00 56.40 ? 397 LEU A O 1 ATOM 2277 C CB . LEU A 1 310 ? 73.674 -38.931 23.661 1.00 48.54 ? 397 LEU A CB 1 ATOM 2278 C CG . LEU A 1 310 ? 74.458 -39.840 24.594 1.00 50.86 ? 397 LEU A CG 1 ATOM 2279 C CD1 . LEU A 1 310 ? 75.856 -40.025 24.028 1.00 59.95 ? 397 LEU A CD1 1 ATOM 2280 C CD2 . LEU A 1 310 ? 74.518 -39.239 25.988 1.00 44.00 ? 397 LEU A CD2 1 ATOM 2281 N N . LEU A 1 311 ? 71.168 -38.004 21.848 1.00 56.26 ? 398 LEU A N 1 ATOM 2282 C CA . LEU A 1 311 ? 70.489 -37.030 20.986 1.00 53.88 ? 398 LEU A CA 1 ATOM 2283 C C . LEU A 1 311 ? 69.234 -37.661 20.414 1.00 58.50 ? 398 LEU A C 1 ATOM 2284 O O . LEU A 1 311 ? 69.213 -38.855 20.119 1.00 68.98 ? 398 LEU A O 1 ATOM 2285 C CB . LEU A 1 311 ? 71.380 -36.558 19.835 1.00 52.76 ? 398 LEU A CB 1 ATOM 2286 C CG . LEU A 1 311 ? 72.568 -35.613 20.051 1.00 53.19 ? 398 LEU A CG 1 ATOM 2287 C CD1 . LEU A 1 311 ? 72.224 -34.513 21.011 1.00 56.20 ? 398 LEU A CD1 1 ATOM 2288 C CD2 . LEU A 1 311 ? 73.778 -36.376 20.532 1.00 59.51 ? 398 LEU A CD2 1 ATOM 2289 N N . SER A 1 312 ? 68.189 -36.862 20.246 1.00 58.49 ? 399 SER A N 1 ATOM 2290 C CA . SER A 1 312 ? 66.932 -37.373 19.718 1.00 62.13 ? 399 SER A CA 1 ATOM 2291 C C . SER A 1 312 ? 66.504 -36.609 18.473 1.00 62.46 ? 399 SER A C 1 ATOM 2292 O O . SER A 1 312 ? 65.820 -37.155 17.610 1.00 71.46 ? 399 SER A O 1 ATOM 2293 C CB . SER A 1 312 ? 65.838 -37.232 20.768 1.00 56.69 ? 399 SER A CB 1 ATOM 2294 O OG . SER A 1 312 ? 65.635 -35.858 21.063 1.00 76.39 ? 399 SER A OG 1 ATOM 2295 N N . ASN A 1 313 ? 66.897 -35.341 18.392 1.00 55.43 ? 401 ASN A N 1 ATOM 2296 C CA . ASN A 1 313 ? 66.310 -34.442 17.409 1.00 65.85 ? 401 ASN A CA 1 ATOM 2297 C C . ASN A 1 313 ? 67.273 -33.940 16.340 1.00 68.76 ? 401 ASN A C 1 ATOM 2298 O O . ASN A 1 313 ? 66.846 -33.435 15.302 1.00 81.93 ? 401 ASN A O 1 ATOM 2299 C CB . ASN A 1 313 ? 65.578 -33.274 18.099 1.00 79.77 ? 401 ASN A CB 1 ATOM 2300 C CG . ASN A 1 313 ? 64.059 -33.353 17.929 1.00 104.67 ? 401 ASN A CG 1 ATOM 2301 O OD1 . ASN A 1 313 ? 63.407 -34.279 18.434 1.00 107.74 ? 401 ASN A OD1 1 ATOM 2302 N ND2 . ASN A 1 313 ? 63.492 -32.378 17.217 1.00 108.76 ? 401 ASN A ND2 1 ATOM 2303 N N . SER A 1 314 ? 68.570 -34.099 16.573 1.00 63.52 ? 402 SER A N 1 ATOM 2304 C CA . SER A 1 314 ? 69.571 -33.641 15.606 1.00 53.57 ? 402 SER A CA 1 ATOM 2305 C C . SER A 1 314 ? 69.780 -34.675 14.495 1.00 60.35 ? 402 SER A C 1 ATOM 2306 O O . SER A 1 314 ? 69.531 -35.865 14.696 1.00 52.94 ? 402 SER A O 1 ATOM 2307 C CB . SER A 1 314 ? 70.895 -33.353 16.317 1.00 63.50 ? 402 SER A CB 1 ATOM 2308 O OG . SER A 1 314 ? 70.880 -32.088 16.974 1.00 63.25 ? 402 SER A OG 1 ATOM 2309 N N . THR A 1 315 ? 70.216 -34.258 13.308 1.00 67.47 ? 403 THR A N 1 ATOM 2310 C CA . THR A 1 315 ? 70.568 -35.303 12.352 1.00 62.16 ? 403 THR A CA 1 ATOM 2311 C C . THR A 1 315 ? 72.072 -35.580 12.386 1.00 58.70 ? 403 THR A C 1 ATOM 2312 O O . THR A 1 315 ? 72.896 -34.664 12.439 1.00 57.64 ? 403 THR A O 1 ATOM 2313 C CB . THR A 1 315 ? 69.977 -35.130 10.911 1.00 59.41 ? 403 THR A CB 1 ATOM 2314 O OG1 . THR A 1 315 ? 70.872 -34.388 10.090 1.00 57.26 ? 403 THR A OG1 1 ATOM 2315 C CG2 . THR A 1 315 ? 68.636 -34.442 10.946 1.00 47.46 ? 403 THR A CG2 1 ATOM 2316 N N . ILE A 1 316 ? 72.406 -36.865 12.369 1.00 64.43 ? 404 ILE A N 1 ATOM 2317 C CA . ILE A 1 316 ? 73.734 -37.314 12.740 1.00 56.23 ? 404 ILE A CA 1 ATOM 2318 C C . ILE A 1 316 ? 74.519 -37.791 11.532 1.00 52.48 ? 404 ILE A C 1 ATOM 2319 O O . ILE A 1 316 ? 73.987 -38.501 10.684 1.00 56.37 ? 404 ILE A O 1 ATOM 2320 C CB . ILE A 1 316 ? 73.671 -38.436 13.808 1.00 55.17 ? 404 ILE A CB 1 ATOM 2321 C CG1 . ILE A 1 316 ? 73.354 -37.859 15.181 1.00 51.44 ? 404 ILE A CG1 1 ATOM 2322 C CG2 . ILE A 1 316 ? 75.008 -39.136 13.943 1.00 60.02 ? 404 ILE A CG2 1 ATOM 2323 C CD1 . ILE A 1 316 ? 71.976 -37.454 15.366 1.00 61.18 ? 404 ILE A CD1 1 ATOM 2324 N N . GLY A 1 317 ? 75.783 -37.372 11.455 1.00 55.34 ? 405 GLY A N 1 ATOM 2325 C CA . GLY A 1 317 ? 76.715 -37.883 10.462 1.00 40.21 ? 405 GLY A CA 1 ATOM 2326 C C . GLY A 1 317 ? 77.736 -38.849 11.053 1.00 52.23 ? 405 GLY A C 1 ATOM 2327 O O . GLY A 1 317 ? 77.387 -39.899 11.611 1.00 45.89 ? 405 GLY A O 1 ATOM 2328 N N . ARG A 1 318 ? 79.007 -38.490 10.937 1.00 51.39 ? 406 ARG A N 1 ATOM 2329 C CA . ARG A 1 318 ? 80.068 -39.369 11.377 1.00 51.19 ? 406 ARG A CA 1 ATOM 2330 C C . ARG A 1 318 ? 80.307 -39.225 12.881 1.00 50.88 ? 406 ARG A C 1 ATOM 2331 O O . ARG A 1 318 ? 79.890 -38.238 13.499 1.00 52.56 ? 406 ARG A O 1 ATOM 2332 C CB . ARG A 1 318 ? 81.354 -39.037 10.626 1.00 56.45 ? 406 ARG A CB 1 ATOM 2333 C CG . ARG A 1 318 ? 81.206 -38.895 9.096 1.00 48.78 ? 406 ARG A CG 1 ATOM 2334 C CD . ARG A 1 318 ? 82.563 -38.505 8.475 1.00 31.33 ? 406 ARG A CD 1 ATOM 2335 N NE . ARG A 1 318 ? 83.051 -37.298 9.132 1.00 56.39 ? 406 ARG A NE 1 ATOM 2336 C CZ . ARG A 1 318 ? 84.236 -37.165 9.710 1.00 52.20 ? 406 ARG A CZ 1 ATOM 2337 N NH1 . ARG A 1 318 ? 85.125 -38.147 9.692 1.00 55.13 ? 406 ARG A NH1 1 ATOM 2338 N NH2 . ARG A 1 318 ? 84.523 -36.029 10.302 1.00 54.03 ? 406 ARG A NH2 1 ATOM 2339 N N . SER A 1 319 ? 80.983 -40.212 13.464 1.00 40.04 ? 407 SER A N 1 ATOM 2340 C CA . SER A 1 319 ? 81.382 -40.134 14.863 1.00 46.42 ? 407 SER A CA 1 ATOM 2341 C C . SER A 1 319 ? 82.661 -40.937 15.065 1.00 49.02 ? 407 SER A C 1 ATOM 2342 O O . SER A 1 319 ? 82.932 -41.872 14.302 1.00 45.15 ? 407 SER A O 1 ATOM 2343 C CB . SER A 1 319 ? 80.268 -40.639 15.783 1.00 42.41 ? 407 SER A CB 1 ATOM 2344 O OG . SER A 1 319 ? 79.931 -41.986 15.475 1.00 38.92 ? 407 SER A OG 1 ATOM 2345 N N . GLY A 1 320 ? 83.447 -40.571 16.081 1.00 41.95 ? 408 GLY A N 1 ATOM 2346 C CA . GLY A 1 320 ? 84.771 -41.152 16.258 1.00 38.41 ? 408 GLY A CA 1 ATOM 2347 C C . GLY A 1 320 ? 85.376 -40.958 17.640 1.00 57.05 ? 408 GLY A C 1 ATOM 2348 O O . GLY A 1 320 ? 84.950 -40.085 18.392 1.00 55.00 ? 408 GLY A O 1 ATOM 2349 N N . LEU A 1 321 ? 86.383 -41.771 17.956 1.00 50.27 ? 409 LEU A N 1 ATOM 2350 C CA . LEU A 1 321 ? 87.018 -41.777 19.268 1.00 46.22 ? 409 LEU A CA 1 ATOM 2351 C C . LEU A 1 321 ? 88.214 -40.846 19.395 1.00 53.26 ? 409 LEU A C 1 ATOM 2352 O O . LEU A 1 321 ? 88.963 -40.625 18.431 1.00 55.46 ? 409 LEU A O 1 ATOM 2353 C CB . LEU A 1 321 ? 87.543 -43.171 19.581 1.00 51.35 ? 409 LEU A CB 1 ATOM 2354 C CG . LEU A 1 321 ? 86.655 -44.201 20.261 1.00 60.19 ? 409 LEU A CG 1 ATOM 2355 C CD1 . LEU A 1 321 ? 85.311 -43.599 20.683 1.00 41.05 ? 409 LEU A CD1 1 ATOM 2356 C CD2 . LEU A 1 321 ? 86.513 -45.394 19.323 1.00 51.66 ? 409 LEU A CD2 1 ATOM 2357 N N . TYR A 1 322 ? 88.432 -40.349 20.612 1.00 52.71 ? 410 TYR A N 1 ATOM 2358 C CA . TYR A 1 322 ? 89.679 -39.661 20.911 1.00 44.22 ? 410 TYR A CA 1 ATOM 2359 C C . TYR A 1 322 ? 90.129 -39.793 22.368 1.00 41.08 ? 410 TYR A C 1 ATOM 2360 O O . TYR A 1 322 ? 89.306 -39.926 23.278 1.00 53.24 ? 410 TYR A O 1 ATOM 2361 C CB . TYR A 1 322 ? 89.615 -38.213 20.443 1.00 40.86 ? 410 TYR A CB 1 ATOM 2362 C CG . TYR A 1 322 ? 88.769 -37.274 21.266 1.00 48.57 ? 410 TYR A CG 1 ATOM 2363 C CD1 . TYR A 1 322 ? 87.425 -37.079 20.964 1.00 54.35 ? 410 TYR A CD1 1 ATOM 2364 C CD2 . TYR A 1 322 ? 89.329 -36.531 22.311 1.00 36.95 ? 410 TYR A CD2 1 ATOM 2365 C CE1 . TYR A 1 322 ? 86.640 -36.185 21.694 1.00 51.46 ? 410 TYR A CE1 1 ATOM 2366 C CE2 . TYR A 1 322 ? 88.557 -35.626 23.042 1.00 46.85 ? 410 TYR A CE2 1 ATOM 2367 C CZ . TYR A 1 322 ? 87.212 -35.458 22.723 1.00 57.87 ? 410 TYR A CZ 1 ATOM 2368 O OH . TYR A 1 322 ? 86.437 -34.571 23.434 1.00 55.93 ? 410 TYR A OH 1 ATOM 2369 N N . GLN A 1 323 ? 91.440 -39.788 22.584 1.00 42.75 ? 411 GLN A N 1 ATOM 2370 C CA . GLN A 1 323 ? 91.974 -39.924 23.949 1.00 48.95 ? 411 GLN A CA 1 ATOM 2371 C C . GLN A 1 323 ? 92.748 -38.703 24.405 1.00 50.12 ? 411 GLN A C 1 ATOM 2372 O O . GLN A 1 323 ? 93.845 -38.443 23.898 1.00 58.45 ? 411 GLN A O 1 ATOM 2373 C CB . GLN A 1 323 ? 92.875 -41.162 24.074 1.00 31.02 ? 411 GLN A CB 1 ATOM 2374 C CG . GLN A 1 323 ? 92.093 -42.459 24.184 1.00 51.38 ? 411 GLN A CG 1 ATOM 2375 C CD . GLN A 1 323 ? 92.948 -43.690 23.986 1.00 54.50 ? 411 GLN A CD 1 ATOM 2376 O OE1 . GLN A 1 323 ? 93.706 -43.793 23.020 1.00 61.68 ? 411 GLN A OE1 1 ATOM 2377 N NE2 . GLN A 1 323 ? 92.819 -44.642 24.900 1.00 54.48 ? 411 GLN A NE2 1 ATOM 2378 N N . PRO A 1 324 ? 92.192 -37.954 25.376 1.00 56.62 ? 412 PRO A N 1 ATOM 2379 C CA . PRO A 1 324 ? 92.994 -36.884 25.989 1.00 55.06 ? 412 PRO A CA 1 ATOM 2380 C C . PRO A 1 324 ? 94.209 -37.554 26.646 1.00 57.61 ? 412 PRO A C 1 ATOM 2381 O O . PRO A 1 324 ? 94.137 -38.706 27.074 1.00 62.95 ? 412 PRO A O 1 ATOM 2382 C CB . PRO A 1 324 ? 92.049 -36.286 27.032 1.00 53.36 ? 412 PRO A CB 1 ATOM 2383 C CG . PRO A 1 324 ? 90.679 -36.801 26.655 1.00 49.90 ? 412 PRO A CG 1 ATOM 2384 C CD . PRO A 1 324 ? 90.923 -38.160 26.090 1.00 56.08 ? 412 PRO A CD 1 ATOM 2385 N N . ALA A 1 325 ? 95.342 -36.882 26.664 1.00 68.13 ? 413 ALA A N 1 ATOM 2386 C CA . ALA A 1 325 ? 96.572 -37.620 26.870 1.00 84.20 ? 413 ALA A CA 1 ATOM 2387 C C . ALA A 1 325 ? 97.507 -36.908 27.813 1.00 87.55 ? 413 ALA A C 1 ATOM 2388 O O . ALA A 1 325 ? 98.507 -37.479 28.257 1.00 110.40 ? 413 ALA A O 1 ATOM 2389 C CB . ALA A 1 325 ? 97.249 -37.866 25.529 1.00 103.08 ? 413 ALA A CB 1 ATOM 2390 N N . TYR A 1 326 A 97.184 -35.656 28.114 1.00 67.71 ? 413 TYR A N 1 ATOM 2391 C CA . TYR A 1 326 A 98.052 -34.820 28.940 1.00 101.16 ? 413 TYR A CA 1 ATOM 2392 C C . TYR A 1 326 A 97.793 -35.142 30.419 1.00 121.00 ? 413 TYR A C 1 ATOM 2393 O O . TYR A 1 326 A 96.960 -34.525 31.089 1.00 122.05 ? 413 TYR A O 1 ATOM 2394 C CB . TYR A 1 326 A 97.894 -33.337 28.589 1.00 114.15 ? 413 TYR A CB 1 ATOM 2395 C CG . TYR A 1 326 A 96.490 -32.870 28.241 1.00 117.83 ? 413 TYR A CG 1 ATOM 2396 C CD1 . TYR A 1 326 A 95.868 -33.237 27.044 1.00 108.44 ? 413 TYR A CD1 1 ATOM 2397 C CD2 . TYR A 1 326 A 95.790 -32.044 29.110 1.00 121.06 ? 413 TYR A CD2 1 ATOM 2398 C CE1 . TYR A 1 326 A 94.583 -32.804 26.740 1.00 103.83 ? 413 TYR A CE1 1 ATOM 2399 C CE2 . TYR A 1 326 A 94.512 -31.604 28.812 1.00 116.96 ? 413 TYR A CE2 1 ATOM 2400 C CZ . TYR A 1 326 A 93.916 -31.984 27.632 1.00 110.91 ? 413 TYR A CZ 1 ATOM 2401 O OH . TYR A 1 326 A 92.648 -31.537 27.360 1.00 106.40 ? 413 TYR A OH 1 ATOM 2402 N N . GLU A 1 327 ? 98.560 -36.113 30.907 1.00 130.45 ? 414 GLU A N 1 ATOM 2403 C CA . GLU A 1 327 ? 98.144 -36.989 31.986 1.00 126.40 ? 414 GLU A CA 1 ATOM 2404 C C . GLU A 1 327 ? 99.372 -37.759 32.434 1.00 135.64 ? 414 GLU A C 1 ATOM 2405 O O . GLU A 1 327 ? 100.297 -37.961 31.644 1.00 147.74 ? 414 GLU A O 1 ATOM 2406 C CB . GLU A 1 327 ? 97.070 -37.940 31.421 1.00 123.23 ? 414 GLU A CB 1 ATOM 2407 C CG . GLU A 1 327 ? 96.886 -39.307 32.106 1.00 128.64 ? 414 GLU A CG 1 ATOM 2408 C CD . GLU A 1 327 ? 97.685 -40.440 31.459 1.00 122.62 ? 414 GLU A CD 1 ATOM 2409 O OE1 . GLU A 1 327 ? 98.548 -40.141 30.609 1.00 130.56 ? 414 GLU A OE1 1 ATOM 2410 O OE2 . GLU A 1 327 ? 97.463 -41.627 31.805 1.00 99.13 ? 414 GLU A OE2 1 ATOM 2411 N N . SER A 1 328 ? 99.405 -38.142 33.704 1.00 119.24 ? 415 SER A N 1 ATOM 2412 C CA . SER A 1 328 ? 100.280 -39.219 34.142 1.00 106.30 ? 415 SER A CA 1 ATOM 2413 C C . SER A 1 328 ? 99.438 -40.050 35.091 1.00 107.87 ? 415 SER A C 1 ATOM 2414 O O . SER A 1 328 ? 99.933 -40.912 35.827 1.00 113.66 ? 415 SER A O 1 ATOM 2415 C CB . SER A 1 328 ? 101.544 -38.679 34.793 1.00 103.10 ? 415 SER A CB 1 ATOM 2416 O OG . SER A 1 328 ? 102.351 -38.026 33.826 1.00 106.25 ? 415 SER A OG 1 ATOM 2417 N N . ARG A 1 329 A 98.135 -39.774 35.004 1.00 96.19 ? 415 ARG A N 1 ATOM 2418 C CA . ARG A 1 329 A 97.083 -40.293 35.883 1.00 85.51 ? 415 ARG A CA 1 ATOM 2419 C C . ARG A 1 329 A 96.974 -41.819 35.938 1.00 89.28 ? 415 ARG A C 1 ATOM 2420 O O . ARG A 1 329 A 97.643 -42.541 35.180 1.00 100.16 ? 415 ARG A O 1 ATOM 2421 C CB . ARG A 1 329 A 95.731 -39.693 35.488 1.00 76.67 ? 415 ARG A CB 1 ATOM 2422 C CG . ARG A 1 329 A 95.778 -38.187 35.254 1.00 86.44 ? 415 ARG A CG 1 ATOM 2423 C CD . ARG A 1 329 A 94.435 -37.647 34.749 1.00 78.31 ? 415 ARG A CD 1 ATOM 2424 N NE . ARG A 1 329 A 93.358 -37.903 35.707 1.00 86.04 ? 415 ARG A NE 1 ATOM 2425 C CZ . ARG A 1 329 A 93.216 -37.258 36.868 1.00 76.95 ? 415 ARG A CZ 1 ATOM 2426 N NH1 . ARG A 1 329 A 94.084 -36.307 37.227 1.00 67.11 ? 415 ARG A NH1 1 ATOM 2427 N NH2 . ARG A 1 329 A 92.205 -37.563 37.678 1.00 60.03 ? 415 ARG A NH2 1 ATOM 2428 N N . ASP A 1 330 ? 96.104 -42.290 36.835 1.00 73.57 ? 416 ASP A N 1 ATOM 2429 C CA . ASP A 1 330 ? 96.009 -43.705 37.175 1.00 77.38 ? 416 ASP A CA 1 ATOM 2430 C C . ASP A 1 330 ? 95.081 -44.489 36.258 1.00 74.05 ? 416 ASP A C 1 ATOM 2431 O O . ASP A 1 330 ? 94.840 -45.682 36.458 1.00 82.33 ? 416 ASP A O 1 ATOM 2432 C CB . ASP A 1 330 ? 95.533 -43.845 38.624 1.00 100.45 ? 416 ASP A CB 1 ATOM 2433 C CG . ASP A 1 330 ? 96.586 -43.404 39.625 1.00 122.03 ? 416 ASP A CG 1 ATOM 2434 O OD1 . ASP A 1 330 ? 96.900 -42.197 39.670 1.00 122.70 ? 416 ASP A OD1 1 ATOM 2435 O OD2 . ASP A 1 330 ? 97.118 -44.265 40.358 1.00 128.69 ? 416 ASP A OD2 1 ATOM 2436 N N . CYS A 1 331 ? 94.593 -43.823 35.225 1.00 68.67 ? 417 CYS A N 1 ATOM 2437 C CA . CYS A 1 331 ? 93.443 -44.313 34.490 1.00 62.85 ? 417 CYS A CA 1 ATOM 2438 C C . CYS A 1 331 ? 93.336 -43.471 33.205 1.00 61.63 ? 417 CYS A C 1 ATOM 2439 O O . CYS A 1 331 ? 93.441 -42.247 33.256 1.00 62.17 ? 417 CYS A O 1 ATOM 2440 C CB . CYS A 1 331 ? 92.236 -44.187 35.435 1.00 42.58 ? 417 CYS A CB 1 ATOM 2441 S SG . CYS A 1 331 ? 90.622 -44.206 34.759 1.00 95.47 ? 417 CYS A SG 1 ATOM 2442 N N . GLN A 1 332 ? 93.190 -44.125 32.053 1.00 59.90 ? 418 GLN A N 1 ATOM 2443 C CA . GLN A 1 332 ? 93.208 -43.409 30.768 1.00 51.62 ? 418 GLN A CA 1 ATOM 2444 C C . GLN A 1 332 ? 91.785 -43.076 30.328 1.00 53.99 ? 418 GLN A C 1 ATOM 2445 O O . GLN A 1 332 ? 90.921 -43.958 30.252 1.00 59.01 ? 418 GLN A O 1 ATOM 2446 C CB . GLN A 1 332 ? 93.942 -44.200 29.674 1.00 36.88 ? 418 GLN A CB 1 ATOM 2447 C CG . GLN A 1 332 ? 93.729 -43.656 28.279 1.00 45.68 ? 418 GLN A CG 1 ATOM 2448 C CD . GLN A 1 332 ? 94.409 -42.319 28.076 1.00 54.56 ? 418 GLN A CD 1 ATOM 2449 O OE1 . GLN A 1 332 ? 95.625 -42.200 28.239 1.00 51.54 ? 418 GLN A OE1 1 ATOM 2450 N NE2 . GLN A 1 332 ? 93.628 -41.302 27.714 1.00 52.11 ? 418 GLN A NE2 1 ATOM 2451 N N . GLU A 1 333 ? 91.553 -41.795 30.059 1.00 45.60 ? 419 GLU A N 1 ATOM 2452 C CA . GLU A 1 333 ? 90.230 -41.287 29.723 1.00 42.17 ? 419 GLU A CA 1 ATOM 2453 C C . GLU A 1 333 ? 89.883 -41.517 28.240 1.00 50.76 ? 419 GLU A C 1 ATOM 2454 O O . GLU A 1 333 ? 90.767 -41.513 27.372 1.00 52.68 ? 419 GLU A O 1 ATOM 2455 C CB . GLU A 1 333 ? 90.181 -39.798 30.054 1.00 51.60 ? 419 GLU A CB 1 ATOM 2456 C CG . GLU A 1 333 ? 88.874 -39.115 29.730 1.00 60.21 ? 419 GLU A CG 1 ATOM 2457 C CD . GLU A 1 333 ? 87.820 -39.350 30.792 1.00 72.34 ? 419 GLU A CD 1 ATOM 2458 O OE1 . GLU A 1 333 ? 88.182 -39.720 31.949 1.00 76.80 ? 419 GLU A OE1 1 ATOM 2459 O OE2 . GLU A 1 333 ? 86.628 -39.147 30.463 1.00 62.64 ? 419 GLU A OE2 1 ATOM 2460 N N . LEU A 1 334 ? 88.600 -41.728 27.950 1.00 53.21 ? 420 LEU A N 1 ATOM 2461 C CA . LEU A 1 334 ? 88.158 -41.978 26.578 1.00 44.04 ? 420 LEU A CA 1 ATOM 2462 C C . LEU A 1 334 ? 87.015 -41.052 26.156 1.00 58.68 ? 420 LEU A C 1 ATOM 2463 O O . LEU A 1 334 ? 86.045 -40.854 26.898 1.00 57.38 ? 420 LEU A O 1 ATOM 2464 C CB . LEU A 1 334 ? 87.732 -43.433 26.412 1.00 46.92 ? 420 LEU A CB 1 ATOM 2465 C CG . LEU A 1 334 ? 87.425 -43.929 24.983 1.00 59.85 ? 420 LEU A CG 1 ATOM 2466 C CD1 . LEU A 1 334 ? 88.599 -43.687 24.023 1.00 49.62 ? 420 LEU A CD1 1 ATOM 2467 C CD2 . LEU A 1 334 ? 87.049 -45.414 24.993 1.00 60.85 ? 420 LEU A CD2 1 ATOM 2468 N N . CYS A 1 335 ? 87.121 -40.487 24.958 1.00 58.41 ? 421 CYS A N 1 ATOM 2469 C CA . CYS A 1 335 ? 86.083 -39.572 24.482 1.00 51.88 ? 421 CYS A CA 1 ATOM 2470 C C . CYS A 1 335 ? 85.677 -39.862 23.047 1.00 53.94 ? 421 CYS A C 1 ATOM 2471 O O . CYS A 1 335 ? 86.339 -40.620 22.332 1.00 53.39 ? 421 CYS A O 1 ATOM 2472 C CB . CYS A 1 335 ? 86.551 -38.119 24.566 1.00 34.79 ? 421 CYS A CB 1 ATOM 2473 S SG . CYS A 1 335 ? 87.161 -37.557 26.156 1.00 57.26 ? 421 CYS A SG 1 ATOM 2474 N N . PHE A 1 336 ? 84.580 -39.248 22.630 1.00 45.97 ? 422 PHE A N 1 ATOM 2475 C CA . PHE A 1 336 ? 84.184 -39.346 21.241 1.00 42.50 ? 422 PHE A CA 1 ATOM 2476 C C . PHE A 1 336 ? 83.543 -38.056 20.699 1.00 48.93 ? 422 PHE A C 1 ATOM 2477 O O . PHE A 1 336 ? 83.001 -37.243 21.465 1.00 46.15 ? 422 PHE A O 1 ATOM 2478 C CB . PHE A 1 336 ? 83.313 -40.594 20.999 1.00 47.75 ? 422 PHE A CB 1 ATOM 2479 C CG . PHE A 1 336 ? 81.950 -40.525 21.610 1.00 51.04 ? 422 PHE A CG 1 ATOM 2480 C CD1 . PHE A 1 336 ? 80.917 -39.870 20.947 1.00 53.59 ? 422 PHE A CD1 1 ATOM 2481 C CD2 . PHE A 1 336 ? 81.681 -41.145 22.823 1.00 54.21 ? 422 PHE A CD2 1 ATOM 2482 C CE1 . PHE A 1 336 ? 79.647 -39.807 21.498 1.00 53.28 ? 422 PHE A CE1 1 ATOM 2483 C CE2 . PHE A 1 336 ? 80.401 -41.092 23.384 1.00 56.57 ? 422 PHE A CE2 1 ATOM 2484 C CZ . PHE A 1 336 ? 79.386 -40.420 22.720 1.00 52.56 ? 422 PHE A CZ 1 ATOM 2485 N N . TRP A 1 337 ? 83.636 -37.860 19.383 1.00 48.55 ? 423 TRP A N 1 ATOM 2486 C CA . TRP A 1 337 ? 82.988 -36.719 18.739 1.00 50.38 ? 423 TRP A CA 1 ATOM 2487 C C . TRP A 1 337 ? 81.862 -37.209 17.847 1.00 47.72 ? 423 TRP A C 1 ATOM 2488 O O . TRP A 1 337 ? 81.885 -38.344 17.376 1.00 54.11 ? 423 TRP A O 1 ATOM 2489 C CB . TRP A 1 337 ? 83.992 -35.866 17.938 1.00 47.78 ? 423 TRP A CB 1 ATOM 2490 C CG . TRP A 1 337 ? 84.867 -36.686 17.055 1.00 49.21 ? 423 TRP A CG 1 ATOM 2491 C CD1 . TRP A 1 337 ? 86.128 -37.134 17.334 1.00 42.68 ? 423 TRP A CD1 1 ATOM 2492 C CD2 . TRP A 1 337 ? 84.541 -37.186 15.750 1.00 52.27 ? 423 TRP A CD2 1 ATOM 2493 N NE1 . TRP A 1 337 ? 86.611 -37.877 16.282 1.00 47.35 ? 423 TRP A NE1 1 ATOM 2494 C CE2 . TRP A 1 337 ? 85.656 -37.928 15.297 1.00 46.43 ? 423 TRP A CE2 1 ATOM 2495 C CE3 . TRP A 1 337 ? 83.416 -37.078 14.919 1.00 42.29 ? 423 TRP A CE3 1 ATOM 2496 C CZ2 . TRP A 1 337 ? 85.680 -38.557 14.048 1.00 45.18 ? 423 TRP A CZ2 1 ATOM 2497 C CZ3 . TRP A 1 337 ? 83.443 -37.703 13.684 1.00 51.16 ? 423 TRP A CZ3 1 ATOM 2498 C CH2 . TRP A 1 337 ? 84.569 -38.431 13.258 1.00 47.43 ? 423 TRP A CH2 1 ATOM 2499 N N . ILE A 1 338 ? 80.865 -36.354 17.651 1.00 48.83 ? 424 ILE A N 1 ATOM 2500 C CA . ILE A 1 338 ? 79.824 -36.593 16.664 1.00 46.92 ? 424 ILE A CA 1 ATOM 2501 C C . ILE A 1 338 ? 79.734 -35.398 15.732 1.00 49.69 ? 424 ILE A C 1 ATOM 2502 O O . ILE A 1 338 ? 79.684 -34.249 16.186 1.00 50.40 ? 424 ILE A O 1 ATOM 2503 C CB . ILE A 1 338 ? 78.441 -36.771 17.293 1.00 47.97 ? 424 ILE A CB 1 ATOM 2504 C CG1 . ILE A 1 338 ? 78.486 -37.709 18.499 1.00 49.14 ? 424 ILE A CG1 1 ATOM 2505 C CG2 . ILE A 1 338 ? 77.455 -37.289 16.247 1.00 44.10 ? 424 ILE A CG2 1 ATOM 2506 C CD1 . ILE A 1 338 ? 77.111 -37.925 19.119 1.00 43.97 ? 424 ILE A CD1 1 ATOM 2507 N N . GLU A 1 339 ? 79.738 -35.677 14.430 1.00 57.63 ? 425 GLU A N 1 ATOM 2508 C CA . GLU A 1 339 ? 79.505 -34.655 13.419 1.00 45.98 ? 425 GLU A CA 1 ATOM 2509 C C . GLU A 1 339 ? 78.002 -34.596 13.131 1.00 49.50 ? 425 GLU A C 1 ATOM 2510 O O . GLU A 1 339 ? 77.347 -35.609 12.904 1.00 60.39 ? 425 GLU A O 1 ATOM 2511 C CB . GLU A 1 339 ? 80.325 -34.921 12.155 1.00 44.78 ? 425 GLU A CB 1 ATOM 2512 C CG . GLU A 1 339 ? 80.278 -33.780 11.114 1.00 54.10 ? 425 GLU A CG 1 ATOM 2513 C CD . GLU A 1 339 ? 81.319 -33.958 10.010 1.00 49.99 ? 425 GLU A CD 1 ATOM 2514 O OE1 . GLU A 1 339 ? 81.339 -35.029 9.374 1.00 50.92 ? 425 GLU A OE1 1 ATOM 2515 O OE2 . GLU A 1 339 ? 82.133 -33.034 9.797 1.00 46.62 ? 425 GLU A OE2 1 ATOM 2516 N N . ILE A 1 340 ? 77.473 -33.383 13.159 1.00 52.80 ? 426 ILE A N 1 ATOM 2517 C CA . ILE A 1 340 ? 76.046 -33.127 13.164 1.00 48.16 ? 426 ILE A CA 1 ATOM 2518 C C . ILE A 1 340 ? 75.709 -32.255 11.974 1.00 54.38 ? 426 ILE A C 1 ATOM 2519 O O . ILE A 1 340 ? 76.477 -31.355 11.623 1.00 55.83 ? 426 ILE A O 1 ATOM 2520 C CB . ILE A 1 340 ? 75.684 -32.352 14.445 1.00 54.27 ? 426 ILE A CB 1 ATOM 2521 C CG1 . ILE A 1 340 ? 75.915 -33.239 15.663 1.00 66.00 ? 426 ILE A CG1 1 ATOM 2522 C CG2 . ILE A 1 340 ? 74.252 -31.909 14.441 1.00 62.76 ? 426 ILE A CG2 1 ATOM 2523 C CD1 . ILE A 1 340 ? 75.089 -34.493 15.633 1.00 71.89 ? 426 ILE A CD1 1 ATOM 2524 N N . ALA A 1 341 ? 74.570 -32.505 11.340 1.00 60.90 ? 427 ALA A N 1 ATOM 2525 C CA . ALA A 1 341 ? 74.117 -31.590 10.303 1.00 56.57 ? 427 ALA A CA 1 ATOM 2526 C C . ALA A 1 341 ? 73.623 -30.304 10.953 1.00 62.18 ? 427 ALA A C 1 ATOM 2527 O O . ALA A 1 341 ? 72.845 -30.324 11.903 1.00 70.54 ? 427 ALA A O 1 ATOM 2528 C CB . ALA A 1 341 ? 73.044 -32.205 9.485 1.00 45.51 ? 427 ALA A CB 1 ATOM 2529 N N . ALA A 1 342 ? 74.095 -29.186 10.433 1.00 59.09 ? 428 ALA A N 1 ATOM 2530 C CA . ALA A 1 342 ? 73.723 -27.892 10.953 1.00 62.55 ? 428 ALA A CA 1 ATOM 2531 C C . ALA A 1 342 ? 73.304 -26.984 9.793 1.00 73.33 ? 428 ALA A C 1 ATOM 2532 O O . ALA A 1 342 ? 73.437 -27.342 8.616 1.00 79.36 ? 428 ALA A O 1 ATOM 2533 C CB . ALA A 1 342 ? 74.894 -27.287 11.703 1.00 50.33 ? 428 ALA A CB 1 ATOM 2534 N N . THR A 1 343 ? 72.798 -25.807 10.134 1.00 69.41 ? 429 THR A N 1 ATOM 2535 C CA . THR A 1 343 ? 72.398 -24.828 9.137 1.00 62.84 ? 429 THR A CA 1 ATOM 2536 C C . THR A 1 343 ? 72.962 -23.471 9.552 1.00 69.40 ? 429 THR A C 1 ATOM 2537 O O . THR A 1 343 ? 72.953 -23.127 10.739 1.00 73.35 ? 429 THR A O 1 ATOM 2538 C CB . THR A 1 343 ? 70.855 -24.763 9.015 1.00 65.31 ? 429 THR A CB 1 ATOM 2539 O OG1 . THR A 1 343 ? 70.292 -26.044 9.336 1.00 81.87 ? 429 THR A OG1 1 ATOM 2540 C CG2 . THR A 1 343 ? 70.437 -24.387 7.611 1.00 55.19 ? 429 THR A CG2 1 ATOM 2541 N N . THR A 1 344 ? 73.479 -22.707 8.591 1.00 72.71 ? 430 THR A N 1 ATOM 2542 C CA . THR A 1 344 ? 74.018 -21.380 8.903 1.00 68.29 ? 430 THR A CA 1 ATOM 2543 C C . THR A 1 344 ? 72.880 -20.369 9.012 1.00 72.30 ? 430 THR A C 1 ATOM 2544 O O . THR A 1 344 ? 71.760 -20.651 8.570 1.00 75.00 ? 430 THR A O 1 ATOM 2545 C CB . THR A 1 344 ? 75.065 -20.918 7.871 1.00 66.33 ? 430 THR A CB 1 ATOM 2546 O OG1 . THR A 1 344 ? 74.419 -20.381 6.706 1.00 72.61 ? 430 THR A OG1 1 ATOM 2547 C CG2 . THR A 1 344 ? 75.962 -22.082 7.479 1.00 53.34 ? 430 THR A CG2 1 ATOM 2548 N N . LYS A 1 345 ? 73.158 -19.211 9.614 1.00 75.24 ? 431 LYS A N 1 ATOM 2549 C CA . LYS A 1 345 ? 72.127 -18.187 9.824 1.00 83.70 ? 431 LYS A CA 1 ATOM 2550 C C . LYS A 1 345 ? 71.531 -17.737 8.490 1.00 83.62 ? 431 LYS A C 1 ATOM 2551 O O . LYS A 1 345 ? 70.319 -17.536 8.370 1.00 75.60 ? 431 LYS A O 1 ATOM 2552 C CB . LYS A 1 345 ? 72.666 -16.979 10.599 1.00 78.94 ? 431 LYS A CB 1 ATOM 2553 C CG . LYS A 1 345 ? 71.603 -16.325 11.471 1.00 102.72 ? 431 LYS A CG 1 ATOM 2554 C CD . LYS A 1 345 ? 71.801 -14.818 11.639 1.00 115.63 ? 431 LYS A CD 1 ATOM 2555 C CE . LYS A 1 345 ? 70.593 -14.181 12.328 1.00 113.73 ? 431 LYS A CE 1 ATOM 2556 N NZ . LYS A 1 345 ? 70.034 -15.066 13.392 1.00 111.82 ? 431 LYS A NZ 1 ATOM 2557 N N . ALA A 1 346 ? 72.393 -17.599 7.487 1.00 70.15 ? 432 ALA A N 1 ATOM 2558 C CA . ALA A 1 346 ? 71.950 -17.284 6.140 1.00 71.98 ? 432 ALA A CA 1 ATOM 2559 C C . ALA A 1 346 ? 71.091 -18.414 5.594 1.00 84.12 ? 432 ALA A C 1 ATOM 2560 O O . ALA A 1 346 ? 70.214 -18.183 4.761 1.00 96.03 ? 432 ALA A O 1 ATOM 2561 C CB . ALA A 1 346 ? 73.142 -17.030 5.223 1.00 60.62 ? 432 ALA A CB 1 ATOM 2562 N N . GLY A 1 347 ? 71.350 -19.632 6.061 1.00 77.94 ? 433 GLY A N 1 ATOM 2563 C CA . GLY A 1 347 ? 70.582 -20.789 5.637 1.00 77.05 ? 433 GLY A CA 1 ATOM 2564 C C . GLY A 1 347 ? 71.335 -21.797 4.770 1.00 81.74 ? 433 GLY A C 1 ATOM 2565 O O . GLY A 1 347 ? 70.704 -22.625 4.091 1.00 62.47 ? 433 GLY A O 1 ATOM 2566 N N . LEU A 1 348 ? 72.670 -21.740 4.783 1.00 79.45 ? 438 LEU A N 1 ATOM 2567 C CA . LEU A 1 348 ? 73.482 -22.779 4.143 1.00 66.97 ? 438 LEU A CA 1 ATOM 2568 C C . LEU A 1 348 ? 73.550 -24.044 4.998 1.00 72.02 ? 438 LEU A C 1 ATOM 2569 O O . LEU A 1 348 ? 73.476 -23.980 6.231 1.00 66.06 ? 438 LEU A O 1 ATOM 2570 C CB . LEU A 1 348 ? 74.906 -22.292 3.879 1.00 59.19 ? 438 LEU A CB 1 ATOM 2571 C CG . LEU A 1 348 ? 75.037 -20.999 3.074 1.00 64.21 ? 438 LEU A CG 1 ATOM 2572 C CD1 . LEU A 1 348 ? 76.488 -20.752 2.632 1.00 55.78 ? 438 LEU A CD1 1 ATOM 2573 C CD2 . LEU A 1 348 ? 74.083 -21.020 1.884 1.00 64.91 ? 438 LEU A CD2 1 ATOM 2574 N N . SER A 1 349 ? 73.681 -25.191 4.334 1.00 77.33 ? 439 SER A N 1 ATOM 2575 C CA . SER A 1 349 ? 73.974 -26.449 5.014 1.00 80.20 ? 439 SER A CA 1 ATOM 2576 C C . SER A 1 349 ? 75.431 -26.472 5.475 1.00 71.83 ? 439 SER A C 1 ATOM 2577 O O . SER A 1 349 ? 76.337 -26.115 4.717 1.00 66.78 ? 439 SER A O 1 ATOM 2578 C CB . SER A 1 349 ? 73.726 -27.645 4.092 1.00 73.50 ? 439 SER A CB 1 ATOM 2579 O OG . SER A 1 349 ? 72.499 -28.274 4.402 1.00 87.38 ? 439 SER A OG 1 ATOM 2580 N N . SER A 1 350 ? 75.648 -26.886 6.720 1.00 60.62 ? 440 SER A N 1 ATOM 2581 C CA . SER A 1 350 ? 76.998 -27.077 7.229 1.00 70.20 ? 440 SER A CA 1 ATOM 2582 C C . SER A 1 350 ? 77.001 -28.185 8.281 1.00 70.87 ? 440 SER A C 1 ATOM 2583 O O . SER A 1 350 ? 75.995 -28.863 8.498 1.00 72.61 ? 440 SER A O 1 ATOM 2584 C CB . SER A 1 350 ? 77.557 -25.767 7.797 1.00 76.27 ? 440 SER A CB 1 ATOM 2585 O OG . SER A 1 350 ? 78.973 -25.751 7.715 1.00 91.26 ? 440 SER A OG 1 ATOM 2586 N N . ASN A 1 351 ? 78.146 -28.394 8.908 1.00 64.16 ? 441 ASN A N 1 ATOM 2587 C CA . ASN A 1 351 ? 78.217 -29.319 10.016 1.00 48.12 ? 441 ASN A CA 1 ATOM 2588 C C . ASN A 1 351 ? 78.612 -28.571 11.265 1.00 56.28 ? 441 ASN A C 1 ATOM 2589 O O . ASN A 1 351 ? 79.186 -27.473 11.183 1.00 54.09 ? 441 ASN A O 1 ATOM 2590 C CB . ASN A 1 351 ? 79.297 -30.355 9.761 1.00 47.66 ? 441 ASN A CB 1 ATOM 2591 C CG . ASN A 1 351 ? 79.129 -31.064 8.439 1.00 53.39 ? 441 ASN A CG 1 ATOM 2592 O OD1 . ASN A 1 351 ? 78.155 -31.799 8.233 1.00 48.68 ? 441 ASN A OD1 1 ATOM 2593 N ND2 . ASN A 1 351 ? 80.102 -30.876 7.541 1.00 45.76 ? 441 ASN A ND2 1 ATOM 2594 N N . ASP A 1 352 ? 78.292 -29.144 12.419 1.00 44.39 ? 442 ASP A N 1 ATOM 2595 C CA . ASP A 1 352 ? 79.181 -28.958 13.551 1.00 63.26 ? 442 ASP A CA 1 ATOM 2596 C C . ASP A 1 352 ? 79.409 -30.231 14.340 1.00 60.74 ? 442 ASP A C 1 ATOM 2597 O O . ASP A 1 352 ? 79.153 -31.346 13.862 1.00 60.33 ? 442 ASP A O 1 ATOM 2598 C CB . ASP A 1 352 ? 78.876 -27.741 14.445 1.00 72.19 ? 442 ASP A CB 1 ATOM 2599 C CG . ASP A 1 352 ? 77.580 -27.860 15.171 1.00 79.53 ? 442 ASP A CG 1 ATOM 2600 O OD1 . ASP A 1 352 ? 76.762 -28.723 14.773 1.00 91.46 ? 442 ASP A OD1 1 ATOM 2601 O OD2 . ASP A 1 352 ? 77.390 -27.068 16.123 1.00 78.23 ? 442 ASP A OD2 1 ATOM 2602 N N . LEU A 1 353 ? 79.923 -30.039 15.542 1.00 50.80 ? 443 LEU A N 1 ATOM 2603 C CA . LEU A 1 353 ? 80.709 -31.055 16.185 1.00 55.55 ? 443 LEU A CA 1 ATOM 2604 C C . LEU A 1 353 ? 80.384 -31.000 17.660 1.00 59.35 ? 443 LEU A C 1 ATOM 2605 O O . LEU A 1 353 ? 80.389 -29.926 18.262 1.00 54.75 ? 443 LEU A O 1 ATOM 2606 C CB . LEU A 1 353 ? 82.188 -30.739 15.905 1.00 52.08 ? 443 LEU A CB 1 ATOM 2607 C CG . LEU A 1 353 ? 83.302 -31.788 16.029 1.00 51.35 ? 443 LEU A CG 1 ATOM 2608 C CD1 . LEU A 1 353 ? 84.012 -31.612 17.350 1.00 53.00 ? 443 LEU A CD1 1 ATOM 2609 C CD2 . LEU A 1 353 ? 82.794 -33.209 15.886 1.00 43.77 ? 443 LEU A CD2 1 ATOM 2610 N N . ILE A 1 354 ? 80.042 -32.144 18.236 1.00 60.27 ? 444 ILE A N 1 ATOM 2611 C CA . ILE A 1 354 ? 79.839 -32.198 19.678 1.00 58.65 ? 444 ILE A CA 1 ATOM 2612 C C . ILE A 1 354 ? 80.687 -33.325 20.241 1.00 52.41 ? 444 ILE A C 1 ATOM 2613 O O . ILE A 1 354 ? 81.029 -34.259 19.528 1.00 55.05 ? 444 ILE A O 1 ATOM 2614 C CB . ILE A 1 354 ? 78.361 -32.338 20.051 1.00 55.79 ? 444 ILE A CB 1 ATOM 2615 C CG1 . ILE A 1 354 ? 77.804 -33.668 19.567 1.00 65.86 ? 444 ILE A CG1 1 ATOM 2616 C CG2 . ILE A 1 354 ? 77.569 -31.204 19.437 1.00 53.47 ? 444 ILE A CG2 1 ATOM 2617 C CD1 . ILE A 1 354 ? 76.340 -33.812 19.857 1.00 74.74 ? 444 ILE A CD1 1 ATOM 2618 N N . THR A 1 355 ? 81.062 -33.209 21.506 1.00 53.63 ? 445 THR A N 1 ATOM 2619 C CA . THR A 1 355 ? 81.984 -34.160 22.106 1.00 50.47 ? 445 THR A CA 1 ATOM 2620 C C . THR A 1 355 ? 81.508 -34.662 23.461 1.00 51.30 ? 445 THR A C 1 ATOM 2621 O O . THR A 1 355 ? 81.067 -33.890 24.315 1.00 47.93 ? 445 THR A O 1 ATOM 2622 C CB . THR A 1 355 ? 83.388 -33.551 22.273 1.00 56.72 ? 445 THR A CB 1 ATOM 2623 O OG1 . THR A 1 355 ? 83.302 -32.381 23.093 1.00 53.79 ? 445 THR A OG1 1 ATOM 2624 C CG2 . THR A 1 355 ? 83.982 -33.171 20.913 1.00 52.26 ? 445 THR A CG2 1 ATOM 2625 N N . PHE A 1 356 ? 81.596 -35.968 23.652 1.00 47.81 ? 446 PHE A N 1 ATOM 2626 C CA . PHE A 1 356 ? 81.361 -36.545 24.966 1.00 45.65 ? 446 PHE A CA 1 ATOM 2627 C C . PHE A 1 356 ? 82.595 -37.263 25.514 1.00 48.26 ? 446 PHE A C 1 ATOM 2628 O O . PHE A 1 356 ? 83.410 -37.833 24.768 1.00 45.19 ? 446 PHE A O 1 ATOM 2629 C CB . PHE A 1 356 ? 80.192 -37.519 24.917 1.00 48.22 ? 446 PHE A CB 1 ATOM 2630 C CG . PHE A 1 356 ? 78.888 -36.867 24.610 1.00 50.44 ? 446 PHE A CG 1 ATOM 2631 C CD1 . PHE A 1 356 ? 78.484 -36.672 23.288 1.00 37.38 ? 446 PHE A CD1 1 ATOM 2632 C CD2 . PHE A 1 356 ? 78.055 -36.441 25.643 1.00 54.55 ? 446 PHE A CD2 1 ATOM 2633 C CE1 . PHE A 1 356 ? 77.261 -36.065 23.009 1.00 48.04 ? 446 PHE A CE1 1 ATOM 2634 C CE2 . PHE A 1 356 ? 76.835 -35.835 25.369 1.00 56.31 ? 446 PHE A CE2 1 ATOM 2635 C CZ . PHE A 1 356 ? 76.434 -35.649 24.055 1.00 55.47 ? 446 PHE A CZ 1 ATOM 2636 N N . CYS A 1 357 ? 82.719 -37.240 26.833 1.00 47.80 ? 447 CYS A N 1 ATOM 2637 C CA . CYS A 1 357 ? 83.799 -37.940 27.515 1.00 39.37 ? 447 CYS A CA 1 ATOM 2638 C C . CYS A 1 357 ? 83.233 -38.871 28.574 1.00 51.97 ? 447 CYS A C 1 ATOM 2639 O O . CYS A 1 357 ? 82.151 -38.626 29.138 1.00 55.99 ? 447 CYS A O 1 ATOM 2640 C CB . CYS A 1 357 ? 84.802 -36.948 28.105 1.00 46.45 ? 447 CYS A CB 1 ATOM 2641 S SG . CYS A 1 357 ? 85.839 -36.126 26.845 1.00 65.63 ? 447 CYS A SG 1 ATOM 2642 N N . GLY A 1 358 ? 83.967 -39.951 28.819 1.00 50.83 ? 448 GLY A N 1 ATOM 2643 C CA . GLY A 1 358 ? 83.504 -41.008 29.694 1.00 47.87 ? 448 GLY A CA 1 ATOM 2644 C C . GLY A 1 358 ? 83.511 -40.624 31.166 1.00 57.45 ? 448 GLY A C 1 ATOM 2645 O O . GLY A 1 358 ? 84.228 -39.724 31.592 1.00 46.44 ? 448 GLY A O 1 ATOM 2646 N N . THR A 1 359 ? 82.689 -41.311 31.947 1.00 65.50 ? 449 THR A N 1 ATOM 2647 C CA . THR A 1 359 ? 82.731 -41.177 33.383 1.00 57.99 ? 449 THR A CA 1 ATOM 2648 C C . THR A 1 359 ? 82.353 -42.513 34.003 1.00 55.02 ? 449 THR A C 1 ATOM 2649 O O . THR A 1 359 ? 81.616 -43.312 33.385 1.00 47.95 ? 449 THR A O 1 ATOM 2650 C CB . THR A 1 359 ? 81.830 -40.009 33.893 1.00 59.05 ? 449 THR A CB 1 ATOM 2651 O OG1 . THR A 1 359 ? 81.928 -39.902 35.325 1.00 57.39 ? 449 THR A OG1 1 ATOM 2652 C CG2 . THR A 1 359 ? 80.370 -40.202 33.469 1.00 43.60 ? 449 THR A CG2 1 ATOM 2653 N N . GLY A 1 360 ? 82.880 -42.768 35.203 1.00 46.92 ? 450 GLY A N 1 ATOM 2654 C CA . GLY A 1 360 ? 82.619 -44.023 35.893 1.00 55.67 ? 450 GLY A CA 1 ATOM 2655 C C . GLY A 1 360 ? 81.316 -43.908 36.657 1.00 59.56 ? 450 GLY A C 1 ATOM 2656 O O . GLY A 1 360 ? 80.682 -44.912 37.000 1.00 68.53 ? 450 GLY A O 1 ATOM 2657 N N . GLY A 1 361 ? 80.925 -42.662 36.926 1.00 57.42 ? 451 GLY A N 1 ATOM 2658 C CA . GLY A 1 361 ? 79.623 -42.374 37.495 1.00 68.37 ? 451 GLY A CA 1 ATOM 2659 C C . GLY A 1 361 ? 78.502 -42.804 36.563 1.00 84.25 ? 451 GLY A C 1 ATOM 2660 O O . GLY A 1 361 ? 78.547 -42.553 35.353 1.00 86.89 ? 451 GLY A O 1 ATOM 2661 N N . SER A 1 362 ? 77.492 -43.458 37.122 1.00 88.32 ? 452 SER A N 1 ATOM 2662 C CA . SER A 1 362 ? 76.304 -43.781 36.348 1.00 93.96 ? 452 SER A CA 1 ATOM 2663 C C . SER A 1 362 ? 75.471 -42.513 36.141 1.00 85.21 ? 452 SER A C 1 ATOM 2664 O O . SER A 1 362 ? 75.182 -41.777 37.091 1.00 73.68 ? 452 SER A O 1 ATOM 2665 C CB . SER A 1 362 ? 75.500 -44.881 37.032 1.00 102.48 ? 452 SER A CB 1 ATOM 2666 O OG . SER A 1 362 ? 76.224 -46.099 37.008 1.00 98.64 ? 452 SER A OG 1 ATOM 2667 N N . MET A 1 363 ? 75.100 -42.268 34.887 1.00 74.95 ? 453 MET A N 1 ATOM 2668 C CA . MET A 1 363 ? 74.490 -41.004 34.477 1.00 58.69 ? 453 MET A CA 1 ATOM 2669 C C . MET A 1 363 ? 72.973 -41.088 34.361 1.00 55.86 ? 453 MET A C 1 ATOM 2670 O O . MET A 1 363 ? 72.406 -42.157 34.109 1.00 61.52 ? 453 MET A O 1 ATOM 2671 C CB . MET A 1 363 ? 75.067 -40.558 33.122 1.00 59.86 ? 453 MET A CB 1 ATOM 2672 C CG . MET A 1 363 ? 76.457 -39.957 33.188 1.00 61.57 ? 453 MET A CG 1 ATOM 2673 S SD . MET A 1 363 ? 76.488 -38.296 33.875 1.00 73.67 ? 453 MET A SD 1 ATOM 2674 C CE . MET A 1 363 ? 75.588 -37.357 32.647 1.00 41.31 ? 453 MET A CE 1 ATOM 2675 N N . PRO A 1 364 ? 72.304 -39.945 34.535 1.00 58.61 ? 454 PRO A N 1 ATOM 2676 C CA . PRO A 1 364 ? 70.858 -39.892 34.296 1.00 63.59 ? 454 PRO A CA 1 ATOM 2677 C C . PRO A 1 364 ? 70.550 -39.924 32.802 1.00 68.88 ? 454 PRO A C 1 ATOM 2678 O O . PRO A 1 364 ? 71.473 -40.028 31.989 1.00 75.70 ? 454 PRO A O 1 ATOM 2679 C CB . PRO A 1 364 ? 70.454 -38.543 34.898 1.00 54.97 ? 454 PRO A CB 1 ATOM 2680 C CG . PRO A 1 364 ? 71.694 -37.731 34.888 1.00 50.97 ? 454 PRO A CG 1 ATOM 2681 C CD . PRO A 1 364 ? 72.845 -38.672 35.042 1.00 50.38 ? 454 PRO A CD 1 ATOM 2682 N N . ASP A 1 365 ? 69.270 -39.852 32.450 1.00 63.81 ? 455 ASP A N 1 ATOM 2683 C CA . ASP A 1 365 ? 68.856 -39.789 31.053 1.00 51.54 ? 455 ASP A CA 1 ATOM 2684 C C . ASP A 1 365 ? 68.618 -38.356 30.661 1.00 67.73 ? 455 ASP A C 1 ATOM 2685 O O . ASP A 1 365 ? 67.619 -37.763 31.054 1.00 83.92 ? 455 ASP A O 1 ATOM 2686 C CB . ASP A 1 365 ? 67.582 -40.593 30.834 1.00 66.35 ? 455 ASP A CB 1 ATOM 2687 C CG . ASP A 1 365 ? 67.834 -42.080 30.860 1.00 86.63 ? 455 ASP A CG 1 ATOM 2688 O OD1 . ASP A 1 365 ? 68.231 -42.592 31.929 1.00 78.09 ? 455 ASP A OD1 1 ATOM 2689 O OD2 . ASP A 1 365 ? 67.660 -42.730 29.807 1.00 101.89 ? 455 ASP A OD2 1 ATOM 2690 N N . VAL A 1 366 ? 69.551 -37.790 29.905 1.00 72.95 ? 456 VAL A N 1 ATOM 2691 C CA . VAL A 1 366 ? 69.403 -36.425 29.439 1.00 62.01 ? 456 VAL A CA 1 ATOM 2692 C C . VAL A 1 366 ? 69.604 -36.377 27.939 1.00 64.35 ? 456 VAL A C 1 ATOM 2693 O O . VAL A 1 366 ? 70.597 -36.876 27.419 1.00 74.48 ? 456 VAL A O 1 ATOM 2694 C CB . VAL A 1 366 ? 70.379 -35.471 30.144 1.00 54.68 ? 456 VAL A CB 1 ATOM 2695 C CG1 . VAL A 1 366 ? 71.613 -36.228 30.591 1.00 67.56 ? 456 VAL A CG1 1 ATOM 2696 C CG2 . VAL A 1 366 ? 70.741 -34.283 29.235 1.00 53.70 ? 456 VAL A CG2 1 ATOM 2697 N N . ASN A 1 367 ? 68.629 -35.806 27.245 1.00 65.99 ? 457 ASN A N 1 ATOM 2698 C CA . ASN A 1 367 ? 68.767 -35.542 25.827 1.00 68.92 ? 457 ASN A CA 1 ATOM 2699 C C . ASN A 1 367 ? 69.520 -34.213 25.607 1.00 67.74 ? 457 ASN A C 1 ATOM 2700 O O . ASN A 1 367 ? 69.196 -33.191 26.216 1.00 54.07 ? 457 ASN A O 1 ATOM 2701 C CB . ASN A 1 367 ? 67.395 -35.548 25.145 1.00 59.79 ? 457 ASN A CB 1 ATOM 2702 C CG . ASN A 1 367 ? 67.414 -34.857 23.800 1.00 75.64 ? 457 ASN A CG 1 ATOM 2703 O OD1 . ASN A 1 367 ? 67.775 -35.457 22.789 1.00 81.66 ? 457 ASN A OD1 1 ATOM 2704 N ND2 . ASN A 1 367 ? 67.034 -33.581 23.782 1.00 83.26 ? 457 ASN A ND2 1 ATOM 2705 N N . TRP A 1 368 ? 70.525 -34.239 24.735 1.00 63.06 ? 458 TRP A N 1 ATOM 2706 C CA . TRP A 1 368 ? 71.403 -33.091 24.543 1.00 59.26 ? 458 TRP A CA 1 ATOM 2707 C C . TRP A 1 368 ? 71.080 -32.260 23.296 1.00 60.28 ? 458 TRP A C 1 ATOM 2708 O O . TRP A 1 368 ? 71.677 -31.201 23.071 1.00 65.69 ? 458 TRP A O 1 ATOM 2709 C CB . TRP A 1 368 ? 72.870 -33.541 24.555 1.00 52.10 ? 458 TRP A CB 1 ATOM 2710 C CG . TRP A 1 368 ? 73.269 -34.071 25.899 1.00 54.41 ? 458 TRP A CG 1 ATOM 2711 C CD1 . TRP A 1 368 ? 73.311 -35.376 26.287 1.00 58.72 ? 458 TRP A CD1 1 ATOM 2712 C CD2 . TRP A 1 368 ? 73.639 -33.301 27.039 1.00 48.99 ? 458 TRP A CD2 1 ATOM 2713 N NE1 . TRP A 1 368 ? 73.703 -35.470 27.594 1.00 52.40 ? 458 TRP A NE1 1 ATOM 2714 C CE2 . TRP A 1 368 ? 73.914 -34.209 28.084 1.00 58.35 ? 458 TRP A CE2 1 ATOM 2715 C CE3 . TRP A 1 368 ? 73.772 -31.931 27.280 1.00 40.44 ? 458 TRP A CE3 1 ATOM 2716 C CZ2 . TRP A 1 368 ? 74.309 -33.794 29.355 1.00 55.81 ? 458 TRP A CZ2 1 ATOM 2717 C CZ3 . TRP A 1 368 ? 74.166 -31.517 28.545 1.00 50.79 ? 458 TRP A CZ3 1 ATOM 2718 C CH2 . TRP A 1 368 ? 74.423 -32.448 29.568 1.00 48.54 ? 458 TRP A CH2 1 ATOM 2719 N N . GLY A 1 369 ? 70.117 -32.732 22.509 1.00 52.54 ? 459 GLY A N 1 ATOM 2720 C CA . GLY A 1 369 ? 69.742 -32.061 21.277 1.00 56.37 ? 459 GLY A CA 1 ATOM 2721 C C . GLY A 1 369 ? 69.021 -32.958 20.273 1.00 70.92 ? 459 GLY A C 1 ATOM 2722 O O . GLY A 1 369 ? 68.758 -34.137 20.525 1.00 73.91 ? 459 GLY A O 1 ATOM 2723 O OXT . GLY A 1 369 ? 68.662 -32.529 19.169 1.00 79.13 ? 459 GLY A OXT 1 ATOM 2724 N N . ALA B 1 6 ? 104.671 -27.945 39.156 1.00 126.12 ? 82 ALA B N 1 ATOM 2725 C CA . ALA B 1 6 ? 105.888 -28.402 39.873 1.00 132.47 ? 82 ALA B CA 1 ATOM 2726 C C . ALA B 1 6 ? 105.643 -28.585 41.367 1.00 128.63 ? 82 ALA B C 1 ATOM 2727 O O . ALA B 1 6 ? 106.154 -29.575 41.947 1.00 127.18 ? 82 ALA B O 1 ATOM 2728 C CB . ALA B 1 6 ? 107.182 -27.470 39.598 1.00 95.00 ? 82 ALA B CB 1 ATOM 2729 N N . THR B 1 7 ? 104.929 -27.676 42.034 1.00 115.05 ? 83 THR B N 1 ATOM 2730 C CA . THR B 1 7 ? 104.677 -27.913 43.465 1.00 100.50 ? 83 THR B CA 1 ATOM 2731 C C . THR B 1 7 ? 103.249 -27.598 43.922 1.00 85.39 ? 83 THR B C 1 ATOM 2732 O O . THR B 1 7 ? 102.581 -26.773 43.302 1.00 81.08 ? 83 THR B O 1 ATOM 2733 C CB . THR B 1 7 ? 105.762 -27.252 44.371 1.00 85.73 ? 83 THR B CB 1 ATOM 2734 O OG1 . THR B 1 7 ? 106.164 -28.184 45.387 1.00 92.78 ? 83 THR B OG1 1 ATOM 2735 C CG2 . THR B 1 7 ? 105.252 -25.941 45.018 1.00 80.49 ? 83 THR B CG2 1 ATOM 2736 N N . PRO B 1 8 ? 102.758 -28.286 44.980 1.00 85.76 ? 84 PRO B N 1 ATOM 2737 C CA . PRO B 1 8 ? 101.391 -27.954 45.406 1.00 82.16 ? 84 PRO B CA 1 ATOM 2738 C C . PRO B 1 8 ? 101.285 -26.522 45.894 1.00 81.76 ? 84 PRO B C 1 ATOM 2739 O O . PRO B 1 8 ? 102.166 -26.041 46.607 1.00 77.98 ? 84 PRO B O 1 ATOM 2740 C CB . PRO B 1 8 ? 101.126 -28.918 46.570 1.00 62.45 ? 84 PRO B CB 1 ATOM 2741 C CG . PRO B 1 8 ? 102.042 -30.047 46.347 1.00 69.83 ? 84 PRO B CG 1 ATOM 2742 C CD . PRO B 1 8 ? 103.291 -29.443 45.726 1.00 80.81 ? 84 PRO B CD 1 ATOM 2743 N N . LEU B 1 9 ? 100.237 -25.832 45.471 1.00 74.52 ? 85 LEU B N 1 ATOM 2744 C CA . LEU B 1 9 ? 99.919 -24.535 46.035 1.00 61.16 ? 85 LEU B CA 1 ATOM 2745 C C . LEU B 1 9 ? 99.616 -24.713 47.532 1.00 69.11 ? 85 LEU B C 1 ATOM 2746 O O . LEU B 1 9 ? 98.811 -25.573 47.931 1.00 80.47 ? 85 LEU B O 1 ATOM 2747 C CB . LEU B 1 9 ? 98.734 -23.928 45.279 1.00 49.64 ? 85 LEU B CB 1 ATOM 2748 C CG . LEU B 1 9 ? 98.167 -22.542 45.579 1.00 69.97 ? 85 LEU B CG 1 ATOM 2749 C CD1 . LEU B 1 9 ? 97.373 -22.088 44.362 1.00 73.36 ? 85 LEU B CD1 1 ATOM 2750 C CD2 . LEU B 1 9 ? 97.263 -22.572 46.812 1.00 71.46 ? 85 LEU B CD2 1 ATOM 2751 N N . VAL B 1 10 ? 100.299 -23.929 48.357 1.00 75.57 ? 86 VAL B N 1 ATOM 2752 C CA . VAL B 1 10 ? 100.004 -23.905 49.783 1.00 88.81 ? 86 VAL B CA 1 ATOM 2753 C C . VAL B 1 10 ? 99.896 -22.453 50.263 1.00 79.37 ? 86 VAL B C 1 ATOM 2754 O O . VAL B 1 10 ? 100.790 -21.637 50.024 1.00 68.48 ? 86 VAL B O 1 ATOM 2755 C CB . VAL B 1 10 ? 100.989 -24.800 50.633 1.00 73.53 ? 86 VAL B CB 1 ATOM 2756 C CG1 . VAL B 1 10 ? 102.429 -24.644 50.166 1.00 79.31 ? 86 VAL B CG1 1 ATOM 2757 C CG2 . VAL B 1 10 ? 100.858 -24.518 52.116 1.00 62.14 ? 86 VAL B CG2 1 ATOM 2758 N N . LEU B 1 11 ? 98.764 -22.152 50.900 1.00 77.41 ? 87 LEU B N 1 ATOM 2759 C CA . LEU B 1 11 ? 98.405 -20.804 51.325 1.00 73.92 ? 87 LEU B CA 1 ATOM 2760 C C . LEU B 1 11 ? 99.043 -20.449 52.666 1.00 77.20 ? 87 LEU B C 1 ATOM 2761 O O . LEU B 1 11 ? 99.500 -21.332 53.401 1.00 76.61 ? 87 LEU B O 1 ATOM 2762 C CB . LEU B 1 11 ? 96.883 -20.706 51.475 1.00 61.24 ? 87 LEU B CB 1 ATOM 2763 C CG . LEU B 1 11 ? 95.966 -20.916 50.270 1.00 58.43 ? 87 LEU B CG 1 ATOM 2764 C CD1 . LEU B 1 11 ? 94.620 -21.458 50.739 1.00 59.95 ? 87 LEU B CD1 1 ATOM 2765 C CD2 . LEU B 1 11 ? 95.777 -19.617 49.496 1.00 50.35 ? 87 LEU B CD2 1 ATOM 2766 N N . GLY B 1 12 ? 99.045 -19.155 52.986 1.00 73.47 ? 88 GLY B N 1 ATOM 2767 C CA . GLY B 1 12 ? 99.541 -18.669 54.264 1.00 61.52 ? 88 GLY B CA 1 ATOM 2768 C C . GLY B 1 12 ? 98.659 -18.968 55.470 1.00 66.44 ? 88 GLY B C 1 ATOM 2769 O O . GLY B 1 12 ? 97.447 -18.679 55.484 1.00 76.73 ? 88 GLY B O 1 ATOM 2770 N N . GLU B 1 13 ? 99.283 -19.530 56.502 1.00 68.25 ? 89 GLU B N 1 ATOM 2771 C CA . GLU B 1 13 ? 98.583 -19.886 57.731 1.00 72.04 ? 89 GLU B CA 1 ATOM 2772 C C . GLU B 1 13 ? 97.992 -18.674 58.470 1.00 64.39 ? 89 GLU B C 1 ATOM 2773 O O . GLU B 1 13 ? 97.019 -18.818 59.234 1.00 55.50 ? 89 GLU B O 1 ATOM 2774 C CB . GLU B 1 13 ? 99.509 -20.697 58.648 1.00 58.52 ? 89 GLU B CB 1 ATOM 2775 C CG . GLU B 1 13 ? 99.663 -22.155 58.226 1.00 67.10 ? 89 GLU B CG 1 ATOM 2776 C CD . GLU B 1 13 ? 98.372 -22.944 58.353 1.00 82.31 ? 89 GLU B CD 1 ATOM 2777 O OE1 . GLU B 1 13 ? 97.590 -22.683 59.295 1.00 78.32 ? 89 GLU B OE1 1 ATOM 2778 O OE2 . GLU B 1 13 ? 98.136 -23.824 57.501 1.00 95.54 ? 89 GLU B OE2 1 ATOM 2779 N N . ASN B 1 14 ? 98.559 -17.488 58.228 1.00 63.56 ? 90 ASN B N 1 ATOM 2780 C CA . ASN B 1 14 ? 98.122 -16.273 58.929 1.00 61.11 ? 90 ASN B CA 1 ATOM 2781 C C . ASN B 1 14 ? 97.742 -15.098 58.025 1.00 67.78 ? 90 ASN B C 1 ATOM 2782 O O . ASN B 1 14 ? 98.506 -14.695 57.136 1.00 78.34 ? 90 ASN B O 1 ATOM 2783 C CB . ASN B 1 14 ? 99.168 -15.860 59.974 1.00 68.03 ? 90 ASN B CB 1 ATOM 2784 C CG . ASN B 1 14 ? 99.298 -16.887 61.099 1.00 90.26 ? 90 ASN B CG 1 ATOM 2785 O OD1 . ASN B 1 14 ? 98.330 -17.169 61.820 1.00 91.34 ? 90 ASN B OD1 1 ATOM 2786 N ND2 . ASN B 1 14 ? 100.487 -17.463 61.239 1.00 89.57 ? 90 ASN B ND2 1 ATOM 2787 N N . LEU B 1 15 ? 96.553 -14.551 58.258 1.00 62.50 ? 91 LEU B N 1 ATOM 2788 C CA . LEU B 1 15 ? 96.045 -13.462 57.421 1.00 70.58 ? 91 LEU B CA 1 ATOM 2789 C C . LEU B 1 15 ? 96.840 -12.191 57.579 1.00 72.67 ? 91 LEU B C 1 ATOM 2790 O O . LEU B 1 15 ? 97.431 -11.940 58.624 1.00 75.21 ? 91 LEU B O 1 ATOM 2791 C CB . LEU B 1 15 ? 94.578 -13.145 57.738 1.00 65.67 ? 91 LEU B CB 1 ATOM 2792 C CG . LEU B 1 15 ? 93.491 -14.041 57.149 1.00 65.36 ? 91 LEU B CG 1 ATOM 2793 C CD1 . LEU B 1 15 ? 92.139 -13.476 57.502 1.00 71.47 ? 91 LEU B CD1 1 ATOM 2794 C CD2 . LEU B 1 15 ? 93.648 -14.162 55.635 1.00 58.87 ? 91 LEU B CD2 1 ATOM 2795 N N . CYS B 1 16 ? 96.836 -11.375 56.537 1.00 77.83 ? 92 CYS B N 1 ATOM 2796 C CA . CYS B 1 16 ? 97.389 -10.041 56.652 1.00 72.31 ? 92 CYS B CA 1 ATOM 2797 C C . CYS B 1 16 ? 96.509 -9.253 57.609 1.00 75.17 ? 92 CYS B C 1 ATOM 2798 O O . CYS B 1 16 ? 95.343 -9.584 57.811 1.00 81.39 ? 92 CYS B O 1 ATOM 2799 C CB . CYS B 1 16 ? 97.438 -9.371 55.278 1.00 68.58 ? 92 CYS B CB 1 ATOM 2800 S SG . CYS B 1 16 ? 98.647 -10.135 54.143 1.00 87.82 ? 92 CYS B SG 1 ATOM 2801 N N . SER B 1 17 ? 97.072 -8.238 58.244 1.00 86.31 ? 93 SER B N 1 ATOM 2802 C CA . SER B 1 17 ? 96.236 -7.330 59.004 1.00 82.97 ? 93 SER B CA 1 ATOM 2803 C C . SER B 1 17 ? 95.477 -6.469 57.999 1.00 81.84 ? 93 SER B C 1 ATOM 2804 O O . SER B 1 17 ? 96.083 -5.887 57.087 1.00 90.63 ? 93 SER B O 1 ATOM 2805 C CB . SER B 1 17 ? 97.080 -6.459 59.925 1.00 80.32 ? 93 SER B CB 1 ATOM 2806 O OG . SER B 1 17 ? 96.261 -5.553 60.634 1.00 94.82 ? 93 SER B OG 1 ATOM 2807 N N . ILE B 1 18 ? 94.153 -6.407 58.136 1.00 61.57 ? 94 ILE B N 1 ATOM 2808 C CA . ILE B 1 18 ? 93.353 -5.607 57.206 1.00 62.26 ? 94 ILE B CA 1 ATOM 2809 C C . ILE B 1 18 ? 92.591 -4.473 57.909 1.00 63.80 ? 94 ILE B C 1 ATOM 2810 O O . ILE B 1 18 ? 91.847 -4.714 58.862 1.00 67.63 ? 94 ILE B O 1 ATOM 2811 C CB . ILE B 1 18 ? 92.392 -6.501 56.353 1.00 72.49 ? 94 ILE B CB 1 ATOM 2812 C CG1 . ILE B 1 18 ? 93.202 -7.365 55.378 1.00 80.89 ? 94 ILE B CG1 1 ATOM 2813 C CG2 . ILE B 1 18 ? 91.399 -5.637 55.579 1.00 64.10 ? 94 ILE B CG2 1 ATOM 2814 C CD1 . ILE B 1 18 ? 92.684 -8.779 55.215 1.00 80.95 ? 94 ILE B CD1 1 ATOM 2815 N N . ASN B 1 19 ? 92.789 -3.235 57.459 1.00 62.65 ? 95 ASN B N 1 ATOM 2816 C CA . ASN B 1 19 ? 92.016 -2.120 58.016 1.00 61.69 ? 95 ASN B CA 1 ATOM 2817 C C . ASN B 1 19 ? 91.422 -1.261 56.932 1.00 70.57 ? 95 ASN B C 1 ATOM 2818 O O . ASN B 1 19 ? 90.838 -0.215 57.201 1.00 76.39 ? 95 ASN B O 1 ATOM 2819 C CB . ASN B 1 19 ? 92.845 -1.272 58.975 1.00 58.25 ? 95 ASN B CB 1 ATOM 2820 C CG . ASN B 1 19 ? 93.438 -2.094 60.077 1.00 69.33 ? 95 ASN B CG 1 ATOM 2821 O OD1 . ASN B 1 19 ? 92.773 -2.395 61.072 1.00 81.54 ? 95 ASN B OD1 1 ATOM 2822 N ND2 . ASN B 1 19 ? 94.688 -2.508 59.894 1.00 74.50 ? 95 ASN B ND2 1 ATOM 2823 N N . GLY B 1 20 ? 91.565 -1.718 55.698 1.00 63.07 ? 96 GLY B N 1 ATOM 2824 C CA . GLY B 1 20 ? 91.019 -0.988 54.583 1.00 60.54 ? 96 GLY B CA 1 ATOM 2825 C C . GLY B 1 20 ? 91.040 -1.813 53.321 1.00 62.95 ? 96 GLY B C 1 ATOM 2826 O O . GLY B 1 20 ? 91.693 -2.863 53.240 1.00 62.84 ? 96 GLY B O 1 ATOM 2827 N N . TRP B 1 21 ? 90.328 -1.324 52.318 1.00 63.68 ? 97 TRP B N 1 ATOM 2828 C CA . TRP B 1 21 ? 90.221 -2.039 51.063 1.00 55.59 ? 97 TRP B CA 1 ATOM 2829 C C . TRP B 1 21 ? 90.556 -1.115 49.916 1.00 55.64 ? 97 TRP B C 1 ATOM 2830 O O . TRP B 1 21 ? 90.206 0.066 49.938 1.00 60.85 ? 97 TRP B O 1 ATOM 2831 C CB . TRP B 1 21 ? 88.803 -2.581 50.924 1.00 61.19 ? 97 TRP B CB 1 ATOM 2832 C CG . TRP B 1 21 ? 88.416 -3.384 52.126 1.00 63.91 ? 97 TRP B CG 1 ATOM 2833 C CD1 . TRP B 1 21 ? 87.748 -2.941 53.235 1.00 67.87 ? 97 TRP B CD1 1 ATOM 2834 C CD2 . TRP B 1 21 ? 88.708 -4.770 52.360 1.00 60.46 ? 97 TRP B CD2 1 ATOM 2835 N NE1 . TRP B 1 21 ? 87.584 -3.972 54.133 1.00 61.49 ? 97 TRP B NE1 1 ATOM 2836 C CE2 . TRP B 1 21 ? 88.166 -5.104 53.621 1.00 62.49 ? 97 TRP B CE2 1 ATOM 2837 C CE3 . TRP B 1 21 ? 89.356 -5.764 51.619 1.00 61.81 ? 97 TRP B CE3 1 ATOM 2838 C CZ2 . TRP B 1 21 ? 88.261 -6.390 54.158 1.00 68.14 ? 97 TRP B CZ2 1 ATOM 2839 C CZ3 . TRP B 1 21 ? 89.445 -7.040 52.153 1.00 66.49 ? 97 TRP B CZ3 1 ATOM 2840 C CH2 . TRP B 1 21 ? 88.903 -7.342 53.410 1.00 65.44 ? 97 TRP B CH2 1 ATOM 2841 N N . VAL B 1 22 ? 91.262 -1.654 48.927 1.00 69.47 ? 98 VAL B N 1 ATOM 2842 C CA . VAL B 1 22 ? 91.585 -0.918 47.705 1.00 69.10 ? 98 VAL B CA 1 ATOM 2843 C C . VAL B 1 22 ? 91.268 -1.783 46.496 1.00 71.00 ? 98 VAL B C 1 ATOM 2844 O O . VAL B 1 22 ? 91.598 -2.978 46.473 1.00 72.15 ? 98 VAL B O 1 ATOM 2845 C CB . VAL B 1 22 ? 93.067 -0.521 47.651 1.00 63.53 ? 98 VAL B CB 1 ATOM 2846 C CG1 . VAL B 1 22 ? 93.385 0.154 46.318 1.00 67.10 ? 98 VAL B CG1 1 ATOM 2847 C CG2 . VAL B 1 22 ? 93.421 0.389 48.820 1.00 58.67 ? 98 VAL B CG2 1 ATOM 2848 N N . PRO B 1 23 ? 90.609 -1.187 45.492 1.00 68.36 ? 99 PRO B N 1 ATOM 2849 C CA . PRO B 1 23 ? 90.278 -1.905 44.251 1.00 57.67 ? 99 PRO B CA 1 ATOM 2850 C C . PRO B 1 23 ? 91.506 -2.324 43.435 1.00 52.19 ? 99 PRO B C 1 ATOM 2851 O O . PRO B 1 23 ? 92.472 -1.565 43.304 1.00 58.53 ? 99 PRO B O 1 ATOM 2852 C CB . PRO B 1 23 ? 89.421 -0.897 43.469 1.00 49.46 ? 99 PRO B CB 1 ATOM 2853 C CG . PRO B 1 23 ? 89.749 0.416 44.052 1.00 58.49 ? 99 PRO B CG 1 ATOM 2854 C CD . PRO B 1 23 ? 90.048 0.173 45.507 1.00 62.97 ? 99 PRO B CD 1 ATOM 2855 N N . THR B 1 24 ? 91.463 -3.538 42.896 1.00 58.21 ? 100 THR B N 1 ATOM 2856 C CA . THR B 1 24 ? 92.566 -4.052 42.094 1.00 61.09 ? 100 THR B CA 1 ATOM 2857 C C . THR B 1 24 ? 92.122 -4.345 40.656 1.00 61.40 ? 100 THR B C 1 ATOM 2858 O O . THR B 1 24 ? 92.937 -4.390 39.723 1.00 62.48 ? 100 THR B O 1 ATOM 2859 C CB . THR B 1 24 ? 93.174 -5.308 42.721 1.00 61.55 ? 100 THR B CB 1 ATOM 2860 O OG1 . THR B 1 24 ? 92.128 -6.145 43.220 1.00 63.66 ? 100 THR B OG1 1 ATOM 2861 C CG2 . THR B 1 24 ? 94.091 -4.930 43.862 1.00 54.60 ? 100 THR B CG2 1 ATOM 2862 N N . TYR B 1 25 ? 90.825 -4.552 40.487 1.00 53.57 ? 101 TYR B N 1 ATOM 2863 C CA . TYR B 1 25 ? 90.248 -4.539 39.165 1.00 58.45 ? 101 TYR B CA 1 ATOM 2864 C C . TYR B 1 25 ? 88.933 -3.816 39.258 1.00 63.29 ? 101 TYR B C 1 ATOM 2865 O O . TYR B 1 25 ? 88.170 -4.011 40.215 1.00 71.85 ? 101 TYR B O 1 ATOM 2866 C CB . TYR B 1 25 ? 90.023 -5.955 38.610 1.00 55.01 ? 101 TYR B CB 1 ATOM 2867 C CG . TYR B 1 25 ? 89.331 -5.956 37.257 1.00 62.48 ? 101 TYR B CG 1 ATOM 2868 C CD1 . TYR B 1 25 ? 90.013 -5.571 36.101 1.00 59.96 ? 101 TYR B CD1 1 ATOM 2869 C CD2 . TYR B 1 25 ? 87.998 -6.328 37.136 1.00 62.70 ? 101 TYR B CD2 1 ATOM 2870 C CE1 . TYR B 1 25 ? 89.393 -5.571 34.873 1.00 63.97 ? 101 TYR B CE1 1 ATOM 2871 C CE2 . TYR B 1 25 ? 87.366 -6.328 35.895 1.00 67.48 ? 101 TYR B CE2 1 ATOM 2872 C CZ . TYR B 1 25 ? 88.070 -5.950 34.769 1.00 68.04 ? 101 TYR B CZ 1 ATOM 2873 O OH . TYR B 1 25 ? 87.450 -5.956 33.532 1.00 65.85 ? 101 TYR B OH 1 ATOM 2874 N N . ARG B 1 26 ? 88.666 -2.988 38.256 1.00 57.00 ? 102 ARG B N 1 ATOM 2875 C CA . ARG B 1 26 ? 87.402 -2.288 38.179 1.00 55.67 ? 102 ARG B CA 1 ATOM 2876 C C . ARG B 1 26 ? 86.947 -2.318 36.733 1.00 66.11 ? 102 ARG B C 1 ATOM 2877 O O . ARG B 1 26 ? 87.563 -1.695 35.870 1.00 76.70 ? 102 ARG B O 1 ATOM 2878 C CB . ARG B 1 26 ? 87.552 -0.855 38.690 1.00 50.81 ? 102 ARG B CB 1 ATOM 2879 C CG . ARG B 1 26 ? 86.240 -0.130 38.864 1.00 56.61 ? 102 ARG B CG 1 ATOM 2880 C CD . ARG B 1 26 ? 86.430 1.178 39.600 1.00 61.83 ? 102 ARG B CD 1 ATOM 2881 N NE . ARG B 1 26 ? 87.099 2.180 38.781 1.00 75.59 ? 102 ARG B NE 1 ATOM 2882 C CZ . ARG B 1 26 ? 87.320 3.432 39.166 1.00 72.04 ? 102 ARG B CZ 1 ATOM 2883 N NH1 . ARG B 1 26 ? 86.935 3.838 40.369 1.00 70.99 ? 102 ARG B NH1 1 ATOM 2884 N NH2 . ARG B 1 26 ? 87.929 4.276 38.347 1.00 73.84 ? 102 ARG B NH2 1 ATOM 2885 N N . GLY B 1 27 ? 85.874 -3.057 36.473 1.00 64.74 ? 103 GLY B N 1 ATOM 2886 C CA . GLY B 1 27 ? 85.402 -3.263 35.121 1.00 56.80 ? 103 GLY B CA 1 ATOM 2887 C C . GLY B 1 27 ? 84.919 -1.996 34.440 1.00 61.68 ? 103 GLY B C 1 ATOM 2888 O O . GLY B 1 27 ? 84.621 -1.000 35.097 1.00 74.98 ? 103 GLY B O 1 ATOM 2889 N N . GLU B 1 28 ? 84.844 -2.040 33.114 1.00 65.43 ? 104 GLU B N 1 ATOM 2890 C CA . GLU B 1 28 ? 84.505 -0.866 32.333 1.00 74.62 ? 104 GLU B CA 1 ATOM 2891 C C . GLU B 1 28 ? 83.059 -0.441 32.593 1.00 85.17 ? 104 GLU B C 1 ATOM 2892 O O . GLU B 1 28 ? 82.716 0.735 32.457 1.00 87.86 ? 104 GLU B O 1 ATOM 2893 C CB . GLU B 1 28 ? 84.756 -1.139 30.839 1.00 71.70 ? 104 GLU B CB 1 ATOM 2894 C CG . GLU B 1 28 ? 85.481 -0.010 30.082 1.00 92.37 ? 104 GLU B CG 1 ATOM 2895 C CD . GLU B 1 28 ? 86.612 0.640 30.886 1.00 105.30 ? 104 GLU B CD 1 ATOM 2896 O OE1 . GLU B 1 28 ? 87.573 -0.077 31.249 1.00 96.90 ? 104 GLU B OE1 1 ATOM 2897 O OE2 . GLU B 1 28 ? 86.540 1.871 31.149 1.00 107.32 ? 104 GLU B OE2 1 ATOM 2898 N N . GLY B 1 29 ? 82.224 -1.398 32.992 1.00 87.56 ? 105 GLY B N 1 ATOM 2899 C CA . GLY B 1 29 ? 80.812 -1.145 33.231 1.00 85.23 ? 105 GLY B CA 1 ATOM 2900 C C . GLY B 1 29 ? 80.503 -0.535 34.587 1.00 77.19 ? 105 GLY B C 1 ATOM 2901 O O . GLY B 1 29 ? 79.359 -0.181 34.882 1.00 74.02 ? 105 GLY B O 1 ATOM 2902 N N . THR B 1 30 ? 81.525 -0.417 35.422 1.00 77.12 ? 106 THR B N 1 ATOM 2903 C CA . THR B 1 30 ? 81.395 0.321 36.669 1.00 84.63 ? 106 THR B CA 1 ATOM 2904 C C . THR B 1 30 ? 81.354 1.809 36.364 1.00 82.98 ? 106 THR B C 1 ATOM 2905 O O . THR B 1 30 ? 80.537 2.544 36.905 1.00 95.46 ? 106 THR B O 1 ATOM 2906 C CB . THR B 1 30 ? 82.607 0.078 37.573 1.00 100.68 ? 106 THR B CB 1 ATOM 2907 O OG1 . THR B 1 30 ? 82.847 -1.329 37.693 1.00 101.15 ? 106 THR B OG1 1 ATOM 2908 C CG2 . THR B 1 30 ? 82.376 0.672 38.947 1.00 106.15 ? 106 THR B CG2 1 ATOM 2909 N N . THR B 1 31 ? 82.251 2.228 35.475 1.00 94.20 ? 107 THR B N 1 ATOM 2910 C CA . THR B 1 31 ? 82.519 3.633 35.179 1.00 97.36 ? 107 THR B CA 1 ATOM 2911 C C . THR B 1 31 ? 81.879 4.096 33.870 1.00 98.55 ? 107 THR B C 1 ATOM 2912 O O . THR B 1 31 ? 82.264 5.132 33.316 1.00 96.35 ? 107 THR B O 1 ATOM 2913 C CB . THR B 1 31 ? 84.045 3.884 35.073 1.00 117.20 ? 107 THR B CB 1 ATOM 2914 O OG1 . THR B 1 31 ? 84.639 2.879 34.239 1.00 117.75 ? 107 THR B OG1 1 ATOM 2915 C CG2 . THR B 1 31 ? 84.699 3.824 36.438 1.00 116.43 ? 107 THR B CG2 1 ATOM 2916 N N . GLY B 1 32 ? 80.912 3.330 33.374 1.00 99.96 ? 108 GLY B N 1 ATOM 2917 C CA . GLY B 1 32 ? 80.263 3.650 32.114 1.00 97.77 ? 108 GLY B CA 1 ATOM 2918 C C . GLY B 1 32 ? 79.534 2.469 31.493 1.00 98.77 ? 108 GLY B C 1 ATOM 2919 O O . GLY B 1 32 ? 78.903 1.668 32.190 1.00 100.02 ? 108 GLY B O 1 ATOM 2920 N N . LYS B 1 33 ? 79.611 2.358 30.172 1.00 93.54 ? 109 LYS B N 1 ATOM 2921 C CA . LYS B 1 33 ? 78.948 1.265 29.469 1.00 86.87 ? 109 LYS B CA 1 ATOM 2922 C C . LYS B 1 33 ? 79.961 0.228 28.988 1.00 91.60 ? 109 LYS B C 1 ATOM 2923 O O . LYS B 1 33 ? 81.156 0.517 28.874 1.00 89.78 ? 109 LYS B O 1 ATOM 2924 C CB . LYS B 1 33 ? 78.126 1.798 28.297 1.00 91.51 ? 109 LYS B CB 1 ATOM 2925 C CG . LYS B 1 33 ? 77.033 2.776 28.699 1.00 103.11 ? 109 LYS B CG 1 ATOM 2926 C CD . LYS B 1 33 ? 75.649 2.212 28.420 1.00 108.58 ? 109 LYS B CD 1 ATOM 2927 C CE . LYS B 1 33 ? 74.682 3.327 28.074 1.00 115.63 ? 109 LYS B CE 1 ATOM 2928 N NZ . LYS B 1 33 ? 75.205 4.150 26.943 1.00 121.85 ? 109 LYS B NZ 1 ATOM 2929 N N . ILE B 1 34 ? 79.490 -0.983 28.713 1.00 86.20 ? 110 ILE B N 1 ATOM 2930 C CA . ILE B 1 34 ? 80.400 -2.038 28.293 1.00 84.86 ? 110 ILE B CA 1 ATOM 2931 C C . ILE B 1 34 ? 80.486 -2.159 26.783 1.00 90.46 ? 110 ILE B C 1 ATOM 2932 O O . ILE B 1 34 ? 79.460 -2.221 26.105 1.00 90.13 ? 110 ILE B O 1 ATOM 2933 C CB . ILE B 1 34 ? 79.986 -3.412 28.837 1.00 77.33 ? 110 ILE B CB 1 ATOM 2934 C CG1 . ILE B 1 34 ? 79.438 -3.289 30.252 1.00 71.51 ? 110 ILE B CG1 1 ATOM 2935 C CG2 . ILE B 1 34 ? 81.169 -4.378 28.798 1.00 68.59 ? 110 ILE B CG2 1 ATOM 2936 C CD1 . ILE B 1 34 ? 79.036 -4.615 30.856 1.00 56.45 ? 110 ILE B CD1 1 ATOM 2937 N N . PRO B 1 35 ? 81.722 -2.201 26.259 1.00 87.13 ? 111 PRO B N 1 ATOM 2938 C CA . PRO B 1 35 ? 82.002 -2.544 24.859 1.00 73.03 ? 111 PRO B CA 1 ATOM 2939 C C . PRO B 1 35 ? 81.286 -3.833 24.471 1.00 81.95 ? 111 PRO B C 1 ATOM 2940 O O . PRO B 1 35 ? 81.384 -4.822 25.207 1.00 92.47 ? 111 PRO B O 1 ATOM 2941 C CB . PRO B 1 35 ? 83.514 -2.776 24.866 1.00 73.22 ? 111 PRO B CB 1 ATOM 2942 C CG . PRO B 1 35 ? 84.021 -1.879 25.960 1.00 73.77 ? 111 PRO B CG 1 ATOM 2943 C CD . PRO B 1 35 ? 82.952 -1.888 27.018 1.00 79.62 ? 111 PRO B CD 1 ATOM 2944 N N . ASP B 1 36 ? 80.584 -3.830 23.338 1.00 86.29 ? 112 ASP B N 1 ATOM 2945 C CA . ASP B 1 36 ? 79.766 -4.983 22.943 1.00 95.02 ? 112 ASP B CA 1 ATOM 2946 C C . ASP B 1 36 ? 80.590 -6.098 22.294 1.00 95.75 ? 112 ASP B C 1 ATOM 2947 O O . ASP B 1 36 ? 80.073 -7.186 22.010 1.00 88.28 ? 112 ASP B O 1 ATOM 2948 C CB . ASP B 1 36 ? 78.622 -4.552 22.022 1.00 96.89 ? 112 ASP B CB 1 ATOM 2949 C CG . ASP B 1 36 ? 78.429 -3.051 22.002 1.00 103.02 ? 112 ASP B CG 1 ATOM 2950 O OD1 . ASP B 1 36 ? 79.336 -2.342 21.506 1.00 100.12 ? 112 ASP B OD1 1 ATOM 2951 O OD2 . ASP B 1 36 ? 77.374 -2.585 22.485 1.00 103.89 ? 112 ASP B OD2 1 ATOM 2952 N N . GLU B 1 37 ? 81.871 -5.816 22.061 1.00 105.46 ? 113 GLU B N 1 ATOM 2953 C CA . GLU B 1 37 ? 82.827 -6.832 21.630 1.00 116.80 ? 113 GLU B CA 1 ATOM 2954 C C . GLU B 1 37 ? 82.910 -7.902 22.712 1.00 116.21 ? 113 GLU B C 1 ATOM 2955 O O . GLU B 1 37 ? 82.964 -9.103 22.430 1.00 119.21 ? 113 GLU B O 1 ATOM 2956 C CB . GLU B 1 37 ? 84.212 -6.206 21.441 1.00 117.40 ? 113 GLU B CB 1 ATOM 2957 C CG . GLU B 1 37 ? 84.193 -4.777 20.912 1.00 124.32 ? 113 GLU B CG 1 ATOM 2958 C CD . GLU B 1 37 ? 85.039 -3.835 21.751 1.00 132.90 ? 113 GLU B CD 1 ATOM 2959 O OE1 . GLU B 1 37 ? 85.687 -4.311 22.709 1.00 146.36 ? 113 GLU B OE1 1 ATOM 2960 O OE2 . GLU B 1 37 ? 85.053 -2.620 21.457 1.00 122.24 ? 113 GLU B OE2 1 ATOM 2961 N N . GLN B 1 38 ? 82.912 -7.428 23.954 1.00 105.50 ? 114 GLN B N 1 ATOM 2962 C CA . GLN B 1 38 ? 82.966 -8.269 25.136 1.00 83.88 ? 114 GLN B CA 1 ATOM 2963 C C . GLN B 1 38 ? 81.758 -9.188 25.272 1.00 74.59 ? 114 GLN B C 1 ATOM 2964 O O . GLN B 1 38 ? 80.630 -8.821 24.924 1.00 71.82 ? 114 GLN B O 1 ATOM 2965 C CB . GLN B 1 38 ? 83.094 -7.405 26.385 1.00 78.45 ? 114 GLN B CB 1 ATOM 2966 C CG . GLN B 1 38 ? 84.477 -6.812 26.587 1.00 84.00 ? 114 GLN B CG 1 ATOM 2967 C CD . GLN B 1 38 ? 84.583 -6.059 27.899 1.00 90.91 ? 114 GLN B CD 1 ATOM 2968 O OE1 . GLN B 1 38 ? 83.777 -6.263 28.822 1.00 85.19 ? 114 GLN B OE1 1 ATOM 2969 N NE2 . GLN B 1 38 ? 85.576 -5.180 27.993 1.00 85.32 ? 114 GLN B NE2 1 ATOM 2970 N N . MET B 1 39 ? 82.025 -10.388 25.783 1.00 66.89 ? 115 MET B N 1 ATOM 2971 C CA . MET B 1 39 ? 81.002 -11.377 26.090 1.00 77.98 ? 115 MET B CA 1 ATOM 2972 C C . MET B 1 39 ? 80.055 -10.942 27.209 1.00 81.31 ? 115 MET B C 1 ATOM 2973 O O . MET B 1 39 ? 80.423 -10.142 28.084 1.00 83.90 ? 115 MET B O 1 ATOM 2974 C CB . MET B 1 39 ? 81.673 -12.669 26.534 1.00 77.33 ? 115 MET B CB 1 ATOM 2975 C CG . MET B 1 39 ? 81.966 -13.624 25.430 1.00 74.70 ? 115 MET B CG 1 ATOM 2976 S SD . MET B 1 39 ? 81.771 -15.304 26.028 1.00 100.38 ? 115 MET B SD 1 ATOM 2977 C CE . MET B 1 39 ? 80.472 -15.867 24.933 1.00 61.85 ? 115 MET B CE 1 ATOM 2978 N N . LEU B 1 40 ? 78.852 -11.508 27.195 1.00 73.93 ? 116 LEU B N 1 ATOM 2979 C CA . LEU B 1 40 ? 77.868 -11.243 28.231 1.00 72.37 ? 116 LEU B CA 1 ATOM 2980 C C . LEU B 1 40 ? 78.015 -12.179 29.448 1.00 77.71 ? 116 LEU B C 1 ATOM 2981 O O . LEU B 1 40 ? 77.314 -13.190 29.576 1.00 85.92 ? 116 LEU B O 1 ATOM 2982 C CB . LEU B 1 40 ? 76.471 -11.374 27.643 1.00 75.37 ? 116 LEU B CB 1 ATOM 2983 C CG . LEU B 1 40 ? 75.741 -10.078 27.335 1.00 73.66 ? 116 LEU B CG 1 ATOM 2984 C CD1 . LEU B 1 40 ? 76.670 -9.109 26.624 1.00 68.75 ? 116 LEU B CD1 1 ATOM 2985 C CD2 . LEU B 1 40 ? 74.520 -10.408 26.493 1.00 74.17 ? 116 LEU B CD2 1 ATOM 2986 N N . THR B 1 41 ? 78.910 -11.807 30.352 1.00 71.49 ? 117 THR B N 1 ATOM 2987 C CA . THR B 1 41 ? 79.225 -12.596 31.535 1.00 64.72 ? 117 THR B CA 1 ATOM 2988 C C . THR B 1 41 ? 78.082 -12.677 32.557 1.00 62.68 ? 117 THR B C 1 ATOM 2989 O O . THR B 1 41 ? 77.319 -11.727 32.723 1.00 64.51 ? 117 THR B O 1 ATOM 2990 C CB . THR B 1 41 ? 80.432 -11.978 32.249 1.00 65.99 ? 117 THR B CB 1 ATOM 2991 O OG1 . THR B 1 41 ? 80.032 -10.763 32.898 1.00 71.84 ? 117 THR B OG1 1 ATOM 2992 C CG2 . THR B 1 41 ? 81.544 -11.670 31.247 1.00 58.28 ? 117 THR B CG2 1 ATOM 2993 N N . ARG B 1 42 ? 77.966 -13.821 33.230 1.00 64.57 ? 118 ARG B N 1 ATOM 2994 C CA . ARG B 1 42 ? 77.178 -13.933 34.467 1.00 58.38 ? 118 ARG B CA 1 ATOM 2995 C C . ARG B 1 42 ? 77.810 -14.961 35.409 1.00 54.13 ? 118 ARG B C 1 ATOM 2996 O O . ARG B 1 42 ? 78.752 -15.654 35.015 1.00 50.47 ? 118 ARG B O 1 ATOM 2997 C CB . ARG B 1 42 ? 75.710 -14.255 34.202 1.00 60.13 ? 118 ARG B CB 1 ATOM 2998 C CG . ARG B 1 42 ? 75.400 -15.690 33.827 1.00 76.83 ? 118 ARG B CG 1 ATOM 2999 C CD . ARG B 1 42 ? 73.992 -15.754 33.256 1.00 88.06 ? 118 ARG B CD 1 ATOM 3000 N NE . ARG B 1 42 ? 73.818 -14.702 32.259 1.00 98.50 ? 118 ARG B NE 1 ATOM 3001 C CZ . ARG B 1 42 ? 72.678 -14.070 32.013 1.00 109.65 ? 118 ARG B CZ 1 ATOM 3002 N NH1 . ARG B 1 42 ? 71.580 -14.380 32.688 1.00 110.65 ? 118 ARG B NH1 1 ATOM 3003 N NH2 . ARG B 1 42 ? 72.640 -13.123 31.087 1.00 110.59 ? 118 ARG B NH2 1 ATOM 3004 N N . GLN B 1 43 ? 77.300 -15.046 36.643 1.00 53.62 ? 119 GLN B N 1 ATOM 3005 C CA . GLN B 1 43 ? 77.912 -15.850 37.712 1.00 45.86 ? 119 GLN B CA 1 ATOM 3006 C C . GLN B 1 43 ? 79.442 -15.656 37.781 1.00 46.91 ? 119 GLN B C 1 ATOM 3007 O O . GLN B 1 43 ? 80.195 -16.618 37.934 1.00 43.53 ? 119 GLN B O 1 ATOM 3008 C CB . GLN B 1 43 ? 77.542 -17.335 37.597 1.00 39.64 ? 119 GLN B CB 1 ATOM 3009 C CG . GLN B 1 43 ? 77.476 -18.085 38.938 1.00 57.96 ? 119 GLN B CG 1 ATOM 3010 C CD . GLN B 1 43 ? 78.347 -19.353 38.982 1.00 60.88 ? 119 GLN B CD 1 ATOM 3011 O OE1 . GLN B 1 43 ? 77.836 -20.476 39.045 1.00 58.72 ? 119 GLN B OE1 1 ATOM 3012 N NE2 . GLN B 1 43 ? 79.666 -19.169 38.972 1.00 52.05 ? 119 GLN B NE2 1 ATOM 3013 N N . ASN B 1 44 ? 79.885 -14.400 37.671 1.00 50.67 ? 120 ASN B N 1 ATOM 3014 C CA . ASN B 1 44 ? 81.295 -14.051 37.819 1.00 48.40 ? 120 ASN B CA 1 ATOM 3015 C C . ASN B 1 44 ? 81.864 -14.375 39.209 1.00 55.88 ? 120 ASN B C 1 ATOM 3016 O O . ASN B 1 44 ? 81.173 -14.259 40.227 1.00 58.44 ? 120 ASN B O 1 ATOM 3017 C CB . ASN B 1 44 ? 81.486 -12.554 37.580 1.00 52.69 ? 120 ASN B CB 1 ATOM 3018 C CG . ASN B 1 44 ? 81.333 -12.165 36.136 1.00 65.03 ? 120 ASN B CG 1 ATOM 3019 O OD1 . ASN B 1 44 ? 82.306 -12.176 35.367 1.00 65.76 ? 120 ASN B OD1 1 ATOM 3020 N ND2 . ASN B 1 44 ? 80.117 -11.786 35.756 1.00 61.70 ? 120 ASN B ND2 1 ATOM 3021 N N . PHE B 1 45 ? 83.134 -14.753 39.256 1.00 52.73 ? 121 PHE B N 1 ATOM 3022 C CA . PHE B 1 45 ? 83.823 -14.889 40.530 1.00 55.03 ? 121 PHE B CA 1 ATOM 3023 C C . PHE B 1 45 ? 85.308 -15.011 40.244 1.00 59.85 ? 121 PHE B C 1 ATOM 3024 O O . PHE B 1 45 ? 85.720 -15.182 39.090 1.00 51.84 ? 121 PHE B O 1 ATOM 3025 C CB . PHE B 1 45 ? 83.310 -16.096 41.327 1.00 43.05 ? 121 PHE B CB 1 ATOM 3026 C CG . PHE B 1 45 ? 83.644 -17.414 40.708 1.00 50.68 ? 121 PHE B CG 1 ATOM 3027 C CD1 . PHE B 1 45 ? 82.813 -17.979 39.748 1.00 46.52 ? 121 PHE B CD1 1 ATOM 3028 C CD2 . PHE B 1 45 ? 84.800 -18.099 41.081 1.00 52.51 ? 121 PHE B CD2 1 ATOM 3029 C CE1 . PHE B 1 45 ? 83.131 -19.207 39.180 1.00 56.94 ? 121 PHE B CE1 1 ATOM 3030 C CE2 . PHE B 1 45 ? 85.122 -19.327 40.512 1.00 51.78 ? 121 PHE B CE2 1 ATOM 3031 C CZ . PHE B 1 45 ? 84.286 -19.884 39.563 1.00 45.82 ? 121 PHE B CZ 1 ATOM 3032 N N . VAL B 1 46 ? 86.116 -14.920 41.289 1.00 56.22 ? 122 VAL B N 1 ATOM 3033 C CA . VAL B 1 46 ? 87.553 -14.920 41.090 1.00 50.63 ? 122 VAL B CA 1 ATOM 3034 C C . VAL B 1 46 ? 88.219 -16.069 41.816 1.00 57.29 ? 122 VAL B C 1 ATOM 3035 O O . VAL B 1 46 ? 87.934 -16.344 42.987 1.00 64.41 ? 122 VAL B O 1 ATOM 3036 C CB . VAL B 1 46 ? 88.183 -13.574 41.493 1.00 43.27 ? 122 VAL B CB 1 ATOM 3037 C CG1 . VAL B 1 46 ? 89.701 -13.676 41.544 1.00 40.32 ? 122 VAL B CG1 1 ATOM 3038 C CG2 . VAL B 1 46 ? 87.752 -12.490 40.514 1.00 40.98 ? 122 VAL B CG2 1 ATOM 3039 N N . SER B 1 47 ? 89.093 -16.760 41.095 1.00 57.53 ? 123 SER B N 1 ATOM 3040 C CA . SER B 1 47 ? 89.897 -17.811 41.691 1.00 55.35 ? 123 SER B CA 1 ATOM 3041 C C . SER B 1 47 ? 91.356 -17.627 41.261 1.00 54.55 ? 123 SER B C 1 ATOM 3042 O O . SER B 1 47 ? 91.639 -17.124 40.176 1.00 62.67 ? 123 SER B O 1 ATOM 3043 C CB . SER B 1 47 ? 89.345 -19.194 41.339 1.00 53.53 ? 123 SER B CB 1 ATOM 3044 O OG . SER B 1 47 ? 90.021 -20.205 42.068 1.00 61.23 ? 123 SER B OG 1 ATOM 3045 N N . CYS B 1 48 ? 92.278 -18.011 42.132 1.00 59.96 ? 124 CYS B N 1 ATOM 3046 C CA . CYS B 1 48 ? 93.691 -17.725 41.917 1.00 51.09 ? 124 CYS B CA 1 ATOM 3047 C C . CYS B 1 48 ? 94.547 -18.974 41.851 1.00 56.59 ? 124 CYS B C 1 ATOM 3048 O O . CYS B 1 48 ? 94.241 -20.001 42.460 1.00 71.97 ? 124 CYS B O 1 ATOM 3049 C CB . CYS B 1 48 ? 94.207 -16.812 43.034 1.00 50.29 ? 124 CYS B CB 1 ATOM 3050 S SG . CYS B 1 48 ? 93.423 -15.208 42.964 1.00 78.62 ? 124 CYS B SG 1 ATOM 3051 N N . SER B 1 49 ? 95.624 -18.886 41.090 1.00 62.59 ? 125 SER B N 1 ATOM 3052 C CA . SER B 1 49 ? 96.552 -19.993 40.999 1.00 59.22 ? 125 SER B CA 1 ATOM 3053 C C . SER B 1 49 ? 97.864 -19.563 41.605 1.00 72.17 ? 125 SER B C 1 ATOM 3054 O O . SER B 1 49 ? 97.965 -18.515 42.256 1.00 81.58 ? 125 SER B O 1 ATOM 3055 C CB . SER B 1 49 ? 96.792 -20.371 39.543 1.00 56.64 ? 125 SER B CB 1 ATOM 3056 O OG . SER B 1 49 ? 97.711 -19.469 38.946 1.00 60.60 ? 125 SER B OG 1 ATOM 3057 N N . ASP B 1 50 ? 98.871 -20.389 41.367 1.00 83.16 ? 126 ASP B N 1 ATOM 3058 C CA . ASP B 1 50 ? 100.238 -20.122 41.790 1.00 93.33 ? 126 ASP B CA 1 ATOM 3059 C C . ASP B 1 50 ? 100.869 -19.002 40.949 1.00 84.16 ? 126 ASP B C 1 ATOM 3060 O O . ASP B 1 50 ? 101.900 -18.444 41.318 1.00 82.97 ? 126 ASP B O 1 ATOM 3061 C CB . ASP B 1 50 ? 101.056 -21.412 41.657 1.00 99.23 ? 126 ASP B CB 1 ATOM 3062 C CG . ASP B 1 50 ? 101.027 -21.986 40.232 1.00 99.43 ? 126 ASP B CG 1 ATOM 3063 O OD1 . ASP B 1 50 ? 100.025 -21.792 39.501 1.00 94.07 ? 126 ASP B OD1 1 ATOM 3064 O OD2 . ASP B 1 50 ? 102.011 -22.644 39.842 1.00 99.53 ? 126 ASP B OD2 1 ATOM 3065 N N . LYS B 1 51 ? 100.238 -18.681 39.822 1.00 71.23 ? 127 LYS B N 1 ATOM 3066 C CA . LYS B 1 51 ? 100.789 -17.720 38.865 1.00 87.31 ? 127 LYS B CA 1 ATOM 3067 C C . LYS B 1 51 ? 99.920 -16.470 38.642 1.00 83.33 ? 127 LYS B C 1 ATOM 3068 O O . LYS B 1 51 ? 100.457 -15.379 38.437 1.00 84.41 ? 127 LYS B O 1 ATOM 3069 C CB . LYS B 1 51 ? 101.092 -18.416 37.522 1.00 86.10 ? 127 LYS B CB 1 ATOM 3070 C CG . LYS B 1 51 ? 102.148 -19.520 37.605 1.00 99.07 ? 127 LYS B CG 1 ATOM 3071 C CD . LYS B 1 51 ? 103.562 -18.933 37.724 1.00 112.32 ? 127 LYS B CD 1 ATOM 3072 C CE . LYS B 1 51 ? 104.598 -19.959 38.203 1.00 113.31 ? 127 LYS B CE 1 ATOM 3073 N NZ . LYS B 1 51 ? 105.988 -19.393 38.188 1.00 104.92 ? 127 LYS B NZ 1 ATOM 3074 N N . GLU B 1 52 ? 98.597 -16.626 38.685 1.00 67.54 ? 128 GLU B N 1 ATOM 3075 C CA . GLU B 1 52 ? 97.699 -15.520 38.358 1.00 68.67 ? 128 GLU B CA 1 ATOM 3076 C C . GLU B 1 52 ? 96.326 -15.649 39.016 1.00 70.38 ? 128 GLU B C 1 ATOM 3077 O O . GLU B 1 52 ? 95.934 -16.733 39.462 1.00 64.30 ? 128 GLU B O 1 ATOM 3078 C CB . GLU B 1 52 ? 97.499 -15.449 36.841 1.00 66.41 ? 128 GLU B CB 1 ATOM 3079 C CG . GLU B 1 52 ? 96.651 -16.600 36.299 1.00 69.19 ? 128 GLU B CG 1 ATOM 3080 C CD . GLU B 1 52 ? 96.600 -16.658 34.778 1.00 80.55 ? 128 GLU B CD 1 ATOM 3081 O OE1 . GLU B 1 52 ? 97.308 -15.861 34.107 1.00 93.69 ? 128 GLU B OE1 1 ATOM 3082 O OE2 . GLU B 1 52 ? 95.852 -17.513 34.249 1.00 70.93 ? 128 GLU B OE2 1 ATOM 3083 N N . CYS B 1 53 ? 95.589 -14.541 39.054 1.00 69.78 ? 129 CYS B N 1 ATOM 3084 C CA . CYS B 1 53 ? 94.164 -14.597 39.384 1.00 68.65 ? 129 CYS B CA 1 ATOM 3085 C C . CYS B 1 53 ? 93.349 -14.591 38.107 1.00 63.72 ? 129 CYS B C 1 ATOM 3086 O O . CYS B 1 53 ? 93.700 -13.899 37.131 1.00 58.09 ? 129 CYS B O 1 ATOM 3087 C CB . CYS B 1 53 ? 93.739 -13.439 40.281 1.00 64.61 ? 129 CYS B CB 1 ATOM 3088 S SG . CYS B 1 53 ? 94.311 -13.665 41.961 1.00 83.79 ? 129 CYS B SG 1 ATOM 3089 N N . ARG B 1 54 ? 92.268 -15.368 38.113 1.00 49.84 ? 130 ARG B N 1 ATOM 3090 C CA . ARG B 1 54 ? 91.431 -15.482 36.934 1.00 50.74 ? 130 ARG B CA 1 ATOM 3091 C C . ARG B 1 54 ? 89.991 -15.199 37.252 1.00 57.06 ? 130 ARG B C 1 ATOM 3092 O O . ARG B 1 54 ? 89.468 -15.573 38.316 1.00 60.07 ? 130 ARG B O 1 ATOM 3093 C CB . ARG B 1 54 ? 91.547 -16.869 36.287 1.00 60.72 ? 130 ARG B CB 1 ATOM 3094 C CG . ARG B 1 54 ? 92.923 -17.182 35.731 1.00 56.37 ? 130 ARG B CG 1 ATOM 3095 C CD . ARG B 1 54 ? 92.929 -18.485 34.956 1.00 58.52 ? 130 ARG B CD 1 ATOM 3096 N NE . ARG B 1 54 ? 92.101 -18.427 33.747 1.00 51.85 ? 130 ARG B NE 1 ATOM 3097 C CZ . ARG B 1 54 ? 92.472 -17.849 32.603 1.00 47.50 ? 130 ARG B CZ 1 ATOM 3098 N NH1 . ARG B 1 54 ? 93.665 -17.245 32.508 1.00 34.19 ? 130 ARG B NH1 1 ATOM 3099 N NH2 . ARG B 1 54 ? 91.640 -17.865 31.557 1.00 36.78 ? 130 ARG B NH2 1 ATOM 3100 N N . ARG B 1 55 ? 89.355 -14.540 36.294 1.00 56.60 ? 131 ARG B N 1 ATOM 3101 C CA . ARG B 1 55 ? 87.938 -14.260 36.357 1.00 50.33 ? 131 ARG B CA 1 ATOM 3102 C C . ARG B 1 55 ? 87.169 -15.361 35.643 1.00 49.97 ? 131 ARG B C 1 ATOM 3103 O O . ARG B 1 55 ? 87.267 -15.501 34.431 1.00 68.19 ? 131 ARG B O 1 ATOM 3104 C CB . ARG B 1 55 ? 87.673 -12.913 35.697 1.00 51.00 ? 131 ARG B CB 1 ATOM 3105 C CG . ARG B 1 55 ? 86.225 -12.534 35.627 1.00 53.56 ? 131 ARG B CG 1 ATOM 3106 C CD . ARG B 1 55 ? 86.052 -11.222 34.896 1.00 57.12 ? 131 ARG B CD 1 ATOM 3107 N NE . ARG B 1 55 ? 84.643 -10.968 34.625 1.00 60.28 ? 131 ARG B NE 1 ATOM 3108 C CZ . ARG B 1 55 ? 84.199 -9.915 33.958 1.00 61.10 ? 131 ARG B CZ 1 ATOM 3109 N NH1 . ARG B 1 55 ? 85.064 -9.015 33.499 1.00 65.73 ? 131 ARG B NH1 1 ATOM 3110 N NH2 . ARG B 1 55 ? 82.899 -9.767 33.750 1.00 55.45 ? 131 ARG B NH2 1 ATOM 3111 N N . PHE B 1 56 ? 86.417 -16.144 36.408 1.00 58.09 ? 132 PHE B N 1 ATOM 3112 C CA . PHE B 1 56 ? 85.499 -17.143 35.872 1.00 50.82 ? 132 PHE B CA 1 ATOM 3113 C C . PHE B 1 56 ? 84.076 -16.590 35.782 1.00 54.34 ? 132 PHE B C 1 ATOM 3114 O O . PHE B 1 56 ? 83.666 -15.755 36.593 1.00 64.10 ? 132 PHE B O 1 ATOM 3115 C CB . PHE B 1 56 ? 85.491 -18.382 36.768 1.00 44.85 ? 132 PHE B CB 1 ATOM 3116 C CG . PHE B 1 56 ? 86.740 -19.192 36.682 1.00 43.66 ? 132 PHE B CG 1 ATOM 3117 C CD1 . PHE B 1 56 ? 87.899 -18.775 37.330 1.00 49.52 ? 132 PHE B CD1 1 ATOM 3118 C CD2 . PHE B 1 56 ? 86.772 -20.371 35.933 1.00 40.30 ? 132 PHE B CD2 1 ATOM 3119 C CE1 . PHE B 1 56 ? 89.082 -19.523 37.241 1.00 57.24 ? 132 PHE B CE1 1 ATOM 3120 C CE2 . PHE B 1 56 ? 87.952 -21.133 35.834 1.00 35.79 ? 132 PHE B CE2 1 ATOM 3121 C CZ . PHE B 1 56 ? 89.108 -20.705 36.489 1.00 48.66 ? 132 PHE B CZ 1 ATOM 3122 N N . PHE B 1 57 ? 83.323 -17.078 34.803 1.00 48.77 ? 133 PHE B N 1 ATOM 3123 C CA . PHE B 1 57 ? 81.927 -16.689 34.618 1.00 59.10 ? 133 PHE B CA 1 ATOM 3124 C C . PHE B 1 57 ? 81.210 -17.691 33.710 1.00 58.42 ? 133 PHE B C 1 ATOM 3125 O O . PHE B 1 57 ? 81.826 -18.595 33.146 1.00 57.18 ? 133 PHE B O 1 ATOM 3126 C CB . PHE B 1 57 ? 81.830 -15.291 33.999 1.00 64.77 ? 133 PHE B CB 1 ATOM 3127 C CG . PHE B 1 57 ? 82.555 -15.164 32.698 1.00 63.60 ? 133 PHE B CG 1 ATOM 3128 C CD1 . PHE B 1 57 ? 81.914 -15.456 31.496 1.00 62.69 ? 133 PHE B CD1 1 ATOM 3129 C CD2 . PHE B 1 57 ? 83.891 -14.770 32.675 1.00 63.46 ? 133 PHE B CD2 1 ATOM 3130 C CE1 . PHE B 1 57 ? 82.591 -15.348 30.284 1.00 58.51 ? 133 PHE B CE1 1 ATOM 3131 C CE2 . PHE B 1 57 ? 84.581 -14.664 31.468 1.00 69.71 ? 133 PHE B CE2 1 ATOM 3132 C CZ . PHE B 1 57 ? 83.928 -14.952 30.270 1.00 56.64 ? 133 PHE B CZ 1 ATOM 3133 N N . VAL B 1 58 ? 79.901 -17.514 33.586 1.00 59.86 ? 134 VAL B N 1 ATOM 3134 C CA . VAL B 1 58 ? 79.063 -18.321 32.715 1.00 48.68 ? 134 VAL B CA 1 ATOM 3135 C C . VAL B 1 58 ? 78.482 -17.372 31.660 1.00 60.93 ? 134 VAL B C 1 ATOM 3136 O O . VAL B 1 58 ? 78.088 -16.247 31.979 1.00 63.91 ? 134 VAL B O 1 ATOM 3137 C CB . VAL B 1 58 ? 77.938 -19.016 33.535 1.00 50.72 ? 134 VAL B CB 1 ATOM 3138 C CG1 . VAL B 1 58 ? 76.690 -19.238 32.697 1.00 65.25 ? 134 VAL B CG1 1 ATOM 3139 C CG2 . VAL B 1 58 ? 78.437 -20.337 34.140 1.00 40.20 ? 134 VAL B CG2 1 ATOM 3140 N N . SER B 1 59 ? 78.458 -17.797 30.402 1.00 66.73 ? 135 SER B N 1 ATOM 3141 C CA . SER B 1 59 ? 77.909 -16.948 29.348 1.00 70.23 ? 135 SER B CA 1 ATOM 3142 C C . SER B 1 59 ? 77.109 -17.740 28.340 1.00 82.50 ? 135 SER B C 1 ATOM 3143 O O . SER B 1 59 ? 77.024 -18.969 28.409 1.00 78.26 ? 135 SER B O 1 ATOM 3144 C CB . SER B 1 59 ? 79.011 -16.180 28.614 1.00 68.14 ? 135 SER B CB 1 ATOM 3145 O OG . SER B 1 59 ? 78.450 -15.199 27.753 1.00 68.13 ? 135 SER B OG 1 ATOM 3146 N N . MET B 1 60 ? 76.509 -17.014 27.408 1.00 93.27 ? 136 MET B N 1 ATOM 3147 C CA . MET B 1 60 ? 75.721 -17.620 26.353 1.00 87.16 ? 136 MET B CA 1 ATOM 3148 C C . MET B 1 60 ? 76.354 -17.281 24.999 1.00 86.76 ? 136 MET B C 1 ATOM 3149 O O . MET B 1 60 ? 76.541 -18.149 24.141 1.00 84.59 ? 136 MET B O 1 ATOM 3150 C CB . MET B 1 60 ? 74.299 -17.075 26.427 1.00 73.67 ? 136 MET B CB 1 ATOM 3151 C CG . MET B 1 60 ? 73.239 -18.140 26.534 1.00 80.12 ? 136 MET B CG 1 ATOM 3152 S SD . MET B 1 60 ? 71.611 -17.376 26.617 1.00 145.26 ? 136 MET B SD 1 ATOM 3153 C CE . MET B 1 60 ? 70.566 -18.820 26.604 1.00 115.28 ? 136 MET B CE 1 ATOM 3154 N N . GLY B 1 61 ? 76.699 -16.006 24.849 1.00 93.70 ? 137 GLY B N 1 ATOM 3155 C CA . GLY B 1 61 ? 77.282 -15.467 23.639 1.00 100.33 ? 137 GLY B CA 1 ATOM 3156 C C . GLY B 1 61 ? 77.568 -13.986 23.831 1.00 105.07 ? 137 GLY B C 1 ATOM 3157 O O . GLY B 1 61 ? 78.134 -13.571 24.853 1.00 112.49 ? 137 GLY B O 1 ATOM 3158 N N . TYR B 1 62 ? 77.138 -13.171 22.874 1.00 102.61 ? 138 TYR B N 1 ATOM 3159 C CA . TYR B 1 62 ? 77.581 -11.777 22.833 1.00 103.83 ? 138 TYR B CA 1 ATOM 3160 C C . TYR B 1 62 ? 76.471 -10.709 22.935 1.00 97.96 ? 138 TYR B C 1 ATOM 3161 O O . TYR B 1 62 ? 75.544 -10.639 22.120 1.00 85.65 ? 138 TYR B O 1 ATOM 3162 C CB . TYR B 1 62 ? 78.484 -11.562 21.606 1.00 102.63 ? 138 TYR B CB 1 ATOM 3163 C CG . TYR B 1 62 ? 79.777 -12.371 21.648 1.00 85.35 ? 138 TYR B CG 1 ATOM 3164 C CD1 . TYR B 1 62 ? 79.811 -13.712 21.253 1.00 70.84 ? 138 TYR B CD1 1 ATOM 3165 C CD2 . TYR B 1 62 ? 80.964 -11.789 22.093 1.00 87.95 ? 138 TYR B CD2 1 ATOM 3166 C CE1 . TYR B 1 62 ? 81.000 -14.447 21.301 1.00 74.42 ? 138 TYR B CE1 1 ATOM 3167 C CE2 . TYR B 1 62 ? 82.151 -12.511 22.141 1.00 89.80 ? 138 TYR B CE2 1 ATOM 3168 C CZ . TYR B 1 62 ? 82.171 -13.832 21.746 1.00 85.94 ? 138 TYR B CZ 1 ATOM 3169 O OH . TYR B 1 62 ? 83.372 -14.513 21.807 1.00 86.76 ? 138 TYR B OH 1 ATOM 3170 N N . VAL B 1 73 ? 69.003 -22.136 34.719 1.00 121.40 ? 149 VAL B N 1 ATOM 3171 C CA . VAL B 1 73 ? 68.830 -23.363 33.942 1.00 133.69 ? 149 VAL B CA 1 ATOM 3172 C C . VAL B 1 73 ? 68.587 -23.080 32.441 1.00 134.49 ? 149 VAL B C 1 ATOM 3173 O O . VAL B 1 73 ? 67.494 -23.342 31.911 1.00 134.01 ? 149 VAL B O 1 ATOM 3174 C CB . VAL B 1 73 ? 67.704 -24.269 34.541 1.00 103.31 ? 149 VAL B CB 1 ATOM 3175 C CG1 . VAL B 1 73 ? 67.813 -25.705 34.021 1.00 88.69 ? 149 VAL B CG1 1 ATOM 3176 C CG2 . VAL B 1 73 ? 67.764 -24.257 36.076 1.00 95.42 ? 149 VAL B CG2 1 ATOM 3177 N N . SER B 1 74 ? 69.605 -22.534 31.767 1.00 125.22 ? 150 SER B N 1 ATOM 3178 C CA . SER B 1 74 ? 69.585 -22.401 30.302 1.00 119.91 ? 150 SER B CA 1 ATOM 3179 C C . SER B 1 74 ? 70.597 -23.375 29.685 1.00 115.46 ? 150 SER B C 1 ATOM 3180 O O . SER B 1 74 ? 71.730 -23.483 30.151 1.00 102.22 ? 150 SER B O 1 ATOM 3181 C CB . SER B 1 74 ? 69.875 -20.954 29.862 1.00 109.17 ? 150 SER B CB 1 ATOM 3182 O OG . SER B 1 74 ? 69.340 -20.685 28.575 1.00 84.25 ? 150 SER B OG 1 ATOM 3183 N N . GLU B 1 75 ? 70.183 -24.085 28.642 1.00 121.66 ? 151 GLU B N 1 ATOM 3184 C CA . GLU B 1 75 ? 70.995 -25.159 28.082 1.00 122.78 ? 151 GLU B CA 1 ATOM 3185 C C . GLU B 1 75 ? 72.066 -24.650 27.113 1.00 115.10 ? 151 GLU B C 1 ATOM 3186 O O . GLU B 1 75 ? 72.935 -25.409 26.675 1.00 114.90 ? 151 GLU B O 1 ATOM 3187 C CB . GLU B 1 75 ? 70.086 -26.175 27.388 1.00 134.09 ? 151 GLU B CB 1 ATOM 3188 C CG . GLU B 1 75 ? 70.608 -27.603 27.385 1.00 144.50 ? 151 GLU B CG 1 ATOM 3189 C CD . GLU B 1 75 ? 70.826 -28.154 28.782 1.00 146.96 ? 151 GLU B CD 1 ATOM 3190 O OE1 . GLU B 1 75 ? 69.823 -28.464 29.468 1.00 146.35 ? 151 GLU B OE1 1 ATOM 3191 O OE2 . GLU B 1 75 ? 72.000 -28.274 29.195 1.00 144.78 ? 151 GLU B OE2 1 ATOM 3192 N N . GLN B 1 76 ? 72.008 -23.364 26.790 1.00 111.06 ? 152 GLN B N 1 ATOM 3193 C CA . GLN B 1 76 ? 72.912 -22.793 25.802 1.00 107.70 ? 152 GLN B CA 1 ATOM 3194 C C . GLN B 1 76 ? 74.136 -22.183 26.465 1.00 92.38 ? 152 GLN B C 1 ATOM 3195 O O . GLN B 1 76 ? 74.944 -21.511 25.810 1.00 81.37 ? 152 GLN B O 1 ATOM 3196 C CB . GLN B 1 76 ? 72.174 -21.732 24.993 1.00 126.09 ? 152 GLN B CB 1 ATOM 3197 C CG . GLN B 1 76 ? 70.716 -22.098 24.765 1.00 135.25 ? 152 GLN B CG 1 ATOM 3198 C CD . GLN B 1 76 ? 70.026 -21.199 23.765 1.00 135.04 ? 152 GLN B CD 1 ATOM 3199 O OE1 . GLN B 1 76 ? 70.597 -20.217 23.289 1.00 129.44 ? 152 GLN B OE1 1 ATOM 3200 N NE2 . GLN B 1 76 ? 68.784 -21.533 23.439 1.00 135.94 ? 152 GLN B NE2 1 ATOM 3201 N N . MET B 1 77 ? 74.275 -22.421 27.769 1.00 87.41 ? 156 MET B N 1 ATOM 3202 C CA . MET B 1 77 ? 75.345 -21.780 28.528 1.00 65.72 ? 156 MET B CA 1 ATOM 3203 C C . MET B 1 77 ? 76.576 -22.639 28.729 1.00 58.15 ? 156 MET B C 1 ATOM 3204 O O . MET B 1 77 ? 76.497 -23.872 28.826 1.00 56.09 ? 156 MET B O 1 ATOM 3205 C CB . MET B 1 77 ? 74.865 -21.311 29.887 1.00 48.59 ? 156 MET B CB 1 ATOM 3206 C CG . MET B 1 77 ? 73.465 -20.822 29.890 1.00 74.90 ? 156 MET B CG 1 ATOM 3207 S SD . MET B 1 77 ? 73.360 -19.366 30.924 1.00 81.11 ? 156 MET B SD 1 ATOM 3208 C CE . MET B 1 77 ? 74.393 -18.255 29.960 1.00 54.35 ? 156 MET B CE 1 ATOM 3209 N N . ASN B 1 78 ? 77.706 -21.939 28.819 1.00 41.84 ? 157 ASN B N 1 ATOM 3210 C CA . ASN B 1 78 ? 78.996 -22.535 29.046 1.00 56.82 ? 157 ASN B CA 1 ATOM 3211 C C . ASN B 1 78 ? 79.807 -21.776 30.092 1.00 69.20 ? 157 ASN B C 1 ATOM 3212 O O . ASN B 1 78 ? 79.517 -20.623 30.413 1.00 70.98 ? 157 ASN B O 1 ATOM 3213 C CB . ASN B 1 78 ? 79.750 -22.635 27.724 1.00 67.07 ? 157 ASN B CB 1 ATOM 3214 C CG . ASN B 1 78 ? 79.071 -23.583 26.760 1.00 67.01 ? 157 ASN B CG 1 ATOM 3215 O OD1 . ASN B 1 78 ? 79.102 -24.799 26.946 1.00 73.16 ? 157 ASN B OD1 1 ATOM 3216 N ND2 . ASN B 1 78 ? 78.419 -23.032 25.750 1.00 48.08 ? 157 ASN B ND2 1 ATOM 3217 N N . VAL B 1 79 ? 80.819 -22.446 30.628 1.00 64.21 ? 158 VAL B N 1 ATOM 3218 C CA . VAL B 1 79 ? 81.696 -21.838 31.606 1.00 61.93 ? 158 VAL B CA 1 ATOM 3219 C C . VAL B 1 79 ? 82.980 -21.375 30.929 1.00 55.84 ? 158 VAL B C 1 ATOM 3220 O O . VAL B 1 79 ? 83.636 -22.152 30.222 1.00 57.21 ? 158 VAL B O 1 ATOM 3221 C CB . VAL B 1 79 ? 82.031 -22.830 32.749 1.00 54.82 ? 158 VAL B CB 1 ATOM 3222 C CG1 . VAL B 1 79 ? 82.866 -22.144 33.792 1.00 33.07 ? 158 VAL B CG1 1 ATOM 3223 C CG2 . VAL B 1 79 ? 80.748 -23.394 33.378 1.00 45.63 ? 158 VAL B CG2 1 ATOM 3224 N N . TYR B 1 80 ? 83.323 -20.106 31.134 1.00 53.51 ? 159 TYR B N 1 ATOM 3225 C CA . TYR B 1 80 ? 84.577 -19.544 30.621 1.00 53.47 ? 159 TYR B CA 1 ATOM 3226 C C . TYR B 1 80 ? 85.394 -18.853 31.708 1.00 57.97 ? 159 TYR B C 1 ATOM 3227 O O . TYR B 1 80 ? 84.978 -18.740 32.865 1.00 58.87 ? 159 TYR B O 1 ATOM 3228 C CB . TYR B 1 80 ? 84.328 -18.498 29.527 1.00 45.41 ? 159 TYR B CB 1 ATOM 3229 C CG . TYR B 1 80 ? 83.443 -18.939 28.404 1.00 49.97 ? 159 TYR B CG 1 ATOM 3230 C CD1 . TYR B 1 80 ? 82.058 -18.954 28.557 1.00 49.84 ? 159 TYR B CD1 1 ATOM 3231 C CD2 . TYR B 1 80 ? 83.981 -19.333 27.180 1.00 56.15 ? 159 TYR B CD2 1 ATOM 3232 C CE1 . TYR B 1 80 ? 81.224 -19.359 27.530 1.00 55.02 ? 159 TYR B CE1 1 ATOM 3233 C CE2 . TYR B 1 80 ? 83.145 -19.734 26.124 1.00 58.54 ? 159 TYR B CE2 1 ATOM 3234 C CZ . TYR B 1 80 ? 81.768 -19.743 26.314 1.00 58.79 ? 159 TYR B CZ 1 ATOM 3235 O OH . TYR B 1 80 ? 80.925 -20.144 25.304 1.00 54.16 ? 159 TYR B OH 1 ATOM 3236 N N . SER B 1 81 ? 86.544 -18.343 31.291 1.00 48.38 ? 160 SER B N 1 ATOM 3237 C CA . SER B 1 81 ? 87.448 -17.665 32.186 1.00 54.82 ? 160 SER B CA 1 ATOM 3238 C C . SER B 1 81 ? 88.388 -16.769 31.380 1.00 59.24 ? 160 SER B C 1 ATOM 3239 O O . SER B 1 81 ? 88.635 -17.021 30.207 1.00 68.54 ? 160 SER B O 1 ATOM 3240 C CB . SER B 1 81 ? 88.242 -18.686 33.017 1.00 55.95 ? 160 SER B CB 1 ATOM 3241 O OG . SER B 1 81 ? 89.525 -18.948 32.465 1.00 57.34 ? 160 SER B OG 1 ATOM 3242 N N . VAL B 1 82 ? 88.867 -15.702 32.010 1.00 55.88 ? 161 VAL B N 1 ATOM 3243 C CA . VAL B 1 82 ? 89.933 -14.873 31.469 1.00 53.10 ? 161 VAL B CA 1 ATOM 3244 C C . VAL B 1 82 ? 90.829 -14.556 32.651 1.00 58.26 ? 161 VAL B C 1 ATOM 3245 O O . VAL B 1 82 ? 90.453 -14.785 33.801 1.00 66.94 ? 161 VAL B O 1 ATOM 3246 C CB . VAL B 1 82 ? 89.397 -13.545 30.862 1.00 62.85 ? 161 VAL B CB 1 ATOM 3247 C CG1 . VAL B 1 82 ? 88.661 -13.802 29.560 1.00 67.31 ? 161 VAL B CG1 1 ATOM 3248 C CG2 . VAL B 1 82 ? 88.483 -12.833 31.854 1.00 59.34 ? 161 VAL B CG2 1 ATOM 3249 N N . LYS B 1 83 ? 92.019 -14.047 32.374 1.00 60.80 ? 162 LYS B N 1 ATOM 3250 C CA . LYS B 1 83 ? 92.900 -13.574 33.430 1.00 58.07 ? 162 LYS B CA 1 ATOM 3251 C C . LYS B 1 83 ? 92.259 -12.315 34.000 1.00 65.07 ? 162 LYS B C 1 ATOM 3252 O O . LYS B 1 83 ? 91.688 -11.516 33.255 1.00 71.89 ? 162 LYS B O 1 ATOM 3253 C CB . LYS B 1 83 ? 94.269 -13.256 32.829 1.00 50.47 ? 162 LYS B CB 1 ATOM 3254 C CG . LYS B 1 83 ? 95.331 -12.752 33.773 1.00 53.22 ? 162 LYS B CG 1 ATOM 3255 C CD . LYS B 1 83 ? 96.648 -12.535 33.009 1.00 57.57 ? 162 LYS B CD 1 ATOM 3256 C CE . LYS B 1 83 ? 97.673 -11.809 33.886 1.00 79.52 ? 162 LYS B CE 1 ATOM 3257 N NZ . LYS B 1 83 ? 98.770 -11.148 33.113 1.00 84.74 ? 162 LYS B NZ 1 ATOM 3258 N N . LEU B 1 84 ? 92.315 -12.150 35.318 1.00 71.54 ? 163 LEU B N 1 ATOM 3259 C CA . LEU B 1 84 ? 91.813 -10.928 35.938 1.00 68.81 ? 163 LEU B CA 1 ATOM 3260 C C . LEU B 1 84 ? 92.618 -9.738 35.420 1.00 65.26 ? 163 LEU B C 1 ATOM 3261 O O . LEU B 1 84 ? 93.852 -9.707 35.559 1.00 62.03 ? 163 LEU B O 1 ATOM 3262 C CB . LEU B 1 84 ? 91.939 -11.018 37.457 1.00 57.73 ? 163 LEU B CB 1 ATOM 3263 C CG . LEU B 1 84 ? 91.091 -10.040 38.261 1.00 55.85 ? 163 LEU B CG 1 ATOM 3264 C CD1 . LEU B 1 84 ? 89.629 -10.149 37.846 1.00 56.41 ? 163 LEU B CD1 1 ATOM 3265 C CD2 . LEU B 1 84 ? 91.270 -10.311 39.751 1.00 56.89 ? 163 LEU B CD2 1 ATOM 3266 N N . GLY B 1 85 ? 91.929 -8.775 34.811 1.00 63.33 ? 164 GLY B N 1 ATOM 3267 C CA . GLY B 1 85 ? 92.598 -7.594 34.287 1.00 74.91 ? 164 GLY B CA 1 ATOM 3268 C C . GLY B 1 85 ? 92.502 -7.497 32.779 1.00 82.89 ? 164 GLY B C 1 ATOM 3269 O O . GLY B 1 85 ? 92.593 -6.409 32.202 1.00 78.75 ? 164 GLY B O 1 ATOM 3270 N N . ASP B 1 86 ? 92.330 -8.652 32.141 1.00 86.20 ? 165 ASP B N 1 ATOM 3271 C CA . ASP B 1 86 ? 92.024 -8.720 30.713 1.00 75.59 ? 165 ASP B CA 1 ATOM 3272 C C . ASP B 1 86 ? 90.514 -8.619 30.542 1.00 72.72 ? 165 ASP B C 1 ATOM 3273 O O . ASP B 1 86 ? 89.766 -8.901 31.480 1.00 75.36 ? 165 ASP B O 1 ATOM 3274 C CB . ASP B 1 86 ? 92.540 -10.036 30.116 1.00 66.86 ? 165 ASP B CB 1 ATOM 3275 C CG . ASP B 1 86 ? 94.062 -10.164 30.189 1.00 77.74 ? 165 ASP B CG 1 ATOM 3276 O OD1 . ASP B 1 86 ? 94.737 -9.213 30.657 1.00 77.83 ? 165 ASP B OD1 1 ATOM 3277 O OD2 . ASP B 1 86 ? 94.580 -11.219 29.750 1.00 73.30 ? 165 ASP B OD2 1 ATOM 3278 N N . PRO B 1 87 ? 90.058 -8.178 29.361 1.00 71.18 ? 166 PRO B N 1 ATOM 3279 C CA . PRO B 1 87 ? 88.613 -8.150 29.109 1.00 64.51 ? 166 PRO B CA 1 ATOM 3280 C C . PRO B 1 87 ? 88.124 -9.454 28.492 1.00 74.95 ? 166 PRO B C 1 ATOM 3281 O O . PRO B 1 87 ? 88.905 -10.162 27.844 1.00 71.47 ? 166 PRO B O 1 ATOM 3282 C CB . PRO B 1 87 ? 88.469 -7.025 28.082 1.00 67.13 ? 166 PRO B CB 1 ATOM 3283 C CG . PRO B 1 87 ? 89.752 -7.081 27.303 1.00 67.40 ? 166 PRO B CG 1 ATOM 3284 C CD . PRO B 1 87 ? 90.819 -7.466 28.314 1.00 75.98 ? 166 PRO B CD 1 ATOM 3285 N N . PRO B 1 88 ? 86.838 -9.779 28.693 1.00 73.33 ? 167 PRO B N 1 ATOM 3286 C CA . PRO B 1 88 ? 86.250 -10.962 28.044 1.00 71.93 ? 167 PRO B CA 1 ATOM 3287 C C . PRO B 1 88 ? 85.975 -10.805 26.534 1.00 75.29 ? 167 PRO B C 1 ATOM 3288 O O . PRO B 1 88 ? 84.871 -11.099 26.054 1.00 73.93 ? 167 PRO B O 1 ATOM 3289 C CB . PRO B 1 88 ? 84.949 -11.205 28.836 1.00 65.07 ? 167 PRO B CB 1 ATOM 3290 C CG . PRO B 1 88 ? 84.659 -9.929 29.517 1.00 66.51 ? 167 PRO B CG 1 ATOM 3291 C CD . PRO B 1 88 ? 85.988 -9.253 29.774 1.00 51.64 ? 167 PRO B CD 1 ATOM 3292 N N . THR B 1 89 ? 86.995 -10.370 25.800 1.00 79.52 ? 168 THR B N 1 ATOM 3293 C CA . THR B 1 89 ? 86.998 -10.413 24.339 1.00 78.50 ? 168 THR B CA 1 ATOM 3294 C C . THR B 1 89 ? 87.462 -11.803 23.864 1.00 89.15 ? 168 THR B C 1 ATOM 3295 O O . THR B 1 89 ? 88.284 -12.449 24.527 1.00 85.03 ? 168 THR B O 1 ATOM 3296 C CB . THR B 1 89 ? 87.953 -9.352 23.775 1.00 80.52 ? 168 THR B CB 1 ATOM 3297 O OG1 . THR B 1 89 ? 89.294 -9.661 24.180 1.00 98.71 ? 168 THR B OG1 1 ATOM 3298 C CG2 . THR B 1 89 ? 87.573 -7.967 24.282 1.00 73.12 ? 168 THR B CG2 1 ATOM 3299 N N . PRO B 1 90 ? 86.933 -12.264 22.714 1.00 82.32 ? 169 PRO B N 1 ATOM 3300 C CA . PRO B 1 90 ? 87.230 -13.553 22.070 1.00 69.41 ? 169 PRO B CA 1 ATOM 3301 C C . PRO B 1 90 ? 88.703 -13.997 22.144 1.00 77.97 ? 169 PRO B C 1 ATOM 3302 O O . PRO B 1 90 ? 88.976 -15.167 22.417 1.00 79.47 ? 169 PRO B O 1 ATOM 3303 C CB . PRO B 1 90 ? 86.853 -13.284 20.620 1.00 54.27 ? 169 PRO B CB 1 ATOM 3304 C CG . PRO B 1 90 ? 85.713 -12.323 20.718 1.00 62.58 ? 169 PRO B CG 1 ATOM 3305 C CD . PRO B 1 90 ? 85.939 -11.488 21.947 1.00 69.90 ? 169 PRO B CD 1 ATOM 3306 N N . ASP B 1 91 ? 89.630 -13.073 21.898 1.00 82.05 ? 170 ASP B N 1 ATOM 3307 C CA . ASP B 1 91 ? 91.063 -13.375 21.918 1.00 78.14 ? 170 ASP B CA 1 ATOM 3308 C C . ASP B 1 91 ? 91.576 -13.745 23.321 1.00 77.82 ? 170 ASP B C 1 ATOM 3309 O O . ASP B 1 91 ? 92.468 -14.594 23.465 1.00 74.31 ? 170 ASP B O 1 ATOM 3310 C CB . ASP B 1 91 ? 91.845 -12.197 21.318 1.00 95.02 ? 170 ASP B CB 1 ATOM 3311 C CG . ASP B 1 91 ? 93.364 -12.342 21.457 1.00 115.56 ? 170 ASP B CG 1 ATOM 3312 O OD1 . ASP B 1 91 ? 93.954 -13.273 20.862 1.00 117.22 ? 170 ASP B OD1 1 ATOM 3313 O OD2 . ASP B 1 91 ? 93.981 -11.490 22.132 1.00 121.54 ? 170 ASP B OD2 1 ATOM 3314 N N . LYS B 1 92 A 90.999 -13.121 24.350 1.00 80.96 ? 170 LYS B N 1 ATOM 3315 C CA . LYS B 1 92 A 91.434 -13.346 25.732 1.00 71.51 ? 170 LYS B CA 1 ATOM 3316 C C . LYS B 1 92 A 90.630 -14.474 26.405 1.00 65.90 ? 170 LYS B C 1 ATOM 3317 O O . LYS B 1 92 A 90.998 -14.975 27.473 1.00 57.51 ? 170 LYS B O 1 ATOM 3318 C CB . LYS B 1 92 A 91.330 -12.050 26.549 1.00 71.69 ? 170 LYS B CB 1 ATOM 3319 C CG . LYS B 1 92 A 92.175 -10.878 26.039 1.00 74.30 ? 170 LYS B CG 1 ATOM 3320 C CD . LYS B 1 92 A 93.651 -11.022 26.412 1.00 79.15 ? 170 LYS B CD 1 ATOM 3321 C CE . LYS B 1 92 A 94.410 -9.689 26.277 1.00 91.26 ? 170 LYS B CE 1 ATOM 3322 N NZ . LYS B 1 92 A 95.169 -9.552 24.994 1.00 91.77 ? 170 LYS B NZ 1 ATOM 3323 N N . LEU B 1 93 ? 89.542 -14.875 25.755 1.00 67.49 ? 171 LEU B N 1 ATOM 3324 C CA . LEU B 1 93 ? 88.673 -15.931 26.247 1.00 63.06 ? 171 LEU B CA 1 ATOM 3325 C C . LEU B 1 93 ? 89.342 -17.288 26.414 1.00 72.06 ? 171 LEU B C 1 ATOM 3326 O O . LEU B 1 93 ? 90.396 -17.552 25.842 1.00 90.72 ? 171 LEU B O 1 ATOM 3327 C CB . LEU B 1 93 ? 87.482 -16.082 25.311 1.00 73.52 ? 171 LEU B CB 1 ATOM 3328 C CG . LEU B 1 93 ? 86.181 -15.513 25.868 1.00 73.41 ? 171 LEU B CG 1 ATOM 3329 C CD1 . LEU B 1 93 ? 85.081 -16.542 25.752 1.00 67.13 ? 171 LEU B CD1 1 ATOM 3330 C CD2 . LEU B 1 93 ? 86.369 -15.105 27.304 1.00 69.45 ? 171 LEU B CD2 1 ATOM 3331 N N . LYS B 1 94 ? 88.705 -18.138 27.214 1.00 67.65 ? 172 LYS B N 1 ATOM 3332 C CA . LYS B 1 94 ? 89.131 -19.521 27.451 1.00 53.08 ? 172 LYS B CA 1 ATOM 3333 C C . LYS B 1 94 ? 87.917 -20.353 27.834 1.00 53.54 ? 172 LYS B C 1 ATOM 3334 O O . LYS B 1 94 ? 87.273 -20.087 28.846 1.00 55.86 ? 172 LYS B O 1 ATOM 3335 C CB . LYS B 1 94 ? 90.155 -19.607 28.569 1.00 47.36 ? 172 LYS B CB 1 ATOM 3336 C CG . LYS B 1 94 ? 90.472 -21.028 29.020 1.00 45.06 ? 172 LYS B CG 1 ATOM 3337 C CD . LYS B 1 94 ? 91.697 -21.008 29.958 1.00 57.59 ? 172 LYS B CD 1 ATOM 3338 C CE . LYS B 1 94 ? 92.031 -22.387 30.523 1.00 55.55 ? 172 LYS B CE 1 ATOM 3339 N NZ . LYS B 1 94 ? 92.188 -23.394 29.443 1.00 64.05 ? 172 LYS B NZ 1 ATOM 3340 N N . PHE B 1 95 ? 87.601 -21.348 27.011 1.00 52.46 ? 173 PHE B N 1 ATOM 3341 C CA . PHE B 1 95 ? 86.482 -22.233 27.276 1.00 48.94 ? 173 PHE B CA 1 ATOM 3342 C C . PHE B 1 95 ? 86.845 -23.147 28.468 1.00 55.58 ? 173 PHE B C 1 ATOM 3343 O O . PHE B 1 95 ? 87.990 -23.612 28.586 1.00 49.97 ? 173 PHE B O 1 ATOM 3344 C CB . PHE B 1 95 ? 86.193 -23.046 26.022 1.00 48.60 ? 173 PHE B CB 1 ATOM 3345 C CG . PHE B 1 95 ? 85.042 -23.986 26.161 1.00 46.31 ? 173 PHE B CG 1 ATOM 3346 C CD1 . PHE B 1 95 ? 83.750 -23.520 26.072 1.00 53.16 ? 173 PHE B CD1 1 ATOM 3347 C CD2 . PHE B 1 95 ? 85.251 -25.341 26.348 1.00 55.03 ? 173 PHE B CD2 1 ATOM 3348 C CE1 . PHE B 1 95 ? 82.674 -24.380 26.188 1.00 56.56 ? 173 PHE B CE1 1 ATOM 3349 C CE2 . PHE B 1 95 ? 84.188 -26.201 26.468 1.00 57.11 ? 173 PHE B CE2 1 ATOM 3350 C CZ . PHE B 1 95 ? 82.893 -25.715 26.387 1.00 55.22 ? 173 PHE B CZ 1 ATOM 3351 N N . GLU B 1 96 ? 85.899 -23.386 29.372 1.00 45.64 ? 174 GLU B N 1 ATOM 3352 C CA . GLU B 1 96 ? 86.219 -24.212 30.529 1.00 56.41 ? 174 GLU B CA 1 ATOM 3353 C C . GLU B 1 96 ? 85.416 -25.509 30.578 1.00 61.36 ? 174 GLU B C 1 ATOM 3354 O O . GLU B 1 96 ? 85.975 -26.568 30.874 1.00 71.31 ? 174 GLU B O 1 ATOM 3355 C CB . GLU B 1 96 ? 86.091 -23.408 31.838 1.00 53.77 ? 174 GLU B CB 1 ATOM 3356 C CG . GLU B 1 96 ? 87.101 -22.250 31.965 1.00 51.82 ? 174 GLU B CG 1 ATOM 3357 C CD . GLU B 1 96 ? 88.526 -22.720 32.327 1.00 64.08 ? 174 GLU B CD 1 ATOM 3358 O OE1 . GLU B 1 96 ? 88.762 -23.956 32.418 1.00 63.75 ? 174 GLU B OE1 1 ATOM 3359 O OE2 . GLU B 1 96 ? 89.410 -21.848 32.540 1.00 57.09 ? 174 GLU B OE2 1 ATOM 3360 N N . ALA B 1 97 ? 84.128 -25.419 30.246 1.00 41.36 ? 175 ALA B N 1 ATOM 3361 C CA . ALA B 1 97 ? 83.160 -26.483 30.513 1.00 43.75 ? 175 ALA B CA 1 ATOM 3362 C C . ALA B 1 97 ? 81.777 -26.089 29.997 1.00 52.20 ? 175 ALA B C 1 ATOM 3363 O O . ALA B 1 97 ? 81.479 -24.911 29.837 1.00 61.39 ? 175 ALA B O 1 ATOM 3364 C CB . ALA B 1 97 ? 83.076 -26.778 32.043 1.00 35.62 ? 175 ALA B CB 1 ATOM 3365 N N . VAL B 1 98 ? 80.939 -27.092 29.770 1.00 52.00 ? 176 VAL B N 1 ATOM 3366 C CA . VAL B 1 98 ? 79.524 -26.913 29.505 1.00 53.05 ? 176 VAL B CA 1 ATOM 3367 C C . VAL B 1 98 ? 78.785 -26.741 30.828 1.00 64.04 ? 176 VAL B C 1 ATOM 3368 O O . VAL B 1 98 ? 78.992 -27.514 31.764 1.00 71.45 ? 176 VAL B O 1 ATOM 3369 C CB . VAL B 1 98 ? 78.988 -28.185 28.838 1.00 53.30 ? 176 VAL B CB 1 ATOM 3370 C CG1 . VAL B 1 98 ? 77.449 -28.139 28.645 1.00 38.41 ? 176 VAL B CG1 1 ATOM 3371 C CG2 . VAL B 1 98 ? 79.736 -28.440 27.529 1.00 49.65 ? 176 VAL B CG2 1 ATOM 3372 N N . GLY B 1 99 ? 77.917 -25.743 30.920 1.00 56.53 ? 177 GLY B N 1 ATOM 3373 C CA . GLY B 1 99 ? 77.121 -25.607 32.121 1.00 54.94 ? 177 GLY B CA 1 ATOM 3374 C C . GLY B 1 99 ? 76.768 -24.191 32.514 1.00 56.66 ? 177 GLY B C 1 ATOM 3375 O O . GLY B 1 99 ? 77.320 -23.216 31.980 1.00 54.49 ? 177 GLY B O 1 ATOM 3376 N N . TRP B 1 100 ? 75.849 -24.083 33.468 1.00 44.92 ? 178 TRP B N 1 ATOM 3377 C CA . TRP B 1 100 ? 75.310 -22.790 33.856 1.00 57.12 ? 178 TRP B CA 1 ATOM 3378 C C . TRP B 1 100 ? 75.735 -22.385 35.270 1.00 64.90 ? 178 TRP B C 1 ATOM 3379 O O . TRP B 1 100 ? 75.445 -21.280 35.716 1.00 62.37 ? 178 TRP B O 1 ATOM 3380 C CB . TRP B 1 100 ? 73.782 -22.815 33.732 1.00 50.79 ? 178 TRP B CB 1 ATOM 3381 C CG . TRP B 1 100 ? 73.091 -23.805 34.656 1.00 51.12 ? 178 TRP B CG 1 ATOM 3382 C CD1 . TRP B 1 100 ? 72.862 -23.661 36.012 1.00 50.33 ? 178 TRP B CD1 1 ATOM 3383 C CD2 . TRP B 1 100 ? 72.514 -25.069 34.292 1.00 52.85 ? 178 TRP B CD2 1 ATOM 3384 N NE1 . TRP B 1 100 ? 72.188 -24.762 36.499 1.00 55.70 ? 178 TRP B NE1 1 ATOM 3385 C CE2 . TRP B 1 100 ? 71.962 -25.640 35.466 1.00 59.53 ? 178 TRP B CE2 1 ATOM 3386 C CE3 . TRP B 1 100 ? 72.413 -25.773 33.087 1.00 51.17 ? 178 TRP B CE3 1 ATOM 3387 C CZ2 . TRP B 1 100 ? 71.324 -26.884 35.468 1.00 60.35 ? 178 TRP B CZ2 1 ATOM 3388 C CZ3 . TRP B 1 100 ? 71.774 -27.006 33.086 1.00 54.67 ? 178 TRP B CZ3 1 ATOM 3389 C CH2 . TRP B 1 100 ? 71.239 -27.548 34.269 1.00 67.21 ? 178 TRP B CH2 1 ATOM 3390 N N . SER B 1 101 ? 76.420 -23.292 35.963 1.00 64.50 ? 179 SER B N 1 ATOM 3391 C CA . SER B 1 101 ? 76.818 -23.093 37.357 1.00 52.79 ? 179 SER B CA 1 ATOM 3392 C C . SER B 1 101 ? 78.228 -23.626 37.568 1.00 52.47 ? 179 SER B C 1 ATOM 3393 O O . SER B 1 101 ? 78.505 -24.810 37.326 1.00 56.09 ? 179 SER B O 1 ATOM 3394 C CB . SER B 1 101 ? 75.854 -23.834 38.280 1.00 63.55 ? 179 SER B CB 1 ATOM 3395 O OG . SER B 1 101 ? 76.133 -23.575 39.652 1.00 75.27 ? 179 SER B OG 1 ATOM 3396 N N . ALA B 1 102 ? 79.134 -22.767 38.011 1.00 50.07 ? 180 ALA B N 1 ATOM 3397 C CA . ALA B 1 102 ? 80.519 -23.210 38.157 1.00 50.48 ? 180 ALA B CA 1 ATOM 3398 C C . ALA B 1 102 ? 81.243 -22.732 39.401 1.00 49.59 ? 180 ALA B C 1 ATOM 3399 O O . ALA B 1 102 ? 81.006 -21.632 39.912 1.00 54.76 ? 180 ALA B O 1 ATOM 3400 C CB . ALA B 1 102 ? 81.333 -22.876 36.929 1.00 43.98 ? 180 ALA B CB 1 ATOM 3401 N N . SER B 1 103 ? 82.148 -23.591 39.853 1.00 51.21 ? 181 SER B N 1 ATOM 3402 C CA . SER B 1 103 ? 83.073 -23.302 40.935 1.00 53.13 ? 181 SER B CA 1 ATOM 3403 C C . SER B 1 103 ? 84.447 -23.710 40.405 1.00 52.58 ? 181 SER B C 1 ATOM 3404 O O . SER B 1 103 ? 84.547 -24.627 39.568 1.00 45.69 ? 181 SER B O 1 ATOM 3405 C CB . SER B 1 103 ? 82.701 -24.136 42.167 1.00 55.31 ? 181 SER B CB 1 ATOM 3406 O OG . SER B 1 103 ? 83.680 -24.006 43.183 1.00 60.69 ? 181 SER B OG 1 ATOM 3407 N N . SER B 1 104 ? 85.507 -23.044 40.855 1.00 38.03 ? 182 SER B N 1 ATOM 3408 C CA . SER B 1 104 ? 86.849 -23.502 40.471 1.00 51.10 ? 182 SER B CA 1 ATOM 3409 C C . SER B 1 104 ? 87.959 -23.172 41.471 1.00 50.06 ? 182 SER B C 1 ATOM 3410 O O . SER B 1 104 ? 87.815 -22.289 42.324 1.00 57.38 ? 182 SER B O 1 ATOM 3411 C CB . SER B 1 104 ? 87.218 -23.001 39.070 1.00 55.11 ? 182 SER B CB 1 ATOM 3412 O OG . SER B 1 104 ? 87.144 -21.594 39.011 1.00 64.82 ? 182 SER B OG 1 ATOM 3413 N N . CYS B 1 105 ? 89.061 -23.906 41.362 1.00 40.62 ? 183 CYS B N 1 ATOM 3414 C CA . CYS B 1 105 ? 90.225 -23.652 42.194 1.00 45.65 ? 183 CYS B CA 1 ATOM 3415 C C . CYS B 1 105 ? 91.444 -24.327 41.622 1.00 50.96 ? 183 CYS B C 1 ATOM 3416 O O . CYS B 1 105 ? 91.337 -25.364 40.973 1.00 65.64 ? 183 CYS B O 1 ATOM 3417 C CB . CYS B 1 105 ? 90.007 -24.120 43.654 1.00 39.59 ? 183 CYS B CB 1 ATOM 3418 S SG . CYS B 1 105 ? 89.182 -25.720 43.894 1.00 57.73 ? 183 CYS B SG 1 ATOM 3419 N N . HIS B 1 106 ? 92.604 -23.742 41.891 1.00 52.00 ? 184 HIS B N 1 ATOM 3420 C CA . HIS B 1 106 ? 93.856 -24.295 41.416 1.00 46.79 ? 184 HIS B CA 1 ATOM 3421 C C . HIS B 1 106 ? 94.642 -24.950 42.560 1.00 50.99 ? 184 HIS B C 1 ATOM 3422 O O . HIS B 1 106 ? 94.662 -24.436 43.684 1.00 54.89 ? 184 HIS B O 1 ATOM 3423 C CB . HIS B 1 106 ? 94.662 -23.182 40.768 1.00 44.69 ? 184 HIS B CB 1 ATOM 3424 C CG . HIS B 1 106 ? 95.737 -23.678 39.852 1.00 55.24 ? 184 HIS B CG 1 ATOM 3425 N ND1 . HIS B 1 106 ? 96.917 -24.203 40.329 1.00 53.92 ? 184 HIS B ND1 1 ATOM 3426 C CD2 . HIS B 1 106 ? 95.787 -23.733 38.505 1.00 46.23 ? 184 HIS B CD2 1 ATOM 3427 C CE1 . HIS B 1 106 ? 97.664 -24.562 39.289 1.00 59.24 ? 184 HIS B CE1 1 ATOM 3428 N NE2 . HIS B 1 106 ? 97.011 -24.303 38.186 1.00 49.57 ? 184 HIS B NE2 1 ATOM 3429 N N . ASP B 1 107 ? 95.292 -26.080 42.280 1.00 55.74 ? 185 ASP B N 1 ATOM 3430 C CA . ASP B 1 107 ? 95.991 -26.826 43.336 1.00 49.50 ? 185 ASP B CA 1 ATOM 3431 C C . ASP B 1 107 ? 97.507 -26.672 43.298 1.00 56.57 ? 185 ASP B C 1 ATOM 3432 O O . ASP B 1 107 ? 98.213 -27.232 44.140 1.00 61.96 ? 185 ASP B O 1 ATOM 3433 C CB . ASP B 1 107 ? 95.617 -28.314 43.293 1.00 49.07 ? 185 ASP B CB 1 ATOM 3434 C CG . ASP B 1 107 ? 95.987 -28.986 41.966 1.00 69.02 ? 185 ASP B CG 1 ATOM 3435 O OD1 . ASP B 1 107 ? 96.496 -28.300 41.045 1.00 71.06 ? 185 ASP B OD1 1 ATOM 3436 O OD2 . ASP B 1 107 ? 95.753 -30.213 41.841 1.00 64.90 ? 185 ASP B OD2 1 ATOM 3437 N N . GLY B 1 108 ? 98.000 -25.906 42.328 1.00 58.76 ? 186 GLY B N 1 ATOM 3438 C CA . GLY B 1 108 ? 99.428 -25.793 42.090 1.00 55.84 ? 186 GLY B CA 1 ATOM 3439 C C . GLY B 1 108 ? 99.837 -26.538 40.828 1.00 66.94 ? 186 GLY B C 1 ATOM 3440 O O . GLY B 1 108 ? 100.930 -26.330 40.293 1.00 70.14 ? 186 GLY B O 1 ATOM 3441 N N . PHE B 1 109 ? 98.947 -27.406 40.352 1.00 67.10 ? 187 PHE B N 1 ATOM 3442 C CA . PHE B 1 109 ? 99.205 -28.211 39.164 1.00 55.98 ? 187 PHE B CA 1 ATOM 3443 C C . PHE B 1 109 ? 98.255 -27.906 38.026 1.00 57.59 ? 187 PHE B C 1 ATOM 3444 O O . PHE B 1 109 ? 98.648 -27.792 36.867 1.00 52.23 ? 187 PHE B O 1 ATOM 3445 C CB . PHE B 1 109 ? 99.045 -29.687 39.487 1.00 40.26 ? 187 PHE B CB 1 ATOM 3446 C CG . PHE B 1 109 ? 99.856 -30.132 40.634 1.00 49.25 ? 187 PHE B CG 1 ATOM 3447 C CD1 . PHE B 1 109 ? 101.233 -29.966 40.626 1.00 52.47 ? 187 PHE B CD1 1 ATOM 3448 C CD2 . PHE B 1 109 ? 99.255 -30.756 41.723 1.00 59.38 ? 187 PHE B CD2 1 ATOM 3449 C CE1 . PHE B 1 109 ? 102.003 -30.398 41.715 1.00 60.70 ? 187 PHE B CE1 1 ATOM 3450 C CE2 . PHE B 1 109 ? 100.017 -31.194 42.799 1.00 59.91 ? 187 PHE B CE2 1 ATOM 3451 C CZ . PHE B 1 109 ? 101.392 -31.011 42.798 1.00 46.94 ? 187 PHE B CZ 1 ATOM 3452 N N . GLN B 1 110 ? 96.985 -27.798 38.367 1.00 64.11 ? 188 GLN B N 1 ATOM 3453 C CA . GLN B 1 110 ? 95.955 -27.785 37.358 1.00 56.00 ? 188 GLN B CA 1 ATOM 3454 C C . GLN B 1 110 ? 94.716 -27.085 37.902 1.00 58.69 ? 188 GLN B C 1 ATOM 3455 O O . GLN B 1 110 ? 94.486 -27.031 39.119 1.00 65.47 ? 188 GLN B O 1 ATOM 3456 C CB . GLN B 1 110 ? 95.636 -29.238 36.978 1.00 57.89 ? 188 GLN B CB 1 ATOM 3457 C CG . GLN B 1 110 ? 95.591 -29.525 35.502 1.00 73.56 ? 188 GLN B CG 1 ATOM 3458 C CD . GLN B 1 110 ? 96.868 -29.154 34.773 1.00 63.86 ? 188 GLN B CD 1 ATOM 3459 O OE1 . GLN B 1 110 ? 97.884 -29.845 34.873 1.00 52.45 ? 188 GLN B OE1 1 ATOM 3460 N NE2 . GLN B 1 110 ? 96.816 -28.063 34.020 1.00 59.19 ? 188 GLN B NE2 1 ATOM 3461 N N . TRP B 1 111 ? 93.927 -26.520 37.002 1.00 64.93 ? 189 TRP B N 1 ATOM 3462 C CA . TRP B 1 111 ? 92.623 -26.038 37.400 1.00 52.40 ? 189 TRP B CA 1 ATOM 3463 C C . TRP B 1 111 ? 91.664 -27.210 37.549 1.00 53.19 ? 189 TRP B C 1 ATOM 3464 O O . TRP B 1 111 ? 91.581 -28.098 36.691 1.00 67.83 ? 189 TRP B O 1 ATOM 3465 C CB . TRP B 1 111 ? 92.071 -25.034 36.391 1.00 40.85 ? 189 TRP B CB 1 ATOM 3466 C CG . TRP B 1 111 ? 92.698 -23.695 36.515 1.00 49.48 ? 189 TRP B CG 1 ATOM 3467 C CD1 . TRP B 1 111 ? 93.662 -23.162 35.712 1.00 37.78 ? 189 TRP B CD1 1 ATOM 3468 C CD2 . TRP B 1 111 ? 92.422 -22.708 37.520 1.00 71.84 ? 189 TRP B CD2 1 ATOM 3469 N NE1 . TRP B 1 111 ? 94.000 -21.901 36.145 1.00 53.72 ? 189 TRP B NE1 1 ATOM 3470 C CE2 . TRP B 1 111 ? 93.256 -21.600 37.257 1.00 75.03 ? 189 TRP B CE2 1 ATOM 3471 C CE3 . TRP B 1 111 ? 91.550 -22.654 38.614 1.00 71.60 ? 189 TRP B CE3 1 ATOM 3472 C CZ2 . TRP B 1 111 ? 93.246 -20.446 38.056 1.00 73.40 ? 189 TRP B CZ2 1 ATOM 3473 C CZ3 . TRP B 1 111 ? 91.539 -21.507 39.401 1.00 68.44 ? 189 TRP B CZ3 1 ATOM 3474 C CH2 . TRP B 1 111 ? 92.380 -20.420 39.115 1.00 61.93 ? 189 TRP B CH2 1 ATOM 3475 N N . THR B 1 112 ? 90.975 -27.208 38.678 1.00 43.95 ? 190 THR B N 1 ATOM 3476 C CA . THR B 1 112 ? 89.809 -28.029 38.906 1.00 43.14 ? 190 THR B CA 1 ATOM 3477 C C . THR B 1 112 ? 88.586 -27.135 38.669 1.00 56.36 ? 190 THR B C 1 ATOM 3478 O O . THR B 1 112 ? 88.452 -26.053 39.287 1.00 54.04 ? 190 THR B O 1 ATOM 3479 C CB . THR B 1 112 ? 89.772 -28.514 40.368 1.00 48.68 ? 190 THR B CB 1 ATOM 3480 O OG1 . THR B 1 112 ? 90.929 -29.317 40.642 1.00 49.59 ? 190 THR B OG1 1 ATOM 3481 C CG2 . THR B 1 112 ? 88.498 -29.312 40.624 1.00 46.63 ? 190 THR B CG2 1 ATOM 3482 N N . VAL B 1 113 ? 87.698 -27.570 37.778 1.00 44.16 ? 191 VAL B N 1 ATOM 3483 C CA . VAL B 1 113 ? 86.477 -26.819 37.517 1.00 41.54 ? 191 VAL B CA 1 ATOM 3484 C C . VAL B 1 113 ? 85.231 -27.675 37.729 1.00 49.04 ? 191 VAL B C 1 ATOM 3485 O O . VAL B 1 113 ? 85.085 -28.748 37.138 1.00 58.54 ? 191 VAL B O 1 ATOM 3486 C CB . VAL B 1 113 ? 86.467 -26.219 36.107 1.00 38.13 ? 191 VAL B CB 1 ATOM 3487 C CG1 . VAL B 1 113 ? 85.100 -25.645 35.787 1.00 39.25 ? 191 VAL B CG1 1 ATOM 3488 C CG2 . VAL B 1 113 ? 87.540 -25.150 35.982 1.00 39.26 ? 191 VAL B CG2 1 ATOM 3489 N N . LEU B 1 114 ? 84.343 -27.194 38.593 1.00 49.19 ? 192 LEU B N 1 ATOM 3490 C CA . LEU B 1 114 ? 83.087 -27.882 38.857 1.00 40.44 ? 192 LEU B CA 1 ATOM 3491 C C . LEU B 1 114 ? 81.947 -27.183 38.137 1.00 54.02 ? 192 LEU B C 1 ATOM 3492 O O . LEU B 1 114 ? 81.702 -25.989 38.351 1.00 52.72 ? 192 LEU B O 1 ATOM 3493 C CB . LEU B 1 114 ? 82.796 -27.947 40.354 1.00 36.42 ? 192 LEU B CB 1 ATOM 3494 C CG . LEU B 1 114 ? 83.767 -28.833 41.118 1.00 53.07 ? 192 LEU B CG 1 ATOM 3495 C CD1 . LEU B 1 114 ? 84.761 -27.971 41.925 1.00 54.87 ? 192 LEU B CD1 1 ATOM 3496 C CD2 . LEU B 1 114 ? 82.989 -29.807 41.989 1.00 47.21 ? 192 LEU B CD2 1 ATOM 3497 N N . SER B 1 115 ? 81.248 -27.933 37.289 1.00 61.98 ? 193 SER B N 1 ATOM 3498 C CA . SER B 1 115 ? 80.222 -27.348 36.448 1.00 56.03 ? 193 SER B CA 1 ATOM 3499 C C . SER B 1 115 ? 78.917 -28.135 36.505 1.00 61.13 ? 193 SER B C 1 ATOM 3500 O O . SER B 1 115 ? 78.929 -29.364 36.565 1.00 62.97 ? 193 SER B O 1 ATOM 3501 C CB . SER B 1 115 ? 80.735 -27.277 35.021 1.00 59.40 ? 193 SER B CB 1 ATOM 3502 O OG . SER B 1 115 ? 79.953 -26.378 34.264 1.00 82.10 ? 193 SER B OG 1 ATOM 3503 N N . VAL B 1 116 ? 77.793 -27.421 36.488 1.00 61.52 ? 194 VAL B N 1 ATOM 3504 C CA . VAL B 1 116 ? 76.473 -28.054 36.445 1.00 62.44 ? 194 VAL B CA 1 ATOM 3505 C C . VAL B 1 116 ? 75.856 -27.938 35.050 1.00 65.64 ? 194 VAL B C 1 ATOM 3506 O O . VAL B 1 116 ? 75.737 -26.846 34.499 1.00 59.42 ? 194 VAL B O 1 ATOM 3507 C CB . VAL B 1 116 ? 75.485 -27.407 37.446 1.00 58.59 ? 194 VAL B CB 1 ATOM 3508 C CG1 . VAL B 1 116 ? 74.152 -28.140 37.426 1.00 47.35 ? 194 VAL B CG1 1 ATOM 3509 C CG2 . VAL B 1 116 ? 76.065 -27.395 38.858 1.00 62.77 ? 194 VAL B CG2 1 ATOM 3510 N N . ALA B 1 117 ? 75.445 -29.072 34.498 1.00 69.54 ? 195 ALA B N 1 ATOM 3511 C CA . ALA B 1 117 ? 74.829 -29.108 33.180 1.00 57.32 ? 195 ALA B CA 1 ATOM 3512 C C . ALA B 1 117 ? 73.655 -30.099 33.153 1.00 61.75 ? 195 ALA B C 1 ATOM 3513 O O . ALA B 1 117 ? 73.335 -30.745 34.166 1.00 59.83 ? 195 ALA B O 1 ATOM 3514 C CB . ALA B 1 117 ? 75.869 -29.469 32.140 1.00 50.22 ? 195 ALA B CB 1 ATOM 3515 N N . GLY B 1 118 ? 73.006 -30.218 32.000 1.00 66.14 ? 196 GLY B N 1 ATOM 3516 C CA . GLY B 1 118 ? 71.944 -31.205 31.833 1.00 79.38 ? 196 GLY B CA 1 ATOM 3517 C C . GLY B 1 118 ? 70.692 -30.950 32.661 1.00 87.67 ? 196 GLY B C 1 ATOM 3518 O O . GLY B 1 118 ? 70.091 -29.875 32.574 1.00 89.40 ? 196 GLY B O 1 ATOM 3519 N N . ASP B 1 119 ? 70.282 -31.936 33.454 1.00 90.01 ? 200 ASP B N 1 ATOM 3520 C CA . ASP B 1 119 ? 69.164 -31.739 34.374 1.00 100.35 ? 200 ASP B CA 1 ATOM 3521 C C . ASP B 1 119 ? 69.692 -31.258 35.720 1.00 103.77 ? 200 ASP B C 1 ATOM 3522 O O . ASP B 1 119 ? 68.926 -30.793 36.574 1.00 106.68 ? 200 ASP B O 1 ATOM 3523 C CB . ASP B 1 119 ? 68.342 -33.018 34.531 1.00 106.48 ? 200 ASP B CB 1 ATOM 3524 C CG . ASP B 1 119 ? 69.192 -34.275 34.441 1.00 114.01 ? 200 ASP B CG 1 ATOM 3525 O OD1 . ASP B 1 119 ? 70.422 -34.172 34.629 1.00 114.79 ? 200 ASP B OD1 1 ATOM 3526 O OD2 . ASP B 1 119 ? 68.627 -35.364 34.184 1.00 115.79 ? 200 ASP B OD2 1 ATOM 3527 N N . GLY B 1 120 ? 71.010 -31.368 35.886 1.00 97.08 ? 201 GLY B N 1 ATOM 3528 C CA . GLY B 1 120 ? 71.686 -30.850 37.056 1.00 90.51 ? 201 GLY B CA 1 ATOM 3529 C C . GLY B 1 120 ? 72.582 -31.831 37.794 1.00 90.26 ? 201 GLY B C 1 ATOM 3530 O O . GLY B 1 120 ? 72.518 -31.915 39.023 1.00 98.98 ? 201 GLY B O 1 ATOM 3531 N N . PHE B 1 121 ? 73.411 -32.577 37.065 1.00 79.99 ? 202 PHE B N 1 ATOM 3532 C CA . PHE B 1 121 ? 74.514 -33.319 37.687 1.00 65.08 ? 202 PHE B CA 1 ATOM 3533 C C . PHE B 1 121 ? 75.725 -32.386 37.652 1.00 61.62 ? 202 PHE B C 1 ATOM 3534 O O . PHE B 1 121 ? 75.699 -31.358 36.956 1.00 59.50 ? 202 PHE B O 1 ATOM 3535 C CB . PHE B 1 121 ? 74.818 -34.609 36.911 1.00 61.23 ? 202 PHE B CB 1 ATOM 3536 C CG . PHE B 1 121 ? 75.145 -34.371 35.465 1.00 58.59 ? 202 PHE B CG 1 ATOM 3537 C CD1 . PHE B 1 121 ? 74.140 -34.343 34.510 1.00 51.70 ? 202 PHE B CD1 1 ATOM 3538 C CD2 . PHE B 1 121 ? 76.453 -34.140 35.066 1.00 68.03 ? 202 PHE B CD2 1 ATOM 3539 C CE1 . PHE B 1 121 ? 74.440 -34.097 33.184 1.00 56.92 ? 202 PHE B CE1 1 ATOM 3540 C CE2 . PHE B 1 121 ? 76.750 -33.897 33.755 1.00 64.31 ? 202 PHE B CE2 1 ATOM 3541 C CZ . PHE B 1 121 ? 75.745 -33.875 32.809 1.00 57.30 ? 202 PHE B CZ 1 ATOM 3542 N N . VAL B 1 122 ? 76.784 -32.702 38.392 1.00 53.76 ? 203 VAL B N 1 ATOM 3543 C CA . VAL B 1 122 ? 77.995 -31.912 38.191 1.00 60.04 ? 203 VAL B CA 1 ATOM 3544 C C . VAL B 1 122 ? 79.144 -32.718 37.583 1.00 52.66 ? 203 VAL B C 1 ATOM 3545 O O . VAL B 1 122 ? 79.296 -33.915 37.851 1.00 51.15 ? 203 VAL B O 1 ATOM 3546 C CB . VAL B 1 122 ? 78.428 -31.064 39.439 1.00 54.73 ? 203 VAL B CB 1 ATOM 3547 C CG1 . VAL B 1 122 ? 77.233 -30.771 40.324 1.00 50.50 ? 203 VAL B CG1 1 ATOM 3548 C CG2 . VAL B 1 122 ? 79.545 -31.732 40.219 1.00 55.87 ? 203 VAL B CG2 1 ATOM 3549 N N . SER B 1 123 ? 79.930 -32.049 36.740 1.00 50.22 ? 204 SER B N 1 ATOM 3550 C CA . SER B 1 123 ? 81.150 -32.642 36.205 1.00 62.85 ? 204 SER B CA 1 ATOM 3551 C C . SER B 1 123 ? 82.355 -31.972 36.834 1.00 61.88 ? 204 SER B C 1 ATOM 3552 O O . SER B 1 123 ? 82.365 -30.747 37.065 1.00 54.37 ? 204 SER B O 1 ATOM 3553 C CB . SER B 1 123 ? 81.241 -32.473 34.680 1.00 52.98 ? 204 SER B CB 1 ATOM 3554 O OG . SER B 1 123 ? 79.961 -32.556 34.105 1.00 60.69 ? 204 SER B OG 1 ATOM 3555 N N . ILE B 1 124 ? 83.380 -32.774 37.094 1.00 43.34 ? 205 ILE B N 1 ATOM 3556 C CA . ILE B 1 124 ? 84.645 -32.205 37.495 1.00 47.62 ? 205 ILE B CA 1 ATOM 3557 C C . ILE B 1 124 ? 85.625 -32.290 36.329 1.00 54.53 ? 205 ILE B C 1 ATOM 3558 O O . ILE B 1 124 ? 85.839 -33.362 35.756 1.00 56.41 ? 205 ILE B O 1 ATOM 3559 C CB . ILE B 1 124 ? 85.184 -32.885 38.756 1.00 47.76 ? 205 ILE B CB 1 ATOM 3560 C CG1 . ILE B 1 124 ? 84.122 -32.791 39.859 1.00 49.28 ? 205 ILE B CG1 1 ATOM 3561 C CG2 . ILE B 1 124 ? 86.453 -32.215 39.202 1.00 48.02 ? 205 ILE B CG2 1 ATOM 3562 C CD1 . ILE B 1 124 ? 84.324 -33.762 40.993 1.00 50.06 ? 205 ILE B CD1 1 ATOM 3563 N N . LEU B 1 125 ? 86.188 -31.141 35.962 1.00 48.91 ? 206 LEU B N 1 ATOM 3564 C CA . LEU B 1 125 ? 87.254 -31.096 34.969 1.00 45.73 ? 206 LEU B CA 1 ATOM 3565 C C . LEU B 1 125 ? 88.578 -30.671 35.589 1.00 51.85 ? 206 LEU B C 1 ATOM 3566 O O . LEU B 1 125 ? 88.641 -29.713 36.367 1.00 57.41 ? 206 LEU B O 1 ATOM 3567 C CB . LEU B 1 125 ? 86.900 -30.155 33.826 1.00 51.19 ? 206 LEU B CB 1 ATOM 3568 C CG . LEU B 1 125 ? 85.772 -30.618 32.906 1.00 48.71 ? 206 LEU B CG 1 ATOM 3569 C CD1 . LEU B 1 125 ? 84.566 -29.781 33.144 1.00 47.60 ? 206 LEU B CD1 1 ATOM 3570 C CD2 . LEU B 1 125 ? 86.182 -30.548 31.471 1.00 55.75 ? 206 LEU B CD2 1 ATOM 3571 N N . TYR B 1 126 ? 89.638 -31.384 35.225 1.00 44.62 ? 207 TYR B N 1 ATOM 3572 C CA . TYR B 1 126 ? 90.963 -31.127 35.770 1.00 44.57 ? 207 TYR B CA 1 ATOM 3573 C C . TYR B 1 126 ? 91.907 -31.021 34.582 1.00 51.36 ? 207 TYR B C 1 ATOM 3574 O O . TYR B 1 126 ? 92.043 -31.970 33.814 1.00 63.80 ? 207 TYR B O 1 ATOM 3575 C CB . TYR B 1 126 ? 91.354 -32.275 36.696 1.00 50.23 ? 207 TYR B CB 1 ATOM 3576 C CG . TYR B 1 126 ? 92.610 -32.056 37.498 1.00 43.41 ? 207 TYR B CG 1 ATOM 3577 C CD1 . TYR B 1 126 ? 92.613 -31.234 38.620 1.00 41.71 ? 207 TYR B CD1 1 ATOM 3578 C CD2 . TYR B 1 126 ? 93.785 -32.710 37.163 1.00 43.88 ? 207 TYR B CD2 1 ATOM 3579 C CE1 . TYR B 1 126 ? 93.772 -31.049 39.372 1.00 45.63 ? 207 TYR B CE1 1 ATOM 3580 C CE2 . TYR B 1 126 ? 94.948 -32.537 37.910 1.00 47.94 ? 207 TYR B CE2 1 ATOM 3581 C CZ . TYR B 1 126 ? 94.937 -31.711 39.011 1.00 47.97 ? 207 TYR B CZ 1 ATOM 3582 O OH . TYR B 1 126 ? 96.097 -31.549 39.734 1.00 53.17 ? 207 TYR B OH 1 ATOM 3583 N N . GLY B 1 127 ? 92.568 -29.876 34.438 1.00 50.20 ? 208 GLY B N 1 ATOM 3584 C CA . GLY B 1 127 ? 93.034 -29.473 33.126 1.00 48.58 ? 208 GLY B CA 1 ATOM 3585 C C . GLY B 1 127 ? 91.714 -29.204 32.447 1.00 62.93 ? 208 GLY B C 1 ATOM 3586 O O . GLY B 1 127 ? 90.814 -28.605 33.060 1.00 91.30 ? 208 GLY B O 1 ATOM 3587 N N . GLY B 1 128 ? 91.552 -29.658 31.217 1.00 46.54 ? 209 GLY B N 1 ATOM 3588 C CA . GLY B 1 128 ? 90.206 -29.682 30.665 1.00 46.74 ? 209 GLY B CA 1 ATOM 3589 C C . GLY B 1 128 ? 89.694 -31.103 30.551 1.00 57.03 ? 209 GLY B C 1 ATOM 3590 O O . GLY B 1 128 ? 88.761 -31.373 29.784 1.00 66.96 ? 209 GLY B O 1 ATOM 3591 N N . ILE B 1 129 ? 90.313 -32.017 31.298 1.00 51.49 ? 210 ILE B N 1 ATOM 3592 C CA . ILE B 1 129 ? 89.929 -33.421 31.249 1.00 44.90 ? 210 ILE B CA 1 ATOM 3593 C C . ILE B 1 129 ? 88.842 -33.766 32.280 1.00 58.57 ? 210 ILE B C 1 ATOM 3594 O O . ILE B 1 129 ? 88.959 -33.429 33.468 1.00 63.49 ? 210 ILE B O 1 ATOM 3595 C CB . ILE B 1 129 ? 91.142 -34.329 31.497 1.00 50.76 ? 210 ILE B CB 1 ATOM 3596 C CG1 . ILE B 1 129 ? 92.268 -33.997 30.518 1.00 45.37 ? 210 ILE B CG1 1 ATOM 3597 C CG2 . ILE B 1 129 ? 90.743 -35.819 31.417 1.00 51.60 ? 210 ILE B CG2 1 ATOM 3598 C CD1 . ILE B 1 129 ? 93.446 -34.977 30.597 1.00 51.68 ? 210 ILE B CD1 1 ATOM 3599 N N . ILE B 1 130 ? 87.789 -34.445 31.833 1.00 53.19 ? 211 ILE B N 1 ATOM 3600 C CA . ILE B 1 130 ? 86.785 -34.932 32.768 1.00 55.71 ? 211 ILE B CA 1 ATOM 3601 C C . ILE B 1 130 ? 87.379 -35.968 33.716 1.00 62.06 ? 211 ILE B C 1 ATOM 3602 O O . ILE B 1 130 ? 87.930 -36.984 33.276 1.00 54.19 ? 211 ILE B O 1 ATOM 3603 C CB . ILE B 1 130 ? 85.580 -35.523 32.059 1.00 52.09 ? 211 ILE B CB 1 ATOM 3604 C CG1 . ILE B 1 130 ? 84.801 -34.393 31.395 1.00 57.45 ? 211 ILE B CG1 1 ATOM 3605 C CG2 . ILE B 1 130 ? 84.682 -36.259 33.068 1.00 49.04 ? 211 ILE B CG2 1 ATOM 3606 C CD1 . ILE B 1 130 ? 84.002 -33.536 32.359 1.00 45.34 ? 211 ILE B CD1 1 ATOM 3607 N N . THR B 1 131 ? 87.262 -35.693 35.017 1.00 57.89 ? 212 THR B N 1 ATOM 3608 C CA . THR B 1 131 ? 87.865 -36.539 36.045 1.00 48.22 ? 212 THR B CA 1 ATOM 3609 C C . THR B 1 131 ? 86.869 -37.184 37.011 1.00 50.13 ? 212 THR B C 1 ATOM 3610 O O . THR B 1 131 ? 87.244 -38.097 37.748 1.00 58.84 ? 212 THR B O 1 ATOM 3611 C CB . THR B 1 131 ? 88.944 -35.779 36.854 1.00 58.04 ? 212 THR B CB 1 ATOM 3612 O OG1 . THR B 1 131 ? 88.462 -34.469 37.195 1.00 63.68 ? 212 THR B OG1 1 ATOM 3613 C CG2 . THR B 1 131 ? 90.218 -35.655 36.045 1.00 49.32 ? 212 THR B CG2 1 ATOM 3614 N N . ASP B 1 132 ? 85.616 -36.723 36.999 1.00 41.40 ? 213 ASP B N 1 ATOM 3615 C CA . ASP B 1 132 ? 84.598 -37.235 37.906 1.00 46.32 ? 213 ASP B CA 1 ATOM 3616 C C . ASP B 1 132 ? 83.226 -36.607 37.633 1.00 52.64 ? 213 ASP B C 1 ATOM 3617 O O . ASP B 1 132 ? 83.141 -35.495 37.089 1.00 52.00 ? 213 ASP B O 1 ATOM 3618 C CB . ASP B 1 132 ? 85.016 -36.925 39.351 1.00 67.49 ? 213 ASP B CB 1 ATOM 3619 C CG . ASP B 1 132 ? 84.755 -38.080 40.296 1.00 86.08 ? 213 ASP B CG 1 ATOM 3620 O OD1 . ASP B 1 132 ? 83.672 -38.702 40.170 1.00 91.48 ? 213 ASP B OD1 1 ATOM 3621 O OD2 . ASP B 1 132 ? 85.626 -38.360 41.163 1.00 82.46 ? 213 ASP B OD2 1 ATOM 3622 N N . THR B 1 133 ? 82.153 -37.308 38.001 1.00 44.20 ? 214 THR B N 1 ATOM 3623 C CA . THR B 1 133 ? 80.840 -36.663 38.067 1.00 54.00 ? 214 THR B CA 1 ATOM 3624 C C . THR B 1 133 ? 80.246 -36.772 39.472 1.00 64.28 ? 214 THR B C 1 ATOM 3625 O O . THR B 1 133 ? 80.701 -37.579 40.283 1.00 60.92 ? 214 THR B O 1 ATOM 3626 C CB . THR B 1 133 ? 79.823 -37.199 37.021 1.00 51.73 ? 214 THR B CB 1 ATOM 3627 O OG1 . THR B 1 133 ? 79.705 -38.622 37.142 1.00 64.06 ? 214 THR B OG1 1 ATOM 3628 C CG2 . THR B 1 133 ? 80.259 -36.832 35.611 1.00 37.31 ? 214 THR B CG2 1 ATOM 3629 N N . ILE B 1 134 ? 79.238 -35.949 39.754 1.00 64.98 ? 215 ILE B N 1 ATOM 3630 C CA . ILE B 1 134 ? 78.533 -35.990 41.029 1.00 60.98 ? 215 ILE B CA 1 ATOM 3631 C C . ILE B 1 134 ? 77.036 -35.929 40.755 1.00 66.96 ? 215 ILE B C 1 ATOM 3632 O O . ILE B 1 134 ? 76.600 -35.157 39.886 1.00 57.12 ? 215 ILE B O 1 ATOM 3633 C CB . ILE B 1 134 ? 78.949 -34.810 41.926 1.00 60.23 ? 215 ILE B CB 1 ATOM 3634 C CG1 . ILE B 1 134 ? 80.336 -35.047 42.517 1.00 48.90 ? 215 ILE B CG1 1 ATOM 3635 C CG2 . ILE B 1 134 ? 77.954 -34.602 43.060 1.00 58.54 ? 215 ILE B CG2 1 ATOM 3636 C CD1 . ILE B 1 134 ? 80.970 -33.792 43.081 1.00 54.71 ? 215 ILE B CD1 1 ATOM 3637 N N . HIS B 1 135 ? 76.247 -36.735 41.472 1.00 72.48 ? 216 HIS B N 1 ATOM 3638 C CA . HIS B 1 135 ? 74.811 -36.810 41.174 1.00 78.01 ? 216 HIS B CA 1 ATOM 3639 C C . HIS B 1 135 ? 73.898 -36.552 42.373 1.00 75.72 ? 216 HIS B C 1 ATOM 3640 O O . HIS B 1 135 ? 74.232 -36.899 43.510 1.00 71.65 ? 216 HIS B O 1 ATOM 3641 C CB . HIS B 1 135 ? 74.454 -38.148 40.518 1.00 78.39 ? 216 HIS B CB 1 ATOM 3642 C CG . HIS B 1 135 ? 75.246 -38.440 39.284 1.00 92.92 ? 216 HIS B CG 1 ATOM 3643 N ND1 . HIS B 1 135 ? 74.895 -37.968 38.043 1.00 100.46 ? 216 HIS B ND1 1 ATOM 3644 C CD2 . HIS B 1 135 ? 76.391 -39.157 39.113 1.00 95.90 ? 216 HIS B CD2 1 ATOM 3645 C CE1 . HIS B 1 135 ? 75.788 -38.381 37.149 1.00 103.18 ? 216 HIS B CE1 1 ATOM 3646 N NE2 . HIS B 1 135 ? 76.697 -39.097 37.775 1.00 100.76 ? 216 HIS B NE2 1 ATOM 3647 N N . PRO B 1 136 ? 72.730 -35.937 42.111 1.00 62.37 ? 217 PRO B N 1 ATOM 3648 C CA . PRO B 1 136 ? 71.709 -35.720 43.142 1.00 68.75 ? 217 PRO B CA 1 ATOM 3649 C C . PRO B 1 136 ? 70.989 -37.000 43.530 1.00 85.13 ? 217 PRO B C 1 ATOM 3650 O O . PRO B 1 136 ? 70.809 -37.894 42.698 1.00 92.89 ? 217 PRO B O 1 ATOM 3651 C CB . PRO B 1 136 ? 70.711 -34.759 42.464 1.00 63.45 ? 217 PRO B CB 1 ATOM 3652 C CG . PRO B 1 136 ? 70.911 -34.941 41.001 1.00 59.57 ? 217 PRO B CG 1 ATOM 3653 C CD . PRO B 1 136 ? 72.375 -35.292 40.831 1.00 63.81 ? 217 PRO B CD 1 ATOM 3654 N N . THR B 1 137 ? 70.581 -37.077 44.790 1.00 89.68 ? 218 THR B N 1 ATOM 3655 C CA . THR B 1 137 ? 69.724 -38.155 45.243 1.00 100.64 ? 218 THR B CA 1 ATOM 3656 C C . THR B 1 137 ? 68.504 -37.546 45.890 1.00 91.42 ? 218 THR B C 1 ATOM 3657 O O . THR B 1 137 ? 67.580 -38.256 46.292 1.00 98.08 ? 218 THR B O 1 ATOM 3658 C CB . THR B 1 137 ? 70.436 -39.077 46.235 1.00 112.84 ? 218 THR B CB 1 ATOM 3659 O OG1 . THR B 1 137 ? 71.670 -38.473 46.641 1.00 100.64 ? 218 THR B OG1 1 ATOM 3660 C CG2 . THR B 1 137 ? 70.708 -40.436 45.591 1.00 120.80 ? 218 THR B CG2 1 ATOM 3661 N N . ASN B 1 138 ? 68.494 -36.220 45.976 1.00 86.32 ? 219 ASN B N 1 ATOM 3662 C CA . ASN B 1 138 ? 67.338 -35.525 46.544 1.00 87.50 ? 219 ASN B CA 1 ATOM 3663 C C . ASN B 1 138 ? 66.540 -34.693 45.541 1.00 78.76 ? 219 ASN B C 1 ATOM 3664 O O . ASN B 1 138 ? 65.713 -33.864 45.927 1.00 82.63 ? 219 ASN B O 1 ATOM 3665 C CB . ASN B 1 138 ? 67.723 -34.712 47.783 1.00 83.56 ? 219 ASN B CB 1 ATOM 3666 C CG . ASN B 1 138 ? 68.036 -35.591 48.966 1.00 96.58 ? 219 ASN B CG 1 ATOM 3667 O OD1 . ASN B 1 138 ? 69.092 -35.458 49.578 1.00 112.08 ? 219 ASN B OD1 1 ATOM 3668 N ND2 . ASN B 1 138 ? 67.126 -36.515 49.286 1.00 99.26 ? 219 ASN B ND2 1 ATOM 3669 N N . GLY B 1 139 ? 66.777 -34.930 44.258 1.00 74.87 ? 220 GLY B N 1 ATOM 3670 C CA . GLY B 1 139 ? 65.880 -34.410 43.252 1.00 77.54 ? 220 GLY B CA 1 ATOM 3671 C C . GLY B 1 139 ? 66.341 -33.268 42.385 1.00 82.28 ? 220 GLY B C 1 ATOM 3672 O O . GLY B 1 139 ? 65.669 -32.946 41.399 1.00 100.73 ? 220 GLY B O 1 ATOM 3673 N N . GLY B 1 140 ? 67.455 -32.639 42.743 1.00 68.19 ? 221 GLY B N 1 ATOM 3674 C CA . GLY B 1 140 ? 68.085 -31.670 41.855 1.00 59.98 ? 221 GLY B CA 1 ATOM 3675 C C . GLY B 1 140 ? 67.286 -30.403 41.604 1.00 55.65 ? 221 GLY B C 1 ATOM 3676 O O . GLY B 1 140 ? 66.149 -30.281 42.046 1.00 71.98 ? 221 GLY B O 1 ATOM 3677 N N . PRO B 1 141 ? 67.875 -29.451 40.881 1.00 55.84 ? 222 PRO B N 1 ATOM 3678 C CA . PRO B 1 141 ? 69.212 -29.623 40.322 1.00 53.92 ? 222 PRO B CA 1 ATOM 3679 C C . PRO B 1 141 ? 70.290 -29.389 41.362 1.00 56.28 ? 222 PRO B C 1 ATOM 3680 O O . PRO B 1 141 ? 70.030 -28.816 42.429 1.00 71.10 ? 222 PRO B O 1 ATOM 3681 C CB . PRO B 1 141 ? 69.289 -28.494 39.302 1.00 61.18 ? 222 PRO B CB 1 ATOM 3682 C CG . PRO B 1 141 ? 68.522 -27.385 39.974 1.00 64.62 ? 222 PRO B CG 1 ATOM 3683 C CD . PRO B 1 141 ? 67.343 -28.101 40.620 1.00 63.66 ? 222 PRO B CD 1 ATOM 3684 N N . LEU B 1 142 ? 71.498 -29.839 41.050 1.00 59.59 ? 223 LEU B N 1 ATOM 3685 C CA . LEU B 1 142 ? 72.662 -29.565 41.883 1.00 59.36 ? 223 LEU B CA 1 ATOM 3686 C C . LEU B 1 142 ? 73.078 -28.093 41.691 1.00 58.36 ? 223 LEU B C 1 ATOM 3687 O O . LEU B 1 142 ? 72.764 -27.456 40.666 1.00 49.99 ? 223 LEU B O 1 ATOM 3688 C CB . LEU B 1 142 ? 73.806 -30.512 41.499 1.00 60.33 ? 223 LEU B CB 1 ATOM 3689 C CG . LEU B 1 142 ? 74.098 -31.695 42.429 1.00 58.07 ? 223 LEU B CG 1 ATOM 3690 C CD1 . LEU B 1 142 ? 72.835 -32.170 43.103 1.00 49.77 ? 223 LEU B CD1 1 ATOM 3691 C CD2 . LEU B 1 142 ? 74.795 -32.863 41.707 1.00 42.43 ? 223 LEU B CD2 1 ATOM 3692 N N . ARG B 1 143 ? 73.740 -27.536 42.697 1.00 49.39 ? 224 ARG B N 1 ATOM 3693 C CA . ARG B 1 143 ? 74.204 -26.153 42.647 1.00 42.93 ? 224 ARG B CA 1 ATOM 3694 C C . ARG B 1 143 ? 75.620 -26.089 43.172 1.00 53.04 ? 224 ARG B C 1 ATOM 3695 O O . ARG B 1 143 ? 75.880 -26.549 44.297 1.00 42.61 ? 224 ARG B O 1 ATOM 3696 C CB . ARG B 1 143 ? 73.341 -25.274 43.564 1.00 47.48 ? 224 ARG B CB 1 ATOM 3697 C CG . ARG B 1 143 ? 71.881 -25.255 43.216 1.00 51.39 ? 224 ARG B CG 1 ATOM 3698 C CD . ARG B 1 143 ? 71.059 -24.666 44.337 1.00 67.03 ? 224 ARG B CD 1 ATOM 3699 N NE . ARG B 1 143 ? 69.778 -25.353 44.454 1.00 79.62 ? 224 ARG B NE 1 ATOM 3700 C CZ . ARG B 1 143 ? 69.492 -26.236 45.402 1.00 79.56 ? 224 ARG B CZ 1 ATOM 3701 N NH1 . ARG B 1 143 ? 70.389 -26.508 46.328 1.00 64.14 ? 224 ARG B NH1 1 ATOM 3702 N NH2 . ARG B 1 143 ? 68.306 -26.829 45.429 1.00 99.77 ? 224 ARG B NH2 1 ATOM 3703 N N . THR B 1 144 ? 76.535 -25.523 42.386 1.00 53.23 ? 225 THR B N 1 ATOM 3704 C CA . THR B 1 144 ? 77.888 -25.309 42.892 1.00 53.50 ? 225 THR B CA 1 ATOM 3705 C C . THR B 1 144 ? 77.872 -24.111 43.840 1.00 53.64 ? 225 THR B C 1 ATOM 3706 O O . THR B 1 144 ? 76.863 -23.409 43.924 1.00 57.35 ? 225 THR B O 1 ATOM 3707 C CB . THR B 1 144 ? 78.906 -25.076 41.769 1.00 51.90 ? 225 THR B CB 1 ATOM 3708 O OG1 . THR B 1 144 ? 78.543 -23.908 41.025 1.00 64.63 ? 225 THR B OG1 1 ATOM 3709 C CG2 . THR B 1 144 ? 78.953 -26.288 40.843 1.00 40.64 ? 225 THR B CG2 1 ATOM 3710 N N . GLN B 1 145 ? 78.983 -23.864 44.534 1.00 61.26 ? 226 GLN B N 1 ATOM 3711 C CA . GLN B 1 145 ? 79.082 -22.711 45.431 1.00 56.02 ? 226 GLN B CA 1 ATOM 3712 C C . GLN B 1 145 ? 79.231 -21.376 44.676 1.00 55.81 ? 226 GLN B C 1 ATOM 3713 O O . GLN B 1 145 ? 79.199 -20.309 45.287 1.00 56.20 ? 226 GLN B O 1 ATOM 3714 C CB . GLN B 1 145 ? 80.223 -22.899 46.429 1.00 58.58 ? 226 GLN B CB 1 ATOM 3715 C CG . GLN B 1 145 ? 81.582 -23.218 45.815 1.00 55.20 ? 226 GLN B CG 1 ATOM 3716 C CD . GLN B 1 145 ? 82.643 -23.462 46.883 1.00 54.66 ? 226 GLN B CD 1 ATOM 3717 O OE1 . GLN B 1 145 ? 83.304 -24.504 46.912 1.00 59.66 ? 226 GLN B OE1 1 ATOM 3718 N NE2 . GLN B 1 145 ? 82.797 -22.506 47.774 1.00 55.78 ? 226 GLN B NE2 1 ATOM 3719 N N . ALA B 1 146 ? 79.388 -21.446 43.355 1.00 51.46 ? 227 ALA B N 1 ATOM 3720 C CA . ALA B 1 146 ? 79.385 -20.259 42.513 1.00 45.63 ? 227 ALA B CA 1 ATOM 3721 C C . ALA B 1 146 ? 80.399 -19.237 42.997 1.00 50.06 ? 227 ALA B C 1 ATOM 3722 O O . ALA B 1 146 ? 80.122 -18.033 43.094 1.00 52.09 ? 227 ALA B O 1 ATOM 3723 C CB . ALA B 1 146 ? 77.987 -19.644 42.436 1.00 45.08 ? 227 ALA B CB 1 ATOM 3724 N N . SER B 1 147 ? 81.597 -19.731 43.246 1.00 46.69 ? 228 SER B N 1 ATOM 3725 C CA . SER B 1 147 ? 82.615 -18.961 43.916 1.00 52.27 ? 228 SER B CA 1 ATOM 3726 C C . SER B 1 147 ? 83.829 -19.874 43.950 1.00 56.87 ? 228 SER B C 1 ATOM 3727 O O . SER B 1 147 ? 83.714 -21.072 43.706 1.00 58.18 ? 228 SER B O 1 ATOM 3728 C CB . SER B 1 147 ? 82.127 -18.627 45.332 1.00 51.62 ? 228 SER B CB 1 ATOM 3729 O OG . SER B 1 147 ? 83.186 -18.301 46.206 1.00 58.84 ? 228 SER B OG 1 ATOM 3730 N N . SER B 1 148 ? 84.994 -19.313 44.231 1.00 49.56 ? 229 SER B N 1 ATOM 3731 C CA . SER B 1 148 ? 86.197 -20.118 44.294 1.00 49.80 ? 229 SER B CA 1 ATOM 3732 C C . SER B 1 148 ? 86.075 -21.247 45.321 1.00 58.06 ? 229 SER B C 1 ATOM 3733 O O . SER B 1 148 ? 85.673 -21.016 46.466 1.00 55.06 ? 229 SER B O 1 ATOM 3734 C CB . SER B 1 148 ? 87.401 -19.232 44.635 1.00 44.34 ? 229 SER B CB 1 ATOM 3735 O OG . SER B 1 148 ? 88.577 -20.017 44.734 1.00 45.23 ? 229 SER B OG 1 ATOM 3736 N N . CYS B 1 149 ? 86.411 -22.466 44.914 1.00 51.43 ? 230 CYS B N 1 ATOM 3737 C CA . CYS B 1 149 ? 86.580 -23.535 45.886 1.00 47.98 ? 230 CYS B CA 1 ATOM 3738 C C . CYS B 1 149 ? 88.003 -23.422 46.431 1.00 50.49 ? 230 CYS B C 1 ATOM 3739 O O . CYS B 1 149 ? 88.779 -22.599 45.944 1.00 51.69 ? 230 CYS B O 1 ATOM 3740 C CB . CYS B 1 149 ? 86.258 -24.909 45.295 1.00 55.56 ? 230 CYS B CB 1 ATOM 3741 S SG . CYS B 1 149 ? 87.163 -25.375 43.789 1.00 59.01 ? 230 CYS B SG 1 ATOM 3742 N N . ILE B 1 150 ? 88.335 -24.198 47.458 1.00 62.07 ? 231 ILE B N 1 ATOM 3743 C CA . ILE B 1 150 ? 89.581 -23.964 48.195 1.00 57.64 ? 231 ILE B CA 1 ATOM 3744 C C . ILE B 1 150 ? 90.536 -25.152 48.087 1.00 60.99 ? 231 ILE B C 1 ATOM 3745 O O . ILE B 1 150 ? 90.175 -26.299 48.388 1.00 58.87 ? 231 ILE B O 1 ATOM 3746 C CB . ILE B 1 150 ? 89.324 -23.641 49.699 1.00 55.65 ? 231 ILE B CB 1 ATOM 3747 C CG1 . ILE B 1 150 ? 88.309 -22.509 49.859 1.00 55.89 ? 231 ILE B CG1 1 ATOM 3748 C CG2 . ILE B 1 150 ? 90.618 -23.274 50.417 1.00 54.42 ? 231 ILE B CG2 1 ATOM 3749 C CD1 . ILE B 1 150 ? 88.738 -21.214 49.235 1.00 58.22 ? 231 ILE B CD1 1 ATOM 3750 N N . CYS B 1 151 ? 91.754 -24.863 47.643 1.00 59.39 ? 232 CYS B N 1 ATOM 3751 C CA . CYS B 1 151 ? 92.802 -25.871 47.542 1.00 54.97 ? 232 CYS B CA 1 ATOM 3752 C C . CYS B 1 151 ? 93.910 -25.519 48.496 1.00 60.90 ? 232 CYS B C 1 ATOM 3753 O O . CYS B 1 151 ? 94.310 -24.360 48.613 1.00 66.99 ? 232 CYS B O 1 ATOM 3754 C CB . CYS B 1 151 ? 93.404 -25.903 46.137 1.00 48.34 ? 232 CYS B CB 1 ATOM 3755 S SG . CYS B 1 151 ? 92.300 -26.433 44.862 1.00 69.62 ? 232 CYS B SG 1 ATOM 3756 N N . ASN B 1 152 ? 94.433 -26.520 49.173 1.00 66.92 ? 233 ASN B N 1 ATOM 3757 C CA . ASN B 1 152 ? 95.599 -26.275 49.986 1.00 63.86 ? 233 ASN B CA 1 ATOM 3758 C C . ASN B 1 152 ? 96.393 -27.537 50.198 1.00 67.15 ? 233 ASN B C 1 ATOM 3759 O O . ASN B 1 152 ? 95.843 -28.562 50.620 1.00 65.19 ? 233 ASN B O 1 ATOM 3760 C CB . ASN B 1 152 ? 95.196 -25.671 51.319 1.00 70.06 ? 233 ASN B CB 1 ATOM 3761 C CG . ASN B 1 152 ? 96.382 -25.183 52.109 1.00 69.60 ? 233 ASN B CG 1 ATOM 3762 O OD1 . ASN B 1 152 ? 97.275 -24.518 51.569 1.00 65.19 ? 233 ASN B OD1 1 ATOM 3763 N ND2 . ASN B 1 152 ? 96.419 -25.538 53.395 1.00 66.79 ? 233 ASN B ND2 1 ATOM 3764 N N . ASP B 1 153 ? 97.687 -27.447 49.900 1.00 80.12 ? 234 ASP B N 1 ATOM 3765 C CA . ASP B 1 153 ? 98.621 -28.560 50.052 1.00 82.94 ? 234 ASP B CA 1 ATOM 3766 C C . ASP B 1 153 ? 98.177 -29.787 49.257 1.00 73.29 ? 234 ASP B C 1 ATOM 3767 O O . ASP B 1 153 ? 98.221 -30.919 49.759 1.00 72.66 ? 234 ASP B O 1 ATOM 3768 C CB . ASP B 1 153 ? 98.822 -28.906 51.533 1.00 84.24 ? 234 ASP B CB 1 ATOM 3769 C CG . ASP B 1 153 ? 100.136 -29.609 51.787 1.00 101.85 ? 234 ASP B CG 1 ATOM 3770 O OD1 . ASP B 1 153 ? 101.017 -29.565 50.896 1.00 102.02 ? 234 ASP B OD1 1 ATOM 3771 O OD2 . ASP B 1 153 ? 100.289 -30.200 52.880 1.00 108.37 ? 234 ASP B OD2 1 ATOM 3772 N N . GLY B 1 154 ? 97.727 -29.557 48.024 1.00 62.75 ? 235 GLY B N 1 ATOM 3773 C CA . GLY B 1 154 ? 97.402 -30.665 47.147 1.00 71.41 ? 235 GLY B CA 1 ATOM 3774 C C . GLY B 1 154 ? 95.959 -31.148 47.099 1.00 68.50 ? 235 GLY B C 1 ATOM 3775 O O . GLY B 1 154 ? 95.535 -31.739 46.088 1.00 68.64 ? 235 GLY B O 1 ATOM 3776 N N . THR B 1 155 ? 95.204 -30.924 48.172 1.00 50.82 ? 236 THR B N 1 ATOM 3777 C CA . THR B 1 155 ? 93.777 -31.254 48.147 1.00 59.38 ? 236 THR B CA 1 ATOM 3778 C C . THR B 1 155 ? 92.842 -30.028 48.086 1.00 56.18 ? 236 THR B C 1 ATOM 3779 O O . THR B 1 155 ? 93.139 -28.961 48.629 1.00 60.43 ? 236 THR B O 1 ATOM 3780 C CB . THR B 1 155 ? 93.359 -32.229 49.277 1.00 59.63 ? 236 THR B CB 1 ATOM 3781 O OG1 . THR B 1 155 ? 92.231 -31.695 49.984 1.00 58.67 ? 236 THR B OG1 1 ATOM 3782 C CG2 . THR B 1 155 ? 94.530 -32.505 50.227 1.00 56.99 ? 236 THR B CG2 1 ATOM 3783 N N . CYS B 1 156 ? 91.717 -30.201 47.400 1.00 46.45 ? 237 CYS B N 1 ATOM 3784 C CA . CYS B 1 156 ? 90.792 -29.112 47.162 1.00 43.79 ? 237 CYS B CA 1 ATOM 3785 C C . CYS B 1 156 ? 89.463 -29.386 47.839 1.00 46.18 ? 237 CYS B C 1 ATOM 3786 O O . CYS B 1 156 ? 89.024 -30.531 47.905 1.00 53.24 ? 237 CYS B O 1 ATOM 3787 C CB . CYS B 1 156 ? 90.595 -28.929 45.654 1.00 50.24 ? 237 CYS B CB 1 ATOM 3788 S SG . CYS B 1 156 ? 92.123 -28.473 44.798 1.00 66.49 ? 237 CYS B SG 1 ATOM 3789 N N . TYR B 1 157 ? 88.823 -28.347 48.368 1.00 56.02 ? 238 TYR B N 1 ATOM 3790 C CA . TYR B 1 157 ? 87.523 -28.541 49.016 1.00 42.78 ? 238 TYR B CA 1 ATOM 3791 C C . TYR B 1 157 ? 86.468 -27.657 48.353 1.00 50.09 ? 238 TYR B C 1 ATOM 3792 O O . TYR B 1 157 ? 86.753 -26.525 47.926 1.00 60.07 ? 238 TYR B O 1 ATOM 3793 C CB . TYR B 1 157 ? 87.598 -28.337 50.548 1.00 41.52 ? 238 TYR B CB 1 ATOM 3794 C CG . TYR B 1 157 ? 88.849 -28.922 51.197 1.00 55.42 ? 238 TYR B CG 1 ATOM 3795 C CD1 . TYR B 1 157 ? 90.016 -28.168 51.287 1.00 62.13 ? 238 TYR B CD1 1 ATOM 3796 C CD2 . TYR B 1 157 ? 88.873 -30.222 51.706 1.00 52.34 ? 238 TYR B CD2 1 ATOM 3797 C CE1 . TYR B 1 157 ? 91.171 -28.679 51.861 1.00 52.75 ? 238 TYR B CE1 1 ATOM 3798 C CE2 . TYR B 1 157 ? 90.037 -30.747 52.289 1.00 51.90 ? 238 TYR B CE2 1 ATOM 3799 C CZ . TYR B 1 157 ? 91.181 -29.963 52.356 1.00 55.31 ? 238 TYR B CZ 1 ATOM 3800 O OH . TYR B 1 157 ? 92.351 -30.441 52.911 1.00 59.36 ? 238 TYR B OH 1 ATOM 3801 N N . THR B 1 158 ? 85.266 -28.211 48.215 1.00 48.21 ? 239 THR B N 1 ATOM 3802 C CA . THR B 1 158 ? 84.158 -27.500 47.588 1.00 51.55 ? 239 THR B CA 1 ATOM 3803 C C . THR B 1 158 ? 82.869 -28.013 48.226 1.00 51.20 ? 239 THR B C 1 ATOM 3804 O O . THR B 1 158 ? 82.847 -29.117 48.788 1.00 51.63 ? 239 THR B O 1 ATOM 3805 C CB . THR B 1 158 ? 84.153 -27.672 46.024 1.00 51.61 ? 239 THR B CB 1 ATOM 3806 O OG1 . THR B 1 158 ? 83.207 -26.770 45.429 1.00 47.83 ? 239 THR B OG1 1 ATOM 3807 C CG2 . THR B 1 158 ? 83.809 -29.113 45.615 1.00 52.67 ? 239 THR B CG2 1 ATOM 3808 N N . ILE B 1 159 ? 81.813 -27.202 48.167 1.00 49.23 ? 240 ILE B N 1 ATOM 3809 C CA . ILE B 1 159 ? 80.539 -27.563 48.789 1.00 55.80 ? 240 ILE B CA 1 ATOM 3810 C C . ILE B 1 159 ? 79.395 -27.542 47.777 1.00 54.71 ? 240 ILE B C 1 ATOM 3811 O O . ILE B 1 159 ? 79.203 -26.559 47.068 1.00 56.70 ? 240 ILE B O 1 ATOM 3812 C CB . ILE B 1 159 ? 80.187 -26.623 49.972 1.00 54.58 ? 240 ILE B CB 1 ATOM 3813 C CG1 . ILE B 1 159 ? 81.207 -26.766 51.097 1.00 58.56 ? 240 ILE B CG1 1 ATOM 3814 C CG2 . ILE B 1 159 ? 78.804 -26.932 50.521 1.00 43.30 ? 240 ILE B CG2 1 ATOM 3815 C CD1 . ILE B 1 159 ? 81.464 -25.467 51.853 1.00 51.11 ? 240 ILE B CD1 1 ATOM 3816 N N . ILE B 1 160 ? 78.619 -28.623 47.738 1.00 57.88 ? 241 ILE B N 1 ATOM 3817 C CA . ILE B 1 160 ? 77.562 -28.765 46.745 1.00 59.11 ? 241 ILE B CA 1 ATOM 3818 C C . ILE B 1 160 ? 76.174 -28.859 47.372 1.00 54.85 ? 241 ILE B C 1 ATOM 3819 O O . ILE B 1 160 ? 75.975 -29.552 48.374 1.00 56.27 ? 241 ILE B O 1 ATOM 3820 C CB . ILE B 1 160 ? 77.834 -29.973 45.825 1.00 56.71 ? 241 ILE B CB 1 ATOM 3821 C CG1 . ILE B 1 160 ? 79.132 -29.737 45.055 1.00 61.51 ? 241 ILE B CG1 1 ATOM 3822 C CG2 . ILE B 1 160 ? 76.691 -30.187 44.843 1.00 52.62 ? 241 ILE B CG2 1 ATOM 3823 C CD1 . ILE B 1 160 ? 79.480 -30.869 44.158 1.00 70.61 ? 241 ILE B CD1 1 ATOM 3824 N N . ALA B 1 161 ? 75.219 -28.143 46.779 1.00 52.61 ? 242 ALA B N 1 ATOM 3825 C CA . ALA B 1 161 ? 73.859 -28.117 47.298 1.00 53.57 ? 242 ALA B CA 1 ATOM 3826 C C . ALA B 1 161 ? 72.929 -28.955 46.429 1.00 64.07 ? 242 ALA B C 1 ATOM 3827 O O . ALA B 1 161 ? 73.113 -29.060 45.218 1.00 64.41 ? 242 ALA B O 1 ATOM 3828 C CB . ALA B 1 161 ? 73.355 -26.681 47.421 1.00 38.05 ? 242 ALA B CB 1 ATOM 3829 N N . ASP B 1 162 ? 71.929 -29.543 47.074 1.00 65.66 ? 243 ASP B N 1 ATOM 3830 C CA . ASP B 1 162 ? 70.944 -30.383 46.421 1.00 60.71 ? 243 ASP B CA 1 ATOM 3831 C C . ASP B 1 162 ? 69.563 -30.010 46.988 1.00 67.72 ? 243 ASP B C 1 ATOM 3832 O O . ASP B 1 162 ? 69.467 -29.216 47.933 1.00 67.83 ? 243 ASP B O 1 ATOM 3833 C CB . ASP B 1 162 ? 71.281 -31.847 46.719 1.00 72.71 ? 243 ASP B CB 1 ATOM 3834 C CG . ASP B 1 162 ? 70.539 -32.827 45.820 1.00 74.24 ? 243 ASP B CG 1 ATOM 3835 O OD1 . ASP B 1 162 ? 69.691 -32.377 45.011 1.00 73.00 ? 243 ASP B OD1 1 ATOM 3836 O OD2 . ASP B 1 162 ? 70.792 -34.054 45.938 1.00 74.96 ? 243 ASP B OD2 1 ATOM 3837 N N . GLY B 1 163 ? 68.501 -30.568 46.409 1.00 68.63 ? 244 GLY B N 1 ATOM 3838 C CA . GLY B 1 163 ? 67.155 -30.355 46.911 1.00 70.19 ? 244 GLY B CA 1 ATOM 3839 C C . GLY B 1 163 ? 66.324 -29.453 46.020 1.00 78.17 ? 244 GLY B C 1 ATOM 3840 O O . GLY B 1 163 ? 66.872 -28.633 45.279 1.00 84.70 ? 244 GLY B O 1 ATOM 3841 N N . THR B 1 164 ? 65.000 -29.585 46.107 1.00 75.16 ? 245 THR B N 1 ATOM 3842 C CA . THR B 1 164 ? 64.102 -28.872 45.195 1.00 65.78 ? 245 THR B CA 1 ATOM 3843 C C . THR B 1 164 ? 63.470 -27.603 45.787 1.00 63.86 ? 245 THR B C 1 ATOM 3844 O O . THR B 1 164 ? 63.027 -26.728 45.044 1.00 65.94 ? 245 THR B O 1 ATOM 3845 C CB . THR B 1 164 ? 63.012 -29.801 44.643 1.00 64.93 ? 245 THR B CB 1 ATOM 3846 O OG1 . THR B 1 164 ? 62.229 -30.327 45.724 1.00 69.69 ? 245 THR B OG1 1 ATOM 3847 C CG2 . THR B 1 164 ? 63.647 -30.948 43.882 1.00 50.07 ? 245 THR B CG2 1 ATOM 3848 N N . THR B 1 165 ? 63.412 -27.518 47.115 1.00 63.47 ? 246 THR B N 1 ATOM 3849 C CA . THR B 1 165 ? 63.131 -26.248 47.804 1.00 73.16 ? 246 THR B CA 1 ATOM 3850 C C . THR B 1 165 ? 64.269 -25.912 48.773 1.00 75.37 ? 246 THR B C 1 ATOM 3851 O O . THR B 1 165 ? 65.044 -26.794 49.160 1.00 77.95 ? 246 THR B O 1 ATOM 3852 C CB . THR B 1 165 ? 61.802 -26.281 48.607 1.00 83.00 ? 246 THR B CB 1 ATOM 3853 O OG1 . THR B 1 165 ? 61.747 -27.472 49.408 1.00 78.15 ? 246 THR B OG1 1 ATOM 3854 C CG2 . THR B 1 165 ? 60.601 -26.229 47.681 1.00 73.73 ? 246 THR B CG2 1 ATOM 3855 N N . TYR B 1 166 ? 64.358 -24.649 49.182 1.00 71.68 ? 247 TYR B N 1 ATOM 3856 C CA . TYR B 1 166 ? 65.373 -24.235 50.146 1.00 65.30 ? 247 TYR B CA 1 ATOM 3857 C C . TYR B 1 166 ? 64.930 -24.633 51.532 1.00 67.33 ? 247 TYR B C 1 ATOM 3858 O O . TYR B 1 166 ? 65.739 -24.764 52.458 1.00 82.54 ? 247 TYR B O 1 ATOM 3859 C CB . TYR B 1 166 ? 65.599 -22.737 50.045 1.00 72.36 ? 247 TYR B CB 1 ATOM 3860 C CG . TYR B 1 166 ? 66.002 -22.336 48.654 1.00 87.72 ? 247 TYR B CG 1 ATOM 3861 C CD1 . TYR B 1 166 ? 67.052 -22.984 47.999 1.00 89.98 ? 247 TYR B CD1 1 ATOM 3862 C CD2 . TYR B 1 166 ? 65.322 -21.337 47.973 1.00 90.95 ? 247 TYR B CD2 1 ATOM 3863 C CE1 . TYR B 1 166 ? 67.424 -22.633 46.703 1.00 94.50 ? 247 TYR B CE1 1 ATOM 3864 C CE2 . TYR B 1 166 ? 65.690 -20.976 46.671 1.00 94.06 ? 247 TYR B CE2 1 ATOM 3865 C CZ . TYR B 1 166 ? 66.739 -21.627 46.043 1.00 96.92 ? 247 TYR B CZ 1 ATOM 3866 O OH . TYR B 1 166 ? 67.099 -21.272 44.761 1.00 90.33 ? 247 TYR B OH 1 ATOM 3867 N N . THR B 1 167 ? 63.626 -24.846 51.648 1.00 68.33 ? 248 THR B N 1 ATOM 3868 C CA . THR B 1 167 ? 63.010 -25.333 52.874 1.00 78.45 ? 248 THR B CA 1 ATOM 3869 C C . THR B 1 167 ? 63.514 -26.736 53.215 1.00 77.00 ? 248 THR B C 1 ATOM 3870 O O . THR B 1 167 ? 63.645 -27.085 54.387 1.00 87.10 ? 248 THR B O 1 ATOM 3871 C CB . THR B 1 167 ? 61.476 -25.309 52.745 1.00 84.95 ? 248 THR B CB 1 ATOM 3872 O OG1 . THR B 1 167 ? 61.057 -26.197 51.702 1.00 86.26 ? 248 THR B OG1 1 ATOM 3873 C CG2 . THR B 1 167 ? 61.018 -23.915 52.385 1.00 81.89 ? 248 THR B CG2 1 ATOM 3874 N N . ALA B 1 168 ? 63.804 -27.524 52.179 1.00 78.04 ? 249 ALA B N 1 ATOM 3875 C CA . ALA B 1 168 ? 64.380 -28.857 52.334 1.00 72.53 ? 249 ALA B CA 1 ATOM 3876 C C . ALA B 1 168 ? 65.609 -28.985 51.443 1.00 83.48 ? 249 ALA B C 1 ATOM 3877 O O . ALA B 1 168 ? 65.719 -29.908 50.626 1.00 84.19 ? 249 ALA B O 1 ATOM 3878 C CB . ALA B 1 168 ? 63.365 -29.917 51.978 1.00 61.84 ? 249 ALA B CB 1 ATOM 3879 N N . SER B 1 169 ? 66.525 -28.035 51.584 1.00 86.07 ? 250 SER B N 1 ATOM 3880 C CA . SER B 1 169 ? 67.778 -28.073 50.845 1.00 73.41 ? 250 SER B CA 1 ATOM 3881 C C . SER B 1 169 ? 68.738 -29.043 51.535 1.00 66.87 ? 250 SER B C 1 ATOM 3882 O O . SER B 1 169 ? 68.480 -29.504 52.641 1.00 55.71 ? 250 SER B O 1 ATOM 3883 C CB . SER B 1 169 ? 68.383 -26.666 50.750 1.00 66.47 ? 250 SER B CB 1 ATOM 3884 O OG . SER B 1 169 ? 69.300 -26.410 51.797 1.00 55.94 ? 250 SER B OG 1 ATOM 3885 N N . SER B 1 170 ? 69.837 -29.379 50.881 1.00 60.82 ? 251 SER B N 1 ATOM 3886 C CA . SER B 1 170 ? 70.751 -30.374 51.436 1.00 52.84 ? 251 SER B CA 1 ATOM 3887 C C . SER B 1 170 ? 72.168 -30.060 50.939 1.00 58.45 ? 251 SER B C 1 ATOM 3888 O O . SER B 1 170 ? 72.337 -29.532 49.826 1.00 57.76 ? 251 SER B O 1 ATOM 3889 C CB . SER B 1 170 ? 70.264 -31.778 51.046 1.00 55.86 ? 251 SER B CB 1 ATOM 3890 O OG . SER B 1 170 ? 71.297 -32.562 50.485 1.00 70.63 ? 251 SER B OG 1 ATOM 3891 N N . HIS B 1 171 ? 73.184 -30.303 51.769 1.00 56.44 ? 252 HIS B N 1 ATOM 3892 C CA . HIS B 1 171 ? 74.531 -29.805 51.426 1.00 59.52 ? 252 HIS B CA 1 ATOM 3893 C C . HIS B 1 171 ? 75.653 -30.783 51.730 1.00 57.06 ? 252 HIS B C 1 ATOM 3894 O O . HIS B 1 171 ? 75.629 -31.477 52.743 1.00 61.43 ? 252 HIS B O 1 ATOM 3895 C CB . HIS B 1 171 ? 74.794 -28.438 52.075 1.00 56.11 ? 252 HIS B CB 1 ATOM 3896 C CG . HIS B 1 171 ? 73.685 -27.463 51.845 1.00 60.90 ? 252 HIS B CG 1 ATOM 3897 N ND1 . HIS B 1 171 ? 73.662 -26.603 50.758 1.00 58.25 ? 252 HIS B ND1 1 ATOM 3898 C CD2 . HIS B 1 171 ? 72.528 -27.257 52.511 1.00 50.24 ? 252 HIS B CD2 1 ATOM 3899 C CE1 . HIS B 1 171 ? 72.554 -25.893 50.800 1.00 52.31 ? 252 HIS B CE1 1 ATOM 3900 N NE2 . HIS B 1 171 ? 71.844 -26.262 51.844 1.00 48.32 ? 252 HIS B NE2 1 ATOM 3901 N N . ARG B 1 172 ? 76.634 -30.838 50.836 1.00 55.47 ? 253 ARG B N 1 ATOM 3902 C CA . ARG B 1 172 ? 77.726 -31.790 50.972 1.00 54.42 ? 253 ARG B CA 1 ATOM 3903 C C . ARG B 1 172 ? 79.082 -31.139 50.791 1.00 52.32 ? 253 ARG B C 1 ATOM 3904 O O . ARG B 1 172 ? 79.238 -30.191 50.021 1.00 53.70 ? 253 ARG B O 1 ATOM 3905 C CB . ARG B 1 172 ? 77.559 -32.941 49.986 1.00 55.87 ? 253 ARG B CB 1 ATOM 3906 C CG . ARG B 1 172 ? 76.405 -33.817 50.330 1.00 57.94 ? 253 ARG B CG 1 ATOM 3907 C CD . ARG B 1 172 ? 75.982 -34.658 49.169 1.00 67.62 ? 253 ARG B CD 1 ATOM 3908 N NE . ARG B 1 172 ? 74.844 -35.496 49.537 1.00 71.10 ? 253 ARG B NE 1 ATOM 3909 C CZ . ARG B 1 172 ? 74.642 -36.715 49.048 1.00 80.66 ? 253 ARG B CZ 1 ATOM 3910 N NH1 . ARG B 1 172 ? 75.505 -37.228 48.175 1.00 74.72 ? 253 ARG B NH1 1 ATOM 3911 N NH2 . ARG B 1 172 ? 73.584 -37.419 49.435 1.00 85.95 ? 253 ARG B NH2 1 ATOM 3912 N N . LEU B 1 173 ? 80.059 -31.668 51.516 1.00 57.60 ? 254 LEU B N 1 ATOM 3913 C CA . LEU B 1 173 ? 81.398 -31.108 51.566 1.00 53.80 ? 254 LEU B CA 1 ATOM 3914 C C . LEU B 1 173 ? 82.358 -32.114 50.935 1.00 55.98 ? 254 LEU B C 1 ATOM 3915 O O . LEU B 1 173 ? 82.551 -33.199 51.471 1.00 54.90 ? 254 LEU B O 1 ATOM 3916 C CB . LEU B 1 173 ? 81.764 -30.825 53.025 1.00 41.74 ? 254 LEU B CB 1 ATOM 3917 C CG . LEU B 1 173 ? 83.235 -30.492 53.298 1.00 56.70 ? 254 LEU B CG 1 ATOM 3918 C CD1 . LEU B 1 173 ? 83.654 -29.222 52.582 1.00 57.69 ? 254 LEU B CD1 1 ATOM 3919 C CD2 . LEU B 1 173 ? 83.494 -30.380 54.798 1.00 44.31 ? 254 LEU B CD2 1 ATOM 3920 N N . TYR B 1 174 ? 82.945 -31.755 49.793 1.00 55.76 ? 255 TYR B N 1 ATOM 3921 C CA . TYR B 1 174 ? 83.735 -32.699 48.995 1.00 45.51 ? 255 TYR B CA 1 ATOM 3922 C C . TYR B 1 174 ? 85.234 -32.478 49.163 1.00 49.18 ? 255 TYR B C 1 ATOM 3923 O O . TYR B 1 174 ? 85.694 -31.334 49.222 1.00 51.82 ? 255 TYR B O 1 ATOM 3924 C CB . TYR B 1 174 ? 83.343 -32.610 47.498 1.00 48.69 ? 255 TYR B CB 1 ATOM 3925 C CG . TYR B 1 174 ? 82.051 -33.342 47.188 1.00 57.88 ? 255 TYR B CG 1 ATOM 3926 C CD1 . TYR B 1 174 ? 80.813 -32.751 47.433 1.00 64.01 ? 255 TYR B CD1 1 ATOM 3927 C CD2 . TYR B 1 174 ? 82.067 -34.633 46.681 1.00 57.66 ? 255 TYR B CD2 1 ATOM 3928 C CE1 . TYR B 1 174 ? 79.637 -33.419 47.181 1.00 56.14 ? 255 TYR B CE1 1 ATOM 3929 C CE2 . TYR B 1 174 ? 80.894 -35.313 46.425 1.00 56.55 ? 255 TYR B CE2 1 ATOM 3930 C CZ . TYR B 1 174 ? 79.680 -34.702 46.675 1.00 58.01 ? 255 TYR B CZ 1 ATOM 3931 O OH . TYR B 1 174 ? 78.498 -35.383 46.423 1.00 66.48 ? 255 TYR B OH 1 ATOM 3932 N N . ARG B 1 175 ? 85.983 -33.577 49.243 1.00 43.08 ? 256 ARG B N 1 ATOM 3933 C CA . ARG B 1 175 ? 87.446 -33.550 49.228 1.00 39.79 ? 256 ARG B CA 1 ATOM 3934 C C . ARG B 1 175 ? 87.911 -34.006 47.838 1.00 49.54 ? 256 ARG B C 1 ATOM 3935 O O . ARG B 1 175 ? 87.647 -35.139 47.433 1.00 59.91 ? 256 ARG B O 1 ATOM 3936 C CB . ARG B 1 175 ? 87.991 -34.524 50.274 1.00 42.99 ? 256 ARG B CB 1 ATOM 3937 C CG . ARG B 1 175 ? 89.521 -34.680 50.276 1.00 57.72 ? 256 ARG B CG 1 ATOM 3938 C CD . ARG B 1 175 ? 89.979 -35.831 51.185 1.00 63.68 ? 256 ARG B CD 1 ATOM 3939 N NE . ARG B 1 175 ? 89.242 -35.841 52.450 1.00 74.74 ? 256 ARG B NE 1 ATOM 3940 C CZ . ARG B 1 175 ? 89.514 -35.040 53.478 1.00 84.94 ? 256 ARG B CZ 1 ATOM 3941 N NH1 . ARG B 1 175 ? 90.517 -34.162 53.401 1.00 79.67 ? 256 ARG B NH1 1 ATOM 3942 N NH2 . ARG B 1 175 ? 88.783 -35.115 54.585 1.00 86.87 ? 256 ARG B NH2 1 ATOM 3943 N N . LEU B 1 176 ? 88.596 -33.135 47.105 1.00 52.93 ? 257 LEU B N 1 ATOM 3944 C CA . LEU B 1 176 ? 89.054 -33.472 45.752 1.00 44.43 ? 257 LEU B CA 1 ATOM 3945 C C . LEU B 1 176 ? 90.577 -33.604 45.698 1.00 52.25 ? 257 LEU B C 1 ATOM 3946 O O . LEU B 1 176 ? 91.299 -32.818 46.321 1.00 63.89 ? 257 LEU B O 1 ATOM 3947 C CB . LEU B 1 176 ? 88.589 -32.411 44.766 1.00 46.40 ? 257 LEU B CB 1 ATOM 3948 C CG . LEU B 1 176 ? 87.221 -32.612 44.088 1.00 60.90 ? 257 LEU B CG 1 ATOM 3949 C CD1 . LEU B 1 176 ? 86.270 -33.468 44.924 1.00 48.90 ? 257 LEU B CD1 1 ATOM 3950 C CD2 . LEU B 1 176 ? 86.573 -31.255 43.722 1.00 48.63 ? 257 LEU B CD2 1 ATOM 3951 N N . VAL B 1 177 ? 91.074 -34.611 44.984 1.00 49.77 ? 258 VAL B N 1 ATOM 3952 C CA . VAL B 1 177 ? 92.522 -34.763 44.811 1.00 52.40 ? 258 VAL B CA 1 ATOM 3953 C C . VAL B 1 177 ? 92.824 -34.947 43.335 1.00 51.50 ? 258 VAL B C 1 ATOM 3954 O O . VAL B 1 177 ? 92.407 -35.941 42.735 1.00 58.71 ? 258 VAL B O 1 ATOM 3955 C CB . VAL B 1 177 ? 93.118 -35.959 45.624 1.00 41.58 ? 258 VAL B CB 1 ATOM 3956 C CG1 . VAL B 1 177 ? 94.623 -36.123 45.323 1.00 47.85 ? 258 VAL B CG1 1 ATOM 3957 C CG2 . VAL B 1 177 ? 92.915 -35.765 47.107 1.00 36.68 ? 258 VAL B CG2 1 ATOM 3958 N N . ASN B 1 178 ? 93.535 -33.985 42.750 1.00 56.42 ? 259 ASN B N 1 ATOM 3959 C CA . ASN B 1 178 ? 93.794 -34.000 41.311 1.00 53.87 ? 259 ASN B CA 1 ATOM 3960 C C . ASN B 1 178 ? 92.508 -34.209 40.508 1.00 48.20 ? 259 ASN B C 1 ATOM 3961 O O . ASN B 1 178 ? 92.475 -35.007 39.569 1.00 44.20 ? 259 ASN B O 1 ATOM 3962 C CB . ASN B 1 178 ? 94.806 -35.088 40.955 1.00 50.58 ? 259 ASN B CB 1 ATOM 3963 C CG . ASN B 1 178 ? 96.139 -34.892 41.644 1.00 61.35 ? 259 ASN B CG 1 ATOM 3964 O OD1 . ASN B 1 178 ? 96.385 -33.856 42.271 1.00 73.33 ? 259 ASN B OD1 1 ATOM 3965 N ND2 . ASN B 1 178 ? 97.021 -35.891 41.516 1.00 72.39 ? 259 ASN B ND2 1 ATOM 3966 N N . GLY B 1 179 ? 91.445 -33.518 40.912 1.00 55.15 ? 260 GLY B N 1 ATOM 3967 C CA . GLY B 1 179 ? 90.164 -33.638 40.241 1.00 55.15 ? 260 GLY B CA 1 ATOM 3968 C C . GLY B 1 179 ? 89.387 -34.930 40.460 1.00 54.19 ? 260 GLY B C 1 ATOM 3969 O O . GLY B 1 179 ? 88.341 -35.137 39.838 1.00 62.36 ? 260 GLY B O 1 ATOM 3970 N N . THR B 1 180 ? 89.881 -35.805 41.330 1.00 52.88 ? 261 THR B N 1 ATOM 3971 C CA . THR B 1 180 ? 89.120 -36.999 41.680 1.00 58.04 ? 261 THR B CA 1 ATOM 3972 C C . THR B 1 180 ? 88.492 -36.867 43.070 1.00 58.58 ? 261 THR B C 1 ATOM 3973 O O . THR B 1 180 ? 89.146 -36.442 44.026 1.00 52.60 ? 261 THR B O 1 ATOM 3974 C CB . THR B 1 180 ? 89.986 -38.262 41.658 1.00 65.56 ? 261 THR B CB 1 ATOM 3975 O OG1 . THR B 1 180 ? 90.762 -38.300 40.451 1.00 70.99 ? 261 THR B OG1 1 ATOM 3976 C CG2 . THR B 1 180 ? 89.096 -39.494 41.741 1.00 57.25 ? 261 THR B CG2 1 ATOM 3977 N N . SER B 1 181 ? 87.219 -37.228 43.185 1.00 60.12 ? 262 SER B N 1 ATOM 3978 C CA . SER B 1 181 ? 86.583 -37.249 44.495 1.00 46.57 ? 262 SER B CA 1 ATOM 3979 C C . SER B 1 181 ? 87.244 -38.319 45.380 1.00 57.06 ? 262 SER B C 1 ATOM 3980 O O . SER B 1 181 ? 87.397 -39.497 44.987 1.00 52.27 ? 262 SER B O 1 ATOM 3981 C CB . SER B 1 181 ? 85.071 -37.486 44.382 1.00 54.58 ? 262 SER B CB 1 ATOM 3982 O OG . SER B 1 181 ? 84.444 -37.420 45.660 1.00 68.47 ? 262 SER B OG 1 ATOM 3983 N N . ALA B 1 182 ? 87.648 -37.887 46.572 1.00 46.62 ? 263 ALA B N 1 ATOM 3984 C CA . ALA B 1 182 ? 88.247 -38.775 47.561 1.00 49.38 ? 263 ALA B CA 1 ATOM 3985 C C . ALA B 1 182 ? 87.301 -38.898 48.741 1.00 56.00 ? 263 ALA B C 1 ATOM 3986 O O . ALA B 1 182 ? 87.670 -39.378 49.816 1.00 65.82 ? 263 ALA B O 1 ATOM 3987 C CB . ALA B 1 182 ? 89.577 -38.228 48.013 1.00 45.81 ? 263 ALA B CB 1 ATOM 3988 N N . GLY B 1 183 ? 86.075 -38.444 48.534 1.00 52.32 ? 264 GLY B N 1 ATOM 3989 C CA . GLY B 1 183 ? 85.081 -38.518 49.575 1.00 56.78 ? 264 GLY B CA 1 ATOM 3990 C C . GLY B 1 183 ? 84.417 -37.193 49.897 1.00 58.79 ? 264 GLY B C 1 ATOM 3991 O O . GLY B 1 183 ? 84.940 -36.108 49.611 1.00 61.00 ? 264 GLY B O 1 ATOM 3992 N N . TRP B 1 184 ? 83.242 -37.312 50.498 1.00 51.67 ? 265 TRP B N 1 ATOM 3993 C CA . TRP B 1 184 ? 82.461 -36.181 50.951 1.00 59.80 ? 265 TRP B CA 1 ATOM 3994 C C . TRP B 1 184 ? 81.819 -36.491 52.311 1.00 63.39 ? 265 TRP B C 1 ATOM 3995 O O . TRP B 1 184 ? 81.754 -37.655 52.745 1.00 57.97 ? 265 TRP B O 1 ATOM 3996 C CB . TRP B 1 184 ? 81.362 -35.814 49.937 1.00 54.03 ? 265 TRP B CB 1 ATOM 3997 C CG . TRP B 1 184 ? 80.361 -36.929 49.712 1.00 53.06 ? 265 TRP B CG 1 ATOM 3998 C CD1 . TRP B 1 184 ? 80.475 -37.970 48.822 1.00 54.68 ? 265 TRP B CD1 1 ATOM 3999 C CD2 . TRP B 1 184 ? 79.103 -37.117 50.384 1.00 47.95 ? 265 TRP B CD2 1 ATOM 4000 N NE1 . TRP B 1 184 ? 79.368 -38.790 48.899 1.00 35.90 ? 265 TRP B NE1 1 ATOM 4001 C CE2 . TRP B 1 184 ? 78.513 -38.292 49.850 1.00 52.55 ? 265 TRP B CE2 1 ATOM 4002 C CE3 . TRP B 1 184 ? 78.422 -36.411 51.385 1.00 49.76 ? 265 TRP B CE3 1 ATOM 4003 C CZ2 . TRP B 1 184 ? 77.273 -38.776 50.290 1.00 41.01 ? 265 TRP B CZ2 1 ATOM 4004 C CZ3 . TRP B 1 184 ? 77.190 -36.892 51.826 1.00 42.70 ? 265 TRP B CZ3 1 ATOM 4005 C CH2 . TRP B 1 184 ? 76.629 -38.064 51.274 1.00 48.32 ? 265 TRP B CH2 1 ATOM 4006 N N . LYS B 1 185 ? 81.339 -35.433 52.963 1.00 49.71 ? 266 LYS B N 1 ATOM 4007 C CA . LYS B 1 185 ? 80.609 -35.560 54.210 1.00 42.52 ? 266 LYS B CA 1 ATOM 4008 C C . LYS B 1 185 ? 79.308 -34.765 54.167 1.00 49.19 ? 266 LYS B C 1 ATOM 4009 O O . LYS B 1 185 ? 79.282 -33.615 53.720 1.00 60.14 ? 266 LYS B O 1 ATOM 4010 C CB . LYS B 1 185 ? 81.481 -35.051 55.352 1.00 47.71 ? 266 LYS B CB 1 ATOM 4011 C CG . LYS B 1 185 ? 80.915 -35.224 56.739 1.00 39.13 ? 266 LYS B CG 1 ATOM 4012 C CD . LYS B 1 185 ? 82.076 -35.157 57.709 1.00 60.38 ? 266 LYS B CD 1 ATOM 4013 C CE . LYS B 1 185 ? 81.675 -35.271 59.163 1.00 53.52 ? 266 LYS B CE 1 ATOM 4014 N NZ . LYS B 1 185 ? 82.951 -35.234 59.920 1.00 56.31 ? 266 LYS B NZ 1 ATOM 4015 N N . ALA B 1 186 ? 78.226 -35.377 54.636 1.00 54.74 ? 267 ALA B N 1 ATOM 4016 C CA . ALA B 1 186 ? 76.989 -34.639 54.860 1.00 59.80 ? 267 ALA B CA 1 ATOM 4017 C C . ALA B 1 186 ? 77.197 -33.504 55.878 1.00 64.50 ? 267 ALA B C 1 ATOM 4018 O O . ALA B 1 186 ? 77.879 -33.666 56.897 1.00 72.57 ? 267 ALA B O 1 ATOM 4019 C CB . ALA B 1 186 ? 75.898 -35.571 55.338 1.00 47.05 ? 267 ALA B CB 1 ATOM 4020 N N . LEU B 1 187 ? 76.606 -32.356 55.577 1.00 58.78 ? 268 LEU B N 1 ATOM 4021 C CA . LEU B 1 187 ? 76.522 -31.250 56.509 1.00 61.63 ? 268 LEU B CA 1 ATOM 4022 C C . LEU B 1 187 ? 75.111 -31.200 57.102 1.00 63.00 ? 268 LEU B C 1 ATOM 4023 O O . LEU B 1 187 ? 74.108 -31.289 56.378 1.00 71.74 ? 268 LEU B O 1 ATOM 4024 C CB . LEU B 1 187 ? 76.858 -29.942 55.795 1.00 59.19 ? 268 LEU B CB 1 ATOM 4025 C CG . LEU B 1 187 ? 78.305 -29.861 55.300 1.00 54.22 ? 268 LEU B CG 1 ATOM 4026 C CD1 . LEU B 1 187 ? 78.458 -28.746 54.274 1.00 45.75 ? 268 LEU B CD1 1 ATOM 4027 C CD2 . LEU B 1 187 ? 79.273 -29.664 56.477 1.00 43.39 ? 268 LEU B CD2 1 ATOM 4028 N N . ASP B 1 188 ? 75.037 -31.073 58.422 1.00 62.27 ? 269 ASP B N 1 ATOM 4029 C CA . ASP B 1 188 ? 73.757 -30.956 59.096 1.00 67.79 ? 269 ASP B CA 1 ATOM 4030 C C . ASP B 1 188 ? 73.256 -29.519 58.943 1.00 62.73 ? 269 ASP B C 1 ATOM 4031 O O . ASP B 1 188 ? 73.787 -28.600 59.553 1.00 68.89 ? 269 ASP B O 1 ATOM 4032 C CB . ASP B 1 188 ? 73.922 -31.333 60.577 1.00 73.85 ? 269 ASP B CB 1 ATOM 4033 C CG . ASP B 1 188 ? 72.588 -31.488 61.314 1.00 87.39 ? 269 ASP B CG 1 ATOM 4034 O OD1 . ASP B 1 188 ? 71.536 -31.031 60.799 1.00 71.40 ? 269 ASP B OD1 1 ATOM 4035 O OD2 . ASP B 1 188 ? 72.606 -32.060 62.432 1.00 93.74 ? 269 ASP B OD2 1 ATOM 4036 N N . THR B 1 189 ? 72.255 -29.324 58.096 1.00 59.41 ? 270 THR B N 1 ATOM 4037 C CA . THR B 1 189 ? 71.664 -28.003 57.898 1.00 67.55 ? 270 THR B CA 1 ATOM 4038 C C . THR B 1 189 ? 70.213 -28.060 58.317 1.00 71.04 ? 270 THR B C 1 ATOM 4039 O O . THR B 1 189 ? 69.334 -27.502 57.653 1.00 79.24 ? 270 THR B O 1 ATOM 4040 C CB . THR B 1 189 ? 71.736 -27.543 56.425 1.00 74.15 ? 270 THR B CB 1 ATOM 4041 O OG1 . THR B 1 189 ? 70.648 -28.116 55.650 1.00 71.69 ? 270 THR B OG1 1 ATOM 4042 C CG2 . THR B 1 189 ? 73.105 -27.902 55.842 1.00 69.94 ? 270 THR B CG2 1 ATOM 4043 N N . THR B 1 190 ? 69.970 -28.770 59.410 1.00 54.52 ? 271 THR B N 1 ATOM 4044 C CA . THR B 1 190 ? 68.627 -28.898 59.943 1.00 65.21 ? 271 THR B CA 1 ATOM 4045 C C . THR B 1 190 ? 68.102 -27.549 60.413 1.00 66.78 ? 271 THR B C 1 ATOM 4046 O O . THR B 1 190 ? 68.673 -26.932 61.331 1.00 66.07 ? 271 THR B O 1 ATOM 4047 C CB . THR B 1 190 ? 68.589 -29.898 61.109 1.00 75.49 ? 271 THR B CB 1 ATOM 4048 O OG1 . THR B 1 190 ? 69.003 -31.192 60.640 1.00 79.61 ? 271 THR B OG1 1 ATOM 4049 C CG2 . THR B 1 190 ? 67.187 -29.992 61.695 1.00 55.57 ? 271 THR B CG2 1 ATOM 4050 N N . GLY B 1 191 ? 67.030 -27.087 59.768 1.00 61.99 ? 272 GLY B N 1 ATOM 4051 C CA . GLY B 1 191 ? 66.377 -25.854 60.174 1.00 72.25 ? 272 GLY B CA 1 ATOM 4052 C C . GLY B 1 191 ? 66.911 -24.605 59.496 1.00 78.85 ? 272 GLY B C 1 ATOM 4053 O O . GLY B 1 191 ? 66.526 -23.486 59.861 1.00 78.49 ? 272 GLY B O 1 ATOM 4054 N N . PHE B 1 192 ? 67.803 -24.791 58.522 1.00 74.69 ? 273 PHE B N 1 ATOM 4055 C CA . PHE B 1 192 ? 68.256 -23.683 57.674 1.00 70.44 ? 273 PHE B CA 1 ATOM 4056 C C . PHE B 1 192 ? 68.739 -24.100 56.275 1.00 64.27 ? 273 PHE B C 1 ATOM 4057 O O . PHE B 1 192 ? 68.804 -25.290 55.929 1.00 77.75 ? 273 PHE B O 1 ATOM 4058 C CB . PHE B 1 192 ? 69.314 -22.812 58.376 1.00 65.18 ? 273 PHE B CB 1 ATOM 4059 C CG . PHE B 1 192 ? 70.634 -23.506 58.605 1.00 65.66 ? 273 PHE B CG 1 ATOM 4060 C CD1 . PHE B 1 192 ? 70.761 -24.473 59.600 1.00 60.85 ? 273 PHE B CD1 1 ATOM 4061 C CD2 . PHE B 1 192 ? 71.758 -23.181 57.841 1.00 59.41 ? 273 PHE B CD2 1 ATOM 4062 C CE1 . PHE B 1 192 ? 71.981 -25.115 59.832 1.00 48.73 ? 273 PHE B CE1 1 ATOM 4063 C CE2 . PHE B 1 192 ? 72.987 -23.817 58.068 1.00 59.98 ? 273 PHE B CE2 1 ATOM 4064 C CZ . PHE B 1 192 ? 73.096 -24.784 59.069 1.00 55.90 ? 273 PHE B CZ 1 ATOM 4065 N N . ASN B 1 193 ? 69.061 -23.091 55.477 1.00 50.37 ? 274 ASN B N 1 ATOM 4066 C CA . ASN B 1 193 ? 69.529 -23.286 54.116 1.00 61.11 ? 274 ASN B CA 1 ATOM 4067 C C . ASN B 1 193 ? 70.908 -22.633 53.931 1.00 70.71 ? 274 ASN B C 1 ATOM 4068 O O . ASN B 1 193 ? 71.170 -21.560 54.486 1.00 72.00 ? 274 ASN B O 1 ATOM 4069 C CB . ASN B 1 193 ? 68.483 -22.728 53.146 1.00 63.55 ? 274 ASN B CB 1 ATOM 4070 C CG . ASN B 1 193 ? 69.021 -22.520 51.760 1.00 58.69 ? 274 ASN B CG 1 ATOM 4071 O OD1 . ASN B 1 193 ? 69.008 -21.398 51.240 1.00 63.01 ? 274 ASN B OD1 1 ATOM 4072 N ND2 . ASN B 1 193 ? 69.495 -23.600 51.141 1.00 51.93 ? 274 ASN B ND2 1 ATOM 4073 N N . PHE B 1 194 ? 71.782 -23.294 53.168 1.00 64.99 ? 275 PHE B N 1 ATOM 4074 C CA . PHE B 1 194 ? 73.184 -22.891 53.038 1.00 54.21 ? 275 PHE B CA 1 ATOM 4075 C C . PHE B 1 194 ? 73.650 -22.825 51.570 1.00 54.92 ? 275 PHE B C 1 ATOM 4076 O O . PHE B 1 194 ? 74.463 -23.640 51.109 1.00 49.25 ? 275 PHE B O 1 ATOM 4077 C CB . PHE B 1 194 ? 74.064 -23.859 53.839 1.00 55.54 ? 275 PHE B CB 1 ATOM 4078 C CG . PHE B 1 194 ? 75.464 -23.358 54.089 1.00 61.63 ? 275 PHE B CG 1 ATOM 4079 C CD1 . PHE B 1 194 ? 75.683 -22.230 54.863 1.00 62.35 ? 275 PHE B CD1 1 ATOM 4080 C CD2 . PHE B 1 194 ? 76.566 -24.028 53.568 1.00 59.22 ? 275 PHE B CD2 1 ATOM 4081 C CE1 . PHE B 1 194 ? 76.988 -21.758 55.106 1.00 60.79 ? 275 PHE B CE1 1 ATOM 4082 C CE2 . PHE B 1 194 ? 77.860 -23.569 53.805 1.00 60.11 ? 275 PHE B CE2 1 ATOM 4083 C CZ . PHE B 1 194 ? 78.071 -22.425 54.582 1.00 49.15 ? 275 PHE B CZ 1 ATOM 4084 N N . GLU B 1 195 ? 73.144 -21.840 50.837 1.00 48.93 ? 276 GLU B N 1 ATOM 4085 C CA . GLU B 1 195 ? 73.510 -21.678 49.428 1.00 49.24 ? 276 GLU B CA 1 ATOM 4086 C C . GLU B 1 195 ? 74.775 -20.841 49.192 1.00 57.54 ? 276 GLU B C 1 ATOM 4087 O O . GLU B 1 195 ? 75.118 -19.959 49.984 1.00 60.67 ? 276 GLU B O 1 ATOM 4088 C CB . GLU B 1 195 ? 72.342 -21.065 48.649 1.00 54.29 ? 276 GLU B CB 1 ATOM 4089 C CG . GLU B 1 195 ? 71.038 -21.882 48.685 1.00 65.36 ? 276 GLU B CG 1 ATOM 4090 C CD . GLU B 1 195 ? 71.166 -23.276 48.069 1.00 67.15 ? 276 GLU B CD 1 ATOM 4091 O OE1 . GLU B 1 195 ? 71.974 -23.458 47.120 1.00 65.29 ? 276 GLU B OE1 1 ATOM 4092 O OE2 . GLU B 1 195 ? 70.450 -24.192 48.536 1.00 67.18 ? 276 GLU B OE2 1 ATOM 4093 N N . PHE B 1 196 ? 75.462 -21.138 48.094 1.00 59.38 ? 277 PHE B N 1 ATOM 4094 C CA . PHE B 1 196 ? 76.590 -20.334 47.603 1.00 51.79 ? 277 PHE B CA 1 ATOM 4095 C C . PHE B 1 196 ? 77.670 -19.947 48.601 1.00 54.47 ? 277 PHE B C 1 ATOM 4096 O O . PHE B 1 196 ? 78.064 -18.779 48.641 1.00 65.79 ? 277 PHE B O 1 ATOM 4097 C CB . PHE B 1 196 ? 76.069 -19.056 46.927 1.00 42.79 ? 277 PHE B CB 1 ATOM 4098 C CG . PHE B 1 196 ? 74.818 -19.276 46.142 1.00 56.06 ? 277 PHE B CG 1 ATOM 4099 C CD1 . PHE B 1 196 ? 74.836 -20.045 44.968 1.00 56.10 ? 277 PHE B CD1 1 ATOM 4100 C CD2 . PHE B 1 196 ? 73.612 -18.743 46.583 1.00 51.22 ? 277 PHE B CD2 1 ATOM 4101 C CE1 . PHE B 1 196 ? 73.657 -20.270 44.238 1.00 48.45 ? 277 PHE B CE1 1 ATOM 4102 C CE2 . PHE B 1 196 ? 72.433 -18.954 45.869 1.00 55.12 ? 277 PHE B CE2 1 ATOM 4103 C CZ . PHE B 1 196 ? 72.449 -19.722 44.691 1.00 52.92 ? 277 PHE B CZ 1 ATOM 4104 N N . PRO B 1 197 ? 78.182 -20.918 49.378 1.00 55.03 ? 278 PRO B N 1 ATOM 4105 C CA . PRO B 1 197 ? 79.236 -20.533 50.329 1.00 44.25 ? 278 PRO B CA 1 ATOM 4106 C C . PRO B 1 197 ? 80.425 -19.938 49.595 1.00 49.20 ? 278 PRO B C 1 ATOM 4107 O O . PRO B 1 197 ? 80.783 -20.406 48.518 1.00 53.22 ? 278 PRO B O 1 ATOM 4108 C CB . PRO B 1 197 ? 79.637 -21.858 50.976 1.00 50.76 ? 278 PRO B CB 1 ATOM 4109 C CG . PRO B 1 197 ? 79.225 -22.910 49.996 1.00 59.98 ? 278 PRO B CG 1 ATOM 4110 C CD . PRO B 1 197 ? 78.016 -22.380 49.280 1.00 50.68 ? 278 PRO B CD 1 ATOM 4111 N N . THR B 1 198 ? 80.992 -18.876 50.146 1.00 63.89 ? 279 THR B N 1 ATOM 4112 C CA . THR B 1 198 ? 82.204 -18.291 49.594 1.00 59.87 ? 279 THR B CA 1 ATOM 4113 C C . THR B 1 198 ? 83.219 -18.283 50.730 1.00 57.42 ? 279 THR B C 1 ATOM 4114 O O . THR B 1 198 ? 82.898 -17.952 51.878 1.00 54.71 ? 279 THR B O 1 ATOM 4115 C CB . THR B 1 198 ? 81.949 -16.891 48.972 1.00 48.00 ? 279 THR B CB 1 ATOM 4116 O OG1 . THR B 1 198 ? 83.172 -16.357 48.436 1.00 52.87 ? 279 THR B OG1 1 ATOM 4117 C CG2 . THR B 1 198 ? 81.341 -15.927 49.992 1.00 41.77 ? 279 THR B CG2 1 ATOM 4118 N N . CYS B 1 199 ? 84.433 -18.712 50.431 1.00 58.79 ? 280 CYS B N 1 ATOM 4119 C CA . CYS B 1 199 ? 85.289 -19.194 51.499 1.00 56.35 ? 280 CYS B CA 1 ATOM 4120 C C . CYS B 1 199 ? 86.678 -18.594 51.492 1.00 60.99 ? 280 CYS B C 1 ATOM 4121 O O . CYS B 1 199 ? 87.091 -17.968 50.496 1.00 50.09 ? 280 CYS B O 1 ATOM 4122 C CB . CYS B 1 199 ? 85.409 -20.723 51.382 1.00 49.57 ? 280 CYS B CB 1 ATOM 4123 S SG . CYS B 1 199 ? 83.826 -21.561 51.211 1.00 77.85 ? 280 CYS B SG 1 ATOM 4124 N N . TYR B 1 200 ? 87.394 -18.804 52.603 1.00 47.55 ? 281 TYR B N 1 ATOM 4125 C CA . TYR B 1 200 ? 88.829 -18.495 52.674 1.00 53.65 ? 281 TYR B CA 1 ATOM 4126 C C . TYR B 1 200 ? 89.549 -19.439 53.650 1.00 57.80 ? 281 TYR B C 1 ATOM 4127 O O . TYR B 1 200 ? 88.901 -20.090 54.489 1.00 53.03 ? 281 TYR B O 1 ATOM 4128 C CB . TYR B 1 200 ? 89.051 -17.026 53.051 1.00 53.02 ? 281 TYR B CB 1 ATOM 4129 C CG . TYR B 1 200 ? 88.542 -16.667 54.424 1.00 54.07 ? 281 TYR B CG 1 ATOM 4130 C CD1 . TYR B 1 200 ? 87.180 -16.612 54.691 1.00 58.75 ? 281 TYR B CD1 1 ATOM 4131 C CD2 . TYR B 1 200 ? 89.424 -16.386 55.460 1.00 60.53 ? 281 TYR B CD2 1 ATOM 4132 C CE1 . TYR B 1 200 ? 86.709 -16.288 55.953 1.00 49.78 ? 281 TYR B CE1 1 ATOM 4133 C CE2 . TYR B 1 200 ? 88.965 -16.056 56.723 1.00 56.74 ? 281 TYR B CE2 1 ATOM 4134 C CZ . TYR B 1 200 ? 87.608 -16.008 56.964 1.00 57.81 ? 281 TYR B CZ 1 ATOM 4135 O OH . TYR B 1 200 ? 87.145 -15.680 58.220 1.00 59.48 ? 281 TYR B OH 1 ATOM 4136 N N . TYR B 1 201 ? 90.876 -19.514 53.534 1.00 54.58 ? 282 TYR B N 1 ATOM 4137 C CA . TYR B 1 201 ? 91.682 -20.368 54.403 1.00 53.61 ? 282 TYR B CA 1 ATOM 4138 C C . TYR B 1 201 ? 92.588 -19.583 55.379 1.00 56.10 ? 282 TYR B C 1 ATOM 4139 O O . TYR B 1 201 ? 93.299 -18.675 54.959 1.00 63.56 ? 282 TYR B O 1 ATOM 4140 C CB . TYR B 1 201 ? 92.556 -21.325 53.560 1.00 56.35 ? 282 TYR B CB 1 ATOM 4141 C CG . TYR B 1 201 ? 93.478 -22.168 54.421 1.00 71.25 ? 282 TYR B CG 1 ATOM 4142 C CD1 . TYR B 1 201 ? 93.010 -23.326 55.039 1.00 64.58 ? 282 TYR B CD1 1 ATOM 4143 C CD2 . TYR B 1 201 ? 94.801 -21.788 54.656 1.00 65.79 ? 282 TYR B CD2 1 ATOM 4144 C CE1 . TYR B 1 201 ? 93.830 -24.088 55.844 1.00 63.54 ? 282 TYR B CE1 1 ATOM 4145 C CE2 . TYR B 1 201 ? 95.631 -22.548 55.468 1.00 74.08 ? 282 TYR B CE2 1 ATOM 4146 C CZ . TYR B 1 201 ? 95.135 -23.700 56.057 1.00 73.61 ? 282 TYR B CZ 1 ATOM 4147 O OH . TYR B 1 201 ? 95.937 -24.475 56.863 1.00 67.40 ? 282 TYR B OH 1 ATOM 4148 N N . THR B 1 202 ? 92.547 -19.934 56.666 1.00 50.91 ? 283 THR B N 1 ATOM 4149 C CA . THR B 1 202 ? 93.663 -19.669 57.606 1.00 76.54 ? 283 THR B CA 1 ATOM 4150 C C . THR B 1 202 ? 93.610 -20.485 58.875 1.00 77.80 ? 283 THR B C 1 ATOM 4151 O O . THR B 1 202 ? 92.536 -20.952 59.287 1.00 62.66 ? 283 THR B O 1 ATOM 4152 C CB . THR B 1 202 ? 93.825 -18.194 58.122 1.00 82.40 ? 283 THR B CB 1 ATOM 4153 O OG1 . THR B 1 202 ? 92.554 -17.646 58.507 1.00 59.00 ? 283 THR B OG1 1 ATOM 4154 C CG2 . THR B 1 202 ? 94.607 -17.303 57.120 1.00 71.11 ? 283 THR B CG2 1 ATOM 4155 N N . SER B 1 203 ? 94.784 -20.581 59.506 1.00 81.28 ? 284 SER B N 1 ATOM 4156 C CA . SER B 1 203 ? 94.935 -21.182 60.819 1.00 67.80 ? 284 SER B CA 1 ATOM 4157 C C . SER B 1 203 ? 94.337 -22.560 60.818 1.00 61.92 ? 284 SER B C 1 ATOM 4158 O O . SER B 1 203 ? 93.519 -22.884 61.694 1.00 69.12 ? 284 SER B O 1 ATOM 4159 C CB . SER B 1 203 ? 94.260 -20.327 61.888 1.00 76.53 ? 284 SER B CB 1 ATOM 4160 O OG . SER B 1 203 ? 95.068 -19.209 62.215 1.00 82.32 ? 284 SER B OG 1 ATOM 4161 N N . GLY B 1 204 ? 94.726 -23.349 59.814 1.00 69.25 ? 285 GLY B N 1 ATOM 4162 C CA . GLY B 1 204 ? 94.306 -24.733 59.715 1.00 75.78 ? 285 GLY B CA 1 ATOM 4163 C C . GLY B 1 204 ? 92.828 -24.951 59.467 1.00 73.38 ? 285 GLY B C 1 ATOM 4164 O O . GLY B 1 204 ? 92.343 -26.078 59.601 1.00 82.96 ? 285 GLY B O 1 ATOM 4165 N N . LYS B 1 205 ? 92.112 -23.887 59.113 1.00 68.10 ? 286 LYS B N 1 ATOM 4166 C CA . LYS B 1 205 ? 90.680 -23.997 58.849 1.00 62.47 ? 286 LYS B CA 1 ATOM 4167 C C . LYS B 1 205 ? 90.234 -23.314 57.562 1.00 56.15 ? 286 LYS B C 1 ATOM 4168 O O . LYS B 1 205 ? 90.820 -22.327 57.101 1.00 71.75 ? 286 LYS B O 1 ATOM 4169 C CB . LYS B 1 205 ? 89.872 -23.476 60.041 1.00 70.96 ? 286 LYS B CB 1 ATOM 4170 C CG . LYS B 1 205 ? 89.802 -24.473 61.176 1.00 73.96 ? 286 LYS B CG 1 ATOM 4171 C CD . LYS B 1 205 ? 89.083 -23.928 62.381 1.00 77.20 ? 286 LYS B CD 1 ATOM 4172 C CE . LYS B 1 205 ? 89.604 -24.583 63.642 1.00 81.08 ? 286 LYS B CE 1 ATOM 4173 N NZ . LYS B 1 205 ? 89.081 -23.905 64.854 1.00 98.12 ? 286 LYS B NZ 1 ATOM 4174 N N . VAL B 1 206 ? 89.196 -23.874 56.969 1.00 55.01 ? 287 VAL B N 1 ATOM 4175 C CA . VAL B 1 206 ? 88.508 -23.203 55.882 1.00 54.46 ? 287 VAL B CA 1 ATOM 4176 C C . VAL B 1 206 ? 87.246 -22.591 56.480 1.00 61.72 ? 287 VAL B C 1 ATOM 4177 O O . VAL B 1 206 ? 86.489 -23.254 57.206 1.00 50.88 ? 287 VAL B O 1 ATOM 4178 C CB . VAL B 1 206 ? 88.158 -24.174 54.741 1.00 56.17 ? 287 VAL B CB 1 ATOM 4179 C CG1 . VAL B 1 206 ? 87.237 -23.503 53.722 1.00 55.25 ? 287 VAL B CG1 1 ATOM 4180 C CG2 . VAL B 1 206 ? 89.428 -24.692 54.069 1.00 58.05 ? 287 VAL B CG2 1 ATOM 4181 N N . LYS B 1 207 ? 87.037 -21.313 56.211 1.00 65.16 ? 288 LYS B N 1 ATOM 4182 C CA . LYS B 1 207 ? 85.884 -20.628 56.764 1.00 62.46 ? 288 LYS B CA 1 ATOM 4183 C C . LYS B 1 207 ? 85.015 -20.153 55.604 1.00 52.43 ? 288 LYS B C 1 ATOM 4184 O O . LYS B 1 207 ? 85.525 -19.601 54.621 1.00 57.81 ? 288 LYS B O 1 ATOM 4185 C CB . LYS B 1 207 ? 86.340 -19.487 57.692 1.00 54.94 ? 288 LYS B CB 1 ATOM 4186 C CG . LYS B 1 207 ? 87.099 -19.963 58.964 1.00 74.30 ? 288 LYS B CG 1 ATOM 4187 C CD . LYS B 1 207 ? 87.966 -18.847 59.608 1.00 64.96 ? 288 LYS B CD 1 ATOM 4188 C CE . LYS B 1 207 ? 88.779 -19.333 60.840 1.00 74.81 ? 288 LYS B CE 1 ATOM 4189 N NZ . LYS B 1 207 ? 88.135 -19.106 62.185 1.00 68.31 ? 288 LYS B NZ 1 ATOM 4190 N N . CYS B 1 208 ? 83.714 -20.414 55.699 1.00 54.24 ? 289 CYS B N 1 ATOM 4191 C CA . CYS B 1 208 ? 82.769 -20.115 54.612 1.00 56.47 ? 289 CYS B CA 1 ATOM 4192 C C . CYS B 1 208 ? 81.572 -19.325 55.103 1.00 53.51 ? 289 CYS B C 1 ATOM 4193 O O . CYS B 1 208 ? 81.035 -19.585 56.187 1.00 55.13 ? 289 CYS B O 1 ATOM 4194 C CB . CYS B 1 208 ? 82.253 -21.405 53.962 1.00 42.74 ? 289 CYS B CB 1 ATOM 4195 S SG . CYS B 1 208 ? 83.511 -22.343 53.088 1.00 89.41 ? 289 CYS B SG 1 ATOM 4196 N N . THR B 1 209 ? 81.165 -18.356 54.295 1.00 52.03 ? 290 THR B N 1 ATOM 4197 C CA . THR B 1 209 ? 79.938 -17.609 54.530 1.00 46.74 ? 290 THR B CA 1 ATOM 4198 C C . THR B 1 209 ? 78.908 -18.087 53.510 1.00 55.36 ? 290 THR B C 1 ATOM 4199 O O . THR B 1 209 ? 79.184 -18.126 52.298 1.00 55.17 ? 290 THR B O 1 ATOM 4200 C CB . THR B 1 209 ? 80.171 -16.119 54.338 1.00 56.07 ? 290 THR B CB 1 ATOM 4201 O OG1 . THR B 1 209 ? 81.209 -15.693 55.224 1.00 61.59 ? 290 THR B OG1 1 ATOM 4202 C CG2 . THR B 1 209 ? 78.898 -15.334 54.608 1.00 51.20 ? 290 THR B CG2 1 ATOM 4203 N N . GLY B 1 210 ? 77.728 -18.468 53.992 1.00 52.36 ? 291 GLY B N 1 ATOM 4204 C CA . GLY B 1 210 ? 76.689 -18.950 53.100 1.00 54.50 ? 291 GLY B CA 1 ATOM 4205 C C . GLY B 1 210 ? 75.544 -17.968 52.889 1.00 53.78 ? 291 GLY B C 1 ATOM 4206 O O . GLY B 1 210 ? 75.560 -16.833 53.383 1.00 60.90 ? 291 GLY B O 1 ATOM 4207 N N . THR B 1 211 ? 74.532 -18.413 52.157 1.00 56.93 ? 292 THR B N 1 ATOM 4208 C CA . THR B 1 211 ? 73.339 -17.605 51.957 1.00 52.48 ? 292 THR B CA 1 ATOM 4209 C C . THR B 1 211 ? 72.095 -18.413 52.313 1.00 56.46 ? 292 THR B C 1 ATOM 4210 O O . THR B 1 211 ? 71.901 -19.526 51.820 1.00 68.46 ? 292 THR B O 1 ATOM 4211 C CB . THR B 1 211 ? 73.276 -17.059 50.526 1.00 44.20 ? 292 THR B CB 1 ATOM 4212 O OG1 . THR B 1 211 ? 74.453 -16.267 50.277 1.00 60.96 ? 292 THR B OG1 1 ATOM 4213 C CG2 . THR B 1 211 ? 72.045 -16.205 50.348 1.00 45.57 ? 292 THR B CG2 1 ATOM 4214 N N . ASN B 1 212 ? 71.276 -17.867 53.205 1.00 61.96 ? 293 ASN B N 1 ATOM 4215 C CA . ASN B 1 212 ? 70.062 -18.553 53.648 1.00 67.98 ? 293 ASN B CA 1 ATOM 4216 C C . ASN B 1 212 ? 68.838 -17.930 52.980 1.00 65.51 ? 293 ASN B C 1 ATOM 4217 O O . ASN B 1 212 ? 68.428 -16.787 53.300 1.00 55.99 ? 293 ASN B O 1 ATOM 4218 C CB . ASN B 1 212 ? 69.933 -18.532 55.178 1.00 72.97 ? 293 ASN B CB 1 ATOM 4219 C CG . ASN B 1 212 ? 68.787 -19.402 55.688 1.00 74.21 ? 293 ASN B CG 1 ATOM 4220 O OD1 . ASN B 1 212 ? 67.805 -19.653 54.981 1.00 71.49 ? 293 ASN B OD1 1 ATOM 4221 N ND2 . ASN B 1 212 ? 68.908 -19.862 56.930 1.00 74.93 ? 293 ASN B ND2 1 ATOM 4222 N N . LEU B 1 213 ? 68.273 -18.701 52.051 1.00 58.41 ? 294 LEU B N 1 ATOM 4223 C CA . LEU B 1 213 ? 67.164 -18.255 51.201 1.00 62.70 ? 294 LEU B CA 1 ATOM 4224 C C . LEU B 1 213 ? 65.834 -18.594 51.817 1.00 63.40 ? 294 LEU B C 1 ATOM 4225 O O . LEU B 1 213 ? 64.779 -18.203 51.321 1.00 65.83 ? 294 LEU B O 1 ATOM 4226 C CB . LEU B 1 213 ? 67.227 -18.900 49.817 1.00 57.34 ? 294 LEU B CB 1 ATOM 4227 C CG . LEU B 1 213 ? 68.030 -18.240 48.703 1.00 61.78 ? 294 LEU B CG 1 ATOM 4228 C CD1 . LEU B 1 213 ? 68.936 -17.159 49.204 1.00 72.45 ? 294 LEU B CD1 1 ATOM 4229 C CD2 . LEU B 1 213 ? 68.852 -19.301 48.032 1.00 54.87 ? 294 LEU B CD2 1 ATOM 4230 N N . TRP B 1 214 ? 65.907 -19.344 52.902 1.00 60.58 ? 295 TRP B N 1 ATOM 4231 C CA . TRP B 1 214 ? 64.728 -19.876 53.529 1.00 64.93 ? 295 TRP B CA 1 ATOM 4232 C C . TRP B 1 214 ? 64.274 -18.995 54.701 1.00 64.70 ? 295 TRP B C 1 ATOM 4233 O O . TRP B 1 214 ? 63.244 -18.332 54.605 1.00 56.57 ? 295 TRP B O 1 ATOM 4234 C CB . TRP B 1 214 ? 65.001 -21.325 53.949 1.00 58.23 ? 295 TRP B CB 1 ATOM 4235 C CG . TRP B 1 214 ? 63.957 -21.911 54.812 1.00 60.52 ? 295 TRP B CG 1 ATOM 4236 C CD1 . TRP B 1 214 ? 62.672 -21.459 54.989 1.00 56.04 ? 295 TRP B CD1 1 ATOM 4237 C CD2 . TRP B 1 214 ? 64.097 -23.058 55.648 1.00 65.27 ? 295 TRP B CD2 1 ATOM 4238 N NE1 . TRP B 1 214 ? 62.010 -22.263 55.880 1.00 59.79 ? 295 TRP B NE1 1 ATOM 4239 C CE2 . TRP B 1 214 ? 62.862 -23.254 56.303 1.00 67.19 ? 295 TRP B CE2 1 ATOM 4240 C CE3 . TRP B 1 214 ? 65.150 -23.939 55.911 1.00 61.54 ? 295 TRP B CE3 1 ATOM 4241 C CZ2 . TRP B 1 214 ? 62.651 -24.297 57.206 1.00 52.62 ? 295 TRP B CZ2 1 ATOM 4242 C CZ3 . TRP B 1 214 ? 64.937 -24.978 56.810 1.00 65.80 ? 295 TRP B CZ3 1 ATOM 4243 C CH2 . TRP B 1 214 ? 63.698 -25.144 57.447 1.00 59.36 ? 295 TRP B CH2 1 ATOM 4244 N N . ASN B 1 215 ? 65.042 -18.969 55.789 1.00 56.32 ? 296 ASN B N 1 ATOM 4245 C CA . ASN B 1 215 ? 64.557 -18.369 57.036 1.00 61.62 ? 296 ASN B CA 1 ATOM 4246 C C . ASN B 1 215 ? 65.578 -17.530 57.806 1.00 69.72 ? 296 ASN B C 1 ATOM 4247 O O . ASN B 1 215 ? 65.620 -17.583 59.041 1.00 72.58 ? 296 ASN B O 1 ATOM 4248 C CB . ASN B 1 215 ? 64.016 -19.472 57.954 1.00 55.14 ? 296 ASN B CB 1 ATOM 4249 C CG . ASN B 1 215 ? 65.003 -20.615 58.145 1.00 56.64 ? 296 ASN B CG 1 ATOM 4250 O OD1 . ASN B 1 215 ? 66.198 -20.476 57.873 1.00 66.95 ? 296 ASN B OD1 1 ATOM 4251 N ND2 . ASN B 1 215 ? 64.502 -21.760 58.613 1.00 59.94 ? 296 ASN B ND2 1 ATOM 4252 N N . ASP B 1 216 ? 66.400 -16.760 57.097 1.00 63.80 ? 297 ASP B N 1 ATOM 4253 C CA . ASP B 1 216 ? 67.418 -15.982 57.793 1.00 65.75 ? 297 ASP B CA 1 ATOM 4254 C C . ASP B 1 216 ? 67.988 -14.818 57.005 1.00 56.71 ? 297 ASP B C 1 ATOM 4255 O O . ASP B 1 216 ? 68.629 -15.020 55.984 1.00 60.30 ? 297 ASP B O 1 ATOM 4256 C CB . ASP B 1 216 ? 68.570 -16.896 58.208 1.00 71.63 ? 297 ASP B CB 1 ATOM 4257 C CG . ASP B 1 216 ? 69.507 -16.230 59.184 1.00 78.19 ? 297 ASP B CG 1 ATOM 4258 O OD1 . ASP B 1 216 ? 69.121 -15.187 59.778 1.00 73.65 ? 297 ASP B OD1 1 ATOM 4259 O OD2 . ASP B 1 216 ? 70.627 -16.749 59.373 1.00 79.13 ? 297 ASP B OD2 1 ATOM 4260 N N . ALA B 1 217 ? 67.783 -13.610 57.524 1.00 62.67 ? 298 ALA B N 1 ATOM 4261 C CA . ALA B 1 217 ? 68.343 -12.394 56.947 1.00 64.33 ? 298 ALA B CA 1 ATOM 4262 C C . ALA B 1 217 ? 69.791 -12.138 57.392 1.00 66.70 ? 298 ALA B C 1 ATOM 4263 O O . ALA B 1 217 ? 70.458 -11.217 56.893 1.00 74.72 ? 298 ALA B O 1 ATOM 4264 C CB . ALA B 1 217 ? 67.468 -11.190 57.283 1.00 65.28 ? 298 ALA B CB 1 ATOM 4265 N N . LYS B 1 218 ? 70.264 -12.922 58.357 1.00 59.23 ? 299 LYS B N 1 ATOM 4266 C CA . LYS B 1 218 ? 71.694 -12.975 58.659 1.00 51.60 ? 299 LYS B CA 1 ATOM 4267 C C . LYS B 1 218 ? 72.299 -14.083 57.813 1.00 56.06 ? 299 LYS B C 1 ATOM 4268 O O . LYS B 1 218 ? 71.577 -14.826 57.155 1.00 64.22 ? 299 LYS B O 1 ATOM 4269 C CB . LYS B 1 218 ? 71.949 -13.250 60.143 1.00 57.43 ? 299 LYS B CB 1 ATOM 4270 C CG . LYS B 1 218 ? 71.684 -12.065 61.056 1.00 68.66 ? 299 LYS B CG 1 ATOM 4271 C CD . LYS B 1 218 ? 72.414 -12.212 62.391 1.00 68.80 ? 299 LYS B CD 1 ATOM 4272 C CE . LYS B 1 218 ? 71.528 -12.789 63.479 1.00 69.57 ? 299 LYS B CE 1 ATOM 4273 N NZ . LYS B 1 218 ? 72.325 -13.115 64.696 1.00 72.72 ? 299 LYS B NZ 1 ATOM 4274 N N . ARG B 1 219 ? 73.618 -14.203 57.823 1.00 64.06 ? 300 ARG B N 1 ATOM 4275 C CA . ARG B 1 219 ? 74.276 -15.203 56.990 1.00 59.32 ? 300 ARG B CA 1 ATOM 4276 C C . ARG B 1 219 ? 74.920 -16.321 57.799 1.00 59.63 ? 300 ARG B C 1 ATOM 4277 O O . ARG B 1 219 ? 75.828 -16.077 58.592 1.00 53.67 ? 300 ARG B O 1 ATOM 4278 C CB . ARG B 1 219 ? 75.336 -14.562 56.096 1.00 49.30 ? 300 ARG B CB 1 ATOM 4279 C CG . ARG B 1 219 ? 74.845 -13.453 55.180 1.00 47.12 ? 300 ARG B CG 1 ATOM 4280 C CD . ARG B 1 219 ? 75.996 -13.068 54.250 1.00 55.00 ? 300 ARG B CD 1 ATOM 4281 N NE . ARG B 1 219 ? 75.584 -12.177 53.176 1.00 60.26 ? 300 ARG B NE 1 ATOM 4282 C CZ . ARG B 1 219 ? 74.958 -12.584 52.080 1.00 52.83 ? 300 ARG B CZ 1 ATOM 4283 N NH1 . ARG B 1 219 ? 74.668 -13.871 51.920 1.00 45.79 ? 300 ARG B NH1 1 ATOM 4284 N NH2 . ARG B 1 219 ? 74.611 -11.701 51.153 1.00 52.82 ? 300 ARG B NH2 1 ATOM 4285 N N . PRO B 1 220 ? 74.488 -17.562 57.546 1.00 63.68 ? 301 PRO B N 1 ATOM 4286 C CA . PRO B 1 220 ? 75.063 -18.736 58.205 1.00 57.61 ? 301 PRO B CA 1 ATOM 4287 C C . PRO B 1 220 ? 76.547 -18.837 57.849 1.00 58.94 ? 301 PRO B C 1 ATOM 4288 O O . PRO B 1 220 ? 76.952 -18.420 56.755 1.00 61.28 ? 301 PRO B O 1 ATOM 4289 C CB . PRO B 1 220 ? 74.291 -19.889 57.572 1.00 46.92 ? 301 PRO B CB 1 ATOM 4290 C CG . PRO B 1 220 ? 74.030 -19.392 56.164 1.00 46.59 ? 301 PRO B CG 1 ATOM 4291 C CD . PRO B 1 220 ? 73.730 -17.923 56.333 1.00 54.72 ? 301 PRO B CD 1 ATOM 4292 N N . PHE B 1 221 ? 77.339 -19.381 58.768 1.00 49.78 ? 302 PHE B N 1 ATOM 4293 C CA . PHE B 1 221 ? 78.786 -19.425 58.625 1.00 54.33 ? 302 PHE B CA 1 ATOM 4294 C C . PHE B 1 221 ? 79.277 -20.820 59.005 1.00 62.80 ? 302 PHE B C 1 ATOM 4295 O O . PHE B 1 221 ? 78.645 -21.524 59.793 1.00 63.40 ? 302 PHE B O 1 ATOM 4296 C CB . PHE B 1 221 ? 79.412 -18.372 59.527 1.00 56.77 ? 302 PHE B CB 1 ATOM 4297 C CG . PHE B 1 221 ? 80.912 -18.238 59.390 1.00 64.12 ? 302 PHE B CG 1 ATOM 4298 C CD1 . PHE B 1 221 ? 81.782 -19.023 60.158 1.00 54.25 ? 302 PHE B CD1 1 ATOM 4299 C CD2 . PHE B 1 221 ? 81.452 -17.279 58.538 1.00 68.83 ? 302 PHE B CD2 1 ATOM 4300 C CE1 . PHE B 1 221 ? 83.159 -18.869 60.037 1.00 57.39 ? 302 PHE B CE1 1 ATOM 4301 C CE2 . PHE B 1 221 ? 82.828 -17.116 58.418 1.00 64.53 ? 302 PHE B CE2 1 ATOM 4302 C CZ . PHE B 1 221 ? 83.681 -17.905 59.167 1.00 63.92 ? 302 PHE B CZ 1 ATOM 4303 N N . LEU B 1 222 ? 80.415 -21.212 58.451 1.00 55.42 ? 303 LEU B N 1 ATOM 4304 C CA . LEU B 1 222 ? 80.836 -22.593 58.512 1.00 45.95 ? 303 LEU B CA 1 ATOM 4305 C C . LEU B 1 222 ? 82.334 -22.595 58.546 1.00 57.89 ? 303 LEU B C 1 ATOM 4306 O O . LEU B 1 222 ? 82.979 -21.883 57.766 1.00 60.73 ? 303 LEU B O 1 ATOM 4307 C CB . LEU B 1 222 ? 80.348 -23.301 57.237 1.00 58.63 ? 303 LEU B CB 1 ATOM 4308 C CG . LEU B 1 222 ? 80.433 -24.813 57.026 1.00 56.78 ? 303 LEU B CG 1 ATOM 4309 C CD1 . LEU B 1 222 ? 81.586 -25.135 56.093 1.00 56.41 ? 303 LEU B CD1 1 ATOM 4310 C CD2 . LEU B 1 222 ? 80.547 -25.582 58.356 1.00 49.91 ? 303 LEU B CD2 1 ATOM 4311 N N . GLU B 1 223 ? 82.895 -23.371 59.463 1.00 63.21 ? 304 GLU B N 1 ATOM 4312 C CA . GLU B 1 223 ? 84.325 -23.624 59.432 1.00 69.09 ? 304 GLU B CA 1 ATOM 4313 C C . GLU B 1 223 ? 84.565 -25.119 59.541 1.00 69.26 ? 304 GLU B C 1 ATOM 4314 O O . GLU B 1 223 ? 83.774 -25.849 60.147 1.00 70.22 ? 304 GLU B O 1 ATOM 4315 C CB . GLU B 1 223 ? 85.067 -22.845 60.521 1.00 71.23 ? 304 GLU B CB 1 ATOM 4316 C CG . GLU B 1 223 ? 84.546 -23.073 61.918 1.00 89.64 ? 304 GLU B CG 1 ATOM 4317 C CD . GLU B 1 223 ? 85.510 -22.586 62.985 1.00 98.99 ? 304 GLU B CD 1 ATOM 4318 O OE1 . GLU B 1 223 ? 85.946 -21.411 62.877 1.00 96.93 ? 304 GLU B OE1 1 ATOM 4319 O OE2 . GLU B 1 223 ? 85.827 -23.372 63.916 1.00 84.26 ? 304 GLU B OE2 1 ATOM 4320 N N . PHE B 1 224 ? 85.643 -25.576 58.917 1.00 58.67 ? 305 PHE B N 1 ATOM 4321 C CA . PHE B 1 224 ? 85.992 -26.986 58.948 1.00 52.86 ? 305 PHE B CA 1 ATOM 4322 C C . PHE B 1 224 ? 87.484 -27.145 58.725 1.00 62.49 ? 305 PHE B C 1 ATOM 4323 O O . PHE B 1 224 ? 88.141 -26.249 58.184 1.00 60.62 ? 305 PHE B O 1 ATOM 4324 C CB . PHE B 1 224 ? 85.201 -27.768 57.893 1.00 58.56 ? 305 PHE B CB 1 ATOM 4325 C CG . PHE B 1 224 ? 85.498 -27.363 56.460 1.00 54.24 ? 305 PHE B CG 1 ATOM 4326 C CD1 . PHE B 1 224 ? 86.563 -27.929 55.764 1.00 48.55 ? 305 PHE B CD1 1 ATOM 4327 C CD2 . PHE B 1 224 ? 84.692 -26.444 55.801 1.00 52.55 ? 305 PHE B CD2 1 ATOM 4328 C CE1 . PHE B 1 224 ? 86.833 -27.577 54.449 1.00 55.71 ? 305 PHE B CE1 1 ATOM 4329 C CE2 . PHE B 1 224 ? 84.954 -26.085 54.482 1.00 55.15 ? 305 PHE B CE2 1 ATOM 4330 C CZ . PHE B 1 224 ? 86.024 -26.661 53.800 1.00 55.19 ? 305 PHE B CZ 1 ATOM 4331 N N . ASP B 1 225 ? 88.017 -28.286 59.146 1.00 68.35 ? 306 ASP B N 1 ATOM 4332 C CA . ASP B 1 225 ? 89.439 -28.564 58.979 1.00 70.48 ? 306 ASP B CA 1 ATOM 4333 C C . ASP B 1 225 ? 89.649 -29.679 57.955 1.00 66.13 ? 306 ASP B C 1 ATOM 4334 O O . ASP B 1 225 ? 88.682 -30.178 57.372 1.00 55.79 ? 306 ASP B O 1 ATOM 4335 C CB . ASP B 1 225 ? 90.059 -28.927 60.329 1.00 78.08 ? 306 ASP B CB 1 ATOM 4336 C CG . ASP B 1 225 ? 89.488 -30.209 60.915 1.00 90.22 ? 306 ASP B CG 1 ATOM 4337 O OD1 . ASP B 1 225 ? 88.512 -30.757 60.354 1.00 86.95 ? 306 ASP B OD1 1 ATOM 4338 O OD2 . ASP B 1 225 ? 90.017 -30.663 61.954 1.00 100.99 ? 306 ASP B OD2 1 ATOM 4339 N N . GLN B 1 226 ? 90.896 -30.097 57.759 1.00 67.46 ? 307 GLN B N 1 ATOM 4340 C CA . GLN B 1 226 ? 91.188 -31.038 56.686 1.00 70.33 ? 307 GLN B CA 1 ATOM 4341 C C . GLN B 1 226 ? 90.655 -32.457 56.933 1.00 68.09 ? 307 GLN B C 1 ATOM 4342 O O . GLN B 1 226 ? 90.605 -33.276 56.019 1.00 72.15 ? 307 GLN B O 1 ATOM 4343 C CB . GLN B 1 226 ? 92.682 -31.056 56.359 1.00 73.14 ? 307 GLN B CB 1 ATOM 4344 C CG . GLN B 1 226 ? 93.533 -31.894 57.291 1.00 89.13 ? 307 GLN B CG 1 ATOM 4345 C CD . GLN B 1 226 ? 94.910 -32.177 56.704 1.00 105.97 ? 307 GLN B CD 1 ATOM 4346 O OE1 . GLN B 1 226 ? 95.135 -33.231 56.099 1.00 118.61 ? 307 GLN B OE1 1 ATOM 4347 N NE2 . GLN B 1 226 ? 95.835 -31.228 56.868 1.00 92.80 ? 307 GLN B NE2 1 ATOM 4348 N N . SER B 1 227 ? 90.243 -32.748 58.157 1.00 66.41 ? 309 SER B N 1 ATOM 4349 C CA . SER B 1 227 ? 89.651 -34.049 58.446 1.00 69.81 ? 309 SER B CA 1 ATOM 4350 C C . SER B 1 227 ? 88.132 -33.961 58.546 1.00 67.16 ? 309 SER B C 1 ATOM 4351 O O . SER B 1 227 ? 87.477 -34.870 59.059 1.00 68.38 ? 309 SER B O 1 ATOM 4352 C CB . SER B 1 227 ? 90.225 -34.606 59.737 1.00 76.36 ? 309 SER B CB 1 ATOM 4353 O OG . SER B 1 227 ? 90.099 -33.641 60.756 1.00 82.94 ? 309 SER B OG 1 ATOM 4354 N N . PHE B 1 228 ? 87.595 -32.845 58.063 1.00 69.82 ? 310 PHE B N 1 ATOM 4355 C CA . PHE B 1 228 ? 86.156 -32.599 57.964 1.00 58.22 ? 310 PHE B CA 1 ATOM 4356 C C . PHE B 1 228 ? 85.415 -32.486 59.289 1.00 60.15 ? 310 PHE B C 1 ATOM 4357 O O . PHE B 1 228 ? 84.193 -32.649 59.347 1.00 56.70 ? 310 PHE B O 1 ATOM 4358 C CB . PHE B 1 228 ? 85.472 -33.607 57.034 1.00 60.50 ? 310 PHE B CB 1 ATOM 4359 C CG . PHE B 1 228 ? 85.726 -33.347 55.576 1.00 65.56 ? 310 PHE B CG 1 ATOM 4360 C CD1 . PHE B 1 228 ? 86.361 -32.174 55.171 1.00 73.57 ? 310 PHE B CD1 1 ATOM 4361 C CD2 . PHE B 1 228 ? 85.332 -34.263 54.606 1.00 64.81 ? 310 PHE B CD2 1 ATOM 4362 C CE1 . PHE B 1 228 ? 86.610 -31.910 53.827 1.00 61.73 ? 310 PHE B CE1 1 ATOM 4363 C CE2 . PHE B 1 228 ? 85.578 -34.010 53.253 1.00 65.71 ? 310 PHE B CE2 1 ATOM 4364 C CZ . PHE B 1 228 ? 86.220 -32.830 52.865 1.00 63.17 ? 310 PHE B CZ 1 ATOM 4365 N N . THR B 1 229 ? 86.150 -32.199 60.355 1.00 61.85 ? 311 THR B N 1 ATOM 4366 C CA . THR B 1 229 ? 85.510 -31.718 61.562 1.00 58.12 ? 311 THR B CA 1 ATOM 4367 C C . THR B 1 229 ? 85.001 -30.278 61.310 1.00 61.74 ? 311 THR B C 1 ATOM 4368 O O . THR B 1 229 ? 85.777 -29.363 60.971 1.00 66.06 ? 311 THR B O 1 ATOM 4369 C CB . THR B 1 229 ? 86.477 -31.784 62.764 1.00 73.99 ? 311 THR B CB 1 ATOM 4370 O OG1 . THR B 1 229 ? 86.729 -33.160 63.101 1.00 76.37 ? 311 THR B OG1 1 ATOM 4371 C CG2 . THR B 1 229 ? 85.888 -31.029 63.975 1.00 44.31 ? 311 THR B CG2 1 ATOM 4372 N N . TYR B 1 230 ? 83.694 -30.081 61.452 1.00 57.95 ? 312 TYR B N 1 ATOM 4373 C CA . TYR B 1 230 ? 83.103 -28.787 61.102 1.00 59.98 ? 312 TYR B CA 1 ATOM 4374 C C . TYR B 1 230 ? 82.135 -28.256 62.148 1.00 51.67 ? 312 TYR B C 1 ATOM 4375 O O . TYR B 1 230 ? 81.533 -29.009 62.914 1.00 60.13 ? 312 TYR B O 1 ATOM 4376 C CB . TYR B 1 230 ? 82.369 -28.856 59.750 1.00 45.26 ? 312 TYR B CB 1 ATOM 4377 C CG . TYR B 1 230 ? 81.103 -29.669 59.810 1.00 53.54 ? 312 TYR B CG 1 ATOM 4378 C CD1 . TYR B 1 230 ? 79.885 -29.084 60.174 1.00 50.44 ? 312 TYR B CD1 1 ATOM 4379 C CD2 . TYR B 1 230 ? 81.117 -31.028 59.507 1.00 60.66 ? 312 TYR B CD2 1 ATOM 4380 C CE1 . TYR B 1 230 ? 78.705 -29.845 60.229 1.00 54.60 ? 312 TYR B CE1 1 ATOM 4381 C CE2 . TYR B 1 230 ? 79.945 -31.793 59.551 1.00 66.35 ? 312 TYR B CE2 1 ATOM 4382 C CZ . TYR B 1 230 ? 78.749 -31.199 59.909 1.00 60.31 ? 312 TYR B CZ 1 ATOM 4383 O OH . TYR B 1 230 ? 77.615 -31.970 59.941 1.00 59.13 ? 312 TYR B OH 1 ATOM 4384 N N . THR B 1 231 ? 81.948 -26.945 62.107 1.00 48.44 ? 313 THR B N 1 ATOM 4385 C CA . THR B 1 231 ? 81.056 -26.261 63.015 1.00 52.21 ? 313 THR B CA 1 ATOM 4386 C C . THR B 1 231 ? 80.315 -25.155 62.281 1.00 59.07 ? 313 THR B C 1 ATOM 4387 O O . THR B 1 231 ? 80.928 -24.220 61.756 1.00 65.10 ? 313 THR B O 1 ATOM 4388 C CB . THR B 1 231 ? 81.821 -25.579 64.201 1.00 67.69 ? 313 THR B CB 1 ATOM 4389 O OG1 . THR B 1 231 ? 82.800 -26.463 64.773 1.00 58.62 ? 313 THR B OG1 1 ATOM 4390 C CG2 . THR B 1 231 ? 80.832 -25.126 65.265 1.00 44.68 ? 313 THR B CG2 1 ATOM 4391 N N . PHE B 1 232 ? 78.994 -25.250 62.267 1.00 64.32 ? 314 PHE B N 1 ATOM 4392 C CA . PHE B 1 232 ? 78.169 -24.139 61.825 1.00 58.48 ? 314 PHE B CA 1 ATOM 4393 C C . PHE B 1 232 ? 78.004 -23.101 62.943 1.00 69.77 ? 314 PHE B C 1 ATOM 4394 O O . PHE B 1 232 ? 77.635 -23.439 64.072 1.00 64.34 ? 314 PHE B O 1 ATOM 4395 C CB . PHE B 1 232 ? 76.809 -24.654 61.369 1.00 51.62 ? 314 PHE B CB 1 ATOM 4396 C CG . PHE B 1 232 ? 76.776 -25.074 59.928 1.00 54.96 ? 314 PHE B CG 1 ATOM 4397 C CD1 . PHE B 1 232 ? 76.884 -24.116 58.924 1.00 47.15 ? 314 PHE B CD1 1 ATOM 4398 C CD2 . PHE B 1 232 ? 76.634 -26.415 59.569 1.00 44.49 ? 314 PHE B CD2 1 ATOM 4399 C CE1 . PHE B 1 232 ? 76.852 -24.478 57.586 1.00 57.33 ? 314 PHE B CE1 1 ATOM 4400 C CE2 . PHE B 1 232 ? 76.599 -26.787 58.221 1.00 56.73 ? 314 PHE B CE2 1 ATOM 4401 C CZ . PHE B 1 232 ? 76.713 -25.813 57.228 1.00 61.67 ? 314 PHE B CZ 1 ATOM 4402 N N . LYS B 1 233 ? 78.294 -21.841 62.630 1.00 68.37 ? 315 LYS B N 1 ATOM 4403 C CA . LYS B 1 233 ? 78.070 -20.746 63.572 1.00 64.18 ? 315 LYS B CA 1 ATOM 4404 C C . LYS B 1 233 ? 77.078 -19.707 63.020 1.00 60.33 ? 315 LYS B C 1 ATOM 4405 O O . LYS B 1 233 ? 76.991 -19.489 61.809 1.00 58.30 ? 315 LYS B O 1 ATOM 4406 C CB . LYS B 1 233 ? 79.403 -20.069 63.932 1.00 64.37 ? 315 LYS B CB 1 ATOM 4407 C CG . LYS B 1 233 ? 80.538 -21.047 64.244 1.00 67.34 ? 315 LYS B CG 1 ATOM 4408 C CD . LYS B 1 233 ? 81.771 -20.340 64.818 1.00 71.51 ? 315 LYS B CD 1 ATOM 4409 C CE . LYS B 1 233 ? 82.840 -21.351 65.258 1.00 76.55 ? 315 LYS B CE 1 ATOM 4410 N NZ . LYS B 1 233 ? 84.187 -20.728 65.494 1.00 80.25 ? 315 LYS B NZ 1 ATOM 4411 N N . GLU B 1 234 ? 76.320 -19.077 63.911 1.00 59.18 ? 316 GLU B N 1 ATOM 4412 C CA . GLU B 1 234 ? 75.475 -17.945 63.533 1.00 60.22 ? 316 GLU B CA 1 ATOM 4413 C C . GLU B 1 234 ? 76.117 -16.678 64.073 1.00 74.78 ? 316 GLU B C 1 ATOM 4414 O O . GLU B 1 234 ? 76.501 -16.623 65.245 1.00 83.72 ? 316 GLU B O 1 ATOM 4415 C CB . GLU B 1 234 ? 74.052 -18.095 64.086 1.00 68.01 ? 316 GLU B CB 1 ATOM 4416 C CG . GLU B 1 234 ? 73.073 -16.995 63.657 1.00 75.34 ? 316 GLU B CG 1 ATOM 4417 C CD . GLU B 1 234 ? 72.511 -17.195 62.243 1.00 80.82 ? 316 GLU B CD 1 ATOM 4418 O OE1 . GLU B 1 234 ? 72.671 -18.289 61.662 1.00 91.49 ? 316 GLU B OE1 1 ATOM 4419 O OE2 . GLU B 1 234 ? 71.900 -16.252 61.707 1.00 82.93 ? 316 GLU B OE2 1 ATOM 4420 N N . PRO B 1 235 ? 76.264 -15.664 63.212 1.00 68.31 ? 317 PRO B N 1 ATOM 4421 C CA . PRO B 1 235 ? 76.837 -14.376 63.623 1.00 74.83 ? 317 PRO B CA 1 ATOM 4422 C C . PRO B 1 235 ? 75.927 -13.692 64.632 1.00 77.51 ? 317 PRO B C 1 ATOM 4423 O O . PRO B 1 235 ? 74.703 -13.678 64.475 1.00 76.88 ? 317 PRO B O 1 ATOM 4424 C CB . PRO B 1 235 ? 76.881 -13.576 62.322 1.00 60.11 ? 317 PRO B CB 1 ATOM 4425 C CG . PRO B 1 235 ? 75.785 -14.194 61.476 1.00 62.17 ? 317 PRO B CG 1 ATOM 4426 C CD . PRO B 1 235 ? 75.807 -15.655 61.815 1.00 52.16 ? 317 PRO B CD 1 ATOM 4427 N N . CYS B 1 236 ? 76.528 -13.133 65.670 1.00 73.17 ? 318 CYS B N 1 ATOM 4428 C CA . CYS B 1 236 ? 75.757 -12.545 66.751 1.00 67.31 ? 318 CYS B CA 1 ATOM 4429 C C . CYS B 1 236 ? 75.525 -11.058 66.552 1.00 73.95 ? 318 CYS B C 1 ATOM 4430 O O . CYS B 1 236 ? 75.228 -10.343 67.492 1.00 51.05 ? 318 CYS B O 1 ATOM 4431 C CB . CYS B 1 236 ? 76.481 -12.781 68.063 1.00 60.58 ? 318 CYS B CB 1 ATOM 4432 S SG . CYS B 1 236 ? 76.658 -14.516 68.426 1.00 86.52 ? 318 CYS B SG 1 ATOM 4433 N N . LEU B 1 237 ? 75.660 -10.581 65.325 1.00 75.36 ? 319 LEU B N 1 ATOM 4434 C CA . LEU B 1 237 ? 75.543 -9.153 65.118 1.00 72.35 ? 319 LEU B CA 1 ATOM 4435 C C . LEU B 1 237 ? 74.233 -8.759 64.446 1.00 73.34 ? 319 LEU B C 1 ATOM 4436 O O . LEU B 1 237 ? 73.797 -9.389 63.482 1.00 81.07 ? 319 LEU B O 1 ATOM 4437 C CB . LEU B 1 237 ? 76.760 -8.624 64.353 1.00 78.44 ? 319 LEU B CB 1 ATOM 4438 C CG . LEU B 1 237 ? 78.090 -8.461 65.117 1.00 70.12 ? 319 LEU B CG 1 ATOM 4439 C CD1 . LEU B 1 237 ? 77.931 -8.638 66.610 1.00 68.70 ? 319 LEU B CD1 1 ATOM 4440 C CD2 . LEU B 1 237 ? 79.132 -9.414 64.589 1.00 64.30 ? 319 LEU B CD2 1 ATOM 4441 N N . GLY B 1 238 ? 73.604 -7.713 64.971 1.00 78.49 ? 320 GLY B N 1 ATOM 4442 C CA . GLY B 1 238 ? 72.369 -7.192 64.410 1.00 72.96 ? 320 GLY B CA 1 ATOM 4443 C C . GLY B 1 238 ? 72.530 -6.432 63.099 1.00 77.44 ? 320 GLY B C 1 ATOM 4444 O O . GLY B 1 238 ? 71.537 -5.931 62.555 1.00 77.95 ? 320 GLY B O 1 ATOM 4445 N N . PHE B 1 239 ? 73.770 -6.335 62.601 1.00 69.45 ? 321 PHE B N 1 ATOM 4446 C CA . PHE B 1 239 ? 74.061 -5.779 61.263 1.00 63.44 ? 321 PHE B CA 1 ATOM 4447 C C . PHE B 1 239 ? 73.844 -6.877 60.207 1.00 59.73 ? 321 PHE B C 1 ATOM 4448 O O . PHE B 1 239 ? 74.751 -7.668 59.897 1.00 52.93 ? 321 PHE B O 1 ATOM 4449 C CB . PHE B 1 239 ? 75.504 -5.284 61.236 1.00 59.30 ? 321 PHE B CB 1 ATOM 4450 C CG . PHE B 1 239 ? 75.859 -4.443 60.033 1.00 62.37 ? 321 PHE B CG 1 ATOM 4451 C CD1 . PHE B 1 239 ? 75.503 -3.097 59.984 1.00 50.84 ? 321 PHE B CD1 1 ATOM 4452 C CD2 . PHE B 1 239 ? 76.614 -4.975 58.979 1.00 48.92 ? 321 PHE B CD2 1 ATOM 4453 C CE1 . PHE B 1 239 ? 75.851 -2.300 58.883 1.00 50.78 ? 321 PHE B CE1 1 ATOM 4454 C CE2 . PHE B 1 239 ? 76.967 -4.185 57.885 1.00 50.44 ? 321 PHE B CE2 1 ATOM 4455 C CZ . PHE B 1 239 ? 76.583 -2.847 57.830 1.00 50.07 ? 321 PHE B CZ 1 ATOM 4456 N N . LEU B 1 240 ? 72.629 -6.934 59.671 1.00 67.19 ? 322 LEU B N 1 ATOM 4457 C CA . LEU B 1 240 ? 72.205 -8.048 58.809 1.00 59.25 ? 322 LEU B CA 1 ATOM 4458 C C . LEU B 1 240 ? 72.926 -8.119 57.456 1.00 59.07 ? 322 LEU B C 1 ATOM 4459 O O . LEU B 1 240 ? 72.936 -7.144 56.692 1.00 54.51 ? 322 LEU B O 1 ATOM 4460 C CB . LEU B 1 240 ? 70.707 -7.957 58.575 1.00 58.41 ? 322 LEU B CB 1 ATOM 4461 C CG . LEU B 1 240 ? 69.913 -7.705 59.852 1.00 65.56 ? 322 LEU B CG 1 ATOM 4462 C CD1 . LEU B 1 240 ? 68.433 -7.528 59.511 1.00 60.34 ? 322 LEU B CD1 1 ATOM 4463 C CD2 . LEU B 1 240 ? 70.138 -8.855 60.839 1.00 47.91 ? 322 LEU B CD2 1 ATOM 4464 N N . GLY B 1 241 ? 73.503 -9.282 57.160 1.00 57.65 ? 323 GLY B N 1 ATOM 4465 C CA . GLY B 1 241 ? 74.311 -9.461 55.966 1.00 57.95 ? 323 GLY B CA 1 ATOM 4466 C C . GLY B 1 241 ? 73.553 -9.677 54.663 1.00 61.28 ? 323 GLY B C 1 ATOM 4467 O O . GLY B 1 241 ? 74.006 -9.248 53.602 1.00 66.41 ? 323 GLY B O 1 ATOM 4468 N N . ASP B 1 242 ? 72.397 -10.330 54.728 1.00 65.07 ? 324 ASP B N 1 ATOM 4469 C CA . ASP B 1 242 ? 71.683 -10.706 53.505 1.00 66.75 ? 324 ASP B CA 1 ATOM 4470 C C . ASP B 1 242 ? 70.924 -9.545 52.841 1.00 64.32 ? 324 ASP B C 1 ATOM 4471 O O . ASP B 1 242 ? 70.744 -8.468 53.422 1.00 63.05 ? 324 ASP B O 1 ATOM 4472 C CB . ASP B 1 242 ? 70.708 -11.861 53.790 1.00 60.70 ? 324 ASP B CB 1 ATOM 4473 C CG . ASP B 1 242 ? 70.634 -12.848 52.658 1.00 65.79 ? 324 ASP B CG 1 ATOM 4474 O OD1 . ASP B 1 242 ? 70.792 -12.411 51.484 1.00 59.77 ? 324 ASP B OD1 1 ATOM 4475 O OD2 . ASP B 1 242 ? 70.431 -14.052 52.946 1.00 69.79 ? 324 ASP B OD2 1 ATOM 4476 N N . THR B 1 243 ? 70.501 -9.785 51.607 1.00 60.34 ? 325 THR B N 1 ATOM 4477 C CA . THR B 1 243 ? 69.546 -8.929 50.916 1.00 62.99 ? 325 THR B CA 1 ATOM 4478 C C . THR B 1 243 ? 68.606 -9.885 50.192 1.00 59.77 ? 325 THR B C 1 ATOM 4479 O O . THR B 1 243 ? 69.059 -10.736 49.427 1.00 61.82 ? 325 THR B O 1 ATOM 4480 C CB . THR B 1 243 ? 70.257 -7.975 49.918 1.00 63.20 ? 325 THR B CB 1 ATOM 4481 O OG1 . THR B 1 243 ? 71.071 -7.041 50.644 1.00 64.18 ? 325 THR B OG1 1 ATOM 4482 C CG2 . THR B 1 243 ? 69.246 -7.205 49.070 1.00 43.52 ? 325 THR B CG2 1 ATOM 4483 N N . PRO B 1 244 ? 67.298 -9.783 50.444 1.00 60.04 ? 326 PRO B N 1 ATOM 4484 C CA . PRO B 1 244 ? 66.628 -8.795 51.292 1.00 66.26 ? 326 PRO B CA 1 ATOM 4485 C C . PRO B 1 244 ? 66.840 -9.057 52.783 1.00 57.39 ? 326 PRO B C 1 ATOM 4486 O O . PRO B 1 244 ? 67.365 -10.111 53.181 1.00 61.90 ? 326 PRO B O 1 ATOM 4487 C CB . PRO B 1 244 ? 65.154 -9.031 50.964 1.00 56.73 ? 326 PRO B CB 1 ATOM 4488 C CG . PRO B 1 244 ? 65.081 -10.503 50.760 1.00 53.54 ? 326 PRO B CG 1 ATOM 4489 C CD . PRO B 1 244 ? 66.369 -10.857 50.031 1.00 50.82 ? 326 PRO B CD 1 ATOM 4490 N N . ARG B 1 245 ? 66.398 -8.087 53.582 1.00 48.96 ? 327 ARG B N 1 ATOM 4491 C CA . ARG B 1 245 ? 66.490 -8.111 55.045 1.00 55.95 ? 327 ARG B CA 1 ATOM 4492 C C . ARG B 1 245 ? 65.564 -7.039 55.606 1.00 57.18 ? 327 ARG B C 1 ATOM 4493 O O . ARG B 1 245 ? 65.076 -6.179 54.871 1.00 57.43 ? 327 ARG B O 1 ATOM 4494 C CB . ARG B 1 245 ? 67.917 -7.779 55.496 1.00 63.68 ? 327 ARG B CB 1 ATOM 4495 C CG . ARG B 1 245 ? 68.380 -6.369 55.061 1.00 50.47 ? 327 ARG B CG 1 ATOM 4496 C CD . ARG B 1 245 ? 69.805 -6.099 55.500 1.00 58.85 ? 327 ARG B CD 1 ATOM 4497 N NE . ARG B 1 245 ? 70.212 -4.726 55.208 1.00 70.71 ? 327 ARG B NE 1 ATOM 4498 C CZ . ARG B 1 245 ? 71.023 -4.377 54.213 1.00 57.38 ? 327 ARG B CZ 1 ATOM 4499 N NH1 . ARG B 1 245 ? 71.535 -5.305 53.418 1.00 48.59 ? 327 ARG B NH1 1 ATOM 4500 N NH2 . ARG B 1 245 ? 71.333 -3.103 54.024 1.00 55.38 ? 327 ARG B NH2 1 ATOM 4501 N N . GLY B 1 246 ? 65.350 -7.075 56.916 1.00 55.46 ? 328 GLY B N 1 ATOM 4502 C CA . GLY B 1 246 ? 64.598 -6.033 57.587 1.00 60.93 ? 328 GLY B CA 1 ATOM 4503 C C . GLY B 1 246 ? 65.474 -5.007 58.289 1.00 65.18 ? 328 GLY B C 1 ATOM 4504 O O . GLY B 1 246 ? 66.676 -4.908 58.029 1.00 67.75 ? 328 GLY B O 1 ATOM 4505 N N . ILE B 1 247 ? 64.852 -4.233 59.175 1.00 68.22 ? 329 ILE B N 1 ATOM 4506 C CA . ILE B 1 247 ? 65.543 -3.253 59.998 1.00 61.62 ? 329 ILE B CA 1 ATOM 4507 C C . ILE B 1 247 ? 66.628 -3.955 60.793 1.00 70.44 ? 329 ILE B C 1 ATOM 4508 O O . ILE B 1 247 ? 66.396 -5.051 61.320 1.00 77.07 ? 329 ILE B O 1 ATOM 4509 C CB . ILE B 1 247 ? 64.556 -2.617 60.985 1.00 64.53 ? 329 ILE B CB 1 ATOM 4510 C CG1 . ILE B 1 247 ? 63.365 -2.038 60.219 1.00 62.91 ? 329 ILE B CG1 1 ATOM 4511 C CG2 . ILE B 1 247 ? 65.238 -1.537 61.830 1.00 57.30 ? 329 ILE B CG2 1 ATOM 4512 C CD1 . ILE B 1 247 ? 62.397 -1.300 61.094 1.00 62.62 ? 329 ILE B CD1 1 ATOM 4513 N N . ASP B 1 248 ? 67.812 -3.347 60.868 1.00 67.85 ? 330 ASP B N 1 ATOM 4514 C CA . ASP B 1 248 ? 68.880 -3.915 61.686 1.00 71.25 ? 330 ASP B CA 1 ATOM 4515 C C . ASP B 1 248 ? 68.387 -4.069 63.116 1.00 70.05 ? 330 ASP B C 1 ATOM 4516 O O . ASP B 1 248 ? 67.555 -3.296 63.584 1.00 69.04 ? 330 ASP B O 1 ATOM 4517 C CB . ASP B 1 248 ? 70.128 -3.046 61.668 1.00 71.15 ? 330 ASP B CB 1 ATOM 4518 C CG . ASP B 1 248 ? 70.966 -3.259 60.439 1.00 83.18 ? 330 ASP B CG 1 ATOM 4519 O OD1 . ASP B 1 248 ? 70.633 -4.151 59.618 1.00 95.73 ? 330 ASP B OD1 1 ATOM 4520 O OD2 . ASP B 1 248 ? 71.970 -2.527 60.305 1.00 72.70 ? 330 ASP B OD2 1 ATOM 4521 N N . THR B 1 249 ? 68.881 -5.078 63.811 1.00 68.25 ? 333 THR B N 1 ATOM 4522 C CA . THR B 1 249 ? 68.392 -5.314 65.152 1.00 78.28 ? 333 THR B CA 1 ATOM 4523 C C . THR B 1 249 ? 69.497 -5.213 66.172 1.00 78.66 ? 333 THR B C 1 ATOM 4524 O O . THR B 1 249 ? 70.585 -4.709 65.894 1.00 78.97 ? 333 THR B O 1 ATOM 4525 C CB . THR B 1 249 ? 67.727 -6.691 65.286 1.00 84.18 ? 333 THR B CB 1 ATOM 4526 O OG1 . THR B 1 249 ? 67.512 -6.980 66.676 1.00 102.82 ? 333 THR B OG1 1 ATOM 4527 C CG2 . THR B 1 249 ? 68.603 -7.768 64.673 1.00 63.55 ? 333 THR B CG2 1 ATOM 4528 N N . THR B 1 250 ? 69.196 -5.695 67.368 1.00 85.02 ? 334 THR B N 1 ATOM 4529 C CA . THR B 1 250 ? 70.194 -5.815 68.417 1.00 90.07 ? 334 THR B CA 1 ATOM 4530 C C . THR B 1 250 ? 71.032 -7.070 68.170 1.00 84.63 ? 334 THR B C 1 ATOM 4531 O O . THR B 1 250 ? 70.637 -7.959 67.399 1.00 86.55 ? 334 THR B O 1 ATOM 4532 C CB . THR B 1 250 ? 69.529 -5.900 69.806 1.00 88.82 ? 334 THR B CB 1 ATOM 4533 O OG1 . THR B 1 250 ? 69.727 -7.211 70.354 1.00 99.51 ? 334 THR B OG1 1 ATOM 4534 C CG2 . THR B 1 250 ? 68.024 -5.639 69.683 1.00 76.85 ? 334 THR B CG2 1 ATOM 4535 N N . ASN B 1 251 ? 72.196 -7.121 68.806 1.00 78.36 ? 335 ASN B N 1 ATOM 4536 C CA . ASN B 1 251 ? 73.006 -8.318 68.777 1.00 66.91 ? 335 ASN B CA 1 ATOM 4537 C C . ASN B 1 251 ? 72.320 -9.469 69.492 1.00 68.78 ? 335 ASN B C 1 ATOM 4538 O O . ASN B 1 251 ? 72.046 -9.389 70.684 1.00 73.57 ? 335 ASN B O 1 ATOM 4539 C CB . ASN B 1 251 ? 74.370 -8.060 69.419 1.00 56.54 ? 335 ASN B CB 1 ATOM 4540 C CG . ASN B 1 251 ? 75.213 -7.103 68.605 1.00 66.03 ? 335 ASN B CG 1 ATOM 4541 O OD1 . ASN B 1 251 ? 74.739 -6.521 67.620 1.00 78.96 ? 335 ASN B OD1 1 ATOM 4542 N ND2 . ASN B 1 251 ? 76.464 -6.918 69.016 1.00 68.53 ? 335 ASN B ND2 1 ATOM 4543 N N . TYR B 1 252 ? 72.022 -10.531 68.756 1.00 69.73 ? 336 TYR B N 1 ATOM 4544 C CA . TYR B 1 252 ? 71.630 -11.789 69.381 1.00 71.78 ? 336 TYR B CA 1 ATOM 4545 C C . TYR B 1 252 ? 72.132 -12.977 68.575 1.00 78.88 ? 336 TYR B C 1 ATOM 4546 O O . TYR B 1 252 ? 72.474 -12.847 67.394 1.00 80.73 ? 336 TYR B O 1 ATOM 4547 C CB . TYR B 1 252 ? 70.127 -11.879 69.618 1.00 63.60 ? 336 TYR B CB 1 ATOM 4548 C CG . TYR B 1 252 ? 69.259 -11.609 68.409 1.00 69.29 ? 336 TYR B CG 1 ATOM 4549 C CD1 . TYR B 1 252 ? 69.028 -12.600 67.451 1.00 65.99 ? 336 TYR B CD1 1 ATOM 4550 C CD2 . TYR B 1 252 ? 68.641 -10.373 68.240 1.00 59.59 ? 336 TYR B CD2 1 ATOM 4551 C CE1 . TYR B 1 252 ? 68.218 -12.357 66.350 1.00 57.70 ? 336 TYR B CE1 1 ATOM 4552 C CE2 . TYR B 1 252 ? 67.832 -10.124 67.154 1.00 68.37 ? 336 TYR B CE2 1 ATOM 4553 C CZ . TYR B 1 252 ? 67.626 -11.116 66.209 1.00 72.82 ? 336 TYR B CZ 1 ATOM 4554 O OH . TYR B 1 252 ? 66.823 -10.859 65.126 1.00 82.73 ? 336 TYR B OH 1 ATOM 4555 N N . CYS B 1 253 ? 72.167 -14.136 69.217 1.00 80.94 ? 337 CYS B N 1 ATOM 4556 C CA . CYS B 1 253 ? 72.967 -15.233 68.703 1.00 80.49 ? 337 CYS B CA 1 ATOM 4557 C C . CYS B 1 253 ? 72.190 -16.307 67.962 1.00 83.58 ? 337 CYS B C 1 ATOM 4558 O O . CYS B 1 253 ? 72.579 -17.474 67.975 1.00 100.45 ? 337 CYS B O 1 ATOM 4559 C CB . CYS B 1 253 ? 73.786 -15.872 69.832 1.00 81.07 ? 337 CYS B CB 1 ATOM 4560 S SG . CYS B 1 253 ? 75.570 -15.802 69.575 1.00 146.38 ? 337 CYS B SG 1 ATOM 4561 N N . ASP B 1 254 ? 71.100 -15.923 67.312 1.00 70.43 ? 339 ASP B N 1 ATOM 4562 C CA . ASP B 1 254 ? 70.404 -16.863 66.449 1.00 76.19 ? 339 ASP B CA 1 ATOM 4563 C C . ASP B 1 254 ? 69.743 -16.195 65.244 1.00 74.33 ? 339 ASP B C 1 ATOM 4564 O O . ASP B 1 254 ? 69.970 -15.012 64.973 1.00 70.86 ? 339 ASP B O 1 ATOM 4565 C CB . ASP B 1 254 ? 69.434 -17.747 67.242 1.00 94.42 ? 339 ASP B CB 1 ATOM 4566 C CG . ASP B 1 254 ? 68.568 -16.960 68.193 1.00 107.30 ? 339 ASP B CG 1 ATOM 4567 O OD1 . ASP B 1 254 ? 68.767 -15.732 68.301 1.00 114.74 ? 339 ASP B OD1 1 ATOM 4568 O OD2 . ASP B 1 254 ? 67.694 -17.583 68.836 1.00 106.84 ? 339 ASP B OD2 1 ATOM 4569 N N . LYS B 1 255 ? 68.958 -16.958 64.491 1.00 68.96 ? 340 LYS B N 1 ATOM 4570 C CA . LYS B 1 255 ? 68.493 -16.457 63.208 1.00 63.49 ? 340 LYS B CA 1 ATOM 4571 C C . LYS B 1 255 ? 67.544 -15.280 63.352 1.00 71.48 ? 340 LYS B C 1 ATOM 4572 O O . LYS B 1 255 ? 66.741 -15.203 64.297 1.00 72.98 ? 340 LYS B O 1 ATOM 4573 C CB . LYS B 1 255 ? 67.813 -17.546 62.377 1.00 66.23 ? 340 LYS B CB 1 ATOM 4574 C CG . LYS B 1 255 ? 68.676 -18.710 61.929 1.00 66.33 ? 340 LYS B CG 1 ATOM 4575 C CD . LYS B 1 255 ? 67.742 -19.864 61.570 1.00 68.81 ? 340 LYS B CD 1 ATOM 4576 C CE . LYS B 1 255 ? 68.483 -21.170 61.385 1.00 86.40 ? 340 LYS B CE 1 ATOM 4577 N NZ . LYS B 1 255 ? 68.614 -21.991 62.622 1.00 79.83 ? 340 LYS B NZ 1 ATOM 4578 N N . THR B 1 256 ? 67.667 -14.362 62.400 1.00 68.56 ? 341 THR B N 1 ATOM 4579 C CA . THR B 1 256 ? 66.693 -13.304 62.202 1.00 75.25 ? 341 THR B CA 1 ATOM 4580 C C . THR B 1 256 ? 65.775 -13.740 61.071 1.00 77.48 ? 341 THR B C 1 ATOM 4581 O O . THR B 1 256 ? 66.101 -13.581 59.887 1.00 77.82 ? 341 THR B O 1 ATOM 4582 C CB . THR B 1 256 ? 67.380 -11.987 61.834 1.00 77.11 ? 341 THR B CB 1 ATOM 4583 O OG1 . THR B 1 256 ? 68.280 -11.606 62.886 1.00 75.94 ? 341 THR B OG1 1 ATOM 4584 C CG2 . THR B 1 256 ? 66.341 -10.886 61.612 1.00 67.75 ? 341 THR B CG2 1 ATOM 4585 N N . THR B 1 257 ? 64.624 -14.287 61.451 1.00 75.48 ? 342 THR B N 1 ATOM 4586 C CA . THR B 1 257 ? 63.732 -14.981 60.520 1.00 86.39 ? 342 THR B CA 1 ATOM 4587 C C . THR B 1 257 ? 62.921 -14.061 59.593 1.00 90.18 ? 342 THR B C 1 ATOM 4588 O O . THR B 1 257 ? 62.765 -14.347 58.391 1.00 80.34 ? 342 THR B O 1 ATOM 4589 C CB . THR B 1 257 ? 62.770 -15.886 61.295 1.00 80.11 ? 342 THR B CB 1 ATOM 4590 O OG1 . THR B 1 257 ? 61.884 -15.071 62.078 1.00 80.58 ? 342 THR B OG1 1 ATOM 4591 C CG2 . THR B 1 257 ? 63.566 -16.830 62.206 1.00 67.76 ? 342 THR B CG2 1 ATOM 4592 N N . THR B 1 258 ? 62.386 -12.981 60.168 1.00 85.20 ? 343 THR B N 1 ATOM 4593 C CA . THR B 1 258 ? 61.678 -11.947 59.408 1.00 78.15 ? 343 THR B CA 1 ATOM 4594 C C . THR B 1 258 ? 62.516 -11.482 58.200 1.00 75.03 ? 343 THR B C 1 ATOM 4595 O O . THR B 1 258 ? 63.732 -11.263 58.326 1.00 78.62 ? 343 THR B O 1 ATOM 4596 C CB . THR B 1 258 ? 61.246 -10.760 60.334 1.00 82.75 ? 343 THR B CB 1 ATOM 4597 O OG1 . THR B 1 258 ? 61.684 -9.510 59.785 1.00 90.01 ? 343 THR B OG1 1 ATOM 4598 C CG2 . THR B 1 258 ? 61.827 -10.926 61.744 1.00 78.47 ? 343 THR B CG2 1 ATOM 4599 N N . GLU B 1 259 ? 61.867 -11.377 57.037 1.00 63.28 ? 344 GLU B N 1 ATOM 4600 C CA . GLU B 1 259 ? 62.549 -11.106 55.757 1.00 63.15 ? 344 GLU B CA 1 ATOM 4601 C C . GLU B 1 259 ? 63.693 -12.102 55.407 1.00 64.27 ? 344 GLU B C 1 ATOM 4602 O O . GLU B 1 259 ? 64.573 -11.820 54.575 1.00 66.88 ? 344 GLU B O 1 ATOM 4603 C CB . GLU B 1 259 ? 63.007 -9.639 55.665 1.00 70.03 ? 344 GLU B CB 1 ATOM 4604 C CG . GLU B 1 259 ? 61.872 -8.634 55.404 1.00 82.21 ? 344 GLU B CG 1 ATOM 4605 C CD . GLU B 1 259 ? 61.172 -8.153 56.680 1.00 114.27 ? 344 GLU B CD 1 ATOM 4606 O OE1 . GLU B 1 259 ? 61.700 -8.390 57.789 1.00 114.98 ? 344 GLU B OE1 1 ATOM 4607 O OE2 . GLU B 1 259 ? 60.091 -7.529 56.574 1.00 125.56 ? 344 GLU B OE2 1 ATOM 4608 N N . GLY B 1 260 ? 63.646 -13.281 56.023 1.00 56.26 ? 345 GLY B N 1 ATOM 4609 C CA . GLY B 1 260 ? 64.666 -14.290 55.823 1.00 54.11 ? 345 GLY B CA 1 ATOM 4610 C C . GLY B 1 260 ? 64.446 -15.171 54.604 1.00 66.53 ? 345 GLY B C 1 ATOM 4611 O O . GLY B 1 260 ? 65.272 -16.035 54.307 1.00 82.66 ? 345 GLY B O 1 ATOM 4612 N N . GLU B 1 261 ? 63.328 -14.981 53.907 1.00 69.78 ? 346 GLU B N 1 ATOM 4613 C CA . GLU B 1 261 ? 63.102 -15.701 52.660 1.00 73.79 ? 346 GLU B CA 1 ATOM 4614 C C . GLU B 1 261 ? 63.734 -14.887 51.547 1.00 60.98 ? 346 GLU B C 1 ATOM 4615 O O . GLU B 1 261 ? 63.727 -13.657 51.591 1.00 65.42 ? 346 GLU B O 1 ATOM 4616 C CB . GLU B 1 261 ? 61.613 -15.922 52.398 1.00 85.52 ? 346 GLU B CB 1 ATOM 4617 C CG . GLU B 1 261 ? 61.331 -17.007 51.367 1.00 93.83 ? 346 GLU B CG 1 ATOM 4618 C CD . GLU B 1 261 ? 59.855 -17.176 51.076 1.00 113.15 ? 346 GLU B CD 1 ATOM 4619 O OE1 . GLU B 1 261 ? 59.094 -17.497 52.020 1.00 117.10 ? 346 GLU B OE1 1 ATOM 4620 O OE2 . GLU B 1 261 ? 59.460 -16.984 49.902 1.00 115.49 ? 346 GLU B OE2 1 ATOM 4621 N N . GLY B 1 262 ? 64.296 -15.567 50.557 1.00 56.72 ? 347 GLY B N 1 ATOM 4622 C CA . GLY B 1 262 ? 65.051 -14.888 49.522 1.00 60.97 ? 347 GLY B CA 1 ATOM 4623 C C . GLY B 1 262 ? 66.501 -14.757 49.942 1.00 67.15 ? 347 GLY B C 1 ATOM 4624 O O . GLY B 1 262 ? 66.935 -15.438 50.844 1.00 81.78 ? 347 GLY B O 1 ATOM 4625 N N . GLY B 1 263 ? 67.261 -13.888 49.297 1.00 69.66 ? 348 GLY B N 1 ATOM 4626 C CA . GLY B 1 263 ? 68.648 -13.737 49.674 1.00 57.04 ? 348 GLY B CA 1 ATOM 4627 C C . GLY B 1 263 ? 69.557 -13.682 48.466 1.00 61.66 ? 348 GLY B C 1 ATOM 4628 O O . GLY B 1 263 ? 69.135 -13.948 47.338 1.00 69.51 ? 348 GLY B O 1 ATOM 4629 N N . ILE B 1 264 ? 70.815 -13.338 48.703 1.00 60.86 ? 349 ILE B N 1 ATOM 4630 C CA . ILE B 1 264 ? 71.782 -13.191 47.624 1.00 51.06 ? 349 ILE B CA 1 ATOM 4631 C C . ILE B 1 264 ? 73.181 -13.527 48.147 1.00 57.46 ? 349 ILE B C 1 ATOM 4632 O O . ILE B 1 264 ? 73.468 -13.354 49.333 1.00 71.31 ? 349 ILE B O 1 ATOM 4633 C CB . ILE B 1 264 ? 71.735 -11.769 47.014 1.00 47.01 ? 349 ILE B CB 1 ATOM 4634 C CG1 . ILE B 1 264 ? 72.535 -11.710 45.711 1.00 43.94 ? 349 ILE B CG1 1 ATOM 4635 C CG2 . ILE B 1 264 ? 72.229 -10.713 48.026 1.00 40.54 ? 349 ILE B CG2 1 ATOM 4636 C CD1 . ILE B 1 264 ? 72.131 -10.582 44.792 1.00 48.56 ? 349 ILE B CD1 1 ATOM 4637 N N . GLN B 1 265 ? 74.035 -14.034 47.267 1.00 56.49 ? 350 GLN B N 1 ATOM 4638 C CA . GLN B 1 265 ? 75.372 -14.442 47.651 1.00 57.82 ? 350 GLN B CA 1 ATOM 4639 C C . GLN B 1 265 ? 76.181 -13.254 48.165 1.00 60.63 ? 350 GLN B C 1 ATOM 4640 O O . GLN B 1 265 ? 76.189 -12.173 47.557 1.00 62.91 ? 350 GLN B O 1 ATOM 4641 C CB . GLN B 1 265 ? 76.077 -15.077 46.464 1.00 40.72 ? 350 GLN B CB 1 ATOM 4642 C CG . GLN B 1 265 ? 77.465 -15.600 46.764 1.00 41.63 ? 350 GLN B CG 1 ATOM 4643 C CD . GLN B 1 265 ? 78.070 -16.297 45.560 1.00 54.79 ? 350 GLN B CD 1 ATOM 4644 O OE1 . GLN B 1 265 ? 77.793 -15.922 44.411 1.00 61.78 ? 350 GLN B OE1 1 ATOM 4645 N NE2 . GLN B 1 265 ? 78.881 -17.330 45.812 1.00 38.78 ? 350 GLN B NE2 1 ATOM 4646 N N . GLY B 1 266 ? 76.857 -13.475 49.292 1.00 56.84 ? 351 GLY B N 1 ATOM 4647 C CA . GLY B 1 266 ? 77.682 -12.467 49.936 1.00 56.64 ? 351 GLY B CA 1 ATOM 4648 C C . GLY B 1 266 ? 78.547 -13.087 51.015 1.00 54.27 ? 351 GLY B C 1 ATOM 4649 O O . GLY B 1 266 ? 78.460 -14.295 51.265 1.00 58.73 ? 351 GLY B O 1 ATOM 4650 N N . PHE B 1 267 ? 79.364 -12.264 51.673 1.00 58.16 ? 352 PHE B N 1 ATOM 4651 C CA . PHE B 1 267 ? 80.404 -12.783 52.568 1.00 63.63 ? 352 PHE B CA 1 ATOM 4652 C C . PHE B 1 267 ? 80.475 -12.088 53.932 1.00 63.66 ? 352 PHE B C 1 ATOM 4653 O O . PHE B 1 267 ? 79.940 -10.992 54.116 1.00 62.73 ? 352 PHE B O 1 ATOM 4654 C CB . PHE B 1 267 ? 81.784 -12.673 51.883 1.00 62.00 ? 352 PHE B CB 1 ATOM 4655 C CG . PHE B 1 267 ? 82.150 -11.272 51.494 1.00 57.82 ? 352 PHE B CG 1 ATOM 4656 C CD1 . PHE B 1 267 ? 81.756 -10.760 50.264 1.00 57.06 ? 352 PHE B CD1 1 ATOM 4657 C CD2 . PHE B 1 267 ? 82.859 -10.450 52.370 1.00 56.67 ? 352 PHE B CD2 1 ATOM 4658 C CE1 . PHE B 1 267 ? 82.074 -9.450 49.900 1.00 65.19 ? 352 PHE B CE1 1 ATOM 4659 C CE2 . PHE B 1 267 ? 83.183 -9.136 52.009 1.00 58.82 ? 352 PHE B CE2 1 ATOM 4660 C CZ . PHE B 1 267 ? 82.790 -8.636 50.772 1.00 61.83 ? 352 PHE B CZ 1 ATOM 4661 N N . MET B 1 268 ? 81.140 -12.763 54.871 1.00 61.10 ? 353 MET B N 1 ATOM 4662 C CA . MET B 1 268 ? 81.658 -12.171 56.102 1.00 58.30 ? 353 MET B CA 1 ATOM 4663 C C . MET B 1 268 ? 83.116 -12.631 56.248 1.00 63.26 ? 353 MET B C 1 ATOM 4664 O O . MET B 1 268 ? 83.523 -13.609 55.624 1.00 64.85 ? 353 MET B O 1 ATOM 4665 C CB . MET B 1 268 ? 80.825 -12.612 57.314 1.00 43.71 ? 353 MET B CB 1 ATOM 4666 C CG . MET B 1 268 ? 79.364 -12.205 57.214 1.00 55.15 ? 353 MET B CG 1 ATOM 4667 S SD . MET B 1 268 ? 78.317 -12.711 58.592 1.00 66.77 ? 353 MET B SD 1 ATOM 4668 C CE . MET B 1 268 ? 78.566 -14.484 58.637 1.00 46.57 ? 353 MET B CE 1 ATOM 4669 N N . ILE B 1 269 ? 83.905 -11.921 57.048 1.00 60.96 ? 354 ILE B N 1 ATOM 4670 C CA . ILE B 1 269 ? 85.276 -12.332 57.334 1.00 55.76 ? 354 ILE B CA 1 ATOM 4671 C C . ILE B 1 269 ? 85.472 -12.407 58.840 1.00 71.69 ? 354 ILE B C 1 ATOM 4672 O O . ILE B 1 269 ? 85.176 -11.449 59.549 1.00 73.27 ? 354 ILE B O 1 ATOM 4673 C CB . ILE B 1 269 ? 86.294 -11.323 56.790 1.00 59.42 ? 354 ILE B CB 1 ATOM 4674 C CG1 . ILE B 1 269 ? 86.111 -11.129 55.284 1.00 53.40 ? 354 ILE B CG1 1 ATOM 4675 C CG2 . ILE B 1 269 ? 87.712 -11.775 57.122 1.00 56.46 ? 354 ILE B CG2 1 ATOM 4676 C CD1 . ILE B 1 269 ? 87.097 -10.143 54.685 1.00 51.43 ? 354 ILE B CD1 1 ATOM 4677 N N . GLU B 1 270 ? 85.968 -13.540 59.325 1.00 74.46 ? 355 GLU B N 1 ATOM 4678 C CA . GLU B 1 270 ? 86.148 -13.762 60.757 1.00 68.15 ? 355 GLU B CA 1 ATOM 4679 C C . GLU B 1 270 ? 87.605 -13.606 61.122 1.00 75.92 ? 355 GLU B C 1 ATOM 4680 O O . GLU B 1 270 ? 88.425 -14.421 60.717 1.00 75.99 ? 355 GLU B O 1 ATOM 4681 C CB . GLU B 1 270 ? 85.745 -15.182 61.098 1.00 77.55 ? 355 GLU B CB 1 ATOM 4682 C CG . GLU B 1 270 ? 84.615 -15.286 62.069 1.00 88.26 ? 355 GLU B CG 1 ATOM 4683 C CD . GLU B 1 270 ? 85.020 -14.953 63.486 1.00 88.19 ? 355 GLU B CD 1 ATOM 4684 O OE1 . GLU B 1 270 ? 86.004 -15.559 63.962 1.00 84.50 ? 355 GLU B OE1 1 ATOM 4685 O OE2 . GLU B 1 270 ? 84.371 -14.084 64.112 1.00 90.48 ? 355 GLU B OE2 1 ATOM 4686 N N . GLY B 1 271 ? 87.944 -12.587 61.903 1.00 89.37 ? 356 GLY B N 1 ATOM 4687 C CA . GLY B 1 271 ? 89.337 -12.402 62.270 1.00 87.10 ? 356 GLY B CA 1 ATOM 4688 C C . GLY B 1 271 ? 89.566 -11.630 63.544 1.00 87.42 ? 356 GLY B C 1 ATOM 4689 O O . GLY B 1 271 ? 88.651 -11.485 64.358 1.00 76.35 ? 356 GLY B O 1 ATOM 4690 N N . SER B 1 272 ? 90.802 -11.155 63.719 1.00 107.15 ? 357 SER B N 1 ATOM 4691 C CA . SER B 1 272 ? 91.137 -10.227 64.796 1.00 110.79 ? 357 SER B CA 1 ATOM 4692 C C . SER B 1 272 ? 90.194 -9.052 64.592 1.00 103.16 ? 357 SER B C 1 ATOM 4693 O O . SER B 1 272 ? 89.498 -8.599 65.520 1.00 83.31 ? 357 SER B O 1 ATOM 4694 C CB . SER B 1 272 ? 92.588 -9.752 64.652 1.00 107.28 ? 357 SER B CB 1 ATOM 4695 O OG . SER B 1 272 ? 93.432 -10.775 64.165 1.00 102.18 ? 357 SER B OG 1 ATOM 4696 N N . ASN B 1 273 ? 90.201 -8.583 63.342 1.00 95.63 ? 359 ASN B N 1 ATOM 4697 C CA . ASN B 1 273 ? 89.183 -7.715 62.777 1.00 81.24 ? 359 ASN B CA 1 ATOM 4698 C C . ASN B 1 273 ? 88.232 -8.563 61.942 1.00 84.44 ? 359 ASN B C 1 ATOM 4699 O O . ASN B 1 273 ? 88.656 -9.203 60.977 1.00 94.26 ? 359 ASN B O 1 ATOM 4700 C CB . ASN B 1 273 ? 89.818 -6.642 61.873 1.00 82.67 ? 359 ASN B CB 1 ATOM 4701 C CG . ASN B 1 273 ? 90.512 -5.541 62.663 1.00 91.30 ? 359 ASN B CG 1 ATOM 4702 O OD1 . ASN B 1 273 ? 90.121 -5.232 63.802 1.00 80.61 ? 359 ASN B OD1 1 ATOM 4703 N ND2 . ASN B 1 273 ? 91.545 -4.939 62.064 1.00 81.98 ? 359 ASN B ND2 1 ATOM 4704 N N . SER B 1 274 ? 86.955 -8.576 62.310 1.00 74.29 ? 360 SER B N 1 ATOM 4705 C CA . SER B 1 274 ? 85.934 -9.156 61.446 1.00 64.11 ? 360 SER B CA 1 ATOM 4706 C C . SER B 1 274 ? 85.306 -8.113 60.517 1.00 66.18 ? 360 SER B C 1 ATOM 4707 O O . SER B 1 274 ? 85.432 -6.911 60.748 1.00 76.83 ? 360 SER B O 1 ATOM 4708 C CB . SER B 1 274 ? 84.854 -9.846 62.264 1.00 59.76 ? 360 SER B CB 1 ATOM 4709 O OG . SER B 1 274 ? 85.312 -11.102 62.721 1.00 61.67 ? 360 SER B OG 1 ATOM 4710 N N . TRP B 1 275 ? 84.646 -8.577 59.456 1.00 65.39 ? 361 TRP B N 1 ATOM 4711 C CA . TRP B 1 275 ? 83.941 -7.685 58.535 1.00 62.51 ? 361 TRP B CA 1 ATOM 4712 C C . TRP B 1 275 ? 82.630 -8.301 58.048 1.00 63.94 ? 361 TRP B C 1 ATOM 4713 O O . TRP B 1 275 ? 82.489 -9.523 57.984 1.00 65.66 ? 361 TRP B O 1 ATOM 4714 C CB . TRP B 1 275 ? 84.794 -7.383 57.302 1.00 62.18 ? 361 TRP B CB 1 ATOM 4715 C CG . TRP B 1 275 ? 86.196 -6.899 57.553 1.00 63.83 ? 361 TRP B CG 1 ATOM 4716 C CD1 . TRP B 1 275 ? 87.302 -7.668 57.816 1.00 62.14 ? 361 TRP B CD1 1 ATOM 4717 C CD2 . TRP B 1 275 ? 86.658 -5.539 57.500 1.00 59.87 ? 361 TRP B CD2 1 ATOM 4718 N NE1 . TRP B 1 275 ? 88.416 -6.865 57.955 1.00 55.66 ? 361 TRP B NE1 1 ATOM 4719 C CE2 . TRP B 1 275 ? 88.052 -5.558 57.755 1.00 57.36 ? 361 TRP B CE2 1 ATOM 4720 C CE3 . TRP B 1 275 ? 86.030 -4.308 57.267 1.00 49.32 ? 361 TRP B CE3 1 ATOM 4721 C CZ2 . TRP B 1 275 ? 88.828 -4.388 57.781 1.00 65.56 ? 361 TRP B CZ2 1 ATOM 4722 C CZ3 . TRP B 1 275 ? 86.799 -3.148 57.296 1.00 71.03 ? 361 TRP B CZ3 1 ATOM 4723 C CH2 . TRP B 1 275 ? 88.185 -3.197 57.553 1.00 69.58 ? 361 TRP B CH2 1 ATOM 4724 N N . ILE B 1 276 ? 81.677 -7.444 57.701 1.00 61.16 ? 362 ILE B N 1 ATOM 4725 C CA . ILE B 1 276 ? 80.457 -7.865 57.020 1.00 60.75 ? 362 ILE B CA 1 ATOM 4726 C C . ILE B 1 276 ? 80.202 -6.888 55.877 1.00 57.16 ? 362 ILE B C 1 ATOM 4727 O O . ILE B 1 276 ? 79.960 -5.706 56.121 1.00 63.36 ? 362 ILE B O 1 ATOM 4728 C CB . ILE B 1 276 ? 79.238 -7.839 57.963 1.00 66.28 ? 362 ILE B CB 1 ATOM 4729 C CG1 . ILE B 1 276 ? 79.511 -8.676 59.219 1.00 62.04 ? 362 ILE B CG1 1 ATOM 4730 C CG2 . ILE B 1 276 ? 77.991 -8.323 57.237 1.00 55.56 ? 362 ILE B CG2 1 ATOM 4731 C CD1 . ILE B 1 276 ? 78.268 -9.014 60.013 1.00 54.66 ? 362 ILE B CD1 1 ATOM 4732 N N . GLY B 1 277 ? 80.291 -7.370 54.637 1.00 60.81 ? 363 GLY B N 1 ATOM 4733 C CA . GLY B 1 277 ? 79.974 -6.567 53.465 1.00 55.34 ? 363 GLY B CA 1 ATOM 4734 C C . GLY B 1 277 ? 78.524 -6.794 53.085 1.00 54.94 ? 363 GLY B C 1 ATOM 4735 O O . GLY B 1 277 ? 78.000 -7.896 53.234 1.00 57.74 ? 363 GLY B O 1 ATOM 4736 N N . ARG B 1 278 ? 77.855 -5.756 52.611 1.00 62.09 ? 364 ARG B N 1 ATOM 4737 C CA . ARG B 1 278 ? 76.454 -5.904 52.247 1.00 60.55 ? 364 ARG B CA 1 ATOM 4738 C C . ARG B 1 278 ? 75.961 -4.805 51.316 1.00 57.41 ? 364 ARG B C 1 ATOM 4739 O O . ARG B 1 278 ? 76.589 -3.742 51.176 1.00 61.49 ? 364 ARG B O 1 ATOM 4740 C CB . ARG B 1 278 ? 75.577 -5.962 53.501 1.00 55.73 ? 364 ARG B CB 1 ATOM 4741 C CG . ARG B 1 278 ? 75.144 -4.605 54.031 1.00 59.39 ? 364 ARG B CG 1 ATOM 4742 C CD . ARG B 1 278 ? 74.551 -4.741 55.407 1.00 54.54 ? 364 ARG B CD 1 ATOM 4743 N NE . ARG B 1 278 ? 74.042 -3.477 55.898 1.00 56.18 ? 364 ARG B NE 1 ATOM 4744 C CZ . ARG B 1 278 ? 73.264 -3.360 56.967 1.00 64.73 ? 364 ARG B CZ 1 ATOM 4745 N NH1 . ARG B 1 278 ? 72.908 -4.445 57.647 1.00 60.86 ? 364 ARG B NH1 1 ATOM 4746 N NH2 . ARG B 1 278 ? 72.844 -2.157 57.352 1.00 50.37 ? 364 ARG B NH2 1 ATOM 4747 N N . ILE B 1 279 ? 74.830 -5.075 50.677 1.00 52.94 ? 365 ILE B N 1 ATOM 4748 C CA . ILE B 1 279 ? 74.210 -4.088 49.811 1.00 51.87 ? 365 ILE B CA 1 ATOM 4749 C C . ILE B 1 279 ? 73.532 -3.036 50.694 1.00 56.12 ? 365 ILE B C 1 ATOM 4750 O O . ILE B 1 279 ? 72.782 -3.370 51.615 1.00 62.95 ? 365 ILE B O 1 ATOM 4751 C CB . ILE B 1 279 ? 73.218 -4.759 48.833 1.00 54.74 ? 365 ILE B CB 1 ATOM 4752 C CG1 . ILE B 1 279 ? 73.941 -5.846 48.027 1.00 43.11 ? 365 ILE B CG1 1 ATOM 4753 C CG2 . ILE B 1 279 ? 72.581 -3.730 47.913 1.00 44.69 ? 365 ILE B CG2 1 ATOM 4754 C CD1 . ILE B 1 279 ? 73.040 -6.639 47.092 1.00 61.03 ? 365 ILE B CD1 1 ATOM 4755 N N . ILE B 1 280 ? 73.826 -1.768 50.429 1.00 56.76 ? 366 ILE B N 1 ATOM 4756 C CA . ILE B 1 280 ? 73.340 -0.669 51.264 1.00 63.88 ? 366 ILE B CA 1 ATOM 4757 C C . ILE B 1 280 ? 71.813 -0.486 51.205 1.00 69.91 ? 366 ILE B C 1 ATOM 4758 O O . ILE B 1 280 ? 71.156 -0.356 52.236 1.00 62.03 ? 366 ILE B O 1 ATOM 4759 C CB . ILE B 1 280 ? 74.050 0.659 50.904 1.00 70.85 ? 366 ILE B CB 1 ATOM 4760 C CG1 . ILE B 1 280 ? 75.556 0.547 51.180 1.00 64.06 ? 366 ILE B CG1 1 ATOM 4761 C CG2 . ILE B 1 280 ? 73.435 1.835 51.663 1.00 55.20 ? 366 ILE B CG2 1 ATOM 4762 C CD1 . ILE B 1 280 ? 76.372 1.723 50.635 1.00 49.61 ? 366 ILE B CD1 1 ATOM 4763 N N . ASN B 1 281 ? 71.244 -0.474 50.005 1.00 73.30 ? 367 ASN B N 1 ATOM 4764 C CA . ASN B 1 281 ? 69.797 -0.342 49.885 1.00 67.44 ? 367 ASN B CA 1 ATOM 4765 C C . ASN B 1 281 ? 69.164 -1.616 49.364 1.00 65.98 ? 367 ASN B C 1 ATOM 4766 O O . ASN B 1 281 ? 69.293 -1.937 48.187 1.00 80.52 ? 367 ASN B O 1 ATOM 4767 C CB . ASN B 1 281 ? 69.448 0.833 48.978 1.00 72.27 ? 367 ASN B CB 1 ATOM 4768 C CG . ASN B 1 281 ? 70.042 2.138 49.470 1.00 72.12 ? 367 ASN B CG 1 ATOM 4769 O OD1 . ASN B 1 281 ? 70.980 2.673 48.862 1.00 63.98 ? 367 ASN B OD1 1 ATOM 4770 N ND2 . ASN B 1 281 ? 69.502 2.660 50.584 1.00 65.59 ? 367 ASN B ND2 1 ATOM 4771 N N . PRO B 1 282 ? 68.492 -2.361 50.250 1.00 57.69 ? 368 PRO B N 1 ATOM 4772 C CA . PRO B 1 282 ? 67.905 -3.660 49.895 1.00 59.24 ? 368 PRO B CA 1 ATOM 4773 C C . PRO B 1 282 ? 66.856 -3.565 48.784 1.00 63.11 ? 368 PRO B C 1 ATOM 4774 O O . PRO B 1 282 ? 66.743 -4.492 47.989 1.00 70.84 ? 368 PRO B O 1 ATOM 4775 C CB . PRO B 1 282 ? 67.268 -4.124 51.210 1.00 72.98 ? 368 PRO B CB 1 ATOM 4776 C CG . PRO B 1 282 ? 68.121 -3.476 52.262 1.00 68.43 ? 368 PRO B CG 1 ATOM 4777 C CD . PRO B 1 282 ? 68.438 -2.109 51.699 1.00 61.03 ? 368 PRO B CD 1 ATOM 4778 N N . GLY B 1 283 ? 66.122 -2.456 48.723 1.00 71.30 ? 369 GLY B N 1 ATOM 4779 C CA . GLY B 1 283 ? 65.070 -2.262 47.736 1.00 47.57 ? 369 GLY B CA 1 ATOM 4780 C C . GLY B 1 283 ? 65.652 -2.015 46.361 1.00 70.28 ? 369 GLY B C 1 ATOM 4781 O O . GLY B 1 283 ? 65.565 -2.873 45.486 1.00 73.25 ? 369 GLY B O 1 ATOM 4782 N N . SER B 1 284 ? 66.236 -0.836 46.160 1.00 82.00 ? 370 SER B N 1 ATOM 4783 C CA . SER B 1 284 ? 67.008 -0.574 44.946 1.00 83.31 ? 370 SER B CA 1 ATOM 4784 C C . SER B 1 284 ? 68.414 -1.056 45.227 1.00 86.76 ? 370 SER B C 1 ATOM 4785 O O . SER B 1 284 ? 69.153 -0.397 45.969 1.00 110.35 ? 370 SER B O 1 ATOM 4786 C CB . SER B 1 284 ? 67.066 0.923 44.665 1.00 88.92 ? 370 SER B CB 1 ATOM 4787 O OG . SER B 1 284 ? 67.937 1.591 45.579 1.00 87.31 ? 370 SER B OG 1 ATOM 4788 N N . LYS B 1 285 ? 68.810 -2.182 44.652 1.00 68.46 ? 371 LYS B N 1 ATOM 4789 C CA . LYS B 1 285 ? 70.043 -2.822 45.108 1.00 75.35 ? 371 LYS B CA 1 ATOM 4790 C C . LYS B 1 285 ? 71.337 -1.981 44.923 1.00 81.98 ? 371 LYS B C 1 ATOM 4791 O O . LYS B 1 285 ? 72.379 -2.498 44.516 1.00 78.81 ? 371 LYS B O 1 ATOM 4792 C CB . LYS B 1 285 ? 70.186 -4.222 44.492 1.00 72.18 ? 371 LYS B CB 1 ATOM 4793 C CG . LYS B 1 285 ? 69.386 -5.323 45.204 1.00 69.64 ? 371 LYS B CG 1 ATOM 4794 C CD . LYS B 1 285 ? 67.963 -5.404 44.682 1.00 74.52 ? 371 LYS B CD 1 ATOM 4795 C CE . LYS B 1 285 ? 67.139 -6.460 45.403 1.00 81.50 ? 371 LYS B CE 1 ATOM 4796 N NZ . LYS B 1 285 ? 65.737 -6.518 44.876 1.00 87.25 ? 371 LYS B NZ 1 ATOM 4797 N N . LYS B 1 286 ? 71.275 -0.696 45.265 1.00 75.39 ? 372 LYS B N 1 ATOM 4798 C CA . LYS B 1 286 ? 72.399 0.213 45.063 1.00 73.66 ? 372 LYS B CA 1 ATOM 4799 C C . LYS B 1 286 ? 73.288 0.375 46.286 1.00 72.44 ? 372 LYS B C 1 ATOM 4800 O O . LYS B 1 286 ? 72.811 0.368 47.436 1.00 71.44 ? 372 LYS B O 1 ATOM 4801 C CB . LYS B 1 286 ? 71.912 1.582 44.572 1.00 77.27 ? 372 LYS B CB 1 ATOM 4802 C CG . LYS B 1 286 ? 71.390 1.535 43.145 1.00 97.46 ? 372 LYS B CG 1 ATOM 4803 C CD . LYS B 1 286 ? 71.456 2.888 42.455 1.00 108.79 ? 372 LYS B CD 1 ATOM 4804 C CE . LYS B 1 286 ? 71.200 2.760 40.953 1.00 111.80 ? 372 LYS B CE 1 ATOM 4805 N NZ . LYS B 1 286 ? 72.459 2.642 40.158 1.00 106.06 ? 372 LYS B NZ 1 ATOM 4806 N N . GLY B 1 287 ? 74.590 0.514 46.023 1.00 66.44 ? 373 GLY B N 1 ATOM 4807 C CA . GLY B 1 287 ? 75.579 0.757 47.067 1.00 64.54 ? 373 GLY B CA 1 ATOM 4808 C C . GLY B 1 287 ? 76.123 -0.506 47.721 1.00 67.67 ? 373 GLY B C 1 ATOM 4809 O O . GLY B 1 287 ? 75.378 -1.455 48.029 1.00 64.70 ? 373 GLY B O 1 ATOM 4810 N N . PHE B 1 288 ? 77.429 -0.533 47.943 1.00 65.66 ? 374 PHE B N 1 ATOM 4811 C CA . PHE B 1 288 ? 77.992 -1.626 48.714 1.00 67.27 ? 374 PHE B CA 1 ATOM 4812 C C . PHE B 1 288 ? 78.802 -1.088 49.876 1.00 59.75 ? 374 PHE B C 1 ATOM 4813 O O . PHE B 1 288 ? 79.662 -0.228 49.692 1.00 63.55 ? 374 PHE B O 1 ATOM 4814 C CB . PHE B 1 288 ? 78.849 -2.533 47.838 1.00 56.94 ? 374 PHE B CB 1 ATOM 4815 C CG . PHE B 1 288 ? 79.317 -3.772 48.540 1.00 57.17 ? 374 PHE B CG 1 ATOM 4816 C CD1 . PHE B 1 288 ? 78.508 -4.900 48.601 1.00 63.03 ? 374 PHE B CD1 1 ATOM 4817 C CD2 . PHE B 1 288 ? 80.563 -3.816 49.140 1.00 55.67 ? 374 PHE B CD2 1 ATOM 4818 C CE1 . PHE B 1 288 ? 78.941 -6.063 49.248 1.00 56.78 ? 374 PHE B CE1 1 ATOM 4819 C CE2 . PHE B 1 288 ? 80.998 -4.971 49.787 1.00 67.67 ? 374 PHE B CE2 1 ATOM 4820 C CZ . PHE B 1 288 ? 80.184 -6.096 49.841 1.00 56.56 ? 374 PHE B CZ 1 ATOM 4821 N N . GLU B 1 289 ? 78.531 -1.592 51.072 1.00 63.89 ? 375 GLU B N 1 ATOM 4822 C CA . GLU B 1 289 ? 79.280 -1.143 52.246 1.00 71.46 ? 375 GLU B CA 1 ATOM 4823 C C . GLU B 1 289 ? 79.948 -2.322 52.913 1.00 60.49 ? 375 GLU B C 1 ATOM 4824 O O . GLU B 1 289 ? 79.501 -3.468 52.773 1.00 58.75 ? 375 GLU B O 1 ATOM 4825 C CB . GLU B 1 289 ? 78.376 -0.417 53.258 1.00 61.64 ? 375 GLU B CB 1 ATOM 4826 C CG . GLU B 1 289 ? 77.259 -1.297 53.806 1.00 61.53 ? 375 GLU B CG 1 ATOM 4827 C CD . GLU B 1 289 ? 76.239 -0.532 54.629 1.00 73.82 ? 375 GLU B CD 1 ATOM 4828 O OE1 . GLU B 1 289 ? 76.533 0.630 55.003 1.00 78.00 ? 375 GLU B OE1 1 ATOM 4829 O OE2 . GLU B 1 289 ? 75.146 -1.089 54.889 1.00 75.00 ? 375 GLU B OE2 1 ATOM 4830 N N . ILE B 1 290 ? 81.023 -2.037 53.639 1.00 53.95 ? 376 ILE B N 1 ATOM 4831 C CA . ILE B 1 290 ? 81.683 -3.066 54.435 1.00 61.60 ? 376 ILE B CA 1 ATOM 4832 C C . ILE B 1 290 ? 82.019 -2.520 55.834 1.00 69.14 ? 376 ILE B C 1 ATOM 4833 O O . ILE B 1 290 ? 82.528 -1.403 55.981 1.00 78.32 ? 376 ILE B O 1 ATOM 4834 C CB . ILE B 1 290 ? 82.915 -3.651 53.704 1.00 56.91 ? 376 ILE B CB 1 ATOM 4835 C CG1 . ILE B 1 290 ? 83.329 -4.973 54.346 1.00 53.24 ? 376 ILE B CG1 1 ATOM 4836 C CG2 . ILE B 1 290 ? 84.074 -2.633 53.644 1.00 50.80 ? 376 ILE B CG2 1 ATOM 4837 C CD1 . ILE B 1 290 ? 84.383 -5.720 53.560 1.00 50.43 ? 376 ILE B CD1 1 ATOM 4838 N N . TYR B 1 291 ? 81.705 -3.304 56.858 1.00 54.02 ? 377 TYR B N 1 ATOM 4839 C CA . TYR B 1 291 ? 81.719 -2.806 58.226 1.00 52.75 ? 377 TYR B CA 1 ATOM 4840 C C . TYR B 1 291 ? 82.766 -3.548 59.076 1.00 62.22 ? 377 TYR B C 1 ATOM 4841 O O . TYR B 1 291 ? 82.759 -4.781 59.138 1.00 58.87 ? 377 TYR B O 1 ATOM 4842 C CB . TYR B 1 291 ? 80.316 -2.968 58.825 1.00 50.41 ? 377 TYR B CB 1 ATOM 4843 C CG . TYR B 1 291 ? 80.051 -2.141 60.051 1.00 61.04 ? 377 TYR B CG 1 ATOM 4844 C CD1 . TYR B 1 291 ? 80.950 -1.161 60.464 1.00 77.18 ? 377 TYR B CD1 1 ATOM 4845 C CD2 . TYR B 1 291 ? 78.904 -2.338 60.804 1.00 72.52 ? 377 TYR B CD2 1 ATOM 4846 C CE1 . TYR B 1 291 ? 80.713 -0.401 61.596 1.00 74.93 ? 377 TYR B CE1 1 ATOM 4847 C CE2 . TYR B 1 291 ? 78.658 -1.583 61.942 1.00 81.51 ? 377 TYR B CE2 1 ATOM 4848 C CZ . TYR B 1 291 ? 79.565 -0.616 62.334 1.00 82.13 ? 377 TYR B CZ 1 ATOM 4849 O OH . TYR B 1 291 ? 79.323 0.138 63.460 1.00 79.92 ? 377 TYR B OH 1 ATOM 4850 N N . LYS B 1 292 ? 83.677 -2.809 59.712 1.00 57.61 ? 378 LYS B N 1 ATOM 4851 C CA . LYS B 1 292 ? 84.706 -3.453 60.522 1.00 59.50 ? 378 LYS B CA 1 ATOM 4852 C C . LYS B 1 292 ? 84.196 -3.720 61.939 1.00 69.08 ? 378 LYS B C 1 ATOM 4853 O O . LYS B 1 292 ? 83.503 -2.903 62.544 1.00 74.21 ? 378 LYS B O 1 ATOM 4854 C CB . LYS B 1 292 ? 86.002 -2.632 60.558 1.00 70.40 ? 378 LYS B CB 1 ATOM 4855 C CG . LYS B 1 292 ? 87.213 -3.364 61.175 1.00 72.40 ? 378 LYS B CG 1 ATOM 4856 C CD . LYS B 1 292 ? 88.174 -2.384 61.875 1.00 84.48 ? 378 LYS B CD 1 ATOM 4857 C CE . LYS B 1 292 ? 89.425 -2.095 61.053 1.00 85.12 ? 378 LYS B CE 1 ATOM 4858 N NZ . LYS B 1 292 ? 89.941 -0.700 61.254 1.00 77.00 ? 378 LYS B NZ 1 ATOM 4859 N N . PHE B 1 293 ? 84.535 -4.889 62.456 1.00 66.34 ? 379 PHE B N 1 ATOM 4860 C CA . PHE B 1 293 ? 84.184 -5.235 63.808 1.00 67.19 ? 379 PHE B CA 1 ATOM 4861 C C . PHE B 1 293 ? 85.450 -5.541 64.583 1.00 73.93 ? 379 PHE B C 1 ATOM 4862 O O . PHE B 1 293 ? 86.334 -6.235 64.082 1.00 68.53 ? 379 PHE B O 1 ATOM 4863 C CB . PHE B 1 293 ? 83.227 -6.412 63.805 1.00 59.31 ? 379 PHE B CB 1 ATOM 4864 C CG . PHE B 1 293 ? 81.867 -6.065 63.277 1.00 68.38 ? 379 PHE B CG 1 ATOM 4865 C CD1 . PHE B 1 293 ? 81.601 -6.117 61.907 1.00 60.70 ? 379 PHE B CD1 1 ATOM 4866 C CD2 . PHE B 1 293 ? 80.849 -5.667 64.145 1.00 62.07 ? 379 PHE B CD2 1 ATOM 4867 C CE1 . PHE B 1 293 ? 80.330 -5.781 61.409 1.00 59.42 ? 379 PHE B CE1 1 ATOM 4868 C CE2 . PHE B 1 293 ? 79.579 -5.334 63.658 1.00 60.08 ? 379 PHE B CE2 1 ATOM 4869 C CZ . PHE B 1 293 ? 79.317 -5.391 62.287 1.00 64.84 ? 379 PHE B CZ 1 ATOM 4870 N N . LEU B 1 294 ? 85.550 -4.996 65.794 1.00 78.38 ? 380 LEU B N 1 ATOM 4871 C CA . LEU B 1 294 ? 86.729 -5.223 66.616 1.00 73.80 ? 380 LEU B CA 1 ATOM 4872 C C . LEU B 1 294 ? 86.541 -6.554 67.343 1.00 81.94 ? 380 LEU B C 1 ATOM 4873 O O . LEU B 1 294 ? 86.100 -6.572 68.494 1.00 83.55 ? 380 LEU B O 1 ATOM 4874 C CB . LEU B 1 294 ? 86.913 -4.083 67.616 1.00 69.94 ? 380 LEU B CB 1 ATOM 4875 C CG . LEU B 1 294 ? 87.501 -2.746 67.132 1.00 76.81 ? 380 LEU B CG 1 ATOM 4876 C CD1 . LEU B 1 294 ? 87.604 -2.655 65.614 1.00 56.78 ? 380 LEU B CD1 1 ATOM 4877 C CD2 . LEU B 1 294 ? 86.687 -1.581 67.678 1.00 58.95 ? 380 LEU B CD2 1 ATOM 4878 N N . GLY B 1 295 ? 86.845 -7.659 66.656 1.00 82.26 ? 381 GLY B N 1 ATOM 4879 C CA . GLY B 1 295 ? 86.716 -8.989 67.227 1.00 80.83 ? 381 GLY B CA 1 ATOM 4880 C C . GLY B 1 295 ? 85.797 -9.941 66.479 1.00 79.12 ? 381 GLY B C 1 ATOM 4881 O O . GLY B 1 295 ? 85.437 -9.691 65.331 1.00 73.95 ? 381 GLY B O 1 ATOM 4882 N N . THR B 1 296 ? 85.411 -11.027 67.148 1.00 74.22 ? 382 THR B N 1 ATOM 4883 C CA . THR B 1 296 ? 84.637 -12.118 66.548 1.00 72.24 ? 382 THR B CA 1 ATOM 4884 C C . THR B 1 296 ? 83.198 -11.757 66.153 1.00 74.22 ? 382 THR B C 1 ATOM 4885 O O . THR B 1 296 ? 82.472 -11.099 66.895 1.00 71.84 ? 382 THR B O 1 ATOM 4886 C CB . THR B 1 296 ? 84.568 -13.357 67.505 1.00 67.09 ? 382 THR B CB 1 ATOM 4887 O OG1 . THR B 1 296 ? 83.877 -14.435 66.867 1.00 74.52 ? 382 THR B OG1 1 ATOM 4888 C CG2 . THR B 1 296 ? 83.816 -13.027 68.791 1.00 66.98 ? 382 THR B CG2 1 ATOM 4889 N N . LEU B 1 297 ? 82.777 -12.233 64.989 1.00 69.44 ? 383 LEU B N 1 ATOM 4890 C CA . LEU B 1 297 ? 81.380 -12.143 64.595 1.00 68.97 ? 383 LEU B CA 1 ATOM 4891 C C . LEU B 1 297 ? 80.455 -12.923 65.535 1.00 68.07 ? 383 LEU B C 1 ATOM 4892 O O . LEU B 1 297 ? 79.230 -12.763 65.483 1.00 68.28 ? 383 LEU B O 1 ATOM 4893 C CB . LEU B 1 297 ? 81.207 -12.670 63.162 1.00 58.60 ? 383 LEU B CB 1 ATOM 4894 C CG . LEU B 1 297 ? 82.022 -11.977 62.064 1.00 60.01 ? 383 LEU B CG 1 ATOM 4895 C CD1 . LEU B 1 297 ? 82.088 -12.829 60.808 1.00 65.14 ? 383 LEU B CD1 1 ATOM 4896 C CD2 . LEU B 1 297 ? 81.479 -10.594 61.733 1.00 61.83 ? 383 LEU B CD2 1 ATOM 4897 N N . PHE B 1 298 ? 81.038 -13.760 66.394 1.00 76.13 ? 384 PHE B N 1 ATOM 4898 C CA . PHE B 1 298 ? 80.257 -14.725 67.182 1.00 70.63 ? 384 PHE B CA 1 ATOM 4899 C C . PHE B 1 298 ? 80.181 -14.469 68.683 1.00 72.02 ? 384 PHE B C 1 ATOM 4900 O O . PHE B 1 298 ? 79.969 -15.390 69.474 1.00 75.93 ? 384 PHE B O 1 ATOM 4901 C CB . PHE B 1 298 ? 80.746 -16.136 66.875 1.00 60.39 ? 384 PHE B CB 1 ATOM 4902 C CG . PHE B 1 298 ? 80.795 -16.408 65.423 1.00 63.32 ? 384 PHE B CG 1 ATOM 4903 C CD1 . PHE B 1 298 ? 79.621 -16.412 64.679 1.00 66.46 ? 384 PHE B CD1 1 ATOM 4904 C CD2 . PHE B 1 298 ? 82.002 -16.587 64.778 1.00 61.54 ? 384 PHE B CD2 1 ATOM 4905 C CE1 . PHE B 1 298 ? 79.646 -16.623 63.317 1.00 64.05 ? 384 PHE B CE1 1 ATOM 4906 C CE2 . PHE B 1 298 ? 82.036 -16.806 63.421 1.00 60.86 ? 384 PHE B CE2 1 ATOM 4907 C CZ . PHE B 1 298 ? 80.859 -16.820 62.688 1.00 67.30 ? 384 PHE B CZ 1 ATOM 4908 N N . SER B 1 299 ? 80.367 -13.209 69.061 1.00 71.13 ? 385 SER B N 1 ATOM 4909 C CA . SER B 1 299 ? 80.029 -12.754 70.403 1.00 72.10 ? 385 SER B CA 1 ATOM 4910 C C . SER B 1 299 ? 79.054 -11.581 70.296 1.00 77.80 ? 385 SER B C 1 ATOM 4911 O O . SER B 1 299 ? 79.173 -10.736 69.397 1.00 86.06 ? 385 SER B O 1 ATOM 4912 C CB . SER B 1 299 ? 81.283 -12.359 71.188 1.00 72.52 ? 385 SER B CB 1 ATOM 4913 O OG . SER B 1 299 ? 81.006 -11.373 72.172 1.00 64.53 ? 385 SER B OG 1 ATOM 4914 N N . VAL B 1 300 ? 78.071 -11.553 71.190 1.00 69.98 ? 387 VAL B N 1 ATOM 4915 C CA . VAL B 1 300 ? 77.132 -10.440 71.250 1.00 77.64 ? 387 VAL B CA 1 ATOM 4916 C C . VAL B 1 300 ? 77.865 -9.156 71.640 1.00 72.74 ? 387 VAL B C 1 ATOM 4917 O O . VAL B 1 300 ? 77.506 -8.071 71.191 1.00 79.38 ? 387 VAL B O 1 ATOM 4918 C CB . VAL B 1 300 ? 75.976 -10.748 72.229 1.00 82.23 ? 387 VAL B CB 1 ATOM 4919 C CG1 . VAL B 1 300 ? 75.387 -9.474 72.820 1.00 93.13 ? 387 VAL B CG1 1 ATOM 4920 C CG2 . VAL B 1 300 ? 74.906 -11.579 71.525 1.00 73.63 ? 387 VAL B CG2 1 ATOM 4921 N N . GLN B 1 301 ? 78.922 -9.305 72.439 1.00 70.44 ? 388 GLN B N 1 ATOM 4922 C CA . GLN B 1 301 ? 79.682 -8.169 72.974 1.00 77.49 ? 388 GLN B CA 1 ATOM 4923 C C . GLN B 1 301 ? 80.479 -7.363 71.947 1.00 80.81 ? 388 GLN B C 1 ATOM 4924 O O . GLN B 1 301 ? 80.641 -6.152 72.117 1.00 86.01 ? 388 GLN B O 1 ATOM 4925 C CB . GLN B 1 301 ? 80.610 -8.599 74.135 1.00 79.60 ? 388 GLN B CB 1 ATOM 4926 C CG . GLN B 1 301 ? 79.890 -9.151 75.374 1.00 72.84 ? 388 GLN B CG 1 ATOM 4927 C CD . GLN B 1 301 ? 78.759 -8.245 75.831 1.00 94.59 ? 388 GLN B CD 1 ATOM 4928 O OE1 . GLN B 1 301 ? 78.912 -7.021 75.865 1.00 115.59 ? 388 GLN B OE1 1 ATOM 4929 N NE2 . GLN B 1 301 ? 77.611 -8.839 76.173 1.00 89.53 ? 388 GLN B NE2 1 ATOM 4930 N N . THR B 1 302 ? 80.973 -8.005 70.888 1.00 88.84 ? 390 THR B N 1 ATOM 4931 C CA . THR B 1 302 ? 81.843 -7.287 69.939 1.00 88.50 ? 390 THR B CA 1 ATOM 4932 C C . THR B 1 302 ? 81.126 -6.136 69.225 1.00 80.83 ? 390 THR B C 1 ATOM 4933 O O . THR B 1 302 ? 79.910 -6.169 69.012 1.00 72.89 ? 390 THR B O 1 ATOM 4934 C CB . THR B 1 302 ? 82.599 -8.223 68.954 1.00 89.06 ? 390 THR B CB 1 ATOM 4935 O OG1 . THR B 1 302 ? 81.950 -8.246 67.682 1.00 76.64 ? 390 THR B OG1 1 ATOM 4936 C CG2 . THR B 1 302 ? 82.711 -9.626 69.526 1.00 81.38 ? 390 THR B CG2 1 ATOM 4937 N N . VAL B 1 303 ? 81.904 -5.125 68.853 1.00 82.19 ? 391 VAL B N 1 ATOM 4938 C CA . VAL B 1 303 ? 81.389 -3.755 68.800 1.00 101.83 ? 391 VAL B CA 1 ATOM 4939 C C . VAL B 1 303 ? 81.107 -3.129 67.430 1.00 124.83 ? 391 VAL B C 1 ATOM 4940 O O . VAL B 1 303 ? 80.005 -2.607 67.202 1.00 136.11 ? 391 VAL B O 1 ATOM 4941 C CB . VAL B 1 303 ? 82.291 -2.811 69.620 1.00 103.13 ? 391 VAL B CB 1 ATOM 4942 C CG1 . VAL B 1 303 ? 83.754 -3.156 69.383 1.00 111.91 ? 391 VAL B CG1 1 ATOM 4943 C CG2 . VAL B 1 303 ? 82.009 -1.345 69.283 1.00 106.39 ? 391 VAL B CG2 1 ATOM 4944 N N . GLY B 1 304 ? 82.088 -3.128 66.534 1.00 55.79 ? 392 GLY B N 1 ATOM 4945 C CA . GLY B 1 304 ? 81.850 -2.487 65.256 1.00 80.35 ? 392 GLY B CA 1 ATOM 4946 C C . GLY B 1 304 ? 82.294 -1.037 65.249 1.00 82.13 ? 392 GLY B C 1 ATOM 4947 O O . GLY B 1 304 ? 81.723 -0.181 65.925 1.00 87.39 ? 392 GLY B O 1 ATOM 4948 N N . ASN B 1 305 A 83.323 -0.768 64.458 1.00 73.47 ? 392 ASN B N 1 ATOM 4949 C CA . ASN B 1 305 A 83.973 0.519 64.458 1.00 75.04 ? 392 ASN B CA 1 ATOM 4950 C C . ASN B 1 305 A 83.741 1.254 63.143 1.00 91.00 ? 392 ASN B C 1 ATOM 4951 O O . ASN B 1 305 A 82.833 2.086 63.041 1.00 103.92 ? 392 ASN B O 1 ATOM 4952 C CB . ASN B 1 305 A 85.474 0.326 64.694 1.00 77.42 ? 392 ASN B CB 1 ATOM 4953 C CG . ASN B 1 305 A 86.145 1.564 65.250 1.00 84.06 ? 392 ASN B CG 1 ATOM 4954 O OD1 . ASN B 1 305 A 85.652 2.183 66.200 1.00 77.21 ? 392 ASN B OD1 1 ATOM 4955 N ND2 . ASN B 1 305 A 87.284 1.932 64.662 1.00 98.07 ? 392 ASN B ND2 1 ATOM 4956 N N . ARG B 1 306 ? 84.559 0.933 62.139 1.00 77.37 ? 393 ARG B N 1 ATOM 4957 C CA . ARG B 1 306 ? 84.576 1.673 60.877 1.00 72.48 ? 393 ARG B CA 1 ATOM 4958 C C . ARG B 1 306 ? 83.644 1.086 59.805 1.00 73.20 ? 393 ARG B C 1 ATOM 4959 O O . ARG B 1 306 ? 83.686 -0.118 59.506 1.00 66.44 ? 393 ARG B O 1 ATOM 4960 C CB . ARG B 1 306 ? 86.003 1.704 60.335 1.00 74.75 ? 393 ARG B CB 1 ATOM 4961 C CG . ARG B 1 306 ? 86.192 2.584 59.116 1.00 84.14 ? 393 ARG B CG 1 ATOM 4962 C CD . ARG B 1 306 ? 86.523 4.018 59.518 1.00 79.66 ? 393 ARG B CD 1 ATOM 4963 N NE . ARG B 1 306 ? 87.404 4.653 58.537 1.00 75.84 ? 393 ARG B NE 1 ATOM 4964 C CZ . ARG B 1 306 ? 86.970 5.353 57.492 1.00 69.64 ? 393 ARG B CZ 1 ATOM 4965 N NH1 . ARG B 1 306 ? 85.663 5.514 57.294 1.00 71.89 ? 393 ARG B NH1 1 ATOM 4966 N NH2 . ARG B 1 306 ? 87.841 5.896 56.648 1.00 64.19 ? 393 ARG B NH2 1 ATOM 4967 N N . ASN B 1 307 ? 82.805 1.937 59.222 1.00 67.55 ? 394 ASN B N 1 ATOM 4968 C CA . ASN B 1 307 ? 81.965 1.516 58.109 1.00 59.34 ? 394 ASN B CA 1 ATOM 4969 C C . ASN B 1 307 ? 82.375 2.218 56.819 1.00 62.54 ? 394 ASN B C 1 ATOM 4970 O O . ASN B 1 307 ? 82.292 3.452 56.710 1.00 65.63 ? 394 ASN B O 1 ATOM 4971 C CB . ASN B 1 307 ? 80.488 1.773 58.394 1.00 62.12 ? 394 ASN B CB 1 ATOM 4972 C CG . ASN B 1 307 ? 79.596 1.388 57.224 1.00 72.73 ? 394 ASN B CG 1 ATOM 4973 O OD1 . ASN B 1 307 ? 79.082 0.275 57.160 1.00 69.32 ? 394 ASN B OD1 1 ATOM 4974 N ND2 . ASN B 1 307 ? 79.407 2.315 56.293 1.00 89.46 ? 394 ASN B ND2 1 ATOM 4975 N N . TYR B 1 308 ? 82.824 1.429 55.847 1.00 59.27 ? 395 TYR B N 1 ATOM 4976 C CA . TYR B 1 308 ? 83.266 1.955 54.559 1.00 69.26 ? 395 TYR B CA 1 ATOM 4977 C C . TYR B 1 308 ? 82.134 1.858 53.528 1.00 73.15 ? 395 TYR B C 1 ATOM 4978 O O . TYR B 1 308 ? 81.580 0.775 53.291 1.00 70.31 ? 395 TYR B O 1 ATOM 4979 C CB . TYR B 1 308 ? 84.478 1.176 54.041 1.00 71.83 ? 395 TYR B CB 1 ATOM 4980 C CG . TYR B 1 308 ? 85.803 1.367 54.766 1.00 69.60 ? 395 TYR B CG 1 ATOM 4981 C CD1 . TYR B 1 308 ? 86.609 2.474 54.501 1.00 76.95 ? 395 TYR B CD1 1 ATOM 4982 C CD2 . TYR B 1 308 ? 86.285 0.400 55.661 1.00 67.96 ? 395 TYR B CD2 1 ATOM 4983 C CE1 . TYR B 1 308 ? 87.842 2.639 55.133 1.00 77.85 ? 395 TYR B CE1 1 ATOM 4984 C CE2 . TYR B 1 308 ? 87.516 0.556 56.302 1.00 68.48 ? 395 TYR B CE2 1 ATOM 4985 C CZ . TYR B 1 308 ? 88.288 1.679 56.032 1.00 77.39 ? 395 TYR B CZ 1 ATOM 4986 O OH . TYR B 1 308 ? 89.506 1.847 56.645 1.00 77.29 ? 395 TYR B OH 1 ATOM 4987 N N . GLN B 1 309 ? 81.799 3.004 52.936 1.00 73.34 ? 396 GLN B N 1 ATOM 4988 C CA . GLN B 1 309 ? 80.855 3.099 51.828 1.00 69.83 ? 396 GLN B CA 1 ATOM 4989 C C . GLN B 1 309 ? 81.687 2.948 50.548 1.00 64.31 ? 396 GLN B C 1 ATOM 4990 O O . GLN B 1 309 ? 82.215 3.931 50.028 1.00 70.50 ? 396 GLN B O 1 ATOM 4991 C CB . GLN B 1 309 ? 80.168 4.474 51.858 1.00 84.95 ? 396 GLN B CB 1 ATOM 4992 C CG . GLN B 1 309 ? 78.633 4.481 51.725 1.00 106.58 ? 396 GLN B CG 1 ATOM 4993 C CD . GLN B 1 309 ? 77.892 4.281 53.053 1.00 119.07 ? 396 GLN B CD 1 ATOM 4994 O OE1 . GLN B 1 309 ? 78.321 3.512 53.913 1.00 116.98 ? 396 GLN B OE1 1 ATOM 4995 N NE2 . GLN B 1 309 ? 76.767 4.975 53.212 1.00 119.46 ? 396 GLN B NE2 1 ATOM 4996 N N . LEU B 1 310 ? 81.837 1.721 50.053 1.00 58.91 ? 397 LEU B N 1 ATOM 4997 C CA . LEU B 1 310 ? 82.764 1.467 48.943 1.00 60.19 ? 397 LEU B CA 1 ATOM 4998 C C . LEU B 1 310 ? 82.188 1.819 47.570 1.00 60.83 ? 397 LEU B C 1 ATOM 4999 O O . LEU B 1 310 ? 82.844 2.486 46.760 1.00 56.50 ? 397 LEU B O 1 ATOM 5000 C CB . LEU B 1 310 ? 83.262 0.020 48.966 1.00 54.37 ? 397 LEU B CB 1 ATOM 5001 C CG . LEU B 1 310 ? 84.271 -0.338 50.068 1.00 60.24 ? 397 LEU B CG 1 ATOM 5002 C CD1 . LEU B 1 310 ? 84.548 -1.849 50.093 1.00 63.93 ? 397 LEU B CD1 1 ATOM 5003 C CD2 . LEU B 1 310 ? 85.564 0.440 49.892 1.00 53.58 ? 397 LEU B CD2 1 ATOM 5004 N N . LEU B 1 311 ? 80.962 1.372 47.320 1.00 60.47 ? 398 LEU B N 1 ATOM 5005 C CA . LEU B 1 311 ? 80.290 1.665 46.070 1.00 56.49 ? 398 LEU B CA 1 ATOM 5006 C C . LEU B 1 311 ? 79.043 2.476 46.355 1.00 58.48 ? 398 LEU B C 1 ATOM 5007 O O . LEU B 1 311 ? 78.344 2.229 47.333 1.00 68.90 ? 398 LEU B O 1 ATOM 5008 C CB . LEU B 1 311 ? 79.942 0.375 45.316 1.00 66.13 ? 398 LEU B CB 1 ATOM 5009 C CG . LEU B 1 311 ? 81.089 -0.411 44.665 1.00 71.06 ? 398 LEU B CG 1 ATOM 5010 C CD1 . LEU B 1 311 ? 82.055 0.527 44.004 1.00 74.20 ? 398 LEU B CD1 1 ATOM 5011 C CD2 . LEU B 1 311 ? 81.826 -1.252 45.674 1.00 75.63 ? 398 LEU B CD2 1 ATOM 5012 N N . SER B 1 312 ? 78.763 3.441 45.489 1.00 64.95 ? 399 SER B N 1 ATOM 5013 C CA . SER B 1 312 ? 77.661 4.372 45.704 1.00 68.99 ? 399 SER B CA 1 ATOM 5014 C C . SER B 1 312 ? 76.710 4.405 44.506 1.00 74.61 ? 399 SER B C 1 ATOM 5015 O O . SER B 1 312 ? 75.491 4.334 44.666 1.00 78.09 ? 399 SER B O 1 ATOM 5016 C CB . SER B 1 312 ? 78.233 5.764 45.950 1.00 51.01 ? 399 SER B CB 1 ATOM 5017 O OG . SER B 1 312 ? 77.307 6.572 46.632 1.00 100.18 ? 399 SER B OG 1 ATOM 5018 N N . ASN B 1 313 ? 77.275 4.501 43.305 1.00 80.35 ? 401 ASN B N 1 ATOM 5019 C CA . ASN B 1 313 ? 76.478 4.600 42.087 1.00 80.41 ? 401 ASN B CA 1 ATOM 5020 C C . ASN B 1 313 ? 75.927 3.267 41.593 1.00 70.26 ? 401 ASN B C 1 ATOM 5021 O O . ASN B 1 313 ? 74.876 3.215 40.960 1.00 82.92 ? 401 ASN B O 1 ATOM 5022 C CB . ASN B 1 313 ? 77.306 5.233 40.966 1.00 89.60 ? 401 ASN B CB 1 ATOM 5023 C CG . ASN B 1 313 ? 78.025 6.493 41.411 1.00 110.15 ? 401 ASN B CG 1 ATOM 5024 O OD1 . ASN B 1 313 ? 77.946 6.889 42.576 1.00 115.89 ? 401 ASN B OD1 1 ATOM 5025 N ND2 . ASN B 1 313 ? 78.743 7.122 40.485 1.00 118.67 ? 401 ASN B ND2 1 ATOM 5026 N N . SER B 1 314 ? 76.637 2.184 41.872 1.00 63.57 ? 402 SER B N 1 ATOM 5027 C CA . SER B 1 314 ? 76.342 0.919 41.211 1.00 52.29 ? 402 SER B CA 1 ATOM 5028 C C . SER B 1 314 ? 75.243 0.053 41.833 1.00 57.73 ? 402 SER B C 1 ATOM 5029 O O . SER B 1 314 ? 75.050 0.010 43.054 1.00 65.36 ? 402 SER B O 1 ATOM 5030 C CB . SER B 1 314 ? 77.621 0.104 41.046 1.00 58.87 ? 402 SER B CB 1 ATOM 5031 O OG . SER B 1 314 ? 78.522 0.778 40.188 1.00 68.85 ? 402 SER B OG 1 ATOM 5032 N N . THR B 1 315 ? 74.519 -0.634 40.961 1.00 60.49 ? 403 THR B N 1 ATOM 5033 C CA . THR B 1 315 ? 73.558 -1.638 41.383 1.00 66.64 ? 403 THR B CA 1 ATOM 5034 C C . THR B 1 315 ? 74.290 -2.965 41.605 1.00 61.25 ? 403 THR B C 1 ATOM 5035 O O . THR B 1 315 ? 74.960 -3.491 40.717 1.00 62.46 ? 403 THR B O 1 ATOM 5036 C CB . THR B 1 315 ? 72.432 -1.783 40.360 1.00 63.13 ? 403 THR B CB 1 ATOM 5037 O OG1 . THR B 1 315 ? 71.883 -0.483 40.088 1.00 67.15 ? 403 THR B OG1 1 ATOM 5038 C CG2 . THR B 1 315 ? 71.350 -2.699 40.896 1.00 61.05 ? 403 THR B CG2 1 ATOM 5039 N N . ILE B 1 316 ? 74.149 -3.492 42.812 1.00 52.03 ? 404 ILE B N 1 ATOM 5040 C CA . ILE B 1 316 ? 74.994 -4.559 43.306 1.00 55.22 ? 404 ILE B CA 1 ATOM 5041 C C . ILE B 1 316 ? 74.235 -5.877 43.297 1.00 61.76 ? 404 ILE B C 1 ATOM 5042 O O . ILE B 1 316 ? 73.021 -5.916 43.520 1.00 65.86 ? 404 ILE B O 1 ATOM 5043 C CB . ILE B 1 316 ? 75.449 -4.231 44.757 1.00 57.92 ? 404 ILE B CB 1 ATOM 5044 C CG1 . ILE B 1 316 ? 76.116 -2.850 44.822 1.00 55.45 ? 404 ILE B CG1 1 ATOM 5045 C CG2 . ILE B 1 316 ? 76.377 -5.291 45.312 1.00 48.40 ? 404 ILE B CG2 1 ATOM 5046 C CD1 . ILE B 1 316 ? 77.351 -2.710 43.974 1.00 60.28 ? 404 ILE B CD1 1 ATOM 5047 N N . GLY B 1 317 ? 74.955 -6.957 43.021 1.00 57.86 ? 405 GLY B N 1 ATOM 5048 C CA . GLY B 1 317 ? 74.395 -8.293 43.131 1.00 39.78 ? 405 GLY B CA 1 ATOM 5049 C C . GLY B 1 317 ? 75.297 -9.151 43.984 1.00 54.86 ? 405 GLY B C 1 ATOM 5050 O O . GLY B 1 317 ? 75.451 -8.886 45.195 1.00 53.25 ? 405 GLY B O 1 ATOM 5051 N N . ARG B 1 318 ? 75.914 -10.157 43.356 1.00 48.07 ? 406 ARG B N 1 ATOM 5052 C CA . ARG B 1 318 ? 76.690 -11.161 44.099 1.00 55.57 ? 406 ARG B CA 1 ATOM 5053 C C . ARG B 1 318 ? 78.049 -10.615 44.564 1.00 47.32 ? 406 ARG B C 1 ATOM 5054 O O . ARG B 1 318 ? 78.584 -9.666 43.983 1.00 52.65 ? 406 ARG B O 1 ATOM 5055 C CB . ARG B 1 318 ? 76.883 -12.437 43.272 1.00 56.12 ? 406 ARG B CB 1 ATOM 5056 C CG . ARG B 1 318 ? 75.572 -13.218 42.964 1.00 57.28 ? 406 ARG B CG 1 ATOM 5057 C CD . ARG B 1 318 ? 75.860 -14.504 42.161 1.00 36.21 ? 406 ARG B CD 1 ATOM 5058 N NE . ARG B 1 318 ? 76.950 -14.204 41.238 1.00 57.57 ? 406 ARG B NE 1 ATOM 5059 C CZ . ARG B 1 318 ? 78.136 -14.807 41.207 1.00 50.56 ? 406 ARG B CZ 1 ATOM 5060 N NH1 . ARG B 1 318 ? 78.431 -15.831 42.002 1.00 47.11 ? 406 ARG B NH1 1 ATOM 5061 N NH2 . ARG B 1 318 ? 79.029 -14.373 40.347 1.00 53.96 ? 406 ARG B NH2 1 ATOM 5062 N N . SER B 1 319 ? 78.583 -11.198 45.635 1.00 47.76 ? 407 SER B N 1 ATOM 5063 C CA . SER B 1 319 ? 79.884 -10.796 46.179 1.00 54.30 ? 407 SER B CA 1 ATOM 5064 C C . SER B 1 319 ? 80.512 -12.022 46.804 1.00 50.58 ? 407 SER B C 1 ATOM 5065 O O . SER B 1 319 ? 79.792 -12.849 47.380 1.00 54.37 ? 407 SER B O 1 ATOM 5066 C CB . SER B 1 319 ? 79.750 -9.673 47.224 1.00 53.67 ? 407 SER B CB 1 ATOM 5067 O OG . SER B 1 319 ? 78.533 -9.782 47.951 1.00 60.78 ? 407 SER B OG 1 ATOM 5068 N N . GLY B 1 320 ? 81.836 -12.158 46.685 1.00 51.34 ? 408 GLY B N 1 ATOM 5069 C CA . GLY B 1 320 ? 82.509 -13.340 47.211 1.00 47.70 ? 408 GLY B CA 1 ATOM 5070 C C . GLY B 1 320 ? 83.985 -13.141 47.516 1.00 54.43 ? 408 GLY B C 1 ATOM 5071 O O . GLY B 1 320 ? 84.577 -12.145 47.124 1.00 59.12 ? 408 GLY B O 1 ATOM 5072 N N . LEU B 1 321 ? 84.584 -14.102 48.213 1.00 59.73 ? 409 LEU B N 1 ATOM 5073 C CA . LEU B 1 321 ? 85.979 -13.995 48.626 1.00 54.14 ? 409 LEU B CA 1 ATOM 5074 C C . LEU B 1 321 ? 86.916 -14.755 47.708 1.00 59.73 ? 409 LEU B C 1 ATOM 5075 O O . LEU B 1 321 ? 86.528 -15.778 47.129 1.00 61.44 ? 409 LEU B O 1 ATOM 5076 C CB . LEU B 1 321 ? 86.166 -14.596 50.018 1.00 53.22 ? 409 LEU B CB 1 ATOM 5077 C CG . LEU B 1 321 ? 85.968 -13.775 51.279 1.00 59.62 ? 409 LEU B CG 1 ATOM 5078 C CD1 . LEU B 1 321 ? 85.552 -12.347 50.962 1.00 58.25 ? 409 LEU B CD1 1 ATOM 5079 C CD2 . LEU B 1 321 ? 84.931 -14.490 52.114 1.00 46.22 ? 409 LEU B CD2 1 ATOM 5080 N N . TYR B 1 322 ? 88.159 -14.274 47.618 1.00 53.34 ? 410 TYR B N 1 ATOM 5081 C CA . TYR B 1 322 ? 89.255 -15.039 47.015 1.00 52.92 ? 410 TYR B CA 1 ATOM 5082 C C . TYR B 1 322 ? 90.600 -14.710 47.654 1.00 52.85 ? 410 TYR B C 1 ATOM 5083 O O . TYR B 1 322 ? 90.786 -13.620 48.202 1.00 51.14 ? 410 TYR B O 1 ATOM 5084 C CB . TYR B 1 322 ? 89.322 -14.855 45.487 1.00 50.63 ? 410 TYR B CB 1 ATOM 5085 C CG . TYR B 1 322 ? 89.699 -13.470 45.000 1.00 59.67 ? 410 TYR B CG 1 ATOM 5086 C CD1 . TYR B 1 322 ? 88.720 -12.508 44.768 1.00 66.56 ? 410 TYR B CD1 1 ATOM 5087 C CD2 . TYR B 1 322 ? 91.024 -13.133 44.745 1.00 52.87 ? 410 TYR B CD2 1 ATOM 5088 C CE1 . TYR B 1 322 ? 89.047 -11.248 44.313 1.00 62.58 ? 410 TYR B CE1 1 ATOM 5089 C CE2 . TYR B 1 322 ? 91.365 -11.868 44.278 1.00 49.50 ? 410 TYR B CE2 1 ATOM 5090 C CZ . TYR B 1 322 ? 90.364 -10.934 44.063 1.00 60.21 ? 410 TYR B CZ 1 ATOM 5091 O OH . TYR B 1 322 ? 90.670 -9.676 43.603 1.00 64.89 ? 410 TYR B OH 1 ATOM 5092 N N . GLN B 1 323 ? 91.531 -15.661 47.575 1.00 50.62 ? 411 GLN B N 1 ATOM 5093 C CA . GLN B 1 323 ? 92.875 -15.498 48.144 1.00 57.77 ? 411 GLN B CA 1 ATOM 5094 C C . GLN B 1 323 ? 93.995 -15.699 47.123 1.00 64.52 ? 411 GLN B C 1 ATOM 5095 O O . GLN B 1 323 ? 94.217 -16.819 46.657 1.00 75.59 ? 411 GLN B O 1 ATOM 5096 C CB . GLN B 1 323 ? 93.085 -16.464 49.317 1.00 47.52 ? 411 GLN B CB 1 ATOM 5097 C CG . GLN B 1 323 ? 92.259 -16.112 50.539 1.00 62.23 ? 411 GLN B CG 1 ATOM 5098 C CD . GLN B 1 323 ? 92.423 -17.103 51.668 1.00 62.87 ? 411 GLN B CD 1 ATOM 5099 O OE1 . GLN B 1 323 ? 92.087 -18.275 51.532 1.00 65.11 ? 411 GLN B OE1 1 ATOM 5100 N NE2 . GLN B 1 323 ? 92.940 -16.633 52.791 1.00 58.10 ? 411 GLN B NE2 1 ATOM 5101 N N . PRO B 1 324 ? 94.712 -14.617 46.780 1.00 62.19 ? 412 PRO B N 1 ATOM 5102 C CA . PRO B 1 324 ? 95.866 -14.740 45.883 1.00 66.36 ? 412 PRO B CA 1 ATOM 5103 C C . PRO B 1 324 ? 96.962 -15.588 46.524 1.00 75.54 ? 412 PRO B C 1 ATOM 5104 O O . PRO B 1 324 ? 97.174 -15.501 47.736 1.00 68.61 ? 412 PRO B O 1 ATOM 5105 C CB . PRO B 1 324 ? 96.345 -13.294 45.725 1.00 68.05 ? 412 PRO B CB 1 ATOM 5106 C CG . PRO B 1 324 ? 95.158 -12.463 46.069 1.00 77.39 ? 412 PRO B CG 1 ATOM 5107 C CD . PRO B 1 324 ? 94.454 -13.218 47.155 1.00 70.01 ? 412 PRO B CD 1 ATOM 5108 N N . ALA B 1 325 ? 97.637 -16.408 45.722 1.00 82.22 ? 413 ALA B N 1 ATOM 5109 C CA . ALA B 1 325 ? 98.700 -17.260 46.246 1.00 84.04 ? 413 ALA B CA 1 ATOM 5110 C C . ALA B 1 325 ? 100.028 -17.171 45.494 1.00 83.38 ? 413 ALA B C 1 ATOM 5111 O O . ALA B 1 325 ? 100.961 -17.920 45.802 1.00 85.19 ? 413 ALA B O 1 ATOM 5112 C CB . ALA B 1 325 ? 98.225 -18.714 46.331 1.00 83.57 ? 413 ALA B CB 1 ATOM 5113 N N . TYR B 1 326 A 100.124 -16.279 44.509 1.00 88.98 ? 413 TYR B N 1 ATOM 5114 C CA . TYR B 1 326 A 101.426 -16.007 43.881 1.00 96.11 ? 413 TYR B CA 1 ATOM 5115 C C . TYR B 1 326 A 102.147 -14.924 44.704 1.00 113.12 ? 413 TYR B C 1 ATOM 5116 O O . TYR B 1 326 A 101.759 -13.755 44.714 1.00 119.06 ? 413 TYR B O 1 ATOM 5117 C CB . TYR B 1 326 A 101.288 -15.663 42.399 1.00 90.85 ? 413 TYR B CB 1 ATOM 5118 C CG . TYR B 1 326 A 100.334 -14.540 42.037 1.00 89.28 ? 413 TYR B CG 1 ATOM 5119 C CD1 . TYR B 1 326 A 98.954 -14.700 42.126 1.00 80.74 ? 413 TYR B CD1 1 ATOM 5120 C CD2 . TYR B 1 326 A 100.823 -13.323 41.564 1.00 88.04 ? 413 TYR B CD2 1 ATOM 5121 C CE1 . TYR B 1 326 A 98.086 -13.661 41.779 1.00 76.97 ? 413 TYR B CE1 1 ATOM 5122 C CE2 . TYR B 1 326 A 99.971 -12.286 41.219 1.00 85.50 ? 413 TYR B CE2 1 ATOM 5123 C CZ . TYR B 1 326 A 98.604 -12.458 41.325 1.00 82.57 ? 413 TYR B CZ 1 ATOM 5124 O OH . TYR B 1 326 A 97.762 -11.417 40.976 1.00 84.17 ? 413 TYR B OH 1 ATOM 5125 N N . GLU B 1 327 ? 103.191 -15.341 45.413 1.00 120.25 ? 414 GLU B N 1 ATOM 5126 C CA . GLU B 1 327 ? 103.553 -14.692 46.665 1.00 112.16 ? 414 GLU B CA 1 ATOM 5127 C C . GLU B 1 327 ? 104.749 -15.320 47.355 1.00 118.06 ? 414 GLU B C 1 ATOM 5128 O O . GLU B 1 327 ? 104.863 -16.542 47.472 1.00 126.92 ? 414 GLU B O 1 ATOM 5129 C CB . GLU B 1 327 ? 102.349 -14.788 47.641 1.00 157.03 ? 414 GLU B CB 1 ATOM 5130 C CG . GLU B 1 327 ? 102.691 -15.295 49.068 1.00 145.62 ? 414 GLU B CG 1 ATOM 5131 C CD . GLU B 1 327 ? 101.502 -15.913 49.795 1.00 137.27 ? 414 GLU B CD 1 ATOM 5132 O OE1 . GLU B 1 327 ? 100.367 -15.837 49.270 1.00 131.40 ? 414 GLU B OE1 1 ATOM 5133 O OE2 . GLU B 1 327 ? 101.704 -16.482 50.891 1.00 127.42 ? 414 GLU B OE2 1 ATOM 5134 N N . SER B 1 328 ? 105.658 -14.473 47.790 1.00 120.17 ? 415 SER B N 1 ATOM 5135 C CA . SER B 1 328 ? 106.383 -14.763 48.997 1.00 124.60 ? 415 SER B CA 1 ATOM 5136 C C . SER B 1 328 ? 106.174 -13.485 49.776 1.00 124.79 ? 415 SER B C 1 ATOM 5137 O O . SER B 1 328 ? 107.055 -12.621 49.863 1.00 137.44 ? 415 SER B O 1 ATOM 5138 C CB . SER B 1 328 ? 107.856 -15.081 48.768 1.00 135.53 ? 415 SER B CB 1 ATOM 5139 O OG . SER B 1 328 ? 108.280 -14.682 47.477 1.00 143.16 ? 415 SER B OG 1 ATOM 5140 N N . ARG B 1 329 A 104.942 -13.334 50.249 1.00 112.24 ? 415 ARG B N 1 ATOM 5141 C CA . ARG B 1 329 A 104.639 -12.372 51.283 1.00 109.36 ? 415 ARG B CA 1 ATOM 5142 C C . ARG B 1 329 A 105.020 -13.062 52.586 1.00 98.51 ? 415 ARG B C 1 ATOM 5143 O O . ARG B 1 329 A 105.630 -14.132 52.588 1.00 95.65 ? 415 ARG B O 1 ATOM 5144 C CB . ARG B 1 329 A 103.153 -12.004 51.280 1.00 117.58 ? 415 ARG B CB 1 ATOM 5145 C CG . ARG B 1 329 A 102.589 -11.541 49.925 1.00 117.27 ? 415 ARG B CG 1 ATOM 5146 C CD . ARG B 1 329 A 102.495 -10.025 49.805 1.00 115.10 ? 415 ARG B CD 1 ATOM 5147 N NE . ARG B 1 329 A 103.472 -9.527 48.844 1.00 118.49 ? 415 ARG B NE 1 ATOM 5148 C CZ . ARG B 1 329 A 104.344 -8.553 49.088 1.00 118.93 ? 415 ARG B CZ 1 ATOM 5149 N NH1 . ARG B 1 329 A 104.358 -7.947 50.270 1.00 118.92 ? 415 ARG B NH1 1 ATOM 5150 N NH2 . ARG B 1 329 A 105.199 -8.181 48.143 1.00 115.97 ? 415 ARG B NH2 1 ATOM 5151 N N . ASP B 1 330 ? 104.677 -12.454 53.704 1.00 105.66 ? 416 ASP B N 1 ATOM 5152 C CA . ASP B 1 330 ? 105.017 -13.036 54.989 1.00 110.59 ? 416 ASP B CA 1 ATOM 5153 C C . ASP B 1 330 ? 103.714 -13.279 55.699 1.00 102.08 ? 416 ASP B C 1 ATOM 5154 O O . ASP B 1 330 ? 103.671 -13.460 56.916 1.00 108.72 ? 416 ASP B O 1 ATOM 5155 C CB . ASP B 1 330 ? 105.845 -12.032 55.777 1.00 119.59 ? 416 ASP B CB 1 ATOM 5156 C CG . ASP B 1 330 ? 106.018 -10.733 55.030 1.00 127.52 ? 416 ASP B CG 1 ATOM 5157 O OD1 . ASP B 1 330 ? 104.999 -10.056 54.772 1.00 124.99 ? 416 ASP B OD1 1 ATOM 5158 O OD2 . ASP B 1 330 ? 107.169 -10.398 54.680 1.00 130.76 ? 416 ASP B OD2 1 ATOM 5159 N N . CYS B 1 331 ? 102.649 -13.311 54.913 1.00 85.06 ? 417 CYS B N 1 ATOM 5160 C CA . CYS B 1 331 ? 101.322 -13.097 55.452 1.00 85.64 ? 417 CYS B CA 1 ATOM 5161 C C . CYS B 1 331 ? 100.298 -13.251 54.323 1.00 74.16 ? 417 CYS B C 1 ATOM 5162 O O . CYS B 1 331 ? 100.550 -12.830 53.180 1.00 60.73 ? 417 CYS B O 1 ATOM 5163 C CB . CYS B 1 331 ? 101.281 -11.701 56.127 1.00 78.61 ? 417 CYS B CB 1 ATOM 5164 S SG . CYS B 1 331 ? 100.061 -10.547 55.555 1.00 108.88 ? 417 CYS B SG 1 ATOM 5165 N N . GLN B 1 332 ? 99.159 -13.873 54.634 1.00 68.74 ? 418 GLN B N 1 ATOM 5166 C CA . GLN B 1 332 ? 98.195 -14.276 53.600 1.00 63.47 ? 418 GLN B CA 1 ATOM 5167 C C . GLN B 1 332 ? 97.190 -13.178 53.259 1.00 64.33 ? 418 GLN B C 1 ATOM 5168 O O . GLN B 1 332 ? 96.406 -12.758 54.123 1.00 68.19 ? 418 GLN B O 1 ATOM 5169 C CB . GLN B 1 332 ? 97.445 -15.542 54.016 1.00 61.25 ? 418 GLN B CB 1 ATOM 5170 C CG . GLN B 1 332 ? 96.445 -16.048 52.974 1.00 55.79 ? 418 GLN B CG 1 ATOM 5171 C CD . GLN B 1 332 ? 97.101 -16.380 51.650 1.00 62.59 ? 418 GLN B CD 1 ATOM 5172 O OE1 . GLN B 1 332 ? 98.114 -17.090 51.599 1.00 73.53 ? 418 GLN B OE1 1 ATOM 5173 N NE2 . GLN B 1 332 ? 96.533 -15.861 50.568 1.00 53.05 ? 418 GLN B NE2 1 ATOM 5174 N N . GLU B 1 333 ? 97.209 -12.733 51.998 1.00 57.10 ? 419 GLU B N 1 ATOM 5175 C CA . GLU B 1 333 ? 96.308 -11.683 51.533 1.00 50.64 ? 419 GLU B CA 1 ATOM 5176 C C . GLU B 1 333 ? 94.863 -12.184 51.346 1.00 55.66 ? 419 GLU B C 1 ATOM 5177 O O . GLU B 1 333 ? 94.645 -13.367 51.060 1.00 63.63 ? 419 GLU B O 1 ATOM 5178 C CB . GLU B 1 333 ? 96.860 -11.040 50.254 1.00 51.49 ? 419 GLU B CB 1 ATOM 5179 C CG . GLU B 1 333 ? 95.952 -9.984 49.586 1.00 78.30 ? 419 GLU B CG 1 ATOM 5180 C CD . GLU B 1 333 ? 95.764 -8.704 50.407 1.00 84.73 ? 419 GLU B CD 1 ATOM 5181 O OE1 . GLU B 1 333 ? 95.332 -8.787 51.580 1.00 90.35 ? 419 GLU B OE1 1 ATOM 5182 O OE2 . GLU B 1 333 ? 96.037 -7.606 49.869 1.00 87.27 ? 419 GLU B OE2 1 ATOM 5183 N N . LEU B 1 334 ? 93.894 -11.283 51.556 1.00 58.56 ? 420 LEU B N 1 ATOM 5184 C CA . LEU B 1 334 ? 92.460 -11.545 51.344 1.00 53.05 ? 420 LEU B CA 1 ATOM 5185 C C . LEU B 1 334 ? 91.818 -10.514 50.426 1.00 54.56 ? 420 LEU B C 1 ATOM 5186 O O . LEU B 1 334 ? 92.020 -9.309 50.576 1.00 63.33 ? 420 LEU B O 1 ATOM 5187 C CB . LEU B 1 334 ? 91.682 -11.537 52.658 1.00 51.04 ? 420 LEU B CB 1 ATOM 5188 C CG . LEU B 1 334 ? 90.803 -12.768 52.897 1.00 58.20 ? 420 LEU B CG 1 ATOM 5189 C CD1 . LEU B 1 334 ? 89.860 -12.552 54.080 1.00 58.94 ? 420 LEU B CD1 1 ATOM 5190 C CD2 . LEU B 1 334 ? 90.024 -13.144 51.656 1.00 51.29 ? 420 LEU B CD2 1 ATOM 5191 N N . CYS B 1 335 ? 91.022 -10.995 49.483 1.00 54.72 ? 421 CYS B N 1 ATOM 5192 C CA . CYS B 1 335 ? 90.345 -10.112 48.551 1.00 56.37 ? 421 CYS B CA 1 ATOM 5193 C C . CYS B 1 335 ? 88.881 -10.489 48.395 1.00 58.54 ? 421 CYS B C 1 ATOM 5194 O O . CYS B 1 335 ? 88.434 -11.556 48.825 1.00 55.22 ? 421 CYS B O 1 ATOM 5195 C CB . CYS B 1 335 ? 91.010 -10.178 47.178 1.00 53.82 ? 421 CYS B CB 1 ATOM 5196 S SG . CYS B 1 335 ? 92.742 -9.659 47.092 1.00 57.73 ? 421 CYS B SG 1 ATOM 5197 N N . PHE B 1 336 ? 88.127 -9.609 47.761 1.00 55.72 ? 422 PHE B N 1 ATOM 5198 C CA . PHE B 1 336 ? 86.788 -9.999 47.368 1.00 55.82 ? 422 PHE B CA 1 ATOM 5199 C C . PHE B 1 336 ? 86.393 -9.412 46.010 1.00 60.17 ? 422 PHE B C 1 ATOM 5200 O O . PHE B 1 336 ? 86.997 -8.448 45.539 1.00 61.18 ? 422 PHE B O 1 ATOM 5201 C CB . PHE B 1 336 ? 85.766 -9.714 48.483 1.00 63.53 ? 422 PHE B CB 1 ATOM 5202 C CG . PHE B 1 336 ? 85.655 -8.265 48.876 1.00 60.94 ? 422 PHE B CG 1 ATOM 5203 C CD1 . PHE B 1 336 ? 84.799 -7.419 48.187 1.00 61.07 ? 422 PHE B CD1 1 ATOM 5204 C CD2 . PHE B 1 336 ? 86.377 -7.753 49.951 1.00 57.17 ? 422 PHE B CD2 1 ATOM 5205 C CE1 . PHE B 1 336 ? 84.674 -6.086 48.545 1.00 63.49 ? 422 PHE B CE1 1 ATOM 5206 C CE2 . PHE B 1 336 ? 86.258 -6.410 50.313 1.00 64.48 ? 422 PHE B CE2 1 ATOM 5207 C CZ . PHE B 1 336 ? 85.400 -5.581 49.611 1.00 61.69 ? 422 PHE B CZ 1 ATOM 5208 N N . TRP B 1 337 ? 85.426 -10.049 45.359 1.00 59.00 ? 423 TRP B N 1 ATOM 5209 C CA . TRP B 1 337 ? 84.862 -9.527 44.129 1.00 48.67 ? 423 TRP B CA 1 ATOM 5210 C C . TRP B 1 337 ? 83.398 -9.179 44.381 1.00 57.40 ? 423 TRP B C 1 ATOM 5211 O O . TRP B 1 337 ? 82.744 -9.740 45.273 1.00 69.21 ? 423 TRP B O 1 ATOM 5212 C CB . TRP B 1 337 ? 84.982 -10.544 42.988 1.00 53.13 ? 423 TRP B CB 1 ATOM 5213 C CG . TRP B 1 337 ? 84.468 -11.886 43.367 1.00 51.33 ? 423 TRP B CG 1 ATOM 5214 C CD1 . TRP B 1 337 ? 85.204 -12.956 43.782 1.00 55.00 ? 423 TRP B CD1 1 ATOM 5215 C CD2 . TRP B 1 337 ? 83.095 -12.311 43.385 1.00 49.85 ? 423 TRP B CD2 1 ATOM 5216 N NE1 . TRP B 1 337 ? 84.377 -14.027 44.056 1.00 49.44 ? 423 TRP B NE1 1 ATOM 5217 C CE2 . TRP B 1 337 ? 83.078 -13.655 43.826 1.00 45.70 ? 423 TRP B CE2 1 ATOM 5218 C CE3 . TRP B 1 337 ? 81.883 -11.687 43.070 1.00 47.96 ? 423 TRP B CE3 1 ATOM 5219 C CZ2 . TRP B 1 337 ? 81.888 -14.384 43.975 1.00 45.90 ? 423 TRP B CZ2 1 ATOM 5220 C CZ3 . TRP B 1 337 ? 80.702 -12.406 43.213 1.00 51.75 ? 423 TRP B CZ3 1 ATOM 5221 C CH2 . TRP B 1 337 ? 80.713 -13.745 43.660 1.00 55.84 ? 423 TRP B CH2 1 ATOM 5222 N N . ILE B 1 338 ? 82.897 -8.241 43.588 1.00 53.53 ? 424 ILE B N 1 ATOM 5223 C CA . ILE B 1 338 ? 81.498 -7.840 43.610 1.00 51.29 ? 424 ILE B CA 1 ATOM 5224 C C . ILE B 1 338 ? 80.996 -7.818 42.178 1.00 53.36 ? 424 ILE B C 1 ATOM 5225 O O . ILE B 1 338 ? 81.578 -7.141 41.307 1.00 46.56 ? 424 ILE B O 1 ATOM 5226 C CB . ILE B 1 338 ? 81.333 -6.410 44.166 1.00 53.33 ? 424 ILE B CB 1 ATOM 5227 C CG1 . ILE B 1 338 ? 81.928 -6.302 45.566 1.00 48.16 ? 424 ILE B CG1 1 ATOM 5228 C CG2 . ILE B 1 338 ? 79.864 -5.976 44.140 1.00 50.40 ? 424 ILE B CG2 1 ATOM 5229 C CD1 . ILE B 1 338 ? 81.982 -4.896 46.054 1.00 48.68 ? 424 ILE B CD1 1 ATOM 5230 N N . GLU B 1 339 ? 79.925 -8.562 41.926 1.00 57.14 ? 425 GLU B N 1 ATOM 5231 C CA . GLU B 1 339 ? 79.281 -8.534 40.621 1.00 53.72 ? 425 GLU B CA 1 ATOM 5232 C C . GLU B 1 339 ? 78.267 -7.406 40.643 1.00 52.74 ? 425 GLU B C 1 ATOM 5233 O O . GLU B 1 339 ? 77.535 -7.235 41.627 1.00 52.70 ? 425 GLU B O 1 ATOM 5234 C CB . GLU B 1 339 ? 78.606 -9.865 40.321 1.00 57.70 ? 425 GLU B CB 1 ATOM 5235 C CG . GLU B 1 339 ? 78.179 -10.078 38.868 1.00 61.42 ? 425 GLU B CG 1 ATOM 5236 C CD . GLU B 1 339 ? 77.636 -11.485 38.667 1.00 70.40 ? 425 GLU B CD 1 ATOM 5237 O OE1 . GLU B 1 339 ? 76.880 -11.945 39.549 1.00 68.65 ? 425 GLU B OE1 1 ATOM 5238 O OE2 . GLU B 1 339 ? 77.983 -12.142 37.661 1.00 71.77 ? 425 GLU B OE2 1 ATOM 5239 N N . ILE B 1 340 ? 78.251 -6.610 39.576 1.00 52.59 ? 426 ILE B N 1 ATOM 5240 C CA . ILE B 1 340 ? 77.342 -5.475 39.500 1.00 51.18 ? 426 ILE B CA 1 ATOM 5241 C C . ILE B 1 340 ? 76.525 -5.519 38.224 1.00 61.06 ? 426 ILE B C 1 ATOM 5242 O O . ILE B 1 340 ? 76.979 -6.031 37.193 1.00 55.10 ? 426 ILE B O 1 ATOM 5243 C CB . ILE B 1 340 ? 78.088 -4.126 39.581 1.00 59.45 ? 426 ILE B CB 1 ATOM 5244 C CG1 . ILE B 1 340 ? 78.969 -3.921 38.362 1.00 53.69 ? 426 ILE B CG1 1 ATOM 5245 C CG2 . ILE B 1 340 ? 78.931 -4.052 40.851 1.00 70.67 ? 426 ILE B CG2 1 ATOM 5246 C CD1 . ILE B 1 340 ? 79.269 -2.481 38.107 1.00 56.78 ? 426 ILE B CD1 1 ATOM 5247 N N . ALA B 1 341 ? 75.309 -4.992 38.302 1.00 67.13 ? 427 ALA B N 1 ATOM 5248 C CA . ALA B 1 341 ? 74.479 -4.820 37.115 1.00 63.32 ? 427 ALA B CA 1 ATOM 5249 C C . ALA B 1 341 ? 75.119 -3.780 36.215 1.00 70.43 ? 427 ALA B C 1 ATOM 5250 O O . ALA B 1 341 ? 75.697 -2.797 36.689 1.00 77.64 ? 427 ALA B O 1 ATOM 5251 C CB . ALA B 1 341 ? 73.094 -4.380 37.499 1.00 56.39 ? 427 ALA B CB 1 ATOM 5252 N N . ALA B 1 342 ? 75.008 -3.996 34.914 1.00 65.82 ? 428 ALA B N 1 ATOM 5253 C CA . ALA B 1 342 ? 75.619 -3.098 33.956 1.00 74.13 ? 428 ALA B CA 1 ATOM 5254 C C . ALA B 1 342 ? 74.874 -3.131 32.629 1.00 78.70 ? 428 ALA B C 1 ATOM 5255 O O . ALA B 1 342 ? 74.002 -3.981 32.395 1.00 74.18 ? 428 ALA B O 1 ATOM 5256 C CB . ALA B 1 342 ? 77.084 -3.456 33.754 1.00 81.07 ? 428 ALA B CB 1 ATOM 5257 N N . THR B 1 343 ? 75.215 -2.190 31.760 1.00 79.66 ? 429 THR B N 1 ATOM 5258 C CA . THR B 1 343 ? 74.609 -2.148 30.442 1.00 88.10 ? 429 THR B CA 1 ATOM 5259 C C . THR B 1 343 ? 75.709 -2.011 29.412 1.00 87.84 ? 429 THR B C 1 ATOM 5260 O O . THR B 1 343 ? 76.735 -1.355 29.653 1.00 79.83 ? 429 THR B O 1 ATOM 5261 C CB . THR B 1 343 ? 73.606 -0.984 30.291 1.00 86.03 ? 429 THR B CB 1 ATOM 5262 O OG1 . THR B 1 343 ? 73.274 -0.461 31.582 1.00 90.44 ? 429 THR B OG1 1 ATOM 5263 C CG2 . THR B 1 343 ? 72.340 -1.464 29.618 1.00 79.36 ? 429 THR B CG2 1 ATOM 5264 N N . THR B 1 344 ? 75.501 -2.651 28.269 1.00 93.36 ? 430 THR B N 1 ATOM 5265 C CA . THR B 1 344 ? 76.452 -2.560 27.178 1.00 96.41 ? 430 THR B CA 1 ATOM 5266 C C . THR B 1 344 ? 76.142 -1.290 26.368 1.00 96.41 ? 430 THR B C 1 ATOM 5267 O O . THR B 1 344 ? 75.096 -0.671 26.573 1.00 102.25 ? 430 THR B O 1 ATOM 5268 C CB . THR B 1 344 ? 76.410 -3.844 26.326 1.00 91.29 ? 430 THR B CB 1 ATOM 5269 O OG1 . THR B 1 344 ? 77.535 -3.875 25.445 1.00 111.00 ? 430 THR B OG1 1 ATOM 5270 C CG2 . THR B 1 344 ? 75.119 -3.934 25.524 1.00 85.00 ? 430 THR B CG2 1 ATOM 5271 N N . LYS B 1 345 ? 77.056 -0.886 25.485 1.00 97.44 ? 431 LYS B N 1 ATOM 5272 C CA . LYS B 1 345 ? 76.858 0.302 24.638 1.00 99.74 ? 431 LYS B CA 1 ATOM 5273 C C . LYS B 1 345 ? 75.550 0.258 23.835 1.00 84.25 ? 431 LYS B C 1 ATOM 5274 O O . LYS B 1 345 ? 74.869 1.273 23.680 1.00 78.24 ? 431 LYS B O 1 ATOM 5275 C CB . LYS B 1 345 ? 78.058 0.526 23.705 1.00 98.51 ? 431 LYS B CB 1 ATOM 5276 C CG . LYS B 1 345 ? 79.345 0.919 24.435 1.00 117.92 ? 431 LYS B CG 1 ATOM 5277 C CD . LYS B 1 345 ? 80.549 0.956 23.497 1.00 132.94 ? 431 LYS B CD 1 ATOM 5278 C CE . LYS B 1 345 ? 81.850 1.227 24.260 1.00 134.57 ? 431 LYS B CE 1 ATOM 5279 N NZ . LYS B 1 345 ? 83.049 1.292 23.365 1.00 123.13 ? 431 LYS B NZ 1 ATOM 5280 N N . ALA B 1 346 ? 75.189 -0.927 23.356 1.00 74.58 ? 432 ALA B N 1 ATOM 5281 C CA . ALA B 1 346 ? 73.924 -1.120 22.654 1.00 70.75 ? 432 ALA B CA 1 ATOM 5282 C C . ALA B 1 346 ? 72.748 -1.295 23.619 1.00 89.65 ? 432 ALA B C 1 ATOM 5283 O O . ALA B 1 346 ? 71.606 -1.510 23.194 1.00 91.03 ? 432 ALA B O 1 ATOM 5284 C CB . ALA B 1 346 ? 74.022 -2.315 21.717 1.00 72.56 ? 432 ALA B CB 1 ATOM 5285 N N . GLY B 1 347 ? 73.037 -1.224 24.917 1.00 94.14 ? 433 GLY B N 1 ATOM 5286 C CA . GLY B 1 347 ? 71.999 -1.210 25.930 1.00 93.06 ? 433 GLY B CA 1 ATOM 5287 C C . GLY B 1 347 ? 71.313 -2.528 26.253 1.00 103.87 ? 433 GLY B C 1 ATOM 5288 O O . GLY B 1 347 ? 70.103 -2.545 26.505 1.00 102.47 ? 433 GLY B O 1 ATOM 5289 N N . LEU B 1 348 ? 72.064 -3.629 26.245 1.00 104.54 ? 438 LEU B N 1 ATOM 5290 C CA . LEU B 1 348 ? 71.577 -4.881 26.829 1.00 95.63 ? 438 LEU B CA 1 ATOM 5291 C C . LEU B 1 348 ? 72.038 -4.966 28.280 1.00 90.79 ? 438 LEU B C 1 ATOM 5292 O O . LEU B 1 348 ? 73.105 -4.449 28.628 1.00 88.99 ? 438 LEU B O 1 ATOM 5293 C CB . LEU B 1 348 ? 72.130 -6.077 26.081 1.00 93.41 ? 438 LEU B CB 1 ATOM 5294 C CG . LEU B 1 348 ? 71.805 -6.180 24.604 1.00 87.08 ? 438 LEU B CG 1 ATOM 5295 C CD1 . LEU B 1 348 ? 72.831 -7.085 23.939 1.00 75.32 ? 438 LEU B CD1 1 ATOM 5296 C CD2 . LEU B 1 348 ? 70.389 -6.724 24.428 1.00 80.48 ? 438 LEU B CD2 1 ATOM 5297 N N . SER B 1 349 ? 71.241 -5.611 29.127 1.00 88.38 ? 439 SER B N 1 ATOM 5298 C CA . SER B 1 349 ? 71.634 -5.794 30.522 1.00 80.70 ? 439 SER B CA 1 ATOM 5299 C C . SER B 1 349 ? 72.719 -6.858 30.608 1.00 73.60 ? 439 SER B C 1 ATOM 5300 O O . SER B 1 349 ? 72.626 -7.912 29.972 1.00 69.52 ? 439 SER B O 1 ATOM 5301 C CB . SER B 1 349 ? 70.443 -6.207 31.379 1.00 78.82 ? 439 SER B CB 1 ATOM 5302 O OG . SER B 1 349 ? 69.247 -5.648 30.867 1.00 101.55 ? 439 SER B OG 1 ATOM 5303 N N . SER B 1 350 ? 73.760 -6.567 31.377 1.00 72.62 ? 440 SER B N 1 ATOM 5304 C CA . SER B 1 350 ? 74.821 -7.531 31.609 1.00 80.41 ? 440 SER B CA 1 ATOM 5305 C C . SER B 1 350 ? 75.338 -7.329 33.025 1.00 72.42 ? 440 SER B C 1 ATOM 5306 O O . SER B 1 350 ? 74.666 -6.717 33.854 1.00 74.34 ? 440 SER B O 1 ATOM 5307 C CB . SER B 1 350 ? 75.945 -7.377 30.578 1.00 79.58 ? 440 SER B CB 1 ATOM 5308 O OG . SER B 1 350 ? 76.983 -8.331 30.785 1.00 79.33 ? 440 SER B OG 1 ATOM 5309 N N . ASN B 1 351 ? 76.512 -7.874 33.310 1.00 63.01 ? 441 ASN B N 1 ATOM 5310 C CA . ASN B 1 351 ? 77.170 -7.633 34.578 1.00 61.00 ? 441 ASN B CA 1 ATOM 5311 C C . ASN B 1 351 ? 78.612 -7.282 34.306 1.00 63.20 ? 441 ASN B C 1 ATOM 5312 O O . ASN B 1 351 ? 79.105 -7.508 33.198 1.00 68.43 ? 441 ASN B O 1 ATOM 5313 C CB . ASN B 1 351 ? 77.147 -8.891 35.462 1.00 62.78 ? 441 ASN B CB 1 ATOM 5314 C CG . ASN B 1 351 ? 75.761 -9.524 35.573 1.00 65.11 ? 441 ASN B CG 1 ATOM 5315 O OD1 . ASN B 1 351 ? 74.844 -8.956 36.168 1.00 63.43 ? 441 ASN B OD1 1 ATOM 5316 N ND2 . ASN B 1 351 ? 75.617 -10.717 35.021 1.00 64.66 ? 441 ASN B ND2 1 ATOM 5317 N N . ASP B 1 352 ? 79.274 -6.692 35.297 1.00 59.09 ? 442 ASP B N 1 ATOM 5318 C CA . ASP B 1 352 ? 80.688 -7.011 35.506 1.00 77.46 ? 442 ASP B CA 1 ATOM 5319 C C . ASP B 1 352 ? 81.216 -6.841 36.925 1.00 66.35 ? 442 ASP B C 1 ATOM 5320 O O . ASP B 1 352 ? 80.451 -6.931 37.891 1.00 68.93 ? 442 ASP B O 1 ATOM 5321 C CB . ASP B 1 352 ? 81.657 -6.502 34.413 1.00 87.68 ? 442 ASP B CB 1 ATOM 5322 C CG . ASP B 1 352 ? 81.829 -5.020 34.406 1.00 81.95 ? 442 ASP B CG 1 ATOM 5323 O OD1 . ASP B 1 352 ? 80.892 -4.304 34.805 1.00 96.28 ? 442 ASP B OD1 1 ATOM 5324 O OD2 . ASP B 1 352 ? 82.913 -4.599 33.964 1.00 69.38 ? 442 ASP B OD2 1 ATOM 5325 N N . LEU B 1 353 ? 82.523 -6.623 37.035 1.00 68.75 ? 443 LEU B N 1 ATOM 5326 C CA . LEU B 1 353 ? 83.247 -6.974 38.248 1.00 66.06 ? 443 LEU B CA 1 ATOM 5327 C C . LEU B 1 353 ? 84.069 -5.828 38.818 1.00 73.33 ? 443 LEU B C 1 ATOM 5328 O O . LEU B 1 353 ? 84.733 -5.105 38.072 1.00 74.95 ? 443 LEU B O 1 ATOM 5329 C CB . LEU B 1 353 ? 84.191 -8.132 37.920 1.00 53.79 ? 443 LEU B CB 1 ATOM 5330 C CG . LEU B 1 353 ? 84.126 -9.511 38.574 1.00 55.01 ? 443 LEU B CG 1 ATOM 5331 C CD1 . LEU B 1 353 ? 85.526 -9.874 39.013 1.00 44.57 ? 443 LEU B CD1 1 ATOM 5332 C CD2 . LEU B 1 353 ? 83.126 -9.612 39.739 1.00 57.08 ? 443 LEU B CD2 1 ATOM 5333 N N . ILE B 1 354 ? 84.028 -5.676 40.142 1.00 67.25 ? 444 ILE B N 1 ATOM 5334 C CA . ILE B 1 354 ? 84.989 -4.836 40.852 1.00 59.36 ? 444 ILE B CA 1 ATOM 5335 C C . ILE B 1 354 ? 85.630 -5.750 41.899 1.00 57.89 ? 444 ILE B C 1 ATOM 5336 O O . ILE B 1 354 ? 84.937 -6.549 42.526 1.00 61.45 ? 444 ILE B O 1 ATOM 5337 C CB . ILE B 1 354 ? 84.296 -3.606 41.504 1.00 74.14 ? 444 ILE B CB 1 ATOM 5338 C CG1 . ILE B 1 354 ? 83.425 -2.899 40.463 1.00 96.37 ? 444 ILE B CG1 1 ATOM 5339 C CG2 . ILE B 1 354 ? 85.316 -2.605 42.086 1.00 49.37 ? 444 ILE B CG2 1 ATOM 5340 C CD1 . ILE B 1 354 ? 82.117 -2.347 40.992 1.00 109.90 ? 444 ILE B CD1 1 ATOM 5341 N N . THR B 1 355 ? 86.949 -5.677 42.061 1.00 52.97 ? 445 THR B N 1 ATOM 5342 C CA . THR B 1 355 ? 87.614 -6.465 43.101 1.00 54.83 ? 445 THR B CA 1 ATOM 5343 C C . THR B 1 355 ? 88.298 -5.540 44.106 1.00 66.96 ? 445 THR B C 1 ATOM 5344 O O . THR B 1 355 ? 88.854 -4.510 43.728 1.00 72.45 ? 445 THR B O 1 ATOM 5345 C CB . THR B 1 355 ? 88.647 -7.474 42.534 1.00 50.54 ? 445 THR B CB 1 ATOM 5346 O OG1 . THR B 1 355 ? 89.577 -6.788 41.689 1.00 64.97 ? 445 THR B OG1 1 ATOM 5347 C CG2 . THR B 1 355 ? 87.955 -8.584 41.738 1.00 52.88 ? 445 THR B CG2 1 ATOM 5348 N N . PHE B 1 356 ? 88.232 -5.909 45.383 1.00 61.12 ? 446 PHE B N 1 ATOM 5349 C CA . PHE B 1 356 ? 88.909 -5.176 46.448 1.00 59.25 ? 446 PHE B CA 1 ATOM 5350 C C . PHE B 1 356 ? 89.878 -6.115 47.179 1.00 69.22 ? 446 PHE B C 1 ATOM 5351 O O . PHE B 1 356 ? 89.525 -7.274 47.477 1.00 65.40 ? 446 PHE B O 1 ATOM 5352 C CB . PHE B 1 356 ? 87.888 -4.626 47.456 1.00 55.75 ? 446 PHE B CB 1 ATOM 5353 C CG . PHE B 1 356 ? 87.145 -3.415 46.976 1.00 56.45 ? 446 PHE B CG 1 ATOM 5354 C CD1 . PHE B 1 356 ? 87.707 -2.151 47.105 1.00 60.43 ? 446 PHE B CD1 1 ATOM 5355 C CD2 . PHE B 1 356 ? 85.886 -3.532 46.401 1.00 50.01 ? 446 PHE B CD2 1 ATOM 5356 C CE1 . PHE B 1 356 ? 87.033 -1.022 46.663 1.00 59.72 ? 446 PHE B CE1 1 ATOM 5357 C CE2 . PHE B 1 356 ? 85.207 -2.402 45.956 1.00 59.47 ? 446 PHE B CE2 1 ATOM 5358 C CZ . PHE B 1 356 ? 85.782 -1.144 46.090 1.00 59.32 ? 446 PHE B CZ 1 ATOM 5359 N N . CYS B 1 357 ? 91.092 -5.630 47.459 1.00 58.91 ? 447 CYS B N 1 ATOM 5360 C CA . CYS B 1 357 ? 92.044 -6.365 48.310 1.00 55.01 ? 447 CYS B CA 1 ATOM 5361 C C . CYS B 1 357 ? 92.342 -5.625 49.615 1.00 59.49 ? 447 CYS B C 1 ATOM 5362 O O . CYS B 1 357 ? 92.351 -4.385 49.649 1.00 65.12 ? 447 CYS B O 1 ATOM 5363 C CB . CYS B 1 357 ? 93.348 -6.668 47.559 1.00 57.10 ? 447 CYS B CB 1 ATOM 5364 S SG . CYS B 1 357 ? 93.167 -7.868 46.176 1.00 92.90 ? 447 CYS B SG 1 ATOM 5365 N N . GLY B 1 358 ? 92.582 -6.382 50.685 1.00 61.94 ? 448 GLY B N 1 ATOM 5366 C CA . GLY B 1 358 ? 92.890 -5.792 51.979 1.00 58.25 ? 448 GLY B CA 1 ATOM 5367 C C . GLY B 1 358 ? 94.236 -5.074 52.054 1.00 69.49 ? 448 GLY B C 1 ATOM 5368 O O . GLY B 1 358 ? 95.238 -5.541 51.500 1.00 67.45 ? 448 GLY B O 1 ATOM 5369 N N . THR B 1 359 ? 94.258 -3.922 52.726 1.00 75.62 ? 449 THR B N 1 ATOM 5370 C CA . THR B 1 359 ? 95.520 -3.266 53.069 1.00 70.56 ? 449 THR B CA 1 ATOM 5371 C C . THR B 1 359 ? 95.609 -3.110 54.576 1.00 68.32 ? 449 THR B C 1 ATOM 5372 O O . THR B 1 359 ? 94.580 -3.073 55.260 1.00 68.85 ? 449 THR B O 1 ATOM 5373 C CB . THR B 1 359 ? 95.711 -1.897 52.370 1.00 70.91 ? 449 THR B CB 1 ATOM 5374 O OG1 . THR B 1 359 ? 96.794 -1.188 52.993 1.00 88.91 ? 449 THR B OG1 1 ATOM 5375 C CG2 . THR B 1 359 ? 94.446 -1.066 52.460 1.00 66.65 ? 449 THR B CG2 1 ATOM 5376 N N . GLY B 1 360 ? 96.836 -3.034 55.089 1.00 63.87 ? 450 GLY B N 1 ATOM 5377 C CA . GLY B 1 360 ? 97.057 -2.977 56.524 1.00 61.59 ? 450 GLY B CA 1 ATOM 5378 C C . GLY B 1 360 ? 96.638 -1.658 57.149 1.00 64.85 ? 450 GLY B C 1 ATOM 5379 O O . GLY B 1 360 ? 96.255 -1.597 58.321 1.00 64.55 ? 450 GLY B O 1 ATOM 5380 N N . GLY B 1 361 ? 96.703 -0.594 56.359 1.00 65.07 ? 451 GLY B N 1 ATOM 5381 C CA . GLY B 1 361 ? 96.383 0.722 56.867 1.00 64.75 ? 451 GLY B CA 1 ATOM 5382 C C . GLY B 1 361 ? 94.903 1.042 56.846 1.00 69.04 ? 451 GLY B C 1 ATOM 5383 O O . GLY B 1 361 ? 94.125 0.413 56.121 1.00 72.57 ? 451 GLY B O 1 ATOM 5384 N N . SER B 1 362 ? 94.509 2.027 57.648 1.00 79.66 ? 452 SER B N 1 ATOM 5385 C CA . SER B 1 362 ? 93.171 2.596 57.538 1.00 77.44 ? 452 SER B CA 1 ATOM 5386 C C . SER B 1 362 ? 93.078 3.458 56.274 1.00 79.36 ? 452 SER B C 1 ATOM 5387 O O . SER B 1 362 ? 94.093 3.951 55.764 1.00 75.31 ? 452 SER B O 1 ATOM 5388 C CB . SER B 1 362 ? 92.823 3.418 58.776 1.00 63.89 ? 452 SER B CB 1 ATOM 5389 O OG . SER B 1 362 ? 91.540 4.009 58.630 1.00 76.34 ? 452 SER B OG 1 ATOM 5390 N N . MET B 1 363 ? 91.867 3.632 55.759 1.00 70.07 ? 453 MET B N 1 ATOM 5391 C CA . MET B 1 363 ? 91.692 4.337 54.496 1.00 61.35 ? 453 MET B CA 1 ATOM 5392 C C . MET B 1 363 ? 90.687 5.477 54.595 1.00 73.35 ? 453 MET B C 1 ATOM 5393 O O . MET B 1 363 ? 89.780 5.441 55.424 1.00 78.79 ? 453 MET B O 1 ATOM 5394 C CB . MET B 1 363 ? 91.257 3.346 53.414 1.00 57.83 ? 453 MET B CB 1 ATOM 5395 C CG . MET B 1 363 ? 92.276 2.236 53.153 1.00 71.54 ? 453 MET B CG 1 ATOM 5396 S SD . MET B 1 363 ? 93.729 2.831 52.266 1.00 77.62 ? 453 MET B SD 1 ATOM 5397 C CE . MET B 1 363 ? 92.861 3.370 50.808 1.00 55.61 ? 453 MET B CE 1 ATOM 5398 N N . PRO B 1 364 ? 90.856 6.505 53.753 1.00 80.44 ? 454 PRO B N 1 ATOM 5399 C CA . PRO B 1 364 ? 89.894 7.613 53.648 1.00 76.38 ? 454 PRO B CA 1 ATOM 5400 C C . PRO B 1 364 ? 88.610 7.145 52.976 1.00 79.53 ? 454 PRO B C 1 ATOM 5401 O O . PRO B 1 364 ? 88.652 6.144 52.256 1.00 74.76 ? 454 PRO B O 1 ATOM 5402 C CB . PRO B 1 364 ? 90.612 8.603 52.724 1.00 69.65 ? 454 PRO B CB 1 ATOM 5403 C CG . PRO B 1 364 ? 91.512 7.727 51.877 1.00 77.71 ? 454 PRO B CG 1 ATOM 5404 C CD . PRO B 1 364 ? 91.998 6.671 52.833 1.00 77.35 ? 454 PRO B CD 1 ATOM 5405 N N . ASP B 1 365 ? 87.505 7.857 53.190 1.00 71.78 ? 455 ASP B N 1 ATOM 5406 C CA . ASP B 1 365 ? 86.215 7.493 52.590 1.00 80.42 ? 455 ASP B CA 1 ATOM 5407 C C . ASP B 1 365 ? 86.080 7.891 51.109 1.00 89.06 ? 455 ASP B C 1 ATOM 5408 O O . ASP B 1 365 ? 85.571 8.974 50.792 1.00 104.55 ? 455 ASP B O 1 ATOM 5409 C CB . ASP B 1 365 ? 85.064 8.099 53.403 1.00 86.22 ? 455 ASP B CB 1 ATOM 5410 C CG . ASP B 1 365 ? 85.067 7.639 54.850 1.00 107.42 ? 455 ASP B CG 1 ATOM 5411 O OD1 . ASP B 1 365 ? 85.361 6.448 55.091 1.00 113.00 ? 455 ASP B OD1 1 ATOM 5412 O OD2 . ASP B 1 365 ? 84.779 8.464 55.749 1.00 123.27 ? 455 ASP B OD2 1 ATOM 5413 N N . VAL B 1 366 ? 86.512 7.010 50.208 1.00 72.38 ? 456 VAL B N 1 ATOM 5414 C CA . VAL B 1 366 ? 86.395 7.268 48.768 1.00 66.27 ? 456 VAL B CA 1 ATOM 5415 C C . VAL B 1 366 ? 85.310 6.429 48.069 1.00 71.52 ? 456 VAL B C 1 ATOM 5416 O O . VAL B 1 366 ? 85.061 5.290 48.453 1.00 74.98 ? 456 VAL B O 1 ATOM 5417 C CB . VAL B 1 366 ? 87.790 7.198 48.048 1.00 72.38 ? 456 VAL B CB 1 ATOM 5418 C CG1 . VAL B 1 366 ? 88.820 6.512 48.917 1.00 62.90 ? 456 VAL B CG1 1 ATOM 5419 C CG2 . VAL B 1 366 ? 87.711 6.565 46.655 1.00 57.88 ? 456 VAL B CG2 1 ATOM 5420 N N . ASN B 1 367 ? 84.645 7.019 47.071 1.00 72.68 ? 457 ASN B N 1 ATOM 5421 C CA . ASN B 1 367 ? 83.641 6.314 46.291 1.00 56.93 ? 457 ASN B CA 1 ATOM 5422 C C . ASN B 1 367 ? 84.277 5.642 45.075 1.00 65.81 ? 457 ASN B C 1 ATOM 5423 O O . ASN B 1 367 ? 84.717 6.312 44.136 1.00 67.40 ? 457 ASN B O 1 ATOM 5424 C CB . ASN B 1 367 ? 82.554 7.273 45.836 1.00 65.91 ? 457 ASN B CB 1 ATOM 5425 C CG . ASN B 1 367 ? 81.468 6.580 45.043 1.00 78.83 ? 457 ASN B CG 1 ATOM 5426 O OD1 . ASN B 1 367 ? 81.179 5.409 45.275 1.00 82.56 ? 457 ASN B OD1 1 ATOM 5427 N ND2 . ASN B 1 367 ? 80.867 7.297 44.097 1.00 91.10 ? 457 ASN B ND2 1 ATOM 5428 N N . TRP B 1 368 ? 84.316 4.314 45.088 1.00 64.19 ? 458 TRP B N 1 ATOM 5429 C CA . TRP B 1 368 ? 85.030 3.573 44.051 1.00 62.00 ? 458 TRP B CA 1 ATOM 5430 C C . TRP B 1 368 ? 84.149 3.203 42.856 1.00 64.04 ? 458 TRP B C 1 ATOM 5431 O O . TRP B 1 368 ? 84.651 2.688 41.861 1.00 53.63 ? 458 TRP B O 1 ATOM 5432 C CB . TRP B 1 368 ? 85.669 2.315 44.640 1.00 56.26 ? 458 TRP B CB 1 ATOM 5433 C CG . TRP B 1 368 ? 86.740 2.580 45.668 1.00 73.51 ? 458 TRP B CG 1 ATOM 5434 C CD1 . TRP B 1 368 ? 86.670 2.346 47.021 1.00 80.00 ? 458 TRP B CD1 1 ATOM 5435 C CD2 . TRP B 1 368 ? 88.043 3.123 45.425 1.00 70.43 ? 458 TRP B CD2 1 ATOM 5436 N NE1 . TRP B 1 368 ? 87.855 2.702 47.626 1.00 66.50 ? 458 TRP B NE1 1 ATOM 5437 C CE2 . TRP B 1 368 ? 88.713 3.179 46.668 1.00 64.00 ? 458 TRP B CE2 1 ATOM 5438 C CE3 . TRP B 1 368 ? 88.710 3.562 44.276 1.00 76.67 ? 458 TRP B CE3 1 ATOM 5439 C CZ2 . TRP B 1 368 ? 90.015 3.650 46.790 1.00 68.06 ? 458 TRP B CZ2 1 ATOM 5440 C CZ3 . TRP B 1 368 ? 90.002 4.023 44.397 1.00 74.40 ? 458 TRP B CZ3 1 ATOM 5441 C CH2 . TRP B 1 368 ? 90.641 4.070 45.650 1.00 73.47 ? 458 TRP B CH2 1 ATOM 5442 N N . GLY B 1 369 ? 82.846 3.464 42.962 1.00 72.37 ? 459 GLY B N 1 ATOM 5443 C CA . GLY B 1 369 ? 81.900 3.175 41.894 1.00 66.16 ? 459 GLY B CA 1 ATOM 5444 C C . GLY B 1 369 ? 80.449 3.166 42.356 1.00 72.03 ? 459 GLY B C 1 ATOM 5445 O O . GLY B 1 369 ? 80.068 3.851 43.300 1.00 70.84 ? 459 GLY B O 1 ATOM 5446 O OXT . GLY B 1 369 ? 79.589 2.482 41.797 1.00 78.22 ? 459 GLY B OXT 1 ATOM 5447 N N . ALA C 1 6 ? 118.825 -23.201 24.740 1.00 114.12 ? 82 ALA C N 1 ATOM 5448 C CA . ALA C 1 6 ? 119.724 -22.026 24.978 1.00 115.57 ? 82 ALA C CA 1 ATOM 5449 C C . ALA C 1 6 ? 121.024 -22.221 24.164 1.00 109.42 ? 82 ALA C C 1 ATOM 5450 O O . ALA C 1 6 ? 122.137 -22.074 24.787 1.00 113.38 ? 82 ALA C O 1 ATOM 5451 C CB . ALA C 1 6 ? 120.080 -21.888 26.556 1.00 101.77 ? 82 ALA C CB 1 ATOM 5452 N N . THR C 1 7 ? 120.919 -22.560 22.866 1.00 97.87 ? 83 THR C N 1 ATOM 5453 C CA . THR C 1 7 ? 122.096 -22.933 22.075 1.00 99.35 ? 83 THR C CA 1 ATOM 5454 C C . THR C 1 7 ? 122.068 -22.348 20.656 1.00 92.05 ? 83 THR C C 1 ATOM 5455 O O . THR C 1 7 ? 120.985 -22.160 20.083 1.00 87.63 ? 83 THR C O 1 ATOM 5456 C CB . THR C 1 7 ? 122.275 -24.481 22.051 1.00 93.97 ? 83 THR C CB 1 ATOM 5457 O OG1 . THR C 1 7 ? 123.399 -24.840 22.864 1.00 93.63 ? 83 THR C OG1 1 ATOM 5458 C CG2 . THR C 1 7 ? 122.476 -25.032 20.617 1.00 84.75 ? 83 THR C CG2 1 ATOM 5459 N N . PRO C 1 8 ? 123.257 -22.043 20.092 1.00 86.98 ? 84 PRO C N 1 ATOM 5460 C CA . PRO C 1 8 ? 123.322 -21.483 18.736 1.00 87.80 ? 84 PRO C CA 1 ATOM 5461 C C . PRO C 1 8 ? 122.652 -22.372 17.682 1.00 87.49 ? 84 PRO C C 1 ATOM 5462 O O . PRO C 1 8 ? 122.805 -23.604 17.696 1.00 83.25 ? 84 PRO C O 1 ATOM 5463 C CB . PRO C 1 8 ? 124.829 -21.386 18.467 1.00 75.90 ? 84 PRO C CB 1 ATOM 5464 C CG . PRO C 1 8 ? 125.442 -21.278 19.799 1.00 74.51 ? 84 PRO C CG 1 ATOM 5465 C CD . PRO C 1 8 ? 124.597 -22.160 20.693 1.00 78.71 ? 84 PRO C CD 1 ATOM 5466 N N . LEU C 1 9 ? 121.856 -21.741 16.852 1.00 87.77 ? 85 LEU C N 1 ATOM 5467 C CA . LEU C 1 9 ? 121.266 -22.438 15.717 1.00 80.45 ? 85 LEU C CA 1 ATOM 5468 C C . LEU C 1 9 ? 122.340 -22.949 14.756 1.00 87.76 ? 85 LEU C C 1 ATOM 5469 O O . LEU C 1 9 ? 123.228 -22.198 14.316 1.00 84.68 ? 85 LEU C O 1 ATOM 5470 C CB . LEU C 1 9 ? 120.280 -21.526 14.976 1.00 77.36 ? 85 LEU C CB 1 ATOM 5471 C CG . LEU C 1 9 ? 119.407 -22.177 13.888 1.00 70.74 ? 85 LEU C CG 1 ATOM 5472 C CD1 . LEU C 1 9 ? 117.983 -21.675 13.972 1.00 63.55 ? 85 LEU C CD1 1 ATOM 5473 C CD2 . LEU C 1 9 ? 119.968 -21.935 12.489 1.00 58.99 ? 85 LEU C CD2 1 ATOM 5474 N N . VAL C 1 10 ? 122.249 -24.238 14.440 1.00 89.59 ? 86 VAL C N 1 ATOM 5475 C CA . VAL C 1 10 ? 123.190 -24.867 13.526 1.00 91.37 ? 86 VAL C CA 1 ATOM 5476 C C . VAL C 1 10 ? 122.461 -25.715 12.478 1.00 84.55 ? 86 VAL C C 1 ATOM 5477 O O . VAL C 1 10 ? 121.643 -26.584 12.800 1.00 70.38 ? 86 VAL C O 1 ATOM 5478 C CB . VAL C 1 10 ? 124.272 -25.676 14.285 1.00 82.42 ? 86 VAL C CB 1 ATOM 5479 C CG1 . VAL C 1 10 ? 123.638 -26.504 15.387 1.00 90.37 ? 86 VAL C CG1 1 ATOM 5480 C CG2 . VAL C 1 10 ? 125.071 -26.544 13.323 1.00 79.19 ? 86 VAL C CG2 1 ATOM 5481 N N . LEU C 1 11 ? 122.761 -25.424 11.217 1.00 80.59 ? 87 LEU C N 1 ATOM 5482 C CA . LEU C 1 11 ? 122.097 -26.054 10.090 1.00 81.91 ? 87 LEU C CA 1 ATOM 5483 C C . LEU C 1 11 ? 122.843 -27.309 9.655 1.00 85.63 ? 87 LEU C C 1 ATOM 5484 O O . LEU C 1 11 ? 124.060 -27.418 9.857 1.00 92.51 ? 87 LEU C O 1 ATOM 5485 C CB . LEU C 1 11 ? 122.037 -25.075 8.911 1.00 78.48 ? 87 LEU C CB 1 ATOM 5486 C CG . LEU C 1 11 ? 121.401 -23.700 9.127 1.00 75.28 ? 87 LEU C CG 1 ATOM 5487 C CD1 . LEU C 1 11 ? 121.664 -22.804 7.925 1.00 64.36 ? 87 LEU C CD1 1 ATOM 5488 C CD2 . LEU C 1 11 ? 119.905 -23.820 9.381 1.00 78.35 ? 87 LEU C CD2 1 ATOM 5489 N N . GLY C 1 12 ? 122.111 -28.244 9.050 1.00 77.57 ? 88 GLY C N 1 ATOM 5490 C CA . GLY C 1 12 ? 122.710 -29.428 8.460 1.00 77.42 ? 88 GLY C CA 1 ATOM 5491 C C . GLY C 1 12 ? 123.710 -29.065 7.377 1.00 75.02 ? 88 GLY C C 1 ATOM 5492 O O . GLY C 1 12 ? 123.485 -28.151 6.580 1.00 72.86 ? 88 GLY C O 1 ATOM 5493 N N . GLU C 1 13 ? 124.830 -29.774 7.352 1.00 84.08 ? 89 GLU C N 1 ATOM 5494 C CA . GLU C 1 13 ? 125.821 -29.546 6.318 1.00 79.34 ? 89 GLU C CA 1 ATOM 5495 C C . GLU C 1 13 ? 125.347 -30.172 5.019 1.00 77.10 ? 89 GLU C C 1 ATOM 5496 O O . GLU C 1 13 ? 125.716 -29.723 3.924 1.00 84.17 ? 89 GLU C O 1 ATOM 5497 C CB . GLU C 1 13 ? 127.181 -30.110 6.734 1.00 73.52 ? 89 GLU C CB 1 ATOM 5498 C CG . GLU C 1 13 ? 127.804 -29.368 7.903 1.00 80.19 ? 89 GLU C CG 1 ATOM 5499 C CD . GLU C 1 13 ? 128.171 -27.935 7.562 1.00 91.42 ? 89 GLU C CD 1 ATOM 5500 O OE1 . GLU C 1 13 ? 128.509 -27.667 6.381 1.00 91.50 ? 89 GLU C OE1 1 ATOM 5501 O OE2 . GLU C 1 13 ? 128.120 -27.080 8.478 1.00 92.04 ? 89 GLU C OE2 1 ATOM 5502 N N . ASN C 1 14 ? 124.510 -31.197 5.140 1.00 68.96 ? 90 ASN C N 1 ATOM 5503 C CA . ASN C 1 14 ? 124.005 -31.872 3.953 1.00 78.16 ? 90 ASN C CA 1 ATOM 5504 C C . ASN C 1 14 ? 122.501 -31.730 3.707 1.00 73.51 ? 90 ASN C C 1 ATOM 5505 O O . ASN C 1 14 ? 121.665 -32.061 4.562 1.00 73.95 ? 90 ASN C O 1 ATOM 5506 C CB . ASN C 1 14 ? 124.459 -33.334 3.924 1.00 91.03 ? 90 ASN C CB 1 ATOM 5507 C CG . ASN C 1 14 ? 125.796 -33.503 3.229 1.00 102.83 ? 90 ASN C CG 1 ATOM 5508 O OD1 . ASN C 1 14 ? 126.133 -32.753 2.303 1.00 102.99 ? 90 ASN C OD1 1 ATOM 5509 N ND2 . ASN C 1 14 ? 126.569 -34.483 3.672 1.00 98.50 ? 90 ASN C ND2 1 ATOM 5510 N N . LEU C 1 15 ? 122.175 -31.226 2.523 1.00 64.80 ? 91 LEU C N 1 ATOM 5511 C CA . LEU C 1 15 ? 120.790 -31.051 2.116 1.00 73.02 ? 91 LEU C CA 1 ATOM 5512 C C . LEU C 1 15 ? 120.114 -32.388 1.852 1.00 75.52 ? 91 LEU C C 1 ATOM 5513 O O . LEU C 1 15 ? 120.740 -33.315 1.321 1.00 75.99 ? 91 LEU C O 1 ATOM 5514 C CB . LEU C 1 15 ? 120.716 -30.184 0.852 1.00 68.35 ? 91 LEU C CB 1 ATOM 5515 C CG . LEU C 1 15 ? 120.353 -28.714 1.061 1.00 76.00 ? 91 LEU C CG 1 ATOM 5516 C CD1 . LEU C 1 15 ? 120.853 -28.210 2.418 1.00 100.77 ? 91 LEU C CD1 1 ATOM 5517 C CD2 . LEU C 1 15 ? 120.937 -27.884 -0.045 1.00 60.35 ? 91 LEU C CD2 1 ATOM 5518 N N . CYS C 1 16 ? 118.839 -32.480 2.228 1.00 69.92 ? 92 CYS C N 1 ATOM 5519 C CA . CYS C 1 16 ? 118.013 -33.633 1.874 1.00 68.36 ? 92 CYS C CA 1 ATOM 5520 C C . CYS C 1 16 ? 117.920 -33.753 0.358 1.00 86.03 ? 92 CYS C C 1 ATOM 5521 O O . CYS C 1 16 ? 118.069 -32.763 -0.365 1.00 88.22 ? 92 CYS C O 1 ATOM 5522 C CB . CYS C 1 16 ? 116.604 -33.482 2.439 1.00 54.37 ? 92 CYS C CB 1 ATOM 5523 S SG . CYS C 1 16 ? 116.522 -33.251 4.239 1.00 104.56 ? 92 CYS C SG 1 ATOM 5524 N N . SER C 1 17 ? 117.683 -34.960 -0.136 1.00 87.81 ? 93 SER C N 1 ATOM 5525 C CA . SER C 1 17 ? 117.461 -35.103 -1.560 1.00 94.16 ? 93 SER C CA 1 ATOM 5526 C C . SER C 1 17 ? 116.093 -34.541 -1.908 1.00 89.01 ? 93 SER C C 1 ATOM 5527 O O . SER C 1 17 ? 115.137 -34.683 -1.145 1.00 88.32 ? 93 SER C O 1 ATOM 5528 C CB . SER C 1 17 ? 117.581 -36.556 -2.004 1.00 98.06 ? 93 SER C CB 1 ATOM 5529 O OG . SER C 1 17 ? 118.713 -36.719 -2.845 1.00 105.56 ? 93 SER C OG 1 ATOM 5530 N N . ILE C 1 18 ? 116.009 -33.875 -3.051 1.00 84.57 ? 94 ILE C N 1 ATOM 5531 C CA . ILE C 1 18 ? 114.743 -33.318 -3.490 1.00 74.32 ? 94 ILE C CA 1 ATOM 5532 C C . ILE C 1 18 ? 114.428 -33.758 -4.905 1.00 67.79 ? 94 ILE C C 1 ATOM 5533 O O . ILE C 1 18 ? 115.258 -33.620 -5.809 1.00 70.89 ? 94 ILE C O 1 ATOM 5534 C CB . ILE C 1 18 ? 114.742 -31.784 -3.399 1.00 72.83 ? 94 ILE C CB 1 ATOM 5535 C CG1 . ILE C 1 18 ? 114.886 -31.360 -1.934 1.00 71.16 ? 94 ILE C CG1 1 ATOM 5536 C CG2 . ILE C 1 18 ? 113.454 -31.213 -3.984 1.00 65.84 ? 94 ILE C CG2 1 ATOM 5537 C CD1 . ILE C 1 18 ? 115.489 -30.003 -1.759 1.00 68.04 ? 94 ILE C CD1 1 ATOM 5538 N N . ASN C 1 19 ? 113.233 -34.310 -5.092 1.00 64.48 ? 95 ASN C N 1 ATOM 5539 C CA . ASN C 1 19 ? 112.776 -34.667 -6.427 1.00 59.47 ? 95 ASN C CA 1 ATOM 5540 C C . ASN C 1 19 ? 111.369 -34.168 -6.691 1.00 67.48 ? 95 ASN C C 1 ATOM 5541 O O . ASN C 1 19 ? 110.841 -34.323 -7.798 1.00 74.14 ? 95 ASN C O 1 ATOM 5542 C CB . ASN C 1 19 ? 112.888 -36.172 -6.654 1.00 68.41 ? 95 ASN C CB 1 ATOM 5543 C CG . ASN C 1 19 ? 114.324 -36.638 -6.662 1.00 83.40 ? 95 ASN C CG 1 ATOM 5544 O OD1 . ASN C 1 19 ? 114.981 -36.633 -7.703 1.00 87.89 ? 95 ASN C OD1 1 ATOM 5545 N ND2 . ASN C 1 19 ? 114.834 -37.015 -5.490 1.00 82.11 ? 95 ASN C ND2 1 ATOM 5546 N N . GLY C 1 20 ? 110.780 -33.543 -5.675 1.00 70.04 ? 96 GLY C N 1 ATOM 5547 C CA . GLY C 1 20 ? 109.455 -32.971 -5.800 1.00 67.24 ? 96 GLY C CA 1 ATOM 5548 C C . GLY C 1 20 ? 109.227 -31.881 -4.781 1.00 65.00 ? 96 GLY C C 1 ATOM 5549 O O . GLY C 1 20 ? 110.090 -31.604 -3.943 1.00 60.76 ? 96 GLY C O 1 ATOM 5550 N N . TRP C 1 21 ? 108.061 -31.253 -4.852 1.00 67.29 ? 97 TRP C N 1 ATOM 5551 C CA . TRP C 1 21 ? 107.710 -30.208 -3.906 1.00 53.66 ? 97 TRP C CA 1 ATOM 5552 C C . TRP C 1 21 ? 106.236 -30.349 -3.501 1.00 59.87 ? 97 TRP C C 1 ATOM 5553 O O . TRP C 1 21 ? 105.388 -30.711 -4.324 1.00 68.47 ? 97 TRP C O 1 ATOM 5554 C CB . TRP C 1 21 ? 107.982 -28.842 -4.539 1.00 43.75 ? 97 TRP C CB 1 ATOM 5555 C CG . TRP C 1 21 ? 109.400 -28.692 -5.053 1.00 51.63 ? 97 TRP C CG 1 ATOM 5556 C CD1 . TRP C 1 21 ? 109.864 -29.028 -6.304 1.00 52.97 ? 97 TRP C CD1 1 ATOM 5557 C CD2 . TRP C 1 21 ? 110.539 -28.185 -4.331 1.00 43.83 ? 97 TRP C CD2 1 ATOM 5558 N NE1 . TRP C 1 21 ? 111.214 -28.755 -6.400 1.00 55.40 ? 97 TRP C NE1 1 ATOM 5559 C CE2 . TRP C 1 21 ? 111.653 -28.239 -5.207 1.00 50.89 ? 97 TRP C CE2 1 ATOM 5560 C CE3 . TRP C 1 21 ? 110.724 -27.687 -3.037 1.00 44.91 ? 97 TRP C CE3 1 ATOM 5561 C CZ2 . TRP C 1 21 ? 112.932 -27.819 -4.826 1.00 51.20 ? 97 TRP C CZ2 1 ATOM 5562 C CZ3 . TRP C 1 21 ? 111.995 -27.262 -2.661 1.00 45.72 ? 97 TRP C CZ3 1 ATOM 5563 C CH2 . TRP C 1 21 ? 113.082 -27.331 -3.556 1.00 51.71 ? 97 TRP C CH2 1 ATOM 5564 N N . VAL C 1 22 ? 105.940 -30.111 -2.222 1.00 55.33 ? 98 VAL C N 1 ATOM 5565 C CA . VAL C 1 22 ? 104.555 -30.100 -1.734 1.00 61.93 ? 98 VAL C CA 1 ATOM 5566 C C . VAL C 1 22 ? 104.334 -28.818 -0.943 1.00 44.62 ? 98 VAL C C 1 ATOM 5567 O O . VAL C 1 22 ? 105.249 -28.328 -0.280 1.00 46.72 ? 98 VAL C O 1 ATOM 5568 C CB . VAL C 1 22 ? 104.248 -31.317 -0.824 1.00 64.11 ? 98 VAL C CB 1 ATOM 5569 C CG1 . VAL C 1 22 ? 102.765 -31.611 -0.804 1.00 56.46 ? 98 VAL C CG1 1 ATOM 5570 C CG2 . VAL C 1 22 ? 104.976 -32.529 -1.316 1.00 50.36 ? 98 VAL C CG2 1 ATOM 5571 N N . PRO C 1 23 ? 103.134 -28.238 -1.038 1.00 42.76 ? 99 PRO C N 1 ATOM 5572 C CA . PRO C 1 23 ? 102.867 -27.058 -0.198 1.00 53.09 ? 99 PRO C CA 1 ATOM 5573 C C . PRO C 1 23 ? 102.842 -27.346 1.316 1.00 57.82 ? 99 PRO C C 1 ATOM 5574 O O . PRO C 1 23 ? 102.428 -28.415 1.785 1.00 49.89 ? 99 PRO C O 1 ATOM 5575 C CB . PRO C 1 23 ? 101.484 -26.581 -0.659 1.00 46.86 ? 99 PRO C CB 1 ATOM 5576 C CG . PRO C 1 23 ? 100.927 -27.703 -1.509 1.00 58.90 ? 99 PRO C CG 1 ATOM 5577 C CD . PRO C 1 23 ? 102.107 -28.440 -2.070 1.00 53.10 ? 99 PRO C CD 1 ATOM 5578 N N . THR C 1 24 ? 103.294 -26.373 2.089 1.00 58.46 ? 100 THR C N 1 ATOM 5579 C CA . THR C 1 24 ? 103.214 -26.492 3.534 1.00 54.03 ? 100 THR C CA 1 ATOM 5580 C C . THR C 1 24 ? 102.268 -25.437 4.081 1.00 55.76 ? 100 THR C C 1 ATOM 5581 O O . THR C 1 24 ? 101.551 -25.675 5.045 1.00 72.47 ? 100 THR C O 1 ATOM 5582 C CB . THR C 1 24 ? 104.584 -26.344 4.160 1.00 49.26 ? 100 THR C CB 1 ATOM 5583 O OG1 . THR C 1 24 ? 105.211 -25.162 3.646 1.00 68.19 ? 100 THR C OG1 1 ATOM 5584 C CG2 . THR C 1 24 ? 105.429 -27.535 3.776 1.00 52.58 ? 100 THR C CG2 1 ATOM 5585 N N . TYR C 1 25 ? 102.261 -24.275 3.444 1.00 58.59 ? 101 TYR C N 1 ATOM 5586 C CA . TYR C 1 25 ? 101.282 -23.253 3.758 1.00 59.11 ? 101 TYR C CA 1 ATOM 5587 C C . TYR C 1 25 ? 100.657 -22.728 2.480 1.00 58.56 ? 101 TYR C C 1 ATOM 5588 O O . TYR C 1 25 ? 101.330 -22.611 1.443 1.00 59.44 ? 101 TYR C O 1 ATOM 5589 C CB . TYR C 1 25 ? 101.915 -22.106 4.532 1.00 57.30 ? 101 TYR C CB 1 ATOM 5590 C CG . TYR C 1 25 ? 100.958 -20.982 4.788 1.00 54.61 ? 101 TYR C CG 1 ATOM 5591 C CD1 . TYR C 1 25 ? 99.988 -21.094 5.772 1.00 46.44 ? 101 TYR C CD1 1 ATOM 5592 C CD2 . TYR C 1 25 ? 101.017 -19.806 4.045 1.00 44.12 ? 101 TYR C CD2 1 ATOM 5593 C CE1 . TYR C 1 25 ? 99.102 -20.064 6.022 1.00 49.46 ? 101 TYR C CE1 1 ATOM 5594 C CE2 . TYR C 1 25 ? 100.130 -18.764 4.284 1.00 43.51 ? 101 TYR C CE2 1 ATOM 5595 C CZ . TYR C 1 25 ? 99.169 -18.899 5.274 1.00 55.24 ? 101 TYR C CZ 1 ATOM 5596 O OH . TYR C 1 25 ? 98.271 -17.883 5.531 1.00 54.22 ? 101 TYR C OH 1 ATOM 5597 N N . ARG C 1 26 ? 99.366 -22.413 2.555 1.00 51.66 ? 102 ARG C N 1 ATOM 5598 C CA . ARG C 1 26 ? 98.659 -21.863 1.406 1.00 52.05 ? 102 ARG C CA 1 ATOM 5599 C C . ARG C 1 26 ? 97.624 -20.849 1.842 1.00 51.00 ? 102 ARG C C 1 ATOM 5600 O O . ARG C 1 26 ? 96.502 -21.206 2.214 1.00 59.06 ? 102 ARG C O 1 ATOM 5601 C CB . ARG C 1 26 ? 97.996 -22.965 0.585 1.00 52.74 ? 102 ARG C CB 1 ATOM 5602 C CG . ARG C 1 26 ? 97.262 -22.434 -0.617 1.00 53.61 ? 102 ARG C CG 1 ATOM 5603 C CD . ARG C 1 26 ? 96.916 -23.531 -1.584 1.00 51.63 ? 102 ARG C CD 1 ATOM 5604 N NE . ARG C 1 26 ? 95.673 -24.205 -1.246 1.00 61.26 ? 102 ARG C NE 1 ATOM 5605 C CZ . ARG C 1 26 ? 95.119 -25.148 -2.005 1.00 60.35 ? 102 ARG C CZ 1 ATOM 5606 N NH1 . ARG C 1 26 ? 95.713 -25.511 -3.132 1.00 58.35 ? 102 ARG C NH1 1 ATOM 5607 N NH2 . ARG C 1 26 ? 93.974 -25.732 -1.644 1.00 54.33 ? 102 ARG C NH2 1 ATOM 5608 N N . GLY C 1 27 ? 98.002 -19.578 1.788 1.00 51.35 ? 103 GLY C N 1 ATOM 5609 C CA . GLY C 1 27 ? 97.100 -18.512 2.187 1.00 57.66 ? 103 GLY C CA 1 ATOM 5610 C C . GLY C 1 27 ? 95.749 -18.543 1.487 1.00 45.62 ? 103 GLY C C 1 ATOM 5611 O O . GLY C 1 27 ? 95.600 -19.082 0.385 1.00 50.41 ? 103 GLY C O 1 ATOM 5612 N N . GLU C 1 28 ? 94.769 -17.936 2.137 1.00 56.24 ? 104 GLU C N 1 ATOM 5613 C CA . GLU C 1 28 ? 93.378 -17.997 1.718 1.00 63.27 ? 104 GLU C CA 1 ATOM 5614 C C . GLU C 1 28 ? 93.196 -17.333 0.360 1.00 68.43 ? 104 GLU C C 1 ATOM 5615 O O . GLU C 1 28 ? 92.326 -17.729 -0.432 1.00 74.38 ? 104 GLU C O 1 ATOM 5616 C CB . GLU C 1 28 ? 92.502 -17.325 2.792 1.00 78.44 ? 104 GLU C CB 1 ATOM 5617 C CG . GLU C 1 28 ? 91.226 -18.082 3.164 1.00 96.50 ? 104 GLU C CG 1 ATOM 5618 C CD . GLU C 1 28 ? 91.439 -19.580 3.312 1.00 94.32 ? 104 GLU C CD 1 ATOM 5619 O OE1 . GLU C 1 28 ? 92.371 -19.978 4.049 1.00 77.63 ? 104 GLU C OE1 1 ATOM 5620 O OE2 . GLU C 1 28 ? 90.671 -20.358 2.688 1.00 99.59 ? 104 GLU C OE2 1 ATOM 5621 N N . GLY C 1 29 ? 94.039 -16.334 0.093 1.00 62.71 ? 105 GLY C N 1 ATOM 5622 C CA . GLY C 1 29 ? 93.999 -15.595 -1.157 1.00 57.57 ? 105 GLY C CA 1 ATOM 5623 C C . GLY C 1 29 ? 94.456 -16.357 -2.392 1.00 59.64 ? 105 GLY C C 1 ATOM 5624 O O . GLY C 1 29 ? 94.340 -15.857 -3.501 1.00 64.23 ? 105 GLY C O 1 ATOM 5625 N N . THR C 1 30 ? 94.990 -17.557 -2.203 1.00 58.97 ? 106 THR C N 1 ATOM 5626 C CA . THR C 1 30 ? 95.392 -18.394 -3.318 1.00 51.40 ? 106 THR C CA 1 ATOM 5627 C C . THR C 1 30 ? 94.169 -19.058 -3.940 1.00 56.48 ? 106 THR C C 1 ATOM 5628 O O . THR C 1 30 ? 94.168 -19.415 -5.125 1.00 56.61 ? 106 THR C O 1 ATOM 5629 C CB . THR C 1 30 ? 96.312 -19.520 -2.841 1.00 59.09 ? 106 THR C CB 1 ATOM 5630 O OG1 . THR C 1 30 ? 97.439 -18.964 -2.164 1.00 58.34 ? 106 THR C OG1 1 ATOM 5631 C CG2 . THR C 1 30 ? 96.773 -20.388 -4.018 1.00 57.50 ? 106 THR C CG2 1 ATOM 5632 N N . THR C 1 31 ? 93.127 -19.246 -3.139 1.00 58.20 ? 107 THR C N 1 ATOM 5633 C CA . THR C 1 31 ? 91.994 -20.049 -3.592 1.00 58.24 ? 107 THR C CA 1 ATOM 5634 C C . THR C 1 31 ? 90.693 -19.261 -3.512 1.00 59.74 ? 107 THR C C 1 ATOM 5635 O O . THR C 1 31 ? 89.601 -19.797 -3.715 1.00 65.22 ? 107 THR C O 1 ATOM 5636 C CB . THR C 1 31 ? 91.912 -21.412 -2.845 1.00 63.14 ? 107 THR C CB 1 ATOM 5637 O OG1 . THR C 1 31 ? 91.737 -21.202 -1.430 1.00 66.13 ? 107 THR C OG1 1 ATOM 5638 C CG2 . THR C 1 31 ? 93.193 -22.241 -3.117 1.00 52.02 ? 107 THR C CG2 1 ATOM 5639 N N . GLY C 1 32 ? 90.825 -17.971 -3.235 1.00 55.67 ? 108 GLY C N 1 ATOM 5640 C CA . GLY C 1 32 ? 89.659 -17.116 -3.126 1.00 53.40 ? 108 GLY C CA 1 ATOM 5641 C C . GLY C 1 32 ? 90.039 -15.762 -2.566 1.00 60.00 ? 108 GLY C C 1 ATOM 5642 O O . GLY C 1 32 ? 91.202 -15.336 -2.683 1.00 66.50 ? 108 GLY C O 1 ATOM 5643 N N . LYS C 1 33 ? 89.073 -15.080 -1.960 1.00 52.02 ? 109 LYS C N 1 ATOM 5644 C CA . LYS C 1 33 ? 89.355 -13.767 -1.383 1.00 60.59 ? 109 LYS C CA 1 ATOM 5645 C C . LYS C 1 33 ? 89.946 -13.849 0.020 1.00 65.83 ? 109 LYS C C 1 ATOM 5646 O O . LYS C 1 33 ? 89.492 -14.648 0.856 1.00 62.68 ? 109 LYS C O 1 ATOM 5647 C CB . LYS C 1 33 ? 88.084 -12.931 -1.341 1.00 60.21 ? 109 LYS C CB 1 ATOM 5648 C CG . LYS C 1 33 ? 87.274 -13.032 -2.609 1.00 68.88 ? 109 LYS C CG 1 ATOM 5649 C CD . LYS C 1 33 ? 87.577 -11.910 -3.584 1.00 73.60 ? 109 LYS C CD 1 ATOM 5650 C CE . LYS C 1 33 ? 86.729 -12.072 -4.823 1.00 78.14 ? 109 LYS C CE 1 ATOM 5651 N NZ . LYS C 1 33 ? 87.012 -13.393 -5.455 1.00 93.98 ? 109 LYS C NZ 1 ATOM 5652 N N . ILE C 1 34 ? 90.959 -13.023 0.275 1.00 66.01 ? 110 ILE C N 1 ATOM 5653 C CA . ILE C 1 34 ? 91.429 -12.803 1.642 1.00 65.25 ? 110 ILE C CA 1 ATOM 5654 C C . ILE C 1 34 ? 90.349 -12.118 2.479 1.00 65.86 ? 110 ILE C C 1 ATOM 5655 O O . ILE C 1 34 ? 89.767 -11.115 2.039 1.00 63.19 ? 110 ILE C O 1 ATOM 5656 C CB . ILE C 1 34 ? 92.669 -11.900 1.681 1.00 56.82 ? 110 ILE C CB 1 ATOM 5657 C CG1 . ILE C 1 34 ? 93.794 -12.501 0.839 1.00 52.92 ? 110 ILE C CG1 1 ATOM 5658 C CG2 . ILE C 1 34 ? 93.119 -11.683 3.132 1.00 56.14 ? 110 ILE C CG2 1 ATOM 5659 C CD1 . ILE C 1 34 ? 95.093 -11.698 0.895 1.00 52.77 ? 110 ILE C CD1 1 ATOM 5660 N N . PRO C 1 35 ? 90.073 -12.659 3.685 1.00 66.84 ? 111 PRO C N 1 ATOM 5661 C CA . PRO C 1 35 ? 89.171 -12.024 4.662 1.00 66.30 ? 111 PRO C CA 1 ATOM 5662 C C . PRO C 1 35 ? 89.595 -10.594 5.028 1.00 70.29 ? 111 PRO C C 1 ATOM 5663 O O . PRO C 1 35 ? 90.797 -10.293 5.101 1.00 75.98 ? 111 PRO C O 1 ATOM 5664 C CB . PRO C 1 35 ? 89.281 -12.944 5.886 1.00 60.45 ? 111 PRO C CB 1 ATOM 5665 C CG . PRO C 1 35 ? 89.589 -14.283 5.313 1.00 48.58 ? 111 PRO C CG 1 ATOM 5666 C CD . PRO C 1 35 ? 90.506 -13.997 4.132 1.00 62.41 ? 111 PRO C CD 1 ATOM 5667 N N . ASP C 1 36 ? 88.611 -9.728 5.258 1.00 64.61 ? 112 ASP C N 1 ATOM 5668 C CA . ASP C 1 36 ? 88.874 -8.304 5.445 1.00 73.09 ? 112 ASP C CA 1 ATOM 5669 C C . ASP C 1 36 ? 89.560 -8.005 6.784 1.00 77.54 ? 112 ASP C C 1 ATOM 5670 O O . ASP C 1 36 ? 90.186 -6.949 6.951 1.00 70.42 ? 112 ASP C O 1 ATOM 5671 C CB . ASP C 1 36 ? 87.576 -7.493 5.308 1.00 75.61 ? 112 ASP C CB 1 ATOM 5672 C CG . ASP C 1 36 ? 87.022 -7.496 3.883 1.00 88.16 ? 112 ASP C CG 1 ATOM 5673 O OD1 . ASP C 1 36 ? 87.828 -7.532 2.925 1.00 92.39 ? 112 ASP C OD1 1 ATOM 5674 O OD2 . ASP C 1 36 ? 85.777 -7.459 3.720 1.00 93.74 ? 112 ASP C OD2 1 ATOM 5675 N N . GLU C 1 37 ? 89.455 -8.945 7.725 1.00 76.82 ? 113 GLU C N 1 ATOM 5676 C CA . GLU C 1 37 ? 90.012 -8.760 9.065 1.00 77.40 ? 113 GLU C CA 1 ATOM 5677 C C . GLU C 1 37 ? 91.512 -8.930 9.070 1.00 73.04 ? 113 GLU C C 1 ATOM 5678 O O . GLU C 1 37 ? 92.159 -8.632 10.076 1.00 84.30 ? 113 GLU C O 1 ATOM 5679 C CB . GLU C 1 37 ? 89.416 -9.746 10.073 1.00 86.22 ? 113 GLU C CB 1 ATOM 5680 C CG . GLU C 1 37 ? 87.922 -9.935 9.962 1.00 98.80 ? 113 GLU C CG 1 ATOM 5681 C CD . GLU C 1 37 ? 87.567 -11.052 9.009 1.00 110.39 ? 113 GLU C CD 1 ATOM 5682 O OE1 . GLU C 1 37 ? 88.327 -12.045 8.953 1.00 113.91 ? 113 GLU C OE1 1 ATOM 5683 O OE2 . GLU C 1 37 ? 86.540 -10.936 8.312 1.00 115.44 ? 113 GLU C OE2 1 ATOM 5684 N N . GLN C 1 38 ? 92.066 -9.433 7.966 1.00 61.09 ? 114 GLN C N 1 ATOM 5685 C CA . GLN C 1 38 ? 93.517 -9.577 7.874 1.00 54.88 ? 114 GLN C CA 1 ATOM 5686 C C . GLN C 1 38 ? 94.186 -8.235 7.589 1.00 54.92 ? 114 GLN C C 1 ATOM 5687 O O . GLN C 1 38 ? 93.655 -7.393 6.844 1.00 58.38 ? 114 GLN C O 1 ATOM 5688 C CB . GLN C 1 38 ? 93.924 -10.616 6.825 1.00 48.89 ? 114 GLN C CB 1 ATOM 5689 C CG . GLN C 1 38 ? 93.641 -12.058 7.212 1.00 65.36 ? 114 GLN C CG 1 ATOM 5690 C CD . GLN C 1 38 ? 94.192 -13.063 6.198 1.00 72.82 ? 114 GLN C CD 1 ATOM 5691 O OE1 . GLN C 1 38 ? 95.160 -12.786 5.488 1.00 75.82 ? 114 GLN C OE1 1 ATOM 5692 N NE2 . GLN C 1 38 ? 93.571 -14.231 6.129 1.00 64.66 ? 114 GLN C NE2 1 ATOM 5693 N N . MET C 1 39 ? 95.333 -8.028 8.224 1.00 47.81 ? 115 MET C N 1 ATOM 5694 C CA . MET C 1 39 ? 96.251 -6.974 7.833 1.00 58.93 ? 115 MET C CA 1 ATOM 5695 C C . MET C 1 39 ? 96.660 -7.186 6.357 1.00 65.64 ? 115 MET C C 1 ATOM 5696 O O . MET C 1 39 ? 96.940 -8.323 5.930 1.00 66.09 ? 115 MET C O 1 ATOM 5697 C CB . MET C 1 39 ? 97.492 -7.023 8.737 1.00 64.28 ? 115 MET C CB 1 ATOM 5698 C CG . MET C 1 39 ? 98.603 -6.067 8.349 1.00 65.01 ? 115 MET C CG 1 ATOM 5699 S SD . MET C 1 39 ? 98.238 -4.394 8.892 1.00 140.45 ? 115 MET C SD 1 ATOM 5700 C CE . MET C 1 39 ? 98.951 -4.424 10.531 1.00 69.74 ? 115 MET C CE 1 ATOM 5701 N N . LEU C 1 40 ? 96.663 -6.102 5.580 1.00 56.30 ? 116 LEU C N 1 ATOM 5702 C CA . LEU C 1 40 ? 97.184 -6.131 4.218 1.00 54.04 ? 116 LEU C CA 1 ATOM 5703 C C . LEU C 1 40 ? 98.699 -6.213 4.268 1.00 57.22 ? 116 LEU C C 1 ATOM 5704 O O . LEU C 1 40 ? 99.352 -5.358 4.843 1.00 75.10 ? 116 LEU C O 1 ATOM 5705 C CB . LEU C 1 40 ? 96.767 -4.885 3.434 1.00 50.83 ? 116 LEU C CB 1 ATOM 5706 C CG . LEU C 1 40 ? 95.464 -4.952 2.634 1.00 64.02 ? 116 LEU C CG 1 ATOM 5707 C CD1 . LEU C 1 40 ? 94.391 -5.736 3.383 1.00 63.20 ? 116 LEU C CD1 1 ATOM 5708 C CD2 . LEU C 1 40 ? 94.977 -3.549 2.328 1.00 63.41 ? 116 LEU C CD2 1 ATOM 5709 N N . THR C 1 41 ? 99.257 -7.247 3.655 1.00 56.68 ? 117 THR C N 1 ATOM 5710 C CA . THR C 1 41 ? 100.690 -7.487 3.712 1.00 52.70 ? 117 THR C CA 1 ATOM 5711 C C . THR C 1 41 ? 101.376 -7.219 2.378 1.00 57.63 ? 117 THR C C 1 ATOM 5712 O O . THR C 1 41 ? 100.758 -7.330 1.315 1.00 61.71 ? 117 THR C O 1 ATOM 5713 C CB . THR C 1 41 ? 100.972 -8.942 4.069 1.00 47.93 ? 117 THR C CB 1 ATOM 5714 O OG1 . THR C 1 41 ? 100.523 -9.787 2.999 1.00 65.31 ? 117 THR C OG1 1 ATOM 5715 C CG2 . THR C 1 41 ? 100.233 -9.303 5.325 1.00 44.62 ? 117 THR C CG2 1 ATOM 5716 N N . ARG C 1 42 ? 102.658 -6.872 2.454 1.00 54.80 ? 118 ARG C N 1 ATOM 5717 C CA . ARG C 1 42 ? 103.527 -6.791 1.288 1.00 52.60 ? 118 ARG C CA 1 ATOM 5718 C C . ARG C 1 42 ? 104.981 -7.099 1.686 1.00 54.64 ? 118 ARG C C 1 ATOM 5719 O O . ARG C 1 42 ? 105.328 -7.068 2.871 1.00 60.17 ? 118 ARG C O 1 ATOM 5720 C CB . ARG C 1 42 ? 103.400 -5.427 0.586 1.00 55.82 ? 118 ARG C CB 1 ATOM 5721 C CG . ARG C 1 42 ? 103.959 -4.227 1.347 1.00 62.32 ? 118 ARG C CG 1 ATOM 5722 C CD . ARG C 1 42 ? 104.002 -2.993 0.435 1.00 84.72 ? 118 ARG C CD 1 ATOM 5723 N NE . ARG C 1 42 ? 105.100 -2.084 0.765 1.00 105.67 ? 118 ARG C NE 1 ATOM 5724 C CZ . ARG C 1 42 ? 106.351 -2.230 0.332 1.00 118.18 ? 118 ARG C CZ 1 ATOM 5725 N NH1 . ARG C 1 42 ? 106.677 -3.252 -0.447 1.00 116.48 ? 118 ARG C NH1 1 ATOM 5726 N NH2 . ARG C 1 42 ? 107.279 -1.353 0.684 1.00 121.21 ? 118 ARG C NH2 1 ATOM 5727 N N . GLN C 1 43 ? 105.818 -7.396 0.694 1.00 53.92 ? 119 GLN C N 1 ATOM 5728 C CA . GLN C 1 43 ? 107.196 -7.814 0.934 1.00 48.62 ? 119 GLN C CA 1 ATOM 5729 C C . GLN C 1 43 ? 107.235 -9.000 1.918 1.00 49.58 ? 119 GLN C C 1 ATOM 5730 O O . GLN C 1 43 ? 108.020 -9.022 2.869 1.00 45.75 ? 119 GLN C O 1 ATOM 5731 C CB . GLN C 1 43 ? 108.068 -6.637 1.420 1.00 52.33 ? 119 GLN C CB 1 ATOM 5732 C CG . GLN C 1 43 ? 109.559 -6.712 1.008 1.00 65.97 ? 119 GLN C CG 1 ATOM 5733 C CD . GLN C 1 43 ? 110.527 -6.863 2.200 1.00 72.59 ? 119 GLN C CD 1 ATOM 5734 O OE1 . GLN C 1 43 ? 111.385 -6.011 2.427 1.00 81.80 ? 119 GLN C OE1 1 ATOM 5735 N NE2 . GLN C 1 43 ? 110.399 -7.960 2.943 1.00 56.72 ? 119 GLN C NE2 1 ATOM 5736 N N . ASN C 1 44 ? 106.390 -9.998 1.681 1.00 42.74 ? 120 ASN C N 1 ATOM 5737 C CA . ASN C 1 44 ? 106.431 -11.195 2.502 1.00 45.24 ? 120 ASN C CA 1 ATOM 5738 C C . ASN C 1 44 ? 107.700 -12.009 2.266 1.00 55.08 ? 120 ASN C C 1 ATOM 5739 O O . ASN C 1 44 ? 108.289 -11.984 1.185 1.00 70.33 ? 120 ASN C O 1 ATOM 5740 C CB . ASN C 1 44 ? 105.186 -12.053 2.272 1.00 44.37 ? 120 ASN C CB 1 ATOM 5741 C CG . ASN C 1 44 ? 103.909 -11.308 2.580 1.00 57.16 ? 120 ASN C CG 1 ATOM 5742 O OD1 . ASN C 1 44 ? 103.384 -11.394 3.684 1.00 72.80 ? 120 ASN C OD1 1 ATOM 5743 N ND2 . ASN C 1 44 ? 103.407 -10.561 1.605 1.00 69.51 ? 120 ASN C ND2 1 ATOM 5744 N N . PHE C 1 45 ? 108.130 -12.701 3.310 1.00 53.13 ? 121 PHE C N 1 ATOM 5745 C CA . PHE C 1 45 ? 109.172 -13.707 3.201 1.00 47.35 ? 121 PHE C CA 1 ATOM 5746 C C . PHE C 1 45 ? 109.146 -14.543 4.481 1.00 56.83 ? 121 PHE C C 1 ATOM 5747 O O . PHE C 1 45 ? 108.525 -14.170 5.485 1.00 52.29 ? 121 PHE C O 1 ATOM 5748 C CB . PHE C 1 45 ? 110.562 -13.080 2.974 1.00 38.88 ? 121 PHE C CB 1 ATOM 5749 C CG . PHE C 1 45 ? 111.100 -12.356 4.170 1.00 49.08 ? 121 PHE C CG 1 ATOM 5750 C CD1 . PHE C 1 45 ? 110.774 -11.023 4.399 1.00 54.85 ? 121 PHE C CD1 1 ATOM 5751 C CD2 . PHE C 1 45 ? 111.925 -13.014 5.087 1.00 58.09 ? 121 PHE C CD2 1 ATOM 5752 C CE1 . PHE C 1 45 ? 111.273 -10.347 5.524 1.00 57.60 ? 121 PHE C CE1 1 ATOM 5753 C CE2 . PHE C 1 45 ? 112.420 -12.351 6.209 1.00 52.80 ? 121 PHE C CE2 1 ATOM 5754 C CZ . PHE C 1 45 ? 112.099 -11.011 6.424 1.00 50.61 ? 121 PHE C CZ 1 ATOM 5755 N N . VAL C 1 46 ? 109.829 -15.675 4.442 1.00 58.60 ? 122 VAL C N 1 ATOM 5756 C CA . VAL C 1 46 ? 109.804 -16.579 5.561 1.00 46.62 ? 122 VAL C CA 1 ATOM 5757 C C . VAL C 1 46 ? 111.197 -16.723 6.142 1.00 56.93 ? 122 VAL C C 1 ATOM 5758 O O . VAL C 1 46 ? 112.191 -16.856 5.403 1.00 57.50 ? 122 VAL C O 1 ATOM 5759 C CB . VAL C 1 46 ? 109.270 -17.940 5.135 1.00 43.90 ? 122 VAL C CB 1 ATOM 5760 C CG1 . VAL C 1 46 ? 109.319 -18.936 6.295 1.00 48.76 ? 122 VAL C CG1 1 ATOM 5761 C CG2 . VAL C 1 46 ? 107.851 -17.778 4.621 1.00 37.63 ? 122 VAL C CG2 1 ATOM 5762 N N . SER C 1 47 ? 111.269 -16.664 7.470 1.00 42.95 ? 123 SER C N 1 ATOM 5763 C CA . SER C 1 47 ? 112.492 -17.036 8.163 1.00 46.92 ? 123 SER C CA 1 ATOM 5764 C C . SER C 1 47 ? 112.178 -17.929 9.358 1.00 69.08 ? 123 SER C C 1 ATOM 5765 O O . SER C 1 47 ? 111.158 -17.759 10.054 1.00 55.01 ? 123 SER C O 1 ATOM 5766 C CB . SER C 1 47 ? 113.285 -15.817 8.589 1.00 46.00 ? 123 SER C CB 1 ATOM 5767 O OG . SER C 1 47 ? 114.619 -16.198 8.851 1.00 65.35 ? 123 SER C OG 1 ATOM 5768 N N . CYS C 1 48 ? 113.059 -18.893 9.580 1.00 70.91 ? 124 CYS C N 1 ATOM 5769 C CA . CYS C 1 48 ? 112.829 -19.880 10.613 1.00 67.02 ? 124 CYS C CA 1 ATOM 5770 C C . CYS C 1 48 ? 113.817 -19.736 11.758 1.00 56.98 ? 124 CYS C C 1 ATOM 5771 O O . CYS C 1 48 ? 114.978 -19.388 11.543 1.00 60.09 ? 124 CYS C O 1 ATOM 5772 C CB . CYS C 1 48 ? 112.888 -21.279 10.003 1.00 74.85 ? 124 CYS C CB 1 ATOM 5773 S SG . CYS C 1 48 ? 111.530 -21.550 8.853 1.00 74.65 ? 124 CYS C SG 1 ATOM 5774 N N . SER C 1 49 ? 113.328 -19.958 12.977 1.00 69.17 ? 125 SER C N 1 ATOM 5775 C CA . SER C 1 49 ? 114.178 -20.063 14.166 1.00 64.30 ? 125 SER C CA 1 ATOM 5776 C C . SER C 1 49 ? 114.378 -21.536 14.502 1.00 63.33 ? 125 SER C C 1 ATOM 5777 O O . SER C 1 49 ? 114.179 -22.412 13.658 1.00 69.11 ? 125 SER C O 1 ATOM 5778 C CB . SER C 1 49 ? 113.531 -19.362 15.350 1.00 54.55 ? 125 SER C CB 1 ATOM 5779 O OG . SER C 1 49 ? 112.428 -20.116 15.827 1.00 58.23 ? 125 SER C OG 1 ATOM 5780 N N . ASP C 1 50 ? 114.773 -21.813 15.734 1.00 76.87 ? 126 ASP C N 1 ATOM 5781 C CA . ASP C 1 50 ? 114.990 -23.194 16.153 1.00 85.20 ? 126 ASP C CA 1 ATOM 5782 C C . ASP C 1 50 ? 113.723 -23.770 16.783 1.00 80.17 ? 126 ASP C C 1 ATOM 5783 O O . ASP C 1 50 ? 113.698 -24.930 17.184 1.00 86.27 ? 126 ASP C O 1 ATOM 5784 C CB . ASP C 1 50 ? 116.215 -23.315 17.075 1.00 88.73 ? 126 ASP C CB 1 ATOM 5785 C CG . ASP C 1 50 ? 116.107 -22.448 18.343 1.00 102.85 ? 126 ASP C CG 1 ATOM 5786 O OD1 . ASP C 1 50 ? 115.169 -21.620 18.465 1.00 97.13 ? 126 ASP C OD1 1 ATOM 5787 O OD2 . ASP C 1 50 ? 116.985 -22.601 19.227 1.00 107.81 ? 126 ASP C OD2 1 ATOM 5788 N N . LYS C 1 51 ? 112.668 -22.954 16.833 1.00 68.63 ? 127 LYS C N 1 ATOM 5789 C CA . LYS C 1 51 ? 111.367 -23.378 17.355 1.00 69.19 ? 127 LYS C CA 1 ATOM 5790 C C . LYS C 1 51 ? 110.224 -23.322 16.326 1.00 73.90 ? 127 LYS C C 1 ATOM 5791 O O . LYS C 1 51 ? 109.283 -24.110 16.410 1.00 71.53 ? 127 LYS C O 1 ATOM 5792 C CB . LYS C 1 51 ? 110.990 -22.547 18.588 1.00 69.82 ? 127 LYS C CB 1 ATOM 5793 C CG . LYS C 1 51 ? 112.087 -22.454 19.650 1.00 101.38 ? 127 LYS C CG 1 ATOM 5794 C CD . LYS C 1 51 ? 112.490 -23.833 20.188 1.00 113.52 ? 127 LYS C CD 1 ATOM 5795 C CE . LYS C 1 51 ? 113.627 -23.750 21.213 1.00 110.98 ? 127 LYS C CE 1 ATOM 5796 N NZ . LYS C 1 51 ? 114.357 -25.046 21.353 1.00 103.40 ? 127 LYS C NZ 1 ATOM 5797 N N . GLU C 1 52 ? 110.298 -22.397 15.366 1.00 72.15 ? 128 GLU C N 1 ATOM 5798 C CA . GLU C 1 52 ? 109.202 -22.208 14.404 1.00 62.89 ? 128 GLU C CA 1 ATOM 5799 C C . GLU C 1 52 ? 109.629 -21.483 13.118 1.00 64.00 ? 128 GLU C C 1 ATOM 5800 O O . GLU C 1 52 ? 110.753 -20.976 13.009 1.00 62.40 ? 128 GLU C O 1 ATOM 5801 C CB . GLU C 1 52 ? 108.044 -21.436 15.055 1.00 55.27 ? 128 GLU C CB 1 ATOM 5802 C CG . GLU C 1 52 ? 108.500 -20.123 15.667 1.00 63.43 ? 128 GLU C CG 1 ATOM 5803 C CD . GLU C 1 52 ? 107.385 -19.328 16.315 1.00 72.36 ? 128 GLU C CD 1 ATOM 5804 O OE1 . GLU C 1 52 ? 106.335 -19.928 16.650 1.00 76.55 ? 128 GLU C OE1 1 ATOM 5805 O OE2 . GLU C 1 52 ? 107.570 -18.094 16.496 1.00 67.60 ? 128 GLU C OE2 1 ATOM 5806 N N . CYS C 1 53 ? 108.717 -21.436 12.148 1.00 52.45 ? 129 CYS C N 1 ATOM 5807 C CA . CYS C 1 53 ? 108.906 -20.604 10.968 1.00 48.62 ? 129 CYS C CA 1 ATOM 5808 C C . CYS C 1 53 ? 108.040 -19.360 11.120 1.00 57.25 ? 129 CYS C C 1 ATOM 5809 O O . CYS C 1 53 ? 106.870 -19.462 11.508 1.00 62.66 ? 129 CYS C O 1 ATOM 5810 C CB . CYS C 1 53 ? 108.532 -21.378 9.703 1.00 48.32 ? 129 CYS C CB 1 ATOM 5811 S SG . CYS C 1 53 ? 109.783 -22.576 9.244 1.00 74.22 ? 129 CYS C SG 1 ATOM 5812 N N . ARG C 1 54 ? 108.602 -18.182 10.850 1.00 59.16 ? 130 ARG C N 1 ATOM 5813 C CA . ARG C 1 54 ? 107.782 -16.965 10.884 1.00 56.32 ? 130 ARG C CA 1 ATOM 5814 C C . ARG C 1 54 ? 107.656 -16.308 9.520 1.00 59.19 ? 130 ARG C C 1 ATOM 5815 O O . ARG C 1 54 ? 108.577 -16.342 8.693 1.00 62.17 ? 130 ARG C O 1 ATOM 5816 C CB . ARG C 1 54 ? 108.271 -15.939 11.924 1.00 56.13 ? 130 ARG C CB 1 ATOM 5817 C CG . ARG C 1 54 ? 108.158 -16.416 13.367 1.00 50.84 ? 130 ARG C CG 1 ATOM 5818 C CD . ARG C 1 54 ? 108.473 -15.318 14.383 1.00 44.90 ? 130 ARG C CD 1 ATOM 5819 N NE . ARG C 1 54 ? 107.406 -14.312 14.523 1.00 50.73 ? 130 ARG C NE 1 ATOM 5820 C CZ . ARG C 1 54 ? 106.202 -14.534 15.064 1.00 48.38 ? 130 ARG C CZ 1 ATOM 5821 N NH1 . ARG C 1 54 ? 105.874 -15.746 15.505 1.00 39.86 ? 130 ARG C NH1 1 ATOM 5822 N NH2 . ARG C 1 54 ? 105.308 -13.546 15.156 1.00 44.10 ? 130 ARG C NH2 1 ATOM 5823 N N . ARG C 1 55 ? 106.483 -15.723 9.312 1.00 60.00 ? 131 ARG C N 1 ATOM 5824 C CA . ARG C 1 55 ? 106.145 -14.970 8.113 1.00 53.39 ? 131 ARG C CA 1 ATOM 5825 C C . ARG C 1 55 ? 106.363 -13.490 8.416 1.00 56.63 ? 131 ARG C C 1 ATOM 5826 O O . ARG C 1 55 ? 105.547 -12.855 9.106 1.00 56.12 ? 131 ARG C O 1 ATOM 5827 C CB . ARG C 1 55 ? 104.662 -15.172 7.768 1.00 44.83 ? 131 ARG C CB 1 ATOM 5828 C CG . ARG C 1 55 ? 104.346 -14.998 6.308 1.00 52.21 ? 131 ARG C CG 1 ATOM 5829 C CD . ARG C 1 55 ? 103.274 -13.970 6.042 1.00 50.47 ? 131 ARG C CD 1 ATOM 5830 N NE . ARG C 1 55 ? 101.967 -14.590 5.807 1.00 53.95 ? 131 ARG C NE 1 ATOM 5831 C CZ . ARG C 1 55 ? 100.972 -14.051 5.100 1.00 61.07 ? 131 ARG C CZ 1 ATOM 5832 N NH1 . ARG C 1 55 ? 101.113 -12.873 4.513 1.00 45.86 ? 131 ARG C NH1 1 ATOM 5833 N NH2 . ARG C 1 55 ? 99.827 -14.708 4.966 1.00 71.47 ? 131 ARG C NH2 1 ATOM 5834 N N . PHE C 1 56 ? 107.458 -12.942 7.914 1.00 58.92 ? 132 PHE C N 1 ATOM 5835 C CA . PHE C 1 56 ? 107.701 -11.520 8.042 1.00 54.36 ? 132 PHE C CA 1 ATOM 5836 C C . PHE C 1 56 ? 107.095 -10.748 6.883 1.00 56.91 ? 132 PHE C C 1 ATOM 5837 O O . PHE C 1 56 ? 107.001 -11.258 5.760 1.00 56.46 ? 132 PHE C O 1 ATOM 5838 C CB . PHE C 1 56 ? 109.190 -11.276 8.133 1.00 50.32 ? 132 PHE C CB 1 ATOM 5839 C CG . PHE C 1 56 ? 109.769 -11.740 9.414 1.00 59.25 ? 132 PHE C CG 1 ATOM 5840 C CD1 . PHE C 1 56 ? 110.053 -13.084 9.617 1.00 57.67 ? 132 PHE C CD1 1 ATOM 5841 C CD2 . PHE C 1 56 ? 109.986 -10.838 10.444 1.00 49.41 ? 132 PHE C CD2 1 ATOM 5842 C CE1 . PHE C 1 56 ? 110.563 -13.511 10.814 1.00 60.08 ? 132 PHE C CE1 1 ATOM 5843 C CE2 . PHE C 1 56 ? 110.493 -11.261 11.641 1.00 58.91 ? 132 PHE C CE2 1 ATOM 5844 C CZ . PHE C 1 56 ? 110.786 -12.597 11.832 1.00 57.65 ? 132 PHE C CZ 1 ATOM 5845 N N . PHE C 1 57 ? 106.683 -9.518 7.166 1.00 51.83 ? 133 PHE C N 1 ATOM 5846 C CA . PHE C 1 57 ? 106.103 -8.660 6.141 1.00 51.56 ? 133 PHE C CA 1 ATOM 5847 C C . PHE C 1 57 ? 106.020 -7.196 6.574 1.00 61.06 ? 133 PHE C C 1 ATOM 5848 O O . PHE C 1 57 ? 106.250 -6.848 7.749 1.00 56.12 ? 133 PHE C O 1 ATOM 5849 C CB . PHE C 1 57 ? 104.708 -9.148 5.747 1.00 45.14 ? 133 PHE C CB 1 ATOM 5850 C CG . PHE C 1 57 ? 103.725 -9.140 6.875 1.00 62.69 ? 133 PHE C CG 1 ATOM 5851 C CD1 . PHE C 1 57 ? 102.980 -7.997 7.163 1.00 65.56 ? 133 PHE C CD1 1 ATOM 5852 C CD2 . PHE C 1 57 ? 103.531 -10.276 7.649 1.00 65.59 ? 133 PHE C CD2 1 ATOM 5853 C CE1 . PHE C 1 57 ? 102.059 -7.990 8.203 1.00 56.85 ? 133 PHE C CE1 1 ATOM 5854 C CE2 . PHE C 1 57 ? 102.611 -10.273 8.700 1.00 65.72 ? 133 PHE C CE2 1 ATOM 5855 C CZ . PHE C 1 57 ? 101.876 -9.130 8.974 1.00 59.74 ? 133 PHE C CZ 1 ATOM 5856 N N . VAL C 1 58 ? 105.694 -6.347 5.601 1.00 52.66 ? 134 VAL C N 1 ATOM 5857 C CA . VAL C 1 58 ? 105.430 -4.937 5.850 1.00 55.95 ? 134 VAL C CA 1 ATOM 5858 C C . VAL C 1 58 ? 103.937 -4.703 5.632 1.00 56.17 ? 134 VAL C C 1 ATOM 5859 O O . VAL C 1 58 ? 103.350 -5.271 4.717 1.00 64.72 ? 134 VAL C O 1 ATOM 5860 C CB . VAL C 1 58 ? 106.291 -4.044 4.937 1.00 65.62 ? 134 VAL C CB 1 ATOM 5861 C CG1 . VAL C 1 58 ? 105.946 -2.569 5.140 1.00 67.45 ? 134 VAL C CG1 1 ATOM 5862 C CG2 . VAL C 1 58 ? 107.788 -4.304 5.211 1.00 45.76 ? 134 VAL C CG2 1 ATOM 5863 N N . SER C 1 59 ? 103.308 -3.903 6.488 1.00 59.04 ? 135 SER C N 1 ATOM 5864 C CA . SER C 1 59 ? 101.847 -3.763 6.450 1.00 66.93 ? 135 SER C CA 1 ATOM 5865 C C . SER C 1 59 ? 101.393 -2.647 5.517 1.00 91.67 ? 135 SER C C 1 ATOM 5866 O O . SER C 1 59 ? 102.180 -1.762 5.166 1.00 98.09 ? 135 SER C O 1 ATOM 5867 C CB . SER C 1 59 ? 101.333 -3.416 7.818 1.00 63.31 ? 135 SER C CB 1 ATOM 5868 O OG . SER C 1 59 ? 101.839 -2.143 8.167 1.00 85.93 ? 135 SER C OG 1 ATOM 5869 N N . MET C 1 60 ? 100.119 -2.705 5.126 1.00 96.21 ? 136 MET C N 1 ATOM 5870 C CA . MET C 1 60 ? 99.465 -1.653 4.352 1.00 95.73 ? 136 MET C CA 1 ATOM 5871 C C . MET C 1 60 ? 98.135 -1.276 5.023 1.00 104.45 ? 136 MET C C 1 ATOM 5872 O O . MET C 1 60 ? 97.449 -0.348 4.585 1.00 107.42 ? 136 MET C O 1 ATOM 5873 C CB . MET C 1 60 ? 99.204 -2.107 2.912 1.00 91.40 ? 136 MET C CB 1 ATOM 5874 C CG . MET C 1 60 ? 100.422 -2.605 2.142 1.00 91.35 ? 136 MET C CG 1 ATOM 5875 S SD . MET C 1 60 ? 99.966 -3.508 0.639 1.00 152.27 ? 136 MET C SD 1 ATOM 5876 C CE . MET C 1 60 ? 98.921 -2.323 -0.204 1.00 98.75 ? 136 MET C CE 1 ATOM 5877 N N . GLY C 1 61 ? 97.766 -2.011 6.073 1.00 104.52 ? 137 GLY C N 1 ATOM 5878 C CA . GLY C 1 61 ? 96.602 -1.672 6.877 1.00 98.40 ? 137 GLY C CA 1 ATOM 5879 C C . GLY C 1 61 ? 95.372 -2.544 6.707 1.00 95.20 ? 137 GLY C C 1 ATOM 5880 O O . GLY C 1 61 ? 95.468 -3.761 6.560 1.00 101.05 ? 137 GLY C O 1 ATOM 5881 N N . TYR C 1 62 ? 94.204 -1.910 6.725 1.00 92.59 ? 138 TYR C N 1 ATOM 5882 C CA . TYR C 1 62 ? 92.936 -2.632 6.717 1.00 96.95 ? 138 TYR C CA 1 ATOM 5883 C C . TYR C 1 62 ? 91.884 -1.925 5.868 1.00 103.80 ? 138 TYR C C 1 ATOM 5884 O O . TYR C 1 62 ? 92.038 -0.749 5.532 1.00 119.09 ? 138 TYR C O 1 ATOM 5885 C CB . TYR C 1 62 ? 92.399 -2.726 8.147 1.00 99.99 ? 138 TYR C CB 1 ATOM 5886 C CG . TYR C 1 62 ? 93.310 -3.418 9.136 1.00 98.15 ? 138 TYR C CG 1 ATOM 5887 C CD1 . TYR C 1 62 ? 93.265 -4.798 9.294 1.00 99.05 ? 138 TYR C CD1 1 ATOM 5888 C CD2 . TYR C 1 62 ? 94.198 -2.693 9.927 1.00 100.40 ? 138 TYR C CD2 1 ATOM 5889 C CE1 . TYR C 1 62 ? 94.083 -5.441 10.204 1.00 100.06 ? 138 TYR C CE1 1 ATOM 5890 C CE2 . TYR C 1 62 ? 95.026 -3.330 10.843 1.00 96.87 ? 138 TYR C CE2 1 ATOM 5891 C CZ . TYR C 1 62 ? 94.962 -4.709 10.975 1.00 97.46 ? 138 TYR C CZ 1 ATOM 5892 O OH . TYR C 1 62 ? 95.772 -5.371 11.875 1.00 91.98 ? 138 TYR C OH 1 ATOM 5893 N N . GLY C 1 63 ? 90.808 -2.639 5.537 1.00 90.03 ? 139 GLY C N 1 ATOM 5894 C CA . GLY C 1 63 ? 89.634 -2.018 4.941 1.00 87.51 ? 139 GLY C CA 1 ATOM 5895 C C . GLY C 1 63 ? 88.806 -1.263 5.977 1.00 99.80 ? 139 GLY C C 1 ATOM 5896 O O . GLY C 1 63 ? 88.104 -0.292 5.673 1.00 102.06 ? 139 GLY C O 1 ATOM 5897 N N . VAL C 1 73 ? 93.002 1.056 3.982 1.00 140.72 ? 149 VAL C N 1 ATOM 5898 C CA . VAL C 1 73 ? 92.777 2.379 4.565 1.00 148.59 ? 149 VAL C CA 1 ATOM 5899 C C . VAL C 1 73 ? 92.807 2.395 6.111 1.00 148.86 ? 149 VAL C C 1 ATOM 5900 O O . VAL C 1 73 ? 91.775 2.627 6.747 1.00 140.23 ? 149 VAL C O 1 ATOM 5901 C CB . VAL C 1 73 ? 91.434 3.005 4.076 1.00 106.18 ? 149 VAL C CB 1 ATOM 5902 C CG1 . VAL C 1 73 ? 91.634 4.479 3.717 1.00 106.46 ? 149 VAL C CG1 1 ATOM 5903 C CG2 . VAL C 1 73 ? 90.853 2.212 2.883 1.00 84.16 ? 149 VAL C CG2 1 ATOM 5904 N N . SER C 1 74 ? 93.988 2.161 6.699 1.00 151.93 ? 150 SER C N 1 ATOM 5905 C CA . SER C 1 74 ? 94.190 2.197 8.163 1.00 142.67 ? 150 SER C CA 1 ATOM 5906 C C . SER C 1 74 ? 95.659 2.231 8.637 1.00 139.47 ? 150 SER C C 1 ATOM 5907 O O . SER C 1 74 ? 96.302 3.280 8.611 1.00 139.55 ? 150 SER C O 1 ATOM 5908 C CB . SER C 1 74 ? 93.453 1.044 8.861 1.00 135.71 ? 150 SER C CB 1 ATOM 5909 O OG . SER C 1 74 ? 92.060 1.279 8.931 1.00 129.92 ? 150 SER C OG 1 ATOM 5910 N N . GLU C 1 75 ? 96.170 1.078 9.072 1.00 142.04 ? 151 GLU C N 1 ATOM 5911 C CA . GLU C 1 75 ? 97.455 0.976 9.796 1.00 151.10 ? 151 GLU C CA 1 ATOM 5912 C C . GLU C 1 75 ? 98.644 0.446 8.956 1.00 138.16 ? 151 GLU C C 1 ATOM 5913 O O . GLU C 1 75 ? 98.821 -0.769 8.838 1.00 124.02 ? 151 GLU C O 1 ATOM 5914 C CB . GLU C 1 75 ? 97.243 0.060 11.012 1.00 163.44 ? 151 GLU C CB 1 ATOM 5915 C CG . GLU C 1 75 ? 98.291 0.118 12.104 1.00 166.70 ? 151 GLU C CG 1 ATOM 5916 C CD . GLU C 1 75 ? 97.779 -0.489 13.402 1.00 164.64 ? 151 GLU C CD 1 ATOM 5917 O OE1 . GLU C 1 75 ? 96.856 0.086 14.015 1.00 156.94 ? 151 GLU C OE1 1 ATOM 5918 O OE2 . GLU C 1 75 ? 98.311 -1.542 13.814 1.00 164.22 ? 151 GLU C OE2 1 ATOM 5919 N N . GLN C 1 76 ? 99.473 1.350 8.418 1.00 136.69 ? 152 GLN C N 1 ATOM 5920 C CA . GLN C 1 76 ? 100.571 0.986 7.493 1.00 137.45 ? 152 GLN C CA 1 ATOM 5921 C C . GLN C 1 76 ? 102.000 1.077 8.062 1.00 137.14 ? 152 GLN C C 1 ATOM 5922 O O . GLN C 1 76 ? 102.206 1.047 9.274 1.00 147.63 ? 152 GLN C O 1 ATOM 5923 C CB . GLN C 1 76 ? 100.531 1.870 6.237 1.00 136.33 ? 152 GLN C CB 1 ATOM 5924 C CG . GLN C 1 76 ? 99.155 2.121 5.645 1.00 138.50 ? 152 GLN C CG 1 ATOM 5925 C CD . GLN C 1 76 ? 98.432 3.275 6.305 1.00 140.70 ? 152 GLN C CD 1 ATOM 5926 O OE1 . GLN C 1 76 ? 98.918 3.858 7.275 1.00 147.15 ? 152 GLN C OE1 1 ATOM 5927 N NE2 . GLN C 1 76 ? 97.261 3.611 5.780 1.00 129.86 ? 152 GLN C NE2 1 ATOM 5928 N N . MET C 1 77 ? 102.970 1.141 7.144 1.00 121.56 ? 156 MET C N 1 ATOM 5929 C CA . MET C 1 77 ? 104.339 1.623 7.392 1.00 105.43 ? 156 MET C CA 1 ATOM 5930 C C . MET C 1 77 ? 105.271 0.854 8.362 1.00 89.07 ? 156 MET C C 1 ATOM 5931 O O . MET C 1 77 ? 106.393 1.300 8.638 1.00 72.18 ? 156 MET C O 1 ATOM 5932 C CB . MET C 1 77 ? 104.298 3.124 7.763 1.00 115.77 ? 156 MET C CB 1 ATOM 5933 C CG . MET C 1 77 ? 104.204 3.416 9.255 1.00 126.49 ? 156 MET C CG 1 ATOM 5934 S SD . MET C 1 77 ? 103.241 4.882 9.657 1.00 219.54 ? 156 MET C SD 1 ATOM 5935 C CE . MET C 1 77 ? 101.978 4.149 10.698 1.00 80.21 ? 156 MET C CE 1 ATOM 5936 N N . ASN C 1 78 ? 104.833 -0.294 8.871 1.00 85.63 ? 157 ASN C N 1 ATOM 5937 C CA . ASN C 1 78 ? 105.638 -1.020 9.866 1.00 72.05 ? 157 ASN C CA 1 ATOM 5938 C C . ASN C 1 78 ? 105.982 -2.451 9.477 1.00 68.18 ? 157 ASN C C 1 ATOM 5939 O O . ASN C 1 78 ? 105.389 -3.008 8.546 1.00 68.20 ? 157 ASN C O 1 ATOM 5940 C CB . ASN C 1 78 ? 104.949 -1.006 11.241 1.00 59.37 ? 157 ASN C CB 1 ATOM 5941 C CG . ASN C 1 78 ? 104.963 0.364 11.875 1.00 75.72 ? 157 ASN C CG 1 ATOM 5942 O OD1 . ASN C 1 78 ? 106.023 0.977 12.028 1.00 86.81 ? 157 ASN C OD1 1 ATOM 5943 N ND2 . ASN C 1 78 ? 103.789 0.867 12.227 1.00 80.71 ? 157 ASN C ND2 1 ATOM 5944 N N . VAL C 1 79 ? 106.949 -3.037 10.186 1.00 58.78 ? 158 VAL C N 1 ATOM 5945 C CA . VAL C 1 79 ? 107.310 -4.448 9.985 1.00 52.80 ? 158 VAL C CA 1 ATOM 5946 C C . VAL C 1 79 ? 106.661 -5.359 11.021 1.00 52.37 ? 158 VAL C C 1 ATOM 5947 O O . VAL C 1 79 ? 106.668 -5.072 12.224 1.00 64.02 ? 158 VAL C O 1 ATOM 5948 C CB . VAL C 1 79 ? 108.838 -4.685 9.992 1.00 57.67 ? 158 VAL C CB 1 ATOM 5949 C CG1 . VAL C 1 79 ? 109.140 -6.113 9.544 1.00 50.36 ? 158 VAL C CG1 1 ATOM 5950 C CG2 . VAL C 1 79 ? 109.553 -3.676 9.075 1.00 39.68 ? 158 VAL C CG2 1 ATOM 5951 N N . TYR C 1 80 ? 106.081 -6.451 10.546 1.00 51.24 ? 159 TYR C N 1 ATOM 5952 C CA . TYR C 1 80 ? 105.407 -7.396 11.427 1.00 48.92 ? 159 TYR C CA 1 ATOM 5953 C C . TYR C 1 80 ? 105.856 -8.805 11.113 1.00 51.65 ? 159 TYR C C 1 ATOM 5954 O O . TYR C 1 80 ? 106.491 -9.049 10.085 1.00 52.24 ? 159 TYR C O 1 ATOM 5955 C CB . TYR C 1 80 ? 103.885 -7.309 11.256 1.00 38.63 ? 159 TYR C CB 1 ATOM 5956 C CG . TYR C 1 80 ? 103.305 -5.992 11.701 1.00 54.16 ? 159 TYR C CG 1 ATOM 5957 C CD1 . TYR C 1 80 ? 103.254 -4.896 10.834 1.00 47.51 ? 159 TYR C CD1 1 ATOM 5958 C CD2 . TYR C 1 80 ? 102.805 -5.835 12.993 1.00 57.10 ? 159 TYR C CD2 1 ATOM 5959 C CE1 . TYR C 1 80 ? 102.716 -3.684 11.245 1.00 63.09 ? 159 TYR C CE1 1 ATOM 5960 C CE2 . TYR C 1 80 ? 102.270 -4.624 13.411 1.00 50.95 ? 159 TYR C CE2 1 ATOM 5961 C CZ . TYR C 1 80 ? 102.225 -3.552 12.538 1.00 67.93 ? 159 TYR C CZ 1 ATOM 5962 O OH . TYR C 1 80 ? 101.690 -2.351 12.955 1.00 74.12 ? 159 TYR C OH 1 ATOM 5963 N N . SER C 1 81 ? 105.524 -9.729 12.007 1.00 61.82 ? 160 SER C N 1 ATOM 5964 C CA . SER C 1 81 ? 105.687 -11.148 11.734 1.00 55.16 ? 160 SER C CA 1 ATOM 5965 C C . SER C 1 81 ? 104.494 -11.862 12.336 1.00 47.79 ? 160 SER C C 1 ATOM 5966 O O . SER C 1 81 ? 103.845 -11.321 13.238 1.00 53.19 ? 160 SER C O 1 ATOM 5967 C CB . SER C 1 81 ? 107.001 -11.688 12.309 1.00 47.44 ? 160 SER C CB 1 ATOM 5968 O OG . SER C 1 81 ? 106.990 -11.673 13.723 1.00 61.91 ? 160 SER C OG 1 ATOM 5969 N N . VAL C 1 82 ? 104.184 -13.046 11.804 1.00 47.09 ? 161 VAL C N 1 ATOM 5970 C CA . VAL C 1 82 ? 103.292 -13.999 12.466 1.00 55.30 ? 161 VAL C CA 1 ATOM 5971 C C . VAL C 1 82 ? 103.945 -15.367 12.399 1.00 57.26 ? 161 VAL C C 1 ATOM 5972 O O . VAL C 1 82 ? 104.907 -15.570 11.659 1.00 59.02 ? 161 VAL C O 1 ATOM 5973 C CB . VAL C 1 82 ? 101.895 -14.084 11.809 1.00 56.87 ? 161 VAL C CB 1 ATOM 5974 C CG1 . VAL C 1 82 ? 101.162 -12.744 11.918 1.00 44.41 ? 161 VAL C CG1 1 ATOM 5975 C CG2 . VAL C 1 82 ? 102.024 -14.538 10.359 1.00 49.66 ? 161 VAL C CG2 1 ATOM 5976 N N . LYS C 1 83 ? 103.449 -16.308 13.184 1.00 61.27 ? 162 LYS C N 1 ATOM 5977 C CA . LYS C 1 83 ? 103.944 -17.662 13.056 1.00 58.46 ? 162 LYS C CA 1 ATOM 5978 C C . LYS C 1 83 ? 103.394 -18.153 11.733 1.00 57.73 ? 162 LYS C C 1 ATOM 5979 O O . LYS C 1 83 ? 102.190 -17.999 11.477 1.00 45.77 ? 162 LYS C O 1 ATOM 5980 C CB . LYS C 1 83 ? 103.418 -18.520 14.198 1.00 54.20 ? 162 LYS C CB 1 ATOM 5981 C CG . LYS C 1 83 ? 104.006 -19.905 14.284 1.00 62.91 ? 162 LYS C CG 1 ATOM 5982 C CD . LYS C 1 83 ? 103.083 -20.756 15.123 1.00 73.81 ? 162 LYS C CD 1 ATOM 5983 C CE . LYS C 1 83 ? 103.740 -22.030 15.611 1.00 82.53 ? 162 LYS C CE 1 ATOM 5984 N NZ . LYS C 1 83 ? 102.781 -22.763 16.493 1.00 87.96 ? 162 LYS C NZ 1 ATOM 5985 N N . LEU C 1 84 ? 104.261 -18.691 10.873 1.00 58.40 ? 163 LEU C N 1 ATOM 5986 C CA . LEU C 1 84 ? 103.796 -19.250 9.595 1.00 56.28 ? 163 LEU C CA 1 ATOM 5987 C C . LEU C 1 84 ? 102.729 -20.314 9.834 1.00 52.40 ? 163 LEU C C 1 ATOM 5988 O O . LEU C 1 84 ? 102.979 -21.305 10.526 1.00 52.72 ? 163 LEU C O 1 ATOM 5989 C CB . LEU C 1 84 ? 104.943 -19.856 8.793 1.00 50.58 ? 163 LEU C CB 1 ATOM 5990 C CG . LEU C 1 84 ? 104.501 -20.524 7.482 1.00 50.39 ? 163 LEU C CG 1 ATOM 5991 C CD1 . LEU C 1 84 ? 104.050 -19.499 6.438 1.00 46.22 ? 163 LEU C CD1 1 ATOM 5992 C CD2 . LEU C 1 84 ? 105.621 -21.399 6.924 1.00 52.90 ? 163 LEU C CD2 1 ATOM 5993 N N . GLY C 1 85 ? 101.544 -20.099 9.265 1.00 54.36 ? 164 GLY C N 1 ATOM 5994 C CA . GLY C 1 85 ? 100.416 -21.002 9.447 1.00 46.04 ? 164 GLY C CA 1 ATOM 5995 C C . GLY C 1 85 ? 99.249 -20.228 10.016 1.00 59.74 ? 164 GLY C C 1 ATOM 5996 O O . GLY C 1 85 ? 98.084 -20.621 9.874 1.00 58.13 ? 164 GLY C O 1 ATOM 5997 N N . ASP C 1 86 ? 99.589 -19.118 10.675 1.00 66.25 ? 165 ASP C N 1 ATOM 5998 C CA . ASP C 1 86 ? 98.627 -18.233 11.319 1.00 61.59 ? 165 ASP C CA 1 ATOM 5999 C C . ASP C 1 86 ? 98.294 -17.101 10.364 1.00 60.85 ? 165 ASP C C 1 ATOM 6000 O O . ASP C 1 86 ? 99.162 -16.636 9.621 1.00 68.42 ? 165 ASP C O 1 ATOM 6001 C CB . ASP C 1 86 ? 99.223 -17.655 12.610 1.00 67.55 ? 165 ASP C CB 1 ATOM 6002 C CG . ASP C 1 86 ? 99.209 -18.647 13.774 1.00 79.77 ? 165 ASP C CG 1 ATOM 6003 O OD1 . ASP C 1 86 ? 98.949 -19.856 13.558 1.00 79.28 ? 165 ASP C OD1 1 ATOM 6004 O OD2 . ASP C 1 86 ? 99.470 -18.207 14.916 1.00 80.04 ? 165 ASP C OD2 1 ATOM 6005 N N . PRO C 1 87 ? 97.032 -16.655 10.376 1.00 63.63 ? 166 PRO C N 1 ATOM 6006 C CA . PRO C 1 87 ? 96.616 -15.496 9.581 1.00 62.28 ? 166 PRO C CA 1 ATOM 6007 C C . PRO C 1 87 ? 97.154 -14.214 10.215 1.00 65.84 ? 166 PRO C C 1 ATOM 6008 O O . PRO C 1 87 ? 97.375 -14.177 11.431 1.00 62.06 ? 166 PRO C O 1 ATOM 6009 C CB . PRO C 1 87 ? 95.097 -15.526 9.720 1.00 59.80 ? 166 PRO C CB 1 ATOM 6010 C CG . PRO C 1 87 ? 94.880 -16.081 11.107 1.00 64.52 ? 166 PRO C CG 1 ATOM 6011 C CD . PRO C 1 87 ? 95.956 -17.131 11.268 1.00 63.83 ? 166 PRO C CD 1 ATOM 6012 N N . PRO C 1 88 ? 97.396 -13.178 9.399 1.00 66.87 ? 167 PRO C N 1 ATOM 6013 C CA . PRO C 1 88 ? 97.776 -11.883 9.971 1.00 65.99 ? 167 PRO C CA 1 ATOM 6014 C C . PRO C 1 88 ? 96.561 -11.078 10.409 1.00 62.20 ? 167 PRO C C 1 ATOM 6015 O O . PRO C 1 88 ? 96.285 -10.007 9.868 1.00 55.55 ? 167 PRO C O 1 ATOM 6016 C CB . PRO C 1 88 ? 98.500 -11.182 8.819 1.00 72.00 ? 167 PRO C CB 1 ATOM 6017 C CG . PRO C 1 88 ? 97.902 -11.790 7.584 1.00 69.88 ? 167 PRO C CG 1 ATOM 6018 C CD . PRO C 1 88 ? 97.595 -13.223 7.938 1.00 63.47 ? 167 PRO C CD 1 ATOM 6019 N N . THR C 1 89 ? 95.843 -11.622 11.385 1.00 70.53 ? 168 THR C N 1 ATOM 6020 C CA . THR C 1 89 ? 94.829 -10.894 12.137 1.00 66.04 ? 168 THR C CA 1 ATOM 6021 C C . THR C 1 89 ? 95.536 -10.122 13.245 1.00 59.87 ? 168 THR C C 1 ATOM 6022 O O . THR C 1 89 ? 96.625 -10.514 13.663 1.00 64.11 ? 168 THR C O 1 ATOM 6023 C CB . THR C 1 89 ? 93.831 -11.883 12.754 1.00 73.55 ? 168 THR C CB 1 ATOM 6024 O OG1 . THR C 1 89 ? 94.546 -12.867 13.521 1.00 89.78 ? 168 THR C OG1 1 ATOM 6025 C CG2 . THR C 1 89 ? 93.041 -12.573 11.655 1.00 62.37 ? 168 THR C CG2 1 ATOM 6026 N N . PRO C 1 90 ? 94.923 -9.025 13.721 1.00 63.71 ? 169 PRO C N 1 ATOM 6027 C CA . PRO C 1 90 ? 95.492 -8.205 14.810 1.00 68.76 ? 169 PRO C CA 1 ATOM 6028 C C . PRO C 1 90 ? 95.965 -9.031 16.007 1.00 66.64 ? 169 PRO C C 1 ATOM 6029 O O . PRO C 1 90 ? 96.971 -8.706 16.650 1.00 70.37 ? 169 PRO C O 1 ATOM 6030 C CB . PRO C 1 90 ? 94.311 -7.323 15.238 1.00 61.02 ? 169 PRO C CB 1 ATOM 6031 C CG . PRO C 1 90 ? 93.492 -7.164 13.976 1.00 65.87 ? 169 PRO C CG 1 ATOM 6032 C CD . PRO C 1 90 ? 93.698 -8.428 13.151 1.00 61.17 ? 169 PRO C CD 1 ATOM 6033 N N . ASP C 1 91 ? 95.232 -10.099 16.295 1.00 73.37 ? 170 ASP C N 1 ATOM 6034 C CA . ASP C 1 91 ? 95.519 -10.955 17.438 1.00 80.94 ? 170 ASP C CA 1 ATOM 6035 C C . ASP C 1 91 ? 96.833 -11.706 17.258 1.00 70.71 ? 170 ASP C C 1 ATOM 6036 O O . ASP C 1 91 ? 97.493 -12.054 18.228 1.00 64.83 ? 170 ASP C O 1 ATOM 6037 C CB . ASP C 1 91 ? 94.369 -11.951 17.642 1.00 112.65 ? 170 ASP C CB 1 ATOM 6038 C CG . ASP C 1 91 ? 92.993 -11.292 17.548 1.00 141.17 ? 170 ASP C CG 1 ATOM 6039 O OD1 . ASP C 1 91 ? 92.915 -10.117 17.127 1.00 147.85 ? 170 ASP C OD1 1 ATOM 6040 O OD2 . ASP C 1 91 ? 91.987 -11.953 17.885 1.00 150.40 ? 170 ASP C OD2 1 ATOM 6041 N N . LYS C 1 92 A 97.225 -11.955 16.016 1.00 65.31 ? 170 LYS C N 1 ATOM 6042 C CA . LYS C 1 92 A 98.390 -12.800 15.777 1.00 64.43 ? 170 LYS C CA 1 ATOM 6043 C C . LYS C 1 92 A 99.673 -12.011 15.440 1.00 64.77 ? 170 LYS C C 1 ATOM 6044 O O . LYS C 1 92 A 100.760 -12.593 15.331 1.00 65.70 ? 170 LYS C O 1 ATOM 6045 C CB . LYS C 1 92 A 98.067 -13.834 14.696 1.00 66.02 ? 170 LYS C CB 1 ATOM 6046 C CG . LYS C 1 92 A 96.996 -14.839 15.101 1.00 54.39 ? 170 LYS C CG 1 ATOM 6047 C CD . LYS C 1 92 A 97.439 -15.689 16.285 1.00 62.52 ? 170 LYS C CD 1 ATOM 6048 C CE . LYS C 1 92 A 96.404 -16.757 16.609 1.00 67.22 ? 170 LYS C CE 1 ATOM 6049 N NZ . LYS C 1 92 A 95.029 -16.176 16.586 1.00 74.50 ? 170 LYS C NZ 1 ATOM 6050 N N . LEU C 1 93 ? 99.543 -10.689 15.311 1.00 67.14 ? 171 LEU C N 1 ATOM 6051 C CA . LEU C 1 93 ? 100.642 -9.819 14.866 1.00 65.10 ? 171 LEU C CA 1 ATOM 6052 C C . LEU C 1 93 ? 101.680 -9.552 15.947 1.00 64.91 ? 171 LEU C C 1 ATOM 6053 O O . LEU C 1 93 ? 101.327 -9.102 17.039 1.00 76.43 ? 171 LEU C O 1 ATOM 6054 C CB . LEU C 1 93 ? 100.085 -8.470 14.417 1.00 64.98 ? 171 LEU C CB 1 ATOM 6055 C CG . LEU C 1 93 ? 99.851 -8.259 12.925 1.00 71.92 ? 171 LEU C CG 1 ATOM 6056 C CD1 . LEU C 1 93 ? 99.384 -9.534 12.280 1.00 71.48 ? 171 LEU C CD1 1 ATOM 6057 C CD2 . LEU C 1 93 ? 98.826 -7.169 12.693 1.00 81.71 ? 171 LEU C CD2 1 ATOM 6058 N N . LYS C 1 94 ? 102.949 -9.828 15.647 1.00 60.39 ? 172 LYS C N 1 ATOM 6059 C CA . LYS C 1 94 ? 104.060 -9.321 16.457 1.00 50.14 ? 172 LYS C CA 1 ATOM 6060 C C . LYS C 1 94 ? 104.656 -8.128 15.722 1.00 57.03 ? 172 LYS C C 1 ATOM 6061 O O . LYS C 1 94 ? 105.099 -8.253 14.575 1.00 66.92 ? 172 LYS C O 1 ATOM 6062 C CB . LYS C 1 94 ? 105.132 -10.402 16.671 1.00 42.23 ? 172 LYS C CB 1 ATOM 6063 C CG . LYS C 1 94 ? 106.476 -9.902 17.260 1.00 49.38 ? 172 LYS C CG 1 ATOM 6064 C CD . LYS C 1 94 ? 107.186 -11.045 18.027 1.00 58.91 ? 172 LYS C CD 1 ATOM 6065 C CE . LYS C 1 94 ? 108.714 -10.942 18.051 1.00 68.78 ? 172 LYS C CE 1 ATOM 6066 N NZ . LYS C 1 94 ? 109.358 -12.261 17.681 1.00 77.88 ? 172 LYS C NZ 1 ATOM 6067 N N . PHE C 1 95 ? 104.636 -6.965 16.359 1.00 52.45 ? 173 PHE C N 1 ATOM 6068 C CA . PHE C 1 95 ? 105.293 -5.782 15.801 1.00 57.01 ? 173 PHE C CA 1 ATOM 6069 C C . PHE C 1 95 ? 106.818 -5.948 15.884 1.00 58.68 ? 173 PHE C C 1 ATOM 6070 O O . PHE C 1 95 ? 107.344 -6.495 16.856 1.00 56.46 ? 173 PHE C O 1 ATOM 6071 C CB . PHE C 1 95 ? 104.828 -4.525 16.541 1.00 56.85 ? 173 PHE C CB 1 ATOM 6072 C CG . PHE C 1 95 ? 105.651 -3.313 16.257 1.00 66.37 ? 173 PHE C CG 1 ATOM 6073 C CD1 . PHE C 1 95 ? 105.472 -2.591 15.080 1.00 70.89 ? 173 PHE C CD1 1 ATOM 6074 C CD2 . PHE C 1 95 ? 106.592 -2.879 17.170 1.00 76.60 ? 173 PHE C CD2 1 ATOM 6075 C CE1 . PHE C 1 95 ? 106.227 -1.467 14.819 1.00 56.82 ? 173 PHE C CE1 1 ATOM 6076 C CE2 . PHE C 1 95 ? 107.351 -1.751 16.910 1.00 77.16 ? 173 PHE C CE2 1 ATOM 6077 C CZ . PHE C 1 95 ? 107.165 -1.049 15.731 1.00 65.93 ? 173 PHE C CZ 1 ATOM 6078 N N . GLU C 1 96 ? 107.531 -5.491 14.862 1.00 69.77 ? 174 GLU C N 1 ATOM 6079 C CA . GLU C 1 96 ? 108.942 -5.837 14.747 1.00 64.70 ? 174 GLU C CA 1 ATOM 6080 C C . GLU C 1 96 ? 109.889 -4.641 14.645 1.00 70.38 ? 174 GLU C C 1 ATOM 6081 O O . GLU C 1 96 ? 110.947 -4.613 15.293 1.00 70.87 ? 174 GLU C O 1 ATOM 6082 C CB . GLU C 1 96 ? 109.141 -6.795 13.570 1.00 56.69 ? 174 GLU C CB 1 ATOM 6083 C CG . GLU C 1 96 ? 108.562 -8.189 13.813 1.00 64.01 ? 174 GLU C CG 1 ATOM 6084 C CD . GLU C 1 96 ? 109.485 -9.084 14.650 1.00 76.07 ? 174 GLU C CD 1 ATOM 6085 O OE1 . GLU C 1 96 ? 110.522 -8.577 15.165 1.00 72.54 ? 174 GLU C OE1 1 ATOM 6086 O OE2 . GLU C 1 96 ? 109.174 -10.302 14.779 1.00 68.28 ? 174 GLU C OE2 1 ATOM 6087 N N . ALA C 1 97 ? 109.508 -3.656 13.838 1.00 73.50 ? 175 ALA C N 1 ATOM 6088 C CA . ALA C 1 97 ? 110.379 -2.517 13.557 1.00 73.57 ? 175 ALA C CA 1 ATOM 6089 C C . ALA C 1 97 ? 109.628 -1.461 12.768 1.00 66.94 ? 175 ALA C C 1 ATOM 6090 O O . ALA C 1 97 ? 108.491 -1.673 12.357 1.00 68.78 ? 175 ALA C O 1 ATOM 6091 C CB . ALA C 1 97 ? 111.634 -2.964 12.782 1.00 70.34 ? 175 ALA C CB 1 ATOM 6092 N N . VAL C 1 98 ? 110.278 -0.324 12.560 1.00 73.28 ? 176 VAL C N 1 ATOM 6093 C CA . VAL C 1 98 ? 109.768 0.692 11.655 1.00 71.86 ? 176 VAL C CA 1 ATOM 6094 C C . VAL C 1 98 ? 110.523 0.553 10.346 1.00 71.66 ? 176 VAL C C 1 ATOM 6095 O O . VAL C 1 98 ? 111.753 0.477 10.342 1.00 77.30 ? 176 VAL C O 1 ATOM 6096 C CB . VAL C 1 98 ? 110.007 2.091 12.211 1.00 66.92 ? 176 VAL C CB 1 ATOM 6097 C CG1 . VAL C 1 98 ? 109.107 3.105 11.512 1.00 71.02 ? 176 VAL C CG1 1 ATOM 6098 C CG2 . VAL C 1 98 ? 109.754 2.094 13.705 1.00 66.65 ? 176 VAL C CG2 1 ATOM 6099 N N . GLY C 1 99 ? 109.789 0.492 9.241 1.00 68.32 ? 177 GLY C N 1 ATOM 6100 C CA . GLY C 1 99 ? 110.419 0.417 7.941 1.00 66.49 ? 177 GLY C CA 1 ATOM 6101 C C . GLY C 1 99 ? 109.488 0.005 6.828 1.00 68.20 ? 177 GLY C C 1 ATOM 6102 O O . GLY C 1 99 ? 108.326 -0.337 7.082 1.00 77.18 ? 177 GLY C O 1 ATOM 6103 N N . TRP C 1 100 ? 110.000 0.039 5.596 1.00 69.83 ? 178 TRP C N 1 ATOM 6104 C CA . TRP C 1 100 ? 109.255 -0.432 4.423 1.00 74.86 ? 178 TRP C CA 1 ATOM 6105 C C . TRP C 1 100 ? 109.933 -1.652 3.834 1.00 71.81 ? 178 TRP C C 1 ATOM 6106 O O . TRP C 1 100 ? 109.406 -2.289 2.926 1.00 85.22 ? 178 TRP C O 1 ATOM 6107 C CB . TRP C 1 100 ? 109.163 0.644 3.337 1.00 80.10 ? 178 TRP C CB 1 ATOM 6108 C CG . TRP C 1 100 ? 109.762 1.966 3.686 1.00 97.02 ? 178 TRP C CG 1 ATOM 6109 C CD1 . TRP C 1 100 ? 111.094 2.276 3.769 1.00 103.28 ? 178 TRP C CD1 1 ATOM 6110 C CD2 . TRP C 1 100 ? 109.047 3.184 3.964 1.00 115.33 ? 178 TRP C CD2 1 ATOM 6111 N NE1 . TRP C 1 100 ? 111.248 3.605 4.101 1.00 118.80 ? 178 TRP C NE1 1 ATOM 6112 C CE2 . TRP C 1 100 ? 110.008 4.183 4.222 1.00 128.32 ? 178 TRP C CE2 1 ATOM 6113 C CE3 . TRP C 1 100 ? 107.685 3.523 4.021 1.00 99.18 ? 178 TRP C CE3 1 ATOM 6114 C CZ2 . TRP C 1 100 ? 109.650 5.500 4.535 1.00 128.40 ? 178 TRP C CZ2 1 ATOM 6115 C CZ3 . TRP C 1 100 ? 107.335 4.826 4.330 1.00 94.25 ? 178 TRP C CZ3 1 ATOM 6116 C CH2 . TRP C 1 100 ? 108.311 5.797 4.583 1.00 112.28 ? 178 TRP C CH2 1 ATOM 6117 N N . SER C 1 101 ? 111.110 -1.973 4.352 1.00 66.19 ? 179 SER C N 1 ATOM 6118 C CA . SER C 1 101 ? 111.912 -3.036 3.766 1.00 64.80 ? 179 SER C CA 1 ATOM 6119 C C . SER C 1 101 ? 112.691 -3.749 4.873 1.00 63.18 ? 179 SER C C 1 ATOM 6120 O O . SER C 1 101 ? 113.404 -3.119 5.665 1.00 59.09 ? 179 SER C O 1 ATOM 6121 C CB . SER C 1 101 ? 112.850 -2.453 2.702 1.00 49.35 ? 179 SER C CB 1 ATOM 6122 O OG . SER C 1 101 ? 113.826 -3.402 2.264 1.00 63.19 ? 179 SER C OG 1 ATOM 6123 N N . ALA C 1 102 ? 112.538 -5.064 4.940 1.00 58.51 ? 180 ALA C N 1 ATOM 6124 C CA . ALA C 1 102 ? 113.164 -5.817 6.013 1.00 57.51 ? 180 ALA C CA 1 ATOM 6125 C C . ALA C 1 102 ? 113.722 -7.159 5.573 1.00 57.57 ? 180 ALA C C 1 ATOM 6126 O O . ALA C 1 102 ? 113.218 -7.799 4.655 1.00 69.14 ? 180 ALA C O 1 ATOM 6127 C CB . ALA C 1 102 ? 112.194 -5.996 7.201 1.00 47.86 ? 180 ALA C CB 1 ATOM 6128 N N . SER C 1 103 ? 114.786 -7.559 6.246 1.00 59.45 ? 181 SER C N 1 ATOM 6129 C CA . SER C 1 103 ? 115.277 -8.920 6.213 1.00 61.78 ? 181 SER C CA 1 ATOM 6130 C C . SER C 1 103 ? 115.339 -9.383 7.680 1.00 58.96 ? 181 SER C C 1 ATOM 6131 O O . SER C 1 103 ? 115.606 -8.572 8.584 1.00 54.73 ? 181 SER C O 1 ATOM 6132 C CB . SER C 1 103 ? 116.657 -8.935 5.564 1.00 54.42 ? 181 SER C CB 1 ATOM 6133 O OG . SER C 1 103 ? 117.127 -10.255 5.371 1.00 66.54 ? 181 SER C OG 1 ATOM 6134 N N . SER C 1 104 ? 115.062 -10.659 7.946 1.00 54.06 ? 182 SER C N 1 ATOM 6135 C CA . SER C 1 104 ? 115.276 -11.188 9.312 1.00 57.51 ? 182 SER C CA 1 ATOM 6136 C C . SER C 1 104 ? 115.968 -12.552 9.335 1.00 53.23 ? 182 SER C C 1 ATOM 6137 O O . SER C 1 104 ? 115.982 -13.253 8.324 1.00 65.62 ? 182 SER C O 1 ATOM 6138 C CB . SER C 1 104 ? 113.970 -11.256 10.107 1.00 63.65 ? 182 SER C CB 1 ATOM 6139 O OG . SER C 1 104 ? 113.104 -12.219 9.545 1.00 63.41 ? 182 SER C OG 1 ATOM 6140 N N . CYS C 1 105 ? 116.541 -12.901 10.486 1.00 59.44 ? 183 CYS C N 1 ATOM 6141 C CA . CYS C 1 105 ? 117.224 -14.182 10.698 1.00 58.49 ? 183 CYS C CA 1 ATOM 6142 C C . CYS C 1 105 ? 117.213 -14.501 12.205 1.00 62.53 ? 183 CYS C C 1 ATOM 6143 O O . CYS C 1 105 ? 116.991 -13.600 13.016 1.00 65.14 ? 183 CYS C O 1 ATOM 6144 C CB . CYS C 1 105 ? 118.630 -14.269 10.122 1.00 46.32 ? 183 CYS C CB 1 ATOM 6145 S SG . CYS C 1 105 ? 119.325 -12.719 9.473 1.00 73.59 ? 183 CYS C SG 1 ATOM 6146 N N . HIS C 1 106 ? 117.451 -15.759 12.594 1.00 58.80 ? 184 HIS C N 1 ATOM 6147 C CA . HIS C 1 106 ? 117.492 -16.129 14.027 1.00 62.92 ? 184 HIS C CA 1 ATOM 6148 C C . HIS C 1 106 ? 118.699 -17.021 14.340 1.00 65.09 ? 184 HIS C C 1 ATOM 6149 O O . HIS C 1 106 ? 118.924 -18.021 13.657 1.00 66.61 ? 184 HIS C O 1 ATOM 6150 C CB . HIS C 1 106 ? 116.189 -16.811 14.429 1.00 63.69 ? 184 HIS C CB 1 ATOM 6151 C CG . HIS C 1 106 ? 116.040 -17.021 15.910 1.00 69.24 ? 184 HIS C CG 1 ATOM 6152 N ND1 . HIS C 1 106 ? 116.774 -17.946 16.602 1.00 71.74 ? 184 HIS C ND1 1 ATOM 6153 C CD2 . HIS C 1 106 ? 115.211 -16.426 16.798 1.00 65.19 ? 184 HIS C CD2 1 ATOM 6154 C CE1 . HIS C 1 106 ? 116.420 -17.906 17.887 1.00 71.90 ? 184 HIS C CE1 1 ATOM 6155 N NE2 . HIS C 1 106 ? 115.481 -16.994 18.025 1.00 64.47 ? 184 HIS C NE2 1 ATOM 6156 N N . ASP C 1 107 ? 119.455 -16.684 15.386 1.00 61.86 ? 185 ASP C N 1 ATOM 6157 C CA . ASP C 1 107 ? 120.747 -17.348 15.630 1.00 62.79 ? 185 ASP C CA 1 ATOM 6158 C C . ASP C 1 107 ? 120.677 -18.426 16.707 1.00 70.77 ? 185 ASP C C 1 ATOM 6159 O O . ASP C 1 107 ? 121.680 -19.064 17.007 1.00 74.24 ? 185 ASP C O 1 ATOM 6160 C CB . ASP C 1 107 ? 121.845 -16.335 15.999 1.00 53.45 ? 185 ASP C CB 1 ATOM 6161 C CG . ASP C 1 107 ? 121.496 -15.515 17.235 1.00 66.20 ? 185 ASP C CG 1 ATOM 6162 O OD1 . ASP C 1 107 ? 120.504 -15.852 17.938 1.00 55.39 ? 185 ASP C OD1 1 ATOM 6163 O OD2 . ASP C 1 107 ? 122.231 -14.532 17.508 1.00 79.96 ? 185 ASP C OD2 1 ATOM 6164 N N . GLY C 1 108 ? 119.497 -18.621 17.289 1.00 68.99 ? 186 GLY C N 1 ATOM 6165 C CA . GLY C 1 108 ? 119.331 -19.582 18.365 1.00 75.12 ? 186 GLY C CA 1 ATOM 6166 C C . GLY C 1 108 ? 118.984 -18.867 19.656 1.00 72.07 ? 186 GLY C C 1 ATOM 6167 O O . GLY C 1 108 ? 118.317 -19.421 20.542 1.00 56.63 ? 186 GLY C O 1 ATOM 6168 N N . PHE C 1 109 ? 119.430 -17.617 19.745 1.00 65.65 ? 187 PHE C N 1 ATOM 6169 C CA . PHE C 1 109 ? 119.153 -16.770 20.901 1.00 61.51 ? 187 PHE C CA 1 ATOM 6170 C C . PHE C 1 109 ? 118.018 -15.803 20.601 1.00 68.74 ? 187 PHE C C 1 ATOM 6171 O O . PHE C 1 109 ? 116.949 -15.886 21.207 1.00 67.66 ? 187 PHE C O 1 ATOM 6172 C CB . PHE C 1 109 ? 120.421 -16.021 21.319 1.00 54.60 ? 187 PHE C CB 1 ATOM 6173 C CG . PHE C 1 109 ? 121.633 -16.899 21.360 1.00 76.45 ? 187 PHE C CG 1 ATOM 6174 C CD1 . PHE C 1 109 ? 121.692 -17.976 22.245 1.00 85.45 ? 187 PHE C CD1 1 ATOM 6175 C CD2 . PHE C 1 109 ? 122.703 -16.674 20.502 1.00 76.14 ? 187 PHE C CD2 1 ATOM 6176 C CE1 . PHE C 1 109 ? 122.801 -18.808 22.279 1.00 81.60 ? 187 PHE C CE1 1 ATOM 6177 C CE2 . PHE C 1 109 ? 123.812 -17.499 20.525 1.00 74.42 ? 187 PHE C CE2 1 ATOM 6178 C CZ . PHE C 1 109 ? 123.863 -18.570 21.418 1.00 78.12 ? 187 PHE C CZ 1 ATOM 6179 N N . GLN C 1 110 ? 118.239 -14.900 19.651 1.00 76.04 ? 188 GLN C N 1 ATOM 6180 C CA . GLN C 1 110 ? 117.201 -13.939 19.303 1.00 76.05 ? 188 GLN C CA 1 ATOM 6181 C C . GLN C 1 110 ? 116.997 -13.707 17.794 1.00 73.18 ? 188 GLN C C 1 ATOM 6182 O O . GLN C 1 110 ? 117.845 -14.073 16.955 1.00 68.65 ? 188 GLN C O 1 ATOM 6183 C CB . GLN C 1 110 ? 117.475 -12.610 20.006 1.00 79.18 ? 188 GLN C CB 1 ATOM 6184 C CG . GLN C 1 110 ? 116.380 -12.195 20.961 1.00 85.54 ? 188 GLN C CG 1 ATOM 6185 C CD . GLN C 1 110 ? 116.596 -12.719 22.350 1.00 87.62 ? 188 GLN C CD 1 ATOM 6186 O OE1 . GLN C 1 110 ? 117.721 -13.024 22.740 1.00 82.90 ? 188 GLN C OE1 1 ATOM 6187 N NE2 . GLN C 1 110 ? 115.518 -12.834 23.110 1.00 95.07 ? 188 GLN C NE2 1 ATOM 6188 N N . TRP C 1 111 ? 115.858 -13.100 17.459 1.00 53.29 ? 189 TRP C N 1 ATOM 6189 C CA . TRP C 1 111 ? 115.629 -12.603 16.107 1.00 51.67 ? 189 TRP C CA 1 ATOM 6190 C C . TRP C 1 111 ? 116.443 -11.337 15.811 1.00 60.61 ? 189 TRP C C 1 ATOM 6191 O O . TRP C 1 111 ? 116.358 -10.327 16.545 1.00 67.01 ? 189 TRP C O 1 ATOM 6192 C CB . TRP C 1 111 ? 114.145 -12.293 15.874 1.00 49.91 ? 189 TRP C CB 1 ATOM 6193 C CG . TRP C 1 111 ? 113.325 -13.502 15.672 1.00 62.59 ? 189 TRP C CG 1 ATOM 6194 C CD1 . TRP C 1 111 ? 112.487 -14.084 16.577 1.00 58.57 ? 189 TRP C CD1 1 ATOM 6195 C CD2 . TRP C 1 111 ? 113.254 -14.301 14.482 1.00 65.24 ? 189 TRP C CD2 1 ATOM 6196 N NE1 . TRP C 1 111 ? 111.901 -15.202 16.028 1.00 63.61 ? 189 TRP C NE1 1 ATOM 6197 C CE2 . TRP C 1 111 ? 112.350 -15.356 14.740 1.00 67.15 ? 189 TRP C CE2 1 ATOM 6198 C CE3 . TRP C 1 111 ? 113.863 -14.225 13.226 1.00 62.34 ? 189 TRP C CE3 1 ATOM 6199 C CZ2 . TRP C 1 111 ? 112.046 -16.337 13.786 1.00 54.75 ? 189 TRP C CZ2 1 ATOM 6200 C CZ3 . TRP C 1 111 ? 113.558 -15.203 12.275 1.00 71.58 ? 189 TRP C CZ3 1 ATOM 6201 C CH2 . TRP C 1 111 ? 112.661 -16.242 12.565 1.00 64.11 ? 189 TRP C CH2 1 ATOM 6202 N N . THR C 1 112 ? 117.226 -11.400 14.734 1.00 61.71 ? 190 THR C N 1 ATOM 6203 C CA . THR C 1 112 ? 117.837 -10.218 14.140 1.00 62.22 ? 190 THR C CA 1 ATOM 6204 C C . THR C 1 112 ? 116.941 -9.694 13.004 1.00 67.00 ? 190 THR C C 1 ATOM 6205 O O . THR C 1 112 ? 116.534 -10.441 12.102 1.00 56.73 ? 190 THR C O 1 ATOM 6206 C CB . THR C 1 112 ? 119.224 -10.531 13.579 1.00 60.11 ? 190 THR C CB 1 ATOM 6207 O OG1 . THR C 1 112 ? 120.035 -11.133 14.603 1.00 67.64 ? 190 THR C OG1 1 ATOM 6208 C CG2 . THR C 1 112 ? 119.873 -9.256 13.066 1.00 51.55 ? 190 THR C CG2 1 ATOM 6209 N N . VAL C 1 113 ? 116.624 -8.407 13.053 1.00 64.50 ? 191 VAL C N 1 ATOM 6210 C CA . VAL C 1 113 ? 115.789 -7.806 12.028 1.00 57.71 ? 191 VAL C CA 1 ATOM 6211 C C . VAL C 1 113 ? 116.461 -6.573 11.427 1.00 67.94 ? 191 VAL C C 1 ATOM 6212 O O . VAL C 1 113 ? 116.678 -5.571 12.120 1.00 67.34 ? 191 VAL C O 1 ATOM 6213 C CB . VAL C 1 113 ? 114.424 -7.404 12.604 1.00 52.40 ? 191 VAL C CB 1 ATOM 6214 C CG1 . VAL C 1 113 ? 113.606 -6.639 11.567 1.00 45.56 ? 191 VAL C CG1 1 ATOM 6215 C CG2 . VAL C 1 113 ? 113.671 -8.634 13.094 1.00 49.63 ? 191 VAL C CG2 1 ATOM 6216 N N . LEU C 1 114 ? 116.801 -6.644 10.141 1.00 68.23 ? 192 LEU C N 1 ATOM 6217 C CA . LEU C 1 114 ? 117.296 -5.461 9.439 1.00 63.54 ? 192 LEU C CA 1 ATOM 6218 C C . LEU C 1 114 ? 116.146 -4.750 8.758 1.00 69.59 ? 192 LEU C C 1 ATOM 6219 O O . LEU C 1 114 ? 115.460 -5.336 7.923 1.00 65.95 ? 192 LEU C O 1 ATOM 6220 C CB . LEU C 1 114 ? 118.369 -5.814 8.420 1.00 51.72 ? 192 LEU C CB 1 ATOM 6221 C CG . LEU C 1 114 ? 119.592 -6.446 9.077 1.00 67.52 ? 192 LEU C CG 1 ATOM 6222 C CD1 . LEU C 1 114 ? 119.470 -7.969 9.043 1.00 65.62 ? 192 LEU C CD1 1 ATOM 6223 C CD2 . LEU C 1 114 ? 120.876 -5.972 8.418 1.00 68.06 ? 192 LEU C CD2 1 ATOM 6224 N N . SER C 1 115 ? 115.939 -3.488 9.123 1.00 70.66 ? 193 SER C N 1 ATOM 6225 C CA . SER C 1 115 ? 114.813 -2.718 8.615 1.00 64.69 ? 193 SER C CA 1 ATOM 6226 C C . SER C 1 115 ? 115.258 -1.363 8.059 1.00 64.24 ? 193 SER C C 1 ATOM 6227 O O . SER C 1 115 ? 115.926 -0.588 8.749 1.00 66.20 ? 193 SER C O 1 ATOM 6228 C CB . SER C 1 115 ? 113.760 -2.536 9.716 1.00 70.71 ? 193 SER C CB 1 ATOM 6229 O OG . SER C 1 115 ? 112.594 -1.897 9.214 1.00 75.30 ? 193 SER C OG 1 ATOM 6230 N N . VAL C 1 116 ? 114.886 -1.095 6.806 1.00 63.33 ? 194 VAL C N 1 ATOM 6231 C CA . VAL C 1 116 ? 115.143 0.195 6.156 1.00 64.13 ? 194 VAL C CA 1 ATOM 6232 C C . VAL C 1 116 ? 114.053 1.209 6.502 1.00 63.33 ? 194 VAL C C 1 ATOM 6233 O O . VAL C 1 116 ? 112.870 0.930 6.343 1.00 64.85 ? 194 VAL C O 1 ATOM 6234 C CB . VAL C 1 116 ? 115.190 0.064 4.608 1.00 65.12 ? 194 VAL C CB 1 ATOM 6235 C CG1 . VAL C 1 116 ? 115.379 1.444 3.951 1.00 52.88 ? 194 VAL C CG1 1 ATOM 6236 C CG2 . VAL C 1 116 ? 116.294 -0.885 4.180 1.00 62.87 ? 194 VAL C CG2 1 ATOM 6237 N N . ALA C 1 117 ? 114.458 2.392 6.947 1.00 61.82 ? 195 ALA C N 1 ATOM 6238 C CA . ALA C 1 117 ? 113.518 3.419 7.374 1.00 63.87 ? 195 ALA C CA 1 ATOM 6239 C C . ALA C 1 117 ? 114.038 4.792 6.971 1.00 83.07 ? 195 ALA C C 1 ATOM 6240 O O . ALA C 1 117 ? 115.120 4.897 6.382 1.00 85.45 ? 195 ALA C O 1 ATOM 6241 C CB . ALA C 1 117 ? 113.304 3.349 8.886 1.00 61.95 ? 195 ALA C CB 1 ATOM 6242 N N . GLY C 1 118 ? 113.270 5.835 7.287 1.00 95.11 ? 196 GLY C N 1 ATOM 6243 C CA . GLY C 1 118 ? 113.672 7.208 7.017 1.00 99.52 ? 196 GLY C CA 1 ATOM 6244 C C . GLY C 1 118 ? 113.980 7.485 5.557 1.00 106.74 ? 196 GLY C C 1 ATOM 6245 O O . GLY C 1 118 ? 113.149 7.239 4.681 1.00 114.90 ? 196 GLY C O 1 ATOM 6246 N N . ASP C 1 119 ? 115.182 7.992 5.299 1.00 111.28 ? 200 ASP C N 1 ATOM 6247 C CA . ASP C 1 119 ? 115.634 8.288 3.940 1.00 116.35 ? 200 ASP C CA 1 ATOM 6248 C C . ASP C 1 119 ? 116.401 7.103 3.338 1.00 101.57 ? 200 ASP C C 1 ATOM 6249 O O . ASP C 1 119 ? 116.953 7.192 2.228 1.00 90.99 ? 200 ASP C O 1 ATOM 6250 C CB . ASP C 1 119 ? 116.495 9.558 3.943 1.00 124.66 ? 200 ASP C CB 1 ATOM 6251 C CG . ASP C 1 119 ? 117.377 9.669 5.185 1.00 126.24 ? 200 ASP C CG 1 ATOM 6252 O OD1 . ASP C 1 119 ? 118.013 8.660 5.568 1.00 111.96 ? 200 ASP C OD1 1 ATOM 6253 O OD2 . ASP C 1 119 ? 117.427 10.771 5.779 1.00 132.56 ? 200 ASP C OD2 1 ATOM 6254 N N . GLY C 1 120 ? 116.423 5.996 4.083 1.00 79.73 ? 201 GLY C N 1 ATOM 6255 C CA . GLY C 1 120 ? 117.101 4.793 3.648 1.00 80.03 ? 201 GLY C CA 1 ATOM 6256 C C . GLY C 1 120 ? 118.343 4.399 4.435 1.00 91.42 ? 201 GLY C C 1 ATOM 6257 O O . GLY C 1 120 ? 119.316 3.914 3.856 1.00 103.18 ? 201 GLY C O 1 ATOM 6258 N N . PHE C 1 121 ? 118.328 4.602 5.748 1.00 82.78 ? 202 PHE C N 1 ATOM 6259 C CA . PHE C 1 121 ? 119.342 3.983 6.601 1.00 70.15 ? 202 PHE C CA 1 ATOM 6260 C C . PHE C 1 121 ? 118.792 2.646 7.101 1.00 68.11 ? 202 PHE C C 1 ATOM 6261 O O . PHE C 1 121 ? 117.580 2.414 7.101 1.00 68.82 ? 202 PHE C O 1 ATOM 6262 C CB . PHE C 1 121 ? 119.694 4.873 7.789 1.00 67.66 ? 202 PHE C CB 1 ATOM 6263 C CG . PHE C 1 121 ? 118.513 5.198 8.665 1.00 70.49 ? 202 PHE C CG 1 ATOM 6264 C CD1 . PHE C 1 121 ? 117.702 6.292 8.380 1.00 68.15 ? 202 PHE C CD1 1 ATOM 6265 C CD2 . PHE C 1 121 ? 118.203 4.405 9.765 1.00 67.04 ? 202 PHE C CD2 1 ATOM 6266 C CE1 . PHE C 1 121 ? 116.609 6.592 9.176 1.00 72.24 ? 202 PHE C CE1 1 ATOM 6267 C CE2 . PHE C 1 121 ? 117.109 4.698 10.561 1.00 68.98 ? 202 PHE C CE2 1 ATOM 6268 C CZ . PHE C 1 121 ? 116.311 5.794 10.269 1.00 73.86 ? 202 PHE C CZ 1 ATOM 6269 N N . VAL C 1 122 ? 119.676 1.757 7.518 1.00 62.77 ? 203 VAL C N 1 ATOM 6270 C CA . VAL C 1 122 ? 119.218 0.485 8.041 1.00 69.11 ? 203 VAL C CA 1 ATOM 6271 C C . VAL C 1 122 ? 119.397 0.415 9.551 1.00 72.84 ? 203 VAL C C 1 ATOM 6272 O O . VAL C 1 122 ? 120.504 0.570 10.058 1.00 72.61 ? 203 VAL C O 1 ATOM 6273 C CB . VAL C 1 122 ? 119.946 -0.683 7.381 1.00 69.42 ? 203 VAL C CB 1 ATOM 6274 C CG1 . VAL C 1 122 ? 119.667 -1.976 8.140 1.00 69.45 ? 203 VAL C CG1 1 ATOM 6275 C CG2 . VAL C 1 122 ? 119.519 -0.791 5.923 1.00 69.72 ? 203 VAL C CG2 1 ATOM 6276 N N . SER C 1 123 ? 118.303 0.191 10.268 1.00 70.95 ? 204 SER C N 1 ATOM 6277 C CA . SER C 1 123 ? 118.387 -0.049 11.699 1.00 65.83 ? 204 SER C CA 1 ATOM 6278 C C . SER C 1 123 ? 118.448 -1.552 11.927 1.00 71.03 ? 204 SER C C 1 ATOM 6279 O O . SER C 1 123 ? 117.793 -2.323 11.223 1.00 71.78 ? 204 SER C O 1 ATOM 6280 C CB . SER C 1 123 ? 117.211 0.598 12.450 1.00 61.05 ? 204 SER C CB 1 ATOM 6281 O OG . SER C 1 123 ? 115.950 0.186 11.942 1.00 77.17 ? 204 SER C OG 1 ATOM 6282 N N . ILE C 1 124 ? 119.271 -1.976 12.878 1.00 74.35 ? 205 ILE C N 1 ATOM 6283 C CA . ILE C 1 124 ? 119.337 -3.396 13.229 1.00 68.99 ? 205 ILE C CA 1 ATOM 6284 C C . ILE C 1 124 ? 118.723 -3.655 14.607 1.00 66.06 ? 205 ILE C C 1 ATOM 6285 O O . ILE C 1 124 ? 119.117 -3.042 15.607 1.00 67.15 ? 205 ILE C O 1 ATOM 6286 C CB . ILE C 1 124 ? 120.778 -3.945 13.169 1.00 56.14 ? 205 ILE C CB 1 ATOM 6287 C CG1 . ILE C 1 124 ? 121.414 -3.593 11.816 1.00 55.32 ? 205 ILE C CG1 1 ATOM 6288 C CG2 . ILE C 1 124 ? 120.784 -5.452 13.429 1.00 53.29 ? 205 ILE C CG2 1 ATOM 6289 C CD1 . ILE C 1 124 ? 122.812 -4.132 11.622 1.00 51.54 ? 205 ILE C CD1 1 ATOM 6290 N N . LEU C 1 125 ? 117.740 -4.551 14.655 1.00 68.37 ? 206 LEU C N 1 ATOM 6291 C CA . LEU C 1 125 ? 117.123 -4.915 15.928 1.00 68.90 ? 206 LEU C CA 1 ATOM 6292 C C . LEU C 1 125 ? 117.431 -6.363 16.316 1.00 75.33 ? 206 LEU C C 1 ATOM 6293 O O . LEU C 1 125 ? 117.284 -7.284 15.505 1.00 78.72 ? 206 LEU C O 1 ATOM 6294 C CB . LEU C 1 125 ? 115.615 -4.647 15.924 1.00 55.80 ? 206 LEU C CB 1 ATOM 6295 C CG . LEU C 1 125 ? 115.183 -3.198 15.689 1.00 65.47 ? 206 LEU C CG 1 ATOM 6296 C CD1 . LEU C 1 125 ? 114.990 -2.940 14.190 1.00 78.70 ? 206 LEU C CD1 1 ATOM 6297 C CD2 . LEU C 1 125 ? 113.928 -2.866 16.464 1.00 48.54 ? 206 LEU C CD2 1 ATOM 6298 N N . TYR C 1 126 ? 117.880 -6.541 17.557 1.00 72.02 ? 207 TYR C N 1 ATOM 6299 C CA . TYR C 1 126 ? 118.179 -7.858 18.105 1.00 70.36 ? 207 TYR C CA 1 ATOM 6300 C C . TYR C 1 126 ? 117.322 -8.047 19.354 1.00 75.28 ? 207 TYR C C 1 ATOM 6301 O O . TYR C 1 126 ? 117.454 -7.288 20.316 1.00 79.79 ? 207 TYR C O 1 ATOM 6302 C CB . TYR C 1 126 ? 119.650 -7.925 18.455 1.00 68.02 ? 207 TYR C CB 1 ATOM 6303 C CG . TYR C 1 126 ? 120.129 -9.311 18.761 1.00 67.47 ? 207 TYR C CG 1 ATOM 6304 C CD1 . TYR C 1 126 ? 120.361 -10.219 17.739 1.00 50.51 ? 207 TYR C CD1 1 ATOM 6305 C CD2 . TYR C 1 126 ? 120.359 -9.716 20.074 1.00 67.44 ? 207 TYR C CD2 1 ATOM 6306 C CE1 . TYR C 1 126 ? 120.816 -11.497 18.008 1.00 65.25 ? 207 TYR C CE1 1 ATOM 6307 C CE2 . TYR C 1 126 ? 120.812 -10.996 20.360 1.00 71.18 ? 207 TYR C CE2 1 ATOM 6308 C CZ . TYR C 1 126 ? 121.038 -11.889 19.323 1.00 78.64 ? 207 TYR C CZ 1 ATOM 6309 O OH . TYR C 1 126 ? 121.484 -13.170 19.591 1.00 75.11 ? 207 TYR C OH 1 ATOM 6310 N N . GLY C 1 127 ? 116.455 -9.059 19.355 1.00 80.45 ? 208 GLY C N 1 ATOM 6311 C CA . GLY C 1 127 ? 115.293 -9.015 20.229 1.00 41.36 ? 208 GLY C CA 1 ATOM 6312 C C . GLY C 1 127 ? 114.493 -7.857 19.673 1.00 96.11 ? 208 GLY C C 1 ATOM 6313 O O . GLY C 1 127 ? 114.347 -7.731 18.439 1.00 103.43 ? 208 GLY C O 1 ATOM 6314 N N . GLY C 1 128 ? 113.996 -6.985 20.541 1.00 85.17 ? 209 GLY C N 1 ATOM 6315 C CA . GLY C 1 128 ? 113.398 -5.756 20.046 1.00 82.35 ? 209 GLY C CA 1 ATOM 6316 C C . GLY C 1 128 ? 114.337 -4.580 20.196 1.00 78.09 ? 209 GLY C C 1 ATOM 6317 O O . GLY C 1 128 ? 113.921 -3.432 20.043 1.00 75.44 ? 209 GLY C O 1 ATOM 6318 N N . ILE C 1 129 ? 115.601 -4.881 20.489 1.00 77.41 ? 210 ILE C N 1 ATOM 6319 C CA . ILE C 1 129 ? 116.596 -3.876 20.852 1.00 70.44 ? 210 ILE C CA 1 ATOM 6320 C C . ILE C 1 129 ? 117.419 -3.419 19.647 1.00 75.35 ? 210 ILE C C 1 ATOM 6321 O O . ILE C 1 129 ? 118.004 -4.246 18.937 1.00 82.70 ? 210 ILE C O 1 ATOM 6322 C CB . ILE C 1 129 ? 117.587 -4.446 21.890 1.00 70.50 ? 210 ILE C CB 1 ATOM 6323 C CG1 . ILE C 1 129 ? 116.847 -5.082 23.070 1.00 77.03 ? 210 ILE C CG1 1 ATOM 6324 C CG2 . ILE C 1 129 ? 118.566 -3.377 22.356 1.00 65.86 ? 210 ILE C CG2 1 ATOM 6325 C CD1 . ILE C 1 129 ? 116.018 -4.119 23.857 1.00 72.66 ? 210 ILE C CD1 1 ATOM 6326 N N . ILE C 1 130 ? 117.478 -2.107 19.430 1.00 60.51 ? 211 ILE C N 1 ATOM 6327 C CA . ILE C 1 130 ? 118.342 -1.547 18.392 1.00 73.42 ? 211 ILE C CA 1 ATOM 6328 C C . ILE C 1 130 ? 119.796 -1.794 18.773 1.00 66.97 ? 211 ILE C C 1 ATOM 6329 O O . ILE C 1 130 ? 120.230 -1.422 19.863 1.00 69.57 ? 211 ILE C O 1 ATOM 6330 C CB . ILE C 1 130 ? 118.088 -0.047 18.191 1.00 78.98 ? 211 ILE C CB 1 ATOM 6331 C CG1 . ILE C 1 130 ? 116.707 0.159 17.583 1.00 80.40 ? 211 ILE C CG1 1 ATOM 6332 C CG2 . ILE C 1 130 ? 119.140 0.565 17.276 1.00 78.45 ? 211 ILE C CG2 1 ATOM 6333 C CD1 . ILE C 1 130 ? 116.237 1.565 17.704 1.00 93.47 ? 211 ILE C CD1 1 ATOM 6334 N N . THR C 1 131 ? 120.543 -2.441 17.889 1.00 51.68 ? 212 THR C N 1 ATOM 6335 C CA . THR C 1 131 ? 121.880 -2.883 18.259 1.00 56.56 ? 212 THR C CA 1 ATOM 6336 C C . THR C 1 131 ? 122.934 -2.324 17.314 1.00 73.62 ? 212 THR C C 1 ATOM 6337 O O . THR C 1 131 ? 124.129 -2.310 17.638 1.00 76.96 ? 212 THR C O 1 ATOM 6338 C CB . THR C 1 131 ? 121.974 -4.421 18.333 1.00 58.83 ? 212 THR C CB 1 ATOM 6339 O OG1 . THR C 1 131 ? 121.444 -4.991 17.127 1.00 76.60 ? 212 THR C OG1 1 ATOM 6340 C CG2 . THR C 1 131 ? 121.182 -4.944 19.526 1.00 48.63 ? 212 THR C CG2 1 ATOM 6341 N N . ASP C 1 132 ? 122.484 -1.856 16.152 1.00 66.24 ? 213 ASP C N 1 ATOM 6342 C CA . ASP C 1 132 ? 123.378 -1.229 15.199 1.00 74.82 ? 213 ASP C CA 1 ATOM 6343 C C . ASP C 1 132 ? 122.597 -0.420 14.178 1.00 79.12 ? 213 ASP C C 1 ATOM 6344 O O . ASP C 1 132 ? 121.371 -0.491 14.113 1.00 73.09 ? 213 ASP C O 1 ATOM 6345 C CB . ASP C 1 132 ? 124.236 -2.284 14.488 1.00 85.12 ? 213 ASP C CB 1 ATOM 6346 C CG . ASP C 1 132 ? 125.704 -1.880 14.385 1.00 94.48 ? 213 ASP C CG 1 ATOM 6347 O OD1 . ASP C 1 132 ? 126.019 -0.662 14.447 1.00 89.71 ? 213 ASP C OD1 1 ATOM 6348 O OD2 . ASP C 1 132 ? 126.544 -2.796 14.244 1.00 100.79 ? 213 ASP C OD2 1 ATOM 6349 N N . THR C 1 133 ? 123.324 0.353 13.383 1.00 82.07 ? 214 THR C N 1 ATOM 6350 C CA . THR C 1 133 ? 122.715 1.121 12.318 1.00 78.59 ? 214 THR C CA 1 ATOM 6351 C C . THR C 1 133 ? 123.700 1.264 11.149 1.00 82.12 ? 214 THR C C 1 ATOM 6352 O O . THR C 1 133 ? 124.893 1.515 11.359 1.00 76.35 ? 214 THR C O 1 ATOM 6353 C CB . THR C 1 133 ? 122.224 2.495 12.831 1.00 84.49 ? 214 THR C CB 1 ATOM 6354 O OG1 . THR C 1 133 ? 121.578 3.208 11.771 1.00 102.38 ? 214 THR C OG1 1 ATOM 6355 C CG2 . THR C 1 133 ? 123.382 3.323 13.361 1.00 86.29 ? 214 THR C CG2 1 ATOM 6356 N N . ILE C 1 134 ? 123.204 1.076 9.923 1.00 76.75 ? 215 ILE C N 1 ATOM 6357 C CA . ILE C 1 134 ? 124.050 1.119 8.733 1.00 74.53 ? 215 ILE C CA 1 ATOM 6358 C C . ILE C 1 134 ? 123.650 2.240 7.780 1.00 69.42 ? 215 ILE C C 1 ATOM 6359 O O . ILE C 1 134 ? 122.459 2.479 7.564 1.00 67.48 ? 215 ILE C O 1 ATOM 6360 C CB . ILE C 1 134 ? 124.013 -0.215 7.981 1.00 64.77 ? 215 ILE C CB 1 ATOM 6361 C CG1 . ILE C 1 134 ? 124.444 -1.354 8.908 1.00 61.86 ? 215 ILE C CG1 1 ATOM 6362 C CG2 . ILE C 1 134 ? 124.909 -0.151 6.747 1.00 51.43 ? 215 ILE C CG2 1 ATOM 6363 C CD1 . ILE C 1 134 ? 124.445 -2.726 8.236 1.00 61.49 ? 215 ILE C CD1 1 ATOM 6364 N N . HIS C 1 135 ? 124.646 2.920 7.206 1.00 67.16 ? 216 HIS C N 1 ATOM 6365 C CA . HIS C 1 135 ? 124.383 4.102 6.378 1.00 72.66 ? 216 HIS C CA 1 ATOM 6366 C C . HIS C 1 135 ? 124.938 4.032 4.959 1.00 80.54 ? 216 HIS C C 1 ATOM 6367 O O . HIS C 1 135 ? 125.979 3.403 4.710 1.00 71.66 ? 216 HIS C O 1 ATOM 6368 C CB . HIS C 1 135 ? 124.876 5.362 7.085 1.00 68.65 ? 216 HIS C CB 1 ATOM 6369 C CG . HIS C 1 135 ? 124.262 5.555 8.427 1.00 77.37 ? 216 HIS C CG 1 ATOM 6370 N ND1 . HIS C 1 135 ? 124.754 4.949 9.566 1.00 79.40 ? 216 HIS C ND1 1 ATOM 6371 C CD2 . HIS C 1 135 ? 123.165 6.252 8.817 1.00 88.92 ? 216 HIS C CD2 1 ATOM 6372 C CE1 . HIS C 1 135 ? 124.006 5.284 10.599 1.00 89.46 ? 216 HIS C CE1 1 ATOM 6373 N NE2 . HIS C 1 135 ? 123.034 6.075 10.172 1.00 97.14 ? 216 HIS C NE2 1 ATOM 6374 N N . PRO C 1 136 ? 124.230 4.679 4.017 1.00 85.15 ? 217 PRO C N 1 ATOM 6375 C CA . PRO C 1 136 ? 124.665 4.664 2.616 1.00 81.98 ? 217 PRO C CA 1 ATOM 6376 C C . PRO C 1 136 ? 125.925 5.487 2.387 1.00 85.24 ? 217 PRO C C 1 ATOM 6377 O O . PRO C 1 136 ? 126.019 6.629 2.828 1.00 83.87 ? 217 PRO C O 1 ATOM 6378 C CB . PRO C 1 136 ? 123.469 5.277 1.862 1.00 73.16 ? 217 PRO C CB 1 ATOM 6379 C CG . PRO C 1 136 ? 122.723 6.075 2.900 1.00 70.03 ? 217 PRO C CG 1 ATOM 6380 C CD . PRO C 1 136 ? 122.929 5.356 4.201 1.00 73.71 ? 217 PRO C CD 1 ATOM 6381 N N . THR C 1 137 ? 126.895 4.881 1.715 1.00 96.66 ? 218 THR C N 1 ATOM 6382 C CA . THR C 1 137 ? 128.025 5.613 1.169 1.00 99.76 ? 218 THR C CA 1 ATOM 6383 C C . THR C 1 137 ? 127.593 6.219 -0.169 1.00 96.42 ? 218 THR C C 1 ATOM 6384 O O . THR C 1 137 ? 127.606 7.442 -0.353 1.00 82.96 ? 218 THR C O 1 ATOM 6385 C CB . THR C 1 137 ? 129.250 4.678 0.957 1.00 102.51 ? 218 THR C CB 1 ATOM 6386 O OG1 . THR C 1 137 ? 129.397 4.342 -0.430 1.00 106.71 ? 218 THR C OG1 1 ATOM 6387 C CG2 . THR C 1 137 ? 129.080 3.393 1.754 1.00 103.46 ? 218 THR C CG2 1 ATOM 6388 N N . ASN C 1 138 ? 127.163 5.337 -1.073 1.00 91.06 ? 219 ASN C N 1 ATOM 6389 C CA . ASN C 1 138 ? 126.944 5.666 -2.477 1.00 86.62 ? 219 ASN C CA 1 ATOM 6390 C C . ASN C 1 138 ? 125.543 6.176 -2.880 1.00 78.07 ? 219 ASN C C 1 ATOM 6391 O O . ASN C 1 138 ? 125.024 5.792 -3.932 1.00 86.77 ? 219 ASN C O 1 ATOM 6392 C CB . ASN C 1 138 ? 127.352 4.482 -3.370 1.00 91.46 ? 219 ASN C CB 1 ATOM 6393 C CG . ASN C 1 138 ? 128.869 4.315 -3.478 1.00 108.59 ? 219 ASN C CG 1 ATOM 6394 O OD1 . ASN C 1 138 ? 129.360 3.205 -3.695 1.00 115.63 ? 219 ASN C OD1 1 ATOM 6395 N ND2 . ASN C 1 138 ? 129.614 5.418 -3.337 1.00 104.30 ? 219 ASN C ND2 1 ATOM 6396 N N . GLY C 1 139 ? 124.944 7.045 -2.064 1.00 75.60 ? 220 GLY C N 1 ATOM 6397 C CA . GLY C 1 139 ? 123.761 7.784 -2.484 1.00 75.27 ? 220 GLY C CA 1 ATOM 6398 C C . GLY C 1 139 ? 122.408 7.330 -1.953 1.00 85.15 ? 220 GLY C C 1 ATOM 6399 O O . GLY C 1 139 ? 121.505 8.153 -1.756 1.00 79.72 ? 220 GLY C O 1 ATOM 6400 N N . GLY C 1 140 ? 122.252 6.024 -1.738 1.00 87.67 ? 221 GLY C N 1 ATOM 6401 C CA . GLY C 1 140 ? 121.015 5.486 -1.201 1.00 72.36 ? 221 GLY C CA 1 ATOM 6402 C C . GLY C 1 140 ? 119.915 5.435 -2.244 1.00 85.84 ? 221 GLY C C 1 ATOM 6403 O O . GLY C 1 140 ? 120.103 5.892 -3.375 1.00 98.01 ? 221 GLY C O 1 ATOM 6404 N N . PRO C 1 141 ? 118.748 4.886 -1.868 1.00 88.98 ? 222 PRO C N 1 ATOM 6405 C CA . PRO C 1 141 ? 118.506 4.419 -0.504 1.00 84.17 ? 222 PRO C CA 1 ATOM 6406 C C . PRO C 1 141 ? 119.037 2.992 -0.324 1.00 78.16 ? 222 PRO C C 1 ATOM 6407 O O . PRO C 1 141 ? 119.119 2.228 -1.299 1.00 72.50 ? 222 PRO C O 1 ATOM 6408 C CB . PRO C 1 141 ? 116.979 4.436 -0.425 1.00 84.80 ? 222 PRO C CB 1 ATOM 6409 C CG . PRO C 1 141 ? 116.563 4.005 -1.814 1.00 84.14 ? 222 PRO C CG 1 ATOM 6410 C CD . PRO C 1 141 ? 117.622 4.553 -2.765 1.00 86.36 ? 222 PRO C CD 1 ATOM 6411 N N . LEU C 1 142 ? 119.422 2.653 0.903 1.00 78.28 ? 223 LEU C N 1 ATOM 6412 C CA . LEU C 1 142 ? 119.848 1.291 1.231 1.00 70.18 ? 223 LEU C CA 1 ATOM 6413 C C . LEU C 1 142 ? 118.718 0.289 0.993 1.00 58.25 ? 223 LEU C C 1 ATOM 6414 O O . LEU C 1 142 ? 117.530 0.627 1.131 1.00 56.30 ? 223 LEU C O 1 ATOM 6415 C CB . LEU C 1 142 ? 120.331 1.211 2.686 1.00 68.66 ? 223 LEU C CB 1 ATOM 6416 C CG . LEU C 1 142 ? 121.843 1.175 2.946 1.00 66.53 ? 223 LEU C CG 1 ATOM 6417 C CD1 . LEU C 1 142 ? 122.653 1.826 1.821 1.00 51.97 ? 223 LEU C CD1 1 ATOM 6418 C CD2 . LEU C 1 142 ? 122.175 1.829 4.273 1.00 49.36 ? 223 LEU C CD2 1 ATOM 6419 N N . ARG C 1 143 ? 119.088 -0.937 0.631 1.00 55.05 ? 224 ARG C N 1 ATOM 6420 C CA . ARG C 1 143 ? 118.110 -1.990 0.346 1.00 55.08 ? 224 ARG C CA 1 ATOM 6421 C C . ARG C 1 143 ? 118.497 -3.330 0.967 1.00 57.43 ? 224 ARG C C 1 ATOM 6422 O O . ARG C 1 143 ? 119.556 -3.891 0.639 1.00 62.10 ? 224 ARG C O 1 ATOM 6423 C CB . ARG C 1 143 ? 117.992 -2.203 -1.164 1.00 56.15 ? 224 ARG C CB 1 ATOM 6424 C CG . ARG C 1 143 ? 117.283 -1.112 -1.944 1.00 48.99 ? 224 ARG C CG 1 ATOM 6425 C CD . ARG C 1 143 ? 117.848 -1.055 -3.361 1.00 52.37 ? 224 ARG C CD 1 ATOM 6426 N NE . ARG C 1 143 ? 118.777 0.057 -3.469 1.00 77.61 ? 224 ARG C NE 1 ATOM 6427 C CZ . ARG C 1 143 ? 119.847 0.083 -4.254 1.00 78.49 ? 224 ARG C CZ 1 ATOM 6428 N NH1 . ARG C 1 143 ? 120.147 -0.948 -5.028 1.00 60.95 ? 224 ARG C NH1 1 ATOM 6429 N NH2 . ARG C 1 143 ? 120.614 1.161 -4.267 1.00 81.55 ? 224 ARG C NH2 1 ATOM 6430 N N . THR C 1 144 ? 117.632 -3.867 1.828 1.00 55.46 ? 225 THR C N 1 ATOM 6431 C CA . THR C 1 144 ? 117.827 -5.237 2.335 1.00 52.22 ? 225 THR C CA 1 ATOM 6432 C C . THR C 1 144 ? 117.509 -6.294 1.274 1.00 54.82 ? 225 THR C C 1 ATOM 6433 O O . THR C 1 144 ? 117.008 -5.972 0.192 1.00 68.99 ? 225 THR C O 1 ATOM 6434 C CB . THR C 1 144 ? 116.962 -5.520 3.561 1.00 57.21 ? 225 THR C CB 1 ATOM 6435 O OG1 . THR C 1 144 ? 115.619 -5.816 3.148 1.00 65.02 ? 225 THR C OG1 1 ATOM 6436 C CG2 . THR C 1 144 ? 116.968 -4.317 4.501 1.00 54.68 ? 225 THR C CG2 1 ATOM 6437 N N . GLN C 1 145 ? 117.771 -7.557 1.587 1.00 54.40 ? 226 GLN C N 1 ATOM 6438 C CA . GLN C 1 145 ? 117.586 -8.607 0.594 1.00 55.16 ? 226 GLN C CA 1 ATOM 6439 C C . GLN C 1 145 ? 116.137 -9.075 0.511 1.00 56.08 ? 226 GLN C C 1 ATOM 6440 O O . GLN C 1 145 ? 115.803 -9.922 -0.334 1.00 64.03 ? 226 GLN C O 1 ATOM 6441 C CB . GLN C 1 145 ? 118.508 -9.783 0.872 1.00 58.01 ? 226 GLN C CB 1 ATOM 6442 C CG . GLN C 1 145 ? 118.615 -10.126 2.338 1.00 64.22 ? 226 GLN C CG 1 ATOM 6443 C CD . GLN C 1 145 ? 119.600 -11.251 2.602 1.00 67.96 ? 226 GLN C CD 1 ATOM 6444 O OE1 . GLN C 1 145 ? 120.232 -11.310 3.664 1.00 78.15 ? 226 GLN C OE1 1 ATOM 6445 N NE2 . GLN C 1 145 ? 119.719 -12.164 1.647 1.00 75.76 ? 226 GLN C NE2 1 ATOM 6446 N N . ALA C 1 146 ? 115.288 -8.506 1.373 1.00 43.30 ? 227 ALA C N 1 ATOM 6447 C CA . ALA C 1 146 ? 113.844 -8.759 1.336 1.00 51.60 ? 227 ALA C CA 1 ATOM 6448 C C . ALA C 1 146 ? 113.579 -10.254 1.363 1.00 55.78 ? 227 ALA C C 1 ATOM 6449 O O . ALA C 1 146 ? 112.783 -10.792 0.576 1.00 57.28 ? 227 ALA C O 1 ATOM 6450 C CB . ALA C 1 146 ? 113.200 -8.131 0.094 1.00 38.53 ? 227 ALA C CB 1 ATOM 6451 N N . SER C 1 147 ? 114.244 -10.893 2.312 1.00 56.83 ? 228 SER C N 1 ATOM 6452 C CA . SER C 1 147 ? 114.354 -12.325 2.384 1.00 54.53 ? 228 SER C CA 1 ATOM 6453 C C . SER C 1 147 ? 115.036 -12.654 3.703 1.00 60.58 ? 228 SER C C 1 ATOM 6454 O O . SER C 1 147 ? 115.515 -11.769 4.411 1.00 53.42 ? 228 SER C O 1 ATOM 6455 C CB . SER C 1 147 ? 115.213 -12.833 1.231 1.00 48.82 ? 228 SER C CB 1 ATOM 6456 O OG . SER C 1 147 ? 115.382 -14.241 1.332 1.00 77.94 ? 228 SER C OG 1 ATOM 6457 N N . SER C 1 148 ? 115.084 -13.934 4.033 1.00 60.12 ? 229 SER C N 1 ATOM 6458 C CA . SER C 1 148 ? 115.763 -14.360 5.235 1.00 50.79 ? 229 SER C CA 1 ATOM 6459 C C . SER C 1 148 ? 117.262 -14.102 5.131 1.00 53.89 ? 229 SER C C 1 ATOM 6460 O O . SER C 1 148 ? 117.860 -14.337 4.059 1.00 55.84 ? 229 SER C O 1 ATOM 6461 C CB . SER C 1 148 ? 115.514 -15.846 5.473 1.00 49.44 ? 229 SER C CB 1 ATOM 6462 O OG . SER C 1 148 ? 116.110 -16.265 6.689 1.00 67.72 ? 229 SER C OG 1 ATOM 6463 N N . CYS C 1 149 ? 117.868 -13.591 6.210 1.00 44.51 ? 230 CYS C N 1 ATOM 6464 C CA . CYS C 1 149 ? 119.329 -13.641 6.336 1.00 63.04 ? 230 CYS C CA 1 ATOM 6465 C C . CYS C 1 149 ? 119.725 -15.054 6.778 1.00 68.24 ? 230 CYS C C 1 ATOM 6466 O O . CYS C 1 149 ? 118.868 -15.884 7.135 1.00 67.80 ? 230 CYS C O 1 ATOM 6467 C CB . CYS C 1 149 ? 119.857 -12.649 7.395 1.00 59.36 ? 230 CYS C CB 1 ATOM 6468 S SG . CYS C 1 149 ? 118.730 -11.420 8.061 1.00 107.31 ? 230 CYS C SG 1 ATOM 6469 N N . ILE C 1 150 ? 121.022 -15.335 6.734 1.00 66.34 ? 231 ILE C N 1 ATOM 6470 C CA . ILE C 1 150 ? 121.503 -16.656 7.124 1.00 66.24 ? 231 ILE C CA 1 ATOM 6471 C C . ILE C 1 150 ? 122.306 -16.609 8.426 1.00 66.66 ? 231 ILE C C 1 ATOM 6472 O O . ILE C 1 150 ? 123.277 -15.864 8.546 1.00 74.41 ? 231 ILE C O 1 ATOM 6473 C CB . ILE C 1 150 ? 122.342 -17.302 6.014 1.00 66.58 ? 231 ILE C CB 1 ATOM 6474 C CG1 . ILE C 1 150 ? 121.618 -17.156 4.659 1.00 69.72 ? 231 ILE C CG1 1 ATOM 6475 C CG2 . ILE C 1 150 ? 122.614 -18.771 6.353 1.00 65.15 ? 231 ILE C CG2 1 ATOM 6476 C CD1 . ILE C 1 150 ? 120.356 -18.017 4.496 1.00 57.54 ? 231 ILE C CD1 1 ATOM 6477 N N . CYS C 1 151 ? 121.874 -17.400 9.403 1.00 73.79 ? 232 CYS C N 1 ATOM 6478 C CA . CYS C 1 151 ? 122.612 -17.582 10.649 1.00 76.19 ? 232 CYS C CA 1 ATOM 6479 C C . CYS C 1 151 ? 123.151 -18.989 10.736 1.00 78.94 ? 232 CYS C C 1 ATOM 6480 O O . CYS C 1 151 ? 122.461 -19.959 10.411 1.00 76.63 ? 232 CYS C O 1 ATOM 6481 C CB . CYS C 1 151 ? 121.716 -17.369 11.865 1.00 65.37 ? 232 CYS C CB 1 ATOM 6482 S SG . CYS C 1 151 ? 121.157 -15.697 12.077 1.00 84.29 ? 232 CYS C SG 1 ATOM 6483 N N . ASN C 1 152 ? 124.384 -19.112 11.196 1.00 77.70 ? 233 ASN C N 1 ATOM 6484 C CA . ASN C 1 152 ? 124.885 -20.426 11.549 1.00 76.60 ? 233 ASN C CA 1 ATOM 6485 C C . ASN C 1 152 ? 125.914 -20.352 12.655 1.00 79.74 ? 233 ASN C C 1 ATOM 6486 O O . ASN C 1 152 ? 126.926 -19.654 12.522 1.00 68.93 ? 233 ASN C O 1 ATOM 6487 C CB . ASN C 1 152 ? 125.453 -21.143 10.331 1.00 75.57 ? 233 ASN C CB 1 ATOM 6488 C CG . ASN C 1 152 ? 125.352 -22.644 10.448 1.00 81.22 ? 233 ASN C CG 1 ATOM 6489 O OD1 . ASN C 1 152 ? 124.467 -23.169 11.132 1.00 80.58 ? 233 ASN C OD1 1 ATOM 6490 N ND2 . ASN C 1 152 ? 126.267 -23.350 9.787 1.00 75.64 ? 233 ASN C ND2 1 ATOM 6491 N N . ASP C 1 153 ? 125.629 -21.059 13.750 1.00 78.41 ? 234 ASP C N 1 ATOM 6492 C CA . ASP C 1 153 ? 126.558 -21.174 14.863 1.00 81.34 ? 234 ASP C CA 1 ATOM 6493 C C . ASP C 1 153 ? 126.921 -19.788 15.407 1.00 79.01 ? 234 ASP C C 1 ATOM 6494 O O . ASP C 1 153 ? 128.105 -19.452 15.529 1.00 69.14 ? 234 ASP C O 1 ATOM 6495 C CB . ASP C 1 153 ? 127.812 -21.931 14.405 1.00 83.25 ? 234 ASP C CB 1 ATOM 6496 C CG . ASP C 1 153 ? 128.561 -22.572 15.555 1.00 112.10 ? 234 ASP C CG 1 ATOM 6497 O OD1 . ASP C 1 153 ? 127.930 -22.897 16.586 1.00 117.64 ? 234 ASP C OD1 1 ATOM 6498 O OD2 . ASP C 1 153 ? 129.785 -22.767 15.425 1.00 121.06 ? 234 ASP C OD2 1 ATOM 6499 N N . GLY C 1 154 ? 125.899 -18.985 15.713 1.00 76.46 ? 235 GLY C N 1 ATOM 6500 C CA . GLY C 1 154 ? 126.107 -17.690 16.341 1.00 75.42 ? 235 GLY C CA 1 ATOM 6501 C C . GLY C 1 154 ? 126.244 -16.467 15.439 1.00 77.35 ? 235 GLY C C 1 ATOM 6502 O O . GLY C 1 154 ? 125.807 -15.367 15.816 1.00 86.71 ? 235 GLY C O 1 ATOM 6503 N N . THR C 1 155 ? 126.862 -16.627 14.267 1.00 68.62 ? 236 THR C N 1 ATOM 6504 C CA . THR C 1 155 ? 127.009 -15.483 13.360 1.00 79.70 ? 236 THR C CA 1 ATOM 6505 C C . THR C 1 155 ? 125.914 -15.441 12.279 1.00 83.10 ? 236 THR C C 1 ATOM 6506 O O . THR C 1 155 ? 125.460 -16.482 11.790 1.00 86.48 ? 236 THR C O 1 ATOM 6507 C CB . THR C 1 155 ? 128.427 -15.382 12.725 1.00 90.36 ? 236 THR C CB 1 ATOM 6508 O OG1 . THR C 1 155 ? 128.554 -16.326 11.656 1.00 98.54 ? 236 THR C OG1 1 ATOM 6509 C CG2 . THR C 1 155 ? 129.518 -15.627 13.773 1.00 81.75 ? 236 THR C CG2 1 ATOM 6510 N N . CYS C 1 156 ? 125.481 -14.232 11.931 1.00 75.73 ? 237 CYS C N 1 ATOM 6511 C CA . CYS C 1 156 ? 124.461 -14.049 10.901 1.00 72.26 ? 237 CYS C CA 1 ATOM 6512 C C . CYS C 1 156 ? 125.004 -13.248 9.736 1.00 70.83 ? 237 CYS C C 1 ATOM 6513 O O . CYS C 1 156 ? 125.715 -12.261 9.925 1.00 83.09 ? 237 CYS C O 1 ATOM 6514 C CB . CYS C 1 156 ? 123.234 -13.343 11.468 1.00 72.97 ? 237 CYS C CB 1 ATOM 6515 S SG . CYS C 1 156 ? 122.405 -14.261 12.777 1.00 95.01 ? 237 CYS C SG 1 ATOM 6516 N N . TYR C 1 157 ? 124.661 -13.667 8.525 1.00 72.18 ? 238 TYR C N 1 ATOM 6517 C CA . TYR C 1 157 ? 125.121 -12.967 7.321 1.00 63.93 ? 238 TYR C CA 1 ATOM 6518 C C . TYR C 1 157 ? 123.954 -12.382 6.498 1.00 62.22 ? 238 TYR C C 1 ATOM 6519 O O . TYR C 1 157 ? 122.870 -12.968 6.414 1.00 60.20 ? 238 TYR C O 1 ATOM 6520 C CB . TYR C 1 157 ? 126.010 -13.885 6.473 1.00 47.07 ? 238 TYR C CB 1 ATOM 6521 C CG . TYR C 1 157 ? 127.116 -14.565 7.263 1.00 67.37 ? 238 TYR C CG 1 ATOM 6522 C CD1 . TYR C 1 157 ? 126.902 -15.793 7.897 1.00 69.30 ? 238 TYR C CD1 1 ATOM 6523 C CD2 . TYR C 1 157 ? 128.375 -13.981 7.379 1.00 69.37 ? 238 TYR C CD2 1 ATOM 6524 C CE1 . TYR C 1 157 ? 127.913 -16.418 8.618 1.00 67.27 ? 238 TYR C CE1 1 ATOM 6525 C CE2 . TYR C 1 157 ? 129.391 -14.601 8.095 1.00 78.05 ? 238 TYR C CE2 1 ATOM 6526 C CZ . TYR C 1 157 ? 129.157 -15.816 8.711 1.00 84.21 ? 238 TYR C CZ 1 ATOM 6527 O OH . TYR C 1 157 ? 130.169 -16.421 9.421 1.00 91.95 ? 238 TYR C OH 1 ATOM 6528 N N . THR C 1 158 ? 124.169 -11.202 5.929 1.00 62.01 ? 239 THR C N 1 ATOM 6529 C CA . THR C 1 158 ? 123.158 -10.564 5.098 1.00 58.92 ? 239 THR C CA 1 ATOM 6530 C C . THR C 1 158 ? 123.845 -9.704 4.048 1.00 62.91 ? 239 THR C C 1 ATOM 6531 O O . THR C 1 158 ? 125.022 -9.355 4.202 1.00 63.72 ? 239 THR C O 1 ATOM 6532 C CB . THR C 1 158 ? 122.175 -9.708 5.929 1.00 72.00 ? 239 THR C CB 1 ATOM 6533 O OG1 . THR C 1 158 ? 121.140 -9.194 5.077 1.00 82.82 ? 239 THR C OG1 1 ATOM 6534 C CG2 . THR C 1 158 ? 122.897 -8.548 6.612 1.00 58.58 ? 239 THR C CG2 1 ATOM 6535 N N . ILE C 1 159 ? 123.118 -9.378 2.978 1.00 63.74 ? 240 ILE C N 1 ATOM 6536 C CA . ILE C 1 159 ? 123.661 -8.548 1.908 1.00 56.04 ? 240 ILE C CA 1 ATOM 6537 C C . ILE C 1 159 ? 122.832 -7.274 1.761 1.00 53.94 ? 240 ILE C C 1 ATOM 6538 O O . ILE C 1 159 ? 121.608 -7.330 1.787 1.00 67.22 ? 240 ILE C O 1 ATOM 6539 C CB . ILE C 1 159 ? 123.730 -9.332 0.586 1.00 50.57 ? 240 ILE C CB 1 ATOM 6540 C CG1 . ILE C 1 159 ? 124.587 -10.586 0.780 1.00 65.24 ? 240 ILE C CG1 1 ATOM 6541 C CG2 . ILE C 1 159 ? 124.309 -8.455 -0.527 1.00 47.85 ? 240 ILE C CG2 1 ATOM 6542 C CD1 . ILE C 1 159 ? 124.360 -11.698 -0.233 1.00 64.17 ? 240 ILE C CD1 1 ATOM 6543 N N . ILE C 1 160 ? 123.500 -6.129 1.631 1.00 56.28 ? 241 ILE C N 1 ATOM 6544 C CA . ILE C 1 160 ? 122.807 -4.844 1.507 1.00 51.29 ? 241 ILE C CA 1 ATOM 6545 C C . ILE C 1 160 ? 123.227 -4.089 0.253 1.00 56.59 ? 241 ILE C C 1 ATOM 6546 O O . ILE C 1 160 ? 124.407 -4.048 -0.096 1.00 66.25 ? 241 ILE C O 1 ATOM 6547 C CB . ILE C 1 160 ? 123.025 -3.964 2.748 1.00 55.35 ? 241 ILE C CB 1 ATOM 6548 C CG1 . ILE C 1 160 ? 122.475 -4.682 3.985 1.00 45.18 ? 241 ILE C CG1 1 ATOM 6549 C CG2 . ILE C 1 160 ? 122.372 -2.584 2.581 1.00 46.29 ? 241 ILE C CG2 1 ATOM 6550 C CD1 . ILE C 1 160 ? 122.549 -3.863 5.239 1.00 65.67 ? 241 ILE C CD1 1 ATOM 6551 N N . ALA C 1 161 ? 122.246 -3.492 -0.419 1.00 59.40 ? 242 ALA C N 1 ATOM 6552 C CA . ALA C 1 161 ? 122.482 -2.795 -1.676 1.00 54.35 ? 242 ALA C CA 1 ATOM 6553 C C . ALA C 1 161 ? 122.472 -1.275 -1.509 1.00 56.87 ? 242 ALA C C 1 ATOM 6554 O O . ALA C 1 161 ? 121.647 -0.723 -0.773 1.00 59.34 ? 242 ALA C O 1 ATOM 6555 C CB . ALA C 1 161 ? 121.451 -3.218 -2.707 1.00 53.36 ? 242 ALA C CB 1 ATOM 6556 N N . ASP C 1 162 ? 123.393 -0.614 -2.207 1.00 55.97 ? 243 ASP C N 1 ATOM 6557 C CA . ASP C 1 162 ? 123.427 0.840 -2.298 1.00 57.59 ? 243 ASP C CA 1 ATOM 6558 C C . ASP C 1 162 ? 123.455 1.237 -3.778 1.00 63.55 ? 243 ASP C C 1 ATOM 6559 O O . ASP C 1 162 ? 123.404 0.371 -4.664 1.00 64.18 ? 243 ASP C O 1 ATOM 6560 C CB . ASP C 1 162 ? 124.661 1.392 -1.581 1.00 63.89 ? 243 ASP C CB 1 ATOM 6561 C CG . ASP C 1 162 ? 124.468 2.816 -1.081 1.00 75.81 ? 243 ASP C CG 1 ATOM 6562 O OD1 . ASP C 1 162 ? 123.572 3.530 -1.590 1.00 81.55 ? 243 ASP C OD1 1 ATOM 6563 O OD2 . ASP C 1 162 ? 125.227 3.224 -0.175 1.00 79.40 ? 243 ASP C OD2 1 ATOM 6564 N N . GLY C 1 163 ? 123.528 2.542 -4.044 1.00 62.44 ? 244 GLY C N 1 ATOM 6565 C CA . GLY C 1 163 ? 123.487 3.049 -5.404 1.00 62.39 ? 244 GLY C CA 1 ATOM 6566 C C . GLY C 1 163 ? 122.158 3.709 -5.713 1.00 64.20 ? 244 GLY C C 1 ATOM 6567 O O . GLY C 1 163 ? 121.142 3.393 -5.098 1.00 66.78 ? 244 GLY C O 1 ATOM 6568 N N . THR C 1 164 ? 122.159 4.628 -6.670 1.00 70.31 ? 245 THR C N 1 ATOM 6569 C CA . THR C 1 164 ? 120.937 5.347 -7.027 1.00 66.58 ? 245 THR C CA 1 ATOM 6570 C C . THR C 1 164 ? 120.273 4.789 -8.291 1.00 70.37 ? 245 THR C C 1 ATOM 6571 O O . THR C 1 164 ? 119.107 5.062 -8.556 1.00 69.25 ? 245 THR C O 1 ATOM 6572 C CB . THR C 1 164 ? 121.207 6.848 -7.204 1.00 75.21 ? 245 THR C CB 1 ATOM 6573 O OG1 . THR C 1 164 ? 122.358 7.038 -8.041 1.00 85.37 ? 245 THR C OG1 1 ATOM 6574 C CG2 . THR C 1 164 ? 121.449 7.504 -5.857 1.00 74.19 ? 245 THR C CG2 1 ATOM 6575 N N . THR C 1 165 ? 121.029 4.001 -9.050 1.00 72.71 ? 246 THR C N 1 ATOM 6576 C CA . THR C 1 165 ? 120.555 3.379 -10.280 1.00 77.74 ? 246 THR C CA 1 ATOM 6577 C C . THR C 1 165 ? 120.958 1.887 -10.273 1.00 72.46 ? 246 THR C C 1 ATOM 6578 O O . THR C 1 165 ? 121.890 1.511 -9.568 1.00 62.86 ? 246 THR C O 1 ATOM 6579 C CB . THR C 1 165 ? 121.119 4.144 -11.520 1.00 75.62 ? 246 THR C CB 1 ATOM 6580 O OG1 . THR C 1 165 ? 120.958 3.358 -12.705 1.00 92.31 ? 246 THR C OG1 1 ATOM 6581 C CG2 . THR C 1 165 ? 122.588 4.447 -11.345 1.00 69.60 ? 246 THR C CG2 1 ATOM 6582 N N . TYR C 1 166 ? 120.268 1.026 -11.023 1.00 76.55 ? 247 TYR C N 1 ATOM 6583 C CA . TYR C 1 166 ? 120.685 -0.385 -11.067 1.00 73.87 ? 247 TYR C CA 1 ATOM 6584 C C . TYR C 1 166 ? 121.952 -0.559 -11.895 1.00 74.97 ? 247 TYR C C 1 ATOM 6585 O O . TYR C 1 166 ? 122.636 -1.587 -11.802 1.00 72.00 ? 247 TYR C O 1 ATOM 6586 C CB . TYR C 1 166 ? 119.572 -1.298 -11.589 1.00 71.50 ? 247 TYR C CB 1 ATOM 6587 C CG . TYR C 1 166 ? 118.368 -1.324 -10.690 1.00 70.73 ? 247 TYR C CG 1 ATOM 6588 C CD1 . TYR C 1 166 ? 118.470 -1.779 -9.381 1.00 75.19 ? 247 TYR C CD1 1 ATOM 6589 C CD2 . TYR C 1 166 ? 117.131 -0.880 -11.134 1.00 65.62 ? 247 TYR C CD2 1 ATOM 6590 C CE1 . TYR C 1 166 ? 117.368 -1.797 -8.535 1.00 71.58 ? 247 TYR C CE1 1 ATOM 6591 C CE2 . TYR C 1 166 ? 116.018 -0.895 -10.294 1.00 68.45 ? 247 TYR C CE2 1 ATOM 6592 C CZ . TYR C 1 166 ? 116.148 -1.357 -8.997 1.00 74.35 ? 247 TYR C CZ 1 ATOM 6593 O OH . TYR C 1 166 ? 115.064 -1.377 -8.154 1.00 77.44 ? 247 TYR C OH 1 ATOM 6594 N N . THR C 1 167 ? 122.255 0.463 -12.695 1.00 65.72 ? 248 THR C N 1 ATOM 6595 C CA . THR C 1 167 ? 123.420 0.463 -13.572 1.00 71.85 ? 248 THR C CA 1 ATOM 6596 C C . THR C 1 167 ? 124.696 0.828 -12.818 1.00 76.66 ? 248 THR C C 1 ATOM 6597 O O . THR C 1 167 ? 125.803 0.639 -13.328 1.00 71.44 ? 248 THR C O 1 ATOM 6598 C CB . THR C 1 167 ? 123.226 1.441 -14.740 1.00 76.95 ? 248 THR C CB 1 ATOM 6599 O OG1 . THR C 1 167 ? 123.256 2.788 -14.249 1.00 77.90 ? 248 THR C OG1 1 ATOM 6600 C CG2 . THR C 1 167 ? 121.890 1.184 -15.426 1.00 65.19 ? 248 THR C CG2 1 ATOM 6601 N N . ALA C 1 168 ? 124.532 1.360 -11.611 1.00 78.19 ? 249 ALA C N 1 ATOM 6602 C CA . ALA C 1 168 ? 125.661 1.681 -10.752 1.00 69.81 ? 249 ALA C CA 1 ATOM 6603 C C . ALA C 1 168 ? 125.359 1.254 -9.318 1.00 71.59 ? 249 ALA C C 1 ATOM 6604 O O . ALA C 1 168 ? 125.375 2.073 -8.394 1.00 79.69 ? 249 ALA C O 1 ATOM 6605 C CB . ALA C 1 168 ? 125.965 3.171 -10.815 1.00 61.77 ? 249 ALA C CB 1 ATOM 6606 N N . SER C 1 169 ? 125.068 -0.030 -9.137 1.00 68.89 ? 250 SER C N 1 ATOM 6607 C CA . SER C 1 169 ? 124.725 -0.555 -7.817 1.00 71.48 ? 250 SER C CA 1 ATOM 6608 C C . SER C 1 169 ? 125.956 -1.089 -7.086 1.00 77.32 ? 250 SER C C 1 ATOM 6609 O O . SER C 1 169 ? 126.792 -1.781 -7.681 1.00 84.50 ? 250 SER C O 1 ATOM 6610 C CB . SER C 1 169 ? 123.681 -1.668 -7.948 1.00 68.27 ? 250 SER C CB 1 ATOM 6611 O OG . SER C 1 169 ? 124.019 -2.571 -8.986 1.00 88.60 ? 250 SER C OG 1 ATOM 6612 N N . SER C 1 170 ? 126.077 -0.767 -5.800 1.00 74.14 ? 251 SER C N 1 ATOM 6613 C CA . SER C 1 170 ? 127.112 -1.391 -4.981 1.00 73.98 ? 251 SER C CA 1 ATOM 6614 C C . SER C 1 170 ? 126.478 -2.362 -3.988 1.00 72.93 ? 251 SER C C 1 ATOM 6615 O O . SER C 1 170 ? 125.336 -2.169 -3.561 1.00 67.10 ? 251 SER C O 1 ATOM 6616 C CB . SER C 1 170 ? 127.964 -0.338 -4.271 1.00 73.29 ? 251 SER C CB 1 ATOM 6617 O OG . SER C 1 170 ? 127.169 0.536 -3.489 1.00 79.72 ? 251 SER C OG 1 ATOM 6618 N N . HIS C 1 171 ? 127.205 -3.416 -3.634 1.00 77.06 ? 252 HIS C N 1 ATOM 6619 C CA . HIS C 1 171 ? 126.669 -4.423 -2.713 1.00 69.85 ? 252 HIS C CA 1 ATOM 6620 C C . HIS C 1 171 ? 127.704 -4.857 -1.677 1.00 70.41 ? 252 HIS C C 1 ATOM 6621 O O . HIS C 1 171 ? 128.898 -4.946 -1.967 1.00 73.15 ? 252 HIS C O 1 ATOM 6622 C CB . HIS C 1 171 ? 126.118 -5.620 -3.499 1.00 55.13 ? 252 HIS C CB 1 ATOM 6623 C CG . HIS C 1 171 ? 125.223 -5.215 -4.629 1.00 67.33 ? 252 HIS C CG 1 ATOM 6624 N ND1 . HIS C 1 171 ? 123.883 -4.941 -4.458 1.00 68.15 ? 252 HIS C ND1 1 ATOM 6625 C CD2 . HIS C 1 171 ? 125.491 -4.978 -5.935 1.00 67.33 ? 252 HIS C CD2 1 ATOM 6626 C CE1 . HIS C 1 171 ? 123.358 -4.581 -5.615 1.00 63.06 ? 252 HIS C CE1 1 ATOM 6627 N NE2 . HIS C 1 171 ? 124.313 -4.594 -6.528 1.00 67.40 ? 252 HIS C NE2 1 ATOM 6628 N N . ARG C 1 172 ? 127.240 -5.107 -0.461 1.00 70.85 ? 253 ARG C N 1 ATOM 6629 C CA . ARG C 1 172 ? 128.134 -5.449 0.635 1.00 61.04 ? 253 ARG C CA 1 ATOM 6630 C C . ARG C 1 172 ? 127.701 -6.681 1.411 1.00 64.28 ? 253 ARG C C 1 ATOM 6631 O O . ARG C 1 172 ? 126.513 -6.888 1.676 1.00 63.89 ? 253 ARG C O 1 ATOM 6632 C CB . ARG C 1 172 ? 128.267 -4.265 1.588 1.00 58.69 ? 253 ARG C CB 1 ATOM 6633 C CG . ARG C 1 172 ? 129.124 -3.143 1.035 1.00 55.55 ? 253 ARG C CG 1 ATOM 6634 C CD . ARG C 1 172 ? 129.210 -2.014 2.026 1.00 60.31 ? 253 ARG C CD 1 ATOM 6635 N NE . ARG C 1 172 ? 130.160 -0.991 1.606 1.00 73.93 ? 253 ARG C NE 1 ATOM 6636 C CZ . ARG C 1 172 ? 130.515 0.043 2.365 1.00 79.51 ? 253 ARG C CZ 1 ATOM 6637 N NH1 . ARG C 1 172 ? 129.995 0.173 3.584 1.00 77.47 ? 253 ARG C NH1 1 ATOM 6638 N NH2 . ARG C 1 172 ? 131.392 0.940 1.911 1.00 60.01 ? 253 ARG C NH2 1 ATOM 6639 N N . LEU C 1 173 ? 128.686 -7.494 1.770 1.00 73.23 ? 254 LEU C N 1 ATOM 6640 C CA . LEU C 1 173 ? 128.469 -8.658 2.618 1.00 75.25 ? 254 LEU C CA 1 ATOM 6641 C C . LEU C 1 173 ? 128.641 -8.282 4.097 1.00 71.39 ? 254 LEU C C 1 ATOM 6642 O O . LEU C 1 173 ? 129.709 -7.849 4.511 1.00 71.60 ? 254 LEU C O 1 ATOM 6643 C CB . LEU C 1 173 ? 129.460 -9.755 2.240 1.00 73.62 ? 254 LEU C CB 1 ATOM 6644 C CG . LEU C 1 173 ? 128.857 -11.131 1.993 1.00 84.08 ? 254 LEU C CG 1 ATOM 6645 C CD1 . LEU C 1 173 ? 129.959 -12.175 1.889 1.00 83.60 ? 254 LEU C CD1 1 ATOM 6646 C CD2 . LEU C 1 173 ? 127.860 -11.490 3.094 1.00 81.78 ? 254 LEU C CD2 1 ATOM 6647 N N . TYR C 1 174 ? 127.587 -8.438 4.891 1.00 71.73 ? 255 TYR C N 1 ATOM 6648 C CA . TYR C 1 174 ? 127.671 -8.120 6.316 1.00 71.19 ? 255 TYR C CA 1 ATOM 6649 C C . TYR C 1 174 ? 127.654 -9.371 7.197 1.00 72.75 ? 255 TYR C C 1 ATOM 6650 O O . TYR C 1 174 ? 126.847 -10.284 6.992 1.00 65.96 ? 255 TYR C O 1 ATOM 6651 C CB . TYR C 1 174 ? 126.553 -7.158 6.742 1.00 60.20 ? 255 TYR C CB 1 ATOM 6652 C CG . TYR C 1 174 ? 126.787 -5.721 6.324 1.00 70.76 ? 255 TYR C CG 1 ATOM 6653 C CD1 . TYR C 1 174 ? 126.451 -5.287 5.044 1.00 83.52 ? 255 TYR C CD1 1 ATOM 6654 C CD2 . TYR C 1 174 ? 127.340 -4.798 7.206 1.00 62.08 ? 255 TYR C CD2 1 ATOM 6655 C CE1 . TYR C 1 174 ? 126.663 -3.984 4.648 1.00 86.52 ? 255 TYR C CE1 1 ATOM 6656 C CE2 . TYR C 1 174 ? 127.558 -3.485 6.815 1.00 67.98 ? 255 TYR C CE2 1 ATOM 6657 C CZ . TYR C 1 174 ? 127.215 -3.087 5.531 1.00 86.58 ? 255 TYR C CZ 1 ATOM 6658 O OH . TYR C 1 174 ? 127.416 -1.793 5.110 1.00 94.92 ? 255 TYR C OH 1 ATOM 6659 N N . ARG C 1 175 ? 128.558 -9.407 8.173 1.00 66.77 ? 256 ARG C N 1 ATOM 6660 C CA . ARG C 1 175 ? 128.550 -10.457 9.180 1.00 64.35 ? 256 ARG C CA 1 ATOM 6661 C C . ARG C 1 175 ? 128.075 -9.840 10.492 1.00 72.15 ? 256 ARG C C 1 ATOM 6662 O O . ARG C 1 175 ? 128.484 -8.730 10.841 1.00 82.51 ? 256 ARG C O 1 ATOM 6663 C CB . ARG C 1 175 ? 129.942 -11.081 9.321 1.00 73.83 ? 256 ARG C CB 1 ATOM 6664 C CG . ARG C 1 175 ? 130.426 -11.270 10.767 1.00 87.34 ? 256 ARG C CG 1 ATOM 6665 C CD . ARG C 1 175 ? 131.740 -12.054 10.892 1.00 80.98 ? 256 ARG C CD 1 ATOM 6666 N NE . ARG C 1 175 ? 132.785 -11.594 9.978 1.00 87.25 ? 256 ARG C NE 1 ATOM 6667 C CZ . ARG C 1 175 ? 133.426 -12.394 9.127 1.00 90.62 ? 256 ARG C CZ 1 ATOM 6668 N NH1 . ARG C 1 175 ? 133.126 -13.690 9.083 1.00 95.50 ? 256 ARG C NH1 1 ATOM 6669 N NH2 . ARG C 1 175 ? 134.363 -11.906 8.323 1.00 79.85 ? 256 ARG C NH2 1 ATOM 6670 N N . LEU C 1 176 ? 127.199 -10.542 11.206 1.00 66.31 ? 257 LEU C N 1 ATOM 6671 C CA . LEU C 1 176 ? 126.626 -9.998 12.435 1.00 72.89 ? 257 LEU C CA 1 ATOM 6672 C C . LEU C 1 176 ? 126.649 -10.975 13.590 1.00 80.56 ? 257 LEU C C 1 ATOM 6673 O O . LEU C 1 176 ? 126.274 -12.146 13.450 1.00 80.57 ? 257 LEU C O 1 ATOM 6674 C CB . LEU C 1 176 ? 125.184 -9.553 12.209 1.00 70.13 ? 257 LEU C CB 1 ATOM 6675 C CG . LEU C 1 176 ? 124.962 -8.420 11.212 1.00 70.83 ? 257 LEU C CG 1 ATOM 6676 C CD1 . LEU C 1 176 ? 123.660 -8.674 10.497 1.00 72.09 ? 257 LEU C CD1 1 ATOM 6677 C CD2 . LEU C 1 176 ? 124.924 -7.070 11.911 1.00 71.36 ? 257 LEU C CD2 1 ATOM 6678 N N . VAL C 1 177 ? 127.076 -10.478 14.741 1.00 79.42 ? 258 VAL C N 1 ATOM 6679 C CA . VAL C 1 177 ? 127.037 -11.274 15.949 1.00 74.40 ? 258 VAL C CA 1 ATOM 6680 C C . VAL C 1 177 ? 126.114 -10.608 16.964 1.00 68.96 ? 258 VAL C C 1 ATOM 6681 O O . VAL C 1 177 ? 126.280 -9.427 17.274 1.00 65.22 ? 258 VAL C O 1 ATOM 6682 C CB . VAL C 1 177 ? 128.440 -11.469 16.514 1.00 75.86 ? 258 VAL C CB 1 ATOM 6683 C CG1 . VAL C 1 177 ? 128.397 -11.468 18.021 1.00 84.35 ? 258 VAL C CG1 1 ATOM 6684 C CG2 . VAL C 1 177 ? 129.033 -12.767 15.991 1.00 77.00 ? 258 VAL C CG2 1 ATOM 6685 N N . ASN C 1 178 ? 125.122 -11.357 17.445 1.00 73.36 ? 259 ASN C N 1 ATOM 6686 C CA . ASN C 1 178 ? 124.188 -10.859 18.460 1.00 82.95 ? 259 ASN C CA 1 ATOM 6687 C C . ASN C 1 178 ? 123.615 -9.471 18.172 1.00 74.30 ? 259 ASN C C 1 ATOM 6688 O O . ASN C 1 178 ? 123.412 -8.674 19.087 1.00 73.62 ? 259 ASN C O 1 ATOM 6689 C CB . ASN C 1 178 ? 124.844 -10.834 19.848 1.00 88.51 ? 259 ASN C CB 1 ATOM 6690 C CG . ASN C 1 178 ? 125.164 -12.221 20.382 1.00 92.59 ? 259 ASN C CG 1 ATOM 6691 O OD1 . ASN C 1 178 ? 124.970 -13.239 19.699 1.00 90.61 ? 259 ASN C OD1 1 ATOM 6692 N ND2 . ASN C 1 178 ? 125.679 -12.261 21.618 1.00 98.34 ? 259 ASN C ND2 1 ATOM 6693 N N . GLY C 1 179 ? 123.378 -9.170 16.903 1.00 74.52 ? 260 GLY C N 1 ATOM 6694 C CA . GLY C 1 179 ? 122.790 -7.896 16.548 1.00 72.84 ? 260 GLY C CA 1 ATOM 6695 C C . GLY C 1 179 ? 123.778 -6.789 16.236 1.00 71.78 ? 260 GLY C C 1 ATOM 6696 O O . GLY C 1 179 ? 123.367 -5.682 15.877 1.00 73.49 ? 260 GLY C O 1 ATOM 6697 N N . THR C 1 180 ? 125.074 -7.058 16.370 1.00 67.97 ? 261 THR C N 1 ATOM 6698 C CA . THR C 1 180 ? 126.056 -6.043 15.988 1.00 75.48 ? 261 THR C CA 1 ATOM 6699 C C . THR C 1 180 ? 126.900 -6.473 14.796 1.00 76.53 ? 261 THR C C 1 ATOM 6700 O O . THR C 1 180 ? 127.117 -7.671 14.562 1.00 69.75 ? 261 THR C O 1 ATOM 6701 C CB . THR C 1 180 ? 126.958 -5.589 17.154 1.00 76.29 ? 261 THR C CB 1 ATOM 6702 O OG1 . THR C 1 180 ? 127.939 -6.596 17.422 1.00 90.78 ? 261 THR C OG1 1 ATOM 6703 C CG2 . THR C 1 180 ? 126.119 -5.292 18.411 1.00 74.11 ? 261 THR C CG2 1 ATOM 6704 N N . SER C 1 181 ? 127.348 -5.474 14.038 1.00 77.73 ? 262 SER C N 1 ATOM 6705 C CA . SER C 1 181 ? 128.124 -5.688 12.824 1.00 76.94 ? 262 SER C CA 1 ATOM 6706 C C . SER C 1 181 ? 129.517 -6.172 13.182 1.00 80.94 ? 262 SER C C 1 ATOM 6707 O O . SER C 1 181 ? 130.268 -5.470 13.848 1.00 73.33 ? 262 SER C O 1 ATOM 6708 C CB . SER C 1 181 ? 128.210 -4.388 12.025 1.00 74.87 ? 262 SER C CB 1 ATOM 6709 O OG . SER C 1 181 ? 129.040 -4.533 10.886 1.00 87.18 ? 262 SER C OG 1 ATOM 6710 N N . ALA C 1 182 ? 129.861 -7.379 12.753 1.00 87.43 ? 263 ALA C N 1 ATOM 6711 C CA . ALA C 1 182 ? 131.179 -7.921 13.049 1.00 85.40 ? 263 ALA C CA 1 ATOM 6712 C C . ALA C 1 182 ? 132.086 -7.808 11.834 1.00 87.12 ? 263 ALA C C 1 ATOM 6713 O O . ALA C 1 182 ? 132.877 -8.715 11.560 1.00 93.68 ? 263 ALA C O 1 ATOM 6714 C CB . ALA C 1 182 ? 131.069 -9.365 13.495 1.00 79.05 ? 263 ALA C CB 1 ATOM 6715 N N . GLY C 1 183 ? 131.959 -6.696 11.107 1.00 81.99 ? 264 GLY C N 1 ATOM 6716 C CA . GLY C 1 183 ? 132.741 -6.459 9.901 1.00 76.74 ? 264 GLY C CA 1 ATOM 6717 C C . GLY C 1 183 ? 131.987 -6.748 8.614 1.00 78.52 ? 264 GLY C C 1 ATOM 6718 O O . GLY C 1 183 ? 130.920 -7.368 8.628 1.00 78.96 ? 264 GLY C O 1 ATOM 6719 N N . TRP C 1 184 ? 132.551 -6.312 7.491 1.00 80.56 ? 265 TRP C N 1 ATOM 6720 C CA . TRP C 1 184 ? 131.886 -6.439 6.197 1.00 75.49 ? 265 TRP C CA 1 ATOM 6721 C C . TRP C 1 184 ? 132.873 -6.474 5.030 1.00 70.31 ? 265 TRP C C 1 ATOM 6722 O O . TRP C 1 184 ? 133.997 -5.992 5.150 1.00 79.50 ? 265 TRP C O 1 ATOM 6723 C CB . TRP C 1 184 ? 130.890 -5.284 6.009 1.00 82.48 ? 265 TRP C CB 1 ATOM 6724 C CG . TRP C 1 184 ? 131.532 -3.918 6.026 1.00 76.88 ? 265 TRP C CG 1 ATOM 6725 C CD1 . TRP C 1 184 ? 131.690 -3.095 7.109 1.00 72.58 ? 265 TRP C CD1 1 ATOM 6726 C CD2 . TRP C 1 184 ? 132.097 -3.222 4.909 1.00 75.17 ? 265 TRP C CD2 1 ATOM 6727 N NE1 . TRP C 1 184 ? 132.322 -1.933 6.733 1.00 71.67 ? 265 TRP C NE1 1 ATOM 6728 C CE2 . TRP C 1 184 ? 132.581 -1.985 5.387 1.00 75.55 ? 265 TRP C CE2 1 ATOM 6729 C CE3 . TRP C 1 184 ? 132.245 -3.526 3.551 1.00 76.87 ? 265 TRP C CE3 1 ATOM 6730 C CZ2 . TRP C 1 184 ? 133.201 -1.050 4.552 1.00 70.79 ? 265 TRP C CZ2 1 ATOM 6731 C CZ3 . TRP C 1 184 ? 132.863 -2.596 2.723 1.00 84.16 ? 265 TRP C CZ3 1 ATOM 6732 C CH2 . TRP C 1 184 ? 133.335 -1.373 3.229 1.00 74.57 ? 265 TRP C CH2 1 ATOM 6733 N N . LYS C 1 185 ? 132.455 -7.045 3.902 1.00 64.29 ? 266 LYS C N 1 ATOM 6734 C CA . LYS C 1 185 ? 133.275 -6.999 2.692 1.00 81.98 ? 266 LYS C CA 1 ATOM 6735 C C . LYS C 1 185 ? 132.518 -6.341 1.548 1.00 85.41 ? 266 LYS C C 1 ATOM 6736 O O . LYS C 1 185 ? 131.333 -6.602 1.351 1.00 84.61 ? 266 LYS C O 1 ATOM 6737 C CB . LYS C 1 185 ? 133.755 -8.403 2.275 1.00 83.36 ? 266 LYS C CB 1 ATOM 6738 C CG . LYS C 1 185 ? 134.725 -8.423 1.073 1.00 93.79 ? 266 LYS C CG 1 ATOM 6739 C CD . LYS C 1 185 ? 135.861 -7.396 1.231 1.00 114.64 ? 266 LYS C CD 1 ATOM 6740 C CE . LYS C 1 185 ? 136.859 -7.439 0.066 1.00 117.32 ? 266 LYS C CE 1 ATOM 6741 N NZ . LYS C 1 185 ? 138.000 -6.483 0.247 1.00 111.85 ? 266 LYS C NZ 1 ATOM 6742 N N . ALA C 1 186 ? 133.198 -5.476 0.799 1.00 85.22 ? 267 ALA C N 1 ATOM 6743 C CA . ALA C 1 186 ? 132.625 -4.968 -0.445 1.00 79.01 ? 267 ALA C CA 1 ATOM 6744 C C . ALA C 1 186 ? 132.676 -6.060 -1.523 1.00 84.29 ? 267 ALA C C 1 ATOM 6745 O O . ALA C 1 186 ? 133.692 -6.731 -1.704 1.00 93.63 ? 267 ALA C O 1 ATOM 6746 C CB . ALA C 1 186 ? 133.349 -3.710 -0.909 1.00 58.69 ? 267 ALA C CB 1 ATOM 6747 N N . LEU C 1 187 ? 131.571 -6.250 -2.228 1.00 78.92 ? 268 LEU C N 1 ATOM 6748 C CA . LEU C 1 187 ? 131.522 -7.271 -3.258 1.00 71.16 ? 268 LEU C CA 1 ATOM 6749 C C . LEU C 1 187 ? 131.788 -6.653 -4.623 1.00 77.60 ? 268 LEU C C 1 ATOM 6750 O O . LEU C 1 187 ? 131.344 -5.534 -4.915 1.00 84.95 ? 268 LEU C O 1 ATOM 6751 C CB . LEU C 1 187 ? 130.164 -7.967 -3.251 1.00 62.96 ? 268 LEU C CB 1 ATOM 6752 C CG . LEU C 1 187 ? 129.751 -8.652 -1.946 1.00 62.49 ? 268 LEU C CG 1 ATOM 6753 C CD1 . LEU C 1 187 ? 128.259 -8.805 -1.910 1.00 53.45 ? 268 LEU C CD1 1 ATOM 6754 C CD2 . LEU C 1 187 ? 130.401 -10.013 -1.807 1.00 72.31 ? 268 LEU C CD2 1 ATOM 6755 N N . ASP C 1 188 ? 132.513 -7.383 -5.460 1.00 71.43 ? 269 ASP C N 1 ATOM 6756 C CA . ASP C 1 188 ? 132.834 -6.884 -6.781 1.00 84.42 ? 269 ASP C CA 1 ATOM 6757 C C . ASP C 1 188 ? 131.699 -7.195 -7.755 1.00 82.56 ? 269 ASP C C 1 ATOM 6758 O O . ASP C 1 188 ? 131.619 -8.300 -8.295 1.00 81.42 ? 269 ASP C O 1 ATOM 6759 C CB . ASP C 1 188 ? 134.149 -7.491 -7.265 1.00 92.05 ? 269 ASP C CB 1 ATOM 6760 C CG . ASP C 1 188 ? 134.733 -6.747 -8.445 1.00 94.48 ? 269 ASP C CG 1 ATOM 6761 O OD1 . ASP C 1 188 ? 134.325 -5.586 -8.668 1.00 101.19 ? 269 ASP C OD1 1 ATOM 6762 O OD2 . ASP C 1 188 ? 135.598 -7.322 -9.141 1.00 88.21 ? 269 ASP C OD2 1 ATOM 6763 N N . THR C 1 189 ? 130.820 -6.217 -7.965 1.00 74.22 ? 270 THR C N 1 ATOM 6764 C CA . THR C 1 189 ? 129.713 -6.364 -8.910 1.00 67.40 ? 270 THR C CA 1 ATOM 6765 C C . THR C 1 189 ? 129.873 -5.445 -10.122 1.00 73.68 ? 270 THR C C 1 ATOM 6766 O O . THR C 1 189 ? 128.911 -4.811 -10.564 1.00 79.97 ? 270 THR C O 1 ATOM 6767 C CB . THR C 1 189 ? 128.353 -6.109 -8.238 1.00 60.33 ? 270 THR C CB 1 ATOM 6768 O OG1 . THR C 1 189 ? 128.382 -4.847 -7.552 1.00 63.10 ? 270 THR C OG1 1 ATOM 6769 C CG2 . THR C 1 189 ? 128.042 -7.227 -7.240 1.00 60.31 ? 270 THR C CG2 1 ATOM 6770 N N . THR C 1 190 ? 131.094 -5.371 -10.647 1.00 69.90 ? 271 THR C N 1 ATOM 6771 C CA . THR C 1 190 ? 131.361 -4.574 -11.840 1.00 78.50 ? 271 THR C CA 1 ATOM 6772 C C . THR C 1 190 ? 130.756 -5.258 -13.051 1.00 77.82 ? 271 THR C C 1 ATOM 6773 O O . THR C 1 190 ? 131.099 -6.407 -13.363 1.00 69.17 ? 271 THR C O 1 ATOM 6774 C CB . THR C 1 190 ? 132.873 -4.371 -12.089 1.00 85.61 ? 271 THR C CB 1 ATOM 6775 O OG1 . THR C 1 190 ? 133.623 -5.130 -11.133 1.00 92.13 ? 271 THR C OG1 1 ATOM 6776 C CG2 . THR C 1 190 ? 133.246 -2.896 -11.966 1.00 81.23 ? 271 THR C CG2 1 ATOM 6777 N N . GLY C 1 191 ? 129.838 -4.561 -13.718 1.00 78.99 ? 272 GLY C N 1 ATOM 6778 C CA . GLY C 1 191 ? 129.238 -5.074 -14.935 1.00 69.09 ? 272 GLY C CA 1 ATOM 6779 C C . GLY C 1 191 ? 127.897 -5.758 -14.765 1.00 76.26 ? 272 GLY C C 1 ATOM 6780 O O . GLY C 1 191 ? 127.263 -6.103 -15.760 1.00 76.16 ? 272 GLY C O 1 ATOM 6781 N N . PHE C 1 192 ? 127.466 -5.972 -13.519 1.00 78.51 ? 273 PHE C N 1 ATOM 6782 C CA . PHE C 1 192 ? 126.117 -6.491 -13.259 1.00 73.51 ? 273 PHE C CA 1 ATOM 6783 C C . PHE C 1 192 ? 125.446 -5.883 -12.031 1.00 79.55 ? 273 PHE C C 1 ATOM 6784 O O . PHE C 1 192 ? 126.053 -5.110 -11.283 1.00 87.56 ? 273 PHE C O 1 ATOM 6785 C CB . PHE C 1 192 ? 126.108 -8.020 -13.147 1.00 76.25 ? 273 PHE C CB 1 ATOM 6786 C CG . PHE C 1 192 ? 126.886 -8.555 -11.976 1.00 78.38 ? 273 PHE C CG 1 ATOM 6787 C CD1 . PHE C 1 192 ? 128.267 -8.653 -12.037 1.00 82.65 ? 273 PHE C CD1 1 ATOM 6788 C CD2 . PHE C 1 192 ? 126.239 -8.974 -10.822 1.00 77.82 ? 273 PHE C CD2 1 ATOM 6789 C CE1 . PHE C 1 192 ? 128.991 -9.148 -10.968 1.00 79.91 ? 273 PHE C CE1 1 ATOM 6790 C CE2 . PHE C 1 192 ? 126.960 -9.475 -9.742 1.00 79.56 ? 273 PHE C CE2 1 ATOM 6791 C CZ . PHE C 1 192 ? 128.338 -9.561 -9.818 1.00 73.59 ? 273 PHE C CZ 1 ATOM 6792 N N . ASN C 1 193 ? 124.182 -6.253 -11.842 1.00 74.07 ? 274 ASN C N 1 ATOM 6793 C CA . ASN C 1 193 ? 123.377 -5.805 -10.706 1.00 60.74 ? 274 ASN C CA 1 ATOM 6794 C C . ASN C 1 193 ? 122.924 -7.014 -9.860 1.00 62.42 ? 274 ASN C C 1 ATOM 6795 O O . ASN C 1 193 ? 122.623 -8.080 -10.410 1.00 68.41 ? 274 ASN C O 1 ATOM 6796 C CB . ASN C 1 193 ? 122.186 -4.985 -11.216 1.00 57.01 ? 274 ASN C CB 1 ATOM 6797 C CG . ASN C 1 193 ? 121.206 -4.617 -10.116 1.00 66.20 ? 274 ASN C CG 1 ATOM 6798 O OD1 . ASN C 1 193 ? 121.594 -4.077 -9.069 1.00 63.23 ? 274 ASN C OD1 1 ATOM 6799 N ND2 . ASN C 1 193 ? 119.920 -4.917 -10.342 1.00 55.47 ? 274 ASN C ND2 1 ATOM 6800 N N . PHE C 1 194 ? 122.878 -6.853 -8.534 1.00 56.68 ? 275 PHE C N 1 ATOM 6801 C CA . PHE C 1 194 ? 122.637 -7.979 -7.628 1.00 58.07 ? 275 PHE C CA 1 ATOM 6802 C C . PHE C 1 194 ? 121.651 -7.652 -6.493 1.00 63.54 ? 275 PHE C C 1 ATOM 6803 O O . PHE C 1 194 ? 122.052 -7.526 -5.323 1.00 61.04 ? 275 PHE C O 1 ATOM 6804 C CB . PHE C 1 194 ? 123.974 -8.449 -7.037 1.00 52.70 ? 275 PHE C CB 1 ATOM 6805 C CG . PHE C 1 194 ? 123.930 -9.836 -6.454 1.00 64.05 ? 275 PHE C CG 1 ATOM 6806 C CD1 . PHE C 1 194 ? 123.805 -10.943 -7.287 1.00 64.36 ? 275 PHE C CD1 1 ATOM 6807 C CD2 . PHE C 1 194 ? 124.029 -10.042 -5.075 1.00 58.90 ? 275 PHE C CD2 1 ATOM 6808 C CE1 . PHE C 1 194 ? 123.770 -12.243 -6.763 1.00 61.36 ? 275 PHE C CE1 1 ATOM 6809 C CE2 . PHE C 1 194 ? 123.999 -11.333 -4.548 1.00 54.15 ? 275 PHE C CE2 1 ATOM 6810 C CZ . PHE C 1 194 ? 123.867 -12.437 -5.397 1.00 58.16 ? 275 PHE C CZ 1 ATOM 6811 N N . GLU C 1 195 ? 120.368 -7.524 -6.826 1.00 61.64 ? 276 GLU C N 1 ATOM 6812 C CA . GLU C 1 195 ? 119.356 -7.131 -5.824 1.00 62.54 ? 276 GLU C CA 1 ATOM 6813 C C . GLU C 1 195 ? 118.613 -8.313 -5.210 1.00 54.30 ? 276 GLU C C 1 ATOM 6814 O O . GLU C 1 195 ? 118.497 -9.366 -5.834 1.00 55.12 ? 276 GLU C O 1 ATOM 6815 C CB . GLU C 1 195 ? 118.331 -6.159 -6.427 1.00 56.44 ? 276 GLU C CB 1 ATOM 6816 C CG . GLU C 1 195 ? 118.931 -4.890 -7.022 1.00 58.09 ? 276 GLU C CG 1 ATOM 6817 C CD . GLU C 1 195 ? 119.279 -3.836 -5.982 1.00 76.28 ? 276 GLU C CD 1 ATOM 6818 O OE1 . GLU C 1 195 ? 118.667 -3.815 -4.887 1.00 93.36 ? 276 GLU C OE1 1 ATOM 6819 O OE2 . GLU C 1 195 ? 120.168 -3.013 -6.275 1.00 86.19 ? 276 GLU C OE2 1 ATOM 6820 N N . PHE C 1 196 ? 118.118 -8.126 -3.986 1.00 55.06 ? 277 PHE C N 1 ATOM 6821 C CA . PHE C 1 196 ? 117.272 -9.126 -3.306 1.00 55.03 ? 277 PHE C CA 1 ATOM 6822 C C . PHE C 1 196 ? 117.778 -10.565 -3.294 1.00 57.35 ? 277 PHE C C 1 ATOM 6823 O O . PHE C 1 196 ? 117.012 -11.470 -3.635 1.00 56.68 ? 277 PHE C O 1 ATOM 6824 C CB . PHE C 1 196 ? 115.879 -9.154 -3.954 1.00 44.80 ? 277 PHE C CB 1 ATOM 6825 C CG . PHE C 1 196 ? 115.356 -7.807 -4.288 1.00 59.91 ? 277 PHE C CG 1 ATOM 6826 C CD1 . PHE C 1 196 ? 115.137 -6.872 -3.279 1.00 75.37 ? 277 PHE C CD1 1 ATOM 6827 C CD2 . PHE C 1 196 ? 115.096 -7.457 -5.602 1.00 61.43 ? 277 PHE C CD2 1 ATOM 6828 C CE1 . PHE C 1 196 ? 114.658 -5.606 -3.573 1.00 64.86 ? 277 PHE C CE1 1 ATOM 6829 C CE2 . PHE C 1 196 ? 114.607 -6.187 -5.909 1.00 57.13 ? 277 PHE C CE2 1 ATOM 6830 C CZ . PHE C 1 196 ? 114.392 -5.261 -4.883 1.00 53.75 ? 277 PHE C CZ 1 ATOM 6831 N N . PRO C 1 197 ? 119.045 -10.798 -2.906 1.00 57.80 ? 278 PRO C N 1 ATOM 6832 C CA . PRO C 1 197 ? 119.437 -12.218 -2.902 1.00 57.05 ? 278 PRO C CA 1 ATOM 6833 C C . PRO C 1 197 ? 118.623 -13.063 -1.906 1.00 60.29 ? 278 PRO C C 1 ATOM 6834 O O . PRO C 1 197 ? 118.318 -12.599 -0.799 1.00 56.08 ? 278 PRO C O 1 ATOM 6835 C CB . PRO C 1 197 ? 120.913 -12.180 -2.482 1.00 61.39 ? 278 PRO C CB 1 ATOM 6836 C CG . PRO C 1 197 ? 121.100 -10.841 -1.806 1.00 54.89 ? 278 PRO C CG 1 ATOM 6837 C CD . PRO C 1 197 ? 120.138 -9.905 -2.474 1.00 44.76 ? 278 PRO C CD 1 ATOM 6838 N N . THR C 1 198 ? 118.238 -14.267 -2.325 1.00 58.71 ? 279 THR C N 1 ATOM 6839 C CA . THR C 1 198 ? 117.664 -15.257 -1.420 1.00 61.28 ? 279 THR C CA 1 ATOM 6840 C C . THR C 1 198 ? 118.686 -16.357 -1.292 1.00 59.05 ? 279 THR C C 1 ATOM 6841 O O . THR C 1 198 ? 119.335 -16.753 -2.271 1.00 65.70 ? 279 THR C O 1 ATOM 6842 C CB . THR C 1 198 ? 116.329 -15.854 -1.920 1.00 67.42 ? 279 THR C CB 1 ATOM 6843 O OG1 . THR C 1 198 ? 116.358 -15.982 -3.349 1.00 62.46 ? 279 THR C OG1 1 ATOM 6844 C CG2 . THR C 1 198 ? 115.204 -14.961 -1.552 1.00 82.68 ? 279 THR C CG2 1 ATOM 6845 N N . CYS C 1 199 ? 118.835 -16.859 -0.082 1.00 58.86 ? 280 CYS C N 1 ATOM 6846 C CA . CYS C 1 199 ? 120.000 -17.667 0.201 1.00 61.75 ? 280 CYS C CA 1 ATOM 6847 C C . CYS C 1 199 ? 119.663 -18.977 0.894 1.00 70.57 ? 280 CYS C C 1 ATOM 6848 O O . CYS C 1 199 ? 118.592 -19.125 1.481 1.00 72.67 ? 280 CYS C O 1 ATOM 6849 C CB . CYS C 1 199 ? 120.998 -16.848 1.030 1.00 59.43 ? 280 CYS C CB 1 ATOM 6850 S SG . CYS C 1 199 ? 121.326 -15.177 0.379 1.00 80.19 ? 280 CYS C SG 1 ATOM 6851 N N . TYR C 1 200 ? 120.590 -19.926 0.816 1.00 76.02 ? 281 TYR C N 1 ATOM 6852 C CA . TYR C 1 200 ? 120.524 -21.147 1.612 1.00 65.00 ? 281 TYR C CA 1 ATOM 6853 C C . TYR C 1 200 ? 121.935 -21.556 2.010 1.00 61.34 ? 281 TYR C C 1 ATOM 6854 O O . TYR C 1 200 ? 122.911 -21.123 1.404 1.00 71.85 ? 281 TYR C O 1 ATOM 6855 C CB . TYR C 1 200 ? 119.816 -22.269 0.849 1.00 60.87 ? 281 TYR C CB 1 ATOM 6856 C CG . TYR C 1 200 ? 120.526 -22.735 -0.402 1.00 67.36 ? 281 TYR C CG 1 ATOM 6857 C CD1 . TYR C 1 200 ? 120.398 -22.045 -1.605 1.00 66.38 ? 281 TYR C CD1 1 ATOM 6858 C CD2 . TYR C 1 200 ? 121.305 -23.881 -0.386 1.00 57.67 ? 281 TYR C CD2 1 ATOM 6859 C CE1 . TYR C 1 200 ? 121.047 -22.484 -2.748 1.00 66.30 ? 281 TYR C CE1 1 ATOM 6860 C CE2 . TYR C 1 200 ? 121.955 -24.321 -1.518 1.00 67.11 ? 281 TYR C CE2 1 ATOM 6861 C CZ . TYR C 1 200 ? 121.822 -23.619 -2.695 1.00 71.41 ? 281 TYR C CZ 1 ATOM 6862 O OH . TYR C 1 200 ? 122.463 -24.059 -3.821 1.00 84.50 ? 281 TYR C OH 1 ATOM 6863 N N . TYR C 1 201 ? 122.046 -22.377 3.041 1.00 60.34 ? 282 TYR C N 1 ATOM 6864 C CA . TYR C 1 201 ? 123.350 -22.882 3.467 1.00 63.73 ? 282 TYR C CA 1 ATOM 6865 C C . TYR C 1 201 ? 123.476 -24.371 3.171 1.00 69.06 ? 282 TYR C C 1 ATOM 6866 O O . TYR C 1 201 ? 122.558 -25.154 3.454 1.00 74.73 ? 282 TYR C O 1 ATOM 6867 C CB . TYR C 1 201 ? 123.549 -22.651 4.975 1.00 62.29 ? 282 TYR C CB 1 ATOM 6868 C CG . TYR C 1 201 ? 124.829 -23.236 5.531 1.00 66.83 ? 282 TYR C CG 1 ATOM 6869 C CD1 . TYR C 1 201 ? 126.025 -22.536 5.431 1.00 73.00 ? 282 TYR C CD1 1 ATOM 6870 C CD2 . TYR C 1 201 ? 124.847 -24.486 6.150 1.00 67.19 ? 282 TYR C CD2 1 ATOM 6871 C CE1 . TYR C 1 201 ? 127.205 -23.056 5.928 1.00 80.50 ? 282 TYR C CE1 1 ATOM 6872 C CE2 . TYR C 1 201 ? 126.029 -25.020 6.652 1.00 70.11 ? 282 TYR C CE2 1 ATOM 6873 C CZ . TYR C 1 201 ? 127.207 -24.297 6.539 1.00 83.76 ? 282 TYR C CZ 1 ATOM 6874 O OH . TYR C 1 201 ? 128.401 -24.797 7.027 1.00 79.69 ? 282 TYR C OH 1 ATOM 6875 N N . THR C 1 202 ? 124.605 -24.759 2.592 1.00 67.28 ? 283 THR C N 1 ATOM 6876 C CA . THR C 1 202 ? 124.982 -26.163 2.596 1.00 82.34 ? 283 THR C CA 1 ATOM 6877 C C . THR C 1 202 ? 126.466 -26.305 2.295 1.00 79.59 ? 283 THR C C 1 ATOM 6878 O O . THR C 1 202 ? 127.042 -25.438 1.632 1.00 80.12 ? 283 THR C O 1 ATOM 6879 C CB . THR C 1 202 ? 124.146 -26.979 1.596 1.00 87.72 ? 283 THR C CB 1 ATOM 6880 O OG1 . THR C 1 202 ? 124.383 -28.380 1.797 1.00 93.49 ? 283 THR C OG1 1 ATOM 6881 C CG2 . THR C 1 202 ? 124.487 -26.581 0.163 1.00 81.37 ? 283 THR C CG2 1 ATOM 6882 N N . SER C 1 203 ? 127.074 -27.381 2.805 1.00 81.97 ? 284 SER C N 1 ATOM 6883 C CA . SER C 1 203 ? 128.466 -27.742 2.497 1.00 82.20 ? 284 SER C CA 1 ATOM 6884 C C . SER C 1 203 ? 129.469 -26.633 2.807 1.00 81.12 ? 284 SER C C 1 ATOM 6885 O O . SER C 1 203 ? 130.438 -26.440 2.065 1.00 77.74 ? 284 SER C O 1 ATOM 6886 C CB . SER C 1 203 ? 128.608 -28.163 1.025 1.00 88.47 ? 284 SER C CB 1 ATOM 6887 O OG . SER C 1 203 ? 127.983 -29.411 0.770 1.00 95.59 ? 284 SER C OG 1 ATOM 6888 N N . GLY C 1 204 ? 129.226 -25.895 3.887 1.00 74.84 ? 285 GLY C N 1 ATOM 6889 C CA . GLY C 1 204 ? 130.143 -24.848 4.294 1.00 81.18 ? 285 GLY C CA 1 ATOM 6890 C C . GLY C 1 204 ? 130.022 -23.516 3.568 1.00 89.58 ? 285 GLY C C 1 ATOM 6891 O O . GLY C 1 204 ? 130.707 -22.552 3.923 1.00 90.71 ? 285 GLY C O 1 ATOM 6892 N N . LYS C 1 205 ? 129.166 -23.441 2.555 1.00 86.38 ? 286 LYS C N 1 ATOM 6893 C CA . LYS C 1 205 ? 128.962 -22.173 1.858 1.00 83.00 ? 286 LYS C CA 1 ATOM 6894 C C . LYS C 1 205 ? 127.535 -21.636 1.998 1.00 80.69 ? 286 LYS C C 1 ATOM 6895 O O . LYS C 1 205 ? 126.561 -22.399 2.015 1.00 77.92 ? 286 LYS C O 1 ATOM 6896 C CB . LYS C 1 205 ? 129.333 -22.302 0.374 1.00 79.83 ? 286 LYS C CB 1 ATOM 6897 C CG . LYS C 1 205 ? 130.824 -22.438 0.128 1.00 92.99 ? 286 LYS C CG 1 ATOM 6898 C CD . LYS C 1 205 ? 131.123 -23.131 -1.196 1.00 103.70 ? 286 LYS C CD 1 ATOM 6899 C CE . LYS C 1 205 ? 132.562 -23.629 -1.236 1.00 114.02 ? 286 LYS C CE 1 ATOM 6900 N NZ . LYS C 1 205 ? 133.166 -23.683 0.137 1.00 123.60 ? 286 LYS C NZ 1 ATOM 6901 N N . VAL C 1 206 ? 127.418 -20.318 2.118 1.00 78.28 ? 287 VAL C N 1 ATOM 6902 C CA . VAL C 1 206 ? 126.134 -19.675 1.889 1.00 73.41 ? 287 VAL C CA 1 ATOM 6903 C C . VAL C 1 206 ? 125.993 -19.473 0.390 1.00 69.26 ? 287 VAL C C 1 ATOM 6904 O O . VAL C 1 206 ? 126.922 -19.000 -0.264 1.00 60.76 ? 287 VAL C O 1 ATOM 6905 C CB . VAL C 1 206 ? 126.021 -18.312 2.568 1.00 67.06 ? 287 VAL C CB 1 ATOM 6906 C CG1 . VAL C 1 206 ? 124.666 -17.679 2.240 1.00 71.48 ? 287 VAL C CG1 1 ATOM 6907 C CG2 . VAL C 1 206 ? 126.182 -18.455 4.061 1.00 63.09 ? 287 VAL C CG2 1 ATOM 6908 N N . LYS C 1 207 ? 124.840 -19.847 -0.157 1.00 67.92 ? 288 LYS C N 1 ATOM 6909 C CA . LYS C 1 207 ? 124.598 -19.680 -1.582 1.00 71.49 ? 288 LYS C CA 1 ATOM 6910 C C . LYS C 1 207 ? 123.379 -18.781 -1.844 1.00 78.08 ? 288 LYS C C 1 ATOM 6911 O O . LYS C 1 207 ? 122.310 -18.999 -1.273 1.00 74.54 ? 288 LYS C O 1 ATOM 6912 C CB . LYS C 1 207 ? 124.475 -21.053 -2.248 1.00 66.67 ? 288 LYS C CB 1 ATOM 6913 C CG . LYS C 1 207 ? 125.687 -21.947 -2.020 1.00 62.83 ? 288 LYS C CG 1 ATOM 6914 C CD . LYS C 1 207 ? 125.627 -23.171 -2.927 1.00 66.83 ? 288 LYS C CD 1 ATOM 6915 C CE . LYS C 1 207 ? 126.619 -24.259 -2.529 1.00 71.86 ? 288 LYS C CE 1 ATOM 6916 N NZ . LYS C 1 207 ? 126.107 -25.618 -2.930 1.00 80.53 ? 288 LYS C NZ 1 ATOM 6917 N N . CYS C 1 208 ? 123.550 -17.770 -2.693 1.00 69.81 ? 289 CYS C N 1 ATOM 6918 C CA . CYS C 1 208 ? 122.490 -16.790 -2.919 1.00 69.39 ? 289 CYS C CA 1 ATOM 6919 C C . CYS C 1 208 ? 122.142 -16.633 -4.396 1.00 70.60 ? 289 CYS C C 1 ATOM 6920 O O . CYS C 1 208 ? 123.007 -16.745 -5.263 1.00 79.09 ? 289 CYS C O 1 ATOM 6921 C CB . CYS C 1 208 ? 122.898 -15.436 -2.342 1.00 58.82 ? 289 CYS C CB 1 ATOM 6922 S SG . CYS C 1 208 ? 123.192 -15.494 -0.603 1.00 94.36 ? 289 CYS C SG 1 ATOM 6923 N N . THR C 1 209 ? 120.871 -16.372 -4.679 1.00 67.78 ? 290 THR C N 1 ATOM 6924 C CA . THR C 1 209 ? 120.442 -16.056 -6.038 1.00 51.40 ? 290 THR C CA 1 ATOM 6925 C C . THR C 1 209 ? 119.956 -14.631 -6.052 1.00 54.09 ? 290 THR C C 1 ATOM 6926 O O . THR C 1 209 ? 119.035 -14.284 -5.323 1.00 62.31 ? 290 THR C O 1 ATOM 6927 C CB . THR C 1 209 ? 119.294 -16.935 -6.495 1.00 52.01 ? 290 THR C CB 1 ATOM 6928 O OG1 . THR C 1 209 ? 119.713 -18.306 -6.486 1.00 74.49 ? 290 THR C OG1 1 ATOM 6929 C CG2 . THR C 1 209 ? 118.882 -16.546 -7.898 1.00 64.19 ? 290 THR C CG2 1 ATOM 6930 N N . GLY C 1 210 ? 120.583 -13.792 -6.865 1.00 52.71 ? 291 GLY C N 1 ATOM 6931 C CA . GLY C 1 210 ? 120.180 -12.401 -6.938 1.00 60.67 ? 291 GLY C CA 1 ATOM 6932 C C . GLY C 1 210 ? 119.281 -12.114 -8.130 1.00 61.32 ? 291 GLY C C 1 ATOM 6933 O O . GLY C 1 210 ? 118.955 -13.016 -8.914 1.00 63.26 ? 291 GLY C O 1 ATOM 6934 N N . THR C 1 211 ? 118.884 -10.849 -8.252 1.00 54.88 ? 292 THR C N 1 ATOM 6935 C CA . THR C 1 211 ? 118.082 -10.366 -9.371 1.00 51.39 ? 292 THR C CA 1 ATOM 6936 C C . THR C 1 211 ? 118.829 -9.234 -10.090 1.00 60.52 ? 292 THR C C 1 ATOM 6937 O O . THR C 1 211 ? 119.200 -8.230 -9.461 1.00 52.34 ? 292 THR C O 1 ATOM 6938 C CB . THR C 1 211 ? 116.690 -9.857 -8.888 1.00 53.53 ? 292 THR C CB 1 ATOM 6939 O OG1 . THR C 1 211 ? 116.011 -10.907 -8.186 1.00 69.23 ? 292 THR C OG1 1 ATOM 6940 C CG2 . THR C 1 211 ? 115.828 -9.400 -10.067 1.00 54.47 ? 292 THR C CG2 1 ATOM 6941 N N . ASN C 1 212 ? 119.066 -9.393 -11.393 1.00 58.94 ? 293 ASN C N 1 ATOM 6942 C CA . ASN C 1 212 ? 119.686 -8.311 -12.154 1.00 57.61 ? 293 ASN C CA 1 ATOM 6943 C C . ASN C 1 212 ? 118.641 -7.467 -12.890 1.00 61.75 ? 293 ASN C C 1 ATOM 6944 O O . ASN C 1 212 ? 118.098 -7.893 -13.939 1.00 52.21 ? 293 ASN C O 1 ATOM 6945 C CB . ASN C 1 212 ? 120.689 -8.862 -13.165 1.00 59.51 ? 293 ASN C CB 1 ATOM 6946 C CG . ASN C 1 212 ? 121.640 -7.805 -13.682 1.00 64.95 ? 293 ASN C CG 1 ATOM 6947 O OD1 . ASN C 1 212 ? 121.278 -6.639 -13.856 1.00 64.57 ? 293 ASN C OD1 1 ATOM 6948 N ND2 . ASN C 1 212 ? 122.874 -8.215 -13.941 1.00 72.82 ? 293 ASN C ND2 1 ATOM 6949 N N . LEU C 1 213 ? 118.382 -6.271 -12.353 1.00 56.42 ? 294 LEU C N 1 ATOM 6950 C CA . LEU C 1 213 ? 117.424 -5.346 -12.962 1.00 53.56 ? 294 LEU C CA 1 ATOM 6951 C C . LEU C 1 213 ? 118.013 -4.449 -14.065 1.00 56.13 ? 294 LEU C C 1 ATOM 6952 O O . LEU C 1 213 ? 117.350 -3.541 -14.589 1.00 54.68 ? 294 LEU C O 1 ATOM 6953 C CB . LEU C 1 213 ? 116.660 -4.521 -11.908 1.00 43.29 ? 294 LEU C CB 1 ATOM 6954 C CG . LEU C 1 213 ? 115.759 -5.368 -11.001 1.00 50.05 ? 294 LEU C CG 1 ATOM 6955 C CD1 . LEU C 1 213 ? 116.526 -5.839 -9.766 1.00 56.35 ? 294 LEU C CD1 1 ATOM 6956 C CD2 . LEU C 1 213 ? 114.504 -4.611 -10.614 1.00 42.20 ? 294 LEU C CD2 1 ATOM 6957 N N . TRP C 1 214 ? 119.253 -4.734 -14.431 1.00 57.92 ? 295 TRP C N 1 ATOM 6958 C CA . TRP C 1 214 ? 119.987 -3.899 -15.365 1.00 64.45 ? 295 TRP C CA 1 ATOM 6959 C C . TRP C 1 214 ? 120.149 -4.528 -16.746 1.00 66.73 ? 295 TRP C C 1 ATOM 6960 O O . TRP C 1 214 ? 119.583 -4.029 -17.720 1.00 61.45 ? 295 TRP C O 1 ATOM 6961 C CB . TRP C 1 214 ? 121.358 -3.563 -14.771 1.00 65.54 ? 295 TRP C CB 1 ATOM 6962 C CG . TRP C 1 214 ? 122.279 -2.797 -15.671 1.00 65.41 ? 295 TRP C CG 1 ATOM 6963 C CD1 . TRP C 1 214 ? 121.946 -2.067 -16.781 1.00 62.16 ? 295 TRP C CD1 1 ATOM 6964 C CD2 . TRP C 1 214 ? 123.699 -2.682 -15.524 1.00 67.50 ? 295 TRP C CD2 1 ATOM 6965 N NE1 . TRP C 1 214 ? 123.076 -1.508 -17.332 1.00 66.07 ? 295 TRP C NE1 1 ATOM 6966 C CE2 . TRP C 1 214 ? 124.166 -1.870 -16.583 1.00 69.94 ? 295 TRP C CE2 1 ATOM 6967 C CE3 . TRP C 1 214 ? 124.621 -3.187 -14.598 1.00 48.24 ? 295 TRP C CE3 1 ATOM 6968 C CZ2 . TRP C 1 214 ? 125.515 -1.551 -16.742 1.00 50.14 ? 295 TRP C CZ2 1 ATOM 6969 C CZ3 . TRP C 1 214 ? 125.961 -2.871 -14.758 1.00 55.10 ? 295 TRP C CZ3 1 ATOM 6970 C CH2 . TRP C 1 214 ? 126.395 -2.061 -15.825 1.00 65.31 ? 295 TRP C CH2 1 ATOM 6971 N N . ASN C 1 215 ? 120.911 -5.621 -16.818 1.00 69.79 ? 296 ASN C N 1 ATOM 6972 C CA . ASN C 1 215 ? 121.421 -6.141 -18.088 1.00 62.90 ? 296 ASN C CA 1 ATOM 6973 C C . ASN C 1 215 ? 121.464 -7.672 -18.197 1.00 61.79 ? 296 ASN C C 1 ATOM 6974 O O . ASN C 1 215 ? 122.280 -8.211 -18.944 1.00 76.94 ? 296 ASN C O 1 ATOM 6975 C CB . ASN C 1 215 ? 122.845 -5.622 -18.282 1.00 57.07 ? 296 ASN C CB 1 ATOM 6976 C CG . ASN C 1 215 ? 123.733 -5.934 -17.094 1.00 68.37 ? 296 ASN C CG 1 ATOM 6977 O OD1 . ASN C 1 215 ? 123.288 -6.519 -16.109 1.00 70.61 ? 296 ASN C OD1 1 ATOM 6978 N ND2 . ASN C 1 215 ? 124.994 -5.560 -17.186 1.00 67.44 ? 296 ASN C ND2 1 ATOM 6979 N N . ASP C 1 216 ? 120.615 -8.372 -17.452 1.00 51.52 ? 297 ASP C N 1 ATOM 6980 C CA . ASP C 1 216 ? 120.601 -9.840 -17.487 1.00 63.13 ? 297 ASP C CA 1 ATOM 6981 C C . ASP C 1 216 ? 119.226 -10.413 -17.198 1.00 62.38 ? 297 ASP C C 1 ATOM 6982 O O . ASP C 1 216 ? 118.662 -10.125 -16.156 1.00 71.66 ? 297 ASP C O 1 ATOM 6983 C CB . ASP C 1 216 ? 121.578 -10.423 -16.456 1.00 69.69 ? 297 ASP C CB 1 ATOM 6984 C CG . ASP C 1 216 ? 121.829 -11.912 -16.671 1.00 77.88 ? 297 ASP C CG 1 ATOM 6985 O OD1 . ASP C 1 216 ? 121.346 -12.458 -17.698 1.00 78.29 ? 297 ASP C OD1 1 ATOM 6986 O OD2 . ASP C 1 216 ? 122.529 -12.528 -15.833 1.00 78.33 ? 297 ASP C OD2 1 ATOM 6987 N N . ALA C 1 217 ? 118.721 -11.251 -18.102 1.00 64.66 ? 298 ALA C N 1 ATOM 6988 C CA . ALA C 1 217 ? 117.447 -11.960 -17.920 1.00 49.15 ? 298 ALA C CA 1 ATOM 6989 C C . ALA C 1 217 ? 117.624 -13.325 -17.260 1.00 58.36 ? 298 ALA C C 1 ATOM 6990 O O . ALA C 1 217 ? 116.634 -13.997 -16.941 1.00 63.99 ? 298 ALA C O 1 ATOM 6991 C CB . ALA C 1 217 ? 116.736 -12.138 -19.245 1.00 50.25 ? 298 ALA C CB 1 ATOM 6992 N N . LYS C 1 218 ? 118.876 -13.754 -17.110 1.00 61.21 ? 299 LYS C N 1 ATOM 6993 C CA . LYS C 1 218 ? 119.211 -14.849 -16.199 1.00 67.57 ? 299 LYS C CA 1 ATOM 6994 C C . LYS C 1 218 ? 119.423 -14.258 -14.810 1.00 59.85 ? 299 LYS C C 1 ATOM 6995 O O . LYS C 1 218 ? 119.336 -13.041 -14.624 1.00 69.14 ? 299 LYS C O 1 ATOM 6996 C CB . LYS C 1 218 ? 120.492 -15.559 -16.630 1.00 67.46 ? 299 LYS C CB 1 ATOM 6997 C CG . LYS C 1 218 ? 120.441 -16.310 -17.946 1.00 70.50 ? 299 LYS C CG 1 ATOM 6998 C CD . LYS C 1 218 ? 121.817 -16.916 -18.189 1.00 77.24 ? 299 LYS C CD 1 ATOM 6999 C CE . LYS C 1 218 ? 122.066 -17.343 -19.619 1.00 83.62 ? 299 LYS C CE 1 ATOM 7000 N NZ . LYS C 1 218 ? 123.466 -17.844 -19.762 1.00 88.28 ? 299 LYS C NZ 1 ATOM 7001 N N . ARG C 1 219 ? 119.708 -15.102 -13.829 1.00 62.28 ? 300 ARG C N 1 ATOM 7002 C CA . ARG C 1 219 ? 119.907 -14.588 -12.474 1.00 59.00 ? 300 ARG C CA 1 ATOM 7003 C C . ARG C 1 219 ? 121.359 -14.723 -12.017 1.00 69.61 ? 300 ARG C C 1 ATOM 7004 O O . ARG C 1 219 ? 121.983 -15.758 -12.237 1.00 74.10 ? 300 ARG C O 1 ATOM 7005 C CB . ARG C 1 219 ? 118.943 -15.263 -11.486 1.00 47.64 ? 300 ARG C CB 1 ATOM 7006 C CG . ARG C 1 219 ? 117.455 -15.072 -11.822 1.00 42.61 ? 300 ARG C CG 1 ATOM 7007 C CD . ARG C 1 219 ? 116.555 -15.727 -10.783 1.00 49.13 ? 300 ARG C CD 1 ATOM 7008 N NE . ARG C 1 219 ? 115.164 -15.288 -10.891 1.00 53.56 ? 300 ARG C NE 1 ATOM 7009 C CZ . ARG C 1 219 ? 114.717 -14.099 -10.490 1.00 53.67 ? 300 ARG C CZ 1 ATOM 7010 N NH1 . ARG C 1 219 ? 115.544 -13.215 -9.947 1.00 47.95 ? 300 ARG C NH1 1 ATOM 7011 N NH2 . ARG C 1 219 ? 113.437 -13.788 -10.635 1.00 66.73 ? 300 ARG C NH2 1 ATOM 7012 N N . PRO C 1 220 ? 121.908 -13.667 -11.388 1.00 76.36 ? 301 PRO C N 1 ATOM 7013 C CA . PRO C 1 220 ? 123.277 -13.766 -10.859 1.00 57.30 ? 301 PRO C CA 1 ATOM 7014 C C . PRO C 1 220 ? 123.333 -14.655 -9.615 1.00 56.89 ? 301 PRO C C 1 ATOM 7015 O O . PRO C 1 220 ? 122.328 -14.776 -8.895 1.00 58.08 ? 301 PRO C O 1 ATOM 7016 C CB . PRO C 1 220 ? 123.620 -12.311 -10.506 1.00 56.57 ? 301 PRO C CB 1 ATOM 7017 C CG . PRO C 1 220 ? 122.283 -11.651 -10.254 1.00 63.45 ? 301 PRO C CG 1 ATOM 7018 C CD . PRO C 1 220 ? 121.335 -12.315 -11.219 1.00 75.20 ? 301 PRO C CD 1 ATOM 7019 N N . PHE C 1 221 ? 124.496 -15.259 -9.370 1.00 55.71 ? 302 PHE C N 1 ATOM 7020 C CA . PHE C 1 221 ? 124.672 -16.207 -8.272 1.00 59.76 ? 302 PHE C CA 1 ATOM 7021 C C . PHE C 1 221 ? 125.902 -15.906 -7.405 1.00 66.78 ? 302 PHE C C 1 ATOM 7022 O O . PHE C 1 221 ? 126.937 -15.482 -7.910 1.00 72.93 ? 302 PHE C O 1 ATOM 7023 C CB . PHE C 1 221 ? 124.790 -17.616 -8.836 1.00 67.05 ? 302 PHE C CB 1 ATOM 7024 C CG . PHE C 1 221 ? 124.425 -18.689 -7.861 1.00 72.19 ? 302 PHE C CG 1 ATOM 7025 C CD1 . PHE C 1 221 ? 123.095 -19.014 -7.647 1.00 81.44 ? 302 PHE C CD1 1 ATOM 7026 C CD2 . PHE C 1 221 ? 125.403 -19.384 -7.164 1.00 79.31 ? 302 PHE C CD2 1 ATOM 7027 C CE1 . PHE C 1 221 ? 122.737 -20.011 -6.750 1.00 84.11 ? 302 PHE C CE1 1 ATOM 7028 C CE2 . PHE C 1 221 ? 125.056 -20.386 -6.261 1.00 85.27 ? 302 PHE C CE2 1 ATOM 7029 C CZ . PHE C 1 221 ? 123.719 -20.698 -6.055 1.00 85.46 ? 302 PHE C CZ 1 ATOM 7030 N N . LEU C 1 222 ? 125.783 -16.153 -6.104 1.00 58.26 ? 303 LEU C N 1 ATOM 7031 C CA . LEU C 1 222 ? 126.863 -15.917 -5.160 1.00 62.84 ? 303 LEU C CA 1 ATOM 7032 C C . LEU C 1 222 ? 127.039 -17.137 -4.258 1.00 75.65 ? 303 LEU C C 1 ATOM 7033 O O . LEU C 1 222 ? 126.065 -17.821 -3.918 1.00 75.33 ? 303 LEU C O 1 ATOM 7034 C CB . LEU C 1 222 ? 126.527 -14.710 -4.273 1.00 74.54 ? 303 LEU C CB 1 ATOM 7035 C CG . LEU C 1 222 ? 127.582 -13.679 -3.855 1.00 76.88 ? 303 LEU C CG 1 ATOM 7036 C CD1 . LEU C 1 222 ? 127.173 -13.017 -2.545 1.00 74.59 ? 303 LEU C CD1 1 ATOM 7037 C CD2 . LEU C 1 222 ? 128.983 -14.253 -3.758 1.00 73.71 ? 303 LEU C CD2 1 ATOM 7038 N N . GLU C 1 223 ? 128.285 -17.414 -3.885 1.00 83.61 ? 304 GLU C N 1 ATOM 7039 C CA . GLU C 1 223 ? 128.577 -18.333 -2.788 1.00 76.31 ? 304 GLU C CA 1 ATOM 7040 C C . GLU C 1 223 ? 129.704 -17.729 -1.948 1.00 72.29 ? 304 GLU C C 1 ATOM 7041 O O . GLU C 1 223 ? 130.556 -17.003 -2.470 1.00 71.43 ? 304 GLU C O 1 ATOM 7042 C CB . GLU C 1 223 ? 128.914 -19.742 -3.292 1.00 76.12 ? 304 GLU C CB 1 ATOM 7043 C CG . GLU C 1 223 ? 130.265 -19.890 -3.985 1.00 100.10 ? 304 GLU C CG 1 ATOM 7044 C CD . GLU C 1 223 ? 130.512 -21.311 -4.482 1.00 114.48 ? 304 GLU C CD 1 ATOM 7045 O OE1 . GLU C 1 223 ? 129.520 -22.060 -4.662 1.00 116.12 ? 304 GLU C OE1 1 ATOM 7046 O OE2 . GLU C 1 223 ? 131.699 -21.673 -4.683 1.00 112.57 ? 304 GLU C OE2 1 ATOM 7047 N N . PHE C 1 224 ? 129.688 -17.993 -0.647 1.00 64.40 ? 305 PHE C N 1 ATOM 7048 C CA . PHE C 1 224 ? 130.727 -17.473 0.238 1.00 74.08 ? 305 PHE C CA 1 ATOM 7049 C C . PHE C 1 224 ? 130.794 -18.239 1.560 1.00 78.47 ? 305 PHE C C 1 ATOM 7050 O O . PHE C 1 224 ? 129.794 -18.815 2.008 1.00 67.94 ? 305 PHE C O 1 ATOM 7051 C CB . PHE C 1 224 ? 130.523 -15.974 0.504 1.00 65.85 ? 305 PHE C CB 1 ATOM 7052 C CG . PHE C 1 224 ? 129.234 -15.647 1.205 1.00 71.77 ? 305 PHE C CG 1 ATOM 7053 C CD1 . PHE C 1 224 ? 128.079 -15.403 0.479 1.00 70.03 ? 305 PHE C CD1 1 ATOM 7054 C CD2 . PHE C 1 224 ? 129.175 -15.578 2.601 1.00 75.03 ? 305 PHE C CD2 1 ATOM 7055 C CE1 . PHE C 1 224 ? 126.888 -15.095 1.133 1.00 72.86 ? 305 PHE C CE1 1 ATOM 7056 C CE2 . PHE C 1 224 ? 127.983 -15.271 3.264 1.00 58.94 ? 305 PHE C CE2 1 ATOM 7057 C CZ . PHE C 1 224 ? 126.846 -15.025 2.535 1.00 62.72 ? 305 PHE C CZ 1 ATOM 7058 N N . ASP C 1 225 ? 131.977 -18.250 2.172 1.00 76.58 ? 306 ASP C N 1 ATOM 7059 C CA . ASP C 1 225 ? 132.150 -18.871 3.482 1.00 74.62 ? 306 ASP C CA 1 ATOM 7060 C C . ASP C 1 225 ? 132.316 -17.798 4.550 1.00 74.44 ? 306 ASP C C 1 ATOM 7061 O O . ASP C 1 225 ? 132.216 -16.601 4.246 1.00 74.06 ? 306 ASP C O 1 ATOM 7062 C CB . ASP C 1 225 ? 133.313 -19.879 3.495 1.00 89.46 ? 306 ASP C CB 1 ATOM 7063 C CG . ASP C 1 225 ? 134.593 -19.322 2.883 1.00 93.97 ? 306 ASP C CG 1 ATOM 7064 O OD1 . ASP C 1 225 ? 134.956 -18.165 3.191 1.00 92.02 ? 306 ASP C OD1 1 ATOM 7065 O OD2 . ASP C 1 225 ? 135.238 -20.052 2.095 1.00 94.59 ? 306 ASP C OD2 1 ATOM 7066 N N . GLN C 1 226 ? 132.565 -18.227 5.790 1.00 73.86 ? 307 GLN C N 1 ATOM 7067 C CA . GLN C 1 226 ? 132.605 -17.310 6.930 1.00 80.92 ? 307 GLN C CA 1 ATOM 7068 C C . GLN C 1 226 ? 133.788 -16.347 6.887 1.00 85.95 ? 307 GLN C C 1 ATOM 7069 O O . GLN C 1 226 ? 133.766 -15.303 7.546 1.00 87.22 ? 307 GLN C O 1 ATOM 7070 C CB . GLN C 1 226 ? 132.580 -18.075 8.256 1.00 91.23 ? 307 GLN C CB 1 ATOM 7071 C CG . GLN C 1 226 ? 133.615 -19.178 8.387 1.00 101.32 ? 307 GLN C CG 1 ATOM 7072 C CD . GLN C 1 226 ? 133.404 -20.008 9.639 1.00 114.32 ? 307 GLN C CD 1 ATOM 7073 O OE1 . GLN C 1 226 ? 132.791 -19.553 10.606 1.00 118.70 ? 307 GLN C OE1 1 ATOM 7074 N NE2 . GLN C 1 226 ? 133.904 -21.236 9.624 1.00 112.19 ? 307 GLN C NE2 1 ATOM 7075 N N . SER C 1 227 ? 134.809 -16.693 6.105 1.00 84.30 ? 309 SER C N 1 ATOM 7076 C CA . SER C 1 227 ? 135.983 -15.839 5.948 1.00 91.35 ? 309 SER C CA 1 ATOM 7077 C C . SER C 1 227 ? 135.777 -14.780 4.859 1.00 99.29 ? 309 SER C C 1 ATOM 7078 O O . SER C 1 227 ? 136.722 -14.105 4.456 1.00 115.08 ? 309 SER C O 1 ATOM 7079 C CB . SER C 1 227 ? 137.229 -16.691 5.663 1.00 94.53 ? 309 SER C CB 1 ATOM 7080 O OG . SER C 1 227 ? 136.960 -17.723 4.729 1.00 106.28 ? 309 SER C OG 1 ATOM 7081 N N . PHE C 1 228 ? 134.532 -14.641 4.404 1.00 95.39 ? 310 PHE C N 1 ATOM 7082 C CA . PHE C 1 228 ? 134.165 -13.754 3.290 1.00 88.67 ? 310 PHE C CA 1 ATOM 7083 C C . PHE C 1 228 ? 134.904 -14.049 1.985 1.00 83.68 ? 310 PHE C C 1 ATOM 7084 O O . PHE C 1 228 ? 135.175 -13.153 1.180 1.00 73.32 ? 310 PHE C O 1 ATOM 7085 C CB . PHE C 1 228 ? 134.301 -12.276 3.663 1.00 85.75 ? 310 PHE C CB 1 ATOM 7086 C CG . PHE C 1 228 ? 133.218 -11.783 4.572 1.00 86.40 ? 310 PHE C CG 1 ATOM 7087 C CD1 . PHE C 1 228 ? 132.056 -12.520 4.756 1.00 82.49 ? 310 PHE C CD1 1 ATOM 7088 C CD2 . PHE C 1 228 ? 133.358 -10.579 5.245 1.00 92.20 ? 310 PHE C CD2 1 ATOM 7089 C CE1 . PHE C 1 228 ? 131.051 -12.064 5.598 1.00 79.60 ? 310 PHE C CE1 1 ATOM 7090 C CE2 . PHE C 1 228 ? 132.355 -10.118 6.091 1.00 91.10 ? 310 PHE C CE2 1 ATOM 7091 C CZ . PHE C 1 228 ? 131.201 -10.862 6.260 1.00 82.37 ? 310 PHE C CZ 1 ATOM 7092 N N . THR C 1 229 ? 135.216 -15.317 1.772 1.00 84.07 ? 311 THR C N 1 ATOM 7093 C CA . THR C 1 229 ? 135.754 -15.738 0.495 1.00 89.42 ? 311 THR C CA 1 ATOM 7094 C C . THR C 1 229 ? 134.591 -16.071 -0.449 1.00 89.90 ? 311 THR C C 1 ATOM 7095 O O . THR C 1 229 ? 133.847 -17.045 -0.250 1.00 81.10 ? 311 THR C O 1 ATOM 7096 C CB . THR C 1 229 ? 136.703 -16.935 0.660 1.00 83.04 ? 311 THR C CB 1 ATOM 7097 O OG1 . THR C 1 229 ? 137.756 -16.586 1.573 1.00 82.08 ? 311 THR C OG1 1 ATOM 7098 C CG2 . THR C 1 229 ? 137.288 -17.328 -0.683 1.00 66.80 ? 311 THR C CG2 1 ATOM 7099 N N . TYR C 1 230 ? 134.432 -15.244 -1.472 1.00 89.76 ? 312 TYR C N 1 ATOM 7100 C CA . TYR C 1 230 ? 133.289 -15.377 -2.359 1.00 88.95 ? 312 TYR C CA 1 ATOM 7101 C C . TYR C 1 230 ? 133.692 -15.567 -3.809 1.00 87.58 ? 312 TYR C C 1 ATOM 7102 O O . TYR C 1 230 ? 134.786 -15.187 -4.240 1.00 85.88 ? 312 TYR C O 1 ATOM 7103 C CB . TYR C 1 230 ? 132.364 -14.148 -2.254 1.00 76.85 ? 312 TYR C CB 1 ATOM 7104 C CG . TYR C 1 230 ? 132.960 -12.873 -2.829 1.00 75.12 ? 312 TYR C CG 1 ATOM 7105 C CD1 . TYR C 1 230 ? 133.726 -12.027 -2.034 1.00 74.87 ? 312 TYR C CD1 1 ATOM 7106 C CD2 . TYR C 1 230 ? 132.757 -12.516 -4.163 1.00 67.82 ? 312 TYR C CD2 1 ATOM 7107 C CE1 . TYR C 1 230 ? 134.275 -10.863 -2.547 1.00 82.10 ? 312 TYR C CE1 1 ATOM 7108 C CE2 . TYR C 1 230 ? 133.308 -11.351 -4.684 1.00 71.93 ? 312 TYR C CE2 1 ATOM 7109 C CZ . TYR C 1 230 ? 134.065 -10.527 -3.871 1.00 77.88 ? 312 TYR C CZ 1 ATOM 7110 O OH . TYR C 1 230 ? 134.616 -9.365 -4.369 1.00 77.02 ? 312 TYR C OH 1 ATOM 7111 N N . THR C 1 231 ? 132.777 -16.164 -4.551 1.00 72.65 ? 313 THR C N 1 ATOM 7112 C CA . THR C 1 231 ? 132.828 -16.111 -5.985 1.00 85.20 ? 313 THR C CA 1 ATOM 7113 C C . THR C 1 231 ? 131.399 -15.905 -6.510 1.00 88.05 ? 313 THR C C 1 ATOM 7114 O O . THR C 1 231 ? 130.442 -16.512 -6.007 1.00 75.75 ? 313 THR C O 1 ATOM 7115 C CB . THR C 1 231 ? 133.540 -17.354 -6.579 1.00 87.04 ? 313 THR C CB 1 ATOM 7116 O OG1 . THR C 1 231 ? 133.049 -17.609 -7.903 1.00 95.03 ? 313 THR C OG1 1 ATOM 7117 C CG2 . THR C 1 231 ? 133.319 -18.579 -5.708 1.00 75.94 ? 313 THR C CG2 1 ATOM 7118 N N . PHE C 1 232 ? 131.259 -14.993 -7.472 1.00 82.11 ? 314 PHE C N 1 ATOM 7119 C CA . PHE C 1 232 ? 130.001 -14.797 -8.174 1.00 73.89 ? 314 PHE C CA 1 ATOM 7120 C C . PHE C 1 232 ? 129.976 -15.745 -9.372 1.00 80.67 ? 314 PHE C C 1 ATOM 7121 O O . PHE C 1 232 ? 130.972 -15.870 -10.087 1.00 83.42 ? 314 PHE C O 1 ATOM 7122 C CB . PHE C 1 232 ? 129.876 -13.355 -8.681 1.00 69.20 ? 314 PHE C CB 1 ATOM 7123 C CG . PHE C 1 232 ? 129.403 -12.363 -7.644 1.00 73.25 ? 314 PHE C CG 1 ATOM 7124 C CD1 . PHE C 1 232 ? 128.052 -12.246 -7.333 1.00 67.45 ? 314 PHE C CD1 1 ATOM 7125 C CD2 . PHE C 1 232 ? 130.304 -11.516 -7.007 1.00 82.59 ? 314 PHE C CD2 1 ATOM 7126 C CE1 . PHE C 1 232 ? 127.608 -11.318 -6.389 1.00 67.81 ? 314 PHE C CE1 1 ATOM 7127 C CE2 . PHE C 1 232 ? 129.864 -10.584 -6.063 1.00 85.17 ? 314 PHE C CE2 1 ATOM 7128 C CZ . PHE C 1 232 ? 128.513 -10.490 -5.758 1.00 76.77 ? 314 PHE C CZ 1 ATOM 7129 N N . LYS C 1 233 ? 128.850 -16.413 -9.603 1.00 71.21 ? 315 LYS C N 1 ATOM 7130 C CA . LYS C 1 233 ? 128.743 -17.265 -10.782 1.00 69.60 ? 315 LYS C CA 1 ATOM 7131 C C . LYS C 1 233 ? 127.608 -16.835 -11.705 1.00 76.79 ? 315 LYS C C 1 ATOM 7132 O O . LYS C 1 233 ? 126.734 -16.065 -11.319 1.00 84.31 ? 315 LYS C O 1 ATOM 7133 C CB . LYS C 1 233 ? 128.596 -18.731 -10.383 1.00 66.10 ? 315 LYS C CB 1 ATOM 7134 C CG . LYS C 1 233 ? 129.568 -19.154 -9.299 1.00 72.42 ? 315 LYS C CG 1 ATOM 7135 C CD . LYS C 1 233 ? 129.866 -20.639 -9.371 1.00 78.41 ? 315 LYS C CD 1 ATOM 7136 C CE . LYS C 1 233 ? 130.875 -21.047 -8.313 1.00 81.97 ? 315 LYS C CE 1 ATOM 7137 N NZ . LYS C 1 233 ? 131.105 -22.519 -8.337 1.00 89.21 ? 315 LYS C NZ 1 ATOM 7138 N N . GLU C 1 234 ? 127.640 -17.316 -12.939 1.00 79.40 ? 316 GLU C N 1 ATOM 7139 C CA . GLU C 1 234 ? 126.557 -17.049 -13.874 1.00 76.91 ? 316 GLU C CA 1 ATOM 7140 C C . GLU C 1 234 ? 126.071 -18.352 -14.478 1.00 79.50 ? 316 GLU C C 1 ATOM 7141 O O . GLU C 1 234 ? 126.849 -19.086 -15.083 1.00 93.60 ? 316 GLU C O 1 ATOM 7142 C CB . GLU C 1 234 ? 127.003 -16.110 -14.985 1.00 68.53 ? 316 GLU C CB 1 ATOM 7143 C CG . GLU C 1 234 ? 125.957 -15.941 -16.070 1.00 80.32 ? 316 GLU C CG 1 ATOM 7144 C CD . GLU C 1 234 ? 124.918 -14.877 -15.725 1.00 94.15 ? 316 GLU C CD 1 ATOM 7145 O OE1 . GLU C 1 234 ? 125.103 -14.164 -14.713 1.00 97.51 ? 316 GLU C OE1 1 ATOM 7146 O OE2 . GLU C 1 234 ? 123.924 -14.746 -16.472 1.00 91.48 ? 316 GLU C OE2 1 ATOM 7147 N N . PRO C 1 235 ? 124.777 -18.643 -14.315 1.00 77.46 ? 317 PRO C N 1 ATOM 7148 C CA . PRO C 1 235 ? 124.197 -19.892 -14.816 1.00 81.76 ? 317 PRO C CA 1 ATOM 7149 C C . PRO C 1 235 ? 124.368 -20.032 -16.324 1.00 84.59 ? 317 PRO C C 1 ATOM 7150 O O . PRO C 1 235 ? 124.171 -19.078 -17.089 1.00 83.77 ? 317 PRO C O 1 ATOM 7151 C CB . PRO C 1 235 ? 122.713 -19.780 -14.433 1.00 73.91 ? 317 PRO C CB 1 ATOM 7152 C CG . PRO C 1 235 ? 122.471 -18.322 -14.217 1.00 70.82 ? 317 PRO C CG 1 ATOM 7153 C CD . PRO C 1 235 ? 123.767 -17.767 -13.701 1.00 73.49 ? 317 PRO C CD 1 ATOM 7154 N N . CYS C 1 236 ? 124.757 -21.233 -16.730 1.00 88.40 ? 318 CYS C N 1 ATOM 7155 C CA . CYS C 1 236 ? 125.040 -21.527 -18.122 1.00 87.07 ? 318 CYS C CA 1 ATOM 7156 C C . CYS C 1 236 ? 123.804 -22.137 -18.786 1.00 81.72 ? 318 CYS C C 1 ATOM 7157 O O . CYS C 1 236 ? 123.898 -22.818 -19.808 1.00 87.98 ? 318 CYS C O 1 ATOM 7158 C CB . CYS C 1 236 ? 126.253 -22.465 -18.213 1.00 76.61 ? 318 CYS C CB 1 ATOM 7159 S SG . CYS C 1 236 ? 127.783 -21.777 -17.500 1.00 110.38 ? 318 CYS C SG 1 ATOM 7160 N N . LEU C 1 237 ? 122.639 -21.867 -18.206 1.00 71.98 ? 319 LEU C N 1 ATOM 7161 C CA . LEU C 1 237 ? 121.397 -22.483 -18.667 1.00 65.44 ? 319 LEU C CA 1 ATOM 7162 C C . LEU C 1 237 ? 120.439 -21.520 -19.376 1.00 73.79 ? 319 LEU C C 1 ATOM 7163 O O . LEU C 1 237 ? 120.071 -20.464 -18.850 1.00 82.02 ? 319 LEU C O 1 ATOM 7164 C CB . LEU C 1 237 ? 120.692 -23.174 -17.498 1.00 71.97 ? 319 LEU C CB 1 ATOM 7165 C CG . LEU C 1 237 ? 120.893 -24.687 -17.362 1.00 76.26 ? 319 LEU C CG 1 ATOM 7166 C CD1 . LEU C 1 237 ? 122.285 -25.107 -17.784 1.00 78.77 ? 319 LEU C CD1 1 ATOM 7167 C CD2 . LEU C 1 237 ? 120.637 -25.118 -15.935 1.00 72.19 ? 319 LEU C CD2 1 ATOM 7168 N N . GLY C 1 238 ? 120.033 -21.915 -20.577 1.00 82.35 ? 320 GLY C N 1 ATOM 7169 C CA . GLY C 1 238 ? 119.161 -21.115 -21.409 1.00 75.20 ? 320 GLY C CA 1 ATOM 7170 C C . GLY C 1 238 ? 117.725 -21.075 -20.926 1.00 77.38 ? 320 GLY C C 1 ATOM 7171 O O . GLY C 1 238 ? 116.888 -20.437 -21.567 1.00 68.94 ? 320 GLY C O 1 ATOM 7172 N N . PHE C 1 239 ? 117.439 -21.758 -19.812 1.00 79.66 ? 321 PHE C N 1 ATOM 7173 C CA . PHE C 1 239 ? 116.135 -21.665 -19.126 1.00 77.17 ? 321 PHE C CA 1 ATOM 7174 C C . PHE C 1 239 ? 116.104 -20.406 -18.243 1.00 69.21 ? 321 PHE C C 1 ATOM 7175 O O . PHE C 1 239 ? 116.573 -20.409 -17.099 1.00 61.94 ? 321 PHE C O 1 ATOM 7176 C CB . PHE C 1 239 ? 115.891 -22.913 -18.280 1.00 72.30 ? 321 PHE C CB 1 ATOM 7177 C CG . PHE C 1 239 ? 114.487 -23.029 -17.732 1.00 68.74 ? 321 PHE C CG 1 ATOM 7178 C CD1 . PHE C 1 239 ? 113.427 -23.336 -18.572 1.00 57.83 ? 321 PHE C CD1 1 ATOM 7179 C CD2 . PHE C 1 239 ? 114.234 -22.879 -16.365 1.00 64.48 ? 321 PHE C CD2 1 ATOM 7180 C CE1 . PHE C 1 239 ? 112.131 -23.472 -18.075 1.00 60.61 ? 321 PHE C CE1 1 ATOM 7181 C CE2 . PHE C 1 239 ? 112.938 -23.007 -15.862 1.00 61.16 ? 321 PHE C CE2 1 ATOM 7182 C CZ . PHE C 1 239 ? 111.885 -23.302 -16.716 1.00 61.69 ? 321 PHE C CZ 1 ATOM 7183 N N . LEU C 1 240 ? 115.542 -19.336 -18.787 1.00 58.48 ? 322 LEU C N 1 ATOM 7184 C CA . LEU C 1 240 ? 115.714 -18.009 -18.218 1.00 59.98 ? 322 LEU C CA 1 ATOM 7185 C C . LEU C 1 240 ? 114.909 -17.778 -16.950 1.00 58.51 ? 322 LEU C C 1 ATOM 7186 O O . LEU C 1 240 ? 113.673 -17.808 -16.972 1.00 62.81 ? 322 LEU C O 1 ATOM 7187 C CB . LEU C 1 240 ? 115.361 -16.951 -19.266 1.00 63.41 ? 322 LEU C CB 1 ATOM 7188 C CG . LEU C 1 240 ? 116.232 -17.003 -20.518 1.00 69.72 ? 322 LEU C CG 1 ATOM 7189 C CD1 . LEU C 1 240 ? 115.957 -15.805 -21.414 1.00 68.99 ? 322 LEU C CD1 1 ATOM 7190 C CD2 . LEU C 1 240 ? 117.702 -17.071 -20.132 1.00 73.95 ? 322 LEU C CD2 1 ATOM 7191 N N . GLY C 1 241 ? 115.625 -17.496 -15.863 1.00 54.65 ? 323 GLY C N 1 ATOM 7192 C CA . GLY C 1 241 ? 115.032 -17.360 -14.547 1.00 52.09 ? 323 GLY C CA 1 ATOM 7193 C C . GLY C 1 241 ? 114.268 -16.081 -14.227 1.00 61.33 ? 323 GLY C C 1 ATOM 7194 O O . GLY C 1 241 ? 113.287 -16.121 -13.460 1.00 55.10 ? 323 GLY C O 1 ATOM 7195 N N . ASP C 1 242 ? 114.697 -14.945 -14.778 1.00 52.84 ? 324 ASP C N 1 ATOM 7196 C CA . ASP C 1 242 ? 114.070 -13.675 -14.404 1.00 51.65 ? 324 ASP C CA 1 ATOM 7197 C C . ASP C 1 242 ? 112.724 -13.443 -15.082 1.00 54.87 ? 324 ASP C C 1 ATOM 7198 O O . ASP C 1 242 ? 112.332 -14.150 -16.025 1.00 56.06 ? 324 ASP C O 1 ATOM 7199 C CB . ASP C 1 242 ? 114.991 -12.476 -14.683 1.00 58.16 ? 324 ASP C CB 1 ATOM 7200 C CG . ASP C 1 242 ? 114.917 -11.426 -13.600 1.00 70.54 ? 324 ASP C CG 1 ATOM 7201 O OD1 . ASP C 1 242 ? 113.791 -11.229 -13.079 1.00 71.43 ? 324 ASP C OD1 1 ATOM 7202 O OD2 . ASP C 1 242 ? 115.982 -10.838 -13.261 1.00 80.85 ? 324 ASP C OD2 1 ATOM 7203 N N . THR C 1 243 ? 112.024 -12.441 -14.571 1.00 50.57 ? 325 THR C N 1 ATOM 7204 C CA . THR C 1 243 ? 110.826 -11.908 -15.193 1.00 48.67 ? 325 THR C CA 1 ATOM 7205 C C . THR C 1 243 ? 110.906 -10.402 -14.972 1.00 60.60 ? 325 THR C C 1 ATOM 7206 O O . THR C 1 243 ? 110.888 -9.948 -13.826 1.00 64.26 ? 325 THR C O 1 ATOM 7207 C CB . THR C 1 243 ? 109.543 -12.458 -14.535 1.00 51.85 ? 325 THR C CB 1 ATOM 7208 O OG1 . THR C 1 243 ? 109.440 -13.872 -14.770 1.00 58.62 ? 325 THR C OG1 1 ATOM 7209 C CG2 . THR C 1 243 ? 108.301 -11.751 -15.101 1.00 48.27 ? 325 THR C CG2 1 ATOM 7210 N N . PRO C 1 244 ? 110.953 -9.613 -16.062 1.00 67.54 ? 326 PRO C N 1 ATOM 7211 C CA . PRO C 1 244 ? 110.768 -10.016 -17.463 1.00 66.93 ? 326 PRO C CA 1 ATOM 7212 C C . PRO C 1 244 ? 111.927 -10.781 -18.078 1.00 58.84 ? 326 PRO C C 1 ATOM 7213 O O . PRO C 1 244 ? 112.990 -10.934 -17.446 1.00 54.34 ? 326 PRO C O 1 ATOM 7214 C CB . PRO C 1 244 ? 110.636 -8.683 -18.187 1.00 41.17 ? 326 PRO C CB 1 ATOM 7215 C CG . PRO C 1 244 ? 111.407 -7.733 -17.364 1.00 51.50 ? 326 PRO C CG 1 ATOM 7216 C CD . PRO C 1 244 ? 111.208 -8.164 -15.944 1.00 65.23 ? 326 PRO C CD 1 ATOM 7217 N N . ARG C 1 245 ? 111.700 -11.232 -19.317 1.00 54.47 ? 327 ARG C N 1 ATOM 7218 C CA . ARG C 1 245 ? 112.647 -12.058 -20.059 1.00 52.38 ? 327 ARG C CA 1 ATOM 7219 C C . ARG C 1 245 ? 112.128 -12.311 -21.476 1.00 61.61 ? 327 ARG C C 1 ATOM 7220 O O . ARG C 1 245 ? 110.944 -12.126 -21.760 1.00 67.50 ? 327 ARG C O 1 ATOM 7221 C CB . ARG C 1 245 ? 112.874 -13.395 -19.327 1.00 49.90 ? 327 ARG C CB 1 ATOM 7222 C CG . ARG C 1 245 ? 111.652 -14.315 -19.290 1.00 49.68 ? 327 ARG C CG 1 ATOM 7223 C CD . ARG C 1 245 ? 112.016 -15.694 -18.745 1.00 61.68 ? 327 ARG C CD 1 ATOM 7224 N NE . ARG C 1 245 ? 110.941 -16.668 -18.952 1.00 63.48 ? 327 ARG C NE 1 ATOM 7225 C CZ . ARG C 1 245 ? 109.957 -16.888 -18.091 1.00 64.16 ? 327 ARG C CZ 1 ATOM 7226 N NH1 . ARG C 1 245 ? 109.909 -16.215 -16.947 1.00 70.55 ? 327 ARG C NH1 1 ATOM 7227 N NH2 . ARG C 1 245 ? 109.025 -17.779 -18.372 1.00 68.93 ? 327 ARG C NH2 1 ATOM 7228 N N . GLY C 1 246 ? 113.010 -12.741 -22.365 1.00 62.29 ? 328 GLY C N 1 ATOM 7229 C CA . GLY C 1 246 ? 112.577 -13.133 -23.690 1.00 62.52 ? 328 GLY C CA 1 ATOM 7230 C C . GLY C 1 246 ? 112.470 -14.644 -23.842 1.00 74.96 ? 328 GLY C C 1 ATOM 7231 O O . GLY C 1 246 ? 112.259 -15.355 -22.853 1.00 72.64 ? 328 GLY C O 1 ATOM 7232 N N . ILE C 1 247 ? 112.615 -15.133 -25.075 1.00 69.37 ? 329 ILE C N 1 ATOM 7233 C CA . ILE C 1 247 ? 112.558 -16.569 -25.366 1.00 74.06 ? 329 ILE C CA 1 ATOM 7234 C C . ILE C 1 247 ? 113.705 -17.323 -24.684 1.00 71.69 ? 329 ILE C C 1 ATOM 7235 O O . ILE C 1 247 ? 114.787 -16.760 -24.479 1.00 65.68 ? 329 ILE C O 1 ATOM 7236 C CB . ILE C 1 247 ? 112.607 -16.821 -26.903 1.00 95.69 ? 329 ILE C CB 1 ATOM 7237 C CG1 . ILE C 1 247 ? 111.550 -15.976 -27.605 1.00 96.62 ? 329 ILE C CG1 1 ATOM 7238 C CG2 . ILE C 1 247 ? 112.395 -18.297 -27.249 1.00 101.31 ? 329 ILE C CG2 1 ATOM 7239 C CD1 . ILE C 1 247 ? 111.228 -16.443 -29.009 1.00 109.31 ? 329 ILE C CD1 1 ATOM 7240 N N . ASP C 1 248 ? 113.472 -18.584 -24.315 1.00 72.30 ? 330 ASP C N 1 ATOM 7241 C CA . ASP C 1 248 ? 114.558 -19.430 -23.822 1.00 65.92 ? 330 ASP C CA 1 ATOM 7242 C C . ASP C 1 248 ? 115.663 -19.555 -24.887 1.00 75.08 ? 330 ASP C C 1 ATOM 7243 O O . ASP C 1 248 ? 115.380 -19.555 -26.086 1.00 71.17 ? 330 ASP C O 1 ATOM 7244 C CB . ASP C 1 248 ? 114.026 -20.801 -23.403 1.00 68.95 ? 330 ASP C CB 1 ATOM 7245 C CG . ASP C 1 248 ? 113.340 -20.773 -22.033 1.00 83.13 ? 330 ASP C CG 1 ATOM 7246 O OD1 . ASP C 1 248 ? 113.580 -19.803 -21.266 1.00 82.87 ? 330 ASP C OD1 1 ATOM 7247 O OD2 . ASP C 1 248 ? 112.574 -21.728 -21.725 1.00 67.08 ? 330 ASP C OD2 1 ATOM 7248 N N . THR C 1 249 ? 116.918 -19.633 -24.454 1.00 76.46 ? 333 THR C N 1 ATOM 7249 C CA . THR C 1 249 ? 118.030 -19.658 -25.400 1.00 83.23 ? 333 THR C CA 1 ATOM 7250 C C . THR C 1 249 ? 118.727 -21.009 -25.422 1.00 84.93 ? 333 THR C C 1 ATOM 7251 O O . THR C 1 249 ? 118.338 -21.939 -24.713 1.00 84.92 ? 333 THR C O 1 ATOM 7252 C CB . THR C 1 249 ? 119.088 -18.573 -25.078 1.00 76.00 ? 333 THR C CB 1 ATOM 7253 O OG1 . THR C 1 249 ? 119.923 -19.006 -23.995 1.00 86.72 ? 333 THR C OG1 1 ATOM 7254 C CG2 . THR C 1 249 ? 118.420 -17.275 -24.704 1.00 62.56 ? 333 THR C CG2 1 ATOM 7255 N N . THR C 1 250 ? 119.760 -21.106 -26.251 1.00 79.98 ? 334 THR C N 1 ATOM 7256 C CA . THR C 1 250 ? 120.717 -22.197 -26.149 1.00 86.06 ? 334 THR C CA 1 ATOM 7257 C C . THR C 1 250 ? 121.499 -22.014 -24.851 1.00 80.42 ? 334 THR C C 1 ATOM 7258 O O . THR C 1 250 ? 121.521 -20.920 -24.284 1.00 83.58 ? 334 THR C O 1 ATOM 7259 C CB . THR C 1 250 ? 121.708 -22.187 -27.327 1.00 89.41 ? 334 THR C CB 1 ATOM 7260 O OG1 . THR C 1 250 ? 122.245 -20.864 -27.486 1.00 87.93 ? 334 THR C OG1 1 ATOM 7261 C CG2 . THR C 1 250 ? 121.014 -22.620 -28.613 1.00 92.00 ? 334 THR C CG2 1 ATOM 7262 N N . ASN C 1 251 ? 122.146 -23.070 -24.378 1.00 64.45 ? 335 ASN C N 1 ATOM 7263 C CA . ASN C 1 251 ? 122.990 -22.924 -23.207 1.00 70.01 ? 335 ASN C CA 1 ATOM 7264 C C . ASN C 1 251 ? 124.271 -22.164 -23.543 1.00 85.08 ? 335 ASN C C 1 ATOM 7265 O O . ASN C 1 251 ? 124.944 -22.468 -24.531 1.00 97.84 ? 335 ASN C O 1 ATOM 7266 C CB . ASN C 1 251 ? 123.317 -24.289 -22.601 1.00 78.60 ? 335 ASN C CB 1 ATOM 7267 C CG . ASN C 1 251 ? 122.093 -24.987 -22.036 1.00 82.55 ? 335 ASN C CG 1 ATOM 7268 O OD1 . ASN C 1 251 ? 120.973 -24.484 -22.126 1.00 80.26 ? 335 ASN C OD1 1 ATOM 7269 N ND2 . ASN C 1 251 ? 122.303 -26.159 -21.457 1.00 87.63 ? 335 ASN C ND2 1 ATOM 7270 N N . TYR C 1 252 ? 124.584 -21.156 -22.733 1.00 91.25 ? 336 TYR C N 1 ATOM 7271 C CA . TYR C 1 252 ? 125.857 -20.437 -22.829 1.00 83.57 ? 336 TYR C CA 1 ATOM 7272 C C . TYR C 1 252 ? 126.208 -19.768 -21.501 1.00 83.23 ? 336 TYR C C 1 ATOM 7273 O O . TYR C 1 252 ? 125.330 -19.564 -20.654 1.00 85.98 ? 336 TYR C O 1 ATOM 7274 C CB . TYR C 1 252 ? 125.875 -19.442 -23.995 1.00 62.29 ? 336 TYR C CB 1 ATOM 7275 C CG . TYR C 1 252 ? 124.822 -18.355 -23.995 1.00 64.09 ? 336 TYR C CG 1 ATOM 7276 C CD1 . TYR C 1 252 ? 124.896 -17.262 -23.122 1.00 64.96 ? 336 TYR C CD1 1 ATOM 7277 C CD2 . TYR C 1 252 ? 123.777 -18.390 -24.913 1.00 65.63 ? 336 TYR C CD2 1 ATOM 7278 C CE1 . TYR C 1 252 ? 123.925 -16.245 -23.148 1.00 53.95 ? 336 TYR C CE1 1 ATOM 7279 C CE2 . TYR C 1 252 ? 122.812 -17.385 -24.954 1.00 70.67 ? 336 TYR C CE2 1 ATOM 7280 C CZ . TYR C 1 252 ? 122.884 -16.320 -24.073 1.00 66.05 ? 336 TYR C CZ 1 ATOM 7281 O OH . TYR C 1 252 ? 121.913 -15.342 -24.140 1.00 59.15 ? 336 TYR C OH 1 ATOM 7282 N N . CYS C 1 253 ? 127.478 -19.427 -21.310 1.00 85.49 ? 337 CYS C N 1 ATOM 7283 C CA . CYS C 1 253 ? 127.937 -19.097 -19.959 1.00 89.32 ? 337 CYS C CA 1 ATOM 7284 C C . CYS C 1 253 ? 128.108 -17.615 -19.628 1.00 90.97 ? 337 CYS C C 1 ATOM 7285 O O . CYS C 1 253 ? 128.965 -17.253 -18.829 1.00 101.85 ? 337 CYS C O 1 ATOM 7286 C CB . CYS C 1 253 ? 129.193 -19.904 -19.590 1.00 80.82 ? 337 CYS C CB 1 ATOM 7287 S SG . CYS C 1 253 ? 128.842 -21.650 -19.238 1.00 155.50 ? 337 CYS C SG 1 ATOM 7288 N N . ASP C 1 254 ? 127.278 -16.767 -20.223 1.00 87.91 ? 339 ASP C N 1 ATOM 7289 C CA . ASP C 1 254 ? 127.227 -15.359 -19.829 1.00 90.16 ? 339 ASP C CA 1 ATOM 7290 C C . ASP C 1 254 ? 125.831 -14.771 -19.970 1.00 86.89 ? 339 ASP C C 1 ATOM 7291 O O . ASP C 1 254 ? 124.873 -15.489 -20.277 1.00 89.93 ? 339 ASP C O 1 ATOM 7292 C CB . ASP C 1 254 ? 128.261 -14.500 -20.574 1.00 98.40 ? 339 ASP C CB 1 ATOM 7293 C CG . ASP C 1 254 ? 128.538 -14.994 -21.985 1.00 100.64 ? 339 ASP C CG 1 ATOM 7294 O OD1 . ASP C 1 254 ? 127.722 -15.777 -22.522 1.00 101.59 ? 339 ASP C OD1 1 ATOM 7295 O OD2 . ASP C 1 254 ? 129.581 -14.589 -22.549 1.00 89.68 ? 339 ASP C OD2 1 ATOM 7296 N N . LYS C 1 255 ? 125.727 -13.463 -19.743 1.00 82.19 ? 340 LYS C N 1 ATOM 7297 C CA . LYS C 1 255 ? 124.430 -12.823 -19.551 1.00 77.89 ? 340 LYS C CA 1 ATOM 7298 C C . LYS C 1 255 ? 123.537 -12.929 -20.774 1.00 81.42 ? 340 LYS C C 1 ATOM 7299 O O . LYS C 1 255 ? 124.020 -12.948 -21.914 1.00 83.73 ? 340 LYS C O 1 ATOM 7300 C CB . LYS C 1 255 ? 124.589 -11.343 -19.174 1.00 74.86 ? 340 LYS C CB 1 ATOM 7301 C CG . LYS C 1 255 ? 125.338 -11.055 -17.868 1.00 80.37 ? 340 LYS C CG 1 ATOM 7302 C CD . LYS C 1 255 ? 125.757 -9.576 -17.828 1.00 82.34 ? 340 LYS C CD 1 ATOM 7303 C CE . LYS C 1 255 ? 126.582 -9.231 -16.596 1.00 93.40 ? 340 LYS C CE 1 ATOM 7304 N NZ . LYS C 1 255 ? 128.003 -9.684 -16.678 1.00 97.87 ? 340 LYS C NZ 1 ATOM 7305 N N . THR C 1 256 ? 122.232 -13.014 -20.522 1.00 73.90 ? 341 THR C N 1 ATOM 7306 C CA . THR C 1 256 ? 121.236 -12.825 -21.570 1.00 71.00 ? 341 THR C CA 1 ATOM 7307 C C . THR C 1 256 ? 120.735 -11.380 -21.498 1.00 70.84 ? 341 THR C C 1 ATOM 7308 O O . THR C 1 256 ? 119.761 -11.068 -20.810 1.00 71.01 ? 341 THR C O 1 ATOM 7309 C CB . THR C 1 256 ? 120.079 -13.809 -21.419 1.00 60.98 ? 341 THR C CB 1 ATOM 7310 O OG1 . THR C 1 256 ? 120.590 -15.141 -21.478 1.00 66.48 ? 341 THR C OG1 1 ATOM 7311 C CG2 . THR C 1 256 ? 119.054 -13.610 -22.528 1.00 57.42 ? 341 THR C CG2 1 ATOM 7312 N N . THR C 1 257 ? 121.422 -10.495 -22.207 1.00 61.82 ? 342 THR C N 1 ATOM 7313 C CA . THR C 1 257 ? 121.199 -9.067 -22.043 1.00 65.30 ? 342 THR C CA 1 ATOM 7314 C C . THR C 1 257 ? 119.859 -8.661 -22.628 1.00 62.06 ? 342 THR C C 1 ATOM 7315 O O . THR C 1 257 ? 119.279 -7.628 -22.265 1.00 66.15 ? 342 THR C O 1 ATOM 7316 C CB . THR C 1 257 ? 122.330 -8.252 -22.695 1.00 78.89 ? 342 THR C CB 1 ATOM 7317 O OG1 . THR C 1 257 ? 122.317 -8.464 -24.115 1.00 66.07 ? 342 THR C OG1 1 ATOM 7318 C CG2 . THR C 1 257 ? 123.692 -8.667 -22.102 1.00 77.12 ? 342 THR C CG2 1 ATOM 7319 N N . THR C 1 258 ? 119.377 -9.499 -23.534 1.00 72.04 ? 343 THR C N 1 ATOM 7320 C CA . THR C 1 258 ? 118.091 -9.297 -24.181 1.00 75.08 ? 343 THR C CA 1 ATOM 7321 C C . THR C 1 258 ? 116.989 -9.359 -23.137 1.00 61.85 ? 343 THR C C 1 ATOM 7322 O O . THR C 1 258 ? 116.808 -10.385 -22.477 1.00 71.32 ? 343 THR C O 1 ATOM 7323 C CB . THR C 1 258 ? 117.830 -10.388 -25.240 1.00 79.04 ? 343 THR C CB 1 ATOM 7324 O OG1 . THR C 1 258 ? 119.039 -10.669 -25.967 1.00 75.92 ? 343 THR C OG1 1 ATOM 7325 C CG2 . THR C 1 258 ? 116.712 -9.962 -26.183 1.00 60.12 ? 343 THR C CG2 1 ATOM 7326 N N . GLU C 1 259 ? 116.259 -8.259 -23.004 1.00 57.11 ? 344 GLU C N 1 ATOM 7327 C CA . GLU C 1 259 ? 115.221 -8.118 -21.988 1.00 57.63 ? 344 GLU C CA 1 ATOM 7328 C C . GLU C 1 259 ? 115.748 -8.273 -20.555 1.00 60.97 ? 344 GLU C C 1 ATOM 7329 O O . GLU C 1 259 ? 115.005 -8.630 -19.642 1.00 82.45 ? 344 GLU C O 1 ATOM 7330 C CB . GLU C 1 259 ? 114.066 -9.084 -22.255 1.00 68.59 ? 344 GLU C CB 1 ATOM 7331 C CG . GLU C 1 259 ? 113.227 -8.723 -23.470 1.00 75.29 ? 344 GLU C CG 1 ATOM 7332 C CD . GLU C 1 259 ? 111.731 -8.804 -23.185 1.00 104.96 ? 344 GLU C CD 1 ATOM 7333 O OE1 . GLU C 1 259 ? 111.202 -7.918 -22.475 1.00 111.08 ? 344 GLU C OE1 1 ATOM 7334 O OE2 . GLU C 1 259 ? 111.081 -9.753 -23.681 1.00 116.43 ? 344 GLU C OE2 1 ATOM 7335 N N . GLY C 1 260 ? 117.030 -7.987 -20.356 1.00 61.92 ? 345 GLY C N 1 ATOM 7336 C CA . GLY C 1 260 ? 117.624 -8.028 -19.028 1.00 64.07 ? 345 GLY C CA 1 ATOM 7337 C C . GLY C 1 260 ? 117.397 -6.808 -18.124 1.00 60.91 ? 345 GLY C C 1 ATOM 7338 O O . GLY C 1 260 ? 117.858 -6.794 -16.985 1.00 78.01 ? 345 GLY C O 1 ATOM 7339 N N . GLU C 1 261 ? 116.722 -5.775 -18.619 1.00 49.53 ? 346 GLU C N 1 ATOM 7340 C CA . GLU C 1 261 ? 116.356 -4.650 -17.775 1.00 54.85 ? 346 GLU C CA 1 ATOM 7341 C C . GLU C 1 261 ? 115.099 -5.061 -17.000 1.00 64.07 ? 346 GLU C C 1 ATOM 7342 O O . GLU C 1 261 ? 114.243 -5.753 -17.551 1.00 70.71 ? 346 GLU C O 1 ATOM 7343 C CB . GLU C 1 261 ? 116.074 -3.407 -18.622 1.00 47.49 ? 346 GLU C CB 1 ATOM 7344 C CG . GLU C 1 261 ? 115.658 -2.177 -17.806 1.00 54.97 ? 346 GLU C CG 1 ATOM 7345 C CD . GLU C 1 261 ? 115.253 -0.980 -18.672 1.00 76.55 ? 346 GLU C CD 1 ATOM 7346 O OE1 . GLU C 1 261 ? 115.424 -1.053 -19.918 1.00 79.51 ? 346 GLU C OE1 1 ATOM 7347 O OE2 . GLU C 1 261 ? 114.763 0.033 -18.103 1.00 68.20 ? 346 GLU C OE2 1 ATOM 7348 N N . GLY C 1 262 ? 114.979 -4.649 -15.736 1.00 57.24 ? 347 GLY C N 1 ATOM 7349 C CA . GLY C 1 262 ? 113.831 -5.015 -14.912 1.00 51.86 ? 347 GLY C CA 1 ATOM 7350 C C . GLY C 1 262 ? 114.093 -6.316 -14.166 1.00 61.31 ? 347 GLY C C 1 ATOM 7351 O O . GLY C 1 262 ? 115.220 -6.778 -14.126 1.00 66.19 ? 347 GLY C O 1 ATOM 7352 N N . GLY C 1 263 ? 113.071 -6.917 -13.575 1.00 58.78 ? 348 GLY C N 1 ATOM 7353 C CA . GLY C 1 263 ? 113.281 -8.166 -12.866 1.00 51.97 ? 348 GLY C CA 1 ATOM 7354 C C . GLY C 1 263 ? 112.522 -8.303 -11.561 1.00 47.46 ? 348 GLY C C 1 ATOM 7355 O O . GLY C 1 263 ? 112.042 -7.331 -10.989 1.00 57.23 ? 348 GLY C O 1 ATOM 7356 N N . ILE C 1 264 ? 112.424 -9.525 -11.069 1.00 61.21 ? 349 ILE C N 1 ATOM 7357 C CA . ILE C 1 264 ? 111.727 -9.759 -9.817 1.00 51.64 ? 349 ILE C CA 1 ATOM 7358 C C . ILE C 1 264 ? 112.543 -10.743 -8.978 1.00 47.18 ? 349 ILE C C 1 ATOM 7359 O O . ILE C 1 264 ? 113.290 -11.561 -9.520 1.00 63.98 ? 349 ILE C O 1 ATOM 7360 C CB . ILE C 1 264 ? 110.299 -10.261 -10.090 1.00 46.26 ? 349 ILE C CB 1 ATOM 7361 C CG1 . ILE C 1 264 ? 109.425 -10.123 -8.836 1.00 50.38 ? 349 ILE C CG1 1 ATOM 7362 C CG2 . ILE C 1 264 ? 110.318 -11.697 -10.653 1.00 37.61 ? 349 ILE C CG2 1 ATOM 7363 C CD1 . ILE C 1 264 ? 107.963 -9.938 -9.166 1.00 50.92 ? 349 ILE C CD1 1 ATOM 7364 N N . GLN C 1 265 ? 112.440 -10.629 -7.663 1.00 47.55 ? 350 GLN C N 1 ATOM 7365 C CA . GLN C 1 265 ? 113.141 -11.533 -6.762 1.00 52.25 ? 350 GLN C CA 1 ATOM 7366 C C . GLN C 1 265 ? 112.678 -12.950 -7.024 1.00 51.69 ? 350 GLN C C 1 ATOM 7367 O O . GLN C 1 265 ? 111.473 -13.223 -7.146 1.00 54.52 ? 350 GLN C O 1 ATOM 7368 C CB . GLN C 1 265 ? 112.853 -11.141 -5.315 1.00 52.56 ? 350 GLN C CB 1 ATOM 7369 C CG . GLN C 1 265 ? 113.418 -12.018 -4.235 1.00 48.98 ? 350 GLN C CG 1 ATOM 7370 C CD . GLN C 1 265 ? 113.211 -11.364 -2.881 1.00 57.91 ? 350 GLN C CD 1 ATOM 7371 O OE1 . GLN C 1 265 ? 112.201 -10.668 -2.665 1.00 65.63 ? 350 GLN C OE1 1 ATOM 7372 N NE2 . GLN C 1 265 ? 114.182 -11.535 -1.975 1.00 39.45 ? 350 GLN C NE2 1 ATOM 7373 N N . GLY C 1 266 ? 113.652 -13.845 -7.120 1.00 49.70 ? 351 GLY C N 1 ATOM 7374 C CA . GLY C 1 266 ? 113.388 -15.241 -7.387 1.00 55.35 ? 351 GLY C CA 1 ATOM 7375 C C . GLY C 1 266 ? 114.672 -15.974 -7.125 1.00 58.24 ? 351 GLY C C 1 ATOM 7376 O O . GLY C 1 266 ? 115.693 -15.341 -6.815 1.00 61.40 ? 351 GLY C O 1 ATOM 7377 N N . PHE C 1 267 ? 114.635 -17.294 -7.279 1.00 58.28 ? 352 PHE C N 1 ATOM 7378 C CA . PHE C 1 267 ? 115.726 -18.132 -6.804 1.00 50.43 ? 352 PHE C CA 1 ATOM 7379 C C . PHE C 1 267 ? 116.145 -19.206 -7.800 1.00 57.28 ? 352 PHE C C 1 ATOM 7380 O O . PHE C 1 267 ? 115.405 -19.566 -8.726 1.00 55.68 ? 352 PHE C O 1 ATOM 7381 C CB . PHE C 1 267 ? 115.324 -18.803 -5.472 1.00 56.92 ? 352 PHE C CB 1 ATOM 7382 C CG . PHE C 1 267 ? 114.119 -19.722 -5.589 1.00 57.52 ? 352 PHE C CG 1 ATOM 7383 C CD1 . PHE C 1 267 ? 112.825 -19.228 -5.399 1.00 51.17 ? 352 PHE C CD1 1 ATOM 7384 C CD2 . PHE C 1 267 ? 114.279 -21.079 -5.889 1.00 53.83 ? 352 PHE C CD2 1 ATOM 7385 C CE1 . PHE C 1 267 ? 111.711 -20.064 -5.516 1.00 50.20 ? 352 PHE C CE1 1 ATOM 7386 C CE2 . PHE C 1 267 ? 113.158 -21.924 -6.003 1.00 55.29 ? 352 PHE C CE2 1 ATOM 7387 C CZ . PHE C 1 267 ? 111.880 -21.415 -5.824 1.00 56.46 ? 352 PHE C CZ 1 ATOM 7388 N N . MET C 1 268 ? 117.359 -19.698 -7.585 1.00 57.92 ? 353 MET C N 1 ATOM 7389 C CA . MET C 1 268 ? 117.864 -20.905 -8.211 1.00 54.34 ? 353 MET C CA 1 ATOM 7390 C C . MET C 1 268 ? 118.401 -21.777 -7.077 1.00 69.80 ? 353 MET C C 1 ATOM 7391 O O . MET C 1 268 ? 118.859 -21.253 -6.048 1.00 62.21 ? 353 MET C O 1 ATOM 7392 C CB . MET C 1 268 ? 118.985 -20.571 -9.193 1.00 51.38 ? 353 MET C CB 1 ATOM 7393 C CG . MET C 1 268 ? 118.548 -19.812 -10.455 1.00 55.66 ? 353 MET C CG 1 ATOM 7394 S SD . MET C 1 268 ? 119.956 -19.231 -11.430 1.00 70.59 ? 353 MET C SD 1 ATOM 7395 C CE . MET C 1 268 ? 119.136 -18.514 -12.868 1.00 124.70 ? 353 MET C CE 1 ATOM 7396 N N . ILE C 1 269 ? 118.338 -23.096 -7.240 1.00 64.19 ? 354 ILE C N 1 ATOM 7397 C CA . ILE C 1 269 ? 118.956 -23.975 -6.257 1.00 61.94 ? 354 ILE C CA 1 ATOM 7398 C C . ILE C 1 269 ? 120.100 -24.750 -6.892 1.00 68.09 ? 354 ILE C C 1 ATOM 7399 O O . ILE C 1 269 ? 119.886 -25.497 -7.852 1.00 67.04 ? 354 ILE C O 1 ATOM 7400 C CB . ILE C 1 269 ? 117.964 -24.989 -5.649 1.00 59.02 ? 354 ILE C CB 1 ATOM 7401 C CG1 . ILE C 1 269 ? 116.770 -24.269 -5.020 1.00 52.40 ? 354 ILE C CG1 1 ATOM 7402 C CG2 . ILE C 1 269 ? 118.684 -25.880 -4.617 1.00 44.14 ? 354 ILE C CG2 1 ATOM 7403 C CD1 . ILE C 1 269 ? 115.667 -25.207 -4.547 1.00 44.60 ? 354 ILE C CD1 1 ATOM 7404 N N . GLU C 1 270 ? 121.307 -24.576 -6.356 1.00 60.24 ? 355 GLU C N 1 ATOM 7405 C CA . GLU C 1 270 ? 122.484 -25.278 -6.877 1.00 62.96 ? 355 GLU C CA 1 ATOM 7406 C C . GLU C 1 270 ? 122.821 -26.531 -6.065 1.00 71.20 ? 355 GLU C C 1 ATOM 7407 O O . GLU C 1 270 ? 123.042 -26.469 -4.846 1.00 67.01 ? 355 GLU C O 1 ATOM 7408 C CB . GLU C 1 270 ? 123.699 -24.351 -6.917 1.00 65.73 ? 355 GLU C CB 1 ATOM 7409 C CG . GLU C 1 270 ? 125.016 -25.076 -7.126 1.00 63.69 ? 355 GLU C CG 1 ATOM 7410 C CD . GLU C 1 270 ? 125.268 -25.445 -8.576 1.00 76.33 ? 355 GLU C CD 1 ATOM 7411 O OE1 . GLU C 1 270 ? 124.340 -25.319 -9.403 1.00 72.54 ? 355 GLU C OE1 1 ATOM 7412 O OE2 . GLU C 1 270 ? 126.407 -25.856 -8.890 1.00 83.39 ? 355 GLU C OE2 1 ATOM 7413 N N . GLY C 1 271 ? 122.873 -27.671 -6.741 1.00 75.36 ? 356 GLY C N 1 ATOM 7414 C CA . GLY C 1 271 ? 123.106 -28.917 -6.042 1.00 78.17 ? 356 GLY C CA 1 ATOM 7415 C C . GLY C 1 271 ? 123.628 -29.997 -6.957 1.00 93.66 ? 356 GLY C C 1 ATOM 7416 O O . GLY C 1 271 ? 124.068 -29.727 -8.083 1.00 94.68 ? 356 GLY C O 1 ATOM 7417 N N . SER C 1 272 ? 123.605 -31.224 -6.449 1.00 98.88 ? 357 SER C N 1 ATOM 7418 C CA . SER C 1 272 ? 123.805 -32.403 -7.273 1.00 95.28 ? 357 SER C CA 1 ATOM 7419 C C . SER C 1 272 ? 122.694 -32.322 -8.298 1.00 99.41 ? 357 SER C C 1 ATOM 7420 O O . SER C 1 272 ? 122.904 -32.482 -9.510 1.00 96.61 ? 357 SER C O 1 ATOM 7421 C CB . SER C 1 272 ? 123.626 -33.639 -6.409 1.00 84.76 ? 357 SER C CB 1 ATOM 7422 O OG . SER C 1 272 ? 122.699 -33.369 -5.367 1.00 81.11 ? 357 SER C OG 1 ATOM 7423 N N . ASN C 1 273 ? 121.503 -32.051 -7.773 1.00 98.36 ? 359 ASN C N 1 ATOM 7424 C CA . ASN C 1 273 ? 120.349 -31.688 -8.571 1.00 89.86 ? 359 ASN C CA 1 ATOM 7425 C C . ASN C 1 273 ? 120.106 -30.210 -8.416 1.00 83.40 ? 359 ASN C C 1 ATOM 7426 O O . ASN C 1 273 ? 120.091 -29.684 -7.299 1.00 87.44 ? 359 ASN C O 1 ATOM 7427 C CB . ASN C 1 273 ? 119.116 -32.468 -8.123 1.00 89.29 ? 359 ASN C CB 1 ATOM 7428 C CG . ASN C 1 273 ? 119.022 -33.822 -8.785 1.00 96.40 ? 359 ASN C CG 1 ATOM 7429 O OD1 . ASN C 1 273 ? 119.888 -34.197 -9.589 1.00 94.66 ? 359 ASN C OD1 1 ATOM 7430 N ND2 . ASN C 1 273 ? 117.973 -34.569 -8.454 1.00 92.50 ? 359 ASN C ND2 1 ATOM 7431 N N . SER C 1 274 ? 119.925 -29.541 -9.543 1.00 78.14 ? 360 SER C N 1 ATOM 7432 C CA . SER C 1 274 ? 119.686 -28.108 -9.530 1.00 76.03 ? 360 SER C CA 1 ATOM 7433 C C . SER C 1 274 ? 118.263 -27.758 -9.931 1.00 62.75 ? 360 SER C C 1 ATOM 7434 O O . SER C 1 274 ? 117.556 -28.553 -10.547 1.00 67.57 ? 360 SER C O 1 ATOM 7435 C CB . SER C 1 274 ? 120.689 -27.382 -10.423 1.00 82.18 ? 360 SER C CB 1 ATOM 7436 O OG . SER C 1 274 ? 121.937 -27.255 -9.767 1.00 84.69 ? 360 SER C OG 1 ATOM 7437 N N . TRP C 1 275 ? 117.844 -26.560 -9.567 1.00 64.84 ? 361 TRP C N 1 ATOM 7438 C CA . TRP C 1 275 ? 116.488 -26.134 -9.842 1.00 57.30 ? 361 TRP C CA 1 ATOM 7439 C C . TRP C 1 275 ? 116.469 -24.673 -10.255 1.00 57.60 ? 361 TRP C C 1 ATOM 7440 O O . TRP C 1 275 ? 117.253 -23.857 -9.749 1.00 61.64 ? 361 TRP C O 1 ATOM 7441 C CB . TRP C 1 275 ? 115.618 -26.285 -8.590 1.00 60.49 ? 361 TRP C CB 1 ATOM 7442 C CG . TRP C 1 275 ? 115.528 -27.668 -7.996 1.00 63.74 ? 361 TRP C CG 1 ATOM 7443 C CD1 . TRP C 1 275 ? 116.352 -28.209 -7.044 1.00 67.60 ? 361 TRP C CD1 1 ATOM 7444 C CD2 . TRP C 1 275 ? 114.517 -28.660 -8.263 1.00 67.20 ? 361 TRP C CD2 1 ATOM 7445 N NE1 . TRP C 1 275 ? 115.930 -29.481 -6.719 1.00 68.88 ? 361 TRP C NE1 1 ATOM 7446 C CE2 . TRP C 1 275 ? 114.807 -29.782 -7.451 1.00 65.46 ? 361 TRP C CE2 1 ATOM 7447 C CE3 . TRP C 1 275 ? 113.401 -28.711 -9.113 1.00 61.43 ? 361 TRP C CE3 1 ATOM 7448 C CZ2 . TRP C 1 275 ? 114.025 -30.948 -7.471 1.00 49.82 ? 361 TRP C CZ2 1 ATOM 7449 C CZ3 . TRP C 1 275 ? 112.621 -29.873 -9.129 1.00 54.63 ? 361 TRP C CZ3 1 ATOM 7450 C CH2 . TRP C 1 275 ? 112.940 -30.973 -8.312 1.00 50.11 ? 361 TRP C CH2 1 ATOM 7451 N N . ILE C 1 276 ? 115.568 -24.350 -11.174 1.00 58.05 ? 362 ILE C N 1 ATOM 7452 C CA . ILE C 1 276 ? 115.244 -22.968 -11.467 1.00 49.46 ? 362 ILE C CA 1 ATOM 7453 C C . ILE C 1 276 ? 113.748 -22.791 -11.315 1.00 62.27 ? 362 ILE C C 1 ATOM 7454 O O . ILE C 1 276 ? 112.969 -23.473 -11.990 1.00 60.40 ? 362 ILE C O 1 ATOM 7455 C CB . ILE C 1 276 ? 115.605 -22.594 -12.886 1.00 49.91 ? 362 ILE C CB 1 ATOM 7456 C CG1 . ILE C 1 276 ? 117.101 -22.798 -13.113 1.00 54.25 ? 362 ILE C CG1 1 ATOM 7457 C CG2 . ILE C 1 276 ? 115.207 -21.147 -13.148 1.00 43.21 ? 362 ILE C CG2 1 ATOM 7458 C CD1 . ILE C 1 276 ? 117.494 -22.639 -14.534 1.00 54.27 ? 362 ILE C CD1 1 ATOM 7459 N N . GLY C 1 277 ? 113.347 -21.894 -10.416 1.00 58.57 ? 363 GLY C N 1 ATOM 7460 C CA . GLY C 1 277 ? 111.949 -21.542 -10.292 1.00 48.60 ? 363 GLY C CA 1 ATOM 7461 C C . GLY C 1 277 ? 111.681 -20.243 -11.014 1.00 54.18 ? 363 GLY C C 1 ATOM 7462 O O . GLY C 1 277 ? 112.409 -19.263 -10.839 1.00 68.01 ? 363 GLY C O 1 ATOM 7463 N N . ARG C 1 278 ? 110.632 -20.219 -11.825 1.00 51.61 ? 364 ARG C N 1 ATOM 7464 C CA . ARG C 1 278 ? 110.253 -18.974 -12.471 1.00 49.85 ? 364 ARG C CA 1 ATOM 7465 C C . ARG C 1 278 ? 108.764 -18.863 -12.720 1.00 56.87 ? 364 ARG C C 1 ATOM 7466 O O . ARG C 1 278 ? 108.004 -19.826 -12.558 1.00 62.04 ? 364 ARG C O 1 ATOM 7467 C CB . ARG C 1 278 ? 110.995 -18.806 -13.793 1.00 50.80 ? 364 ARG C CB 1 ATOM 7468 C CG . ARG C 1 278 ? 110.322 -19.521 -14.934 1.00 50.47 ? 364 ARG C CG 1 ATOM 7469 C CD . ARG C 1 278 ? 111.293 -19.751 -16.061 1.00 57.33 ? 364 ARG C CD 1 ATOM 7470 N NE . ARG C 1 278 ? 110.607 -20.354 -17.190 1.00 70.41 ? 364 ARG C NE 1 ATOM 7471 C CZ . ARG C 1 278 ? 111.128 -20.478 -18.401 1.00 57.27 ? 364 ARG C CZ 1 ATOM 7472 N NH1 . ARG C 1 278 ? 112.355 -20.044 -18.641 1.00 52.59 ? 364 ARG C NH1 1 ATOM 7473 N NH2 . ARG C 1 278 ? 110.415 -21.050 -19.361 1.00 59.70 ? 364 ARG C NH2 1 ATOM 7474 N N . ILE C 1 279 ? 108.377 -17.652 -13.102 1.00 49.85 ? 365 ILE C N 1 ATOM 7475 C CA . ILE C 1 279 ? 107.025 -17.320 -13.499 1.00 54.68 ? 365 ILE C CA 1 ATOM 7476 C C . ILE C 1 279 ? 106.802 -17.794 -14.939 1.00 60.21 ? 365 ILE C C 1 ATOM 7477 O O . ILE C 1 279 ? 107.643 -17.566 -15.812 1.00 59.34 ? 365 ILE C O 1 ATOM 7478 C CB . ILE C 1 279 ? 106.842 -15.809 -13.392 1.00 53.50 ? 365 ILE C CB 1 ATOM 7479 C CG1 . ILE C 1 279 ? 107.108 -15.395 -11.940 1.00 50.76 ? 365 ILE C CG1 1 ATOM 7480 C CG2 . ILE C 1 279 ? 105.465 -15.387 -13.890 1.00 63.99 ? 365 ILE C CG2 1 ATOM 7481 C CD1 . ILE C 1 279 ? 106.658 -13.987 -11.560 1.00 47.36 ? 365 ILE C CD1 1 ATOM 7482 N N . ILE C 1 280 ? 105.677 -18.461 -15.187 1.00 58.54 ? 366 ILE C N 1 ATOM 7483 C CA . ILE C 1 280 ? 105.491 -19.162 -16.451 1.00 50.27 ? 366 ILE C CA 1 ATOM 7484 C C . ILE C 1 280 ? 105.250 -18.210 -17.630 1.00 54.02 ? 366 ILE C C 1 ATOM 7485 O O . ILE C 1 280 ? 105.938 -18.294 -18.646 1.00 42.93 ? 366 ILE C O 1 ATOM 7486 C CB . ILE C 1 280 ? 104.389 -20.227 -16.344 1.00 62.25 ? 366 ILE C CB 1 ATOM 7487 C CG1 . ILE C 1 280 ? 104.715 -21.185 -15.191 1.00 51.64 ? 366 ILE C CG1 1 ATOM 7488 C CG2 . ILE C 1 280 ? 104.229 -20.991 -17.683 1.00 36.50 ? 366 ILE C CG2 1 ATOM 7489 C CD1 . ILE C 1 280 ? 103.642 -22.213 -14.930 1.00 48.85 ? 366 ILE C CD1 1 ATOM 7490 N N . ASN C 1 281 ? 104.282 -17.309 -17.498 1.00 58.02 ? 367 ASN C N 1 ATOM 7491 C CA . ASN C 1 281 ? 104.064 -16.297 -18.519 1.00 59.32 ? 367 ASN C CA 1 ATOM 7492 C C . ASN C 1 281 ? 104.641 -14.980 -18.041 1.00 59.32 ? 367 ASN C C 1 ATOM 7493 O O . ASN C 1 281 ? 104.065 -14.346 -17.174 1.00 60.76 ? 367 ASN C O 1 ATOM 7494 C CB . ASN C 1 281 ? 102.568 -16.130 -18.831 1.00 84.97 ? 367 ASN C CB 1 ATOM 7495 C CG . ASN C 1 281 ? 101.862 -17.457 -19.104 1.00 103.72 ? 367 ASN C CG 1 ATOM 7496 O OD1 . ASN C 1 281 ? 102.244 -18.509 -18.582 1.00 95.62 ? 367 ASN C OD1 1 ATOM 7497 N ND2 . ASN C 1 281 ? 100.814 -17.405 -19.919 1.00 109.14 ? 367 ASN C ND2 1 ATOM 7498 N N . PRO C 1 282 ? 105.779 -14.547 -18.608 1.00 58.52 ? 368 PRO C N 1 ATOM 7499 C CA . PRO C 1 282 ? 106.320 -13.295 -18.060 1.00 62.32 ? 368 PRO C CA 1 ATOM 7500 C C . PRO C 1 282 ? 105.433 -12.063 -18.366 1.00 58.20 ? 368 PRO C C 1 ATOM 7501 O O . PRO C 1 282 ? 105.629 -10.993 -17.761 1.00 65.33 ? 368 PRO C O 1 ATOM 7502 C CB . PRO C 1 282 ? 107.691 -13.166 -18.750 1.00 63.28 ? 368 PRO C CB 1 ATOM 7503 C CG . PRO C 1 282 ? 107.909 -14.471 -19.485 1.00 56.14 ? 368 PRO C CG 1 ATOM 7504 C CD . PRO C 1 282 ? 106.547 -15.016 -19.773 1.00 51.85 ? 368 PRO C CD 1 ATOM 7505 N N . GLY C 1 283 ? 104.466 -12.217 -19.279 1.00 44.89 ? 369 GLY C N 1 ATOM 7506 C CA . GLY C 1 283 ? 103.595 -11.117 -19.677 1.00 49.84 ? 369 GLY C CA 1 ATOM 7507 C C . GLY C 1 283 ? 102.542 -10.794 -18.632 1.00 67.67 ? 369 GLY C C 1 ATOM 7508 O O . GLY C 1 283 ? 102.655 -9.813 -17.901 1.00 77.72 ? 369 GLY C O 1 ATOM 7509 N N . SER C 1 284 ? 101.489 -11.605 -18.589 1.00 70.44 ? 370 SER C N 1 ATOM 7510 C CA . SER C 1 284 ? 100.563 -11.608 -17.467 1.00 65.20 ? 370 SER C CA 1 ATOM 7511 C C . SER C 1 284 ? 101.345 -12.446 -16.511 1.00 80.31 ? 370 SER C C 1 ATOM 7512 O O . SER C 1 284 ? 101.747 -13.546 -16.894 1.00 110.74 ? 370 SER C O 1 ATOM 7513 C CB . SER C 1 284 ? 99.316 -12.387 -17.842 1.00 64.33 ? 370 SER C CB 1 ATOM 7514 O OG . SER C 1 284 ? 99.635 -13.758 -18.090 1.00 60.54 ? 370 SER C OG 1 ATOM 7515 N N . LYS C 1 285 ? 101.594 -11.984 -15.293 1.00 59.95 ? 371 LYS C N 1 ATOM 7516 C CA . LYS C 1 285 ? 102.522 -12.747 -14.439 1.00 62.07 ? 371 LYS C CA 1 ATOM 7517 C C . LYS C 1 285 ? 101.885 -14.014 -13.830 1.00 58.82 ? 371 LYS C C 1 ATOM 7518 O O . LYS C 1 285 ? 101.773 -14.151 -12.607 1.00 60.61 ? 371 LYS C O 1 ATOM 7519 C CB . LYS C 1 285 ? 103.159 -11.847 -13.376 1.00 57.74 ? 371 LYS C CB 1 ATOM 7520 C CG . LYS C 1 285 ? 104.207 -10.881 -13.940 1.00 68.99 ? 371 LYS C CG 1 ATOM 7521 C CD . LYS C 1 285 ? 104.691 -9.877 -12.883 1.00 87.66 ? 371 LYS C CD 1 ATOM 7522 C CE . LYS C 1 285 ? 105.565 -8.794 -13.509 1.00 103.89 ? 371 LYS C CE 1 ATOM 7523 N NZ . LYS C 1 285 ? 104.950 -7.438 -13.386 1.00 109.26 ? 371 LYS C NZ 1 ATOM 7524 N N . LYS C 1 286 ? 101.505 -14.948 -14.701 1.00 58.08 ? 372 LYS C N 1 ATOM 7525 C CA . LYS C 1 286 ? 100.686 -16.095 -14.311 1.00 65.15 ? 372 LYS C CA 1 ATOM 7526 C C . LYS C 1 286 ? 101.428 -17.431 -14.257 1.00 60.58 ? 372 LYS C C 1 ATOM 7527 O O . LYS C 1 286 ? 102.199 -17.771 -15.171 1.00 52.77 ? 372 LYS C O 1 ATOM 7528 C CB . LYS C 1 286 ? 99.441 -16.196 -15.212 1.00 58.01 ? 372 LYS C CB 1 ATOM 7529 C CG . LYS C 1 286 ? 98.356 -15.201 -14.802 1.00 66.42 ? 372 LYS C CG 1 ATOM 7530 C CD . LYS C 1 286 ? 96.969 -15.846 -14.693 1.00 66.00 ? 372 LYS C CD 1 ATOM 7531 C CE . LYS C 1 286 ? 95.921 -14.853 -14.121 1.00 77.01 ? 372 LYS C CE 1 ATOM 7532 N NZ . LYS C 1 286 ? 95.797 -14.798 -12.613 1.00 68.03 ? 372 LYS C NZ 1 ATOM 7533 N N . GLY C 1 287 ? 101.185 -18.183 -13.177 1.00 55.51 ? 373 GLY C N 1 ATOM 7534 C CA . GLY C 1 287 ? 101.753 -19.515 -13.029 1.00 43.20 ? 373 GLY C CA 1 ATOM 7535 C C . GLY C 1 287 ? 103.195 -19.525 -12.544 1.00 52.56 ? 373 GLY C C 1 ATOM 7536 O O . GLY C 1 287 ? 103.946 -18.550 -12.698 1.00 57.20 ? 373 GLY C O 1 ATOM 7537 N N . PHE C 1 288 ? 103.589 -20.645 -11.955 1.00 47.92 ? 374 PHE C N 1 ATOM 7538 C CA . PHE C 1 288 ? 104.950 -20.800 -11.482 1.00 53.84 ? 374 PHE C CA 1 ATOM 7539 C C . PHE C 1 288 ? 105.407 -22.205 -11.804 1.00 58.21 ? 374 PHE C C 1 ATOM 7540 O O . PHE C 1 288 ? 104.657 -23.173 -11.627 1.00 48.94 ? 374 PHE C O 1 ATOM 7541 C CB . PHE C 1 288 ? 105.026 -20.550 -9.978 1.00 54.19 ? 374 PHE C CB 1 ATOM 7542 C CG . PHE C 1 288 ? 106.427 -20.488 -9.442 1.00 40.72 ? 374 PHE C CG 1 ATOM 7543 C CD1 . PHE C 1 288 ? 107.117 -19.290 -9.428 1.00 44.25 ? 374 PHE C CD1 1 ATOM 7544 C CD2 . PHE C 1 288 ? 107.048 -21.622 -8.939 1.00 37.88 ? 374 PHE C CD2 1 ATOM 7545 C CE1 . PHE C 1 288 ? 108.415 -19.214 -8.933 1.00 45.73 ? 374 PHE C CE1 1 ATOM 7546 C CE2 . PHE C 1 288 ? 108.337 -21.555 -8.449 1.00 44.99 ? 374 PHE C CE2 1 ATOM 7547 C CZ . PHE C 1 288 ? 109.023 -20.343 -8.441 1.00 45.50 ? 374 PHE C CZ 1 ATOM 7548 N N . GLU C 1 289 ? 106.635 -22.315 -12.293 1.00 57.49 ? 375 GLU C N 1 ATOM 7549 C CA . GLU C 1 289 ? 107.184 -23.618 -12.642 1.00 51.68 ? 375 GLU C CA 1 ATOM 7550 C C . GLU C 1 289 ? 108.545 -23.736 -11.986 1.00 50.58 ? 375 GLU C C 1 ATOM 7551 O O . GLU C 1 289 ? 109.175 -22.729 -11.662 1.00 60.57 ? 375 GLU C O 1 ATOM 7552 C CB . GLU C 1 289 ? 107.262 -23.815 -14.172 1.00 43.29 ? 375 GLU C CB 1 ATOM 7553 C CG . GLU C 1 289 ? 108.214 -22.844 -14.920 1.00 62.08 ? 375 GLU C CG 1 ATOM 7554 C CD . GLU C 1 289 ? 107.976 -22.811 -16.430 1.00 67.49 ? 375 GLU C CD 1 ATOM 7555 O OE1 . GLU C 1 289 ? 107.572 -23.854 -17.005 1.00 82.51 ? 375 GLU C OE1 1 ATOM 7556 O OE2 . GLU C 1 289 ? 108.198 -21.744 -17.048 1.00 66.73 ? 375 GLU C OE2 1 ATOM 7557 N N . ILE C 1 290 ? 108.975 -24.966 -11.750 1.00 43.36 ? 376 ILE C N 1 ATOM 7558 C CA . ILE C 1 290 ? 110.314 -25.204 -11.234 1.00 55.41 ? 376 ILE C CA 1 ATOM 7559 C C . ILE C 1 290 ? 110.888 -26.408 -11.981 1.00 61.87 ? 376 ILE C C 1 ATOM 7560 O O . ILE C 1 290 ? 110.246 -27.460 -12.108 1.00 58.21 ? 376 ILE C O 1 ATOM 7561 C CB . ILE C 1 290 ? 110.352 -25.335 -9.662 1.00 59.13 ? 376 ILE C CB 1 ATOM 7562 C CG1 . ILE C 1 290 ? 111.793 -25.297 -9.144 1.00 57.77 ? 376 ILE C CG1 1 ATOM 7563 C CG2 . ILE C 1 290 ? 109.574 -26.575 -9.154 1.00 46.15 ? 376 ILE C CG2 1 ATOM 7564 C CD1 . ILE C 1 290 ? 111.909 -25.135 -7.625 1.00 57.99 ? 376 ILE C CD1 1 ATOM 7565 N N . TYR C 1 291 ? 112.087 -26.219 -12.515 1.00 58.16 ? 377 TYR C N 1 ATOM 7566 C CA . TYR C 1 291 ? 112.687 -27.163 -13.446 1.00 55.73 ? 377 TYR C CA 1 ATOM 7567 C C . TYR C 1 291 ? 113.894 -27.819 -12.795 1.00 55.44 ? 377 TYR C C 1 ATOM 7568 O O . TYR C 1 291 ? 114.778 -27.122 -12.283 1.00 56.51 ? 377 TYR C O 1 ATOM 7569 C CB . TYR C 1 291 ? 113.128 -26.391 -14.688 1.00 59.76 ? 377 TYR C CB 1 ATOM 7570 C CG . TYR C 1 291 ? 113.371 -27.209 -15.924 1.00 74.10 ? 377 TYR C CG 1 ATOM 7571 C CD1 . TYR C 1 291 ? 113.167 -28.580 -15.941 1.00 84.00 ? 377 TYR C CD1 1 ATOM 7572 C CD2 . TYR C 1 291 ? 113.807 -26.599 -17.087 1.00 87.36 ? 377 TYR C CD2 1 ATOM 7573 C CE1 . TYR C 1 291 ? 113.399 -29.317 -17.091 1.00 93.08 ? 377 TYR C CE1 1 ATOM 7574 C CE2 . TYR C 1 291 ? 114.040 -27.318 -18.229 1.00 92.30 ? 377 TYR C CE2 1 ATOM 7575 C CZ . TYR C 1 291 ? 113.838 -28.672 -18.233 1.00 93.72 ? 377 TYR C CZ 1 ATOM 7576 O OH . TYR C 1 291 ? 114.086 -29.361 -19.395 1.00 84.56 ? 377 TYR C OH 1 ATOM 7577 N N . LYS C 1 292 ? 113.926 -29.152 -12.802 1.00 57.25 ? 378 LYS C N 1 ATOM 7578 C CA . LYS C 1 292 ? 115.045 -29.891 -12.217 1.00 53.80 ? 378 LYS C CA 1 ATOM 7579 C C . LYS C 1 292 ? 116.116 -30.120 -13.277 1.00 63.71 ? 378 LYS C C 1 ATOM 7580 O O . LYS C 1 292 ? 115.811 -30.439 -14.440 1.00 59.58 ? 378 LYS C O 1 ATOM 7581 C CB . LYS C 1 292 ? 114.585 -31.239 -11.657 1.00 60.28 ? 378 LYS C CB 1 ATOM 7582 C CG . LYS C 1 292 ? 115.635 -31.947 -10.797 1.00 75.41 ? 378 LYS C CG 1 ATOM 7583 C CD . LYS C 1 292 ? 115.622 -33.472 -10.982 1.00 87.06 ? 378 LYS C CD 1 ATOM 7584 C CE . LYS C 1 292 ? 114.497 -34.148 -10.210 1.00 94.85 ? 378 LYS C CE 1 ATOM 7585 N NZ . LYS C 1 292 ? 114.899 -35.493 -9.717 1.00 96.86 ? 378 LYS C NZ 1 ATOM 7586 N N . PHE C 1 293 ? 117.368 -29.944 -12.872 1.00 58.81 ? 379 PHE C N 1 ATOM 7587 C CA . PHE C 1 293 ? 118.498 -30.165 -13.760 1.00 68.91 ? 379 PHE C CA 1 ATOM 7588 C C . PHE C 1 293 ? 119.429 -31.197 -13.136 1.00 79.94 ? 379 PHE C C 1 ATOM 7589 O O . PHE C 1 293 ? 119.690 -31.158 -11.928 1.00 76.59 ? 379 PHE C O 1 ATOM 7590 C CB . PHE C 1 293 ? 119.236 -28.848 -14.034 1.00 72.48 ? 379 PHE C CB 1 ATOM 7591 C CG . PHE C 1 293 ? 118.454 -27.876 -14.894 1.00 73.29 ? 379 PHE C CG 1 ATOM 7592 C CD1 . PHE C 1 293 ? 118.492 -27.975 -16.278 1.00 69.62 ? 379 PHE C CD1 1 ATOM 7593 C CD2 . PHE C 1 293 ? 117.687 -26.863 -14.322 1.00 67.05 ? 379 PHE C CD2 1 ATOM 7594 C CE1 . PHE C 1 293 ? 117.777 -27.093 -17.082 1.00 61.56 ? 379 PHE C CE1 1 ATOM 7595 C CE2 . PHE C 1 293 ? 116.973 -25.984 -15.120 1.00 73.91 ? 379 PHE C CE2 1 ATOM 7596 C CZ . PHE C 1 293 ? 117.024 -26.097 -16.508 1.00 65.13 ? 379 PHE C CZ 1 ATOM 7597 N N . LEU C 1 294 ? 119.913 -32.129 -13.955 1.00 83.69 ? 380 LEU C N 1 ATOM 7598 C CA . LEU C 1 294 ? 120.827 -33.158 -13.470 1.00 73.73 ? 380 LEU C CA 1 ATOM 7599 C C . LEU C 1 294 ? 122.252 -32.619 -13.561 1.00 81.25 ? 380 LEU C C 1 ATOM 7600 O O . LEU C 1 294 ? 122.850 -32.620 -14.640 1.00 99.92 ? 380 LEU C O 1 ATOM 7601 C CB . LEU C 1 294 ? 120.675 -34.443 -14.293 1.00 80.23 ? 380 LEU C CB 1 ATOM 7602 C CG . LEU C 1 294 ? 119.254 -34.993 -14.497 1.00 70.48 ? 380 LEU C CG 1 ATOM 7603 C CD1 . LEU C 1 294 ? 119.249 -36.147 -15.478 1.00 66.15 ? 380 LEU C CD1 1 ATOM 7604 C CD2 . LEU C 1 294 ? 118.639 -35.425 -13.187 1.00 53.37 ? 380 LEU C CD2 1 ATOM 7605 N N . GLY C 1 295 ? 122.780 -32.139 -12.434 1.00 81.66 ? 381 GLY C N 1 ATOM 7606 C CA . GLY C 1 295 ? 124.071 -31.464 -12.409 1.00 90.73 ? 381 GLY C CA 1 ATOM 7607 C C . GLY C 1 295 ? 124.026 -29.972 -12.079 1.00 84.89 ? 381 GLY C C 1 ATOM 7608 O O . GLY C 1 295 ? 122.975 -29.426 -11.749 1.00 76.35 ? 381 GLY C O 1 ATOM 7609 N N . THR C 1 296 ? 125.181 -29.318 -12.185 1.00 89.06 ? 382 THR C N 1 ATOM 7610 C CA . THR C 1 296 ? 125.360 -27.921 -11.776 1.00 83.46 ? 382 THR C CA 1 ATOM 7611 C C . THR C 1 296 ? 124.703 -26.913 -12.723 1.00 82.58 ? 382 THR C C 1 ATOM 7612 O O . THR C 1 296 ? 124.525 -27.182 -13.911 1.00 76.33 ? 382 THR C O 1 ATOM 7613 C CB . THR C 1 296 ? 126.865 -27.574 -11.676 1.00 77.77 ? 382 THR C CB 1 ATOM 7614 O OG1 . THR C 1 296 ? 127.022 -26.203 -11.293 1.00 72.57 ? 382 THR C OG1 1 ATOM 7615 C CG2 . THR C 1 296 ? 127.570 -27.814 -13.028 1.00 72.63 ? 382 THR C CG2 1 ATOM 7616 N N . LEU C 1 297 ? 124.356 -25.744 -12.194 1.00 77.56 ? 383 LEU C N 1 ATOM 7617 C CA . LEU C 1 297 ? 123.784 -24.678 -13.005 1.00 79.34 ? 383 LEU C CA 1 ATOM 7618 C C . LEU C 1 297 ? 124.857 -24.033 -13.870 1.00 84.72 ? 383 LEU C C 1 ATOM 7619 O O . LEU C 1 297 ? 124.551 -23.212 -14.736 1.00 80.44 ? 383 LEU C O 1 ATOM 7620 C CB . LEU C 1 297 ? 123.170 -23.605 -12.102 1.00 84.34 ? 383 LEU C CB 1 ATOM 7621 C CG . LEU C 1 297 ? 122.018 -24.020 -11.182 1.00 80.85 ? 383 LEU C CG 1 ATOM 7622 C CD1 . LEU C 1 297 ? 121.786 -22.983 -10.084 1.00 74.06 ? 383 LEU C CD1 1 ATOM 7623 C CD2 . LEU C 1 297 ? 120.743 -24.247 -11.980 1.00 76.22 ? 383 LEU C CD2 1 ATOM 7624 N N . PHE C 1 298 ? 126.113 -24.411 -13.635 1.00 93.12 ? 384 PHE C N 1 ATOM 7625 C CA . PHE C 1 298 ? 127.253 -23.702 -14.216 1.00 94.59 ? 384 PHE C CA 1 ATOM 7626 C C . PHE C 1 298 ? 128.123 -24.533 -15.164 1.00 91.85 ? 384 PHE C C 1 ATOM 7627 O O . PHE C 1 298 ? 129.349 -24.400 -15.186 1.00 94.04 ? 384 PHE C O 1 ATOM 7628 C CB . PHE C 1 298 ? 128.079 -23.102 -13.088 1.00 89.03 ? 384 PHE C CB 1 ATOM 7629 C CG . PHE C 1 298 ? 127.242 -22.443 -12.040 1.00 84.30 ? 384 PHE C CG 1 ATOM 7630 C CD1 . PHE C 1 298 ? 126.483 -21.318 -12.352 1.00 76.45 ? 384 PHE C CD1 1 ATOM 7631 C CD2 . PHE C 1 298 ? 127.191 -22.953 -10.752 1.00 86.10 ? 384 PHE C CD2 1 ATOM 7632 C CE1 . PHE C 1 298 ? 125.694 -20.702 -11.392 1.00 67.47 ? 384 PHE C CE1 1 ATOM 7633 C CE2 . PHE C 1 298 ? 126.408 -22.341 -9.777 1.00 84.32 ? 384 PHE C CE2 1 ATOM 7634 C CZ . PHE C 1 298 ? 125.656 -21.211 -10.099 1.00 75.90 ? 384 PHE C CZ 1 ATOM 7635 N N . SER C 1 299 ? 127.464 -25.401 -15.926 1.00 84.76 ? 385 SER C N 1 ATOM 7636 C CA . SER C 1 299 ? 128.042 -26.053 -17.090 1.00 84.53 ? 385 SER C CA 1 ATOM 7637 C C . SER C 1 299 ? 127.031 -25.914 -18.212 1.00 86.27 ? 385 SER C C 1 ATOM 7638 O O . SER C 1 299 ? 125.856 -25.677 -17.964 1.00 91.44 ? 385 SER C O 1 ATOM 7639 C CB . SER C 1 299 ? 128.294 -27.531 -16.833 1.00 90.13 ? 385 SER C CB 1 ATOM 7640 O OG . SER C 1 299 ? 128.206 -28.245 -18.056 1.00 88.70 ? 385 SER C OG 1 ATOM 7641 N N . VAL C 1 300 ? 127.477 -26.061 -19.449 1.00 82.85 ? 387 VAL C N 1 ATOM 7642 C CA . VAL C 1 300 ? 126.567 -25.959 -20.580 1.00 83.70 ? 387 VAL C CA 1 ATOM 7643 C C . VAL C 1 300 ? 126.058 -27.347 -20.938 1.00 85.47 ? 387 VAL C C 1 ATOM 7644 O O . VAL C 1 300 ? 125.113 -27.511 -21.714 1.00 78.31 ? 387 VAL C O 1 ATOM 7645 C CB . VAL C 1 300 ? 127.272 -25.324 -21.777 1.00 73.54 ? 387 VAL C CB 1 ATOM 7646 C CG1 . VAL C 1 300 ? 126.775 -23.906 -21.993 1.00 55.07 ? 387 VAL C CG1 1 ATOM 7647 C CG2 . VAL C 1 300 ? 128.782 -25.332 -21.536 1.00 79.73 ? 387 VAL C CG2 1 ATOM 7648 N N . GLN C 1 301 ? 126.691 -28.351 -20.345 1.00 88.80 ? 388 GLN C N 1 ATOM 7649 C CA . GLN C 1 301 ? 126.330 -29.735 -20.602 1.00 90.58 ? 388 GLN C CA 1 ATOM 7650 C C . GLN C 1 301 ? 125.177 -30.212 -19.727 1.00 89.94 ? 388 GLN C C 1 ATOM 7651 O O . GLN C 1 301 ? 124.451 -31.119 -20.135 1.00 89.62 ? 388 GLN C O 1 ATOM 7652 C CB . GLN C 1 301 ? 127.549 -30.662 -20.447 1.00 95.63 ? 388 GLN C CB 1 ATOM 7653 C CG . GLN C 1 301 ? 128.761 -30.296 -21.298 1.00 103.31 ? 388 GLN C CG 1 ATOM 7654 C CD . GLN C 1 301 ? 130.006 -30.080 -20.454 1.00 114.62 ? 388 GLN C CD 1 ATOM 7655 O OE1 . GLN C 1 301 ? 130.374 -30.934 -19.647 1.00 114.31 ? 388 GLN C OE1 1 ATOM 7656 N NE2 . GLN C 1 301 ? 130.649 -28.923 -20.621 1.00 114.75 ? 388 GLN C NE2 1 ATOM 7657 N N . THR C 1 302 ? 124.994 -29.614 -18.544 1.00 88.40 ? 390 THR C N 1 ATOM 7658 C CA . THR C 1 302 ? 123.930 -30.083 -17.640 1.00 81.52 ? 390 THR C CA 1 ATOM 7659 C C . THR C 1 302 ? 122.536 -30.020 -18.295 1.00 84.93 ? 390 THR C C 1 ATOM 7660 O O . THR C 1 302 ? 122.236 -29.113 -19.093 1.00 76.93 ? 390 THR C O 1 ATOM 7661 C CB . THR C 1 302 ? 123.974 -29.448 -16.213 1.00 86.24 ? 390 THR C CB 1 ATOM 7662 O OG1 . THR C 1 302 ? 123.682 -28.054 -16.285 1.00 101.10 ? 390 THR C OG1 1 ATOM 7663 C CG2 . THR C 1 302 ? 125.349 -29.653 -15.569 1.00 86.66 ? 390 THR C CG2 1 ATOM 7664 N N . VAL C 1 303 ? 121.700 -31.006 -17.965 1.00 97.11 ? 391 VAL C N 1 ATOM 7665 C CA . VAL C 1 303 ? 120.644 -31.455 -18.884 1.00 96.14 ? 391 VAL C CA 1 ATOM 7666 C C . VAL C 1 303 ? 119.264 -30.806 -18.785 1.00 98.89 ? 391 VAL C C 1 ATOM 7667 O O . VAL C 1 303 ? 118.948 -29.926 -19.594 1.00 118.07 ? 391 VAL C O 1 ATOM 7668 C CB . VAL C 1 303 ? 120.495 -32.979 -18.853 1.00 94.43 ? 391 VAL C CB 1 ATOM 7669 C CG1 . VAL C 1 303 ? 120.181 -33.474 -20.241 1.00 67.07 ? 391 VAL C CG1 1 ATOM 7670 C CG2 . VAL C 1 303 ? 121.787 -33.618 -18.354 1.00 101.44 ? 391 VAL C CG2 1 ATOM 7671 N N . GLY C 1 304 ? 118.436 -31.253 -17.842 1.00 67.04 ? 392 GLY C N 1 ATOM 7672 C CA . GLY C 1 304 ? 117.056 -30.790 -17.808 1.00 66.49 ? 392 GLY C CA 1 ATOM 7673 C C . GLY C 1 304 ? 116.109 -31.978 -17.785 1.00 77.84 ? 392 GLY C C 1 ATOM 7674 O O . GLY C 1 304 ? 115.988 -32.709 -18.769 1.00 73.73 ? 392 GLY C O 1 ATOM 7675 N N . ASN C 1 305 A 115.432 -32.160 -16.654 1.00 86.86 ? 392 ASN C N 1 ATOM 7676 C CA . ASN C 1 305 A 114.875 -33.454 -16.300 1.00 74.70 ? 392 ASN C CA 1 ATOM 7677 C C . ASN C 1 305 A 113.366 -33.464 -16.104 1.00 80.67 ? 392 ASN C C 1 ATOM 7678 O O . ASN C 1 305 A 112.669 -34.324 -16.649 1.00 73.88 ? 392 ASN C O 1 ATOM 7679 C CB . ASN C 1 305 A 115.562 -33.961 -15.028 1.00 67.38 ? 392 ASN C CB 1 ATOM 7680 C CG . ASN C 1 305 A 115.225 -35.410 -14.725 1.00 75.41 ? 392 ASN C CG 1 ATOM 7681 O OD1 . ASN C 1 305 A 114.560 -35.715 -13.733 1.00 80.68 ? 392 ASN C OD1 1 ATOM 7682 N ND2 . ASN C 1 305 A 115.677 -36.312 -15.586 1.00 73.71 ? 392 ASN C ND2 1 ATOM 7683 N N . ARG C 1 306 ? 112.871 -32.533 -15.295 1.00 81.65 ? 393 ARG C N 1 ATOM 7684 C CA . ARG C 1 306 ? 111.444 -32.452 -15.033 1.00 68.98 ? 393 ARG C CA 1 ATOM 7685 C C . ARG C 1 306 ? 111.018 -31.052 -14.646 1.00 66.78 ? 393 ARG C C 1 ATOM 7686 O O . ARG C 1 306 ? 111.486 -30.496 -13.645 1.00 61.23 ? 393 ARG C O 1 ATOM 7687 C CB . ARG C 1 306 ? 111.021 -33.437 -13.941 1.00 59.28 ? 393 ARG C CB 1 ATOM 7688 C CG . ARG C 1 306 ? 109.501 -33.519 -13.764 1.00 59.33 ? 393 ARG C CG 1 ATOM 7689 C CD . ARG C 1 306 ? 109.097 -34.919 -13.356 1.00 82.64 ? 393 ARG C CD 1 ATOM 7690 N NE . ARG C 1 306 ? 107.814 -34.968 -12.661 1.00 83.93 ? 393 ARG C NE 1 ATOM 7691 C CZ . ARG C 1 306 ? 106.646 -34.766 -13.253 1.00 70.55 ? 393 ARG C CZ 1 ATOM 7692 N NH1 . ARG C 1 306 ? 106.598 -34.494 -14.547 1.00 85.66 ? 393 ARG C NH1 1 ATOM 7693 N NH2 . ARG C 1 306 ? 105.529 -34.832 -12.552 1.00 59.59 ? 393 ARG C NH2 1 ATOM 7694 N N . ASN C 1 307 ? 110.126 -30.494 -15.456 1.00 65.68 ? 394 ASN C N 1 ATOM 7695 C CA . ASN C 1 307 ? 109.551 -29.188 -15.198 1.00 64.52 ? 394 ASN C CA 1 ATOM 7696 C C . ASN C 1 307 ? 108.213 -29.323 -14.472 1.00 64.53 ? 394 ASN C C 1 ATOM 7697 O O . ASN C 1 307 ? 107.227 -29.780 -15.056 1.00 65.56 ? 394 ASN C O 1 ATOM 7698 C CB . ASN C 1 307 ? 109.352 -28.453 -16.520 1.00 59.54 ? 394 ASN C CB 1 ATOM 7699 C CG . ASN C 1 307 ? 109.093 -26.981 -16.329 1.00 70.35 ? 394 ASN C CG 1 ATOM 7700 O OD1 . ASN C 1 307 ? 110.009 -26.220 -16.039 1.00 100.55 ? 394 ASN C OD1 1 ATOM 7701 N ND2 . ASN C 1 307 ? 107.844 -26.569 -16.489 1.00 70.11 ? 394 ASN C ND2 1 ATOM 7702 N N . TYR C 1 308 ? 108.179 -28.935 -13.203 1.00 58.60 ? 395 TYR C N 1 ATOM 7703 C CA . TYR C 1 308 ? 106.938 -28.977 -12.426 1.00 56.82 ? 395 TYR C CA 1 ATOM 7704 C C . TYR C 1 308 ? 106.161 -27.668 -12.537 1.00 52.31 ? 395 TYR C C 1 ATOM 7705 O O . TYR C 1 308 ? 106.650 -26.610 -12.116 1.00 58.04 ? 395 TYR C O 1 ATOM 7706 C CB . TYR C 1 308 ? 107.242 -29.215 -10.945 1.00 49.88 ? 395 TYR C CB 1 ATOM 7707 C CG . TYR C 1 308 ? 107.651 -30.615 -10.578 1.00 51.92 ? 395 TYR C CG 1 ATOM 7708 C CD1 . TYR C 1 308 ? 106.752 -31.679 -10.684 1.00 57.18 ? 395 TYR C CD1 1 ATOM 7709 C CD2 . TYR C 1 308 ? 108.927 -30.877 -10.080 1.00 43.22 ? 395 TYR C CD2 1 ATOM 7710 C CE1 . TYR C 1 308 ? 107.124 -32.982 -10.313 1.00 53.75 ? 395 TYR C CE1 1 ATOM 7711 C CE2 . TYR C 1 308 ? 109.304 -32.166 -9.703 1.00 56.20 ? 395 TYR C CE2 1 ATOM 7712 C CZ . TYR C 1 308 ? 108.399 -33.212 -9.826 1.00 55.48 ? 395 TYR C CZ 1 ATOM 7713 O OH . TYR C 1 308 ? 108.775 -34.479 -9.458 1.00 60.82 ? 395 TYR C OH 1 ATOM 7714 N N . GLN C 1 309 ? 104.946 -27.730 -13.068 1.00 48.26 ? 396 GLN C N 1 ATOM 7715 C CA . GLN C 1 309 ? 104.093 -26.541 -13.086 1.00 53.27 ? 396 GLN C CA 1 ATOM 7716 C C . GLN C 1 309 ? 103.203 -26.433 -11.849 1.00 50.90 ? 396 GLN C C 1 ATOM 7717 O O . GLN C 1 309 ? 101.988 -26.677 -11.907 1.00 56.27 ? 396 GLN C O 1 ATOM 7718 C CB . GLN C 1 309 ? 103.272 -26.485 -14.357 1.00 57.07 ? 396 GLN C CB 1 ATOM 7719 C CG . GLN C 1 309 ? 104.086 -26.048 -15.545 1.00 78.25 ? 396 GLN C CG 1 ATOM 7720 C CD . GLN C 1 309 ? 103.532 -26.607 -16.812 1.00 92.10 ? 396 GLN C CD 1 ATOM 7721 O OE1 . GLN C 1 309 ? 103.903 -27.710 -17.229 1.00 107.41 ? 396 GLN C OE1 1 ATOM 7722 N NE2 . GLN C 1 309 ? 102.611 -25.873 -17.429 1.00 81.17 ? 396 GLN C NE2 1 ATOM 7723 N N . LEU C 1 310 ? 103.834 -26.028 -10.748 1.00 48.04 ? 397 LEU C N 1 ATOM 7724 C CA . LEU C 1 310 ? 103.206 -25.919 -9.425 1.00 47.82 ? 397 LEU C CA 1 ATOM 7725 C C . LEU C 1 310 ? 101.923 -25.063 -9.376 1.00 56.27 ? 397 LEU C C 1 ATOM 7726 O O . LEU C 1 310 ? 100.915 -25.493 -8.796 1.00 48.92 ? 397 LEU C O 1 ATOM 7727 C CB . LEU C 1 310 ? 104.235 -25.449 -8.385 1.00 42.24 ? 397 LEU C CB 1 ATOM 7728 C CG . LEU C 1 310 ? 105.434 -26.405 -8.176 1.00 48.88 ? 397 LEU C CG 1 ATOM 7729 C CD1 . LEU C 1 310 ? 106.392 -25.945 -7.068 1.00 45.06 ? 397 LEU C CD1 1 ATOM 7730 C CD2 . LEU C 1 310 ? 104.948 -27.815 -7.880 1.00 40.30 ? 397 LEU C CD2 1 ATOM 7731 N N . LEU C 1 311 ? 101.945 -23.873 -9.984 1.00 52.37 ? 398 LEU C N 1 ATOM 7732 C CA . LEU C 1 311 ? 100.749 -23.020 -10.028 1.00 49.78 ? 398 LEU C CA 1 ATOM 7733 C C . LEU C 1 311 ? 100.398 -22.576 -11.443 1.00 54.66 ? 398 LEU C C 1 ATOM 7734 O O . LEU C 1 311 ? 101.270 -22.482 -12.295 1.00 55.95 ? 398 LEU C O 1 ATOM 7735 C CB . LEU C 1 311 ? 100.908 -21.793 -9.136 1.00 52.23 ? 398 LEU C CB 1 ATOM 7736 C CG . LEU C 1 311 ? 100.899 -21.950 -7.612 1.00 55.40 ? 398 LEU C CG 1 ATOM 7737 C CD1 . LEU C 1 311 ? 102.306 -22.129 -7.093 1.00 52.37 ? 398 LEU C CD1 1 ATOM 7738 C CD2 . LEU C 1 311 ? 100.303 -20.714 -7.023 1.00 59.64 ? 398 LEU C CD2 1 ATOM 7739 N N . SER C 1 312 ? 99.121 -22.279 -11.676 1.00 63.33 ? 399 SER C N 1 ATOM 7740 C CA . SER C 1 312 ? 98.629 -21.892 -13.001 1.00 61.94 ? 399 SER C CA 1 ATOM 7741 C C . SER C 1 312 ? 97.629 -20.766 -12.874 1.00 60.95 ? 399 SER C C 1 ATOM 7742 O O . SER C 1 312 ? 97.658 -19.792 -13.620 1.00 62.56 ? 399 SER C O 1 ATOM 7743 C CB . SER C 1 312 ? 97.919 -23.071 -13.649 1.00 50.40 ? 399 SER C CB 1 ATOM 7744 O OG . SER C 1 312 ? 98.719 -24.228 -13.534 1.00 87.63 ? 399 SER C OG 1 ATOM 7745 N N . ASN C 1 313 ? 96.729 -20.936 -11.920 1.00 59.77 ? 401 ASN C N 1 ATOM 7746 C CA . ASN C 1 313 ? 95.623 -20.032 -11.727 1.00 63.38 ? 401 ASN C CA 1 ATOM 7747 C C . ASN C 1 313 ? 96.073 -18.630 -11.352 1.00 55.93 ? 401 ASN C C 1 ATOM 7748 O O . ASN C 1 313 ? 95.551 -17.639 -11.857 1.00 66.13 ? 401 ASN C O 1 ATOM 7749 C CB . ASN C 1 313 ? 94.699 -20.571 -10.623 1.00 74.74 ? 401 ASN C CB 1 ATOM 7750 C CG . ASN C 1 313 ? 93.875 -21.778 -11.067 1.00 87.63 ? 401 ASN C CG 1 ATOM 7751 O OD1 . ASN C 1 313 ? 94.200 -22.456 -12.053 1.00 86.65 ? 401 ASN C OD1 1 ATOM 7752 N ND2 . ASN C 1 313 ? 92.794 -22.048 -10.322 1.00 97.45 ? 401 ASN C ND2 1 ATOM 7753 N N . SER C 1 314 ? 97.047 -18.532 -10.465 1.00 53.78 ? 402 SER C N 1 ATOM 7754 C CA . SER C 1 314 ? 97.255 -17.262 -9.790 1.00 57.30 ? 402 SER C CA 1 ATOM 7755 C C . SER C 1 314 ? 98.404 -16.405 -10.328 1.00 58.36 ? 402 SER C C 1 ATOM 7756 O O . SER C 1 314 ? 99.265 -16.866 -11.097 1.00 53.66 ? 402 SER C O 1 ATOM 7757 C CB . SER C 1 314 ? 97.332 -17.468 -8.261 1.00 59.98 ? 402 SER C CB 1 ATOM 7758 O OG . SER C 1 314 ? 98.363 -18.357 -7.942 1.00 60.74 ? 402 SER C OG 1 ATOM 7759 N N . THR C 1 315 ? 98.366 -15.133 -9.941 1.00 65.35 ? 403 THR C N 1 ATOM 7760 C CA . THR C 1 315 ? 99.330 -14.126 -10.384 1.00 53.70 ? 403 THR C CA 1 ATOM 7761 C C . THR C 1 315 ? 100.504 -14.026 -9.404 1.00 48.02 ? 403 THR C C 1 ATOM 7762 O O . THR C 1 315 ? 100.331 -13.670 -8.240 1.00 71.80 ? 403 THR C O 1 ATOM 7763 C CB . THR C 1 315 ? 98.628 -12.765 -10.545 1.00 50.93 ? 403 THR C CB 1 ATOM 7764 O OG1 . THR C 1 315 ? 97.638 -12.878 -11.572 1.00 56.72 ? 403 THR C OG1 1 ATOM 7765 C CG2 . THR C 1 315 ? 99.605 -11.682 -10.927 1.00 49.18 ? 403 THR C CG2 1 ATOM 7766 N N . ILE C 1 316 ? 101.692 -14.362 -9.898 1.00 46.13 ? 404 ILE C N 1 ATOM 7767 C CA . ILE C 1 316 ? 102.913 -14.473 -9.093 1.00 46.79 ? 404 ILE C CA 1 ATOM 7768 C C . ILE C 1 316 ? 103.691 -13.151 -9.013 1.00 53.27 ? 404 ILE C C 1 ATOM 7769 O O . ILE C 1 316 ? 103.682 -12.345 -9.943 1.00 45.43 ? 404 ILE C O 1 ATOM 7770 C CB . ILE C 1 316 ? 103.881 -15.539 -9.679 1.00 54.78 ? 404 ILE C CB 1 ATOM 7771 C CG1 . ILE C 1 316 ? 103.135 -16.818 -10.091 1.00 56.00 ? 404 ILE C CG1 1 ATOM 7772 C CG2 . ILE C 1 316 ? 105.046 -15.829 -8.726 1.00 50.92 ? 404 ILE C CG2 1 ATOM 7773 C CD1 . ILE C 1 316 ? 102.195 -17.388 -9.056 1.00 47.32 ? 404 ILE C CD1 1 ATOM 7774 N N . GLY C 1 317 ? 104.357 -12.934 -7.885 1.00 56.10 ? 405 GLY C N 1 ATOM 7775 C CA . GLY C 1 317 ? 105.294 -11.837 -7.746 1.00 44.91 ? 405 GLY C CA 1 ATOM 7776 C C . GLY C 1 317 ? 106.621 -12.407 -7.291 1.00 56.40 ? 405 GLY C C 1 ATOM 7777 O O . GLY C 1 317 ? 107.188 -13.288 -7.954 1.00 48.30 ? 405 GLY C O 1 ATOM 7778 N N . ARG C 1 318 ? 107.109 -11.930 -6.147 1.00 61.50 ? 406 ARG C N 1 ATOM 7779 C CA . ARG C 1 318 ? 108.407 -12.356 -5.648 1.00 56.42 ? 406 ARG C CA 1 ATOM 7780 C C . ARG C 1 318 ? 108.384 -13.811 -5.159 1.00 58.64 ? 406 ARG C C 1 ATOM 7781 O O . ARG C 1 318 ? 107.331 -14.362 -4.809 1.00 48.31 ? 406 ARG C O 1 ATOM 7782 C CB . ARG C 1 318 ? 108.870 -11.444 -4.517 1.00 51.33 ? 406 ARG C CB 1 ATOM 7783 C CG . ARG C 1 318 ? 109.047 -9.974 -4.882 1.00 48.51 ? 406 ARG C CG 1 ATOM 7784 C CD . ARG C 1 318 ? 109.515 -9.191 -3.643 1.00 45.24 ? 406 ARG C CD 1 ATOM 7785 N NE . ARG C 1 318 ? 108.738 -9.653 -2.500 1.00 63.51 ? 406 ARG C NE 1 ATOM 7786 C CZ . ARG C 1 318 ? 109.251 -10.093 -1.362 1.00 59.95 ? 406 ARG C CZ 1 ATOM 7787 N NH1 . ARG C 1 318 ? 110.559 -10.105 -1.160 1.00 72.97 ? 406 ARG C NH1 1 ATOM 7788 N NH2 . ARG C 1 318 ? 108.439 -10.508 -0.422 1.00 58.65 ? 406 ARG C NH2 1 ATOM 7789 N N . SER C 1 319 ? 109.556 -14.436 -5.152 1.00 49.41 ? 407 SER C N 1 ATOM 7790 C CA . SER C 1 319 ? 109.703 -15.772 -4.584 1.00 47.11 ? 407 SER C CA 1 ATOM 7791 C C . SER C 1 319 ? 111.070 -15.871 -3.861 1.00 59.92 ? 407 SER C C 1 ATOM 7792 O O . SER C 1 319 ? 112.043 -15.212 -4.257 1.00 50.18 ? 407 SER C O 1 ATOM 7793 C CB . SER C 1 319 ? 109.505 -16.861 -5.650 1.00 42.13 ? 407 SER C CB 1 ATOM 7794 O OG . SER C 1 319 ? 110.539 -16.858 -6.629 1.00 56.67 ? 407 SER C OG 1 ATOM 7795 N N . GLY C 1 320 ? 111.126 -16.651 -2.780 1.00 54.87 ? 408 GLY C N 1 ATOM 7796 C CA . GLY C 1 320 ? 112.330 -16.711 -1.973 1.00 50.64 ? 408 GLY C CA 1 ATOM 7797 C C . GLY C 1 320 ? 112.613 -18.033 -1.300 1.00 61.64 ? 408 GLY C C 1 ATOM 7798 O O . GLY C 1 320 ? 111.742 -18.897 -1.239 1.00 59.63 ? 408 GLY C O 1 ATOM 7799 N N . LEU C 1 321 ? 113.832 -18.197 -0.791 1.00 61.23 ? 409 LEU C N 1 ATOM 7800 C CA . LEU C 1 321 ? 114.231 -19.459 -0.153 1.00 54.95 ? 409 LEU C CA 1 ATOM 7801 C C . LEU C 1 321 ? 114.233 -19.388 1.384 1.00 61.46 ? 409 LEU C C 1 ATOM 7802 O O . LEU C 1 321 ? 114.394 -18.309 1.966 1.00 62.27 ? 409 LEU C O 1 ATOM 7803 C CB . LEU C 1 321 ? 115.634 -19.829 -0.632 1.00 64.93 ? 409 LEU C CB 1 ATOM 7804 C CG . LEU C 1 321 ? 115.886 -21.027 -1.541 1.00 63.97 ? 409 LEU C CG 1 ATOM 7805 C CD1 . LEU C 1 321 ? 114.653 -21.414 -2.346 1.00 48.30 ? 409 LEU C CD1 1 ATOM 7806 C CD2 . LEU C 1 321 ? 117.059 -20.686 -2.450 1.00 53.06 ? 409 LEU C CD2 1 ATOM 7807 N N . TYR C 1 322 ? 114.062 -20.540 2.040 1.00 66.66 ? 410 TYR C N 1 ATOM 7808 C CA . TYR C 1 322 ? 114.230 -20.623 3.500 1.00 54.12 ? 410 TYR C CA 1 ATOM 7809 C C . TYR C 1 322 ? 114.509 -22.044 3.982 1.00 56.33 ? 410 TYR C C 1 ATOM 7810 O O . TYR C 1 322 ? 114.004 -23.004 3.397 1.00 64.37 ? 410 TYR C O 1 ATOM 7811 C CB . TYR C 1 322 ? 113.034 -20.011 4.247 1.00 46.12 ? 410 TYR C CB 1 ATOM 7812 C CG . TYR C 1 322 ? 111.747 -20.805 4.204 1.00 54.40 ? 410 TYR C CG 1 ATOM 7813 C CD1 . TYR C 1 322 ? 110.879 -20.714 3.110 1.00 59.04 ? 410 TYR C CD1 1 ATOM 7814 C CD2 . TYR C 1 322 ? 111.374 -21.619 5.274 1.00 48.73 ? 410 TYR C CD2 1 ATOM 7815 C CE1 . TYR C 1 322 ? 109.682 -21.433 3.072 1.00 62.40 ? 410 TYR C CE1 1 ATOM 7816 C CE2 . TYR C 1 322 ? 110.177 -22.339 5.250 1.00 51.46 ? 410 TYR C CE2 1 ATOM 7817 C CZ . TYR C 1 322 ? 109.337 -22.241 4.150 1.00 70.53 ? 410 TYR C CZ 1 ATOM 7818 O OH . TYR C 1 322 ? 108.160 -22.956 4.129 1.00 72.60 ? 410 TYR C OH 1 ATOM 7819 N N . GLN C 1 323 ? 115.321 -22.166 5.037 1.00 55.61 ? 411 GLN C N 1 ATOM 7820 C CA . GLN C 1 323 ? 115.623 -23.469 5.654 1.00 50.71 ? 411 GLN C CA 1 ATOM 7821 C C . GLN C 1 323 ? 115.065 -23.602 7.079 1.00 57.92 ? 411 GLN C C 1 ATOM 7822 O O . GLN C 1 323 ? 115.481 -22.873 7.985 1.00 62.74 ? 411 GLN C O 1 ATOM 7823 C CB . GLN C 1 323 ? 117.131 -23.705 5.673 1.00 42.14 ? 411 GLN C CB 1 ATOM 7824 C CG . GLN C 1 323 ? 117.726 -23.958 4.299 1.00 49.51 ? 411 GLN C CG 1 ATOM 7825 C CD . GLN C 1 323 ? 119.252 -23.813 4.275 1.00 65.64 ? 411 GLN C CD 1 ATOM 7826 O OE1 . GLN C 1 323 ? 119.814 -22.821 4.777 1.00 67.41 ? 411 GLN C OE1 1 ATOM 7827 N NE2 . GLN C 1 323 ? 119.929 -24.803 3.686 1.00 55.96 ? 411 GLN C NE2 1 ATOM 7828 N N . PRO C 1 324 ? 114.115 -24.533 7.283 1.00 69.70 ? 412 PRO C N 1 ATOM 7829 C CA . PRO C 1 324 ? 113.578 -24.810 8.625 1.00 60.86 ? 412 PRO C CA 1 ATOM 7830 C C . PRO C 1 324 ? 114.655 -25.474 9.479 1.00 63.19 ? 412 PRO C C 1 ATOM 7831 O O . PRO C 1 324 ? 115.396 -26.295 8.928 1.00 67.03 ? 412 PRO C O 1 ATOM 7832 C CB . PRO C 1 324 ? 112.445 -25.814 8.353 1.00 54.05 ? 412 PRO C CB 1 ATOM 7833 C CG . PRO C 1 324 ? 112.173 -25.736 6.892 1.00 70.97 ? 412 PRO C CG 1 ATOM 7834 C CD . PRO C 1 324 ? 113.480 -25.374 6.254 1.00 75.38 ? 412 PRO C CD 1 ATOM 7835 N N . ALA C 1 325 ? 114.760 -25.139 10.767 1.00 72.39 ? 413 ALA C N 1 ATOM 7836 C CA . ALA C 1 325 ? 115.763 -25.798 11.606 1.00 77.10 ? 413 ALA C CA 1 ATOM 7837 C C . ALA C 1 325 ? 115.320 -26.062 13.041 1.00 81.10 ? 413 ALA C C 1 ATOM 7838 O O . ALA C 1 325 ? 116.083 -25.839 13.994 1.00 86.72 ? 413 ALA C O 1 ATOM 7839 C CB . ALA C 1 325 ? 117.092 -25.037 11.578 1.00 80.03 ? 413 ALA C CB 1 ATOM 7840 N N . TYR C 1 326 A 114.082 -26.520 13.190 1.00 81.16 ? 413 TYR C N 1 ATOM 7841 C CA . TYR C 1 326 A 113.644 -27.147 14.437 1.00 89.80 ? 413 TYR C CA 1 ATOM 7842 C C . TYR C 1 326 A 113.498 -28.643 14.154 1.00 92.80 ? 413 TYR C C 1 ATOM 7843 O O . TYR C 1 326 A 112.568 -29.326 14.602 1.00 73.78 ? 413 TYR C O 1 ATOM 7844 C CB . TYR C 1 326 A 112.375 -26.507 14.990 1.00 78.72 ? 413 TYR C CB 1 ATOM 7845 C CG . TYR C 1 326 A 111.262 -26.281 13.985 1.00 89.64 ? 413 TYR C CG 1 ATOM 7846 C CD1 . TYR C 1 326 A 111.273 -25.186 13.122 1.00 85.50 ? 413 TYR C CD1 1 ATOM 7847 C CD2 . TYR C 1 326 A 110.182 -27.151 13.923 1.00 88.46 ? 413 TYR C CD2 1 ATOM 7848 C CE1 . TYR C 1 326 A 110.244 -24.981 12.216 1.00 76.91 ? 413 TYR C CE1 1 ATOM 7849 C CE2 . TYR C 1 326 A 109.155 -26.954 13.030 1.00 86.60 ? 413 TYR C CE2 1 ATOM 7850 C CZ . TYR C 1 326 A 109.185 -25.870 12.178 1.00 87.18 ? 413 TYR C CZ 1 ATOM 7851 O OH . TYR C 1 326 A 108.146 -25.691 11.290 1.00 84.94 ? 413 TYR C OH 1 ATOM 7852 N N . GLU C 1 327 ? 114.468 -29.120 13.383 1.00 105.30 ? 414 GLU C N 1 ATOM 7853 C CA . GLU C 1 327 ? 114.595 -30.509 13.005 1.00 110.77 ? 414 GLU C CA 1 ATOM 7854 C C . GLU C 1 327 ? 115.322 -31.276 14.099 1.00 114.43 ? 414 GLU C C 1 ATOM 7855 O O . GLU C 1 327 ? 115.979 -30.695 14.966 1.00 117.48 ? 414 GLU C O 1 ATOM 7856 C CB . GLU C 1 327 ? 115.380 -30.616 11.684 1.00 116.93 ? 414 GLU C CB 1 ATOM 7857 C CG . GLU C 1 327 ? 116.345 -29.429 11.383 1.00 139.63 ? 414 GLU C CG 1 ATOM 7858 C CD . GLU C 1 327 ? 117.812 -29.844 11.220 1.00 135.37 ? 414 GLU C CD 1 ATOM 7859 O OE1 . GLU C 1 327 ? 118.214 -30.889 11.777 1.00 132.54 ? 414 GLU C OE1 1 ATOM 7860 O OE2 . GLU C 1 327 ? 118.573 -29.117 10.540 1.00 127.86 ? 414 GLU C OE2 1 ATOM 7861 N N . SER C 1 328 ? 115.152 -32.588 14.071 1.00 108.44 ? 415 SER C N 1 ATOM 7862 C CA . SER C 1 328 ? 116.089 -33.491 14.693 1.00 112.14 ? 415 SER C CA 1 ATOM 7863 C C . SER C 1 328 ? 116.355 -34.466 13.560 1.00 119.27 ? 415 SER C C 1 ATOM 7864 O O . SER C 1 328 ? 116.439 -35.685 13.763 1.00 130.19 ? 415 SER C O 1 ATOM 7865 C CB . SER C 1 328 ? 115.483 -34.177 15.910 1.00 109.64 ? 415 SER C CB 1 ATOM 7866 O OG . SER C 1 328 ? 116.393 -34.176 16.996 1.00 108.64 ? 415 SER C OG 1 ATOM 7867 N N . ARG C 1 329 A 116.457 -33.891 12.356 1.00 104.25 ? 415 ARG C N 1 ATOM 7868 C CA . ARG C 1 329 A 116.567 -34.637 11.101 1.00 99.88 ? 415 ARG C CA 1 ATOM 7869 C C . ARG C 1 329 A 118.015 -34.778 10.633 1.00 94.11 ? 415 ARG C C 1 ATOM 7870 O O . ARG C 1 329 A 118.844 -33.890 10.862 1.00 104.72 ? 415 ARG C O 1 ATOM 7871 C CB . ARG C 1 329 A 115.732 -33.971 9.994 1.00 107.30 ? 415 ARG C CB 1 ATOM 7872 C CG . ARG C 1 329 A 114.218 -34.112 10.138 1.00 106.99 ? 415 ARG C CG 1 ATOM 7873 C CD . ARG C 1 329 A 113.490 -33.662 8.867 1.00 110.36 ? 415 ARG C CD 1 ATOM 7874 N NE . ARG C 1 329 A 113.606 -34.626 7.770 1.00 113.15 ? 415 ARG C NE 1 ATOM 7875 C CZ . ARG C 1 329 A 113.137 -34.430 6.538 1.00 110.45 ? 415 ARG C CZ 1 ATOM 7876 N NH1 . ARG C 1 329 A 112.519 -33.297 6.222 1.00 94.13 ? 415 ARG C NH1 1 ATOM 7877 N NH2 . ARG C 1 329 A 113.292 -35.371 5.617 1.00 112.99 ? 415 ARG C NH2 1 ATOM 7878 N N . ASP C 1 330 ? 118.290 -35.894 9.957 1.00 84.13 ? 416 ASP C N 1 ATOM 7879 C CA . ASP C 1 330 ? 119.632 -36.269 9.506 1.00 102.38 ? 416 ASP C CA 1 ATOM 7880 C C . ASP C 1 330 ? 120.078 -35.593 8.196 1.00 96.40 ? 416 ASP C C 1 ATOM 7881 O O . ASP C 1 330 ? 121.128 -35.932 7.634 1.00 90.13 ? 416 ASP C O 1 ATOM 7882 C CB . ASP C 1 330 ? 119.714 -37.796 9.356 1.00 120.95 ? 416 ASP C CB 1 ATOM 7883 C CG . ASP C 1 330 ? 118.566 -38.368 8.525 1.00 134.77 ? 416 ASP C CG 1 ATOM 7884 O OD1 . ASP C 1 330 ? 117.803 -37.580 7.920 1.00 138.11 ? 416 ASP C OD1 1 ATOM 7885 O OD2 . ASP C 1 330 ? 118.430 -39.612 8.471 1.00 136.54 ? 416 ASP C OD2 1 ATOM 7886 N N . CYS C 1 331 ? 119.269 -34.655 7.707 1.00 89.46 ? 417 CYS C N 1 ATOM 7887 C CA . CYS C 1 331 ? 119.613 -33.861 6.526 1.00 86.14 ? 417 CYS C CA 1 ATOM 7888 C C . CYS C 1 331 ? 118.943 -32.499 6.658 1.00 80.07 ? 417 CYS C C 1 ATOM 7889 O O . CYS C 1 331 ? 117.967 -32.358 7.409 1.00 63.20 ? 417 CYS C O 1 ATOM 7890 C CB . CYS C 1 331 ? 119.170 -34.556 5.237 1.00 80.95 ? 417 CYS C CB 1 ATOM 7891 S SG . CYS C 1 331 ? 117.384 -34.868 5.142 1.00 103.68 ? 417 CYS C SG 1 ATOM 7892 N N . GLN C 1 332 ? 119.466 -31.498 5.945 1.00 76.28 ? 418 GLN C N 1 ATOM 7893 C CA . GLN C 1 332 ? 118.958 -30.130 6.075 1.00 57.30 ? 418 GLN C CA 1 ATOM 7894 C C . GLN C 1 332 ? 117.864 -29.843 5.039 1.00 62.60 ? 418 GLN C C 1 ATOM 7895 O O . GLN C 1 332 ? 118.131 -29.843 3.832 1.00 63.31 ? 418 GLN C O 1 ATOM 7896 C CB . GLN C 1 332 ? 120.095 -29.114 5.961 1.00 61.04 ? 418 GLN C CB 1 ATOM 7897 C CG . GLN C 1 332 ? 119.628 -27.653 5.931 1.00 71.31 ? 418 GLN C CG 1 ATOM 7898 C CD . GLN C 1 332 ? 118.818 -27.264 7.168 1.00 73.91 ? 418 GLN C CD 1 ATOM 7899 O OE1 . GLN C 1 332 ? 119.333 -27.281 8.293 1.00 70.14 ? 418 GLN C OE1 1 ATOM 7900 N NE2 . GLN C 1 332 ? 117.544 -26.918 6.964 1.00 62.33 ? 418 GLN C NE2 1 ATOM 7901 N N . GLU C 1 333 ? 116.634 -29.604 5.505 1.00 65.52 ? 419 GLU C N 1 ATOM 7902 C CA . GLU C 1 333 ? 115.509 -29.390 4.585 1.00 63.93 ? 419 GLU C CA 1 ATOM 7903 C C . GLU C 1 333 ? 115.496 -27.986 3.940 1.00 60.21 ? 419 GLU C C 1 ATOM 7904 O O . GLU C 1 333 ? 115.884 -26.987 4.561 1.00 69.40 ? 419 GLU C O 1 ATOM 7905 C CB . GLU C 1 333 ? 114.171 -29.729 5.268 1.00 55.70 ? 419 GLU C CB 1 ATOM 7906 C CG . GLU C 1 333 ? 112.900 -29.281 4.517 1.00 75.05 ? 419 GLU C CG 1 ATOM 7907 C CD . GLU C 1 333 ? 112.514 -30.172 3.326 1.00 92.65 ? 419 GLU C CD 1 ATOM 7908 O OE1 . GLU C 1 333 ? 113.406 -30.592 2.554 1.00 97.08 ? 419 GLU C OE1 1 ATOM 7909 O OE2 . GLU C 1 333 ? 111.304 -30.445 3.152 1.00 94.45 ? 419 GLU C OE2 1 ATOM 7910 N N . LEU C 1 334 ? 115.067 -27.927 2.683 1.00 62.12 ? 420 LEU C N 1 ATOM 7911 C CA . LEU C 1 334 ? 115.030 -26.679 1.926 1.00 58.75 ? 420 LEU C CA 1 ATOM 7912 C C . LEU C 1 334 ? 113.611 -26.394 1.443 1.00 59.39 ? 420 LEU C C 1 ATOM 7913 O O . LEU C 1 334 ? 112.891 -27.290 0.983 1.00 68.15 ? 420 LEU C O 1 ATOM 7914 C CB . LEU C 1 334 ? 115.994 -26.758 0.736 1.00 52.17 ? 420 LEU C CB 1 ATOM 7915 C CG . LEU C 1 334 ? 116.277 -25.484 -0.053 1.00 60.27 ? 420 LEU C CG 1 ATOM 7916 C CD1 . LEU C 1 334 ? 116.624 -24.320 0.884 1.00 58.36 ? 420 LEU C CD1 1 ATOM 7917 C CD2 . LEU C 1 334 ? 117.397 -25.719 -1.078 1.00 60.87 ? 420 LEU C CD2 1 ATOM 7918 N N . CYS C 1 335 ? 113.212 -25.137 1.557 1.00 57.28 ? 421 CYS C N 1 ATOM 7919 C CA . CYS C 1 335 ? 111.869 -24.719 1.162 1.00 54.14 ? 421 CYS C CA 1 ATOM 7920 C C . CYS C 1 335 ? 111.895 -23.415 0.375 1.00 51.61 ? 421 CYS C C 1 ATOM 7921 O O . CYS C 1 335 ? 112.903 -22.700 0.362 1.00 61.30 ? 421 CYS C O 1 ATOM 7922 C CB . CYS C 1 335 ? 111.007 -24.495 2.409 1.00 48.37 ? 421 CYS C CB 1 ATOM 7923 S SG . CYS C 1 335 ? 110.824 -25.933 3.464 1.00 67.41 ? 421 CYS C SG 1 ATOM 7924 N N . PHE C 1 336 ? 110.778 -23.091 -0.263 1.00 47.38 ? 422 PHE C N 1 ATOM 7925 C CA . PHE C 1 336 ? 110.626 -21.751 -0.832 1.00 57.51 ? 422 PHE C CA 1 ATOM 7926 C C . PHE C 1 336 ? 109.231 -21.165 -0.615 1.00 61.17 ? 422 PHE C C 1 ATOM 7927 O O . PHE C 1 336 ? 108.248 -21.899 -0.406 1.00 50.71 ? 422 PHE C O 1 ATOM 7928 C CB . PHE C 1 336 ? 111.062 -21.678 -2.315 1.00 52.11 ? 422 PHE C CB 1 ATOM 7929 C CG . PHE C 1 336 ? 110.258 -22.534 -3.239 1.00 51.24 ? 422 PHE C CG 1 ATOM 7930 C CD1 . PHE C 1 336 ? 109.082 -22.048 -3.805 1.00 62.91 ? 422 PHE C CD1 1 ATOM 7931 C CD2 . PHE C 1 336 ? 110.690 -23.813 -3.581 1.00 49.38 ? 422 PHE C CD2 1 ATOM 7932 C CE1 . PHE C 1 336 ? 108.330 -22.837 -4.677 1.00 57.21 ? 422 PHE C CE1 1 ATOM 7933 C CE2 . PHE C 1 336 ? 109.942 -24.610 -4.461 1.00 56.06 ? 422 PHE C CE2 1 ATOM 7934 C CZ . PHE C 1 336 ? 108.761 -24.119 -5.003 1.00 51.43 ? 422 PHE C CZ 1 ATOM 7935 N N . TRP C 1 337 ? 109.172 -19.835 -0.620 1.00 54.11 ? 423 TRP C N 1 ATOM 7936 C CA . TRP C 1 337 ? 107.908 -19.123 -0.544 1.00 52.26 ? 423 TRP C CA 1 ATOM 7937 C C . TRP C 1 337 ? 107.682 -18.374 -1.855 1.00 47.89 ? 423 TRP C C 1 ATOM 7938 O O . TRP C 1 337 ? 108.627 -17.875 -2.466 1.00 46.42 ? 423 TRP C O 1 ATOM 7939 C CB . TRP C 1 337 ? 107.888 -18.143 0.636 1.00 49.65 ? 423 TRP C CB 1 ATOM 7940 C CG . TRP C 1 337 ? 109.053 -17.175 0.636 1.00 46.52 ? 423 TRP C CG 1 ATOM 7941 C CD1 . TRP C 1 337 ? 110.192 -17.285 1.367 1.00 48.38 ? 423 TRP C CD1 1 ATOM 7942 C CD2 . TRP C 1 337 ? 109.180 -15.959 -0.124 1.00 42.86 ? 423 TRP C CD2 1 ATOM 7943 N NE1 . TRP C 1 337 ? 111.021 -16.220 1.123 1.00 53.12 ? 423 TRP C NE1 1 ATOM 7944 C CE2 . TRP C 1 337 ? 110.427 -15.389 0.212 1.00 46.96 ? 423 TRP C CE2 1 ATOM 7945 C CE3 . TRP C 1 337 ? 108.363 -15.297 -1.053 1.00 45.00 ? 423 TRP C CE3 1 ATOM 7946 C CZ2 . TRP C 1 337 ? 110.891 -14.194 -0.358 1.00 45.97 ? 423 TRP C CZ2 1 ATOM 7947 C CZ3 . TRP C 1 337 ? 108.826 -14.107 -1.620 1.00 55.74 ? 423 TRP C CZ3 1 ATOM 7948 C CH2 . TRP C 1 337 ? 110.080 -13.571 -1.268 1.00 50.04 ? 423 TRP C CH2 1 ATOM 7949 N N . ILE C 1 338 ? 106.420 -18.305 -2.266 1.00 47.29 ? 424 ILE C N 1 ATOM 7950 C CA . ILE C 1 338 ? 105.997 -17.551 -3.431 1.00 47.17 ? 424 ILE C CA 1 ATOM 7951 C C . ILE C 1 338 ? 104.961 -16.503 -3.043 1.00 53.63 ? 424 ILE C C 1 ATOM 7952 O O . ILE C 1 338 ? 103.866 -16.858 -2.604 1.00 58.64 ? 424 ILE C O 1 ATOM 7953 C CB . ILE C 1 338 ? 105.300 -18.469 -4.442 1.00 60.23 ? 424 ILE C CB 1 ATOM 7954 C CG1 . ILE C 1 338 ? 106.166 -19.690 -4.781 1.00 65.02 ? 424 ILE C CG1 1 ATOM 7955 C CG2 . ILE C 1 338 ? 104.895 -17.682 -5.695 1.00 51.41 ? 424 ILE C CG2 1 ATOM 7956 C CD1 . ILE C 1 338 ? 105.509 -20.621 -5.809 1.00 58.48 ? 424 ILE C CD1 1 ATOM 7957 N N . GLU C 1 339 ? 105.285 -15.221 -3.222 1.00 59.96 ? 425 GLU C N 1 ATOM 7958 C CA . GLU C 1 339 ? 104.283 -14.152 -3.067 1.00 51.67 ? 425 GLU C CA 1 ATOM 7959 C C . GLU C 1 339 ? 103.317 -14.071 -4.281 1.00 53.19 ? 425 GLU C C 1 ATOM 7960 O O . GLU C 1 339 ? 103.723 -14.112 -5.447 1.00 57.55 ? 425 GLU C O 1 ATOM 7961 C CB . GLU C 1 339 ? 104.944 -12.803 -2.762 1.00 50.70 ? 425 GLU C CB 1 ATOM 7962 C CG . GLU C 1 339 ? 103.996 -11.739 -2.187 1.00 57.64 ? 425 GLU C CG 1 ATOM 7963 C CD . GLU C 1 339 ? 104.732 -10.496 -1.660 1.00 71.17 ? 425 GLU C CD 1 ATOM 7964 O OE1 . GLU C 1 339 ? 105.693 -10.008 -2.319 1.00 62.21 ? 425 GLU C OE1 1 ATOM 7965 O OE2 . GLU C 1 339 ? 104.343 -10.005 -0.575 1.00 67.84 ? 425 GLU C OE2 1 ATOM 7966 N N . ILE C 1 340 ? 102.034 -13.956 -3.956 1.00 45.97 ? 426 ILE C N 1 ATOM 7967 C CA . ILE C 1 340 ? 100.894 -14.065 -4.865 1.00 38.90 ? 426 ILE C CA 1 ATOM 7968 C C . ILE C 1 340 ? 100.115 -12.740 -4.874 1.00 52.53 ? 426 ILE C C 1 ATOM 7969 O O . ILE C 1 340 ? 99.856 -12.164 -3.817 1.00 57.24 ? 426 ILE C O 1 ATOM 7970 C CB . ILE C 1 340 ? 99.948 -15.182 -4.305 1.00 43.96 ? 426 ILE C CB 1 ATOM 7971 C CG1 . ILE C 1 340 ? 100.604 -16.544 -4.445 1.00 45.47 ? 426 ILE C CG1 1 ATOM 7972 C CG2 . ILE C 1 340 ? 98.578 -15.171 -4.924 1.00 56.38 ? 426 ILE C CG2 1 ATOM 7973 C CD1 . ILE C 1 340 ? 101.399 -16.665 -5.703 1.00 63.73 ? 426 ILE C CD1 1 ATOM 7974 N N . ALA C 1 341 ? 99.735 -12.237 -6.041 1.00 61.55 ? 427 ALA C N 1 ATOM 7975 C CA . ALA C 1 341 ? 98.802 -11.109 -6.063 1.00 57.26 ? 427 ALA C CA 1 ATOM 7976 C C . ALA C 1 341 ? 97.413 -11.652 -5.745 1.00 60.72 ? 427 ALA C C 1 ATOM 7977 O O . ALA C 1 341 ? 96.980 -12.630 -6.354 1.00 76.58 ? 427 ALA C O 1 ATOM 7978 C CB . ALA C 1 341 ? 98.811 -10.436 -7.403 1.00 45.16 ? 427 ALA C CB 1 ATOM 7979 N N . ALA C 1 342 ? 96.726 -11.038 -4.782 1.00 55.93 ? 428 ALA C N 1 ATOM 7980 C CA . ALA C 1 342 ? 95.386 -11.482 -4.379 1.00 45.66 ? 428 ALA C CA 1 ATOM 7981 C C . ALA C 1 342 ? 94.430 -10.314 -4.094 1.00 51.04 ? 428 ALA C C 1 ATOM 7982 O O . ALA C 1 342 ? 94.790 -9.140 -4.229 1.00 59.84 ? 428 ALA C O 1 ATOM 7983 C CB . ALA C 1 342 ? 95.476 -12.402 -3.168 1.00 51.92 ? 428 ALA C CB 1 ATOM 7984 N N . THR C 1 343 ? 93.210 -10.638 -3.682 1.00 53.32 ? 429 THR C N 1 ATOM 7985 C CA . THR C 1 343 ? 92.176 -9.621 -3.499 1.00 55.91 ? 429 THR C CA 1 ATOM 7986 C C . THR C 1 343 ? 91.406 -9.881 -2.214 1.00 54.92 ? 429 THR C C 1 ATOM 7987 O O . THR C 1 343 ? 91.141 -11.033 -1.880 1.00 61.44 ? 429 THR C O 1 ATOM 7988 C CB . THR C 1 343 ? 91.190 -9.648 -4.685 1.00 54.78 ? 429 THR C CB 1 ATOM 7989 O OG1 . THR C 1 343 ? 91.932 -9.688 -5.911 1.00 72.64 ? 429 THR C OG1 1 ATOM 7990 C CG2 . THR C 1 343 ? 90.299 -8.429 -4.686 1.00 52.14 ? 429 THR C CG2 1 ATOM 7991 N N . THR C 1 344 ? 91.041 -8.822 -1.494 1.00 60.14 ? 430 THR C N 1 ATOM 7992 C CA . THR C 1 344 ? 90.271 -8.990 -0.254 1.00 63.96 ? 430 THR C CA 1 ATOM 7993 C C . THR C 1 344 ? 88.803 -9.131 -0.581 1.00 63.41 ? 430 THR C C 1 ATOM 7994 O O . THR C 1 344 ? 88.396 -8.885 -1.713 1.00 74.43 ? 430 THR C O 1 ATOM 7995 C CB . THR C 1 344 ? 90.470 -7.840 0.757 1.00 61.62 ? 430 THR C CB 1 ATOM 7996 O OG1 . THR C 1 344 ? 89.907 -6.622 0.243 1.00 68.58 ? 430 THR C OG1 1 ATOM 7997 C CG2 . THR C 1 344 ? 91.956 -7.659 1.070 1.00 53.13 ? 430 THR C CG2 1 ATOM 7998 N N . LYS C 1 345 ? 88.009 -9.539 0.402 1.00 64.16 ? 431 LYS C N 1 ATOM 7999 C CA . LYS C 1 345 ? 86.587 -9.747 0.166 1.00 70.35 ? 431 LYS C CA 1 ATOM 8000 C C . LYS C 1 345 ? 85.922 -8.438 -0.273 1.00 63.45 ? 431 LYS C C 1 ATOM 8001 O O . LYS C 1 345 ? 85.020 -8.431 -1.122 1.00 69.09 ? 431 LYS C O 1 ATOM 8002 C CB . LYS C 1 345 ? 85.901 -10.329 1.405 1.00 70.97 ? 431 LYS C CB 1 ATOM 8003 C CG . LYS C 1 345 ? 84.539 -10.907 1.105 1.00 77.48 ? 431 LYS C CG 1 ATOM 8004 C CD . LYS C 1 345 ? 83.651 -10.930 2.334 1.00 84.16 ? 431 LYS C CD 1 ATOM 8005 C CE . LYS C 1 345 ? 82.238 -10.504 1.967 1.00 90.51 ? 431 LYS C CE 1 ATOM 8006 N NZ . LYS C 1 345 ? 81.218 -11.005 2.926 1.00 90.13 ? 431 LYS C NZ 1 ATOM 8007 N N . ALA C 1 346 ? 86.411 -7.337 0.289 1.00 52.99 ? 432 ALA C N 1 ATOM 8008 C CA . ALA C 1 346 ? 85.945 -5.994 -0.044 1.00 58.73 ? 432 ALA C CA 1 ATOM 8009 C C . ALA C 1 346 ? 86.324 -5.572 -1.456 1.00 75.16 ? 432 ALA C C 1 ATOM 8010 O O . ALA C 1 346 ? 85.678 -4.704 -2.046 1.00 90.05 ? 432 ALA C O 1 ATOM 8011 C CB . ALA C 1 346 ? 86.503 -4.999 0.944 1.00 51.20 ? 432 ALA C CB 1 ATOM 8012 N N . GLY C 1 347 ? 87.388 -6.166 -1.987 1.00 80.15 ? 433 GLY C N 1 ATOM 8013 C CA . GLY C 1 347 ? 87.853 -5.832 -3.319 1.00 74.71 ? 433 GLY C CA 1 ATOM 8014 C C . GLY C 1 347 ? 89.225 -5.183 -3.359 1.00 64.76 ? 433 GLY C C 1 ATOM 8015 O O . GLY C 1 347 ? 89.777 -4.988 -4.441 1.00 61.51 ? 433 GLY C O 1 ATOM 8016 N N . LEU C 1 348 ? 89.785 -4.847 -2.198 1.00 65.36 ? 438 LEU C N 1 ATOM 8017 C CA . LEU C 1 348 ? 91.156 -4.323 -2.166 1.00 71.74 ? 438 LEU C CA 1 ATOM 8018 C C . LEU C 1 348 ? 92.142 -5.369 -2.681 1.00 70.24 ? 438 LEU C C 1 ATOM 8019 O O . LEU C 1 348 ? 91.997 -6.568 -2.396 1.00 61.72 ? 438 LEU C O 1 ATOM 8020 C CB . LEU C 1 348 ? 91.562 -3.896 -0.761 1.00 72.99 ? 438 LEU C CB 1 ATOM 8021 C CG . LEU C 1 348 ? 91.343 -2.417 -0.454 1.00 79.57 ? 438 LEU C CG 1 ATOM 8022 C CD1 . LEU C 1 348 ? 89.871 -2.113 -0.238 1.00 92.09 ? 438 LEU C CD1 1 ATOM 8023 C CD2 . LEU C 1 348 ? 92.135 -2.002 0.763 1.00 75.19 ? 438 LEU C CD2 1 ATOM 8024 N N . SER C 1 349 ? 93.126 -4.935 -3.464 1.00 67.63 ? 439 SER C N 1 ATOM 8025 C CA . SER C 1 349 ? 94.164 -5.866 -3.891 1.00 70.47 ? 439 SER C CA 1 ATOM 8026 C C . SER C 1 349 ? 95.206 -5.972 -2.779 1.00 54.79 ? 439 SER C C 1 ATOM 8027 O O . SER C 1 349 ? 95.413 -5.022 -2.014 1.00 55.54 ? 439 SER C O 1 ATOM 8028 C CB . SER C 1 349 ? 94.793 -5.458 -5.238 1.00 65.29 ? 439 SER C CB 1 ATOM 8029 O OG . SER C 1 349 ? 95.765 -4.449 -5.065 1.00 66.80 ? 439 SER C OG 1 ATOM 8030 N N . SER C 1 350 ? 95.841 -7.136 -2.684 1.00 48.02 ? 440 SER C N 1 ATOM 8031 C CA . SER C 1 350 ? 96.833 -7.408 -1.638 1.00 53.06 ? 440 SER C CA 1 ATOM 8032 C C . SER C 1 350 ? 97.664 -8.644 -2.001 1.00 49.99 ? 440 SER C C 1 ATOM 8033 O O . SER C 1 350 ? 97.510 -9.221 -3.071 1.00 55.70 ? 440 SER C O 1 ATOM 8034 C CB . SER C 1 350 ? 96.141 -7.616 -0.281 1.00 61.25 ? 440 SER C CB 1 ATOM 8035 O OG . SER C 1 350 ? 97.077 -7.778 0.778 1.00 70.44 ? 440 SER C OG 1 ATOM 8036 N N . ASN C 1 351 ? 98.548 -9.049 -1.106 1.00 51.42 ? 441 ASN C N 1 ATOM 8037 C CA . ASN C 1 351 ? 99.312 -10.266 -1.308 1.00 51.13 ? 441 ASN C CA 1 ATOM 8038 C C . ASN C 1 351 ? 99.012 -11.324 -0.261 1.00 59.30 ? 441 ASN C C 1 ATOM 8039 O O . ASN C 1 351 ? 98.650 -10.989 0.877 1.00 70.33 ? 441 ASN C O 1 ATOM 8040 C CB . ASN C 1 351 ? 100.802 -9.945 -1.197 1.00 53.56 ? 441 ASN C CB 1 ATOM 8041 C CG . ASN C 1 351 ? 101.208 -8.756 -2.044 1.00 60.17 ? 441 ASN C CG 1 ATOM 8042 O OD1 . ASN C 1 351 ? 101.690 -8.923 -3.161 1.00 64.20 ? 441 ASN C OD1 1 ATOM 8043 N ND2 . ASN C 1 351 ? 101.010 -7.551 -1.520 1.00 62.65 ? 441 ASN C ND2 1 ATOM 8044 N N . ASP C 1 352 ? 99.163 -12.594 -0.641 1.00 55.61 ? 442 ASP C N 1 ATOM 8045 C CA . ASP C 1 352 ? 99.740 -13.550 0.317 1.00 70.89 ? 442 ASP C CA 1 ATOM 8046 C C . ASP C 1 352 ? 100.679 -14.593 -0.244 1.00 57.78 ? 442 ASP C C 1 ATOM 8047 O O . ASP C 1 352 ? 101.398 -14.351 -1.211 1.00 51.04 ? 442 ASP C O 1 ATOM 8048 C CB . ASP C 1 352 ? 98.724 -14.195 1.260 1.00 87.17 ? 442 ASP C CB 1 ATOM 8049 C CG . ASP C 1 352 ? 97.608 -14.838 0.535 1.00 84.07 ? 442 ASP C CG 1 ATOM 8050 O OD1 . ASP C 1 352 ? 97.632 -14.799 -0.709 1.00 96.44 ? 442 ASP C OD1 1 ATOM 8051 O OD2 . ASP C 1 352 ? 96.713 -15.383 1.205 1.00 59.43 ? 442 ASP C OD2 1 ATOM 8052 N N . LEU C 1 353 ? 100.645 -15.761 0.382 1.00 64.63 ? 443 LEU C N 1 ATOM 8053 C CA . LEU C 1 353 ? 101.798 -16.632 0.412 1.00 52.46 ? 443 LEU C CA 1 ATOM 8054 C C . LEU C 1 353 ? 101.436 -18.083 0.197 1.00 56.49 ? 443 LEU C C 1 ATOM 8055 O O . LEU C 1 353 ? 100.450 -18.580 0.774 1.00 60.52 ? 443 LEU C O 1 ATOM 8056 C CB . LEU C 1 353 ? 102.434 -16.494 1.786 1.00 55.70 ? 443 LEU C CB 1 ATOM 8057 C CG . LEU C 1 353 ? 103.853 -15.983 1.903 1.00 66.74 ? 443 LEU C CG 1 ATOM 8058 C CD1 . LEU C 1 353 ? 104.539 -16.790 2.983 1.00 57.21 ? 443 LEU C CD1 1 ATOM 8059 C CD2 . LEU C 1 353 ? 104.556 -16.132 0.584 1.00 65.64 ? 443 LEU C CD2 1 ATOM 8060 N N . ILE C 1 354 ? 102.234 -18.752 -0.637 1.00 53.77 ? 444 ILE C N 1 ATOM 8061 C CA . ILE C 1 354 ? 102.246 -20.208 -0.713 1.00 52.67 ? 444 ILE C CA 1 ATOM 8062 C C . ILE C 1 354 ? 103.677 -20.597 -0.404 1.00 57.46 ? 444 ILE C C 1 ATOM 8063 O O . ILE C 1 354 ? 104.618 -19.874 -0.787 1.00 47.84 ? 444 ILE C O 1 ATOM 8064 C CB . ILE C 1 354 ? 101.945 -20.706 -2.115 1.00 59.80 ? 444 ILE C CB 1 ATOM 8065 C CG1 . ILE C 1 354 ? 100.847 -19.868 -2.728 1.00 73.09 ? 444 ILE C CG1 1 ATOM 8066 C CG2 . ILE C 1 354 ? 101.520 -22.190 -2.108 1.00 51.53 ? 444 ILE C CG2 1 ATOM 8067 C CD1 . ILE C 1 354 ? 100.046 -20.664 -3.653 1.00 91.35 ? 444 ILE C CD1 1 ATOM 8068 N N . THR C 1 355 ? 103.847 -21.721 0.290 1.00 49.88 ? 445 THR C N 1 ATOM 8069 C CA . THR C 1 355 ? 105.182 -22.224 0.587 1.00 46.66 ? 445 THR C CA 1 ATOM 8070 C C . THR C 1 355 ? 105.295 -23.678 0.137 1.00 53.84 ? 445 THR C C 1 ATOM 8071 O O . THR C 1 355 ? 104.295 -24.395 0.061 1.00 56.27 ? 445 THR C O 1 ATOM 8072 C CB . THR C 1 355 ? 105.540 -22.067 2.082 1.00 46.60 ? 445 THR C CB 1 ATOM 8073 O OG1 . THR C 1 355 ? 104.531 -22.687 2.877 1.00 54.60 ? 445 THR C OG1 1 ATOM 8074 C CG2 . THR C 1 355 ? 105.628 -20.601 2.473 1.00 52.33 ? 445 THR C CG2 1 ATOM 8075 N N . PHE C 1 356 ? 106.513 -24.107 -0.165 1.00 49.97 ? 446 PHE C N 1 ATOM 8076 C CA . PHE C 1 356 ? 106.740 -25.451 -0.668 1.00 44.15 ? 446 PHE C CA 1 ATOM 8077 C C . PHE C 1 356 ? 107.998 -25.941 -0.006 1.00 47.06 ? 446 PHE C C 1 ATOM 8078 O O . PHE C 1 356 ? 108.934 -25.164 0.171 1.00 54.26 ? 446 PHE C O 1 ATOM 8079 C CB . PHE C 1 356 ? 106.977 -25.424 -2.188 1.00 46.85 ? 446 PHE C CB 1 ATOM 8080 C CG . PHE C 1 356 ? 105.726 -25.286 -3.003 1.00 44.66 ? 446 PHE C CG 1 ATOM 8081 C CD1 . PHE C 1 356 ? 105.239 -24.024 -3.363 1.00 43.90 ? 446 PHE C CD1 1 ATOM 8082 C CD2 . PHE C 1 356 ? 105.037 -26.422 -3.437 1.00 46.25 ? 446 PHE C CD2 1 ATOM 8083 C CE1 . PHE C 1 356 ? 104.062 -23.902 -4.129 1.00 46.40 ? 446 PHE C CE1 1 ATOM 8084 C CE2 . PHE C 1 356 ? 103.872 -26.306 -4.198 1.00 55.41 ? 446 PHE C CE2 1 ATOM 8085 C CZ . PHE C 1 356 ? 103.378 -25.049 -4.548 1.00 48.58 ? 446 PHE C CZ 1 ATOM 8086 N N . CYS C 1 357 ? 108.033 -27.222 0.348 1.00 58.70 ? 447 CYS C N 1 ATOM 8087 C CA . CYS C 1 357 ? 109.258 -27.849 0.850 1.00 52.33 ? 447 CYS C CA 1 ATOM 8088 C C . CYS C 1 357 ? 109.538 -29.065 0.006 1.00 49.27 ? 447 CYS C C 1 ATOM 8089 O O . CYS C 1 357 ? 108.623 -29.622 -0.614 1.00 69.88 ? 447 CYS C O 1 ATOM 8090 C CB . CYS C 1 357 ? 109.112 -28.231 2.324 1.00 51.12 ? 447 CYS C CB 1 ATOM 8091 S SG . CYS C 1 357 ? 108.965 -26.787 3.411 1.00 79.47 ? 447 CYS C SG 1 ATOM 8092 N N . GLY C 1 358 ? 110.798 -29.475 -0.042 1.00 44.80 ? 448 GLY C N 1 ATOM 8093 C CA . GLY C 1 358 ? 111.175 -30.570 -0.917 1.00 55.35 ? 448 GLY C CA 1 ATOM 8094 C C . GLY C 1 358 ? 110.839 -31.963 -0.399 1.00 73.44 ? 448 GLY C C 1 ATOM 8095 O O . GLY C 1 358 ? 110.906 -32.225 0.804 1.00 85.48 ? 448 GLY C O 1 ATOM 8096 N N . THR C 1 359 ? 110.476 -32.845 -1.326 1.00 74.83 ? 449 THR C N 1 ATOM 8097 C CA . THR C 1 359 ? 110.311 -34.270 -1.074 1.00 68.86 ? 449 THR C CA 1 ATOM 8098 C C . THR C 1 359 ? 111.412 -35.012 -1.807 1.00 70.61 ? 449 THR C C 1 ATOM 8099 O O . THR C 1 359 ? 111.809 -34.615 -2.907 1.00 72.91 ? 449 THR C O 1 ATOM 8100 C CB . THR C 1 359 ? 109.003 -34.780 -1.681 1.00 83.16 ? 449 THR C CB 1 ATOM 8101 O OG1 . THR C 1 359 ? 107.914 -34.024 -1.157 1.00 93.01 ? 449 THR C OG1 1 ATOM 8102 C CG2 . THR C 1 359 ? 108.785 -36.275 -1.372 1.00 90.01 ? 449 THR C CG2 1 ATOM 8103 N N . GLY C 1 360 ? 111.886 -36.106 -1.223 1.00 72.06 ? 450 GLY C N 1 ATOM 8104 C CA . GLY C 1 360 ? 112.861 -36.949 -1.890 1.00 71.32 ? 450 GLY C CA 1 ATOM 8105 C C . GLY C 1 360 ? 112.322 -37.707 -3.096 1.00 65.65 ? 450 GLY C C 1 ATOM 8106 O O . GLY C 1 360 ? 113.096 -38.168 -3.938 1.00 74.09 ? 450 GLY C O 1 ATOM 8107 N N . GLY C 1 361 ? 111.000 -37.849 -3.181 1.00 57.48 ? 451 GLY C N 1 ATOM 8108 C CA . GLY C 1 361 ? 110.393 -38.601 -4.269 1.00 55.18 ? 451 GLY C CA 1 ATOM 8109 C C . GLY C 1 361 ? 109.744 -37.737 -5.342 1.00 71.61 ? 451 GLY C C 1 ATOM 8110 O O . GLY C 1 361 ? 109.246 -36.643 -5.057 1.00 83.07 ? 451 GLY C O 1 ATOM 8111 N N . SER C 1 362 ? 109.737 -38.228 -6.579 1.00 66.56 ? 452 SER C N 1 ATOM 8112 C CA . SER C 1 362 ? 109.126 -37.489 -7.685 1.00 68.25 ? 452 SER C CA 1 ATOM 8113 C C . SER C 1 362 ? 107.610 -37.356 -7.494 1.00 66.92 ? 452 SER C C 1 ATOM 8114 O O . SER C 1 362 ? 106.972 -38.241 -6.930 1.00 77.37 ? 452 SER C O 1 ATOM 8115 C CB . SER C 1 362 ? 109.448 -38.154 -9.029 1.00 64.33 ? 452 SER C CB 1 ATOM 8116 O OG . SER C 1 362 ? 108.639 -39.303 -9.240 1.00 82.08 ? 452 SER C OG 1 ATOM 8117 N N . MET C 1 363 ? 107.040 -36.239 -7.944 1.00 53.72 ? 453 MET C N 1 ATOM 8118 C CA . MET C 1 363 ? 105.601 -36.006 -7.815 1.00 50.09 ? 453 MET C CA 1 ATOM 8119 C C . MET C 1 363 ? 104.878 -36.102 -9.165 1.00 56.51 ? 453 MET C C 1 ATOM 8120 O O . MET C 1 363 ? 105.510 -36.032 -10.228 1.00 55.82 ? 453 MET C O 1 ATOM 8121 C CB . MET C 1 363 ? 105.331 -34.617 -7.209 1.00 53.86 ? 453 MET C CB 1 ATOM 8122 C CG . MET C 1 363 ? 105.906 -34.338 -5.813 1.00 53.02 ? 453 MET C CG 1 ATOM 8123 S SD . MET C 1 363 ? 105.361 -35.478 -4.521 1.00 78.85 ? 453 MET C SD 1 ATOM 8124 C CE . MET C 1 363 ? 103.617 -35.486 -4.833 1.00 72.81 ? 453 MET C CE 1 ATOM 8125 N N . PRO C 1 364 ? 103.542 -36.274 -9.128 1.00 63.53 ? 454 PRO C N 1 ATOM 8126 C CA . PRO C 1 364 ? 102.716 -36.154 -10.342 1.00 62.54 ? 454 PRO C CA 1 ATOM 8127 C C . PRO C 1 364 ? 102.557 -34.690 -10.764 1.00 62.87 ? 454 PRO C C 1 ATOM 8128 O O . PRO C 1 364 ? 102.874 -33.781 -9.984 1.00 59.88 ? 454 PRO C O 1 ATOM 8129 C CB . PRO C 1 364 ? 101.349 -36.691 -9.892 1.00 52.69 ? 454 PRO C CB 1 ATOM 8130 C CG . PRO C 1 364 ? 101.332 -36.430 -8.411 1.00 52.02 ? 454 PRO C CG 1 ATOM 8131 C CD . PRO C 1 364 ? 102.744 -36.693 -7.959 1.00 42.78 ? 454 PRO C CD 1 ATOM 8132 N N . ASP C 1 365 ? 102.083 -34.477 -11.988 1.00 58.83 ? 455 ASP C N 1 ATOM 8133 C CA . ASP C 1 365 ? 101.723 -33.144 -12.454 1.00 64.75 ? 455 ASP C CA 1 ATOM 8134 C C . ASP C 1 365 ? 100.388 -32.750 -11.829 1.00 65.89 ? 455 ASP C C 1 ATOM 8135 O O . ASP C 1 365 ? 99.342 -33.307 -12.198 1.00 63.46 ? 455 ASP C O 1 ATOM 8136 C CB . ASP C 1 365 ? 101.641 -33.094 -13.990 1.00 62.47 ? 455 ASP C CB 1 ATOM 8137 C CG . ASP C 1 365 ? 102.992 -33.290 -14.651 1.00 72.12 ? 455 ASP C CG 1 ATOM 8138 O OD1 . ASP C 1 365 ? 103.984 -32.751 -14.117 1.00 74.20 ? 455 ASP C OD1 1 ATOM 8139 O OD2 . ASP C 1 365 ? 103.072 -33.985 -15.692 1.00 82.10 ? 455 ASP C OD2 1 ATOM 8140 N N . VAL C 1 366 ? 100.444 -31.802 -10.884 1.00 65.48 ? 456 VAL C N 1 ATOM 8141 C CA . VAL C 1 366 ? 99.265 -31.315 -10.140 1.00 62.73 ? 456 VAL C CA 1 ATOM 8142 C C . VAL C 1 366 ? 99.269 -29.789 -9.952 1.00 53.39 ? 456 VAL C C 1 ATOM 8143 O O . VAL C 1 366 ? 100.331 -29.193 -9.788 1.00 56.63 ? 456 VAL C O 1 ATOM 8144 C CB . VAL C 1 366 ? 99.114 -32.032 -8.758 1.00 54.27 ? 456 VAL C CB 1 ATOM 8145 C CG1 . VAL C 1 366 ? 100.438 -32.561 -8.277 1.00 51.72 ? 456 VAL C CG1 1 ATOM 8146 C CG2 . VAL C 1 366 ? 98.531 -31.098 -7.716 1.00 55.65 ? 456 VAL C CG2 1 ATOM 8147 N N . ASN C 1 367 ? 98.098 -29.151 -10.003 1.00 52.58 ? 457 ASN C N 1 ATOM 8148 C CA . ASN C 1 367 ? 98.044 -27.719 -9.748 1.00 55.48 ? 457 ASN C CA 1 ATOM 8149 C C . ASN C 1 367 ? 97.751 -27.392 -8.295 1.00 55.55 ? 457 ASN C C 1 ATOM 8150 O O . ASN C 1 367 ? 96.811 -27.923 -7.705 1.00 60.06 ? 457 ASN C O 1 ATOM 8151 C CB . ASN C 1 367 ? 97.024 -27.016 -10.637 1.00 61.81 ? 457 ASN C CB 1 ATOM 8152 C CG . ASN C 1 367 ? 97.170 -25.510 -10.574 1.00 80.19 ? 457 ASN C CG 1 ATOM 8153 O OD1 . ASN C 1 367 ? 98.219 -24.971 -10.943 1.00 89.43 ? 457 ASN C OD1 1 ATOM 8154 N ND2 . ASN C 1 367 ? 96.139 -24.823 -10.082 1.00 82.77 ? 457 ASN C ND2 1 ATOM 8155 N N . TRP C 1 368 ? 98.544 -26.494 -7.729 1.00 55.74 ? 458 TRP C N 1 ATOM 8156 C CA . TRP C 1 368 ? 98.402 -26.149 -6.322 1.00 48.10 ? 458 TRP C CA 1 ATOM 8157 C C . TRP C 1 368 ? 97.766 -24.778 -6.134 1.00 54.43 ? 458 TRP C C 1 ATOM 8158 O O . TRP C 1 368 ? 97.550 -24.336 -5.001 1.00 60.24 ? 458 TRP C O 1 ATOM 8159 C CB . TRP C 1 368 ? 99.763 -26.177 -5.629 1.00 42.71 ? 458 TRP C CB 1 ATOM 8160 C CG . TRP C 1 368 ? 100.347 -27.531 -5.546 1.00 55.34 ? 458 TRP C CG 1 ATOM 8161 C CD1 . TRP C 1 368 ? 101.483 -27.984 -6.161 1.00 60.46 ? 458 TRP C CD1 1 ATOM 8162 C CD2 . TRP C 1 368 ? 99.821 -28.633 -4.811 1.00 63.92 ? 458 TRP C CD2 1 ATOM 8163 N NE1 . TRP C 1 368 ? 101.701 -29.305 -5.840 1.00 62.22 ? 458 TRP C NE1 1 ATOM 8164 C CE2 . TRP C 1 368 ? 100.693 -29.727 -5.012 1.00 68.93 ? 458 TRP C CE2 1 ATOM 8165 C CE3 . TRP C 1 368 ? 98.697 -28.804 -3.994 1.00 64.57 ? 458 TRP C CE3 1 ATOM 8166 C CZ2 . TRP C 1 368 ? 100.472 -30.976 -4.425 1.00 64.65 ? 458 TRP C CZ2 1 ATOM 8167 C CZ3 . TRP C 1 368 ? 98.483 -30.043 -3.413 1.00 65.69 ? 458 TRP C CZ3 1 ATOM 8168 C CH2 . TRP C 1 368 ? 99.363 -31.114 -3.636 1.00 56.21 ? 458 TRP C CH2 1 ATOM 8169 N N . GLY C 1 369 ? 97.473 -24.100 -7.236 1.00 51.89 ? 459 GLY C N 1 ATOM 8170 C CA . GLY C 1 369 ? 96.962 -22.747 -7.152 1.00 55.21 ? 459 GLY C CA 1 ATOM 8171 C C . GLY C 1 369 ? 97.242 -21.918 -8.385 1.00 64.99 ? 459 GLY C C 1 ATOM 8172 O O . GLY C 1 369 ? 97.324 -22.449 -9.497 1.00 66.18 ? 459 GLY C O 1 ATOM 8173 O OXT . GLY C 1 369 ? 97.373 -20.694 -8.288 1.00 70.67 ? 459 GLY C OXT 1 ATOM 8174 N N . ALA D 1 6 ? 112.869 -17.147 37.174 1.00 115.73 ? 82 ALA D N 1 ATOM 8175 C CA . ALA D 1 6 ? 112.537 -15.739 37.359 1.00 127.18 ? 82 ALA D CA 1 ATOM 8176 C C . ALA D 1 6 ? 113.792 -14.874 37.368 1.00 137.39 ? 82 ALA D C 1 ATOM 8177 O O . ALA D 1 6 ? 114.221 -14.376 36.327 1.00 152.53 ? 82 ALA D O 1 ATOM 8178 C CB . ALA D 1 6 ? 111.748 -15.545 38.644 1.00 100.61 ? 82 ALA D CB 1 ATOM 8179 N N . THR D 1 7 ? 114.376 -14.701 38.549 1.00 119.79 ? 83 THR D N 1 ATOM 8180 C CA . THR D 1 7 ? 115.588 -13.903 38.696 1.00 110.15 ? 83 THR D CA 1 ATOM 8181 C C . THR D 1 7 ? 115.279 -12.409 38.692 1.00 106.73 ? 83 THR D C 1 ATOM 8182 O O . THR D 1 7 ? 114.313 -11.966 38.071 1.00 112.21 ? 83 THR D O 1 ATOM 8183 C CB . THR D 1 7 ? 116.610 -14.214 37.586 1.00 131.80 ? 83 THR D CB 1 ATOM 8184 O OG1 . THR D 1 7 ? 116.291 -13.456 36.412 1.00 136.35 ? 83 THR D OG1 1 ATOM 8185 C CG2 . THR D 1 7 ? 116.591 -15.696 37.247 1.00 130.55 ? 83 THR D CG2 1 ATOM 8186 N N . PRO D 1 8 ? 116.108 -11.640 39.389 1.00 105.97 ? 84 PRO D N 1 ATOM 8187 C CA . PRO D 1 8 ? 115.929 -10.183 39.481 1.00 103.04 ? 84 PRO D CA 1 ATOM 8188 C C . PRO D 1 8 ? 116.414 -9.418 38.252 1.00 103.94 ? 84 PRO D C 1 ATOM 8189 O O . PRO D 1 8 ? 117.410 -9.788 37.628 1.00 104.09 ? 84 PRO D O 1 ATOM 8190 C CB . PRO D 1 8 ? 116.770 -9.794 40.702 1.00 89.23 ? 84 PRO D CB 1 ATOM 8191 C CG . PRO D 1 8 ? 117.098 -11.064 41.411 1.00 88.60 ? 84 PRO D CG 1 ATOM 8192 C CD . PRO D 1 8 ? 117.117 -12.129 40.346 1.00 103.88 ? 84 PRO D CD 1 ATOM 8193 N N . LEU D 1 9 ? 115.726 -8.402 37.909 1.00 102.81 ? 85 LEU D N 1 ATOM 8194 C CA . LEU D 1 9 ? 116.127 -7.520 36.824 1.00 97.16 ? 85 LEU D CA 1 ATOM 8195 C C . LEU D 1 9 ? 117.323 -6.700 37.263 1.00 102.50 ? 85 LEU D C 1 ATOM 8196 O O . LEU D 1 9 ? 117.367 -6.181 38.386 1.00 107.59 ? 85 LEU D O 1 ATOM 8197 C CB . LEU D 1 9 ? 114.971 -6.608 36.415 1.00 96.74 ? 85 LEU D CB 1 ATOM 8198 C CG . LEU D 1 9 ? 115.075 -5.868 35.080 1.00 89.74 ? 85 LEU D CG 1 ATOM 8199 C CD1 . LEU D 1 9 ? 113.694 -5.795 34.448 1.00 87.68 ? 85 LEU D CD1 1 ATOM 8200 C CD2 . LEU D 1 9 ? 115.647 -4.471 35.282 1.00 90.72 ? 85 LEU D CD2 1 ATOM 8201 N N . VAL D 1 10 ? 118.284 -6.585 36.356 1.00 103.05 ? 86 VAL D N 1 ATOM 8202 C CA . VAL D 1 10 ? 119.574 -5.980 36.649 1.00 100.40 ? 86 VAL D CA 1 ATOM 8203 C C . VAL D 1 10 ? 120.082 -5.298 35.368 1.00 95.22 ? 86 VAL D C 1 ATOM 8204 O O . VAL D 1 10 ? 120.021 -5.874 34.282 1.00 85.90 ? 86 VAL D O 1 ATOM 8205 C CB . VAL D 1 10 ? 120.548 -7.066 37.176 1.00 82.23 ? 86 VAL D CB 1 ATOM 8206 C CG1 . VAL D 1 10 ? 120.385 -8.358 36.367 1.00 99.54 ? 86 VAL D CG1 1 ATOM 8207 C CG2 . VAL D 1 10 ? 121.983 -6.585 37.164 1.00 75.97 ? 86 VAL D CG2 1 ATOM 8208 N N . LEU D 1 11 ? 120.556 -4.061 35.495 1.00 102.15 ? 87 LEU D N 1 ATOM 8209 C CA . LEU D 1 11 ? 120.906 -3.250 34.330 1.00 95.13 ? 87 LEU D CA 1 ATOM 8210 C C . LEU D 1 11 ? 122.408 -3.225 34.057 1.00 85.48 ? 87 LEU D C 1 ATOM 8211 O O . LEU D 1 11 ? 123.203 -3.804 34.804 1.00 87.04 ? 87 LEU D O 1 ATOM 8212 C CB . LEU D 1 11 ? 120.380 -1.821 34.509 1.00 91.79 ? 87 LEU D CB 1 ATOM 8213 C CG . LEU D 1 11 ? 118.883 -1.731 34.836 1.00 83.82 ? 87 LEU D CG 1 ATOM 8214 C CD1 . LEU D 1 11 ? 118.465 -0.323 35.257 1.00 72.50 ? 87 LEU D CD1 1 ATOM 8215 C CD2 . LEU D 1 11 ? 118.060 -2.200 33.648 1.00 81.48 ? 87 LEU D CD2 1 ATOM 8216 N N . GLY D 1 12 ? 122.788 -2.555 32.975 1.00 76.24 ? 88 GLY D N 1 ATOM 8217 C CA . GLY D 1 12 ? 124.191 -2.367 32.663 1.00 77.35 ? 88 GLY D CA 1 ATOM 8218 C C . GLY D 1 12 ? 124.774 -1.221 33.466 1.00 91.65 ? 88 GLY D C 1 ATOM 8219 O O . GLY D 1 12 ? 124.097 -0.213 33.717 1.00 90.15 ? 88 GLY D O 1 ATOM 8220 N N . GLU D 1 13 ? 126.032 -1.372 33.875 1.00 101.75 ? 89 GLU D N 1 ATOM 8221 C CA . GLU D 1 13 ? 126.727 -0.315 34.608 1.00 101.80 ? 89 GLU D CA 1 ATOM 8222 C C . GLU D 1 13 ? 127.251 0.765 33.661 1.00 103.37 ? 89 GLU D C 1 ATOM 8223 O O . GLU D 1 13 ? 127.566 1.883 34.080 1.00 112.00 ? 89 GLU D O 1 ATOM 8224 C CB . GLU D 1 13 ? 127.871 -0.898 35.441 1.00 100.85 ? 89 GLU D CB 1 ATOM 8225 C CG . GLU D 1 13 ? 127.405 -1.654 36.660 1.00 98.07 ? 89 GLU D CG 1 ATOM 8226 C CD . GLU D 1 13 ? 126.562 -0.794 37.567 1.00 104.73 ? 89 GLU D CD 1 ATOM 8227 O OE1 . GLU D 1 13 ? 126.951 0.371 37.818 1.00 106.88 ? 89 GLU D OE1 1 ATOM 8228 O OE2 . GLU D 1 13 ? 125.505 -1.281 38.017 1.00 107.44 ? 89 GLU D OE2 1 ATOM 8229 N N . ASN D 1 14 ? 127.327 0.421 32.380 1.00 93.61 ? 90 ASN D N 1 ATOM 8230 C CA . ASN D 1 14 ? 127.843 1.336 31.380 1.00 90.75 ? 90 ASN D CA 1 ATOM 8231 C C . ASN D 1 14 ? 126.859 1.553 30.241 1.00 88.97 ? 90 ASN D C 1 ATOM 8232 O O . ASN D 1 14 ? 126.297 0.600 29.697 1.00 83.81 ? 90 ASN D O 1 ATOM 8233 C CB . ASN D 1 14 ? 129.187 0.829 30.860 1.00 94.49 ? 90 ASN D CB 1 ATOM 8234 C CG . ASN D 1 14 ? 130.191 0.620 31.977 1.00 109.71 ? 90 ASN D CG 1 ATOM 8235 O OD1 . ASN D 1 14 ? 130.822 -0.431 32.072 1.00 117.26 ? 90 ASN D OD1 1 ATOM 8236 N ND2 . ASN D 1 14 ? 130.328 1.622 32.846 1.00 105.70 ? 90 ASN D ND2 1 ATOM 8237 N N . LEU D 1 15 ? 126.639 2.819 29.906 1.00 89.98 ? 91 LEU D N 1 ATOM 8238 C CA . LEU D 1 15 ? 125.758 3.178 28.804 1.00 85.09 ? 91 LEU D CA 1 ATOM 8239 C C . LEU D 1 15 ? 126.437 2.971 27.460 1.00 89.41 ? 91 LEU D C 1 ATOM 8240 O O . LEU D 1 15 ? 127.609 3.307 27.277 1.00 86.69 ? 91 LEU D O 1 ATOM 8241 C CB . LEU D 1 15 ? 125.351 4.649 28.891 1.00 74.06 ? 91 LEU D CB 1 ATOM 8242 C CG . LEU D 1 15 ? 124.379 5.088 29.973 1.00 70.70 ? 91 LEU D CG 1 ATOM 8243 C CD1 . LEU D 1 15 ? 124.224 6.596 29.949 1.00 64.09 ? 91 LEU D CD1 1 ATOM 8244 C CD2 . LEU D 1 15 ? 123.036 4.398 29.796 1.00 72.18 ? 91 LEU D CD2 1 ATOM 8245 N N . CYS D 1 16 ? 125.688 2.423 26.516 1.00 93.05 ? 92 CYS D N 1 ATOM 8246 C CA . CYS D 1 16 ? 126.082 2.441 25.113 1.00 96.18 ? 92 CYS D CA 1 ATOM 8247 C C . CYS D 1 16 ? 126.319 3.886 24.668 1.00 88.75 ? 92 CYS D C 1 ATOM 8248 O O . CYS D 1 16 ? 125.582 4.795 25.062 1.00 89.51 ? 92 CYS D O 1 ATOM 8249 C CB . CYS D 1 16 ? 124.978 1.790 24.258 1.00 85.35 ? 92 CYS D CB 1 ATOM 8250 S SG . CYS D 1 16 ? 125.567 0.450 23.203 1.00 213.47 ? 92 CYS D SG 1 ATOM 8251 N N . SER D 1 17 ? 127.353 4.114 23.868 1.00 83.38 ? 93 SER D N 1 ATOM 8252 C CA . SER D 1 17 ? 127.560 5.463 23.364 1.00 90.16 ? 93 SER D CA 1 ATOM 8253 C C . SER D 1 17 ? 126.413 5.830 22.427 1.00 94.07 ? 93 SER D C 1 ATOM 8254 O O . SER D 1 17 ? 125.839 4.968 21.750 1.00 82.46 ? 93 SER D O 1 ATOM 8255 C CB . SER D 1 17 ? 128.922 5.613 22.690 1.00 90.21 ? 93 SER D CB 1 ATOM 8256 O OG . SER D 1 17 ? 129.953 5.546 23.664 1.00 99.73 ? 93 SER D OG 1 ATOM 8257 N N . ILE D 1 18 ? 126.046 7.106 22.432 1.00 90.29 ? 94 ILE D N 1 ATOM 8258 C CA . ILE D 1 18 ? 124.905 7.563 21.657 1.00 79.65 ? 94 ILE D CA 1 ATOM 8259 C C . ILE D 1 18 ? 125.257 8.801 20.869 1.00 88.76 ? 94 ILE D C 1 ATOM 8260 O O . ILE D 1 18 ? 125.587 9.839 21.443 1.00 98.87 ? 94 ILE D O 1 ATOM 8261 C CB . ILE D 1 18 ? 123.707 7.901 22.551 1.00 80.86 ? 94 ILE D CB 1 ATOM 8262 C CG1 . ILE D 1 18 ? 123.381 6.719 23.473 1.00 76.52 ? 94 ILE D CG1 1 ATOM 8263 C CG2 . ILE D 1 18 ? 122.513 8.283 21.685 1.00 85.17 ? 94 ILE D CG2 1 ATOM 8264 C CD1 . ILE D 1 18 ? 122.313 7.009 24.490 1.00 67.98 ? 94 ILE D CD1 1 ATOM 8265 N N . ASN D 1 19 ? 125.172 8.688 19.549 1.00 95.48 ? 95 ASN D N 1 ATOM 8266 C CA . ASN D 1 19 ? 125.485 9.793 18.660 1.00 96.53 ? 95 ASN D CA 1 ATOM 8267 C C . ASN D 1 19 ? 124.295 10.119 17.768 1.00 94.16 ? 95 ASN D C 1 ATOM 8268 O O . ASN D 1 19 ? 124.346 11.042 16.952 1.00 86.64 ? 95 ASN D O 1 ATOM 8269 C CB . ASN D 1 19 ? 126.717 9.450 17.819 1.00 89.40 ? 95 ASN D CB 1 ATOM 8270 C CG . ASN D 1 19 ? 127.969 9.292 18.667 1.00 85.89 ? 95 ASN D CG 1 ATOM 8271 O OD1 . ASN D 1 19 ? 128.275 10.141 19.508 1.00 75.85 ? 95 ASN D OD1 1 ATOM 8272 N ND2 . ASN D 1 19 ? 128.690 8.198 18.460 1.00 89.43 ? 95 ASN D ND2 1 ATOM 8273 N N . GLY D 1 20 ? 123.221 9.355 17.948 1.00 95.17 ? 96 GLY D N 1 ATOM 8274 C CA . GLY D 1 20 ? 122.074 9.404 17.061 1.00 95.21 ? 96 GLY D CA 1 ATOM 8275 C C . GLY D 1 20 ? 120.884 8.684 17.659 1.00 89.07 ? 96 GLY D C 1 ATOM 8276 O O . GLY D 1 20 ? 121.014 7.971 18.666 1.00 78.62 ? 96 GLY D O 1 ATOM 8277 N N . TRP D 1 21 ? 119.718 8.869 17.045 1.00 80.84 ? 97 TRP D N 1 ATOM 8278 C CA . TRP D 1 21 ? 118.482 8.339 17.612 1.00 74.89 ? 97 TRP D CA 1 ATOM 8279 C C . TRP D 1 21 ? 117.569 7.720 16.568 1.00 73.73 ? 97 TRP D C 1 ATOM 8280 O O . TRP D 1 21 ? 117.387 8.265 15.483 1.00 77.76 ? 97 TRP D O 1 ATOM 8281 C CB . TRP D 1 21 ? 117.731 9.431 18.377 1.00 73.65 ? 97 TRP D CB 1 ATOM 8282 C CG . TRP D 1 21 ? 118.507 9.980 19.530 1.00 78.14 ? 97 TRP D CG 1 ATOM 8283 C CD1 . TRP D 1 21 ? 119.333 11.065 19.512 1.00 84.64 ? 97 TRP D CD1 1 ATOM 8284 C CD2 . TRP D 1 21 ? 118.544 9.469 20.873 1.00 77.92 ? 97 TRP D CD2 1 ATOM 8285 N NE1 . TRP D 1 21 ? 119.880 11.267 20.756 1.00 86.16 ? 97 TRP D NE1 1 ATOM 8286 C CE2 . TRP D 1 21 ? 119.411 10.305 21.613 1.00 82.26 ? 97 TRP D CE2 1 ATOM 8287 C CE3 . TRP D 1 21 ? 117.927 8.394 21.522 1.00 65.33 ? 97 TRP D CE3 1 ATOM 8288 C CZ2 . TRP D 1 21 ? 119.674 10.102 22.973 1.00 67.17 ? 97 TRP D CZ2 1 ATOM 8289 C CZ3 . TRP D 1 21 ? 118.195 8.190 22.873 1.00 66.40 ? 97 TRP D CZ3 1 ATOM 8290 C CH2 . TRP D 1 21 ? 119.060 9.041 23.581 1.00 67.10 ? 97 TRP D CH2 1 ATOM 8291 N N . VAL D 1 22 ? 116.981 6.582 16.927 1.00 74.81 ? 98 VAL D N 1 ATOM 8292 C CA . VAL D 1 22 ? 116.146 5.803 16.019 1.00 69.28 ? 98 VAL D CA 1 ATOM 8293 C C . VAL D 1 22 ? 114.773 5.554 16.636 1.00 72.29 ? 98 VAL D C 1 ATOM 8294 O O . VAL D 1 22 ? 114.671 5.182 17.806 1.00 86.30 ? 98 VAL D O 1 ATOM 8295 C CB . VAL D 1 22 ? 116.811 4.439 15.685 1.00 67.53 ? 98 VAL D CB 1 ATOM 8296 C CG1 . VAL D 1 22 ? 115.933 3.608 14.754 1.00 63.01 ? 98 VAL D CG1 1 ATOM 8297 C CG2 . VAL D 1 22 ? 118.197 4.644 15.079 1.00 69.51 ? 98 VAL D CG2 1 ATOM 8298 N N . PRO D 1 23 ? 113.709 5.761 15.849 1.00 68.22 ? 99 PRO D N 1 ATOM 8299 C CA . PRO D 1 23 ? 112.335 5.465 16.276 1.00 69.83 ? 99 PRO D CA 1 ATOM 8300 C C . PRO D 1 23 ? 112.065 3.959 16.433 1.00 68.49 ? 99 PRO D C 1 ATOM 8301 O O . PRO D 1 23 ? 112.288 3.169 15.507 1.00 59.02 ? 99 PRO D O 1 ATOM 8302 C CB . PRO D 1 23 ? 111.487 6.032 15.129 1.00 71.14 ? 99 PRO D CB 1 ATOM 8303 C CG . PRO D 1 23 ? 112.398 6.001 13.935 1.00 63.10 ? 99 PRO D CG 1 ATOM 8304 C CD . PRO D 1 23 ? 113.754 6.339 14.496 1.00 63.59 ? 99 PRO D CD 1 ATOM 8305 N N . THR D 1 24 ? 111.588 3.563 17.605 1.00 74.62 ? 100 THR D N 1 ATOM 8306 C CA . THR D 1 24 ? 111.213 2.172 17.818 1.00 72.46 ? 100 THR D CA 1 ATOM 8307 C C . THR D 1 24 ? 109.709 1.931 17.663 1.00 61.02 ? 100 THR D C 1 ATOM 8308 O O . THR D 1 24 ? 109.287 0.797 17.439 1.00 56.10 ? 100 THR D O 1 ATOM 8309 C CB . THR D 1 24 ? 111.697 1.642 19.185 1.00 77.73 ? 100 THR D CB 1 ATOM 8310 O OG1 . THR D 1 24 ? 111.634 2.684 20.171 1.00 88.25 ? 100 THR D OG1 1 ATOM 8311 C CG2 . THR D 1 24 ? 113.116 1.153 19.068 1.00 67.66 ? 100 THR D CG2 1 ATOM 8312 N N . TYR D 1 25 ? 108.922 3.003 17.768 1.00 59.55 ? 101 TYR D N 1 ATOM 8313 C CA . TYR D 1 25 ? 107.461 2.937 17.699 1.00 55.74 ? 101 TYR D CA 1 ATOM 8314 C C . TYR D 1 25 ? 106.880 4.309 17.397 1.00 61.18 ? 101 TYR D C 1 ATOM 8315 O O . TYR D 1 25 ? 107.292 5.305 17.993 1.00 68.47 ? 101 TYR D O 1 ATOM 8316 C CB . TYR D 1 25 ? 106.879 2.445 19.033 1.00 59.14 ? 101 TYR D CB 1 ATOM 8317 C CG . TYR D 1 25 ? 105.377 2.654 19.182 1.00 66.96 ? 101 TYR D CG 1 ATOM 8318 C CD1 . TYR D 1 25 ? 104.470 1.906 18.430 1.00 70.20 ? 101 TYR D CD1 1 ATOM 8319 C CD2 . TYR D 1 25 ? 104.866 3.587 20.081 1.00 64.38 ? 101 TYR D CD2 1 ATOM 8320 C CE1 . TYR D 1 25 ? 103.098 2.086 18.562 1.00 63.01 ? 101 TYR D CE1 1 ATOM 8321 C CE2 . TYR D 1 25 ? 103.491 3.774 20.224 1.00 69.88 ? 101 TYR D CE2 1 ATOM 8322 C CZ . TYR D 1 25 ? 102.613 3.019 19.459 1.00 72.70 ? 101 TYR D CZ 1 ATOM 8323 O OH . TYR D 1 25 ? 101.251 3.193 19.591 1.00 77.29 ? 101 TYR D OH 1 ATOM 8324 N N . ARG D 1 26 ? 105.917 4.351 16.481 1.00 64.19 ? 102 ARG D N 1 ATOM 8325 C CA . ARG D 1 26 ? 105.190 5.577 16.147 1.00 62.28 ? 102 ARG D CA 1 ATOM 8326 C C . ARG D 1 26 ? 103.689 5.302 16.208 1.00 72.81 ? 102 ARG D C 1 ATOM 8327 O O . ARG D 1 26 ? 103.186 4.399 15.538 1.00 86.09 ? 102 ARG D O 1 ATOM 8328 C CB . ARG D 1 26 ? 105.590 6.069 14.754 1.00 66.49 ? 102 ARG D CB 1 ATOM 8329 C CG . ARG D 1 26 ? 107.108 6.133 14.552 1.00 75.02 ? 102 ARG D CG 1 ATOM 8330 C CD . ARG D 1 26 ? 107.530 5.982 13.095 1.00 87.11 ? 102 ARG D CD 1 ATOM 8331 N NE . ARG D 1 26 ? 107.391 7.224 12.333 1.00 105.10 ? 102 ARG D NE 1 ATOM 8332 C CZ . ARG D 1 26 ? 106.595 7.368 11.277 1.00 118.03 ? 102 ARG D CZ 1 ATOM 8333 N NH1 . ARG D 1 26 ? 105.862 6.344 10.850 1.00 125.68 ? 102 ARG D NH1 1 ATOM 8334 N NH2 . ARG D 1 26 ? 106.534 8.533 10.646 1.00 119.33 ? 102 ARG D NH2 1 ATOM 8335 N N . GLY D 1 27 ? 102.973 6.060 17.030 1.00 76.49 ? 103 GLY D N 1 ATOM 8336 C CA . GLY D 1 27 ? 101.551 5.834 17.207 1.00 75.28 ? 103 GLY D CA 1 ATOM 8337 C C . GLY D 1 27 ? 100.756 6.152 15.961 1.00 83.36 ? 103 GLY D C 1 ATOM 8338 O O . GLY D 1 27 ? 101.315 6.628 14.975 1.00 98.50 ? 103 GLY D O 1 ATOM 8339 N N . GLU D 1 28 ? 99.453 5.892 16.006 1.00 88.01 ? 104 GLU D N 1 ATOM 8340 C CA . GLU D 1 28 ? 98.556 6.200 14.893 1.00 95.48 ? 104 GLU D CA 1 ATOM 8341 C C . GLU D 1 28 ? 98.422 7.708 14.711 1.00 102.24 ? 104 GLU D C 1 ATOM 8342 O O . GLU D 1 28 ? 98.237 8.203 13.598 1.00 95.88 ? 104 GLU D O 1 ATOM 8343 C CB . GLU D 1 28 ? 97.172 5.624 15.167 1.00 101.03 ? 104 GLU D CB 1 ATOM 8344 C CG . GLU D 1 28 ? 96.548 4.909 13.990 1.00 119.21 ? 104 GLU D CG 1 ATOM 8345 C CD . GLU D 1 28 ? 96.495 3.405 14.198 1.00 137.01 ? 104 GLU D CD 1 ATOM 8346 O OE1 . GLU D 1 28 ? 97.410 2.855 14.852 1.00 140.29 ? 104 GLU D OE1 1 ATOM 8347 O OE2 . GLU D 1 28 ? 95.532 2.772 13.715 1.00 139.13 ? 104 GLU D OE2 1 ATOM 8348 N N . GLY D 1 29 ? 98.508 8.432 15.822 1.00 106.89 ? 105 GLY D N 1 ATOM 8349 C CA . GLY D 1 29 ? 98.335 9.874 15.818 1.00 112.14 ? 105 GLY D CA 1 ATOM 8350 C C . GLY D 1 29 ? 99.630 10.632 15.644 1.00 113.70 ? 105 GLY D C 1 ATOM 8351 O O . GLY D 1 29 ? 99.638 11.866 15.683 1.00 107.05 ? 105 GLY D O 1 ATOM 8352 N N . THR D 1 30 ? 100.728 9.897 15.485 1.00 119.94 ? 106 THR D N 1 ATOM 8353 C CA . THR D 1 30 ? 101.946 10.465 14.917 1.00 127.95 ? 106 THR D CA 1 ATOM 8354 C C . THR D 1 30 ? 101.647 10.712 13.441 1.00 126.81 ? 106 THR D C 1 ATOM 8355 O O . THR D 1 30 ? 102.046 11.726 12.857 1.00 111.06 ? 106 THR D O 1 ATOM 8356 C CB . THR D 1 30 ? 103.125 9.470 15.001 1.00 127.27 ? 106 THR D CB 1 ATOM 8357 O OG1 . THR D 1 30 ? 103.377 9.126 16.368 1.00 117.72 ? 106 THR D OG1 1 ATOM 8358 C CG2 . THR D 1 30 ? 104.393 10.060 14.375 1.00 126.89 ? 106 THR D CG2 1 ATOM 8359 N N . THR D 1 31 ? 100.903 9.765 12.872 1.00 134.28 ? 107 THR D N 1 ATOM 8360 C CA . THR D 1 31 ? 100.633 9.694 11.447 1.00 132.55 ? 107 THR D CA 1 ATOM 8361 C C . THR D 1 31 ? 99.201 10.147 11.121 1.00 131.57 ? 107 THR D C 1 ATOM 8362 O O . THR D 1 31 ? 98.549 9.589 10.234 1.00 129.52 ? 107 THR D O 1 ATOM 8363 C CB . THR D 1 31 ? 100.868 8.248 10.932 1.00 104.55 ? 107 THR D CB 1 ATOM 8364 O OG1 . THR D 1 31 ? 99.801 7.395 11.368 1.00 104.98 ? 107 THR D OG1 1 ATOM 8365 C CG2 . THR D 1 31 ? 102.189 7.699 11.474 1.00 97.17 ? 107 THR D CG2 1 ATOM 8366 N N . GLY D 1 32 ? 98.706 11.151 11.842 1.00 132.08 ? 108 GLY D N 1 ATOM 8367 C CA . GLY D 1 32 ? 97.420 11.745 11.506 1.00 130.99 ? 108 GLY D CA 1 ATOM 8368 C C . GLY D 1 32 ? 96.316 11.679 12.549 1.00 124.62 ? 108 GLY D C 1 ATOM 8369 O O . GLY D 1 32 ? 96.316 12.451 13.518 1.00 126.77 ? 108 GLY D O 1 ATOM 8370 N N . LYS D 1 33 ? 95.367 10.763 12.358 1.00 107.60 ? 109 LYS D N 1 ATOM 8371 C CA . LYS D 1 33 ? 94.167 10.724 13.207 1.00 101.85 ? 109 LYS D CA 1 ATOM 8372 C C . LYS D 1 33 ? 93.935 9.385 13.929 1.00 96.98 ? 109 LYS D C 1 ATOM 8373 O O . LYS D 1 33 ? 93.885 8.328 13.295 1.00 87.43 ? 109 LYS D O 1 ATOM 8374 C CB . LYS D 1 33 ? 92.924 11.077 12.377 1.00 102.12 ? 109 LYS D CB 1 ATOM 8375 C CG . LYS D 1 33 ? 92.303 12.429 12.702 1.00 98.04 ? 109 LYS D CG 1 ATOM 8376 C CD . LYS D 1 33 ? 92.575 13.459 11.617 1.00 83.68 ? 109 LYS D CD 1 ATOM 8377 C CE . LYS D 1 33 ? 91.801 14.728 11.903 1.00 91.14 ? 109 LYS D CE 1 ATOM 8378 N NZ . LYS D 1 33 ? 92.364 15.903 11.188 1.00 99.24 ? 109 LYS D NZ 1 ATOM 8379 N N . ILE D 1 34 ? 93.778 9.455 15.252 1.00 93.83 ? 110 ILE D N 1 ATOM 8380 C CA . ILE D 1 34 ? 93.491 8.278 16.062 1.00 83.49 ? 110 ILE D CA 1 ATOM 8381 C C . ILE D 1 34 ? 92.089 7.749 15.759 1.00 83.25 ? 110 ILE D C 1 ATOM 8382 O O . ILE D 1 34 ? 91.128 8.507 15.805 1.00 91.53 ? 110 ILE D O 1 ATOM 8383 C CB . ILE D 1 34 ? 93.555 8.578 17.568 1.00 91.00 ? 110 ILE D CB 1 ATOM 8384 C CG1 . ILE D 1 34 ? 94.855 9.262 17.932 1.00 86.45 ? 110 ILE D CG1 1 ATOM 8385 C CG2 . ILE D 1 34 ? 93.432 7.290 18.379 1.00 92.89 ? 110 ILE D CG2 1 ATOM 8386 C CD1 . ILE D 1 34 ? 96.028 8.346 17.824 1.00 92.88 ? 110 ILE D CD1 1 ATOM 8387 N N . PRO D 1 35 ? 91.966 6.436 15.476 1.00 77.73 ? 111 PRO D N 1 ATOM 8388 C CA . PRO D 1 35 ? 90.659 5.793 15.294 1.00 77.09 ? 111 PRO D CA 1 ATOM 8389 C C . PRO D 1 35 ? 89.828 5.885 16.559 1.00 89.23 ? 111 PRO D C 1 ATOM 8390 O O . PRO D 1 35 ? 90.403 5.952 17.652 1.00 97.30 ? 111 PRO D O 1 ATOM 8391 C CB . PRO D 1 35 ? 91.033 4.362 14.983 1.00 75.24 ? 111 PRO D CB 1 ATOM 8392 C CG . PRO D 1 35 ? 92.425 4.426 14.423 1.00 74.02 ? 111 PRO D CG 1 ATOM 8393 C CD . PRO D 1 35 ? 93.072 5.484 15.257 1.00 81.32 ? 111 PRO D CD 1 ATOM 8394 N N . ASP D 1 36 ? 88.505 5.925 16.423 1.00 98.41 ? 112 ASP D N 1 ATOM 8395 C CA . ASP D 1 36 ? 87.646 6.208 17.581 1.00 106.55 ? 112 ASP D CA 1 ATOM 8396 C C . ASP D 1 36 ? 87.465 5.021 18.525 1.00 102.26 ? 112 ASP D C 1 ATOM 8397 O O . ASP D 1 36 ? 86.991 5.201 19.651 1.00 105.53 ? 112 ASP D O 1 ATOM 8398 C CB . ASP D 1 36 ? 86.266 6.706 17.141 1.00 111.96 ? 112 ASP D CB 1 ATOM 8399 C CG . ASP D 1 36 ? 86.344 7.853 16.163 1.00 123.78 ? 112 ASP D CG 1 ATOM 8400 O OD1 . ASP D 1 36 ? 87.012 8.864 16.476 1.00 134.67 ? 112 ASP D OD1 1 ATOM 8401 O OD2 . ASP D 1 36 ? 85.730 7.741 15.085 1.00 121.63 ? 112 ASP D OD2 1 ATOM 8402 N N . GLU D 1 37 ? 87.823 3.819 18.069 1.00 95.15 ? 113 GLU D N 1 ATOM 8403 C CA . GLU D 1 37 ? 87.698 2.624 18.908 1.00 103.25 ? 113 GLU D CA 1 ATOM 8404 C C . GLU D 1 37 ? 88.822 2.511 19.939 1.00 104.69 ? 113 GLU D C 1 ATOM 8405 O O . GLU D 1 37 ? 88.770 1.669 20.836 1.00 104.72 ? 113 GLU D O 1 ATOM 8406 C CB . GLU D 1 37 ? 87.593 1.342 18.070 1.00 110.55 ? 113 GLU D CB 1 ATOM 8407 C CG . GLU D 1 37 ? 88.888 0.857 17.441 1.00 133.04 ? 113 GLU D CG 1 ATOM 8408 C CD . GLU D 1 37 ? 89.228 1.570 16.148 1.00 148.08 ? 113 GLU D CD 1 ATOM 8409 O OE1 . GLU D 1 37 ? 88.478 2.484 15.721 1.00 144.32 ? 113 GLU D OE1 1 ATOM 8410 O OE2 . GLU D 1 37 ? 90.263 1.216 15.533 1.00 154.72 ? 113 GLU D OE2 1 ATOM 8411 N N . GLN D 1 38 ? 89.831 3.368 19.811 1.00 107.48 ? 114 GLN D N 1 ATOM 8412 C CA . GLN D 1 38 ? 90.933 3.393 20.762 1.00 100.52 ? 114 GLN D CA 1 ATOM 8413 C C . GLN D 1 38 ? 90.580 4.218 21.989 1.00 95.25 ? 114 GLN D C 1 ATOM 8414 O O . GLN D 1 38 ? 89.813 5.182 21.905 1.00 98.69 ? 114 GLN D O 1 ATOM 8415 C CB . GLN D 1 38 ? 92.194 3.961 20.116 1.00 96.98 ? 114 GLN D CB 1 ATOM 8416 C CG . GLN D 1 38 ? 92.842 3.039 19.101 1.00 93.95 ? 114 GLN D CG 1 ATOM 8417 C CD . GLN D 1 38 ? 94.294 3.393 18.847 1.00 89.66 ? 114 GLN D CD 1 ATOM 8418 O OE1 . GLN D 1 38 ? 94.929 4.082 19.652 1.00 90.10 ? 114 GLN D OE1 1 ATOM 8419 N NE2 . GLN D 1 38 ? 94.826 2.928 17.724 1.00 85.79 ? 114 GLN D NE2 1 ATOM 8420 N N . MET D 1 39 ? 91.150 3.841 23.129 1.00 80.42 ? 115 MET D N 1 ATOM 8421 C CA . MET D 1 39 ? 90.931 4.588 24.357 1.00 74.19 ? 115 MET D CA 1 ATOM 8422 C C . MET D 1 39 ? 91.546 5.971 24.269 1.00 76.36 ? 115 MET D C 1 ATOM 8423 O O . MET D 1 39 ? 92.430 6.222 23.457 1.00 83.71 ? 115 MET D O 1 ATOM 8424 C CB . MET D 1 39 ? 91.500 3.848 25.573 1.00 76.52 ? 115 MET D CB 1 ATOM 8425 C CG . MET D 1 39 ? 90.552 2.823 26.168 1.00 75.82 ? 115 MET D CG 1 ATOM 8426 S SD . MET D 1 39 ? 90.734 2.631 27.951 1.00 111.93 ? 115 MET D SD 1 ATOM 8427 C CE . MET D 1 39 ? 89.208 3.392 28.531 1.00 113.06 ? 115 MET D CE 1 ATOM 8428 N N . LEU D 1 40 ? 91.065 6.873 25.109 1.00 78.98 ? 116 LEU D N 1 ATOM 8429 C CA . LEU D 1 40 ? 91.661 8.191 25.202 1.00 78.69 ? 116 LEU D CA 1 ATOM 8430 C C . LEU D 1 40 ? 92.738 8.172 26.284 1.00 85.85 ? 116 LEU D C 1 ATOM 8431 O O . LEU D 1 40 ? 92.455 8.325 27.479 1.00 94.53 ? 116 LEU D O 1 ATOM 8432 C CB . LEU D 1 40 ? 90.601 9.251 25.500 1.00 86.85 ? 116 LEU D CB 1 ATOM 8433 C CG . LEU D 1 40 ? 89.963 10.028 24.345 1.00 88.92 ? 116 LEU D CG 1 ATOM 8434 C CD1 . LEU D 1 40 ? 90.185 9.365 22.990 1.00 95.14 ? 116 LEU D CD1 1 ATOM 8435 C CD2 . LEU D 1 40 ? 88.477 10.205 24.623 1.00 85.50 ? 116 LEU D CD2 1 ATOM 8436 N N . THR D 1 41 ? 93.975 7.976 25.847 1.00 80.56 ? 117 THR D N 1 ATOM 8437 C CA . THR D 1 41 ? 95.118 7.956 26.740 1.00 67.50 ? 117 THR D CA 1 ATOM 8438 C C . THR D 1 41 ? 95.535 9.362 27.151 1.00 70.35 ? 117 THR D C 1 ATOM 8439 O O . THR D 1 41 ? 95.441 10.313 26.374 1.00 78.02 ? 117 THR D O 1 ATOM 8440 C CB . THR D 1 41 ? 96.318 7.284 26.063 1.00 70.01 ? 117 THR D CB 1 ATOM 8441 O OG1 . THR D 1 41 ? 97.036 8.245 25.278 1.00 79.28 ? 117 THR D OG1 1 ATOM 8442 C CG2 . THR D 1 41 ? 95.848 6.151 25.164 1.00 64.81 ? 117 THR D CG2 1 ATOM 8443 N N . ARG D 1 42 ? 95.968 9.485 28.396 1.00 70.40 ? 118 ARG D N 1 ATOM 8444 C CA . ARG D 1 42 ? 96.767 10.620 28.825 1.00 75.62 ? 118 ARG D CA 1 ATOM 8445 C C . ARG D 1 42 ? 97.805 10.088 29.820 1.00 74.58 ? 118 ARG D C 1 ATOM 8446 O O . ARG D 1 42 ? 97.803 8.893 30.124 1.00 76.92 ? 118 ARG D O 1 ATOM 8447 C CB . ARG D 1 42 ? 95.909 11.759 29.388 1.00 76.02 ? 118 ARG D CB 1 ATOM 8448 C CG . ARG D 1 42 ? 94.925 11.382 30.474 1.00 73.76 ? 118 ARG D CG 1 ATOM 8449 C CD . ARG D 1 42 ? 94.147 12.616 30.924 1.00 96.92 ? 118 ARG D CD 1 ATOM 8450 N NE . ARG D 1 42 ? 95.028 13.761 31.170 1.00 116.05 ? 118 ARG D NE 1 ATOM 8451 C CZ . ARG D 1 42 ? 95.614 14.024 32.336 1.00 114.79 ? 118 ARG D CZ 1 ATOM 8452 N NH1 . ARG D 1 42 ? 95.415 13.227 33.378 1.00 92.57 ? 118 ARG D NH1 1 ATOM 8453 N NH2 . ARG D 1 42 ? 96.401 15.087 32.459 1.00 114.86 ? 118 ARG D NH2 1 ATOM 8454 N N . GLN D 1 43 ? 98.708 10.948 30.285 1.00 72.14 ? 119 GLN D N 1 ATOM 8455 C CA . GLN D 1 43 ? 99.829 10.532 31.136 1.00 68.56 ? 119 GLN D CA 1 ATOM 8456 C C . GLN D 1 43 ? 100.591 9.302 30.612 1.00 66.93 ? 119 GLN D C 1 ATOM 8457 O O . GLN D 1 43 ? 100.996 8.430 31.384 1.00 69.72 ? 119 GLN D O 1 ATOM 8458 C CB . GLN D 1 43 ? 99.370 10.299 32.578 1.00 75.17 ? 119 GLN D CB 1 ATOM 8459 C CG . GLN D 1 43 ? 100.384 10.728 33.640 1.00 84.52 ? 119 GLN D CG 1 ATOM 8460 C CD . GLN D 1 43 ? 100.972 9.558 34.434 1.00 89.57 ? 119 GLN D CD 1 ATOM 8461 O OE1 . GLN D 1 43 ? 101.053 9.606 35.667 1.00 90.62 ? 119 GLN D OE1 1 ATOM 8462 N NE2 . GLN D 1 43 ? 101.399 8.514 33.728 1.00 78.53 ? 119 GLN D NE2 1 ATOM 8463 N N . ASN D 1 44 ? 100.792 9.243 29.300 1.00 59.44 ? 120 ASN D N 1 ATOM 8464 C CA . ASN D 1 44 ? 101.569 8.172 28.696 1.00 65.37 ? 120 ASN D CA 1 ATOM 8465 C C . ASN D 1 44 ? 103.021 8.110 29.175 1.00 59.18 ? 120 ASN D C 1 ATOM 8466 O O . ASN D 1 44 ? 103.678 9.133 29.352 1.00 65.88 ? 120 ASN D O 1 ATOM 8467 C CB . ASN D 1 44 ? 101.565 8.328 27.171 1.00 80.28 ? 120 ASN D CB 1 ATOM 8468 C CG . ASN D 1 44 ? 100.213 8.060 26.563 1.00 74.66 ? 120 ASN D CG 1 ATOM 8469 O OD1 . ASN D 1 44 ? 99.909 6.928 26.176 1.00 64.52 ? 120 ASN D OD1 1 ATOM 8470 N ND2 . ASN D 1 44 ? 99.385 9.103 26.475 1.00 76.80 ? 120 ASN D ND2 1 ATOM 8471 N N . PHE D 1 45 ? 103.525 6.901 29.365 1.00 65.01 ? 121 PHE D N 1 ATOM 8472 C CA . PHE D 1 45 ? 104.953 6.712 29.574 1.00 70.47 ? 121 PHE D CA 1 ATOM 8473 C C . PHE D 1 45 ? 105.329 5.269 29.246 1.00 65.62 ? 121 PHE D C 1 ATOM 8474 O O . PHE D 1 45 ? 104.455 4.425 29.042 1.00 53.33 ? 121 PHE D O 1 ATOM 8475 C CB . PHE D 1 45 ? 105.367 7.102 31.000 1.00 71.77 ? 121 PHE D CB 1 ATOM 8476 C CG . PHE D 1 45 ? 104.849 6.177 32.066 1.00 68.90 ? 121 PHE D CG 1 ATOM 8477 C CD1 . PHE D 1 45 ? 103.576 6.343 32.594 1.00 66.68 ? 121 PHE D CD1 1 ATOM 8478 C CD2 . PHE D 1 45 ? 105.644 5.146 32.552 1.00 70.55 ? 121 PHE D CD2 1 ATOM 8479 C CE1 . PHE D 1 45 ? 103.093 5.487 33.586 1.00 61.88 ? 121 PHE D CE1 1 ATOM 8480 C CE2 . PHE D 1 45 ? 105.173 4.284 33.544 1.00 67.60 ? 121 PHE D CE2 1 ATOM 8481 C CZ . PHE D 1 45 ? 103.895 4.457 34.065 1.00 62.99 ? 121 PHE D CZ 1 ATOM 8482 N N . VAL D 1 46 ? 106.624 4.988 29.184 1.00 69.62 ? 122 VAL D N 1 ATOM 8483 C CA . VAL D 1 46 ? 107.074 3.647 28.838 1.00 68.85 ? 122 VAL D CA 1 ATOM 8484 C C . VAL D 1 46 ? 107.966 3.080 29.921 1.00 68.48 ? 122 VAL D C 1 ATOM 8485 O O . VAL D 1 46 ? 108.923 3.728 30.344 1.00 79.96 ? 122 VAL D O 1 ATOM 8486 C CB . VAL D 1 46 ? 107.819 3.609 27.471 1.00 102.24 ? 122 VAL D CB 1 ATOM 8487 C CG1 . VAL D 1 46 ? 108.485 2.231 27.239 1.00 47.20 ? 122 VAL D CG1 1 ATOM 8488 C CG2 . VAL D 1 46 ? 106.861 3.977 26.322 1.00 47.58 ? 122 VAL D CG2 1 ATOM 8489 N N . SER D 1 47 ? 107.629 1.879 30.382 1.00 69.46 ? 123 SER D N 1 ATOM 8490 C CA . SER D 1 47 ? 108.489 1.135 31.298 1.00 70.21 ? 123 SER D CA 1 ATOM 8491 C C . SER D 1 47 ? 108.708 -0.270 30.754 1.00 67.71 ? 123 SER D C 1 ATOM 8492 O O . SER D 1 47 ? 107.803 -0.880 30.174 1.00 58.97 ? 123 SER D O 1 ATOM 8493 C CB . SER D 1 47 ? 107.898 1.075 32.710 1.00 66.94 ? 123 SER D CB 1 ATOM 8494 O OG . SER D 1 47 ? 108.845 0.541 33.631 1.00 65.90 ? 123 SER D OG 1 ATOM 8495 N N . CYS D 1 48 ? 109.913 -0.784 30.935 1.00 66.80 ? 124 CYS D N 1 ATOM 8496 C CA . CYS D 1 48 ? 110.227 -2.088 30.386 1.00 67.57 ? 124 CYS D CA 1 ATOM 8497 C C . CYS D 1 48 ? 110.359 -3.155 31.452 1.00 75.22 ? 124 CYS D C 1 ATOM 8498 O O . CYS D 1 48 ? 110.724 -2.870 32.597 1.00 77.43 ? 124 CYS D O 1 ATOM 8499 C CB . CYS D 1 48 ? 111.498 -2.012 29.535 1.00 65.24 ? 124 CYS D CB 1 ATOM 8500 S SG . CYS D 1 48 ? 111.291 -0.875 28.171 1.00 91.38 ? 124 CYS D SG 1 ATOM 8501 N N . SER D 1 49 ? 110.022 -4.384 31.070 1.00 86.49 ? 125 SER D N 1 ATOM 8502 C CA . SER D 1 49 ? 110.265 -5.560 31.900 1.00 83.97 ? 125 SER D CA 1 ATOM 8503 C C . SER D 1 49 ? 111.452 -6.305 31.306 1.00 86.40 ? 125 SER D C 1 ATOM 8504 O O . SER D 1 49 ? 112.259 -5.730 30.588 1.00 88.70 ? 125 SER D O 1 ATOM 8505 C CB . SER D 1 49 ? 109.044 -6.485 31.923 1.00 71.88 ? 125 SER D CB 1 ATOM 8506 O OG . SER D 1 49 ? 108.993 -7.269 30.742 1.00 75.17 ? 125 SER D OG 1 ATOM 8507 N N . ASP D 1 50 ? 111.545 -7.593 31.599 1.00 100.08 ? 126 ASP D N 1 ATOM 8508 C CA . ASP D 1 50 ? 112.681 -8.395 31.176 1.00 103.40 ? 126 ASP D CA 1 ATOM 8509 C C . ASP D 1 50 ? 112.309 -9.223 29.956 1.00 103.00 ? 126 ASP D C 1 ATOM 8510 O O . ASP D 1 50 ? 113.038 -10.142 29.582 1.00 114.90 ? 126 ASP D O 1 ATOM 8511 C CB . ASP D 1 50 ? 113.109 -9.319 32.314 1.00 117.08 ? 126 ASP D CB 1 ATOM 8512 C CG . ASP D 1 50 ? 111.923 -9.971 33.014 1.00 128.47 ? 126 ASP D CG 1 ATOM 8513 O OD1 . ASP D 1 50 ? 110.811 -9.408 32.977 1.00 130.87 ? 126 ASP D OD1 1 ATOM 8514 O OD2 . ASP D 1 50 ? 112.103 -11.050 33.613 1.00 131.94 ? 126 ASP D OD2 1 ATOM 8515 N N . LYS D 1 51 ? 111.181 -8.884 29.334 1.00 91.39 ? 127 LYS D N 1 ATOM 8516 C CA . LYS D 1 51 ? 110.656 -9.657 28.218 1.00 84.70 ? 127 LYS D CA 1 ATOM 8517 C C . LYS D 1 51 ? 109.972 -8.759 27.193 1.00 82.82 ? 127 LYS D C 1 ATOM 8518 O O . LYS D 1 51 ? 109.810 -9.146 26.040 1.00 85.44 ? 127 LYS D O 1 ATOM 8519 C CB . LYS D 1 51 ? 109.681 -10.727 28.721 1.00 87.75 ? 127 LYS D CB 1 ATOM 8520 C CG . LYS D 1 51 ? 108.205 -10.364 28.580 1.00 95.49 ? 127 LYS D CG 1 ATOM 8521 C CD . LYS D 1 51 ? 107.319 -11.456 29.172 1.00 107.78 ? 127 LYS D CD 1 ATOM 8522 C CE . LYS D 1 51 ? 105.856 -11.306 28.761 1.00 105.70 ? 127 LYS D CE 1 ATOM 8523 N NZ . LYS D 1 51 ? 105.026 -12.456 29.230 1.00 103.74 ? 127 LYS D NZ 1 ATOM 8524 N N . GLU D 1 52 ? 109.576 -7.562 27.622 1.00 80.42 ? 128 GLU D N 1 ATOM 8525 C CA . GLU D 1 52 ? 108.868 -6.622 26.762 1.00 68.38 ? 128 GLU D CA 1 ATOM 8526 C C . GLU D 1 52 ? 108.894 -5.216 27.348 1.00 73.42 ? 128 GLU D C 1 ATOM 8527 O O . GLU D 1 52 ? 109.081 -5.042 28.552 1.00 74.61 ? 128 GLU D O 1 ATOM 8528 C CB . GLU D 1 52 ? 107.409 -7.055 26.582 1.00 66.39 ? 128 GLU D CB 1 ATOM 8529 C CG . GLU D 1 52 ? 106.616 -7.108 27.883 1.00 72.82 ? 128 GLU D CG 1 ATOM 8530 C CD . GLU D 1 52 ? 105.165 -7.552 27.692 1.00 84.24 ? 128 GLU D CD 1 ATOM 8531 O OE1 . GLU D 1 52 ? 104.815 -8.081 26.606 1.00 90.18 ? 128 GLU D OE1 1 ATOM 8532 O OE2 . GLU D 1 52 ? 104.373 -7.371 28.641 1.00 72.58 ? 128 GLU D OE2 1 ATOM 8533 N N . CYS D 1 53 ? 108.715 -4.218 26.486 1.00 68.34 ? 129 CYS D N 1 ATOM 8534 C CA . CYS D 1 53 ? 108.463 -2.851 26.930 1.00 59.99 ? 129 CYS D CA 1 ATOM 8535 C C . CYS D 1 53 ? 106.961 -2.615 26.937 1.00 66.78 ? 129 CYS D C 1 ATOM 8536 O O . CYS D 1 53 ? 106.234 -3.200 26.128 1.00 61.30 ? 129 CYS D O 1 ATOM 8537 C CB . CYS D 1 53 ? 109.148 -1.851 26.002 1.00 56.63 ? 129 CYS D CB 1 ATOM 8538 S SG . CYS D 1 53 ? 110.912 -1.696 26.330 1.00 100.37 ? 129 CYS D SG 1 ATOM 8539 N N . ARG D 1 54 ? 106.486 -1.777 27.854 1.00 70.62 ? 130 ARG D N 1 ATOM 8540 C CA . ARG D 1 54 ? 105.051 -1.515 27.933 1.00 67.05 ? 130 ARG D CA 1 ATOM 8541 C C . ARG D 1 54 ? 104.724 -0.037 27.964 1.00 67.54 ? 130 ARG D C 1 ATOM 8542 O O . ARG D 1 54 ? 105.464 0.767 28.533 1.00 67.68 ? 130 ARG D O 1 ATOM 8543 C CB . ARG D 1 54 ? 104.419 -2.181 29.158 1.00 67.61 ? 130 ARG D CB 1 ATOM 8544 C CG . ARG D 1 54 ? 104.348 -3.686 29.109 1.00 63.02 ? 130 ARG D CG 1 ATOM 8545 C CD . ARG D 1 54 ? 103.208 -4.220 29.973 1.00 49.08 ? 130 ARG D CD 1 ATOM 8546 N NE . ARG D 1 54 ? 102.417 -5.148 29.172 1.00 65.48 ? 130 ARG D NE 1 ATOM 8547 C CZ . ARG D 1 54 ? 101.118 -5.023 28.939 1.00 63.86 ? 130 ARG D CZ 1 ATOM 8548 N NH1 . ARG D 1 54 ? 100.446 -4.017 29.466 1.00 58.48 ? 130 ARG D NH1 1 ATOM 8549 N NH2 . ARG D 1 54 ? 100.489 -5.919 28.194 1.00 74.39 ? 130 ARG D NH2 1 ATOM 8550 N N . ARG D 1 55 ? 103.588 0.300 27.363 1.00 63.69 ? 131 ARG D N 1 ATOM 8551 C CA . ARG D 1 55 ? 103.077 1.659 27.357 1.00 63.60 ? 131 ARG D CA 1 ATOM 8552 C C . ARG D 1 55 ? 102.009 1.769 28.429 1.00 64.34 ? 131 ARG D C 1 ATOM 8553 O O . ARG D 1 55 ? 100.963 1.133 28.337 1.00 74.32 ? 131 ARG D O 1 ATOM 8554 C CB . ARG D 1 55 ? 102.491 1.982 25.976 1.00 62.97 ? 131 ARG D CB 1 ATOM 8555 C CG . ARG D 1 55 ? 101.701 3.279 25.887 1.00 64.47 ? 131 ARG D CG 1 ATOM 8556 C CD . ARG D 1 55 ? 101.247 3.554 24.445 1.00 65.24 ? 131 ARG D CD 1 ATOM 8557 N NE . ARG D 1 55 ? 100.369 4.724 24.367 1.00 68.94 ? 131 ARG D NE 1 ATOM 8558 C CZ . ARG D 1 55 ? 99.664 5.074 23.295 1.00 72.92 ? 131 ARG D CZ 1 ATOM 8559 N NH1 . ARG D 1 55 ? 99.718 4.338 22.189 1.00 78.52 ? 131 ARG D NH1 1 ATOM 8560 N NH2 . ARG D 1 55 ? 98.897 6.162 23.336 1.00 64.07 ? 131 ARG D NH2 1 ATOM 8561 N N . PHE D 1 56 ? 102.289 2.549 29.464 1.00 62.35 ? 132 PHE D N 1 ATOM 8562 C CA . PHE D 1 56 ? 101.310 2.788 30.513 1.00 63.15 ? 132 PHE D CA 1 ATOM 8563 C C . PHE D 1 56 ? 100.662 4.149 30.296 1.00 73.05 ? 132 PHE D C 1 ATOM 8564 O O . PHE D 1 56 ? 101.307 5.097 29.819 1.00 63.96 ? 132 PHE D O 1 ATOM 8565 C CB . PHE D 1 56 ? 101.966 2.762 31.892 1.00 56.90 ? 132 PHE D CB 1 ATOM 8566 C CG . PHE D 1 56 ? 102.413 1.406 32.334 1.00 57.33 ? 132 PHE D CG 1 ATOM 8567 C CD1 . PHE D 1 56 ? 103.522 0.800 31.758 1.00 54.24 ? 132 PHE D CD1 1 ATOM 8568 C CD2 . PHE D 1 56 ? 101.743 0.740 33.349 1.00 59.81 ? 132 PHE D CD2 1 ATOM 8569 C CE1 . PHE D 1 56 ? 103.943 -0.454 32.171 1.00 54.98 ? 132 PHE D CE1 1 ATOM 8570 C CE2 . PHE D 1 56 ? 102.165 -0.529 33.775 1.00 63.86 ? 132 PHE D CE2 1 ATOM 8571 C CZ . PHE D 1 56 ? 103.266 -1.126 33.184 1.00 56.63 ? 132 PHE D CZ 1 ATOM 8572 N N . PHE D 1 57 ? 99.388 4.245 30.661 1.00 71.58 ? 133 PHE D N 1 ATOM 8573 C CA . PHE D 1 57 ? 98.676 5.502 30.567 1.00 76.12 ? 133 PHE D CA 1 ATOM 8574 C C . PHE D 1 57 ? 97.479 5.484 31.502 1.00 70.95 ? 133 PHE D C 1 ATOM 8575 O O . PHE D 1 57 ? 97.145 4.453 32.089 1.00 68.16 ? 133 PHE D O 1 ATOM 8576 C CB . PHE D 1 57 ? 98.211 5.749 29.128 1.00 72.49 ? 133 PHE D CB 1 ATOM 8577 C CG . PHE D 1 57 ? 97.284 4.691 28.608 1.00 71.88 ? 133 PHE D CG 1 ATOM 8578 C CD1 . PHE D 1 57 ? 97.787 3.522 28.047 1.00 76.69 ? 133 PHE D CD1 1 ATOM 8579 C CD2 . PHE D 1 57 ? 95.909 4.856 28.683 1.00 71.14 ? 133 PHE D CD2 1 ATOM 8580 C CE1 . PHE D 1 57 ? 96.936 2.538 27.562 1.00 77.27 ? 133 PHE D CE1 1 ATOM 8581 C CE2 . PHE D 1 57 ? 95.048 3.873 28.202 1.00 77.85 ? 133 PHE D CE2 1 ATOM 8582 C CZ . PHE D 1 57 ? 95.563 2.715 27.640 1.00 79.95 ? 133 PHE D CZ 1 ATOM 8583 N N . VAL D 1 58 ? 96.849 6.649 31.620 1.00 66.14 ? 134 VAL D N 1 ATOM 8584 C CA . VAL D 1 58 ? 95.605 6.845 32.350 1.00 65.26 ? 134 VAL D CA 1 ATOM 8585 C C . VAL D 1 58 ? 94.496 7.133 31.327 1.00 61.03 ? 134 VAL D C 1 ATOM 8586 O O . VAL D 1 58 ? 94.722 7.845 30.352 1.00 74.53 ? 134 VAL D O 1 ATOM 8587 C CB . VAL D 1 58 ? 95.751 8.057 33.311 1.00 73.64 ? 134 VAL D CB 1 ATOM 8588 C CG1 . VAL D 1 58 ? 94.423 8.435 33.935 1.00 78.59 ? 134 VAL D CG1 1 ATOM 8589 C CG2 . VAL D 1 58 ? 96.810 7.772 34.376 1.00 69.98 ? 134 VAL D CG2 1 ATOM 8590 N N . SER D 1 59 ? 93.311 6.569 31.523 1.00 59.41 ? 135 SER D N 1 ATOM 8591 C CA . SER D 1 59 ? 92.174 6.906 30.670 1.00 66.69 ? 135 SER D CA 1 ATOM 8592 C C . SER D 1 59 ? 90.880 6.904 31.446 1.00 81.44 ? 135 SER D C 1 ATOM 8593 O O . SER D 1 59 ? 90.834 6.531 32.624 1.00 88.12 ? 135 SER D O 1 ATOM 8594 C CB . SER D 1 59 ? 92.032 5.942 29.493 1.00 76.62 ? 135 SER D CB 1 ATOM 8595 O OG . SER D 1 59 ? 90.966 6.349 28.644 1.00 93.56 ? 135 SER D OG 1 ATOM 8596 N N . MET D 1 60 ? 89.814 7.290 30.761 1.00 87.49 ? 136 MET D N 1 ATOM 8597 C CA . MET D 1 60 ? 88.530 7.458 31.412 1.00 91.65 ? 136 MET D CA 1 ATOM 8598 C C . MET D 1 60 ? 87.374 6.972 30.533 1.00 101.28 ? 136 MET D C 1 ATOM 8599 O O . MET D 1 60 ? 86.338 6.527 31.048 1.00 109.79 ? 136 MET D O 1 ATOM 8600 C CB . MET D 1 60 ? 88.366 8.933 31.782 1.00 92.76 ? 136 MET D CB 1 ATOM 8601 C CG . MET D 1 60 ? 87.079 9.263 32.473 1.00 92.26 ? 136 MET D CG 1 ATOM 8602 S SD . MET D 1 60 ? 87.185 10.879 33.241 1.00 103.99 ? 136 MET D SD 1 ATOM 8603 C CE . MET D 1 60 ? 85.453 11.179 33.569 1.00 138.68 ? 136 MET D CE 1 ATOM 8604 N N . GLY D 1 61 ? 87.572 7.057 29.216 1.00 103.44 ? 137 GLY D N 1 ATOM 8605 C CA . GLY D 1 61 ? 86.624 6.555 28.237 1.00 112.22 ? 137 GLY D CA 1 ATOM 8606 C C . GLY D 1 61 ? 87.205 6.401 26.836 1.00 120.50 ? 137 GLY D C 1 ATOM 8607 O O . GLY D 1 61 ? 88.388 6.084 26.663 1.00 118.27 ? 137 GLY D O 1 ATOM 8608 N N . TYR D 1 62 ? 86.366 6.638 25.830 1.00 122.87 ? 138 TYR D N 1 ATOM 8609 C CA . TYR D 1 62 ? 86.739 6.372 24.444 1.00 124.99 ? 138 TYR D CA 1 ATOM 8610 C C . TYR D 1 62 ? 86.500 7.569 23.523 1.00 121.82 ? 138 TYR D C 1 ATOM 8611 O O . TYR D 1 62 ? 85.737 7.492 22.557 1.00 115.75 ? 138 TYR D O 1 ATOM 8612 C CB . TYR D 1 62 ? 85.980 5.142 23.934 1.00 136.84 ? 138 TYR D CB 1 ATOM 8613 C CG . TYR D 1 62 ? 86.446 3.821 24.522 1.00 146.36 ? 138 TYR D CG 1 ATOM 8614 C CD1 . TYR D 1 62 ? 85.987 3.376 25.761 1.00 149.01 ? 138 TYR D CD1 1 ATOM 8615 C CD2 . TYR D 1 62 ? 87.335 3.011 23.827 1.00 144.95 ? 138 TYR D CD2 1 ATOM 8616 C CE1 . TYR D 1 62 ? 86.413 2.162 26.291 1.00 146.83 ? 138 TYR D CE1 1 ATOM 8617 C CE2 . TYR D 1 62 ? 87.766 1.802 24.348 1.00 141.89 ? 138 TYR D CE2 1 ATOM 8618 C CZ . TYR D 1 62 ? 87.304 1.379 25.579 1.00 142.73 ? 138 TYR D CZ 1 ATOM 8619 O OH . TYR D 1 62 ? 87.731 0.174 26.093 1.00 134.99 ? 138 TYR D OH 1 ATOM 8620 N N . VAL D 1 73 ? 91.241 15.405 37.471 1.00 105.95 ? 149 VAL D N 1 ATOM 8621 C CA . VAL D 1 73 ? 91.043 14.392 38.514 1.00 115.64 ? 149 VAL D CA 1 ATOM 8622 C C . VAL D 1 73 ? 89.603 13.846 38.557 1.00 114.84 ? 149 VAL D C 1 ATOM 8623 O O . VAL D 1 73 ? 88.636 14.608 38.672 1.00 117.73 ? 149 VAL D O 1 ATOM 8624 C CB . VAL D 1 73 ? 91.501 14.899 39.918 1.00 105.42 ? 149 VAL D CB 1 ATOM 8625 C CG1 . VAL D 1 73 ? 93.021 14.986 39.972 1.00 89.85 ? 149 VAL D CG1 1 ATOM 8626 C CG2 . VAL D 1 73 ? 90.864 16.259 40.255 1.00 107.77 ? 149 VAL D CG2 1 ATOM 8627 N N . SER D 1 74 ? 89.472 12.524 38.454 1.00 109.39 ? 150 SER D N 1 ATOM 8628 C CA . SER D 1 74 ? 88.163 11.876 38.445 1.00 103.28 ? 150 SER D CA 1 ATOM 8629 C C . SER D 1 74 ? 88.199 10.512 39.136 1.00 98.40 ? 150 SER D C 1 ATOM 8630 O O . SER D 1 74 ? 89.247 9.851 39.179 1.00 101.62 ? 150 SER D O 1 ATOM 8631 C CB . SER D 1 74 ? 87.656 11.728 37.004 1.00 98.63 ? 150 SER D CB 1 ATOM 8632 O OG . SER D 1 74 ? 86.509 10.900 36.953 1.00 95.72 ? 150 SER D OG 1 ATOM 8633 N N . GLU D 1 75 ? 87.055 10.094 39.678 1.00 87.10 ? 151 GLU D N 1 ATOM 8634 C CA . GLU D 1 75 ? 86.939 8.762 40.254 1.00 81.81 ? 151 GLU D CA 1 ATOM 8635 C C . GLU D 1 75 ? 86.977 7.776 39.110 1.00 84.25 ? 151 GLU D C 1 ATOM 8636 O O . GLU D 1 75 ? 87.384 6.632 39.276 1.00 100.18 ? 151 GLU D O 1 ATOM 8637 C CB . GLU D 1 75 ? 85.622 8.599 41.019 1.00 86.18 ? 151 GLU D CB 1 ATOM 8638 C CG . GLU D 1 75 ? 85.133 9.861 41.728 1.00 98.70 ? 151 GLU D CG 1 ATOM 8639 C CD . GLU D 1 75 ? 84.117 9.584 42.845 1.00 101.35 ? 151 GLU D CD 1 ATOM 8640 O OE1 . GLU D 1 75 ? 83.036 9.019 42.555 1.00 84.91 ? 151 GLU D OE1 1 ATOM 8641 O OE2 . GLU D 1 75 ? 84.400 9.914 44.017 1.00 111.93 ? 151 GLU D OE2 1 ATOM 8642 N N . GLN D 1 76 ? 86.560 8.241 37.937 1.00 74.49 ? 152 GLN D N 1 ATOM 8643 C CA . GLN D 1 76 ? 86.419 7.373 36.782 1.00 81.54 ? 152 GLN D CA 1 ATOM 8644 C C . GLN D 1 76 ? 87.756 6.972 36.153 1.00 75.42 ? 152 GLN D C 1 ATOM 8645 O O . GLN D 1 76 ? 87.810 6.031 35.364 1.00 68.65 ? 152 GLN D O 1 ATOM 8646 C CB . GLN D 1 76 ? 85.500 8.023 35.748 1.00 93.76 ? 152 GLN D CB 1 ATOM 8647 C CG . GLN D 1 76 ? 84.146 8.440 36.313 1.00 98.95 ? 152 GLN D CG 1 ATOM 8648 C CD . GLN D 1 76 ? 83.123 8.701 35.223 1.00 96.34 ? 152 GLN D CD 1 ATOM 8649 O OE1 . GLN D 1 76 ? 83.274 8.238 34.086 1.00 95.64 ? 152 GLN D OE1 1 ATOM 8650 N NE2 . GLN D 1 76 ? 82.073 9.442 35.565 1.00 88.60 ? 152 GLN D NE2 1 ATOM 8651 N N . MET D 1 77 ? 88.828 7.672 36.516 1.00 73.76 ? 156 MET D N 1 ATOM 8652 C CA . MET D 1 77 ? 90.140 7.429 35.913 1.00 72.04 ? 156 MET D CA 1 ATOM 8653 C C . MET D 1 77 ? 90.741 6.092 36.351 1.00 69.13 ? 156 MET D C 1 ATOM 8654 O O . MET D 1 77 ? 90.725 5.742 37.535 1.00 77.97 ? 156 MET D O 1 ATOM 8655 C CB . MET D 1 77 ? 91.119 8.568 36.248 1.00 84.29 ? 156 MET D CB 1 ATOM 8656 C CG . MET D 1 77 ? 90.848 9.933 35.593 1.00 85.66 ? 156 MET D CG 1 ATOM 8657 S SD . MET D 1 77 ? 91.223 9.999 33.832 1.00 118.59 ? 156 MET D SD 1 ATOM 8658 C CE . MET D 1 77 ? 91.518 11.747 33.597 1.00 112.76 ? 156 MET D CE 1 ATOM 8659 N N . ASN D 1 78 ? 91.272 5.349 35.386 1.00 68.76 ? 157 ASN D N 1 ATOM 8660 C CA . ASN D 1 78 ? 91.972 4.100 35.668 1.00 75.08 ? 157 ASN D CA 1 ATOM 8661 C C . ASN D 1 78 ? 93.370 4.125 35.073 1.00 74.20 ? 157 ASN D C 1 ATOM 8662 O O . ASN D 1 78 ? 93.653 4.924 34.181 1.00 70.76 ? 157 ASN D O 1 ATOM 8663 C CB . ASN D 1 78 ? 91.203 2.902 35.096 1.00 70.89 ? 157 ASN D CB 1 ATOM 8664 C CG . ASN D 1 78 ? 89.874 2.678 35.785 1.00 72.22 ? 157 ASN D CG 1 ATOM 8665 O OD1 . ASN D 1 78 ? 89.779 2.753 37.014 1.00 74.35 ? 157 ASN D OD1 1 ATOM 8666 N ND2 . ASN D 1 78 ? 88.835 2.401 35.000 1.00 63.30 ? 157 ASN D ND2 1 ATOM 8667 N N . VAL D 1 79 ? 94.247 3.256 35.570 1.00 77.27 ? 158 VAL D N 1 ATOM 8668 C CA . VAL D 1 79 ? 95.542 3.041 34.934 1.00 64.98 ? 158 VAL D CA 1 ATOM 8669 C C . VAL D 1 79 ? 95.512 1.775 34.081 1.00 61.28 ? 158 VAL D C 1 ATOM 8670 O O . VAL D 1 79 ? 95.104 0.708 34.549 1.00 70.87 ? 158 VAL D O 1 ATOM 8671 C CB . VAL D 1 79 ? 96.677 2.927 35.959 1.00 62.60 ? 158 VAL D CB 1 ATOM 8672 C CG1 . VAL D 1 79 ? 98.000 3.313 35.307 1.00 50.94 ? 158 VAL D CG1 1 ATOM 8673 C CG2 . VAL D 1 79 ? 96.390 3.827 37.150 1.00 50.50 ? 158 VAL D CG2 1 ATOM 8674 N N . TYR D 1 80 ? 95.931 1.901 32.825 1.00 63.64 ? 159 TYR D N 1 ATOM 8675 C CA . TYR D 1 80 ? 96.039 0.750 31.929 1.00 57.49 ? 159 TYR D CA 1 ATOM 8676 C C . TYR D 1 80 ? 97.444 0.642 31.346 1.00 58.18 ? 159 TYR D C 1 ATOM 8677 O O . TYR D 1 80 ? 98.257 1.560 31.468 1.00 61.59 ? 159 TYR D O 1 ATOM 8678 C CB . TYR D 1 80 ? 95.063 0.889 30.768 1.00 52.53 ? 159 TYR D CB 1 ATOM 8679 C CG . TYR D 1 80 ? 93.620 1.104 31.146 1.00 60.68 ? 159 TYR D CG 1 ATOM 8680 C CD1 . TYR D 1 80 ? 93.118 2.390 31.359 1.00 60.73 ? 159 TYR D CD1 1 ATOM 8681 C CD2 . TYR D 1 80 ? 92.743 0.025 31.253 1.00 51.64 ? 159 TYR D CD2 1 ATOM 8682 C CE1 . TYR D 1 80 ? 91.776 2.591 31.689 1.00 65.01 ? 159 TYR D CE1 1 ATOM 8683 C CE2 . TYR D 1 80 ? 91.403 0.213 31.582 1.00 52.91 ? 159 TYR D CE2 1 ATOM 8684 C CZ . TYR D 1 80 ? 90.924 1.494 31.803 1.00 65.16 ? 159 TYR D CZ 1 ATOM 8685 O OH . TYR D 1 80 ? 89.596 1.672 32.134 1.00 67.05 ? 159 TYR D OH 1 ATOM 8686 N N . SER D 1 81 ? 97.722 -0.479 30.695 1.00 59.87 ? 160 SER D N 1 ATOM 8687 C CA . SER D 1 81 ? 98.939 -0.600 29.893 1.00 63.72 ? 160 SER D CA 1 ATOM 8688 C C . SER D 1 81 ? 98.749 -1.542 28.699 1.00 64.91 ? 160 SER D C 1 ATOM 8689 O O . SER D 1 81 ? 97.862 -2.412 28.699 1.00 59.13 ? 160 SER D O 1 ATOM 8690 C CB . SER D 1 81 ? 100.131 -1.052 30.746 1.00 60.19 ? 160 SER D CB 1 ATOM 8691 O OG . SER D 1 81 ? 100.020 -2.420 31.114 1.00 54.15 ? 160 SER D OG 1 ATOM 8692 N N . VAL D 1 82 ? 99.574 -1.346 27.675 1.00 63.14 ? 161 VAL D N 1 ATOM 8693 C CA . VAL D 1 82 ? 99.606 -2.241 26.525 1.00 59.13 ? 161 VAL D CA 1 ATOM 8694 C C . VAL D 1 82 ? 101.053 -2.581 26.249 1.00 60.48 ? 161 VAL D C 1 ATOM 8695 O O . VAL D 1 82 ? 101.959 -1.918 26.764 1.00 65.27 ? 161 VAL D O 1 ATOM 8696 C CB . VAL D 1 82 ? 99.004 -1.585 25.257 1.00 67.14 ? 161 VAL D CB 1 ATOM 8697 C CG1 . VAL D 1 82 ? 97.491 -1.457 25.383 1.00 65.79 ? 161 VAL D CG1 1 ATOM 8698 C CG2 . VAL D 1 82 ? 99.651 -0.218 25.000 1.00 54.71 ? 161 VAL D CG2 1 ATOM 8699 N N . LYS D 1 83 ? 101.283 -3.613 25.446 1.00 63.22 ? 162 LYS D N 1 ATOM 8700 C CA . LYS D 1 83 ? 102.634 -3.874 24.983 1.00 62.15 ? 162 LYS D CA 1 ATOM 8701 C C . LYS D 1 83 ? 103.006 -2.733 24.039 1.00 67.40 ? 162 LYS D C 1 ATOM 8702 O O . LYS D 1 83 ? 102.191 -2.362 23.173 1.00 55.50 ? 162 LYS D O 1 ATOM 8703 C CB . LYS D 1 83 ? 102.703 -5.202 24.235 1.00 59.82 ? 162 LYS D CB 1 ATOM 8704 C CG . LYS D 1 83 ? 104.114 -5.723 24.062 1.00 58.40 ? 162 LYS D CG 1 ATOM 8705 C CD . LYS D 1 83 ? 104.177 -6.836 23.044 1.00 57.69 ? 162 LYS D CD 1 ATOM 8706 C CE . LYS D 1 83 ? 105.578 -7.458 23.015 1.00 76.04 ? 162 LYS D CE 1 ATOM 8707 N NZ . LYS D 1 83 ? 105.879 -8.174 21.728 1.00 82.12 ? 162 LYS D NZ 1 ATOM 8708 N N . LEU D 1 84 ? 104.199 -2.156 24.230 1.00 64.55 ? 163 LEU D N 1 ATOM 8709 C CA . LEU D 1 84 ? 104.719 -1.153 23.301 1.00 65.31 ? 163 LEU D CA 1 ATOM 8710 C C . LEU D 1 84 ? 104.615 -1.672 21.850 1.00 69.37 ? 163 LEU D C 1 ATOM 8711 O O . LEU D 1 84 ? 105.206 -2.700 21.497 1.00 62.59 ? 163 LEU D O 1 ATOM 8712 C CB . LEU D 1 84 ? 106.164 -0.778 23.642 1.00 57.07 ? 163 LEU D CB 1 ATOM 8713 C CG . LEU D 1 84 ? 106.680 0.441 22.869 1.00 58.96 ? 163 LEU D CG 1 ATOM 8714 C CD1 . LEU D 1 84 ? 105.651 1.565 22.942 1.00 53.05 ? 163 LEU D CD1 1 ATOM 8715 C CD2 . LEU D 1 84 ? 108.040 0.912 23.389 1.00 54.91 ? 163 LEU D CD2 1 ATOM 8716 N N . GLY D 1 85 ? 103.840 -0.974 21.025 1.00 64.41 ? 164 GLY D N 1 ATOM 8717 C CA . GLY D 1 85 ? 103.585 -1.434 19.671 1.00 84.65 ? 164 GLY D CA 1 ATOM 8718 C C . GLY D 1 85 ? 102.116 -1.725 19.405 1.00 84.71 ? 164 GLY D C 1 ATOM 8719 O O . GLY D 1 85 ? 101.559 -1.335 18.371 1.00 89.91 ? 164 GLY D O 1 ATOM 8720 N N . ASP D 1 86 ? 101.481 -2.422 20.336 1.00 69.60 ? 165 ASP D N 1 ATOM 8721 C CA . ASP D 1 86 ? 100.047 -2.638 20.247 1.00 67.75 ? 165 ASP D CA 1 ATOM 8722 C C . ASP D 1 86 ? 99.277 -1.335 20.488 1.00 63.99 ? 165 ASP D C 1 ATOM 8723 O O . ASP D 1 86 ? 99.633 -0.546 21.356 1.00 61.33 ? 165 ASP D O 1 ATOM 8724 C CB . ASP D 1 86 ? 99.615 -3.731 21.238 1.00 70.20 ? 165 ASP D CB 1 ATOM 8725 C CG . ASP D 1 86 ? 100.139 -5.100 20.851 1.00 83.02 ? 165 ASP D CG 1 ATOM 8726 O OD1 . ASP D 1 86 ? 100.991 -5.175 19.933 1.00 92.54 ? 165 ASP D OD1 1 ATOM 8727 O OD2 . ASP D 1 86 ? 99.710 -6.100 21.458 1.00 83.81 ? 165 ASP D OD2 1 ATOM 8728 N N . PRO D 1 87 ? 98.223 -1.098 19.697 1.00 69.20 ? 166 PRO D N 1 ATOM 8729 C CA . PRO D 1 87 ? 97.319 0.039 19.946 1.00 66.55 ? 166 PRO D CA 1 ATOM 8730 C C . PRO D 1 87 ? 96.456 -0.181 21.185 1.00 69.36 ? 166 PRO D C 1 ATOM 8731 O O . PRO D 1 87 ? 96.175 -1.328 21.555 1.00 64.80 ? 166 PRO D O 1 ATOM 8732 C CB . PRO D 1 87 ? 96.419 0.040 18.709 1.00 71.96 ? 166 PRO D CB 1 ATOM 8733 C CG . PRO D 1 87 ? 96.450 -1.425 18.223 1.00 60.63 ? 166 PRO D CG 1 ATOM 8734 C CD . PRO D 1 87 ? 97.871 -1.845 18.470 1.00 53.55 ? 166 PRO D CD 1 ATOM 8735 N N . PRO D 1 88 ? 96.036 0.910 21.829 1.00 70.60 ? 167 PRO D N 1 ATOM 8736 C CA . PRO D 1 88 ? 95.133 0.769 22.979 1.00 72.34 ? 167 PRO D CA 1 ATOM 8737 C C . PRO D 1 88 ? 93.665 0.502 22.615 1.00 79.26 ? 167 PRO D C 1 ATOM 8738 O O . PRO D 1 88 ? 92.770 1.214 23.086 1.00 79.79 ? 167 PRO D O 1 ATOM 8739 C CB . PRO D 1 88 ? 95.288 2.101 23.728 1.00 74.35 ? 167 PRO D CB 1 ATOM 8740 C CG . PRO D 1 88 ? 95.862 3.052 22.725 1.00 80.14 ? 167 PRO D CG 1 ATOM 8741 C CD . PRO D 1 88 ? 96.642 2.247 21.735 1.00 73.00 ? 167 PRO D CD 1 ATOM 8742 N N . THR D 1 89 ? 93.428 -0.519 21.791 1.00 80.74 ? 168 THR D N 1 ATOM 8743 C CA . THR D 1 89 ? 92.090 -1.092 21.638 1.00 84.67 ? 168 THR D CA 1 ATOM 8744 C C . THR D 1 89 ? 91.726 -1.954 22.855 1.00 92.58 ? 168 THR D C 1 ATOM 8745 O O . THR D 1 89 ? 92.558 -2.727 23.343 1.00 78.20 ? 168 THR D O 1 ATOM 8746 C CB . THR D 1 89 ? 91.973 -1.956 20.367 1.00 86.03 ? 168 THR D CB 1 ATOM 8747 O OG1 . THR D 1 89 ? 93.183 -2.707 20.173 1.00 90.41 ? 168 THR D OG1 1 ATOM 8748 C CG2 . THR D 1 89 ? 91.712 -1.075 19.157 1.00 80.88 ? 168 THR D CG2 1 ATOM 8749 N N . PRO D 1 90 ? 90.477 -1.816 23.344 1.00 107.84 ? 169 PRO D N 1 ATOM 8750 C CA . PRO D 1 90 ? 89.883 -2.542 24.475 1.00 107.60 ? 169 PRO D CA 1 ATOM 8751 C C . PRO D 1 90 ? 90.364 -3.987 24.561 1.00 103.46 ? 169 PRO D C 1 ATOM 8752 O O . PRO D 1 90 ? 90.672 -4.482 25.646 1.00 119.92 ? 169 PRO D O 1 ATOM 8753 C CB . PRO D 1 90 ? 88.384 -2.500 24.164 1.00 112.30 ? 169 PRO D CB 1 ATOM 8754 C CG . PRO D 1 90 ? 88.205 -1.385 23.122 1.00 114.32 ? 169 PRO D CG 1 ATOM 8755 C CD . PRO D 1 90 ? 89.554 -0.793 22.832 1.00 114.27 ? 169 PRO D CD 1 ATOM 8756 N N . ASP D 1 91 ? 90.438 -4.644 23.410 1.00 85.58 ? 170 ASP D N 1 ATOM 8757 C CA . ASP D 1 91 ? 90.989 -5.991 23.289 1.00 89.62 ? 170 ASP D CA 1 ATOM 8758 C C . ASP D 1 91 ? 92.427 -6.127 23.815 1.00 83.67 ? 170 ASP D C 1 ATOM 8759 O O . ASP D 1 91 ? 92.813 -7.174 24.339 1.00 90.64 ? 170 ASP D O 1 ATOM 8760 C CB . ASP D 1 91 ? 90.939 -6.394 21.816 1.00 106.60 ? 170 ASP D CB 1 ATOM 8761 C CG . ASP D 1 91 ? 90.828 -7.891 21.623 1.00 127.96 ? 170 ASP D CG 1 ATOM 8762 O OD1 . ASP D 1 91 ? 91.527 -8.645 22.339 1.00 133.81 ? 170 ASP D OD1 1 ATOM 8763 O OD2 . ASP D 1 91 ? 90.031 -8.319 20.761 1.00 132.91 ? 170 ASP D OD2 1 ATOM 8764 N N . LYS D 1 92 A 93.217 -5.066 23.672 1.00 77.00 ? 170 LYS D N 1 ATOM 8765 C CA . LYS D 1 92 A 94.657 -5.131 23.952 1.00 79.28 ? 170 LYS D CA 1 ATOM 8766 C C . LYS D 1 92 A 95.020 -4.509 25.306 1.00 77.61 ? 170 LYS D C 1 ATOM 8767 O O . LYS D 1 92 A 96.198 -4.466 25.687 1.00 62.50 ? 170 LYS D O 1 ATOM 8768 C CB . LYS D 1 92 A 95.446 -4.439 22.827 1.00 72.94 ? 170 LYS D CB 1 ATOM 8769 C CG . LYS D 1 92 A 95.346 -5.092 21.463 1.00 69.18 ? 170 LYS D CG 1 ATOM 8770 C CD . LYS D 1 92 A 96.643 -5.805 21.094 1.00 68.93 ? 170 LYS D CD 1 ATOM 8771 C CE . LYS D 1 92 A 96.424 -6.781 19.930 1.00 72.78 ? 170 LYS D CE 1 ATOM 8772 N NZ . LYS D 1 92 A 97.438 -7.892 19.912 1.00 70.89 ? 170 LYS D NZ 1 ATOM 8773 N N . LEU D 1 93 ? 93.995 -4.042 26.013 1.00 71.27 ? 171 LEU D N 1 ATOM 8774 C CA . LEU D 1 93 ? 94.154 -3.375 27.292 1.00 66.87 ? 171 LEU D CA 1 ATOM 8775 C C . LEU D 1 93 ? 94.368 -4.331 28.470 1.00 72.24 ? 171 LEU D C 1 ATOM 8776 O O . LEU D 1 93 ? 93.791 -5.427 28.531 1.00 81.38 ? 171 LEU D O 1 ATOM 8777 C CB . LEU D 1 93 ? 92.913 -2.530 27.573 1.00 65.10 ? 171 LEU D CB 1 ATOM 8778 C CG . LEU D 1 93 ? 93.035 -1.027 27.354 1.00 79.97 ? 171 LEU D CG 1 ATOM 8779 C CD1 . LEU D 1 93 ? 94.086 -0.712 26.312 1.00 76.99 ? 171 LEU D CD1 1 ATOM 8780 C CD2 . LEU D 1 93 ? 91.691 -0.487 26.928 1.00 86.45 ? 171 LEU D CD2 1 ATOM 8781 N N . LYS D 1 94 ? 95.216 -3.904 29.399 1.00 61.29 ? 172 LYS D N 1 ATOM 8782 C CA . LYS D 1 94 ? 95.325 -4.541 30.705 1.00 62.89 ? 172 LYS D CA 1 ATOM 8783 C C . LYS D 1 94 ? 95.036 -3.498 31.788 1.00 63.90 ? 172 LYS D C 1 ATOM 8784 O O . LYS D 1 94 ? 95.737 -2.481 31.887 1.00 60.77 ? 172 LYS D O 1 ATOM 8785 C CB . LYS D 1 94 ? 96.721 -5.131 30.917 1.00 57.37 ? 172 LYS D CB 1 ATOM 8786 C CG . LYS D 1 94 ? 97.000 -5.495 32.352 1.00 50.52 ? 172 LYS D CG 1 ATOM 8787 C CD . LYS D 1 94 ? 98.405 -6.026 32.523 1.00 64.48 ? 172 LYS D CD 1 ATOM 8788 C CE . LYS D 1 94 ? 98.524 -6.747 33.861 1.00 75.78 ? 172 LYS D CE 1 ATOM 8789 N NZ . LYS D 1 94 ? 99.747 -7.587 33.939 1.00 88.30 ? 172 LYS D NZ 1 ATOM 8790 N N . PHE D 1 95 ? 93.992 -3.739 32.579 1.00 65.34 ? 173 PHE D N 1 ATOM 8791 C CA . PHE D 1 95 ? 93.712 -2.899 33.738 1.00 66.95 ? 173 PHE D CA 1 ATOM 8792 C C . PHE D 1 95 ? 94.896 -2.966 34.703 1.00 62.79 ? 173 PHE D C 1 ATOM 8793 O O . PHE D 1 95 ? 95.423 -4.049 34.971 1.00 62.28 ? 173 PHE D O 1 ATOM 8794 C CB . PHE D 1 95 ? 92.444 -3.358 34.455 1.00 68.16 ? 173 PHE D CB 1 ATOM 8795 C CG . PHE D 1 95 ? 92.002 -2.425 35.538 1.00 69.43 ? 173 PHE D CG 1 ATOM 8796 C CD1 . PHE D 1 95 ? 91.163 -1.359 35.240 1.00 70.93 ? 173 PHE D CD1 1 ATOM 8797 C CD2 . PHE D 1 95 ? 92.436 -2.595 36.853 1.00 69.43 ? 173 PHE D CD2 1 ATOM 8798 C CE1 . PHE D 1 95 ? 90.752 -0.485 36.227 1.00 69.38 ? 173 PHE D CE1 1 ATOM 8799 C CE2 . PHE D 1 95 ? 92.032 -1.722 37.851 1.00 73.69 ? 173 PHE D CE2 1 ATOM 8800 C CZ . PHE D 1 95 ? 91.185 -0.664 37.535 1.00 75.40 ? 173 PHE D CZ 1 ATOM 8801 N N . GLU D 1 96 ? 95.320 -1.815 35.216 1.00 53.02 ? 174 GLU D N 1 ATOM 8802 C CA . GLU D 1 96 ? 96.479 -1.779 36.101 1.00 65.02 ? 174 GLU D CA 1 ATOM 8803 C C . GLU D 1 96 ? 96.149 -1.310 37.527 1.00 68.36 ? 174 GLU D C 1 ATOM 8804 O O . GLU D 1 96 ? 96.592 -1.930 38.497 1.00 71.63 ? 174 GLU D O 1 ATOM 8805 C CB . GLU D 1 96 ? 97.611 -0.956 35.473 1.00 64.58 ? 174 GLU D CB 1 ATOM 8806 C CG . GLU D 1 96 ? 98.264 -1.625 34.265 1.00 64.43 ? 174 GLU D CG 1 ATOM 8807 C CD . GLU D 1 96 ? 99.191 -2.772 34.656 1.00 75.40 ? 174 GLU D CD 1 ATOM 8808 O OE1 . GLU D 1 96 ? 99.416 -2.981 35.873 1.00 88.00 ? 174 GLU D OE1 1 ATOM 8809 O OE2 . GLU D 1 96 ? 99.704 -3.461 33.748 1.00 71.81 ? 174 GLU D OE2 1 ATOM 8810 N N . ALA D 1 97 ? 95.372 -0.232 37.643 1.00 60.23 ? 175 ALA D N 1 ATOM 8811 C CA . ALA D 1 97 ? 94.960 0.312 38.940 1.00 60.65 ? 175 ALA D CA 1 ATOM 8812 C C . ALA D 1 97 ? 93.889 1.363 38.718 1.00 60.00 ? 175 ALA D C 1 ATOM 8813 O O . ALA D 1 97 ? 93.650 1.777 37.585 1.00 61.49 ? 175 ALA D O 1 ATOM 8814 C CB . ALA D 1 97 ? 96.156 0.933 39.695 1.00 57.23 ? 175 ALA D CB 1 ATOM 8815 N N . VAL D 1 98 ? 93.257 1.798 39.804 1.00 61.31 ? 176 VAL D N 1 ATOM 8816 C CA . VAL D 1 98 ? 92.375 2.964 39.778 1.00 62.49 ? 176 VAL D CA 1 ATOM 8817 C C . VAL D 1 98 ? 93.228 4.203 40.084 1.00 65.79 ? 176 VAL D C 1 ATOM 8818 O O . VAL D 1 98 ? 94.014 4.188 41.034 1.00 68.34 ? 176 VAL D O 1 ATOM 8819 C CB . VAL D 1 98 ? 91.254 2.812 40.839 1.00 74.81 ? 176 VAL D CB 1 ATOM 8820 C CG1 . VAL D 1 98 ? 90.273 3.978 40.799 1.00 62.78 ? 176 VAL D CG1 1 ATOM 8821 C CG2 . VAL D 1 98 ? 90.523 1.490 40.643 1.00 71.72 ? 176 VAL D CG2 1 ATOM 8822 N N . GLY D 1 99 ? 93.104 5.258 39.276 1.00 73.33 ? 177 GLY D N 1 ATOM 8823 C CA . GLY D 1 99 ? 93.908 6.459 39.484 1.00 79.96 ? 177 GLY D CA 1 ATOM 8824 C C . GLY D 1 99 ? 94.060 7.439 38.320 1.00 82.00 ? 177 GLY D C 1 ATOM 8825 O O . GLY D 1 99 ? 93.644 7.162 37.191 1.00 89.56 ? 177 GLY D O 1 ATOM 8826 N N . TRP D 1 100 ? 94.665 8.592 38.602 1.00 72.53 ? 178 TRP D N 1 ATOM 8827 C CA . TRP D 1 100 ? 94.843 9.652 37.603 1.00 79.95 ? 178 TRP D CA 1 ATOM 8828 C C . TRP D 1 100 ? 96.320 10.015 37.434 1.00 81.68 ? 178 TRP D C 1 ATOM 8829 O O . TRP D 1 100 ? 96.661 10.940 36.699 1.00 85.06 ? 178 TRP D O 1 ATOM 8830 C CB . TRP D 1 100 ? 94.046 10.907 38.005 1.00 85.89 ? 178 TRP D CB 1 ATOM 8831 C CG . TRP D 1 100 ? 94.380 11.407 39.378 1.00 77.99 ? 178 TRP D CG 1 ATOM 8832 C CD1 . TRP D 1 100 ? 95.516 12.063 39.764 1.00 68.66 ? 178 TRP D CD1 1 ATOM 8833 C CD2 . TRP D 1 100 ? 93.574 11.277 40.549 1.00 82.48 ? 178 TRP D CD2 1 ATOM 8834 N NE1 . TRP D 1 100 ? 95.463 12.352 41.105 1.00 70.99 ? 178 TRP D NE1 1 ATOM 8835 C CE2 . TRP D 1 100 ? 94.280 11.884 41.613 1.00 86.58 ? 178 TRP D CE2 1 ATOM 8836 C CE3 . TRP D 1 100 ? 92.319 10.711 40.802 1.00 74.29 ? 178 TRP D CE3 1 ATOM 8837 C CZ2 . TRP D 1 100 ? 93.771 11.939 42.917 1.00 83.69 ? 178 TRP D CZ2 1 ATOM 8838 C CZ3 . TRP D 1 100 ? 91.813 10.772 42.097 1.00 78.11 ? 178 TRP D CZ3 1 ATOM 8839 C CH2 . TRP D 1 100 ? 92.540 11.382 43.137 1.00 81.74 ? 178 TRP D CH2 1 ATOM 8840 N N . SER D 1 101 ? 97.188 9.284 38.126 1.00 80.96 ? 179 SER D N 1 ATOM 8841 C CA . SER D 1 101 ? 98.622 9.562 38.135 1.00 79.79 ? 179 SER D CA 1 ATOM 8842 C C . SER D 1 101 ? 99.360 8.253 38.406 1.00 73.51 ? 179 SER D C 1 ATOM 8843 O O . SER D 1 101 ? 99.014 7.534 39.346 1.00 71.27 ? 179 SER D O 1 ATOM 8844 C CB . SER D 1 101 ? 98.939 10.588 39.228 1.00 79.80 ? 179 SER D CB 1 ATOM 8845 O OG . SER D 1 101 ? 100.325 10.875 39.294 1.00 80.96 ? 179 SER D OG 1 ATOM 8846 N N . ALA D 1 102 ? 100.366 7.927 37.596 1.00 75.62 ? 180 ALA D N 1 ATOM 8847 C CA . ALA D 1 102 ? 101.002 6.612 37.732 1.00 71.43 ? 180 ALA D CA 1 ATOM 8848 C C . ALA D 1 102 ? 102.476 6.511 37.330 1.00 75.21 ? 180 ALA D C 1 ATOM 8849 O O . ALA D 1 102 ? 102.912 7.086 36.330 1.00 83.95 ? 180 ALA D O 1 ATOM 8850 C CB . ALA D 1 102 ? 100.176 5.537 37.010 1.00 60.97 ? 180 ALA D CB 1 ATOM 8851 N N . SER D 1 103 ? 103.224 5.752 38.127 1.00 73.27 ? 181 SER D N 1 ATOM 8852 C CA . SER D 1 103 ? 104.589 5.367 37.804 1.00 71.49 ? 181 SER D CA 1 ATOM 8853 C C . SER D 1 103 ? 104.656 3.846 37.870 1.00 72.53 ? 181 SER D C 1 ATOM 8854 O O . SER D 1 103 ? 104.059 3.231 38.760 1.00 73.60 ? 181 SER D O 1 ATOM 8855 C CB . SER D 1 103 ? 105.560 5.963 38.820 1.00 72.28 ? 181 SER D CB 1 ATOM 8856 O OG . SER D 1 103 ? 106.869 5.446 38.642 1.00 76.69 ? 181 SER D OG 1 ATOM 8857 N N . SER D 1 104 ? 105.367 3.217 36.946 1.00 67.28 ? 182 SER D N 1 ATOM 8858 C CA . SER D 1 104 ? 105.558 1.777 37.089 1.00 66.60 ? 182 SER D CA 1 ATOM 8859 C C . SER D 1 104 ? 106.986 1.349 36.798 1.00 64.87 ? 182 SER D C 1 ATOM 8860 O O . SER D 1 104 ? 107.811 2.153 36.349 1.00 67.13 ? 182 SER D O 1 ATOM 8861 C CB . SER D 1 104 ? 104.559 0.989 36.234 1.00 65.19 ? 182 SER D CB 1 ATOM 8862 O OG . SER D 1 104 ? 104.772 1.206 34.850 1.00 63.07 ? 182 SER D OG 1 ATOM 8863 N N . CYS D 1 105 ? 107.266 0.078 37.078 1.00 64.52 ? 183 CYS D N 1 ATOM 8864 C CA . CYS D 1 105 ? 108.594 -0.512 36.883 1.00 67.32 ? 183 CYS D CA 1 ATOM 8865 C C . CYS D 1 105 ? 108.581 -1.985 37.288 1.00 74.89 ? 183 CYS D C 1 ATOM 8866 O O . CYS D 1 105 ? 107.762 -2.416 38.118 1.00 77.89 ? 183 CYS D O 1 ATOM 8867 C CB . CYS D 1 105 ? 109.669 0.237 37.681 1.00 70.86 ? 183 CYS D CB 1 ATOM 8868 S SG . CYS D 1 105 ? 109.267 0.523 39.459 1.00 77.48 ? 183 CYS D SG 1 ATOM 8869 N N . HIS D 1 106 ? 109.506 -2.743 36.708 1.00 71.81 ? 184 HIS D N 1 ATOM 8870 C CA . HIS D 1 106 ? 109.540 -4.192 36.865 1.00 69.70 ? 184 HIS D CA 1 ATOM 8871 C C . HIS D 1 106 ? 110.861 -4.606 37.512 1.00 73.80 ? 184 HIS D C 1 ATOM 8872 O O . HIS D 1 106 ? 111.916 -4.076 37.153 1.00 76.80 ? 184 HIS D O 1 ATOM 8873 C CB . HIS D 1 106 ? 109.381 -4.848 35.494 1.00 68.77 ? 184 HIS D CB 1 ATOM 8874 C CG . HIS D 1 106 ? 108.962 -6.278 35.558 1.00 70.51 ? 184 HIS D CG 1 ATOM 8875 N ND1 . HIS D 1 106 ? 109.862 -7.311 35.739 1.00 70.18 ? 184 HIS D ND1 1 ATOM 8876 C CD2 . HIS D 1 106 ? 107.739 -6.851 35.466 1.00 58.96 ? 184 HIS D CD2 1 ATOM 8877 C CE1 . HIS D 1 106 ? 109.205 -8.456 35.759 1.00 70.57 ? 184 HIS D CE1 1 ATOM 8878 N NE2 . HIS D 1 106 ? 107.919 -8.209 35.595 1.00 63.74 ? 184 HIS D NE2 1 ATOM 8879 N N . ASP D 1 107 ? 110.802 -5.546 38.456 1.00 72.67 ? 185 ASP D N 1 ATOM 8880 C CA . ASP D 1 107 ? 111.964 -5.889 39.283 1.00 72.46 ? 185 ASP D CA 1 ATOM 8881 C C . ASP D 1 107 ? 112.577 -7.224 38.892 1.00 73.67 ? 185 ASP D C 1 ATOM 8882 O O . ASP D 1 107 ? 113.477 -7.727 39.569 1.00 71.80 ? 185 ASP D O 1 ATOM 8883 C CB . ASP D 1 107 ? 111.573 -5.914 40.775 1.00 65.34 ? 185 ASP D CB 1 ATOM 8884 C CG . ASP D 1 107 ? 110.450 -6.909 41.083 1.00 76.58 ? 185 ASP D CG 1 ATOM 8885 O OD1 . ASP D 1 107 ? 109.946 -7.580 40.155 1.00 82.81 ? 185 ASP D OD1 1 ATOM 8886 O OD2 . ASP D 1 107 ? 110.058 -7.011 42.261 1.00 76.77 ? 185 ASP D OD2 1 ATOM 8887 N N . GLY D 1 108 ? 112.075 -7.794 37.800 1.00 77.25 ? 186 GLY D N 1 ATOM 8888 C CA . GLY D 1 108 ? 112.453 -9.134 37.383 1.00 76.03 ? 186 GLY D CA 1 ATOM 8889 C C . GLY D 1 108 ? 111.392 -10.165 37.737 1.00 75.47 ? 186 GLY D C 1 ATOM 8890 O O . GLY D 1 108 ? 111.348 -11.250 37.160 1.00 71.39 ? 186 GLY D O 1 ATOM 8891 N N . PHE D 1 109 ? 110.532 -9.819 38.690 1.00 82.25 ? 187 PHE D N 1 ATOM 8892 C CA . PHE D 1 109 ? 109.516 -10.743 39.180 1.00 79.94 ? 187 PHE D CA 1 ATOM 8893 C C . PHE D 1 109 ? 108.111 -10.275 38.822 1.00 79.90 ? 187 PHE D C 1 ATOM 8894 O O . PHE D 1 109 ? 107.275 -11.058 38.347 1.00 67.13 ? 187 PHE D O 1 ATOM 8895 C CB . PHE D 1 109 ? 109.607 -10.874 40.704 1.00 70.51 ? 187 PHE D CB 1 ATOM 8896 C CG . PHE D 1 109 ? 110.949 -11.328 41.203 1.00 78.15 ? 187 PHE D CG 1 ATOM 8897 C CD1 . PHE D 1 109 ? 111.398 -12.620 40.959 1.00 72.65 ? 187 PHE D CD1 1 ATOM 8898 C CD2 . PHE D 1 109 ? 111.756 -10.466 41.942 1.00 80.07 ? 187 PHE D CD2 1 ATOM 8899 C CE1 . PHE D 1 109 ? 112.637 -13.040 41.434 1.00 80.99 ? 187 PHE D CE1 1 ATOM 8900 C CE2 . PHE D 1 109 ? 112.994 -10.876 42.423 1.00 76.63 ? 187 PHE D CE2 1 ATOM 8901 C CZ . PHE D 1 109 ? 113.437 -12.164 42.171 1.00 83.50 ? 187 PHE D CZ 1 ATOM 8902 N N . GLN D 1 110 ? 107.860 -8.989 39.058 1.00 82.31 ? 188 GLN D N 1 ATOM 8903 C CA . GLN D 1 110 ? 106.508 -8.451 38.998 1.00 68.34 ? 188 GLN D CA 1 ATOM 8904 C C . GLN D 1 110 ? 106.500 -6.955 38.697 1.00 68.81 ? 188 GLN D C 1 ATOM 8905 O O . GLN D 1 110 ? 107.447 -6.221 39.024 1.00 72.25 ? 188 GLN D O 1 ATOM 8906 C CB . GLN D 1 110 ? 105.808 -8.709 40.338 1.00 64.86 ? 188 GLN D CB 1 ATOM 8907 C CG . GLN D 1 110 ? 104.454 -9.386 40.246 1.00 77.12 ? 188 GLN D CG 1 ATOM 8908 C CD . GLN D 1 110 ? 104.522 -10.871 39.926 1.00 73.86 ? 188 GLN D CD 1 ATOM 8909 O OE1 . GLN D 1 110 ? 105.486 -11.549 40.263 1.00 82.25 ? 188 GLN D OE1 1 ATOM 8910 N NE2 . GLN D 1 110 ? 103.483 -11.382 39.289 1.00 56.87 ? 188 GLN D NE2 1 ATOM 8911 N N . TRP D 1 111 ? 105.425 -6.511 38.056 1.00 60.77 ? 189 TRP D N 1 ATOM 8912 C CA . TRP D 1 111 ? 105.181 -5.087 37.890 1.00 56.94 ? 189 TRP D CA 1 ATOM 8913 C C . TRP D 1 111 ? 104.782 -4.455 39.220 1.00 64.13 ? 189 TRP D C 1 ATOM 8914 O O . TRP D 1 111 ? 103.805 -4.867 39.880 1.00 59.38 ? 189 TRP D O 1 ATOM 8915 C CB . TRP D 1 111 ? 104.096 -4.828 36.848 1.00 52.48 ? 189 TRP D CB 1 ATOM 8916 C CG . TRP D 1 111 ? 104.595 -5.008 35.460 1.00 65.51 ? 189 TRP D CG 1 ATOM 8917 C CD1 . TRP D 1 111 ? 104.378 -6.081 34.649 1.00 64.29 ? 189 TRP D CD1 1 ATOM 8918 C CD2 . TRP D 1 111 ? 105.420 -4.101 34.714 1.00 61.61 ? 189 TRP D CD2 1 ATOM 8919 N NE1 . TRP D 1 111 ? 105.013 -5.900 33.444 1.00 61.02 ? 189 TRP D NE1 1 ATOM 8920 C CE2 . TRP D 1 111 ? 105.656 -4.692 33.456 1.00 49.91 ? 189 TRP D CE2 1 ATOM 8921 C CE3 . TRP D 1 111 ? 105.978 -2.844 34.989 1.00 65.72 ? 189 TRP D CE3 1 ATOM 8922 C CZ2 . TRP D 1 111 ? 106.418 -4.075 32.469 1.00 47.43 ? 189 TRP D CZ2 1 ATOM 8923 C CZ3 . TRP D 1 111 ? 106.740 -2.233 34.010 1.00 62.67 ? 189 TRP D CZ3 1 ATOM 8924 C CH2 . TRP D 1 111 ? 106.953 -2.851 32.762 1.00 58.69 ? 189 TRP D CH2 1 ATOM 8925 N N . THR D 1 112 ? 105.563 -3.460 39.609 1.00 59.83 ? 190 THR D N 1 ATOM 8926 C CA . THR D 1 112 ? 105.197 -2.585 40.702 1.00 71.67 ? 190 THR D CA 1 ATOM 8927 C C . THR D 1 112 ? 104.511 -1.365 40.084 1.00 73.89 ? 190 THR D C 1 ATOM 8928 O O . THR D 1 112 ? 105.045 -0.748 39.150 1.00 73.62 ? 190 THR D O 1 ATOM 8929 C CB . THR D 1 112 ? 106.443 -2.161 41.468 1.00 67.93 ? 190 THR D CB 1 ATOM 8930 O OG1 . THR D 1 112 ? 107.300 -3.302 41.625 1.00 75.58 ? 190 THR D OG1 1 ATOM 8931 C CG2 . THR D 1 112 ? 106.067 -1.609 42.811 1.00 66.21 ? 190 THR D CG2 1 ATOM 8932 N N . VAL D 1 113 ? 103.317 -1.035 40.570 1.00 68.99 ? 191 VAL D N 1 ATOM 8933 C CA . VAL D 1 113 ? 102.581 0.112 40.031 1.00 68.78 ? 191 VAL D CA 1 ATOM 8934 C C . VAL D 1 113 ? 102.102 1.065 41.130 1.00 72.21 ? 191 VAL D C 1 ATOM 8935 O O . VAL D 1 113 ? 101.343 0.672 42.018 1.00 83.21 ? 191 VAL D O 1 ATOM 8936 C CB . VAL D 1 113 ? 101.378 -0.320 39.133 1.00 62.16 ? 191 VAL D CB 1 ATOM 8937 C CG1 . VAL D 1 113 ? 100.504 0.878 38.782 1.00 56.82 ? 191 VAL D CG1 1 ATOM 8938 C CG2 . VAL D 1 113 ? 101.866 -0.997 37.852 1.00 62.17 ? 191 VAL D CG2 1 ATOM 8939 N N . LEU D 1 114 ? 102.557 2.315 41.065 1.00 68.03 ? 192 LEU D N 1 ATOM 8940 C CA . LEU D 1 114 ? 102.106 3.360 41.989 1.00 73.57 ? 192 LEU D CA 1 ATOM 8941 C C . LEU D 1 114 ? 101.022 4.210 41.340 1.00 75.51 ? 192 LEU D C 1 ATOM 8942 O O . LEU D 1 114 ? 101.204 4.757 40.248 1.00 71.15 ? 192 LEU D O 1 ATOM 8943 C CB . LEU D 1 114 ? 103.265 4.255 42.447 1.00 71.68 ? 192 LEU D CB 1 ATOM 8944 C CG . LEU D 1 114 ? 104.308 3.540 43.303 1.00 72.55 ? 192 LEU D CG 1 ATOM 8945 C CD1 . LEU D 1 114 ? 105.467 3.055 42.441 1.00 62.15 ? 192 LEU D CD1 1 ATOM 8946 C CD2 . LEU D 1 114 ? 104.807 4.428 44.434 1.00 72.32 ? 192 LEU D CD2 1 ATOM 8947 N N . SER D 1 115 ? 99.893 4.317 42.026 1.00 74.55 ? 193 SER D N 1 ATOM 8948 C CA . SER D 1 115 ? 98.740 5.014 41.494 1.00 66.54 ? 193 SER D CA 1 ATOM 8949 C C . SER D 1 115 ? 98.118 5.940 42.554 1.00 71.73 ? 193 SER D C 1 ATOM 8950 O O . SER D 1 115 ? 97.841 5.526 43.692 1.00 70.22 ? 193 SER D O 1 ATOM 8951 C CB . SER D 1 115 ? 97.718 3.989 41.000 1.00 69.50 ? 193 SER D CB 1 ATOM 8952 O OG . SER D 1 115 ? 96.633 4.622 40.360 1.00 83.32 ? 193 SER D OG 1 ATOM 8953 N N . VAL D 1 116 ? 97.921 7.199 42.171 1.00 69.29 ? 194 VAL D N 1 ATOM 8954 C CA . VAL D 1 116 ? 97.223 8.170 42.999 1.00 62.04 ? 194 VAL D CA 1 ATOM 8955 C C . VAL D 1 116 ? 95.732 8.049 42.731 1.00 68.68 ? 194 VAL D C 1 ATOM 8956 O O . VAL D 1 116 ? 95.275 8.169 41.599 1.00 74.88 ? 194 VAL D O 1 ATOM 8957 C CB . VAL D 1 116 ? 97.659 9.615 42.677 1.00 63.56 ? 194 VAL D CB 1 ATOM 8958 C CG1 . VAL D 1 116 ? 97.117 10.584 43.735 1.00 57.45 ? 194 VAL D CG1 1 ATOM 8959 C CG2 . VAL D 1 116 ? 99.172 9.708 42.592 1.00 70.83 ? 194 VAL D CG2 1 ATOM 8960 N N . ALA D 1 117 ? 94.968 7.823 43.783 1.00 75.15 ? 195 ALA D N 1 ATOM 8961 C CA . ALA D 1 117 ? 93.548 7.595 43.631 1.00 73.71 ? 195 ALA D CA 1 ATOM 8962 C C . ALA D 1 117 ? 92.842 8.152 44.854 1.00 79.64 ? 195 ALA D C 1 ATOM 8963 O O . ALA D 1 117 ? 93.492 8.654 45.781 1.00 78.40 ? 195 ALA D O 1 ATOM 8964 C CB . ALA D 1 117 ? 93.275 6.110 43.480 1.00 78.93 ? 195 ALA D CB 1 ATOM 8965 N N . GLY D 1 118 ? 91.514 8.066 44.845 1.00 77.92 ? 196 GLY D N 1 ATOM 8966 C CA . GLY D 1 118 ? 90.699 8.545 45.946 1.00 75.25 ? 196 GLY D CA 1 ATOM 8967 C C . GLY D 1 118 ? 90.815 10.042 46.155 1.00 83.23 ? 196 GLY D C 1 ATOM 8968 O O . GLY D 1 118 ? 90.479 10.835 45.276 1.00 88.56 ? 196 GLY D O 1 ATOM 8969 N N . ASP D 1 119 ? 91.302 10.427 47.328 1.00 90.89 ? 200 ASP D N 1 ATOM 8970 C CA . ASP D 1 119 ? 91.447 11.834 47.670 1.00 96.49 ? 200 ASP D CA 1 ATOM 8971 C C . ASP D 1 119 ? 92.853 12.345 47.355 1.00 103.71 ? 200 ASP D C 1 ATOM 8972 O O . ASP D 1 119 ? 93.116 13.550 47.432 1.00 110.36 ? 200 ASP D O 1 ATOM 8973 C CB . ASP D 1 119 ? 91.079 12.078 49.141 1.00 99.69 ? 200 ASP D CB 1 ATOM 8974 C CG . ASP D 1 119 ? 92.026 11.383 50.121 1.00 104.31 ? 200 ASP D CG 1 ATOM 8975 O OD1 . ASP D 1 119 ? 92.614 10.340 49.766 1.00 96.25 ? 200 ASP D OD1 1 ATOM 8976 O OD2 . ASP D 1 119 ? 92.173 11.884 51.261 1.00 112.94 ? 200 ASP D OD2 1 ATOM 8977 N N . GLY D 1 120 ? 93.746 11.426 46.991 1.00 96.16 ? 201 GLY D N 1 ATOM 8978 C CA . GLY D 1 120 ? 95.116 11.785 46.665 1.00 93.03 ? 201 GLY D CA 1 ATOM 8979 C C . GLY D 1 120 ? 96.176 11.003 47.426 1.00 85.03 ? 201 GLY D C 1 ATOM 8980 O O . GLY D 1 120 ? 97.284 11.499 47.654 1.00 81.60 ? 201 GLY D O 1 ATOM 8981 N N . PHE D 1 121 ? 95.840 9.782 47.831 1.00 76.45 ? 202 PHE D N 1 ATOM 8982 C CA . PHE D 1 121 ? 96.842 8.874 48.382 1.00 78.10 ? 202 PHE D CA 1 ATOM 8983 C C . PHE D 1 121 ? 97.354 7.960 47.268 1.00 76.45 ? 202 PHE D C 1 ATOM 8984 O O . PHE D 1 121 ? 96.638 7.697 46.292 1.00 84.65 ? 202 PHE D O 1 ATOM 8985 C CB . PHE D 1 121 ? 96.248 8.029 49.513 1.00 86.35 ? 202 PHE D CB 1 ATOM 8986 C CG . PHE D 1 121 ? 95.160 7.093 49.063 1.00 73.64 ? 202 PHE D CG 1 ATOM 8987 C CD1 . PHE D 1 121 ? 93.851 7.545 48.927 1.00 73.06 ? 202 PHE D CD1 1 ATOM 8988 C CD2 . PHE D 1 121 ? 95.447 5.764 48.772 1.00 65.18 ? 202 PHE D CD2 1 ATOM 8989 C CE1 . PHE D 1 121 ? 92.850 6.692 48.509 1.00 78.32 ? 202 PHE D CE1 1 ATOM 8990 C CE2 . PHE D 1 121 ? 94.455 4.911 48.349 1.00 73.83 ? 202 PHE D CE2 1 ATOM 8991 C CZ . PHE D 1 121 ? 93.150 5.376 48.214 1.00 80.41 ? 202 PHE D CZ 1 ATOM 8992 N N . VAL D 1 122 ? 98.587 7.480 47.391 1.00 78.72 ? 203 VAL D N 1 ATOM 8993 C CA . VAL D 1 122 ? 99.093 6.530 46.401 1.00 83.85 ? 203 VAL D CA 1 ATOM 8994 C C . VAL D 1 122 ? 98.935 5.087 46.862 1.00 72.58 ? 203 VAL D C 1 ATOM 8995 O O . VAL D 1 122 ? 99.303 4.739 47.990 1.00 72.61 ? 203 VAL D O 1 ATOM 8996 C CB . VAL D 1 122 ? 100.557 6.836 45.932 1.00 72.19 ? 203 VAL D CB 1 ATOM 8997 C CG1 . VAL D 1 122 ? 101.290 7.730 46.920 1.00 79.23 ? 203 VAL D CG1 1 ATOM 8998 C CG2 . VAL D 1 122 ? 101.330 5.550 45.653 1.00 62.53 ? 203 VAL D CG2 1 ATOM 8999 N N . SER D 1 123 ? 98.355 4.261 45.991 1.00 67.34 ? 204 SER D N 1 ATOM 9000 C CA . SER D 1 123 ? 98.240 2.825 46.261 1.00 72.41 ? 204 SER D CA 1 ATOM 9001 C C . SER D 1 123 ? 99.339 2.092 45.492 1.00 77.89 ? 204 SER D C 1 ATOM 9002 O O . SER D 1 123 ? 99.640 2.456 44.348 1.00 77.74 ? 204 SER D O 1 ATOM 9003 C CB . SER D 1 123 ? 96.864 2.308 45.848 1.00 77.52 ? 204 SER D CB 1 ATOM 9004 O OG . SER D 1 123 ? 95.908 3.339 45.906 1.00 94.85 ? 204 SER D OG 1 ATOM 9005 N N . ILE D 1 124 ? 99.952 1.085 46.115 1.00 79.09 ? 205 ILE D N 1 ATOM 9006 C CA . ILE D 1 124 ? 101.040 0.351 45.460 1.00 76.23 ? 205 ILE D CA 1 ATOM 9007 C C . ILE D 1 124 ? 100.655 -1.087 45.138 1.00 68.05 ? 205 ILE D C 1 ATOM 9008 O O . ILE D 1 124 ? 100.396 -1.883 46.045 1.00 77.09 ? 205 ILE D O 1 ATOM 9009 C CB . ILE D 1 124 ? 102.326 0.328 46.309 1.00 74.72 ? 205 ILE D CB 1 ATOM 9010 C CG1 . ILE D 1 124 ? 102.873 1.744 46.509 1.00 70.49 ? 205 ILE D CG1 1 ATOM 9011 C CG2 . ILE D 1 124 ? 103.383 -0.544 45.643 1.00 76.39 ? 205 ILE D CG2 1 ATOM 9012 C CD1 . ILE D 1 124 ? 104.205 1.774 47.229 1.00 73.51 ? 205 ILE D CD1 1 ATOM 9013 N N . LEU D 1 125 ? 100.646 -1.425 43.851 1.00 69.76 ? 206 LEU D N 1 ATOM 9014 C CA . LEU D 1 125 ? 100.226 -2.763 43.414 1.00 69.61 ? 206 LEU D CA 1 ATOM 9015 C C . LEU D 1 125 ? 101.396 -3.580 42.890 1.00 65.33 ? 206 LEU D C 1 ATOM 9016 O O . LEU D 1 125 ? 102.211 -3.085 42.105 1.00 71.74 ? 206 LEU D O 1 ATOM 9017 C CB . LEU D 1 125 ? 99.101 -2.685 42.373 1.00 71.07 ? 206 LEU D CB 1 ATOM 9018 C CG . LEU D 1 125 ? 97.761 -2.100 42.851 1.00 74.19 ? 206 LEU D CG 1 ATOM 9019 C CD1 . LEU D 1 125 ? 97.781 -0.582 42.784 1.00 71.47 ? 206 LEU D CD1 1 ATOM 9020 C CD2 . LEU D 1 125 ? 96.569 -2.653 42.073 1.00 66.17 ? 206 LEU D CD2 1 ATOM 9021 N N . TYR D 1 126 ? 101.476 -4.834 43.331 1.00 59.98 ? 207 TYR D N 1 ATOM 9022 C CA . TYR D 1 126 ? 102.601 -5.710 42.988 1.00 65.30 ? 207 TYR D CA 1 ATOM 9023 C C . TYR D 1 126 ? 102.027 -7.041 42.509 1.00 71.11 ? 207 TYR D C 1 ATOM 9024 O O . TYR D 1 126 ? 101.432 -7.800 43.285 1.00 76.36 ? 207 TYR D O 1 ATOM 9025 C CB . TYR D 1 126 ? 103.499 -5.889 44.203 1.00 67.25 ? 207 TYR D CB 1 ATOM 9026 C CG . TYR D 1 126 ? 104.790 -6.617 43.935 1.00 64.91 ? 207 TYR D CG 1 ATOM 9027 C CD1 . TYR D 1 126 ? 105.873 -5.961 43.379 1.00 66.06 ? 207 TYR D CD1 1 ATOM 9028 C CD2 . TYR D 1 126 ? 104.940 -7.954 44.275 1.00 72.57 ? 207 TYR D CD2 1 ATOM 9029 C CE1 . TYR D 1 126 ? 107.073 -6.624 43.151 1.00 75.90 ? 207 TYR D CE1 1 ATOM 9030 C CE2 . TYR D 1 126 ? 106.133 -8.628 44.049 1.00 74.54 ? 207 TYR D CE2 1 ATOM 9031 C CZ . TYR D 1 126 ? 107.196 -7.961 43.486 1.00 73.27 ? 207 TYR D CZ 1 ATOM 9032 O OH . TYR D 1 126 ? 108.376 -8.634 43.262 1.00 73.09 ? 207 TYR D OH 1 ATOM 9033 N N . GLY D 1 127 ? 102.215 -7.330 41.227 1.00 83.94 ? 208 GLY D N 1 ATOM 9034 C CA . GLY D 1 127 ? 101.284 -8.205 40.542 1.00 89.33 ? 208 GLY D CA 1 ATOM 9035 C C . GLY D 1 127 ? 100.090 -7.297 40.383 1.00 95.80 ? 208 GLY D C 1 ATOM 9036 O O . GLY D 1 127 ? 100.257 -6.123 40.030 1.00 114.58 ? 208 GLY D O 1 ATOM 9037 N N . GLY D 1 128 ? 98.900 -7.805 40.656 1.00 80.20 ? 209 GLY D N 1 ATOM 9038 C CA . GLY D 1 128 ? 97.765 -6.918 40.778 1.00 79.85 ? 209 GLY D CA 1 ATOM 9039 C C . GLY D 1 128 ? 97.246 -6.969 42.194 1.00 70.76 ? 209 GLY D C 1 ATOM 9040 O O . GLY D 1 128 ? 96.033 -6.959 42.412 1.00 74.91 ? 209 GLY D O 1 ATOM 9041 N N . ILE D 1 129 ? 98.161 -7.054 43.158 1.00 60.16 ? 210 ILE D N 1 ATOM 9042 C CA . ILE D 1 129 ? 97.770 -7.070 44.568 1.00 73.16 ? 210 ILE D CA 1 ATOM 9043 C C . ILE D 1 129 ? 98.353 -5.871 45.304 1.00 79.18 ? 210 ILE D C 1 ATOM 9044 O O . ILE D 1 129 ? 99.503 -5.478 45.084 1.00 85.48 ? 210 ILE D O 1 ATOM 9045 C CB . ILE D 1 129 ? 98.122 -8.404 45.264 1.00 82.22 ? 210 ILE D CB 1 ATOM 9046 C CG1 . ILE D 1 129 ? 99.482 -8.343 45.962 1.00 106.15 ? 210 ILE D CG1 1 ATOM 9047 C CG2 . ILE D 1 129 ? 98.075 -9.540 44.264 1.00 71.14 ? 210 ILE D CG2 1 ATOM 9048 C CD1 . ILE D 1 129 ? 99.837 -9.597 46.754 1.00 114.58 ? 210 ILE D CD1 1 ATOM 9049 N N . ILE D 1 130 ? 97.542 -5.259 46.152 1.00 75.98 ? 211 ILE D N 1 ATOM 9050 C CA . ILE D 1 130 ? 98.007 -4.095 46.879 1.00 69.54 ? 211 ILE D CA 1 ATOM 9051 C C . ILE D 1 130 ? 98.958 -4.471 48.031 1.00 70.00 ? 211 ILE D C 1 ATOM 9052 O O . ILE D 1 130 ? 98.631 -5.297 48.899 1.00 67.15 ? 211 ILE D O 1 ATOM 9053 C CB . ILE D 1 130 ? 96.842 -3.213 47.331 1.00 77.12 ? 211 ILE D CB 1 ATOM 9054 C CG1 . ILE D 1 130 ? 97.384 -1.925 47.915 1.00 91.93 ? 211 ILE D CG1 1 ATOM 9055 C CG2 . ILE D 1 130 ? 95.955 -3.932 48.325 1.00 87.12 ? 211 ILE D CG2 1 ATOM 9056 C CD1 . ILE D 1 130 ? 96.695 -0.722 47.383 1.00 107.82 ? 211 ILE D CD1 1 ATOM 9057 N N . THR D 1 131 ? 100.154 -3.883 48.001 1.00 70.11 ? 212 THR D N 1 ATOM 9058 C CA . THR D 1 131 ? 101.211 -4.231 48.954 1.00 70.52 ? 212 THR D CA 1 ATOM 9059 C C . THR D 1 131 ? 101.526 -3.089 49.920 1.00 73.18 ? 212 THR D C 1 ATOM 9060 O O . THR D 1 131 ? 102.159 -3.312 50.954 1.00 78.37 ? 212 THR D O 1 ATOM 9061 C CB . THR D 1 131 ? 102.516 -4.675 48.246 1.00 76.61 ? 212 THR D CB 1 ATOM 9062 O OG1 . THR D 1 131 ? 102.872 -3.715 47.241 1.00 90.13 ? 212 THR D OG1 1 ATOM 9063 C CG2 . THR D 1 131 ? 102.343 -6.024 47.595 1.00 69.76 ? 212 THR D CG2 1 ATOM 9064 N N . ASP D 1 132 ? 101.089 -1.877 49.577 1.00 73.94 ? 213 ASP D N 1 ATOM 9065 C CA . ASP D 1 132 ? 101.269 -0.718 50.455 1.00 78.31 ? 213 ASP D CA 1 ATOM 9066 C C . ASP D 1 132 ? 100.431 0.492 50.047 1.00 75.75 ? 213 ASP D C 1 ATOM 9067 O O . ASP D 1 132 ? 100.000 0.604 48.905 1.00 77.72 ? 213 ASP D O 1 ATOM 9068 C CB . ASP D 1 132 ? 102.743 -0.321 50.510 1.00 76.39 ? 213 ASP D CB 1 ATOM 9069 C CG . ASP D 1 132 ? 103.221 -0.122 51.918 1.00 93.44 ? 213 ASP D CG 1 ATOM 9070 O OD1 . ASP D 1 132 ? 102.412 0.354 52.751 1.00 100.10 ? 213 ASP D OD1 1 ATOM 9071 O OD2 . ASP D 1 132 ? 104.393 -0.447 52.199 1.00 105.02 ? 213 ASP D OD2 1 ATOM 9072 N N . THR D 1 133 ? 100.197 1.386 50.996 1.00 76.90 ? 214 THR D N 1 ATOM 9073 C CA . THR D 1 133 ? 99.582 2.668 50.705 1.00 77.26 ? 214 THR D CA 1 ATOM 9074 C C . THR D 1 133 ? 100.482 3.759 51.266 1.00 86.37 ? 214 THR D C 1 ATOM 9075 O O . THR D 1 133 ? 101.159 3.571 52.281 1.00 83.12 ? 214 THR D O 1 ATOM 9076 C CB . THR D 1 133 ? 98.154 2.803 51.299 1.00 96.15 ? 214 THR D CB 1 ATOM 9077 O OG1 . THR D 1 133 ? 98.058 2.066 52.527 1.00 94.96 ? 214 THR D OG1 1 ATOM 9078 C CG2 . THR D 1 133 ? 97.115 2.286 50.323 1.00 84.21 ? 214 THR D CG2 1 ATOM 9079 N N . ILE D 1 134 ? 100.495 4.898 50.590 1.00 83.72 ? 215 ILE D N 1 ATOM 9080 C CA . ILE D 1 134 ? 101.247 6.057 51.038 1.00 80.59 ? 215 ILE D CA 1 ATOM 9081 C C . ILE D 1 134 ? 100.267 7.229 51.080 1.00 81.47 ? 215 ILE D C 1 ATOM 9082 O O . ILE D 1 134 ? 99.472 7.419 50.154 1.00 75.80 ? 215 ILE D O 1 ATOM 9083 C CB . ILE D 1 134 ? 102.421 6.341 50.084 1.00 80.13 ? 215 ILE D CB 1 ATOM 9084 C CG1 . ILE D 1 134 ? 103.471 5.233 50.207 1.00 80.11 ? 215 ILE D CG1 1 ATOM 9085 C CG2 . ILE D 1 134 ? 103.047 7.679 50.380 1.00 84.89 ? 215 ILE D CG2 1 ATOM 9086 C CD1 . ILE D 1 134 ? 104.520 5.261 49.104 1.00 75.62 ? 215 ILE D CD1 1 ATOM 9087 N N . HIS D 1 135 ? 100.291 8.000 52.161 1.00 78.22 ? 216 HIS D N 1 ATOM 9088 C CA . HIS D 1 135 ? 99.308 9.060 52.309 1.00 77.66 ? 216 HIS D CA 1 ATOM 9089 C C . HIS D 1 135 ? 99.957 10.431 52.417 1.00 90.45 ? 216 HIS D C 1 ATOM 9090 O O . HIS D 1 135 ? 101.075 10.563 52.916 1.00 100.08 ? 216 HIS D O 1 ATOM 9091 C CB . HIS D 1 135 ? 98.390 8.776 53.499 1.00 68.27 ? 216 HIS D CB 1 ATOM 9092 C CG . HIS D 1 135 ? 97.523 7.567 53.311 1.00 78.65 ? 216 HIS D CG 1 ATOM 9093 N ND1 . HIS D 1 135 ? 96.251 7.640 52.783 1.00 84.09 ? 216 HIS D ND1 1 ATOM 9094 C CD2 . HIS D 1 135 ? 97.752 6.259 53.572 1.00 76.46 ? 216 HIS D CD2 1 ATOM 9095 C CE1 . HIS D 1 135 ? 95.731 6.426 52.736 1.00 85.26 ? 216 HIS D CE1 1 ATOM 9096 N NE2 . HIS D 1 135 ? 96.618 5.570 53.204 1.00 82.44 ? 216 HIS D NE2 1 ATOM 9097 N N . PRO D 1 136 ? 99.262 11.455 51.906 1.00 89.24 ? 217 PRO D N 1 ATOM 9098 C CA . PRO D 1 136 ? 99.696 12.849 52.026 1.00 86.64 ? 217 PRO D CA 1 ATOM 9099 C C . PRO D 1 136 ? 99.801 13.302 53.482 1.00 103.90 ? 217 PRO D C 1 ATOM 9100 O O . PRO D 1 136 ? 98.894 13.032 54.275 1.00 108.49 ? 217 PRO D O 1 ATOM 9101 C CB . PRO D 1 136 ? 98.568 13.621 51.331 1.00 81.91 ? 217 PRO D CB 1 ATOM 9102 C CG . PRO D 1 136 ? 97.400 12.672 51.287 1.00 84.64 ? 217 PRO D CG 1 ATOM 9103 C CD . PRO D 1 136 ? 98.014 11.326 51.133 1.00 78.93 ? 217 PRO D CD 1 ATOM 9104 N N . THR D 1 137 ? 100.906 13.964 53.820 1.00 113.43 ? 218 THR D N 1 ATOM 9105 C CA . THR D 1 137 ? 101.034 14.679 55.088 1.00 114.44 ? 218 THR D CA 1 ATOM 9106 C C . THR D 1 137 ? 100.963 16.178 54.811 1.00 120.52 ? 218 THR D C 1 ATOM 9107 O O . THR D 1 137 ? 100.104 16.891 55.341 1.00 115.20 ? 218 THR D O 1 ATOM 9108 C CB . THR D 1 137 ? 102.382 14.379 55.785 1.00 107.69 ? 218 THR D CB 1 ATOM 9109 O OG1 . THR D 1 137 ? 103.443 15.094 55.132 1.00 110.20 ? 218 THR D OG1 1 ATOM 9110 C CG2 . THR D 1 137 ? 102.685 12.888 55.757 1.00 93.15 ? 218 THR D CG2 1 ATOM 9111 N N . ASN D 1 138 ? 101.877 16.625 53.951 1.00 127.24 ? 219 ASN D N 1 ATOM 9112 C CA . ASN D 1 138 ? 102.073 18.032 53.606 1.00 128.85 ? 219 ASN D CA 1 ATOM 9113 C C . ASN D 1 138 ? 101.026 18.622 52.645 1.00 115.85 ? 219 ASN D C 1 ATOM 9114 O O . ASN D 1 138 ? 101.377 19.287 51.663 1.00 112.19 ? 219 ASN D O 1 ATOM 9115 C CB . ASN D 1 138 ? 103.489 18.247 53.026 1.00 131.54 ? 219 ASN D CB 1 ATOM 9116 C CG . ASN D 1 138 ? 104.560 18.379 54.107 1.00 130.06 ? 219 ASN D CG 1 ATOM 9117 O OD1 . ASN D 1 138 ? 105.656 17.818 53.990 1.00 127.26 ? 219 ASN D OD1 1 ATOM 9118 N ND2 . ASN D 1 138 ? 104.249 19.136 55.159 1.00 121.30 ? 219 ASN D ND2 1 ATOM 9119 N N . GLY D 1 139 ? 99.749 18.381 52.929 1.00 109.96 ? 220 GLY D N 1 ATOM 9120 C CA . GLY D 1 139 ? 98.668 19.001 52.178 1.00 110.08 ? 220 GLY D CA 1 ATOM 9121 C C . GLY D 1 139 ? 97.932 18.105 51.192 1.00 102.55 ? 220 GLY D C 1 ATOM 9122 O O . GLY D 1 139 ? 96.696 18.169 51.074 1.00 92.65 ? 220 GLY D O 1 ATOM 9123 N N . GLY D 1 140 ? 98.685 17.274 50.473 1.00 96.47 ? 221 GLY D N 1 ATOM 9124 C CA . GLY D 1 140 ? 98.126 16.525 49.365 1.00 91.45 ? 221 GLY D CA 1 ATOM 9125 C C . GLY D 1 140 ? 97.760 17.454 48.224 1.00 100.70 ? 221 GLY D C 1 ATOM 9126 O O . GLY D 1 140 ? 97.985 18.664 48.301 1.00 113.19 ? 221 GLY D O 1 ATOM 9127 N N . PRO D 1 141 ? 97.273 16.889 47.114 1.00 104.21 ? 222 PRO D N 1 ATOM 9128 C CA . PRO D 1 141 ? 97.317 15.450 46.833 1.00 105.58 ? 222 PRO D CA 1 ATOM 9129 C C . PRO D 1 141 ? 98.750 14.995 46.527 1.00 104.12 ? 222 PRO D C 1 ATOM 9130 O O . PRO D 1 141 ? 99.609 15.827 46.209 1.00 110.37 ? 222 PRO D O 1 ATOM 9131 C CB . PRO D 1 141 ? 96.447 15.315 45.575 1.00 101.63 ? 222 PRO D CB 1 ATOM 9132 C CG . PRO D 1 141 ? 96.459 16.669 44.939 1.00 102.79 ? 222 PRO D CG 1 ATOM 9133 C CD . PRO D 1 141 ? 96.531 17.639 46.083 1.00 110.53 ? 222 PRO D CD 1 ATOM 9134 N N . LEU D 1 142 ? 99.009 13.694 46.635 1.00 93.92 ? 223 LEU D N 1 ATOM 9135 C CA . LEU D 1 142 ? 100.320 13.138 46.270 1.00 87.44 ? 223 LEU D CA 1 ATOM 9136 C C . LEU D 1 142 ? 100.495 13.062 44.747 1.00 86.71 ? 223 LEU D C 1 ATOM 9137 O O . LEU D 1 142 ? 99.507 13.065 43.997 1.00 88.75 ? 223 LEU D O 1 ATOM 9138 C CB . LEU D 1 142 ? 100.540 11.761 46.904 1.00 80.70 ? 223 LEU D CB 1 ATOM 9139 C CG . LEU D 1 142 ? 101.432 11.700 48.147 1.00 75.92 ? 223 LEU D CG 1 ATOM 9140 C CD1 . LEU D 1 142 ? 101.360 13.010 48.850 1.00 68.92 ? 223 LEU D CD1 1 ATOM 9141 C CD2 . LEU D 1 142 ? 101.002 10.585 49.088 1.00 64.35 ? 223 LEU D CD2 1 ATOM 9142 N N . ARG D 1 143 ? 101.747 13.028 44.293 1.00 82.12 ? 224 ARG D N 1 ATOM 9143 C CA . ARG D 1 143 ? 102.042 13.066 42.862 1.00 79.99 ? 224 ARG D CA 1 ATOM 9144 C C . ARG D 1 143 ? 103.168 12.094 42.485 1.00 83.64 ? 224 ARG D C 1 ATOM 9145 O O . ARG D 1 143 ? 104.297 12.213 42.980 1.00 84.24 ? 224 ARG D O 1 ATOM 9146 C CB . ARG D 1 143 ? 102.409 14.499 42.439 1.00 82.19 ? 224 ARG D CB 1 ATOM 9147 C CG . ARG D 1 143 ? 101.267 15.506 42.553 1.00 79.74 ? 224 ARG D CG 1 ATOM 9148 C CD . ARG D 1 143 ? 101.672 16.938 42.189 1.00 80.19 ? 224 ARG D CD 1 ATOM 9149 N NE . ARG D 1 143 ? 102.772 17.466 43.002 1.00 91.82 ? 224 ARG D NE 1 ATOM 9150 C CZ . ARG D 1 143 ? 102.626 18.097 44.166 1.00 97.32 ? 224 ARG D CZ 1 ATOM 9151 N NH1 . ARG D 1 143 ? 101.419 18.273 44.689 1.00 103.13 ? 224 ARG D NH1 1 ATOM 9152 N NH2 . ARG D 1 143 ? 103.692 18.546 44.816 1.00 92.81 ? 224 ARG D NH2 1 ATOM 9153 N N . THR D 1 144 ? 102.863 11.135 41.607 1.00 82.37 ? 225 THR D N 1 ATOM 9154 C CA . THR D 1 144 ? 103.880 10.196 41.110 1.00 76.39 ? 225 THR D CA 1 ATOM 9155 C C . THR D 1 144 ? 104.819 10.885 40.129 1.00 78.53 ? 225 THR D C 1 ATOM 9156 O O . THR D 1 144 ? 104.575 12.028 39.712 1.00 72.67 ? 225 THR D O 1 ATOM 9157 C CB . THR D 1 144 ? 103.263 8.971 40.402 1.00 77.14 ? 225 THR D CB 1 ATOM 9158 O OG1 . THR D 1 144 ? 102.360 9.409 39.376 1.00 82.94 ? 225 THR D OG1 1 ATOM 9159 C CG2 . THR D 1 144 ? 102.524 8.081 41.400 1.00 65.99 ? 225 THR D CG2 1 ATOM 9160 N N . GLN D 1 145 ? 105.883 10.183 39.748 1.00 77.47 ? 226 GLN D N 1 ATOM 9161 C CA . GLN D 1 145 ? 106.883 10.771 38.871 1.00 72.77 ? 226 GLN D CA 1 ATOM 9162 C C . GLN D 1 145 ? 106.484 10.709 37.398 1.00 72.64 ? 226 GLN D C 1 ATOM 9163 O O . GLN D 1 145 ? 107.289 11.075 36.525 1.00 77.31 ? 226 GLN D O 1 ATOM 9164 C CB . GLN D 1 145 ? 108.252 10.137 39.108 1.00 76.30 ? 226 GLN D CB 1 ATOM 9165 C CG . GLN D 1 145 ? 108.339 8.669 38.775 1.00 75.95 ? 226 GLN D CG 1 ATOM 9166 C CD . GLN D 1 145 ? 109.752 8.148 38.925 1.00 81.20 ? 226 GLN D CD 1 ATOM 9167 O OE1 . GLN D 1 145 ? 110.039 7.329 39.796 1.00 78.09 ? 226 GLN D OE1 1 ATOM 9168 N NE2 . GLN D 1 145 ? 110.650 8.633 38.079 1.00 96.12 ? 226 GLN D NE2 1 ATOM 9169 N N . ALA D 1 146 ? 105.249 10.243 37.145 1.00 63.56 ? 227 ALA D N 1 ATOM 9170 C CA . ALA D 1 146 ? 104.615 10.252 35.812 1.00 65.83 ? 227 ALA D CA 1 ATOM 9171 C C . ALA D 1 146 ? 105.469 9.584 34.732 1.00 67.04 ? 227 ALA D C 1 ATOM 9172 O O . ALA D 1 146 ? 105.460 9.986 33.562 1.00 79.13 ? 227 ALA D O 1 ATOM 9173 C CB . ALA D 1 146 ? 104.269 11.676 35.400 1.00 76.66 ? 227 ALA D CB 1 ATOM 9174 N N . SER D 1 147 ? 106.182 8.541 35.129 1.00 60.52 ? 228 SER D N 1 ATOM 9175 C CA . SER D 1 147 ? 107.276 8.033 34.328 1.00 71.64 ? 228 SER D CA 1 ATOM 9176 C C . SER D 1 147 ? 107.742 6.728 34.949 1.00 70.11 ? 228 SER D C 1 ATOM 9177 O O . SER D 1 147 ? 107.387 6.412 36.095 1.00 75.62 ? 228 SER D O 1 ATOM 9178 C CB . SER D 1 147 ? 108.414 9.084 34.290 1.00 75.89 ? 228 SER D CB 1 ATOM 9179 O OG . SER D 1 147 ? 109.694 8.504 34.086 1.00 77.12 ? 228 SER D OG 1 ATOM 9180 N N . SER D 1 148 ? 108.513 5.951 34.200 1.00 61.27 ? 229 SER D N 1 ATOM 9181 C CA . SER D 1 148 ? 108.998 4.691 34.744 1.00 72.77 ? 229 SER D CA 1 ATOM 9182 C C . SER D 1 148 ? 109.863 4.954 35.971 1.00 72.66 ? 229 SER D C 1 ATOM 9183 O O . SER D 1 148 ? 110.809 5.751 35.920 1.00 82.32 ? 229 SER D O 1 ATOM 9184 C CB . SER D 1 148 ? 109.808 3.907 33.708 1.00 73.44 ? 229 SER D CB 1 ATOM 9185 O OG . SER D 1 148 ? 110.467 2.820 34.334 1.00 77.87 ? 229 SER D OG 1 ATOM 9186 N N . CYS D 1 149 ? 109.520 4.312 37.079 1.00 60.38 ? 230 CYS D N 1 ATOM 9187 C CA . CYS D 1 149 ? 110.440 4.262 38.207 1.00 70.76 ? 230 CYS D CA 1 ATOM 9188 C C . CYS D 1 149 ? 111.549 3.261 37.878 1.00 79.73 ? 230 CYS D C 1 ATOM 9189 O O . CYS D 1 149 ? 111.511 2.613 36.821 1.00 72.51 ? 230 CYS D O 1 ATOM 9190 C CB . CYS D 1 149 ? 109.721 3.922 39.514 1.00 66.75 ? 230 CYS D CB 1 ATOM 9191 S SG . CYS D 1 149 ? 108.641 2.463 39.477 1.00 78.86 ? 230 CYS D SG 1 ATOM 9192 N N . ILE D 1 150 ? 112.547 3.156 38.752 1.00 78.05 ? 231 ILE D N 1 ATOM 9193 C CA . ILE D 1 150 ? 113.748 2.390 38.420 1.00 75.09 ? 231 ILE D CA 1 ATOM 9194 C C . ILE D 1 150 ? 113.929 1.213 39.356 1.00 72.53 ? 231 ILE D C 1 ATOM 9195 O O . ILE D 1 150 ? 113.842 1.358 40.571 1.00 81.39 ? 231 ILE D O 1 ATOM 9196 C CB . ILE D 1 150 ? 115.032 3.268 38.453 1.00 80.79 ? 231 ILE D CB 1 ATOM 9197 C CG1 . ILE D 1 150 ? 114.942 4.438 37.452 1.00 82.25 ? 231 ILE D CG1 1 ATOM 9198 C CG2 . ILE D 1 150 ? 116.280 2.417 38.212 1.00 67.23 ? 231 ILE D CG2 1 ATOM 9199 C CD1 . ILE D 1 150 ? 114.658 4.034 36.000 1.00 77.88 ? 231 ILE D CD1 1 ATOM 9200 N N . CYS D 1 151 ? 114.169 0.042 38.780 1.00 72.91 ? 232 CYS D N 1 ATOM 9201 C CA . CYS D 1 151 ? 114.439 -1.155 39.559 1.00 75.94 ? 232 CYS D CA 1 ATOM 9202 C C . CYS D 1 151 ? 115.828 -1.668 39.227 1.00 80.65 ? 232 CYS D C 1 ATOM 9203 O O . CYS D 1 151 ? 116.250 -1.640 38.071 1.00 80.31 ? 232 CYS D O 1 ATOM 9204 C CB . CYS D 1 151 ? 113.408 -2.246 39.257 1.00 80.01 ? 232 CYS D CB 1 ATOM 9205 S SG . CYS D 1 151 ? 111.751 -1.888 39.851 1.00 93.34 ? 232 CYS D SG 1 ATOM 9206 N N . ASN D 1 152 ? 116.540 -2.126 40.249 1.00 92.29 ? 233 ASN D N 1 ATOM 9207 C CA . ASN D 1 152 ? 117.814 -2.796 40.042 1.00 96.18 ? 233 ASN D CA 1 ATOM 9208 C C . ASN D 1 152 ? 118.074 -3.763 41.184 1.00 99.48 ? 233 ASN D C 1 ATOM 9209 O O . ASN D 1 152 ? 117.976 -3.389 42.360 1.00 101.03 ? 233 ASN D O 1 ATOM 9210 C CB . ASN D 1 152 ? 118.967 -1.784 39.922 1.00 95.20 ? 233 ASN D CB 1 ATOM 9211 C CG . ASN D 1 152 ? 120.163 -2.338 39.148 1.00 96.87 ? 233 ASN D CG 1 ATOM 9212 O OD1 . ASN D 1 152 ? 120.008 -3.141 38.225 1.00 103.68 ? 233 ASN D OD1 1 ATOM 9213 N ND2 . ASN D 1 152 ? 121.360 -1.907 39.524 1.00 89.55 ? 233 ASN D ND2 1 ATOM 9214 N N . ASP D 1 153 ? 118.366 -5.010 40.828 1.00 98.78 ? 234 ASP D N 1 ATOM 9215 C CA . ASP D 1 153 ? 118.840 -6.005 41.783 1.00 103.21 ? 234 ASP D CA 1 ATOM 9216 C C . ASP D 1 153 ? 117.798 -6.353 42.847 1.00 95.99 ? 234 ASP D C 1 ATOM 9217 O O . ASP D 1 153 ? 118.131 -6.571 44.017 1.00 87.76 ? 234 ASP D O 1 ATOM 9218 C CB . ASP D 1 153 ? 120.138 -5.520 42.435 1.00 119.71 ? 234 ASP D CB 1 ATOM 9219 C CG . ASP D 1 153 ? 121.159 -6.624 42.591 1.00 130.84 ? 234 ASP D CG 1 ATOM 9220 O OD1 . ASP D 1 153 ? 120.899 -7.746 42.102 1.00 125.30 ? 234 ASP D OD1 1 ATOM 9221 O OD2 . ASP D 1 153 ? 122.228 -6.363 43.191 1.00 138.78 ? 234 ASP D OD2 1 ATOM 9222 N N . GLY D 1 154 ? 116.536 -6.407 42.434 1.00 92.48 ? 235 GLY D N 1 ATOM 9223 C CA . GLY D 1 154 ? 115.457 -6.774 43.334 1.00 88.03 ? 235 GLY D CA 1 ATOM 9224 C C . GLY D 1 154 ? 114.797 -5.585 44.009 1.00 84.09 ? 235 GLY D C 1 ATOM 9225 O O . GLY D 1 154 ? 113.711 -5.712 44.586 1.00 86.68 ? 235 GLY D O 1 ATOM 9226 N N . THR D 1 155 ? 115.439 -4.424 43.914 1.00 78.29 ? 236 THR D N 1 ATOM 9227 C CA . THR D 1 155 ? 115.008 -3.244 44.660 1.00 79.52 ? 236 THR D CA 1 ATOM 9228 C C . THR D 1 155 ? 114.577 -2.098 43.727 1.00 77.58 ? 236 THR D C 1 ATOM 9229 O O . THR D 1 155 ? 115.198 -1.863 42.684 1.00 75.87 ? 236 THR D O 1 ATOM 9230 C CB . THR D 1 155 ? 116.133 -2.783 45.612 1.00 86.11 ? 236 THR D CB 1 ATOM 9231 O OG1 . THR D 1 155 ? 116.816 -3.936 46.136 1.00 94.21 ? 236 THR D OG1 1 ATOM 9232 C CG2 . THR D 1 155 ? 115.574 -1.955 46.751 1.00 78.76 ? 236 THR D CG2 1 ATOM 9233 N N . CYS D 1 156 ? 113.512 -1.390 44.101 1.00 73.57 ? 237 CYS D N 1 ATOM 9234 C CA . CYS D 1 156 ? 112.957 -0.322 43.257 1.00 67.87 ? 237 CYS D CA 1 ATOM 9235 C C . CYS D 1 156 ? 112.946 1.038 43.957 1.00 77.50 ? 237 CYS D C 1 ATOM 9236 O O . CYS D 1 156 ? 112.718 1.133 45.164 1.00 91.43 ? 237 CYS D O 1 ATOM 9237 C CB . CYS D 1 156 ? 111.530 -0.670 42.802 1.00 57.35 ? 237 CYS D CB 1 ATOM 9238 S SG . CYS D 1 156 ? 111.368 -2.200 41.823 1.00 108.75 ? 237 CYS D SG 1 ATOM 9239 N N . TYR D 1 157 ? 113.171 2.086 43.175 1.00 72.39 ? 238 TYR D N 1 ATOM 9240 C CA . TYR D 1 157 ? 113.254 3.454 43.685 1.00 70.48 ? 238 TYR D CA 1 ATOM 9241 C C . TYR D 1 157 ? 112.294 4.365 42.918 1.00 73.86 ? 238 TYR D C 1 ATOM 9242 O O . TYR D 1 157 ? 112.185 4.275 41.695 1.00 76.16 ? 238 TYR D O 1 ATOM 9243 C CB . TYR D 1 157 ? 114.698 3.972 43.561 1.00 70.29 ? 238 TYR D CB 1 ATOM 9244 C CG . TYR D 1 157 ? 115.716 2.993 44.113 1.00 84.21 ? 238 TYR D CG 1 ATOM 9245 C CD1 . TYR D 1 157 ? 116.070 3.008 45.466 1.00 87.10 ? 238 TYR D CD1 1 ATOM 9246 C CD2 . TYR D 1 157 ? 116.299 2.030 43.294 1.00 81.33 ? 238 TYR D CD2 1 ATOM 9247 C CE1 . TYR D 1 157 ? 116.985 2.099 45.980 1.00 89.98 ? 238 TYR D CE1 1 ATOM 9248 C CE2 . TYR D 1 157 ? 117.212 1.117 43.800 1.00 93.69 ? 238 TYR D CE2 1 ATOM 9249 C CZ . TYR D 1 157 ? 117.552 1.156 45.142 1.00 100.77 ? 238 TYR D CZ 1 ATOM 9250 O OH . TYR D 1 157 ? 118.463 0.249 45.643 1.00 107.98 ? 238 TYR D OH 1 ATOM 9251 N N . THR D 1 158 ? 111.574 5.221 43.635 1.00 77.01 ? 239 THR D N 1 ATOM 9252 C CA . THR D 1 158 ? 110.723 6.219 42.986 1.00 75.03 ? 239 THR D CA 1 ATOM 9253 C C . THR D 1 158 ? 110.642 7.489 43.823 1.00 75.73 ? 239 THR D C 1 ATOM 9254 O O . THR D 1 158 ? 111.045 7.508 44.990 1.00 90.24 ? 239 THR D O 1 ATOM 9255 C CB . THR D 1 158 ? 109.286 5.683 42.669 1.00 77.00 ? 239 THR D CB 1 ATOM 9256 O OG1 . THR D 1 158 ? 108.501 6.709 42.021 1.00 63.92 ? 239 THR D OG1 1 ATOM 9257 C CG2 . THR D 1 158 ? 108.577 5.208 43.950 1.00 70.31 ? 239 THR D CG2 1 ATOM 9258 N N . ILE D 1 159 ? 110.117 8.547 43.217 1.00 71.59 ? 240 ILE D N 1 ATOM 9259 C CA . ILE D 1 159 ? 110.022 9.832 43.879 1.00 76.51 ? 240 ILE D CA 1 ATOM 9260 C C . ILE D 1 159 ? 108.574 10.315 43.852 1.00 80.15 ? 240 ILE D C 1 ATOM 9261 O O . ILE D 1 159 ? 107.958 10.402 42.791 1.00 80.89 ? 240 ILE D O 1 ATOM 9262 C CB . ILE D 1 159 ? 111.008 10.853 43.232 1.00 86.71 ? 240 ILE D CB 1 ATOM 9263 C CG1 . ILE D 1 159 ? 112.452 10.399 43.471 1.00 85.90 ? 240 ILE D CG1 1 ATOM 9264 C CG2 . ILE D 1 159 ? 110.804 12.268 43.790 1.00 78.18 ? 240 ILE D CG2 1 ATOM 9265 C CD1 . ILE D 1 159 ? 113.426 10.784 42.378 1.00 78.45 ? 240 ILE D CD1 1 ATOM 9266 N N . ILE D 1 160 ? 108.036 10.615 45.032 1.00 87.75 ? 241 ILE D N 1 ATOM 9267 C CA . ILE D 1 160 ? 106.662 11.099 45.177 1.00 86.86 ? 241 ILE D CA 1 ATOM 9268 C C . ILE D 1 160 ? 106.670 12.533 45.713 1.00 77.37 ? 241 ILE D C 1 ATOM 9269 O O . ILE D 1 160 ? 107.496 12.888 46.547 1.00 87.62 ? 241 ILE D O 1 ATOM 9270 C CB . ILE D 1 160 ? 105.841 10.176 46.117 1.00 82.95 ? 241 ILE D CB 1 ATOM 9271 C CG1 . ILE D 1 160 ? 106.011 8.714 45.691 1.00 79.10 ? 241 ILE D CG1 1 ATOM 9272 C CG2 . ILE D 1 160 ? 104.363 10.578 46.149 1.00 70.56 ? 241 ILE D CG2 1 ATOM 9273 C CD1 . ILE D 1 160 ? 105.216 7.736 46.517 1.00 77.42 ? 241 ILE D CD1 1 ATOM 9274 N N . ALA D 1 161 ? 105.748 13.355 45.225 1.00 77.78 ? 242 ALA D N 1 ATOM 9275 C CA . ALA D 1 161 ? 105.707 14.767 45.582 1.00 81.78 ? 242 ALA D CA 1 ATOM 9276 C C . ALA D 1 161 ? 104.471 15.089 46.416 1.00 87.07 ? 242 ALA D C 1 ATOM 9277 O O . ALA D 1 161 ? 103.408 14.509 46.190 1.00 88.45 ? 242 ALA D O 1 ATOM 9278 C CB . ALA D 1 161 ? 105.734 15.623 44.320 1.00 76.06 ? 242 ALA D CB 1 ATOM 9279 N N . ASP D 1 162 ? 104.614 16.013 47.368 1.00 82.70 ? 243 ASP D N 1 ATOM 9280 C CA . ASP D 1 162 ? 103.484 16.543 48.134 1.00 82.58 ? 243 ASP D CA 1 ATOM 9281 C C . ASP D 1 162 ? 103.544 18.077 48.091 1.00 94.82 ? 243 ASP D C 1 ATOM 9282 O O . ASP D 1 162 ? 104.536 18.649 47.622 1.00 90.04 ? 243 ASP D O 1 ATOM 9283 C CB . ASP D 1 162 ? 103.536 16.038 49.584 1.00 85.51 ? 243 ASP D CB 1 ATOM 9284 C CG . ASP D 1 162 ? 102.154 15.985 50.241 1.00 97.78 ? 243 ASP D CG 1 ATOM 9285 O OD1 . ASP D 1 162 ? 101.221 16.666 49.748 1.00 107.85 ? 243 ASP D OD1 1 ATOM 9286 O OD2 . ASP D 1 162 ? 101.999 15.268 51.259 1.00 94.15 ? 243 ASP D OD2 1 ATOM 9287 N N . GLY D 1 163 ? 102.494 18.741 48.572 1.00 103.20 ? 244 GLY D N 1 ATOM 9288 C CA . GLY D 1 163 ? 102.426 20.192 48.514 1.00 100.97 ? 244 GLY D CA 1 ATOM 9289 C C . GLY D 1 163 ? 101.173 20.691 47.814 1.00 112.58 ? 244 GLY D C 1 ATOM 9290 O O . GLY D 1 163 ? 100.726 20.098 46.826 1.00 118.42 ? 244 GLY D O 1 ATOM 9291 N N . THR D 1 164 ? 100.603 21.783 48.323 1.00 112.00 ? 245 THR D N 1 ATOM 9292 C CA . THR D 1 164 ? 99.384 22.351 47.748 1.00 111.71 ? 245 THR D CA 1 ATOM 9293 C C . THR D 1 164 ? 99.716 23.281 46.569 1.00 117.70 ? 245 THR D C 1 ATOM 9294 O O . THR D 1 164 ? 98.861 23.566 45.725 1.00 120.56 ? 245 THR D O 1 ATOM 9295 C CB . THR D 1 164 ? 98.522 23.064 48.829 1.00 101.56 ? 245 THR D CB 1 ATOM 9296 O OG1 . THR D 1 164 ? 99.060 24.359 49.123 1.00 90.30 ? 245 THR D OG1 1 ATOM 9297 C CG2 . THR D 1 164 ? 98.493 22.240 50.111 1.00 108.51 ? 245 THR D CG2 1 ATOM 9298 N N . THR D 1 165 ? 100.968 23.735 46.513 1.00 116.98 ? 246 THR D N 1 ATOM 9299 C CA . THR D 1 165 ? 101.475 24.483 45.360 1.00 118.03 ? 246 THR D CA 1 ATOM 9300 C C . THR D 1 165 ? 102.981 24.270 45.166 1.00 115.07 ? 246 THR D C 1 ATOM 9301 O O . THR D 1 165 ? 103.686 23.871 46.106 1.00 114.87 ? 246 THR D O 1 ATOM 9302 C CB . THR D 1 165 ? 101.167 25.994 45.468 1.00 130.43 ? 246 THR D CB 1 ATOM 9303 O OG1 . THR D 1 165 ? 101.780 26.689 44.371 1.00 136.30 ? 246 THR D OG1 1 ATOM 9304 C CG2 . THR D 1 165 ? 101.686 26.557 46.785 1.00 81.12 ? 246 THR D CG2 1 ATOM 9305 N N . TYR D 1 166 ? 103.461 24.550 43.952 1.00 110.28 ? 247 TYR D N 1 ATOM 9306 C CA . TYR D 1 166 ? 104.856 24.297 43.574 1.00 115.71 ? 247 TYR D CA 1 ATOM 9307 C C . TYR D 1 166 ? 105.890 25.168 44.297 1.00 117.54 ? 247 TYR D C 1 ATOM 9308 O O . TYR D 1 166 ? 107.087 24.860 44.278 1.00 112.47 ? 247 TYR D O 1 ATOM 9309 C CB . TYR D 1 166 ? 105.045 24.401 42.056 1.00 127.81 ? 247 TYR D CB 1 ATOM 9310 C CG . TYR D 1 166 ? 104.359 25.589 41.414 1.00 148.43 ? 247 TYR D CG 1 ATOM 9311 C CD1 . TYR D 1 166 ? 104.979 26.833 41.351 1.00 154.56 ? 247 TYR D CD1 1 ATOM 9312 C CD2 . TYR D 1 166 ? 103.091 25.462 40.862 1.00 156.03 ? 247 TYR D CD2 1 ATOM 9313 C CE1 . TYR D 1 166 ? 104.348 27.921 40.758 1.00 156.07 ? 247 TYR D CE1 1 ATOM 9314 C CE2 . TYR D 1 166 ? 102.453 26.541 40.269 1.00 157.89 ? 247 TYR D CE2 1 ATOM 9315 C CZ . TYR D 1 166 ? 103.086 27.769 40.219 1.00 157.94 ? 247 TYR D CZ 1 ATOM 9316 O OH . TYR D 1 166 ? 102.461 28.848 39.630 1.00 158.55 ? 247 TYR D OH 1 ATOM 9317 N N . THR D 1 167 ? 105.442 26.256 44.917 1.00 120.01 ? 248 THR D N 1 ATOM 9318 C CA . THR D 1 167 ? 106.331 27.029 45.776 1.00 121.30 ? 248 THR D CA 1 ATOM 9319 C C . THR D 1 167 ? 106.735 26.142 46.945 1.00 130.33 ? 248 THR D C 1 ATOM 9320 O O . THR D 1 167 ? 107.894 25.756 47.084 1.00 138.93 ? 248 THR D O 1 ATOM 9321 C CB . THR D 1 167 ? 105.654 28.292 46.335 1.00 108.11 ? 248 THR D CB 1 ATOM 9322 O OG1 . THR D 1 167 ? 104.710 27.922 47.347 1.00 111.15 ? 248 THR D OG1 1 ATOM 9323 C CG2 . THR D 1 167 ? 104.942 29.062 45.234 1.00 94.45 ? 248 THR D CG2 1 ATOM 9324 N N . ALA D 1 168 ? 105.750 25.811 47.771 1.00 124.52 ? 249 ALA D N 1 ATOM 9325 C CA . ALA D 1 168 ? 105.960 24.977 48.941 1.00 113.54 ? 249 ALA D CA 1 ATOM 9326 C C . ALA D 1 168 ? 105.679 23.510 48.628 1.00 110.88 ? 249 ALA D C 1 ATOM 9327 O O . ALA D 1 168 ? 104.725 22.929 49.152 1.00 106.05 ? 249 ALA D O 1 ATOM 9328 C CB . ALA D 1 168 ? 105.074 25.451 50.087 1.00 105.76 ? 249 ALA D CB 1 ATOM 9329 N N . SER D 1 169 ? 106.507 22.916 47.771 1.00 107.34 ? 250 SER D N 1 ATOM 9330 C CA . SER D 1 169 ? 106.408 21.482 47.484 1.00 108.53 ? 250 SER D CA 1 ATOM 9331 C C . SER D 1 169 ? 107.498 20.657 48.185 1.00 108.56 ? 250 SER D C 1 ATOM 9332 O O . SER D 1 169 ? 108.668 21.048 48.228 1.00 110.64 ? 250 SER D O 1 ATOM 9333 C CB . SER D 1 169 ? 106.412 21.208 45.971 1.00 94.05 ? 250 SER D CB 1 ATOM 9334 O OG . SER D 1 169 ? 107.675 21.478 45.390 1.00 90.18 ? 250 SER D OG 1 ATOM 9335 N N . SER D 1 170 ? 107.088 19.518 48.738 1.00 100.64 ? 251 SER D N 1 ATOM 9336 C CA . SER D 1 170 ? 107.995 18.553 49.356 1.00 95.72 ? 251 SER D CA 1 ATOM 9337 C C . SER D 1 170 ? 108.234 17.359 48.416 1.00 94.21 ? 251 SER D C 1 ATOM 9338 O O . SER D 1 170 ? 107.342 16.973 47.648 1.00 82.32 ? 251 SER D O 1 ATOM 9339 C CB . SER D 1 170 ? 107.401 18.064 50.672 1.00 95.81 ? 251 SER D CB 1 ATOM 9340 O OG . SER D 1 170 ? 108.049 16.886 51.109 1.00 108.42 ? 251 SER D OG 1 ATOM 9341 N N . HIS D 1 171 ? 109.432 16.775 48.466 1.00 97.40 ? 252 HIS D N 1 ATOM 9342 C CA . HIS D 1 171 ? 109.731 15.599 47.635 1.00 88.78 ? 252 HIS D CA 1 ATOM 9343 C C . HIS D 1 171 ? 110.424 14.473 48.397 1.00 92.38 ? 252 HIS D C 1 ATOM 9344 O O . HIS D 1 171 ? 111.489 14.658 48.988 1.00 95.09 ? 252 HIS D O 1 ATOM 9345 C CB . HIS D 1 171 ? 110.544 15.983 46.395 1.00 84.11 ? 252 HIS D CB 1 ATOM 9346 C CG . HIS D 1 171 ? 109.881 17.030 45.553 1.00 91.55 ? 252 HIS D CG 1 ATOM 9347 N ND1 . HIS D 1 171 ? 110.106 18.375 45.729 1.00 89.31 ? 252 HIS D ND1 1 ATOM 9348 C CD2 . HIS D 1 171 ? 108.970 16.919 44.558 1.00 97.94 ? 252 HIS D CD2 1 ATOM 9349 C CE1 . HIS D 1 171 ? 109.373 19.058 44.861 1.00 94.40 ? 252 HIS D CE1 1 ATOM 9350 N NE2 . HIS D 1 171 ? 108.676 18.197 44.145 1.00 101.36 ? 252 HIS D NE2 1 ATOM 9351 N N . ARG D 1 172 ? 109.803 13.299 48.382 1.00 100.81 ? 253 ARG D N 1 ATOM 9352 C CA . ARG D 1 172 ? 110.371 12.138 49.055 1.00 97.71 ? 253 ARG D CA 1 ATOM 9353 C C . ARG D 1 172 ? 110.887 11.085 48.078 1.00 93.99 ? 253 ARG D C 1 ATOM 9354 O O . ARG D 1 172 ? 110.315 10.863 47.007 1.00 91.97 ? 253 ARG D O 1 ATOM 9355 C CB . ARG D 1 172 ? 109.361 11.513 50.018 1.00 88.99 ? 253 ARG D CB 1 ATOM 9356 C CG . ARG D 1 172 ? 108.947 12.423 51.142 1.00 102.51 ? 253 ARG D CG 1 ATOM 9357 C CD . ARG D 1 172 ? 108.277 11.636 52.229 1.00 110.01 ? 253 ARG D CD 1 ATOM 9358 N NE . ARG D 1 172 ? 107.839 12.481 53.334 1.00 112.95 ? 253 ARG D NE 1 ATOM 9359 C CZ . ARG D 1 172 ? 107.274 12.010 54.442 1.00 113.68 ? 253 ARG D CZ 1 ATOM 9360 N NH1 . ARG D 1 172 ? 107.083 10.701 54.582 1.00 113.67 ? 253 ARG D NH1 1 ATOM 9361 N NH2 . ARG D 1 172 ? 106.895 12.840 55.406 1.00 106.90 ? 253 ARG D NH2 1 ATOM 9362 N N . LEU D 1 173 ? 111.981 10.444 48.472 1.00 93.79 ? 254 LEU D N 1 ATOM 9363 C CA . LEU D 1 173 ? 112.585 9.364 47.707 1.00 93.49 ? 254 LEU D CA 1 ATOM 9364 C C . LEU D 1 173 ? 112.287 8.019 48.382 1.00 92.18 ? 254 LEU D C 1 ATOM 9365 O O . LEU D 1 173 ? 112.710 7.788 49.519 1.00 78.87 ? 254 LEU D O 1 ATOM 9366 C CB . LEU D 1 173 ? 114.094 9.599 47.615 1.00 87.54 ? 254 LEU D CB 1 ATOM 9367 C CG . LEU D 1 173 ? 114.981 8.543 46.957 1.00 83.88 ? 254 LEU D CG 1 ATOM 9368 C CD1 . LEU D 1 173 ? 114.471 8.211 45.562 1.00 76.26 ? 254 LEU D CD1 1 ATOM 9369 C CD2 . LEU D 1 173 ? 116.418 9.037 46.904 1.00 68.94 ? 254 LEU D CD2 1 ATOM 9370 N N . TYR D 1 174 ? 111.560 7.136 47.691 1.00 85.09 ? 255 TYR D N 1 ATOM 9371 C CA . TYR D 1 174 ? 111.183 5.839 48.273 1.00 78.88 ? 255 TYR D CA 1 ATOM 9372 C C . TYR D 1 174 ? 112.027 4.653 47.797 1.00 83.57 ? 255 TYR D C 1 ATOM 9373 O O . TYR D 1 174 ? 112.439 4.601 46.635 1.00 98.06 ? 255 TYR D O 1 ATOM 9374 C CB . TYR D 1 174 ? 109.704 5.555 48.031 1.00 65.49 ? 255 TYR D CB 1 ATOM 9375 C CG . TYR D 1 174 ? 108.802 6.395 48.890 1.00 79.95 ? 255 TYR D CG 1 ATOM 9376 C CD1 . TYR D 1 174 ? 108.487 7.705 48.532 1.00 88.94 ? 255 TYR D CD1 1 ATOM 9377 C CD2 . TYR D 1 174 ? 108.273 5.888 50.067 1.00 86.03 ? 255 TYR D CD2 1 ATOM 9378 C CE1 . TYR D 1 174 ? 107.658 8.482 49.325 1.00 94.07 ? 255 TYR D CE1 1 ATOM 9379 C CE2 . TYR D 1 174 ? 107.445 6.656 50.869 1.00 93.32 ? 255 TYR D CE2 1 ATOM 9380 C CZ . TYR D 1 174 ? 107.141 7.952 50.499 1.00 92.96 ? 255 TYR D CZ 1 ATOM 9381 O OH . TYR D 1 174 ? 106.318 8.707 51.310 1.00 85.11 ? 255 TYR D OH 1 ATOM 9382 N N . ARG D 1 175 ? 112.298 3.720 48.711 1.00 68.74 ? 256 ARG D N 1 ATOM 9383 C CA . ARG D 1 175 ? 112.908 2.436 48.365 1.00 80.08 ? 256 ARG D CA 1 ATOM 9384 C C . ARG D 1 175 ? 111.880 1.326 48.561 1.00 86.14 ? 256 ARG D C 1 ATOM 9385 O O . ARG D 1 175 ? 111.273 1.202 49.632 1.00 87.98 ? 256 ARG D O 1 ATOM 9386 C CB . ARG D 1 175 ? 114.167 2.144 49.195 1.00 88.81 ? 256 ARG D CB 1 ATOM 9387 C CG . ARG D 1 175 ? 114.609 0.671 49.131 1.00 90.21 ? 256 ARG D CG 1 ATOM 9388 C CD . ARG D 1 175 ? 116.023 0.406 49.657 1.00 82.46 ? 256 ARG D CD 1 ATOM 9389 N NE . ARG D 1 175 ? 116.227 0.894 51.015 1.00 91.86 ? 256 ARG D NE 1 ATOM 9390 C CZ . ARG D 1 175 ? 117.107 1.838 51.333 1.00 107.58 ? 256 ARG D CZ 1 ATOM 9391 N NH1 . ARG D 1 175 ? 117.859 2.384 50.384 1.00 107.66 ? 256 ARG D NH1 1 ATOM 9392 N NH2 . ARG D 1 175 ? 117.241 2.236 52.595 1.00 120.17 ? 256 ARG D NH2 1 ATOM 9393 N N . LEU D 1 176 ? 111.682 0.525 47.518 1.00 89.36 ? 257 LEU D N 1 ATOM 9394 C CA . LEU D 1 176 ? 110.692 -0.543 47.558 1.00 87.13 ? 257 LEU D CA 1 ATOM 9395 C C . LEU D 1 176 ? 111.321 -1.894 47.302 1.00 82.72 ? 257 LEU D C 1 ATOM 9396 O O . LEU D 1 176 ? 112.223 -2.022 46.469 1.00 85.58 ? 257 LEU D O 1 ATOM 9397 C CB . LEU D 1 176 ? 109.605 -0.304 46.510 1.00 84.33 ? 257 LEU D CB 1 ATOM 9398 C CG . LEU D 1 176 ? 108.974 1.085 46.495 1.00 86.40 ? 257 LEU D CG 1 ATOM 9399 C CD1 . LEU D 1 176 ? 107.921 1.197 45.396 1.00 72.87 ? 257 LEU D CD1 1 ATOM 9400 C CD2 . LEU D 1 176 ? 108.381 1.415 47.856 1.00 77.86 ? 257 LEU D CD2 1 ATOM 9401 N N . VAL D 1 177 ? 110.842 -2.903 48.019 1.00 74.12 ? 258 VAL D N 1 ATOM 9402 C CA . VAL D 1 177 ? 111.184 -4.285 47.697 1.00 68.22 ? 258 VAL D CA 1 ATOM 9403 C C . VAL D 1 177 ? 109.911 -5.130 47.682 1.00 61.66 ? 258 VAL D C 1 ATOM 9404 O O . VAL D 1 177 ? 109.131 -5.114 48.638 1.00 69.52 ? 258 VAL D O 1 ATOM 9405 C CB . VAL D 1 177 ? 112.299 -4.855 48.625 1.00 66.28 ? 258 VAL D CB 1 ATOM 9406 C CG1 . VAL D 1 177 ? 112.280 -4.160 49.970 1.00 73.47 ? 258 VAL D CG1 1 ATOM 9407 C CG2 . VAL D 1 177 ? 112.177 -6.363 48.769 1.00 63.82 ? 258 VAL D CG2 1 ATOM 9408 N N . ASN D 1 178 ? 109.693 -5.828 46.567 1.00 72.73 ? 259 ASN D N 1 ATOM 9409 C CA . ASN D 1 178 ? 108.484 -6.624 46.352 1.00 75.37 ? 259 ASN D CA 1 ATOM 9410 C C . ASN D 1 178 ? 107.184 -5.884 46.660 1.00 71.52 ? 259 ASN D C 1 ATOM 9411 O O . ASN D 1 178 ? 106.229 -6.474 47.160 1.00 80.20 ? 259 ASN D O 1 ATOM 9412 C CB . ASN D 1 178 ? 108.529 -7.940 47.145 1.00 68.33 ? 259 ASN D CB 1 ATOM 9413 C CG . ASN D 1 178 ? 109.629 -8.872 46.673 1.00 81.48 ? 259 ASN D CG 1 ATOM 9414 O OD1 . ASN D 1 178 ? 110.381 -8.548 45.751 1.00 90.91 ? 259 ASN D OD1 1 ATOM 9415 N ND2 . ASN D 1 178 ? 109.736 -10.033 47.318 1.00 91.18 ? 259 ASN D ND2 1 ATOM 9416 N N . GLY D 1 179 ? 107.151 -4.592 46.364 1.00 65.34 ? 260 GLY D N 1 ATOM 9417 C CA . GLY D 1 179 ? 105.939 -3.815 46.545 1.00 66.50 ? 260 GLY D CA 1 ATOM 9418 C C . GLY D 1 179 ? 105.819 -3.096 47.881 1.00 78.21 ? 260 GLY D C 1 ATOM 9419 O O . GLY D 1 179 ? 104.889 -2.311 48.086 1.00 79.35 ? 260 GLY D O 1 ATOM 9420 N N . THR D 1 180 ? 106.754 -3.349 48.790 1.00 79.39 ? 261 THR D N 1 ATOM 9421 C CA . THR D 1 180 ? 106.662 -2.781 50.135 1.00 89.55 ? 261 THR D CA 1 ATOM 9422 C C . THR D 1 180 ? 107.676 -1.645 50.393 1.00 88.41 ? 261 THR D C 1 ATOM 9423 O O . THR D 1 180 ? 108.816 -1.707 49.909 1.00 91.50 ? 261 THR D O 1 ATOM 9424 C CB . THR D 1 180 ? 106.791 -3.892 51.197 1.00 98.45 ? 261 THR D CB 1 ATOM 9425 O OG1 . THR D 1 180 ? 105.821 -4.915 50.926 1.00 102.32 ? 261 THR D OG1 1 ATOM 9426 C CG2 . THR D 1 180 ? 106.569 -3.330 52.600 1.00 94.13 ? 261 THR D CG2 1 ATOM 9427 N N . SER D 1 181 ? 107.250 -0.605 51.125 1.00 72.21 ? 262 SER D N 1 ATOM 9428 C CA . SER D 1 181 ? 108.149 0.491 51.523 1.00 84.51 ? 262 SER D CA 1 ATOM 9429 C C . SER D 1 181 ? 109.277 -0.019 52.409 1.00 81.49 ? 262 SER D C 1 ATOM 9430 O O . SER D 1 181 ? 109.027 -0.604 53.460 1.00 80.20 ? 262 SER D O 1 ATOM 9431 C CB . SER D 1 181 ? 107.393 1.600 52.262 1.00 89.69 ? 262 SER D CB 1 ATOM 9432 O OG . SER D 1 181 ? 107.078 2.682 51.399 1.00 92.93 ? 262 SER D OG 1 ATOM 9433 N N . ALA D 1 182 ? 110.514 0.187 51.969 1.00 81.40 ? 263 ALA D N 1 ATOM 9434 C CA . ALA D 1 182 ? 111.679 -0.269 52.713 1.00 87.06 ? 263 ALA D CA 1 ATOM 9435 C C . ALA D 1 182 ? 112.392 0.964 53.217 1.00 97.99 ? 263 ALA D C 1 ATOM 9436 O O . ALA D 1 182 ? 113.626 1.036 53.222 1.00 102.55 ? 263 ALA D O 1 ATOM 9437 C CB . ALA D 1 182 ? 112.595 -1.091 51.826 1.00 92.62 ? 263 ALA D CB 1 ATOM 9438 N N . GLY D 1 183 ? 111.593 1.946 53.621 1.00 101.40 ? 264 GLY D N 1 ATOM 9439 C CA . GLY D 1 183 ? 112.116 3.220 54.067 1.00 100.31 ? 264 GLY D CA 1 ATOM 9440 C C . GLY D 1 183 ? 112.273 4.224 52.938 1.00 92.29 ? 264 GLY D C 1 ATOM 9441 O O . GLY D 1 183 ? 112.201 3.883 51.760 1.00 86.92 ? 264 GLY D O 1 ATOM 9442 N N . TRP D 1 184 ? 112.527 5.470 53.313 1.00 93.51 ? 265 TRP D N 1 ATOM 9443 C CA . TRP D 1 184 ? 112.494 6.580 52.380 1.00 81.48 ? 265 TRP D CA 1 ATOM 9444 C C . TRP D 1 184 ? 113.421 7.698 52.874 1.00 91.26 ? 265 TRP D C 1 ATOM 9445 O O . TRP D 1 184 ? 114.090 7.555 53.902 1.00 87.62 ? 265 TRP D O 1 ATOM 9446 C CB . TRP D 1 184 ? 111.059 7.091 52.278 1.00 76.84 ? 265 TRP D CB 1 ATOM 9447 C CG . TRP D 1 184 ? 110.448 7.311 53.639 1.00 92.46 ? 265 TRP D CG 1 ATOM 9448 C CD1 . TRP D 1 184 ? 109.895 6.361 54.459 1.00 97.91 ? 265 TRP D CD1 1 ATOM 9449 C CD2 . TRP D 1 184 ? 110.353 8.553 54.347 1.00 96.91 ? 265 TRP D CD2 1 ATOM 9450 N NE1 . TRP D 1 184 ? 109.459 6.938 55.629 1.00 97.69 ? 265 TRP D NE1 1 ATOM 9451 C CE2 . TRP D 1 184 ? 109.726 8.282 55.586 1.00 99.51 ? 265 TRP D CE2 1 ATOM 9452 C CE3 . TRP D 1 184 ? 110.735 9.869 54.054 1.00 103.45 ? 265 TRP D CE3 1 ATOM 9453 C CZ2 . TRP D 1 184 ? 109.471 9.279 56.531 1.00 99.60 ? 265 TRP D CZ2 1 ATOM 9454 C CZ3 . TRP D 1 184 ? 110.481 10.862 54.993 1.00 106.47 ? 265 TRP D CZ3 1 ATOM 9455 C CH2 . TRP D 1 184 ? 109.854 10.559 56.218 1.00 102.90 ? 265 TRP D CH2 1 ATOM 9456 N N . LYS D 1 185 ? 113.453 8.803 52.136 1.00 90.92 ? 266 LYS D N 1 ATOM 9457 C CA . LYS D 1 185 ? 114.290 9.940 52.488 1.00 103.08 ? 266 LYS D CA 1 ATOM 9458 C C . LYS D 1 185 ? 113.692 11.258 52.002 1.00 107.30 ? 266 LYS D C 1 ATOM 9459 O O . LYS D 1 185 ? 113.148 11.337 50.899 1.00 111.23 ? 266 LYS D O 1 ATOM 9460 C CB . LYS D 1 185 ? 115.698 9.766 51.909 1.00 108.41 ? 266 LYS D CB 1 ATOM 9461 C CG . LYS D 1 185 ? 116.747 10.654 52.575 1.00 117.18 ? 266 LYS D CG 1 ATOM 9462 C CD . LYS D 1 185 ? 118.121 10.009 52.512 1.00 118.90 ? 266 LYS D CD 1 ATOM 9463 C CE . LYS D 1 185 ? 119.131 10.768 53.354 1.00 121.71 ? 266 LYS D CE 1 ATOM 9464 N NZ . LYS D 1 185 ? 120.474 10.746 52.710 1.00 122.06 ? 266 LYS D NZ 1 ATOM 9465 N N . ALA D 1 186 ? 113.793 12.295 52.828 1.00 103.62 ? 267 ALA D N 1 ATOM 9466 C CA . ALA D 1 186 ? 113.352 13.615 52.409 1.00 102.46 ? 267 ALA D CA 1 ATOM 9467 C C . ALA D 1 186 ? 114.458 14.256 51.582 1.00 107.24 ? 267 ALA D C 1 ATOM 9468 O O . ALA D 1 186 ? 115.644 14.049 51.850 1.00 109.70 ? 267 ALA D O 1 ATOM 9469 C CB . ALA D 1 186 ? 113.008 14.470 53.609 1.00 77.22 ? 267 ALA D CB 1 ATOM 9470 N N . LEU D 1 187 ? 114.073 15.011 50.560 1.00 105.42 ? 268 LEU D N 1 ATOM 9471 C CA . LEU D 1 187 ? 115.056 15.689 49.722 1.00 108.01 ? 268 LEU D CA 1 ATOM 9472 C C . LEU D 1 187 ? 114.974 17.196 49.936 1.00 109.06 ? 268 LEU D C 1 ATOM 9473 O O . LEU D 1 187 ? 113.898 17.791 49.815 1.00 111.59 ? 268 LEU D O 1 ATOM 9474 C CB . LEU D 1 187 ? 114.834 15.368 48.236 1.00 99.04 ? 268 LEU D CB 1 ATOM 9475 C CG . LEU D 1 187 ? 114.751 13.910 47.765 1.00 98.09 ? 268 LEU D CG 1 ATOM 9476 C CD1 . LEU D 1 187 ? 114.004 13.841 46.441 1.00 81.66 ? 268 LEU D CD1 1 ATOM 9477 C CD2 . LEU D 1 187 ? 116.131 13.281 47.619 1.00 100.95 ? 268 LEU D CD2 1 ATOM 9478 N N . ASP D 1 188 ? 116.109 17.807 50.257 1.00 96.57 ? 269 ASP D N 1 ATOM 9479 C CA . ASP D 1 188 ? 116.164 19.246 50.399 1.00 99.22 ? 269 ASP D CA 1 ATOM 9480 C C . ASP D 1 188 ? 115.853 19.886 49.056 1.00 105.08 ? 269 ASP D C 1 ATOM 9481 O O . ASP D 1 188 ? 116.698 19.911 48.161 1.00 97.72 ? 269 ASP D O 1 ATOM 9482 C CB . ASP D 1 188 ? 117.553 19.674 50.877 1.00 106.12 ? 269 ASP D CB 1 ATOM 9483 C CG . ASP D 1 188 ? 117.587 21.108 51.361 1.00 109.07 ? 269 ASP D CG 1 ATOM 9484 O OD1 . ASP D 1 188 ? 116.509 21.654 51.677 1.00 111.69 ? 269 ASP D OD1 1 ATOM 9485 O OD2 . ASP D 1 188 ? 118.692 21.687 51.430 1.00 119.94 ? 269 ASP D OD2 1 ATOM 9486 N N . THR D 1 189 ? 114.624 20.365 48.897 1.00 116.38 ? 270 THR D N 1 ATOM 9487 C CA . THR D 1 189 ? 114.276 21.147 47.715 1.00 114.53 ? 270 THR D CA 1 ATOM 9488 C C . THR D 1 189 ? 113.929 22.550 48.152 1.00 109.97 ? 270 THR D C 1 ATOM 9489 O O . THR D 1 189 ? 113.048 23.194 47.578 1.00 113.12 ? 270 THR D O 1 ATOM 9490 C CB . THR D 1 189 ? 113.119 20.534 46.876 1.00 85.80 ? 270 THR D CB 1 ATOM 9491 O OG1 . THR D 1 189 ? 111.933 20.427 47.678 1.00 94.13 ? 270 THR D OG1 1 ATOM 9492 C CG2 . THR D 1 189 ? 113.523 19.157 46.334 1.00 81.60 ? 270 THR D CG2 1 ATOM 9493 N N . THR D 1 190 ? 114.615 23.009 49.196 1.00 102.61 ? 271 THR D N 1 ATOM 9494 C CA . THR D 1 190 ? 114.583 24.427 49.526 1.00 108.47 ? 271 THR D CA 1 ATOM 9495 C C . THR D 1 190 ? 115.293 25.179 48.406 1.00 100.80 ? 271 THR D C 1 ATOM 9496 O O . THR D 1 190 ? 116.430 24.865 48.028 1.00 99.17 ? 271 THR D O 1 ATOM 9497 C CB . THR D 1 190 ? 115.191 24.765 50.911 1.00 117.87 ? 271 THR D CB 1 ATOM 9498 O OG1 . THR D 1 190 ? 116.369 23.981 51.135 1.00 133.46 ? 271 THR D OG1 1 ATOM 9499 C CG2 . THR D 1 190 ? 114.179 24.492 52.022 1.00 103.77 ? 271 THR D CG2 1 ATOM 9500 N N . GLY D 1 191 ? 114.583 26.150 47.853 1.00 95.60 ? 272 GLY D N 1 ATOM 9501 C CA . GLY D 1 191 ? 115.068 26.880 46.710 1.00 105.33 ? 272 GLY D CA 1 ATOM 9502 C C . GLY D 1 191 ? 114.134 26.704 45.541 1.00 111.95 ? 272 GLY D C 1 ATOM 9503 O O . GLY D 1 191 ? 113.852 27.653 44.810 1.00 122.24 ? 272 GLY D O 1 ATOM 9504 N N . PHE D 1 192 ? 113.624 25.490 45.378 1.00 109.85 ? 273 PHE D N 1 ATOM 9505 C CA . PHE D 1 192 ? 113.032 25.114 44.102 1.00 109.05 ? 273 PHE D CA 1 ATOM 9506 C C . PHE D 1 192 ? 112.002 23.991 44.186 1.00 117.89 ? 273 PHE D C 1 ATOM 9507 O O . PHE D 1 192 ? 111.561 23.581 45.275 1.00 116.82 ? 273 PHE D O 1 ATOM 9508 C CB . PHE D 1 192 ? 114.143 24.710 43.119 1.00 100.68 ? 273 PHE D CB 1 ATOM 9509 C CG . PHE D 1 192 ? 114.903 23.482 43.544 1.00 103.38 ? 273 PHE D CG 1 ATOM 9510 C CD1 . PHE D 1 192 ? 115.729 23.519 44.658 1.00 96.27 ? 273 PHE D CD1 1 ATOM 9511 C CD2 . PHE D 1 192 ? 114.781 22.286 42.844 1.00 104.54 ? 273 PHE D CD2 1 ATOM 9512 C CE1 . PHE D 1 192 ? 116.422 22.399 45.066 1.00 93.37 ? 273 PHE D CE1 1 ATOM 9513 C CE2 . PHE D 1 192 ? 115.478 21.155 43.249 1.00 94.40 ? 273 PHE D CE2 1 ATOM 9514 C CZ . PHE D 1 192 ? 116.301 21.214 44.359 1.00 93.10 ? 273 PHE D CZ 1 ATOM 9515 N N . ASN D 1 193 ? 111.652 23.500 42.998 1.00 114.07 ? 274 ASN D N 1 ATOM 9516 C CA . ASN D 1 193 ? 110.578 22.537 42.795 1.00 105.04 ? 274 ASN D CA 1 ATOM 9517 C C . ASN D 1 193 ? 111.014 21.416 41.843 1.00 105.94 ? 274 ASN D C 1 ATOM 9518 O O . ASN D 1 193 ? 111.642 21.678 40.813 1.00 108.88 ? 274 ASN D O 1 ATOM 9519 C CB . ASN D 1 193 ? 109.358 23.265 42.236 1.00 101.72 ? 274 ASN D CB 1 ATOM 9520 C CG . ASN D 1 193 ? 108.260 22.322 41.819 1.00 95.79 ? 274 ASN D CG 1 ATOM 9521 O OD1 . ASN D 1 193 ? 107.903 21.410 42.560 1.00 90.63 ? 274 ASN D OD1 1 ATOM 9522 N ND2 . ASN D 1 193 ? 107.723 22.530 40.617 1.00 93.82 ? 274 ASN D ND2 1 ATOM 9523 N N . PHE D 1 194 ? 110.665 20.175 42.187 1.00 104.95 ? 275 PHE D N 1 ATOM 9524 C CA . PHE D 1 194 ? 111.169 18.989 41.485 1.00 98.72 ? 275 PHE D CA 1 ATOM 9525 C C . PHE D 1 194 ? 110.056 18.027 41.035 1.00 99.48 ? 275 PHE D C 1 ATOM 9526 O O . PHE D 1 194 ? 109.991 16.888 41.508 1.00 108.29 ? 275 PHE D O 1 ATOM 9527 C CB . PHE D 1 194 ? 112.172 18.249 42.389 1.00 90.22 ? 275 PHE D CB 1 ATOM 9528 C CG . PHE D 1 194 ? 113.096 17.310 41.650 1.00 95.99 ? 275 PHE D CG 1 ATOM 9529 C CD1 . PHE D 1 194 ? 114.007 17.799 40.721 1.00 96.60 ? 275 PHE D CD1 1 ATOM 9530 C CD2 . PHE D 1 194 ? 113.069 15.942 41.898 1.00 98.90 ? 275 PHE D CD2 1 ATOM 9531 C CE1 . PHE D 1 194 ? 114.871 16.943 40.038 1.00 89.64 ? 275 PHE D CE1 1 ATOM 9532 C CE2 . PHE D 1 194 ? 113.925 15.078 41.222 1.00 91.87 ? 275 PHE D CE2 1 ATOM 9533 C CZ . PHE D 1 194 ? 114.830 15.583 40.290 1.00 90.00 ? 275 PHE D CZ 1 ATOM 9534 N N . GLU D 1 195 ? 109.193 18.474 40.121 1.00 100.58 ? 276 GLU D N 1 ATOM 9535 C CA . GLU D 1 195 ? 108.055 17.659 39.663 1.00 99.64 ? 276 GLU D CA 1 ATOM 9536 C C . GLU D 1 195 ? 108.379 16.739 38.474 1.00 92.63 ? 276 GLU D C 1 ATOM 9537 O O . GLU D 1 195 ? 109.112 17.117 37.561 1.00 99.90 ? 276 GLU D O 1 ATOM 9538 C CB . GLU D 1 195 ? 106.851 18.544 39.308 1.00 96.21 ? 276 GLU D CB 1 ATOM 9539 C CG . GLU D 1 195 ? 106.407 19.502 40.404 1.00 103.17 ? 276 GLU D CG 1 ATOM 9540 C CD . GLU D 1 195 ? 105.895 18.803 41.648 1.00 107.46 ? 276 GLU D CD 1 ATOM 9541 O OE1 . GLU D 1 195 ? 104.814 18.179 41.585 1.00 107.79 ? 276 GLU D OE1 1 ATOM 9542 O OE2 . GLU D 1 195 ? 106.569 18.884 42.698 1.00 114.19 ? 276 GLU D OE2 1 ATOM 9543 N N . PHE D 1 196 ? 107.813 15.536 38.503 1.00 80.62 ? 277 PHE D N 1 ATOM 9544 C CA . PHE D 1 196 ? 107.921 14.564 37.408 1.00 80.92 ? 277 PHE D CA 1 ATOM 9545 C C . PHE D 1 196 ? 109.332 14.137 37.039 1.00 82.69 ? 277 PHE D C 1 ATOM 9546 O O . PHE D 1 196 ? 109.679 14.171 35.857 1.00 83.56 ? 277 PHE D O 1 ATOM 9547 C CB . PHE D 1 196 ? 107.236 15.089 36.137 1.00 84.23 ? 277 PHE D CB 1 ATOM 9548 C CG . PHE D 1 196 ? 105.975 15.852 36.401 1.00 88.13 ? 277 PHE D CG 1 ATOM 9549 C CD1 . PHE D 1 196 ? 104.842 15.209 36.893 1.00 92.67 ? 277 PHE D CD1 1 ATOM 9550 C CD2 . PHE D 1 196 ? 105.921 17.214 36.156 1.00 80.46 ? 277 PHE D CD2 1 ATOM 9551 C CE1 . PHE D 1 196 ? 103.681 15.918 37.146 1.00 89.35 ? 277 PHE D CE1 1 ATOM 9552 C CE2 . PHE D 1 196 ? 104.762 17.930 36.401 1.00 75.97 ? 277 PHE D CE2 1 ATOM 9553 C CZ . PHE D 1 196 ? 103.640 17.282 36.900 1.00 85.03 ? 277 PHE D CZ 1 ATOM 9554 N N . PRO D 1 197 ? 110.145 13.714 38.025 1.00 91.13 ? 278 PRO D N 1 ATOM 9555 C CA . PRO D 1 197 ? 111.485 13.276 37.608 1.00 87.87 ? 278 PRO D CA 1 ATOM 9556 C C . PRO D 1 197 ? 111.416 12.066 36.672 1.00 84.55 ? 278 PRO D C 1 ATOM 9557 O O . PRO D 1 197 ? 110.687 11.105 36.936 1.00 79.89 ? 278 PRO D O 1 ATOM 9558 C CB . PRO D 1 197 ? 112.164 12.891 38.926 1.00 85.33 ? 278 PRO D CB 1 ATOM 9559 C CG . PRO D 1 197 ? 111.022 12.583 39.876 1.00 87.97 ? 278 PRO D CG 1 ATOM 9560 C CD . PRO D 1 197 ? 109.894 13.487 39.464 1.00 90.06 ? 278 PRO D CD 1 ATOM 9561 N N . THR D 1 198 ? 112.140 12.142 35.562 1.00 85.41 ? 279 THR D N 1 ATOM 9562 C CA . THR D 1 198 ? 112.279 11.008 34.660 1.00 83.55 ? 279 THR D CA 1 ATOM 9563 C C . THR D 1 198 ? 113.735 10.540 34.728 1.00 88.71 ? 279 THR D C 1 ATOM 9564 O O . THR D 1 198 ? 114.657 11.348 34.635 1.00 89.97 ? 279 THR D O 1 ATOM 9565 C CB . THR D 1 198 ? 111.802 11.358 33.214 1.00 81.07 ? 279 THR D CB 1 ATOM 9566 O OG1 . THR D 1 198 ? 112.103 10.279 32.323 1.00 91.23 ? 279 THR D OG1 1 ATOM 9567 C CG2 . THR D 1 198 ? 112.450 12.642 32.712 1.00 81.17 ? 279 THR D CG2 1 ATOM 9568 N N . CYS D 1 199 ? 113.942 9.241 34.919 1.00 95.83 ? 280 CYS D N 1 ATOM 9569 C CA . CYS D 1 199 ? 115.238 8.758 35.390 1.00 93.46 ? 280 CYS D CA 1 ATOM 9570 C C . CYS D 1 199 ? 115.889 7.649 34.556 1.00 95.36 ? 280 CYS D C 1 ATOM 9571 O O . CYS D 1 199 ? 115.262 7.081 33.659 1.00 102.18 ? 280 CYS D O 1 ATOM 9572 C CB . CYS D 1 199 ? 115.080 8.275 36.838 1.00 83.21 ? 280 CYS D CB 1 ATOM 9573 S SG . CYS D 1 199 ? 114.268 9.474 37.926 1.00 112.75 ? 280 CYS D SG 1 ATOM 9574 N N . TYR D 1 200 ? 117.150 7.350 34.873 1.00 86.05 ? 281 TYR D N 1 ATOM 9575 C CA . TYR D 1 200 ? 117.854 6.189 34.318 1.00 76.96 ? 281 TYR D CA 1 ATOM 9576 C C . TYR D 1 200 ? 119.018 5.780 35.224 1.00 79.02 ? 281 TYR D C 1 ATOM 9577 O O . TYR D 1 200 ? 119.339 6.479 36.187 1.00 79.69 ? 281 TYR D O 1 ATOM 9578 C CB . TYR D 1 200 ? 118.361 6.472 32.911 1.00 73.61 ? 281 TYR D CB 1 ATOM 9579 C CG . TYR D 1 200 ? 119.424 7.531 32.863 1.00 75.90 ? 281 TYR D CG 1 ATOM 9580 C CD1 . TYR D 1 200 ? 119.092 8.875 32.968 1.00 84.52 ? 281 TYR D CD1 1 ATOM 9581 C CD2 . TYR D 1 200 ? 120.765 7.192 32.722 1.00 88.04 ? 281 TYR D CD2 1 ATOM 9582 C CE1 . TYR D 1 200 ? 120.066 9.861 32.932 1.00 94.10 ? 281 TYR D CE1 1 ATOM 9583 C CE2 . TYR D 1 200 ? 121.749 8.169 32.684 1.00 95.49 ? 281 TYR D CE2 1 ATOM 9584 C CZ . TYR D 1 200 ? 121.391 9.505 32.790 1.00 97.94 ? 281 TYR D CZ 1 ATOM 9585 O OH . TYR D 1 200 ? 122.349 10.493 32.755 1.00 103.83 ? 281 TYR D OH 1 ATOM 9586 N N . TYR D 1 201 ? 119.648 4.651 34.905 1.00 85.16 ? 282 TYR D N 1 ATOM 9587 C CA . TYR D 1 201 ? 120.692 4.067 35.751 1.00 88.79 ? 282 TYR D CA 1 ATOM 9588 C C . TYR D 1 201 ? 122.018 3.786 35.014 1.00 96.54 ? 282 TYR D C 1 ATOM 9589 O O . TYR D 1 201 ? 122.017 3.236 33.902 1.00 93.58 ? 282 TYR D O 1 ATOM 9590 C CB . TYR D 1 201 ? 120.169 2.772 36.408 1.00 77.89 ? 282 TYR D CB 1 ATOM 9591 C CG . TYR D 1 201 ? 121.204 2.055 37.237 1.00 85.42 ? 282 TYR D CG 1 ATOM 9592 C CD1 . TYR D 1 201 ? 122.033 1.093 36.669 1.00 94.57 ? 282 TYR D CD1 1 ATOM 9593 C CD2 . TYR D 1 201 ? 121.362 2.346 38.588 1.00 91.00 ? 282 TYR D CD2 1 ATOM 9594 C CE1 . TYR D 1 201 ? 122.993 0.442 37.422 1.00 109.00 ? 282 TYR D CE1 1 ATOM 9595 C CE2 . TYR D 1 201 ? 122.324 1.698 39.354 1.00 97.37 ? 282 TYR D CE2 1 ATOM 9596 C CZ . TYR D 1 201 ? 123.135 0.749 38.766 1.00 109.56 ? 282 TYR D CZ 1 ATOM 9597 O OH . TYR D 1 201 ? 124.087 0.107 39.523 1.00 115.28 ? 282 TYR D OH 1 ATOM 9598 N N . THR D 1 202 ? 123.132 4.198 35.635 1.00 96.95 ? 283 THR D N 1 ATOM 9599 C CA . THR D 1 202 ? 124.488 3.709 35.314 1.00 104.27 ? 283 THR D CA 1 ATOM 9600 C C . THR D 1 202 ? 125.475 4.006 36.439 1.00 109.36 ? 283 THR D C 1 ATOM 9601 O O . THR D 1 202 ? 125.199 4.829 37.314 1.00 112.61 ? 283 THR D O 1 ATOM 9602 C CB . THR D 1 202 ? 125.098 4.300 34.007 1.00 104.83 ? 283 THR D CB 1 ATOM 9603 O OG1 . THR D 1 202 ? 124.437 5.523 33.656 1.00 100.45 ? 283 THR D OG1 1 ATOM 9604 C CG2 . THR D 1 202 ? 125.015 3.296 32.860 1.00 104.21 ? 283 THR D CG2 1 ATOM 9605 N N . SER D 1 203 ? 126.622 3.328 36.398 1.00 108.03 ? 284 SER D N 1 ATOM 9606 C CA . SER D 1 203 ? 127.767 3.638 37.257 1.00 104.29 ? 284 SER D CA 1 ATOM 9607 C C . SER D 1 203 ? 127.438 3.629 38.747 1.00 115.14 ? 284 SER D C 1 ATOM 9608 O O . SER D 1 203 ? 128.066 4.341 39.539 1.00 122.49 ? 284 SER D O 1 ATOM 9609 C CB . SER D 1 203 ? 128.376 4.991 36.864 1.00 104.11 ? 284 SER D CB 1 ATOM 9610 O OG . SER D 1 203 ? 128.847 4.984 35.527 1.00 105.86 ? 284 SER D OG 1 ATOM 9611 N N . GLY D 1 204 ? 126.446 2.829 39.125 1.00 118.73 ? 285 GLY D N 1 ATOM 9612 C CA . GLY D 1 204 ? 126.039 2.732 40.515 1.00 120.20 ? 285 GLY D CA 1 ATOM 9613 C C . GLY D 1 204 ? 125.083 3.830 40.943 1.00 112.82 ? 285 GLY D C 1 ATOM 9614 O O . GLY D 1 204 ? 124.690 3.896 42.107 1.00 99.87 ? 285 GLY D O 1 ATOM 9615 N N . LYS D 1 205 ? 124.699 4.688 40.001 1.00 113.70 ? 286 LYS D N 1 ATOM 9616 C CA . LYS D 1 205 ? 123.808 5.807 40.304 1.00 102.06 ? 286 LYS D CA 1 ATOM 9617 C C . LYS D 1 205 ? 122.530 5.845 39.460 1.00 98.15 ? 286 LYS D C 1 ATOM 9618 O O . LYS D 1 205 ? 122.510 5.414 38.303 1.00 93.19 ? 286 LYS D O 1 ATOM 9619 C CB . LYS D 1 205 ? 124.564 7.136 40.177 1.00 92.04 ? 286 LYS D CB 1 ATOM 9620 C CG . LYS D 1 205 ? 125.366 7.476 41.407 1.00 102.27 ? 286 LYS D CG 1 ATOM 9621 C CD . LYS D 1 205 ? 126.794 7.886 41.095 1.00 110.42 ? 286 LYS D CD 1 ATOM 9622 C CE . LYS D 1 205 ? 127.599 7.895 42.381 1.00 116.17 ? 286 LYS D CE 1 ATOM 9623 N NZ . LYS D 1 205 ? 127.419 6.600 43.110 1.00 118.21 ? 286 LYS D NZ 1 ATOM 9624 N N . VAL D 1 206 ? 121.465 6.362 40.067 1.00 89.78 ? 287 VAL D N 1 ATOM 9625 C CA . VAL D 1 206 ? 120.214 6.637 39.374 1.00 78.26 ? 287 VAL D CA 1 ATOM 9626 C C . VAL D 1 206 ? 120.157 8.138 39.117 1.00 91.24 ? 287 VAL D C 1 ATOM 9627 O O . VAL D 1 206 ? 120.067 8.922 40.060 1.00 81.99 ? 287 VAL D O 1 ATOM 9628 C CB . VAL D 1 206 ? 118.999 6.252 40.247 1.00 77.01 ? 287 VAL D CB 1 ATOM 9629 C CG1 . VAL D 1 206 ? 117.696 6.719 39.599 1.00 67.73 ? 287 VAL D CG1 1 ATOM 9630 C CG2 . VAL D 1 206 ? 118.976 4.746 40.533 1.00 62.65 ? 287 VAL D CG2 1 ATOM 9631 N N . LYS D 1 207 ? 120.222 8.532 37.846 1.00 103.51 ? 288 LYS D N 1 ATOM 9632 C CA . LYS D 1 207 ? 120.208 9.948 37.463 1.00 98.16 ? 288 LYS D CA 1 ATOM 9633 C C . LYS D 1 207 ? 118.819 10.378 36.970 1.00 92.38 ? 288 LYS D C 1 ATOM 9634 O O . LYS D 1 207 ? 118.247 9.746 36.088 1.00 94.52 ? 288 LYS D O 1 ATOM 9635 C CB . LYS D 1 207 ? 121.279 10.227 36.399 1.00 90.34 ? 288 LYS D CB 1 ATOM 9636 C CG . LYS D 1 207 ? 122.589 9.483 36.634 1.00 90.18 ? 288 LYS D CG 1 ATOM 9637 C CD . LYS D 1 207 ? 123.801 10.336 36.281 1.00 104.61 ? 288 LYS D CD 1 ATOM 9638 C CE . LYS D 1 207 ? 125.106 9.640 36.675 1.00 111.18 ? 288 LYS D CE 1 ATOM 9639 N NZ . LYS D 1 207 ? 126.235 10.597 36.912 1.00 113.09 ? 288 LYS D NZ 1 ATOM 9640 N N . CYS D 1 208 ? 118.283 11.453 37.542 1.00 94.08 ? 289 CYS D N 1 ATOM 9641 C CA . CYS D 1 208 ? 116.900 11.860 37.285 1.00 88.70 ? 289 CYS D CA 1 ATOM 9642 C C . CYS D 1 208 ? 116.786 13.318 36.848 1.00 90.17 ? 289 CYS D C 1 ATOM 9643 O O . CYS D 1 208 ? 117.510 14.173 37.341 1.00 99.68 ? 289 CYS D O 1 ATOM 9644 C CB . CYS D 1 208 ? 116.052 11.651 38.549 1.00 86.10 ? 289 CYS D CB 1 ATOM 9645 S SG . CYS D 1 208 ? 115.885 9.937 39.080 1.00 125.63 ? 289 CYS D SG 1 ATOM 9646 N N . THR D 1 209 ? 115.862 13.601 35.936 1.00 91.61 ? 290 THR D N 1 ATOM 9647 C CA . THR D 1 209 ? 115.645 14.963 35.445 1.00 88.47 ? 290 THR D CA 1 ATOM 9648 C C . THR D 1 209 ? 114.252 15.455 35.813 1.00 85.72 ? 290 THR D C 1 ATOM 9649 O O . THR D 1 209 ? 113.244 14.926 35.320 1.00 80.05 ? 290 THR D O 1 ATOM 9650 C CB . THR D 1 209 ? 115.761 15.051 33.905 1.00 88.56 ? 290 THR D CB 1 ATOM 9651 O OG1 . THR D 1 209 ? 117.043 14.575 33.479 1.00 91.72 ? 290 THR D OG1 1 ATOM 9652 C CG2 . THR D 1 209 ? 115.567 16.492 33.441 1.00 84.26 ? 290 THR D CG2 1 ATOM 9653 N N . GLY D 1 210 ? 114.194 16.480 36.657 1.00 88.08 ? 291 GLY D N 1 ATOM 9654 C CA . GLY D 1 210 ? 112.918 17.017 37.096 1.00 96.11 ? 291 GLY D CA 1 ATOM 9655 C C . GLY D 1 210 ? 112.415 18.175 36.254 1.00 98.00 ? 291 GLY D C 1 ATOM 9656 O O . GLY D 1 210 ? 113.095 18.636 35.328 1.00 95.47 ? 291 GLY D O 1 ATOM 9657 N N . THR D 1 211 ? 111.208 18.634 36.573 1.00 93.52 ? 292 THR D N 1 ATOM 9658 C CA . THR D 1 211 ? 110.626 19.807 35.931 1.00 93.17 ? 292 THR D CA 1 ATOM 9659 C C . THR D 1 211 ? 110.348 20.877 36.975 1.00 101.34 ? 292 THR D C 1 ATOM 9660 O O . THR D 1 211 ? 109.582 20.643 37.919 1.00 99.54 ? 292 THR D O 1 ATOM 9661 C CB . THR D 1 211 ? 109.304 19.470 35.221 1.00 95.15 ? 292 THR D CB 1 ATOM 9662 O OG1 . THR D 1 211 ? 109.566 18.637 34.081 1.00 96.25 ? 292 THR D OG1 1 ATOM 9663 C CG2 . THR D 1 211 ? 108.594 20.752 34.783 1.00 95.40 ? 292 THR D CG2 1 ATOM 9664 N N . ASN D 1 212 ? 110.973 22.045 36.818 1.00 108.09 ? 293 ASN D N 1 ATOM 9665 C CA . ASN D 1 212 ? 110.746 23.139 37.763 1.00 105.88 ? 293 ASN D CA 1 ATOM 9666 C C . ASN D 1 212 ? 109.595 24.052 37.331 1.00 100.40 ? 293 ASN D C 1 ATOM 9667 O O . ASN D 1 212 ? 109.704 24.804 36.338 1.00 110.35 ? 293 ASN D O 1 ATOM 9668 C CB . ASN D 1 212 ? 112.024 23.942 38.004 1.00 105.15 ? 293 ASN D CB 1 ATOM 9669 C CG . ASN D 1 212 ? 111.973 24.750 39.289 1.00 102.83 ? 293 ASN D CG 1 ATOM 9670 O OD1 . ASN D 1 212 ? 110.924 25.275 39.671 1.00 103.09 ? 293 ASN D OD1 1 ATOM 9671 N ND2 . ASN D 1 212 ? 113.116 24.862 39.959 1.00 101.71 ? 293 ASN D ND2 1 ATOM 9672 N N . LEU D 1 213 ? 108.496 23.958 38.082 1.00 89.86 ? 294 LEU D N 1 ATOM 9673 C CA . LEU D 1 213 ? 107.290 24.707 37.783 1.00 92.10 ? 294 LEU D CA 1 ATOM 9674 C C . LEU D 1 213 ? 107.269 26.009 38.554 1.00 95.36 ? 294 LEU D C 1 ATOM 9675 O O . LEU D 1 213 ? 106.325 26.791 38.436 1.00 97.27 ? 294 LEU D O 1 ATOM 9676 C CB . LEU D 1 213 ? 106.034 23.884 38.076 1.00 92.60 ? 294 LEU D CB 1 ATOM 9677 C CG . LEU D 1 213 ? 105.660 22.935 36.934 1.00 96.66 ? 294 LEU D CG 1 ATOM 9678 C CD1 . LEU D 1 213 ? 106.003 21.507 37.308 1.00 97.78 ? 294 LEU D CD1 1 ATOM 9679 C CD2 . LEU D 1 213 ? 104.193 23.073 36.552 1.00 98.24 ? 294 LEU D CD2 1 ATOM 9680 N N . TRP D 1 214 ? 108.330 26.236 39.325 1.00 99.94 ? 295 TRP D N 1 ATOM 9681 C CA . TRP D 1 214 ? 108.440 27.411 40.176 1.00 98.56 ? 295 TRP D CA 1 ATOM 9682 C C . TRP D 1 214 ? 109.344 28.497 39.591 1.00 116.17 ? 295 TRP D C 1 ATOM 9683 O O . TRP D 1 214 ? 108.875 29.436 38.940 1.00 126.86 ? 295 TRP D O 1 ATOM 9684 C CB . TRP D 1 214 ? 108.961 27.015 41.564 1.00 96.82 ? 295 TRP D CB 1 ATOM 9685 C CG . TRP D 1 214 ? 108.947 28.154 42.551 1.00 113.47 ? 295 TRP D CG 1 ATOM 9686 C CD1 . TRP D 1 214 ? 108.331 29.362 42.393 1.00 118.99 ? 295 TRP D CD1 1 ATOM 9687 C CD2 . TRP D 1 214 ? 109.575 28.192 43.844 1.00 116.22 ? 295 TRP D CD2 1 ATOM 9688 N NE1 . TRP D 1 214 ? 108.536 30.146 43.501 1.00 120.87 ? 295 TRP D NE1 1 ATOM 9689 C CE2 . TRP D 1 214 ? 109.294 29.451 44.406 1.00 118.76 ? 295 TRP D CE2 1 ATOM 9690 C CE3 . TRP D 1 214 ? 110.345 27.284 44.578 1.00 115.92 ? 295 TRP D CE3 1 ATOM 9691 C CZ2 . TRP D 1 214 ? 109.756 29.827 45.669 1.00 117.62 ? 295 TRP D CZ2 1 ATOM 9692 C CZ3 . TRP D 1 214 ? 110.806 27.662 45.837 1.00 116.10 ? 295 TRP D CZ3 1 ATOM 9693 C CH2 . TRP D 1 214 ? 110.507 28.920 46.367 1.00 111.34 ? 295 TRP D CH2 1 ATOM 9694 N N . ASN D 1 215 ? 110.643 28.357 39.838 1.00 119.39 ? 296 ASN D N 1 ATOM 9695 C CA . ASN D 1 215 ? 111.605 29.431 39.612 1.00 116.42 ? 296 ASN D CA 1 ATOM 9696 C C . ASN D 1 215 ? 112.755 29.050 38.679 1.00 116.91 ? 296 ASN D C 1 ATOM 9697 O O . ASN D 1 215 ? 113.908 29.406 38.938 1.00 122.71 ? 296 ASN D O 1 ATOM 9698 C CB . ASN D 1 215 ? 112.185 29.857 40.962 1.00 108.78 ? 296 ASN D CB 1 ATOM 9699 C CG . ASN D 1 215 ? 112.551 28.670 41.835 1.00 116.17 ? 296 ASN D CG 1 ATOM 9700 O OD1 . ASN D 1 215 ? 112.695 27.545 41.351 1.00 120.05 ? 296 ASN D OD1 1 ATOM 9701 N ND2 . ASN D 1 215 ? 112.695 28.914 43.131 1.00 117.75 ? 296 ASN D ND2 1 ATOM 9702 N N . ASP D 1 216 ? 112.452 28.339 37.596 1.00 105.90 ? 297 ASP D N 1 ATOM 9703 C CA . ASP D 1 216 ? 113.511 27.831 36.726 1.00 103.27 ? 297 ASP D CA 1 ATOM 9704 C C . ASP D 1 216 ? 112.978 27.375 35.378 1.00 106.03 ? 297 ASP D C 1 ATOM 9705 O O . ASP D 1 216 ? 112.044 26.571 35.325 1.00 116.53 ? 297 ASP D O 1 ATOM 9706 C CB . ASP D 1 216 ? 114.222 26.654 37.407 1.00 103.65 ? 297 ASP D CB 1 ATOM 9707 C CG . ASP D 1 216 ? 115.629 26.429 36.882 1.00 111.47 ? 297 ASP D CG 1 ATOM 9708 O OD1 . ASP D 1 216 ? 115.996 27.023 35.843 1.00 119.23 ? 297 ASP D OD1 1 ATOM 9709 O OD2 . ASP D 1 216 ? 116.374 25.648 37.512 1.00 110.08 ? 297 ASP D OD2 1 ATOM 9710 N N . ALA D 1 217 ? 113.583 27.876 34.300 1.00 98.36 ? 298 ALA D N 1 ATOM 9711 C CA . ALA D 1 217 ? 113.258 27.429 32.948 1.00 102.85 ? 298 ALA D CA 1 ATOM 9712 C C . ALA D 1 217 ? 114.333 26.476 32.421 1.00 108.80 ? 298 ALA D C 1 ATOM 9713 O O . ALA D 1 217 ? 114.295 26.041 31.265 1.00 104.67 ? 298 ALA D O 1 ATOM 9714 C CB . ALA D 1 217 ? 113.087 28.610 32.016 1.00 105.06 ? 298 ALA D CB 1 ATOM 9715 N N . LYS D 1 218 ? 115.306 26.177 33.274 1.00 110.87 ? 299 LYS D N 1 ATOM 9716 C CA . LYS D 1 218 ? 116.163 25.022 33.062 1.00 114.98 ? 299 LYS D CA 1 ATOM 9717 C C . LYS D 1 218 ? 115.513 23.832 33.753 1.00 116.73 ? 299 LYS D C 1 ATOM 9718 O O . LYS D 1 218 ? 114.531 23.983 34.486 1.00 111.96 ? 299 LYS D O 1 ATOM 9719 C CB . LYS D 1 218 ? 117.552 25.248 33.657 1.00 114.29 ? 299 LYS D CB 1 ATOM 9720 C CG . LYS D 1 218 ? 118.432 26.194 32.872 1.00 119.34 ? 299 LYS D CG 1 ATOM 9721 C CD . LYS D 1 218 ? 119.898 25.900 33.153 1.00 129.13 ? 299 LYS D CD 1 ATOM 9722 C CE . LYS D 1 218 ? 120.681 27.155 33.506 1.00 138.76 ? 299 LYS D CE 1 ATOM 9723 N NZ . LYS D 1 218 ? 122.155 26.952 33.372 1.00 145.70 ? 299 LYS D NZ 1 ATOM 9724 N N . ARG D 1 219 ? 116.054 22.645 33.522 1.00 113.29 ? 300 ARG D N 1 ATOM 9725 C CA . ARG D 1 219 ? 115.571 21.486 34.249 1.00 103.45 ? 300 ARG D CA 1 ATOM 9726 C C . ARG D 1 219 ? 116.571 21.110 35.327 1.00 108.38 ? 300 ARG D C 1 ATOM 9727 O O . ARG D 1 219 ? 117.766 21.016 35.055 1.00 111.55 ? 300 ARG D O 1 ATOM 9728 C CB . ARG D 1 219 ? 115.327 20.315 33.303 1.00 91.10 ? 300 ARG D CB 1 ATOM 9729 C CG . ARG D 1 219 ? 114.367 20.661 32.182 1.00 86.12 ? 300 ARG D CG 1 ATOM 9730 C CD . ARG D 1 219 ? 114.032 19.443 31.355 1.00 82.52 ? 300 ARG D CD 1 ATOM 9731 N NE . ARG D 1 219 ? 112.896 19.690 30.476 1.00 80.29 ? 300 ARG D NE 1 ATOM 9732 C CZ . ARG D 1 219 ? 111.634 19.759 30.894 1.00 88.51 ? 300 ARG D CZ 1 ATOM 9733 N NH1 . ARG D 1 219 ? 111.341 19.607 32.188 1.00 85.40 ? 300 ARG D NH1 1 ATOM 9734 N NH2 . ARG D 1 219 ? 110.659 19.975 30.016 1.00 91.19 ? 300 ARG D NH2 1 ATOM 9735 N N . PRO D 1 220 ? 116.088 20.918 36.567 1.00 104.86 ? 301 PRO D N 1 ATOM 9736 C CA . PRO D 1 220 ? 116.943 20.416 37.650 1.00 99.10 ? 301 PRO D CA 1 ATOM 9737 C C . PRO D 1 220 ? 117.361 18.962 37.413 1.00 96.58 ? 301 PRO D C 1 ATOM 9738 O O . PRO D 1 220 ? 116.860 18.305 36.503 1.00 94.73 ? 301 PRO D O 1 ATOM 9739 C CB . PRO D 1 220 ? 116.034 20.509 38.877 1.00 104.79 ? 301 PRO D CB 1 ATOM 9740 C CG . PRO D 1 220 ? 114.642 20.417 38.323 1.00 100.33 ? 301 PRO D CG 1 ATOM 9741 C CD . PRO D 1 220 ? 114.714 21.190 37.031 1.00 101.85 ? 301 PRO D CD 1 ATOM 9742 N N . PHE D 1 221 ? 118.268 18.461 38.238 1.00 103.10 ? 302 PHE D N 1 ATOM 9743 C CA . PHE D 1 221 ? 118.845 17.151 37.994 1.00 102.02 ? 302 PHE D CA 1 ATOM 9744 C C . PHE D 1 221 ? 119.239 16.456 39.289 1.00 101.49 ? 302 PHE D C 1 ATOM 9745 O O . PHE D 1 221 ? 119.899 17.042 40.145 1.00 108.02 ? 302 PHE D O 1 ATOM 9746 C CB . PHE D 1 221 ? 120.072 17.287 37.092 1.00 103.19 ? 302 PHE D CB 1 ATOM 9747 C CG . PHE D 1 221 ? 120.505 15.998 36.459 1.00 107.78 ? 302 PHE D CG 1 ATOM 9748 C CD1 . PHE D 1 221 ? 121.344 15.121 37.138 1.00 100.08 ? 302 PHE D CD1 1 ATOM 9749 C CD2 . PHE D 1 221 ? 120.077 15.665 35.175 1.00 110.53 ? 302 PHE D CD2 1 ATOM 9750 C CE1 . PHE D 1 221 ? 121.742 13.932 36.552 1.00 103.76 ? 302 PHE D CE1 1 ATOM 9751 C CE2 . PHE D 1 221 ? 120.473 14.480 34.579 1.00 102.27 ? 302 PHE D CE2 1 ATOM 9752 C CZ . PHE D 1 221 ? 121.306 13.610 35.266 1.00 104.04 ? 302 PHE D CZ 1 ATOM 9753 N N . LEU D 1 222 ? 118.842 15.199 39.424 1.00 95.23 ? 303 LEU D N 1 ATOM 9754 C CA . LEU D 1 222 ? 119.157 14.437 40.618 1.00 101.44 ? 303 LEU D CA 1 ATOM 9755 C C . LEU D 1 222 ? 120.116 13.299 40.281 1.00 104.63 ? 303 LEU D C 1 ATOM 9756 O O . LEU D 1 222 ? 120.162 12.822 39.145 1.00 108.95 ? 303 LEU D O 1 ATOM 9757 C CB . LEU D 1 222 ? 117.872 13.841 41.195 1.00 105.59 ? 303 LEU D CB 1 ATOM 9758 C CG . LEU D 1 222 ? 117.625 13.856 42.701 1.00 102.30 ? 303 LEU D CG 1 ATOM 9759 C CD1 . LEU D 1 222 ? 116.918 12.566 43.093 1.00 91.44 ? 303 LEU D CD1 1 ATOM 9760 C CD2 . LEU D 1 222 ? 118.904 14.050 43.506 1.00 107.23 ? 303 LEU D CD2 1 ATOM 9761 N N . GLU D 1 223 ? 120.915 12.899 41.262 1.00 99.25 ? 304 GLU D N 1 ATOM 9762 C CA . GLU D 1 223 ? 121.488 11.560 41.269 1.00 100.47 ? 304 GLU D CA 1 ATOM 9763 C C . GLU D 1 223 ? 121.531 11.046 42.699 1.00 102.28 ? 304 GLU D C 1 ATOM 9764 O O . GLU D 1 223 ? 121.564 11.832 43.644 1.00 105.82 ? 304 GLU D O 1 ATOM 9765 C CB . GLU D 1 223 ? 122.851 11.469 40.556 1.00 109.79 ? 304 GLU D CB 1 ATOM 9766 C CG . GLU D 1 223 ? 123.924 12.477 40.973 1.00 131.21 ? 304 GLU D CG 1 ATOM 9767 C CD . GLU D 1 223 ? 125.341 12.061 40.537 1.00 142.45 ? 304 GLU D CD 1 ATOM 9768 O OE1 . GLU D 1 223 ? 125.784 10.956 40.919 1.00 146.17 ? 304 GLU D OE1 1 ATOM 9769 O OE2 . GLU D 1 223 ? 126.018 12.836 39.819 1.00 142.58 ? 304 GLU D OE2 1 ATOM 9770 N N . PHE D 1 224 ? 121.444 9.731 42.851 1.00 104.31 ? 305 PHE D N 1 ATOM 9771 C CA . PHE D 1 224 ? 121.586 9.108 44.156 1.00 109.75 ? 305 PHE D CA 1 ATOM 9772 C C . PHE D 1 224 ? 122.087 7.691 43.989 1.00 111.16 ? 305 PHE D C 1 ATOM 9773 O O . PHE D 1 224 ? 122.049 7.139 42.886 1.00 110.48 ? 305 PHE D O 1 ATOM 9774 C CB . PHE D 1 224 ? 120.272 9.131 44.944 1.00 104.32 ? 305 PHE D CB 1 ATOM 9775 C CG . PHE D 1 224 ? 119.113 8.459 44.246 1.00 95.70 ? 305 PHE D CG 1 ATOM 9776 C CD1 . PHE D 1 224 ? 118.856 7.105 44.431 1.00 87.26 ? 305 PHE D CD1 1 ATOM 9777 C CD2 . PHE D 1 224 ? 118.254 9.193 43.430 1.00 94.25 ? 305 PHE D CD2 1 ATOM 9778 C CE1 . PHE D 1 224 ? 117.778 6.490 43.795 1.00 79.69 ? 305 PHE D CE1 1 ATOM 9779 C CE2 . PHE D 1 224 ? 117.167 8.584 42.796 1.00 83.90 ? 305 PHE D CE2 1 ATOM 9780 C CZ . PHE D 1 224 ? 116.933 7.233 42.982 1.00 69.05 ? 305 PHE D CZ 1 ATOM 9781 N N . ASP D 1 225 ? 122.562 7.113 45.087 1.00 114.28 ? 306 ASP D N 1 ATOM 9782 C CA . ASP D 1 225 ? 123.011 5.734 45.093 1.00 120.92 ? 306 ASP D CA 1 ATOM 9783 C C . ASP D 1 225 ? 121.967 4.873 45.789 1.00 103.89 ? 306 ASP D C 1 ATOM 9784 O O . ASP D 1 225 ? 120.922 5.376 46.201 1.00 89.10 ? 306 ASP D O 1 ATOM 9785 C CB . ASP D 1 225 ? 124.343 5.611 45.830 1.00 137.41 ? 306 ASP D CB 1 ATOM 9786 C CG . ASP D 1 225 ? 125.064 4.315 45.504 1.00 152.66 ? 306 ASP D CG 1 ATOM 9787 O OD1 . ASP D 1 225 ? 124.464 3.451 44.810 1.00 158.12 ? 306 ASP D OD1 1 ATOM 9788 O OD2 . ASP D 1 225 ? 126.223 4.165 45.945 1.00 146.46 ? 306 ASP D OD2 1 ATOM 9789 N N . GLN D 1 226 ? 122.266 3.583 45.927 1.00 101.90 ? 307 GLN D N 1 ATOM 9790 C CA . GLN D 1 226 ? 121.388 2.647 46.610 1.00 106.32 ? 307 GLN D CA 1 ATOM 9791 C C . GLN D 1 226 ? 121.319 2.922 48.110 1.00 108.36 ? 307 GLN D C 1 ATOM 9792 O O . GLN D 1 226 ? 120.351 2.531 48.772 1.00 110.71 ? 307 GLN D O 1 ATOM 9793 C CB . GLN D 1 226 ? 121.845 1.207 46.370 1.00 110.26 ? 307 GLN D CB 1 ATOM 9794 C CG . GLN D 1 226 ? 123.032 0.788 47.227 1.00 121.52 ? 307 GLN D CG 1 ATOM 9795 C CD . GLN D 1 226 ? 123.670 -0.499 46.757 1.00 123.97 ? 307 GLN D CD 1 ATOM 9796 O OE1 . GLN D 1 226 ? 123.954 -0.663 45.570 1.00 127.13 ? 307 GLN D OE1 1 ATOM 9797 N NE2 . GLN D 1 226 ? 123.890 -1.428 47.684 1.00 121.95 ? 307 GLN D NE2 1 ATOM 9798 N N . SER D 1 227 ? 122.351 3.564 48.657 1.00 110.24 ? 309 SER D N 1 ATOM 9799 C CA . SER D 1 227 ? 122.327 3.933 50.076 1.00 119.09 ? 309 SER D CA 1 ATOM 9800 C C . SER D 1 227 ? 121.932 5.398 50.276 1.00 121.51 ? 309 SER D C 1 ATOM 9801 O O . SER D 1 227 ? 122.339 6.041 51.246 1.00 128.49 ? 309 SER D O 1 ATOM 9802 C CB . SER D 1 227 ? 123.638 3.581 50.796 1.00 116.00 ? 309 SER D CB 1 ATOM 9803 O OG . SER D 1 227 ? 124.680 3.274 49.881 1.00 122.04 ? 309 SER D OG 1 ATOM 9804 N N . PHE D 1 228 ? 121.143 5.907 49.331 1.00 112.25 ? 310 PHE D N 1 ATOM 9805 C CA . PHE D 1 228 ? 120.430 7.178 49.480 1.00 113.06 ? 310 PHE D CA 1 ATOM 9806 C C . PHE D 1 228 ? 121.286 8.442 49.501 1.00 121.06 ? 310 PHE D C 1 ATOM 9807 O O . PHE D 1 228 ? 120.737 9.540 49.604 1.00 126.91 ? 310 PHE D O 1 ATOM 9808 C CB . PHE D 1 228 ? 119.515 7.154 50.712 1.00 112.54 ? 310 PHE D CB 1 ATOM 9809 C CG . PHE D 1 228 ? 118.173 6.537 50.456 1.00 118.15 ? 310 PHE D CG 1 ATOM 9810 C CD1 . PHE D 1 228 ? 117.600 6.591 49.189 1.00 111.39 ? 310 PHE D CD1 1 ATOM 9811 C CD2 . PHE D 1 228 ? 117.479 5.903 51.478 1.00 124.17 ? 310 PHE D CD2 1 ATOM 9812 C CE1 . PHE D 1 228 ? 116.351 6.017 48.945 1.00 103.16 ? 310 PHE D CE1 1 ATOM 9813 C CE2 . PHE D 1 228 ? 116.234 5.328 51.244 1.00 121.90 ? 310 PHE D CE2 1 ATOM 9814 C CZ . PHE D 1 228 ? 115.669 5.387 49.970 1.00 107.23 ? 310 PHE D CZ 1 ATOM 9815 N N . THR D 1 229 ? 122.607 8.316 49.410 1.00 119.23 ? 311 THR D N 1 ATOM 9816 C CA . THR D 1 229 ? 123.417 9.524 49.283 1.00 122.36 ? 311 THR D CA 1 ATOM 9817 C C . THR D 1 229 ? 123.093 10.174 47.930 1.00 114.63 ? 311 THR D C 1 ATOM 9818 O O . THR D 1 229 ? 123.175 9.526 46.878 1.00 108.31 ? 311 THR D O 1 ATOM 9819 C CB . THR D 1 229 ? 124.943 9.264 49.478 1.00 108.32 ? 311 THR D CB 1 ATOM 9820 O OG1 . THR D 1 229 ? 125.485 8.603 48.328 1.00 124.39 ? 311 THR D OG1 1 ATOM 9821 C CG2 . THR D 1 229 ? 125.200 8.422 50.733 1.00 100.67 ? 311 THR D CG2 1 ATOM 9822 N N . TYR D 1 230 ? 122.684 11.440 47.969 1.00 106.10 ? 312 TYR D N 1 ATOM 9823 C CA . TYR D 1 230 ? 122.203 12.118 46.770 1.00 94.81 ? 312 TYR D CA 1 ATOM 9824 C C . TYR D 1 230 ? 122.749 13.519 46.628 1.00 103.53 ? 312 TYR D C 1 ATOM 9825 O O . TYR D 1 230 ? 123.142 14.155 47.606 1.00 116.36 ? 312 TYR D O 1 ATOM 9826 C CB . TYR D 1 230 ? 120.678 12.224 46.781 1.00 88.45 ? 312 TYR D CB 1 ATOM 9827 C CG . TYR D 1 230 ? 120.134 13.237 47.776 1.00 92.56 ? 312 TYR D CG 1 ATOM 9828 C CD1 . TYR D 1 230 ? 120.029 12.917 49.129 1.00 99.13 ? 312 TYR D CD1 1 ATOM 9829 C CD2 . TYR D 1 230 ? 119.712 14.506 47.366 1.00 85.52 ? 312 TYR D CD2 1 ATOM 9830 C CE1 . TYR D 1 230 ? 119.524 13.825 50.056 1.00 95.69 ? 312 TYR D CE1 1 ATOM 9831 C CE2 . TYR D 1 230 ? 119.199 15.423 48.286 1.00 79.24 ? 312 TYR D CE2 1 ATOM 9832 C CZ . TYR D 1 230 ? 119.110 15.073 49.636 1.00 94.65 ? 312 TYR D CZ 1 ATOM 9833 O OH . TYR D 1 230 ? 118.610 15.956 50.578 1.00 84.72 ? 312 TYR D OH 1 ATOM 9834 N N . THR D 1 231 ? 122.728 14.004 45.396 1.00 103.37 ? 313 THR D N 1 ATOM 9835 C CA . THR D 1 231 ? 123.087 15.379 45.114 1.00 105.45 ? 313 THR D CA 1 ATOM 9836 C C . THR D 1 231 ? 122.247 15.930 43.955 1.00 94.16 ? 313 THR D C 1 ATOM 9837 O O . THR D 1 231 ? 122.103 15.277 42.914 1.00 88.12 ? 313 THR D O 1 ATOM 9838 C CB . THR D 1 231 ? 124.617 15.517 44.834 1.00 108.97 ? 313 THR D CB 1 ATOM 9839 O OG1 . THR D 1 231 ? 124.866 16.624 43.950 1.00 101.41 ? 313 THR D OG1 1 ATOM 9840 C CG2 . THR D 1 231 ? 125.171 14.223 44.216 1.00 104.62 ? 313 THR D CG2 1 ATOM 9841 N N . PHE D 1 232 ? 121.661 17.110 44.166 1.00 93.37 ? 314 PHE D N 1 ATOM 9842 C CA . PHE D 1 232 ? 121.059 17.890 43.081 1.00 96.43 ? 314 PHE D CA 1 ATOM 9843 C C . PHE D 1 232 ? 122.146 18.678 42.337 1.00 98.44 ? 314 PHE D C 1 ATOM 9844 O O . PHE D 1 232 ? 123.054 19.242 42.951 1.00 105.44 ? 314 PHE D O 1 ATOM 9845 C CB . PHE D 1 232 ? 119.996 18.861 43.613 1.00 95.62 ? 314 PHE D CB 1 ATOM 9846 C CG . PHE D 1 232 ? 118.663 18.216 43.917 1.00 114.33 ? 314 PHE D CG 1 ATOM 9847 C CD1 . PHE D 1 232 ? 118.437 17.561 45.129 1.00 112.99 ? 314 PHE D CD1 1 ATOM 9848 C CD2 . PHE D 1 232 ? 117.623 18.284 42.996 1.00 117.80 ? 314 PHE D CD2 1 ATOM 9849 C CE1 . PHE D 1 232 ? 117.206 16.981 45.405 1.00 106.30 ? 314 PHE D CE1 1 ATOM 9850 C CE2 . PHE D 1 232 ? 116.388 17.704 43.269 1.00 114.10 ? 314 PHE D CE2 1 ATOM 9851 C CZ . PHE D 1 232 ? 116.183 17.054 44.474 1.00 111.42 ? 314 PHE D CZ 1 ATOM 9852 N N . LYS D 1 233 ? 122.057 18.698 41.015 1.00 90.15 ? 315 LYS D N 1 ATOM 9853 C CA . LYS D 1 233 ? 122.975 19.476 40.201 1.00 95.79 ? 315 LYS D CA 1 ATOM 9854 C C . LYS D 1 233 ? 122.166 20.424 39.328 1.00 104.82 ? 315 LYS D C 1 ATOM 9855 O O . LYS D 1 233 ? 120.989 20.180 39.060 1.00 105.02 ? 315 LYS D O 1 ATOM 9856 C CB . LYS D 1 233 ? 123.850 18.560 39.331 1.00 97.34 ? 315 LYS D CB 1 ATOM 9857 C CG . LYS D 1 233 ? 124.589 17.476 40.112 1.00 102.65 ? 315 LYS D CG 1 ATOM 9858 C CD . LYS D 1 233 ? 125.781 16.929 39.333 1.00 108.67 ? 315 LYS D CD 1 ATOM 9859 C CE . LYS D 1 233 ? 126.605 15.961 40.184 1.00 109.22 ? 315 LYS D CE 1 ATOM 9860 N NZ . LYS D 1 233 ? 127.874 15.539 39.516 1.00 109.12 ? 315 LYS D NZ 1 ATOM 9861 N N . GLU D 1 234 ? 122.786 21.519 38.906 1.00 118.40 ? 316 GLU D N 1 ATOM 9862 C CA . GLU D 1 234 ? 122.149 22.429 37.960 1.00 125.26 ? 316 GLU D CA 1 ATOM 9863 C C . GLU D 1 234 ? 122.951 22.471 36.672 1.00 128.92 ? 316 GLU D C 1 ATOM 9864 O O . GLU D 1 234 ? 124.165 22.693 36.705 1.00 130.77 ? 316 GLU D O 1 ATOM 9865 C CB . GLU D 1 234 ? 122.007 23.829 38.551 1.00 121.82 ? 316 GLU D CB 1 ATOM 9866 C CG . GLU D 1 234 ? 120.677 24.062 39.241 1.00 129.19 ? 316 GLU D CG 1 ATOM 9867 C CD . GLU D 1 234 ? 119.562 24.385 38.264 1.00 125.85 ? 316 GLU D CD 1 ATOM 9868 O OE1 . GLU D 1 234 ? 119.866 24.760 37.109 1.00 110.83 ? 316 GLU D OE1 1 ATOM 9869 O OE2 . GLU D 1 234 ? 118.383 24.270 38.660 1.00 130.64 ? 316 GLU D OE2 1 ATOM 9870 N N . PRO D 1 235 ? 122.277 22.237 35.533 1.00 124.90 ? 317 PRO D N 1 ATOM 9871 C CA . PRO D 1 235 ? 122.970 22.272 34.243 1.00 123.90 ? 317 PRO D CA 1 ATOM 9872 C C . PRO D 1 235 ? 123.603 23.640 34.003 1.00 128.12 ? 317 PRO D C 1 ATOM 9873 O O . PRO D 1 235 ? 122.897 24.643 33.894 1.00 128.49 ? 317 PRO D O 1 ATOM 9874 C CB . PRO D 1 235 ? 121.849 21.997 33.224 1.00 108.82 ? 317 PRO D CB 1 ATOM 9875 C CG . PRO D 1 235 ? 120.576 22.313 33.933 1.00 103.12 ? 317 PRO D CG 1 ATOM 9876 C CD . PRO D 1 235 ? 120.836 21.969 35.379 1.00 112.83 ? 317 PRO D CD 1 ATOM 9877 N N . CYS D 1 236 ? 124.931 23.677 33.953 1.00 134.93 ? 318 CYS D N 1 ATOM 9878 C CA . CYS D 1 236 ? 125.662 24.900 33.629 1.00 132.29 ? 318 CYS D CA 1 ATOM 9879 C C . CYS D 1 236 ? 125.599 25.112 32.115 1.00 143.25 ? 318 CYS D C 1 ATOM 9880 O O . CYS D 1 236 ? 126.585 24.901 31.406 1.00 150.79 ? 318 CYS D O 1 ATOM 9881 C CB . CYS D 1 236 ? 127.109 24.775 34.102 1.00 118.35 ? 318 CYS D CB 1 ATOM 9882 S SG . CYS D 1 236 ? 127.279 24.518 35.888 1.00 223.24 ? 318 CYS D SG 1 ATOM 9883 N N . LEU D 1 237 ? 124.433 25.533 31.628 1.00 141.24 ? 319 LEU D N 1 ATOM 9884 C CA . LEU D 1 237 ? 124.121 25.463 30.199 1.00 127.18 ? 319 LEU D CA 1 ATOM 9885 C C . LEU D 1 237 ? 123.003 26.428 29.806 1.00 135.23 ? 319 LEU D C 1 ATOM 9886 O O . LEU D 1 237 ? 121.977 26.519 30.487 1.00 144.03 ? 319 LEU D O 1 ATOM 9887 C CB . LEU D 1 237 ? 123.685 24.040 29.844 1.00 112.79 ? 319 LEU D CB 1 ATOM 9888 C CG . LEU D 1 237 ? 124.366 23.257 28.718 1.00 112.24 ? 319 LEU D CG 1 ATOM 9889 C CD1 . LEU D 1 237 ? 124.848 24.207 27.659 1.00 125.34 ? 319 LEU D CD1 1 ATOM 9890 C CD2 . LEU D 1 237 ? 125.495 22.352 29.207 1.00 105.54 ? 319 LEU D CD2 1 ATOM 9891 N N . GLY D 1 238 ? 123.196 27.132 28.694 1.00 133.95 ? 320 GLY D N 1 ATOM 9892 C CA . GLY D 1 238 ? 122.266 28.164 28.274 1.00 127.37 ? 320 GLY D CA 1 ATOM 9893 C C . GLY D 1 238 ? 121.222 27.699 27.283 1.00 117.10 ? 320 GLY D C 1 ATOM 9894 O O . GLY D 1 238 ? 120.371 28.494 26.865 1.00 107.13 ? 320 GLY D O 1 ATOM 9895 N N . PHE D 1 239 ? 121.282 26.415 26.918 1.00 122.11 ? 321 PHE D N 1 ATOM 9896 C CA . PHE D 1 239 ? 120.255 25.762 26.084 1.00 116.02 ? 321 PHE D CA 1 ATOM 9897 C C . PHE D 1 239 ? 119.074 25.376 26.976 1.00 107.34 ? 321 PHE D C 1 ATOM 9898 O O . PHE D 1 239 ? 119.080 24.312 27.600 1.00 108.29 ? 321 PHE D O 1 ATOM 9899 C CB . PHE D 1 239 ? 120.838 24.502 25.425 1.00 104.14 ? 321 PHE D CB 1 ATOM 9900 C CG . PHE D 1 239 ? 120.029 23.965 24.267 1.00 101.89 ? 321 PHE D CG 1 ATOM 9901 C CD1 . PHE D 1 239 ? 119.858 24.708 23.102 1.00 95.99 ? 321 PHE D CD1 1 ATOM 9902 C CD2 . PHE D 1 239 ? 119.479 22.692 24.326 1.00 102.48 ? 321 PHE D CD2 1 ATOM 9903 C CE1 . PHE D 1 239 ? 119.127 24.198 22.019 1.00 93.20 ? 321 PHE D CE1 1 ATOM 9904 C CE2 . PHE D 1 239 ? 118.745 22.178 23.256 1.00 94.77 ? 321 PHE D CE2 1 ATOM 9905 C CZ . PHE D 1 239 ? 118.572 22.933 22.099 1.00 96.98 ? 321 PHE D CZ 1 ATOM 9906 N N . LEU D 1 240 ? 118.073 26.249 27.045 1.00 102.80 ? 322 LEU D N 1 ATOM 9907 C CA . LEU D 1 240 ? 116.981 26.081 27.996 1.00 111.66 ? 322 LEU D CA 1 ATOM 9908 C C . LEU D 1 240 ? 116.063 24.917 27.614 1.00 118.93 ? 322 LEU D C 1 ATOM 9909 O O . LEU D 1 240 ? 115.544 24.862 26.495 1.00 131.87 ? 322 LEU D O 1 ATOM 9910 C CB . LEU D 1 240 ? 116.201 27.393 28.150 1.00 108.63 ? 322 LEU D CB 1 ATOM 9911 C CG . LEU D 1 240 ? 117.038 28.619 28.541 1.00 103.02 ? 322 LEU D CG 1 ATOM 9912 C CD1 . LEU D 1 240 ? 116.158 29.824 28.862 1.00 105.02 ? 322 LEU D CD1 1 ATOM 9913 C CD2 . LEU D 1 240 ? 117.960 28.283 29.710 1.00 96.91 ? 322 LEU D CD2 1 ATOM 9914 N N . GLY D 1 241 ? 115.874 23.993 28.559 1.00 103.68 ? 323 GLY D N 1 ATOM 9915 C CA . GLY D 1 241 ? 115.164 22.743 28.311 1.00 101.24 ? 323 GLY D CA 1 ATOM 9916 C C . GLY D 1 241 ? 113.669 22.732 28.606 1.00 96.18 ? 323 GLY D C 1 ATOM 9917 O O . GLY D 1 241 ? 112.886 22.140 27.854 1.00 91.37 ? 323 GLY D O 1 ATOM 9918 N N . ASP D 1 242 ? 113.272 23.385 29.697 1.00 96.30 ? 324 ASP D N 1 ATOM 9919 C CA . ASP D 1 242 ? 111.865 23.489 30.086 1.00 91.79 ? 324 ASP D CA 1 ATOM 9920 C C . ASP D 1 242 ? 111.047 24.303 29.074 1.00 85.44 ? 324 ASP D C 1 ATOM 9921 O O . ASP D 1 242 ? 111.598 25.047 28.264 1.00 77.64 ? 324 ASP D O 1 ATOM 9922 C CB . ASP D 1 242 ? 111.762 24.132 31.471 1.00 98.62 ? 324 ASP D CB 1 ATOM 9923 C CG . ASP D 1 242 ? 110.503 23.728 32.221 1.00 100.01 ? 324 ASP D CG 1 ATOM 9924 O OD1 . ASP D 1 242 ? 109.522 23.284 31.571 1.00 98.55 ? 324 ASP D OD1 1 ATOM 9925 O OD2 . ASP D 1 242 ? 110.493 23.870 33.471 1.00 91.79 ? 324 ASP D OD2 1 ATOM 9926 N N . THR D 1 243 ? 109.731 24.122 29.112 1.00 97.23 ? 325 THR D N 1 ATOM 9927 C CA . THR D 1 243 ? 108.789 24.898 28.306 1.00 94.52 ? 325 THR D CA 1 ATOM 9928 C C . THR D 1 243 ? 107.610 25.251 29.229 1.00 106.24 ? 325 THR D C 1 ATOM 9929 O O . THR D 1 243 ? 106.972 24.356 29.797 1.00 104.65 ? 325 THR D O 1 ATOM 9930 C CB . THR D 1 243 ? 108.295 24.089 27.083 1.00 89.11 ? 325 THR D CB 1 ATOM 9931 O OG1 . THR D 1 243 ? 109.400 23.792 26.213 1.00 91.33 ? 325 THR D OG1 1 ATOM 9932 C CG2 . THR D 1 243 ? 107.204 24.844 26.309 1.00 79.02 ? 325 THR D CG2 1 ATOM 9933 N N . PRO D 1 244 ? 107.296 26.554 29.369 1.00 108.11 ? 326 PRO D N 1 ATOM 9934 C CA . PRO D 1 244 ? 107.846 27.648 28.564 1.00 110.74 ? 326 PRO D CA 1 ATOM 9935 C C . PRO D 1 244 ? 109.253 28.055 28.988 1.00 110.89 ? 326 PRO D C 1 ATOM 9936 O O . PRO D 1 244 ? 109.786 27.556 29.990 1.00 106.82 ? 326 PRO D O 1 ATOM 9937 C CB . PRO D 1 244 ? 106.875 28.797 28.850 1.00 112.89 ? 326 PRO D CB 1 ATOM 9938 C CG . PRO D 1 244 ? 106.471 28.571 30.277 1.00 108.67 ? 326 PRO D CG 1 ATOM 9939 C CD . PRO D 1 244 ? 106.422 27.061 30.446 1.00 107.47 ? 326 PRO D CD 1 ATOM 9940 N N . ARG D 1 245 ? 109.841 28.953 28.204 1.00 108.81 ? 327 ARG D N 1 ATOM 9941 C CA . ARG D 1 245 ? 111.162 29.486 28.490 1.00 108.39 ? 327 ARG D CA 1 ATOM 9942 C C . ARG D 1 245 ? 111.348 30.796 27.729 1.00 113.69 ? 327 ARG D C 1 ATOM 9943 O O . ARG D 1 245 ? 110.489 31.187 26.929 1.00 113.03 ? 327 ARG D O 1 ATOM 9944 C CB . ARG D 1 245 ? 112.251 28.472 28.114 1.00 101.62 ? 327 ARG D CB 1 ATOM 9945 C CG . ARG D 1 245 ? 112.210 28.041 26.660 1.00 96.82 ? 327 ARG D CG 1 ATOM 9946 C CD . ARG D 1 245 ? 113.260 26.987 26.346 1.00 99.15 ? 327 ARG D CD 1 ATOM 9947 N NE . ARG D 1 245 ? 113.408 26.795 24.904 1.00 102.40 ? 327 ARG D NE 1 ATOM 9948 C CZ . ARG D 1 245 ? 112.602 26.037 24.168 1.00 97.42 ? 327 ARG D CZ 1 ATOM 9949 N NH1 . ARG D 1 245 ? 111.596 25.391 24.742 1.00 97.89 ? 327 ARG D NH1 1 ATOM 9950 N NH2 . ARG D 1 245 ? 112.799 25.920 22.863 1.00 99.59 ? 327 ARG D NH2 1 ATOM 9951 N N . GLY D 1 246 ? 112.457 31.477 27.997 1.00 111.26 ? 328 GLY D N 1 ATOM 9952 C CA . GLY D 1 246 ? 112.783 32.700 27.291 1.00 114.99 ? 328 GLY D CA 1 ATOM 9953 C C . GLY D 1 246 ? 113.747 32.426 26.156 1.00 118.91 ? 328 GLY D C 1 ATOM 9954 O O . GLY D 1 246 ? 113.881 31.284 25.704 1.00 109.63 ? 328 GLY D O 1 ATOM 9955 N N . ILE D 1 247 ? 114.418 33.472 25.687 1.00 118.64 ? 329 ILE D N 1 ATOM 9956 C CA . ILE D 1 247 ? 115.484 33.295 24.713 1.00 122.14 ? 329 ILE D CA 1 ATOM 9957 C C . ILE D 1 247 ? 116.652 32.547 25.364 1.00 118.64 ? 329 ILE D C 1 ATOM 9958 O O . ILE D 1 247 ? 116.864 32.650 26.578 1.00 114.98 ? 329 ILE D O 1 ATOM 9959 C CB . ILE D 1 247 ? 115.949 34.647 24.141 1.00 126.86 ? 329 ILE D CB 1 ATOM 9960 C CG1 . ILE D 1 247 ? 116.329 35.616 25.269 1.00 128.85 ? 329 ILE D CG1 1 ATOM 9961 C CG2 . ILE D 1 247 ? 114.853 35.255 23.290 1.00 122.56 ? 329 ILE D CG2 1 ATOM 9962 C CD1 . ILE D 1 247 ? 117.824 35.879 25.395 1.00 125.68 ? 329 ILE D CD1 1 ATOM 9963 N N . ASP D 1 248 ? 117.392 31.779 24.570 1.00 111.88 ? 330 ASP D N 1 ATOM 9964 C CA . ASP D 1 248 ? 118.538 31.046 25.101 1.00 105.54 ? 330 ASP D CA 1 ATOM 9965 C C . ASP D 1 248 ? 119.608 32.032 25.572 1.00 108.10 ? 330 ASP D C 1 ATOM 9966 O O . ASP D 1 248 ? 119.636 33.178 25.129 1.00 103.85 ? 330 ASP D O 1 ATOM 9967 C CB . ASP D 1 248 ? 119.085 30.059 24.066 1.00 100.48 ? 330 ASP D CB 1 ATOM 9968 C CG . ASP D 1 248 ? 118.250 28.793 23.968 1.00 107.96 ? 330 ASP D CG 1 ATOM 9969 O OD1 . ASP D 1 248 ? 117.018 28.859 24.183 1.00 115.52 ? 330 ASP D OD1 1 ATOM 9970 O OD2 . ASP D 1 248 ? 118.834 27.727 23.681 1.00 103.90 ? 330 ASP D OD2 1 ATOM 9971 N N . THR D 1 249 ? 120.471 31.591 26.484 1.00 116.19 ? 333 THR D N 1 ATOM 9972 C CA . THR D 1 249 ? 121.410 32.491 27.153 1.00 127.89 ? 333 THR D CA 1 ATOM 9973 C C . THR D 1 249 ? 122.864 32.043 26.986 1.00 133.35 ? 333 THR D C 1 ATOM 9974 O O . THR D 1 249 ? 123.154 31.086 26.266 1.00 129.67 ? 333 THR D O 1 ATOM 9975 C CB . THR D 1 249 ? 121.116 32.574 28.674 1.00 128.50 ? 333 THR D CB 1 ATOM 9976 O OG1 . THR D 1 249 ? 121.696 31.445 29.341 1.00 126.10 ? 333 THR D OG1 1 ATOM 9977 C CG2 . THR D 1 249 ? 119.611 32.609 28.948 1.00 119.22 ? 333 THR D CG2 1 ATOM 9978 N N . THR D 1 250 ? 123.778 32.752 27.648 1.00 130.51 ? 334 THR D N 1 ATOM 9979 C CA . THR D 1 250 ? 125.135 32.244 27.867 1.00 121.03 ? 334 THR D CA 1 ATOM 9980 C C . THR D 1 250 ? 125.080 31.215 28.995 1.00 107.61 ? 334 THR D C 1 ATOM 9981 O O . THR D 1 250 ? 124.077 31.122 29.706 1.00 107.47 ? 334 THR D O 1 ATOM 9982 C CB . THR D 1 250 ? 126.150 33.373 28.239 1.00 114.71 ? 334 THR D CB 1 ATOM 9983 O OG1 . THR D 1 250 ? 126.226 33.532 29.669 1.00 107.51 ? 334 THR D OG1 1 ATOM 9984 C CG2 . THR D 1 250 ? 125.766 34.698 27.576 1.00 114.06 ? 334 THR D CG2 1 ATOM 9985 N N . ASN D 1 251 ? 126.148 30.444 29.170 1.00 102.62 ? 335 ASN D N 1 ATOM 9986 C CA . ASN D 1 251 ? 126.151 29.398 30.193 1.00 105.95 ? 335 ASN D CA 1 ATOM 9987 C C . ASN D 1 251 ? 126.455 29.925 31.583 1.00 106.86 ? 335 ASN D C 1 ATOM 9988 O O . ASN D 1 251 ? 127.499 30.528 31.793 1.00 108.19 ? 335 ASN D O 1 ATOM 9989 C CB . ASN D 1 251 ? 127.162 28.302 29.852 1.00 105.31 ? 335 ASN D CB 1 ATOM 9990 C CG . ASN D 1 251 ? 127.020 27.794 28.434 1.00 112.28 ? 335 ASN D CG 1 ATOM 9991 O OD1 . ASN D 1 251 ? 125.992 27.991 27.780 1.00 108.52 ? 335 ASN D OD1 1 ATOM 9992 N ND2 . ASN D 1 251 ? 128.061 27.130 27.948 1.00 118.60 ? 335 ASN D ND2 1 ATOM 9993 N N . TYR D 1 252 ? 125.545 29.687 32.524 1.00 119.34 ? 336 TYR D N 1 ATOM 9994 C CA . TYR D 1 252 ? 125.787 29.978 33.940 1.00 118.85 ? 336 TYR D CA 1 ATOM 9995 C C . TYR D 1 252 ? 125.165 28.912 34.841 1.00 130.32 ? 336 TYR D C 1 ATOM 9996 O O . TYR D 1 252 ? 124.127 28.332 34.509 1.00 131.66 ? 336 TYR D O 1 ATOM 9997 C CB . TYR D 1 252 ? 125.294 31.375 34.337 1.00 111.32 ? 336 TYR D CB 1 ATOM 9998 C CG . TYR D 1 252 ? 123.907 31.764 33.848 1.00 109.08 ? 336 TYR D CG 1 ATOM 9999 C CD1 . TYR D 1 252 ? 123.733 32.343 32.593 1.00 118.09 ? 336 TYR D CD1 1 ATOM 10000 C CD2 . TYR D 1 252 ? 122.780 31.591 34.652 1.00 102.31 ? 336 TYR D CD2 1 ATOM 10001 C CE1 . TYR D 1 252 ? 122.477 32.723 32.140 1.00 123.57 ? 336 TYR D CE1 1 ATOM 10002 C CE2 . TYR D 1 252 ? 121.515 31.969 34.209 1.00 108.33 ? 336 TYR D CE2 1 ATOM 10003 C CZ . TYR D 1 252 ? 121.370 32.536 32.951 1.00 121.67 ? 336 TYR D CZ 1 ATOM 10004 O OH . TYR D 1 252 ? 120.121 32.917 32.497 1.00 124.99 ? 336 TYR D OH 1 ATOM 10005 N N . CYS D 1 253 ? 125.790 28.673 35.990 1.00 129.78 ? 337 CYS D N 1 ATOM 10006 C CA . CYS D 1 253 ? 125.425 27.539 36.831 1.00 127.77 ? 337 CYS D CA 1 ATOM 10007 C C . CYS D 1 253 ? 124.252 27.803 37.782 1.00 130.89 ? 337 CYS D C 1 ATOM 10008 O O . CYS D 1 253 ? 124.051 27.072 38.759 1.00 131.97 ? 337 CYS D O 1 ATOM 10009 C CB . CYS D 1 253 ? 126.653 27.043 37.600 1.00 125.05 ? 337 CYS D CB 1 ATOM 10010 S SG . CYS D 1 253 ? 127.929 26.331 36.538 1.00 250.95 ? 337 CYS D SG 1 ATOM 10011 N N . ASP D 1 254 ? 123.472 28.837 37.491 1.00 126.73 ? 339 ASP D N 1 ATOM 10012 C CA . ASP D 1 254 ? 122.307 29.146 38.307 1.00 126.78 ? 339 ASP D CA 1 ATOM 10013 C C . ASP D 1 254 ? 121.005 29.093 37.518 1.00 125.16 ? 339 ASP D C 1 ATOM 10014 O O . ASP D 1 254 ? 120.995 29.190 36.292 1.00 127.21 ? 339 ASP D O 1 ATOM 10015 C CB . ASP D 1 254 ? 122.461 30.510 38.983 1.00 133.17 ? 339 ASP D CB 1 ATOM 10016 C CG . ASP D 1 254 ? 122.405 30.418 40.502 1.00 142.38 ? 339 ASP D CG 1 ATOM 10017 O OD1 . ASP D 1 254 ? 121.710 29.517 41.036 1.00 139.41 ? 339 ASP D OD1 1 ATOM 10018 O OD2 . ASP D 1 254 ? 123.062 31.252 41.162 1.00 141.91 ? 339 ASP D OD2 1 ATOM 10019 N N . LYS D 1 255 ? 119.906 28.939 38.244 1.00 127.97 ? 340 LYS D N 1 ATOM 10020 C CA . LYS D 1 255 ? 118.581 28.868 37.646 1.00 128.78 ? 340 LYS D CA 1 ATOM 10021 C C . LYS D 1 255 ? 118.225 30.149 36.913 1.00 137.91 ? 340 LYS D C 1 ATOM 10022 O O . LYS D 1 255 ? 118.135 31.217 37.526 1.00 150.75 ? 340 LYS D O 1 ATOM 10023 C CB . LYS D 1 255 ? 117.531 28.626 38.734 1.00 120.31 ? 340 LYS D CB 1 ATOM 10024 C CG . LYS D 1 255 ? 117.862 27.463 39.647 1.00 113.98 ? 340 LYS D CG 1 ATOM 10025 C CD . LYS D 1 255 ? 117.541 27.790 41.089 1.00 110.78 ? 340 LYS D CD 1 ATOM 10026 C CE . LYS D 1 255 ? 116.111 28.256 41.232 1.00 106.17 ? 340 LYS D CE 1 ATOM 10027 N NZ . LYS D 1 255 ? 115.626 27.959 42.596 1.00 114.30 ? 340 LYS D NZ 1 ATOM 10028 N N . THR D 1 256 ? 118.023 30.050 35.604 1.00 127.33 ? 341 THR D N 1 ATOM 10029 C CA . THR D 1 256 ? 117.391 31.147 34.884 1.00 127.31 ? 341 THR D CA 1 ATOM 10030 C C . THR D 1 256 ? 115.922 31.228 35.329 1.00 123.28 ? 341 THR D C 1 ATOM 10031 O O . THR D 1 256 ? 115.132 30.314 35.092 1.00 113.34 ? 341 THR D O 1 ATOM 10032 C CB . THR D 1 256 ? 117.539 31.007 33.344 1.00 115.80 ? 341 THR D CB 1 ATOM 10033 O OG1 . THR D 1 256 ? 116.249 30.981 32.714 1.00 116.15 ? 341 THR D OG1 1 ATOM 10034 C CG2 . THR D 1 256 ? 118.312 29.749 32.992 1.00 113.36 ? 341 THR D CG2 1 ATOM 10035 N N . THR D 1 257 ? 115.574 32.316 36.008 1.00 131.97 ? 342 THR D N 1 ATOM 10036 C CA . THR D 1 257 ? 114.259 32.442 36.625 1.00 124.42 ? 342 THR D CA 1 ATOM 10037 C C . THR D 1 257 ? 113.271 33.066 35.642 1.00 112.51 ? 342 THR D C 1 ATOM 10038 O O . THR D 1 257 ? 112.105 33.307 35.962 1.00 109.49 ? 342 THR D O 1 ATOM 10039 C CB . THR D 1 257 ? 114.339 33.267 37.937 1.00 115.31 ? 342 THR D CB 1 ATOM 10040 O OG1 . THR D 1 257 ? 114.391 34.671 37.638 1.00 112.51 ? 342 THR D OG1 1 ATOM 10041 C CG2 . THR D 1 257 ? 115.578 32.871 38.726 1.00 112.00 ? 342 THR D CG2 1 ATOM 10042 N N . THR D 1 258 ? 113.750 33.289 34.428 1.00 102.01 ? 343 THR D N 1 ATOM 10043 C CA . THR D 1 258 ? 113.031 34.089 33.451 1.00 105.56 ? 343 THR D CA 1 ATOM 10044 C C . THR D 1 258 ? 111.988 33.253 32.697 1.00 107.83 ? 343 THR D C 1 ATOM 10045 O O . THR D 1 258 ? 112.332 32.417 31.850 1.00 97.18 ? 343 THR D O 1 ATOM 10046 C CB . THR D 1 258 ? 114.032 34.767 32.497 1.00 107.15 ? 343 THR D CB 1 ATOM 10047 O OG1 . THR D 1 258 ? 115.061 35.410 33.272 1.00 110.14 ? 343 THR D OG1 1 ATOM 10048 C CG2 . THR D 1 258 ? 113.332 35.783 31.609 1.00 98.95 ? 343 THR D CG2 1 ATOM 10049 N N . GLU D 1 259 ? 110.715 33.511 33.006 1.00 117.07 ? 344 GLU D N 1 ATOM 10050 C CA . GLU D 1 259 ? 109.615 32.601 32.676 1.00 118.46 ? 344 GLU D CA 1 ATOM 10051 C C . GLU D 1 259 ? 109.926 31.244 33.290 1.00 115.34 ? 344 GLU D C 1 ATOM 10052 O O . GLU D 1 259 ? 109.693 30.195 32.686 1.00 112.91 ? 344 GLU D O 1 ATOM 10053 C CB . GLU D 1 259 ? 109.400 32.475 31.171 1.00 117.99 ? 344 GLU D CB 1 ATOM 10054 C CG . GLU D 1 259 ? 108.772 33.681 30.506 1.00 118.68 ? 344 GLU D CG 1 ATOM 10055 C CD . GLU D 1 259 ? 108.914 33.619 29.000 1.00 128.28 ? 344 GLU D CD 1 ATOM 10056 O OE1 . GLU D 1 259 ? 110.062 33.485 28.530 1.00 129.14 ? 344 GLU D OE1 1 ATOM 10057 O OE2 . GLU D 1 259 ? 107.887 33.673 28.288 1.00 132.12 ? 344 GLU D OE2 1 ATOM 10058 N N . GLY D 1 260 ? 110.483 31.288 34.496 1.00 118.89 ? 345 GLY D N 1 ATOM 10059 C CA . GLY D 1 260 ? 110.815 30.091 35.235 1.00 117.22 ? 345 GLY D CA 1 ATOM 10060 C C . GLY D 1 260 ? 109.557 29.500 35.827 1.00 116.47 ? 345 GLY D C 1 ATOM 10061 O O . GLY D 1 260 ? 109.564 28.371 36.304 1.00 115.24 ? 345 GLY D O 1 ATOM 10062 N N . GLU D 1 261 ? 108.474 30.275 35.802 1.00 121.19 ? 346 GLU D N 1 ATOM 10063 C CA . GLU D 1 261 ? 107.166 29.791 36.227 1.00 115.79 ? 346 GLU D CA 1 ATOM 10064 C C . GLU D 1 261 ? 106.530 29.019 35.079 1.00 108.69 ? 346 GLU D C 1 ATOM 10065 O O . GLU D 1 261 ? 106.794 29.309 33.908 1.00 103.62 ? 346 GLU D O 1 ATOM 10066 C CB . GLU D 1 261 ? 106.260 30.950 36.641 1.00 128.37 ? 346 GLU D CB 1 ATOM 10067 C CG . GLU D 1 261 ? 105.720 30.840 38.058 1.00 136.30 ? 346 GLU D CG 1 ATOM 10068 C CD . GLU D 1 261 ? 104.289 31.326 38.177 1.00 135.87 ? 346 GLU D CD 1 ATOM 10069 O OE1 . GLU D 1 261 ? 103.612 31.447 37.129 1.00 138.74 ? 346 GLU D OE1 1 ATOM 10070 O OE2 . GLU D 1 261 ? 103.844 31.583 39.319 1.00 125.32 ? 346 GLU D OE2 1 ATOM 10071 N N . GLY D 1 262 ? 105.686 28.045 35.411 1.00 109.29 ? 347 GLY D N 1 ATOM 10072 C CA . GLY D 1 262 ? 105.142 27.147 34.407 1.00 111.71 ? 347 GLY D CA 1 ATOM 10073 C C . GLY D 1 262 ? 106.090 25.973 34.248 1.00 112.94 ? 347 GLY D C 1 ATOM 10074 O O . GLY D 1 262 ? 107.091 25.887 34.950 1.00 127.75 ? 347 GLY D O 1 ATOM 10075 N N . GLY D 1 263 ? 105.788 25.063 33.334 1.00 100.61 ? 348 GLY D N 1 ATOM 10076 C CA . GLY D 1 263 ? 106.662 23.927 33.138 1.00 106.06 ? 348 GLY D CA 1 ATOM 10077 C C . GLY D 1 263 ? 105.993 22.753 32.465 1.00 103.84 ? 348 GLY D C 1 ATOM 10078 O O . GLY D 1 263 ? 104.768 22.685 32.351 1.00 103.69 ? 348 GLY D O 1 ATOM 10079 N N . ILE D 1 264 ? 106.819 21.825 32.003 1.00 93.37 ? 349 ILE D N 1 ATOM 10080 C CA . ILE D 1 264 ? 106.326 20.600 31.398 1.00 82.25 ? 349 ILE D CA 1 ATOM 10081 C C . ILE D 1 264 ? 107.367 19.500 31.586 1.00 78.03 ? 349 ILE D C 1 ATOM 10082 O O . ILE D 1 264 ? 108.557 19.782 31.735 1.00 86.93 ? 349 ILE D O 1 ATOM 10083 C CB . ILE D 1 264 ? 105.964 20.796 29.901 1.00 112.38 ? 349 ILE D CB 1 ATOM 10084 C CG1 . ILE D 1 264 ? 104.932 19.749 29.458 1.00 97.46 ? 349 ILE D CG1 1 ATOM 10085 C CG2 . ILE D 1 264 ? 107.212 20.768 29.025 1.00 114.35 ? 349 ILE D CG2 1 ATOM 10086 C CD1 . ILE D 1 264 ? 104.169 20.120 28.202 1.00 82.94 ? 349 ILE D CD1 1 ATOM 10087 N N . GLN D 1 265 ? 106.912 18.251 31.610 1.00 81.95 ? 350 GLN D N 1 ATOM 10088 C CA . GLN D 1 265 ? 107.807 17.131 31.858 1.00 80.13 ? 350 GLN D CA 1 ATOM 10089 C C . GLN D 1 265 ? 108.779 16.930 30.696 1.00 87.51 ? 350 GLN D C 1 ATOM 10090 O O . GLN D 1 265 ? 108.373 16.934 29.529 1.00 93.71 ? 350 GLN D O 1 ATOM 10091 C CB . GLN D 1 265 ? 107.015 15.856 32.101 1.00 70.41 ? 350 GLN D CB 1 ATOM 10092 C CG . GLN D 1 265 ? 107.895 14.660 32.407 1.00 77.29 ? 350 GLN D CG 1 ATOM 10093 C CD . GLN D 1 265 ? 107.106 13.492 32.942 1.00 82.84 ? 350 GLN D CD 1 ATOM 10094 O OE1 . GLN D 1 265 ? 105.882 13.453 32.822 1.00 85.63 ? 350 GLN D OE1 1 ATOM 10095 N NE2 . GLN D 1 265 ? 107.801 12.536 33.551 1.00 82.22 ? 350 GLN D NE2 1 ATOM 10096 N N . GLY D 1 266 ? 110.059 16.759 31.025 1.00 86.02 ? 351 GLY D N 1 ATOM 10097 C CA . GLY D 1 266 ? 111.095 16.544 30.027 1.00 92.64 ? 351 GLY D CA 1 ATOM 10098 C C . GLY D 1 266 ? 112.370 15.979 30.633 1.00 90.88 ? 351 GLY D C 1 ATOM 10099 O O . GLY D 1 266 ? 112.462 15.808 31.859 1.00 85.84 ? 351 GLY D O 1 ATOM 10100 N N . PHE D 1 267 ? 113.360 15.696 29.783 1.00 83.94 ? 352 PHE D N 1 ATOM 10101 C CA . PHE D 1 267 ? 114.580 15.034 30.245 1.00 85.86 ? 352 PHE D CA 1 ATOM 10102 C C . PHE D 1 267 ? 115.874 15.681 29.755 1.00 99.39 ? 352 PHE D C 1 ATOM 10103 O O . PHE D 1 267 ? 115.881 16.509 28.828 1.00 97.48 ? 352 PHE D O 1 ATOM 10104 C CB . PHE D 1 267 ? 114.576 13.560 29.810 1.00 83.42 ? 352 PHE D CB 1 ATOM 10105 C CG . PHE D 1 267 ? 114.575 13.376 28.324 1.00 78.53 ? 352 PHE D CG 1 ATOM 10106 C CD1 . PHE D 1 267 ? 113.383 13.370 27.625 1.00 79.66 ? 352 PHE D CD1 1 ATOM 10107 C CD2 . PHE D 1 267 ? 115.766 13.227 27.620 1.00 75.52 ? 352 PHE D CD2 1 ATOM 10108 C CE1 . PHE D 1 267 ? 113.370 13.214 26.252 1.00 86.33 ? 352 PHE D CE1 1 ATOM 10109 C CE2 . PHE D 1 267 ? 115.765 13.070 26.240 1.00 78.46 ? 352 PHE D CE2 1 ATOM 10110 C CZ . PHE D 1 267 ? 114.566 13.065 25.554 1.00 86.73 ? 352 PHE D CZ 1 ATOM 10111 N N . MET D 1 268 ? 116.964 15.283 30.411 1.00 102.46 ? 353 MET D N 1 ATOM 10112 C CA . MET D 1 268 ? 118.326 15.529 29.959 1.00 91.23 ? 353 MET D CA 1 ATOM 10113 C C . MET D 1 268 ? 119.085 14.223 30.142 1.00 95.75 ? 353 MET D C 1 ATOM 10114 O O . MET D 1 268 ? 118.674 13.372 30.930 1.00 107.06 ? 353 MET D O 1 ATOM 10115 C CB . MET D 1 268 ? 118.991 16.609 30.807 1.00 88.57 ? 353 MET D CB 1 ATOM 10116 C CG . MET D 1 268 ? 118.303 17.963 30.799 1.00 87.93 ? 353 MET D CG 1 ATOM 10117 S SD . MET D 1 268 ? 119.199 19.123 31.845 1.00 103.06 ? 353 MET D SD 1 ATOM 10118 C CE . MET D 1 268 ? 118.473 20.694 31.336 1.00 93.00 ? 353 MET D CE 1 ATOM 10119 N N . ILE D 1 269 ? 120.191 14.060 29.426 1.00 94.37 ? 354 ILE D N 1 ATOM 10120 C CA . ILE D 1 269 ? 121.047 12.890 29.614 1.00 98.76 ? 354 ILE D CA 1 ATOM 10121 C C . ILE D 1 269 ? 122.479 13.331 29.939 1.00 104.19 ? 354 ILE D C 1 ATOM 10122 O O . ILE D 1 269 ? 123.034 14.186 29.250 1.00 105.51 ? 354 ILE D O 1 ATOM 10123 C CB . ILE D 1 269 ? 121.053 11.975 28.357 1.00 70.64 ? 354 ILE D CB 1 ATOM 10124 C CG1 . ILE D 1 269 ? 119.627 11.578 27.972 1.00 74.49 ? 354 ILE D CG1 1 ATOM 10125 C CG2 . ILE D 1 269 ? 121.897 10.720 28.587 1.00 72.75 ? 354 ILE D CG2 1 ATOM 10126 C CD1 . ILE D 1 269 ? 119.561 10.644 26.779 1.00 73.17 ? 354 ILE D CD1 1 ATOM 10127 N N . GLU D 1 270 ? 123.070 12.755 30.985 1.00 104.90 ? 355 GLU D N 1 ATOM 10128 C CA . GLU D 1 270 ? 124.468 13.030 31.325 1.00 109.76 ? 355 GLU D CA 1 ATOM 10129 C C . GLU D 1 270 ? 125.380 11.817 31.061 1.00 107.05 ? 355 GLU D C 1 ATOM 10130 O O . GLU D 1 270 ? 125.125 10.723 31.557 1.00 98.64 ? 355 GLU D O 1 ATOM 10131 C CB . GLU D 1 270 ? 124.583 13.477 32.793 1.00 115.79 ? 355 GLU D CB 1 ATOM 10132 C CG . GLU D 1 270 ? 125.996 13.401 33.379 1.00 119.04 ? 355 GLU D CG 1 ATOM 10133 C CD . GLU D 1 270 ? 126.681 14.754 33.488 1.00 120.69 ? 355 GLU D CD 1 ATOM 10134 O OE1 . GLU D 1 270 ? 126.215 15.727 32.852 1.00 116.02 ? 355 GLU D OE1 1 ATOM 10135 O OE2 . GLU D 1 270 ? 127.690 14.838 34.222 1.00 122.68 ? 355 GLU D OE2 1 ATOM 10136 N N . GLY D 1 271 ? 126.442 12.012 30.282 1.00 114.18 ? 356 GLY D N 1 ATOM 10137 C CA . GLY D 1 271 ? 127.394 10.942 30.011 1.00 114.91 ? 356 GLY D CA 1 ATOM 10138 C C . GLY D 1 271 ? 128.673 11.440 29.354 1.00 117.15 ? 356 GLY D C 1 ATOM 10139 O O . GLY D 1 271 ? 129.061 12.598 29.542 1.00 114.08 ? 356 GLY D O 1 ATOM 10140 N N . SER D 1 272 ? 129.341 10.565 28.600 1.00 113.72 ? 357 SER D N 1 ATOM 10141 C CA . SER D 1 272 ? 130.450 10.979 27.730 1.00 115.85 ? 357 SER D CA 1 ATOM 10142 C C . SER D 1 272 ? 129.963 12.095 26.809 1.00 119.80 ? 357 SER D C 1 ATOM 10143 O O . SER D 1 272 ? 130.326 13.259 26.985 1.00 121.24 ? 357 SER D O 1 ATOM 10144 C CB . SER D 1 272 ? 130.964 9.801 26.902 1.00 113.79 ? 357 SER D CB 1 ATOM 10145 O OG . SER D 1 272 ? 131.734 8.910 27.686 1.00 115.04 ? 357 SER D OG 1 ATOM 10146 N N . ASN D 1 273 ? 129.157 11.734 25.814 1.00 124.68 ? 359 ASN D N 1 ATOM 10147 C CA . ASN D 1 273 ? 128.302 12.713 25.160 1.00 117.97 ? 359 ASN D CA 1 ATOM 10148 C C . ASN D 1 273 ? 127.129 12.926 26.103 1.00 105.42 ? 359 ASN D C 1 ATOM 10149 O O . ASN D 1 273 ? 126.763 12.028 26.853 1.00 107.16 ? 359 ASN D O 1 ATOM 10150 C CB . ASN D 1 273 ? 127.788 12.209 23.806 1.00 114.82 ? 359 ASN D CB 1 ATOM 10151 C CG . ASN D 1 273 ? 128.900 11.717 22.899 1.00 117.31 ? 359 ASN D CG 1 ATOM 10152 O OD1 . ASN D 1 273 ? 130.058 12.130 23.026 1.00 116.91 ? 359 ASN D OD1 1 ATOM 10153 N ND2 . ASN D 1 273 ? 128.552 10.827 21.972 1.00 114.27 ? 359 ASN D ND2 1 ATOM 10154 N N . SER D 1 274 ? 126.543 14.111 26.088 1.00 98.70 ? 360 SER D N 1 ATOM 10155 C CA . SER D 1 274 ? 125.378 14.357 26.921 1.00 97.07 ? 360 SER D CA 1 ATOM 10156 C C . SER D 1 274 ? 124.300 15.014 26.079 1.00 98.95 ? 360 SER D C 1 ATOM 10157 O O . SER D 1 274 ? 124.595 15.710 25.106 1.00 102.54 ? 360 SER D O 1 ATOM 10158 C CB . SER D 1 274 ? 125.743 15.220 28.132 1.00 102.10 ? 360 SER D CB 1 ATOM 10159 O OG . SER D 1 274 ? 126.507 14.478 29.072 1.00 104.10 ? 360 SER D OG 1 ATOM 10160 N N . TRP D 1 275 ? 123.042 14.791 26.430 1.00 99.12 ? 361 TRP D N 1 ATOM 10161 C CA . TRP D 1 275 ? 121.968 15.331 25.605 1.00 93.05 ? 361 TRP D CA 1 ATOM 10162 C C . TRP D 1 275 ? 120.982 16.179 26.386 1.00 91.79 ? 361 TRP D C 1 ATOM 10163 O O . TRP D 1 275 ? 120.821 16.018 27.605 1.00 95.72 ? 361 TRP D O 1 ATOM 10164 C CB . TRP D 1 275 ? 121.208 14.187 24.921 1.00 77.93 ? 361 TRP D CB 1 ATOM 10165 C CG . TRP D 1 275 ? 122.081 13.282 24.101 1.00 82.78 ? 361 TRP D CG 1 ATOM 10166 C CD1 . TRP D 1 275 ? 122.877 12.261 24.558 1.00 90.28 ? 361 TRP D CD1 1 ATOM 10167 C CD2 . TRP D 1 275 ? 122.232 13.300 22.677 1.00 88.04 ? 361 TRP D CD2 1 ATOM 10168 N NE1 . TRP D 1 275 ? 123.515 11.646 23.500 1.00 92.09 ? 361 TRP D NE1 1 ATOM 10169 C CE2 . TRP D 1 275 ? 123.135 12.263 22.335 1.00 96.94 ? 361 TRP D CE2 1 ATOM 10170 C CE3 . TRP D 1 275 ? 121.685 14.085 21.653 1.00 86.31 ? 361 TRP D CE3 1 ATOM 10171 C CZ2 . TRP D 1 275 ? 123.510 12.000 21.008 1.00 97.62 ? 361 TRP D CZ2 1 ATOM 10172 C CZ3 . TRP D 1 275 ? 122.062 13.826 20.338 1.00 89.73 ? 361 TRP D CZ3 1 ATOM 10173 C CH2 . TRP D 1 275 ? 122.966 12.790 20.030 1.00 93.24 ? 361 TRP D CH2 1 ATOM 10174 N N . ILE D 1 276 ? 120.322 17.086 25.674 1.00 84.85 ? 362 ILE D N 1 ATOM 10175 C CA . ILE D 1 276 ? 119.100 17.707 26.180 1.00 90.81 ? 362 ILE D CA 1 ATOM 10176 C C . ILE D 1 276 ? 118.095 17.894 25.044 1.00 97.89 ? 362 ILE D C 1 ATOM 10177 O O . ILE D 1 276 ? 118.412 18.491 24.011 1.00 111.17 ? 362 ILE D O 1 ATOM 10178 C CB . ILE D 1 276 ? 119.371 19.042 26.914 1.00 107.25 ? 362 ILE D CB 1 ATOM 10179 C CG1 . ILE D 1 276 ? 118.135 19.937 26.888 1.00 108.92 ? 362 ILE D CG1 1 ATOM 10180 C CG2 . ILE D 1 276 ? 120.528 19.774 26.283 1.00 121.60 ? 362 ILE D CG2 1 ATOM 10181 C CD1 . ILE D 1 276 ? 118.421 21.344 27.334 1.00 109.01 ? 362 ILE D CD1 1 ATOM 10182 N N . GLY D 1 277 ? 116.895 17.349 25.226 1.00 85.34 ? 363 GLY D N 1 ATOM 10183 C CA . GLY D 1 277 ? 115.838 17.514 24.251 1.00 75.08 ? 363 GLY D CA 1 ATOM 10184 C C . GLY D 1 277 ? 114.826 18.518 24.753 1.00 83.49 ? 363 GLY D C 1 ATOM 10185 O O . GLY D 1 277 ? 114.703 18.717 25.961 1.00 98.59 ? 363 GLY D O 1 ATOM 10186 N N . ARG D 1 278 ? 114.106 19.158 23.838 1.00 85.80 ? 364 ARG D N 1 ATOM 10187 C CA . ARG D 1 278 ? 113.127 20.163 24.232 1.00 88.68 ? 364 ARG D CA 1 ATOM 10188 C C . ARG D 1 278 ? 112.167 20.439 23.088 1.00 91.19 ? 364 ARG D C 1 ATOM 10189 O O . ARG D 1 278 ? 112.437 20.081 21.934 1.00 85.49 ? 364 ARG D O 1 ATOM 10190 C CB . ARG D 1 278 ? 113.831 21.461 24.638 1.00 84.95 ? 364 ARG D CB 1 ATOM 10191 C CG . ARG D 1 278 ? 114.174 22.350 23.451 1.00 90.92 ? 364 ARG D CG 1 ATOM 10192 C CD . ARG D 1 278 ? 115.337 23.265 23.756 1.00 95.27 ? 364 ARG D CD 1 ATOM 10193 N NE . ARG D 1 278 ? 115.497 24.293 22.731 1.00 98.02 ? 364 ARG D NE 1 ATOM 10194 C CZ . ARG D 1 278 ? 116.160 25.430 22.918 1.00 104.16 ? 364 ARG D CZ 1 ATOM 10195 N NH1 . ARG D 1 278 ? 116.724 25.686 24.094 1.00 100.16 ? 364 ARG D NH1 1 ATOM 10196 N NH2 . ARG D 1 278 ? 116.255 26.309 21.929 1.00 106.99 ? 364 ARG D NH2 1 ATOM 10197 N N . ILE D 1 279 ? 111.038 21.061 23.415 1.00 94.39 ? 365 ILE D N 1 ATOM 10198 C CA . ILE D 1 279 ? 110.150 21.588 22.393 1.00 95.50 ? 365 ILE D CA 1 ATOM 10199 C C . ILE D 1 279 ? 110.852 22.806 21.826 1.00 101.46 ? 365 ILE D C 1 ATOM 10200 O O . ILE D 1 279 ? 111.293 23.674 22.583 1.00 109.35 ? 365 ILE D O 1 ATOM 10201 C CB . ILE D 1 279 ? 108.814 22.022 22.994 1.00 89.57 ? 365 ILE D CB 1 ATOM 10202 C CG1 . ILE D 1 279 ? 108.424 21.062 24.119 1.00 88.94 ? 365 ILE D CG1 1 ATOM 10203 C CG2 . ILE D 1 279 ? 107.736 22.126 21.902 1.00 83.60 ? 365 ILE D CG2 1 ATOM 10204 C CD1 . ILE D 1 279 ? 107.001 21.235 24.617 1.00 92.81 ? 365 ILE D CD1 1 ATOM 10205 N N . ILE D 1 280 ? 110.976 22.871 20.505 1.00 96.36 ? 366 ILE D N 1 ATOM 10206 C CA . ILE D 1 280 ? 111.690 23.985 19.898 1.00 103.72 ? 366 ILE D CA 1 ATOM 10207 C C . ILE D 1 280 ? 110.932 25.295 20.069 1.00 101.35 ? 366 ILE D C 1 ATOM 10208 O O . ILE D 1 280 ? 111.498 26.295 20.515 1.00 90.54 ? 366 ILE D O 1 ATOM 10209 C CB . ILE D 1 280 ? 111.985 23.743 18.427 1.00 104.14 ? 366 ILE D CB 1 ATOM 10210 C CG1 . ILE D 1 280 ? 112.366 22.269 18.214 1.00 101.86 ? 366 ILE D CG1 1 ATOM 10211 C CG2 . ILE D 1 280 ? 113.064 24.739 17.979 1.00 110.26 ? 366 ILE D CG2 1 ATOM 10212 C CD1 . ILE D 1 280 ? 111.807 21.648 16.933 1.00 98.22 ? 366 ILE D CD1 1 ATOM 10213 N N . ASN D 1 281 ? 109.648 25.266 19.730 1.00 105.49 ? 367 ASN D N 1 ATOM 10214 C CA . ASN D 1 281 ? 108.780 26.426 19.852 1.00 107.46 ? 367 ASN D CA 1 ATOM 10215 C C . ASN D 1 281 ? 107.919 26.320 21.095 1.00 108.93 ? 367 ASN D C 1 ATOM 10216 O O . ASN D 1 281 ? 107.027 25.480 21.165 1.00 121.26 ? 367 ASN D O 1 ATOM 10217 C CB . ASN D 1 281 ? 107.879 26.542 18.619 1.00 123.76 ? 367 ASN D CB 1 ATOM 10218 C CG . ASN D 1 281 ? 108.670 26.691 17.324 1.00 144.06 ? 367 ASN D CG 1 ATOM 10219 O OD1 . ASN D 1 281 ? 108.942 27.806 16.876 1.00 150.30 ? 367 ASN D OD1 1 ATOM 10220 N ND2 . ASN D 1 281 ? 109.038 25.564 16.713 1.00 146.00 ? 367 ASN D ND2 1 ATOM 10221 N N . PRO D 1 282 ? 108.202 27.155 22.101 1.00 103.39 ? 368 PRO D N 1 ATOM 10222 C CA . PRO D 1 282 ? 107.333 27.203 23.280 1.00 94.52 ? 368 PRO D CA 1 ATOM 10223 C C . PRO D 1 282 ? 106.080 28.043 23.029 1.00 103.17 ? 368 PRO D C 1 ATOM 10224 O O . PRO D 1 282 ? 105.225 28.132 23.912 1.00 115.06 ? 368 PRO D O 1 ATOM 10225 C CB . PRO D 1 282 ? 108.216 27.869 24.343 1.00 94.92 ? 368 PRO D CB 1 ATOM 10226 C CG . PRO D 1 282 ? 109.621 27.838 23.787 1.00 91.55 ? 368 PRO D CG 1 ATOM 10227 C CD . PRO D 1 282 ? 109.459 27.892 22.308 1.00 95.36 ? 368 PRO D CD 1 ATOM 10228 N N . GLY D 1 283 ? 105.973 28.637 21.839 1.00 110.11 ? 369 GLY D N 1 ATOM 10229 C CA . GLY D 1 283 ? 104.819 29.452 21.465 1.00 115.15 ? 369 GLY D CA 1 ATOM 10230 C C . GLY D 1 283 ? 103.599 28.592 21.196 1.00 109.85 ? 369 GLY D C 1 ATOM 10231 O O . GLY D 1 283 ? 102.798 28.351 22.099 1.00 105.41 ? 369 GLY D O 1 ATOM 10232 N N . SER D 1 284 ? 103.436 28.160 19.948 1.00 107.78 ? 370 SER D N 1 ATOM 10233 C CA . SER D 1 284 ? 102.654 26.964 19.689 1.00 111.77 ? 370 SER D CA 1 ATOM 10234 C C . SER D 1 284 ? 103.644 25.901 20.098 1.00 108.64 ? 370 SER D C 1 ATOM 10235 O O . SER D 1 284 ? 104.841 26.091 19.914 1.00 126.94 ? 370 SER D O 1 ATOM 10236 C CB . SER D 1 284 ? 102.333 26.826 18.207 1.00 120.13 ? 370 SER D CB 1 ATOM 10237 O OG . SER D 1 284 ? 103.518 26.616 17.455 1.00 119.21 ? 370 SER D OG 1 ATOM 10238 N N . LYS D 1 285 ? 103.199 24.806 20.689 1.00 91.89 ? 371 LYS D N 1 ATOM 10239 C CA . LYS D 1 285 ? 104.194 23.880 21.212 1.00 95.65 ? 371 LYS D CA 1 ATOM 10240 C C . LYS D 1 285 ? 104.718 22.921 20.127 1.00 94.13 ? 371 LYS D C 1 ATOM 10241 O O . LYS D 1 285 ? 104.836 21.722 20.354 1.00 94.82 ? 371 LYS D O 1 ATOM 10242 C CB . LYS D 1 285 ? 103.674 23.139 22.464 1.00 96.99 ? 371 LYS D CB 1 ATOM 10243 C CG . LYS D 1 285 ? 103.561 24.003 23.745 1.00 99.66 ? 371 LYS D CG 1 ATOM 10244 C CD . LYS D 1 285 ? 102.193 24.709 23.865 1.00 117.45 ? 371 LYS D CD 1 ATOM 10245 C CE . LYS D 1 285 ? 102.273 26.011 24.692 1.00 127.58 ? 371 LYS D CE 1 ATOM 10246 N NZ . LYS D 1 285 ? 100.961 26.731 24.824 1.00 125.10 ? 371 LYS D NZ 1 ATOM 10247 N N . LYS D 1 286 ? 105.063 23.454 18.957 1.00 98.11 ? 372 LYS D N 1 ATOM 10248 C CA . LYS D 1 286 ? 105.402 22.600 17.814 1.00 97.80 ? 372 LYS D CA 1 ATOM 10249 C C . LYS D 1 286 ? 106.878 22.175 17.723 1.00 94.38 ? 372 LYS D C 1 ATOM 10250 O O . LYS D 1 286 ? 107.780 22.934 18.088 1.00 82.25 ? 372 LYS D O 1 ATOM 10251 C CB . LYS D 1 286 ? 104.935 23.241 16.499 1.00 94.86 ? 372 LYS D CB 1 ATOM 10252 C CG . LYS D 1 286 ? 103.425 23.402 16.432 1.00 105.26 ? 372 LYS D CG 1 ATOM 10253 C CD . LYS D 1 286 ? 102.891 23.302 15.013 1.00 114.30 ? 372 LYS D CD 1 ATOM 10254 C CE . LYS D 1 286 ? 101.414 22.915 15.030 1.00 128.94 ? 372 LYS D CE 1 ATOM 10255 N NZ . LYS D 1 286 ? 101.196 21.489 14.626 1.00 129.40 ? 372 LYS D NZ 1 ATOM 10256 N N . GLY D 1 287 ? 107.106 20.950 17.244 1.00 86.72 ? 373 GLY D N 1 ATOM 10257 C CA . GLY D 1 287 ? 108.447 20.458 16.981 1.00 84.41 ? 373 GLY D CA 1 ATOM 10258 C C . GLY D 1 287 ? 109.187 19.967 18.213 1.00 85.22 ? 373 GLY D C 1 ATOM 10259 O O . GLY D 1 287 ? 108.925 20.421 19.333 1.00 86.59 ? 373 GLY D O 1 ATOM 10260 N N . PHE D 1 288 ? 110.114 19.030 18.010 1.00 86.70 ? 374 PHE D N 1 ATOM 10261 C CA . PHE D 1 288 ? 110.957 18.526 19.100 1.00 85.68 ? 374 PHE D CA 1 ATOM 10262 C C . PHE D 1 288 ? 112.381 18.350 18.637 1.00 86.73 ? 374 PHE D C 1 ATOM 10263 O O . PHE D 1 288 ? 112.644 17.687 17.626 1.00 84.16 ? 374 PHE D O 1 ATOM 10264 C CB . PHE D 1 288 ? 110.465 17.186 19.645 1.00 81.27 ? 374 PHE D CB 1 ATOM 10265 C CG . PHE D 1 288 ? 111.293 16.656 20.808 1.00 86.26 ? 374 PHE D CG 1 ATOM 10266 C CD1 . PHE D 1 288 ? 110.959 16.990 22.125 1.00 92.15 ? 374 PHE D CD1 1 ATOM 10267 C CD2 . PHE D 1 288 ? 112.398 15.825 20.594 1.00 79.77 ? 374 PHE D CD2 1 ATOM 10268 C CE1 . PHE D 1 288 ? 111.704 16.505 23.217 1.00 86.92 ? 374 PHE D CE1 1 ATOM 10269 C CE2 . PHE D 1 288 ? 113.155 15.338 21.671 1.00 87.19 ? 374 PHE D CE2 1 ATOM 10270 C CZ . PHE D 1 288 ? 112.802 15.677 22.991 1.00 91.73 ? 374 PHE D CZ 1 ATOM 10271 N N . GLU D 1 289 ? 113.298 18.914 19.412 1.00 94.12 ? 375 GLU D N 1 ATOM 10272 C CA . GLU D 1 289 ? 114.713 18.835 19.101 1.00 96.38 ? 375 GLU D CA 1 ATOM 10273 C C . GLU D 1 289 ? 115.476 18.171 20.235 1.00 91.16 ? 375 GLU D C 1 ATOM 10274 O O . GLU D 1 289 ? 115.033 18.183 21.387 1.00 78.70 ? 375 GLU D O 1 ATOM 10275 C CB . GLU D 1 289 ? 115.289 20.229 18.797 1.00 88.35 ? 375 GLU D CB 1 ATOM 10276 C CG . GLU D 1 289 ? 115.361 21.188 19.981 1.00 94.00 ? 375 GLU D CG 1 ATOM 10277 C CD . GLU D 1 289 ? 115.954 22.538 19.597 1.00 110.10 ? 375 GLU D CD 1 ATOM 10278 O OE1 . GLU D 1 289 ? 116.789 22.576 18.668 1.00 104.30 ? 375 GLU D OE1 1 ATOM 10279 O OE2 . GLU D 1 289 ? 115.580 23.559 20.216 1.00 121.39 ? 375 GLU D OE2 1 ATOM 10280 N N . ILE D 1 290 ? 116.613 17.576 19.891 1.00 91.84 ? 376 ILE D N 1 ATOM 10281 C CA . ILE D 1 290 ? 117.518 17.018 20.887 1.00 89.09 ? 376 ILE D CA 1 ATOM 10282 C C . ILE D 1 290 ? 118.966 17.313 20.487 1.00 91.83 ? 376 ILE D C 1 ATOM 10283 O O . ILE D 1 290 ? 119.351 17.147 19.322 1.00 82.35 ? 376 ILE D O 1 ATOM 10284 C CB . ILE D 1 290 ? 117.276 15.508 21.111 1.00 86.72 ? 376 ILE D CB 1 ATOM 10285 C CG1 . ILE D 1 290 ? 118.213 14.975 22.193 1.00 92.27 ? 376 ILE D CG1 1 ATOM 10286 C CG2 . ILE D 1 290 ? 117.422 14.723 19.807 1.00 80.13 ? 376 ILE D CG2 1 ATOM 10287 C CD1 . ILE D 1 290 ? 117.844 13.596 22.677 1.00 86.42 ? 376 ILE D CD1 1 ATOM 10288 N N . TYR D 1 291 ? 119.754 17.759 21.466 1.00 92.72 ? 377 TYR D N 1 ATOM 10289 C CA . TYR D 1 291 ? 121.028 18.431 21.215 1.00 87.27 ? 377 TYR D CA 1 ATOM 10290 C C . TYR D 1 291 ? 122.168 17.768 21.973 1.00 90.33 ? 377 TYR D C 1 ATOM 10291 O O . TYR D 1 291 ? 122.060 17.545 23.187 1.00 95.37 ? 377 TYR D O 1 ATOM 10292 C CB . TYR D 1 291 ? 120.901 19.893 21.659 1.00 95.09 ? 377 TYR D CB 1 ATOM 10293 C CG . TYR D 1 291 ? 121.982 20.837 21.165 1.00 104.95 ? 377 TYR D CG 1 ATOM 10294 C CD1 . TYR D 1 291 ? 122.772 20.527 20.059 1.00 108.03 ? 377 TYR D CD1 1 ATOM 10295 C CD2 . TYR D 1 291 ? 122.206 22.049 21.811 1.00 103.47 ? 377 TYR D CD2 1 ATOM 10296 C CE1 . TYR D 1 291 ? 123.760 21.407 19.616 1.00 107.22 ? 377 TYR D CE1 1 ATOM 10297 C CE2 . TYR D 1 291 ? 123.184 22.925 21.381 1.00 107.49 ? 377 TYR D CE2 1 ATOM 10298 C CZ . TYR D 1 291 ? 123.958 22.605 20.285 1.00 103.15 ? 377 TYR D CZ 1 ATOM 10299 O OH . TYR D 1 291 ? 124.923 23.492 19.868 1.00 84.63 ? 377 TYR D OH 1 ATOM 10300 N N . LYS D 1 292 ? 123.261 17.465 21.269 1.00 92.98 ? 378 LYS D N 1 ATOM 10301 C CA . LYS D 1 292 ? 124.411 16.798 21.889 1.00 105.02 ? 378 LYS D CA 1 ATOM 10302 C C . LYS D 1 292 ? 125.416 17.784 22.522 1.00 108.04 ? 378 LYS D C 1 ATOM 10303 O O . LYS D 1 292 ? 125.542 18.927 22.079 1.00 108.38 ? 378 LYS D O 1 ATOM 10304 C CB . LYS D 1 292 ? 125.125 15.884 20.879 1.00 100.12 ? 378 LYS D CB 1 ATOM 10305 C CG . LYS D 1 292 ? 125.859 14.700 21.529 1.00 100.79 ? 378 LYS D CG 1 ATOM 10306 C CD . LYS D 1 292 ? 127.078 14.239 20.725 1.00 109.93 ? 378 LYS D CD 1 ATOM 10307 C CE . LYS D 1 292 ? 126.714 13.310 19.575 1.00 108.98 ? 378 LYS D CE 1 ATOM 10308 N NZ . LYS D 1 292 ? 127.895 12.995 18.718 1.00 102.20 ? 378 LYS D NZ 1 ATOM 10309 N N . PHE D 1 293 ? 126.108 17.331 23.567 1.00 103.56 ? 379 PHE D N 1 ATOM 10310 C CA . PHE D 1 293 ? 127.171 18.099 24.213 1.00 106.01 ? 379 PHE D CA 1 ATOM 10311 C C . PHE D 1 293 ? 128.355 17.184 24.526 1.00 112.06 ? 379 PHE D C 1 ATOM 10312 O O . PHE D 1 293 ? 128.173 16.017 24.875 1.00 111.86 ? 379 PHE D O 1 ATOM 10313 C CB . PHE D 1 293 ? 126.654 18.769 25.488 1.00 106.66 ? 379 PHE D CB 1 ATOM 10314 C CG . PHE D 1 293 ? 125.672 19.874 25.229 1.00 102.93 ? 379 PHE D CG 1 ATOM 10315 C CD1 . PHE D 1 293 ? 124.319 19.608 25.080 1.00 89.84 ? 379 PHE D CD1 1 ATOM 10316 C CD2 . PHE D 1 293 ? 126.104 21.182 25.124 1.00 103.69 ? 379 PHE D CD2 1 ATOM 10317 C CE1 . PHE D 1 293 ? 123.420 20.632 24.828 1.00 80.60 ? 379 PHE D CE1 1 ATOM 10318 C CE2 . PHE D 1 293 ? 125.203 22.205 24.872 1.00 99.73 ? 379 PHE D CE2 1 ATOM 10319 C CZ . PHE D 1 293 ? 123.858 21.927 24.728 1.00 85.23 ? 379 PHE D CZ 1 ATOM 10320 N N . LEU D 1 294 ? 129.569 17.706 24.406 1.00 115.52 ? 380 LEU D N 1 ATOM 10321 C CA . LEU D 1 294 ? 130.745 16.843 24.479 1.00 114.77 ? 380 LEU D CA 1 ATOM 10322 C C . LEU D 1 294 ? 131.383 16.859 25.858 1.00 112.09 ? 380 LEU D C 1 ATOM 10323 O O . LEU D 1 294 ? 132.478 17.386 26.050 1.00 107.85 ? 380 LEU D O 1 ATOM 10324 C CB . LEU D 1 294 ? 131.750 17.196 23.379 1.00 115.91 ? 380 LEU D CB 1 ATOM 10325 C CG . LEU D 1 294 ? 131.104 17.330 21.993 1.00 110.36 ? 380 LEU D CG 1 ATOM 10326 C CD1 . LEU D 1 294 ? 130.730 18.788 21.709 1.00 115.58 ? 380 LEU D CD1 1 ATOM 10327 C CD2 . LEU D 1 294 ? 131.972 16.751 20.874 1.00 88.58 ? 380 LEU D CD2 1 ATOM 10328 N N . GLY D 1 295 ? 130.673 16.262 26.809 1.00 111.85 ? 381 GLY D N 1 ATOM 10329 C CA . GLY D 1 295 ? 131.083 16.242 28.197 1.00 117.19 ? 381 GLY D CA 1 ATOM 10330 C C . GLY D 1 295 ? 129.866 16.474 29.066 1.00 118.91 ? 381 GLY D C 1 ATOM 10331 O O . GLY D 1 295 ? 128.735 16.348 28.595 1.00 116.19 ? 381 GLY D O 1 ATOM 10332 N N . THR D 1 296 ? 130.095 16.834 30.325 1.00 114.68 ? 382 THR D N 1 ATOM 10333 C CA . THR D 1 296 ? 129.013 17.023 31.290 1.00 107.99 ? 382 THR D CA 1 ATOM 10334 C C . THR D 1 296 ? 128.143 18.276 31.056 1.00 114.39 ? 382 THR D C 1 ATOM 10335 O O . THR D 1 296 ? 128.539 19.206 30.347 1.00 121.09 ? 382 THR D O 1 ATOM 10336 C CB . THR D 1 296 ? 129.563 17.023 32.737 1.00 103.90 ? 382 THR D CB 1 ATOM 10337 O OG1 . THR D 1 296 ? 128.700 17.794 33.588 1.00 104.65 ? 382 THR D OG1 1 ATOM 10338 C CG2 . THR D 1 296 ? 130.983 17.601 32.768 1.00 91.74 ? 382 THR D CG2 1 ATOM 10339 N N . LEU D 1 297 ? 126.955 18.274 31.664 1.00 111.98 ? 383 LEU D N 1 ATOM 10340 C CA . LEU D 1 297 ? 125.977 19.361 31.553 1.00 104.92 ? 383 LEU D CA 1 ATOM 10341 C C . LEU D 1 297 ? 126.264 20.385 32.644 1.00 111.38 ? 383 LEU D C 1 ATOM 10342 O O . LEU D 1 297 ? 125.677 21.471 32.667 1.00 114.84 ? 383 LEU D O 1 ATOM 10343 C CB . LEU D 1 297 ? 124.552 18.812 31.741 1.00 98.98 ? 383 LEU D CB 1 ATOM 10344 C CG . LEU D 1 297 ? 124.101 17.538 31.008 1.00 96.80 ? 383 LEU D CG 1 ATOM 10345 C CD1 . LEU D 1 297 ? 123.123 16.705 31.852 1.00 88.42 ? 383 LEU D CD1 1 ATOM 10346 C CD2 . LEU D 1 297 ? 123.473 17.876 29.654 1.00 91.91 ? 383 LEU D CD2 1 ATOM 10347 N N . PHE D 1 298 ? 127.186 20.028 33.536 1.00 109.13 ? 384 PHE D N 1 ATOM 10348 C CA . PHE D 1 298 ? 127.426 20.794 34.753 1.00 111.31 ? 384 PHE D CA 1 ATOM 10349 C C . PHE D 1 298 ? 128.784 21.506 34.767 1.00 111.74 ? 384 PHE D C 1 ATOM 10350 O O . PHE D 1 298 ? 129.283 21.906 35.825 1.00 113.47 ? 384 PHE D O 1 ATOM 10351 C CB . PHE D 1 298 ? 127.229 19.887 35.970 1.00 106.58 ? 384 PHE D CB 1 ATOM 10352 C CG . PHE D 1 298 ? 126.010 19.023 35.867 1.00 102.54 ? 384 PHE D CG 1 ATOM 10353 C CD1 . PHE D 1 298 ? 124.739 19.585 35.908 1.00 100.48 ? 384 PHE D CD1 1 ATOM 10354 C CD2 . PHE D 1 298 ? 126.127 17.653 35.689 1.00 101.27 ? 384 PHE D CD2 1 ATOM 10355 C CE1 . PHE D 1 298 ? 123.607 18.791 35.790 1.00 95.19 ? 384 PHE D CE1 1 ATOM 10356 C CE2 . PHE D 1 298 ? 125.001 16.854 35.571 1.00 95.53 ? 384 PHE D CE2 1 ATOM 10357 C CZ . PHE D 1 298 ? 123.741 17.421 35.622 1.00 93.34 ? 384 PHE D CZ 1 ATOM 10358 N N . SER D 1 299 ? 129.374 21.637 33.580 1.00 105.52 ? 385 SER D N 1 ATOM 10359 C CA . SER D 1 299 ? 130.484 22.554 33.350 1.00 114.50 ? 385 SER D CA 1 ATOM 10360 C C . SER D 1 299 ? 130.007 23.654 32.407 1.00 116.37 ? 385 SER D C 1 ATOM 10361 O O . SER D 1 299 ? 129.181 23.411 31.531 1.00 123.56 ? 385 SER D O 1 ATOM 10362 C CB . SER D 1 299 ? 131.684 21.834 32.747 1.00 113.04 ? 385 SER D CB 1 ATOM 10363 O OG . SER D 1 299 ? 132.637 22.771 32.274 1.00 106.83 ? 385 SER D OG 1 ATOM 10364 N N . VAL D 1 300 ? 130.519 24.864 32.586 1.00 117.82 ? 387 VAL D N 1 ATOM 10365 C CA . VAL D 1 300 ? 130.087 25.991 31.765 1.00 119.76 ? 387 VAL D CA 1 ATOM 10366 C C . VAL D 1 300 ? 130.879 26.009 30.470 1.00 122.29 ? 387 VAL D C 1 ATOM 10367 O O . VAL D 1 300 ? 130.517 26.676 29.497 1.00 117.35 ? 387 VAL D O 1 ATOM 10368 C CB . VAL D 1 300 ? 130.279 27.319 32.516 1.00 110.00 ? 387 VAL D CB 1 ATOM 10369 C CG1 . VAL D 1 300 ? 128.934 27.874 32.962 1.00 97.47 ? 387 VAL D CG1 1 ATOM 10370 C CG2 . VAL D 1 300 ? 131.210 27.115 33.716 1.00 105.20 ? 387 VAL D CG2 1 ATOM 10371 N N . GLN D 1 301 ? 131.953 25.230 30.474 1.00 126.95 ? 388 GLN D N 1 ATOM 10372 C CA . GLN D 1 301 ? 132.970 25.251 29.435 1.00 125.57 ? 388 GLN D CA 1 ATOM 10373 C C . GLN D 1 301 ? 132.669 24.287 28.307 1.00 128.07 ? 388 GLN D C 1 ATOM 10374 O O . GLN D 1 301 ? 133.519 24.037 27.453 1.00 135.29 ? 388 GLN D O 1 ATOM 10375 C CB . GLN D 1 301 ? 134.303 24.843 30.069 1.00 125.81 ? 388 GLN D CB 1 ATOM 10376 C CG . GLN D 1 301 ? 134.841 25.831 31.091 1.00 127.74 ? 388 GLN D CG 1 ATOM 10377 C CD . GLN D 1 301 ? 135.720 26.873 30.437 1.00 134.17 ? 388 GLN D CD 1 ATOM 10378 O OE1 . GLN D 1 301 ? 136.303 26.621 29.379 1.00 135.80 ? 388 GLN D OE1 1 ATOM 10379 N NE2 . GLN D 1 301 ? 135.815 28.052 31.050 1.00 131.71 ? 388 GLN D NE2 1 ATOM 10380 N N . THR D 1 302 ? 131.463 23.736 28.305 1.00 127.49 ? 390 THR D N 1 ATOM 10381 C CA . THR D 1 302 ? 131.174 22.555 27.487 1.00 124.28 ? 390 THR D CA 1 ATOM 10382 C C . THR D 1 302 ? 130.365 22.880 26.216 1.00 118.16 ? 390 THR D C 1 ATOM 10383 O O . THR D 1 302 ? 129.362 23.600 26.261 1.00 115.99 ? 390 THR D O 1 ATOM 10384 C CB . THR D 1 302 ? 130.558 21.442 28.365 1.00 121.79 ? 390 THR D CB 1 ATOM 10385 O OG1 . THR D 1 302 ? 131.617 20.693 28.983 1.00 121.30 ? 390 THR D OG1 1 ATOM 10386 C CG2 . THR D 1 302 ? 129.687 20.512 27.550 1.00 115.15 ? 390 THR D CG2 1 ATOM 10387 N N . VAL D 1 303 ? 130.814 22.325 25.092 1.00 116.48 ? 391 VAL D N 1 ATOM 10388 C CA . VAL D 1 303 ? 130.530 22.889 23.762 1.00 130.08 ? 391 VAL D CA 1 ATOM 10389 C C . VAL D 1 303 ? 129.080 22.913 23.242 1.00 128.07 ? 391 VAL D C 1 ATOM 10390 O O . VAL D 1 303 ? 128.390 23.934 23.358 1.00 135.56 ? 391 VAL D O 1 ATOM 10391 C CB . VAL D 1 303 ? 131.442 22.253 22.682 1.00 120.98 ? 391 VAL D CB 1 ATOM 10392 C CG1 . VAL D 1 303 ? 131.595 23.183 21.466 1.00 102.90 ? 391 VAL D CG1 1 ATOM 10393 C CG2 . VAL D 1 303 ? 132.799 21.918 23.286 1.00 121.01 ? 391 VAL D CG2 1 ATOM 10394 N N . GLY D 1 304 ? 128.639 21.805 22.652 1.00 108.91 ? 392 GLY D N 1 ATOM 10395 C CA . GLY D 1 304 ? 127.414 21.799 21.872 1.00 111.28 ? 392 GLY D CA 1 ATOM 10396 C C . GLY D 1 304 ? 127.673 21.396 20.427 1.00 119.08 ? 392 GLY D C 1 ATOM 10397 O O . GLY D 1 304 ? 127.999 22.228 19.572 1.00 119.81 ? 392 GLY D O 1 ATOM 10398 N N . ASN D 1 305 A 127.515 20.105 20.158 1.00 118.69 ? 392 ASN D N 1 ATOM 10399 C CA . ASN D 1 305 A 127.825 19.535 18.859 1.00 109.59 ? 392 ASN D CA 1 ATOM 10400 C C . ASN D 1 305 A 126.595 19.525 17.957 1.00 100.10 ? 392 ASN D C 1 ATOM 10401 O O . ASN D 1 305 A 126.107 20.576 17.540 1.00 101.22 ? 392 ASN D O 1 ATOM 10402 C CB . ASN D 1 305 A 128.374 18.113 19.041 1.00 112.53 ? 392 ASN D CB 1 ATOM 10403 C CG . ASN D 1 305 A 128.929 17.526 17.755 1.00 117.06 ? 392 ASN D CG 1 ATOM 10404 O OD1 . ASN D 1 305 A 129.356 18.259 16.862 1.00 124.87 ? 392 ASN D OD1 1 ATOM 10405 N ND2 . ASN D 1 305 A 128.913 16.197 17.651 1.00 106.46 ? 392 ASN D ND2 1 ATOM 10406 N N . ARG D 1 306 ? 126.094 18.325 17.686 1.00 97.14 ? 393 ARG D N 1 ATOM 10407 C CA . ARG D 1 306 ? 125.026 18.090 16.725 1.00 92.95 ? 393 ARG D CA 1 ATOM 10408 C C . ARG D 1 306 ? 123.631 18.292 17.323 1.00 97.24 ? 393 ARG D C 1 ATOM 10409 O O . ARG D 1 306 ? 123.331 17.796 18.411 1.00 86.17 ? 393 ARG D O 1 ATOM 10410 C CB . ARG D 1 306 ? 125.139 16.651 16.215 1.00 84.83 ? 393 ARG D CB 1 ATOM 10411 C CG . ARG D 1 306 ? 124.084 16.259 15.223 1.00 86.53 ? 393 ARG D CG 1 ATOM 10412 C CD . ARG D 1 306 ? 124.519 16.621 13.821 1.00 89.77 ? 393 ARG D CD 1 ATOM 10413 N NE . ARG D 1 306 ? 123.560 16.167 12.818 1.00 94.07 ? 393 ARG D NE 1 ATOM 10414 C CZ . ARG D 1 306 ? 123.628 14.995 12.190 1.00 95.46 ? 393 ARG D CZ 1 ATOM 10415 N NH1 . ARG D 1 306 ? 124.614 14.142 12.456 1.00 78.26 ? 393 ARG D NH1 1 ATOM 10416 N NH2 . ARG D 1 306 ? 122.704 14.673 11.293 1.00 101.34 ? 393 ARG D NH2 1 ATOM 10417 N N . ASN D 1 307 ? 122.784 19.022 16.605 1.00 104.77 ? 394 ASN D N 1 ATOM 10418 C CA . ASN D 1 307 ? 121.385 19.183 16.988 1.00 102.15 ? 394 ASN D CA 1 ATOM 10419 C C . ASN D 1 307 ? 120.488 18.394 16.026 1.00 102.30 ? 394 ASN D C 1 ATOM 10420 O O . ASN D 1 307 ? 120.587 18.546 14.804 1.00 95.84 ? 394 ASN D O 1 ATOM 10421 C CB . ASN D 1 307 ? 121.002 20.670 17.011 1.00 99.76 ? 394 ASN D CB 1 ATOM 10422 C CG . ASN D 1 307 ? 119.499 20.894 17.090 1.00 108.13 ? 394 ASN D CG 1 ATOM 10423 O OD1 . ASN D 1 307 ? 118.935 21.007 18.177 1.00 112.42 ? 394 ASN D OD1 1 ATOM 10424 N ND2 . ASN D 1 307 ? 118.846 20.979 15.930 1.00 117.44 ? 394 ASN D ND2 1 ATOM 10425 N N . TYR D 1 308 ? 119.625 17.541 16.574 1.00 103.94 ? 395 TYR D N 1 ATOM 10426 C CA . TYR D 1 308 ? 118.722 16.745 15.752 1.00 92.26 ? 395 TYR D CA 1 ATOM 10427 C C . TYR D 1 308 ? 117.297 17.284 15.834 1.00 92.62 ? 395 TYR D C 1 ATOM 10428 O O . TYR D 1 308 ? 116.766 17.483 16.926 1.00 95.81 ? 395 TYR D O 1 ATOM 10429 C CB . TYR D 1 308 ? 118.751 15.289 16.199 1.00 89.99 ? 395 TYR D CB 1 ATOM 10430 C CG . TYR D 1 308 ? 119.973 14.507 15.766 1.00 89.11 ? 395 TYR D CG 1 ATOM 10431 C CD1 . TYR D 1 308 ? 120.138 14.118 14.441 1.00 89.65 ? 395 TYR D CD1 1 ATOM 10432 C CD2 . TYR D 1 308 ? 120.944 14.119 16.692 1.00 88.41 ? 395 TYR D CD2 1 ATOM 10433 C CE1 . TYR D 1 308 ? 121.250 13.379 14.040 1.00 89.40 ? 395 TYR D CE1 1 ATOM 10434 C CE2 . TYR D 1 308 ? 122.059 13.377 16.303 1.00 91.42 ? 395 TYR D CE2 1 ATOM 10435 C CZ . TYR D 1 308 ? 122.206 13.012 14.977 1.00 91.90 ? 395 TYR D CZ 1 ATOM 10436 O OH . TYR D 1 308 ? 123.309 12.278 14.592 1.00 87.77 ? 395 TYR D OH 1 ATOM 10437 N N . GLN D 1 309 ? 116.691 17.522 14.673 1.00 96.62 ? 396 GLN D N 1 ATOM 10438 C CA . GLN D 1 309 ? 115.315 18.018 14.581 1.00 101.27 ? 396 GLN D CA 1 ATOM 10439 C C . GLN D 1 309 ? 114.363 16.865 14.257 1.00 100.37 ? 396 GLN D C 1 ATOM 10440 O O . GLN D 1 309 ? 113.858 16.752 13.131 1.00 99.67 ? 396 GLN D O 1 ATOM 10441 C CB . GLN D 1 309 ? 115.205 19.096 13.496 1.00 105.17 ? 396 GLN D CB 1 ATOM 10442 C CG . GLN D 1 309 ? 114.830 20.487 14.002 1.00 116.47 ? 396 GLN D CG 1 ATOM 10443 C CD . GLN D 1 309 ? 116.032 21.401 14.192 1.00 128.03 ? 396 GLN D CD 1 ATOM 10444 O OE1 . GLN D 1 309 ? 117.118 21.136 13.673 1.00 138.04 ? 396 GLN D OE1 1 ATOM 10445 N NE2 . GLN D 1 309 ? 115.840 22.484 14.939 1.00 121.22 ? 396 GLN D NE2 1 ATOM 10446 N N . LEU D 1 310 ? 114.117 16.018 15.255 1.00 85.89 ? 397 LEU D N 1 ATOM 10447 C CA . LEU D 1 310 ? 113.362 14.781 15.065 1.00 74.92 ? 397 LEU D CA 1 ATOM 10448 C C . LEU D 1 310 ? 111.896 14.991 14.694 1.00 76.69 ? 397 LEU D C 1 ATOM 10449 O O . LEU D 1 310 ? 111.287 14.137 14.053 1.00 76.30 ? 397 LEU D O 1 ATOM 10450 C CB . LEU D 1 310 ? 113.443 13.917 16.325 1.00 69.63 ? 397 LEU D CB 1 ATOM 10451 C CG . LEU D 1 310 ? 114.820 13.454 16.799 1.00 76.37 ? 397 LEU D CG 1 ATOM 10452 C CD1 . LEU D 1 310 ? 114.693 12.588 18.057 1.00 65.76 ? 397 LEU D CD1 1 ATOM 10453 C CD2 . LEU D 1 310 ? 115.533 12.692 15.689 1.00 83.76 ? 397 LEU D CD2 1 ATOM 10454 N N . LEU D 1 311 ? 111.333 16.123 15.100 1.00 78.26 ? 398 LEU D N 1 ATOM 10455 C CA . LEU D 1 311 ? 109.917 16.392 14.881 1.00 76.12 ? 398 LEU D CA 1 ATOM 10456 C C . LEU D 1 311 ? 109.692 17.864 14.513 1.00 96.03 ? 398 LEU D C 1 ATOM 10457 O O . LEU D 1 311 ? 110.386 18.745 15.020 1.00 95.81 ? 398 LEU D O 1 ATOM 10458 C CB . LEU D 1 311 ? 109.140 16.029 16.147 1.00 72.05 ? 398 LEU D CB 1 ATOM 10459 C CG . LEU D 1 311 ? 108.033 14.966 16.079 1.00 83.94 ? 398 LEU D CG 1 ATOM 10460 C CD1 . LEU D 1 311 ? 108.309 13.912 15.030 1.00 78.53 ? 398 LEU D CD1 1 ATOM 10461 C CD2 . LEU D 1 311 ? 107.853 14.295 17.440 1.00 84.22 ? 398 LEU D CD2 1 ATOM 10462 N N . SER D 1 312 ? 108.724 18.127 13.635 1.00 102.95 ? 399 SER D N 1 ATOM 10463 C CA . SER D 1 312 ? 108.453 19.488 13.163 1.00 96.16 ? 399 SER D CA 1 ATOM 10464 C C . SER D 1 312 ? 106.985 19.891 13.277 1.00 100.35 ? 399 SER D C 1 ATOM 10465 O O . SER D 1 312 ? 106.622 20.682 14.146 1.00 112.80 ? 399 SER D O 1 ATOM 10466 C CB . SER D 1 312 ? 108.889 19.651 11.702 1.00 92.71 ? 399 SER D CB 1 ATOM 10467 O OG . SER D 1 312 ? 110.239 19.269 11.509 1.00 90.54 ? 399 SER D OG 1 ATOM 10468 N N . ASN D 1 313 ? 106.153 19.348 12.388 1.00 106.55 ? 401 ASN D N 1 ATOM 10469 C CA . ASN D 1 313 ? 104.763 19.785 12.234 1.00 116.78 ? 401 ASN D CA 1 ATOM 10470 C C . ASN D 1 313 ? 103.824 19.300 13.326 1.00 116.48 ? 401 ASN D C 1 ATOM 10471 O O . ASN D 1 313 ? 102.604 19.472 13.237 1.00 124.11 ? 401 ASN D O 1 ATOM 10472 C CB . ASN D 1 313 ? 104.206 19.353 10.868 1.00 118.88 ? 401 ASN D CB 1 ATOM 10473 C CG . ASN D 1 313 ? 104.827 20.111 9.713 1.00 132.69 ? 401 ASN D CG 1 ATOM 10474 O OD1 . ASN D 1 313 ? 104.256 21.084 9.214 1.00 134.32 ? 401 ASN D OD1 1 ATOM 10475 N ND2 . ASN D 1 313 ? 105.995 19.660 9.270 1.00 133.72 ? 401 ASN D ND2 1 ATOM 10476 N N . SER D 1 314 ? 104.397 18.706 14.360 1.00 107.09 ? 402 SER D N 1 ATOM 10477 C CA . SER D 1 314 ? 103.597 18.098 15.400 1.00 103.86 ? 402 SER D CA 1 ATOM 10478 C C . SER D 1 314 ? 103.629 18.897 16.711 1.00 99.07 ? 402 SER D C 1 ATOM 10479 O O . SER D 1 314 ? 104.689 19.374 17.127 1.00 91.83 ? 402 SER D O 1 ATOM 10480 C CB . SER D 1 314 ? 104.081 16.671 15.620 1.00 97.33 ? 402 SER D CB 1 ATOM 10481 O OG . SER D 1 314 ? 103.345 16.100 16.667 1.00 110.25 ? 402 SER D OG 1 ATOM 10482 N N . THR D 1 315 ? 102.466 19.070 17.342 1.00 95.38 ? 403 THR D N 1 ATOM 10483 C CA . THR D 1 315 ? 102.392 19.818 18.598 1.00 95.59 ? 403 THR D CA 1 ATOM 10484 C C . THR D 1 315 ? 102.667 18.866 19.768 1.00 98.74 ? 403 THR D C 1 ATOM 10485 O O . THR D 1 315 ? 101.906 17.923 20.012 1.00 103.84 ? 403 THR D O 1 ATOM 10486 C CB . THR D 1 315 ? 101.055 20.620 18.746 1.00 85.53 ? 403 THR D CB 1 ATOM 10487 O OG1 . THR D 1 315 ? 100.435 20.319 20.000 1.00 80.59 ? 403 THR D OG1 1 ATOM 10488 C CG2 . THR D 1 315 ? 100.077 20.332 17.587 1.00 90.69 ? 403 THR D CG2 1 ATOM 10489 N N . ILE D 1 316 ? 103.777 19.098 20.467 1.00 89.64 ? 404 ILE D N 1 ATOM 10490 C CA . ILE D 1 316 ? 104.303 18.103 21.402 1.00 88.78 ? 404 ILE D CA 1 ATOM 10491 C C . ILE D 1 316 ? 104.126 18.485 22.887 1.00 87.35 ? 404 ILE D C 1 ATOM 10492 O O . ILE D 1 316 ? 103.707 19.600 23.207 1.00 83.98 ? 404 ILE D O 1 ATOM 10493 C CB . ILE D 1 316 ? 105.778 17.718 21.062 1.00 104.72 ? 404 ILE D CB 1 ATOM 10494 C CG1 . ILE D 1 316 ? 106.768 18.637 21.756 1.00 105.37 ? 404 ILE D CG1 1 ATOM 10495 C CG2 . ILE D 1 316 ? 106.020 17.697 19.545 1.00 95.85 ? 404 ILE D CG2 1 ATOM 10496 C CD1 . ILE D 1 316 ? 107.667 17.887 22.695 1.00 108.01 ? 404 ILE D CD1 1 ATOM 10497 N N . GLY D 1 317 ? 104.418 17.548 23.788 1.00 80.01 ? 405 GLY D N 1 ATOM 10498 C CA . GLY D 1 317 ? 104.127 17.732 25.203 1.00 79.13 ? 405 GLY D CA 1 ATOM 10499 C C . GLY D 1 317 ? 105.119 17.064 26.142 1.00 85.31 ? 405 GLY D C 1 ATOM 10500 O O . GLY D 1 317 ? 106.304 17.441 26.189 1.00 75.27 ? 405 GLY D O 1 ATOM 10501 N N . ARG D 1 318 ? 104.651 16.073 26.903 1.00 86.17 ? 406 ARG D N 1 ATOM 10502 C CA . ARG D 1 318 ? 105.536 15.406 27.861 1.00 78.22 ? 406 ARG D CA 1 ATOM 10503 C C . ARG D 1 318 ? 106.528 14.501 27.156 1.00 75.28 ? 406 ARG D C 1 ATOM 10504 O O . ARG D 1 318 ? 106.253 13.979 26.071 1.00 71.34 ? 406 ARG D O 1 ATOM 10505 C CB . ARG D 1 318 ? 104.755 14.616 28.912 1.00 65.51 ? 406 ARG D CB 1 ATOM 10506 C CG . ARG D 1 318 ? 103.891 15.469 29.836 1.00 64.99 ? 406 ARG D CG 1 ATOM 10507 C CD . ARG D 1 318 ? 103.227 14.627 30.930 1.00 62.42 ? 406 ARG D CD 1 ATOM 10508 N NE . ARG D 1 318 ? 102.944 13.277 30.450 1.00 76.83 ? 406 ARG D NE 1 ATOM 10509 C CZ . ARG D 1 318 ? 103.510 12.173 30.928 1.00 78.91 ? 406 ARG D CZ 1 ATOM 10510 N NH1 . ARG D 1 318 ? 104.374 12.237 31.925 1.00 93.51 ? 406 ARG D NH1 1 ATOM 10511 N NH2 . ARG D 1 318 ? 103.204 11.003 30.412 1.00 72.66 ? 406 ARG D NH2 1 ATOM 10512 N N . SER D 1 319 ? 107.697 14.347 27.765 1.00 86.34 ? 407 SER D N 1 ATOM 10513 C CA . SER D 1 319 ? 108.686 13.384 27.292 1.00 83.74 ? 407 SER D CA 1 ATOM 10514 C C . SER D 1 319 ? 109.410 12.794 28.493 1.00 73.66 ? 407 SER D C 1 ATOM 10515 O O . SER D 1 319 ? 109.490 13.422 29.543 1.00 74.67 ? 407 SER D O 1 ATOM 10516 C CB . SER D 1 319 ? 109.677 14.018 26.305 1.00 72.91 ? 407 SER D CB 1 ATOM 10517 O OG . SER D 1 319 ? 110.374 15.107 26.883 1.00 70.77 ? 407 SER D OG 1 ATOM 10518 N N . GLY D 1 320 ? 109.931 11.585 28.341 1.00 71.14 ? 408 GLY D N 1 ATOM 10519 C CA . GLY D 1 320 ? 110.606 10.932 29.441 1.00 72.51 ? 408 GLY D CA 1 ATOM 10520 C C . GLY D 1 320 ? 111.528 9.829 28.982 1.00 78.78 ? 408 GLY D C 1 ATOM 10521 O O . GLY D 1 320 ? 111.594 9.529 27.786 1.00 72.92 ? 408 GLY D O 1 ATOM 10522 N N . LEU D 1 321 ? 112.224 9.221 29.943 1.00 83.44 ? 409 LEU D N 1 ATOM 10523 C CA . LEU D 1 321 ? 113.241 8.207 29.674 1.00 77.54 ? 409 LEU D CA 1 ATOM 10524 C C . LEU D 1 321 ? 112.783 6.796 29.999 1.00 80.12 ? 409 LEU D C 1 ATOM 10525 O O . LEU D 1 321 ? 111.898 6.594 30.846 1.00 83.57 ? 409 LEU D O 1 ATOM 10526 C CB . LEU D 1 321 ? 114.489 8.504 30.504 1.00 67.70 ? 409 LEU D CB 1 ATOM 10527 C CG . LEU D 1 321 ? 115.657 9.210 29.828 1.00 77.33 ? 409 LEU D CG 1 ATOM 10528 C CD1 . LEU D 1 321 ? 115.213 9.989 28.585 1.00 61.57 ? 409 LEU D CD1 1 ATOM 10529 C CD2 . LEU D 1 321 ? 116.314 10.127 30.849 1.00 78.49 ? 409 LEU D CD2 1 ATOM 10530 N N . TYR D 1 322 ? 113.394 5.825 29.318 1.00 75.94 ? 410 TYR D N 1 ATOM 10531 C CA . TYR D 1 322 ? 113.259 4.414 29.687 1.00 76.07 ? 410 TYR D CA 1 ATOM 10532 C C . TYR D 1 322 ? 114.455 3.568 29.236 1.00 82.57 ? 410 TYR D C 1 ATOM 10533 O O . TYR D 1 322 ? 115.057 3.815 28.180 1.00 76.82 ? 410 TYR D O 1 ATOM 10534 C CB . TYR D 1 322 ? 111.926 3.821 29.204 1.00 63.73 ? 410 TYR D CB 1 ATOM 10535 C CG . TYR D 1 322 ? 111.791 3.576 27.712 1.00 71.43 ? 410 TYR D CG 1 ATOM 10536 C CD1 . TYR D 1 322 ? 111.321 4.572 26.856 1.00 72.78 ? 410 TYR D CD1 1 ATOM 10537 C CD2 . TYR D 1 322 ? 112.097 2.334 27.163 1.00 64.23 ? 410 TYR D CD2 1 ATOM 10538 C CE1 . TYR D 1 322 ? 111.179 4.340 25.491 1.00 67.15 ? 410 TYR D CE1 1 ATOM 10539 C CE2 . TYR D 1 322 ? 111.956 2.094 25.802 1.00 65.29 ? 410 TYR D CE2 1 ATOM 10540 C CZ . TYR D 1 322 ? 111.493 3.097 24.971 1.00 66.90 ? 410 TYR D CZ 1 ATOM 10541 O OH . TYR D 1 322 ? 111.358 2.845 23.619 1.00 78.39 ? 410 TYR D OH 1 ATOM 10542 N N . GLN D 1 323 ? 114.812 2.589 30.058 1.00 79.49 ? 411 GLN D N 1 ATOM 10543 C CA . GLN D 1 323 ? 115.901 1.690 29.717 1.00 78.23 ? 411 GLN D CA 1 ATOM 10544 C C . GLN D 1 323 ? 115.345 0.298 29.431 1.00 72.28 ? 411 GLN D C 1 ATOM 10545 O O . GLN D 1 323 ? 114.907 -0.399 30.354 1.00 69.46 ? 411 GLN D O 1 ATOM 10546 C CB . GLN D 1 323 ? 116.932 1.645 30.854 1.00 72.49 ? 411 GLN D CB 1 ATOM 10547 C CG . GLN D 1 323 ? 117.641 2.981 31.093 1.00 74.12 ? 411 GLN D CG 1 ATOM 10548 C CD . GLN D 1 323 ? 118.564 2.965 32.300 1.00 75.71 ? 411 GLN D CD 1 ATOM 10549 O OE1 . GLN D 1 323 ? 118.116 3.063 33.448 1.00 77.33 ? 411 GLN D OE1 1 ATOM 10550 N NE2 . GLN D 1 323 ? 119.861 2.843 32.047 1.00 79.95 ? 411 GLN D NE2 1 ATOM 10551 N N . PRO D 1 324 ? 115.335 -0.100 28.146 1.00 75.91 ? 412 PRO D N 1 ATOM 10552 C CA . PRO D 1 324 ? 114.994 -1.485 27.808 1.00 73.50 ? 412 PRO D CA 1 ATOM 10553 C C . PRO D 1 324 ? 115.900 -2.413 28.576 1.00 80.33 ? 412 PRO D C 1 ATOM 10554 O O . PRO D 1 324 ? 117.094 -2.453 28.323 1.00 81.75 ? 412 PRO D O 1 ATOM 10555 C CB . PRO D 1 324 ? 115.330 -1.593 26.329 1.00 52.08 ? 412 PRO D CB 1 ATOM 10556 C CG . PRO D 1 324 ? 115.245 -0.193 25.822 1.00 77.87 ? 412 PRO D CG 1 ATOM 10557 C CD . PRO D 1 324 ? 115.695 0.686 26.960 1.00 85.67 ? 412 PRO D CD 1 ATOM 10558 N N . ALA D 1 325 ? 115.331 -3.142 29.531 1.00 89.59 ? 413 ALA D N 1 ATOM 10559 C CA . ALA D 1 325 ? 116.119 -3.975 30.434 1.00 112.36 ? 413 ALA D CA 1 ATOM 10560 C C . ALA D 1 325 ? 115.939 -5.472 30.197 1.00 122.15 ? 413 ALA D C 1 ATOM 10561 O O . ALA D 1 325 ? 115.356 -6.175 31.022 1.00 135.98 ? 413 ALA D O 1 ATOM 10562 C CB . ALA D 1 325 ? 115.804 -3.627 31.882 1.00 126.20 ? 413 ALA D CB 1 ATOM 10563 N N . TYR D 1 326 A 116.454 -5.952 29.072 1.00 120.75 ? 413 TYR D N 1 ATOM 10564 C CA . TYR D 1 326 A 116.467 -7.380 28.774 1.00 135.01 ? 413 TYR D CA 1 ATOM 10565 C C . TYR D 1 326 A 117.732 -7.711 27.995 1.00 141.05 ? 413 TYR D C 1 ATOM 10566 O O . TYR D 1 326 A 117.682 -7.996 26.799 1.00 138.58 ? 413 TYR D O 1 ATOM 10567 C CB . TYR D 1 326 A 115.224 -7.805 27.982 1.00 138.90 ? 413 TYR D CB 1 ATOM 10568 C CG . TYR D 1 326 A 114.576 -6.705 27.169 1.00 143.23 ? 413 TYR D CG 1 ATOM 10569 C CD1 . TYR D 1 326 A 114.115 -5.545 27.775 1.00 146.99 ? 413 TYR D CD1 1 ATOM 10570 C CD2 . TYR D 1 326 A 114.418 -6.833 25.796 1.00 143.11 ? 413 TYR D CD2 1 ATOM 10571 C CE1 . TYR D 1 326 A 113.519 -4.540 27.036 1.00 150.39 ? 413 TYR D CE1 1 ATOM 10572 C CE2 . TYR D 1 326 A 113.825 -5.834 25.048 1.00 145.73 ? 413 TYR D CE2 1 ATOM 10573 C CZ . TYR D 1 326 A 113.377 -4.690 25.673 1.00 154.80 ? 413 TYR D CZ 1 ATOM 10574 O OH . TYR D 1 326 A 112.785 -3.693 24.933 1.00 161.69 ? 413 TYR D OH 1 ATOM 10575 N N . GLU D 1 327 ? 118.869 -7.660 28.682 1.00 146.69 ? 414 GLU D N 1 ATOM 10576 C CA . GLU D 1 327 ? 120.171 -7.833 28.023 1.00 152.86 ? 414 GLU D CA 1 ATOM 10577 C C . GLU D 1 327 ? 120.996 -9.040 28.548 1.00 145.15 ? 414 GLU D C 1 ATOM 10578 O O . GLU D 1 327 ? 120.459 -10.002 29.114 1.00 139.44 ? 414 GLU D O 1 ATOM 10579 C CB . GLU D 1 327 ? 120.987 -6.527 28.188 1.00 158.51 ? 414 GLU D CB 1 ATOM 10580 C CG . GLU D 1 327 ? 121.792 -6.378 29.545 1.00 133.20 ? 414 GLU D CG 1 ATOM 10581 C CD . GLU D 1 327 ? 120.922 -6.408 30.846 1.00 166.85 ? 414 GLU D CD 1 ATOM 10582 O OE1 . GLU D 1 327 ? 120.003 -7.228 30.924 1.00 168.13 ? 414 GLU D OE1 1 ATOM 10583 O OE2 . GLU D 1 327 ? 121.256 -5.627 31.729 1.00 162.63 ? 414 GLU D OE2 1 ATOM 10584 N N . SER D 1 328 ? 122.306 -8.969 28.299 1.00 148.03 ? 415 SER D N 1 ATOM 10585 C CA . SER D 1 328 ? 123.352 -9.840 28.846 1.00 146.73 ? 415 SER D CA 1 ATOM 10586 C C . SER D 1 328 ? 124.626 -9.051 28.555 1.00 152.21 ? 415 SER D C 1 ATOM 10587 O O . SER D 1 328 ? 125.759 -9.528 28.716 1.00 157.47 ? 415 SER D O 1 ATOM 10588 C CB . SER D 1 328 ? 123.377 -11.149 28.062 1.00 143.55 ? 415 SER D CB 1 ATOM 10589 O OG . SER D 1 328 ? 123.124 -10.912 26.688 1.00 138.37 ? 415 SER D OG 1 ATOM 10590 N N . ARG D 1 329 A 124.392 -7.797 28.179 1.00 145.94 ? 415 ARG D N 1 ATOM 10591 C CA . ARG D 1 329 A 125.193 -7.089 27.186 1.00 133.36 ? 415 ARG D CA 1 ATOM 10592 C C . ARG D 1 329 A 126.466 -6.352 27.592 1.00 129.19 ? 415 ARG D C 1 ATOM 10593 O O . ARG D 1 329 A 126.818 -6.244 28.771 1.00 130.72 ? 415 ARG D O 1 ATOM 10594 C CB . ARG D 1 329 A 124.278 -6.118 26.436 1.00 130.60 ? 415 ARG D CB 1 ATOM 10595 C CG . ARG D 1 329 A 123.509 -6.775 25.324 1.00 128.68 ? 415 ARG D CG 1 ATOM 10596 C CD . ARG D 1 329 A 124.491 -7.312 24.310 1.00 132.05 ? 415 ARG D CD 1 ATOM 10597 N NE . ARG D 1 329 A 123.854 -7.748 23.072 1.00 123.13 ? 415 ARG D NE 1 ATOM 10598 C CZ . ARG D 1 329 A 123.379 -6.924 22.147 1.00 105.61 ? 415 ARG D CZ 1 ATOM 10599 N NH1 . ARG D 1 329 A 123.446 -5.608 22.321 1.00 102.36 ? 415 ARG D NH1 1 ATOM 10600 N NH2 . ARG D 1 329 A 122.831 -7.419 21.052 1.00 105.65 ? 415 ARG D NH2 1 ATOM 10601 N N . ASP D 1 330 ? 127.129 -5.839 26.558 1.00 122.32 ? 416 ASP D N 1 ATOM 10602 C CA . ASP D 1 330 ? 128.344 -5.057 26.684 1.00 125.93 ? 416 ASP D CA 1 ATOM 10603 C C . ASP D 1 330 ? 127.998 -3.598 26.933 1.00 123.79 ? 416 ASP D C 1 ATOM 10604 O O . ASP D 1 330 ? 128.876 -2.754 27.123 1.00 129.84 ? 416 ASP D O 1 ATOM 10605 C CB . ASP D 1 330 ? 129.160 -5.171 25.397 1.00 128.36 ? 416 ASP D CB 1 ATOM 10606 C CG . ASP D 1 330 ? 130.595 -4.691 25.568 1.00 141.21 ? 416 ASP D CG 1 ATOM 10607 O OD1 . ASP D 1 330 ? 131.266 -5.128 26.535 1.00 141.03 ? 416 ASP D OD1 1 ATOM 10608 O OD2 . ASP D 1 330 ? 131.058 -3.881 24.735 1.00 144.60 ? 416 ASP D OD2 1 ATOM 10609 N N . CYS D 1 331 ? 126.706 -3.303 26.929 1.00 110.59 ? 417 CYS D N 1 ATOM 10610 C CA . CYS D 1 331 ? 126.251 -1.923 27.042 1.00 103.56 ? 417 CYS D CA 1 ATOM 10611 C C . CYS D 1 331 ? 124.758 -1.833 27.337 1.00 100.92 ? 417 CYS D C 1 ATOM 10612 O O . CYS D 1 331 ? 123.966 -2.640 26.854 1.00 95.36 ? 417 CYS D O 1 ATOM 10613 C CB . CYS D 1 331 ? 126.594 -1.156 25.747 1.00 94.88 ? 417 CYS D CB 1 ATOM 10614 S SG . CYS D 1 331 ? 125.259 -0.142 25.083 1.00 132.60 ? 417 CYS D SG 1 ATOM 10615 N N . GLN D 1 332 ? 124.383 -0.861 28.159 1.00 102.34 ? 418 GLN D N 1 ATOM 10616 C CA . GLN D 1 332 ? 122.975 -0.602 28.430 1.00 88.88 ? 418 GLN D CA 1 ATOM 10617 C C . GLN D 1 332 ? 122.394 0.372 27.408 1.00 86.35 ? 418 GLN D C 1 ATOM 10618 O O . GLN D 1 332 ? 122.883 1.498 27.263 1.00 80.90 ? 418 GLN D O 1 ATOM 10619 C CB . GLN D 1 332 ? 122.793 -0.013 29.831 1.00 81.74 ? 418 GLN D CB 1 ATOM 10620 C CG . GLN D 1 332 ? 121.387 0.474 30.093 1.00 73.35 ? 418 GLN D CG 1 ATOM 10621 C CD . GLN D 1 332 ? 120.385 -0.658 30.071 1.00 75.76 ? 418 GLN D CD 1 ATOM 10622 O OE1 . GLN D 1 332 ? 120.569 -1.673 30.745 1.00 82.44 ? 418 GLN D OE1 1 ATOM 10623 N NE2 . GLN D 1 332 ? 119.326 -0.501 29.278 1.00 63.59 ? 418 GLN D NE2 1 ATOM 10624 N N . GLU D 1 333 ? 121.357 -0.062 26.696 1.00 86.20 ? 419 GLU D N 1 ATOM 10625 C CA . GLU D 1 333 ? 120.622 0.831 25.804 1.00 79.41 ? 419 GLU D CA 1 ATOM 10626 C C . GLU D 1 333 ? 119.831 1.866 26.622 1.00 77.47 ? 419 GLU D C 1 ATOM 10627 O O . GLU D 1 333 ? 119.488 1.638 27.787 1.00 85.96 ? 419 GLU D O 1 ATOM 10628 C CB . GLU D 1 333 ? 119.701 0.020 24.875 1.00 76.56 ? 419 GLU D CB 1 ATOM 10629 C CG . GLU D 1 333 ? 118.843 0.830 23.894 1.00 89.14 ? 419 GLU D CG 1 ATOM 10630 C CD . GLU D 1 333 ? 119.620 1.397 22.699 1.00 97.34 ? 419 GLU D CD 1 ATOM 10631 O OE1 . GLU D 1 333 ? 120.738 0.910 22.399 1.00 97.15 ? 419 GLU D OE1 1 ATOM 10632 O OE2 . GLU D 1 333 ? 119.090 2.331 22.054 1.00 95.07 ? 419 GLU D OE2 1 ATOM 10633 N N . LEU D 1 334 ? 119.573 3.018 26.018 1.00 84.22 ? 420 LEU D N 1 ATOM 10634 C CA . LEU D 1 334 ? 118.778 4.055 26.654 1.00 79.93 ? 420 LEU D CA 1 ATOM 10635 C C . LEU D 1 334 ? 117.808 4.637 25.631 1.00 81.79 ? 420 LEU D C 1 ATOM 10636 O O . LEU D 1 334 ? 118.180 4.905 24.485 1.00 85.06 ? 420 LEU D O 1 ATOM 10637 C CB . LEU D 1 334 ? 119.685 5.146 27.215 1.00 78.72 ? 420 LEU D CB 1 ATOM 10638 C CG . LEU D 1 334 ? 118.963 6.335 27.843 1.00 82.10 ? 420 LEU D CG 1 ATOM 10639 C CD1 . LEU D 1 334 ? 117.963 5.835 28.863 1.00 84.21 ? 420 LEU D CD1 1 ATOM 10640 C CD2 . LEU D 1 334 ? 119.951 7.308 28.480 1.00 85.22 ? 420 LEU D CD2 1 ATOM 10641 N N . CYS D 1 335 ? 116.559 4.818 26.042 1.00 82.38 ? 421 CYS D N 1 ATOM 10642 C CA . CYS D 1 335 ? 115.529 5.318 25.134 1.00 78.67 ? 421 CYS D CA 1 ATOM 10643 C C . CYS D 1 335 ? 114.719 6.462 25.734 1.00 76.65 ? 421 CYS D C 1 ATOM 10644 O O . CYS D 1 335 ? 114.829 6.780 26.924 1.00 76.56 ? 421 CYS D O 1 ATOM 10645 C CB . CYS D 1 335 ? 114.565 4.186 24.750 1.00 58.65 ? 421 CYS D CB 1 ATOM 10646 S SG . CYS D 1 335 ? 115.318 2.782 23.879 1.00 71.93 ? 421 CYS D SG 1 ATOM 10647 N N . PHE D 1 336 ? 113.882 7.069 24.901 1.00 63.42 ? 422 PHE D N 1 ATOM 10648 C CA . PHE D 1 336 ? 112.950 8.062 25.407 1.00 72.26 ? 422 PHE D CA 1 ATOM 10649 C C . PHE D 1 336 ? 111.610 8.055 24.644 1.00 69.94 ? 422 PHE D C 1 ATOM 10650 O O . PHE D 1 336 ? 111.554 7.719 23.460 1.00 68.01 ? 422 PHE D O 1 ATOM 10651 C CB . PHE D 1 336 ? 113.603 9.461 25.457 1.00 81.06 ? 422 PHE D CB 1 ATOM 10652 C CG . PHE D 1 336 ? 113.844 10.081 24.104 1.00 89.08 ? 422 PHE D CG 1 ATOM 10653 C CD1 . PHE D 1 336 ? 115.032 9.854 23.411 1.00 91.70 ? 422 PHE D CD1 1 ATOM 10654 C CD2 . PHE D 1 336 ? 112.884 10.903 23.526 1.00 84.77 ? 422 PHE D CD2 1 ATOM 10655 C CE1 . PHE D 1 336 ? 115.249 10.427 22.153 1.00 82.05 ? 422 PHE D CE1 1 ATOM 10656 C CE2 . PHE D 1 336 ? 113.093 11.480 22.275 1.00 77.78 ? 422 PHE D CE2 1 ATOM 10657 C CZ . PHE D 1 336 ? 114.276 11.240 21.588 1.00 72.69 ? 422 PHE D CZ 1 ATOM 10658 N N . TRP D 1 337 ? 110.531 8.396 25.346 1.00 65.37 ? 423 TRP D N 1 ATOM 10659 C CA . TRP D 1 337 ? 109.213 8.556 24.727 1.00 60.88 ? 423 TRP D CA 1 ATOM 10660 C C . TRP D 1 337 ? 108.833 10.040 24.711 1.00 69.55 ? 423 TRP D C 1 ATOM 10661 O O . TRP D 1 337 ? 109.252 10.813 25.579 1.00 67.38 ? 423 TRP D O 1 ATOM 10662 C CB . TRP D 1 337 ? 108.137 7.739 25.476 1.00 58.76 ? 423 TRP D CB 1 ATOM 10663 C CG . TRP D 1 337 ? 108.127 8.029 26.944 1.00 55.22 ? 423 TRP D CG 1 ATOM 10664 C CD1 . TRP D 1 337 ? 108.768 7.328 27.924 1.00 66.35 ? 423 TRP D CD1 1 ATOM 10665 C CD2 . TRP D 1 337 ? 107.486 9.133 27.591 1.00 56.73 ? 423 TRP D CD2 1 ATOM 10666 N NE1 . TRP D 1 337 ? 108.556 7.922 29.149 1.00 71.73 ? 423 TRP D NE1 1 ATOM 10667 C CE2 . TRP D 1 337 ? 107.775 9.036 28.971 1.00 66.45 ? 423 TRP D CE2 1 ATOM 10668 C CE3 . TRP D 1 337 ? 106.693 10.193 27.140 1.00 57.25 ? 423 TRP D CE3 1 ATOM 10669 C CZ2 . TRP D 1 337 ? 107.300 9.964 29.904 1.00 65.69 ? 423 TRP D CZ2 1 ATOM 10670 C CZ3 . TRP D 1 337 ? 106.224 11.110 28.062 1.00 62.32 ? 423 TRP D CZ3 1 ATOM 10671 C CH2 . TRP D 1 337 ? 106.530 10.992 29.431 1.00 67.74 ? 423 TRP D CH2 1 ATOM 10672 N N . ILE D 1 338 ? 108.047 10.428 23.712 1.00 75.22 ? 424 ILE D N 1 ATOM 10673 C CA . ILE D 1 338 ? 107.519 11.783 23.596 1.00 78.22 ? 424 ILE D CA 1 ATOM 10674 C C . ILE D 1 338 ? 105.998 11.700 23.469 1.00 72.64 ? 424 ILE D C 1 ATOM 10675 O O . ILE D 1 338 ? 105.482 10.968 22.626 1.00 70.16 ? 424 ILE D O 1 ATOM 10676 C CB . ILE D 1 338 ? 108.064 12.487 22.327 1.00 83.34 ? 424 ILE D CB 1 ATOM 10677 C CG1 . ILE D 1 338 ? 109.588 12.403 22.266 1.00 77.65 ? 424 ILE D CG1 1 ATOM 10678 C CG2 . ILE D 1 338 ? 107.600 13.941 22.254 1.00 82.60 ? 424 ILE D CG2 1 ATOM 10679 C CD1 . ILE D 1 338 ? 110.157 13.068 21.041 1.00 73.05 ? 424 ILE D CD1 1 ATOM 10680 N N . GLU D 1 339 ? 105.271 12.441 24.295 1.00 72.52 ? 425 GLU D N 1 ATOM 10681 C CA . GLU D 1 339 ? 103.817 12.437 24.183 1.00 70.92 ? 425 GLU D CA 1 ATOM 10682 C C . GLU D 1 339 ? 103.357 13.590 23.281 1.00 73.04 ? 425 GLU D C 1 ATOM 10683 O O . GLU D 1 339 ? 103.699 14.747 23.516 1.00 76.50 ? 425 GLU D O 1 ATOM 10684 C CB . GLU D 1 339 ? 103.175 12.506 25.567 1.00 63.58 ? 425 GLU D CB 1 ATOM 10685 C CG . GLU D 1 339 ? 101.660 12.394 25.576 1.00 66.54 ? 425 GLU D CG 1 ATOM 10686 C CD . GLU D 1 339 ? 101.103 12.399 26.994 1.00 90.18 ? 425 GLU D CD 1 ATOM 10687 O OE1 . GLU D 1 339 ? 101.857 12.778 27.915 1.00 97.40 ? 425 GLU D OE1 1 ATOM 10688 O OE2 . GLU D 1 339 ? 99.926 12.022 27.189 1.00 97.91 ? 425 GLU D OE2 1 ATOM 10689 N N . ILE D 1 340 ? 102.582 13.252 22.251 1.00 75.72 ? 426 ILE D N 1 ATOM 10690 C CA . ILE D 1 340 ? 102.173 14.182 21.200 1.00 82.12 ? 426 ILE D CA 1 ATOM 10691 C C . ILE D 1 340 ? 100.678 14.461 21.288 1.00 79.90 ? 426 ILE D C 1 ATOM 10692 O O . ILE D 1 340 ? 99.893 13.543 21.519 1.00 80.91 ? 426 ILE D O 1 ATOM 10693 C CB . ILE D 1 340 ? 102.431 13.553 19.808 1.00 88.91 ? 426 ILE D CB 1 ATOM 10694 C CG1 . ILE D 1 340 ? 103.895 13.138 19.654 1.00 83.82 ? 426 ILE D CG1 1 ATOM 10695 C CG2 . ILE D 1 340 ? 102.002 14.477 18.702 1.00 96.68 ? 426 ILE D CG2 1 ATOM 10696 C CD1 . ILE D 1 340 ? 104.871 14.212 20.023 1.00 90.09 ? 426 ILE D CD1 1 ATOM 10697 N N . ALA D 1 341 ? 100.275 15.715 21.101 1.00 77.29 ? 427 ALA D N 1 ATOM 10698 C CA . ALA D 1 341 ? 98.856 16.021 20.937 1.00 75.79 ? 427 ALA D CA 1 ATOM 10699 C C . ALA D 1 341 ? 98.359 15.373 19.647 1.00 81.73 ? 427 ALA D C 1 ATOM 10700 O O . ALA D 1 341 ? 99.094 15.290 18.662 1.00 90.64 ? 427 ALA D O 1 ATOM 10701 C CB . ALA D 1 341 ? 98.637 17.511 20.894 1.00 68.13 ? 427 ALA D CB 1 ATOM 10702 N N . ALA D 1 342 ? 97.117 14.906 19.646 1.00 86.38 ? 428 ALA D N 1 ATOM 10703 C CA . ALA D 1 342 ? 96.572 14.226 18.471 1.00 82.47 ? 428 ALA D CA 1 ATOM 10704 C C . ALA D 1 342 ? 95.059 14.406 18.381 1.00 93.05 ? 428 ALA D C 1 ATOM 10705 O O . ALA D 1 342 ? 94.439 14.957 19.292 1.00 93.70 ? 428 ALA D O 1 ATOM 10706 C CB . ALA D 1 342 ? 96.942 12.746 18.497 1.00 71.77 ? 428 ALA D CB 1 ATOM 10707 N N . THR D 1 343 ? 94.460 13.953 17.283 1.00 104.29 ? 429 THR D N 1 ATOM 10708 C CA . THR D 1 343 ? 93.008 14.072 17.115 1.00 103.49 ? 429 THR D CA 1 ATOM 10709 C C . THR D 1 343 ? 92.368 12.761 16.668 1.00 91.03 ? 429 THR D C 1 ATOM 10710 O O . THR D 1 343 ? 92.994 11.959 15.969 1.00 78.67 ? 429 THR D O 1 ATOM 10711 C CB . THR D 1 343 ? 92.620 15.198 16.119 1.00 111.27 ? 429 THR D CB 1 ATOM 10712 O OG1 . THR D 1 343 ? 93.271 14.979 14.858 1.00 110.73 ? 429 THR D OG1 1 ATOM 10713 C CG2 . THR D 1 343 ? 93.003 16.574 16.672 1.00 100.77 ? 429 THR D CG2 1 ATOM 10714 N N . THR D 1 344 ? 91.119 12.544 17.069 1.00 96.26 ? 430 THR D N 1 ATOM 10715 C CA . THR D 1 344 ? 90.422 11.339 16.642 1.00 100.24 ? 430 THR D CA 1 ATOM 10716 C C . THR D 1 344 ? 89.615 11.575 15.371 1.00 109.42 ? 430 THR D C 1 ATOM 10717 O O . THR D 1 344 ? 89.468 12.707 14.912 1.00 115.41 ? 430 THR D O 1 ATOM 10718 C CB . THR D 1 344 ? 89.522 10.756 17.741 1.00 90.79 ? 430 THR D CB 1 ATOM 10719 O OG1 . THR D 1 344 ? 88.288 11.484 17.803 1.00 92.54 ? 430 THR D OG1 1 ATOM 10720 C CG2 . THR D 1 344 ? 90.230 10.819 19.077 1.00 89.37 ? 430 THR D CG2 1 ATOM 10721 N N . LYS D 1 345 ? 89.102 10.491 14.808 1.00 104.16 ? 431 LYS D N 1 ATOM 10722 C CA . LYS D 1 345 ? 88.341 10.560 13.575 1.00 107.40 ? 431 LYS D CA 1 ATOM 10723 C C . LYS D 1 345 ? 87.046 11.371 13.741 1.00 114.12 ? 431 LYS D C 1 ATOM 10724 O O . LYS D 1 345 ? 86.546 11.954 12.778 1.00 124.22 ? 431 LYS D O 1 ATOM 10725 C CB . LYS D 1 345 ? 88.056 9.149 13.063 1.00 107.87 ? 431 LYS D CB 1 ATOM 10726 C CG . LYS D 1 345 ? 87.418 9.109 11.695 1.00 123.01 ? 431 LYS D CG 1 ATOM 10727 C CD . LYS D 1 345 ? 87.376 7.693 11.150 1.00 128.65 ? 431 LYS D CD 1 ATOM 10728 C CE . LYS D 1 345 ? 86.659 7.644 9.810 1.00 125.40 ? 431 LYS D CE 1 ATOM 10729 N NZ . LYS D 1 345 ? 87.096 6.485 8.989 1.00 115.16 ? 431 LYS D NZ 1 ATOM 10730 N N . ALA D 1 346 ? 86.514 11.418 14.961 1.00 105.54 ? 432 ALA D N 1 ATOM 10731 C CA . ALA D 1 346 ? 85.332 12.229 15.251 1.00 99.61 ? 432 ALA D CA 1 ATOM 10732 C C . ALA D 1 346 ? 85.729 13.621 15.733 1.00 110.66 ? 432 ALA D C 1 ATOM 10733 O O . ALA D 1 346 ? 84.885 14.401 16.182 1.00 118.79 ? 432 ALA D O 1 ATOM 10734 C CB . ALA D 1 346 ? 84.448 11.544 16.286 1.00 91.61 ? 432 ALA D CB 1 ATOM 10735 N N . GLY D 1 347 ? 87.022 13.921 15.653 1.00 112.46 ? 433 GLY D N 1 ATOM 10736 C CA . GLY D 1 347 ? 87.524 15.233 16.009 1.00 112.51 ? 433 GLY D CA 1 ATOM 10737 C C . GLY D 1 347 ? 87.849 15.470 17.478 1.00 110.07 ? 433 GLY D C 1 ATOM 10738 O O . GLY D 1 347 ? 88.117 16.612 17.864 1.00 99.10 ? 433 GLY D O 1 ATOM 10739 N N . LEU D 1 348 ? 87.836 14.421 18.301 1.00 107.90 ? 438 LEU D N 1 ATOM 10740 C CA . LEU D 1 348 ? 88.172 14.589 19.719 1.00 100.58 ? 438 LEU D CA 1 ATOM 10741 C C . LEU D 1 348 ? 89.662 14.827 19.930 1.00 95.62 ? 438 LEU D C 1 ATOM 10742 O O . LEU D 1 348 ? 90.500 14.260 19.227 1.00 99.09 ? 438 LEU D O 1 ATOM 10743 C CB . LEU D 1 348 ? 87.723 13.392 20.562 1.00 98.12 ? 438 LEU D CB 1 ATOM 10744 C CG . LEU D 1 348 ? 86.243 13.309 20.926 1.00 96.77 ? 438 LEU D CG 1 ATOM 10745 C CD1 . LEU D 1 348 ? 85.469 12.688 19.772 1.00 104.25 ? 438 LEU D CD1 1 ATOM 10746 C CD2 . LEU D 1 348 ? 86.026 12.527 22.227 1.00 88.95 ? 438 LEU D CD2 1 ATOM 10747 N N . SER D 1 349 ? 89.980 15.672 20.903 1.00 94.34 ? 439 SER D N 1 ATOM 10748 C CA . SER D 1 349 ? 91.365 15.957 21.242 1.00 97.36 ? 439 SER D CA 1 ATOM 10749 C C . SER D 1 349 ? 91.900 14.847 22.140 1.00 99.82 ? 439 SER D C 1 ATOM 10750 O O . SER D 1 349 ? 91.210 14.385 23.049 1.00 99.61 ? 439 SER D O 1 ATOM 10751 C CB . SER D 1 349 ? 91.481 17.322 21.925 1.00 99.48 ? 439 SER D CB 1 ATOM 10752 O OG . SER D 1 349 ? 92.199 17.223 23.144 1.00 108.34 ? 439 SER D OG 1 ATOM 10753 N N . SER D 1 350 ? 93.126 14.414 21.867 1.00 99.00 ? 440 SER D N 1 ATOM 10754 C CA . SER D 1 350 ? 93.728 13.295 22.580 1.00 96.31 ? 440 SER D CA 1 ATOM 10755 C C . SER D 1 350 ? 95.244 13.322 22.418 1.00 90.09 ? 440 SER D C 1 ATOM 10756 O O . SER D 1 350 ? 95.811 14.318 21.982 1.00 95.47 ? 440 SER D O 1 ATOM 10757 C CB . SER D 1 350 ? 93.160 11.962 22.067 1.00 102.01 ? 440 SER D CB 1 ATOM 10758 O OG . SER D 1 350 ? 93.738 10.852 22.736 1.00 102.68 ? 440 SER D OG 1 ATOM 10759 N N . ASN D 1 351 ? 95.896 12.221 22.770 1.00 88.86 ? 441 ASN D N 1 ATOM 10760 C CA . ASN D 1 351 ? 97.341 12.124 22.658 1.00 82.68 ? 441 ASN D CA 1 ATOM 10761 C C . ASN D 1 351 ? 97.745 10.816 22.021 1.00 80.86 ? 441 ASN D C 1 ATOM 10762 O O . ASN D 1 351 ? 96.949 9.872 21.958 1.00 81.36 ? 441 ASN D O 1 ATOM 10763 C CB . ASN D 1 351 ? 97.979 12.156 24.052 1.00 81.77 ? 441 ASN D CB 1 ATOM 10764 C CG . ASN D 1 351 ? 97.554 13.357 24.868 1.00 77.65 ? 441 ASN D CG 1 ATOM 10765 O OD1 . ASN D 1 351 ? 97.909 14.493 24.544 1.00 76.42 ? 441 ASN D OD1 1 ATOM 10766 N ND2 . ASN D 1 351 ? 96.813 13.114 25.950 1.00 71.65 ? 441 ASN D ND2 1 ATOM 10767 N N . ASP D 1 352 ? 98.984 10.757 21.546 1.00 76.34 ? 442 ASP D N 1 ATOM 10768 C CA . ASP D 1 352 ? 99.683 9.477 21.551 1.00 90.40 ? 442 ASP D CA 1 ATOM 10769 C C . ASP D 1 352 ? 101.188 9.610 21.648 1.00 70.73 ? 442 ASP D C 1 ATOM 10770 O O . ASP D 1 352 ? 101.700 10.615 22.135 1.00 73.40 ? 442 ASP D O 1 ATOM 10771 C CB . ASP D 1 352 ? 99.239 8.516 20.442 1.00 110.75 ? 442 ASP D CB 1 ATOM 10772 C CG . ASP D 1 352 ? 99.494 9.053 19.080 1.00 123.83 ? 442 ASP D CG 1 ATOM 10773 O OD1 . ASP D 1 352 ? 99.537 10.291 18.944 1.00 138.24 ? 442 ASP D OD1 1 ATOM 10774 O OD2 . ASP D 1 352 ? 99.649 8.234 18.149 1.00 118.11 ? 442 ASP D OD2 1 ATOM 10775 N N . LEU D 1 353 ? 101.893 8.587 21.194 1.00 65.79 ? 443 LEU D N 1 ATOM 10776 C CA . LEU D 1 353 ? 103.218 8.334 21.723 1.00 68.74 ? 443 LEU D CA 1 ATOM 10777 C C . LEU D 1 353 ? 104.188 7.936 20.635 1.00 71.30 ? 443 LEU D C 1 ATOM 10778 O O . LEU D 1 353 ? 103.848 7.147 19.749 1.00 79.78 ? 443 LEU D O 1 ATOM 10779 C CB . LEU D 1 353 ? 103.088 7.200 22.731 1.00 73.51 ? 443 LEU D CB 1 ATOM 10780 C CG . LEU D 1 353 ? 103.952 7.089 23.975 1.00 77.69 ? 443 LEU D CG 1 ATOM 10781 C CD1 . LEU D 1 353 ? 105.074 6.157 23.666 1.00 80.92 ? 443 LEU D CD1 1 ATOM 10782 C CD2 . LEU D 1 353 ? 104.473 8.439 24.435 1.00 78.78 ? 443 LEU D CD2 1 ATOM 10783 N N . ILE D 1 354 ? 105.390 8.495 20.695 1.00 64.87 ? 444 ILE D N 1 ATOM 10784 C CA . ILE D 1 354 ? 106.465 8.057 19.825 1.00 62.07 ? 444 ILE D CA 1 ATOM 10785 C C . ILE D 1 354 ? 107.683 7.740 20.683 1.00 64.74 ? 444 ILE D C 1 ATOM 10786 O O . ILE D 1 354 ? 107.912 8.394 21.706 1.00 63.00 ? 444 ILE D O 1 ATOM 10787 C CB . ILE D 1 354 ? 106.801 9.114 18.749 1.00 73.92 ? 444 ILE D CB 1 ATOM 10788 C CG1 . ILE D 1 354 ? 108.042 8.695 17.947 1.00 89.38 ? 444 ILE D CG1 1 ATOM 10789 C CG2 . ILE D 1 354 ? 107.015 10.478 19.392 1.00 64.59 ? 444 ILE D CG2 1 ATOM 10790 C CD1 . ILE D 1 354 ? 108.112 9.280 16.552 1.00 92.28 ? 444 ILE D CD1 1 ATOM 10791 N N . THR D 1 355 ? 108.448 6.724 20.283 1.00 72.66 ? 445 THR D N 1 ATOM 10792 C CA . THR D 1 355 ? 109.677 6.369 20.996 1.00 75.57 ? 445 THR D CA 1 ATOM 10793 C C . THR D 1 355 ? 110.921 6.390 20.104 1.00 76.99 ? 445 THR D C 1 ATOM 10794 O O . THR D 1 355 ? 110.864 6.118 18.902 1.00 78.41 ? 445 THR D O 1 ATOM 10795 C CB . THR D 1 355 ? 109.572 4.997 21.696 1.00 70.64 ? 445 THR D CB 1 ATOM 10796 O OG1 . THR D 1 355 ? 109.336 3.978 20.717 1.00 72.17 ? 445 THR D OG1 1 ATOM 10797 C CG2 . THR D 1 355 ? 108.437 5.006 22.704 1.00 69.87 ? 445 THR D CG2 1 ATOM 10798 N N . PHE D 1 356 ? 112.042 6.727 20.723 1.00 72.73 ? 446 PHE D N 1 ATOM 10799 C CA . PHE D 1 356 ? 113.332 6.717 20.067 1.00 61.99 ? 446 PHE D CA 1 ATOM 10800 C C . PHE D 1 356 ? 114.331 6.036 20.987 1.00 75.59 ? 446 PHE D C 1 ATOM 10801 O O . PHE D 1 356 ? 114.313 6.247 22.209 1.00 85.43 ? 446 PHE D O 1 ATOM 10802 C CB . PHE D 1 356 ? 113.808 8.144 19.805 1.00 64.23 ? 446 PHE D CB 1 ATOM 10803 C CG . PHE D 1 356 ? 113.070 8.839 18.698 1.00 72.96 ? 446 PHE D CG 1 ATOM 10804 C CD1 . PHE D 1 356 ? 113.510 8.736 17.382 1.00 68.47 ? 446 PHE D CD1 1 ATOM 10805 C CD2 . PHE D 1 356 ? 111.939 9.602 18.970 1.00 77.18 ? 446 PHE D CD2 1 ATOM 10806 C CE1 . PHE D 1 356 ? 112.828 9.376 16.358 1.00 70.49 ? 446 PHE D CE1 1 ATOM 10807 C CE2 . PHE D 1 356 ? 111.254 10.249 17.953 1.00 81.73 ? 446 PHE D CE2 1 ATOM 10808 C CZ . PHE D 1 356 ? 111.699 10.137 16.644 1.00 78.26 ? 446 PHE D CZ 1 ATOM 10809 N N . CYS D 1 357 ? 115.206 5.227 20.403 1.00 71.11 ? 447 CYS D N 1 ATOM 10810 C CA . CYS D 1 357 ? 116.293 4.606 21.153 1.00 68.04 ? 447 CYS D CA 1 ATOM 10811 C C . CYS D 1 357 ? 117.623 5.116 20.623 1.00 73.54 ? 447 CYS D C 1 ATOM 10812 O O . CYS D 1 357 ? 117.687 5.653 19.512 1.00 71.13 ? 447 CYS D O 1 ATOM 10813 C CB . CYS D 1 357 ? 116.209 3.086 21.050 1.00 61.34 ? 447 CYS D CB 1 ATOM 10814 S SG . CYS D 1 357 ? 114.785 2.400 21.934 1.00 95.53 ? 447 CYS D SG 1 ATOM 10815 N N . GLY D 1 358 ? 118.681 4.968 21.413 1.00 78.33 ? 448 GLY D N 1 ATOM 10816 C CA . GLY D 1 358 ? 119.987 5.442 20.996 1.00 75.22 ? 448 GLY D CA 1 ATOM 10817 C C . GLY D 1 358 ? 120.678 4.503 20.022 1.00 79.88 ? 448 GLY D C 1 ATOM 10818 O O . GLY D 1 358 ? 120.333 3.325 19.921 1.00 83.81 ? 448 GLY D O 1 ATOM 10819 N N . THR D 1 359 ? 121.650 5.028 19.287 1.00 76.13 ? 449 THR D N 1 ATOM 10820 C CA . THR D 1 359 ? 122.560 4.182 18.529 1.00 71.95 ? 449 THR D CA 1 ATOM 10821 C C . THR D 1 359 ? 123.910 4.861 18.468 1.00 75.09 ? 449 THR D C 1 ATOM 10822 O O . THR D 1 359 ? 123.978 6.091 18.321 1.00 78.48 ? 449 THR D O 1 ATOM 10823 C CB . THR D 1 359 ? 122.062 3.894 17.088 1.00 82.64 ? 449 THR D CB 1 ATOM 10824 O OG1 . THR D 1 359 ? 123.106 3.242 16.345 1.00 84.20 ? 449 THR D OG1 1 ATOM 10825 C CG2 . THR D 1 359 ? 121.660 5.190 16.369 1.00 78.97 ? 449 THR D CG2 1 ATOM 10826 N N . GLY D 1 360 ? 124.976 4.065 18.571 1.00 76.26 ? 450 GLY D N 1 ATOM 10827 C CA . GLY D 1 360 ? 126.336 4.589 18.610 1.00 80.15 ? 450 GLY D CA 1 ATOM 10828 C C . GLY D 1 360 ? 126.745 5.507 17.468 1.00 74.05 ? 450 GLY D C 1 ATOM 10829 O O . GLY D 1 360 ? 127.585 6.378 17.664 1.00 79.54 ? 450 GLY D O 1 ATOM 10830 N N . GLY D 1 361 ? 126.151 5.320 16.287 1.00 76.51 ? 451 GLY D N 1 ATOM 10831 C CA . GLY D 1 361 ? 126.512 6.096 15.109 1.00 84.44 ? 451 GLY D CA 1 ATOM 10832 C C . GLY D 1 361 ? 125.717 7.376 14.912 1.00 88.17 ? 451 GLY D C 1 ATOM 10833 O O . GLY D 1 361 ? 124.635 7.538 15.472 1.00 96.58 ? 451 GLY D O 1 ATOM 10834 N N . SER D 1 362 ? 126.250 8.294 14.110 1.00 90.52 ? 452 SER D N 1 ATOM 10835 C CA . SER D 1 362 ? 125.527 9.528 13.804 1.00 94.64 ? 452 SER D CA 1 ATOM 10836 C C . SER D 1 362 ? 124.473 9.313 12.710 1.00 88.20 ? 452 SER D C 1 ATOM 10837 O O . SER D 1 362 ? 124.644 8.490 11.803 1.00 86.85 ? 452 SER D O 1 ATOM 10838 C CB . SER D 1 362 ? 126.483 10.690 13.468 1.00 92.73 ? 452 SER D CB 1 ATOM 10839 O OG . SER D 1 362 ? 127.092 10.535 12.196 1.00 89.41 ? 452 SER D OG 1 ATOM 10840 N N . MET D 1 363 ? 123.380 10.060 12.815 1.00 80.21 ? 453 MET D N 1 ATOM 10841 C CA . MET D 1 363 ? 122.200 9.836 11.992 1.00 77.94 ? 453 MET D CA 1 ATOM 10842 C C . MET D 1 363 ? 122.005 10.978 11.016 1.00 83.69 ? 453 MET D C 1 ATOM 10843 O O . MET D 1 363 ? 122.393 12.113 11.302 1.00 81.91 ? 453 MET D O 1 ATOM 10844 C CB . MET D 1 363 ? 120.945 9.736 12.885 1.00 78.79 ? 453 MET D CB 1 ATOM 10845 C CG . MET D 1 363 ? 120.812 8.444 13.673 1.00 65.67 ? 453 MET D CG 1 ATOM 10846 S SD . MET D 1 363 ? 120.618 7.021 12.581 1.00 88.83 ? 453 MET D SD 1 ATOM 10847 C CE . MET D 1 363 ? 118.993 7.365 11.898 1.00 53.70 ? 453 MET D CE 1 ATOM 10848 N N . PRO D 1 364 ? 121.398 10.683 9.857 1.00 85.19 ? 454 PRO D N 1 ATOM 10849 C CA . PRO D 1 364 ? 120.987 11.727 8.911 1.00 86.44 ? 454 PRO D CA 1 ATOM 10850 C C . PRO D 1 364 ? 119.973 12.684 9.543 1.00 95.90 ? 454 PRO D C 1 ATOM 10851 O O . PRO D 1 364 ? 119.376 12.365 10.580 1.00 98.30 ? 454 PRO D O 1 ATOM 10852 C CB . PRO D 1 364 ? 120.320 10.933 7.779 1.00 79.98 ? 454 PRO D CB 1 ATOM 10853 C CG . PRO D 1 364 ? 120.034 9.578 8.348 1.00 83.57 ? 454 PRO D CG 1 ATOM 10854 C CD . PRO D 1 364 ? 121.117 9.331 9.350 1.00 83.98 ? 454 PRO D CD 1 ATOM 10855 N N . ASP D 1 365 ? 119.798 13.857 8.941 1.00 103.22 ? 455 ASP D N 1 ATOM 10856 C CA . ASP D 1 365 ? 118.740 14.762 9.372 1.00 103.18 ? 455 ASP D CA 1 ATOM 10857 C C . ASP D 1 365 ? 117.412 14.239 8.828 1.00 98.96 ? 455 ASP D C 1 ATOM 10858 O O . ASP D 1 365 ? 117.096 14.444 7.657 1.00 111.89 ? 455 ASP D O 1 ATOM 10859 C CB . ASP D 1 365 ? 118.991 16.198 8.882 1.00 106.52 ? 455 ASP D CB 1 ATOM 10860 C CG . ASP D 1 365 ? 120.218 16.841 9.516 1.00 113.97 ? 455 ASP D CG 1 ATOM 10861 O OD1 . ASP D 1 365 ? 120.594 16.438 10.640 1.00 108.84 ? 455 ASP D OD1 1 ATOM 10862 O OD2 . ASP D 1 365 ? 120.798 17.757 8.879 1.00 118.14 ? 455 ASP D OD2 1 ATOM 10863 N N . VAL D 1 366 ? 116.649 13.542 9.665 1.00 83.98 ? 456 VAL D N 1 ATOM 10864 C CA . VAL D 1 366 ? 115.349 13.038 9.241 1.00 75.30 ? 456 VAL D CA 1 ATOM 10865 C C . VAL D 1 366 ? 114.227 13.593 10.122 1.00 85.90 ? 456 VAL D C 1 ATOM 10866 O O . VAL D 1 366 ? 114.338 13.640 11.357 1.00 88.94 ? 456 VAL D O 1 ATOM 10867 C CB . VAL D 1 366 ? 115.323 11.479 9.143 1.00 72.89 ? 456 VAL D CB 1 ATOM 10868 C CG1 . VAL D 1 366 ? 116.177 10.856 10.230 1.00 83.08 ? 456 VAL D CG1 1 ATOM 10869 C CG2 . VAL D 1 366 ? 113.884 10.931 9.170 1.00 65.20 ? 456 VAL D CG2 1 ATOM 10870 N N . ASN D 1 367 ? 113.164 14.052 9.468 1.00 84.60 ? 457 ASN D N 1 ATOM 10871 C CA . ASN D 1 367 ? 112.004 14.596 10.160 1.00 93.68 ? 457 ASN D CA 1 ATOM 10872 C C . ASN D 1 367 ? 110.912 13.527 10.263 1.00 90.69 ? 457 ASN D C 1 ATOM 10873 O O . ASN D 1 367 ? 110.461 12.985 9.251 1.00 95.98 ? 457 ASN D O 1 ATOM 10874 C CB . ASN D 1 367 ? 111.509 15.851 9.431 1.00 106.42 ? 457 ASN D CB 1 ATOM 10875 C CG . ASN D 1 367 ? 110.163 16.336 9.933 1.00 116.28 ? 457 ASN D CG 1 ATOM 10876 O OD1 . ASN D 1 367 ? 110.005 16.658 11.112 1.00 126.99 ? 457 ASN D OD1 1 ATOM 10877 N ND2 . ASN D 1 367 ? 109.186 16.409 9.031 1.00 107.11 ? 457 ASN D ND2 1 ATOM 10878 N N . TRP D 1 368 ? 110.500 13.213 11.486 1.00 81.55 ? 458 TRP D N 1 ATOM 10879 C CA . TRP D 1 368 ? 109.595 12.091 11.707 1.00 83.50 ? 458 TRP D CA 1 ATOM 10880 C C . TRP D 1 368 ? 108.141 12.523 11.842 1.00 83.06 ? 458 TRP D C 1 ATOM 10881 O O . TRP D 1 368 ? 107.269 11.707 12.153 1.00 81.38 ? 458 TRP D O 1 ATOM 10882 C CB . TRP D 1 368 ? 110.020 11.288 12.940 1.00 82.76 ? 458 TRP D CB 1 ATOM 10883 C CG . TRP D 1 368 ? 111.367 10.636 12.800 1.00 84.75 ? 458 TRP D CG 1 ATOM 10884 C CD1 . TRP D 1 368 ? 112.547 11.042 13.365 1.00 90.84 ? 458 TRP D CD1 1 ATOM 10885 C CD2 . TRP D 1 368 ? 111.672 9.469 12.035 1.00 81.50 ? 458 TRP D CD2 1 ATOM 10886 N NE1 . TRP D 1 368 ? 113.568 10.194 12.999 1.00 82.32 ? 458 TRP D NE1 1 ATOM 10887 C CE2 . TRP D 1 368 ? 113.057 9.219 12.183 1.00 82.92 ? 458 TRP D CE2 1 ATOM 10888 C CE3 . TRP D 1 368 ? 110.909 8.607 11.237 1.00 76.49 ? 458 TRP D CE3 1 ATOM 10889 C CZ2 . TRP D 1 368 ? 113.693 8.142 11.562 1.00 85.57 ? 458 TRP D CZ2 1 ATOM 10890 C CZ3 . TRP D 1 368 ? 111.540 7.535 10.624 1.00 76.35 ? 458 TRP D CZ3 1 ATOM 10891 C CH2 . TRP D 1 368 ? 112.921 7.311 10.789 1.00 86.26 ? 458 TRP D CH2 1 ATOM 10892 N N . GLY D 1 369 ? 107.880 13.804 11.607 1.00 84.48 ? 459 GLY D N 1 ATOM 10893 C CA . GLY D 1 369 ? 106.529 14.328 11.721 1.00 93.51 ? 459 GLY D CA 1 ATOM 10894 C C . GLY D 1 369 ? 106.491 15.703 12.366 1.00 107.13 ? 459 GLY D C 1 ATOM 10895 O O . GLY D 1 369 ? 107.515 16.381 12.475 1.00 102.77 ? 459 GLY D O 1 ATOM 10896 O OXT . GLY D 1 369 ? 105.438 16.179 12.792 1.00 119.03 ? 459 GLY D OXT 1 HETATM 10897 C C1 . NAG E 2 . ? 112.458 -38.024 16.820 1.00 78.17 ? 601 NAG A C1 1 HETATM 10898 C C2 . NAG E 2 . ? 113.862 -38.620 16.797 1.00 79.63 ? 601 NAG A C2 1 HETATM 10899 C C3 . NAG E 2 . ? 114.478 -38.649 18.185 1.00 77.46 ? 601 NAG A C3 1 HETATM 10900 C C4 . NAG E 2 . ? 114.303 -37.311 18.896 1.00 82.23 ? 601 NAG A C4 1 HETATM 10901 C C5 . NAG E 2 . ? 112.888 -36.773 18.790 1.00 80.13 ? 601 NAG A C5 1 HETATM 10902 C C6 . NAG E 2 . ? 112.837 -35.350 19.328 1.00 80.07 ? 601 NAG A C6 1 HETATM 10903 C C7 . NAG E 2 . ? 114.452 -40.220 15.059 1.00 91.08 ? 601 NAG A C7 1 HETATM 10904 C C8 . NAG E 2 . ? 114.649 -41.674 14.744 1.00 81.15 ? 601 NAG A C8 1 HETATM 10905 N N2 . NAG E 2 . ? 113.876 -39.964 16.244 1.00 82.58 ? 601 NAG A N2 1 HETATM 10906 O O3 . NAG E 2 . ? 115.844 -38.977 18.069 1.00 79.74 ? 601 NAG A O3 1 HETATM 10907 O O4 . NAG E 2 . ? 114.562 -37.486 20.265 1.00 103.40 ? 601 NAG A O4 1 HETATM 10908 O O5 . NAG E 2 . ? 112.467 -36.761 17.446 1.00 85.52 ? 601 NAG A O5 1 HETATM 10909 O O6 . NAG E 2 . ? 113.809 -34.578 18.662 1.00 77.69 ? 601 NAG A O6 1 HETATM 10910 O O7 . NAG E 2 . ? 114.813 -39.352 14.234 1.00 93.34 ? 601 NAG A O7 1 HETATM 10911 C C1 . NAG F 2 . ? 115.841 -36.916 20.564 1.00 120.34 ? 602 NAG A C1 1 HETATM 10912 C C2 . NAG F 2 . ? 115.863 -36.542 22.034 1.00 116.15 ? 602 NAG A C2 1 HETATM 10913 C C3 . NAG F 2 . ? 117.151 -35.799 22.346 1.00 135.97 ? 602 NAG A C3 1 HETATM 10914 C C4 . NAG F 2 . ? 118.387 -36.524 21.801 1.00 154.96 ? 602 NAG A C4 1 HETATM 10915 C C5 . NAG F 2 . ? 118.196 -37.191 20.430 1.00 149.22 ? 602 NAG A C5 1 HETATM 10916 C C6 . NAG F 2 . ? 119.244 -38.290 20.272 1.00 140.44 ? 602 NAG A C6 1 HETATM 10917 C C7 . NAG F 2 . ? 114.170 -35.601 23.514 1.00 116.34 ? 602 NAG A C7 1 HETATM 10918 C C8 . NAG F 2 . ? 114.201 -34.237 24.152 1.00 117.85 ? 602 NAG A C8 1 HETATM 10919 N N2 . NAG F 2 . ? 114.728 -35.687 22.307 1.00 108.64 ? 602 NAG A N2 1 HETATM 10920 O O3 . NAG F 2 . ? 117.260 -35.640 23.746 1.00 137.52 ? 602 NAG A O3 1 HETATM 10921 O O4 . NAG F 2 . ? 119.486 -35.628 21.724 1.00 166.89 ? 602 NAG A O4 1 HETATM 10922 O O5 . NAG F 2 . ? 116.914 -37.776 20.260 1.00 141.93 ? 602 NAG A O5 1 HETATM 10923 O O6 . NAG F 2 . ? 119.379 -38.975 21.507 1.00 132.64 ? 602 NAG A O6 1 HETATM 10924 O O7 . NAG F 2 . ? 113.646 -36.571 24.089 1.00 117.05 ? 602 NAG A O7 1 HETATM 10925 C C1 . BMA G 3 . ? 120.443 -35.866 22.792 1.00 166.83 ? 603 BMA A C1 1 HETATM 10926 C C2 . BMA G 3 . ? 121.695 -34.991 22.605 1.00 159.11 ? 603 BMA A C2 1 HETATM 10927 C C3 . BMA G 3 . ? 122.732 -35.344 23.669 1.00 154.62 ? 603 BMA A C3 1 HETATM 10928 C C4 . BMA G 3 . ? 122.101 -35.328 25.065 1.00 155.29 ? 603 BMA A C4 1 HETATM 10929 C C5 . BMA G 3 . ? 120.800 -36.133 25.121 1.00 152.76 ? 603 BMA A C5 1 HETATM 10930 C C6 . BMA G 3 . ? 120.100 -35.987 26.474 1.00 143.20 ? 603 BMA A C6 1 HETATM 10931 O O2 . BMA G 3 . ? 121.402 -33.605 22.656 1.00 149.70 ? 603 BMA A O2 1 HETATM 10932 O O3 . BMA G 3 . ? 123.807 -34.430 23.584 1.00 146.14 ? 603 BMA A O3 1 HETATM 10933 O O4 . BMA G 3 . ? 123.005 -35.875 25.998 1.00 156.08 ? 603 BMA A O4 1 HETATM 10934 O O5 . BMA G 3 . ? 119.917 -35.711 24.100 1.00 163.24 ? 603 BMA A O5 1 HETATM 10935 O O6 . BMA G 3 . ? 119.119 -34.969 26.439 1.00 136.82 ? 603 BMA A O6 1 HETATM 10936 CA CA . CA H 4 . ? 77.237 -51.080 5.774 1.00 68.24 ? 604 CA A CA 1 HETATM 10937 C C1 . NAG I 2 . ? 98.307 -35.526 42.061 1.00 71.14 ? 601 NAG B C1 1 HETATM 10938 C C2 . NAG I 2 . ? 98.983 -36.825 42.513 1.00 77.77 ? 601 NAG B C2 1 HETATM 10939 C C3 . NAG I 2 . ? 100.417 -36.565 42.924 1.00 77.94 ? 601 NAG B C3 1 HETATM 10940 C C4 . NAG I 2 . ? 101.165 -35.847 41.805 1.00 75.08 ? 601 NAG B C4 1 HETATM 10941 C C5 . NAG I 2 . ? 100.444 -34.573 41.395 1.00 71.44 ? 601 NAG B C5 1 HETATM 10942 C C6 . NAG I 2 . ? 101.124 -33.948 40.169 1.00 75.00 ? 601 NAG B C6 1 HETATM 10943 C C7 . NAG I 2 . ? 97.545 -38.631 43.233 1.00 85.10 ? 601 NAG B C7 1 HETATM 10944 C C8 . NAG I 2 . ? 97.347 -39.698 44.268 1.00 67.78 ? 601 NAG B C8 1 HETATM 10945 N N2 . NAG I 2 . ? 98.273 -37.553 43.570 1.00 78.09 ? 601 NAG B N2 1 HETATM 10946 O O3 . NAG I 2 . ? 101.003 -37.817 43.193 1.00 87.23 ? 601 NAG B O3 1 HETATM 10947 O O4 . NAG I 2 . ? 102.491 -35.547 42.191 1.00 96.14 ? 601 NAG B O4 1 HETATM 10948 O O5 . NAG I 2 . ? 99.079 -34.831 41.096 1.00 77.00 ? 601 NAG B O5 1 HETATM 10949 O O6 . NAG I 2 . ? 101.178 -34.837 39.066 1.00 65.42 ? 601 NAG B O6 1 HETATM 10950 O O7 . NAG I 2 . ? 97.040 -38.770 42.105 1.00 91.25 ? 601 NAG B O7 1 HETATM 10951 C C1 . NAG J 2 . ? 103.378 -36.424 41.470 1.00 118.20 ? 602 NAG B C1 1 HETATM 10952 C C2 . NAG J 2 . ? 104.678 -35.699 41.140 1.00 123.49 ? 602 NAG B C2 1 HETATM 10953 C C3 . NAG J 2 . ? 105.579 -36.604 40.304 1.00 122.51 ? 602 NAG B C3 1 HETATM 10954 C C4 . NAG J 2 . ? 105.771 -37.955 40.989 1.00 130.63 ? 602 NAG B C4 1 HETATM 10955 C C5 . NAG J 2 . ? 104.434 -38.560 41.443 1.00 134.21 ? 602 NAG B C5 1 HETATM 10956 C C6 . NAG J 2 . ? 104.614 -39.812 42.309 1.00 128.01 ? 602 NAG B C6 1 HETATM 10957 C C7 . NAG J 2 . ? 104.954 -33.300 40.853 1.00 119.96 ? 602 NAG B C7 1 HETATM 10958 C C8 . NAG J 2 . ? 105.117 -32.233 39.803 1.00 112.91 ? 602 NAG B C8 1 HETATM 10959 N N2 . NAG J 2 . ? 104.417 -34.451 40.449 1.00 123.50 ? 602 NAG B N2 1 HETATM 10960 O O3 . NAG J 2 . ? 106.838 -35.997 40.107 1.00 110.94 ? 602 NAG B O3 1 HETATM 10961 O O4 . NAG J 2 . ? 106.438 -38.817 40.090 1.00 125.72 ? 602 NAG B O4 1 HETATM 10962 O O5 . NAG J 2 . ? 103.659 -37.621 42.169 1.00 136.46 ? 602 NAG B O5 1 HETATM 10963 O O6 . NAG J 2 . ? 105.411 -39.549 43.448 1.00 117.08 ? 602 NAG B O6 1 HETATM 10964 O O7 . NAG J 2 . ? 105.302 -33.105 42.020 1.00 117.94 ? 602 NAG B O7 1 HETATM 10965 C C1 . NAG K 2 . ? 79.025 8.472 40.909 1.00 124.33 ? 603 NAG B C1 1 HETATM 10966 C C2 . NAG K 2 . ? 80.264 8.566 40.016 1.00 119.03 ? 603 NAG B C2 1 HETATM 10967 C C3 . NAG K 2 . ? 80.773 9.999 40.011 1.00 118.93 ? 603 NAG B C3 1 HETATM 10968 C C4 . NAG K 2 . ? 79.666 10.971 39.604 1.00 130.24 ? 603 NAG B C4 1 HETATM 10969 C C5 . NAG K 2 . ? 78.365 10.744 40.387 1.00 129.53 ? 603 NAG B C5 1 HETATM 10970 C C6 . NAG K 2 . ? 77.185 11.519 39.781 1.00 133.03 ? 603 NAG B C6 1 HETATM 10971 C C7 . NAG K 2 . ? 81.835 6.700 39.685 1.00 104.22 ? 603 NAG B C7 1 HETATM 10972 C C8 . NAG K 2 . ? 83.218 6.228 40.030 1.00 90.89 ? 603 NAG B C8 1 HETATM 10973 N N2 . NAG K 2 . ? 81.324 7.665 40.454 1.00 109.30 ? 603 NAG B N2 1 HETATM 10974 O O3 . NAG K 2 . ? 81.895 10.100 39.161 1.00 105.81 ? 603 NAG B O3 1 HETATM 10975 O O4 . NAG K 2 . ? 80.127 12.281 39.863 1.00 139.49 ? 603 NAG B O4 1 HETATM 10976 O O5 . NAG K 2 . ? 78.007 9.376 40.507 1.00 126.77 ? 603 NAG B O5 1 HETATM 10977 O O6 . NAG K 2 . ? 77.015 11.276 38.395 1.00 133.41 ? 603 NAG B O6 1 HETATM 10978 O O7 . NAG K 2 . ? 81.228 6.196 38.738 1.00 109.64 ? 603 NAG B O7 1 HETATM 10979 C C1 . NAG L 2 . ? 80.377 13.002 38.641 1.00 131.16 ? 604 NAG B C1 1 HETATM 10980 C C2 . NAG L 2 . ? 80.174 14.495 38.920 1.00 129.55 ? 604 NAG B C2 1 HETATM 10981 C C3 . NAG L 2 . ? 80.540 15.325 37.695 1.00 133.49 ? 604 NAG B C3 1 HETATM 10982 C C4 . NAG L 2 . ? 81.912 14.943 37.155 1.00 129.25 ? 604 NAG B C4 1 HETATM 10983 C C5 . NAG L 2 . ? 82.020 13.427 36.944 1.00 125.37 ? 604 NAG B C5 1 HETATM 10984 C C6 . NAG L 2 . ? 83.429 12.998 36.515 1.00 120.26 ? 604 NAG B C6 1 HETATM 10985 C C7 . NAG L 2 . ? 78.460 14.769 40.628 1.00 120.89 ? 604 NAG B C7 1 HETATM 10986 C C8 . NAG L 2 . ? 77.045 15.160 40.950 1.00 124.02 ? 604 NAG B C8 1 HETATM 10987 N N2 . NAG L 2 . ? 78.808 14.781 39.341 1.00 118.63 ? 604 NAG B N2 1 HETATM 10988 O O3 . NAG L 2 . ? 80.544 16.697 38.024 1.00 134.14 ? 604 NAG B O3 1 HETATM 10989 O O4 . NAG L 2 . ? 82.130 15.660 35.955 1.00 118.72 ? 604 NAG B O4 1 HETATM 10990 O O5 . NAG L 2 . ? 81.668 12.730 38.128 1.00 123.93 ? 604 NAG B O5 1 HETATM 10991 O O6 . NAG L 2 . ? 84.173 12.507 37.613 1.00 121.61 ? 604 NAG B O6 1 HETATM 10992 O O7 . NAG L 2 . ? 79.241 14.448 41.529 1.00 117.92 ? 604 NAG B O7 1 HETATM 10993 CA CA . CA M 4 . ? 67.426 -14.190 53.402 1.00 68.28 ? 605 CA B CA 1 HETATM 10994 C C1 . NAG N 2 . ? 125.804 -13.607 22.124 1.00 103.04 ? 601 NAG C C1 1 HETATM 10995 C C2 . NAG N 2 . ? 127.193 -13.670 22.760 1.00 101.60 ? 601 NAG C C2 1 HETATM 10996 C C3 . NAG N 2 . ? 127.406 -15.020 23.433 1.00 104.05 ? 601 NAG C C3 1 HETATM 10997 C C4 . NAG N 2 . ? 126.246 -15.358 24.361 1.00 114.07 ? 601 NAG C C4 1 HETATM 10998 C C5 . NAG N 2 . ? 124.893 -15.185 23.675 1.00 100.32 ? 601 NAG C C5 1 HETATM 10999 C C6 . NAG N 2 . ? 123.741 -15.324 24.669 1.00 87.10 ? 601 NAG C C6 1 HETATM 11000 C C7 . NAG N 2 . ? 129.033 -12.401 21.752 1.00 95.68 ? 601 NAG C C7 1 HETATM 11001 C C8 . NAG N 2 . ? 130.315 -12.562 20.981 1.00 78.36 ? 601 NAG C C8 1 HETATM 11002 N N2 . NAG N 2 . ? 128.227 -13.463 21.759 1.00 94.33 ? 601 NAG C N2 1 HETATM 11003 O O3 . NAG N 2 . ? 128.622 -15.019 24.152 1.00 99.29 ? 601 NAG C O3 1 HETATM 11004 O O4 . NAG N 2 . ? 126.396 -16.693 24.797 1.00 135.38 ? 601 NAG C O4 1 HETATM 11005 O O5 . NAG N 2 . ? 124.802 -13.910 23.075 1.00 102.64 ? 601 NAG C O5 1 HETATM 11006 O O6 . NAG N 2 . ? 123.690 -14.185 25.503 1.00 82.46 ? 601 NAG C O6 1 HETATM 11007 O O7 . NAG N 2 . ? 128.761 -11.341 22.330 1.00 101.46 ? 601 NAG C O7 1 HETATM 11008 C C1 . NAG O 2 . ? 126.873 -16.694 26.156 1.00 140.13 ? 602 NAG C C1 1 HETATM 11009 C C2 . NAG O 2 . ? 126.665 -18.075 26.775 1.00 135.49 ? 602 NAG C C2 1 HETATM 11010 C C3 . NAG O 2 . ? 127.163 -18.086 28.217 1.00 132.95 ? 602 NAG C C3 1 HETATM 11011 C C4 . NAG O 2 . ? 128.550 -17.459 28.344 1.00 135.58 ? 602 NAG C C4 1 HETATM 11012 C C5 . NAG O 2 . ? 128.635 -16.126 27.604 1.00 135.24 ? 602 NAG C C5 1 HETATM 11013 C C6 . NAG O 2 . ? 130.042 -15.529 27.641 1.00 123.26 ? 602 NAG C C6 1 HETATM 11014 C C7 . NAG O 2 . ? 124.882 -19.508 25.924 1.00 114.11 ? 602 NAG C C7 1 HETATM 11015 C C8 . NAG O 2 . ? 123.475 -20.003 26.107 1.00 105.44 ? 602 NAG C C8 1 HETATM 11016 N N2 . NAG O 2 . ? 125.268 -18.484 26.692 1.00 124.89 ? 602 NAG C N2 1 HETATM 11017 O O3 . NAG O 2 . ? 127.223 -19.420 28.665 1.00 129.34 ? 602 NAG C O3 1 HETATM 11018 O O4 . NAG O 2 . ? 128.846 -17.271 29.711 1.00 135.98 ? 602 NAG C O4 1 HETATM 11019 O O5 . NAG O 2 . ? 128.229 -16.305 26.263 1.00 142.70 ? 602 NAG C O5 1 HETATM 11020 O O6 . NAG O 2 . ? 131.006 -16.467 27.216 1.00 114.14 ? 602 NAG C O6 1 HETATM 11021 O O7 . NAG O 2 . ? 125.625 -20.042 25.095 1.00 111.96 ? 602 NAG C O7 1 HETATM 11022 C C1 . NAG P 2 . ? 92.081 -23.238 -10.716 1.00 92.70 ? 603 NAG C C1 1 HETATM 11023 C C2 . NAG P 2 . ? 91.533 -23.731 -9.377 1.00 89.07 ? 603 NAG C C2 1 HETATM 11024 C C3 . NAG P 2 . ? 90.566 -24.888 -9.572 1.00 92.55 ? 603 NAG C C3 1 HETATM 11025 C C4 . NAG P 2 . ? 89.544 -24.587 -10.662 1.00 103.08 ? 603 NAG C C4 1 HETATM 11026 C C5 . NAG P 2 . ? 90.238 -24.062 -11.910 1.00 109.24 ? 603 NAG C C5 1 HETATM 11027 C C6 . NAG P 2 . ? 89.254 -23.665 -13.002 1.00 118.45 ? 603 NAG C C6 1 HETATM 11028 C C7 . NAG P 2 . ? 92.972 -23.610 -7.379 1.00 82.92 ? 603 NAG C C7 1 HETATM 11029 C C8 . NAG P 2 . ? 93.894 -24.449 -6.545 1.00 65.01 ? 603 NAG C C8 1 HETATM 11030 N N2 . NAG P 2 . ? 92.614 -24.188 -8.528 1.00 92.66 ? 603 NAG C N2 1 HETATM 11031 O O3 . NAG P 2 . ? 89.918 -25.184 -8.355 1.00 92.89 ? 603 NAG C O3 1 HETATM 11032 O O4 . NAG P 2 . ? 88.879 -25.783 -10.976 1.00 105.83 ? 603 NAG C O4 1 HETATM 11033 O O5 . NAG P 2 . ? 90.992 -22.927 -11.554 1.00 100.40 ? 603 NAG C O5 1 HETATM 11034 O O6 . NAG P 2 . ? 88.887 -22.315 -12.822 1.00 127.74 ? 603 NAG C O6 1 HETATM 11035 O O7 . NAG P 2 . ? 92.613 -22.483 -7.008 1.00 74.77 ? 603 NAG C O7 1 HETATM 11036 C C1 . FUC Q 5 . ? 87.485 -22.164 -13.099 1.00 135.92 ? 604 FUC C C1 1 HETATM 11037 C C2 . FUC Q 5 . ? 86.818 -21.272 -12.054 1.00 133.89 ? 604 FUC C C2 1 HETATM 11038 C C3 . FUC Q 5 . ? 87.474 -19.895 -12.067 1.00 137.95 ? 604 FUC C C3 1 HETATM 11039 C C4 . FUC Q 5 . ? 87.484 -19.322 -13.490 1.00 141.59 ? 604 FUC C C4 1 HETATM 11040 C C5 . FUC Q 5 . ? 88.030 -20.355 -14.487 1.00 140.34 ? 604 FUC C C5 1 HETATM 11041 C C6 . FUC Q 5 . ? 87.966 -19.862 -15.931 1.00 133.91 ? 604 FUC C C6 1 HETATM 11042 O O2 . FUC Q 5 . ? 86.936 -21.830 -10.764 1.00 133.34 ? 604 FUC C O2 1 HETATM 11043 O O3 . FUC Q 5 . ? 86.794 -19.040 -11.173 1.00 134.99 ? 604 FUC C O3 1 HETATM 11044 O O4 . FUC Q 5 . ? 86.187 -18.907 -13.875 1.00 141.34 ? 604 FUC C O4 1 HETATM 11045 O O5 . FUC Q 5 . ? 87.311 -21.570 -14.370 1.00 143.41 ? 604 FUC C O5 1 HETATM 11046 C C1 . NAG R 2 . ? 87.488 -25.666 -10.654 1.00 103.32 ? 605 NAG C C1 1 HETATM 11047 C C2 . NAG R 2 . ? 86.760 -26.614 -11.602 1.00 101.49 ? 605 NAG C C2 1 HETATM 11048 C C3 . NAG R 2 . ? 85.265 -26.692 -11.272 1.00 100.46 ? 605 NAG C C3 1 HETATM 11049 C C4 . NAG R 2 . ? 84.956 -26.718 -9.765 1.00 107.19 ? 605 NAG C C4 1 HETATM 11050 C C5 . NAG R 2 . ? 85.860 -25.790 -8.941 1.00 103.77 ? 605 NAG C C5 1 HETATM 11051 C C6 . NAG R 2 . ? 85.698 -25.990 -7.426 1.00 93.18 ? 605 NAG C C6 1 HETATM 11052 C C7 . NAG R 2 . ? 87.873 -26.881 -13.794 1.00 95.89 ? 605 NAG C C7 1 HETATM 11053 C C8 . NAG R 2 . ? 87.661 -26.664 -15.268 1.00 101.22 ? 605 NAG C C8 1 HETATM 11054 N N2 . NAG R 2 . ? 87.026 -26.221 -12.985 1.00 94.13 ? 605 NAG C N2 1 HETATM 11055 O O3 . NAG R 2 . ? 84.746 -27.862 -11.862 1.00 90.53 ? 605 NAG C O3 1 HETATM 11056 O O4 . NAG R 2 . ? 83.607 -26.335 -9.556 1.00 121.01 ? 605 NAG C O4 1 HETATM 11057 O O5 . NAG R 2 . ? 87.218 -25.964 -9.299 1.00 104.44 ? 605 NAG C O5 1 HETATM 11058 O O6 . NAG R 2 . ? 86.423 -27.109 -6.950 1.00 74.88 ? 605 NAG C O6 1 HETATM 11059 O O7 . NAG R 2 . ? 88.784 -27.631 -13.407 1.00 77.98 ? 605 NAG C O7 1 HETATM 11060 C C1 . BMA S 3 . ? 82.725 -27.470 -9.398 1.00 130.28 ? 606 BMA C C1 1 HETATM 11061 C C2 . BMA S 3 . ? 81.590 -27.086 -8.450 1.00 127.16 ? 606 BMA C C2 1 HETATM 11062 C C3 . BMA S 3 . ? 80.662 -28.273 -8.225 1.00 137.08 ? 606 BMA C C3 1 HETATM 11063 C C4 . BMA S 3 . ? 80.244 -28.906 -9.552 1.00 134.12 ? 606 BMA C C4 1 HETATM 11064 C C5 . BMA S 3 . ? 81.451 -29.146 -10.459 1.00 132.22 ? 606 BMA C C5 1 HETATM 11065 C C6 . BMA S 3 . ? 81.005 -29.689 -11.820 1.00 118.44 ? 606 BMA C C6 1 HETATM 11066 O O2 . BMA S 3 . ? 80.845 -26.013 -8.986 1.00 117.66 ? 606 BMA C O2 1 HETATM 11067 O O3 . BMA S 3 . ? 79.539 -27.832 -7.487 1.00 150.41 ? 606 BMA C O3 1 HETATM 11068 O O4 . BMA S 3 . ? 79.604 -30.139 -9.306 1.00 128.48 ? 606 BMA C O4 1 HETATM 11069 O O5 . BMA S 3 . ? 82.178 -27.944 -10.615 1.00 140.37 ? 606 BMA C O5 1 HETATM 11070 O O6 . BMA S 3 . ? 81.870 -29.272 -12.856 1.00 111.34 ? 606 BMA C O6 1 HETATM 11071 C C1 . MAN T 6 . ? 79.724 -28.138 -6.089 1.00 159.16 ? 607 MAN C C1 1 HETATM 11072 C C2 . MAN T 6 . ? 78.364 -28.436 -5.470 1.00 159.99 ? 607 MAN C C2 1 HETATM 11073 C C3 . MAN T 6 . ? 77.493 -27.187 -5.572 1.00 158.30 ? 607 MAN C C3 1 HETATM 11074 C C4 . MAN T 6 . ? 78.208 -26.004 -4.918 1.00 163.43 ? 607 MAN C C4 1 HETATM 11075 C C5 . MAN T 6 . ? 79.619 -25.863 -5.489 1.00 168.09 ? 607 MAN C C5 1 HETATM 11076 C C6 . MAN T 6 . ? 80.399 -24.741 -4.807 1.00 166.59 ? 607 MAN C C6 1 HETATM 11077 O O2 . MAN T 6 . ? 78.530 -28.827 -4.123 1.00 157.84 ? 607 MAN C O2 1 HETATM 11078 O O3 . MAN T 6 . ? 76.236 -27.418 -4.973 1.00 150.79 ? 607 MAN C O3 1 HETATM 11079 O O4 . MAN T 6 . ? 77.491 -24.810 -5.150 1.00 158.01 ? 607 MAN C O4 1 HETATM 11080 O O5 . MAN T 6 . ? 80.321 -27.087 -5.354 1.00 164.97 ? 607 MAN C O5 1 HETATM 11081 O O6 . MAN T 6 . ? 81.470 -24.336 -5.633 1.00 163.18 ? 607 MAN C O6 1 HETATM 11082 CA CA . CA U 4 . ? 116.112 -8.901 -15.716 1.00 73.00 ? 608 CA C CA 1 HETATM 11083 C C1 . NAG V 2 . ? 110.916 -10.734 46.880 1.00 97.38 ? 601 NAG D C1 1 HETATM 11084 C C2 . NAG V 2 . ? 111.538 -11.277 48.155 1.00 99.77 ? 601 NAG D C2 1 HETATM 11085 C C3 . NAG V 2 . ? 112.708 -12.191 47.826 1.00 107.24 ? 601 NAG D C3 1 HETATM 11086 C C4 . NAG V 2 . ? 112.320 -13.248 46.790 1.00 113.41 ? 601 NAG D C4 1 HETATM 11087 C C5 . NAG V 2 . ? 111.515 -12.664 45.626 1.00 111.60 ? 601 NAG D C5 1 HETATM 11088 C C6 . NAG V 2 . ? 110.884 -13.765 44.770 1.00 104.62 ? 601 NAG D C6 1 HETATM 11089 C C7 . NAG V 2 . ? 111.869 -10.198 50.317 1.00 111.29 ? 601 NAG D C7 1 HETATM 11090 C C8 . NAG V 2 . ? 113.087 -9.751 51.087 1.00 104.49 ? 601 NAG D C8 1 HETATM 11091 N N2 . NAG V 2 . ? 112.000 -10.182 48.986 1.00 102.03 ? 601 NAG D N2 1 HETATM 11092 O O3 . NAG V 2 . ? 113.166 -12.780 49.029 1.00 107.31 ? 601 NAG D O3 1 HETATM 11093 O O4 . NAG V 2 . ? 113.484 -13.890 46.294 1.00 121.55 ? 601 NAG D O4 1 HETATM 11094 O O5 . NAG V 2 . ? 110.482 -11.807 46.076 1.00 107.46 ? 601 NAG D O5 1 HETATM 11095 O O6 . NAG V 2 . ? 109.848 -14.415 45.472 1.00 97.07 ? 601 NAG D O6 1 HETATM 11096 O O7 . NAG V 2 . ? 110.822 -10.546 50.911 1.00 112.80 ? 601 NAG D O7 1 HETATM 11097 C C1 . NAG W 2 . ? 113.565 -15.199 46.895 1.00 133.70 ? 602 NAG D C1 1 HETATM 11098 C C2 . NAG W 2 . ? 114.006 -16.208 45.852 1.00 139.82 ? 602 NAG D C2 1 HETATM 11099 C C3 . NAG W 2 . ? 114.075 -17.623 46.419 1.00 157.51 ? 602 NAG D C3 1 HETATM 11100 C C4 . NAG W 2 . ? 114.848 -17.649 47.736 1.00 163.72 ? 602 NAG D C4 1 HETATM 11101 C C5 . NAG W 2 . ? 114.399 -16.515 48.661 1.00 150.73 ? 602 NAG D C5 1 HETATM 11102 C C6 . NAG W 2 . ? 115.284 -16.415 49.901 1.00 135.25 ? 602 NAG D C6 1 HETATM 11103 C C7 . NAG W 2 . ? 113.692 -16.091 43.502 1.00 138.59 ? 602 NAG D C7 1 HETATM 11104 C C8 . NAG W 2 . ? 112.877 -16.633 42.362 1.00 127.47 ? 602 NAG D C8 1 HETATM 11105 N N2 . NAG W 2 . ? 113.130 -16.178 44.703 1.00 138.48 ? 602 NAG D N2 1 HETATM 11106 O O3 . NAG W 2 . ? 114.705 -18.461 45.468 1.00 170.98 ? 602 NAG D O3 1 HETATM 11107 O O4 . NAG W 2 . ? 114.725 -18.915 48.372 1.00 173.23 ? 602 NAG D O4 1 HETATM 11108 O O5 . NAG W 2 . ? 114.465 -15.275 47.977 1.00 147.28 ? 602 NAG D O5 1 HETATM 11109 O O6 . NAG W 2 . ? 116.209 -15.359 49.731 1.00 123.18 ? 602 NAG D O6 1 HETATM 11110 O O7 . NAG W 2 . ? 114.824 -15.596 43.342 1.00 143.69 ? 602 NAG D O7 1 HETATM 11111 C C1 . BMA X 3 . ? 115.921 -19.723 48.198 1.00 174.83 ? 603 BMA D C1 1 HETATM 11112 C C2 . BMA X 3 . ? 115.787 -21.006 49.019 1.00 169.31 ? 603 BMA D C2 1 HETATM 11113 C C3 . BMA X 3 . ? 117.070 -21.835 48.910 1.00 171.98 ? 603 BMA D C3 1 HETATM 11114 C C4 . BMA X 3 . ? 117.513 -22.010 47.451 1.00 168.26 ? 603 BMA D C4 1 HETATM 11115 C C5 . BMA X 3 . ? 117.515 -20.676 46.704 1.00 165.41 ? 603 BMA D C5 1 HETATM 11116 C C6 . BMA X 3 . ? 117.861 -20.888 45.225 1.00 147.46 ? 603 BMA D C6 1 HETATM 11117 O O2 . BMA X 3 . ? 114.658 -21.757 48.602 1.00 157.58 ? 603 BMA D O2 1 HETATM 11118 O O3 . BMA X 3 . ? 116.864 -23.092 49.520 1.00 171.65 ? 603 BMA D O3 1 HETATM 11119 O O4 . BMA X 3 . ? 118.806 -22.574 47.382 1.00 164.01 ? 603 BMA D O4 1 HETATM 11120 O O5 . BMA X 3 . ? 116.248 -20.051 46.851 1.00 175.55 ? 603 BMA D O5 1 HETATM 11121 O O6 . BMA X 3 . ? 118.038 -19.661 44.546 1.00 135.50 ? 603 BMA D O6 1 HETATM 11122 CA CA . CA Y 4 . ? 109.840 25.917 34.766 1.00 110.11 ? 604 CA D CA 1 HETATM 11123 O O . HOH Z 7 . ? 89.308 -55.769 1.104 1.00 40.45 ? 701 HOH A O 1 HETATM 11124 O O . HOH Z 7 . ? 79.217 -36.062 9.088 1.00 44.18 ? 702 HOH A O 1 HETATM 11125 O O . HOH Z 7 . ? 84.203 -49.155 28.465 1.00 43.66 ? 703 HOH A O 1 HETATM 11126 O O . HOH Z 7 . ? 93.939 -54.937 2.472 1.00 48.78 ? 704 HOH A O 1 HETATM 11127 O O . HOH Z 7 . ? 85.932 -49.807 30.622 1.00 51.45 ? 705 HOH A O 1 HETATM 11128 O O . HOH Z 7 . ? 109.303 -30.495 12.170 1.00 47.48 ? 706 HOH A O 1 HETATM 11129 O O . HOH Z 7 . ? 106.511 -39.436 15.658 1.00 51.81 ? 707 HOH A O 1 HETATM 11130 O O . HOH Z 7 . ? 90.543 -42.688 15.887 1.00 46.58 ? 708 HOH A O 1 HETATM 11131 O O . HOH Z 7 . ? 87.106 -48.706 18.380 1.00 52.33 ? 709 HOH A O 1 HETATM 11132 O O . HOH Z 7 . ? 89.175 -38.690 16.414 1.00 46.87 ? 710 HOH A O 1 HETATM 11133 O O . HOH Z 7 . ? 94.940 -42.633 8.024 1.00 42.72 ? 711 HOH A O 1 HETATM 11134 O O . HOH Z 7 . ? 84.819 -46.425 11.249 1.00 49.29 ? 712 HOH A O 1 HETATM 11135 O O . HOH Z 7 . ? 97.275 -37.852 19.592 1.00 39.53 ? 713 HOH A O 1 HETATM 11136 O O . HOH Z 7 . ? 98.634 -48.805 -2.149 1.00 56.17 ? 714 HOH A O 1 HETATM 11137 O O . HOH Z 7 . ? 103.328 -59.697 18.858 1.00 58.94 ? 715 HOH A O 1 HETATM 11138 O O . HOH Z 7 . ? 75.572 -41.303 29.780 1.00 48.98 ? 716 HOH A O 1 HETATM 11139 O O . HOH Z 7 . ? 84.334 -29.351 28.707 1.00 49.78 ? 717 HOH A O 1 HETATM 11140 O O . HOH Z 7 . ? 91.629 -45.435 6.171 1.00 46.88 ? 718 HOH A O 1 HETATM 11141 O O . HOH Z 7 . ? 73.269 -39.660 29.778 1.00 50.99 ? 719 HOH A O 1 HETATM 11142 O O . HOH Z 7 . ? 87.214 -33.004 25.616 1.00 50.60 ? 720 HOH A O 1 HETATM 11143 O O . HOH Z 7 . ? 98.024 -39.869 20.708 1.00 51.58 ? 721 HOH A O 1 HETATM 11144 O O . HOH Z 7 . ? 79.210 -44.677 16.102 1.00 53.32 ? 722 HOH A O 1 HETATM 11145 O O . HOH Z 7 . ? 82.229 -34.573 6.782 1.00 45.13 ? 723 HOH A O 1 HETATM 11146 O O . HOH Z 7 . ? 80.233 -51.032 8.958 1.00 64.98 ? 724 HOH A O 1 HETATM 11147 O O . HOH Z 7 . ? 103.500 -29.656 16.003 1.00 49.02 ? 725 HOH A O 1 HETATM 11148 O O . HOH Z 7 . ? 104.301 -40.475 21.552 1.00 64.00 ? 726 HOH A O 1 HETATM 11149 O O . HOH Z 7 . ? 70.996 -54.827 8.766 1.00 60.01 ? 727 HOH A O 1 HETATM 11150 O O . HOH Z 7 . ? 92.086 -61.319 8.163 1.00 67.29 ? 728 HOH A O 1 HETATM 11151 O O . HOH Z 7 . ? 92.586 -56.482 -0.151 1.00 55.46 ? 729 HOH A O 1 HETATM 11152 O O . HOH Z 7 . ? 73.236 -59.154 23.866 1.00 69.80 ? 730 HOH A O 1 HETATM 11153 O O . HOH Z 7 . ? 93.559 -58.347 1.555 1.00 72.42 ? 731 HOH A O 1 HETATM 11154 O O . HOH Z 7 . ? 68.991 -56.848 9.467 1.00 57.41 ? 732 HOH A O 1 HETATM 11155 O O . HOH Z 7 . ? 90.774 -43.736 -8.632 1.00 50.06 ? 733 HOH A O 1 HETATM 11156 O O . HOH Z 7 . ? 87.885 -38.686 4.633 1.00 71.58 ? 734 HOH A O 1 HETATM 11157 O O . HOH Z 7 . ? 86.920 -17.733 21.859 1.00 70.09 ? 735 HOH A O 1 HETATM 11158 O O . HOH Z 7 . ? 73.360 -28.540 19.010 1.00 51.10 ? 736 HOH A O 1 HETATM 11159 O O . HOH Z 7 . ? 76.953 -34.458 9.370 1.00 52.25 ? 737 HOH A O 1 HETATM 11160 O O . HOH Z 7 . ? 88.784 -50.557 32.574 1.00 61.82 ? 738 HOH A O 1 HETATM 11161 O O . HOH Z 7 . ? 96.470 -57.297 1.622 1.00 60.97 ? 739 HOH A O 1 HETATM 11162 O O . HOH Z 7 . ? 71.088 -39.731 27.982 1.00 74.72 ? 740 HOH A O 1 HETATM 11163 O O . HOH Z 7 . ? 74.213 -54.576 0.829 1.00 73.12 ? 741 HOH A O 1 HETATM 11164 O O . HOH Z 7 . ? 74.676 -37.570 29.442 1.00 50.79 ? 742 HOH A O 1 HETATM 11165 O O . HOH Z 7 . ? 78.559 -41.990 13.088 1.00 43.90 ? 743 HOH A O 1 HETATM 11166 O O . HOH Z 7 . ? 95.547 -59.574 18.273 1.00 64.98 ? 744 HOH A O 1 HETATM 11167 O O . HOH Z 7 . ? 88.257 -44.702 29.750 1.00 50.23 ? 745 HOH A O 1 HETATM 11168 O O . HOH Z 7 . ? 90.009 -52.711 25.707 1.00 59.50 ? 746 HOH A O 1 HETATM 11169 O O . HOH Z 7 . ? 90.512 -39.609 -0.715 1.00 57.80 ? 747 HOH A O 1 HETATM 11170 O O . HOH Z 7 . ? 82.031 -41.433 6.788 1.00 49.78 ? 748 HOH A O 1 HETATM 11171 O O . HOH Z 7 . ? 99.687 -46.176 32.399 1.00 53.31 ? 749 HOH A O 1 HETATM 11172 O O . HOH Z 7 . ? 99.799 -29.604 9.245 1.00 58.18 ? 750 HOH A O 1 HETATM 11173 O O . HOH Z 7 . ? 82.662 -56.286 8.148 1.00 60.70 ? 751 HOH A O 1 HETATM 11174 O O . HOH Z 7 . ? 97.484 -57.929 18.681 1.00 71.75 ? 752 HOH A O 1 HETATM 11175 O O . HOH Z 7 . ? 77.608 -44.672 13.895 1.00 51.81 ? 753 HOH A O 1 HETATM 11176 O O . HOH Z 7 . ? 85.831 -20.000 22.967 1.00 57.17 ? 754 HOH A O 1 HETATM 11177 O O . HOH Z 7 . ? 108.279 -46.416 20.420 1.00 68.29 ? 755 HOH A O 1 HETATM 11178 O O . HOH Z 7 . ? 85.947 -44.433 -3.482 1.00 65.43 ? 756 HOH A O 1 HETATM 11179 O O . HOH Z 7 . ? 97.053 -41.740 -9.677 1.00 59.93 ? 757 HOH A O 1 HETATM 11180 O O . HOH AA 7 . ? 80.496 -26.130 44.440 1.00 51.37 ? 701 HOH B O 1 HETATM 11181 O O . HOH AA 7 . ? 85.597 -16.438 44.678 1.00 52.04 ? 702 HOH B O 1 HETATM 11182 O O . HOH AA 7 . ? 78.620 -9.549 50.979 1.00 49.04 ? 703 HOH B O 1 HETATM 11183 O O . HOH AA 7 . ? 76.789 -25.182 47.079 1.00 47.77 ? 704 HOH B O 1 HETATM 11184 O O . HOH AA 7 . ? 71.615 -15.518 54.465 1.00 56.91 ? 705 HOH B O 1 HETATM 11185 O O . HOH AA 7 . ? 85.132 -18.532 47.733 1.00 58.43 ? 706 HOH B O 1 HETATM 11186 O O . HOH AA 7 . ? 71.127 -19.204 58.433 1.00 64.09 ? 707 HOH B O 1 HETATM 11187 O O . HOH AA 7 . ? 72.634 -33.794 48.861 1.00 70.60 ? 708 HOH B O 1 HETATM 11188 O O . HOH AA 7 . ? 98.708 -9.595 37.112 1.00 48.26 ? 709 HOH B O 1 HETATM 11189 O O . HOH AA 7 . ? 87.189 -28.689 28.495 1.00 44.85 ? 710 HOH B O 1 HETATM 11190 O O . HOH AA 7 . ? 96.720 -11.627 38.008 1.00 55.05 ? 711 HOH B O 1 HETATM 11191 O O . HOH AA 7 . ? 84.337 -16.979 21.020 1.00 67.29 ? 712 HOH B O 1 HETATM 11192 O O . HOH AA 7 . ? 85.824 -40.964 42.714 1.00 63.17 ? 713 HOH B O 1 HETATM 11193 O O . HOH AA 7 . ? 68.177 -27.647 54.825 1.00 38.84 ? 714 HOH B O 1 HETATM 11194 O O . HOH AA 7 . ? 65.133 -8.952 58.648 1.00 64.94 ? 715 HOH B O 1 HETATM 11195 O O . HOH AA 7 . ? 75.802 -20.834 39.939 1.00 65.08 ? 716 HOH B O 1 HETATM 11196 O O . HOH AA 7 . ? 75.888 -25.501 49.605 1.00 49.93 ? 717 HOH B O 1 HETATM 11197 O O . HOH AA 7 . ? 75.098 -11.711 58.468 1.00 56.66 ? 718 HOH B O 1 HETATM 11198 O O . HOH AA 7 . ? 68.268 -0.802 59.836 1.00 66.87 ? 719 HOH B O 1 HETATM 11199 O O . HOH AA 7 . ? 72.681 -0.291 54.798 1.00 66.06 ? 720 HOH B O 1 HETATM 11200 O O . HOH AA 7 . ? 64.391 -6.082 51.837 1.00 64.68 ? 721 HOH B O 1 HETATM 11201 O O . HOH AA 7 . ? 76.246 -25.252 26.058 1.00 63.40 ? 722 HOH B O 1 HETATM 11202 O O . HOH AA 7 . ? 74.646 -13.624 37.857 1.00 55.69 ? 723 HOH B O 1 HETATM 11203 O O . HOH AA 7 . ? 64.432 -23.649 62.390 1.00 69.50 ? 724 HOH B O 1 HETATM 11204 O O . HOH AA 7 . ? 83.470 18.540 34.686 1.00 89.78 ? 725 HOH B O 1 HETATM 11205 O O . HOH AA 7 . ? 76.302 11.801 35.907 1.00 74.64 ? 726 HOH B O 1 HETATM 11206 O O . HOH AA 7 . ? 97.114 -6.688 37.208 1.00 54.93 ? 727 HOH B O 1 HETATM 11207 O O . HOH BA 7 . ? 127.047 -3.264 -9.644 1.00 48.94 ? 701 HOH C O 1 HETATM 11208 O O . HOH BA 7 . ? 113.237 -16.007 2.861 1.00 50.61 ? 702 HOH C O 1 HETATM 11209 O O . HOH BA 7 . ? 116.963 -17.960 10.398 1.00 51.98 ? 703 HOH C O 1 HETATM 11210 O O . HOH BA 7 . ? 109.602 -14.741 -8.105 1.00 46.98 ? 704 HOH C O 1 HETATM 11211 O O . HOH BA 7 . ? 105.708 -10.096 -5.099 1.00 57.07 ? 705 HOH C O 1 HETATM 11212 O O . HOH BA 7 . ? 119.543 -19.200 9.434 1.00 51.59 ? 706 HOH C O 1 HETATM 11213 O O . HOH BA 7 . ? 96.359 -14.380 -7.966 1.00 51.55 ? 707 HOH C O 1 HETATM 11214 O O . HOH BA 7 . ? 110.662 -15.559 -13.216 1.00 55.98 ? 708 HOH C O 1 HETATM 11215 O O . HOH BA 7 . ? 114.677 -18.142 -11.303 1.00 62.13 ? 709 HOH C O 1 HETATM 11216 O O . HOH BA 7 . ? 87.942 -21.155 -1.812 1.00 55.62 ? 710 HOH C O 1 HETATM 11217 O O . HOH BA 7 . ? 106.043 -32.047 -15.342 1.00 67.75 ? 711 HOH C O 1 HETATM 11218 O O . HOH BA 7 . ? 94.228 -21.675 0.111 1.00 50.36 ? 712 HOH C O 1 HETATM 11219 O O . HOH BA 7 . ? 103.433 -30.206 -13.355 1.00 44.63 ? 713 HOH C O 1 HETATM 11220 O O . HOH BA 7 . ? 97.756 -30.739 -13.689 1.00 133.46 ? 714 HOH C O 1 HETATM 11221 O O . HOH BA 7 . ? 105.812 -7.006 -2.125 1.00 53.24 ? 715 HOH C O 1 HETATM 11222 O O . HOH BA 7 . ? 111.067 -15.970 -10.496 1.00 52.38 ? 716 HOH C O 1 HETATM 11223 O O . HOH BA 7 . ? 102.976 -10.470 -5.733 1.00 62.88 ? 717 HOH C O 1 HETATM 11224 O O . HOH BA 7 . ? 103.125 -13.449 17.726 1.00 72.53 ? 718 HOH C O 1 HETATM 11225 O O . HOH BA 7 . ? 127.110 -12.260 -13.251 1.00 63.43 ? 719 HOH C O 1 HETATM 11226 O O . HOH BA 7 . ? 111.651 -17.709 -21.465 1.00 61.33 ? 720 HOH C O 1 HETATM 11227 O O . HOH BA 7 . ? 129.692 -12.887 -12.825 1.00 68.94 ? 721 HOH C O 1 HETATM 11228 O O . HOH BA 7 . ? 123.789 -11.065 -13.691 1.00 72.31 ? 722 HOH C O 1 HETATM 11229 O O . HOH BA 7 . ? 119.041 -19.581 -16.208 1.00 73.99 ? 723 HOH C O 1 HETATM 11230 O O . HOH BA 7 . ? 109.291 -26.705 17.886 1.00 47.76 ? 724 HOH C O 1 HETATM 11231 O O . HOH BA 7 . ? 103.655 -15.752 17.440 1.00 52.61 ? 725 HOH C O 1 HETATM 11232 O O . HOH CA 7 . ? 110.268 22.963 47.069 1.00 81.05 ? 701 HOH D O 1 HETATM 11233 O O . HOH CA 7 . ? 102.016 -4.598 33.633 1.00 71.69 ? 702 HOH D O 1 HETATM 11234 O O . HOH CA 7 . ? 101.923 0.838 21.846 1.00 55.87 ? 703 HOH D O 1 HETATM 11235 O O . HOH CA 7 . ? 103.330 24.647 32.389 1.00 78.84 ? 704 HOH D O 1 HETATM 11236 O O . HOH CA 7 . ? 106.184 14.611 51.125 1.00 72.85 ? 705 HOH D O 1 HETATM 11237 O O . HOH CA 7 . ? 103.623 -8.587 37.524 1.00 62.62 ? 706 HOH D O 1 HETATM 11238 O O . HOH CA 7 . ? 111.613 -0.941 34.833 1.00 71.97 ? 707 HOH D O 1 HETATM 11239 O O . HOH CA 7 . ? 102.179 -10.533 44.077 1.00 63.16 ? 708 HOH D 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 . ALA A 6 ? 1.0156 1.0619 0.9899 0.0308 -0.0689 0.0788 82 ALA A N 2 C CA . ALA A 6 ? 1.1841 1.2107 1.1551 0.0361 -0.0631 0.0778 82 ALA A CA 3 C C . ALA A 6 ? 1.1790 1.2036 1.1470 0.0475 -0.0594 0.0848 82 ALA A C 4 O O . ALA A 6 ? 1.1184 1.1576 1.0924 0.0535 -0.0593 0.0916 82 ALA A O 5 C CB . ALA A 6 ? 0.8537 0.8789 0.8319 0.0345 -0.0608 0.0765 82 ALA A CB 6 N N . THR A 7 ? 1.1415 1.1484 1.1004 0.0505 -0.0561 0.0832 83 THR A N 7 C CA . THR A 7 ? 1.1305 1.1324 1.0838 0.0603 -0.0522 0.0892 83 THR A CA 8 C C . THR A 7 ? 1.0676 1.0474 1.0148 0.0629 -0.0460 0.0862 83 THR A C 9 O O . THR A 7 ? 1.0273 0.9962 0.9721 0.0565 -0.0460 0.0793 83 THR A O 10 C CB . THR A 7 ? 1.1437 1.1486 1.0903 0.0601 -0.0551 0.0906 83 THR A CB 11 O OG1 . THR A 7 ? 1.3690 1.3608 1.3073 0.0681 -0.0500 0.0941 83 THR A OG1 12 C CG2 . THR A 7 ? 1.0167 1.0141 0.9590 0.0503 -0.0579 0.0824 83 THR A CG2 13 N N . PRO A 8 ? 0.9407 0.9139 0.8847 0.0722 -0.0405 0.0914 84 PRO A N 14 C CA . PRO A 8 ? 0.8260 0.7781 0.7633 0.0739 -0.0344 0.0881 84 PRO A CA 15 C C . PRO A 8 ? 0.9001 0.8389 0.8285 0.0696 -0.0342 0.0833 84 PRO A C 16 O O . PRO A 8 ? 1.0011 0.9422 0.9249 0.0709 -0.0356 0.0859 84 PRO A O 17 C CB . PRO A 8 ? 0.8501 0.7987 0.7845 0.0847 -0.0286 0.0954 84 PRO A CB 18 C CG . PRO A 8 ? 0.9471 0.9166 0.8906 0.0889 -0.0314 0.1019 84 PRO A CG 19 C CD . PRO A 8 ? 0.9007 0.8858 0.8479 0.0815 -0.0393 0.1003 84 PRO A CD 20 N N . LEU A 9 ? 1.0063 0.9325 0.9324 0.0647 -0.0324 0.0766 85 LEU A N 21 C CA . LEU A 9 ? 0.9338 0.8466 0.8516 0.0610 -0.0311 0.0720 85 LEU A CA 22 C C . LEU A 9 ? 0.9764 0.8764 0.8856 0.0675 -0.0249 0.0754 85 LEU A C 23 O O . LEU A 9 ? 1.0161 0.9084 0.9241 0.0724 -0.0195 0.0771 85 LEU A O 24 C CB . LEU A 9 ? 0.8582 0.7623 0.7765 0.0551 -0.0302 0.0647 85 LEU A CB 25 C CG . LEU A 9 ? 0.8956 0.7883 0.8072 0.0500 -0.0294 0.0589 85 LEU A CG 26 C CD1 . LEU A 9 ? 1.0126 0.9078 0.9287 0.0431 -0.0327 0.0529 85 LEU A CD1 27 C CD2 . LEU A 9 ? 0.7688 0.6457 0.6735 0.0522 -0.0228 0.0574 85 LEU A CD2 28 N N . VAL A 10 ? 0.9414 0.8384 0.8441 0.0675 -0.0252 0.0765 86 VAL A N 29 C CA . VAL A 10 ? 0.9643 0.8470 0.8577 0.0728 -0.0188 0.0793 86 VAL A CA 30 C C . VAL A 10 ? 0.9756 0.8468 0.8612 0.0670 -0.0180 0.0741 86 VAL A C 31 O O . VAL A 10 ? 1.0091 0.8869 0.8948 0.0624 -0.0228 0.0722 86 VAL A O 32 C CB . VAL A 10 ? 0.8373 0.7279 0.7295 0.0814 -0.0185 0.0885 86 VAL A CB 33 C CG1 . VAL A 10 ? 0.8070 0.7165 0.7040 0.0787 -0.0264 0.0901 86 VAL A CG1 34 C CG2 . VAL A 10 ? 0.8358 0.7110 0.7167 0.0855 -0.0127 0.0912 86 VAL A CG2 35 N N . LEU A 11 ? 0.9452 0.7993 0.8243 0.0667 -0.0116 0.0712 87 LEU A N 36 C CA . LEU A 11 ? 0.9161 0.7595 0.7885 0.0608 -0.0101 0.0658 87 LEU A CA 37 C C . LEU A 11 ? 0.9618 0.7973 0.8248 0.0647 -0.0065 0.0704 87 LEU A C 38 O O . LEU A 11 ? 0.9044 0.7405 0.7653 0.0729 -0.0042 0.0780 87 LEU A O 39 C CB . LEU A 11 ? 0.9393 0.7693 0.8091 0.0573 -0.0050 0.0599 87 LEU A CB 40 C CG . LEU A 11 ? 0.9903 0.8256 0.8678 0.0540 -0.0073 0.0554 87 LEU A CG 41 C CD1 . LEU A 11 ? 0.8845 0.7079 0.7586 0.0558 -0.0007 0.0541 87 LEU A CD1 42 C CD2 . LEU A 11 ? 0.9879 0.8254 0.8675 0.0456 -0.0109 0.0482 87 LEU A CD2 43 N N . GLY A 12 ? 0.8748 0.7029 0.7320 0.0592 -0.0058 0.0662 88 GLY A N 44 C CA . GLY A 12 ? 0.7962 0.6156 0.6438 0.0620 -0.0020 0.0701 88 GLY A CA 45 C C . GLY A 12 ? 0.9014 0.7019 0.7405 0.0658 0.0073 0.0718 88 GLY A C 46 O O . GLY A 12 ? 0.8412 0.6313 0.6794 0.0619 0.0114 0.0662 88 GLY A O 47 N N . GLU A 13 ? 0.9291 0.7252 0.7616 0.0735 0.0109 0.0796 89 GLU A N 48 C CA . GLU A 13 ? 0.8528 0.6289 0.6757 0.0776 0.0207 0.0820 89 GLU A CA 49 C C . GLU A 13 ? 0.8492 0.6094 0.6635 0.0704 0.0255 0.0763 89 GLU A C 50 O O . GLU A 13 ? 0.8798 0.6222 0.6874 0.0696 0.0336 0.0742 89 GLU A O 51 C CB . GLU A 13 ? 0.7619 0.5380 0.5800 0.0887 0.0234 0.0928 89 GLU A CB 52 C CG . GLU A 13 ? 0.8577 0.6422 0.6823 0.0972 0.0232 0.0985 89 GLU A CG 53 C CD . GLU A 13 ? 1.0667 0.8380 0.8910 0.0967 0.0295 0.0945 89 GLU A CD 54 O OE1 . GLU A 13 ? 1.2039 0.9539 1.0181 0.0968 0.0384 0.0934 89 GLU A OE1 55 O OE2 . GLU A 13 ? 0.9712 0.7532 0.8048 0.0958 0.0257 0.0923 89 GLU A OE2 56 N N . ASN A 14 ? 0.8030 0.5696 0.6173 0.0647 0.0209 0.0736 90 ASN A N 57 C CA . ASN A 14 ? 0.8998 0.6530 0.7060 0.0581 0.0255 0.0688 90 ASN A CA 58 C C . ASN A 14 ? 0.8369 0.5969 0.6487 0.0481 0.0208 0.0597 90 ASN A C 59 O O . ASN A 14 ? 0.8740 0.6495 0.6924 0.0463 0.0131 0.0588 90 ASN A O 60 C CB . ASN A 14 ? 0.9572 0.7083 0.7552 0.0613 0.0265 0.0747 90 ASN A CB 61 C CG . ASN A 14 ? 1.0566 0.8032 0.8493 0.0726 0.0306 0.0850 90 ASN A CG 62 O OD1 . ASN A 14 ? 1.0095 0.7696 0.8040 0.0784 0.0256 0.0916 90 ASN A OD1 63 N ND2 . ASN A 14 ? 0.9757 0.7034 0.7615 0.0759 0.0400 0.0864 90 ASN A ND2 64 N N . LEU A 15 ? 0.7119 0.4606 0.5209 0.0414 0.0257 0.0531 91 LEU A N 65 C CA . LEU A 15 ? 0.7540 0.5097 0.5684 0.0324 0.0218 0.0448 91 LEU A CA 66 C C . LEU A 15 ? 0.9194 0.6779 0.7306 0.0289 0.0198 0.0441 91 LEU A C 67 O O . LEU A 15 ? 0.8304 0.5791 0.6324 0.0309 0.0245 0.0480 91 LEU A O 68 C CB . LEU A 15 ? 0.7976 0.5420 0.6095 0.0259 0.0276 0.0380 91 LEU A CB 69 C CG . LEU A 15 ? 0.8177 0.5618 0.6339 0.0268 0.0284 0.0360 91 LEU A CG 70 C CD1 . LEU A 15 ? 0.7282 0.4612 0.5404 0.0195 0.0344 0.0290 91 LEU A CD1 71 C CD2 . LEU A 15 ? 0.7427 0.5044 0.5704 0.0264 0.0199 0.0341 91 LEU A CD2 72 N N . CYS A 16 ? 0.7901 0.5612 0.6083 0.0240 0.0135 0.0393 92 CYS A N 73 C CA . CYS A 16 ? 0.7451 0.5166 0.5599 0.0190 0.0132 0.0365 92 CYS A CA 74 C C . CYS A 16 ? 0.8929 0.6514 0.7020 0.0132 0.0205 0.0319 92 CYS A C 75 O O . CYS A 16 ? 1.0162 0.7703 0.8272 0.0105 0.0233 0.0281 92 CYS A O 76 C CB . CYS A 16 ? 0.6821 0.4679 0.5052 0.0147 0.0062 0.0315 92 CYS A CB 77 S SG . CYS A 16 ? 1.1510 0.9531 0.9816 0.0194 -0.0026 0.0353 92 CYS A SG 78 N N . SER A 17 ? 0.9137 0.6658 0.7152 0.0111 0.0239 0.0325 93 SER A N 79 C CA . SER A 17 ? 0.8640 0.6052 0.6604 0.0042 0.0307 0.0277 93 SER A CA 80 C C . SER A 17 ? 0.9874 0.7393 0.7922 -0.0030 0.0271 0.0196 93 SER A C 81 O O . SER A 17 ? 1.0259 0.7904 0.8364 -0.0033 0.0208 0.0185 93 SER A O 82 C CB . SER A 17 ? 0.8607 0.5939 0.6473 0.0039 0.0348 0.0307 93 SER A CB 83 O OG . SER A 17 ? 1.0560 0.7782 0.8374 -0.0033 0.0420 0.0261 93 SER A OG 84 N N . ILE A 18 ? 0.8598 0.6070 0.6651 -0.0088 0.0312 0.0141 94 ILE A N 85 C CA . ILE A 18 ? 0.7862 0.5449 0.5999 -0.0149 0.0280 0.0070 94 ILE A CA 86 C C . ILE A 18 ? 0.7847 0.5393 0.5949 -0.0231 0.0333 0.0018 94 ILE A C 87 O O . ILE A 18 ? 0.8629 0.6052 0.6668 -0.0266 0.0402 0.0005 94 ILE A O 88 C CB . ILE A 18 ? 0.7879 0.5505 0.6080 -0.0151 0.0263 0.0043 94 ILE A CB 89 C CG1 . ILE A 18 ? 0.7646 0.5332 0.5894 -0.0075 0.0208 0.0091 94 ILE A CG1 90 C CG2 . ILE A 18 ? 0.6886 0.4636 0.5168 -0.0210 0.0233 -0.0025 94 ILE A CG2 91 C CD1 . ILE A 18 ? 0.7405 0.5109 0.5700 -0.0067 0.0202 0.0075 94 ILE A CD1 92 N N . ASN A 19 ? 0.7535 0.5184 0.5679 -0.0264 0.0304 -0.0013 95 ASN A N 93 C CA . ASN A 19 ? 0.8335 0.5969 0.6456 -0.0343 0.0352 -0.0062 95 ASN A CA 94 C C . ASN A 19 ? 0.8367 0.6155 0.6587 -0.0387 0.0316 -0.0123 95 ASN A C 95 O O . ASN A 19 ? 0.9518 0.7331 0.7743 -0.0456 0.0351 -0.0170 95 ASN A O 96 C CB . ASN A 19 ? 0.7940 0.5533 0.5994 -0.0340 0.0373 -0.0034 95 ASN A CB 97 C CG . ASN A 19 ? 0.8104 0.5540 0.6050 -0.0297 0.0420 0.0030 95 ASN A CG 98 O OD1 . ASN A 19 ? 0.9095 0.6399 0.6982 -0.0316 0.0485 0.0031 95 ASN A OD1 99 N ND2 . ASN A 19 ? 0.9710 0.7158 0.7626 -0.0236 0.0388 0.0087 95 ASN A ND2 100 N N . GLY A 20 ? 0.7885 0.5780 0.6187 -0.0345 0.0250 -0.0119 96 GLY A N 101 C CA . GLY A 20 ? 0.8294 0.6336 0.6692 -0.0370 0.0213 -0.0167 96 GLY A CA 102 C C . GLY A 20 ? 0.8266 0.6389 0.6736 -0.0313 0.0147 -0.0149 96 GLY A C 103 O O . GLY A 20 ? 0.7468 0.5542 0.5918 -0.0260 0.0129 -0.0103 96 GLY A O 104 N N . TRP A 21 ? 0.7953 0.6206 0.6508 -0.0323 0.0114 -0.0184 97 TRP A N 105 C CA . TRP A 21 ? 0.6922 0.5248 0.5546 -0.0279 0.0061 -0.0173 97 TRP A CA 106 C C . TRP A 21 ? 0.7930 0.6367 0.6621 -0.0263 0.0022 -0.0185 97 TRP A C 107 O O . TRP A 21 ? 0.5971 0.4467 0.4680 -0.0296 0.0036 -0.0217 97 TRP A O 108 C CB . TRP A 21 ? 0.6139 0.4499 0.4796 -0.0301 0.0066 -0.0200 97 TRP A CB 109 C CG . TRP A 21 ? 0.5668 0.3902 0.4252 -0.0316 0.0111 -0.0192 97 TRP A CG 110 C CD1 . TRP A 21 ? 0.6489 0.4654 0.5015 -0.0378 0.0171 -0.0222 97 TRP A CD1 111 C CD2 . TRP A 21 ? 0.6410 0.4565 0.4968 -0.0267 0.0108 -0.0150 97 TRP A CD2 112 N NE1 . TRP A 21 ? 0.7597 0.5628 0.6055 -0.0369 0.0208 -0.0202 97 TRP A NE1 113 C CE2 . TRP A 21 ? 0.7663 0.5690 0.6141 -0.0297 0.0170 -0.0156 97 TRP A CE2 114 C CE3 . TRP A 21 ? 0.5788 0.3967 0.4381 -0.0202 0.0061 -0.0109 97 TRP A CE3 115 C CZ2 . TRP A 21 ? 0.6177 0.4099 0.4610 -0.0255 0.0189 -0.0119 97 TRP A CZ2 116 C CZ3 . TRP A 21 ? 0.5850 0.3942 0.4405 -0.0163 0.0075 -0.0071 97 TRP A CZ3 117 C CH2 . TRP A 21 ? 0.7403 0.5367 0.5879 -0.0185 0.0140 -0.0075 97 TRP A CH2 118 N N . VAL A 22 ? 0.7448 0.5909 0.6174 -0.0214 -0.0024 -0.0159 98 VAL A N 119 C CA . VAL A 22 ? 0.6285 0.4819 0.5057 -0.0193 -0.0057 -0.0164 98 VAL A CA 120 C C . VAL A 22 ? 0.6435 0.5032 0.5278 -0.0159 -0.0096 -0.0157 98 VAL A C 121 O O . VAL A 22 ? 0.6745 0.5310 0.5586 -0.0133 -0.0114 -0.0128 98 VAL A O 122 C CB . VAL A 22 ? 0.7564 0.6045 0.6285 -0.0174 -0.0068 -0.0136 98 VAL A CB 123 C CG1 . VAL A 22 ? 0.8777 0.7312 0.7539 -0.0148 -0.0106 -0.0138 98 VAL A CG1 124 C CG2 . VAL A 22 ? 0.8862 0.7302 0.7521 -0.0207 -0.0029 -0.0148 98 VAL A CG2 125 N N . PRO A 23 ? 0.6795 0.5483 0.5700 -0.0156 -0.0107 -0.0180 99 PRO A N 126 C CA . PRO A 23 ? 0.7195 0.5939 0.6163 -0.0121 -0.0139 -0.0171 99 PRO A CA 127 C C . PRO A 23 ? 0.7146 0.5858 0.6115 -0.0087 -0.0171 -0.0142 99 PRO A C 128 O O . PRO A 23 ? 0.7508 0.6199 0.6453 -0.0087 -0.0173 -0.0144 99 PRO A O 129 C CB . PRO A 23 ? 0.6747 0.5589 0.5770 -0.0120 -0.0135 -0.0197 99 PRO A CB 130 C CG . PRO A 23 ? 0.6677 0.5501 0.5665 -0.0142 -0.0111 -0.0214 99 PRO A CG 131 C CD . PRO A 23 ? 0.6856 0.5601 0.5775 -0.0178 -0.0086 -0.0212 99 PRO A CD 132 N N . THR A 24 ? 0.6854 0.5565 0.5847 -0.0062 -0.0194 -0.0119 100 THR A N 133 C CA . THR A 24 ? 0.6483 0.5180 0.5488 -0.0036 -0.0224 -0.0094 100 THR A CA 134 C C . THR A 24 ? 0.6107 0.4858 0.5177 -0.0011 -0.0242 -0.0093 100 THR A C 135 O O . THR A 24 ? 0.7158 0.5900 0.6243 0.0006 -0.0263 -0.0077 100 THR A O 136 C CB . THR A 24 ? 0.6617 0.5266 0.5594 -0.0025 -0.0236 -0.0059 100 THR A CB 137 O OG1 . THR A 24 ? 0.8162 0.6807 0.7143 -0.0023 -0.0223 -0.0054 100 THR A OG1 138 C CG2 . THR A 24 ? 0.5834 0.4427 0.4741 -0.0039 -0.0223 -0.0051 100 THR A CG2 139 N N . TYR A 25 ? 0.6457 0.5268 0.5562 -0.0010 -0.0231 -0.0109 101 TYR A N 140 C CA . TYR A 25 ? 0.6172 0.5041 0.5335 0.0020 -0.0243 -0.0103 101 TYR A CA 141 C C . TYR A 25 ? 0.6477 0.5432 0.5669 0.0015 -0.0229 -0.0124 101 TYR A C 142 O O . TYR A 25 ? 0.7000 0.5967 0.6175 -0.0011 -0.0218 -0.0135 101 TYR A O 143 C CB . TYR A 25 ? 0.7026 0.5883 0.6204 0.0039 -0.0262 -0.0073 101 TYR A CB 144 C CG . TYR A 25 ? 0.8411 0.7322 0.7642 0.0071 -0.0272 -0.0062 101 TYR A CG 145 C CD1 . TYR A 25 ? 0.6998 0.5908 0.6255 0.0095 -0.0276 -0.0055 101 TYR A CD1 146 C CD2 . TYR A 25 ? 0.8937 0.7892 0.8185 0.0079 -0.0274 -0.0055 101 TYR A CD2 147 C CE1 . TYR A 25 ? 0.7149 0.6097 0.6448 0.0129 -0.0280 -0.0038 101 TYR A CE1 148 C CE2 . TYR A 25 ? 0.8993 0.7999 0.8284 0.0112 -0.0282 -0.0039 101 TYR A CE2 149 C CZ . TYR A 25 ? 0.9025 0.8027 0.8343 0.0139 -0.0284 -0.0028 101 TYR A CZ 150 O OH . TYR A 25 ? 0.7445 0.6486 0.6800 0.0177 -0.0287 -0.0006 101 TYR A OH 151 N N . ARG A 26 ? 0.7416 0.6431 0.6649 0.0040 -0.0226 -0.0128 102 ARG A N 152 C CA . ARG A 26 ? 0.8245 0.7372 0.7518 0.0044 -0.0218 -0.0141 102 ARG A CA 153 C C . ARG A 26 ? 0.8939 0.8107 0.8258 0.0094 -0.0232 -0.0115 102 ARG A C 154 O O . ARG A 26 ? 1.3712 1.2857 1.3045 0.0127 -0.0229 -0.0104 102 ARG A O 155 C CB . ARG A 26 ? 0.8404 0.7576 0.7685 0.0037 -0.0196 -0.0165 102 ARG A CB 156 C CG . ARG A 26 ? 0.8309 0.7412 0.7534 -0.0006 -0.0179 -0.0184 102 ARG A CG 157 C CD . ARG A 26 ? 0.9475 0.8607 0.8706 -0.0006 -0.0157 -0.0203 102 ARG A CD 158 N NE . ARG A 26 ? 1.1337 1.0590 1.0603 -0.0022 -0.0140 -0.0224 102 ARG A NE 159 C CZ . ARG A 26 ? 1.2583 1.1904 1.1876 -0.0010 -0.0119 -0.0237 102 ARG A CZ 160 N NH1 . ARG A 26 ? 1.1852 1.1113 1.1133 0.0019 -0.0109 -0.0233 102 ARG A NH1 161 N NH2 . ARG A 26 ? 1.1763 1.1214 1.1094 -0.0028 -0.0105 -0.0255 102 ARG A NH2 162 N N . GLY A 27 ? 0.6794 0.6016 0.6130 0.0100 -0.0243 -0.0106 103 GLY A N 163 C CA . GLY A 27 ? 0.8108 0.7342 0.7475 0.0146 -0.0257 -0.0073 103 GLY A CA 164 C C . GLY A 27 ? 0.9411 0.8704 0.8820 0.0197 -0.0249 -0.0058 103 GLY A C 165 O O . GLY A 27 ? 1.0711 1.0031 1.0129 0.0201 -0.0233 -0.0073 103 GLY A O 166 N N . GLU A 28 ? 0.9443 0.8755 0.8877 0.0240 -0.0257 -0.0025 104 GLU A N 167 C CA . GLU A 28 ? 0.9934 0.9275 0.9400 0.0298 -0.0244 -0.0003 104 GLU A CA 168 C C . GLU A 28 ? 0.7761 0.7250 0.7264 0.0321 -0.0235 -0.0007 104 GLU A C 169 O O . GLU A 28 ? 0.7996 0.7516 0.7526 0.0377 -0.0218 0.0014 104 GLU A O 170 C CB . GLU A 28 ? 1.1750 1.1052 1.1227 0.0339 -0.0248 0.0039 104 GLU A CB 171 C CG . GLU A 28 ? 1.1462 1.0622 1.0917 0.0334 -0.0242 0.0045 104 GLU A CG 172 C CD . GLU A 28 ? 1.2034 1.1129 1.1456 0.0277 -0.0259 0.0026 104 GLU A CD 173 O OE1 . GLU A 28 ? 1.2050 1.1186 1.1467 0.0256 -0.0273 0.0022 104 GLU A OE1 174 O OE2 . GLU A 28 ? 1.1993 1.0999 1.1391 0.0256 -0.0255 0.0015 104 GLU A OE2 175 N N . GLY A 29 ? 0.8091 0.7669 0.7592 0.0277 -0.0243 -0.0035 105 GLY A N 176 C CA . GLY A 29 ? 1.1004 1.0744 1.0543 0.0289 -0.0238 -0.0043 105 GLY A CA 177 C C . GLY A 29 ? 1.2127 1.1899 1.1671 0.0261 -0.0218 -0.0076 105 GLY A C 178 O O . GLY A 29 ? 1.2687 1.2595 1.2252 0.0235 -0.0217 -0.0098 105 GLY A O 179 N N . THR A 30 ? 1.2355 1.2008 1.1876 0.0263 -0.0200 -0.0082 106 THR A N 180 C CA . THR A 30 ? 1.3061 1.2737 1.2582 0.0240 -0.0177 -0.0112 106 THR A CA 181 C C . THR A 30 ? 1.3406 1.3194 1.2979 0.0303 -0.0156 -0.0095 106 THR A C 182 O O . THR A 30 ? 1.2564 1.2437 1.2157 0.0290 -0.0137 -0.0117 106 THR A O 183 C CB . THR A 30 ? 1.2140 1.1652 1.1610 0.0219 -0.0164 -0.0125 106 THR A CB 184 O OG1 . THR A 30 ? 1.2769 1.2170 1.2225 0.0253 -0.0171 -0.0098 106 THR A OG1 185 C CG2 . THR A 30 ? 1.1309 1.0761 1.0731 0.0146 -0.0173 -0.0152 106 THR A CG2 186 N N . THR A 31 ? 1.4147 1.3935 1.3743 0.0374 -0.0156 -0.0054 107 THR A N 187 C CA . THR A 31 ? 1.3322 1.3209 1.2967 0.0452 -0.0133 -0.0025 107 THR A CA 188 C C . THR A 31 ? 1.3246 1.3351 1.2942 0.0463 -0.0150 -0.0015 107 THR A C 189 O O . THR A 31 ? 1.3372 1.3603 1.3118 0.0532 -0.0135 0.0014 107 THR A O 190 C CB . THR A 31 ? 1.4749 1.4529 1.4387 0.0525 -0.0120 0.0019 107 THR A CB 191 O OG1 . THR A 31 ? 1.4882 1.4792 1.4564 0.0592 -0.0125 0.0064 107 THR A OG1 192 C CG2 . THR A 31 ? 1.4052 1.3678 1.3643 0.0486 -0.0141 0.0018 107 THR A CG2 193 N N . GLY A 32 ? 1.2180 1.2332 1.1863 0.0394 -0.0179 -0.0041 108 GLY A N 194 C CA . GLY A 32 ? 1.0995 1.1348 1.0716 0.0391 -0.0200 -0.0037 108 GLY A CA 195 C C . GLY A 32 ? 1.1745 1.2100 1.1459 0.0423 -0.0225 -0.0001 108 GLY A C 196 O O . GLY A 32 ? 1.2019 1.2488 1.1734 0.0387 -0.0250 -0.0012 108 GLY A O 197 N N . LYS A 33 ? 1.1405 1.1632 1.1108 0.0485 -0.0216 0.0040 109 LYS A N 198 C CA . LYS A 33 ? 1.0127 1.0352 0.9824 0.0525 -0.0234 0.0081 109 LYS A CA 199 C C . LYS A 33 ? 0.9625 0.9642 0.9280 0.0526 -0.0231 0.0095 109 LYS A C 200 O O . LYS A 33 ? 1.0637 1.0516 1.0277 0.0536 -0.0207 0.0094 109 LYS A O 201 C CB . LYS A 33 ? 0.9383 0.9725 0.9124 0.0626 -0.0222 0.0138 109 LYS A CB 202 C CG . LYS A 33 ? 1.1169 1.1727 1.0938 0.0635 -0.0249 0.0152 109 LYS A CG 203 C CD . LYS A 33 ? 1.2962 1.3722 1.2790 0.0679 -0.0239 0.0163 109 LYS A CD 204 C CE . LYS A 33 ? 1.4012 1.5012 1.3867 0.0680 -0.0271 0.0174 109 LYS A CE 205 N NZ . LYS A 33 ? 1.4376 1.5601 1.4293 0.0695 -0.0267 0.0170 109 LYS A NZ 206 N N . ILE A 34 ? 0.9015 0.9020 0.8651 0.0514 -0.0253 0.0107 110 ILE A N 207 C CA . ILE A 34 ? 0.9433 0.9265 0.9036 0.0512 -0.0252 0.0123 110 ILE A CA 208 C C . ILE A 34 ? 0.8685 0.8486 0.8299 0.0595 -0.0236 0.0182 110 ILE A C 209 O O . ILE A 34 ? 1.0169 1.0094 0.9804 0.0645 -0.0242 0.0217 110 ILE A O 210 C CB . ILE A 34 ? 0.8859 0.8681 0.8432 0.0457 -0.0278 0.0107 110 ILE A CB 211 C CG1 . ILE A 34 ? 0.9126 0.8973 0.8681 0.0378 -0.0286 0.0051 110 ILE A CG1 212 C CG2 . ILE A 34 ? 0.7457 0.7112 0.7002 0.0451 -0.0277 0.0122 110 ILE A CG2 213 C CD1 . ILE A 34 ? 0.8440 0.8200 0.7952 0.0324 -0.0297 0.0032 110 ILE A CD1 214 N N . PRO A 35 ? 0.8550 0.8185 0.8146 0.0608 -0.0214 0.0193 111 PRO A N 215 C CA . PRO A 35 ? 0.8615 0.8180 0.8212 0.0677 -0.0190 0.0247 111 PRO A CA 216 C C . PRO A 35 ? 0.9884 0.9475 0.9474 0.0689 -0.0208 0.0281 111 PRO A C 217 O O . PRO A 35 ? 0.9870 0.9435 0.9442 0.0632 -0.0232 0.0260 111 PRO A O 218 C CB . PRO A 35 ? 0.7636 0.7007 0.7202 0.0646 -0.0171 0.0231 111 PRO A CB 219 C CG . PRO A 35 ? 0.7677 0.7041 0.7235 0.0592 -0.0176 0.0178 111 PRO A CG 220 C CD . PRO A 35 ? 0.7904 0.7408 0.7474 0.0552 -0.0208 0.0153 111 PRO A CD 221 N N . ASP A 36 ? 0.9817 0.9458 0.9420 0.0767 -0.0193 0.0337 112 ASP A N 222 C CA . ASP A 36 ? 0.9688 0.9380 0.9283 0.0783 -0.0210 0.0372 112 ASP A CA 223 C C . ASP A 36 ? 0.9433 0.8966 0.9001 0.0766 -0.0201 0.0388 112 ASP A C 224 O O . ASP A 36 ? 0.9623 0.9186 0.9181 0.0767 -0.0215 0.0411 112 ASP A O 225 C CB . ASP A 36 ? 1.0801 1.0617 1.0415 0.0876 -0.0199 0.0431 112 ASP A CB 226 C CG . ASP A 36 ? 1.3275 1.3311 1.2917 0.0877 -0.0225 0.0416 112 ASP A CG 227 O OD1 . ASP A 36 ? 1.3985 1.4133 1.3619 0.0840 -0.0259 0.0401 112 ASP A OD1 228 O OD2 . ASP A 36 ? 1.3097 1.3196 1.2769 0.0914 -0.0208 0.0417 112 ASP A OD2 229 N N . GLU A 37 ? 0.9531 0.8904 0.9088 0.0744 -0.0178 0.0374 113 GLU A N 230 C CA . GLU A 37 ? 0.9870 0.9102 0.9407 0.0720 -0.0169 0.0387 113 GLU A CA 231 C C . GLU A 37 ? 0.9213 0.8439 0.8741 0.0641 -0.0203 0.0347 113 GLU A C 232 O O . GLU A 37 ? 0.9870 0.9026 0.9389 0.0618 -0.0204 0.0359 113 GLU A O 233 C CB . GLU A 37 ? 1.0365 0.9436 0.9889 0.0718 -0.0131 0.0382 113 GLU A CB 234 C CG . GLU A 37 ? 1.1823 1.0890 1.1352 0.0795 -0.0090 0.0409 113 GLU A CG 235 C CD . GLU A 37 ? 1.3485 1.2611 1.3026 0.0787 -0.0093 0.0368 113 GLU A CD 236 O OE1 . GLU A 37 ? 1.2068 1.1115 1.1594 0.0724 -0.0098 0.0319 113 GLU A OE1 237 O OE2 . GLU A 37 ? 1.3984 1.3243 1.3550 0.0843 -0.0091 0.0386 113 GLU A OE2 238 N N . GLN A 38 ? 0.8441 0.7744 0.7973 0.0603 -0.0226 0.0303 114 GLN A N 239 C CA . GLN A 38 ? 0.7594 0.6892 0.7112 0.0536 -0.0253 0.0267 114 GLN A CA 240 C C . GLN A 38 ? 0.8865 0.8255 0.8377 0.0534 -0.0273 0.0276 114 GLN A C 241 O O . GLN A 38 ? 0.8643 0.8155 0.8162 0.0569 -0.0278 0.0291 114 GLN A O 242 C CB . GLN A 38 ? 0.7620 0.6948 0.7135 0.0494 -0.0263 0.0216 114 GLN A CB 243 C CG . GLN A 38 ? 0.9459 0.8673 0.8966 0.0471 -0.0249 0.0195 114 GLN A CG 244 C CD . GLN A 38 ? 0.9381 0.8630 0.8884 0.0441 -0.0252 0.0152 114 GLN A CD 245 O OE1 . GLN A 38 ? 1.0702 0.9914 1.0206 0.0453 -0.0232 0.0142 114 GLN A OE1 246 N NE2 . GLN A 38 ? 0.8383 0.7698 0.7877 0.0401 -0.0271 0.0125 114 GLN A NE2 247 N N . MET A 39 ? 0.6548 0.5884 0.6045 0.0494 -0.0283 0.0268 115 MET A N 248 C CA . MET A 39 ? 0.6841 0.6243 0.6323 0.0485 -0.0297 0.0270 115 MET A CA 249 C C . MET A 39 ? 0.7797 0.7302 0.7266 0.0455 -0.0312 0.0229 115 MET A C 250 O O . MET A 39 ? 0.8469 0.7958 0.7934 0.0417 -0.0314 0.0189 115 MET A O 251 C CB . MET A 39 ? 0.6763 0.6080 0.6232 0.0448 -0.0299 0.0266 115 MET A CB 252 C CG . MET A 39 ? 0.8011 0.7262 0.7491 0.0471 -0.0286 0.0311 115 MET A CG 253 S SD . MET A 39 ? 1.1867 1.1108 1.1333 0.0450 -0.0290 0.0319 115 MET A SD 254 C CE . MET A 39 ? 1.2779 1.2095 1.2236 0.0503 -0.0282 0.0365 115 MET A CE 255 N N . LEU A 40 ? 0.8510 0.8122 0.7968 0.0469 -0.0321 0.0237 116 LEU A N 256 C CA . LEU A 40 ? 0.8430 0.8134 0.7866 0.0425 -0.0334 0.0192 116 LEU A CA 257 C C . LEU A 40 ? 0.8261 0.7875 0.7663 0.0371 -0.0332 0.0161 116 LEU A C 258 O O . LEU A 40 ? 0.9711 0.9286 0.9097 0.0375 -0.0328 0.0179 116 LEU A O 259 C CB . LEU A 40 ? 0.8431 0.8273 0.7856 0.0450 -0.0344 0.0208 116 LEU A CB 260 C CG . LEU A 40 ? 0.8326 0.8312 0.7780 0.0493 -0.0350 0.0225 116 LEU A CG 261 C CD1 . LEU A 40 ? 0.8023 0.7962 0.7513 0.0513 -0.0338 0.0229 116 LEU A CD1 262 C CD2 . LEU A 40 ? 0.8376 0.8431 0.7832 0.0563 -0.0351 0.0286 116 LEU A CD2 263 N N . THR A 41 ? 0.7816 0.7399 0.7209 0.0324 -0.0330 0.0118 117 THR A N 264 C CA . THR A 41 ? 0.6722 0.6200 0.6085 0.0283 -0.0322 0.0096 117 THR A CA 265 C C . THR A 41 ? 0.6774 0.6288 0.6093 0.0232 -0.0317 0.0050 117 THR A C 266 O O . THR A 41 ? 0.6507 0.6120 0.5823 0.0211 -0.0322 0.0021 117 THR A O 267 C CB . THR A 41 ? 0.6526 0.5924 0.5902 0.0266 -0.0318 0.0084 117 THR A CB 268 O OG1 . THR A 41 ? 0.8723 0.8055 0.8062 0.0220 -0.0310 0.0053 117 THR A OG1 269 C CG2 . THR A 41 ? 0.7445 0.6916 0.6841 0.0267 -0.0320 0.0066 117 THR A CG2 270 N N . ARG A 42 ? 0.7031 0.6465 0.6313 0.0212 -0.0305 0.0043 118 ARG A N 271 C CA . ARG A 42 ? 0.7691 0.7142 0.6919 0.0167 -0.0292 0.0001 118 ARG A CA 272 C C . ARG A 42 ? 0.7825 0.7144 0.7014 0.0146 -0.0269 -0.0009 118 ARG A C 273 O O . ARG A 42 ? 0.7693 0.6940 0.6900 0.0177 -0.0268 0.0028 118 ARG A O 274 C CB . ARG A 42 ? 0.8173 0.7703 0.7387 0.0189 -0.0298 0.0016 118 ARG A CB 275 C CG . ARG A 42 ? 0.9817 0.9405 0.8974 0.0141 -0.0289 -0.0031 118 ARG A CG 276 C CD . ARG A 42 ? 1.1164 1.0862 1.0313 0.0168 -0.0302 -0.0012 118 ARG A CD 277 N NE . ARG A 42 ? 1.3959 1.3818 1.3133 0.0172 -0.0325 -0.0016 118 ARG A NE 278 C CZ . ARG A 42 ? 1.5957 1.5925 1.5152 0.0222 -0.0343 0.0025 118 ARG A CZ 279 N NH1 . ARG A 42 ? 1.6441 1.6367 1.5633 0.0268 -0.0339 0.0071 118 ARG A NH1 280 N NH2 . ARG A 42 ? 1.6083 1.6208 1.5304 0.0230 -0.0363 0.0024 118 ARG A NH2 281 N N . GLN A 43 ? 0.6002 0.5292 0.5138 0.0094 -0.0248 -0.0056 119 GLN A N 282 C CA . GLN A 43 ? 0.5683 0.4839 0.4775 0.0079 -0.0218 -0.0063 119 GLN A CA 283 C C . GLN A 43 ? 0.6769 0.5853 0.5893 0.0100 -0.0225 -0.0034 119 GLN A C 284 O O . GLN A 43 ? 0.5653 0.4661 0.4776 0.0126 -0.0216 -0.0004 119 GLN A O 285 C CB . GLN A 43 ? 0.6908 0.6019 0.5971 0.0102 -0.0201 -0.0045 119 GLN A CB 286 C CG . GLN A 43 ? 0.9314 0.8306 0.8304 0.0074 -0.0157 -0.0071 119 GLN A CG 287 C CD . GLN A 43 ? 0.9576 0.8479 0.8566 0.0119 -0.0140 -0.0028 119 GLN A CD 288 O OE1 . GLN A 43 ? 0.9949 0.8806 0.8893 0.0124 -0.0110 -0.0033 119 GLN A OE1 289 N NE2 . GLN A 43 ? 0.7840 0.6724 0.6883 0.0151 -0.0158 0.0012 119 GLN A NE2 290 N N . ASN A 44 ? 0.6514 0.5631 0.5666 0.0088 -0.0238 -0.0044 120 ASN A N 291 C CA . ASN A 44 ? 0.6092 0.5146 0.5265 0.0100 -0.0244 -0.0024 120 ASN A CA 292 C C . ASN A 44 ? 0.6902 0.5847 0.6026 0.0079 -0.0218 -0.0034 120 ASN A C 293 O O . ASN A 44 ? 0.7807 0.6723 0.6880 0.0037 -0.0191 -0.0072 120 ASN A O 294 C CB . ASN A 44 ? 0.6658 0.5772 0.5862 0.0091 -0.0258 -0.0038 120 ASN A CB 295 C CG . ASN A 44 ? 0.6472 0.5663 0.5731 0.0132 -0.0281 -0.0011 120 ASN A CG 296 O OD1 . ASN A 44 ? 0.6684 0.5839 0.5972 0.0163 -0.0292 0.0023 120 ASN A OD1 297 N ND2 . ASN A 44 ? 0.5735 0.5033 0.5005 0.0131 -0.0288 -0.0024 120 ASN A ND2 298 N N . PHE A 45 ? 0.6543 0.5428 0.5679 0.0106 -0.0222 0.0002 121 PHE A N 299 C CA . PHE A 45 ? 0.5745 0.4537 0.4840 0.0096 -0.0202 0.0002 121 PHE A CA 300 C C . PHE A 45 ? 0.6607 0.5384 0.5736 0.0122 -0.0224 0.0039 121 PHE A C 301 O O . PHE A 45 ? 0.6124 0.4948 0.5304 0.0146 -0.0250 0.0063 121 PHE A O 302 C CB . PHE A 45 ? 0.6088 0.4805 0.5133 0.0103 -0.0167 0.0008 121 PHE A CB 303 C CG . PHE A 45 ? 0.6732 0.5449 0.5806 0.0150 -0.0175 0.0053 121 PHE A CG 304 C CD1 . PHE A 45 ? 0.5542 0.4319 0.4642 0.0166 -0.0184 0.0060 121 PHE A CD1 305 C CD2 . PHE A 45 ? 0.6378 0.5047 0.5455 0.0180 -0.0172 0.0092 121 PHE A CD2 306 C CE1 . PHE A 45 ? 0.6508 0.5289 0.5637 0.0207 -0.0188 0.0103 121 PHE A CE1 307 C CE2 . PHE A 45 ? 0.5825 0.4510 0.4936 0.0221 -0.0179 0.0135 121 PHE A CE2 308 C CZ . PHE A 45 ? 0.7077 0.5814 0.6214 0.0233 -0.0185 0.0140 121 PHE A CZ 309 N N . VAL A 46 ? 0.7142 0.5853 0.6237 0.0114 -0.0211 0.0043 122 VAL A N 310 C CA . VAL A 46 ? 0.6114 0.4820 0.5231 0.0131 -0.0234 0.0073 122 VAL A CA 311 C C . VAL A 46 ? 0.6826 0.5477 0.5919 0.0159 -0.0220 0.0110 122 VAL A C 312 O O . VAL A 46 ? 0.7118 0.5701 0.6156 0.0158 -0.0183 0.0105 122 VAL A O 313 C CB . VAL A 46 ? 0.5899 0.4589 0.4995 0.0104 -0.0234 0.0052 122 VAL A CB 314 C CG1 . VAL A 46 ? 0.5610 0.4297 0.4719 0.0117 -0.0258 0.0080 122 VAL A CG1 315 C CG2 . VAL A 46 ? 0.4878 0.3629 0.4001 0.0083 -0.0244 0.0019 122 VAL A CG2 316 N N . SER A 47 ? 0.5034 0.3718 0.4168 0.0185 -0.0245 0.0148 123 SER A N 317 C CA . SER A 47 ? 0.6424 0.5082 0.5546 0.0217 -0.0238 0.0190 123 SER A CA 318 C C . SER A 47 ? 0.6520 0.5223 0.5674 0.0218 -0.0274 0.0214 123 SER A C 319 O O . SER A 47 ? 0.7433 0.6186 0.6631 0.0203 -0.0303 0.0205 123 SER A O 320 C CB . SER A 47 ? 0.6688 0.5357 0.5829 0.0251 -0.0225 0.0217 123 SER A CB 321 O OG . SER A 47 ? 0.7551 0.6175 0.6661 0.0286 -0.0200 0.0253 123 SER A OG 322 N N . CYS A 48 ? 0.7194 0.5879 0.6321 0.0237 -0.0271 0.0245 124 CYS A N 323 C CA . CYS A 48 ? 0.7527 0.6263 0.6674 0.0230 -0.0307 0.0262 124 CYS A CA 324 C C . CYS A 48 ? 0.8510 0.7302 0.7689 0.0265 -0.0320 0.0315 124 CYS A C 325 O O . CYS A 48 ? 0.8295 0.7063 0.7455 0.0306 -0.0293 0.0347 124 CYS A O 326 C CB . CYS A 48 ? 0.6332 0.5024 0.5420 0.0214 -0.0302 0.0252 124 CYS A CB 327 S SG . CYS A 48 ? 0.8595 0.7231 0.7647 0.0172 -0.0280 0.0192 124 CYS A SG 328 N N . SER A 49 ? 0.7796 0.6665 0.7023 0.0248 -0.0358 0.0322 125 SER A N 329 C CA . SER A 49 ? 0.7545 0.6496 0.6809 0.0271 -0.0378 0.0371 125 SER A CA 330 C C . SER A 49 ? 0.9139 0.8119 0.8372 0.0263 -0.0400 0.0385 125 SER A C 331 O O . SER A 49 ? 1.0263 0.9185 0.9440 0.0247 -0.0393 0.0361 125 SER A O 332 C CB . SER A 49 ? 0.7679 0.6706 0.7014 0.0248 -0.0405 0.0370 125 SER A CB 333 O OG . SER A 49 ? 0.8133 0.7159 0.7469 0.0198 -0.0429 0.0331 125 SER A OG 334 N N . ASP A 50 ? 1.1747 1.0828 1.1019 0.0273 -0.0428 0.0423 126 ASP A N 335 C CA . ASP A 50 ? 1.3480 1.2620 1.2729 0.0264 -0.0457 0.0441 126 ASP A CA 336 C C . ASP A 50 ? 1.2147 1.1303 1.1393 0.0197 -0.0489 0.0395 126 ASP A C 337 O O . ASP A 50 ? 1.2148 1.1363 1.1373 0.0179 -0.0518 0.0403 126 ASP A O 338 C CB . ASP A 50 ? 1.4670 1.3938 1.3970 0.0294 -0.0478 0.0498 126 ASP A CB 339 C CG . ASP A 50 ? 1.5014 1.4355 1.4396 0.0269 -0.0494 0.0494 126 ASP A CG 340 O OD1 . ASP A 50 ? 1.4175 1.3458 1.3572 0.0238 -0.0485 0.0452 126 ASP A OD1 341 O OD2 . ASP A 50 ? 1.5119 1.4582 1.4553 0.0283 -0.0514 0.0535 126 ASP A OD2 342 N N . LYS A 51 ? 1.1544 1.0647 1.0805 0.0164 -0.0482 0.0348 127 LYS A N 343 C CA . LYS A 51 ? 0.9582 0.8691 0.8844 0.0105 -0.0505 0.0305 127 LYS A CA 344 C C . LYS A 51 ? 0.8631 0.7645 0.7874 0.0088 -0.0483 0.0256 127 LYS A C 345 O O . LYS A 51 ? 0.7246 0.6238 0.6468 0.0048 -0.0491 0.0218 127 LYS A O 346 C CB . LYS A 51 ? 0.8876 0.8062 0.8205 0.0078 -0.0527 0.0310 127 LYS A CB 347 C CG . LYS A 51 ? 1.0809 0.9946 1.0175 0.0069 -0.0508 0.0286 127 LYS A CG 348 C CD . LYS A 51 ? 1.2105 1.1310 1.1532 0.0037 -0.0525 0.0293 127 LYS A CD 349 C CE . LYS A 51 ? 1.0069 0.9210 0.9518 0.0023 -0.0505 0.0266 127 LYS A CE 350 N NZ . LYS A 51 ? 1.0472 0.9644 0.9953 -0.0033 -0.0518 0.0254 127 LYS A NZ 351 N N . GLU A 52 ? 0.8058 0.7023 0.7306 0.0118 -0.0454 0.0255 128 GLU A N 352 C CA . GLU A 52 ? 0.8570 0.7471 0.7807 0.0104 -0.0435 0.0213 128 GLU A CA 353 C C . GLU A 52 ? 0.8690 0.7544 0.7912 0.0134 -0.0402 0.0213 128 GLU A C 354 O O . GLU A 52 ? 0.8677 0.7533 0.7897 0.0167 -0.0390 0.0245 128 GLU A O 355 C CB . GLU A 52 ? 0.7906 0.6819 0.7193 0.0085 -0.0441 0.0198 128 GLU A CB 356 C CG . GLU A 52 ? 0.8695 0.7642 0.8034 0.0111 -0.0436 0.0228 128 GLU A CG 357 C CD . GLU A 52 ? 1.0183 0.9136 0.9566 0.0093 -0.0438 0.0219 128 GLU A CD 358 O OE1 . GLU A 52 ? 1.0169 0.9093 0.9541 0.0062 -0.0441 0.0189 128 GLU A OE1 359 O OE2 . GLU A 52 ? 1.0606 0.9587 1.0030 0.0111 -0.0433 0.0244 128 GLU A OE2 360 N N . CYS A 53 ? 0.6930 0.5743 0.6137 0.0121 -0.0387 0.0175 129 CYS A N 361 C CA . CYS A 53 ? 0.6655 0.5437 0.5853 0.0136 -0.0358 0.0165 129 CYS A CA 362 C C . CYS A 53 ? 0.7830 0.6635 0.7075 0.0138 -0.0359 0.0154 129 CYS A C 363 O O . CYS A 53 ? 0.6563 0.5378 0.5828 0.0122 -0.0369 0.0137 129 CYS A O 364 C CB . CYS A 53 ? 0.6609 0.5345 0.5756 0.0119 -0.0338 0.0134 129 CYS A CB 365 S SG . CYS A 53 ? 0.9828 0.8515 0.8909 0.0131 -0.0319 0.0158 129 CYS A SG 366 N N . ARG A 54 ? 0.6575 0.5384 0.5831 0.0160 -0.0344 0.0166 130 ARG A N 367 C CA . ARG A 54 ? 0.6008 0.4844 0.5302 0.0167 -0.0344 0.0161 130 ARG A CA 368 C C . ARG A 54 ? 0.6515 0.5345 0.5789 0.0168 -0.0322 0.0136 130 ARG A C 369 O O . ARG A 54 ? 0.6312 0.5110 0.5546 0.0168 -0.0302 0.0131 130 ARG A O 370 C CB . ARG A 54 ? 0.7359 0.6226 0.6692 0.0188 -0.0349 0.0197 130 ARG A CB 371 C CG . ARG A 54 ? 0.5384 0.4279 0.4747 0.0179 -0.0371 0.0221 130 ARG A CG 372 C CD . ARG A 54 ? 0.5282 0.4214 0.4696 0.0191 -0.0374 0.0246 130 ARG A CD 373 N NE . ARG A 54 ? 0.7029 0.5970 0.6471 0.0164 -0.0389 0.0241 130 ARG A NE 374 C CZ . ARG A 54 ? 0.7597 0.6528 0.7060 0.0163 -0.0382 0.0235 130 ARG A CZ 375 N NH1 . ARG A 54 ? 0.6423 0.5354 0.5885 0.0189 -0.0366 0.0236 130 ARG A NH1 376 N NH2 . ARG A 54 ? 1.1266 1.0187 1.0745 0.0137 -0.0388 0.0230 130 ARG A NH2 377 N N . ARG A 55 ? 0.5811 0.4672 0.5110 0.0169 -0.0325 0.0123 131 ARG A N 378 C CA . ARG A 55 ? 0.6746 0.5632 0.6037 0.0171 -0.0311 0.0103 131 ARG A CA 379 C C . ARG A 55 ? 0.6906 0.5819 0.6218 0.0195 -0.0309 0.0127 131 ARG A C 380 O O . ARG A 55 ? 0.7852 0.6788 0.7202 0.0210 -0.0320 0.0148 131 ARG A O 381 C CB . ARG A 55 ? 0.6597 0.5519 0.5906 0.0168 -0.0315 0.0083 131 ARG A CB 382 C CG . ARG A 55 ? 0.6201 0.5160 0.5491 0.0154 -0.0302 0.0051 131 ARG A CG 383 C CD . ARG A 55 ? 0.6793 0.5825 0.6113 0.0175 -0.0306 0.0053 131 ARG A CD 384 N NE . ARG A 55 ? 0.7883 0.6946 0.7224 0.0180 -0.0308 0.0042 131 ARG A NE 385 C CZ . ARG A 55 ? 0.8176 0.7319 0.7532 0.0189 -0.0305 0.0031 131 ARG A CZ 386 N NH1 . ARG A 55 ? 0.6204 0.5410 0.5553 0.0188 -0.0304 0.0025 131 ARG A NH1 387 N NH2 . ARG A 55 ? 0.9257 0.8424 0.8633 0.0202 -0.0302 0.0026 131 ARG A NH2 388 N N . PHE A 56 ? 0.7599 0.6500 0.6881 0.0197 -0.0291 0.0123 132 PHE A N 389 C CA . PHE A 56 ? 0.6853 0.5781 0.6145 0.0218 -0.0285 0.0140 132 PHE A CA 390 C C . PHE A 56 ? 0.7500 0.6472 0.6774 0.0209 -0.0277 0.0111 132 PHE A C 391 O O . PHE A 56 ? 0.7629 0.6596 0.6868 0.0180 -0.0267 0.0075 132 PHE A O 392 C CB . PHE A 56 ? 0.5500 0.4385 0.4765 0.0229 -0.0264 0.0154 132 PHE A CB 393 C CG . PHE A 56 ? 0.5934 0.4805 0.5225 0.0246 -0.0273 0.0191 132 PHE A CG 394 C CD1 . PHE A 56 ? 0.6594 0.5435 0.5873 0.0234 -0.0280 0.0191 132 PHE A CD1 395 C CD2 . PHE A 56 ? 0.5820 0.4718 0.5146 0.0271 -0.0274 0.0227 132 PHE A CD2 396 C CE1 . PHE A 56 ? 0.7448 0.6297 0.6752 0.0248 -0.0292 0.0227 132 PHE A CE1 397 C CE2 . PHE A 56 ? 0.5325 0.4231 0.4682 0.0282 -0.0284 0.0262 132 PHE A CE2 398 C CZ . PHE A 56 ? 0.7273 0.6160 0.6619 0.0270 -0.0295 0.0261 132 PHE A CZ 399 N N . PHE A 57 ? 0.7254 0.6275 0.6548 0.0230 -0.0282 0.0127 133 PHE A N 400 C CA . PHE A 57 ? 0.7156 0.6241 0.6434 0.0225 -0.0279 0.0105 133 PHE A CA 401 C C . PHE A 57 ? 0.7765 0.6885 0.7054 0.0255 -0.0278 0.0135 133 PHE A C 402 O O . PHE A 57 ? 0.6616 0.5714 0.5934 0.0279 -0.0279 0.0172 133 PHE A O 403 C CB . PHE A 57 ? 0.5354 0.4497 0.4657 0.0225 -0.0294 0.0095 133 PHE A CB 404 C CG . PHE A 57 ? 0.7540 0.6685 0.6891 0.0256 -0.0306 0.0131 133 PHE A CG 405 C CD1 . PHE A 57 ? 0.5884 0.4974 0.5252 0.0251 -0.0312 0.0137 133 PHE A CD1 406 C CD2 . PHE A 57 ? 0.6518 0.5713 0.5890 0.0290 -0.0309 0.0160 133 PHE A CD2 407 C CE1 . PHE A 57 ? 0.5973 0.5050 0.5376 0.0271 -0.0317 0.0165 133 PHE A CE1 408 C CE2 . PHE A 57 ? 0.6823 0.6000 0.6231 0.0316 -0.0312 0.0193 133 PHE A CE2 409 C CZ . PHE A 57 ? 0.7046 0.6160 0.6470 0.0304 -0.0315 0.0193 133 PHE A CZ 410 N N . VAL A 58 ? 0.8056 0.7240 0.7320 0.0251 -0.0275 0.0117 134 VAL A N 411 C CA . VAL A 58 ? 0.6957 0.6186 0.6223 0.0279 -0.0274 0.0142 134 VAL A CA 412 C C . VAL A 58 ? 0.6791 0.6110 0.6083 0.0300 -0.0291 0.0154 134 VAL A C 413 O O . VAL A 58 ? 0.6189 0.5559 0.5482 0.0283 -0.0300 0.0126 134 VAL A O 414 C CB . VAL A 58 ? 0.6975 0.6207 0.6180 0.0259 -0.0254 0.0114 134 VAL A CB 415 C CG1 . VAL A 58 ? 0.7583 0.6883 0.6781 0.0284 -0.0255 0.0134 134 VAL A CG1 416 C CG2 . VAL A 58 ? 0.6641 0.5774 0.5823 0.0255 -0.0230 0.0116 134 VAL A CG2 417 N N . SER A 59 ? 0.7035 0.6377 0.6351 0.0339 -0.0293 0.0198 135 SER A N 418 C CA . SER A 59 ? 0.7967 0.7394 0.7301 0.0371 -0.0304 0.0217 135 SER A CA 419 C C . SER A 59 ? 0.9030 0.8493 0.8362 0.0411 -0.0300 0.0261 135 SER A C 420 O O . SER A 59 ? 0.8481 0.7890 0.7811 0.0416 -0.0287 0.0283 135 SER A O 421 C CB . SER A 59 ? 0.8728 0.8124 0.8106 0.0387 -0.0309 0.0234 135 SER A CB 422 O OG . SER A 59 ? 1.1285 1.0762 1.0677 0.0422 -0.0315 0.0252 135 SER A OG 423 N N . MET A 60 ? 0.9858 0.9419 0.9189 0.0440 -0.0308 0.0276 136 MET A N 424 C CA . MET A 60 ? 0.9842 0.9433 0.9175 0.0489 -0.0302 0.0330 136 MET A CA 425 C C . MET A 60 ? 1.2258 1.1824 1.1633 0.0533 -0.0297 0.0373 136 MET A C 426 O O . MET A 60 ? 1.4092 1.3575 1.3486 0.0547 -0.0282 0.0409 136 MET A O 427 C CB . MET A 60 ? 0.7752 0.7474 0.7048 0.0501 -0.0312 0.0327 136 MET A CB 428 C CG . MET A 60 ? 0.8308 0.8053 0.7549 0.0457 -0.0310 0.0283 136 MET A CG 429 S SD . MET A 60 ? 0.9815 0.9736 0.9014 0.0474 -0.0325 0.0286 136 MET A SD 430 C CE . MET A 60 ? 1.3853 1.3804 1.2991 0.0394 -0.0326 0.0201 136 MET A CE 431 N N . GLY A 61 ? 1.2533 1.2169 1.1921 0.0551 -0.0307 0.0369 137 GLY A N 432 C CA . GLY A 61 ? 1.3621 1.3227 1.3041 0.0597 -0.0295 0.0407 137 GLY A CA 433 C C . GLY A 61 ? 1.3401 1.3015 1.2846 0.0593 -0.0299 0.0382 137 GLY A C 434 O O . GLY A 61 ? 1.2045 1.1623 1.1491 0.0543 -0.0306 0.0335 137 GLY A O 435 N N . TYR A 62 ? 1.3760 1.3420 1.3222 0.0652 -0.0290 0.0418 138 TYR A N 436 C CA . TYR A 62 ? 1.4221 1.3864 1.3708 0.0663 -0.0282 0.0407 138 TYR A CA 437 C C . TYR A 62 ? 1.3695 1.3498 1.3194 0.0700 -0.0292 0.0411 138 TYR A C 438 O O . TYR A 62 ? 1.2276 1.2087 1.1799 0.0729 -0.0281 0.0414 138 TYR A O 439 C CB . TYR A 62 ? 1.4247 1.3766 1.3746 0.0705 -0.0250 0.0451 138 TYR A CB 440 C CG . TYR A 62 ? 1.5405 1.4778 1.4900 0.0663 -0.0240 0.0446 138 TYR A CG 441 C CD1 . TYR A 62 ? 1.6485 1.5834 1.5968 0.0661 -0.0237 0.0473 138 TYR A CD1 442 C CD2 . TYR A 62 ? 1.6409 1.5682 1.5913 0.0624 -0.0235 0.0414 138 TYR A CD2 443 C CE1 . TYR A 62 ? 1.7563 1.6800 1.7050 0.0621 -0.0228 0.0469 138 TYR A CE1 444 C CE2 . TYR A 62 ? 1.7656 1.6819 1.7159 0.0582 -0.0230 0.0409 138 TYR A CE2 445 C CZ . TYR A 62 ? 1.8369 1.7519 1.7867 0.0581 -0.0227 0.0437 138 TYR A CZ 446 O OH . TYR A 62 ? 1.8481 1.7543 1.7986 0.0539 -0.0222 0.0434 138 TYR A OH 447 N N . VAL A 73 ? 1.1945 1.1681 1.0798 0.0139 -0.0233 -0.0055 149 VAL A N 448 C CA . VAL A 73 ? 1.2671 1.2312 1.1511 0.0179 -0.0207 -0.0019 149 VAL A CA 449 C C . VAL A 73 ? 1.2782 1.2509 1.1648 0.0242 -0.0226 0.0045 149 VAL A C 450 O O . VAL A 73 ? 1.3293 1.3131 1.2115 0.0238 -0.0236 0.0038 149 VAL A O 451 C CB . VAL A 73 ? 1.4311 1.3879 1.3052 0.0136 -0.0165 -0.0071 149 VAL A CB 452 C CG1 . VAL A 73 ? 1.3757 1.3243 1.2489 0.0184 -0.0136 -0.0030 149 VAL A CG1 453 C CG2 . VAL A 73 ? 1.3907 1.3359 1.2618 0.0081 -0.0136 -0.0125 149 VAL A CG2 454 N N . SER A 74 ? 1.0851 1.0526 0.9785 0.0296 -0.0229 0.0106 150 SER A N 455 C CA . SER A 74 ? 0.8657 0.8387 0.7618 0.0355 -0.0238 0.0171 150 SER A CA 456 C C . SER A 74 ? 0.7668 0.7290 0.6664 0.0392 -0.0216 0.0219 150 SER A C 457 O O . SER A 74 ? 0.8529 0.8058 0.7562 0.0385 -0.0208 0.0217 150 SER A O 458 C CB . SER A 74 ? 0.9048 0.8865 0.8068 0.0386 -0.0271 0.0205 150 SER A CB 459 O OG . SER A 74 ? 0.8342 0.8124 0.7413 0.0444 -0.0268 0.0274 150 SER A OG 460 N N . GLU A 75 ? 0.8946 0.8594 0.7932 0.0430 -0.0206 0.0263 151 GLU A N 461 C CA . GLU A 75 ? 0.7278 0.6847 0.6302 0.0464 -0.0184 0.0313 151 GLU A CA 462 C C . GLU A 75 ? 0.6418 0.5950 0.5525 0.0485 -0.0197 0.0353 151 GLU A C 463 O O . GLU A 75 ? 0.6419 0.5887 0.5568 0.0500 -0.0182 0.0388 151 GLU A O 464 C CB . GLU A 75 ? 0.8673 0.8294 0.7670 0.0502 -0.0172 0.0358 151 GLU A CB 465 C CG . GLU A 75 ? 1.1180 1.0761 1.0122 0.0499 -0.0135 0.0348 151 GLU A CG 466 C CD . GLU A 75 ? 1.2465 1.2105 1.1376 0.0537 -0.0124 0.0394 151 GLU A CD 467 O OE1 . GLU A 75 ? 1.1280 1.0951 1.0234 0.0575 -0.0135 0.0452 151 GLU A OE1 468 O OE2 . GLU A 75 ? 1.1781 1.1429 1.0618 0.0529 -0.0100 0.0372 151 GLU A OE2 469 N N . GLN A 76 ? 0.7362 0.6942 0.6494 0.0484 -0.0224 0.0348 152 GLN A N 470 C CA . GLN A 76 ? 0.7115 0.6661 0.6315 0.0507 -0.0233 0.0387 152 GLN A CA 471 C C . GLN A 76 ? 0.6958 0.6463 0.6192 0.0479 -0.0247 0.0355 152 GLN A C 472 O O . GLN A 76 ? 0.7946 0.7427 0.7228 0.0493 -0.0255 0.0378 152 GLN A O 473 C CB . GLN A 76 ? 0.7712 0.7330 0.6921 0.0555 -0.0241 0.0436 152 GLN A CB 474 C CG . GLN A 76 ? 0.9118 0.8855 0.8302 0.0559 -0.0265 0.0418 152 GLN A CG 475 C CD . GLN A 76 ? 0.9994 0.9806 0.9179 0.0620 -0.0266 0.0480 152 GLN A CD 476 O OE1 . GLN A 76 ? 1.1109 1.0949 1.0327 0.0650 -0.0276 0.0502 152 GLN A OE1 477 N NE2 . GLN A 76 ? 0.8694 0.8533 0.7839 0.0642 -0.0253 0.0510 152 GLN A NE2 478 N N . MET A 77 ? 0.7229 0.6715 0.6431 0.0437 -0.0246 0.0300 156 MET A N 479 C CA . MET A 77 ? 0.6540 0.5971 0.5768 0.0408 -0.0253 0.0272 156 MET A CA 480 C C . MET A 77 ? 0.6510 0.5845 0.5771 0.0409 -0.0241 0.0290 156 MET A C 481 O O . MET A 77 ? 0.6840 0.6142 0.6085 0.0413 -0.0219 0.0299 156 MET A O 482 C CB . MET A 77 ? 0.6691 0.6128 0.5869 0.0362 -0.0251 0.0209 156 MET A CB 483 C CG . MET A 77 ? 0.8342 0.7895 0.7492 0.0353 -0.0267 0.0187 156 MET A CG 484 S SD . MET A 77 ? 1.2185 1.1769 1.1334 0.0305 -0.0281 0.0131 156 MET A SD 485 C CE . MET A 77 ? 0.6345 0.6014 0.5412 0.0258 -0.0275 0.0075 156 MET A CE 486 N N . ASN A 78 ? 0.7507 0.6808 0.6814 0.0405 -0.0253 0.0297 157 ASN A N 487 C CA . ASN A 78 ? 0.7685 0.6913 0.7026 0.0398 -0.0248 0.0310 157 ASN A CA 488 C C . ASN A 78 ? 0.7033 0.6220 0.6368 0.0367 -0.0255 0.0273 157 ASN A C 489 O O . ASN A 78 ? 0.6975 0.6188 0.6292 0.0350 -0.0265 0.0240 157 ASN A O 490 C CB . ASN A 78 ? 0.7308 0.6523 0.6702 0.0415 -0.0253 0.0352 157 ASN A CB 491 C CG . ASN A 78 ? 0.7768 0.7007 0.7166 0.0446 -0.0239 0.0395 157 ASN A CG 492 O OD1 . ASN A 78 ? 0.7650 0.6898 0.7026 0.0452 -0.0223 0.0401 157 ASN A OD1 493 N ND2 . ASN A 78 ? 0.7906 0.7149 0.7329 0.0466 -0.0240 0.0427 157 ASN A ND2 494 N N . VAL A 79 ? 0.7274 0.6407 0.6624 0.0361 -0.0248 0.0282 158 VAL A N 495 C CA . VAL A 79 ? 0.7129 0.6219 0.6478 0.0337 -0.0255 0.0258 158 VAL A CA 496 C C . VAL A 79 ? 0.6654 0.5733 0.6055 0.0336 -0.0273 0.0279 158 VAL A C 497 O O . VAL A 79 ? 0.6679 0.5756 0.6117 0.0346 -0.0272 0.0314 158 VAL A O 498 C CB . VAL A 79 ? 0.7537 0.6577 0.6865 0.0336 -0.0236 0.0257 158 VAL A CB 499 C CG1 . VAL A 79 ? 0.6541 0.5535 0.5845 0.0311 -0.0238 0.0227 158 VAL A CG1 500 C CG2 . VAL A 79 ? 0.6525 0.5565 0.5802 0.0343 -0.0209 0.0245 158 VAL A CG2 501 N N . TYR A 80 ? 0.6206 0.5280 0.5607 0.0319 -0.0287 0.0255 159 TYR A N 502 C CA . TYR A 80 ? 0.6510 0.5560 0.5946 0.0310 -0.0300 0.0266 159 TYR A CA 503 C C . TYR A 80 ? 0.6558 0.5574 0.5978 0.0285 -0.0307 0.0238 159 TYR A C 504 O O . TYR A 80 ? 0.8193 0.7204 0.7575 0.0273 -0.0300 0.0209 159 TYR A O 505 C CB . TYR A 80 ? 0.6665 0.5732 0.6117 0.0321 -0.0304 0.0269 159 TYR A CB 506 C CG . TYR A 80 ? 0.6935 0.6036 0.6395 0.0353 -0.0295 0.0300 159 TYR A CG 507 C CD1 . TYR A 80 ? 0.6048 0.5128 0.5540 0.0363 -0.0287 0.0337 159 TYR A CD1 508 C CD2 . TYR A 80 ? 0.7255 0.6414 0.6689 0.0370 -0.0293 0.0291 159 TYR A CD2 509 C CE1 . TYR A 80 ? 0.6582 0.5687 0.6076 0.0394 -0.0275 0.0369 159 TYR A CE1 510 C CE2 . TYR A 80 ? 0.6939 0.6136 0.6376 0.0402 -0.0285 0.0324 159 TYR A CE2 511 C CZ . TYR A 80 ? 0.7604 0.6768 0.7069 0.0417 -0.0274 0.0365 159 TYR A CZ 512 O OH . TYR A 80 ? 0.7008 0.6201 0.6470 0.0451 -0.0263 0.0401 159 TYR A OH 513 N N . SER A 81 ? 0.6806 0.5798 0.6250 0.0271 -0.0318 0.0246 160 SER A N 514 C CA . SER A 81 ? 0.7381 0.6346 0.6806 0.0248 -0.0327 0.0220 160 SER A CA 515 C C . SER A 81 ? 0.6415 0.5365 0.5859 0.0236 -0.0336 0.0215 160 SER A C 516 O O . SER A 81 ? 0.6373 0.5321 0.5847 0.0241 -0.0335 0.0238 160 SER A O 517 C CB . SER A 81 ? 0.5699 0.4645 0.5116 0.0240 -0.0329 0.0230 160 SER A CB 518 O OG . SER A 81 ? 0.6954 0.5910 0.6409 0.0235 -0.0341 0.0256 160 SER A OG 519 N N . VAL A 82 ? 0.5993 0.4925 0.5416 0.0219 -0.0339 0.0186 161 VAL A N 520 C CA . VAL A 82 ? 0.5431 0.4333 0.4859 0.0202 -0.0345 0.0177 161 VAL A CA 521 C C . VAL A 82 ? 0.6070 0.4951 0.5471 0.0176 -0.0354 0.0159 161 VAL A C 522 O O . VAL A 82 ? 0.7508 0.6391 0.6883 0.0176 -0.0352 0.0154 161 VAL A O 523 C CB . VAL A 82 ? 0.5794 0.4696 0.5221 0.0213 -0.0335 0.0158 161 VAL A CB 524 C CG1 . VAL A 82 ? 0.4922 0.3848 0.4373 0.0246 -0.0325 0.0182 161 VAL A CG1 525 C CG2 . VAL A 82 ? 0.6222 0.5147 0.5622 0.0208 -0.0332 0.0129 161 VAL A CG2 526 N N . LYS A 83 ? 0.7413 0.6268 0.6812 0.0153 -0.0362 0.0149 162 LYS A N 527 C CA . LYS A 83 ? 0.7408 0.6246 0.6773 0.0130 -0.0370 0.0132 162 LYS A CA 528 C C . LYS A 83 ? 0.7278 0.6107 0.6613 0.0131 -0.0357 0.0102 162 LYS A C 529 O O . LYS A 83 ? 0.5977 0.4810 0.5322 0.0141 -0.0346 0.0088 162 LYS A O 530 C CB . LYS A 83 ? 0.8235 0.7050 0.7597 0.0100 -0.0380 0.0123 162 LYS A CB 531 C CG . LYS A 83 ? 0.8047 0.6859 0.7372 0.0077 -0.0394 0.0114 162 LYS A CG 532 C CD . LYS A 83 ? 0.8591 0.7371 0.7895 0.0045 -0.0397 0.0088 162 LYS A CD 533 C CE . LYS A 83 ? 0.9701 0.8497 0.8973 0.0018 -0.0418 0.0089 162 LYS A CE 534 N NZ . LYS A 83 ? 1.1305 1.0093 1.0575 -0.0023 -0.0429 0.0075 162 LYS A NZ 535 N N . LEU A 84 ? 0.5471 0.4292 0.4771 0.0121 -0.0356 0.0094 163 LEU A N 536 C CA . LEU A 84 ? 0.6929 0.5745 0.6201 0.0114 -0.0341 0.0064 163 LEU A CA 537 C C . LEU A 84 ? 0.7462 0.6264 0.6730 0.0103 -0.0339 0.0041 163 LEU A C 538 O O . LEU A 84 ? 0.8709 0.7485 0.7961 0.0084 -0.0349 0.0039 163 LEU A O 539 C CB . LEU A 84 ? 0.7128 0.5918 0.6353 0.0101 -0.0335 0.0061 163 LEU A CB 540 C CG . LEU A 84 ? 0.6780 0.5567 0.5978 0.0086 -0.0315 0.0028 163 LEU A CG 541 C CD1 . LEU A 84 ? 0.6914 0.5747 0.6137 0.0095 -0.0304 0.0017 163 LEU A CD1 542 C CD2 . LEU A 84 ? 0.5652 0.4398 0.4798 0.0073 -0.0300 0.0028 163 LEU A CD2 543 N N . GLY A 85 ? 0.6337 0.5162 0.5620 0.0115 -0.0325 0.0025 164 GLY A N 544 C CA . GLY A 85 ? 0.6536 0.5344 0.5817 0.0114 -0.0316 0.0006 164 GLY A CA 545 C C . GLY A 85 ? 0.8339 0.7142 0.7654 0.0140 -0.0310 0.0020 164 GLY A C 546 O O . GLY A 85 ? 0.7704 0.6504 0.7025 0.0156 -0.0292 0.0007 164 GLY A O 547 N N . ASP A 86 ? 0.7685 0.6484 0.7022 0.0146 -0.0321 0.0047 165 ASP A N 548 C CA . ASP A 86 ? 0.7857 0.6648 0.7224 0.0173 -0.0309 0.0065 165 ASP A CA 549 C C . ASP A 86 ? 0.8333 0.7189 0.7722 0.0210 -0.0301 0.0076 165 ASP A C 550 O O . ASP A 86 ? 0.8424 0.7327 0.7811 0.0207 -0.0310 0.0074 165 ASP A O 551 C CB . ASP A 86 ? 0.8764 0.7535 0.8148 0.0163 -0.0320 0.0091 165 ASP A CB 552 C CG . ASP A 86 ? 1.0583 0.9306 0.9946 0.0121 -0.0329 0.0079 165 ASP A CG 553 O OD1 . ASP A 86 ? 1.0506 0.9199 0.9838 0.0105 -0.0323 0.0050 165 ASP A OD1 554 O OD2 . ASP A 86 ? 1.0521 0.9247 0.9900 0.0103 -0.0341 0.0097 165 ASP A OD2 555 N N . PRO A 87 ? 0.8886 0.7745 0.8293 0.0246 -0.0283 0.0085 166 PRO A N 556 C CA . PRO A 87 ? 0.8763 0.7701 0.8193 0.0286 -0.0278 0.0102 166 PRO A CA 557 C C . PRO A 87 ? 0.9439 0.8384 0.8886 0.0303 -0.0283 0.0138 166 PRO A C 558 O O . PRO A 87 ? 1.0368 0.9249 0.9819 0.0299 -0.0278 0.0155 166 PRO A O 559 C CB . PRO A 87 ? 0.7449 0.6381 0.6888 0.0325 -0.0252 0.0105 166 PRO A CB 560 C CG . PRO A 87 ? 0.7156 0.5977 0.6578 0.0308 -0.0239 0.0101 166 PRO A CG 561 C CD . PRO A 87 ? 0.6667 0.5458 0.6065 0.0252 -0.0261 0.0078 166 PRO A CD 562 N N . PRO A 88 ? 0.8452 0.7475 0.7906 0.0317 -0.0291 0.0146 167 PRO A N 563 C CA . PRO A 88 ? 0.7614 0.6648 0.7079 0.0334 -0.0295 0.0180 167 PRO A CA 564 C C . PRO A 88 ? 0.7975 0.7005 0.7457 0.0382 -0.0277 0.0216 167 PRO A C 565 O O . PRO A 88 ? 1.0006 0.9110 0.9495 0.0419 -0.0275 0.0236 167 PRO A O 566 C CB . PRO A 88 ? 0.7375 0.6495 0.6831 0.0333 -0.0304 0.0169 167 PRO A CB 567 C CG . PRO A 88 ? 0.8844 0.8017 0.8297 0.0330 -0.0302 0.0139 167 PRO A CG 568 C CD . PRO A 88 ? 0.7577 0.6677 0.7022 0.0308 -0.0297 0.0120 167 PRO A CD 569 N N . THR A 89 ? 0.7724 0.6665 0.7208 0.0380 -0.0261 0.0226 168 THR A N 570 C CA . THR A 89 ? 0.9003 0.7907 0.8496 0.0421 -0.0235 0.0263 168 THR A CA 571 C C . THR A 89 ? 1.0371 0.9231 0.9871 0.0403 -0.0235 0.0289 168 THR A C 572 O O . THR A 89 ? 0.8727 0.7575 0.8227 0.0358 -0.0253 0.0273 168 THR A O 573 C CB . THR A 89 ? 0.7948 0.6764 0.7431 0.0426 -0.0208 0.0253 168 THR A CB 574 O OG1 . THR A 89 ? 0.9421 0.8155 0.8891 0.0368 -0.0213 0.0228 168 THR A OG1 575 C CG2 . THR A 89 ? 0.6851 0.5715 0.6331 0.0441 -0.0206 0.0227 168 THR A CG2 576 N N . PRO A 90 ? 1.1629 1.0471 1.1135 0.0442 -0.0212 0.0331 169 PRO A N 577 C CA . PRO A 90 ? 1.1811 1.0614 1.1326 0.0427 -0.0205 0.0359 169 PRO A CA 578 C C . PRO A 90 ? 1.1079 0.9805 1.0595 0.0365 -0.0207 0.0339 169 PRO A C 579 O O . PRO A 90 ? 1.0211 0.8955 0.9742 0.0334 -0.0221 0.0344 169 PRO A O 580 C CB . PRO A 90 ? 1.2295 1.1054 1.1805 0.0478 -0.0168 0.0403 169 PRO A CB 581 C CG . PRO A 90 ? 1.2343 1.1188 1.1849 0.0535 -0.0171 0.0411 169 PRO A CG 582 C CD . PRO A 90 ? 1.1629 1.0506 1.1133 0.0509 -0.0192 0.0360 169 PRO A CD 583 N N . ASP A 91 ? 1.1819 1.0471 1.1321 0.0349 -0.0192 0.0315 170 ASP A N 584 C CA . ASP A 91 ? 1.2710 1.1296 1.2206 0.0285 -0.0194 0.0289 170 ASP A CA 585 C C . ASP A 91 ? 1.1180 0.9829 1.0684 0.0244 -0.0234 0.0267 170 ASP A C 586 O O . ASP A 91 ? 1.1252 0.9904 1.0771 0.0202 -0.0246 0.0269 170 ASP A O 587 C CB . ASP A 91 ? 1.5782 1.4291 1.5249 0.0277 -0.0174 0.0257 170 ASP A CB 588 C CG . ASP A 91 ? 1.7620 1.6088 1.7076 0.0342 -0.0134 0.0279 170 ASP A CG 589 O OD1 . ASP A 91 ? 1.7404 1.5921 1.6874 0.0395 -0.0128 0.0319 170 ASP A OD1 590 O OD2 . ASP A 91 ? 1.8535 1.6923 1.7965 0.0342 -0.0106 0.0257 170 ASP A OD2 591 N N . LYS A 92 A 1.0153 0.8858 0.9648 0.0259 -0.0253 0.0247 170 LYS A N 592 C CA . LYS A 92 A 1.0497 0.9239 0.9987 0.0224 -0.0283 0.0222 170 LYS A CA 593 C C . LYS A 92 A 0.9853 0.8665 0.9356 0.0232 -0.0301 0.0238 170 LYS A C 594 O O . LYS A 92 A 0.8952 0.7787 0.8449 0.0210 -0.0321 0.0226 170 LYS A O 595 C CB . LYS A 92 A 1.0005 0.8751 0.9469 0.0229 -0.0285 0.0188 170 LYS A CB 596 C CG . LYS A 92 A 0.9856 0.8527 0.9300 0.0217 -0.0265 0.0166 170 LYS A CG 597 C CD . LYS A 92 A 1.0965 0.9602 1.0390 0.0159 -0.0280 0.0139 170 LYS A CD 598 C CE . LYS A 92 A 1.0373 0.8936 0.9763 0.0143 -0.0260 0.0106 170 LYS A CE 599 N NZ . LYS A 92 A 1.2334 1.0907 1.1719 0.0190 -0.0240 0.0099 170 LYS A NZ 600 N N . LEU A 93 ? 1.0159 0.9000 0.9675 0.0268 -0.0291 0.0268 171 LEU A N 601 C CA . LEU A 93 ? 0.8918 0.7817 0.8439 0.0278 -0.0301 0.0282 171 LEU A CA 602 C C . LEU A 93 ? 0.8465 0.7369 0.8009 0.0255 -0.0307 0.0302 171 LEU A C 603 O O . LEU A 93 ? 0.9977 0.8852 0.9541 0.0238 -0.0298 0.0318 171 LEU A O 604 C CB . LEU A 93 ? 0.7152 0.6087 0.6674 0.0322 -0.0288 0.0308 171 LEU A CB 605 C CG . LEU A 93 ? 0.8005 0.6999 0.7507 0.0343 -0.0294 0.0290 171 LEU A CG 606 C CD1 . LEU A 93 ? 0.8360 0.7343 0.7852 0.0337 -0.0295 0.0259 171 LEU A CD1 607 C CD2 . LEU A 93 ? 1.0198 0.9234 0.9700 0.0386 -0.0282 0.0319 171 LEU A CD2 608 N N . LYS A 94 ? 0.7245 0.6186 0.6784 0.0254 -0.0319 0.0299 172 LYS A N 609 C CA . LYS A 94 ? 0.7399 0.6366 0.6962 0.0248 -0.0321 0.0325 172 LYS A CA 610 C C . LYS A 94 ? 0.7761 0.6763 0.7314 0.0281 -0.0310 0.0339 172 LYS A C 611 O O . LYS A 94 ? 0.7062 0.6074 0.6584 0.0290 -0.0311 0.0319 172 LYS A O 612 C CB . LYS A 94 ? 0.6598 0.5575 0.6157 0.0225 -0.0338 0.0314 172 LYS A CB 613 C CG . LYS A 94 ? 0.6671 0.5692 0.6256 0.0229 -0.0339 0.0343 172 LYS A CG 614 C CD . LYS A 94 ? 0.8686 0.7724 0.8268 0.0212 -0.0357 0.0339 172 LYS A CD 615 C CE . LYS A 94 ? 0.7736 0.6833 0.7355 0.0219 -0.0357 0.0375 172 LYS A CE 616 N NZ . LYS A 94 ? 0.9504 0.8624 0.9170 0.0198 -0.0354 0.0396 172 LYS A NZ 617 N N . PHE A 95 ? 0.7008 0.6026 0.6583 0.0295 -0.0296 0.0372 173 PHE A N 618 C CA . PHE A 95 ? 0.6857 0.5909 0.6421 0.0323 -0.0285 0.0386 173 PHE A CA 619 C C . PHE A 95 ? 0.6996 0.6062 0.6558 0.0320 -0.0287 0.0385 173 PHE A C 620 O O . PHE A 95 ? 0.6260 0.5338 0.5855 0.0304 -0.0294 0.0401 173 PHE A O 621 C CB . PHE A 95 ? 0.5252 0.4316 0.4840 0.0337 -0.0267 0.0425 173 PHE A CB 622 C CG . PHE A 95 ? 0.6057 0.5155 0.5625 0.0367 -0.0252 0.0439 173 PHE A CG 623 C CD1 . PHE A 95 ? 0.4861 0.3981 0.4440 0.0372 -0.0243 0.0453 173 PHE A CD1 624 C CD2 . PHE A 95 ? 0.5892 0.5006 0.5426 0.0393 -0.0245 0.0436 173 PHE A CD2 625 C CE1 . PHE A 95 ? 0.5756 0.4897 0.5307 0.0399 -0.0223 0.0460 173 PHE A CE1 626 C CE2 . PHE A 95 ? 0.5100 0.4245 0.4605 0.0415 -0.0231 0.0443 173 PHE A CE2 627 C CZ . PHE A 95 ? 0.5415 0.4566 0.4926 0.0417 -0.0218 0.0453 173 PHE A CZ 628 N N . GLU A 96 ? 0.5360 0.4426 0.4881 0.0335 -0.0279 0.0367 174 GLU A N 629 C CA . GLU A 96 ? 0.6359 0.5423 0.5869 0.0342 -0.0271 0.0370 174 GLU A CA 630 C C . GLU A 96 ? 0.6658 0.5738 0.6157 0.0371 -0.0245 0.0390 174 GLU A C 631 O O . GLU A 96 ? 0.6494 0.5593 0.6019 0.0384 -0.0235 0.0419 174 GLU A O 632 C CB . GLU A 96 ? 0.7065 0.6093 0.6526 0.0332 -0.0273 0.0333 174 GLU A CB 633 C CG . GLU A 96 ? 0.6923 0.5934 0.6389 0.0305 -0.0295 0.0314 174 GLU A CG 634 C CD . GLU A 96 ? 0.8795 0.7813 0.8290 0.0295 -0.0309 0.0334 174 GLU A CD 635 O OE1 . GLU A 96 ? 0.7857 0.6905 0.7379 0.0310 -0.0302 0.0366 174 GLU A OE1 636 O OE2 . GLU A 96 ? 0.9020 0.8023 0.8511 0.0271 -0.0326 0.0317 174 GLU A OE2 637 N N . ALA A 97 ? 0.6255 0.5338 0.5716 0.0381 -0.0234 0.0375 175 ALA A N 638 C CA . ALA A 97 ? 0.6770 0.5863 0.6207 0.0405 -0.0207 0.0386 175 ALA A CA 639 C C . ALA A 97 ? 0.7429 0.6546 0.6830 0.0410 -0.0204 0.0373 175 ALA A C 640 O O . ALA A 97 ? 0.7711 0.6838 0.7106 0.0398 -0.0222 0.0354 175 ALA A O 641 C CB . ALA A 97 ? 0.5187 0.4241 0.4580 0.0412 -0.0185 0.0368 175 ALA A CB 642 N N . VAL A 98 ? 0.6262 0.5393 0.5639 0.0430 -0.0180 0.0384 176 VAL A N 643 C CA . VAL A 98 ? 0.6513 0.5675 0.5841 0.0435 -0.0176 0.0368 176 VAL A CA 644 C C . VAL A 98 ? 0.7608 0.6739 0.6868 0.0419 -0.0160 0.0320 176 VAL A C 645 O O . VAL A 98 ? 0.6935 0.6022 0.6178 0.0426 -0.0134 0.0320 176 VAL A O 646 C CB . VAL A 98 ? 0.7637 0.6829 0.6964 0.0462 -0.0155 0.0404 176 VAL A CB 647 C CG1 . VAL A 98 ? 0.6567 0.5800 0.5831 0.0466 -0.0150 0.0385 176 VAL A CG1 648 C CG2 . VAL A 98 ? 0.6949 0.6158 0.6340 0.0472 -0.0163 0.0451 176 VAL A CG2 649 N N . GLY A 99 ? 0.6003 0.5157 0.5225 0.0397 -0.0173 0.0281 177 GLY A N 650 C CA . GLY A 99 ? 0.6144 0.5267 0.5296 0.0370 -0.0154 0.0231 177 GLY A CA 651 C C . GLY A 99 ? 0.6563 0.5719 0.5696 0.0336 -0.0176 0.0189 177 GLY A C 652 O O . GLY A 99 ? 0.5704 0.4900 0.4884 0.0339 -0.0204 0.0202 177 GLY A O 653 N N . TRP A 100 ? 0.6091 0.5230 0.5156 0.0301 -0.0158 0.0137 178 TRP A N 654 C CA . TRP A 100 ? 0.5641 0.4832 0.4687 0.0262 -0.0176 0.0093 178 TRP A CA 655 C C . TRP A 100 ? 0.6913 0.6023 0.5924 0.0221 -0.0157 0.0050 178 TRP A C 656 O O . TRP A 100 ? 0.6879 0.6022 0.5876 0.0181 -0.0167 0.0010 178 TRP A O 657 C CB . TRP A 100 ? 0.5830 0.5099 0.4820 0.0245 -0.0174 0.0065 178 TRP A CB 658 C CG . TRP A 100 ? 0.6783 0.5985 0.5693 0.0226 -0.0131 0.0033 178 TRP A CG 659 C CD1 . TRP A 100 ? 0.6970 0.6094 0.5817 0.0179 -0.0100 -0.0021 178 TRP A CD1 660 C CD2 . TRP A 100 ? 0.7446 0.6643 0.6326 0.0254 -0.0109 0.0053 178 TRP A CD2 661 N NE1 . TRP A 100 ? 0.8051 0.7114 0.6827 0.0177 -0.0058 -0.0038 178 TRP A NE1 662 C CE2 . TRP A 100 ? 0.8651 0.7762 0.7446 0.0223 -0.0063 0.0007 178 TRP A CE2 663 C CE3 . TRP A 100 ? 0.7609 0.6860 0.6522 0.0300 -0.0118 0.0106 178 TRP A CE3 664 C CZ2 . TRP A 100 ? 0.8540 0.7620 0.7282 0.0241 -0.0027 0.0010 178 TRP A CZ2 665 C CZ3 . TRP A 100 ? 0.7548 0.6775 0.6411 0.0317 -0.0084 0.0111 178 TRP A CZ3 666 C CH2 . TRP A 100 ? 0.8164 0.7309 0.6944 0.0288 -0.0040 0.0062 178 TRP A CH2 667 N N . SER A 101 ? 0.7152 0.6159 0.6149 0.0234 -0.0127 0.0061 179 SER A N 668 C CA . SER A 101 ? 0.7556 0.6467 0.6515 0.0207 -0.0102 0.0032 179 SER A CA 669 C C . SER A 101 ? 0.7427 0.6277 0.6430 0.0246 -0.0099 0.0080 179 SER A C 670 O O . SER A 101 ? 0.7545 0.6384 0.6564 0.0286 -0.0086 0.0117 179 SER A O 671 C CB . SER A 101 ? 0.7575 0.6412 0.6441 0.0181 -0.0053 -0.0010 179 SER A CB 672 O OG . SER A 101 ? 0.8217 0.6951 0.7035 0.0150 -0.0021 -0.0041 179 SER A OG 673 N N . ALA A 102 ? 0.6293 0.5116 0.5317 0.0235 -0.0112 0.0080 180 ALA A N 674 C CA . ALA A 102 ? 0.6431 0.5215 0.5495 0.0270 -0.0113 0.0125 180 ALA A CA 675 C C . ALA A 102 ? 0.6923 0.5625 0.5958 0.0257 -0.0098 0.0115 180 ALA A C 676 O O . ALA A 102 ? 0.6890 0.5579 0.5895 0.0216 -0.0098 0.0075 180 ALA A O 677 C CB . ALA A 102 ? 0.7336 0.6193 0.6481 0.0289 -0.0156 0.0162 180 ALA A CB 678 N N . SER A 103 ? 0.6183 0.4841 0.5229 0.0295 -0.0083 0.0155 181 SER A N 679 C CA . SER A 103 ? 0.6101 0.4694 0.5130 0.0297 -0.0074 0.0164 181 SER A CA 680 C C . SER A 103 ? 0.6418 0.5055 0.5515 0.0335 -0.0102 0.0219 181 SER A C 681 O O . SER A 103 ? 0.6908 0.5586 0.6044 0.0369 -0.0103 0.0255 181 SER A O 682 C CB . SER A 103 ? 0.6980 0.5458 0.5930 0.0310 -0.0014 0.0158 181 SER A CB 683 O OG . SER A 103 ? 0.6641 0.5061 0.5578 0.0327 -0.0003 0.0182 181 SER A OG 684 N N . SER A 104 ? 0.6961 0.5599 0.6073 0.0325 -0.0125 0.0226 182 SER A N 685 C CA . SER A 104 ? 0.6537 0.5221 0.5705 0.0355 -0.0149 0.0277 182 SER A CA 686 C C . SER A 104 ? 0.6572 0.5217 0.5716 0.0360 -0.0148 0.0290 182 SER A C 687 O O . SER A 104 ? 0.7972 0.6556 0.7063 0.0333 -0.0134 0.0259 182 SER A O 688 C CB . SER A 104 ? 0.6917 0.5690 0.6156 0.0340 -0.0196 0.0283 182 SER A CB 689 O OG . SER A 104 ? 0.6846 0.5621 0.6080 0.0302 -0.0218 0.0249 182 SER A OG 690 N N . CYS A 105 ? 0.7170 0.5862 0.6355 0.0393 -0.0163 0.0340 183 CYS A N 691 C CA . CYS A 105 ? 0.5501 0.4180 0.4670 0.0406 -0.0168 0.0365 183 CYS A CA 692 C C . CYS A 105 ? 0.6449 0.5231 0.5687 0.0431 -0.0201 0.0416 183 CYS A C 693 O O . CYS A 105 ? 0.7383 0.6221 0.6669 0.0454 -0.0201 0.0441 183 CYS A O 694 C CB . CYS A 105 ? 0.5383 0.3960 0.4480 0.0442 -0.0112 0.0380 183 CYS A CB 695 S SG . CYS A 105 ? 0.7869 0.6426 0.6964 0.0498 -0.0064 0.0408 183 CYS A SG 696 N N . HIS A 106 ? 0.6812 0.5622 0.6052 0.0424 -0.0228 0.0430 184 HIS A N 697 C CA . HIS A 106 ? 0.6577 0.5500 0.5879 0.0435 -0.0265 0.0472 184 HIS A CA 698 C C . HIS A 106 ? 0.6815 0.5744 0.6093 0.0488 -0.0251 0.0526 184 HIS A C 699 O O . HIS A 106 ? 0.8316 0.7166 0.7526 0.0494 -0.0231 0.0522 184 HIS A O 700 C CB . HIS A 106 ? 0.7079 0.6044 0.6400 0.0380 -0.0312 0.0445 184 HIS A CB 701 C CG . HIS A 106 ? 0.7659 0.6742 0.7049 0.0368 -0.0352 0.0471 184 HIS A CG 702 N ND1 . HIS A 106 ? 0.7351 0.6514 0.6755 0.0391 -0.0369 0.0516 184 HIS A ND1 703 C CD2 . HIS A 106 ? 0.6887 0.6027 0.6335 0.0333 -0.0376 0.0458 184 HIS A CD2 704 C CE1 . HIS A 106 ? 0.7150 0.6420 0.6619 0.0363 -0.0404 0.0526 184 HIS A CE1 705 N NE2 . HIS A 106 ? 0.7108 0.6357 0.6604 0.0326 -0.0406 0.0490 184 HIS A NE2 706 N N . ASP A 107 ? 0.5875 0.4905 0.5209 0.0526 -0.0259 0.0578 185 ASP A N 707 C CA . ASP A 107 ? 0.6647 0.5700 0.5966 0.0592 -0.0241 0.0640 185 ASP A CA 708 C C . ASP A 107 ? 0.8132 0.7320 0.7491 0.0586 -0.0292 0.0674 185 ASP A C 709 O O . ASP A 107 ? 0.7086 0.6329 0.6444 0.0644 -0.0286 0.0734 185 ASP A O 710 C CB . ASP A 107 ? 0.5178 0.4261 0.4532 0.0654 -0.0206 0.0683 185 ASP A CB 711 C CG . ASP A 107 ? 0.9086 0.8320 0.8542 0.0637 -0.0244 0.0699 185 ASP A CG 712 O OD1 . ASP A 107 ? 0.7637 0.6940 0.7132 0.0574 -0.0295 0.0673 185 ASP A OD1 713 O OD2 . ASP A 107 ? 0.7764 0.7041 0.7259 0.0685 -0.0218 0.0736 185 ASP A OD2 714 N N . GLY A 108 ? 0.7216 0.6459 0.6606 0.0517 -0.0341 0.0637 186 GLY A N 715 C CA . GLY A 108 ? 0.7433 0.6815 0.6863 0.0497 -0.0392 0.0661 186 GLY A CA 716 C C . GLY A 108 ? 0.8202 0.7712 0.7725 0.0470 -0.0421 0.0668 186 GLY A C 717 O O . GLY A 108 ? 0.8959 0.8568 0.8516 0.0418 -0.0467 0.0658 186 GLY A O 718 N N . PHE A 109 ? 0.8250 0.7758 0.7812 0.0499 -0.0392 0.0681 187 PHE A N 719 C CA . PHE A 109 ? 0.5982 0.5607 0.5632 0.0469 -0.0414 0.0688 187 PHE A CA 720 C C . PHE A 109 ? 0.6699 0.6256 0.6360 0.0420 -0.0409 0.0637 187 PHE A C 721 O O . PHE A 109 ? 0.5396 0.5014 0.5105 0.0362 -0.0437 0.0619 187 PHE A O 722 C CB . PHE A 109 ? 0.4876 0.4589 0.4577 0.0538 -0.0390 0.0751 187 PHE A CB 723 C CG . PHE A 109 ? 0.7181 0.6956 0.6867 0.0603 -0.0387 0.0810 187 PHE A CG 724 C CD1 . PHE A 109 ? 0.6525 0.6425 0.6227 0.0579 -0.0436 0.0828 187 PHE A CD1 725 C CD2 . PHE A 109 ? 0.7485 0.7189 0.7134 0.0690 -0.0332 0.0849 187 PHE A CD2 726 C CE1 . PHE A 109 ? 0.6467 0.6433 0.6152 0.0647 -0.0434 0.0889 187 PHE A CE1 727 C CE2 . PHE A 109 ? 0.8887 0.8641 0.8517 0.0760 -0.0323 0.0911 187 PHE A CE2 728 C CZ . PHE A 109 ? 0.7920 0.7811 0.7570 0.0741 -0.0376 0.0934 187 PHE A CZ 729 N N . GLN A 110 ? 0.7441 0.6871 0.7053 0.0441 -0.0371 0.0614 188 GLN A N 730 C CA . GLN A 110 ? 0.6326 0.5711 0.5953 0.0416 -0.0358 0.0582 188 GLN A CA 731 C C . GLN A 110 ? 0.6008 0.5255 0.5561 0.0427 -0.0325 0.0546 188 GLN A C 732 O O . GLN A 110 ? 0.7157 0.6340 0.6654 0.0465 -0.0298 0.0555 188 GLN A O 733 C CB . GLN A 110 ? 0.6201 0.5658 0.5887 0.0453 -0.0338 0.0623 188 GLN A CB 734 C CG . GLN A 110 ? 0.8004 0.7513 0.7751 0.0411 -0.0349 0.0615 188 GLN A CG 735 C CD . GLN A 110 ? 0.7432 0.7041 0.7230 0.0352 -0.0393 0.0614 188 GLN A CD 736 O OE1 . GLN A 110 ? 0.6428 0.6161 0.6274 0.0359 -0.0411 0.0653 188 GLN A OE1 737 N NE2 . GLN A 110 ? 0.6793 0.6351 0.6580 0.0293 -0.0409 0.0570 188 GLN A NE2 738 N N . TRP A 111 ? 0.6719 0.5921 0.6269 0.0393 -0.0325 0.0506 189 TRP A N 739 C CA . TRP A 111 ? 0.5289 0.4386 0.4779 0.0400 -0.0295 0.0471 189 TRP A CA 740 C C . TRP A 111 ? 0.5836 0.4918 0.5322 0.0444 -0.0254 0.0491 189 TRP A C 741 O O . TRP A 111 ? 0.8996 0.8142 0.8536 0.0454 -0.0253 0.0516 189 TRP A O 742 C CB . TRP A 111 ? 0.5175 0.4246 0.4666 0.0356 -0.0309 0.0428 189 TRP A CB 743 C CG . TRP A 111 ? 0.6603 0.5653 0.6072 0.0318 -0.0334 0.0398 189 TRP A CG 744 C CD1 . TRP A 111 ? 0.5415 0.4508 0.4916 0.0279 -0.0367 0.0393 189 TRP A CD1 745 C CD2 . TRP A 111 ? 0.7830 0.6807 0.7235 0.0311 -0.0324 0.0368 189 TRP A CD2 746 N NE1 . TRP A 111 ? 0.6213 0.5262 0.5672 0.0254 -0.0378 0.0361 189 TRP A NE1 747 C CE2 . TRP A 111 ? 0.7828 0.6812 0.7232 0.0273 -0.0352 0.0347 189 TRP A CE2 748 C CE3 . TRP A 111 ? 0.7092 0.5996 0.6438 0.0329 -0.0290 0.0354 189 TRP A CE3 749 C CZ2 . TRP A 111 ? 0.6893 0.5819 0.6243 0.0257 -0.0349 0.0316 189 TRP A CZ2 750 C CZ3 . TRP A 111 ? 0.8619 0.7464 0.7912 0.0308 -0.0286 0.0322 189 TRP A CZ3 751 C CH2 . TRP A 111 ? 0.7768 0.6628 0.7065 0.0274 -0.0316 0.0305 189 TRP A CH2 752 N N . THR A 112 ? 0.7205 0.6197 0.6623 0.0469 -0.0217 0.0480 190 THR A N 753 C CA . THR A 112 ? 0.7614 0.6562 0.7006 0.0501 -0.0172 0.0480 190 THR A CA 754 C C . THR A 112 ? 0.7536 0.6423 0.6883 0.0463 -0.0168 0.0425 190 THR A C 755 O O . THR A 112 ? 0.7991 0.6820 0.7291 0.0436 -0.0170 0.0390 190 THR A O 756 C CB . THR A 112 ? 0.7329 0.6202 0.6662 0.0551 -0.0125 0.0500 190 THR A CB 757 O OG1 . THR A 112 ? 0.7683 0.6633 0.7064 0.0601 -0.0122 0.0561 190 THR A OG1 758 C CG2 . THR A 112 ? 0.5982 0.4772 0.5258 0.0566 -0.0072 0.0478 190 THR A CG2 759 N N . VAL A 113 ? 0.7319 0.6230 0.6684 0.0460 -0.0162 0.0418 191 VAL A N 760 C CA . VAL A 113 ? 0.7333 0.6204 0.6654 0.0431 -0.0157 0.0370 191 VAL A CA 761 C C . VAL A 113 ? 0.7704 0.6541 0.6983 0.0453 -0.0113 0.0364 191 VAL A C 762 O O . VAL A 113 ? 0.8126 0.7006 0.7439 0.0480 -0.0104 0.0394 191 VAL A O 763 C CB . VAL A 113 ? 0.6035 0.4965 0.5403 0.0402 -0.0194 0.0362 191 VAL A CB 764 C CG1 . VAL A 113 ? 0.6267 0.5178 0.5594 0.0381 -0.0188 0.0320 191 VAL A CG1 765 C CG2 . VAL A 113 ? 0.5827 0.4775 0.5223 0.0375 -0.0230 0.0359 191 VAL A CG2 766 N N . LEU A 114 ? 0.6674 0.5431 0.5875 0.0439 -0.0084 0.0322 192 LEU A N 767 C CA . LEU A 114 ? 0.6095 0.4807 0.5239 0.0449 -0.0040 0.0304 192 LEU A CA 768 C C . LEU A 114 ? 0.7942 0.6684 0.7067 0.0411 -0.0055 0.0262 192 LEU A C 769 O O . LEU A 114 ? 0.7916 0.6651 0.7018 0.0370 -0.0071 0.0223 192 LEU A O 770 C CB . LEU A 114 ? 0.5682 0.4279 0.4741 0.0450 0.0009 0.0280 192 LEU A CB 771 C CG . LEU A 114 ? 0.7130 0.5687 0.6193 0.0502 0.0035 0.0327 192 LEU A CG 772 C CD1 . LEU A 114 ? 0.6656 0.5203 0.5728 0.0490 0.0010 0.0334 192 LEU A CD1 773 C CD2 . LEU A 114 ? 0.5790 0.4230 0.4765 0.0524 0.0107 0.0313 192 LEU A CD2 774 N N . SER A 115 ? 0.7971 0.6756 0.7104 0.0425 -0.0047 0.0272 193 SER A N 775 C CA . SER A 115 ? 0.7252 0.6085 0.6371 0.0397 -0.0065 0.0242 193 SER A CA 776 C C . SER A 115 ? 0.6973 0.5796 0.6031 0.0400 -0.0030 0.0223 193 SER A C 777 O O . SER A 115 ? 0.6703 0.5527 0.5769 0.0437 -0.0005 0.0254 193 SER A O 778 C CB . SER A 115 ? 0.6398 0.5318 0.5595 0.0402 -0.0107 0.0275 193 SER A CB 779 O OG . SER A 115 ? 0.8468 0.7436 0.7649 0.0383 -0.0123 0.0251 193 SER A OG 780 N N . VAL A 116 ? 0.6536 0.5358 0.5533 0.0359 -0.0029 0.0170 194 VAL A N 781 C CA . VAL A 116 ? 0.7583 0.6413 0.6514 0.0350 -0.0003 0.0141 194 VAL A CA 782 C C . VAL A 116 ? 0.8210 0.7152 0.7176 0.0357 -0.0037 0.0160 194 VAL A C 783 O O . VAL A 116 ? 0.8046 0.7055 0.7032 0.0335 -0.0075 0.0148 194 VAL A O 784 C CB . VAL A 116 ? 0.7320 0.6115 0.6167 0.0293 0.0012 0.0072 194 VAL A CB 785 C CG1 . VAL A 116 ? 0.5936 0.4732 0.4703 0.0279 0.0043 0.0038 194 VAL A CG1 786 C CG2 . VAL A 116 ? 0.7224 0.5899 0.6034 0.0282 0.0046 0.0054 194 VAL A CG2 787 N N . ALA A 117 ? 0.8623 0.7583 0.7591 0.0391 -0.0019 0.0191 195 ALA A N 788 C CA . ALA A 117 ? 0.8020 0.7073 0.7011 0.0404 -0.0042 0.0216 195 ALA A CA 789 C C . ALA A 117 ? 0.8431 0.7488 0.7360 0.0417 -0.0006 0.0212 195 ALA A C 790 O O . ALA A 117 ? 0.8432 0.7414 0.7291 0.0410 0.0038 0.0181 195 ALA A O 791 C CB . ALA A 117 ? 0.6973 0.6059 0.6060 0.0436 -0.0064 0.0278 195 ALA A CB 792 N N . GLY A 118 ? 0.7637 0.6773 0.6585 0.0438 -0.0021 0.0246 196 GLY A N 793 C CA . GLY A 118 ? 0.5780 0.4930 0.4669 0.0453 0.0011 0.0247 196 GLY A CA 794 C C . GLY A 118 ? 0.6647 0.5787 0.5427 0.0413 0.0031 0.0180 196 GLY A C 795 O O . GLY A 118 ? 0.7014 0.6222 0.5769 0.0379 -0.0001 0.0148 196 GLY A O 796 N N . ASP A 119 ? 0.5862 0.4919 0.4576 0.0416 0.0085 0.0158 200 ASP A N 797 C CA . ASP A 119 ? 0.6852 0.5876 0.5449 0.0372 0.0115 0.0088 200 ASP A CA 798 C C . ASP A 119 ? 0.8833 0.7751 0.7396 0.0334 0.0136 0.0038 200 ASP A C 799 O O . ASP A 119 ? 0.8568 0.7415 0.7029 0.0295 0.0178 -0.0024 200 ASP A O 800 C CB . ASP A 119 ? 0.7889 0.6868 0.6420 0.0398 0.0172 0.0090 200 ASP A CB 801 C CG . ASP A 119 ? 1.0090 0.8953 0.8641 0.0439 0.0224 0.0114 200 ASP A CG 802 O OD1 . ASP A 119 ? 1.0095 0.8947 0.8737 0.0465 0.0206 0.0156 200 ASP A OD1 803 O OD2 . ASP A 119 ? 1.1238 1.0021 0.9707 0.0448 0.0285 0.0092 200 ASP A OD2 804 N N . GLY A 120 ? 0.7613 0.6515 0.6257 0.0345 0.0110 0.0064 201 GLY A N 805 C CA . GLY A 120 ? 0.7412 0.6219 0.6031 0.0313 0.0127 0.0026 201 GLY A CA 806 C C . GLY A 120 ? 0.7384 0.6074 0.6016 0.0355 0.0171 0.0054 201 GLY A C 807 O O . GLY A 120 ? 0.7641 0.6215 0.6208 0.0335 0.0215 0.0017 201 GLY A O 808 N N . PHE A 121 ? 0.6160 0.4880 0.4873 0.0413 0.0164 0.0122 202 PHE A N 809 C CA . PHE A 121 ? 0.6906 0.5545 0.5648 0.0458 0.0197 0.0159 202 PHE A CA 810 C C . PHE A 121 ? 0.7540 0.6212 0.6374 0.0461 0.0149 0.0190 202 PHE A C 811 O O . PHE A 121 ? 0.7012 0.5772 0.5898 0.0440 0.0094 0.0195 202 PHE A O 812 C CB . PHE A 121 ? 0.6938 0.5602 0.5718 0.0519 0.0223 0.0214 202 PHE A CB 813 C CG . PHE A 121 ? 0.6868 0.5653 0.5749 0.0536 0.0173 0.0267 202 PHE A CG 814 C CD1 . PHE A 121 ? 0.8398 0.7262 0.7269 0.0524 0.0153 0.0265 202 PHE A CD1 815 C CD2 . PHE A 121 ? 0.7582 0.6401 0.6563 0.0563 0.0148 0.0320 202 PHE A CD2 816 C CE1 . PHE A 121 ? 0.9328 0.8286 0.8286 0.0540 0.0114 0.0316 202 PHE A CE1 817 C CE2 . PHE A 121 ? 0.7528 0.6445 0.6596 0.0570 0.0107 0.0364 202 PHE A CE2 818 C CZ . PHE A 121 ? 0.7681 0.6660 0.6737 0.0559 0.0093 0.0363 202 PHE A CZ 819 N N . VAL A 122 ? 0.6614 0.5216 0.5463 0.0489 0.0171 0.0213 203 VAL A N 820 C CA . VAL A 122 ? 0.7251 0.5898 0.6186 0.0492 0.0123 0.0245 203 VAL A CA 821 C C . VAL A 122 ? 0.7884 0.6590 0.6910 0.0543 0.0113 0.0315 203 VAL A C 822 O O . VAL A 122 ? 0.7122 0.5803 0.6144 0.0591 0.0157 0.0345 203 VAL A O 823 C CB . VAL A 122 ? 0.7804 0.6365 0.6707 0.0472 0.0130 0.0222 203 VAL A CB 824 C CG1 . VAL A 122 ? 0.6833 0.5322 0.5634 0.0415 0.0155 0.0149 203 VAL A CG1 825 C CG2 . VAL A 122 ? 0.8457 0.6946 0.7359 0.0526 0.0173 0.0262 203 VAL A CG2 826 N N . SER A 123 ? 0.8180 0.6970 0.7288 0.0531 0.0058 0.0338 204 SER A N 827 C CA . SER A 123 ? 0.8654 0.7513 0.7856 0.0564 0.0041 0.0399 204 SER A CA 828 C C . SER A 123 ? 0.7421 0.6278 0.6661 0.0558 0.0012 0.0410 204 SER A C 829 O O . SER A 123 ? 0.7628 0.6483 0.6866 0.0518 -0.0023 0.0382 204 SER A O 830 C CB . SER A 123 ? 0.8547 0.7498 0.7808 0.0552 0.0006 0.0418 204 SER A CB 831 O OG . SER A 123 ? 1.0034 0.8984 0.9240 0.0527 0.0004 0.0380 204 SER A OG 832 N N . ILE A 124 ? 0.5911 0.4775 0.5184 0.0599 0.0027 0.0454 205 ILE A N 833 C CA . ILE A 124 ? 0.6827 0.5709 0.6141 0.0597 -0.0002 0.0473 205 ILE A CA 834 C C . ILE A 124 ? 0.7068 0.6066 0.6482 0.0588 -0.0047 0.0511 205 ILE A C 835 O O . ILE A 124 ? 0.6910 0.5974 0.6376 0.0618 -0.0036 0.0552 205 ILE A O 836 C CB . ILE A 124 ? 0.7450 0.6287 0.6744 0.0651 0.0039 0.0505 205 ILE A CB 837 C CG1 . ILE A 124 ? 0.8204 0.6906 0.7388 0.0657 0.0096 0.0465 205 ILE A CG1 838 C CG2 . ILE A 124 ? 0.6698 0.5556 0.6021 0.0649 0.0007 0.0524 205 ILE A CG2 839 C CD1 . ILE A 124 ? 0.7111 0.5734 0.6256 0.0708 0.0144 0.0491 205 ILE A CD1 840 N N . LEU A 125 ? 0.7404 0.6423 0.6842 0.0545 -0.0094 0.0494 206 LEU A N 841 C CA . LEU A 125 ? 0.7244 0.6356 0.6767 0.0527 -0.0134 0.0522 206 LEU A CA 842 C C . LEU A 125 ? 0.7114 0.6248 0.6659 0.0522 -0.0160 0.0536 206 LEU A C 843 O O . LEU A 125 ? 0.7979 0.7053 0.7477 0.0507 -0.0168 0.0507 206 LEU A O 844 C CB . LEU A 125 ? 0.6437 0.5556 0.5969 0.0483 -0.0163 0.0496 206 LEU A CB 845 C CG . LEU A 125 ? 0.8529 0.7652 0.8049 0.0489 -0.0144 0.0493 206 LEU A CG 846 C CD1 . LEU A 125 ? 0.8255 0.7309 0.7692 0.0483 -0.0128 0.0447 206 LEU A CD1 847 C CD2 . LEU A 125 ? 1.0161 0.9327 0.9729 0.0460 -0.0170 0.0502 206 LEU A CD2 848 N N . TYR A 126 ? 0.6472 0.5700 0.6088 0.0533 -0.0173 0.0581 207 TYR A N 849 C CA . TYR A 126 ? 0.5489 0.4763 0.5129 0.0530 -0.0201 0.0599 207 TYR A CA 850 C C . TYR A 126 ? 0.7443 0.6813 0.7157 0.0483 -0.0244 0.0608 207 TYR A C 851 O O . TYR A 126 ? 0.8351 0.7811 0.8131 0.0486 -0.0243 0.0641 207 TYR A O 852 C CB . TYR A 126 ? 0.5746 0.5059 0.5399 0.0593 -0.0173 0.0649 207 TYR A CB 853 C CG . TYR A 126 ? 0.6472 0.5826 0.6132 0.0602 -0.0196 0.0672 207 TYR A CG 854 C CD1 . TYR A 126 ? 0.5352 0.4610 0.4937 0.0605 -0.0191 0.0649 207 TYR A CD1 855 C CD2 . TYR A 126 ? 0.6281 0.5777 0.6019 0.0606 -0.0223 0.0716 207 TYR A CD2 856 C CE1 . TYR A 126 ? 0.7192 0.6487 0.6776 0.0618 -0.0210 0.0675 207 TYR A CE1 857 C CE2 . TYR A 126 ? 0.7491 0.7038 0.7231 0.0616 -0.0247 0.0740 207 TYR A CE2 858 C CZ . TYR A 126 ? 0.8196 0.7639 0.7856 0.0625 -0.0240 0.0721 207 TYR A CZ 859 O OH . TYR A 126 ? 0.7579 0.7074 0.7235 0.0638 -0.0263 0.0749 207 TYR A OH 860 N N . GLY A 127 ? 0.8029 0.7378 0.7729 0.0436 -0.0278 0.0577 208 GLY A N 861 C CA . GLY A 127 ? 0.8172 0.7566 0.7920 0.0381 -0.0309 0.0567 208 GLY A CA 862 C C . GLY A 127 ? 0.9986 0.9321 0.9715 0.0377 -0.0289 0.0546 208 GLY A C 863 O O . GLY A 127 ? 1.2619 1.1871 1.2288 0.0386 -0.0277 0.0515 208 GLY A O 864 N N . GLY A 128 ? 0.8128 0.7510 0.7907 0.0367 -0.0282 0.0566 209 GLY A N 865 C CA . GLY A 128 ? 0.8767 0.8101 0.8523 0.0377 -0.0258 0.0556 209 GLY A CA 866 C C . GLY A 128 ? 0.8401 0.7779 0.8182 0.0414 -0.0225 0.0592 209 GLY A C 867 O O . GLY A 128 ? 0.9347 0.8735 0.9148 0.0405 -0.0213 0.0603 209 GLY A O 868 N N . ILE A 129 ? 0.8414 0.7814 0.8193 0.0457 -0.0207 0.0614 210 ILE A N 869 C CA . ILE A 129 ? 0.9281 0.8730 0.9088 0.0497 -0.0173 0.0652 210 ILE A CA 870 C C . ILE A 129 ? 0.8868 0.8246 0.8606 0.0548 -0.0134 0.0643 210 ILE A C 871 O O . ILE A 129 ? 0.7955 0.7280 0.7647 0.0561 -0.0134 0.0628 210 ILE A O 872 C CB . ILE A 129 ? 0.9314 0.8880 0.9197 0.0504 -0.0182 0.0696 210 ILE A CB 873 C CG1 . ILE A 129 ? 0.8678 0.8310 0.8624 0.0439 -0.0217 0.0696 210 ILE A CG1 874 C CG2 . ILE A 129 ? 1.0618 1.0242 1.0533 0.0553 -0.0141 0.0738 210 ILE A CG2 875 C CD1 . ILE A 129 ? 1.0677 1.0371 1.0650 0.0415 -0.0254 0.0699 210 ILE A CD1 876 N N . ILE A 130 ? 0.8944 0.8310 0.8664 0.0573 -0.0097 0.0651 211 ILE A N 877 C CA . ILE A 130 ? 0.8569 0.7860 0.8216 0.0618 -0.0053 0.0638 211 ILE A CA 878 C C . ILE A 130 ? 0.7551 0.6876 0.7221 0.0669 -0.0030 0.0678 211 ILE A C 879 O O . ILE A 130 ? 0.9524 0.8951 0.9270 0.0686 -0.0027 0.0724 211 ILE A O 880 C CB . ILE A 130 ? 0.8352 0.7629 0.7971 0.0633 -0.0018 0.0637 211 ILE A CB 881 C CG1 . ILE A 130 ? 1.1324 1.0584 1.0925 0.0589 -0.0042 0.0608 211 ILE A CG1 882 C CG2 . ILE A 130 ? 0.6847 0.6031 0.6374 0.0666 0.0028 0.0611 211 ILE A CG2 883 C CD1 . ILE A 130 ? 1.3703 1.3025 1.3351 0.0586 -0.0035 0.0639 211 ILE A CD1 884 N N . THR A 131 ? 0.6486 0.5728 0.6092 0.0694 -0.0011 0.0662 212 THR A N 885 C CA . THR A 131 ? 0.8396 0.7659 0.8014 0.0753 0.0015 0.0705 212 THR A CA 886 C C . THR A 131 ? 0.9123 0.8279 0.8658 0.0803 0.0082 0.0696 212 THR A C 887 O O . THR A 131 ? 0.8226 0.7395 0.7769 0.0868 0.0123 0.0738 212 THR A O 888 C CB . THR A 131 ? 0.7770 0.7030 0.7386 0.0745 -0.0017 0.0707 212 THR A CB 889 O OG1 . THR A 131 ? 0.8409 0.7560 0.7950 0.0704 -0.0028 0.0650 212 THR A OG1 890 C CG2 . THR A 131 ? 0.6956 0.6348 0.6666 0.0706 -0.0074 0.0729 212 THR A CG2 891 N N . ASP A 132 ? 0.7706 0.6758 0.7158 0.0773 0.0095 0.0640 213 ASP A N 892 C CA . ASP A 132 ? 0.7754 0.6696 0.7115 0.0806 0.0161 0.0619 213 ASP A CA 893 C C . ASP A 132 ? 0.7724 0.6605 0.7017 0.0753 0.0156 0.0557 213 ASP A C 894 O O . ASP A 132 ? 0.7682 0.6585 0.6988 0.0699 0.0106 0.0530 213 ASP A O 895 C CB . ASP A 132 ? 0.8984 0.7819 0.8280 0.0838 0.0196 0.0617 213 ASP A CB 896 C CG . ASP A 132 ? 1.1588 1.0368 1.0847 0.0914 0.0273 0.0647 213 ASP A CG 897 O OD1 . ASP A 132 ? 1.2125 1.0878 1.1349 0.0922 0.0313 0.0631 213 ASP A OD1 898 O OD2 . ASP A 132 ? 1.1999 1.0763 1.1260 0.0970 0.0297 0.0688 213 ASP A OD2 899 N N . THR A 133 ? 0.7134 0.5948 0.6355 0.0770 0.0211 0.0536 214 THR A N 900 C CA . THR A 133 ? 0.7006 0.5753 0.6140 0.0723 0.0216 0.0472 214 THR A CA 901 C C . THR A 133 ? 0.7634 0.6239 0.6658 0.0740 0.0283 0.0438 214 THR A C 902 O O . THR A 133 ? 0.8506 0.7071 0.7523 0.0800 0.0335 0.0472 214 THR A O 903 C CB . THR A 133 ? 0.8477 0.7280 0.7613 0.0719 0.0221 0.0471 214 THR A CB 904 O OG1 . THR A 133 ? 0.8193 0.6995 0.7330 0.0778 0.0278 0.0507 214 THR A OG1 905 C CG2 . THR A 133 ? 0.6124 0.5047 0.5356 0.0695 0.0161 0.0500 214 THR A CG2 906 N N . ILE A 134 ? 0.7848 0.6378 0.6785 0.0686 0.0286 0.0372 215 ILE A N 907 C CA . ILE A 134 ? 0.7340 0.5722 0.6158 0.0685 0.0355 0.0328 215 ILE A CA 908 C C . ILE A 134 ? 0.7727 0.6098 0.6468 0.0633 0.0362 0.0265 215 ILE A C 909 O O . ILE A 134 ? 0.8010 0.6455 0.6770 0.0581 0.0305 0.0240 215 ILE A O 910 C CB . ILE A 134 ? 0.7398 0.5692 0.6178 0.0658 0.0353 0.0302 215 ILE A CB 911 C CG1 . ILE A 134 ? 0.6579 0.4884 0.5423 0.0716 0.0351 0.0367 215 ILE A CG1 912 C CG2 . ILE A 134 ? 0.5376 0.3504 0.4021 0.0638 0.0427 0.0244 215 ILE A CG2 913 C CD1 . ILE A 134 ? 0.6507 0.4798 0.5361 0.0684 0.0313 0.0359 215 ILE A CD1 914 N N . HIS A 135 ? 0.8238 0.6522 0.6889 0.0649 0.0431 0.0241 216 HIS A N 915 C CA . HIS A 135 ? 0.8125 0.6412 0.6695 0.0597 0.0437 0.0181 216 HIS A CA 916 C C . HIS A 135 ? 0.8935 0.7075 0.7369 0.0549 0.0492 0.0105 216 HIS A C 917 O O . HIS A 135 ? 0.9867 0.7869 0.8245 0.0580 0.0560 0.0105 216 HIS A O 918 C CB . HIS A 135 ? 0.7553 0.5885 0.6125 0.0639 0.0466 0.0208 216 HIS A CB 919 C CG . HIS A 135 ? 0.8972 0.7452 0.7669 0.0668 0.0412 0.0273 216 HIS A CG 920 N ND1 . HIS A 135 ? 0.9394 0.7917 0.8192 0.0723 0.0406 0.0342 216 HIS A ND1 921 C CD2 . HIS A 135 ? 1.0622 0.9219 0.9359 0.0646 0.0363 0.0281 216 HIS A CD2 922 C CE1 . HIS A 135 ? 1.0798 0.9451 0.9690 0.0726 0.0357 0.0384 216 HIS A CE1 923 N NE2 . HIS A 135 ? 1.2375 1.1066 1.1231 0.0683 0.0333 0.0350 216 HIS A NE2 924 N N . PRO A 136 ? 0.9158 0.7330 0.7537 0.0473 0.0465 0.0040 217 PRO A N 925 C CA . PRO A 136 ? 0.8761 0.6803 0.7007 0.0411 0.0517 -0.0041 217 PRO A CA 926 C C . PRO A 136 ? 0.8308 0.6224 0.6451 0.0440 0.0609 -0.0059 217 PRO A C 927 O O . PRO A 136 ? 0.8492 0.6457 0.6657 0.0491 0.0623 -0.0023 217 PRO A O 928 C CB . PRO A 136 ? 0.7260 0.5414 0.5484 0.0332 0.0464 -0.0096 217 PRO A CB 929 C CG . PRO A 136 ? 0.8139 0.6454 0.6458 0.0371 0.0407 -0.0040 217 PRO A CG 930 C CD . PRO A 136 ? 0.8466 0.6797 0.6901 0.0440 0.0390 0.0040 217 PRO A CD 931 N N . THR A 137 ? 0.8495 0.6244 0.6522 0.0403 0.0677 -0.0118 218 THR A N 932 C CA . THR A 137 ? 0.7443 0.5026 0.5359 0.0433 0.0780 -0.0137 218 THR A CA 933 C C . THR A 137 ? 0.8384 0.5852 0.6148 0.0335 0.0826 -0.0242 218 THR A C 934 O O . THR A 137 ? 0.7526 0.4891 0.5176 0.0329 0.0900 -0.0284 218 THR A O 935 C CB . THR A 137 ? 0.8329 0.5785 0.6264 0.0512 0.0834 -0.0081 218 THR A CB 936 O OG1 . THR A 137 ? 0.8037 0.5591 0.6084 0.0608 0.0818 0.0010 218 THR A OG1 937 C CG2 . THR A 137 ? 1.0813 0.8036 0.8598 0.0518 0.0954 -0.0123 218 THR A CG2 938 N N . ASN A 138 ? 0.8717 0.6204 0.6478 0.0255 0.0785 -0.0287 219 ASN A N 939 C CA . ASN A 138 ? 0.8605 0.6013 0.6233 0.0145 0.0817 -0.0391 219 ASN A CA 940 C C . ASN A 138 ? 0.9319 0.6924 0.6968 0.0069 0.0735 -0.0432 219 ASN A C 941 O O . ASN A 138 ? 1.0705 0.8317 0.8293 -0.0032 0.0725 -0.0508 219 ASN A O 942 C CB . ASN A 138 ? 0.9724 0.7009 0.7320 0.0099 0.0841 -0.0419 219 ASN A CB 943 C CG . ASN A 138 ? 1.4029 1.1068 1.1528 0.0138 0.0954 -0.0419 219 ASN A CG 944 O OD1 . ASN A 138 ? 1.4332 1.1310 1.1832 0.0232 0.1004 -0.0367 219 ASN A OD1 945 N ND2 . ASN A 138 ? 1.6532 1.3424 1.3944 0.0068 0.1000 -0.0476 219 ASN A ND2 946 N N . GLY A 139 ? 0.8795 0.6565 0.6533 0.0119 0.0676 -0.0378 220 GLY A N 947 C CA . GLY A 139 ? 0.9266 0.7215 0.7008 0.0061 0.0609 -0.0411 220 GLY A CA 948 C C . GLY A 139 ? 0.9404 0.7541 0.7278 0.0061 0.0507 -0.0370 220 GLY A C 949 O O . GLY A 139 ? 0.9292 0.7591 0.7178 0.0028 0.0451 -0.0383 220 GLY A O 950 N N . GLY A 140 ? 0.7989 0.6108 0.5957 0.0099 0.0484 -0.0319 221 GLY A N 951 C CA . GLY A 140 ? 0.7216 0.5496 0.5311 0.0109 0.0395 -0.0274 221 GLY A CA 952 C C . GLY A 140 ? 0.7158 0.5547 0.5246 0.0023 0.0343 -0.0329 221 GLY A C 953 O O . GLY A 140 ? 0.7517 0.5864 0.5500 -0.0059 0.0374 -0.0410 221 GLY A O 954 N N . PRO A 141 ? 0.7719 0.6244 0.5920 0.0038 0.0268 -0.0287 222 PRO A N 955 C CA . PRO A 141 ? 0.8054 0.6595 0.6370 0.0121 0.0241 -0.0200 222 PRO A CA 956 C C . PRO A 141 ? 0.6764 0.5181 0.5098 0.0132 0.0265 -0.0189 222 PRO A C 957 O O . PRO A 141 ? 0.7445 0.5790 0.5719 0.0070 0.0288 -0.0244 222 PRO A O 958 C CB . PRO A 141 ? 0.7067 0.5782 0.5475 0.0118 0.0160 -0.0176 222 PRO A CB 959 C CG . PRO A 141 ? 0.7707 0.6460 0.6067 0.0032 0.0147 -0.0248 222 PRO A CG 960 C CD . PRO A 141 ? 0.7114 0.5769 0.5338 -0.0026 0.0211 -0.0323 222 PRO A CD 961 N N . LEU A 142 ? 0.7130 0.5527 0.5541 0.0206 0.0262 -0.0117 223 LEU A N 962 C CA . LEU A 142 ? 0.7432 0.5739 0.5870 0.0223 0.0273 -0.0095 223 LEU A CA 963 C C . LEU A 142 ? 0.7691 0.6079 0.6188 0.0183 0.0212 -0.0103 223 LEU A C 964 O O . LEU A 142 ? 0.7618 0.6147 0.6173 0.0174 0.0154 -0.0096 223 LEU A O 965 C CB . LEU A 142 ? 0.6065 0.4360 0.4577 0.0309 0.0278 -0.0015 223 LEU A CB 966 C CG . LEU A 142 ? 0.8105 0.6310 0.6557 0.0354 0.0349 -0.0006 223 LEU A CG 967 C CD1 . LEU A 142 ? 0.5353 0.3553 0.3881 0.0440 0.0359 0.0074 223 LEU A CD1 968 C CD2 . LEU A 142 ? 0.6585 0.4620 0.4906 0.0317 0.0426 -0.0068 223 LEU A CD2 969 N N . ARG A 143 ? 0.7526 0.5822 0.6002 0.0162 0.0232 -0.0118 224 ARG A N 970 C CA . ARG A 143 ? 0.8241 0.6603 0.6770 0.0128 0.0181 -0.0125 224 ARG A CA 971 C C . ARG A 143 ? 0.8374 0.6671 0.6946 0.0167 0.0183 -0.0079 224 ARG A C 972 O O . ARG A 143 ? 0.8969 0.7124 0.7480 0.0176 0.0240 -0.0081 224 ARG A O 973 C CB . ARG A 143 ? 0.7764 0.6097 0.6214 0.0039 0.0201 -0.0204 224 ARG A CB 974 C CG . ARG A 143 ? 0.7308 0.5752 0.5727 -0.0013 0.0181 -0.0254 224 ARG A CG 975 C CD . ARG A 143 ? 0.5425 0.3786 0.3729 -0.0102 0.0232 -0.0340 224 ARG A CD 976 N NE . ARG A 143 ? 0.8787 0.7054 0.6999 -0.0099 0.0292 -0.0363 224 ARG A NE 977 C CZ . ARG A 143 ? 0.9123 0.7217 0.7225 -0.0134 0.0370 -0.0409 224 ARG A CZ 978 N NH1 . ARG A 143 ? 0.8077 0.6070 0.6143 -0.0181 0.0400 -0.0439 224 ARG A NH1 979 N NH2 . ARG A 143 ? 1.0341 0.8357 0.8361 -0.0124 0.0423 -0.0426 224 ARG A NH2 980 N N . THR A 144 ? 0.7105 0.5500 0.5775 0.0191 0.0123 -0.0036 225 THR A N 981 C CA . THR A 144 ? 0.6560 0.4918 0.5272 0.0218 0.0114 0.0002 225 THR A CA 982 C C . THR A 144 ? 0.6879 0.5189 0.5549 0.0158 0.0121 -0.0043 225 THR A C 983 O O . THR A 144 ? 0.8915 0.7245 0.7542 0.0095 0.0125 -0.0102 225 THR A O 984 C CB . THR A 144 ? 0.6767 0.5244 0.5586 0.0246 0.0049 0.0049 225 THR A CB 985 O OG1 . THR A 144 ? 0.6839 0.5408 0.5682 0.0200 0.0005 0.0017 225 THR A OG1 986 C CG2 . THR A 144 ? 0.5490 0.4028 0.4354 0.0295 0.0040 0.0091 225 THR A CG2 987 N N . GLN A 145 ? 0.8459 0.6717 0.7144 0.0176 0.0122 -0.0015 226 GLN A N 988 C CA . GLN A 145 ? 0.8419 0.6620 0.7060 0.0122 0.0136 -0.0054 226 GLN A CA 989 C C . GLN A 145 ? 0.7570 0.5895 0.6276 0.0086 0.0075 -0.0069 226 GLN A C 990 O O . GLN A 145 ? 0.6707 0.5008 0.5386 0.0037 0.0081 -0.0103 226 GLN A O 991 C CB . GLN A 145 ? 0.6650 0.4739 0.5270 0.0158 0.0168 -0.0016 226 GLN A CB 992 C CG . GLN A 145 ? 0.7213 0.5366 0.5917 0.0224 0.0126 0.0055 226 GLN A CG 993 C CD . GLN A 145 ? 0.7626 0.5682 0.6303 0.0264 0.0157 0.0097 226 GLN A CD 994 O OE1 . GLN A 145 ? 0.8234 0.6267 0.6921 0.0331 0.0175 0.0149 226 GLN A OE1 995 N NE2 . GLN A 145 ? 0.8011 0.6013 0.6652 0.0227 0.0166 0.0076 226 GLN A NE2 996 N N . ALA A 146 ? 0.5889 0.4337 0.4674 0.0113 0.0023 -0.0042 227 ALA A N 997 C CA . ALA A 146 ? 0.6505 0.5070 0.5348 0.0089 -0.0029 -0.0054 227 ALA A CA 998 C C . ALA A 146 ? 0.6518 0.5062 0.5379 0.0079 -0.0042 -0.0047 227 ALA A C 999 O O . ALA A 146 ? 0.6794 0.5377 0.5656 0.0033 -0.0053 -0.0083 227 ALA A O 1000 C CB . ALA A 146 ? 0.4762 0.3386 0.3570 0.0027 -0.0027 -0.0115 227 ALA A CB 1001 N N . SER A 147 ? 0.6849 0.5342 0.5728 0.0125 -0.0041 0.0002 228 SER A N 1002 C CA . SER A 147 ? 0.7561 0.6008 0.6436 0.0123 -0.0042 0.0013 228 SER A CA 1003 C C . SER A 147 ? 0.7221 0.5653 0.6128 0.0183 -0.0051 0.0076 228 SER A C 1004 O O . SER A 147 ? 0.6688 0.5135 0.5615 0.0222 -0.0048 0.0105 228 SER A O 1005 C CB . SER A 147 ? 0.7391 0.5714 0.6175 0.0089 0.0016 -0.0018 228 SER A CB 1006 O OG . SER A 147 ? 0.8977 0.7260 0.7753 0.0086 0.0015 -0.0005 228 SER A OG 1007 N N . SER A 148 ? 0.6524 0.4937 0.5436 0.0189 -0.0062 0.0096 229 SER A N 1008 C CA . SER A 148 ? 0.5430 0.3847 0.4371 0.0242 -0.0073 0.0155 229 SER A CA 1009 C C . SER A 148 ? 0.6890 0.5210 0.5776 0.0280 -0.0019 0.0180 229 SER A C 1010 O O . SER A 148 ? 0.7008 0.5222 0.5816 0.0260 0.0030 0.0153 229 SER A O 1011 C CB . SER A 148 ? 0.6863 0.5280 0.5807 0.0236 -0.0094 0.0168 229 SER A CB 1012 O OG . SER A 148 ? 0.6939 0.5376 0.5909 0.0284 -0.0107 0.0225 229 SER A OG 1013 N N . CYS A 149 ? 0.5920 0.4274 0.4844 0.0335 -0.0024 0.0229 230 CYS A N 1014 C CA . CYS A 149 ? 0.6025 0.4294 0.4903 0.0386 0.0028 0.0266 230 CYS A CA 1015 C C . CYS A 149 ? 0.7949 0.6217 0.6831 0.0420 0.0017 0.0315 230 CYS A C 1016 O O . CYS A 149 ? 0.8048 0.6383 0.6967 0.0396 -0.0031 0.0314 230 CYS A O 1017 C CB . CYS A 149 ? 0.6380 0.4682 0.5289 0.0431 0.0039 0.0294 230 CYS A CB 1018 S SG . CYS A 149 ? 0.7614 0.6081 0.6642 0.0448 -0.0027 0.0330 230 CYS A SG 1019 N N . ILE A 150 ? 0.8077 0.6269 0.6915 0.0475 0.0065 0.0358 231 ILE A N 1020 C CA . ILE A 150 ? 0.7154 0.5338 0.5978 0.0507 0.0061 0.0404 231 ILE A CA 1021 C C . ILE A 150 ? 0.8173 0.6435 0.7047 0.0582 0.0050 0.0478 231 ILE A C 1022 O O . ILE A 150 ? 0.7592 0.5806 0.6445 0.0640 0.0099 0.0512 231 ILE A O 1023 C CB . ILE A 150 ? 0.7807 0.5827 0.6524 0.0514 0.0130 0.0401 231 ILE A CB 1024 C CG1 . ILE A 150 ? 0.8253 0.6199 0.6917 0.0432 0.0146 0.0325 231 ILE A CG1 1025 C CG2 . ILE A 150 ? 0.7506 0.5532 0.6210 0.0553 0.0122 0.0456 231 ILE A CG2 1026 C CD1 . ILE A 150 ? 0.7368 0.5374 0.6054 0.0383 0.0097 0.0304 231 ILE A CD1 1027 N N . CYS A 151 ? 0.8426 0.6814 0.7366 0.0579 -0.0012 0.0504 232 CYS A N 1028 C CA . CYS A 151 ? 0.8535 0.7020 0.7525 0.0643 -0.0028 0.0575 232 CYS A CA 1029 C C . CYS A 151 ? 0.8613 0.7087 0.7563 0.0674 -0.0027 0.0619 232 CYS A C 1030 O O . CYS A 151 ? 0.9557 0.8026 0.8485 0.0629 -0.0054 0.0594 232 CYS A O 1031 C CB . CYS A 151 ? 0.8965 0.7613 0.8057 0.0619 -0.0096 0.0579 232 CYS A CB 1032 S SG . CYS A 151 ? 0.9488 0.8165 0.8632 0.0601 -0.0094 0.0548 232 CYS A SG 1033 N N . ASN A 152 ? 0.7947 0.6419 0.6886 0.0756 0.0007 0.0687 233 ASN A N 1034 C CA . ASN A 152 ? 0.7670 0.6156 0.6576 0.0799 0.0004 0.0742 233 ASN A CA 1035 C C . ASN A 152 ? 0.8339 0.6929 0.7291 0.0890 0.0008 0.0828 233 ASN A C 1036 O O . ASN A 152 ? 0.8676 0.7215 0.7620 0.0950 0.0063 0.0855 233 ASN A O 1037 C CB . ASN A 152 ? 0.7676 0.5972 0.6467 0.0807 0.0073 0.0734 233 ASN A CB 1038 C CG . ASN A 152 ? 0.8852 0.7156 0.7600 0.0843 0.0068 0.0787 233 ASN A CG 1039 O OD1 . ASN A 152 ? 0.9547 0.7975 0.8334 0.0813 0.0001 0.0791 233 ASN A OD1 1040 N ND2 . ASN A 152 ? 1.0220 0.8388 0.8882 0.0907 0.0141 0.0830 233 ASN A ND2 1041 N N . ASP A 153 ? 0.8211 0.6956 0.7211 0.0897 -0.0051 0.0869 234 ASP A N 1042 C CA . ASP A 153 ? 0.8600 0.7492 0.7656 0.0978 -0.0062 0.0954 234 ASP A CA 1043 C C . ASP A 153 ? 0.8234 0.7203 0.7372 0.1004 -0.0054 0.0966 234 ASP A C 1044 O O . ASP A 153 ? 0.8466 0.7453 0.7612 0.1094 -0.0012 0.1031 234 ASP A O 1045 C CB . ASP A 153 ? 0.9587 0.8392 0.8564 0.1073 -0.0001 0.1025 234 ASP A CB 1046 C CG . ASP A 153 ? 1.1803 1.0795 1.0828 0.1142 -0.0037 0.1114 234 ASP A CG 1047 O OD1 . ASP A 153 ? 1.1450 1.0621 1.0543 0.1092 -0.0118 0.1108 234 ASP A OD1 1048 O OD2 . ASP A 153 ? 1.3299 1.2259 1.2288 0.1246 0.0017 0.1191 234 ASP A OD2 1049 N N . GLY A 154 ? 0.8475 0.7487 0.7670 0.0930 -0.0091 0.0907 235 GLY A N 1050 C CA . GLY A 154 ? 0.7478 0.6579 0.6754 0.0947 -0.0090 0.0919 235 GLY A CA 1051 C C . GLY A 154 ? 0.8980 0.7940 0.8221 0.0952 -0.0028 0.0882 235 GLY A C 1052 O O . GLY A 154 ? 0.9513 0.8535 0.8817 0.0938 -0.0036 0.0870 235 GLY A O 1053 N N . THR A 155 ? 0.7304 0.6075 0.6441 0.0967 0.0034 0.0863 236 THR A N 1054 C CA . THR A 155 ? 0.6915 0.5545 0.6004 0.0963 0.0095 0.0821 236 THR A CA 1055 C C . THR A 155 ? 0.6674 0.5202 0.5714 0.0870 0.0086 0.0733 236 THR A C 1056 O O . THR A 155 ? 0.6112 0.4581 0.5102 0.0836 0.0076 0.0711 236 THR A O 1057 C CB . THR A 155 ? 0.6812 0.5281 0.5807 0.1042 0.0187 0.0855 236 THR A CB 1058 O OG1 . THR A 155 ? 0.7556 0.6122 0.6596 0.1142 0.0202 0.0943 236 THR A OG1 1059 C CG2 . THR A 155 ? 0.7105 0.5432 0.6046 0.1028 0.0249 0.0803 236 THR A CG2 1060 N N . CYS A 156 ? 0.7298 0.5811 0.6353 0.0833 0.0091 0.0685 237 CYS A N 1061 C CA . CYS A 156 ? 0.7699 0.6120 0.6703 0.0754 0.0091 0.0605 237 CYS A CA 1062 C C . CYS A 156 ? 0.6729 0.4982 0.5639 0.0761 0.0170 0.0573 237 CYS A C 1063 O O . CYS A 156 ? 0.7148 0.5371 0.6049 0.0819 0.0220 0.0600 237 CYS A O 1064 C CB . CYS A 156 ? 0.7448 0.5976 0.6527 0.0697 0.0034 0.0569 237 CYS A CB 1065 S SG . CYS A 156 ? 1.0588 0.9299 0.9769 0.0683 -0.0050 0.0605 237 CYS A SG 1066 N N . TYR A 157 ? 0.7293 0.5436 0.6131 0.0701 0.0186 0.0513 238 TYR A N 1067 C CA . TYR A 157 ? 0.7016 0.4995 0.5755 0.0690 0.0262 0.0471 238 TYR A CA 1068 C C . TYR A 157 ? 0.6822 0.4801 0.5551 0.0601 0.0241 0.0390 238 TYR A C 1069 O O . TYR A 157 ? 0.7829 0.5871 0.6589 0.0545 0.0187 0.0361 238 TYR A O 1070 C CB . TYR A 157 ? 0.6463 0.4288 0.5105 0.0703 0.0319 0.0479 238 TYR A CB 1071 C CG . TYR A 157 ? 0.7253 0.5092 0.5905 0.0797 0.0335 0.0566 238 TYR A CG 1072 C CD1 . TYR A 157 ? 0.7556 0.5333 0.6182 0.0880 0.0402 0.0612 238 TYR A CD1 1073 C CD2 . TYR A 157 ? 0.7687 0.5610 0.6374 0.0806 0.0285 0.0606 238 TYR A CD2 1074 C CE1 . TYR A 157 ? 0.9372 0.7178 0.8011 0.0976 0.0417 0.0700 238 TYR A CE1 1075 C CE2 . TYR A 157 ? 0.8814 0.6772 0.7511 0.0895 0.0296 0.0691 238 TYR A CE2 1076 C CZ . TYR A 157 ? 1.0034 0.7938 0.8710 0.0982 0.0362 0.0740 238 TYR A CZ 1077 O OH . TYR A 157 ? 1.0583 0.8536 0.9274 0.1079 0.0374 0.0831 238 TYR A OH 1078 N N . THR A 158 ? 0.6882 0.4796 0.5566 0.0591 0.0286 0.0354 239 THR A N 1079 C CA . THR A 158 ? 0.8231 0.6166 0.6906 0.0511 0.0265 0.0280 239 THR A CA 1080 C C . THR A 158 ? 0.8308 0.6106 0.6881 0.0491 0.0340 0.0232 239 THR A C 1081 O O . THR A 158 ? 0.8089 0.5778 0.6608 0.0547 0.0408 0.0259 239 THR A O 1082 C CB . THR A 158 ? 0.8068 0.6165 0.6842 0.0508 0.0201 0.0288 239 THR A CB 1083 O OG1 . THR A 158 ? 0.6282 0.4427 0.5062 0.0434 0.0163 0.0228 239 THR A OG1 1084 C CG2 . THR A 158 ? 0.7264 0.5363 0.6039 0.0552 0.0235 0.0304 239 THR A CG2 1085 N N . ILE A 159 ? 0.8154 0.5954 0.6696 0.0411 0.0331 0.0159 240 ILE A N 1086 C CA . ILE A 159 ? 0.8179 0.5854 0.6616 0.0376 0.0400 0.0102 240 ILE A CA 1087 C C . ILE A 159 ? 0.6775 0.4550 0.5232 0.0331 0.0369 0.0056 240 ILE A C 1088 O O . ILE A 159 ? 0.7577 0.5474 0.6090 0.0286 0.0304 0.0034 240 ILE A O 1089 C CB . ILE A 159 ? 0.7542 0.5090 0.5888 0.0309 0.0441 0.0049 240 ILE A CB 1090 C CG1 . ILE A 159 ? 0.6181 0.3608 0.4491 0.0364 0.0486 0.0102 240 ILE A CG1 1091 C CG2 . ILE A 159 ? 0.7657 0.5087 0.5893 0.0255 0.0510 -0.0022 240 ILE A CG2 1092 C CD1 . ILE A 159 ? 0.6714 0.4068 0.4975 0.0303 0.0496 0.0071 240 ILE A CD1 1093 N N . ILE A 160 ? 0.8214 0.5937 0.6621 0.0349 0.0417 0.0044 241 ILE A N 1094 C CA . ILE A 160 ? 0.7369 0.5192 0.5789 0.0317 0.0390 0.0009 241 ILE A CA 1095 C C . ILE A 160 ? 0.6971 0.4685 0.5269 0.0258 0.0453 -0.0067 241 ILE A C 1096 O O . ILE A 160 ? 0.7762 0.5315 0.5971 0.0278 0.0535 -0.0073 241 ILE A O 1097 C CB . ILE A 160 ? 0.6514 0.4421 0.5004 0.0391 0.0376 0.0067 241 ILE A CB 1098 C CG1 . ILE A 160 ? 0.6682 0.4712 0.5293 0.0431 0.0308 0.0133 241 ILE A CG1 1099 C CG2 . ILE A 160 ? 0.6168 0.4168 0.4659 0.0360 0.0353 0.0034 241 ILE A CG2 1100 C CD1 . ILE A 160 ? 0.6483 0.4605 0.5169 0.0496 0.0294 0.0192 241 ILE A CD1 1101 N N . ALA A 161 ? 0.6498 0.4303 0.4790 0.0184 0.0417 -0.0126 242 ALA A N 1102 C CA . ALA A 161 ? 0.7540 0.5267 0.5716 0.0113 0.0469 -0.0206 242 ALA A CA 1103 C C . ALA A 161 ? 0.7032 0.4834 0.5197 0.0119 0.0465 -0.0219 242 ALA A C 1104 O O . ALA A 161 ? 0.7668 0.5630 0.5922 0.0142 0.0398 -0.0187 242 ALA A O 1105 C CB . ALA A 161 ? 0.5750 0.3525 0.3909 0.0014 0.0441 -0.0272 242 ALA A CB 1106 N N . ASP A 162 ? 0.8058 0.5734 0.6106 0.0097 0.0540 -0.0266 243 ASP A N 1107 C CA . ASP A 162 ? 0.8349 0.6084 0.6361 0.0088 0.0544 -0.0294 243 ASP A CA 1108 C C . ASP A 162 ? 0.8802 0.6474 0.6687 -0.0018 0.0584 -0.0395 243 ASP A C 1109 O O . ASP A 162 ? 0.7925 0.5522 0.5767 -0.0081 0.0603 -0.0437 243 ASP A O 1110 C CB . ASP A 162 ? 0.7900 0.5541 0.5885 0.0173 0.0606 -0.0251 243 ASP A CB 1111 C CG . ASP A 162 ? 1.0430 0.8175 0.8415 0.0184 0.0591 -0.0253 243 ASP A CG 1112 O OD1 . ASP A 162 ? 1.2043 0.9904 1.0015 0.0117 0.0547 -0.0301 243 ASP A OD1 1113 O OD2 . ASP A 162 ? 0.9087 0.6802 0.7083 0.0262 0.0626 -0.0204 243 ASP A OD2 1114 N N . GLY A 163 ? 0.9060 0.6770 0.6884 -0.0043 0.0597 -0.0434 244 GLY A N 1115 C CA . GLY A 163 ? 0.8873 0.6547 0.6574 -0.0152 0.0630 -0.0535 244 GLY A CA 1116 C C . GLY A 163 ? 0.9232 0.7129 0.6975 -0.0216 0.0545 -0.0567 244 GLY A C 1117 O O . GLY A 163 ? 0.8453 0.6488 0.6306 -0.0206 0.0470 -0.0531 244 GLY A O 1118 N N . THR A 164 ? 1.0040 0.7974 0.7689 -0.0281 0.0560 -0.0636 245 THR A N 1119 C CA . THR A 164 ? 0.8667 0.6831 0.6351 -0.0330 0.0481 -0.0658 245 THR A CA 1120 C C . THR A 164 ? 0.8554 0.6777 0.6216 -0.0442 0.0461 -0.0731 245 THR A C 1121 O O . THR A 164 ? 0.9073 0.7506 0.6796 -0.0472 0.0385 -0.0734 245 THR A O 1122 C CB . THR A 164 ? 0.8801 0.7016 0.6402 -0.0344 0.0495 -0.0692 245 THR A CB 1123 O OG1 . THR A 164 ? 0.9618 0.7691 0.7061 -0.0436 0.0573 -0.0789 245 THR A OG1 1124 C CG2 . THR A 164 ? 0.6803 0.4965 0.4430 -0.0231 0.0518 -0.0617 245 THR A CG2 1125 N N . THR A 165 ? 0.8252 0.6290 0.5828 -0.0502 0.0532 -0.0785 246 THR A N 1126 C CA . THR A 165 ? 1.0021 0.8095 0.7578 -0.0613 0.0523 -0.0853 246 THR A CA 1127 C C . THR A 165 ? 0.9412 0.7307 0.6971 -0.0610 0.0569 -0.0840 246 THR A C 1128 O O . THR A 165 ? 1.0086 0.7776 0.7604 -0.0550 0.0638 -0.0810 246 THR A O 1129 C CB . THR A 165 ? 1.1777 0.9796 0.9181 -0.0738 0.0579 -0.0967 246 THR A CB 1130 O OG1 . THR A 165 ? 1.2575 1.0354 0.9862 -0.0716 0.0678 -0.0983 246 THR A OG1 1131 C CG2 . THR A 165 ? 1.3250 1.1504 1.0652 -0.0779 0.0517 -0.0998 246 THR A CG2 1132 N N . TYR A 166 ? 0.8721 0.6698 0.6323 -0.0675 0.0535 -0.0864 247 TYR A N 1133 C CA . TYR A 166 ? 0.7480 0.5312 0.5090 -0.0677 0.0570 -0.0850 247 TYR A CA 1134 C C . TYR A 166 ? 0.8717 0.6309 0.6174 -0.0757 0.0679 -0.0926 247 TYR A C 1135 O O . TYR A 166 ? 1.0291 0.7698 0.7721 -0.0744 0.0735 -0.0910 247 TYR A O 1136 C CB . TYR A 166 ? 0.7914 0.5926 0.5621 -0.0721 0.0498 -0.0853 247 TYR A CB 1137 C CG . TYR A 166 ? 1.2611 1.0818 1.0464 -0.0627 0.0404 -0.0769 247 TYR A CG 1138 C CD1 . TYR A 166 ? 1.3518 1.1660 1.1434 -0.0507 0.0398 -0.0679 247 TYR A CD1 1139 C CD2 . TYR A 166 ? 1.4429 1.2885 1.2354 -0.0657 0.0324 -0.0778 247 TYR A CD2 1140 C CE1 . TYR A 166 ? 1.3679 1.1985 1.1721 -0.0429 0.0319 -0.0607 247 TYR A CE1 1141 C CE2 . TYR A 166 ? 1.4648 1.3262 1.2699 -0.0568 0.0247 -0.0700 247 TYR A CE2 1142 C CZ . TYR A 166 ? 1.3552 1.2081 1.1657 -0.0458 0.0246 -0.0617 247 TYR A CZ 1143 O OH . TYR A 166 ? 1.1526 1.0194 0.9748 -0.0379 0.0177 -0.0545 247 TYR A OH 1144 N N . THR A 167 ? 0.7903 0.5493 0.5252 -0.0837 0.0711 -0.1007 248 THR A N 1145 C CA . THR A 167 ? 1.1299 0.8657 0.8484 -0.0926 0.0820 -0.1092 248 THR A CA 1146 C C . THR A 167 ? 1.1280 0.8401 0.8389 -0.0834 0.0906 -0.1056 248 THR A C 1147 O O . THR A 167 ? 1.0384 0.7254 0.7357 -0.0875 0.1015 -0.1105 248 THR A O 1148 C CB . THR A 167 ? 1.2425 0.9892 0.9518 -0.1058 0.0818 -0.1200 248 THR A CB 1149 O OG1 . THR A 167 ? 1.1334 0.8988 0.8472 -0.1005 0.0753 -0.1173 248 THR A OG1 1150 C CG2 . THR A 167 ? 0.9178 0.6824 0.6314 -0.1175 0.0765 -0.1255 248 THR A CG2 1151 N N . ALA A 168 ? 0.9334 0.6538 0.6530 -0.0711 0.0861 -0.0971 249 ALA A N 1152 C CA . ALA A 168 ? 0.9090 0.6109 0.6245 -0.0604 0.0931 -0.0920 249 ALA A CA 1153 C C . ALA A 168 ? 1.0423 0.7546 0.7731 -0.0466 0.0865 -0.0801 249 ALA A C 1154 O O . ALA A 168 ? 0.9491 0.6687 0.6836 -0.0390 0.0843 -0.0756 249 ALA A O 1155 C CB . ALA A 168 ? 0.9053 0.6055 0.6107 -0.0622 0.0968 -0.0969 249 ALA A CB 1156 N N . SER A 169 ? 1.0954 0.8089 0.8348 -0.0441 0.0834 -0.0752 250 SER A N 1157 C CA . SER A 169 ? 0.9070 0.6297 0.6606 -0.0322 0.0772 -0.0645 250 SER A CA 1158 C C . SER A 169 ? 0.9014 0.6036 0.6524 -0.0223 0.0847 -0.0582 250 SER A C 1159 O O . SER A 169 ? 0.9631 0.6433 0.7027 -0.0249 0.0941 -0.0614 250 SER A O 1160 C CB . SER A 169 ? 0.8858 0.6208 0.6495 -0.0346 0.0699 -0.0626 250 SER A CB 1161 O OG . SER A 169 ? 1.0520 0.7699 0.8101 -0.0380 0.0758 -0.0642 250 SER A OG 1162 N N . SER A 170 ? 0.8357 0.5455 0.5971 -0.0109 0.0808 -0.0490 251 SER A N 1163 C CA . SER A 170 ? 0.9139 0.6089 0.6752 -0.0001 0.0867 -0.0415 251 SER A CA 1164 C C . SER A 170 ? 0.8742 0.5808 0.6498 0.0068 0.0792 -0.0328 251 SER A C 1165 O O . SER A 170 ? 0.7338 0.4608 0.5204 0.0068 0.0698 -0.0307 251 SER A O 1166 C CB . SER A 170 ? 0.8138 0.5067 0.5733 0.0075 0.0904 -0.0388 251 SER A CB 1167 O OG . SER A 170 ? 0.7917 0.5058 0.5642 0.0130 0.0817 -0.0330 251 SER A OG 1168 N N . HIS A 171 ? 0.8737 0.5672 0.6485 0.0126 0.0836 -0.0277 252 HIS A N 1169 C CA . HIS A 171 ? 0.8191 0.5234 0.6062 0.0180 0.0766 -0.0202 252 HIS A CA 1170 C C . HIS A 171 ? 0.7815 0.4794 0.5716 0.0303 0.0799 -0.0108 252 HIS A C 1171 O O . HIS A 171 ? 0.9440 0.6226 0.7248 0.0342 0.0894 -0.0099 252 HIS A O 1172 C CB . HIS A 171 ? 0.7276 0.4295 0.5134 0.0105 0.0752 -0.0235 252 HIS A CB 1173 C CG . HIS A 171 ? 0.8284 0.5388 0.6119 -0.0014 0.0720 -0.0324 252 HIS A CG 1174 N ND1 . HIS A 171 ? 0.8645 0.5968 0.6586 -0.0041 0.0620 -0.0325 252 HIS A ND1 1175 C CD2 . HIS A 171 ? 0.8124 0.5133 0.5843 -0.0113 0.0775 -0.0415 252 HIS A CD2 1176 C CE1 . HIS A 171 ? 0.7297 0.4667 0.5192 -0.0145 0.0613 -0.0408 252 HIS A CE1 1177 N NE2 . HIS A 171 ? 0.7817 0.5006 0.5579 -0.0196 0.0703 -0.0466 252 HIS A NE2 1178 N N . ARG A 172 ? 0.7517 0.4664 0.5549 0.0364 0.0722 -0.0038 253 ARG A N 1179 C CA . ARG A 172 ? 0.7739 0.4880 0.5822 0.0481 0.0738 0.0054 253 ARG A CA 1180 C C . ARG A 172 ? 0.9086 0.6331 0.7271 0.0512 0.0670 0.0116 253 ARG A C 1181 O O . ARG A 172 ? 0.9877 0.7280 0.8147 0.0471 0.0582 0.0109 253 ARG A O 1182 C CB . ARG A 172 ? 0.6450 0.3703 0.4594 0.0535 0.0720 0.0086 253 ARG A CB 1183 C CG . ARG A 172 ? 0.6698 0.3808 0.4745 0.0571 0.0817 0.0073 253 ARG A CG 1184 C CD . ARG A 172 ? 0.7451 0.4690 0.5555 0.0602 0.0791 0.0089 253 ARG A CD 1185 N NE . ARG A 172 ? 0.8715 0.5824 0.6710 0.0611 0.0881 0.0053 253 ARG A NE 1186 C CZ . ARG A 172 ? 0.9279 0.6448 0.7302 0.0668 0.0893 0.0083 253 ARG A CZ 1187 N NH1 . ARG A 172 ? 0.8593 0.5949 0.6753 0.0717 0.0822 0.0149 253 ARG A NH1 1188 N NH2 . ARG A 172 ? 0.9744 0.6783 0.7656 0.0674 0.0980 0.0045 253 ARG A NH2 1189 N N . LEU A 173 ? 0.8790 0.5945 0.6960 0.0588 0.0714 0.0179 254 LEU A N 1190 C CA . LEU A 173 ? 0.8666 0.5905 0.6916 0.0625 0.0660 0.0242 254 LEU A CA 1191 C C . LEU A 173 ? 0.8497 0.5879 0.6855 0.0717 0.0623 0.0324 254 LEU A C 1192 O O . LEU A 173 ? 0.9138 0.6457 0.7473 0.0799 0.0686 0.0369 254 LEU A O 1193 C CB . LEU A 173 ? 0.9591 0.6647 0.7752 0.0664 0.0737 0.0271 254 LEU A CB 1194 C CG . LEU A 173 ? 1.0034 0.7100 0.8213 0.0667 0.0707 0.0306 254 LEU A CG 1195 C CD1 . LEU A 173 ? 1.2694 0.9661 1.0794 0.0562 0.0724 0.0226 254 LEU A CD1 1196 C CD2 . LEU A 173 ? 0.9717 0.6661 0.7848 0.0766 0.0777 0.0381 254 LEU A CD2 1197 N N . TYR A 174 ? 0.8566 0.6139 0.7041 0.0704 0.0528 0.0343 255 TYR A N 1198 C CA . TYR A 174 ? 0.7531 0.5253 0.6113 0.0776 0.0491 0.0415 255 TYR A CA 1199 C C . TYR A 174 ? 0.7647 0.5459 0.6301 0.0820 0.0445 0.0484 255 TYR A C 1200 O O . TYR A 174 ? 0.8193 0.6033 0.6859 0.0770 0.0397 0.0467 255 TYR A O 1201 C CB . TYR A 174 ? 0.6662 0.4540 0.5325 0.0731 0.0422 0.0389 255 TYR A CB 1202 C CG . TYR A 174 ? 0.7871 0.5709 0.6487 0.0723 0.0466 0.0352 255 TYR A CG 1203 C CD1 . TYR A 174 ? 0.7354 0.5111 0.5885 0.0645 0.0486 0.0269 255 TYR A CD1 1204 C CD2 . TYR A 174 ? 0.7511 0.5400 0.6168 0.0793 0.0487 0.0399 255 TYR A CD2 1205 C CE1 . TYR A 174 ? 0.8763 0.6488 0.7242 0.0635 0.0525 0.0232 255 TYR A CE1 1206 C CE2 . TYR A 174 ? 0.8975 0.6825 0.7582 0.0787 0.0530 0.0365 255 TYR A CE2 1207 C CZ . TYR A 174 ? 0.9758 0.7524 0.8273 0.0708 0.0549 0.0280 255 TYR A CZ 1208 O OH . TYR A 174 ? 0.9740 0.7471 0.8197 0.0700 0.0591 0.0244 255 TYR A OH 1209 N N . ARG A 175 ? 0.7923 0.5789 0.6624 0.0912 0.0460 0.0562 256 ARG A N 1210 C CA . ARG A 175 ? 0.8073 0.6075 0.6860 0.0950 0.0403 0.0629 256 ARG A CA 1211 C C . ARG A 175 ? 0.7970 0.6171 0.6881 0.0958 0.0341 0.0658 256 ARG A C 1212 O O . ARG A 175 ? 0.7930 0.6155 0.6862 0.0992 0.0369 0.0670 256 ARG A O 1213 C CB . ARG A 175 ? 0.8607 0.6546 0.7360 0.1047 0.0459 0.0704 256 ARG A CB 1214 C CG . ARG A 175 ? 0.7529 0.5536 0.6331 0.1148 0.0492 0.0776 256 ARG A CG 1215 C CD . ARG A 175 ? 0.7921 0.5893 0.6699 0.1251 0.0536 0.0861 256 ARG A CD 1216 N NE . ARG A 175 ? 0.6935 0.4666 0.5577 0.1284 0.0642 0.0850 256 ARG A NE 1217 C CZ . ARG A 175 ? 0.9477 0.7076 0.8035 0.1292 0.0675 0.0860 256 ARG A CZ 1218 N NH1 . ARG A 175 ? 1.1204 0.8902 0.9803 0.1273 0.0607 0.0883 256 ARG A NH1 1219 N NH2 . ARG A 175 ? 0.9683 0.7047 0.8112 0.1318 0.0781 0.0847 256 ARG A NH2 1220 N N . LEU A 176 ? 0.7469 0.5807 0.6459 0.0922 0.0259 0.0666 257 LEU A N 1221 C CA . LEU A 176 ? 0.6980 0.5496 0.6083 0.0907 0.0197 0.0681 257 LEU A CA 1222 C C . LEU A 176 ? 0.7412 0.6080 0.6599 0.0938 0.0146 0.0746 257 LEU A C 1223 O O . LEU A 176 ? 0.6538 0.5198 0.5706 0.0922 0.0119 0.0749 257 LEU A O 1224 C CB . LEU A 176 ? 0.6699 0.5240 0.5815 0.0813 0.0143 0.0614 257 LEU A CB 1225 C CG . LEU A 176 ? 0.8850 0.7369 0.7953 0.0778 0.0156 0.0564 257 LEU A CG 1226 C CD1 . LEU A 176 ? 0.7403 0.5762 0.6400 0.0794 0.0236 0.0535 257 LEU A CD1 1227 C CD2 . LEU A 176 ? 0.8615 0.7155 0.7723 0.0694 0.0103 0.0506 257 LEU A CD2 1228 N N . VAL A 177 ? 0.7924 0.6733 0.7200 0.0978 0.0133 0.0796 258 VAL A N 1229 C CA . VAL A 177 ? 0.6686 0.5668 0.6051 0.0995 0.0078 0.0853 258 VAL A CA 1230 C C . VAL A 177 ? 0.8220 0.7365 0.7691 0.0949 0.0021 0.0850 258 VAL A C 1231 O O . VAL A 177 ? 0.8332 0.7527 0.7847 0.0971 0.0042 0.0865 258 VAL A O 1232 C CB . VAL A 177 ? 0.6331 0.5358 0.5710 0.1100 0.0119 0.0936 258 VAL A CB 1233 C CG1 . VAL A 177 ? 0.5812 0.5060 0.5299 0.1108 0.0055 0.0991 258 VAL A CG1 1234 C CG2 . VAL A 177 ? 0.5120 0.3990 0.4393 0.1145 0.0170 0.0947 258 VAL A CG2 1235 N N . ASN A 178 ? 0.8681 0.7902 0.8189 0.0883 -0.0047 0.0830 259 ASN A N 1236 C CA . ASN A 178 ? 0.7399 0.6740 0.6991 0.0821 -0.0100 0.0814 259 ASN A CA 1237 C C . ASN A 178 ? 0.7388 0.6665 0.6969 0.0794 -0.0078 0.0771 259 ASN A C 1238 O O . ASN A 178 ? 0.8540 0.7910 0.8190 0.0780 -0.0089 0.0781 259 ASN A O 1239 C CB . ASN A 178 ? 0.6723 0.6253 0.6417 0.0851 -0.0121 0.0878 259 ASN A CB 1240 C CG . ASN A 178 ? 0.8004 0.7622 0.7709 0.0878 -0.0150 0.0923 259 ASN A CG 1241 O OD1 . ASN A 178 ? 0.7148 0.6702 0.6797 0.0853 -0.0170 0.0900 259 ASN A OD1 1242 N ND2 . ASN A 178 ? 0.9561 0.9339 0.9342 0.0932 -0.0151 0.0991 259 ASN A ND2 1243 N N . GLY A 179 ? 0.8068 0.7189 0.7557 0.0784 -0.0044 0.0724 260 GLY A N 1244 C CA . GLY A 179 ? 0.7642 0.6706 0.7108 0.0754 -0.0027 0.0678 260 GLY A CA 1245 C C . GLY A 179 ? 0.8128 0.7145 0.7567 0.0808 0.0037 0.0692 260 GLY A C 1246 O O . GLY A 179 ? 0.7872 0.6828 0.7273 0.0784 0.0057 0.0651 260 GLY A O 1247 N N . THR A 180 ? 0.7591 0.6643 0.7050 0.0882 0.0072 0.0751 261 THR A N 1248 C CA . THR A 180 ? 0.7786 0.6776 0.7208 0.0939 0.0143 0.0762 261 THR A CA 1249 C C . THR A 180 ? 0.8435 0.7253 0.7745 0.0976 0.0206 0.0749 261 THR A C 1250 O O . THR A 180 ? 0.8880 0.7669 0.8168 0.0993 0.0202 0.0768 261 THR A O 1251 C CB . THR A 180 ? 1.0167 0.9293 0.9676 0.1007 0.0158 0.0835 261 THR A CB 1252 O OG1 . THR A 180 ? 1.0991 1.0116 1.0491 0.1082 0.0186 0.0889 261 THR A OG1 1253 C CG2 . THR A 180 ? 1.1243 1.0551 1.0869 0.0963 0.0089 0.0855 261 THR A CG2 1254 N N . SER A 181 ? 0.7906 0.6605 0.7139 0.0985 0.0267 0.0715 262 SER A N 1255 C CA . SER A 181 ? 0.8431 0.6950 0.7550 0.1015 0.0338 0.0699 262 SER A CA 1256 C C . SER A 181 ? 0.8603 0.7117 0.7725 0.1118 0.0388 0.0775 262 SER A C 1257 O O . SER A 181 ? 0.9092 0.7685 0.8267 0.1183 0.0415 0.0825 262 SER A O 1258 C CB . SER A 181 ? 0.7342 0.5735 0.6370 0.0997 0.0396 0.0643 262 SER A CB 1259 O OG . SER A 181 ? 0.8812 0.7019 0.7723 0.1019 0.0469 0.0624 262 SER A OG 1260 N N . ALA A 182 ? 0.8132 0.6560 0.7201 0.1137 0.0403 0.0787 263 ALA A N 1261 C CA . ALA A 182 ? 0.7791 0.6189 0.6844 0.1241 0.0461 0.0859 263 ALA A CA 1262 C C . ALA A 182 ? 0.8537 0.6696 0.7449 0.1267 0.0561 0.0830 263 ALA A C 1263 O O . ALA A 182 ? 0.9248 0.7324 0.8114 0.1350 0.0622 0.0882 263 ALA A O 1264 C CB . ALA A 182 ? 0.6157 0.4624 0.5240 0.1255 0.0414 0.0905 263 ALA A CB 1265 N N . GLY A 183 ? 0.8332 0.6383 0.7174 0.1195 0.0579 0.0748 264 GLY A N 1266 C CA . GLY A 183 ? 0.7560 0.5384 0.6264 0.1204 0.0677 0.0707 264 GLY A CA 1267 C C . GLY A 183 ? 0.8770 0.6464 0.7381 0.1099 0.0673 0.0616 264 GLY A C 1268 O O . GLY A 183 ? 0.7804 0.5574 0.6455 0.1030 0.0596 0.0591 264 GLY A O 1269 N N . TRP A 184 ? 0.8310 0.5808 0.6794 0.1087 0.0760 0.0564 265 TRP A N 1270 C CA . TRP A 184 ? 0.6606 0.3969 0.4991 0.0988 0.0772 0.0477 265 TRP A CA 1271 C C . TRP A 184 ? 0.7591 0.4700 0.5826 0.1008 0.0889 0.0455 265 TRP A C 1272 O O . TRP A 184 ? 0.7953 0.4981 0.6155 0.1102 0.0967 0.0503 265 TRP A O 1273 C CB . TRP A 184 ? 0.6224 0.3644 0.4609 0.0897 0.0735 0.0398 265 TRP A CB 1274 C CG . TRP A 184 ? 0.7214 0.4589 0.5556 0.0925 0.0796 0.0384 265 TRP A CG 1275 C CD1 . TRP A 184 ? 0.8147 0.5662 0.6574 0.0971 0.0774 0.0423 265 TRP A CD1 1276 C CD2 . TRP A 184 ? 0.6806 0.3979 0.5004 0.0907 0.0894 0.0324 265 TRP A CD2 1277 N NE1 . TRP A 184 ? 0.8606 0.6022 0.6952 0.0987 0.0851 0.0394 265 TRP A NE1 1278 C CE2 . TRP A 184 ? 0.7814 0.5019 0.6017 0.0947 0.0926 0.0331 265 TRP A CE2 1279 C CE3 . TRP A 184 ? 0.6744 0.3710 0.4806 0.0854 0.0961 0.0263 265 TRP A CE3 1280 C CZ2 . TRP A 184 ? 0.6527 0.3561 0.4597 0.0937 0.1022 0.0276 265 TRP A CZ2 1281 C CZ3 . TRP A 184 ? 0.7918 0.4711 0.5850 0.0840 0.1058 0.0207 265 TRP A CZ3 1282 C CH2 . TRP A 184 ? 0.6700 0.3527 0.4634 0.0882 0.1087 0.0213 265 TRP A CH2 1283 N N . LYS A 185 ? 0.8225 0.5209 0.6370 0.0918 0.0903 0.0383 266 LYS A N 1284 C CA . LYS A 185 ? 0.8043 0.4770 0.6035 0.0913 0.1016 0.0349 266 LYS A CA 1285 C C . LYS A 185 ? 0.8899 0.5551 0.6805 0.0783 0.1022 0.0234 266 LYS A C 1286 O O . LYS A 185 ? 0.8319 0.5067 0.6264 0.0695 0.0946 0.0192 266 LYS A O 1287 C CB . LYS A 185 ? 0.7859 0.4499 0.5822 0.0941 0.1033 0.0392 266 LYS A CB 1288 C CG . LYS A 185 ? 0.6990 0.3344 0.4788 0.0928 0.1154 0.0358 266 LYS A CG 1289 C CD . LYS A 185 ? 0.8399 0.4670 0.6181 0.1047 0.1208 0.0457 266 LYS A CD 1290 C CE . LYS A 185 ? 0.9168 0.5148 0.6787 0.1040 0.1327 0.0436 266 LYS A CE 1291 N NZ . LYS A 185 ? 1.0796 0.6727 0.8414 0.1169 0.1368 0.0548 266 LYS A NZ 1292 N N . ALA A 186 ? 0.9048 0.5537 0.6837 0.0769 0.1114 0.0182 267 ALA A N 1293 C CA . ALA A 186 ? 0.9374 0.5775 0.7063 0.0641 0.1133 0.0071 267 ALA A CA 1294 C C . ALA A 186 ? 0.8690 0.4949 0.6304 0.0582 0.1162 0.0042 267 ALA A C 1295 O O . ALA A 186 ? 0.9114 0.5198 0.6660 0.0643 0.1243 0.0084 267 ALA A O 1296 C CB . ALA A 186 ? 0.7491 0.3724 0.5054 0.0639 0.1237 0.0020 267 ALA A CB 1297 N N . LEU A 187 ? 0.8809 0.5151 0.6439 0.0468 0.1098 -0.0024 268 LEU A N 1298 C CA . LEU A 187 ? 0.9209 0.5423 0.6764 0.0395 0.1129 -0.0063 268 LEU A CA 1299 C C . LEU A 187 ? 0.9964 0.5998 0.7368 0.0296 0.1215 -0.0168 268 LEU A C 1300 O O . LEU A 187 ? 1.1064 0.7177 0.8461 0.0232 0.1192 -0.0233 268 LEU A O 1301 C CB . LEU A 187 ? 0.8329 0.4736 0.5984 0.0324 0.1016 -0.0080 268 LEU A CB 1302 C CG . LEU A 187 ? 0.8545 0.5124 0.6340 0.0407 0.0931 0.0014 268 LEU A CG 1303 C CD1 . LEU A 187 ? 0.6419 0.3223 0.4326 0.0341 0.0813 -0.0010 268 LEU A CD1 1304 C CD2 . LEU A 187 ? 0.8711 0.5172 0.6477 0.0463 0.0971 0.0076 268 LEU A CD2 1305 N N . ASP A 188 ? 1.0265 0.6054 0.7542 0.0281 0.1319 -0.0184 269 ASP A N 1306 C CA . ASP A 188 ? 1.0369 0.5986 0.7497 0.0167 0.1401 -0.0294 269 ASP A CA 1307 C C . ASP A 188 ? 1.0236 0.5961 0.7383 0.0024 0.1335 -0.0372 269 ASP A C 1308 O O . ASP A 188 ? 0.9330 0.5004 0.6469 -0.0007 0.1339 -0.0366 269 ASP A O 1309 C CB . ASP A 188 ? 0.9097 0.4393 0.6072 0.0196 0.1546 -0.0288 269 ASP A CB 1310 C CG . ASP A 188 ? 1.1634 0.6737 0.8446 0.0060 0.1636 -0.0410 269 ASP A CG 1311 O OD1 . ASP A 188 ? 1.1941 0.7159 0.8751 -0.0042 0.1593 -0.0496 269 ASP A OD1 1312 O OD2 . ASP A 188 ? 1.2531 0.7365 0.9211 0.0053 0.1752 -0.0418 269 ASP A OD2 1313 N N . THR A 189 ? 1.0341 0.6226 0.7515 -0.0057 0.1275 -0.0442 270 THR A N 1314 C CA . THR A 189 ? 1.0592 0.6603 0.7787 -0.0191 0.1213 -0.0518 270 THR A CA 1315 C C . THR A 189 ? 1.0199 0.6118 0.7262 -0.0319 0.1273 -0.0637 270 THR A C 1316 O O . THR A 189 ? 1.0476 0.6566 0.7567 -0.0419 0.1209 -0.0705 270 THR A O 1317 C CB . THR A 189 ? 1.0507 0.6826 0.7860 -0.0184 0.1076 -0.0497 270 THR A CB 1318 O OG1 . THR A 189 ? 0.9349 0.5751 0.6710 -0.0161 0.1060 -0.0508 270 THR A OG1 1319 C CG2 . THR A 189 ? 0.9158 0.5572 0.6639 -0.0073 0.1014 -0.0388 270 THR A CG2 1320 N N . THR A 190 ? 1.1194 0.6842 0.8109 -0.0315 0.1401 -0.0661 271 THR A N 1321 C CA . THR A 190 ? 1.1932 0.7451 0.8699 -0.0444 0.1476 -0.0779 271 THR A CA 1322 C C . THR A 190 ? 1.2157 0.7698 0.8899 -0.0591 0.1464 -0.0856 271 THR A C 1323 O O . THR A 190 ? 1.2295 0.7756 0.9044 -0.0587 0.1482 -0.0823 271 THR A O 1324 C CB . THR A 190 ? 1.1795 0.6981 0.8400 -0.0407 0.1629 -0.0784 271 THR A CB 1325 O OG1 . THR A 190 ? 1.3197 0.8382 0.9833 -0.0267 0.1640 -0.0711 271 THR A OG1 1326 C CG2 . THR A 190 ? 1.0838 0.5882 0.7278 -0.0552 0.1711 -0.0916 271 THR A CG2 1327 N N . GLY A 191 ? 1.1096 0.6762 0.7813 -0.0721 0.1432 -0.0957 272 GLY A N 1328 C CA . GLY A 191 ? 0.9910 0.5612 0.6598 -0.0873 0.1425 -0.1041 272 GLY A CA 1329 C C . GLY A 191 ? 1.0851 0.6848 0.7702 -0.0887 0.1293 -0.1014 272 GLY A C 1330 O O . GLY A 191 ? 1.1347 0.7431 0.8195 -0.1014 0.1272 -0.1085 272 GLY A O 1331 N N . PHE A 192 ? 0.9994 0.6145 0.6986 -0.0759 0.1207 -0.0914 273 PHE A N 1332 C CA . PHE A 192 ? 0.9999 0.6422 0.7143 -0.0767 0.1086 -0.0888 273 PHE A CA 1333 C C . PHE A 192 ? 0.8907 0.5545 0.6189 -0.0659 0.0985 -0.0814 273 PHE A C 1334 O O . PHE A 192 ? 0.9208 0.5801 0.6476 -0.0577 0.1004 -0.0780 273 PHE A O 1335 C CB . PHE A 192 ? 0.9656 0.6021 0.6836 -0.0754 0.1090 -0.0844 273 PHE A CB 1336 C CG . PHE A 192 ? 0.9710 0.5959 0.6920 -0.0606 0.1110 -0.0733 273 PHE A CG 1337 C CD1 . PHE A 192 ? 0.9722 0.5688 0.6810 -0.0559 0.1228 -0.0716 273 PHE A CD1 1338 C CD2 . PHE A 192 ? 0.9791 0.6214 0.7148 -0.0514 0.1015 -0.0646 273 PHE A CD2 1339 C CE1 . PHE A 192 ? 0.8878 0.4756 0.5996 -0.0417 0.1245 -0.0608 273 PHE A CE1 1340 C CE2 . PHE A 192 ? 0.9723 0.6059 0.7109 -0.0382 0.1030 -0.0545 273 PHE A CE2 1341 C CZ . PHE A 192 ? 1.0470 0.6543 0.7740 -0.0331 0.1143 -0.0524 273 PHE A CZ 1342 N N . ASN A 193 ? 0.8285 0.5151 0.5698 -0.0661 0.0882 -0.0789 274 ASN A N 1343 C CA . ASN A 193 ? 0.7626 0.4709 0.5175 -0.0574 0.0782 -0.0723 274 ASN A CA 1344 C C . ASN A 193 ? 0.9571 0.6716 0.7235 -0.0503 0.0727 -0.0642 274 ASN A C 1345 O O . ASN A 193 ? 0.7405 0.4521 0.5065 -0.0555 0.0735 -0.0657 274 ASN A O 1346 C CB . ASN A 193 ? 0.8243 0.5561 0.5830 -0.0657 0.0710 -0.0784 274 ASN A CB 1347 C CG . ASN A 193 ? 0.9137 0.6695 0.6874 -0.0585 0.0601 -0.0719 274 ASN A CG 1348 O OD1 . ASN A 193 ? 0.9045 0.6775 0.6864 -0.0620 0.0533 -0.0724 274 ASN A OD1 1349 N ND2 . ASN A 193 ? 0.7902 0.5472 0.5674 -0.0485 0.0586 -0.0660 274 ASN A ND2 1350 N N . PHE A 194 ? 0.8618 0.5848 0.6380 -0.0390 0.0674 -0.0558 275 PHE A N 1351 C CA . PHE A 194 ? 0.7898 0.5148 0.5748 -0.0315 0.0637 -0.0478 275 PHE A CA 1352 C C . PHE A 194 ? 0.7703 0.5169 0.5691 -0.0251 0.0537 -0.0423 275 PHE A C 1353 O O . PHE A 194 ? 0.7783 0.5253 0.5822 -0.0152 0.0523 -0.0350 275 PHE A O 1354 C CB . PHE A 194 ? 0.7684 0.4731 0.5484 -0.0223 0.0709 -0.0416 275 PHE A CB 1355 C CG . PHE A 194 ? 0.8401 0.5434 0.6257 -0.0163 0.0690 -0.0344 275 PHE A CG 1356 C CD1 . PHE A 194 ? 0.9020 0.6001 0.6848 -0.0226 0.0706 -0.0369 275 PHE A CD1 1357 C CD2 . PHE A 194 ? 0.7792 0.4865 0.5724 -0.0048 0.0659 -0.0253 275 PHE A CD2 1358 C CE1 . PHE A 194 ? 0.8262 0.5231 0.6133 -0.0172 0.0689 -0.0303 275 PHE A CE1 1359 C CE2 . PHE A 194 ? 0.8193 0.5262 0.6170 0.0002 0.0640 -0.0190 275 PHE A CE2 1360 C CZ . PHE A 194 ? 0.7804 0.4820 0.5748 -0.0058 0.0654 -0.0215 275 PHE A CZ 1361 N N . GLU A 195 ? 0.7347 0.4996 0.5396 -0.0309 0.0469 -0.0456 276 GLU A N 1362 C CA . GLU A 195 ? 0.7502 0.5350 0.5673 -0.0256 0.0379 -0.0409 276 GLU A CA 1363 C C . GLU A 195 ? 0.7734 0.5649 0.6003 -0.0214 0.0326 -0.0353 276 GLU A C 1364 O O . GLU A 195 ? 0.6553 0.4425 0.4807 -0.0255 0.0338 -0.0369 276 GLU A O 1365 C CB . GLU A 195 ? 0.8017 0.6039 0.6205 -0.0324 0.0334 -0.0465 276 GLU A CB 1366 C CG . GLU A 195 ? 0.9550 0.7536 0.7644 -0.0367 0.0376 -0.0521 276 GLU A CG 1367 C CD . GLU A 195 ? 0.8970 0.6953 0.7075 -0.0283 0.0376 -0.0474 276 GLU A CD 1368 O OE1 . GLU A 195 ? 0.9872 0.7993 0.8078 -0.0220 0.0310 -0.0418 276 GLU A OE1 1369 O OE2 . GLU A 195 ? 0.9680 0.7516 0.7689 -0.0282 0.0446 -0.0495 276 GLU A OE2 1370 N N . PHE A 196 ? 0.8092 0.6111 0.6455 -0.0138 0.0269 -0.0291 277 PHE A N 1371 C CA . PHE A 196 ? 0.7113 0.5218 0.5570 -0.0106 0.0211 -0.0245 277 PHE A CA 1372 C C . PHE A 196 ? 0.8230 0.6217 0.6665 -0.0094 0.0240 -0.0221 277 PHE A C 1373 O O . PHE A 196 ? 0.6189 0.4222 0.4654 -0.0126 0.0215 -0.0230 277 PHE A O 1374 C CB . PHE A 196 ? 0.7189 0.5450 0.5694 -0.0165 0.0160 -0.0284 277 PHE A CB 1375 C CG . PHE A 196 ? 0.8200 0.6573 0.6701 -0.0195 0.0141 -0.0321 277 PHE A CG 1376 C CD1 . PHE A 196 ? 0.9332 0.7780 0.7880 -0.0136 0.0110 -0.0282 277 PHE A CD1 1377 C CD2 . PHE A 196 ? 0.7117 0.5528 0.5568 -0.0284 0.0155 -0.0394 277 PHE A CD2 1378 C CE1 . PHE A 196 ? 0.8394 0.6947 0.6932 -0.0159 0.0093 -0.0311 277 PHE A CE1 1379 C CE2 . PHE A 196 ? 0.6841 0.5371 0.5286 -0.0312 0.0135 -0.0426 277 PHE A CE2 1380 C CZ . PHE A 196 ? 0.8328 0.6927 0.6814 -0.0246 0.0104 -0.0383 277 PHE A CZ 1381 N N . PRO A 197 ? 0.8355 0.6195 0.6738 -0.0045 0.0294 -0.0187 278 PRO A N 1382 C CA . PRO A 197 ? 0.7698 0.5434 0.6057 -0.0030 0.0320 -0.0159 278 PRO A CA 1383 C C . PRO A 197 ? 0.7977 0.5825 0.6434 0.0010 0.0251 -0.0108 278 PRO A C 1384 O O . PRO A 197 ? 0.8000 0.5940 0.6531 0.0067 0.0206 -0.0063 278 PRO A O 1385 C CB . PRO A 197 ? 0.8292 0.5878 0.6593 0.0038 0.0384 -0.0116 278 PRO A CB 1386 C CG . PRO A 197 ? 0.8002 0.5668 0.6346 0.0083 0.0361 -0.0098 278 PRO A CG 1387 C CD . PRO A 197 ? 0.6829 0.4602 0.5182 0.0011 0.0331 -0.0162 278 PRO A CD 1388 N N . THR A 198 ? 0.7674 0.5515 0.6127 -0.0026 0.0246 -0.0119 279 THR A N 1389 C CA . THR A 198 ? 0.6208 0.4133 0.4737 0.0008 0.0190 -0.0074 279 THR A CA 1390 C C . THR A 198 ? 0.7495 0.5293 0.5972 0.0040 0.0229 -0.0034 279 THR A C 1391 O O . THR A 198 ? 0.7417 0.5085 0.5808 0.0002 0.0291 -0.0060 279 THR A O 1392 C CB . THR A 198 ? 0.6938 0.4984 0.5515 -0.0050 0.0144 -0.0115 279 THR A CB 1393 O OG1 . THR A 198 ? 0.6531 0.4653 0.5178 -0.0016 0.0091 -0.0074 279 THR A OG1 1394 C CG2 . THR A 198 ? 0.7410 0.5382 0.5916 -0.0128 0.0191 -0.0170 279 THR A CG2 1395 N N . CYS A 199 ? 0.5761 0.3597 0.4288 0.0110 0.0196 0.0032 280 CYS A N 1396 C CA . CYS A 199 ? 0.7701 0.5424 0.6177 0.0164 0.0237 0.0086 280 CYS A CA 1397 C C . CYS A 199 ? 0.7443 0.5215 0.5953 0.0191 0.0197 0.0131 280 CYS A C 1398 O O . CYS A 199 ? 0.6147 0.4049 0.4732 0.0179 0.0131 0.0128 280 CYS A O 1399 C CB . CYS A 199 ? 0.5902 0.3603 0.4384 0.0240 0.0256 0.0135 280 CYS A CB 1400 S SG . CYS A 199 ? 0.9586 0.7211 0.8012 0.0217 0.0312 0.0085 280 CYS A SG 1401 N N . TYR A 200 ? 0.6829 0.4490 0.5275 0.0229 0.0241 0.0174 281 TYR A N 1402 C CA . TYR A 200 ? 0.6904 0.4611 0.5371 0.0270 0.0207 0.0229 281 TYR A CA 1403 C C . TYR A 200 ? 0.6526 0.4136 0.4939 0.0349 0.0255 0.0300 281 TYR A C 1404 O O . TYR A 200 ? 0.7607 0.5069 0.5940 0.0360 0.0331 0.0297 281 TYR A O 1405 C CB . TYR A 200 ? 0.6265 0.3957 0.4704 0.0212 0.0204 0.0200 281 TYR A CB 1406 C CG . TYR A 200 ? 0.7653 0.5175 0.5983 0.0179 0.0286 0.0177 281 TYR A CG 1407 C CD1 . TYR A 200 ? 0.7937 0.5395 0.6229 0.0112 0.0328 0.0110 281 TYR A CD1 1408 C CD2 . TYR A 200 ? 0.7410 0.4836 0.5671 0.0209 0.0322 0.0223 281 TYR A CD2 1409 C CE1 . TYR A 200 ? 0.7933 0.5230 0.6123 0.0070 0.0407 0.0084 281 TYR A CE1 1410 C CE2 . TYR A 200 ? 0.7729 0.4986 0.5886 0.0175 0.0403 0.0203 281 TYR A CE2 1411 C CZ . TYR A 200 ? 0.8892 0.6082 0.7014 0.0101 0.0446 0.0131 281 TYR A CZ 1412 O OH . TYR A 200 ? 0.8361 0.5379 0.6377 0.0056 0.0531 0.0105 281 TYR A OH 1413 N N . TYR A 201 ? 0.7748 0.5443 0.6201 0.0405 0.0213 0.0363 282 TYR A N 1414 C CA . TYR A 201 ? 0.7907 0.5536 0.6313 0.0489 0.0253 0.0440 282 TYR A CA 1415 C C . TYR A 201 ? 0.7510 0.5070 0.5846 0.0491 0.0273 0.0465 282 TYR A C 1416 O O . TYR A 201 ? 0.7224 0.4869 0.5588 0.0452 0.0220 0.0451 282 TYR A O 1417 C CB . TYR A 201 ? 0.7938 0.5721 0.6432 0.0554 0.0195 0.0500 282 TYR A CB 1418 C CG . TYR A 201 ? 0.8491 0.6237 0.6947 0.0649 0.0230 0.0587 282 TYR A CG 1419 C CD1 . TYR A 201 ? 0.8327 0.5963 0.6739 0.0709 0.0302 0.0616 282 TYR A CD1 1420 C CD2 . TYR A 201 ? 0.7505 0.5325 0.5965 0.0681 0.0194 0.0641 282 TYR A CD2 1421 C CE1 . TYR A 201 ? 0.9652 0.7256 0.8030 0.0807 0.0339 0.0702 282 TYR A CE1 1422 C CE2 . TYR A 201 ? 0.7527 0.5328 0.5953 0.0774 0.0226 0.0727 282 TYR A CE2 1423 C CZ . TYR A 201 ? 0.9178 0.6872 0.7566 0.0840 0.0298 0.0759 282 TYR A CZ 1424 O OH . TYR A 201 ? 0.9004 0.6683 0.7360 0.0943 0.0333 0.0851 282 TYR A OH 1425 N N . THR A 202 ? 0.8015 0.5419 0.6257 0.0538 0.0352 0.0505 283 THR A N 1426 C CA . THR A 202 ? 0.9530 0.6874 0.7702 0.0564 0.0373 0.0553 283 THR A CA 1427 C C . THR A 202 ? 1.0619 0.7795 0.8694 0.0646 0.0464 0.0619 283 THR A C 1428 O O . THR A 202 ? 1.0408 0.7447 0.8434 0.0650 0.0536 0.0599 283 THR A O 1429 C CB . THR A 202 ? 1.0330 0.7619 0.8457 0.0471 0.0381 0.0491 283 THR A CB 1430 O OG1 . THR A 202 ? 1.2755 1.0071 1.0855 0.0492 0.0361 0.0536 283 THR A OG1 1431 C CG2 . THR A 202 ? 0.9418 0.6498 0.7442 0.0432 0.0480 0.0452 283 THR A CG2 1432 N N . SER A 203 ? 0.9893 0.7081 0.7936 0.0714 0.0464 0.0698 284 SER A N 1433 C CA . SER A 203 ? 0.9194 0.6231 0.7144 0.0809 0.0551 0.0776 284 SER A CA 1434 C C . SER A 203 ? 0.9313 0.6312 0.7277 0.0878 0.0593 0.0802 284 SER A C 1435 O O . SER A 203 ? 0.8738 0.5532 0.6609 0.0897 0.0693 0.0800 284 SER A O 1436 C CB . SER A 203 ? 0.8969 0.5771 0.6790 0.0764 0.0646 0.0746 284 SER A CB 1437 O OG . SER A 203 ? 1.1371 0.8201 0.9178 0.0693 0.0614 0.0715 284 SER A OG 1438 N N . GLY A 204 ? 0.7694 0.4883 0.5770 0.0913 0.0523 0.0823 285 GLY A N 1439 C CA . GLY A 204 ? 0.7828 0.5000 0.5925 0.0981 0.0561 0.0850 285 GLY A CA 1440 C C . GLY A 204 ? 0.9649 0.6714 0.7730 0.0918 0.0603 0.0766 285 GLY A C 1441 O O . GLY A 204 ? 0.9266 0.6277 0.7340 0.0975 0.0653 0.0784 285 GLY A O 1442 N N . LYS A 205 ? 0.8962 0.6003 0.7035 0.0803 0.0585 0.0674 286 LYS A N 1443 C CA . LYS A 205 ? 0.7496 0.4461 0.5555 0.0738 0.0618 0.0592 286 LYS A CA 1444 C C . LYS A 205 ? 0.8291 0.5411 0.6441 0.0645 0.0532 0.0516 286 LYS A C 1445 O O . LYS A 205 ? 0.7627 0.4838 0.5812 0.0594 0.0472 0.0497 286 LYS A O 1446 C CB . LYS A 205 ? 0.8132 0.4855 0.6057 0.0687 0.0718 0.0546 286 LYS A CB 1447 C CG . LYS A 205 ? 0.7735 0.4260 0.5554 0.0780 0.0825 0.0613 286 LYS A CG 1448 C CD . LYS A 205 ? 0.9502 0.5772 0.7184 0.0713 0.0932 0.0552 286 LYS A CD 1449 C CE . LYS A 205 ? 0.9757 0.5816 0.7318 0.0793 0.1037 0.0624 286 LYS A CE 1450 N NZ . LYS A 205 ? 1.1536 0.7642 0.9126 0.0940 0.1044 0.0732 286 LYS A NZ 1451 N N . VAL A 206 ? 0.9597 0.6745 0.7783 0.0629 0.0530 0.0477 287 VAL A N 1452 C CA . VAL A 206 ? 0.8619 0.5866 0.6862 0.0535 0.0474 0.0396 287 VAL A CA 1453 C C . VAL A 206 ? 0.8253 0.5346 0.6404 0.0450 0.0538 0.0316 287 VAL A C 1454 O O . VAL A 206 ? 0.8008 0.4936 0.6071 0.0463 0.0624 0.0308 287 VAL A O 1455 C CB . VAL A 206 ? 0.8307 0.5668 0.6631 0.0556 0.0439 0.0393 287 VAL A CB 1456 C CG1 . VAL A 206 ? 0.6924 0.4378 0.5297 0.0465 0.0387 0.0315 287 VAL A CG1 1457 C CG2 . VAL A 206 ? 0.8294 0.5817 0.6714 0.0630 0.0376 0.0469 287 VAL A CG2 1458 N N . LYS A 207 ? 0.8552 0.5694 0.6716 0.0361 0.0501 0.0259 288 LYS A N 1459 C CA . LYS A 207 ? 0.7638 0.4663 0.5723 0.0268 0.0554 0.0179 288 LYS A CA 1460 C C . LYS A 207 ? 0.7707 0.4870 0.5859 0.0188 0.0496 0.0106 288 LYS A C 1461 O O . LYS A 207 ? 0.7986 0.5318 0.6234 0.0182 0.0412 0.0110 288 LYS A O 1462 C CB . LYS A 207 ? 0.8470 0.5413 0.6495 0.0233 0.0580 0.0179 288 LYS A CB 1463 C CG . LYS A 207 ? 0.9175 0.6018 0.7147 0.0324 0.0622 0.0266 288 LYS A CG 1464 C CD . LYS A 207 ? 0.9244 0.5963 0.7129 0.0282 0.0671 0.0259 288 LYS A CD 1465 C CE . LYS A 207 ? 0.9279 0.5910 0.7109 0.0378 0.0709 0.0354 288 LYS A CE 1466 N NZ . LYS A 207 ? 0.9772 0.6222 0.7487 0.0339 0.0787 0.0346 288 LYS A NZ 1467 N N . CYS A 208 ? 0.8448 0.5537 0.6545 0.0129 0.0542 0.0041 289 CYS A N 1468 C CA . CYS A 208 ? 0.7493 0.4720 0.5652 0.0074 0.0491 -0.0017 289 CYS A CA 1469 C C . CYS A 208 ? 0.7443 0.4619 0.5538 -0.0036 0.0528 -0.0106 289 CYS A C 1470 O O . CYS A 208 ? 0.7459 0.4456 0.5445 -0.0066 0.0615 -0.0135 289 CYS A O 1471 C CB . CYS A 208 ? 0.6781 0.4022 0.4955 0.0127 0.0496 -0.0001 289 CYS A CB 1472 S SG . CYS A 208 ? 0.9818 0.7170 0.8090 0.0245 0.0441 0.0097 289 CYS A SG 1473 N N . THR A 209 ? 0.6634 0.3969 0.4798 -0.0097 0.0464 -0.0150 290 THR A N 1474 C CA . THR A 209 ? 0.7649 0.4992 0.5774 -0.0204 0.0484 -0.0236 290 THR A CA 1475 C C . THR A 209 ? 0.7560 0.5035 0.5733 -0.0218 0.0442 -0.0269 290 THR A C 1476 O O . THR A 209 ? 0.6687 0.4320 0.4959 -0.0178 0.0367 -0.0239 290 THR A O 1477 C CB . THR A 209 ? 0.8223 0.5664 0.6390 -0.0264 0.0446 -0.0262 290 THR A CB 1478 O OG1 . THR A 209 ? 0.8187 0.5503 0.6302 -0.0254 0.0488 -0.0232 290 THR A OG1 1479 C CG2 . THR A 209 ? 0.9458 0.6937 0.7595 -0.0377 0.0462 -0.0351 290 THR A CG2 1480 N N . GLY A 210 ? 0.7435 0.4837 0.5529 -0.0276 0.0494 -0.0329 291 GLY A N 1481 C CA . GLY A 210 ? 0.7489 0.5007 0.5612 -0.0290 0.0461 -0.0360 291 GLY A CA 1482 C C . GLY A 210 ? 0.8167 0.5766 0.6269 -0.0404 0.0458 -0.0446 291 GLY A C 1483 O O . GLY A 210 ? 0.8026 0.5588 0.6094 -0.0476 0.0484 -0.0484 291 GLY A O 1484 N N . THR A 211 ? 0.8702 0.6423 0.6825 -0.0421 0.0425 -0.0476 292 THR A N 1485 C CA . THR A 211 ? 0.5831 0.3660 0.3938 -0.0527 0.0416 -0.0557 292 THR A CA 1486 C C . THR A 211 ? 0.7916 0.5661 0.5920 -0.0576 0.0472 -0.0615 292 THR A C 1487 O O . THR A 211 ? 0.8046 0.5799 0.6050 -0.0520 0.0465 -0.0593 292 THR A O 1488 C CB . THR A 211 ? 0.6606 0.4682 0.4826 -0.0516 0.0323 -0.0548 292 THR A CB 1489 O OG1 . THR A 211 ? 0.9222 0.7354 0.7535 -0.0450 0.0274 -0.0484 292 THR A OG1 1490 C CG2 . THR A 211 ? 0.7032 0.5239 0.5249 -0.0624 0.0311 -0.0622 292 THR A CG2 1491 N N . ASN A 212 ? 0.7863 0.5523 0.5775 -0.0683 0.0531 -0.0691 293 ASN A N 1492 C CA . ASN A 212 ? 0.8005 0.5591 0.5806 -0.0755 0.0587 -0.0765 293 ASN A CA 1493 C C . ASN A 212 ? 0.8959 0.6775 0.6793 -0.0838 0.0530 -0.0827 293 ASN A C 1494 O O . ASN A 212 ? 0.9144 0.7047 0.6988 -0.0930 0.0521 -0.0877 293 ASN A O 1495 C CB . ASN A 212 ? 0.8755 0.6120 0.6429 -0.0839 0.0688 -0.0821 293 ASN A CB 1496 C CG . ASN A 212 ? 1.0588 0.7807 0.8129 -0.0889 0.0766 -0.0884 293 ASN A CG 1497 O OD1 . ASN A 212 ? 0.9628 0.6959 0.7170 -0.0897 0.0735 -0.0910 293 ASN A OD1 1498 N ND2 . ASN A 212 ? 1.1341 0.8298 0.8759 -0.0920 0.0871 -0.0907 293 ASN A ND2 1499 N N . LEU A 213 ? 0.7893 0.5813 0.5743 -0.0803 0.0494 -0.0822 294 LEU A N 1500 C CA . LEU A 213 ? 0.7657 0.5813 0.5538 -0.0867 0.0436 -0.0871 294 LEU A CA 1501 C C . LEU A 213 ? 0.8079 0.6186 0.5832 -0.0985 0.0492 -0.0970 294 LEU A C 1502 O O . LEU A 213 ? 0.8536 0.6837 0.6296 -0.1053 0.0451 -0.1021 294 LEU A O 1503 C CB . LEU A 213 ? 0.6340 0.4644 0.4299 -0.0774 0.0367 -0.0813 294 LEU A CB 1504 C CG . LEU A 213 ? 0.7483 0.5843 0.5566 -0.0664 0.0311 -0.0719 294 LEU A CG 1505 C CD1 . LEU A 213 ? 0.7506 0.5920 0.5634 -0.0567 0.0275 -0.0660 294 LEU A CD1 1506 C CD2 . LEU A 213 ? 0.6946 0.5515 0.5126 -0.0691 0.0243 -0.0720 294 LEU A CD2 1507 N N . TRP A 214 ? 0.9805 0.7650 0.7439 -0.1008 0.0589 -0.0998 295 TRP A N 1508 C CA . TRP A 214 ? 0.9075 0.6820 0.6567 -0.1110 0.0658 -0.1090 295 TRP A CA 1509 C C . TRP A 214 ? 0.9336 0.7008 0.6755 -0.1250 0.0714 -0.1174 295 TRP A C 1510 O O . TRP A 214 ? 0.9350 0.7181 0.6754 -0.1367 0.0692 -0.1253 295 TRP A O 1511 C CB . TRP A 214 ? 0.8853 0.6335 0.6250 -0.1039 0.0742 -0.1066 295 TRP A CB 1512 C CG . TRP A 214 ? 0.9910 0.7227 0.7140 -0.1136 0.0835 -0.1161 295 TRP A CG 1513 C CD1 . TRP A 214 ? 1.0504 0.7914 0.7666 -0.1279 0.0838 -0.1266 295 TRP A CD1 1514 C CD2 . TRP A 214 ? 1.1016 0.8047 0.8124 -0.1098 0.0940 -0.1161 295 TRP A CD2 1515 N NE1 . TRP A 214 ? 1.1372 0.8561 0.8370 -0.1338 0.0940 -0.1336 295 TRP A NE1 1516 C CE2 . TRP A 214 ? 1.1440 0.8387 0.8402 -0.1225 0.1007 -0.1272 295 TRP A CE2 1517 C CE3 . TRP A 214 ? 1.0904 0.7747 0.8011 -0.0968 0.0986 -0.1076 295 TRP A CE3 1518 C CZ2 . TRP A 214 ? 1.0890 0.7555 0.7701 -0.1223 0.1123 -0.1301 295 TRP A CZ2 1519 C CZ3 . TRP A 214 ? 1.0557 0.7133 0.7522 -0.0959 0.1099 -0.1100 295 TRP A CZ3 1520 C CH2 . TRP A 214 ? 1.1105 0.7585 0.7921 -0.1084 0.1169 -0.1212 295 TRP A CH2 1521 N N . ASN A 215 ? 0.9231 0.6671 0.6604 -0.1238 0.0786 -0.1155 296 ASN A N 1522 C CA . ASN A 215 ? 0.9401 0.6700 0.6667 -0.1373 0.0868 -0.1239 296 ASN A CA 1523 C C . ASN A 215 ? 0.8996 0.6198 0.6289 -0.1369 0.0893 -0.1204 296 ASN A C 1524 O O . ASN A 215 ? 1.1984 0.8968 0.9166 -0.1444 0.0989 -0.1249 296 ASN A O 1525 C CB . ASN A 215 ? 1.0173 0.7183 0.7268 -0.1401 0.0985 -0.1286 296 ASN A CB 1526 C CG . ASN A 215 ? 1.1274 0.8065 0.8354 -0.1252 0.1031 -0.1194 296 ASN A CG 1527 O OD1 . ASN A 215 ? 1.3065 0.9886 1.0248 -0.1146 0.0989 -0.1102 296 ASN A OD1 1528 N ND2 . ASN A 215 ? 1.0804 0.7384 0.7757 -0.1243 0.1119 -0.1220 296 ASN A ND2 1529 N N . ASP A 216 ? 0.7996 0.5350 0.5429 -0.1284 0.0812 -0.1125 297 ASP A N 1530 C CA . ASP A 216 ? 0.9512 0.6778 0.6964 -0.1283 0.0836 -0.1095 297 ASP A CA 1531 C C . ASP A 216 ? 0.9251 0.6762 0.6853 -0.1257 0.0739 -0.1054 297 ASP A C 1532 O O . ASP A 216 ? 1.0630 0.8267 0.8336 -0.1146 0.0664 -0.0982 297 ASP A O 1533 C CB . ASP A 216 ? 1.0583 0.7598 0.7995 -0.1165 0.0893 -0.1014 297 ASP A CB 1534 C CG . ASP A 216 ? 1.1357 0.8252 0.8762 -0.1169 0.0932 -0.0985 297 ASP A CG 1535 O OD1 . ASP A 216 ? 1.0553 0.7474 0.7936 -0.1290 0.0954 -0.1048 297 ASP A OD1 1536 O OD2 . ASP A 216 ? 1.2978 0.9758 1.0398 -0.1053 0.0942 -0.0898 297 ASP A OD2 1537 N N . ALA A 217 ? 0.9879 0.7443 0.7487 -0.1359 0.0750 -0.1100 298 ALA A N 1538 C CA . ALA A 217 ? 0.9836 0.7611 0.7575 -0.1346 0.0675 -0.1068 298 ALA A CA 1539 C C . ALA A 217 ? 1.0491 0.8143 0.8260 -0.1256 0.0685 -0.0986 298 ALA A C 1540 O O . ALA A 217 ? 0.9691 0.7502 0.7573 -0.1211 0.0618 -0.0942 298 ALA A O 1541 C CB . ALA A 217 ? 0.9003 0.6899 0.6735 -0.1496 0.0685 -0.1153 298 ALA A CB 1542 N N . LYS A 218 ? 0.9469 0.6839 0.7133 -0.1230 0.0772 -0.0966 299 LYS A N 1543 C CA . LYS A 218 ? 0.8511 0.5762 0.6197 -0.1115 0.0777 -0.0874 299 LYS A CA 1544 C C . LYS A 218 ? 1.0016 0.7280 0.7750 -0.0976 0.0731 -0.0798 299 LYS A C 1545 O O . LYS A 218 ? 0.8582 0.5892 0.6306 -0.0971 0.0717 -0.0820 299 LYS A O 1546 C CB . LYS A 218 ? 0.8304 0.5252 0.5855 -0.1137 0.0892 -0.0876 299 LYS A CB 1547 C CG . LYS A 218 ? 0.8147 0.5034 0.5640 -0.1267 0.0953 -0.0937 299 LYS A CG 1548 C CD . LYS A 218 ? 0.8457 0.5007 0.5793 -0.1278 0.1080 -0.0940 299 LYS A CD 1549 C CE . LYS A 218 ? 1.0347 0.6774 0.7600 -0.1402 0.1163 -0.0995 299 LYS A CE 1550 N NZ . LYS A 218 ? 1.0721 0.6801 0.7814 -0.1393 0.1290 -0.0989 299 LYS A NZ 1551 N N . ARG A 219 ? 1.0199 0.7427 0.7983 -0.0867 0.0709 -0.0711 300 ARG A N 1552 C CA . ARG A 219 ? 0.8528 0.5761 0.6354 -0.0741 0.0673 -0.0638 300 ARG A CA 1553 C C . ARG A 219 ? 0.8648 0.5624 0.6377 -0.0674 0.0756 -0.0595 300 ARG A C 1554 O O . ARG A 219 ? 1.0071 0.6891 0.7745 -0.0669 0.0812 -0.0571 300 ARG A O 1555 C CB . ARG A 219 ? 0.7389 0.4779 0.5343 -0.0658 0.0585 -0.0568 300 ARG A CB 1556 C CG . ARG A 219 ? 0.7260 0.4896 0.5310 -0.0710 0.0509 -0.0602 300 ARG A CG 1557 C CD . ARG A 219 ? 0.8105 0.5870 0.6271 -0.0624 0.0431 -0.0532 300 ARG A CD 1558 N NE . ARG A 219 ? 0.9053 0.7056 0.7317 -0.0650 0.0357 -0.0555 300 ARG A NE 1559 C CZ . ARG A 219 ? 0.8163 0.6305 0.6472 -0.0637 0.0310 -0.0563 300 ARG A CZ 1560 N NH1 . ARG A 219 ? 0.8052 0.6120 0.6319 -0.0601 0.0328 -0.0555 300 ARG A NH1 1561 N NH2 . ARG A 219 ? 0.7255 0.5609 0.5650 -0.0654 0.0249 -0.0577 300 ARG A NH2 1562 N N . PRO A 220 ? 0.8546 0.5478 0.6252 -0.0618 0.0768 -0.0582 301 PRO A N 1563 C CA . PRO A 220 ? 0.7751 0.4463 0.5380 -0.0531 0.0842 -0.0527 301 PRO A CA 1564 C C . PRO A 220 ? 0.9017 0.5753 0.6721 -0.0411 0.0801 -0.0424 301 PRO A C 1565 O O . PRO A 220 ? 0.8364 0.5301 0.6190 -0.0370 0.0705 -0.0389 301 PRO A O 1566 C CB . PRO A 220 ? 0.7923 0.4653 0.5542 -0.0497 0.0840 -0.0536 301 PRO A CB 1567 C CG . PRO A 220 ? 0.8748 0.5751 0.6482 -0.0520 0.0735 -0.0555 301 PRO A CG 1568 C CD . PRO A 220 ? 0.8325 0.5414 0.6071 -0.0632 0.0718 -0.0616 301 PRO A CD 1569 N N . PHE A 221 ? 0.8318 0.4851 0.5946 -0.0356 0.0875 -0.0375 302 PHE A N 1570 C CA . PHE A 221 ? 0.8051 0.4605 0.5738 -0.0246 0.0842 -0.0277 302 PHE A CA 1571 C C . PHE A 221 ? 0.9011 0.5444 0.6663 -0.0131 0.0888 -0.0210 302 PHE A C 1572 O O . PHE A 221 ? 0.9610 0.5854 0.7153 -0.0137 0.0981 -0.0232 302 PHE A O 1573 C CB . PHE A 221 ? 0.9144 0.5601 0.6787 -0.0269 0.0877 -0.0263 302 PHE A CB 1574 C CG . PHE A 221 ? 0.7936 0.4479 0.5657 -0.0179 0.0817 -0.0175 302 PHE A CG 1575 C CD1 . PHE A 221 ? 0.9754 0.6519 0.7593 -0.0191 0.0716 -0.0175 302 PHE A CD1 1576 C CD2 . PHE A 221 ? 0.9014 0.5420 0.6687 -0.0082 0.0864 -0.0093 302 PHE A CD2 1577 C CE1 . PHE A 221 ? 0.9185 0.6029 0.7090 -0.0116 0.0661 -0.0101 302 PHE A CE1 1578 C CE2 . PHE A 221 ? 0.9615 0.6117 0.7358 -0.0004 0.0805 -0.0014 302 PHE A CE2 1579 C CZ . PHE A 221 ? 0.8586 0.5304 0.6442 -0.0026 0.0704 -0.0022 302 PHE A CZ 1580 N N . LEU A 222 ? 0.7459 0.4006 0.5205 -0.0028 0.0824 -0.0127 303 LEU A N 1581 C CA . LEU A 222 ? 0.8493 0.4973 0.6231 0.0089 0.0855 -0.0055 303 LEU A CA 1582 C C . LEU A 222 ? 0.8520 0.5042 0.6309 0.0184 0.0822 0.0042 303 LEU A C 1583 O O . LEU A 222 ? 0.8332 0.5028 0.6218 0.0179 0.0733 0.0057 303 LEU A O 1584 C CB . LEU A 222 ? 0.7857 0.4493 0.5678 0.0116 0.0796 -0.0057 303 LEU A CB 1585 C CG . LEU A 222 ? 0.8515 0.5085 0.6317 0.0211 0.0840 -0.0012 303 LEU A CG 1586 C CD1 . LEU A 222 ? 0.8948 0.5697 0.6875 0.0304 0.0760 0.0066 303 LEU A CD1 1587 C CD2 . LEU A 222 ? 0.7440 0.3759 0.5119 0.0266 0.0956 0.0023 303 LEU A CD2 1588 N N . GLU A 223 ? 0.7887 0.4250 0.5607 0.0270 0.0896 0.0107 304 GLU A N 1589 C CA . GLU A 223 ? 0.9462 0.5895 0.7240 0.0378 0.0859 0.0208 304 GLU A CA 1590 C C . GLU A 223 ? 0.9976 0.6362 0.7748 0.0494 0.0901 0.0276 304 GLU A C 1591 O O . GLU A 223 ? 0.9321 0.5528 0.6996 0.0505 0.0995 0.0257 304 GLU A O 1592 C CB . GLU A 223 ? 1.0602 0.6926 0.8315 0.0383 0.0896 0.0242 304 GLU A CB 1593 C CG . GLU A 223 ? 1.3121 0.9169 1.0686 0.0407 0.1027 0.0255 304 GLU A CG 1594 C CD . GLU A 223 ? 1.4549 1.0492 1.2049 0.0418 0.1063 0.0298 304 GLU A CD 1595 O OE1 . GLU A 223 ? 1.4541 1.0300 1.1948 0.0498 0.1154 0.0361 304 GLU A OE1 1596 O OE2 . GLU A 223 ? 1.3067 0.9108 1.0605 0.0349 0.1006 0.0271 304 GLU A OE2 1597 N N . PHE A 224 ? 0.9229 0.5781 0.7103 0.0579 0.0831 0.0352 305 PHE A N 1598 C CA . PHE A 224 ? 0.8819 0.5360 0.6704 0.0700 0.0863 0.0430 305 PHE A CA 1599 C C . PHE A 224 ? 0.8239 0.4932 0.6209 0.0789 0.0800 0.0527 305 PHE A C 1600 O O . PHE A 224 ? 0.8486 0.5327 0.6527 0.0751 0.0713 0.0524 305 PHE A O 1601 C CB . PHE A 224 ? 0.7193 0.3821 0.5133 0.0700 0.0843 0.0401 305 PHE A CB 1602 C CG . PHE A 224 ? 0.8004 0.4878 0.6079 0.0663 0.0724 0.0384 305 PHE A CG 1603 C CD1 . PHE A 224 ? 0.8920 0.5973 0.7106 0.0739 0.0657 0.0457 305 PHE A CD1 1604 C CD2 . PHE A 224 ? 0.7764 0.4692 0.5853 0.0551 0.0683 0.0296 305 PHE A CD2 1605 C CE1 . PHE A 224 ? 0.8456 0.5717 0.6758 0.0700 0.0556 0.0440 305 PHE A CE1 1606 C CE2 . PHE A 224 ? 0.7075 0.4214 0.5281 0.0523 0.0582 0.0284 305 PHE A CE2 1607 C CZ . PHE A 224 ? 0.7080 0.4375 0.5390 0.0596 0.0521 0.0355 305 PHE A CZ 1608 N N . ASP A 225 ? 0.8178 0.4833 0.6136 0.0908 0.0846 0.0611 306 ASP A N 1609 C CA . ASP A 225 ? 0.8307 0.5118 0.6343 0.1002 0.0793 0.0710 306 ASP A CA 1610 C C . ASP A 225 ? 0.8934 0.5909 0.7075 0.1059 0.0752 0.0741 306 ASP A C 1611 O O . ASP A 225 ? 0.9163 0.6131 0.7315 0.1018 0.0760 0.0682 306 ASP A O 1612 C CB . ASP A 225 ? 0.8593 0.5252 0.6537 0.1104 0.0879 0.0795 306 ASP A CB 1613 C CG . ASP A 225 ? 1.1187 0.7680 0.9060 0.1186 0.0988 0.0821 306 ASP A CG 1614 O OD1 . ASP A 225 ? 1.1064 0.7557 0.8954 0.1159 0.0999 0.0769 306 ASP A OD1 1615 O OD2 . ASP A 225 ? 1.0705 0.7060 0.8498 0.1280 0.1069 0.0894 306 ASP A OD2 1616 N N . GLN A 226 ? 0.9450 0.6575 0.7666 0.1152 0.0713 0.0833 307 GLN A N 1617 C CA . GLN A 226 ? 0.8909 0.6222 0.7240 0.1195 0.0664 0.0863 307 GLN A CA 1618 C C . GLN A 226 ? 0.9633 0.6851 0.7930 0.1287 0.0753 0.0899 307 GLN A C 1619 O O . GLN A 226 ? 0.8626 0.5975 0.7008 0.1316 0.0728 0.0913 307 GLN A O 1620 C CB . GLN A 226 ? 1.0089 0.7620 0.8518 0.1246 0.0583 0.0941 307 GLN A CB 1621 C CG . GLN A 226 ? 1.2271 0.9741 1.0638 0.1332 0.0623 0.1024 307 GLN A CG 1622 C CD . GLN A 226 ? 1.4225 1.1921 1.2690 0.1417 0.0564 0.1120 307 GLN A CD 1623 O OE1 . GLN A 226 ? 1.4191 1.2082 1.2772 0.1412 0.0500 0.1123 307 GLN A OE1 1624 N NE2 . GLN A 226 ? 1.4781 1.2459 1.3199 0.1496 0.0587 0.1201 307 GLN A NE2 1625 N N . SER A 227 ? 1.0195 0.7180 0.8365 0.1333 0.0862 0.0916 309 SER A N 1626 C CA . SER A 227 ? 1.0120 0.6973 0.8235 0.1418 0.0965 0.0942 309 SER A CA 1627 C C . SER A 227 ? 1.0539 0.7238 0.8581 0.1326 0.1013 0.0834 309 SER A C 1628 O O . SER A 227 ? 1.2400 0.8934 1.0362 0.1370 0.1114 0.0830 309 SER A O 1629 C CB . SER A 227 ? 1.1922 0.8580 0.9924 0.1514 0.1068 0.1013 309 SER A CB 1630 O OG . SER A 227 ? 1.3110 0.9927 1.1177 0.1605 0.1021 0.1117 309 SER A OG 1631 N N . PHE A 228 ? 0.9012 0.5772 0.7080 0.1199 0.0943 0.0748 310 PHE A N 1632 C CA . PHE A 228 ? 0.8678 0.5322 0.6680 0.1093 0.0973 0.0640 310 PHE A CA 1633 C C . PHE A 228 ? 0.9149 0.5499 0.6986 0.1079 0.1097 0.0606 310 PHE A C 1634 O O . PHE A 228 ? 0.8959 0.5181 0.6721 0.1027 0.1156 0.0533 310 PHE A O 1635 C CB . PHE A 228 ? 0.9326 0.6048 0.7378 0.1101 0.0967 0.0617 310 PHE A CB 1636 C CG . PHE A 228 ? 0.9009 0.5987 0.7202 0.1059 0.0846 0.0608 310 PHE A CG 1637 C CD1 . PHE A 228 ? 0.8913 0.6033 0.7180 0.1023 0.0754 0.0619 310 PHE A CD1 1638 C CD2 . PHE A 228 ? 0.9426 0.6494 0.7671 0.1055 0.0830 0.0585 310 PHE A CD2 1639 C CE1 . PHE A 228 ? 0.9407 0.6745 0.7796 0.0983 0.0651 0.0607 310 PHE A CE1 1640 C CE2 . PHE A 228 ? 0.9255 0.6546 0.7625 0.1016 0.0725 0.0578 310 PHE A CE2 1641 C CZ . PHE A 228 ? 0.8209 0.5628 0.6649 0.0979 0.0638 0.0588 310 PHE A CZ 1642 N N . THR A 229 ? 0.9307 0.5548 0.7083 0.1124 0.1138 0.0659 311 THR A N 1643 C CA . THR A 229 ? 0.8535 0.4495 0.6153 0.1085 0.1248 0.0619 311 THR A CA 1644 C C . THR A 229 ? 1.0164 0.6134 0.7770 0.0934 0.1200 0.0521 311 THR A C 1645 O O . THR A 229 ? 1.0075 0.6199 0.7757 0.0905 0.1110 0.0534 311 THR A O 1646 C CB . THR A 229 ? 1.0099 0.5943 0.7655 0.1185 0.1309 0.0714 311 THR A CB 1647 O OG1 . THR A 229 ? 1.1705 0.7463 0.9229 0.1321 0.1394 0.0790 311 THR A OG1 1648 C CG2 . THR A 229 ? 0.7734 0.3321 0.5142 0.1109 0.1395 0.0662 311 THR A CG2 1649 N N . TYR A 230 ? 0.9631 0.5449 0.7144 0.0837 0.1259 0.0422 312 TYR A N 1650 C CA . TYR A 230 ? 0.9324 0.5197 0.6846 0.0690 0.1203 0.0325 312 TYR A CA 1651 C C . TYR A 230 ? 0.8709 0.4340 0.6083 0.0590 0.1299 0.0245 312 TYR A C 1652 O O . TYR A 230 ? 0.8786 0.4184 0.6036 0.0615 0.1417 0.0239 312 TYR A O 1653 C CB . TYR A 230 ? 0.8824 0.4881 0.6435 0.0632 0.1125 0.0264 312 TYR A CB 1654 C CG . TYR A 230 ? 1.0324 0.6251 0.7848 0.0596 0.1201 0.0195 312 TYR A CG 1655 C CD1 . TYR A 230 ? 0.9219 0.5035 0.6651 0.0466 0.1239 0.0088 312 TYR A CD1 1656 C CD2 . TYR A 230 ? 0.7285 0.3209 0.4820 0.0689 0.1234 0.0236 312 TYR A CD2 1657 C CE1 . TYR A 230 ? 0.7922 0.3621 0.5266 0.0426 0.1308 0.0020 312 TYR A CE1 1658 C CE2 . TYR A 230 ? 1.0734 0.6536 0.8182 0.0655 0.1305 0.0170 312 TYR A CE2 1659 C CZ . TYR A 230 ? 1.0040 0.5727 0.7389 0.0522 0.1342 0.0060 312 TYR A CZ 1660 O OH . TYR A 230 ? 1.0673 0.6242 0.7927 0.0480 0.1413 -0.0012 312 TYR A OH 1661 N N . THR A 231 ? 0.9466 0.5162 0.6856 0.0475 0.1247 0.0181 313 THR A N 1662 C CA . THR A 231 ? 0.9762 0.5267 0.7027 0.0358 0.1324 0.0096 313 THR A CA 1663 C C . THR A 231 ? 1.1040 0.6706 0.8363 0.0220 0.1243 0.0000 313 THR A C 1664 O O . THR A 231 ? 0.9492 0.5359 0.6924 0.0206 0.1141 0.0014 313 THR A O 1665 C CB . THR A 231 ? 0.9715 0.5065 0.6904 0.0374 0.1381 0.0141 313 THR A CB 1666 O OG1 . THR A 231 ? 1.0939 0.6151 0.8077 0.0515 0.1456 0.0241 313 THR A OG1 1667 C CG2 . THR A 231 ? 0.8513 0.3651 0.5567 0.0247 0.1473 0.0049 313 THR A CG2 1668 N N . PHE A 232 ? 1.1222 0.6802 0.8468 0.0118 0.1291 -0.0098 314 PHE A N 1669 C CA . PHE A 232 ? 0.9708 0.5421 0.6988 -0.0020 0.1231 -0.0193 314 PHE A CA 1670 C C . PHE A 232 ? 0.9194 0.4764 0.6384 -0.0114 0.1290 -0.0236 314 PHE A C 1671 O O . PHE A 232 ? 1.0043 0.5351 0.7095 -0.0120 0.1409 -0.0243 314 PHE A O 1672 C CB . PHE A 232 ? 0.7468 0.3193 0.4714 -0.0090 0.1244 -0.0280 314 PHE A CB 1673 C CG . PHE A 232 ? 0.7976 0.3936 0.5347 -0.0045 0.1145 -0.0261 314 PHE A CG 1674 C CD1 . PHE A 232 ? 0.7891 0.4104 0.5394 -0.0071 0.1025 -0.0261 314 PHE A CD1 1675 C CD2 . PHE A 232 ? 0.7496 0.3420 0.4849 0.0023 0.1176 -0.0245 314 PHE A CD2 1676 C CE1 . PHE A 232 ? 0.6800 0.3217 0.4412 -0.0031 0.0940 -0.0243 314 PHE A CE1 1677 C CE2 . PHE A 232 ? 0.8519 0.4657 0.5985 0.0061 0.1089 -0.0227 314 PHE A CE2 1678 C CZ . PHE A 232 ? 0.8772 0.5152 0.6366 0.0033 0.0971 -0.0225 314 PHE A CZ 1679 N N . LYS A 233 ? 0.8363 0.4098 0.5628 -0.0188 0.1211 -0.0264 315 LYS A N 1680 C CA . LYS A 233 ? 0.9537 0.5167 0.6732 -0.0284 0.1259 -0.0305 315 LYS A CA 1681 C C . LYS A 233 ? 0.9444 0.5229 0.6677 -0.0427 0.1208 -0.0406 315 LYS A C 1682 O O . LYS A 233 ? 0.8884 0.4913 0.6237 -0.0430 0.1103 -0.0415 315 LYS A O 1683 C CB . LYS A 233 ? 1.0095 0.5767 0.7340 -0.0220 0.1223 -0.0223 315 LYS A CB 1684 C CG . LYS A 233 ? 0.9641 0.5161 0.6840 -0.0079 0.1279 -0.0115 315 LYS A CG 1685 C CD . LYS A 233 ? 1.1660 0.7082 0.8811 -0.0075 0.1313 -0.0072 315 LYS A CD 1686 C CE . LYS A 233 ? 1.2500 0.7874 0.9652 0.0079 0.1325 0.0051 315 LYS A CE 1687 N NZ . LYS A 233 ? 1.3516 0.9158 1.0819 0.0148 0.1197 0.0107 315 LYS A NZ 1688 N N . GLU A 234 ? 0.9780 0.5425 0.6911 -0.0546 0.1285 -0.0480 316 GLU A N 1689 C CA . GLU A 234 ? 0.9226 0.5021 0.6388 -0.0689 0.1244 -0.0575 316 GLU A CA 1690 C C . GLU A 234 ? 0.9304 0.5101 0.6474 -0.0741 0.1245 -0.0571 316 GLU A C 1691 O O . GLU A 234 ? 1.1874 0.7441 0.8931 -0.0761 0.1345 -0.0565 316 GLU A O 1692 C CB . GLU A 234 ? 0.9666 0.5318 0.6704 -0.0807 0.1331 -0.0678 316 GLU A CB 1693 C CG . GLU A 234 ? 1.0143 0.5963 0.7208 -0.0962 0.1292 -0.0781 316 GLU A CG 1694 C CD . GLU A 234 ? 1.1910 0.8017 0.9097 -0.0957 0.1177 -0.0799 316 GLU A CD 1695 O OE1 . GLU A 234 ? 1.3389 0.9520 1.0603 -0.0860 0.1151 -0.0757 316 GLU A OE1 1696 O OE2 . GLU A 234 ? 1.2435 0.8749 0.9691 -0.1049 0.1115 -0.0853 316 GLU A OE2 1697 N N . PRO A 235 ? 0.9603 0.5655 0.6901 -0.0761 0.1140 -0.0572 317 PRO A N 1698 C CA . PRO A 235 ? 0.9984 0.6074 0.7304 -0.0808 0.1131 -0.0569 317 PRO A CA 1699 C C . PRO A 235 ? 1.0993 0.6963 0.8211 -0.0959 0.1217 -0.0660 317 PRO A C 1700 O O . PRO A 235 ? 1.1057 0.7079 0.8256 -0.1061 0.1223 -0.0749 317 PRO A O 1701 C CB . PRO A 235 ? 0.8695 0.5097 0.6168 -0.0818 0.1005 -0.0579 317 PRO A CB 1702 C CG . PRO A 235 ? 0.8524 0.5035 0.6023 -0.0843 0.0971 -0.0631 317 PRO A CG 1703 C CD . PRO A 235 ? 0.9515 0.5834 0.6936 -0.0757 0.1031 -0.0591 317 PRO A CD 1704 N N . CYS A 236 ? 1.1682 0.7499 0.8833 -0.0977 0.1283 -0.0638 318 CYS A N 1705 C CA . CYS A 236 ? 1.1272 0.6933 0.8310 -0.1119 0.1383 -0.0718 318 CYS A CA 1706 C C . CYS A 236 ? 1.1570 0.7425 0.8680 -0.1233 0.1338 -0.0773 318 CYS A C 1707 O O . CYS A 236 ? 1.2806 0.8555 0.9837 -0.1354 0.1415 -0.0832 318 CYS A O 1708 C CB . CYS A 236 ? 0.9547 0.4891 0.6448 -0.1077 0.1503 -0.0665 318 CYS A CB 1709 S SG . CYS A 236 ? 1.4300 0.9372 1.1084 -0.0965 0.1592 -0.0619 318 CYS A SG 1710 N N . LEU A 237 ? 0.9932 0.6073 0.7192 -0.1196 0.1216 -0.0755 319 LEU A N 1711 C CA . LEU A 237 ? 0.8289 0.4634 0.5635 -0.1274 0.1165 -0.0787 319 LEU A CA 1712 C C . LEU A 237 ? 1.0004 0.6576 0.7414 -0.1383 0.1114 -0.0879 319 LEU A C 1713 O O . LEU A 237 ? 1.1512 0.8228 0.8988 -0.1339 0.1044 -0.0880 319 LEU A O 1714 C CB . LEU A 237 ? 0.8445 0.4953 0.5912 -0.1158 0.1068 -0.0703 319 LEU A CB 1715 C CG . LEU A 237 ? 0.9191 0.5507 0.6599 -0.1053 0.1110 -0.0610 319 LEU A CG 1716 C CD1 . LEU A 237 ? 0.7183 0.3663 0.4704 -0.0947 0.1015 -0.0532 319 LEU A CD1 1717 C CD2 . LEU A 237 ? 0.8626 0.4760 0.5928 -0.1139 0.1212 -0.0631 319 LEU A CD2 1718 N N . GLY A 238 ? 1.0769 0.7388 0.8163 -0.1524 0.1147 -0.0953 320 GLY A N 1719 C CA . GLY A 238 ? 1.0650 0.7507 0.8106 -0.1637 0.1101 -0.1042 320 GLY A CA 1720 C C . GLY A 238 ? 1.2169 0.9356 0.9792 -0.1592 0.0977 -0.1021 320 GLY A C 1721 O O . GLY A 238 ? 1.3865 1.1274 1.1548 -0.1671 0.0931 -0.1084 320 GLY A O 1722 N N . PHE A 239 ? 1.1128 0.8346 0.8821 -0.1465 0.0924 -0.0931 321 PHE A N 1723 C CA . PHE A 239 ? 0.8453 0.5947 0.6296 -0.1397 0.0810 -0.0899 321 PHE A CA 1724 C C . PHE A 239 ? 0.9135 0.6682 0.7010 -0.1314 0.0755 -0.0877 321 PHE A C 1725 O O . PHE A 239 ? 0.8955 0.6398 0.6825 -0.1195 0.0743 -0.0804 321 PHE A O 1726 C CB . PHE A 239 ? 0.8699 0.6165 0.6582 -0.1299 0.0789 -0.0816 321 PHE A CB 1727 C CG . PHE A 239 ? 0.8784 0.6512 0.6810 -0.1251 0.0691 -0.0791 321 PHE A CG 1728 C CD1 . PHE A 239 ? 0.7745 0.5653 0.5832 -0.1333 0.0677 -0.0835 321 PHE A CD1 1729 C CD2 . PHE A 239 ? 0.8861 0.6647 0.6957 -0.1122 0.0619 -0.0720 321 PHE A CD2 1730 C CE1 . PHE A 239 ? 0.8472 0.6610 0.6687 -0.1280 0.0595 -0.0808 321 PHE A CE1 1731 C CE2 . PHE A 239 ? 0.7591 0.5595 0.5808 -0.1077 0.0538 -0.0698 321 PHE A CE2 1732 C CZ . PHE A 239 ? 0.7228 0.5403 0.5503 -0.1152 0.0527 -0.0740 321 PHE A CZ 1733 N N . LEU A 240 ? 0.8395 0.6109 0.6301 -0.1378 0.0722 -0.0939 322 LEU A N 1734 C CA . LEU A 240 ? 0.7385 0.5133 0.5299 -0.1319 0.0683 -0.0931 322 LEU A CA 1735 C C . LEU A 240 ? 0.7830 0.5759 0.5872 -0.1198 0.0582 -0.0862 322 LEU A C 1736 O O . LEU A 240 ? 0.9618 0.7766 0.7764 -0.1203 0.0521 -0.0861 322 LEU A O 1737 C CB . LEU A 240 ? 0.8544 0.6419 0.6441 -0.1434 0.0682 -0.1022 322 LEU A CB 1738 C CG . LEU A 240 ? 0.9149 0.6897 0.6934 -0.1585 0.0776 -0.1107 322 LEU A CG 1739 C CD1 . LEU A 240 ? 0.7995 0.5914 0.5776 -0.1700 0.0760 -0.1197 322 LEU A CD1 1740 C CD2 . LEU A 240 ? 1.0710 0.8114 0.8349 -0.1571 0.0878 -0.1097 322 LEU A CD2 1741 N N . GLY A 241 ? 0.7768 0.5606 0.5803 -0.1090 0.0569 -0.0803 323 GLY A N 1742 C CA . GLY A 241 ? 0.7902 0.5869 0.6046 -0.0973 0.0485 -0.0731 323 GLY A CA 1743 C C . GLY A 241 ? 0.9700 0.7868 0.7915 -0.0954 0.0415 -0.0742 323 GLY A C 1744 O O . GLY A 241 ? 0.9704 0.8048 0.8027 -0.0894 0.0340 -0.0704 323 GLY A O 1745 N N . ASP A 242 ? 0.8211 0.6349 0.6360 -0.1005 0.0443 -0.0793 324 ASP A N 1746 C CA . ASP A 242 ? 0.8066 0.6383 0.6269 -0.0983 0.0381 -0.0799 324 ASP A CA 1747 C C . ASP A 242 ? 0.8158 0.6740 0.6439 -0.1047 0.0328 -0.0840 324 ASP A C 1748 O O . ASP A 242 ? 0.7603 0.6228 0.5880 -0.1137 0.0350 -0.0886 324 ASP A O 1749 C CB . ASP A 242 ? 0.8370 0.6582 0.6473 -0.1018 0.0426 -0.0842 324 ASP A CB 1750 C CG . ASP A 242 ? 0.9041 0.7313 0.7184 -0.0922 0.0377 -0.0796 324 ASP A CG 1751 O OD1 . ASP A 242 ? 0.9347 0.7804 0.7601 -0.0860 0.0299 -0.0753 324 ASP A OD1 1752 O OD2 . ASP A 242 ? 1.0728 0.8857 0.8790 -0.0907 0.0421 -0.0802 324 ASP A OD2 1753 N N . THR A 243 ? 0.7675 0.6437 0.6029 -0.0995 0.0259 -0.0819 325 THR A N 1754 C CA . THR A 243 ? 0.9053 0.8085 0.7477 -0.1039 0.0205 -0.0852 325 THR A CA 1755 C C . THR A 243 ? 0.9294 0.8397 0.7699 -0.1025 0.0180 -0.0862 325 THR A C 1756 O O . THR A 243 ? 0.9278 0.8358 0.7711 -0.0923 0.0150 -0.0802 325 THR A O 1757 C CB . THR A 243 ? 0.7971 0.7168 0.6524 -0.0957 0.0137 -0.0791 325 THR A CB 1758 O OG1 . THR A 243 ? 1.0375 0.9502 0.8939 -0.0970 0.0162 -0.0782 325 THR A OG1 1759 C CG2 . THR A 243 ? 0.6706 0.6189 0.5334 -0.0988 0.0083 -0.0815 325 THR A CG2 1760 N N . PRO A 244 ? 0.8723 0.7920 0.7078 -0.1132 0.0192 -0.0940 326 PRO A N 1761 C CA . PRO A 244 ? 0.9155 0.8418 0.7486 -0.1264 0.0222 -0.1016 326 PRO A CA 1762 C C . PRO A 244 ? 0.9566 0.8566 0.7782 -0.1343 0.0317 -0.1060 326 PRO A C 1763 O O . PRO A 244 ? 0.9536 0.8292 0.7677 -0.1295 0.0364 -0.1035 326 PRO A O 1764 C CB . PRO A 244 ? 0.7822 0.7258 0.6123 -0.1342 0.0203 -0.1080 326 PRO A CB 1765 C CG . PRO A 244 ? 0.6814 0.6120 0.5051 -0.1283 0.0213 -0.1061 326 PRO A CG 1766 C CD . PRO A 244 ? 0.8614 0.7863 0.6927 -0.1133 0.0178 -0.0960 326 PRO A CD 1767 N N . ARG A 245 ? 0.8456 0.7515 0.6658 -0.1465 0.0345 -0.1125 327 ARG A N 1768 C CA . ARG A 245 ? 0.8477 0.7305 0.6573 -0.1556 0.0439 -0.1172 327 ARG A CA 1769 C C . ARG A 245 ? 0.9714 0.8705 0.7820 -0.1702 0.0450 -0.1252 327 ARG A C 1770 O O . ARG A 245 ? 0.8840 0.8116 0.7056 -0.1703 0.0381 -0.1248 327 ARG A O 1771 C CB . ARG A 245 ? 0.7874 0.6526 0.5985 -0.1473 0.0462 -0.1102 327 ARG A CB 1772 C CG . ARG A 245 ? 0.6436 0.5267 0.4665 -0.1455 0.0415 -0.1071 327 ARG A CG 1773 C CD . ARG A 245 ? 0.8610 0.7245 0.6826 -0.1397 0.0451 -0.1015 327 ARG A CD 1774 N NE . ARG A 245 ? 0.9514 0.8296 0.7828 -0.1384 0.0416 -0.0990 327 ARG A NE 1775 C CZ . ARG A 245 ? 0.8896 0.7827 0.7322 -0.1279 0.0342 -0.0928 327 ARG A CZ 1776 N NH1 . ARG A 245 ? 0.7544 0.6500 0.6000 -0.1182 0.0293 -0.0883 327 ARG A NH1 1777 N NH2 . ARG A 245 ? 0.7871 0.6921 0.6375 -0.1273 0.0321 -0.0911 327 ARG A NH2 1778 N N . GLY A 246 ? 0.9626 0.8436 0.7617 -0.1823 0.0540 -0.1321 328 GLY A N 1779 C CA . GLY A 246 ? 0.9116 0.8055 0.7108 -0.1974 0.0562 -0.1400 328 GLY A CA 1780 C C . GLY A 246 ? 1.0840 0.9705 0.8859 -0.1983 0.0597 -0.1376 328 GLY A C 1781 O O . GLY A 246 ? 1.2280 1.1112 1.0365 -0.1859 0.0568 -0.1291 328 GLY A O 1782 N N . ILE A 247 ? 1.0625 0.9464 0.8588 -0.2134 0.0662 -0.1453 329 ILE A N 1783 C CA . ILE A 247 ? 0.9346 0.8115 0.7323 -0.2161 0.0705 -0.1439 329 ILE A CA 1784 C C . ILE A 247 ? 0.9746 0.8149 0.7622 -0.2092 0.0780 -0.1389 329 ILE A C 1785 O O . ILE A 247 ? 0.8947 0.7122 0.6704 -0.2097 0.0836 -0.1407 329 ILE A O 1786 C CB . ILE A 247 ? 1.1112 0.9930 0.9040 -0.2355 0.0765 -0.1542 329 ILE A CB 1787 C CG1 . ILE A 247 ? 1.1341 1.0523 0.9352 -0.2429 0.0693 -0.1598 329 ILE A CG1 1788 C CG2 . ILE A 247 ? 1.1991 1.0795 0.9955 -0.2385 0.0799 -0.1526 329 ILE A CG2 1789 C CD1 . ILE A 247 ? 1.0648 1.0136 0.8831 -0.2323 0.0590 -0.1531 329 ILE A CD1 1790 N N . ASP A 248 ? 0.9003 0.7353 0.6923 -0.2026 0.0782 -0.1325 330 ASP A N 1791 C CA . ASP A 248 ? 0.8958 0.6981 0.6784 -0.1962 0.0854 -0.1272 330 ASP A CA 1792 C C . ASP A 248 ? 1.0460 0.8231 0.8133 -0.2095 0.0975 -0.1342 330 ASP A C 1793 O O . ASP A 248 ? 1.0049 0.7906 0.7710 -0.2244 0.1008 -0.1421 330 ASP A O 1794 C CB . ASP A 248 ? 0.7837 0.5878 0.5736 -0.1886 0.0835 -0.1200 330 ASP A CB 1795 C CG . ASP A 248 ? 1.0562 0.8724 0.8571 -0.1723 0.0739 -0.1113 330 ASP A CG 1796 O OD1 . ASP A 248 ? 1.1461 0.9626 0.9472 -0.1654 0.0701 -0.1095 330 ASP A OD1 1797 O OD2 . ASP A 248 ? 0.9298 0.7545 0.7387 -0.1668 0.0705 -0.1064 330 ASP A OD2 1798 N N . THR A 249 ? 1.1050 0.8510 0.8603 -0.2043 0.1046 -0.1314 333 THR A N 1799 C CA . THR A 249 ? 1.1131 0.8315 0.8521 -0.2159 0.1171 -0.1378 333 THR A CA 1800 C C . THR A 249 ? 1.0359 0.7267 0.7671 -0.2127 0.1257 -0.1326 333 THR A C 1801 O O . THR A 249 ? 1.1514 0.8447 0.8895 -0.2014 0.1217 -0.1240 333 THR A O 1802 C CB . THR A 249 ? 1.1854 0.8864 0.9138 -0.2141 0.1208 -0.1401 333 THR A CB 1803 O OG1 . THR A 249 ? 1.4223 1.0981 1.1454 -0.1995 0.1242 -0.1310 333 THR A OG1 1804 C CG2 . THR A 249 ? 0.9735 0.7016 0.7112 -0.2108 0.1102 -0.1413 333 THR A CG2 1805 N N . THR A 250 ? 1.2146 0.8785 0.9306 -0.2229 0.1380 -0.1378 334 THR A N 1806 C CA . THR A 250 ? 1.2771 0.9100 0.9828 -0.2187 0.1476 -0.1322 334 THR A CA 1807 C C . THR A 250 ? 1.2275 0.8430 0.9299 -0.2013 0.1474 -0.1231 334 THR A C 1808 O O . THR A 250 ? 1.2525 0.8757 0.9578 -0.1958 0.1420 -0.1232 334 THR A O 1809 C CB . THR A 250 ? 1.3091 0.9151 0.9980 -0.2340 0.1619 -0.1404 334 THR A CB 1810 O OG1 . THR A 250 ? 1.3211 0.9073 0.9986 -0.2330 0.1673 -0.1431 334 THR A OG1 1811 C CG2 . THR A 250 ? 1.3651 0.9921 1.0573 -0.2533 0.1615 -0.1516 334 THR A CG2 1812 N N . ASN A 251 ? 1.1336 0.7262 0.8298 -0.1926 0.1532 -0.1151 335 ASN A N 1813 C CA . ASN A 251 ? 1.0537 0.6313 0.7473 -0.1758 0.1530 -0.1059 335 ASN A CA 1814 C C . ASN A 251 ? 1.1959 0.7437 0.8737 -0.1769 0.1639 -0.1086 335 ASN A C 1815 O O . ASN A 251 ? 1.2001 0.7220 0.8640 -0.1852 0.1764 -0.1119 335 ASN A O 1816 C CB . ASN A 251 ? 1.0639 0.6313 0.7577 -0.1648 0.1541 -0.0954 335 ASN A CB 1817 C CG . ASN A 251 ? 1.1860 0.7826 0.8959 -0.1598 0.1422 -0.0913 335 ASN A CG 1818 O OD1 . ASN A 251 ? 1.2466 0.8703 0.9684 -0.1605 0.1322 -0.0942 335 ASN A OD1 1819 N ND2 . ASN A 251 ? 1.2696 0.8602 0.9792 -0.1543 0.1435 -0.0844 335 ASN A ND2 1820 N N . TYR A 252 ? 1.2208 0.7721 0.9006 -0.1688 0.1597 -0.1072 336 TYR A N 1821 C CA . TYR A 252 ? 1.0992 0.6218 0.7646 -0.1662 0.1697 -0.1079 336 TYR A CA 1822 C C . TYR A 252 ? 1.1528 0.6771 0.8229 -0.1489 0.1644 -0.0995 336 TYR A C 1823 O O . TYR A 252 ? 1.1163 0.6664 0.8010 -0.1410 0.1521 -0.0950 336 TYR A O 1824 C CB . TYR A 252 ? 1.1410 0.6616 0.7984 -0.1821 0.1744 -0.1206 336 TYR A CB 1825 C CG . TYR A 252 ? 1.1636 0.7188 0.8332 -0.1877 0.1626 -0.1267 336 TYR A CG 1826 C CD1 . TYR A 252 ? 1.0399 0.6050 0.7137 -0.1794 0.1564 -0.1253 336 TYR A CD1 1827 C CD2 . TYR A 252 ? 1.0926 0.6708 0.7691 -0.2013 0.1583 -0.1337 336 TYR A CD2 1828 C CE1 . TYR A 252 ? 1.0672 0.6636 0.7514 -0.1843 0.1459 -0.1304 336 TYR A CE1 1829 C CE2 . TYR A 252 ? 1.1099 0.7205 0.7974 -0.2060 0.1478 -0.1388 336 TYR A CE2 1830 C CZ . TYR A 252 ? 1.1221 0.7412 0.8130 -0.1974 0.1417 -0.1370 336 TYR A CZ 1831 O OH . TYR A 252 ? 1.1129 0.7638 0.8140 -0.2015 0.1315 -0.1414 336 TYR A OH 1832 N N . CYS A 253 ? 1.3211 0.8177 0.9785 -0.1433 0.1740 -0.0975 337 CYS A N 1833 C CA . CYS A 253 ? 1.3233 0.8185 0.9844 -0.1254 0.1705 -0.0878 337 CYS A CA 1834 C C . CYS A 253 ? 1.2479 0.7554 0.9128 -0.1234 0.1653 -0.0911 337 CYS A C 1835 O O . CYS A 253 ? 1.3560 0.8690 1.0272 -0.1092 0.1601 -0.0833 337 CYS A O 1836 C CB . CYS A 253 ? 1.2637 0.7246 0.9114 -0.1160 0.1829 -0.0806 337 CYS A CB 1837 S SG . CYS A 253 ? 2.6523 2.1149 2.3066 -0.1018 0.1793 -0.0668 337 CYS A SG 1838 N N . ASP A 254 ? 1.1952 0.7082 0.8563 -0.1378 0.1663 -0.1026 339 ASP A N 1839 C CA . ASP A 254 ? 1.2961 0.8216 0.9602 -0.1363 0.1612 -0.1058 339 ASP A CA 1840 C C . ASP A 254 ? 1.2407 0.8028 0.9193 -0.1421 0.1479 -0.1099 339 ASP A C 1841 O O . ASP A 254 ? 1.2752 0.8547 0.9630 -0.1458 0.1419 -0.1095 339 ASP A O 1842 C CB . ASP A 254 ? 1.4044 0.9069 1.0518 -0.1452 0.1727 -0.1148 339 ASP A CB 1843 C CG . ASP A 254 ? 1.6225 1.1060 1.2572 -0.1609 0.1836 -0.1230 339 ASP A CG 1844 O OD1 . ASP A 254 ? 1.7594 1.2552 1.4003 -0.1679 0.1802 -0.1239 339 ASP A OD1 1845 O OD2 . ASP A 254 ? 1.6123 1.0682 1.2305 -0.1664 0.1961 -0.1285 339 ASP A OD2 1846 N N . LYS A 255 ? 1.2475 0.8211 0.9277 -0.1421 0.1438 -0.1135 340 LYS A N 1847 C CA . LYS A 255 ? 1.0722 0.6806 0.7668 -0.1430 0.1305 -0.1147 340 LYS A CA 1848 C C . LYS A 255 ? 1.1075 0.7336 0.8042 -0.1595 0.1280 -0.1243 340 LYS A C 1849 O O . LYS A 255 ? 1.3164 0.9295 1.0011 -0.1734 0.1366 -0.1335 340 LYS A O 1850 C CB . LYS A 255 ? 1.0538 0.6674 0.7473 -0.1396 0.1283 -0.1166 340 LYS A CB 1851 C CG . LYS A 255 ? 1.1421 0.7664 0.8468 -0.1227 0.1202 -0.1061 340 LYS A CG 1852 C CD . LYS A 255 ? 1.2408 0.8414 0.9370 -0.1119 0.1276 -0.1013 340 LYS A CD 1853 C CE . LYS A 255 ? 1.2224 0.8136 0.9068 -0.1185 0.1338 -0.1096 340 LYS A CE 1854 N NZ . LYS A 255 ? 1.3470 0.9666 1.0387 -0.1238 0.1242 -0.1147 340 LYS A NZ 1855 N N . THR A 256 ? 1.1890 0.8452 0.9011 -0.1581 0.1165 -0.1220 341 THR A N 1856 C CA . THR A 256 ? 1.1438 0.8235 0.8602 -0.1722 0.1122 -0.1306 341 THR A CA 1857 C C . THR A 256 ? 1.1165 0.8171 0.8369 -0.1722 0.1050 -0.1337 341 THR A C 1858 O O . THR A 256 ? 1.0460 0.7663 0.7787 -0.1616 0.0951 -0.1274 341 THR A O 1859 C CB . THR A 256 ? 1.0434 0.7446 0.7736 -0.1710 0.1045 -0.1267 341 THR A CB 1860 O OG1 . THR A 256 ? 1.0710 0.7520 0.7960 -0.1719 0.1119 -0.1242 341 THR A OG1 1861 C CG2 . THR A 256 ? 0.7943 0.5235 0.5302 -0.1847 0.0994 -0.1352 341 THR A CG2 1862 N N . THR A 257 ? 1.1351 0.8302 0.8443 -0.1843 0.1104 -0.1437 342 THR A N 1863 C CA . THR A 257 ? 1.1383 0.8487 0.8479 -0.1846 0.1054 -0.1471 342 THR A CA 1864 C C . THR A 257 ? 1.1047 0.8517 0.8249 -0.1926 0.0955 -0.1516 342 THR A C 1865 O O . THR A 257 ? 1.1492 0.9162 0.8746 -0.1892 0.0880 -0.1512 342 THR A O 1866 C CB . THR A 257 ? 1.1318 0.8200 0.8235 -0.1943 0.1159 -0.1562 342 THR A CB 1867 O OG1 . THR A 257 ? 1.1702 0.8524 0.8537 -0.2117 0.1227 -0.1658 342 THR A OG1 1868 C CG2 . THR A 257 ? 1.0982 0.7519 0.7800 -0.1836 0.1253 -0.1506 342 THR A CG2 1869 N N . THR A 258 ? 1.0121 0.7679 0.7353 -0.2029 0.0957 -0.1554 343 THR A N 1870 C CA . THR A 258 ? 1.0010 0.7921 0.7342 -0.2114 0.0873 -0.1600 343 THR A CA 1871 C C . THR A 258 ? 0.9282 0.7448 0.6785 -0.1977 0.0754 -0.1506 343 THR A C 1872 O O . THR A 258 ? 1.0206 0.8328 0.7781 -0.1880 0.0738 -0.1425 343 THR A O 1873 C CB . THR A 258 ? 1.0914 0.8851 0.8248 -0.2245 0.0909 -0.1651 343 THR A CB 1874 O OG1 . THR A 258 ? 1.1568 0.9196 0.8736 -0.2353 0.1038 -0.1719 343 THR A OG1 1875 C CG2 . THR A 258 ? 0.9900 0.8196 0.7309 -0.2360 0.0840 -0.1719 343 THR A CG2 1876 N N . GLU A 259 ? 0.9330 0.7757 0.6890 -0.1971 0.0673 -0.1518 344 GLU A N 1877 C CA . GLU A 259 ? 1.0083 0.8740 0.7793 -0.1837 0.0564 -0.1430 344 GLU A CA 1878 C C . GLU A 259 ? 1.1236 0.9709 0.8957 -0.1672 0.0565 -0.1331 344 GLU A C 1879 O O . GLU A 259 ? 1.2281 1.0857 1.0122 -0.1555 0.0498 -0.1246 344 GLU A O 1880 C CB . GLU A 259 ? 1.1258 1.0114 0.9097 -0.1841 0.0514 -0.1404 344 GLU A CB 1881 C CG . GLU A 259 ? 1.1133 1.0268 0.9005 -0.1980 0.0485 -0.1484 344 GLU A CG 1882 C CD . GLU A 259 ? 1.3180 1.2647 1.1217 -0.1911 0.0381 -0.1429 344 GLU A CD 1883 O OE1 . GLU A 259 ? 1.2131 1.1734 1.0239 -0.1961 0.0371 -0.1439 344 GLU A OE1 1884 O OE2 . GLU A 259 ? 1.3975 1.3563 1.2070 -0.1803 0.0313 -0.1374 344 GLU A OE2 1885 N N . GLY A 260 ? 1.0815 0.9021 0.8410 -0.1666 0.0643 -0.1346 345 GLY A N 1886 C CA . GLY A 260 ? 0.9050 0.7065 0.6643 -0.1520 0.0658 -0.1258 345 GLY A CA 1887 C C . GLY A 260 ? 0.9686 0.7806 0.7322 -0.1419 0.0597 -0.1213 345 GLY A C 1888 O O . GLY A 260 ? 1.1592 0.9574 0.9230 -0.1300 0.0607 -0.1141 345 GLY A O 1889 N N . GLU A 261 ? 0.9201 0.7570 0.6870 -0.1466 0.0536 -0.1252 346 GLU A N 1890 C CA . GLU A 261 ? 0.8855 0.7340 0.6568 -0.1370 0.0475 -0.1205 346 GLU A CA 1891 C C . GLU A 261 ? 0.8500 0.7206 0.6374 -0.1275 0.0378 -0.1124 346 GLU A C 1892 O O . GLU A 261 ? 0.9134 0.7980 0.7078 -0.1317 0.0348 -0.1133 346 GLU A O 1893 C CB . GLU A 261 ? 0.8146 0.6783 0.5800 -0.1462 0.0461 -0.1285 346 GLU A CB 1894 C CG . GLU A 261 ? 0.9539 0.8244 0.7203 -0.1370 0.0420 -0.1243 346 GLU A CG 1895 C CD . GLU A 261 ? 1.2559 1.1401 1.0145 -0.1465 0.0412 -0.1326 346 GLU A CD 1896 O OE1 . GLU A 261 ? 1.3133 1.2072 1.0680 -0.1605 0.0421 -0.1413 346 GLU A OE1 1897 O OE2 . GLU A 261 ? 1.2268 1.1126 0.9830 -0.1404 0.0397 -0.1304 346 GLU A OE2 1898 N N . GLY A 262 ? 0.8207 0.6942 0.6138 -0.1149 0.0334 -0.1048 347 GLY A N 1899 C CA . GLY A 262 ? 0.8648 0.7547 0.6721 -0.1051 0.0254 -0.0966 347 GLY A CA 1900 C C . GLY A 262 ? 0.8836 0.7575 0.6947 -0.0979 0.0273 -0.0903 347 GLY A C 1901 O O . GLY A 262 ? 0.8608 0.7106 0.6638 -0.0979 0.0344 -0.0906 347 GLY A O 1902 N N . GLY A 263 ? 0.7376 0.6246 0.5606 -0.0916 0.0211 -0.0845 348 GLY A N 1903 C CA . GLY A 263 ? 0.6963 0.5701 0.5227 -0.0854 0.0224 -0.0788 348 GLY A CA 1904 C C . GLY A 263 ? 0.7880 0.6719 0.6259 -0.0737 0.0156 -0.0703 348 GLY A C 1905 O O . GLY A 263 ? 0.7896 0.6876 0.6320 -0.0695 0.0106 -0.0682 348 GLY A O 1906 N N . ILE A 264 ? 0.7995 0.6756 0.6414 -0.0688 0.0156 -0.0655 349 ILE A N 1907 C CA . ILE A 264 ? 0.6859 0.5698 0.5382 -0.0586 0.0097 -0.0579 349 ILE A CA 1908 C C . ILE A 264 ? 0.7182 0.5838 0.5695 -0.0527 0.0124 -0.0528 349 ILE A C 1909 O O . ILE A 264 ? 0.7559 0.6078 0.6012 -0.0570 0.0177 -0.0549 349 ILE A O 1910 C CB . ILE A 264 ? 0.7494 0.6530 0.6106 -0.0601 0.0047 -0.0582 349 ILE A CB 1911 C CG1 . ILE A 264 ? 0.7798 0.6932 0.6510 -0.0500 -0.0014 -0.0510 349 ILE A CG1 1912 C CG2 . ILE A 264 ? 0.6750 0.5723 0.5352 -0.0653 0.0079 -0.0602 349 ILE A CG2 1913 C CD1 . ILE A 264 ? 0.7451 0.6810 0.6246 -0.0505 -0.0064 -0.0513 349 ILE A CD1 1914 N N . GLN A 265 ? 0.6591 0.5247 0.5159 -0.0431 0.0090 -0.0460 350 GLN A N 1915 C CA . GLN A 265 ? 0.6254 0.4760 0.4815 -0.0372 0.0111 -0.0408 350 GLN A CA 1916 C C . GLN A 265 ? 0.8150 0.6645 0.6732 -0.0392 0.0111 -0.0406 350 GLN A C 1917 O O . GLN A 265 ? 0.8526 0.7166 0.7177 -0.0400 0.0068 -0.0409 350 GLN A O 1918 C CB . GLN A 265 ? 0.6786 0.5333 0.5418 -0.0277 0.0065 -0.0339 350 GLN A CB 1919 C CG . GLN A 265 ? 0.7318 0.5726 0.5940 -0.0212 0.0085 -0.0282 350 GLN A CG 1920 C CD . GLN A 265 ? 0.7131 0.5604 0.5830 -0.0130 0.0037 -0.0221 350 GLN A CD 1921 O OE1 . GLN A 265 ? 0.7055 0.5667 0.5825 -0.0119 -0.0014 -0.0213 350 GLN A OE1 1922 N NE2 . GLN A 265 ? 0.7012 0.5388 0.5697 -0.0073 0.0057 -0.0176 350 GLN A NE2 1923 N N . GLY A 266 ? 0.8522 0.6844 0.7039 -0.0394 0.0163 -0.0397 351 GLY A N 1924 C CA . GLY A 266 ? 0.7045 0.5330 0.5563 -0.0412 0.0174 -0.0392 351 GLY A CA 1925 C C . GLY A 266 ? 0.7061 0.5147 0.5509 -0.0380 0.0228 -0.0358 351 GLY A C 1926 O O . GLY A 266 ? 0.7455 0.5438 0.5859 -0.0340 0.0257 -0.0337 351 GLY A O 1927 N N . PHE A 267 ? 0.7015 0.5048 0.5448 -0.0395 0.0245 -0.0350 352 PHE A N 1928 C CA . PHE A 267 ? 0.7147 0.5011 0.5523 -0.0346 0.0286 -0.0301 352 PHE A CA 1929 C C . PHE A 267 ? 0.7917 0.5668 0.6221 -0.0405 0.0344 -0.0324 352 PHE A C 1930 O O . PHE A 267 ? 0.8488 0.6320 0.6812 -0.0472 0.0337 -0.0366 352 PHE A O 1931 C CB . PHE A 267 ? 0.6963 0.4887 0.5412 -0.0265 0.0229 -0.0234 352 PHE A CB 1932 C CG . PHE A 267 ? 0.7091 0.5126 0.5596 -0.0288 0.0190 -0.0243 352 PHE A CG 1933 C CD1 . PHE A 267 ? 0.7294 0.5256 0.5761 -0.0305 0.0218 -0.0235 352 PHE A CD1 1934 C CD2 . PHE A 267 ? 0.6791 0.5000 0.5385 -0.0290 0.0129 -0.0256 352 PHE A CD2 1935 C CE1 . PHE A 267 ? 0.7425 0.5489 0.5941 -0.0327 0.0185 -0.0246 352 PHE A CE1 1936 C CE2 . PHE A 267 ? 0.7699 0.6005 0.6343 -0.0306 0.0099 -0.0264 352 PHE A CE2 1937 C CZ . PHE A 267 ? 0.7643 0.5879 0.6250 -0.0326 0.0127 -0.0261 352 PHE A CZ 1938 N N . MET A 268 ? 0.7993 0.5557 0.6213 -0.0375 0.0406 -0.0293 353 MET A N 1939 C CA . MET A 268 ? 0.7212 0.4651 0.5364 -0.0400 0.0459 -0.0287 353 MET A CA 1940 C C . MET A 268 ? 0.8041 0.5419 0.6192 -0.0299 0.0450 -0.0202 353 MET A C 1941 O O . MET A 268 ? 0.8376 0.5774 0.6560 -0.0224 0.0424 -0.0159 353 MET A O 1942 C CB . MET A 268 ? 0.7844 0.5096 0.5876 -0.0461 0.0556 -0.0328 353 MET A CB 1943 C CG . MET A 268 ? 0.6982 0.4295 0.5005 -0.0561 0.0566 -0.0415 353 MET A CG 1944 S SD . MET A 268 ? 0.9021 0.6078 0.6890 -0.0613 0.0685 -0.0455 353 MET A SD 1945 C CE . MET A 268 ? 1.9411 1.6569 1.7270 -0.0770 0.0694 -0.0569 353 MET A CE 1946 N N . ILE A 269 ? 0.8710 0.6031 0.6830 -0.0299 0.0469 -0.0177 354 ILE A N 1947 C CA . ILE A 269 ? 0.7779 0.5037 0.5882 -0.0209 0.0468 -0.0096 354 ILE A CA 1948 C C . ILE A 269 ? 0.9256 0.6306 0.7238 -0.0222 0.0561 -0.0084 354 ILE A C 1949 O O . ILE A 269 ? 0.9617 0.6626 0.7558 -0.0297 0.0597 -0.0123 354 ILE A O 1950 C CB . ILE A 269 ? 0.7200 0.4580 0.5367 -0.0192 0.0405 -0.0070 354 ILE A CB 1951 C CG1 . ILE A 269 ? 0.6651 0.4226 0.4935 -0.0179 0.0317 -0.0080 354 ILE A CG1 1952 C CG2 . ILE A 269 ? 0.6048 0.3362 0.4182 -0.0107 0.0408 0.0013 354 ILE A CG2 1953 C CD1 . ILE A 269 ? 0.6824 0.4515 0.5164 -0.0189 0.0265 -0.0080 354 ILE A CD1 1954 N N . GLU A 270 ? 0.9581 0.6497 0.7504 -0.0147 0.0606 -0.0028 355 GLU A N 1955 C CA . GLU A 270 ? 0.9701 0.6407 0.7503 -0.0141 0.0699 -0.0002 355 GLU A CA 1956 C C . GLU A 270 ? 0.8868 0.5566 0.6664 -0.0050 0.0683 0.0088 355 GLU A C 1957 O O . GLU A 270 ? 1.0351 0.7111 0.8191 0.0042 0.0642 0.0150 355 GLU A O 1958 C CB . GLU A 270 ? 0.9478 0.6008 0.7196 -0.0125 0.0781 -0.0006 355 GLU A CB 1959 C CG . GLU A 270 ? 1.0042 0.6349 0.7628 -0.0183 0.0891 -0.0030 355 GLU A CG 1960 C CD . GLU A 270 ? 1.2127 0.8241 0.9621 -0.0087 0.0966 0.0049 355 GLU A CD 1961 O OE1 . GLU A 270 ? 1.1396 0.7301 0.8770 -0.0118 0.1065 0.0044 355 GLU A OE1 1962 O OE2 . GLU A 270 ? 1.3878 1.0055 1.1420 0.0021 0.0926 0.0118 355 GLU A OE2 1963 N N . GLY A 271 ? 0.9492 0.6124 0.7231 -0.0080 0.0715 0.0095 356 GLY A N 1964 C CA . GLY A 271 ? 0.9981 0.6619 0.7707 -0.0005 0.0698 0.0176 356 GLY A CA 1965 C C . GLY A 271 ? 0.9337 0.5818 0.6954 -0.0043 0.0776 0.0180 356 GLY A C 1966 O O . GLY A 271 ? 0.9304 0.5653 0.6853 -0.0122 0.0851 0.0124 356 GLY A O 1967 N N . SER A 272 ? 1.0372 0.6865 0.7969 0.0008 0.0761 0.0245 357 SER A N 1968 C CA . SER A 272 ? 1.0411 0.6763 0.7904 -0.0031 0.0834 0.0250 357 SER A CA 1969 C C . SER A 272 ? 0.9895 0.6319 0.7423 -0.0155 0.0823 0.0159 357 SER A C 1970 O O . SER A 272 ? 1.0614 0.6909 0.8065 -0.0232 0.0901 0.0121 357 SER A O 1971 C CB . SER A 272 ? 1.1502 0.7877 0.8968 0.0048 0.0812 0.0337 357 SER A CB 1972 O OG . SER A 272 ? 1.4786 1.1373 1.2349 0.0039 0.0712 0.0326 357 SER A OG 1973 N N . ASN A 273 ? 0.9292 0.5929 0.6940 -0.0171 0.0727 0.0125 359 ASN A N 1974 C CA . ASN A 273 ? 1.0419 0.7158 0.8126 -0.0277 0.0708 0.0035 359 ASN A CA 1975 C C . ASN A 273 ? 0.9508 0.6308 0.7276 -0.0284 0.0681 -0.0005 359 ASN A C 1976 O O . ASN A 273 ? 0.8475 0.5366 0.6308 -0.0210 0.0620 0.0031 359 ASN A O 1977 C CB . ASN A 273 ? 1.0571 0.7503 0.8367 -0.0282 0.0624 0.0028 359 ASN A CB 1978 C CG . ASN A 273 ? 1.1735 0.8619 0.9469 -0.0294 0.0653 0.0052 359 ASN A CG 1979 O OD1 . ASN A 273 ? 1.1402 0.8108 0.9028 -0.0312 0.0740 0.0067 359 ASN A OD1 1980 N ND2 . ASN A 273 ? 1.1712 0.8745 0.9507 -0.0286 0.0585 0.0055 359 ASN A ND2 1981 N N . SER A 274 ? 0.9135 0.5892 0.6883 -0.0376 0.0726 -0.0080 360 SER A N 1982 C CA . SER A 274 ? 0.8833 0.5672 0.6641 -0.0392 0.0695 -0.0124 360 SER A CA 1983 C C . SER A 274 ? 0.7698 0.4734 0.5603 -0.0467 0.0636 -0.0194 360 SER A C 1984 O O . SER A 274 ? 0.8086 0.5162 0.5993 -0.0530 0.0643 -0.0223 360 SER A O 1985 C CB . SER A 274 ? 0.7961 0.4619 0.5675 -0.0430 0.0784 -0.0156 360 SER A CB 1986 O OG . SER A 274 ? 1.0129 0.6637 0.7778 -0.0332 0.0824 -0.0084 360 SER A OG 1987 N N . TRP A 275 ? 0.8250 0.5413 0.6234 -0.0456 0.0579 -0.0215 361 TRP A N 1988 C CA . TRP A 275 ? 0.7861 0.5221 0.5939 -0.0515 0.0522 -0.0273 361 TRP A CA 1989 C C . TRP A 275 ? 0.8004 0.5409 0.6099 -0.0555 0.0520 -0.0327 361 TRP A C 1990 O O . TRP A 275 ? 0.9217 0.6553 0.7289 -0.0508 0.0530 -0.0307 361 TRP A O 1991 C CB . TRP A 275 ? 0.7024 0.4549 0.5205 -0.0448 0.0431 -0.0237 361 TRP A CB 1992 C CG . TRP A 275 ? 0.8067 0.5578 0.6238 -0.0410 0.0421 -0.0189 361 TRP A CG 1993 C CD1 . TRP A 275 ? 0.8022 0.5443 0.6151 -0.0331 0.0426 -0.0117 361 TRP A CD1 1994 C CD2 . TRP A 275 ? 0.8126 0.5728 0.6329 -0.0448 0.0403 -0.0208 361 TRP A CD2 1995 N NE1 . TRP A 275 ? 0.9648 0.7098 0.7776 -0.0321 0.0410 -0.0093 361 TRP A NE1 1996 C CE2 . TRP A 275 ? 0.9418 0.6972 0.7590 -0.0392 0.0398 -0.0149 361 TRP A CE2 1997 C CE3 . TRP A 275 ? 0.7855 0.5584 0.6111 -0.0521 0.0392 -0.0268 361 TRP A CE3 1998 C CZ2 . TRP A 275 ? 0.9345 0.6960 0.7530 -0.0409 0.0384 -0.0151 361 TRP A CZ2 1999 C CZ3 . TRP A 275 ? 0.9023 0.6813 0.7298 -0.0533 0.0381 -0.0267 361 TRP A CZ3 2000 C CH2 . TRP A 275 ? 0.9134 0.6861 0.7371 -0.0479 0.0378 -0.0211 361 TRP A CH2 2001 N N . ILE A 276 ? 0.8962 0.6493 0.7098 -0.0642 0.0508 -0.0394 362 ILE A N 2002 C CA . ILE A 276 ? 0.7637 0.5269 0.5809 -0.0677 0.0485 -0.0443 362 ILE A CA 2003 C C . ILE A 276 ? 0.8558 0.6429 0.6846 -0.0688 0.0408 -0.0463 362 ILE A C 2004 O O . ILE A 276 ? 0.9961 0.7912 0.8272 -0.0748 0.0411 -0.0494 362 ILE A O 2005 C CB . ILE A 276 ? 0.8145 0.5693 0.6236 -0.0786 0.0557 -0.0515 362 ILE A CB 2006 C CG1 . ILE A 276 ? 0.7983 0.5274 0.5950 -0.0770 0.0643 -0.0496 362 ILE A CG1 2007 C CG2 . ILE A 276 ? 0.7602 0.5287 0.5734 -0.0826 0.0524 -0.0568 362 ILE A CG2 2008 C CD1 . ILE A 276 ? 0.7370 0.4551 0.5243 -0.0882 0.0723 -0.0571 362 ILE A CD1 2009 N N . GLY A 277 ? 0.6767 0.4749 0.5127 -0.0624 0.0344 -0.0440 363 GLY A N 2010 C CA . GLY A 277 ? 0.7447 0.5648 0.5912 -0.0627 0.0276 -0.0457 363 GLY A CA 2011 C C . GLY A 277 ? 0.8638 0.6936 0.7112 -0.0685 0.0272 -0.0513 363 GLY A C 2012 O O . GLY A 277 ? 0.9615 0.7838 0.8043 -0.0678 0.0291 -0.0519 363 GLY A O 2013 N N . ARG A 278 ? 0.7538 0.6010 0.6068 -0.0742 0.0250 -0.0556 364 ARG A N 2014 C CA . ARG A 278 ? 0.6813 0.5415 0.5359 -0.0798 0.0237 -0.0608 364 ARG A CA 2015 C C . ARG A 278 ? 0.7647 0.6495 0.6299 -0.0801 0.0180 -0.0618 364 ARG A C 2016 O O . ARG A 278 ? 0.7649 0.6555 0.6354 -0.0777 0.0163 -0.0596 364 ARG A O 2017 C CB . ARG A 278 ? 0.7169 0.5689 0.5626 -0.0914 0.0307 -0.0678 364 ARG A CB 2018 C CG . ARG A 278 ? 0.7530 0.6162 0.6011 -0.1004 0.0321 -0.0724 364 ARG A CG 2019 C CD . ARG A 278 ? 0.7606 0.6077 0.5978 -0.1109 0.0407 -0.0778 364 ARG A CD 2020 N NE . ARG A 278 ? 0.8256 0.6844 0.6645 -0.1218 0.0427 -0.0836 364 ARG A NE 2021 C CZ . ARG A 278 ? 0.8784 0.7264 0.7083 -0.1334 0.0502 -0.0897 364 ARG A CZ 2022 N NH1 . ARG A 278 ? 0.9640 0.7880 0.7823 -0.1344 0.0566 -0.0903 364 ARG A NH1 2023 N NH2 . ARG A 278 ? 0.8693 0.7298 0.7016 -0.1438 0.0519 -0.0950 364 ARG A NH2 2024 N N . ILE A 279 ? 0.7881 0.6870 0.6558 -0.0824 0.0153 -0.0648 365 ILE A N 2025 C CA . ILE A 279 ? 0.7250 0.6489 0.6018 -0.0837 0.0106 -0.0665 365 ILE A CA 2026 C C . ILE A 279 ? 0.7973 0.7272 0.6724 -0.0952 0.0145 -0.0728 365 ILE A C 2027 O O . ILE A 279 ? 0.7952 0.7158 0.6618 -0.1042 0.0196 -0.0781 365 ILE A O 2028 C CB . ILE A 279 ? 0.7171 0.6532 0.5956 -0.0826 0.0069 -0.0674 365 ILE A CB 2029 C CG1 . ILE A 279 ? 0.6948 0.6230 0.5744 -0.0718 0.0039 -0.0611 365 ILE A CG1 2030 C CG2 . ILE A 279 ? 0.6138 0.5775 0.5017 -0.0833 0.0020 -0.0685 365 ILE A CG2 2031 C CD1 . ILE A 279 ? 0.6962 0.6376 0.5786 -0.0689 -0.0003 -0.0606 365 ILE A CD1 2032 N N . ILE A 280 ? 0.7904 0.7354 0.6733 -0.0952 0.0125 -0.0724 366 ILE A N 2033 C CA . ILE A 280 ? 0.7789 0.7308 0.6614 -0.1058 0.0162 -0.0779 366 ILE A CA 2034 C C . ILE A 280 ? 0.8697 0.8397 0.7529 -0.1153 0.0157 -0.0844 366 ILE A C 2035 O O . ILE A 280 ? 0.7926 0.7553 0.6680 -0.1263 0.0210 -0.0905 366 ILE A O 2036 C CB . ILE A 280 ? 0.7679 0.7323 0.6591 -0.1023 0.0143 -0.0753 366 ILE A CB 2037 C CG1 . ILE A 280 ? 0.8130 0.7583 0.7017 -0.0950 0.0156 -0.0699 366 ILE A CG1 2038 C CG2 . ILE A 280 ? 0.6888 0.6633 0.5806 -0.1137 0.0181 -0.0811 366 ILE A CG2 2039 C CD1 . ILE A 280 ? 0.7084 0.6644 0.6053 -0.0890 0.0129 -0.0665 366 ILE A CD1 2040 N N . ASN A 281 ? 1.0188 1.0122 0.9107 -0.1110 0.0096 -0.0831 367 ASN A N 2041 C CA . ASN A 281 ? 0.9314 0.9443 0.8240 -0.1189 0.0081 -0.0886 367 ASN A CA 2042 C C . ASN A 281 ? 0.8139 0.8223 0.7018 -0.1161 0.0060 -0.0883 367 ASN A C 2043 O O . ASN A 281 ? 0.8710 0.8867 0.7643 -0.1058 0.0008 -0.0829 367 ASN A O 2044 C CB . ASN A 281 ? 0.9621 1.0060 0.8670 -0.1164 0.0029 -0.0873 367 ASN A CB 2045 C CG . ASN A 281 ? 1.2607 1.3280 1.1667 -0.1273 0.0021 -0.0940 367 ASN A CG 2046 O OD1 . ASN A 281 ? 1.3960 1.4628 1.2959 -0.1322 0.0020 -0.0978 367 ASN A OD1 2047 N ND2 . ASN A 281 ? 1.2797 1.3686 1.1936 -0.1312 0.0016 -0.0956 367 ASN A ND2 2048 N N . PRO A 282 ? 0.8080 0.8032 0.6853 -0.1252 0.0108 -0.0940 368 PRO A N 2049 C CA . PRO A 282 ? 0.8630 0.8530 0.7350 -0.1228 0.0096 -0.0941 368 PRO A CA 2050 C C . PRO A 282 ? 0.9150 0.9326 0.7930 -0.1218 0.0033 -0.0946 368 PRO A C 2051 O O . PRO A 282 ? 0.9793 0.9960 0.8566 -0.1148 0.0003 -0.0914 368 PRO A O 2052 C CB . PRO A 282 ? 0.8469 0.8196 0.7062 -0.1349 0.0169 -0.1016 368 PRO A CB 2053 C CG . PRO A 282 ? 0.7692 0.7265 0.6259 -0.1386 0.0225 -0.1020 368 PRO A CG 2054 C CD . PRO A 282 ? 0.6629 0.6425 0.5315 -0.1368 0.0184 -0.1000 368 PRO A CD 2055 N N . GLY A 283 ? 0.9351 0.9776 0.8190 -0.1286 0.0014 -0.0983 369 GLY A N 2056 C CA . GLY A 283 ? 0.8139 0.8852 0.7035 -0.1281 -0.0045 -0.0987 369 GLY A CA 2057 C C . GLY A 283 ? 0.8646 0.9493 0.7649 -0.1136 -0.0108 -0.0900 369 GLY A C 2058 O O . GLY A 283 ? 0.8907 0.9755 0.7905 -0.1059 -0.0141 -0.0861 369 GLY A O 2059 N N . SER A 284 ? 0.7895 0.8854 0.6990 -0.1099 -0.0121 -0.0869 370 SER A N 2060 C CA . SER A 284 ? 0.7953 0.8970 0.7137 -0.0956 -0.0165 -0.0784 370 SER A CA 2061 C C . SER A 284 ? 0.8954 0.9676 0.8095 -0.0900 -0.0135 -0.0748 370 SER A C 2062 O O . SER A 284 ? 1.3342 1.3942 1.2467 -0.0938 -0.0095 -0.0763 370 SER A O 2063 C CB . SER A 284 ? 0.8974 1.0187 0.8262 -0.0938 -0.0177 -0.0767 370 SER A CB 2064 O OG . SER A 284 ? 0.9847 1.0905 0.9124 -0.0965 -0.0132 -0.0776 370 SER A OG 2065 N N . LYS A 285 ? 0.6031 0.6638 0.5153 -0.0815 -0.0153 -0.0701 371 LYS A N 2066 C CA . LYS A 285 ? 0.7982 0.8310 0.7055 -0.0776 -0.0122 -0.0674 371 LYS A CA 2067 C C . LYS A 285 ? 0.8119 0.8408 0.7252 -0.0710 -0.0123 -0.0628 371 LYS A C 2068 O O . LYS A 285 ? 0.9040 0.9216 0.8186 -0.0619 -0.0136 -0.0571 371 LYS A O 2069 C CB . LYS A 285 ? 0.8272 0.8493 0.7310 -0.0706 -0.0138 -0.0637 371 LYS A CB 2070 C CG . LYS A 285 ? 1.0108 1.0227 0.9042 -0.0782 -0.0106 -0.0690 371 LYS A CG 2071 C CD . LYS A 285 ? 1.2279 1.2430 1.1197 -0.0730 -0.0136 -0.0666 371 LYS A CD 2072 C CE . LYS A 285 ? 1.4253 1.4492 1.3106 -0.0827 -0.0127 -0.0735 371 LYS A CE 2073 N NZ . LYS A 285 ? 1.4444 1.4976 1.3355 -0.0870 -0.0163 -0.0761 371 LYS A NZ 2074 N N . LYS A 286 ? 0.7254 0.7633 0.6419 -0.0765 -0.0107 -0.0656 372 LYS A N 2075 C CA . LYS A 286 ? 0.8660 0.9039 0.7885 -0.0708 -0.0107 -0.0619 372 LYS A CA 2076 C C . LYS A 286 ? 0.7647 0.7816 0.6814 -0.0748 -0.0058 -0.0632 372 LYS A C 2077 O O . LYS A 286 ? 0.7852 0.7955 0.6954 -0.0850 -0.0014 -0.0687 372 LYS A O 2078 C CB . LYS A 286 ? 0.9591 1.0235 0.8904 -0.0724 -0.0123 -0.0631 372 LYS A CB 2079 C CG . LYS A 286 ? 1.1517 1.2375 1.0902 -0.0649 -0.0175 -0.0594 372 LYS A CG 2080 C CD . LYS A 286 ? 1.2994 1.4046 1.2481 -0.0596 -0.0189 -0.0565 372 LYS A CD 2081 C CE . LYS A 286 ? 1.2251 1.3489 1.1806 -0.0499 -0.0236 -0.0514 372 LYS A CE 2082 N NZ . LYS A 286 ? 1.0705 1.1828 1.0284 -0.0374 -0.0247 -0.0443 372 LYS A NZ 2083 N N . GLY A 287 ? 0.6879 0.6939 0.6063 -0.0667 -0.0062 -0.0582 373 GLY A N 2084 C CA . GLY A 287 ? 0.7513 0.7397 0.6650 -0.0688 -0.0020 -0.0583 373 GLY A CA 2085 C C . GLY A 287 ? 0.8063 0.7700 0.7106 -0.0690 0.0007 -0.0576 373 GLY A C 2086 O O . GLY A 287 ? 0.7115 0.6700 0.6106 -0.0723 0.0016 -0.0597 373 GLY A O 2087 N N . PHE A 288 ? 0.7666 0.7154 0.6685 -0.0654 0.0023 -0.0544 374 PHE A N 2088 C CA . PHE A 288 ? 0.8322 0.7584 0.7254 -0.0649 0.0052 -0.0530 374 PHE A CA 2089 C C . PHE A 288 ? 0.8704 0.7833 0.7582 -0.0684 0.0100 -0.0533 374 PHE A C 2090 O O . PHE A 288 ? 0.8130 0.7284 0.7042 -0.0653 0.0093 -0.0512 374 PHE A O 2091 C CB . PHE A 288 ? 0.6956 0.6154 0.5905 -0.0549 0.0015 -0.0471 374 PHE A CB 2092 C CG . PHE A 288 ? 0.7229 0.6228 0.6098 -0.0536 0.0040 -0.0452 374 PHE A CG 2093 C CD1 . PHE A 288 ? 0.6820 0.5781 0.5649 -0.0552 0.0049 -0.0468 374 PHE A CD1 2094 C CD2 . PHE A 288 ? 0.7073 0.5927 0.5904 -0.0504 0.0057 -0.0418 374 PHE A CD2 2095 C CE1 . PHE A 288 ? 0.6221 0.4998 0.4977 -0.0533 0.0078 -0.0447 374 PHE A CE1 2096 C CE2 . PHE A 288 ? 0.7360 0.6043 0.6121 -0.0484 0.0081 -0.0394 374 PHE A CE2 2097 C CZ . PHE A 288 ? 0.6451 0.5094 0.5176 -0.0496 0.0094 -0.0408 374 PHE A CZ 2098 N N . GLU A 289 ? 0.8031 0.7015 0.6819 -0.0747 0.0154 -0.0560 375 GLU A N 2099 C CA . GLU A 289 ? 0.6997 0.5833 0.5719 -0.0778 0.0206 -0.0559 375 GLU A CA 2100 C C . GLU A 289 ? 0.7338 0.5949 0.5972 -0.0741 0.0235 -0.0523 375 GLU A C 2101 O O . GLU A 289 ? 0.7767 0.6323 0.6372 -0.0728 0.0235 -0.0523 375 GLU A O 2102 C CB . GLU A 289 ? 0.7226 0.6085 0.5913 -0.0897 0.0260 -0.0623 375 GLU A CB 2103 C CG . GLU A 289 ? 0.7363 0.6153 0.5980 -0.0970 0.0297 -0.0669 375 GLU A CG 2104 C CD . GLU A 289 ? 0.9853 0.8730 0.8460 -0.1097 0.0337 -0.0742 375 GLU A CD 2105 O OE1 . GLU A 289 ? 0.8851 0.7759 0.7473 -0.1133 0.0360 -0.0750 375 GLU A OE1 2106 O OE2 . GLU A 289 ? 1.1088 1.0010 0.9673 -0.1164 0.0345 -0.0792 375 GLU A OE2 2107 N N . ILE A 290 ? 0.7459 0.5949 0.6052 -0.0718 0.0259 -0.0490 376 ILE A N 2108 C CA . ILE A 290 ? 0.7603 0.5886 0.6109 -0.0682 0.0292 -0.0452 376 ILE A CA 2109 C C . ILE A 290 ? 0.8471 0.6619 0.6898 -0.0722 0.0356 -0.0451 376 ILE A C 2110 O O . ILE A 290 ? 0.8671 0.6871 0.7122 -0.0727 0.0352 -0.0447 376 ILE A O 2111 C CB . ILE A 290 ? 0.6472 0.4741 0.5009 -0.0574 0.0241 -0.0387 376 ILE A CB 2112 C CG1 . ILE A 290 ? 0.6867 0.4948 0.5321 -0.0535 0.0276 -0.0348 376 ILE A CG1 2113 C CG2 . ILE A 290 ? 0.6399 0.4719 0.4974 -0.0537 0.0213 -0.0358 376 ILE A CG2 2114 C CD1 . ILE A 290 ? 0.7528 0.5606 0.6013 -0.0437 0.0227 -0.0285 376 ILE A CD1 2115 N N . TYR A 291 ? 0.9022 0.6989 0.7351 -0.0746 0.0418 -0.0453 377 TYR A N 2116 C CA . TYR A 291 ? 0.8853 0.6694 0.7097 -0.0819 0.0496 -0.0475 377 TYR A CA 2117 C C . TYR A 291 ? 0.9577 0.7191 0.7718 -0.0766 0.0545 -0.0418 377 TYR A C 2118 O O . TYR A 291 ? 0.8445 0.5948 0.6539 -0.0735 0.0565 -0.0404 377 TYR A O 2119 C CB . TYR A 291 ? 0.8441 0.6288 0.6655 -0.0925 0.0539 -0.0549 377 TYR A CB 2120 C CG . TYR A 291 ? 0.9657 0.7410 0.7797 -0.1028 0.0620 -0.0590 377 TYR A CG 2121 C CD1 . TYR A 291 ? 1.0170 0.7872 0.8286 -0.1026 0.0646 -0.0563 377 TYR A CD1 2122 C CD2 . TYR A 291 ? 0.9858 0.7567 0.7944 -0.1133 0.0675 -0.0658 377 TYR A CD2 2123 C CE1 . TYR A 291 ? 1.0815 0.8423 0.8860 -0.1123 0.0726 -0.0599 377 TYR A CE1 2124 C CE2 . TYR A 291 ? 1.0031 0.7644 0.8044 -0.1236 0.0756 -0.0698 377 TYR A CE2 2125 C CZ . TYR A 291 ? 1.0264 0.7826 0.8258 -0.1230 0.0782 -0.0667 377 TYR A CZ 2126 O OH . TYR A 291 ? 1.0241 0.7705 0.8162 -0.1335 0.0866 -0.0705 377 TYR A OH 2127 N N . LYS A 292 ? 0.9140 0.6692 0.7246 -0.0750 0.0566 -0.0383 378 LYS A N 2128 C CA . LYS A 292 ? 0.8339 0.5693 0.6350 -0.0690 0.0610 -0.0321 378 LYS A CA 2129 C C . LYS A 292 ? 0.8337 0.5495 0.6230 -0.0762 0.0713 -0.0344 378 LYS A C 2130 O O . LYS A 292 ? 0.8760 0.5939 0.6643 -0.0860 0.0751 -0.0400 378 LYS A O 2131 C CB . LYS A 292 ? 0.8459 0.5831 0.6474 -0.0637 0.0586 -0.0268 378 LYS A CB 2132 C CG . LYS A 292 ? 0.8750 0.5949 0.6674 -0.0559 0.0618 -0.0192 378 LYS A CG 2133 C CD . LYS A 292 ? 1.0747 0.7995 0.8681 -0.0503 0.0579 -0.0140 378 LYS A CD 2134 C CE . LYS A 292 ? 1.0600 0.7782 0.8468 -0.0555 0.0636 -0.0145 378 LYS A CE 2135 N NZ . LYS A 292 ? 1.0027 0.7289 0.7915 -0.0504 0.0587 -0.0105 378 LYS A NZ 2136 N N . PHE A 293 ? 0.9132 0.6101 0.6937 -0.0711 0.0761 -0.0302 379 PHE A N 2137 C CA . PHE A 293 ? 0.9401 0.6140 0.7076 -0.0760 0.0870 -0.0310 379 PHE A CA 2138 C C . PHE A 293 ? 1.0649 0.7223 0.8241 -0.0668 0.0907 -0.0221 379 PHE A C 2139 O O . PHE A 293 ? 1.1058 0.7665 0.8681 -0.0560 0.0854 -0.0156 379 PHE A O 2140 C CB . PHE A 293 ? 0.9571 0.6211 0.7202 -0.0781 0.0910 -0.0344 379 PHE A CB 2141 C CG . PHE A 293 ? 1.0665 0.7444 0.8352 -0.0883 0.0890 -0.0435 379 PHE A CG 2142 C CD1 . PHE A 293 ? 0.9495 0.6493 0.7302 -0.0855 0.0795 -0.0447 379 PHE A CD1 2143 C CD2 . PHE A 293 ? 1.0621 0.7317 0.8239 -0.1009 0.0969 -0.0508 379 PHE A CD2 2144 C CE1 . PHE A 293 ? 0.9570 0.6710 0.7427 -0.0943 0.0774 -0.0526 379 PHE A CE1 2145 C CE2 . PHE A 293 ? 1.0672 0.7518 0.8342 -0.1106 0.0946 -0.0593 379 PHE A CE2 2146 C CZ . PHE A 293 ? 1.0015 0.7088 0.7805 -0.1069 0.0847 -0.0599 379 PHE A CZ 2147 N N . LEU A 294 ? 1.0380 0.6778 0.7863 -0.0712 0.0998 -0.0217 380 LEU A N 2148 C CA . LEU A 294 ? 1.0023 0.6259 0.7416 -0.0623 0.1040 -0.0127 380 LEU A CA 2149 C C . LEU A 294 ? 1.0216 0.6227 0.7506 -0.0581 0.1119 -0.0098 380 LEU A C 2150 O O . LEU A 294 ? 1.0629 0.6430 0.7803 -0.0637 0.1227 -0.0115 380 LEU A O 2151 C CB . LEU A 294 ? 1.0240 0.6392 0.7561 -0.0678 0.1102 -0.0124 380 LEU A CB 2152 C CG . LEU A 294 ? 1.0353 0.6713 0.7765 -0.0723 0.1038 -0.0154 380 LEU A CG 2153 C CD1 . LEU A 294 ? 1.0566 0.6824 0.7896 -0.0793 0.1117 -0.0161 380 LEU A CD1 2154 C CD2 . LEU A 294 ? 0.9429 0.5936 0.6914 -0.0617 0.0940 -0.0093 380 LEU A CD2 2155 N N . GLY A 295 ? 0.9001 0.5054 0.6334 -0.0484 0.1070 -0.0056 381 GLY A N 2156 C CA . GLY A 295 ? 0.9578 0.5436 0.6825 -0.0429 0.1141 -0.0025 381 GLY A CA 2157 C C . GLY A 295 ? 1.0969 0.6896 0.8275 -0.0425 0.1106 -0.0064 381 GLY A C 2158 O O . GLY A 295 ? 0.9739 0.5884 0.7163 -0.0444 0.1013 -0.0102 381 GLY A O 2159 N N . THR A 296 ? 1.0519 0.6251 0.7735 -0.0396 0.1186 -0.0053 382 THR A N 2160 C CA . THR A 296 ? 0.9476 0.5242 0.6728 -0.0371 0.1165 -0.0075 382 THR A CA 2161 C C . THR A 296 ? 1.0449 0.6304 0.7737 -0.0500 0.1152 -0.0187 382 THR A C 2162 O O . THR A 296 ? 1.0073 0.5850 0.7301 -0.0616 0.1213 -0.0253 382 THR A O 2163 C CB . THR A 296 ? 0.9829 0.5333 0.6957 -0.0305 0.1272 -0.0033 382 THR A CB 2164 O OG1 . THR A 296 ? 1.0178 0.5725 0.7345 -0.0269 0.1249 -0.0047 382 THR A OG1 2165 C CG2 . THR A 296 ? 0.9174 0.4435 0.6163 -0.0409 0.1400 -0.0091 382 THR A CG2 2166 N N . LEU A 297 ? 0.9689 0.5714 0.7074 -0.0482 0.1074 -0.0208 383 LEU A N 2167 C CA . LEU A 297 ? 0.9300 0.5404 0.6708 -0.0591 0.1065 -0.0308 383 LEU A CA 2168 C C . LEU A 297 ? 0.9148 0.5017 0.6423 -0.0646 0.1180 -0.0356 383 LEU A C 2169 O O . LEU A 297 ? 0.9489 0.5387 0.6752 -0.0762 0.1195 -0.0448 383 LEU A O 2170 C CB . LEU A 297 ? 0.8824 0.5137 0.6351 -0.0544 0.0965 -0.0308 383 LEU A CB 2171 C CG . LEU A 297 ? 0.9626 0.6183 0.7289 -0.0505 0.0851 -0.0278 383 LEU A CG 2172 C CD1 . LEU A 297 ? 0.8140 0.4837 0.5895 -0.0426 0.0772 -0.0250 383 LEU A CD1 2173 C CD2 . LEU A 297 ? 0.8400 0.5116 0.6120 -0.0615 0.0815 -0.0350 383 LEU A CD2 2174 N N . PHE A 298 ? 0.9242 0.4883 0.6417 -0.0564 0.1261 -0.0292 384 PHE A N 2175 C CA . PHE A 298 ? 0.9809 0.5209 0.6854 -0.0592 0.1373 -0.0328 384 PHE A CA 2176 C C . PHE A 298 ? 1.0494 0.5613 0.7387 -0.0640 0.1505 -0.0332 384 PHE A C 2177 O O . PHE A 298 ? 1.1995 0.6867 0.8771 -0.0595 0.1607 -0.0307 384 PHE A O 2178 C CB . PHE A 298 ? 0.8860 0.4205 0.5903 -0.0454 0.1376 -0.0257 384 PHE A CB 2179 C CG . PHE A 298 ? 0.9505 0.5117 0.6697 -0.0392 0.1249 -0.0233 384 PHE A CG 2180 C CD1 . PHE A 298 ? 0.9983 0.5744 0.7235 -0.0456 0.1197 -0.0308 384 PHE A CD1 2181 C CD2 . PHE A 298 ? 0.9688 0.5411 0.6960 -0.0277 0.1180 -0.0139 384 PHE A CD2 2182 C CE1 . PHE A 298 ? 0.8530 0.4529 0.5918 -0.0400 0.1084 -0.0284 384 PHE A CE1 2183 C CE2 . PHE A 298 ? 0.9885 0.5847 0.7292 -0.0229 0.1067 -0.0121 384 PHE A CE2 2184 C CZ . PHE A 298 ? 0.9158 0.5251 0.6622 -0.0288 0.1021 -0.0192 384 PHE A CZ 2185 N N . SER A 299 ? 1.0949 0.6108 0.7846 -0.0730 0.1505 -0.0362 385 SER A N 2186 C CA . SER A 299 ? 1.1547 0.6461 0.8305 -0.0814 0.1629 -0.0388 385 SER A CA 2187 C C . SER A 299 ? 1.2088 0.7127 0.8877 -0.0985 0.1614 -0.0495 385 SER A C 2188 O O . SER A 299 ? 1.2274 0.7581 0.9195 -0.1003 0.1507 -0.0506 385 SER A O 2189 C CB . SER A 299 ? 1.1623 0.6444 0.8345 -0.0729 0.1654 -0.0289 385 SER A CB 2190 O OG . SER A 299 ? 1.1064 0.5636 0.7645 -0.0808 0.1781 -0.0310 385 SER A OG 2191 N N . VAL A 300 ? 1.1645 0.6496 0.8316 -0.1111 0.1722 -0.0575 387 VAL A N 2192 C CA . VAL A 300 ? 1.2996 0.7953 0.9685 -0.1282 0.1723 -0.0674 387 VAL A CA 2193 C C . VAL A 300 ? 1.3460 0.8457 1.0172 -0.1294 0.1717 -0.0637 387 VAL A C 2194 O O . VAL A 300 ? 1.2349 0.7575 0.9159 -0.1376 0.1651 -0.0683 387 VAL A O 2195 C CB . VAL A 300 ? 1.3233 0.7956 0.9775 -0.1420 0.1851 -0.0768 387 VAL A CB 2196 C CG1 . VAL A 300 ? 1.5721 1.0516 1.2263 -0.1594 0.1873 -0.0855 387 VAL A CG1 2197 C CG2 . VAL A 300 ? 1.2733 0.7512 0.9282 -0.1445 0.1829 -0.0833 387 VAL A CG2 2198 N N . GLN A 301 ? 1.3935 0.8720 1.0560 -0.1202 0.1784 -0.0547 388 GLN A N 2199 C CA . GLN A 301 ? 1.4304 0.9084 1.0923 -0.1208 0.1796 -0.0505 388 GLN A CA 2200 C C . GLN A 301 ? 1.3362 0.8437 1.0135 -0.1144 0.1661 -0.0460 388 GLN A C 2201 O O . GLN A 301 ? 1.3996 0.9112 1.0779 -0.1179 0.1663 -0.0450 388 GLN A O 2202 C CB . GLN A 301 ? 1.4772 0.9256 1.1255 -0.1107 0.1898 -0.0407 388 GLN A CB 2203 C CG . GLN A 301 ? 1.4605 0.8754 1.0918 -0.1156 0.2049 -0.0439 388 GLN A CG 2204 C CD . GLN A 301 ? 1.7923 1.1797 1.4112 -0.1025 0.2141 -0.0324 388 GLN A CD 2205 O OE1 . GLN A 301 ? 1.8484 1.2433 1.4717 -0.0902 0.2088 -0.0223 388 GLN A OE1 2206 N NE2 . GLN A 301 ? 1.9149 1.2701 1.5177 -0.1048 0.2284 -0.0339 388 GLN A NE2 2207 N N . THR A 302 ? 1.2279 0.7548 0.9167 -0.1053 0.1552 -0.0434 390 THR A N 2208 C CA . THR A 302 ? 1.1658 0.7184 0.8682 -0.0990 0.1431 -0.0391 390 THR A CA 2209 C C . THR A 302 ? 1.0978 0.6749 0.8106 -0.1109 0.1370 -0.0476 390 THR A C 2210 O O . THR A 302 ? 1.1458 0.7281 0.8596 -0.1216 0.1379 -0.0565 390 THR A O 2211 C CB . THR A 302 ? 1.0626 0.6277 0.7738 -0.0850 0.1335 -0.0328 390 THR A CB 2212 O OG1 . THR A 302 ? 1.3416 0.9254 1.0623 -0.0893 0.1265 -0.0396 390 THR A OG1 2213 C CG2 . THR A 302 ? 0.9802 0.5220 0.6813 -0.0744 0.1404 -0.0259 390 THR A CG2 2214 N N . VAL A 303 ? 1.1643 0.7572 0.8849 -0.1088 0.1308 -0.0446 391 VAL A N 2215 C CA . VAL A 303 ? 1.1882 0.7971 0.9145 -0.1210 0.1295 -0.0515 391 VAL A CA 2216 C C . VAL A 303 ? 1.1915 0.8324 0.9339 -0.1215 0.1176 -0.0545 391 VAL A C 2217 O O . VAL A 303 ? 1.4226 1.0776 1.1701 -0.1325 0.1165 -0.0628 391 VAL A O 2218 C CB . VAL A 303 ? 1.1166 0.7163 0.8370 -0.1227 0.1350 -0.0481 391 VAL A CB 2219 C CG1 . VAL A 303 ? 0.9687 0.5465 0.6763 -0.1349 0.1480 -0.0532 391 VAL A CG1 2220 C CG2 . VAL A 303 ? 1.2634 0.8520 0.9794 -0.1080 0.1346 -0.0368 391 VAL A CG2 2221 N N . GLY A 304 ? 0.8087 0.4615 0.5590 -0.1099 0.1090 -0.0478 392 GLY A N 2222 C CA . GLY A 304 ? 0.9993 0.6808 0.7641 -0.1102 0.0987 -0.0504 392 GLY A CA 2223 C C . GLY A 304 ? 1.0529 0.7430 0.8210 -0.1109 0.0973 -0.0486 392 GLY A C 2224 O O . GLY A 304 ? 1.1314 0.8152 0.8942 -0.1197 0.1042 -0.0515 392 GLY A O 2225 N N . ASN A 305 A 0.9134 0.6177 0.6900 -0.1017 0.0887 -0.0440 392 ASN A N 2226 C CA . ASN A 305 A 0.9264 0.6341 0.7036 -0.0990 0.0876 -0.0402 392 ASN A CA 2227 C C . ASN A 305 A 0.9028 0.6363 0.6932 -0.0992 0.0794 -0.0427 392 ASN A C 2228 O O . ASN A 305 A 0.9322 0.6723 0.7242 -0.1026 0.0804 -0.0436 392 ASN A O 2229 C CB . ASN A 305 A 1.1259 0.8233 0.8987 -0.0863 0.0858 -0.0310 392 ASN A CB 2230 C CG . ASN A 305 A 1.1514 0.8503 0.9228 -0.0834 0.0853 -0.0267 392 ASN A CG 2231 O OD1 . ASN A 305 A 1.1519 0.8626 0.9295 -0.0760 0.0777 -0.0232 392 ASN A OD1 2232 N ND2 . ASN A 305 A 1.2028 0.8892 0.9654 -0.0896 0.0937 -0.0272 392 ASN A ND2 2233 N N . ARG A 306 ? 0.8290 0.5767 0.6286 -0.0951 0.0718 -0.0436 393 ARG A N 2234 C CA . ARG A 306 ? 0.9033 0.6744 0.7152 -0.0936 0.0641 -0.0451 393 ARG A CA 2235 C C . ARG A 306 ? 0.9941 0.7794 0.8148 -0.0918 0.0577 -0.0475 393 ARG A C 2236 O O . ARG A 306 ? 0.9796 0.7593 0.7995 -0.0852 0.0551 -0.0444 393 ARG A O 2237 C CB . ARG A 306 ? 1.0664 0.8391 0.8798 -0.0840 0.0594 -0.0388 393 ARG A CB 2238 C CG . ARG A 306 ? 1.1273 0.9078 0.9426 -0.0868 0.0603 -0.0397 393 ARG A CG 2239 C CD . ARG A 306 ? 1.0036 0.7980 0.8271 -0.0793 0.0525 -0.0373 393 ARG A CD 2240 N NE . ARG A 306 ? 1.0922 0.9074 0.9267 -0.0825 0.0491 -0.0421 393 ARG A NE 2241 C CZ . ARG A 306 ? 1.0960 0.9238 0.9368 -0.0793 0.0453 -0.0417 393 ARG A CZ 2242 N NH1 . ARG A 306 ? 0.8319 0.6538 0.6688 -0.0736 0.0444 -0.0373 393 ARG A NH1 2243 N NH2 . ARG A 306 ? 0.9862 0.8329 0.8370 -0.0816 0.0428 -0.0456 393 ARG A NH2 2244 N N . ASN A 307 ? 1.0192 0.8241 0.8487 -0.0973 0.0551 -0.0527 394 ASN A N 2245 C CA . ASN A 307 ? 0.8931 0.7132 0.7310 -0.0958 0.0491 -0.0549 394 ASN A CA 2246 C C . ASN A 307 ? 0.8762 0.7169 0.7257 -0.0904 0.0418 -0.0537 394 ASN A C 2247 O O . ASN A 307 ? 0.9124 0.7675 0.7675 -0.0948 0.0418 -0.0568 394 ASN A O 2248 C CB . ASN A 307 ? 0.7863 0.6125 0.6240 -0.1069 0.0524 -0.0622 394 ASN A CB 2249 C CG . ASN A 307 ? 0.8873 0.7290 0.7325 -0.1054 0.0464 -0.0643 394 ASN A CG 2250 O OD1 . ASN A 307 ? 0.8557 0.6951 0.7024 -0.0968 0.0420 -0.0603 394 ASN A OD1 2251 N ND2 . ASN A 307 ? 0.8877 0.7460 0.7376 -0.1138 0.0463 -0.0703 394 ASN A ND2 2252 N N . TYR A 308 ? 0.7591 0.6008 0.6120 -0.0809 0.0360 -0.0493 395 TYR A N 2253 C CA . TYR A 308 ? 0.7598 0.6184 0.6228 -0.0750 0.0295 -0.0479 395 TYR A CA 2254 C C . TYR A 308 ? 0.9206 0.7962 0.7919 -0.0753 0.0251 -0.0506 395 TYR A C 2255 O O . TYR A 308 ? 0.8976 0.7700 0.7683 -0.0725 0.0231 -0.0497 395 TYR A O 2256 C CB . TYR A 308 ? 0.8192 0.6706 0.6817 -0.0651 0.0256 -0.0419 395 TYR A CB 2257 C CG . TYR A 308 ? 0.7751 0.6135 0.6304 -0.0633 0.0284 -0.0384 395 TYR A CG 2258 C CD1 . TYR A 308 ? 0.8098 0.6546 0.6676 -0.0621 0.0275 -0.0379 395 TYR A CD1 2259 C CD2 . TYR A 308 ? 0.8199 0.6400 0.6658 -0.0621 0.0319 -0.0352 395 TYR A CD2 2260 C CE1 . TYR A 308 ? 0.8354 0.6690 0.6861 -0.0604 0.0299 -0.0346 395 TYR A CE1 2261 C CE2 . TYR A 308 ? 0.7531 0.5626 0.5922 -0.0598 0.0342 -0.0314 395 TYR A CE2 2262 C CZ . TYR A 308 ? 0.8467 0.6631 0.6881 -0.0592 0.0330 -0.0312 395 TYR A CZ 2263 O OH . TYR A 308 ? 1.0268 0.8333 0.8609 -0.0570 0.0352 -0.0275 395 TYR A OH 2264 N N . GLN A 309 ? 0.9833 0.8775 0.8623 -0.0783 0.0239 -0.0537 396 GLN A N 2265 C CA . GLN A 309 ? 0.7699 0.6832 0.6578 -0.0767 0.0191 -0.0551 396 GLN A CA 2266 C C . GLN A 309 ? 0.7696 0.6875 0.6635 -0.0661 0.0135 -0.0503 396 GLN A C 2267 O O . GLN A 309 ? 0.8541 0.7824 0.7538 -0.0635 0.0123 -0.0497 396 GLN A O 2268 C CB . GLN A 309 ? 0.7321 0.6650 0.6264 -0.0830 0.0201 -0.0594 396 GLN A CB 2269 C CG . GLN A 309 ? 1.0364 0.9812 0.9320 -0.0912 0.0207 -0.0647 396 GLN A CG 2270 C CD . GLN A 309 ? 1.2556 1.1905 1.1430 -0.1027 0.0274 -0.0695 396 GLN A CD 2271 O OE1 . GLN A 309 ? 1.4242 1.3441 1.3053 -0.1044 0.0321 -0.0686 396 GLN A OE1 2272 N NE2 . GLN A 309 ? 1.1140 1.0568 1.0009 -0.1109 0.0283 -0.0748 396 GLN A NE2 2273 N N . LEU A 310 ? 0.7627 0.6725 0.6552 -0.0602 0.0106 -0.0469 397 LEU A N 2274 C CA . LEU A 310 ? 0.6310 0.5430 0.5282 -0.0510 0.0059 -0.0426 397 LEU A CA 2275 C C . LEU A 310 ? 0.6677 0.5985 0.5744 -0.0476 0.0019 -0.0427 397 LEU A C 2276 O O . LEU A 310 ? 0.7652 0.7009 0.6767 -0.0416 -0.0005 -0.0403 397 LEU A O 2277 C CB . LEU A 310 ? 0.6842 0.5827 0.5773 -0.0462 0.0043 -0.0388 397 LEU A CB 2278 C CG . LEU A 310 ? 0.7228 0.6028 0.6070 -0.0467 0.0076 -0.0369 397 LEU A CG 2279 C CD1 . LEU A 310 ? 0.8421 0.7122 0.7234 -0.0422 0.0061 -0.0335 397 LEU A CD1 2280 C CD2 . LEU A 310 ? 0.6368 0.5142 0.5207 -0.0435 0.0072 -0.0344 397 LEU A CD2 2281 N N . LEU A 311 ? 0.7627 0.7035 0.6714 -0.0511 0.0012 -0.0454 398 LEU A N 2282 C CA . LEU A 311 ? 0.7232 0.6836 0.6405 -0.0481 -0.0023 -0.0453 398 LEU A CA 2283 C C . LEU A 311 ? 0.7760 0.7516 0.6953 -0.0563 -0.0006 -0.0503 398 LEU A C 2284 O O . LEU A 311 ? 0.9126 0.8822 0.8260 -0.0641 0.0024 -0.0540 398 LEU A O 2285 C CB . LEU A 311 ? 0.7085 0.6692 0.6271 -0.0429 -0.0060 -0.0427 398 LEU A CB 2286 C CG . LEU A 311 ? 0.7168 0.6682 0.6359 -0.0342 -0.0089 -0.0376 398 LEU A CG 2287 C CD1 . LEU A 311 ? 0.7524 0.7071 0.6759 -0.0292 -0.0095 -0.0355 398 LEU A CD1 2288 C CD2 . LEU A 311 ? 0.8060 0.7378 0.7175 -0.0346 -0.0073 -0.0362 398 LEU A CD2 2289 N N . SER A 312 ? 0.7664 0.7620 0.6940 -0.0545 -0.0023 -0.0505 399 SER A N 2290 C CA . SER A 312 ? 0.8054 0.8192 0.7361 -0.0623 -0.0012 -0.0551 399 SER A CA 2291 C C . SER A 312 ? 0.8002 0.8350 0.7382 -0.0586 -0.0055 -0.0542 399 SER A C 2292 O O . SER A 312 ? 0.9091 0.9581 0.8480 -0.0653 -0.0057 -0.0581 399 SER A O 2293 C CB . SER A 312 ? 0.7323 0.7547 0.6669 -0.0643 0.0015 -0.0563 399 SER A CB 2294 O OG . SER A 312 ? 0.9765 1.0077 0.9184 -0.0547 -0.0009 -0.0522 399 SER A OG 2295 N N . ASN A 313 ? 0.7087 0.7458 0.6514 -0.0480 -0.0087 -0.0490 401 ASN A N 2296 C CA . ASN A 313 ? 0.8311 0.8896 0.7815 -0.0429 -0.0123 -0.0471 401 ASN A CA 2297 C C . ASN A 313 ? 0.8692 0.9245 0.8187 -0.0369 -0.0158 -0.0436 401 ASN A C 2298 O O . ASN A 313 ? 1.0287 1.1015 0.9829 -0.0340 -0.0187 -0.0424 401 ASN A O 2299 C CB . ASN A 313 ? 1.0012 1.0705 0.9593 -0.0355 -0.0122 -0.0438 401 ASN A CB 2300 C CG . ASN A 313 ? 1.3056 1.4006 1.2707 -0.0393 -0.0117 -0.0463 401 ASN A CG 2301 O OD1 . ASN A 313 ? 1.3443 1.4415 1.3080 -0.0485 -0.0086 -0.0510 401 ASN A OD1 2302 N ND2 . ASN A 313 ? 1.3482 1.4632 1.3211 -0.0321 -0.0144 -0.0430 401 ASN A ND2 2303 N N . SER A 314 ? 0.8121 0.8457 0.7556 -0.0350 -0.0156 -0.0420 402 SER A N 2304 C CA . SER A 314 ? 0.6879 0.7172 0.6304 -0.0295 -0.0185 -0.0386 402 SER A CA 2305 C C . SER A 314 ? 0.7752 0.8051 0.7126 -0.0362 -0.0186 -0.0422 402 SER A C 2306 O O . SER A 314 ? 0.6846 0.7099 0.6170 -0.0453 -0.0156 -0.0471 402 SER A O 2307 C CB . SER A 314 ? 0.8222 0.8297 0.7608 -0.0248 -0.0182 -0.0353 402 SER A CB 2308 O OG . SER A 314 ? 0.8174 0.8252 0.7607 -0.0169 -0.0189 -0.0313 402 SER A OG 2309 N N . THR A 315 ? 0.8635 0.8987 0.8015 -0.0323 -0.0215 -0.0400 403 THR A N 2310 C CA . THR A 315 ? 0.7994 0.8315 0.7309 -0.0388 -0.0210 -0.0437 403 THR A CA 2311 C C . THR A 315 ? 0.7650 0.7748 0.6904 -0.0363 -0.0201 -0.0416 403 THR A C 2312 O O . THR A 315 ? 0.7529 0.7567 0.6805 -0.0281 -0.0219 -0.0364 403 THR A O 2313 C CB . THR A 315 ? 0.7567 0.8099 0.6906 -0.0396 -0.0239 -0.0446 403 THR A CB 2314 O OG1 . THR A 315 ? 0.7303 0.7810 0.6643 -0.0318 -0.0266 -0.0398 403 THR A OG1 2315 C CG2 . THR A 315 ? 0.5946 0.6719 0.5369 -0.0379 -0.0257 -0.0440 403 THR A CG2 2316 N N . ILE A 316 ? 0.8443 0.8417 0.7620 -0.0437 -0.0168 -0.0457 404 ILE A N 2317 C CA . ILE A 316 ? 0.7499 0.7250 0.6615 -0.0419 -0.0148 -0.0439 404 ILE A CA 2318 C C . ILE A 316 ? 0.7057 0.6760 0.6121 -0.0424 -0.0147 -0.0445 404 ILE A C 2319 O O . ILE A 316 ? 0.7539 0.7311 0.6569 -0.0492 -0.0137 -0.0493 404 ILE A O 2320 C CB . ILE A 316 ? 0.7433 0.7039 0.6490 -0.0483 -0.0100 -0.0470 404 ILE A CB 2321 C CG1 . ILE A 316 ? 0.6951 0.6547 0.6048 -0.0454 -0.0100 -0.0448 404 ILE A CG1 2322 C CG2 . ILE A 316 ? 0.8143 0.7534 0.7127 -0.0470 -0.0075 -0.0455 404 ILE A CG2 2323 C CD1 . ILE A 316 ? 0.8104 0.7881 0.7261 -0.0478 -0.0108 -0.0468 404 ILE A CD1 2324 N N . GLY A 317 ? 0.7458 0.7051 0.6517 -0.0355 -0.0157 -0.0398 405 GLY A N 2325 C CA . GLY A 317 ? 0.5586 0.5101 0.4590 -0.0353 -0.0148 -0.0399 405 GLY A CA 2326 C C . GLY A 317 ? 0.7204 0.6503 0.6138 -0.0361 -0.0107 -0.0397 405 GLY A C 2327 O O . GLY A 317 ? 0.6447 0.5662 0.5327 -0.0426 -0.0066 -0.0435 405 GLY A O 2328 N N . ARG A 318 ? 0.7126 0.6337 0.6062 -0.0295 -0.0115 -0.0349 406 ARG A N 2329 C CA . ARG A 318 ? 0.7185 0.6208 0.6058 -0.0289 -0.0077 -0.0339 406 ARG A CA 2330 C C . ARG A 318 ? 0.7167 0.6110 0.6055 -0.0266 -0.0074 -0.0310 406 ARG A C 2331 O O . ARG A 318 ? 0.7332 0.6355 0.6283 -0.0240 -0.0105 -0.0292 406 ARG A O 2332 C CB . ARG A 318 ? 0.7864 0.6846 0.6739 -0.0226 -0.0088 -0.0297 406 ARG A CB 2333 C CG . ARG A 318 ? 0.6862 0.5942 0.5731 -0.0233 -0.0100 -0.0314 406 ARG A CG 2334 C CD . ARG A 318 ? 0.4665 0.3697 0.3540 -0.0165 -0.0107 -0.0266 406 ARG A CD 2335 N NE . ARG A 318 ? 0.7807 0.6862 0.6756 -0.0100 -0.0143 -0.0210 406 ARG A NE 2336 C CZ . ARG A 318 ? 0.7305 0.6264 0.6265 -0.0052 -0.0140 -0.0165 406 ARG A CZ 2337 N NH1 . ARG A 318 ? 0.7736 0.6570 0.6640 -0.0050 -0.0103 -0.0162 406 ARG A NH1 2338 N NH2 . ARG A 318 ? 0.7504 0.6497 0.6529 -0.0007 -0.0173 -0.0124 406 ARG A NH2 2339 N N . SER A 319 ? 0.5869 0.4650 0.4694 -0.0272 -0.0033 -0.0306 407 SER A N 2340 C CA . SER A 319 ? 0.6703 0.5402 0.5531 -0.0244 -0.0030 -0.0273 407 SER A CA 2341 C C . SER A 319 ? 0.7105 0.5645 0.5875 -0.0212 0.0003 -0.0242 407 SER A C 2342 O O . SER A 319 ? 0.6660 0.5125 0.5370 -0.0232 0.0041 -0.0261 407 SER A O 2343 C CB . SER A 319 ? 0.6205 0.4898 0.5010 -0.0305 -0.0005 -0.0309 407 SER A CB 2344 O OG . SER A 319 ? 0.5819 0.4425 0.4544 -0.0372 0.0049 -0.0353 407 SER A OG 2345 N N . GLY A 320 ? 0.6219 0.4713 0.5007 -0.0162 -0.0011 -0.0193 408 GLY A N 2346 C CA . GLY A 320 ? 0.5823 0.4198 0.4574 -0.0115 0.0012 -0.0151 408 GLY A CA 2347 C C . GLY A 320 ? 0.8196 0.6526 0.6953 -0.0077 0.0001 -0.0106 408 GLY A C 2348 O O . GLY A 320 ? 0.7898 0.6299 0.6700 -0.0077 -0.0033 -0.0103 408 GLY A O 2349 N N . LEU A 321 ? 0.7392 0.5609 0.6099 -0.0041 0.0033 -0.0070 409 LEU A N 2350 C CA . LEU A 321 ? 0.6896 0.5069 0.5595 -0.0005 0.0028 -0.0024 409 LEU A CA 2351 C C . LEU A 321 ? 0.7745 0.5982 0.6507 0.0057 -0.0019 0.0029 409 LEU A C 2352 O O . LEU A 321 ? 0.8006 0.6269 0.6796 0.0088 -0.0028 0.0045 409 LEU A O 2353 C CB . LEU A 321 ? 0.7625 0.5648 0.6238 0.0011 0.0089 -0.0003 409 LEU A CB 2354 C CG . LEU A 321 ? 0.8806 0.6724 0.7339 -0.0040 0.0143 -0.0031 409 LEU A CG 2355 C CD1 . LEU A 321 ? 0.6343 0.4348 0.4907 -0.0101 0.0120 -0.0077 409 LEU A CD1 2356 C CD2 . LEU A 321 ? 0.7788 0.5593 0.6246 -0.0069 0.0209 -0.0063 409 LEU A CD2 2357 N N . TYR A 322 ? 0.7664 0.5923 0.6441 0.0072 -0.0046 0.0055 410 TYR A N 2358 C CA . TYR A 322 ? 0.6557 0.4865 0.5381 0.0124 -0.0084 0.0107 410 TYR A CA 2359 C C . TYR A 322 ? 0.6175 0.4461 0.4973 0.0144 -0.0091 0.0143 410 TYR A C 2360 O O . TYR A 322 ? 0.7734 0.5996 0.6499 0.0113 -0.0083 0.0124 410 TYR A O 2361 C CB . TYR A 322 ? 0.6066 0.4488 0.4971 0.0121 -0.0135 0.0097 410 TYR A CB 2362 C CG . TYR A 322 ? 0.7017 0.5492 0.5947 0.0092 -0.0164 0.0074 410 TYR A CG 2363 C CD1 . TYR A 322 ? 0.7738 0.6241 0.6673 0.0051 -0.0158 0.0026 410 TYR A CD1 2364 C CD2 . TYR A 322 ? 0.5527 0.4035 0.4478 0.0107 -0.0197 0.0100 410 TYR A CD2 2365 C CE1 . TYR A 322 ? 0.7347 0.5900 0.6307 0.0032 -0.0180 0.0007 410 TYR A CE1 2366 C CE2 . TYR A 322 ? 0.6763 0.5309 0.5731 0.0081 -0.0218 0.0076 410 TYR A CE2 2367 C CZ . TYR A 322 ? 0.8149 0.6715 0.7122 0.0048 -0.0208 0.0031 410 TYR A CZ 2368 O OH . TYR A 322 ? 0.7885 0.6489 0.6876 0.0029 -0.0223 0.0009 410 TYR A OH 2369 N N . GLN A 323 ? 0.6375 0.4678 0.5188 0.0196 -0.0104 0.0198 411 GLN A N 2370 C CA . GLN A 323 ? 0.7170 0.5470 0.5957 0.0219 -0.0115 0.0238 411 GLN A CA 2371 C C . GLN A 323 ? 0.7259 0.5672 0.6111 0.0231 -0.0175 0.0261 411 GLN A C 2372 O O . GLN A 323 ? 0.8282 0.6748 0.7179 0.0266 -0.0192 0.0295 411 GLN A O 2373 C CB . GLN A 323 ? 0.4943 0.3165 0.3677 0.0273 -0.0073 0.0291 411 GLN A CB 2374 C CG . GLN A 323 ? 0.7599 0.5681 0.6242 0.0257 -0.0006 0.0274 411 GLN A CG 2375 C CD . GLN A 323 ? 0.8045 0.6029 0.6633 0.0315 0.0048 0.0322 411 GLN A CD 2376 O OE1 . GLN A 323 ? 0.8943 0.6936 0.7557 0.0351 0.0056 0.0339 411 GLN A OE1 2377 N NE2 . GLN A 323 ? 0.8103 0.5987 0.6609 0.0329 0.0091 0.0347 411 GLN A NE2 2378 N N . PRO A 324 ? 0.8070 0.6518 0.6924 0.0198 -0.0203 0.0240 412 PRO A N 2379 C CA . PRO A 324 ? 0.7826 0.6369 0.6726 0.0203 -0.0255 0.0261 412 PRO A CA 2380 C C . PRO A 324 ? 0.8153 0.6709 0.7029 0.0251 -0.0257 0.0323 412 PRO A C 2381 O O . PRO A 324 ? 0.8876 0.7356 0.7686 0.0274 -0.0219 0.0346 412 PRO A O 2382 C CB . PRO A 324 ? 0.7616 0.6162 0.6494 0.0160 -0.0269 0.0225 412 PRO A CB 2383 C CG . PRO A 324 ? 0.7212 0.5689 0.6060 0.0131 -0.0230 0.0181 412 PRO A CG 2384 C CD . PRO A 324 ? 0.8034 0.6433 0.6840 0.0157 -0.0185 0.0203 412 PRO A CD 2385 N N . ALA A 325 ? 0.9434 0.8087 0.8364 0.0269 -0.0296 0.0354 413 ALA A N 2386 C CA . ALA A 325 ? 1.1463 1.0144 1.0386 0.0326 -0.0291 0.0420 413 ALA A CA 2387 C C . ALA A 325 ? 1.1839 1.0639 1.0789 0.0326 -0.0343 0.0449 413 ALA A C 2388 O O . ALA A 325 ? 1.4719 1.3568 1.3661 0.0374 -0.0346 0.0508 413 ALA A O 2389 C CB . ALA A 325 ? 1.3837 1.2524 1.2804 0.0362 -0.0274 0.0439 413 ALA A CB 2390 N N . TYR A 326 A 0.9298 0.8149 0.8278 0.0271 -0.0381 0.0407 413 TYR A N 2391 C CA . TYR A 326 A 1.3487 1.2455 1.2494 0.0254 -0.0432 0.0422 413 TYR A CA 2392 C C . TYR A 326 A 1.6026 1.4990 1.4959 0.0247 -0.0440 0.0430 413 TYR A C 2393 O O . TYR A 326 A 1.6176 1.5116 1.5080 0.0198 -0.0449 0.0384 413 TYR A O 2394 C CB . TYR A 326 A 1.5100 1.4110 1.4164 0.0199 -0.0462 0.0375 413 TYR A CB 2395 C CG . TYR A 326 A 1.5599 1.4521 1.4650 0.0163 -0.0442 0.0315 413 TYR A CG 2396 C CD1 . TYR A 326 A 1.4427 1.3285 1.3492 0.0177 -0.0409 0.0300 413 TYR A CD1 2397 C CD2 . TYR A 326 A 1.6019 1.4932 1.5046 0.0115 -0.0457 0.0272 413 TYR A CD2 2398 C CE1 . TYR A 326 A 1.3863 1.2665 1.2923 0.0147 -0.0394 0.0249 413 TYR A CE1 2399 C CE2 . TYR A 326 A 1.5524 1.4371 1.4545 0.0090 -0.0438 0.0222 413 TYR A CE2 2400 C CZ . TYR A 326 A 1.4766 1.3566 1.3807 0.0107 -0.0408 0.0213 413 TYR A CZ 2401 O OH . TYR A 326 A 1.4210 1.2967 1.3250 0.0084 -0.0392 0.0167 413 TYR A OH 2402 N N . GLU A 327 ? 1.7224 1.6215 1.6126 0.0301 -0.0433 0.0492 414 GLU A N 2403 C CA . GLU A 327 ? 1.6759 1.5694 1.5572 0.0319 -0.0413 0.0513 414 GLU A CA 2404 C C . GLU A 327 ? 1.7907 1.6919 1.6709 0.0386 -0.0419 0.0594 414 GLU A C 2405 O O . GLU A 327 ? 1.9403 1.8468 1.8261 0.0430 -0.0418 0.0633 414 GLU A O 2406 C CB . GLU A 327 ? 1.6426 1.5203 1.5192 0.0329 -0.0350 0.0494 414 GLU A CB 2407 C CG . GLU A 327 ? 1.7172 1.5860 1.5846 0.0373 -0.0305 0.0536 414 GLU A CG 2408 C CD . GLU A 327 ? 1.6423 1.5075 1.5092 0.0450 -0.0265 0.0598 414 GLU A CD 2409 O OE1 . GLU A 327 ? 1.7381 1.6105 1.6123 0.0473 -0.0281 0.0616 414 GLU A OE1 2410 O OE2 . GLU A 327 ? 1.3509 1.2055 1.2100 0.0488 -0.0213 0.0631 414 GLU A OE2 2411 N N . SER A 328 ? 1.5848 1.4878 1.4580 0.0398 -0.0427 0.0623 415 SER A N 2412 C CA . SER A 328 ? 1.4209 1.3273 1.2907 0.0479 -0.0413 0.0709 415 SER A CA 2413 C C . SER A 328 ? 1.4482 1.3432 1.3071 0.0487 -0.0376 0.0717 415 SER A C 2414 O O . SER A 328 ? 1.5231 1.4193 1.3762 0.0549 -0.0363 0.0787 415 SER A O 2415 C CB . SER A 328 ? 1.3724 1.2986 1.2462 0.0487 -0.0475 0.0751 415 SER A CB 2416 O OG . SER A 328 ? 1.4057 1.3416 1.2897 0.0482 -0.0500 0.0749 415 SER A OG 2417 N N . ARG A 329 A 1.3049 1.1888 1.1612 0.0427 -0.0356 0.0646 415 ARG A N 2418 C CA . ARG A 329 A 1.1765 1.0495 1.0232 0.0409 -0.0322 0.0631 415 ARG A CA 2419 C C . ARG A 329 A 1.2310 1.0911 1.0699 0.0473 -0.0253 0.0686 415 ARG A C 2420 O O . ARG A 329 A 1.3691 1.2268 1.2098 0.0535 -0.0223 0.0732 415 ARG A O 2421 C CB . ARG A 329 A 1.0669 0.9317 0.9146 0.0336 -0.0309 0.0544 415 ARG A CB 2422 C CG . ARG A 329 A 1.1848 1.0594 1.0401 0.0278 -0.0364 0.0489 415 ARG A CG 2423 C CD . ARG A 329 A 1.0839 0.9507 0.9407 0.0220 -0.0345 0.0411 415 ARG A CD 2424 N NE . ARG A 329 A 1.1869 1.0465 1.0358 0.0192 -0.0320 0.0387 415 ARG A NE 2425 C CZ . ARG A 329 A 1.0714 0.9356 0.9166 0.0159 -0.0348 0.0370 415 ARG A CZ 2426 N NH1 . ARG A 329 A 0.9418 0.8179 0.7903 0.0145 -0.0405 0.0372 415 ARG A NH1 2427 N NH2 . ARG A 329 A 0.8619 0.7190 0.6998 0.0137 -0.0319 0.0349 415 ARG A NH2 2428 N N . ASP A 330 ? 1.0381 0.8891 0.8679 0.0457 -0.0222 0.0679 416 ASP A N 2429 C CA . ASP A 330 ? 1.0937 0.9321 0.9142 0.0514 -0.0155 0.0736 416 ASP A CA 2430 C C . ASP A 330 ? 1.0583 0.8788 0.8765 0.0499 -0.0080 0.0701 416 ASP A C 2431 O O . ASP A 330 ? 1.1705 0.9773 0.9802 0.0534 -0.0011 0.0736 416 ASP A O 2432 C CB . ASP A 330 ? 1.3895 1.2267 1.2006 0.0500 -0.0154 0.0748 416 ASP A CB 2433 C CG . ASP A 330 ? 1.6572 1.5114 1.4680 0.0531 -0.0218 0.0801 416 ASP A CG 2434 O OD1 . ASP A 330 ? 1.6589 1.5269 1.4764 0.0485 -0.0286 0.0763 416 ASP A OD1 2435 O OD2 . ASP A 330 ? 1.7440 1.5980 1.5477 0.0600 -0.0199 0.0882 416 ASP A OD2 2436 N N . CYS A 331 ? 0.9876 0.8084 0.8131 0.0446 -0.0091 0.0631 417 CYS A N 2437 C CA . CYS A 331 ? 0.9193 0.7260 0.7427 0.0404 -0.0032 0.0576 417 CYS A CA 2438 C C . CYS A 331 ? 0.8987 0.7107 0.7321 0.0368 -0.0060 0.0520 417 CYS A C 2439 O O . CYS A 331 ? 0.8993 0.7233 0.7394 0.0337 -0.0122 0.0491 417 CYS A O 2440 C CB . CYS A 331 ? 0.6659 0.4682 0.4836 0.0343 -0.0021 0.0535 417 CYS A CB 2441 S SG . CYS A 331 ? 1.3389 1.1316 1.1569 0.0261 0.0021 0.0445 417 CYS A SG 2442 N N . GLN A 332 ? 0.8797 0.6826 0.7135 0.0375 -0.0012 0.0508 418 GLN A N 2443 C CA . GLN A 332 ? 0.7702 0.5784 0.6128 0.0352 -0.0036 0.0464 418 GLN A CA 2444 C C . GLN A 332 ? 0.8012 0.6055 0.6447 0.0274 -0.0024 0.0383 418 GLN A C 2445 O O . GLN A 332 ? 0.8708 0.6632 0.7081 0.0249 0.0035 0.0360 418 GLN A O 2446 C CB . GLN A 332 ? 0.5851 0.3877 0.4283 0.0405 0.0003 0.0495 418 GLN A CB 2447 C CG . GLN A 332 ? 0.6934 0.4987 0.5436 0.0374 -0.0007 0.0445 418 GLN A CG 2448 C CD . GLN A 332 ? 0.7972 0.6184 0.6572 0.0373 -0.0080 0.0444 418 GLN A CD 2449 O OE1 . GLN A 332 ? 0.7553 0.5845 0.6184 0.0426 -0.0106 0.0500 418 GLN A OE1 2450 N NE2 . GLN A 332 ? 0.7630 0.5890 0.6280 0.0313 -0.0112 0.0383 418 GLN A NE2 2451 N N . GLU A 333 ? 0.6888 0.5037 0.5400 0.0237 -0.0078 0.0341 419 GLU A N 2452 C CA . GLU A 333 ? 0.6448 0.4593 0.4979 0.0171 -0.0076 0.0270 419 GLU A CA 2453 C C . GLU A 333 ? 0.7536 0.5651 0.6098 0.0157 -0.0051 0.0236 419 GLU A C 2454 O O . GLU A 333 ? 0.7760 0.5897 0.6359 0.0193 -0.0058 0.0259 419 GLU A O 2455 C CB . GLU A 333 ? 0.7582 0.5845 0.6177 0.0147 -0.0138 0.0245 419 GLU A CB 2456 C CG . GLU A 333 ? 0.8658 0.6937 0.7283 0.0091 -0.0139 0.0179 419 GLU A CG 2457 C CD . GLU A 333 ? 1.0227 0.8465 0.8794 0.0055 -0.0116 0.0156 419 GLU A CD 2458 O OE1 . GLU A 333 ? 1.0820 0.9035 0.9327 0.0071 -0.0113 0.0190 419 GLU A OE1 2459 O OE2 . GLU A 333 ? 0.8994 0.7231 0.7576 0.0011 -0.0100 0.0104 419 GLU A OE2 2460 N N . LEU A 334 ? 0.7866 0.5938 0.6411 0.0102 -0.0021 0.0181 420 LEU A N 2461 C CA . LEU A 334 ? 0.6704 0.4757 0.5270 0.0079 0.0002 0.0143 420 LEU A CA 2462 C C . LEU A 334 ? 0.8514 0.6647 0.7135 0.0026 -0.0022 0.0082 420 LEU A C 2463 O O . LEU A 334 ? 0.8350 0.6493 0.6959 -0.0013 -0.0019 0.0054 420 LEU A O 2464 C CB . LEU A 334 ? 0.7145 0.5058 0.5626 0.0063 0.0076 0.0135 420 LEU A CB 2465 C CG . LEU A 334 ? 0.8795 0.6669 0.7276 0.0039 0.0109 0.0097 420 LEU A CG 2466 C CD1 . LEU A 334 ? 0.7472 0.5382 0.5997 0.0092 0.0089 0.0128 420 LEU A CD1 2467 C CD2 . LEU A 334 ? 0.9008 0.6722 0.7389 0.0017 0.0191 0.0089 420 LEU A CD2 2468 N N . CYS A 335 ? 0.8439 0.6634 0.7121 0.0028 -0.0043 0.0066 421 CYS A N 2469 C CA . CYS A 335 ? 0.7565 0.5846 0.6302 -0.0011 -0.0066 0.0017 421 CYS A CA 2470 C C . CYS A 335 ? 0.7818 0.6108 0.6568 -0.0032 -0.0049 -0.0015 421 CYS A C 2471 O O . CYS A 335 ? 0.7777 0.6008 0.6501 -0.0013 -0.0024 -0.0001 421 CYS A O 2472 C CB . CYS A 335 ? 0.5343 0.3723 0.4152 0.0012 -0.0124 0.0030 421 CYS A CB 2473 S SG . CYS A 335 ? 0.8189 0.6581 0.6987 0.0031 -0.0154 0.0062 421 CYS A SG 2474 N N . PHE A 336 ? 0.6769 0.5139 0.5560 -0.0068 -0.0062 -0.0059 422 PHE A N 2475 C CA . PHE A 336 ? 0.6310 0.4718 0.5119 -0.0088 -0.0056 -0.0089 422 PHE A CA 2476 C C . PHE A 336 ? 0.7055 0.5596 0.5942 -0.0090 -0.0096 -0.0108 422 PHE A C 2477 O O . PHE A 336 ? 0.6675 0.5267 0.5592 -0.0092 -0.0116 -0.0113 422 PHE A O 2478 C CB . PHE A 336 ? 0.7018 0.5362 0.5763 -0.0145 -0.0001 -0.0131 422 PHE A CB 2479 C CG . PHE A 336 ? 0.7419 0.5807 0.6167 -0.0199 0.0007 -0.0170 422 PHE A CG 2480 C CD1 . PHE A 336 ? 0.7682 0.6196 0.6484 -0.0228 -0.0013 -0.0208 422 PHE A CD1 2481 C CD2 . PHE A 336 ? 0.7866 0.6174 0.6558 -0.0218 0.0039 -0.0167 422 PHE A CD2 2482 C CE1 . PHE A 336 ? 0.7621 0.6191 0.6431 -0.0275 -0.0003 -0.0243 422 PHE A CE1 2483 C CE2 . PHE A 336 ? 0.8147 0.6502 0.6844 -0.0270 0.0051 -0.0204 422 PHE A CE2 2484 C CZ . PHE A 336 ? 0.7574 0.6063 0.6333 -0.0298 0.0030 -0.0242 422 PHE A CZ 2485 N N . TRP A 337 ? 0.6981 0.5572 0.5895 -0.0083 -0.0106 -0.0115 423 TRP A N 2486 C CA . TRP A 337 ? 0.7149 0.5863 0.6130 -0.0080 -0.0138 -0.0129 423 TRP A CA 2487 C C . TRP A 337 ? 0.6796 0.5568 0.5768 -0.0128 -0.0121 -0.0175 423 TRP A C 2488 O O . TRP A 337 ? 0.7644 0.6354 0.6560 -0.0160 -0.0086 -0.0196 423 TRP A O 2489 C CB . TRP A 337 ? 0.6793 0.5541 0.5819 -0.0030 -0.0169 -0.0094 423 TRP A CB 2490 C CG . TRP A 337 ? 0.7005 0.5696 0.5998 -0.0019 -0.0150 -0.0083 423 TRP A CG 2491 C CD1 . TRP A 337 ? 0.6212 0.4822 0.5182 0.0014 -0.0141 -0.0045 423 TRP A CD1 2492 C CD2 . TRP A 337 ? 0.7390 0.6104 0.6366 -0.0039 -0.0135 -0.0109 423 TRP A CD2 2493 N NE1 . TRP A 337 ? 0.6826 0.5399 0.5766 0.0019 -0.0117 -0.0046 423 TRP A NE1 2494 C CE2 . TRP A 337 ? 0.6690 0.5321 0.5629 -0.0016 -0.0112 -0.0088 423 TRP A CE2 2495 C CE3 . TRP A 337 ? 0.6092 0.4899 0.5078 -0.0074 -0.0137 -0.0149 423 TRP A CE3 2496 C CZ2 . TRP A 337 ? 0.6547 0.5168 0.5452 -0.0030 -0.0089 -0.0109 423 TRP A CZ2 2497 C CZ3 . TRP A 337 ? 0.7225 0.6034 0.6179 -0.0092 -0.0120 -0.0169 423 TRP A CZ3 2498 C CH2 . TRP A 337 ? 0.6801 0.5511 0.5711 -0.0071 -0.0094 -0.0151 423 TRP A CH2 2499 N N . ILE A 338 ? 0.6879 0.5772 0.5904 -0.0135 -0.0142 -0.0192 424 ILE A N 2500 C CA . ILE A 338 ? 0.6601 0.5593 0.5633 -0.0175 -0.0137 -0.0232 424 ILE A CA 2501 C C . ILE A 338 ? 0.6891 0.6003 0.5987 -0.0133 -0.0174 -0.0215 424 ILE A C 2502 O O . ILE A 338 ? 0.6949 0.6103 0.6096 -0.0093 -0.0198 -0.0190 424 ILE A O 2503 C CB . ILE A 338 ? 0.6712 0.5766 0.5750 -0.0224 -0.0123 -0.0270 424 ILE A CB 2504 C CG1 . ILE A 338 ? 0.6921 0.5852 0.5899 -0.0257 -0.0086 -0.0278 424 ILE A CG1 2505 C CG2 . ILE A 338 ? 0.6189 0.5344 0.5223 -0.0280 -0.0113 -0.0315 424 ILE A CG2 2506 C CD1 . ILE A 338 ? 0.6243 0.5237 0.5226 -0.0312 -0.0067 -0.0316 424 ILE A CD1 2507 N N . GLU A 339 ? 0.7883 0.7042 0.6970 -0.0143 -0.0175 -0.0227 425 GLU A N 2508 C CA . GLU A 339 ? 0.6348 0.5634 0.5488 -0.0107 -0.0206 -0.0211 425 GLU A CA 2509 C C . GLU A 339 ? 0.6735 0.6172 0.5900 -0.0143 -0.0210 -0.0247 425 GLU A C 2510 O O . GLU A 339 ? 0.8120 0.7576 0.7247 -0.0209 -0.0188 -0.0293 425 GLU A O 2511 C CB . GLU A 339 ? 0.6210 0.5479 0.5325 -0.0094 -0.0207 -0.0202 425 GLU A CB 2512 C CG . GLU A 339 ? 0.7335 0.6721 0.6500 -0.0046 -0.0239 -0.0174 425 GLU A CG 2513 C CD . GLU A 339 ? 0.6835 0.6184 0.5975 -0.0024 -0.0238 -0.0156 425 GLU A CD 2514 O OE1 . GLU A 339 ? 0.6980 0.6303 0.6063 -0.0067 -0.0215 -0.0189 425 GLU A OE1 2515 O OE2 . GLU A 339 ? 0.6400 0.5739 0.5573 0.0032 -0.0255 -0.0110 425 GLU A OE2 2516 N N . ILE A 340 ? 0.7096 0.6640 0.6325 -0.0099 -0.0235 -0.0224 426 ILE A N 2517 C CA . ILE A 340 ? 0.6444 0.6142 0.5712 -0.0117 -0.0239 -0.0246 426 ILE A CA 2518 C C . ILE A 340 ? 0.7167 0.7014 0.6479 -0.0073 -0.0266 -0.0223 426 ILE A C 2519 O O . ILE A 340 ? 0.7354 0.7173 0.6686 -0.0009 -0.0282 -0.0178 426 ILE A O 2520 C CB . ILE A 340 ? 0.7210 0.6897 0.6515 -0.0088 -0.0237 -0.0231 426 ILE A CB 2521 C CG1 . ILE A 340 ? 0.8755 0.8309 0.8013 -0.0133 -0.0210 -0.0252 426 ILE A CG1 2522 C CG2 . ILE A 340 ? 0.8210 0.8068 0.7568 -0.0090 -0.0241 -0.0244 426 ILE A CG2 2523 C CD1 . ILE A 340 ? 0.9505 0.9086 0.8726 -0.0216 -0.0184 -0.0304 426 ILE A CD1 2524 N N . ALA A 341 ? 0.7934 0.7945 0.7260 -0.0108 -0.0271 -0.0253 427 ALA A N 2525 C CA . ALA A 341 ? 0.7315 0.7490 0.6687 -0.0057 -0.0299 -0.0224 427 ALA A CA 2526 C C . ALA A 341 ? 0.7986 0.8214 0.7424 0.0013 -0.0305 -0.0185 427 ALA A C 2527 O O . ALA A 341 ? 0.9029 0.9285 0.8490 -0.0004 -0.0292 -0.0202 427 ALA A O 2528 C CB . ALA A 341 ? 0.5856 0.6208 0.5227 -0.0114 -0.0305 -0.0265 427 ALA A CB 2529 N N . ALA A 342 ? 0.7584 0.7818 0.7049 0.0092 -0.0320 -0.0132 428 ALA A N 2530 C CA . ALA A 342 ? 0.7996 0.8258 0.7513 0.0166 -0.0319 -0.0091 428 ALA A CA 2531 C C . ALA A 342 ? 0.9298 0.9712 0.8852 0.0234 -0.0337 -0.0047 428 ALA A C 2532 O O . ALA A 342 ? 1.0045 1.0531 0.9578 0.0222 -0.0354 -0.0048 428 ALA A O 2533 C CB . ALA A 342 ? 0.6515 0.6587 0.6021 0.0201 -0.0310 -0.0062 428 ALA A CB 2534 N N . THR A 343 ? 0.8771 0.9228 0.8373 0.0307 -0.0331 -0.0008 429 THR A N 2535 C CA . THR A 343 ? 0.7884 0.8474 0.7520 0.0387 -0.0342 0.0045 429 THR A CA 2536 C C . THR A 343 ? 0.8751 0.9216 0.8400 0.0471 -0.0324 0.0099 429 THR A C 2537 O O . THR A 343 ? 0.9283 0.9647 0.8940 0.0476 -0.0302 0.0092 429 THR A O 2538 C CB . THR A 343 ? 0.8102 0.8924 0.7790 0.0398 -0.0347 0.0041 429 THR A CB 2539 O OG1 . THR A 343 ? 1.0183 1.1066 0.9859 0.0299 -0.0349 -0.0026 429 THR A OG1 2540 C CG2 . THR A 343 ? 0.6753 0.7761 0.6456 0.0445 -0.0370 0.0079 429 THR A CG2 2541 N N . THR A 344 ? 0.9173 0.9634 0.8819 0.0532 -0.0329 0.0151 430 THR A N 2542 C CA . THR A 344 ? 0.8654 0.8987 0.8307 0.0608 -0.0305 0.0203 430 THR A CA 2543 C C . THR A 344 ? 0.9109 0.9554 0.8809 0.0691 -0.0287 0.0242 430 THR A C 2544 O O . THR A 344 ? 0.9372 1.0021 0.9103 0.0698 -0.0301 0.0239 430 THR A O 2545 C CB . THR A 344 ? 0.8435 0.8704 0.8063 0.0642 -0.0310 0.0247 430 THR A CB 2546 O OG1 . THR A 344 ? 0.9171 0.9601 0.8816 0.0709 -0.0318 0.0295 430 THR A OG1 2547 C CG2 . THR A 344 ? 0.6821 0.7039 0.6406 0.0565 -0.0329 0.0209 430 THR A CG2 2548 N N . LYS A 345 ? 0.9524 0.9836 0.9227 0.0752 -0.0254 0.0276 431 LYS A N 2549 C CA . LYS A 345 ? 1.0557 1.0946 1.0300 0.0840 -0.0226 0.0316 431 LYS A CA 2550 C C . LYS A 345 ? 1.0479 1.1049 1.0245 0.0916 -0.0237 0.0374 431 LYS A C 2551 O O . LYS A 345 ? 0.9387 1.0140 0.9198 0.0965 -0.0235 0.0393 431 LYS A O 2552 C CB . LYS A 345 ? 1.0027 1.0213 0.9754 0.0890 -0.0182 0.0342 431 LYS A CB 2553 C CG . LYS A 345 ? 1.3018 1.3235 1.2777 0.0944 -0.0145 0.0348 431 LYS A CG 2554 C CD . LYS A 345 ? 1.4703 1.4780 1.4450 0.1036 -0.0094 0.0402 431 LYS A CD 2555 C CE . LYS A 345 ? 1.4431 1.4568 1.4212 0.1105 -0.0053 0.0415 431 LYS A CE 2556 N NZ . LYS A 345 ? 1.4169 1.4353 1.3965 0.1034 -0.0062 0.0350 431 LYS A NZ 2557 N N . ALA A 346 ? 0.8797 0.9325 0.8532 0.0927 -0.0249 0.0405 432 ALA A N 2558 C CA . ALA A 346 ? 0.8968 0.9668 0.8713 0.0992 -0.0264 0.0460 432 ALA A CA 2559 C C . ALA A 346 ? 1.0421 1.1358 1.0184 0.0937 -0.0306 0.0421 432 ALA A C 2560 O O . ALA A 346 ? 1.1850 1.2998 1.1639 0.0993 -0.0319 0.0460 432 ALA A O 2561 C CB . ALA A 346 ? 0.7579 0.8173 0.7280 0.1001 -0.0268 0.0493 432 ALA A CB 2562 N N . GLY A 347 ? 0.9656 1.0558 0.9400 0.0828 -0.0325 0.0347 433 GLY A N 2563 C CA . GLY A 347 ? 0.9474 1.0574 0.9226 0.0757 -0.0358 0.0298 433 GLY A CA 2564 C C . GLY A 347 ? 1.0090 1.1179 0.9790 0.0682 -0.0386 0.0264 433 GLY A C 2565 O O . GLY A 347 ? 0.7590 0.8860 0.7285 0.0632 -0.0413 0.0232 433 GLY A O 2566 N N . LEU A 348 ? 0.9883 1.0763 0.9540 0.0671 -0.0376 0.0269 438 LEU A N 2567 C CA . LEU A 348 ? 0.8334 0.9172 0.7938 0.0596 -0.0394 0.0231 438 LEU A CA 2568 C C . LEU A 348 ? 0.9003 0.9773 0.8588 0.0492 -0.0393 0.0153 438 LEU A C 2569 O O . LEU A 348 ? 0.8274 0.8949 0.7877 0.0480 -0.0376 0.0136 438 LEU A O 2570 C CB . LEU A 348 ? 0.7424 0.8073 0.6995 0.0622 -0.0382 0.0265 438 LEU A CB 2571 C CG . LEU A 348 ? 0.8050 0.8719 0.7628 0.0724 -0.0373 0.0347 438 LEU A CG 2572 C CD1 . LEU A 348 ? 0.7051 0.7553 0.6591 0.0729 -0.0363 0.0372 438 LEU A CD1 2573 C CD2 . LEU A 348 ? 0.8056 0.8967 0.7639 0.0756 -0.0397 0.0370 438 LEU A CD2 2574 N N . SER A 349 ? 0.9676 1.0489 0.9218 0.0417 -0.0409 0.0107 439 SER A N 2575 C CA . SER A 349 ? 1.0085 1.0795 0.9593 0.0320 -0.0401 0.0039 439 SER A CA 2576 C C . SER A 349 ? 0.9113 0.9589 0.8589 0.0318 -0.0385 0.0046 439 SER A C 2577 O O . SER A 349 ? 0.8499 0.8919 0.7954 0.0352 -0.0387 0.0081 439 SER A O 2578 C CB . SER A 349 ? 0.9218 1.0029 0.8680 0.0242 -0.0415 -0.0013 439 SER A CB 2579 O OG . SER A 349 ? 1.0921 1.1877 1.0401 0.0183 -0.0419 -0.0061 439 SER A OG 2580 N N . SER A 350 ? 0.7736 0.8086 0.7210 0.0280 -0.0369 0.0016 440 SER A N 2581 C CA . SER A 350 ? 0.9028 0.9175 0.8471 0.0269 -0.0356 0.0017 440 SER A CA 2582 C C . SER A 350 ? 0.9150 0.9210 0.8568 0.0195 -0.0342 -0.0036 440 SER A C 2583 O O . SER A 350 ? 0.9340 0.9490 0.8758 0.0145 -0.0341 -0.0078 440 SER A O 2584 C CB . SER A 350 ? 0.9819 0.9869 0.9293 0.0338 -0.0348 0.0069 440 SER A CB 2585 O OG . SER A 350 ? 1.1773 1.1678 1.1222 0.0340 -0.0343 0.0086 440 SER A OG 2586 N N . ASN A 351 ? 0.8364 0.8255 0.7758 0.0187 -0.0331 -0.0033 441 ASN A N 2587 C CA . ASN A 351 ? 0.6373 0.6169 0.5741 0.0131 -0.0316 -0.0073 441 ASN A CA 2588 C C . ASN A 351 ? 0.7434 0.7128 0.6824 0.0160 -0.0310 -0.0051 441 ASN A C 2589 O O . ASN A 351 ? 0.7160 0.6819 0.6574 0.0215 -0.0315 -0.0008 441 ASN A O 2590 C CB . ASN A 351 ? 0.6371 0.6052 0.5684 0.0095 -0.0305 -0.0087 441 ASN A CB 2591 C CG . ASN A 351 ? 0.7085 0.6840 0.6362 0.0067 -0.0307 -0.0109 441 ASN A CG 2592 O OD1 . ASN A 351 ? 0.6464 0.6306 0.5725 0.0013 -0.0303 -0.0153 441 ASN A OD1 2593 N ND2 . ASN A 351 ? 0.6134 0.5855 0.5397 0.0097 -0.0310 -0.0080 441 ASN A ND2 2594 N N . ASP A 352 ? 0.5948 0.5593 0.5325 0.0119 -0.0296 -0.0082 442 ASP A N 2595 C CA . ASP A 352 ? 0.8388 0.7892 0.7754 0.0125 -0.0290 -0.0070 442 ASP A CA 2596 C C . ASP A 352 ? 0.8115 0.7530 0.7432 0.0068 -0.0274 -0.0103 442 ASP A C 2597 O O . ASP A 352 ? 0.8070 0.7501 0.7353 0.0022 -0.0263 -0.0134 442 ASP A O 2598 C CB . ASP A 352 ? 0.9511 0.9005 0.8912 0.0165 -0.0288 -0.0051 442 ASP A CB 2599 C CG . ASP A 352 ? 1.0413 0.9977 0.9828 0.0146 -0.0277 -0.0080 442 ASP A CG 2600 O OD1 . ASP A 352 ? 1.1896 1.1550 1.1306 0.0105 -0.0274 -0.0111 442 ASP A OD1 2601 O OD2 . ASP A 352 ? 1.0254 0.9784 0.9685 0.0169 -0.0268 -0.0072 442 ASP A OD2 2602 N N . LEU A 353 ? 0.6892 0.6209 0.6201 0.0071 -0.0269 -0.0095 443 LEU A N 2603 C CA . LEU A 353 ? 0.7547 0.6751 0.6807 0.0040 -0.0257 -0.0103 443 LEU A CA 2604 C C . LEU A 353 ? 0.8047 0.7206 0.7298 0.0026 -0.0247 -0.0114 443 LEU A C 2605 O O . LEU A 353 ? 0.7456 0.6612 0.6733 0.0055 -0.0256 -0.0099 443 LEU A O 2606 C CB . LEU A 353 ? 0.7133 0.6265 0.6392 0.0073 -0.0268 -0.0066 443 LEU A CB 2607 C CG . LEU A 353 ? 0.7088 0.6122 0.6302 0.0059 -0.0258 -0.0059 443 LEU A CG 2608 C CD1 . LEU A 353 ? 0.7326 0.6282 0.6532 0.0065 -0.0261 -0.0043 443 LEU A CD1 2609 C CD2 . LEU A 353 ? 0.6151 0.5164 0.5314 0.0012 -0.0231 -0.0095 443 LEU A CD2 2610 N N . ILE A 354 ? 0.8192 0.7311 0.7399 -0.0021 -0.0226 -0.0142 444 ILE A N 2611 C CA . ILE A 354 ? 0.8011 0.7076 0.7198 -0.0035 -0.0214 -0.0149 444 ILE A CA 2612 C C . ILE A 354 ? 0.7280 0.6229 0.6406 -0.0056 -0.0199 -0.0145 444 ILE A C 2613 O O . ILE A 354 ? 0.7634 0.6553 0.6730 -0.0072 -0.0186 -0.0149 444 ILE A O 2614 C CB . ILE A 354 ? 0.7619 0.6761 0.6816 -0.0067 -0.0197 -0.0184 444 ILE A CB 2615 C CG1 . ILE A 354 ? 0.8902 0.8058 0.8064 -0.0125 -0.0174 -0.0218 444 ILE A CG1 2616 C CG2 . ILE A 354 ? 0.7263 0.6531 0.6524 -0.0033 -0.0212 -0.0179 444 ILE A CG2 2617 C CD1 . ILE A 354 ? 0.9988 0.9240 0.9168 -0.0163 -0.0157 -0.0253 444 ILE A CD1 2618 N N . THR A 355 ? 0.7464 0.6348 0.6567 -0.0053 -0.0198 -0.0134 445 THR A N 2619 C CA . THR A 355 ? 0.7117 0.5896 0.6163 -0.0059 -0.0185 -0.0117 445 THR A CA 2620 C C . THR A 355 ? 0.7253 0.5984 0.6254 -0.0086 -0.0163 -0.0129 445 THR A C 2621 O O . THR A 355 ? 0.6814 0.5568 0.5828 -0.0084 -0.0171 -0.0135 445 THR A O 2622 C CB . THR A 355 ? 0.7916 0.6662 0.6974 -0.0018 -0.0212 -0.0077 445 THR A CB 2623 O OG1 . THR A 355 ? 0.7530 0.6296 0.6612 -0.0006 -0.0231 -0.0074 445 THR A OG1 2624 C CG2 . THR A 355 ? 0.7326 0.6108 0.6423 0.0008 -0.0228 -0.0061 445 THR A CG2 2625 N N . PHE A 356 ? 0.6857 0.5511 0.5797 -0.0112 -0.0132 -0.0133 446 PHE A N 2626 C CA . PHE A 356 ? 0.6623 0.5212 0.5508 -0.0132 -0.0108 -0.0134 446 PHE A CA 2627 C C . PHE A 356 ? 0.7007 0.5495 0.5836 -0.0109 -0.0101 -0.0094 446 PHE A C 2628 O O . PHE A 356 ? 0.6634 0.5083 0.5452 -0.0090 -0.0095 -0.0074 446 PHE A O 2629 C CB . PHE A 356 ? 0.6963 0.5544 0.5816 -0.0188 -0.0065 -0.0173 446 PHE A CB 2630 C CG . PHE A 356 ? 0.7186 0.5885 0.6093 -0.0212 -0.0070 -0.0209 446 PHE A CG 2631 C CD1 . PHE A 356 ? 0.5488 0.4275 0.4441 -0.0218 -0.0080 -0.0228 446 PHE A CD1 2632 C CD2 . PHE A 356 ? 0.7695 0.6425 0.6608 -0.0225 -0.0063 -0.0223 446 PHE A CD2 2633 C CE1 . PHE A 356 ? 0.6777 0.5691 0.5784 -0.0233 -0.0085 -0.0256 446 PHE A CE1 2634 C CE2 . PHE A 356 ? 0.7859 0.6709 0.6827 -0.0239 -0.0064 -0.0253 446 PHE A CE2 2635 C CZ . PHE A 356 ? 0.7704 0.6651 0.6721 -0.0242 -0.0076 -0.0267 446 PHE A CZ 2636 N N . CYS A 357 ? 0.6972 0.5424 0.5765 -0.0106 -0.0100 -0.0080 447 CYS A N 2637 C CA . CYS A 357 ? 0.5951 0.4322 0.4687 -0.0080 -0.0093 -0.0036 447 CYS A CA 2638 C C . CYS A 357 ? 0.7596 0.5892 0.6257 -0.0107 -0.0051 -0.0040 447 CYS A C 2639 O O . CYS A 357 ? 0.8097 0.6419 0.6756 -0.0142 -0.0040 -0.0072 447 CYS A O 2640 C CB . CYS A 357 ? 0.6827 0.5235 0.5588 -0.0044 -0.0139 -0.0005 447 CYS A CB 2641 S SG . CYS A 357 ? 0.9211 0.7679 0.8046 -0.0008 -0.0179 0.0014 447 CYS A SG 2642 N N . GLY A 358 ? 0.7505 0.5707 0.6102 -0.0088 -0.0024 -0.0004 448 GLY A N 2643 C CA . GLY A 358 ? 0.7189 0.5298 0.5703 -0.0110 0.0026 0.0000 448 GLY A CA 2644 C C . GLY A 358 ? 0.8410 0.6527 0.6892 -0.0104 0.0013 0.0017 448 GLY A C 2645 O O . GLY A 358 ? 0.6986 0.5162 0.5495 -0.0074 -0.0035 0.0038 448 GLY A O 2646 N N . THR A 359 ? 0.9471 0.7527 0.7890 -0.0139 0.0058 0.0006 449 THR A N 2647 C CA . THR A 359 ? 0.8540 0.6585 0.6908 -0.0132 0.0055 0.0027 449 THR A CA 2648 C C . THR A 359 ? 0.8237 0.6162 0.6508 -0.0150 0.0121 0.0041 449 THR A C 2649 O O . THR A 359 ? 0.7365 0.5233 0.5622 -0.0191 0.0170 0.0012 449 THR A O 2650 C CB . THR A 359 ? 0.8630 0.6766 0.7039 -0.0160 0.0030 -0.0015 449 THR A CB 2651 O OG1 . THR A 359 ? 0.8446 0.6566 0.6795 -0.0155 0.0029 0.0005 449 THR A OG1 2652 C CG2 . THR A 359 ? 0.6660 0.4813 0.5091 -0.0217 0.0067 -0.0069 449 THR A CG2 2653 N N . GLY A 360 ? 0.7246 0.5131 0.5448 -0.0121 0.0123 0.0087 450 GLY A N 2654 C CA . GLY A 360 ? 0.8431 0.6191 0.6531 -0.0129 0.0189 0.0112 450 GLY A CA 2655 C C . GLY A 360 ? 0.8928 0.6695 0.7006 -0.0188 0.0216 0.0071 450 GLY A C 2656 O O . GLY A 360 ? 1.0121 0.7788 0.8129 -0.0220 0.0282 0.0069 450 GLY A O 2657 N N . GLY A 361 ? 0.8600 0.6481 0.6738 -0.0200 0.0170 0.0038 451 GLY A N 2658 C CA . GLY A 361 ? 0.9975 0.7888 0.8113 -0.0252 0.0193 -0.0007 451 GLY A CA 2659 C C . GLY A 361 ? 1.1974 0.9887 1.0149 -0.0311 0.0234 -0.0058 451 GLY A C 2660 O O . GLY A 361 ? 1.2269 1.0231 1.0515 -0.0313 0.0213 -0.0080 451 GLY A O 2661 N N . SER A 362 ? 1.2521 1.0390 1.0648 -0.0362 0.0291 -0.0078 452 SER A N 2662 C CA . SER A 362 ? 1.3213 1.1110 1.1379 -0.0430 0.0328 -0.0133 452 SER A CA 2663 C C . SER A 362 ? 1.2019 1.0073 1.0284 -0.0443 0.0290 -0.0179 452 SER A C 2664 O O . SER A 362 ? 1.0543 0.8644 0.8807 -0.0434 0.0278 -0.0181 452 SER A O 2665 C CB . SER A 362 ? 1.4351 1.2151 1.2434 -0.0485 0.0406 -0.0139 452 SER A CB 2666 O OG . SER A 362 ? 1.3946 1.1590 1.1941 -0.0471 0.0449 -0.0098 452 SER A OG 2667 N N . MET A 363 ? 1.0667 0.8799 0.9011 -0.0462 0.0275 -0.0214 453 MET A N 2668 C CA . MET A 363 ? 0.8523 0.6808 0.6968 -0.0457 0.0235 -0.0247 453 MET A CA 2669 C C . MET A 363 ? 0.8123 0.6496 0.6607 -0.0520 0.0270 -0.0297 453 MET A C 2670 O O . MET A 363 ? 0.8863 0.7195 0.7316 -0.0582 0.0321 -0.0318 453 MET A O 2671 C CB . MET A 363 ? 0.8631 0.6968 0.7145 -0.0428 0.0190 -0.0248 453 MET A CB 2672 C CG . MET A 363 ? 0.8858 0.7167 0.7370 -0.0360 0.0140 -0.0205 453 MET A CG 2673 S SD . MET A 363 ? 1.0344 0.8744 0.8905 -0.0320 0.0092 -0.0206 453 MET A SD 2674 C CE . MET A 363 ? 0.6159 0.4702 0.4833 -0.0325 0.0071 -0.0246 453 MET A CE 2675 N N . PRO A 364 ? 0.8406 0.6904 0.6959 -0.0507 0.0247 -0.0318 454 PRO A N 2676 C CA . PRO A 364 ? 0.8977 0.7595 0.7588 -0.0559 0.0275 -0.0363 454 PRO A CA 2677 C C . PRO A 364 ? 0.9591 0.8304 0.8275 -0.0579 0.0258 -0.0389 454 PRO A C 2678 O O . PRO A 364 ? 1.0470 0.9139 0.9152 -0.0553 0.0230 -0.0372 454 PRO A O 2679 C CB . PRO A 364 ? 0.7837 0.6551 0.6498 -0.0518 0.0252 -0.0367 454 PRO A CB 2680 C CG . PRO A 364 ? 0.7346 0.6017 0.6004 -0.0449 0.0199 -0.0334 454 PRO A CG 2681 C CD . PRO A 364 ? 0.7346 0.5874 0.5921 -0.0445 0.0201 -0.0299 454 PRO A CD 2682 N N . ASP A 365 ? 0.8883 0.7733 0.7629 -0.0625 0.0276 -0.0428 455 ASP A N 2683 C CA . ASP A 365 ? 0.7263 0.6236 0.6082 -0.0644 0.0257 -0.0455 455 ASP A CA 2684 C C . ASP A 365 ? 0.9234 0.8352 0.8148 -0.0582 0.0210 -0.0450 455 ASP A C 2685 O O . ASP A 365 ? 1.1228 1.0465 1.0194 -0.0582 0.0220 -0.0465 455 ASP A O 2686 C CB . ASP A 365 ? 0.9108 0.8163 0.7940 -0.0736 0.0303 -0.0501 455 ASP A CB 2687 C CG . ASP A 365 ? 1.1758 1.0660 1.0496 -0.0805 0.0354 -0.0510 455 ASP A CG 2688 O OD1 . ASP A 365 ? 1.0754 0.9508 0.9407 -0.0804 0.0387 -0.0487 455 ASP A OD1 2689 O OD2 . ASP A 365 ? 1.3682 1.2607 1.2425 -0.0859 0.0362 -0.0540 455 ASP A OD2 2690 N N . VAL A 366 ? 0.9892 0.8997 0.8827 -0.0526 0.0163 -0.0427 456 VAL A N 2691 C CA . VAL A 366 ? 0.8438 0.7665 0.7457 -0.0464 0.0123 -0.0418 456 VAL A CA 2692 C C . VAL A 366 ? 0.8696 0.7995 0.7761 -0.0457 0.0091 -0.0421 456 VAL A C 2693 O O . VAL A 366 ? 1.0024 0.9225 0.9049 -0.0455 0.0079 -0.0408 456 VAL A O 2694 C CB . VAL A 366 ? 0.7545 0.6685 0.6544 -0.0393 0.0096 -0.0384 456 VAL A CB 2695 C CG1 . VAL A 366 ? 0.9264 0.8233 0.8174 -0.0395 0.0096 -0.0359 456 VAL A CG1 2696 C CG2 . VAL A 366 ? 0.7375 0.6586 0.6443 -0.0328 0.0051 -0.0367 456 VAL A CG2 2697 N N . ASN A 367 ? 0.8816 0.8294 0.7965 -0.0453 0.0081 -0.0437 457 ASN A N 2698 C CA . ASN A 367 ? 0.9140 0.8709 0.8337 -0.0435 0.0047 -0.0434 457 ASN A CA 2699 C C . ASN A 367 ? 0.8982 0.8542 0.8213 -0.0343 0.0006 -0.0395 457 ASN A C 2700 O O . ASN A 367 ? 0.7227 0.6823 0.6492 -0.0294 0.0006 -0.0382 457 ASN A O 2701 C CB . ASN A 367 ? 0.7889 0.7669 0.7158 -0.0471 0.0052 -0.0465 457 ASN A CB 2702 C CG . ASN A 367 ? 0.9833 0.9741 0.9165 -0.0428 0.0011 -0.0452 457 ASN A CG 2703 O OD1 . ASN A 367 ? 1.0602 1.0507 0.9916 -0.0458 -0.0002 -0.0463 457 ASN A OD1 2704 N ND2 . ASN A 367 ? 1.0740 1.0755 1.0142 -0.0353 -0.0007 -0.0427 457 ASN A ND2 2705 N N . TRP A 368 ? 0.8412 0.7917 0.7631 -0.0321 -0.0022 -0.0377 458 TRP A N 2706 C CA . TRP A 368 ? 0.7934 0.7406 0.7174 -0.0243 -0.0056 -0.0339 458 TRP A CA 2707 C C . TRP A 368 ? 0.7993 0.7606 0.7306 -0.0200 -0.0084 -0.0328 458 TRP A C 2708 O O . TRP A 368 ? 0.8676 0.8270 0.8011 -0.0134 -0.0107 -0.0296 458 TRP A O 2709 C CB . TRP A 368 ? 0.7103 0.6414 0.6280 -0.0237 -0.0068 -0.0318 458 TRP A CB 2710 C CG . TRP A 368 ? 0.7461 0.6640 0.6570 -0.0257 -0.0046 -0.0316 458 TRP A CG 2711 C CD1 . TRP A 368 ? 0.8057 0.7152 0.7101 -0.0313 -0.0015 -0.0330 458 TRP A CD1 2712 C CD2 . TRP A 368 ? 0.6802 0.5919 0.5894 -0.0222 -0.0049 -0.0299 458 TRP A CD2 2713 N NE1 . TRP A 368 ? 0.7310 0.6301 0.6299 -0.0309 -0.0001 -0.0317 458 TRP A NE1 2714 C CE2 . TRP A 368 ? 0.8049 0.7056 0.7066 -0.0256 -0.0024 -0.0301 458 TRP A CE2 2715 C CE3 . TRP A 368 ? 0.5700 0.4837 0.4828 -0.0166 -0.0068 -0.0284 458 TRP A CE3 2716 C CZ2 . TRP A 368 ? 0.7766 0.6699 0.6743 -0.0238 -0.0022 -0.0288 458 TRP A CZ2 2717 C CZ3 . TRP A 368 ? 0.7053 0.6106 0.6138 -0.0154 -0.0063 -0.0276 458 TRP A CZ3 2718 C CH2 . TRP A 368 ? 0.6824 0.5784 0.5836 -0.0191 -0.0043 -0.0279 458 TRP A CH2 2719 N N . GLY A 369 ? 0.6953 0.6709 0.6299 -0.0240 -0.0080 -0.0353 459 GLY A N 2720 C CA . GLY A 369 ? 0.7366 0.7275 0.6776 -0.0202 -0.0107 -0.0341 459 GLY A CA 2721 C C . GLY A 369 ? 0.9162 0.9202 0.8582 -0.0267 -0.0107 -0.0375 459 GLY A C 2722 O O . GLY A 369 ? 0.9566 0.9573 0.8943 -0.0349 -0.0081 -0.0413 459 GLY A O 2723 O OXT . GLY A 369 ? 1.0137 1.0324 0.9606 -0.0243 -0.0131 -0.0367 459 GLY A OXT 2724 N N . ALA B 6 ? 1.6281 1.6464 1.5174 -0.0230 -0.0908 0.0359 82 ALA B N 2725 C CA . ALA B 6 ? 1.7010 1.7414 1.5908 -0.0214 -0.0959 0.0420 82 ALA B CA 2726 C C . ALA B 6 ? 1.6548 1.6991 1.5334 -0.0233 -0.0983 0.0414 82 ALA B C 2727 O O . ALA B 6 ? 1.6335 1.6891 1.5095 -0.0166 -0.1001 0.0490 82 ALA B O 2728 C CB . ALA B 6 ? 1.2174 1.2765 1.1159 -0.0285 -0.1003 0.0410 82 ALA B CB 2729 N N . THR B 7 ? 1.4879 1.5240 1.3594 -0.0319 -0.0982 0.0332 83 THR B N 2730 C CA . THR B 7 ? 1.3063 1.3460 1.1663 -0.0333 -0.1002 0.0328 83 THR B CA 2731 C C . THR B 7 ? 1.1247 1.1443 0.9755 -0.0363 -0.0962 0.0260 83 THR B C 2732 O O . THR B 7 ? 1.0739 1.0797 0.9270 -0.0405 -0.0930 0.0195 83 THR B O 2733 C CB . THR B 7 ? 1.1125 1.1741 0.9709 -0.0415 -0.1068 0.0314 83 THR B CB 2734 O OG1 . THR B 7 ? 1.1994 1.2745 1.0514 -0.0362 -0.1099 0.0383 83 THR B OG1 2735 C CG2 . THR B 7 ? 1.0507 1.1053 0.9021 -0.0537 -0.1070 0.0206 83 THR B CG2 2736 N N . PRO B 8 ? 1.1334 1.1513 0.9739 -0.0334 -0.0959 0.0280 84 PRO B N 2737 C CA . PRO B 8 ? 1.0966 1.0961 0.9289 -0.0364 -0.0917 0.0213 84 PRO B CA 2738 C C . PRO B 8 ? 1.0931 1.0915 0.9217 -0.0478 -0.0929 0.0117 84 PRO B C 2739 O O . PRO B 8 ? 1.0410 1.0548 0.8671 -0.0540 -0.0979 0.0105 84 PRO B O 2740 C CB . PRO B 8 ? 0.8499 0.8515 0.6714 -0.0320 -0.0919 0.0258 84 PRO B CB 2741 C CG . PRO B 8 ? 0.9379 0.9518 0.7635 -0.0231 -0.0937 0.0361 84 PRO B CG 2742 C CD . PRO B 8 ? 1.0681 1.0982 0.9040 -0.0262 -0.0982 0.0367 84 PRO B CD 2743 N N . LEU B 9 ? 1.0075 0.9880 0.8359 -0.0505 -0.0882 0.0050 85 LEU B N 2744 C CA . LEU B 9 ? 0.8420 0.8172 0.6647 -0.0605 -0.0878 -0.0043 85 LEU B CA 2745 C C . LEU B 9 ? 0.9463 0.9239 0.7557 -0.0629 -0.0890 -0.0059 85 LEU B C 2746 O O . LEU B 9 ? 1.0944 1.0650 0.8982 -0.0571 -0.0863 -0.0031 85 LEU B O 2747 C CB . LEU B 9 ? 0.7021 0.6570 0.5270 -0.0605 -0.0817 -0.0097 85 LEU B CB 2748 C CG . LEU B 9 ? 0.9650 0.9086 0.7850 -0.0690 -0.0789 -0.0194 85 LEU B CG 2749 C CD1 . LEU B 9 ? 1.0106 0.9389 0.8378 -0.0663 -0.0737 -0.0215 85 LEU B CD1 2750 C CD2 . LEU B 9 ? 0.9903 0.9270 0.7978 -0.0706 -0.0769 -0.0233 85 LEU B CD2 2751 N N . VAL B 10 ? 1.0264 1.0146 0.8305 -0.0719 -0.0930 -0.0103 86 VAL B N 2752 C CA . VAL B 10 ? 1.1979 1.1880 0.9885 -0.0757 -0.0940 -0.0132 86 VAL B CA 2753 C C . VAL B 10 ? 1.0821 1.0669 0.8666 -0.0877 -0.0933 -0.0241 86 VAL B C 2754 O O . VAL B 10 ? 0.9401 0.9333 0.7286 -0.0952 -0.0962 -0.0272 86 VAL B O 2755 C CB . VAL B 10 ? 0.9984 1.0104 0.7851 -0.0731 -0.1001 -0.0057 86 VAL B CB 2756 C CG1 . VAL B 10 ? 1.0617 1.0938 0.8578 -0.0752 -0.1058 -0.0023 86 VAL B CG1 2757 C CG2 . VAL B 10 ? 0.8574 0.8738 0.6297 -0.0793 -0.1020 -0.0100 86 VAL B CG2 2758 N N . LEU B 11 ? 1.0655 1.0352 0.8403 -0.0893 -0.0887 -0.0297 87 LEU B N 2759 C CA . LEU B 11 ? 1.0271 0.9864 0.7949 -0.0993 -0.0860 -0.0403 87 LEU B CA 2760 C C . LEU B 11 ? 1.0684 1.0406 0.8244 -0.1082 -0.0905 -0.0443 87 LEU B C 2761 O O . LEU B 11 ? 1.0573 1.0447 0.8089 -0.1053 -0.0951 -0.0384 87 LEU B O 2762 C CB . LEU B 11 ? 0.8753 0.8138 0.6376 -0.0962 -0.0788 -0.0442 87 LEU B CB 2763 C CG . LEU B 11 ? 0.8415 0.7654 0.6133 -0.0883 -0.0734 -0.0421 87 LEU B CG 2764 C CD1 . LEU B 11 ? 0.8667 0.7788 0.6322 -0.0830 -0.0683 -0.0422 87 LEU B CD1 2765 C CD2 . LEU B 11 ? 0.7417 0.6533 0.5181 -0.0931 -0.0696 -0.0488 87 LEU B CD2 2766 N N . GLY B 12 ? 1.0252 0.9906 0.7755 -0.1191 -0.0888 -0.0542 88 GLY B N 2767 C CA . GLY B 12 ? 0.8749 0.8502 0.6125 -0.1292 -0.0923 -0.0598 88 GLY B CA 2768 C C . GLY B 12 ? 0.9440 0.9131 0.6672 -0.1282 -0.0901 -0.0619 88 GLY B C 2769 O O . GLY B 12 ? 1.0825 1.0314 0.8016 -0.1262 -0.0831 -0.0662 88 GLY B O 2770 N N . GLU B 13 ? 0.9635 0.9511 0.6787 -0.1297 -0.0959 -0.0588 89 GLU B N 2771 C CA . GLU B 13 ? 1.0174 1.0020 0.7180 -0.1290 -0.0945 -0.0600 89 GLU B CA 2772 C C . GLU B 13 ? 0.9295 0.8997 0.6172 -0.1393 -0.0899 -0.0724 89 GLU B C 2773 O O . GLU B 13 ? 0.8241 0.7837 0.5011 -0.1375 -0.0856 -0.0746 89 GLU B O 2774 C CB . GLU B 13 ? 0.8397 0.8494 0.5345 -0.1285 -0.1022 -0.0535 89 GLU B CB 2775 C CG . GLU B 13 ? 0.9429 0.9611 0.6456 -0.1152 -0.1043 -0.0404 89 GLU B CG 2776 C CD . GLU B 13 ? 1.1423 1.1438 0.8411 -0.1059 -0.0981 -0.0372 89 GLU B CD 2777 O OE1 . GLU B 13 ? 1.0993 1.0916 0.7850 -0.1091 -0.0947 -0.0426 89 GLU B OE1 2778 O OE2 . GLU B 13 ? 1.3080 1.3054 1.0166 -0.0957 -0.0962 -0.0295 89 GLU B OE2 2779 N N . ASN B 14 ? 0.9190 0.8881 0.6077 -0.1501 -0.0902 -0.0803 90 ASN B N 2780 C CA . ASN B 14 ? 0.8971 0.8521 0.5729 -0.1609 -0.0855 -0.0926 90 ASN B CA 2781 C C . ASN B 14 ? 0.9867 0.9208 0.6678 -0.1647 -0.0788 -0.0998 90 ASN B C 2782 O O . ASN B 14 ? 1.1155 1.0538 0.8072 -0.1677 -0.0807 -0.0994 90 ASN B O 2783 C CB . ASN B 14 ? 0.9821 0.9557 0.6471 -0.1734 -0.0919 -0.0975 90 ASN B CB 2784 C CG . ASN B 14 ? 1.2611 1.2518 0.9165 -0.1698 -0.0971 -0.0917 90 ASN B CG 2785 O OD1 . ASN B 14 ? 1.2818 1.2620 0.9268 -0.1661 -0.0929 -0.0927 90 ASN B OD1 2786 N ND2 . ASN B 14 ? 1.2422 1.2598 0.9014 -0.1702 -0.1058 -0.0851 90 ASN B ND2 2787 N N . LEU B 15 ? 0.9298 0.8414 0.6034 -0.1641 -0.0705 -0.1061 91 LEU B N 2788 C CA . LEU B 15 ? 1.0379 0.9277 0.7159 -0.1658 -0.0630 -0.1122 91 LEU B CA 2789 C C . LEU B 15 ? 1.0668 0.9550 0.7395 -0.1802 -0.0629 -0.1218 91 LEU B C 2790 O O . LEU B 15 ? 1.0995 0.9980 0.7603 -0.1904 -0.0666 -0.1270 91 LEU B O 2791 C CB . LEU B 15 ? 0.9860 0.8530 0.6562 -0.1616 -0.0538 -0.1168 91 LEU B CB 2792 C CG . LEU B 15 ? 0.9815 0.8417 0.6601 -0.1475 -0.0503 -0.1092 91 LEU B CG 2793 C CD1 . LEU B 15 ? 1.0688 0.9074 0.7394 -0.1455 -0.0409 -0.1153 91 LEU B CD1 2794 C CD2 . LEU B 15 ? 0.8939 0.7529 0.5899 -0.1411 -0.0504 -0.1034 91 LEU B CD2 2795 N N . CYS B 16 ? 1.1339 1.0086 0.8148 -0.1813 -0.0585 -0.1242 92 CYS B N 2796 C CA . CYS B 16 ? 1.0686 0.9357 0.7433 -0.1952 -0.0560 -0.1344 92 CYS B CA 2797 C C . CYS B 16 ? 1.1170 0.9643 0.7748 -0.2001 -0.0484 -0.1445 92 CYS B C 2798 O O . CYS B 16 ? 1.2007 1.0363 0.8555 -0.1911 -0.0433 -0.1432 92 CYS B O 2799 C CB . CYS B 16 ? 1.0215 0.8758 0.7086 -0.1936 -0.0516 -0.1340 92 CYS B CB 2800 S SG . CYS B 16 ? 1.2510 1.1287 0.9571 -0.1900 -0.0603 -0.1234 92 CYS B SG 2801 N N . SER B 17 ? 1.2629 1.1073 0.9091 -0.2148 -0.0474 -0.1548 93 SER B N 2802 C CA . SER B 17 ? 1.2335 1.0552 0.8639 -0.2197 -0.0386 -0.1653 93 SER B CA 2803 C C . SER B 17 ? 1.2263 1.0209 0.8622 -0.2150 -0.0284 -0.1674 93 SER B C 2804 O O . SER B 17 ? 1.3358 1.1274 0.9803 -0.2188 -0.0278 -0.1676 93 SER B O 2805 C CB . SER B 17 ? 1.2036 1.0288 0.8194 -0.2376 -0.0400 -0.1764 93 SER B CB 2806 O OG . SER B 17 ? 1.4006 1.2018 1.0003 -0.2423 -0.0305 -0.1869 93 SER B OG 2807 N N . ILE B 18 ? 0.9772 0.7531 0.6090 -0.2063 -0.0202 -0.1682 94 ILE B N 2808 C CA . ILE B 18 ? 0.9926 0.7434 0.6295 -0.2004 -0.0102 -0.1694 94 ILE B CA 2809 C C . ILE B 18 ? 1.0262 0.7512 0.6468 -0.2054 0.0007 -0.1804 94 ILE B C 2810 O O . ILE B 18 ? 1.0793 0.8011 0.6891 -0.2032 0.0032 -0.1829 94 ILE B O 2811 C CB . ILE B 18 ? 1.1176 0.8682 0.7684 -0.1831 -0.0092 -0.1588 94 ILE B CB 2812 C CG1 . ILE B 18 ? 1.2116 0.9823 0.8793 -0.1788 -0.0180 -0.1488 94 ILE B CG1 2813 C CG2 . ILE B 18 ? 1.0191 0.7439 0.6727 -0.1765 0.0018 -0.1605 94 ILE B CG2 2814 C CD1 . ILE B 18 ? 1.2053 0.9889 0.8815 -0.1660 -0.0222 -0.1386 94 ILE B CD1 2815 N N . ASN B 19 ? 1.0187 0.7247 0.6369 -0.2121 0.0077 -0.1871 95 ASN B N 2816 C CA . ASN B 19 ? 1.0208 0.6992 0.6238 -0.2155 0.0195 -0.1972 95 ASN B CA 2817 C C . ASN B 19 ? 1.1392 0.7934 0.7488 -0.2088 0.0296 -0.1966 95 ASN B C 2818 O O . ASN B 19 ? 1.2251 0.8538 0.8234 -0.2109 0.0406 -0.2045 95 ASN B O 2819 C CB . ASN B 19 ? 0.9839 0.6594 0.5700 -0.2339 0.0198 -0.2093 95 ASN B CB 2820 C CG . ASN B 19 ? 1.1181 0.8189 0.6970 -0.2405 0.0097 -0.2097 95 ASN B CG 2821 O OD1 . ASN B 19 ? 1.2770 0.9767 0.8445 -0.2385 0.0112 -0.2121 95 ASN B OD1 2822 N ND2 . ASN B 19 ? 1.1733 0.8982 0.7593 -0.2476 -0.0009 -0.2066 95 ASN B ND2 2823 N N . GLY B 20 ? 1.0357 0.6977 0.6631 -0.2002 0.0260 -0.1870 96 GLY B N 2824 C CA . GLY B 20 ? 1.0080 0.6496 0.6428 -0.1926 0.0348 -0.1850 96 GLY B CA 2825 C C . GLY B 20 ? 1.0273 0.6824 0.6820 -0.1811 0.0293 -0.1730 96 GLY B C 2826 O O . GLY B 20 ? 1.0150 0.6948 0.6781 -0.1808 0.0186 -0.1668 96 GLY B O 2827 N N . TRP B 21 ? 1.0397 0.6783 0.7017 -0.1713 0.0370 -0.1695 97 TRP B N 2828 C CA . TRP B 21 ? 0.9275 0.5769 0.6077 -0.1598 0.0330 -0.1585 97 TRP B CA 2829 C C . TRP B 21 ? 0.9307 0.5662 0.6170 -0.1602 0.0380 -0.1578 97 TRP B C 2830 O O . TRP B 21 ? 1.0078 0.6188 0.6855 -0.1623 0.0485 -0.1638 97 TRP B O 2831 C CB . TRP B 21 ? 0.9980 0.6444 0.6825 -0.1446 0.0368 -0.1532 97 TRP B CB 2832 C CG . TRP B 21 ? 1.0315 0.6886 0.7083 -0.1448 0.0333 -0.1547 97 TRP B CG 2833 C CD1 . TRP B 21 ? 1.0908 0.7353 0.7526 -0.1471 0.0399 -0.1621 97 TRP B CD1 2834 C CD2 . TRP B 21 ? 0.9775 0.6594 0.6602 -0.1427 0.0229 -0.1484 97 TRP B CD2 2835 N NE1 . TRP B 21 ? 1.0059 0.6664 0.6642 -0.1465 0.0340 -0.1607 97 TRP B NE1 2836 C CE2 . TRP B 21 ? 1.0069 0.6900 0.6776 -0.1437 0.0236 -0.1522 97 TRP B CE2 2837 C CE3 . TRP B 21 ? 0.9833 0.6855 0.6797 -0.1395 0.0136 -0.1398 97 TRP B CE3 2838 C CZ2 . TRP B 21 ? 1.0711 0.7748 0.7432 -0.1418 0.0155 -0.1474 97 TRP B CZ2 2839 C CZ3 . TRP B 21 ? 1.0356 0.7576 0.7333 -0.1373 0.0057 -0.1352 97 TRP B CZ3 2840 C CH2 . TRP B 21 ? 1.0261 0.7486 0.7118 -0.1385 0.0067 -0.1388 97 TRP B CH2 2841 N N . VAL B 22 ? 1.0960 0.7468 0.7965 -0.1583 0.0310 -0.1503 98 VAL B N 2842 C CA . VAL B 22 ? 1.0925 0.7326 0.8006 -0.1573 0.0351 -0.1478 98 VAL B CA 2843 C C . VAL B 22 ? 1.1068 0.7588 0.8320 -0.1438 0.0310 -0.1364 98 VAL B C 2844 O O . VAL B 22 ? 1.1111 0.7860 0.8442 -0.1414 0.0214 -0.1308 98 VAL B O 2845 C CB . VAL B 22 ? 1.0199 0.6667 0.7274 -0.1721 0.0306 -0.1515 98 VAL B CB 2846 C CG1 . VAL B 22 ? 1.0655 0.7021 0.7818 -0.1702 0.0348 -0.1479 98 VAL B CG1 2847 C CG2 . VAL B 22 ? 0.9682 0.6030 0.6581 -0.1870 0.0348 -0.1636 98 VAL B CG2 2848 N N . PRO B 23 ? 1.0770 0.7133 0.8073 -0.1347 0.0387 -0.1330 99 PRO B N 2849 C CA . PRO B 23 ? 0.9328 0.5793 0.6789 -0.1221 0.0356 -0.1226 99 PRO B CA 2850 C C . PRO B 23 ? 0.8545 0.5171 0.6113 -0.1263 0.0275 -0.1178 99 PRO B C 2851 O O . PRO B 23 ? 0.9374 0.5948 0.6916 -0.1367 0.0285 -0.1216 99 PRO B O 2852 C CB . PRO B 23 ? 0.8364 0.4600 0.5828 -0.1137 0.0467 -0.1214 99 PRO B CB 2853 C CG . PRO B 23 ? 0.9626 0.5644 0.6952 -0.1243 0.0547 -0.1307 99 PRO B CG 2854 C CD . PRO B 23 ? 1.0213 0.6291 0.7422 -0.1348 0.0512 -0.1385 99 PRO B CD 2855 N N . THR B 24 ? 0.9204 0.6024 0.6890 -0.1184 0.0200 -0.1096 100 THR B N 2856 C CA . THR B 24 ? 0.9478 0.6463 0.7272 -0.1208 0.0125 -0.1043 100 THR B CA 2857 C C . THR B 24 ? 0.9470 0.6465 0.7394 -0.1086 0.0133 -0.0956 100 THR B C 2858 O O . THR B 24 ? 0.9556 0.6618 0.7565 -0.1097 0.0104 -0.0915 100 THR B O 2859 C CB . THR B 24 ? 0.9448 0.6675 0.7263 -0.1235 0.0021 -0.1023 100 THR B CB 2860 O OG1 . THR B 24 ? 0.9707 0.6972 0.7510 -0.1151 0.0014 -0.1003 100 THR B OG1 2861 C CG2 . THR B 24 ? 0.8592 0.5853 0.6302 -0.1381 -0.0005 -0.1101 100 THR B CG2 2862 N N . TYR B 25 ? 0.8493 0.5431 0.6429 -0.0972 0.0174 -0.0929 101 TYR B N 2863 C CA . TYR B 25 ? 0.9088 0.5997 0.7123 -0.0860 0.0202 -0.0859 101 TYR B CA 2864 C C . TYR B 25 ? 0.9778 0.6507 0.7762 -0.0783 0.0297 -0.0875 101 TYR B C 2865 O O . TYR B 25 ? 1.0891 0.7602 0.8808 -0.0770 0.0314 -0.0909 101 TYR B O 2866 C CB . TYR B 25 ? 0.8549 0.5656 0.6695 -0.0776 0.0129 -0.0782 101 TYR B CB 2867 C CG . TYR B 25 ? 0.9470 0.6557 0.7712 -0.0661 0.0157 -0.0713 101 TYR B CG 2868 C CD1 . TYR B 25 ? 0.9133 0.6209 0.7441 -0.0661 0.0158 -0.0676 101 TYR B CD1 2869 C CD2 . TYR B 25 ? 0.9492 0.6577 0.7755 -0.0555 0.0184 -0.0686 101 TYR B CD2 2870 C CE1 . TYR B 25 ? 0.9617 0.6683 0.8006 -0.0556 0.0182 -0.0612 101 TYR B CE1 2871 C CE2 . TYR B 25 ? 1.0069 0.7154 0.8418 -0.0452 0.0206 -0.0624 101 TYR B CE2 2872 C CZ . TYR B 25 ? 1.0123 0.7198 0.8532 -0.0452 0.0205 -0.0586 101 TYR B CZ 2873 O OH . TYR B 25 ? 0.9816 0.6899 0.8304 -0.0349 0.0225 -0.0522 101 TYR B OH 2874 N N . ARG B 26 ? 0.9015 0.5614 0.7030 -0.0729 0.0362 -0.0847 102 ARG B N 2875 C CA . ARG B 26 ? 0.8912 0.5348 0.6893 -0.0637 0.0457 -0.0847 102 ARG B CA 2876 C C . ARG B 26 ? 1.0191 0.6646 0.8282 -0.0521 0.0471 -0.0762 102 ARG B C 2877 O O . ARG B 26 ? 1.1546 0.7935 0.9663 -0.0535 0.0491 -0.0741 102 ARG B O 2878 C CB . ARG B 26 ? 0.8419 0.4610 0.6276 -0.0704 0.0551 -0.0920 102 ARG B CB 2879 C CG . ARG B 26 ? 0.9230 0.5246 0.7032 -0.0611 0.0656 -0.0929 102 ARG B CG 2880 C CD . ARG B 26 ? 1.0022 0.5790 0.7679 -0.0692 0.0749 -0.1014 102 ARG B CD 2881 N NE . ARG B 26 ? 1.1816 0.7435 0.9470 -0.0724 0.0801 -0.1008 102 ARG B NE 2882 C CZ . ARG B 26 ? 1.1487 0.6862 0.9021 -0.0793 0.0895 -0.1074 102 ARG B CZ 2883 N NH1 . ARG B 26 ? 1.1439 0.6692 0.8844 -0.0837 0.0947 -0.1155 102 ARG B NH1 2884 N NH2 . ARG B 26 ? 1.1759 0.7003 0.9296 -0.0819 0.0942 -0.1061 102 ARG B NH2 2885 N N . GLY B 27 ? 0.9965 0.6517 0.8118 -0.0412 0.0459 -0.0715 103 GLY B N 2886 C CA . GLY B 27 ? 0.8903 0.5513 0.7164 -0.0303 0.0459 -0.0633 103 GLY B CA 2887 C C . GLY B 27 ? 0.9591 0.6011 0.7833 -0.0237 0.0559 -0.0615 103 GLY B C 2888 O O . GLY B 27 ? 1.1371 0.7603 0.9514 -0.0253 0.0642 -0.0665 103 GLY B O 2889 N N . GLU B 28 ? 1.0020 0.6488 0.8352 -0.0161 0.0554 -0.0541 104 GLU B N 2890 C CA . GLU B 28 ? 1.1245 0.7543 0.9565 -0.0093 0.0645 -0.0510 104 GLU B CA 2891 C C . GLU B 28 ? 1.2616 0.8836 1.0909 0.0016 0.0723 -0.0503 104 GLU B C 2892 O O . GLU B 28 ? 1.3042 0.9063 1.1278 0.0059 0.0822 -0.0503 104 GLU B O 2893 C CB . GLU B 28 ? 1.0807 0.7203 0.9233 -0.0034 0.0612 -0.0427 104 GLU B CB 2894 C CG . GLU B 28 ? 1.3488 0.9718 1.1890 -0.0055 0.0670 -0.0411 104 GLU B CG 2895 C CD . GLU B 28 ? 1.5201 1.1297 1.3512 -0.0201 0.0687 -0.0489 104 GLU B CD 2896 O OE1 . GLU B 28 ? 1.4087 1.0313 1.2417 -0.0301 0.0604 -0.0516 104 GLU B OE1 2897 O OE2 . GLU B 28 ? 1.5565 1.1429 1.3784 -0.0216 0.0785 -0.0522 104 GLU B OE2 2898 N N . GLY B 29 ? 1.2855 0.9228 1.1186 0.0061 0.0683 -0.0498 105 GLY B N 2899 C CA . GLY B 29 ? 1.2573 0.8916 1.0895 0.0169 0.0749 -0.0487 105 GLY B CA 2900 C C . GLY B 29 ? 1.1647 0.7833 0.9849 0.0128 0.0815 -0.0565 105 GLY B C 2901 O O . GLY B 29 ? 1.1269 0.7403 0.9450 0.0215 0.0884 -0.0562 105 GLY B O 2902 N N . THR B 30 ? 1.1688 0.7805 0.9808 -0.0004 0.0795 -0.0635 106 THR B N 2903 C CA . THR B 30 ? 1.2742 0.8683 1.0730 -0.0059 0.0865 -0.0717 106 THR B CA 2904 C C . THR B 30 ? 1.2645 0.8324 1.0560 -0.0033 0.0981 -0.0724 106 THR B C 2905 O O . THR B 30 ? 1.4302 0.9827 1.2142 0.0016 0.1077 -0.0751 106 THR B O 2906 C CB . THR B 30 ? 1.4795 1.0746 1.2713 -0.0217 0.0807 -0.0791 106 THR B CB 2907 O OG1 . THR B 30 ? 1.4750 1.0942 1.2740 -0.0241 0.0695 -0.0772 106 THR B OG1 2908 C CG2 . THR B 30 ? 1.5587 1.1384 1.3364 -0.0276 0.0870 -0.0880 106 THR B CG2 2909 N N . THR B 31 ? 1.4074 0.9704 1.2014 -0.0066 0.0976 -0.0698 107 THR B N 2910 C CA . THR B 31 ? 1.4587 0.9954 1.2450 -0.0072 0.1082 -0.0709 107 THR B CA 2911 C C . THR B 31 ? 1.4727 1.0060 1.2660 0.0073 0.1136 -0.0615 107 THR B C 2912 O O . THR B 31 ? 1.4526 0.9667 1.2417 0.0073 0.1210 -0.0603 107 THR B O 2913 C CB . THR B 31 ? 1.7124 1.2448 1.4960 -0.0218 0.1048 -0.0746 107 THR B CB 2914 O OG1 . THR B 31 ? 1.7075 1.2629 1.5034 -0.0223 0.0938 -0.0688 107 THR B OG1 2915 C CG2 . THR B 31 ? 1.7069 1.2367 1.4802 -0.0367 0.1025 -0.0849 107 THR B CG2 2916 N N . GLY B 32 ? 1.4808 1.0328 1.2843 0.0193 0.1100 -0.0548 108 GLY B N 2917 C CA . GLY B 32 ? 1.4503 1.0033 1.2611 0.0334 0.1138 -0.0452 108 GLY B CA 2918 C C . GLY B 32 ? 1.4492 1.0303 1.2732 0.0424 0.1056 -0.0385 108 GLY B C 2919 O O . GLY B 32 ? 1.4599 1.0544 1.2858 0.0431 0.1017 -0.0407 108 GLY B O 2920 N N . LYS B 33 ? 1.3772 0.9669 1.2099 0.0490 0.1031 -0.0304 109 LYS B N 2921 C CA . LYS B 33 ? 1.2798 0.8960 1.1247 0.0570 0.0955 -0.0241 109 LYS B CA 2922 C C . LYS B 33 ? 1.3318 0.9650 1.1835 0.0486 0.0841 -0.0234 109 LYS B C 2923 O O . LYS B 33 ? 1.3126 0.9375 1.1613 0.0392 0.0828 -0.0255 109 LYS B O 2924 C CB . LYS B 33 ? 1.3366 0.9535 1.1868 0.0721 0.1008 -0.0148 109 LYS B CB 2925 C CG . LYS B 33 ? 1.4904 1.0923 1.3350 0.0826 0.1125 -0.0142 109 LYS B CG 2926 C CD . LYS B 33 ? 1.5498 1.1724 1.4032 0.0955 0.1113 -0.0088 109 LYS B CD 2927 C CE . LYS B 33 ? 1.6439 1.2543 1.4952 0.1104 0.1230 -0.0031 109 LYS B CE 2928 N NZ . LYS B 33 ? 1.7269 1.3254 1.5775 0.1146 0.1270 0.0033 109 LYS B NZ 2929 N N . ILE B 34 ? 1.2524 0.9095 1.1132 0.0517 0.0761 -0.0206 110 ILE B N 2930 C CA . ILE B 34 ? 1.2281 0.9011 1.0950 0.0445 0.0657 -0.0199 110 ILE B CA 2931 C C . ILE B 34 ? 1.2932 0.9755 1.1684 0.0512 0.0634 -0.0119 110 ILE B C 2932 O O . ILE B 34 ? 1.2842 0.9755 1.1648 0.0625 0.0648 -0.0062 110 ILE B O 2933 C CB . ILE B 34 ? 1.1246 0.8177 0.9960 0.0425 0.0579 -0.0218 110 ILE B CB 2934 C CG1 . ILE B 34 ? 1.0557 0.7419 0.9196 0.0401 0.0616 -0.0283 110 ILE B CG1 2935 C CG2 . ILE B 34 ? 1.0094 0.7131 0.8834 0.0324 0.0485 -0.0233 110 ILE B CG2 2936 C CD1 . ILE B 34 ? 0.8576 0.5621 0.7250 0.0378 0.0547 -0.0302 110 ILE B CD1 2937 N N . PRO B 35 ? 1.2511 0.9322 1.1271 0.0440 0.0596 -0.0113 111 PRO B N 2938 C CA . PRO B 35 ? 1.0662 0.7586 0.9501 0.0482 0.0557 -0.0043 111 PRO B CA 2939 C C . PRO B 35 ? 1.1683 0.8848 1.0608 0.0530 0.0485 -0.0014 111 PRO B C 2940 O O . PRO B 35 ? 1.2979 1.0244 1.1912 0.0469 0.0426 -0.0056 111 PRO B O 2941 C CB . PRO B 35 ? 1.0692 0.7605 0.9524 0.0362 0.0507 -0.0070 111 PRO B CB 2942 C CG . PRO B 35 ? 1.0861 0.7575 0.9594 0.0277 0.0561 -0.0139 111 PRO B CG 2943 C CD . PRO B 35 ? 1.1623 0.8315 1.0315 0.0308 0.0592 -0.0178 111 PRO B CD 2944 N N . ASP B 36 ? 1.2183 0.9437 1.1165 0.0635 0.0492 0.0056 112 ASP B N 2945 C CA . ASP B 36 ? 1.3187 1.0669 1.2246 0.0682 0.0432 0.0080 112 ASP B CA 2946 C C . ASP B 36 ? 1.3215 1.0839 1.2327 0.0626 0.0345 0.0090 112 ASP B C 2947 O O . ASP B 36 ? 1.2189 0.9995 1.1358 0.0642 0.0291 0.0100 112 ASP B O 2948 C CB . ASP B 36 ? 1.3390 1.0934 1.2490 0.0816 0.0472 0.0150 112 ASP B CB 2949 C CG . ASP B 36 ? 1.4254 1.1594 1.3296 0.0879 0.0573 0.0172 112 ASP B CG 2950 O OD1 . ASP B 36 ? 1.3940 1.1147 1.2952 0.0856 0.0599 0.0190 112 ASP B OD1 2951 O OD2 . ASP B 36 ? 1.4379 1.1690 1.3406 0.0952 0.0631 0.0174 112 ASP B OD2 2952 N N . GLU B 37 ? 1.4479 1.2019 1.3572 0.0558 0.0336 0.0085 113 GLU B N 2953 C CA . GLU B 37 ? 1.5864 1.3516 1.4997 0.0495 0.0258 0.0086 113 GLU B CA 2954 C C . GLU B 37 ? 1.5765 1.3494 1.4893 0.0424 0.0205 0.0030 113 GLU B C 2955 O O . GLU B 37 ? 1.6081 1.3960 1.5254 0.0411 0.0142 0.0036 113 GLU B O 2956 C CB . GLU B 37 ? 1.5990 1.3523 1.5095 0.0426 0.0268 0.0082 113 GLU B CB 2957 C CG . GLU B 37 ? 1.6933 1.4300 1.6004 0.0473 0.0350 0.0116 113 GLU B CG 2958 C CD . GLU B 37 ? 1.8110 1.5281 1.7106 0.0388 0.0395 0.0066 113 GLU B CD 2959 O OE1 . GLU B 37 ? 1.9817 1.7002 1.8793 0.0290 0.0356 0.0007 113 GLU B OE1 2960 O OE2 . GLU B 37 ? 1.6829 1.3833 1.5783 0.0416 0.0472 0.0086 113 GLU B OE2 2961 N N . GLN B 38 ? 1.4469 1.2084 1.3533 0.0379 0.0236 -0.0023 114 GLN B N 2962 C CA . GLN B 38 ? 1.1722 0.9385 1.0764 0.0313 0.0197 -0.0077 114 GLN B CA 2963 C C . GLN B 38 ? 1.0487 0.8289 0.9565 0.0363 0.0178 -0.0073 114 GLN B C 2964 O O . GLN B 38 ? 1.0123 0.7944 0.9221 0.0448 0.0217 -0.0046 114 GLN B O 2965 C CB . GLN B 38 ? 1.1117 0.8617 1.0073 0.0263 0.0246 -0.0134 114 GLN B CB 2966 C CG . GLN B 38 ? 1.1871 0.9262 1.0785 0.0172 0.0247 -0.0160 114 GLN B CG 2967 C CD . GLN B 38 ? 1.2826 1.0068 1.1648 0.0111 0.0291 -0.0226 114 GLN B CD 2968 O OE1 . GLN B 38 ? 1.2111 0.9356 1.0900 0.0121 0.0303 -0.0259 114 GLN B OE1 2969 N NE2 . GLN B 38 ? 1.2178 0.9289 1.0953 0.0041 0.0317 -0.0249 114 GLN B NE2 2970 N N . MET B 39 ? 0.9476 0.7377 0.8563 0.0308 0.0118 -0.0097 115 MET B N 2971 C CA . MET B 39 ? 1.0831 0.8856 0.9943 0.0331 0.0098 -0.0103 115 MET B CA 2972 C C . MET B 39 ? 1.1287 0.9253 1.0352 0.0346 0.0147 -0.0140 115 MET B C 2973 O O . MET B 39 ? 1.1685 0.9512 1.0682 0.0308 0.0182 -0.0177 115 MET B O 2974 C CB . MET B 39 ? 1.0721 0.8828 0.9834 0.0260 0.0033 -0.0124 115 MET B CB 2975 C CG . MET B 39 ? 1.0327 0.8555 0.9500 0.0270 -0.0015 -0.0086 115 MET B CG 2976 S SD . MET B 39 ? 1.3539 1.1884 1.2716 0.0230 -0.0066 -0.0107 115 MET B SD 2977 C CE . MET B 39 ? 0.8591 0.7076 0.7835 0.0301 -0.0065 -0.0074 115 MET B CE 2978 N N . LEU B 40 ? 1.0304 0.8381 0.9405 0.0395 0.0149 -0.0131 116 LEU B N 2979 C CA . LEU B 40 ? 1.0128 0.8175 0.9194 0.0414 0.0194 -0.0163 116 LEU B CA 2980 C C . LEU B 40 ? 1.0809 0.8881 0.9835 0.0339 0.0162 -0.0211 116 LEU B C 2981 O O . LEU B 40 ? 1.1798 0.9992 1.0854 0.0343 0.0140 -0.0211 116 LEU B O 2982 C CB . LEU B 40 ? 1.0446 0.8617 0.9575 0.0502 0.0214 -0.0129 116 LEU B CB 2983 C CG . LEU B 40 ? 1.0253 0.8353 0.9381 0.0594 0.0288 -0.0103 116 LEU B CG 2984 C CD1 . LEU B 40 ? 0.9679 0.7653 0.8789 0.0601 0.0306 -0.0077 116 LEU B CD1 2985 C CD2 . LEU B 40 ? 1.0233 0.8508 0.9442 0.0679 0.0288 -0.0058 116 LEU B CD2 2986 N N . THR B 41 ? 1.0086 0.8039 0.9039 0.0270 0.0164 -0.0251 117 THR B N 2987 C CA . THR B 41 ? 0.9240 0.7206 0.8143 0.0198 0.0133 -0.0293 117 THR B CA 2988 C C . THR B 41 ? 0.8992 0.6962 0.7861 0.0215 0.0172 -0.0323 117 THR B C 2989 O O . THR B 41 ? 0.9253 0.7151 0.8105 0.0265 0.0236 -0.0330 117 THR B O 2990 C CB . THR B 41 ? 0.9468 0.7309 0.8296 0.0122 0.0131 -0.0329 117 THR B CB 2991 O OG1 . THR B 41 ? 1.0277 0.7976 0.9040 0.0133 0.0201 -0.0363 117 THR B OG1 2992 C CG2 . THR B 41 ? 0.8486 0.6311 0.7347 0.0107 0.0106 -0.0300 117 THR B CG2 2993 N N . ARG B 42 ? 0.9209 0.7259 0.8068 0.0175 0.0137 -0.0339 118 ARG B N 2994 C CA . ARG B 42 ? 0.8448 0.6482 0.7252 0.0166 0.0169 -0.0377 118 ARG B CA 2995 C C . ARG B 42 ? 0.7917 0.5978 0.6671 0.0090 0.0122 -0.0400 118 ARG B C 2996 O O . ARG B 42 ? 0.7433 0.5538 0.6205 0.0054 0.0066 -0.0382 118 ARG B O 2997 C CB . ARG B 42 ? 0.8616 0.6754 0.7478 0.0233 0.0198 -0.0360 118 ARG B CB 2998 C CG . ARG B 42 ? 1.0662 0.8952 0.9580 0.0222 0.0152 -0.0339 118 ARG B CG 2999 C CD . ARG B 42 ? 1.2022 1.0425 1.1012 0.0292 0.0182 -0.0317 118 ARG B CD 3000 N NE . ARG B 42 ? 1.3335 1.1721 1.2369 0.0363 0.0209 -0.0285 118 ARG B NE 3001 C CZ . ARG B 42 ? 1.4722 1.3147 1.3794 0.0441 0.0260 -0.0269 118 ARG B CZ 3002 N NH1 . ARG B 42 ? 1.4824 1.3317 1.3901 0.0455 0.0290 -0.0286 118 ARG B NH1 3003 N NH2 . ARG B 42 ? 1.4839 1.3238 1.3943 0.0508 0.0284 -0.0234 118 ARG B NH2 3004 N N . GLN B 43 ? 0.7884 0.5917 0.6571 0.0069 0.0149 -0.0438 119 GLN B N 3005 C CA . GLN B 43 ? 0.6922 0.4962 0.5542 -0.0001 0.0113 -0.0461 119 GLN B CA 3006 C C . GLN B 43 ? 0.7083 0.5075 0.5666 -0.0063 0.0068 -0.0467 119 GLN B C 3007 O O . GLN B 43 ? 0.6636 0.4689 0.5214 -0.0102 0.0014 -0.0453 119 GLN B O 3008 C CB . GLN B 43 ? 0.6079 0.4243 0.4737 -0.0003 0.0078 -0.0436 119 GLN B CB 3009 C CG . GLN B 43 ? 0.8425 0.6592 0.7004 -0.0050 0.0074 -0.0461 119 GLN B CG 3010 C CD . GLN B 43 ? 0.8777 0.7003 0.7350 -0.0091 0.0014 -0.0438 119 GLN B CD 3011 O OE1 . GLN B 43 ? 0.8476 0.6771 0.7063 -0.0090 0.0008 -0.0422 119 GLN B OE1 3012 N NE2 . GLN B 43 ? 0.7677 0.5874 0.6227 -0.0128 -0.0027 -0.0434 119 GLN B NE2 3013 N N . ASN B 44 ? 0.7604 0.5488 0.6161 -0.0069 0.0095 -0.0485 120 ASN B N 3014 C CA . ASN B 44 ? 0.7344 0.5182 0.5863 -0.0136 0.0061 -0.0498 120 ASN B CA 3015 C C . ASN B 44 ? 0.8327 0.6156 0.6750 -0.0210 0.0038 -0.0538 120 ASN B C 3016 O O . ASN B 44 ? 0.8686 0.6477 0.7041 -0.0216 0.0073 -0.0573 120 ASN B O 3017 C CB . ASN B 44 ? 0.7941 0.5643 0.6436 -0.0134 0.0111 -0.0520 120 ASN B CB 3018 C CG . ASN B 44 ? 0.9473 0.7181 0.8056 -0.0071 0.0123 -0.0474 120 ASN B CG 3019 O OD1 . ASN B 44 ? 0.9546 0.7273 0.8167 -0.0091 0.0087 -0.0449 120 ASN B OD1 3020 N ND2 . ASN B 44 ? 0.9044 0.6741 0.7659 0.0008 0.0176 -0.0460 120 ASN B ND2 3021 N N . PHE B 45 ? 0.7915 0.5788 0.6331 -0.0266 -0.0020 -0.0529 121 PHE B N 3022 C CA . PHE B 45 ? 0.8239 0.6110 0.6561 -0.0340 -0.0045 -0.0565 121 PHE B CA 3023 C C . PHE B 45 ? 0.8827 0.6749 0.7164 -0.0392 -0.0105 -0.0549 121 PHE B C 3024 O O . PHE B 45 ? 0.7770 0.5734 0.6193 -0.0366 -0.0127 -0.0507 121 PHE B O 3025 C CB . PHE B 45 ? 0.6707 0.4653 0.4999 -0.0334 -0.0062 -0.0557 121 PHE B CB 3026 C CG . PHE B 45 ? 0.7611 0.5674 0.5971 -0.0314 -0.0114 -0.0500 121 PHE B CG 3027 C CD1 . PHE B 45 ? 0.7042 0.5148 0.5486 -0.0251 -0.0103 -0.0464 121 PHE B CD1 3028 C CD2 . PHE B 45 ? 0.7827 0.5959 0.6164 -0.0357 -0.0173 -0.0483 121 PHE B CD2 3029 C CE1 . PHE B 45 ? 0.8313 0.6511 0.6809 -0.0236 -0.0145 -0.0417 121 PHE B CE1 3030 C CE2 . PHE B 45 ? 0.7685 0.5910 0.6079 -0.0333 -0.0214 -0.0429 121 PHE B CE2 3031 C CZ . PHE B 45 ? 0.6897 0.5146 0.5366 -0.0274 -0.0197 -0.0399 121 PHE B CZ 3032 N N . VAL B 46 ? 0.8392 0.6321 0.6648 -0.0466 -0.0130 -0.0582 122 VAL B N 3033 C CA . VAL B 46 ? 0.7659 0.5647 0.5930 -0.0521 -0.0185 -0.0571 122 VAL B CA 3034 C C . VAL B 46 ? 0.8470 0.6583 0.6714 -0.0548 -0.0246 -0.0549 122 VAL B C 3035 O O . VAL B 46 ? 0.9399 0.7516 0.7558 -0.0570 -0.0245 -0.0574 122 VAL B O 3036 C CB . VAL B 46 ? 0.6779 0.4673 0.4986 -0.0597 -0.0163 -0.0629 122 VAL B CB 3037 C CG1 . VAL B 46 ? 0.6373 0.4360 0.4586 -0.0669 -0.0225 -0.0622 122 VAL B CG1 3038 C CG2 . VAL B 46 ? 0.6516 0.4290 0.4765 -0.0563 -0.0104 -0.0634 122 VAL B CG2 3039 N N . SER B 47 ? 0.8442 0.6657 0.6759 -0.0538 -0.0297 -0.0497 123 SER B N 3040 C CA . SER B 47 ? 0.8131 0.6469 0.6429 -0.0557 -0.0356 -0.0466 123 SER B CA 3041 C C . SER B 47 ? 0.7989 0.6408 0.6329 -0.0599 -0.0404 -0.0448 123 SER B C 3042 O O . SER B 47 ? 0.9001 0.7397 0.7414 -0.0589 -0.0396 -0.0436 123 SER B O 3043 C CB . SER B 47 ? 0.7869 0.6263 0.6209 -0.0486 -0.0364 -0.0411 123 SER B CB 3044 O OG . SER B 47 ? 0.8822 0.7316 0.7126 -0.0498 -0.0411 -0.0380 123 SER B OG 3045 N N . CYS B 48 ? 0.8657 0.7176 0.6949 -0.0646 -0.0453 -0.0445 124 CYS B N 3046 C CA . CYS B 48 ? 0.7492 0.6104 0.5816 -0.0699 -0.0498 -0.0435 124 CYS B CA 3047 C C . CYS B 48 ? 0.8123 0.6892 0.6488 -0.0670 -0.0556 -0.0367 124 CYS B C 3048 O O . CYS B 48 ? 1.0068 0.8881 0.8397 -0.0634 -0.0568 -0.0338 124 CYS B O 3049 C CB . CYS B 48 ? 0.7424 0.6032 0.5653 -0.0798 -0.0505 -0.0501 124 CYS B CB 3050 S SG . CYS B 48 ? 1.1093 0.9500 0.9277 -0.0836 -0.0429 -0.0581 124 CYS B SG 3051 N N . SER B 49 ? 0.8830 0.7681 0.7271 -0.0682 -0.0586 -0.0338 125 SER B N 3052 C CA . SER B 49 ? 0.8338 0.7343 0.6821 -0.0652 -0.0638 -0.0270 125 SER B CA 3053 C C . SER B 49 ? 0.9940 0.9074 0.8406 -0.0732 -0.0687 -0.0282 125 SER B C 3054 O O . SER B 49 ? 1.1165 1.0263 0.9570 -0.0816 -0.0680 -0.0348 125 SER B O 3055 C CB . SER B 49 ? 0.7968 0.6987 0.6564 -0.0593 -0.0635 -0.0218 125 SER B CB 3056 O OG . SER B 49 ? 0.8442 0.7491 0.7091 -0.0644 -0.0645 -0.0230 125 SER B OG 3057 N N . ASP B 50 ? 1.1262 1.0550 0.9784 -0.0705 -0.0733 -0.0218 126 ASP B N 3058 C CA . ASP B 50 ? 1.2493 1.1945 1.1022 -0.0771 -0.0786 -0.0215 126 ASP B CA 3059 C C . ASP B 50 ? 1.1314 1.0754 0.9910 -0.0832 -0.0777 -0.0245 126 ASP B C 3060 O O . ASP B 50 ? 1.1125 1.0678 0.9720 -0.0914 -0.0811 -0.0265 126 ASP B O 3061 C CB . ASP B 50 ? 1.3168 1.2786 1.1749 -0.0705 -0.0829 -0.0127 126 ASP B CB 3062 C CG . ASP B 50 ? 1.3167 1.2757 1.1853 -0.0623 -0.0810 -0.0071 126 ASP B CG 3063 O OD1 . ASP B 50 ? 1.2536 1.1971 1.1237 -0.0591 -0.0762 -0.0089 126 ASP B OD1 3064 O OD2 . ASP B 50 ? 1.3111 1.2841 1.1863 -0.0588 -0.0842 -0.0008 126 ASP B OD2 3065 N N . LYS B 51 ? 0.9702 0.9008 0.8353 -0.0793 -0.0731 -0.0246 127 LYS B N 3066 C CA . LYS B 51 ? 1.1724 1.1006 1.0443 -0.0835 -0.0716 -0.0261 127 LYS B CA 3067 C C . LYS B 51 ? 1.1298 1.0381 0.9981 -0.0870 -0.0654 -0.0328 127 LYS B C 3068 O O . LYS B 51 ? 1.1442 1.0497 1.0132 -0.0947 -0.0641 -0.0368 127 LYS B O 3069 C CB . LYS B 51 ? 1.1520 1.0845 1.0350 -0.0755 -0.0717 -0.0190 127 LYS B CB 3070 C CG . LYS B 51 ? 1.3081 1.2604 1.1958 -0.0722 -0.0772 -0.0121 127 LYS B CG 3071 C CD . LYS B 51 ? 1.4694 1.4372 1.3609 -0.0805 -0.0810 -0.0126 127 LYS B CD 3072 C CE . LYS B 51 ? 1.4738 1.4637 1.3677 -0.0780 -0.0869 -0.0062 127 LYS B CE 3073 N NZ . LYS B 51 ? 1.3600 1.3672 1.2593 -0.0859 -0.0907 -0.0064 127 LYS B NZ 3074 N N . GLU B 52 ? 0.9356 0.8305 0.8001 -0.0813 -0.0613 -0.0339 128 GLU B N 3075 C CA . GLU B 52 ? 0.9570 0.8332 0.8190 -0.0823 -0.0549 -0.0390 128 GLU B CA 3076 C C . GLU B 52 ? 0.9848 0.8499 0.8392 -0.0786 -0.0513 -0.0418 128 GLU B C 3077 O O . GLU B 52 ? 0.9066 0.7771 0.7594 -0.0737 -0.0533 -0.0388 128 GLU B O 3078 C CB . GLU B 52 ? 0.9269 0.7979 0.7984 -0.0761 -0.0522 -0.0351 128 GLU B CB 3079 C CG . GLU B 52 ? 0.9608 0.8320 0.8360 -0.0655 -0.0518 -0.0299 128 GLU B CG 3080 C CD . GLU B 52 ? 1.1023 0.9716 0.9869 -0.0596 -0.0501 -0.0256 128 GLU B CD 3081 O OE1 . GLU B 52 ? 1.2675 1.1361 1.1563 -0.0632 -0.0493 -0.0258 128 GLU B OE1 3082 O OE2 . GLU B 52 ? 0.9797 0.8483 0.8671 -0.0517 -0.0493 -0.0220 128 GLU B OE2 3083 N N . CYS B 53 ? 0.9842 0.8332 0.8341 -0.0808 -0.0455 -0.0473 129 CYS B N 3084 C CA . CYS B 53 ? 0.9752 0.8129 0.8203 -0.0756 -0.0409 -0.0492 129 CYS B CA 3085 C C . CYS B 53 ? 0.9127 0.7430 0.7654 -0.0671 -0.0370 -0.0458 129 CYS B C 3086 O O . CYS B 53 ? 0.8410 0.6672 0.6991 -0.0674 -0.0352 -0.0450 129 CYS B O 3087 C CB . CYS B 53 ? 0.9319 0.7563 0.7666 -0.0819 -0.0362 -0.0571 129 CYS B CB 3088 S SG . CYS B 53 ? 1.1756 1.0089 0.9991 -0.0904 -0.0406 -0.0614 129 CYS B SG 3089 N N . ARG B 54 ? 0.7371 0.5665 0.5900 -0.0598 -0.0357 -0.0437 130 ARG B N 3090 C CA . ARG B 54 ? 0.7476 0.5725 0.6076 -0.0518 -0.0325 -0.0404 130 ARG B CA 3091 C C . ARG B 54 ? 0.8323 0.6472 0.6884 -0.0478 -0.0271 -0.0432 130 ARG B C 3092 O O . ARG B 54 ? 0.8727 0.6876 0.7220 -0.0486 -0.0268 -0.0455 130 ARG B O 3093 C CB . ARG B 54 ? 0.8680 0.7042 0.7350 -0.0460 -0.0364 -0.0340 130 ARG B CB 3094 C CG . ARG B 54 ? 0.8075 0.6541 0.6803 -0.0480 -0.0411 -0.0302 130 ARG B CG 3095 C CD . ARG B 54 ? 0.8298 0.6847 0.7091 -0.0414 -0.0434 -0.0241 130 ARG B CD 3096 N NE . ARG B 54 ? 0.7452 0.5949 0.6302 -0.0351 -0.0401 -0.0223 130 ARG B NE 3097 C CZ . ARG B 54 ? 0.6884 0.5366 0.5796 -0.0341 -0.0391 -0.0205 130 ARG B CZ 3098 N NH1 . ARG B 54 ? 0.5185 0.3693 0.4112 -0.0394 -0.0409 -0.0207 130 ARG B NH1 3099 N NH2 . ARG B 54 ? 0.5524 0.3971 0.4481 -0.0281 -0.0363 -0.0187 130 ARG B NH2 3100 N N . ARG B 55 ? 0.8277 0.6347 0.6882 -0.0431 -0.0226 -0.0424 131 ARG B N 3101 C CA . ARG B 55 ? 0.7515 0.5505 0.6103 -0.0377 -0.0171 -0.0439 131 ARG B CA 3102 C C . ARG B 55 ? 0.7421 0.5489 0.6077 -0.0302 -0.0181 -0.0392 131 ARG B C 3103 O O . ARG B 55 ? 0.9692 0.7791 0.8424 -0.0262 -0.0188 -0.0351 131 ARG B O 3104 C CB . ARG B 55 ? 0.7638 0.5504 0.6235 -0.0362 -0.0113 -0.0452 131 ARG B CB 3105 C CG . ARG B 55 ? 0.7990 0.5782 0.6580 -0.0294 -0.0052 -0.0459 131 ARG B CG 3106 C CD . ARG B 55 ? 0.8478 0.6147 0.7078 -0.0269 0.0006 -0.0461 131 ARG B CD 3107 N NE . ARG B 55 ? 0.8887 0.6515 0.7501 -0.0185 0.0061 -0.0451 131 ARG B NE 3108 C CZ . ARG B 55 ? 0.9021 0.6548 0.7646 -0.0136 0.0121 -0.0442 131 ARG B CZ 3109 N NH1 . ARG B 55 ? 0.9639 0.7079 0.8257 -0.0170 0.0136 -0.0444 131 ARG B NH1 3110 N NH2 . ARG B 55 ? 0.8302 0.5818 0.6946 -0.0054 0.0167 -0.0428 131 ARG B NH2 3111 N N . PHE B 56 ? 0.8451 0.6550 0.7073 -0.0289 -0.0181 -0.0399 132 PHE B N 3112 C CA . PHE B 56 ? 0.7491 0.5652 0.6165 -0.0227 -0.0181 -0.0365 132 PHE B CA 3113 C C . PHE B 56 ? 0.7955 0.6059 0.6631 -0.0177 -0.0121 -0.0381 132 PHE B C 3114 O O . PHE B 56 ? 0.9241 0.7261 0.7854 -0.0191 -0.0081 -0.0423 132 PHE B O 3115 C CB . PHE B 56 ? 0.6726 0.4954 0.5360 -0.0243 -0.0210 -0.0360 132 PHE B CB 3116 C CG . PHE B 56 ? 0.6545 0.4853 0.5193 -0.0268 -0.0267 -0.0327 132 PHE B CG 3117 C CD1 . PHE B 56 ? 0.7299 0.5613 0.5903 -0.0328 -0.0296 -0.0343 132 PHE B CD1 3118 C CD2 . PHE B 56 ? 0.6077 0.4457 0.4780 -0.0231 -0.0290 -0.0281 132 PHE B CD2 3119 C CE1 . PHE B 56 ? 0.8240 0.6646 0.6863 -0.0345 -0.0349 -0.0308 132 PHE B CE1 3120 C CE2 . PHE B 56 ? 0.5476 0.3929 0.4192 -0.0246 -0.0337 -0.0246 132 PHE B CE2 3121 C CZ . PHE B 56 ? 0.7113 0.5584 0.5793 -0.0298 -0.0367 -0.0256 132 PHE B CZ 3122 N N . PHE B 57 ? 0.7208 0.5367 0.5956 -0.0117 -0.0115 -0.0347 133 PHE B N 3123 C CA . PHE B 57 ? 0.8516 0.6657 0.7282 -0.0062 -0.0064 -0.0353 133 PHE B CA 3124 C C . PHE B 57 ? 0.8370 0.6616 0.7211 -0.0015 -0.0076 -0.0316 133 PHE B C 3125 O O . PHE B 57 ? 0.8180 0.6491 0.7054 -0.0024 -0.0118 -0.0288 133 PHE B O 3126 C CB . PHE B 57 ? 0.9258 0.7312 0.8039 -0.0031 -0.0022 -0.0355 133 PHE B CB 3127 C CG . PHE B 57 ? 0.9080 0.7157 0.7926 -0.0016 -0.0045 -0.0315 133 PHE B CG 3128 C CD1 . PHE B 57 ? 0.8916 0.7064 0.7839 0.0047 -0.0043 -0.0275 133 PHE B CD1 3129 C CD2 . PHE B 57 ? 0.9082 0.7120 0.7911 -0.0069 -0.0069 -0.0319 133 PHE B CD2 3130 C CE1 . PHE B 57 ? 0.8361 0.6530 0.7338 0.0061 -0.0063 -0.0238 133 PHE B CE1 3131 C CE2 . PHE B 57 ? 0.9845 0.7907 0.8734 -0.0056 -0.0088 -0.0281 133 PHE B CE2 3132 C CZ . PHE B 57 ? 0.8146 0.6268 0.7106 0.0011 -0.0084 -0.0240 133 PHE B CZ 3133 N N . VAL B 58 ? 0.8540 0.6803 0.7403 0.0033 -0.0035 -0.0319 134 VAL B N 3134 C CA . VAL B 58 ? 0.7064 0.5434 0.5997 0.0074 -0.0040 -0.0291 134 VAL B CA 3135 C C . VAL B 58 ? 0.8595 0.6968 0.7586 0.0139 -0.0009 -0.0270 134 VAL B C 3136 O O . VAL B 58 ? 0.9006 0.7302 0.7974 0.0165 0.0038 -0.0285 134 VAL B O 3137 C CB . VAL B 58 ? 0.7314 0.5730 0.6228 0.0073 -0.0018 -0.0310 134 VAL B CB 3138 C CG1 . VAL B 58 ? 0.9096 0.7611 0.8083 0.0125 0.0002 -0.0292 134 VAL B CG1 3139 C CG2 . VAL B 58 ? 0.5984 0.4429 0.4862 0.0022 -0.0054 -0.0311 134 VAL B CG2 3140 N N . SER B 59 ? 0.9281 0.7736 0.8339 0.0167 -0.0031 -0.0234 135 SER B N 3141 C CA . SER B 59 ? 0.9700 0.8173 0.8812 0.0234 -0.0005 -0.0206 135 SER B CA 3142 C C . SER B 59 ? 1.1184 0.9798 1.0365 0.0267 -0.0019 -0.0180 135 SER B C 3143 O O . SER B 59 ? 1.0621 0.9307 0.9808 0.0234 -0.0047 -0.0185 135 SER B O 3144 C CB . SER B 59 ? 0.9457 0.7860 0.8574 0.0235 -0.0015 -0.0185 135 SER B CB 3145 O OG . SER B 59 ? 0.9446 0.7842 0.8599 0.0305 0.0022 -0.0157 135 SER B OG 3146 N N . MET B 60 ? 1.2519 1.1170 1.1749 0.0334 0.0004 -0.0151 136 MET B N 3147 C CA . MET B 60 ? 1.1673 1.0473 1.0970 0.0368 -0.0010 -0.0125 136 MET B CA 3148 C C . MET B 60 ? 1.1608 1.0419 1.0939 0.0396 -0.0029 -0.0085 136 MET B C 3149 O O . MET B 60 ? 1.1293 1.0191 1.0655 0.0383 -0.0065 -0.0070 136 MET B O 3150 C CB . MET B 60 ? 0.9932 0.8799 0.9260 0.0431 0.0035 -0.0120 136 MET B CB 3151 C CG . MET B 60 ? 1.0690 0.9702 1.0051 0.0417 0.0029 -0.0133 136 MET B CG 3152 S SD . MET B 60 ? 1.8893 1.8000 1.8299 0.0498 0.0084 -0.0123 136 MET B SD 3153 C CE . MET B 60 ? 1.5019 1.4314 1.4469 0.0458 0.0065 -0.0141 136 MET B CE 3154 N N . GLY B 61 ? 1.2524 1.1235 1.1843 0.0433 0.0001 -0.0068 137 GLY B N 3155 C CA . GLY B 61 ? 1.3358 1.2059 1.2702 0.0466 -0.0006 -0.0027 137 GLY B CA 3156 C C . GLY B 61 ? 1.4018 1.2574 1.3330 0.0499 0.0042 -0.0019 137 GLY B C 3157 O O . GLY B 61 ? 1.5019 1.3448 1.4274 0.0455 0.0058 -0.0053 137 GLY B O 3158 N N . TYR B 62 ? 1.3691 1.2263 1.3033 0.0576 0.0070 0.0026 138 TYR B N 3159 C CA . TYR B 62 ? 1.3909 1.2325 1.3217 0.0605 0.0119 0.0041 138 TYR B CA 3160 C C . TYR B 62 ? 1.3177 1.1561 1.2484 0.0695 0.0187 0.0061 138 TYR B C 3161 O O . TYR B 62 ? 1.1561 1.0064 1.0919 0.0774 0.0196 0.0103 138 TYR B O 3162 C CB . TYR B 62 ? 1.3754 1.2161 1.3081 0.0612 0.0100 0.0083 138 TYR B CB 3163 C CG . TYR B 62 ? 1.1571 0.9971 1.0889 0.0525 0.0046 0.0063 138 TYR B CG 3164 C CD1 . TYR B 62 ? 0.9676 0.8212 0.9028 0.0498 -0.0009 0.0062 138 TYR B CD1 3165 C CD2 . TYR B 62 ? 1.1961 1.0220 1.1235 0.0470 0.0054 0.0046 138 TYR B CD2 3166 C CE1 . TYR B 62 ? 1.0136 0.8662 0.9478 0.0428 -0.0053 0.0049 138 TYR B CE1 3167 C CE2 . TYR B 62 ? 1.2193 1.0463 1.1465 0.0397 0.0005 0.0033 138 TYR B CE2 3168 C CZ . TYR B 62 ? 1.1649 1.0050 1.0955 0.0381 -0.0047 0.0037 138 TYR B CZ 3169 O OH . TYR B 62 ? 1.1751 1.0158 1.1054 0.0318 -0.0089 0.0029 138 TYR B OH 3170 N N . VAL B 73 ? 1.5983 1.5042 1.5102 0.0160 0.0187 -0.0358 149 VAL B N 3171 C CA . VAL B 73 ? 1.7489 1.6654 1.6653 0.0122 0.0157 -0.0348 149 VAL B CA 3172 C C . VAL B 73 ? 1.7523 1.6799 1.6777 0.0166 0.0137 -0.0320 149 VAL B C 3173 O O . VAL B 73 ? 1.7387 1.6818 1.6711 0.0179 0.0150 -0.0317 149 VAL B O 3174 C CB . VAL B 73 ? 1.3609 1.2866 1.2780 0.0084 0.0188 -0.0368 149 VAL B CB 3175 C CG1 . VAL B 73 ? 1.1736 1.1045 1.0915 0.0022 0.0161 -0.0368 149 VAL B CG1 3176 C CG2 . VAL B 73 ? 1.2673 1.1826 1.1755 0.0059 0.0219 -0.0393 149 VAL B CG2 3177 N N . SER B 74 ? 1.6374 1.5579 1.5625 0.0189 0.0107 -0.0300 150 SER B N 3178 C CA . SER B 74 ? 1.5647 1.4945 1.4969 0.0223 0.0082 -0.0270 150 SER B CA 3179 C C . SER B 74 ? 1.5098 1.4369 1.4404 0.0173 0.0033 -0.0264 150 SER B C 3180 O O . SER B 74 ? 1.3482 1.2628 1.2728 0.0144 0.0015 -0.0267 150 SER B O 3181 C CB . SER B 74 ? 1.4299 1.3543 1.3636 0.0296 0.0092 -0.0246 150 SER B CB 3182 O OG . SER B 74 ? 1.1074 1.0447 1.0489 0.0348 0.0085 -0.0214 150 SER B OG 3183 N N . GLU B 75 ? 1.5824 1.5220 1.5183 0.0162 0.0015 -0.0256 151 GLU B N 3184 C CA . GLU B 75 ? 1.5980 1.5353 1.5319 0.0112 -0.0021 -0.0255 151 GLU B CA 3185 C C . GLU B 75 ? 1.5020 1.4347 1.4368 0.0141 -0.0054 -0.0226 151 GLU B C 3186 O O . GLU B 75 ? 1.5014 1.4301 1.4340 0.0108 -0.0082 -0.0222 151 GLU B O 3187 C CB . GLU B 75 ? 1.7349 1.6869 1.6731 0.0077 -0.0022 -0.0266 151 GLU B CB 3188 C CG . GLU B 75 ? 1.8698 1.8171 1.8034 0.0004 -0.0036 -0.0281 151 GLU B CG 3189 C CD . GLU B 75 ? 1.9070 1.8435 1.8335 -0.0038 -0.0016 -0.0299 151 GLU B CD 3190 O OE1 . GLU B 75 ? 1.9055 1.8289 1.8261 -0.0046 -0.0032 -0.0290 151 GLU B OE1 3191 O OE2 . GLU B 75 ? 1.8775 1.8193 1.8041 -0.0062 0.0016 -0.0320 151 GLU B OE2 3192 N N . GLN B 76 ? 1.4499 1.3823 1.3875 0.0206 -0.0044 -0.0205 152 GLN B N 3193 C CA . GLN B 76 ? 1.4082 1.3370 1.3471 0.0238 -0.0069 -0.0175 152 GLN B CA 3194 C C . GLN B 76 ? 1.2213 1.1339 1.1547 0.0232 -0.0073 -0.0174 152 GLN B C 3195 O O . GLN B 76 ? 1.0833 0.9911 1.0173 0.0257 -0.0086 -0.0150 152 GLN B O 3196 C CB . GLN B 76 ? 1.6361 1.5736 1.5810 0.0314 -0.0053 -0.0147 152 GLN B CB 3197 C CG . GLN B 76 ? 1.7446 1.6995 1.6949 0.0324 -0.0038 -0.0153 152 GLN B CG 3198 C CD . GLN B 76 ? 1.7359 1.7024 1.6926 0.0405 -0.0030 -0.0116 152 GLN B CD 3199 O OE1 . GLN B 76 ? 1.6673 1.6269 1.6238 0.0458 -0.0028 -0.0084 152 GLN B OE1 3200 N NE2 . GLN B 76 ? 1.7394 1.7241 1.7017 0.0414 -0.0023 -0.0117 152 GLN B NE2 3201 N N . MET B 77 ? 1.1628 1.0677 1.0906 0.0194 -0.0062 -0.0201 156 MET B N 3202 C CA . MET B 77 ? 0.8946 0.7856 0.8168 0.0183 -0.0064 -0.0206 156 MET B CA 3203 C C . MET B 77 ? 0.8020 0.6873 0.7201 0.0131 -0.0100 -0.0205 156 MET B C 3204 O O . MET B 77 ? 0.7751 0.6638 0.6920 0.0094 -0.0111 -0.0211 156 MET B O 3205 C CB . MET B 77 ? 0.6812 0.5665 0.5987 0.0178 -0.0028 -0.0234 156 MET B CB 3206 C CG . MET B 77 ? 1.0105 0.9034 0.9319 0.0224 0.0013 -0.0237 156 MET B CG 3207 S SD . MET B 77 ? 1.0948 0.9757 1.0114 0.0256 0.0062 -0.0255 156 MET B SD 3208 C CE . MET B 77 ? 0.7582 0.6310 0.6759 0.0290 0.0050 -0.0226 156 MET B CE 3209 N N . ASN B 78 ? 0.5993 0.4756 0.5149 0.0129 -0.0114 -0.0197 157 ASN B N 3210 C CA . ASN B 78 ? 0.7918 0.6633 0.7039 0.0089 -0.0148 -0.0191 157 ASN B CA 3211 C C . ASN B 78 ? 0.9537 0.8153 0.8601 0.0066 -0.0147 -0.0206 157 ASN B C 3212 O O . ASN B 78 ? 0.9782 0.8349 0.8836 0.0084 -0.0119 -0.0220 157 ASN B O 3213 C CB . ASN B 78 ? 0.9193 0.7933 0.8356 0.0103 -0.0175 -0.0160 157 ASN B CB 3214 C CG . ASN B 78 ? 0.9140 0.7977 0.8344 0.0111 -0.0179 -0.0151 157 ASN B CG 3215 O OD1 . ASN B 78 ? 0.9921 0.8773 0.9104 0.0078 -0.0188 -0.0157 157 ASN B OD1 3216 N ND2 . ASN B 78 ? 0.6704 0.5605 0.5961 0.0153 -0.0170 -0.0138 157 ASN B ND2 3217 N N . VAL B 79 ? 0.8928 0.7518 0.7952 0.0026 -0.0176 -0.0204 158 VAL B N 3218 C CA . VAL B 79 ? 0.8682 0.7200 0.7650 -0.0006 -0.0184 -0.0219 158 VAL B CA 3219 C C . VAL B 79 ? 0.7909 0.6409 0.6899 -0.0011 -0.0211 -0.0198 158 VAL B C 3220 O O . VAL B 79 ? 0.8059 0.6601 0.7077 -0.0011 -0.0240 -0.0169 158 VAL B O 3221 C CB . VAL B 79 ? 0.7803 0.6317 0.6708 -0.0046 -0.0199 -0.0226 158 VAL B CB 3222 C CG1 . VAL B 79 ? 0.5089 0.3544 0.3933 -0.0082 -0.0208 -0.0245 158 VAL B CG1 3223 C CG2 . VAL B 79 ? 0.6639 0.5173 0.5524 -0.0044 -0.0168 -0.0245 158 VAL B CG2 3224 N N . TYR B 80 ? 0.7641 0.6075 0.6616 -0.0018 -0.0198 -0.0212 159 TYR B N 3225 C CA . TYR B 80 ? 0.7637 0.6049 0.6628 -0.0034 -0.0219 -0.0197 159 TYR B CA 3226 C C . TYR B 80 ? 0.8249 0.6599 0.7178 -0.0087 -0.0224 -0.0226 159 TYR B C 3227 O O . TYR B 80 ? 0.8395 0.6711 0.7263 -0.0109 -0.0209 -0.0259 159 TYR B O 3228 C CB . TYR B 80 ? 0.6611 0.4996 0.5648 0.0007 -0.0194 -0.0183 159 TYR B CB 3229 C CG . TYR B 80 ? 0.7146 0.5600 0.6242 0.0060 -0.0187 -0.0157 159 TYR B CG 3230 C CD1 . TYR B 80 ? 0.7119 0.5596 0.6220 0.0094 -0.0156 -0.0169 159 TYR B CD1 3231 C CD2 . TYR B 80 ? 0.7895 0.6399 0.7041 0.0076 -0.0210 -0.0122 159 TYR B CD2 3232 C CE1 . TYR B 80 ? 0.7730 0.6290 0.6886 0.0137 -0.0152 -0.0147 159 TYR B CE1 3233 C CE2 . TYR B 80 ? 0.8157 0.6732 0.7352 0.0121 -0.0205 -0.0102 159 TYR B CE2 3234 C CZ . TYR B 80 ? 0.8177 0.6785 0.7376 0.0149 -0.0178 -0.0115 159 TYR B CZ 3235 O OH . TYR B 80 ? 0.7545 0.6243 0.6792 0.0187 -0.0176 -0.0098 159 TYR B OH 3236 N N . SER B 81 ? 0.7033 0.5371 0.5978 -0.0110 -0.0242 -0.0214 160 SER B N 3237 C CA . SER B 81 ? 0.7880 0.6175 0.6773 -0.0171 -0.0250 -0.0243 160 SER B CA 3238 C C . SER B 81 ? 0.8438 0.6705 0.7364 -0.0186 -0.0251 -0.0231 160 SER B C 3239 O O . SER B 81 ? 0.9582 0.7890 0.8572 -0.0154 -0.0261 -0.0192 160 SER B O 3240 C CB . SER B 81 ? 0.8011 0.6375 0.6872 -0.0209 -0.0296 -0.0237 160 SER B CB 3241 O OG . SER B 81 ? 0.8154 0.6577 0.7054 -0.0225 -0.0334 -0.0206 160 SER B OG 3242 N N . VAL B 82 ? 0.8053 0.6246 0.6932 -0.0238 -0.0236 -0.0267 161 VAL B N 3243 C CA . VAL B 82 ? 0.7704 0.5870 0.6603 -0.0274 -0.0238 -0.0262 161 VAL B CA 3244 C C . VAL B 82 ? 0.8380 0.6541 0.7215 -0.0360 -0.0257 -0.0302 161 VAL B C 3245 O O . VAL B 82 ? 0.9503 0.7659 0.8274 -0.0381 -0.0259 -0.0334 161 VAL B O 3246 C CB . VAL B 82 ? 0.8978 0.7022 0.7878 -0.0249 -0.0177 -0.0271 161 VAL B CB 3247 C CG1 . VAL B 82 ? 0.9512 0.7583 0.8480 -0.0165 -0.0164 -0.0225 161 VAL B CG1 3248 C CG2 . VAL B 82 ? 0.8594 0.6534 0.7420 -0.0254 -0.0129 -0.0320 161 VAL B CG2 3249 N N . LYS B 83 ? 0.8692 0.6865 0.7545 -0.0412 -0.0272 -0.0300 162 LYS B N 3250 C CA . LYS B 83 ? 0.8365 0.6539 0.7158 -0.0504 -0.0288 -0.0343 162 LYS B CA 3251 C C . LYS B 83 ? 0.9330 0.7348 0.8048 -0.0531 -0.0228 -0.0401 162 LYS B C 3252 O O . LYS B 83 ? 1.0223 0.8135 0.8956 -0.0492 -0.0175 -0.0397 162 LYS B O 3253 C CB . LYS B 83 ? 0.7369 0.5597 0.6210 -0.0552 -0.0312 -0.0326 162 LYS B CB 3254 C CG . LYS B 83 ? 0.7724 0.5980 0.6516 -0.0657 -0.0334 -0.0368 162 LYS B CG 3255 C CD . LYS B 83 ? 0.8228 0.6559 0.7086 -0.0698 -0.0357 -0.0342 162 LYS B CD 3256 C CE . LYS B 83 ? 1.1018 0.9370 0.9827 -0.0816 -0.0371 -0.0393 162 LYS B CE 3257 N NZ . LYS B 83 ? 1.1654 1.0028 1.0517 -0.0869 -0.0369 -0.0383 162 LYS B NZ 3258 N N . LEU B 84 ? 1.0183 0.8184 0.8815 -0.0592 -0.0231 -0.0453 163 LEU B N 3259 C CA . LEU B 84 ? 0.9918 0.7761 0.8467 -0.0627 -0.0169 -0.0514 163 LEU B CA 3260 C C . LEU B 84 ? 0.9496 0.7254 0.8046 -0.0685 -0.0141 -0.0531 163 LEU B C 3261 O O . LEU B 84 ? 0.9059 0.6894 0.7617 -0.0764 -0.0181 -0.0538 163 LEU B O 3262 C CB . LEU B 84 ? 0.8543 0.6399 0.6993 -0.0696 -0.0186 -0.0568 163 LEU B CB 3263 C CG . LEU B 84 ? 0.8392 0.6086 0.6742 -0.0713 -0.0117 -0.0633 163 LEU B CG 3264 C CD1 . LEU B 84 ? 0.8477 0.6106 0.6850 -0.0608 -0.0069 -0.0611 163 LEU B CD1 3265 C CD2 . LEU B 84 ? 0.8543 0.6276 0.6796 -0.0781 -0.0143 -0.0682 163 LEU B CD2 3266 N N . GLY B 85 ? 0.9304 0.6910 0.7850 -0.0644 -0.0070 -0.0535 164 GLY B N 3267 C CA . GLY B 85 ? 1.0807 0.8307 0.9349 -0.0695 -0.0030 -0.0549 164 GLY B CA 3268 C C . GLY B 85 ? 1.1791 0.9282 1.0421 -0.0620 -0.0013 -0.0485 164 GLY B C 3269 O O . GLY B 85 ? 1.1314 0.8671 0.9935 -0.0627 0.0045 -0.0488 164 GLY B O 3270 N N . ASP B 86 ? 1.2137 0.9767 1.0847 -0.0551 -0.0061 -0.0427 165 ASP B N 3271 C CA . ASP B 86 ? 1.0764 0.8402 0.9555 -0.0466 -0.0048 -0.0365 165 ASP B CA 3272 C C . ASP B 86 ? 1.0427 0.7996 0.9209 -0.0370 -0.0001 -0.0355 165 ASP B C 3273 O O . ASP B 86 ? 1.0778 0.8341 0.9513 -0.0363 0.0004 -0.0386 165 ASP B O 3274 C CB . ASP B 86 ? 0.9571 0.7389 0.8444 -0.0440 -0.0118 -0.0313 165 ASP B CB 3275 C CG . ASP B 86 ? 1.0911 0.8819 0.9806 -0.0524 -0.0165 -0.0313 165 ASP B CG 3276 O OD1 . ASP B 86 ? 1.0961 0.8799 0.9811 -0.0611 -0.0145 -0.0356 165 ASP B OD1 3277 O OD2 . ASP B 86 ? 1.0280 0.8331 0.9239 -0.0504 -0.0219 -0.0270 165 ASP B OD2 3278 N N . PRO B 87 ? 1.0233 0.7754 0.9060 -0.0297 0.0037 -0.0311 166 PRO B N 3279 C CA . PRO B 87 ? 0.9396 0.6886 0.8228 -0.0198 0.0077 -0.0293 166 PRO B CA 3280 C C . PRO B 87 ? 1.0641 0.8290 0.9547 -0.0132 0.0027 -0.0246 166 PRO B C 3281 O O . PRO B 87 ? 1.0147 0.7901 0.9108 -0.0143 -0.0023 -0.0214 166 PRO B O 3282 C CB . PRO B 87 ? 0.9764 0.7135 0.8606 -0.0152 0.0140 -0.0262 166 PRO B CB 3283 C CG . PRO B 87 ? 0.9768 0.7186 0.8656 -0.0198 0.0107 -0.0235 166 PRO B CG 3284 C CD . PRO B 87 ? 1.0846 0.8319 0.9705 -0.0307 0.0058 -0.0281 166 PRO B CD 3285 N N . PRO B 88 ? 1.0430 0.8099 0.9335 -0.0067 0.0044 -0.0245 167 PRO B N 3286 C CA . PRO B 88 ? 1.0182 0.7994 0.9154 -0.0007 0.0005 -0.0204 167 PRO B CA 3287 C C . PRO B 88 ? 1.0576 0.8418 0.9614 0.0067 0.0016 -0.0146 167 PRO B C 3288 O O . PRO B 88 ? 1.0374 0.8273 0.9444 0.0141 0.0027 -0.0122 167 PRO B O 3289 C CB . PRO B 88 ? 0.9321 0.7138 0.8265 0.0029 0.0027 -0.0228 167 PRO B CB 3290 C CG . PRO B 88 ? 0.9578 0.7239 0.8453 0.0021 0.0093 -0.0265 167 PRO B CG 3291 C CD . PRO B 88 ? 0.7737 0.5312 0.6571 -0.0065 0.0091 -0.0291 167 PRO B CD 3292 N N . THR B 89 ? 1.1115 0.8930 1.0171 0.0044 0.0013 -0.0125 168 THR B N 3293 C CA . THR B 89 ? 1.0948 0.8812 1.0065 0.0102 0.0011 -0.0067 168 THR B CA 3294 C C . THR B 89 ? 1.2229 1.0245 1.1398 0.0094 -0.0056 -0.0045 168 THR B C 3295 O O . THR B 89 ? 1.1696 0.9755 1.0857 0.0030 -0.0098 -0.0067 168 THR B O 3296 C CB . THR B 89 ? 1.1239 0.9003 1.0350 0.0075 0.0040 -0.0053 168 THR B CB 3297 O OG1 . THR B 89 ? 1.3535 1.1327 1.2644 -0.0015 -0.0001 -0.0074 168 THR B OG1 3298 C CG2 . THR B 89 ? 1.0383 0.7971 0.9430 0.0076 0.0115 -0.0079 168 THR B CG2 3299 N N . PRO B 90 ? 1.1319 0.9419 1.0540 0.0160 -0.0065 -0.0001 169 PRO B N 3300 C CA . PRO B 90 ? 0.9626 0.7857 0.8892 0.0164 -0.0117 0.0022 169 PRO B CA 3301 C C . PRO B 90 ? 1.0697 0.8954 0.9972 0.0099 -0.0156 0.0022 169 PRO B C 3302 O O . PRO B 90 ? 1.0856 0.9197 1.0141 0.0079 -0.0198 0.0017 169 PRO B O 3303 C CB . PRO B 90 ? 0.7684 0.5946 0.6991 0.0232 -0.0101 0.0071 169 PRO B CB 3304 C CG . PRO B 90 ? 0.8764 0.6961 0.8053 0.0289 -0.0049 0.0073 169 PRO B CG 3305 C CD . PRO B 90 ? 0.9753 0.7821 0.8985 0.0242 -0.0017 0.0030 169 PRO B CD 3306 N N . ASP B 91 ? 1.1238 0.9426 1.0510 0.0068 -0.0139 0.0028 170 ASP B N 3307 C CA . ASP B 91 ? 1.0725 0.8951 1.0014 0.0007 -0.0172 0.0031 170 ASP B CA 3308 C C . ASP B 91 ? 1.0692 0.8930 0.9945 -0.0063 -0.0200 -0.0011 170 ASP B C 3309 O O . ASP B 91 ? 1.0213 0.8538 0.9486 -0.0094 -0.0244 -0.0004 170 ASP B O 3310 C CB . ASP B 91 ? 1.2888 1.1033 1.2181 -0.0014 -0.0139 0.0047 170 ASP B CB 3311 C CG . ASP B 91 ? 1.5469 1.3658 1.4781 -0.0087 -0.0170 0.0046 170 ASP B CG 3312 O OD1 . ASP B 91 ? 1.5629 1.3925 1.4986 -0.0078 -0.0207 0.0075 170 ASP B OD1 3313 O OD2 . ASP B 91 ? 1.6262 1.4378 1.5542 -0.0155 -0.0153 0.0015 170 ASP B OD2 3314 N N . LYS B 92 A 1.1136 0.9290 1.0334 -0.0082 -0.0174 -0.0053 170 LYS B N 3315 C CA . LYS B 92 A 0.9952 0.8112 0.9105 -0.0150 -0.0197 -0.0096 170 LYS B CA 3316 C C . LYS B 92 A 0.9226 0.7451 0.8364 -0.0127 -0.0221 -0.0107 170 LYS B C 3317 O O . LYS B 92 A 0.8163 0.6421 0.7267 -0.0173 -0.0249 -0.0131 170 LYS B O 3318 C CB . LYS B 92 A 1.0042 0.8068 0.9130 -0.0194 -0.0152 -0.0142 170 LYS B CB 3319 C CG . LYS B 92 A 1.0400 0.8341 0.9489 -0.0233 -0.0121 -0.0140 170 LYS B CG 3320 C CD . LYS B 92 A 1.0991 0.8997 1.0088 -0.0322 -0.0161 -0.0151 170 LYS B CD 3321 C CE . LYS B 92 A 1.2567 1.0466 1.1643 -0.0386 -0.0121 -0.0169 170 LYS B CE 3322 N NZ . LYS B 92 A 1.2599 1.0529 1.1739 -0.0375 -0.0120 -0.0120 170 LYS B NZ 3323 N N . LEU B 93 ? 0.9410 0.7658 0.8573 -0.0057 -0.0209 -0.0086 171 LEU B N 3324 C CA . LEU B 93 ? 0.8833 0.7139 0.7987 -0.0035 -0.0224 -0.0094 171 LEU B CA 3325 C C . LEU B 93 ? 0.9937 0.8340 0.9103 -0.0054 -0.0273 -0.0081 171 LEU B C 3326 O O . LEU B 93 ? 1.2274 1.0721 1.1473 -0.0067 -0.0298 -0.0055 171 LEU B O 3327 C CB . LEU B 93 ? 1.0138 0.8470 0.9326 0.0039 -0.0203 -0.0071 171 LEU B CB 3328 C CG . LEU B 93 ? 1.0151 0.8431 0.9310 0.0068 -0.0161 -0.0096 171 LEU B CG 3329 C CD1 . LEU B 93 ? 0.9321 0.7687 0.8499 0.0106 -0.0169 -0.0091 171 LEU B CD1 3330 C CD2 . LEU B 93 ? 0.9696 0.7904 0.8789 0.0014 -0.0152 -0.0142 171 LEU B CD2 3331 N N . LYS B 94 ? 0.9379 0.7810 0.8516 -0.0053 -0.0282 -0.0097 172 LYS B N 3332 C CA . LYS B 94 ? 0.7507 0.6015 0.6645 -0.0061 -0.0319 -0.0082 172 LYS B CA 3333 C C . LYS B 94 ? 0.7566 0.6091 0.6684 -0.0037 -0.0309 -0.0094 172 LYS B C 3334 O O . LYS B 94 ? 0.7888 0.6375 0.6960 -0.0051 -0.0292 -0.0126 172 LYS B O 3335 C CB . LYS B 94 ? 0.6793 0.5311 0.5891 -0.0118 -0.0347 -0.0096 172 LYS B CB 3336 C CG . LYS B 94 ? 0.6482 0.5070 0.5568 -0.0118 -0.0378 -0.0078 172 LYS B CG 3337 C CD . LYS B 94 ? 0.8067 0.6689 0.7124 -0.0169 -0.0410 -0.0081 172 LYS B CD 3338 C CE . LYS B 94 ? 0.7795 0.6481 0.6831 -0.0162 -0.0437 -0.0057 172 LYS B CE 3339 N NZ . LYS B 94 ? 0.8842 0.7569 0.7926 -0.0116 -0.0441 -0.0015 172 LYS B NZ 3340 N N . PHE B 95 ? 0.7400 0.5980 0.6551 -0.0005 -0.0316 -0.0070 173 PHE B N 3341 C CA . PHE B 95 ? 0.6952 0.5555 0.6088 0.0009 -0.0305 -0.0081 173 PHE B CA 3342 C C . PHE B 95 ? 0.7809 0.6416 0.6893 -0.0023 -0.0322 -0.0088 173 PHE B C 3343 O O . PHE B 95 ? 0.7094 0.5721 0.6174 -0.0038 -0.0350 -0.0067 173 PHE B O 3344 C CB . PHE B 95 ? 0.6877 0.5534 0.6055 0.0041 -0.0308 -0.0056 173 PHE B CB 3345 C CG . PHE B 95 ? 0.6580 0.5267 0.5747 0.0048 -0.0294 -0.0070 173 PHE B CG 3346 C CD1 . PHE B 95 ? 0.7439 0.6139 0.6619 0.0069 -0.0268 -0.0087 173 PHE B CD1 3347 C CD2 . PHE B 95 ? 0.7687 0.6390 0.6832 0.0035 -0.0304 -0.0063 173 PHE B CD2 3348 C CE1 . PHE B 95 ? 0.7859 0.6600 0.7033 0.0068 -0.0254 -0.0101 173 PHE B CE1 3349 C CE2 . PHE B 95 ? 0.7949 0.6672 0.7080 0.0032 -0.0286 -0.0078 173 PHE B CE2 3350 C CZ . PHE B 95 ? 0.7694 0.6443 0.6843 0.0045 -0.0263 -0.0099 173 PHE B CZ 3351 N N . GLU B 96 ? 0.6568 0.5160 0.5612 -0.0029 -0.0304 -0.0113 174 GLU B N 3352 C CA . GLU B 96 ? 0.7952 0.6543 0.6939 -0.0057 -0.0317 -0.0116 174 GLU B CA 3353 C C . GLU B 96 ? 0.8576 0.7187 0.7550 -0.0047 -0.0305 -0.0113 174 GLU B C 3354 O O . GLU B 96 ? 0.9842 0.8462 0.8789 -0.0054 -0.0318 -0.0092 174 GLU B O 3355 C CB . GLU B 96 ? 0.7651 0.6197 0.6581 -0.0087 -0.0309 -0.0151 174 GLU B CB 3356 C CG . GLU B 96 ? 0.7414 0.5934 0.6341 -0.0114 -0.0322 -0.0158 174 GLU B CG 3357 C CD . GLU B 96 ? 0.8957 0.7520 0.7871 -0.0143 -0.0364 -0.0136 174 GLU B CD 3358 O OE1 . GLU B 96 ? 0.8903 0.7508 0.7810 -0.0131 -0.0380 -0.0108 174 GLU B OE1 3359 O OE2 . GLU B 96 ? 0.8076 0.6632 0.6985 -0.0177 -0.0378 -0.0145 174 GLU B OE2 3360 N N . ALA B 97 ? 0.6034 0.4653 0.5027 -0.0031 -0.0276 -0.0131 175 ALA B N 3361 C CA . ALA B 97 ? 0.6339 0.4973 0.5311 -0.0035 -0.0256 -0.0139 175 ALA B CA 3362 C C . ALA B 97 ? 0.7385 0.6053 0.6396 -0.0016 -0.0227 -0.0158 175 ALA B C 3363 O O . ALA B 97 ? 0.8543 0.7206 0.7578 0.0002 -0.0217 -0.0168 175 ALA B O 3364 C CB . ALA B 97 ? 0.5346 0.3946 0.4244 -0.0063 -0.0249 -0.0154 175 ALA B CB 3365 N N . VAL B 98 ? 0.7346 0.6050 0.6361 -0.0022 -0.0211 -0.0163 176 VAL B N 3366 C CA . VAL B 98 ? 0.7451 0.6209 0.6498 -0.0012 -0.0183 -0.0184 176 VAL B CA 3367 C C . VAL B 98 ? 0.8864 0.7600 0.7867 -0.0027 -0.0157 -0.0210 176 VAL B C 3368 O O . VAL B 98 ? 0.9834 0.8533 0.8780 -0.0056 -0.0154 -0.0212 176 VAL B O 3369 C CB . VAL B 98 ? 0.7462 0.6268 0.6521 -0.0027 -0.0176 -0.0184 176 VAL B CB 3370 C CG1 . VAL B 98 ? 0.5537 0.4424 0.4631 -0.0026 -0.0147 -0.0207 176 VAL B CG1 3371 C CG2 . VAL B 98 ? 0.6984 0.5806 0.6076 -0.0014 -0.0198 -0.0160 176 VAL B CG2 3372 N N . GLY B 99 ? 0.7898 0.6656 0.6926 -0.0004 -0.0134 -0.0226 177 GLY B N 3373 C CA . GLY B 99 ? 0.7714 0.6457 0.6703 -0.0015 -0.0103 -0.0252 177 GLY B CA 3374 C C . GLY B 99 ? 0.7941 0.6656 0.6931 0.0013 -0.0081 -0.0267 177 GLY B C 3375 O O . GLY B 99 ? 0.7669 0.6355 0.6681 0.0039 -0.0090 -0.0257 177 GLY B O 3376 N N . TRP B 100 ? 0.6463 0.5179 0.5427 0.0009 -0.0046 -0.0292 178 TRP B N 3377 C CA . TRP B 100 ? 0.8017 0.6705 0.6980 0.0042 -0.0012 -0.0309 178 TRP B CA 3378 C C . TRP B 100 ? 0.9065 0.7656 0.7939 0.0014 0.0000 -0.0335 178 TRP B C 3379 O O . TRP B 100 ? 0.8767 0.7307 0.7622 0.0035 0.0031 -0.0354 178 TRP B O 3380 C CB . TRP B 100 ? 0.7169 0.5949 0.6178 0.0069 0.0028 -0.0317 178 TRP B CB 3381 C CG . TRP B 100 ? 0.7214 0.6022 0.6189 0.0031 0.0047 -0.0336 178 TRP B CG 3382 C CD1 . TRP B 100 ? 0.7156 0.5907 0.6061 0.0013 0.0076 -0.0361 178 TRP B CD1 3383 C CD2 . TRP B 100 ? 0.7395 0.6288 0.6396 0.0003 0.0046 -0.0332 178 TRP B CD2 3384 N NE1 . TRP B 100 ? 0.7825 0.6622 0.6715 -0.0022 0.0092 -0.0369 178 TRP B NE1 3385 C CE2 . TRP B 100 ? 0.8263 0.7144 0.7212 -0.0031 0.0075 -0.0353 178 TRP B CE2 3386 C CE3 . TRP B 100 ? 0.7136 0.6111 0.6196 -0.0001 0.0025 -0.0316 178 TRP B CE3 3387 C CZ2 . TRP B 100 ? 0.8346 0.7287 0.7300 -0.0070 0.0087 -0.0357 178 TRP B CZ2 3388 C CZ3 . TRP B 100 ? 0.7558 0.6593 0.6621 -0.0044 0.0036 -0.0325 178 TRP B CZ3 3389 C CH2 . TRP B 100 ? 0.9170 0.8185 0.8181 -0.0078 0.0068 -0.0345 178 TRP B CH2 3390 N N . SER B 101 ? 0.9043 0.7608 0.7858 -0.0031 -0.0024 -0.0334 179 SER B N 3391 C CA . SER B 101 ? 0.7615 0.6106 0.6338 -0.0064 -0.0019 -0.0357 179 SER B CA 3392 C C . SER B 101 ? 0.7597 0.6059 0.6278 -0.0098 -0.0067 -0.0340 179 SER B C 3393 O O . SER B 101 ? 0.8044 0.6539 0.6730 -0.0110 -0.0088 -0.0315 179 SER B O 3394 C CB . SER B 101 ? 0.8983 0.7496 0.7668 -0.0080 0.0013 -0.0372 179 SER B CB 3395 O OG . SER B 101 ? 1.0521 0.8967 0.9111 -0.0109 0.0023 -0.0396 179 SER B OG 3396 N N . ALA B 102 ? 0.7327 0.5730 0.5967 -0.0114 -0.0081 -0.0352 180 ALA B N 3397 C CA . ALA B 102 ? 0.7391 0.5789 0.6001 -0.0144 -0.0130 -0.0332 180 ALA B CA 3398 C C . ALA B 102 ? 0.7324 0.5674 0.5843 -0.0185 -0.0140 -0.0355 180 ALA B C 3399 O O . ALA B 102 ? 0.8009 0.6303 0.6494 -0.0193 -0.0114 -0.0393 180 ALA B O 3400 C CB . ALA B 102 ? 0.6540 0.4952 0.5217 -0.0129 -0.0158 -0.0307 180 ALA B CB 3401 N N . SER B 103 ? 0.7535 0.5909 0.6015 -0.0209 -0.0178 -0.0332 181 SER B N 3402 C CA . SER B 103 ? 0.7809 0.6168 0.6208 -0.0251 -0.0202 -0.0345 181 SER B CA 3403 C C . SER B 103 ? 0.7714 0.6121 0.6142 -0.0257 -0.0255 -0.0306 181 SER B C 3404 O O . SER B 103 ? 0.6811 0.5256 0.5293 -0.0229 -0.0267 -0.0266 181 SER B O 3405 C CB . SER B 103 ? 0.8113 0.6475 0.6427 -0.0266 -0.0192 -0.0346 181 SER B CB 3406 O OG . SER B 103 ? 0.8819 0.7188 0.7052 -0.0306 -0.0224 -0.0352 181 SER B OG 3407 N N . SER B 104 ? 0.5882 0.4292 0.4276 -0.0295 -0.0285 -0.0318 182 SER B N 3408 C CA . SER B 104 ? 0.7506 0.5982 0.5927 -0.0301 -0.0336 -0.0277 182 SER B CA 3409 C C . SER B 104 ? 0.7385 0.5896 0.5739 -0.0352 -0.0373 -0.0287 182 SER B C 3410 O O . SER B 104 ? 0.8349 0.6818 0.6637 -0.0393 -0.0360 -0.0336 182 SER B O 3411 C CB . SER B 104 ? 0.7981 0.6461 0.6497 -0.0282 -0.0342 -0.0264 182 SER B CB 3412 O OG . SER B 104 ? 0.9231 0.7652 0.7746 -0.0305 -0.0323 -0.0307 182 SER B OG 3413 N N . CYS B 105 ? 0.6157 0.4750 0.4526 -0.0348 -0.0418 -0.0240 183 CYS B N 3414 C CA . CYS B 105 ? 0.6789 0.5448 0.5108 -0.0395 -0.0461 -0.0242 183 CYS B CA 3415 C C . CYS B 105 ? 0.7411 0.6168 0.5784 -0.0377 -0.0506 -0.0183 183 CYS B C 3416 O O . CYS B 105 ? 0.9251 0.8020 0.7667 -0.0324 -0.0502 -0.0135 183 CYS B O 3417 C CB . CYS B 105 ? 0.6054 0.4725 0.4263 -0.0413 -0.0463 -0.0249 183 CYS B CB 3418 S SG . CYS B 105 ? 0.8364 0.7024 0.6546 -0.0356 -0.0440 -0.0201 183 CYS B SG 3419 N N . HIS B 106 ? 0.7519 0.6349 0.5889 -0.0423 -0.0546 -0.0189 184 HIS B N 3420 C CA . HIS B 106 ? 0.6804 0.5746 0.5229 -0.0407 -0.0590 -0.0133 184 HIS B CA 3421 C C . HIS B 106 ? 0.7321 0.6372 0.5679 -0.0417 -0.0631 -0.0102 184 HIS B C 3422 O O . HIS B 106 ? 0.7840 0.6903 0.6114 -0.0470 -0.0641 -0.0141 184 HIS B O 3423 C CB . HIS B 106 ? 0.6510 0.5475 0.4994 -0.0451 -0.0605 -0.0155 184 HIS B CB 3424 C CG . HIS B 106 ? 0.7786 0.6848 0.6356 -0.0422 -0.0636 -0.0098 184 HIS B CG 3425 N ND1 . HIS B 106 ? 0.7572 0.6775 0.6139 -0.0427 -0.0684 -0.0055 184 HIS B ND1 3426 C CD2 . HIS B 106 ? 0.6621 0.5663 0.5281 -0.0385 -0.0623 -0.0074 184 HIS B CD2 3427 C CE1 . HIS B 106 ? 0.8197 0.7460 0.6852 -0.0392 -0.0696 -0.0007 184 HIS B CE1 3428 N NE2 . HIS B 106 ? 0.6987 0.6152 0.5696 -0.0367 -0.0660 -0.0019 184 HIS B NE2 3429 N N . ASP B 107 ? 0.7886 0.7017 0.6275 -0.0364 -0.0652 -0.0030 185 ASP B N 3430 C CA . ASP B 107 ? 0.7081 0.6320 0.5406 -0.0356 -0.0688 0.0014 185 ASP B CA 3431 C C . ASP B 107 ? 0.7908 0.7309 0.6275 -0.0375 -0.0744 0.0046 185 ASP B C 3432 O O . ASP B 107 ? 0.8567 0.8086 0.6888 -0.0366 -0.0780 0.0088 185 ASP B O 3433 C CB . ASP B 107 ? 0.7040 0.6254 0.5349 -0.0277 -0.0666 0.0078 185 ASP B CB 3434 C CG . ASP B 107 ? 0.9534 0.8751 0.7938 -0.0217 -0.0659 0.0130 185 ASP B CG 3435 O OD1 . ASP B 107 ? 0.9757 0.8999 0.8244 -0.0233 -0.0671 0.0117 185 ASP B OD1 3436 O OD2 . ASP B 107 ? 0.9028 0.8213 0.7419 -0.0154 -0.0636 0.0182 185 ASP B OD2 3437 N N . GLY B 108 ? 0.8153 0.7567 0.6606 -0.0399 -0.0750 0.0029 186 GLY B N 3438 C CA . GLY B 108 ? 0.7710 0.7283 0.6222 -0.0413 -0.0798 0.0063 186 GLY B CA 3439 C C . GLY B 108 ? 0.9077 0.8669 0.7688 -0.0341 -0.0790 0.0126 186 GLY B C 3440 O O . GLY B 108 ? 0.9421 0.9125 0.8105 -0.0349 -0.0819 0.0151 186 GLY B O 3441 N N . PHE B 109 ? 0.9135 0.8615 0.7743 -0.0274 -0.0749 0.0149 187 PHE B N 3442 C CA . PHE B 109 ? 0.7702 0.7179 0.6389 -0.0203 -0.0733 0.0204 187 PHE B CA 3443 C C . PHE B 109 ? 0.7936 0.7276 0.6668 -0.0194 -0.0689 0.0170 187 PHE B C 3444 O O . PHE B 109 ? 0.7228 0.6577 0.6041 -0.0176 -0.0685 0.0185 187 PHE B O 3445 C CB . PHE B 109 ? 0.5730 0.5196 0.4372 -0.0127 -0.0718 0.0267 187 PHE B CB 3446 C CG . PHE B 109 ? 0.6843 0.6440 0.5431 -0.0120 -0.0756 0.0311 187 PHE B CG 3447 C CD1 . PHE B 109 ? 0.7176 0.6946 0.5814 -0.0124 -0.0804 0.0348 187 PHE B CD1 3448 C CD2 . PHE B 109 ? 0.8172 0.7731 0.6659 -0.0105 -0.0745 0.0320 187 PHE B CD2 3449 C CE1 . PHE B 109 ? 0.8187 0.8102 0.6775 -0.0113 -0.0843 0.0394 187 PHE B CE1 3450 C CE2 . PHE B 109 ? 0.8214 0.7902 0.6645 -0.0092 -0.0782 0.0368 187 PHE B CE2 3451 C CZ . PHE B 109 ? 0.6494 0.6366 0.4976 -0.0095 -0.0833 0.0405 187 PHE B CZ 3452 N N . GLN B 110 ? 0.8820 0.8041 0.7497 -0.0204 -0.0656 0.0128 188 GLN B N 3453 C CA . GLN B 110 ? 0.7820 0.6925 0.6533 -0.0181 -0.0613 0.0107 188 GLN B CA 3454 C C . GLN B 110 ? 0.8211 0.7217 0.6871 -0.0217 -0.0585 0.0043 188 GLN B C 3455 O O . GLN B 110 ? 0.9097 0.8104 0.7677 -0.0244 -0.0590 0.0024 188 GLN B O 3456 C CB . GLN B 110 ? 0.8072 0.7141 0.6780 -0.0111 -0.0587 0.0157 188 GLN B CB 3457 C CG . GLN B 110 ? 1.0042 0.9079 0.8827 -0.0074 -0.0565 0.0174 188 GLN B CG 3458 C CD . GLN B 110 ? 0.8757 0.7888 0.7618 -0.0072 -0.0595 0.0201 188 GLN B CD 3459 O OE1 . GLN B 110 ? 0.7280 0.6498 0.6152 -0.0039 -0.0614 0.0257 188 GLN B OE1 3460 N NE2 . GLN B 110 ? 0.8154 0.7268 0.7069 -0.0103 -0.0594 0.0165 188 GLN B NE2 3461 N N . TRP B 111 ? 0.9014 0.7940 0.7718 -0.0216 -0.0554 0.0011 189 TRP B N 3462 C CA . TRP B 111 ? 0.7471 0.6304 0.6133 -0.0232 -0.0519 -0.0040 189 TRP B CA 3463 C C . TRP B 111 ? 0.7599 0.6385 0.6227 -0.0193 -0.0489 -0.0023 189 TRP B C 3464 O O . TRP B 111 ? 0.9442 0.8222 0.8109 -0.0150 -0.0477 0.0011 189 TRP B O 3465 C CB . TRP B 111 ? 0.6011 0.4782 0.4730 -0.0237 -0.0494 -0.0074 189 TRP B CB 3466 C CG . TRP B 111 ? 0.7099 0.5877 0.5824 -0.0289 -0.0508 -0.0107 189 TRP B CG 3467 C CD1 . TRP B 111 ? 0.5583 0.4401 0.4371 -0.0301 -0.0527 -0.0094 189 TRP B CD1 3468 C CD2 . TRP B 111 ? 0.9967 0.8702 0.8626 -0.0343 -0.0500 -0.0162 189 TRP B CD2 3469 N NE1 . TRP B 111 ? 0.7614 0.6415 0.6381 -0.0363 -0.0529 -0.0139 189 TRP B NE1 3470 C CE2 . TRP B 111 ? 1.0360 0.9105 0.9044 -0.0389 -0.0512 -0.0182 189 TRP B CE2 3471 C CE3 . TRP B 111 ? 0.9981 0.8665 0.8559 -0.0357 -0.0479 -0.0198 189 TRP B CE3 3472 C CZ2 . TRP B 111 ? 1.0189 0.8887 0.8814 -0.0453 -0.0503 -0.0240 189 TRP B CZ2 3473 C CZ3 . TRP B 111 ? 0.9614 0.8256 0.8134 -0.0416 -0.0471 -0.0254 189 TRP B CZ3 3474 C CH2 . TRP B 111 ? 0.8781 0.7425 0.7323 -0.0464 -0.0482 -0.0276 189 TRP B CH2 3475 N N . THR B 112 ? 0.6465 0.5219 0.5016 -0.0212 -0.0475 -0.0050 190 THR B N 3476 C CA . THR B 112 ? 0.6394 0.5088 0.4909 -0.0190 -0.0437 -0.0051 190 THR B CA 3477 C C . THR B 112 ? 0.8086 0.6714 0.6616 -0.0204 -0.0401 -0.0106 190 THR B C 3478 O O . THR B 112 ? 0.7809 0.6417 0.6307 -0.0240 -0.0399 -0.0150 190 THR B O 3479 C CB . THR B 112 ? 0.7126 0.5828 0.5541 -0.0204 -0.0440 -0.0046 190 THR B CB 3480 O OG1 . THR B 112 ? 0.7223 0.5997 0.5621 -0.0183 -0.0473 0.0012 190 THR B OG1 3481 C CG2 . THR B 112 ? 0.6902 0.5536 0.5279 -0.0187 -0.0393 -0.0050 190 THR B CG2 3482 N N . VAL B 113 ? 0.6536 0.5132 0.5111 -0.0174 -0.0370 -0.0104 191 VAL B N 3483 C CA . VAL B 113 ? 0.6212 0.4764 0.4808 -0.0177 -0.0334 -0.0147 191 VAL B CA 3484 C C . VAL B 113 ? 0.7179 0.5704 0.5752 -0.0165 -0.0295 -0.0152 191 VAL B C 3485 O O . VAL B 113 ? 0.8373 0.6904 0.6966 -0.0145 -0.0287 -0.0124 191 VAL B O 3486 C CB . VAL B 113 ? 0.5749 0.4305 0.4433 -0.0157 -0.0333 -0.0147 191 VAL B CB 3487 C CG1 . VAL B 113 ? 0.5894 0.4417 0.4601 -0.0146 -0.0293 -0.0181 191 VAL B CG1 3488 C CG2 . VAL B 113 ? 0.5882 0.4450 0.4584 -0.0179 -0.0361 -0.0152 191 VAL B CG2 3489 N N . LEU B 114 ? 0.7222 0.5717 0.5749 -0.0182 -0.0268 -0.0190 192 LEU B N 3490 C CA . LEU B 114 ? 0.6126 0.4604 0.4635 -0.0178 -0.0227 -0.0200 192 LEU B CA 3491 C C . LEU B 114 ? 0.7825 0.6303 0.6396 -0.0164 -0.0195 -0.0230 192 LEU B C 3492 O O . LEU B 114 ? 0.7667 0.6126 0.6238 -0.0167 -0.0185 -0.0262 192 LEU B O 3493 C CB . LEU B 114 ? 0.5656 0.4111 0.4070 -0.0202 -0.0213 -0.0217 192 LEU B CB 3494 C CG . LEU B 114 ? 0.7784 0.6250 0.6130 -0.0208 -0.0239 -0.0178 192 LEU B CG 3495 C CD1 . LEU B 114 ? 0.8023 0.6505 0.6321 -0.0234 -0.0276 -0.0190 192 LEU B CD1 3496 C CD2 . LEU B 114 ? 0.7075 0.5513 0.5351 -0.0212 -0.0204 -0.0172 192 LEU B CD2 3497 N N . SER B 115 ? 0.8810 0.7311 0.7428 -0.0148 -0.0177 -0.0220 193 SER B N 3498 C CA . SER B 115 ? 0.8024 0.6552 0.6712 -0.0129 -0.0153 -0.0240 193 SER B CA 3499 C C . SER B 115 ? 0.8661 0.7213 0.7353 -0.0135 -0.0114 -0.0251 193 SER B C 3500 O O . SER B 115 ? 0.8904 0.7452 0.7571 -0.0149 -0.0109 -0.0234 193 SER B O 3501 C CB . SER B 115 ? 0.8417 0.6973 0.7179 -0.0107 -0.0176 -0.0218 193 SER B CB 3502 O OG . SER B 115 ? 1.1262 0.9845 1.0085 -0.0083 -0.0160 -0.0234 193 SER B OG 3503 N N . VAL B 116 ? 0.8692 0.7269 0.7414 -0.0123 -0.0083 -0.0279 194 VAL B N 3504 C CA . VAL B 116 ? 0.8787 0.7411 0.7528 -0.0130 -0.0045 -0.0292 194 VAL B CA 3505 C C . VAL B 116 ? 0.9135 0.7837 0.7969 -0.0108 -0.0044 -0.0289 194 VAL B C 3506 O O . VAL B 116 ? 0.8324 0.7048 0.7206 -0.0074 -0.0047 -0.0293 194 VAL B O 3507 C CB . VAL B 116 ? 0.8308 0.6931 0.7022 -0.0130 -0.0006 -0.0323 194 VAL B CB 3508 C CG1 . VAL B 116 ? 0.6855 0.5542 0.5594 -0.0143 0.0034 -0.0335 194 VAL B CG1 3509 C CG2 . VAL B 116 ? 0.8894 0.7446 0.7509 -0.0153 -0.0007 -0.0329 194 VAL B CG2 3510 N N . ALA B 117 ? 0.9610 0.8351 0.8462 -0.0127 -0.0036 -0.0284 195 ALA B N 3511 C CA . ALA B 117 ? 0.8006 0.6835 0.6938 -0.0114 -0.0037 -0.0284 195 ALA B CA 3512 C C . ALA B 117 ? 0.8542 0.7434 0.7485 -0.0149 -0.0003 -0.0301 195 ALA B C 3513 O O . ALA B 117 ? 0.8331 0.7186 0.7216 -0.0182 0.0024 -0.0311 195 ALA B O 3514 C CB . ALA B 117 ? 0.7106 0.5921 0.6056 -0.0108 -0.0072 -0.0259 195 ALA B CB 3515 N N . GLY B 118 ? 0.9044 0.8033 0.8055 -0.0147 -0.0003 -0.0306 196 GLY B N 3516 C CA . GLY B 118 ? 1.0692 0.9752 0.9716 -0.0191 0.0026 -0.0325 196 GLY B CA 3517 C C . GLY B 118 ? 1.1719 1.0840 1.0753 -0.0199 0.0066 -0.0348 196 GLY B C 3518 O O . GLY B 118 ? 1.1895 1.1089 1.0982 -0.0157 0.0071 -0.0352 196 GLY B O 3519 N N . ASP B 119 ? 1.2041 1.1133 1.1025 -0.0250 0.0098 -0.0362 200 ASP B N 3520 C CA . ASP B 119 ? 1.3334 1.2476 1.2319 -0.0261 0.0140 -0.0383 200 ASP B CA 3521 C C . ASP B 119 ? 1.3829 1.2862 1.2738 -0.0244 0.0147 -0.0378 200 ASP B C 3522 O O . ASP B 119 ? 1.4191 1.3248 1.3094 -0.0238 0.0180 -0.0394 200 ASP B O 3523 C CB . ASP B 119 ? 1.4104 1.3278 1.3075 -0.0330 0.0179 -0.0402 200 ASP B CB 3524 C CG . ASP B 119 ? 1.5120 1.4180 1.4020 -0.0372 0.0175 -0.0390 200 ASP B CG 3525 O OD1 . ASP B 119 ? 1.5271 1.4222 1.4122 -0.0345 0.0146 -0.0365 200 ASP B OD1 3526 O OD2 . ASP B 119 ? 1.5340 1.4420 1.4234 -0.0432 0.0204 -0.0407 200 ASP B OD2 3527 N N . GLY B 120 ? 1.3038 1.1958 1.1889 -0.0238 0.0116 -0.0357 201 GLY B N 3528 C CA . GLY B 120 ? 1.2262 1.1088 1.1040 -0.0224 0.0112 -0.0352 201 GLY B CA 3529 C C . GLY B 120 ? 1.2296 1.1017 1.0980 -0.0252 0.0106 -0.0332 201 GLY B C 3530 O O . GLY B 120 ? 1.3442 1.2113 1.2053 -0.0265 0.0127 -0.0336 201 GLY B O 3531 N N . PHE B 121 ? 1.1007 0.9695 0.9689 -0.0258 0.0082 -0.0309 202 PHE B N 3532 C CA . PHE B 121 ? 0.9181 0.7769 0.7777 -0.0265 0.0069 -0.0280 202 PHE B CA 3533 C C . PHE B 121 ? 0.8751 0.7315 0.7347 -0.0229 0.0021 -0.0263 202 PHE B C 3534 O O . PHE B 121 ? 0.8444 0.7054 0.7107 -0.0203 0.0002 -0.0274 202 PHE B O 3535 C CB . PHE B 121 ? 0.8706 0.7264 0.7296 -0.0285 0.0074 -0.0261 202 PHE B CB 3536 C CG . PHE B 121 ? 0.8330 0.6934 0.6997 -0.0267 0.0044 -0.0259 202 PHE B CG 3537 C CD1 . PHE B 121 ? 0.7403 0.6098 0.6143 -0.0281 0.0057 -0.0284 202 PHE B CD1 3538 C CD2 . PHE B 121 ? 0.9537 0.8106 0.8204 -0.0235 0.0002 -0.0230 202 PHE B CD2 3539 C CE1 . PHE B 121 ? 0.8027 0.6770 0.6831 -0.0262 0.0028 -0.0280 202 PHE B CE1 3540 C CE2 . PHE B 121 ? 0.9031 0.7641 0.7764 -0.0218 -0.0023 -0.0227 202 PHE B CE2 3541 C CZ . PHE B 121 ? 0.8093 0.6786 0.6891 -0.0230 -0.0010 -0.0252 202 PHE B CZ 3542 N N . VAL B 122 ? 0.7803 0.6299 0.6325 -0.0227 0.0002 -0.0237 203 VAL B N 3543 C CA . VAL B 122 ? 0.8598 0.7086 0.7130 -0.0201 -0.0046 -0.0222 203 VAL B CA 3544 C C . VAL B 122 ? 0.7673 0.6135 0.6201 -0.0190 -0.0072 -0.0181 203 VAL B C 3545 O O . VAL B 122 ? 0.7513 0.5931 0.5989 -0.0200 -0.0054 -0.0157 203 VAL B O 3546 C CB . VAL B 122 ? 0.7954 0.6417 0.6423 -0.0202 -0.0058 -0.0230 203 VAL B CB 3547 C CG1 . VAL B 122 ? 0.7427 0.5894 0.5868 -0.0217 -0.0015 -0.0264 203 VAL B CG1 3548 C CG2 . VAL B 122 ? 0.8140 0.6561 0.6529 -0.0205 -0.0080 -0.0194 203 VAL B CG2 3549 N N . SER B 123 ? 0.7337 0.5823 0.5920 -0.0167 -0.0110 -0.0173 204 SER B N 3550 C CA . SER B 123 ? 0.8943 0.7413 0.7526 -0.0151 -0.0137 -0.0133 204 SER B CA 3551 C C . SER B 123 ? 0.8829 0.7299 0.7385 -0.0141 -0.0177 -0.0116 204 SER B C 3552 O O . SER B 123 ? 0.7867 0.6354 0.6438 -0.0144 -0.0192 -0.0141 204 SER B O 3553 C CB . SER B 123 ? 0.7653 0.6158 0.6319 -0.0135 -0.0150 -0.0133 204 SER B CB 3554 O OG . SER B 123 ? 0.8606 0.7144 0.7311 -0.0148 -0.0120 -0.0162 204 SER B OG 3555 N N . ILE B 124 ? 0.6501 0.4952 0.5016 -0.0129 -0.0193 -0.0074 205 ILE B N 3556 C CA . ILE B 124 ? 0.7039 0.5515 0.5541 -0.0121 -0.0237 -0.0054 205 ILE B CA 3557 C C . ILE B 124 ? 0.7885 0.6386 0.6449 -0.0096 -0.0263 -0.0024 205 ILE B C 3558 O O . ILE B 124 ? 0.8129 0.6610 0.6695 -0.0077 -0.0250 0.0006 205 ILE B O 3559 C CB . ILE B 124 ? 0.7092 0.5552 0.5503 -0.0121 -0.0241 -0.0022 205 ILE B CB 3560 C CG1 . ILE B 124 ? 0.7314 0.5747 0.5663 -0.0147 -0.0209 -0.0053 205 ILE B CG1 3561 C CG2 . ILE B 124 ? 0.7111 0.5623 0.5513 -0.0120 -0.0290 -0.0006 205 ILE B CG2 3562 C CD1 . ILE B 124 ? 0.7455 0.5858 0.5706 -0.0145 -0.0197 -0.0019 205 ILE B CD1 3563 N N . LEU B 125 ? 0.7143 0.5683 0.5756 -0.0098 -0.0295 -0.0036 206 LEU B N 3564 C CA . LEU B 125 ? 0.6711 0.5284 0.5380 -0.0077 -0.0322 -0.0007 206 LEU B CA 3565 C C . LEU B 125 ? 0.7476 0.6095 0.6129 -0.0081 -0.0364 0.0016 206 LEU B C 3566 O O . LEU B 125 ? 0.8184 0.6816 0.6814 -0.0110 -0.0379 -0.0012 206 LEU B O 3567 C CB . LEU B 125 ? 0.7371 0.5959 0.6118 -0.0075 -0.0323 -0.0032 206 LEU B CB 3568 C CG . LEU B 125 ? 0.7052 0.5624 0.5831 -0.0067 -0.0289 -0.0047 206 LEU B CG 3569 C CD1 . LEU B 125 ? 0.6909 0.5480 0.5697 -0.0082 -0.0269 -0.0091 206 LEU B CD1 3570 C CD2 . LEU B 125 ? 0.7913 0.6509 0.6760 -0.0046 -0.0299 -0.0033 206 LEU B CD2 3571 N N . TYR B 126 ? 0.6547 0.5195 0.5212 -0.0053 -0.0381 0.0064 207 TYR B N 3572 C CA . TYR B 126 ? 0.6521 0.5237 0.5178 -0.0054 -0.0423 0.0093 207 TYR B CA 3573 C C . TYR B 126 ? 0.7340 0.6100 0.6074 -0.0032 -0.0441 0.0120 207 TYR B C 3574 O O . TYR B 126 ? 0.8915 0.7658 0.7668 0.0005 -0.0424 0.0152 207 TYR B O 3575 C CB . TYR B 126 ? 0.7259 0.5980 0.5845 -0.0031 -0.0421 0.0139 207 TYR B CB 3576 C CG . TYR B 126 ? 0.6373 0.5185 0.4937 -0.0034 -0.0466 0.0170 207 TYR B CG 3577 C CD1 . TYR B 126 ? 0.6163 0.5006 0.4680 -0.0078 -0.0489 0.0139 207 TYR B CD1 3578 C CD2 . TYR B 126 ? 0.6403 0.5276 0.4992 0.0007 -0.0484 0.0230 207 TYR B CD2 3579 C CE1 . TYR B 126 ? 0.6632 0.5577 0.5127 -0.0087 -0.0534 0.0165 207 TYR B CE1 3580 C CE2 . TYR B 126 ? 0.6887 0.5868 0.5461 0.0006 -0.0528 0.0262 207 TYR B CE2 3581 C CZ . TYR B 126 ? 0.6892 0.5915 0.5420 -0.0045 -0.0555 0.0228 207 TYR B CZ 3582 O OH . TYR B 126 ? 0.7514 0.6660 0.6027 -0.0052 -0.0602 0.0258 207 TYR B OH 3583 N N . GLY B 127 ? 0.7162 0.5975 0.5938 -0.0057 -0.0472 0.0105 208 GLY B N 3584 C CA . GLY B 127 ? 0.6923 0.5756 0.5780 -0.0045 -0.0477 0.0112 208 GLY B CA 3585 C C . GLY B 127 ? 0.8758 0.7521 0.7631 -0.0046 -0.0443 0.0074 208 GLY B C 3586 O O . GLY B 127 ? 1.2374 1.1100 1.1217 -0.0072 -0.0430 0.0033 208 GLY B O 3587 N N . GLY B 128 ? 0.6672 0.5421 0.5590 -0.0018 -0.0426 0.0087 209 GLY B N 3588 C CA . GLY B 128 ? 0.6712 0.5411 0.5637 -0.0016 -0.0393 0.0055 209 GLY B CA 3589 C C . GLY B 128 ? 0.8038 0.6699 0.6930 0.0003 -0.0364 0.0070 209 GLY B C 3590 O O . GLY B 128 ? 0.9298 0.7935 0.8207 0.0006 -0.0338 0.0051 209 GLY B O 3591 N N . ILE B 129 ? 0.7354 0.6013 0.6197 0.0016 -0.0367 0.0104 210 ILE B N 3592 C CA . ILE B 129 ? 0.6553 0.5156 0.5353 0.0034 -0.0331 0.0121 210 ILE B CA 3593 C C . ILE B 129 ? 0.8321 0.6877 0.7056 0.0010 -0.0306 0.0097 210 ILE B C 3594 O O . ILE B 129 ? 0.8954 0.7523 0.7646 -0.0004 -0.0320 0.0096 210 ILE B O 3595 C CB . ILE B 129 ? 0.7299 0.5914 0.6075 0.0071 -0.0338 0.0180 210 ILE B CB 3596 C CG1 . ILE B 129 ? 0.6575 0.5246 0.5418 0.0095 -0.0362 0.0206 210 ILE B CG1 3597 C CG2 . ILE B 129 ? 0.7450 0.5982 0.6172 0.0092 -0.0291 0.0199 210 ILE B CG2 3598 C CD1 . ILE B 129 ? 0.7373 0.6062 0.6201 0.0142 -0.0361 0.0269 210 ILE B CD1 3599 N N . ILE B 130 ? 0.7659 0.6165 0.6384 0.0002 -0.0266 0.0077 211 ILE B N 3600 C CA . ILE B 130 ? 0.8014 0.6475 0.6677 -0.0021 -0.0235 0.0058 211 ILE B CA 3601 C C . ILE B 130 ? 0.8858 0.7278 0.7443 -0.0003 -0.0224 0.0103 211 ILE B C 3602 O O . ILE B 130 ? 0.7879 0.6261 0.6449 0.0026 -0.0206 0.0140 211 ILE B O 3603 C CB . ILE B 130 ? 0.7566 0.5992 0.6235 -0.0040 -0.0193 0.0028 211 ILE B CB 3604 C CG1 . ILE B 130 ? 0.8203 0.6684 0.6941 -0.0055 -0.0204 -0.0015 211 ILE B CG1 3605 C CG2 . ILE B 130 ? 0.7221 0.5594 0.5819 -0.0065 -0.0154 0.0017 211 ILE B CG2 3606 C CD1 . ILE B 130 ? 0.6667 0.5166 0.5394 -0.0077 -0.0204 -0.0047 211 ILE B CD1 3607 N N . THR B 131 ? 0.8346 0.6772 0.6878 -0.0017 -0.0232 0.0100 212 THR B N 3608 C CA . THR B 131 ? 0.7155 0.5557 0.5610 0.0004 -0.0227 0.0147 212 THR B CA 3609 C C . THR B 131 ? 0.7445 0.5782 0.5819 -0.0017 -0.0184 0.0137 212 THR B C 3610 O O . THR B 131 ? 0.8586 0.6883 0.6887 0.0006 -0.0167 0.0182 212 THR B O 3611 C CB . THR B 131 ? 0.8375 0.6856 0.6822 0.0011 -0.0279 0.0169 212 THR B CB 3612 O OG1 . THR B 131 ? 0.9070 0.7587 0.7537 -0.0028 -0.0300 0.0117 212 THR B OG1 3613 C CG2 . THR B 131 ? 0.7231 0.5770 0.5737 0.0043 -0.0312 0.0204 212 THR B CG2 3614 N N . ASP B 132 ? 0.6337 0.4666 0.4726 -0.0056 -0.0165 0.0083 213 ASP B N 3615 C CA . ASP B 132 ? 0.7000 0.5278 0.5320 -0.0082 -0.0122 0.0069 213 ASP B CA 3616 C C . ASP B 132 ? 0.7782 0.6076 0.6144 -0.0120 -0.0103 0.0007 213 ASP B C 3617 O O . ASP B 132 ? 0.7658 0.6011 0.6090 -0.0124 -0.0131 -0.0023 213 ASP B O 3618 C CB . ASP B 132 ? 0.9699 0.7996 0.7949 -0.0080 -0.0143 0.0086 213 ASP B CB 3619 C CG . ASP B 132 ? 1.2111 1.0336 1.0261 -0.0076 -0.0100 0.0117 213 ASP B CG 3620 O OD1 . ASP B 132 ? 1.2820 1.0984 1.0955 -0.0102 -0.0048 0.0096 213 ASP B OD1 3621 O OD2 . ASP B 132 ? 1.1670 0.9904 0.9757 -0.0050 -0.0118 0.0165 213 ASP B OD2 3622 N N . THR B 133 ? 0.6742 0.4990 0.5064 -0.0148 -0.0053 -0.0009 214 THR B N 3623 C CA . THR B 133 ? 0.7961 0.6243 0.6314 -0.0182 -0.0034 -0.0063 214 THR B CA 3624 C C . THR B 133 ? 0.9297 0.7554 0.7572 -0.0203 -0.0007 -0.0069 214 THR B C 3625 O O . THR B 133 ? 0.8919 0.7120 0.7110 -0.0194 0.0006 -0.0031 214 THR B O 3626 C CB . THR B 133 ? 0.7657 0.5940 0.6058 -0.0209 0.0002 -0.0092 214 THR B CB 3627 O OG1 . THR B 133 ? 0.9269 0.7467 0.7605 -0.0223 0.0049 -0.0071 214 THR B OG1 3628 C CG2 . THR B 133 ? 0.5790 0.4115 0.4272 -0.0190 -0.0027 -0.0094 214 THR B CG2 3629 N N . ILE B 134 ? 0.9363 0.7662 0.7663 -0.0225 0.0004 -0.0115 215 ILE B N 3630 C CA . ILE B 134 ? 0.8886 0.7166 0.7117 -0.0247 0.0035 -0.0127 215 ILE B CA 3631 C C . ILE B 134 ? 0.9618 0.7931 0.7893 -0.0278 0.0078 -0.0172 215 ILE B C 3632 O O . ILE B 134 ? 0.8320 0.6698 0.6683 -0.0274 0.0066 -0.0201 215 ILE B O 3633 C CB . ILE B 134 ? 0.8791 0.7098 0.6996 -0.0238 0.0002 -0.0139 215 ILE B CB 3634 C CG1 . ILE B 134 ? 0.7383 0.5671 0.5524 -0.0216 -0.0035 -0.0092 215 ILE B CG1 3635 C CG2 . ILE B 134 ? 0.8597 0.6898 0.6748 -0.0262 0.0040 -0.0167 215 ILE B CG2 3636 C CD1 . ILE B 134 ? 0.8110 0.6438 0.6242 -0.0214 -0.0078 -0.0108 215 ILE B CD1 3637 N N . HIS B 135 ? 1.0349 0.8624 0.8565 -0.0308 0.0130 -0.0174 216 HIS B N 3638 C CA . HIS B 135 ? 1.1018 0.9340 0.9282 -0.0344 0.0174 -0.0214 216 HIS B CA 3639 C C . HIS B 135 ? 1.0741 0.9071 0.8960 -0.0365 0.0211 -0.0236 216 HIS B C 3640 O O . HIS B 135 ? 1.0278 0.8547 0.8400 -0.0365 0.0223 -0.0214 216 HIS B O 3641 C CB . HIS B 135 ? 1.1080 0.9362 0.9341 -0.0377 0.0213 -0.0208 216 HIS B CB 3642 C CG . HIS B 135 ? 1.2910 1.1182 1.1213 -0.0359 0.0184 -0.0192 216 HIS B CG 3643 N ND1 . HIS B 135 ? 1.3806 1.2158 1.2206 -0.0360 0.0166 -0.0219 216 HIS B ND1 3644 C CD2 . HIS B 135 ? 1.3329 1.1522 1.1587 -0.0335 0.0172 -0.0148 216 HIS B CD2 3645 C CE1 . HIS B 135 ? 1.4158 1.2477 1.2569 -0.0342 0.0144 -0.0196 216 HIS B CE1 3646 N NE2 . HIS B 135 ? 1.3910 1.2134 1.2239 -0.0325 0.0149 -0.0154 216 HIS B NE2 3647 N N . PRO B 136 ? 0.8998 0.7412 0.7287 -0.0378 0.0232 -0.0278 217 PRO B N 3648 C CA . PRO B 136 ? 0.9810 0.8244 0.8069 -0.0398 0.0277 -0.0302 217 PRO B CA 3649 C C . PRO B 136 ? 1.1913 1.0309 1.0123 -0.0447 0.0336 -0.0298 217 PRO B C 3650 O O . PRO B 136 ? 1.2888 1.1279 1.1125 -0.0475 0.0352 -0.0295 217 PRO B O 3651 C CB . PRO B 136 ? 0.9064 0.7613 0.7432 -0.0390 0.0280 -0.0341 217 PRO B CB 3652 C CG . PRO B 136 ? 0.8531 0.7122 0.6981 -0.0386 0.0253 -0.0338 217 PRO B CG 3653 C CD . PRO B 136 ? 0.9113 0.7617 0.7517 -0.0366 0.0211 -0.0301 217 PRO B CD 3654 N N . THR B 137 ? 1.2525 1.0892 1.0658 -0.0461 0.0373 -0.0299 218 THR B N 3655 C CA . THR B 137 ? 1.3937 1.2275 1.2026 -0.0511 0.0439 -0.0300 218 THR B CA 3656 C C . THR B 137 ? 1.2737 1.1152 1.0847 -0.0527 0.0479 -0.0336 218 THR B C 3657 O O . THR B 137 ? 1.3586 1.2004 1.1676 -0.0573 0.0539 -0.0346 218 THR B O 3658 C CB . THR B 137 ? 1.5568 1.3781 1.3525 -0.0513 0.0456 -0.0254 218 THR B CB 3659 O OG1 . THR B 137 ? 1.4048 1.2230 1.1959 -0.0464 0.0400 -0.0228 218 THR B OG1 3660 C CG2 . THR B 137 ? 1.6610 1.4743 1.4546 -0.0538 0.0479 -0.0228 218 THR B CG2 3661 N N . ASN B 138 ? 1.2057 1.0532 1.0209 -0.0487 0.0450 -0.0358 219 ASN B N 3662 C CA . ASN B 138 ? 1.2173 1.0724 1.0350 -0.0490 0.0491 -0.0392 219 ASN B CA 3663 C C . ASN B 138 ? 1.0977 0.9661 0.9289 -0.0473 0.0485 -0.0423 219 ASN B C 3664 O O . ASN B 138 ? 1.1433 1.0186 0.9777 -0.0456 0.0512 -0.0449 219 ASN B O 3665 C CB . ASN B 138 ? 1.1718 1.0221 0.9809 -0.0462 0.0486 -0.0395 219 ASN B CB 3666 C CG . ASN B 138 ? 1.3445 1.1850 1.1402 -0.0486 0.0513 -0.0367 219 ASN B CG 3667 O OD1 . ASN B 138 ? 1.5460 1.3795 1.3331 -0.0466 0.0479 -0.0344 219 ASN B OD1 3668 N ND2 . ASN B 138 ? 1.3790 1.2197 1.1728 -0.0532 0.0575 -0.0368 219 ASN B ND2 3669 N N . GLY B 139 ? 1.0447 0.9167 0.8834 -0.0473 0.0453 -0.0418 220 GLY B N 3670 C CA . GLY B 139 ? 1.0696 0.9558 0.9209 -0.0465 0.0454 -0.0443 220 GLY B CA 3671 C C . GLY B 139 ? 1.1258 1.0162 0.9843 -0.0407 0.0403 -0.0443 220 GLY B C 3672 O O . GLY B 139 ? 1.3519 1.2545 1.2209 -0.0396 0.0399 -0.0455 220 GLY B O 3673 N N . GLY B 140 ? 0.9521 0.8334 0.8052 -0.0370 0.0365 -0.0429 221 GLY B N 3674 C CA . GLY B 140 ? 0.8456 0.7286 0.7046 -0.0321 0.0316 -0.0425 221 GLY B CA 3675 C C . GLY B 140 ? 0.7852 0.6773 0.6520 -0.0276 0.0329 -0.0445 221 GLY B C 3676 O O . GLY B 140 ? 0.9889 0.8880 0.8578 -0.0280 0.0377 -0.0464 221 GLY B O 3677 N N . PRO B 141 ? 0.7862 0.6781 0.6572 -0.0229 0.0291 -0.0439 222 PRO B N 3678 C CA . PRO B 141 ? 0.7649 0.6497 0.6340 -0.0226 0.0237 -0.0416 222 PRO B CA 3679 C C . PRO B 141 ? 0.8023 0.6751 0.6611 -0.0228 0.0219 -0.0410 222 PRO B C 3680 O O . PRO B 141 ? 0.9929 0.8623 0.8462 -0.0223 0.0246 -0.0428 222 PRO B O 3681 C CB . PRO B 141 ? 0.8525 0.7422 0.7299 -0.0174 0.0213 -0.0414 222 PRO B CB 3682 C CG . PRO B 141 ? 0.8953 0.7868 0.7731 -0.0139 0.0252 -0.0435 222 PRO B CG 3683 C CD . PRO B 141 ? 0.8813 0.7790 0.7586 -0.0172 0.0303 -0.0451 222 PRO B CD 3684 N N . LEU B 142 ? 0.8471 0.7140 0.7031 -0.0234 0.0175 -0.0385 223 LEU B N 3685 C CA . LEU B 142 ? 0.8502 0.7080 0.6974 -0.0234 0.0148 -0.0375 223 LEU B CA 3686 C C . LEU B 142 ? 0.8371 0.6937 0.6867 -0.0199 0.0127 -0.0389 223 LEU B C 3687 O O . LEU B 142 ? 0.7264 0.5881 0.5847 -0.0169 0.0123 -0.0393 223 LEU B O 3688 C CB . LEU B 142 ? 0.8646 0.7182 0.7094 -0.0246 0.0109 -0.0339 223 LEU B CB 3689 C CG . LEU B 142 ? 0.8411 0.6889 0.6763 -0.0275 0.0122 -0.0317 223 LEU B CG 3690 C CD1 . LEU B 142 ? 0.7363 0.5857 0.5692 -0.0302 0.0180 -0.0336 223 LEU B CD1 3691 C CD2 . LEU B 142 ? 0.6438 0.4891 0.4793 -0.0281 0.0103 -0.0281 223 LEU B CD2 3692 N N . ARG B 143 ? 0.7284 0.5782 0.5698 -0.0205 0.0119 -0.0399 224 ARG B N 3693 C CA . ARG B 143 ? 0.6477 0.4942 0.4894 -0.0183 0.0106 -0.0417 224 ARG B CA 3694 C C . ARG B 143 ? 0.7802 0.6208 0.6145 -0.0204 0.0061 -0.0408 224 ARG B C 3695 O O . ARG B 143 ? 0.6521 0.4896 0.4771 -0.0231 0.0063 -0.0407 224 ARG B O 3696 C CB . ARG B 143 ? 0.7072 0.5516 0.5451 -0.0175 0.0156 -0.0456 224 ARG B CB 3697 C CG . ARG B 143 ? 0.7519 0.6037 0.5969 -0.0151 0.0205 -0.0466 224 ARG B CG 3698 C CD . ARG B 143 ? 0.9527 0.8021 0.7922 -0.0147 0.0261 -0.0500 224 ARG B CD 3699 N NE . ARG B 143 ? 1.1084 0.9657 0.9512 -0.0151 0.0305 -0.0501 224 ARG B NE 3700 C CZ . ARG B 143 ? 1.1102 0.9667 0.9462 -0.0188 0.0327 -0.0503 224 ARG B CZ 3701 N NH1 . ARG B 143 ? 0.9212 0.7695 0.7464 -0.0218 0.0307 -0.0500 224 ARG B NH1 3702 N NH2 . ARG B 143 ? 1.3622 1.2265 1.2022 -0.0196 0.0371 -0.0505 224 ARG B NH2 3703 N N . THR B 144 ? 0.7815 0.6214 0.6198 -0.0193 0.0022 -0.0398 225 THR B N 3704 C CA . THR B 144 ? 0.7882 0.6242 0.6202 -0.0216 -0.0021 -0.0392 225 THR B CA 3705 C C . THR B 144 ? 0.7941 0.6245 0.6194 -0.0230 -0.0001 -0.0436 225 THR B C 3706 O O . THR B 144 ? 0.8412 0.6701 0.6678 -0.0211 0.0046 -0.0466 225 THR B O 3707 C CB . THR B 144 ? 0.7653 0.6027 0.6038 -0.0204 -0.0066 -0.0368 225 THR B CB 3708 O OG1 . THR B 144 ? 0.9249 0.7613 0.7696 -0.0179 -0.0049 -0.0388 225 THR B OG1 3709 C CG2 . THR B 144 ? 0.6193 0.4613 0.4634 -0.0192 -0.0081 -0.0328 225 THR B CG2 3710 N N . GLN B 145 ? 0.8939 0.7216 0.7119 -0.0262 -0.0036 -0.0440 226 GLN B N 3711 C CA . GLN B 145 ? 0.8321 0.6537 0.6426 -0.0287 -0.0019 -0.0489 226 GLN B CA 3712 C C . GLN B 145 ? 0.8293 0.6466 0.6448 -0.0274 -0.0010 -0.0512 226 GLN B C 3713 O O . GLN B 145 ? 0.8384 0.6488 0.6480 -0.0291 0.0016 -0.0557 226 GLN B O 3714 C CB . GLN B 145 ? 0.8678 0.6894 0.6685 -0.0333 -0.0060 -0.0488 226 GLN B CB 3715 C CG . GLN B 145 ? 0.8224 0.6485 0.6266 -0.0342 -0.0124 -0.0450 226 GLN B CG 3716 C CD . GLN B 145 ? 0.8179 0.6466 0.6124 -0.0384 -0.0165 -0.0445 226 GLN B CD 3717 O OE1 . GLN B 145 ? 0.8794 0.7138 0.6735 -0.0379 -0.0202 -0.0396 226 GLN B OE1 3718 N NE2 . GLN B 145 ? 0.8361 0.6608 0.6224 -0.0425 -0.0157 -0.0496 226 GLN B NE2 3719 N N . ALA B 146 ? 0.7696 0.5902 0.5952 -0.0243 -0.0028 -0.0482 227 ALA B N 3720 C CA . ALA B 146 ? 0.6954 0.5120 0.5265 -0.0221 -0.0013 -0.0495 227 ALA B CA 3721 C C . ALA B 146 ? 0.7559 0.5656 0.5806 -0.0265 -0.0026 -0.0526 227 ALA B C 3722 O O . ALA B 146 ? 0.7850 0.5866 0.6077 -0.0262 0.0015 -0.0564 227 ALA B O 3723 C CB . ALA B 146 ? 0.6884 0.5026 0.5219 -0.0178 0.0053 -0.0516 227 ALA B CB 3724 N N . SER B 147 ? 0.7129 0.5263 0.5348 -0.0305 -0.0081 -0.0510 228 SER B N 3725 C CA . SER B 147 ? 0.7873 0.5968 0.6020 -0.0363 -0.0101 -0.0542 228 SER B CA 3726 C C . SER B 147 ? 0.8426 0.6608 0.6574 -0.0388 -0.0169 -0.0503 228 SER B C 3727 O O . SER B 147 ? 0.8561 0.6806 0.6740 -0.0361 -0.0187 -0.0458 228 SER B O 3728 C CB . SER B 147 ? 0.7846 0.5888 0.5878 -0.0394 -0.0067 -0.0592 228 SER B CB 3729 O OG . SER B 147 ? 0.8791 0.6830 0.6735 -0.0461 -0.0099 -0.0619 228 SER B OG 3730 N N . SER B 148 ? 0.7511 0.5697 0.5624 -0.0441 -0.0203 -0.0519 229 SER B N 3731 C CA . SER B 148 ? 0.7508 0.5791 0.5624 -0.0461 -0.0267 -0.0478 229 SER B CA 3732 C C . SER B 148 ? 0.8561 0.6895 0.6606 -0.0461 -0.0281 -0.0457 229 SER B C 3733 O O . SER B 148 ? 0.8223 0.6524 0.6172 -0.0489 -0.0260 -0.0495 229 SER B O 3734 C CB . SER B 148 ? 0.6826 0.5116 0.4904 -0.0529 -0.0298 -0.0508 229 SER B CB 3735 O OG . SER B 148 ? 0.6899 0.5304 0.4984 -0.0544 -0.0361 -0.0465 229 SER B OG 3736 N N . CYS B 149 ? 0.7682 0.6089 0.5769 -0.0428 -0.0311 -0.0397 230 CYS B N 3737 C CA . CYS B 149 ? 0.7253 0.5710 0.5268 -0.0429 -0.0330 -0.0367 230 CYS B CA 3738 C C . CYS B 149 ? 0.7558 0.6096 0.5532 -0.0472 -0.0388 -0.0358 230 CYS B C 3739 O O . CYS B 149 ? 0.7691 0.6244 0.5704 -0.0501 -0.0410 -0.0373 230 CYS B O 3740 C CB . CYS B 149 ? 0.8188 0.6671 0.6252 -0.0375 -0.0327 -0.0308 230 CYS B CB 3741 S SG . CYS B 149 ? 0.8567 0.7105 0.6748 -0.0341 -0.0362 -0.0253 230 CYS B SG 3742 N N . ILE B 150 ? 0.9032 0.7627 0.6924 -0.0479 -0.0410 -0.0332 231 ILE B N 3743 C CA . ILE B 150 ? 0.8460 0.7145 0.6297 -0.0527 -0.0464 -0.0332 231 ILE B CA 3744 C C . ILE B 150 ? 0.8839 0.7636 0.6697 -0.0491 -0.0511 -0.0252 231 ILE B C 3745 O O . ILE B 150 ? 0.8580 0.7380 0.6409 -0.0447 -0.0500 -0.0205 231 ILE B O 3746 C CB . ILE B 150 ? 0.8257 0.6931 0.5957 -0.0575 -0.0456 -0.0376 231 ILE B CB 3747 C CG1 . ILE B 150 ? 0.8338 0.6889 0.6009 -0.0602 -0.0400 -0.0454 231 ILE B CG1 3748 C CG2 . ILE B 150 ? 0.8084 0.6866 0.5728 -0.0635 -0.0515 -0.0384 231 ILE B CG2 3749 C CD1 . ILE B 150 ? 0.8631 0.7144 0.6347 -0.0643 -0.0400 -0.0502 231 ILE B CD1 3750 N N . CYS B 151 ? 0.8590 0.7477 0.6500 -0.0510 -0.0559 -0.0235 232 CYS B N 3751 C CA . CYS B 151 ? 0.7981 0.6988 0.5915 -0.0474 -0.0605 -0.0158 232 CYS B CA 3752 C C . CYS B 151 ? 0.8710 0.7845 0.6583 -0.0528 -0.0660 -0.0162 232 CYS B C 3753 O O . CYS B 151 ? 0.9479 0.8627 0.7346 -0.0599 -0.0675 -0.0221 232 CYS B O 3754 C CB . CYS B 151 ? 0.7092 0.6126 0.5151 -0.0445 -0.0618 -0.0126 232 CYS B CB 3755 S SG . CYS B 151 ? 0.9797 0.8716 0.7938 -0.0381 -0.0564 -0.0112 232 CYS B SG 3756 N N . ASN B 152 ? 0.9457 0.8689 0.7281 -0.0496 -0.0689 -0.0100 233 ASN B N 3757 C CA . ASN B 152 ? 0.9033 0.8421 0.6810 -0.0542 -0.0749 -0.0093 233 ASN B CA 3758 C C . ASN B 152 ? 0.9409 0.8923 0.7183 -0.0476 -0.0784 0.0004 233 ASN B C 3759 O O . ASN B 152 ? 0.9193 0.8665 0.6913 -0.0419 -0.0758 0.0050 233 ASN B O 3760 C CB . ASN B 152 ? 0.9868 0.9238 0.7514 -0.0607 -0.0746 -0.0156 233 ASN B CB 3761 C CG . ASN B 152 ? 0.9770 0.9305 0.7368 -0.0675 -0.0809 -0.0167 233 ASN B CG 3762 O OD1 . ASN B 152 ? 0.9164 0.8776 0.6830 -0.0718 -0.0843 -0.0183 233 ASN B OD1 3763 N ND2 . ASN B 152 ? 0.9434 0.9033 0.6910 -0.0686 -0.0827 -0.0158 233 ASN B ND2 3764 N N . ASP B 153 ? 1.0979 1.0648 0.8814 -0.0484 -0.0838 0.0037 234 ASP B N 3765 C CA . ASP B 153 ? 1.1285 1.1100 0.9129 -0.0416 -0.0874 0.0136 234 ASP B CA 3766 C C . ASP B 153 ? 1.0078 0.9801 0.7968 -0.0315 -0.0831 0.0206 234 ASP B C 3767 O O . ASP B 153 ? 1.0009 0.9754 0.7846 -0.0248 -0.0825 0.0278 234 ASP B O 3768 C CB . ASP B 153 ? 1.1460 1.1372 0.9176 -0.0425 -0.0902 0.0157 234 ASP B CB 3769 C CG . ASP B 153 ? 1.3615 1.3738 1.1345 -0.0381 -0.0959 0.0247 234 ASP B CG 3770 O OD1 . ASP B 153 ? 1.3570 1.3783 1.1411 -0.0365 -0.0984 0.0277 234 ASP B OD1 3771 O OD2 . ASP B 153 ? 1.4447 1.4650 1.2077 -0.0358 -0.0977 0.0291 234 ASP B OD2 3772 N N . GLY B 154 ? 0.8748 0.8362 0.6731 -0.0305 -0.0797 0.0182 235 GLY B N 3773 C CA . GLY B 154 ? 0.9855 0.9390 0.7889 -0.0219 -0.0758 0.0242 235 GLY B CA 3774 C C . GLY B 154 ? 0.9558 0.8915 0.7552 -0.0196 -0.0693 0.0223 235 GLY B C 3775 O O . GLY B 154 ? 0.9586 0.8855 0.7640 -0.0149 -0.0655 0.0243 235 GLY B O 3776 N N . THR B 155 ? 0.7368 0.6678 0.5261 -0.0231 -0.0678 0.0184 236 THR B N 3777 C CA . THR B 155 ? 0.8517 0.7668 0.6377 -0.0220 -0.0614 0.0157 236 THR B CA 3778 C C . THR B 155 ? 0.8140 0.7203 0.6004 -0.0284 -0.0591 0.0062 236 THR B C 3779 O O . THR B 155 ? 0.8673 0.7781 0.6508 -0.0347 -0.0618 0.0009 236 THR B O 3780 C CB . THR B 155 ? 0.8595 0.7722 0.6339 -0.0190 -0.0592 0.0198 236 THR B CB 3781 O OG1 . THR B 155 ? 0.8526 0.7567 0.6199 -0.0237 -0.0559 0.0131 236 THR B OG1 3782 C CG2 . THR B 155 ? 0.8230 0.7512 0.5911 -0.0180 -0.0646 0.0253 236 THR B CG2 3783 N N . CYS B 156 ? 0.6935 0.5877 0.4836 -0.0266 -0.0538 0.0042 237 CYS B N 3784 C CA . CYS B 156 ? 0.6619 0.5479 0.4540 -0.0309 -0.0509 -0.0038 237 CYS B CA 3785 C C . CYS B 156 ? 0.6976 0.5742 0.4826 -0.0310 -0.0456 -0.0063 237 CYS B C 3786 O O . CYS B 156 ? 0.7890 0.6621 0.5717 -0.0269 -0.0427 -0.0019 237 CYS B O 3787 C CB . CYS B 156 ? 0.7411 0.6228 0.5451 -0.0288 -0.0494 -0.0043 237 CYS B CB 3788 S SG . CYS B 156 ? 0.9403 0.8327 0.7533 -0.0292 -0.0550 -0.0019 237 CYS B SG 3789 N N . TYR B 157 ? 0.8251 0.6973 0.6061 -0.0357 -0.0438 -0.0133 238 TYR B N 3790 C CA . TYR B 157 ? 0.6623 0.5263 0.4369 -0.0359 -0.0384 -0.0160 238 TYR B CA 3791 C C . TYR B 157 ? 0.7556 0.6115 0.5361 -0.0369 -0.0341 -0.0221 238 TYR B C 3792 O O . TYR B 157 ? 0.8807 0.7364 0.6654 -0.0396 -0.0354 -0.0262 238 TYR B O 3793 C CB . TYR B 157 ? 0.6500 0.5162 0.4113 -0.0395 -0.0391 -0.0180 238 TYR B CB 3794 C CG . TYR B 157 ? 0.8242 0.7014 0.5800 -0.0390 -0.0446 -0.0123 238 TYR B CG 3795 C CD1 . TYR B 157 ? 0.9058 0.7926 0.6623 -0.0428 -0.0504 -0.0135 238 TYR B CD1 3796 C CD2 . TYR B 157 ? 0.7867 0.6653 0.5368 -0.0346 -0.0439 -0.0054 238 TYR B CD2 3797 C CE1 . TYR B 157 ? 0.7842 0.6836 0.5365 -0.0421 -0.0557 -0.0080 238 TYR B CE1 3798 C CE2 . TYR B 157 ? 0.7790 0.6688 0.5242 -0.0330 -0.0489 0.0006 238 TYR B CE2 3799 C CZ . TYR B 157 ? 0.8179 0.7191 0.5647 -0.0368 -0.0550 -0.0007 238 TYR B CZ 3800 O OH . TYR B 157 ? 0.8659 0.7807 0.6087 -0.0352 -0.0604 0.0054 238 TYR B OH 3801 N N . THR B 158 ? 0.7336 0.5834 0.5148 -0.0345 -0.0289 -0.0221 239 THR B N 3802 C CA . THR B 158 ? 0.7759 0.6198 0.5632 -0.0344 -0.0245 -0.0269 239 THR B CA 3803 C C . THR B 158 ? 0.7746 0.6139 0.5569 -0.0339 -0.0189 -0.0280 239 THR B C 3804 O O . THR B 158 ? 0.7819 0.6216 0.5584 -0.0329 -0.0182 -0.0240 239 THR B O 3805 C CB . THR B 158 ? 0.7723 0.6166 0.5721 -0.0311 -0.0248 -0.0248 239 THR B CB 3806 O OG1 . THR B 158 ? 0.7238 0.5640 0.5294 -0.0309 -0.0212 -0.0294 239 THR B OG1 3807 C CG2 . THR B 158 ? 0.7852 0.6292 0.5869 -0.0277 -0.0229 -0.0198 239 THR B CG2 3808 N N . ILE B 159 ? 0.7505 0.5853 0.5346 -0.0345 -0.0145 -0.0333 240 ILE B N 3809 C CA . ILE B 159 ? 0.8362 0.6677 0.6162 -0.0343 -0.0088 -0.0348 240 ILE B CA 3810 C C . ILE B 159 ? 0.8194 0.6500 0.6095 -0.0318 -0.0046 -0.0360 240 ILE B C 3811 O O . ILE B 159 ? 0.8426 0.6725 0.6394 -0.0310 -0.0042 -0.0389 240 ILE B O 3812 C CB . ILE B 159 ? 0.8251 0.6532 0.5956 -0.0374 -0.0064 -0.0403 240 ILE B CB 3813 C CG1 . ILE B 159 ? 0.8785 0.7090 0.6376 -0.0404 -0.0104 -0.0392 240 ILE B CG1 3814 C CG2 . ILE B 159 ? 0.6841 0.5093 0.4516 -0.0369 0.0001 -0.0421 240 ILE B CG2 3815 C CD1 . ILE B 159 ? 0.7873 0.6154 0.5393 -0.0446 -0.0107 -0.0454 240 ILE B CD1 3816 N N . ILE B 160 ? 0.8593 0.6900 0.6499 -0.0309 -0.0013 -0.0337 241 ILE B N 3817 C CA . ILE B 160 ? 0.8711 0.7033 0.6714 -0.0291 0.0022 -0.0344 241 ILE B CA 3818 C C . ILE B 160 ? 0.8182 0.6498 0.6162 -0.0298 0.0084 -0.0371 241 ILE B C 3819 O O . ILE B 160 ? 0.8397 0.6693 0.6290 -0.0315 0.0106 -0.0361 241 ILE B O 3820 C CB . ILE B 160 ? 0.8385 0.6723 0.6439 -0.0278 0.0008 -0.0297 241 ILE B CB 3821 C CG1 . ILE B 160 ? 0.8973 0.7328 0.7069 -0.0265 -0.0049 -0.0274 241 ILE B CG1 3822 C CG2 . ILE B 160 ? 0.7827 0.6193 0.5975 -0.0269 0.0044 -0.0309 241 ILE B CG2 3823 C CD1 . ILE B 160 ? 1.0109 0.8471 0.8248 -0.0250 -0.0060 -0.0229 241 ILE B CD1 3824 N N . ALA B 161 ? 0.7865 0.6202 0.5923 -0.0282 0.0115 -0.0402 242 ALA B N 3825 C CA . ALA B 161 ? 0.7985 0.6333 0.6035 -0.0284 0.0177 -0.0429 242 ALA B CA 3826 C C . ALA B 161 ? 0.9267 0.7672 0.7404 -0.0280 0.0203 -0.0415 242 ALA B C 3827 O O . ALA B 161 ? 0.9270 0.7709 0.7495 -0.0266 0.0178 -0.0401 242 ALA B O 3828 C CB . ALA B 161 ? 0.6017 0.4356 0.4084 -0.0266 0.0203 -0.0474 242 ALA B CB 3829 N N . ASP B 162 ? 0.9475 0.7892 0.7583 -0.0298 0.0254 -0.0422 243 ASP B N 3830 C CA . ASP B 162 ? 0.8804 0.7281 0.6983 -0.0309 0.0287 -0.0416 243 ASP B CA 3831 C C . ASP B 162 ? 0.9673 0.8194 0.7862 -0.0310 0.0350 -0.0449 243 ASP B C 3832 O O . ASP B 162 ? 0.9720 0.8207 0.7847 -0.0302 0.0369 -0.0473 243 ASP B O 3833 C CB . ASP B 162 ? 1.0359 0.8794 0.8475 -0.0341 0.0289 -0.0381 243 ASP B CB 3834 C CG . ASP B 162 ? 1.0512 0.8994 0.8700 -0.0362 0.0314 -0.0373 243 ASP B CG 3835 O OD1 . ASP B 162 ? 1.0293 0.8861 0.8582 -0.0353 0.0326 -0.0396 243 ASP B OD1 3836 O OD2 . ASP B 162 ? 1.0636 0.9071 0.8775 -0.0388 0.0323 -0.0345 243 ASP B OD2 3837 N N . GLY B 163 ? 0.9737 0.8337 0.8002 -0.0322 0.0383 -0.0451 244 GLY B N 3838 C CA . GLY B 163 ? 0.9908 0.8570 0.8192 -0.0325 0.0446 -0.0478 244 GLY B CA 3839 C C . GLY B 163 ? 1.0843 0.9610 0.9249 -0.0286 0.0456 -0.0496 244 GLY B C 3840 O O . GLY B 163 ? 1.1656 1.0420 1.0107 -0.0248 0.0418 -0.0494 244 GLY B O 3841 N N . THR B 164 ? 1.0412 0.9276 0.8869 -0.0293 0.0510 -0.0511 245 THR B N 3842 C CA . THR B 164 ? 0.9140 0.8133 0.7722 -0.0253 0.0523 -0.0521 245 THR B CA 3843 C C . THR B 164 ? 0.8890 0.7897 0.7475 -0.0200 0.0565 -0.0544 245 THR B C 3844 O O . THR B 164 ? 0.9098 0.8182 0.7773 -0.0146 0.0568 -0.0546 245 THR B O 3845 C CB . THR B 164 ? 0.8960 0.8088 0.7624 -0.0291 0.0550 -0.0522 245 THR B CB 3846 O OG1 . THR B 164 ? 0.9576 0.8711 0.8190 -0.0329 0.0610 -0.0534 245 THR B OG1 3847 C CG2 . THR B 164 ? 0.7086 0.6190 0.5750 -0.0338 0.0512 -0.0503 245 THR B CG2 3848 N N . THR B 165 ? 0.8900 0.7832 0.7383 -0.0213 0.0602 -0.0560 246 THR B N 3849 C CA . THR B 165 ? 1.0150 0.9045 0.8601 -0.0164 0.0640 -0.0585 246 THR B CA 3850 C C . THR B 165 ? 1.0529 0.9265 0.8841 -0.0177 0.0619 -0.0596 246 THR B C 3851 O O . THR B 165 ? 1.0902 0.9577 0.9138 -0.0224 0.0588 -0.0581 246 THR B O 3852 C CB . THR B 165 ? 1.1372 1.0339 0.9826 -0.0164 0.0718 -0.0604 246 THR B CB 3853 O OG1 . THR B 165 ? 1.0791 0.9733 0.9169 -0.0230 0.0734 -0.0599 246 THR B OG1 3854 C CG2 . THR B 165 ? 1.0090 0.9235 0.8691 -0.0136 0.0743 -0.0598 246 THR B CG2 3855 N N . TYR B 166 ? 1.0096 0.8768 0.8372 -0.0137 0.0639 -0.0621 247 TYR B N 3856 C CA . TYR B 166 ? 0.9379 0.7913 0.7519 -0.0156 0.0623 -0.0639 247 TYR B CA 3857 C C . TYR B 166 ? 0.9681 0.8186 0.7716 -0.0187 0.0671 -0.0656 247 TYR B C 3858 O O . TYR B 166 ? 1.1680 1.0092 0.9588 -0.0221 0.0653 -0.0663 247 TYR B O 3859 C CB . TYR B 166 ? 1.0297 0.8763 0.8432 -0.0108 0.0634 -0.0665 247 TYR B CB 3860 C CG . TYR B 166 ? 1.2198 1.0693 1.0438 -0.0074 0.0591 -0.0644 247 TYR B CG 3861 C CD1 . TYR B 166 ? 1.2483 1.0971 1.0735 -0.0104 0.0519 -0.0617 247 TYR B CD1 3862 C CD2 . TYR B 166 ? 1.2566 1.1099 1.0892 -0.0007 0.0625 -0.0647 247 TYR B CD2 3863 C CE1 . TYR B 166 ? 1.3014 1.1530 1.1359 -0.0073 0.0481 -0.0596 247 TYR B CE1 3864 C CE2 . TYR B 166 ? 1.2920 1.1482 1.1338 0.0026 0.0586 -0.0624 247 TYR B CE2 3865 C CZ . TYR B 166 ? 1.3282 1.1835 1.1708 -0.0010 0.0513 -0.0600 247 TYR B CZ 3866 O OH . TYR B 166 ? 1.2410 1.0990 1.0922 0.0023 0.0478 -0.0576 247 TYR B OH 3867 N N . THR B 167 ? 0.9759 0.8356 0.7848 -0.0176 0.0732 -0.0661 248 THR B N 3868 C CA . THR B 167 ? 1.1071 0.9662 0.9075 -0.0206 0.0788 -0.0673 248 THR B CA 3869 C C . THR B 167 ? 1.0915 0.9485 0.8856 -0.0269 0.0759 -0.0644 248 THR B C 3870 O O . THR B 167 ? 1.2256 1.0764 1.0074 -0.0300 0.0780 -0.0649 248 THR B O 3871 C CB . THR B 167 ? 1.1819 1.0538 0.9919 -0.0181 0.0858 -0.0679 248 THR B CB 3872 O OG1 . THR B 167 ? 1.1905 1.0747 1.0124 -0.0198 0.0839 -0.0651 248 THR B OG1 3873 C CG2 . THR B 167 ? 1.1406 1.0141 0.9566 -0.0107 0.0890 -0.0699 248 THR B CG2 3874 N N . ALA B 168 ? 1.1006 0.9623 0.9025 -0.0284 0.0714 -0.0613 249 ALA B N 3875 C CA . ALA B 168 ? 1.0337 0.8920 0.8301 -0.0336 0.0687 -0.0580 249 ALA B CA 3876 C C . ALA B 168 ? 1.1729 1.0276 0.9715 -0.0333 0.0609 -0.0556 249 ALA B C 3877 O O . ALA B 168 ? 1.1788 1.0368 0.9830 -0.0352 0.0586 -0.0529 249 ALA B O 3878 C CB . ALA B 168 ? 0.8929 0.7606 0.6963 -0.0368 0.0725 -0.0567 249 ALA B CB 3879 N N . SER B 169 ? 1.2094 1.0572 1.0035 -0.0310 0.0572 -0.0568 250 SER B N 3880 C CA . SER B 169 ? 1.0498 0.8942 0.8453 -0.0307 0.0499 -0.0546 250 SER B CA 3881 C C . SER B 169 ? 0.9728 0.8106 0.7572 -0.0343 0.0469 -0.0515 250 SER B C 3882 O O . SER B 169 ? 0.8357 0.6706 0.6104 -0.0367 0.0503 -0.0514 250 SER B O 3883 C CB . SER B 169 ? 0.9636 0.8034 0.7585 -0.0276 0.0476 -0.0572 250 SER B CB 3884 O OG . SER B 169 ? 0.8375 0.6687 0.6193 -0.0297 0.0456 -0.0582 250 SER B OG 3885 N N . SER B 170 ? 0.8964 0.7324 0.6822 -0.0343 0.0407 -0.0485 251 SER B N 3886 C CA . SER B 170 ? 0.8002 0.6311 0.5765 -0.0367 0.0379 -0.0446 251 SER B CA 3887 C C . SER B 170 ? 0.8718 0.7005 0.6484 -0.0355 0.0306 -0.0429 251 SER B C 3888 O O . SER B 170 ? 0.8588 0.6904 0.6453 -0.0334 0.0280 -0.0434 251 SER B O 3889 C CB . SER B 170 ? 0.8369 0.6695 0.6160 -0.0387 0.0404 -0.0414 251 SER B CB 3890 O OG . SER B 170 ? 1.0249 0.8549 0.8040 -0.0387 0.0357 -0.0370 251 SER B OG 3891 N N . HIS B 171 ? 0.8514 0.6759 0.6171 -0.0366 0.0274 -0.0408 252 HIS B N 3892 C CA . HIS B 171 ? 0.8906 0.7145 0.6564 -0.0358 0.0206 -0.0398 252 HIS B CA 3893 C C . HIS B 171 ? 0.8621 0.6848 0.6212 -0.0362 0.0165 -0.0343 252 HIS B C 3894 O O . HIS B 171 ? 0.9215 0.7420 0.6704 -0.0374 0.0183 -0.0321 252 HIS B O 3895 C CB . HIS B 171 ? 0.8499 0.6717 0.6105 -0.0365 0.0199 -0.0446 252 HIS B CB 3896 C CG . HIS B 171 ? 0.9085 0.7306 0.6749 -0.0351 0.0248 -0.0495 252 HIS B CG 3897 N ND1 . HIS B 171 ? 0.8709 0.6943 0.6478 -0.0326 0.0237 -0.0512 252 HIS B ND1 3898 C CD2 . HIS B 171 ? 0.7746 0.5961 0.5382 -0.0352 0.0312 -0.0525 252 HIS B CD2 3899 C CE1 . HIS B 171 ? 0.7947 0.6184 0.5746 -0.0309 0.0292 -0.0548 252 HIS B CE1 3900 N NE2 . HIS B 171 ? 0.7469 0.5698 0.5194 -0.0324 0.0339 -0.0559 252 HIS B NE2 3901 N N . ARG B 172 ? 0.8394 0.6639 0.6044 -0.0347 0.0112 -0.0317 253 ARG B N 3902 C CA . ARG B 172 ? 0.8278 0.6521 0.5880 -0.0340 0.0074 -0.0258 253 ARG B CA 3903 C C . ARG B 172 ? 0.8001 0.6273 0.5607 -0.0335 0.0006 -0.0252 253 ARG B C 3904 O O . ARG B 172 ? 0.8144 0.6433 0.5829 -0.0333 -0.0014 -0.0283 253 ARG B O 3905 C CB . ARG B 172 ? 0.8443 0.6677 0.6110 -0.0325 0.0087 -0.0218 253 ARG B CB 3906 C CG . ARG B 172 ? 0.8724 0.6927 0.6365 -0.0339 0.0153 -0.0216 253 ARG B CG 3907 C CD . ARG B 172 ? 0.9922 0.8122 0.7649 -0.0337 0.0174 -0.0200 253 ARG B CD 3908 N NE . ARG B 172 ? 1.0382 0.8554 0.8080 -0.0361 0.0241 -0.0202 253 ARG B NE 3909 C CZ . ARG B 172 ? 1.1602 0.9737 0.9309 -0.0370 0.0271 -0.0172 253 ARG B CZ 3910 N NH1 . ARG B 172 ? 1.0844 0.8962 0.8583 -0.0350 0.0239 -0.0138 253 ARG B NH1 3911 N NH2 . ARG B 172 ? 1.2290 1.0400 0.9968 -0.0402 0.0336 -0.0178 253 ARG B NH2 3912 N N . LEU B 173 ? 0.8693 0.6978 0.6213 -0.0334 -0.0027 -0.0210 254 LEU B N 3913 C CA . LEU B 173 ? 0.8199 0.6533 0.5709 -0.0337 -0.0093 -0.0202 254 LEU B CA 3914 C C . LEU B 173 ? 0.8457 0.6816 0.5999 -0.0303 -0.0126 -0.0131 254 LEU B C 3915 O O . LEU B 173 ? 0.8346 0.6695 0.5819 -0.0285 -0.0117 -0.0078 254 LEU B O 3916 C CB . LEU B 173 ? 0.6711 0.5061 0.4087 -0.0362 -0.0105 -0.0211 254 LEU B CB 3917 C CG . LEU B 173 ? 0.8592 0.7014 0.5937 -0.0371 -0.0177 -0.0192 254 LEU B CG 3918 C CD1 . LEU B 173 ? 0.8686 0.7125 0.6107 -0.0393 -0.0207 -0.0241 254 LEU B CD1 3919 C CD2 . LEU B 173 ? 0.7063 0.5510 0.4263 -0.0398 -0.0186 -0.0198 254 LEU B CD2 3920 N N . TYR B 174 ? 0.8386 0.6773 0.6029 -0.0292 -0.0160 -0.0130 255 TYR B N 3921 C CA . TYR B 174 ? 0.7067 0.5470 0.4756 -0.0255 -0.0182 -0.0068 255 TYR B CA 3922 C C . TYR B 174 ? 0.7510 0.5990 0.5186 -0.0249 -0.0247 -0.0036 255 TYR B C 3923 O O . TYR B 174 ? 0.7826 0.6348 0.5517 -0.0278 -0.0282 -0.0075 255 TYR B O 3924 C CB . TYR B 174 ? 0.7433 0.5819 0.5247 -0.0243 -0.0170 -0.0082 255 TYR B CB 3925 C CG . TYR B 174 ? 0.8610 0.6940 0.6441 -0.0242 -0.0108 -0.0089 255 TYR B CG 3926 C CD1 . TYR B 174 ? 0.9391 0.7702 0.7227 -0.0266 -0.0068 -0.0143 255 TYR B CD1 3927 C CD2 . TYR B 174 ? 0.8592 0.6886 0.6430 -0.0220 -0.0086 -0.0041 255 TYR B CD2 3928 C CE1 . TYR B 174 ? 0.8400 0.6677 0.6254 -0.0271 -0.0012 -0.0150 255 TYR B CE1 3929 C CE2 . TYR B 174 ? 0.8464 0.6709 0.6313 -0.0230 -0.0028 -0.0052 255 TYR B CE2 3930 C CZ . TYR B 174 ? 0.8645 0.6891 0.6506 -0.0258 0.0006 -0.0107 255 TYR B CZ 3931 O OH . TYR B 174 ? 0.9722 0.7938 0.7599 -0.0275 0.0064 -0.0119 255 TYR B OH 3932 N N . ARG B 175 ? 0.6741 0.5240 0.4389 -0.0211 -0.0260 0.0037 256 ARG B N 3933 C CA . ARG B 175 ? 0.6290 0.4882 0.3945 -0.0194 -0.0321 0.0080 256 ARG B CA 3934 C C . ARG B 175 ? 0.7491 0.6082 0.5251 -0.0156 -0.0327 0.0113 256 ARG B C 3935 O O . ARG B 175 ? 0.8823 0.7356 0.6586 -0.0119 -0.0291 0.0156 256 ARG B O 3936 C CB . ARG B 175 ? 0.6722 0.5342 0.4270 -0.0164 -0.0327 0.0149 256 ARG B CB 3937 C CG . ARG B 175 ? 0.8547 0.7282 0.6103 -0.0134 -0.0389 0.0208 256 ARG B CG 3938 C CD . ARG B 175 ? 0.9328 0.8085 0.6784 -0.0086 -0.0385 0.0291 256 ARG B CD 3939 N NE . ARG B 175 ? 1.0779 0.9502 0.8116 -0.0112 -0.0359 0.0273 256 ARG B NE 3940 C CZ . ARG B 175 ? 1.2070 1.0870 0.9335 -0.0154 -0.0396 0.0241 256 ARG B CZ 3941 N NH1 . ARG B 175 ? 1.1350 1.0269 0.8652 -0.0181 -0.0461 0.0223 256 ARG B NH1 3942 N NH2 . ARG B 175 ? 1.2364 1.1124 0.9518 -0.0175 -0.0365 0.0226 256 ARG B NH2 3943 N N . LEU B 176 ? 0.7873 0.6523 0.5715 -0.0168 -0.0369 0.0093 257 LEU B N 3944 C CA . LEU B 176 ? 0.6762 0.5414 0.4704 -0.0134 -0.0374 0.0121 257 LEU B CA 3945 C C . LEU B 176 ? 0.7712 0.6471 0.5671 -0.0109 -0.0429 0.0175 257 LEU B C 3946 O O . LEU B 176 ? 0.9163 0.8011 0.7101 -0.0139 -0.0475 0.0162 257 LEU B O 3947 C CB . LEU B 176 ? 0.6987 0.5622 0.5022 -0.0162 -0.0372 0.0060 257 LEU B CB 3948 C CG . LEU B 176 ? 0.8841 0.7388 0.6912 -0.0162 -0.0317 0.0028 257 LEU B CG 3949 C CD1 . LEU B 176 ? 0.7369 0.5853 0.5358 -0.0162 -0.0269 0.0034 257 LEU B CD1 3950 C CD2 . LEU B 176 ? 0.7272 0.5809 0.5395 -0.0196 -0.0314 -0.0042 257 LEU B CD2 3951 N N . VAL B 177 ? 0.7388 0.6141 0.5382 -0.0054 -0.0420 0.0237 258 VAL B N 3952 C CA . VAL B 177 ? 0.7674 0.6537 0.5698 -0.0021 -0.0468 0.0293 258 VAL B CA 3953 C C . VAL B 177 ? 0.7531 0.6379 0.5659 0.0008 -0.0461 0.0306 258 VAL B C 3954 O O . VAL B 177 ? 0.8471 0.7231 0.6603 0.0046 -0.0416 0.0332 258 VAL B O 3955 C CB . VAL B 177 ? 0.6321 0.5213 0.4264 0.0036 -0.0466 0.0378 258 VAL B CB 3956 C CG1 . VAL B 177 ? 0.7057 0.6078 0.5047 0.0078 -0.0513 0.0441 258 VAL B CG1 3957 C CG2 . VAL B 177 ? 0.5728 0.4649 0.3560 0.0008 -0.0477 0.0370 258 VAL B CG2 3958 N N . ASN B 178 ? 0.8101 0.7030 0.6308 -0.0015 -0.0503 0.0285 259 ASN B N 3959 C CA . ASN B 178 ? 0.7748 0.6665 0.6055 0.0007 -0.0498 0.0290 259 ASN B CA 3960 C C . ASN B 178 ? 0.7064 0.5855 0.5393 0.0004 -0.0445 0.0252 259 ASN B C 3961 O O . ASN B 178 ? 0.6562 0.5306 0.4925 0.0042 -0.0416 0.0278 259 ASN B O 3962 C CB . ASN B 178 ? 0.7314 0.6272 0.5634 0.0077 -0.0500 0.0372 259 ASN B CB 3963 C CG . ASN B 178 ? 0.8628 0.7740 0.6942 0.0085 -0.0556 0.0416 259 ASN B CG 3964 O OD1 . ASN B 178 ? 1.0122 0.9312 0.8427 0.0029 -0.0597 0.0377 259 ASN B OD1 3965 N ND2 . ASN B 178 ? 1.0010 0.9168 0.8326 0.0156 -0.0555 0.0497 259 ASN B ND2 3966 N N . GLY B 179 ? 0.7968 0.6712 0.6273 -0.0043 -0.0429 0.0190 260 GLY B N 3967 C CA . GLY B 179 ? 0.7993 0.6642 0.6320 -0.0050 -0.0382 0.0152 260 GLY B CA 3968 C C . GLY B 179 ? 0.7919 0.6482 0.6189 -0.0029 -0.0330 0.0174 260 GLY B C 3969 O O . GLY B 179 ? 0.8968 0.7465 0.7261 -0.0039 -0.0290 0.0144 260 GLY B O 3970 N N . THR B 180 ? 0.7778 0.6343 0.5971 -0.0001 -0.0328 0.0228 261 THR B N 3971 C CA . THR B 180 ? 0.8486 0.6955 0.6610 0.0013 -0.0271 0.0248 261 THR B CA 3972 C C . THR B 180 ? 0.8589 0.7046 0.6622 -0.0015 -0.0261 0.0232 261 THR B C 3973 O O . THR B 180 ? 0.7824 0.6352 0.5811 -0.0019 -0.0299 0.0245 261 THR B O 3974 C CB . THR B 180 ? 0.9457 0.7908 0.7545 0.0074 -0.0259 0.0329 261 THR B CB 3975 O OG1 . THR B 180 ? 1.0107 0.8586 0.8278 0.0104 -0.0274 0.0348 261 THR B OG1 3976 C CG2 . THR B 180 ? 0.8467 0.6790 0.6493 0.0083 -0.0188 0.0342 261 THR B CG2 3977 N N . SER B 181 ? 0.8823 0.7195 0.6827 -0.0038 -0.0208 0.0201 262 SER B N 3978 C CA . SER B 181 ? 0.7145 0.5495 0.5056 -0.0061 -0.0188 0.0190 262 SER B CA 3979 C C . SER B 181 ? 0.8510 0.6847 0.6324 -0.0020 -0.0180 0.0265 262 SER B C 3980 O O . SER B 181 ? 0.7931 0.6200 0.5729 0.0019 -0.0144 0.0315 262 SER B O 3981 C CB . SER B 181 ? 0.8186 0.6458 0.6094 -0.0094 -0.0128 0.0145 262 SER B CB 3982 O OG . SER B 181 ? 0.9980 0.8235 0.7799 -0.0118 -0.0108 0.0132 262 SER B OG 3983 N N . ALA B 182 ? 0.7191 0.5589 0.4935 -0.0027 -0.0212 0.0273 263 ALA B N 3984 C CA . ALA B 182 ? 0.7572 0.5976 0.5215 0.0013 -0.0209 0.0347 263 ALA B CA 3985 C C . ALA B 182 ? 0.8461 0.6814 0.6001 -0.0016 -0.0172 0.0329 263 ALA B C 3986 O O . ALA B 182 ? 0.9733 0.8102 0.7173 0.0007 -0.0174 0.0379 263 ALA B O 3987 C CB . ALA B 182 ? 0.7075 0.5615 0.4714 0.0028 -0.0281 0.0376 263 ALA B CB 3988 N N . GLY B 183 ? 0.8004 0.6305 0.5572 -0.0063 -0.0139 0.0260 264 GLY B N 3989 C CA . GLY B 183 ? 0.8613 0.6868 0.6094 -0.0094 -0.0097 0.0237 264 GLY B CA 3990 C C . GLY B 183 ? 0.8850 0.7141 0.6348 -0.0147 -0.0110 0.0156 264 GLY B C 3991 O O . GLY B 183 ? 0.9087 0.7450 0.6641 -0.0161 -0.0161 0.0122 264 GLY B O 3992 N N . TRP B 184 ? 0.7984 0.6218 0.5432 -0.0175 -0.0057 0.0126 265 TRP B N 3993 C CA . TRP B 184 ? 0.9008 0.7260 0.6455 -0.0219 -0.0053 0.0053 265 TRP B CA 3994 C C . TRP B 184 ? 0.9514 0.7733 0.6839 -0.0235 -0.0013 0.0055 265 TRP B C 3995 O O . TRP B 184 ? 0.8870 0.7035 0.6122 -0.0215 0.0023 0.0110 265 TRP B O 3996 C CB . TRP B 184 ? 0.8252 0.6476 0.5803 -0.0240 -0.0019 -0.0003 265 TRP B CB 3997 C CG . TRP B 184 ? 0.8155 0.6305 0.5701 -0.0244 0.0049 0.0010 265 TRP B CG 3998 C CD1 . TRP B 184 ? 0.8363 0.6468 0.5946 -0.0225 0.0069 0.0047 265 TRP B CD1 3999 C CD2 . TRP B 184 ? 0.7535 0.5647 0.5036 -0.0274 0.0110 -0.0018 265 TRP B CD2 4000 N NE1 . TRP B 184 ? 0.6014 0.4053 0.3575 -0.0248 0.0138 0.0041 265 TRP B NE1 4001 C CE2 . TRP B 184 ? 0.8136 0.6183 0.5649 -0.0278 0.0164 0.0004 265 TRP B CE2 4002 C CE3 . TRP B 184 ? 0.7778 0.5902 0.5225 -0.0301 0.0129 -0.0059 265 TRP B CE3 4003 C CZ2 . TRP B 184 ? 0.6699 0.4703 0.4179 -0.0310 0.0233 -0.0014 265 TRP B CZ2 4004 C CZ3 . TRP B 184 ? 0.6909 0.4992 0.4323 -0.0326 0.0197 -0.0075 265 TRP B CZ3 4005 C CH2 . TRP B 184 ? 0.7632 0.5660 0.5067 -0.0332 0.0248 -0.0051 265 TRP B CH2 4006 N N . LYS B 185 ? 0.7783 0.6024 0.5082 -0.0271 -0.0014 -0.0006 266 LYS B N 4007 C CA . LYS B 185 ? 0.6919 0.5130 0.4107 -0.0291 0.0029 -0.0016 266 LYS B CA 4008 C C . LYS B 185 ? 0.7758 0.5949 0.4984 -0.0325 0.0073 -0.0092 266 LYS B C 4009 O O . LYS B 185 ? 0.9112 0.7333 0.6405 -0.0338 0.0050 -0.0146 266 LYS B O 4010 C CB . LYS B 185 ? 0.7591 0.5861 0.4674 -0.0297 -0.0018 -0.0010 266 LYS B CB 4011 C CG . LYS B 185 ? 0.6557 0.4803 0.3506 -0.0314 0.0019 -0.0013 266 LYS B CG 4012 C CD . LYS B 185 ? 0.9260 0.7577 0.6103 -0.0308 -0.0036 0.0023 266 LYS B CD 4013 C CE . LYS B 185 ? 0.8445 0.6751 0.5138 -0.0324 -0.0008 0.0023 266 LYS B CE 4014 N NZ . LYS B 185 ? 0.8796 0.7196 0.5402 -0.0314 -0.0073 0.0064 266 LYS B NZ 4015 N N . ALA B 186 ? 0.8492 0.6632 0.5675 -0.0337 0.0139 -0.0093 267 ALA B N 4016 C CA . ALA B 186 ? 0.9128 0.7263 0.6329 -0.0365 0.0186 -0.0159 267 ALA B CA 4017 C C . ALA B 186 ? 0.9741 0.7901 0.6864 -0.0384 0.0166 -0.0203 267 ALA B C 4018 O O . ALA B 186 ? 1.0800 0.8969 0.7805 -0.0385 0.0144 -0.0177 267 ALA B O 4019 C CB . ALA B 186 ? 0.7546 0.5632 0.4701 -0.0379 0.0261 -0.0147 267 ALA B CB 4020 N N . LEU B 187 ? 0.8993 0.7163 0.6177 -0.0397 0.0176 -0.0269 268 LEU B N 4021 C CA . LEU B 187 ? 0.9379 0.7550 0.6488 -0.0419 0.0179 -0.0324 268 LEU B CA 4022 C C . LEU B 187 ? 0.9571 0.7713 0.6651 -0.0431 0.0257 -0.0358 268 LEU B C 4023 O O . LEU B 187 ? 1.0645 0.8788 0.7823 -0.0425 0.0300 -0.0373 268 LEU B O 4024 C CB . LEU B 187 ? 0.9039 0.7225 0.6227 -0.0422 0.0146 -0.0373 268 LEU B CB 4025 C CG . LEU B 187 ? 0.8389 0.6613 0.5600 -0.0416 0.0068 -0.0344 268 LEU B CG 4026 C CD1 . LEU B 187 ? 0.7278 0.5508 0.4597 -0.0415 0.0048 -0.0385 268 LEU B CD1 4027 C CD2 . LEU B 187 ? 0.7052 0.5302 0.4131 -0.0440 0.0028 -0.0340 268 LEU B CD2 4028 N N . ASP B 188 ? 0.9529 0.7655 0.6475 -0.0450 0.0275 -0.0371 269 ASP B N 4029 C CA . ASP B 188 ? 1.0249 0.8351 0.7157 -0.0462 0.0351 -0.0405 269 ASP B CA 4030 C C . ASP B 188 ? 0.9595 0.7693 0.6547 -0.0465 0.0369 -0.0480 269 ASP B C 4031 O O . ASP B 188 ? 1.0405 0.8490 0.7281 -0.0481 0.0348 -0.0519 269 ASP B O 4032 C CB . ASP B 188 ? 1.1079 0.9163 0.7817 -0.0479 0.0365 -0.0389 269 ASP B CB 4033 C CG . ASP B 188 ? 1.2818 1.0877 0.9510 -0.0490 0.0451 -0.0411 269 ASP B CG 4034 O OD1 . ASP B 188 ? 1.0760 0.8823 0.7547 -0.0487 0.0498 -0.0452 269 ASP B OD1 4035 O OD2 . ASP B 188 ? 1.3673 1.1714 1.0231 -0.0501 0.0471 -0.0385 269 ASP B OD2 4036 N N . THR B 189 ? 0.9130 0.7240 0.6203 -0.0449 0.0410 -0.0501 270 THR B N 4037 C CA . THR B 189 ? 1.0148 0.8250 0.7268 -0.0440 0.0438 -0.0564 270 THR B CA 4038 C C . THR B 189 ? 1.0586 0.8694 0.7711 -0.0436 0.0523 -0.0587 270 THR B C 4039 O O . THR B 189 ? 1.1582 0.9715 0.8811 -0.0413 0.0559 -0.0613 270 THR B O 4040 C CB . THR B 189 ? 1.0923 0.9052 0.8197 -0.0414 0.0412 -0.0567 270 THR B CB 4041 O OG1 . THR B 189 ? 1.0559 0.8733 0.7945 -0.0397 0.0453 -0.0553 270 THR B OG1 4042 C CG2 . THR B 189 ? 1.0382 0.8520 0.7672 -0.0416 0.0332 -0.0527 270 THR B CG2 4043 N N . THR B 190 ? 0.8537 0.6630 0.5549 -0.0457 0.0554 -0.0570 271 THR B N 4044 C CA . THR B 190 ? 0.9891 0.7993 0.6894 -0.0458 0.0638 -0.0589 271 THR B CA 4045 C C . THR B 190 ? 1.0106 0.8185 0.7083 -0.0448 0.0680 -0.0656 271 THR B C 4046 O O . THR B 190 ? 1.0076 0.8104 0.6925 -0.0464 0.0669 -0.0686 271 THR B O 4047 C CB . THR B 190 ? 1.1246 0.9325 0.8113 -0.0484 0.0664 -0.0556 271 THR B CB 4048 O OG1 . THR B 190 ? 1.1757 0.9842 0.8649 -0.0489 0.0637 -0.0491 271 THR B OG1 4049 C CG2 . THR B 190 ? 0.8722 0.6814 0.5580 -0.0489 0.0755 -0.0578 271 THR B CG2 4050 N N . GLY B 191 ? 0.9447 0.7565 0.6541 -0.0420 0.0729 -0.0680 272 GLY B N 4051 C CA . GLY B 191 ? 1.0761 0.8853 0.7837 -0.0399 0.0784 -0.0739 272 GLY B CA 4052 C C . GLY B 191 ? 1.1593 0.9651 0.8717 -0.0375 0.0754 -0.0772 272 GLY B C 4053 O O . GLY B 191 ? 1.1573 0.9585 0.8666 -0.0356 0.0800 -0.0823 272 GLY B O 4054 N N . PHE B 192 ? 1.1037 0.9109 0.8232 -0.0374 0.0681 -0.0743 273 PHE B N 4055 C CA . PHE B 192 ? 1.0485 0.8531 0.7747 -0.0349 0.0654 -0.0767 273 PHE B CA 4056 C C . PHE B 192 ? 0.9642 0.7740 0.7037 -0.0335 0.0594 -0.0724 273 PHE B C 4057 O O . PHE B 192 ? 1.1320 0.9469 0.8752 -0.0347 0.0569 -0.0677 273 PHE B O 4058 C CB . PHE B 192 ? 0.9890 0.7848 0.7027 -0.0378 0.0624 -0.0806 273 PHE B CB 4059 C CG . PHE B 192 ? 0.9972 0.7934 0.7041 -0.0419 0.0544 -0.0773 273 PHE B CG 4060 C CD1 . PHE B 192 ? 0.9395 0.7370 0.6356 -0.0448 0.0542 -0.0747 273 PHE B CD1 4061 C CD2 . PHE B 192 ? 0.9168 0.7127 0.6279 -0.0424 0.0474 -0.0764 273 PHE B CD2 4062 C CE1 . PHE B 192 ? 0.7877 0.5865 0.4774 -0.0476 0.0470 -0.0710 273 PHE B CE1 4063 C CE2 . PHE B 192 ? 0.9253 0.7231 0.6306 -0.0457 0.0402 -0.0730 273 PHE B CE2 4064 C CZ . PHE B 192 ? 0.8766 0.6761 0.5712 -0.0480 0.0399 -0.0701 273 PHE B CZ 4065 N N . ASN B 193 ? 0.7868 0.5943 0.5327 -0.0309 0.0577 -0.0743 274 ASN B N 4066 C CA . ASN B 193 ? 0.9173 0.7291 0.6754 -0.0292 0.0523 -0.0709 274 ASN B CA 4067 C C . ASN B 193 ? 1.0421 0.8480 0.7965 -0.0310 0.0461 -0.0718 274 ASN B C 4068 O O . ASN B 193 ? 1.0635 0.8618 0.8104 -0.0319 0.0478 -0.0765 274 ASN B O 4069 C CB . ASN B 193 ? 0.9420 0.7589 0.7135 -0.0238 0.0565 -0.0714 274 ASN B CB 4070 C CG . ASN B 193 ? 0.8760 0.6953 0.6586 -0.0215 0.0515 -0.0690 274 ASN B CG 4071 O OD1 . ASN B 193 ? 0.9305 0.7465 0.7172 -0.0180 0.0527 -0.0710 274 ASN B OD1 4072 N ND2 . ASN B 193 ? 0.7871 0.6116 0.5743 -0.0233 0.0464 -0.0647 274 ASN B ND2 4073 N N . PHE B 194 ? 0.9668 0.7763 0.7263 -0.0318 0.0395 -0.0676 275 PHE B N 4074 C CA . PHE B 194 ? 0.8325 0.6385 0.5886 -0.0342 0.0330 -0.0676 275 PHE B CA 4075 C C . PHE B 194 ? 0.8362 0.6454 0.6050 -0.0318 0.0287 -0.0648 275 PHE B C 4076 O O . PHE B 194 ? 0.7624 0.5753 0.5337 -0.0328 0.0231 -0.0605 275 PHE B O 4077 C CB . PHE B 194 ? 0.8523 0.6596 0.5986 -0.0382 0.0284 -0.0647 275 PHE B CB 4078 C CG . PHE B 194 ? 0.9323 0.7373 0.6722 -0.0417 0.0224 -0.0657 275 PHE B CG 4079 C CD1 . PHE B 194 ? 0.9466 0.7452 0.6771 -0.0445 0.0240 -0.0715 275 PHE B CD1 4080 C CD2 . PHE B 194 ? 0.8991 0.7087 0.6420 -0.0423 0.0155 -0.0609 275 PHE B CD2 4081 C CE1 . PHE B 194 ? 0.9291 0.7268 0.6536 -0.0488 0.0183 -0.0729 275 PHE B CE1 4082 C CE2 . PHE B 194 ? 0.9122 0.7217 0.6498 -0.0458 0.0099 -0.0617 275 PHE B CE2 4083 C CZ . PHE B 194 ? 0.7783 0.5823 0.5068 -0.0494 0.0111 -0.0679 275 PHE B CZ 4084 N N . GLU B 195 ? 0.7583 0.5659 0.5348 -0.0281 0.0317 -0.0669 276 GLU B N 4085 C CA . GLU B 195 ? 0.7574 0.5679 0.5457 -0.0254 0.0282 -0.0643 276 GLU B CA 4086 C C . GLU B 195 ? 0.8651 0.6700 0.6511 -0.0275 0.0238 -0.0656 276 GLU B C 4087 O O . GLU B 195 ? 0.9103 0.7076 0.6871 -0.0302 0.0251 -0.0700 276 GLU B O 4088 C CB . GLU B 195 ? 0.8172 0.6300 0.6155 -0.0198 0.0334 -0.0650 276 GLU B CB 4089 C CG . GLU B 195 ? 0.9531 0.7741 0.7561 -0.0179 0.0377 -0.0636 276 GLU B CG 4090 C CD . GLU B 195 ? 0.9712 0.8002 0.7798 -0.0194 0.0338 -0.0589 276 GLU B CD 4091 O OE1 . GLU B 195 ? 0.9454 0.7758 0.7595 -0.0192 0.0285 -0.0563 276 GLU B OE1 4092 O OE2 . GLU B 195 ? 0.9707 0.8039 0.7780 -0.0209 0.0365 -0.0581 276 GLU B OE2 4093 N N . PHE B 196 ? 0.8843 0.6932 0.6786 -0.0266 0.0187 -0.0619 277 PHE B N 4094 C CA . PHE B 196 ? 0.7891 0.5941 0.5843 -0.0281 0.0148 -0.0625 277 PHE B CA 4095 C C . PHE B 196 ? 0.8286 0.6289 0.6122 -0.0340 0.0119 -0.0654 277 PHE B C 4096 O O . PHE B 196 ? 0.9753 0.7683 0.7560 -0.0357 0.0130 -0.0693 277 PHE B O 4097 C CB . PHE B 196 ? 0.6752 0.4748 0.4758 -0.0242 0.0192 -0.0649 277 PHE B CB 4098 C CG . PHE B 196 ? 0.8381 0.6433 0.6488 -0.0182 0.0230 -0.0628 277 PHE B CG 4099 C CD1 . PHE B 196 ? 0.8321 0.6459 0.6534 -0.0159 0.0196 -0.0581 277 PHE B CD1 4100 C CD2 . PHE B 196 ? 0.7778 0.5809 0.5874 -0.0149 0.0301 -0.0656 277 PHE B CD2 4101 C CE1 . PHE B 196 ? 0.7298 0.5508 0.5604 -0.0110 0.0228 -0.0564 277 PHE B CE1 4102 C CE2 . PHE B 196 ? 0.8213 0.6322 0.6409 -0.0094 0.0335 -0.0634 277 PHE B CE2 4103 C CZ . PHE B 196 ? 0.7867 0.6070 0.6168 -0.0077 0.0296 -0.0589 277 PHE B CZ 4104 N N . PRO B 197 ? 0.8365 0.6411 0.6133 -0.0373 0.0084 -0.0634 278 PRO B N 4105 C CA . PRO B 197 ? 0.7044 0.5068 0.4701 -0.0431 0.0051 -0.0661 278 PRO B CA 4106 C C . PRO B 197 ? 0.7656 0.5682 0.5355 -0.0451 0.0003 -0.0659 278 PRO B C 4107 O O . PRO B 197 ? 0.8116 0.6192 0.5914 -0.0425 -0.0030 -0.0613 278 PRO B O 4108 C CB . PRO B 197 ? 0.7863 0.5957 0.5468 -0.0445 0.0013 -0.0618 278 PRO B CB 4109 C CG . PRO B 197 ? 0.8977 0.7124 0.6689 -0.0399 0.0009 -0.0562 278 PRO B CG 4110 C CD . PRO B 197 ? 0.7781 0.5900 0.5574 -0.0359 0.0065 -0.0582 278 PRO B CD 4111 N N . THR B 198 ? 0.9561 0.7528 0.7185 -0.0500 0.0004 -0.0710 279 THR B N 4112 C CA . THR B 198 ? 0.9042 0.7013 0.6692 -0.0534 -0.0041 -0.0713 279 THR B CA 4113 C C . THR B 198 ? 0.8760 0.6764 0.6295 -0.0607 -0.0083 -0.0735 279 THR B C 4114 O O . THR B 198 ? 0.8470 0.6430 0.5889 -0.0641 -0.0055 -0.0783 279 THR B O 4115 C CB . THR B 198 ? 0.7564 0.5428 0.5246 -0.0528 0.0006 -0.0755 279 THR B CB 4116 O OG1 . THR B 198 ? 0.8170 0.6040 0.5877 -0.0569 -0.0036 -0.0756 279 THR B OG1 4117 C CG2 . THR B 198 ? 0.6849 0.4602 0.4418 -0.0554 0.0070 -0.0826 279 THR B CG2 4118 N N . CYS B 199 ? 0.8893 0.6987 0.6457 -0.0630 -0.0152 -0.0699 280 CYS B N 4119 C CA . CYS B 199 ? 0.8589 0.6764 0.6057 -0.0679 -0.0202 -0.0694 280 CYS B CA 4120 C C . CYS B 199 ? 0.9165 0.7389 0.6621 -0.0746 -0.0256 -0.0711 280 CYS B C 4121 O O . CYS B 199 ? 0.7764 0.5965 0.5302 -0.0748 -0.0260 -0.0713 280 CYS B O 4122 C CB . CYS B 199 ? 0.7685 0.5961 0.5189 -0.0633 -0.0239 -0.0614 280 CYS B CB 4123 S SG . CYS B 199 ? 1.1270 0.9503 0.8807 -0.0562 -0.0178 -0.0589 280 CYS B SG 4124 N N . TYR B 200 ? 0.7473 0.5772 0.4824 -0.0800 -0.0297 -0.0720 281 TYR B N 4125 C CA . TYR B 200 ? 0.8216 0.6611 0.5560 -0.0865 -0.0361 -0.0723 281 TYR B CA 4126 C C . TYR B 200 ? 0.8718 0.7256 0.5987 -0.0880 -0.0421 -0.0683 281 TYR B C 4127 O O . TYR B 200 ? 0.8141 0.6676 0.5332 -0.0857 -0.0404 -0.0672 281 TYR B O 4128 C CB . TYR B 200 ? 0.8188 0.6496 0.5460 -0.0950 -0.0336 -0.0815 281 TYR B CB 4129 C CG . TYR B 200 ? 0.8392 0.6644 0.5510 -0.0996 -0.0304 -0.0878 281 TYR B CG 4130 C CD1 . TYR B 200 ? 0.9034 0.7169 0.6119 -0.0951 -0.0231 -0.0900 281 TYR B CD1 4131 C CD2 . TYR B 200 ? 0.9223 0.7549 0.6228 -0.1085 -0.0345 -0.0917 281 TYR B CD2 4132 C CE1 . TYR B 200 ? 0.7964 0.6046 0.4904 -0.0990 -0.0196 -0.0958 281 TYR B CE1 4133 C CE2 . TYR B 200 ? 0.8810 0.7084 0.5664 -0.1129 -0.0314 -0.0978 281 TYR B CE2 4134 C CZ . TYR B 200 ? 0.9000 0.7146 0.5821 -0.1080 -0.0238 -0.0998 281 TYR B CZ 4135 O OH . TYR B 200 ? 0.9280 0.7372 0.5948 -0.1122 -0.0202 -0.1059 281 TYR B OH 4136 N N . TYR B 201 ? 0.8258 0.6928 0.5552 -0.0916 -0.0490 -0.0659 282 TYR B N 4137 C CA . TYR B 201 ? 0.8104 0.6932 0.5335 -0.0926 -0.0551 -0.0613 282 TYR B CA 4138 C C . TYR B 201 ? 0.8427 0.7333 0.5554 -0.1031 -0.0591 -0.0672 282 TYR B C 4139 O O . TYR B 201 ? 0.9358 0.8274 0.6519 -0.1095 -0.0606 -0.0712 282 TYR B O 4140 C CB . TYR B 201 ? 0.8370 0.7327 0.5714 -0.0871 -0.0605 -0.0521 282 TYR B CB 4141 C CG . TYR B 201 ? 1.0219 0.9350 0.7502 -0.0873 -0.0669 -0.0465 282 TYR B CG 4142 C CD1 . TYR B 201 ? 0.9387 0.8536 0.6614 -0.0812 -0.0662 -0.0408 282 TYR B CD1 4143 C CD2 . TYR B 201 ? 0.9478 0.8762 0.6756 -0.0938 -0.0734 -0.0470 282 TYR B CD2 4144 C CE1 . TYR B 201 ? 0.9224 0.8530 0.6389 -0.0805 -0.0717 -0.0351 282 TYR B CE1 4145 C CE2 . TYR B 201 ? 1.0488 0.9949 0.7710 -0.0933 -0.0794 -0.0415 282 TYR B CE2 4146 C CZ . TYR B 201 ? 1.0445 0.9913 0.7610 -0.0862 -0.0784 -0.0353 282 TYR B CZ 4147 O OH . TYR B 201 ? 0.9621 0.9262 0.6727 -0.0847 -0.0840 -0.0289 282 TYR B OH 4148 N N . THR B 202 ? 0.7796 0.6757 0.4791 -0.1053 -0.0604 -0.0677 283 THR B N 4149 C CA . THR B 202 ? 1.1021 1.0134 0.7925 -0.1138 -0.0668 -0.0699 283 THR B CA 4150 C C . THR B 202 ? 1.1193 1.0396 0.7972 -0.1127 -0.0690 -0.0668 283 THR B C 4151 O O . THR B 202 ? 0.9325 0.8431 0.6050 -0.1077 -0.0640 -0.0660 283 THR B O 4152 C CB . THR B 202 ? 1.1816 1.0862 0.8630 -0.1259 -0.0650 -0.0816 283 THR B CB 4153 O OG1 . THR B 202 ? 0.8944 0.7796 0.5679 -0.1259 -0.0568 -0.0883 283 THR B OG1 4154 C CG2 . THR B 202 ? 1.0352 0.9398 0.7267 -0.1312 -0.0663 -0.0845 283 THR B CG2 4155 N N . SER B 203 ? 1.1585 1.0979 0.8316 -0.1178 -0.0764 -0.0653 284 SER B N 4156 C CA . SER B 203 ? 0.9887 0.9393 0.6481 -0.1184 -0.0795 -0.0629 284 SER B CA 4157 C C . SER B 203 ? 0.9141 0.8636 0.5749 -0.1068 -0.0777 -0.0532 284 SER B C 4158 O O . SER B 203 ? 1.0111 0.9543 0.6607 -0.1051 -0.0741 -0.0538 284 SER B O 4159 C CB . SER B 203 ? 1.1081 1.0480 0.7517 -0.1262 -0.0751 -0.0732 284 SER B CB 4160 O OG . SER B 203 ? 1.1813 1.1268 0.8197 -0.1384 -0.0782 -0.0816 284 SER B OG 4161 N N . GLY B 204 ? 1.0007 0.9554 0.6750 -0.0990 -0.0798 -0.0446 285 GLY B N 4162 C CA . GLY B 204 ? 1.0830 1.0370 0.7592 -0.0880 -0.0782 -0.0347 285 GLY B CA 4163 C C . GLY B 204 ? 1.0592 0.9931 0.7358 -0.0833 -0.0698 -0.0361 285 GLY B C 4164 O O . GLY B 204 ? 1.1817 1.1134 0.8569 -0.0756 -0.0676 -0.0291 285 GLY B O 4165 N N . LYS B 205 ? 0.9966 0.9161 0.6750 -0.0876 -0.0649 -0.0450 286 LYS B N 4166 C CA . LYS B 205 ? 0.9307 0.8327 0.6104 -0.0833 -0.0569 -0.0468 286 LYS B CA 4167 C C . LYS B 205 ? 0.8501 0.7407 0.5427 -0.0825 -0.0532 -0.0504 286 LYS B C 4168 O O . LYS B 205 ? 1.0460 0.9372 0.7429 -0.0879 -0.0550 -0.0552 286 LYS B O 4169 C CB . LYS B 205 ? 1.0457 0.9398 0.7107 -0.0879 -0.0525 -0.0539 286 LYS B CB 4170 C CG . LYS B 205 ? 1.0854 0.9862 0.7384 -0.0853 -0.0534 -0.0486 286 LYS B CG 4171 C CD . LYS B 205 ? 1.1339 1.0278 0.7716 -0.0903 -0.0492 -0.0558 286 LYS B CD 4172 C CE . LYS B 205 ? 1.1834 1.0901 0.8071 -0.0911 -0.0533 -0.0516 286 LYS B CE 4173 N NZ . LYS B 205 ? 1.4064 1.3078 1.0139 -0.0975 -0.0500 -0.0597 286 LYS B NZ 4174 N N . VAL B 206 ? 0.8370 0.7176 0.5357 -0.0758 -0.0479 -0.0477 287 VAL B N 4175 C CA . VAL B 206 ? 0.8304 0.6993 0.5394 -0.0745 -0.0433 -0.0515 287 VAL B CA 4176 C C . VAL B 206 ? 0.9292 0.7851 0.6307 -0.0761 -0.0361 -0.0584 287 VAL B C 4177 O O . VAL B 206 ? 0.7951 0.6487 0.4895 -0.0736 -0.0329 -0.0568 287 VAL B O 4178 C CB . VAL B 206 ? 0.8484 0.7160 0.5699 -0.0664 -0.0421 -0.0445 287 VAL B CB 4179 C CG1 . VAL B 206 ? 0.8376 0.6934 0.5684 -0.0647 -0.0367 -0.0484 287 VAL B CG1 4180 C CG2 . VAL B 206 ? 0.8655 0.7451 0.5949 -0.0645 -0.0486 -0.0380 287 VAL B CG2 4181 N N . LYS B 207 ? 0.9754 0.8224 0.6779 -0.0802 -0.0331 -0.0660 288 LYS B N 4182 C CA . LYS B 207 ? 0.9478 0.7822 0.6432 -0.0814 -0.0257 -0.0728 288 LYS B CA 4183 C C . LYS B 207 ? 0.8203 0.6442 0.5274 -0.0768 -0.0203 -0.0740 288 LYS B C 4184 O O . LYS B 207 ? 0.8856 0.7089 0.6019 -0.0773 -0.0220 -0.0743 288 LYS B O 4185 C CB . LYS B 207 ? 0.8576 0.6895 0.5406 -0.0904 -0.0259 -0.0812 288 LYS B CB 4186 C CG . LYS B 207 ? 1.1031 0.9469 0.7729 -0.0950 -0.0312 -0.0802 288 LYS B CG 4187 C CD . LYS B 207 ? 0.9875 0.8331 0.6476 -0.1056 -0.0338 -0.0881 288 LYS B CD 4188 C CE . LYS B 207 ? 1.1116 0.9718 0.7589 -0.1102 -0.0400 -0.0867 288 LYS B CE 4189 N NZ . LYS B 207 ? 1.0368 0.8917 0.6671 -0.1138 -0.0359 -0.0923 288 LYS B NZ 4190 N N . CYS B 208 ? 0.8456 0.6625 0.5527 -0.0723 -0.0139 -0.0742 289 CYS B N 4191 C CA . CYS B 208 ? 0.8725 0.6820 0.5912 -0.0669 -0.0088 -0.0744 289 CYS B CA 4192 C C . CYS B 208 ? 0.8405 0.6387 0.5538 -0.0665 -0.0006 -0.0806 289 CYS B C 4193 O O . CYS B 208 ? 0.8650 0.6620 0.5679 -0.0675 0.0023 -0.0823 289 CYS B O 4194 C CB . CYS B 208 ? 0.6939 0.5083 0.4217 -0.0602 -0.0089 -0.0670 289 CYS B CB 4195 S SG . CYS B 208 ? 1.2783 1.1039 1.0150 -0.0586 -0.0169 -0.0591 289 CYS B SG 4196 N N . THR B 209 ? 0.8222 0.6122 0.5424 -0.0647 0.0035 -0.0838 290 THR B N 4197 C CA . THR B 209 ? 0.7596 0.5390 0.4774 -0.0623 0.0120 -0.0886 290 THR B CA 4198 C C . THR B 209 ? 0.8638 0.6448 0.5948 -0.0543 0.0152 -0.0842 290 THR B C 4199 O O . THR B 209 ? 0.8566 0.6403 0.5994 -0.0514 0.0127 -0.0807 290 THR B O 4200 C CB . THR B 209 ? 0.8823 0.6504 0.5978 -0.0653 0.0152 -0.0951 290 THR B CB 4201 O OG1 . THR B 209 ? 0.9563 0.7242 0.6598 -0.0739 0.0117 -0.0995 290 THR B OG1 4202 C CG2 . THR B 209 ? 0.8253 0.5819 0.5379 -0.0618 0.0248 -0.0998 290 THR B CG2 4203 N N . GLY B 210 ? 0.8267 0.6070 0.5557 -0.0511 0.0207 -0.0843 291 GLY B N 4204 C CA . GLY B 210 ? 0.8486 0.6323 0.5899 -0.0443 0.0237 -0.0805 291 GLY B CA 4205 C C . GLY B 210 ? 0.8409 0.6172 0.5851 -0.0399 0.0319 -0.0842 291 GLY B C 4206 O O . GLY B 210 ? 0.9370 0.7033 0.6736 -0.0418 0.0359 -0.0900 291 GLY B O 4207 N N . THR B 211 ? 0.8755 0.6570 0.6305 -0.0340 0.0347 -0.0808 292 THR B N 4208 C CA . THR B 211 ? 0.8193 0.5965 0.5782 -0.0287 0.0427 -0.0833 292 THR B CA 4209 C C . THR B 211 ? 0.8668 0.6508 0.6277 -0.0258 0.0470 -0.0817 292 THR B C 4210 O O . THR B 211 ? 1.0130 0.8067 0.7813 -0.0249 0.0442 -0.0769 292 THR B O 4211 C CB . THR B 211 ? 0.7100 0.4877 0.4818 -0.0236 0.0425 -0.0810 292 THR B CB 4212 O OG1 . THR B 211 ? 0.9256 0.6961 0.6946 -0.0270 0.0391 -0.0828 292 THR B OG1 4213 C CG2 . THR B 211 ? 0.7273 0.5014 0.5029 -0.0171 0.0509 -0.0829 292 THR B CG2 4214 N N . ASN B 212 ? 0.9406 0.7192 0.6943 -0.0248 0.0542 -0.0859 293 ASN B N 4215 C CA . ASN B 212 ? 1.0143 0.7994 0.7692 -0.0226 0.0592 -0.0848 293 ASN B CA 4216 C C . ASN B 212 ? 0.9788 0.7662 0.7441 -0.0151 0.0659 -0.0848 293 ASN B C 4217 O O . ASN B 212 ? 0.8625 0.6410 0.6238 -0.0122 0.0724 -0.0890 293 ASN B O 4218 C CB . ASN B 212 ? 1.0845 0.8641 0.8240 -0.0265 0.0628 -0.0889 293 ASN B CB 4219 C CG . ASN B 212 ? 1.0975 0.8845 0.8377 -0.0251 0.0675 -0.0873 293 ASN B CG 4220 O OD1 . ASN B 212 ? 1.0564 0.8513 0.8085 -0.0204 0.0705 -0.0848 293 ASN B OD1 4221 N ND2 . ASN B 212 ? 1.1117 0.8967 0.8388 -0.0296 0.0681 -0.0887 293 ASN B ND2 4222 N N . LEU B 213 ? 0.8805 0.6798 0.6588 -0.0120 0.0646 -0.0801 294 LEU B N 4223 C CA . LEU B 213 ? 0.9287 0.7343 0.7193 -0.0046 0.0694 -0.0788 294 LEU B CA 4224 C C . LEU B 213 ? 0.9351 0.7474 0.7263 -0.0026 0.0763 -0.0793 294 LEU B C 4225 O O . LEU B 213 ? 0.9606 0.7796 0.7612 0.0038 0.0814 -0.0785 294 LEU B O 4226 C CB . LEU B 213 ? 0.8525 0.6691 0.6570 -0.0029 0.0642 -0.0737 294 LEU B CB 4227 C CG . LEU B 213 ? 0.9080 0.7211 0.7182 -0.0008 0.0600 -0.0722 294 LEU B CG 4228 C CD1 . LEU B 213 ? 1.0515 0.8496 0.8515 -0.0027 0.0602 -0.0762 294 LEU B CD1 4229 C CD2 . LEU B 213 ? 0.8171 0.6363 0.6315 -0.0045 0.0520 -0.0684 294 LEU B CD2 4230 N N . TRP B 214 ? 0.9029 0.7144 0.6843 -0.0079 0.0764 -0.0804 295 TRP B N 4231 C CA . TRP B 214 ? 0.9555 0.7743 0.7372 -0.0073 0.0824 -0.0805 295 TRP B CA 4232 C C . TRP B 214 ? 0.9595 0.7690 0.7300 -0.0061 0.0901 -0.0856 295 TRP B C 4233 O O . TRP B 214 ? 0.8538 0.6659 0.6295 0.0000 0.0972 -0.0866 295 TRP B O 4234 C CB . TRP B 214 ? 0.8704 0.6938 0.6482 -0.0135 0.0785 -0.0779 295 TRP B CB 4235 C CG . TRP B 214 ? 0.8987 0.7272 0.6735 -0.0145 0.0847 -0.0784 295 TRP B CG 4236 C CD1 . TRP B 214 ? 0.8387 0.6725 0.6180 -0.0100 0.0928 -0.0799 295 TRP B CD1 4237 C CD2 . TRP B 214 ? 0.9616 0.7905 0.7279 -0.0202 0.0839 -0.0770 295 TRP B CD2 4238 N NE1 . TRP B 214 ? 0.8865 0.7243 0.6609 -0.0132 0.0969 -0.0799 295 TRP B NE1 4239 C CE2 . TRP B 214 ? 0.9842 0.8184 0.7502 -0.0195 0.0917 -0.0780 295 TRP B CE2 4240 C CE3 . TRP B 214 ? 0.9180 0.7434 0.6769 -0.0255 0.0776 -0.0745 295 TRP B CE3 4241 C CZ2 . TRP B 214 ? 0.8020 0.6372 0.5601 -0.0242 0.0935 -0.0769 295 TRP B CZ2 4242 C CZ3 . TRP B 214 ? 0.9744 0.8006 0.7253 -0.0295 0.0794 -0.0730 295 TRP B CZ3 4243 C CH2 . TRP B 214 ? 0.8915 0.7220 0.6418 -0.0291 0.0874 -0.0743 295 TRP B CH2 4244 N N . ASN B 215 ? 0.8618 0.6612 0.6169 -0.0116 0.0888 -0.0887 296 ASN B N 4245 C CA . ASN B 215 ? 0.9356 0.7271 0.6785 -0.0117 0.0964 -0.0936 296 ASN B CA 4246 C C . ASN B 215 ? 1.0485 0.8248 0.7760 -0.0158 0.0953 -0.0988 296 ASN B C 4247 O O . ASN B 215 ? 1.0910 0.8620 0.8045 -0.0197 0.0979 -0.1021 296 ASN B O 4248 C CB . ASN B 215 ? 0.8532 0.6510 0.5908 -0.0152 0.0984 -0.0925 296 ASN B CB 4249 C CG . ASN B 215 ? 0.8735 0.6727 0.6059 -0.0218 0.0904 -0.0894 296 ASN B CG 4250 O OD1 . ASN B 215 ? 1.0067 0.8010 0.7362 -0.0245 0.0835 -0.0892 296 ASN B OD1 4251 N ND2 . ASN B 215 ? 0.9134 0.7196 0.6446 -0.0243 0.0917 -0.0867 296 ASN B ND2 4252 N N . ASP B 216 ? 0.9749 0.7446 0.7046 -0.0154 0.0917 -0.0996 297 ASP B N 4253 C CA . ASP B 216 ? 1.0090 0.7650 0.7242 -0.0206 0.0903 -0.1048 297 ASP B CA 4254 C C . ASP B 216 ? 0.8967 0.6433 0.6149 -0.0187 0.0899 -0.1067 297 ASP B C 4255 O O . ASP B 216 ? 0.9377 0.6884 0.6651 -0.0186 0.0834 -0.1030 297 ASP B O 4256 C CB . ASP B 216 ? 1.0849 0.8438 0.7929 -0.0282 0.0815 -0.1032 297 ASP B CB 4257 C CG . ASP B 216 ? 1.1772 0.9250 0.8685 -0.0347 0.0804 -0.1090 297 ASP B CG 4258 O OD1 . ASP B 216 ? 1.1263 0.8630 0.8091 -0.0341 0.0877 -0.1150 297 ASP B OD1 4259 O OD2 . ASP B 216 ? 1.1900 0.9403 0.8762 -0.0406 0.0724 -0.1076 297 ASP B OD2 4260 N N . ALA B 217 ? 0.9796 0.7125 0.6890 -0.0175 0.0972 -0.1126 298 ALA B N 4261 C CA . ALA B 217 ? 1.0048 0.7253 0.7140 -0.0166 0.0983 -0.1153 298 ALA B CA 4262 C C . ALA B 217 ? 1.0417 0.7539 0.7389 -0.0261 0.0922 -0.1192 298 ALA B C 4263 O O . ALA B 217 ? 1.1468 0.8489 0.8435 -0.0272 0.0918 -0.1215 298 ALA B O 4264 C CB . ALA B 217 ? 1.0226 0.7305 0.7272 -0.0109 0.1099 -0.1199 298 ALA B CB 4265 N N . LYS B 218 ? 0.9489 0.6656 0.6361 -0.0331 0.0877 -0.1201 299 LYS B N 4266 C CA . LYS B 218 ? 0.8557 0.5706 0.5343 -0.0420 0.0797 -0.1220 299 LYS B CA 4267 C C . LYS B 218 ? 0.9036 0.6325 0.5939 -0.0423 0.0700 -0.1146 299 LYS B C 4268 O O . LYS B 218 ? 0.9996 0.7383 0.7022 -0.0366 0.0700 -0.1090 299 LYS B O 4269 C CB . LYS B 218 ? 0.9357 0.6493 0.5970 -0.0491 0.0796 -0.1262 299 LYS B CB 4270 C CG . LYS B 218 ? 1.0882 0.7858 0.7346 -0.0512 0.0881 -0.1349 299 LYS B CG 4271 C CD . LYS B 218 ? 1.0966 0.7929 0.7245 -0.0607 0.0852 -0.1397 299 LYS B CD 4272 C CE . LYS B 218 ? 1.1081 0.8075 0.7276 -0.0597 0.0900 -0.1402 299 LYS B CE 4273 N NZ . LYS B 218 ? 1.1532 0.8544 0.7555 -0.0687 0.0855 -0.1433 299 LYS B NZ 4274 N N . ARG B 219 ? 1.0058 0.7360 0.6921 -0.0490 0.0620 -0.1146 300 ARG B N 4275 C CA . ARG B 219 ? 0.9381 0.6806 0.6351 -0.0489 0.0532 -0.1077 300 ARG B CA 4276 C C . ARG B 219 ? 0.9416 0.6931 0.6311 -0.0541 0.0468 -0.1052 300 ARG B C 4277 O O . ARG B 219 ? 0.8708 0.6202 0.5481 -0.0610 0.0435 -0.1087 300 ARG B O 4278 C CB . ARG B 219 ? 0.8105 0.5499 0.5126 -0.0511 0.0486 -0.1078 300 ARG B CB 4279 C CG . ARG B 219 ? 0.7836 0.5136 0.4933 -0.0457 0.0545 -0.1092 300 ARG B CG 4280 C CD . ARG B 219 ? 0.8818 0.6109 0.5971 -0.0484 0.0487 -0.1080 300 ARG B CD 4281 N NE . ARG B 219 ? 0.9477 0.6696 0.6723 -0.0423 0.0534 -0.1075 300 ARG B NE 4282 C CZ . ARG B 219 ? 0.8463 0.5756 0.5853 -0.0346 0.0533 -0.1016 300 ARG B CZ 4283 N NH1 . ARG B 219 ? 0.7503 0.4936 0.4960 -0.0327 0.0491 -0.0963 300 ARG B NH1 4284 N NH2 . ARG B 219 ? 0.8461 0.5687 0.5923 -0.0289 0.0578 -0.1010 300 ARG B NH2 4285 N N . PRO B 220 ? 0.9870 0.7489 0.6837 -0.0507 0.0449 -0.0988 301 PRO B N 4286 C CA . PRO B 220 ? 0.9094 0.6797 0.5999 -0.0542 0.0392 -0.0950 301 PRO B CA 4287 C C . PRO B 220 ? 0.9246 0.6992 0.6157 -0.0584 0.0301 -0.0930 301 PRO B C 4288 O O . PRO B 220 ? 0.9510 0.7251 0.6524 -0.0569 0.0278 -0.0920 301 PRO B O 4289 C CB . PRO B 220 ? 0.7674 0.5460 0.4693 -0.0490 0.0397 -0.0885 301 PRO B CB 4290 C CG . PRO B 220 ? 0.7583 0.5365 0.4753 -0.0442 0.0403 -0.0874 301 PRO B CG 4291 C CD . PRO B 220 ? 0.8663 0.6334 0.5794 -0.0438 0.0462 -0.0940 301 PRO B CD 4292 N N . PHE B 221 ? 0.8106 0.5900 0.4908 -0.0633 0.0253 -0.0922 302 PHE B N 4293 C CA . PHE B 221 ? 0.8668 0.6517 0.5459 -0.0678 0.0169 -0.0907 302 PHE B CA 4294 C C . PHE B 221 ? 0.9713 0.7671 0.6479 -0.0676 0.0114 -0.0836 302 PHE B C 4295 O O . PHE B 221 ? 0.9807 0.7776 0.6506 -0.0665 0.0143 -0.0820 302 PHE B O 4296 C CB . PHE B 221 ? 0.9040 0.6835 0.5693 -0.0752 0.0168 -0.0982 302 PHE B CB 4297 C CG . PHE B 221 ? 0.9952 0.7814 0.6597 -0.0808 0.0083 -0.0977 302 PHE B CG 4298 C CD1 . PHE B 221 ? 0.8692 0.6664 0.5256 -0.0842 0.0017 -0.0944 302 PHE B CD1 4299 C CD2 . PHE B 221 ? 1.0543 0.8358 0.7253 -0.0827 0.0074 -0.1006 302 PHE B CD2 4300 C CE1 . PHE B 221 ? 0.9064 0.7117 0.5626 -0.0894 -0.0060 -0.0939 302 PHE B CE1 4301 C CE2 . PHE B 221 ? 0.9976 0.7861 0.6682 -0.0884 0.0000 -0.1004 302 PHE B CE2 4302 C CZ . PHE B 221 ? 0.9880 0.7891 0.6515 -0.0918 -0.0068 -0.0971 302 PHE B CZ 4303 N N . LEU B 222 ? 0.8734 0.6770 0.5552 -0.0684 0.0038 -0.0792 303 LEU B N 4304 C CA . LEU B 222 ? 0.7501 0.5632 0.4327 -0.0662 -0.0008 -0.0712 303 LEU B CA 4305 C C . LEU B 222 ? 0.8990 0.7207 0.5797 -0.0699 -0.0091 -0.0693 303 LEU B C 4306 O O . LEU B 222 ? 0.9326 0.7543 0.6204 -0.0716 -0.0119 -0.0711 303 LEU B O 4307 C CB . LEU B 222 ? 0.9052 0.7193 0.6031 -0.0600 0.0001 -0.0657 303 LEU B CB 4308 C CG . LEU B 222 ? 0.8785 0.6990 0.5798 -0.0562 -0.0021 -0.0573 303 LEU B CG 4309 C CD1 . LEU B 222 ? 0.8687 0.6958 0.5786 -0.0551 -0.0089 -0.0525 303 LEU B CD1 4310 C CD2 . LEU B 222 ? 0.7952 0.6188 0.4824 -0.0576 -0.0024 -0.0548 303 LEU B CD2 4311 N N . GLU B 223 ? 0.9671 0.7966 0.6379 -0.0712 -0.0129 -0.0655 304 GLU B N 4312 C CA . GLU B 223 ? 1.0378 0.8787 0.7085 -0.0734 -0.0212 -0.0617 304 GLU B CA 4313 C C . GLU B 223 ? 1.0374 0.8861 0.7081 -0.0683 -0.0238 -0.0521 304 GLU B C 4314 O O . GLU B 223 ? 1.0526 0.8983 0.7173 -0.0657 -0.0196 -0.0498 304 GLU B O 4315 C CB . GLU B 223 ? 1.0681 0.9129 0.7252 -0.0812 -0.0243 -0.0673 304 GLU B CB 4316 C CG . GLU B 223 ? 1.3069 1.1506 0.9482 -0.0829 -0.0213 -0.0691 304 GLU B CG 4317 C CD . GLU B 223 ? 1.4273 1.2791 1.0548 -0.0906 -0.0264 -0.0728 304 GLU B CD 4318 O OE1 . GLU B 223 ? 1.4016 1.2621 1.0191 -0.0901 -0.0291 -0.0681 304 GLU B OE1 4319 O OE2 . GLU B 223 ? 1.2419 1.0913 0.8683 -0.0972 -0.0273 -0.0802 304 GLU B OE2 4320 N N . PHE B 224 ? 0.8979 0.7558 0.5756 -0.0667 -0.0301 -0.0464 305 PHE B N 4321 C CA . PHE B 224 ? 0.8219 0.6866 0.4998 -0.0613 -0.0324 -0.0367 305 PHE B CA 4322 C C . PHE B 224 ? 0.9386 0.8165 0.6193 -0.0617 -0.0405 -0.0322 305 PHE B C 4323 O O . PHE B 224 ? 0.9119 0.7929 0.5986 -0.0655 -0.0439 -0.0360 305 PHE B O 4324 C CB . PHE B 224 ? 0.8925 0.7505 0.5819 -0.0550 -0.0281 -0.0326 305 PHE B CB 4325 C CG . PHE B 224 ? 0.8330 0.6905 0.5374 -0.0538 -0.0298 -0.0331 305 PHE B CG 4326 C CD1 . PHE B 224 ? 0.7558 0.6214 0.4673 -0.0510 -0.0351 -0.0268 305 PHE B CD1 4327 C CD2 . PHE B 224 ? 0.8122 0.6611 0.5235 -0.0549 -0.0256 -0.0394 305 PHE B CD2 4328 C CE1 . PHE B 224 ? 0.8423 0.7074 0.5671 -0.0499 -0.0364 -0.0271 305 PHE B CE1 4329 C CE2 . PHE B 224 ? 0.8408 0.6893 0.5653 -0.0534 -0.0270 -0.0394 305 PHE B CE2 4330 C CZ . PHE B 224 ? 0.8365 0.6930 0.5676 -0.0511 -0.0324 -0.0333 305 PHE B CZ 4331 N N . ASP B 225 ? 1.0115 0.8976 0.6879 -0.0575 -0.0433 -0.0237 306 ASP B N 4332 C CA . ASP B 225 ? 1.0328 0.9334 0.7119 -0.0567 -0.0509 -0.0181 306 ASP B CA 4333 C C . ASP B 225 ? 0.9739 0.8748 0.6638 -0.0487 -0.0508 -0.0094 306 ASP B C 4334 O O . ASP B 225 ? 0.8451 0.7347 0.5400 -0.0450 -0.0451 -0.0085 306 ASP B O 4335 C CB . ASP B 225 ? 1.1299 1.0421 0.7948 -0.0579 -0.0547 -0.0148 306 ASP B CB 4336 C CG . ASP B 225 ? 1.2874 1.1958 0.9448 -0.0516 -0.0508 -0.0075 306 ASP B CG 4337 O OD1 . ASP B 225 ? 1.2483 1.1444 0.9108 -0.0475 -0.0447 -0.0062 306 ASP B OD1 4338 O OD2 . ASP B 225 ? 1.4244 1.3426 1.0703 -0.0510 -0.0539 -0.0030 306 ASP B OD2 4339 N N . GLN B 226 ? 0.9853 0.8994 0.6784 -0.0463 -0.0569 -0.0029 307 GLN B N 4340 C CA . GLN B 226 ? 1.0183 0.9320 0.7220 -0.0390 -0.0567 0.0047 307 GLN B CA 4341 C C . GLN B 226 ? 0.9936 0.9010 0.6926 -0.0318 -0.0521 0.0125 307 GLN B C 4342 O O . GLN B 226 ? 1.0440 0.9466 0.7509 -0.0261 -0.0499 0.0176 307 GLN B O 4343 C CB . GLN B 226 ? 1.0466 0.9765 0.7558 -0.0379 -0.0640 0.0094 307 GLN B CB 4344 C CG . GLN B 226 ? 1.2475 1.1909 0.9480 -0.0341 -0.0680 0.0179 307 GLN B CG 4345 C CD . GLN B 226 ? 1.4529 1.4117 1.1618 -0.0305 -0.0739 0.0246 307 GLN B CD 4346 O OE1 . GLN B 226 ? 1.6117 1.5692 1.3257 -0.0222 -0.0725 0.0329 307 GLN B OE1 4347 N NE2 . GLN B 226 ? 1.2809 1.2540 0.9912 -0.0369 -0.0803 0.0207 307 GLN B NE2 4348 N N . SER B 227 ? 0.9771 0.8835 0.6626 -0.0324 -0.0502 0.0131 309 SER B N 4349 C CA . SER B 227 ? 1.0247 0.9232 0.7046 -0.0263 -0.0449 0.0201 309 SER B CA 4350 C C . SER B 227 ? 0.9968 0.8802 0.6746 -0.0286 -0.0372 0.0145 309 SER B C 4351 O O . SER B 227 ? 1.0171 0.8935 0.6876 -0.0256 -0.0321 0.0185 309 SER B O 4352 C CB . SER B 227 ? 1.1092 1.0171 0.7752 -0.0243 -0.0474 0.0264 309 SER B CB 4353 O OG . SER B 227 ? 1.1942 1.1065 0.8506 -0.0314 -0.0493 0.0193 309 SER B OG 4354 N N . PHE B 228 ? 1.0299 0.9090 0.7141 -0.0337 -0.0363 0.0054 310 PHE B N 4355 C CA . PHE B 228 ? 0.8868 0.7533 0.5719 -0.0357 -0.0292 -0.0005 310 PHE B CA 4356 C C . PHE B 228 ? 0.9170 0.7802 0.5882 -0.0386 -0.0255 -0.0034 310 PHE B C 4357 O O . PHE B 228 ? 0.8768 0.7302 0.5473 -0.0388 -0.0187 -0.0059 310 PHE B O 4358 C CB . PHE B 228 ? 0.9161 0.7735 0.6090 -0.0310 -0.0240 0.0035 310 PHE B CB 4359 C CG . PHE B 228 ? 0.9752 0.8326 0.6832 -0.0299 -0.0256 0.0026 310 PHE B CG 4360 C CD1 . PHE B 228 ? 1.0728 0.9361 0.7866 -0.0332 -0.0306 -0.0023 310 PHE B CD1 4361 C CD2 . PHE B 228 ? 0.9653 0.8162 0.6809 -0.0258 -0.0220 0.0063 310 PHE B CD2 4362 C CE1 . PHE B 228 ? 0.9184 0.7816 0.6455 -0.0321 -0.0320 -0.0029 310 PHE B CE1 4363 C CE2 . PHE B 228 ? 0.9722 0.8234 0.7009 -0.0249 -0.0236 0.0054 310 PHE B CE2 4364 C CZ . PHE B 228 ? 0.9360 0.7936 0.6706 -0.0277 -0.0286 0.0010 310 PHE B CZ 4365 N N . THR B 229 ? 0.9392 0.8114 0.5993 -0.0410 -0.0299 -0.0032 311 THR B N 4366 C CA . THR B 229 ? 0.8971 0.7667 0.5443 -0.0454 -0.0271 -0.0084 311 THR B CA 4367 C C . THR B 229 ? 0.9433 0.8081 0.5944 -0.0513 -0.0257 -0.0194 311 THR B C 4368 O O . THR B 229 ? 0.9947 0.8652 0.6501 -0.0549 -0.0307 -0.0233 311 THR B O 4369 C CB . THR B 229 ? 1.0986 0.9804 0.7322 -0.0467 -0.0326 -0.0053 311 THR B CB 4370 O OG1 . THR B 229 ? 1.1299 1.0138 0.7582 -0.0402 -0.0321 0.0053 311 THR B OG1 4371 C CG2 . THR B 229 ? 0.7281 0.6074 0.3479 -0.0526 -0.0301 -0.0127 311 THR B CG2 4372 N N . TYR B 230 ? 0.8992 0.7535 0.5492 -0.0521 -0.0184 -0.0240 312 TYR B N 4373 C CA . TYR B 230 ? 0.9253 0.7735 0.5800 -0.0562 -0.0158 -0.0336 312 TYR B CA 4374 C C . TYR B 230 ? 0.8259 0.6678 0.4694 -0.0595 -0.0100 -0.0399 312 TYR B C 4375 O O . TYR B 230 ? 0.9367 0.7763 0.5718 -0.0579 -0.0060 -0.0369 312 TYR B O 4376 C CB . TYR B 230 ? 0.7359 0.5774 0.4062 -0.0529 -0.0121 -0.0338 312 TYR B CB 4377 C CG . TYR B 230 ? 0.8431 0.6776 0.5135 -0.0500 -0.0048 -0.0319 312 TYR B CG 4378 C CD1 . TYR B 230 ? 0.8069 0.6345 0.4750 -0.0518 0.0019 -0.0382 312 TYR B CD1 4379 C CD2 . TYR B 230 ? 0.9325 0.7670 0.6052 -0.0456 -0.0041 -0.0238 312 TYR B CD2 4380 C CE1 . TYR B 230 ? 0.8610 0.6836 0.5299 -0.0496 0.0088 -0.0364 312 TYR B CE1 4381 C CE2 . TYR B 230 ? 1.0068 0.8348 0.6795 -0.0440 0.0031 -0.0224 312 TYR B CE2 4382 C CZ . TYR B 230 ? 0.9325 0.7553 0.6036 -0.0462 0.0092 -0.0287 312 TYR B CZ 4383 O OH . TYR B 230 ? 0.9190 0.7368 0.5908 -0.0451 0.0162 -0.0272 312 TYR B OH 4384 N N . THR B 231 ? 0.7862 0.6240 0.4301 -0.0638 -0.0089 -0.0486 313 THR B N 4385 C CA . THR B 231 ? 0.8396 0.6705 0.4735 -0.0670 -0.0029 -0.0557 313 THR B CA 4386 C C . THR B 231 ? 0.9265 0.7486 0.5692 -0.0675 0.0017 -0.0629 313 THR B C 4387 O O . THR B 231 ? 1.0013 0.8234 0.6487 -0.0702 -0.0014 -0.0670 313 THR B O 4388 C CB . THR B 231 ? 1.0393 0.8747 0.6577 -0.0733 -0.0066 -0.0602 313 THR B CB 4389 O OG1 . THR B 231 ? 0.9231 0.7698 0.5343 -0.0728 -0.0128 -0.0530 313 THR B OG1 4390 C CG2 . THR B 231 ? 0.7547 0.5825 0.3605 -0.0758 0.0004 -0.0664 313 THR B CG2 4391 N N . PHE B 232 ? 0.9946 0.8098 0.6395 -0.0649 0.0094 -0.0644 314 PHE B N 4392 C CA . PHE B 232 ? 0.9215 0.7285 0.5720 -0.0650 0.0149 -0.0715 314 PHE B CA 4393 C C . PHE B 232 ? 1.0711 0.8725 0.7075 -0.0698 0.0183 -0.0797 314 PHE B C 4394 O O . PHE B 232 ? 1.0067 0.8077 0.6304 -0.0711 0.0211 -0.0800 314 PHE B O 4395 C CB . PHE B 232 ? 0.8328 0.6366 0.4918 -0.0601 0.0219 -0.0697 314 PHE B CB 4396 C CG . PHE B 232 ? 0.8688 0.6749 0.5446 -0.0561 0.0202 -0.0654 314 PHE B CG 4397 C CD1 . PHE B 232 ? 0.7672 0.5709 0.4534 -0.0554 0.0195 -0.0687 314 PHE B CD1 4398 C CD2 . PHE B 232 ? 0.7333 0.5433 0.4140 -0.0531 0.0196 -0.0581 314 PHE B CD2 4399 C CE1 . PHE B 232 ? 0.8902 0.6966 0.5913 -0.0517 0.0178 -0.0648 314 PHE B CE1 4400 C CE2 . PHE B 232 ? 0.8826 0.6946 0.5782 -0.0498 0.0182 -0.0548 314 PHE B CE2 4401 C CZ . PHE B 232 ? 0.9422 0.7529 0.6480 -0.0491 0.0171 -0.0581 314 PHE B CZ 4402 N N . LYS B 233 ? 1.0547 0.8509 0.6924 -0.0727 0.0183 -0.0863 315 LYS B N 4403 C CA . LYS B 233 ? 1.0085 0.7969 0.6331 -0.0774 0.0226 -0.0950 315 LYS B CA 4404 C C . LYS B 233 ? 0.9613 0.7385 0.5925 -0.0748 0.0305 -0.1007 315 LYS B C 4405 O O . LYS B 233 ? 0.9312 0.7073 0.5768 -0.0712 0.0303 -0.0991 315 LYS B O 4406 C CB . LYS B 233 ? 1.0128 0.8039 0.6291 -0.0847 0.0162 -0.0989 315 LYS B CB 4407 C CG . LYS B 233 ? 1.0470 0.8517 0.6599 -0.0863 0.0072 -0.0922 315 LYS B CG 4408 C CD . LYS B 233 ? 1.1017 0.9111 0.7044 -0.0946 0.0013 -0.0968 315 LYS B CD 4409 C CE . LYS B 233 ? 1.1618 0.9867 0.7601 -0.0953 -0.0073 -0.0895 315 LYS B CE 4410 N NZ . LYS B 233 ? 1.2076 1.0408 0.8007 -0.1031 -0.0146 -0.0928 315 LYS B NZ 4411 N N . GLU B 234 ? 0.9531 0.7221 0.5734 -0.0762 0.0378 -0.1070 316 GLU B N 4412 C CA . GLU B 234 ? 0.9688 0.7263 0.5930 -0.0737 0.0458 -0.1130 316 GLU B CA 4413 C C . GLU B 234 ? 1.1602 0.9087 0.7723 -0.0805 0.0464 -0.1217 316 GLU B C 4414 O O . GLU B 234 ? 1.2788 1.0274 0.8748 -0.0865 0.0455 -0.1254 316 GLU B O 4415 C CB . GLU B 234 ? 1.0696 0.8234 0.6911 -0.0695 0.0551 -0.1141 316 GLU B CB 4416 C CG . GLU B 234 ? 1.1642 0.9073 0.7909 -0.0652 0.0640 -0.1191 316 GLU B CG 4417 C CD . GLU B 234 ? 1.2258 0.9726 0.8724 -0.0580 0.0646 -0.1140 316 GLU B CD 4418 O OE1 . GLU B 234 ? 1.3543 1.1114 1.0104 -0.0562 0.0594 -0.1069 316 GLU B OE1 4419 O OE2 . GLU B 234 ? 1.2530 0.9923 0.9056 -0.0539 0.0707 -0.1171 316 GLU B OE2 4420 N N . PRO B 235 ? 1.0785 0.8190 0.6979 -0.0800 0.0479 -0.1250 317 PRO B N 4421 C CA . PRO B 235 ? 1.1685 0.8981 0.7768 -0.0870 0.0496 -0.1338 317 PRO B CA 4422 C C . PRO B 235 ? 1.2108 0.9285 0.8057 -0.0874 0.0595 -0.1412 317 PRO B C 4423 O O . PRO B 235 ? 1.2025 0.9159 0.8026 -0.0802 0.0673 -0.1404 317 PRO B O 4424 C CB . PRO B 235 ? 0.9799 0.7025 0.6016 -0.0837 0.0511 -0.1341 317 PRO B CB 4425 C CG . PRO B 235 ? 0.9995 0.7261 0.6366 -0.0737 0.0543 -0.1276 317 PRO B CG 4426 C CD . PRO B 235 ? 0.8678 0.6083 0.5056 -0.0729 0.0491 -0.1207 317 PRO B CD 4427 N N . CYS B 236 ? 1.1631 0.8762 0.7407 -0.0960 0.0591 -0.1484 318 CYS B N 4428 C CA . CYS B 236 ? 1.0977 0.7997 0.6602 -0.0974 0.0682 -0.1557 318 CYS B CA 4429 C C . CYS B 236 ? 1.1891 0.8723 0.7481 -0.0983 0.0766 -0.1642 318 CYS B C 4430 O O . CYS B 236 ? 0.9081 0.5799 0.4516 -0.1020 0.0835 -0.1722 318 CYS B O 4431 C CB . CYS B 236 ? 1.0170 0.7242 0.5607 -0.1064 0.0639 -0.1591 318 CYS B CB 4432 S SG . CYS B 236 ? 1.3383 1.0654 0.8838 -0.1042 0.0558 -0.1488 318 CYS B SG 4433 N N . LEU B 237 ? 1.2038 0.8830 0.7767 -0.0948 0.0764 -0.1623 319 LEU B N 4434 C CA . LEU B 237 ? 1.1733 0.8334 0.7422 -0.0958 0.0844 -0.1700 319 LEU B CA 4435 C C . LEU B 237 ? 1.1852 0.8366 0.7647 -0.0844 0.0944 -0.1681 319 LEU B C 4436 O O . LEU B 237 ? 1.2742 0.9350 0.8709 -0.0763 0.0923 -0.1601 319 LEU B O 4437 C CB . LEU B 237 ? 1.2495 0.9082 0.8227 -0.1018 0.0783 -0.1710 319 LEU B CB 4438 C CG . LEU B 237 ? 1.1477 0.8098 0.7068 -0.1151 0.0712 -0.1765 319 LEU B CG 4439 C CD1 . LEU B 237 ? 1.1357 0.7985 0.6759 -0.1205 0.0728 -0.1816 319 LEU B CD1 4440 C CD2 . LEU B 237 ? 1.0642 0.7456 0.6334 -0.1171 0.0585 -0.1689 319 LEU B CD2 4441 N N . GLY B 238 ? 1.2598 0.8937 0.8286 -0.0837 0.1054 -0.1757 320 GLY B N 4442 C CA . GLY B 238 ? 1.1900 0.8149 0.7674 -0.0726 0.1159 -0.1745 320 GLY B CA 4443 C C . GLY B 238 ? 1.2451 0.8621 0.8350 -0.0681 0.1172 -0.1726 320 GLY B C 4444 O O . GLY B 238 ? 1.2514 0.8614 0.8491 -0.0580 0.1259 -0.1710 320 GLY B O 4445 N N . PHE B 239 ? 1.1426 0.7615 0.7345 -0.0752 0.1090 -0.1725 321 PHE B N 4446 C CA . PHE B 239 ? 1.0638 0.6779 0.6687 -0.0714 0.1085 -0.1694 321 PHE B CA 4447 C C . PHE B 239 ? 1.0038 0.6369 0.6288 -0.0638 0.1014 -0.1586 321 PHE B C 4448 O O . PHE B 239 ? 0.9114 0.5582 0.5417 -0.0684 0.0906 -0.1544 321 PHE B O 4449 C CB . PHE B 239 ? 1.0152 0.6247 0.6132 -0.0832 0.1025 -0.1740 321 PHE B CB 4450 C CG . PHE B 239 ? 1.0544 0.6540 0.6616 -0.0810 0.1042 -0.1729 321 PHE B CG 4451 C CD1 . PHE B 239 ? 0.9184 0.4947 0.5186 -0.0794 0.1157 -0.1789 321 PHE B CD1 4452 C CD2 . PHE B 239 ? 0.8749 0.4873 0.4964 -0.0810 0.0946 -0.1660 321 PHE B CD2 4453 C CE1 . PHE B 239 ? 0.9185 0.4845 0.5263 -0.0774 0.1177 -0.1776 321 PHE B CE1 4454 C CE2 . PHE B 239 ? 0.8948 0.4978 0.5239 -0.0793 0.0964 -0.1650 321 PHE B CE2 4455 C CZ . PHE B 239 ? 0.9002 0.4799 0.5225 -0.0775 0.1079 -0.1706 321 PHE B CZ 4456 N N . LEU B 240 ? 1.0943 0.7287 0.7301 -0.0523 0.1077 -0.1541 322 LEU B N 4457 C CA . LEU B 240 ? 0.9815 0.6345 0.6351 -0.0452 0.1021 -0.1446 322 LEU B CA 4458 C C . LEU B 240 ? 0.9728 0.6310 0.6404 -0.0442 0.0952 -0.1391 322 LEU B C 4459 O O . LEU B 240 ? 0.9177 0.5645 0.5891 -0.0407 0.0996 -0.1398 322 LEU B O 4460 C CB . LEU B 240 ? 0.9682 0.6216 0.6296 -0.0336 0.1112 -0.1419 322 LEU B CB 4461 C CG . LEU B 240 ? 1.0657 0.7117 0.7134 -0.0336 0.1200 -0.1476 322 LEU B CG 4462 C CD1 . LEU B 240 ? 0.9960 0.6433 0.6531 -0.0213 0.1294 -0.1445 322 LEU B CD1 4463 C CD2 . LEU B 240 ? 0.8406 0.4988 0.4810 -0.0401 0.1139 -0.1473 322 LEU B CD2 4464 N N . GLY B 241 ? 0.9470 0.6219 0.6217 -0.0467 0.0849 -0.1335 323 GLY B N 4465 C CA . GLY B 241 ? 0.9448 0.6257 0.6314 -0.0467 0.0775 -0.1286 323 GLY B CA 4466 C C . GLY B 241 ? 0.9787 0.6664 0.6831 -0.0363 0.0786 -0.1215 323 GLY B C 4467 O O . GLY B 241 ? 1.0417 0.7271 0.7543 -0.0346 0.0767 -0.1191 323 GLY B O 4468 N N . ASP B 242 ? 1.0219 0.7184 0.7322 -0.0296 0.0816 -0.1181 324 ASP B N 4469 C CA . ASP B 242 ? 1.0340 0.7407 0.7615 -0.0205 0.0814 -0.1111 324 ASP B CA 4470 C C . ASP B 242 ? 1.0049 0.7015 0.7374 -0.0118 0.0903 -0.1113 324 ASP B C 4471 O O . ASP B 242 ? 0.9976 0.6781 0.7198 -0.0118 0.0983 -0.1171 324 ASP B O 4472 C CB . ASP B 242 ? 0.9510 0.6720 0.6834 -0.0172 0.0815 -0.1074 324 ASP B CB 4473 C CG . ASP B 242 ? 1.0050 0.7417 0.7530 -0.0138 0.0752 -0.0999 324 ASP B CG 4474 O OD1 . ASP B 242 ? 0.9256 0.6620 0.6835 -0.0097 0.0742 -0.0971 324 ASP B OD1 4475 O OD2 . ASP B 242 ? 1.0512 0.7997 0.8009 -0.0155 0.0717 -0.0971 324 ASP B OD2 4476 N N . THR B 243 ? 0.9462 0.6523 0.6940 -0.0044 0.0889 -0.1049 325 THR B N 4477 C CA . THR B 243 ? 0.9788 0.6806 0.7339 0.0060 0.0970 -0.1031 325 THR B CA 4478 C C . THR B 243 ? 0.9264 0.6481 0.6966 0.0128 0.0950 -0.0963 325 THR B C 4479 O O . THR B 243 ? 0.9454 0.6790 0.7244 0.0111 0.0868 -0.0917 325 THR B O 4480 C CB . THR B 243 ? 0.9839 0.6752 0.7420 0.0074 0.0969 -0.1022 325 THR B CB 4481 O OG1 . THR B 243 ? 1.0077 0.6799 0.7510 0.0002 0.0997 -0.1093 325 THR B OG1 4482 C CG2 . THR B 243 ? 0.7324 0.4217 0.4994 0.0196 0.1047 -0.0986 325 THR B CG2 4483 N N . PRO B 244 ? 0.9275 0.6532 0.7005 0.0202 0.1026 -0.0958 326 PRO B N 4484 C CA . PRO B 244 ? 1.0140 0.7261 0.7775 0.0238 0.1134 -0.1007 326 PRO B CA 4485 C C . PRO B 244 ? 0.9087 0.6149 0.6568 0.0156 0.1144 -0.1069 326 PRO B C 4486 O O . PRO B 244 ? 0.9636 0.6786 0.7095 0.0081 0.1068 -0.1065 326 PRO B O 4487 C CB . PRO B 244 ? 0.8847 0.6110 0.6598 0.0340 0.1188 -0.0964 326 PRO B CB 4488 C CG . PRO B 244 ? 0.8349 0.5812 0.6183 0.0303 0.1106 -0.0924 326 PRO B CG 4489 C CD . PRO B 244 ? 0.7997 0.5461 0.5853 0.0243 0.1006 -0.0905 326 PRO B CD 4490 N N . ARG B 245 ? 0.8105 0.5018 0.5479 0.0177 0.1242 -0.1123 327 ARG B N 4491 C CA . ARG B 245 ? 0.9072 0.5905 0.6281 0.0108 0.1271 -0.1190 327 ARG B CA 4492 C C . ARG B 245 ? 0.9296 0.5994 0.6436 0.0175 0.1402 -0.1231 327 ARG B C 4493 O O . ARG B 245 ? 0.9326 0.5965 0.6530 0.0267 0.1465 -0.1210 327 ARG B O 4494 C CB . ARG B 245 ? 1.0138 0.6843 0.7215 -0.0003 0.1221 -0.1244 327 ARG B CB 4495 C CG . ARG B 245 ? 0.8544 0.5050 0.5580 0.0008 0.1272 -0.1277 327 ARG B CG 4496 C CD . ARG B 245 ? 0.9682 0.6085 0.6594 -0.0114 0.1218 -0.1332 327 ARG B CD 4497 N NE . ARG B 245 ? 1.1273 0.7467 0.8126 -0.0115 0.1279 -0.1373 327 ARG B NE 4498 C CZ . ARG B 245 ? 0.9575 0.5739 0.6488 -0.0128 0.1238 -0.1350 327 ARG B CZ 4499 N NH1 . ARG B 245 ? 0.8365 0.4698 0.5399 -0.0139 0.1133 -0.1288 327 ARG B NH1 4500 N NH2 . ARG B 245 ? 0.9413 0.5369 0.6260 -0.0131 0.1306 -0.1390 327 ARG B NH2 4501 N N . GLY B 246 ? 0.9143 0.5785 0.6146 0.0132 0.1445 -0.1287 328 GLY B N 4502 C CA . GLY B 246 ? 0.9918 0.6406 0.6826 0.0184 0.1573 -0.1338 328 GLY B CA 4503 C C . GLY B 246 ? 1.0599 0.6847 0.7320 0.0108 0.1607 -0.1424 328 GLY B C 4504 O O . GLY B 246 ? 1.0952 0.7149 0.7640 0.0027 0.1536 -0.1440 328 GLY B O 4505 N N . ILE B 247 ? 1.1071 0.7176 0.7672 0.0133 0.1722 -0.1482 329 ILE B N 4506 C CA . ILE B 247 ? 1.0380 0.6248 0.6783 0.0056 0.1771 -0.1577 329 ILE B CA 4507 C C . ILE B 247 ? 1.1521 0.7430 0.7813 -0.0087 0.1671 -0.1617 329 ILE B C 4508 O O . ILE B 247 ? 1.2303 0.8373 0.8605 -0.0110 0.1622 -0.1595 329 ILE B O 4509 C CB . ILE B 247 ? 1.0829 0.6575 0.7117 0.0104 0.1907 -0.1630 329 ILE B CB 4510 C CG1 . ILE B 247 ? 1.0582 0.6324 0.6995 0.0262 0.2006 -0.1578 329 ILE B CG1 4511 C CG2 . ILE B 247 ? 1.0073 0.5555 0.6144 0.0021 0.1968 -0.1737 329 ILE B CG2 4512 C CD1 . ILE B 247 ? 1.0625 0.6234 0.6932 0.0324 0.2151 -0.1627 329 ILE B CD1 4513 N N . ASP B 248 ? 1.1273 0.7046 0.7462 -0.0183 0.1642 -0.1672 330 ASP B N 4514 C CA . ASP B 248 ? 1.1729 0.7544 0.7801 -0.0319 0.1550 -0.1713 330 ASP B CA 4515 C C . ASP B 248 ? 1.1636 0.7426 0.7553 -0.0351 0.1603 -0.1771 330 ASP B C 4516 O O . ASP B 248 ? 1.1579 0.7231 0.7422 -0.0299 0.1724 -0.1813 330 ASP B O 4517 C CB . ASP B 248 ? 1.1803 0.7459 0.7771 -0.0420 0.1532 -0.1777 330 ASP B CB 4518 C CG . ASP B 248 ? 1.3255 0.8988 0.9360 -0.0429 0.1439 -0.1719 330 ASP B CG 4519 O OD1 . ASP B 248 ? 1.4727 1.0642 1.1004 -0.0362 0.1381 -0.1630 330 ASP B OD1 4520 O OD2 . ASP B 248 ? 1.1992 0.7602 0.8030 -0.0509 0.1426 -0.1766 330 ASP B OD2 4521 N N . THR B 249 ? 1.1380 0.7305 0.7246 -0.0431 0.1515 -0.1768 333 THR B N 4522 C CA . THR B 249 ? 1.2702 0.8619 0.8423 -0.0458 0.1561 -0.1815 333 THR B CA 4523 C C . THR B 249 ? 1.2832 0.8696 0.8359 -0.0597 0.1514 -0.1891 333 THR B C 4524 O O . THR B 249 ? 1.2906 0.8703 0.8397 -0.0674 0.1467 -0.1923 333 THR B O 4525 C CB . THR B 249 ? 1.3346 0.9479 0.9159 -0.0419 0.1519 -0.1741 333 THR B CB 4526 O OG1 . THR B 249 ? 1.5763 1.1892 1.1412 -0.0468 0.1547 -0.1789 333 THR B OG1 4527 C CG2 . THR B 249 ? 1.0640 0.6948 0.6557 -0.0460 0.1380 -0.1673 333 THR B CG2 4528 N N . THR B 250 ? 1.3666 0.9569 0.9068 -0.0631 0.1528 -0.1919 334 THR B N 4529 C CA . THR B 250 ? 1.4367 1.0268 0.9587 -0.0762 0.1470 -0.1980 334 THR B CA 4530 C C . THR B 250 ? 1.3581 0.9697 0.8879 -0.0805 0.1326 -0.1908 334 THR B C 4531 O O . THR B 250 ? 1.3718 0.9978 0.9190 -0.0732 0.1285 -0.1815 334 THR B O 4532 C CB . THR B 250 ? 1.4276 1.0145 0.9327 -0.0777 0.1541 -0.2032 334 THR B CB 4533 O OG1 . THR B 250 ? 1.5569 1.1631 1.0611 -0.0809 0.1454 -0.1982 334 THR B OG1 4534 C CG2 . THR B 250 ? 1.2755 0.8572 0.7872 -0.0651 0.1666 -0.2015 334 THR B CG2 4535 N N . ASN B 251 ? 1.2823 0.8959 0.7991 -0.0923 0.1251 -0.1950 335 ASN B N 4536 C CA . ASN B 251 ? 1.1290 0.7628 0.6503 -0.0964 0.1121 -0.1884 335 ASN B CA 4537 C C . ASN B 251 ? 1.1490 0.7956 0.6686 -0.0930 0.1117 -0.1835 335 ASN B C 4538 O O . ASN B 251 ? 1.2166 0.8592 0.7194 -0.0966 0.1162 -0.1888 335 ASN B O 4539 C CB . ASN B 251 ? 1.0025 0.6367 0.5089 -0.1098 0.1048 -0.1944 335 ASN B CB 4540 C CG . ASN B 251 ? 1.1247 0.7494 0.6349 -0.1142 0.1033 -0.1980 335 ASN B CG 4541 O OD1 . ASN B 251 ? 1.2877 0.9027 0.8097 -0.1070 0.1088 -0.1966 335 ASN B OD1 4542 N ND2 . ASN B 251 ? 1.1587 0.7864 0.6585 -0.1262 0.0960 -0.2025 335 ASN B ND2 4543 N N . TYR B 252 ? 1.1505 0.8118 0.6871 -0.0863 0.1069 -0.1736 336 TYR B N 4544 C CA . TYR B 252 ? 1.1724 0.8475 0.7075 -0.0848 0.1045 -0.1680 336 TYR B CA 4545 C C . TYR B 252 ? 1.2517 0.9436 0.8018 -0.0830 0.0940 -0.1580 336 TYR B C 4546 O O . TYR B 252 ? 1.2698 0.9631 0.8345 -0.0804 0.0902 -0.1547 336 TYR B O 4547 C CB . TYR B 252 ? 1.0688 0.7413 0.6065 -0.0765 0.1152 -0.1672 336 TYR B CB 4548 C CG . TYR B 252 ? 1.1349 0.8060 0.6919 -0.0664 0.1202 -0.1634 336 TYR B CG 4549 C CD1 . TYR B 252 ? 1.0821 0.7675 0.6578 -0.0609 0.1151 -0.1540 336 TYR B CD1 4550 C CD2 . TYR B 252 ? 1.0175 0.6729 0.5736 -0.0621 0.1306 -0.1691 336 TYR B CD2 4551 C CE1 . TYR B 252 ? 0.9712 0.6569 0.5641 -0.0518 0.1194 -0.1506 336 TYR B CE1 4552 C CE2 . TYR B 252 ? 1.1229 0.7784 0.6964 -0.0522 0.1352 -0.1650 336 TYR B CE2 4553 C CZ . TYR B 252 ? 1.1678 0.8393 0.7598 -0.0473 0.1292 -0.1558 336 TYR B CZ 4554 O OH . TYR B 252 ? 1.2871 0.9602 0.8961 -0.0377 0.1335 -0.1519 336 TYR B OH 4555 N N . CYS B 253 ? 1.2752 0.9791 0.8209 -0.0841 0.0898 -0.1530 337 CYS B N 4556 C CA . CYS B 253 ? 1.2618 0.9802 0.8163 -0.0847 0.0789 -0.1447 337 CYS B CA 4557 C C . CYS B 253 ? 1.2922 1.0200 0.8632 -0.0768 0.0791 -0.1357 337 CYS B C 4558 O O . CYS B 253 ? 1.5013 1.2406 1.0746 -0.0770 0.0725 -0.1286 337 CYS B O 4559 C CB . CYS B 253 ? 1.2717 0.9982 0.8103 -0.0918 0.0726 -0.1442 337 CYS B CB 4560 S SG . CYS B 253 ? 2.0968 1.8309 1.6339 -0.0997 0.0599 -0.1438 337 CYS B SG 4561 N N . ASP B 254 ? 1.1236 0.8467 0.7059 -0.0697 0.0868 -0.1358 339 ASP B N 4562 C CA . ASP B 254 ? 1.1876 0.9203 0.7870 -0.0629 0.0865 -0.1278 339 ASP B CA 4563 C C . ASP B 254 ? 1.1598 0.8889 0.7755 -0.0560 0.0909 -0.1277 339 ASP B C 4564 O O . ASP B 254 ? 1.1199 0.8383 0.7343 -0.0563 0.0934 -0.1331 339 ASP B O 4565 C CB . ASP B 254 ? 1.4182 1.1560 1.0134 -0.0610 0.0915 -0.1252 339 ASP B CB 4566 C CG . ASP B 254 ? 1.5884 1.3167 1.1719 -0.0605 0.1019 -0.1322 339 ASP B CG 4567 O OD1 . ASP B 254 ? 1.6887 1.4052 1.2658 -0.0620 0.1053 -0.1394 339 ASP B OD1 4568 O OD2 . ASP B 254 ? 1.5824 1.3144 1.1627 -0.0587 0.1071 -0.1304 339 ASP B OD2 4569 N N . LYS B 255 ? 1.0837 0.8218 0.7145 -0.0500 0.0918 -0.1214 340 LYS B N 4570 C CA . LYS B 255 ? 1.0089 0.7469 0.6564 -0.0436 0.0938 -0.1199 340 LYS B CA 4571 C C . LYS B 255 ? 1.1140 0.8418 0.7601 -0.0388 0.1045 -0.1254 340 LYS B C 4572 O O . LYS B 255 ? 1.1368 0.8619 0.7742 -0.0380 0.1121 -0.1284 340 LYS B O 4573 C CB . LYS B 255 ? 1.0339 0.7851 0.6976 -0.0388 0.0926 -0.1123 340 LYS B CB 4574 C CG . LYS B 255 ? 1.0304 0.7908 0.6988 -0.0418 0.0827 -0.1060 340 LYS B CG 4575 C CD . LYS B 255 ? 1.0547 0.8262 0.7337 -0.0384 0.0844 -0.1001 340 LYS B CD 4576 C CE . LYS B 255 ? 1.2744 1.0534 0.9548 -0.0415 0.0764 -0.0939 340 LYS B CE 4577 N NZ . LYS B 255 ? 1.1956 0.9754 0.8620 -0.0456 0.0764 -0.0928 340 LYS B NZ 4578 N N . THR B 256 ? 1.0762 0.7980 0.7306 -0.0352 0.1054 -0.1264 341 THR B N 4579 C CA . THR B 256 ? 1.1627 0.8762 0.8201 -0.0282 0.1156 -0.1296 341 THR B CA 4580 C C . THR B 256 ? 1.1803 0.9059 0.8576 -0.0198 0.1167 -0.1230 341 THR B C 4581 O O . THR B 256 ? 1.1797 0.9078 0.8692 -0.0171 0.1126 -0.1197 341 THR B O 4582 C CB . THR B 256 ? 1.1925 0.8909 0.8463 -0.0291 0.1167 -0.1345 341 THR B CB 4583 O OG1 . THR B 256 ? 1.1874 0.8757 0.8223 -0.0382 0.1152 -0.1411 341 THR B OG1 4584 C CG2 . THR B 256 ? 1.0763 0.7650 0.7330 -0.0206 0.1282 -0.1370 341 THR B CG2 4585 N N . THR B 257 ? 1.1512 0.8852 0.8315 -0.0162 0.1223 -0.1212 342 THR B N 4586 C CA . THR B 257 ? 1.2782 1.0275 0.9766 -0.0101 0.1223 -0.1148 342 THR B CA 4587 C C . THR B 257 ? 1.3222 1.0713 1.0331 -0.0005 0.1286 -0.1140 342 THR B C 4588 O O . THR B 257 ? 1.1887 0.9482 0.9154 0.0035 0.1249 -0.1088 342 THR B O 4589 C CB . THR B 257 ? 1.1959 0.9549 0.8929 -0.0104 0.1266 -0.1134 342 THR B CB 4590 O OG1 . THR B 257 ? 1.2066 0.9586 0.8966 -0.0064 0.1375 -0.1181 342 THR B OG1 4591 C CG2 . THR B 257 ? 1.0437 0.8028 0.7280 -0.0191 0.1207 -0.1132 342 THR B CG2 4592 N N . THR B 258 ? 1.2655 1.0030 0.9687 0.0034 0.1383 -0.1190 343 THR B N 4593 C CA . THR B 258 ? 1.1741 0.9087 0.8867 0.0133 0.1454 -0.1185 343 THR B CA 4594 C C . THR B 258 ? 1.1333 0.8641 0.8535 0.0143 0.1393 -0.1163 343 THR B C 4595 O O . THR B 258 ? 1.1852 0.9055 0.8964 0.0073 0.1337 -0.1192 343 THR B O 4596 C CB . THR B 258 ? 1.2424 0.9601 0.9416 0.0163 0.1569 -0.1253 343 THR B CB 4597 O OG1 . THR B 258 ? 1.3400 1.0421 1.0378 0.0196 0.1595 -0.1276 343 THR B OG1 4598 C CG2 . THR B 258 ? 1.1981 0.9062 0.8771 0.0068 0.1565 -0.1313 343 THR B CG2 4599 N N . GLU B 259 ? 0.9755 0.7163 0.7124 0.0228 0.1403 -0.1111 344 GLU B N 4600 C CA . GLU B 259 ? 0.9709 0.7114 0.7172 0.0245 0.1342 -0.1077 344 GLU B CA 4601 C C . GLU B 259 ? 0.9825 0.7291 0.7302 0.0159 0.1219 -0.1053 344 GLU B C 4602 O O . GLU B 259 ? 1.0157 0.7584 0.7668 0.0148 0.1163 -0.1039 344 GLU B O 4603 C CB . GLU B 259 ? 1.0674 0.7873 0.8063 0.0270 0.1393 -0.1117 344 GLU B CB 4604 C CG . GLU B 259 ? 1.2211 0.9375 0.9650 0.0391 0.1507 -0.1111 344 GLU B CG 4605 C CD . GLU B 259 ? 1.6345 1.3413 1.3658 0.0404 0.1613 -0.1167 344 GLU B CD 4606 O OE1 . GLU B 259 ? 1.6511 1.3502 1.3675 0.0314 0.1601 -0.1221 344 GLU B OE1 4607 O OE2 . GLU B 259 ? 1.7758 1.4830 1.5119 0.0509 0.1711 -0.1155 344 GLU B OE2 4608 N N . GLY B 260 ? 0.8788 0.6350 0.6240 0.0102 0.1183 -0.1044 345 GLY B N 4609 C CA . GLY B 260 ? 0.8496 0.6113 0.5950 0.0027 0.1077 -0.1019 345 GLY B CA 4610 C C . GLY B 260 ? 0.9959 0.7739 0.7581 0.0052 0.1021 -0.0952 345 GLY B C 4611 O O . GLY B 260 ? 1.1983 0.9808 0.9617 -0.0001 0.0937 -0.0926 345 GLY B O 4612 N N . GLU B 261 ? 1.0297 0.8172 0.8046 0.0133 0.1070 -0.0925 346 GLU B N 4613 C CA . GLU B 261 ? 1.0700 0.8730 0.8607 0.0156 0.1019 -0.0866 346 GLU B CA 4614 C C . GLU B 261 ? 0.9076 0.7054 0.7041 0.0192 0.0990 -0.0852 346 GLU B C 4615 O O . GLU B 261 ? 0.9692 0.7548 0.7618 0.0236 0.1043 -0.0877 346 GLU B O 4616 C CB . GLU B 261 ? 1.2095 1.0280 1.0118 0.0220 0.1079 -0.0841 346 GLU B CB 4617 C CG . GLU B 261 ? 1.3039 1.1407 1.1204 0.0215 0.1023 -0.0789 346 GLU B CG 4618 C CD . GLU B 261 ? 1.5388 1.3929 1.3673 0.0273 0.1080 -0.0766 346 GLU B CD 4619 O OE1 . GLU B 261 ? 1.5890 1.4465 1.4136 0.0261 0.1135 -0.0784 346 GLU B OE1 4620 O OE2 . GLU B 261 ? 1.5604 1.4254 1.4022 0.0330 0.1069 -0.0730 346 GLU B OE2 4621 N N . GLY B 262 ? 0.8482 0.6539 0.6531 0.0172 0.0910 -0.0811 347 GLY B N 4622 C CA . GLY B 262 ? 0.9022 0.7026 0.7116 0.0195 0.0874 -0.0795 347 GLY B CA 4623 C C . GLY B 262 ? 0.9887 0.7758 0.7868 0.0119 0.0820 -0.0824 347 GLY B C 4624 O O . GLY B 262 ? 1.1774 0.9634 0.9665 0.0050 0.0793 -0.0842 347 GLY B O 4625 N N . GLY B 263 ? 1.0235 0.8013 0.8219 0.0130 0.0805 -0.0826 348 GLY B N 4626 C CA . GLY B 263 ? 0.8707 0.6376 0.6590 0.0053 0.0754 -0.0853 348 GLY B CA 4627 C C . GLY B 263 ? 0.9263 0.6944 0.7222 0.0051 0.0688 -0.0819 348 GLY B C 4628 O O . GLY B 263 ? 1.0181 0.7964 0.8267 0.0103 0.0674 -0.0771 348 GLY B O 4629 N N . ILE B 264 ? 0.9222 0.6804 0.7100 -0.0013 0.0649 -0.0845 349 ILE B N 4630 C CA . ILE B 264 ? 0.7961 0.5541 0.5900 -0.0021 0.0591 -0.0817 349 ILE B CA 4631 C C . ILE B 264 ? 0.8809 0.6359 0.6664 -0.0115 0.0521 -0.0836 349 ILE B C 4632 O O . ILE B 264 ? 1.0628 0.8110 0.8357 -0.0170 0.0533 -0.0884 349 ILE B O 4633 C CB . ILE B 264 ? 0.7484 0.4942 0.5435 0.0029 0.0646 -0.0827 349 ILE B CB 4634 C CG1 . ILE B 264 ? 0.7058 0.4540 0.5096 0.0035 0.0591 -0.0786 349 ILE B CG1 4635 C CG2 . ILE B 264 ? 0.6774 0.4052 0.4578 -0.0020 0.0691 -0.0897 349 ILE B CG2 4636 C CD1 . ILE B 264 ? 0.7648 0.5061 0.5741 0.0115 0.0647 -0.0769 349 ILE B CD1 4637 N N . GLN B 265 ? 0.8643 0.6256 0.6566 -0.0131 0.0448 -0.0796 350 GLN B N 4638 C CA . GLN B 265 ? 0.8829 0.6446 0.6692 -0.0212 0.0378 -0.0803 350 GLN B CA 4639 C C . GLN B 265 ? 0.9266 0.6743 0.7027 -0.0264 0.0394 -0.0859 350 GLN B C 4640 O O . GLN B 265 ? 0.9580 0.6963 0.7362 -0.0238 0.0433 -0.0870 350 GLN B O 4641 C CB . GLN B 265 ? 0.6600 0.4304 0.4567 -0.0206 0.0308 -0.0748 350 GLN B CB 4642 C CG . GLN B 265 ? 0.6721 0.4453 0.4643 -0.0279 0.0232 -0.0744 350 GLN B CG 4643 C CD . GLN B 265 ? 0.8323 0.6145 0.6352 -0.0265 0.0170 -0.0687 350 GLN B CD 4644 O OE1 . GLN B 265 ? 0.9176 0.7000 0.7299 -0.0215 0.0183 -0.0663 350 GLN B OE1 4645 N NE2 . GLN B 265 ? 0.6275 0.4172 0.4289 -0.0303 0.0107 -0.0662 350 GLN B NE2 4646 N N . GLY B 266 ? 0.8829 0.6294 0.6475 -0.0340 0.0367 -0.0894 351 GLY B N 4647 C CA . GLY B 266 ? 0.8880 0.6228 0.6413 -0.0410 0.0377 -0.0955 351 GLY B CA 4648 C C . GLY B 266 ? 0.8597 0.5997 0.6028 -0.0493 0.0319 -0.0974 351 GLY B C 4649 O O . GLY B 266 ? 0.9118 0.6632 0.6564 -0.0488 0.0278 -0.0935 351 GLY B O 4650 N N . PHE B 267 ? 0.9154 0.6470 0.6475 -0.0571 0.0319 -0.1033 352 PHE B N 4651 C CA . PHE B 267 ? 0.9853 0.7240 0.7084 -0.0655 0.0251 -0.1046 352 PHE B CA 4652 C C . PHE B 267 ? 0.9943 0.7239 0.7005 -0.0726 0.0287 -0.1128 352 PHE B C 4653 O O . PHE B 267 ? 0.9893 0.7041 0.6900 -0.0723 0.0367 -0.1184 352 PHE B O 4654 C CB . PHE B 267 ? 0.9615 0.7049 0.6894 -0.0704 0.0180 -0.1029 352 PHE B CB 4655 C CG . PHE B 267 ? 0.9136 0.6433 0.6398 -0.0736 0.0221 -0.1079 352 PHE B CG 4656 C CD1 . PHE B 267 ? 0.9024 0.6262 0.6394 -0.0671 0.0257 -0.1053 352 PHE B CD1 4657 C CD2 . PHE B 267 ? 0.9059 0.6281 0.6190 -0.0834 0.0227 -0.1154 352 PHE B CD2 4658 C CE1 . PHE B 267 ? 1.0109 0.7203 0.7456 -0.0698 0.0302 -0.1095 352 PHE B CE1 4659 C CE2 . PHE B 267 ? 0.9388 0.6464 0.6496 -0.0870 0.0273 -0.1203 352 PHE B CE2 4660 C CZ . PHE B 267 ? 0.9757 0.6763 0.6973 -0.0799 0.0313 -0.1172 352 PHE B CZ 4661 N N . MET B 268 ? 0.9617 0.7005 0.6595 -0.0787 0.0229 -0.1131 353 MET B N 4662 C CA . MET B 268 ? 0.9334 0.6672 0.6147 -0.0880 0.0234 -0.1206 353 MET B CA 4663 C C . MET B 268 ? 0.9922 0.7391 0.6722 -0.0955 0.0134 -0.1188 353 MET B C 4664 O O . MET B 268 ? 1.0047 0.7645 0.6948 -0.0922 0.0069 -0.1113 353 MET B O 4665 C CB . MET B 268 ? 0.7522 0.4860 0.4227 -0.0873 0.0270 -0.1225 353 MET B CB 4666 C CG . MET B 268 ? 0.9001 0.6230 0.5724 -0.0796 0.0370 -0.1240 353 MET B CG 4667 S SD . MET B 268 ? 1.0513 0.7742 0.7116 -0.0784 0.0421 -0.1260 353 MET B SD 4668 C CE . MET B 268 ? 0.7871 0.5295 0.4528 -0.0765 0.0335 -0.1169 353 MET B CE 4669 N N . ILE B 269 ? 0.9683 0.7122 0.6358 -0.1055 0.0123 -0.1258 354 ILE B N 4670 C CA . ILE B 269 ? 0.8984 0.6569 0.5635 -0.1131 0.0028 -0.1244 354 ILE B CA 4671 C C . ILE B 269 ? 1.1047 0.8667 0.7526 -0.1203 0.0016 -0.1294 354 ILE B C 4672 O O . ILE B 269 ? 1.1332 0.8822 0.7687 -0.1256 0.0076 -0.1380 354 ILE B O 4673 C CB . ILE B 269 ? 0.9454 0.7000 0.6123 -0.1206 0.0013 -0.1285 354 ILE B CB 4674 C CG1 . ILE B 269 ? 0.8654 0.6153 0.5483 -0.1136 0.0030 -0.1239 354 ILE B CG1 4675 C CG2 . ILE B 269 ? 0.9026 0.6750 0.5676 -0.1284 -0.0088 -0.1269 354 ILE B CG2 4676 C CD1 . ILE B 269 ? 0.8412 0.5865 0.5262 -0.1207 0.0021 -0.1274 354 ILE B CD1 4677 N N . GLU B 270 ? 1.1345 0.9135 0.7810 -0.1203 -0.0058 -0.1238 355 GLU B N 4678 C CA . GLU B 270 ? 1.0581 0.8428 0.6884 -0.1262 -0.0076 -0.1271 355 GLU B CA 4679 C C . GLU B 270 ? 1.1539 0.9516 0.7791 -0.1362 -0.0159 -0.1288 355 GLU B C 4680 O O . GLU B 270 ? 1.1466 0.9605 0.7801 -0.1345 -0.0238 -0.1214 355 GLU B O 4681 C CB . GLU B 270 ? 1.1730 0.9689 0.8045 -0.1190 -0.0103 -0.1188 355 GLU B CB 4682 C CG . GLU B 270 ? 1.3150 1.1030 0.9353 -0.1169 -0.0035 -0.1216 355 GLU B CG 4683 C CD . GLU B 270 ? 1.3198 1.1100 0.9210 -0.1260 -0.0046 -0.1282 355 GLU B CD 4684 O OE1 . GLU B 270 ? 1.2813 1.0574 0.8719 -0.1289 0.0030 -0.1364 355 GLU B OE1 4685 O OE2 . GLU B 270 ? 1.3449 1.1512 0.9417 -0.1299 -0.0128 -0.1249 355 GLU B OE2 4686 N N . GLY B 271 ? 1.3309 1.1223 0.9424 -0.1467 -0.0140 -0.1386 356 GLY B N 4687 C CA . GLY B 271 ? 1.2991 1.1046 0.9057 -0.1573 -0.0220 -0.1408 356 GLY B CA 4688 C C . GLY B 271 ? 1.3107 1.1130 0.8978 -0.1689 -0.0206 -0.1512 356 GLY B C 4689 O O . GLY B 271 ? 1.1780 0.9695 0.7534 -0.1680 -0.0142 -0.1555 356 GLY B O 4690 N N . SER B 272 ? 1.5584 1.3708 1.1419 -0.1803 -0.0266 -0.1552 357 SER B N 4691 C CA . SER B 272 ? 1.6121 1.4203 1.1771 -0.1936 -0.0250 -0.1667 357 SER B CA 4692 C C . SER B 272 ? 1.5264 1.3060 1.0872 -0.1940 -0.0130 -0.1754 357 SER B C 4693 O O . SER B 272 ? 1.2844 1.0513 0.8298 -0.1967 -0.0063 -0.1828 357 SER B O 4694 C CB . SER B 272 ? 1.5628 1.3844 1.1289 -0.2057 -0.0323 -0.1698 357 SER B CB 4695 O OG . SER B 272 ? 1.4861 1.3314 1.0650 -0.2014 -0.0422 -0.1591 357 SER B OG 4696 N N . ASN B 273 ? 1.4296 1.1996 1.0043 -0.1908 -0.0102 -0.1738 359 ASN B N 4697 C CA . ASN B 273 ? 1.2554 0.9995 0.8319 -0.1859 0.0012 -0.1778 359 ASN B CA 4698 C C . ASN B 273 ? 1.2909 1.0348 0.8826 -0.1702 0.0029 -0.1677 359 ASN B C 4699 O O . ASN B 273 ? 1.4062 1.1617 1.0135 -0.1649 -0.0029 -0.1592 359 ASN B O 4700 C CB . ASN B 273 ? 1.2749 1.0088 0.8572 -0.1921 0.0033 -0.1820 359 ASN B CB 4701 C CG . ASN B 273 ? 1.3920 1.1191 0.9579 -0.2084 0.0050 -0.1943 359 ASN B CG 4702 O OD1 . ASN B 273 ? 1.2648 0.9847 0.8134 -0.2135 0.0091 -0.2020 359 ASN B OD1 4703 N ND2 . ASN B 273 ? 1.2718 1.0008 0.8424 -0.2171 0.0022 -0.1967 359 ASN B ND2 4704 N N . SER B 274 ? 1.1681 0.8994 0.7551 -0.1631 0.0109 -0.1688 360 SER B N 4705 C CA . SER B 274 ? 1.0356 0.7638 0.6367 -0.1491 0.0143 -0.1608 360 SER B CA 4706 C C . SER B 274 ? 1.0666 0.7741 0.6740 -0.1449 0.0235 -0.1636 360 SER B C 4707 O O . SER B 274 ? 1.2100 0.9014 0.8078 -0.1522 0.0295 -0.1726 360 SER B O 4708 C CB . SER B 274 ? 0.9825 0.7110 0.5772 -0.1427 0.0178 -0.1591 360 SER B CB 4709 O OG . SER B 274 ? 0.9998 0.7488 0.5945 -0.1421 0.0090 -0.1524 360 SER B OG 4710 N N . TRP B 275 ? 1.0512 0.7591 0.6744 -0.1333 0.0248 -0.1557 361 TRP B N 4711 C CA . TRP B 275 ? 1.0184 0.7083 0.6485 -0.1273 0.0336 -0.1567 361 TRP B CA 4712 C C . TRP B 275 ? 1.0330 0.7229 0.6734 -0.1137 0.0378 -0.1501 361 TRP B C 4713 O O . TRP B 275 ? 1.0473 0.7527 0.6946 -0.1087 0.0322 -0.1428 361 TRP B O 4714 C CB . TRP B 275 ? 1.0094 0.7011 0.6519 -0.1284 0.0298 -0.1536 361 TRP B CB 4715 C CG . TRP B 275 ? 1.0311 0.7268 0.6674 -0.1417 0.0244 -0.1586 361 TRP B CG 4716 C CD1 . TRP B 275 ? 1.0024 0.7190 0.6397 -0.1476 0.0136 -0.1556 361 TRP B CD1 4717 C CD2 . TRP B 275 ? 0.9889 0.6680 0.6180 -0.1506 0.0296 -0.1671 361 TRP B CD2 4718 N NE1 . TRP B 275 ? 0.9226 0.6382 0.5539 -0.1602 0.0114 -0.1619 361 TRP B NE1 4719 C CE2 . TRP B 275 ? 0.9537 0.6459 0.5798 -0.1627 0.0213 -0.1693 361 TRP B CE2 4720 C CE3 . TRP B 275 ? 0.8650 0.5193 0.4896 -0.1495 0.0410 -0.1730 361 TRP B CE3 4721 C CZ2 . TRP B 275 ? 1.0637 0.7449 0.6825 -0.1747 0.0238 -0.1776 361 TRP B CZ2 4722 C CZ3 . TRP B 275 ? 1.1469 0.7883 0.7635 -0.1609 0.0441 -0.1811 361 TRP B CZ3 4723 C CH2 . TRP B 275 ? 1.1250 0.7800 0.7388 -0.1739 0.0355 -0.1836 361 TRP B CH2 4724 N N . ILE B 276 ? 1.0034 0.6758 0.6445 -0.1079 0.0480 -0.1527 362 ILE B N 4725 C CA . ILE B 276 ? 0.9942 0.6670 0.6472 -0.0949 0.0522 -0.1464 362 ILE B CA 4726 C C . ILE B 276 ? 0.9504 0.6095 0.6118 -0.0897 0.0584 -0.1460 362 ILE B C 4727 O O . ILE B 276 ? 1.0382 0.6784 0.6907 -0.0915 0.0671 -0.1528 362 ILE B O 4728 C CB . ILE B 276 ? 1.0695 0.7355 0.7134 -0.0909 0.0603 -0.1496 362 ILE B CB 4729 C CG1 . ILE B 276 ? 1.0157 0.6930 0.6484 -0.0968 0.0552 -0.1508 362 ILE B CG1 4730 C CG2 . ILE B 276 ? 0.9281 0.5975 0.5855 -0.0779 0.0642 -0.1428 362 ILE B CG2 4731 C CD1 . ILE B 276 ? 0.9247 0.6003 0.5518 -0.0913 0.0617 -0.1514 362 ILE B CD1 4732 N N . GLY B 277 ? 0.9882 0.6564 0.6660 -0.0835 0.0541 -0.1380 363 GLY B N 4733 C CA . GLY B 277 ? 0.9195 0.5768 0.6064 -0.0770 0.0595 -0.1361 363 GLY B CA 4734 C C . GLY B 277 ? 0.9118 0.5692 0.6067 -0.0643 0.0656 -0.1317 363 GLY B C 4735 O O . GLY B 277 ? 0.9408 0.6123 0.6408 -0.0601 0.0623 -0.1271 363 GLY B O 4736 N N . ARG B 278 ? 1.0071 0.6490 0.7031 -0.0581 0.0750 -0.1330 364 ARG B N 4737 C CA . ARG B 278 ? 0.9844 0.6278 0.6884 -0.0458 0.0812 -0.1287 364 ARG B CA 4738 C C . ARG B 278 ? 0.9477 0.5769 0.6568 -0.0377 0.0896 -0.1275 364 ARG B C 4739 O O . ARG B 278 ? 1.0068 0.6198 0.7097 -0.0422 0.0932 -0.1317 364 ARG B O 4740 C CB . ARG B 278 ? 0.9282 0.5681 0.6213 -0.0452 0.0872 -0.1333 364 ARG B CB 4741 C CG . ARG B 278 ? 0.9861 0.6033 0.6670 -0.0448 0.0990 -0.1406 364 ARG B CG 4742 C CD . ARG B 278 ? 0.9298 0.5446 0.5978 -0.0469 0.1035 -0.1460 364 ARG B CD 4743 N NE . ARG B 278 ? 0.9619 0.5544 0.6182 -0.0455 0.1158 -0.1529 364 ARG B NE 4744 C CZ . ARG B 278 ? 1.0756 0.6625 0.7212 -0.0445 0.1229 -0.1575 364 ARG B CZ 4745 N NH1 . ARG B 278 ? 1.0216 0.6240 0.6668 -0.0450 0.1186 -0.1558 364 ARG B NH1 4746 N NH2 . ARG B 278 ? 0.9048 0.4696 0.5395 -0.0429 0.1347 -0.1639 364 ARG B NH2 4747 N N . ILE B 279 ? 0.8850 0.5209 0.6054 -0.0259 0.0928 -0.1215 365 ILE B N 4748 C CA . ILE B 279 ? 0.8735 0.4979 0.5992 -0.0163 0.1012 -0.1192 365 ILE B CA 4749 C C . ILE B 279 ? 0.9384 0.5430 0.6510 -0.0144 0.1134 -0.1259 365 ILE B C 4750 O O . ILE B 279 ? 1.0256 0.6332 0.7330 -0.0132 0.1165 -0.1282 365 ILE B O 4751 C CB . ILE B 279 ? 0.8989 0.5397 0.6412 -0.0043 0.1001 -0.1105 365 ILE B CB 4752 C CG1 . ILE B 279 ? 0.7418 0.4008 0.4953 -0.0071 0.0883 -0.1047 365 ILE B CG1 4753 C CG2 . ILE B 279 ? 0.7732 0.4035 0.5211 0.0065 0.1087 -0.1073 365 ILE B CG2 4754 C CD1 . ILE B 279 ? 0.9576 0.6343 0.7268 0.0028 0.0862 -0.0968 365 ILE B CD1 4755 N N . ILE B 280 ? 0.9554 0.5392 0.6621 -0.0146 0.1206 -0.1291 366 ILE B N 4756 C CA . ILE B 280 ? 1.0578 0.6192 0.7502 -0.0140 0.1329 -0.1362 366 ILE B CA 4757 C C . ILE B 280 ? 1.1326 0.6940 0.8298 0.0004 0.1424 -0.1328 366 ILE B C 4758 O O . ILE B 280 ? 1.0379 0.5936 0.7255 0.0010 0.1490 -0.1376 366 ILE B O 4759 C CB . ILE B 280 ? 1.1565 0.6939 0.8414 -0.0177 0.1391 -0.1401 366 ILE B CB 4760 C CG1 . ILE B 280 ? 1.0728 0.6102 0.7510 -0.0335 0.1305 -0.1451 366 ILE B CG1 4761 C CG2 . ILE B 280 ? 0.9716 0.4838 0.6420 -0.0154 0.1534 -0.1471 366 ILE B CG2 4762 C CD1 . ILE B 280 ? 0.8982 0.4151 0.5716 -0.0383 0.1351 -0.1479 366 ILE B CD1 4763 N N . ASN B 281 ? 1.1682 0.7367 0.8801 0.0121 0.1433 -0.1244 367 ASN B N 4764 C CA . ASN B 281 ? 1.0908 0.6628 0.8089 0.0262 0.1516 -0.1204 367 ASN B CA 4765 C C . ASN B 281 ? 1.0574 0.6578 0.7916 0.0318 0.1439 -0.1127 367 ASN B C 4766 O O . ASN B 281 ? 1.2334 0.8453 0.9808 0.0359 0.1383 -0.1057 367 ASN B O 4767 C CB . ASN B 281 ? 1.1561 0.7127 0.8771 0.0369 0.1611 -0.1169 367 ASN B CB 4768 C CG . ASN B 281 ? 1.1700 0.6961 0.8743 0.0312 0.1701 -0.1247 367 ASN B CG 4769 O OD1 . ASN B 281 ? 1.0709 0.5860 0.7739 0.0263 0.1686 -0.1249 367 ASN B OD1 4770 N ND2 . ASN B 281 ? 1.0966 0.6082 0.7875 0.0312 0.1798 -0.1315 367 ASN B ND2 4771 N N . PRO B 282 ? 0.9493 0.5607 0.6818 0.0313 0.1436 -0.1143 368 PRO B N 4772 C CA . PRO B 282 ? 0.9555 0.5934 0.7018 0.0347 0.1365 -0.1080 368 PRO B CA 4773 C C . PRO B 282 ? 0.9956 0.6446 0.7575 0.0488 0.1398 -0.0999 368 PRO B C 4774 O O . PRO B 282 ? 1.0823 0.7517 0.8576 0.0505 0.1320 -0.0938 368 PRO B O 4775 C CB . PRO B 282 ? 1.1312 0.7724 0.8695 0.0323 0.1395 -0.1124 368 PRO B CB 4776 C CG . PRO B 282 ? 1.0866 0.7073 0.8061 0.0218 0.1420 -0.1215 368 PRO B CG 4777 C CD . PRO B 282 ? 1.0012 0.6005 0.7172 0.0250 0.1490 -0.1228 368 PRO B CD 4778 N N . GLY B 283 ? 1.1045 0.7403 0.8643 0.0588 0.1514 -0.0998 369 GLY B N 4779 C CA . GLY B 283 ? 0.7957 0.4424 0.5695 0.0732 0.1556 -0.0920 369 GLY B CA 4780 C C . GLY B 283 ? 1.0800 0.7275 0.8626 0.0760 0.1511 -0.0862 369 GLY B C 4781 O O . GLY B 283 ? 1.1061 0.7747 0.9022 0.0776 0.1429 -0.0801 369 GLY B O 4782 N N . SER B 284 ? 1.2390 0.8630 1.0135 0.0763 0.1570 -0.0882 370 SER B N 4783 C CA . SER B 284 ? 1.2543 0.8763 1.0348 0.0766 0.1524 -0.0836 370 SER B CA 4784 C C . SER B 284 ? 1.3010 0.9203 1.0754 0.0611 0.1428 -0.0883 370 SER B C 4785 O O . SER B 284 ? 1.6114 1.2099 1.3715 0.0527 0.1461 -0.0957 370 SER B O 4786 C CB . SER B 284 ? 1.3364 0.9325 1.1097 0.0830 0.1637 -0.0839 370 SER B CB 4787 O OG . SER B 284 ? 1.3300 0.9013 1.0862 0.0721 0.1674 -0.0930 370 SER B OG 4788 N N . LYS B 285 ? 1.0589 0.6987 0.8435 0.0571 0.1312 -0.0845 371 LYS B N 4789 C CA . LYS B 285 ? 1.1479 0.7885 0.9267 0.0428 0.1218 -0.0889 371 LYS B CA 4790 C C . LYS B 285 ? 1.2409 0.8622 1.0116 0.0350 0.1217 -0.0923 371 LYS B C 4791 O O . LYS B 285 ? 1.1978 0.8255 0.9713 0.0272 0.1124 -0.0915 371 LYS B O 4792 C CB . LYS B 285 ? 1.0952 0.7609 0.8866 0.0409 0.1101 -0.0836 371 LYS B CB 4793 C CG . LYS B 285 ? 1.0564 0.7392 0.8503 0.0407 0.1078 -0.0838 371 LYS B CG 4794 C CD . LYS B 285 ? 1.1102 0.8061 0.9152 0.0534 0.1126 -0.0783 371 LYS B CD 4795 C CE . LYS B 285 ? 1.1923 0.9046 0.9997 0.0525 0.1111 -0.0788 371 LYS B CE 4796 N NZ . LYS B 285 ? 1.2563 0.9834 1.0754 0.0645 0.1158 -0.0734 371 LYS B NZ 4797 N N . LYS B 286 ? 1.1691 0.7664 0.9291 0.0366 0.1324 -0.0965 372 LYS B N 4798 C CA . LYS B 286 ? 1.1564 0.7338 0.9084 0.0294 0.1339 -0.0999 372 LYS B CA 4799 C C . LYS B 286 ? 1.1504 0.7155 0.8866 0.0149 0.1331 -0.1098 372 LYS B C 4800 O O . LYS B 286 ? 1.1422 0.7032 0.8689 0.0129 0.1373 -0.1155 372 LYS B O 4801 C CB . LYS B 286 ? 1.2101 0.7664 0.9593 0.0395 0.1465 -0.0983 372 LYS B CB 4802 C CG . LYS B 286 ? 1.4569 1.0247 1.2214 0.0523 0.1458 -0.0879 372 LYS B CG 4803 C CD . LYS B 286 ? 1.6090 1.1543 1.3701 0.0590 0.1558 -0.0858 372 LYS B CD 4804 C CE . LYS B 286 ? 1.6378 1.1963 1.4139 0.0697 0.1529 -0.0752 372 LYS B CE 4805 N NZ . LYS B 286 ? 1.5640 1.1229 1.3430 0.0615 0.1450 -0.0738 372 LYS B NZ 4806 N N . GLY B 287 ? 1.0767 0.6372 0.8104 0.0044 0.1276 -0.1119 373 GLY B N 4807 C CA . GLY B 287 ? 1.0611 0.6108 0.7801 -0.0105 0.1263 -0.1212 373 GLY B CA 4808 C C . GLY B 287 ? 1.0940 0.6638 0.8134 -0.0197 0.1145 -0.1226 373 GLY B C 4809 O O . GLY B 287 ? 1.0492 0.6353 0.7737 -0.0152 0.1114 -0.1199 373 GLY B O 4810 N N . PHE B 288 ? 1.0705 0.6396 0.7846 -0.0327 0.1081 -0.1267 374 PHE B N 4811 C CA . PHE B 288 ? 1.0860 0.6720 0.7980 -0.0417 0.0980 -0.1285 374 PHE B CA 4812 C C . PHE B 288 ? 1.0005 0.5744 0.6954 -0.0555 0.0991 -0.1386 374 PHE B C 4813 O O . PHE B 288 ? 1.0548 0.6153 0.7443 -0.0630 0.1010 -0.1425 374 PHE B O 4814 C CB . PHE B 288 ? 0.9446 0.5496 0.6691 -0.0440 0.0863 -0.1222 374 PHE B CB 4815 C CG . PHE B 288 ? 0.9414 0.5653 0.6653 -0.0507 0.0761 -0.1224 374 PHE B CG 4816 C CD1 . PHE B 288 ? 1.0077 0.6481 0.7389 -0.0440 0.0728 -0.1175 374 PHE B CD1 4817 C CD2 . PHE B 288 ? 0.9246 0.5501 0.6405 -0.0637 0.0702 -0.1272 374 PHE B CD2 4818 C CE1 . PHE B 288 ? 0.9235 0.5802 0.6536 -0.0497 0.0641 -0.1171 374 PHE B CE1 4819 C CE2 . PHE B 288 ? 1.0708 0.7142 0.7861 -0.0689 0.0610 -0.1265 374 PHE B CE2 4820 C CZ . PHE B 288 ? 0.9230 0.5811 0.6451 -0.0616 0.0582 -0.1213 374 PHE B CZ 4821 N N . GLU B 289 ? 1.0541 0.6332 0.7404 -0.0592 0.0980 -0.1428 375 GLU B N 4822 C CA . GLU B 289 ? 1.1587 0.7285 0.8279 -0.0728 0.0985 -0.1527 375 GLU B CA 4823 C C . GLU B 289 ? 1.0131 0.6039 0.6814 -0.0807 0.0869 -0.1524 375 GLU B C 4824 O O . GLU B 289 ? 0.9817 0.5908 0.6595 -0.0745 0.0812 -0.1459 375 GLU B O 4825 C CB . GLU B 289 ? 1.0451 0.5970 0.7001 -0.0711 0.1101 -0.1597 375 GLU B CB 4826 C CG . GLU B 289 ? 1.0387 0.6029 0.6961 -0.0632 0.1103 -0.1568 375 GLU B CG 4827 C CD . GLU B 289 ? 1.2043 0.7508 0.8497 -0.0590 0.1230 -0.1626 375 GLU B CD 4828 O OE1 . GLU B 289 ? 1.2531 0.8080 0.9024 -0.0503 0.1253 -0.1595 375 GLU B OE1 4829 O OE2 . GLU B 289 ? 1.2312 0.7552 0.8632 -0.0648 0.1309 -0.1705 375 GLU B OE2 4830 N N . ILE B 290 ? 0.9349 0.5232 0.5916 -0.0945 0.0836 -0.1595 376 ILE B N 4831 C CA . ILE B 290 ? 1.0266 0.6341 0.6799 -0.1023 0.0732 -0.1598 376 ILE B CA 4832 C C . ILE B 290 ? 1.1318 0.7300 0.7652 -0.1141 0.0761 -0.1705 376 ILE B C 4833 O O . ILE B 290 ? 1.2571 0.8382 0.8806 -0.1224 0.0812 -0.1781 376 ILE B O 4834 C CB . ILE B 290 ? 0.9581 0.5823 0.6218 -0.1072 0.0619 -0.1548 376 ILE B CB 4835 C CG1 . ILE B 290 ? 0.9039 0.5510 0.5679 -0.1103 0.0514 -0.1518 376 ILE B CG1 4836 C CG2 . ILE B 290 ? 0.8866 0.5001 0.5434 -0.1193 0.0624 -0.1613 376 ILE B CG2 4837 C CD1 . ILE B 290 ? 0.8583 0.5235 0.5343 -0.1122 0.0406 -0.1452 376 ILE B CD1 4838 N N . TYR B 291 ? 0.9389 0.5477 0.5657 -0.1150 0.0731 -0.1713 377 TYR B N 4839 C CA . TYR B 291 ? 0.9326 0.5317 0.5398 -0.1239 0.0774 -0.1813 377 TYR B CA 4840 C C . TYR B 291 ? 1.0487 0.6663 0.6490 -0.1352 0.0664 -0.1829 377 TYR B C 4841 O O . TYR B 291 ? 0.9972 0.6350 0.6045 -0.1314 0.0584 -0.1759 377 TYR B O 4842 C CB . TYR B 291 ? 0.9062 0.5000 0.5092 -0.1147 0.0853 -0.1815 377 TYR B CB 4843 C CG . TYR B 291 ? 1.0534 0.6300 0.6361 -0.1213 0.0939 -0.1923 377 TYR B CG 4844 C CD1 . TYR B 291 ? 1.2667 0.8301 0.8358 -0.1344 0.0958 -0.2018 377 TYR B CD1 4845 C CD2 . TYR B 291 ? 1.2018 0.7752 0.7784 -0.1148 0.1005 -0.1933 377 TYR B CD2 4846 C CE1 . TYR B 291 ? 1.2504 0.7971 0.7996 -0.1410 0.1040 -0.2124 377 TYR B CE1 4847 C CE2 . TYR B 291 ? 1.3275 0.8847 0.8847 -0.1208 0.1088 -0.2035 377 TYR B CE2 4848 C CZ . TYR B 291 ? 1.3446 0.8881 0.8878 -0.1339 0.1106 -0.2132 377 TYR B CZ 4849 O OH . TYR B 291 ? 1.3291 0.8556 0.8519 -0.1403 0.1192 -0.2239 377 TYR B OH 4850 N N . LYS B 292 ? 0.9971 0.6082 0.5837 -0.1490 0.0662 -0.1920 378 LYS B N 4851 C CA . LYS B 292 ? 1.0169 0.6471 0.5967 -0.1599 0.0556 -0.1934 378 LYS B CA 4852 C C . LYS B 292 ? 1.1433 0.7742 0.7071 -0.1623 0.0576 -0.1984 378 LYS B C 4853 O O . LYS B 292 ? 1.2191 0.8305 0.7701 -0.1630 0.0680 -0.2061 378 LYS B O 4854 C CB . LYS B 292 ? 1.1581 0.7854 0.7313 -0.1748 0.0530 -0.2006 378 LYS B CB 4855 C CG . LYS B 292 ? 1.1764 0.8283 0.7463 -0.1852 0.0404 -0.2002 378 LYS B CG 4856 C CD . LYS B 292 ? 1.3367 0.9824 0.8909 -0.2027 0.0408 -0.2119 378 LYS B CD 4857 C CE . LYS B 292 ? 1.3393 0.9924 0.9024 -0.2106 0.0348 -0.2110 378 LYS B CE 4858 N NZ . LYS B 292 ? 1.2471 0.8810 0.7977 -0.2245 0.0415 -0.2228 378 LYS B NZ 4859 N N . PHE B 293 ? 1.1010 0.7543 0.6653 -0.1630 0.0480 -0.1935 379 PHE B N 4860 C CA . PHE B 293 ? 1.1157 0.7724 0.6647 -0.1659 0.0486 -0.1974 379 PHE B CA 4861 C C . PHE B 293 ? 1.1984 0.8724 0.7382 -0.1787 0.0384 -0.2001 379 PHE B C 4862 O O . PHE B 293 ? 1.1201 0.8132 0.6706 -0.1795 0.0282 -0.1933 379 PHE B O 4863 C CB . PHE B 293 ? 1.0097 0.6767 0.5668 -0.1533 0.0477 -0.1884 379 PHE B CB 4864 C CG . PHE B 293 ? 1.1278 0.7789 0.6913 -0.1415 0.0585 -0.1870 379 PHE B CG 4865 C CD1 . PHE B 293 ? 1.0247 0.6749 0.6067 -0.1322 0.0590 -0.1799 379 PHE B CD1 4866 C CD2 . PHE B 293 ? 1.0566 0.6942 0.6076 -0.1394 0.0683 -0.1927 379 PHE B CD2 4867 C CE1 . PHE B 293 ? 1.0106 0.6480 0.5989 -0.1209 0.0688 -0.1783 379 PHE B CE1 4868 C CE2 . PHE B 293 ? 1.0336 0.6581 0.5912 -0.1279 0.0785 -0.1910 379 PHE B CE2 4869 C CZ . PHE B 293 ? 1.0874 0.7124 0.6638 -0.1185 0.0786 -0.1837 379 PHE B CZ 4870 N N . LEU B 294 ? 1.2636 0.9313 0.7833 -0.1887 0.0414 -0.2101 380 LEU B N 4871 C CA . LEU B 294 ? 1.2032 0.8884 0.7126 -0.2016 0.0320 -0.2133 380 LEU B CA 4872 C C . LEU B 294 ? 1.3000 1.0055 0.8078 -0.1966 0.0253 -0.2061 380 LEU B C 4873 O O . LEU B 294 ? 1.3267 1.0295 0.8183 -0.1991 0.0284 -0.2110 380 LEU B O 4874 C CB . LEU B 294 ? 1.1665 0.8367 0.6542 -0.2152 0.0380 -0.2274 380 LEU B CB 4875 C CG . LEU B 294 ? 1.2602 0.9131 0.7453 -0.2253 0.0428 -0.2363 380 LEU B CG 4876 C CD1 . LEU B 294 ? 1.0006 0.6504 0.5063 -0.2179 0.0427 -0.2291 380 LEU B CD1 4877 C CD2 . LEU B 294 ? 1.0493 0.6725 0.5180 -0.2279 0.0570 -0.2476 380 LEU B CD2 4878 N N . GLY B 295 ? 1.2924 1.0166 0.8163 -0.1890 0.0168 -0.1944 381 GLY B N 4879 C CA . GLY B 295 ? 1.2682 1.0111 0.7918 -0.1835 0.0106 -0.1863 381 GLY B CA 4880 C C . GLY B 295 ? 1.2409 0.9853 0.7802 -0.1684 0.0120 -0.1756 381 GLY B C 4881 O O . GLY B 295 ? 1.1735 0.9090 0.7271 -0.1618 0.0155 -0.1728 381 GLY B O 4882 N N . THR B 296 ? 1.1763 0.9318 0.7120 -0.1633 0.0096 -0.1699 382 THR B N 4883 C CA . THR B 296 ? 1.1451 0.9052 0.6946 -0.1503 0.0098 -0.1593 382 THR B CA 4884 C C . THR B 296 ? 1.1747 0.9165 0.7289 -0.1416 0.0210 -0.1605 382 THR B C 4885 O O . THR B 296 ? 1.1532 0.8813 0.6949 -0.1433 0.0293 -0.1680 382 THR B O 4886 C CB . THR B 296 ? 1.0772 0.8524 0.6193 -0.1479 0.0053 -0.1533 382 THR B CB 4887 O OG1 . THR B 296 ? 1.1656 0.9447 0.7213 -0.1362 0.0057 -0.1432 382 THR B OG1 4888 C CG2 . THR B 296 ? 1.0852 0.8512 0.6085 -0.1508 0.0123 -0.1604 382 THR B CG2 4889 N N . LEU B 297 ? 1.1078 0.8506 0.6801 -0.1320 0.0211 -0.1528 383 LEU B N 4890 C CA . LEU B 297 ? 1.1038 0.8344 0.6824 -0.1224 0.0305 -0.1519 383 LEU B CA 4891 C C . LEU B 297 ? 1.0940 0.8274 0.6649 -0.1183 0.0339 -0.1499 383 LEU B C 4892 O O . LEU B 297 ? 1.0993 0.8228 0.6722 -0.1116 0.0426 -0.1506 383 LEU B O 4893 C CB . LEU B 297 ? 0.9640 0.6991 0.5636 -0.1135 0.0284 -0.1432 383 LEU B CB 4894 C CG . LEU B 297 ? 0.9794 0.7119 0.5889 -0.1159 0.0256 -0.1437 383 LEU B CG 4895 C CD1 . LEU B 297 ? 1.0347 0.7772 0.6633 -0.1081 0.0208 -0.1339 383 LEU B CD1 4896 C CD2 . LEU B 297 ? 1.0097 0.7217 0.6178 -0.1158 0.0352 -0.1510 383 LEU B CD2 4897 N N . PHE B 298 ? 1.1944 0.9417 0.7565 -0.1220 0.0271 -0.1471 384 PHE B N 4898 C CA . PHE B 298 ? 1.1251 0.8772 0.6815 -0.1175 0.0292 -0.1431 384 PHE B CA 4899 C C . PHE B 298 ? 1.1505 0.9003 0.6855 -0.1240 0.0318 -0.1498 384 PHE B C 4900 O O . PHE B 298 ? 1.1996 0.9578 0.7275 -0.1225 0.0305 -0.1456 384 PHE B O 4901 C CB . PHE B 298 ? 0.9867 0.7561 0.5518 -0.1135 0.0207 -0.1320 384 PHE B CB 4902 C CG . PHE B 298 ? 1.0165 0.7879 0.6016 -0.1073 0.0185 -0.1259 384 PHE B CG 4903 C CD1 . PHE B 298 ? 1.0551 0.8185 0.6516 -0.0992 0.0255 -0.1241 384 PHE B CD1 4904 C CD2 . PHE B 298 ? 0.9880 0.7696 0.5807 -0.1097 0.0097 -0.1222 384 PHE B CD2 4905 C CE1 . PHE B 298 ? 1.0180 0.7834 0.6324 -0.0937 0.0236 -0.1188 384 PHE B CE1 4906 C CE2 . PHE B 298 ? 0.9730 0.7558 0.5835 -0.1041 0.0081 -0.1168 384 PHE B CE2 4907 C CZ . PHE B 298 ? 1.0538 0.8283 0.6749 -0.0962 0.0149 -0.1153 384 PHE B CZ 4908 N N . SER B 299 ? 1.1470 0.8847 0.6711 -0.1315 0.0359 -0.1603 385 SER B N 4909 C CA . SER B 299 ? 1.1684 0.8991 0.6719 -0.1370 0.0413 -0.1684 385 SER B CA 4910 C C . SER B 299 ? 1.2487 0.9575 0.7498 -0.1352 0.0535 -0.1766 385 SER B C 4911 O O . SER B 299 ? 1.3538 1.0525 0.8634 -0.1350 0.0559 -0.1794 385 SER B O 4912 C CB . SER B 299 ? 1.1765 0.9139 0.6649 -0.1495 0.0345 -0.1744 385 SER B CB 4913 O OG . SER B 299 ? 1.0861 0.8100 0.5556 -0.1567 0.0417 -0.1858 385 SER B OG 4914 N N . VAL B 300 ? 1.1558 0.8574 0.6457 -0.1331 0.0616 -0.1799 387 VAL B N 4915 C CA . VAL B 300 ? 1.2612 0.9421 0.7466 -0.1311 0.0741 -0.1879 387 VAL B CA 4916 C C . VAL B 300 ? 1.2081 0.8765 0.6792 -0.1422 0.0758 -0.1994 387 VAL B C 4917 O O . VAL B 300 ? 1.2978 0.9481 0.7702 -0.1412 0.0841 -0.2053 387 VAL B O 4918 C CB . VAL B 300 ? 1.3238 1.0013 0.7991 -0.1269 0.0823 -0.1889 387 VAL B CB 4919 C CG1 . VAL B 300 ? 1.4736 1.1302 0.9348 -0.1294 0.0942 -0.2002 387 VAL B CG1 4920 C CG2 . VAL B 300 ? 1.2074 0.8899 0.7002 -0.1146 0.0852 -0.1796 387 VAL B CG2 4921 N N . GLN B 301 ? 1.1800 0.8586 0.6378 -0.1529 0.0679 -0.2024 388 GLN B N 4922 C CA . GLN B 301 ? 1.2779 0.9468 0.7197 -0.1656 0.0689 -0.2141 388 GLN B CA 4923 C C . GLN B 301 ? 1.3188 0.9817 0.7699 -0.1699 0.0667 -0.2165 388 GLN B C 4924 O O . GLN B 301 ? 1.3938 1.0395 0.8345 -0.1774 0.0729 -0.2271 388 GLN B O 4925 C CB . GLN B 301 ? 1.3050 0.9896 0.7299 -0.1762 0.0603 -0.2163 388 GLN B CB 4926 C CG . GLN B 301 ? 1.2234 0.9106 0.6334 -0.1745 0.0639 -0.2165 388 GLN B CG 4927 C CD . GLN B 301 ? 1.5101 1.1742 0.9095 -0.1726 0.0783 -0.2253 388 GLN B CD 4928 O OE1 . GLN B 301 ? 1.7847 1.4315 1.1756 -0.1794 0.0843 -0.2358 388 GLN B OE1 4929 N NE2 . GLN B 301 ? 1.4461 1.1094 0.8461 -0.1634 0.0845 -0.2211 388 GLN B NE2 4930 N N . THR B 302 ? 1.4098 1.0859 0.8798 -0.1655 0.0585 -0.2071 390 THR B N 4931 C CA . THR B 302 ? 1.4039 1.0763 0.8824 -0.1704 0.0556 -0.2091 390 THR B CA 4932 C C . THR B 302 ? 1.3136 0.9614 0.7963 -0.1662 0.0672 -0.2139 390 THR B C 4933 O O . THR B 302 ? 1.2143 0.8529 0.7023 -0.1554 0.0757 -0.2115 390 THR B O 4934 C CB . THR B 302 ? 1.3980 1.0903 0.8954 -0.1668 0.0442 -0.1980 390 THR B CB 4935 O OG1 . THR B 302 ? 1.2367 0.9224 0.7530 -0.1557 0.0480 -0.1919 390 THR B OG1 4936 C CG2 . THR B 302 ? 1.2938 1.0075 0.7908 -0.1638 0.0362 -0.1896 390 THR B CG2 4937 N N . VAL B 303 ? 1.3348 0.9729 0.8153 -0.1749 0.0677 -0.2205 391 VAL B N 4938 C CA . VAL B 303 ? 1.5952 1.2058 1.0680 -0.1762 0.0805 -0.2300 391 VAL B CA 4939 C C . VAL B 303 ? 1.8858 1.4828 1.3743 -0.1686 0.0858 -0.2271 391 VAL B C 4940 O O . VAL B 303 ? 2.0340 1.6135 1.5239 -0.1595 0.0972 -0.2279 391 VAL B O 4941 C CB . VAL B 303 ? 1.6211 1.2235 1.0739 -0.1929 0.0810 -0.2426 391 VAL B CB 4942 C CG1 . VAL B 303 ? 1.7241 1.3466 1.1813 -0.2029 0.0676 -0.2406 391 VAL B CG1 4943 C CG2 . VAL B 303 ? 1.6742 1.2469 1.1214 -0.1950 0.0935 -0.2517 391 VAL B CG2 4944 N N . GLY B 304 ? 1.0051 0.6098 0.5049 -0.1722 0.0783 -0.2237 392 GLY B N 4945 C CA . GLY B 304 ? 1.3160 0.9073 0.8294 -0.1654 0.0836 -0.2211 392 GLY B CA 4946 C C . GLY B 304 ? 1.3499 0.9182 0.8523 -0.1752 0.0912 -0.2318 392 GLY B C 4947 O O . GLY B 304 ? 1.4286 0.9761 0.9158 -0.1772 0.1022 -0.2406 392 GLY B O 4948 N N . ASN B 305 A 1.2366 0.8082 0.7467 -0.1813 0.0856 -0.2309 392 ASN B N 4949 C CA . ASN B 305 A 1.2663 0.8188 0.7659 -0.1931 0.0911 -0.2410 392 ASN B CA 4950 C C . ASN B 305 A 1.4700 1.0056 0.9819 -0.1858 0.0980 -0.2378 392 ASN B C 4951 O O . ASN B 305 A 1.6432 1.1546 1.1507 -0.1793 0.1109 -0.2410 392 ASN B O 4952 C CB . ASN B 305 A 1.2915 0.8619 0.7882 -0.2084 0.0793 -0.2436 392 ASN B CB 4953 C CG . ASN B 305 A 1.3874 0.9404 0.8660 -0.2248 0.0847 -0.2572 392 ASN B CG 4954 O OD1 . ASN B 305 A 1.3124 0.8485 0.7726 -0.2291 0.0935 -0.2668 392 ASN B OD1 4955 N ND2 . ASN B 305 A 1.5619 1.1189 1.0454 -0.2347 0.0796 -0.2584 392 ASN B ND2 4956 N N . ARG B 306 ? 1.2879 0.8367 0.8151 -0.1864 0.0895 -0.2312 393 ARG B N 4957 C CA . ARG B 306 ? 1.2273 0.7614 0.7653 -0.1818 0.0948 -0.2285 393 ARG B CA 4958 C C . ARG B 306 ? 1.2284 0.7671 0.7857 -0.1636 0.0956 -0.2165 393 ARG B C 4959 O O . ARG B 306 ? 1.1307 0.6931 0.7008 -0.1578 0.0857 -0.2074 393 ARG B O 4960 C CB . ARG B 306 ? 1.2502 0.7958 0.7941 -0.1929 0.0857 -0.2281 393 ARG B CB 4961 C CG . ARG B 306 ? 1.3719 0.9009 0.9241 -0.1910 0.0914 -0.2267 393 ARG B CG 4962 C CD . ARG B 306 ? 1.3300 0.8318 0.8650 -0.2035 0.1017 -0.2393 393 ARG B CD 4963 N NE . ARG B 306 ? 1.2813 0.7772 0.8231 -0.2094 0.1015 -0.2389 393 ARG B NE 4964 C CZ . ARG B 306 ? 1.2070 0.6832 0.7558 -0.2007 0.1105 -0.2355 393 ARG B CZ 4965 N NH1 . ARG B 306 ? 1.2397 0.7016 0.7902 -0.1855 0.1200 -0.2320 393 ARG B NH1 4966 N NH2 . ARG B 306 ? 1.1376 0.6094 0.6919 -0.2071 0.1100 -0.2352 393 ARG B NH2 4967 N N . ASN B 307 ? 1.1638 0.6800 0.7227 -0.1546 0.1076 -0.2165 394 ASN B N 4968 C CA . ASN B 307 ? 1.0524 0.5728 0.6296 -0.1379 0.1086 -0.2055 394 ASN B CA 4969 C C . ASN B 307 ? 1.0931 0.6031 0.6801 -0.1361 0.1111 -0.2024 394 ASN B C 4970 O O . ASN B 307 ? 1.1436 0.6279 0.7221 -0.1381 0.1220 -0.2083 394 ASN B O 4971 C CB . ASN B 307 ? 1.0931 0.6001 0.6672 -0.1256 0.1202 -0.2055 394 ASN B CB 4972 C CG . ASN B 307 ? 1.2193 0.7318 0.8123 -0.1088 0.1214 -0.1944 394 ASN B CG 4973 O OD1 . ASN B 307 ? 1.1662 0.6984 0.7693 -0.1012 0.1155 -0.1872 394 ASN B OD1 4974 N ND2 . ASN B 307 ? 1.4356 0.9306 1.0331 -0.1030 0.1294 -0.1929 394 ASN B ND2 4975 N N . TYR B 308 ? 1.0394 0.5689 0.6437 -0.1324 0.1013 -0.1931 395 TYR B N 4976 C CA . TYR B 308 ? 1.1646 0.6877 0.7794 -0.1304 0.1022 -0.1889 395 TYR B CA 4977 C C . TYR B 308 ? 1.2099 0.7306 0.8388 -0.1126 0.1073 -0.1797 395 TYR B C 4978 O O . TYR B 308 ? 1.1638 0.7035 0.8042 -0.1033 0.1015 -0.1719 395 TYR B O 4979 C CB . TYR B 308 ? 1.1858 0.7319 0.8113 -0.1369 0.0887 -0.1841 395 TYR B CB 4980 C CG . TYR B 308 ? 1.1595 0.7105 0.7744 -0.1549 0.0828 -0.1920 395 TYR B CG 4981 C CD1 . TYR B 308 ? 1.2599 0.7948 0.8689 -0.1654 0.0871 -0.1982 395 TYR B CD1 4982 C CD2 . TYR B 308 ? 1.1326 0.7056 0.7440 -0.1614 0.0726 -0.1926 395 TYR B CD2 4983 C CE1 . TYR B 308 ? 1.2720 0.8137 0.8722 -0.1827 0.0813 -0.2055 395 TYR B CE1 4984 C CE2 . TYR B 308 ? 1.1397 0.7200 0.7421 -0.1777 0.0666 -0.1994 395 TYR B CE2 4985 C CZ . TYR B 308 ? 1.2594 0.8246 0.8565 -0.1886 0.0708 -0.2060 395 TYR B CZ 4986 O OH . TYR B 308 ? 1.2580 0.8319 0.8466 -0.2054 0.0648 -0.2128 395 TYR B OH 4987 N N . GLN B 309 ? 1.2208 0.7179 0.8480 -0.1081 0.1184 -0.1807 396 GLN B N 4988 C CA . GLN B 309 ? 1.1731 0.6669 0.8134 -0.0917 0.1236 -0.1719 396 GLN B CA 4989 C C . GLN B 309 ? 1.0956 0.5981 0.7497 -0.0920 0.1168 -0.1651 396 GLN B C 4990 O O . GLN B 309 ? 1.1807 0.6660 0.8319 -0.0960 0.1221 -0.1672 396 GLN B O 4991 C CB . GLN B 309 ? 1.3783 0.8410 1.0085 -0.0868 0.1396 -0.1763 396 GLN B CB 4992 C CG . GLN B 309 ? 1.6518 1.1110 1.2866 -0.0696 0.1481 -0.1713 396 GLN B CG 4993 C CD . GLN B 309 ? 1.8143 1.2723 1.4374 -0.0699 0.1520 -0.1773 396 GLN B CD 4994 O OE1 . GLN B 309 ? 1.7845 1.2572 1.4030 -0.0790 0.1436 -0.1807 396 GLN B OE1 4995 N NE2 . GLN B 309 ? 1.8266 1.2675 1.4450 -0.0593 0.1650 -0.1780 396 GLN B NE2 4996 N N . LEU B 310 ? 1.0137 0.5424 0.6821 -0.0884 0.1054 -0.1571 397 LEU B N 4997 C CA . LEU B 310 ? 1.0224 0.5616 0.7030 -0.0903 0.0978 -0.1513 397 LEU B CA 4998 C C . LEU B 310 ? 1.0284 0.5618 0.7211 -0.0771 0.1027 -0.1431 397 LEU B C 4999 O O . LEU B 310 ? 0.9759 0.5001 0.6709 -0.0797 0.1044 -0.1421 397 LEU B O 5000 C CB . LEU B 310 ? 0.9358 0.5042 0.6258 -0.0923 0.0838 -0.1464 397 LEU B CB 5001 C CG . LEU B 310 ? 1.0103 0.5881 0.6903 -0.1071 0.0764 -0.1530 397 LEU B CG 5002 C CD1 . LEU B 310 ? 1.0444 0.6506 0.7340 -0.1059 0.0639 -0.1466 397 LEU B CD1 5003 C CD2 . LEU B 310 ? 0.9299 0.5005 0.6055 -0.1201 0.0756 -0.1578 397 LEU B CD2 5004 N N . LEU B 311 ? 1.0193 0.5588 0.7195 -0.0632 0.1050 -0.1372 398 LEU B N 5005 C CA . LEU B 311 ? 0.9662 0.5025 0.6777 -0.0496 0.1096 -0.1291 398 LEU B CA 5006 C C . LEU B 311 ? 0.9994 0.5176 0.7048 -0.0395 0.1226 -0.1305 398 LEU B C 5007 O O . LEU B 311 ? 1.1332 0.6525 0.8322 -0.0383 0.1250 -0.1341 398 LEU B O 5008 C CB . LEU B 311 ? 1.0740 0.6366 0.8022 -0.0412 0.1002 -0.1196 398 LEU B CB 5009 C CG . LEU B 311 ? 1.1275 0.7077 0.8649 -0.0475 0.0883 -0.1158 398 LEU B CG 5010 C CD1 . LEU B 311 ? 1.1723 0.7389 0.9082 -0.0533 0.0906 -0.1168 398 LEU B CD1 5011 C CD2 . LEU B 311 ? 1.1825 0.7762 0.9148 -0.0588 0.0794 -0.1201 398 LEU B CD2 5012 N N . SER B 312 ? 1.0863 0.5880 0.7935 -0.0317 0.1313 -0.1272 399 SER B N 5013 C CA . SER B 312 ? 1.1463 0.6280 0.8469 -0.0216 0.1452 -0.1283 399 SER B CA 5014 C C . SER B 312 ? 1.2113 0.6981 0.9255 -0.0043 0.1485 -0.1177 399 SER B C 5015 O O . SER B 312 ? 1.2536 0.7432 0.9702 0.0074 0.1538 -0.1150 399 SER B O 5016 C CB . SER B 312 ? 0.9338 0.3847 0.6196 -0.0292 0.1555 -0.1357 399 SER B CB 5017 O OG . SER B 312 ? 1.5672 0.9976 1.2418 -0.0233 0.1686 -0.1400 399 SER B OG 5018 N N . ASN B 313 ? 1.2801 0.7695 1.0033 -0.0028 0.1452 -0.1116 401 ASN B N 5019 C CA . ASN B 313 ? 1.2751 0.7694 1.0106 0.0131 0.1481 -0.1014 401 ASN B CA 5020 C C . ASN B 313 ? 1.1310 0.6562 0.8822 0.0201 0.1380 -0.0939 401 ASN B C 5021 O O . ASN B 313 ? 1.2859 0.8186 1.0460 0.0343 0.1411 -0.0868 401 ASN B O 5022 C CB . ASN B 313 ? 1.3938 0.8784 1.1322 0.0119 0.1488 -0.0976 401 ASN B CB 5023 C CG . ASN B 313 ? 1.6694 1.1236 1.3923 0.0023 0.1580 -0.1055 401 ASN B CG 5024 O OD1 . ASN B 313 ? 1.7512 1.1914 1.4605 -0.0041 0.1636 -0.1143 401 ASN B OD1 5025 N ND2 . ASN B 313 ? 1.7804 1.2239 1.5047 0.0007 0.1598 -0.1026 401 ASN B ND2 5026 N N . SER B 314 ? 1.0392 0.5828 0.7936 0.0102 0.1260 -0.0955 402 SER B N 5027 C CA . SER B 314 ? 0.8821 0.4534 0.6514 0.0154 0.1160 -0.0882 402 SER B CA 5028 C C . SER B 314 ? 0.9445 0.5317 0.7172 0.0208 0.1147 -0.0876 402 SER B C 5029 O O . SER B 314 ? 1.0460 0.6286 0.8089 0.0159 0.1170 -0.0943 402 SER B O 5030 C CB . SER B 314 ? 0.9599 0.5442 0.7327 0.0037 0.1039 -0.0887 402 SER B CB 5031 O OG . SER B 314 ? 1.0894 0.6637 0.8630 0.0008 0.1045 -0.0870 402 SER B OG 5032 N N . THR B 315 ? 0.9686 0.5747 0.7550 0.0308 0.1111 -0.0797 403 THR B N 5033 C CA . THR B 315 ? 1.0384 0.6634 0.8303 0.0350 0.1082 -0.0783 403 THR B CA 5034 C C . THR B 315 ? 0.9631 0.6061 0.7582 0.0252 0.0960 -0.0789 403 THR B C 5035 O O . THR B 315 ? 0.9721 0.6256 0.7754 0.0233 0.0882 -0.0747 403 THR B O 5036 C CB . THR B 315 ? 0.9851 0.6235 0.7901 0.0494 0.1101 -0.0698 403 THR B CB 5037 O OG1 . THR B 315 ? 1.0431 0.6636 0.8447 0.0589 0.1217 -0.0683 403 THR B OG1 5038 C CG2 . THR B 315 ? 0.9513 0.6074 0.7609 0.0532 0.1088 -0.0692 403 THR B CG2 5039 N N . ILE B 316 ? 0.8475 0.4935 0.6358 0.0195 0.0948 -0.0841 404 ILE B N 5040 C CA . ILE B 316 ? 0.8844 0.5421 0.6714 0.0089 0.0847 -0.0862 404 ILE B CA 5041 C C . ILE B 316 ? 0.9570 0.6365 0.7529 0.0126 0.0795 -0.0822 404 ILE B C 5042 O O . ILE B 316 ? 1.0070 0.6903 0.8050 0.0203 0.0849 -0.0812 404 ILE B O 5043 C CB . ILE B 316 ? 0.9280 0.5733 0.6993 -0.0013 0.0869 -0.0951 404 ILE B CB 5044 C CG1 . ILE B 316 ? 0.9080 0.5297 0.6693 -0.0057 0.0934 -0.1000 404 ILE B CG1 5045 C CG2 . ILE B 316 ? 0.8041 0.4617 0.5733 -0.0119 0.0766 -0.0968 404 ILE B CG2 5046 C CD1 . ILE B 316 ? 0.9680 0.5892 0.7330 -0.0114 0.0878 -0.0982 404 ILE B CD1 5047 N N . GLY B 317 ? 0.9012 0.5951 0.7023 0.0072 0.0695 -0.0798 405 GLY B N 5048 C CA . GLY B 317 ? 0.6638 0.3766 0.4713 0.0085 0.0644 -0.0769 405 GLY B CA 5049 C C . GLY B 317 ? 0.8552 0.5728 0.6563 -0.0020 0.0572 -0.0799 405 GLY B C 5050 O O . GLY B 317 ? 0.8417 0.5508 0.6308 -0.0078 0.0596 -0.0859 405 GLY B O 5051 N N . ARG B 318 ? 0.7623 0.4932 0.5709 -0.0043 0.0486 -0.0757 406 ARG B N 5052 C CA . ARG B 318 ? 0.8563 0.5946 0.6603 -0.0126 0.0414 -0.0770 406 ARG B CA 5053 C C . ARG B 318 ? 0.7578 0.4871 0.5529 -0.0219 0.0388 -0.0812 406 ARG B C 5054 O O . ARG B 318 ? 0.8284 0.5481 0.6238 -0.0225 0.0405 -0.0818 406 ARG B O 5055 C CB . ARG B 318 ? 0.8544 0.6091 0.6689 -0.0114 0.0340 -0.0709 406 ARG B CB 5056 C CG . ARG B 318 ? 0.8625 0.6288 0.6850 -0.0044 0.0356 -0.0674 406 ARG B CG 5057 C CD . ARG B 318 ? 0.5879 0.3687 0.4194 -0.0045 0.0284 -0.0622 406 ARG B CD 5058 N NE . ARG B 318 ? 0.8577 0.6368 0.6929 -0.0059 0.0242 -0.0600 406 ARG B NE 5059 C CZ . ARG B 318 ? 0.7680 0.5506 0.6025 -0.0116 0.0175 -0.0590 406 ARG B CZ 5060 N NH1 . ARG B 318 ? 0.7238 0.5122 0.5538 -0.0161 0.0136 -0.0592 406 ARG B NH1 5061 N NH2 . ARG B 318 ? 0.8105 0.5910 0.6486 -0.0124 0.0149 -0.0572 406 ARG B NH2 5062 N N . SER B 319 ? 0.7650 0.4977 0.5518 -0.0293 0.0348 -0.0841 407 SER B N 5063 C CA . SER B 319 ? 0.8524 0.5800 0.6306 -0.0391 0.0314 -0.0882 407 SER B CA 5064 C C . SER B 319 ? 0.8017 0.5425 0.5776 -0.0442 0.0235 -0.0867 407 SER B C 5065 O O . SER B 319 ? 0.8480 0.5952 0.6226 -0.0420 0.0237 -0.0857 407 SER B O 5066 C CB . SER B 319 ? 0.8544 0.5659 0.6190 -0.0434 0.0383 -0.0961 407 SER B CB 5067 O OG . SER B 319 ? 0.9464 0.6560 0.7068 -0.0389 0.0441 -0.0978 407 SER B OG 5068 N N . GLY B 320 ? 0.8099 0.5552 0.5856 -0.0507 0.0169 -0.0862 408 GLY B N 5069 C CA . GLY B 320 ? 0.7599 0.5186 0.5341 -0.0546 0.0093 -0.0838 408 GLY B CA 5070 C C . GLY B 320 ? 0.8457 0.6072 0.6152 -0.0636 0.0035 -0.0857 408 GLY B C 5071 O O . GLY B 320 ? 0.9077 0.6617 0.6771 -0.0672 0.0048 -0.0884 408 GLY B O 5072 N N . LEU B 321 ? 0.9101 0.6833 0.6759 -0.0671 -0.0026 -0.0840 409 LEU B N 5073 C CA . LEU B 321 ? 0.8390 0.6181 0.6001 -0.0757 -0.0086 -0.0855 409 LEU B CA 5074 C C . LEU B 321 ? 0.9020 0.6938 0.6737 -0.0744 -0.0156 -0.0788 409 LEU B C 5075 O O . LEU B 321 ? 0.9187 0.7174 0.6984 -0.0676 -0.0172 -0.0727 409 LEU B O 5076 C CB . LEU B 321 ? 0.8288 0.6146 0.5786 -0.0802 -0.0115 -0.0872 409 LEU B CB 5077 C CG . LEU B 321 ? 0.9180 0.6947 0.6528 -0.0868 -0.0075 -0.0954 409 LEU B CG 5078 C CD1 . LEU B 321 ? 0.9069 0.6661 0.6401 -0.0878 0.0001 -0.1014 409 LEU B CD1 5079 C CD2 . LEU B 321 ? 0.7499 0.5272 0.4790 -0.0827 -0.0048 -0.0948 409 LEU B CD2 5080 N N . TYR B 322 ? 0.8200 0.6153 0.5914 -0.0814 -0.0196 -0.0802 410 TYR B N 5081 C CA . TYR B 322 ? 0.8072 0.6168 0.5866 -0.0814 -0.0270 -0.0742 410 TYR B CA 5082 C C . TYR B 322 ? 0.8055 0.6231 0.5793 -0.0913 -0.0322 -0.0770 410 TYR B C 5083 O O . TYR B 322 ? 0.7895 0.5988 0.5550 -0.0989 -0.0295 -0.0842 410 TYR B O 5084 C CB . TYR B 322 ? 0.7745 0.5823 0.5668 -0.0766 -0.0262 -0.0702 410 TYR B CB 5085 C CG . TYR B 322 ? 0.8925 0.6897 0.6852 -0.0812 -0.0229 -0.0746 410 TYR B CG 5086 C CD1 . TYR B 322 ? 0.9857 0.7666 0.7767 -0.0785 -0.0150 -0.0783 410 TYR B CD1 5087 C CD2 . TYR B 322 ? 0.8035 0.6070 0.5984 -0.0880 -0.0272 -0.0748 410 TYR B CD2 5088 C CE1 . TYR B 322 ? 0.9392 0.7086 0.7298 -0.0823 -0.0111 -0.0819 410 TYR B CE1 5089 C CE2 . TYR B 322 ? 0.7645 0.5571 0.5593 -0.0927 -0.0235 -0.0788 410 TYR B CE2 5090 C CZ . TYR B 322 ? 0.9068 0.6816 0.6992 -0.0897 -0.0153 -0.0823 410 TYR B CZ 5091 O OH . TYR B 322 ? 0.9706 0.7327 0.7623 -0.0939 -0.0107 -0.0860 410 TYR B OH 5092 N N . GLN B 323 ? 0.7705 0.6044 0.5485 -0.0910 -0.0393 -0.0712 411 GLN B N 5093 C CA . GLN B 323 ? 0.8583 0.7042 0.6325 -0.0998 -0.0452 -0.0726 411 GLN B CA 5094 C C . GLN B 323 ? 0.9363 0.7933 0.7219 -0.0997 -0.0501 -0.0675 411 GLN B C 5095 O O . GLN B 323 ? 1.0705 0.9380 0.8635 -0.0931 -0.0537 -0.0600 411 GLN B O 5096 C CB . GLN B 323 ? 0.7269 0.5853 0.4932 -0.1003 -0.0498 -0.0705 411 GLN B CB 5097 C CG . GLN B 323 ? 0.9208 0.7702 0.6734 -0.1033 -0.0458 -0.0768 411 GLN B CG 5098 C CD . GLN B 323 ? 0.9276 0.7891 0.6720 -0.1031 -0.0500 -0.0739 411 GLN B CD 5099 O OE1 . GLN B 323 ? 0.9530 0.8196 0.7011 -0.0952 -0.0512 -0.0670 411 GLN B OE1 5100 N NE2 . GLN B 323 ? 0.8696 0.7355 0.6023 -0.1119 -0.0521 -0.0793 411 GLN B NE2 5101 N N . PRO B 324 ? 0.9073 0.7614 0.6942 -0.1071 -0.0497 -0.0717 412 PRO B N 5102 C CA . PRO B 324 ? 0.9527 0.8186 0.7501 -0.1081 -0.0542 -0.0673 412 PRO B CA 5103 C C . PRO B 324 ? 1.0620 0.9494 0.8586 -0.1107 -0.0622 -0.0634 412 PRO B C 5104 O O . PRO B 324 ? 0.9760 0.8687 0.7621 -0.1169 -0.0644 -0.0672 412 PRO B O 5105 C CB . PRO B 324 ? 0.9777 0.8348 0.7730 -0.1178 -0.0513 -0.0743 412 PRO B CB 5106 C CG . PRO B 324 ? 1.1058 0.9420 0.8928 -0.1178 -0.0435 -0.0807 412 PRO B CG 5107 C CD . PRO B 324 ? 1.0143 0.8530 0.7929 -0.1148 -0.0441 -0.0808 412 PRO B CD 5108 N N . ALA B 325 ? 1.1388 1.0389 0.9461 -0.1054 -0.0664 -0.0556 413 ALA B N 5109 C CA . ALA B 325 ? 1.1546 1.0763 0.9623 -0.1062 -0.0737 -0.0506 413 ALA B CA 5110 C C . ALA B 325 ? 1.1381 1.0741 0.9559 -0.1089 -0.0780 -0.0473 413 ALA B C 5111 O O . ALA B 325 ? 1.1538 1.1093 0.9736 -0.1083 -0.0841 -0.0420 413 ALA B O 5112 C CB . ALA B 325 ? 1.1468 1.0729 0.9555 -0.0955 -0.0749 -0.0430 413 ALA B CB 5113 N N . TYR B 326 A 1.2099 1.1368 1.0340 -0.1115 -0.0748 -0.0497 413 TYR B N 5114 C CA . TYR B 326 A 1.2929 1.2331 1.1257 -0.1161 -0.0784 -0.0478 413 TYR B CA 5115 C C . TYR B 326 A 1.5093 1.4538 1.3349 -0.1303 -0.0798 -0.0557 413 TYR B C 5116 O O . TYR B 326 A 1.5918 1.5198 1.4123 -0.1370 -0.0747 -0.0633 413 TYR B O 5117 C CB . TYR B 326 A 1.2261 1.1564 1.0694 -0.1120 -0.0744 -0.0457 413 TYR B CB 5118 C CG . TYR B 326 A 1.2150 1.1220 1.0550 -0.1138 -0.0669 -0.0520 413 TYR B CG 5119 C CD1 . TYR B 326 A 1.1135 1.0052 0.9492 -0.1070 -0.0622 -0.0529 413 TYR B CD1 5120 C CD2 . TYR B 326 A 1.2011 1.1015 1.0426 -0.1219 -0.0642 -0.0565 413 TYR B CD2 5121 C CE1 . TYR B 326 A 1.0734 0.9446 0.9065 -0.1076 -0.0551 -0.0580 413 TYR B CE1 5122 C CE2 . TYR B 326 A 1.1773 1.0557 1.0156 -0.1227 -0.0568 -0.0616 413 TYR B CE2 5123 C CZ . TYR B 326 A 1.1463 1.0105 0.9805 -0.1151 -0.0523 -0.0621 413 TYR B CZ 5124 O OH . TYR B 326 A 1.1746 1.0176 1.0057 -0.1149 -0.0447 -0.0665 413 TYR B OH 5125 N N . GLU B 327 ? 1.5926 1.5593 1.4172 -0.1347 -0.0867 -0.0537 414 GLU B N 5126 C CA . GLU B 327 ? 1.4921 1.4642 1.3053 -0.1467 -0.0888 -0.0612 414 GLU B CA 5127 C C . GLU B 327 ? 1.5570 1.5578 1.3708 -0.1498 -0.0973 -0.0572 414 GLU B C 5128 O O . GLU B 327 ? 1.6641 1.6777 1.4808 -0.1403 -0.1011 -0.0488 414 GLU B O 5129 C CB . GLU B 327 ? 2.0693 2.0276 1.8697 -0.1446 -0.0855 -0.0651 414 GLU B CB 5130 C CG . GLU B 327 ? 1.9227 1.8974 1.7127 -0.1481 -0.0911 -0.0654 414 GLU B CG 5131 C CD . GLU B 327 ? 1.8235 1.7879 1.6043 -0.1410 -0.0885 -0.0649 414 GLU B CD 5132 O OE1 . GLU B 327 ? 1.7555 1.6998 1.5373 -0.1346 -0.0821 -0.0655 414 GLU B OE1 5133 O OE2 . GLU B 327 ? 1.6972 1.6745 1.4698 -0.1418 -0.0928 -0.0636 414 GLU B OE2 5134 N N . SER B 328 ? 1.5812 1.5924 1.3923 -0.1631 -0.0999 -0.0631 415 SER B N 5135 C CA . SER B 328 ? 1.6322 1.6657 1.4363 -0.1692 -0.1067 -0.0636 415 SER B CA 5136 C C . SER B 328 ? 1.6428 1.6644 1.4342 -0.1835 -0.1037 -0.0759 415 SER B C 5137 O O . SER B 328 ? 1.8003 1.8301 1.5916 -0.1966 -0.1052 -0.0816 415 SER B O 5138 C CB . SER B 328 ? 1.7575 1.8204 1.5716 -0.1719 -0.1140 -0.0581 415 SER B CB 5139 O OG . SER B 328 ? 1.8510 1.9107 1.6778 -0.1720 -0.1116 -0.0566 415 SER B OG 5140 N N . ARG B 329 A 1.4945 1.4947 1.2754 -0.1808 -0.0982 -0.0802 415 ARG B N 5141 C CA . ARG B 329 A 1.4665 1.4566 1.2323 -0.1926 -0.0956 -0.0913 415 ARG B CA 5142 C C . ARG B 329 A 1.3248 1.3363 1.0817 -0.1944 -0.1026 -0.0899 415 ARG B C 5143 O O . ARG B 329 A 1.2790 1.3129 1.0425 -0.1875 -0.1091 -0.0805 415 ARG B O 5144 C CB . ARG B 329 A 1.5831 1.5430 1.3416 -0.1877 -0.0868 -0.0957 415 ARG B CB 5145 C CG . ARG B 329 A 1.5829 1.5219 1.3509 -0.1820 -0.0797 -0.0948 415 ARG B CG 5146 C CD . ARG B 329 A 1.5639 1.4830 1.3262 -0.1932 -0.0729 -0.1052 415 ARG B CD 5147 N NE . ARG B 329 A 1.6015 1.5263 1.3744 -0.1986 -0.0738 -0.1043 415 ARG B NE 5148 C CZ . ARG B 329 A 1.6071 1.5352 1.3763 -0.2136 -0.0741 -0.1117 415 ARG B CZ 5149 N NH1 . ARG B 329 A 1.6126 1.5386 1.3672 -0.2252 -0.0736 -0.1210 415 ARG B NH1 5150 N NH2 . ARG B 329 A 1.5642 1.4979 1.3442 -0.2176 -0.0745 -0.1100 415 ARG B NH2 5151 N N . ASP B 330 ? 1.4228 1.4275 1.1641 -0.2035 -0.1010 -0.0989 416 ASP B N 5152 C CA . ASP B 330 ? 1.4819 1.5068 1.2133 -0.2059 -0.1075 -0.0980 416 ASP B CA 5153 C C . ASP B 330 ? 1.3841 1.3908 1.1035 -0.2000 -0.1026 -0.1000 416 ASP B C 5154 O O . ASP B 330 ? 1.4699 1.4847 1.1763 -0.2037 -0.1053 -0.1025 416 ASP B O 5155 C CB . ASP B 330 ? 1.5956 1.6305 1.3177 -0.2241 -0.1101 -0.1081 416 ASP B CB 5156 C CG . ASP B 330 ? 1.7005 1.7191 1.4256 -0.2344 -0.1045 -0.1164 416 ASP B CG 5157 O OD1 . ASP B 330 ? 1.6800 1.6687 1.4004 -0.2334 -0.0955 -0.1221 416 ASP B OD1 5158 O OD2 . ASP B 330 ? 1.7334 1.7690 1.4659 -0.2430 -0.1086 -0.1168 416 ASP B OD2 5159 N N . CYS B 331 ? 1.1748 1.1582 0.8989 -0.1904 -0.0955 -0.0984 417 CYS B N 5160 C CA . CYS B 331 ? 1.1935 1.1542 0.9063 -0.1878 -0.0884 -0.1034 417 CYS B CA 5161 C C . CYS B 331 ? 1.0518 0.9918 0.7741 -0.1759 -0.0816 -0.0996 417 CYS B C 5162 O O . CYS B 331 ? 0.8798 0.8143 0.6133 -0.1755 -0.0797 -0.0987 417 CYS B O 5163 C CB . CYS B 331 ? 1.1133 1.0611 0.8126 -0.2027 -0.0842 -0.1169 417 CYS B CB 5164 S SG . CYS B 331 ? 1.5098 1.4207 1.2064 -0.2024 -0.0718 -0.1249 417 CYS B SG 5165 N N . GLN B 332 ? 0.9880 0.9177 0.7060 -0.1665 -0.0781 -0.0971 418 GLN B N 5166 C CA . GLN B 332 ? 0.9229 0.8379 0.6506 -0.1542 -0.0730 -0.0919 418 GLN B CA 5167 C C . GLN B 332 ? 0.9438 0.8320 0.6685 -0.1555 -0.0635 -0.0995 418 GLN B C 5168 O O . GLN B 332 ? 1.0009 0.8768 0.7132 -0.1580 -0.0589 -0.1060 418 GLN B O 5169 C CB . GLN B 332 ? 0.8947 0.8123 0.6204 -0.1432 -0.0735 -0.0850 418 GLN B CB 5170 C CG . GLN B 332 ? 0.8266 0.7311 0.5622 -0.1311 -0.0685 -0.0797 418 GLN B CG 5171 C CD . GLN B 332 ? 0.9050 0.8166 0.6565 -0.1264 -0.0712 -0.0729 418 GLN B CD 5172 O OE1 . GLN B 332 ? 1.0354 0.9666 0.7919 -0.1255 -0.0779 -0.0666 418 GLN B OE1 5173 N NE2 . GLN B 332 ? 0.7867 0.6829 0.5459 -0.1231 -0.0657 -0.0739 418 GLN B NE2 5174 N N . GLU B 333 ? 0.8513 0.7308 0.5874 -0.1530 -0.0605 -0.0982 419 GLU B N 5175 C CA . GLU B 333 ? 0.7782 0.6328 0.5129 -0.1530 -0.0514 -0.1042 419 GLU B CA 5176 C C . GLU B 333 ? 0.8458 0.6875 0.5815 -0.1409 -0.0459 -0.1011 419 GLU B C 5177 O O . GLU B 333 ? 0.9414 0.7924 0.6839 -0.1315 -0.0490 -0.0929 419 GLU B O 5178 C CB . GLU B 333 ? 0.7866 0.6372 0.5325 -0.1544 -0.0501 -0.1033 419 GLU B CB 5179 C CG . GLU B 333 ? 1.1347 0.9596 0.8808 -0.1524 -0.0404 -0.1077 419 GLU B CG 5180 C CD . GLU B 333 ? 1.2264 1.0348 0.9581 -0.1630 -0.0343 -0.1190 419 GLU B CD 5181 O OE1 . GLU B 333 ? 1.3022 1.1093 1.0215 -0.1655 -0.0336 -0.1233 419 GLU B OE1 5182 O OE2 . GLU B 333 ? 1.2626 1.0583 0.9948 -0.1689 -0.0297 -0.1235 419 GLU B OE2 5183 N N . LEU B 334 ? 0.8920 0.7127 0.6202 -0.1417 -0.0375 -0.1079 420 LEU B N 5184 C CA . LEU B 334 ? 0.8261 0.6338 0.5556 -0.1311 -0.0312 -0.1060 420 LEU B CA 5185 C C . LEU B 334 ? 0.8506 0.6382 0.5843 -0.1284 -0.0230 -0.1087 420 LEU B C 5186 O O . LEU B 334 ? 0.9680 0.7430 0.6951 -0.1363 -0.0186 -0.1162 420 LEU B O 5187 C CB . LEU B 334 ? 0.8075 0.6092 0.5225 -0.1326 -0.0280 -0.1111 420 LEU B CB 5188 C CG . LEU B 334 ? 0.8959 0.7029 0.6125 -0.1225 -0.0285 -0.1049 420 LEU B CG 5189 C CD1 . LEU B 334 ? 0.9132 0.7104 0.6158 -0.1236 -0.0232 -0.1106 420 LEU B CD1 5190 C CD2 . LEU B 334 ? 0.8057 0.6074 0.5356 -0.1114 -0.0255 -0.0987 420 LEU B CD2 5191 N N . CYS B 335 ? 0.8501 0.6347 0.5942 -0.1172 -0.0208 -0.1025 421 CYS B N 5192 C CA . CYS B 335 ? 0.8752 0.6425 0.6240 -0.1128 -0.0132 -0.1036 421 CYS B CA 5193 C C . CYS B 335 ? 0.9043 0.6645 0.6553 -0.1018 -0.0079 -0.1010 421 CYS B C 5194 O O . CYS B 335 ? 0.8593 0.6287 0.6103 -0.0972 -0.0106 -0.0974 421 CYS B O 5195 C CB . CYS B 335 ? 0.8365 0.6092 0.5991 -0.1103 -0.0161 -0.0979 421 CYS B CB 5196 S SG . CYS B 335 ? 0.8829 0.6645 0.6459 -0.1227 -0.0216 -0.1002 421 CYS B SG 5197 N N . PHE B 336 ? 0.8733 0.6175 0.6265 -0.0975 -0.0002 -0.1026 422 PHE B N 5198 C CA . PHE B 336 ? 0.8741 0.6146 0.6324 -0.0863 0.0042 -0.0989 422 PHE B CA 5199 C C . PHE B 336 ? 0.9286 0.6605 0.6969 -0.0795 0.0088 -0.0958 422 PHE B C 5200 O O . PHE B 336 ? 0.9444 0.6676 0.7127 -0.0837 0.0109 -0.0981 422 PHE B O 5201 C CB . PHE B 336 ? 0.9787 0.7095 0.7255 -0.0859 0.0105 -0.1043 422 PHE B CB 5202 C CG . PHE B 336 ? 0.9558 0.6672 0.6924 -0.0910 0.0184 -0.1125 422 PHE B CG 5203 C CD1 . PHE B 336 ? 0.9616 0.6577 0.7013 -0.0841 0.0269 -0.1126 422 PHE B CD1 5204 C CD2 . PHE B 336 ? 0.9135 0.6218 0.6370 -0.1024 0.0177 -0.1200 422 PHE B CD2 5205 C CE1 . PHE B 336 ? 1.0021 0.6783 0.7318 -0.0882 0.0353 -0.1199 422 PHE B CE1 5206 C CE2 . PHE B 336 ? 1.0162 0.7047 0.7292 -0.1076 0.0259 -0.1281 422 PHE B CE2 5207 C CZ . PHE B 336 ? 0.9855 0.6570 0.7015 -0.1002 0.0350 -0.1280 422 PHE B CZ 5208 N N . TRP B 337 ? 0.9098 0.6454 0.6867 -0.0692 0.0099 -0.0902 423 TRP B N 5209 C CA . TRP B 337 ? 0.7783 0.5068 0.5641 -0.0614 0.0146 -0.0869 423 TRP B CA 5210 C C . TRP B 337 ? 0.8929 0.6119 0.6762 -0.0541 0.0227 -0.0884 423 TRP B C 5211 O O . TRP B 337 ? 1.0430 0.7655 0.8214 -0.0532 0.0231 -0.0898 423 TRP B O 5212 C CB . TRP B 337 ? 0.8256 0.5682 0.6249 -0.0554 0.0090 -0.0789 423 TRP B CB 5213 C CG . TRP B 337 ? 0.7980 0.5531 0.5990 -0.0519 0.0053 -0.0756 423 TRP B CG 5214 C CD1 . TRP B 337 ? 0.8402 0.6086 0.6409 -0.0555 -0.0020 -0.0734 423 TRP B CD1 5215 C CD2 . TRP B 337 ? 0.7783 0.5341 0.5816 -0.0441 0.0091 -0.0740 423 TRP B CD2 5216 N NE1 . TRP B 337 ? 0.7670 0.5425 0.5690 -0.0506 -0.0026 -0.0706 423 TRP B NE1 5217 C CE2 . TRP B 337 ? 0.7215 0.4899 0.5252 -0.0441 0.0041 -0.0712 423 TRP B CE2 5218 C CE3 . TRP B 337 ? 0.7566 0.5040 0.5617 -0.0370 0.0166 -0.0744 423 TRP B CE3 5219 C CZ2 . TRP B 337 ? 0.7220 0.4945 0.5277 -0.0382 0.0064 -0.0693 423 TRP B CZ2 5220 C CZ3 . TRP B 337 ? 0.8017 0.5550 0.6095 -0.0309 0.0184 -0.0724 423 TRP B CZ3 5221 C CH2 . TRP B 337 ? 0.8493 0.6149 0.6574 -0.0320 0.0134 -0.0701 423 TRP B CH2 5222 N N . ILE B 338 ? 0.8467 0.5540 0.6333 -0.0486 0.0293 -0.0878 424 ILE B N 5223 C CA . ILE B 338 ? 0.8211 0.5205 0.6074 -0.0399 0.0374 -0.0880 424 ILE B CA 5224 C C . ILE B 338 ? 0.8421 0.5444 0.6410 -0.0301 0.0386 -0.0812 424 ILE B C 5225 O O . ILE B 338 ? 0.7570 0.4531 0.5591 -0.0303 0.0394 -0.0797 424 ILE B O 5226 C CB . ILE B 338 ? 0.8577 0.5358 0.6328 -0.0424 0.0466 -0.0947 424 ILE B CB 5227 C CG1 . ILE B 338 ? 0.7980 0.4724 0.5594 -0.0534 0.0455 -0.1023 424 ILE B CG1 5228 C CG2 . ILE B 338 ? 0.8229 0.4934 0.5985 -0.0320 0.0556 -0.0941 424 ILE B CG2 5229 C CD1 . ILE B 338 ? 0.8157 0.4684 0.5654 -0.0578 0.0541 -0.1096 424 ILE B CD1 5230 N N . GLU B 339 ? 0.8843 0.5966 0.6900 -0.0219 0.0388 -0.0772 425 GLU B N 5231 C CA . GLU B 339 ? 0.8358 0.5522 0.6529 -0.0122 0.0403 -0.0710 425 GLU B CA 5232 C C . GLU B 339 ? 0.8290 0.5317 0.6432 -0.0051 0.0505 -0.0724 425 GLU B C 5233 O O . GLU B 339 ? 0.8325 0.5302 0.6397 -0.0045 0.0555 -0.0763 425 GLU B O 5234 C CB . GLU B 339 ? 0.8774 0.6117 0.7031 -0.0075 0.0359 -0.0663 425 GLU B CB 5235 C CG . GLU B 339 ? 0.9175 0.6604 0.7557 0.0007 0.0350 -0.0596 425 GLU B CG 5236 C CD . GLU B 339 ? 1.0230 0.7834 0.8683 0.0030 0.0301 -0.0560 425 GLU B CD 5237 O OE1 . GLU B 339 ? 1.0009 0.7646 0.8429 0.0031 0.0318 -0.0581 425 GLU B OE1 5238 O OE2 . GLU B 339 ? 1.0343 0.8048 0.8879 0.0042 0.0249 -0.0515 425 GLU B OE2 5239 N N . ILE B 340 ? 0.8277 0.5238 0.6468 0.0004 0.0540 -0.0690 426 ILE B N 5240 C CA . ILE B 340 ? 0.8152 0.4974 0.6318 0.0083 0.0643 -0.0694 426 ILE B CA 5241 C C . ILE B 340 ? 0.9336 0.6244 0.7620 0.0201 0.0656 -0.0618 426 ILE B C 5242 O O . ILE B 340 ? 0.8517 0.5531 0.6888 0.0207 0.0595 -0.0568 426 ILE B O 5243 C CB . ILE B 340 ? 0.9304 0.5906 0.7380 0.0037 0.0701 -0.0734 426 ILE B CB 5244 C CG1 . ILE B 340 ? 0.8551 0.5156 0.6692 0.0031 0.0668 -0.0690 426 ILE B CG1 5245 C CG2 . ILE B 340 ? 1.0790 0.7319 0.8744 -0.0089 0.0685 -0.0814 426 ILE B CG2 5246 C CD1 . ILE B 340 ? 0.9037 0.5421 0.7116 0.0032 0.0751 -0.0707 426 ILE B CD1 5247 N N . ALA B 341 ? 1.0117 0.6987 0.8403 0.0295 0.0735 -0.0609 427 ALA B N 5248 C CA . ALA B 341 ? 0.9575 0.6518 0.7964 0.0414 0.0759 -0.0536 427 ALA B CA 5249 C C . ALA B 341 ? 1.0524 0.7329 0.8909 0.0433 0.0792 -0.0511 427 ALA B C 5250 O O . ALA B 341 ? 1.1538 0.8139 0.9823 0.0386 0.0845 -0.0557 427 ALA B O 5251 C CB . ALA B 341 ? 0.8704 0.5631 0.7088 0.0511 0.0844 -0.0533 427 ALA B CB 5252 N N . ALA B 342 ? 0.9869 0.6783 0.8357 0.0498 0.0762 -0.0440 428 ALA B N 5253 C CA . ALA B 342 ? 1.0958 0.7758 0.9449 0.0520 0.0789 -0.0407 428 ALA B CA 5254 C C . ALA B 342 ? 1.1461 0.8382 1.0060 0.0641 0.0792 -0.0321 428 ALA B C 5255 O O . ALA B 342 ? 1.0795 0.7914 0.9476 0.0693 0.0758 -0.0290 428 ALA B O 5256 C CB . ALA B 342 ? 1.1839 0.8640 1.0323 0.0408 0.0714 -0.0422 428 ALA B CB 5257 N N . THR B 343 ? 1.1622 0.8428 1.0219 0.0683 0.0834 -0.0282 429 THR B N 5258 C CA . THR B 343 ? 1.2622 0.9540 1.1313 0.0798 0.0836 -0.0196 429 THR B CA 5259 C C . THR B 343 ? 1.2591 0.9481 1.1302 0.0765 0.0800 -0.0164 429 THR B C 5260 O O . THR B 343 ? 1.1662 0.8371 1.0298 0.0688 0.0821 -0.0199 429 THR B O 5261 C CB . THR B 343 ? 1.2404 0.9210 1.1075 0.0928 0.0948 -0.0160 429 THR B CB 5262 O OG1 . THR B 343 ? 1.3044 0.9699 1.1620 0.0909 0.1019 -0.0225 429 THR B OG1 5263 C CG2 . THR B 343 ? 1.1448 0.8478 1.0226 0.1047 0.0938 -0.0094 429 THR B CG2 5264 N N . THR B 344 ? 1.3195 1.0272 1.2006 0.0816 0.0744 -0.0099 430 THR B N 5265 C CA . THR B 344 ? 1.3576 1.0645 1.2412 0.0798 0.0711 -0.0060 430 THR B CA 5266 C C . THR B 344 ? 1.3623 1.0561 1.2446 0.0904 0.0799 0.0000 430 THR B C 5267 O O . THR B 344 ? 1.4381 1.1278 1.3192 0.1002 0.0873 0.0018 430 THR B O 5268 C CB . THR B 344 ? 1.2809 1.0129 1.1748 0.0800 0.0615 -0.0023 430 THR B CB 5269 O OG1 . THR B 344 ? 1.5305 1.2612 1.4258 0.0758 0.0575 0.0001 430 THR B OG1 5270 C CG2 . THR B 344 ? 1.1935 0.9411 1.0949 0.0929 0.0628 0.0043 430 THR B CG2 5271 N N . LYS B 345 ? 1.3778 1.0647 1.2600 0.0887 0.0795 0.0032 431 LYS B N 5272 C CA . LYS B 345 ? 1.4119 1.0856 1.2924 0.0986 0.0878 0.0097 431 LYS B CA 5273 C C . LYS B 345 ? 1.2079 0.8974 1.0958 0.1138 0.0894 0.0177 431 LYS B C 5274 O O . LYS B 345 ? 1.1365 0.8148 1.0216 0.1246 0.0987 0.0218 431 LYS B O 5275 C CB . LYS B 345 ? 1.3981 1.0661 1.2787 0.0939 0.0857 0.0124 431 LYS B CB 5276 C CG . LYS B 345 ? 1.6529 1.3021 1.5253 0.0799 0.0866 0.0052 431 LYS B CG 5277 C CD . LYS B 345 ? 1.8430 1.4910 1.7172 0.0745 0.0833 0.0080 431 LYS B CD 5278 C CE . LYS B 345 ? 1.8707 1.5042 1.7380 0.0594 0.0831 0.0004 431 LYS B CE 5279 N NZ . LYS B 345 ? 1.7254 1.3581 1.5948 0.0538 0.0803 0.0031 431 LYS B NZ 5280 N N . ALA B 346 ? 1.0737 0.7892 0.9707 0.1145 0.0805 0.0197 432 ALA B N 5281 C CA . ALA B 346 ? 1.0161 0.7510 0.9209 0.1274 0.0807 0.0266 432 ALA B CA 5282 C C . ALA B 346 ? 1.2531 0.9944 1.1586 0.1314 0.0835 0.0237 432 ALA B C 5283 O O . ALA B 346 ? 1.2623 1.0219 1.1747 0.1415 0.0836 0.0286 432 ALA B O 5284 C CB . ALA B 346 ? 1.0277 0.7876 0.9415 0.1256 0.0704 0.0294 432 ALA B CB 5285 N N . GLY B 347 ? 1.3170 1.0445 1.2154 0.1231 0.0856 0.0158 433 GLY B N 5286 C CA . GLY B 347 ? 1.3032 1.0324 1.2004 0.1267 0.0899 0.0127 433 GLY B CA 5287 C C . GLY B 347 ? 1.4293 1.1835 1.3337 0.1243 0.0826 0.0107 433 GLY B C 5288 O O . GLY B 347 ? 1.4068 1.1716 1.3148 0.1324 0.0859 0.0122 433 GLY B O 5289 N N . LEU B 348 ? 1.4339 1.1977 1.3405 0.1133 0.0732 0.0074 438 LEU B N 5290 C CA . LEU B 348 ? 1.3135 1.0956 1.2243 0.1084 0.0671 0.0037 438 LEU B CA 5291 C C . LEU B 348 ? 1.2596 1.0281 1.1618 0.0984 0.0681 -0.0046 438 LEU B C 5292 O O . LEU B 348 ? 1.2457 0.9954 1.1402 0.0914 0.0692 -0.0080 438 LEU B O 5293 C CB . LEU B 348 ? 1.2778 1.0767 1.1947 0.1022 0.0570 0.0047 438 LEU B CB 5294 C CG . LEU B 348 ? 1.1897 1.0042 1.1147 0.1100 0.0545 0.0123 438 LEU B CG 5295 C CD1 . LEU B 348 ? 1.0378 0.8589 0.9650 0.1018 0.0459 0.0121 438 LEU B CD1 5296 C CD2 . LEU B 348 ? 1.0958 0.9335 1.0288 0.1171 0.0539 0.0148 438 LEU B CD2 5297 N N . SER B 349 ? 1.2255 1.0039 1.1287 0.0974 0.0676 -0.0079 439 SER B N 5298 C CA . SER B 349 ? 1.1346 0.9022 1.0295 0.0880 0.0680 -0.0156 439 SER B CA 5299 C C . SER B 349 ? 1.0430 0.8156 0.9377 0.0760 0.0587 -0.0186 439 SER B C 5300 O O . SER B 349 ? 0.9827 0.7736 0.8850 0.0751 0.0518 -0.0161 439 SER B O 5301 C CB . SER B 349 ? 1.1071 0.8846 1.0032 0.0906 0.0704 -0.0178 439 SER B CB 5302 O OG . SER B 349 ? 1.3907 1.1754 1.2924 0.1036 0.0763 -0.0124 439 SER B OG 5303 N N . SER B 350 ? 1.0390 0.7953 0.9248 0.0670 0.0587 -0.0238 440 SER B N 5304 C CA . SER B 350 ? 1.1366 0.8972 1.0215 0.0560 0.0504 -0.0267 440 SER B CA 5305 C C . SER B 350 ? 1.0434 0.7904 0.9177 0.0473 0.0520 -0.0339 440 SER B C 5306 O O . SER B 350 ? 1.0726 0.8106 0.9413 0.0498 0.0588 -0.0369 440 SER B O 5307 C CB . SER B 350 ? 1.1262 0.8842 1.0134 0.0536 0.0466 -0.0236 440 SER B CB 5308 O OG . SER B 350 ? 1.1214 0.8846 1.0082 0.0437 0.0388 -0.0259 440 SER B OG 5309 N N . ASN B 351 ? 0.9254 0.6720 0.7969 0.0373 0.0457 -0.0366 441 ASN B N 5310 C CA . ASN B 351 ? 0.9074 0.6419 0.7684 0.0282 0.0465 -0.0433 441 ASN B CA 5311 C C . ASN B 351 ? 0.9389 0.6653 0.7972 0.0206 0.0435 -0.0442 441 ASN B C 5312 O O . ASN B 351 ? 1.0007 0.7334 0.8658 0.0219 0.0396 -0.0396 441 ASN B O 5313 C CB . ASN B 351 ? 0.9265 0.6726 0.7864 0.0223 0.0408 -0.0460 441 ASN B CB 5314 C CG . ASN B 351 ? 0.9501 0.7087 0.8149 0.0289 0.0422 -0.0444 441 ASN B CG 5315 O OD1 . ASN B 351 ? 0.9318 0.6849 0.7932 0.0333 0.0491 -0.0463 441 ASN B OD1 5316 N ND2 . ASN B 351 ? 0.9363 0.7118 0.8088 0.0292 0.0361 -0.0411 441 ASN B ND2 5317 N N . ASP B 352 ? 0.8948 0.6074 0.7430 0.0127 0.0456 -0.0502 442 ASP B N 5318 C CA . ASP B 352 ? 1.1280 0.8414 0.9736 0.0020 0.0393 -0.0525 442 ASP B CA 5319 C C . ASP B 352 ? 0.9937 0.6993 0.8281 -0.0079 0.0395 -0.0599 442 ASP B C 5320 O O . ASP B 352 ? 1.0287 0.7327 0.8577 -0.0071 0.0424 -0.0633 442 ASP B O 5321 C CB . ASP B 352 ? 1.2576 0.9671 1.1070 0.0007 0.0382 -0.0493 442 ASP B CB 5322 C CG . ASP B 352 ? 1.1941 0.8828 1.0368 0.0003 0.0464 -0.0516 442 ASP B CG 5323 O OD1 . ASP B 352 ? 1.3809 1.0586 1.2189 0.0057 0.0543 -0.0533 442 ASP B OD1 5324 O OD2 . ASP B 352 ? 1.0369 0.7202 0.8792 -0.0053 0.0452 -0.0516 442 ASP B OD2 5325 N N . LEU B 353 ? 1.0264 0.7284 0.8574 -0.0172 0.0362 -0.0623 443 LEU B N 5326 C CA . LEU B 353 ? 0.9944 0.6982 0.8175 -0.0276 0.0322 -0.0678 443 LEU B CA 5327 C C . LEU B 353 ? 1.0952 0.7828 0.9082 -0.0367 0.0360 -0.0741 443 LEU B C 5328 O O . LEU B 353 ? 1.1177 0.7979 0.9323 -0.0385 0.0375 -0.0731 443 LEU B O 5329 C CB . LEU B 353 ? 0.8311 0.5521 0.6606 -0.0315 0.0223 -0.0645 443 LEU B CB 5330 C CG . LEU B 353 ? 0.8413 0.5776 0.6714 -0.0329 0.0159 -0.0638 443 LEU B CG 5331 C CD1 . LEU B 353 ? 0.7077 0.4504 0.5352 -0.0426 0.0091 -0.0653 443 LEU B CD1 5332 C CD2 . LEU B 353 ? 0.8709 0.6042 0.6936 -0.0318 0.0195 -0.0677 443 LEU B CD2 5333 N N . ILE B 354 ? 1.0236 0.7058 0.8257 -0.0430 0.0375 -0.0808 444 ILE B N 5334 C CA . ILE B 354 ? 0.9310 0.6017 0.7226 -0.0545 0.0390 -0.0878 444 ILE B CA 5335 C C . ILE B 354 ? 0.9093 0.5936 0.6966 -0.0630 0.0312 -0.0907 444 ILE B C 5336 O O . ILE B 354 ? 0.9521 0.6443 0.7384 -0.0597 0.0296 -0.0903 444 ILE B O 5337 C CB . ILE B 354 ? 1.1293 0.7779 0.9096 -0.0542 0.0499 -0.0940 444 ILE B CB 5338 C CG1 . ILE B 354 ? 1.4126 1.0505 1.1983 -0.0426 0.0577 -0.0893 444 ILE B CG1 5339 C CG2 . ILE B 354 ? 0.8242 0.4585 0.5933 -0.0670 0.0525 -0.1016 444 ILE B CG2 5340 C CD1 . ILE B 354 ? 1.5901 1.2156 1.3698 -0.0351 0.0671 -0.0915 444 ILE B CD1 5341 N N . THR B 355 ? 0.8464 0.5347 0.6317 -0.0735 0.0262 -0.0929 445 THR B N 5342 C CA . THR B 355 ? 0.8671 0.5686 0.6475 -0.0815 0.0189 -0.0955 445 THR B CA 5343 C C . THR B 355 ? 1.0285 0.7198 0.7957 -0.0939 0.0212 -0.1044 445 THR B C 5344 O O . THR B 355 ? 1.1027 0.7820 0.8679 -0.0992 0.0250 -0.1073 445 THR B O 5345 C CB . THR B 355 ? 0.8029 0.5243 0.5930 -0.0831 0.0090 -0.0897 445 THR B CB 5346 O OG1 . THR B 355 ? 0.9855 0.7034 0.7797 -0.0873 0.0091 -0.0891 445 THR B OG1 5347 C CG2 . THR B 355 ? 0.8251 0.5578 0.6263 -0.0719 0.0062 -0.0818 445 THR B CG2 5348 N N . PHE B 356 ? 0.9563 0.6519 0.7140 -0.0988 0.0192 -0.1089 446 PHE B N 5349 C CA . PHE B 356 ? 0.9395 0.6282 0.6837 -0.1116 0.0203 -0.1177 446 PHE B CA 5350 C C . PHE B 356 ? 1.0592 0.7689 0.8019 -0.1191 0.0101 -0.1175 446 PHE B C 5351 O O . PHE B 356 ? 1.0053 0.7288 0.7509 -0.1137 0.0052 -0.1130 446 PHE B O 5352 C CB . PHE B 356 ? 0.9045 0.5777 0.6359 -0.1109 0.0284 -0.1243 446 PHE B CB 5353 C CG . PHE B 356 ? 0.9220 0.5718 0.6512 -0.1062 0.0397 -0.1265 446 PHE B CG 5354 C CD1 . PHE B 356 ? 0.9812 0.6133 0.7014 -0.1155 0.0455 -0.1336 446 PHE B CD1 5355 C CD2 . PHE B 356 ? 0.8398 0.4851 0.5754 -0.0927 0.0448 -0.1215 446 PHE B CD2 5356 C CE1 . PHE B 356 ? 0.9810 0.5898 0.6984 -0.1105 0.0567 -0.1352 446 PHE B CE1 5357 C CE2 . PHE B 356 ? 0.9673 0.5914 0.7007 -0.0874 0.0555 -0.1229 446 PHE B CE2 5358 C CZ . PHE B 356 ? 0.9749 0.5800 0.6990 -0.0960 0.0617 -0.1295 446 PHE B CZ 5359 N N . CYS B 357 ? 0.9291 0.6417 0.6675 -0.1314 0.0070 -0.1220 447 CYS B N 5360 C CA . CYS B 357 ? 0.8742 0.6067 0.6092 -0.1395 -0.0022 -0.1227 447 CYS B CA 5361 C C . CYS B 357 ? 0.9387 0.6645 0.6571 -0.1520 -0.0001 -0.1329 447 CYS B C 5362 O O . CYS B 357 ? 1.0187 0.7257 0.7298 -0.1584 0.0072 -0.1401 447 CYS B O 5363 C CB . CYS B 357 ? 0.8918 0.6403 0.6372 -0.1435 -0.0096 -0.1181 447 CYS B CB 5364 S SG . CYS B 357 ? 1.3347 1.0963 1.0986 -0.1295 -0.0142 -0.1056 447 CYS B SG 5365 N N . GLY B 358 ? 0.9669 0.7078 0.6789 -0.1555 -0.0063 -0.1337 448 GLY B N 5366 C CA . GLY B 358 ? 0.9267 0.6642 0.6224 -0.1677 -0.0053 -0.1434 448 GLY B CA 5367 C C . GLY B 358 ? 1.0685 0.8105 0.7612 -0.1825 -0.0083 -0.1488 448 GLY B C 5368 O O . GLY B 358 ? 1.0333 0.7932 0.7362 -0.1843 -0.0158 -0.1437 448 GLY B O 5369 N N . THR B 359 ? 1.1564 0.8817 0.8350 -0.1932 -0.0019 -0.1595 449 THR B N 5370 C CA . THR B 359 ? 1.0924 0.8234 0.7652 -0.2096 -0.0049 -0.1663 449 THR B CA 5371 C C . THR B 359 ? 1.0692 0.8024 0.7244 -0.2200 -0.0058 -0.1752 449 THR B C 5372 O O . THR B 359 ? 1.0833 0.8041 0.7287 -0.2156 -0.0003 -0.1782 449 THR B O 5373 C CB . THR B 359 ? 1.1047 0.8131 0.7765 -0.2159 0.0037 -0.1719 449 THR B CB 5374 O OG1 . THR B 359 ? 1.3347 1.0464 0.9969 -0.2339 0.0020 -0.1809 449 THR B OG1 5375 C CG2 . THR B 359 ? 1.0637 0.7419 0.7267 -0.2104 0.0163 -0.1766 449 THR B CG2 5376 N N . GLY B 360 ? 1.0084 0.7587 0.6597 -0.2339 -0.0128 -0.1791 450 GLY B N 5377 C CA . GLY B 360 ? 0.9828 0.7398 0.6175 -0.2446 -0.0152 -0.1871 450 GLY B CA 5378 C C . GLY B 360 ? 1.0389 0.7687 0.6562 -0.2544 -0.0046 -0.2000 450 GLY B C 5379 O O . GLY B 360 ? 1.0413 0.7681 0.6432 -0.2586 -0.0030 -0.2065 450 GLY B O 5380 N N . GLY B 361 ? 1.0481 0.7571 0.6672 -0.2579 0.0033 -0.2037 451 GLY B N 5381 C CA . GLY B 361 ? 1.0589 0.7398 0.6614 -0.2676 0.0144 -0.2160 451 GLY B CA 5382 C C . GLY B 361 ? 1.1238 0.7778 0.7215 -0.2554 0.0257 -0.2165 451 GLY B C 5383 O O . GLY B 361 ? 1.1644 0.8186 0.7744 -0.2391 0.0262 -0.2068 451 GLY B O 5384 N N . SER B 362 ? 1.2720 0.9030 0.8515 -0.2633 0.0352 -0.2280 452 SER B N 5385 C CA . SER B 362 ? 1.2554 0.8571 0.8299 -0.2527 0.0481 -0.2294 452 SER B CA 5386 C C . SER B 362 ? 1.2841 0.8644 0.8667 -0.2487 0.0566 -0.2274 452 SER B C 5387 O O . SER B 362 ? 1.2313 0.8129 0.8172 -0.2590 0.0549 -0.2293 452 SER B O 5388 C CB . SER B 362 ? 1.0977 0.6802 0.6494 -0.2625 0.0564 -0.2425 452 SER B CB 5389 O OG . SER B 362 ? 1.2664 0.8203 0.8137 -0.2515 0.0697 -0.2435 452 SER B OG 5390 N N . MET B 363 ? 1.1715 0.7331 0.7576 -0.2335 0.0656 -0.2232 453 MET B N 5391 C CA . MET B 363 ? 1.0643 0.6075 0.6593 -0.2271 0.0732 -0.2193 453 MET B CA 5392 C C . MET B 363 ? 1.2320 0.7398 0.8154 -0.2228 0.0892 -0.2251 453 MET B C 5393 O O . MET B 363 ? 1.3068 0.8068 0.8802 -0.2183 0.0941 -0.2285 453 MET B O 5394 C CB . MET B 363 ? 1.0077 0.5663 0.6232 -0.2101 0.0677 -0.2054 453 MET B CB 5395 C CG . MET B 363 ? 1.1661 0.7578 0.7942 -0.2129 0.0529 -0.1986 453 MET B CG 5396 S SD . MET B 363 ? 1.2398 0.8345 0.8748 -0.2252 0.0500 -0.1992 453 MET B SD 5397 C CE . MET B 363 ? 0.9649 0.5373 0.6107 -0.2097 0.0601 -0.1919 453 MET B CE 5398 N N . PRO B 364 ? 1.3288 0.8147 0.9130 -0.2241 0.0978 -0.2262 454 PRO B N 5399 C CA . PRO B 364 ? 1.2921 0.7430 0.8671 -0.2177 0.1140 -0.2298 454 PRO B CA 5400 C C . PRO B 364 ? 1.3283 0.7784 0.9151 -0.1959 0.1170 -0.2191 454 PRO B C 5401 O O . PRO B 364 ? 1.2543 0.7277 0.8583 -0.1872 0.1074 -0.2086 454 PRO B O 5402 C CB . PRO B 364 ? 1.2119 0.6459 0.7886 -0.2243 0.1196 -0.2309 454 PRO B CB 5403 C CG . PRO B 364 ? 1.2981 0.7614 0.8932 -0.2246 0.1062 -0.2220 454 PRO B CG 5404 C CD . PRO B 364 ? 1.2838 0.7771 0.8780 -0.2315 0.0931 -0.2234 454 PRO B CD 5405 N N . ASP B 365 ? 1.2416 0.6660 0.8196 -0.1874 0.1303 -0.2218 455 ASP B N 5406 C CA . ASP B 365 ? 1.3477 0.7715 0.9364 -0.1667 0.1341 -0.2120 455 ASP B CA 5407 C C . ASP B 365 ? 1.4556 0.8707 1.0575 -0.1561 0.1384 -0.2032 455 ASP B C 5408 O O . ASP B 365 ? 1.6634 1.0499 1.2591 -0.1512 0.1519 -0.2047 455 ASP B O 5409 C CB . ASP B 365 ? 1.4335 0.8345 1.0079 -0.1609 0.1470 -0.2178 455 ASP B CB 5410 C CG . ASP B 365 ? 1.7032 1.1135 1.2647 -0.1696 0.1430 -0.2258 455 ASP B CG 5411 O OD1 . ASP B 365 ? 1.7614 1.2012 1.3307 -0.1705 0.1299 -0.2216 455 ASP B OD1 5412 O OD2 . ASP B 365 ? 1.9175 1.3054 1.4607 -0.1754 0.1533 -0.2360 455 ASP B OD2 5413 N N . VAL B 366 ? 1.2305 0.6698 0.8500 -0.1520 0.1272 -0.1936 456 VAL B N 5414 C CA . VAL B 366 ? 1.1503 0.5847 0.7831 -0.1416 0.1300 -0.1844 456 VAL B CA 5415 C C . VAL B 366 ? 1.2070 0.6555 0.8551 -0.1222 0.1275 -0.1728 456 VAL B C 5416 O O . VAL B 366 ? 1.2411 0.7128 0.8949 -0.1191 0.1184 -0.1698 456 VAL B O 5417 C CB . VAL B 366 ? 1.2213 0.6669 0.8618 -0.1524 0.1219 -0.1827 456 VAL B CB 5418 C CG1 . VAL B 366 ? 1.0950 0.5627 0.7323 -0.1676 0.1100 -0.1880 456 VAL B CG1 5419 C CG2 . VAL B 366 ? 1.0260 0.4870 0.6863 -0.1399 0.1162 -0.1699 456 VAL B CG2 5420 N N . ASN B 367 ? 1.2246 0.6585 0.8784 -0.1094 0.1361 -0.1665 457 ASN B N 5421 C CA . ASN B 367 ? 1.0156 0.4631 0.6843 -0.0915 0.1341 -0.1555 457 ASN B CA 5422 C C . ASN B 367 ? 1.1159 0.5832 0.8014 -0.0893 0.1241 -0.1464 457 ASN B C 5423 O O . ASN B 367 ? 1.1386 0.5950 0.8272 -0.0891 0.1278 -0.1436 457 ASN B O 5424 C CB . ASN B 367 ? 1.1381 0.5618 0.8045 -0.0777 0.1484 -0.1528 457 ASN B CB 5425 C CG . ASN B 367 ? 1.2915 0.7307 0.9731 -0.0594 0.1465 -0.1416 457 ASN B CG 5426 O OD1 . ASN B 367 ? 1.3280 0.7916 1.0174 -0.0567 0.1371 -0.1385 457 ASN B OD1 5427 N ND2 . ASN B 367 ? 1.4502 0.8754 1.1359 -0.0469 0.1555 -0.1354 457 ASN B ND2 5428 N N . TRP B 368 ? 1.0825 0.5782 0.7783 -0.0874 0.1120 -0.1417 458 TRP B N 5429 C CA . TRP B 368 ? 1.0431 0.5589 0.7538 -0.0868 0.1018 -0.1339 458 TRP B CA 5430 C C . TRP B 368 ? 1.0616 0.5848 0.7868 -0.0699 0.1022 -0.1230 458 TRP B C 5431 O O . TRP B 368 ? 0.9211 0.4583 0.6584 -0.0681 0.0952 -0.1162 458 TRP B O 5432 C CB . TRP B 368 ? 0.9604 0.5029 0.6745 -0.0943 0.0885 -0.1344 458 TRP B CB 5433 C CG . TRP B 368 ? 1.1834 0.7242 0.8854 -0.1118 0.0858 -0.1441 458 TRP B CG 5434 C CD1 . TRP B 368 ? 1.2686 0.8119 0.9592 -0.1189 0.0845 -0.1513 458 TRP B CD1 5435 C CD2 . TRP B 368 ? 1.1461 0.6837 0.8462 -0.1249 0.0841 -0.1475 458 TRP B CD2 5436 N NE1 . TRP B 368 ? 1.1007 0.6436 0.7824 -0.1355 0.0815 -0.1590 458 TRP B NE1 5437 C CE2 . TRP B 368 ? 1.0681 0.6078 0.7557 -0.1397 0.0812 -0.1570 458 TRP B CE2 5438 C CE3 . TRP B 368 ? 1.2239 0.7578 0.9315 -0.1257 0.0846 -0.1434 458 TRP B CE3 5439 C CZ2 . TRP B 368 ? 1.1211 0.6605 0.8042 -0.1555 0.0787 -0.1626 458 TRP B CZ2 5440 C CZ3 . TRP B 368 ? 1.1969 0.7298 0.9002 -0.1413 0.0825 -0.1489 458 TRP B CZ3 5441 C CH2 . TRP B 368 ? 1.1881 0.7241 0.8794 -0.1562 0.0795 -0.1585 458 TRP B CH2 5442 N N . GLY B 369 ? 1.1706 0.6849 0.8943 -0.0578 0.1104 -0.1214 459 GLY B N 5443 C CA . GLY B 369 ? 1.0851 0.6069 0.8217 -0.0415 0.1114 -0.1114 459 GLY B CA 5444 C C . GLY B 369 ? 1.1609 0.6800 0.8957 -0.0298 0.1181 -0.1107 459 GLY B C 5445 O O . GLY B 369 ? 1.1560 0.6577 0.8780 -0.0318 0.1266 -0.1177 459 GLY B O 5446 O OXT . GLY B 369 ? 1.2303 0.7650 0.9766 -0.0179 0.1156 -0.1033 459 GLY B OXT 5447 N N . ALA C 6 ? 1.3733 1.5442 1.4185 -0.0347 -0.0845 0.0717 82 ALA C N 5448 C CA . ALA C 6 ? 1.3844 1.5712 1.4356 -0.0484 -0.0869 0.0684 82 ALA C CA 5449 C C . ALA C 6 ? 1.2950 1.5032 1.3592 -0.0458 -0.0859 0.0748 82 ALA C C 5450 O O . ALA C 6 ? 1.3337 1.5694 1.4048 -0.0512 -0.0902 0.0767 82 ALA C O 5451 C CB . ALA C 6 ? 1.2046 1.4092 1.2529 -0.0557 -0.0936 0.0663 82 ALA C CB 5452 N N . THR C 7 ? 1.1512 1.3492 1.2185 -0.0379 -0.0805 0.0781 83 THR C N 5453 C CA . THR C 7 ? 1.1595 1.3770 1.2385 -0.0332 -0.0789 0.0850 83 THR C CA 5454 C C . THR C 7 ? 1.0698 1.2752 1.1523 -0.0345 -0.0731 0.0842 83 THR C C 5455 O O . THR C 7 ? 1.0250 1.2044 1.1000 -0.0329 -0.0695 0.0807 83 THR C O 5456 C CB . THR C 7 ? 1.0887 1.3130 1.1686 -0.0172 -0.0785 0.0933 83 THR C CB 5457 O OG1 . THR C 7 ? 1.0720 1.3268 1.1589 -0.0167 -0.0832 0.0984 83 THR C OG1 5458 C CG2 . THR C 7 ? 0.9723 1.1911 1.0569 -0.0074 -0.0723 0.0982 83 THR C CG2 5459 N N . PRO C 8 ? 0.9953 1.2202 1.0891 -0.0375 -0.0721 0.0875 84 PRO C N 5460 C CA . PRO C 8 ? 1.0079 1.2228 1.1053 -0.0388 -0.0664 0.0873 84 PRO C CA 5461 C C . PRO C 8 ? 1.0114 1.2081 1.1048 -0.0254 -0.0613 0.0906 84 PRO C C 5462 O O . PRO C 8 ? 0.9554 1.1581 1.0496 -0.0134 -0.0612 0.0964 84 PRO C O 5463 C CB . PRO C 8 ? 0.8429 1.0871 0.9539 -0.0414 -0.0667 0.0922 84 PRO C CB 5464 C CG . PRO C 8 ? 0.8167 1.0839 0.9303 -0.0483 -0.0732 0.0915 84 PRO C CG 5465 C CD . PRO C 8 ? 0.8761 1.1345 0.9802 -0.0403 -0.0763 0.0917 84 PRO C CD 5466 N N . LEU C 9 ? 1.0242 1.1982 1.1126 -0.0277 -0.0572 0.0868 85 LEU C N 5467 C CA . LEU C 9 ? 0.9380 1.0958 1.0229 -0.0167 -0.0522 0.0893 85 LEU C CA 5468 C C . LEU C 9 ? 1.0223 1.1953 1.1168 -0.0102 -0.0488 0.0961 85 LEU C C 5469 O O . LEU C 9 ? 0.9764 1.1617 1.0793 -0.0170 -0.0475 0.0969 85 LEU C O 5470 C CB . LEU C 9 ? 0.9092 1.0424 0.9876 -0.0212 -0.0486 0.0842 85 LEU C CB 5471 C CG . LEU C 9 ? 0.8337 0.9478 0.9062 -0.0109 -0.0440 0.0854 85 LEU C CG 5472 C CD1 . LEU C 9 ? 0.7543 0.8442 0.8163 -0.0134 -0.0437 0.0795 85 LEU C CD1 5473 C CD2 . LEU C 9 ? 0.6827 0.7980 0.7606 -0.0093 -0.0388 0.0886 85 LEU C CD2 5474 N N . VAL C 10 ? 1.0465 1.2180 1.1395 0.0029 -0.0469 0.1009 86 VAL C N 5475 C CA . VAL C 10 ? 1.0623 1.2463 1.1632 0.0109 -0.0429 0.1075 86 VAL C CA 5476 C C . VAL C 10 ? 0.9847 1.1489 1.0788 0.0219 -0.0375 0.1088 86 VAL C C 5477 O O . VAL C 10 ? 0.8123 0.9638 0.8980 0.0289 -0.0377 0.1082 86 VAL C O 5478 C CB . VAL C 10 ? 0.9375 1.1481 1.0462 0.0163 -0.0458 0.1138 86 VAL C CB 5479 C CG1 . VAL C 10 ? 1.0422 1.2481 1.1432 0.0216 -0.0494 0.1137 86 VAL C CG1 5480 C CG2 . VAL C 10 ? 0.8913 1.1112 1.0064 0.0275 -0.0407 0.1211 86 VAL C CG2 5481 N N . LEU C 11 ? 0.9343 1.0960 1.0315 0.0226 -0.0325 0.1101 87 LEU C N 5482 C CA . LEU C 11 ? 0.9595 1.1028 1.0500 0.0312 -0.0272 0.1105 87 LEU C CA 5483 C C . LEU C 11 ? 1.0020 1.1552 1.0962 0.0434 -0.0235 0.1172 87 LEU C C 5484 O O . LEU C 11 ? 1.0780 1.2543 1.1826 0.0445 -0.0240 0.1223 87 LEU C O 5485 C CB . LEU C 11 ? 0.9185 1.0538 1.0097 0.0259 -0.0233 0.1088 87 LEU C CB 5486 C CG . LEU C 11 ? 0.8825 1.0071 0.9706 0.0140 -0.0252 0.1028 87 LEU C CG 5487 C CD1 . LEU C 11 ? 0.7446 0.8657 0.8352 0.0099 -0.0206 0.1031 87 LEU C CD1 5488 C CD2 . LEU C 11 ? 0.9330 1.0349 1.0091 0.0152 -0.0264 0.0978 87 LEU C CD2 5489 N N . GLY C 12 ? 0.9087 1.0444 0.9943 0.0525 -0.0196 0.1172 88 GLY C N 5490 C CA . GLY C 12 ? 0.9048 1.0450 0.9919 0.0645 -0.0146 0.1230 88 GLY C CA 5491 C C . GLY C 12 ? 0.8676 1.0194 0.9633 0.0647 -0.0102 0.1266 88 GLY C C 5492 O O . GLY C 12 ? 0.8428 0.9876 0.9381 0.0583 -0.0086 0.1237 88 GLY C O 5493 N N . GLU C 13 ? 0.9737 1.1438 1.0774 0.0724 -0.0079 0.1332 89 GLU C N 5494 C CA . GLU C 13 ? 0.9067 1.0889 1.0189 0.0738 -0.0032 0.1372 89 GLU C CA 5495 C C . GLU C 13 ? 0.8874 1.0507 0.9914 0.0815 0.0039 0.1368 89 GLU C C 5496 O O . GLU C 13 ? 0.9757 1.1399 1.0825 0.0802 0.0082 0.1376 89 GLU C O 5497 C CB . GLU C 13 ? 0.8200 1.0295 0.9438 0.0801 -0.0029 0.1448 89 GLU C CB 5498 C CG . GLU C 13 ? 0.8939 1.1261 1.0271 0.0709 -0.0099 0.1451 89 GLU C CG 5499 C CD . GLU C 13 ? 1.0312 1.2710 1.1713 0.0575 -0.0111 0.1423 89 GLU C CD 5500 O OE1 . GLU C 13 ? 1.0319 1.2703 1.1746 0.0579 -0.0056 0.1434 89 GLU C OE1 5501 O OE2 . GLU C 13 ? 1.0362 1.2827 1.1783 0.0464 -0.0171 0.1387 89 GLU C OE2 5502 N N . ASN C 14 ? 0.7937 0.9396 0.8869 0.0890 0.0053 0.1354 90 ASN C N 5503 C CA . ASN C 14 ? 0.9194 1.0469 1.0036 0.0959 0.0121 0.1344 90 ASN C CA 5504 C C . ASN C 14 ? 0.8732 0.9753 0.9443 0.0921 0.0112 0.1273 90 ASN C C 5505 O O . ASN C 14 ? 0.8842 0.9766 0.9488 0.0916 0.0077 0.1243 90 ASN C O 5506 C CB . ASN C 14 ? 1.0826 1.2109 1.1651 0.1093 0.0172 0.1395 90 ASN C CB 5507 C CG . ASN C 14 ? 1.2227 1.3691 1.3153 0.1152 0.0224 0.1460 90 ASN C CG 5508 O OD1 . ASN C 14 ? 1.2222 1.3722 1.3188 0.1109 0.0246 0.1457 90 ASN C OD1 5509 N ND2 . ASN C 14 ? 1.1627 1.3206 1.2593 0.1255 0.0247 0.1523 90 ASN C ND2 5510 N N . LEU C 15 ? 0.7672 0.8599 0.8349 0.0896 0.0145 0.1249 91 LEU C N 5511 C CA . LEU C 15 ? 0.8826 0.9533 0.9384 0.0864 0.0141 0.1186 91 LEU C CA 5512 C C . LEU C 15 ? 0.9234 0.9779 0.9681 0.0948 0.0180 0.1172 91 LEU C C 5513 O O . LEU C 15 ? 0.9289 0.9852 0.9734 0.1035 0.0239 0.1208 91 LEU C O 5514 C CB . LEU C 15 ? 0.8250 0.8917 0.8802 0.0823 0.0170 0.1174 91 LEU C CB 5515 C CG . LEU C 15 ? 0.9211 0.9879 0.9787 0.0713 0.0125 0.1145 91 LEU C CG 5516 C CD1 . LEU C 15 ? 1.2272 1.3082 1.2935 0.0655 0.0067 0.1153 91 LEU C CD1 5517 C CD2 . LEU C 15 ? 0.7198 0.7914 0.7817 0.0685 0.0162 0.1165 91 LEU C CD2 5518 N N . CYS C 16 ? 0.8609 0.8996 0.8962 0.0920 0.0153 0.1118 92 CYS C N 5519 C CA . CYS C 16 ? 0.8510 0.8720 0.8743 0.0978 0.0191 0.1090 92 CYS C CA 5520 C C . CYS C 16 ? 1.0792 1.0923 1.0971 0.1001 0.0251 0.1080 92 CYS C C 5521 O O . CYS C 16 ? 1.1046 1.1217 1.1257 0.0955 0.0249 0.1079 92 CYS C O 5522 C CB . CYS C 16 ? 0.6813 0.6882 0.6963 0.0925 0.0148 0.1029 92 CYS C CB 5523 S SG . CYS C 16 ? 1.3132 1.3273 1.3325 0.0886 0.0075 0.1031 92 CYS C SG 5524 N N . SER C 17 ? 1.1087 1.1100 1.1177 0.1071 0.0307 0.1071 93 SER C N 5525 C CA . SER C 17 ? 1.1944 1.1869 1.1964 0.1086 0.0362 0.1051 93 SER C CA 5526 C C . SER C 17 ? 1.1361 1.1163 1.1296 0.1017 0.0331 0.0987 93 SER C C 5527 O O . SER C 17 ? 1.1316 1.1037 1.1204 0.0987 0.0293 0.0949 93 SER C O 5528 C CB . SER C 17 ? 1.2500 1.2322 1.2437 0.1175 0.0437 0.1054 93 SER C CB 5529 O OG . SER C 17 ? 1.3406 1.3313 1.3389 0.1233 0.0497 0.1101 93 SER C OG 5530 N N . ILE C 18 ? 1.0805 1.0602 1.0725 0.0993 0.0347 0.0979 94 ILE C N 5531 C CA . ILE C 18 ? 0.9566 0.9263 0.9409 0.0936 0.0321 0.0926 94 ILE C CA 5532 C C . ILE C 18 ? 0.8800 0.8411 0.8545 0.0961 0.0376 0.0904 94 ILE C C 5533 O O . ILE C 18 ? 0.9166 0.8834 0.8935 0.0988 0.0420 0.0936 94 ILE C O 5534 C CB . ILE C 18 ? 0.9328 0.9103 0.9242 0.0866 0.0273 0.0936 94 ILE C CB 5535 C CG1 . ILE C 18 ? 0.9067 0.8911 0.9060 0.0830 0.0215 0.0944 94 ILE C CG1 5536 C CG2 . ILE C 18 ? 0.8502 0.8179 0.8334 0.0822 0.0254 0.0890 94 ILE C CG2 5537 C CD1 . ILE C 18 ? 0.8601 0.8558 0.8693 0.0773 0.0187 0.0971 94 ILE C CD1 5538 N N . ASN C 19 ? 0.8463 0.7942 0.8093 0.0949 0.0375 0.0847 95 ASN C N 5539 C CA . ASN C 19 ? 0.7890 0.7290 0.7415 0.0959 0.0420 0.0815 95 ASN C CA 5540 C C . ASN C 19 ? 0.8950 0.8287 0.8402 0.0901 0.0379 0.0763 95 ASN C C 5541 O O . ASN C 19 ? 0.9841 0.9126 0.9201 0.0897 0.0405 0.0733 95 ASN C O 5542 C CB . ASN C 19 ? 0.9085 0.8384 0.8524 0.1016 0.0485 0.0797 95 ASN C CB 5543 C CG . ASN C 19 ? 1.0937 1.0307 1.0443 0.1087 0.0537 0.0855 95 ASN C CG 5544 O OD1 . ASN C 19 ? 1.1499 1.0897 1.1000 0.1118 0.0588 0.0876 95 ASN C OD1 5545 N ND2 . ASN C 19 ? 1.0739 1.0148 1.0312 0.1116 0.0525 0.0887 95 ASN C ND2 5546 N N . GLY C 20 ? 0.9256 0.8608 0.8750 0.0856 0.0316 0.0754 96 GLY C N 5547 C CA . GLY C 20 ? 0.8933 0.8243 0.8373 0.0805 0.0274 0.0711 96 GLY C CA 5548 C C . GLY C 20 ? 0.8606 0.7966 0.8127 0.0762 0.0212 0.0723 96 GLY C C 5549 O O . GLY C 20 ? 0.8015 0.7442 0.7628 0.0764 0.0199 0.0759 96 GLY C O 5550 N N . TRP C 21 ? 0.8918 0.8249 0.8401 0.0722 0.0175 0.0692 97 TRP C N 5551 C CA . TRP C 21 ? 0.7162 0.6521 0.6706 0.0681 0.0121 0.0697 97 TRP C CA 5552 C C . TRP C 21 ? 0.7990 0.7286 0.7471 0.0652 0.0087 0.0645 97 TRP C C 5553 O O . TRP C 21 ? 0.9121 0.8377 0.8517 0.0652 0.0098 0.0612 97 TRP C O 5554 C CB . TRP C 21 ? 0.5875 0.5286 0.5461 0.0663 0.0118 0.0732 97 TRP C CB 5555 C CG . TRP C 21 ? 0.6829 0.6311 0.6477 0.0686 0.0156 0.0782 97 TRP C CG 5556 C CD1 . TRP C 21 ? 0.7008 0.6497 0.6619 0.0721 0.0205 0.0797 97 TRP C CD1 5557 C CD2 . TRP C 21 ? 0.5778 0.5341 0.5534 0.0674 0.0149 0.0822 97 TRP C CD2 5558 N NE1 . TRP C 21 ? 0.7261 0.6832 0.6955 0.0734 0.0232 0.0847 97 TRP C NE1 5559 C CE2 . TRP C 21 ? 0.6643 0.6266 0.6429 0.0704 0.0197 0.0863 97 TRP C CE2 5560 C CE3 . TRP C 21 ? 0.5879 0.5478 0.5708 0.0638 0.0108 0.0826 97 TRP C CE3 5561 C CZ2 . TRP C 21 ? 0.6612 0.6339 0.6505 0.0696 0.0203 0.0908 97 TRP C CZ2 5562 C CZ3 . TRP C 21 ? 0.5914 0.5615 0.5843 0.0628 0.0112 0.0868 97 TRP C CZ3 5563 C CH2 . TRP C 21 ? 0.6639 0.6407 0.6602 0.0656 0.0159 0.0909 97 TRP C CH2 5564 N N . VAL C 22 ? 0.7403 0.6696 0.6924 0.0626 0.0047 0.0636 98 VAL C N 5565 C CA . VAL C 22 ? 0.8271 0.7516 0.7745 0.0597 0.0014 0.0591 98 VAL C CA 5566 C C . VAL C 22 ? 0.6048 0.5320 0.5585 0.0563 -0.0029 0.0602 98 VAL C C 5567 O O . VAL C 22 ? 0.6275 0.5590 0.5888 0.0555 -0.0037 0.0633 98 VAL C O 5568 C CB . VAL C 22 ? 0.8576 0.7765 0.8017 0.0599 0.0014 0.0559 98 VAL C CB 5569 C CG1 . VAL C 22 ? 0.7649 0.6786 0.7017 0.0573 -0.0003 0.0505 98 VAL C CG1 5570 C CG2 . VAL C 22 ? 0.6856 0.6016 0.6262 0.0640 0.0065 0.0564 98 VAL C CG2 5571 N N . PRO C 23 ? 0.5830 0.5083 0.5334 0.0543 -0.0053 0.0578 99 PRO C N 5572 C CA . PRO C 23 ? 0.7119 0.6380 0.6674 0.0513 -0.0086 0.0586 99 PRO C CA 5573 C C . PRO C 23 ? 0.7714 0.6960 0.7297 0.0491 -0.0113 0.0568 99 PRO C C 5574 O O . PRO C 23 ? 0.6733 0.5946 0.6277 0.0495 -0.0115 0.0538 99 PRO C O 5575 C CB . PRO C 23 ? 0.6352 0.5595 0.5856 0.0508 -0.0101 0.0563 99 PRO C CB 5576 C CG . PRO C 23 ? 0.7907 0.7139 0.7332 0.0524 -0.0083 0.0532 99 PRO C CG 5577 C CD . PRO C 23 ? 0.7171 0.6409 0.6597 0.0548 -0.0045 0.0552 99 PRO C CD 5578 N N . THR C 24 ? 0.7767 0.7034 0.7412 0.0465 -0.0132 0.0586 100 THR C N 5579 C CA . THR C 24 ? 0.7201 0.6460 0.6868 0.0440 -0.0161 0.0569 100 THR C CA 5580 C C . THR C 24 ? 0.7431 0.6659 0.7097 0.0409 -0.0186 0.0551 100 THR C C 5581 O O . THR C 24 ? 0.9563 0.8763 0.9211 0.0394 -0.0208 0.0520 100 THR C O 5582 C CB . THR C 24 ? 0.6553 0.5871 0.6292 0.0430 -0.0164 0.0601 100 THR C CB 5583 O OG1 . THR C 24 ? 0.8924 0.8274 0.8709 0.0412 -0.0155 0.0631 100 THR C OG1 5584 C CG2 . THR C 24 ? 0.6964 0.6311 0.6701 0.0471 -0.0137 0.0620 100 THR C CG2 5585 N N . TYR C 25 ? 0.7785 0.7013 0.7465 0.0404 -0.0178 0.0571 101 TYR C N 5586 C CA . TYR C 25 ? 0.7868 0.7055 0.7537 0.0387 -0.0191 0.0558 101 TYR C CA 5587 C C . TYR C 25 ? 0.7812 0.6992 0.7447 0.0415 -0.0173 0.0573 101 TYR C C 5588 O O . TYR C 25 ? 0.7914 0.7118 0.7554 0.0432 -0.0149 0.0605 101 TYR C O 5589 C CB . TYR C 25 ? 0.7624 0.6804 0.7345 0.0347 -0.0196 0.0571 101 TYR C CB 5590 C CG . TYR C 25 ? 0.7308 0.6430 0.7012 0.0336 -0.0199 0.0560 101 TYR C CG 5591 C CD1 . TYR C 25 ? 0.6291 0.5381 0.5973 0.0326 -0.0221 0.0524 101 TYR C CD1 5592 C CD2 . TYR C 25 ? 0.5987 0.5083 0.5696 0.0339 -0.0175 0.0590 101 TYR C CD2 5593 C CE1 . TYR C 25 ? 0.6696 0.5733 0.6363 0.0322 -0.0219 0.0516 101 TYR C CE1 5594 C CE2 . TYR C 25 ? 0.5936 0.4969 0.5626 0.0338 -0.0170 0.0585 101 TYR C CE2 5595 C CZ . TYR C 25 ? 0.7437 0.6443 0.7108 0.0331 -0.0192 0.0547 101 TYR C CZ 5596 O OH . TYR C 25 ? 0.7335 0.6279 0.6987 0.0336 -0.0183 0.0543 101 TYR C OH 5597 N N . ARG C 26 ? 0.6957 0.6112 0.6558 0.0421 -0.0185 0.0552 102 ARG C N 5598 C CA . ARG C 26 ? 0.7016 0.6178 0.6584 0.0452 -0.0171 0.0570 102 ARG C CA 5599 C C . ARG C 26 ? 0.6896 0.6024 0.6458 0.0454 -0.0179 0.0567 102 ARG C C 5600 O O . ARG C 26 ? 0.7923 0.7057 0.7459 0.0459 -0.0197 0.0535 102 ARG C O 5601 C CB . ARG C 26 ? 0.7109 0.6307 0.6621 0.0476 -0.0172 0.0549 102 ARG C CB 5602 C CG . ARG C 26 ? 0.7224 0.6449 0.6698 0.0509 -0.0163 0.0569 102 ARG C CG 5603 C CD . ARG C 26 ? 0.6977 0.6246 0.6394 0.0523 -0.0159 0.0550 102 ARG C CD 5604 N NE . ARG C 26 ? 0.8201 0.7490 0.7584 0.0514 -0.0181 0.0503 102 ARG C NE 5605 C CZ . ARG C 26 ? 0.8093 0.7421 0.7418 0.0515 -0.0180 0.0474 102 ARG C CZ 5606 N NH1 . ARG C 26 ? 0.7845 0.7191 0.7137 0.0530 -0.0157 0.0488 102 ARG C NH1 5607 N NH2 . ARG C 26 ? 0.7332 0.6681 0.6628 0.0498 -0.0198 0.0430 102 ARG C NH2 5608 N N . GLY C 27 ? 0.6945 0.6035 0.6531 0.0451 -0.0161 0.0599 103 GLY C N 5609 C CA . GLY C 27 ? 0.7762 0.6804 0.7340 0.0458 -0.0158 0.0601 103 GLY C CA 5610 C C . GLY C 27 ? 0.6241 0.5317 0.5775 0.0505 -0.0162 0.0603 103 GLY C C 5611 O O . GLY C 27 ? 0.6838 0.5972 0.6344 0.0532 -0.0160 0.0614 103 GLY C O 5612 N N . GLU C 28 ? 0.7598 0.6644 0.7127 0.0514 -0.0166 0.0592 104 GLU C N 5613 C CA . GLU C 28 ? 0.8481 0.7578 0.7979 0.0555 -0.0175 0.0589 104 GLU C CA 5614 C C . GLU C 28 ? 0.9133 0.8258 0.8608 0.0607 -0.0153 0.0641 104 GLU C C 5615 O O . GLU C 28 ? 0.9869 0.9078 0.9312 0.0642 -0.0164 0.0643 104 GLU C O 5616 C CB . GLU C 28 ? 1.0416 0.9467 0.9921 0.0557 -0.0176 0.0572 104 GLU C CB 5617 C CG . GLU C 28 ? 1.2685 1.1802 1.2177 0.0563 -0.0203 0.0533 104 GLU C CG 5618 C CD . GLU C 28 ? 1.2397 1.1560 1.1881 0.0527 -0.0228 0.0490 104 GLU C CD 5619 O OE1 . GLU C 28 ? 1.0292 0.9410 0.9794 0.0486 -0.0232 0.0473 104 GLU C OE1 5620 O OE2 . GLU C 28 ? 1.3046 1.2291 1.2504 0.0539 -0.0241 0.0475 104 GLU C OE2 5621 N N . GLY C 29 ? 0.8427 0.7485 0.7914 0.0609 -0.0121 0.0684 105 GLY C N 5622 C CA . GLY C 29 ? 0.7782 0.6849 0.7243 0.0659 -0.0093 0.0742 105 GLY C CA 5623 C C . GLY C 29 ? 0.8027 0.7170 0.7465 0.0670 -0.0095 0.0755 105 GLY C C 5624 O O . GLY C 29 ? 0.8610 0.7776 0.8018 0.0715 -0.0075 0.0803 105 GLY C O 5625 N N . THR C 30 ? 0.7928 0.7105 0.7374 0.0633 -0.0115 0.0715 106 THR C N 5626 C CA . THR C 30 ? 0.6957 0.6199 0.6374 0.0642 -0.0113 0.0720 106 THR C CA 5627 C C . THR C 30 ? 0.7586 0.6919 0.6953 0.0668 -0.0136 0.0700 106 THR C C 5628 O O . THR C 30 ? 0.7596 0.6991 0.6921 0.0690 -0.0131 0.0714 106 THR C O 5629 C CB . THR C 30 ? 0.7925 0.7164 0.7362 0.0598 -0.0122 0.0682 106 THR C CB 5630 O OG1 . THR C 30 ? 0.7833 0.7010 0.7323 0.0566 -0.0107 0.0697 106 THR C OG1 5631 C CG2 . THR C 30 ? 0.7717 0.7010 0.7118 0.0609 -0.0112 0.0686 106 THR C CG2 5632 N N . THR C 31 ? 0.7797 0.7148 0.7169 0.0662 -0.0161 0.0664 107 THR C N 5633 C CA . THR C 31 ? 0.7782 0.7233 0.7113 0.0671 -0.0186 0.0634 107 THR C CA 5634 C C . THR C 31 ? 0.7957 0.7453 0.7287 0.0712 -0.0195 0.0651 107 THR C C 5635 O O . THR C 31 ? 0.8627 0.8221 0.7934 0.0717 -0.0218 0.0625 107 THR C O 5636 C CB . THR C 31 ? 0.8402 0.7856 0.7731 0.0621 -0.0207 0.0566 107 THR C CB 5637 O OG1 . THR C 31 ? 0.8787 0.8183 0.8158 0.0597 -0.0216 0.0544 107 THR C OG1 5638 C CG2 . THR C 31 ? 0.7006 0.6426 0.6331 0.0595 -0.0192 0.0557 107 THR C CG2 5639 N N . GLY C 32 ? 0.7458 0.6884 0.6812 0.0741 -0.0172 0.0697 108 GLY C N 5640 C CA . GLY C 32 ? 0.7160 0.6615 0.6514 0.0791 -0.0171 0.0722 108 GLY C CA 5641 C C . GLY C 32 ? 0.8029 0.7360 0.7407 0.0809 -0.0136 0.0762 108 GLY C C 5642 O O . GLY C 32 ? 0.8878 0.8123 0.8265 0.0792 -0.0109 0.0785 108 GLY C O 5643 N N . LYS C 33 ? 0.7018 0.6338 0.6407 0.0842 -0.0131 0.0768 109 LYS C N 5644 C CA . LYS C 33 ? 0.8145 0.7330 0.7547 0.0858 -0.0091 0.0801 109 LYS C CA 5645 C C . LYS C 33 ? 0.8832 0.7914 0.8267 0.0791 -0.0092 0.0752 109 LYS C C 5646 O O . LYS C 33 ? 0.8417 0.7534 0.7865 0.0758 -0.0123 0.0697 109 LYS C O 5647 C CB . LYS C 33 ? 0.8092 0.7299 0.7486 0.0930 -0.0077 0.0834 109 LYS C CB 5648 C CG . LYS C 33 ? 0.9151 0.8504 0.8516 0.0996 -0.0088 0.0875 109 LYS C CG 5649 C CD . LYS C 33 ? 0.9775 0.9079 0.9110 0.1061 -0.0044 0.0958 109 LYS C CD 5650 C CE . LYS C 33 ? 1.0306 0.9776 0.9608 0.1128 -0.0061 0.1000 109 LYS C CE 5651 N NZ . LYS C 33 ? 1.2278 1.1863 1.1566 0.1078 -0.0103 0.0957 109 LYS C NZ 5652 N N . ILE C 34 ? 0.8894 0.7851 0.8337 0.0767 -0.0057 0.0771 110 ILE C N 5653 C CA . ILE C 34 ? 0.8824 0.7678 0.8292 0.0709 -0.0053 0.0731 110 ILE C CA 5654 C C . ILE C 34 ? 0.8918 0.7726 0.8381 0.0738 -0.0040 0.0723 110 ILE C C 5655 O O . ILE C 34 ? 0.8597 0.7370 0.8040 0.0802 -0.0004 0.0771 110 ILE C O 5656 C CB . ILE C 34 ? 0.7793 0.6527 0.7268 0.0675 -0.0013 0.0755 110 ILE C CB 5657 C CG1 . ILE C 34 ? 0.7280 0.6062 0.6764 0.0650 -0.0020 0.0768 110 ILE C CG1 5658 C CG2 . ILE C 34 ? 0.7731 0.6374 0.7227 0.0607 -0.0012 0.0708 110 ILE C CG2 5659 C CD1 . ILE C 34 ? 0.7289 0.5971 0.6789 0.0605 0.0018 0.0789 110 ILE C CD1 5660 N N . PRO C 35 ? 0.9038 0.7844 0.8516 0.0695 -0.0065 0.0665 111 PRO C N 5661 C CA . PRO C 35 ? 0.8989 0.7738 0.8464 0.0713 -0.0049 0.0649 111 PRO C CA 5662 C C . PRO C 35 ? 0.9554 0.8140 0.9014 0.0713 0.0007 0.0673 111 PRO C C 5663 O O . PRO C 35 ? 1.0299 0.8806 0.9763 0.0660 0.0022 0.0673 111 PRO C O 5664 C CB . PRO C 35 ? 0.8239 0.7000 0.7731 0.0646 -0.0084 0.0581 111 PRO C CB 5665 C CG . PRO C 35 ? 0.6696 0.5568 0.6195 0.0624 -0.0126 0.0566 111 PRO C CG 5666 C CD . PRO C 35 ? 0.8450 0.7318 0.7946 0.0636 -0.0109 0.0613 111 PRO C CD 5667 N N . ASP C 36 ? 0.8856 0.7394 0.8299 0.0772 0.0041 0.0692 112 ASP C N 5668 C CA . ASP C 36 ? 0.9995 0.8365 0.9412 0.0785 0.0106 0.0721 112 ASP C CA 5669 C C . ASP C 36 ? 1.0602 0.8844 1.0017 0.0700 0.0118 0.0666 112 ASP C C 5670 O O . ASP C 36 ? 0.9757 0.7849 0.9149 0.0677 0.0170 0.0678 112 ASP C O 5671 C CB . ASP C 36 ? 1.0326 0.8681 0.9722 0.0882 0.0145 0.0761 112 ASP C CB 5672 C CG . ASP C 36 ? 1.1879 1.0347 1.1268 0.0971 0.0143 0.0829 112 ASP C CG 5673 O OD1 . ASP C 36 ? 1.2414 1.0892 1.1798 0.0964 0.0144 0.0863 112 ASP C OD1 5674 O OD2 . ASP C 36 ? 1.2557 1.1114 1.1947 0.1048 0.0141 0.0851 112 ASP C OD2 5675 N N . GLU C 37 ? 1.0484 0.8787 0.9918 0.0650 0.0072 0.0605 113 GLU C N 5676 C CA . GLU C 37 ? 1.0592 0.8797 1.0020 0.0570 0.0075 0.0550 113 GLU C CA 5677 C C . GLU C 37 ? 1.0041 0.8227 0.9485 0.0488 0.0063 0.0538 113 GLU C C 5678 O O . GLU C 37 ? 1.1495 0.9601 1.0933 0.0415 0.0070 0.0498 113 GLU C O 5679 C CB . GLU C 37 ? 1.1680 0.9962 1.1119 0.0546 0.0030 0.0494 113 GLU C CB 5680 C CG . GLU C 37 ? 1.3248 1.1607 1.2687 0.0622 0.0027 0.0502 113 GLU C CG 5681 C CD . GLU C 37 ? 1.4651 1.3178 1.4114 0.0651 -0.0019 0.0517 113 GLU C CD 5682 O OE1 . GLU C 37 ? 1.5072 1.3657 1.4551 0.0598 -0.0059 0.0495 113 GLU C OE1 5683 O OE2 . GLU C 37 ? 1.5266 1.3867 1.4729 0.0726 -0.0013 0.0551 113 GLU C OE2 5684 N N . GLN C 38 ? 0.8493 0.6762 0.7957 0.0499 0.0046 0.0573 114 GLN C N 5685 C CA . GLN C 38 ? 0.7700 0.5965 0.7186 0.0428 0.0038 0.0569 114 GLN C CA 5686 C C . GLN C 38 ? 0.7758 0.5885 0.7225 0.0411 0.0100 0.0599 114 GLN C C 5687 O O . GLN C 38 ? 0.8226 0.6291 0.7666 0.0477 0.0146 0.0648 114 GLN C O 5688 C CB . GLN C 38 ? 0.6889 0.5286 0.6402 0.0444 0.0003 0.0592 114 GLN C CB 5689 C CG . GLN C 38 ? 0.8929 0.7445 0.8460 0.0434 -0.0054 0.0553 114 GLN C CG 5690 C CD . GLN C 38 ? 0.9833 0.8456 0.9381 0.0442 -0.0080 0.0572 114 GLN C CD 5691 O OE1 . GLN C 38 ? 1.0212 0.8827 0.9771 0.0430 -0.0062 0.0603 114 GLN C OE1 5692 N NE2 . GLN C 38 ? 0.8766 0.7487 0.8314 0.0459 -0.0117 0.0550 114 GLN C NE2 5693 N N . MET C 39 ? 0.6868 0.4949 0.6348 0.0322 0.0102 0.0571 115 MET C N 5694 C CA . MET C 39 ? 0.8314 0.6290 0.7786 0.0285 0.0155 0.0597 115 MET C CA 5695 C C . MET C 39 ? 0.9135 0.7180 0.8624 0.0327 0.0160 0.0657 115 MET C C 5696 O O . MET C 39 ? 0.9135 0.7319 0.8658 0.0333 0.0111 0.0658 115 MET C O 5697 C CB . MET C 39 ? 0.8985 0.6957 0.8481 0.0172 0.0140 0.0550 115 MET C CB 5698 C CG . MET C 39 ? 0.9105 0.6992 0.8602 0.0114 0.0190 0.0571 115 MET C CG 5699 S SD . MET C 39 ? 1.8760 1.6414 1.8189 0.0094 0.0274 0.0561 115 MET C SD 5700 C CE . MET C 39 ? 0.9808 0.7451 0.9241 -0.0034 0.0248 0.0475 115 MET C CE 5701 N N . LEU C 40 ? 0.7998 0.5938 0.7457 0.0360 0.0222 0.0709 116 LEU C N 5702 C CA . LEU C 40 ? 0.7694 0.5679 0.7161 0.0390 0.0236 0.0768 116 LEU C CA 5703 C C . LEU C 40 ? 0.8077 0.6080 0.7583 0.0298 0.0235 0.0756 116 LEU C C 5704 O O . LEU C 40 ? 1.0381 0.8274 0.9881 0.0225 0.0273 0.0738 116 LEU C O 5705 C CB . LEU C 40 ? 0.7347 0.5203 0.6764 0.0453 0.0310 0.0830 116 LEU C CB 5706 C CG . LEU C 40 ? 0.9011 0.6915 0.8399 0.0572 0.0310 0.0878 116 LEU C CG 5707 C CD1 . LEU C 40 ? 0.8875 0.6864 0.8273 0.0599 0.0258 0.0834 116 LEU C CD1 5708 C CD2 . LEU C 40 ? 0.9006 0.6747 0.8340 0.0629 0.0391 0.0930 116 LEU C CD2 5709 N N . THR C 41 ? 0.7949 0.6094 0.7494 0.0299 0.0194 0.0765 117 THR C N 5710 C CA . THR C 41 ? 0.7411 0.5607 0.7005 0.0219 0.0186 0.0756 117 THR C CA 5711 C C . THR C 41 ? 0.8030 0.6239 0.7628 0.0237 0.0222 0.0816 117 THR C C 5712 O O . THR C 41 ? 0.8549 0.6780 0.8119 0.0319 0.0231 0.0862 117 THR C O 5713 C CB . THR C 41 ? 0.6741 0.5092 0.6379 0.0205 0.0117 0.0722 117 THR C CB 5714 O OG1 . THR C 41 ? 0.8912 0.7357 0.8544 0.0281 0.0098 0.0753 117 THR C OG1 5715 C CG2 . THR C 41 ? 0.6326 0.4673 0.5955 0.0194 0.0081 0.0667 117 THR C CG2 5716 N N . ARG C 42 ? 0.7662 0.5864 0.7295 0.0156 0.0243 0.0815 118 ARG C N 5717 C CA . ARG C 42 ? 0.7366 0.5605 0.7016 0.0158 0.0273 0.0866 118 ARG C CA 5718 C C . ARG C 42 ? 0.7573 0.5897 0.7292 0.0064 0.0258 0.0843 118 ARG C C 5719 O O . ARG C 42 ? 0.8265 0.6589 0.8008 -0.0011 0.0237 0.0792 118 ARG C O 5720 C CB . ARG C 42 ? 0.7841 0.5927 0.7441 0.0177 0.0352 0.0917 118 ARG C CB 5721 C CG . ARG C 42 ? 0.8716 0.6656 0.8308 0.0085 0.0404 0.0896 118 ARG C CG 5722 C CD . ARG C 42 ? 1.1618 0.9410 1.1161 0.0107 0.0490 0.0958 118 ARG C CD 5723 N NE . ARG C 42 ? 1.4298 1.1998 1.3853 -0.0004 0.0543 0.0945 118 ARG C NE 5724 C CZ . ARG C 42 ? 1.5837 1.3619 1.5445 -0.0067 0.0550 0.0957 118 ARG C CZ 5725 N NH1 . ARG C 42 ? 1.5554 1.3502 1.5203 -0.0025 0.0510 0.0983 118 ARG C NH1 5726 N NH2 . ARG C 42 ? 1.6246 1.3945 1.5863 -0.0176 0.0600 0.0942 118 ARG C NH2 5727 N N . GLN C 43 ? 0.7444 0.5848 0.7194 0.0069 0.0271 0.0883 119 GLN C N 5728 C CA . GLN C 43 ? 0.6711 0.5228 0.6534 -0.0006 0.0256 0.0870 119 GLN C CA 5729 C C . GLN C 43 ? 0.6779 0.5417 0.6642 -0.0019 0.0184 0.0821 119 GLN C C 5730 O O . GLN C 43 ? 0.6261 0.4949 0.6172 -0.0100 0.0165 0.0786 119 GLN C O 5731 C CB . GLN C 43 ? 0.7203 0.5638 0.7043 -0.0111 0.0302 0.0860 119 GLN C CB 5732 C CG . GLN C 43 ? 0.8871 0.7412 0.8782 -0.0175 0.0318 0.0880 119 GLN C CG 5733 C CD . GLN C 43 ? 0.9657 0.8291 0.9635 -0.0282 0.0285 0.0830 119 GLN C CD 5734 O OE1 . GLN C 43 ? 1.0823 0.9430 1.0826 -0.0378 0.0322 0.0823 119 GLN C OE1 5735 N NE2 . GLN C 43 ? 0.7598 0.6348 0.7604 -0.0266 0.0217 0.0796 119 GLN C NE2 5736 N N . ASN C 44 ? 0.5902 0.4592 0.5744 0.0060 0.0146 0.0818 120 ASN C N 5737 C CA . ASN C 44 ? 0.6172 0.4970 0.6045 0.0056 0.0085 0.0778 120 ASN C CA 5738 C C . ASN C 44 ? 0.7350 0.6290 0.7290 0.0035 0.0071 0.0791 120 ASN C C 5739 O O . ASN C 44 ? 0.9264 0.8239 0.9218 0.0053 0.0102 0.0833 120 ASN C O 5740 C CB . ASN C 44 ? 0.6073 0.4882 0.5901 0.0139 0.0054 0.0771 120 ASN C CB 5741 C CG . ASN C 44 ? 0.7753 0.6442 0.7523 0.0165 0.0065 0.0760 120 ASN C CG 5742 O OD1 . ASN C 44 ? 0.9744 0.8409 0.9506 0.0146 0.0039 0.0716 120 ASN C OD1 5743 N ND2 . ASN C 44 ? 0.9355 0.7972 0.9083 0.0213 0.0108 0.0802 120 ASN C ND2 5744 N N . PHE C 45 ? 0.7060 0.6085 0.7041 -0.0001 0.0027 0.0756 121 PHE C N 5745 C CA . PHE C 45 ? 0.6258 0.5432 0.6300 -0.0001 0.0008 0.0767 121 PHE C CA 5746 C C . PHE C 45 ? 0.7431 0.6671 0.7491 -0.0016 -0.0046 0.0727 121 PHE C C 5747 O O . PHE C 45 ? 0.6887 0.6062 0.6920 -0.0046 -0.0065 0.0688 121 PHE C O 5748 C CB . PHE C 45 ? 0.5144 0.4377 0.5250 -0.0067 0.0038 0.0792 121 PHE C CB 5749 C CG . PHE C 45 ? 0.6424 0.5660 0.6563 -0.0167 0.0029 0.0758 121 PHE C CG 5750 C CD1 . PHE C 45 ? 0.7214 0.6310 0.7316 -0.0221 0.0063 0.0744 121 PHE C CD1 5751 C CD2 . PHE C 45 ? 0.7498 0.6874 0.7699 -0.0206 -0.0013 0.0740 121 PHE C CD2 5752 C CE1 . PHE C 45 ? 0.7557 0.6649 0.7679 -0.0323 0.0057 0.0704 121 PHE C CE1 5753 C CE2 . PHE C 45 ? 0.6814 0.6206 0.7040 -0.0305 -0.0026 0.0704 121 PHE C CE2 5754 C CZ . PHE C 45 ? 0.6599 0.5847 0.6784 -0.0368 0.0010 0.0683 121 PHE C CZ 5755 N N . VAL C 46 ? 0.7599 0.6965 0.7702 0.0008 -0.0068 0.0738 122 VAL C N 5756 C CA . VAL C 46 ? 0.6056 0.5487 0.6171 0.0007 -0.0115 0.0709 122 VAL C CA 5757 C C . VAL C 46 ? 0.7288 0.6859 0.7483 -0.0046 -0.0129 0.0718 122 VAL C C 5758 O O . VAL C 46 ? 0.7313 0.6974 0.7561 -0.0040 -0.0107 0.0755 122 VAL C O 5759 C CB . VAL C 46 ? 0.5714 0.5165 0.5798 0.0090 -0.0129 0.0713 122 VAL C CB 5760 C CG1 . VAL C 46 ? 0.6307 0.5820 0.6400 0.0093 -0.0172 0.0690 122 VAL C CG1 5761 C CG2 . VAL C 46 ? 0.4986 0.4319 0.4993 0.0134 -0.0120 0.0701 122 VAL C CG2 5762 N N . SER C 47 ? 0.5505 0.5104 0.5710 -0.0097 -0.0165 0.0684 123 SER C N 5763 C CA . SER C 47 ? 0.5929 0.5691 0.6209 -0.0136 -0.0191 0.0692 123 SER C CA 5764 C C . SER C 47 ? 0.8727 0.8530 0.8991 -0.0120 -0.0240 0.0667 123 SER C C 5765 O O . SER C 47 ? 0.6998 0.6700 0.7202 -0.0128 -0.0257 0.0629 123 SER C O 5766 C CB . SER C 47 ? 0.5789 0.5578 0.6110 -0.0242 -0.0181 0.0680 123 SER C CB 5767 O OG . SER C 47 ? 0.8148 0.8126 0.8555 -0.0270 -0.0197 0.0703 123 SER C OG 5768 N N . CYS C 48 ? 0.8891 0.8844 0.9208 -0.0094 -0.0259 0.0694 124 CYS C N 5769 C CA . CYS C 48 ? 0.8390 0.8386 0.8690 -0.0065 -0.0300 0.0682 124 CYS C CA 5770 C C . CYS C 48 ? 0.7049 0.7196 0.7406 -0.0130 -0.0336 0.0679 124 CYS C C 5771 O O . CYS C 48 ? 0.7375 0.7650 0.7808 -0.0169 -0.0329 0.0704 124 CYS C O 5772 C CB . CYS C 48 ? 0.9370 0.9402 0.9669 0.0034 -0.0291 0.0717 124 CYS C CB 5773 S SG . CYS C 48 ? 0.9431 0.9289 0.9645 0.0101 -0.0258 0.0707 124 CYS C SG 5774 N N . SER C 49 ? 0.8609 0.8745 0.8928 -0.0146 -0.0374 0.0648 125 SER C N 5775 C CA . SER C 49 ? 0.7926 0.8219 0.8287 -0.0194 -0.0417 0.0647 125 SER C CA 5776 C C . SER C 49 ? 0.7770 0.8155 0.8138 -0.0107 -0.0437 0.0682 125 SER C C 5777 O O . SER C 49 ? 0.8519 0.8866 0.8875 -0.0020 -0.0411 0.0712 125 SER C O 5778 C CB . SER C 49 ? 0.6733 0.6955 0.7039 -0.0267 -0.0444 0.0590 125 SER C CB 5779 O OG . SER C 49 ? 0.7255 0.7380 0.7488 -0.0210 -0.0458 0.0573 125 SER C OG 5780 N N . ASP C 50 ? 0.9444 0.9943 0.9821 -0.0131 -0.0480 0.0679 126 ASP C N 5781 C CA . ASP C 50 ? 1.0470 1.1053 1.0848 -0.0046 -0.0497 0.0718 126 ASP C CA 5782 C C . ASP C 50 ? 0.9913 1.0353 1.0195 -0.0011 -0.0508 0.0688 126 ASP C C 5783 O O . ASP C 50 ? 1.0682 1.1151 1.0944 0.0060 -0.0516 0.0716 126 ASP C O 5784 C CB . ASP C 50 ? 1.0818 1.1631 1.1264 -0.0076 -0.0537 0.0746 126 ASP C CB 5785 C CG . ASP C 50 ? 1.2605 1.3444 1.3028 -0.0181 -0.0580 0.0695 126 ASP C CG 5786 O OD1 . ASP C 50 ? 1.1957 1.2631 1.2317 -0.0236 -0.0573 0.0638 126 ASP C OD1 5787 O OD2 . ASP C 50 ? 1.3155 1.4187 1.3621 -0.0207 -0.0620 0.0713 126 ASP C OD2 5788 N N . LYS C 51 ? 0.8525 0.8806 0.8747 -0.0058 -0.0503 0.0635 127 LYS C N 5789 C CA . LYS C 51 ? 0.8672 0.8813 0.8806 -0.0031 -0.0508 0.0602 127 LYS C CA 5790 C C . LYS C 51 ? 0.9343 0.9308 0.9427 0.0005 -0.0471 0.0584 127 LYS C C 5791 O O . LYS C 51 ? 0.9093 0.8967 0.9117 0.0056 -0.0466 0.0575 127 LYS C O 5792 C CB . LYS C 51 ? 0.8772 0.8889 0.8868 -0.0114 -0.0540 0.0551 127 LYS C CB 5793 C CG . LYS C 51 ? 1.2693 1.2994 1.2832 -0.0166 -0.0581 0.0561 127 LYS C CG 5794 C CD . LYS C 51 ? 1.4192 1.4604 1.4335 -0.0090 -0.0603 0.0609 127 LYS C CD 5795 C CE . LYS C 51 ? 1.3785 1.4408 1.3975 -0.0136 -0.0648 0.0626 127 LYS C CE 5796 N NZ . LYS C 51 ? 1.2767 1.3530 1.2990 -0.0045 -0.0656 0.0694 127 LYS C NZ 5797 N N . GLU C 52 ? 0.9127 0.9051 0.9235 -0.0022 -0.0443 0.0581 128 GLU C N 5798 C CA . GLU C 52 ? 0.8021 0.7793 0.8081 0.0008 -0.0411 0.0565 128 GLU C CA 5799 C C . GLU C 52 ? 0.8151 0.7915 0.8250 0.0001 -0.0375 0.0585 128 GLU C C 5800 O O . GLU C 52 ? 0.7894 0.7760 0.8057 -0.0040 -0.0373 0.0605 128 GLU C O 5801 C CB . GLU C 52 ? 0.7118 0.6765 0.7116 -0.0034 -0.0418 0.0513 128 GLU C CB 5802 C CG . GLU C 52 ? 0.8141 0.7802 0.8158 -0.0127 -0.0426 0.0488 128 GLU C CG 5803 C CD . GLU C 52 ? 0.9338 0.8867 0.9290 -0.0164 -0.0425 0.0437 128 GLU C CD 5804 O OE1 . GLU C 52 ? 0.9909 0.9369 0.9807 -0.0123 -0.0431 0.0419 128 GLU C OE1 5805 O OE2 . GLU C 52 ? 0.8747 0.8238 0.8701 -0.0236 -0.0414 0.0413 128 GLU C OE2 5806 N N . CYS C 53 ? 0.6740 0.6390 0.6797 0.0040 -0.0346 0.0580 129 CYS C N 5807 C CA . CYS C 53 ? 0.6260 0.5877 0.6336 0.0032 -0.0311 0.0596 129 CYS C CA 5808 C C . CYS C 53 ? 0.7408 0.6902 0.7443 -0.0013 -0.0301 0.0562 129 CYS C C 5809 O O . CYS C 53 ? 0.8142 0.7546 0.8118 0.0003 -0.0309 0.0532 129 CYS C O 5810 C CB . CYS C 53 ? 0.6241 0.5825 0.6294 0.0109 -0.0283 0.0619 129 CYS C CB 5811 S SG . CYS C 53 ? 0.9459 0.9177 0.9565 0.0161 -0.0274 0.0667 129 CYS C SG 5812 N N . ARG C 54 ? 0.7642 0.7129 0.7706 -0.0070 -0.0280 0.0567 130 ARG C N 5813 C CA . ARG C 54 ? 0.7343 0.6694 0.7363 -0.0104 -0.0259 0.0540 130 ARG C CA 5814 C C . ARG C 54 ? 0.7730 0.7015 0.7745 -0.0080 -0.0213 0.0568 130 ARG C C 5815 O O . ARG C 54 ? 0.8069 0.7423 0.8130 -0.0077 -0.0194 0.0605 130 ARG C O 5816 C CB . ARG C 54 ? 0.7316 0.6665 0.7346 -0.0201 -0.0266 0.0509 130 ARG C CB 5817 C CG . ARG C 54 ? 0.6636 0.6029 0.6652 -0.0227 -0.0311 0.0474 130 ARG C CG 5818 C CD . ARG C 54 ? 0.5894 0.5265 0.5902 -0.0328 -0.0315 0.0434 130 ARG C CD 5819 N NE . ARG C 54 ? 0.6712 0.5910 0.6654 -0.0344 -0.0286 0.0399 130 ARG C NE 5820 C CZ . ARG C 54 ? 0.6462 0.5575 0.6344 -0.0310 -0.0295 0.0371 130 ARG C CZ 5821 N NH1 . ARG C 54 ? 0.5365 0.4540 0.5240 -0.0262 -0.0332 0.0372 130 ARG C NH1 5822 N NH2 . ARG C 54 ? 0.5990 0.4951 0.5817 -0.0321 -0.0263 0.0344 130 ARG C NH2 5823 N N . ARG C 55 ? 0.7895 0.7051 0.7851 -0.0060 -0.0195 0.0554 131 ARG C N 5824 C CA . ARG C 55 ? 0.7091 0.6166 0.7027 -0.0033 -0.0151 0.0582 131 ARG C CA 5825 C C . ARG C 55 ? 0.7534 0.6520 0.7465 -0.0103 -0.0119 0.0571 131 ARG C C 5826 O O . ARG C 55 ? 0.7518 0.6400 0.7403 -0.0120 -0.0115 0.0539 131 ARG C O 5827 C CB . ARG C 55 ? 0.6054 0.5049 0.5929 0.0035 -0.0149 0.0575 131 ARG C CB 5828 C CG . ARG C 55 ? 0.7005 0.5972 0.6861 0.0093 -0.0115 0.0614 131 ARG C CG 5829 C CD . ARG C 55 ? 0.6843 0.5688 0.6647 0.0114 -0.0086 0.0616 131 ARG C CD 5830 N NE . ARG C 55 ? 0.7300 0.6137 0.7060 0.0181 -0.0102 0.0608 131 ARG C NE 5831 C CZ . ARG C 55 ? 0.8236 0.7013 0.7955 0.0232 -0.0078 0.0627 131 ARG C CZ 5832 N NH1 . ARG C 55 ? 0.6338 0.5040 0.6046 0.0232 -0.0034 0.0660 131 ARG C NH1 5833 N NH2 . ARG C 55 ? 0.9557 0.8354 0.9243 0.0284 -0.0098 0.0615 131 ARG C NH2 5834 N N . PHE C 56 ? 0.7798 0.6818 0.7772 -0.0146 -0.0092 0.0597 132 PHE C N 5835 C CA . PHE C 56 ? 0.7257 0.6177 0.7220 -0.0217 -0.0050 0.0589 132 PHE C CA 5836 C C . PHE C 56 ? 0.7634 0.6433 0.7556 -0.0169 0.0003 0.0624 132 PHE C C 5837 O O . PHE C 56 ? 0.7565 0.6400 0.7489 -0.0101 0.0011 0.0664 132 PHE C O 5838 C CB . PHE C 56 ? 0.6688 0.5710 0.6720 -0.0297 -0.0046 0.0597 132 PHE C CB 5839 C CG . PHE C 56 ? 0.7771 0.6904 0.7838 -0.0356 -0.0095 0.0561 132 PHE C CG 5840 C CD1 . PHE C 56 ? 0.7510 0.6786 0.7614 -0.0312 -0.0142 0.0570 132 PHE C CD1 5841 C CD2 . PHE C 56 ? 0.6544 0.5632 0.6599 -0.0453 -0.0092 0.0516 132 PHE C CD2 5842 C CE1 . PHE C 56 ? 0.7771 0.7154 0.7902 -0.0358 -0.0187 0.0543 132 PHE C CE1 5843 C CE2 . PHE C 56 ? 0.7701 0.6901 0.7781 -0.0507 -0.0141 0.0483 132 PHE C CE2 5844 C CZ . PHE C 56 ? 0.7476 0.6830 0.7597 -0.0457 -0.0190 0.0500 132 PHE C CZ 5845 N N . PHE C 57 ? 0.7054 0.5706 0.6932 -0.0205 0.0043 0.0609 133 PHE C N 5846 C CA . PHE C 57 ? 0.7077 0.5603 0.6909 -0.0158 0.0100 0.0648 133 PHE C CA 5847 C C . PHE C 57 ? 0.8351 0.6709 0.8141 -0.0219 0.0155 0.0631 133 PHE C C 5848 O O . PHE C 57 ? 0.7735 0.6067 0.7523 -0.0299 0.0145 0.0580 133 PHE C O 5849 C CB . PHE C 57 ? 0.6290 0.4787 0.6074 -0.0054 0.0087 0.0658 133 PHE C CB 5850 C CG . PHE C 57 ? 0.8545 0.6984 0.8291 -0.0053 0.0064 0.0611 133 PHE C CG 5851 C CD1 . PHE C 57 ? 0.8980 0.7259 0.8671 -0.0053 0.0108 0.0602 133 PHE C CD1 5852 C CD2 . PHE C 57 ? 0.8873 0.7410 0.8636 -0.0048 0.0005 0.0577 133 PHE C CD2 5853 C CE1 . PHE C 57 ? 0.7906 0.6133 0.7562 -0.0049 0.0092 0.0558 133 PHE C CE1 5854 C CE2 . PHE C 57 ? 0.8919 0.7404 0.8646 -0.0048 -0.0013 0.0533 133 PHE C CE2 5855 C CZ . PHE C 57 ? 0.8230 0.6564 0.7905 -0.0049 0.0030 0.0523 133 PHE C CZ 5856 N N . VAL C 58 ? 0.7338 0.5581 0.7090 -0.0180 0.0215 0.0675 134 VAL C N 5857 C CA . VAL C 58 ? 0.7837 0.5889 0.7533 -0.0216 0.0281 0.0668 134 VAL C CA 5858 C C . VAL C 58 ? 0.7923 0.5868 0.7552 -0.0115 0.0297 0.0685 134 VAL C C 5859 O O . VAL C 58 ? 0.8988 0.6989 0.8612 -0.0021 0.0284 0.0726 134 VAL C O 5860 C CB . VAL C 58 ? 0.9081 0.7071 0.8781 -0.0253 0.0348 0.0712 134 VAL C CB 5861 C CG1 . VAL C 58 ? 0.9411 0.7176 0.9041 -0.0284 0.0427 0.0709 134 VAL C CG1 5862 C CG2 . VAL C 58 ? 0.6497 0.4618 0.6273 -0.0358 0.0329 0.0694 134 VAL C CG2 5863 N N . SER C 59 ? 0.8352 0.6152 0.7929 -0.0135 0.0326 0.0650 135 SER C N 5864 C CA . SER C 59 ? 0.9396 0.7117 0.8918 -0.0037 0.0336 0.0661 135 SER C CA 5865 C C . SER C 59 ? 1.2599 1.0165 1.2065 0.0023 0.0416 0.0720 135 SER C C 5866 O O . SER C 59 ? 1.3448 1.0918 1.2904 -0.0031 0.0476 0.0740 135 SER C O 5867 C CB . SER C 59 ? 0.8979 0.6611 0.8465 -0.0078 0.0335 0.0598 135 SER C CB 5868 O OG . SER C 59 ? 1.1911 0.9376 1.1361 -0.0157 0.0404 0.0582 135 SER C OG 5869 N N . MET C 60 ? 1.3192 1.0740 1.2622 0.0134 0.0419 0.0751 136 MET C N 5870 C CA . MET C 60 ? 1.3200 1.0602 1.2570 0.0211 0.0494 0.0811 136 MET C CA 5871 C C . MET C 60 ? 1.4352 1.1662 1.3673 0.0273 0.0509 0.0796 136 MET C C 5872 O O . MET C 60 ? 1.4790 1.1967 1.4056 0.0346 0.0576 0.0843 136 MET C O 5873 C CB . MET C 60 ? 1.2616 1.0120 1.1992 0.0308 0.0484 0.0884 136 MET C CB 5874 C CG . MET C 60 ? 1.2557 1.0170 1.1982 0.0264 0.0468 0.0904 136 MET C CG 5875 S SD . MET C 60 ? 2.0218 1.7990 1.9648 0.0376 0.0435 0.0969 136 MET C SD 5876 C CE . MET C 60 ? 1.3513 1.1143 1.2863 0.0487 0.0511 0.1047 136 MET C CE 5877 N N . GLY C 61 ? 1.4329 1.1714 1.3670 0.0249 0.0450 0.0733 137 GLY C N 5878 C CA . GLY C 61 ? 1.3596 1.0897 1.2895 0.0293 0.0465 0.0709 137 GLY C CA 5879 C C . GLY C 61 ? 1.3142 1.0575 1.2454 0.0392 0.0414 0.0720 137 GLY C C 5880 O O . GLY C 61 ? 1.3809 1.1417 1.3168 0.0391 0.0342 0.0707 137 GLY C O 5881 N N . TYR C 62 ? 1.2855 1.0202 1.2123 0.0478 0.0456 0.0744 138 TYR C N 5882 C CA . TYR C 62 ? 1.3362 1.0832 1.2641 0.0566 0.0413 0.0748 138 TYR C CA 5883 C C . TYR C 62 ? 1.4256 1.1684 1.3499 0.0692 0.0464 0.0822 138 TYR C C 5884 O O . TYR C 62 ? 1.6263 1.3525 1.5459 0.0713 0.0543 0.0864 138 TYR C O 5885 C CB . TYR C 62 ? 1.3763 1.1198 1.3032 0.0533 0.0400 0.0678 138 TYR C CB 5886 C CG . TYR C 62 ? 1.3504 1.0986 1.2803 0.0415 0.0348 0.0605 138 TYR C CG 5887 C CD1 . TYR C 62 ? 1.3541 1.1205 1.2887 0.0405 0.0267 0.0579 138 TYR C CD1 5888 C CD2 . TYR C 62 ? 1.3842 1.1189 1.3117 0.0315 0.0383 0.0563 138 TYR C CD2 5889 C CE1 . TYR C 62 ? 1.3645 1.1357 1.3016 0.0308 0.0221 0.0520 138 TYR C CE1 5890 C CE2 . TYR C 62 ? 1.3364 1.0776 1.2667 0.0210 0.0332 0.0500 138 TYR C CE2 5891 C CZ . TYR C 62 ? 1.3360 1.0956 1.2712 0.0213 0.0251 0.0483 138 TYR C CZ 5892 O OH . TYR C 62 ? 1.2635 1.0302 1.2013 0.0121 0.0201 0.0428 138 TYR C OH 5893 N N . GLY C 63 ? 1.2456 1.0035 1.1717 0.0775 0.0421 0.0839 139 GLY C N 5894 C CA . GLY C 63 ? 1.2150 0.9717 1.1382 0.0901 0.0462 0.0905 139 GLY C CA 5895 C C . GLY C 63 ? 1.3762 1.1197 1.2959 0.0928 0.0511 0.0882 139 GLY C C 5896 O O . GLY C 63 ? 1.4095 1.1432 1.3252 0.1021 0.0579 0.0938 139 GLY C O 5897 N N . VAL C 73 ? 1.9107 1.6128 1.8234 0.0742 0.0678 0.0978 149 VAL C N 5898 C CA . VAL C 73 ? 2.0207 1.6983 1.9267 0.0745 0.0774 0.0978 149 VAL C CA 5899 C C . VAL C 73 ? 2.0267 1.6969 1.9322 0.0656 0.0766 0.0883 149 VAL C C 5900 O O . VAL C 73 ? 1.9200 1.5854 1.8229 0.0713 0.0784 0.0870 149 VAL C O 5901 C CB . VAL C 73 ? 1.4865 1.1596 1.3882 0.0900 0.0825 0.1052 149 VAL C CB 5902 C CG1 . VAL C 73 ? 1.5011 1.1487 1.3951 0.0928 0.0945 0.1108 149 VAL C CG1 5903 C CG2 . VAL C 73 ? 1.1990 0.8945 1.1042 0.1001 0.0768 0.1117 149 VAL C CG2 5904 N N . SER C 74 ? 2.0650 1.7348 1.9728 0.0518 0.0742 0.0819 150 SER C N 5905 C CA . SER C 74 ? 1.9503 1.6134 1.8570 0.0418 0.0734 0.0727 150 SER C CA 5906 C C . SER C 74 ? 1.9100 1.5708 1.8184 0.0263 0.0725 0.0671 150 SER C C 5907 O O . SER C 74 ? 1.9186 1.5612 1.8225 0.0204 0.0802 0.0672 150 SER C O 5908 C CB . SER C 74 ? 1.8549 1.5355 1.7658 0.0438 0.0647 0.0682 150 SER C CB 5909 O OG . SER C 74 ? 1.7833 1.4615 1.6915 0.0553 0.0671 0.0707 150 SER C OG 5910 N N . GLU C 75 ? 1.9343 1.6136 1.8490 0.0199 0.0633 0.0624 151 GLU C N 5911 C CA . GLU C 75 ? 2.0478 1.7286 1.9649 0.0051 0.0611 0.0560 151 GLU C CA 5912 C C . GLU C 75 ? 1.8772 1.5714 1.8006 0.0005 0.0576 0.0588 151 GLU C C 5913 O O . GLU C 75 ? 1.6894 1.4037 1.6191 0.0012 0.0494 0.0584 151 GLU C O 5914 C CB . GLU C 75 ? 2.1994 1.8917 2.1188 0.0010 0.0534 0.0487 151 GLU C CB 5915 C CG . GLU C 75 ? 2.2409 1.9324 2.1606 -0.0137 0.0518 0.0411 151 GLU C CG 5916 C CD . GLU C 75 ? 2.2131 1.9102 2.1322 -0.0158 0.0466 0.0344 151 GLU C CD 5917 O OE1 . GLU C 75 ? 2.1080 1.8226 2.0325 -0.0204 0.0386 0.0316 151 GLU C OE1 5918 O OE2 . GLU C 75 ? 2.2143 1.8979 2.1272 -0.0124 0.0509 0.0323 151 GLU C OE2 5919 N N . GLN C 76 ? 1.8632 1.5458 1.7847 -0.0045 0.0643 0.0613 152 GLN C N 5920 C CA . GLN C 76 ? 1.8671 1.5611 1.7943 -0.0079 0.0625 0.0650 152 GLN C CA 5921 C C . GLN C 76 ? 1.8611 1.5579 1.7918 -0.0232 0.0617 0.0598 152 GLN C C 5922 O O . GLN C 76 ? 1.9942 1.6905 1.9244 -0.0318 0.0594 0.0525 152 GLN C O 5923 C CB . GLN C 76 ? 1.8583 1.5400 1.7817 -0.0017 0.0706 0.0731 152 GLN C CB 5924 C CG . GLN C 76 ? 1.8894 1.5652 1.8080 0.0133 0.0736 0.0791 152 GLN C CG 5925 C CD . GLN C 76 ? 1.9278 1.5802 1.8382 0.0148 0.0817 0.0777 152 GLN C CD 5926 O OE1 . GLN C 76 ? 2.0145 1.6544 1.9221 0.0041 0.0849 0.0713 152 GLN C OE1 5927 N NE2 . GLN C 76 ? 1.7937 1.4404 1.6999 0.0283 0.0852 0.0836 152 GLN C NE2 5928 N N . MET C 77 ? 1.6611 1.3625 1.5954 -0.0261 0.0633 0.0639 156 MET C N 5929 C CA . MET C 77 ? 1.4565 1.1563 1.3930 -0.0403 0.0658 0.0609 156 MET C CA 5930 C C . MET C 77 ? 1.2412 0.9586 1.1845 -0.0516 0.0581 0.0542 156 MET C C 5931 O O . MET C 77 ? 1.0266 0.7440 0.9719 -0.0641 0.0601 0.0513 156 MET C O 5932 C CB . MET C 77 ? 1.5993 1.2723 1.5273 -0.0464 0.0761 0.0589 156 MET C CB 5933 C CG . MET C 77 ? 1.7387 1.4043 1.6630 -0.0555 0.0756 0.0498 156 MET C CG 5934 S SD . MET C 77 ? 2.9326 2.5647 2.8441 -0.0532 0.0871 0.0487 156 MET C SD 5935 C CE . MET C 77 ? 1.1665 0.8046 1.0767 -0.0459 0.0805 0.0442 156 MET C CE 5936 N N . ASN C 78 ? 1.1913 0.9243 1.1380 -0.0473 0.0496 0.0519 157 ASN C N 5937 C CA . ASN C 78 ? 1.0120 0.7613 0.9643 -0.0568 0.0425 0.0460 157 ASN C CA 5938 C C . ASN C 78 ? 0.9522 0.7255 0.9127 -0.0522 0.0343 0.0485 157 ASN C C 5939 O O . ASN C 78 ? 0.9509 0.7284 0.9121 -0.0411 0.0332 0.0537 157 ASN C O 5940 C CB . ASN C 78 ? 0.8548 0.5987 0.8024 -0.0592 0.0403 0.0391 157 ASN C CB 5941 C CG . ASN C 78 ? 1.0717 0.7935 1.0116 -0.0678 0.0480 0.0347 157 ASN C CG 5942 O OD1 . ASN C 78 ? 1.2127 0.9323 1.1535 -0.0798 0.0510 0.0322 157 ASN C OD1 5943 N ND2 . ASN C 78 ? 1.1431 0.8483 1.0753 -0.0618 0.0519 0.0335 157 ASN C ND2 5944 N N . VAL C 79 ? 0.8259 0.6150 0.7924 -0.0608 0.0288 0.0447 158 VAL C N 5945 C CA . VAL C 79 ? 0.7403 0.5517 0.7141 -0.0566 0.0212 0.0466 158 VAL C CA 5946 C C . VAL C 79 ? 0.7327 0.5513 0.7058 -0.0540 0.0145 0.0425 158 VAL C C 5947 O O . VAL C 79 ? 0.8821 0.6977 0.8527 -0.0613 0.0133 0.0366 158 VAL C O 5948 C CB . VAL C 79 ? 0.7939 0.6216 0.7759 -0.0658 0.0192 0.0466 158 VAL C CB 5949 C CG1 . VAL C 79 ? 0.6921 0.5403 0.6810 -0.0590 0.0130 0.0500 158 VAL C CG1 5950 C CG2 . VAL C 79 ? 0.5685 0.3883 0.5510 -0.0704 0.0266 0.0500 158 VAL C CG2 5951 N N . TYR C 80 ? 0.7147 0.5424 0.6897 -0.0438 0.0104 0.0455 159 TYR C N 5952 C CA . TYR C 80 ? 0.6835 0.5176 0.6575 -0.0405 0.0045 0.0422 159 TYR C CA 5953 C C . TYR C 80 ? 0.7097 0.5628 0.6900 -0.0363 -0.0013 0.0446 159 TYR C C 5954 O O . TYR C 80 ? 0.7134 0.5734 0.6981 -0.0341 -0.0003 0.0491 159 TYR C O 5955 C CB . TYR C 80 ? 0.5590 0.3817 0.5270 -0.0311 0.0061 0.0428 159 TYR C CB 5956 C CG . TYR C 80 ? 0.7645 0.5676 0.7256 -0.0338 0.0120 0.0402 159 TYR C CG 5957 C CD1 . TYR C 80 ? 0.6860 0.4752 0.6441 -0.0325 0.0193 0.0439 159 TYR C CD1 5958 C CD2 . TYR C 80 ? 0.8050 0.6026 0.7619 -0.0374 0.0109 0.0343 159 TYR C CD2 5959 C CE1 . TYR C 80 ? 0.8922 0.6616 0.8433 -0.0344 0.0256 0.0418 159 TYR C CE1 5960 C CE2 . TYR C 80 ? 0.7359 0.5143 0.6858 -0.0397 0.0170 0.0318 159 TYR C CE2 5961 C CZ . TYR C 80 ? 0.9568 0.7206 0.9037 -0.0380 0.0245 0.0355 159 TYR C CZ 5962 O OH . TYR C 80 ? 1.0446 0.7878 0.9839 -0.0396 0.0315 0.0332 159 TYR C OH 5963 N N . SER C 81 ? 0.8360 0.6966 0.8163 -0.0351 -0.0067 0.0416 160 SER C N 5964 C CA . SER C 81 ? 0.7453 0.6209 0.7297 -0.0294 -0.0115 0.0439 160 SER C CA 5965 C C . SER C 81 ? 0.6540 0.5276 0.6342 -0.0238 -0.0146 0.0415 160 SER C C 5966 O O . SER C 81 ? 0.7269 0.5915 0.7025 -0.0265 -0.0141 0.0374 160 SER C O 5967 C CB . SER C 81 ? 0.6401 0.5317 0.6309 -0.0356 -0.0154 0.0433 160 SER C CB 5968 O OG . SER C 81 ? 0.8235 0.7165 0.8124 -0.0416 -0.0186 0.0383 160 SER C OG 5969 N N . VAL C 82 ? 0.6421 0.5236 0.6237 -0.0164 -0.0172 0.0438 161 VAL C N 5970 C CA . VAL C 82 ? 0.7463 0.6296 0.7251 -0.0123 -0.0208 0.0414 161 VAL C CA 5971 C C . VAL C 82 ? 0.7652 0.6625 0.7481 -0.0100 -0.0246 0.0432 161 VAL C C 5972 O O . VAL C 82 ? 0.7833 0.6882 0.7709 -0.0098 -0.0239 0.0466 161 VAL C O 5973 C CB . VAL C 82 ? 0.7701 0.6461 0.7445 -0.0044 -0.0192 0.0423 161 VAL C CB 5974 C CG1 . VAL C 82 ? 0.6186 0.4803 0.5887 -0.0052 -0.0151 0.0410 161 VAL C CG1 5975 C CG2 . VAL C 82 ? 0.6767 0.5571 0.6531 0.0016 -0.0180 0.0470 161 VAL C CG2 5976 N N . LYS C 83 ? 0.8155 0.7159 0.7965 -0.0080 -0.0280 0.0410 162 LYS C N 5977 C CA . LYS C 83 ? 0.7753 0.6868 0.7590 -0.0045 -0.0307 0.0431 162 LYS C CA 5978 C C . LYS C 83 ? 0.7670 0.6768 0.7497 0.0028 -0.0287 0.0458 162 LYS C C 5979 O O . LYS C 83 ? 0.6195 0.5215 0.5978 0.0062 -0.0276 0.0446 162 LYS C O 5980 C CB . LYS C 83 ? 0.7219 0.6349 0.7026 -0.0038 -0.0341 0.0402 162 LYS C CB 5981 C CG . LYS C 83 ? 0.8280 0.7513 0.8109 -0.0005 -0.0364 0.0424 162 LYS C CG 5982 C CD . LYS C 83 ? 0.9685 0.8892 0.9465 0.0018 -0.0384 0.0398 162 LYS C CD 5983 C CE . LYS C 83 ? 1.0756 1.0055 1.0549 0.0040 -0.0408 0.0417 162 LYS C CE 5984 N NZ . LYS C 83 ? 1.1475 1.0733 1.1213 0.0055 -0.0422 0.0390 162 LYS C NZ 5985 N N . LEU C 84 ? 0.7716 0.6890 0.7582 0.0051 -0.0280 0.0495 163 LEU C N 5986 C CA . LEU C 84 ? 0.7457 0.6622 0.7306 0.0117 -0.0261 0.0517 163 LEU C CA 5987 C C . LEU C 84 ? 0.6987 0.6134 0.6789 0.0160 -0.0278 0.0495 163 LEU C C 5988 O O . LEU C 84 ? 0.7011 0.6204 0.6815 0.0163 -0.0300 0.0487 163 LEU C O 5989 C CB . LEU C 84 ? 0.6690 0.5945 0.6583 0.0137 -0.0252 0.0556 163 LEU C CB 5990 C CG . LEU C 84 ? 0.6678 0.5924 0.6543 0.0201 -0.0231 0.0574 163 LEU C CG 5991 C CD1 . LEU C 84 ? 0.6177 0.5361 0.6024 0.0212 -0.0200 0.0590 163 LEU C CD1 5992 C CD2 . LEU C 84 ? 0.6954 0.6289 0.6856 0.0226 -0.0222 0.0606 163 LEU C CD2 5993 N N . GLY C 85 ? 0.7270 0.6354 0.7031 0.0191 -0.0266 0.0486 164 GLY C N 5994 C CA . GLY C 85 ? 0.6237 0.5305 0.5953 0.0223 -0.0278 0.0461 164 GLY C CA 5995 C C . GLY C 85 ? 0.8004 0.7003 0.7689 0.0214 -0.0279 0.0433 164 GLY C C 5996 O O . GLY C 85 ? 0.7818 0.6801 0.7468 0.0243 -0.0281 0.0416 164 GLY C O 5997 N N . ASP C 86 ? 0.8837 0.7798 0.8536 0.0171 -0.0275 0.0427 165 ASP C N 5998 C CA . ASP C 86 ? 0.8283 0.7166 0.7953 0.0159 -0.0268 0.0402 165 ASP C CA 5999 C C . ASP C 86 ? 0.8210 0.7037 0.7874 0.0181 -0.0233 0.0426 165 ASP C C 6000 O O . ASP C 86 ? 0.9158 0.7992 0.8847 0.0174 -0.0214 0.0458 165 ASP C O 6001 C CB . ASP C 86 ? 0.9042 0.7905 0.8719 0.0095 -0.0278 0.0378 165 ASP C CB 6002 C CG . ASP C 86 ? 1.0578 0.9483 1.0246 0.0079 -0.0313 0.0350 165 ASP C CG 6003 O OD1 . ASP C 86 ? 1.0504 0.9453 1.0165 0.0115 -0.0326 0.0354 165 ASP C OD1 6004 O OD2 . ASP C 86 ? 1.0620 0.9510 1.0282 0.0028 -0.0324 0.0325 165 ASP C OD2 6005 N N . PRO C 87 ? 0.8591 0.7365 0.8221 0.0212 -0.0221 0.0416 166 PRO C N 6006 C CA . PRO C 87 ? 0.8445 0.7156 0.8062 0.0241 -0.0184 0.0444 166 PRO C CA 6007 C C . PRO C 87 ? 0.8926 0.7545 0.8544 0.0191 -0.0157 0.0438 166 PRO C C 6008 O O . PRO C 87 ? 0.8455 0.7055 0.8070 0.0140 -0.0171 0.0401 166 PRO C O 6009 C CB . PRO C 87 ? 0.8146 0.6843 0.7732 0.0286 -0.0184 0.0429 166 PRO C CB 6010 C CG . PRO C 87 ? 0.8746 0.7444 0.8324 0.0250 -0.0211 0.0382 166 PRO C CG 6011 C CD . PRO C 87 ? 0.8628 0.7396 0.8231 0.0218 -0.0239 0.0379 166 PRO C CD 6012 N N . PRO C 88 ? 0.9077 0.7637 0.8693 0.0202 -0.0116 0.0473 167 PRO C N 6013 C CA . PRO C 88 ? 0.9007 0.7456 0.8611 0.0152 -0.0081 0.0464 167 PRO C CA 6014 C C . PRO C 88 ? 0.8576 0.6921 0.8135 0.0182 -0.0052 0.0451 167 PRO C C 6015 O O . PRO C 88 ? 0.7773 0.6025 0.7310 0.0210 -0.0003 0.0480 167 PRO C O 6016 C CB . PRO C 88 ? 0.9773 0.8196 0.9389 0.0157 -0.0042 0.0513 167 PRO C CB 6017 C CG . PRO C 88 ? 0.9483 0.7972 0.9095 0.0237 -0.0048 0.0551 167 PRO C CG 6018 C CD . PRO C 88 ? 0.8633 0.7228 0.8256 0.0247 -0.0100 0.0523 167 PRO C CD 6019 N N . THR C 89 ? 0.9630 0.7994 0.9176 0.0181 -0.0080 0.0410 168 THR C N 6020 C CA . THR C 89 ? 0.9107 0.7375 0.8613 0.0194 -0.0055 0.0386 168 THR C CA 6021 C C . THR C 89 ? 0.8362 0.6538 0.7850 0.0111 -0.0038 0.0348 168 THR C C 6022 O O . THR C 89 ? 0.8871 0.7101 0.8385 0.0044 -0.0066 0.0331 168 THR C O 6023 C CB . THR C 89 ? 1.0037 0.8373 0.9537 0.0220 -0.0092 0.0356 168 THR C CB 6024 O OG1 . THR C 89 ? 1.2061 1.0470 1.1579 0.0164 -0.0137 0.0325 168 THR C OG1 6025 C CG2 . THR C 89 ? 0.8587 0.7013 0.8097 0.0295 -0.0104 0.0389 168 THR C CG2 6026 N N . PRO C 90 ? 0.8907 0.6949 0.8351 0.0114 0.0009 0.0333 169 PRO C N 6027 C CA . PRO C 90 ? 0.9591 0.7529 0.9004 0.0029 0.0032 0.0288 169 PRO C CA 6028 C C . PRO C 90 ? 0.9293 0.7311 0.8715 -0.0040 -0.0023 0.0238 169 PRO C C 6029 O O . PRO C 90 ? 0.9771 0.7775 0.9191 -0.0128 -0.0026 0.0209 169 PRO C O 6030 C CB . PRO C 90 ? 0.8673 0.6478 0.8032 0.0071 0.0082 0.0276 169 PRO C CB 6031 C CG . PRO C 90 ? 0.9284 0.7095 0.8649 0.0175 0.0107 0.0337 169 PRO C CG 6032 C CD . PRO C 90 ? 0.8615 0.6594 0.8032 0.0202 0.0050 0.0364 169 PRO C CD 6033 N N . ASP C 91 ? 1.0114 0.8221 0.9542 0.0000 -0.0064 0.0229 170 ASP C N 6034 C CA . ASP C 91 ? 1.1048 0.9228 1.0476 -0.0050 -0.0112 0.0187 170 ASP C CA 6035 C C . ASP C 91 ? 0.9698 0.7994 0.9175 -0.0093 -0.0154 0.0200 170 ASP C C 6036 O O . ASP C 91 ? 0.8937 0.7282 0.8414 -0.0155 -0.0186 0.0170 170 ASP C O 6037 C CB . ASP C 91 ? 1.5045 1.3287 1.4469 0.0009 -0.0139 0.0181 170 ASP C CB 6038 C CG . ASP C 91 ? 1.8695 1.6854 1.8087 0.0072 -0.0097 0.0182 170 ASP C CG 6039 O OD1 . ASP C 91 ? 1.9584 1.7635 1.8958 0.0085 -0.0045 0.0199 170 ASP C OD1 6040 O OD2 . ASP C 91 ? 1.9852 1.8055 1.9237 0.0109 -0.0113 0.0170 170 ASP C OD2 6041 N N . LYS C 92 A 0.8983 0.7331 0.8500 -0.0057 -0.0153 0.0247 170 LYS C N 6042 C CA . LYS C 92 A 0.8816 0.7285 0.8381 -0.0083 -0.0190 0.0264 170 LYS C CA 6043 C C . LYS C 92 A 0.8852 0.7313 0.8445 -0.0144 -0.0170 0.0277 170 LYS C C 6044 O O . LYS C 92 A 0.8918 0.7487 0.8557 -0.0172 -0.0198 0.0291 170 LYS C O 6045 C CB . LYS C 92 A 0.8980 0.7532 0.8572 -0.0009 -0.0206 0.0301 170 LYS C CB 6046 C CG . LYS C 92 A 0.7503 0.6089 0.7074 0.0034 -0.0232 0.0283 170 LYS C CG 6047 C CD . LYS C 92 A 0.8513 0.7160 0.8083 -0.0008 -0.0272 0.0254 170 LYS C CD 6048 C CE . LYS C 92 A 0.9105 0.7783 0.8654 0.0032 -0.0293 0.0240 170 LYS C CE 6049 N NZ . LYS C 92 A 1.0062 0.8666 0.9579 0.0068 -0.0266 0.0227 170 LYS C NZ 6050 N N . LEU C 93 ? 0.9205 0.7536 0.8769 -0.0164 -0.0118 0.0274 171 LEU C N 6051 C CA . LEU C 93 ? 0.8950 0.7252 0.8534 -0.0222 -0.0087 0.0289 171 LEU C CA 6052 C C . LEU C 93 ? 0.8914 0.7244 0.8504 -0.0331 -0.0104 0.0246 171 LEU C C 6053 O O . LEU C 93 ? 1.0413 0.8672 0.9955 -0.0375 -0.0099 0.0197 171 LEU C O 6054 C CB . LEU C 93 ? 0.9006 0.7138 0.8545 -0.0207 -0.0018 0.0298 171 LEU C CB 6055 C CG . LEU C 93 ? 0.9888 0.8000 0.9439 -0.0132 0.0015 0.0360 171 LEU C CG 6056 C CD1 . LEU C 93 ? 0.9781 0.8018 0.9360 -0.0053 -0.0028 0.0388 171 LEU C CD1 6057 C CD2 . LEU C 93 ? 1.1201 0.9150 1.0695 -0.0084 0.0077 0.0371 171 LEU C CD2 6058 N N . LYS C 94 ? 0.8285 0.6728 0.7933 -0.0375 -0.0123 0.0265 172 LYS C N 6059 C CA . LYS C 94 ? 0.6973 0.5448 0.6631 -0.0489 -0.0129 0.0231 172 LYS C CA 6060 C C . LYS C 94 ? 0.7873 0.6259 0.7536 -0.0535 -0.0070 0.0246 172 LYS C C 6061 O O . LYS C 94 ? 0.9097 0.7526 0.8804 -0.0502 -0.0056 0.0297 172 LYS C O 6062 C CB . LYS C 94 ? 0.5880 0.4558 0.5606 -0.0509 -0.0188 0.0244 172 LYS C CB 6063 C CG . LYS C 94 ? 0.6750 0.5506 0.6507 -0.0627 -0.0196 0.0221 172 LYS C CG 6064 C CD . LYS C 94 ? 0.7876 0.6830 0.7676 -0.0640 -0.0265 0.0220 172 LYS C CD 6065 C CE . LYS C 94 ? 0.9051 0.8160 0.8922 -0.0721 -0.0281 0.0230 172 LYS C CE 6066 N NZ . LYS C 94 ? 1.0117 0.9414 1.0060 -0.0660 -0.0323 0.0280 172 LYS C NZ 6067 N N . PHE C 95 ? 0.7356 0.5607 0.6966 -0.0612 -0.0028 0.0203 173 PHE C N 6068 C CA . PHE C 95 ? 0.7967 0.6121 0.7574 -0.0675 0.0034 0.0210 173 PHE C CA 6069 C C . PHE C 95 ? 0.8102 0.6415 0.7778 -0.0769 0.0006 0.0209 173 PHE C C 6070 O O . PHE C 95 ? 0.7770 0.6215 0.7468 -0.0825 -0.0049 0.0176 173 PHE C O 6071 C CB . PHE C 95 ? 0.8042 0.5994 0.7563 -0.0735 0.0091 0.0158 173 PHE C CB 6072 C CG . PHE C 95 ? 0.9286 0.7137 0.8796 -0.0830 0.0154 0.0150 173 PHE C CG 6073 C CD1 . PHE C 95 ? 0.9904 0.7628 0.9403 -0.0784 0.0223 0.0200 173 PHE C CD1 6074 C CD2 . PHE C 95 ? 1.0571 0.8453 1.0078 -0.0968 0.0148 0.0093 173 PHE C CD2 6075 C CE1 . PHE C 95 ? 0.8163 0.5779 0.7647 -0.0875 0.0288 0.0194 173 PHE C CE1 6076 C CE2 . PHE C 95 ? 1.0680 0.8464 1.0174 -0.1067 0.0211 0.0081 173 PHE C CE2 6077 C CZ . PHE C 95 ? 0.9308 0.6952 0.8790 -0.1019 0.0284 0.0133 173 PHE C CZ 6078 N N . GLU C 96 ? 0.9495 0.7805 0.9209 -0.0785 0.0045 0.0249 174 GLU C N 6079 C CA . GLU C 96 ? 0.8764 0.7259 0.8560 -0.0853 0.0016 0.0261 174 GLU C CA 6080 C C . GLU C 96 ? 0.9502 0.7939 0.9302 -0.0974 0.0070 0.0245 174 GLU C C 6081 O O . GLU C 96 ? 0.9507 0.8074 0.9347 -0.1082 0.0043 0.0214 174 GLU C O 6082 C CB . GLU C 96 ? 0.7687 0.6303 0.7549 -0.0757 -0.0003 0.0330 174 GLU C CB 6083 C CG . GLU C 96 ? 0.8574 0.7299 0.8448 -0.0664 -0.0066 0.0340 174 GLU C CG 6084 C CD . GLU C 96 ? 1.0013 0.8945 0.9945 -0.0708 -0.0133 0.0326 174 GLU C CD 6085 O OE1 . GLU C 96 ? 0.9532 0.8535 0.9494 -0.0817 -0.0135 0.0302 174 GLU C OE1 6086 O OE2 . GLU C 96 ? 0.8989 0.8018 0.8936 -0.0633 -0.0180 0.0341 174 GLU C OE2 6087 N N . ALA C 97 ? 0.9974 0.8222 0.9730 -0.0958 0.0147 0.0266 175 ALA C N 6088 C CA . ALA C 97 ? 1.0009 0.8181 0.9765 -0.1066 0.0211 0.0259 175 ALA C CA 6089 C C . ALA C 97 ? 0.9277 0.7198 0.8959 -0.1021 0.0301 0.0285 175 ALA C C 6090 O O . ALA C 97 ? 0.9551 0.7388 0.9195 -0.0901 0.0308 0.0315 175 ALA C O 6091 C CB . ALA C 97 ? 0.9501 0.7867 0.9358 -0.1090 0.0195 0.0304 175 ALA C CB 6092 N N . VAL C 98 ? 1.0124 0.7931 0.9787 -0.1120 0.0372 0.0275 176 VAL C N 6093 C CA . VAL C 98 ? 1.0041 0.7619 0.9642 -0.1077 0.0467 0.0314 176 VAL C CA 6094 C C . VAL C 98 ? 0.9966 0.7629 0.9632 -0.1055 0.0485 0.0385 176 VAL C C 6095 O O . VAL C 98 ? 1.0610 0.8416 1.0346 -0.1152 0.0472 0.0378 176 VAL C O 6096 C CB . VAL C 98 ? 0.9510 0.6879 0.9036 -0.1203 0.0548 0.0260 176 VAL C CB 6097 C CG1 . VAL C 98 ? 1.0153 0.7244 0.9588 -0.1130 0.0647 0.0298 176 VAL C CG1 6098 C CG2 . VAL C 98 ? 0.9495 0.6853 0.8977 -0.1274 0.0513 0.0174 176 VAL C CG2 6099 N N . GLY C 99 ? 0.9574 0.7165 0.9220 -0.0926 0.0514 0.0453 177 GLY C N 6100 C CA . GLY C 99 ? 0.9306 0.6959 0.9000 -0.0897 0.0539 0.0523 177 GLY C CA 6101 C C . GLY C 99 ? 0.9536 0.7166 0.9211 -0.0738 0.0543 0.0594 177 GLY C C 6102 O O . GLY C 99 ? 1.0701 0.8290 1.0334 -0.0646 0.0518 0.0590 177 GLY C O 6103 N N . TRP C 100 ? 0.9722 0.7385 0.9425 -0.0709 0.0575 0.0659 178 TRP C N 6104 C CA . TRP C 100 ? 1.0360 0.8034 1.0049 -0.0564 0.0575 0.0730 178 TRP C CA 6105 C C . TRP C 100 ? 0.9865 0.7776 0.9641 -0.0534 0.0514 0.0757 178 TRP C C 6106 O O . TRP C 100 ? 1.1548 0.9510 1.1320 -0.0422 0.0499 0.0806 178 TRP C O 6107 C CB . TRP C 100 ? 1.1102 0.8599 1.0735 -0.0535 0.0671 0.0792 178 TRP C CB 6108 C CG . TRP C 100 ? 1.3315 1.0638 1.2912 -0.0655 0.0754 0.0768 178 TRP C CG 6109 C CD1 . TRP C 100 ? 1.4071 1.1451 1.3720 -0.0787 0.0774 0.0750 178 TRP C CD1 6110 C CD2 . TRP C 100 ? 1.5755 1.2811 1.5252 -0.0657 0.0835 0.0760 178 TRP C CD2 6111 N NE1 . TRP C 100 ? 1.6131 1.3291 1.5715 -0.0880 0.0861 0.0726 178 TRP C NE1 6112 C CE2 . TRP C 100 ? 1.7440 1.4389 1.6927 -0.0799 0.0903 0.0732 178 TRP C CE2 6113 C CE3 . TRP C 100 ? 1.3790 1.0689 1.3205 -0.0550 0.0859 0.0775 178 TRP C CE3 6114 C CZ2 . TRP C 100 ? 1.7574 1.4247 1.6964 -0.0839 0.0999 0.0716 178 TRP C CZ2 6115 C CZ3 . TRP C 100 ? 1.3284 0.9918 1.2608 -0.0580 0.0953 0.0764 178 TRP C CZ3 6116 C CH2 . TRP C 100 ? 1.5614 1.2127 1.4921 -0.0723 0.1024 0.0734 178 TRP C CH2 6117 N N . SER C 101 ? 0.9079 0.7139 0.8931 -0.0636 0.0483 0.0726 179 SER C N 6118 C CA . SER C 101 ? 0.8801 0.7080 0.8738 -0.0613 0.0439 0.0756 179 SER C CA 6119 C C . SER C 101 ? 0.8510 0.6973 0.8521 -0.0691 0.0370 0.0704 179 SER C C 6120 O O . SER C 101 ? 0.7987 0.6449 0.8016 -0.0815 0.0381 0.0660 179 SER C O 6121 C CB . SER C 101 ? 0.6838 0.5113 0.6801 -0.0648 0.0504 0.0807 179 SER C CB 6122 O OG . SER C 101 ? 0.8486 0.6984 0.8540 -0.0646 0.0468 0.0830 179 SER C OG 6123 N N . ALA C 102 ? 0.7853 0.6475 0.7903 -0.0619 0.0300 0.0708 180 ALA C N 6124 C CA . ALA C 102 ? 0.7647 0.6443 0.7760 -0.0674 0.0232 0.0666 180 ALA C CA 6125 C C . ALA C 102 ? 0.7560 0.6568 0.7747 -0.0613 0.0185 0.0698 180 ALA C C 6126 O O . ALA C 102 ? 0.9029 0.8039 0.9201 -0.0507 0.0184 0.0739 180 ALA C O 6127 C CB . ALA C 102 ? 0.6463 0.5198 0.6523 -0.0665 0.0190 0.0611 180 ALA C CB 6128 N N . SER C 103 ? 0.7712 0.6898 0.7977 -0.0684 0.0147 0.0680 181 SER C N 6129 C CA . SER C 103 ? 0.7917 0.7308 0.8250 -0.0628 0.0094 0.0701 181 SER C CA 6130 C C . SER C 103 ? 0.7523 0.7007 0.7871 -0.0672 0.0029 0.0650 181 SER C C 6131 O O . SER C 103 ? 0.6999 0.6456 0.7340 -0.0780 0.0030 0.0605 181 SER C O 6132 C CB . SER C 103 ? 0.6903 0.6448 0.7326 -0.0668 0.0116 0.0739 181 SER C CB 6133 O OG . SER C 103 ? 0.8356 0.8086 0.8840 -0.0598 0.0076 0.0768 181 SER C OG 6134 N N . SER C 104 ? 0.6866 0.6448 0.7225 -0.0591 -0.0024 0.0656 182 SER C N 6135 C CA . SER C 104 ? 0.7258 0.6954 0.7638 -0.0629 -0.0086 0.0618 182 SER C CA 6136 C C . SER C 104 ? 0.6623 0.6529 0.7074 -0.0571 -0.0129 0.0650 182 SER C C 6137 O O . SER C 104 ? 0.8178 0.8110 0.8643 -0.0483 -0.0115 0.0695 182 SER C O 6138 C CB . SER C 104 ? 0.8110 0.7671 0.8404 -0.0600 -0.0110 0.0575 182 SER C CB 6139 O OG . SER C 104 ? 0.8101 0.7629 0.8364 -0.0480 -0.0121 0.0599 182 SER C OG 6140 N N . CYS C 105 ? 0.7347 0.7399 0.7837 -0.0620 -0.0179 0.0628 183 CYS C N 6141 C CA . CYS C 105 ? 0.7137 0.7393 0.7692 -0.0564 -0.0221 0.0661 183 CYS C CA 6142 C C . CYS C 105 ? 0.7624 0.7962 0.8172 -0.0602 -0.0281 0.0623 183 CYS C C 6143 O O . CYS C 105 ? 0.7990 0.8260 0.8500 -0.0694 -0.0286 0.0572 183 CYS C O 6144 C CB . CYS C 105 ? 0.5497 0.5945 0.6157 -0.0585 -0.0206 0.0705 183 CYS C CB 6145 S SG . CYS C 105 ? 0.8954 0.9362 0.9644 -0.0703 -0.0145 0.0702 183 CYS C SG 6146 N N . HIS C 106 ? 0.7097 0.7573 0.7673 -0.0531 -0.0322 0.0649 184 HIS C N 6147 C CA . HIS C 106 ? 0.7590 0.8159 0.8157 -0.0560 -0.0380 0.0622 184 HIS C CA 6148 C C . HIS C 106 ? 0.7747 0.8578 0.8406 -0.0537 -0.0413 0.0667 184 HIS C C 6149 O O . HIS C 106 ? 0.7910 0.8799 0.8601 -0.0436 -0.0403 0.0718 184 HIS C O 6150 C CB . HIS C 106 ? 0.7764 0.8194 0.8242 -0.0484 -0.0397 0.0603 184 HIS C CB 6151 C CG . HIS C 106 ? 0.8459 0.8942 0.8907 -0.0519 -0.0450 0.0568 184 HIS C CG 6152 N ND1 . HIS C 106 ? 0.8694 0.9374 0.9188 -0.0494 -0.0493 0.0597 184 HIS C ND1 6153 C CD2 . HIS C 106 ? 0.8013 0.8373 0.8385 -0.0572 -0.0462 0.0511 184 HIS C CD2 6154 C CE1 . HIS C 106 ? 0.8730 0.9413 0.9175 -0.0534 -0.0534 0.0557 184 HIS C CE1 6155 N NE2 . HIS C 106 ? 0.7878 0.8368 0.8249 -0.0584 -0.0515 0.0503 184 HIS C NE2 6156 N N . ASP C 107 ? 0.7271 0.8262 0.7969 -0.0628 -0.0452 0.0647 185 ASP C N 6157 C CA . ASP C 107 ? 0.7263 0.8533 0.8063 -0.0617 -0.0481 0.0695 185 ASP C CA 6158 C C . ASP C 107 ? 0.8242 0.9620 0.9027 -0.0558 -0.0537 0.0708 185 ASP C C 6159 O O . ASP C 107 ? 0.8577 1.0191 0.9440 -0.0534 -0.0563 0.0753 185 ASP C O 6160 C CB . ASP C 107 ? 0.6001 0.7435 0.6872 -0.0758 -0.0490 0.0675 185 ASP C CB 6161 C CG . ASP C 107 ? 0.7653 0.9040 0.8462 -0.0875 -0.0522 0.0602 185 ASP C CG 6162 O OD1 . ASP C 107 ? 0.6353 0.7619 0.7075 -0.0838 -0.0545 0.0574 185 ASP C OD1 6163 O OD2 . ASP C 107 ? 0.9353 1.0827 1.0200 -0.1007 -0.0521 0.0571 185 ASP C OD2 6164 N N . GLY C 108 ? 0.8107 0.9315 0.8792 -0.0532 -0.0551 0.0672 186 GLY C N 6165 C CA . GLY C 108 ? 0.8868 1.0152 0.9524 -0.0482 -0.0599 0.0681 186 GLY C CA 6166 C C . GLY C 108 ? 0.8508 0.9771 0.9106 -0.0584 -0.0637 0.0617 186 GLY C C 6167 O O . GLY C 108 ? 0.6589 0.7809 0.7119 -0.0550 -0.0667 0.0603 186 GLY C O 6168 N N . PHE C 109 ? 0.7681 0.8964 0.8300 -0.0713 -0.0631 0.0575 187 PHE C N 6169 C CA . PHE C 109 ? 0.7188 0.8435 0.7746 -0.0828 -0.0658 0.0504 187 PHE C CA 6170 C C . PHE C 109 ? 0.8230 0.9190 0.8698 -0.0866 -0.0614 0.0446 187 PHE C C 6171 O O . PHE C 109 ? 0.8173 0.8984 0.8550 -0.0847 -0.0621 0.0410 187 PHE C O 6172 C CB . PHE C 109 ? 0.6217 0.7681 0.6849 -0.0958 -0.0679 0.0490 187 PHE C CB 6173 C CG . PHE C 109 ? 0.8848 1.0612 0.9587 -0.0913 -0.0713 0.0559 187 PHE C CG 6174 C CD1 . PHE C 109 ? 0.9945 1.1845 1.0676 -0.0840 -0.0764 0.0591 187 PHE C CD1 6175 C CD2 . PHE C 109 ? 0.8724 1.0635 0.9571 -0.0935 -0.0689 0.0596 187 PHE C CD2 6176 C CE1 . PHE C 109 ? 0.9333 1.1511 1.0162 -0.0784 -0.0791 0.0662 187 PHE C CE1 6177 C CE2 . PHE C 109 ? 0.8376 1.0572 0.9327 -0.0883 -0.0717 0.0664 187 PHE C CE2 6178 C CZ . PHE C 109 ? 0.8803 1.1134 0.9745 -0.0804 -0.0768 0.0699 187 PHE C CZ 6179 N N . GLN C 110 ? 0.9171 1.0054 0.9666 -0.0915 -0.0564 0.0440 188 GLN C N 6180 C CA . GLN C 110 ? 0.9290 0.9902 0.9703 -0.0943 -0.0515 0.0394 188 GLN C CA 6181 C C . GLN C 110 ? 0.8962 0.9450 0.9393 -0.0889 -0.0455 0.0428 188 GLN C C 6182 O O . GLN C 110 ? 0.8317 0.8934 0.8832 -0.0857 -0.0443 0.0481 188 GLN C O 6183 C CB . GLN C 110 ? 0.9705 1.0288 1.0090 -0.1099 -0.0508 0.0325 188 GLN C CB 6184 C CG . GLN C 110 ? 1.0608 1.1013 1.0880 -0.1128 -0.0513 0.0260 188 GLN C CG 6185 C CD . GLN C 110 ? 1.0826 1.1384 1.1081 -0.1156 -0.0579 0.0239 188 GLN C CD 6186 O OE1 . GLN C 110 ? 1.0122 1.0927 1.0449 -0.1196 -0.0620 0.0259 188 GLN C OE1 6187 N NE2 . GLN C 110 ? 1.1847 1.2268 1.2006 -0.1132 -0.0589 0.0202 188 GLN C NE2 6188 N N . TRP C 111 ? 0.6552 0.6794 0.6901 -0.0876 -0.0415 0.0399 189 TRP C N 6189 C CA . TRP C 111 ? 0.6390 0.6499 0.6742 -0.0846 -0.0354 0.0424 189 TRP C CA 6190 C C . TRP C 111 ? 0.7514 0.7620 0.7897 -0.0965 -0.0313 0.0408 189 TRP C C 6191 O O . TRP C 111 ? 0.8367 0.8391 0.8703 -0.1074 -0.0303 0.0349 189 TRP C O 6192 C CB . TRP C 111 ? 0.6285 0.6142 0.6539 -0.0793 -0.0323 0.0401 189 TRP C CB 6193 C CG . TRP C 111 ? 0.7904 0.7744 0.8135 -0.0667 -0.0343 0.0428 189 TRP C CG 6194 C CD1 . TRP C 111 ? 0.7425 0.7229 0.7599 -0.0632 -0.0378 0.0402 189 TRP C CD1 6195 C CD2 . TRP C 111 ? 0.8226 0.8079 0.8484 -0.0562 -0.0327 0.0483 189 TRP C CD2 6196 N NE1 . TRP C 111 ? 0.8070 0.7864 0.8236 -0.0517 -0.0383 0.0437 189 TRP C NE1 6197 C CE2 . TRP C 111 ? 0.8492 0.8314 0.8707 -0.0472 -0.0353 0.0485 189 TRP C CE2 6198 C CE3 . TRP C 111 ? 0.7830 0.7716 0.8141 -0.0539 -0.0291 0.0529 189 TRP C CE3 6199 C CZ2 . TRP C 111 ? 0.6921 0.6740 0.7141 -0.0366 -0.0343 0.0527 189 TRP C CZ2 6200 C CZ3 . TRP C 111 ? 0.8998 0.8885 0.9313 -0.0428 -0.0282 0.0572 189 TRP C CZ3 6201 C CH2 . TRP C 111 ? 0.8080 0.7932 0.8348 -0.0345 -0.0308 0.0569 189 TRP C CH2 6202 N N . THR C 112 ? 0.7601 0.7789 0.8059 -0.0948 -0.0285 0.0458 190 THR C N 6203 C CA . THR C 112 ? 0.7672 0.7817 0.8153 -0.1043 -0.0231 0.0453 190 THR C CA 6204 C C . THR C 112 ? 0.8376 0.8284 0.8797 -0.0984 -0.0166 0.0470 190 THR C C 6205 O O . THR C 112 ? 0.7081 0.6970 0.7505 -0.0866 -0.0159 0.0517 190 THR C O 6206 C CB . THR C 112 ? 0.7288 0.7664 0.7886 -0.1060 -0.0232 0.0501 190 THR C CB 6207 O OG1 . THR C 112 ? 0.8141 0.8760 0.8798 -0.1096 -0.0296 0.0496 190 THR C OG1 6208 C CG2 . THR C 112 ? 0.6213 0.6543 0.6832 -0.1174 -0.0173 0.0490 190 THR C CG2 6209 N N . VAL C 113 ? 0.8140 0.7865 0.8502 -0.1065 -0.0116 0.0431 191 VAL C N 6210 C CA . VAL C 113 ? 0.7374 0.6876 0.7676 -0.1010 -0.0052 0.0451 191 VAL C CA 6211 C C . VAL C 113 ? 0.8690 0.8122 0.9003 -0.1106 0.0017 0.0454 191 VAL C C 6212 O O . VAL C 113 ? 0.8647 0.8009 0.8929 -0.1228 0.0039 0.0401 191 VAL C O 6213 C CB . VAL C 113 ? 0.6810 0.6098 0.7004 -0.0987 -0.0044 0.0408 191 VAL C CB 6214 C CG1 . VAL C 113 ? 0.6038 0.5102 0.6171 -0.0935 0.0027 0.0432 191 VAL C CG1 6215 C CG2 . VAL C 113 ? 0.6445 0.5788 0.6624 -0.0888 -0.0105 0.0409 191 VAL C CG2 6216 N N . LEU C 114 ? 0.8708 0.8155 0.9060 -0.1055 0.0055 0.0514 192 LEU C N 6217 C CA . LEU C 114 ? 0.8148 0.7495 0.8498 -0.1132 0.0132 0.0523 192 LEU C CA 6218 C C . LEU C 114 ? 0.9037 0.8114 0.9288 -0.1071 0.0194 0.0536 192 LEU C C 6219 O O . LEU C 114 ? 0.8594 0.7637 0.8828 -0.0944 0.0194 0.0582 192 LEU C O 6220 C CB . LEU C 114 ? 0.6565 0.6077 0.7010 -0.1121 0.0147 0.0583 192 LEU C CB 6221 C CG . LEU C 114 ? 0.8435 0.8232 0.8986 -0.1183 0.0091 0.0576 192 LEU C CG 6222 C CD1 . LEU C 114 ? 0.8129 0.8083 0.8720 -0.1056 0.0029 0.0611 192 LEU C CD1 6223 C CD2 . LEU C 114 ? 0.8437 0.8352 0.9072 -0.1264 0.0133 0.0604 192 LEU C CD2 6224 N N . SER C 115 ? 0.9258 0.8147 0.9443 -0.1160 0.0248 0.0496 193 SER C N 6225 C CA . SER C 115 ? 0.8624 0.7248 0.8709 -0.1101 0.0311 0.0508 193 SER C CA 6226 C C . SER C 115 ? 0.8629 0.7095 0.8686 -0.1187 0.0405 0.0515 193 SER C C 6227 O O . SER C 115 ? 0.8882 0.7330 0.8939 -0.1328 0.0427 0.0465 193 SER C O 6228 C CB . SER C 115 ? 0.9457 0.7950 0.9460 -0.1098 0.0292 0.0449 193 SER C CB 6229 O OG . SER C 115 ? 1.0148 0.8402 1.0059 -0.1021 0.0350 0.0468 193 SER C OG 6230 N N . VAL C 116 ? 0.8560 0.6913 0.8588 -0.1102 0.0461 0.0579 194 VAL C N 6231 C CA . VAL C 116 ? 0.8737 0.6907 0.8723 -0.1161 0.0561 0.0598 194 VAL C CA 6232 C C . VAL C 116 ? 0.8771 0.6654 0.8637 -0.1151 0.0620 0.0573 194 VAL C C 6233 O O . VAL C 116 ? 0.9010 0.6808 0.8821 -0.1028 0.0609 0.0592 194 VAL C O 6234 C CB . VAL C 116 ? 0.8859 0.7027 0.8857 -0.1065 0.0601 0.0685 194 VAL C CB 6235 C CG1 . VAL C 116 ? 0.7399 0.5353 0.7340 -0.1119 0.0712 0.0710 194 VAL C CG1 6236 C CG2 . VAL C 116 ? 0.8446 0.6884 0.8559 -0.1069 0.0557 0.0714 194 VAL C CG2 6237 N N . ALA C 117 ? 0.8644 0.6379 0.8467 -0.1281 0.0686 0.0531 195 ALA C N 6238 C CA . ALA C 117 ? 0.9037 0.6488 0.8743 -0.1284 0.0751 0.0502 195 ALA C CA 6239 C C . ALA C 117 ? 1.1552 0.8802 1.1209 -0.1383 0.0864 0.0506 195 ALA C C 6240 O O . ALA C 117 ? 1.1800 0.9147 1.1520 -0.1453 0.0886 0.0531 195 ALA C O 6241 C CB . ALA C 117 ? 0.8799 0.6260 0.8480 -0.1357 0.0703 0.0412 195 ALA C CB 6242 N N . GLY C 118 ? 1.3210 1.0176 1.2753 -0.1389 0.0941 0.0484 196 GLY C N 6243 C CA . GLY C 118 ? 1.3868 1.0600 1.3345 -0.1487 0.1059 0.0481 196 GLY C CA 6244 C C . GLY C 118 ? 1.4791 1.1485 1.4279 -0.1433 0.1124 0.0574 196 GLY C C 6245 O O . GLY C 118 ? 1.5849 1.2497 1.5311 -0.1274 0.1131 0.0648 196 GLY C O 6246 N N . ASP C 119 ? 1.5345 1.2067 1.4872 -0.1568 0.1171 0.0568 200 ASP C N 6247 C CA . ASP C 119 ? 1.5991 1.2686 1.5532 -0.1536 0.1237 0.0653 200 ASP C CA 6248 C C . ASP C 119 ? 1.3967 1.0987 1.3639 -0.1503 0.1155 0.0693 200 ASP C C 6249 O O . ASP C 119 ? 1.2606 0.9658 1.2308 -0.1487 0.1199 0.0761 200 ASP C O 6250 C CB . ASP C 119 ? 1.7112 1.3637 1.6616 -0.1704 0.1347 0.0628 200 ASP C CB 6251 C CG . ASP C 119 ? 1.7262 1.3895 1.6808 -0.1898 0.1314 0.0523 200 ASP C CG 6252 O OD1 . ASP C 119 ? 1.5313 1.2256 1.4973 -0.1927 0.1210 0.0500 200 ASP C OD1 6253 O OD2 . ASP C 119 ? 1.8168 1.4572 1.7628 -0.2020 0.1395 0.0464 200 ASP C OD2 6254 N N . GLY C 120 ? 1.1099 0.8353 1.0843 -0.1490 0.1041 0.0653 201 GLY C N 6255 C CA . GLY C 120 ? 1.0994 0.8555 1.0858 -0.1452 0.0961 0.0686 201 GLY C CA 6256 C C . GLY C 120 ? 1.2318 1.0129 1.2289 -0.1595 0.0904 0.0629 201 GLY C C 6257 O O . GLY C 120 ? 1.3706 1.1724 1.3775 -0.1613 0.0888 0.0664 201 GLY C O 6258 N N . PHE C 121 ? 1.1232 0.9034 1.1184 -0.1695 0.0874 0.0544 202 PHE C N 6259 C CA . PHE C 121 ? 0.9504 0.7588 0.9560 -0.1802 0.0795 0.0493 202 PHE C CA 6260 C C . PHE C 121 ? 0.9175 0.7435 0.9267 -0.1688 0.0683 0.0491 202 PHE C C 6261 O O . PHE C 121 ? 0.9332 0.7462 0.9353 -0.1565 0.0672 0.0501 202 PHE C O 6262 C CB . PHE C 121 ? 0.9229 0.7235 0.9245 -0.1981 0.0817 0.0399 202 PHE C CB 6263 C CG . PHE C 121 ? 0.9696 0.7489 0.9597 -0.1952 0.0818 0.0347 202 PHE C CG 6264 C CD1 . PHE C 121 ? 0.9555 0.7008 0.9332 -0.1931 0.0919 0.0352 202 PHE C CD1 6265 C CD2 . PHE C 121 ? 0.9209 0.7139 0.9125 -0.1938 0.0721 0.0296 202 PHE C CD2 6266 C CE1 . PHE C 121 ? 1.0171 0.7431 0.9844 -0.1898 0.0924 0.0306 202 PHE C CE1 6267 C CE2 . PHE C 121 ? 0.9553 0.7291 0.9364 -0.1909 0.0725 0.0249 202 PHE C CE2 6268 C CZ . PHE C 121 ? 1.0322 0.7727 1.0013 -0.1889 0.0827 0.0253 202 PHE C CZ 6269 N N . VAL C 122 ? 0.8364 0.6921 0.8566 -0.1726 0.0604 0.0479 203 VAL C N 6270 C CA . VAL C 122 ? 0.9102 0.7820 0.9335 -0.1625 0.0504 0.0477 203 VAL C CA 6271 C C . VAL C 122 ? 0.9545 0.8353 0.9779 -0.1727 0.0444 0.0394 203 VAL C C 6272 O O . VAL C 122 ? 0.9436 0.8413 0.9738 -0.1862 0.0429 0.0360 203 VAL C O 6273 C CB . VAL C 122 ? 0.9011 0.8003 0.9361 -0.1554 0.0453 0.0536 203 VAL C CB 6274 C CG1 . VAL C 122 ? 0.8943 0.8116 0.9328 -0.1479 0.0351 0.0523 203 VAL C CG1 6275 C CG2 . VAL C 122 ? 0.9088 0.7985 0.9418 -0.1426 0.0501 0.0616 203 VAL C CG2 6276 N N . SER C 123 ? 0.9366 0.8068 0.9526 -0.1665 0.0411 0.0361 204 SER C N 6277 C CA . SER C 123 ? 0.8685 0.7487 0.8841 -0.1742 0.0346 0.0288 204 SER C CA 6278 C C . SER C 123 ? 0.9232 0.8289 0.9466 -0.1643 0.0246 0.0315 204 SER C C 6279 O O . SER C 123 ? 0.9330 0.8377 0.9565 -0.1494 0.0231 0.0370 204 SER C O 6280 C CB . SER C 123 ? 0.8208 0.6750 0.8236 -0.1740 0.0371 0.0233 204 SER C CB 6281 O OG . SER C 123 ? 1.0311 0.8723 1.0287 -0.1575 0.0373 0.0275 204 SER C OG 6282 N N . ILE C 124 ? 0.9555 0.8844 0.9852 -0.1728 0.0180 0.0279 205 ILE C N 6283 C CA . ILE C 124 ? 0.8777 0.8299 0.9138 -0.1637 0.0089 0.0303 205 ILE C CA 6284 C C . ILE C 124 ? 0.8428 0.7943 0.8729 -0.1651 0.0031 0.0242 205 ILE C C 6285 O O . ILE C 124 ? 0.8566 0.8102 0.8846 -0.1788 0.0024 0.0174 205 ILE C O 6286 C CB . ILE C 124 ? 0.6999 0.6839 0.7492 -0.1688 0.0049 0.0330 205 ILE C CB 6287 C CG1 . ILE C 124 ? 0.6877 0.6717 0.7426 -0.1686 0.0115 0.0387 205 ILE C CG1 6288 C CG2 . ILE C 124 ? 0.6547 0.6603 0.7099 -0.1572 -0.0035 0.0366 205 ILE C CG2 6289 C CD1 . ILE C 124 ? 0.6247 0.6402 0.6933 -0.1724 0.0085 0.0422 205 ILE C CD1 6290 N N . LEU C 125 ? 0.8741 0.8223 0.9011 -0.1513 -0.0007 0.0262 206 LEU C N 6291 C CA . LEU C 125 ? 0.8827 0.8310 0.9042 -0.1512 -0.0062 0.0211 206 LEU C CA 6292 C C . LEU C 125 ? 0.9533 0.9270 0.9818 -0.1437 -0.0148 0.0242 206 LEU C C 6293 O O . LEU C 125 ? 0.9930 0.9722 1.0256 -0.1312 -0.0159 0.0305 206 LEU C O 6294 C CB . LEU C 125 ? 0.7295 0.6509 0.7399 -0.1431 -0.0030 0.0197 206 LEU C CB 6295 C CG . LEU C 125 ? 0.8639 0.7578 0.8657 -0.1495 0.0059 0.0165 206 LEU C CG 6296 C CD1 . LEU C 125 ? 1.0350 0.9177 1.0377 -0.1414 0.0123 0.0232 206 LEU C CD1 6297 C CD2 . LEU C 125 ? 0.6601 0.5336 0.6507 -0.1471 0.0069 0.0116 206 LEU C CD2 6298 N N . TYR C 126 ? 0.9062 0.8948 0.9354 -0.1517 -0.0205 0.0197 207 TYR C N 6299 C CA . TYR C 126 ? 0.8755 0.8876 0.9102 -0.1452 -0.0285 0.0225 207 TYR C CA 6300 C C . TYR C 126 ? 0.9429 0.9485 0.9688 -0.1450 -0.0324 0.0172 207 TYR C C 6301 O O . TYR C 126 ? 1.0024 1.0057 1.0235 -0.1572 -0.0328 0.0104 207 TYR C O 6302 C CB . TYR C 126 ? 0.8331 0.8737 0.8778 -0.1550 -0.0320 0.0228 207 TYR C CB 6303 C CG . TYR C 126 ? 0.8149 0.8815 0.8670 -0.1466 -0.0392 0.0278 207 TYR C CG 6304 C CD1 . TYR C 126 ? 0.5949 0.6699 0.6543 -0.1343 -0.0388 0.0355 207 TYR C CD1 6305 C CD2 . TYR C 126 ? 0.8094 0.8920 0.8609 -0.1506 -0.0460 0.0248 207 TYR C CD2 6306 C CE1 . TYR C 126 ? 0.7720 0.8696 0.8377 -0.1260 -0.0446 0.0404 207 TYR C CE1 6307 C CE2 . TYR C 126 ? 0.8469 0.9530 0.9048 -0.1420 -0.0521 0.0301 207 TYR C CE2 6308 C CZ . TYR C 126 ? 0.9367 1.0496 1.0017 -0.1295 -0.0511 0.0379 207 TYR C CZ 6309 O OH . TYR C 126 ? 0.8828 1.0175 0.9537 -0.1203 -0.0563 0.0434 207 TYR C OH 6310 N N . GLY C 127 ? 1.0103 1.0129 1.0337 -0.1316 -0.0352 0.0201 208 GLY C N 6311 C CA . GLY C 127 ? 0.5238 0.5109 0.5368 -0.1298 -0.0362 0.0153 208 GLY C CA 6312 C C . GLY C 127 ? 1.2290 1.1881 1.2347 -0.1315 -0.0285 0.0127 208 GLY C C 6313 O O . GLY C 127 ? 1.3237 1.2745 1.3316 -0.1253 -0.0239 0.0172 208 GLY C O 6314 N N . GLY C 128 ? 1.0984 1.0426 1.0950 -0.1396 -0.0265 0.0056 209 GLY C N 6315 C CA . GLY C 128 ? 1.0738 0.9916 1.0636 -0.1424 -0.0183 0.0032 209 GLY C CA 6316 C C . GLY C 128 ? 1.0202 0.9367 1.0101 -0.1584 -0.0144 -0.0011 209 GLY C C 6317 O O . GLY C 128 ? 0.9969 0.8902 0.9794 -0.1633 -0.0070 -0.0045 209 GLY C O 6318 N N . ILE C 129 ? 1.0004 0.9421 0.9986 -0.1663 -0.0189 -0.0009 210 ILE C N 6319 C CA . ILE C 129 ? 0.9106 0.8563 0.9095 -0.1837 -0.0166 -0.0060 210 ILE C CA 6320 C C . ILE C 129 ? 0.9696 0.9174 0.9760 -0.1866 -0.0115 -0.0017 210 ILE C C 6321 O O . ILE C 129 ? 1.0530 1.0195 1.0695 -0.1796 -0.0143 0.0051 210 ILE C O 6322 C CB . ILE C 129 ? 0.8994 0.8752 0.9039 -0.1917 -0.0249 -0.0082 210 ILE C CB 6323 C CG1 . ILE C 129 ? 0.9839 0.9610 0.9818 -0.1875 -0.0308 -0.0114 210 ILE C CG1 6324 C CG2 . ILE C 129 ? 0.8392 0.8196 0.8436 -0.2112 -0.0228 -0.0146 210 ILE C CG2 6325 C CD1 . ILE C 129 ? 0.9412 0.8938 0.9258 -0.1946 -0.0267 -0.0197 210 ILE C CD1 6326 N N . ILE C 130 ? 0.7900 0.7181 0.7909 -0.1970 -0.0035 -0.0056 211 ILE C N 6327 C CA . ILE C 130 ? 0.9508 0.8806 0.9582 -0.2023 0.0020 -0.0022 211 ILE C CA 6328 C C . ILE C 130 ? 0.8551 0.8165 0.8731 -0.2137 -0.0031 -0.0030 211 ILE C C 6329 O O . ILE C 130 ? 0.8863 0.8553 0.9018 -0.2273 -0.0057 -0.0100 211 ILE C O 6330 C CB . ILE C 130 ? 1.0341 0.9345 1.0322 -0.2119 0.0123 -0.0067 211 ILE C CB 6331 C CG1 . ILE C 130 ? 1.0646 0.9362 1.0540 -0.1983 0.0178 -0.0039 211 ILE C CG1 6332 C CG2 . ILE C 130 ? 1.0238 0.9282 1.0286 -0.2203 0.0178 -0.0040 211 ILE C CG2 6333 C CD1 . ILE C 130 ? 1.2444 1.0848 1.2221 -0.2063 0.0275 -0.0091 211 ILE C CD1 6334 N N . THR C 131 ? 0.6511 0.6318 0.6806 -0.2082 -0.0046 0.0044 212 THR C N 6335 C CA . THR C 131 ? 0.6978 0.7124 0.7387 -0.2162 -0.0105 0.0049 212 THR C CA 6336 C C . THR C 131 ? 0.9087 0.9305 0.9579 -0.2239 -0.0051 0.0078 212 THR C C 6337 O O . THR C 131 ? 0.9395 0.9872 0.9976 -0.2351 -0.0081 0.0068 212 THR C O 6338 C CB . THR C 131 ? 0.7159 0.7549 0.7646 -0.2023 -0.0189 0.0112 212 THR C CB 6339 O OG1 . THR C 131 ? 0.9434 0.9734 0.9938 -0.1863 -0.0163 0.0187 212 THR C OG1 6340 C CG2 . THR C 131 ? 0.5897 0.6270 0.6309 -0.1985 -0.0250 0.0073 212 THR C CG2 6341 N N . ASP C 132 ? 0.8236 0.8231 0.8700 -0.2180 0.0028 0.0116 213 ASP C N 6342 C CA . ASP C 132 ? 0.9293 0.9314 0.9820 -0.2252 0.0091 0.0145 213 ASP C CA 6343 C C . ASP C 132 ? 0.9976 0.9665 1.0421 -0.2204 0.0189 0.0166 213 ASP C C 6344 O O . ASP C 132 ? 0.9316 0.8787 0.9669 -0.2095 0.0201 0.0170 213 ASP C O 6345 C CB . ASP C 132 ? 1.0454 1.0766 1.1121 -0.2170 0.0051 0.0226 213 ASP C CB 6346 C CG . ASP C 132 ? 1.1526 1.2070 1.2301 -0.2316 0.0062 0.0223 213 ASP C CG 6347 O OD1 . ASP C 132 ? 1.0975 1.1399 1.1713 -0.2472 0.0126 0.0172 213 ASP C OD1 6348 O OD2 . ASP C 132 ? 1.2183 1.3032 1.3081 -0.2274 0.0010 0.0274 213 ASP C OD2 6349 N N . THR C 133 ? 1.0348 1.0008 1.0826 -0.2286 0.0261 0.0183 214 THR C N 6350 C CA . THR C 133 ? 1.0030 0.9395 1.0436 -0.2239 0.0359 0.0216 214 THR C CA 6351 C C . THR C 133 ? 1.0412 0.9879 1.0910 -0.2260 0.0407 0.0277 214 THR C C 6352 O O . THR C 133 ? 0.9589 0.9251 1.0169 -0.2400 0.0405 0.0257 214 THR C O 6353 C CB . THR C 133 ? 1.0923 0.9982 1.1199 -0.2355 0.0435 0.0142 214 THR C CB 6354 O OG1 . THR C 133 ? 1.3310 1.2079 1.3513 -0.2289 0.0533 0.0184 214 THR C OG1 6355 C CG2 . THR C 133 ? 1.1110 1.0260 1.1415 -0.2573 0.0460 0.0078 214 THR C CG2 6356 N N . ILE C 134 ? 0.9775 0.9126 1.0261 -0.2122 0.0449 0.0352 215 ILE C N 6357 C CA . ILE C 134 ? 0.9437 0.8878 1.0003 -0.2121 0.0495 0.0418 215 ILE C CA 6358 C C . ILE C 134 ? 0.8920 0.8055 0.9400 -0.2125 0.0610 0.0442 215 ILE C C 6359 O O . ILE C 134 ? 0.8797 0.7675 0.9169 -0.2027 0.0640 0.0452 215 ILE C O 6360 C CB . ILE C 134 ? 0.8118 0.7735 0.8759 -0.1950 0.0443 0.0496 215 ILE C CB 6361 C CG1 . ILE C 134 ? 0.7621 0.7538 0.8347 -0.1937 0.0336 0.0480 215 ILE C CG1 6362 C CG2 . ILE C 134 ? 0.6369 0.6081 0.7090 -0.1950 0.0496 0.0563 215 ILE C CG2 6363 C CD1 . ILE C 134 ? 0.7493 0.7581 0.8289 -0.1770 0.0289 0.0554 215 ILE C CD1 6364 N N . HIS C 135 ? 0.8607 0.7775 0.9134 -0.2236 0.0676 0.0456 216 HIS C N 6365 C CA . HIS C 135 ? 0.9433 0.8302 0.9873 -0.2262 0.0795 0.0477 216 HIS C CA 6366 C C . HIS C 135 ? 1.0395 0.9315 1.0893 -0.2210 0.0848 0.0563 216 HIS C C 6367 O O . HIS C 135 ? 0.9131 0.8341 0.9756 -0.2232 0.0812 0.0590 216 HIS C O 6368 C CB . HIS C 135 ? 0.8979 0.7730 0.9375 -0.2471 0.0856 0.0398 216 HIS C CB 6369 C CG . HIS C 135 ? 1.0140 0.8801 1.0457 -0.2523 0.0818 0.0310 216 HIS C CG 6370 N ND1 . HIS C 135 ? 1.0288 0.9210 1.0671 -0.2594 0.0722 0.0253 216 HIS C ND1 6371 C CD2 . HIS C 135 ? 1.1756 1.0099 1.1932 -0.2505 0.0864 0.0273 216 HIS C CD2 6372 C CE1 . HIS C 135 ? 1.1648 1.0413 1.1931 -0.2626 0.0710 0.0181 216 HIS C CE1 6373 N NE2 . HIS C 135 ? 1.2780 1.1192 1.2938 -0.2572 0.0797 0.0190 216 HIS C NE2 6374 N N . PRO C 136 ? 1.1104 0.9743 1.1506 -0.2137 0.0935 0.0611 217 PRO C N 6375 C CA . PRO C 136 ? 1.0683 0.9344 1.1121 -0.2080 0.0992 0.0697 217 PRO C CA 6376 C C . PRO C 136 ? 1.1060 0.9773 1.1554 -0.2254 0.1064 0.0689 217 PRO C C 6377 O O . PRO C 136 ? 1.0971 0.9496 1.1399 -0.2395 0.1133 0.0636 217 PRO C O 6378 C CB . PRO C 136 ? 0.9725 0.8048 1.0025 -0.1966 0.1067 0.0741 217 PRO C CB 6379 C CG . PRO C 136 ? 0.9443 0.7529 0.9635 -0.2029 0.1086 0.0667 217 PRO C CG 6380 C CD . PRO C 136 ? 0.9817 0.8119 1.0070 -0.2082 0.0979 0.0594 217 PRO C CD 6381 N N . THR C 137 ? 1.2381 1.1352 1.2996 -0.2245 0.1050 0.0739 218 THR C N 6382 C CA . THR C 137 ? 1.2740 1.1755 1.3409 -0.2381 0.1131 0.0753 218 THR C CA 6383 C C . THR C 137 ? 1.2431 1.1191 1.3014 -0.2300 0.1236 0.0830 218 THR C C 6384 O O . THR C 137 ? 1.0835 0.9348 1.1338 -0.2397 0.1340 0.0821 218 THR C O 6385 C CB . THR C 137 ? 1.2899 1.2311 1.3738 -0.2393 0.1075 0.0782 218 THR C CB 6386 O OG1 . THR C 137 ? 1.3415 1.2849 1.4279 -0.2279 0.1117 0.0875 218 THR C OG1 6387 C CG2 . THR C 137 ? 1.2918 1.2570 1.3822 -0.2309 0.0947 0.0763 218 THR C CG2 6388 N N . ASN C 138 ? 1.1730 1.0546 1.2323 -0.2118 0.1208 0.0905 219 ASN C N 6389 C CA . ASN C 138 ? 1.1238 0.9899 1.1775 -0.2028 0.1294 0.0991 219 ASN C CA 6390 C C . ASN C 138 ? 1.0321 0.8642 1.0700 -0.1908 0.1341 0.1021 219 ASN C C 6391 O O . ASN C 138 ? 1.1450 0.9729 1.1792 -0.1756 0.1353 0.1096 219 ASN C O 6392 C CB . ASN C 138 ? 1.1735 1.0650 1.2366 -0.1905 0.1250 0.1060 219 ASN C CB 6393 C CG . ASN C 138 ? 1.3759 1.2962 1.4537 -0.2021 0.1255 0.1064 219 ASN C CG 6394 O OD1 . ASN C 138 ? 1.4525 1.4003 1.5408 -0.1950 0.1193 0.1092 219 ASN C OD1 6395 N ND2 . ASN C 138 ? 1.3235 1.2375 1.4020 -0.2198 0.1334 0.1037 219 ASN C ND2 6396 N N . GLY C 139 ? 1.0120 0.8203 1.0403 -0.1975 0.1371 0.0963 220 GLY C N 6397 C CA . GLY C 139 ? 1.0242 0.7983 1.0373 -0.1883 0.1441 0.0996 220 GLY C CA 6398 C C . GLY C 139 ? 1.1548 0.9199 1.1608 -0.1752 0.1376 0.0977 220 GLY C C 6399 O O . GLY C 139 ? 1.0996 0.8360 1.0934 -0.1731 0.1431 0.0969 220 GLY C O 6400 N N . GLY C 140 ? 1.1762 0.9653 1.1895 -0.1659 0.1263 0.0974 221 GLY C N 6401 C CA . GLY C 140 ? 0.9861 0.7696 0.9938 -0.1541 0.1195 0.0954 221 GLY C CA 6402 C C . GLY C 140 ? 1.1650 0.9330 1.1637 -0.1363 0.1223 0.1031 221 GLY C C 6403 O O . GLY C 140 ? 1.3229 1.0825 1.3187 -0.1333 0.1301 0.1102 221 GLY C O 6404 N N . PRO C 141 ? 1.2073 0.9720 1.2014 -0.1246 0.1161 0.1020 222 PRO C N 6405 C CA . PRO C 141 ? 1.1430 0.9157 1.1395 -0.1286 0.1077 0.0937 222 PRO C CA 6406 C C . PRO C 141 ? 1.0521 0.8572 1.0605 -0.1257 0.0970 0.0929 222 PRO C C 6407 O O . PRO C 141 ? 0.9751 0.7923 0.9870 -0.1155 0.0953 0.0990 222 PRO C O 6408 C CB . PRO C 141 ? 1.1604 0.9151 1.1465 -0.1152 0.1069 0.0946 222 PRO C CB 6409 C CG . PRO C 141 ? 1.1521 0.9084 1.1364 -0.1001 0.1080 0.1037 222 PRO C CG 6410 C CD . PRO C 141 ? 1.1792 0.9359 1.1662 -0.1065 0.1159 0.1087 222 PRO C CD 6411 N N . LEU C 142 ? 1.0473 0.8658 1.0612 -0.1347 0.0904 0.0856 223 LEU C N 6412 C CA . LEU C 142 ? 0.9314 0.7793 0.9557 -0.1313 0.0803 0.0847 223 LEU C CA 6413 C C . LEU C 142 ? 0.7812 0.6299 0.8021 -0.1142 0.0743 0.0872 223 LEU C C 6414 O O . LEU C 142 ? 0.7664 0.5954 0.7775 -0.1076 0.0755 0.0865 223 LEU C O 6415 C CB . LEU C 142 ? 0.9067 0.7664 0.9357 -0.1437 0.0745 0.0763 223 LEU C CB 6416 C CG . LEU C 142 ? 0.8680 0.7513 0.9087 -0.1575 0.0735 0.0745 223 LEU C CG 6417 C CD1 . LEU C 142 ? 0.6835 0.5646 0.7268 -0.1621 0.0824 0.0799 223 LEU C CD1 6418 C CD2 . LEU C 142 ? 0.6511 0.5331 0.6911 -0.1737 0.0726 0.0658 223 LEU C CD2 6419 N N . ARG C 143 ? 0.7305 0.6020 0.7593 -0.1071 0.0683 0.0899 224 ARG C N 6420 C CA . ARG C 143 ? 0.7309 0.6050 0.7569 -0.0917 0.0627 0.0921 224 ARG C CA 6421 C C . ARG C 143 ? 0.7495 0.6485 0.7842 -0.0896 0.0534 0.0899 224 ARG C C 6422 O O . ARG C 143 ? 0.7988 0.7180 0.8427 -0.0913 0.0523 0.0922 224 ARG C O 6423 C CB . ARG C 143 ? 0.7456 0.6183 0.7697 -0.0811 0.0667 0.0999 224 ARG C CB 6424 C CG . ARG C 143 ? 0.6666 0.5142 0.6804 -0.0777 0.0751 0.1039 224 ARG C CG 6425 C CD . ARG C 143 ? 0.7080 0.5587 0.7229 -0.0741 0.0808 0.1113 224 ARG C CD 6426 N NE . ARG C 143 ? 1.0294 0.8736 1.0459 -0.0867 0.0887 0.1118 224 ARG C NE 6427 C CZ . ARG C 143 ? 1.0349 0.8898 1.0575 -0.0904 0.0927 0.1159 224 ARG C CZ 6428 N NH1 . ARG C 143 ? 0.8053 0.6777 0.8328 -0.0820 0.0897 0.1199 224 ARG C NH1 6429 N NH2 . ARG C 143 ? 1.0760 0.9232 1.0994 -0.1029 0.1003 0.1157 224 ARG C NH2 6430 N N . THR C 144 ? 0.7262 0.6237 0.7575 -0.0852 0.0472 0.0858 225 THR C N 6431 C CA . THR C 144 ? 0.6759 0.5946 0.7138 -0.0807 0.0388 0.0846 225 THR C CA 6432 C C . THR C 144 ? 0.7067 0.6317 0.7446 -0.0668 0.0375 0.0899 225 THR C C 6433 O O . THR C 144 ? 0.8921 0.8051 0.9243 -0.0603 0.0423 0.0943 225 THR C O 6434 C CB . THR C 144 ? 0.7418 0.6563 0.7756 -0.0799 0.0329 0.0789 225 THR C CB 6435 O OG1 . THR C 144 ? 0.8479 0.7492 0.8735 -0.0678 0.0325 0.0804 225 THR C OG1 6436 C CG2 . THR C 144 ? 0.7154 0.6169 0.7453 -0.0924 0.0356 0.0733 225 THR C CG2 6437 N N . GLN C 145 ? 0.6933 0.6366 0.7370 -0.0622 0.0311 0.0896 226 GLN C N 6438 C CA . GLN C 145 ? 0.7008 0.6505 0.7445 -0.0501 0.0303 0.0941 226 GLN C CA 6439 C C . GLN C 145 ? 0.7194 0.6572 0.7542 -0.0398 0.0278 0.0933 226 GLN C C 6440 O O . GLN C 145 ? 0.8198 0.7605 0.8527 -0.0298 0.0273 0.0964 226 GLN C O 6441 C CB . GLN C 145 ? 0.7259 0.6992 0.7791 -0.0488 0.0257 0.0947 226 GLN C CB 6442 C CG . GLN C 145 ? 0.8006 0.7826 0.8570 -0.0538 0.0193 0.0896 226 GLN C CG 6443 C CD . GLN C 145 ? 0.8366 0.8429 0.9027 -0.0520 0.0153 0.0911 226 GLN C CD 6444 O OE1 . GLN C 145 ? 0.9593 0.9787 1.0313 -0.0590 0.0115 0.0884 226 GLN C OE1 6445 N NE2 . GLN C 145 ? 0.9329 0.9453 1.0002 -0.0421 0.0164 0.0955 226 GLN C NE2 6446 N N . ALA C 146 ? 0.5639 0.4883 0.5929 -0.0425 0.0266 0.0890 227 ALA C N 6447 C CA . ALA C 146 ? 0.6759 0.5882 0.6965 -0.0337 0.0248 0.0881 227 ALA C CA 6448 C C . ALA C 146 ? 0.7243 0.6487 0.7463 -0.0253 0.0191 0.0879 227 ALA C C 6449 O O . ALA C 146 ? 0.7462 0.6670 0.7632 -0.0158 0.0191 0.0900 227 ALA C O 6450 C CB . ALA C 146 ? 0.5174 0.4156 0.5309 -0.0275 0.0306 0.0927 227 ALA C CB 6451 N N . SER C 147 ? 0.7309 0.6692 0.7593 -0.0293 0.0144 0.0852 228 SER C N 6452 C CA . SER C 147 ? 0.6962 0.6479 0.7276 -0.0227 0.0099 0.0856 228 SER C CA 6453 C C . SER C 147 ? 0.7666 0.7310 0.8041 -0.0290 0.0051 0.0823 228 SER C C 6454 O O . SER C 147 ? 0.6752 0.6394 0.7151 -0.0390 0.0056 0.0799 228 SER C O 6455 C CB . SER C 147 ? 0.6189 0.5812 0.6548 -0.0186 0.0128 0.0907 228 SER C CB 6456 O OG . SER C 147 ? 0.9828 0.9573 1.0213 -0.0122 0.0091 0.0911 228 SER C OG 6457 N N . SER C 148 ? 0.7564 0.7317 0.7961 -0.0234 0.0008 0.0823 229 SER C N 6458 C CA . SER C 148 ? 0.6316 0.6210 0.6772 -0.0280 -0.0039 0.0801 229 SER C CA 6459 C C . SER C 148 ? 0.6621 0.6680 0.7175 -0.0345 -0.0024 0.0827 229 SER C C 6460 O O . SER C 148 ? 0.6835 0.6954 0.7425 -0.0308 0.0011 0.0872 229 SER C O 6461 C CB . SER C 148 ? 0.6122 0.6089 0.6574 -0.0192 -0.0079 0.0806 229 SER C CB 6462 O OG . SER C 148 ? 0.8376 0.8477 0.8877 -0.0230 -0.0125 0.0790 229 SER C OG 6463 N N . CYS C 149 ? 0.5392 0.5530 0.5989 -0.0445 -0.0049 0.0797 230 CYS C N 6464 C CA . CYS C 149 ? 0.7631 0.7984 0.8336 -0.0501 -0.0052 0.0819 230 CYS C CA 6465 C C . CYS C 149 ? 0.8217 0.8744 0.8969 -0.0428 -0.0098 0.0840 230 CYS C C 6466 O O . CYS C 149 ? 0.8198 0.8667 0.8894 -0.0354 -0.0129 0.0828 230 CYS C O 6467 C CB . CYS C 149 ? 0.7142 0.7538 0.7874 -0.0640 -0.0066 0.0776 230 CYS C CB 6468 S SG . CYS C 149 ? 1.3332 1.3482 1.3958 -0.0713 -0.0055 0.0712 230 CYS C SG 6469 N N . ILE C 150 ? 0.7870 0.8613 0.8725 -0.0447 -0.0100 0.0873 231 ILE C N 6470 C CA . ILE C 150 ? 0.7783 0.8700 0.8687 -0.0372 -0.0136 0.0902 231 ILE C CA 6471 C C . ILE C 150 ? 0.7748 0.8860 0.8720 -0.0448 -0.0187 0.0887 231 ILE C C 6472 O O . ILE C 150 ? 0.8661 0.9903 0.9708 -0.0546 -0.0180 0.0887 231 ILE C O 6473 C CB . ILE C 150 ? 0.7764 0.8798 0.8734 -0.0300 -0.0098 0.0963 231 ILE C CB 6474 C CG1 . ILE C 150 ? 0.8248 0.9095 0.9147 -0.0243 -0.0044 0.0975 231 ILE C CG1 6475 C CG2 . ILE C 150 ? 0.7531 0.8695 0.8527 -0.0198 -0.0126 0.0994 231 ILE C CG2 6476 C CD1 . ILE C 150 ? 0.6791 0.7483 0.7590 -0.0141 -0.0054 0.0963 231 ILE C CD1 6477 N N . CYS C 151 ? 0.8655 0.9787 0.9596 -0.0406 -0.0238 0.0873 232 CYS C N 6478 C CA . CYS C 151 ? 0.8871 1.0208 0.9870 -0.0457 -0.0292 0.0867 232 CYS C CA 6479 C C . CYS C 151 ? 0.9145 1.0652 1.0195 -0.0347 -0.0311 0.0922 232 CYS C C 6480 O O . CYS C 151 ? 0.8906 1.0311 0.9900 -0.0234 -0.0303 0.0938 232 CYS C O 6481 C CB . CYS C 151 ? 0.7561 0.8796 0.8479 -0.0498 -0.0337 0.0810 232 CYS C CB 6482 S SG . CYS C 151 ? 1.0040 1.1089 1.0898 -0.0636 -0.0317 0.0740 232 CYS C SG 6483 N N . ASN C 152 ? 0.8866 1.0636 1.0020 -0.0378 -0.0334 0.0952 233 ASN C N 6484 C CA . ASN C 152 ? 0.8655 1.0595 0.9852 -0.0274 -0.0358 0.1005 233 ASN C CA 6485 C C . ASN C 152 ? 0.8932 1.1149 1.0215 -0.0339 -0.0410 0.1014 233 ASN C C 6486 O O . ASN C 152 ? 0.7474 0.9865 0.8851 -0.0425 -0.0404 0.1022 233 ASN C O 6487 C CB . ASN C 152 ? 0.8490 1.0485 0.9739 -0.0172 -0.0306 0.1068 233 ASN C CB 6488 C CG . ASN C 152 ? 0.9203 1.1223 1.0434 -0.0028 -0.0310 0.1113 233 ASN C CG 6489 O OD1 . ASN C 152 ? 0.9189 1.1094 1.0336 0.0010 -0.0338 0.1091 233 ASN C OD1 6490 N ND2 . ASN C 152 ? 0.8421 1.0590 0.9729 0.0053 -0.0277 0.1178 233 ASN C ND2 6491 N N . ASP C 153 ? 0.8762 1.1021 1.0010 -0.0299 -0.0461 0.1013 234 ASP C N 6492 C CA . ASP C 153 ? 0.9015 1.1553 1.0337 -0.0341 -0.0516 0.1030 234 ASP C CA 6493 C C . ASP C 153 ? 0.8688 1.1295 1.0036 -0.0517 -0.0539 0.0971 234 ASP C C 6494 O O . ASP C 153 ? 0.7317 1.0181 0.8773 -0.0584 -0.0551 0.0992 234 ASP C O 6495 C CB . ASP C 153 ? 0.9130 1.1929 1.0573 -0.0261 -0.0501 0.1113 234 ASP C CB 6496 C CG . ASP C 153 ? 1.2672 1.5748 1.4172 -0.0237 -0.0560 0.1152 234 ASP C CG 6497 O OD1 . ASP C 153 ? 1.3417 1.6440 1.4842 -0.0227 -0.0604 0.1130 234 ASP C OD1 6498 O OD2 . ASP C 153 ? 1.3674 1.7028 1.5296 -0.0225 -0.0560 0.1208 234 ASP C OD2 6499 N N . GLY C 154 ? 0.8477 1.0851 0.9723 -0.0592 -0.0541 0.0899 235 GLY C N 6500 C CA . GLY C 154 ? 0.8338 1.0736 0.9584 -0.0761 -0.0559 0.0834 235 GLY C CA 6501 C C . GLY C 154 ? 0.8613 1.0904 0.9873 -0.0860 -0.0503 0.0805 235 GLY C C 6502 O O . GLY C 154 ? 0.9865 1.2017 1.1064 -0.0979 -0.0499 0.0737 235 GLY C O 6503 N N . THR C 155 ? 0.7463 0.9812 0.8798 -0.0813 -0.0456 0.0858 236 THR C N 6504 C CA . THR C 155 ? 0.8898 1.1142 1.0243 -0.0902 -0.0397 0.0838 236 THR C CA 6505 C C . THR C 155 ? 0.9460 1.1400 1.0716 -0.0824 -0.0342 0.0838 236 THR C C 6506 O O . THR C 155 ? 0.9916 1.1797 1.1146 -0.0685 -0.0335 0.0877 236 THR C O 6507 C CB . THR C 155 ? 1.0117 1.2615 1.1601 -0.0934 -0.0373 0.0887 236 THR C CB 6508 O OG1 . THR C 155 ? 1.1139 1.3647 1.2655 -0.0789 -0.0337 0.0957 236 THR C OG1 6509 C CG2 . THR C 155 ? 0.8880 1.1720 1.0462 -0.0988 -0.0434 0.0899 236 THR C CG2 6510 N N . CYS C 156 ? 0.8609 1.0353 0.9811 -0.0916 -0.0301 0.0793 237 CYS C N 6511 C CA . CYS C 156 ? 0.8289 0.9758 0.9407 -0.0851 -0.0248 0.0794 237 CYS C CA 6512 C C . CYS C 156 ? 0.8104 0.9547 0.9263 -0.0897 -0.0181 0.0815 237 CYS C C 6513 O O . CYS C 156 ? 0.9620 1.1130 1.0822 -0.1030 -0.0166 0.0792 237 CYS C O 6514 C CB . CYS C 156 ? 0.8503 0.9721 0.9501 -0.0895 -0.0252 0.0728 237 CYS C CB 6515 S SG . CYS C 156 ? 1.1320 1.2529 1.2252 -0.0836 -0.0323 0.0702 237 CYS C SG 6516 N N . TYR C 157 ? 0.8315 0.9655 0.9454 -0.0791 -0.0137 0.0857 238 TYR C N 6517 C CA . TYR C 157 ? 0.7274 0.8577 0.8441 -0.0821 -0.0068 0.0884 238 TYR C CA 6518 C C . TYR C 157 ? 0.7194 0.8196 0.8249 -0.0790 -0.0019 0.0872 238 TYR C C 6519 O O . TYR C 157 ? 0.7014 0.7873 0.7987 -0.0692 -0.0032 0.0868 238 TYR C O 6520 C CB . TYR C 157 ? 0.5046 0.6536 0.6304 -0.0732 -0.0050 0.0954 238 TYR C CB 6521 C CG . TYR C 157 ? 0.7476 0.9274 0.8847 -0.0740 -0.0098 0.0976 238 TYR C CG 6522 C CD1 . TYR C 157 ? 0.7697 0.9573 0.9062 -0.0639 -0.0149 0.0991 238 TYR C CD1 6523 C CD2 . TYR C 157 ? 0.7619 0.9636 0.9101 -0.0848 -0.0091 0.0984 238 TYR C CD2 6524 C CE1 . TYR C 157 ? 0.7309 0.9474 0.8775 -0.0636 -0.0192 0.1019 238 TYR C CE1 6525 C CE2 . TYR C 157 ? 0.8582 1.0904 1.0171 -0.0851 -0.0137 0.1009 238 TYR C CE2 6526 C CZ . TYR C 157 ? 0.9341 1.1736 1.0921 -0.0740 -0.0188 0.1029 238 TYR C CZ 6527 O OH . TYR C 157 ? 1.0183 1.2887 1.1868 -0.0734 -0.0232 0.1061 238 TYR C OH 6528 N N . THR C 158 ? 0.7200 0.8110 0.8250 -0.0876 0.0038 0.0867 239 THR C N 6529 C CA . THR C 158 ? 0.6933 0.7572 0.7881 -0.0845 0.0090 0.0865 239 THR C CA 6530 C C . THR C 158 ? 0.7433 0.8055 0.8413 -0.0900 0.0164 0.0897 239 THR C C 6531 O O . THR C 158 ? 0.7447 0.8244 0.8521 -0.0995 0.0173 0.0901 239 THR C O 6532 C CB . THR C 158 ? 0.8690 0.9123 0.9542 -0.0908 0.0082 0.0803 239 THR C CB 6533 O OG1 . THR C 158 ? 1.0177 1.0360 1.0931 -0.0856 0.0132 0.0811 239 THR C OG1 6534 C CG2 . THR C 158 ? 0.6970 0.7435 0.7851 -0.1074 0.0096 0.0761 239 THR C CG2 6535 N N . ILE C 159 ? 0.7630 0.8054 0.8534 -0.0839 0.0217 0.0921 240 ILE C N 6536 C CA . ILE C 159 ? 0.6665 0.7046 0.7583 -0.0881 0.0293 0.0955 240 ILE C CA 6537 C C . ILE C 159 ? 0.6525 0.6633 0.7339 -0.0930 0.0344 0.0933 240 ILE C C 6538 O O . ILE C 159 ? 0.8297 0.8228 0.9015 -0.0859 0.0334 0.0920 240 ILE C O 6539 C CB . ILE C 159 ? 0.5958 0.6373 0.6883 -0.0758 0.0321 0.1019 240 ILE C CB 6540 C CG1 . ILE C 159 ? 0.7694 0.8373 0.8721 -0.0708 0.0279 0.1043 240 ILE C CG1 6541 C CG2 . ILE C 159 ? 0.5624 0.5996 0.6561 -0.0802 0.0404 0.1058 240 ILE C CG2 6542 C CD1 . ILE C 159 ? 0.7559 0.8252 0.8569 -0.0562 0.0289 0.1090 240 ILE C CD1 6543 N N . ILE C 160 ? 0.6825 0.6901 0.7659 -0.1051 0.0400 0.0928 241 ILE C N 6544 C CA . ILE C 160 ? 0.6317 0.6122 0.7050 -0.1102 0.0460 0.0909 241 ILE C CA 6545 C C . ILE C 160 ? 0.7017 0.6743 0.7744 -0.1118 0.0550 0.0960 241 ILE C C 6546 O O . ILE C 160 ? 0.8154 0.8046 0.8974 -0.1179 0.0574 0.0984 241 ILE C O 6547 C CB . ILE C 160 ? 0.6842 0.6616 0.7572 -0.1253 0.0453 0.0839 241 ILE C CB 6548 C CG1 . ILE C 160 ? 0.5540 0.5369 0.6258 -0.1228 0.0367 0.0790 241 ILE C CG1 6549 C CG2 . ILE C 160 ? 0.5830 0.5306 0.6452 -0.1307 0.0529 0.0822 241 ILE C CG2 6550 C CD1 . ILE C 160 ? 0.8158 0.7941 0.8854 -0.1368 0.0356 0.0716 241 ILE C CD1 6551 N N . ALA C 161 ? 0.7491 0.6969 0.8109 -0.1061 0.0600 0.0981 242 ALA C N 6552 C CA . ALA C 161 ? 0.6893 0.6271 0.7486 -0.1056 0.0688 0.1037 242 ALA C CA 6553 C C . ALA C 161 ? 0.7304 0.6469 0.7837 -0.1174 0.0765 0.1016 242 ALA C C 6554 O O . ALA C 161 ? 0.7701 0.6690 0.8155 -0.1195 0.0762 0.0972 242 ALA C O 6555 C CB . ALA C 161 ? 0.6834 0.6096 0.7343 -0.0900 0.0698 0.1087 242 ALA C CB 6556 N N . ASP C 162 ? 0.7173 0.6351 0.7741 -0.1249 0.0838 0.1049 243 ASP C N 6557 C CA . ASP C 162 ? 0.7474 0.6430 0.7977 -0.1353 0.0930 0.1042 243 ASP C CA 6558 C C . ASP C 162 ? 0.8278 0.7129 0.8739 -0.1292 0.1015 0.1123 243 ASP C C 6559 O O . ASP C 162 ? 0.8316 0.7271 0.8796 -0.1173 0.0997 0.1176 243 ASP C O 6560 C CB . ASP C 162 ? 0.8203 0.7280 0.8792 -0.1539 0.0944 0.0995 243 ASP C CB 6561 C CG . ASP C 162 ? 0.9825 0.8650 1.0329 -0.1666 0.1015 0.0951 243 ASP C CG 6562 O OD1 . ASP C 162 ? 1.0684 0.9231 1.1070 -0.1610 0.1081 0.0977 243 ASP C OD1 6563 O OD2 . ASP C 162 ? 1.0235 0.9144 1.0790 -0.1824 0.1009 0.0889 243 ASP C OD2 6564 N N . GLY C 163 ? 0.8229 0.6867 0.8627 -0.1375 0.1112 0.1131 244 GLY C N 6565 C CA . GLY C 163 ? 0.8285 0.6794 0.8627 -0.1320 0.1202 0.1210 244 GLY C CA 6566 C C . GLY C 163 ? 0.8663 0.6872 0.8858 -0.1229 0.1246 0.1235 244 GLY C C 6567 O O . GLY C 163 ? 0.9026 0.7174 0.9172 -0.1160 0.1189 0.1203 244 GLY C O 6568 N N . THR C 164 ? 0.9522 0.7547 0.9645 -0.1226 0.1349 0.1294 245 THR C N 6569 C CA . THR C 164 ? 0.9193 0.6931 0.9175 -0.1134 0.1402 0.1329 245 THR C CA 6570 C C . THR C 164 ? 0.9686 0.7433 0.9618 -0.0959 0.1399 0.1412 245 THR C C 6571 O O . THR C 164 ? 0.9639 0.7209 0.9465 -0.0850 0.1413 0.1442 245 THR C O 6572 C CB . THR C 164 ? 1.0394 0.7877 1.0304 -0.1237 0.1528 0.1343 245 THR C CB 6573 O OG1 . THR C 164 ? 1.1633 0.9205 1.1599 -0.1303 0.1589 0.1388 245 THR C OG1 6574 C CG2 . THR C 164 ? 1.0288 0.7694 1.0205 -0.1394 0.1533 0.1252 245 THR C CG2 6575 N N . THR C 165 ? 0.9885 0.7846 0.9894 -0.0933 0.1380 0.1448 246 THR C N 6576 C CA . THR C 165 ? 1.0523 0.8523 1.0490 -0.0780 0.1375 0.1521 246 THR C CA 6577 C C . THR C 165 ? 0.9724 0.8016 0.9793 -0.0733 0.1281 0.1504 246 THR C C 6578 O O . THR C 165 ? 0.8412 0.6880 0.8591 -0.0829 0.1244 0.1456 246 THR C O 6579 C CB . THR C 165 ? 1.0296 0.8210 1.0226 -0.0790 0.1485 0.1601 246 THR C CB 6580 O OG1 . THR C 165 ? 1.2380 1.0399 1.2294 -0.0660 0.1472 0.1665 246 THR C OG1 6581 C CG2 . THR C 165 ? 0.9461 0.7488 0.9495 -0.0947 0.1525 0.1583 246 THR C CG2 6582 N N . TYR C 166 ? 1.0236 0.8582 1.0266 -0.0588 0.1241 0.1540 247 TYR C N 6583 C CA . TYR C 166 ? 0.9783 0.8385 0.9899 -0.0543 0.1164 0.1525 247 TYR C CA 6584 C C . TYR C 166 ? 0.9848 0.8600 1.0038 -0.0579 0.1209 0.1567 247 TYR C C 6585 O O . TYR C 166 ? 0.9365 0.8341 0.9650 -0.0575 0.1161 0.1551 247 TYR C O 6586 C CB . TYR C 166 ? 0.9502 0.8116 0.9550 -0.0388 0.1110 0.1543 247 TYR C CB 6587 C CG . TYR C 166 ? 0.9456 0.7968 0.9452 -0.0352 0.1054 0.1497 247 TYR C CG 6588 C CD1 . TYR C 166 ? 0.9968 0.8566 1.0033 -0.0410 0.0984 0.1423 247 TYR C CD1 6589 C CD2 . TYR C 166 ? 0.8906 0.7244 0.8784 -0.0258 0.1073 0.1530 247 TYR C CD2 6590 C CE1 . TYR C 166 ? 0.9559 0.8064 0.9575 -0.0379 0.0936 0.1380 247 TYR C CE1 6591 C CE2 . TYR C 166 ? 0.9306 0.7560 0.9142 -0.0224 0.1025 0.1489 247 TYR C CE2 6592 C CZ . TYR C 166 ? 1.0004 0.8338 0.9908 -0.0287 0.0958 0.1412 247 TYR C CZ 6593 O OH . TYR C 166 ? 1.0436 0.8688 1.0298 -0.0256 0.0913 0.1371 247 TYR C OH 6594 N N . THR C 167 ? 0.8736 0.7356 0.8878 -0.0611 0.1307 0.1622 248 THR C N 6595 C CA . THR C 167 ? 0.9454 0.8192 0.9654 -0.0647 0.1366 0.1668 248 THR C CA 6596 C C . THR C 167 ? 0.9985 0.8836 1.0307 -0.0811 0.1383 0.1628 248 THR C C 6597 O O . THR C 167 ? 0.9244 0.8253 0.9648 -0.0853 0.1415 0.1654 248 THR C O 6598 C CB . THR C 167 ? 1.0199 0.8745 1.0294 -0.0618 0.1470 0.1747 248 THR C CB 6599 O OG1 . THR C 167 ? 1.0399 0.8741 1.0458 -0.0725 0.1538 0.1737 248 THR C OG1 6600 C CG2 . THR C 167 ? 0.8788 0.7225 0.8757 -0.0460 0.1451 0.1786 248 THR C CG2 6601 N N . ALA C 168 ? 1.0201 0.8974 1.0532 -0.0905 0.1362 0.1565 249 ALA C N 6602 C CA . ALA C 168 ? 0.9063 0.7956 0.9506 -0.1069 0.1365 0.1516 249 ALA C CA 6603 C C . ALA C 168 ? 0.9253 0.8211 0.9736 -0.1104 0.1272 0.1434 249 ALA C C 6604 O O . ALA C 168 ? 1.0317 0.9172 1.0791 -0.1220 0.1285 0.1381 249 ALA C O 6605 C CB . ALA C 168 ? 0.8128 0.6817 0.8525 -0.1192 0.1471 0.1524 249 ALA C CB 6606 N N . SER C 169 ? 0.8844 0.7965 0.9364 -0.1003 0.1182 0.1421 250 SER C N 6607 C CA . SER C 169 ? 0.9139 0.8328 0.9691 -0.1020 0.1090 0.1350 250 SER C CA 6608 C C . SER C 169 ? 0.9737 0.9205 1.0437 -0.1114 0.1045 0.1315 250 SER C C 6609 O O . SER C 169 ? 1.0550 1.0222 1.1334 -0.1087 0.1045 0.1350 250 SER C O 6610 C CB . SER C 169 ? 0.8744 0.7948 0.9248 -0.0861 0.1017 0.1354 250 SER C CB 6611 O OG . SER C 169 ? 1.1263 1.0608 1.1795 -0.0766 0.1017 0.1405 250 SER C OG 6612 N N . SER C 170 ? 0.9319 0.8802 1.0049 -0.1224 0.1008 0.1246 251 SER C N 6613 C CA . SER C 170 ? 0.9158 0.8926 1.0025 -0.1298 0.0949 0.1211 251 SER C CA 6614 C C . SER C 170 ? 0.8999 0.8841 0.9870 -0.1233 0.0845 0.1166 251 SER C C 6615 O O . SER C 170 ? 0.8357 0.8008 0.9129 -0.1193 0.0825 0.1138 251 SER C O 6616 C CB . SER C 170 ? 0.9050 0.8833 0.9966 -0.1491 0.0985 0.1167 251 SER C CB 6617 O OG . SER C 170 ? 0.9974 0.9522 1.0793 -0.1551 0.0993 0.1113 251 SER C OG 6618 N N . HIS C 171 ? 0.9393 0.9511 1.0376 -0.1216 0.0783 0.1164 252 HIS C N 6619 C CA . HIS C 171 ? 0.8451 0.8650 0.9439 -0.1149 0.0688 0.1128 252 HIS C CA 6620 C C . HIS C 171 ? 0.8387 0.8864 0.9503 -0.1234 0.0630 0.1096 252 HIS C C 6621 O O . HIS C 171 ? 0.8628 0.9315 0.9853 -0.1284 0.0650 0.1122 252 HIS C O 6622 C CB . HIS C 171 ? 0.6588 0.6811 0.7549 -0.0975 0.0663 0.1172 252 HIS C CB 6623 C CG . HIS C 171 ? 0.8249 0.8240 0.9093 -0.0893 0.0721 0.1211 252 HIS C CG 6624 N ND1 . HIS C 171 ? 0.8468 0.8234 0.9194 -0.0841 0.0710 0.1191 252 HIS C ND1 6625 C CD2 . HIS C 171 ? 0.8266 0.8221 0.9093 -0.0858 0.0792 0.1271 252 HIS C CD2 6626 C CE1 . HIS C 171 ? 0.7902 0.7514 0.8545 -0.0773 0.0768 0.1239 252 HIS C CE1 6627 N NE2 . HIS C 171 ? 0.8398 0.8115 0.9096 -0.0782 0.0818 0.1288 252 HIS C NE2 6628 N N . ARG C 172 ? 0.8445 0.8929 0.9545 -0.1250 0.0559 0.1040 253 ARG C N 6629 C CA . ARG C 172 ? 0.7080 0.7822 0.8290 -0.1334 0.0500 0.1007 253 ARG C CA 6630 C C . ARG C 172 ? 0.7452 0.8301 0.8669 -0.1237 0.0409 0.0993 253 ARG C C 6631 O O . ARG C 172 ? 0.7495 0.8167 0.8613 -0.1164 0.0382 0.0971 253 ARG C O 6632 C CB . ARG C 172 ? 0.6813 0.7481 0.8004 -0.1506 0.0510 0.0940 253 ARG C CB 6633 C CG . ARG C 172 ? 0.6411 0.7062 0.7634 -0.1638 0.0594 0.0949 253 ARG C CG 6634 C CD . ARG C 172 ? 0.7054 0.7617 0.8246 -0.1811 0.0606 0.0875 253 ARG C CD 6635 N NE . ARG C 172 ? 0.8760 0.9336 0.9994 -0.1957 0.0685 0.0878 253 ARG C NE 6636 C CZ . ARG C 172 ? 0.9485 1.0017 1.0709 -0.2136 0.0708 0.0814 253 ARG C CZ 6637 N NH1 . ARG C 172 ? 0.9263 0.9738 1.0435 -0.2186 0.0656 0.0742 253 ARG C NH1 6638 N NH2 . ARG C 172 ? 0.6998 0.7541 0.8261 -0.2269 0.0786 0.0819 253 ARG C NH2 6639 N N . LEU C 173 ? 0.8448 0.9592 0.9786 -0.1235 0.0366 0.1009 254 LEU C N 6640 C CA . LEU C 173 ? 0.8653 0.9928 1.0010 -0.1155 0.0282 0.0999 254 LEU C CA 6641 C C . LEU C 173 ? 0.8132 0.9486 0.9506 -0.1277 0.0226 0.0934 254 LEU C C 6642 O O . LEU C 173 ? 0.8063 0.9611 0.9531 -0.1399 0.0225 0.0923 254 LEU C O 6643 C CB . LEU C 173 ? 0.8314 0.9868 0.9789 -0.1079 0.0269 0.1056 254 LEU C CB 6644 C CG . LEU C 173 ? 0.9652 1.1201 1.1095 -0.0905 0.0237 0.1087 254 LEU C CG 6645 C CD1 . LEU C 173 ? 0.9450 1.1296 1.1018 -0.0845 0.0222 0.1138 254 LEU C CD1 6646 C CD2 . LEU C 173 ? 0.9417 1.0870 1.0784 -0.0880 0.0169 0.1038 254 LEU C CD2 6647 N N . TYR C 174 ? 0.8253 0.9464 0.9537 -0.1246 0.0180 0.0891 255 TYR C N 6648 C CA . TYR C 174 ? 0.8162 0.9439 0.9448 -0.1355 0.0126 0.0827 255 TYR C CA 6649 C C . TYR C 174 ? 0.8288 0.9746 0.9608 -0.1275 0.0041 0.0831 255 TYR C C 6650 O O . TYR C 174 ? 0.7472 0.8849 0.8741 -0.1135 0.0021 0.0852 255 TYR C O 6651 C CB . TYR C 174 ? 0.6915 0.7891 0.8069 -0.1408 0.0144 0.0767 255 TYR C CB 6652 C CG . TYR C 174 ? 0.8311 0.9137 0.9438 -0.1538 0.0223 0.0747 255 TYR C CG 6653 C CD1 . TYR C 174 ? 1.0004 1.0644 1.1085 -0.1487 0.0299 0.0789 255 TYR C CD1 6654 C CD2 . TYR C 174 ? 0.7193 0.8060 0.8334 -0.1712 0.0224 0.0686 255 TYR C CD2 6655 C CE1 . TYR C 174 ? 1.0444 1.0934 1.1494 -0.1600 0.0378 0.0776 255 TYR C CE1 6656 C CE2 . TYR C 174 ? 0.8002 0.8714 0.9111 -0.1834 0.0304 0.0667 255 TYR C CE2 6657 C CZ . TYR C 174 ? 1.0438 1.0957 1.1502 -0.1774 0.0383 0.0715 255 TYR C CZ 6658 O OH . TYR C 174 ? 1.1563 1.1912 1.2588 -0.1888 0.0471 0.0702 255 TYR C OH 6659 N N . ARG C 175 ? 0.7419 0.9126 0.8823 -0.1366 -0.0007 0.0811 256 ARG C N 6660 C CA . ARG C 175 ? 0.7049 0.8925 0.8476 -0.1306 -0.0088 0.0810 256 ARG C CA 6661 C C . ARG C 175 ? 0.8085 0.9887 0.9442 -0.1413 -0.0129 0.0732 256 ARG C C 6662 O O . ARG C 175 ? 0.9397 1.1194 1.0758 -0.1571 -0.0110 0.0684 256 ARG C O 6663 C CB . ARG C 175 ? 0.8078 1.0322 0.9654 -0.1311 -0.0116 0.0856 256 ARG C CB 6664 C CG . ARG C 175 ? 0.9697 1.2171 1.1317 -0.1383 -0.0195 0.0824 256 ARG C CG 6665 C CD . ARG C 175 ? 0.8714 1.1572 1.0484 -0.1357 -0.0227 0.0882 256 ARG C CD 6666 N NE . ARG C 175 ? 0.9428 1.2422 1.1302 -0.1413 -0.0171 0.0917 256 ARG C NE 6667 C CZ . ARG C 175 ? 0.9774 1.2922 1.1737 -0.1303 -0.0147 0.0994 256 ARG C CZ 6668 N NH1 . ARG C 175 ? 1.0385 1.3561 1.2341 -0.1134 -0.0172 0.1042 256 ARG C NH1 6669 N NH2 . ARG C 175 ? 0.8338 1.1606 1.0394 -0.1364 -0.0093 0.1022 256 ARG C NH2 6670 N N . LEU C 176 ? 0.7391 0.9125 0.8679 -0.1332 -0.0181 0.0716 257 LEU C N 6671 C CA . LEU C 176 ? 0.8282 0.9923 0.9490 -0.1421 -0.0217 0.0641 257 LEU C CA 6672 C C . LEU C 176 ? 0.9190 1.1008 1.0411 -0.1377 -0.0300 0.0639 257 LEU C C 6673 O O . LEU C 176 ? 0.9186 1.1023 1.0403 -0.1230 -0.0324 0.0684 257 LEU C O 6674 C CB . LEU C 176 ? 0.8097 0.9385 0.9166 -0.1382 -0.0183 0.0609 257 LEU C CB 6675 C CG . LEU C 176 ? 0.8272 0.9338 0.9301 -0.1430 -0.0098 0.0604 257 LEU C CG 6676 C CD1 . LEU C 176 ? 0.8552 0.9358 0.9483 -0.1299 -0.0071 0.0622 257 LEU C CD1 6677 C CD2 . LEU C 176 ? 0.8399 0.9342 0.9371 -0.1597 -0.0075 0.0528 257 LEU C CD2 6678 N N . VAL C 177 ? 0.9003 1.0942 1.0232 -0.1508 -0.0341 0.0586 258 VAL C N 6679 C CA . VAL C 177 ? 0.8318 1.0410 0.9542 -0.1478 -0.0420 0.0578 258 VAL C CA 6680 C C . VAL C 177 ? 0.7735 0.9632 0.8836 -0.1556 -0.0436 0.0495 258 VAL C C 6681 O O . VAL C 177 ? 0.7292 0.9125 0.8364 -0.1710 -0.0413 0.0432 258 VAL C O 6682 C CB . VAL C 177 ? 0.8335 1.0804 0.9684 -0.1550 -0.0466 0.0597 258 VAL C CB 6683 C CG1 . VAL C 177 ? 0.9388 1.1963 1.0699 -0.1622 -0.0537 0.0545 258 VAL C CG1 6684 C CG2 . VAL C 177 ? 0.8375 1.1058 0.9823 -0.1401 -0.0481 0.0690 258 VAL C CG2 6685 N N . ASN C 178 ? 0.8354 1.0143 0.9376 -0.1451 -0.0469 0.0494 259 ASN C N 6686 C CA . ASN C 178 ? 0.9668 1.1279 1.0571 -0.1508 -0.0486 0.0419 259 ASN C CA 6687 C C . ASN C 178 ? 0.8693 1.0024 0.9514 -0.1608 -0.0421 0.0357 259 ASN C C 6688 O O . ASN C 178 ? 0.8653 0.9912 0.9405 -0.1726 -0.0427 0.0283 259 ASN C O 6689 C CB . ASN C 178 ? 1.0288 1.2131 1.1209 -0.1612 -0.0554 0.0381 259 ASN C CB 6690 C CG . ASN C 178 ? 1.0708 1.2792 1.1680 -0.1501 -0.0623 0.0438 259 ASN C CG 6691 O OD1 . ASN C 178 ? 1.0449 1.2531 1.1448 -0.1348 -0.0617 0.0506 259 ASN C OD1 6692 N ND2 . ASN C 178 ? 1.1364 1.3658 1.2344 -0.1579 -0.0687 0.0410 259 ASN C ND2 6693 N N . GLY C 179 ? 0.8774 0.9945 0.9596 -0.1562 -0.0354 0.0388 260 GLY C N 6694 C CA . GLY C 179 ? 0.8682 0.9573 0.9421 -0.1636 -0.0284 0.0342 260 GLY C CA 6695 C C . GLY C 179 ? 0.8517 0.9453 0.9304 -0.1789 -0.0237 0.0322 260 GLY C C 6696 O O . GLY C 179 ? 0.8837 0.9531 0.9555 -0.1853 -0.0168 0.0288 260 GLY C O 6697 N N . THR C 180 ? 0.7892 0.9135 0.8796 -0.1847 -0.0269 0.0343 261 THR C N 6698 C CA . THR C 180 ? 0.8806 1.0107 0.9766 -0.1995 -0.0220 0.0327 261 THR C CA 6699 C C . THR C 180 ? 0.8848 1.0306 0.9926 -0.1935 -0.0194 0.0408 261 THR C C 6700 O O . THR C 180 ? 0.7908 0.9541 0.9054 -0.1806 -0.0234 0.0472 261 THR C O 6701 C CB . THR C 180 ? 0.8825 1.0344 0.9819 -0.2169 -0.0263 0.0266 261 THR C CB 6702 O OG1 . THR C 180 ? 1.0494 1.2383 1.1613 -0.2132 -0.0332 0.0316 261 THR C OG1 6703 C CG2 . THR C 180 ? 0.8636 1.0014 0.9507 -0.2218 -0.0294 0.0186 261 THR C CG2 6704 N N . SER C 181 ? 0.9020 1.0399 1.0114 -0.2029 -0.0120 0.0404 262 SER C N 6705 C CA . SER C 181 ? 0.8848 1.0342 1.0043 -0.1987 -0.0080 0.0476 262 SER C CA 6706 C C . SER C 181 ? 0.9174 1.1065 1.0515 -0.2041 -0.0129 0.0499 262 SER C C 6707 O O . SER C 181 ? 0.8155 1.0179 0.9529 -0.2208 -0.0138 0.0449 262 SER C O 6708 C CB . SER C 181 ? 0.8666 0.9955 0.9827 -0.2089 0.0016 0.0460 262 SER C CB 6709 O OG . SER C 181 ? 1.0149 1.1564 1.1411 -0.2062 0.0057 0.0527 262 SER C OG 6710 N N . ALA C 182 ? 0.9903 1.1988 1.1329 -0.1900 -0.0160 0.0575 263 ALA C N 6711 C CA . ALA C 182 ? 0.9466 1.1944 1.1038 -0.1929 -0.0205 0.0609 263 ALA C CA 6712 C C . ALA C 182 ? 0.9612 1.2200 1.1289 -0.1928 -0.0145 0.0668 263 ALA C C 6713 O O . ALA C 182 ? 1.0315 1.3174 1.2107 -0.1847 -0.0168 0.0735 263 ALA C O 6714 C CB . ALA C 182 ? 0.8597 1.1242 1.0198 -0.1775 -0.0277 0.0657 263 ALA C CB 6715 N N . GLY C 183 ? 0.9049 1.1420 1.0682 -0.2014 -0.0064 0.0646 264 GLY C N 6716 C CA . GLY C 183 ? 0.8335 1.0772 1.0052 -0.2021 0.0004 0.0699 264 GLY C CA 6717 C C . GLY C 183 ? 0.8660 1.0857 1.0318 -0.1870 0.0061 0.0753 264 GLY C C 6718 O O . GLY C 183 ? 0.8801 1.0829 1.0372 -0.1738 0.0039 0.0759 264 GLY C O 6719 N N . TRP C 184 ? 0.8903 1.1096 1.0608 -0.1892 0.0135 0.0792 265 TRP C N 6720 C CA . TRP C 184 ? 0.8359 1.0323 1.0002 -0.1766 0.0197 0.0841 265 TRP C CA 6721 C C . TRP C 184 ? 0.7621 0.9729 0.9366 -0.1756 0.0257 0.0907 265 TRP C C 6722 O O . TRP C 184 ? 0.8680 1.0998 1.0528 -0.1885 0.0271 0.0902 265 TRP C O 6723 C CB . TRP C 184 ? 0.9416 1.1007 1.0917 -0.1821 0.0256 0.0796 265 TRP C CB 6724 C CG . TRP C 184 ? 0.8715 1.0269 1.0227 -0.2013 0.0317 0.0757 265 TRP C CG 6725 C CD1 . TRP C 184 ? 0.8179 0.9729 0.9669 -0.2180 0.0302 0.0679 265 TRP C CD1 6726 C CD2 . TRP C 184 ? 0.8503 1.0013 1.0044 -0.2062 0.0407 0.0793 265 TRP C CD2 6727 N NE1 . TRP C 184 ? 0.8076 0.9576 0.9579 -0.2334 0.0380 0.0661 265 TRP C NE1 6728 C CE2 . TRP C 184 ? 0.8565 1.0039 1.0100 -0.2264 0.0446 0.0733 265 TRP C CE2 6729 C CE3 . TRP C 184 ? 0.8717 1.0210 1.0281 -0.1959 0.0462 0.0869 265 TRP C CE3 6730 C CZ2 . TRP C 184 ? 0.7975 0.9392 0.9530 -0.2364 0.0539 0.0748 265 TRP C CZ2 6731 C CZ3 . TRP C 184 ? 0.9649 1.1094 1.1234 -0.2054 0.0552 0.0887 265 TRP C CZ3 6732 C CH2 . TRP C 184 ? 0.8449 0.9855 1.0031 -0.2255 0.0591 0.0828 265 TRP C CH2 6733 N N . LYS C 185 ? 0.6903 0.8906 0.8619 -0.1606 0.0292 0.0966 266 LYS C N 6734 C CA . LYS C 185 ? 0.9087 1.1182 1.0879 -0.1592 0.0360 0.1028 266 LYS C CA 6735 C C . LYS C 185 ? 0.9665 1.1441 1.1346 -0.1557 0.0442 0.1045 266 LYS C C 6736 O O . LYS C 185 ? 0.9680 1.1224 1.1246 -0.1450 0.0435 0.1043 266 LYS C O 6737 C CB . LYS C 185 ? 0.9156 1.1482 1.1036 -0.1439 0.0334 0.1096 266 LYS C CB 6738 C CG . LYS C 185 ? 1.0401 1.2861 1.2373 -0.1424 0.0404 0.1161 266 LYS C CG 6739 C CD . LYS C 185 ? 1.2955 1.5578 1.5025 -0.1612 0.0438 0.1144 266 LYS C CD 6740 C CE . LYS C 185 ? 1.3211 1.5985 1.5379 -0.1598 0.0509 0.1211 266 LYS C CE 6741 N NZ . LYS C 185 ? 1.2422 1.5379 1.4695 -0.1787 0.0541 0.1194 266 LYS C NZ 6742 N N . ALA C 186 ? 0.9631 1.1401 1.1346 -0.1649 0.0521 0.1063 267 ALA C N 6743 C CA . ALA C 186 ? 0.8965 1.0470 1.0586 -0.1598 0.0604 0.1097 267 ALA C CA 6744 C C . ALA C 186 ? 0.9600 1.1180 1.1245 -0.1428 0.0614 0.1171 267 ALA C C 6745 O O . ALA C 186 ? 1.0649 1.2508 1.2419 -0.1406 0.0606 0.1209 267 ALA C O 6746 C CB . ALA C 186 ? 0.6396 0.7863 0.8040 -0.1751 0.0690 0.1097 267 ALA C CB 6747 N N . LEU C 187 ? 0.9042 1.0378 1.0567 -0.1306 0.0632 0.1190 268 LEU C N 6748 C CA . LEU C 187 ? 0.8043 0.9424 0.9571 -0.1148 0.0645 0.1251 268 LEU C CA 6749 C C . LEU C 187 ? 0.8897 1.0184 1.0403 -0.1151 0.0741 0.1301 268 LEU C C 6750 O O . LEU C 187 ? 0.9932 1.0990 1.1353 -0.1216 0.0795 0.1291 268 LEU C O 6751 C CB . LEU C 187 ? 0.7106 0.8302 0.8515 -0.1010 0.0604 0.1242 268 LEU C CB 6752 C CG . LEU C 187 ? 0.7023 0.8284 0.8436 -0.0991 0.0511 0.1195 268 LEU C CG 6753 C CD1 . LEU C 187 ? 0.6009 0.7015 0.7284 -0.0904 0.0490 0.1173 268 LEU C CD1 6754 C CD2 . LEU C 187 ? 0.8148 0.9671 0.9657 -0.0900 0.0467 0.1226 268 LEU C CD2 6755 N N . ASP C 188 ? 0.8034 0.9493 0.9612 -0.1075 0.0766 0.1358 269 ASP C N 6756 C CA . ASP C 188 ? 0.9708 1.1099 1.1268 -0.1072 0.0858 0.1410 269 ASP C CA 6757 C C . ASP C 188 ? 0.9597 1.0756 1.1018 -0.0930 0.0879 0.1436 269 ASP C C 6758 O O . ASP C 188 ? 0.9429 1.0658 1.0849 -0.0798 0.0866 0.1467 269 ASP C O 6759 C CB . ASP C 188 ? 1.0530 1.2216 1.2230 -0.1057 0.0881 0.1459 269 ASP C CB 6760 C CG . ASP C 188 ? 1.0846 1.2499 1.2553 -0.1100 0.0982 0.1506 269 ASP C CG 6761 O OD1 . ASP C 188 ? 1.1798 1.3227 1.3422 -0.1180 0.1032 0.1495 269 ASP C OD1 6762 O OD2 . ASP C 188 ? 0.9960 1.1806 1.1751 -0.1051 0.1014 0.1556 269 ASP C OD2 6763 N N . THR C 189 ? 0.8672 0.9555 0.9972 -0.0959 0.0913 0.1424 270 THR C N 6764 C CA . THR C 189 ? 0.7927 0.8591 0.9091 -0.0836 0.0935 0.1452 270 THR C CA 6765 C C . THR C 189 ? 0.8784 0.9317 0.9895 -0.0857 0.1034 0.1502 270 THR C C 6766 O O . THR C 189 ? 0.9705 0.9990 1.0690 -0.0828 0.1065 0.1511 270 THR C O 6767 C CB . THR C 189 ? 0.7143 0.7585 0.8193 -0.0816 0.0890 0.1405 270 THR C CB 6768 O OG1 . THR C 189 ? 0.7537 0.7864 0.8575 -0.0956 0.0912 0.1369 270 THR C OG1 6769 C CG2 . THR C 189 ? 0.7092 0.7649 0.8173 -0.0760 0.0794 0.1365 270 THR C CG2 6770 N N . THR C 190 ? 0.8214 0.8921 0.9425 -0.0906 0.1086 0.1539 271 THR C N 6771 C CA . THR C 190 ? 0.9351 0.9955 1.0520 -0.0925 0.1186 0.1593 271 THR C CA 6772 C C . THR C 190 ? 0.9320 0.9851 1.0397 -0.0767 0.1204 0.1641 271 THR C C 6773 O O . THR C 190 ? 0.8151 0.8853 0.9276 -0.0676 0.1181 0.1658 271 THR C O 6774 C CB . THR C 190 ? 1.0130 1.0960 1.1437 -0.1020 0.1238 0.1620 271 THR C CB 6775 O OG1 . THR C 190 ? 1.0818 1.1923 1.2264 -0.1048 0.1170 0.1590 271 THR C OG1 6776 C CG2 . THR C 190 ? 0.9614 1.0331 1.0918 -0.1183 0.1307 0.1611 271 THR C CG2 6777 N N . GLY C 191 ? 0.9599 0.9876 1.0537 -0.0733 0.1247 0.1664 272 GLY C N 6778 C CA . GLY C 191 ? 0.8404 0.8605 0.9241 -0.0594 0.1269 0.1711 272 GLY C CA 6779 C C . GLY C 191 ? 0.9382 0.9474 1.0118 -0.0478 0.1200 0.1685 272 GLY C C 6780 O O . GLY C 191 ? 0.9430 0.9443 1.0066 -0.0369 0.1217 0.1719 272 GLY C O 6781 N N . PHE C 192 ? 0.9658 0.9754 1.0416 -0.0503 0.1124 0.1625 273 PHE C N 6782 C CA . PHE C 192 ? 0.9098 0.9074 0.9758 -0.0407 0.1061 0.1597 273 PHE C CA 6783 C C . PHE C 192 ? 0.9910 0.9767 1.0549 -0.0473 0.1017 0.1542 273 PHE C C 6784 O O . PHE C 192 ? 1.0898 1.0770 1.1601 -0.0599 0.1030 0.1517 273 PHE C O 6785 C CB . PHE C 192 ? 0.9381 0.9517 1.0076 -0.0311 0.0997 0.1581 273 PHE C CB 6786 C CG . PHE C 192 ? 0.9541 0.9873 1.0366 -0.0368 0.0943 0.1541 273 PHE C CG 6787 C CD1 . PHE C 192 ? 0.9971 1.0511 1.0924 -0.0423 0.0972 0.1563 273 PHE C CD1 6788 C CD2 . PHE C 192 ? 0.9475 0.9795 1.0298 -0.0362 0.0863 0.1486 273 PHE C CD2 6789 C CE1 . PHE C 192 ? 0.9515 1.0255 1.0590 -0.0470 0.0920 0.1532 273 PHE C CE1 6790 C CE2 . PHE C 192 ? 0.9594 1.0103 1.0533 -0.0410 0.0812 0.1455 273 PHE C CE2 6791 C CZ . PHE C 192 ? 0.8724 0.9447 0.9789 -0.0463 0.0840 0.1479 273 PHE C CZ 6792 N N . ASN C 193 ? 0.9285 0.9025 0.9832 -0.0389 0.0968 0.1520 274 ASN C N 6793 C CA . ASN C 193 ? 0.7648 0.7267 0.8162 -0.0429 0.0923 0.1467 274 ASN C CA 6794 C C . ASN C 193 ? 0.7820 0.7537 0.8358 -0.0372 0.0830 0.1419 274 ASN C C 6795 O O . ASN C 193 ? 0.8567 0.8345 0.9081 -0.0266 0.0805 0.1431 274 ASN C O 6796 C CB . ASN C 193 ? 0.7304 0.6676 0.7681 -0.0383 0.0957 0.1488 274 ASN C CB 6797 C CG . ASN C 193 ? 0.8527 0.7766 0.8859 -0.0402 0.0913 0.1436 274 ASN C CG 6798 O OD1 . ASN C 193 ? 0.8135 0.7373 0.8518 -0.0511 0.0904 0.1393 274 ASN C OD1 6799 N ND2 . ASN C 193 ? 0.7236 0.6370 0.7470 -0.0297 0.0883 0.1437 274 ASN C ND2 6800 N N . PHE C 194 ? 0.7077 0.6806 0.7654 -0.0445 0.0781 0.1363 275 PHE C N 6801 C CA . PHE C 194 ? 0.7203 0.7044 0.7816 -0.0406 0.0696 0.1320 275 PHE C CA 6802 C C . PHE C 194 ? 0.7956 0.7670 0.8518 -0.0430 0.0648 0.1264 275 PHE C C 6803 O O . PHE C 194 ? 0.7595 0.7379 0.8220 -0.0516 0.0612 0.1220 275 PHE C O 6804 C CB . PHE C 194 ? 0.6397 0.6479 0.7149 -0.0470 0.0676 0.1311 275 PHE C CB 6805 C CG . PHE C 194 ? 0.7773 0.7999 0.8565 -0.0400 0.0604 0.1289 275 PHE C CG 6806 C CD1 . PHE C 194 ? 0.7801 0.8079 0.8572 -0.0281 0.0603 0.1318 275 PHE C CD1 6807 C CD2 . PHE C 194 ? 0.7076 0.7383 0.7920 -0.0453 0.0540 0.1240 275 PHE C CD2 6808 C CE1 . PHE C 194 ? 0.7373 0.7767 0.8173 -0.0214 0.0545 0.1300 275 PHE C CE1 6809 C CE2 . PHE C 194 ? 0.6422 0.6855 0.7298 -0.0383 0.0479 0.1227 275 PHE C CE2 6810 C CZ . PHE C 194 ? 0.6925 0.7396 0.7779 -0.0262 0.0484 0.1257 275 PHE C CZ 6811 N N . GLU C 195 ? 0.7811 0.7350 0.8261 -0.0355 0.0646 0.1267 276 GLU C N 6812 C CA . GLU C 195 ? 0.7988 0.7392 0.8383 -0.0372 0.0610 0.1218 276 GLU C CA 6813 C C . GLU C 195 ? 0.6930 0.6388 0.7314 -0.0297 0.0531 0.1182 276 GLU C C 6814 O O . GLU C 195 ? 0.7010 0.6545 0.7387 -0.0206 0.0513 0.1201 276 GLU C O 6815 C CB . GLU C 195 ? 0.7330 0.6505 0.7609 -0.0338 0.0659 0.1242 276 GLU C CB 6816 C CG . GLU C 195 ? 0.7574 0.6654 0.7845 -0.0409 0.0747 0.1280 276 GLU C CG 6817 C CD . GLU C 195 ? 0.9895 0.8899 1.0188 -0.0542 0.0765 0.1238 276 GLU C CD 6818 O OE1 . GLU C 195 ? 1.2081 1.1034 1.2357 -0.0562 0.0719 0.1184 276 GLU C OE1 6819 O OE2 . GLU C 195 ? 1.1145 1.0136 1.1468 -0.0631 0.0830 0.1258 276 GLU C OE2 6820 N N . PHE C 196 ? 0.7046 0.6454 0.7421 -0.0340 0.0488 0.1129 277 PHE C N 6821 C CA . PHE C 196 ? 0.7041 0.6472 0.7394 -0.0275 0.0416 0.1092 277 PHE C CA 6822 C C . PHE C 196 ? 0.7252 0.6870 0.7666 -0.0222 0.0373 0.1094 277 PHE C C 6823 O O . PHE C 196 ? 0.7188 0.6795 0.7553 -0.0127 0.0347 0.1095 277 PHE C O 6824 C CB . PHE C 196 ? 0.5831 0.5114 0.6075 -0.0177 0.0421 0.1105 277 PHE C CB 6825 C CG . PHE C 196 ? 0.7832 0.6926 0.8006 -0.0198 0.0477 0.1122 277 PHE C CG 6826 C CD1 . PHE C 196 ? 0.9829 0.8815 0.9992 -0.0277 0.0481 0.1084 277 PHE C CD1 6827 C CD2 . PHE C 196 ? 0.8067 0.7089 0.8183 -0.0139 0.0530 0.1178 277 PHE C CD2 6828 C CE1 . PHE C 196 ? 0.8586 0.7380 0.8678 -0.0293 0.0542 0.1103 277 PHE C CE1 6829 C CE2 . PHE C 196 ? 0.7607 0.6447 0.7654 -0.0150 0.0588 0.1202 277 PHE C CE2 6830 C CZ . PHE C 196 ? 0.7222 0.5942 0.7257 -0.0226 0.0596 0.1165 277 PHE C CZ 6831 N N . PRO C 197 ? 0.7217 0.7008 0.7735 -0.0281 0.0367 0.1096 278 PRO C N 6832 C CA . PRO C 197 ? 0.7052 0.7007 0.7618 -0.0213 0.0330 0.1102 278 PRO C CA 6833 C C . PRO C 197 ? 0.7474 0.7421 0.8012 -0.0173 0.0262 0.1059 278 PRO C C 6834 O O . PRO C 197 ? 0.6956 0.6862 0.7490 -0.0235 0.0230 0.1017 278 PRO C O 6835 C CB . PRO C 197 ? 0.7497 0.7645 0.8185 -0.0291 0.0332 0.1111 278 PRO C CB 6836 C CG . PRO C 197 ? 0.6691 0.6776 0.7390 -0.0416 0.0346 0.1084 278 PRO C CG 6837 C CD . PRO C 197 ? 0.5519 0.5374 0.6113 -0.0404 0.0392 0.1092 278 PRO C CD 6838 N N . THR C 198 ? 0.7274 0.7249 0.7784 -0.0073 0.0245 0.1067 279 THR C N 6839 C CA . THR C 198 ? 0.7599 0.7594 0.8093 -0.0034 0.0185 0.1032 279 THR C CA 6840 C C . THR C 198 ? 0.7227 0.7407 0.7801 -0.0003 0.0173 0.1051 279 THR C C 6841 O O . THR C 198 ? 0.8038 0.8288 0.8637 0.0040 0.0212 0.1091 279 THR C O 6842 C CB . THR C 198 ? 0.8451 0.8323 0.8842 0.0056 0.0176 0.1021 279 THR C CB 6843 O OG1 . THR C 198 ? 0.7841 0.7694 0.8198 0.0113 0.0223 0.1060 279 THR C OG1 6844 C CG2 . THR C 198 ? 1.0459 1.0173 1.0781 0.0030 0.0168 0.0993 279 THR C CG2 6845 N N . CYS C 199 ? 0.7164 0.7425 0.7776 -0.0020 0.0123 0.1025 280 CYS C N 6846 C CA . CYS C 199 ? 0.7433 0.7892 0.8138 -0.0006 0.0113 0.1050 280 CYS C CA 6847 C C . CYS C 199 ? 0.8544 0.9037 0.9233 0.0064 0.0070 0.1037 280 CYS C C 6848 O O . CYS C 199 ? 0.8870 0.9251 0.9489 0.0075 0.0037 0.0999 280 CYS C O 6849 C CB . CYS C 199 ? 0.7065 0.7651 0.7863 -0.0116 0.0101 0.1046 280 CYS C CB 6850 S SG . CYS C 199 ? 0.9716 1.0230 1.0523 -0.0218 0.0157 0.1053 280 CYS C SG 6851 N N . TYR C 200 ? 0.9160 0.9809 0.9914 0.0115 0.0076 0.1071 281 TYR C N 6852 C CA . TYR C 200 ? 0.7746 0.8452 0.8500 0.0176 0.0040 0.1067 281 TYR C CA 6853 C C . TYR C 200 ? 0.7166 0.8103 0.8037 0.0176 0.0036 0.1107 281 TYR C C 6854 O O . TYR C 200 ? 0.8436 0.9483 0.9381 0.0151 0.0071 0.1140 281 TYR C O 6855 C CB . TYR C 200 ? 0.7285 0.7888 0.7955 0.0282 0.0062 0.1070 281 TYR C CB 6856 C CG . TYR C 200 ? 0.8082 0.8739 0.8773 0.0343 0.0120 0.1114 281 TYR C CG 6857 C CD1 . TYR C 200 ? 0.7993 0.8576 0.8653 0.0333 0.0164 0.1124 281 TYR C CD1 6858 C CD2 . TYR C 200 ? 0.6801 0.7576 0.7535 0.0417 0.0134 0.1147 281 TYR C CD2 6859 C CE1 . TYR C 200 ? 0.7962 0.8594 0.8634 0.0389 0.0219 0.1163 281 TYR C CE1 6860 C CE2 . TYR C 200 ? 0.7976 0.8796 0.8725 0.0476 0.0192 0.1186 281 TYR C CE2 6861 C CZ . TYR C 200 ? 0.8556 0.9305 0.9273 0.0459 0.0234 0.1191 281 TYR C CZ 6862 O OH . TYR C 200 ? 1.0197 1.0989 1.0922 0.0517 0.0293 0.1228 281 TYR C OH 6863 N N . TYR C 201 ? 0.7006 0.8025 0.7895 0.0206 -0.0005 0.1106 282 TYR C N 6864 C CA . TYR C 201 ? 0.7320 0.8575 0.8319 0.0223 -0.0010 0.1150 282 TYR C CA 6865 C C . TYR C 201 ? 0.7994 0.9269 0.8977 0.0352 0.0012 0.1185 282 TYR C C 6866 O O . TYR C 201 ? 0.8784 0.9929 0.9679 0.0408 -0.0001 0.1163 282 TYR C O 6867 C CB . TYR C 201 ? 0.7088 0.8452 0.8128 0.0158 -0.0074 0.1131 282 TYR C CB 6868 C CG . TYR C 201 ? 0.7538 0.9164 0.8690 0.0181 -0.0089 0.1179 282 TYR C CG 6869 C CD1 . TYR C 201 ? 0.8216 1.0041 0.9482 0.0111 -0.0081 0.1205 282 TYR C CD1 6870 C CD2 . TYR C 201 ? 0.7569 0.9248 0.8711 0.0275 -0.0108 0.1203 282 TYR C CD2 6871 C CE1 . TYR C 201 ? 0.9040 1.1129 1.0416 0.0135 -0.0095 0.1253 282 TYR C CE1 6872 C CE2 . TYR C 201 ? 0.7820 0.9750 0.9067 0.0307 -0.0120 0.1256 282 TYR C CE2 6873 C CZ . TYR C 201 ? 0.9439 1.1583 1.0805 0.0238 -0.0116 0.1281 282 TYR C CZ 6874 O OH . TYR C 201 ? 0.8794 1.1214 1.0272 0.0270 -0.0129 0.1336 282 TYR C OH 6875 N N . THR C 202 ? 0.7689 0.9121 0.8753 0.0397 0.0051 0.1239 283 THR C N 6876 C CA . THR C 202 ? 0.9574 1.1067 1.0644 0.0516 0.0070 0.1279 283 THR C CA 6877 C C . THR C 202 ? 0.9103 1.0836 1.0299 0.0541 0.0101 0.1342 283 THR C C 6878 O O . THR C 202 ? 0.9129 1.0929 1.0384 0.0481 0.0127 0.1352 283 THR C O 6879 C CB . THR C 202 ? 1.0362 1.1653 1.1317 0.0604 0.0117 0.1268 283 THR C CB 6880 O OG1 . THR C 202 ? 1.1086 1.2405 1.2029 0.0716 0.0136 0.1299 283 THR C OG1 6881 C CG2 . THR C 202 ? 0.9562 1.0835 1.0522 0.0608 0.0179 0.1285 283 THR C CG2 6882 N N . SER C 203 ? 0.9348 1.1212 1.0586 0.0629 0.0100 0.1386 284 SER C N 6883 C CA . SER C 203 ? 0.9258 1.1358 1.0615 0.0680 0.0135 0.1454 284 SER C CA 6884 C C . SER C 203 ? 0.9000 1.1332 1.0490 0.0570 0.0111 0.1467 284 SER C C 6885 O O . SER C 203 ? 0.8495 1.0969 1.0072 0.0574 0.0155 0.1508 284 SER C O 6886 C CB . SER C 203 ? 1.0089 1.2110 1.1416 0.0756 0.0218 0.1476 284 SER C CB 6887 O OG . SER C 203 ? 1.1080 1.2939 1.2303 0.0870 0.0250 0.1475 284 SER C OG 6888 N N . GLY C 204 ? 0.8190 1.0554 0.9691 0.0467 0.0044 0.1430 285 GLY C N 6889 C CA . GLY C 204 ? 0.8882 1.1462 1.0500 0.0350 0.0018 0.1433 285 GLY C CA 6890 C C . GLY C 204 ? 0.9976 1.2469 1.1590 0.0234 0.0041 0.1399 285 GLY C C 6891 O O . GLY C 204 ? 1.0039 1.2686 1.1740 0.0119 0.0023 0.1392 285 GLY C O 6892 N N . LYS C 205 ? 0.9686 1.1936 1.1199 0.0262 0.0084 0.1377 286 LYS C N 6893 C CA . LYS C 205 ? 0.9299 1.1444 1.0794 0.0162 0.0110 0.1349 286 LYS C CA 6894 C C . LYS C 205 ? 0.9139 1.1013 1.0505 0.0121 0.0089 0.1286 286 LYS C C 6895 O O . LYS C 205 ? 0.8875 1.0589 1.0141 0.0199 0.0080 0.1269 286 LYS C O 6896 C CB . LYS C 205 ? 0.8904 1.1026 1.0403 0.0218 0.0188 0.1387 286 LYS C CB 6897 C CG . LYS C 205 ? 1.0430 1.2829 1.2072 0.0226 0.0218 0.1447 286 LYS C CG 6898 C CD . LYS C 205 ? 1.1798 1.4175 1.3429 0.0334 0.0294 0.1491 286 LYS C CD 6899 C CE . LYS C 205 ? 1.2959 1.5630 1.4732 0.0379 0.0319 0.1557 286 LYS C CE 6900 N NZ . LYS C 205 ? 1.4063 1.6963 1.5936 0.0341 0.0253 0.1566 286 LYS C NZ 6901 N N . VAL C 206 ? 0.8850 1.0675 1.0217 -0.0003 0.0082 0.1252 287 VAL C N 6902 C CA . VAL C 206 ? 0.8362 0.9922 0.9609 -0.0032 0.0084 0.1204 287 VAL C CA 6903 C C . VAL C 206 ? 0.7888 0.9335 0.9094 0.0004 0.0152 0.1225 287 VAL C C 6904 O O . VAL C 206 ? 0.6750 0.8305 0.8030 -0.0030 0.0195 0.1258 287 VAL C O 6905 C CB . VAL C 206 ? 0.7567 0.9093 0.8818 -0.0174 0.0061 0.1160 287 VAL C CB 6906 C CG1 . VAL C 206 ? 0.8262 0.9509 0.9387 -0.0186 0.0071 0.1118 287 VAL C CG1 6907 C CG2 . VAL C 206 ? 0.7013 0.8660 0.8300 -0.0219 -0.0007 0.1135 287 VAL C CG2 6908 N N . LYS C 207 ? 0.7826 0.9066 0.8915 0.0073 0.0162 0.1208 288 LYS C N 6909 C CA . LYS C 207 ? 0.8334 0.9461 0.9369 0.0111 0.0223 0.1227 288 LYS C CA 6910 C C . LYS C 207 ? 0.9280 1.0178 1.0208 0.0073 0.0224 0.1189 288 LYS C C 6911 O O . LYS C 207 ? 0.8898 0.9673 0.9750 0.0089 0.0185 0.1151 288 LYS C O 6912 C CB . LYS C 207 ? 0.7742 0.8855 0.8735 0.0241 0.0247 0.1249 288 LYS C CB 6913 C CG . LYS C 207 ? 0.7147 0.8481 0.8244 0.0292 0.0254 0.1293 288 LYS C CG 6914 C CD . LYS C 207 ? 0.7684 0.8979 0.8731 0.0417 0.0299 0.1318 288 LYS C CD 6915 C CE . LYS C 207 ? 0.8230 0.9714 0.9361 0.0491 0.0304 0.1360 288 LYS C CE 6916 N NZ . LYS C 207 ? 0.9393 1.0770 1.0434 0.0612 0.0329 0.1360 288 LYS C NZ 6917 N N . CYS C 208 ? 0.8252 0.9098 0.9176 0.0025 0.0271 0.1204 289 CYS C N 6918 C CA . CYS C 208 ? 0.8298 0.8939 0.9129 -0.0013 0.0278 0.1177 289 CYS C CA 6919 C C . CYS C 208 ? 0.8511 0.9042 0.9271 0.0039 0.0336 0.1206 289 CYS C C 6920 O O . CYS C 208 ? 0.9542 1.0163 1.0346 0.0057 0.0383 0.1248 289 CYS C O 6921 C CB . CYS C 208 ? 0.6941 0.7589 0.7818 -0.0141 0.0280 0.1163 289 CYS C CB 6922 S SG . CYS C 208 ? 1.1382 1.2147 1.2323 -0.0213 0.0209 0.1123 289 CYS C SG 6923 N N . THR C 209 ? 0.8253 0.8598 0.8903 0.0064 0.0331 0.1184 290 THR C N 6924 C CA . THR C 209 ? 0.6241 0.6477 0.6813 0.0106 0.0382 0.1211 290 THR C CA 6925 C C . THR C 209 ? 0.6640 0.6739 0.7173 0.0037 0.0400 0.1206 290 THR C C 6926 O O . THR C 209 ? 0.7733 0.7725 0.8218 0.0018 0.0365 0.1170 290 THR C O 6927 C CB . THR C 209 ? 0.6385 0.6522 0.6852 0.0200 0.0367 0.1195 290 THR C CB 6928 O OG1 . THR C 209 ? 0.9190 0.9432 0.9682 0.0267 0.0359 0.1198 290 THR C OG1 6929 C CG2 . THR C 209 ? 0.7987 0.8030 0.8373 0.0238 0.0417 0.1225 290 THR C CG2 6930 N N . GLY C 210 ? 0.6460 0.6558 0.7011 0.0000 0.0459 0.1245 291 GLY C N 6931 C CA . GLY C 210 ? 0.7531 0.7482 0.8038 -0.0063 0.0488 0.1247 291 GLY C CA 6932 C C . GLY C 210 ? 0.7700 0.7505 0.8095 0.0005 0.0525 0.1274 291 GLY C C 6933 O O . GLY C 210 ? 0.7955 0.7777 0.8303 0.0094 0.0525 0.1287 291 GLY C O 6934 N N . THR C 211 ? 0.6947 0.6609 0.7295 -0.0040 0.0559 0.1284 292 THR C N 6935 C CA . THR C 211 ? 0.6586 0.6111 0.6829 0.0018 0.0599 0.1320 292 THR C CA 6936 C C . THR C 211 ? 0.7752 0.7237 0.8006 -0.0037 0.0677 0.1369 292 THR C C 6937 O O . THR C 211 ? 0.6721 0.6156 0.7009 -0.0133 0.0698 0.1359 292 THR C O 6938 C CB . THR C 211 ? 0.6939 0.6301 0.7097 0.0035 0.0573 0.1294 292 THR C CB 6939 O OG1 . THR C 211 ? 0.8918 0.8319 0.9069 0.0079 0.0503 0.1248 292 THR C OG1 6940 C CG2 . THR C 211 ? 0.7135 0.6375 0.7185 0.0107 0.0612 0.1338 292 THR C CG2 6941 N N . ASN C 212 ? 0.7557 0.7061 0.7778 0.0018 0.0724 0.1419 293 ASN C N 6942 C CA . ASN C 212 ? 0.7407 0.6858 0.7625 -0.0028 0.0804 0.1470 293 ASN C CA 6943 C C . ASN C 212 ? 0.8035 0.7298 0.8129 0.0019 0.0841 0.1505 293 ASN C C 6944 O O . ASN C 212 ? 0.6857 0.6109 0.6872 0.0113 0.0849 0.1537 293 ASN C O 6945 C CB . ASN C 212 ? 0.7590 0.7176 0.7847 -0.0003 0.0845 0.1511 293 ASN C CB 6946 C CG . ASN C 212 ? 0.8272 0.7844 0.8562 -0.0078 0.0925 0.1557 293 ASN C CG 6947 O OD1 . ASN C 212 ? 0.8297 0.7710 0.8529 -0.0111 0.0970 0.1579 293 ASN C OD1 6948 N ND2 . ASN C 212 ? 0.9181 0.8921 0.9566 -0.0104 0.0950 0.1574 293 ASN C ND2 6949 N N . LEU C 213 ? 0.7414 0.6534 0.7489 -0.0045 0.0865 0.1501 294 LEU C N 6950 C CA . LEU C 213 ? 0.7152 0.6084 0.7113 0.0000 0.0907 0.1541 294 LEU C CA 6951 C C . LEU C 213 ? 0.7510 0.6378 0.7440 -0.0015 0.1001 0.1612 294 LEU C C 6952 O O . LEU C 213 ? 0.7411 0.6116 0.7248 0.0017 0.1049 0.1655 294 LEU C O 6953 C CB . LEU C 213 ? 0.5913 0.4692 0.5845 -0.0040 0.0894 0.1506 294 LEU C CB 6954 C CG . LEU C 213 ? 0.6758 0.5571 0.6688 0.0000 0.0806 0.1446 294 LEU C CG 6955 C CD1 . LEU C 213 ? 0.7479 0.6413 0.7518 -0.0086 0.0759 0.1385 294 LEU C CD1 6956 C CD2 . LEU C 213 ? 0.5851 0.4486 0.5698 0.0028 0.0806 0.1441 294 LEU C CD2 6957 N N . TRP C 214 ? 0.7664 0.6667 0.7674 -0.0059 0.1029 0.1627 295 TRP C N 6958 C CA . TRP C 214 ? 0.8510 0.7470 0.8508 -0.0092 0.1121 0.1689 295 TRP C CA 6959 C C . TRP C 214 ? 0.8786 0.7825 0.8744 -0.0003 0.1146 0.1742 295 TRP C C 6960 O O . TRP C 214 ? 0.8189 0.7117 0.8042 0.0059 0.1191 0.1798 295 TRP C O 6961 C CB . TRP C 214 ? 0.8575 0.7629 0.8697 -0.0223 0.1147 0.1671 295 TRP C CB 6962 C CG . TRP C 214 ? 0.8562 0.7599 0.8691 -0.0272 0.1243 0.1730 295 TRP C CG 6963 C CD1 . TRP C 214 ? 0.8233 0.7128 0.8259 -0.0226 0.1317 0.1799 295 TRP C CD1 6964 C CD2 . TRP C 214 ? 0.8742 0.7918 0.8989 -0.0378 0.1277 0.1728 295 TRP C CD2 6965 N NE1 . TRP C 214 ? 0.8703 0.7628 0.8773 -0.0300 0.1398 0.1839 295 TRP C NE1 6966 C CE2 . TRP C 214 ? 0.9088 0.8190 0.9297 -0.0396 0.1375 0.1796 295 TRP C CE2 6967 C CE3 . TRP C 214 ? 0.6194 0.5559 0.6577 -0.0458 0.1234 0.1680 295 TRP C CE3 6968 C CZ2 . TRP C 214 ? 0.6512 0.5723 0.6818 -0.0496 0.1432 0.1812 295 TRP C CZ2 6969 C CZ3 . TRP C 214 ? 0.6989 0.6476 0.7471 -0.0555 0.1287 0.1697 295 TRP C CZ3 6970 C CH2 . TRP C 214 ? 0.8320 0.7729 0.8765 -0.0576 0.1386 0.1761 295 TRP C CH2 6971 N N . ASN C 215 ? 0.9083 0.8313 0.9119 0.0005 0.1119 0.1725 296 ASN C N 6972 C CA . ASN C 215 ? 0.8186 0.7506 0.8205 0.0063 0.1159 0.1772 296 ASN C CA 6973 C C . ASN C 215 ? 0.7986 0.7465 0.8028 0.0135 0.1104 0.1743 296 ASN C C 6974 O O . ASN C 215 ? 0.9856 0.9452 0.9927 0.0155 0.1137 0.1768 296 ASN C O 6975 C CB . ASN C 215 ? 0.7393 0.6789 0.7504 -0.0029 0.1229 0.1801 296 ASN C CB 6976 C CG . ASN C 215 ? 0.8728 0.8267 0.8982 -0.0121 0.1191 0.1749 296 ASN C CG 6977 O OD1 . ASN C 215 ? 0.8991 0.8563 0.9272 -0.0114 0.1114 0.1693 296 ASN C OD1 6978 N ND2 . ASN C 215 ? 0.8546 0.8182 0.8895 -0.0206 0.1244 0.1769 296 ASN C ND2 6979 N N . ASP C 216 ? 0.6690 0.6169 0.6718 0.0172 0.1025 0.1689 297 ASP C N 6980 C CA . ASP C 216 ? 0.8113 0.7720 0.8154 0.0238 0.0976 0.1657 297 ASP C CA 6981 C C . ASP C 216 ? 0.8067 0.7610 0.8026 0.0306 0.0909 0.1617 297 ASP C C 6982 O O . ASP C 216 ? 0.9257 0.8740 0.9230 0.0273 0.0864 0.1580 297 ASP C O 6983 C CB . ASP C 216 ? 0.8847 0.8605 0.9028 0.0179 0.0945 0.1618 297 ASP C CB 6984 C CG . ASP C 216 ? 0.9834 0.9726 1.0032 0.0250 0.0918 0.1600 297 ASP C CG 6985 O OD1 . ASP C 216 ? 0.9925 0.9794 1.0029 0.0334 0.0932 0.1615 297 ASP C OD1 6986 O OD2 . ASP C 216 ? 0.9813 0.9833 1.0116 0.0223 0.0888 0.1572 297 ASP C OD2 6987 N N . ALA C 217 ? 0.8376 0.7940 0.8252 0.0394 0.0902 0.1623 298 ALA C N 6988 C CA . ALA C 217 ? 0.6449 0.5977 0.6248 0.0458 0.0839 0.1582 298 ALA C CA 6989 C C . ALA C 217 ? 0.7563 0.7196 0.7414 0.0473 0.0787 0.1525 298 ALA C C 6990 O O . ALA C 217 ? 0.8302 0.7911 0.8101 0.0513 0.0732 0.1483 298 ALA C O 6991 C CB . ALA C 217 ? 0.6643 0.6138 0.6312 0.0540 0.0859 0.1613 298 ALA C CB 6992 N N . LYS C 218 ? 0.7852 0.7603 0.7801 0.0444 0.0808 0.1528 299 LYS C N 6993 C CA . LYS C 218 ? 0.8601 0.8450 0.8625 0.0445 0.0762 0.1481 299 LYS C CA 6994 C C . LYS C 218 ? 0.7590 0.7442 0.7707 0.0363 0.0727 0.1457 299 LYS C C 6995 O O . LYS C 218 ? 0.8793 0.8564 0.8913 0.0306 0.0744 0.1474 299 LYS C O 6996 C CB . LYS C 218 ? 0.8517 0.8506 0.8611 0.0458 0.0802 0.1501 299 LYS C CB 6997 C CG . LYS C 218 ? 0.8927 0.8927 0.8934 0.0537 0.0841 0.1518 299 LYS C CG 6998 C CD . LYS C 218 ? 0.9703 0.9846 0.9798 0.0543 0.0885 0.1539 299 LYS C CD 6999 C CE . LYS C 218 ? 1.0532 1.0690 1.0552 0.0605 0.0946 0.1569 299 LYS C CE 7000 N NZ . LYS C 218 ? 1.1039 1.1342 1.1159 0.0609 0.0994 0.1593 299 LYS C NZ 7001 N N . ARG C 219 ? 0.7846 0.7784 0.8034 0.0357 0.0681 0.1418 300 ARG C N 7002 C CA . ARG C 219 ? 0.7398 0.7349 0.7669 0.0278 0.0644 0.1391 300 ARG C CA 7003 C C . ARG C 219 ? 0.8643 0.8758 0.9047 0.0226 0.0658 0.1403 300 ARG C C 7004 O O . ARG C 219 ? 0.9159 0.9392 0.9602 0.0274 0.0664 0.1409 300 ARG C O 7005 C CB . ARG C 219 ? 0.5982 0.5896 0.6225 0.0301 0.0572 0.1336 300 ARG C CB 7006 C CG . ARG C 219 ? 0.5433 0.5201 0.5554 0.0345 0.0554 0.1322 300 ARG C CG 7007 C CD . ARG C 219 ? 0.6274 0.6016 0.6378 0.0359 0.0485 0.1267 300 ARG C CD 7008 N NE . ARG C 219 ? 0.6911 0.6523 0.6917 0.0382 0.0466 0.1254 300 ARG C NE 7009 C CZ . ARG C 219 ? 0.6960 0.6475 0.6956 0.0339 0.0468 0.1258 300 ARG C CZ 7010 N NH1 . ARG C 219 ? 0.6208 0.5730 0.6279 0.0260 0.0488 0.1268 300 ARG C NH1 7011 N NH2 . ARG C 219 ? 0.8678 0.8089 0.8587 0.0374 0.0452 0.1251 300 ARG C NH2 7012 N N . PRO C 220 ? 0.9471 0.9597 0.9947 0.0128 0.0667 0.1406 301 PRO C N 7013 C CA . PRO C 220 ? 0.6951 0.7258 0.7563 0.0069 0.0673 0.1415 301 PRO C CA 7014 C C . PRO C 220 ? 0.6846 0.7251 0.7518 0.0074 0.0605 0.1374 301 PRO C C 7015 O O . PRO C 220 ? 0.7047 0.7357 0.7665 0.0083 0.0552 0.1333 301 PRO C O 7016 C CB . PRO C 220 ? 0.6862 0.7122 0.7510 -0.0046 0.0699 0.1419 301 PRO C CB 7017 C CG . PRO C 220 ? 0.7837 0.7893 0.8380 -0.0047 0.0678 0.1394 301 PRO C CG 7018 C CD . PRO C 220 ? 0.9389 0.9364 0.9820 0.0066 0.0679 0.1406 301 PRO C CD 7019 N N . PHE C 221 ? 0.6596 0.7194 0.7377 0.0071 0.0607 0.1389 302 PHE C N 7020 C CA . PHE C 221 ? 0.7052 0.7763 0.7892 0.0089 0.0549 0.1362 302 PHE C CA 7021 C C . PHE C 221 ? 0.7828 0.8734 0.8810 0.0004 0.0538 0.1368 302 PHE C C 7022 O O . PHE C 221 ? 0.8545 0.9562 0.9603 -0.0036 0.0586 0.1405 302 PHE C O 7023 C CB . PHE C 221 ? 0.7961 0.8732 0.8784 0.0204 0.0559 0.1377 302 PHE C CB 7024 C CG . PHE C 221 ? 0.8603 0.9401 0.9426 0.0251 0.0501 0.1345 302 PHE C CG 7025 C CD1 . PHE C 221 ? 0.9863 1.0502 1.0577 0.0288 0.0463 0.1305 302 PHE C CD1 7026 C CD2 . PHE C 221 ? 0.9406 1.0393 1.0336 0.0261 0.0485 0.1358 302 PHE C CD2 7027 C CE1 . PHE C 221 ? 1.0198 1.0852 1.0906 0.0329 0.0414 0.1276 302 PHE C CE1 7028 C CE2 . PHE C 221 ? 1.0158 1.1161 1.1081 0.0310 0.0434 0.1333 302 PHE C CE2 7029 C CZ . PHE C 221 ? 1.0277 1.1106 1.1086 0.0341 0.0400 0.1291 302 PHE C CZ 7030 N N . LEU C 222 ? 0.6720 0.7676 0.7738 -0.0024 0.0474 0.1332 303 LEU C N 7031 C CA . LEU C 222 ? 0.7192 0.8346 0.8338 -0.0106 0.0452 0.1333 303 LEU C CA 7032 C C . LEU C 222 ? 0.8755 1.0042 0.9946 -0.0046 0.0397 0.1325 303 LEU C C 7033 O O . LEU C 222 ? 0.8778 0.9955 0.9888 0.0018 0.0360 0.1298 303 LEU C O 7034 C CB . LEU C 222 ? 0.8704 0.9776 0.9842 -0.0228 0.0425 0.1291 303 LEU C CB 7035 C CG . LEU C 222 ? 0.8923 1.0123 1.0164 -0.0365 0.0440 0.1292 303 LEU C CG 7036 C CD1 . LEU C 222 ? 0.8655 0.9803 0.9884 -0.0462 0.0388 0.1235 303 LEU C CD1 7037 C CD2 . LEU C 222 ? 0.8381 0.9865 0.9762 -0.0366 0.0444 0.1328 303 LEU C CD2 7038 N N . GLU C 223 ? 0.9639 1.1168 1.0959 -0.0065 0.0396 0.1353 304 GLU C N 7039 C CA . GLU C 223 ? 0.8647 1.0326 1.0023 -0.0031 0.0339 0.1349 304 GLU C CA 7040 C C . GLU C 223 ? 0.8016 0.9924 0.9526 -0.0140 0.0318 0.1353 304 GLU C C 7041 O O . GLU C 223 ? 0.7851 0.9855 0.9433 -0.0209 0.0362 0.1377 304 GLU C O 7042 C CB . GLU C 223 ? 0.8591 1.0351 0.9979 0.0106 0.0361 0.1389 304 GLU C CB 7043 C CG . GLU C 223 ? 1.1522 1.3491 1.3022 0.0123 0.0416 0.1447 304 GLU C CG 7044 C CD . GLU C 223 ? 1.3328 1.5347 1.4822 0.0268 0.0445 0.1485 304 GLU C CD 7045 O OE1 . GLU C 223 ? 1.3427 1.5663 1.5032 0.0297 0.0476 0.1534 304 GLU C OE1 7046 O OE2 . GLU C 223 ? 1.3184 1.5025 1.4563 0.0350 0.0440 0.1463 304 GLU C OE2 7047 N N . PHE C 224 ? 0.6978 0.8974 0.8518 -0.0164 0.0251 0.1329 305 PHE C N 7048 C CA . PHE C 224 ? 0.8084 1.0316 0.9747 -0.0271 0.0222 0.1328 305 PHE C CA 7049 C C . PHE C 224 ? 0.8584 1.0952 1.0279 -0.0246 0.0149 0.1320 305 PHE C C 7050 O O . PHE C 224 ? 0.7331 0.9552 0.8933 -0.0184 0.0114 0.1294 305 PHE C O 7051 C CB . PHE C 224 ? 0.7082 0.9213 0.8724 -0.0426 0.0223 0.1282 305 PHE C CB 7052 C CG . PHE C 224 ? 0.7947 0.9851 0.9472 -0.0449 0.0182 0.1222 305 PHE C CG 7053 C CD1 . PHE C 224 ? 0.7859 0.9488 0.9259 -0.0408 0.0210 0.1207 305 PHE C CD1 7054 C CD2 . PHE C 224 ? 0.8331 1.0307 0.9871 -0.0511 0.0114 0.1182 305 PHE C CD2 7055 C CE1 . PHE C 224 ? 0.8318 0.9749 0.9615 -0.0427 0.0174 0.1154 305 PHE C CE1 7056 C CE2 . PHE C 224 ? 0.6399 0.8166 0.7830 -0.0532 0.0080 0.1127 305 PHE C CE2 7057 C CZ . PHE C 224 ? 0.7006 0.8503 0.8320 -0.0489 0.0111 0.1113 305 PHE C CZ 7058 N N . ASP C 225 ? 0.8204 1.0862 1.0031 -0.0293 0.0127 0.1343 306 ASP C N 7059 C CA . ASP C 225 ? 0.7891 1.0707 0.9755 -0.0280 0.0056 0.1340 306 ASP C CA 7060 C C . ASP C 225 ? 0.7835 1.0721 0.9728 -0.0442 0.0008 0.1288 306 ASP C C 7061 O O . ASP C 225 ? 0.7829 1.0609 0.9703 -0.0560 0.0035 0.1254 306 ASP C O 7062 C CB . ASP C 225 ? 0.9630 1.2742 1.1617 -0.0190 0.0060 0.1410 306 ASP C CB 7063 C CG . ASP C 225 ? 1.0083 1.3418 1.2202 -0.0254 0.0104 0.1447 306 ASP C CG 7064 O OD1 . ASP C 225 ? 0.9801 1.3198 1.1965 -0.0408 0.0095 0.1415 306 ASP C OD1 7065 O OD2 . ASP C 225 ? 1.0107 1.3552 1.2283 -0.0151 0.0152 0.1509 306 ASP C OD2 7066 N N . GLN C 226 ? 0.7692 1.0749 0.9624 -0.0448 -0.0059 0.1284 307 GLN C N 7067 C CA . GLN C 226 ? 0.8565 1.1676 1.0504 -0.0599 -0.0112 0.1227 307 GLN C CA 7068 C C . GLN C 226 ? 0.9089 1.2421 1.1148 -0.0742 -0.0097 0.1227 307 GLN C C 7069 O O . GLN C 226 ? 0.9258 1.2574 1.1306 -0.0894 -0.0118 0.1168 307 GLN C O 7070 C CB . GLN C 226 ? 0.9822 1.3072 1.1767 -0.0563 -0.0189 0.1226 307 GLN C CB 7071 C CG . GLN C 226 ? 1.0961 1.4516 1.3020 -0.0461 -0.0201 0.1302 307 GLN C CG 7072 C CD . GLN C 226 ? 1.2584 1.6228 1.4624 -0.0404 -0.0272 0.1306 307 GLN C CD 7073 O OE1 . GLN C 226 ? 1.3189 1.6750 1.5161 -0.0483 -0.0322 0.1247 307 GLN C OE1 7074 N NE2 . GLN C 226 ? 1.2244 1.6048 1.4336 -0.0261 -0.0271 0.1378 307 GLN C NE2 7075 N N . SER C 227 ? 0.8776 1.2307 1.0946 -0.0697 -0.0055 0.1291 309 SER C N 7076 C CA . SER C 227 ? 0.9554 1.3309 1.1846 -0.0829 -0.0033 0.1297 309 SER C CA 7077 C C . SER C 227 ? 1.0644 1.4189 1.2894 -0.0905 0.0043 0.1278 309 SER C C 7078 O O . SER C 227 ? 1.2561 1.6258 1.4907 -0.1002 0.0081 0.1290 309 SER C O 7079 C CB . SER C 227 ? 0.9794 1.3887 1.2235 -0.0745 -0.0022 0.1378 309 SER C CB 7080 O OG . SER C 227 ? 1.1326 1.5320 1.3734 -0.0569 0.0022 0.1432 309 SER C OG 7081 N N . PHE C 228 ? 1.0313 1.3513 1.2419 -0.0860 0.0065 0.1250 310 PHE C N 7082 C CA . PHE C 228 ? 0.9560 1.2526 1.1604 -0.0900 0.0140 0.1241 310 PHE C CA 7083 C C . PHE C 228 ? 0.8875 1.1931 1.0988 -0.0833 0.0211 0.1308 310 PHE C C 7084 O O . PHE C 228 ? 0.7583 1.0574 0.9702 -0.0910 0.0274 0.1311 310 PHE C O 7085 C CB . PHE C 228 ? 0.9209 1.2122 1.1249 -0.1093 0.0151 0.1184 310 PHE C CB 7086 C CG . PHE C 228 ? 0.9405 1.2098 1.1326 -0.1148 0.0110 0.1112 310 PHE C CG 7087 C CD1 . PHE C 228 ? 0.9007 1.1514 1.0821 -0.1026 0.0079 0.1103 310 PHE C CD1 7088 C CD2 . PHE C 228 ? 1.0150 1.2818 1.2064 -0.1324 0.0107 0.1051 310 PHE C CD2 7089 C CE1 . PHE C 228 ? 0.8742 1.1052 1.0449 -0.1074 0.0044 0.1039 310 PHE C CE1 7090 C CE2 . PHE C 228 ? 1.0118 1.2576 1.1918 -0.1372 0.0074 0.0983 310 PHE C CE2 7091 C CZ . PHE C 228 ? 0.9105 1.1388 1.0805 -0.1243 0.0042 0.0979 310 PHE C CZ 7092 N N . THR C 229 ? 0.8864 1.2058 1.1022 -0.0688 0.0205 0.1363 311 THR C N 7093 C CA . THR C 229 ? 0.9512 1.2754 1.1711 -0.0600 0.0275 0.1425 311 THR C CA 7094 C C . THR C 229 ? 0.9726 1.2652 1.1780 -0.0490 0.0312 0.1424 311 THR C C 7095 O O . THR C 229 ? 0.8669 1.1497 1.0649 -0.0372 0.0283 0.1423 311 THR C O 7096 C CB . THR C 229 ? 0.8564 1.2107 1.0881 -0.0492 0.0262 0.1488 311 THR C CB 7097 O OG1 . THR C 229 ? 0.8292 1.2150 1.0746 -0.0600 0.0221 0.1488 311 THR C OG1 7098 C CG2 . THR C 229 ? 0.6477 1.0068 0.8836 -0.0405 0.0342 0.1550 311 THR C CG2 7099 N N . TYR C 230 ? 0.9776 1.2544 1.1785 -0.0533 0.0378 0.1424 312 TYR C N 7100 C CA . TYR C 230 ? 0.9821 1.2290 1.1685 -0.0448 0.0410 0.1419 312 TYR C CA 7101 C C . TYR C 230 ? 0.9647 1.2112 1.1517 -0.0380 0.0491 0.1472 312 TYR C C 7102 O O . TYR C 230 ? 0.9338 1.1980 1.1313 -0.0433 0.0535 0.1506 312 TYR C O 7103 C CB . TYR C 230 ? 0.8410 1.0620 1.0170 -0.0550 0.0413 0.1365 312 TYR C CB 7104 C CG . TYR C 230 ? 0.8180 1.0385 0.9976 -0.0675 0.0475 0.1371 312 TYR C CG 7105 C CD1 . TYR C 230 ? 0.8070 1.0423 0.9954 -0.0829 0.0461 0.1345 312 TYR C CD1 7106 C CD2 . TYR C 230 ? 0.7327 0.9378 0.9062 -0.0644 0.0551 0.1401 312 TYR C CD2 7107 C CE1 . TYR C 230 ? 0.8981 1.1318 1.0894 -0.0951 0.0524 0.1348 312 TYR C CE1 7108 C CE2 . TYR C 230 ? 0.7843 0.9880 0.9606 -0.0758 0.0614 0.1409 312 TYR C CE2 7109 C CZ . TYR C 230 ? 0.8521 1.0696 1.0373 -0.0914 0.0602 0.1382 312 TYR C CZ 7110 O OH . TYR C 230 ? 0.8411 1.0563 1.0288 -0.1036 0.0669 0.1388 312 TYR C OH 7111 N N . THR C 231 ? 0.7863 1.0125 0.9615 -0.0264 0.0510 0.1476 313 THR C N 7112 C CA . THR C 231 ? 0.9494 1.1672 1.1206 -0.0213 0.0587 0.1513 313 THR C CA 7113 C C . THR C 231 ? 1.0015 1.1880 1.1560 -0.0175 0.0593 0.1484 313 THR C C 7114 O O . THR C 231 ? 0.8522 1.0272 0.9987 -0.0115 0.0544 0.1452 313 THR C O 7115 C CB . THR C 231 ? 0.9655 1.1994 1.1422 -0.0085 0.0619 0.1566 313 THR C CB 7116 O OG1 . THR C 231 ? 1.0758 1.2928 1.2422 0.0000 0.0679 0.1584 313 THR C OG1 7117 C CG2 . THR C 231 ? 0.8227 1.0629 0.9997 0.0008 0.0560 0.1559 313 THR C CG2 7118 N N . PHE C 232 ? 0.9324 1.1057 1.0818 -0.0216 0.0652 0.1496 314 PHE C N 7119 C CA . PHE C 232 ? 0.8423 0.9886 0.9764 -0.0168 0.0668 0.1482 314 PHE C CA 7120 C C . PHE C 232 ? 0.9303 1.0752 1.0595 -0.0039 0.0713 0.1519 314 PHE C C 7121 O O . PHE C 232 ? 0.9582 1.1170 1.0944 -0.0026 0.0768 0.1564 314 PHE C O 7122 C CB . PHE C 232 ? 0.7889 0.9214 0.9191 -0.0266 0.0717 0.1484 314 PHE C CB 7123 C CG . PHE C 232 ? 0.8440 0.9666 0.9725 -0.0377 0.0679 0.1436 314 PHE C CG 7124 C CD1 . PHE C 232 ? 0.7818 0.8827 0.8982 -0.0350 0.0643 0.1398 314 PHE C CD1 7125 C CD2 . PHE C 232 ? 0.9549 1.0898 1.0934 -0.0514 0.0683 0.1426 314 PHE C CD2 7126 C CE1 . PHE C 232 ? 0.7905 0.8812 0.9048 -0.0450 0.0615 0.1352 314 PHE C CE1 7127 C CE2 . PHE C 232 ? 0.9920 1.1162 1.1278 -0.0621 0.0654 0.1376 314 PHE C CE2 7128 C CZ . PHE C 232 ? 0.8972 0.9988 1.0207 -0.0585 0.0622 0.1340 314 PHE C CZ 7129 N N . LYS C 233 ? 0.8199 0.9486 0.9370 0.0053 0.0692 0.1498 315 LYS C N 7130 C CA . LYS C 233 ? 0.8029 0.9282 0.9135 0.0166 0.0738 0.1525 315 LYS C CA 7131 C C . LYS C 233 ? 0.9066 1.0088 1.0023 0.0191 0.0760 0.1518 315 LYS C C 7132 O O . LYS C 233 ? 1.0087 1.0963 1.0983 0.0142 0.0731 0.1489 315 LYS C O 7133 C CB . LYS C 233 ? 0.7570 0.8873 0.8670 0.0269 0.0705 0.1514 315 LYS C CB 7134 C CG . LYS C 233 ? 0.8250 0.9777 0.9489 0.0251 0.0671 0.1521 315 LYS C CG 7135 C CD . LYS C 233 ? 0.8978 1.0589 1.0227 0.0373 0.0678 0.1539 315 LYS C CD 7136 C CE . LYS C 233 ? 0.9301 1.1153 1.0692 0.0363 0.0647 0.1556 315 LYS C CE 7137 N NZ . LYS C 233 ? 1.0197 1.2110 1.1588 0.0493 0.0658 0.1577 315 LYS C NZ 7138 N N . GLU C 234 ? 0.9425 1.0422 1.0322 0.0270 0.0814 0.1547 316 GLU C N 7139 C CA . GLU C 234 ? 0.9224 1.0024 0.9975 0.0306 0.0833 0.1543 316 GLU C CA 7140 C C . GLU C 234 ? 0.9594 1.0356 1.0256 0.0422 0.0836 0.1532 316 GLU C C 7141 O O . GLU C 234 ? 1.1336 1.2201 1.2028 0.0478 0.0882 0.1559 316 GLU C O 7142 C CB . GLU C 234 ? 0.8174 0.8952 0.8912 0.0274 0.0907 0.1589 316 GLU C CB 7143 C CG . GLU C 234 ? 0.9778 1.0378 1.0361 0.0327 0.0930 0.1595 316 GLU C CG 7144 C CD . GLU C 234 ? 1.1610 1.2040 1.2124 0.0276 0.0901 0.1577 316 GLU C CD 7145 O OE1 . GLU C 234 ? 1.2007 1.2449 1.2592 0.0189 0.0874 0.1561 316 GLU C OE1 7146 O OE2 . GLU C 234 ? 1.1360 1.1650 1.1746 0.0323 0.0908 0.1579 316 GLU C OE2 7147 N N . PRO C 235 ? 0.9421 1.0036 0.9973 0.0455 0.0792 0.1492 317 PRO C N 7148 C CA . PRO C 235 ? 1.0014 1.0578 1.0471 0.0553 0.0792 0.1471 317 PRO C CA 7149 C C . PRO C 235 ? 1.0405 1.0948 1.0788 0.0605 0.0862 0.1503 317 PRO C C 7150 O O . PRO C 235 ? 1.0339 1.0816 1.0673 0.0577 0.0893 0.1528 317 PRO C O 7151 C CB . PRO C 235 ? 0.9108 0.9513 0.9461 0.0553 0.0735 0.1425 317 PRO C CB 7152 C CG . PRO C 235 ? 0.8734 0.9078 0.9098 0.0471 0.0728 0.1435 317 PRO C CG 7153 C CD . PRO C 235 ? 0.8977 0.9461 0.9483 0.0400 0.0745 0.1463 317 PRO C CD 7154 N N . CYS C 236 ? 1.0874 1.1470 1.1244 0.0682 0.0891 0.1502 318 CYS C N 7155 C CA . CYS C 236 ? 1.0730 1.1320 1.1031 0.0736 0.0962 0.1529 318 CYS C CA 7156 C C . CYS C 236 ? 1.0157 1.0602 1.0292 0.0792 0.0953 0.1490 318 CYS C C 7157 O O . CYS C 236 ? 1.0980 1.1411 1.1037 0.0853 0.1003 0.1494 318 CYS C O 7158 C CB . CYS C 236 ? 0.9329 1.0065 0.9713 0.0788 0.1009 0.1552 318 CYS C CB 7159 S SG . CYS C 236 ? 1.3468 1.4416 1.4057 0.0720 0.1022 0.1600 318 CYS C SG 7160 N N . LEU C 237 ? 0.8976 0.9316 0.9057 0.0768 0.0889 0.1453 319 LEU C N 7161 C CA . LEU C 237 ? 0.8237 0.8456 0.8170 0.0812 0.0869 0.1410 319 LEU C CA 7162 C C . LEU C 237 ? 0.9362 0.9481 0.9194 0.0794 0.0863 0.1418 319 LEU C C 7163 O O . LEU C 237 ? 1.0407 1.0490 1.0269 0.0740 0.0831 0.1426 319 LEU C O 7164 C CB . LEU C 237 ? 0.9076 0.9258 0.9012 0.0815 0.0802 0.1356 319 LEU C CB 7165 C CG . LEU C 237 ? 0.9621 0.9817 0.9538 0.0878 0.0815 0.1327 319 LEU C CG 7166 C CD1 . LEU C 237 ? 0.9876 1.0187 0.9867 0.0914 0.0882 0.1368 319 LEU C CD1 7167 C CD2 . LEU C 237 ? 0.9085 0.9284 0.9059 0.0865 0.0754 0.1294 319 LEU C CD2 7168 N N . GLY C 238 ? 1.0502 1.0577 1.0211 0.0842 0.0897 0.1415 320 GLY C N 7169 C CA . GLY C 238 ? 0.9658 0.9655 0.9259 0.0839 0.0897 0.1430 320 GLY C CA 7170 C C . GLY C 238 ? 0.9986 0.9897 0.9517 0.0834 0.0828 0.1387 320 GLY C C 7171 O O . GLY C 238 ? 0.8967 0.8820 0.8407 0.0839 0.0822 0.1400 320 GLY C O 7172 N N . PHE C 239 ? 1.0263 1.0169 0.9834 0.0827 0.0777 0.1339 321 PHE C N 7173 C CA . PHE C 239 ? 0.9986 0.9820 0.9515 0.0813 0.0709 0.1297 321 PHE C CA 7174 C C . PHE C 239 ? 0.8955 0.8773 0.8568 0.0756 0.0680 0.1320 321 PHE C C 7175 O O . PHE C 239 ? 0.7988 0.7840 0.7705 0.0721 0.0655 0.1309 321 PHE C O 7176 C CB . PHE C 239 ? 0.9368 0.9199 0.8905 0.0828 0.0674 0.1238 321 PHE C CB 7177 C CG . PHE C 239 ? 0.8961 0.8721 0.8436 0.0819 0.0610 0.1190 321 PHE C CG 7178 C CD1 . PHE C 239 ? 0.7638 0.7353 0.6981 0.0845 0.0604 0.1164 321 PHE C CD1 7179 C CD2 . PHE C 239 ? 0.8400 0.8150 0.7950 0.0785 0.0558 0.1168 321 PHE C CD2 7180 C CE1 . PHE C 239 ? 0.8022 0.7690 0.7316 0.0836 0.0546 0.1119 321 PHE C CE1 7181 C CE2 . PHE C 239 ? 0.8017 0.7707 0.7512 0.0778 0.0503 0.1124 321 PHE C CE2 7182 C CZ . PHE C 239 ? 0.8139 0.7791 0.7509 0.0804 0.0497 0.1100 321 PHE C CZ 7183 N N . LEU C 240 ? 0.7631 0.7396 0.7191 0.0748 0.0686 0.1352 322 LEU C N 7184 C CA . LEU C 240 ? 0.7808 0.7544 0.7437 0.0694 0.0684 0.1384 322 LEU C CA 7185 C C . LEU C 240 ? 0.7629 0.7316 0.7286 0.0663 0.0619 0.1346 322 LEU C C 7186 O O . LEU C 240 ? 0.8221 0.7848 0.7796 0.0686 0.0583 0.1323 322 LEU C O 7187 C CB . LEU C 240 ? 0.8286 0.7967 0.7838 0.0705 0.0720 0.1437 322 LEU C CB 7188 C CG . LEU C 240 ? 0.9078 0.8806 0.8605 0.0729 0.0790 0.1483 322 LEU C CG 7189 C CD1 . LEU C 240 ? 0.9029 0.8696 0.8489 0.0734 0.0828 0.1543 322 LEU C CD1 7190 C CD2 . LEU C 240 ? 0.9543 0.9356 0.9198 0.0691 0.0825 0.1498 322 LEU C CD2 7191 N N . GLY C 241 ? 0.7092 0.6810 0.6862 0.0609 0.0608 0.1342 323 GLY C N 7192 C CA . GLY C 241 ? 0.6769 0.6450 0.6574 0.0575 0.0549 0.1302 323 GLY C CA 7193 C C . GLY C 241 ? 0.7979 0.7561 0.7762 0.0544 0.0538 0.1313 323 GLY C C 7194 O O . GLY C 241 ? 0.7214 0.6745 0.6976 0.0543 0.0488 0.1276 323 GLY C O 7195 N N . ASP C 242 ? 0.6913 0.6463 0.6702 0.0519 0.0587 0.1365 324 ASP C N 7196 C CA . ASP C 242 ? 0.6804 0.6245 0.6574 0.0489 0.0586 0.1379 324 ASP C CA 7197 C C . ASP C 242 ? 0.7278 0.6640 0.6931 0.0550 0.0577 0.1390 324 ASP C C 7198 O O . ASP C 242 ? 0.7442 0.6838 0.7020 0.0610 0.0578 0.1392 324 ASP C O 7199 C CB . ASP C 242 ? 0.7624 0.7038 0.7437 0.0435 0.0649 0.1430 324 ASP C CB 7200 C CG . ASP C 242 ? 0.9204 0.8538 0.9061 0.0363 0.0641 0.1419 324 ASP C CG 7201 O OD1 . ASP C 242 ? 0.9360 0.8611 0.9169 0.0380 0.0604 0.1394 324 ASP C OD1 7202 O OD2 . ASP C 242 ? 1.0475 0.9833 1.0413 0.0288 0.0674 0.1431 324 ASP C OD2 7203 N N . THR C 243 ? 0.6772 0.6034 0.6409 0.0533 0.0570 0.1395 325 THR C N 7204 C CA . THR C 243 ? 0.6589 0.5776 0.6125 0.0589 0.0572 0.1422 325 THR C CA 7205 C C . THR C 243 ? 0.8138 0.7208 0.7681 0.0553 0.0615 0.1463 325 THR C C 7206 O O . THR C 243 ? 0.8602 0.7619 0.8197 0.0499 0.0599 0.1434 325 THR C O 7207 C CB . THR C 243 ? 0.7006 0.6186 0.6509 0.0618 0.0505 0.1370 325 THR C CB 7208 O OG1 . THR C 243 ? 0.7839 0.7111 0.7325 0.0647 0.0472 0.1330 325 THR C OG1 7209 C CG2 . THR C 243 ? 0.6606 0.5719 0.6016 0.0676 0.0508 0.1405 325 THR C CG2 7210 N N . PRO C 244 ? 0.9053 0.8073 0.8535 0.0582 0.0673 0.1530 326 PRO C N 7211 C CA . PRO C 244 ? 0.8986 0.8058 0.8386 0.0652 0.0692 0.1569 326 PRO C CA 7212 C C . PRO C 244 ? 0.7915 0.7090 0.7349 0.0641 0.0717 0.1571 326 PRO C C 7213 O O . PRO C 244 ? 0.7299 0.6516 0.6832 0.0577 0.0725 0.1551 326 PRO C O 7214 C CB . PRO C 244 ? 0.5780 0.4745 0.5119 0.0671 0.0756 0.1646 326 PRO C CB 7215 C CG . PRO C 244 ? 0.7090 0.5972 0.6506 0.0588 0.0793 0.1650 326 PRO C CG 7216 C CD . PRO C 244 ? 0.8802 0.7697 0.8288 0.0543 0.0731 0.1575 326 PRO C CD 7217 N N . ARG C 245 ? 0.7376 0.6597 0.6724 0.0704 0.0732 0.1597 327 ARG C N 7218 C CA . ARG C 245 ? 0.7076 0.6393 0.6434 0.0709 0.0759 0.1599 327 ARG C CA 7219 C C . ARG C 245 ? 0.8278 0.7620 0.7513 0.0782 0.0776 0.1632 327 ARG C C 7220 O O . ARG C 245 ? 0.9062 0.8375 0.8211 0.0830 0.0749 0.1640 327 ARG C O 7221 C CB . ARG C 245 ? 0.6713 0.6115 0.6130 0.0696 0.0709 0.1527 327 ARG C CB 7222 C CG . ARG C 245 ? 0.6704 0.6123 0.6048 0.0744 0.0649 0.1477 327 ARG C CG 7223 C CD . ARG C 245 ? 0.8184 0.7676 0.7574 0.0736 0.0617 0.1414 327 ARG C CD 7224 N NE . ARG C 245 ? 0.8435 0.7945 0.7741 0.0778 0.0573 0.1367 327 ARG C NE 7225 C CZ . ARG C 245 ? 0.8530 0.8016 0.7833 0.0774 0.0515 0.1322 327 ARG C CZ 7226 N NH1 . ARG C 245 ? 0.9330 0.8769 0.8706 0.0734 0.0494 0.1316 327 ARG C NH1 7227 N NH2 . ARG C 245 ? 0.9152 0.8661 0.8376 0.0806 0.0480 0.1279 327 ARG C NH2 7228 N N . GLY C 246 ? 0.8345 0.7750 0.7571 0.0791 0.0821 0.1653 328 GLY C N 7229 C CA . GLY C 246 ? 0.8403 0.7844 0.7508 0.0856 0.0835 0.1674 328 GLY C CA 7230 C C . GLY C 246 ? 0.9959 0.9484 0.9037 0.0878 0.0802 0.1609 328 GLY C C 7231 O O . GLY C 246 ? 0.9643 0.9182 0.8774 0.0857 0.0751 0.1546 328 GLY C O 7232 N N . ILE C 247 ? 0.9265 0.8838 0.8254 0.0918 0.0834 0.1624 329 ILE C N 7233 C CA . ILE C 247 ? 0.9852 0.9489 0.8796 0.0939 0.0817 0.1563 329 ILE C CA 7234 C C . ILE C 247 ? 0.9503 0.9178 0.8559 0.0906 0.0830 0.1529 329 ILE C C 7235 O O . ILE C 247 ? 0.8708 0.8391 0.7857 0.0873 0.0873 0.1567 329 ILE C O 7236 C CB . ILE C 247 ? 1.2621 1.2297 1.1441 0.0985 0.0861 0.1591 329 ILE C CB 7237 C CG1 . ILE C 247 ? 1.2782 1.2435 1.1495 0.1023 0.0851 0.1638 329 ILE C CG1 7238 C CG2 . ILE C 247 ? 1.3338 1.3064 1.2090 0.1005 0.0845 0.1520 329 ILE C CG2 7239 C CD1 . ILE C 247 ? 1.4419 1.4125 1.2988 0.1071 0.0869 0.1646 329 ILE C CD1 7240 N N . ASP C 248 ? 0.9573 0.9276 0.8621 0.0913 0.0796 0.1459 330 ASP C N 7241 C CA . ASP C 248 ? 0.8721 0.8467 0.7858 0.0899 0.0816 0.1433 330 ASP C CA 7242 C C . ASP C 248 ? 0.9870 0.9663 0.8995 0.0918 0.0893 0.1472 330 ASP C C 7243 O O . ASP C 248 ? 0.9413 0.9206 0.8422 0.0953 0.0922 0.1491 330 ASP C O 7244 C CB . ASP C 248 ? 0.9116 0.8864 0.8219 0.0913 0.0776 0.1355 330 ASP C CB 7245 C CG . ASP C 248 ? 1.0902 1.0619 1.0066 0.0883 0.0708 0.1316 330 ASP C CG 7246 O OD1 . ASP C 248 ? 1.0843 1.0545 1.0099 0.0847 0.0697 0.1345 330 ASP C OD1 7247 O OD2 . ASP C 248 ? 0.8890 0.8593 0.8005 0.0892 0.0668 0.1254 330 ASP C OD2 7248 N N . THR C 249 ? 0.9989 0.9831 0.9232 0.0896 0.0927 0.1488 333 THR C N 7249 C CA . THR C 249 ? 1.0827 1.0722 1.0074 0.0912 0.1005 0.1531 333 THR C CA 7250 C C . THR C 249 ? 1.1019 1.0968 1.0283 0.0942 0.1031 0.1494 333 THR C C 7251 O O . THR C 249 ? 1.1020 1.0957 1.0288 0.0950 0.0990 0.1435 333 THR C O 7252 C CB . THR C 249 ? 0.9859 0.9786 0.9232 0.0863 0.1042 0.1590 333 THR C CB 7253 O OG1 . THR C 249 ? 1.1148 1.1140 1.0660 0.0835 0.1030 0.1569 333 THR C OG1 7254 C CG2 . THR C 249 ? 0.8180 0.8033 0.7555 0.0827 0.1014 0.1617 333 THR C CG2 7255 N N . THR C 250 ? 1.0371 1.0374 0.9643 0.0961 0.1105 0.1531 334 THR C N 7256 C CA . THR C 250 ? 1.1102 1.1169 1.0428 0.0988 0.1142 0.1512 334 THR C CA 7257 C C . THR C 250 ? 1.0308 1.0440 0.9808 0.0949 0.1122 0.1521 334 THR C C 7258 O O . THR C 250 ? 1.0683 1.0815 1.0258 0.0895 0.1098 0.1549 334 THR C O 7259 C CB . THR C 250 ? 1.1515 1.1637 1.0821 0.1016 0.1232 0.1558 334 THR C CB 7260 O OG1 . THR C 250 ? 1.1296 1.1445 1.0669 0.0974 0.1259 0.1627 334 THR C OG1 7261 C CG2 . THR C 250 ? 1.1921 1.1990 1.1045 0.1060 0.1255 0.1541 334 THR C CG2 7262 N N . ASN C 251 ? 0.8247 0.8434 0.7808 0.0976 0.1133 0.1497 335 ASN C N 7263 C CA . ASN C 251 ? 0.8866 0.9140 0.8594 0.0943 0.1117 0.1511 335 ASN C CA 7264 C C . ASN C 251 ? 1.0705 1.1085 1.0538 0.0917 0.1177 0.1576 335 ASN C C 7265 O O . ASN C 251 ? 1.2315 1.2738 1.2121 0.0955 0.1248 0.1603 335 ASN C O 7266 C CB . ASN C 251 ? 0.9931 1.0239 0.9692 0.0989 0.1114 0.1474 335 ASN C CB 7267 C CG . ASN C 251 ? 1.0494 1.0700 1.0172 0.1000 0.1051 0.1408 335 ASN C CG 7268 O OD1 . ASN C 251 ? 1.0260 1.0381 0.9856 0.0975 0.1007 0.1388 335 ASN C OD1 7269 N ND2 . ASN C 251 ? 1.1128 1.1343 1.0825 0.1039 0.1050 0.1377 335 ASN C ND2 7270 N N . TYR C 252 ? 1.1435 1.1855 1.1382 0.0846 0.1150 0.1600 336 TYR C N 7271 C CA . TYR C 252 ? 1.0382 1.0919 1.0452 0.0805 0.1202 0.1657 336 TYR C CA 7272 C C . TYR C 252 ? 1.0271 1.0869 1.0483 0.0727 0.1155 0.1658 336 TYR C C 7273 O O . TYR C 252 ? 1.0651 1.1171 1.0847 0.0699 0.1086 0.1621 336 TYR C O 7274 C CB . TYR C 252 ? 0.7724 0.8216 0.7727 0.0788 0.1257 0.1705 336 TYR C CB 7275 C CG . TYR C 252 ? 0.8020 0.8384 0.7948 0.0747 0.1222 0.1708 336 TYR C CG 7276 C CD1 . TYR C 252 ? 0.8104 0.8459 0.8121 0.0666 0.1194 0.1720 336 TYR C CD1 7277 C CD2 . TYR C 252 ? 0.8306 0.8560 0.8072 0.0791 0.1221 0.1701 336 TYR C CD2 7278 C CE1 . TYR C 252 ? 0.6777 0.7001 0.6719 0.0637 0.1171 0.1726 336 TYR C CE1 7279 C CE2 . TYR C 252 ? 0.9003 0.9148 0.8700 0.0766 0.1193 0.1712 336 TYR C CE2 7280 C CZ . TYR C 252 ? 0.8396 0.8519 0.8181 0.0692 0.1171 0.1726 336 TYR C CZ 7281 O OH . TYR C 252 ? 0.7587 0.7591 0.7297 0.0677 0.1151 0.1739 336 TYR C OH 7282 N N . CYS C 253 ? 1.0464 1.1205 1.0814 0.0688 0.1192 0.1697 337 CYS C N 7283 C CA . CYS C 253 ? 1.0871 1.1704 1.1363 0.0620 0.1145 0.1689 337 CYS C CA 7284 C C . CYS C 253 ? 1.1064 1.1886 1.1615 0.0513 0.1143 0.1711 337 CYS C C 7285 O O . CYS C 253 ? 1.2354 1.3303 1.3043 0.0447 0.1135 0.1720 337 CYS C O 7286 C CB . CYS C 253 ? 0.9685 1.0712 1.0310 0.0647 0.1167 0.1705 337 CYS C CB 7287 S SG . CYS C 253 ? 1.9161 2.0181 1.9742 0.0756 0.1140 0.1663 337 CYS C SG 7288 N N . ASP C 254 ? 1.0764 1.1433 1.1206 0.0497 0.1151 0.1718 339 ASP C N 7289 C CA . ASP C 254 ? 1.1057 1.1670 1.1531 0.0399 0.1149 0.1732 339 ASP C CA 7290 C C . ASP C 254 ? 1.0752 1.1169 1.1092 0.0404 0.1119 0.1717 339 ASP C C 7291 O O . ASP C 254 ? 1.1200 1.1541 1.1431 0.0478 0.1090 0.1690 339 ASP C O 7292 C CB . ASP C 254 ? 1.2063 1.2737 1.2589 0.0347 0.1231 0.1791 339 ASP C CB 7293 C CG . ASP C 254 ? 1.2365 1.3055 1.2819 0.0424 0.1300 0.1827 339 ASP C CG 7294 O OD1 . ASP C 254 ? 1.2550 1.3164 1.2884 0.0510 0.1286 0.1807 339 ASP C OD1 7295 O OD2 . ASP C 254 ? 1.0924 1.1707 1.1442 0.0394 0.1370 0.1874 339 ASP C OD2 7296 N N . LYS C 255 ? 1.0181 1.0519 1.0529 0.0325 0.1129 0.1734 340 LYS C N 7297 C CA . LYS C 255 ? 0.9729 0.9890 0.9975 0.0323 0.1093 0.1717 340 LYS C CA 7298 C C . LYS C 255 ? 1.0262 1.0318 1.0354 0.0405 0.1114 0.1738 340 LYS C C 7299 O O . LYS C 255 ? 1.0558 1.0642 1.0614 0.0436 0.1178 0.1782 340 LYS C O 7300 C CB . LYS C 255 ? 0.9361 0.9445 0.9640 0.0224 0.1118 0.1738 340 LYS C CB 7301 C CG . LYS C 255 ? 0.9981 1.0156 1.0401 0.0125 0.1091 0.1710 340 LYS C CG 7302 C CD . LYS C 255 ? 1.0245 1.0350 1.0692 0.0020 0.1145 0.1739 340 LYS C CD 7303 C CE . LYS C 255 ? 1.1565 1.1773 1.2149 -0.0092 0.1123 0.1709 340 LYS C CE 7304 N NZ . LYS C 255 ? 1.2012 1.2443 1.2729 -0.0121 0.1151 0.1727 340 LYS C NZ 7305 N N . THR C 256 ? 0.9378 0.9323 0.9378 0.0440 0.1059 0.1706 341 THR C N 7306 C CA . THR C 256 ? 0.9096 0.8934 0.8947 0.0504 0.1072 0.1729 341 THR C CA 7307 C C . THR C 256 ? 0.9132 0.8834 0.8948 0.0462 0.1089 0.1762 341 THR C C 7308 O O . THR C 256 ? 0.9194 0.8806 0.8979 0.0458 0.1040 0.1735 341 THR C O 7309 C CB . THR C 256 ? 0.7863 0.7674 0.7632 0.0570 0.1006 0.1677 341 THR C CB 7310 O OG1 . THR C 256 ? 0.8514 0.8433 0.8312 0.0608 0.1001 0.1647 341 THR C OG1 7311 C CG2 . THR C 256 ? 0.7491 0.7216 0.7108 0.0633 0.1017 0.1701 341 THR C CG2 7312 N N . THR C 257 ? 0.7996 0.7680 0.7814 0.0431 0.1165 0.1822 342 THR C N 7313 C CA . THR C 257 ? 0.8486 0.8037 0.8287 0.0378 0.1196 0.1856 342 THR C CA 7314 C C . THR C 257 ? 0.8170 0.7586 0.7825 0.0447 0.1188 0.1880 342 THR C C 7315 O O . THR C 257 ? 0.8741 0.8025 0.8367 0.0423 0.1193 0.1895 342 THR C O 7316 C CB . THR C 257 ? 1.0190 0.9755 1.0029 0.0324 0.1288 0.1917 342 THR C CB 7317 O OG1 . THR C 257 ? 0.8597 0.8169 0.8339 0.0396 0.1337 0.1967 342 THR C OG1 7318 C CG2 . THR C 257 ? 0.9860 0.9588 0.9855 0.0254 0.1295 0.1896 342 THR C CG2 7319 N N . THR C 258 ? 0.9450 0.8906 0.9014 0.0534 0.1177 0.1882 343 THR C N 7320 C CA . THR C 258 ? 0.9911 0.9279 0.9335 0.0608 0.1161 0.1903 343 THR C CA 7321 C C . THR C 258 ? 0.8256 0.7567 0.7676 0.0612 0.1084 0.1851 343 THR C C 7322 O O . THR C 258 ? 0.9420 0.8801 0.8879 0.0618 0.1022 0.1787 343 THR C O 7323 C CB . THR C 258 ? 1.0416 0.9864 0.9750 0.0690 0.1154 0.1897 343 THR C CB 7324 O OG1 . THR C 258 ? 0.9982 0.9515 0.9349 0.0680 0.1217 0.1924 343 THR C OG1 7325 C CG2 . THR C 258 ? 0.8095 0.7470 0.7278 0.0761 0.1158 0.1940 343 THR C CG2 7326 N N . GLU C 259 ? 0.7716 0.6897 0.7087 0.0613 0.1094 0.1883 344 GLU C N 7327 C CA . GLU C 259 ? 0.7804 0.6918 0.7174 0.0614 0.1031 0.1842 344 GLU C CA 7328 C C . GLU C 259 ? 0.8177 0.7315 0.7674 0.0531 0.0996 0.1780 344 GLU C C 7329 O O . GLU C 259 ? 1.0896 1.0025 1.0406 0.0534 0.0930 0.1727 344 GLU C O 7330 C CB . GLU C 259 ? 0.9204 0.8365 0.8492 0.0694 0.0966 0.1808 344 GLU C CB 7331 C CG . GLU C 259 ? 1.0109 0.9235 0.9261 0.0776 0.0987 0.1867 344 GLU C CG 7332 C CD . GLU C 259 ? 1.3899 1.2997 1.2984 0.0830 0.0924 0.1845 344 GLU C CD 7333 O OE1 . GLU C 259 ? 1.4668 1.3849 1.3689 0.0883 0.0881 0.1817 344 GLU C OE1 7334 O OE2 . GLU C 259 ? 1.5382 1.4377 1.4480 0.0817 0.0920 0.1854 344 GLU C OE2 7335 N N . GLY C 260 ? 0.8252 0.7429 0.7845 0.0455 0.1040 0.1790 345 GLY C N 7336 C CA . GLY C 260 ? 0.8472 0.7686 0.8186 0.0370 0.1010 0.1738 345 GLY C CA 7337 C C . GLY C 260 ? 0.8111 0.7189 0.7843 0.0301 0.1021 0.1734 345 GLY C C 7338 O O . GLY C 260 ? 1.0235 0.9344 1.0062 0.0224 0.0994 0.1688 345 GLY C O 7339 N N . GLU C 261 ? 0.6750 0.5679 0.6390 0.0328 0.1063 0.1784 346 GLU C N 7340 C CA . GLU C 261 ? 0.7476 0.6252 0.7114 0.0274 0.1076 0.1778 346 GLU C CA 7341 C C . GLU C 261 ? 0.8662 0.7411 0.8269 0.0320 0.0998 0.1728 346 GLU C C 7342 O O . GLU C 261 ? 0.9513 0.8300 0.9052 0.0412 0.0961 0.1731 346 GLU C O 7343 C CB . GLU C 261 ? 0.6627 0.5244 0.6171 0.0298 0.1158 0.1856 346 GLU C CB 7344 C CG . GLU C 261 ? 0.7643 0.6073 0.7170 0.0249 0.1186 0.1853 346 GLU C CG 7345 C CD . GLU C 261 ? 1.0470 0.8726 0.9890 0.0290 0.1270 0.1938 346 GLU C CD 7346 O OE1 . GLU C 261 ? 1.0853 0.9142 1.0217 0.0347 0.1310 0.2001 346 GLU C OE1 7347 O OE2 . GLU C 261 ? 0.9482 0.7563 0.8867 0.0269 0.1300 0.1942 346 GLU C OE2 7348 N N . GLY C 262 ? 0.7802 0.6488 0.7457 0.0255 0.0975 0.1681 347 GLY C N 7349 C CA . GLY C 262 ? 0.7136 0.5798 0.6769 0.0291 0.0904 0.1631 347 GLY C CA 7350 C C . GLY C 262 ? 0.8256 0.7072 0.7967 0.0276 0.0828 0.1563 347 GLY C C 7351 O O . GLY C 262 ? 0.8809 0.7740 0.8601 0.0228 0.0833 0.1553 347 GLY C O 7352 N N . GLY C 263 ? 0.7941 0.6763 0.7629 0.0319 0.0760 0.1519 348 GLY C N 7353 C CA . GLY C 263 ? 0.7012 0.5967 0.6766 0.0309 0.0693 0.1458 348 GLY C CA 7354 C C . GLY C 263 ? 0.6448 0.5368 0.6216 0.0292 0.0633 0.1398 348 GLY C C 7355 O O . GLY C 263 ? 0.7735 0.6529 0.7482 0.0265 0.0646 0.1395 348 GLY C O 7356 N N . ILE C 264 ? 0.8144 0.7170 0.7944 0.0308 0.0570 0.1349 349 ILE C N 7357 C CA . ILE C 264 ? 0.6934 0.5939 0.6747 0.0293 0.0512 0.1291 349 ILE C CA 7358 C C . ILE C 264 ? 0.6296 0.5430 0.6200 0.0250 0.0470 0.1246 349 ILE C C 7359 O O . ILE C 264 ? 0.8377 0.7622 0.8312 0.0267 0.0475 0.1257 349 ILE C O 7360 C CB . ILE C 264 ? 0.6289 0.5271 0.6019 0.0378 0.0474 0.1281 349 ILE C CB 7361 C CG1 . ILE C 264 ? 0.6830 0.5752 0.6560 0.0362 0.0430 0.1232 349 ILE C CG1 7362 C CG2 . ILE C 264 ? 0.5154 0.4259 0.4875 0.0430 0.0443 0.1266 349 ILE C CG2 7363 C CD1 . ILE C 264 ? 0.6948 0.5805 0.6592 0.0436 0.0417 0.1241 349 ILE C CD1 7364 N N . GLN C 265 ? 0.6335 0.5452 0.6278 0.0197 0.0434 0.1199 350 GLN C N 7365 C CA . GLN C 265 ? 0.6863 0.6104 0.6887 0.0161 0.0390 0.1159 350 GLN C CA 7366 C C . GLN C 265 ? 0.6776 0.6091 0.6775 0.0238 0.0350 0.1142 350 GLN C C 7367 O O . GLN C 265 ? 0.7177 0.6436 0.7104 0.0293 0.0325 0.1128 350 GLN C O 7368 C CB . GLN C 265 ? 0.6909 0.6104 0.6957 0.0100 0.0355 0.1111 350 GLN C CB 7369 C CG . GLN C 265 ? 0.6391 0.5707 0.6513 0.0067 0.0303 0.1069 350 GLN C CG 7370 C CD . GLN C 265 ? 0.7536 0.6794 0.7672 -0.0007 0.0280 0.1026 350 GLN C CD 7371 O OE1 . GLN C 265 ? 0.8581 0.7701 0.8653 0.0000 0.0284 0.1014 350 GLN C OE1 7372 N NE2 . GLN C 265 ? 0.5135 0.4500 0.5353 -0.0077 0.0258 0.1003 350 GLN C NE2 7373 N N . GLY C 266 ? 0.6460 0.5903 0.6519 0.0239 0.0347 0.1144 351 GLY C N 7374 C CA . GLY C 266 ? 0.7163 0.6670 0.7198 0.0307 0.0320 0.1128 351 GLY C CA 7375 C C . GLY C 266 ? 0.7453 0.7097 0.7578 0.0290 0.0321 0.1131 351 GLY C C 7376 O O . GLY C 266 ? 0.7810 0.7508 0.8013 0.0225 0.0341 0.1148 351 GLY C O 7377 N N . PHE C 267 ? 0.7443 0.7146 0.7555 0.0348 0.0305 0.1117 352 PHE C N 7378 C CA . PHE C 267 ? 0.6378 0.6211 0.6573 0.0344 0.0299 0.1118 352 PHE C CA 7379 C C . PHE C 267 ? 0.7232 0.7124 0.7409 0.0414 0.0331 0.1137 352 PHE C C 7380 O O . PHE C 267 ? 0.7081 0.6909 0.7166 0.0468 0.0344 0.1135 352 PHE C O 7381 C CB . PHE C 267 ? 0.7191 0.7035 0.7401 0.0339 0.0241 0.1073 352 PHE C CB 7382 C CG . PHE C 267 ? 0.7322 0.7094 0.7441 0.0400 0.0216 0.1040 352 PHE C CG 7383 C CD1 . PHE C 267 ? 0.6577 0.6238 0.6628 0.0396 0.0192 0.1014 352 PHE C CD1 7384 C CD2 . PHE C 267 ? 0.6846 0.6660 0.6947 0.0461 0.0222 0.1034 352 PHE C CD2 7385 C CE1 . PHE C 267 ? 0.6499 0.6107 0.6469 0.0445 0.0170 0.0982 352 PHE C CE1 7386 C CE2 . PHE C 267 ? 0.7085 0.6828 0.7097 0.0506 0.0203 0.0999 352 PHE C CE2 7387 C CZ . PHE C 267 ? 0.7285 0.6933 0.7235 0.0495 0.0175 0.0972 352 PHE C CZ 7388 N N . MET C 268 ? 0.7242 0.7261 0.7506 0.0412 0.0344 0.1155 353 MET C N 7389 C CA . MET C 268 ? 0.6768 0.6853 0.7027 0.0481 0.0371 0.1168 353 MET C CA 7390 C C . MET C 268 ? 0.8671 0.8850 0.9001 0.0488 0.0340 0.1155 353 MET C C 7391 O O . MET C 268 ? 0.7661 0.7905 0.8072 0.0427 0.0310 0.1153 353 MET C O 7392 C CB . MET C 268 ? 0.6351 0.6515 0.6655 0.0481 0.0432 0.1218 353 MET C CB 7393 C CG . MET C 268 ? 0.6948 0.7025 0.7174 0.0487 0.0473 0.1240 353 MET C CG 7394 S SD . MET C 268 ? 0.8783 0.8960 0.9077 0.0469 0.0546 0.1302 353 MET C SD 7395 C CE . MET C 268 ? 1.5721 1.5770 1.5891 0.0492 0.0586 0.1324 353 MET C CE 7396 N N . ILE C 269 ? 0.7971 0.8155 0.8265 0.0559 0.0347 0.1145 354 ILE C N 7397 C CA . ILE C 269 ? 0.7632 0.7911 0.7992 0.0579 0.0327 0.1145 354 ILE C CA 7398 C C . ILE C 269 ? 0.8360 0.8746 0.8765 0.0637 0.0380 0.1185 354 ILE C C 7399 O O . ILE C 269 ? 0.8271 0.8601 0.8600 0.0701 0.0420 0.1184 354 ILE C O 7400 C CB . ILE C 269 ? 0.7317 0.7507 0.7602 0.0618 0.0292 0.1102 354 ILE C CB 7401 C CG1 . ILE C 269 ? 0.6527 0.6614 0.6767 0.0566 0.0242 0.1061 354 ILE C CG1 7402 C CG2 . ILE C 269 ? 0.5374 0.5666 0.5729 0.0644 0.0276 0.1111 354 ILE C CG2 7403 C CD1 . ILE C 269 ? 0.5598 0.5590 0.5756 0.0599 0.0213 0.1016 354 ILE C CD1 7404 N N . GLU C 270 ? 0.7272 0.7819 0.7799 0.0615 0.0381 0.1220 355 GLU C N 7405 C CA . GLU C 270 ? 0.7555 0.8227 0.8141 0.0674 0.0433 0.1264 355 GLU C CA 7406 C C . GLU C 270 ? 0.8568 0.9304 0.9181 0.0738 0.0421 0.1268 355 GLU C C 7407 O O . GLU C 270 ? 0.7988 0.8806 0.8668 0.0708 0.0373 0.1267 355 GLU C O 7408 C CB . GLU C 270 ? 0.7810 0.8644 0.8520 0.0616 0.0450 0.1307 355 GLU C CB 7409 C CG . GLU C 270 ? 0.7464 0.8470 0.8264 0.0673 0.0494 0.1356 355 GLU C CG 7410 C CD . GLU C 270 ? 0.9093 1.0068 0.9844 0.0736 0.0569 0.1379 355 GLU C CD 7411 O OE1 . GLU C 270 ? 0.8704 0.9519 0.9338 0.0743 0.0583 0.1354 355 GLU C OE1 7412 O OE2 . GLU C 270 ? 0.9911 1.1032 1.0741 0.0778 0.0615 0.1424 355 GLU C OE2 7413 N N . GLY C 271 ? 0.9127 0.9823 0.9683 0.0828 0.0470 0.1275 356 GLY C N 7414 C CA . GLY C 271 ? 0.9471 1.0196 1.0034 0.0900 0.0469 0.1281 356 GLY C CA 7415 C C . GLY C 271 ? 1.1444 1.2166 1.1974 0.0998 0.0545 0.1305 356 GLY C C 7416 O O . GLY C 271 ? 1.1568 1.2309 1.2097 0.1007 0.0597 0.1326 356 GLY C O 7417 N N . SER C 272 ? 1.2125 1.2819 1.2627 0.1072 0.0554 0.1305 357 SER C N 7418 C CA . SER C 272 ? 1.1714 1.2342 1.2146 0.1169 0.0630 0.1313 357 SER C CA 7419 C C . SER C 272 ? 1.2346 1.2789 1.2636 0.1150 0.0646 0.1260 357 SER C C 7420 O O . SER C 272 ? 1.2018 1.2430 1.2259 0.1182 0.0708 0.1265 357 SER C O 7421 C CB . SER C 272 ? 1.0411 1.0987 1.0809 0.1237 0.0629 0.1308 357 SER C CB 7422 O OG . SER C 272 ? 0.9976 1.0491 1.0352 0.1179 0.0554 0.1270 357 SER C OG 7423 N N . ASN C 273 ? 1.2272 1.2603 1.2499 0.1096 0.0587 0.1210 359 ASN C N 7424 C CA . ASN C 273 ? 1.1281 1.1469 1.1392 0.1059 0.0581 0.1161 359 ASN C CA 7425 C C . ASN C 273 ? 1.0433 1.0661 1.0594 0.0971 0.0530 0.1162 359 ASN C C 7426 O O . ASN C 273 ? 1.0903 1.1186 1.1135 0.0923 0.0473 0.1162 359 ASN C O 7427 C CB . ASN C 273 ? 1.1298 1.1331 1.1298 0.1065 0.0557 0.1103 359 ASN C CB 7428 C CG . ASN C 273 ? 1.2268 1.2195 1.2163 0.1139 0.0624 0.1084 359 ASN C CG 7429 O OD1 . ASN C 273 ? 1.2032 1.1998 1.1935 0.1193 0.0691 0.1115 359 ASN C OD1 7430 N ND2 . ASN C 273 ? 1.1855 1.1641 1.1648 0.1140 0.0611 0.1031 359 ASN C ND2 7431 N N . SER C 274 ? 0.9791 0.9989 0.9910 0.0950 0.0555 0.1162 360 SER C N 7432 C CA . SER C 274 ? 0.9506 0.9722 0.9660 0.0872 0.0519 0.1167 360 SER C CA 7433 C C . SER C 274 ? 0.7911 0.7984 0.7948 0.0845 0.0493 0.1122 360 SER C C 7434 O O . SER C 274 ? 0.8590 0.8566 0.8516 0.0883 0.0513 0.1089 360 SER C O 7435 C CB . SER C 274 ? 1.0233 1.0544 1.0447 0.0863 0.0567 0.1216 360 SER C CB 7436 O OG . SER C 274 ? 1.0450 1.0925 1.0803 0.0855 0.0569 0.1259 360 SER C OG 7437 N N . TRP C 275 ? 0.8168 0.8235 0.8232 0.0779 0.0451 0.1120 361 TRP C N 7438 C CA . TRP C 275 ? 0.7285 0.7234 0.7251 0.0756 0.0423 0.1083 361 TRP C CA 7439 C C . TRP C 275 ? 0.7315 0.7268 0.7303 0.0705 0.0423 0.1110 361 TRP C C 7440 O O . TRP C 275 ? 0.7768 0.7797 0.7856 0.0660 0.0418 0.1139 361 TRP C O 7441 C CB . TRP C 275 ? 0.7709 0.7608 0.7669 0.0731 0.0361 0.1042 361 TRP C CB 7442 C CG . TRP C 275 ? 0.8135 0.8013 0.8072 0.0775 0.0358 0.1016 361 TRP C CG 7443 C CD1 . TRP C 275 ? 0.8571 0.8527 0.8588 0.0790 0.0352 0.1033 361 TRP C CD1 7444 C CD2 . TRP C 275 ? 0.8647 0.8417 0.8468 0.0806 0.0361 0.0969 361 TRP C CD2 7445 N NE1 . TRP C 275 ? 0.8775 0.8665 0.8731 0.0835 0.0356 0.1003 361 TRP C NE1 7446 C CE2 . TRP C 275 ? 0.8422 0.8193 0.8256 0.0841 0.0363 0.0960 361 TRP C CE2 7447 C CE3 . TRP C 275 ? 0.7986 0.7665 0.7692 0.0806 0.0363 0.0933 361 TRP C CE3 7448 C CZ2 . TRP C 275 ? 0.6509 0.6177 0.6243 0.0870 0.0372 0.0915 361 TRP C CZ2 7449 C CZ3 . TRP C 275 ? 0.7184 0.6777 0.6795 0.0830 0.0368 0.0885 361 TRP C CZ3 7450 C CH2 . TRP C 275 ? 0.6613 0.6191 0.6237 0.0859 0.0375 0.0875 361 TRP C CH2 7451 N N . ILE C 276 ? 0.7432 0.7303 0.7321 0.0712 0.0430 0.1099 362 ILE C N 7452 C CA . ILE C 276 ? 0.6355 0.6197 0.6242 0.0669 0.0425 0.1120 362 ILE C CA 7453 C C . ILE C 276 ? 0.8039 0.7783 0.7839 0.0665 0.0382 0.1082 362 ILE C C 7454 O O . ILE C 276 ? 0.7849 0.7548 0.7551 0.0702 0.0386 0.1056 362 ILE C O 7455 C CB . ILE C 276 ? 0.6422 0.6272 0.6268 0.0690 0.0481 0.1159 362 ILE C CB 7456 C CG1 . ILE C 276 ? 0.6907 0.6864 0.6840 0.0698 0.0530 0.1199 362 ILE C CG1 7457 C CG2 . ILE C 276 ? 0.5592 0.5397 0.5429 0.0650 0.0480 0.1185 362 ILE C CG2 7458 C CD1 . ILE C 276 ? 0.6922 0.6889 0.6808 0.0726 0.0591 0.1234 362 ILE C CD1 7459 N N . GLY C 277 ? 0.7567 0.7284 0.7405 0.0617 0.0344 0.1077 363 GLY C N 7460 C CA . GLY C 277 ? 0.6355 0.5988 0.6121 0.0614 0.0308 0.1049 363 GLY C CA 7461 C C . GLY C 277 ? 0.7084 0.6678 0.6824 0.0602 0.0328 0.1087 363 GLY C C 7462 O O . GLY C 277 ? 0.8810 0.8416 0.8616 0.0563 0.0347 0.1121 363 GLY C O 7463 N N . ARG C 278 ? 0.6808 0.6355 0.6449 0.0635 0.0326 0.1081 364 ARG C N 7464 C CA . ARG C 278 ? 0.6610 0.6113 0.6217 0.0634 0.0344 0.1122 364 ARG C CA 7465 C C . ARG C 278 ? 0.7546 0.7002 0.7063 0.0662 0.0315 0.1104 364 ARG C C 7466 O O . ARG C 278 ? 0.8212 0.7675 0.7684 0.0680 0.0282 0.1057 364 ARG C O 7467 C CB . ARG C 278 ? 0.6729 0.6263 0.6311 0.0657 0.0402 0.1170 364 ARG C CB 7468 C CG . ARG C 278 ? 0.6721 0.6262 0.6193 0.0710 0.0409 0.1160 364 ARG C CG 7469 C CD . ARG C 278 ? 0.7580 0.7166 0.7037 0.0732 0.0467 0.1194 364 ARG C CD 7470 N NE . ARG C 278 ? 0.9275 0.8865 0.8614 0.0778 0.0474 0.1182 364 ARG C NE 7471 C CZ . ARG C 278 ? 0.7618 0.7236 0.6907 0.0805 0.0524 0.1212 364 ARG C CZ 7472 N NH1 . ARG C 278 ? 0.6994 0.6640 0.6348 0.0794 0.0573 0.1258 364 ARG C NH1 7473 N NH2 . ARG C 278 ? 0.7963 0.7586 0.7135 0.0840 0.0525 0.1193 364 ARG C NH2 7474 N N . ILE C 279 ? 0.6679 0.6089 0.6172 0.0665 0.0329 0.1145 365 ILE C N 7475 C CA . ILE C 279 ? 0.7329 0.6708 0.6740 0.0700 0.0309 0.1146 365 ILE C CA 7476 C C . ILE C 279 ? 0.8045 0.7467 0.7363 0.0748 0.0330 0.1162 365 ILE C C 7477 O O . ILE C 279 ? 0.7932 0.7371 0.7244 0.0757 0.0378 0.1204 365 ILE C O 7478 C CB . ILE C 279 ? 0.7200 0.6508 0.6621 0.0691 0.0329 0.1194 365 ILE C CB 7479 C CG1 . ILE C 279 ? 0.6838 0.6103 0.6345 0.0635 0.0310 0.1170 365 ILE C CG1 7480 C CG2 . ILE C 279 ? 0.8563 0.7850 0.7899 0.0740 0.0313 0.1208 365 ILE C CG2 7481 C CD1 . ILE C 279 ? 0.6440 0.5609 0.5947 0.0623 0.0323 0.1199 365 ILE C CD1 7482 N N . ILE C 280 ? 0.7851 0.7296 0.7095 0.0775 0.0296 0.1126 366 ILE C N 7483 C CA . ILE C 280 ? 0.6817 0.6314 0.5968 0.0810 0.0310 0.1123 366 ILE C CA 7484 C C . ILE C 280 ? 0.7312 0.6814 0.6397 0.0848 0.0340 0.1188 366 ILE C C 7485 O O . ILE C 280 ? 0.5911 0.5437 0.4962 0.0864 0.0382 0.1218 366 ILE C O 7486 C CB . ILE C 280 ? 0.8344 0.7872 0.7434 0.0816 0.0265 0.1058 366 ILE C CB 7487 C CG1 . ILE C 280 ? 0.6986 0.6498 0.6137 0.0782 0.0245 0.1000 366 ILE C CG1 7488 C CG2 . ILE C 280 ? 0.5101 0.4682 0.4085 0.0844 0.0283 0.1047 366 ILE C CG2 7489 C CD1 . ILE C 280 ? 0.6645 0.6172 0.5743 0.0778 0.0205 0.0933 366 ILE C CD1 7490 N N . ASN C 281 ? 0.7833 0.7312 0.6899 0.0867 0.0320 0.1213 367 ASN C N 7491 C CA . ASN C 281 ? 0.8019 0.7494 0.7026 0.0909 0.0351 0.1285 367 ASN C CA 7492 C C . ASN C 281 ? 0.8026 0.7413 0.7099 0.0892 0.0386 0.1338 367 ASN C C 7493 O O . ASN C 281 ? 0.8216 0.7549 0.7321 0.0885 0.0366 0.1336 367 ASN C O 7494 C CB . ASN C 281 ? 1.1279 1.0794 1.0212 0.0953 0.0314 0.1287 367 ASN C CB 7495 C CG . ASN C 281 ? 1.3645 1.3247 1.2517 0.0953 0.0273 0.1219 367 ASN C CG 7496 O OD1 . ASN C 281 ? 1.2609 1.2212 1.1511 0.0916 0.0260 0.1157 367 ASN C OD1 7497 N ND2 . ASN C 281 ? 1.4336 1.4010 1.3120 0.0994 0.0253 0.1232 367 ASN C ND2 7498 N N . PRO C 282 ? 0.7926 0.7294 0.7015 0.0883 0.0443 0.1385 368 PRO C N 7499 C CA . PRO C 282 ? 0.8418 0.7693 0.7570 0.0853 0.0478 0.1429 368 PRO C CA 7500 C C . PRO C 282 ? 0.7936 0.7146 0.7032 0.0897 0.0493 0.1488 368 PRO C C 7501 O O . PRO C 282 ? 0.8858 0.7969 0.7996 0.0873 0.0520 0.1516 368 PRO C O 7502 C CB . PRO C 282 ? 0.8528 0.7813 0.7702 0.0834 0.0539 0.1467 368 PRO C CB 7503 C CG . PRO C 282 ? 0.7606 0.6985 0.6739 0.0854 0.0532 0.1436 368 PRO C CG 7504 C CD . PRO C 282 ? 0.7078 0.6498 0.6124 0.0898 0.0483 0.1406 368 PRO C CD 7505 N N . GLY C 283 ? 0.6264 0.5529 0.5265 0.0962 0.0478 0.1508 369 GLY C N 7506 C CA . GLY C 283 ? 0.6925 0.6146 0.5867 0.1019 0.0494 0.1573 369 GLY C CA 7507 C C . GLY C 283 ? 0.9187 0.8371 0.8153 0.1026 0.0453 0.1549 369 GLY C C 7508 O O . GLY C 283 ? 1.0483 0.9555 0.9491 0.1008 0.0479 0.1569 369 GLY C O 7509 N N . SER C 284 ? 0.9518 0.8795 0.8452 0.1051 0.0394 0.1504 370 SER C N 7510 C CA . SER C 284 ? 0.8847 0.8109 0.7816 0.1045 0.0349 0.1461 370 SER C CA 7511 C C . SER C 284 ? 1.0737 0.9991 0.9786 0.0970 0.0329 0.1388 370 SER C C 7512 O O . SER C 284 ? 1.4570 1.3898 1.3609 0.0953 0.0315 0.1350 370 SER C O 7513 C CB . SER C 284 ? 0.8714 0.8102 0.7625 0.1085 0.0293 0.1431 370 SER C CB 7514 O OG . SER C 284 ? 0.8210 0.7682 0.7111 0.1051 0.0266 0.1368 370 SER C OG 7515 N N . LYS C 285 ? 0.8163 0.7329 0.7286 0.0926 0.0330 0.1368 371 LYS C N 7516 C CA . LYS C 285 ? 0.8405 0.7573 0.7605 0.0856 0.0316 0.1309 371 LYS C CA 7517 C C . LYS C 285 ? 0.7967 0.7207 0.7174 0.0844 0.0253 0.1232 371 LYS C C 7518 O O . LYS C 285 ? 0.8186 0.7394 0.7449 0.0807 0.0226 0.1187 371 LYS C O 7519 C CB . LYS C 285 ? 0.7869 0.6928 0.7143 0.0802 0.0339 0.1312 371 LYS C CB 7520 C CG . LYS C 285 ? 0.9312 0.8307 0.8595 0.0787 0.0408 0.1375 371 LYS C CG 7521 C CD . LYS C 285 ? 1.1694 1.0574 1.1039 0.0727 0.0434 0.1375 371 LYS C CD 7522 C CE . LYS C 285 ? 1.3777 1.2578 1.3117 0.0712 0.0508 0.1441 371 LYS C CE 7523 N NZ . LYS C 285 ? 1.4516 1.3181 1.3818 0.0735 0.0548 0.1486 371 LYS C NZ 7524 N N . LYS C 286 ? 0.7863 0.7196 0.7008 0.0872 0.0235 0.1215 372 LYS C N 7525 C CA . LYS C 286 ? 0.8742 0.8140 0.7871 0.0866 0.0182 0.1146 372 LYS C CA 7526 C C . LYS C 286 ? 0.8148 0.7581 0.7290 0.0831 0.0176 0.1092 372 LYS C C 7527 O O . LYS C 286 ? 0.7158 0.6618 0.6274 0.0837 0.0208 0.1108 372 LYS C O 7528 C CB . LYS C 286 ? 0.7840 0.7320 0.6881 0.0919 0.0160 0.1156 372 LYS C CB 7529 C CG . LYS C 286 ? 0.8911 0.8370 0.7953 0.0954 0.0147 0.1185 372 LYS C CG 7530 C CD . LYS C 286 ? 0.8839 0.8393 0.7846 0.0970 0.0094 0.1142 372 LYS C CD 7531 C CE . LYS C 286 ? 1.0235 0.9767 0.9257 0.1008 0.0084 0.1170 372 LYS C CE 7532 N NZ . LYS C 286 ? 0.9097 0.8557 0.8192 0.0969 0.0067 0.1126 372 LYS C NZ 7533 N N . GLY C 287 ? 0.7493 0.6923 0.6675 0.0797 0.0140 0.1030 373 GLY C N 7534 C CA . GLY C 287 ? 0.5924 0.5378 0.5111 0.0771 0.0135 0.0978 373 GLY C CA 7535 C C . GLY C 287 ? 0.7094 0.6515 0.6359 0.0740 0.0163 0.0988 373 GLY C C 7536 O O . GLY C 287 ? 0.7679 0.7071 0.6982 0.0736 0.0196 0.1039 373 GLY C O 7537 N N . PHE C 288 ? 0.6495 0.5926 0.5786 0.0718 0.0151 0.0940 374 PHE C N 7538 C CA . PHE C 288 ? 0.7221 0.6646 0.6588 0.0693 0.0174 0.0948 374 PHE C CA 7539 C C . PHE C 288 ? 0.7775 0.7229 0.7116 0.0702 0.0187 0.0915 374 PHE C C 7540 O O . PHE C 288 ? 0.6616 0.6070 0.5910 0.0704 0.0163 0.0863 374 PHE C O 7541 C CB . PHE C 288 ? 0.7251 0.6643 0.6697 0.0654 0.0145 0.0929 374 PHE C CB 7542 C CG . PHE C 288 ? 0.5512 0.4916 0.5045 0.0625 0.0165 0.0945 374 PHE C CG 7543 C CD1 . PHE C 288 ? 0.5946 0.5335 0.5531 0.0602 0.0190 0.0991 374 PHE C CD1 7544 C CD2 . PHE C 288 ? 0.5131 0.4566 0.4695 0.0620 0.0161 0.0917 374 PHE C CD2 7545 C CE1 . PHE C 288 ? 0.6094 0.5515 0.5764 0.0567 0.0207 0.1005 374 PHE C CE1 7546 C CE2 . PHE C 288 ? 0.5992 0.5462 0.5642 0.0597 0.0177 0.0937 374 PHE C CE2 7547 C CZ . PHE C 288 ? 0.6036 0.5508 0.5743 0.0567 0.0197 0.0979 374 PHE C CZ 7548 N N . GLU C 289 ? 0.7666 0.7143 0.7035 0.0707 0.0229 0.0945 375 GLU C N 7549 C CA . GLU C 289 ? 0.6932 0.6428 0.6276 0.0723 0.0252 0.0919 375 GLU C CA 7550 C C . GLU C 289 ? 0.6752 0.6271 0.6195 0.0710 0.0272 0.0938 375 GLU C C 7551 O O . GLU C 289 ? 0.7987 0.7519 0.7506 0.0687 0.0278 0.0978 375 GLU C O 7552 C CB . GLU C 289 ? 0.5890 0.5409 0.5149 0.0756 0.0292 0.0935 375 GLU C CB 7553 C CG . GLU C 289 ? 0.8253 0.7794 0.7542 0.0764 0.0336 0.1002 375 GLU C CG 7554 C CD . GLU C 289 ? 0.8966 0.8526 0.8153 0.0797 0.0367 0.1022 375 GLU C CD 7555 O OE1 . GLU C 289 ? 1.0866 1.0431 1.0054 0.0804 0.0390 0.1078 375 GLU C OE1 7556 O OE2 . GLU C 289 ? 0.8895 0.8461 0.7997 0.0813 0.0371 0.0980 375 GLU C OE2 7557 N N . ILE C 290 ? 0.5835 0.5361 0.5279 0.0724 0.0283 0.0910 376 ILE C N 7558 C CA . ILE C 290 ? 0.7316 0.6886 0.6852 0.0723 0.0305 0.0933 376 ILE C CA 7559 C C . ILE C 290 ? 0.8146 0.7725 0.7637 0.0765 0.0352 0.0925 376 ILE C C 7560 O O . ILE C 290 ? 0.7724 0.7258 0.7135 0.0782 0.0352 0.0878 376 ILE C O 7561 C CB . ILE C 290 ? 0.7762 0.7332 0.7374 0.0695 0.0263 0.0913 376 ILE C CB 7562 C CG1 . ILE C 290 ? 0.7528 0.7172 0.7248 0.0689 0.0281 0.0949 376 ILE C CG1 7563 C CG2 . ILE C 290 ? 0.6154 0.5676 0.5707 0.0708 0.0242 0.0857 376 ILE C CG2 7564 C CD1 . ILE C 290 ? 0.7525 0.7186 0.7324 0.0654 0.0237 0.0939 376 ILE C CD1 7565 N N . TYR C 291 ? 0.7641 0.7276 0.7180 0.0780 0.0398 0.0970 377 TYR C N 7566 C CA . TYR C 291 ? 0.7347 0.6990 0.6838 0.0825 0.0455 0.0971 377 TYR C CA 7567 C C . TYR C 291 ? 0.7262 0.6958 0.6842 0.0845 0.0479 0.0988 377 TYR C C 7568 O O . TYR C 291 ? 0.7336 0.7107 0.7027 0.0825 0.0476 0.1030 377 TYR C O 7569 C CB . TYR C 291 ? 0.7853 0.7528 0.7326 0.0832 0.0497 0.1015 377 TYR C CB 7570 C CG . TYR C 291 ? 0.9701 0.9368 0.9084 0.0875 0.0554 0.1009 377 TYR C CG 7571 C CD1 . TYR C 291 ? 1.0994 1.0614 1.0309 0.0904 0.0571 0.0961 377 TYR C CD1 7572 C CD2 . TYR C 291 ? 1.1379 1.1076 1.0738 0.0886 0.0597 0.1050 377 TYR C CD2 7573 C CE1 . TYR C 291 ? 1.2181 1.1782 1.1404 0.0940 0.0629 0.0950 377 TYR C CE1 7574 C CE2 . TYR C 291 ? 1.2036 1.1725 1.1307 0.0924 0.0652 0.1043 377 TYR C CE2 7575 C CZ . TYR C 291 ? 1.2256 1.1896 1.1458 0.0951 0.0668 0.0991 377 TYR C CZ 7576 O OH . TYR C 291 ? 1.1133 1.0757 1.0239 0.0986 0.0728 0.0980 377 TYR C OH 7577 N N . LYS C 292 ? 0.7522 0.7180 0.7051 0.0884 0.0504 0.0957 378 LYS C N 7578 C CA . LYS C 292 ? 0.7043 0.6751 0.6648 0.0919 0.0532 0.0979 378 LYS C CA 7579 C C . LYS C 292 ? 0.8280 0.8038 0.7890 0.0962 0.0604 0.1016 378 LYS C C 7580 O O . LYS C 292 ? 0.7809 0.7516 0.7313 0.0983 0.0643 0.0999 378 LYS C O 7581 C CB . LYS C 292 ? 0.7909 0.7538 0.7455 0.0946 0.0532 0.0933 378 LYS C CB 7582 C CG . LYS C 292 ? 0.9779 0.9462 0.9412 0.0986 0.0551 0.0960 378 LYS C CG 7583 C CD . LYS C 292 ? 1.1313 1.0908 1.0859 0.1044 0.0603 0.0932 378 LYS C CD 7584 C CE . LYS C 292 ? 1.2359 1.1846 1.1835 0.1027 0.0568 0.0876 378 LYS C CE 7585 N NZ . LYS C 292 ? 1.2638 1.2072 1.2094 0.1084 0.0611 0.0872 378 LYS C NZ 7586 N N . PHE C 293 ? 0.7583 0.7449 0.7313 0.0975 0.0622 0.1066 379 PHE C N 7587 C CA . PHE C 293 ? 0.8833 0.8764 0.8585 0.1019 0.0693 0.1106 379 PHE C CA 7588 C C . PHE C 293 ? 1.0192 1.0175 1.0007 0.1076 0.0723 0.1124 379 PHE C C 7589 O O . PHE C 293 ? 0.9718 0.9759 0.9625 0.1063 0.0682 0.1136 379 PHE C O 7590 C CB . PHE C 293 ? 0.9218 0.9255 0.9066 0.0980 0.0696 0.1160 379 PHE C CB 7591 C CG . PHE C 293 ? 0.9364 0.9346 0.9138 0.0942 0.0687 0.1155 379 PHE C CG 7592 C CD1 . PHE C 293 ? 0.8937 0.8894 0.8623 0.0971 0.0742 0.1161 379 PHE C CD1 7593 C CD2 . PHE C 293 ? 0.8577 0.8532 0.8365 0.0883 0.0626 0.1146 379 PHE C CD2 7594 C CE1 . PHE C 293 ? 0.7953 0.7869 0.7568 0.0944 0.0733 0.1164 379 PHE C CE1 7595 C CE2 . PHE C 293 ? 0.9486 0.9392 0.9205 0.0860 0.0622 0.1149 379 PHE C CE2 7596 C CZ . PHE C 293 ? 0.8408 0.8299 0.8041 0.0891 0.0674 0.1160 379 PHE C CZ 7597 N N . LEU C 294 ? 1.0693 1.0653 1.0453 0.1141 0.0797 0.1127 380 LEU C N 7598 C CA . LEU C 294 ? 0.9400 0.9403 0.9212 0.1210 0.0838 0.1152 380 LEU C CA 7599 C C . LEU C 294 ? 1.0247 1.0425 1.0198 0.1224 0.0867 0.1222 380 LEU C C 7600 O O . LEU C 294 ? 1.2607 1.2814 1.2543 0.1254 0.0932 0.1246 380 LEU C O 7601 C CB . LEU C 294 ? 1.0307 1.0190 0.9988 0.1276 0.0912 0.1120 380 LEU C CB 7602 C CG . LEU C 294 ? 0.9182 0.8892 0.8705 0.1254 0.0895 0.1043 380 LEU C CG 7603 C CD1 . LEU C 294 ? 0.8716 0.8314 0.8106 0.1310 0.0979 0.1012 380 LEU C CD1 7604 C CD2 . LEU C 294 ? 0.7028 0.6687 0.6561 0.1241 0.0842 0.1016 380 LEU C CD2 7605 N N . GLY C 295 ? 1.0212 1.0515 1.0299 0.1197 0.0820 0.1255 381 GLY C N 7606 C CA . GLY C 295 ? 1.1251 1.1741 1.1483 0.1189 0.0835 0.1318 381 GLY C CA 7607 C C . GLY C 295 ? 1.0461 1.1023 1.0772 0.1091 0.0779 0.1329 381 GLY C C 7608 O O . GLY C 295 ? 0.9428 0.9895 0.9687 0.1034 0.0722 0.1290 381 GLY C O 7609 N N . THR C 296 ? 1.0892 1.1619 1.1327 0.1073 0.0800 0.1383 382 THR C N 7610 C CA . THR C 296 ? 1.0126 1.0935 1.0651 0.0976 0.0756 0.1397 382 THR C CA 7611 C C . THR C 296 ? 1.0074 1.0783 1.0522 0.0923 0.0762 0.1385 382 THR C C 7612 O O . THR C 296 ? 0.9336 0.9973 0.9692 0.0963 0.0815 0.1383 382 THR C O 7613 C CB . THR C 296 ? 0.9279 1.0307 0.9961 0.0968 0.0785 0.1459 382 THR C CB 7614 O OG1 . THR C 296 ? 0.8573 0.9666 0.9333 0.0863 0.0747 0.1467 382 THR C OG1 7615 C CG2 . THR C 296 ? 0.8623 0.9683 0.9289 0.1022 0.0873 0.1493 382 THR C CG2 7616 N N . LEU C 297 ? 0.9428 1.0132 0.9911 0.0836 0.0712 0.1378 383 LEU C N 7617 C CA . LEU C 297 ? 0.9703 1.0318 1.0122 0.0787 0.0719 0.1375 383 LEU C CA 7618 C C . LEU C 297 ? 1.0330 1.1048 1.0813 0.0771 0.0781 0.1428 383 LEU C C 7619 O O . LEU C 297 ? 0.9829 1.0479 1.0255 0.0744 0.0805 0.1438 383 LEU C O 7620 C CB . LEU C 297 ? 1.0343 1.0918 1.0785 0.0701 0.0655 0.1355 383 LEU C CB 7621 C CG . LEU C 297 ? 0.9955 1.0426 1.0337 0.0702 0.0590 0.1302 383 LEU C CG 7622 C CD1 . LEU C 297 ? 0.9074 0.9550 0.9514 0.0615 0.0533 0.1290 383 LEU C CD1 7623 C CD2 . LEU C 297 ? 0.9473 0.9784 0.9705 0.0732 0.0592 0.1268 383 LEU C CD2 7624 N N . PHE C 298 ? 1.1299 1.2184 1.1899 0.0792 0.0809 0.1465 384 PHE C N 7625 C CA . PHE C 298 ? 1.1410 1.2427 1.2102 0.0760 0.0862 0.1518 384 PHE C CA 7626 C C . PHE C 298 ? 1.1035 1.2129 1.1734 0.0844 0.0941 0.1553 384 PHE C C 7627 O O . PHE C 298 ? 1.1213 1.2483 1.2034 0.0838 0.0977 0.1599 384 PHE C O 7628 C CB . PHE C 298 ? 1.0599 1.1780 1.1447 0.0687 0.0826 0.1536 384 PHE C CB 7629 C CG . PHE C 298 ? 1.0030 1.1133 1.0867 0.0613 0.0750 0.1496 384 PHE C CG 7630 C CD1 . PHE C 298 ? 0.9103 1.0072 0.9874 0.0548 0.0742 0.1481 384 PHE C CD1 7631 C CD2 . PHE C 298 ? 1.0224 1.1380 1.1110 0.0614 0.0691 0.1474 384 PHE C CD2 7632 C CE1 . PHE C 298 ? 0.7997 0.8885 0.8754 0.0484 0.0678 0.1444 384 PHE C CE1 7633 C CE2 . PHE C 298 ? 1.0029 1.1109 1.0899 0.0545 0.0624 0.1435 384 PHE C CE2 7634 C CZ . PHE C 298 ? 0.9029 0.9973 0.9835 0.0480 0.0619 0.1419 384 PHE C CZ 7635 N N . SER C 299 ? 1.0226 1.1190 1.0790 0.0919 0.0968 0.1528 385 SER C N 7636 C CA . SER C 299 ? 1.0203 1.1187 1.0728 0.0993 0.1052 0.1553 385 SER C CA 7637 C C . SER C 299 ? 1.0536 1.1347 1.0895 0.1001 0.1070 0.1525 385 SER C C 7638 O O . SER C 299 ? 1.1263 1.1944 1.1536 0.0972 0.1016 0.1484 385 SER C O 7639 C CB . SER C 299 ? 1.0911 1.1908 1.1426 0.1090 0.1074 0.1544 385 SER C CB 7640 O OG . SER C 299 ? 1.0797 1.1710 1.1195 0.1161 0.1146 0.1538 385 SER C OG 7641 N N . VAL C 300 ? 1.0116 1.0934 1.0427 0.1041 0.1147 0.1550 387 VAL C N 7642 C CA . VAL C 300 ? 1.0328 1.0999 1.0475 0.1052 0.1166 0.1527 387 VAL C CA 7643 C C . VAL C 300 ? 1.0628 1.1198 1.0650 0.1132 0.1188 0.1482 387 VAL C C 7644 O O . VAL C 300 ? 0.9814 1.0255 0.9684 0.1142 0.1191 0.1446 387 VAL C O 7645 C CB . VAL C 300 ? 0.9024 0.9747 0.9171 0.1047 0.1239 0.1576 387 VAL C CB 7646 C CG1 . VAL C 300 ? 0.6708 0.7382 0.6836 0.0969 0.1214 0.1592 387 VAL C CG1 7647 C CG2 . VAL C 300 ? 0.9689 1.0604 1.0000 0.1053 0.1284 0.1629 387 VAL C CG2 7648 N N . GLN C 301 ? 1.1008 1.1640 1.1093 0.1187 0.1204 0.1483 388 GLN C N 7649 C CA . GLN C 301 ? 1.1304 1.1834 1.1277 0.1264 0.1236 0.1442 388 GLN C CA 7650 C C . GLN C 301 ? 1.1284 1.1695 1.1194 0.1252 0.1165 0.1383 388 GLN C C 7651 O O . GLN C 301 ? 1.1334 1.1612 1.1105 0.1289 0.1182 0.1332 388 GLN C O 7652 C CB . GLN C 301 ? 1.1880 1.2518 1.1938 0.1343 0.1300 0.1477 388 GLN C CB 7653 C CG . GLN C 301 ? 1.2785 1.3556 1.2913 0.1362 0.1377 0.1537 388 GLN C CG 7654 C CD . GLN C 301 ? 1.4081 1.5062 1.4409 0.1362 0.1376 0.1595 388 GLN C CD 7655 O OE1 . GLN C 301 ? 1.4005 1.5036 1.4392 0.1417 0.1373 0.1600 388 GLN C OE1 7656 N NE2 . GLN C 301 ? 1.4020 1.5129 1.4452 0.1298 0.1378 0.1641 388 GLN C NE2 7657 N N . THR C 302 ? 1.1042 1.1497 1.1047 0.1196 0.1090 0.1385 390 THR C N 7658 C CA . THR C 302 ? 1.0224 1.0574 1.0176 0.1186 0.1024 0.1331 390 THR C CA 7659 C C . THR C 302 ? 1.0764 1.0955 1.0553 0.1163 0.1003 0.1276 390 THR C C 7660 O O . THR C 302 ? 0.9768 0.9946 0.9515 0.1127 0.1004 0.1286 390 THR C O 7661 C CB . THR C 302 ? 1.0754 1.1180 1.0832 0.1129 0.0947 0.1341 390 THR C CB 7662 O OG1 . THR C 302 ? 1.2624 1.3062 1.2728 0.1049 0.0910 0.1352 390 THR C OG1 7663 C CG2 . THR C 302 ? 1.0697 1.1298 1.0932 0.1156 0.0967 0.1394 390 THR C CG2 7664 N N . VAL C 303 ? 1.2375 1.2452 1.2071 0.1186 0.0986 0.1220 391 VAL C N 7665 C CA . VAL C 303 ? 1.2356 1.2296 1.1878 0.1191 0.0999 0.1165 391 VAL C CA 7666 C C . VAL C 303 ? 1.2753 1.2618 1.2205 0.1130 0.0927 0.1126 391 VAL C C 7667 O O . VAL C 303 ? 1.5194 1.5063 1.4604 0.1102 0.0925 0.1139 391 VAL C O 7668 C CB . VAL C 303 ? 1.2201 1.2044 1.1635 0.1250 0.1039 0.1120 391 VAL C CB 7669 C CG1 . VAL C 303 ? 0.8816 0.8573 0.8093 0.1273 0.1100 0.1088 391 VAL C CG1 7670 C CG2 . VAL C 303 ? 1.3025 1.2952 1.2567 0.1313 0.1087 0.1164 391 VAL C CG2 7671 N N . GLY C 304 ? 0.8746 0.8546 0.8180 0.1115 0.0874 0.1081 392 GLY C N 7672 C CA . GLY C 304 ? 0.8726 0.8455 0.8082 0.1066 0.0812 0.1040 392 GLY C CA 7673 C C . GLY C 304 ? 1.0244 0.9856 0.9475 0.1077 0.0811 0.0969 392 GLY C C 7674 O O . GLY C 304 ? 0.9782 0.9335 0.8896 0.1104 0.0863 0.0939 392 GLY C O 7675 N N . ASN C 305 A 1.1392 1.0967 1.0644 0.1052 0.0754 0.0938 392 ASN C N 7676 C CA . ASN C 305 A 0.9913 0.9386 0.9083 0.1069 0.0763 0.0880 392 ASN C CA 7677 C C . ASN C 305 A 1.0724 1.0122 0.9806 0.1020 0.0706 0.0819 392 ASN C C 7678 O O . ASN C 305 A 0.9936 0.9245 0.8889 0.1020 0.0728 0.0761 392 ASN C O 7679 C CB . ASN C 305 A 0.8944 0.8439 0.8217 0.1095 0.0758 0.0900 392 ASN C CB 7680 C CG . ASN C 305 A 1.0029 0.9407 0.9216 0.1125 0.0789 0.0851 392 ASN C CG 7681 O OD1 . ASN C 305 A 1.0713 1.0042 0.9900 0.1104 0.0746 0.0821 392 ASN C OD1 7682 N ND2 . ASN C 305 A 0.9859 0.9183 0.8966 0.1175 0.0870 0.0841 392 ASN C ND2 7683 N N . ARG C 306 ? 1.0811 1.0247 0.9965 0.0978 0.0635 0.0830 393 ARG C N 7684 C CA . ARG C 306 ? 0.9247 0.8630 0.8333 0.0934 0.0579 0.0779 393 ARG C CA 7685 C C . ARG C 306 ? 0.8926 0.8366 0.8082 0.0894 0.0517 0.0807 393 ARG C C 7686 O O . ARG C 306 ? 0.8170 0.7653 0.7440 0.0882 0.0488 0.0839 393 ARG C O 7687 C CB . ARG C 306 ? 0.8044 0.7356 0.7123 0.0930 0.0562 0.0735 393 ARG C CB 7688 C CG . ARG C 306 ? 0.8096 0.7354 0.7094 0.0884 0.0513 0.0675 393 ARG C CG 7689 C CD . ARG C 306 ? 1.1108 1.0262 1.0030 0.0887 0.0535 0.0616 393 ARG C CD 7690 N NE . ARG C 306 ? 1.1293 1.0411 1.0186 0.0839 0.0479 0.0568 393 ARG C NE 7691 C CZ . ARG C 306 ? 0.9626 0.8744 0.8436 0.0800 0.0452 0.0526 393 ARG C CZ 7692 N NH1 . ARG C 306 ? 1.1552 1.0700 1.0294 0.0803 0.0473 0.0527 393 ARG C NH1 7693 N NH2 . ARG C 306 ? 0.8250 0.7347 0.7045 0.0759 0.0404 0.0485 393 ARG C NH2 7694 N N . ASN C 307 ? 0.8812 0.8250 0.7891 0.0875 0.0499 0.0795 394 ASN C N 7695 C CA . ASN C 307 ? 0.8640 0.8114 0.7762 0.0843 0.0446 0.0820 394 ASN C CA 7696 C C . ASN C 307 ? 0.8664 0.8100 0.7754 0.0812 0.0388 0.0770 394 ASN C C 7697 O O . ASN C 307 ? 0.8838 0.8249 0.7822 0.0804 0.0381 0.0724 394 ASN C O 7698 C CB . ASN C 307 ? 0.8020 0.7524 0.7079 0.0850 0.0463 0.0846 394 ASN C CB 7699 C CG . ASN C 307 ? 0.9360 0.8896 0.8476 0.0830 0.0427 0.0891 394 ASN C CG 7700 O OD1 . ASN C 307 ? 1.3141 1.2710 1.2354 0.0826 0.0439 0.0942 394 ASN C OD1 7701 N ND2 . ASN C 307 ? 0.9351 0.8880 0.8407 0.0817 0.0387 0.0873 394 ASN C ND2 7702 N N . TYR C 308 ? 0.7883 0.7321 0.7063 0.0791 0.0347 0.0776 395 TYR C N 7703 C CA . TYR C 308 ? 0.7674 0.7081 0.6834 0.0761 0.0293 0.0733 395 TYR C CA 7704 C C . TYR C 308 ? 0.7091 0.6526 0.6260 0.0743 0.0254 0.0755 395 TYR C C 7705 O O . TYR C 308 ? 0.7781 0.7238 0.7035 0.0735 0.0245 0.0801 395 TYR C O 7706 C CB . TYR C 308 ? 0.6771 0.6163 0.6017 0.0749 0.0269 0.0728 395 TYR C CB 7707 C CG . TYR C 308 ? 0.7052 0.6399 0.6277 0.0768 0.0298 0.0699 395 TYR C CG 7708 C CD1 . TYR C 308 ? 0.7773 0.7054 0.6899 0.0761 0.0302 0.0638 395 TYR C CD1 7709 C CD2 . TYR C 308 ? 0.5914 0.5287 0.5220 0.0793 0.0325 0.0735 395 TYR C CD2 7710 C CE1 . TYR C 308 ? 0.7369 0.6587 0.6468 0.0781 0.0337 0.0613 395 TYR C CE1 7711 C CE2 . TYR C 308 ? 0.7580 0.6906 0.6866 0.0821 0.0356 0.0715 395 TYR C CE2 7712 C CZ . TYR C 308 ? 0.7554 0.6793 0.6733 0.0816 0.0365 0.0655 395 TYR C CZ 7713 O OH . TYR C 308 ? 0.8261 0.7435 0.7412 0.0847 0.0405 0.0638 395 TYR C OH 7714 N N . GLN C 309 ? 0.6607 0.6041 0.5689 0.0736 0.0233 0.0723 396 GLN C N 7715 C CA . GLN C 309 ? 0.7230 0.6691 0.6318 0.0728 0.0195 0.0745 396 GLN C CA 7716 C C . GLN C 309 ? 0.6926 0.6367 0.6049 0.0701 0.0145 0.0715 396 GLN C C 7717 O O . GLN C 309 ? 0.7622 0.7073 0.6687 0.0691 0.0116 0.0677 396 GLN C O 7718 C CB . GLN C 309 ? 0.7734 0.7231 0.6717 0.0741 0.0197 0.0739 396 GLN C CB 7719 C CG . GLN C 309 ? 1.0416 0.9939 0.9377 0.0768 0.0242 0.0789 396 GLN C CG 7720 C CD . GLN C 309 ? 1.2201 1.1754 1.1038 0.0779 0.0256 0.0763 396 GLN C CD 7721 O OE1 . GLN C 309 ? 1.4166 1.3698 1.2948 0.0779 0.0290 0.0725 396 GLN C OE1 7722 N NE2 . GLN C 309 ? 1.0816 1.0419 0.9604 0.0788 0.0232 0.0781 396 GLN C NE2 7723 N N . LEU C 310 ? 0.6537 0.5960 0.5756 0.0689 0.0135 0.0735 397 LEU C N 7724 C CA . LEU C 310 ? 0.6503 0.5902 0.5765 0.0663 0.0092 0.0710 397 LEU C CA 7725 C C . LEU C 310 ? 0.7576 0.6986 0.6818 0.0658 0.0056 0.0708 397 LEU C C 7726 O O . LEU C 310 ? 0.6655 0.6058 0.5874 0.0642 0.0025 0.0664 397 LEU C O 7727 C CB . LEU C 310 ? 0.5763 0.5155 0.5129 0.0648 0.0092 0.0738 397 LEU C CB 7728 C CG . LEU C 310 ? 0.6593 0.5989 0.5991 0.0658 0.0121 0.0739 397 LEU C CG 7729 C CD1 . LEU C 310 ? 0.6068 0.5482 0.5572 0.0639 0.0112 0.0765 397 LEU C CD1 7730 C CD2 . LEU C 310 ? 0.5537 0.4896 0.4878 0.0661 0.0119 0.0684 397 LEU C CD2 7731 N N . LEU C 311 ? 0.7074 0.6501 0.6322 0.0674 0.0064 0.0758 398 LEU C N 7732 C CA . LEU C 311 ? 0.6749 0.6189 0.5975 0.0682 0.0037 0.0767 398 LEU C CA 7733 C C . LEU C 311 ? 0.7376 0.6861 0.6533 0.0716 0.0053 0.0801 398 LEU C C 7734 O O . LEU C 311 ? 0.7541 0.7033 0.6687 0.0731 0.0090 0.0834 398 LEU C O 7735 C CB . LEU C 311 ? 0.7048 0.6448 0.6349 0.0671 0.0030 0.0800 398 LEU C CB 7736 C CG . LEU C 311 ? 0.7441 0.6804 0.6804 0.0637 0.0003 0.0767 398 LEU C CG 7737 C CD1 . LEU C 311 ? 0.7041 0.6389 0.6470 0.0615 0.0021 0.0778 398 LEU C CD1 7738 C CD2 . LEU C 311 ? 0.7981 0.7311 0.7370 0.0635 -0.0011 0.0787 398 LEU C CD2 7739 N N . SER C 312 ? 0.8474 0.7999 0.7588 0.0731 0.0026 0.0795 399 SER C N 7740 C CA . SER C 312 ? 0.8303 0.7889 0.7343 0.0767 0.0034 0.0827 399 SER C CA 7741 C C . SER C 312 ? 0.8169 0.7774 0.7214 0.0795 0.0013 0.0863 399 SER C C 7742 O O . SER C 312 ? 0.8377 0.7991 0.7403 0.0833 0.0033 0.0925 399 SER C O 7743 C CB . SER C 312 ? 0.6848 0.6498 0.5802 0.0758 0.0020 0.0772 399 SER C CB 7744 O OG . SER C 312 ? 1.1578 1.1190 1.0527 0.0732 0.0040 0.0730 399 SER C OG 7745 N N . ASN C 313 ? 0.8012 0.7620 0.7079 0.0779 -0.0023 0.0824 401 ASN C N 7746 C CA . ASN C 313 ? 0.8459 0.8095 0.7529 0.0809 -0.0044 0.0849 401 ASN C CA 7747 C C . ASN C 313 ? 0.7525 0.7081 0.6647 0.0829 -0.0019 0.0911 401 ASN C C 7748 O O . ASN C 313 ? 0.8818 0.8388 0.7918 0.0877 -0.0009 0.0966 401 ASN C O 7749 C CB . ASN C 313 ? 0.9886 0.9533 0.8980 0.0780 -0.0083 0.0790 401 ASN C CB 7750 C CG . ASN C 313 ? 1.1509 1.1247 1.0541 0.0761 -0.0109 0.0730 401 ASN C CG 7751 O OD1 . ASN C 313 ? 1.1393 1.1166 1.0364 0.0757 -0.0096 0.0719 401 ASN C OD1 7752 N ND2 . ASN C 313 ? 1.2738 1.2510 1.1780 0.0745 -0.0142 0.0690 401 ASN C ND2 7753 N N . SER C 314 ? 0.7258 0.6728 0.6446 0.0793 -0.0005 0.0904 402 SER C N 7754 C CA . SER C 314 ? 0.7716 0.7101 0.6953 0.0796 0.0013 0.0943 402 SER C CA 7755 C C . SER C 314 ? 0.7865 0.7194 0.7116 0.0800 0.0062 0.1003 402 SER C C 7756 O O . SER C 314 ? 0.7267 0.6620 0.6504 0.0795 0.0083 0.1012 402 SER C O 7757 C CB . SER C 314 ? 0.8053 0.7384 0.7354 0.0749 -0.0008 0.0896 402 SER C CB 7758 O OG . SER C 314 ? 0.8141 0.7465 0.7471 0.0707 -0.0007 0.0864 402 SER C OG 7759 N N . THR C 315 ? 0.8769 0.8018 0.8043 0.0809 0.0084 0.1043 403 THR C N 7760 C CA . THR C 315 ? 0.7313 0.6493 0.6599 0.0809 0.0137 0.1103 403 THR C CA 7761 C C . THR C 315 ? 0.6590 0.5705 0.5952 0.0742 0.0149 0.1083 403 THR C C 7762 O O . THR C 315 ? 0.9608 0.8664 0.9009 0.0712 0.0137 0.1057 403 THR C O 7763 C CB . THR C 315 ? 0.6992 0.6109 0.6251 0.0857 0.0163 0.1161 403 THR C CB 7764 O OG1 . THR C 315 ? 0.7719 0.6923 0.6909 0.0924 0.0152 0.1188 403 THR C OG1 7765 C CG2 . THR C 315 ? 0.6798 0.5823 0.6064 0.0850 0.0224 0.1221 403 THR C CG2 7766 N N . ILE C 316 ? 0.6337 0.5473 0.5717 0.0720 0.0172 0.1094 404 ILE C N 7767 C CA . ILE C 316 ? 0.6402 0.5516 0.5859 0.0656 0.0180 0.1074 404 ILE C CA 7768 C C . ILE C 316 ? 0.7241 0.6270 0.6729 0.0627 0.0229 0.1120 404 ILE C C 7769 O O . ILE C 316 ? 0.6273 0.5268 0.5721 0.0659 0.0271 0.1177 404 ILE C O 7770 C CB . ILE C 316 ? 0.7385 0.6576 0.6852 0.0649 0.0186 0.1066 404 ILE C CB 7771 C CG1 . ILE C 316 ? 0.7535 0.6797 0.6947 0.0681 0.0153 0.1026 404 ILE C CG1 7772 C CG2 . ILE C 316 ? 0.6867 0.6063 0.6419 0.0589 0.0184 0.1042 404 ILE C CG2 7773 C CD1 . ILE C 316 ? 0.6433 0.5696 0.5849 0.0670 0.0104 0.0969 404 ILE C CD1 7774 N N . GLY C 317 ? 0.7589 0.6583 0.7145 0.0563 0.0226 0.1094 405 GLY C N 7775 C CA . GLY C 317 ? 0.6183 0.5107 0.5776 0.0515 0.0273 0.1125 405 GLY C CA 7776 C C . GLY C 317 ? 0.7589 0.6580 0.7260 0.0454 0.0268 0.1104 405 GLY C C 7777 O O . GLY C 317 ? 0.6532 0.5610 0.6209 0.0471 0.0268 0.1109 405 GLY C O 7778 N N . ARG C 318 ? 0.8229 0.7184 0.7956 0.0385 0.0265 0.1079 406 ARG C N 7779 C CA . ARG C 318 ? 0.7532 0.6565 0.7340 0.0325 0.0260 0.1063 406 ARG C CA 7780 C C . ARG C 318 ? 0.7773 0.6905 0.7603 0.0340 0.0207 0.1020 406 ARG C C 7781 O O . ARG C 318 ? 0.6482 0.5602 0.6273 0.0373 0.0169 0.0988 406 ARG C O 7782 C CB . ARG C 318 ? 0.6891 0.5867 0.6747 0.0241 0.0267 0.1044 406 ARG C CB 7783 C CG . ARG C 318 ? 0.6578 0.5439 0.6414 0.0212 0.0328 0.1083 406 ARG C CG 7784 C CD . ARG C 318 ? 0.6167 0.4973 0.6047 0.0116 0.0332 0.1049 406 ARG C CD 7785 N NE . ARG C 318 ? 0.8484 0.7287 0.8359 0.0117 0.0277 0.0994 406 ARG C NE 7786 C CZ . ARG C 318 ? 0.7993 0.6863 0.7923 0.0058 0.0237 0.0949 406 ARG C CZ 7787 N NH1 . ARG C 318 ? 0.9588 0.8546 0.9592 -0.0010 0.0244 0.0950 406 ARG C NH1 7788 N NH2 . ARG C 318 ? 0.7838 0.6696 0.7752 0.0068 0.0192 0.0904 406 ARG C NH2 7789 N N . SER C 319 ? 0.6550 0.5780 0.6442 0.0317 0.0210 0.1022 407 SER C N 7790 C CA . SER C 319 ? 0.6222 0.5537 0.6140 0.0329 0.0168 0.0987 407 SER C CA 7791 C C . SER C 319 ? 0.7783 0.7187 0.7797 0.0270 0.0167 0.0985 407 SER C C 7792 O O . SER C 319 ? 0.6526 0.5957 0.6584 0.0234 0.0205 0.1019 407 SER C O 7793 C CB . SER C 319 ? 0.5592 0.4953 0.5463 0.0398 0.0174 0.0994 407 SER C CB 7794 O OG . SER C 319 ? 0.7408 0.6824 0.7301 0.0405 0.0218 0.1036 407 SER C OG 7795 N N . GLY C 320 ? 0.7116 0.6570 0.7162 0.0258 0.0123 0.0949 408 GLY C N 7796 C CA . GLY C 320 ? 0.6517 0.6070 0.6653 0.0203 0.0114 0.0948 408 GLY C CA 7797 C C . GLY C 320 ? 0.7870 0.7515 0.8035 0.0227 0.0078 0.0928 408 GLY C C 7798 O O . GLY C 320 ? 0.7645 0.7256 0.7755 0.0277 0.0056 0.0904 408 GLY C O 7799 N N . LEU C 321 ? 0.7750 0.7515 0.8001 0.0192 0.0075 0.0940 409 LEU C N 7800 C CA . LEU C 321 ? 0.6910 0.6773 0.7194 0.0223 0.0046 0.0932 409 LEU C CA 7801 C C . LEU C 321 ? 0.7715 0.7608 0.8030 0.0172 -0.0002 0.0900 409 LEU C C 7802 O O . LEU C 321 ? 0.7813 0.7693 0.8154 0.0096 -0.0008 0.0888 409 LEU C O 7803 C CB . LEU C 321 ? 0.8102 0.8106 0.8464 0.0233 0.0075 0.0974 409 LEU C CB 7804 C CG . LEU C 321 ? 0.7973 0.8014 0.8317 0.0318 0.0103 0.0997 409 LEU C CG 7805 C CD1 . LEU C 321 ? 0.6068 0.5981 0.6303 0.0373 0.0112 0.0978 409 LEU C CD1 7806 C CD2 . LEU C 321 ? 0.6541 0.6674 0.6945 0.0313 0.0152 0.1043 409 LEU C CD2 7807 N N . TYR C 322 ? 0.8364 0.8291 0.8671 0.0213 -0.0033 0.0885 410 TYR C N 7808 C CA . TYR C 322 ? 0.6746 0.6728 0.7087 0.0171 -0.0079 0.0862 410 TYR C CA 7809 C C . TYR C 322 ? 0.6998 0.7058 0.7349 0.0230 -0.0097 0.0869 410 TYR C C 7810 O O . TYR C 322 ? 0.8051 0.8059 0.8348 0.0301 -0.0082 0.0870 410 TYR C O 7811 C CB . TYR C 322 ? 0.5795 0.5652 0.6075 0.0136 -0.0106 0.0816 410 TYR C CB 7812 C CG . TYR C 322 ? 0.6905 0.6663 0.7102 0.0195 -0.0118 0.0790 410 TYR C CG 7813 C CD1 . TYR C 322 ? 0.7547 0.7206 0.7679 0.0235 -0.0092 0.0791 410 TYR C CD1 7814 C CD2 . TYR C 322 ? 0.6190 0.5955 0.6370 0.0207 -0.0155 0.0765 410 TYR C CD2 7815 C CE1 . TYR C 322 ? 0.8024 0.7605 0.8081 0.0281 -0.0104 0.0764 410 TYR C CE1 7816 C CE2 . TYR C 322 ? 0.6592 0.6265 0.6695 0.0253 -0.0163 0.0739 410 TYR C CE2 7817 C CZ . TYR C 322 ? 0.9055 0.8642 0.9101 0.0286 -0.0139 0.0737 410 TYR C CZ 7818 O OH . TYR C 322 ? 0.9366 0.8878 0.9340 0.0323 -0.0148 0.0708 410 TYR C OH 7819 N N . GLN C 323 ? 0.6843 0.7028 0.7260 0.0199 -0.0127 0.0875 411 GLN C N 7820 C CA . GLN C 323 ? 0.6193 0.6455 0.6620 0.0257 -0.0145 0.0888 411 GLN C CA 7821 C C . GLN C 323 ? 0.7121 0.7365 0.7522 0.0231 -0.0195 0.0854 411 GLN C C 7822 O O . GLN C 323 ? 0.7692 0.8008 0.8137 0.0158 -0.0225 0.0843 411 GLN C O 7823 C CB . GLN C 323 ? 0.5009 0.5463 0.5538 0.0262 -0.0136 0.0936 411 GLN C CB 7824 C CG . GLN C 323 ? 0.5927 0.6409 0.6477 0.0312 -0.0082 0.0975 411 GLN C CG 7825 C CD . GLN C 323 ? 0.7862 0.8548 0.8529 0.0296 -0.0070 0.1022 411 GLN C CD 7826 O OE1 . GLN C 323 ? 0.8036 0.8810 0.8766 0.0208 -0.0089 0.1018 411 GLN C OE1 7827 N NE2 . GLN C 323 ? 0.6603 0.7364 0.7295 0.0379 -0.0036 0.1064 411 GLN C NE2 7828 N N . PRO C 324 ? 0.8669 0.8817 0.8996 0.0285 -0.0202 0.0835 412 PRO C N 7829 C CA . PRO C 324 ? 0.7566 0.7697 0.7863 0.0270 -0.0245 0.0806 412 PRO C CA 7830 C C . PRO C 324 ? 0.7786 0.8078 0.8144 0.0287 -0.0266 0.0841 412 PRO C C 7831 O O . PRO C 324 ? 0.8238 0.8604 0.8628 0.0352 -0.0238 0.0884 412 PRO C O 7832 C CB . PRO C 324 ? 0.6778 0.6776 0.6984 0.0334 -0.0233 0.0787 412 PRO C CB 7833 C CG . PRO C 324 ? 0.8952 0.8881 0.9132 0.0363 -0.0190 0.0792 412 PRO C CG 7834 C CD . PRO C 324 ? 0.9444 0.9492 0.9705 0.0359 -0.0166 0.0836 412 PRO C CD 7835 N N . ALA C 325 ? 0.8926 0.9279 0.9300 0.0233 -0.0310 0.0825 413 ALA C N 7836 C CA . ALA C 325 ? 0.9447 0.9970 0.9877 0.0255 -0.0334 0.0862 413 ALA C CA 7837 C C . ALA C 325 ? 0.9966 1.0490 1.0357 0.0239 -0.0380 0.0840 413 ALA C C 7838 O O . ALA C 325 ? 1.0610 1.1286 1.1052 0.0199 -0.0416 0.0851 413 ALA C O 7839 C CB . ALA C 325 ? 0.9722 1.0430 1.0257 0.0199 -0.0340 0.0889 413 ALA C CB 7840 N N . TYR C 326 A 1.0058 1.0420 1.0358 0.0266 -0.0377 0.0808 413 TYR C N 7841 C CA . TYR C 326 A 1.1171 1.1523 1.1424 0.0278 -0.0409 0.0798 413 TYR C CA 7842 C C . TYR C 326 A 1.1581 1.1887 1.1793 0.0382 -0.0379 0.0830 413 TYR C C 7843 O O . TYR C 326 A 0.9234 0.9428 0.9369 0.0410 -0.0379 0.0810 413 TYR C O 7844 C CB . TYR C 326 A 0.9840 1.0051 1.0021 0.0222 -0.0429 0.0736 413 TYR C CB 7845 C CG . TYR C 326 A 1.1297 1.1338 1.1424 0.0232 -0.0397 0.0704 413 TYR C CG 7846 C CD1 . TYR C 326 A 1.0775 1.0785 1.0925 0.0189 -0.0379 0.0692 413 TYR C CD1 7847 C CD2 . TYR C 326 A 1.1216 1.1130 1.1264 0.0281 -0.0383 0.0687 413 TYR C CD2 7848 C CE1 . TYR C 326 A 0.9752 0.9621 0.9850 0.0203 -0.0353 0.0669 413 TYR C CE1 7849 C CE2 . TYR C 326 A 1.1040 1.0821 1.1041 0.0287 -0.0358 0.0658 413 TYR C CE2 7850 C CZ . TYR C 326 A 1.1112 1.0875 1.1137 0.0251 -0.0345 0.0651 413 TYR C CZ 7851 O OH . TYR C 326 A 1.0884 1.0530 1.0860 0.0264 -0.0322 0.0628 413 TYR C OH 7852 N N . GLU C 327 ? 1.3115 1.3511 1.3383 0.0437 -0.0348 0.0879 414 GLU C N 7853 C CA . GLU C 327 ? 1.3828 1.4193 1.4067 0.0540 -0.0309 0.0917 414 GLU C CA 7854 C C . GLU C 327 ? 1.4241 1.4734 1.4503 0.0584 -0.0329 0.0964 414 GLU C C 7855 O O . GLU C 327 ? 1.4557 1.5205 1.4877 0.0536 -0.0374 0.0975 414 GLU C O 7856 C CB . GLU C 327 ? 1.4576 1.4986 1.4865 0.0581 -0.0262 0.0952 414 GLU C CB 7857 C CG . GLU C 327 ? 1.7368 1.7927 1.7757 0.0516 -0.0275 0.0965 414 GLU C CG 7858 C CD . GLU C 327 ? 1.6732 1.7487 1.7216 0.0566 -0.0260 0.1032 414 GLU C CD 7859 O OE1 . GLU C 327 ? 1.6353 1.7170 1.6837 0.0640 -0.0257 0.1074 414 GLU C OE1 7860 O OE2 . GLU C 327 ? 1.5723 1.6575 1.6282 0.0533 -0.0248 0.1047 414 GLU C OE2 7861 N N . SER C 328 ? 1.3524 1.3946 1.3732 0.0675 -0.0294 0.0991 415 SER C N 7862 C CA . SER C 328 ? 1.3939 1.4490 1.4178 0.0751 -0.0291 0.1058 415 SER C CA 7863 C C . SER C 328 ? 1.4869 1.5354 1.5093 0.0845 -0.0220 0.1090 415 SER C C 7864 O O . SER C 328 ? 1.6282 1.6723 1.6461 0.0935 -0.0185 0.1128 415 SER C O 7865 C CB . SER C 328 ? 1.3667 1.4159 1.3832 0.0771 -0.0311 0.1056 415 SER C CB 7866 O OG . SER C 328 ? 1.3455 1.4145 1.3676 0.0778 -0.0353 0.1103 415 SER C OG 7867 N N . ARG C 329 A 1.2964 1.3431 1.3217 0.0821 -0.0196 0.1074 415 ARG C N 7868 C CA . ARG C 329 A 1.2447 1.2830 1.2673 0.0893 -0.0126 0.1089 415 ARG C CA 7869 C C . ARG C 329 A 1.1624 1.2186 1.1948 0.0948 -0.0100 0.1157 415 ARG C C 7870 O O . ARG C 329 A 1.2872 1.3619 1.3297 0.0899 -0.0136 0.1176 415 ARG C O 7871 C CB . ARG C 329 A 1.3443 1.3693 1.3631 0.0839 -0.0111 0.1031 415 ARG C CB 7872 C CG . ARG C 329 A 1.3506 1.3560 1.3585 0.0808 -0.0117 0.0968 415 ARG C CG 7873 C CD . ARG C 329 A 1.3984 1.3923 1.4023 0.0779 -0.0093 0.0923 415 ARG C CD 7874 N NE . ARG C 329 A 1.4379 1.4240 1.4373 0.0850 -0.0026 0.0935 415 ARG C NE 7875 C CZ . ARG C 329 A 1.4078 1.3855 1.4033 0.0839 0.0004 0.0906 415 ARG C CZ 7876 N NH1 . ARG C 329 A 1.2016 1.1776 1.1975 0.0767 -0.0026 0.0868 415 ARG C NH1 7877 N NH2 . ARG C 329 A 1.4439 1.4146 1.4345 0.0903 0.0068 0.0915 415 ARG C NH2 7878 N N . ASP C 330 ? 1.0391 1.0893 1.0683 0.1048 -0.0033 0.1191 416 ASP C N 7879 C CA . ASP C 330 ? 1.2623 1.3281 1.2998 0.1124 0.0006 0.1261 416 ASP C CA 7880 C C . ASP C 330 ? 1.1834 1.2530 1.2261 0.1099 0.0034 0.1257 416 ASP C C 7881 O O . ASP C 330 ? 1.0982 1.1790 1.1472 0.1165 0.0077 0.1312 416 ASP C O 7882 C CB . ASP C 330 ? 1.5031 1.5586 1.5337 0.1247 0.0076 0.1300 416 ASP C CB 7883 C CG . ASP C 330 ? 1.6913 1.7204 1.7089 0.1253 0.0127 0.1242 416 ASP C CG 7884 O OD1 . ASP C 330 ? 1.7371 1.7581 1.7522 0.1172 0.0110 0.1180 416 ASP C OD1 7885 O OD2 . ASP C 330 ? 1.7205 1.7370 1.7303 0.1339 0.0187 0.1259 416 ASP C OD2 7886 N N . CYS C 331 ? 1.0997 1.1598 1.1395 0.1010 0.0014 0.1194 417 CYS C N 7887 C CA . CYS C 331 ? 1.0551 1.1184 1.0993 0.0975 0.0036 0.1188 417 CYS C CA 7888 C C . CYS C 331 ? 0.9791 1.0397 1.0236 0.0858 -0.0016 0.1134 417 CYS C C 7889 O O . CYS C 331 ? 0.7706 0.8216 0.8092 0.0816 -0.0055 0.1091 417 CYS C O 7890 C CB . CYS C 331 ? 0.9979 1.0445 1.0334 0.1030 0.0106 0.1172 417 CYS C CB 7891 S SG . CYS C 331 ? 1.2997 1.3198 1.3201 0.1001 0.0104 0.1093 417 CYS C SG 7892 N N . GLN C 332 ? 0.9261 0.9948 0.9773 0.0808 -0.0013 0.1138 418 GLN C N 7893 C CA . GLN C 332 ? 0.6862 0.7527 0.7382 0.0699 -0.0055 0.1094 418 GLN C CA 7894 C C . GLN C 332 ? 0.7626 0.8102 0.8057 0.0683 -0.0030 0.1048 418 GLN C C 7895 O O . GLN C 332 ? 0.7722 0.8182 0.8151 0.0708 0.0017 0.1061 418 GLN C O 7896 C CB . GLN C 332 ? 0.7235 0.8086 0.7873 0.0641 -0.0064 0.1123 418 GLN C CB 7897 C CG . GLN C 332 ? 0.8550 0.9356 0.9190 0.0530 -0.0092 0.1079 418 GLN C CG 7898 C CD . GLN C 332 ? 0.8910 0.9661 0.9511 0.0469 -0.0150 0.1034 418 GLN C CD 7899 O OE1 . GLN C 332 ? 0.8373 0.9254 0.9023 0.0448 -0.0190 0.1046 418 GLN C OE1 7900 N NE2 . GLN C 332 ? 0.7534 0.8101 0.8047 0.0444 -0.0153 0.0984 418 GLN C NE2 7901 N N . GLU C 333 ? 0.8066 0.8408 0.8422 0.0642 -0.0062 0.0996 419 GLU C N 7902 C CA . GLU C 333 ? 0.7949 0.8125 0.8218 0.0632 -0.0043 0.0953 419 GLU C CA 7903 C C . GLU C 333 ? 0.7465 0.7647 0.7764 0.0563 -0.0046 0.0944 419 GLU C C 7904 O O . GLU C 333 ? 0.8582 0.8843 0.8944 0.0494 -0.0078 0.0944 419 GLU C O 7905 C CB . GLU C 333 ? 0.6982 0.7021 0.7162 0.0622 -0.0070 0.0904 419 GLU C CB 7906 C CG . GLU C 333 ? 0.9507 0.9401 0.9608 0.0595 -0.0065 0.0857 419 GLU C CG 7907 C CD . GLU C 333 ? 1.1793 1.1592 1.1817 0.0653 -0.0014 0.0850 419 GLU C CD 7908 O OE1 . GLU C 333 ? 1.2328 1.2179 1.2378 0.0700 0.0029 0.0885 419 GLU C OE1 7909 O OE2 . GLU C 333 ? 1.2090 1.1768 1.2029 0.0649 -0.0016 0.0806 419 GLU C OE2 7910 N N . LEU C 334 ? 0.7754 0.7848 0.8001 0.0581 -0.0008 0.0935 420 LEU C N 7911 C CA . LEU C 334 ? 0.7326 0.7409 0.7588 0.0529 0.0000 0.0934 420 LEU C CA 7912 C C . LEU C 334 ? 0.7490 0.7420 0.7656 0.0518 -0.0003 0.0891 420 LEU C C 7913 O O . LEU C 334 ? 0.8655 0.8497 0.8741 0.0565 0.0014 0.0871 420 LEU C O 7914 C CB . LEU C 334 ? 0.6457 0.6609 0.6756 0.0563 0.0053 0.0976 420 LEU C CB 7915 C CG . LEU C 334 ? 0.7467 0.7634 0.7797 0.0512 0.0070 0.0989 420 LEU C CG 7916 C CD1 . LEU C 334 ? 0.7180 0.7413 0.7582 0.0425 0.0032 0.0986 420 LEU C CD1 7917 C CD2 . LEU C 334 ? 0.7497 0.7756 0.7874 0.0551 0.0123 0.1036 420 LEU C CD2 7918 N N . CYS C 335 ? 0.7230 0.7130 0.7403 0.0455 -0.0022 0.0876 421 CYS C N 7919 C CA . CYS C 335 ? 0.6903 0.6674 0.6995 0.0446 -0.0028 0.0842 421 CYS C CA 7920 C C . CYS C 335 ? 0.6586 0.6338 0.6687 0.0411 -0.0009 0.0856 421 CYS C C 7921 O O . CYS C 335 ? 0.7763 0.7592 0.7936 0.0374 0.0002 0.0885 421 CYS C O 7922 C CB . CYS C 335 ? 0.6195 0.5915 0.6266 0.0410 -0.0074 0.0803 421 CYS C CB 7923 S SG . CYS C 335 ? 0.8613 0.8337 0.8662 0.0446 -0.0097 0.0786 421 CYS C SG 7924 N N . PHE C 336 ? 0.6108 0.5760 0.6135 0.0420 -0.0004 0.0838 422 PHE C N 7925 C CA . PHE C 336 ? 0.7404 0.7018 0.7430 0.0387 0.0011 0.0852 422 PHE C CA 7926 C C . PHE C 336 ? 0.7923 0.7433 0.7887 0.0376 -0.0009 0.0822 422 PHE C C 7927 O O . PHE C 336 ? 0.6631 0.6098 0.6538 0.0403 -0.0030 0.0789 422 PHE C O 7928 C CB . PHE C 336 ? 0.6720 0.6348 0.6731 0.0419 0.0059 0.0889 422 PHE C CB 7929 C CG . PHE C 336 ? 0.6654 0.6235 0.6579 0.0477 0.0072 0.0875 422 PHE C CG 7930 C CD1 . PHE C 336 ? 0.8182 0.7686 0.8034 0.0486 0.0069 0.0864 422 PHE C CD1 7931 C CD2 . PHE C 336 ? 0.6411 0.6029 0.6324 0.0524 0.0090 0.0876 422 PHE C CD2 7932 C CE1 . PHE C 336 ? 0.7498 0.6974 0.7267 0.0532 0.0078 0.0848 422 PHE C CE1 7933 C CE2 . PHE C 336 ? 0.7303 0.6871 0.7125 0.0568 0.0105 0.0857 422 PHE C CE2 7934 C CZ . PHE C 336 ? 0.6761 0.6266 0.6513 0.0568 0.0097 0.0841 422 PHE C CZ 7935 N N . TRP C 337 ? 0.7038 0.6507 0.7013 0.0335 -0.0001 0.0832 423 TRP C N 7936 C CA . TRP C 337 ? 0.6855 0.6226 0.6774 0.0334 -0.0010 0.0814 423 TRP C CA 7937 C C . TRP C 337 ? 0.6328 0.5658 0.6209 0.0357 0.0028 0.0848 423 TRP C C 7938 O O . TRP C 337 ? 0.6120 0.5479 0.6036 0.0343 0.0063 0.0885 423 TRP C O 7939 C CB . TRP C 337 ? 0.6528 0.5861 0.6477 0.0271 -0.0027 0.0796 423 TRP C CB 7940 C CG . TRP C 337 ? 0.6101 0.5462 0.6112 0.0214 -0.0001 0.0823 423 TRP C CG 7941 C CD1 . TRP C 337 ? 0.6283 0.5734 0.6367 0.0166 -0.0012 0.0823 423 TRP C CD1 7942 C CD2 . TRP C 337 ? 0.5660 0.4961 0.5662 0.0197 0.0041 0.0854 423 TRP C CD2 7943 N NE1 . TRP C 337 ? 0.6866 0.6323 0.6992 0.0112 0.0020 0.0847 423 TRP C NE1 7944 C CE2 . TRP C 337 ? 0.6137 0.5493 0.6211 0.0129 0.0056 0.0867 423 TRP C CE2 7945 C CE3 . TRP C 337 ? 0.5982 0.5194 0.5923 0.0233 0.0070 0.0875 423 TRP C CE3 7946 C CZ2 . TRP C 337 ? 0.6024 0.5334 0.6108 0.0091 0.0103 0.0897 423 TRP C CZ2 7947 C CZ3 . TRP C 337 ? 0.7356 0.6520 0.7303 0.0204 0.0117 0.0911 423 TRP C CZ3 7948 C CH2 . TRP C 337 ? 0.6598 0.5803 0.6614 0.0131 0.0135 0.0920 423 TRP C CH2 7949 N N . ILE C 338 ? 0.6295 0.5566 0.6106 0.0393 0.0023 0.0838 424 ILE C N 7950 C CA . ILE C 338 ? 0.6308 0.5539 0.6073 0.0423 0.0054 0.0873 424 ILE C CA 7951 C C . ILE C 338 ? 0.7166 0.6310 0.6901 0.0419 0.0050 0.0868 424 ILE C C 7952 O O . ILE C 338 ? 0.7817 0.6944 0.7518 0.0437 0.0020 0.0836 424 ILE C O 7953 C CB . ILE C 338 ? 0.7977 0.7233 0.7674 0.0482 0.0053 0.0869 424 ILE C CB 7954 C CG1 . ILE C 338 ? 0.8554 0.7882 0.8267 0.0495 0.0060 0.0865 424 ILE C CG1 7955 C CG2 . ILE C 338 ? 0.6886 0.6117 0.6532 0.0517 0.0084 0.0911 424 ILE C CG2 7956 C CD1 . ILE C 338 ? 0.7747 0.7091 0.7382 0.0544 0.0064 0.0854 424 ILE C CD1 7957 N N . GLU C 339 ? 0.7983 0.7069 0.7729 0.0396 0.0085 0.0902 425 GLU C N 7958 C CA . GLU C 339 ? 0.6979 0.5968 0.6685 0.0407 0.0094 0.0908 425 GLU C CA 7959 C C . GLU C 339 ? 0.7197 0.6181 0.6832 0.0480 0.0107 0.0940 425 GLU C C 7960 O O . GLU C 339 ? 0.7745 0.6760 0.7361 0.0507 0.0134 0.0978 425 GLU C O 7961 C CB . GLU C 339 ? 0.6874 0.5783 0.6608 0.0354 0.0134 0.0930 425 GLU C CB 7962 C CG . GLU C 339 ? 0.7803 0.6594 0.7502 0.0354 0.0144 0.0924 425 GLU C CG 7963 C CD . GLU C 339 ? 0.9540 0.8238 0.9264 0.0284 0.0185 0.0931 425 GLU C CD 7964 O OE1 . GLU C 339 ? 0.8399 0.7095 0.8142 0.0259 0.0226 0.0968 425 GLU C OE1 7965 O OE2 . GLU C 339 ? 0.9142 0.7768 0.8864 0.0250 0.0177 0.0896 425 GLU C OE2 7966 N N . ILE C 340 ? 0.6305 0.5259 0.5902 0.0510 0.0086 0.0922 426 ILE C N 7967 C CA . ILE C 340 ? 0.5423 0.4402 0.4957 0.0579 0.0082 0.0940 426 ILE C CA 7968 C C . ILE C 340 ? 0.7188 0.6078 0.6692 0.0608 0.0109 0.0974 426 ILE C C 7969 O O . ILE C 340 ? 0.7804 0.6620 0.7325 0.0582 0.0108 0.0953 426 ILE C O 7970 C CB . ILE C 340 ? 0.6049 0.5084 0.5570 0.0588 0.0031 0.0885 426 ILE C CB 7971 C CG1 . ILE C 340 ? 0.6211 0.5321 0.5744 0.0572 0.0013 0.0856 426 ILE C CG1 7972 C CG2 . ILE C 340 ? 0.7630 0.6698 0.7093 0.0648 0.0020 0.0894 426 ILE C CG2 7973 C CD1 . ILE C 340 ? 0.8516 0.7664 0.8036 0.0591 0.0044 0.0895 426 ILE C CD1 7974 N N . ALA C 341 ? 0.8347 0.7238 0.7801 0.0666 0.0137 0.1029 427 ALA C N 7975 C CA . ALA C 341 ? 0.7841 0.6657 0.7260 0.0712 0.0161 0.1064 427 ALA C CA 7976 C C . ALA C 341 ? 0.8265 0.7143 0.7662 0.0751 0.0117 0.1032 427 ALA C C 7977 O O . ALA C 341 ? 1.0245 0.9233 0.9619 0.0776 0.0084 0.1019 427 ALA C O 7978 C CB . ALA C 341 ? 0.6327 0.5135 0.5697 0.0768 0.0204 0.1137 427 ALA C CB 7979 N N . ALA C 342 ? 0.7680 0.6487 0.7084 0.0752 0.0117 0.1018 428 ALA C N 7980 C CA . ALA C 342 ? 0.6363 0.5231 0.5755 0.0786 0.0079 0.0988 428 ALA C CA 7981 C C . ALA C 342 ? 0.7077 0.5867 0.6447 0.0838 0.0108 0.1020 428 ALA C C 7982 O O . ALA C 342 ? 0.8234 0.6908 0.7592 0.0849 0.0162 0.1066 428 ALA C O 7983 C CB . ALA C 342 ? 0.7136 0.6023 0.6568 0.0725 0.0036 0.0913 428 ALA C CB 7984 N N . THR C 343 ? 0.7347 0.6198 0.6713 0.0870 0.0076 0.0995 429 THR C N 7985 C CA . THR C 343 ? 0.7700 0.6499 0.7045 0.0934 0.0104 0.1030 429 THR C CA 7986 C C . THR C 343 ? 0.7567 0.6364 0.6936 0.0915 0.0077 0.0972 429 THR C C 7987 O O . THR C 343 ? 0.8354 0.7250 0.7741 0.0884 0.0026 0.0918 429 THR C O 7988 C CB . THR C 343 ? 0.7530 0.6451 0.6835 0.1024 0.0096 0.1081 429 THR C CB 7989 O OG1 . THR C 343 ? 0.9792 0.8740 0.9070 0.1033 0.0111 0.1125 429 THR C OG1 7990 C CG2 . THR C 343 ? 0.7224 0.6084 0.6504 0.1105 0.0138 0.1138 429 THR C CG2 7991 N N . THR C 344 ? 0.8270 0.6946 0.7635 0.0933 0.0116 0.0983 430 THR C N 7992 C CA . THR C 344 ? 0.8750 0.7418 0.8133 0.0919 0.0097 0.0931 430 THR C CA 7993 C C . THR C 344 ? 0.8645 0.7432 0.8017 0.1000 0.0079 0.0949 430 THR C C 7994 O O . THR C 344 ? 1.0026 0.8883 0.9372 0.1071 0.0088 0.1008 430 THR C O 7995 C CB . THR C 344 ? 0.8517 0.7002 0.7895 0.0899 0.0148 0.0925 430 THR C CB 7996 O OG1 . THR C 344 ? 0.9436 0.7843 0.8777 0.0983 0.0207 0.0994 430 THR C OG1 7997 C CG2 . THR C 344 ? 0.7471 0.5854 0.6863 0.0810 0.0165 0.0906 430 THR C CG2 7998 N N . LYS C 345 ? 0.8722 0.7543 0.8114 0.0989 0.0053 0.0899 431 LYS C N 7999 C CA . LYS C 345 ? 0.9461 0.8418 0.8852 0.1058 0.0033 0.0910 431 LYS C CA 8000 C C . LYS C 345 ? 0.8612 0.7520 0.7977 0.1159 0.0087 0.0987 431 LYS C C 8001 O O . LYS C 345 ? 0.9285 0.8326 0.8639 0.1237 0.0078 0.1033 431 LYS C O 8002 C CB . LYS C 345 ? 0.9521 0.8505 0.8939 0.1023 0.0004 0.0843 431 LYS C CB 8003 C CG . LYS C 345 ? 1.0281 0.9448 0.9708 0.1072 -0.0030 0.0842 431 LYS C CG 8004 C CD . LYS C 345 ? 1.1121 1.0285 1.0570 0.1068 -0.0032 0.0799 431 LYS C CD 8005 C CE . LYS C 345 ? 1.1885 1.1167 1.1338 0.1164 -0.0024 0.0843 431 LYS C CE 8006 N NZ . LYS C 345 ? 1.1801 1.1160 1.1283 0.1152 -0.0045 0.0793 431 LYS C NZ 8007 N N . ALA C 346 ? 0.7356 0.6071 0.6707 0.1154 0.0146 0.1002 432 ALA C N 8008 C CA . ALA C 346 ? 0.8126 0.6746 0.7443 0.1247 0.0213 0.1076 432 ALA C CA 8009 C C . ALA C 346 ? 1.0212 0.8847 0.9497 0.1301 0.0237 0.1156 432 ALA C C 8010 O O . ALA C 346 ? 1.2113 1.0737 1.1367 0.1402 0.0279 0.1232 432 ALA C O 8011 C CB . ALA C 346 ? 0.7253 0.5644 0.6557 0.1210 0.0273 0.1060 432 ALA C CB 8012 N N . GLY C 347 ? 1.0837 0.9493 1.0125 0.1236 0.0213 0.1142 433 GLY C N 8013 C CA . GLY C 347 ? 1.0155 0.8823 0.9409 0.1277 0.0236 0.1213 433 GLY C CA 8014 C C . GLY C 347 ? 0.8958 0.7450 0.8198 0.1221 0.0286 0.1226 433 GLY C C 8015 O O . GLY C 347 ? 0.8553 0.7051 0.7767 0.1241 0.0306 0.1280 433 GLY C O 8016 N N . LEU C 348 ? 0.9077 0.7421 0.8335 0.1147 0.0308 0.1176 438 LEU C N 8017 C CA . LEU C 348 ? 0.9936 0.8132 0.9189 0.1075 0.0350 0.1177 438 LEU C CA 8018 C C . LEU C 348 ? 0.9701 0.8004 0.8982 0.1010 0.0304 0.1152 438 LEU C C 8019 O O . LEU C 348 ? 0.8567 0.7002 0.7880 0.0976 0.0238 0.1097 438 LEU C O 8020 C CB . LEU C 348 ? 1.0141 0.8184 0.9408 0.0996 0.0372 0.1117 438 LEU C CB 8021 C CG . LEU C 348 ? 1.1058 0.8894 1.0280 0.1031 0.0459 0.1154 438 LEU C CG 8022 C CD1 . LEU C 348 ? 1.2643 1.0501 1.1847 0.1133 0.0469 0.1176 438 LEU C CD1 8023 C CD2 . LEU C 348 ? 1.0554 0.8232 0.9782 0.0925 0.0485 0.1091 438 LEU C CD2 8024 N N . SER C 349 ? 0.9396 0.7640 0.8661 0.0994 0.0342 0.1195 439 SER C N 8025 C CA . SER C 349 ? 0.9716 0.8049 0.9009 0.0931 0.0306 0.1172 439 SER C CA 8026 C C . SER C 349 ? 0.7741 0.5998 0.7078 0.0820 0.0303 0.1108 439 SER C C 8027 O O . SER C 349 ? 0.7889 0.5992 0.7220 0.0787 0.0348 0.1100 439 SER C O 8028 C CB . SER C 349 ? 0.9073 0.7399 0.8334 0.0961 0.0346 0.1245 439 SER C CB 8029 O OG . SER C 349 ? 0.9321 0.7481 0.8579 0.0913 0.0412 0.1264 439 SER C OG 8030 N N . SER C 350 ? 0.6834 0.5201 0.6211 0.0764 0.0250 0.1062 440 SER C N 8031 C CA . SER C 350 ? 0.7467 0.5800 0.6891 0.0662 0.0236 0.1003 440 SER C CA 8032 C C . SER C 350 ? 0.7024 0.5487 0.6484 0.0625 0.0193 0.0981 440 SER C C 8033 O O . SER C 350 ? 0.7720 0.6280 0.7163 0.0671 0.0179 0.1008 440 SER C O 8034 C CB . SER C 350 ? 0.8506 0.6822 0.7943 0.0641 0.0206 0.0941 440 SER C CB 8035 O OG . SER C 350 ? 0.9668 0.7951 0.9144 0.0544 0.0194 0.0887 440 SER C OG 8036 N N . ASN C 351 ? 0.7188 0.5654 0.6695 0.0542 0.0173 0.0931 441 ASN C N 8037 C CA . ASN C 351 ? 0.7100 0.5685 0.6642 0.0513 0.0133 0.0909 441 ASN C CA 8038 C C . ASN C 351 ? 0.8106 0.6754 0.7673 0.0485 0.0077 0.0845 441 ASN C C 8039 O O . ASN C 351 ? 0.9521 0.8109 0.9093 0.0458 0.0071 0.0810 441 ASN C O 8040 C CB . ASN C 351 ? 0.7403 0.5961 0.6987 0.0439 0.0158 0.0914 441 ASN C CB 8041 C CG . ASN C 351 ? 0.8277 0.6746 0.7838 0.0449 0.0224 0.0974 441 ASN C CG 8042 O OD1 . ASN C 351 ? 0.8773 0.7291 0.8328 0.0472 0.0241 0.1016 441 ASN C OD1 8043 N ND2 . ASN C 351 ? 0.8646 0.6974 0.8186 0.0431 0.0267 0.0979 441 ASN C ND2 8044 N N . ASP C 352 ? 0.7597 0.6359 0.7174 0.0493 0.0041 0.0830 442 ASP C N 8045 C CA . ASP C 352 ? 0.9502 0.8312 0.9120 0.0440 0.0003 0.0780 442 ASP C CA 8046 C C . ASP C 352 ? 0.7803 0.6705 0.7445 0.0432 -0.0009 0.0782 442 ASP C C 8047 O O . ASP C 352 ? 0.6945 0.5859 0.6589 0.0440 0.0021 0.0823 442 ASP C O 8048 C CB . ASP C 352 ? 1.1561 1.0389 1.1170 0.0444 -0.0038 0.0730 442 ASP C CB 8049 C CG . ASP C 352 ? 1.1161 1.0052 1.0731 0.0504 -0.0055 0.0732 442 ASP C CG 8050 O OD1 . ASP C 352 ? 1.2724 1.1649 1.2270 0.0544 -0.0038 0.0771 442 ASP C OD1 8051 O OD2 . ASP C 352 ? 0.8036 0.6948 0.7597 0.0508 -0.0085 0.0693 442 ASP C OD2 8052 N N . LEU C 353 ? 0.8648 0.7608 0.8302 0.0419 -0.0048 0.0740 443 LEU C N 8053 C CA . LEU C 353 ? 0.7071 0.6097 0.6764 0.0393 -0.0056 0.0735 443 LEU C CA 8054 C C . LEU C 353 ? 0.7568 0.6659 0.7239 0.0422 -0.0082 0.0711 443 LEU C C 8055 O O . LEU C 353 ? 0.8086 0.7174 0.7733 0.0429 -0.0109 0.0674 443 LEU C O 8056 C CB . LEU C 353 ? 0.7469 0.6483 0.7209 0.0331 -0.0072 0.0708 443 LEU C CB 8057 C CG . LEU C 353 ? 0.8844 0.7874 0.8640 0.0280 -0.0052 0.0728 443 LEU C CG 8058 C CD1 . LEU C 353 ? 0.7601 0.6695 0.7440 0.0242 -0.0086 0.0698 443 LEU C CD1 8059 C CD2 . LEU C 353 ? 0.8687 0.7763 0.8489 0.0306 -0.0023 0.0771 443 LEU C CD2 8060 N N . ILE C 354 ? 0.7203 0.6349 0.6879 0.0435 -0.0068 0.0729 444 ILE C N 8061 C CA . ILE C 354 ? 0.7051 0.6248 0.6712 0.0451 -0.0084 0.0703 444 ILE C CA 8062 C C . ILE C 354 ? 0.7625 0.6864 0.7343 0.0428 -0.0077 0.0715 444 ILE C C 8063 O O . ILE C 354 ? 0.6390 0.5641 0.6146 0.0413 -0.0051 0.0751 444 ILE C O 8064 C CB . ILE C 354 ? 0.7963 0.7189 0.7570 0.0495 -0.0067 0.0716 444 ILE C CB 8065 C CG1 . ILE C 354 ? 0.9667 0.8872 0.9231 0.0522 -0.0064 0.0731 444 ILE C CG1 8066 C CG2 . ILE C 354 ? 0.6920 0.6172 0.6489 0.0509 -0.0082 0.0676 444 ILE C CG2 8067 C CD1 . ILE C 354 ? 1.1988 1.1234 1.1487 0.0557 -0.0068 0.0717 444 ILE C CD1 8068 N N . THR C 355 ? 0.6654 0.5919 0.6379 0.0425 -0.0096 0.0687 445 THR C N 8069 C CA . THR C 355 ? 0.6209 0.5531 0.5989 0.0414 -0.0090 0.0702 445 THR C CA 8070 C C . THR C 355 ? 0.7120 0.6467 0.6869 0.0454 -0.0080 0.0693 445 THR C C 8071 O O . THR C 355 ? 0.7459 0.6773 0.7148 0.0472 -0.0090 0.0661 445 THR C O 8072 C CB . THR C 355 ? 0.6182 0.5515 0.6011 0.0371 -0.0118 0.0686 445 THR C CB 8073 O OG1 . THR C 355 ? 0.7220 0.6517 0.7010 0.0374 -0.0147 0.0646 445 THR C OG1 8074 C CG2 . THR C 355 ? 0.6907 0.6209 0.6766 0.0324 -0.0118 0.0694 445 THR C CG2 8075 N N . PHE C 356 ? 0.6598 0.6001 0.6386 0.0466 -0.0058 0.0721 446 PHE C N 8076 C CA . PHE C 356 ? 0.5869 0.5284 0.5624 0.0508 -0.0037 0.0716 446 PHE C CA 8077 C C . PHE C 356 ? 0.6193 0.5673 0.6014 0.0511 -0.0033 0.0738 446 PHE C C 8078 O O . PHE C 356 ? 0.7061 0.6602 0.6954 0.0486 -0.0032 0.0769 446 PHE C O 8079 C CB . PHE C 356 ? 0.6219 0.5642 0.5942 0.0539 0.0003 0.0740 446 PHE C CB 8080 C CG . PHE C 356 ? 0.5983 0.5359 0.5626 0.0550 0.0001 0.0719 446 PHE C CG 8081 C CD1 . PHE C 356 ? 0.5893 0.5255 0.5533 0.0536 -0.0003 0.0735 446 PHE C CD1 8082 C CD2 . PHE C 356 ? 0.6220 0.5568 0.5786 0.0573 0.0008 0.0684 446 PHE C CD2 8083 C CE1 . PHE C 356 ? 0.6241 0.5579 0.5809 0.0553 -0.0007 0.0721 446 PHE C CE1 8084 C CE2 . PHE C 356 ? 0.7411 0.6737 0.6904 0.0579 0.0003 0.0663 446 PHE C CE2 8085 C CZ . PHE C 356 ? 0.6544 0.5875 0.6040 0.0572 -0.0006 0.0684 446 PHE C CZ 8086 N N . CYS C 357 ? 0.7678 0.7150 0.7475 0.0541 -0.0029 0.0724 447 CYS C N 8087 C CA . CYS C 357 ? 0.6828 0.6373 0.6684 0.0562 -0.0019 0.0753 447 CYS C CA 8088 C C . CYS C 357 ? 0.6461 0.5988 0.6271 0.0620 0.0026 0.0759 447 CYS C C 8089 O O . CYS C 357 ? 0.9127 0.8574 0.8851 0.0634 0.0040 0.0726 447 CYS C O 8090 C CB . CYS C 357 ? 0.6669 0.6216 0.6539 0.0548 -0.0055 0.0738 447 CYS C CB 8091 S SG . CYS C 357 ? 1.0232 0.9804 1.0157 0.0475 -0.0104 0.0730 447 CYS C SG 8092 N N . GLY C 358 ? 0.5851 0.5455 0.5716 0.0652 0.0052 0.0799 448 GLY C N 8093 C CA . GLY C 358 ? 0.7209 0.6791 0.7030 0.0711 0.0106 0.0807 448 GLY C CA 8094 C C . GLY C 358 ? 0.9544 0.9056 0.9306 0.0750 0.0119 0.0786 448 GLY C C 8095 O O . GLY C 358 ? 1.1054 1.0581 1.0843 0.0746 0.0091 0.0788 448 GLY C O 8096 N N . THR C 359 ? 0.9776 0.9205 0.9450 0.0783 0.0164 0.0764 449 THR C N 8097 C CA . THR C 359 ? 0.9072 0.8416 0.8677 0.0825 0.0197 0.0746 449 THR C CA 8098 C C . THR C 359 ? 0.9285 0.8649 0.8894 0.0891 0.0262 0.0782 449 THR C C 8099 O O . THR C 359 ? 0.9565 0.8962 0.9177 0.0898 0.0289 0.0795 449 THR C O 8100 C CB . THR C 359 ? 1.0963 1.0185 1.0449 0.0807 0.0208 0.0685 449 THR C CB 8101 O OG1 . THR C 359 ? 1.2215 1.1427 1.1698 0.0749 0.0152 0.0653 449 THR C OG1 8102 C CG2 . THR C 359 ? 1.1894 1.1007 1.1300 0.0841 0.0249 0.0661 449 THR C CG2 8103 N N . GLY C 360 ? 0.9480 0.8818 0.9080 0.0944 0.0292 0.0799 450 GLY C N 8104 C CA . GLY C 360 ? 0.9389 0.8729 0.8981 0.1017 0.0363 0.0832 450 GLY C CA 8105 C C . GLY C 360 ? 0.8755 0.7966 0.8224 0.1032 0.0422 0.0788 450 GLY C C 8106 O O . GLY C 360 ? 0.9827 0.9040 0.9284 0.1085 0.0485 0.0811 450 GLY C O 8107 N N . GLY C 361 ? 0.7787 0.6890 0.7163 0.0983 0.0405 0.0725 451 GLY C N 8108 C CA . GLY C 361 ? 0.7578 0.6561 0.6827 0.0984 0.0457 0.0674 451 GLY C CA 8109 C C . GLY C 361 ? 0.9662 0.8667 0.8880 0.0935 0.0437 0.0645 451 GLY C C 8110 O O . GLY C 361 ? 1.1076 1.0145 1.0343 0.0886 0.0373 0.0644 451 GLY C O 8111 N N . SER C 362 ? 0.9071 0.8020 0.8201 0.0950 0.0493 0.0621 452 SER C N 8112 C CA . SER C 362 ? 0.9290 0.8265 0.8378 0.0910 0.0477 0.0596 452 SER C CA 8113 C C . SER C 362 ? 0.9159 0.8087 0.8182 0.0845 0.0429 0.0535 452 SER C C 8114 O O . SER C 362 ? 1.0532 0.9367 0.9496 0.0831 0.0436 0.0493 452 SER C O 8115 C CB . SER C 362 ? 0.8842 0.7765 0.7837 0.0940 0.0552 0.0581 452 SER C CB 8116 O OG . SER C 362 ? 1.1179 0.9965 1.0042 0.0926 0.0587 0.0513 452 SER C OG 8117 N N . MET C 363 ? 0.7459 0.6456 0.6498 0.0807 0.0383 0.0534 453 MET C N 8118 C CA . MET C 363 ? 0.7021 0.6000 0.6010 0.0750 0.0335 0.0483 453 MET C CA 8119 C C . MET C 363 ? 0.7874 0.6842 0.6755 0.0728 0.0352 0.0441 453 MET C C 8120 O O . MET C 363 ? 0.7788 0.6777 0.6645 0.0755 0.0391 0.0460 453 MET C O 8121 C CB . MET C 363 ? 0.7438 0.6505 0.6522 0.0724 0.0267 0.0513 453 MET C CB 8122 C CG . MET C 363 ? 0.7287 0.6380 0.6476 0.0730 0.0239 0.0549 453 MET C CG 8123 S SD . MET C 363 ? 1.0600 0.9603 0.9758 0.0721 0.0234 0.0510 453 MET C SD 8124 C CE . MET C 363 ? 0.9879 0.8843 0.8945 0.0663 0.0205 0.0440 453 MET C CE 8125 N N . PRO C 364 ? 0.8794 0.7739 0.7608 0.0679 0.0322 0.0384 454 PRO C N 8126 C CA . PRO C 364 ? 0.8690 0.7661 0.7412 0.0650 0.0321 0.0346 454 PRO C CA 8127 C C . PRO C 364 ? 0.8676 0.7758 0.7453 0.0650 0.0275 0.0390 454 PRO C C 8128 O O . PRO C 364 ? 0.8248 0.7374 0.7131 0.0659 0.0240 0.0437 454 PRO C O 8129 C CB . PRO C 364 ? 0.7475 0.6408 0.6136 0.0595 0.0294 0.0278 454 PRO C CB 8130 C CG . PRO C 364 ? 0.7362 0.6289 0.6115 0.0593 0.0256 0.0299 454 PRO C CG 8131 C CD . PRO C 364 ? 0.6181 0.5078 0.4997 0.0646 0.0293 0.0349 454 PRO C CD 8132 N N . ASP C 365 ? 0.8175 0.7299 0.6877 0.0641 0.0279 0.0375 455 ASP C N 8133 C CA . ASP C 365 ? 0.8881 0.8104 0.7616 0.0642 0.0238 0.0414 455 ASP C CA 8134 C C . ASP C 365 ? 0.9012 0.8269 0.7755 0.0604 0.0178 0.0388 455 ASP C C 8135 O O . ASP C 365 ? 0.8730 0.7994 0.7387 0.0569 0.0169 0.0330 455 ASP C O 8136 C CB . ASP C 365 ? 0.8610 0.7873 0.7251 0.0649 0.0263 0.0410 455 ASP C CB 8137 C CG . ASP C 365 ? 0.9840 0.9081 0.8482 0.0691 0.0324 0.0445 455 ASP C CG 8138 O OD1 . ASP C 365 ? 1.0065 0.9316 0.8811 0.0720 0.0329 0.0503 455 ASP C OD1 8139 O OD2 . ASP C 365 ? 1.1145 1.0365 0.9684 0.0693 0.0368 0.0415 455 ASP C OD2 8140 N N . VAL C 366 ? 0.8917 0.8198 0.7763 0.0610 0.0140 0.0428 456 VAL C N 8141 C CA . VAL C 366 ? 0.8551 0.7863 0.7421 0.0582 0.0085 0.0412 456 VAL C CA 8142 C C . VAL C 366 ? 0.7322 0.6691 0.6272 0.0600 0.0053 0.0472 456 VAL C C 8143 O O . VAL C 366 ? 0.7713 0.7074 0.6730 0.0622 0.0067 0.0523 456 VAL C O 8144 C CB . VAL C 366 ? 0.7491 0.6736 0.6391 0.0559 0.0076 0.0379 456 VAL C CB 8145 C CG1 . VAL C 366 ? 0.7175 0.6358 0.6116 0.0584 0.0113 0.0401 456 VAL C CG1 8146 C CG2 . VAL C 366 ? 0.7631 0.6905 0.6607 0.0548 0.0025 0.0395 456 VAL C CG2 8147 N N . ASN C 367 ? 0.7204 0.6630 0.6143 0.0590 0.0014 0.0467 457 ASN C N 8148 C CA . ASN C 367 ? 0.7538 0.6997 0.6546 0.0609 -0.0010 0.0522 457 ASN C CA 8149 C C . ASN C 367 ? 0.7533 0.6960 0.6613 0.0592 -0.0040 0.0517 457 ASN C C 8150 O O . ASN C 367 ? 0.8110 0.7537 0.7172 0.0566 -0.0064 0.0470 457 ASN C O 8151 C CB . ASN C 367 ? 0.8328 0.7869 0.7290 0.0623 -0.0030 0.0536 457 ASN C CB 8152 C CG . ASN C 367 ? 1.0631 1.0186 0.9653 0.0654 -0.0037 0.0604 457 ASN C CG 8153 O OD1 . ASN C 367 ? 1.1799 1.1333 1.0848 0.0674 -0.0008 0.0653 457 ASN C OD1 8154 N ND2 . ASN C 367 ? 1.0941 1.0525 0.9983 0.0657 -0.0071 0.0609 457 ASN C ND2 8155 N N . TRP C 368 ? 0.7538 0.6943 0.6698 0.0603 -0.0038 0.0564 458 TRP C N 8156 C CA . TRP C 368 ? 0.6560 0.5932 0.5786 0.0584 -0.0064 0.0558 458 TRP C CA 8157 C C . TRP C 368 ? 0.7345 0.6734 0.6601 0.0594 -0.0085 0.0590 458 TRP C C 8158 O O . TRP C 368 ? 0.8074 0.7434 0.7380 0.0579 -0.0105 0.0586 458 TRP C O 8159 C CB . TRP C 368 ? 0.5867 0.5200 0.5161 0.0580 -0.0048 0.0581 458 TRP C CB 8160 C CG . TRP C 368 ? 0.7484 0.6790 0.6755 0.0578 -0.0026 0.0553 458 TRP C CG 8161 C CD1 . TRP C 368 ? 0.8132 0.7437 0.7402 0.0598 0.0013 0.0573 458 TRP C CD1 8162 C CD2 . TRP C 368 ? 0.8591 0.7860 0.7834 0.0558 -0.0035 0.0501 458 TRP C CD2 8163 N NE1 . TRP C 368 ? 0.8378 0.7642 0.7619 0.0597 0.0030 0.0539 458 TRP C NE1 8164 C CE2 . TRP C 368 ? 0.9244 0.8481 0.8466 0.0571 0.0002 0.0494 458 TRP C CE2 8165 C CE3 . TRP C 368 ? 0.8682 0.7940 0.7913 0.0533 -0.0066 0.0462 458 TRP C CE3 8166 C CZ2 . TRP C 368 ? 0.8733 0.7915 0.7918 0.0559 0.0011 0.0451 458 TRP C CZ2 8167 C CZ3 . TRP C 368 ? 0.8850 0.8060 0.8048 0.0515 -0.0060 0.0417 458 TRP C CZ3 8168 C CH2 . TRP C 368 ? 0.7673 0.6840 0.6845 0.0529 -0.0020 0.0413 458 TRP C CH2 8169 N N . GLY C 369 ? 0.7020 0.6453 0.6243 0.0623 -0.0077 0.0624 459 GLY C N 8170 C CA . GLY C 369 ? 0.7431 0.6869 0.6679 0.0643 -0.0087 0.0664 459 GLY C CA 8171 C C . GLY C 369 ? 0.8669 0.8132 0.7892 0.0680 -0.0062 0.0722 459 GLY C C 8172 O O . GLY C 369 ? 0.8824 0.8332 0.7988 0.0693 -0.0048 0.0721 459 GLY C O 8173 O OXT . GLY C 369 ? 0.9388 0.8822 0.8643 0.0697 -0.0051 0.0770 459 GLY C OXT 8174 N N . ALA D 6 ? 1.4498 1.5563 1.3910 -0.1211 -0.1065 -0.0008 82 ALA D N 8175 C CA . ALA D 6 ? 1.6031 1.6950 1.5342 -0.1341 -0.1043 -0.0115 82 ALA D CA 8176 C C . ALA D 6 ? 1.7271 1.8303 1.6629 -0.1484 -0.1050 -0.0159 82 ALA D C 8177 O O . ALA D 6 ? 1.9192 2.0139 1.8623 -0.1497 -0.1005 -0.0158 82 ALA D O 8178 C CB . ALA D 6 ? 1.2692 1.3651 1.1885 -0.1368 -0.1080 -0.0147 82 ALA D CB 8179 N N . THR D 7 ? 1.4991 1.6215 1.4310 -0.1587 -0.1103 -0.0194 83 THR D N 8180 C CA . THR D 7 ? 1.3687 1.5112 1.3054 -0.1731 -0.1131 -0.0228 83 THR D CA 8181 C C . THR D 7 ? 1.3330 1.4573 1.2650 -0.1882 -0.1077 -0.0332 83 THR D C 8182 O O . THR D 7 ? 1.4114 1.5094 1.3428 -0.1856 -0.1007 -0.0349 83 THR D O 8183 C CB . THR D 7 ? 1.6294 1.7966 1.5819 -0.1686 -0.1157 -0.0140 83 THR D CB 8184 O OG1 . THR D 7 ? 1.6899 1.8414 1.6495 -0.1669 -0.1095 -0.0132 83 THR D OG1 8185 C CG2 . THR D 7 ? 1.6075 1.7886 1.5640 -0.1522 -0.1196 -0.0034 83 THR D CG2 8186 N N . PRO D 8 ? 1.3201 1.4582 1.2479 -0.2041 -0.1108 -0.0401 84 PRO D N 8187 C CA . PRO D 8 ? 1.2920 1.4107 1.2123 -0.2194 -0.1053 -0.0511 84 PRO D CA 8188 C C . PRO D 8 ? 1.3027 1.4145 1.2319 -0.2242 -0.1000 -0.0512 84 PRO D C 8189 O O . PRO D 8 ? 1.2930 1.4268 1.2351 -0.2228 -0.1029 -0.0449 84 PRO D O 8190 C CB . PRO D 8 ? 1.1113 1.2527 1.0263 -0.2350 -0.1111 -0.0574 84 PRO D CB 8191 C CG . PRO D 8 ? 1.0936 1.2623 1.0106 -0.2261 -0.1195 -0.0499 84 PRO D CG 8192 C CD . PRO D 8 ? 1.2816 1.4542 1.2110 -0.2087 -0.1194 -0.0381 84 PRO D CD 8193 N N . LEU D 9 ? 1.3004 1.3828 1.2231 -0.2291 -0.0923 -0.0577 85 LEU D N 8194 C CA . LEU D 9 ? 1.2300 1.3026 1.1590 -0.2351 -0.0863 -0.0588 85 LEU D CA 8195 C C . LEU D 9 ? 1.2913 1.3817 1.2214 -0.2543 -0.0882 -0.0651 85 LEU D C 8196 O O . LEU D 9 ? 1.3588 1.4507 1.2783 -0.2668 -0.0898 -0.0736 85 LEU D O 8197 C CB . LEU D 9 ? 1.2405 1.2745 1.1605 -0.2346 -0.0767 -0.0641 85 LEU D CB 8198 C CG . LEU D 9 ? 1.1552 1.1732 1.0813 -0.2353 -0.0693 -0.0629 85 LEU D CG 8199 C CD1 . LEU D 9 ? 1.1411 1.1278 1.0625 -0.2228 -0.0624 -0.0614 85 LEU D CD1 8200 C CD2 . LEU D 9 ? 1.1717 1.1824 1.0929 -0.2547 -0.0647 -0.0722 85 LEU D CD2 8201 N N . VAL D 10 ? 1.2896 1.3936 1.2322 -0.2570 -0.0879 -0.0610 86 VAL D N 8202 C CA . VAL D 10 ? 1.2469 1.3740 1.1937 -0.2745 -0.0906 -0.0653 86 VAL D CA 8203 C C . VAL D 10 ? 1.1807 1.3006 1.1365 -0.2785 -0.0843 -0.0639 86 VAL D C 8204 O O . VAL D 10 ? 1.0597 1.1786 1.0253 -0.2651 -0.0828 -0.0551 86 VAL D O 8205 C CB . VAL D 10 ? 0.9998 1.1687 0.9557 -0.2713 -0.1011 -0.0586 86 VAL D CB 8206 C CG1 . VAL D 10 ? 1.2134 1.3888 1.1797 -0.2504 -0.1029 -0.0461 86 VAL D CG1 8207 C CG2 . VAL D 10 ? 0.9081 1.1054 0.8728 -0.2868 -0.1039 -0.0604 86 VAL D CG2 8208 N N . LEU D 11 ? 1.2719 1.3856 1.2238 -0.2972 -0.0800 -0.0728 87 LEU D N 8209 C CA . LEU D 11 ? 1.1852 1.2862 1.1430 -0.3023 -0.0724 -0.0726 87 LEU D CA 8210 C C . LEU D 11 ? 1.0474 1.1818 1.0186 -0.3126 -0.0762 -0.0704 87 LEU D C 8211 O O . LEU D 11 ? 1.0541 1.2228 1.0301 -0.3162 -0.0850 -0.0692 87 LEU D O 8212 C CB . LEU D 11 ? 1.1588 1.2260 1.1029 -0.3158 -0.0631 -0.0837 87 LEU D CB 8213 C CG . LEU D 11 ? 1.0735 1.1074 1.0038 -0.3066 -0.0587 -0.0866 87 LEU D CG 8214 C CD1 . LEU D 11 ? 0.9452 0.9487 0.8607 -0.3214 -0.0500 -0.0984 87 LEU D CD1 8215 C CD2 . LEU D 11 ? 1.0482 1.0641 0.9835 -0.2873 -0.0545 -0.0776 87 LEU D CD2 8216 N N . GLY D 12 ? 0.9315 1.0564 0.9088 -0.3169 -0.0693 -0.0695 88 GLY D N 8217 C CA . GLY D 12 ? 0.9317 1.0857 0.9214 -0.3284 -0.0715 -0.0683 88 GLY D CA 8218 C C . GLY D 12 ? 1.1144 1.2708 1.0969 -0.3529 -0.0701 -0.0803 88 GLY D C 8219 O O . GLY D 12 ? 1.1109 1.2349 1.0795 -0.3615 -0.0627 -0.0893 88 GLY D O 8220 N N . GLU D 13 ? 1.2265 1.4215 1.2181 -0.3641 -0.0769 -0.0805 89 GLU D N 8221 C CA . GLU D 13 ? 1.2268 1.4287 1.2126 -0.3891 -0.0762 -0.0920 89 GLU D CA 8222 C C . GLU D 13 ? 1.2498 1.4385 1.2394 -0.4019 -0.0669 -0.0949 89 GLU D C 8223 O O . GLU D 13 ? 1.3644 1.5449 1.3462 -0.4230 -0.0625 -0.1058 89 GLU D O 8224 C CB . GLU D 13 ? 1.1955 1.4465 1.1898 -0.3965 -0.0875 -0.0910 89 GLU D CB 8225 C CG . GLU D 13 ? 1.1594 1.4212 1.1457 -0.3901 -0.0958 -0.0915 89 GLU D CG 8226 C CD . GLU D 13 ? 1.2603 1.4923 1.2266 -0.4010 -0.0917 -0.1040 89 GLU D CD 8227 O OE1 . GLU D 13 ? 1.2922 1.5167 1.2520 -0.4225 -0.0870 -0.1148 89 GLU D OE1 8228 O OE2 . GLU D 13 ? 1.3035 1.5186 1.2603 -0.3883 -0.0926 -0.1030 89 GLU D OE2 8229 N N . ASN D 14 ? 1.1232 1.3092 1.1244 -0.3891 -0.0635 -0.0852 90 ASN D N 8230 C CA . ASN D 14 ? 1.0890 1.2639 1.0950 -0.3992 -0.0547 -0.0862 90 ASN D CA 8231 C C . ASN D 14 ? 1.0808 1.2162 1.0833 -0.3851 -0.0451 -0.0817 90 ASN D C 8232 O O . ASN D 14 ? 1.0145 1.1483 1.0217 -0.3641 -0.0473 -0.0722 90 ASN D O 8233 C CB . ASN D 14 ? 1.1163 1.3324 1.1414 -0.4008 -0.0597 -0.0789 90 ASN D CB 8234 C CG . ASN D 14 ? 1.2937 1.5519 1.3230 -0.4146 -0.0695 -0.0829 90 ASN D CG 8235 O OD1 . ASN D 14 ? 1.3726 1.6682 1.4145 -0.4056 -0.0785 -0.0747 90 ASN D OD1 8236 N ND2 . ASN D 14 ? 1.2488 1.5007 1.2667 -0.4363 -0.0678 -0.0956 90 ASN D ND2 8237 N N . LEU D 15 ? 1.1073 1.2107 1.1009 -0.3971 -0.0344 -0.0886 91 LEU D N 8238 C CA . LEU D 15 ? 1.0592 1.1250 1.0489 -0.3854 -0.0244 -0.0846 91 LEU D CA 8239 C C . LEU D 15 ? 1.1053 1.1818 1.1100 -0.3797 -0.0219 -0.0752 91 LEU D C 8240 O O . LEU D 15 ? 1.0606 1.1589 1.0743 -0.3939 -0.0219 -0.0762 91 LEU D O 8241 C CB . LEU D 15 ? 0.9372 0.9646 0.9120 -0.4002 -0.0128 -0.0948 91 LEU D CB 8242 C CG . LEU D 15 ? 0.9090 0.9115 0.8657 -0.4036 -0.0111 -0.1042 91 LEU D CG 8243 C CD1 . LEU D 15 ? 0.8415 0.8085 0.7850 -0.4201 0.0014 -0.1140 91 LEU D CD1 8244 C CD2 . LEU D 15 ? 0.9357 0.9189 0.8879 -0.3805 -0.0115 -0.0981 91 LEU D CD2 8245 N N . CYS D 16 ? 1.1557 1.2171 1.1627 -0.3593 -0.0196 -0.0662 92 CYS D N 8246 C CA . CYS D 16 ? 1.1922 1.2527 1.2096 -0.3535 -0.0144 -0.0581 92 CYS D CA 8247 C C . CYS D 16 ? 1.1083 1.1439 1.1198 -0.3699 -0.0028 -0.0641 92 CYS D C 8248 O O . CYS D 16 ? 1.1338 1.1367 1.1303 -0.3764 0.0040 -0.0718 92 CYS D O 8249 C CB . CYS D 16 ? 1.0620 1.1024 1.0783 -0.3298 -0.0125 -0.0494 92 CYS D CB 8250 S SG . CYS D 16 ? 2.6685 2.7390 2.7032 -0.3124 -0.0180 -0.0357 92 CYS D SG 8251 N N . SER D 17 ? 1.0316 1.0821 1.0544 -0.3770 -0.0001 -0.0606 93 SER D N 8252 C CA . SER D 17 ? 1.1278 1.1529 1.1448 -0.3919 0.0118 -0.0656 93 SER D CA 8253 C C . SER D 17 ? 1.1941 1.1776 1.2024 -0.3777 0.0214 -0.0613 93 SER D C 8254 O O . SER D 17 ? 1.0457 1.0288 1.0584 -0.3569 0.0190 -0.0520 93 SER D O 8255 C CB . SER D 17 ? 1.1151 1.1659 1.1466 -0.4027 0.0129 -0.0625 93 SER D CB 8256 O OG . SER D 17 ? 1.2220 1.3080 1.2592 -0.4196 0.0054 -0.0685 93 SER D OG 8257 N N . ILE D 18 ? 1.1624 1.1107 1.1576 -0.3888 0.0324 -0.0682 94 ILE D N 8258 C CA . ILE D 18 ? 1.0445 0.9521 1.0298 -0.3759 0.0420 -0.0647 94 ILE D CA 8259 C C . ILE D 18 ? 1.1692 1.0527 1.1507 -0.3876 0.0550 -0.0661 94 ILE D C 8260 O O . ILE D 18 ? 1.3042 1.1752 1.2772 -0.4075 0.0610 -0.0759 94 ILE D O 8261 C CB . ILE D 18 ? 1.0749 0.9540 1.0435 -0.3735 0.0438 -0.0716 94 ILE D CB 8262 C CG1 . ILE D 18 ? 1.0112 0.9140 0.9823 -0.3640 0.0311 -0.0713 94 ILE D CG1 8263 C CG2 . ILE D 18 ? 1.1452 0.9856 1.1052 -0.3579 0.0532 -0.0665 94 ILE D CG2 8264 C CD1 . ILE D 18 ? 0.9160 0.7955 0.8715 -0.3634 0.0320 -0.0789 94 ILE D CD1 8265 N N . ASN D 19 ? 1.2548 1.1311 1.2420 -0.3752 0.0598 -0.0562 95 ASN D N 8266 C CA . ASN D 19 ? 1.2768 1.1299 1.2609 -0.3839 0.0726 -0.0556 95 ASN D CA 8267 C C . ASN D 19 ? 1.2626 1.0779 1.2373 -0.3668 0.0814 -0.0494 95 ASN D C 8268 O O . ASN D 19 ? 1.1770 0.9677 1.1471 -0.3705 0.0931 -0.0476 95 ASN D O 8269 C CB . ASN D 19 ? 1.1709 1.0541 1.1716 -0.3874 0.0709 -0.0492 95 ASN D CB 8270 C CG . ASN D 19 ? 1.1109 1.0316 1.1209 -0.4063 0.0634 -0.0555 95 ASN D CG 8271 O OD1 . ASN D 19 ? 0.9885 0.9027 0.9908 -0.4265 0.0665 -0.0662 95 ASN D OD1 8272 N ND2 . ASN D 19 ? 1.1371 1.0976 1.1634 -0.3998 0.0537 -0.0489 95 ASN D ND2 8273 N N . GLY D 20 ? 1.2775 1.0891 1.2493 -0.3481 0.0758 -0.0461 96 GLY D N 8274 C CA . GLY D 20 ? 1.2894 1.0729 1.2550 -0.3289 0.0818 -0.0386 96 GLY D CA 8275 C C . GLY D 20 ? 1.2148 0.9944 1.1752 -0.3134 0.0753 -0.0386 96 GLY D C 8276 O O . GLY D 20 ? 1.0739 0.8760 1.0372 -0.3157 0.0651 -0.0428 96 GLY D O 8277 N N . TRP D 21 ? 1.1225 0.8741 1.0750 -0.2976 0.0811 -0.0336 97 TRP D N 8278 C CA . TRP D 21 ? 1.0518 0.7957 0.9979 -0.2837 0.0766 -0.0340 97 TRP D CA 8279 C C . TRP D 21 ? 1.0384 0.7765 0.9866 -0.2609 0.0764 -0.0235 97 TRP D C 8280 O O . TRP D 21 ? 1.0962 0.8160 1.0423 -0.2554 0.0850 -0.0175 97 TRP D O 8281 C CB . TRP D 21 ? 1.0531 0.7628 0.9826 -0.2904 0.0851 -0.0424 97 TRP D CB 8282 C CG . TRP D 21 ? 1.1094 0.8243 1.0351 -0.3128 0.0846 -0.0539 97 TRP D CG 8283 C CD1 . TRP D 21 ? 1.1964 0.9009 1.1186 -0.3320 0.0931 -0.0594 97 TRP D CD1 8284 C CD2 . TRP D 21 ? 1.1012 0.8338 1.0258 -0.3189 0.0753 -0.0616 97 TRP D CD2 8285 N NE1 . TRP D 21 ? 1.2132 0.9283 1.1322 -0.3502 0.0895 -0.0704 97 TRP D NE1 8286 C CE2 . TRP D 21 ? 1.1575 0.8901 1.0777 -0.3423 0.0785 -0.0718 97 TRP D CE2 8287 C CE3 . TRP D 21 ? 0.9359 0.6841 0.8623 -0.3072 0.0649 -0.0608 97 TRP D CE3 8288 C CZ2 . TRP D 21 ? 0.9620 0.7106 0.8795 -0.3540 0.0711 -0.0811 97 TRP D CZ2 8289 C CZ3 . TRP D 21 ? 0.9453 0.7086 0.8690 -0.3184 0.0579 -0.0696 97 TRP D CZ3 8290 C CH2 . TRP D 21 ? 0.9554 0.7193 0.8747 -0.3415 0.0609 -0.0796 97 TRP D CH2 8291 N N . VAL D 22 ? 1.0457 0.7994 0.9973 -0.2481 0.0666 -0.0215 98 VAL D N 8292 C CA . VAL D 22 ? 0.9747 0.7283 0.9293 -0.2271 0.0645 -0.0122 98 VAL D CA 8293 C C . VAL D 22 ? 1.0203 0.7602 0.9663 -0.2158 0.0627 -0.0140 98 VAL D C 8294 O O . VAL D 22 ? 1.1953 0.9443 1.1394 -0.2201 0.0564 -0.0203 98 VAL D O 8295 C CB . VAL D 22 ? 0.9356 0.7253 0.9049 -0.2208 0.0540 -0.0065 98 VAL D CB 8296 C CG1 . VAL D 22 ? 0.8778 0.6670 0.8494 -0.1999 0.0519 0.0024 98 VAL D CG1 8297 C CG2 . VAL D 22 ? 0.9521 0.7578 0.9310 -0.2317 0.0557 -0.0044 98 VAL D CG2 8298 N N . PRO D 23 ? 0.9776 0.6962 0.9181 -0.2012 0.0683 -0.0082 99 PRO D N 8299 C CA . PRO D 23 ? 1.0042 0.7113 0.9378 -0.1884 0.0668 -0.0086 99 PRO D CA 8300 C C . PRO D 23 ? 0.9758 0.7091 0.9175 -0.1771 0.0549 -0.0054 99 PRO D C 8301 O O . PRO D 23 ? 0.8476 0.5966 0.7982 -0.1680 0.0512 0.0020 99 PRO D O 8302 C CB . PRO D 23 ? 1.0305 0.7135 0.9589 -0.1756 0.0757 -0.0013 99 PRO D CB 8303 C CG . PRO D 23 ? 0.9227 0.6154 0.8593 -0.1764 0.0775 0.0055 99 PRO D CG 8304 C CD . PRO D 23 ? 0.9237 0.6282 0.8643 -0.1962 0.0769 -0.0008 99 PRO D CD 8305 N N . THR D 24 ? 1.0533 0.7904 0.9914 -0.1777 0.0495 -0.0112 100 THR D N 8306 C CA . THR D 24 ? 1.0170 0.7753 0.9611 -0.1667 0.0393 -0.0085 100 THR D CA 8307 C C . THR D 24 ? 0.8788 0.6227 0.8171 -0.1508 0.0403 -0.0057 100 THR D C 8308 O O . THR D 24 ? 0.8099 0.5683 0.7534 -0.1392 0.0336 -0.0014 100 THR D O 8309 C CB . THR D 24 ? 1.0770 0.8541 1.0223 -0.1762 0.0310 -0.0154 100 THR D CB 8310 O OG1 . THR D 24 ? 1.2194 0.9793 1.1544 -0.1890 0.0360 -0.0244 100 THR D OG1 8311 C CG2 . THR D 24 ? 0.9363 0.7414 0.8930 -0.1846 0.0256 -0.0141 100 THR D CG2 8312 N N . TYR D 25 ? 0.8731 0.5887 0.8007 -0.1505 0.0492 -0.0081 101 TYR D N 8313 C CA . TYR D 25 ? 0.8319 0.5328 0.7533 -0.1362 0.0512 -0.0059 101 TYR D CA 8314 C C . TYR D 25 ? 0.9149 0.5838 0.8260 -0.1358 0.0633 -0.0061 101 TYR D C 8315 O O . TYR D 25 ? 1.0144 0.6684 0.9187 -0.1488 0.0693 -0.0125 101 TYR D O 8316 C CB . TYR D 25 ? 0.8748 0.5800 0.7923 -0.1368 0.0456 -0.0123 101 TYR D CB 8317 C CG . TYR D 25 ? 0.9826 0.6693 0.8921 -0.1250 0.0494 -0.0119 101 TYR D CG 8318 C CD1 . TYR D 25 ? 1.0209 0.7125 0.9339 -0.1088 0.0469 -0.0048 101 TYR D CD1 8319 C CD2 . TYR D 25 ? 0.9610 0.6259 0.8593 -0.1304 0.0557 -0.0187 101 TYR D CD2 8320 C CE1 . TYR D 25 ? 0.9369 0.6139 0.8435 -0.0981 0.0503 -0.0043 101 TYR D CE1 8321 C CE2 . TYR D 25 ? 1.0383 0.6873 0.9297 -0.1190 0.0595 -0.0181 101 TYR D CE2 8322 C CZ . TYR D 25 ? 1.0701 0.7261 0.9662 -0.1028 0.0566 -0.0106 101 TYR D CZ 8323 O OH . TYR D 25 ? 1.1345 0.7772 1.0248 -0.0916 0.0602 -0.0097 101 TYR D OH 8324 N N . ARG D 26 ? 0.9569 0.6154 0.8666 -0.1208 0.0670 0.0010 102 ARG D N 8325 C CA . ARG D 26 ? 0.9463 0.5743 0.8459 -0.1168 0.0787 0.0024 102 ARG D CA 8326 C C . ARG D 26 ? 1.0831 0.7045 0.9788 -0.1012 0.0786 0.0049 102 ARG D C 8327 O O . ARG D 26 ? 1.2445 0.8801 1.1463 -0.0886 0.0731 0.0112 102 ARG D O 8328 C CB . ARG D 26 ? 1.0011 0.6226 0.9028 -0.1136 0.0850 0.0102 102 ARG D CB 8329 C CG . ARG D 26 ? 1.1029 0.7365 1.0111 -0.1279 0.0839 0.0090 102 ARG D CG 8330 C CD . ARG D 26 ? 1.2516 0.8917 1.1663 -0.1217 0.0853 0.0182 102 ARG D CD 8331 N NE . ARG D 26 ? 1.4909 1.1042 1.3981 -0.1207 0.0976 0.0220 102 ARG D NE 8332 C CZ . ARG D 26 ? 1.6586 1.2624 1.5636 -0.1058 0.1020 0.0306 102 ARG D CZ 8333 N NH1 . ARG D 26 ? 1.7487 1.3680 1.6586 -0.0914 0.0948 0.0356 102 ARG D NH1 8334 N NH2 . ARG D 26 ? 1.6859 1.2647 1.5835 -0.1054 0.1137 0.0343 102 ARG D NH2 8335 N N . GLY D 27 ? 1.1402 0.7406 1.0257 -0.1022 0.0846 -0.0003 103 GLY D N 8336 C CA . GLY D 27 ? 1.1277 0.7228 1.0097 -0.0882 0.0847 0.0015 103 GLY D CA 8337 C C . GLY D 27 ? 1.2336 0.8187 1.1149 -0.0729 0.0905 0.0111 103 GLY D C 8338 O O . GLY D 27 ? 1.4267 1.0065 1.3092 -0.0735 0.0953 0.0162 103 GLY D O 8339 N N . GLU D 28 ? 1.2937 0.8771 1.1732 -0.0594 0.0902 0.0136 104 GLU D N 8340 C CA . GLU D 28 ? 1.3914 0.9666 1.2697 -0.0437 0.0955 0.0228 104 GLU D CA 8341 C C . GLU D 28 ? 1.4910 1.0347 1.3590 -0.0441 0.1092 0.0239 104 GLU D C 8342 O O . GLU D 28 ? 1.4136 0.9487 1.2806 -0.0356 0.1152 0.0321 104 GLU D O 8343 C CB . GLU D 28 ? 1.4596 1.0408 1.3381 -0.0305 0.0921 0.0241 104 GLU D CB 8344 C CG . GLU D 28 ? 1.6826 1.2791 1.5676 -0.0159 0.0881 0.0332 104 GLU D CG 8345 C CD . GLU D 28 ? 1.8959 1.5202 1.7895 -0.0148 0.0757 0.0319 104 GLU D CD 8346 O OE1 . GLU D 28 ? 1.9326 1.5681 1.8296 -0.0263 0.0696 0.0262 104 GLU D OE1 8347 O OE2 . GLU D 28 ? 1.9181 1.5532 1.8148 -0.0024 0.0724 0.0366 104 GLU D OE2 8348 N N . GLY D 29 ? 1.5585 1.0847 1.4182 -0.0540 0.1145 0.0155 105 GLY D N 8349 C CA . GLY D 29 ? 1.6397 1.1332 1.4880 -0.0551 0.1284 0.0152 105 GLY D CA 8350 C C . GLY D 29 ? 1.6640 1.1463 1.5099 -0.0704 0.1340 0.0126 105 GLY D C 8351 O O . GLY D 29 ? 1.5927 1.0461 1.4284 -0.0738 0.1463 0.0115 105 GLY D O 8352 N N . THR D 30 ? 1.7323 1.2375 1.5875 -0.0799 0.1253 0.0115 106 THR D N 8353 C CA . THR D 30 ? 1.8352 1.3353 1.6911 -0.0914 0.1298 0.0121 106 THR D CA 8354 C C . THR D 30 ? 1.8221 1.3170 1.6793 -0.0780 0.1348 0.0238 106 THR D C 8355 O O . THR D 30 ? 1.6312 1.1057 1.4830 -0.0813 0.1452 0.0267 106 THR D O 8356 C CB . THR D 30 ? 1.8127 1.3429 1.6799 -0.1021 0.1183 0.0096 106 THR D CB 8357 O OG1 . THR D 30 ? 1.6892 1.2278 1.5557 -0.1133 0.1124 -0.0006 106 THR D OG1 8358 C CG2 . THR D 30 ? 1.8086 1.3352 1.6775 -0.1140 0.1232 0.0106 106 THR D CG2 8359 N N . THR D 31 ? 1.9082 1.4217 1.7722 -0.0631 0.1274 0.0304 107 THR D N 8360 C CA . THR D 31 ? 1.8841 1.4008 1.7512 -0.0499 0.1291 0.0416 107 THR D CA 8361 C C . THR D 31 ? 1.8789 1.3807 1.7396 -0.0325 0.1354 0.0478 107 THR D C 8362 O O . THR D 31 ? 1.8471 1.3617 1.7122 -0.0182 0.1317 0.0559 107 THR D O 8363 C CB . THR D 31 ? 1.5143 1.0645 1.3937 -0.0458 0.1161 0.0447 107 THR D CB 8364 O OG1 . THR D 31 ? 1.5147 1.0777 1.3963 -0.0357 0.1088 0.0441 107 THR D OG1 8365 C CG2 . THR D 31 ? 1.4129 0.9802 1.2990 -0.0621 0.1090 0.0380 107 THR D CG2 8366 N N . GLY D 32 ? 1.8977 1.3730 1.7478 -0.0336 0.1449 0.0439 108 GLY D N 8367 C CA . GLY D 32 ? 1.8916 1.3504 1.7350 -0.0169 0.1528 0.0505 108 GLY D CA 8368 C C . GLY D 32 ? 1.8138 1.2683 1.6531 -0.0113 0.1525 0.0457 108 GLY D C 8369 O O . GLY D 32 ? 1.8511 1.2842 1.6815 -0.0191 0.1596 0.0384 108 GLY D O 8370 N N . LYS D 33 ? 1.5893 1.0643 1.4348 0.0018 0.1446 0.0496 109 LYS D N 8371 C CA . LYS D 33 ? 1.5187 0.9903 1.3607 0.0097 0.1451 0.0468 109 LYS D CA 8372 C C . LYS D 33 ? 1.4453 0.9443 1.2953 0.0079 0.1318 0.0414 109 LYS D C 8373 O O . LYS D 33 ? 1.3127 0.8371 1.1721 0.0131 0.1222 0.0456 109 LYS D O 8374 C CB . LYS D 33 ? 1.5246 0.9910 1.3646 0.0298 0.1507 0.0573 109 LYS D CB 8375 C CG . LYS D 33 ? 1.4880 0.9212 1.3158 0.0351 0.1653 0.0580 109 LYS D CG 8376 C CD . LYS D 33 ? 1.3148 0.7276 1.1369 0.0399 0.1764 0.0668 109 LYS D CD 8377 C CE . LYS D 33 ? 1.4242 0.8046 1.2341 0.0480 0.1913 0.0686 109 LYS D CE 8378 N NZ . LYS D 33 ? 1.5387 0.8917 1.3403 0.0467 0.2042 0.0738 109 LYS D NZ 8379 N N . ILE D 34 ? 1.4090 0.9015 1.2545 0.0006 0.1319 0.0321 110 ILE D N 8380 C CA . ILE D 34 ? 1.2684 0.7837 1.1199 -0.0010 0.1206 0.0268 110 ILE D CA 8381 C C . ILE D 34 ? 1.2604 0.7872 1.1153 0.0163 0.1180 0.0326 110 ILE D C 8382 O O . ILE D 34 ? 1.3730 0.8833 1.2216 0.0263 0.1266 0.0354 110 ILE D O 8383 C CB . ILE D 34 ? 1.3699 0.8736 1.2142 -0.0120 0.1225 0.0158 110 ILE D CB 8384 C CG1 . ILE D 34 ? 1.3183 0.8085 1.1578 -0.0296 0.1265 0.0094 110 ILE D CG1 8385 C CG2 . ILE D 34 ? 1.3833 0.9120 1.2341 -0.0149 0.1103 0.0106 110 ILE D CG2 8386 C CD1 . ILE D 34 ? 1.3888 0.9029 1.2375 -0.0405 0.1158 0.0074 110 ILE D CD1 8387 N N . PRO D 35 ? 1.1778 0.7331 1.0426 0.0195 0.1064 0.0343 111 PRO D N 8388 C CA . PRO D 35 ? 1.1636 0.7331 1.0323 0.0337 0.1026 0.0385 111 PRO D CA 8389 C C . PRO D 35 ? 1.3211 0.8841 1.1850 0.0343 0.1044 0.0322 111 PRO D C 8390 O O . PRO D 35 ? 1.4266 0.9834 1.2868 0.0217 0.1038 0.0233 111 PRO D O 8391 C CB . PRO D 35 ? 1.1272 0.7257 1.0060 0.0315 0.0900 0.0387 111 PRO D CB 8392 C CG . PRO D 35 ? 1.1107 0.7098 0.9917 0.0215 0.0889 0.0392 111 PRO D CG 8393 C CD . PRO D 35 ? 1.2138 0.7895 1.0866 0.0099 0.0966 0.0327 111 PRO D CD 8394 N N . ASP D 36 ? 1.4369 1.0016 1.3008 0.0485 0.1068 0.0366 112 ASP D N 8395 C CA . ASP D 36 ? 1.5450 1.1001 1.4033 0.0503 0.1107 0.0313 112 ASP D CA 8396 C C . ASP D 36 ? 1.4825 1.0574 1.3455 0.0452 0.1007 0.0246 112 ASP D C 8397 O O . ASP D 36 ? 1.5283 1.0952 1.3860 0.0432 0.1032 0.0184 112 ASP D O 8398 C CB . ASP D 36 ? 1.6156 1.1661 1.4724 0.0679 0.1175 0.0386 112 ASP D CB 8399 C CG . ASP D 36 ? 1.7733 1.3046 1.6253 0.0751 0.1278 0.0465 112 ASP D CG 8400 O OD1 . ASP D 36 ? 1.9226 1.4283 1.7660 0.0673 0.1365 0.0432 112 ASP D OD1 8401 O OD2 . ASP D 36 ? 1.7410 1.2829 1.5973 0.0883 0.1274 0.0560 112 ASP D OD2 8402 N N . GLU D 37 ? 1.3813 0.9809 1.2533 0.0434 0.0898 0.0260 113 GLU D N 8403 C CA . GLU D 37 ? 1.4761 1.0945 1.3525 0.0386 0.0803 0.0204 113 GLU D CA 8404 C C . GLU D 37 ? 1.4965 1.1114 1.3699 0.0223 0.0774 0.0115 113 GLU D C 8405 O O . GLU D 37 ? 1.4925 1.1192 1.3674 0.0174 0.0708 0.0060 113 GLU D O 8406 C CB . GLU D 37 ? 1.5562 1.2014 1.4426 0.0432 0.0705 0.0250 113 GLU D CB 8407 C CG . GLU D 37 ? 1.8366 1.4908 1.7276 0.0350 0.0648 0.0259 113 GLU D CG 8408 C CD . GLU D 37 ? 2.0295 1.6763 1.9205 0.0398 0.0698 0.0334 113 GLU D CD 8409 O OE1 . GLU D 37 ? 1.9876 1.6213 1.8746 0.0496 0.0780 0.0383 113 GLU D OE1 8410 O OE2 . GLU D 37 ? 2.1098 1.7641 2.0048 0.0340 0.0659 0.0347 113 GLU D OE2 8411 N N . GLN D 38 ? 1.5386 1.1377 1.4075 0.0139 0.0824 0.0101 114 GLN D N 8412 C CA . GLN D 38 ? 1.4526 1.0484 1.3183 -0.0022 0.0803 0.0017 114 GLN D CA 8413 C C . GLN D 38 ? 1.3961 0.9716 1.2513 -0.0066 0.0875 -0.0057 114 GLN D C 8414 O O . GLN D 38 ? 1.4482 1.0044 1.2970 0.0011 0.0973 -0.0038 114 GLN D O 8415 C CB . GLN D 38 ? 1.4102 0.9988 1.2758 -0.0106 0.0828 0.0029 114 GLN D CB 8416 C CG . GLN D 38 ? 1.3613 0.9713 1.2370 -0.0099 0.0746 0.0083 114 GLN D CG 8417 C CD . GLN D 38 ? 1.3078 0.9149 1.1841 -0.0223 0.0750 0.0069 114 GLN D CD 8418 O OE1 . GLN D 38 ? 1.3199 0.9137 1.1899 -0.0342 0.0789 0.0001 114 GLN D OE1 8419 N NE2 . GLN D 38 ? 1.2520 0.8720 1.1357 -0.0200 0.0713 0.0130 114 GLN D NE2 8420 N N . MET D 39 ? 1.2074 0.7875 1.0605 -0.0188 0.0827 -0.0141 115 MET D N 8421 C CA . MET D 39 ? 1.1384 0.6999 0.9806 -0.0249 0.0891 -0.0222 115 MET D CA 8422 C C . MET D 39 ? 1.1777 0.7126 1.0111 -0.0321 0.0996 -0.0245 115 MET D C 8423 O O . MET D 39 ? 1.2701 0.8043 1.1064 -0.0363 0.1001 -0.0213 115 MET D O 8424 C CB . MET D 39 ? 1.1640 0.7379 1.0055 -0.0372 0.0811 -0.0305 115 MET D CB 8425 C CG . MET D 39 ? 1.1488 0.7385 0.9933 -0.0305 0.0749 -0.0311 115 MET D CG 8426 S SD . MET D 39 ? 1.6090 1.1983 1.4454 -0.0426 0.0724 -0.0422 115 MET D SD 8427 C CE . MET D 39 ? 1.6329 1.2025 1.4604 -0.0325 0.0827 -0.0438 115 MET D CE 8428 N N . LEU D 40 ? 1.2220 0.7345 1.0443 -0.0335 0.1087 -0.0300 116 LEU D N 8429 C CA . LEU D 40 ? 1.2309 0.7160 1.0431 -0.0422 0.1194 -0.0337 116 LEU D CA 8430 C C . LEU D 40 ? 1.3228 0.8088 1.1303 -0.0614 0.1159 -0.0444 116 LEU D C 8431 O O . LEU D 40 ? 1.4379 0.9167 1.2372 -0.0667 0.1176 -0.0524 116 LEU D O 8432 C CB . LEU D 40 ? 1.3468 0.8046 1.1484 -0.0335 0.1324 -0.0341 116 LEU D CB 8433 C CG . LEU D 40 ? 1.3782 0.8210 1.1793 -0.0188 0.1420 -0.0243 116 LEU D CG 8434 C CD1 . LEU D 40 ? 1.4462 0.9092 1.2594 -0.0116 0.1350 -0.0144 116 LEU D CD1 8435 C CD2 . LEU D 40 ? 1.3381 0.7744 1.1361 -0.0035 0.1476 -0.0219 116 LEU D CD2 8436 N N . THR D 41 ? 1.2507 0.7468 1.0635 -0.0717 0.1109 -0.0442 117 THR D N 8437 C CA . THR D 41 ? 1.0850 0.5853 0.8946 -0.0904 0.1070 -0.0534 117 THR D CA 8438 C C . THR D 41 ? 1.1353 0.6056 0.9319 -0.1017 0.1189 -0.0603 117 THR D C 8439 O O . THR D 41 ? 1.2409 0.6898 1.0337 -0.0977 0.1291 -0.0562 117 THR D O 8440 C CB . THR D 41 ? 1.1056 0.6282 0.9261 -0.0970 0.0981 -0.0502 117 THR D CB 8441 O OG1 . THR D 41 ? 1.2290 0.7358 1.0475 -0.1024 0.1058 -0.0483 117 THR D OG1 8442 C CG2 . THR D 41 ? 1.0280 0.5734 0.8609 -0.0829 0.0899 -0.0408 117 THR D CG2 8443 N N . ARG D 42 ? 1.1392 0.6074 0.9281 -0.1159 0.1178 -0.0708 118 ARG D N 8444 C CA . ARG D 42 ? 1.2164 0.6625 0.9943 -0.1321 0.1262 -0.0790 118 ARG D CA 8445 C C . ARG D 42 ? 1.1966 0.6621 0.9750 -0.1497 0.1167 -0.0878 118 ARG D C 8446 O O . ARG D 42 ? 1.2143 0.7073 1.0009 -0.1472 0.1047 -0.0865 118 ARG D O 8447 C CB . ARG D 42 ? 1.2378 0.6500 1.0006 -0.1296 0.1401 -0.0838 118 ARG D CB 8448 C CG . ARG D 42 ? 1.2104 0.6242 0.9680 -0.1244 0.1386 -0.0883 118 ARG D CG 8449 C CD . ARG D 42 ? 1.5208 0.8986 1.2630 -0.1218 0.1539 -0.0926 118 ARG D CD 8450 N NE . ARG D 42 ? 1.7751 1.1286 1.5058 -0.1384 0.1631 -0.1005 118 ARG D NE 8451 C CZ . ARG D 42 ? 1.7639 1.1129 1.4847 -0.1560 0.1631 -0.1126 118 ARG D CZ 8452 N NH1 . ARG D 42 ? 1.4764 0.8436 1.1971 -0.1587 0.1543 -0.1180 118 ARG D NH1 8453 N NH2 . ARG D 42 ? 1.7757 1.1021 1.4862 -0.1713 0.1721 -0.1196 118 ARG D NH2 8454 N N . GLN D 43 ? 1.1731 0.6251 0.9428 -0.1674 0.1218 -0.0962 119 GLN D N 8455 C CA . GLN D 43 ? 1.1209 0.5928 0.8914 -0.1854 0.1129 -0.1042 119 GLN D CA 8456 C C . GLN D 43 ? 1.0827 0.5908 0.8695 -0.1846 0.0990 -0.0980 119 GLN D C 8457 O O . GLN D 43 ? 1.1088 0.6411 0.8990 -0.1905 0.0884 -0.1014 119 GLN D O 8458 C CB . GLN D 43 ? 1.2071 0.6804 0.9686 -0.1895 0.1103 -0.1131 119 GLN D CB 8459 C CG . GLN D 43 ? 1.3284 0.8018 1.0810 -0.2117 0.1096 -0.1252 119 GLN D CG 8460 C CD . GLN D 43 ? 1.3788 0.8869 1.1377 -0.2184 0.0948 -0.1278 119 GLN D CD 8461 O OE1 . GLN D 43 ? 1.3948 0.9040 1.1442 -0.2287 0.0932 -0.1373 119 GLN D OE1 8462 N NE2 . GLN D 43 ? 1.2243 0.7607 0.9987 -0.2124 0.0843 -0.1194 119 GLN D NE2 8463 N N . ASN D 44 ? 0.9838 0.4948 0.7800 -0.1771 0.0996 -0.0887 120 ASN D N 8464 C CA . ASN D 44 ? 1.0433 0.5859 0.8544 -0.1765 0.0881 -0.0827 120 ASN D CA 8465 C C . ASN D 44 ? 0.9587 0.5179 0.7719 -0.1958 0.0823 -0.0889 120 ASN D C 8466 O O . ASN D 44 ? 1.0513 0.5947 0.8571 -0.2102 0.0895 -0.0952 120 ASN D O 8467 C CB . ASN D 44 ? 1.2309 0.7695 1.0497 -0.1664 0.0918 -0.0723 120 ASN D CB 8468 C CG . ASN D 44 ? 1.1612 0.6939 0.9817 -0.1458 0.0940 -0.0643 120 ASN D CG 8469 O OD1 . ASN D 44 ? 1.0219 0.5768 0.8526 -0.1352 0.0851 -0.0580 120 ASN D OD1 8470 N ND2 . ASN D 44 ? 1.2017 0.7043 1.0121 -0.1401 0.1062 -0.0645 120 ASN D ND2 8471 N N . PHE D 45 ? 1.0184 0.6099 0.8420 -0.1960 0.0696 -0.0869 121 PHE D N 8472 C CA . PHE D 45 ? 1.0786 0.6911 0.9076 -0.2118 0.0632 -0.0901 121 PHE D CA 8473 C C . PHE D 45 ? 1.0009 0.6478 0.8444 -0.2046 0.0504 -0.0830 121 PHE D C 8474 O O . PHE D 45 ? 0.8418 0.4950 0.6894 -0.1893 0.0464 -0.0772 121 PHE D O 8475 C CB . PHE D 45 ? 1.0989 0.7105 0.9173 -0.2287 0.0625 -0.1021 121 PHE D CB 8476 C CG . PHE D 45 ? 1.0582 0.6850 0.8749 -0.2247 0.0541 -0.1046 121 PHE D CG 8477 C CD1 . PHE D 45 ? 1.0393 0.6477 0.8466 -0.2159 0.0589 -0.1067 121 PHE D CD1 8478 C CD2 . PHE D 45 ? 1.0653 0.7252 0.8900 -0.2297 0.0418 -0.1045 121 PHE D CD2 8479 C CE1 . PHE D 45 ? 0.9745 0.5967 0.7800 -0.2124 0.0515 -0.1089 121 PHE D CE1 8480 C CE2 . PHE D 45 ? 1.0243 0.6976 0.8468 -0.2259 0.0344 -0.1063 121 PHE D CE2 8481 C CZ . PHE D 45 ? 0.9754 0.6297 0.7882 -0.2176 0.0393 -0.1087 121 PHE D CZ 8482 N N . VAL D 46 ? 1.0417 0.7106 0.8929 -0.2157 0.0443 -0.0833 122 VAL D N 8483 C CA . VAL D 46 ? 1.0168 0.7176 0.8817 -0.2090 0.0330 -0.0763 122 VAL D CA 8484 C C . VAL D 46 ? 1.0030 0.7296 0.8694 -0.2210 0.0236 -0.0816 122 VAL D C 8485 O O . VAL D 46 ? 1.1485 0.8775 1.0122 -0.2378 0.0247 -0.0881 122 VAL D O 8486 C CB . VAL D 46 ? 1.4334 1.1418 1.3096 -0.2070 0.0336 -0.0685 122 VAL D CB 8487 C CG1 . VAL D 46 ? 0.7202 0.4632 0.6101 -0.2025 0.0220 -0.0624 122 VAL D CG1 8488 C CG2 . VAL D 46 ? 0.7486 0.4351 0.6242 -0.1924 0.0416 -0.0616 122 VAL D CG2 8489 N N . SER D 47 ? 1.0077 0.7534 0.8780 -0.2124 0.0146 -0.0789 123 SER D N 8490 C CA . SER D 47 ? 1.0065 0.7809 0.8801 -0.2207 0.0045 -0.0816 123 SER D CA 8491 C C . SER D 47 ? 0.9616 0.7624 0.8485 -0.2088 -0.0045 -0.0721 123 SER D C 8492 O O . SER D 47 ? 0.8515 0.6479 0.7413 -0.1932 -0.0045 -0.0658 123 SER D O 8493 C CB . SER D 47 ? 0.9700 0.7411 0.8323 -0.2239 0.0027 -0.0890 123 SER D CB 8494 O OG . SER D 47 ? 0.9472 0.7454 0.8113 -0.2342 -0.0063 -0.0922 123 SER D OG 8495 N N . CYS D 48 ? 0.9382 0.7667 0.8331 -0.2163 -0.0120 -0.0712 124 CYS D N 8496 C CA . CYS D 48 ? 0.9357 0.7885 0.8430 -0.2054 -0.0197 -0.0622 124 CYS D CA 8497 C C . CYS D 48 ? 1.0248 0.9006 0.9325 -0.2043 -0.0292 -0.0625 124 CYS D C 8498 O O . CYS D 48 ? 1.0530 0.9348 0.9540 -0.2161 -0.0317 -0.0697 124 CYS D O 8499 C CB . CYS D 48 ? 0.8971 0.7658 0.8157 -0.2111 -0.0206 -0.0583 124 CYS D CB 8500 S SG . CYS D 48 ? 1.2373 1.0789 1.1557 -0.2103 -0.0093 -0.0563 124 CYS D SG 8501 N N . SER D 49 ? 1.1614 1.0488 1.0761 -0.1898 -0.0342 -0.0546 125 SER D N 8502 C CA . SER D 49 ? 1.1208 1.0321 1.0376 -0.1868 -0.0433 -0.0527 125 SER D CA 8503 C C . SER D 49 ? 1.1380 1.0765 1.0682 -0.1856 -0.0489 -0.0458 125 SER D C 8504 O O . SER D 49 ? 1.1643 1.1054 1.1005 -0.1920 -0.0464 -0.0451 125 SER D O 8505 C CB . SER D 49 ? 0.9705 0.8754 0.8853 -0.1713 -0.0444 -0.0487 125 SER D CB 8506 O OG . SER D 49 ? 1.0070 0.9171 0.9318 -0.1588 -0.0451 -0.0399 125 SER D OG 8507 N N . ASP D 50 ? 1.3032 1.2614 1.2379 -0.1770 -0.0561 -0.0404 126 ASP D N 8508 C CA . ASP D 50 ? 1.3321 1.3177 1.2790 -0.1750 -0.0616 -0.0336 126 ASP D CA 8509 C C . ASP D 50 ? 1.3251 1.3085 1.2798 -0.1595 -0.0605 -0.0249 126 ASP D C 8510 O O . ASP D 50 ? 1.4656 1.4700 1.4299 -0.1540 -0.0649 -0.0181 126 ASP D O 8511 C CB . ASP D 50 ? 1.4974 1.5072 1.4440 -0.1752 -0.0700 -0.0328 126 ASP D CB 8512 C CG . ASP D 50 ? 1.6478 1.6476 1.5859 -0.1661 -0.0712 -0.0332 126 ASP D CG 8513 O OD1 . ASP D 50 ? 1.6895 1.6637 1.6195 -0.1644 -0.0655 -0.0371 126 ASP D OD1 8514 O OD2 . ASP D 50 ? 1.6853 1.7031 1.6247 -0.1605 -0.0774 -0.0292 126 ASP D OD2 8515 N N . LYS D 51 ? 1.1880 1.1462 1.1383 -0.1526 -0.0544 -0.0251 127 LYS D N 8516 C CA . LYS D 51 ? 1.1027 1.0570 1.0586 -0.1381 -0.0532 -0.0177 127 LYS D CA 8517 C C . LYS D 51 ? 1.0876 1.0176 1.0416 -0.1358 -0.0452 -0.0180 127 LYS D C 8518 O O . LYS D 51 ? 1.1195 1.0476 1.0793 -0.1265 -0.0434 -0.0120 127 LYS D O 8519 C CB . LYS D 51 ? 1.1430 1.0962 1.0948 -0.1271 -0.0562 -0.0158 127 LYS D CB 8520 C CG . LYS D 51 ? 1.2522 1.1799 1.1962 -0.1212 -0.0509 -0.0182 127 LYS D CG 8521 C CD . LYS D 51 ? 1.4086 1.3376 1.3489 -0.1118 -0.0541 -0.0167 127 LYS D CD 8522 C CE . LYS D 51 ? 1.3912 1.2984 1.3265 -0.1035 -0.0490 -0.0171 127 LYS D CE 8523 N NZ . LYS D 51 ? 1.3664 1.2760 1.2991 -0.0944 -0.0520 -0.0152 127 LYS D NZ 8524 N N . GLU D 52 ? 1.0663 0.9776 1.0116 -0.1443 -0.0401 -0.0250 128 GLU D N 8525 C CA . GLU D 52 ? 0.9233 0.8098 0.8652 -0.1420 -0.0318 -0.0254 128 GLU D CA 8526 C C . GLU D 52 ? 0.9956 0.8654 0.9287 -0.1550 -0.0262 -0.0336 128 GLU D C 8527 O O . GLU D 52 ? 1.0114 0.8852 0.9384 -0.1641 -0.0287 -0.0399 128 GLU D O 8528 C CB . GLU D 52 ? 0.9042 0.7764 0.8418 -0.1288 -0.0300 -0.0235 128 GLU D CB 8529 C CG . GLU D 52 ? 0.9908 0.8570 0.9188 -0.1300 -0.0313 -0.0292 128 GLU D CG 8530 C CD . GLU D 52 ? 1.1409 0.9945 1.0654 -0.1172 -0.0294 -0.0272 128 GLU D CD 8531 O OE1 . GLU D 52 ? 1.2141 1.0680 1.1444 -0.1067 -0.0288 -0.0209 128 GLU D OE1 8532 O OE2 . GLU D 52 ? 0.9992 0.8433 0.9151 -0.1180 -0.0285 -0.0321 128 GLU D OE2 8533 N N . CYS D 53 ? 0.9382 0.7887 0.8698 -0.1559 -0.0183 -0.0334 129 CYS D N 8534 C CA . CYS D 53 ? 0.8433 0.6713 0.7648 -0.1658 -0.0109 -0.0409 129 CYS D CA 8535 C C . CYS D 53 ? 0.9398 0.7445 0.8530 -0.1558 -0.0058 -0.0414 129 CYS D C 8536 O O . CYS D 53 ? 0.8697 0.6726 0.7867 -0.1421 -0.0057 -0.0350 129 CYS D O 8537 C CB . CYS D 53 ? 0.8028 0.6220 0.7268 -0.1726 -0.0043 -0.0401 129 CYS D CB 8538 S SG . CYS D 53 ? 1.3467 1.1897 1.2773 -0.1898 -0.0085 -0.0429 129 CYS D SG 8539 N N . ARG D 54 ? 0.9979 0.7855 0.8998 -0.1626 -0.0014 -0.0491 130 ARG D N 8540 C CA . ARG D 54 ? 0.9624 0.7285 0.8566 -0.1531 0.0039 -0.0498 130 ARG D CA 8541 C C . ARG D 54 ? 0.9815 0.7191 0.8657 -0.1591 0.0144 -0.0550 130 ARG D C 8542 O O . ARG D 54 ? 0.9863 0.7197 0.8654 -0.1738 0.0169 -0.0617 130 ARG D O 8543 C CB . ARG D 54 ? 0.9695 0.7411 0.8582 -0.1512 -0.0010 -0.0535 130 ARG D CB 8544 C CG . ARG D 54 ? 0.9013 0.6953 0.7979 -0.1416 -0.0098 -0.0477 130 ARG D CG 8545 C CD . ARG D 54 ? 0.7280 0.5184 0.6182 -0.1349 -0.0114 -0.0496 130 ARG D CD 8546 N NE . ARG D 54 ? 0.9326 0.7266 0.8289 -0.1199 -0.0130 -0.0423 130 ARG D NE 8547 C CZ . ARG D 54 ? 0.9183 0.6972 0.8110 -0.1101 -0.0084 -0.0413 130 ARG D CZ 8548 N NH1 . ARG D 54 ? 0.8601 0.6187 0.7432 -0.1128 -0.0017 -0.0468 130 ARG D NH1 8549 N NH2 . ARG D 54 ? 1.0477 0.8325 0.9464 -0.0978 -0.0105 -0.0349 130 ARG D NH2 8550 N N . ARG D 55 ? 0.9402 0.6585 0.8213 -0.1476 0.0209 -0.0518 131 ARG D N 8551 C CA . ARG D 55 ? 0.9523 0.6411 0.8232 -0.1501 0.0320 -0.0556 131 ARG D CA 8552 C C . ARG D 55 ? 0.9690 0.6460 0.8298 -0.1476 0.0339 -0.0610 131 ARG D C 8553 O O . ARG D 55 ? 1.0945 0.7728 0.9565 -0.1345 0.0323 -0.0573 131 ARG D O 8554 C CB . ARG D 55 ? 0.9475 0.6234 0.8216 -0.1378 0.0382 -0.0477 131 ARG D CB 8555 C CG . ARG D 55 ? 0.9806 0.6248 0.8441 -0.1359 0.0503 -0.0497 131 ARG D CG 8556 C CD . ARG D 55 ? 0.9922 0.6269 0.8596 -0.1236 0.0558 -0.0407 131 ARG D CD 8557 N NE . ARG D 55 ? 1.0525 0.6572 0.9098 -0.1192 0.0674 -0.0415 131 ARG D NE 8558 C CZ . ARG D 55 ? 1.1066 0.6995 0.9646 -0.1065 0.0735 -0.0340 131 ARG D CZ 8559 N NH1 . ARG D 55 ? 1.1689 0.7775 1.0370 -0.0973 0.0687 -0.0255 131 ARG D NH1 8560 N NH2 . ARG D 55 ? 1.0069 0.5723 0.8550 -0.1026 0.0845 -0.0349 131 ARG D NH2 8561 N N . PHE D 56 ? 0.9508 0.6170 0.8014 -0.1607 0.0373 -0.0702 132 PHE D N 8562 C CA . PHE D 56 ? 0.9690 0.6217 0.8086 -0.1593 0.0404 -0.0762 132 PHE D CA 8563 C C . PHE D 56 ? 1.1088 0.7284 0.9384 -0.1583 0.0536 -0.0785 132 PHE D C 8564 O O . PHE D 56 ? 0.9988 0.6052 0.8262 -0.1663 0.0601 -0.0797 132 PHE D O 8565 C CB . PHE D 56 ? 0.8891 0.5506 0.7222 -0.1742 0.0360 -0.0854 132 PHE D CB 8566 C CG . PHE D 56 ? 0.8817 0.5742 0.7226 -0.1737 0.0237 -0.0833 132 PHE D CG 8567 C CD1 . PHE D 56 ? 0.8311 0.5464 0.6834 -0.1766 0.0167 -0.0786 132 PHE D CD1 8568 C CD2 . PHE D 56 ? 0.9125 0.6110 0.7489 -0.1701 0.0194 -0.0858 132 PHE D CD2 8569 C CE1 . PHE D 56 ? 0.8289 0.5721 0.6880 -0.1753 0.0059 -0.0762 132 PHE D CE1 8570 C CE2 . PHE D 56 ? 0.9524 0.6787 0.7953 -0.1692 0.0084 -0.0834 132 PHE D CE2 8571 C CZ . PHE D 56 ? 0.8497 0.5981 0.7039 -0.1715 0.0018 -0.0784 132 PHE D CZ 8572 N N . PHE D 57 ? 1.0969 0.7028 0.9200 -0.1484 0.0578 -0.0791 133 PHE D N 8573 C CA . PHE D 57 ? 1.1684 0.7425 0.9812 -0.1460 0.0707 -0.0812 133 PHE D CA 8574 C C . PHE D 57 ? 1.1090 0.6734 0.9132 -0.1397 0.0733 -0.0850 133 PHE D C 8575 O O . PHE D 57 ? 1.0666 0.6494 0.8739 -0.1360 0.0651 -0.0850 133 PHE D O 8576 C CB . PHE D 57 ? 1.1235 0.6889 0.9421 -0.1326 0.0759 -0.0715 133 PHE D CB 8577 C CG . PHE D 57 ? 1.1078 0.6882 0.9352 -0.1157 0.0702 -0.0634 133 PHE D CG 8578 C CD1 . PHE D 57 ? 1.1555 0.7630 0.9954 -0.1129 0.0598 -0.0577 133 PHE D CD1 8579 C CD2 . PHE D 57 ? 1.1040 0.6719 0.9272 -0.1028 0.0756 -0.0616 133 PHE D CD2 8580 C CE1 . PHE D 57 ? 1.1559 0.7766 1.0032 -0.0984 0.0549 -0.0508 133 PHE D CE1 8581 C CE2 . PHE D 57 ? 1.1812 0.7642 1.0126 -0.0883 0.0702 -0.0546 133 PHE D CE2 8582 C CZ . PHE D 57 ? 1.1953 0.8041 1.0384 -0.0865 0.0600 -0.0494 133 PHE D CZ 8583 N N . VAL D 58 ? 1.0617 0.5965 0.8549 -0.1384 0.0855 -0.0882 134 VAL D N 8584 C CA . VAL D 58 ? 1.0580 0.5790 0.8425 -0.1306 0.0908 -0.0910 134 VAL D CA 8585 C C . VAL D 58 ? 1.0078 0.5161 0.7951 -0.1125 0.0979 -0.0822 134 VAL D C 8586 O O . VAL D 58 ? 1.1827 0.6780 0.9710 -0.1105 0.1045 -0.0778 134 VAL D O 8587 C CB . VAL D 58 ? 1.1785 0.6730 0.9467 -0.1433 0.1007 -0.1019 134 VAL D CB 8588 C CG1 . VAL D 58 ? 1.2505 0.7265 1.0091 -0.1339 0.1086 -0.1043 134 VAL D CG1 8589 C CG2 . VAL D 58 ? 1.1285 0.6373 0.8933 -0.1615 0.0933 -0.1110 134 VAL D CG2 8590 N N . SER D 59 ? 0.9850 0.4984 0.7740 -0.0994 0.0966 -0.0793 135 SER D N 8591 C CA . SER D 59 ? 1.0803 0.5824 0.8711 -0.0822 0.1038 -0.0714 135 SER D CA 8592 C C . SER D 59 ? 1.2715 0.7666 1.0564 -0.0734 0.1077 -0.0736 135 SER D C 8593 O O . SER D 59 ? 1.3559 0.8564 1.1357 -0.0800 0.1041 -0.0808 135 SER D O 8594 C CB . SER D 59 ? 1.1938 0.7182 0.9992 -0.0709 0.0960 -0.0610 135 SER D CB 8595 O OG . SER D 59 ? 1.4115 0.9253 1.2182 -0.0548 0.1032 -0.0534 135 SER D OG 8596 N N . MET D 60 ? 1.3512 0.8359 1.1371 -0.0579 0.1149 -0.0668 136 MET D N 8597 C CA . MET D 60 ? 1.4088 0.8845 1.1889 -0.0483 0.1206 -0.0682 136 MET D CA 8598 C C . MET D 60 ? 1.5239 1.0107 1.3136 -0.0294 0.1197 -0.0580 136 MET D C 8599 O O . MET D 60 ? 1.6293 1.1227 1.4194 -0.0213 0.1190 -0.0581 136 MET D O 8600 C CB . MET D 60 ? 1.4393 0.8803 1.2049 -0.0508 0.1354 -0.0732 136 MET D CB 8601 C CG . MET D 60 ? 1.4395 0.8680 1.1979 -0.0410 0.1432 -0.0750 136 MET D CG 8602 S SD . MET D 60 ? 1.6082 0.9960 1.3470 -0.0492 0.1594 -0.0842 136 MET D SD 8603 C CE . MET D 60 ? 2.0527 1.4292 1.7874 -0.0307 0.1690 -0.0815 136 MET D CE 8604 N N . GLY D 61 ? 1.5479 1.0375 1.3451 -0.0230 0.1198 -0.0495 137 GLY D N 8605 C CA . GLY D 61 ? 1.6511 1.1543 1.4582 -0.0063 0.1178 -0.0394 137 GLY D CA 8606 C C . GLY D 61 ? 1.7502 1.2621 1.5662 -0.0034 0.1145 -0.0312 137 GLY D C 8607 O O . GLY D 61 ? 1.7182 1.2382 1.5373 -0.0146 0.1084 -0.0329 137 GLY D O 8608 N N . TYR D 62 ? 1.7792 1.2901 1.5992 0.0119 0.1188 -0.0221 138 TYR D N 8609 C CA . TYR D 62 ? 1.7993 1.3215 1.6282 0.0167 0.1151 -0.0134 138 TYR D CA 8610 C C . TYR D 62 ? 1.7676 1.2684 1.5923 0.0257 0.1266 -0.0066 138 TYR D C 8611 O O . TYR D 62 ? 1.6866 1.1946 1.5168 0.0401 0.1274 0.0026 138 TYR D O 8612 C CB . TYR D 62 ? 1.9362 1.4866 1.7765 0.0271 0.1058 -0.0075 138 TYR D CB 8613 C CG . TYR D 62 ? 2.0472 1.6207 1.8932 0.0183 0.0934 -0.0122 138 TYR D CG 8614 C CD1 . TYR D 62 ? 2.0805 1.6579 1.9235 0.0151 0.0911 -0.0189 138 TYR D CD1 8615 C CD2 . TYR D 62 ? 2.0207 1.6119 1.8749 0.0136 0.0845 -0.0096 138 TYR D CD2 8616 C CE1 . TYR D 62 ? 2.0444 1.6423 1.8922 0.0077 0.0803 -0.0224 138 TYR D CE1 8617 C CE2 . TYR D 62 ? 1.9735 1.5849 1.8326 0.0065 0.0739 -0.0132 138 TYR D CE2 8618 C CZ . TYR D 62 ? 1.9843 1.5989 1.8400 0.0036 0.0718 -0.0195 138 TYR D CZ 8619 O OH . TYR D 62 ? 1.8782 1.5123 1.7383 -0.0029 0.0617 -0.0224 138 TYR D OH 8620 N N . VAL D 73 ? 1.6958 0.9719 1.3578 -0.1425 0.1934 -0.1445 149 VAL D N 8621 C CA . VAL D 73 ? 1.8100 1.1105 1.4735 -0.1451 0.1823 -0.1491 149 VAL D CA 8622 C C . VAL D 73 ? 1.7960 1.1031 1.4643 -0.1247 0.1823 -0.1425 149 VAL D C 8623 O O . VAL D 73 ? 1.8440 1.1258 1.5035 -0.1145 0.1952 -0.1425 149 VAL D O 8624 C CB . VAL D 73 ? 1.6907 0.9782 1.3368 -0.1639 0.1857 -0.1643 149 VAL D CB 8625 C CG1 . VAL D 73 ? 1.4907 0.7866 1.1365 -0.1854 0.1798 -0.1704 149 VAL D CG1 8626 C CG2 . VAL D 73 ? 1.7347 0.9922 1.3680 -0.1599 0.2019 -0.1670 149 VAL D CG2 8627 N N . SER D 74 ? 1.7111 1.0521 1.3933 -0.1189 0.1683 -0.1370 150 SER D N 8628 C CA . SER D 74 ? 1.6281 0.9796 1.3166 -0.1007 0.1668 -0.1305 150 SER D CA 8629 C C . SER D 74 ? 1.5531 0.9371 1.2485 -0.1033 0.1523 -0.1317 150 SER D C 8630 O O . SER D 74 ? 1.5851 0.9899 1.2861 -0.1148 0.1410 -0.1330 150 SER D O 8631 C CB . SER D 74 ? 1.5628 0.9198 1.2648 -0.0835 0.1672 -0.1170 150 SER D CB 8632 O OG . SER D 74 ? 1.5174 0.8915 1.2279 -0.0676 0.1630 -0.1106 150 SER D OG 8633 N N . GLU D 75 ? 1.4089 0.7970 1.1036 -0.0925 0.1530 -0.1309 151 GLU D N 8634 C CA . GLU D 75 ? 1.3295 0.7475 1.0312 -0.0926 0.1401 -0.1306 151 GLU D CA 8635 C C . GLU D 75 ? 1.3459 0.7895 1.0658 -0.0833 0.1301 -0.1194 151 GLU D C 8636 O O . GLU D 75 ? 1.5360 1.0063 1.2639 -0.0868 0.1176 -0.1182 151 GLU D O 8637 C CB . GLU D 75 ? 1.3875 0.8027 1.0845 -0.0822 0.1445 -0.1317 151 GLU D CB 8638 C CG . GLU D 75 ? 1.5629 0.9447 1.2427 -0.0834 0.1597 -0.1395 151 GLU D CG 8639 C CD . GLU D 75 ? 1.5985 0.9808 1.2714 -0.0787 0.1621 -0.1437 151 GLU D CD 8640 O OE1 . GLU D 75 ? 1.3988 0.7704 1.0571 -0.0909 0.1649 -0.1546 151 GLU D OE1 8641 O OE2 . GLU D 75 ? 1.7258 1.1194 1.4076 -0.0630 0.1614 -0.1363 151 GLU D OE2 8642 N N . GLN D 76 ? 1.2233 0.6579 0.9492 -0.0713 0.1361 -0.1111 152 GLN D N 8643 C CA . GLN D 76 ? 1.2996 0.7566 1.0420 -0.0607 0.1280 -0.1001 152 GLN D CA 8644 C C . GLN D 76 ? 1.2147 0.6861 0.9648 -0.0707 0.1190 -0.0984 152 GLN D C 8645 O O . GLN D 76 ? 1.1170 0.6110 0.8805 -0.0646 0.1100 -0.0907 152 GLN D O 8646 C CB . GLN D 76 ? 1.4578 0.9013 1.2034 -0.0441 0.1376 -0.0916 152 GLN D CB 8647 C CG . GLN D 76 ? 1.5302 0.9604 1.2691 -0.0328 0.1471 -0.0925 152 GLN D CG 8648 C CD . GLN D 76 ? 1.4955 0.9232 1.2418 -0.0137 0.1530 -0.0818 152 GLN D CD 8649 O OE1 . GLN D 76 ? 1.4775 0.9204 1.2359 -0.0078 0.1472 -0.0732 152 GLN D OE1 8650 N NE2 . GLN D 76 ? 1.4061 0.8153 1.1450 -0.0038 0.1647 -0.0821 152 GLN D NE2 8651 N N . MET D 77 ? 1.2007 0.6597 0.9423 -0.0864 0.1214 -0.1057 156 MET D N 8652 C CA . MET D 77 ? 1.1725 0.6438 0.9210 -0.0964 0.1141 -0.1043 156 MET D CA 8653 C C . MET D 77 ? 1.1225 0.6253 0.8787 -0.1027 0.0994 -0.1049 156 MET D C 8654 O O . MET D 77 ? 1.2348 0.7432 0.9845 -0.1094 0.0960 -0.1117 156 MET D O 8655 C CB . MET D 77 ? 1.3386 0.7884 1.0755 -0.1127 0.1212 -0.1127 156 MET D CB 8656 C CG . MET D 77 ? 1.3691 0.7867 1.0990 -0.1084 0.1359 -0.1112 156 MET D CG 8657 S SD . MET D 77 ? 1.7806 1.2018 1.5234 -0.1005 0.1357 -0.0993 156 MET D SD 8658 C CE . MET D 77 ? 1.7250 1.1056 1.4539 -0.1065 0.1527 -0.1031 156 MET D CE 8659 N N . ASN D 78 ? 1.1068 0.6296 0.8763 -0.1000 0.0911 -0.0974 157 ASN D N 8660 C CA . ASN D 78 ? 1.1745 0.7264 0.9518 -0.1056 0.0776 -0.0969 157 ASN D CA 8661 C C . ASN D 78 ? 1.1586 0.7192 0.9415 -0.1160 0.0730 -0.0960 157 ASN D C 8662 O O . ASN D 78 ? 1.1194 0.6663 0.9031 -0.1157 0.0793 -0.0933 157 ASN D O 8663 C CB . ASN D 78 ? 1.1106 0.6829 0.9000 -0.0911 0.0707 -0.0882 157 ASN D CB 8664 C CG . ASN D 78 ? 1.1298 0.6990 0.9150 -0.0820 0.0736 -0.0893 157 ASN D CG 8665 O OD1 . ASN D 78 ? 1.1614 0.7267 0.9369 -0.0888 0.0743 -0.0969 157 ASN D OD1 8666 N ND2 . ASN D 78 ? 1.0137 0.5854 0.8061 -0.0667 0.0752 -0.0816 157 ASN D ND2 8667 N N . VAL D 79 ? 1.1886 0.7721 0.9752 -0.1249 0.0623 -0.0980 158 VAL D N 8668 C CA . VAL D 79 ? 1.0255 0.6232 0.8203 -0.1328 0.0564 -0.0955 158 VAL D CA 8669 C C . VAL D 79 ? 0.9657 0.5875 0.7751 -0.1224 0.0473 -0.0860 158 VAL D C 8670 O O . VAL D 79 ? 1.0806 0.7188 0.8931 -0.1175 0.0403 -0.0846 158 VAL D O 8671 C CB . VAL D 79 ? 0.9931 0.6023 0.7833 -0.1499 0.0504 -0.1033 158 VAL D CB 8672 C CG1 . VAL D 79 ? 0.8423 0.4557 0.6373 -0.1604 0.0493 -0.1029 158 VAL D CG1 8673 C CG2 . VAL D 79 ? 0.8519 0.4410 0.6260 -0.1587 0.0576 -0.1139 158 VAL D CG2 8674 N N . TYR D 80 ? 0.9924 0.6153 0.8102 -0.1191 0.0480 -0.0795 159 TYR D N 8675 C CA . TYR D 80 ? 0.9027 0.5477 0.7339 -0.1104 0.0398 -0.0708 159 TYR D CA 8676 C C . TYR D 80 ? 0.9049 0.5626 0.7433 -0.1191 0.0352 -0.0689 159 TYR D C 8677 O O . TYR D 80 ? 0.9529 0.6006 0.7865 -0.1309 0.0393 -0.0736 159 TYR D O 8678 C CB . TYR D 80 ? 0.8412 0.4777 0.6771 -0.0953 0.0449 -0.0630 159 TYR D CB 8679 C CG . TYR D 80 ? 0.9505 0.5743 0.7806 -0.0851 0.0506 -0.0636 159 TYR D CG 8680 C CD1 . TYR D 80 ? 0.9635 0.5606 0.7834 -0.0852 0.0619 -0.0673 159 TYR D CD1 8681 C CD2 . TYR D 80 ? 0.8296 0.4678 0.6646 -0.0752 0.0453 -0.0602 159 TYR D CD2 8682 C CE1 . TYR D 80 ? 1.0229 0.6091 0.8380 -0.0750 0.0676 -0.0673 159 TYR D CE1 8683 C CE2 . TYR D 80 ? 0.8505 0.4788 0.6811 -0.0658 0.0507 -0.0605 159 TYR D CE2 8684 C CZ . TYR D 80 ? 1.0174 0.6203 0.8383 -0.0654 0.0617 -0.0639 159 TYR D CZ 8685 O OH . TYR D 80 ? 1.0455 0.6396 0.8624 -0.0555 0.0672 -0.0638 159 TYR D OH 8686 N N . SER D 81 ? 0.9152 0.5946 0.7650 -0.1132 0.0271 -0.0621 160 SER D N 8687 C CA . SER D 81 ? 0.9573 0.6485 0.8154 -0.1184 0.0237 -0.0586 160 SER D CA 8688 C C . SER D 81 ? 0.9638 0.6689 0.8335 -0.1061 0.0194 -0.0491 160 SER D C 8689 O O . SER D 81 ? 0.8874 0.5996 0.7597 -0.0956 0.0162 -0.0459 160 SER D O 8690 C CB . SER D 81 ? 0.9060 0.6160 0.7649 -0.1314 0.0160 -0.0630 160 SER D CB 8691 O OG . SER D 81 ? 0.8206 0.5522 0.6848 -0.1261 0.0069 -0.0602 160 SER D OG 8692 N N . VAL D 82 ? 0.9381 0.6465 0.8144 -0.1078 0.0198 -0.0449 161 VAL D N 8693 C CA . VAL D 82 ? 0.8790 0.6017 0.7660 -0.0980 0.0155 -0.0364 161 VAL D CA 8694 C C . VAL D 82 ? 0.8879 0.6279 0.7822 -0.1063 0.0102 -0.0351 161 VAL D C 8695 O O . VAL D 82 ? 0.9502 0.6884 0.8414 -0.1194 0.0114 -0.0403 161 VAL D O 8696 C CB . VAL D 82 ? 0.9851 0.6928 0.8731 -0.0886 0.0228 -0.0307 161 VAL D CB 8697 C CG1 . VAL D 82 ? 0.9737 0.6691 0.8568 -0.0776 0.0271 -0.0302 161 VAL D CG1 8698 C CG2 . VAL D 82 ? 0.8351 0.5251 0.7186 -0.0975 0.0308 -0.0330 161 VAL D CG2 8699 N N . LYS D 83 ? 0.9137 0.6708 0.8176 -0.0992 0.0047 -0.0284 162 LYS D N 8700 C CA . LYS D 83 ? 0.8922 0.6651 0.8040 -0.1055 0.0009 -0.0260 162 LYS D CA 8701 C C . LYS D 83 ? 0.9636 0.7220 0.8752 -0.1084 0.0085 -0.0245 162 LYS D C 8702 O O . LYS D 83 ? 0.8177 0.5625 0.7284 -0.0990 0.0139 -0.0204 162 LYS D O 8703 C CB . LYS D 83 ? 0.8534 0.6450 0.7746 -0.0958 -0.0054 -0.0189 162 LYS D CB 8704 C CG . LYS D 83 ? 0.8258 0.6379 0.7552 -0.1020 -0.0108 -0.0169 162 LYS D CG 8705 C CD . LYS D 83 ? 0.8094 0.6352 0.7475 -0.0917 -0.0146 -0.0094 162 LYS D CD 8706 C CE . LYS D 83 ? 1.0317 0.8796 0.9779 -0.0971 -0.0202 -0.0074 162 LYS D CE 8707 N NZ . LYS D 83 ? 1.1027 0.9602 1.0575 -0.0889 -0.0213 0.0001 162 LYS D NZ 8708 N N . LEU D 84 ? 0.9263 0.6877 0.8386 -0.1215 0.0091 -0.0277 163 LEU D N 8709 C CA . LEU D 84 ? 0.9396 0.6892 0.8526 -0.1255 0.0161 -0.0258 163 LEU D CA 8710 C C . LEU D 84 ? 0.9865 0.7417 0.9076 -0.1137 0.0158 -0.0166 163 LEU D C 8711 O O . LEU D 84 ? 0.8905 0.6672 0.8205 -0.1112 0.0090 -0.0126 163 LEU D O 8712 C CB . LEU D 84 ? 0.8312 0.5906 0.7465 -0.1413 0.0147 -0.0297 163 LEU D CB 8713 C CG . LEU D 84 ? 0.8610 0.6044 0.7748 -0.1479 0.0234 -0.0293 163 LEU D CG 8714 C CD1 . LEU D 84 ? 0.8002 0.5127 0.7027 -0.1455 0.0334 -0.0320 163 LEU D CD1 8715 C CD2 . LEU D 84 ? 0.8064 0.5587 0.7213 -0.1656 0.0226 -0.0348 163 LEU D CD2 8716 N N . GLY D 85 ? 0.9312 0.6674 0.8489 -0.1061 0.0233 -0.0133 164 GLY D N 8717 C CA . GLY D 85 ? 1.1840 0.9246 1.1080 -0.0943 0.0232 -0.0048 164 GLY D CA 8718 C C . GLY D 85 ? 1.1880 0.9214 1.1093 -0.0801 0.0243 -0.0018 164 GLY D C 8719 O O . GLY D 85 ? 1.2572 0.9807 1.1781 -0.0714 0.0294 0.0036 164 GLY D O 8720 N N . ASP D 86 ? 0.9952 0.7347 0.9147 -0.0777 0.0195 -0.0050 165 ASP D N 8721 C CA . ASP D 86 ? 0.9750 0.7078 0.8915 -0.0656 0.0208 -0.0031 165 ASP D CA 8722 C C . ASP D 86 ? 0.9388 0.6465 0.8460 -0.0650 0.0301 -0.0057 165 ASP D C 8723 O O . ASP D 86 ? 0.9109 0.6075 0.8117 -0.0753 0.0336 -0.0120 165 ASP D O 8724 C CB . ASP D 86 ? 1.0016 0.7474 0.9184 -0.0642 0.0136 -0.0062 165 ASP D CB 8725 C CG . ASP D 86 ? 1.1534 0.9219 1.0790 -0.0614 0.0055 -0.0023 165 ASP D CG 8726 O OD1 . ASP D 86 ? 1.2697 1.0452 1.2012 -0.0623 0.0050 0.0018 165 ASP D OD1 8727 O OD2 . ASP D 86 ? 1.1598 0.9387 1.0860 -0.0582 0.0000 -0.0034 165 ASP D OD2 8728 N N . PRO D 87 ? 1.0082 0.7069 0.9143 -0.0529 0.0345 -0.0006 166 PRO D N 8729 C CA . PRO D 87 ? 0.9854 0.6607 0.8826 -0.0497 0.0436 -0.0021 166 PRO D CA 8730 C C . PRO D 87 ? 1.0234 0.6966 0.9154 -0.0490 0.0424 -0.0078 166 PRO D C 8731 O O . PRO D 87 ? 0.9585 0.6487 0.8546 -0.0462 0.0347 -0.0081 166 PRO D O 8732 C CB . PRO D 87 ? 1.0537 0.7272 0.9533 -0.0352 0.0464 0.0061 166 PRO D CB 8733 C CG . PRO D 87 ? 0.8990 0.5972 0.8076 -0.0300 0.0369 0.0098 166 PRO D CG 8734 C CD . PRO D 87 ? 0.8038 0.5140 0.7167 -0.0416 0.0317 0.0072 166 PRO D CD 8735 N N . PRO D 88 ? 1.0493 0.7011 0.9320 -0.0515 0.0503 -0.0122 167 PRO D N 8736 C CA . PRO D 88 ? 1.0743 0.7228 0.9514 -0.0500 0.0502 -0.0174 167 PRO D CA 8737 C C . PRO D 88 ? 1.1617 0.8102 1.0397 -0.0347 0.0516 -0.0127 167 PRO D C 8738 O O . PRO D 88 ? 1.1761 0.8085 1.0470 -0.0307 0.0585 -0.0147 167 PRO D O 8739 C CB . PRO D 88 ? 1.1115 0.7357 0.9777 -0.0586 0.0592 -0.0239 167 PRO D CB 8740 C CG . PRO D 88 ? 1.1894 0.8002 1.0551 -0.0600 0.0662 -0.0201 167 PRO D CG 8741 C CD . PRO D 88 ? 1.0888 0.7197 0.9651 -0.0594 0.0592 -0.0143 167 PRO D CD 8742 N N . THR D 89 ? 1.1715 0.8383 1.0581 -0.0266 0.0454 -0.0067 168 THR D N 8743 C CA . THR D 89 ? 1.2184 0.8918 1.1070 -0.0142 0.0441 -0.0035 168 THR D CA 8744 C C . THR D 89 ? 1.3155 0.9988 1.2032 -0.0170 0.0385 -0.0090 168 THR D C 8745 O O . THR D 89 ? 1.1283 0.8244 1.0186 -0.0251 0.0315 -0.0119 168 THR D O 8746 C CB . THR D 89 ? 1.2269 0.9172 1.1244 -0.0058 0.0392 0.0041 168 THR D CB 8747 O OG1 . THR D 89 ? 1.2759 0.9804 1.1790 -0.0133 0.0323 0.0039 168 THR D OG1 8748 C CG2 . THR D 89 ? 1.1655 0.8450 1.0625 0.0022 0.0461 0.0108 168 THR D CG2 8749 N N . PRO D 90 ? 1.5119 1.1897 1.3960 -0.0098 0.0418 -0.0100 169 PRO D N 8750 C CA . PRO D 90 ? 1.5069 1.1921 1.3893 -0.0106 0.0380 -0.0147 169 PRO D CA 8751 C C . PRO D 90 ? 1.4449 1.1522 1.3340 -0.0136 0.0278 -0.0145 169 PRO D C 8752 O O . PRO D 90 ? 1.6525 1.3648 1.5390 -0.0208 0.0237 -0.0197 169 PRO D O 8753 C CB . PRO D 90 ? 1.5665 1.2508 1.4496 0.0025 0.0416 -0.0110 169 PRO D CB 8754 C CG . PRO D 90 ? 1.5971 1.2673 1.4791 0.0093 0.0495 -0.0056 169 PRO D CG 8755 C CD . PRO D 90 ? 1.5997 1.2616 1.4803 -0.0002 0.0509 -0.0064 169 PRO D CD 8756 N N . ASP D 91 ? 1.2117 0.9315 1.1085 -0.0080 0.0240 -0.0083 170 ASP D N 8757 C CA . ASP D 91 ? 1.2543 0.9935 1.1574 -0.0101 0.0153 -0.0072 170 ASP D CA 8758 C C . ASP D 91 ? 1.1777 0.9207 1.0806 -0.0219 0.0114 -0.0106 170 ASP D C 8759 O O . ASP D 91 ? 1.2608 1.0174 1.1659 -0.0253 0.0048 -0.0120 170 ASP D O 8760 C CB . ASP D 91 ? 1.4641 1.2122 1.3742 -0.0026 0.0138 -0.0001 170 ASP D CB 8761 C CG . ASP D 91 ? 1.7263 1.4933 1.6422 -0.0002 0.0063 0.0016 170 ASP D CG 8762 O OD1 . ASP D 91 ? 1.7975 1.5726 1.7139 -0.0069 0.0011 -0.0014 170 ASP D OD1 8763 O OD2 . ASP D 91 ? 1.7856 1.5593 1.7051 0.0084 0.0059 0.0059 170 ASP D OD2 8764 N N . LYS D 92 A 1.0980 0.8293 0.9983 -0.0281 0.0158 -0.0117 170 LYS D N 8765 C CA . LYS D 92 A 1.1246 0.8616 1.0261 -0.0393 0.0122 -0.0140 170 LYS D CA 8766 C C . LYS D 92 A 1.1090 0.8372 1.0025 -0.0500 0.0139 -0.0218 170 LYS D C 8767 O O . LYS D 92 A 0.9159 0.6492 0.8097 -0.0604 0.0111 -0.0246 170 LYS D O 8768 C CB . LYS D 92 A 1.0450 0.7771 0.9494 -0.0406 0.0156 -0.0101 170 LYS D CB 8769 C CG . LYS D 92 A 0.9912 0.7339 0.9033 -0.0318 0.0133 -0.0026 170 LYS D CG 8770 C CD . LYS D 92 A 0.9807 0.7389 0.8995 -0.0372 0.0074 -0.0009 170 LYS D CD 8771 C CE . LYS D 92 A 1.0228 0.7939 0.9486 -0.0281 0.0039 0.0056 170 LYS D CE 8772 N NZ . LYS D 92 A 0.9908 0.7800 0.9227 -0.0317 -0.0032 0.0065 170 LYS D NZ 8773 N N . LEU D 93 ? 1.0351 0.7511 0.9216 -0.0473 0.0184 -0.0253 171 LEU D N 8774 C CA . LEU D 93 ? 0.9860 0.6912 0.8634 -0.0566 0.0212 -0.0331 171 LEU D CA 8775 C C . LEU D 93 ? 1.0498 0.7689 0.9260 -0.0619 0.0139 -0.0372 171 LEU D C 8776 O O . LEU D 93 ? 1.1601 0.8918 1.0400 -0.0553 0.0090 -0.0347 171 LEU D O 8777 C CB . LEU D 93 ? 0.9723 0.6587 0.8424 -0.0504 0.0295 -0.0348 171 LEU D CB 8778 C CG . LEU D 93 ? 1.1707 0.8338 1.0341 -0.0533 0.0393 -0.0365 171 LEU D CG 8779 C CD1 . LEU D 93 ? 1.1309 0.7949 0.9993 -0.0568 0.0395 -0.0326 171 LEU D CD1 8780 C CD2 . LEU D 93 ? 1.2578 0.9078 1.1191 -0.0407 0.0468 -0.0331 171 LEU D CD2 8781 N N . LYS D 94 ? 0.9137 0.6306 0.7843 -0.0741 0.0134 -0.0435 172 LYS D N 8782 C CA . LYS D 94 ? 0.9322 0.6586 0.7987 -0.0797 0.0082 -0.0484 172 LYS D CA 8783 C C . LYS D 94 ? 0.9550 0.6635 0.8094 -0.0867 0.0144 -0.0564 172 LYS D C 8784 O O . LYS D 94 ? 0.9205 0.6180 0.7703 -0.0961 0.0185 -0.0605 172 LYS D O 8785 C CB . LYS D 94 ? 0.8548 0.5993 0.7256 -0.0888 0.0006 -0.0486 172 LYS D CB 8786 C CG . LYS D 94 ? 0.7677 0.5197 0.6322 -0.0967 -0.0039 -0.0544 172 LYS D CG 8787 C CD . LYS D 94 ? 0.9364 0.7077 0.8057 -0.1051 -0.0112 -0.0539 172 LYS D CD 8788 C CE . LYS D 94 ? 1.0771 0.8605 0.9415 -0.1094 -0.0171 -0.0575 172 LYS D CE 8789 N NZ . LYS D 94 ? 1.2260 1.0323 1.0968 -0.1137 -0.0253 -0.0547 172 LYS D NZ 8790 N N . PHE D 95 ? 0.9760 0.6812 0.8252 -0.0822 0.0155 -0.0589 173 PHE D N 8791 C CA . PHE D 95 ? 1.0057 0.6955 0.8427 -0.0888 0.0208 -0.0670 173 PHE D CA 8792 C C . PHE D 95 ? 0.9515 0.6501 0.7842 -0.1031 0.0157 -0.0729 173 PHE D C 8793 O O . PHE D 95 ? 0.9365 0.6559 0.7741 -0.1046 0.0070 -0.0710 173 PHE D O 8794 C CB . PHE D 95 ? 1.0226 0.7115 0.8557 -0.0814 0.0216 -0.0681 173 PHE D CB 8795 C CG . PHE D 95 ? 1.0490 0.7198 0.8692 -0.0864 0.0286 -0.0761 173 PHE D CG 8796 C CD1 . PHE D 95 ? 1.0768 0.7258 0.8923 -0.0807 0.0388 -0.0766 173 PHE D CD1 8797 C CD2 . PHE D 95 ? 1.0502 0.7255 0.8625 -0.0966 0.0252 -0.0829 173 PHE D CD2 8798 C CE1 . PHE D 95 ? 1.0675 0.6983 0.8705 -0.0850 0.0461 -0.0841 173 PHE D CE1 8799 C CE2 . PHE D 95 ? 1.1142 0.7720 0.9136 -0.1016 0.0320 -0.0908 173 PHE D CE2 8800 C CZ . PHE D 95 ? 1.1450 0.7799 0.9398 -0.0958 0.0427 -0.0916 173 PHE D CZ 8801 N N . GLU D 96 ? 0.8359 0.5192 0.6594 -0.1137 0.0213 -0.0799 174 GLU D N 8802 C CA . GLU D 96 ? 0.9862 0.6786 0.8055 -0.1285 0.0166 -0.0860 174 GLU D CA 8803 C C . GLU D 96 ? 1.0365 0.7189 0.8419 -0.1359 0.0196 -0.0952 174 GLU D C 8804 O O . GLU D 96 ? 1.0738 0.7713 0.8764 -0.1424 0.0128 -0.0983 174 GLU D O 8805 C CB . GLU D 96 ? 0.9813 0.6697 0.8026 -0.1380 0.0188 -0.0868 174 GLU D CB 8806 C CG . GLU D 96 ? 0.9694 0.6742 0.8045 -0.1334 0.0135 -0.0784 174 GLU D CG 8807 C CD . GLU D 96 ? 1.0971 0.8297 0.9383 -0.1377 0.0024 -0.0767 174 GLU D CD 8808 O OE1 . GLU D 96 ? 1.2564 0.9962 1.0910 -0.1452 -0.0013 -0.0823 174 GLU D OE1 8809 O OE2 . GLU D 96 ? 1.0429 0.7903 0.8952 -0.1332 -0.0023 -0.0697 174 GLU D OE2 8810 N N . ALA D 97 ? 0.9450 0.6020 0.7414 -0.1345 0.0299 -0.0993 175 ALA D N 8811 C CA . ALA D 97 ? 0.9594 0.6036 0.7416 -0.1409 0.0344 -0.1083 175 ALA D CA 8812 C C . ALA D 97 ? 0.9628 0.5789 0.7381 -0.1340 0.0466 -0.1097 175 ALA D C 8813 O O . ALA D 97 ? 0.9828 0.5896 0.7638 -0.1264 0.0515 -0.1041 175 ALA D O 8814 C CB . ALA D 97 ? 0.9188 0.5628 0.6929 -0.1592 0.0335 -0.1169 175 ALA D CB 8815 N N . VAL D 98 ? 0.9880 0.5909 0.7508 -0.1364 0.0518 -0.1169 176 VAL D N 8816 C CA . VAL D 98 ? 1.0157 0.5894 0.7694 -0.1320 0.0648 -0.1198 176 VAL D CA 8817 C C . VAL D 98 ? 1.0672 0.6223 0.8101 -0.1472 0.0713 -0.1283 176 VAL D C 8818 O O . VAL D 98 ? 1.0997 0.6613 0.8356 -0.1614 0.0672 -0.1359 176 VAL D O 8819 C CB . VAL D 98 ? 1.1764 0.7447 0.9213 -0.1271 0.0678 -0.1238 176 VAL D CB 8820 C CG1 . VAL D 98 ? 1.0368 0.5754 0.7729 -0.1208 0.0817 -0.1261 176 VAL D CG1 8821 C CG2 . VAL D 98 ? 1.1267 0.7160 0.8822 -0.1145 0.0604 -0.1162 176 VAL D CG2 8822 N N . GLY D 99 ? 1.1708 0.7033 0.9122 -0.1446 0.0814 -0.1270 177 GLY D N 8823 C CA . GLY D 99 ? 1.2649 0.7776 0.9957 -0.1593 0.0886 -0.1349 177 GLY D CA 8824 C C . GLY D 99 ? 1.2968 0.7894 1.0294 -0.1568 0.0977 -0.1310 177 GLY D C 8825 O O . GLY D 99 ? 1.3877 0.8840 1.1312 -0.1433 0.0975 -0.1211 177 GLY D O 8826 N N . TRP D 100 ? 1.1878 0.6589 0.9090 -0.1704 0.1059 -0.1391 178 TRP D N 8827 C CA . TRP D 100 ? 1.2897 0.7378 1.0100 -0.1696 0.1163 -0.1364 178 TRP D CA 8828 C C . TRP D 100 ? 1.3102 0.7623 1.0310 -0.1875 0.1140 -0.1404 178 TRP D C 8829 O O . TRP D 100 ? 1.3602 0.7929 1.0790 -0.1903 0.1226 -0.1395 178 TRP D O 8830 C CB . TRP D 100 ? 1.3826 0.7938 1.0870 -0.1678 0.1320 -0.1420 178 TRP D CB 8831 C CG . TRP D 100 ? 1.2914 0.6920 0.9798 -0.1843 0.1349 -0.1555 178 TRP D CG 8832 C CD1 . TRP D 100 ? 1.1781 0.5720 0.8585 -0.2044 0.1366 -0.1645 178 TRP D CD1 8833 C CD2 . TRP D 100 ? 1.3529 0.7495 1.0313 -0.1825 0.1364 -0.1616 178 TRP D CD2 8834 N NE1 . TRP D 100 ? 1.2154 0.6012 0.8808 -0.2153 0.1389 -0.1762 178 TRP D NE1 8835 C CE2 . TRP D 100 ? 1.4130 0.7999 1.0767 -0.2020 0.1389 -0.1746 178 TRP D CE2 8836 C CE3 . TRP D 100 ? 1.2472 0.6480 0.9275 -0.1666 0.1360 -0.1576 178 TRP D CE3 8837 C CZ2 . TRP D 100 ? 1.3829 0.7636 1.0333 -0.2057 0.1411 -0.1835 178 TRP D CZ2 8838 C CZ3 . TRP D 100 ? 1.3019 0.6963 0.9695 -0.1702 0.1385 -0.1662 178 TRP D CZ3 8839 C CH2 . TRP D 100 ? 1.3564 0.7405 1.0089 -0.1894 0.1410 -0.1790 178 TRP D CH2 8840 N N . SER D 101 ? 1.2918 0.7694 1.0151 -0.1995 0.1026 -0.1447 179 SER D N 8841 C CA . SER D 101 ? 1.2742 0.7597 0.9979 -0.2180 0.0994 -0.1495 179 SER D CA 8842 C C . SER D 101 ? 1.1779 0.7023 0.9128 -0.2215 0.0834 -0.1472 179 SER D C 8843 O O . SER D 101 ? 1.1459 0.6837 0.8783 -0.2203 0.0770 -0.1497 179 SER D O 8844 C CB . SER D 101 ? 1.2870 0.7520 0.9928 -0.2355 0.1069 -0.1631 179 SER D CB 8845 O OG . SER D 101 ? 1.2987 0.7727 1.0047 -0.2547 0.1038 -0.1684 179 SER D OG 8846 N N . ALA D 102 ? 1.1946 0.7369 0.9416 -0.2253 0.0773 -0.1421 180 ALA D N 8847 C CA . ALA D 102 ? 1.1254 0.7046 0.8841 -0.2256 0.0626 -0.1381 180 ALA D CA 8848 C C . ALA D 102 ? 1.1638 0.7628 0.9311 -0.2382 0.0565 -0.1376 180 ALA D C 8849 O O . ALA D 102 ? 1.2759 0.8660 1.0477 -0.2396 0.0615 -0.1343 180 ALA D O 8850 C CB . ALA D 102 ? 0.9846 0.5765 0.7555 -0.2055 0.0575 -0.1268 180 ALA D CB 8851 N N . SER D 103 ? 1.1291 0.7559 0.8987 -0.2469 0.0456 -0.1404 181 SER D N 8852 C CA . SER D 103 ? 1.0943 0.7474 0.8745 -0.2565 0.0374 -0.1384 181 SER D CA 8853 C C . SER D 103 ? 1.0928 0.7784 0.8846 -0.2468 0.0245 -0.1309 181 SER D C 8854 O O . SER D 103 ? 1.1059 0.7977 0.8930 -0.2425 0.0204 -0.1324 181 SER D O 8855 C CB . SER D 103 ? 1.1060 0.7634 0.8769 -0.2784 0.0366 -0.1497 181 SER D CB 8856 O OG . SER D 103 ? 1.1480 0.8361 0.9299 -0.2871 0.0272 -0.1475 181 SER D OG 8857 N N . SER D 104 ? 1.0147 0.7205 0.8211 -0.2432 0.0186 -0.1227 182 SER D N 8858 C CA . SER D 104 ? 0.9924 0.7293 0.8089 -0.2355 0.0066 -0.1162 182 SER D CA 8859 C C . SER D 104 ? 0.9572 0.7226 0.7849 -0.2438 -0.0013 -0.1134 182 SER D C 8860 O O . SER D 104 ? 0.9866 0.7482 0.8157 -0.2549 0.0025 -0.1158 182 SER D O 8861 C CB . SER D 104 ? 0.9725 0.7074 0.7969 -0.2152 0.0063 -0.1063 182 SER D CB 8862 O OG . SER D 104 ? 0.9441 0.6744 0.7778 -0.2099 0.0097 -0.0995 182 SER D OG 8863 N N . CYS D 105 ? 0.9408 0.7346 0.7762 -0.2382 -0.0119 -0.1083 183 CYS D N 8864 C CA . CYS D 105 ? 0.9621 0.7868 0.8088 -0.2440 -0.0204 -0.1046 183 CYS D CA 8865 C C . CYS D 105 ? 1.0472 0.8983 0.9001 -0.2342 -0.0308 -0.0984 183 CYS D C 8866 O O . CYS D 105 ? 1.0887 0.9367 0.9341 -0.2289 -0.0324 -0.1000 183 CYS D O 8867 C CB . CYS D 105 ? 1.0061 0.8390 0.8471 -0.2648 -0.0213 -0.1138 183 CYS D CB 8868 S SG . CYS D 105 ? 1.0975 0.9259 0.9207 -0.2751 -0.0222 -0.1254 183 CYS D SG 8869 N N . HIS D 106 ? 0.9952 0.8718 0.8614 -0.2319 -0.0374 -0.0912 184 HIS D N 8870 C CA . HIS D 106 ? 0.9582 0.8585 0.8316 -0.2207 -0.0463 -0.0836 184 HIS D CA 8871 C C . HIS D 106 ? 0.9978 0.9305 0.8757 -0.2307 -0.0551 -0.0839 184 HIS D C 8872 O O . HIS D 106 ? 1.0308 0.9731 0.9142 -0.2415 -0.0550 -0.0852 184 HIS D O 8873 C CB . HIS D 106 ? 0.9419 0.8434 0.8276 -0.2063 -0.0459 -0.0734 184 HIS D CB 8874 C CG . HIS D 106 ? 0.9578 0.8730 0.8482 -0.1919 -0.0521 -0.0659 184 HIS D CG 8875 N ND1 . HIS D 106 ? 0.9410 0.8858 0.8396 -0.1903 -0.0606 -0.0606 184 HIS D ND1 8876 C CD2 . HIS D 106 ? 0.8164 0.7196 0.7042 -0.1786 -0.0506 -0.0630 184 HIS D CD2 8877 C CE1 . HIS D 106 ? 0.9443 0.8928 0.8443 -0.1767 -0.0637 -0.0547 184 HIS D CE1 8878 N NE2 . HIS D 106 ? 0.8680 0.7920 0.7618 -0.1698 -0.0579 -0.0562 184 HIS D NE2 8879 N N . ASP D 107 ? 0.9786 0.9286 0.8541 -0.2271 -0.0624 -0.0826 185 ASP D N 8880 C CA . ASP D 107 ? 0.9648 0.9459 0.8423 -0.2369 -0.0708 -0.0835 185 ASP D CA 8881 C C . ASP D 107 ? 0.9665 0.9756 0.8571 -0.2260 -0.0785 -0.0727 185 ASP D C 8882 O O . ASP D 107 ? 0.9325 0.9700 0.8257 -0.2306 -0.0862 -0.0714 185 ASP D O 8883 C CB . ASP D 107 ? 0.8789 0.8610 0.7427 -0.2422 -0.0736 -0.0903 185 ASP D CB 8884 C CG . ASP D 107 ? 1.0244 1.0006 0.8847 -0.2266 -0.0749 -0.0857 185 ASP D CG 8885 O OD1 . ASP D 107 ? 1.1024 1.0734 0.9707 -0.2120 -0.0736 -0.0776 185 ASP D OD1 8886 O OD2 . ASP D 107 ? 1.0304 1.0069 0.8796 -0.2294 -0.0769 -0.0903 185 ASP D OD2 8887 N N . GLY D 108 ? 1.0119 1.0128 0.9103 -0.2114 -0.0762 -0.0648 186 GLY D N 8888 C CA . GLY D 108 ? 0.9856 1.0081 0.8950 -0.1988 -0.0821 -0.0543 186 GLY D CA 8889 C C . GLY D 108 ? 0.9820 0.9987 0.8871 -0.1848 -0.0835 -0.0504 186 GLY D C 8890 O O . GLY D 108 ? 0.9248 0.9497 0.8378 -0.1717 -0.0858 -0.0417 186 GLY D O 8891 N N . PHE D 109 ? 1.0770 1.0790 0.9692 -0.1877 -0.0817 -0.0571 187 PHE D N 8892 C CA . PHE D 109 ? 1.0512 1.0481 0.9381 -0.1760 -0.0828 -0.0542 187 PHE D CA 8893 C C . PHE D 109 ? 1.0632 1.0289 0.9439 -0.1704 -0.0750 -0.0572 187 PHE D C 8894 O O . PHE D 109 ? 0.9029 0.8616 0.7860 -0.1570 -0.0739 -0.0517 187 PHE D O 8895 C CB . PHE D 109 ? 0.9317 0.9395 0.8081 -0.1828 -0.0876 -0.0589 187 PHE D CB 8896 C CG . PHE D 109 ? 1.0158 1.0564 0.8973 -0.1884 -0.0958 -0.0561 187 PHE D CG 8897 C CD1 . PHE D 109 ? 0.9362 0.9975 0.8268 -0.1772 -0.1012 -0.0459 187 PHE D CD1 8898 C CD2 . PHE D 109 ? 1.0382 1.0892 0.9150 -0.2050 -0.0978 -0.0637 187 PHE D CD2 8899 C CE1 . PHE D 109 ? 1.0296 1.1226 0.9252 -0.1814 -0.1087 -0.0426 187 PHE D CE1 8900 C CE2 . PHE D 109 ? 0.9821 1.0658 0.8639 -0.2103 -0.1057 -0.0609 187 PHE D CE2 8901 C CZ . PHE D 109 ? 1.0586 1.1639 0.9501 -0.1980 -0.1112 -0.0500 187 PHE D CZ 8902 N N . GLN D 110 ? 1.1026 1.0499 0.9751 -0.1808 -0.0693 -0.0659 188 GLN D N 8903 C CA . GLN D 110 ? 0.9379 0.8564 0.8023 -0.1764 -0.0618 -0.0697 188 GLN D CA 8904 C C . GLN D 110 ? 0.9523 0.8501 0.8121 -0.1866 -0.0541 -0.0770 188 GLN D C 8905 O O . GLN D 110 ? 0.9943 0.8985 0.8523 -0.2007 -0.0547 -0.0823 188 GLN D O 8906 C CB . GLN D 110 ? 0.8985 0.8148 0.7509 -0.1768 -0.0632 -0.0741 188 GLN D CB 8907 C CG . GLN D 110 ? 1.0588 0.9623 0.9092 -0.1629 -0.0608 -0.0706 188 GLN D CG 8908 C CD . GLN D 110 ? 1.0090 0.9296 0.8680 -0.1508 -0.0665 -0.0610 188 GLN D CD 8909 O OE1 . GLN D 110 ? 1.1061 1.0500 0.9690 -0.1525 -0.0734 -0.0575 188 GLN D OE1 8910 N NE2 . GLN D 110 ? 0.7968 0.7058 0.6583 -0.1384 -0.0634 -0.0567 188 GLN D NE2 8911 N N . TRP D 111 ? 0.8594 0.7323 0.7172 -0.1792 -0.0465 -0.0769 189 TRP D N 8912 C CA . TRP D 111 ? 0.8213 0.6700 0.6722 -0.1871 -0.0378 -0.0839 189 TRP D CA 8913 C C . TRP D 111 ? 0.9210 0.7588 0.7569 -0.1961 -0.0354 -0.0936 189 TRP D C 8914 O O . TRP D 111 ? 0.8650 0.6970 0.6943 -0.1895 -0.0352 -0.0945 189 TRP D O 8915 C CB . TRP D 111 ? 0.7716 0.5979 0.6244 -0.1752 -0.0303 -0.0803 189 TRP D CB 8916 C CG . TRP D 111 ? 0.9306 0.7624 0.7960 -0.1700 -0.0304 -0.0728 189 TRP D CG 8917 C CD1 . TRP D 111 ? 0.9086 0.7503 0.7838 -0.1569 -0.0338 -0.0640 189 TRP D CD1 8918 C CD2 . TRP D 111 ? 0.8815 0.7089 0.7505 -0.1782 -0.0266 -0.0737 189 TRP D CD2 8919 N NE1 . TRP D 111 ? 0.8632 0.7075 0.7479 -0.1561 -0.0325 -0.0593 189 TRP D NE1 8920 C CE2 . TRP D 111 ? 0.7265 0.5623 0.6077 -0.1689 -0.0281 -0.0648 189 TRP D CE2 8921 C CE3 . TRP D 111 ? 0.9392 0.7559 0.8018 -0.1929 -0.0216 -0.0813 189 TRP D CE3 8922 C CZ2 . TRP D 111 ? 0.6934 0.5277 0.5809 -0.1733 -0.0249 -0.0630 189 TRP D CZ2 8923 C CZ3 . TRP D 111 ? 0.8991 0.7140 0.7680 -0.1977 -0.0184 -0.0795 189 TRP D CZ3 8924 C CH2 . TRP D 111 ? 0.8414 0.6654 0.7229 -0.1877 -0.0201 -0.0702 189 TRP D CH2 8925 N N . THR D 112 ? 0.8690 0.7046 0.6995 -0.2118 -0.0334 -0.1012 190 THR D N 8926 C CA . THR D 112 ? 1.0294 0.8493 0.8445 -0.2220 -0.0289 -0.1117 190 THR D CA 8927 C C . THR D 112 ? 1.0702 0.8572 0.8800 -0.2218 -0.0171 -0.1152 190 THR D C 8928 O O . THR D 112 ? 1.0668 0.8481 0.8823 -0.2253 -0.0133 -0.1139 190 THR D O 8929 C CB . THR D 112 ? 0.9781 0.8136 0.7894 -0.2402 -0.0330 -0.1186 190 THR D CB 8930 O OG1 . THR D 112 ? 1.0606 0.9297 0.8813 -0.2386 -0.0439 -0.1124 190 THR D OG1 8931 C CG2 . THR D 112 ? 0.9652 0.7905 0.7600 -0.2497 -0.0307 -0.1290 190 THR D CG2 8932 N N . VAL D 113 ? 1.0188 0.7843 0.8182 -0.2169 -0.0109 -0.1190 191 VAL D N 8933 C CA . VAL D 113 ? 1.0287 0.7623 0.8224 -0.2150 0.0009 -0.1218 191 VAL D CA 8934 C C . VAL D 113 ? 1.0849 0.7974 0.8614 -0.2240 0.0079 -0.1328 191 VAL D C 8935 O O . VAL D 113 ? 1.2269 0.9386 0.9961 -0.2199 0.0069 -0.1350 191 VAL D O 8936 C CB . VAL D 113 ? 0.9461 0.6695 0.7460 -0.1960 0.0042 -0.1135 191 VAL D CB 8937 C CG1 . VAL D 113 ? 0.8921 0.5826 0.6842 -0.1933 0.0167 -0.1165 191 VAL D CG1 8938 C CG2 . VAL D 113 ? 0.9359 0.6745 0.7516 -0.1882 -0.0003 -0.1034 191 VAL D CG2 8939 N N . LEU D 114 ? 1.0402 0.7349 0.8097 -0.2365 0.0155 -0.1398 192 LEU D N 8940 C CA . LEU D 114 ? 1.1243 0.7944 0.8765 -0.2454 0.0241 -0.1507 192 LEU D CA 8941 C C . LEU D 114 ? 1.1615 0.7983 0.9094 -0.2357 0.0367 -0.1498 192 LEU D C 8942 O O . LEU D 114 ? 1.1081 0.7337 0.8617 -0.2337 0.0421 -0.1460 192 LEU D O 8943 C CB . LEU D 114 ? 1.1029 0.7725 0.8479 -0.2667 0.0254 -0.1603 192 LEU D CB 8944 C CG . LEU D 114 ? 1.1024 0.8051 0.8491 -0.2778 0.0134 -0.1627 192 LEU D CG 8945 C CD1 . LEU D 114 ? 0.9570 0.6848 0.7196 -0.2798 0.0060 -0.1557 192 LEU D CD1 8946 C CD2 . LEU D 114 ? 1.1070 0.8031 0.8379 -0.2978 0.0161 -0.1761 192 LEU D CD2 8947 N N . SER D 115 ? 1.1577 0.7793 0.8957 -0.2294 0.0416 -0.1531 193 SER D N 8948 C CA . SER D 115 ? 1.0673 0.6596 0.8015 -0.2179 0.0532 -0.1513 193 SER D CA 8949 C C . SER D 115 ? 1.1477 0.7143 0.8634 -0.2238 0.0628 -0.1620 193 SER D C 8950 O O . SER D 115 ? 1.1287 0.7026 0.8367 -0.2263 0.0592 -0.1669 193 SER D O 8951 C CB . SER D 115 ? 1.0984 0.6999 0.8426 -0.1982 0.0496 -0.1413 193 SER D CB 8952 O OG . SER D 115 ? 1.2822 0.8588 1.0248 -0.1860 0.0602 -0.1383 193 SER D OG 8953 N N . VAL D 116 ? 1.1296 0.6656 0.8376 -0.2262 0.0755 -0.1655 194 VAL D N 8954 C CA . VAL D 116 ? 1.0532 0.5602 0.7437 -0.2295 0.0869 -0.1747 194 VAL D CA 8955 C C . VAL D 116 ? 1.1415 0.6353 0.8328 -0.2097 0.0929 -0.1688 194 VAL D C 8956 O O . VAL D 116 ? 1.2197 0.7058 0.9196 -0.1969 0.0970 -0.1602 194 VAL D O 8957 C CB . VAL D 116 ? 1.0855 0.5629 0.7667 -0.2404 0.0992 -0.1808 194 VAL D CB 8958 C CG1 . VAL D 116 ? 1.0245 0.4731 0.6854 -0.2472 0.1104 -0.1924 194 VAL D CG1 8959 C CG2 . VAL D 116 ? 1.1714 0.6641 0.8559 -0.2585 0.0931 -0.1843 194 VAL D CG2 8960 N N . ALA D 117 ? 1.2271 0.7190 0.9094 -0.2073 0.0935 -0.1734 195 ALA D N 8961 C CA . ALA D 117 ? 1.2111 0.6947 0.8949 -0.1889 0.0982 -0.1679 195 ALA D CA 8962 C C . ALA D 117 ? 1.2983 0.7628 0.9647 -0.1919 0.1062 -0.1775 195 ALA D C 8963 O O . ALA D 117 ? 1.2889 0.7477 0.9423 -0.2085 0.1074 -0.1883 195 ALA D O 8964 C CB . ALA D 117 ? 1.2624 0.7768 0.9600 -0.1782 0.0858 -0.1592 195 ALA D CB 8965 N N . GLY D 118 ? 1.2798 0.7350 0.9459 -0.1760 0.1119 -0.1737 196 GLY D N 8966 C CA . GLY D 118 ? 1.2573 0.6943 0.9077 -0.1762 0.1202 -0.1817 196 GLY D CA 8967 C C . GLY D 118 ? 1.3753 0.7772 1.0098 -0.1851 0.1346 -0.1907 196 GLY D C 8968 O O . GLY D 118 ? 1.4496 0.8298 1.0852 -0.1775 0.1447 -0.1868 196 GLY D O 8969 N N . ASP D 119 ? 1.4795 0.8754 1.0985 -0.2014 0.1357 -0.2029 200 ASP D N 8970 C CA . ASP D 119 ? 1.5677 0.9291 1.1692 -0.2119 0.1496 -0.2131 200 ASP D CA 8971 C C . ASP D 119 ? 1.6588 1.0213 1.2603 -0.2296 0.1476 -0.2171 200 ASP D C 8972 O O . ASP D 119 ? 1.7511 1.0962 1.3459 -0.2355 0.1573 -0.2206 200 ASP D O 8973 C CB . ASP D 119 ? 1.6157 0.9711 1.2009 -0.2183 0.1531 -0.2233 200 ASP D CB 8974 C CG . ASP D 119 ? 1.6667 1.0480 1.2484 -0.2349 0.1403 -0.2302 200 ASP D CG 8975 O OD1 . ASP D 119 ? 1.5507 0.9610 1.1454 -0.2355 0.1269 -0.2245 200 ASP D OD1 8976 O OD2 . ASP D 119 ? 1.7807 1.1600 1.3503 -0.2448 0.1429 -0.2385 200 ASP D OD2 8977 N N . GLY D 120 ? 1.5484 0.9420 1.1632 -0.2342 0.1335 -0.2125 201 GLY D N 8978 C CA . GLY D 120 ? 1.5067 0.9052 1.1230 -0.2510 0.1304 -0.2159 201 GLY D CA 8979 C C . GLY D 120 ? 1.3939 0.8248 1.0119 -0.2660 0.1161 -0.2202 201 GLY D C 8980 O O . GLY D 120 ? 1.3514 0.7845 0.9647 -0.2842 0.1150 -0.2273 201 GLY D O 8981 N N . PHE D 121 ? 1.2739 0.7317 0.8990 -0.2578 0.1051 -0.2154 202 PHE D N 8982 C CA . PHE D 121 ? 1.2818 0.7742 0.9115 -0.2686 0.0903 -0.2165 202 PHE D CA 8983 C C . PHE D 121 ? 1.2452 0.7638 0.8959 -0.2608 0.0800 -0.2042 202 PHE D C 8984 O O . PHE D 121 ? 1.3466 0.8614 1.0083 -0.2439 0.0821 -0.1942 202 PHE D O 8985 C CB . PHE D 121 ? 1.3833 0.8900 1.0076 -0.2647 0.0843 -0.2181 202 PHE D CB 8986 C CG . PHE D 121 ? 1.2157 0.7306 0.8516 -0.2433 0.0817 -0.2069 202 PHE D CG 8987 C CD1 . PHE D 121 ? 1.2182 0.7081 0.8497 -0.2297 0.0930 -0.2056 202 PHE D CD1 8988 C CD2 . PHE D 121 ? 1.0926 0.6403 0.7437 -0.2368 0.0683 -0.1976 202 PHE D CD2 8989 C CE1 . PHE D 121 ? 1.2782 0.7770 0.9206 -0.2110 0.0906 -0.1956 202 PHE D CE1 8990 C CE2 . PHE D 121 ? 1.1965 0.7511 0.8577 -0.2183 0.0663 -0.1880 202 PHE D CE2 8991 C CZ . PHE D 121 ? 1.2891 0.8199 0.9461 -0.2057 0.0772 -0.1871 202 PHE D CZ 8992 N N . VAL D 122 ? 1.2629 0.8086 0.9194 -0.2729 0.0690 -0.2048 203 VAL D N 8993 C CA . VAL D 122 ? 1.3126 0.8845 0.9888 -0.2653 0.0589 -0.1932 203 VAL D CA 8994 C C . VAL D 122 ? 1.1573 0.7597 0.8408 -0.2572 0.0464 -0.1873 203 VAL D C 8995 O O . VAL D 122 ? 1.1551 0.7725 0.8311 -0.2666 0.0402 -0.1931 203 VAL D O 8996 C CB . VAL D 122 ? 1.1590 0.7430 0.8411 -0.2804 0.0550 -0.1945 203 VAL D CB 8997 C CG1 . VAL D 122 ? 1.2559 0.8324 0.9221 -0.3024 0.0581 -0.2084 203 VAL D CG1 8998 C CG2 . VAL D 122 ? 1.0183 0.6410 0.7164 -0.2779 0.0402 -0.1861 203 VAL D CG2 8999 N N . SER D 123 ? 1.0834 0.6941 0.7810 -0.2398 0.0433 -0.1758 204 SER D N 9000 C CA . SER D 123 ? 1.1354 0.7745 0.8414 -0.2314 0.0318 -0.1689 204 SER D CA 9001 C C . SER D 123 ? 1.1905 0.8567 0.9122 -0.2325 0.0217 -0.1614 204 SER D C 9002 O O . SER D 123 ? 1.1876 0.8481 0.9181 -0.2304 0.0246 -0.1569 204 SER D O 9003 C CB . SER D 123 ? 1.2008 0.8328 0.9118 -0.2119 0.0349 -0.1615 204 SER D CB 9004 O OG . SER D 123 ? 1.4342 1.0348 1.1349 -0.2085 0.0477 -0.1661 204 SER D OG 9005 N N . ILE D 124 ? 1.1951 0.8903 0.9198 -0.2357 0.0103 -0.1598 205 ILE D N 9006 C CA . ILE D 124 ? 1.1449 0.8673 0.8843 -0.2366 0.0007 -0.1526 205 ILE D CA 9007 C C . ILE D 124 ? 1.0308 0.7728 0.7819 -0.2211 -0.0071 -0.1418 205 ILE D C 9008 O O . ILE D 124 ? 1.1425 0.8971 0.8895 -0.2188 -0.0125 -0.1417 205 ILE D O 9009 C CB . ILE D 124 ? 1.1198 0.8640 0.8553 -0.2536 -0.0069 -0.1584 205 ILE D CB 9010 C CG1 . ILE D 124 ? 1.0755 0.8020 0.8006 -0.2710 0.0005 -0.1693 205 ILE D CG1 9011 C CG2 . ILE D 124 ? 1.1255 0.8997 0.8771 -0.2523 -0.0169 -0.1498 205 ILE D CG2 9012 C CD1 . ILE D 124 ? 1.1069 0.8568 0.8294 -0.2889 -0.0071 -0.1750 205 ILE D CD1 9013 N N . LEU D 125 ? 1.0471 0.7914 0.8121 -0.2109 -0.0074 -0.1328 206 LEU D N 9014 C CA . LEU D 125 ? 1.0363 0.7964 0.8123 -0.1959 -0.0136 -0.1226 206 LEU D CA 9015 C C . LEU D 125 ? 0.9686 0.7562 0.7576 -0.1969 -0.0230 -0.1159 206 LEU D C 9016 O O . LEU D 125 ? 1.0473 0.8359 0.8426 -0.2023 -0.0221 -0.1150 206 LEU D O 9017 C CB . LEU D 125 ? 1.0589 0.8012 0.8403 -0.1812 -0.0068 -0.1170 206 LEU D CB 9018 C CG . LEU D 125 ? 1.1101 0.8280 0.8806 -0.1763 0.0021 -0.1217 206 LEU D CG 9019 C CD1 . LEU D 125 ? 1.0875 0.7793 0.8489 -0.1847 0.0124 -0.1292 206 LEU D CD1 9020 C CD2 . LEU D 125 ? 1.0077 0.7206 0.7857 -0.1590 0.0045 -0.1139 206 LEU D CD2 9021 N N . TYR D 126 ? 0.8924 0.7017 0.6849 -0.1914 -0.0314 -0.1108 207 TYR D N 9022 C CA . TYR D 126 ? 0.9466 0.7837 0.7506 -0.1916 -0.0405 -0.1042 207 TYR D CA 9023 C C . TYR D 126 ? 1.0143 0.8605 0.8271 -0.1756 -0.0443 -0.0944 207 TYR D C 9024 O O . TYR D 126 ? 1.0810 0.9315 0.8889 -0.1704 -0.0468 -0.0935 207 TYR D O 9025 C CB . TYR D 126 ? 0.9668 0.8240 0.7644 -0.2034 -0.0475 -0.1087 207 TYR D CB 9026 C CG . TYR D 126 ? 0.9236 0.8105 0.7324 -0.2055 -0.0565 -0.1026 207 TYR D CG 9027 C CD1 . TYR D 126 ? 0.9342 0.8271 0.7487 -0.2155 -0.0566 -0.1040 207 TYR D CD1 9028 C CD2 . TYR D 126 ? 1.0118 0.9207 0.8249 -0.1975 -0.0644 -0.0955 207 TYR D CD2 9029 C CE1 . TYR D 126 ? 1.0456 0.9672 0.8709 -0.2171 -0.0646 -0.0983 207 TYR D CE1 9030 C CE2 . TYR D 126 ? 1.0243 0.9607 0.8474 -0.1985 -0.0722 -0.0895 207 TYR D CE2 9031 C CZ . TYR D 126 ? 1.0036 0.9471 0.8332 -0.2082 -0.0724 -0.0909 207 TYR D CZ 9032 O OH . TYR D 126 ? 0.9883 0.9602 0.8285 -0.2086 -0.0799 -0.0847 207 TYR D OH 9033 N N . GLY D 127 ? 1.1717 1.0205 0.9970 -0.1682 -0.0443 -0.0871 208 GLY D N 9034 C CA . GLY D 127 ? 1.2389 1.0848 1.0705 -0.1528 -0.0437 -0.0797 208 GLY D CA 9035 C C . GLY D 127 ? 1.3321 1.1507 1.1571 -0.1499 -0.0344 -0.0839 208 GLY D C 9036 O O . GLY D 127 ? 1.5758 1.3795 1.3985 -0.1563 -0.0284 -0.0883 208 GLY D O 9037 N N . GLY D 128 ? 1.1378 0.9497 0.9598 -0.1404 -0.0327 -0.0826 209 GLY D N 9038 C CA . GLY D 128 ? 1.1442 0.9318 0.9581 -0.1384 -0.0238 -0.0875 209 GLY D CA 9039 C C . GLY D 128 ? 1.0339 0.8191 0.8355 -0.1417 -0.0237 -0.0934 209 GLY D C 9040 O O . GLY D 128 ? 1.0922 0.8647 0.8893 -0.1346 -0.0188 -0.0943 209 GLY D O 9041 N N . ILE D 129 ? 0.8970 0.6955 0.6931 -0.1524 -0.0291 -0.0974 210 ILE D N 9042 C CA . ILE D 129 ? 1.0665 0.8637 0.8496 -0.1569 -0.0292 -0.1035 210 ILE D CA 9043 C C . ILE D 129 ? 1.1492 0.9381 0.9210 -0.1722 -0.0262 -0.1136 210 ILE D C 9044 O O . ILE D 129 ? 1.2253 1.0226 1.0000 -0.1819 -0.0290 -0.1151 210 ILE D O 9045 C CB . ILE D 129 ? 1.1731 0.9939 0.9572 -0.1547 -0.0383 -0.0990 210 ILE D CB 9046 C CG1 . ILE D 129 ? 1.4709 1.3102 1.2521 -0.1674 -0.0450 -0.1020 210 ILE D CG1 9047 C CG2 . ILE D 129 ? 1.0244 0.8565 0.8221 -0.1427 -0.0421 -0.0886 210 ILE D CG2 9048 C CD1 . ILE D 129 ? 1.5702 1.4326 1.3509 -0.1651 -0.0535 -0.0975 210 ILE D CD1 9049 N N . ILE D 130 ? 1.1187 0.8906 0.8775 -0.1745 -0.0201 -0.1209 211 ILE D N 9050 C CA . ILE D 130 ? 1.0447 0.8061 0.7912 -0.1893 -0.0163 -0.1313 211 ILE D CA 9051 C C . ILE D 130 ? 1.0457 0.8284 0.7856 -0.2007 -0.0246 -0.1351 211 ILE D C 9052 O O . ILE D 130 ? 1.0075 0.8009 0.7429 -0.1974 -0.0289 -0.1339 211 ILE D O 9053 C CB . ILE D 130 ? 1.1541 0.8879 0.8883 -0.1879 -0.0058 -0.1382 211 ILE D CB 9054 C CG1 . ILE D 130 ? 1.3504 1.0705 1.0719 -0.2038 -0.0007 -0.1493 211 ILE D CG1 9055 C CG2 . ILE D 130 ? 1.2820 1.0189 1.0091 -0.1821 -0.0070 -0.1384 211 ILE D CG2 9056 C CD1 . ILE D 130 ? 1.5632 1.2528 1.2806 -0.2020 0.0115 -0.1529 211 ILE D CD1 9057 N N . THR D 131 ? 1.0446 0.8346 0.7847 -0.2141 -0.0268 -0.1391 212 THR D N 9058 C CA . THR D 131 ? 1.0431 0.8574 0.7790 -0.2253 -0.0356 -0.1418 212 THR D CA 9059 C C . THR D 131 ? 1.0854 0.8896 0.8055 -0.2423 -0.0317 -0.1545 212 THR D C 9060 O O . THR D 131 ? 1.1476 0.9696 0.8604 -0.2519 -0.0381 -0.1584 212 THR D O 9061 C CB . THR D 131 ? 1.1074 0.9464 0.8572 -0.2281 -0.0434 -0.1355 212 THR D CB 9062 O OG1 . THR D 131 ? 1.2813 1.1070 1.0364 -0.2327 -0.0378 -0.1371 212 THR D OG1 9063 C CG2 . THR D 131 ? 1.0111 0.8652 0.7743 -0.2125 -0.0490 -0.1234 212 THR D CG2 9064 N N . ASP D 132 ? 1.1065 0.8822 0.8208 -0.2460 -0.0212 -0.1609 213 ASP D N 9065 C CA . ASP D 132 ? 1.1721 0.9332 0.8699 -0.2620 -0.0156 -0.1738 213 ASP D CA 9066 C C . ASP D 132 ? 1.1542 0.8787 0.8451 -0.2610 -0.0020 -0.1792 213 ASP D C 9067 O O . ASP D 132 ? 1.1799 0.8925 0.8806 -0.2505 0.0027 -0.1730 213 ASP D O 9068 C CB . ASP D 132 ? 1.1419 0.9197 0.8410 -0.2789 -0.0207 -0.1779 213 ASP D CB 9069 C CG . ASP D 132 ? 1.3593 1.1474 1.0437 -0.2940 -0.0243 -0.1876 213 ASP D CG 9070 O OD1 . ASP D 132 ? 1.4552 1.2239 1.1241 -0.2959 -0.0179 -0.1953 213 ASP D OD1 9071 O OD2 . ASP D 132 ? 1.4954 1.3114 1.1833 -0.3037 -0.0335 -0.1874 213 ASP D OD2 9072 N N . THR D 133 ? 1.1805 0.8874 0.8539 -0.2716 0.0046 -0.1906 214 THR D N 9073 C CA . THR D 133 ? 1.1998 0.8712 0.8647 -0.2732 0.0182 -0.1970 214 THR D CA 9074 C C . THR D 133 ? 1.3216 0.9859 0.9741 -0.2944 0.0214 -0.2093 214 THR D C 9075 O O . THR D 133 ? 1.2771 0.9593 0.9218 -0.3070 0.0146 -0.2152 214 THR D O 9076 C CB . THR D 133 ? 1.4499 1.0997 1.1038 -0.2636 0.0263 -0.1997 214 THR D CB 9077 O OG1 . THR D 133 ? 1.4318 1.0984 1.0778 -0.2656 0.0196 -0.2020 214 THR D OG1 9078 C CG2 . THR D 133 ? 1.2965 0.9404 0.9627 -0.2433 0.0288 -0.1889 214 THR D CG2 9079 N N . ILE D 134 ? 1.2975 0.9357 0.9478 -0.2986 0.0318 -0.2129 215 ILE D N 9080 C CA . ILE D 134 ? 1.2663 0.8921 0.9037 -0.3191 0.0371 -0.2252 215 ILE D CA 9081 C C . ILE D 134 ? 1.2959 0.8800 0.9195 -0.3174 0.0530 -0.2321 215 ILE D C 9082 O O . ILE D 134 ? 1.2282 0.7936 0.8582 -0.3028 0.0604 -0.2254 215 ILE D O 9083 C CB . ILE D 134 ? 1.2534 0.8886 0.9024 -0.3276 0.0346 -0.2227 215 ILE D CB 9084 C CG1 . ILE D 134 ? 1.2351 0.9127 0.8960 -0.3309 0.0191 -0.2172 215 ILE D CG1 9085 C CG2 . ILE D 134 ? 1.3246 0.9406 0.9602 -0.3480 0.0429 -0.2355 215 ILE D CG2 9086 C CD1 . ILE D 134 ? 1.1688 0.8596 0.8450 -0.3346 0.0157 -0.2116 215 ILE D CD1 9087 N N . HIS D 135 ? 1.2661 0.8357 0.8703 -0.3316 0.0586 -0.2451 216 HIS D N 9088 C CA . HIS D 135 ? 1.2745 0.8084 0.8676 -0.3263 0.0739 -0.2493 216 HIS D CA 9089 C C . HIS D 135 ? 1.4430 0.9633 1.0304 -0.3389 0.0826 -0.2556 216 HIS D C 9090 O O . HIS D 135 ? 1.5587 1.0985 1.1453 -0.3545 0.0767 -0.2602 216 HIS D O 9091 C CB . HIS D 135 ? 1.1606 0.6919 0.7415 -0.3214 0.0749 -0.2532 216 HIS D CB 9092 C CG . HIS D 135 ? 1.2861 0.8278 0.8745 -0.3043 0.0691 -0.2446 216 HIS D CG 9093 N ND1 . HIS D 135 ? 1.3607 0.8821 0.9521 -0.2861 0.0777 -0.2387 216 HIS D ND1 9094 C CD2 . HIS D 135 ? 1.2439 0.8196 0.8418 -0.2995 0.0555 -0.2376 216 HIS D CD2 9095 C CE1 . HIS D 135 ? 1.3649 0.9074 0.9671 -0.2718 0.0694 -0.2292 216 HIS D CE1 9096 N NE2 . HIS D 135 ? 1.3173 0.8917 0.9234 -0.2794 0.0562 -0.2283 216 HIS D NE2 9097 N N . PRO D 136 ? 1.4399 0.9271 1.0238 -0.3317 0.0970 -0.2553 217 PRO D N 9098 C CA . PRO D 136 ? 1.4156 0.8844 0.9919 -0.3422 0.1077 -0.2613 217 PRO D CA 9099 C C . PRO D 136 ? 1.6387 1.1090 1.1998 -0.3534 0.1093 -0.2712 217 PRO D C 9100 O O . PRO D 136 ? 1.7013 1.1669 1.2541 -0.3463 0.1108 -0.2730 217 PRO D O 9101 C CB . PRO D 136 ? 1.3684 0.8014 0.9424 -0.3273 0.1226 -0.2576 217 PRO D CB 9102 C CG . PRO D 136 ? 1.4020 0.8352 0.9787 -0.3101 0.1201 -0.2522 217 PRO D CG 9103 C CD . PRO D 136 ? 1.3153 0.7811 0.9025 -0.3125 0.1041 -0.2484 217 PRO D CD 9104 N N . THR D 137 ? 1.7581 1.2358 1.3158 -0.3707 0.1090 -0.2773 218 THR D N 9105 C CA . THR D 137 ? 1.7776 1.2509 1.3198 -0.3824 0.1134 -0.2872 218 THR D CA 9106 C C . THR D 137 ? 1.8681 1.3088 1.4024 -0.3861 0.1294 -0.2911 218 THR D C 9107 O O . THR D 137 ? 1.8133 1.2287 1.3350 -0.3817 0.1408 -0.2950 218 THR D O 9108 C CB . THR D 137 ? 1.6807 1.1875 1.2235 -0.4008 0.1016 -0.2921 218 THR D CB 9109 O OG1 . THR D 137 ? 1.7106 1.2178 1.2585 -0.4127 0.1038 -0.2932 218 THR D OG1 9110 C CG2 . THR D 137 ? 1.4812 1.0228 1.0352 -0.3974 0.0852 -0.2863 218 THR D CG2 9111 N N . ASN D 138 ? 1.9503 1.3922 1.4921 -0.3938 0.1301 -0.2896 219 ASN D N 9112 C CA . ASN D 138 ? 1.9821 1.3965 1.5173 -0.3999 0.1441 -0.2930 219 ASN D CA 9113 C C . ASN D 138 ? 1.8287 1.2087 1.3645 -0.3831 0.1575 -0.2868 219 ASN D C 9114 O O . ASN D 138 ? 1.7853 1.1519 1.3257 -0.3838 0.1641 -0.2837 219 ASN D O 9115 C CB . ASN D 138 ? 2.0080 1.4385 1.5516 -0.4147 0.1394 -0.2934 219 ASN D CB 9116 C CG . ASN D 138 ? 1.9839 1.4369 1.5209 -0.4351 0.1332 -0.3025 219 ASN D CG 9117 O OD1 . ASN D 138 ? 1.9348 1.4188 1.4815 -0.4450 0.1215 -0.3017 219 ASN D OD1 9118 N ND2 . ASN D 138 ? 1.8835 1.3214 1.4039 -0.4413 0.1412 -0.3111 219 ASN D ND2 9119 N N . GLY D 139 ? 1.7599 1.1267 1.2913 -0.3679 0.1616 -0.2847 220 GLY D N 9120 C CA . GLY D 139 ? 1.7725 1.1070 1.3029 -0.3514 0.1751 -0.2792 220 GLY D CA 9121 C C . GLY D 139 ? 1.6718 1.0090 1.2156 -0.3326 0.1711 -0.2683 220 GLY D C 9122 O O . GLY D 139 ? 1.5534 0.8720 1.0948 -0.3161 0.1787 -0.2644 220 GLY D O 9123 N N . GLY D 140 ? 1.5823 0.9428 1.1401 -0.3349 0.1595 -0.2634 221 GLY D N 9124 C CA . GLY D 140 ? 1.5140 0.8756 1.0849 -0.3185 0.1565 -0.2529 221 GLY D CA 9125 C C . GLY D 140 ? 1.6398 0.9733 1.2130 -0.3090 0.1695 -0.2470 221 GLY D C 9126 O O . GLY D 140 ? 1.8075 1.1210 1.3720 -0.3158 0.1805 -0.2511 221 GLY D O 9127 N N . PRO D 141 ? 1.6806 1.0134 1.2657 -0.2940 0.1679 -0.2370 222 PRO D N 9128 C CA . PRO D 141 ? 1.6853 1.0441 1.2823 -0.2892 0.1538 -0.2319 222 PRO D CA 9129 C C . PRO D 141 ? 1.6551 1.0399 1.2612 -0.3042 0.1423 -0.2324 222 PRO D C 9130 O O . PRO D 141 ? 1.7360 1.1157 1.3418 -0.3153 0.1465 -0.2346 222 PRO D O 9131 C CB . PRO D 141 ? 1.6369 0.9815 1.2429 -0.2696 0.1588 -0.2210 222 PRO D CB 9132 C CG . PRO D 141 ? 1.6619 0.9794 1.2642 -0.2684 0.1730 -0.2195 222 PRO D CG 9133 C CD . PRO D 141 ? 1.7693 1.0744 1.3560 -0.2792 0.1807 -0.2296 222 PRO D CD 9134 N N . LEU D 142 ? 1.5138 0.9266 1.1279 -0.3047 0.1281 -0.2304 223 LEU D N 9135 C CA . LEU D 142 ? 1.4192 0.8593 1.0437 -0.3171 0.1165 -0.2295 223 LEU D CA 9136 C C . LEU D 142 ? 1.4071 0.8427 1.0448 -0.3100 0.1176 -0.2202 223 LEU D C 9137 O O . LEU D 142 ? 1.4382 0.8553 1.0785 -0.2932 0.1241 -0.2133 223 LEU D O 9138 C CB . LEU D 142 ? 1.3219 0.7941 0.9502 -0.3195 0.1011 -0.2299 223 LEU D CB 9139 C CG . LEU D 142 ? 1.2560 0.7509 0.8778 -0.3368 0.0935 -0.2386 223 LEU D CG 9140 C CD1 . LEU D 142 ? 1.1790 0.6527 0.7870 -0.3442 0.1052 -0.2466 223 LEU D CD1 9141 C CD2 . LEU D 142 ? 1.1040 0.6182 0.7227 -0.3334 0.0836 -0.2396 223 LEU D CD2 9142 N N . ARG D 143 ? 1.3406 0.7932 0.9865 -0.3225 0.1117 -0.2199 224 ARG D N 9143 C CA . ARG D 143 ? 1.3111 0.7593 0.9687 -0.3177 0.1135 -0.2115 224 ARG D CA 9144 C C . ARG D 143 ? 1.3392 0.8260 1.0129 -0.3233 0.0987 -0.2065 224 ARG D C 9145 O O . ARG D 143 ? 1.3423 0.8444 1.0140 -0.3427 0.0938 -0.2138 224 ARG D O 9146 C CB . ARG D 143 ? 1.3481 0.7733 1.0013 -0.3235 0.1263 -0.2132 224 ARG D CB 9147 C CG . ARG D 143 ? 1.3326 0.7230 0.9743 -0.3124 0.1415 -0.2138 224 ARG D CG 9148 C CD . ARG D 143 ? 1.3478 0.7154 0.9837 -0.3189 0.1544 -0.2157 224 ARG D CD 9149 N NE . ARG D 143 ? 1.4938 0.8716 1.1234 -0.3398 0.1529 -0.2254 224 ARG D NE 9150 C CZ . ARG D 143 ? 1.5709 0.9404 1.1863 -0.3473 0.1578 -0.2346 224 ARG D CZ 9151 N NH1 . ARG D 143 ? 1.6538 1.0049 1.2599 -0.3356 0.1646 -0.2354 224 ARG D NH1 9152 N NH2 . ARG D 143 ? 1.5117 0.8923 1.1224 -0.3667 0.1560 -0.2429 224 ARG D NH2 9153 N N . THR D 144 ? 1.3115 0.8162 1.0019 -0.3057 0.0917 -0.1935 225 THR D N 9154 C CA . THR D 144 ? 1.2180 0.7593 0.9253 -0.3076 0.0786 -0.1867 225 THR D CA 9155 C C . THR D 144 ? 1.2449 0.7809 0.9578 -0.3166 0.0830 -0.1854 225 THR D C 9156 O O . THR D 144 ? 1.1846 0.6873 0.8891 -0.3188 0.0964 -0.1881 225 THR D O 9157 C CB . THR D 144 ? 1.2160 0.7761 0.9389 -0.2860 0.0707 -0.1733 225 THR D CB 9158 O OG1 . THR D 144 ? 1.2971 0.8324 1.0220 -0.2706 0.0804 -0.1664 225 THR D OG1 9159 C CG2 . THR D 144 ? 1.0716 0.6443 0.7913 -0.2786 0.0639 -0.1740 225 THR D CG2 9160 N N . GLN D 145 ? 1.2161 0.7845 0.9431 -0.3213 0.0721 -0.1808 226 GLN D N 9161 C CA . GLN D 145 ? 1.1549 0.7221 0.8879 -0.3313 0.0754 -0.1797 226 GLN D CA 9162 C C . GLN D 145 ? 1.1524 0.7107 0.8967 -0.3145 0.0794 -0.1675 226 GLN D C 9163 O O . GLN D 145 ? 1.2090 0.7683 0.9602 -0.3204 0.0816 -0.1646 226 GLN D O 9164 C CB . GLN D 145 ? 1.1834 0.7893 0.9264 -0.3446 0.0628 -0.1805 226 GLN D CB 9165 C CG . GLN D 145 ? 1.1617 0.8026 0.9214 -0.3308 0.0493 -0.1695 226 GLN D CG 9166 C CD . GLN D 145 ? 1.2125 0.8905 0.9823 -0.3437 0.0382 -0.1697 226 GLN D CD 9167 O OE1 . GLN D 145 ? 1.1636 0.8688 0.9346 -0.3461 0.0275 -0.1710 226 GLN D OE1 9168 N NE2 . GLN D 145 ? 1.3985 1.0780 1.1755 -0.3520 0.0410 -0.1681 226 GLN D NE2 9169 N N . ALA D 146 ? 1.0395 0.5901 0.7853 -0.2941 0.0804 -0.1605 227 ALA D N 9170 C CA . ALA D 146 ? 1.0696 0.6082 0.8235 -0.2763 0.0855 -0.1493 227 ALA D CA 9171 C C . ALA D 146 ? 1.0706 0.6346 0.8421 -0.2737 0.0778 -0.1399 227 ALA D C 9172 O O . ALA D 146 ? 1.2261 0.7780 1.0026 -0.2676 0.0839 -0.1332 227 ALA D O 9173 C CB . ALA D 146 ? 1.2240 0.7223 0.9666 -0.2786 0.1018 -0.1523 227 ALA D CB 9174 N N . SER D 147 ? 0.9733 0.5726 0.7538 -0.2776 0.0645 -0.1390 228 SER D N 9175 C CA . SER D 147 ? 1.1006 0.7255 0.8961 -0.2804 0.0575 -0.1328 228 SER D CA 9176 C C . SER D 147 ? 1.0658 0.7284 0.8697 -0.2802 0.0428 -0.1311 228 SER D C 9177 O O . SER D 147 ? 1.1365 0.8040 0.9329 -0.2821 0.0389 -0.1367 228 SER D O 9178 C CB . SER D 147 ? 1.1579 0.7760 0.9496 -0.3012 0.0630 -0.1398 228 SER D CB 9179 O OG . SER D 147 ? 1.1582 0.8094 0.9625 -0.3098 0.0535 -0.1376 228 SER D OG 9180 N N . SER D 148 ? 0.9400 0.6290 0.7592 -0.2771 0.0350 -0.1232 229 SER D N 9181 C CA . SER D 148 ? 1.0709 0.7957 0.8984 -0.2760 0.0216 -0.1207 229 SER D CA 9182 C C . SER D 148 ? 1.0674 0.8055 0.8880 -0.2957 0.0176 -0.1310 229 SER D C 9183 O O . SER D 148 ? 1.1903 0.9278 1.0097 -0.3122 0.0207 -0.1364 229 SER D O 9184 C CB . SER D 148 ? 1.0652 0.8154 0.9099 -0.2707 0.0150 -0.1109 229 SER D CB 9185 O OG . SER D 148 ? 1.1074 0.8923 0.9591 -0.2724 0.0028 -0.1095 229 SER D OG 9186 N N . CYS D 149 ? 0.9096 0.6594 0.7251 -0.2944 0.0110 -0.1341 230 CYS D N 9187 C CA . CYS D 149 ? 1.0351 0.8067 0.8467 -0.3113 0.0041 -0.1418 230 CYS D CA 9188 C C . CYS D 149 ? 1.1304 0.9409 0.9582 -0.3110 -0.0072 -0.1345 230 CYS D C 9189 O O . CYS D 149 ? 1.0322 0.8499 0.8728 -0.2975 -0.0091 -0.1241 230 CYS D O 9190 C CB . CYS D 149 ? 0.9883 0.7596 0.7884 -0.3100 0.0011 -0.1472 230 CYS D CB 9191 S SG . CYS D 149 ? 1.1363 0.9174 0.9425 -0.2862 -0.0056 -0.1370 230 CYS D SG 9192 N N . ILE D 150 ? 1.1008 0.9366 0.9279 -0.3259 -0.0144 -0.1399 231 ILE D N 9193 C CA . ILE D 150 ? 1.0460 0.9188 0.8884 -0.3278 -0.0239 -0.1336 231 ILE D CA 9194 C C . ILE D 150 ? 1.0025 0.9063 0.8470 -0.3239 -0.0359 -0.1312 231 ILE D C 9195 O O . ILE D 150 ? 1.1178 1.0240 0.9508 -0.3327 -0.0381 -0.1392 231 ILE D O 9196 C CB . ILE D 150 ? 1.1148 0.9969 0.9581 -0.3496 -0.0226 -0.1404 231 ILE D CB 9197 C CG1 . ILE D 150 ? 1.1442 0.9952 0.9857 -0.3538 -0.0102 -0.1420 231 ILE D CG1 9198 C CG2 . ILE D 150 ? 0.9237 0.8475 0.7831 -0.3511 -0.0331 -0.1337 231 ILE D CG2 9199 C CD1 . ILE D 150 ? 1.0864 0.9322 0.9405 -0.3365 -0.0078 -0.1301 231 ILE D CD1 9200 N N . CYS D 151 ? 0.9949 0.9218 0.8536 -0.3103 -0.0431 -0.1201 232 CYS D N 9201 C CA . CYS D 151 ? 1.0218 0.9797 0.8839 -0.3053 -0.0543 -0.1161 232 CYS D CA 9202 C C . CYS D 151 ? 1.0644 1.0586 0.9412 -0.3096 -0.0620 -0.1106 232 CYS D C 9203 O O . CYS D 151 ? 1.0558 1.0514 0.9442 -0.3061 -0.0597 -0.1047 232 CYS D O 9204 C CB . CYS D 151 ? 1.0737 1.0272 0.9390 -0.2836 -0.0561 -0.1071 232 CYS D CB 9205 S SG . CYS D 151 ? 1.2598 1.1779 1.1087 -0.2771 -0.0490 -0.1127 232 CYS D SG 9206 N N . ASN D 152 ? 1.2021 1.2261 1.0783 -0.3169 -0.0709 -0.1124 233 ASN D N 9207 C CA . ASN D 152 ? 1.2337 1.2963 1.1244 -0.3185 -0.0793 -0.1059 233 ASN D CA 9208 C C . ASN D 152 ? 1.2662 1.3583 1.1553 -0.3163 -0.0898 -0.1040 233 ASN D C 9209 O O . ASN D 152 ? 1.2899 1.3824 1.1662 -0.3272 -0.0914 -0.1127 233 ASN D O 9210 C CB . ASN D 152 ? 1.2172 1.2892 1.1106 -0.3391 -0.0775 -0.1124 233 ASN D CB 9211 C CG . ASN D 152 ? 1.2216 1.3258 1.1334 -0.3374 -0.0827 -0.1037 233 ASN D CG 9212 O OD1 . ASN D 152 ? 1.3033 1.4099 1.2260 -0.3207 -0.0833 -0.0931 233 ASN D OD1 9213 N ND2 . ASN D 152 ? 1.1192 1.2488 1.0344 -0.3550 -0.0863 -0.1083 233 ASN D ND2 9214 N N . ASP D 153 ? 1.2456 1.3609 1.1469 -0.3017 -0.0964 -0.0925 234 ASP D N 9215 C CA . ASP D 153 ? 1.2902 1.4386 1.1926 -0.2989 -0.1067 -0.0885 234 ASP D CA 9216 C C . ASP D 153 ? 1.2076 1.3440 1.0957 -0.2935 -0.1078 -0.0915 234 ASP D C 9217 O O . ASP D 153 ? 1.0988 1.2554 0.9804 -0.3000 -0.1144 -0.0944 234 ASP D O 9218 C CB . ASP D 153 ? 1.4886 1.6672 1.3925 -0.3181 -0.1121 -0.0941 234 ASP D CB 9219 C CG . ASP D 153 ? 1.6110 1.8328 1.5275 -0.3122 -0.1222 -0.0844 234 ASP D CG 9220 O OD1 . ASP D 153 ? 1.5368 1.7630 1.4611 -0.2932 -0.1243 -0.0733 234 ASP D OD1 9221 O OD2 . ASP D 153 ? 1.7011 1.9525 1.6195 -0.3267 -0.1279 -0.0879 234 ASP D OD2 9222 N N . GLY D 154 ? 1.1754 1.2800 1.0586 -0.2816 -0.1014 -0.0904 235 GLY D N 9223 C CA . GLY D 154 ? 1.1275 1.2191 0.9980 -0.2750 -0.1015 -0.0925 235 GLY D CA 9224 C C . GLY D 154 ? 1.0922 1.1567 0.9462 -0.2875 -0.0950 -0.1053 235 GLY D C 9225 O O . GLY D 154 ? 1.1348 1.1810 0.9777 -0.2815 -0.0926 -0.1077 235 GLY D O 9226 N N . THR D 155 ? 1.0206 1.0814 0.8728 -0.3048 -0.0914 -0.1135 236 THR D N 9227 C CA . THR D 155 ? 1.0494 1.0870 0.8851 -0.3194 -0.0852 -0.1266 236 THR D CA 9228 C C . THR D 155 ? 1.0370 1.0398 0.8710 -0.3228 -0.0736 -0.1310 236 THR D C 9229 O O . THR D 155 ? 1.0105 1.0163 0.8559 -0.3240 -0.0716 -0.1273 236 THR D O 9230 C CB . THR D 155 ? 1.1260 1.1887 0.9572 -0.3398 -0.0907 -0.1346 236 THR D CB 9231 O OG1 . THR D 155 ? 1.2133 1.3148 1.0514 -0.3348 -0.1022 -0.1272 236 THR D OG1 9232 C CG2 . THR D 155 ? 1.0457 1.0896 0.8571 -0.3521 -0.0868 -0.1475 236 THR D CG2 9233 N N . CYS D 156 ? 1.0020 0.9719 0.8215 -0.3238 -0.0655 -0.1385 237 CYS D N 9234 C CA . CYS D 156 ? 0.9427 0.8769 0.7593 -0.3248 -0.0537 -0.1420 237 CYS D CA 9235 C C . CYS D 156 ? 1.0770 0.9901 0.8774 -0.3437 -0.0463 -0.1560 237 CYS D C 9236 O O . CYS D 156 ? 1.2577 1.1714 1.0450 -0.3506 -0.0480 -0.1636 237 CYS D O 9237 C CB . CYS D 156 ? 0.8185 0.7271 0.6334 -0.3057 -0.0484 -0.1367 237 CYS D CB 9238 S SG . CYS D 156 ? 1.4577 1.3840 1.2902 -0.2830 -0.0548 -0.1208 237 CYS D SG 9239 N N . TYR D 157 ? 1.0187 0.9121 0.8198 -0.3516 -0.0376 -0.1594 238 TYR D N 9240 C CA . TYR D 157 ? 1.0069 0.8778 0.7931 -0.3704 -0.0292 -0.1727 238 TYR D CA 9241 C C . TYR D 157 ? 1.0661 0.8940 0.8465 -0.3646 -0.0155 -0.1739 238 TYR D C 9242 O O . TYR D 157 ? 1.0938 0.9148 0.8853 -0.3539 -0.0123 -0.1655 238 TYR D O 9243 C CB . TYR D 157 ? 0.9961 0.8870 0.7878 -0.3899 -0.0314 -0.1768 238 TYR D CB 9244 C CG . TYR D 157 ? 1.1538 1.0911 0.9547 -0.3932 -0.0453 -0.1731 238 TYR D CG 9245 C CD1 . TYR D 157 ? 1.1883 1.1425 0.9785 -0.4065 -0.0512 -0.1815 238 TYR D CD1 9246 C CD2 . TYR D 157 ? 1.1021 1.0663 0.9217 -0.3821 -0.0525 -0.1608 238 TYR D CD2 9247 C CE1 . TYR D 157 ? 1.2076 1.2053 1.0060 -0.4083 -0.0640 -0.1773 238 TYR D CE1 9248 C CE2 . TYR D 157 ? 1.2418 1.2482 1.0697 -0.3836 -0.0647 -0.1566 238 TYR D CE2 9249 C CZ . TYR D 157 ? 1.3292 1.3528 1.1467 -0.3965 -0.0705 -0.1646 238 TYR D CZ 9250 O OH . TYR D 157 ? 1.4034 1.4702 1.2292 -0.3972 -0.0827 -0.1597 238 TYR D OH 9251 N N . THR D 158 ? 1.1214 0.9204 0.8842 -0.3709 -0.0072 -0.1840 239 THR D N 9252 C CA . THR D 158 ? 1.1125 0.8697 0.8684 -0.3668 0.0068 -0.1860 239 THR D CA 9253 C C . THR D 158 ? 1.1365 0.8678 0.8729 -0.3846 0.0161 -0.2006 239 THR D C 9254 O O . THR D 158 ? 1.3189 1.0637 1.0460 -0.3982 0.0114 -0.2093 239 THR D O 9255 C CB . THR D 158 ? 1.1431 0.8833 0.8993 -0.3438 0.0096 -0.1785 239 THR D CB 9256 O OG1 . THR D 158 ? 0.9928 0.6934 0.7424 -0.3398 0.0235 -0.1800 239 THR D OG1 9257 C CG2 . THR D 158 ? 1.0612 0.8041 0.8062 -0.3410 0.0059 -0.1828 239 THR D CG2 9258 N N . ILE D 159 ? 1.0988 0.7926 0.8286 -0.3842 0.0297 -0.2031 240 ILE D N 9259 C CA . ILE D 159 ? 1.1773 0.8417 0.8882 -0.4006 0.0406 -0.2167 240 ILE D CA 9260 C C . ILE D 159 ? 1.2402 0.8654 0.9398 -0.3872 0.0523 -0.2173 240 ILE D C 9261 O O . ILE D 159 ? 1.2532 0.8609 0.9592 -0.3721 0.0585 -0.2088 240 ILE D O 9262 C CB . ILE D 159 ? 1.3081 0.9652 1.0212 -0.4156 0.0474 -0.2199 240 ILE D CB 9263 C CG1 . ILE D 159 ? 1.2804 0.9796 1.0038 -0.4299 0.0355 -0.2204 240 ILE D CG1 9264 C CG2 . ILE D 159 ? 1.2147 0.8432 0.9125 -0.4224 0.0606 -0.2284 240 ILE D CG2 9265 C CD1 . ILE D 159 ? 1.1802 0.8847 0.9156 -0.4368 0.0376 -0.2166 240 ILE D CD1 9266 N N . ILE D 160 ? 1.3454 0.9595 1.0290 -0.3913 0.0552 -0.2262 241 ILE D N 9267 C CA . ILE D 160 ? 1.3496 0.9288 1.0219 -0.3787 0.0664 -0.2272 241 ILE D CA 9268 C C . ILE D 160 ? 1.2418 0.7971 0.9007 -0.3871 0.0790 -0.2354 241 ILE D C 9269 O O . ILE D 160 ? 1.3684 0.9382 1.0224 -0.4023 0.0764 -0.2426 241 ILE D O 9270 C CB . ILE D 160 ? 1.2988 0.8874 0.9657 -0.3702 0.0597 -0.2278 241 ILE D CB 9271 C CG1 . ILE D 160 ? 1.2315 0.8567 0.9174 -0.3563 0.0456 -0.2149 241 ILE D CG1 9272 C CG2 . ILE D 160 ? 1.1567 0.7104 0.8137 -0.3556 0.0711 -0.2277 241 ILE D CG2 9273 C CD1 . ILE D 160 ? 1.2068 0.8443 0.8904 -0.3448 0.0389 -0.2127 241 ILE D CD1 9274 N N . ALA D 161 ? 1.2609 0.7802 0.9140 -0.3768 0.0927 -0.2339 242 ALA D N 9275 C CA . ALA D 161 ? 1.3245 0.8179 0.9649 -0.3834 0.1061 -0.2406 242 ALA D CA 9276 C C . ALA D 161 ? 1.4037 0.8745 1.0299 -0.3745 0.1138 -0.2445 242 ALA D C 9277 O O . ALA D 161 ? 1.4234 0.8862 1.0511 -0.3583 0.1140 -0.2392 242 ALA D O 9278 C CB . ALA D 161 ? 1.2588 0.7279 0.9032 -0.3794 0.1172 -0.2356 242 ALA D CB 9279 N N . ASP D 162 ? 1.3562 0.8171 0.9688 -0.3852 0.1205 -0.2536 243 ASP D N 9280 C CA . ASP D 162 ? 1.3679 0.8039 0.9660 -0.3779 0.1303 -0.2577 243 ASP D CA 9281 C C . ASP D 162 ? 1.5365 0.9425 1.1238 -0.3840 0.1458 -0.2625 243 ASP D C 9282 O O . ASP D 162 ? 1.4742 0.8822 1.0645 -0.3957 0.1475 -0.2636 243 ASP D O 9283 C CB . ASP D 162 ? 1.4012 0.8567 0.9910 -0.3854 0.1222 -0.2650 243 ASP D CB 9284 C CG . ASP D 162 ? 1.5661 1.0036 1.1456 -0.3723 0.1280 -0.2660 243 ASP D CG 9285 O OD1 . ASP D 162 ? 1.7052 1.1116 1.2810 -0.3602 0.1407 -0.2631 243 ASP D OD1 9286 O OD2 . ASP D 162 ? 1.5157 0.9707 1.0909 -0.3739 0.1199 -0.2693 243 ASP D OD2 9287 N N . GLY D 163 ? 1.6561 1.0345 1.2306 -0.3761 0.1573 -0.2651 244 GLY D N 9288 C CA . GLY D 163 ? 1.6419 0.9894 1.2052 -0.3800 0.1731 -0.2690 244 GLY D CA 9289 C C . GLY D 163 ? 1.8004 1.1153 1.3617 -0.3606 0.1860 -0.2623 244 GLY D C 9290 O O . GLY D 163 ? 1.8702 1.1859 1.4431 -0.3461 0.1835 -0.2527 244 GLY D O 9291 N N . THR D 164 ? 1.8073 1.0942 1.3539 -0.3600 0.1999 -0.2671 245 THR D N 9292 C CA . THR D 164 ? 1.8151 1.0709 1.3587 -0.3414 0.2132 -0.2609 245 THR D CA 9293 C C . THR D 164 ? 1.8966 1.1326 1.4429 -0.3403 0.2234 -0.2560 245 THR D C 9294 O O . THR D 164 ? 1.9387 1.1545 1.4874 -0.3232 0.2319 -0.2476 245 THR D O 9295 C CB . THR D 164 ? 1.6993 0.9337 1.2259 -0.3394 0.2240 -0.2675 245 THR D CB 9296 O OG1 . THR D 164 ? 1.5672 0.7826 1.0812 -0.3530 0.2353 -0.2747 245 THR D OG1 9297 C CG2 . THR D 164 ? 1.7813 1.0377 1.3037 -0.3456 0.2135 -0.2741 245 THR D CG2 9298 N N . THR D 165 ? 1.8853 1.1283 1.4312 -0.3585 0.2223 -0.2609 246 THR D N 9299 C CA . THR D 165 ? 1.9018 1.1309 1.4517 -0.3596 0.2299 -0.2562 246 THR D CA 9300 C C . THR D 165 ? 1.8535 1.1073 1.4112 -0.3784 0.2205 -0.2592 246 THR D C 9301 O O . THR D 165 ? 1.8438 1.1210 1.3996 -0.3933 0.2110 -0.2671 246 THR D O 9302 C CB . THR D 165 ? 2.0760 1.2692 1.6105 -0.3608 0.2484 -0.2598 246 THR D CB 9303 O OG1 . THR D 165 ? 2.1529 1.3347 1.6912 -0.3634 0.2550 -0.2556 246 THR D OG1 9304 C CG2 . THR D 165 ? 1.4562 0.6498 0.9760 -0.3797 0.2504 -0.2728 246 THR D CG2 9305 N N . TYR D 166 ? 1.7916 1.0406 1.3578 -0.3772 0.2234 -0.2527 247 TYR D N 9306 C CA . TYR D 166 ? 1.8492 1.1223 1.4251 -0.3929 0.2146 -0.2538 247 TYR D CA 9307 C C . TYR D 166 ? 1.8755 1.1494 1.4412 -0.4154 0.2182 -0.2649 247 TYR D C 9308 O O . TYR D 166 ? 1.8003 1.0999 1.3733 -0.4306 0.2091 -0.2675 247 TYR D O 9309 C CB . TYR D 166 ? 2.0008 1.2671 1.5881 -0.3850 0.2177 -0.2436 247 TYR D CB 9310 C CG . TYR D 166 ? 2.2776 1.5056 1.8566 -0.3746 0.2353 -0.2396 247 TYR D CG 9311 C CD1 . TYR D 166 ? 2.3644 1.5741 1.9340 -0.3869 0.2469 -0.2446 247 TYR D CD1 9312 C CD2 . TYR D 166 ? 2.3790 1.5900 1.9595 -0.3522 0.2406 -0.2307 247 TYR D CD2 9313 C CE1 . TYR D 166 ? 2.3979 1.5725 1.9594 -0.3768 0.2633 -0.2405 247 TYR D CE1 9314 C CE2 . TYR D 166 ? 2.4161 1.5937 1.9892 -0.3416 0.2567 -0.2262 247 TYR D CE2 9315 C CZ . TYR D 166 ? 2.4261 1.5852 1.9895 -0.3539 0.2681 -0.2311 247 TYR D CZ 9316 O OH . TYR D 166 ? 2.4477 1.5734 2.0032 -0.3432 0.2843 -0.2264 247 TYR D OH 9317 N N . THR D 167 ? 1.9216 1.1677 1.4704 -0.4177 0.2317 -0.2712 248 THR D N 9318 C CA . THR D 167 ? 1.9414 1.1886 1.4788 -0.4394 0.2349 -0.2828 248 THR D CA 9319 C C . THR D 167 ? 2.0448 1.3247 1.5827 -0.4498 0.2205 -0.2896 248 THR D C 9320 O O . THR D 167 ? 2.1417 1.4505 1.6864 -0.4651 0.2101 -0.2928 248 THR D O 9321 C CB . THR D 167 ? 1.7930 1.0038 1.3110 -0.4390 0.2522 -0.2886 248 THR D CB 9322 O OG1 . THR D 167 ? 1.8343 1.0440 1.3447 -0.4317 0.2507 -0.2916 248 THR D OG1 9323 C CG2 . THR D 167 ? 1.6315 0.8087 1.1483 -0.4235 0.2666 -0.2802 248 THR D CG2 9324 N N . ALA D 168 ? 1.9748 1.2505 1.5057 -0.4408 0.2201 -0.2913 249 ALA D N 9325 C CA . ALA D 168 ? 1.8267 1.1308 1.3564 -0.4485 0.2074 -0.2972 249 ALA D CA 9326 C C . ALA D 168 ? 1.7793 1.1093 1.3243 -0.4364 0.1927 -0.2893 249 ALA D C 9327 O O . ALA D 168 ? 1.7190 1.0488 1.2615 -0.4249 0.1901 -0.2882 249 ALA D O 9328 C CB . ALA D 168 ? 1.7403 1.0254 1.2528 -0.4466 0.2154 -0.3041 249 ALA D CB 9329 N N . SER D 169 ? 1.7220 1.0740 1.2825 -0.4391 0.1834 -0.2838 250 SER D N 9330 C CA . SER D 169 ? 1.7230 1.1025 1.2982 -0.4299 0.1687 -0.2767 250 SER D CA 9331 C C . SER D 169 ? 1.7078 1.1284 1.2887 -0.4450 0.1529 -0.2810 250 SER D C 9332 O O . SER D 169 ? 1.7293 1.1631 1.3114 -0.4618 0.1512 -0.2854 250 SER D O 9333 C CB . SER D 169 ? 1.5356 0.9122 1.1255 -0.4189 0.1686 -0.2657 250 SER D CB 9334 O OG . SER D 169 ? 1.4800 0.8691 1.0773 -0.4326 0.1665 -0.2659 250 SER D OG 9335 N N . SER D 170 ? 1.5995 1.0405 1.1838 -0.4383 0.1416 -0.2794 251 SER D N 9336 C CA . SER D 170 ? 1.5213 1.0034 1.1122 -0.4490 0.1255 -0.2815 251 SER D CA 9337 C C . SER D 170 ? 1.4881 0.9937 1.0976 -0.4408 0.1137 -0.2716 251 SER D C 9338 O O . SER D 170 ? 1.3404 0.8322 0.9552 -0.4238 0.1158 -0.2639 251 SER D O 9339 C CB . SER D 170 ? 1.5232 1.0130 1.1043 -0.4474 0.1208 -0.2864 251 SER D CB 9340 O OG . SER D 170 ? 1.6667 1.1966 1.2563 -0.4520 0.1043 -0.2853 251 SER D OG 9341 N N . HIS D 171 ? 1.5134 1.0546 1.1327 -0.4526 0.1015 -0.2717 252 HIS D N 9342 C CA . HIS D 171 ? 1.3901 0.9561 1.0270 -0.4458 0.0897 -0.2625 252 HIS D CA 9343 C C . HIS D 171 ? 1.4194 1.0283 1.0622 -0.4524 0.0731 -0.2631 252 HIS D C 9344 O O . HIS D 171 ? 1.4465 1.0780 1.0887 -0.4683 0.0683 -0.2685 252 HIS D O 9345 C CB . HIS D 171 ? 1.3273 0.8929 0.9755 -0.4502 0.0924 -0.2580 252 HIS D CB 9346 C CG . HIS D 171 ? 1.4368 0.9616 1.0801 -0.4424 0.1084 -0.2559 252 HIS D CG 9347 N ND1 . HIS D 171 ? 1.4198 0.9218 1.0518 -0.4521 0.1209 -0.2625 252 HIS D ND1 9348 C CD2 . HIS D 171 ? 1.5237 1.0266 1.1712 -0.4251 0.1140 -0.2477 252 HIS D CD2 9349 C CE1 . HIS D 171 ? 1.4964 0.9643 1.1261 -0.4408 0.1336 -0.2580 252 HIS D CE1 9350 N NE2 . HIS D 171 ? 1.5812 1.0496 1.2204 -0.4242 0.1295 -0.2489 252 HIS D NE2 9351 N N . ARG D 172 ? 1.5207 1.1409 1.1688 -0.4396 0.0646 -0.2573 253 ARG D N 9352 C CA . ARG D 172 ? 1.4660 1.1267 1.1199 -0.4433 0.0487 -0.2564 253 ARG D CA 9353 C C . ARG D 172 ? 1.4043 1.0903 1.0766 -0.4385 0.0381 -0.2469 253 ARG D C 9354 O O . ARG D 172 ? 1.3816 1.0520 1.0608 -0.4264 0.0414 -0.2399 253 ARG D O 9355 C CB . ARG D 172 ? 1.3591 1.0185 1.0037 -0.4341 0.0457 -0.2578 253 ARG D CB 9356 C CG . ARG D 172 ? 1.5426 1.1830 1.1692 -0.4399 0.0544 -0.2674 253 ARG D CG 9357 C CD . ARG D 172 ? 1.6369 1.2872 1.2559 -0.4341 0.0481 -0.2688 253 ARG D CD 9358 N NE . ARG D 172 ? 1.6860 1.3182 1.2875 -0.4394 0.0566 -0.2779 253 ARG D NE 9359 C CZ . ARG D 172 ? 1.6963 1.3344 1.2884 -0.4364 0.0530 -0.2808 253 ARG D CZ 9360 N NH1 . ARG D 172 ? 1.6864 1.3479 1.2847 -0.4281 0.0411 -0.2751 253 ARG D NH1 9361 N NH2 . ARG D 172 ? 1.6218 1.2422 1.1978 -0.4417 0.0614 -0.2892 253 ARG D NH2 9362 N N . LEU D 173 ? 1.3859 1.1118 1.0658 -0.4482 0.0255 -0.2466 254 LEU D N 9363 C CA . LEU D 173 ? 1.3663 1.1220 1.0637 -0.4448 0.0140 -0.2378 254 LEU D CA 9364 C C . LEU D 173 ? 1.3408 1.1223 1.0394 -0.4371 0.0012 -0.2343 254 LEU D C 9365 O O . LEU D 173 ? 1.1662 0.9708 0.8596 -0.4444 -0.0058 -0.2384 254 LEU D O 9366 C CB . LEU D 173 ? 1.2783 1.0630 0.9848 -0.4604 0.0091 -0.2388 254 LEU D CB 9367 C CG . LEU D 173 ? 1.2132 1.0355 0.9385 -0.4596 -0.0035 -0.2302 254 LEU D CG 9368 C CD1 . LEU D 173 ? 1.1187 0.9249 0.8540 -0.4472 -0.0006 -0.2217 254 LEU D CD1 9369 C CD2 . LEU D 173 ? 1.0137 0.8595 0.7461 -0.4758 -0.0055 -0.2325 254 LEU D CD2 9370 N N . TYR D 174 ? 1.2496 1.0280 0.9556 -0.4207 -0.0016 -0.2256 255 TYR D N 9371 C CA . TYR D 174 ? 1.1615 0.9643 0.8713 -0.4070 -0.0124 -0.2186 255 TYR D CA 9372 C C . TYR D 174 ? 1.2006 1.0444 0.9301 -0.4000 -0.0253 -0.2068 255 TYR D C 9373 O O . TYR D 174 ? 1.3784 1.2253 1.1223 -0.3953 -0.0246 -0.1994 255 TYR D O 9374 C CB . TYR D 174 ? 1.0013 0.7783 0.7086 -0.3861 -0.0065 -0.2132 255 TYR D CB 9375 C CG . TYR D 174 ? 1.2023 0.9469 0.8888 -0.3909 0.0033 -0.2244 255 TYR D CG 9376 C CD1 . TYR D 174 ? 1.3319 1.0386 1.0087 -0.3976 0.0175 -0.2316 255 TYR D CD1 9377 C CD2 . TYR D 174 ? 1.2805 1.0318 0.9565 -0.3886 -0.0009 -0.2276 255 TYR D CD2 9378 C CE1 . TYR D 174 ? 1.4118 1.0907 1.0716 -0.3982 0.0273 -0.2397 255 TYR D CE1 9379 C CE2 . TYR D 174 ? 1.3892 1.1109 1.0458 -0.3929 0.0085 -0.2380 255 TYR D CE2 9380 C CZ . TYR D 174 ? 1.3983 1.0854 1.0484 -0.3957 0.0227 -0.2428 255 TYR D CZ 9381 O OH . TYR D 174 ? 1.3125 0.9742 0.9472 -0.3946 0.0326 -0.2496 255 TYR D OH 9382 N N . ARG D 175 ? 1.0025 0.8773 0.7320 -0.3992 -0.0366 -0.2052 256 ARG D N 9383 C CA . ARG D 175 ? 1.1279 1.0401 0.8748 -0.3887 -0.0486 -0.1928 256 ARG D CA 9384 C C . ARG D 175 ? 1.2042 1.1168 0.9521 -0.3677 -0.0521 -0.1844 256 ARG D C 9385 O O . ARG D 175 ? 1.2334 1.1417 0.9679 -0.3678 -0.0527 -0.1893 256 ARG D O 9386 C CB . ARG D 175 ? 1.2247 1.1770 0.9727 -0.4036 -0.0597 -0.1958 256 ARG D CB 9387 C CG . ARG D 175 ? 1.2246 1.2154 0.9875 -0.3901 -0.0723 -0.1828 256 ARG D CG 9388 C CD . ARG D 175 ? 1.1104 1.1441 0.8787 -0.4038 -0.0831 -0.1835 256 ARG D CD 9389 N NE . ARG D 175 ? 1.2329 1.2728 0.9844 -0.4211 -0.0852 -0.1956 256 ARG D NE 9390 C CZ . ARG D 175 ? 1.4315 1.4780 1.1781 -0.4436 -0.0842 -0.2061 256 ARG D CZ 9391 N NH1 . ARG D 175 ? 1.4285 1.4760 1.1863 -0.4506 -0.0809 -0.2054 256 ARG D NH1 9392 N NH2 . ARG D 175 ? 1.5934 1.6450 1.3276 -0.4517 -0.0842 -0.2133 256 ARG D NH2 9393 N N . LEU D 176 ? 1.2382 1.1553 1.0015 -0.3502 -0.0539 -0.1719 257 LEU D N 9394 C CA . LEU D 176 ? 1.2097 1.1258 0.9750 -0.3301 -0.0564 -0.1634 257 LEU D CA 9395 C C . LEU D 176 ? 1.1369 1.0884 0.9175 -0.3199 -0.0675 -0.1515 257 LEU D C 9396 O O . LEU D 176 ? 1.1632 1.1310 0.9576 -0.3210 -0.0703 -0.1461 257 LEU D O 9397 C CB . LEU D 176 ? 1.1840 1.0679 0.9523 -0.3160 -0.0468 -0.1592 257 LEU D CB 9398 C CG . LEU D 176 ? 1.2273 1.0730 0.9826 -0.3236 -0.0340 -0.1692 257 LEU D CG 9399 C CD1 . LEU D 176 ? 1.0634 0.8818 0.8235 -0.3074 -0.0256 -0.1631 257 LEU D CD1 9400 C CD2 . LEU D 176 ? 1.1290 0.9639 0.8656 -0.3302 -0.0319 -0.1792 257 LEU D CD2 9401 N N . VAL D 177 ? 1.0253 0.9881 0.8029 -0.3097 -0.0733 -0.1472 258 VAL D N 9402 C CA . VAL D 177 ? 0.9368 0.9271 0.7281 -0.2960 -0.0821 -0.1346 258 VAL D CA 9403 C C . VAL D 177 ? 0.8588 0.8356 0.6485 -0.2773 -0.0806 -0.1284 258 VAL D C 9404 O O . VAL D 177 ? 0.9662 0.9327 0.7426 -0.2771 -0.0792 -0.1333 258 VAL D O 9405 C CB . VAL D 177 ? 0.8991 0.9282 0.6910 -0.3040 -0.0933 -0.1339 258 VAL D CB 9406 C CG1 . VAL D 177 ? 0.9969 1.0237 0.7709 -0.3197 -0.0932 -0.1461 258 VAL D CG1 9407 C CG2 . VAL D 177 ? 0.8587 0.9087 0.6573 -0.2873 -0.1010 -0.1222 258 VAL D CG2 9408 N N . ASN D 178 ? 0.9946 0.9710 0.7978 -0.2623 -0.0804 -0.1181 259 ASN D N 9409 C CA . ASN D 178 ? 1.0323 0.9955 0.8358 -0.2446 -0.0784 -0.1118 259 ASN D CA 9410 C C . ASN D 178 ? 0.9991 0.9289 0.7896 -0.2439 -0.0693 -0.1191 259 ASN D C 9411 O O . ASN D 178 ? 1.1130 1.0366 0.8978 -0.2345 -0.0690 -0.1175 259 ASN D O 9412 C CB . ASN D 178 ? 0.9355 0.9221 0.7387 -0.2367 -0.0869 -0.1055 259 ASN D CB 9413 C CG . ASN D 178 ? 1.0869 1.1044 0.9046 -0.2322 -0.0950 -0.0957 259 ASN D CG 9414 O OD1 . ASN D 178 ? 1.2010 1.2239 1.0294 -0.2354 -0.0946 -0.0937 259 ASN D OD1 9415 N ND2 . ASN D 178 ? 1.2030 1.2409 1.0206 -0.2246 -0.1020 -0.0892 259 ASN D ND2 9416 N N . GLY D 179 ? 0.9295 0.8379 0.7153 -0.2538 -0.0614 -0.1270 260 GLY D N 9417 C CA . GLY D 179 ? 0.9591 0.8345 0.7332 -0.2523 -0.0516 -0.1334 260 GLY D CA 9418 C C . GLY D 179 ? 1.1159 0.9837 0.8722 -0.2656 -0.0495 -0.1451 260 GLY D C 9419 O O . GLY D 179 ? 1.1434 0.9827 0.8889 -0.2659 -0.0405 -0.1516 260 GLY D O 9420 N N . THR D 180 ? 1.1234 1.0167 0.8763 -0.2764 -0.0576 -0.1479 261 THR D N 9421 C CA . THR D 180 ? 1.2594 1.1485 0.9947 -0.2891 -0.0566 -0.1590 261 THR D CA 9422 C C . THR D 180 ? 1.2464 1.1370 0.9759 -0.3103 -0.0553 -0.1694 261 THR D C 9423 O O . THR D 180 ? 1.2749 1.1866 1.0152 -0.3166 -0.0604 -0.1665 261 THR D O 9424 C CB . THR D 180 ? 1.3645 1.2799 1.0964 -0.2859 -0.0663 -0.1556 261 THR D CB 9425 O OG1 . THR D 180 ? 1.4131 1.3248 1.1500 -0.2669 -0.0666 -0.1464 261 THR D OG1 9426 C CG2 . THR D 180 ? 1.3182 1.2276 1.0306 -0.2980 -0.0649 -0.1671 261 THR D CG2 9427 N N . SER D 181 ? 1.0546 0.9221 0.7670 -0.3214 -0.0478 -0.1815 262 SER D N 9428 C CA . SER D 181 ? 1.2131 1.0804 0.9173 -0.3433 -0.0459 -0.1929 262 SER D CA 9429 C C . SER D 181 ? 1.1624 1.0677 0.8661 -0.3544 -0.0577 -0.1941 262 SER D C 9430 O O . SER D 181 ? 1.1449 1.0621 0.8401 -0.3528 -0.0629 -0.1948 262 SER D O 9431 C CB . SER D 181 ? 1.2964 1.1311 0.9805 -0.3521 -0.0354 -0.2058 262 SER D CB 9432 O OG . SER D 181 ? 1.3483 1.1508 1.0319 -0.3538 -0.0236 -0.2092 262 SER D OG 9433 N N . ALA D 182 ? 1.1514 1.0769 0.8646 -0.3653 -0.0620 -0.1937 263 ALA D N 9434 C CA . ALA D 182 ? 1.2094 1.1743 0.9242 -0.3759 -0.0735 -0.1941 263 ALA D CA 9435 C C . ALA D 182 ? 1.3528 1.3142 1.0563 -0.4003 -0.0703 -0.2082 263 ALA D C 9436 O O . ALA D 182 ? 1.3990 1.3885 1.1091 -0.4131 -0.0767 -0.2091 263 ALA D O 9437 C CB . ALA D 182 ? 1.2629 1.2577 0.9985 -0.3690 -0.0815 -0.1821 263 ALA D CB 9438 N N . GLY D 183 ? 1.4132 1.3396 1.1000 -0.4067 -0.0598 -0.2191 264 GLY D N 9439 C CA . GLY D 183 ? 1.4060 1.3226 1.0827 -0.4260 -0.0535 -0.2312 264 GLY D CA 9440 C C . GLY D 183 ? 1.3107 1.2028 0.9930 -0.4304 -0.0433 -0.2330 264 GLY D C 9441 O O . GLY D 183 ? 1.2397 1.1282 0.9346 -0.4219 -0.0433 -0.2254 264 GLY D O 9442 N N . TRP D 184 ? 1.3343 1.2106 1.0080 -0.4425 -0.0343 -0.2419 265 TRP D N 9443 C CA . TRP D 184 ? 1.1916 1.0377 0.8666 -0.4461 -0.0221 -0.2445 265 TRP D CA 9444 C C . TRP D 184 ? 1.3163 1.1652 0.9861 -0.4639 -0.0177 -0.2528 265 TRP D C 9445 O O . TRP D 184 ? 1.2624 1.1381 0.9286 -0.4730 -0.0246 -0.2562 265 TRP D O 9446 C CB . TRP D 184 ? 1.1514 0.9534 0.8148 -0.4361 -0.0098 -0.2472 265 TRP D CB 9447 C CG . TRP D 184 ? 1.3575 1.1516 1.0039 -0.4374 -0.0073 -0.2545 265 TRP D CG 9448 C CD1 . TRP D 184 ? 1.4241 1.2308 1.0653 -0.4297 -0.0146 -0.2528 265 TRP D CD1 9449 C CD2 . TRP D 184 ? 1.4259 1.1984 1.0579 -0.4472 0.0033 -0.2644 265 TRP D CD2 9450 N NE1 . TRP D 184 ? 1.4309 1.2253 1.0557 -0.4342 -0.0092 -0.2610 265 TRP D NE1 9451 C CE2 . TRP D 184 ? 1.4629 1.2362 1.0818 -0.4449 0.0018 -0.2683 265 TRP D CE2 9452 C CE3 . TRP D 184 ? 1.5166 1.2688 1.1451 -0.4577 0.0143 -0.2702 265 TRP D CE3 9453 C CZ2 . TRP D 184 ? 1.4757 1.2304 1.0784 -0.4529 0.0108 -0.2780 265 TRP D CZ2 9454 C CZ3 . TRP D 184 ? 1.5667 1.3000 1.1787 -0.4657 0.0233 -0.2798 265 TRP D CZ3 9455 C CH2 . TRP D 184 ? 1.5252 1.2600 1.1247 -0.4633 0.0214 -0.2836 265 TRP D CH2 9456 N N . LYS D 185 ? 1.3213 1.1425 0.9906 -0.4685 -0.0059 -0.2559 266 LYS D N 9457 C CA . LYS D 185 ? 1.4775 1.2975 1.1414 -0.4855 -0.0002 -0.2639 266 LYS D CA 9458 C C . LYS D 185 ? 1.5492 1.3238 1.2040 -0.4863 0.0166 -0.2688 266 LYS D C 9459 O O . LYS D 185 ? 1.6046 1.3566 1.2650 -0.4763 0.0226 -0.2636 266 LYS D O 9460 C CB . LYS D 185 ? 1.5290 1.3816 1.2086 -0.4950 -0.0076 -0.2602 266 LYS D CB 9461 C CG . LYS D 185 ? 1.6379 1.5022 1.3121 -0.5141 -0.0058 -0.2684 266 LYS D CG 9462 C CD . LYS D 185 ? 1.6390 1.5505 1.3281 -0.5216 -0.0185 -0.2640 266 LYS D CD 9463 C CE . LYS D 185 ? 1.6715 1.5987 1.3544 -0.5404 -0.0181 -0.2724 266 LYS D CE 9464 N NZ . LYS D 185 ? 1.6609 1.6176 1.3594 -0.5495 -0.0231 -0.2689 266 LYS D NZ 9465 N N . ALA D 186 ? 1.5117 1.2730 1.1523 -0.4979 0.0244 -0.2785 267 ALA D N 9466 C CA . ALA D 186 ? 1.5138 1.2338 1.1454 -0.4998 0.0407 -0.2832 267 ALA D CA 9467 C C . ALA D 186 ? 1.5698 1.2947 1.2102 -0.5114 0.0434 -0.2831 267 ALA D C 9468 O O . ALA D 186 ? 1.5874 1.3462 1.2344 -0.5237 0.0347 -0.2841 267 ALA D O 9469 C CB . ALA D 186 ? 1.2062 0.9092 0.8186 -0.5077 0.0484 -0.2936 267 ALA D CB 9470 N N . LEU D 187 ? 1.5576 1.2495 1.1984 -0.5068 0.0553 -0.2813 268 LEU D N 9471 C CA . LEU D 187 ? 1.5875 1.2804 1.2358 -0.5173 0.0593 -0.2810 268 LEU D CA 9472 C C . LEU D 187 ? 1.6171 1.2765 1.2503 -0.5268 0.0749 -0.2897 268 LEU D C 9473 O O . LEU D 187 ? 1.6651 1.2867 1.2880 -0.5175 0.0867 -0.2906 268 LEU D O 9474 C CB . LEU D 187 ? 1.4724 1.1559 1.1346 -0.5051 0.0608 -0.2711 268 LEU D CB 9475 C CG . LEU D 187 ? 1.4466 1.1562 1.1240 -0.4932 0.0476 -0.2613 268 LEU D CG 9476 C CD1 . LEU D 187 ? 1.2447 0.9290 0.9289 -0.4783 0.0539 -0.2532 268 LEU D CD1 9477 C CD2 . LEU D 187 ? 1.4632 1.2169 1.1555 -0.5031 0.0351 -0.2583 268 LEU D CD2 9478 N N . ASP D 188 ? 1.4546 1.1284 1.0863 -0.5451 0.0749 -0.2959 269 ASP D N 9479 C CA . ASP D 188 ? 1.5028 1.1464 1.1206 -0.5558 0.0897 -0.3041 269 ASP D CA 9480 C C . ASP D 188 ? 1.5864 1.1983 1.2080 -0.5485 0.1013 -0.2990 269 ASP D C 9481 O O . ASP D 188 ? 1.4853 1.1087 1.1191 -0.5533 0.0997 -0.2950 269 ASP D O 9482 C CB . ASP D 188 ? 1.5817 1.2511 1.1994 -0.5773 0.0864 -0.3109 269 ASP D CB 9483 C CG . ASP D 188 ? 1.6345 1.2751 1.2344 -0.5903 0.1007 -0.3214 269 ASP D CG 9484 O OD1 . ASP D 188 ? 1.6840 1.2897 1.2698 -0.5831 0.1113 -0.3245 269 ASP D OD1 9485 O OD2 . ASP D 188 ? 1.7679 1.4212 1.3680 -0.6077 0.1016 -0.3265 269 ASP D OD2 9486 N N . THR D 189 ? 1.7457 1.3186 1.3574 -0.5358 0.1128 -0.2984 270 THR D N 9487 C CA . THR D 189 ? 1.7333 1.2725 1.3458 -0.5290 0.1258 -0.2941 270 THR D CA 9488 C C . THR D 189 ? 1.6938 1.1969 1.2875 -0.5353 0.1420 -0.3024 270 THR D C 9489 O O . THR D 189 ? 1.7480 1.2143 1.3359 -0.5240 0.1548 -0.2996 270 THR D O 9490 C CB . THR D 189 ? 1.3727 0.8956 0.9917 -0.5064 0.1267 -0.2840 270 THR D CB 9491 O OG1 . THR D 189 ? 1.4874 0.9942 1.0948 -0.4962 0.1294 -0.2863 270 THR D OG1 9492 C CG2 . THR D 189 ? 1.3015 0.8594 0.9395 -0.5008 0.1113 -0.2755 270 THR D CG2 9493 N N . THR D 190 ? 1.6001 1.1144 1.1840 -0.5531 0.1414 -0.3125 271 THR D N 9494 C CA . THR D 190 ? 1.6906 1.1735 1.2574 -0.5631 0.1570 -0.3211 271 THR D CA 9495 C C . THR D 190 ? 1.5951 1.0673 1.1674 -0.5693 0.1647 -0.3188 271 THR D C 9496 O O . THR D 190 ? 1.5608 1.0618 1.1454 -0.5795 0.1565 -0.3174 271 THR D O 9497 C CB . THR D 190 ? 1.8087 1.3066 1.3633 -0.5820 0.1548 -0.3328 271 THR D CB 9498 O OG1 . THR D 190 ? 1.9869 1.5306 1.5536 -0.5933 0.1395 -0.3328 271 THR D OG1 9499 C CG2 . THR D 190 ? 1.6365 1.1273 1.1791 -0.5747 0.1543 -0.3364 271 THR D CG2 9500 N N . GLY D 191 ? 1.5462 0.9767 1.1096 -0.5619 0.1807 -0.3178 272 GLY D N 9501 C CA . GLY D 191 ? 1.6731 1.0883 1.2407 -0.5647 0.1896 -0.3145 272 GLY D CA 9502 C C . GLY D 191 ? 1.7621 1.1547 1.3366 -0.5432 0.1946 -0.3033 272 GLY D C 9503 O O . GLY D 191 ? 1.9051 1.2650 1.4743 -0.5392 0.2087 -0.3012 272 GLY D O 9504 N N . PHE D 192 ? 1.7259 1.1359 1.3119 -0.5289 0.1832 -0.2959 273 PHE D N 9505 C CA . PHE D 192 ? 1.7159 1.1146 1.3131 -0.5106 0.1846 -0.2840 273 PHE D CA 9506 C C . PHE D 192 ? 1.8238 1.2290 1.4266 -0.4922 0.1764 -0.2777 273 PHE D C 9507 O O . PHE D 192 ? 1.8098 1.2229 1.4058 -0.4917 0.1714 -0.2824 273 PHE D O 9508 C CB . PHE D 192 ? 1.5959 1.0191 1.2104 -0.5166 0.1772 -0.2785 273 PHE D CB 9509 C CG . PHE D 192 ? 1.6104 1.0798 1.2376 -0.5231 0.1589 -0.2783 273 PHE D CG 9510 C CD1 . PHE D 192 ? 1.5140 1.0075 1.1364 -0.5410 0.1527 -0.2878 273 PHE D CD1 9511 C CD2 . PHE D 192 ? 1.6130 1.1023 1.2567 -0.5110 0.1480 -0.2685 273 PHE D CD2 9512 C CE1 . PHE D 192 ? 1.4589 0.9959 1.0928 -0.5461 0.1360 -0.2870 273 PHE D CE1 9513 C CE2 . PHE D 192 ? 1.4665 0.9987 1.1216 -0.5165 0.1314 -0.2680 273 PHE D CE2 9514 C CZ . PHE D 192 ? 1.4435 0.9999 1.0939 -0.5337 0.1254 -0.2769 273 PHE D CZ 9515 N N . ASN D 193 ? 1.7724 1.1743 1.3875 -0.4774 0.1753 -0.2668 274 ASN D N 9516 C CA . ASN D 193 ? 1.6560 1.0581 1.2768 -0.4578 0.1701 -0.2592 274 ASN D CA 9517 C C . ASN D 193 ? 1.6521 1.0806 1.2925 -0.4525 0.1581 -0.2499 274 ASN D C 9518 O O . ASN D 193 ? 1.6867 1.1146 1.3355 -0.4551 0.1607 -0.2452 274 ASN D O 9519 C CB . ASN D 193 ? 1.6302 0.9913 1.2432 -0.4409 0.1850 -0.2545 274 ASN D CB 9520 C CG . ASN D 193 ? 1.5531 0.9133 1.1732 -0.4198 0.1806 -0.2456 274 ASN D CG 9521 O OD1 . ASN D 193 ? 1.4815 0.8593 1.1025 -0.4167 0.1707 -0.2470 274 ASN D OD1 9522 N ND2 . ASN D 193 ? 1.5332 0.8733 1.1583 -0.4052 0.1879 -0.2361 274 ASN D ND2 9523 N N . PHE D 194 ? 1.6299 1.0808 1.2770 -0.4451 0.1456 -0.2471 275 PHE D N 9524 C CA . PHE D 194 ? 1.5350 1.0159 1.2001 -0.4422 0.1325 -0.2394 275 PHE D CA 9525 C C . PHE D 194 ? 1.5439 1.0210 1.2148 -0.4218 0.1288 -0.2308 275 PHE D C 9526 O O . PHE D 194 ? 1.6452 1.1477 1.3215 -0.4195 0.1162 -0.2300 275 PHE D O 9527 C CB . PHE D 194 ? 1.4120 0.9342 1.0817 -0.4569 0.1179 -0.2447 275 PHE D CB 9528 C CG . PHE D 194 ? 1.4677 1.0234 1.1561 -0.4595 0.1059 -0.2380 275 PHE D CG 9529 C CD1 . PHE D 194 ? 1.4722 1.0295 1.1686 -0.4673 0.1094 -0.2355 275 PHE D CD1 9530 C CD2 . PHE D 194 ? 1.4914 1.0774 1.1891 -0.4544 0.0914 -0.2343 275 PHE D CD2 9531 C CE1 . PHE D 194 ? 1.3677 0.9566 1.0816 -0.4697 0.0988 -0.2292 275 PHE D CE1 9532 C CE2 . PHE D 194 ? 1.3862 1.0034 1.1010 -0.4567 0.0807 -0.2279 275 PHE D CE2 9533 C CZ . PHE D 194 ? 1.3591 0.9781 1.0823 -0.4643 0.0845 -0.2254 275 PHE D CZ 9534 N N . GLU D 195 ? 1.5685 1.0149 1.2383 -0.4070 0.1396 -0.2242 276 GLU D N 9535 C CA . GLU D 195 ? 1.5571 0.9972 1.2315 -0.3869 0.1375 -0.2160 276 GLU D CA 9536 C C . GLU D 195 ? 1.4571 0.9137 1.1486 -0.3807 0.1298 -0.2060 276 GLU D C 9537 O O . GLU D 195 ? 1.5470 1.0033 1.2454 -0.3855 0.1327 -0.2023 276 GLU D O 9538 C CB . GLU D 195 ? 1.5303 0.9303 1.1949 -0.3720 0.1528 -0.2132 276 GLU D CB 9539 C CG . GLU D 195 ? 1.6310 1.0109 1.2780 -0.3763 0.1621 -0.2224 276 GLU D CG 9540 C CD . GLU D 195 ? 1.6830 1.0757 1.3244 -0.3755 0.1545 -0.2278 276 GLU D CD 9541 O OE1 . GLU D 195 ? 1.6885 1.0760 1.3310 -0.3592 0.1533 -0.2229 276 GLU D OE1 9542 O OE2 . GLU D 195 ? 1.7649 1.1732 1.4005 -0.3912 0.1499 -0.2368 276 GLU D OE2 9543 N N . PHE D 196 ? 1.2984 0.7688 0.9959 -0.3701 0.1203 -0.2015 277 PHE D N 9544 C CA . PHE D 196 ? 1.2927 0.7768 1.0053 -0.3620 0.1132 -0.1916 277 PHE D CA 9545 C C . PHE D 196 ? 1.3001 0.8159 1.0258 -0.3755 0.1039 -0.1904 277 PHE D C 9546 O O . PHE D 196 ? 1.3072 0.8241 1.0438 -0.3706 0.1056 -0.1819 277 PHE D O 9547 C CB . PHE D 196 ? 1.3439 0.7985 1.0581 -0.3471 0.1247 -0.1827 277 PHE D CB 9548 C CG . PHE D 196 ? 1.4087 0.8299 1.1099 -0.3346 0.1369 -0.1835 277 PHE D CG 9549 C CD1 . PHE D 196 ? 1.4684 0.8866 1.1659 -0.3215 0.1343 -0.1827 277 PHE D CD1 9550 C CD2 . PHE D 196 ? 1.3237 0.7171 1.0164 -0.3356 0.1510 -0.1848 277 PHE D CD2 9551 C CE1 . PHE D 196 ? 1.4398 0.8291 1.1261 -0.3097 0.1457 -0.1832 277 PHE D CE1 9552 C CE2 . PHE D 196 ? 1.2805 0.6444 0.9616 -0.3237 0.1625 -0.1851 277 PHE D CE2 9553 C CZ . PHE D 196 ? 1.3967 0.7591 1.0750 -0.3106 0.1597 -0.1843 277 PHE D CZ 9554 N N . PRO D 197 ? 1.3969 0.9424 1.1231 -0.3899 0.0934 -0.1973 278 PRO D N 9555 C CA . PRO D 197 ? 1.3399 0.9185 1.0803 -0.4009 0.0843 -0.1948 278 PRO D CA 9556 C C . PRO D 197 ? 1.2826 0.8873 1.0426 -0.3813 0.0746 -0.1800 278 PRO D C 9557 O O . PRO D 197 ? 1.2185 0.8350 0.9819 -0.3657 0.0673 -0.1748 278 PRO D O 9558 C CB . PRO D 197 ? 1.2987 0.9073 1.0363 -0.4153 0.0738 -0.2032 278 PRO D CB 9559 C CG . PRO D 197 ? 1.3394 0.9376 1.0655 -0.4061 0.0732 -0.2066 278 PRO D CG 9560 C CD . PRO D 197 ? 1.3835 0.9386 1.0998 -0.3941 0.0883 -0.2054 278 PRO D CD 9561 N N . THR D 198 ? 1.2873 0.8988 1.0592 -0.3822 0.0754 -0.1733 279 THR D N 9562 C CA . THR D 198 ? 1.2485 0.8871 1.0390 -0.3663 0.0661 -0.1601 279 THR D CA 9563 C C . THR D 198 ? 1.2970 0.9743 1.0995 -0.3802 0.0558 -0.1605 279 THR D C 9564 O O . THR D 198 ? 1.3142 0.9892 1.1152 -0.3985 0.0604 -0.1662 279 THR D O 9565 C CB . THR D 198 ? 1.2230 0.8390 1.0183 -0.3521 0.0751 -0.1503 279 THR D CB 9566 O OG1 . THR D 198 ? 1.3363 0.9805 1.1497 -0.3394 0.0660 -0.1384 279 THR D OG1 9567 C CG2 . THR D 198 ? 1.2335 0.8270 1.0235 -0.3675 0.0870 -0.1548 279 THR D CG2 9568 N N . CYS D 199 ? 1.3713 1.0843 1.1855 -0.3717 0.0423 -0.1543 280 CYS D N 9569 C CA . CYS D 199 ? 1.3254 1.0774 1.1482 -0.3857 0.0316 -0.1566 280 CYS D CA 9570 C C . CYS D 199 ? 1.3314 1.1176 1.1742 -0.3755 0.0219 -0.1446 280 CYS D C 9571 O O . CYS D 199 ? 1.4168 1.1984 1.2670 -0.3561 0.0220 -0.1343 280 CYS D O 9572 C CB . CYS D 199 ? 1.1931 0.9604 1.0079 -0.3901 0.0234 -0.1634 280 CYS D CB 9573 S SG . CYS D 199 ? 1.5884 1.3168 1.3787 -0.4013 0.0344 -0.1779 280 CYS D SG 9574 N N . TYR D 200 ? 1.1992 1.0199 1.0504 -0.3888 0.0136 -0.1462 281 TYR D N 9575 C CA . TYR D 200 ? 1.0655 0.9234 0.9352 -0.3799 0.0031 -0.1356 281 TYR D CA 9576 C C . TYR D 200 ? 1.0768 0.9745 0.9513 -0.3946 -0.0076 -0.1397 281 TYR D C 9577 O O . TYR D 200 ? 1.0893 0.9854 0.9530 -0.4131 -0.0065 -0.1512 281 TYR D O 9578 C CB . TYR D 200 ? 1.0205 0.8751 0.9012 -0.3780 0.0085 -0.1286 281 TYR D CB 9579 C CG . TYR D 200 ? 1.0500 0.9043 0.9296 -0.4007 0.0139 -0.1360 281 TYR D CG 9580 C CD1 . TYR D 200 ? 1.1765 0.9937 1.0413 -0.4126 0.0264 -0.1450 281 TYR D CD1 9581 C CD2 . TYR D 200 ? 1.1870 1.0780 1.0802 -0.4107 0.0069 -0.1340 281 TYR D CD2 9582 C CE1 . TYR D 200 ? 1.2989 1.1145 1.1619 -0.4346 0.0321 -0.1524 281 TYR D CE1 9583 C CE2 . TYR D 200 ? 1.2813 1.1731 1.1737 -0.4326 0.0120 -0.1411 281 TYR D CE2 9584 C CZ . TYR D 200 ? 1.3302 1.1836 1.2073 -0.4450 0.0247 -0.1505 281 TYR D CZ 9585 O OH . TYR D 200 ? 1.4058 1.2581 1.2812 -0.4677 0.0305 -0.1581 281 TYR D OH 9586 N N . TYR D 201 ? 1.1373 1.0708 1.0277 -0.3860 -0.0177 -0.1304 282 TYR D N 9587 C CA . TYR D 201 ? 1.1673 1.1425 1.0638 -0.3960 -0.0292 -0.1320 282 TYR D CA 9588 C C . TYR D 201 ? 1.2488 1.2563 1.1630 -0.4006 -0.0333 -0.1259 282 TYR D C 9589 O O . TYR D 201 ? 1.2064 1.2168 1.1326 -0.3860 -0.0330 -0.1152 282 TYR D O 9590 C CB . TYR D 201 ? 1.0229 1.0159 0.9205 -0.3802 -0.0392 -0.1266 282 TYR D CB 9591 C CG . TYR D 201 ? 1.1012 1.1387 1.0056 -0.3874 -0.0514 -0.1263 282 TYR D CG 9592 C CD1 . TYR D 201 ? 1.1999 1.2716 1.1219 -0.3794 -0.0589 -0.1158 282 TYR D CD1 9593 C CD2 . TYR D 201 ? 1.1730 1.2189 1.0659 -0.4019 -0.0551 -0.1365 282 TYR D CD2 9594 C CE1 . TYR D 201 ? 1.3665 1.4800 1.2951 -0.3850 -0.0698 -0.1149 282 TYR D CE1 9595 C CE2 . TYR D 201 ? 1.2374 1.3259 1.1365 -0.4083 -0.0665 -0.1358 282 TYR D CE2 9596 C CZ . TYR D 201 ? 1.3744 1.4968 1.2915 -0.3995 -0.0738 -0.1247 282 TYR D CZ 9597 O OH . TYR D 201 ? 1.4304 1.5959 1.3539 -0.4048 -0.0848 -0.1233 282 TYR D OH 9598 N N . THR D 202 ? 1.2458 1.2771 1.1610 -0.4214 -0.0367 -0.1330 283 THR D N 9599 C CA . THR D 202 ? 1.3187 1.3920 1.2512 -0.4265 -0.0441 -0.1276 283 THR D CA 9600 C C . THR D 202 ? 1.3741 1.4766 1.3042 -0.4485 -0.0503 -0.1368 283 THR D C 9601 O O . THR D 202 ? 1.4262 1.5117 1.3406 -0.4632 -0.0467 -0.1488 283 THR D O 9602 C CB . THR D 202 ? 1.3246 1.3915 1.2670 -0.4307 -0.0364 -0.1241 283 THR D CB 9603 O OG1 . THR D 202 ? 1.2883 1.3104 1.2178 -0.4370 -0.0232 -0.1307 283 THR D OG1 9604 C CG2 . THR D 202 ? 1.3088 1.3845 1.2660 -0.4086 -0.0386 -0.1097 283 THR D CG2 9605 N N . SER D 203 ? 1.3374 1.4842 1.2831 -0.4504 -0.0594 -0.1311 284 SER D N 9606 C CA . SER D 203 ? 1.2783 1.4587 1.2253 -0.4725 -0.0654 -0.1388 284 SER D CA 9607 C C . SER D 203 ? 1.4193 1.6041 1.3516 -0.4801 -0.0709 -0.1477 284 SER D C 9608 O O . SER D 203 ? 1.5108 1.7067 1.4366 -0.5027 -0.0718 -0.1587 284 SER D O 9609 C CB . SER D 203 ? 1.2814 1.4481 1.2261 -0.4951 -0.0559 -0.1477 284 SER D CB 9610 O OG . SER D 203 ? 1.2983 1.4665 1.2575 -0.4898 -0.0515 -0.1393 284 SER D OG 9611 N N . GLY D 204 ? 1.4695 1.6454 1.3963 -0.4616 -0.0743 -0.1433 285 GLY D N 9612 C CA . GLY D 204 ? 1.4920 1.6708 1.4044 -0.4664 -0.0794 -0.1507 285 GLY D CA 9613 C C . GLY D 204 ? 1.4203 1.5541 1.3121 -0.4754 -0.0692 -0.1629 285 GLY D C 9614 O O . GLY D 204 ? 1.2617 1.3934 1.1395 -0.4809 -0.0719 -0.1706 285 GLY D O 9615 N N . LYS D 205 ? 1.4444 1.5418 1.3339 -0.4762 -0.0571 -0.1644 286 LYS D N 9616 C CA . LYS D 205 ? 1.3186 1.3707 1.1887 -0.4843 -0.0458 -0.1755 286 LYS D CA 9617 C C . LYS D 205 ? 1.2840 1.2948 1.1507 -0.4646 -0.0367 -0.1698 286 LYS D C 9618 O O . LYS D 205 ? 1.2169 1.2275 1.0966 -0.4501 -0.0355 -0.1589 286 LYS D O 9619 C CB . LYS D 205 ? 1.1962 1.2384 1.0625 -0.5059 -0.0371 -0.1848 286 LYS D CB 9620 C CG . LYS D 205 ? 1.3198 1.3857 1.1803 -0.5191 -0.0414 -0.1923 286 LYS D CG 9621 C CD . LYS D 205 ? 1.4101 1.5032 1.2821 -0.5323 -0.0419 -0.1922 286 LYS D CD 9622 C CE . LYS D 205 ? 1.4734 1.5988 1.3416 -0.5430 -0.0493 -0.1977 286 LYS D CE 9623 N NZ . LYS D 205 ? 1.4881 1.6438 1.3595 -0.5323 -0.0626 -0.1923 286 LYS D NZ 9624 N N . VAL D 206 ? 1.1951 1.1720 1.0440 -0.4643 -0.0303 -0.1774 287 VAL D N 9625 C CA . VAL D 206 ? 1.0653 1.0000 0.9083 -0.4487 -0.0202 -0.1741 287 VAL D CA 9626 C C . VAL D 206 ? 1.2458 1.1437 1.0772 -0.4643 -0.0062 -0.1839 287 VAL D C 9627 O O . VAL D 206 ? 1.1385 1.0226 0.9540 -0.4803 -0.0022 -0.1964 287 VAL D O 9628 C CB . VAL D 206 ? 1.0586 0.9785 0.8889 -0.4374 -0.0214 -0.1760 287 VAL D CB 9629 C CG1 . VAL D 206 ? 0.9586 0.8336 0.7814 -0.4236 -0.0097 -0.1742 287 VAL D CG1 9630 C CG2 . VAL D 206 ? 0.8622 0.8157 0.7026 -0.4212 -0.0344 -0.1662 287 VAL D CG2 9631 N N . LYS D 207 ? 1.4041 1.2858 1.2430 -0.4599 0.0017 -0.1781 288 LYS D N 9632 C CA . LYS D 207 ? 1.3518 1.1973 1.1805 -0.4736 0.0159 -0.1859 288 LYS D CA 9633 C C . LYS D 207 ? 1.2972 1.0968 1.1160 -0.4579 0.0273 -0.1836 288 LYS D C 9634 O O . LYS D 207 ? 1.3223 1.1188 1.1501 -0.4368 0.0267 -0.1720 288 LYS D O 9635 C CB . LYS D 207 ? 1.2442 1.1016 1.0866 -0.4812 0.0181 -0.1815 288 LYS D CB 9636 C CG . LYS D 207 ? 1.2199 1.1290 1.0775 -0.4895 0.0052 -0.1791 288 LYS D CG 9637 C CD . LYS D 207 ? 1.3981 1.3158 1.2607 -0.5082 0.0098 -0.1829 288 LYS D CD 9638 C CE . LYS D 207 ? 1.4588 1.4300 1.3356 -0.5163 -0.0032 -0.1810 288 LYS D CE 9639 N NZ . LYS D 207 ? 1.4798 1.4610 1.3561 -0.5338 0.0006 -0.1874 288 LYS D NZ 9640 N N . CYS D 208 ? 1.3366 1.1013 1.1367 -0.4678 0.0379 -0.1945 289 CYS D N 9641 C CA . CYS D 208 ? 1.2865 1.0085 1.0754 -0.4533 0.0484 -0.1934 289 CYS D CA 9642 C C . CYS D 208 ? 1.3208 1.0052 1.1000 -0.4578 0.0645 -0.1971 289 CYS D C 9643 O O . CYS D 208 ? 1.4424 1.1287 1.2162 -0.4722 0.0682 -0.2044 289 CYS D O 9644 C CB . CYS D 208 ? 1.2601 0.9762 1.0352 -0.4505 0.0459 -0.2000 289 CYS D CB 9645 S SG . CYS D 208 ? 1.7433 1.5006 1.5294 -0.4345 0.0284 -0.1918 289 CYS D SG 9646 N N . THR D 209 ? 1.3511 1.0018 1.1279 -0.4442 0.0742 -0.1914 290 THR D N 9647 C CA . THR D 209 ? 1.3266 0.9404 1.0943 -0.4448 0.0901 -0.1929 290 THR D CA 9648 C C . THR D 209 ? 1.3092 0.8860 1.0615 -0.4324 0.0995 -0.1950 290 THR D C 9649 O O . THR D 209 ? 1.2415 0.8050 0.9950 -0.4158 0.1001 -0.1883 290 THR D O 9650 C CB . THR D 209 ? 1.3280 0.9311 1.1059 -0.4380 0.0957 -0.1830 290 THR D CB 9651 O OG1 . THR D 209 ? 1.3512 0.9890 1.1445 -0.4486 0.0875 -0.1803 290 THR D OG1 9652 C CG2 . THR D 209 ? 1.2894 0.8549 1.0570 -0.4385 0.1122 -0.1845 290 THR D CG2 9653 N N . GLY D 210 ? 1.3495 0.9097 1.0873 -0.4405 0.1072 -0.2042 291 GLY D N 9654 C CA . GLY D 210 ? 1.4675 0.9940 1.1903 -0.4297 0.1167 -0.2067 291 GLY D CA 9655 C C . GLY D 210 ? 1.5068 0.9938 1.2229 -0.4227 0.1330 -0.2036 291 GLY D C 9656 O O . GLY D 210 ? 1.4737 0.9580 1.1959 -0.4272 0.1376 -0.1999 291 GLY D O 9657 N N . THR D 211 ? 1.4643 0.9214 1.1679 -0.4110 0.1418 -0.2046 292 THR D N 9658 C CA . THR D 211 ? 1.4755 0.8941 1.1706 -0.4033 0.1580 -0.2020 292 THR D CA 9659 C C . THR D 211 ? 1.5918 0.9897 1.2691 -0.4100 0.1675 -0.2120 292 THR D C 9660 O O . THR D 211 ? 1.5726 0.9677 1.2418 -0.4054 0.1659 -0.2162 292 THR D O 9661 C CB . THR D 211 ? 1.5067 0.9054 1.2030 -0.3802 0.1619 -0.1925 292 THR D CB 9662 O OG1 . THR D 211 ? 1.5108 0.9238 1.2226 -0.3737 0.1555 -0.1825 292 THR D OG1 9663 C CG2 . THR D 211 ? 1.5269 0.8857 1.2121 -0.3714 0.1791 -0.1906 292 THR D CG2 9664 N N . ASN D 212 ? 1.6842 1.0675 1.3552 -0.4213 0.1777 -0.2160 293 ASN D N 9665 C CA . ASN D 212 ? 1.6694 1.0310 1.3227 -0.4286 0.1880 -0.2256 293 ASN D CA 9666 C C . ASN D 212 ? 1.6173 0.9375 1.2599 -0.4131 0.2038 -0.2217 293 ASN D C 9667 O O . ASN D 212 ? 1.7498 1.0503 1.3927 -0.4101 0.2140 -0.2166 293 ASN D O 9668 C CB . ASN D 212 ? 1.6591 1.0271 1.3091 -0.4505 0.1907 -0.2335 293 ASN D CB 9669 C CG . ASN D 212 ? 1.6392 0.9962 1.2718 -0.4618 0.1967 -0.2455 293 ASN D CG 9670 O OD1 . ASN D 212 ? 1.6560 0.9851 1.2759 -0.4523 0.2062 -0.2469 293 ASN D OD1 9671 N ND2 . ASN D 212 ? 1.6177 0.9971 1.2497 -0.4823 0.1913 -0.2539 293 ASN D ND2 9672 N N . LEU D 213 ? 1.4907 0.7992 1.1243 -0.4030 0.2057 -0.2237 294 LEU D N 9673 C CA . LEU D 213 ? 1.5343 0.8067 1.1583 -0.3865 0.2198 -0.2196 294 LEU D CA 9674 C C . LEU D 213 ? 1.5898 0.8377 1.1958 -0.3960 0.2328 -0.2289 294 LEU D C 9675 O O . LEU D 213 ? 1.6277 0.8444 1.2237 -0.3842 0.2459 -0.2268 294 LEU D O 9676 C CB . LEU D 213 ? 1.5403 0.8128 1.1651 -0.3685 0.2155 -0.2156 294 LEU D CB 9677 C CG . LEU D 213 ? 1.5838 0.8651 1.2238 -0.3524 0.2092 -0.2033 294 LEU D CG 9678 C CD1 . LEU D 213 ? 1.5824 0.8993 1.2334 -0.3558 0.1918 -0.2038 294 LEU D CD1 9679 C CD2 . LEU D 213 ? 1.6132 0.8699 1.2496 -0.3295 0.2176 -0.1958 294 LEU D CD2 9680 N N . TRP D 214 ? 1.6439 0.9071 1.2462 -0.4174 0.2292 -0.2390 295 TRP D N 9681 C CA . TRP D 214 ? 1.6390 0.8822 1.2237 -0.4294 0.2404 -0.2493 295 TRP D CA 9682 C C . TRP D 214 ? 1.8674 1.0975 1.4489 -0.4420 0.2504 -0.2512 295 TRP D C 9683 O O . TRP D 214 ? 2.0158 1.2139 1.5904 -0.4337 0.2648 -0.2472 295 TRP D O 9684 C CB . TRP D 214 ? 1.6102 0.8780 1.1905 -0.4454 0.2306 -0.2604 295 TRP D CB 9685 C CG . TRP D 214 ? 1.8344 1.0814 1.3955 -0.4570 0.2420 -0.2713 295 TRP D CG 9686 C CD1 . TRP D 214 ? 1.9218 1.1303 1.4692 -0.4519 0.2595 -0.2718 295 TRP D CD1 9687 C CD2 . TRP D 214 ? 1.8665 1.1301 1.4194 -0.4756 0.2370 -0.2831 295 TRP D CD2 9688 N NE1 . TRP D 214 ? 1.9540 1.1533 1.4852 -0.4664 0.2660 -0.2834 295 TRP D NE1 9689 C CE2 . TRP D 214 ? 1.9151 1.1478 1.4492 -0.4812 0.2523 -0.2906 295 TRP D CE2 9690 C CE3 . TRP D 214 ? 1.8476 1.1497 1.4071 -0.4876 0.2212 -0.2878 295 TRP D CE3 9691 C CZ2 . TRP D 214 ? 1.9029 1.1416 1.4246 -0.4989 0.2523 -0.3029 295 TRP D CZ2 9692 C CZ3 . TRP D 214 ? 1.8516 1.1607 1.3989 -0.5048 0.2209 -0.2996 295 TRP D CZ3 9693 C CH2 . TRP D 214 ? 1.8082 1.0855 1.3368 -0.5105 0.2363 -0.3072 295 TRP D CH2 9694 N N . ASN D 215 ? 1.8981 1.1539 1.4844 -0.4618 0.2425 -0.2571 296 ASN D N 9695 C CA . ASN D 215 ? 1.8657 1.1116 1.4462 -0.4782 0.2516 -0.2621 296 ASN D CA 9696 C C . ASN D 215 ? 1.8588 1.1281 1.4553 -0.4861 0.2443 -0.2575 296 ASN D C 9697 O O . ASN D 215 ? 1.9279 1.2108 1.5239 -0.5060 0.2430 -0.2646 296 ASN D O 9698 C CB . ASN D 215 ? 1.7704 1.0239 1.3387 -0.4985 0.2512 -0.2759 296 ASN D CB 9699 C CG . ASN D 215 ? 1.8484 1.1414 1.4243 -0.5048 0.2334 -0.2795 296 ASN D CG 9700 O OD1 . ASN D 215 ? 1.8834 1.2024 1.4756 -0.4982 0.2206 -0.2724 296 ASN D OD1 9701 N ND2 . ASN D 215 ? 1.8709 1.1685 1.4347 -0.5174 0.2328 -0.2904 296 ASN D ND2 9702 N N . ASP D 216 ? 1.7129 0.9873 1.3235 -0.4708 0.2397 -0.2458 297 ASP D N 9703 C CA . ASP D 216 ? 1.6657 0.9653 1.2927 -0.4774 0.2316 -0.2409 297 ASP D CA 9704 C C . ASP D 216 ? 1.6990 0.9920 1.3377 -0.4582 0.2319 -0.2272 297 ASP D C 9705 O O . ASP D 216 ? 1.8299 1.1248 1.4729 -0.4417 0.2267 -0.2213 297 ASP D O 9706 C CB . ASP D 216 ? 1.6524 0.9958 1.2903 -0.4873 0.2134 -0.2444 297 ASP D CB 9707 C CG . ASP D 216 ? 1.7375 1.1091 1.3887 -0.5019 0.2064 -0.2438 297 ASP D CG 9708 O OD1 . ASP D 216 ? 1.8393 1.1976 1.4934 -0.5022 0.2145 -0.2390 297 ASP D OD1 9709 O OD2 . ASP D 216 ? 1.7052 1.1134 1.3639 -0.5128 0.1928 -0.2477 297 ASP D OD2 9710 N N . ALA D 217 ? 1.6025 0.8885 1.2462 -0.4608 0.2380 -0.2222 298 ALA D N 9711 C CA . ALA D 217 ? 1.6563 0.9395 1.3120 -0.4445 0.2377 -0.2090 298 ALA D CA 9712 C C . ALA D 217 ? 1.7132 1.0332 1.3875 -0.4524 0.2243 -0.2054 298 ALA D C 9713 O O . ALA D 217 ? 1.6563 0.9788 1.3421 -0.4419 0.2229 -0.1947 298 ALA D O 9714 C CB . ALA D 217 ? 1.6982 0.9470 1.3468 -0.4392 0.2542 -0.2042 298 ALA D CB 9715 N N . LYS D 218 ? 1.7289 1.0779 1.4056 -0.4709 0.2149 -0.2142 299 LYS D N 9716 C CA . LYS D 218 ? 1.7615 1.1512 1.4561 -0.4766 0.1994 -0.2113 299 LYS D CA 9717 C C . LYS D 218 ? 1.7761 1.1845 1.4745 -0.4679 0.1870 -0.2109 299 LYS D C 9718 O O . LYS D 218 ? 1.7254 1.1166 1.4120 -0.4603 0.1903 -0.2143 299 LYS D O 9719 C CB . LYS D 218 ? 1.7437 1.1589 1.4399 -0.5005 0.1948 -0.2205 299 LYS D CB 9720 C CG . LYS D 218 ? 1.8108 1.2164 1.5074 -0.5110 0.2042 -0.2202 299 LYS D CG 9721 C CD . LYS D 218 ? 1.9185 1.3626 1.6252 -0.5314 0.1945 -0.2252 299 LYS D CD 9722 C CE . LYS D 218 ? 2.0479 1.4808 1.7434 -0.5504 0.2044 -0.2348 299 LYS D CE 9723 N NZ . LYS D 218 ? 2.1199 1.5881 1.8278 -0.5682 0.1969 -0.2368 299 LYS D NZ 9724 N N . ARG D 219 ? 1.7155 1.1590 1.4300 -0.4688 0.1729 -0.2066 300 ARG D N 9725 C CA . ARG D 219 ? 1.5827 1.0471 1.3007 -0.4627 0.1603 -0.2070 300 ARG D CA 9726 C C . ARG D 219 ? 1.6327 1.1325 1.3528 -0.4809 0.1490 -0.2158 300 ARG D C 9727 O O . ARG D 219 ? 1.6612 1.1860 1.3913 -0.4938 0.1441 -0.2161 300 ARG D O 9728 C CB . ARG D 219 ? 1.4164 0.8950 1.1500 -0.4490 0.1520 -0.1956 300 ARG D CB 9729 C CG . ARG D 219 ? 1.3649 0.8105 1.0969 -0.4305 0.1628 -0.1860 300 ARG D CG 9730 C CD . ARG D 219 ? 1.3100 0.7696 1.0559 -0.4167 0.1544 -0.1753 300 ARG D CD 9731 N NE . ARG D 219 ? 1.2932 0.7215 1.0358 -0.3968 0.1639 -0.1665 300 ARG D NE 9732 C CZ . ARG D 219 ? 1.4076 0.8149 1.1403 -0.3830 0.1680 -0.1666 300 ARG D CZ 9733 N NH1 . ARG D 219 ? 1.3690 0.7819 1.0937 -0.3874 0.1637 -0.1754 300 ARG D NH1 9734 N NH2 . ARG D 219 ? 1.4507 0.8325 1.1818 -0.3645 0.1764 -0.1576 300 ARG D NH2 9735 N N . PRO D 220 ? 1.5903 1.0932 1.3008 -0.4817 0.1451 -0.2229 301 PRO D N 9736 C CA . PRO D 220 ? 1.5044 1.0438 1.2171 -0.4968 0.1330 -0.2304 301 PRO D CA 9737 C C . PRO D 220 ? 1.4534 1.0322 1.1838 -0.4936 0.1168 -0.2239 301 PRO D C 9738 O O . PRO D 220 ? 1.4279 1.0038 1.1675 -0.4793 0.1150 -0.2143 301 PRO D O 9739 C CB . PRO D 220 ? 1.5857 1.1127 1.2832 -0.4935 0.1342 -0.2373 301 PRO D CB 9740 C CG . PRO D 220 ? 1.5403 1.0370 1.2346 -0.4723 0.1408 -0.2303 301 PRO D CG 9741 C CD . PRO D 220 ? 1.5668 1.0393 1.2636 -0.4683 0.1523 -0.2241 301 PRO D CD 9742 N N . PHE D 221 ? 1.5221 1.1381 1.2571 -0.5067 0.1052 -0.2288 302 PHE D N 9743 C CA . PHE D 221 ? 1.4891 1.1455 1.2416 -0.5053 0.0902 -0.2226 302 PHE D CA 9744 C C . PHE D 221 ? 1.4711 1.1621 1.2230 -0.5130 0.0773 -0.2282 302 PHE D C 9745 O O . PHE D 221 ? 1.5532 1.2531 1.2979 -0.5281 0.0777 -0.2369 302 PHE D O 9746 C CB . PHE D 221 ? 1.4934 1.1680 1.2595 -0.5150 0.0895 -0.2189 302 PHE D CB 9747 C CG . PHE D 221 ? 1.5337 1.2424 1.3192 -0.5096 0.0770 -0.2097 302 PHE D CG 9748 C CD1 . PHE D 221 ? 1.4179 1.1719 1.2126 -0.5173 0.0624 -0.2108 302 PHE D CD1 9749 C CD2 . PHE D 221 ? 1.5697 1.2658 1.3641 -0.4965 0.0799 -0.1995 302 PHE D CD2 9750 C CE1 . PHE D 221 ? 1.4480 1.2339 1.2606 -0.5118 0.0513 -0.2019 302 PHE D CE1 9751 C CE2 . PHE D 221 ? 1.4489 1.1760 1.2607 -0.4918 0.0689 -0.1910 302 PHE D CE2 9752 C CZ . PHE D 221 ? 1.4533 1.2255 1.2744 -0.4993 0.0546 -0.1922 302 PHE D CZ 9753 N N . LEU D 222 ? 1.3828 1.0936 1.1421 -0.5025 0.0659 -0.2230 303 LEU D N 9754 C CA . LEU D 222 ? 1.4502 1.1947 1.2093 -0.5076 0.0531 -0.2269 303 LEU D CA 9755 C C . LEU D 222 ? 1.4690 1.2592 1.2473 -0.5092 0.0388 -0.2201 303 LEU D C 9756 O O . LEU D 222 ? 1.5185 1.3113 1.3098 -0.5015 0.0378 -0.2112 303 LEU D O 9757 C CB . LEU D 222 ? 1.5098 1.2416 1.2605 -0.4935 0.0509 -0.2265 303 LEU D CB 9758 C CG . LEU D 222 ? 1.4707 1.2083 1.2080 -0.4983 0.0476 -0.2351 303 LEU D CG 9759 C CD1 . LEU D 222 ? 1.3274 1.0796 1.0673 -0.4855 0.0369 -0.2307 303 LEU D CD1 9760 C CD2 . LEU D 222 ? 1.5220 1.2920 1.2601 -0.5167 0.0414 -0.2415 303 LEU D CD2 9761 N N . GLU D 223 ? 1.3881 1.2147 1.1682 -0.5192 0.0283 -0.2240 304 GLU D N 9762 C CA . GLU D 223 ? 1.3836 1.2547 1.1793 -0.5160 0.0129 -0.2171 304 GLU D CA 9763 C C . GLU D 223 ? 1.4007 1.2960 1.1897 -0.5190 0.0031 -0.2219 304 GLU D C 9764 O O . GLU D 223 ? 1.4531 1.3394 1.2282 -0.5288 0.0076 -0.2313 304 GLU D O 9765 C CB . GLU D 223 ? 1.4856 1.3877 1.2983 -0.5250 0.0088 -0.2128 304 GLU D CB 9766 C CG . GLU D 223 ? 1.7553 1.6656 1.5645 -0.5438 0.0127 -0.2207 304 GLU D CG 9767 C CD . GLU D 223 ? 1.8771 1.8305 1.7048 -0.5519 0.0045 -0.2159 304 GLU D CD 9768 O OE1 . GLU D 223 ? 1.9072 1.9011 1.7454 -0.5488 -0.0091 -0.2113 304 GLU D OE1 9769 O OE2 . GLU D 223 ? 1.8794 1.8268 1.7112 -0.5608 0.0119 -0.2165 304 GLU D OE2 9770 N N . PHE D 224 ? 1.4139 1.3375 1.2119 -0.5096 -0.0095 -0.2153 305 PHE D N 9771 C CA . PHE D 224 ? 1.4749 1.4265 1.2684 -0.5114 -0.0200 -0.2182 305 PHE D CA 9772 C C . PHE D 224 ? 1.4730 1.4676 1.2830 -0.5042 -0.0348 -0.2085 305 PHE D C 9773 O O . PHE D 224 ? 1.4592 1.4561 1.2823 -0.4957 -0.0362 -0.1999 305 PHE D O 9774 C CB . PHE D 224 ? 1.4211 1.3449 1.1976 -0.5032 -0.0165 -0.2226 305 PHE D CB 9775 C CG . PHE D 224 ? 1.3181 1.2216 1.0965 -0.4857 -0.0157 -0.2158 305 PHE D CG 9776 C CD1 . PHE D 224 ? 1.2009 1.1286 0.9858 -0.4748 -0.0277 -0.2091 305 PHE D CD1 9777 C CD2 . PHE D 224 ? 1.3161 1.1758 1.0890 -0.4796 -0.0026 -0.2159 305 PHE D CD2 9778 C CE1 . PHE D 224 ? 1.1100 1.0199 0.8979 -0.4537 -0.0261 -0.2005 305 PHE D CE1 9779 C CE2 . PHE D 224 ? 1.1909 1.0319 0.9651 -0.4633 -0.0016 -0.2096 305 PHE D CE2 9780 C CZ . PHE D 224 ? 0.9909 0.8586 0.7741 -0.4468 -0.0131 -0.2002 305 PHE D CZ 9781 N N . ASP D 225 ? 1.5013 1.5300 1.3106 -0.5073 -0.0454 -0.2096 306 ASP D N 9782 C CA . ASP D 225 ? 1.5667 1.6375 1.3902 -0.4993 -0.0596 -0.2002 306 ASP D CA 9783 C C . ASP D 225 ? 1.3550 1.4221 1.1701 -0.4866 -0.0651 -0.1986 306 ASP D C 9784 O O . ASP D 225 ? 1.1847 1.2167 0.9840 -0.4844 -0.0574 -0.2049 306 ASP D O 9785 C CB . ASP D 225 ? 1.7588 1.8739 1.5883 -0.5103 -0.0682 -0.2010 306 ASP D CB 9786 C CG . ASP D 225 ? 1.9305 2.0909 1.7789 -0.5023 -0.0813 -0.1895 306 ASP D CG 9787 O OD1 . ASP D 225 ? 1.9983 2.1557 1.8538 -0.4881 -0.0844 -0.1813 306 ASP D OD1 9788 O OD2 . ASP D 225 ? 1.8367 2.0357 1.6926 -0.5098 -0.0883 -0.1885 306 ASP D OD2 9789 N N . GLN D 226 ? 1.3140 1.4179 1.1398 -0.4780 -0.0780 -0.1900 307 GLN D N 9790 C CA . GLN D 226 ? 1.3718 1.4768 1.1912 -0.4633 -0.0837 -0.1864 307 GLN D CA 9791 C C . GLN D 226 ? 1.4015 1.5109 1.2047 -0.4722 -0.0857 -0.1955 307 GLN D C 9792 O O . GLN D 226 ? 1.4393 1.5363 1.2311 -0.4642 -0.0867 -0.1967 307 GLN D O 9793 C CB . GLN D 226 ? 1.4031 1.5466 1.2398 -0.4464 -0.0952 -0.1717 307 GLN D CB 9794 C CG . GLN D 226 ? 1.5281 1.7202 1.3690 -0.4578 -0.1072 -0.1723 307 GLN D CG 9795 C CD . GLN D 226 ? 1.5401 1.7697 1.4004 -0.4421 -0.1167 -0.1572 307 GLN D CD 9796 O OE1 . GLN D 226 ? 1.5752 1.8048 1.4504 -0.4342 -0.1142 -0.1492 307 GLN D OE1 9797 N NE2 . GLN D 226 ? 1.5042 1.7653 1.3639 -0.4370 -0.1274 -0.1530 307 GLN D NE2 9798 N N . SER D 227 ? 1.4194 1.5471 1.2223 -0.4867 -0.0859 -0.2007 309 SER D N 9799 C CA . SER D 227 ? 1.5356 1.6660 1.3231 -0.4944 -0.0864 -0.2090 309 SER D CA 9800 C C . SER D 227 ? 1.5848 1.6753 1.3568 -0.5058 -0.0725 -0.2209 309 SER D C 9801 O O . SER D 227 ? 1.6749 1.7702 1.4369 -0.5180 -0.0711 -0.2290 309 SER D O 9802 C CB . SER D 227 ? 1.4781 1.6568 1.2727 -0.5022 -0.0966 -0.2072 309 SER D CB 9803 O OG . SER D 227 ? 1.5389 1.7453 1.3529 -0.5031 -0.1010 -0.1997 309 SER D OG 9804 N N . PHE D 228 ? 1.4812 1.5324 1.2515 -0.5011 -0.0621 -0.2215 310 PHE D N 9805 C CA . PHE D 228 ? 1.5117 1.5183 1.2658 -0.5067 -0.0479 -0.2313 310 PHE D CA 9806 C C . PHE D 228 ? 1.6157 1.6175 1.3667 -0.5243 -0.0402 -0.2390 310 PHE D C 9807 O O . PHE D 228 ? 1.7067 1.6712 1.4441 -0.5290 -0.0278 -0.2469 310 PHE D O 9808 C CB . PHE D 228 ? 1.5154 1.5088 1.2518 -0.5037 -0.0472 -0.2371 310 PHE D CB 9809 C CG . PHE D 228 ? 1.5953 1.5656 1.3281 -0.4868 -0.0460 -0.2330 310 PHE D CG 9810 C CD1 . PHE D 228 ? 1.5162 1.4608 1.2552 -0.4779 -0.0397 -0.2283 310 PHE D CD1 9811 C CD2 . PHE D 228 ? 1.6737 1.6477 1.3965 -0.4799 -0.0509 -0.2337 310 PHE D CD2 9812 C CE1 . PHE D 228 ? 1.4202 1.3438 1.1557 -0.4625 -0.0384 -0.2246 310 PHE D CE1 9813 C CE2 . PHE D 228 ? 1.6532 1.6061 1.3725 -0.4646 -0.0496 -0.2301 310 PHE D CE2 9814 C CZ . PHE D 228 ? 1.4736 1.4014 1.1993 -0.4560 -0.0434 -0.2256 310 PHE D CZ 9815 N N . THR D 229 ? 1.5762 1.6147 1.3393 -0.5337 -0.0469 -0.2369 311 THR D N 9816 C CA . THR D 229 ? 1.6187 1.6509 1.3796 -0.5504 -0.0389 -0.2439 311 THR D CA 9817 C C . THR D 229 ? 1.5308 1.5289 1.2957 -0.5477 -0.0276 -0.2422 311 THR D C 9818 O O . THR D 229 ? 1.4432 1.4492 1.2230 -0.5388 -0.0310 -0.2330 311 THR D O 9819 C CB . THR D 229 ? 1.4206 1.5012 1.1940 -0.5614 -0.0483 -0.2420 311 THR D CB 9820 O OG1 . THR D 229 ? 1.6108 1.7112 1.4042 -0.5552 -0.0534 -0.2317 311 THR D OG1 9821 C CG2 . THR D 229 ? 1.3124 1.4290 1.0836 -0.5605 -0.0606 -0.2412 311 THR D CG2 9822 N N . TYR D 230 ? 1.4404 1.3998 1.1912 -0.5547 -0.0139 -0.2506 312 TYR D N 9823 C CA . TYR D 230 ? 1.3096 1.2314 1.0612 -0.5505 -0.0018 -0.2490 312 TYR D CA 9824 C C . TYR D 230 ? 1.4287 1.3316 1.1734 -0.5658 0.0100 -0.2567 312 TYR D C 9825 O O . TYR D 230 ? 1.5937 1.5003 1.3273 -0.5791 0.0117 -0.2656 312 TYR D O 9826 C CB . TYR D 230 ? 1.2469 1.1276 0.9863 -0.5371 0.0060 -0.2496 312 TYR D CB 9827 C CG . TYR D 230 ? 1.3152 1.1678 1.0338 -0.5437 0.0156 -0.2605 312 TYR D CG 9828 C CD1 . TYR D 230 ? 1.3965 1.2645 1.1054 -0.5466 0.0093 -0.2655 312 TYR D CD1 9829 C CD2 . TYR D 230 ? 1.2436 1.0539 0.9518 -0.5466 0.0313 -0.2653 312 TYR D CD2 9830 C CE1 . TYR D 230 ? 1.3678 1.2106 1.0575 -0.5527 0.0182 -0.2754 312 TYR D CE1 9831 C CE2 . TYR D 230 ? 1.1790 0.9636 0.8680 -0.5522 0.0405 -0.2751 312 TYR D CE2 9832 C CZ . TYR D 230 ? 1.3717 1.1729 1.0516 -0.5556 0.0338 -0.2802 312 TYR D CZ 9833 O OH . TYR D 230 ? 1.2605 1.0373 0.9212 -0.5615 0.0428 -0.2899 312 TYR D OH 9834 N N . THR D 231 ? 1.4320 1.3131 1.1826 -0.5636 0.0185 -0.2531 313 THR D N 9835 C CA . THR D 231 ? 1.4690 1.3253 1.2121 -0.5760 0.0316 -0.2596 313 THR D CA 9836 C C . THR D 231 ? 1.3411 1.1539 1.0825 -0.5657 0.0444 -0.2558 313 THR D C 9837 O O . THR D 231 ? 1.2592 1.0750 1.0140 -0.5546 0.0416 -0.2463 313 THR D O 9838 C CB . THR D 231 ? 1.4983 1.3884 1.2537 -0.5910 0.0273 -0.2595 313 THR D CB 9839 O OG1 . THR D 231 ? 1.4120 1.2752 1.1660 -0.5976 0.0403 -0.2612 313 THR D OG1 9840 C CG2 . THR D 231 ? 1.4229 1.3525 1.1997 -0.5833 0.0140 -0.2485 313 THR D CG2 9841 N N . PHE D 232 ? 1.3501 1.1229 1.0747 -0.5688 0.0584 -0.2630 314 PHE D N 9842 C CA . PHE D 232 ? 1.4035 1.1349 1.1254 -0.5617 0.0723 -0.2601 314 PHE D CA 9843 C C . PHE D 232 ? 1.4264 1.1598 1.1541 -0.5748 0.0781 -0.2608 314 PHE D C 9844 O O . PHE D 232 ? 1.5118 1.2592 1.2354 -0.5920 0.0783 -0.2684 314 PHE D O 9845 C CB . PHE D 232 ? 1.4146 1.1026 1.1160 -0.5589 0.0856 -0.2670 314 PHE D CB 9846 C CG . PHE D 232 ? 1.6579 1.3319 1.3543 -0.5416 0.0839 -0.2640 314 PHE D CG 9847 C CD1 . PHE D 232 ? 1.6363 1.3294 1.3274 -0.5416 0.0746 -0.2678 314 PHE D CD1 9848 C CD2 . PHE D 232 ? 1.7126 1.3543 1.4091 -0.5250 0.0919 -0.2574 314 PHE D CD2 9849 C CE1 . PHE D 232 ? 1.5575 1.2375 1.2438 -0.5259 0.0735 -0.2652 314 PHE D CE1 9850 C CE2 . PHE D 232 ? 1.6715 1.3006 1.3633 -0.5091 0.0906 -0.2548 314 PHE D CE2 9851 C CZ . PHE D 232 ? 1.6329 1.2809 1.3197 -0.5098 0.0815 -0.2589 314 PHE D CZ 9852 N N . LYS D 233 ? 1.3227 1.0428 1.0599 -0.5668 0.0829 -0.2527 315 LYS D N 9853 C CA . LYS D 233 ? 1.3933 1.1109 1.1356 -0.5776 0.0898 -0.2525 315 LYS D CA 9854 C C . LYS D 233 ? 1.5266 1.1955 1.2606 -0.5693 0.1060 -0.2505 315 LYS D C 9855 O O . LYS D 233 ? 1.5383 1.1832 1.2688 -0.5526 0.1092 -0.2458 315 LYS D O 9856 C CB . LYS D 233 ? 1.3935 1.1470 1.1578 -0.5766 0.0795 -0.2434 315 LYS D CB 9857 C CG . LYS D 233 ? 1.4406 1.2446 1.2150 -0.5814 0.0627 -0.2433 315 LYS D CG 9858 C CD . LYS D 233 ? 1.4978 1.3387 1.2926 -0.5861 0.0550 -0.2365 315 LYS D CD 9859 C CE . LYS D 233 ? 1.4845 1.3769 1.2886 -0.5916 0.0390 -0.2366 315 LYS D CE 9860 N NZ . LYS D 233 ? 1.4640 1.3944 1.2875 -0.5976 0.0322 -0.2308 315 LYS D NZ 9861 N N . GLU D 234 ? 1.7046 1.3590 1.4349 -0.5808 0.1165 -0.2538 316 GLU D N 9862 C CA . GLU D 234 ? 1.8084 1.4189 1.5321 -0.5729 0.1320 -0.2506 316 GLU D CA 9863 C C . GLU D 234 ? 1.8474 1.4654 1.5854 -0.5750 0.1335 -0.2434 316 GLU D C 9864 O O . GLU D 234 ? 1.8610 1.5026 1.6049 -0.5912 0.1309 -0.2467 316 GLU D O 9865 C CB . GLU D 234 ? 1.7821 1.3605 1.4858 -0.5830 0.1460 -0.2607 316 GLU D CB 9866 C CG . GLU D 234 ? 1.8910 1.4390 1.5786 -0.5721 0.1520 -0.2639 316 GLU D CG 9867 C CD . GLU D 234 ? 1.8628 1.3715 1.5475 -0.5534 0.1632 -0.2560 316 GLU D CD 9868 O OE1 . GLU D 234 ? 1.6741 1.1721 1.3651 -0.5518 0.1696 -0.2500 316 GLU D OE1 9869 O OE2 . GLU D 234 ? 1.9330 1.4220 1.6089 -0.5402 0.1657 -0.2557 316 GLU D OE2 9870 N N . PRO D 235 ? 1.8007 1.4000 1.5448 -0.5586 0.1375 -0.2332 317 PRO D N 9871 C CA . PRO D 235 ? 1.7819 1.3864 1.5394 -0.5593 0.1396 -0.2255 317 PRO D CA 9872 C C . PRO D 235 ? 1.8447 1.4295 1.5939 -0.5732 0.1527 -0.2309 317 PRO D C 9873 O O . PRO D 235 ? 1.8679 1.4118 1.6023 -0.5691 0.1667 -0.2329 317 PRO D O 9874 C CB . PRO D 235 ? 1.5991 1.1769 1.3586 -0.5379 0.1446 -0.2149 317 PRO D CB 9875 C CG . PRO D 235 ? 1.5426 1.0900 1.2856 -0.5281 0.1504 -0.2188 317 PRO D CG 9876 C CD . PRO D 235 ? 1.6590 1.2308 1.3972 -0.5385 0.1408 -0.2283 317 PRO D CD 9877 N N . CYS D 236 ? 1.9180 1.5324 1.6764 -0.5895 0.1482 -0.2333 318 CYS D N 9878 C CA . CYS D 236 ? 1.8916 1.4909 1.6441 -0.6037 0.1599 -0.2379 318 CYS D CA 9879 C C . CYS D 236 ? 2.0340 1.6149 1.7940 -0.5944 0.1679 -0.2275 318 CYS D C 9880 O O . CYS D 236 ? 2.1171 1.7210 1.8914 -0.6010 0.1646 -0.2233 318 CYS D O 9881 C CB . CYS D 236 ? 1.6984 1.3392 1.4593 -0.6238 0.1513 -0.2435 318 CYS D CB 9882 S SG . CYS D 236 ? 3.0214 2.6872 2.7736 -0.6354 0.1414 -0.2552 318 CYS D SG 9883 N N . LEU D 237 ? 2.0253 1.5655 1.7758 -0.5787 0.1785 -0.2231 319 LEU D N 9884 C CA . LEU D 237 ? 1.8499 1.3742 1.6082 -0.5649 0.1841 -0.2112 319 LEU D CA 9885 C C . LEU D 237 ? 1.9739 1.4477 1.7166 -0.5524 0.2000 -0.2092 319 LEU D C 9886 O O . LEU D 237 ? 2.0958 1.5503 1.8263 -0.5438 0.2024 -0.2123 319 LEU D O 9887 C CB . LEU D 237 ? 1.6556 1.2015 1.4285 -0.5497 0.1717 -0.2018 319 LEU D CB 9888 C CG . LEU D 237 ? 1.6333 1.2049 1.4264 -0.5471 0.1653 -0.1915 319 LEU D CG 9889 C CD1 . LEU D 237 ? 1.8058 1.3579 1.5987 -0.5510 0.1777 -0.1882 319 LEU D CD1 9890 C CD2 . LEU D 237 ? 1.5263 1.1493 1.3344 -0.5595 0.1500 -0.1938 319 LEU D CD2 9891 N N . GLY D 238 ? 1.9644 1.4176 1.7074 -0.5506 0.2110 -0.2036 320 GLY D N 9892 C CA . GLY D 238 ? 1.9018 1.3080 1.6297 -0.5398 0.2272 -0.2015 320 GLY D CA 9893 C C . GLY D 238 ? 1.7757 1.1654 1.5080 -0.5161 0.2290 -0.1886 320 GLY D C 9894 O O . GLY D 238 ? 1.6660 1.0178 1.3867 -0.5045 0.2421 -0.1853 320 GLY D O 9895 N N . PHE D 239 ? 1.8240 1.2427 1.5728 -0.5089 0.2161 -0.1814 321 PHE D N 9896 C CA . PHE D 239 ? 1.7488 1.1569 1.5025 -0.4863 0.2155 -0.1694 321 PHE D CA 9897 C C . PHE D 239 ? 1.6445 1.0439 1.3898 -0.4750 0.2122 -0.1722 321 PHE D C 9898 O O . PHE D 239 ? 1.6448 1.0722 1.3974 -0.4754 0.1988 -0.1739 321 PHE D O 9899 C CB . PHE D 239 ? 1.5794 1.0236 1.3537 -0.4846 0.2027 -0.1615 321 PHE D CB 9900 C CG . PHE D 239 ? 1.5527 0.9856 1.3332 -0.4635 0.2040 -0.1481 321 PHE D CG 9901 C CD1 . PHE D 239 ? 1.4879 0.8939 1.2656 -0.4555 0.2165 -0.1401 321 PHE D CD1 9902 C CD2 . PHE D 239 ? 1.5513 1.0019 1.3404 -0.4521 0.1927 -0.1432 321 PHE D CD2 9903 C CE1 . PHE D 239 ? 1.4535 0.8508 1.2368 -0.4358 0.2175 -0.1272 321 PHE D CE1 9904 C CE2 . PHE D 239 ? 1.4551 0.8961 1.2495 -0.4330 0.1939 -0.1308 321 PHE D CE2 9905 C CZ . PHE D 239 ? 1.4928 0.9075 1.2844 -0.4247 0.2062 -0.1227 321 PHE D CZ 9906 N N . LEU D 240 ? 1.6049 0.9662 1.3347 -0.4648 0.2247 -0.1725 322 LEU D N 9907 C CA . LEU D 240 ? 1.7242 1.0748 1.4438 -0.4559 0.2235 -0.1765 322 LEU D CA 9908 C C . LEU D 240 ? 1.8110 1.1686 1.5394 -0.4363 0.2154 -0.1672 322 LEU D C 9909 O O . LEU D 240 ? 1.9782 1.3218 1.7105 -0.4207 0.2202 -0.1561 322 LEU D O 9910 C CB . LEU D 240 ? 1.7062 1.0144 1.4070 -0.4506 0.2401 -0.1792 322 LEU D CB 9911 C CG . LEU D 240 ? 1.6424 0.9396 1.3325 -0.4700 0.2496 -0.1890 322 LEU D CG 9912 C CD1 . LEU D 240 ? 1.6881 0.9439 1.3584 -0.4641 0.2655 -0.1923 322 LEU D CD1 9913 C CD2 . LEU D 240 ? 1.5540 0.8824 1.2458 -0.4906 0.2391 -0.2006 322 LEU D CD2 9914 N N . GLY D 241 ? 1.6095 0.9893 1.3405 -0.4373 0.2033 -0.1716 323 GLY D N 9915 C CA . GLY D 241 ? 1.5713 0.9638 1.3117 -0.4218 0.1936 -0.1640 323 GLY D CA 9916 C C . GLY D 241 ? 1.5185 0.8867 1.2490 -0.4033 0.1978 -0.1620 323 GLY D C 9917 O O . GLY D 241 ? 1.4575 0.8207 1.1934 -0.3855 0.1968 -0.1521 323 GLY D O 9918 N N . ASP D 242 ? 1.5298 0.8835 1.2457 -0.4076 0.2027 -0.1714 324 ASP D N 9919 C CA . ASP D 242 ? 1.4839 0.8142 1.1894 -0.3912 0.2077 -0.1705 324 ASP D CA 9920 C C . ASP D 242 ? 1.4169 0.7124 1.1169 -0.3745 0.2220 -0.1616 324 ASP D C 9921 O O . ASP D 242 ? 1.3217 0.6062 1.0219 -0.3784 0.2302 -0.1586 324 ASP D O 9922 C CB . ASP D 242 ? 1.5781 0.9005 1.2687 -0.4016 0.2111 -0.1830 324 ASP D CB 9923 C CG . ASP D 242 ? 1.6005 0.9151 1.2843 -0.3883 0.2095 -0.1840 324 ASP D CG 9924 O OD1 . ASP D 242 ? 1.5839 0.8893 1.2714 -0.3686 0.2101 -0.1746 324 ASP D OD1 9925 O OD2 . ASP D 242 ? 1.4984 0.8164 1.1728 -0.3975 0.2078 -0.1942 324 ASP D OD2 9926 N N . THR D 243 ? 1.5730 0.8528 1.2685 -0.3556 0.2246 -0.1571 325 THR D N 9927 C CA . THR D 243 ? 1.5517 0.7991 1.2406 -0.3379 0.2381 -0.1488 325 THR D CA 9928 C C . THR D 243 ? 1.7111 0.9391 1.3866 -0.3287 0.2437 -0.1530 325 THR D C 9929 O O . THR D 243 ? 1.6860 0.9261 1.3641 -0.3217 0.2351 -0.1536 325 THR D O 9930 C CB . THR D 243 ? 1.4774 0.7297 1.1785 -0.3195 0.2343 -0.1349 325 THR D CB 9931 O OG1 . THR D 243 ? 1.4959 0.7654 1.2090 -0.3282 0.2299 -0.1308 325 THR D OG1 9932 C CG2 . THR D 243 ? 1.3625 0.5834 1.0566 -0.2992 0.2475 -0.1257 325 THR D CG2 9933 N N . PRO D 244 ? 1.7495 0.9474 1.4108 -0.3282 0.2585 -0.1558 326 PRO D N 9934 C CA . PRO D 244 ? 1.7903 0.9694 1.4478 -0.3326 0.2705 -0.1533 326 PRO D CA 9935 C C . PRO D 244 ? 1.7889 0.9792 1.4452 -0.3579 0.2692 -0.1633 326 PRO D C 9936 O O . PRO D 244 ? 1.7295 0.9419 1.3871 -0.3722 0.2594 -0.1727 326 PRO D O 9937 C CB . PRO D 244 ? 1.8347 0.9787 1.4757 -0.3231 0.2860 -0.1542 326 PRO D CB 9938 C CG . PRO D 244 ? 1.7824 0.9309 1.4157 -0.3280 0.2820 -0.1644 326 PRO D CG 9939 C CD . PRO D 244 ? 1.7521 0.9323 1.3990 -0.3250 0.2649 -0.1626 326 PRO D CD 9940 N N . ARG D 245 ? 1.7680 0.9439 1.4223 -0.3628 0.2791 -0.1608 327 ARG D N 9941 C CA . ARG D 245 ? 1.7607 0.9443 1.4132 -0.3863 0.2800 -0.1697 327 ARG D CA 9942 C C . ARG D 245 ? 1.8406 0.9947 1.4846 -0.3868 0.2962 -0.1670 327 ARG D C 9943 O O . ARG D 245 ? 1.8411 0.9718 1.4819 -0.3684 0.3055 -0.1574 327 ARG D O 9944 C CB . ARG D 245 ? 1.6570 0.8772 1.3271 -0.3965 0.2657 -0.1681 327 ARG D CB 9945 C CG . ARG D 245 ? 1.5912 0.8138 1.2737 -0.3833 0.2649 -0.1544 327 ARG D CG 9946 C CD . ARG D 245 ? 1.6025 0.8623 1.3025 -0.3933 0.2508 -0.1529 327 ARG D CD 9947 N NE . ARG D 245 ? 1.6402 0.8998 1.3505 -0.3838 0.2523 -0.1405 327 ARG D NE 9948 C CZ . ARG D 245 ? 1.5745 0.8350 1.2920 -0.3643 0.2489 -0.1294 327 ARG D CZ 9949 N NH1 . ARG D 245 ? 1.5805 0.8423 1.2965 -0.3524 0.2435 -0.1293 327 ARG D NH1 9950 N NH2 . ARG D 245 ? 1.5991 0.8595 1.3252 -0.3567 0.2508 -0.1184 327 ARG D NH2 9951 N N . GLY D 246 ? 1.8107 0.9661 1.4504 -0.4078 0.2998 -0.1755 328 GLY D N 9952 C CA . GLY D 246 ? 1.8693 0.9985 1.5011 -0.4108 0.3148 -0.1738 328 GLY D CA 9953 C C . GLY D 246 ? 1.9092 1.0540 1.5549 -0.4154 0.3112 -0.1669 328 GLY D C 9954 O O . GLY D 246 ? 1.7777 0.9488 1.4391 -0.4102 0.2986 -0.1605 328 GLY D O 9955 N N . ILE D 247 ? 1.9133 1.0416 1.5529 -0.4252 0.3227 -0.1682 329 ILE D N 9956 C CA . ILE D 247 ? 1.9482 1.0925 1.6002 -0.4330 0.3197 -0.1634 329 ILE D CA 9957 C C . ILE D 247 ? 1.8873 1.0703 1.5502 -0.4536 0.3053 -0.1718 329 ILE D C 9958 O O . ILE D 247 ? 1.8411 1.0308 1.4969 -0.4670 0.3024 -0.1836 329 ILE D O 9959 C CB . ILE D 247 ? 2.0205 1.1374 1.6624 -0.4399 0.3359 -0.1638 329 ILE D CB 9960 C CG1 . ILE D 247 ? 2.0553 1.1593 1.6813 -0.4586 0.3436 -0.1783 329 ILE D CG1 9961 C CG2 . ILE D 247 ? 1.9799 1.0630 1.6140 -0.4176 0.3489 -0.1529 329 ILE D CG2 9962 C CD1 . ILE D 247 ? 2.0081 1.1297 1.6376 -0.4840 0.3416 -0.1865 329 ILE D CD1 9963 N N . ASP D 248 ? 1.7873 0.9965 1.4671 -0.4557 0.2963 -0.1653 330 ASP D N 9964 C CA . ASP D 248 ? 1.6900 0.9384 1.3814 -0.4744 0.2826 -0.1721 330 ASP D CA 9965 C C . ASP D 248 ? 1.7258 0.9720 1.4094 -0.4977 0.2891 -0.1831 330 ASP D C 9966 O O . ASP D 248 ? 1.6854 0.9021 1.3584 -0.4992 0.3038 -0.1829 330 ASP D O 9967 C CB . ASP D 248 ? 1.6104 0.8860 1.3216 -0.4707 0.2729 -0.1620 330 ASP D CB 9968 C CG . ASP D 248 ? 1.6972 0.9869 1.4179 -0.4533 0.2618 -0.1545 330 ASP D CG 9969 O OD1 . ASP D 248 ? 1.8030 1.0713 1.5149 -0.4372 0.2657 -0.1523 330 ASP D OD1 9970 O OD2 . ASP D 248 ? 1.6294 0.9521 1.3664 -0.4558 0.2493 -0.1509 330 ASP D OD2 9971 N N . THR D 249 ? 1.8162 1.0938 1.5047 -0.5158 0.2782 -0.1926 333 THR D N 9972 C CA . THR D 249 ? 1.9674 1.2447 1.6470 -0.5387 0.2835 -0.2047 333 THR D CA 9973 C C . THR D 249 ? 2.0188 1.3343 1.7136 -0.5566 0.2738 -0.2066 333 THR D C 9974 O O . THR D 249 ? 1.9581 1.2985 1.6703 -0.5509 0.2641 -0.1980 333 THR D O 9975 C CB . THR D 249 ? 1.9787 1.2575 1.6464 -0.5465 0.2808 -0.2170 333 THR D CB 9976 O OG1 . THR D 249 ? 1.9296 1.2516 1.6098 -0.5549 0.2633 -0.2205 333 THR D OG1 9977 C CG2 . THR D 249 ? 1.8739 1.1252 1.5308 -0.5267 0.2857 -0.2142 333 THR D CG2 9978 N N . THR D 250 ? 1.9834 1.3037 1.6715 -0.5783 0.2769 -0.2179 334 THR D N 9979 C CA . THR D 250 ? 1.8448 1.2074 1.5464 -0.5970 0.2654 -0.2222 334 THR D CA 9980 C C . THR D 250 ? 1.6623 1.0574 1.3688 -0.5993 0.2497 -0.2273 334 THR D C 9981 O O . THR D 250 ? 1.6686 1.0497 1.3652 -0.5899 0.2498 -0.2298 334 THR D O 9982 C CB . THR D 250 ? 1.7695 1.1273 1.4616 -0.6204 0.2741 -0.2330 334 THR D CB 9983 O OG1 . THR D 250 ? 1.6794 1.0446 1.3607 -0.6332 0.2709 -0.2459 334 THR D OG1 9984 C CG2 . THR D 250 ? 1.7819 1.0928 1.4590 -0.6168 0.2937 -0.2315 334 THR D CG2 9985 N N . ASN D 251 ? 1.5795 1.0185 1.3013 -0.6113 0.2363 -0.2287 335 ASN D N 9986 C CA . ASN D 251 ? 1.6084 1.0813 1.3361 -0.6129 0.2207 -0.2325 335 ASN D CA 9987 C C . ASN D 251 ? 1.6231 1.0998 1.3373 -0.6298 0.2208 -0.2466 335 ASN D C 9988 O O . ASN D 251 ? 1.6371 1.1239 1.3498 -0.6491 0.2232 -0.2537 335 ASN D O 9989 C CB . ASN D 251 ? 1.5769 1.0978 1.3268 -0.6178 0.2058 -0.2277 335 ASN D CB 9990 C CG . ASN D 251 ? 1.6609 1.1806 1.4247 -0.6033 0.2060 -0.2140 335 ASN D CG 9991 O OD1 . ASN D 251 ? 1.6260 1.1129 1.3843 -0.5861 0.2142 -0.2069 335 ASN D OD1 9992 N ND2 . ASN D 251 ? 1.7224 1.2792 1.5047 -0.6098 0.1969 -0.2097 335 ASN D ND2 9993 N N . TYR D 252 ? 1.7869 1.2561 1.4914 -0.6228 0.2182 -0.2505 336 TYR D N 9994 C CA . TYR D 252 ? 1.7818 1.2596 1.4745 -0.6378 0.2159 -0.2635 336 TYR D CA 9995 C C . TYR D 252 ? 1.9197 1.4172 1.6145 -0.6293 0.2029 -0.2639 336 TYR D C 9996 O O . TYR D 252 ? 1.9398 1.4258 1.6369 -0.6098 0.2013 -0.2562 336 TYR D O 9997 C CB . TYR D 252 ? 1.7086 1.1426 1.3784 -0.6422 0.2331 -0.2715 336 TYR D CB 9998 C CG . TYR D 252 ? 1.6982 1.0883 1.3580 -0.6216 0.2447 -0.2653 336 TYR D CG 9999 C CD1 . TYR D 252 ? 1.8212 1.1840 1.4816 -0.6130 0.2562 -0.2572 336 TYR D CD1 10000 C CD2 . TYR D 252 ? 1.6207 0.9967 1.2700 -0.6107 0.2445 -0.2675 336 TYR D CD2 10001 C CE1 . TYR D 252 ? 1.9065 1.2305 1.5579 -0.5936 0.2670 -0.2510 336 TYR D CE1 10002 C CE2 . TYR D 252 ? 1.7129 1.0500 1.3533 -0.5915 0.2553 -0.2616 336 TYR D CE2 10003 C CZ . TYR D 252 ? 1.8899 1.2015 1.5315 -0.5829 0.2665 -0.2533 336 TYR D CZ 10004 O OH . TYR D 252 ? 1.9471 1.2217 1.5802 -0.5631 0.2772 -0.2468 336 TYR D OH 10005 N N . CYS D 253 ? 1.9037 1.4303 1.5970 -0.6440 0.1939 -0.2730 337 CYS D N 10006 C CA . CYS D 253 ? 1.8678 1.4211 1.5657 -0.6378 0.1795 -0.2729 337 CYS D CA 10007 C C . CYS D 253 ? 1.9221 1.4489 1.6022 -0.6306 0.1842 -0.2784 337 CYS D C 10008 O O . CYS D 253 ? 1.9288 1.4768 1.6086 -0.6299 0.1735 -0.2815 337 CYS D O 10009 C CB . CYS D 253 ? 1.8147 1.4158 1.5209 -0.6553 0.1663 -0.2787 337 CYS D CB 10010 S SG . CYS D 253 ? 3.3873 3.0289 3.1186 -0.6597 0.1568 -0.2701 337 CYS D SG 10011 N N . ASP D 254 ? 1.8896 1.3705 1.5549 -0.6246 0.2003 -0.2791 339 ASP D N 10012 C CA . ASP D 254 ? 1.9050 1.3584 1.5535 -0.6165 0.2063 -0.2836 339 ASP D CA 10013 C C . ASP D 254 ? 1.8958 1.3166 1.5430 -0.5930 0.2133 -0.2740 339 ASP D C 10014 O O . ASP D 254 ? 1.9230 1.3325 1.5780 -0.5847 0.2181 -0.2651 339 ASP D O 10015 C CB . ASP D 254 ? 2.0013 1.4289 1.6297 -0.6315 0.2200 -0.2951 339 ASP D CB 10016 C CG . ASP D 254 ? 2.1175 1.5574 1.7349 -0.6410 0.2148 -0.3058 339 ASP D CG 10017 O OD1 . ASP D 254 ? 2.0753 1.5265 1.6950 -0.6298 0.2054 -0.3037 339 ASP D OD1 10018 O OD2 . ASP D 254 ? 2.1159 1.5541 1.7220 -0.6600 0.2203 -0.3164 339 ASP D OD2 10019 N N . LYS D 255 ? 1.9395 1.3460 1.5768 -0.5822 0.2140 -0.2757 340 LYS D N 10020 C CA . LYS D 255 ? 1.9604 1.3373 1.5955 -0.5594 0.2203 -0.2672 340 LYS D CA 10021 C C . LYS D 255 ? 2.0939 1.4278 1.7180 -0.5556 0.2390 -0.2654 340 LYS D C 10022 O O . LYS D 255 ? 2.2703 1.5803 1.8772 -0.5642 0.2506 -0.2740 340 LYS D O 10023 C CB . LYS D 255 ? 1.8594 1.2284 1.4835 -0.5515 0.2189 -0.2713 340 LYS D CB 10024 C CG . LYS D 255 ? 1.7631 1.1728 1.3949 -0.5565 0.2014 -0.2744 340 LYS D CG 10025 C CD . LYS D 255 ? 1.7295 1.1347 1.3450 -0.5639 0.2028 -0.2854 340 LYS D CD 10026 C CE . LYS D 255 ? 1.6887 1.0549 1.2906 -0.5479 0.2142 -0.2843 340 LYS D CE 10027 N NZ . LYS D 255 ? 1.7926 1.1654 1.3847 -0.5494 0.2094 -0.2916 340 LYS D NZ 10028 N N . THR D 256 ? 1.9602 1.2841 1.5937 -0.5426 0.2422 -0.2542 341 THR D N 10029 C CA . THR D 256 ? 1.9778 1.2587 1.6005 -0.5333 0.2598 -0.2504 341 THR D CA 10030 C C . THR D 256 ? 1.9393 1.1940 1.5507 -0.5158 0.2654 -0.2493 341 THR D C 10031 O O . THR D 256 ? 1.8087 1.0696 1.4281 -0.4986 0.2582 -0.2416 341 THR D O 10032 C CB . THR D 256 ? 1.8288 1.1066 1.4645 -0.5232 0.2617 -0.2380 341 THR D CB 10033 O OG1 . THR D 256 ? 1.8428 1.0942 1.4764 -0.4995 0.2680 -0.2283 341 THR D OG1 10034 C CG2 . THR D 256 ? 1.7768 1.0971 1.4332 -0.5260 0.2449 -0.2333 341 THR D CG2 10035 N N . THR D 257 ? 2.0653 1.2913 1.6577 -0.5208 0.2783 -0.2573 342 THR D N 10036 C CA . THR D 257 ? 1.9812 1.1846 1.5617 -0.5067 0.2838 -0.2579 342 THR D CA 10037 C C . THR D 257 ? 1.8441 1.0106 1.4201 -0.4869 0.2978 -0.2482 342 THR D C 10038 O O . THR D 257 ? 1.8168 0.9603 1.3829 -0.4729 0.3047 -0.2470 342 THR D O 10039 C CB . THR D 257 ? 1.8759 1.0678 1.4377 -0.5218 0.2906 -0.2716 342 THR D CB 10040 O OG1 . THR D 257 ? 1.8569 1.0134 1.4045 -0.5265 0.3088 -0.2742 342 THR D OG1 10041 C CG2 . THR D 257 ? 1.8203 1.0486 1.3865 -0.5444 0.2786 -0.2810 342 THR D CG2 10042 N N . THR D 258 ? 1.7097 0.8725 1.2936 -0.4853 0.3014 -0.2407 343 THR D N 10043 C CA . THR D 258 ? 1.7685 0.8956 1.3467 -0.4697 0.3164 -0.2320 343 THR D CA 10044 C C . THR D 258 ? 1.7937 0.9213 1.3822 -0.4446 0.3118 -0.2189 343 THR D C 10045 O O . THR D 258 ? 1.6463 0.7950 1.2512 -0.4400 0.3022 -0.2108 343 THR D O 10046 C CB . THR D 258 ? 1.7894 0.9113 1.3703 -0.4798 0.3232 -0.2300 343 THR D CB 10047 O OG1 . THR D 258 ? 1.8285 0.9551 1.4011 -0.5045 0.3256 -0.2429 343 THR D OG1 10048 C CG2 . THR D 258 ? 1.7019 0.7841 1.2736 -0.4655 0.3407 -0.2225 343 THR D CG2 10049 N N . GLU D 259 ? 1.9218 1.0260 1.5003 -0.4286 0.3191 -0.2170 344 GLU D N 10050 C CA . GLU D 259 ? 1.9353 1.0438 1.5221 -0.4061 0.3128 -0.2072 344 GLU D CA 10051 C C . GLU D 259 ? 1.8790 1.0256 1.4778 -0.4114 0.2940 -0.2102 344 GLU D C 10052 O O . GLU D 259 ? 1.8375 1.0021 1.4506 -0.3997 0.2838 -0.2015 344 GLU D O 10053 C CB . GLU D 259 ? 1.9277 1.0304 1.5248 -0.3901 0.3152 -0.1930 344 GLU D CB 10054 C CG . GLU D 259 ? 1.9530 1.0174 1.5387 -0.3785 0.3336 -0.1874 344 GLU D CG 10055 C CD . GLU D 259 ? 2.0718 1.1345 1.6680 -0.3680 0.3353 -0.1746 344 GLU D CD 10056 O OE1 . GLU D 259 ? 2.0744 1.1532 1.6791 -0.3815 0.3307 -0.1752 344 GLU D OE1 10057 O OE2 . GLU D 259 ? 2.1256 1.1726 1.7219 -0.3461 0.3409 -0.1637 344 GLU D OE2 10058 N N . GLY D 260 ? 1.9219 1.0810 1.5142 -0.4294 0.2897 -0.2226 345 GLY D N 10059 C CA . GLY D 260 ? 1.8857 1.0809 1.4873 -0.4359 0.2725 -0.2266 345 GLY D CA 10060 C C . GLY D 260 ? 1.8781 1.0703 1.4769 -0.4200 0.2693 -0.2250 345 GLY D C 10061 O O . GLY D 260 ? 1.8504 1.0704 1.4577 -0.4199 0.2550 -0.2258 345 GLY D O 10062 N N . GLU D 261 ? 1.9531 1.1118 1.5398 -0.4064 0.2829 -0.2227 346 GLU D N 10063 C CA . GLU D 261 ? 1.8874 1.0404 1.4717 -0.3888 0.2816 -0.2198 346 GLU D CA 10064 C C . GLU D 261 ? 1.7916 0.9485 1.3896 -0.3681 0.2773 -0.2060 346 GLU D C 10065 O O . GLU D 261 ? 1.7280 0.8775 1.3318 -0.3636 0.2820 -0.1981 346 GLU D O 10066 C CB . GLU D 261 ? 2.0649 1.1813 1.6312 -0.3822 0.2984 -0.2225 346 GLU D CB 10067 C CG . GLU D 261 ? 2.1686 1.2858 1.7243 -0.3851 0.2967 -0.2316 346 GLU D CG 10068 C CD . GLU D 261 ? 2.1763 1.2645 1.7218 -0.3660 0.3085 -0.2278 346 GLU D CD 10069 O OE1 . GLU D 261 ? 2.2160 1.2897 1.7659 -0.3477 0.3144 -0.2165 346 GLU D OE1 10070 O OE2 . GLU D 261 ? 2.0491 1.1299 1.5824 -0.3693 0.3117 -0.2359 346 GLU D OE2 10071 N N . GLY D 262 ? 1.7939 0.9621 1.3967 -0.3555 0.2688 -0.2032 347 GLY D N 10072 C CA . GLY D 262 ? 1.8171 0.9937 1.4336 -0.3373 0.2627 -0.1909 347 GLY D CA 10073 C C . GLY D 262 ? 1.8154 1.0284 1.4474 -0.3468 0.2461 -0.1906 347 GLY D C 10074 O O . GLY D 262 ? 1.9970 1.2283 1.6286 -0.3663 0.2397 -0.1997 347 GLY D O 10075 N N . GLY D 263 ? 1.6511 0.8752 1.2965 -0.3332 0.2392 -0.1800 348 GLY D N 10076 C CA . GLY D 263 ? 1.7038 0.9619 1.3639 -0.3414 0.2240 -0.1791 348 GLY D CA 10077 C C . GLY D 263 ? 1.6677 0.9375 1.3400 -0.3241 0.2157 -0.1688 348 GLY D C 10078 O O . GLY D 263 ? 1.6719 0.9267 1.3412 -0.3057 0.2199 -0.1635 348 GLY D O 10079 N N . ILE D 264 ? 1.5213 0.8186 1.2076 -0.3301 0.2040 -0.1659 349 ILE D N 10080 C CA . ILE D 264 ? 1.3718 0.6834 1.0701 -0.3161 0.1948 -0.1569 349 ILE D CA 10081 C C . ILE D 264 ? 1.3021 0.6503 1.0125 -0.3294 0.1795 -0.1593 349 ILE D C 10082 O O . ILE D 264 ? 1.4096 0.7710 1.1221 -0.3473 0.1774 -0.1646 349 ILE D O 10083 C CB . ILE D 264 ? 1.7564 1.0531 1.4606 -0.3005 0.2018 -0.1440 349 ILE D CB 10084 C CG1 . ILE D 264 ? 1.5635 0.8648 1.2747 -0.2807 0.1961 -0.1350 349 ILE D CG1 10085 C CG2 . ILE D 264 ? 1.7734 1.0836 1.4878 -0.3116 0.1993 -0.1408 349 ILE D CG2 10086 C CD1 . ILE D 264 ? 1.3859 0.6669 1.0986 -0.2612 0.2053 -0.1226 349 ILE D CD1 10087 N N . GLN D 265 ? 1.3435 0.7087 1.0615 -0.3206 0.1688 -0.1555 350 GLN D N 10088 C CA . GLN D 265 ? 1.3049 0.7059 1.0339 -0.3319 0.1539 -0.1575 350 GLN D CA 10089 C C . GLN D 265 ? 1.3897 0.8035 1.1317 -0.3366 0.1516 -0.1506 350 GLN D C 10090 O O . GLN D 265 ? 1.4690 0.8744 1.2173 -0.3210 0.1556 -0.1395 350 GLN D O 10091 C CB . GLN D 265 ? 1.1728 0.5936 0.9087 -0.3164 0.1426 -0.1525 350 GLN D CB 10092 C CG . GLN D 265 ? 1.2402 0.7065 0.9900 -0.3222 0.1255 -0.1519 350 GLN D CG 10093 C CD . GLN D 265 ? 1.3021 0.7888 1.0565 -0.3077 0.1147 -0.1486 350 GLN D CD 10094 O OE1 . GLN D 265 ? 1.3442 0.8144 1.0949 -0.2906 0.1190 -0.1444 350 GLN D OE1 10095 N NE2 . GLN D 265 ? 1.2796 0.8024 1.0419 -0.3144 0.1009 -0.1505 350 GLN D NE2 10096 N N . GLY D 266 ? 1.3602 0.8002 1.1081 -0.3552 0.1441 -0.1560 351 GLY D N 10097 C CA . GLY D 266 ? 1.4331 0.8917 1.1950 -0.3600 0.1408 -0.1497 351 GLY D CA 10098 C C . GLY D 266 ? 1.3952 0.8922 1.1655 -0.3780 0.1285 -0.1554 351 GLY D C 10099 O O . GLY D 266 ? 1.3300 0.8374 1.0940 -0.3883 0.1230 -0.1650 351 GLY D O 10100 N N . PHE D 267 ? 1.2953 0.8143 1.0798 -0.3818 0.1243 -0.1493 352 PHE D N 10101 C CA . PHE D 267 ? 1.3022 0.8625 1.0975 -0.3962 0.1116 -0.1526 352 PHE D CA 10102 C C . PHE D 267 ? 1.4706 1.0356 1.2702 -0.4155 0.1157 -0.1551 352 PHE D C 10103 O O . PHE D 267 ? 1.4557 0.9951 1.2529 -0.4149 0.1276 -0.1516 352 PHE D O 10104 C CB . PHE D 267 ? 1.2531 0.8503 1.0662 -0.3791 0.0973 -0.1414 352 PHE D CB 10105 C CG . PHE D 267 ? 1.1877 0.7839 1.0121 -0.3652 0.0998 -0.1287 352 PHE D CG 10106 C CD1 . PHE D 267 ? 1.2105 0.7838 1.0324 -0.3442 0.1054 -0.1206 352 PHE D CD1 10107 C CD2 . PHE D 267 ? 1.1377 0.7565 0.9751 -0.3732 0.0967 -0.1248 352 PHE D CD2 10108 C CE1 . PHE D 267 ? 1.2920 0.8647 1.1235 -0.3316 0.1077 -0.1090 352 PHE D CE1 10109 C CE2 . PHE D 267 ? 1.1722 0.7897 1.0193 -0.3605 0.0994 -0.1133 352 PHE D CE2 10110 C CZ . PHE D 267 ? 1.2858 0.8800 1.1296 -0.3398 0.1048 -0.1054 352 PHE D CZ 10111 N N . MET D 268 ? 1.4956 1.0954 1.3018 -0.4320 0.1057 -0.1608 353 MET D N 10112 C CA . MET D 268 ? 1.3435 0.9631 1.1595 -0.4477 0.1049 -0.1610 353 MET D CA 10113 C C . MET D 268 ? 1.3783 1.0483 1.2114 -0.4469 0.0881 -0.1568 353 MET D C 10114 O O . MET D 268 ? 1.5156 1.2031 1.3491 -0.4393 0.0780 -0.1572 353 MET D O 10115 C CB . MET D 268 ? 1.3139 0.9312 1.1202 -0.4645 0.1096 -0.1719 353 MET D CB 10116 C CG . MET D 268 ? 1.3261 0.8991 1.1156 -0.4617 0.1255 -0.1755 353 MET D CG 10117 S SD . MET D 268 ? 1.5210 1.0954 1.2995 -0.4836 0.1299 -0.1889 353 MET D SD 10118 C CE . MET D 268 ? 1.4170 0.9376 1.1790 -0.4780 0.1504 -0.1893 353 MET D CE 10119 N N . ILE D 269 ? 1.3480 1.0422 1.1953 -0.4536 0.0853 -0.1522 354 ILE D N 10120 C CA . ILE D 269 ? 1.3815 1.1255 1.2455 -0.4534 0.0699 -0.1481 354 ILE D CA 10121 C C . ILE D 269 ? 1.4412 1.2082 1.3094 -0.4793 0.0684 -0.1558 354 ILE D C 10122 O O . ILE D 269 ? 1.4623 1.2159 1.3307 -0.4905 0.0780 -0.1567 354 ILE D O 10123 C CB . ILE D 269 ? 1.0144 0.7742 0.8952 -0.4330 0.0655 -0.1330 354 ILE D CB 10124 C CG1 . ILE D 269 ? 1.0722 0.8093 0.9488 -0.4081 0.0674 -0.1257 354 ILE D CG1 10125 C CG2 . ILE D 269 ? 1.0188 0.8292 0.9163 -0.4312 0.0501 -0.1284 354 ILE D CG2 10126 C CD1 . ILE D 269 ? 1.0454 0.7975 0.9372 -0.3881 0.0630 -0.1115 354 ILE D CD1 10127 N N . GLU D 270 ? 1.4374 1.2396 1.3089 -0.4889 0.0566 -0.1610 355 GLU D N 10128 C CA . GLU D 270 ? 1.4865 1.3191 1.3646 -0.5093 0.0529 -0.1664 355 GLU D CA 10129 C C . GLU D 270 ? 1.4285 1.3114 1.3275 -0.5070 0.0393 -0.1584 355 GLU D C 10130 O O . GLU D 270 ? 1.3124 1.2192 1.2164 -0.4941 0.0277 -0.1541 355 GLU D O 10131 C CB . GLU D 270 ? 1.5657 1.4029 1.4311 -0.5198 0.0506 -0.1780 355 GLU D CB 10132 C CG . GLU D 270 ? 1.5896 1.4699 1.4636 -0.5358 0.0422 -0.1818 355 GLU D CG 10133 C CD . GLU D 270 ? 1.6175 1.4847 1.4836 -0.5517 0.0523 -0.1897 355 GLU D CD 10134 O OE1 . GLU D 270 ? 1.5746 1.4016 1.4319 -0.5501 0.0661 -0.1902 355 GLU D OE1 10135 O OE2 . GLU D 270 ? 1.6317 1.5294 1.5003 -0.5656 0.0464 -0.1952 355 GLU D OE2 10136 N N . GLY D 271 ? 1.5091 1.4086 1.4205 -0.5161 0.0409 -0.1551 356 GLY D N 10137 C CA . GLY D 271 ? 1.4953 1.4437 1.4271 -0.5116 0.0289 -0.1466 356 GLY D CA 10138 C C . GLY D 271 ? 1.5144 1.4795 1.4572 -0.5282 0.0324 -0.1466 356 GLY D C 10139 O O . GLY D 271 ? 1.4837 1.4330 1.4178 -0.5415 0.0409 -0.1543 356 GLY D O 10140 N N . SER D 272 ? 1.4535 1.4517 1.4155 -0.5182 0.0257 -0.1354 357 SER D N 10141 C CA . SER D 272 ? 1.4722 1.4836 1.4461 -0.5299 0.0302 -0.1330 357 SER D CA 10142 C C . SER D 272 ? 1.5415 1.5050 1.5055 -0.5315 0.0464 -0.1335 357 SER D C 10143 O O . SER D 272 ? 1.5684 1.5148 1.5234 -0.5457 0.0552 -0.1414 357 SER D O 10144 C CB . SER D 272 ? 1.4275 1.4741 1.4220 -0.5130 0.0221 -0.1191 357 SER D CB 10145 O OG . SER D 272 ? 1.4234 1.5187 1.4289 -0.5157 0.0083 -0.1186 357 SER D OG 10146 N N . ASN D 273 ? 1.6095 1.5528 1.5751 -0.5084 0.0500 -0.1228 359 ASN D N 10147 C CA . ASN D 273 ? 1.5460 1.4382 1.4980 -0.5050 0.0647 -0.1232 359 ASN D CA 10148 C C . ASN D 273 ? 1.4023 1.2664 1.3366 -0.5010 0.0658 -0.1303 359 ASN D C 10149 O O . ASN D 273 ? 1.4179 1.3004 1.3533 -0.4915 0.0549 -0.1298 359 ASN D O 10150 C CB . ASN D 273 ? 1.5070 1.3893 1.4664 -0.4809 0.0673 -0.1091 359 ASN D CB 10151 C CG . ASN D 273 ? 1.5210 1.4367 1.4997 -0.4808 0.0640 -0.1006 359 ASN D CG 10152 O OD1 . ASN D 273 ? 1.5070 1.4431 1.4920 -0.5012 0.0644 -0.1053 359 ASN D OD1 10153 N ND2 . ASN D 273 ? 1.4773 1.3990 1.4653 -0.4579 0.0608 -0.0881 359 ASN D ND2 10154 N N . SER D 274 ? 1.3378 1.1571 1.2553 -0.5081 0.0794 -0.1368 360 SER D N 10155 C CA . SER D 274 ? 1.3327 1.1226 1.2329 -0.5031 0.0818 -0.1431 360 SER D CA 10156 C C . SER D 274 ? 1.3761 1.1180 1.2657 -0.4894 0.0953 -0.1385 360 SER D C 10157 O O . SER D 274 ? 1.4270 1.1517 1.3175 -0.4924 0.1056 -0.1351 360 SER D O 10158 C CB . SER D 274 ? 1.4009 1.1894 1.2891 -0.5184 0.0832 -0.1559 360 SER D CB 10159 O OG . SER D 274 ? 1.4087 1.2417 1.3049 -0.5268 0.0693 -0.1595 360 SER D OG 10160 N N . TRP D 275 ? 1.3884 1.1095 1.2682 -0.4733 0.0952 -0.1378 361 TRP D N 10161 C CA . TRP D 275 ? 1.3287 1.0073 1.1996 -0.4579 0.1072 -0.1321 361 TRP D CA 10162 C C . TRP D 275 ? 1.3329 0.9716 1.1830 -0.4606 0.1163 -0.1412 361 TRP D C 10163 O O . TRP D 275 ? 1.3819 1.0295 1.2256 -0.4652 0.1102 -0.1495 361 TRP D O 10164 C CB . TRP D 275 ? 1.1305 0.8194 1.0111 -0.4299 0.0999 -0.1190 361 TRP D CB 10165 C CG . TRP D 275 ? 1.1729 0.8991 1.0733 -0.4247 0.0915 -0.1092 361 TRP D CG 10166 C CD1 . TRP D 275 ? 1.2484 1.0197 1.1623 -0.4274 0.0775 -0.1085 361 TRP D CD1 10167 C CD2 . TRP D 275 ? 1.2384 0.9598 1.1470 -0.4149 0.0967 -0.0985 361 TRP D CD2 10168 N NE1 . TRP D 275 ? 1.2582 1.0525 1.1883 -0.4198 0.0741 -0.0981 361 TRP D NE1 10169 C CE2 . TRP D 275 ? 1.3305 1.0951 1.2576 -0.4123 0.0856 -0.0920 361 TRP D CE2 10170 C CE3 . TRP D 275 ? 1.2308 0.9159 1.1327 -0.4075 0.1098 -0.0933 361 TRP D CE3 10171 C CZ2 . TRP D 275 ? 1.3329 1.1047 1.2716 -0.4032 0.0874 -0.0812 361 TRP D CZ2 10172 C CZ3 . TRP D 275 ? 1.2677 0.9607 1.1810 -0.3987 0.1113 -0.0824 361 TRP D CZ3 10173 C CH2 . TRP D 275 ? 1.2918 1.0277 1.2232 -0.3968 0.1002 -0.0767 361 TRP D CH2 10174 N N . ILE D 276 ? 1.2614 0.8604 1.1020 -0.4519 0.1301 -0.1379 362 ILE D N 10175 C CA . ILE D 276 ? 1.3548 0.9176 1.1782 -0.4423 0.1380 -0.1415 362 ILE D CA 10176 C C . ILE D 276 ? 1.4562 0.9864 1.2767 -0.4231 0.1477 -0.1312 362 ILE D C 10177 O O . ILE D 276 ? 1.6280 1.1453 1.4505 -0.4223 0.1565 -0.1254 362 ILE D O 10178 C CB . ILE D 276 ? 1.5736 1.1185 1.3830 -0.4550 0.1471 -0.1521 362 ILE D CB 10179 C CG1 . ILE D 276 ? 1.6152 1.1152 1.4080 -0.4423 0.1601 -0.1520 362 ILE D CG1 10180 C CG2 . ILE D 276 ? 1.7522 1.3014 1.5665 -0.4682 0.1528 -0.1520 362 ILE D CG2 10181 C CD1 . ILE D 276 ? 1.6281 1.1064 1.4072 -0.4539 0.1715 -0.1606 362 ILE D CD1 10182 N N . GLY D 277 ? 1.3018 0.8223 1.1183 -0.4057 0.1453 -0.1279 363 GLY D N 10183 C CA . GLY D 277 ? 1.1818 0.6754 0.9955 -0.3839 0.1532 -0.1175 363 GLY D CA 10184 C C . GLY D 277 ? 1.3082 0.7609 1.1031 -0.3805 0.1653 -0.1229 363 GLY D C 10185 O O . GLY D 277 ? 1.5020 0.9556 1.2884 -0.3876 0.1632 -0.1329 363 GLY D O 10186 N N . ARG D 278 ? 1.3495 0.7715 1.1390 -0.3660 0.1769 -0.1151 364 ARG D N 10187 C CA . ARG D 278 ? 1.4027 0.7907 1.1762 -0.3578 0.1881 -0.1180 364 ARG D CA 10188 C C . ARG D 278 ? 1.4440 0.8057 1.2152 -0.3367 0.1974 -0.1061 364 ARG D C 10189 O O . ARG D 278 ? 1.3666 0.7340 1.1476 -0.3311 0.1970 -0.0962 364 ARG D O 10190 C CB . ARG D 278 ? 1.3626 0.7384 1.1268 -0.3736 0.1971 -0.1266 364 ARG D CB 10191 C CG . ARG D 278 ? 1.4444 0.8018 1.2083 -0.3720 0.2088 -0.1197 364 ARG D CG 10192 C CD . ARG D 278 ? 1.4999 0.8593 1.2605 -0.3930 0.2133 -0.1282 364 ARG D CD 10193 N NE . ARG D 278 ? 1.5441 0.8795 1.3008 -0.3904 0.2266 -0.1225 364 ARG D NE 10194 C CZ . ARG D 278 ? 1.6285 0.9518 1.3772 -0.4045 0.2357 -0.1292 364 ARG D CZ 10195 N NH1 . ARG D 278 ? 1.5763 0.9095 1.3197 -0.4221 0.2328 -0.1418 364 ARG D NH1 10196 N NH2 . ARG D 278 ? 1.6729 0.9740 1.4181 -0.4008 0.2477 -0.1231 364 ARG D NH2 10197 N N . ILE D 279 ? 1.4977 0.8321 1.2564 -0.3245 0.2056 -0.1066 365 ILE D N 10198 C CA . ILE D 279 ? 1.5221 0.8298 1.2767 -0.3051 0.2163 -0.0959 365 ILE D CA 10199 C C . ILE D 279 ? 1.6044 0.8962 1.3545 -0.3132 0.2278 -0.0958 365 ILE D C 10200 O O . ILE D 279 ? 1.7100 0.9936 1.4510 -0.3273 0.2330 -0.1057 365 ILE D O 10201 C CB . ILE D 279 ? 1.4589 0.7431 1.2010 -0.2913 0.2226 -0.0974 365 ILE D CB 10202 C CG1 . ILE D 279 ? 1.4450 0.7463 1.1881 -0.2926 0.2113 -0.1041 365 ILE D CG1 10203 C CG2 . ILE D 279 ? 1.3896 0.6554 1.1313 -0.2672 0.2294 -0.0842 365 ILE D CG2 10204 C CD1 . ILE D 279 ? 1.5037 0.7857 1.2369 -0.2763 0.2159 -0.1038 365 ILE D CD1 10205 N N . ILE D 280 ? 1.5393 0.8267 1.2952 -0.3048 0.2320 -0.0846 366 ILE D N 10206 C CA . ILE D 280 ? 1.6386 0.9117 1.3907 -0.3127 0.2428 -0.0839 366 ILE D CA 10207 C C . ILE D 280 ? 1.6257 0.8636 1.3615 -0.3055 0.2574 -0.0853 366 ILE D C 10208 O O . ILE D 280 ? 1.4955 0.7219 1.2227 -0.3196 0.2649 -0.0934 366 ILE D O 10209 C CB . ILE D 280 ? 1.6394 0.9163 1.4011 -0.3047 0.2441 -0.0712 366 ILE D CB 10210 C CG1 . ILE D 280 ? 1.5944 0.9040 1.3717 -0.3057 0.2298 -0.0677 366 ILE D CG1 10211 C CG2 . ILE D 280 ? 1.7199 0.9899 1.4798 -0.3191 0.2526 -0.0730 366 ILE D CG2 10212 C CD1 . ILE D 280 ? 1.5459 0.8556 1.3303 -0.2862 0.2292 -0.0530 366 ILE D CD1 10213 N N . ASN D 281 ? 1.6847 0.9068 1.4166 -0.2835 0.2612 -0.0773 367 ASN D N 10214 C CA . ASN D 281 ? 1.7253 0.9151 1.4424 -0.2737 0.2749 -0.0771 367 ASN D CA 10215 C C . ASN D 281 ? 1.7481 0.9336 1.4573 -0.2707 0.2730 -0.0848 367 ASN D C 10216 O O . ASN D 281 ? 1.9004 1.0932 1.6136 -0.2564 0.2665 -0.0805 367 ASN D O 10217 C CB . ASN D 281 ? 1.9363 1.1121 1.6540 -0.2500 0.2812 -0.0623 367 ASN D CB 10218 C CG . ASN D 281 ? 2.1902 1.3687 1.9147 -0.2514 0.2839 -0.0538 367 ASN D CG 10219 O OD1 . ASN D 281 ? 2.2785 1.4368 1.9954 -0.2537 0.2959 -0.0526 367 ASN D OD1 10220 N ND2 . ASN D 281 ? 2.2019 1.4050 1.9404 -0.2500 0.2732 -0.0477 367 ASN D ND2 10221 N N . PRO D 282 ? 1.6855 0.8596 1.3832 -0.2848 0.2787 -0.0966 368 PRO D N 10222 C CA . PRO D 282 ? 1.5788 0.7454 1.2671 -0.2814 0.2790 -0.1038 368 PRO D CA 10223 C C . PRO D 282 ? 1.7021 0.8384 1.3794 -0.2620 0.2921 -0.0977 368 PRO D C 10224 O O . PRO D 282 ? 1.8582 0.9861 1.5274 -0.2564 0.2938 -0.1022 368 PRO D O 10225 C CB . PRO D 282 ? 1.5870 0.7527 1.2669 -0.3048 0.2812 -0.1181 368 PRO D CB 10226 C CG . PRO D 282 ? 1.5361 0.7175 1.2246 -0.3213 0.2780 -0.1187 368 PRO D CG 10227 C CD . PRO D 282 ? 1.5849 0.7589 1.2796 -0.3070 0.2827 -0.1049 368 PRO D CD 10228 N N . GLY D 283 ? 1.7953 0.9164 1.4722 -0.2514 0.3013 -0.0874 369 GLY D N 10229 C CA . GLY D 283 ? 1.8714 0.9652 1.5386 -0.2319 0.3140 -0.0801 369 GLY D CA 10230 C C . GLY D 283 ? 1.7998 0.9010 1.4731 -0.2095 0.3082 -0.0709 369 GLY D C 10231 O O . GLY D 283 ? 1.7450 0.8457 1.4142 -0.2045 0.3061 -0.0754 369 GLY D O 10232 N N . SER D 284 ? 1.7682 0.8762 1.4508 -0.1958 0.3060 -0.0581 370 SER D N 10233 C CA . SER D 284 ? 1.8093 0.9351 1.5021 -0.1800 0.2955 -0.0507 370 SER D CA 10234 C C . SER D 284 ? 1.7571 0.9104 1.4603 -0.1972 0.2814 -0.0574 370 SER D C 10235 O O . SER D 284 ? 1.9861 1.1450 1.6919 -0.2140 0.2809 -0.0610 370 SER D O 10236 C CB . SER D 284 ? 1.9128 1.0393 1.6122 -0.1624 0.2972 -0.0353 370 SER D CB 10237 O OG . SER D 284 ? 1.8946 1.0326 1.6021 -0.1738 0.2938 -0.0332 370 SER D OG 10238 N N . LYS D 285 ? 1.5372 0.7081 1.2461 -0.1939 0.2702 -0.0595 371 LYS D N 10239 C CA . LYS D 285 ? 1.5734 0.7700 1.2908 -0.2119 0.2574 -0.0671 371 LYS D CA 10240 C C . LYS D 285 ? 1.5425 0.7597 1.2743 -0.2095 0.2489 -0.0580 371 LYS D C 10241 O O . LYS D 285 ? 1.5406 0.7806 1.2815 -0.2115 0.2366 -0.0588 371 LYS D O 10242 C CB . LYS D 285 ? 1.5871 0.7945 1.3033 -0.2134 0.2488 -0.0753 371 LYS D CB 10243 C CG . LYS D 285 ? 1.6306 0.8231 1.3330 -0.2233 0.2553 -0.0875 371 LYS D CG 10244 C CD . LYS D 285 ? 1.8676 1.0356 1.5595 -0.2049 0.2661 -0.0840 371 LYS D CD 10245 C CE . LYS D 285 ? 2.0087 1.1536 1.6852 -0.2147 0.2780 -0.0935 371 LYS D CE 10246 N NZ . LYS D 285 ? 1.9887 1.1097 1.6548 -0.1971 0.2893 -0.0899 371 LYS D NZ 10247 N N . LYS D 286 ? 1.5952 0.8041 1.3285 -0.2057 0.2558 -0.0494 372 LYS D N 10248 C CA . LYS D 286 ? 1.5813 0.8073 1.3273 -0.2001 0.2493 -0.0391 372 LYS D CA 10249 C C . LYS D 286 ? 1.5280 0.7747 1.2832 -0.2208 0.2424 -0.0433 372 LYS D C 10250 O O . LYS D 286 ? 1.3772 0.6196 1.1283 -0.2383 0.2468 -0.0512 372 LYS D O 10251 C CB . LYS D 286 ? 1.5500 0.7599 1.2942 -0.1830 0.2591 -0.0260 372 LYS D CB 10252 C CG . LYS D 286 ? 1.6881 0.8847 1.4267 -0.1599 0.2636 -0.0194 372 LYS D CG 10253 C CD . LYS D 286 ? 1.8014 0.9972 1.5443 -0.1398 0.2660 -0.0039 372 LYS D CD 10254 C CE . LYS D 286 ? 1.9873 1.1826 1.7295 -0.1174 0.2646 0.0024 372 LYS D CE 10255 N NZ . LYS D 286 ? 1.9810 1.2003 1.7351 -0.1094 0.2521 0.0085 372 LYS D NZ 10256 N N . GLY D 287 ? 1.4192 0.6890 1.1868 -0.2185 0.2317 -0.0379 373 GLY D N 10257 C CA . GLY D 287 ? 1.3788 0.6714 1.1570 -0.2350 0.2250 -0.0396 373 GLY D CA 10258 C C . GLY D 287 ? 1.3802 0.6959 1.1619 -0.2540 0.2146 -0.0523 373 GLY D C 10259 O O . GLY D 287 ? 1.4051 0.7086 1.1766 -0.2614 0.2173 -0.0625 373 GLY D O 10260 N N . PHE D 288 ? 1.3813 0.7348 1.1783 -0.2600 0.2018 -0.0513 374 PHE D N 10261 C CA . PHE D 288 ? 1.3581 0.7376 1.1598 -0.2782 0.1914 -0.0623 374 PHE D CA 10262 C C . PHE D 288 ? 1.3600 0.7627 1.1728 -0.2931 0.1874 -0.0620 374 PHE D C 10263 O O . PHE D 288 ? 1.3164 0.7395 1.1418 -0.2835 0.1818 -0.0521 374 PHE D O 10264 C CB . PHE D 288 ? 1.2887 0.6998 1.0994 -0.2675 0.1756 -0.0617 374 PHE D CB 10265 C CG . PHE D 288 ? 1.3415 0.7797 1.1564 -0.2851 0.1648 -0.0724 374 PHE D CG 10266 C CD1 . PHE D 288 ? 1.4237 0.8505 1.2272 -0.2940 0.1660 -0.0838 374 PHE D CD1 10267 C CD2 . PHE D 288 ? 1.2418 0.7173 1.0718 -0.2924 0.1535 -0.0709 374 PHE D CD2 10268 C CE1 . PHE D 288 ? 1.3477 0.8003 1.1543 -0.3100 0.1559 -0.0935 374 PHE D CE1 10269 C CE2 . PHE D 288 ? 1.3256 0.8275 1.1596 -0.3078 0.1435 -0.0801 374 PHE D CE2 10270 C CZ . PHE D 288 ? 1.3909 0.8816 1.2129 -0.3167 0.1444 -0.0914 374 PHE D CZ 10271 N N . GLU D 289 ? 1.4556 0.8566 1.2640 -0.3168 0.1899 -0.0734 375 GLU D N 10272 C CA . GLU D 289 ? 1.4732 0.8969 1.2919 -0.3336 0.1866 -0.0746 375 GLU D CA 10273 C C . GLU D 289 ? 1.3938 0.8509 1.2189 -0.3492 0.1738 -0.0844 375 GLU D C 10274 O O . GLU D 289 ? 1.2402 0.6930 1.0570 -0.3531 0.1716 -0.0933 375 GLU D O 10275 C CB . GLU D 289 ? 1.3841 0.7794 1.1933 -0.3478 0.2018 -0.0779 375 GLU D CB 10276 C CG . GLU D 289 ? 1.4639 0.8471 1.2605 -0.3599 0.2062 -0.0907 375 GLU D CG 10277 C CD . GLU D 289 ? 1.6765 1.0405 1.4662 -0.3686 0.2188 -0.0923 375 GLU D CD 10278 O OE1 . GLU D 289 ? 1.5973 0.9700 1.3956 -0.3734 0.2203 -0.0868 375 GLU D OE1 10279 O OE2 . GLU D 289 ? 1.8322 1.1722 1.6077 -0.3705 0.2275 -0.0990 375 GLU D OE2 10280 N N . ILE D 290 ? 1.3860 0.8774 1.2259 -0.3571 0.1654 -0.0823 376 ILE D N 10281 C CA . ILE D 290 ? 1.3376 0.8630 1.1845 -0.3735 0.1539 -0.0910 376 ILE D CA 10282 C C . ILE D 290 ? 1.3640 0.9058 1.2193 -0.3925 0.1551 -0.0924 376 ILE D C 10283 O O . ILE D 290 ? 1.2383 0.7874 1.1033 -0.3861 0.1563 -0.0827 376 ILE D O 10284 C CB . ILE D 290 ? 1.2909 0.8535 1.1505 -0.3590 0.1371 -0.0861 376 ILE D CB 10285 C CG1 . ILE D 290 ? 1.3476 0.9449 1.2135 -0.3757 0.1256 -0.0948 376 ILE D CG1 10286 C CG2 . ILE D 290 ? 1.1963 0.7775 1.0706 -0.3431 0.1327 -0.0727 376 ILE D CG2 10287 C CD1 . ILE D 290 ? 1.2604 0.8884 1.1349 -0.3623 0.1106 -0.0918 376 ILE D CD1 10288 N N . TYR D 291 ? 1.3745 0.9225 1.2259 -0.4162 0.1548 -0.1047 377 TYR D N 10289 C CA . TYR D 291 ? 1.3021 0.8565 1.1571 -0.4369 0.1597 -0.1084 377 TYR D CA 10290 C C . TYR D 291 ? 1.3223 0.9210 1.1888 -0.4537 0.1468 -0.1147 377 TYR D C 10291 O O . TYR D 291 ? 1.3840 0.9937 1.2461 -0.4593 0.1396 -0.1233 377 TYR D O 10292 C CB . TYR D 291 ? 1.4170 0.9402 1.2556 -0.4430 0.1718 -0.1162 377 TYR D CB 10293 C CG . TYR D 291 ? 1.5419 1.0638 1.3818 -0.4568 0.1796 -0.1175 377 TYR D CG 10294 C CD1 . TYR D 291 ? 1.5709 1.1091 1.4246 -0.4583 0.1792 -0.1092 377 TYR D CD1 10295 C CD2 . TYR D 291 ? 1.5335 1.0375 1.3603 -0.4685 0.1879 -0.1273 377 TYR D CD2 10296 C CE1 . TYR D 291 ? 1.5607 1.0976 1.4154 -0.4712 0.1867 -0.1106 377 TYR D CE1 10297 C CE2 . TYR D 291 ? 1.5849 1.0870 1.4123 -0.4816 0.1954 -0.1289 377 TYR D CE2 10298 C CZ . TYR D 291 ? 1.5198 1.0383 1.3613 -0.4829 0.1947 -0.1206 377 TYR D CZ 10299 O OH . TYR D 291 ? 1.2860 0.8021 1.1276 -0.4960 0.2024 -0.1224 377 TYR D OH 10300 N N . LYS D 292 ? 1.3419 0.9677 1.2233 -0.4603 0.1437 -0.1098 378 LYS D N 10301 C CA . LYS D 292 ? 1.4745 1.1468 1.3691 -0.4744 0.1310 -0.1141 378 LYS D CA 10302 C C . LYS D 292 ? 1.5124 1.1897 1.4030 -0.4958 0.1345 -0.1247 378 LYS D C 10303 O O . LYS D 292 ? 1.5282 1.1789 1.4108 -0.4995 0.1468 -0.1257 378 LYS D O 10304 C CB . LYS D 292 ? 1.3940 1.1012 1.3088 -0.4650 0.1236 -0.1024 378 LYS D CB 10305 C CG . LYS D 292 ? 1.3803 1.1391 1.3101 -0.4669 0.1067 -0.1028 378 LYS D CG 10306 C CD . LYS D 292 ? 1.4781 1.2721 1.4267 -0.4704 0.1026 -0.0959 378 LYS D CD 10307 C CE . LYS D 292 ? 1.4597 1.2618 1.4192 -0.4453 0.0992 -0.0814 378 LYS D CE 10308 N NZ . LYS D 292 ? 1.3583 1.1902 1.3346 -0.4492 0.0974 -0.0748 378 LYS D NZ 10309 N N . PHE D 293 ? 1.4421 1.1546 1.3379 -0.5078 0.1231 -0.1320 379 PHE D N 10310 C CA . PHE D 293 ? 1.4695 1.1951 1.3635 -0.5272 0.1239 -0.1414 379 PHE D CA 10311 C C . PHE D 293 ? 1.5222 1.3018 1.4340 -0.5372 0.1100 -0.1414 379 PHE D C 10312 O O . PHE D 293 ? 1.5081 1.3137 1.4281 -0.5308 0.0980 -0.1386 379 PHE D O 10313 C CB . PHE D 293 ? 1.4898 1.1968 1.3659 -0.5322 0.1261 -0.1530 379 PHE D CB 10314 C CG . PHE D 293 ? 1.4658 1.1212 1.3240 -0.5247 0.1412 -0.1540 379 PHE D CG 10315 C CD1 . PHE D 293 ? 1.3113 0.9400 1.1621 -0.5065 0.1436 -0.1494 379 PHE D CD1 10316 C CD2 . PHE D 293 ? 1.4856 1.1197 1.3345 -0.5355 0.1531 -0.1591 379 PHE D CD2 10317 C CE1 . PHE D 293 ? 1.2148 0.7978 1.0499 -0.4984 0.1576 -0.1495 379 PHE D CE1 10318 C CE2 . PHE D 293 ? 1.4565 1.0437 1.2891 -0.5277 0.1673 -0.1593 379 PHE D CE2 10319 C CZ . PHE D 293 ? 1.2833 0.8457 1.1093 -0.5087 0.1694 -0.1543 379 PHE D CZ 10320 N N . LEU D 294 ? 1.5580 1.3552 1.4760 -0.5524 0.1117 -0.1442 380 LEU D N 10321 C CA . LEU D 294 ? 1.5247 1.3743 1.4618 -0.5599 0.0995 -0.1419 380 LEU D CA 10322 C C . LEU D 294 ? 1.4822 1.3597 1.4171 -0.5738 0.0908 -0.1523 380 LEU D C 10323 O O . LEU D 294 ? 1.4213 1.3167 1.3596 -0.5893 0.0914 -0.1571 380 LEU D O 10324 C CB . LEU D 294 ? 1.5324 1.3909 1.4810 -0.5664 0.1053 -0.1365 380 LEU D CB 10325 C CG . LEU D 294 ? 1.4726 1.2995 1.4210 -0.5529 0.1156 -0.1263 380 LEU D CG 10326 C CD1 . LEU D 294 ? 1.5603 1.3395 1.4915 -0.5556 0.1317 -0.1301 380 LEU D CD1 10327 C CD2 . LEU D 294 ? 1.1810 1.0359 1.1489 -0.5522 0.1137 -0.1162 380 LEU D CD2 10328 N N . GLY D 295 ? 1.4799 1.3609 1.4089 -0.5678 0.0828 -0.1555 381 GLY D N 10329 C CA . GLY D 295 ? 1.5414 1.4455 1.4659 -0.5788 0.0747 -0.1652 381 GLY D CA 10330 C C . GLY D 295 ? 1.5798 1.4528 1.4855 -0.5727 0.0769 -0.1714 381 GLY D C 10331 O O . GLY D 295 ? 1.5574 1.3999 1.4575 -0.5581 0.0817 -0.1668 381 GLY D O 10332 N N . THR D 296 ? 1.5269 1.4077 1.4228 -0.5838 0.0739 -0.1819 382 THR D N 10333 C CA . THR D 296 ? 1.4564 1.3121 1.3347 -0.5791 0.0753 -0.1885 382 THR D CA 10334 C C . THR D 296 ? 1.5620 1.3628 1.4217 -0.5769 0.0917 -0.1924 382 THR D C 10335 O O . THR D 296 ? 1.6534 1.4360 1.5114 -0.5832 0.1026 -0.1924 382 THR D O 10336 C CB . THR D 296 ? 1.3975 1.2798 1.2705 -0.5920 0.0672 -0.1983 382 THR D CB 10337 O OG1 . THR D 296 ? 1.4255 1.2734 1.2774 -0.5929 0.0744 -0.2073 382 THR D OG1 10338 C CG2 . THR D 296 ? 1.2336 1.1399 1.1123 -0.6106 0.0677 -0.2026 382 THR D CG2 10339 N N . LEU D 297 ? 1.5444 1.3199 1.3903 -0.5674 0.0934 -0.1953 383 LEU D N 10340 C CA . LEU D 297 ? 1.4782 1.2024 1.3060 -0.5625 0.1083 -0.1984 383 LEU D CA 10341 C C . LEU D 297 ? 1.5680 1.2836 1.3802 -0.5779 0.1134 -0.2111 383 LEU D C 10342 O O . LEU D 297 ? 1.6306 1.3059 1.4268 -0.5777 0.1267 -0.2154 383 LEU D O 10343 C CB . LEU D 297 ? 1.4120 1.1158 1.2330 -0.5443 0.1072 -0.1954 383 LEU D CB 10344 C CG . LEU D 297 ? 1.3755 1.0923 1.2103 -0.5283 0.0991 -0.1842 383 LEU D CG 10345 C CD1 . LEU D 297 ? 1.2703 0.9893 1.1000 -0.5177 0.0911 -0.1852 383 LEU D CD1 10346 C CD2 . LEU D 297 ? 1.3246 1.0080 1.1597 -0.5155 0.1102 -0.1753 383 LEU D CD2 10347 N N . PHE D 298 ? 1.5250 1.2794 1.3419 -0.5912 0.1028 -0.2167 384 PHE D N 10348 C CA . PHE D 298 ? 1.5584 1.3103 1.3605 -0.6057 0.1051 -0.2291 384 PHE D CA 10349 C C . PHE D 298 ? 1.5573 1.3263 1.3621 -0.6259 0.1074 -0.2345 384 PHE D C 10350 O O . PHE D 298 ? 1.5779 1.3588 1.3745 -0.6404 0.1058 -0.2443 384 PHE D O 10351 C CB . PHE D 298 ? 1.4898 1.2687 1.2910 -0.6042 0.0919 -0.2323 384 PHE D CB 10352 C CG . PHE D 298 ? 1.4421 1.2102 1.2437 -0.5846 0.0880 -0.2259 384 PHE D CG 10353 C CD1 . PHE D 298 ? 1.4361 1.1595 1.2221 -0.5742 0.0986 -0.2275 384 PHE D CD1 10354 C CD2 . PHE D 298 ? 1.4093 1.2116 1.2269 -0.5759 0.0743 -0.2180 384 PHE D CD2 10355 C CE1 . PHE D 298 ? 1.3723 1.0859 1.1588 -0.5561 0.0953 -0.2215 384 PHE D CE1 10356 C CE2 . PHE D 298 ? 1.3401 1.1318 1.1577 -0.5583 0.0710 -0.2123 384 PHE D CE2 10357 C CZ . PHE D 298 ? 1.3323 1.0799 1.1344 -0.5485 0.0814 -0.2142 384 PHE D CZ 10358 N N . SER D 299 ? 1.4738 1.2449 1.2904 -0.6266 0.1112 -0.2278 385 SER D N 10359 C CA . SER D 299 ? 1.5863 1.3612 1.4032 -0.6443 0.1177 -0.2324 385 SER D CA 10360 C C . SER D 299 ? 1.6290 1.3562 1.4364 -0.6408 0.1349 -0.2308 385 SER D C 10361 O O . SER D 299 ? 1.7266 1.4318 1.5364 -0.6241 0.1387 -0.2220 385 SER D O 10362 C CB . SER D 299 ? 1.5455 1.3650 1.3845 -0.6490 0.1083 -0.2260 385 SER D CB 10363 O OG . SER D 299 ? 1.4676 1.2845 1.3071 -0.6638 0.1166 -0.2289 385 SER D OG 10364 N N . VAL D 300 ? 1.6563 1.3675 1.4528 -0.6562 0.1453 -0.2390 387 VAL D N 10365 C CA . VAL D 300 ? 1.7000 1.3648 1.4857 -0.6535 0.1624 -0.2379 387 VAL D CA 10366 C C . VAL D 300 ? 1.7241 1.3977 1.5246 -0.6550 0.1649 -0.2298 387 VAL D C 10367 O O . VAL D 300 ? 1.6742 1.3139 1.4707 -0.6486 0.1773 -0.2250 387 VAL D O 10368 C CB . VAL D 300 ? 1.5904 1.2323 1.3568 -0.6697 0.1736 -0.2504 387 VAL D CB 10369 C CG1 . VAL D 300 ? 1.4530 1.0510 1.1996 -0.6593 0.1831 -0.2537 387 VAL D CG1 10370 C CG2 . VAL D 300 ? 1.5164 1.1970 1.2836 -0.6877 0.1633 -0.2600 387 VAL D CG2 10371 N N . GLN D 301 ? 1.7615 1.4824 1.5797 -0.6628 0.1526 -0.2279 388 GLN D N 10372 C CA . GLN D 301 ? 1.7332 1.4713 1.5665 -0.6685 0.1536 -0.2220 388 GLN D CA 10373 C C . GLN D 301 ? 1.7570 1.5026 1.6065 -0.6513 0.1493 -0.2083 388 GLN D C 10374 O O . GLN D 301 ? 1.8361 1.6031 1.7011 -0.6542 0.1476 -0.2020 388 GLN D O 10375 C CB . GLN D 301 ? 1.7154 1.5045 1.5602 -0.6851 0.1420 -0.2266 388 GLN D CB 10376 C CG . GLN D 301 ? 1.7455 1.5321 1.5759 -0.7053 0.1465 -0.2402 388 GLN D CG 10377 C CD . GLN D 301 ? 1.8304 1.6074 1.6601 -0.7197 0.1575 -0.2425 388 GLN D CD 10378 O OE1 . GLN D 301 ? 1.8415 1.6317 1.6865 -0.7179 0.1573 -0.2343 388 GLN D OE1 10379 N NE2 . GLN D 301 ? 1.8131 1.5667 1.6246 -0.7340 0.1677 -0.2538 388 GLN D NE2 10380 N N . THR D 302 ? 1.7566 1.4850 1.6024 -0.6334 0.1476 -0.2036 390 THR D N 10381 C CA . THR D 302 ? 1.7054 1.4495 1.5673 -0.6174 0.1399 -0.1914 390 THR D CA 10382 C C . THR D 302 ? 1.6418 1.3469 1.5010 -0.6023 0.1515 -0.1821 390 THR D C 10383 O O . THR D 302 ? 1.6338 1.2966 1.4766 -0.5948 0.1620 -0.1839 390 THR D O 10384 C CB . THR D 302 ? 1.6669 1.4301 1.5304 -0.6085 0.1267 -0.1916 390 THR D CB 10385 O OG1 . THR D 302 ? 1.6393 1.4538 1.5160 -0.6188 0.1129 -0.1937 390 THR D OG1 10386 C CG2 . THR D 302 ? 1.5822 1.3394 1.4536 -0.5881 0.1239 -0.1801 390 THR D CG2 10387 N N . VAL D 303 ? 1.6095 1.3308 1.4853 -0.5973 0.1495 -0.1717 391 VAL D N 10388 C CA . VAL D 303 ? 1.7927 1.4823 1.6673 -0.5890 0.1621 -0.1635 391 VAL D CA 10389 C C . VAL D 303 ? 1.7839 1.4333 1.6489 -0.5684 0.1693 -0.1569 391 VAL D C 10390 O O . VAL D 303 ? 1.8981 1.5070 1.7456 -0.5660 0.1812 -0.1606 391 VAL D O 10391 C CB . VAL D 303 ? 1.6605 1.3803 1.5558 -0.5893 0.1581 -0.1538 391 VAL D CB 10392 C CG1 . VAL D 303 ? 1.4421 1.1330 1.3348 -0.5887 0.1726 -0.1485 391 VAL D CG1 10393 C CG2 . VAL D 303 ? 1.6407 1.4085 1.5485 -0.6065 0.1477 -0.1591 391 VAL D CG2 10394 N N . GLY D 304 ? 1.5336 1.1947 1.4098 -0.5535 0.1623 -0.1468 392 GLY D N 10395 C CA . GLY D 304 ? 1.5774 1.2035 1.4474 -0.5337 0.1696 -0.1383 392 GLY D CA 10396 C C . GLY D 304 ? 1.6701 1.3012 1.5533 -0.5256 0.1717 -0.1256 392 GLY D C 10397 O O . GLY D 304 ? 1.6861 1.2989 1.5672 -0.5278 0.1828 -0.1224 392 GLY D O 10398 N N . ASN D 305 A 1.6525 1.3084 1.5489 -0.5160 0.1612 -0.1183 392 ASN D N 10399 C CA . ASN D 305 A 1.5289 1.1959 1.4392 -0.5089 0.1614 -0.1063 392 ASN D CA 10400 C C . ASN D 305 A 1.4228 1.0544 1.3261 -0.4882 0.1692 -0.0966 392 ASN D C 10401 O O . ASN D 305 A 1.4540 1.0474 1.3444 -0.4836 0.1821 -0.0957 392 ASN D O 10402 C CB . ASN D 305 A 1.5439 1.2590 1.4726 -0.5099 0.1460 -0.1033 392 ASN D CB 10403 C CG . ASN D 305 A 1.5901 1.3230 1.5348 -0.5056 0.1459 -0.0916 392 ASN D CG 10404 O OD1 . ASN D 305 A 1.6935 1.4129 1.6382 -0.5082 0.1560 -0.0879 392 ASN D OD1 10405 N ND2 . ASN D 305 A 1.4399 1.2068 1.3985 -0.4908 0.1327 -0.0843 392 ASN D ND2 10406 N N . ARG D 306 ? 1.3779 1.0233 1.2895 -0.4757 0.1611 -0.0893 393 ARG D N 10407 C CA . ARG D 306 ? 1.3332 0.9563 1.2420 -0.4507 0.1650 -0.0777 393 ARG D CA 10408 C C . ARG D 306 ? 1.4034 0.9949 1.2965 -0.4387 0.1676 -0.0806 393 ARG D C 10409 O O . ARG D 306 ? 1.2595 0.8638 1.1510 -0.4392 0.1584 -0.0871 393 ARG D O 10410 C CB . ARG D 306 ? 1.2114 0.8738 1.1380 -0.4326 0.1510 -0.0674 393 ARG D CB 10411 C CG . ARG D 306 ? 1.2386 0.8851 1.1641 -0.4059 0.1527 -0.0553 393 ARG D CG 10412 C CD . ARG D 306 ? 1.2806 0.9198 1.2106 -0.4031 0.1616 -0.0459 393 ARG D CD 10413 N NE . ARG D 306 ? 1.3388 0.9670 1.2685 -0.3773 0.1621 -0.0339 393 ARG D NE 10414 C CZ . ARG D 306 ? 1.3422 0.9996 1.2854 -0.3617 0.1522 -0.0248 393 ARG D CZ 10415 N NH1 . ARG D 306 ? 1.1053 0.8044 1.0637 -0.3683 0.1411 -0.0258 393 ARG D NH1 10416 N NH2 . ARG D 306 ? 1.4214 1.0663 1.3626 -0.3395 0.1535 -0.0147 393 ARG D NH2 10417 N N . ASN D 307 ? 1.5162 1.0671 1.3977 -0.4276 0.1804 -0.0753 394 ASN D N 10418 C CA . ASN D 307 ? 1.4974 1.0184 1.3652 -0.4127 0.1836 -0.0757 394 ASN D CA 10419 C C . ASN D 307 ? 1.4967 1.0199 1.3701 -0.3842 0.1797 -0.0619 394 ASN D C 10420 O O . ASN D 307 ? 1.4160 0.9325 1.2929 -0.3761 0.1857 -0.0521 394 ASN D O 10421 C CB . ASN D 307 ? 1.4866 0.9665 1.3374 -0.4140 0.1986 -0.0794 394 ASN D CB 10422 C CG . ASN D 307 ? 1.6080 1.0550 1.4455 -0.3949 0.2040 -0.0767 394 ASN D CG 10423 O OD1 . ASN D 307 ? 1.6676 1.1077 1.4961 -0.3955 0.2020 -0.0849 394 ASN D OD1 10424 N ND2 . ASN D 307 ? 1.7329 1.1601 1.5690 -0.3774 0.2111 -0.0648 394 ASN D ND2 10425 N N . TYR D 308 ? 1.5139 1.0473 1.3881 -0.3694 0.1697 -0.0614 395 TYR D N 10426 C CA . TYR D 308 ? 1.3632 0.9000 1.2423 -0.3432 0.1654 -0.0494 395 TYR D CA 10427 C C . TYR D 308 ? 1.3855 0.8845 1.2493 -0.3290 0.1737 -0.0483 395 TYR D C 10428 O O . TYR D 308 ? 1.4327 0.9207 1.2870 -0.3328 0.1734 -0.0569 395 TYR D O 10429 C CB . TYR D 308 ? 1.3167 0.8940 1.2087 -0.3351 0.1481 -0.0483 395 TYR D CB 10430 C CG . TYR D 308 ? 1.2864 0.9035 1.1959 -0.3404 0.1392 -0.0447 395 TYR D CG 10431 C CD1 . TYR D 308 ? 1.2876 0.9127 1.2062 -0.3282 0.1397 -0.0331 395 TYR D CD1 10432 C CD2 . TYR D 308 ? 1.2648 0.9127 1.1817 -0.3570 0.1302 -0.0526 395 TYR D CD2 10433 C CE1 . TYR D 308 ? 1.2668 0.9285 1.2016 -0.3323 0.1320 -0.0296 395 TYR D CE1 10434 C CE2 . TYR D 308 ? 1.2847 0.9706 1.2182 -0.3608 0.1221 -0.0487 395 TYR D CE2 10435 C CZ . TYR D 308 ? 1.2858 0.9778 1.2282 -0.3483 0.1233 -0.0373 395 TYR D CZ 10436 O OH . TYR D 308 ? 1.2156 0.9448 1.1743 -0.3516 0.1160 -0.0334 395 TYR D OH 10437 N N . GLN D 309 ? 1.4432 0.9233 1.3048 -0.3126 0.1811 -0.0374 396 GLN D N 10438 C CA . GLN D 309 ? 1.5178 0.9637 1.3662 -0.2966 0.1893 -0.0342 396 GLN D CA 10439 C C . GLN D 309 ? 1.4982 0.9617 1.3538 -0.2727 0.1788 -0.0258 396 GLN D C 10440 O O . GLN D 309 ? 1.4906 0.9486 1.3478 -0.2557 0.1815 -0.0146 396 GLN D O 10441 C CB . GLN D 309 ? 1.5811 0.9934 1.4213 -0.2932 0.2053 -0.0271 396 GLN D CB 10442 C CG . GLN D 309 ? 1.7453 1.1133 1.5668 -0.3020 0.2210 -0.0339 396 GLN D CG 10443 C CD . GLN D 309 ? 1.8935 1.2580 1.7129 -0.3249 0.2276 -0.0416 396 GLN D CD 10444 O OE1 . GLN D 309 ? 2.0101 1.3946 1.8402 -0.3358 0.2251 -0.0397 396 GLN D OE1 10445 N NE2 . GLN D 309 ? 1.8186 1.1620 1.6251 -0.3304 0.2351 -0.0501 396 GLN D NE2 10446 N N . LEU D 310 ? 1.3066 0.7911 1.1657 -0.2720 0.1670 -0.0315 397 LEU D N 10447 C CA . LEU D 310 ? 1.1578 0.6639 1.0251 -0.2522 0.1554 -0.0248 397 LEU D CA 10448 C C . LEU D 310 ? 1.1912 0.6727 1.0498 -0.2317 0.1611 -0.0186 397 LEU D C 10449 O O . LEU D 310 ? 1.1795 0.6747 1.0447 -0.2137 0.1546 -0.0100 397 LEU D O 10450 C CB . LEU D 310 ? 1.0810 0.6123 0.9524 -0.2576 0.1427 -0.0330 397 LEU D CB 10451 C CG . LEU D 310 ? 1.1521 0.7156 1.0340 -0.2754 0.1341 -0.0386 397 LEU D CG 10452 C CD1 . LEU D 310 ? 1.0093 0.5954 0.8937 -0.2774 0.1218 -0.0455 397 LEU D CD1 10453 C CD2 . LEU D 310 ? 1.2318 0.8219 1.1287 -0.2697 0.1285 -0.0292 397 LEU D CD2 10454 N N . LEU D 311 ? 1.2282 0.6737 1.0718 -0.2345 0.1733 -0.0229 398 LEU D N 10455 C CA . LEU D 311 ? 1.2119 0.6336 1.0465 -0.2155 0.1792 -0.0176 398 LEU D CA 10456 C C . LEU D 311 ? 1.4830 0.8623 1.3033 -0.2174 0.1972 -0.0165 398 LEU D C 10457 O O . LEU D 311 ? 1.4883 0.8510 1.3011 -0.2363 0.2051 -0.0249 398 LEU D O 10458 C CB . LEU D 311 ? 1.1612 0.5848 0.9914 -0.2136 0.1735 -0.0253 398 LEU D CB 10459 C CG . LEU D 311 ? 1.3047 0.7443 1.1403 -0.1929 0.1640 -0.0194 398 LEU D CG 10460 C CD1 . LEU D 311 ? 1.2217 0.6906 1.0717 -0.1827 0.1546 -0.0097 398 LEU D CD1 10461 C CD2 . LEU D 311 ? 1.3029 0.7583 1.1390 -0.1980 0.1541 -0.0287 398 LEU D CD2 10462 N N . SER D 312 ? 1.5780 0.9398 1.3940 -0.1980 0.2038 -0.0062 399 SER D N 10463 C CA . SER D 312 ? 1.5102 0.8311 1.3125 -0.1969 0.2214 -0.0031 399 SER D CA 10464 C C . SER D 312 ? 1.5752 0.8710 1.3667 -0.1787 0.2284 0.0005 399 SER D C 10465 O O . SER D 312 ? 1.7460 1.0151 1.5248 -0.1845 0.2370 -0.0072 399 SER D O 10466 C CB . SER D 312 ? 1.4649 0.7858 1.2717 -0.1913 0.2260 0.0084 399 SER D CB 10467 O OG . SER D 312 ? 1.4257 0.7710 1.2434 -0.2069 0.2200 0.0060 399 SER D OG 10468 N N . ASN D 313 ? 1.6489 0.9540 1.4456 -0.1569 0.2248 0.0121 401 ASN D N 10469 C CA . ASN D 313 ? 1.7892 1.0714 1.5766 -0.1375 0.2325 0.0182 401 ASN D CA 10470 C C . ASN D 313 ? 1.7840 1.0719 1.5700 -0.1317 0.2261 0.0122 401 ASN D C 10471 O O . ASN D 313 ? 1.8866 1.1619 1.6672 -0.1142 0.2303 0.0174 401 ASN D O 10472 C CB . ASN D 313 ? 1.8101 1.1030 1.6039 -0.1165 0.2303 0.0329 401 ASN D CB 10473 C CG . ASN D 313 ? 1.9911 1.2684 1.7821 -0.1180 0.2408 0.0408 401 ASN D CG 10474 O OD1 . ASN D 313 ? 2.0251 1.2731 1.8055 -0.1082 0.2540 0.0473 401 ASN D OD1 10475 N ND2 . ASN D 313 ? 1.9936 1.2924 1.7946 -0.1293 0.2348 0.0407 401 ASN D ND2 10476 N N . SER D 314 ? 1.6570 0.9643 1.4476 -0.1464 0.2163 0.0014 402 SER D N 10477 C CA . SER D 314 ? 1.6129 0.9300 1.4034 -0.1417 0.2086 -0.0044 402 SER D CA 10478 C C . SER D 314 ? 1.5644 0.8578 1.3420 -0.1561 0.2160 -0.0171 402 SER D C 10479 O O . SER D 314 ? 1.4756 0.7635 1.2500 -0.1767 0.2190 -0.0254 402 SER D O 10480 C CB . SER D 314 ? 1.5111 0.8705 1.3166 -0.1448 0.1908 -0.0062 402 SER D CB 10481 O OG . SER D 314 ? 1.6721 1.0401 1.4769 -0.1412 0.1839 -0.0120 402 SER D OG 10482 N N . THR D 315 ? 1.5251 0.8041 1.2946 -0.1456 0.2194 -0.0188 403 THR D N 10483 C CA . THR D 315 ? 1.5402 0.7955 1.2963 -0.1579 0.2269 -0.0310 403 THR D CA 10484 C C . THR D 315 ? 1.5688 0.8522 1.3306 -0.1682 0.2128 -0.0410 403 THR D C 10485 O O . THR D 315 ? 1.6244 0.9283 1.3927 -0.1559 0.2029 -0.0388 403 THR D O 10486 C CB . THR D 315 ? 1.4249 0.6547 1.1700 -0.1411 0.2377 -0.0281 403 THR D CB 10487 O OG1 . THR D 315 ? 1.3635 0.5945 1.1041 -0.1420 0.2341 -0.0368 403 THR D OG1 10488 C CG2 . THR D 315 ? 1.4887 0.7188 1.2382 -0.1167 0.2388 -0.0133 403 THR D CG2 10489 N N . ILE D 316 ? 1.4536 0.7391 1.2132 -0.1910 0.2119 -0.0517 404 ILE D N 10490 C CA . ILE D 316 ? 1.4293 0.7474 1.1967 -0.2019 0.1971 -0.0597 404 ILE D CA 10491 C C . ILE D 316 ? 1.4195 0.7247 1.1746 -0.2138 0.1996 -0.0732 404 ILE D C 10492 O O . ILE D 316 ? 1.3928 0.6645 1.1335 -0.2151 0.2131 -0.0772 404 ILE D O 10493 C CB . ILE D 316 ? 1.6190 0.9624 1.3973 -0.2177 0.1896 -0.0608 404 ILE D CB 10494 C CG1 . ILE D 316 ? 1.6354 0.9637 1.4045 -0.2425 0.1967 -0.0726 404 ILE D CG1 10495 C CG2 . ILE D 316 ? 1.5029 0.8494 1.2895 -0.2082 0.1917 -0.0483 404 ILE D CG2 10496 C CD1 . ILE D 316 ? 1.6559 1.0162 1.4318 -0.2589 0.1835 -0.0816 404 ILE D CD1 10497 N N . GLY D 317 ? 1.3148 0.6492 1.0759 -0.2209 0.1861 -0.0796 405 GLY D N 10498 C CA . GLY D 317 ? 1.3099 0.6363 1.0602 -0.2297 0.1867 -0.0915 405 GLY D CA 10499 C C . GLY D 317 ? 1.3767 0.7328 1.1320 -0.2479 0.1743 -0.1009 405 GLY D C 10500 O O . GLY D 317 ? 1.2484 0.6078 1.0039 -0.2669 0.1750 -0.1063 405 GLY D O 10501 N N . ARG D 318 ? 1.3788 0.7573 1.1380 -0.2422 0.1629 -0.1026 406 ARG D N 10502 C CA . ARG D 318 ? 1.2670 0.6745 1.0304 -0.2582 0.1510 -0.1110 406 ARG D CA 10503 C C . ARG D 318 ? 1.2123 0.6551 0.9930 -0.2600 0.1393 -0.1047 406 ARG D C 10504 O O . ARG D 318 ? 1.1559 0.6076 0.9470 -0.2445 0.1367 -0.0933 406 ARG D O 10505 C CB . ARG D 318 ? 1.1023 0.5225 0.8641 -0.2517 0.1428 -0.1145 406 ARG D CB 10506 C CG . ARG D 318 ? 1.1124 0.5005 0.8564 -0.2527 0.1535 -0.1228 406 ARG D CG 10507 C CD . ARG D 318 ? 1.0750 0.4788 0.8179 -0.2479 0.1445 -0.1267 406 ARG D CD 10508 N NE . ARG D 318 ? 1.2417 0.6772 1.0003 -0.2328 0.1317 -0.1169 406 ARG D NE 10509 C CZ . ARG D 318 ? 1.2534 0.7237 1.0212 -0.2374 0.1174 -0.1180 406 ARG D CZ 10510 N NH1 . ARG D 318 ? 1.4365 0.9167 1.1998 -0.2564 0.1134 -0.1282 406 ARG D NH1 10511 N NH2 . ARG D 318 ? 1.1616 0.6566 0.9426 -0.2230 0.1074 -0.1088 406 ARG D NH2 10512 N N . SER D 319 ? 1.3448 0.8076 1.1282 -0.2793 0.1328 -0.1122 407 SER D N 10513 C CA . SER D 319 ? 1.2938 0.7940 1.0938 -0.2817 0.1206 -0.1071 407 SER D CA 10514 C C . SER D 319 ? 1.1564 0.6844 0.9581 -0.2963 0.1095 -0.1159 407 SER D C 10515 O O . SER D 319 ? 1.1774 0.6930 0.9666 -0.3104 0.1133 -0.1271 407 SER D O 10516 C CB . SER D 319 ? 1.1567 0.6525 0.9610 -0.2909 0.1267 -0.1042 407 SER D CB 10517 O OG . SER D 319 ? 1.1389 0.6175 0.9324 -0.3126 0.1349 -0.1151 407 SER D OG 10518 N N . GLY D 320 ? 1.1071 0.6724 0.9235 -0.2927 0.0960 -0.1107 408 GLY D N 10519 C CA . GLY D 320 ? 1.1139 0.7083 0.9328 -0.3044 0.0848 -0.1175 408 GLY D CA 10520 C C . GLY D 320 ? 1.1744 0.8082 1.0107 -0.3031 0.0725 -0.1107 408 GLY D C 10521 O O . GLY D 320 ? 1.0953 0.7334 0.9419 -0.2924 0.0726 -0.1007 408 GLY D O 10522 N N . LEU D 321 ? 1.2228 0.8853 1.0621 -0.3135 0.0621 -0.1159 409 LEU D N 10523 C CA . LEU D 321 ? 1.1297 0.8316 0.9851 -0.3144 0.0504 -0.1105 409 LEU D CA 10524 C C . LEU D 321 ? 1.1518 0.8781 1.0142 -0.2996 0.0386 -0.1050 409 LEU D C 10525 O O . LEU D 321 ? 1.2008 0.9196 1.0547 -0.2945 0.0374 -0.1086 409 LEU D O 10526 C CB . LEU D 321 ? 0.9989 0.7196 0.8537 -0.3374 0.0467 -0.1196 409 LEU D CB 10527 C CG . LEU D 321 ? 1.1182 0.8417 0.9784 -0.3521 0.0514 -0.1203 409 LEU D CG 10528 C CD1 . LEU D 321 ? 0.9298 0.6216 0.7881 -0.3446 0.0638 -0.1147 409 LEU D CD1 10529 C CD2 . LEU D 321 ? 1.1379 0.8572 0.9873 -0.3765 0.0545 -0.1337 409 LEU D CD2 10530 N N . TYR D 322 ? 1.0842 0.8390 0.9620 -0.2929 0.0305 -0.0964 410 TYR D N 10531 C CA . TYR D 322 ? 1.0739 0.8567 0.9595 -0.2819 0.0186 -0.0915 410 TYR D CA 10532 C C . TYR D 322 ? 1.1390 0.9577 1.0404 -0.2831 0.0098 -0.0854 410 TYR D C 10533 O O . TYR D 322 ? 1.0631 0.8833 0.9726 -0.2840 0.0132 -0.0806 410 TYR D O 10534 C CB . TYR D 322 ? 0.9220 0.6923 0.8073 -0.2603 0.0193 -0.0844 410 TYR D CB 10535 C CG . TYR D 322 ? 1.0171 0.7848 0.9120 -0.2469 0.0218 -0.0739 410 TYR D CG 10536 C CD1 . TYR D 322 ? 1.0458 0.7837 0.9357 -0.2442 0.0332 -0.0724 410 TYR D CD1 10537 C CD2 . TYR D 322 ? 0.9128 0.7070 0.8208 -0.2363 0.0133 -0.0653 410 TYR D CD2 10538 C CE1 . TYR D 322 ? 0.9724 0.7087 0.8704 -0.2318 0.0353 -0.0627 410 TYR D CE1 10539 C CE2 . TYR D 322 ? 0.9243 0.7161 0.8402 -0.2242 0.0156 -0.0561 410 TYR D CE2 10540 C CZ . TYR D 322 ? 0.9559 0.7193 0.8667 -0.2221 0.0264 -0.0548 410 TYR D CZ 10541 O OH . TYR D 322 ? 1.0993 0.8615 1.0174 -0.2100 0.0285 -0.0455 410 TYR D OH 10542 N N . GLN D 323 ? 1.0890 0.9368 0.9947 -0.2832 -0.0010 -0.0855 411 GLN D N 10543 C CA . GLN D 323 ? 1.0561 0.9394 0.9768 -0.2827 -0.0096 -0.0792 411 GLN D CA 10544 C C . GLN D 323 ? 0.9740 0.8704 0.9020 -0.2628 -0.0166 -0.0699 411 GLN D C 10545 O O . GLN D 323 ? 0.9368 0.8415 0.8610 -0.2584 -0.0227 -0.0712 411 GLN D O 10546 C CB . GLN D 323 ? 0.9745 0.8845 0.8954 -0.2993 -0.0168 -0.0858 411 GLN D CB 10547 C CG . GLN D 323 ? 1.0003 0.9008 0.9151 -0.3211 -0.0102 -0.0953 411 GLN D CG 10548 C CD . GLN D 323 ? 1.0120 0.9390 0.9255 -0.3381 -0.0174 -0.1028 411 GLN D CD 10549 O OE1 . GLN D 323 ? 1.0380 0.9603 0.9400 -0.3428 -0.0192 -0.1102 411 GLN D OE1 10550 N NE2 . GLN D 323 ? 1.0522 1.0082 0.9775 -0.3476 -0.0217 -0.1010 411 GLN D NE2 10551 N N . PRO D 324 ? 1.0166 0.9135 0.9541 -0.2508 -0.0151 -0.0608 412 PRO D N 10552 C CA . PRO D 324 ? 0.9783 0.8906 0.9237 -0.2334 -0.0219 -0.0520 412 PRO D CA 10553 C C . PRO D 324 ? 1.0508 0.9982 1.0031 -0.2368 -0.0323 -0.0512 412 PRO D C 10554 O O . PRO D 324 ? 1.0583 1.0277 1.0201 -0.2443 -0.0349 -0.0494 412 PRO D O 10555 C CB . PRO D 324 ? 0.7032 0.6165 0.6589 -0.2261 -0.0187 -0.0437 412 PRO D CB 10556 C CG . PRO D 324 ? 1.0409 0.9273 0.9904 -0.2346 -0.0082 -0.0476 412 PRO D CG 10557 C CD . PRO D 324 ? 1.1432 1.0275 1.0844 -0.2535 -0.0071 -0.0582 412 PRO D CD 10558 N N . ALA D 325 ? 1.1678 1.1208 1.1153 -0.2313 -0.0380 -0.0523 413 ALA D N 10559 C CA . ALA D 325 ? 1.4440 1.4292 1.3959 -0.2347 -0.0477 -0.0519 413 ALA D CA 10560 C C . ALA D 325 ? 1.5598 1.5619 1.5195 -0.2177 -0.0542 -0.0426 413 ALA D C 10561 O O . ALA D 325 ? 1.7357 1.7407 1.6902 -0.2116 -0.0587 -0.0428 413 ALA D O 10562 C CB . ALA D 325 ? 1.6246 1.6064 1.5641 -0.2443 -0.0496 -0.0610 413 ALA D CB 10563 N N . TYR D 326 A 1.5347 1.5471 1.5061 -0.2103 -0.0542 -0.0346 413 TYR D N 10564 C CA . TYR D 326 A 1.7069 1.7366 1.6863 -0.1951 -0.0599 -0.0256 413 TYR D CA 10565 C C . TYR D 326 A 1.7706 1.8246 1.7641 -0.1957 -0.0619 -0.0194 413 TYR D C 10566 O O . TYR D 326 A 1.7386 1.7882 1.7385 -0.1863 -0.0588 -0.0130 413 TYR D O 10567 C CB . TYR D 326 A 1.7642 1.7719 1.7413 -0.1792 -0.0560 -0.0213 413 TYR D CB 10568 C CG . TYR D 326 A 1.8305 1.8088 1.8028 -0.1806 -0.0469 -0.0237 413 TYR D CG 10569 C CD1 . TYR D 326 A 1.8886 1.8463 1.8499 -0.1909 -0.0421 -0.0323 413 TYR D CD1 10570 C CD2 . TYR D 326 A 1.8295 1.8003 1.8077 -0.1711 -0.0429 -0.0173 413 TYR D CD2 10571 C CE1 . TYR D 326 A 1.9425 1.8726 1.8991 -0.1911 -0.0332 -0.0338 413 TYR D CE1 10572 C CE2 . TYR D 326 A 1.8729 1.8175 1.8465 -0.1715 -0.0345 -0.0188 413 TYR D CE2 10573 C CZ . TYR D 326 A 1.9982 1.9224 1.9611 -0.1812 -0.0296 -0.0268 413 TYR D CZ 10574 O OH . TYR D 326 A 2.0960 1.9934 2.0540 -0.1808 -0.0207 -0.0276 413 TYR D OH 10575 N N . GLU D 327 ? 1.8318 1.9121 1.8297 -0.2069 -0.0669 -0.0212 414 GLU D N 10576 C CA . GLU D 327 ? 1.8971 2.0024 1.9086 -0.2097 -0.0685 -0.0161 414 GLU D CA 10577 C C . GLU D 327 ? 1.7846 1.9257 1.8047 -0.2044 -0.0774 -0.0100 414 GLU D C 10578 O O . GLU D 327 ? 1.7124 1.8565 1.7291 -0.1938 -0.0818 -0.0073 414 GLU D O 10579 C CB . GLU D 327 ? 1.9680 2.0754 1.9793 -0.2298 -0.0655 -0.0234 414 GLU D CB 10580 C CG . GLU D 327 ? 1.6395 1.7720 1.6493 -0.2444 -0.0722 -0.0292 414 GLU D CG 10581 C CD . GLU D 327 ? 2.0737 2.1961 2.0696 -0.2456 -0.0750 -0.0356 414 GLU D CD 10582 O OE1 . GLU D 327 ? 2.0941 2.2075 2.0864 -0.2309 -0.0764 -0.0319 414 GLU D OE1 10583 O OE2 . GLU D 327 ? 2.0213 2.1469 2.0110 -0.2618 -0.0757 -0.0442 414 GLU D OE2 10584 N N . SER D 328 ? 1.8084 1.9760 1.8398 -0.2115 -0.0794 -0.0076 415 SER D N 10585 C CA . SER D 328 ? 1.7763 1.9818 1.8168 -0.2103 -0.0874 -0.0026 415 SER D CA 10586 C C . SER D 328 ? 1.8363 2.0609 1.8861 -0.2254 -0.0865 -0.0044 415 SER D C 10587 O O . SER D 328 ? 1.8877 2.1468 1.9484 -0.2269 -0.0918 0.0000 415 SER D O 10588 C CB . SER D 328 ? 1.7303 1.9445 1.7795 -0.1912 -0.0886 0.0084 415 SER D CB 10589 O OG . SER D 328 ? 1.6697 1.8655 1.7224 -0.1857 -0.0815 0.0113 415 SER D OG 10590 N N . ARG D 329 A 1.7664 1.9675 1.8110 -0.2370 -0.0794 -0.0113 415 ARG D N 10591 C CA . ARG D 329 A 1.6034 1.8071 1.6566 -0.2449 -0.0742 -0.0105 415 ARG D CA 10592 C C . ARG D 329 A 1.5403 1.7689 1.5995 -0.2645 -0.0759 -0.0152 415 ARG D C 10593 O O . ARG D 329 A 1.5551 1.8008 1.6110 -0.2751 -0.0816 -0.0205 415 ARG D O 10594 C CB . ARG D 329 A 1.5846 1.7484 1.6292 -0.2462 -0.0645 -0.0145 415 ARG D CB 10595 C CG . ARG D 329 A 1.5655 1.7122 1.6115 -0.2274 -0.0611 -0.0068 415 ARG D CG 10596 C CD . ARG D 329 A 1.5959 1.7645 1.6568 -0.2219 -0.0612 0.0018 415 ARG D CD 10597 N NE . ARG D 329 A 1.4884 1.6393 1.5506 -0.2063 -0.0565 0.0084 415 ARG D NE 10598 C CZ . ARG D 329 A 1.2767 1.4009 1.3351 -0.2073 -0.0483 0.0073 415 ARG D CZ 10599 N NH1 . ARG D 329 A 1.2423 1.3520 1.2950 -0.2229 -0.0432 -0.0001 415 ARG D NH1 10600 N NH2 . ARG D 329 A 1.2810 1.3926 1.3407 -0.1927 -0.0449 0.0137 415 ARG D NH2 10601 N N . ASP D 330 ? 1.4500 1.6799 1.5178 -0.2694 -0.0705 -0.0132 416 ASP D N 10602 C CA . ASP D 330 ? 1.4863 1.7375 1.5609 -0.2884 -0.0704 -0.0172 416 ASP D CA 10603 C C . ASP D 330 ? 1.4725 1.6958 1.5351 -0.3063 -0.0635 -0.0285 416 ASP D C 10604 O O . ASP D 330 ? 1.5444 1.7794 1.6097 -0.3251 -0.0622 -0.0341 416 ASP D O 10605 C CB . ASP D 330 ? 1.5084 1.7715 1.5973 -0.2849 -0.0667 -0.0096 416 ASP D CB 10606 C CG . ASP D 330 ? 1.6565 1.9524 1.7562 -0.3023 -0.0685 -0.0117 416 ASP D CG 10607 O OD1 . ASP D 330 ? 1.6417 1.9709 1.7458 -0.3070 -0.0770 -0.0121 416 ASP D OD1 10608 O OD2 . ASP D 330 ? 1.7003 1.9896 1.8041 -0.3115 -0.0615 -0.0126 416 ASP D OD2 10609 N N . CYS D 331 ? 1.3221 1.5082 1.3714 -0.3003 -0.0588 -0.0317 417 CYS D N 10610 C CA . CYS D 331 ? 1.2478 1.4021 1.2847 -0.3146 -0.0506 -0.0414 417 CYS D CA 10611 C C . CYS D 331 ? 1.2313 1.3501 1.2532 -0.3056 -0.0476 -0.0445 417 CYS D C 10612 O O . CYS D 331 ? 1.1638 1.2732 1.1861 -0.2869 -0.0481 -0.0377 417 CYS D O 10613 C CB . CYS D 331 ? 1.1409 1.2814 1.1828 -0.3185 -0.0413 -0.0394 417 CYS D CB 10614 S SG . CYS D 331 ? 1.6414 1.7280 1.6686 -0.3152 -0.0291 -0.0427 417 CYS D SG 10615 N N . GLN D 332 ? 1.2599 1.3600 1.2686 -0.3194 -0.0444 -0.0551 418 GLN D N 10616 C CA . GLN D 332 ? 1.1062 1.1708 1.1002 -0.3124 -0.0401 -0.0587 418 GLN D CA 10617 C C . GLN D 332 ? 1.0881 1.1160 1.0768 -0.3118 -0.0283 -0.0592 418 GLN D C 10618 O O . GLN D 332 ? 1.0233 1.0412 1.0093 -0.3279 -0.0217 -0.0650 418 GLN D O 10619 C CB . GLN D 332 ? 1.0216 1.0816 1.0025 -0.3269 -0.0415 -0.0701 418 GLN D CB 10620 C CG . GLN D 332 ? 0.9336 0.9547 0.8988 -0.3219 -0.0353 -0.0749 418 GLN D CG 10621 C CD . GLN D 332 ? 0.9651 0.9834 0.9300 -0.3006 -0.0395 -0.0679 418 GLN D CD 10622 O OE1 . GLN D 332 ? 1.0401 1.0836 1.0086 -0.2952 -0.0487 -0.0652 418 GLN D OE1 10623 N NE2 . GLN D 332 ? 0.8224 0.8104 0.7831 -0.2882 -0.0326 -0.0648 418 GLN D NE2 10624 N N . GLU D 333 ? 1.0934 1.1014 1.0805 -0.2935 -0.0256 -0.0530 419 GLU D N 10625 C CA . GLU D 333 ? 1.0218 0.9934 1.0021 -0.2907 -0.0146 -0.0531 419 GLU D CA 10626 C C . GLU D 333 ? 1.0128 0.9542 0.9764 -0.2998 -0.0087 -0.0632 419 GLU D C 10627 O O . GLU D 333 ? 1.1216 1.0667 1.0780 -0.3021 -0.0136 -0.0687 419 GLU D O 10628 C CB . GLU D 333 ? 0.9881 0.9497 0.9711 -0.2684 -0.0142 -0.0437 419 GLU D CB 10629 C CG . GLU D 333 ? 1.1616 1.0872 1.1379 -0.2626 -0.0035 -0.0422 419 GLU D CG 10630 C CD . GLU D 333 ? 1.2635 1.1880 1.2471 -0.2671 0.0029 -0.0382 419 GLU D CD 10631 O OE1 . GLU D 333 ? 1.2471 1.2006 1.2433 -0.2702 -0.0016 -0.0343 419 GLU D OE1 10632 O OE2 . GLU D 333 ? 1.2471 1.1415 1.2236 -0.2670 0.0128 -0.0386 419 GLU D OE2 10633 N N . LEU D 334 ? 1.1106 1.0219 1.0676 -0.3050 0.0023 -0.0657 420 LEU D N 10634 C CA . LEU D 334 ? 1.0726 0.9513 1.0132 -0.3122 0.0098 -0.0747 420 LEU D CA 10635 C C . LEU D 334 ? 1.1098 0.9530 1.0449 -0.3011 0.0203 -0.0707 420 LEU D C 10636 O O . LEU D 334 ? 1.1503 0.9898 1.0917 -0.2993 0.0254 -0.0650 420 LEU D O 10637 C CB . LEU D 334 ? 1.0589 0.9371 0.9948 -0.3363 0.0137 -0.0847 420 LEU D CB 10638 C CG . LEU D 334 ? 1.1197 0.9619 1.0377 -0.3455 0.0231 -0.0948 420 LEU D CG 10639 C CD1 . LEU D 334 ? 1.1509 0.9887 1.0600 -0.3374 0.0184 -0.0978 420 LEU D CD1 10640 C CD2 . LEU D 334 ? 1.1597 1.0050 1.0732 -0.3710 0.0260 -0.1054 420 LEU D CD2 10641 N N . CYS D 335 ? 1.1296 0.9477 1.0528 -0.2931 0.0236 -0.0732 421 CYS D N 10642 C CA . CYS D 335 ? 1.0953 0.8810 1.0129 -0.2808 0.0331 -0.0689 421 CYS D CA 10643 C C . CYS D 335 ? 1.0871 0.8374 0.9880 -0.2866 0.0427 -0.0772 421 CYS D C 10644 O O . CYS D 335 ? 1.0887 0.8388 0.9813 -0.2991 0.0414 -0.0867 421 CYS D O 10645 C CB . CYS D 335 ? 0.8387 0.6290 0.7606 -0.2588 0.0278 -0.0606 421 CYS D CB 10646 S SG . CYS D 335 ? 0.9887 0.8152 0.9290 -0.2483 0.0182 -0.0497 421 CYS D SG 10647 N N . PHE D 336 ? 0.9313 0.6516 0.8267 -0.2768 0.0524 -0.0732 422 PHE D N 10648 C CA . PHE D 336 ? 1.0602 0.7456 0.9398 -0.2783 0.0620 -0.0797 422 PHE D CA 10649 C C . PHE D 336 ? 1.0395 0.7022 0.9158 -0.2579 0.0675 -0.0723 422 PHE D C 10650 O O . PHE D 336 ? 1.0112 0.6772 0.8957 -0.2462 0.0678 -0.0627 422 PHE D O 10651 C CB . PHE D 336 ? 1.1813 0.8459 1.0527 -0.2974 0.0727 -0.0870 422 PHE D CB 10652 C CG . PHE D 336 ? 1.2868 0.9366 1.1612 -0.2949 0.0818 -0.0802 422 PHE D CG 10653 C CD1 . PHE D 336 ? 1.3084 0.9806 1.1953 -0.3015 0.0787 -0.0762 422 PHE D CD1 10654 C CD2 . PHE D 336 ? 1.2475 0.8612 1.1122 -0.2856 0.0936 -0.0775 422 PHE D CD2 10655 C CE1 . PHE D 336 ? 1.1899 0.8483 1.0793 -0.2991 0.0874 -0.0697 422 PHE D CE1 10656 C CE2 . PHE D 336 ? 1.1629 0.7625 1.0298 -0.2828 0.1022 -0.0707 422 PHE D CE2 10657 C CZ . PHE D 336 ? 1.0871 0.7088 0.9661 -0.2898 0.0991 -0.0669 422 PHE D CZ 10658 N N . TRP D 337 ? 0.9928 0.6339 0.8570 -0.2536 0.0715 -0.0768 423 TRP D N 10659 C CA . TRP D 337 ? 0.9453 0.5631 0.8050 -0.2355 0.0779 -0.0708 423 TRP D CA 10660 C C . TRP D 337 ? 1.0727 0.6515 0.9182 -0.2409 0.0927 -0.0752 423 TRP D C 10661 O O . TRP D 337 ? 1.0520 0.6200 0.8882 -0.2576 0.0970 -0.0853 423 TRP D O 10662 C CB . TRP D 337 ? 0.9174 0.5405 0.7748 -0.2236 0.0716 -0.0712 423 TRP D CB 10663 C CG . TRP D 337 ? 0.8771 0.4966 0.7242 -0.2360 0.0709 -0.0825 423 TRP D CG 10664 C CD1 . TRP D 337 ? 1.0083 0.6541 0.8584 -0.2453 0.0606 -0.0876 423 TRP D CD1 10665 C CD2 . TRP D 337 ? 0.9123 0.4997 0.7436 -0.2408 0.0815 -0.0902 423 TRP D CD2 10666 N NE1 . TRP D 337 ? 1.0853 0.7180 0.9222 -0.2560 0.0637 -0.0982 423 TRP D NE1 10667 C CE2 . TRP D 337 ? 1.0344 0.6307 0.8596 -0.2537 0.0767 -0.1003 423 TRP D CE2 10668 C CE3 . TRP D 337 ? 0.9340 0.4859 0.7555 -0.2351 0.0948 -0.0893 423 TRP D CE3 10669 C CZ2 . TRP D 337 ? 1.0388 0.6090 0.8480 -0.2615 0.0849 -0.1100 423 TRP D CZ2 10670 C CZ3 . TRP D 337 ? 1.0121 0.5376 0.8181 -0.2422 0.1032 -0.0985 423 TRP D CZ3 10671 C CH2 . TRP D 337 ? 1.0798 0.6143 0.8796 -0.2556 0.0983 -0.1091 423 TRP D CH2 10672 N N . ILE D 338 ? 1.1521 0.7102 0.9959 -0.2267 0.1007 -0.0675 424 ILE D N 10673 C CA . ILE D 338 ? 1.2075 0.7267 1.0377 -0.2278 0.1156 -0.0698 424 ILE D CA 10674 C C . ILE D 338 ? 1.1438 0.6473 0.9691 -0.2079 0.1189 -0.0650 424 ILE D C 10675 O O . ILE D 338 ? 1.1057 0.6206 0.9396 -0.1914 0.1145 -0.0553 424 ILE D O 10676 C CB . ILE D 338 ? 1.2757 0.7827 1.1082 -0.2289 0.1241 -0.0635 424 ILE D CB 10677 C CG1 . ILE D 338 ? 1.1939 0.7219 1.0345 -0.2466 0.1198 -0.0663 424 ILE D CG1 10678 C CG2 . ILE D 338 ? 1.2854 0.7503 1.1028 -0.2311 0.1406 -0.0660 424 ILE D CG2 10679 C CD1 . ILE D 338 ? 1.1385 0.6555 0.9815 -0.2484 0.1282 -0.0602 424 ILE D CD1 10680 N N . GLU D 339 ? 1.1553 0.6332 0.9668 -0.2094 0.1267 -0.0718 425 GLU D N 10681 C CA . GLU D 339 ? 1.1416 0.6046 0.9486 -0.1905 0.1307 -0.0671 425 GLU D CA 10682 C C . GLU D 339 ? 1.1820 0.6116 0.9815 -0.1833 0.1455 -0.0617 425 GLU D C 10683 O O . GLU D 339 ? 1.2384 0.6414 1.0267 -0.1951 0.1567 -0.0676 425 GLU D O 10684 C CB . GLU D 339 ? 1.0547 0.5098 0.8514 -0.1936 0.1308 -0.0764 425 GLU D CB 10685 C CG . GLU D 339 ? 1.0972 0.5408 0.8901 -0.1743 0.1338 -0.0721 425 GLU D CG 10686 C CD . GLU D 339 ? 1.4017 0.8399 1.1848 -0.1783 0.1335 -0.0817 425 GLU D CD 10687 O OE1 . GLU D 339 ? 1.4962 0.9320 1.2725 -0.1966 0.1338 -0.0921 425 GLU D OE1 10688 O OE2 . GLU D 339 ? 1.5002 0.9375 1.2825 -0.1635 0.1327 -0.0789 425 GLU D OE2 10689 N N . ILE D 340 ? 1.2135 0.6449 1.0187 -0.1640 0.1455 -0.0505 426 ILE D N 10690 C CA . ILE D 340 ? 1.3049 0.7099 1.1052 -0.1545 0.1580 -0.0428 426 ILE D CA 10691 C C . ILE D 340 ? 1.2855 0.6719 1.0785 -0.1370 0.1644 -0.0394 426 ILE D C 10692 O O . ILE D 340 ? 1.2905 0.6946 1.0889 -0.1256 0.1560 -0.0373 426 ILE D O 10693 C CB . ILE D 340 ? 1.3803 0.8043 1.1934 -0.1445 0.1528 -0.0311 426 ILE D CB 10694 C CG1 . ILE D 340 ? 1.3053 0.7519 1.1277 -0.1599 0.1456 -0.0333 426 ILE D CG1 10695 C CG2 . ILE D 340 ? 1.4891 0.8874 1.2970 -0.1339 0.1654 -0.0224 426 ILE D CG2 10696 C CD1 . ILE D 340 ? 1.3935 0.8217 1.2078 -0.1799 0.1542 -0.0412 426 ILE D CD1 10697 N N . ALA D 341 ? 1.2683 0.6192 1.0491 -0.1346 0.1796 -0.0388 427 ALA D N 10698 C CA . ALA D 341 ? 1.2568 0.5908 1.0320 -0.1154 0.1866 -0.0330 427 ALA D CA 10699 C C . ALA D 341 ? 1.3227 0.6736 1.1089 -0.0967 0.1818 -0.0196 427 ALA D C 10700 O O . ALA D 341 ? 1.4307 0.7896 1.2235 -0.0984 0.1804 -0.0138 427 ALA D O 10701 C CB . ALA D 341 ? 1.1788 0.4710 0.9388 -0.1164 0.2046 -0.0340 427 ALA D CB 10702 N N . ALA D 342 ? 1.3790 0.7361 1.1671 -0.0794 0.1793 -0.0149 428 ALA D N 10703 C CA . ALA D 342 ? 1.3199 0.6952 1.1183 -0.0619 0.1739 -0.0027 428 ALA D CA 10704 C C . ALA D 342 ? 1.4583 0.8243 1.2530 -0.0422 0.1791 0.0031 428 ALA D C 10705 O O . ALA D 342 ? 1.4760 0.8232 1.2611 -0.0419 0.1859 -0.0026 428 ALA D O 10706 C CB . ALA D 342 ? 1.1670 0.5808 0.9792 -0.0639 0.1572 -0.0031 428 ALA D CB 10707 N N . THR D 343 ? 1.5936 0.9731 1.3959 -0.0257 0.1760 0.0143 429 THR D N 10708 C CA . THR D 343 ? 1.5857 0.9605 1.3861 -0.0062 0.1801 0.0208 429 THR D CA 10709 C C . THR D 343 ? 1.4124 0.8209 1.2252 0.0057 0.1672 0.0264 429 THR D C 10710 O O . THR D 343 ? 1.2452 0.6763 1.0677 0.0035 0.1579 0.0297 429 THR D O 10711 C CB . THR D 343 ? 1.6950 1.0444 1.4884 0.0058 0.1938 0.0306 429 THR D CB 10712 O OG1 . THR D 343 ? 1.6821 1.0428 1.4824 0.0070 0.1908 0.0387 429 THR D OG1 10713 C CG2 . THR D 343 ? 1.5796 0.8908 1.3585 -0.0041 0.2088 0.0247 429 THR D CG2 10714 N N . THR D 344 ? 1.4777 0.8895 1.2902 0.0181 0.1670 0.0275 430 THR D N 10715 C CA . THR D 344 ? 1.5141 0.9569 1.3378 0.0293 0.1556 0.0327 430 THR D CA 10716 C C . THR D 344 ? 1.6293 1.0732 1.4550 0.0479 0.1596 0.0455 430 THR D C 10717 O O . THR D 344 ? 1.7160 1.1351 1.5338 0.0537 0.1718 0.0506 430 THR D O 10718 C CB . THR D 344 ? 1.3911 0.8432 1.2152 0.0320 0.1511 0.0270 430 THR D CB 10719 O OG1 . THR D 344 ? 1.4207 0.8569 1.2387 0.0465 0.1609 0.0310 430 THR D OG1 10720 C CG2 . THR D 344 ? 1.3774 0.8221 1.1962 0.0145 0.1502 0.0145 430 THR D CG2 10721 N N . LYS D 345 ? 1.5496 1.0223 1.3856 0.0568 0.1493 0.0505 431 LYS D N 10722 C CA . LYS D 345 ? 1.5876 1.0668 1.4265 0.0740 0.1511 0.0625 431 LYS D CA 10723 C C . LYS D 345 ? 1.6800 1.1435 1.5124 0.0892 0.1612 0.0669 431 LYS D C 10724 O O . LYS D 345 ? 1.8107 1.2680 1.6413 0.1028 0.1678 0.0772 431 LYS D O 10725 C CB . LYS D 345 ? 1.5778 1.0923 1.4286 0.0786 0.1374 0.0654 431 LYS D CB 10726 C CG . LYS D 345 ? 1.7647 1.2900 1.6192 0.0945 0.1376 0.0774 431 LYS D CG 10727 C CD . LYS D 345 ? 1.8213 1.3802 1.6868 0.0957 0.1240 0.0789 431 LYS D CD 10728 C CE . LYS D 345 ? 1.7750 1.3461 1.6435 0.1115 0.1240 0.0906 431 LYS D CE 10729 N NZ . LYS D 345 ? 1.6336 1.2313 1.5107 0.1093 0.1129 0.0924 431 LYS D NZ 10730 N N . ALA D 346 ? 1.5746 1.0319 1.4034 0.0871 0.1628 0.0594 432 ALA D N 10731 C CA . ALA D 346 ? 1.5073 0.9480 1.3293 0.1007 0.1733 0.0625 432 ALA D CA 10732 C C . ALA D 346 ? 1.6646 1.0668 1.4731 0.0952 0.1880 0.0590 432 ALA D C 10733 O O . ALA D 346 ? 1.7765 1.1596 1.5774 0.1042 0.1984 0.0597 432 ALA D O 10734 C CB . ALA D 346 ? 1.4004 0.8550 1.2255 0.1027 0.1679 0.0567 432 ALA D CB 10735 N N . GLY D 347 ? 1.6922 1.0830 1.4976 0.0801 0.1892 0.0550 433 GLY D N 10736 C CA . GLY D 347 ? 1.7095 1.0634 1.5018 0.0729 0.2032 0.0514 433 GLY D CA 10737 C C . GLY D 347 ? 1.6862 1.0252 1.4708 0.0579 0.2056 0.0379 433 GLY D C 10738 O O . GLY D 347 ? 1.5623 0.8684 1.3346 0.0524 0.2185 0.0342 433 GLY D O 10739 N N . LEU D 348 ? 1.6489 1.0109 1.4398 0.0509 0.1938 0.0303 438 LEU D N 10740 C CA . LEU D 348 ? 1.5627 0.9128 1.3461 0.0362 0.1951 0.0173 438 LEU D CA 10741 C C . LEU D 348 ? 1.5036 0.8456 1.2838 0.0154 0.1946 0.0098 438 LEU D C 10742 O O . LEU D 348 ? 1.5388 0.8986 1.3275 0.0099 0.1865 0.0125 438 LEU D O 10743 C CB . LEU D 348 ? 1.5202 0.8972 1.3108 0.0350 0.1828 0.0118 438 LEU D CB 10744 C CG . LEU D 348 ? 1.5023 0.8819 1.2926 0.0509 0.1853 0.0144 438 LEU D CG 10745 C CD1 . LEU D 348 ? 1.5856 0.9886 1.3869 0.0681 0.1798 0.0264 438 LEU D CD1 10746 C CD2 . LEU D 348 ? 1.3986 0.7913 1.1898 0.0435 0.1777 0.0046 438 LEU D CD2 10747 N N . SER D 349 ? 1.5003 0.8160 1.2683 0.0038 0.2035 0.0003 439 SER D N 10748 C CA . SER D 349 ? 1.5425 0.8503 1.3066 -0.0174 0.2034 -0.0081 439 SER D CA 10749 C C . SER D 349 ? 1.5624 0.8971 1.3331 -0.0305 0.1891 -0.0171 439 SER D C 10750 O O . SER D 349 ? 1.5575 0.8997 1.3275 -0.0280 0.1854 -0.0218 439 SER D O 10751 C CB . SER D 349 ? 1.5881 0.8563 1.3354 -0.0253 0.2192 -0.0152 439 SER D CB 10752 O OG . SER D 349 ? 1.7020 0.9700 1.4445 -0.0449 0.2158 -0.0287 439 SER D OG 10753 N N . SER D 350 ? 1.5450 0.8946 1.3220 -0.0439 0.1814 -0.0189 440 SER D N 10754 C CA . SER D 350 ? 1.4991 0.8769 1.2835 -0.0553 0.1672 -0.0258 440 SER D CA 10755 C C . SER D 350 ? 1.4178 0.8007 1.2047 -0.0732 0.1639 -0.0295 440 SER D C 10756 O O . SER D 350 ? 1.4953 0.8563 1.2760 -0.0792 0.1738 -0.0291 440 SER D O 10757 C CB . SER D 350 ? 1.5557 0.9663 1.3538 -0.0426 0.1547 -0.0186 440 SER D CB 10758 O OG . SER D 350 ? 1.5532 0.9901 1.3581 -0.0527 0.1415 -0.0245 440 SER D OG 10759 N N . ASN D 351 ? 1.3893 0.8016 1.1853 -0.0816 0.1503 -0.0330 441 ASN D N 10760 C CA . ASN D 351 ? 1.3064 0.7286 1.1064 -0.0982 0.1459 -0.0363 441 ASN D CA 10761 C C . ASN D 351 ? 1.2668 0.7237 1.0819 -0.0948 0.1322 -0.0306 441 ASN D C 10762 O O . ASN D 351 ? 1.2650 0.7398 1.0866 -0.0826 0.1247 -0.0266 441 ASN D O 10763 C CB . ASN D 351 ? 1.2967 0.7196 1.0907 -0.1165 0.1432 -0.0492 441 ASN D CB 10764 C CG . ASN D 351 ? 1.2611 0.6502 1.0390 -0.1211 0.1562 -0.0567 441 ASN D CG 10765 O OD1 . ASN D 351 ? 1.2571 0.6197 1.0268 -0.1267 0.1680 -0.0574 441 ASN D OD1 10766 N ND2 . ASN D 351 ? 1.1869 0.5759 0.9596 -0.1192 0.1546 -0.0625 441 ASN D ND2 10767 N N . ASP D 352 ? 1.2046 0.6708 1.0251 -0.1058 0.1293 -0.0303 442 ASP D N 10768 C CA . ASP D 352 ? 1.3673 0.8675 1.2001 -0.1098 0.1152 -0.0301 442 ASP D CA 10769 C C . ASP D 352 ? 1.1147 0.6225 0.9501 -0.1281 0.1130 -0.0347 442 ASP D C 10770 O O . ASP D 352 ? 1.1581 0.6463 0.9844 -0.1415 0.1208 -0.0416 442 ASP D O 10771 C CB . ASP D 352 ? 1.6146 1.1349 1.4587 -0.0940 0.1084 -0.0194 442 ASP D CB 10772 C CG . ASP D 352 ? 1.7825 1.2942 1.6284 -0.0889 0.1147 -0.0110 442 ASP D CG 10773 O OD1 . ASP D 352 ? 1.9773 1.4614 1.8140 -0.0920 0.1267 -0.0116 442 ASP D OD1 10774 O OD2 . ASP D 352 ? 1.6999 1.2319 1.5560 -0.0819 0.1079 -0.0037 442 ASP D OD2 10775 N N . LEU D 353 ? 1.0386 0.5751 0.8862 -0.1289 0.1024 -0.0311 443 LEU D N 10776 C CA . LEU D 353 ? 1.0691 0.6221 0.9207 -0.1462 0.0963 -0.0372 443 LEU D CA 10777 C C . LEU D 353 ? 1.0920 0.6623 0.9547 -0.1473 0.0925 -0.0306 443 LEU D C 10778 O O . LEU D 353 ? 1.1921 0.7762 1.0631 -0.1340 0.0878 -0.0222 443 LEU D O 10779 C CB . LEU D 353 ? 1.1204 0.6969 0.9757 -0.1467 0.0847 -0.0414 443 LEU D CB 10780 C CG . LEU D 353 ? 1.1704 0.7579 1.0236 -0.1641 0.0795 -0.0513 443 LEU D CG 10781 C CD1 . LEU D 353 ? 1.1968 0.8152 1.0627 -0.1690 0.0693 -0.0486 443 LEU D CD1 10782 C CD2 . LEU D 353 ? 1.1958 0.7594 1.0381 -0.1798 0.0896 -0.0593 443 LEU D CD2 10783 N N . ILE D 354 ? 1.0109 0.5804 0.8735 -0.1636 0.0950 -0.0347 444 ILE D N 10784 C CA . ILE D 354 ? 0.9650 0.5545 0.8389 -0.1670 0.0905 -0.0297 444 ILE D CA 10785 C C . ILE D 354 ? 0.9905 0.6008 0.8685 -0.1845 0.0834 -0.0371 444 ILE D C 10786 O O . ILE D 354 ? 0.9747 0.5747 0.8442 -0.1981 0.0865 -0.0465 444 ILE D O 10787 C CB . ILE D 354 ? 1.1228 0.6918 0.9940 -0.1684 0.1018 -0.0251 444 ILE D CB 10788 C CG1 . ILE D 354 ? 1.3075 0.8983 1.1904 -0.1742 0.0974 -0.0209 444 ILE D CG1 10789 C CG2 . ILE D 354 ? 1.0183 0.5589 0.8768 -0.1827 0.1129 -0.0333 444 ILE D CG2 10790 C CD1 . ILE D 354 ? 1.3484 0.9259 1.2318 -0.1680 0.1057 -0.0122 444 ILE D CD1 10791 N N . THR D 355 ? 1.0766 0.7169 0.9674 -0.1840 0.0739 -0.0330 445 THR D N 10792 C CA . THR D 355 ? 1.1037 0.7675 1.0001 -0.1996 0.0667 -0.0386 445 THR D CA 10793 C C . THR D 355 ? 1.1138 0.7915 1.0199 -0.2064 0.0666 -0.0345 445 THR D C 10794 O O . THR D 355 ? 1.1290 0.8091 1.0413 -0.1957 0.0675 -0.0256 445 THR D O 10795 C CB . THR D 355 ? 1.0298 0.7215 0.9326 -0.1946 0.0539 -0.0389 445 THR D CB 10796 O OG1 . THR D 355 ? 1.0408 0.7477 0.9535 -0.1794 0.0487 -0.0293 445 THR D OG1 10797 C CG2 . THR D 355 ? 1.0276 0.7067 0.9205 -0.1902 0.0541 -0.0440 445 THR D CG2 10798 N N . PHE D 356 ? 1.0563 0.7437 0.9633 -0.2248 0.0655 -0.0413 446 PHE D N 10799 C CA . PHE D 356 ? 0.9114 0.6157 0.8283 -0.2336 0.0647 -0.0386 446 PHE D CA 10800 C C . PHE D 356 ? 1.0705 0.8068 0.9946 -0.2453 0.0543 -0.0435 446 PHE D C 10801 O O . PHE D 356 ? 1.1977 0.9333 1.1149 -0.2554 0.0524 -0.0524 446 PHE D O 10802 C CB . PHE D 356 ? 0.9502 0.6304 0.8600 -0.2473 0.0767 -0.0422 446 PHE D CB 10803 C CG . PHE D 356 ? 1.0722 0.7236 0.9765 -0.2361 0.0875 -0.0355 446 PHE D CG 10804 C CD1 . PHE D 356 ? 1.0107 0.6675 0.9231 -0.2306 0.0895 -0.0266 446 PHE D CD1 10805 C CD2 . PHE D 356 ? 1.1408 0.7601 1.0317 -0.2307 0.0959 -0.0378 446 PHE D CD2 10806 C CE1 . PHE D 356 ? 1.0468 0.6779 0.9537 -0.2199 0.0993 -0.0199 446 PHE D CE1 10807 C CE2 . PHE D 356 ? 1.2087 0.8023 1.0945 -0.2196 0.1059 -0.0309 446 PHE D CE2 10808 C CZ . PHE D 356 ? 1.1600 0.7598 1.0537 -0.2142 0.1075 -0.0219 446 PHE D CZ 10809 N N . CYS D 357 ? 0.9999 0.7644 0.9375 -0.2437 0.0478 -0.0377 447 CYS D N 10810 C CA . CYS D 357 ? 0.9473 0.7447 0.8931 -0.2546 0.0384 -0.0411 447 CYS D CA 10811 C C . CYS D 357 ? 1.0111 0.8191 0.9642 -0.2685 0.0414 -0.0409 447 CYS D C 10812 O O . CYS D 357 ? 0.9849 0.7788 0.9389 -0.2660 0.0493 -0.0359 447 CYS D O 10813 C CB . CYS D 357 ? 0.8499 0.6747 0.8060 -0.2403 0.0274 -0.0344 447 CYS D CB 10814 S SG . CYS D 357 ? 1.2881 1.1055 1.2361 -0.2274 0.0226 -0.0362 447 CYS D SG 10815 N N . GLY D 358 ? 1.0616 0.8949 1.0198 -0.2832 0.0354 -0.0461 448 GLY D N 10816 C CA . GLY D 358 ? 1.0153 0.8617 0.9812 -0.2978 0.0379 -0.0465 448 GLY D CA 10817 C C . GLY D 358 ? 1.0599 0.9335 1.0415 -0.2888 0.0328 -0.0366 448 GLY D C 10818 O O . GLY D 358 ? 1.1027 0.9918 1.0901 -0.2735 0.0251 -0.0307 448 GLY D O 10819 N N . THR D 359 ? 1.0087 0.8872 0.9966 -0.2983 0.0378 -0.0348 449 THR D N 10820 C CA . THR D 359 ? 0.9404 0.8495 0.9440 -0.2935 0.0327 -0.0269 449 THR D CA 10821 C C . THR D 359 ? 0.9733 0.8964 0.9832 -0.3131 0.0357 -0.0301 449 THR D C 10822 O O . THR D 359 ? 1.0269 0.9260 1.0290 -0.3255 0.0457 -0.0348 449 THR D O 10823 C CB . THR D 359 ? 1.0787 0.9761 1.0851 -0.2759 0.0371 -0.0166 449 THR D CB 10824 O OG1 . THR D 359 ? 1.0839 1.0102 1.1051 -0.2742 0.0337 -0.0098 449 THR D OG1 10825 C CG2 . THR D 359 ? 1.0475 0.9087 1.0442 -0.2793 0.0502 -0.0170 449 THR D CG2 10826 N N . GLY D 360 ? 0.9706 0.9323 0.9946 -0.3158 0.0275 -0.0274 450 GLY D N 10827 C CA . GLY D 360 ? 1.0106 0.9923 1.0425 -0.3349 0.0288 -0.0306 450 GLY D CA 10828 C C . GLY D 360 ? 0.9384 0.9039 0.9713 -0.3410 0.0401 -0.0279 450 GLY D C 10829 O O . GLY D 360 ? 1.0069 0.9750 1.0402 -0.3608 0.0445 -0.0337 450 GLY D O 10830 N N . GLY D 361 ? 0.9751 0.9241 1.0079 -0.3245 0.0447 -0.0193 451 GLY D N 10831 C CA . GLY D 361 ? 1.0802 1.0145 1.1139 -0.3279 0.0553 -0.0153 451 GLY D CA 10832 C C . GLY D 361 ? 1.1474 1.0373 1.1653 -0.3319 0.0675 -0.0189 451 GLY D C 10833 O O . GLY D 361 ? 1.2656 1.1327 1.2715 -0.3263 0.0681 -0.0226 451 GLY D O 10834 N N . SER D 362 ? 1.1816 1.0587 1.1992 -0.3411 0.0779 -0.0177 452 SER D N 10835 C CA . SER D 362 ? 1.2534 1.0867 1.2558 -0.3437 0.0907 -0.0199 452 SER D CA 10836 C C . SER D 362 ? 1.1805 0.9920 1.1786 -0.3214 0.0948 -0.0102 452 SER D C 10837 O O . SER D 362 ? 1.1545 0.9830 1.1625 -0.3084 0.0912 -0.0011 452 SER D O 10838 C CB . SER D 362 ? 1.2321 1.0572 1.2341 -0.3640 0.1013 -0.0231 452 SER D CB 10839 O OG . SER D 362 ? 1.1836 1.0183 1.1954 -0.3593 0.1047 -0.0139 452 SER D OG 10840 N N . MET D 363 ? 1.0968 0.8711 1.0798 -0.3172 0.1023 -0.0123 453 MET D N 10841 C CA . MET D 363 ? 1.0766 0.8308 1.0542 -0.2955 0.1049 -0.0041 453 MET D CA 10842 C C . MET D 363 ? 1.1634 0.8843 1.1323 -0.2959 0.1193 -0.0002 453 MET D C 10843 O O . MET D 363 ? 1.1494 0.8517 1.1111 -0.3128 0.1285 -0.0064 453 MET D O 10844 C CB . MET D 363 ? 1.0965 0.8342 1.0632 -0.2874 0.1022 -0.0085 453 MET D CB 10845 C CG . MET D 363 ? 0.9181 0.6850 0.8920 -0.2806 0.0881 -0.0098 453 MET D CG 10846 S SD . MET D 363 ? 1.2000 0.9894 1.1858 -0.2582 0.0804 0.0024 453 MET D SD 10847 C CE . MET D 363 ? 0.7714 0.5244 0.7445 -0.2393 0.0875 0.0077 453 MET D CE 10848 N N . PRO D 364 ? 1.1849 0.8979 1.1539 -0.2775 0.1216 0.0101 454 PRO D N 10849 C CA . PRO D 364 ? 1.2154 0.8944 1.1745 -0.2740 0.1352 0.0151 454 PRO D CA 10850 C C . PRO D 364 ? 1.3531 0.9950 1.2956 -0.2747 0.1430 0.0097 454 PRO D C 10851 O O . PRO D 364 ? 1.3843 1.0274 1.3232 -0.2732 0.1369 0.0036 454 PRO D O 10852 C CB . PRO D 364 ? 1.1310 0.8143 1.0935 -0.2512 0.1324 0.0265 454 PRO D CB 10853 C CG . PRO D 364 ? 1.1647 0.8756 1.1349 -0.2418 0.1183 0.0257 454 PRO D CG 10854 C CD . PRO D 364 ? 1.1586 0.8954 1.1371 -0.2592 0.1116 0.0177 454 PRO D CD 10855 N N . ASP D 365 ? 1.4603 1.0691 1.3924 -0.2769 0.1570 0.0120 455 ASP D N 10856 C CA . ASP D 365 ? 1.4778 1.0489 1.3936 -0.2741 0.1658 0.0088 455 ASP D CA 10857 C C . ASP D 365 ? 1.4279 0.9916 1.3406 -0.2492 0.1635 0.0172 455 ASP D C 10858 O O . ASP D 365 ? 1.5961 1.1482 1.5069 -0.2372 0.1697 0.0270 455 ASP D O 10859 C CB . ASP D 365 ? 1.5351 1.0719 1.4402 -0.2841 0.1825 0.0091 455 ASP D CB 10860 C CG . ASP D 365 ? 1.6278 1.1683 1.5341 -0.3107 0.1860 -0.0007 455 ASP D CG 10861 O OD1 . ASP D 365 ? 1.5548 1.1153 1.4651 -0.3219 0.1771 -0.0100 455 ASP D OD1 10862 O OD2 . ASP D 365 ? 1.6875 1.2109 1.5902 -0.3203 0.1978 0.0011 455 ASP D OD2 10863 N N . VAL D 366 ? 1.2354 0.8075 1.1478 -0.2416 0.1544 0.0136 456 VAL D N 10864 C CA . VAL D 366 ? 1.1285 0.6947 1.0379 -0.2190 0.1519 0.0207 456 VAL D CA 10865 C C . VAL D 366 ? 1.2760 0.8157 1.1722 -0.2158 0.1560 0.0153 456 VAL D C 10866 O O . VAL D 366 ? 1.3146 0.8564 1.2084 -0.2272 0.1527 0.0052 456 VAL D O 10867 C CB . VAL D 366 ? 1.0814 0.6841 1.0039 -0.2079 0.1369 0.0241 456 VAL D CB 10868 C CG1 . VAL D 366 ? 1.1984 0.8289 1.1293 -0.2219 0.1269 0.0155 456 VAL D CG1 10869 C CG2 . VAL D 366 ? 0.9871 0.5847 0.9054 -0.1881 0.1329 0.0276 456 VAL D CG2 10870 N N . ASN D 367 ? 1.2707 0.7856 1.1582 -0.2002 0.1636 0.0223 457 ASN D N 10871 C CA . ASN D 367 ? 1.3986 0.8872 1.2735 -0.1943 0.1686 0.0189 457 ASN D CA 10872 C C . ASN D 367 ? 1.3546 0.8582 1.2331 -0.1757 0.1584 0.0222 457 ASN D C 10873 O O . ASN D 367 ? 1.4173 0.9293 1.3003 -0.1596 0.1558 0.0320 457 ASN D O 10874 C CB . ASN D 367 ? 1.5768 1.0276 1.4392 -0.1888 0.1845 0.0246 457 ASN D CB 10875 C CG . ASN D 367 ? 1.7146 1.1390 1.5647 -0.1778 0.1901 0.0236 457 ASN D CG 10876 O OD1 . ASN D 367 ? 1.8557 1.2701 1.6992 -0.1870 0.1910 0.0137 457 ASN D OD1 10877 N ND2 . ASN D 367 ? 1.6031 1.0166 1.4498 -0.1579 0.1940 0.0341 457 ASN D ND2 10878 N N . TRP D 368 ? 1.2381 0.7457 1.1146 -0.1786 0.1526 0.0140 458 TRP D N 10879 C CA . TRP D 368 ? 1.2553 0.7808 1.1364 -0.1636 0.1418 0.0160 458 TRP D CA 10880 C C . TRP D 368 ? 1.2614 0.7626 1.1319 -0.1493 0.1475 0.0179 458 TRP D C 10881 O O . TRP D 368 ? 1.2355 0.7484 1.1083 -0.1376 0.1398 0.0186 458 TRP D O 10882 C CB . TRP D 368 ? 1.2361 0.7854 1.1229 -0.1738 0.1304 0.0068 458 TRP D CB 10883 C CG . TRP D 368 ? 1.2472 0.8264 1.1465 -0.1847 0.1228 0.0061 458 TRP D CG 10884 C CD1 . TRP D 368 ? 1.3220 0.9065 1.2228 -0.2050 0.1236 -0.0013 458 TRP D CD1 10885 C CD2 . TRP D 368 ? 1.1922 0.8003 1.1041 -0.1759 0.1135 0.0131 458 TRP D CD2 10886 N NE1 . TRP D 368 ? 1.1991 0.8153 1.1134 -0.2086 0.1153 0.0012 458 TRP D NE1 10887 C CE2 . TRP D 368 ? 1.1998 0.8300 1.1209 -0.1908 0.1093 0.0100 458 TRP D CE2 10888 C CE3 . TRP D 368 ? 1.1241 0.7419 1.0402 -0.1570 0.1086 0.0216 458 TRP D CE3 10889 C CZ2 . TRP D 368 ? 1.2189 0.8794 1.1530 -0.1865 0.1008 0.0154 458 TRP D CZ2 10890 C CZ3 . TRP D 368 ? 1.1085 0.7553 1.0370 -0.1536 0.1002 0.0263 458 TRP D CZ3 10891 C CH2 . TRP D 368 ? 1.2243 0.8917 1.1616 -0.1679 0.0966 0.0234 458 TRP D CH2 10892 N N . GLY D 369 ? 1.2945 0.7621 1.1533 -0.1501 0.1616 0.0190 459 GLY D N 10893 C CA . GLY D 369 ? 1.4206 0.8635 1.2688 -0.1363 0.1685 0.0214 459 GLY D CA 10894 C C . GLY D 369 ? 1.6099 1.0169 1.4437 -0.1465 0.1822 0.0148 459 GLY D C 10895 O O . GLY D 369 ? 1.5586 0.9565 1.3899 -0.1638 0.1881 0.0100 459 GLY D O 10896 O OXT . GLY D 369 ? 1.7710 1.1567 1.5951 -0.1380 0.1882 0.0140 459 GLY D OXT 10897 C C1 . NAG E . ? 1.0008 0.9891 0.9803 0.0941 -0.0190 0.1028 601 NAG A C1 10898 C C2 . NAG E . ? 1.0123 1.0153 0.9980 0.1033 -0.0168 0.1114 601 NAG A C2 10899 C C3 . NAG E . ? 0.9784 0.9975 0.9672 0.1049 -0.0216 0.1164 601 NAG A C3 10900 C C4 . NAG E . ? 1.0338 1.0635 1.0269 0.0937 -0.0295 0.1121 601 NAG A C4 10901 C C5 . NAG E . ? 1.0154 1.0275 1.0017 0.0854 -0.0305 0.1034 601 NAG A C5 10902 C C6 . NAG E . ? 1.0097 1.0320 1.0008 0.0746 -0.0373 0.0992 601 NAG A C6 10903 C C7 . NAG E . ? 1.1631 1.1525 1.1450 0.1179 -0.0037 0.1163 601 NAG A C7 10904 C C8 . NAG E . ? 1.0436 1.0210 1.0188 0.1291 0.0048 0.1206 601 NAG A C8 10905 N N2 . NAG E . ? 1.0562 1.0459 1.0355 0.1131 -0.0088 0.1144 601 NAG A N2 10906 O O3 . NAG E . ? 0.9988 1.0355 0.9955 0.1126 -0.0203 0.1244 601 NAG A O3 10907 O O4 . NAG E . ? 1.2988 1.3389 1.2911 0.0947 -0.0336 0.1154 601 NAG A O4 10908 O O5 . NAG E . ? 1.0882 1.0881 1.0731 0.0852 -0.0261 0.1001 601 NAG A O5 10909 O O6 . NAG E . ? 0.9713 1.0081 0.9725 0.0724 -0.0384 0.1008 601 NAG A O6 10910 O O7 . NAG E . ? 1.1866 1.1841 1.1757 0.1138 -0.0050 0.1147 601 NAG A O7 10911 C C1 . NAG F . ? 1.5011 1.5670 1.5043 0.0939 -0.0379 0.1200 602 NAG A C1 10912 C C2 . NAG F . ? 1.4444 1.5219 1.4468 0.0893 -0.0445 0.1201 602 NAG A C2 10913 C C3 . NAG F . ? 1.6821 1.7881 1.6961 0.0862 -0.0497 0.1236 602 NAG A C3 10914 C C4 . NAG F . ? 1.9152 2.0357 1.9367 0.0969 -0.0461 0.1325 602 NAG A C4 10915 C C5 . NAG F . ? 1.8488 1.9523 1.8683 0.1039 -0.0380 0.1329 602 NAG A C5 10916 C C6 . NAG F . ? 1.7330 1.8470 1.7561 0.1175 -0.0335 0.1428 602 NAG A C6 10917 C C7 . NAG F . ? 1.4552 1.5189 1.4465 0.0751 -0.0513 0.1094 602 NAG A C7 10918 C C8 . NAG F . ? 1.4695 1.5441 1.4643 0.0632 -0.0579 0.1043 602 NAG A C8 10919 N N2 . NAG F . ? 1.3550 1.4203 1.3524 0.0787 -0.0475 0.1114 602 NAG A N2 10920 O O3 . NAG F . ? 1.6983 1.8164 1.7106 0.0832 -0.0555 0.1246 602 NAG A O3 10921 O O4 . NAG F . ? 2.0540 2.1995 2.0876 0.0917 -0.0502 0.1340 602 NAG A O4 10922 O O5 . NAG F . ? 1.7696 1.8458 1.7772 0.1049 -0.0341 0.1284 602 NAG A O5 10923 O O6 . NAG F . ? 1.6334 1.7538 1.6526 0.1233 -0.0354 0.1481 602 NAG A O6 10924 O O7 . NAG F . ? 1.4704 1.5237 1.4531 0.0808 -0.0491 0.1114 602 NAG A O7 10925 C C1 . BMA G . ? 2.0433 2.2138 2.0816 0.0952 -0.0545 0.1408 603 BMA A C1 10926 C C2 . BMA G . ? 1.9314 2.1304 1.9835 0.0898 -0.0583 0.1428 603 BMA A C2 10927 C C3 . BMA G . ? 1.8632 2.0909 1.9206 0.0945 -0.0627 0.1507 603 BMA A C3 10928 C C4 . BMA G . ? 1.8754 2.1010 1.9239 0.0906 -0.0679 0.1485 603 BMA A C4 10929 C C5 . BMA G . ? 1.8584 2.0528 1.8931 0.0957 -0.0634 0.1461 603 BMA A C5 10930 C C6 . BMA G . ? 1.7412 1.9326 1.7670 0.0904 -0.0685 0.1429 603 BMA A C6 10931 O O2 . BMA G . ? 1.8114 2.0110 1.8655 0.0749 -0.0628 0.1345 603 BMA A O2 10932 O O3 . BMA G . ? 1.7426 1.9974 1.8127 0.0873 -0.0668 0.1513 603 BMA A O3 10933 O O4 . BMA G . ? 1.8759 2.1265 1.9278 0.0976 -0.0711 0.1570 603 BMA A O4 10934 O O5 . BMA G . ? 1.9999 2.1707 2.0316 0.0904 -0.0598 0.1385 603 BMA A O5 10935 O O6 . BMA G . ? 1.6670 1.8432 1.6885 0.0776 -0.0706 0.1325 603 BMA A O6 10936 CA CA . CA H . ? 0.9944 0.8139 0.7845 -0.1136 0.0480 -0.0986 604 CA A CA 10937 C C1 . NAG I . ? 0.9790 0.9123 0.8118 0.0157 -0.0615 0.0532 601 NAG B C1 10938 C C2 . NAG I . ? 1.0632 1.0004 0.8912 0.0244 -0.0605 0.0631 601 NAG B C2 10939 C C3 . NAG I . ? 1.0575 1.0156 0.8884 0.0259 -0.0667 0.0680 601 NAG B C3 10940 C C4 . NAG I . ? 1.0144 0.9807 0.8576 0.0240 -0.0694 0.0663 601 NAG B C4 10941 C C5 . NAG I . ? 0.9691 0.9293 0.8159 0.0149 -0.0699 0.0563 601 NAG B C5 10942 C C6 . NAG I . ? 1.0084 0.9743 0.8670 0.0137 -0.0715 0.0552 601 NAG B C6 10943 C C7 . NAG I . ? 1.1691 1.0825 0.9818 0.0305 -0.0506 0.0672 601 NAG B C7 10944 C C8 . NAG I . ? 0.9553 0.8637 0.7564 0.0354 -0.0473 0.0733 601 NAG B C8 10945 N N2 . NAG I . ? 1.0738 1.0030 0.8901 0.0260 -0.0573 0.0650 601 NAG B N2 10946 O O3 . NAG I . ? 1.1754 1.1362 1.0026 0.0354 -0.0650 0.0779 601 NAG B O3 10947 O O4 . NAG I . ? 1.2729 1.2603 1.1195 0.0243 -0.0754 0.0705 601 NAG B O4 10948 O O5 . NAG I . ? 1.0469 0.9883 0.8903 0.0144 -0.0644 0.0522 601 NAG B O5 10949 O O6 . NAG I . ? 0.8879 0.8467 0.7510 0.0209 -0.0673 0.0594 601 NAG B O6 10950 O O7 . NAG I . ? 1.2488 1.1516 1.0668 0.0305 -0.0468 0.0644 601 NAG B O7 10951 C C1 . NAG J . ? 1.5487 1.5413 1.4009 0.0334 -0.0740 0.0787 602 NAG B C1 10952 C C2 . NAG J . ? 1.6055 1.6190 1.4677 0.0314 -0.0797 0.0799 602 NAG B C2 10953 C C3 . NAG J . ? 1.5891 1.6077 1.4579 0.0414 -0.0777 0.0886 602 NAG B C3 10954 C C4 . NAG J . ? 1.6946 1.7130 1.5557 0.0518 -0.0751 0.0981 602 NAG B C4 10955 C C5 . NAG J . ? 1.7510 1.7476 1.6009 0.0521 -0.0697 0.0959 602 NAG B C5 10956 C C6 . NAG J . ? 1.6756 1.6719 1.5161 0.0616 -0.0672 0.1054 602 NAG B C6 10957 C C7 . NAG J . ? 1.5540 1.5787 1.4254 0.0140 -0.0865 0.0669 602 NAG B C7 10958 C C8 . NAG J . ? 1.4616 1.4859 1.3426 0.0078 -0.0871 0.0612 602 NAG B C8 10959 N N2 . NAG J . ? 1.6043 1.6152 1.4731 0.0224 -0.0810 0.0712 602 NAG B N2 10960 O O3 . NAG J . ? 1.4323 1.4726 1.3102 0.0397 -0.0830 0.0905 602 NAG B O3 10961 O O4 . NAG J . ? 1.6305 1.6491 1.4971 0.0614 -0.0716 0.1053 602 NAG B O4 10962 O O5 . NAG J . ? 1.7818 1.7761 1.6269 0.0422 -0.0723 0.0876 602 NAG B O5 10963 O O6 . NAG J . ? 1.5310 1.5485 1.3689 0.0613 -0.0735 0.1093 602 NAG B O6 10964 O O7 . NAG J . ? 1.5262 1.5631 1.3919 0.0110 -0.0908 0.0675 602 NAG B O7 10965 C C1 . NAG K . ? 1.8683 1.2788 1.5769 -0.0046 0.1724 -0.1095 603 NAG B C1 10966 C C2 . NAG K . ? 1.7994 1.2108 1.5124 -0.0130 0.1670 -0.1073 603 NAG B C2 10967 C C3 . NAG K . ? 1.8139 1.1913 1.5135 -0.0189 0.1795 -0.1123 603 NAG B C3 10968 C C4 . NAG K . ? 1.9653 1.3213 1.6618 -0.0023 0.1943 -0.1073 603 NAG B C4 10969 C C5 . NAG K . ? 1.9559 1.3152 1.6505 0.0081 0.1984 -0.1080 603 NAG B C5 10970 C C6 . NAG K . ? 2.0045 1.3498 1.7003 0.0278 0.2113 -0.1002 603 NAG B C6 10971 C C7 . NAG K . ? 1.5920 1.0472 1.3207 -0.0285 0.1418 -0.1056 603 NAG B C7 10972 C C8 . NAG K . ? 1.4199 0.8857 1.1477 -0.0456 0.1317 -0.1108 603 NAG B C8 10973 N N2 . NAG K . ? 1.6692 1.0996 1.3842 -0.0281 0.1539 -0.1118 603 NAG B N2 10974 O O3 . NAG K . ? 1.6459 1.0246 1.3500 -0.0265 0.1750 -0.1099 603 NAG B O3 10975 O O4 . NAG K . ? 2.0991 1.4206 1.7801 -0.0095 0.2068 -0.1138 603 NAG B O4 10976 O O5 . NAG K . ? 1.9059 1.2983 1.6126 0.0106 0.1857 -0.1049 603 NAG B O5 10977 O O6 . NAG K . ? 1.9998 1.3590 1.7102 0.0393 0.2075 -0.0883 603 NAG B O6 10978 O O7 . NAG K . ? 1.6515 1.1212 1.3931 -0.0157 0.1388 -0.0961 603 NAG B O7 10979 C C1 . NAG L . ? 1.9970 1.3054 1.6812 -0.0036 0.2126 -0.1065 604 NAG B C1 10980 C C2 . NAG L . ? 1.9957 1.2635 1.6631 -0.0025 0.2309 -0.1109 604 NAG B C2 10981 C C3 . NAG L . ? 2.0507 1.3016 1.7196 0.0022 0.2380 -0.1037 604 NAG B C3 10982 C C4 . NAG L . ? 1.9910 1.2541 1.6658 -0.0125 0.2271 -0.1042 604 NAG B C4 10983 C C5 . NAG L . ? 1.9226 1.2269 1.6140 -0.0124 0.2090 -0.0999 604 NAG B C5 10984 C C6 . NAG L . ? 1.8515 1.1692 1.5487 -0.0274 0.1981 -0.1010 604 NAG B C6 10985 C C7 . NAG L . ? 1.8955 1.1493 1.5487 0.0079 0.2438 -0.1186 604 NAG B C7 10986 C C8 . NAG L . ? 1.9395 1.1833 1.5893 0.0251 0.2554 -0.1160 604 NAG B C8 10987 N N2 . NAG L . ? 1.8613 1.1208 1.5252 0.0129 0.2408 -0.1093 604 NAG B N2 10988 O O3 . NAG L . ? 2.0750 1.2928 1.7291 0.0000 0.2532 -0.1081 604 NAG B O3 10989 O O4 . NAG L . ? 1.8616 1.1106 1.5387 -0.0061 0.2338 -0.0962 604 NAG B O4 10990 O O5 . NAG L . ? 1.9008 1.2181 1.5897 -0.0166 0.2036 -0.1068 604 NAG B O5 10991 O O6 . NAG L . ? 1.8673 1.1942 1.5592 -0.0448 0.1902 -0.1116 604 NAG B O6 10992 O O7 . NAG L . ? 1.8589 1.1163 1.5052 -0.0097 0.2374 -0.1288 604 NAG B O7 10993 CA CA . CA M . ? 1.0260 0.7849 0.7837 -0.0025 0.0876 -0.0962 605 CA B CA 10994 C C1 . NAG N . ? 1.1888 1.4367 1.2897 -0.1454 -0.0745 0.0470 601 NAG C C1 10995 C C2 . NAG N . ? 1.1542 1.4404 1.2658 -0.1535 -0.0799 0.0487 601 NAG C C2 10996 C C3 . NAG N . ? 1.1771 1.4848 1.2914 -0.1411 -0.0862 0.0552 601 NAG C C3 10997 C C4 . NAG N . ? 1.3144 1.6043 1.4154 -0.1368 -0.0890 0.0516 601 NAG C C4 10998 C C5 . NAG N . ? 1.1564 1.4078 1.2474 -0.1307 -0.0832 0.0491 601 NAG C C5 10999 C C6 . NAG N . ? 0.9993 1.2332 1.0771 -0.1292 -0.0857 0.0443 601 NAG C C6 11000 C C7 . NAG N . ? 1.0648 1.3766 1.1939 -0.1722 -0.0750 0.0488 601 NAG C C7 11001 C C8 . NAG N . ? 0.8312 1.1702 0.9758 -0.1722 -0.0737 0.0552 601 NAG C C8 11002 N N2 . NAG N . ? 1.0529 1.3542 1.1770 -0.1556 -0.0764 0.0530 601 NAG C N2 11003 O O3 . NAG N . ? 1.1017 1.4458 1.2250 -0.1490 -0.0918 0.0564 601 NAG C O3 11004 O O4 . NAG N . ? 1.5781 1.8845 1.6813 -0.1232 -0.0935 0.0589 601 NAG C O4 11005 O O5 . NAG N . ? 1.1919 1.4266 1.2815 -0.1422 -0.0777 0.0435 601 NAG C O5 11006 O O6 . NAG N . ? 0.9438 1.1738 1.0154 -0.1456 -0.0867 0.0354 601 NAG C O6 11007 O O7 . NAG N . ? 1.1445 1.4444 1.2661 -0.1870 -0.0745 0.0400 601 NAG C O7 11008 C C1 . NAG O . ? 1.6307 1.9604 1.7332 -0.1306 -0.1007 0.0569 602 NAG C C1 11009 C C2 . NAG O . ? 1.5698 1.9083 1.6700 -0.1154 -0.1049 0.0636 602 NAG C C2 11010 C C3 . NAG O . ? 1.5296 1.8936 1.6284 -0.1227 -0.1127 0.0620 602 NAG C C3 11011 C C4 . NAG O . ? 1.5479 1.9453 1.6583 -0.1356 -0.1156 0.0617 602 NAG C C4 11012 C C5 . NAG O . ? 1.5476 1.9314 1.6596 -0.1503 -0.1103 0.0545 602 NAG C C5 11013 C C6 . NAG O . ? 1.3805 1.7980 1.5048 -0.1636 -0.1126 0.0543 602 NAG C C6 11014 C C7 . NAG O . ? 1.3169 1.6128 1.4060 -0.0898 -0.0989 0.0688 602 NAG C C7 11015 C C8 . NAG O . ? 1.2208 1.4880 1.2974 -0.0815 -0.0974 0.0670 602 NAG C C8 11016 N N2 . NAG O . ? 1.4503 1.7564 1.5387 -0.1060 -0.1022 0.0622 602 NAG C N2 11017 O O3 . NAG O . ? 1.4793 1.8563 1.5785 -0.1075 -0.1161 0.0703 602 NAG C O3 11018 O O4 . NAG O . ? 1.5476 1.9647 1.6541 -0.1450 -0.1227 0.0581 602 NAG C O4 11019 O O5 . NAG O . ? 1.6486 2.0108 1.7626 -0.1406 -0.1033 0.0580 602 NAG C O5 11020 O O6 . NAG O . ? 1.2509 1.6973 1.3887 -0.1522 -0.1140 0.0649 602 NAG C O6 11021 O O7 . NAG O . ? 1.2819 1.5910 1.3812 -0.0821 -0.0969 0.0760 602 NAG C O7 11022 C C1 . NAG P . ? 1.2129 1.1981 1.1111 0.0713 -0.0162 0.0627 603 NAG C C1 11023 C C2 . NAG P . ? 1.1665 1.1488 1.0690 0.0674 -0.0185 0.0574 603 NAG C C2 11024 C C3 . NAG P . ? 1.2097 1.2001 1.1067 0.0633 -0.0208 0.0504 603 NAG C C3 11025 C C4 . NAG P . ? 1.3399 1.3452 1.2316 0.0659 -0.0227 0.0520 603 NAG C C4 11026 C C5 . NAG P . ? 1.4187 1.4254 1.3064 0.0701 -0.0204 0.0577 603 NAG C C5 11027 C C6 . NAG P . ? 1.5319 1.5544 1.4142 0.0736 -0.0224 0.0603 603 NAG C C6 11028 C C7 . NAG P . ? 1.0914 1.0544 1.0049 0.0642 -0.0168 0.0570 603 NAG C C7 11029 C C8 . NAG P . ? 0.8664 0.8210 0.7826 0.0604 -0.0157 0.0537 603 NAG C C8 11030 N N2 . NAG P . ? 1.2144 1.1852 1.1210 0.0644 -0.0168 0.0556 603 NAG C N2 11031 O O3 . NAG P . ? 1.2133 1.2019 1.1143 0.0602 -0.0228 0.0464 603 NAG C O3 11032 O O4 . NAG P . ? 1.3744 1.3867 1.2601 0.0607 -0.0241 0.0448 603 NAG C O4 11033 O O5 . NAG P . ? 1.3077 1.3058 1.2013 0.0743 -0.0183 0.0643 603 NAG C O5 11034 O O6 . NAG P . ? 1.6475 1.6717 1.5344 0.0800 -0.0228 0.0675 603 NAG C O6 11035 O O7 . NAG P . ? 0.9870 0.9495 0.9043 0.0669 -0.0174 0.0608 603 NAG C O7 11036 C C1 . FUC Q . ? 1.7463 1.7867 1.6315 0.0819 -0.0264 0.0676 604 FUC C C1 11037 C C2 . FUC Q . ? 1.7184 1.7575 1.6112 0.0853 -0.0274 0.0704 604 FUC C C2 11038 C C3 . FUC Q . ? 1.7721 1.8015 1.6680 0.0920 -0.0241 0.0792 604 FUC C C3 11039 C C4 . FUC Q . ? 1.8174 1.8553 1.7071 0.0980 -0.0231 0.0860 604 FUC C C4 11040 C C5 . FUC Q . ? 1.8028 1.8444 1.6852 0.0937 -0.0229 0.0821 604 FUC C C5 11041 C C6 . FUC Q . ? 1.7204 1.7720 1.5956 0.0993 -0.0222 0.0884 604 FUC C C6 11042 O O2 . FUC Q . ? 1.7129 1.7426 1.6107 0.0799 -0.0278 0.0647 604 FUC C O2 11043 O O3 . FUC Q . ? 1.7331 1.7610 1.6348 0.0956 -0.0246 0.0818 604 FUC C O3 11044 O O4 . FUC Q . ? 1.8092 1.8635 1.6976 0.1030 -0.0258 0.0889 604 FUC C O4 11045 O O5 . FUC Q . ? 1.8395 1.8901 1.7193 0.0874 -0.0262 0.0735 604 FUC C O5 11046 C C1 . NAG R . ? 1.3382 1.3621 1.2252 0.0601 -0.0277 0.0430 605 NAG C C1 11047 C C2 . NAG R . ? 1.3138 1.3502 1.1923 0.0557 -0.0291 0.0375 605 NAG C C2 11048 C C3 . NAG R . ? 1.2955 1.3462 1.1753 0.0537 -0.0330 0.0344 605 NAG C C3 11049 C C4 . NAG R . ? 1.3806 1.4242 1.2679 0.0517 -0.0336 0.0322 605 NAG C C4 11050 C C5 . NAG R . ? 1.3396 1.3689 1.2341 0.0565 -0.0317 0.0379 605 NAG C C5 11051 C C6 . NAG R . ? 1.2064 1.2271 1.1069 0.0535 -0.0320 0.0348 605 NAG C C6 11052 C C7 . NAG R . ? 1.2464 1.2850 1.1121 0.0576 -0.0255 0.0398 605 NAG C C7 11053 C C8 . NAG R . ? 1.3123 1.3636 1.1700 0.0601 -0.0260 0.0424 605 NAG C C8 11054 N N2 . NAG R . ? 1.2201 1.2636 1.0926 0.0596 -0.0284 0.0418 605 NAG C N2 11055 O O3 . NAG R . ? 1.1696 1.2283 1.0417 0.0467 -0.0337 0.0269 605 NAG C O3 11056 O O4 . NAG R . ? 1.5496 1.6082 1.4399 0.0527 -0.0370 0.0324 605 NAG C O4 11057 O O5 . NAG R . ? 1.3528 1.3703 1.2452 0.0568 -0.0285 0.0393 605 NAG C O5 11058 O O6 . NAG R . ? 0.9792 0.9881 0.8778 0.0479 -0.0301 0.0294 605 NAG C O6 11059 O O7 . NAG R . ? 1.0242 1.0492 0.8896 0.0543 -0.0225 0.0364 605 NAG C O7 11060 C C1 . BMA S . ? 1.6655 1.7319 1.5527 0.0447 -0.0386 0.0240 606 BMA C C1 11061 C C2 . BMA S . ? 1.6209 1.6954 1.5150 0.0452 -0.0410 0.0239 606 BMA C C2 11062 C C3 . BMA S . ? 1.7449 1.8275 1.6362 0.0361 -0.0423 0.0150 606 BMA C C3 11063 C C4 . BMA S . ? 1.7052 1.8026 1.5880 0.0320 -0.0436 0.0114 606 BMA C C4 11064 C C5 . BMA S . ? 1.6870 1.7740 1.5628 0.0327 -0.0408 0.0123 606 BMA C C5 11065 C C6 . BMA S . ? 1.5105 1.6128 1.3769 0.0288 -0.0421 0.0088 606 BMA C C6 11066 O O2 . BMA S . ? 1.4946 1.5849 1.3910 0.0524 -0.0433 0.0303 606 BMA C O2 11067 O O3 . BMA S . ? 1.9079 2.0012 1.8058 0.0373 -0.0447 0.0156 606 BMA C O3 11068 O O4 . BMA S . ? 1.6340 1.7344 1.5132 0.0219 -0.0437 0.0021 606 BMA C O4 11069 O O5 . BMA S . ? 1.7907 1.8725 1.6704 0.0420 -0.0401 0.0213 606 BMA C O5 11070 O O6 . BMA S . ? 1.4230 1.5228 1.2848 0.0338 -0.0407 0.0137 606 BMA C O6 11071 C C1 . MAN T . ? 2.0221 2.1009 1.9245 0.0343 -0.0431 0.0127 607 MAN C C1 11072 C C2 . MAN T . ? 2.0271 2.1191 1.9328 0.0302 -0.0452 0.0086 607 MAN C C2 11073 C C3 . MAN T . ? 1.9982 2.1064 1.9100 0.0384 -0.0476 0.0153 607 MAN C C3 11074 C C4 . MAN T . ? 2.0662 2.1600 1.9834 0.0469 -0.0458 0.0225 607 MAN C C4 11075 C C5 . MAN T . ? 2.1315 2.2105 2.0448 0.0491 -0.0436 0.0255 607 MAN C C5 11076 C C6 . MAN T . ? 2.1157 2.1797 2.0341 0.0559 -0.0415 0.0319 607 MAN C C6 11077 O O2 . MAN T . ? 2.0035 2.0813 1.9124 0.0268 -0.0434 0.0054 607 MAN C O2 11078 O O3 . MAN T . ? 1.8973 2.0190 1.8131 0.0351 -0.0493 0.0118 607 MAN C O3 11079 O O4 . MAN T . ? 1.9918 2.0987 1.9134 0.0556 -0.0471 0.0294 607 MAN C O4 11080 O O5 . MAN T . ? 2.0974 2.1646 2.0059 0.0413 -0.0420 0.0190 607 MAN C O5 11081 O O6 . MAN T . ? 2.0760 2.1328 1.9913 0.0596 -0.0399 0.0365 607 MAN C O6 11082 CA CA . CA U . ? 0.9579 0.8776 0.9384 0.0322 0.0823 0.1571 608 CA C CA 11083 C C1 . NAG V . ? 1.2671 1.3347 1.0981 -0.2223 -0.1090 -0.0809 601 NAG D C1 11084 C C2 . NAG V . ? 1.2901 1.3854 1.1152 -0.2265 -0.1175 -0.0804 601 NAG D C2 11085 C C3 . NAG V . ? 1.3692 1.4977 1.2078 -0.2214 -0.1252 -0.0701 601 NAG D C3 11086 C C4 . NAG V . ? 1.4451 1.5690 1.2949 -0.2029 -0.1237 -0.0588 601 NAG D C4 11087 C C5 . NAG V . ? 1.4313 1.5244 1.2846 -0.1994 -0.1150 -0.0608 601 NAG D C5 11088 C C6 . NAG V . ? 1.3427 1.4284 1.2037 -0.1810 -0.1133 -0.0509 601 NAG D C6 11089 C C7 . NAG V . ? 1.4409 1.5456 1.2421 -0.2513 -0.1211 -0.0967 601 NAG D C7 11090 C C8 . NAG V . ? 1.3463 1.4789 1.1448 -0.2679 -0.1276 -0.1020 601 NAG D C8 11091 N N2 . NAG V . ? 1.3211 1.4193 1.1361 -0.2454 -0.1179 -0.0917 601 NAG D N2 11092 O O3 . NAG V . ? 1.3637 1.5175 1.1961 -0.2231 -0.1328 -0.0685 601 NAG D O3 11093 O O4 . NAG V . ? 1.5342 1.6863 1.3977 -0.1992 -0.1293 -0.0501 601 NAG D O4 11094 O O5 . NAG V . ? 1.3924 1.4581 1.2327 -0.2049 -0.1088 -0.0704 601 NAG D O5 11095 O O6 . NAG V . ? 1.2537 1.3293 1.1053 -0.1729 -0.1127 -0.0500 601 NAG D O6 11096 O O7 . NAG V . ? 1.4683 1.5583 1.2594 -0.2442 -0.1189 -0.0973 601 NAG D O7 11097 C C1 . NAG W . ? 1.6823 1.8526 1.5452 -0.1878 -0.1350 -0.0412 602 NAG D C1 11098 C C2 . NAG W . ? 1.7512 1.9323 1.6290 -0.1738 -0.1360 -0.0292 602 NAG D C2 11099 C C3 . NAG W . ? 1.9700 2.1678 1.8471 -0.1606 -0.1409 -0.0191 602 NAG D C3 11100 C C4 . NAG W . ? 2.0413 2.2674 1.9120 -0.1686 -0.1485 -0.0202 602 NAG D C4 11101 C C5 . NAG W . ? 1.8856 2.0997 1.7419 -0.1841 -0.1473 -0.0332 602 NAG D C5 11102 C C6 . NAG W . ? 1.6814 1.9258 1.5316 -0.1944 -0.1552 -0.0353 602 NAG D C6 11103 C C7 . NAG W . ? 1.7382 1.8944 1.6332 -0.1636 -0.1271 -0.0246 602 NAG D C7 11104 C C8 . NAG W . ? 1.6025 1.7380 1.5029 -0.1499 -0.1215 -0.0193 602 NAG D C8 11105 N N2 . NAG W . ? 1.7420 1.8954 1.6240 -0.1656 -0.1287 -0.0283 602 NAG D N2 11106 O O3 . NAG W . ? 2.1316 2.3422 2.0228 -0.1494 -0.1418 -0.0086 602 NAG D O3 11107 O O4 . NAG W . ? 2.1592 2.3963 2.0264 -0.1560 -0.1520 -0.0112 602 NAG D O4 11108 O O5 . NAG W . ? 1.8457 2.0455 1.7049 -0.1958 -0.1426 -0.0418 602 NAG D O5 11109 O O6 . NAG W . ? 1.5230 1.7797 1.3777 -0.2106 -0.1567 -0.0422 602 NAG D O6 11110 O O7 . NAG W . ? 1.7940 1.9697 1.6961 -0.1730 -0.1300 -0.0255 602 NAG D O7 11111 C C1 . BMA X . ? 2.1649 2.4342 2.0434 -0.1495 -0.1578 -0.0007 603 BMA D C1 11112 C C2 . BMA X . ? 2.0933 2.3738 1.9660 -0.1367 -0.1612 0.0086 603 BMA D C2 11113 C C3 . BMA X . ? 2.1117 2.4271 1.9956 -0.1293 -0.1672 0.0201 603 BMA D C3 11114 C C4 . BMA X . ? 2.0596 2.3738 1.9597 -0.1228 -0.1640 0.0255 603 BMA D C4 11115 C C5 . BMA X . ? 2.0265 2.3274 1.9309 -0.1366 -0.1605 0.0151 603 BMA D C5 11116 C C6 . BMA X . ? 1.7952 2.0928 1.7147 -0.1292 -0.1567 0.0207 603 BMA D C6 11117 O O2 . BMA X . ? 1.9545 2.2082 1.8245 -0.1233 -0.1553 0.0125 603 BMA D O2 11118 O O3 . BMA X . ? 2.1073 2.4287 1.9861 -0.1152 -0.1688 0.0298 603 BMA D O3 11119 O O4 . BMA X . ? 1.9907 2.3395 1.9016 -0.1182 -0.1694 0.0348 603 BMA D O4 11120 O O5 . BMA X . ? 2.1697 2.4375 2.0628 -0.1412 -0.1550 0.0058 603 BMA D O5 11121 O O6 . BMA X . ? 1.6450 1.9343 1.5692 -0.1421 -0.1539 0.0122 603 BMA D O6 11122 CA CA . CA Y . ? 1.7565 1.0271 1.4000 -0.4042 0.2295 -0.2078 604 CA D CA 11123 O O . HOH Z . ? 0.7200 0.3719 0.4450 -0.0401 0.1045 -0.0704 701 HOH A O 11124 O O . HOH Z . ? 0.6089 0.5555 0.5140 -0.0177 -0.0201 -0.0279 702 HOH A O 11125 O O . HOH Z . ? 0.7110 0.4346 0.5132 -0.0131 0.0440 0.0068 703 HOH A O 11126 O O . HOH Z . ? 0.8198 0.4660 0.5674 0.0087 0.1051 -0.0347 704 HOH A O 11127 O O . HOH Z . ? 0.8169 0.5295 0.6084 0.0017 0.0455 0.0226 705 HOH A O 11128 O O . HOH Z . ? 0.6136 0.5852 0.6055 0.0481 -0.0282 0.0719 706 HOH A O 11129 O O . HOH Z . ? 0.7075 0.6140 0.6468 0.0800 -0.0084 0.0756 707 HOH A O 11130 O O . HOH Z . ? 0.6971 0.5064 0.5664 0.0142 0.0077 0.0058 708 HOH A O 11131 O O . HOH Z . ? 0.8092 0.5481 0.6309 -0.0080 0.0407 -0.0079 709 HOH A O 11132 O O . HOH Z . ? 0.6814 0.5267 0.5727 0.0104 -0.0095 0.0038 710 HOH A O 11133 O O . HOH Z . ? 0.6447 0.4619 0.5164 0.0322 0.0165 0.0106 711 HOH A O 11134 O O . HOH Z . ? 0.7472 0.5425 0.5830 -0.0289 0.0278 -0.0341 712 HOH A O 11135 O O . HOH Z . ? 0.5770 0.4393 0.4854 0.0386 -0.0190 0.0379 713 HOH A O 11136 O O . HOH Z . ? 0.8617 0.6085 0.6640 0.0436 0.0737 -0.0081 714 HOH A O 11137 O O . HOH Z . ? 0.9594 0.5589 0.7213 0.1483 0.1297 0.1001 715 HOH A O 11138 O O . HOH Z . ? 0.7216 0.5589 0.5805 -0.0446 0.0173 -0.0278 716 HOH A O 11139 O O . HOH Z . ? 0.7087 0.5749 0.6077 -0.0023 -0.0274 -0.0076 717 HOH A O 11140 O O . HOH Z . ? 0.7159 0.5087 0.5568 0.0096 0.0302 -0.0132 718 HOH A O 11141 O O . HOH Z . ? 0.7327 0.5988 0.6059 -0.0481 0.0152 -0.0343 719 HOH A O 11142 O O . HOH Z . ? 0.7203 0.5826 0.6196 0.0034 -0.0271 0.0030 720 HOH A O 11143 O O . HOH Z . ? 0.7363 0.5884 0.6352 0.0461 -0.0132 0.0447 721 HOH A O 11144 O O . HOH Z . ? 0.7787 0.6138 0.6336 -0.0506 0.0180 -0.0427 722 HOH A O 11145 O O . HOH Z . ? 0.6223 0.5632 0.5290 -0.0019 -0.0231 -0.0161 723 HOH A O 11146 O O . HOH Z . ? 0.9674 0.7398 0.7618 -0.0824 0.0531 -0.0743 724 HOH A O 11147 O O . HOH Z . ? 0.6554 0.5870 0.6202 0.0315 -0.0376 0.0500 725 HOH A O 11148 O O . HOH Z . ? 0.8728 0.7680 0.7908 0.0741 -0.0167 0.0758 726 HOH A O 11149 O O . HOH Z . ? 0.8954 0.7154 0.6692 -0.1837 0.0711 -0.1339 727 HOH A O 11150 O O . HOH Z . ? 1.1173 0.6318 0.8076 -0.0006 0.1556 -0.0343 728 HOH A O 11151 O O . HOH Z . ? 0.9215 0.5467 0.6389 -0.0134 0.1188 -0.0582 729 HOH A O 11152 O O . HOH Z . ? 1.0982 0.7245 0.8295 -0.1412 0.1276 -0.0726 730 HOH A O 11153 O O . HOH Z . ? 1.1548 0.7364 0.8605 -0.0019 0.1361 -0.0499 731 HOH A O 11154 O O . HOH Z . ? 0.8711 0.6792 0.6308 -0.2158 0.0861 -0.1503 732 HOH A O 11155 O O . HOH Z . ? 0.7475 0.6120 0.5424 -0.0082 0.0306 -0.0429 733 HOH A O 11156 O O . HOH Z . ? 0.9858 0.8683 0.8657 0.0031 -0.0052 -0.0136 734 HOH A O 11157 O O . HOH Z . ? 0.9591 0.8129 0.8910 0.0157 -0.0233 0.0027 735 HOH A O 11158 O O . HOH Z . ? 0.6760 0.6462 0.6195 0.0040 -0.0203 -0.0192 736 HOH A O 11159 O O . HOH Z . ? 0.6967 0.6745 0.6140 -0.0161 -0.0249 -0.0276 737 HOH A O 11160 O O . HOH Z . ? 0.9532 0.6607 0.7348 0.0249 0.0451 0.0449 738 HOH A O 11161 O O . HOH Z . ? 0.9979 0.5952 0.7235 0.0290 0.1321 -0.0280 739 HOH A O 11162 O O . HOH Z . ? 1.0203 0.9134 0.9053 -0.0575 0.0164 -0.0427 740 HOH A O 11163 O O . HOH Z . ? 1.0677 0.8997 0.8110 -0.1763 0.0641 -0.1472 741 HOH A O 11164 O O . HOH Z . ? 0.7258 0.5974 0.6068 -0.0360 0.0059 -0.0296 742 HOH A O 11165 O O . HOH Z . ? 0.6370 0.5201 0.5107 -0.0460 0.0033 -0.0439 743 HOH A O 11166 O O . HOH Z . ? 1.0593 0.6163 0.7934 0.0666 0.1285 0.0412 744 HOH A O 11167 O O . HOH Z . ? 0.7667 0.5441 0.5979 0.0118 0.0120 0.0241 745 HOH A O 11168 O O . HOH Z . ? 0.9342 0.6087 0.7178 0.0252 0.0633 0.0319 746 HOH A O 11169 O O . HOH Z . ? 0.8185 0.6980 0.6797 0.0100 0.0049 -0.0136 747 HOH A O 11170 O O . HOH Z . ? 0.7118 0.6014 0.5782 -0.0318 -0.0002 -0.0399 748 HOH A O 11171 O O . HOH Z . ? 0.7855 0.6165 0.6235 0.0802 -0.0024 0.0911 749 HOH A O 11172 O O . HOH Z . ? 0.7836 0.6913 0.7358 0.0375 -0.0250 0.0413 750 HOH A O 11173 O O . HOH Z . ? 0.9679 0.6319 0.7065 -0.0855 0.0962 -0.0813 751 HOH A O 11174 O O . HOH Z . ? 1.1237 0.7215 0.8811 0.0839 0.1125 0.0553 752 HOH A O 11175 O O . HOH Z . ? 0.7509 0.6100 0.6075 -0.0624 0.0163 -0.0533 753 HOH A O 11176 O O . HOH Z . ? 0.7931 0.6567 0.7223 0.0138 -0.0263 -0.0009 754 HOH A O 11177 O O . HOH Z . ? 0.9400 0.8118 0.8430 0.1257 0.0162 0.1095 755 HOH A O 11178 O O . HOH Z . ? 0.9343 0.8065 0.7451 -0.0343 0.0199 -0.0557 756 HOH A O 11179 O O . HOH Z . ? 0.8677 0.7236 0.6859 0.0329 0.0390 -0.0091 757 HOH A O 11180 O O . HOH AA . ? 0.7671 0.6017 0.5831 -0.0273 -0.0110 -0.0351 701 HOH B O 11181 O O . HOH AA . ? 0.7915 0.5920 0.5939 -0.0535 -0.0154 -0.0633 702 HOH B O 11182 O O . HOH AA . ? 0.8113 0.5108 0.5411 -0.0526 0.0478 -0.1112 703 HOH B O 11183 O O . HOH AA . ? 0.7290 0.5553 0.5306 -0.0285 0.0065 -0.0468 704 HOH B O 11184 O O . HOH AA . ? 0.8915 0.6455 0.6253 -0.0280 0.0625 -0.0977 705 HOH B O 11185 O O . HOH AA . ? 0.8757 0.6880 0.6562 -0.0571 -0.0185 -0.0634 706 HOH B O 11186 O O . HOH AA . ? 0.9874 0.7592 0.6884 -0.0407 0.0604 -0.0946 707 HOH B O 11187 O O . HOH AA . ? 1.0229 0.8511 0.8087 -0.0376 0.0293 -0.0307 708 HOH B O 11188 O O . HOH AA . ? 0.7178 0.5431 0.5728 -0.1123 -0.0356 -0.0598 709 HOH B O 11189 O O . HOH AA . ? 0.6453 0.5121 0.5466 -0.0007 -0.0333 -0.0019 710 HOH B O 11190 O O . HOH AA . ? 0.8035 0.6333 0.6547 -0.0952 -0.0382 -0.0553 711 HOH B O 11191 O O . HOH AA . ? 0.9214 0.7793 0.8558 0.0268 -0.0179 0.0040 712 HOH B O 11192 O O . HOH AA . ? 0.9350 0.7422 0.7230 0.0002 -0.0031 0.0279 713 HOH B O 11193 O O . HOH AA . ? 0.6310 0.4574 0.3874 -0.0360 0.0563 -0.0593 714 HOH B O 11194 O O . HOH AA . ? 1.0317 0.7140 0.7218 0.0029 0.1389 -0.1301 715 HOH B O 11195 O O . HOH AA . ? 0.9274 0.7608 0.7847 -0.0066 0.0080 -0.0448 716 HOH B O 11196 O O . HOH AA . ? 0.7645 0.5862 0.5463 -0.0325 0.0129 -0.0504 717 HOH B O 11197 O O . HOH AA . ? 0.9281 0.6313 0.5935 -0.0609 0.0653 -0.1291 718 HOH B O 11198 O O . HOH AA . ? 1.1308 0.6664 0.7438 -0.0141 0.1783 -0.1729 719 HOH B O 11199 O O . HOH AA . ? 1.1055 0.6462 0.7583 -0.0271 0.1456 -0.1565 720 HOH B O 11200 O O . HOH AA . ? 1.0054 0.6905 0.7618 0.0456 0.1430 -0.1051 721 HOH B O 11201 O O . HOH AA . ? 0.8587 0.7652 0.7851 0.0102 -0.0148 -0.0179 722 HOH B O 11202 O O . HOH AA . ? 0.8188 0.6142 0.6830 0.0172 0.0305 -0.0484 723 HOH B O 11203 O O . HOH AA . ? 1.0503 0.8500 0.7403 -0.0367 0.0979 -0.0873 724 HOH B O 11204 O O . HOH AA . ? 1.5181 0.7130 1.1801 -0.0149 0.2576 -0.0930 725 HOH B O 11205 O O . HOH AA . ? 1.2484 0.6113 0.9764 0.0665 0.2127 -0.0664 726 HOH B O 11206 O O . HOH AA . ? 0.8252 0.5982 0.6635 -0.1170 -0.0161 -0.0724 727 HOH B O 11207 O O . HOH BA . ? 0.5985 0.5826 0.6783 -0.0881 0.1061 0.1452 701 HOH C O 11208 O O . HOH BA . ? 0.6427 0.6094 0.6708 -0.0021 -0.0010 0.0837 702 HOH C O 11209 O O . HOH BA . ? 0.6247 0.6687 0.6817 -0.0273 -0.0278 0.0746 703 HOH C O 11210 O O . HOH BA . ? 0.6264 0.5526 0.6058 0.0427 0.0281 0.1105 704 HOH C O 11211 O O . HOH BA . ? 0.7755 0.6498 0.7432 0.0374 0.0283 0.1073 705 HOH C O 11212 O O . HOH BA . ? 0.6000 0.6839 0.6762 -0.0206 -0.0258 0.0858 706 HOH C O 11213 O O . HOH BA . ? 0.7029 0.6222 0.6335 0.0820 0.0040 0.1003 707 HOH C O 11214 O O . HOH BA . ? 0.7419 0.6805 0.7044 0.0587 0.0425 0.1246 708 HOH C O 11215 O O . HOH BA . ? 0.7988 0.7693 0.7927 0.0505 0.0426 0.1200 709 HOH C O 11216 O O . HOH BA . ? 0.7386 0.7029 0.6716 0.0650 -0.0265 0.0514 710 HOH C O 11217 O O . HOH BA . ? 0.9214 0.8518 0.8012 0.0786 0.0403 0.0599 711 HOH C O 11218 O O . HOH BA . ? 0.6816 0.6066 0.6254 0.0528 -0.0202 0.0531 712 HOH C O 11219 O O . HOH BA . ? 0.6232 0.5597 0.5128 0.0710 0.0236 0.0586 713 HOH C O 11220 O O . HOH BA . ? 1.7145 1.7538 1.6024 -0.0216 -0.0959 0.0416 714 HOH C O 11221 O O . HOH BA . ? 0.7381 0.5774 0.7075 0.0189 0.0348 0.1010 715 HOH C O 11222 O O . HOH BA . ? 0.6907 0.6314 0.6680 0.0495 0.0351 0.1165 716 HOH C O 11223 O O . HOH BA . ? 0.8534 0.7270 0.8088 0.0523 0.0242 0.1079 717 HOH C O 11224 O O . HOH BA . ? 0.9689 0.8491 0.9377 -0.0337 -0.0290 0.0239 718 HOH C O 11225 O O . HOH BA . ? 0.7546 0.8174 0.8379 -0.0060 0.0899 0.1571 719 HOH C O 11226 O O . HOH BA . ? 0.8180 0.7780 0.7344 0.0850 0.0653 0.1399 720 HOH C O 11227 O O . HOH BA . ? 0.8007 0.9077 0.9110 -0.0122 0.0927 0.1607 721 HOH C O 11228 O O . HOH BA . ? 0.8955 0.9054 0.9464 0.0007 0.0870 0.1541 722 HOH C O 11229 O O . HOH BA . ? 0.9377 0.9396 0.9341 0.0640 0.0701 0.1371 723 HOH C O 11230 O O . HOH BA . ? 0.6079 0.6019 0.6046 0.0168 -0.0492 0.0618 724 HOH C O 11231 O O . HOH BA . ? 0.7077 0.6090 0.6824 -0.0257 -0.0352 0.0288 725 HOH C O 11232 O O . HOH CA . ? 1.3614 0.7754 0.9427 -0.4838 0.1668 -0.2889 701 HOH D O 11233 O O . HOH CA . ? 1.0229 0.8121 0.8889 -0.1438 -0.0163 -0.0656 702 HOH D O 11234 O O . HOH CA . ? 0.8451 0.5348 0.7430 -0.1025 0.0379 -0.0199 703 HOH D O 11235 O O . HOH CA . ? 1.3830 0.5822 1.0303 -0.2894 0.2460 -0.1623 704 HOH D O 11236 O O . HOH CA . ? 1.2096 0.7510 0.8075 -0.4196 0.0909 -0.2732 705 HOH D O 11237 O O . HOH CA . ? 0.8809 0.7537 0.7448 -0.1500 -0.0489 -0.0644 706 HOH D O 11238 O O . HOH CA . ? 0.9932 0.8684 0.8728 -0.2535 -0.0287 -0.0919 707 HOH D O 11239 O O . HOH CA . ? 0.8954 0.7931 0.7112 -0.1596 -0.0636 -0.0802 708 HOH D O # 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 GLY 1 77 ? ? ? A . n A 1 2 SER 2 78 ? ? ? A . n A 1 3 PRO 3 79 ? ? ? A . n A 1 4 SER 4 80 ? ? ? A . n A 1 5 ARG 5 81 ? ? ? A . n A 1 6 ALA 6 82 82 ALA ALA A . n A 1 7 THR 7 83 83 THR THR A . n A 1 8 PRO 8 84 84 PRO PRO A . n A 1 9 LEU 9 85 85 LEU LEU A . n A 1 10 VAL 10 86 86 VAL VAL A . n A 1 11 LEU 11 87 87 LEU LEU A . n A 1 12 GLY 12 88 88 GLY GLY A . n A 1 13 GLU 13 89 89 GLU GLU A . n A 1 14 ASN 14 90 90 ASN ASN A . n A 1 15 LEU 15 91 91 LEU LEU A . n A 1 16 CYS 16 92 92 CYS CYS A . n A 1 17 SER 17 93 93 SER SER A . n A 1 18 ILE 18 94 94 ILE ILE A . n A 1 19 ASN 19 95 95 ASN ASN A . n A 1 20 GLY 20 96 96 GLY GLY A . n A 1 21 TRP 21 97 97 TRP TRP A . n A 1 22 VAL 22 98 98 VAL VAL A . n A 1 23 PRO 23 99 99 PRO PRO A . n A 1 24 THR 24 100 100 THR THR A . n A 1 25 TYR 25 101 101 TYR TYR A . n A 1 26 ARG 26 102 102 ARG ARG A . n A 1 27 GLY 27 103 103 GLY GLY A . n A 1 28 GLU 28 104 104 GLU GLU A . n A 1 29 GLY 29 105 105 GLY GLY A . n A 1 30 THR 30 106 106 THR THR A . n A 1 31 THR 31 107 107 THR THR A . n A 1 32 GLY 32 108 108 GLY GLY A . n A 1 33 LYS 33 109 109 LYS LYS A . n A 1 34 ILE 34 110 110 ILE ILE A . n A 1 35 PRO 35 111 111 PRO PRO A . n A 1 36 ASP 36 112 112 ASP ASP A . n A 1 37 GLU 37 113 113 GLU GLU A . n A 1 38 GLN 38 114 114 GLN GLN A . n A 1 39 MET 39 115 115 MET MET A . n A 1 40 LEU 40 116 116 LEU LEU A . n A 1 41 THR 41 117 117 THR THR A . n A 1 42 ARG 42 118 118 ARG ARG A . n A 1 43 GLN 43 119 119 GLN GLN A . n A 1 44 ASN 44 120 120 ASN ASN A . n A 1 45 PHE 45 121 121 PHE PHE A . n A 1 46 VAL 46 122 122 VAL VAL A . n A 1 47 SER 47 123 123 SER SER A . n A 1 48 CYS 48 124 124 CYS CYS A . n A 1 49 SER 49 125 125 SER SER A . n A 1 50 ASP 50 126 126 ASP ASP A . n A 1 51 LYS 51 127 127 LYS LYS A . n A 1 52 GLU 52 128 128 GLU GLU A . n A 1 53 CYS 53 129 129 CYS CYS A . n A 1 54 ARG 54 130 130 ARG ARG A . n A 1 55 ARG 55 131 131 ARG ARG A . n A 1 56 PHE 56 132 132 PHE PHE A . n A 1 57 PHE 57 133 133 PHE PHE A . n A 1 58 VAL 58 134 134 VAL VAL A . n A 1 59 SER 59 135 135 SER SER A . n A 1 60 MET 60 136 136 MET MET A . n A 1 61 GLY 61 137 137 GLY GLY A . n A 1 62 TYR 62 138 138 TYR TYR A . n A 1 63 GLY 63 139 ? ? ? A . n A 1 64 THR 64 140 ? ? ? A . n A 1 65 THR 65 141 ? ? ? A . n A 1 66 THR 66 142 ? ? ? A . n A 1 67 ASN 67 143 ? ? ? A . n A 1 68 PHE 68 144 ? ? ? A . n A 1 69 ALA 69 145 ? ? ? A . n A 1 70 ASP 70 146 ? ? ? A . n A 1 71 LEU 71 147 ? ? ? A . n A 1 72 ILE 72 148 ? ? ? A . n A 1 73 VAL 73 149 149 VAL VAL A . n A 1 74 SER 74 150 150 SER SER A . n A 1 75 GLU 75 151 151 GLU GLU A . n A 1 76 GLN 76 152 152 GLN GLN A . n A 1 77 MET 77 156 156 MET MET A . n A 1 78 ASN 78 157 157 ASN ASN A . n A 1 79 VAL 79 158 158 VAL VAL A . n A 1 80 TYR 80 159 159 TYR TYR A . n A 1 81 SER 81 160 160 SER SER A . n A 1 82 VAL 82 161 161 VAL VAL A . n A 1 83 LYS 83 162 162 LYS LYS A . n A 1 84 LEU 84 163 163 LEU LEU A . n A 1 85 GLY 85 164 164 GLY GLY A . n A 1 86 ASP 86 165 165 ASP ASP A . n A 1 87 PRO 87 166 166 PRO PRO A . n A 1 88 PRO 88 167 167 PRO PRO A . n A 1 89 THR 89 168 168 THR THR A . n A 1 90 PRO 90 169 169 PRO PRO A . n A 1 91 ASP 91 170 170 ASP ASP A . n A 1 92 LYS 92 170 170 LYS LYS A A n A 1 93 LEU 93 171 171 LEU LEU A . n A 1 94 LYS 94 172 172 LYS LYS A . n A 1 95 PHE 95 173 173 PHE PHE A . n A 1 96 GLU 96 174 174 GLU GLU A . n A 1 97 ALA 97 175 175 ALA ALA A . n A 1 98 VAL 98 176 176 VAL VAL A . n A 1 99 GLY 99 177 177 GLY GLY A . n A 1 100 TRP 100 178 178 TRP TRP A . n A 1 101 SER 101 179 179 SER SER A . n A 1 102 ALA 102 180 180 ALA ALA A . n A 1 103 SER 103 181 181 SER SER A . n A 1 104 SER 104 182 182 SER SER A . n A 1 105 CYS 105 183 183 CYS CYS A . n A 1 106 HIS 106 184 184 HIS HIS A . n A 1 107 ASP 107 185 185 ASP ASP A . n A 1 108 GLY 108 186 186 GLY GLY A . n A 1 109 PHE 109 187 187 PHE PHE A . n A 1 110 GLN 110 188 188 GLN GLN A . n A 1 111 TRP 111 189 189 TRP TRP A . n A 1 112 THR 112 190 190 THR THR A . n A 1 113 VAL 113 191 191 VAL VAL A . n A 1 114 LEU 114 192 192 LEU LEU A . n A 1 115 SER 115 193 193 SER SER A . n A 1 116 VAL 116 194 194 VAL VAL A . n A 1 117 ALA 117 195 195 ALA ALA A . n A 1 118 GLY 118 196 196 GLY GLY A . n A 1 119 ASP 119 200 200 ASP ASP A . n A 1 120 GLY 120 201 201 GLY GLY A . n A 1 121 PHE 121 202 202 PHE PHE A . n A 1 122 VAL 122 203 203 VAL VAL A . n A 1 123 SER 123 204 204 SER SER A . n A 1 124 ILE 124 205 205 ILE ILE A . n A 1 125 LEU 125 206 206 LEU LEU A . n A 1 126 TYR 126 207 207 TYR TYR A . n A 1 127 GLY 127 208 208 GLY GLY A . n A 1 128 GLY 128 209 209 GLY GLY A . n A 1 129 ILE 129 210 210 ILE ILE A . n A 1 130 ILE 130 211 211 ILE ILE A . n A 1 131 THR 131 212 212 THR THR A . n A 1 132 ASP 132 213 213 ASP ASP A . n A 1 133 THR 133 214 214 THR THR A . n A 1 134 ILE 134 215 215 ILE ILE A . n A 1 135 HIS 135 216 216 HIS HIS A . n A 1 136 PRO 136 217 217 PRO PRO A . n A 1 137 THR 137 218 218 THR THR A . n A 1 138 ASN 138 219 219 ASN ASN A . n A 1 139 GLY 139 220 220 GLY GLY A . n A 1 140 GLY 140 221 221 GLY GLY A . n A 1 141 PRO 141 222 222 PRO PRO A . n A 1 142 LEU 142 223 223 LEU LEU A . n A 1 143 ARG 143 224 224 ARG ARG A . n A 1 144 THR 144 225 225 THR THR A . n A 1 145 GLN 145 226 226 GLN GLN A . n A 1 146 ALA 146 227 227 ALA ALA A . n A 1 147 SER 147 228 228 SER SER A . n A 1 148 SER 148 229 229 SER SER A . n A 1 149 CYS 149 230 230 CYS CYS A . n A 1 150 ILE 150 231 231 ILE ILE A . n A 1 151 CYS 151 232 232 CYS CYS A . n A 1 152 ASN 152 233 233 ASN ASN A . n A 1 153 ASP 153 234 234 ASP ASP A . n A 1 154 GLY 154 235 235 GLY GLY A . n A 1 155 THR 155 236 236 THR THR A . n A 1 156 CYS 156 237 237 CYS CYS A . n A 1 157 TYR 157 238 238 TYR TYR A . n A 1 158 THR 158 239 239 THR THR A . n A 1 159 ILE 159 240 240 ILE ILE A . n A 1 160 ILE 160 241 241 ILE ILE A . n A 1 161 ALA 161 242 242 ALA ALA A . n A 1 162 ASP 162 243 243 ASP ASP A . n A 1 163 GLY 163 244 244 GLY GLY A . n A 1 164 THR 164 245 245 THR THR A . n A 1 165 THR 165 246 246 THR THR A . n A 1 166 TYR 166 247 247 TYR TYR A . n A 1 167 THR 167 248 248 THR THR A . n A 1 168 ALA 168 249 249 ALA ALA A . n A 1 169 SER 169 250 250 SER SER A . n A 1 170 SER 170 251 251 SER SER A . n A 1 171 HIS 171 252 252 HIS HIS A . n A 1 172 ARG 172 253 253 ARG ARG A . n A 1 173 LEU 173 254 254 LEU LEU A . n A 1 174 TYR 174 255 255 TYR TYR A . n A 1 175 ARG 175 256 256 ARG ARG A . n A 1 176 LEU 176 257 257 LEU LEU A . n A 1 177 VAL 177 258 258 VAL VAL A . n A 1 178 ASN 178 259 259 ASN ASN A . n A 1 179 GLY 179 260 260 GLY GLY A . n A 1 180 THR 180 261 261 THR THR A . n A 1 181 SER 181 262 262 SER SER A . n A 1 182 ALA 182 263 263 ALA ALA A . n A 1 183 GLY 183 264 264 GLY GLY A . n A 1 184 TRP 184 265 265 TRP TRP A . n A 1 185 LYS 185 266 266 LYS LYS A . n A 1 186 ALA 186 267 267 ALA ALA A . n A 1 187 LEU 187 268 268 LEU LEU A . n A 1 188 ASP 188 269 269 ASP ASP A . n A 1 189 THR 189 270 270 THR THR A . n A 1 190 THR 190 271 271 THR THR A . n A 1 191 GLY 191 272 272 GLY GLY A . n A 1 192 PHE 192 273 273 PHE PHE A . n A 1 193 ASN 193 274 274 ASN ASN A . n A 1 194 PHE 194 275 275 PHE PHE A . n A 1 195 GLU 195 276 276 GLU GLU A . n A 1 196 PHE 196 277 277 PHE PHE A . n A 1 197 PRO 197 278 278 PRO PRO A . n A 1 198 THR 198 279 279 THR THR A . n A 1 199 CYS 199 280 280 CYS CYS A . n A 1 200 TYR 200 281 281 TYR TYR A . n A 1 201 TYR 201 282 282 TYR TYR A . n A 1 202 THR 202 283 283 THR THR A . n A 1 203 SER 203 284 284 SER SER A . n A 1 204 GLY 204 285 285 GLY GLY A . n A 1 205 LYS 205 286 286 LYS LYS A . n A 1 206 VAL 206 287 287 VAL VAL A . n A 1 207 LYS 207 288 288 LYS LYS A . n A 1 208 CYS 208 289 289 CYS CYS A . n A 1 209 THR 209 290 290 THR THR A . n A 1 210 GLY 210 291 291 GLY GLY A . n A 1 211 THR 211 292 292 THR THR A . n A 1 212 ASN 212 293 293 ASN ASN A . n A 1 213 LEU 213 294 294 LEU LEU A . n A 1 214 TRP 214 295 295 TRP TRP A . n A 1 215 ASN 215 296 296 ASN ASN A . n A 1 216 ASP 216 297 297 ASP ASP A . n A 1 217 ALA 217 298 298 ALA ALA A . n A 1 218 LYS 218 299 299 LYS LYS A . n A 1 219 ARG 219 300 300 ARG ARG A . n A 1 220 PRO 220 301 301 PRO PRO A . n A 1 221 PHE 221 302 302 PHE PHE A . n A 1 222 LEU 222 303 303 LEU LEU A . n A 1 223 GLU 223 304 304 GLU GLU A . n A 1 224 PHE 224 305 305 PHE PHE A . n A 1 225 ASP 225 306 306 ASP ASP A . n A 1 226 GLN 226 307 307 GLN GLN A . n A 1 227 SER 227 309 309 SER SER A . n A 1 228 PHE 228 310 310 PHE PHE A . n A 1 229 THR 229 311 311 THR THR A . n A 1 230 TYR 230 312 312 TYR TYR A . n A 1 231 THR 231 313 313 THR THR A . n A 1 232 PHE 232 314 314 PHE PHE A . n A 1 233 LYS 233 315 315 LYS LYS A . n A 1 234 GLU 234 316 316 GLU GLU A . n A 1 235 PRO 235 317 317 PRO PRO A . n A 1 236 CYS 236 318 318 CYS CYS A . n A 1 237 LEU 237 319 319 LEU LEU A . n A 1 238 GLY 238 320 320 GLY GLY A . n A 1 239 PHE 239 321 321 PHE PHE A . n A 1 240 LEU 240 322 322 LEU LEU A . n A 1 241 GLY 241 323 323 GLY GLY A . n A 1 242 ASP 242 324 324 ASP ASP A . n A 1 243 THR 243 325 325 THR THR A . n A 1 244 PRO 244 326 326 PRO PRO A . n A 1 245 ARG 245 327 327 ARG ARG A . n A 1 246 GLY 246 328 328 GLY GLY A . n A 1 247 ILE 247 329 329 ILE ILE A . n A 1 248 ASP 248 330 330 ASP ASP A . n A 1 249 THR 249 333 333 THR THR A . n A 1 250 THR 250 334 334 THR THR A . n A 1 251 ASN 251 335 335 ASN ASN A . n A 1 252 TYR 252 336 336 TYR TYR A . n A 1 253 CYS 253 337 337 CYS CYS A . n A 1 254 ASP 254 339 339 ASP ASP A . n A 1 255 LYS 255 340 340 LYS LYS A . n A 1 256 THR 256 341 341 THR THR A . n A 1 257 THR 257 342 342 THR THR A . n A 1 258 THR 258 343 343 THR THR A . n A 1 259 GLU 259 344 344 GLU GLU A . n A 1 260 GLY 260 345 345 GLY GLY A . n A 1 261 GLU 261 346 346 GLU GLU A . n A 1 262 GLY 262 347 347 GLY GLY A . n A 1 263 GLY 263 348 348 GLY GLY A . n A 1 264 ILE 264 349 349 ILE ILE A . n A 1 265 GLN 265 350 350 GLN GLN A . n A 1 266 GLY 266 351 351 GLY GLY A . n A 1 267 PHE 267 352 352 PHE PHE A . n A 1 268 MET 268 353 353 MET MET A . n A 1 269 ILE 269 354 354 ILE ILE A . n A 1 270 GLU 270 355 355 GLU GLU A . n A 1 271 GLY 271 356 356 GLY GLY A . n A 1 272 SER 272 357 357 SER SER A . n A 1 273 ASN 273 359 359 ASN ASN A . n A 1 274 SER 274 360 360 SER SER A . n A 1 275 TRP 275 361 361 TRP TRP A . n A 1 276 ILE 276 362 362 ILE ILE A . n A 1 277 GLY 277 363 363 GLY GLY A . n A 1 278 ARG 278 364 364 ARG ARG A . n A 1 279 ILE 279 365 365 ILE ILE A . n A 1 280 ILE 280 366 366 ILE ILE A . n A 1 281 ASN 281 367 367 ASN ASN A . n A 1 282 PRO 282 368 368 PRO PRO A . n A 1 283 GLY 283 369 369 GLY GLY A . n A 1 284 SER 284 370 370 SER SER A . n A 1 285 LYS 285 371 371 LYS LYS A . n A 1 286 LYS 286 372 372 LYS LYS A . n A 1 287 GLY 287 373 373 GLY GLY A . n A 1 288 PHE 288 374 374 PHE PHE A . n A 1 289 GLU 289 375 375 GLU GLU A . n A 1 290 ILE 290 376 376 ILE ILE A . n A 1 291 TYR 291 377 377 TYR TYR A . n A 1 292 LYS 292 378 378 LYS LYS A . n A 1 293 PHE 293 379 379 PHE PHE A . n A 1 294 LEU 294 380 380 LEU LEU A . n A 1 295 GLY 295 381 381 GLY GLY A . n A 1 296 THR 296 382 382 THR THR A . n A 1 297 LEU 297 383 383 LEU LEU A . n A 1 298 PHE 298 384 384 PHE PHE A . n A 1 299 SER 299 385 385 SER SER A . n A 1 300 VAL 300 387 387 VAL VAL A . n A 1 301 GLN 301 388 388 GLN GLN A . n A 1 302 THR 302 390 390 THR THR A . n A 1 303 VAL 303 391 391 VAL VAL A . n A 1 304 GLY 304 392 392 GLY GLY A . n A 1 305 ASN 305 392 392 ASN ASN A A n A 1 306 ARG 306 393 393 ARG ARG A . n A 1 307 ASN 307 394 394 ASN ASN A . n A 1 308 TYR 308 395 395 TYR TYR A . n A 1 309 GLN 309 396 396 GLN GLN A . n A 1 310 LEU 310 397 397 LEU LEU A . n A 1 311 LEU 311 398 398 LEU LEU A . n A 1 312 SER 312 399 399 SER SER A . n A 1 313 ASN 313 401 401 ASN ASN A . n A 1 314 SER 314 402 402 SER SER A . n A 1 315 THR 315 403 403 THR THR A . n A 1 316 ILE 316 404 404 ILE ILE A . n A 1 317 GLY 317 405 405 GLY GLY A . n A 1 318 ARG 318 406 406 ARG ARG A . n A 1 319 SER 319 407 407 SER SER A . n A 1 320 GLY 320 408 408 GLY GLY A . n A 1 321 LEU 321 409 409 LEU LEU A . n A 1 322 TYR 322 410 410 TYR TYR A . n A 1 323 GLN 323 411 411 GLN GLN A . n A 1 324 PRO 324 412 412 PRO PRO A . n A 1 325 ALA 325 413 413 ALA ALA A . n A 1 326 TYR 326 413 413 TYR TYR A A n A 1 327 GLU 327 414 414 GLU GLU A . n A 1 328 SER 328 415 415 SER SER A . n A 1 329 ARG 329 415 415 ARG ARG A A n A 1 330 ASP 330 416 416 ASP ASP A . n A 1 331 CYS 331 417 417 CYS CYS A . n A 1 332 GLN 332 418 418 GLN GLN A . n A 1 333 GLU 333 419 419 GLU GLU A . n A 1 334 LEU 334 420 420 LEU LEU A . n A 1 335 CYS 335 421 421 CYS CYS A . n A 1 336 PHE 336 422 422 PHE PHE A . n A 1 337 TRP 337 423 423 TRP TRP A . n A 1 338 ILE 338 424 424 ILE ILE A . n A 1 339 GLU 339 425 425 GLU GLU A . n A 1 340 ILE 340 426 426 ILE ILE A . n A 1 341 ALA 341 427 427 ALA ALA A . n A 1 342 ALA 342 428 428 ALA ALA A . n A 1 343 THR 343 429 429 THR THR A . n A 1 344 THR 344 430 430 THR THR A . n A 1 345 LYS 345 431 431 LYS LYS A . n A 1 346 ALA 346 432 432 ALA ALA A . n A 1 347 GLY 347 433 433 GLY GLY A . n A 1 348 LEU 348 438 438 LEU LEU A . n A 1 349 SER 349 439 439 SER SER A . n A 1 350 SER 350 440 440 SER SER A . n A 1 351 ASN 351 441 441 ASN ASN A . n A 1 352 ASP 352 442 442 ASP ASP A . n A 1 353 LEU 353 443 443 LEU LEU A . n A 1 354 ILE 354 444 444 ILE ILE A . n A 1 355 THR 355 445 445 THR THR A . n A 1 356 PHE 356 446 446 PHE PHE A . n A 1 357 CYS 357 447 447 CYS CYS A . n A 1 358 GLY 358 448 448 GLY GLY A . n A 1 359 THR 359 449 449 THR THR A . n A 1 360 GLY 360 450 450 GLY GLY A . n A 1 361 GLY 361 451 451 GLY GLY A . n A 1 362 SER 362 452 452 SER SER A . n A 1 363 MET 363 453 453 MET MET A . n A 1 364 PRO 364 454 454 PRO PRO A . n A 1 365 ASP 365 455 455 ASP ASP A . n A 1 366 VAL 366 456 456 VAL VAL A . n A 1 367 ASN 367 457 457 ASN ASN A . n A 1 368 TRP 368 458 458 TRP TRP A . n A 1 369 GLY 369 459 459 GLY GLY A . n B 1 1 GLY 1 77 ? ? ? B . n B 1 2 SER 2 78 ? ? ? B . n B 1 3 PRO 3 79 ? ? ? B . n B 1 4 SER 4 80 ? ? ? B . n B 1 5 ARG 5 81 ? ? ? B . n B 1 6 ALA 6 82 82 ALA ALA B . n B 1 7 THR 7 83 83 THR THR B . n B 1 8 PRO 8 84 84 PRO PRO B . n B 1 9 LEU 9 85 85 LEU LEU B . n B 1 10 VAL 10 86 86 VAL VAL B . n B 1 11 LEU 11 87 87 LEU LEU B . n B 1 12 GLY 12 88 88 GLY GLY B . n B 1 13 GLU 13 89 89 GLU GLU B . n B 1 14 ASN 14 90 90 ASN ASN B . n B 1 15 LEU 15 91 91 LEU LEU B . n B 1 16 CYS 16 92 92 CYS CYS B . n B 1 17 SER 17 93 93 SER SER B . n B 1 18 ILE 18 94 94 ILE ILE B . n B 1 19 ASN 19 95 95 ASN ASN B . n B 1 20 GLY 20 96 96 GLY GLY B . n B 1 21 TRP 21 97 97 TRP TRP B . n B 1 22 VAL 22 98 98 VAL VAL B . n B 1 23 PRO 23 99 99 PRO PRO B . n B 1 24 THR 24 100 100 THR THR B . n B 1 25 TYR 25 101 101 TYR TYR B . n B 1 26 ARG 26 102 102 ARG ARG B . n B 1 27 GLY 27 103 103 GLY GLY B . n B 1 28 GLU 28 104 104 GLU GLU B . n B 1 29 GLY 29 105 105 GLY GLY B . n B 1 30 THR 30 106 106 THR THR B . n B 1 31 THR 31 107 107 THR THR B . n B 1 32 GLY 32 108 108 GLY GLY B . n B 1 33 LYS 33 109 109 LYS LYS B . n B 1 34 ILE 34 110 110 ILE ILE B . n B 1 35 PRO 35 111 111 PRO PRO B . n B 1 36 ASP 36 112 112 ASP ASP B . n B 1 37 GLU 37 113 113 GLU GLU B . n B 1 38 GLN 38 114 114 GLN GLN B . n B 1 39 MET 39 115 115 MET MET B . n B 1 40 LEU 40 116 116 LEU LEU B . n B 1 41 THR 41 117 117 THR THR B . n B 1 42 ARG 42 118 118 ARG ARG B . n B 1 43 GLN 43 119 119 GLN GLN B . n B 1 44 ASN 44 120 120 ASN ASN B . n B 1 45 PHE 45 121 121 PHE PHE B . n B 1 46 VAL 46 122 122 VAL VAL B . n B 1 47 SER 47 123 123 SER SER B . n B 1 48 CYS 48 124 124 CYS CYS B . n B 1 49 SER 49 125 125 SER SER B . n B 1 50 ASP 50 126 126 ASP ASP B . n B 1 51 LYS 51 127 127 LYS LYS B . n B 1 52 GLU 52 128 128 GLU GLU B . n B 1 53 CYS 53 129 129 CYS CYS B . n B 1 54 ARG 54 130 130 ARG ARG B . n B 1 55 ARG 55 131 131 ARG ARG B . n B 1 56 PHE 56 132 132 PHE PHE B . n B 1 57 PHE 57 133 133 PHE PHE B . n B 1 58 VAL 58 134 134 VAL VAL B . n B 1 59 SER 59 135 135 SER SER B . n B 1 60 MET 60 136 136 MET MET B . n B 1 61 GLY 61 137 137 GLY GLY B . n B 1 62 TYR 62 138 138 TYR TYR B . n B 1 63 GLY 63 139 ? ? ? B . n B 1 64 THR 64 140 ? ? ? B . n B 1 65 THR 65 141 ? ? ? B . n B 1 66 THR 66 142 ? ? ? B . n B 1 67 ASN 67 143 ? ? ? B . n B 1 68 PHE 68 144 ? ? ? B . n B 1 69 ALA 69 145 ? ? ? B . n B 1 70 ASP 70 146 ? ? ? B . n B 1 71 LEU 71 147 ? ? ? B . n B 1 72 ILE 72 148 ? ? ? B . n B 1 73 VAL 73 149 149 VAL VAL B . n B 1 74 SER 74 150 150 SER SER B . n B 1 75 GLU 75 151 151 GLU GLU B . n B 1 76 GLN 76 152 152 GLN GLN B . n B 1 77 MET 77 156 156 MET MET B . n B 1 78 ASN 78 157 157 ASN ASN B . n B 1 79 VAL 79 158 158 VAL VAL B . n B 1 80 TYR 80 159 159 TYR TYR B . n B 1 81 SER 81 160 160 SER SER B . n B 1 82 VAL 82 161 161 VAL VAL B . n B 1 83 LYS 83 162 162 LYS LYS B . n B 1 84 LEU 84 163 163 LEU LEU B . n B 1 85 GLY 85 164 164 GLY GLY B . n B 1 86 ASP 86 165 165 ASP ASP B . n B 1 87 PRO 87 166 166 PRO PRO B . n B 1 88 PRO 88 167 167 PRO PRO B . n B 1 89 THR 89 168 168 THR THR B . n B 1 90 PRO 90 169 169 PRO PRO B . n B 1 91 ASP 91 170 170 ASP ASP B . n B 1 92 LYS 92 170 170 LYS LYS B A n B 1 93 LEU 93 171 171 LEU LEU B . n B 1 94 LYS 94 172 172 LYS LYS B . n B 1 95 PHE 95 173 173 PHE PHE B . n B 1 96 GLU 96 174 174 GLU GLU B . n B 1 97 ALA 97 175 175 ALA ALA B . n B 1 98 VAL 98 176 176 VAL VAL B . n B 1 99 GLY 99 177 177 GLY GLY B . n B 1 100 TRP 100 178 178 TRP TRP B . n B 1 101 SER 101 179 179 SER SER B . n B 1 102 ALA 102 180 180 ALA ALA B . n B 1 103 SER 103 181 181 SER SER B . n B 1 104 SER 104 182 182 SER SER B . n B 1 105 CYS 105 183 183 CYS CYS B . n B 1 106 HIS 106 184 184 HIS HIS B . n B 1 107 ASP 107 185 185 ASP ASP B . n B 1 108 GLY 108 186 186 GLY GLY B . n B 1 109 PHE 109 187 187 PHE PHE B . n B 1 110 GLN 110 188 188 GLN GLN B . n B 1 111 TRP 111 189 189 TRP TRP B . n B 1 112 THR 112 190 190 THR THR B . n B 1 113 VAL 113 191 191 VAL VAL B . n B 1 114 LEU 114 192 192 LEU LEU B . n B 1 115 SER 115 193 193 SER SER B . n B 1 116 VAL 116 194 194 VAL VAL B . n B 1 117 ALA 117 195 195 ALA ALA B . n B 1 118 GLY 118 196 196 GLY GLY B . n B 1 119 ASP 119 200 200 ASP ASP B . n B 1 120 GLY 120 201 201 GLY GLY B . n B 1 121 PHE 121 202 202 PHE PHE B . n B 1 122 VAL 122 203 203 VAL VAL B . n B 1 123 SER 123 204 204 SER SER B . n B 1 124 ILE 124 205 205 ILE ILE B . n B 1 125 LEU 125 206 206 LEU LEU B . n B 1 126 TYR 126 207 207 TYR TYR B . n B 1 127 GLY 127 208 208 GLY GLY B . n B 1 128 GLY 128 209 209 GLY GLY B . n B 1 129 ILE 129 210 210 ILE ILE B . n B 1 130 ILE 130 211 211 ILE ILE B . n B 1 131 THR 131 212 212 THR THR B . n B 1 132 ASP 132 213 213 ASP ASP B . n B 1 133 THR 133 214 214 THR THR B . n B 1 134 ILE 134 215 215 ILE ILE B . n B 1 135 HIS 135 216 216 HIS HIS B . n B 1 136 PRO 136 217 217 PRO PRO B . n B 1 137 THR 137 218 218 THR THR B . n B 1 138 ASN 138 219 219 ASN ASN B . n B 1 139 GLY 139 220 220 GLY GLY B . n B 1 140 GLY 140 221 221 GLY GLY B . n B 1 141 PRO 141 222 222 PRO PRO B . n B 1 142 LEU 142 223 223 LEU LEU B . n B 1 143 ARG 143 224 224 ARG ARG B . n B 1 144 THR 144 225 225 THR THR B . n B 1 145 GLN 145 226 226 GLN GLN B . n B 1 146 ALA 146 227 227 ALA ALA B . n B 1 147 SER 147 228 228 SER SER B . n B 1 148 SER 148 229 229 SER SER B . n B 1 149 CYS 149 230 230 CYS CYS B . n B 1 150 ILE 150 231 231 ILE ILE B . n B 1 151 CYS 151 232 232 CYS CYS B . n B 1 152 ASN 152 233 233 ASN ASN B . n B 1 153 ASP 153 234 234 ASP ASP B . n B 1 154 GLY 154 235 235 GLY GLY B . n B 1 155 THR 155 236 236 THR THR B . n B 1 156 CYS 156 237 237 CYS CYS B . n B 1 157 TYR 157 238 238 TYR TYR B . n B 1 158 THR 158 239 239 THR THR B . n B 1 159 ILE 159 240 240 ILE ILE B . n B 1 160 ILE 160 241 241 ILE ILE B . n B 1 161 ALA 161 242 242 ALA ALA B . n B 1 162 ASP 162 243 243 ASP ASP B . n B 1 163 GLY 163 244 244 GLY GLY B . n B 1 164 THR 164 245 245 THR THR B . n B 1 165 THR 165 246 246 THR THR B . n B 1 166 TYR 166 247 247 TYR TYR B . n B 1 167 THR 167 248 248 THR THR B . n B 1 168 ALA 168 249 249 ALA ALA B . n B 1 169 SER 169 250 250 SER SER B . n B 1 170 SER 170 251 251 SER SER B . n B 1 171 HIS 171 252 252 HIS HIS B . n B 1 172 ARG 172 253 253 ARG ARG B . n B 1 173 LEU 173 254 254 LEU LEU B . n B 1 174 TYR 174 255 255 TYR TYR B . n B 1 175 ARG 175 256 256 ARG ARG B . n B 1 176 LEU 176 257 257 LEU LEU B . n B 1 177 VAL 177 258 258 VAL VAL B . n B 1 178 ASN 178 259 259 ASN ASN B . n B 1 179 GLY 179 260 260 GLY GLY B . n B 1 180 THR 180 261 261 THR THR B . n B 1 181 SER 181 262 262 SER SER B . n B 1 182 ALA 182 263 263 ALA ALA B . n B 1 183 GLY 183 264 264 GLY GLY B . n B 1 184 TRP 184 265 265 TRP TRP B . n B 1 185 LYS 185 266 266 LYS LYS B . n B 1 186 ALA 186 267 267 ALA ALA B . n B 1 187 LEU 187 268 268 LEU LEU B . n B 1 188 ASP 188 269 269 ASP ASP B . n B 1 189 THR 189 270 270 THR THR B . n B 1 190 THR 190 271 271 THR THR B . n B 1 191 GLY 191 272 272 GLY GLY B . n B 1 192 PHE 192 273 273 PHE PHE B . n B 1 193 ASN 193 274 274 ASN ASN B . n B 1 194 PHE 194 275 275 PHE PHE B . n B 1 195 GLU 195 276 276 GLU GLU B . n B 1 196 PHE 196 277 277 PHE PHE B . n B 1 197 PRO 197 278 278 PRO PRO B . n B 1 198 THR 198 279 279 THR THR B . n B 1 199 CYS 199 280 280 CYS CYS B . n B 1 200 TYR 200 281 281 TYR TYR B . n B 1 201 TYR 201 282 282 TYR TYR B . n B 1 202 THR 202 283 283 THR THR B . n B 1 203 SER 203 284 284 SER SER B . n B 1 204 GLY 204 285 285 GLY GLY B . n B 1 205 LYS 205 286 286 LYS LYS B . n B 1 206 VAL 206 287 287 VAL VAL B . n B 1 207 LYS 207 288 288 LYS LYS B . n B 1 208 CYS 208 289 289 CYS CYS B . n B 1 209 THR 209 290 290 THR THR B . n B 1 210 GLY 210 291 291 GLY GLY B . n B 1 211 THR 211 292 292 THR THR B . n B 1 212 ASN 212 293 293 ASN ASN B . n B 1 213 LEU 213 294 294 LEU LEU B . n B 1 214 TRP 214 295 295 TRP TRP B . n B 1 215 ASN 215 296 296 ASN ASN B . n B 1 216 ASP 216 297 297 ASP ASP B . n B 1 217 ALA 217 298 298 ALA ALA B . n B 1 218 LYS 218 299 299 LYS LYS B . n B 1 219 ARG 219 300 300 ARG ARG B . n B 1 220 PRO 220 301 301 PRO PRO B . n B 1 221 PHE 221 302 302 PHE PHE B . n B 1 222 LEU 222 303 303 LEU LEU B . n B 1 223 GLU 223 304 304 GLU GLU B . n B 1 224 PHE 224 305 305 PHE PHE B . n B 1 225 ASP 225 306 306 ASP ASP B . n B 1 226 GLN 226 307 307 GLN GLN B . n B 1 227 SER 227 309 309 SER SER B . n B 1 228 PHE 228 310 310 PHE PHE B . n B 1 229 THR 229 311 311 THR THR B . n B 1 230 TYR 230 312 312 TYR TYR B . n B 1 231 THR 231 313 313 THR THR B . n B 1 232 PHE 232 314 314 PHE PHE B . n B 1 233 LYS 233 315 315 LYS LYS B . n B 1 234 GLU 234 316 316 GLU GLU B . n B 1 235 PRO 235 317 317 PRO PRO B . n B 1 236 CYS 236 318 318 CYS CYS B . n B 1 237 LEU 237 319 319 LEU LEU B . n B 1 238 GLY 238 320 320 GLY GLY B . n B 1 239 PHE 239 321 321 PHE PHE B . n B 1 240 LEU 240 322 322 LEU LEU B . n B 1 241 GLY 241 323 323 GLY GLY B . n B 1 242 ASP 242 324 324 ASP ASP B . n B 1 243 THR 243 325 325 THR THR B . n B 1 244 PRO 244 326 326 PRO PRO B . n B 1 245 ARG 245 327 327 ARG ARG B . n B 1 246 GLY 246 328 328 GLY GLY B . n B 1 247 ILE 247 329 329 ILE ILE B . n B 1 248 ASP 248 330 330 ASP ASP B . n B 1 249 THR 249 333 333 THR THR B . n B 1 250 THR 250 334 334 THR THR B . n B 1 251 ASN 251 335 335 ASN ASN B . n B 1 252 TYR 252 336 336 TYR TYR B . n B 1 253 CYS 253 337 337 CYS CYS B . n B 1 254 ASP 254 339 339 ASP ASP B . n B 1 255 LYS 255 340 340 LYS LYS B . n B 1 256 THR 256 341 341 THR THR B . n B 1 257 THR 257 342 342 THR THR B . n B 1 258 THR 258 343 343 THR THR B . n B 1 259 GLU 259 344 344 GLU GLU B . n B 1 260 GLY 260 345 345 GLY GLY B . n B 1 261 GLU 261 346 346 GLU GLU B . n B 1 262 GLY 262 347 347 GLY GLY B . n B 1 263 GLY 263 348 348 GLY GLY B . n B 1 264 ILE 264 349 349 ILE ILE B . n B 1 265 GLN 265 350 350 GLN GLN B . n B 1 266 GLY 266 351 351 GLY GLY B . n B 1 267 PHE 267 352 352 PHE PHE B . n B 1 268 MET 268 353 353 MET MET B . n B 1 269 ILE 269 354 354 ILE ILE B . n B 1 270 GLU 270 355 355 GLU GLU B . n B 1 271 GLY 271 356 356 GLY GLY B . n B 1 272 SER 272 357 357 SER SER B . n B 1 273 ASN 273 359 359 ASN ASN B . n B 1 274 SER 274 360 360 SER SER B . n B 1 275 TRP 275 361 361 TRP TRP B . n B 1 276 ILE 276 362 362 ILE ILE B . n B 1 277 GLY 277 363 363 GLY GLY B . n B 1 278 ARG 278 364 364 ARG ARG B . n B 1 279 ILE 279 365 365 ILE ILE B . n B 1 280 ILE 280 366 366 ILE ILE B . n B 1 281 ASN 281 367 367 ASN ASN B . n B 1 282 PRO 282 368 368 PRO PRO B . n B 1 283 GLY 283 369 369 GLY GLY B . n B 1 284 SER 284 370 370 SER SER B . n B 1 285 LYS 285 371 371 LYS LYS B . n B 1 286 LYS 286 372 372 LYS LYS B . n B 1 287 GLY 287 373 373 GLY GLY B . n B 1 288 PHE 288 374 374 PHE PHE B . n B 1 289 GLU 289 375 375 GLU GLU B . n B 1 290 ILE 290 376 376 ILE ILE B . n B 1 291 TYR 291 377 377 TYR TYR B . n B 1 292 LYS 292 378 378 LYS LYS B . n B 1 293 PHE 293 379 379 PHE PHE B . n B 1 294 LEU 294 380 380 LEU LEU B . n B 1 295 GLY 295 381 381 GLY GLY B . n B 1 296 THR 296 382 382 THR THR B . n B 1 297 LEU 297 383 383 LEU LEU B . n B 1 298 PHE 298 384 384 PHE PHE B . n B 1 299 SER 299 385 385 SER SER B . n B 1 300 VAL 300 387 387 VAL VAL B . n B 1 301 GLN 301 388 388 GLN GLN B . n B 1 302 THR 302 390 390 THR THR B . n B 1 303 VAL 303 391 391 VAL VAL B . n B 1 304 GLY 304 392 392 GLY GLY B . n B 1 305 ASN 305 392 392 ASN ASN B A n B 1 306 ARG 306 393 393 ARG ARG B . n B 1 307 ASN 307 394 394 ASN ASN B . n B 1 308 TYR 308 395 395 TYR TYR B . n B 1 309 GLN 309 396 396 GLN GLN B . n B 1 310 LEU 310 397 397 LEU LEU B . n B 1 311 LEU 311 398 398 LEU LEU B . n B 1 312 SER 312 399 399 SER SER B . n B 1 313 ASN 313 401 401 ASN ASN B . n B 1 314 SER 314 402 402 SER SER B . n B 1 315 THR 315 403 403 THR THR B . n B 1 316 ILE 316 404 404 ILE ILE B . n B 1 317 GLY 317 405 405 GLY GLY B . n B 1 318 ARG 318 406 406 ARG ARG B . n B 1 319 SER 319 407 407 SER SER B . n B 1 320 GLY 320 408 408 GLY GLY B . n B 1 321 LEU 321 409 409 LEU LEU B . n B 1 322 TYR 322 410 410 TYR TYR B . n B 1 323 GLN 323 411 411 GLN GLN B . n B 1 324 PRO 324 412 412 PRO PRO B . n B 1 325 ALA 325 413 413 ALA ALA B . n B 1 326 TYR 326 413 413 TYR TYR B A n B 1 327 GLU 327 414 414 GLU GLU B . n B 1 328 SER 328 415 415 SER SER B . n B 1 329 ARG 329 415 415 ARG ARG B A n B 1 330 ASP 330 416 416 ASP ASP B . n B 1 331 CYS 331 417 417 CYS CYS B . n B 1 332 GLN 332 418 418 GLN GLN B . n B 1 333 GLU 333 419 419 GLU GLU B . n B 1 334 LEU 334 420 420 LEU LEU B . n B 1 335 CYS 335 421 421 CYS CYS B . n B 1 336 PHE 336 422 422 PHE PHE B . n B 1 337 TRP 337 423 423 TRP TRP B . n B 1 338 ILE 338 424 424 ILE ILE B . n B 1 339 GLU 339 425 425 GLU GLU B . n B 1 340 ILE 340 426 426 ILE ILE B . n B 1 341 ALA 341 427 427 ALA ALA B . n B 1 342 ALA 342 428 428 ALA ALA B . n B 1 343 THR 343 429 429 THR THR B . n B 1 344 THR 344 430 430 THR THR B . n B 1 345 LYS 345 431 431 LYS LYS B . n B 1 346 ALA 346 432 432 ALA ALA B . n B 1 347 GLY 347 433 433 GLY GLY B . n B 1 348 LEU 348 438 438 LEU LEU B . n B 1 349 SER 349 439 439 SER SER B . n B 1 350 SER 350 440 440 SER SER B . n B 1 351 ASN 351 441 441 ASN ASN B . n B 1 352 ASP 352 442 442 ASP ASP B . n B 1 353 LEU 353 443 443 LEU LEU B . n B 1 354 ILE 354 444 444 ILE ILE B . n B 1 355 THR 355 445 445 THR THR B . n B 1 356 PHE 356 446 446 PHE PHE B . n B 1 357 CYS 357 447 447 CYS CYS B . n B 1 358 GLY 358 448 448 GLY GLY B . n B 1 359 THR 359 449 449 THR THR B . n B 1 360 GLY 360 450 450 GLY GLY B . n B 1 361 GLY 361 451 451 GLY GLY B . n B 1 362 SER 362 452 452 SER SER B . n B 1 363 MET 363 453 453 MET MET B . n B 1 364 PRO 364 454 454 PRO PRO B . n B 1 365 ASP 365 455 455 ASP ASP B . n B 1 366 VAL 366 456 456 VAL VAL B . n B 1 367 ASN 367 457 457 ASN ASN B . n B 1 368 TRP 368 458 458 TRP TRP B . n B 1 369 GLY 369 459 459 GLY GLY B . n C 1 1 GLY 1 77 ? ? ? C . n C 1 2 SER 2 78 ? ? ? C . n C 1 3 PRO 3 79 ? ? ? C . n C 1 4 SER 4 80 ? ? ? C . n C 1 5 ARG 5 81 ? ? ? C . n C 1 6 ALA 6 82 82 ALA ALA C . n C 1 7 THR 7 83 83 THR THR C . n C 1 8 PRO 8 84 84 PRO PRO C . n C 1 9 LEU 9 85 85 LEU LEU C . n C 1 10 VAL 10 86 86 VAL VAL C . n C 1 11 LEU 11 87 87 LEU LEU C . n C 1 12 GLY 12 88 88 GLY GLY C . n C 1 13 GLU 13 89 89 GLU GLU C . n C 1 14 ASN 14 90 90 ASN ASN C . n C 1 15 LEU 15 91 91 LEU LEU C . n C 1 16 CYS 16 92 92 CYS CYS C . n C 1 17 SER 17 93 93 SER SER C . n C 1 18 ILE 18 94 94 ILE ILE C . n C 1 19 ASN 19 95 95 ASN ASN C . n C 1 20 GLY 20 96 96 GLY GLY C . n C 1 21 TRP 21 97 97 TRP TRP C . n C 1 22 VAL 22 98 98 VAL VAL C . n C 1 23 PRO 23 99 99 PRO PRO C . n C 1 24 THR 24 100 100 THR THR C . n C 1 25 TYR 25 101 101 TYR TYR C . n C 1 26 ARG 26 102 102 ARG ARG C . n C 1 27 GLY 27 103 103 GLY GLY C . n C 1 28 GLU 28 104 104 GLU GLU C . n C 1 29 GLY 29 105 105 GLY GLY C . n C 1 30 THR 30 106 106 THR THR C . n C 1 31 THR 31 107 107 THR THR C . n C 1 32 GLY 32 108 108 GLY GLY C . n C 1 33 LYS 33 109 109 LYS LYS C . n C 1 34 ILE 34 110 110 ILE ILE C . n C 1 35 PRO 35 111 111 PRO PRO C . n C 1 36 ASP 36 112 112 ASP ASP C . n C 1 37 GLU 37 113 113 GLU GLU C . n C 1 38 GLN 38 114 114 GLN GLN C . n C 1 39 MET 39 115 115 MET MET C . n C 1 40 LEU 40 116 116 LEU LEU C . n C 1 41 THR 41 117 117 THR THR C . n C 1 42 ARG 42 118 118 ARG ARG C . n C 1 43 GLN 43 119 119 GLN GLN C . n C 1 44 ASN 44 120 120 ASN ASN C . n C 1 45 PHE 45 121 121 PHE PHE C . n C 1 46 VAL 46 122 122 VAL VAL C . n C 1 47 SER 47 123 123 SER SER C . n C 1 48 CYS 48 124 124 CYS CYS C . n C 1 49 SER 49 125 125 SER SER C . n C 1 50 ASP 50 126 126 ASP ASP C . n C 1 51 LYS 51 127 127 LYS LYS C . n C 1 52 GLU 52 128 128 GLU GLU C . n C 1 53 CYS 53 129 129 CYS CYS C . n C 1 54 ARG 54 130 130 ARG ARG C . n C 1 55 ARG 55 131 131 ARG ARG C . n C 1 56 PHE 56 132 132 PHE PHE C . n C 1 57 PHE 57 133 133 PHE PHE C . n C 1 58 VAL 58 134 134 VAL VAL C . n C 1 59 SER 59 135 135 SER SER C . n C 1 60 MET 60 136 136 MET MET C . n C 1 61 GLY 61 137 137 GLY GLY C . n C 1 62 TYR 62 138 138 TYR TYR C . n C 1 63 GLY 63 139 139 GLY GLY C . n C 1 64 THR 64 140 ? ? ? C . n C 1 65 THR 65 141 ? ? ? C . n C 1 66 THR 66 142 ? ? ? C . n C 1 67 ASN 67 143 ? ? ? C . n C 1 68 PHE 68 144 ? ? ? C . n C 1 69 ALA 69 145 ? ? ? C . n C 1 70 ASP 70 146 ? ? ? C . n C 1 71 LEU 71 147 ? ? ? C . n C 1 72 ILE 72 148 ? ? ? C . n C 1 73 VAL 73 149 149 VAL VAL C . n C 1 74 SER 74 150 150 SER SER C . n C 1 75 GLU 75 151 151 GLU GLU C . n C 1 76 GLN 76 152 152 GLN GLN C . n C 1 77 MET 77 156 156 MET MET C . n C 1 78 ASN 78 157 157 ASN ASN C . n C 1 79 VAL 79 158 158 VAL VAL C . n C 1 80 TYR 80 159 159 TYR TYR C . n C 1 81 SER 81 160 160 SER SER C . n C 1 82 VAL 82 161 161 VAL VAL C . n C 1 83 LYS 83 162 162 LYS LYS C . n C 1 84 LEU 84 163 163 LEU LEU C . n C 1 85 GLY 85 164 164 GLY GLY C . n C 1 86 ASP 86 165 165 ASP ASP C . n C 1 87 PRO 87 166 166 PRO PRO C . n C 1 88 PRO 88 167 167 PRO PRO C . n C 1 89 THR 89 168 168 THR THR C . n C 1 90 PRO 90 169 169 PRO PRO C . n C 1 91 ASP 91 170 170 ASP ASP C . n C 1 92 LYS 92 170 170 LYS LYS C A n C 1 93 LEU 93 171 171 LEU LEU C . n C 1 94 LYS 94 172 172 LYS LYS C . n C 1 95 PHE 95 173 173 PHE PHE C . n C 1 96 GLU 96 174 174 GLU GLU C . n C 1 97 ALA 97 175 175 ALA ALA C . n C 1 98 VAL 98 176 176 VAL VAL C . n C 1 99 GLY 99 177 177 GLY GLY C . n C 1 100 TRP 100 178 178 TRP TRP C . n C 1 101 SER 101 179 179 SER SER C . n C 1 102 ALA 102 180 180 ALA ALA C . n C 1 103 SER 103 181 181 SER SER C . n C 1 104 SER 104 182 182 SER SER C . n C 1 105 CYS 105 183 183 CYS CYS C . n C 1 106 HIS 106 184 184 HIS HIS C . n C 1 107 ASP 107 185 185 ASP ASP C . n C 1 108 GLY 108 186 186 GLY GLY C . n C 1 109 PHE 109 187 187 PHE PHE C . n C 1 110 GLN 110 188 188 GLN GLN C . n C 1 111 TRP 111 189 189 TRP TRP C . n C 1 112 THR 112 190 190 THR THR C . n C 1 113 VAL 113 191 191 VAL VAL C . n C 1 114 LEU 114 192 192 LEU LEU C . n C 1 115 SER 115 193 193 SER SER C . n C 1 116 VAL 116 194 194 VAL VAL C . n C 1 117 ALA 117 195 195 ALA ALA C . n C 1 118 GLY 118 196 196 GLY GLY C . n C 1 119 ASP 119 200 200 ASP ASP C . n C 1 120 GLY 120 201 201 GLY GLY C . n C 1 121 PHE 121 202 202 PHE PHE C . n C 1 122 VAL 122 203 203 VAL VAL C . n C 1 123 SER 123 204 204 SER SER C . n C 1 124 ILE 124 205 205 ILE ILE C . n C 1 125 LEU 125 206 206 LEU LEU C . n C 1 126 TYR 126 207 207 TYR TYR C . n C 1 127 GLY 127 208 208 GLY GLY C . n C 1 128 GLY 128 209 209 GLY GLY C . n C 1 129 ILE 129 210 210 ILE ILE C . n C 1 130 ILE 130 211 211 ILE ILE C . n C 1 131 THR 131 212 212 THR THR C . n C 1 132 ASP 132 213 213 ASP ASP C . n C 1 133 THR 133 214 214 THR THR C . n C 1 134 ILE 134 215 215 ILE ILE C . n C 1 135 HIS 135 216 216 HIS HIS C . n C 1 136 PRO 136 217 217 PRO PRO C . n C 1 137 THR 137 218 218 THR THR C . n C 1 138 ASN 138 219 219 ASN ASN C . n C 1 139 GLY 139 220 220 GLY GLY C . n C 1 140 GLY 140 221 221 GLY GLY C . n C 1 141 PRO 141 222 222 PRO PRO C . n C 1 142 LEU 142 223 223 LEU LEU C . n C 1 143 ARG 143 224 224 ARG ARG C . n C 1 144 THR 144 225 225 THR THR C . n C 1 145 GLN 145 226 226 GLN GLN C . n C 1 146 ALA 146 227 227 ALA ALA C . n C 1 147 SER 147 228 228 SER SER C . n C 1 148 SER 148 229 229 SER SER C . n C 1 149 CYS 149 230 230 CYS CYS C . n C 1 150 ILE 150 231 231 ILE ILE C . n C 1 151 CYS 151 232 232 CYS CYS C . n C 1 152 ASN 152 233 233 ASN ASN C . n C 1 153 ASP 153 234 234 ASP ASP C . n C 1 154 GLY 154 235 235 GLY GLY C . n C 1 155 THR 155 236 236 THR THR C . n C 1 156 CYS 156 237 237 CYS CYS C . n C 1 157 TYR 157 238 238 TYR TYR C . n C 1 158 THR 158 239 239 THR THR C . n C 1 159 ILE 159 240 240 ILE ILE C . n C 1 160 ILE 160 241 241 ILE ILE C . n C 1 161 ALA 161 242 242 ALA ALA C . n C 1 162 ASP 162 243 243 ASP ASP C . n C 1 163 GLY 163 244 244 GLY GLY C . n C 1 164 THR 164 245 245 THR THR C . n C 1 165 THR 165 246 246 THR THR C . n C 1 166 TYR 166 247 247 TYR TYR C . n C 1 167 THR 167 248 248 THR THR C . n C 1 168 ALA 168 249 249 ALA ALA C . n C 1 169 SER 169 250 250 SER SER C . n C 1 170 SER 170 251 251 SER SER C . n C 1 171 HIS 171 252 252 HIS HIS C . n C 1 172 ARG 172 253 253 ARG ARG C . n C 1 173 LEU 173 254 254 LEU LEU C . n C 1 174 TYR 174 255 255 TYR TYR C . n C 1 175 ARG 175 256 256 ARG ARG C . n C 1 176 LEU 176 257 257 LEU LEU C . n C 1 177 VAL 177 258 258 VAL VAL C . n C 1 178 ASN 178 259 259 ASN ASN C . n C 1 179 GLY 179 260 260 GLY GLY C . n C 1 180 THR 180 261 261 THR THR C . n C 1 181 SER 181 262 262 SER SER C . n C 1 182 ALA 182 263 263 ALA ALA C . n C 1 183 GLY 183 264 264 GLY GLY C . n C 1 184 TRP 184 265 265 TRP TRP C . n C 1 185 LYS 185 266 266 LYS LYS C . n C 1 186 ALA 186 267 267 ALA ALA C . n C 1 187 LEU 187 268 268 LEU LEU C . n C 1 188 ASP 188 269 269 ASP ASP C . n C 1 189 THR 189 270 270 THR THR C . n C 1 190 THR 190 271 271 THR THR C . n C 1 191 GLY 191 272 272 GLY GLY C . n C 1 192 PHE 192 273 273 PHE PHE C . n C 1 193 ASN 193 274 274 ASN ASN C . n C 1 194 PHE 194 275 275 PHE PHE C . n C 1 195 GLU 195 276 276 GLU GLU C . n C 1 196 PHE 196 277 277 PHE PHE C . n C 1 197 PRO 197 278 278 PRO PRO C . n C 1 198 THR 198 279 279 THR THR C . n C 1 199 CYS 199 280 280 CYS CYS C . n C 1 200 TYR 200 281 281 TYR TYR C . n C 1 201 TYR 201 282 282 TYR TYR C . n C 1 202 THR 202 283 283 THR THR C . n C 1 203 SER 203 284 284 SER SER C . n C 1 204 GLY 204 285 285 GLY GLY C . n C 1 205 LYS 205 286 286 LYS LYS C . n C 1 206 VAL 206 287 287 VAL VAL C . n C 1 207 LYS 207 288 288 LYS LYS C . n C 1 208 CYS 208 289 289 CYS CYS C . n C 1 209 THR 209 290 290 THR THR C . n C 1 210 GLY 210 291 291 GLY GLY C . n C 1 211 THR 211 292 292 THR THR C . n C 1 212 ASN 212 293 293 ASN ASN C . n C 1 213 LEU 213 294 294 LEU LEU C . n C 1 214 TRP 214 295 295 TRP TRP C . n C 1 215 ASN 215 296 296 ASN ASN C . n C 1 216 ASP 216 297 297 ASP ASP C . n C 1 217 ALA 217 298 298 ALA ALA C . n C 1 218 LYS 218 299 299 LYS LYS C . n C 1 219 ARG 219 300 300 ARG ARG C . n C 1 220 PRO 220 301 301 PRO PRO C . n C 1 221 PHE 221 302 302 PHE PHE C . n C 1 222 LEU 222 303 303 LEU LEU C . n C 1 223 GLU 223 304 304 GLU GLU C . n C 1 224 PHE 224 305 305 PHE PHE C . n C 1 225 ASP 225 306 306 ASP ASP C . n C 1 226 GLN 226 307 307 GLN GLN C . n C 1 227 SER 227 309 309 SER SER C . n C 1 228 PHE 228 310 310 PHE PHE C . n C 1 229 THR 229 311 311 THR THR C . n C 1 230 TYR 230 312 312 TYR TYR C . n C 1 231 THR 231 313 313 THR THR C . n C 1 232 PHE 232 314 314 PHE PHE C . n C 1 233 LYS 233 315 315 LYS LYS C . n C 1 234 GLU 234 316 316 GLU GLU C . n C 1 235 PRO 235 317 317 PRO PRO C . n C 1 236 CYS 236 318 318 CYS CYS C . n C 1 237 LEU 237 319 319 LEU LEU C . n C 1 238 GLY 238 320 320 GLY GLY C . n C 1 239 PHE 239 321 321 PHE PHE C . n C 1 240 LEU 240 322 322 LEU LEU C . n C 1 241 GLY 241 323 323 GLY GLY C . n C 1 242 ASP 242 324 324 ASP ASP C . n C 1 243 THR 243 325 325 THR THR C . n C 1 244 PRO 244 326 326 PRO PRO C . n C 1 245 ARG 245 327 327 ARG ARG C . n C 1 246 GLY 246 328 328 GLY GLY C . n C 1 247 ILE 247 329 329 ILE ILE C . n C 1 248 ASP 248 330 330 ASP ASP C . n C 1 249 THR 249 333 333 THR THR C . n C 1 250 THR 250 334 334 THR THR C . n C 1 251 ASN 251 335 335 ASN ASN C . n C 1 252 TYR 252 336 336 TYR TYR C . n C 1 253 CYS 253 337 337 CYS CYS C . n C 1 254 ASP 254 339 339 ASP ASP C . n C 1 255 LYS 255 340 340 LYS LYS C . n C 1 256 THR 256 341 341 THR THR C . n C 1 257 THR 257 342 342 THR THR C . n C 1 258 THR 258 343 343 THR THR C . n C 1 259 GLU 259 344 344 GLU GLU C . n C 1 260 GLY 260 345 345 GLY GLY C . n C 1 261 GLU 261 346 346 GLU GLU C . n C 1 262 GLY 262 347 347 GLY GLY C . n C 1 263 GLY 263 348 348 GLY GLY C . n C 1 264 ILE 264 349 349 ILE ILE C . n C 1 265 GLN 265 350 350 GLN GLN C . n C 1 266 GLY 266 351 351 GLY GLY C . n C 1 267 PHE 267 352 352 PHE PHE C . n C 1 268 MET 268 353 353 MET MET C . n C 1 269 ILE 269 354 354 ILE ILE C . n C 1 270 GLU 270 355 355 GLU GLU C . n C 1 271 GLY 271 356 356 GLY GLY C . n C 1 272 SER 272 357 357 SER SER C . n C 1 273 ASN 273 359 359 ASN ASN C . n C 1 274 SER 274 360 360 SER SER C . n C 1 275 TRP 275 361 361 TRP TRP C . n C 1 276 ILE 276 362 362 ILE ILE C . n C 1 277 GLY 277 363 363 GLY GLY C . n C 1 278 ARG 278 364 364 ARG ARG C . n C 1 279 ILE 279 365 365 ILE ILE C . n C 1 280 ILE 280 366 366 ILE ILE C . n C 1 281 ASN 281 367 367 ASN ASN C . n C 1 282 PRO 282 368 368 PRO PRO C . n C 1 283 GLY 283 369 369 GLY GLY C . n C 1 284 SER 284 370 370 SER SER C . n C 1 285 LYS 285 371 371 LYS LYS C . n C 1 286 LYS 286 372 372 LYS LYS C . n C 1 287 GLY 287 373 373 GLY GLY C . n C 1 288 PHE 288 374 374 PHE PHE C . n C 1 289 GLU 289 375 375 GLU GLU C . n C 1 290 ILE 290 376 376 ILE ILE C . n C 1 291 TYR 291 377 377 TYR TYR C . n C 1 292 LYS 292 378 378 LYS LYS C . n C 1 293 PHE 293 379 379 PHE PHE C . n C 1 294 LEU 294 380 380 LEU LEU C . n C 1 295 GLY 295 381 381 GLY GLY C . n C 1 296 THR 296 382 382 THR THR C . n C 1 297 LEU 297 383 383 LEU LEU C . n C 1 298 PHE 298 384 384 PHE PHE C . n C 1 299 SER 299 385 385 SER SER C . n C 1 300 VAL 300 387 387 VAL VAL C . n C 1 301 GLN 301 388 388 GLN GLN C . n C 1 302 THR 302 390 390 THR THR C . n C 1 303 VAL 303 391 391 VAL VAL C . n C 1 304 GLY 304 392 392 GLY GLY C . n C 1 305 ASN 305 392 392 ASN ASN C A n C 1 306 ARG 306 393 393 ARG ARG C . n C 1 307 ASN 307 394 394 ASN ASN C . n C 1 308 TYR 308 395 395 TYR TYR C . n C 1 309 GLN 309 396 396 GLN GLN C . n C 1 310 LEU 310 397 397 LEU LEU C . n C 1 311 LEU 311 398 398 LEU LEU C . n C 1 312 SER 312 399 399 SER SER C . n C 1 313 ASN 313 401 401 ASN ASN C . n C 1 314 SER 314 402 402 SER SER C . n C 1 315 THR 315 403 403 THR THR C . n C 1 316 ILE 316 404 404 ILE ILE C . n C 1 317 GLY 317 405 405 GLY GLY C . n C 1 318 ARG 318 406 406 ARG ARG C . n C 1 319 SER 319 407 407 SER SER C . n C 1 320 GLY 320 408 408 GLY GLY C . n C 1 321 LEU 321 409 409 LEU LEU C . n C 1 322 TYR 322 410 410 TYR TYR C . n C 1 323 GLN 323 411 411 GLN GLN C . n C 1 324 PRO 324 412 412 PRO PRO C . n C 1 325 ALA 325 413 413 ALA ALA C . n C 1 326 TYR 326 413 413 TYR TYR C A n C 1 327 GLU 327 414 414 GLU GLU C . n C 1 328 SER 328 415 415 SER SER C . n C 1 329 ARG 329 415 415 ARG ARG C A n C 1 330 ASP 330 416 416 ASP ASP C . n C 1 331 CYS 331 417 417 CYS CYS C . n C 1 332 GLN 332 418 418 GLN GLN C . n C 1 333 GLU 333 419 419 GLU GLU C . n C 1 334 LEU 334 420 420 LEU LEU C . n C 1 335 CYS 335 421 421 CYS CYS C . n C 1 336 PHE 336 422 422 PHE PHE C . n C 1 337 TRP 337 423 423 TRP TRP C . n C 1 338 ILE 338 424 424 ILE ILE C . n C 1 339 GLU 339 425 425 GLU GLU C . n C 1 340 ILE 340 426 426 ILE ILE C . n C 1 341 ALA 341 427 427 ALA ALA C . n C 1 342 ALA 342 428 428 ALA ALA C . n C 1 343 THR 343 429 429 THR THR C . n C 1 344 THR 344 430 430 THR THR C . n C 1 345 LYS 345 431 431 LYS LYS C . n C 1 346 ALA 346 432 432 ALA ALA C . n C 1 347 GLY 347 433 433 GLY GLY C . n C 1 348 LEU 348 438 438 LEU LEU C . n C 1 349 SER 349 439 439 SER SER C . n C 1 350 SER 350 440 440 SER SER C . n C 1 351 ASN 351 441 441 ASN ASN C . n C 1 352 ASP 352 442 442 ASP ASP C . n C 1 353 LEU 353 443 443 LEU LEU C . n C 1 354 ILE 354 444 444 ILE ILE C . n C 1 355 THR 355 445 445 THR THR C . n C 1 356 PHE 356 446 446 PHE PHE C . n C 1 357 CYS 357 447 447 CYS CYS C . n C 1 358 GLY 358 448 448 GLY GLY C . n C 1 359 THR 359 449 449 THR THR C . n C 1 360 GLY 360 450 450 GLY GLY C . n C 1 361 GLY 361 451 451 GLY GLY C . n C 1 362 SER 362 452 452 SER SER C . n C 1 363 MET 363 453 453 MET MET C . n C 1 364 PRO 364 454 454 PRO PRO C . n C 1 365 ASP 365 455 455 ASP ASP C . n C 1 366 VAL 366 456 456 VAL VAL C . n C 1 367 ASN 367 457 457 ASN ASN C . n C 1 368 TRP 368 458 458 TRP TRP C . n C 1 369 GLY 369 459 459 GLY GLY C . n D 1 1 GLY 1 77 ? ? ? D . n D 1 2 SER 2 78 ? ? ? D . n D 1 3 PRO 3 79 ? ? ? D . n D 1 4 SER 4 80 ? ? ? D . n D 1 5 ARG 5 81 ? ? ? D . n D 1 6 ALA 6 82 82 ALA ALA D . n D 1 7 THR 7 83 83 THR THR D . n D 1 8 PRO 8 84 84 PRO PRO D . n D 1 9 LEU 9 85 85 LEU LEU D . n D 1 10 VAL 10 86 86 VAL VAL D . n D 1 11 LEU 11 87 87 LEU LEU D . n D 1 12 GLY 12 88 88 GLY GLY D . n D 1 13 GLU 13 89 89 GLU GLU D . n D 1 14 ASN 14 90 90 ASN ASN D . n D 1 15 LEU 15 91 91 LEU LEU D . n D 1 16 CYS 16 92 92 CYS CYS D . n D 1 17 SER 17 93 93 SER SER D . n D 1 18 ILE 18 94 94 ILE ILE D . n D 1 19 ASN 19 95 95 ASN ASN D . n D 1 20 GLY 20 96 96 GLY GLY D . n D 1 21 TRP 21 97 97 TRP TRP D . n D 1 22 VAL 22 98 98 VAL VAL D . n D 1 23 PRO 23 99 99 PRO PRO D . n D 1 24 THR 24 100 100 THR THR D . n D 1 25 TYR 25 101 101 TYR TYR D . n D 1 26 ARG 26 102 102 ARG ARG D . n D 1 27 GLY 27 103 103 GLY GLY D . n D 1 28 GLU 28 104 104 GLU GLU D . n D 1 29 GLY 29 105 105 GLY GLY D . n D 1 30 THR 30 106 106 THR THR D . n D 1 31 THR 31 107 107 THR THR D . n D 1 32 GLY 32 108 108 GLY GLY D . n D 1 33 LYS 33 109 109 LYS LYS D . n D 1 34 ILE 34 110 110 ILE ILE D . n D 1 35 PRO 35 111 111 PRO PRO D . n D 1 36 ASP 36 112 112 ASP ASP D . n D 1 37 GLU 37 113 113 GLU GLU D . n D 1 38 GLN 38 114 114 GLN GLN D . n D 1 39 MET 39 115 115 MET MET D . n D 1 40 LEU 40 116 116 LEU LEU D . n D 1 41 THR 41 117 117 THR THR D . n D 1 42 ARG 42 118 118 ARG ARG D . n D 1 43 GLN 43 119 119 GLN GLN D . n D 1 44 ASN 44 120 120 ASN ASN D . n D 1 45 PHE 45 121 121 PHE PHE D . n D 1 46 VAL 46 122 122 VAL VAL D . n D 1 47 SER 47 123 123 SER SER D . n D 1 48 CYS 48 124 124 CYS CYS D . n D 1 49 SER 49 125 125 SER SER D . n D 1 50 ASP 50 126 126 ASP ASP D . n D 1 51 LYS 51 127 127 LYS LYS D . n D 1 52 GLU 52 128 128 GLU GLU D . n D 1 53 CYS 53 129 129 CYS CYS D . n D 1 54 ARG 54 130 130 ARG ARG D . n D 1 55 ARG 55 131 131 ARG ARG D . n D 1 56 PHE 56 132 132 PHE PHE D . n D 1 57 PHE 57 133 133 PHE PHE D . n D 1 58 VAL 58 134 134 VAL VAL D . n D 1 59 SER 59 135 135 SER SER D . n D 1 60 MET 60 136 136 MET MET D . n D 1 61 GLY 61 137 137 GLY GLY D . n D 1 62 TYR 62 138 138 TYR TYR D . n D 1 63 GLY 63 139 ? ? ? D . n D 1 64 THR 64 140 ? ? ? D . n D 1 65 THR 65 141 ? ? ? D . n D 1 66 THR 66 142 ? ? ? D . n D 1 67 ASN 67 143 ? ? ? D . n D 1 68 PHE 68 144 ? ? ? D . n D 1 69 ALA 69 145 ? ? ? D . n D 1 70 ASP 70 146 ? ? ? D . n D 1 71 LEU 71 147 ? ? ? D . n D 1 72 ILE 72 148 ? ? ? D . n D 1 73 VAL 73 149 149 VAL VAL D . n D 1 74 SER 74 150 150 SER SER D . n D 1 75 GLU 75 151 151 GLU GLU D . n D 1 76 GLN 76 152 152 GLN GLN D . n D 1 77 MET 77 156 156 MET MET D . n D 1 78 ASN 78 157 157 ASN ASN D . n D 1 79 VAL 79 158 158 VAL VAL D . n D 1 80 TYR 80 159 159 TYR TYR D . n D 1 81 SER 81 160 160 SER SER D . n D 1 82 VAL 82 161 161 VAL VAL D . n D 1 83 LYS 83 162 162 LYS LYS D . n D 1 84 LEU 84 163 163 LEU LEU D . n D 1 85 GLY 85 164 164 GLY GLY D . n D 1 86 ASP 86 165 165 ASP ASP D . n D 1 87 PRO 87 166 166 PRO PRO D . n D 1 88 PRO 88 167 167 PRO PRO D . n D 1 89 THR 89 168 168 THR THR D . n D 1 90 PRO 90 169 169 PRO PRO D . n D 1 91 ASP 91 170 170 ASP ASP D . n D 1 92 LYS 92 170 170 LYS LYS D A n D 1 93 LEU 93 171 171 LEU LEU D . n D 1 94 LYS 94 172 172 LYS LYS D . n D 1 95 PHE 95 173 173 PHE PHE D . n D 1 96 GLU 96 174 174 GLU GLU D . n D 1 97 ALA 97 175 175 ALA ALA D . n D 1 98 VAL 98 176 176 VAL VAL D . n D 1 99 GLY 99 177 177 GLY GLY D . n D 1 100 TRP 100 178 178 TRP TRP D . n D 1 101 SER 101 179 179 SER SER D . n D 1 102 ALA 102 180 180 ALA ALA D . n D 1 103 SER 103 181 181 SER SER D . n D 1 104 SER 104 182 182 SER SER D . n D 1 105 CYS 105 183 183 CYS CYS D . n D 1 106 HIS 106 184 184 HIS HIS D . n D 1 107 ASP 107 185 185 ASP ASP D . n D 1 108 GLY 108 186 186 GLY GLY D . n D 1 109 PHE 109 187 187 PHE PHE D . n D 1 110 GLN 110 188 188 GLN GLN D . n D 1 111 TRP 111 189 189 TRP TRP D . n D 1 112 THR 112 190 190 THR THR D . n D 1 113 VAL 113 191 191 VAL VAL D . n D 1 114 LEU 114 192 192 LEU LEU D . n D 1 115 SER 115 193 193 SER SER D . n D 1 116 VAL 116 194 194 VAL VAL D . n D 1 117 ALA 117 195 195 ALA ALA D . n D 1 118 GLY 118 196 196 GLY GLY D . n D 1 119 ASP 119 200 200 ASP ASP D . n D 1 120 GLY 120 201 201 GLY GLY D . n D 1 121 PHE 121 202 202 PHE PHE D . n D 1 122 VAL 122 203 203 VAL VAL D . n D 1 123 SER 123 204 204 SER SER D . n D 1 124 ILE 124 205 205 ILE ILE D . n D 1 125 LEU 125 206 206 LEU LEU D . n D 1 126 TYR 126 207 207 TYR TYR D . n D 1 127 GLY 127 208 208 GLY GLY D . n D 1 128 GLY 128 209 209 GLY GLY D . n D 1 129 ILE 129 210 210 ILE ILE D . n D 1 130 ILE 130 211 211 ILE ILE D . n D 1 131 THR 131 212 212 THR THR D . n D 1 132 ASP 132 213 213 ASP ASP D . n D 1 133 THR 133 214 214 THR THR D . n D 1 134 ILE 134 215 215 ILE ILE D . n D 1 135 HIS 135 216 216 HIS HIS D . n D 1 136 PRO 136 217 217 PRO PRO D . n D 1 137 THR 137 218 218 THR THR D . n D 1 138 ASN 138 219 219 ASN ASN D . n D 1 139 GLY 139 220 220 GLY GLY D . n D 1 140 GLY 140 221 221 GLY GLY D . n D 1 141 PRO 141 222 222 PRO PRO D . n D 1 142 LEU 142 223 223 LEU LEU D . n D 1 143 ARG 143 224 224 ARG ARG D . n D 1 144 THR 144 225 225 THR THR D . n D 1 145 GLN 145 226 226 GLN GLN D . n D 1 146 ALA 146 227 227 ALA ALA D . n D 1 147 SER 147 228 228 SER SER D . n D 1 148 SER 148 229 229 SER SER D . n D 1 149 CYS 149 230 230 CYS CYS D . n D 1 150 ILE 150 231 231 ILE ILE D . n D 1 151 CYS 151 232 232 CYS CYS D . n D 1 152 ASN 152 233 233 ASN ASN D . n D 1 153 ASP 153 234 234 ASP ASP D . n D 1 154 GLY 154 235 235 GLY GLY D . n D 1 155 THR 155 236 236 THR THR D . n D 1 156 CYS 156 237 237 CYS CYS D . n D 1 157 TYR 157 238 238 TYR TYR D . n D 1 158 THR 158 239 239 THR THR D . n D 1 159 ILE 159 240 240 ILE ILE D . n D 1 160 ILE 160 241 241 ILE ILE D . n D 1 161 ALA 161 242 242 ALA ALA D . n D 1 162 ASP 162 243 243 ASP ASP D . n D 1 163 GLY 163 244 244 GLY GLY D . n D 1 164 THR 164 245 245 THR THR D . n D 1 165 THR 165 246 246 THR THR D . n D 1 166 TYR 166 247 247 TYR TYR D . n D 1 167 THR 167 248 248 THR THR D . n D 1 168 ALA 168 249 249 ALA ALA D . n D 1 169 SER 169 250 250 SER SER D . n D 1 170 SER 170 251 251 SER SER D . n D 1 171 HIS 171 252 252 HIS HIS D . n D 1 172 ARG 172 253 253 ARG ARG D . n D 1 173 LEU 173 254 254 LEU LEU D . n D 1 174 TYR 174 255 255 TYR TYR D . n D 1 175 ARG 175 256 256 ARG ARG D . n D 1 176 LEU 176 257 257 LEU LEU D . n D 1 177 VAL 177 258 258 VAL VAL D . n D 1 178 ASN 178 259 259 ASN ASN D . n D 1 179 GLY 179 260 260 GLY GLY D . n D 1 180 THR 180 261 261 THR THR D . n D 1 181 SER 181 262 262 SER SER D . n D 1 182 ALA 182 263 263 ALA ALA D . n D 1 183 GLY 183 264 264 GLY GLY D . n D 1 184 TRP 184 265 265 TRP TRP D . n D 1 185 LYS 185 266 266 LYS LYS D . n D 1 186 ALA 186 267 267 ALA ALA D . n D 1 187 LEU 187 268 268 LEU LEU D . n D 1 188 ASP 188 269 269 ASP ASP D . n D 1 189 THR 189 270 270 THR THR D . n D 1 190 THR 190 271 271 THR THR D . n D 1 191 GLY 191 272 272 GLY GLY D . n D 1 192 PHE 192 273 273 PHE PHE D . n D 1 193 ASN 193 274 274 ASN ASN D . n D 1 194 PHE 194 275 275 PHE PHE D . n D 1 195 GLU 195 276 276 GLU GLU D . n D 1 196 PHE 196 277 277 PHE PHE D . n D 1 197 PRO 197 278 278 PRO PRO D . n D 1 198 THR 198 279 279 THR THR D . n D 1 199 CYS 199 280 280 CYS CYS D . n D 1 200 TYR 200 281 281 TYR TYR D . n D 1 201 TYR 201 282 282 TYR TYR D . n D 1 202 THR 202 283 283 THR THR D . n D 1 203 SER 203 284 284 SER SER D . n D 1 204 GLY 204 285 285 GLY GLY D . n D 1 205 LYS 205 286 286 LYS LYS D . n D 1 206 VAL 206 287 287 VAL VAL D . n D 1 207 LYS 207 288 288 LYS LYS D . n D 1 208 CYS 208 289 289 CYS CYS D . n D 1 209 THR 209 290 290 THR THR D . n D 1 210 GLY 210 291 291 GLY GLY D . n D 1 211 THR 211 292 292 THR THR D . n D 1 212 ASN 212 293 293 ASN ASN D . n D 1 213 LEU 213 294 294 LEU LEU D . n D 1 214 TRP 214 295 295 TRP TRP D . n D 1 215 ASN 215 296 296 ASN ASN D . n D 1 216 ASP 216 297 297 ASP ASP D . n D 1 217 ALA 217 298 298 ALA ALA D . n D 1 218 LYS 218 299 299 LYS LYS D . n D 1 219 ARG 219 300 300 ARG ARG D . n D 1 220 PRO 220 301 301 PRO PRO D . n D 1 221 PHE 221 302 302 PHE PHE D . n D 1 222 LEU 222 303 303 LEU LEU D . n D 1 223 GLU 223 304 304 GLU GLU D . n D 1 224 PHE 224 305 305 PHE PHE D . n D 1 225 ASP 225 306 306 ASP ASP D . n D 1 226 GLN 226 307 307 GLN GLN D . n D 1 227 SER 227 309 309 SER SER D . n D 1 228 PHE 228 310 310 PHE PHE D . n D 1 229 THR 229 311 311 THR THR D . n D 1 230 TYR 230 312 312 TYR TYR D . n D 1 231 THR 231 313 313 THR THR D . n D 1 232 PHE 232 314 314 PHE PHE D . n D 1 233 LYS 233 315 315 LYS LYS D . n D 1 234 GLU 234 316 316 GLU GLU D . n D 1 235 PRO 235 317 317 PRO PRO D . n D 1 236 CYS 236 318 318 CYS CYS D . n D 1 237 LEU 237 319 319 LEU LEU D . n D 1 238 GLY 238 320 320 GLY GLY D . n D 1 239 PHE 239 321 321 PHE PHE D . n D 1 240 LEU 240 322 322 LEU LEU D . n D 1 241 GLY 241 323 323 GLY GLY D . n D 1 242 ASP 242 324 324 ASP ASP D . n D 1 243 THR 243 325 325 THR THR D . n D 1 244 PRO 244 326 326 PRO PRO D . n D 1 245 ARG 245 327 327 ARG ARG D . n D 1 246 GLY 246 328 328 GLY GLY D . n D 1 247 ILE 247 329 329 ILE ILE D . n D 1 248 ASP 248 330 330 ASP ASP D . n D 1 249 THR 249 333 333 THR THR D . n D 1 250 THR 250 334 334 THR THR D . n D 1 251 ASN 251 335 335 ASN ASN D . n D 1 252 TYR 252 336 336 TYR TYR D . n D 1 253 CYS 253 337 337 CYS CYS D . n D 1 254 ASP 254 339 339 ASP ASP D . n D 1 255 LYS 255 340 340 LYS LYS D . n D 1 256 THR 256 341 341 THR THR D . n D 1 257 THR 257 342 342 THR THR D . n D 1 258 THR 258 343 343 THR THR D . n D 1 259 GLU 259 344 344 GLU GLU D . n D 1 260 GLY 260 345 345 GLY GLY D . n D 1 261 GLU 261 346 346 GLU GLU D . n D 1 262 GLY 262 347 347 GLY GLY D . n D 1 263 GLY 263 348 348 GLY GLY D . n D 1 264 ILE 264 349 349 ILE ILE D . n D 1 265 GLN 265 350 350 GLN GLN D . n D 1 266 GLY 266 351 351 GLY GLY D . n D 1 267 PHE 267 352 352 PHE PHE D . n D 1 268 MET 268 353 353 MET MET D . n D 1 269 ILE 269 354 354 ILE ILE D . n D 1 270 GLU 270 355 355 GLU GLU D . n D 1 271 GLY 271 356 356 GLY GLY D . n D 1 272 SER 272 357 357 SER SER D . n D 1 273 ASN 273 359 359 ASN ASN D . n D 1 274 SER 274 360 360 SER SER D . n D 1 275 TRP 275 361 361 TRP TRP D . n D 1 276 ILE 276 362 362 ILE ILE D . n D 1 277 GLY 277 363 363 GLY GLY D . n D 1 278 ARG 278 364 364 ARG ARG D . n D 1 279 ILE 279 365 365 ILE ILE D . n D 1 280 ILE 280 366 366 ILE ILE D . n D 1 281 ASN 281 367 367 ASN ASN D . n D 1 282 PRO 282 368 368 PRO PRO D . n D 1 283 GLY 283 369 369 GLY GLY D . n D 1 284 SER 284 370 370 SER SER D . n D 1 285 LYS 285 371 371 LYS LYS D . n D 1 286 LYS 286 372 372 LYS LYS D . n D 1 287 GLY 287 373 373 GLY GLY D . n D 1 288 PHE 288 374 374 PHE PHE D . n D 1 289 GLU 289 375 375 GLU GLU D . n D 1 290 ILE 290 376 376 ILE ILE D . n D 1 291 TYR 291 377 377 TYR TYR D . n D 1 292 LYS 292 378 378 LYS LYS D . n D 1 293 PHE 293 379 379 PHE PHE D . n D 1 294 LEU 294 380 380 LEU LEU D . n D 1 295 GLY 295 381 381 GLY GLY D . n D 1 296 THR 296 382 382 THR THR D . n D 1 297 LEU 297 383 383 LEU LEU D . n D 1 298 PHE 298 384 384 PHE PHE D . n D 1 299 SER 299 385 385 SER SER D . n D 1 300 VAL 300 387 387 VAL VAL D . n D 1 301 GLN 301 388 388 GLN GLN D . n D 1 302 THR 302 390 390 THR THR D . n D 1 303 VAL 303 391 391 VAL VAL D . n D 1 304 GLY 304 392 392 GLY GLY D . n D 1 305 ASN 305 392 392 ASN ASN D A n D 1 306 ARG 306 393 393 ARG ARG D . n D 1 307 ASN 307 394 394 ASN ASN D . n D 1 308 TYR 308 395 395 TYR TYR D . n D 1 309 GLN 309 396 396 GLN GLN D . n D 1 310 LEU 310 397 397 LEU LEU D . n D 1 311 LEU 311 398 398 LEU LEU D . n D 1 312 SER 312 399 399 SER SER D . n D 1 313 ASN 313 401 401 ASN ASN D . n D 1 314 SER 314 402 402 SER SER D . n D 1 315 THR 315 403 403 THR THR D . n D 1 316 ILE 316 404 404 ILE ILE D . n D 1 317 GLY 317 405 405 GLY GLY D . n D 1 318 ARG 318 406 406 ARG ARG D . n D 1 319 SER 319 407 407 SER SER D . n D 1 320 GLY 320 408 408 GLY GLY D . n D 1 321 LEU 321 409 409 LEU LEU D . n D 1 322 TYR 322 410 410 TYR TYR D . n D 1 323 GLN 323 411 411 GLN GLN D . n D 1 324 PRO 324 412 412 PRO PRO D . n D 1 325 ALA 325 413 413 ALA ALA D . n D 1 326 TYR 326 413 413 TYR TYR D A n D 1 327 GLU 327 414 414 GLU GLU D . n D 1 328 SER 328 415 415 SER SER D . n D 1 329 ARG 329 415 415 ARG ARG D A n D 1 330 ASP 330 416 416 ASP ASP D . n D 1 331 CYS 331 417 417 CYS CYS D . n D 1 332 GLN 332 418 418 GLN GLN D . n D 1 333 GLU 333 419 419 GLU GLU D . n D 1 334 LEU 334 420 420 LEU LEU D . n D 1 335 CYS 335 421 421 CYS CYS D . n D 1 336 PHE 336 422 422 PHE PHE D . n D 1 337 TRP 337 423 423 TRP TRP D . n D 1 338 ILE 338 424 424 ILE ILE D . n D 1 339 GLU 339 425 425 GLU GLU D . n D 1 340 ILE 340 426 426 ILE ILE D . n D 1 341 ALA 341 427 427 ALA ALA D . n D 1 342 ALA 342 428 428 ALA ALA D . n D 1 343 THR 343 429 429 THR THR D . n D 1 344 THR 344 430 430 THR THR D . n D 1 345 LYS 345 431 431 LYS LYS D . n D 1 346 ALA 346 432 432 ALA ALA D . n D 1 347 GLY 347 433 433 GLY GLY D . n D 1 348 LEU 348 438 438 LEU LEU D . n D 1 349 SER 349 439 439 SER SER D . n D 1 350 SER 350 440 440 SER SER D . n D 1 351 ASN 351 441 441 ASN ASN D . n D 1 352 ASP 352 442 442 ASP ASP D . n D 1 353 LEU 353 443 443 LEU LEU D . n D 1 354 ILE 354 444 444 ILE ILE D . n D 1 355 THR 355 445 445 THR THR D . n D 1 356 PHE 356 446 446 PHE PHE D . n D 1 357 CYS 357 447 447 CYS CYS D . n D 1 358 GLY 358 448 448 GLY GLY D . n D 1 359 THR 359 449 449 THR THR D . n D 1 360 GLY 360 450 450 GLY GLY D . n D 1 361 GLY 361 451 451 GLY GLY D . n D 1 362 SER 362 452 452 SER SER D . n D 1 363 MET 363 453 453 MET MET D . n D 1 364 PRO 364 454 454 PRO PRO D . n D 1 365 ASP 365 455 455 ASP ASP D . n D 1 366 VAL 366 456 456 VAL VAL D . n D 1 367 ASN 367 457 457 ASN ASN D . n D 1 368 TRP 368 458 458 TRP TRP D . n D 1 369 GLY 369 459 459 GLY GLY D . n # 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 A ASN 178 A ASN 259 ? ASN 'GLYCOSYLATION SITE' 2 D ASN 178 D ASN 259 ? ASN 'GLYCOSYLATION SITE' 3 C ASN 313 C ASN 401 ? ASN 'GLYCOSYLATION SITE' 4 B ASN 313 B ASN 401 ? ASN 'GLYCOSYLATION SITE' 5 C ASN 178 C ASN 259 ? ASN 'GLYCOSYLATION SITE' 6 B ASN 178 B ASN 259 ? ASN 'GLYCOSYLATION SITE' # _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 tetrameric _pdbx_struct_assembly.oligomeric_count 4 # _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 # 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)' 13080 ? 1 MORE -39 ? 1 'SSA (A^2)' 47930 ? # _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_struct_conn_angle.id _pdbx_struct_conn_angle.ptnr1_label_atom_id _pdbx_struct_conn_angle.ptnr1_label_alt_id _pdbx_struct_conn_angle.ptnr1_label_asym_id _pdbx_struct_conn_angle.ptnr1_label_comp_id _pdbx_struct_conn_angle.ptnr1_label_seq_id _pdbx_struct_conn_angle.ptnr1_auth_atom_id _pdbx_struct_conn_angle.ptnr1_auth_asym_id _pdbx_struct_conn_angle.ptnr1_auth_comp_id _pdbx_struct_conn_angle.ptnr1_auth_seq_id _pdbx_struct_conn_angle.ptnr1_PDB_ins_code _pdbx_struct_conn_angle.ptnr1_symmetry _pdbx_struct_conn_angle.ptnr2_label_atom_id _pdbx_struct_conn_angle.ptnr2_label_alt_id _pdbx_struct_conn_angle.ptnr2_label_asym_id _pdbx_struct_conn_angle.ptnr2_label_comp_id _pdbx_struct_conn_angle.ptnr2_label_seq_id _pdbx_struct_conn_angle.ptnr2_auth_atom_id _pdbx_struct_conn_angle.ptnr2_auth_asym_id _pdbx_struct_conn_angle.ptnr2_auth_comp_id _pdbx_struct_conn_angle.ptnr2_auth_seq_id _pdbx_struct_conn_angle.ptnr2_PDB_ins_code _pdbx_struct_conn_angle.ptnr2_symmetry _pdbx_struct_conn_angle.ptnr3_label_atom_id _pdbx_struct_conn_angle.ptnr3_label_alt_id _pdbx_struct_conn_angle.ptnr3_label_asym_id _pdbx_struct_conn_angle.ptnr3_label_comp_id _pdbx_struct_conn_angle.ptnr3_label_seq_id _pdbx_struct_conn_angle.ptnr3_auth_atom_id _pdbx_struct_conn_angle.ptnr3_auth_asym_id _pdbx_struct_conn_angle.ptnr3_auth_comp_id _pdbx_struct_conn_angle.ptnr3_auth_seq_id _pdbx_struct_conn_angle.ptnr3_PDB_ins_code _pdbx_struct_conn_angle.ptnr3_symmetry _pdbx_struct_conn_angle.value _pdbx_struct_conn_angle.value_esd 1 O ? D ASN 212 ? D ASN 293 ? 1_555 CA ? Y CA . ? D CA 604 ? 1_555 O ? D ASP 216 ? D ASP 297 ? 1_555 91.9 ? 2 O ? D ASN 212 ? D ASN 293 ? 1_555 CA ? Y CA . ? D CA 604 ? 1_555 OD2 ? D ASP 242 ? D ASP 324 ? 1_555 88.2 ? 3 O ? D ASP 216 ? D ASP 297 ? 1_555 CA ? Y CA . ? D CA 604 ? 1_555 OD2 ? D ASP 242 ? D ASP 324 ? 1_555 96.0 ? 4 O ? D ASN 212 ? D ASN 293 ? 1_555 CA ? Y CA . ? D CA 604 ? 1_555 O ? D GLY 262 ? D GLY 347 ? 1_555 82.5 ? 5 O ? D ASP 216 ? D ASP 297 ? 1_555 CA ? Y CA . ? D CA 604 ? 1_555 O ? D GLY 262 ? D GLY 347 ? 1_555 156.4 ? 6 OD2 ? D ASP 242 ? D ASP 324 ? 1_555 CA ? Y CA . ? D CA 604 ? 1_555 O ? D GLY 262 ? D GLY 347 ? 1_555 106.6 ? 7 O ? D ASN 212 ? D ASN 293 ? 1_555 CA ? Y CA . ? D CA 604 ? 1_555 O ? D GLY 260 ? D GLY 345 ? 1_555 92.8 ? 8 O ? D ASP 216 ? D ASP 297 ? 1_555 CA ? Y CA . ? D CA 604 ? 1_555 O ? D GLY 260 ? D GLY 345 ? 1_555 74.4 ? 9 OD2 ? D ASP 242 ? D ASP 324 ? 1_555 CA ? Y CA . ? D CA 604 ? 1_555 O ? D GLY 260 ? D GLY 345 ? 1_555 170.4 ? 10 O ? D GLY 262 ? D GLY 347 ? 1_555 CA ? Y CA . ? D CA 604 ? 1_555 O ? D GLY 260 ? D GLY 345 ? 1_555 83.1 ? 11 O ? B ASN 212 ? B ASN 293 ? 1_555 CA ? M CA . ? B CA 605 ? 1_555 O ? B GLY 262 ? B GLY 347 ? 1_555 68.0 ? 12 O ? B ASN 212 ? B ASN 293 ? 1_555 CA ? M CA . ? B CA 605 ? 1_555 O ? B ASP 216 ? B ASP 297 ? 1_555 68.0 ? 13 O ? B GLY 262 ? B GLY 347 ? 1_555 CA ? M CA . ? B CA 605 ? 1_555 O ? B ASP 216 ? B ASP 297 ? 1_555 136.0 ? 14 O ? B ASN 212 ? B ASN 293 ? 1_555 CA ? M CA . ? B CA 605 ? 1_555 O ? B GLY 260 ? B GLY 345 ? 1_555 72.2 ? 15 O ? B GLY 262 ? B GLY 347 ? 1_555 CA ? M CA . ? B CA 605 ? 1_555 O ? B GLY 260 ? B GLY 345 ? 1_555 83.0 ? 16 O ? B ASP 216 ? B ASP 297 ? 1_555 CA ? M CA . ? B CA 605 ? 1_555 O ? B GLY 260 ? B GLY 345 ? 1_555 81.7 ? 17 O ? B ASN 212 ? B ASN 293 ? 1_555 CA ? M CA . ? B CA 605 ? 1_555 OD2 ? B ASP 242 ? B ASP 324 ? 1_555 71.4 ? 18 O ? B GLY 262 ? B GLY 347 ? 1_555 CA ? M CA . ? B CA 605 ? 1_555 OD2 ? B ASP 242 ? B ASP 324 ? 1_555 93.1 ? 19 O ? B ASP 216 ? B ASP 297 ? 1_555 CA ? M CA . ? B CA 605 ? 1_555 OD2 ? B ASP 242 ? B ASP 324 ? 1_555 75.1 ? 20 O ? B GLY 260 ? B GLY 345 ? 1_555 CA ? M CA . ? B CA 605 ? 1_555 OD2 ? B ASP 242 ? B ASP 324 ? 1_555 142.0 ? 21 O ? C GLY 262 ? C GLY 347 ? 1_555 CA ? U CA . ? C CA 608 ? 1_555 O ? C ASN 212 ? C ASN 293 ? 1_555 66.4 ? 22 O ? C GLY 262 ? C GLY 347 ? 1_555 CA ? U CA . ? C CA 608 ? 1_555 O ? C ASP 216 ? C ASP 297 ? 1_555 134.1 ? 23 O ? C ASN 212 ? C ASN 293 ? 1_555 CA ? U CA . ? C CA 608 ? 1_555 O ? C ASP 216 ? C ASP 297 ? 1_555 68.1 ? 24 O ? C GLY 262 ? C GLY 347 ? 1_555 CA ? U CA . ? C CA 608 ? 1_555 O ? C GLY 260 ? C GLY 345 ? 1_555 83.9 ? 25 O ? C ASN 212 ? C ASN 293 ? 1_555 CA ? U CA . ? C CA 608 ? 1_555 O ? C GLY 260 ? C GLY 345 ? 1_555 67.2 ? 26 O ? C ASP 216 ? C ASP 297 ? 1_555 CA ? U CA . ? C CA 608 ? 1_555 O ? C GLY 260 ? C GLY 345 ? 1_555 73.6 ? 27 O ? C GLY 262 ? C GLY 347 ? 1_555 CA ? U CA . ? C CA 608 ? 1_555 OD2 ? C ASP 242 ? C ASP 324 ? 1_555 90.6 ? 28 O ? C ASN 212 ? C ASN 293 ? 1_555 CA ? U CA . ? C CA 608 ? 1_555 OD2 ? C ASP 242 ? C ASP 324 ? 1_555 76.0 ? 29 O ? C ASP 216 ? C ASP 297 ? 1_555 CA ? U CA . ? C CA 608 ? 1_555 OD2 ? C ASP 242 ? C ASP 324 ? 1_555 83.9 ? 30 O ? C GLY 260 ? C GLY 345 ? 1_555 CA ? U CA . ? C CA 608 ? 1_555 OD2 ? C ASP 242 ? C ASP 324 ? 1_555 141.8 ? 31 O ? A ASP 216 ? A ASP 297 ? 1_555 CA ? H CA . ? A CA 604 ? 1_555 O ? A ASN 212 ? A ASN 293 ? 1_555 74.7 ? 32 O ? A ASP 216 ? A ASP 297 ? 1_555 CA ? H CA . ? A CA 604 ? 1_555 O ? A GLY 262 ? A GLY 347 ? 1_555 139.8 ? 33 O ? A ASN 212 ? A ASN 293 ? 1_555 CA ? H CA . ? A CA 604 ? 1_555 O ? A GLY 262 ? A GLY 347 ? 1_555 65.1 ? 34 O ? A ASP 216 ? A ASP 297 ? 1_555 CA ? H CA . ? A CA 604 ? 1_555 O ? A GLY 260 ? A GLY 345 ? 1_555 80.9 ? 35 O ? A ASN 212 ? A ASN 293 ? 1_555 CA ? H CA . ? A CA 604 ? 1_555 O ? A GLY 260 ? A GLY 345 ? 1_555 78.6 ? 36 O ? A GLY 262 ? A GLY 347 ? 1_555 CA ? H CA . ? A CA 604 ? 1_555 O ? A GLY 260 ? A GLY 345 ? 1_555 91.0 ? 37 O ? A ASP 216 ? A ASP 297 ? 1_555 CA ? H CA . ? A CA 604 ? 1_555 OD2 ? A ASP 242 ? A ASP 324 ? 1_555 79.3 ? 38 O ? A ASN 212 ? A ASN 293 ? 1_555 CA ? H CA . ? A CA 604 ? 1_555 OD2 ? A ASP 242 ? A ASP 324 ? 1_555 73.1 ? 39 O ? A GLY 262 ? A GLY 347 ? 1_555 CA ? H CA . ? A CA 604 ? 1_555 OD2 ? A ASP 242 ? A ASP 324 ? 1_555 88.9 ? 40 O ? A GLY 260 ? A GLY 345 ? 1_555 CA ? H CA . ? A CA 604 ? 1_555 OD2 ? A ASP 242 ? A ASP 324 ? 1_555 148.8 ? # loop_ _pdbx_audit_revision_history.ordinal _pdbx_audit_revision_history.data_content_type _pdbx_audit_revision_history.major_revision _pdbx_audit_revision_history.minor_revision _pdbx_audit_revision_history.revision_date 1 'Structure model' 1 0 2013-10-23 2 'Structure model' 1 1 2013-11-20 # _pdbx_audit_revision_details.ordinal 1 _pdbx_audit_revision_details.revision_ordinal 1 _pdbx_audit_revision_details.data_content_type 'Structure model' _pdbx_audit_revision_details.provider repository _pdbx_audit_revision_details.type 'Initial release' _pdbx_audit_revision_details.description ? # _pdbx_audit_revision_group.ordinal 1 _pdbx_audit_revision_group.revision_ordinal 2 _pdbx_audit_revision_group.data_content_type 'Structure model' _pdbx_audit_revision_group.group 'Database references' # _pdbx_refine_tls.pdbx_refine_id 'X-RAY DIFFRACTION' _pdbx_refine_tls.id 1 _pdbx_refine_tls.details ? _pdbx_refine_tls.method refined _pdbx_refine_tls.origin_x 98.3731 _pdbx_refine_tls.origin_y -15.8911 _pdbx_refine_tls.origin_z 23.1232 _pdbx_refine_tls.T[1][1] 0.4684 _pdbx_refine_tls.T[2][2] 0.3369 _pdbx_refine_tls.T[3][3] 0.4106 _pdbx_refine_tls.T[1][2] -0.0273 _pdbx_refine_tls.T[1][3] -0.0378 _pdbx_refine_tls.T[2][3] 0.0069 _pdbx_refine_tls.L[1][1] 0.5805 _pdbx_refine_tls.L[2][2] 0.3772 _pdbx_refine_tls.L[3][3] 1.0229 _pdbx_refine_tls.L[1][2] 0.0292 _pdbx_refine_tls.L[1][3] -0.4612 _pdbx_refine_tls.L[2][3] -0.0961 _pdbx_refine_tls.S[1][1] 0.1154 _pdbx_refine_tls.S[1][2] -0.1020 _pdbx_refine_tls.S[1][3] 0.1636 _pdbx_refine_tls.S[2][1] 0.0958 _pdbx_refine_tls.S[2][2] -0.0869 _pdbx_refine_tls.S[2][3] -0.0770 _pdbx_refine_tls.S[3][1] -0.2009 _pdbx_refine_tls.S[3][2] 0.1779 _pdbx_refine_tls.S[3][3] -0.0175 # _pdbx_refine_tls_group.pdbx_refine_id 'X-RAY DIFFRACTION' _pdbx_refine_tls_group.id 1 _pdbx_refine_tls_group.refine_tls_id 1 _pdbx_refine_tls_group.beg_auth_asym_id ? _pdbx_refine_tls_group.beg_auth_seq_id ? _pdbx_refine_tls_group.beg_label_asym_id ? _pdbx_refine_tls_group.beg_label_seq_id ? _pdbx_refine_tls_group.end_auth_asym_id ? _pdbx_refine_tls_group.end_auth_seq_id ? _pdbx_refine_tls_group.end_label_asym_id ? _pdbx_refine_tls_group.end_label_seq_id ? _pdbx_refine_tls_group.selection ? _pdbx_refine_tls_group.selection_details all # loop_ _software.name _software.classification _software.version _software.citation_id _software.pdbx_ordinal HKL-2000 'data collection' . ? 1 PHASER phasing . ? 2 PHENIX refinement '(phenix.refine: 1.7.2_869)' ? 3 HKL-2000 'data reduction' . ? 4 HKL-2000 'data scaling' . ? 5 # 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 CB D CYS 92 ? ? SG D CYS 417 ? ? 2.12 2 1 OE1 D GLN 350 ? ? NH1 D ARG 406 ? ? 2.13 3 1 SG C CYS 183 ? ? CB C CYS 230 ? ? 2.15 4 1 ND2 B ASN 401 ? ? C2 B NAG 603 ? ? 2.15 5 1 O B ASN 120 ? ? NH2 B ARG 406 ? ? 2.15 6 1 NH2 A ARG 393 ? ? OD1 A ASP 455 ? ? 2.17 7 1 O C ASN 120 ? ? NH2 C ARG 406 ? ? 2.19 # 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 TYR A 101 ? ? -171.43 131.00 2 1 LYS A 127 ? ? -146.75 -19.77 3 1 MET A 136 ? ? -102.45 -65.24 4 1 TRP A 295 ? ? -101.18 -67.93 5 1 LYS A 371 ? ? -66.35 53.05 6 1 ARG A 415 A ? -57.86 173.81 7 1 SER B 125 ? ? -114.33 -168.14 8 1 TRP B 295 ? ? -96.87 -69.24 9 1 ASP B 297 ? ? -160.64 117.64 10 1 THR B 333 ? ? -119.49 -166.02 11 1 LYS B 371 ? ? -62.13 44.41 12 1 ASN B 392 A ? -112.51 -83.31 13 1 GLU B 414 ? ? 178.59 133.58 14 1 CYS B 417 ? ? -177.64 140.73 15 1 ASP B 442 ? ? -153.43 -155.13 16 1 SER C 125 ? ? -100.07 -160.72 17 1 SER C 150 ? ? -166.25 -101.49 18 1 GLN C 152 ? ? -107.39 -160.87 19 1 PHE C 187 ? ? -100.54 -64.30 20 1 ASN C 219 ? ? -89.70 41.58 21 1 TRP C 295 ? ? -107.02 -66.59 22 1 ASN C 296 ? ? -142.80 25.72 23 1 VAL C 391 ? ? -91.43 -81.43 24 1 ASN C 392 A ? -120.79 -50.52 25 1 SER C 399 ? ? -139.45 -45.40 26 1 ALA C 413 ? ? -143.53 42.66 27 1 TYR C 413 A ? -108.13 40.27 28 1 ASP C 442 ? ? -141.96 -147.20 29 1 THR D 83 ? ? 78.55 150.45 30 1 SER D 125 ? ? -104.70 -157.13 31 1 LYS D 127 ? ? -145.44 -20.69 32 1 MET D 136 ? ? -141.15 -29.12 33 1 ASN D 219 ? ? -76.33 47.59 34 1 TRP D 295 ? ? -101.83 -84.96 35 1 PHE D 310 ? ? 68.84 -1.24 36 1 SER D 357 ? ? -54.37 -73.91 37 1 LYS D 371 ? ? -84.05 46.69 38 1 VAL D 391 ? ? -65.54 -84.44 39 1 ASN D 392 A ? -92.11 -111.00 40 1 GLN D 396 ? ? -100.76 73.66 41 1 SER D 399 ? ? -129.04 -74.14 42 1 ALA D 413 ? ? -109.98 69.75 43 1 GLU D 414 ? ? -119.66 -159.32 44 1 SER D 415 ? ? -164.01 12.31 45 1 SER D 440 ? ? -160.61 -166.25 46 1 ASP D 442 ? ? -151.82 -156.91 # 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 ASN A 441 ? ? ASP A 442 ? ? 146.70 2 1 THR B 390 ? ? VAL B 391 ? ? -148.93 3 1 TYR B 413 A ? GLU B 414 ? ? -149.66 4 1 GLU B 414 ? ? SER B 415 ? ? 146.02 5 1 ASN B 441 ? ? ASP B 442 ? ? 143.60 6 1 ASN C 441 ? ? ASP C 442 ? ? 141.04 7 1 SER D 415 ? ? ARG D 415 A ? -144.15 8 1 ASN D 441 ? ? ASP D 442 ? ? 149.09 # 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 GLY 77 ? A GLY 1 2 1 Y 1 A SER 78 ? A SER 2 3 1 Y 1 A PRO 79 ? A PRO 3 4 1 Y 1 A SER 80 ? A SER 4 5 1 Y 1 A ARG 81 ? A ARG 5 6 1 Y 1 A GLY 139 ? A GLY 63 7 1 Y 1 A THR 140 ? A THR 64 8 1 Y 1 A THR 141 ? A THR 65 9 1 Y 1 A THR 142 ? A THR 66 10 1 Y 1 A ASN 143 ? A ASN 67 11 1 Y 1 A PHE 144 ? A PHE 68 12 1 Y 1 A ALA 145 ? A ALA 69 13 1 Y 1 A ASP 146 ? A ASP 70 14 1 Y 1 A LEU 147 ? A LEU 71 15 1 Y 1 A ILE 148 ? A ILE 72 16 1 Y 1 B GLY 77 ? B GLY 1 17 1 Y 1 B SER 78 ? B SER 2 18 1 Y 1 B PRO 79 ? B PRO 3 19 1 Y 1 B SER 80 ? B SER 4 20 1 Y 1 B ARG 81 ? B ARG 5 21 1 Y 1 B GLY 139 ? B GLY 63 22 1 Y 1 B THR 140 ? B THR 64 23 1 Y 1 B THR 141 ? B THR 65 24 1 Y 1 B THR 142 ? B THR 66 25 1 Y 1 B ASN 143 ? B ASN 67 26 1 Y 1 B PHE 144 ? B PHE 68 27 1 Y 1 B ALA 145 ? B ALA 69 28 1 Y 1 B ASP 146 ? B ASP 70 29 1 Y 1 B LEU 147 ? B LEU 71 30 1 Y 1 B ILE 148 ? B ILE 72 31 1 Y 1 C GLY 77 ? C GLY 1 32 1 Y 1 C SER 78 ? C SER 2 33 1 Y 1 C PRO 79 ? C PRO 3 34 1 Y 1 C SER 80 ? C SER 4 35 1 Y 1 C ARG 81 ? C ARG 5 36 1 Y 1 C THR 140 ? C THR 64 37 1 Y 1 C THR 141 ? C THR 65 38 1 Y 1 C THR 142 ? C THR 66 39 1 Y 1 C ASN 143 ? C ASN 67 40 1 Y 1 C PHE 144 ? C PHE 68 41 1 Y 1 C ALA 145 ? C ALA 69 42 1 Y 1 C ASP 146 ? C ASP 70 43 1 Y 1 C LEU 147 ? C LEU 71 44 1 Y 1 C ILE 148 ? C ILE 72 45 1 Y 1 D GLY 77 ? D GLY 1 46 1 Y 1 D SER 78 ? D SER 2 47 1 Y 1 D PRO 79 ? D PRO 3 48 1 Y 1 D SER 80 ? D SER 4 49 1 Y 1 D ARG 81 ? D ARG 5 50 1 Y 1 D GLY 139 ? D GLY 63 51 1 Y 1 D THR 140 ? D THR 64 52 1 Y 1 D THR 141 ? D THR 65 53 1 Y 1 D THR 142 ? D THR 66 54 1 Y 1 D ASN 143 ? D ASN 67 55 1 Y 1 D PHE 144 ? D PHE 68 56 1 Y 1 D ALA 145 ? D ALA 69 57 1 Y 1 D ASP 146 ? D ASP 70 58 1 Y 1 D LEU 147 ? D LEU 71 59 1 Y 1 D ILE 148 ? D ILE 72 # loop_ _pdbx_entity_nonpoly.entity_id _pdbx_entity_nonpoly.name _pdbx_entity_nonpoly.comp_id 2 N-ACETYL-D-GLUCOSAMINE NAG 3 BETA-D-MANNOSE BMA 4 'CALCIUM ION' CA 5 ALPHA-L-FUCOSE FUC 6 ALPHA-D-MANNOSE MAN 7 water HOH # 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 E 2 NAG 1 601 601 NAG NAG A . F 2 NAG 2 602 602 NAG NAG A . G 3 BMA 3 603 603 BMA MAN A . H 4 CA 1 604 901 CA CA A . I 2 NAG 1 601 601 NAG NAG B . J 2 NAG 2 602 602 NAG NAG B . K 2 NAG 1 603 701 NAG NAG B . L 2 NAG 2 604 702 NAG NAG B . M 4 CA 1 605 901 CA CA B . N 2 NAG 1 601 601 NAG NAG C . O 2 NAG 2 602 602 NAG NAG C . P 2 NAG 1 603 701 NAG NAG C . Q 5 FUC 2 604 701 FUC FUC C . R 2 NAG 3 605 702 NAG NAG C . S 3 BMA 4 606 703 BMA MAN C . T 6 MAN 5 607 704 MAN MAN C . U 4 CA 1 608 901 CA CA C . V 2 NAG 1 601 601 NAG NAG D . W 2 NAG 2 602 602 NAG NAG D . X 3 BMA 3 603 603 BMA MAN D . Y 4 CA 1 604 901 CA CA D . Z 7 HOH 1 701 1 HOH HOH A . Z 7 HOH 2 702 4 HOH HOH A . Z 7 HOH 3 703 5 HOH HOH A . Z 7 HOH 4 704 6 HOH HOH A . Z 7 HOH 5 705 7 HOH HOH A . Z 7 HOH 6 706 8 HOH HOH A . Z 7 HOH 7 707 10 HOH HOH A . Z 7 HOH 8 708 11 HOH HOH A . Z 7 HOH 9 709 13 HOH HOH A . Z 7 HOH 10 710 14 HOH HOH A . Z 7 HOH 11 711 15 HOH HOH A . Z 7 HOH 12 712 16 HOH HOH A . Z 7 HOH 13 713 19 HOH HOH A . Z 7 HOH 14 714 22 HOH HOH A . Z 7 HOH 15 715 28 HOH HOH A . Z 7 HOH 16 716 29 HOH HOH A . Z 7 HOH 17 717 31 HOH HOH A . Z 7 HOH 18 718 32 HOH HOH A . Z 7 HOH 19 719 34 HOH HOH A . Z 7 HOH 20 720 37 HOH HOH A . Z 7 HOH 21 721 39 HOH HOH A . Z 7 HOH 22 722 42 HOH HOH A . Z 7 HOH 23 723 43 HOH HOH A . Z 7 HOH 24 724 46 HOH HOH A . Z 7 HOH 25 725 49 HOH HOH A . Z 7 HOH 26 726 50 HOH HOH A . Z 7 HOH 27 727 52 HOH HOH A . Z 7 HOH 28 728 53 HOH HOH A . Z 7 HOH 29 729 55 HOH HOH A . Z 7 HOH 30 730 56 HOH HOH A . Z 7 HOH 31 731 57 HOH HOH A . Z 7 HOH 32 732 62 HOH HOH A . Z 7 HOH 33 733 65 HOH HOH A . Z 7 HOH 34 734 67 HOH HOH A . Z 7 HOH 35 735 68 HOH HOH A . Z 7 HOH 36 736 69 HOH HOH A . Z 7 HOH 37 737 70 HOH HOH A . Z 7 HOH 38 738 73 HOH HOH A . Z 7 HOH 39 739 75 HOH HOH A . Z 7 HOH 40 740 76 HOH HOH A . Z 7 HOH 41 741 77 HOH HOH A . Z 7 HOH 42 742 79 HOH HOH A . Z 7 HOH 43 743 82 HOH HOH A . Z 7 HOH 44 744 84 HOH HOH A . Z 7 HOH 45 745 86 HOH HOH A . Z 7 HOH 46 746 89 HOH HOH A . Z 7 HOH 47 747 90 HOH HOH A . Z 7 HOH 48 748 92 HOH HOH A . Z 7 HOH 49 749 97 HOH HOH A . Z 7 HOH 50 750 98 HOH HOH A . Z 7 HOH 51 751 99 HOH HOH A . Z 7 HOH 52 752 100 HOH HOH A . Z 7 HOH 53 753 101 HOH HOH A . Z 7 HOH 54 754 107 HOH HOH A . Z 7 HOH 55 755 109 HOH HOH A . Z 7 HOH 56 756 116 HOH HOH A . Z 7 HOH 57 757 117 HOH HOH A . AA 7 HOH 1 701 20 HOH HOH B . AA 7 HOH 2 702 21 HOH HOH B . AA 7 HOH 3 703 25 HOH HOH B . AA 7 HOH 4 704 26 HOH HOH B . AA 7 HOH 5 705 27 HOH HOH B . AA 7 HOH 6 706 33 HOH HOH B . AA 7 HOH 7 707 36 HOH HOH B . AA 7 HOH 8 708 40 HOH HOH B . AA 7 HOH 9 709 41 HOH HOH B . AA 7 HOH 10 710 51 HOH HOH B . AA 7 HOH 11 711 58 HOH HOH B . AA 7 HOH 12 712 60 HOH HOH B . AA 7 HOH 13 713 61 HOH HOH B . AA 7 HOH 14 714 66 HOH HOH B . AA 7 HOH 15 715 71 HOH HOH B . AA 7 HOH 16 716 72 HOH HOH B . AA 7 HOH 17 717 80 HOH HOH B . AA 7 HOH 18 718 91 HOH HOH B . AA 7 HOH 19 719 94 HOH HOH B . AA 7 HOH 20 720 95 HOH HOH B . AA 7 HOH 21 721 103 HOH HOH B . AA 7 HOH 22 722 104 HOH HOH B . AA 7 HOH 23 723 105 HOH HOH B . AA 7 HOH 24 724 108 HOH HOH B . AA 7 HOH 25 725 111 HOH HOH B . AA 7 HOH 26 726 112 HOH HOH B . AA 7 HOH 27 727 115 HOH HOH B . BA 7 HOH 1 701 2 HOH HOH C . BA 7 HOH 2 702 9 HOH HOH C . BA 7 HOH 3 703 12 HOH HOH C . BA 7 HOH 4 704 17 HOH HOH C . BA 7 HOH 5 705 18 HOH HOH C . BA 7 HOH 6 706 23 HOH HOH C . BA 7 HOH 7 707 24 HOH HOH C . BA 7 HOH 8 708 30 HOH HOH C . BA 7 HOH 9 709 35 HOH HOH C . BA 7 HOH 10 710 38 HOH HOH C . BA 7 HOH 11 711 48 HOH HOH C . BA 7 HOH 12 712 54 HOH HOH C . BA 7 HOH 13 713 59 HOH HOH C . BA 7 HOH 14 714 63 HOH HOH C . BA 7 HOH 15 715 64 HOH HOH C . BA 7 HOH 16 716 74 HOH HOH C . BA 7 HOH 17 717 78 HOH HOH C . BA 7 HOH 18 718 81 HOH HOH C . BA 7 HOH 19 719 83 HOH HOH C . BA 7 HOH 20 720 87 HOH HOH C . BA 7 HOH 21 721 88 HOH HOH C . BA 7 HOH 22 722 93 HOH HOH C . BA 7 HOH 23 723 102 HOH HOH C . BA 7 HOH 24 724 106 HOH HOH C . BA 7 HOH 25 725 110 HOH HOH C . CA 7 HOH 1 701 3 HOH HOH D . CA 7 HOH 2 702 44 HOH HOH D . CA 7 HOH 3 703 45 HOH HOH D . CA 7 HOH 4 704 47 HOH HOH D . CA 7 HOH 5 705 85 HOH HOH D . CA 7 HOH 6 706 96 HOH HOH D . CA 7 HOH 7 707 113 HOH HOH D . CA 7 HOH 8 708 114 HOH HOH D . #