data_3JXA # _entry.id 3JXA # _audit_conform.dict_name mmcif_pdbx.dic _audit_conform.dict_version 5.287 _audit_conform.dict_location http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic # loop_ _database_2.database_id _database_2.database_code PDB 3JXA RCSB RCSB055275 WWPDB D_1000055275 # loop_ _pdbx_database_related.db_name _pdbx_database_related.db_id _pdbx_database_related.details _pdbx_database_related.content_type PDB 3JXF . unspecified PDB 3JXG . unspecified PDB 3JXH . unspecified # _pdbx_database_status.entry_id 3JXA _pdbx_database_status.deposit_site RCSB _pdbx_database_status.process_site RCSB _pdbx_database_status.recvd_initial_deposition_date 2009-09-18 _pdbx_database_status.status_code REL _pdbx_database_status.status_code_sf REL _pdbx_database_status.status_code_mr ? _pdbx_database_status.SG_entry ? _pdbx_database_status.pdb_format_compatible Y _pdbx_database_status.status_code_cs ? _pdbx_database_status.methods_development_category ? # _audit_author.name 'Bouyain, S.' _audit_author.pdbx_ordinal 1 # _citation.id primary _citation.title 'The protein tyrosine phosphatases PTPRZ and PTPRG bind to distinct members of the contactin family of neural recognition molecules.' _citation.journal_abbrev Proc.Natl.Acad.Sci.USA _citation.journal_volume 107 _citation.page_first 2443 _citation.page_last 2448 _citation.year 2010 _citation.journal_id_ASTM PNASA6 _citation.country US _citation.journal_id_ISSN 0027-8424 _citation.journal_id_CSD 0040 _citation.book_publisher ? _citation.pdbx_database_id_PubMed 20133774 _citation.pdbx_database_id_DOI 10.1073/pnas.0911235107 # loop_ _citation_author.citation_id _citation_author.name _citation_author.ordinal primary 'Bouyain, S.' 1 primary 'Watkins, D.J.' 2 # _cell.entry_id 3JXA _cell.length_a 281.728 _cell.length_b 40.431 _cell.length_c 95.076 _cell.angle_alpha 90.00 _cell.angle_beta 103.32 _cell.angle_gamma 90.00 _cell.Z_PDB 8 _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 3JXA _symmetry.space_group_name_H-M 'C 1 2 1' _symmetry.pdbx_full_space_group_name_H-M ? _symmetry.cell_setting ? _symmetry.Int_Tables_number 5 _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 'Contactin 4' 42862.520 2 ? ? 'Ig 1-4 fragment (UNP residues 25-404)' ? 2 non-polymer man N-ACETYL-D-GLUCOSAMINE 221.208 5 ? ? ? ? 3 non-polymer man '2-(ACETYLAMINO)-2-DEOXY-A-D-GLUCOPYRANOSE' 221.208 3 ? ? ? ? 4 water nat water 18.015 187 ? ? ? ? # _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 ;PGSGPVFVQEPSHVMFPLDSEEKKVKLSCEVKGNPKPHIRWKLNGTDVDIGMDFRYSVVDGSLLINNPNKTQDAGTYQCI ATNSFGTIVSREAKLQFAYLENFKTRTRSTVSVRRGQGMVLLCGPPPHSGELSYAWIFNEYPSYQDNRRFVSQETGNLYI AKVEKSDVGNYTCVVTNTVTNHKVLGPPTPLILRNDGVMGEYEPKIEVQFPETVPAEKGTTVKLECFALGNPVPTILWRR ADGKPIARKARRHKSNGILEIPNFQQEDAGSYECVAENSRGKNVAKGQLTFYAQPNWVQIINDIHVAMEESVFWECKANG RPKPTYRWLKNGDPLLTRDRIQIEQGTLNITIVNLSDAGMYQCVAENKHGVIFSSAELSVIAE ; _entity_poly.pdbx_seq_one_letter_code_can ;PGSGPVFVQEPSHVMFPLDSEEKKVKLSCEVKGNPKPHIRWKLNGTDVDIGMDFRYSVVDGSLLINNPNKTQDAGTYQCI ATNSFGTIVSREAKLQFAYLENFKTRTRSTVSVRRGQGMVLLCGPPPHSGELSYAWIFNEYPSYQDNRRFVSQETGNLYI AKVEKSDVGNYTCVVTNTVTNHKVLGPPTPLILRNDGVMGEYEPKIEVQFPETVPAEKGTTVKLECFALGNPVPTILWRR ADGKPIARKARRHKSNGILEIPNFQQEDAGSYECVAENSRGKNVAKGQLTFYAQPNWVQIINDIHVAMEESVFWECKANG RPKPTYRWLKNGDPLLTRDRIQIEQGTLNITIVNLSDAGMYQCVAENKHGVIFSSAELSVIAE ; _entity_poly.pdbx_strand_id A,B _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 PRO n 1 2 GLY n 1 3 SER n 1 4 GLY n 1 5 PRO n 1 6 VAL n 1 7 PHE n 1 8 VAL n 1 9 GLN n 1 10 GLU n 1 11 PRO n 1 12 SER n 1 13 HIS n 1 14 VAL n 1 15 MET n 1 16 PHE n 1 17 PRO n 1 18 LEU n 1 19 ASP n 1 20 SER n 1 21 GLU n 1 22 GLU n 1 23 LYS n 1 24 LYS n 1 25 VAL n 1 26 LYS n 1 27 LEU n 1 28 SER n 1 29 CYS n 1 30 GLU n 1 31 VAL n 1 32 LYS n 1 33 GLY n 1 34 ASN n 1 35 PRO n 1 36 LYS n 1 37 PRO n 1 38 HIS n 1 39 ILE n 1 40 ARG n 1 41 TRP n 1 42 LYS n 1 43 LEU n 1 44 ASN n 1 45 GLY n 1 46 THR n 1 47 ASP n 1 48 VAL n 1 49 ASP n 1 50 ILE n 1 51 GLY n 1 52 MET n 1 53 ASP n 1 54 PHE n 1 55 ARG n 1 56 TYR n 1 57 SER n 1 58 VAL n 1 59 VAL n 1 60 ASP n 1 61 GLY n 1 62 SER n 1 63 LEU n 1 64 LEU n 1 65 ILE n 1 66 ASN n 1 67 ASN n 1 68 PRO n 1 69 ASN n 1 70 LYS n 1 71 THR n 1 72 GLN n 1 73 ASP n 1 74 ALA n 1 75 GLY n 1 76 THR n 1 77 TYR n 1 78 GLN n 1 79 CYS n 1 80 ILE n 1 81 ALA n 1 82 THR n 1 83 ASN n 1 84 SER n 1 85 PHE n 1 86 GLY n 1 87 THR n 1 88 ILE n 1 89 VAL n 1 90 SER n 1 91 ARG n 1 92 GLU n 1 93 ALA n 1 94 LYS n 1 95 LEU n 1 96 GLN n 1 97 PHE n 1 98 ALA n 1 99 TYR n 1 100 LEU n 1 101 GLU n 1 102 ASN n 1 103 PHE n 1 104 LYS n 1 105 THR n 1 106 ARG n 1 107 THR n 1 108 ARG n 1 109 SER n 1 110 THR n 1 111 VAL n 1 112 SER n 1 113 VAL n 1 114 ARG n 1 115 ARG n 1 116 GLY n 1 117 GLN n 1 118 GLY n 1 119 MET n 1 120 VAL n 1 121 LEU n 1 122 LEU n 1 123 CYS n 1 124 GLY n 1 125 PRO n 1 126 PRO n 1 127 PRO n 1 128 HIS n 1 129 SER n 1 130 GLY n 1 131 GLU n 1 132 LEU n 1 133 SER n 1 134 TYR n 1 135 ALA n 1 136 TRP n 1 137 ILE n 1 138 PHE n 1 139 ASN n 1 140 GLU n 1 141 TYR n 1 142 PRO n 1 143 SER n 1 144 TYR n 1 145 GLN n 1 146 ASP n 1 147 ASN n 1 148 ARG n 1 149 ARG n 1 150 PHE n 1 151 VAL n 1 152 SER n 1 153 GLN n 1 154 GLU n 1 155 THR n 1 156 GLY n 1 157 ASN n 1 158 LEU n 1 159 TYR n 1 160 ILE n 1 161 ALA n 1 162 LYS n 1 163 VAL n 1 164 GLU n 1 165 LYS n 1 166 SER n 1 167 ASP n 1 168 VAL n 1 169 GLY n 1 170 ASN n 1 171 TYR n 1 172 THR n 1 173 CYS n 1 174 VAL n 1 175 VAL n 1 176 THR n 1 177 ASN n 1 178 THR n 1 179 VAL n 1 180 THR n 1 181 ASN n 1 182 HIS n 1 183 LYS n 1 184 VAL n 1 185 LEU n 1 186 GLY n 1 187 PRO n 1 188 PRO n 1 189 THR n 1 190 PRO n 1 191 LEU n 1 192 ILE n 1 193 LEU n 1 194 ARG n 1 195 ASN n 1 196 ASP n 1 197 GLY n 1 198 VAL n 1 199 MET n 1 200 GLY n 1 201 GLU n 1 202 TYR n 1 203 GLU n 1 204 PRO n 1 205 LYS n 1 206 ILE n 1 207 GLU n 1 208 VAL n 1 209 GLN n 1 210 PHE n 1 211 PRO n 1 212 GLU n 1 213 THR n 1 214 VAL n 1 215 PRO n 1 216 ALA n 1 217 GLU n 1 218 LYS n 1 219 GLY n 1 220 THR n 1 221 THR n 1 222 VAL n 1 223 LYS n 1 224 LEU n 1 225 GLU n 1 226 CYS n 1 227 PHE n 1 228 ALA n 1 229 LEU n 1 230 GLY n 1 231 ASN n 1 232 PRO n 1 233 VAL n 1 234 PRO n 1 235 THR n 1 236 ILE n 1 237 LEU n 1 238 TRP n 1 239 ARG n 1 240 ARG n 1 241 ALA n 1 242 ASP n 1 243 GLY n 1 244 LYS n 1 245 PRO n 1 246 ILE n 1 247 ALA n 1 248 ARG n 1 249 LYS n 1 250 ALA n 1 251 ARG n 1 252 ARG n 1 253 HIS n 1 254 LYS n 1 255 SER n 1 256 ASN n 1 257 GLY n 1 258 ILE n 1 259 LEU n 1 260 GLU n 1 261 ILE n 1 262 PRO n 1 263 ASN n 1 264 PHE n 1 265 GLN n 1 266 GLN n 1 267 GLU n 1 268 ASP n 1 269 ALA n 1 270 GLY n 1 271 SER n 1 272 TYR n 1 273 GLU n 1 274 CYS n 1 275 VAL n 1 276 ALA n 1 277 GLU n 1 278 ASN n 1 279 SER n 1 280 ARG n 1 281 GLY n 1 282 LYS n 1 283 ASN n 1 284 VAL n 1 285 ALA n 1 286 LYS n 1 287 GLY n 1 288 GLN n 1 289 LEU n 1 290 THR n 1 291 PHE n 1 292 TYR n 1 293 ALA n 1 294 GLN n 1 295 PRO n 1 296 ASN n 1 297 TRP n 1 298 VAL n 1 299 GLN n 1 300 ILE n 1 301 ILE n 1 302 ASN n 1 303 ASP n 1 304 ILE n 1 305 HIS n 1 306 VAL n 1 307 ALA n 1 308 MET n 1 309 GLU n 1 310 GLU n 1 311 SER n 1 312 VAL n 1 313 PHE n 1 314 TRP n 1 315 GLU n 1 316 CYS n 1 317 LYS n 1 318 ALA n 1 319 ASN n 1 320 GLY n 1 321 ARG n 1 322 PRO n 1 323 LYS n 1 324 PRO n 1 325 THR n 1 326 TYR n 1 327 ARG n 1 328 TRP n 1 329 LEU n 1 330 LYS n 1 331 ASN n 1 332 GLY n 1 333 ASP n 1 334 PRO n 1 335 LEU n 1 336 LEU n 1 337 THR n 1 338 ARG n 1 339 ASP n 1 340 ARG n 1 341 ILE n 1 342 GLN n 1 343 ILE n 1 344 GLU n 1 345 GLN n 1 346 GLY n 1 347 THR n 1 348 LEU n 1 349 ASN n 1 350 ILE n 1 351 THR n 1 352 ILE n 1 353 VAL n 1 354 ASN n 1 355 LEU n 1 356 SER n 1 357 ASP n 1 358 ALA n 1 359 GLY n 1 360 MET n 1 361 TYR n 1 362 GLN n 1 363 CYS n 1 364 VAL n 1 365 ALA n 1 366 GLU n 1 367 ASN n 1 368 LYS n 1 369 HIS n 1 370 GLY n 1 371 VAL n 1 372 ILE n 1 373 PHE n 1 374 SER n 1 375 SER n 1 376 ALA n 1 377 GLU n 1 378 LEU n 1 379 SER n 1 380 VAL n 1 381 ILE n 1 382 ALA n 1 383 GLU 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 mouse _entity_src_gen.gene_src_genus ? _entity_src_gen.pdbx_gene_src_gene Cntn4 _entity_src_gen.gene_src_species ? _entity_src_gen.gene_src_strain ? _entity_src_gen.gene_src_tissue ? _entity_src_gen.gene_src_tissue_fraction ? _entity_src_gen.gene_src_details ? _entity_src_gen.pdbx_gene_src_fragment ? _entity_src_gen.pdbx_gene_src_scientific_name 'Mus musculus' _entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id 10090 _entity_src_gen.pdbx_gene_src_variant ? _entity_src_gen.pdbx_gene_src_cell_line ? _entity_src_gen.pdbx_gene_src_atcc ? _entity_src_gen.pdbx_gene_src_organ ? _entity_src_gen.pdbx_gene_src_organelle ? _entity_src_gen.pdbx_gene_src_cell ? _entity_src_gen.pdbx_gene_src_cellular_location ? _entity_src_gen.host_org_common_name ? _entity_src_gen.pdbx_host_org_scientific_name 'Homo Sapiens' _entity_src_gen.pdbx_host_org_ncbi_taxonomy_id 9606 _entity_src_gen.host_org_genus ? _entity_src_gen.pdbx_host_org_gene ? _entity_src_gen.pdbx_host_org_organ ? _entity_src_gen.host_org_species ? _entity_src_gen.pdbx_host_org_tissue ? _entity_src_gen.pdbx_host_org_tissue_fraction ? _entity_src_gen.pdbx_host_org_strain ? _entity_src_gen.pdbx_host_org_variant ? _entity_src_gen.pdbx_host_org_cell_line ? _entity_src_gen.pdbx_host_org_atcc ? _entity_src_gen.pdbx_host_org_culture_collection ? _entity_src_gen.pdbx_host_org_cell ? _entity_src_gen.pdbx_host_org_organelle ? _entity_src_gen.pdbx_host_org_cellular_location ? _entity_src_gen.pdbx_host_org_vector_type Plasmid _entity_src_gen.pdbx_host_org_vector ? _entity_src_gen.host_org_details ? _entity_src_gen.expression_system_id ? _entity_src_gen.plasmid_name pSGHP1 _entity_src_gen.plasmid_details ? _entity_src_gen.pdbx_description ? # _struct_ref.id 1 _struct_ref.db_name UNP _struct_ref.db_code Q14BL8_MOUSE _struct_ref.pdbx_db_accession Q14BL8 _struct_ref.entity_id 1 _struct_ref.pdbx_seq_one_letter_code ;GPVFVQEPSHVMFPLDSEEKKVKLSCEVKGNPKPHIRWKLNGTDVDIGMDFRYSVVDGSLLINNPNKTQDAGTYQCIATN SFGTIVSREAKLQFAYLENFKTRTRSTVSVRRGQGMVLLCGPPPHSGELSYAWIFNEYPSYQDNRRFVSQETGNLYIAKV EKSDVGNYTCVVTNTVTNHKVLGPPTPLILRNDGVMGEYEPKIEVQFPETVPAEKGTTVKLECFALGNPVPTILWRRADG KPIARKARRHKSNGILEIPNFQQEDAGSYECVAENSRGKNVAKGQLTFYAQPNWVQIINDIHVAMEESVFWECKANGRPK PTYRWLKNGDPLLTRDRIQIEQGTLNITIVNLSDAGMYQCVAENKHGVIFSSAELSVIAE ; _struct_ref.pdbx_align_begin 25 _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 3JXA A 4 ? 383 ? Q14BL8 25 ? 404 ? 25 404 2 1 3JXA B 4 ? 383 ? Q14BL8 25 ? 404 ? 25 404 # loop_ _struct_ref_seq_dif.align_id _struct_ref_seq_dif.pdbx_pdb_id_code _struct_ref_seq_dif.mon_id _struct_ref_seq_dif.pdbx_pdb_strand_id _struct_ref_seq_dif.seq_num _struct_ref_seq_dif.pdbx_pdb_ins_code _struct_ref_seq_dif.pdbx_seq_db_name _struct_ref_seq_dif.pdbx_seq_db_accession_code _struct_ref_seq_dif.db_mon_id _struct_ref_seq_dif.pdbx_seq_db_seq_num _struct_ref_seq_dif.details _struct_ref_seq_dif.pdbx_auth_seq_num _struct_ref_seq_dif.pdbx_ordinal 1 3JXA PRO A 1 ? UNP Q14BL8 ? ? 'EXPRESSION TAG' 22 1 1 3JXA GLY A 2 ? UNP Q14BL8 ? ? 'EXPRESSION TAG' 23 2 1 3JXA SER A 3 ? UNP Q14BL8 ? ? 'EXPRESSION TAG' 24 3 2 3JXA PRO B 1 ? UNP Q14BL8 ? ? 'EXPRESSION TAG' 22 4 2 3JXA GLY B 2 ? UNP Q14BL8 ? ? 'EXPRESSION TAG' 23 5 2 3JXA SER B 3 ? UNP Q14BL8 ? ? 'EXPRESSION TAG' 24 6 # loop_ _chem_comp.id _chem_comp.type _chem_comp.mon_nstd_flag _chem_comp.name _chem_comp.pdbx_synonyms _chem_comp.formula _chem_comp.formula_weight ALA 'L-peptide linking' y ALANINE ? 'C3 H7 N O2' 89.093 ARG 'L-peptide linking' y ARGININE ? 'C6 H15 N4 O2 1' 175.209 ASN 'L-peptide linking' y ASPARAGINE ? 'C4 H8 N2 O3' 132.118 ASP 'L-peptide linking' y 'ASPARTIC ACID' ? 'C4 H7 N O4' 133.103 CYS 'L-peptide linking' y CYSTEINE ? 'C3 H7 N O2 S' 121.158 GLN 'L-peptide linking' y GLUTAMINE ? 'C5 H10 N2 O3' 146.144 GLU 'L-peptide linking' y 'GLUTAMIC ACID' ? 'C5 H9 N O4' 147.129 GLY 'peptide linking' y GLYCINE ? 'C2 H5 N O2' 75.067 HIS 'L-peptide linking' y HISTIDINE ? 'C6 H10 N3 O2 1' 156.162 HOH non-polymer . WATER ? 'H2 O' 18.015 ILE 'L-peptide linking' y ISOLEUCINE ? 'C6 H13 N O2' 131.173 LEU 'L-peptide linking' y LEUCINE ? 'C6 H13 N O2' 131.173 LYS 'L-peptide linking' y LYSINE ? 'C6 H15 N2 O2 1' 147.195 MET 'L-peptide linking' y METHIONINE ? 'C5 H11 N O2 S' 149.211 NAG D-saccharide . N-ACETYL-D-GLUCOSAMINE ? 'C8 H15 N O6' 221.208 NDG D-saccharide . '2-(ACETYLAMINO)-2-DEOXY-A-D-GLUCOPYRANOSE' ? '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 3JXA _exptl.method 'X-RAY DIFFRACTION' _exptl.crystals_number 1 # _exptl_crystal.id 1 _exptl_crystal.density_meas ? _exptl_crystal.density_Matthews 3.07 _exptl_crystal.density_percent_sol 59.98 _exptl_crystal.description ? _exptl_crystal.F_000 ? _exptl_crystal.preparation ? # _exptl_crystal_grow.crystal_id 1 _exptl_crystal_grow.method 'VAPOR DIFFUSION, HANGING DROP' _exptl_crystal_grow.temp 293 _exptl_crystal_grow.temp_details ? _exptl_crystal_grow.pH 5.8 _exptl_crystal_grow.pdbx_pH_range ? _exptl_crystal_grow.pdbx_details '20 mM Na/K phosphate pH 5.8, 10% PEG 3400, 1.2 M 1,6-hexanediol, VAPOR DIFFUSION, HANGING DROP, temperature 293K' # loop_ _diffrn.id _diffrn.ambient_temp _diffrn.ambient_temp_details _diffrn.crystal_id 1 100 ? 1 2 100 ? 1 # loop_ _diffrn_detector.diffrn_id _diffrn_detector.detector _diffrn_detector.type _diffrn_detector.pdbx_collection_date _diffrn_detector.details 1 CCD 'MARMOSAIC 300 mm CCD' 2009-03-27 ? 2 CCD 'MARMOSAIC 225 mm CCD' 2009-04-11 ? # loop_ _diffrn_radiation.diffrn_id _diffrn_radiation.wavelength_id _diffrn_radiation.pdbx_monochromatic_or_laue_m_l _diffrn_radiation.monochromator _diffrn_radiation.pdbx_diffrn_protocol _diffrn_radiation.pdbx_scattering_type 1 1 M 'Rosenbaum-Rock monochromator' 'SINGLE WAVELENGTH' x-ray 2 1 M 'Rosenbaum-Rock monochromator' 'SINGLE WAVELENGTH' x-ray # _diffrn_radiation_wavelength.id 1 _diffrn_radiation_wavelength.wavelength 1.00 _diffrn_radiation_wavelength.wt 1.0 # loop_ _diffrn_source.diffrn_id _diffrn_source.source _diffrn_source.type _diffrn_source.pdbx_synchrotron_site _diffrn_source.pdbx_synchrotron_beamline _diffrn_source.pdbx_wavelength _diffrn_source.pdbx_wavelength_list 1 SYNCHROTRON 'APS BEAMLINE 22-ID' APS 22-ID ? 1.00 2 SYNCHROTRON 'APS BEAMLINE 22-BM' APS 22-BM ? 1.00 # _reflns.entry_id 3JXA _reflns.observed_criterion_sigma_I 2.0 _reflns.observed_criterion_sigma_F ? _reflns.d_resolution_low 50.000 _reflns.d_resolution_high 2.400 _reflns.number_obs 40236 _reflns.number_all ? _reflns.percent_possible_obs 97.000 _reflns.pdbx_Rmerge_I_obs 0.136 _reflns.pdbx_Rsym_value ? _reflns.pdbx_netI_over_sigmaI 8.800 _reflns.B_iso_Wilson_estimate ? _reflns.pdbx_redundancy 9.200 _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 1,2 # loop_ _reflns_shell.d_res_high _reflns_shell.d_res_low _reflns_shell.percent_possible_all _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 _reflns_shell.pdbx_diffrn_id 2.40 2.49 81.10 0.548 ? ? 4.10 ? ? ? ? ? ? 1 1,2 2.49 2.59 91.90 0.504 ? ? 5.40 ? ? ? ? ? ? 2 1,2 2.59 2.70 97.60 0.480 ? ? 7.10 ? ? ? ? ? ? 3 1,2 2.70 2.85 99.50 0.368 ? ? 8.90 ? ? ? ? ? ? 4 1,2 2.85 3.02 99.90 0.290 ? ? 10.30 ? ? ? ? ? ? 5 1,2 3.02 3.26 100.00 0.215 ? ? 11.00 ? ? ? ? ? ? 6 1,2 3.26 3.58 100.00 0.164 ? ? 11.00 ? ? ? ? ? ? 7 1,2 3.58 4.10 100.00 0.145 ? ? 11.00 ? ? ? ? ? ? 8 1,2 4.10 5.17 100.00 0.114 ? ? 10.90 ? ? ? ? ? ? 9 1,2 5.17 50.00 99.70 0.087 ? ? 10.50 ? ? ? ? ? ? 10 1,2 # _refine.pdbx_refine_id 'X-RAY DIFFRACTION' _refine.entry_id 3JXA _refine.ls_number_reflns_obs 37921 _refine.ls_number_reflns_all ? _refine.pdbx_ls_sigma_I ? _refine.pdbx_ls_sigma_F 0.07 _refine.pdbx_data_cutoff_high_absF ? _refine.pdbx_data_cutoff_low_absF ? _refine.pdbx_data_cutoff_high_rms_absF ? _refine.ls_d_res_low 37.172 _refine.ls_d_res_high 2.403 _refine.ls_percent_reflns_obs 91.38 _refine.ls_R_factor_obs 0.1997 _refine.ls_R_factor_all ? _refine.ls_R_factor_R_work 0.1970 _refine.ls_R_factor_R_free 0.2517 _refine.ls_R_factor_R_free_error ? _refine.ls_R_factor_R_free_error_details ? _refine.ls_percent_reflns_R_free 4.97 _refine.ls_number_reflns_R_free 1886 _refine.ls_number_parameters ? _refine.ls_number_restraints ? _refine.occupancy_min 1.00 _refine.occupancy_max 1.00 _refine.correlation_coeff_Fo_to_Fc ? _refine.correlation_coeff_Fo_to_Fc_free ? _refine.B_iso_mean 78.726 _refine.aniso_B[1][1] -0.457 _refine.aniso_B[2][2] 11.965 _refine.aniso_B[3][3] -11.508 _refine.aniso_B[1][2] 0.000 _refine.aniso_B[1][3] -2.688 _refine.aniso_B[2][3] 0.000 _refine.solvent_model_details 'FLAT BULK SOLVENT MODEL' _refine.solvent_model_param_ksol 0.288 _refine.solvent_model_param_bsol 50.885 _refine.pdbx_solvent_vdw_probe_radii 1.11 _refine.pdbx_solvent_ion_probe_radii ? _refine.pdbx_solvent_shrinkage_radii 0.90 _refine.pdbx_ls_cross_valid_method ? _refine.details ? _refine.pdbx_starting_model ? _refine.pdbx_method_to_determine_struct 'MOLECULAR REPLACEMENT' _refine.pdbx_isotropic_thermal_model ? _refine.pdbx_stereochemistry_target_values ML _refine.pdbx_stereochem_target_val_spec_case ? _refine.pdbx_R_Free_selection_details ? _refine.pdbx_overall_ESU_R ? _refine.pdbx_overall_ESU_R_Free ? _refine.overall_SU_ML 0.34 _refine.pdbx_overall_phase_error 27.86 _refine.overall_SU_B ? _refine.ls_redundancy_reflns_obs ? _refine.B_iso_min ? _refine.B_iso_max ? _refine.overall_SU_R_Cruickshank_DPI ? _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 1,2 _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 5984 _refine_hist.pdbx_number_atoms_nucleic_acid 0 _refine_hist.pdbx_number_atoms_ligand 112 _refine_hist.number_atoms_solvent 187 _refine_hist.number_atoms_total 6283 _refine_hist.d_res_high 2.403 _refine_hist.d_res_low 37.172 # loop_ _refine_ls_restr.type _refine_ls_restr.dev_ideal _refine_ls_restr.dev_ideal_target _refine_ls_restr.weight _refine_ls_restr.number _refine_ls_restr.pdbx_refine_id _refine_ls_restr.pdbx_restraint_function f_bond_d 0.005 ? ? 6253 'X-RAY DIFFRACTION' ? f_angle_d 0.932 ? ? 8478 'X-RAY DIFFRACTION' ? f_dihedral_angle_d 17.303 ? ? 2330 'X-RAY DIFFRACTION' ? f_chiral_restr 0.060 ? ? 941 'X-RAY DIFFRACTION' ? f_plane_restr 0.005 ? ? 1099 'X-RAY DIFFRACTION' ? # loop_ _refine_ls_shell.pdbx_refine_id _refine_ls_shell.pdbx_total_number_of_bins_used _refine_ls_shell.d_res_high _refine_ls_shell.d_res_low _refine_ls_shell.number_reflns_R_work _refine_ls_shell.R_factor_R_work _refine_ls_shell.percent_reflns_obs _refine_ls_shell.R_factor_R_free _refine_ls_shell.R_factor_R_free_error _refine_ls_shell.percent_reflns_R_free _refine_ls_shell.number_reflns_R_free _refine_ls_shell.number_reflns_all _refine_ls_shell.R_factor_all _refine_ls_shell.redundancy_reflns_obs _refine_ls_shell.number_reflns_obs 'X-RAY DIFFRACTION' . 2.4030 2.4679 1914 0.2558 65.00 0.3097 . . 103 . . . . 'X-RAY DIFFRACTION' . 2.4679 2.5405 2274 0.2543 75.00 0.3047 . . 120 . . . . 'X-RAY DIFFRACTION' . 2.5405 2.6225 2475 0.2514 83.00 0.3356 . . 126 . . . . 'X-RAY DIFFRACTION' . 2.6225 2.7162 2655 0.2483 87.00 0.3488 . . 135 . . . . 'X-RAY DIFFRACTION' . 2.7162 2.8249 2711 0.2315 92.00 0.2803 . . 142 . . . . 'X-RAY DIFFRACTION' . 2.8249 2.9534 2842 0.2306 94.00 0.3194 . . 148 . . . . 'X-RAY DIFFRACTION' . 2.9534 3.1091 2903 0.2261 96.00 0.2839 . . 154 . . . . 'X-RAY DIFFRACTION' . 3.1091 3.3038 2927 0.2181 97.00 0.2832 . . 153 . . . . 'X-RAY DIFFRACTION' . 3.3038 3.5586 2991 0.2095 98.00 0.2588 . . 157 . . . . 'X-RAY DIFFRACTION' . 3.5586 3.9164 3016 0.1938 100.00 0.2375 . . 158 . . . . 'X-RAY DIFFRACTION' . 3.9164 4.4823 3070 0.1572 100.00 0.2340 . . 162 . . . . 'X-RAY DIFFRACTION' . 4.4823 5.6441 3072 0.1453 100.00 0.1891 . . 161 . . . . 'X-RAY DIFFRACTION' . 5.6441 37.1766 3185 0.1743 99.00 0.2146 . . 167 . . . . # _struct.entry_id 3JXA _struct.title 'Immunoglobulin domains 1-4 of mouse CNTN4' _struct.pdbx_descriptor 'Contactin 4' _struct.pdbx_model_details ? _struct.pdbx_CASP_flag ? _struct.pdbx_model_type_details ? # _struct_keywords.entry_id 3JXA _struct_keywords.pdbx_keywords 'CELL ADHESION' _struct_keywords.text 'Immunoglobulin-like domains, Horseshoe-like conformation, IMMUNE SYSTEM, CELL ADHESION' # 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 2 ? D N N 3 ? E N N 2 ? F N N 3 ? G N N 2 ? H N N 2 ? I N N 2 ? J N N 3 ? K N N 4 ? L N N 4 ? # _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 ASN A 69 ? ALA A 74 ? ASN A 90 ALA A 95 1 ? 6 HELX_P HELX_P2 2 GLU A 164 ? VAL A 168 ? GLU A 185 VAL A 189 5 ? 5 HELX_P HELX_P3 3 GLN A 265 ? ALA A 269 ? GLN A 286 ALA A 290 5 ? 5 HELX_P HELX_P4 4 ASN B 69 ? ALA B 74 ? ASN B 90 ALA B 95 1 ? 6 HELX_P HELX_P5 5 GLU B 164 ? VAL B 168 ? GLU B 185 VAL B 189 5 ? 5 HELX_P HELX_P6 6 GLN B 265 ? ALA B 269 ? GLN B 286 ALA B 290 5 ? 5 HELX_P HELX_P7 7 ASN B 354 ? ALA B 358 ? ASN B 375 ALA B 379 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 29 SG ? ? ? 1_555 A CYS 79 SG ? ? A CYS 50 A CYS 100 1_555 ? ? ? ? ? ? ? 2.040 ? disulf2 disulf ? ? A CYS 123 SG ? ? ? 1_555 A CYS 173 SG ? ? A CYS 144 A CYS 194 1_555 ? ? ? ? ? ? ? 2.058 ? disulf3 disulf ? ? A CYS 226 SG ? ? ? 1_555 A CYS 274 SG ? ? A CYS 247 A CYS 295 1_555 ? ? ? ? ? ? ? 2.040 ? disulf4 disulf ? ? A CYS 316 SG ? ? ? 1_555 A CYS 363 SG ? ? A CYS 337 A CYS 384 1_555 ? ? ? ? ? ? ? 2.040 ? disulf5 disulf ? ? B CYS 29 SG ? ? ? 1_555 B CYS 79 SG ? ? B CYS 50 B CYS 100 1_555 ? ? ? ? ? ? ? 2.032 ? disulf6 disulf ? ? B CYS 123 SG ? ? ? 1_555 B CYS 173 SG ? ? B CYS 144 B CYS 194 1_555 ? ? ? ? ? ? ? 2.040 ? disulf7 disulf ? ? B CYS 226 SG ? ? ? 1_555 B CYS 274 SG ? ? B CYS 247 B CYS 295 1_555 ? ? ? ? ? ? ? 2.033 ? disulf8 disulf ? ? B CYS 316 SG ? ? ? 1_555 B CYS 363 SG ? ? B CYS 337 B CYS 384 1_555 ? ? ? ? ? ? ? 2.029 ? covale1 covale ? ? A ASN 44 ND2 ? ? ? 1_555 C NAG . C1 ? ? A ASN 65 A NAG 1 1_555 ? ? ? ? ? ? ? 1.447 ? covale2 covale ? ? A ASN 170 ND2 ? ? ? 1_555 E NAG . C1 ? ? A ASN 191 A NAG 3 1_555 ? ? ? ? ? ? ? 1.448 ? covale3 covale ? ? B ASN 44 ND2 ? ? ? 1_555 G NAG . C1 ? ? B ASN 65 B NAG 5 1_555 ? ? ? ? ? ? ? 1.447 ? covale4 covale ? ? B ASN 69 ND2 ? ? ? 1_555 H NAG . C1 ? ? B ASN 90 B NAG 6 1_555 ? ? ? ? ? ? ? 1.441 ? covale5 covale ? ? B ASN 170 ND2 ? ? ? 1_555 I NAG . C1 ? ? B ASN 191 B NAG 7 1_555 ? ? ? ? ? ? ? 1.443 ? covale6 covale ? ? A ASN 349 ND2 ? ? ? 1_555 F NDG . C1 ? ? A ASN 370 A NDG 4 1_555 ? ? ? ? ? ? ? 1.439 ? covale7 covale ? ? B ASN 349 ND2 ? ? ? 1_555 J NDG . C1 ? ? B ASN 370 B NDG 8 1_555 ? ? ? ? ? ? ? 1.441 ? covale8 covale ? ? A ASN 69 ND2 ? ? ? 1_555 D NDG . C1 ? ? A ASN 90 A NDG 2 1_555 ? ? ? ? ? ? ? 1.444 ? # loop_ _struct_conn_type.id _struct_conn_type.criteria _struct_conn_type.reference disulf ? ? covale ? ? # loop_ _struct_mon_prot_cis.pdbx_id _struct_mon_prot_cis.label_comp_id _struct_mon_prot_cis.label_seq_id _struct_mon_prot_cis.label_asym_id _struct_mon_prot_cis.label_alt_id _struct_mon_prot_cis.pdbx_PDB_ins_code _struct_mon_prot_cis.auth_comp_id _struct_mon_prot_cis.auth_seq_id _struct_mon_prot_cis.auth_asym_id _struct_mon_prot_cis.pdbx_label_comp_id_2 _struct_mon_prot_cis.pdbx_label_seq_id_2 _struct_mon_prot_cis.pdbx_label_asym_id_2 _struct_mon_prot_cis.pdbx_PDB_ins_code_2 _struct_mon_prot_cis.pdbx_auth_comp_id_2 _struct_mon_prot_cis.pdbx_auth_seq_id_2 _struct_mon_prot_cis.pdbx_auth_asym_id_2 _struct_mon_prot_cis.pdbx_PDB_model_num _struct_mon_prot_cis.pdbx_omega_angle 1 ASN 34 A . ? ASN 55 A PRO 35 A ? PRO 56 A 1 3.29 2 MET 52 A . ? MET 73 A ASP 53 A ? ASP 74 A 1 4.19 3 ASN 231 A . ? ASN 252 A PRO 232 A ? PRO 253 A 1 5.14 4 ARG 321 A . ? ARG 342 A PRO 322 A ? PRO 343 A 1 -2.09 5 ASP 339 A . ? ASP 360 A ARG 340 A ? ARG 361 A 1 2.26 6 ASN 34 B . ? ASN 55 B PRO 35 B ? PRO 56 B 1 3.70 7 MET 52 B . ? MET 73 B ASP 53 B ? ASP 74 B 1 0.14 8 ASN 231 B . ? ASN 252 B PRO 232 B ? PRO 253 B 1 -0.20 9 ARG 321 B . ? ARG 342 B PRO 322 B ? PRO 343 B 1 5.99 # loop_ _struct_sheet.id _struct_sheet.type _struct_sheet.number_strands _struct_sheet.details A ? 2 ? B ? 4 ? C ? 5 ? D ? 2 ? E ? 5 ? F ? 4 ? G ? 3 ? H ? 4 ? I ? 4 ? J ? 3 ? K ? 5 ? L ? 3 ? M ? 2 ? N ? 5 ? O ? 3 ? P ? 3 ? Q ? 5 ? R ? 4 ? S ? 3 ? T ? 2 ? U ? 4 ? V ? 3 ? W ? 3 ? X ? 5 ? Y ? 3 ? # 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 B 1 2 ? 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 C 4 5 ? anti-parallel D 1 2 ? anti-parallel E 1 2 ? parallel E 2 3 ? anti-parallel E 3 4 ? anti-parallel E 4 5 ? anti-parallel F 1 2 ? parallel F 2 3 ? anti-parallel F 3 4 ? anti-parallel G 1 2 ? anti-parallel G 2 3 ? anti-parallel H 1 2 ? anti-parallel H 2 3 ? anti-parallel H 3 4 ? anti-parallel I 1 2 ? parallel I 2 3 ? anti-parallel I 3 4 ? anti-parallel J 1 2 ? parallel J 2 3 ? anti-parallel K 1 2 ? parallel K 2 3 ? anti-parallel K 3 4 ? anti-parallel K 4 5 ? anti-parallel L 1 2 ? anti-parallel L 2 3 ? anti-parallel M 1 2 ? anti-parallel N 1 2 ? parallel N 2 3 ? anti-parallel N 3 4 ? anti-parallel N 4 5 ? anti-parallel O 1 2 ? parallel O 2 3 ? anti-parallel P 1 2 ? anti-parallel P 2 3 ? anti-parallel Q 1 2 ? parallel Q 2 3 ? anti-parallel Q 3 4 ? anti-parallel Q 4 5 ? anti-parallel R 1 2 ? parallel R 2 3 ? anti-parallel R 3 4 ? anti-parallel S 1 2 ? anti-parallel S 2 3 ? anti-parallel T 1 2 ? anti-parallel U 1 2 ? parallel U 2 3 ? anti-parallel U 3 4 ? anti-parallel V 1 2 ? parallel V 2 3 ? anti-parallel W 1 2 ? anti-parallel W 2 3 ? anti-parallel X 1 2 ? parallel X 2 3 ? anti-parallel X 3 4 ? anti-parallel X 4 5 ? anti-parallel Y 1 2 ? anti-parallel Y 2 3 ? 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 SER A 3 ? GLN A 9 ? SER A 24 GLN A 30 A 2 GLU A 30 ? ASN A 34 ? GLU A 51 ASN A 55 B 1 VAL A 14 ? PRO A 17 ? VAL A 35 PRO A 38 B 2 ALA A 93 ? LEU A 100 ? ALA A 114 LEU A 121 B 3 THR A 76 ? ASN A 83 ? THR A 97 ASN A 104 B 4 GLY A 86 ? VAL A 89 ? GLY A 107 VAL A 110 C 1 THR A 46 ? ASP A 47 ? THR A 67 ASP A 68 C 2 HIS A 38 ? LEU A 43 ? HIS A 59 LEU A 64 C 3 THR A 76 ? ASN A 83 ? THR A 97 ASN A 104 C 4 ALA A 93 ? LEU A 100 ? ALA A 114 LEU A 121 C 5 HIS A 128 ? SER A 129 ? HIS A 149 SER A 150 D 1 LYS A 26 ? LEU A 27 ? LYS A 47 LEU A 48 D 2 LEU A 63 ? LEU A 64 ? LEU A 84 LEU A 85 E 1 VAL A 111 ? VAL A 113 ? VAL A 132 VAL A 134 E 2 THR A 189 ? LEU A 193 ? THR A 210 LEU A 214 E 3 GLY A 169 ? ASN A 177 ? GLY A 190 ASN A 198 E 4 LEU A 132 ? PHE A 138 ? LEU A 153 PHE A 159 E 5 TYR A 141 ? PRO A 142 ? TYR A 162 PRO A 163 F 1 VAL A 111 ? VAL A 113 ? VAL A 132 VAL A 134 F 2 THR A 189 ? LEU A 193 ? THR A 210 LEU A 214 F 3 GLY A 169 ? ASN A 177 ? GLY A 190 ASN A 198 F 4 LYS A 183 ? LEU A 185 ? LYS A 204 LEU A 206 G 1 MET A 119 ? LEU A 121 ? MET A 140 LEU A 142 G 2 LEU A 158 ? ILE A 160 ? LEU A 179 ILE A 181 G 3 ARG A 149 ? VAL A 151 ? ARG A 170 VAL A 172 H 1 TYR A 202 ? GLN A 209 ? TYR A 223 GLN A 230 H 2 VAL A 222 ? ASN A 231 ? VAL A 243 ASN A 252 H 3 ILE A 258 ? ILE A 261 ? ILE A 279 ILE A 282 H 4 ARG A 251 ? HIS A 253 ? ARG A 272 HIS A 274 I 1 THR A 213 ? GLU A 217 ? THR A 234 GLU A 238 I 2 GLY A 281 ? GLN A 299 ? GLY A 302 GLN A 320 I 3 GLY A 270 ? ASN A 278 ? GLY A 291 ASN A 299 I 4 THR A 235 ? ARG A 240 ? THR A 256 ARG A 261 J 1 THR A 213 ? GLU A 217 ? THR A 234 GLU A 238 J 2 GLY A 281 ? GLN A 299 ? GLY A 302 GLN A 320 J 3 LYS A 317 ? ARG A 321 ? LYS A 338 ARG A 342 K 1 ILE A 304 ? ALA A 307 ? ILE A 325 ALA A 328 K 2 GLY A 370 ? ILE A 381 ? GLY A 391 ILE A 402 K 3 GLY A 359 ? ASN A 367 ? GLY A 380 ASN A 388 K 4 THR A 325 ? LYS A 330 ? THR A 346 LYS A 351 K 5 ASP A 333 ? PRO A 334 ? ASP A 354 PRO A 355 L 1 VAL A 312 ? GLU A 315 ? VAL A 333 GLU A 336 L 2 THR A 347 ? ILE A 350 ? THR A 368 ILE A 371 L 3 ILE A 341 ? GLU A 344 ? ILE A 362 GLU A 365 M 1 SER B 3 ? GLN B 9 ? SER B 24 GLN B 30 M 2 GLU B 30 ? ASN B 34 ? GLU B 51 ASN B 55 N 1 VAL B 14 ? PRO B 17 ? VAL B 35 PRO B 38 N 2 GLY B 86 ? LEU B 100 ? GLY B 107 LEU B 121 N 3 GLY B 75 ? ASN B 83 ? GLY B 96 ASN B 104 N 4 HIS B 38 ? LEU B 43 ? HIS B 59 LEU B 64 N 5 THR B 46 ? ASP B 47 ? THR B 67 ASP B 68 O 1 VAL B 14 ? PRO B 17 ? VAL B 35 PRO B 38 O 2 GLY B 86 ? LEU B 100 ? GLY B 107 LEU B 121 O 3 HIS B 128 ? SER B 129 ? HIS B 149 SER B 150 P 1 LYS B 24 ? LEU B 27 ? LYS B 45 LEU B 48 P 2 SER B 62 ? ASN B 66 ? SER B 83 ASN B 87 P 3 SER B 57 ? VAL B 59 ? SER B 78 VAL B 80 Q 1 VAL B 111 ? VAL B 113 ? VAL B 132 VAL B 134 Q 2 THR B 189 ? LEU B 193 ? THR B 210 LEU B 214 Q 3 GLY B 169 ? ASN B 177 ? GLY B 190 ASN B 198 Q 4 LEU B 132 ? PHE B 138 ? LEU B 153 PHE B 159 Q 5 TYR B 141 ? PRO B 142 ? TYR B 162 PRO B 163 R 1 VAL B 111 ? VAL B 113 ? VAL B 132 VAL B 134 R 2 THR B 189 ? LEU B 193 ? THR B 210 LEU B 214 R 3 GLY B 169 ? ASN B 177 ? GLY B 190 ASN B 198 R 4 LYS B 183 ? LEU B 185 ? LYS B 204 LEU B 206 S 1 MET B 119 ? LEU B 121 ? MET B 140 LEU B 142 S 2 LEU B 158 ? ILE B 160 ? LEU B 179 ILE B 181 S 3 ARG B 149 ? VAL B 151 ? ARG B 170 VAL B 172 T 1 TYR B 202 ? VAL B 208 ? TYR B 223 VAL B 229 T 2 PHE B 227 ? ASN B 231 ? PHE B 248 ASN B 252 U 1 THR B 213 ? GLU B 217 ? THR B 234 GLU B 238 U 2 LYS B 282 ? GLN B 299 ? LYS B 303 GLN B 320 U 3 GLY B 270 ? GLU B 277 ? GLY B 291 GLU B 298 U 4 THR B 235 ? ARG B 240 ? THR B 256 ARG B 261 V 1 THR B 213 ? GLU B 217 ? THR B 234 GLU B 238 V 2 LYS B 282 ? GLN B 299 ? LYS B 303 GLN B 320 V 3 LYS B 317 ? ARG B 321 ? LYS B 338 ARG B 342 W 1 VAL B 222 ? GLU B 225 ? VAL B 243 GLU B 246 W 2 ILE B 258 ? ILE B 261 ? ILE B 279 ILE B 282 W 3 ARG B 251 ? HIS B 253 ? ARG B 272 HIS B 274 X 1 ILE B 304 ? VAL B 306 ? ILE B 325 VAL B 327 X 2 GLY B 370 ? VAL B 380 ? GLY B 391 VAL B 401 X 3 GLY B 359 ? ASN B 367 ? GLY B 380 ASN B 388 X 4 THR B 325 ? LYS B 330 ? THR B 346 LYS B 351 X 5 ASP B 333 ? PRO B 334 ? ASP B 354 PRO B 355 Y 1 VAL B 312 ? GLU B 315 ? VAL B 333 GLU B 336 Y 2 THR B 347 ? ILE B 350 ? THR B 368 ILE B 371 Y 3 ILE B 341 ? GLU B 344 ? ILE B 362 GLU B 365 # 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 SER A 3 ? N SER A 24 O ASN A 34 ? O ASN A 55 B 1 2 N PHE A 16 ? N PHE A 37 O GLN A 96 ? O GLN A 117 B 2 3 O ALA A 93 ? O ALA A 114 N TYR A 77 ? N TYR A 98 B 3 4 N ALA A 81 ? N ALA A 102 O ILE A 88 ? O ILE A 109 C 1 2 O THR A 46 ? O THR A 67 N LEU A 43 ? N LEU A 64 C 2 3 N ARG A 40 ? N ARG A 61 O ILE A 80 ? O ILE A 101 C 3 4 N TYR A 77 ? N TYR A 98 O ALA A 93 ? O ALA A 114 C 4 5 N TYR A 99 ? N TYR A 120 O SER A 129 ? O SER A 150 D 1 2 N LEU A 27 ? N LEU A 48 O LEU A 63 ? O LEU A 84 E 1 2 N VAL A 111 ? N VAL A 132 O PRO A 190 ? O PRO A 211 E 2 3 O LEU A 191 ? O LEU A 212 N GLY A 169 ? N GLY A 190 E 3 4 O THR A 176 ? O THR A 197 N SER A 133 ? N SER A 154 E 4 5 N PHE A 138 ? N PHE A 159 O TYR A 141 ? O TYR A 162 F 1 2 N VAL A 111 ? N VAL A 132 O PRO A 190 ? O PRO A 211 F 2 3 O LEU A 191 ? O LEU A 212 N GLY A 169 ? N GLY A 190 F 3 4 N VAL A 175 ? N VAL A 196 O VAL A 184 ? O VAL A 205 G 1 2 N LEU A 121 ? N LEU A 142 O LEU A 158 ? O LEU A 179 G 2 3 O TYR A 159 ? O TYR A 180 N PHE A 150 ? N PHE A 171 H 1 2 N LYS A 205 ? N LYS A 226 O LEU A 229 ? O LEU A 250 H 2 3 N VAL A 222 ? N VAL A 243 O ILE A 261 ? O ILE A 282 H 3 4 O GLU A 260 ? O GLU A 281 N ARG A 251 ? N ARG A 272 I 1 2 N VAL A 214 ? N VAL A 235 O GLN A 288 ? O GLN A 309 I 2 3 O ASN A 283 ? O ASN A 304 N ALA A 276 ? N ALA A 297 I 3 4 O GLU A 273 ? O GLU A 294 N ARG A 239 ? N ARG A 260 J 1 2 N VAL A 214 ? N VAL A 235 O GLN A 288 ? O GLN A 309 J 2 3 N GLN A 299 ? N GLN A 320 O LYS A 317 ? O LYS A 338 K 1 2 N VAL A 306 ? N VAL A 327 O ILE A 381 ? O ILE A 402 K 2 3 O ALA A 376 ? O ALA A 397 N TYR A 361 ? N TYR A 382 K 3 4 O VAL A 364 ? O VAL A 385 N ARG A 327 ? N ARG A 348 K 4 5 N LYS A 330 ? N LYS A 351 O ASP A 333 ? O ASP A 354 L 1 2 N TRP A 314 ? N TRP A 335 O LEU A 348 ? O LEU A 369 L 2 3 O ASN A 349 ? O ASN A 370 N GLN A 342 ? N GLN A 363 M 1 2 N VAL B 8 ? N VAL B 29 O GLU B 30 ? O GLU B 51 N 1 2 N PHE B 16 ? N PHE B 37 O GLN B 96 ? O GLN B 117 N 2 3 O ALA B 93 ? O ALA B 114 N TYR B 77 ? N TYR B 98 N 3 4 O ILE B 80 ? O ILE B 101 N ARG B 40 ? N ARG B 61 N 4 5 N LEU B 43 ? N LEU B 64 O THR B 46 ? O THR B 67 O 1 2 N PHE B 16 ? N PHE B 37 O GLN B 96 ? O GLN B 117 O 2 3 N TYR B 99 ? N TYR B 120 O SER B 129 ? O SER B 150 P 1 2 N LEU B 27 ? N LEU B 48 O LEU B 63 ? O LEU B 84 P 2 3 O LEU B 64 ? O LEU B 85 N SER B 57 ? N SER B 78 Q 1 2 N VAL B 113 ? N VAL B 134 O ILE B 192 ? O ILE B 213 Q 2 3 O THR B 189 ? O THR B 210 N TYR B 171 ? N TYR B 192 Q 3 4 O VAL B 174 ? O VAL B 195 N ALA B 135 ? N ALA B 156 Q 4 5 N PHE B 138 ? N PHE B 159 O TYR B 141 ? O TYR B 162 R 1 2 N VAL B 113 ? N VAL B 134 O ILE B 192 ? O ILE B 213 R 2 3 O THR B 189 ? O THR B 210 N TYR B 171 ? N TYR B 192 R 3 4 N VAL B 175 ? N VAL B 196 O VAL B 184 ? O VAL B 205 S 1 2 N LEU B 121 ? N LEU B 142 O LEU B 158 ? O LEU B 179 S 2 3 O TYR B 159 ? O TYR B 180 N PHE B 150 ? N PHE B 171 T 1 2 N GLU B 207 ? N GLU B 228 O PHE B 227 ? O PHE B 248 U 1 2 N VAL B 214 ? N VAL B 235 O GLN B 288 ? O GLN B 309 U 2 3 O GLY B 287 ? O GLY B 308 N TYR B 272 ? N TYR B 293 U 3 4 O VAL B 275 ? O VAL B 296 N LEU B 237 ? N LEU B 258 V 1 2 N VAL B 214 ? N VAL B 235 O GLN B 288 ? O GLN B 309 V 2 3 N VAL B 298 ? N VAL B 319 O LYS B 317 ? O LYS B 338 W 1 2 N LEU B 224 ? N LEU B 245 O LEU B 259 ? O LEU B 280 W 2 3 O GLU B 260 ? O GLU B 281 N ARG B 251 ? N ARG B 272 X 1 2 N ILE B 304 ? N ILE B 325 O SER B 379 ? O SER B 400 X 2 3 O ALA B 376 ? O ALA B 397 N TYR B 361 ? N TYR B 382 X 3 4 O VAL B 364 ? O VAL B 385 N ARG B 327 ? N ARG B 348 X 4 5 N LYS B 330 ? N LYS B 351 O ASP B 333 ? O ASP B 354 Y 1 2 N VAL B 312 ? N VAL B 333 O ILE B 350 ? O ILE B 371 Y 2 3 O ASN B 349 ? O ASN B 370 N GLN B 342 ? N GLN B 363 # loop_ _struct_site.id _struct_site.pdbx_evidence_code _struct_site.pdbx_auth_asym_id _struct_site.pdbx_auth_comp_id _struct_site.pdbx_auth_seq_id _struct_site.pdbx_auth_ins_code _struct_site.pdbx_num_residues _struct_site.details AC1 Software ? ? ? ? 3 'BINDING SITE FOR RESIDUE NAG A 1' AC2 Software ? ? ? ? 4 'BINDING SITE FOR RESIDUE NDG A 2' AC3 Software ? ? ? ? 11 'BINDING SITE FOR RESIDUE NAG A 3' AC4 Software ? ? ? ? 4 'BINDING SITE FOR RESIDUE NDG A 4' AC5 Software ? ? ? ? 5 'BINDING SITE FOR RESIDUE NAG B 5' AC6 Software ? ? ? ? 5 'BINDING SITE FOR RESIDUE NAG B 6' AC7 Software ? ? ? ? 6 'BINDING SITE FOR RESIDUE NAG B 7' AC8 Software ? ? ? ? 5 'BINDING SITE FOR RESIDUE NDG B 8' # loop_ _struct_site_gen.id _struct_site_gen.site_id _struct_site_gen.pdbx_num_res _struct_site_gen.label_comp_id _struct_site_gen.label_asym_id _struct_site_gen.label_seq_id _struct_site_gen.pdbx_auth_ins_code _struct_site_gen.auth_comp_id _struct_site_gen.auth_asym_id _struct_site_gen.auth_seq_id _struct_site_gen.label_atom_id _struct_site_gen.label_alt_id _struct_site_gen.symmetry _struct_site_gen.details 1 AC1 3 ASN A 44 ? ASN A 65 . ? 1_555 ? 2 AC1 3 GLN A 72 ? GLN A 93 . ? 1_555 ? 3 AC1 3 ALA A 74 ? ALA A 95 . ? 1_555 ? 4 AC2 4 ASN A 69 ? ASN A 90 . ? 1_555 ? 5 AC2 4 THR A 71 ? THR A 92 . ? 1_555 ? 6 AC2 4 GLN A 72 ? GLN A 93 . ? 1_555 ? 7 AC2 4 HOH K . ? HOH A 490 . ? 1_555 ? 8 AC3 11 GLY A 169 ? GLY A 190 . ? 1_555 ? 9 AC3 11 ASN A 170 ? ASN A 191 . ? 1_555 ? 10 AC3 11 PRO A 190 ? PRO A 211 . ? 1_555 ? 11 AC3 11 LEU A 191 ? LEU A 212 . ? 1_555 ? 12 AC3 11 ILE A 192 ? ILE A 213 . ? 1_555 ? 13 AC3 11 GLU A 201 ? GLU A 222 . ? 4_556 ? 14 AC3 11 ARG A 280 ? ARG A 301 . ? 4_556 ? 15 AC3 11 HOH K . ? HOH A 408 . ? 1_555 ? 16 AC3 11 HOH K . ? HOH A 409 . ? 1_555 ? 17 AC3 11 HOH K . ? HOH A 419 . ? 4_556 ? 18 AC3 11 HOH K . ? HOH A 482 . ? 4_556 ? 19 AC4 4 PHE A 313 ? PHE A 334 . ? 1_555 ? 20 AC4 4 GLN A 342 ? GLN A 363 . ? 1_555 ? 21 AC4 4 ASN A 349 ? ASN A 370 . ? 1_555 ? 22 AC4 4 THR A 351 ? THR A 372 . ? 1_555 ? 23 AC5 5 ASN B 44 ? ASN B 65 . ? 1_555 ? 24 AC5 5 ALA B 74 ? ALA B 95 . ? 1_555 ? 25 AC5 5 ARG B 251 ? ARG B 272 . ? 1_545 ? 26 AC5 5 ARG B 252 ? ARG B 273 . ? 1_545 ? 27 AC5 5 HIS B 253 ? HIS B 274 . ? 1_545 ? 28 AC6 5 ASN B 69 ? ASN B 90 . ? 1_555 ? 29 AC6 5 THR B 71 ? THR B 92 . ? 1_555 ? 30 AC6 5 GLN B 72 ? GLN B 93 . ? 1_555 ? 31 AC6 5 ASN B 139 ? ASN B 160 . ? 2_545 ? 32 AC6 5 GLU B 140 ? GLU B 161 . ? 2_545 ? 33 AC7 6 ASP B 53 ? ASP B 74 . ? 2_565 ? 34 AC7 6 PHE B 54 ? PHE B 75 . ? 2_565 ? 35 AC7 6 ASN B 67 ? ASN B 88 . ? 2_565 ? 36 AC7 6 ASN B 139 ? ASN B 160 . ? 1_555 ? 37 AC7 6 GLY B 169 ? GLY B 190 . ? 1_555 ? 38 AC7 6 ASN B 170 ? ASN B 191 . ? 1_555 ? 39 AC8 5 GLU A 310 ? GLU A 331 . ? 1_556 ? 40 AC8 5 SER B 311 ? SER B 332 . ? 1_555 ? 41 AC8 5 PHE B 313 ? PHE B 334 . ? 1_555 ? 42 AC8 5 ASN B 349 ? ASN B 370 . ? 1_555 ? 43 AC8 5 HOH L . ? HOH B 420 . ? 1_555 ? # _atom_sites.entry_id 3JXA _atom_sites.fract_transf_matrix[1][1] 0.003550 _atom_sites.fract_transf_matrix[1][2] 0.000000 _atom_sites.fract_transf_matrix[1][3] 0.000840 _atom_sites.fract_transf_matrix[2][1] 0.000000 _atom_sites.fract_transf_matrix[2][2] 0.024733 _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] 0.010809 _atom_sites.fract_transf_vector[1] 0.00000 _atom_sites.fract_transf_vector[2] 0.00000 _atom_sites.fract_transf_vector[3] 0.00000 # loop_ _atom_type.symbol C N O S # loop_ _atom_site.group_PDB _atom_site.id _atom_site.type_symbol _atom_site.label_atom_id _atom_site.label_alt_id _atom_site.label_comp_id _atom_site.label_asym_id _atom_site.label_entity_id _atom_site.label_seq_id _atom_site.pdbx_PDB_ins_code _atom_site.Cartn_x _atom_site.Cartn_y _atom_site.Cartn_z _atom_site.occupancy _atom_site.B_iso_or_equiv _atom_site.pdbx_formal_charge _atom_site.auth_seq_id _atom_site.auth_comp_id _atom_site.auth_asym_id _atom_site.auth_atom_id _atom_site.pdbx_PDB_model_num ATOM 1 N N . PRO A 1 1 ? 55.550 6.811 -32.027 1.00 150.01 ? 22 PRO A N 1 ATOM 2 C CA . PRO A 1 1 ? 54.089 6.692 -32.035 1.00 148.66 ? 22 PRO A CA 1 ATOM 3 C C . PRO A 1 1 ? 53.623 5.268 -32.330 1.00 139.42 ? 22 PRO A C 1 ATOM 4 O O . PRO A 1 1 ? 54.101 4.638 -33.276 1.00 138.85 ? 22 PRO A O 1 ATOM 5 C CB . PRO A 1 1 ? 53.677 7.637 -33.164 1.00 152.38 ? 22 PRO A CB 1 ATOM 6 C CG . PRO A 1 1 ? 54.718 8.702 -33.135 1.00 155.31 ? 22 PRO A CG 1 ATOM 7 C CD . PRO A 1 1 ? 56.007 8.024 -32.730 1.00 153.60 ? 22 PRO A CD 1 ATOM 8 N N . GLY A 1 2 ? 52.692 4.775 -31.520 1.00 127.60 ? 23 GLY A N 1 ATOM 9 C CA . GLY A 1 2 ? 52.190 3.421 -31.663 1.00 115.95 ? 23 GLY A CA 1 ATOM 10 C C . GLY A 1 2 ? 52.820 2.484 -30.652 1.00 105.94 ? 23 GLY A C 1 ATOM 11 O O . GLY A 1 2 ? 53.802 1.800 -30.944 1.00 103.39 ? 23 GLY A O 1 ATOM 12 N N . SER A 1 3 ? 52.260 2.454 -29.449 1.00 100.43 ? 24 SER A N 1 ATOM 13 C CA . SER A 1 3 ? 52.793 1.586 -28.407 1.00 97.51 ? 24 SER A CA 1 ATOM 14 C C . SER A 1 3 ? 51.712 1.119 -27.441 1.00 90.75 ? 24 SER A C 1 ATOM 15 O O . SER A 1 3 ? 50.855 1.898 -27.017 1.00 87.70 ? 24 SER A O 1 ATOM 16 C CB . SER A 1 3 ? 53.919 2.286 -27.641 1.00 100.27 ? 24 SER A CB 1 ATOM 17 O OG . SER A 1 3 ? 53.405 3.250 -26.739 1.00 107.54 ? 24 SER A OG 1 ATOM 18 N N . GLY A 1 4 ? 51.755 -0.163 -27.103 1.00 86.83 ? 25 GLY A N 1 ATOM 19 C CA . GLY A 1 4 ? 50.879 -0.699 -26.082 1.00 87.66 ? 25 GLY A CA 1 ATOM 20 C C . GLY A 1 4 ? 51.237 -0.106 -24.732 1.00 80.80 ? 25 GLY A C 1 ATOM 21 O O . GLY A 1 4 ? 52.267 0.560 -24.597 1.00 75.01 ? 25 GLY A O 1 ATOM 22 N N . PRO A 1 5 ? 50.388 -0.354 -23.726 1.00 77.58 ? 26 PRO A N 1 ATOM 23 C CA . PRO A 1 5 ? 50.522 0.177 -22.363 1.00 74.19 ? 26 PRO A CA 1 ATOM 24 C C . PRO A 1 5 ? 51.736 -0.375 -21.625 1.00 73.92 ? 26 PRO A C 1 ATOM 25 O O . PRO A 1 5 ? 52.040 -1.560 -21.740 1.00 79.42 ? 26 PRO A O 1 ATOM 26 C CB . PRO A 1 5 ? 49.245 -0.314 -21.664 1.00 67.13 ? 26 PRO A CB 1 ATOM 27 C CG . PRO A 1 5 ? 48.330 -0.761 -22.759 1.00 76.63 ? 26 PRO A CG 1 ATOM 28 C CD . PRO A 1 5 ? 49.216 -1.231 -23.861 1.00 76.69 ? 26 PRO A CD 1 ATOM 29 N N . VAL A 1 6 ? 52.422 0.486 -20.881 1.00 70.19 ? 27 VAL A N 1 ATOM 30 C CA . VAL A 1 6 ? 53.434 0.050 -19.921 1.00 60.00 ? 27 VAL A CA 1 ATOM 31 C C . VAL A 1 6 ? 53.272 0.832 -18.615 1.00 72.73 ? 27 VAL A C 1 ATOM 32 O O . VAL A 1 6 ? 52.955 2.026 -18.633 1.00 75.68 ? 27 VAL A O 1 ATOM 33 C CB . VAL A 1 6 ? 54.873 0.168 -20.471 1.00 61.71 ? 27 VAL A CB 1 ATOM 34 C CG1 . VAL A 1 6 ? 54.910 0.967 -21.781 1.00 63.36 ? 27 VAL A CG1 1 ATOM 35 C CG2 . VAL A 1 6 ? 55.813 0.748 -19.420 1.00 58.10 ? 27 VAL A CG2 1 ATOM 36 N N . PHE A 1 7 ? 53.466 0.147 -17.487 1.00 69.06 ? 28 PHE A N 1 ATOM 37 C CA . PHE A 1 7 ? 53.253 0.744 -16.167 1.00 71.13 ? 28 PHE A CA 1 ATOM 38 C C . PHE A 1 7 ? 54.390 1.665 -15.718 1.00 74.52 ? 28 PHE A C 1 ATOM 39 O O . PHE A 1 7 ? 55.558 1.268 -15.690 1.00 75.28 ? 28 PHE A O 1 ATOM 40 C CB . PHE A 1 7 ? 53.041 -0.347 -15.111 1.00 73.52 ? 28 PHE A CB 1 ATOM 41 C CG . PHE A 1 7 ? 51.677 -0.970 -15.144 1.00 73.67 ? 28 PHE A CG 1 ATOM 42 C CD1 . PHE A 1 7 ? 51.528 -2.327 -15.361 1.00 69.52 ? 28 PHE A CD1 1 ATOM 43 C CD2 . PHE A 1 7 ? 50.547 -0.196 -14.963 1.00 76.43 ? 28 PHE A CD2 1 ATOM 44 C CE1 . PHE A 1 7 ? 50.276 -2.899 -15.397 1.00 71.23 ? 28 PHE A CE1 1 ATOM 45 C CE2 . PHE A 1 7 ? 49.292 -0.763 -14.998 1.00 78.29 ? 28 PHE A CE2 1 ATOM 46 C CZ . PHE A 1 7 ? 49.155 -2.115 -15.215 1.00 76.14 ? 28 PHE A CZ 1 ATOM 47 N N . VAL A 1 8 ? 54.035 2.895 -15.359 1.00 72.38 ? 29 VAL A N 1 ATOM 48 C CA . VAL A 1 8 ? 54.987 3.830 -14.775 1.00 79.48 ? 29 VAL A CA 1 ATOM 49 C C . VAL A 1 8 ? 54.985 3.694 -13.249 1.00 82.15 ? 29 VAL A C 1 ATOM 50 O O . VAL A 1 8 ? 56.012 3.889 -12.602 1.00 82.62 ? 29 VAL A O 1 ATOM 51 C CB . VAL A 1 8 ? 54.653 5.285 -15.162 1.00 88.99 ? 29 VAL A CB 1 ATOM 52 C CG1 . VAL A 1 8 ? 55.736 6.228 -14.670 1.00 92.41 ? 29 VAL A CG1 1 ATOM 53 C CG2 . VAL A 1 8 ? 54.489 5.406 -16.667 1.00 95.10 ? 29 VAL A CG2 1 ATOM 54 N N . GLN A 1 9 ? 53.817 3.363 -12.696 1.00 82.77 ? 30 GLN A N 1 ATOM 55 C CA . GLN A 1 9 ? 53.628 3.113 -11.263 1.00 84.97 ? 30 GLN A CA 1 ATOM 56 C C . GLN A 1 9 ? 52.583 2.021 -11.038 1.00 81.76 ? 30 GLN A C 1 ATOM 57 O O . GLN A 1 9 ? 51.538 2.012 -11.688 1.00 87.94 ? 30 GLN A O 1 ATOM 58 C CB . GLN A 1 9 ? 53.158 4.379 -10.546 1.00 90.30 ? 30 GLN A CB 1 ATOM 59 C CG . GLN A 1 9 ? 54.250 5.172 -9.867 1.00 98.58 ? 30 GLN A CG 1 ATOM 60 C CD . GLN A 1 9 ? 53.815 5.673 -8.503 1.00 107.85 ? 30 GLN A CD 1 ATOM 61 O OE1 . GLN A 1 9 ? 53.432 6.833 -8.348 1.00 115.43 ? 30 GLN A OE1 1 ATOM 62 N NE2 . GLN A 1 9 ? 53.851 4.789 -7.508 1.00 102.90 ? 30 GLN A NE2 1 ATOM 63 N N . GLU A 1 10 ? 52.853 1.109 -10.111 1.00 74.01 ? 31 GLU A N 1 ATOM 64 C CA . GLU A 1 10 ? 51.890 0.052 -9.800 1.00 78.07 ? 31 GLU A CA 1 ATOM 65 C C . GLU A 1 10 ? 51.427 0.091 -8.337 1.00 76.52 ? 31 GLU A C 1 ATOM 66 O O . GLU A 1 10 ? 52.097 0.674 -7.488 1.00 78.96 ? 31 GLU A O 1 ATOM 67 C CB . GLU A 1 10 ? 52.468 -1.319 -10.154 1.00 79.47 ? 31 GLU A CB 1 ATOM 68 C CG . GLU A 1 10 ? 52.730 -1.502 -11.635 1.00 79.28 ? 31 GLU A CG 1 ATOM 69 C CD . GLU A 1 10 ? 53.089 -2.929 -11.991 1.00 81.99 ? 31 GLU A CD 1 ATOM 70 O OE1 . GLU A 1 10 ? 52.433 -3.858 -11.478 1.00 84.28 ? 31 GLU A OE1 1 ATOM 71 O OE2 . GLU A 1 10 ? 54.025 -3.123 -12.793 1.00 86.16 ? 31 GLU A OE2 1 ATOM 72 N N . PRO A 1 11 ? 50.275 -0.537 -8.043 1.00 71.70 ? 32 PRO A N 1 ATOM 73 C CA . PRO A 1 11 ? 49.675 -0.472 -6.707 1.00 74.99 ? 32 PRO A CA 1 ATOM 74 C C . PRO A 1 11 ? 50.484 -1.280 -5.699 1.00 79.35 ? 32 PRO A C 1 ATOM 75 O O . PRO A 1 11 ? 51.053 -2.315 -6.048 1.00 78.81 ? 32 PRO A O 1 ATOM 76 C CB . PRO A 1 11 ? 48.290 -1.113 -6.904 1.00 69.30 ? 32 PRO A CB 1 ATOM 77 C CG . PRO A 1 11 ? 48.145 -1.341 -8.380 1.00 66.32 ? 32 PRO A CG 1 ATOM 78 C CD . PRO A 1 11 ? 49.516 -1.428 -8.931 1.00 69.97 ? 32 PRO A CD 1 ATOM 79 N N . SER A 1 12 ? 50.527 -0.809 -4.459 1.00 77.73 ? 33 SER A N 1 ATOM 80 C CA . SER A 1 12 ? 51.310 -1.472 -3.430 1.00 78.17 ? 33 SER A CA 1 ATOM 81 C C . SER A 1 12 ? 50.425 -1.966 -2.291 1.00 79.61 ? 33 SER A C 1 ATOM 82 O O . SER A 1 12 ? 49.386 -1.371 -1.998 1.00 74.93 ? 33 SER A O 1 ATOM 83 C CB . SER A 1 12 ? 52.389 -0.528 -2.895 1.00 79.17 ? 33 SER A CB 1 ATOM 84 O OG . SER A 1 12 ? 53.290 -0.148 -3.922 1.00 81.56 ? 33 SER A OG 1 ATOM 85 N N . HIS A 1 13 ? 50.841 -3.060 -1.660 1.00 81.30 ? 34 HIS A N 1 ATOM 86 C CA . HIS A 1 13 ? 50.137 -3.588 -0.498 1.00 84.64 ? 34 HIS A CA 1 ATOM 87 C C . HIS A 1 13 ? 49.923 -2.471 0.507 1.00 83.25 ? 34 HIS A C 1 ATOM 88 O O . HIS A 1 13 ? 50.731 -1.547 0.599 1.00 78.65 ? 34 HIS A O 1 ATOM 89 C CB . HIS A 1 13 ? 50.912 -4.744 0.138 1.00 86.40 ? 34 HIS A CB 1 ATOM 90 C CG . HIS A 1 13 ? 50.981 -5.966 -0.726 1.00 96.45 ? 34 HIS A CG 1 ATOM 91 N ND1 . HIS A 1 13 ? 52.143 -6.383 -1.334 1.00 98.65 ? 34 HIS A ND1 1 ATOM 92 C CD2 . HIS A 1 13 ? 50.022 -6.848 -1.097 1.00 102.60 ? 34 HIS A CD2 1 ATOM 93 C CE1 . HIS A 1 13 ? 51.901 -7.477 -2.038 1.00 102.59 ? 34 HIS A CE1 1 ATOM 94 N NE2 . HIS A 1 13 ? 50.622 -7.778 -1.911 1.00 105.06 ? 34 HIS A NE2 1 ATOM 95 N N . VAL A 1 14 ? 48.823 -2.554 1.247 1.00 87.12 ? 35 VAL A N 1 ATOM 96 C CA . VAL A 1 14 ? 48.455 -1.502 2.183 1.00 91.62 ? 35 VAL A CA 1 ATOM 97 C C . VAL A 1 14 ? 47.826 -2.029 3.471 1.00 92.57 ? 35 VAL A C 1 ATOM 98 O O . VAL A 1 14 ? 46.924 -2.867 3.442 1.00 95.43 ? 35 VAL A O 1 ATOM 99 C CB . VAL A 1 14 ? 47.481 -0.499 1.529 1.00 93.61 ? 35 VAL A CB 1 ATOM 100 C CG1 . VAL A 1 14 ? 46.729 0.279 2.593 1.00 99.46 ? 35 VAL A CG1 1 ATOM 101 C CG2 . VAL A 1 14 ? 48.234 0.442 0.613 1.00 91.85 ? 35 VAL A CG2 1 ATOM 102 N N . MET A 1 15 ? 48.324 -1.539 4.601 1.00 90.37 ? 36 MET A N 1 ATOM 103 C CA . MET A 1 15 ? 47.642 -1.700 5.880 1.00 83.94 ? 36 MET A CA 1 ATOM 104 C C . MET A 1 15 ? 47.142 -0.328 6.310 1.00 81.72 ? 36 MET A C 1 ATOM 105 O O . MET A 1 15 ? 47.919 0.515 6.753 1.00 79.85 ? 36 MET A O 1 ATOM 106 C CB . MET A 1 15 ? 48.577 -2.292 6.937 1.00 90.78 ? 36 MET A CB 1 ATOM 107 C CG . MET A 1 15 ? 48.427 -3.796 7.140 1.00 91.07 ? 36 MET A CG 1 ATOM 108 S SD . MET A 1 15 ? 47.388 -4.214 8.555 1.00 85.81 ? 36 MET A SD 1 ATOM 109 C CE . MET A 1 15 ? 46.096 -2.990 8.407 1.00 63.21 ? 36 MET A CE 1 ATOM 110 N N . PHE A 1 16 ? 45.846 -0.094 6.153 1.00 88.08 ? 37 PHE A N 1 ATOM 111 C CA . PHE A 1 16 ? 45.297 1.236 6.372 1.00 95.58 ? 37 PHE A CA 1 ATOM 112 C C . PHE A 1 16 ? 44.553 1.356 7.699 1.00 98.58 ? 37 PHE A C 1 ATOM 113 O O . PHE A 1 16 ? 43.743 0.495 8.044 1.00 100.12 ? 37 PHE A O 1 ATOM 114 C CB . PHE A 1 16 ? 44.378 1.628 5.211 1.00 101.41 ? 37 PHE A CB 1 ATOM 115 C CG . PHE A 1 16 ? 43.935 3.064 5.249 1.00 107.67 ? 37 PHE A CG 1 ATOM 116 C CD1 . PHE A 1 16 ? 44.793 4.078 4.851 1.00 109.15 ? 37 PHE A CD1 1 ATOM 117 C CD2 . PHE A 1 16 ? 42.661 3.399 5.676 1.00 109.17 ? 37 PHE A CD2 1 ATOM 118 C CE1 . PHE A 1 16 ? 44.391 5.400 4.888 1.00 111.78 ? 37 PHE A CE1 1 ATOM 119 C CE2 . PHE A 1 16 ? 42.251 4.720 5.714 1.00 112.19 ? 37 PHE A CE2 1 ATOM 120 C CZ . PHE A 1 16 ? 43.117 5.722 5.321 1.00 113.79 ? 37 PHE A CZ 1 ATOM 121 N N . PRO A 1 17 ? 44.838 2.431 8.449 1.00 97.79 ? 38 PRO A N 1 ATOM 122 C CA . PRO A 1 17 ? 44.124 2.772 9.685 1.00 99.75 ? 38 PRO A CA 1 ATOM 123 C C . PRO A 1 17 ? 42.648 3.039 9.413 1.00 110.28 ? 38 PRO A C 1 ATOM 124 O O . PRO A 1 17 ? 42.302 3.500 8.331 1.00 118.82 ? 38 PRO A O 1 ATOM 125 C CB . PRO A 1 17 ? 44.800 4.072 10.131 1.00 95.12 ? 38 PRO A CB 1 ATOM 126 C CG . PRO A 1 17 ? 46.147 4.045 9.492 1.00 92.69 ? 38 PRO A CG 1 ATOM 127 C CD . PRO A 1 17 ? 45.955 3.353 8.179 1.00 91.23 ? 38 PRO A CD 1 ATOM 128 N N . LEU A 1 18 ? 41.786 2.753 10.378 1.00 115.63 ? 39 LEU A N 1 ATOM 129 C CA . LEU A 1 18 ? 40.379 3.110 10.251 1.00 126.90 ? 39 LEU A CA 1 ATOM 130 C C . LEU A 1 18 ? 40.075 4.352 11.088 1.00 142.10 ? 39 LEU A C 1 ATOM 131 O O . LEU A 1 18 ? 39.160 4.355 11.915 1.00 147.84 ? 39 LEU A O 1 ATOM 132 C CB . LEU A 1 18 ? 39.483 1.940 10.660 1.00 121.42 ? 39 LEU A CB 1 ATOM 133 C CG . LEU A 1 18 ? 39.362 0.788 9.663 1.00 111.48 ? 39 LEU A CG 1 ATOM 134 C CD1 . LEU A 1 18 ? 38.798 -0.444 10.353 1.00 108.88 ? 39 LEU A CD1 1 ATOM 135 C CD2 . LEU A 1 18 ? 38.492 1.200 8.483 1.00 110.71 ? 39 LEU A CD2 1 ATOM 136 N N . ASP A 1 19 ? 40.860 5.403 10.869 1.00 145.63 ? 40 ASP A N 1 ATOM 137 C CA . ASP A 1 19 ? 40.693 6.664 11.584 1.00 147.16 ? 40 ASP A CA 1 ATOM 138 C C . ASP A 1 19 ? 41.358 7.823 10.841 1.00 146.05 ? 40 ASP A C 1 ATOM 139 O O . ASP A 1 19 ? 40.728 8.489 10.017 1.00 145.93 ? 40 ASP A O 1 ATOM 140 C CB . ASP A 1 19 ? 41.242 6.559 13.011 1.00 145.36 ? 40 ASP A CB 1 ATOM 141 C CG . ASP A 1 19 ? 42.465 5.664 13.107 1.00 142.74 ? 40 ASP A CG 1 ATOM 142 O OD1 . ASP A 1 19 ? 42.293 4.436 13.257 1.00 142.29 ? 40 ASP A OD1 1 ATOM 143 O OD2 . ASP A 1 19 ? 43.597 6.189 13.051 1.00 140.74 ? 40 ASP A OD2 1 ATOM 144 N N . LYS A 1 24 ? 41.435 10.227 1.183 1.00 128.68 ? 45 LYS A N 1 ATOM 145 C CA . LYS A 1 24 ? 42.259 9.392 2.052 1.00 125.89 ? 45 LYS A CA 1 ATOM 146 C C . LYS A 1 24 ? 43.011 8.323 1.259 1.00 120.97 ? 45 LYS A C 1 ATOM 147 O O . LYS A 1 24 ? 43.813 8.650 0.384 1.00 125.50 ? 45 LYS A O 1 ATOM 148 C CB . LYS A 1 24 ? 41.413 8.763 3.164 1.00 127.24 ? 45 LYS A CB 1 ATOM 149 C CG . LYS A 1 24 ? 40.979 9.757 4.231 1.00 132.31 ? 45 LYS A CG 1 ATOM 150 C CD . LYS A 1 24 ? 40.299 9.074 5.405 1.00 134.61 ? 45 LYS A CD 1 ATOM 151 C CE . LYS A 1 24 ? 40.072 10.055 6.549 1.00 137.94 ? 45 LYS A CE 1 ATOM 152 N NZ . LYS A 1 24 ? 39.426 9.422 7.737 1.00 137.97 ? 45 LYS A NZ 1 ATOM 153 N N . VAL A 1 25 ? 42.746 7.055 1.558 1.00 113.09 ? 46 VAL A N 1 ATOM 154 C CA . VAL A 1 25 ? 43.478 5.943 0.943 1.00 112.27 ? 46 VAL A CA 1 ATOM 155 C C . VAL A 1 25 ? 43.643 6.049 -0.585 1.00 115.45 ? 46 VAL A C 1 ATOM 156 O O . VAL A 1 25 ? 42.668 6.176 -1.332 1.00 112.34 ? 46 VAL A O 1 ATOM 157 C CB . VAL A 1 25 ? 42.860 4.574 1.318 1.00 109.75 ? 46 VAL A CB 1 ATOM 158 C CG1 . VAL A 1 25 ? 41.396 4.525 0.934 1.00 112.55 ? 46 VAL A CG1 1 ATOM 159 C CG2 . VAL A 1 25 ? 43.627 3.440 0.654 1.00 106.09 ? 46 VAL A CG2 1 ATOM 160 N N . LYS A 1 26 ? 44.896 5.992 -1.031 1.00 113.70 ? 47 LYS A N 1 ATOM 161 C CA . LYS A 1 26 ? 45.232 6.072 -2.448 1.00 110.77 ? 47 LYS A CA 1 ATOM 162 C C . LYS A 1 26 ? 45.921 4.791 -2.913 1.00 107.13 ? 47 LYS A C 1 ATOM 163 O O . LYS A 1 26 ? 46.849 4.309 -2.263 1.00 109.64 ? 47 LYS A O 1 ATOM 164 C CB . LYS A 1 26 ? 46.126 7.291 -2.709 1.00 109.03 ? 47 LYS A CB 1 ATOM 165 C CG . LYS A 1 26 ? 47.026 7.192 -3.939 1.00 107.60 ? 47 LYS A CG 1 ATOM 166 C CD . LYS A 1 26 ? 47.606 8.562 -4.306 1.00 107.67 ? 47 LYS A CD 1 ATOM 167 C CE . LYS A 1 26 ? 49.044 8.471 -4.830 1.00 102.75 ? 47 LYS A CE 1 ATOM 168 N NZ . LYS A 1 26 ? 49.167 7.896 -6.202 1.00 96.50 ? 47 LYS A NZ 1 ATOM 169 N N . LEU A 1 27 ? 45.453 4.235 -4.027 1.00 101.35 ? 48 LEU A N 1 ATOM 170 C CA . LEU A 1 27 ? 46.081 3.057 -4.622 1.00 95.01 ? 48 LEU A CA 1 ATOM 171 C C . LEU A 1 27 ? 46.755 3.429 -5.942 1.00 98.15 ? 48 LEU A C 1 ATOM 172 O O . LEU A 1 27 ? 46.154 3.325 -7.013 1.00 96.90 ? 48 LEU A O 1 ATOM 173 C CB . LEU A 1 27 ? 45.060 1.934 -4.835 1.00 89.77 ? 48 LEU A CB 1 ATOM 174 C CG . LEU A 1 27 ? 44.559 1.213 -3.581 1.00 85.77 ? 48 LEU A CG 1 ATOM 175 C CD1 . LEU A 1 27 ? 43.643 0.054 -3.952 1.00 83.41 ? 48 LEU A CD1 1 ATOM 176 C CD2 . LEU A 1 27 ? 45.727 0.725 -2.738 1.00 85.74 ? 48 LEU A CD2 1 ATOM 177 N N . SER A 1 28 ? 48.009 3.861 -5.844 1.00 98.26 ? 49 SER A N 1 ATOM 178 C CA . SER A 1 28 ? 48.749 4.403 -6.979 1.00 96.23 ? 49 SER A CA 1 ATOM 179 C C . SER A 1 28 ? 48.863 3.439 -8.151 1.00 90.46 ? 49 SER A C 1 ATOM 180 O O . SER A 1 28 ? 49.063 2.240 -7.971 1.00 88.58 ? 49 SER A O 1 ATOM 181 C CB . SER A 1 28 ? 50.137 4.882 -6.540 1.00 102.41 ? 49 SER A CB 1 ATOM 182 O OG . SER A 1 28 ? 50.628 4.113 -5.452 1.00 105.48 ? 49 SER A OG 1 ATOM 183 N N . CYS A 1 29 ? 48.730 3.992 -9.353 1.00 88.79 ? 50 CYS A N 1 ATOM 184 C CA . CYS A 1 29 ? 48.805 3.234 -10.595 1.00 89.90 ? 50 CYS A CA 1 ATOM 185 C C . CYS A 1 29 ? 48.735 4.216 -11.756 1.00 95.59 ? 50 CYS A C 1 ATOM 186 O O . CYS A 1 29 ? 47.705 4.853 -11.976 1.00 99.04 ? 50 CYS A O 1 ATOM 187 C CB . CYS A 1 29 ? 47.651 2.228 -10.684 1.00 92.82 ? 50 CYS A CB 1 ATOM 188 S SG . CYS A 1 29 ? 47.562 1.239 -12.217 1.00 109.46 ? 50 CYS A SG 1 ATOM 189 N N . GLU A 1 30 ? 49.834 4.356 -12.489 1.00 96.93 ? 51 GLU A N 1 ATOM 190 C CA . GLU A 1 30 ? 49.836 5.212 -13.670 1.00 98.49 ? 51 GLU A CA 1 ATOM 191 C C . GLU A 1 30 ? 50.480 4.528 -14.872 1.00 88.01 ? 51 GLU A C 1 ATOM 192 O O . GLU A 1 30 ? 51.433 3.761 -14.741 1.00 75.57 ? 51 GLU A O 1 ATOM 193 C CB . GLU A 1 30 ? 50.506 6.561 -13.390 1.00 105.84 ? 51 GLU A CB 1 ATOM 194 C CG . GLU A 1 30 ? 52.003 6.493 -13.169 1.00 108.75 ? 51 GLU A CG 1 ATOM 195 C CD . GLU A 1 30 ? 52.656 7.860 -13.223 1.00 115.35 ? 51 GLU A CD 1 ATOM 196 O OE1 . GLU A 1 30 ? 52.491 8.561 -14.245 1.00 118.43 ? 51 GLU A OE1 1 ATOM 197 O OE2 . GLU A 1 30 ? 53.338 8.231 -12.245 1.00 117.88 ? 51 GLU A OE2 1 ATOM 198 N N . VAL A 1 31 ? 49.942 4.816 -16.049 1.00 88.86 ? 52 VAL A N 1 ATOM 199 C CA . VAL A 1 31 ? 50.374 4.141 -17.255 1.00 86.23 ? 52 VAL A CA 1 ATOM 200 C C . VAL A 1 31 ? 50.762 5.148 -18.335 1.00 88.93 ? 52 VAL A C 1 ATOM 201 O O . VAL A 1 31 ? 50.247 6.268 -18.374 1.00 89.66 ? 52 VAL A O 1 ATOM 202 C CB . VAL A 1 31 ? 49.268 3.201 -17.774 1.00 85.51 ? 52 VAL A CB 1 ATOM 203 C CG1 . VAL A 1 31 ? 48.137 4.010 -18.398 1.00 94.70 ? 52 VAL A CG1 1 ATOM 204 C CG2 . VAL A 1 31 ? 49.835 2.190 -18.766 1.00 78.56 ? 52 VAL A CG2 1 ATOM 205 N N . LYS A 1 32 ? 51.691 4.745 -19.194 1.00 86.89 ? 53 LYS A N 1 ATOM 206 C CA . LYS A 1 32 ? 52.034 5.522 -20.375 1.00 87.62 ? 53 LYS A CA 1 ATOM 207 C C . LYS A 1 32 ? 51.820 4.646 -21.602 1.00 92.05 ? 53 LYS A C 1 ATOM 208 O O . LYS A 1 32 ? 51.836 3.417 -21.505 1.00 87.57 ? 53 LYS A O 1 ATOM 209 C CB . LYS A 1 32 ? 53.486 5.997 -20.312 1.00 86.66 ? 53 LYS A CB 1 ATOM 210 C CG . LYS A 1 32 ? 54.503 4.905 -20.597 1.00 84.08 ? 53 LYS A CG 1 ATOM 211 C CD . LYS A 1 32 ? 55.927 5.424 -20.485 1.00 91.63 ? 53 LYS A CD 1 ATOM 212 C CE . LYS A 1 32 ? 56.935 4.323 -20.786 1.00 95.51 ? 53 LYS A CE 1 ATOM 213 N NZ . LYS A 1 32 ? 58.339 4.778 -20.595 1.00 100.26 ? 53 LYS A NZ 1 ATOM 214 N N . GLY A 1 33 ? 51.615 5.278 -22.752 1.00 93.75 ? 54 GLY A N 1 ATOM 215 C CA . GLY A 1 33 ? 51.387 4.548 -23.982 1.00 92.55 ? 54 GLY A CA 1 ATOM 216 C C . GLY A 1 33 ? 50.643 5.388 -24.998 1.00 97.13 ? 54 GLY A C 1 ATOM 217 O O . GLY A 1 33 ? 50.039 6.403 -24.650 1.00 97.31 ? 54 GLY A O 1 ATOM 218 N N . ASN A 1 34 ? 50.683 4.957 -26.254 1.00 99.81 ? 55 ASN A N 1 ATOM 219 C CA . ASN A 1 34 ? 50.079 5.704 -27.354 1.00 106.22 ? 55 ASN A CA 1 ATOM 220 C C . ASN A 1 34 ? 49.344 4.786 -28.330 1.00 104.51 ? 55 ASN A C 1 ATOM 221 O O . ASN A 1 34 ? 49.974 3.984 -29.022 1.00 104.99 ? 55 ASN A O 1 ATOM 222 C CB . ASN A 1 34 ? 51.158 6.500 -28.092 1.00 109.44 ? 55 ASN A CB 1 ATOM 223 C CG . ASN A 1 34 ? 50.615 7.254 -29.293 1.00 113.37 ? 55 ASN A CG 1 ATOM 224 O OD1 . ASN A 1 34 ? 49.488 7.755 -29.272 1.00 114.59 ? 55 ASN A OD1 1 ATOM 225 N ND2 . ASN A 1 34 ? 51.422 7.344 -30.348 1.00 107.91 ? 55 ASN A ND2 1 ATOM 226 N N . PRO A 1 35 ? 48.008 4.908 -28.404 1.00 101.81 ? 56 PRO A N 1 ATOM 227 C CA . PRO A 1 35 ? 47.152 5.875 -27.700 1.00 106.45 ? 56 PRO A CA 1 ATOM 228 C C . PRO A 1 35 ? 47.154 5.751 -26.175 1.00 110.29 ? 56 PRO A C 1 ATOM 229 O O . PRO A 1 35 ? 47.320 4.661 -25.619 1.00 105.13 ? 56 PRO A O 1 ATOM 230 C CB . PRO A 1 35 ? 45.748 5.558 -28.236 1.00 106.38 ? 56 PRO A CB 1 ATOM 231 C CG . PRO A 1 35 ? 45.974 4.839 -29.520 1.00 106.48 ? 56 PRO A CG 1 ATOM 232 C CD . PRO A 1 35 ? 47.231 4.056 -29.319 1.00 101.11 ? 56 PRO A CD 1 ATOM 233 N N . LYS A 1 36 ? 46.965 6.889 -25.514 1.00 113.99 ? 57 LYS A N 1 ATOM 234 C CA . LYS A 1 36 ? 46.805 6.941 -24.070 1.00 115.08 ? 57 LYS A CA 1 ATOM 235 C C . LYS A 1 36 ? 45.838 5.849 -23.627 1.00 114.23 ? 57 LYS A C 1 ATOM 236 O O . LYS A 1 36 ? 44.690 5.817 -24.069 1.00 121.06 ? 57 LYS A O 1 ATOM 237 C CB . LYS A 1 36 ? 46.283 8.322 -23.667 1.00 121.27 ? 57 LYS A CB 1 ATOM 238 C CG . LYS A 1 36 ? 46.182 8.565 -22.175 1.00 125.42 ? 57 LYS A CG 1 ATOM 239 C CD . LYS A 1 36 ? 44.825 8.154 -21.635 1.00 131.46 ? 57 LYS A CD 1 ATOM 240 C CE . LYS A 1 36 ? 44.523 8.877 -20.334 1.00 137.07 ? 57 LYS A CE 1 ATOM 241 N NZ . LYS A 1 36 ? 44.588 10.355 -20.514 1.00 141.57 ? 57 LYS A NZ 1 ATOM 242 N N . PRO A 1 37 ? 46.310 4.938 -22.761 1.00 104.07 ? 58 PRO A N 1 ATOM 243 C CA . PRO A 1 37 ? 45.539 3.776 -22.303 1.00 98.50 ? 58 PRO A CA 1 ATOM 244 C C . PRO A 1 37 ? 44.522 4.135 -21.227 1.00 96.91 ? 58 PRO A C 1 ATOM 245 O O . PRO A 1 37 ? 44.803 4.989 -20.386 1.00 89.80 ? 58 PRO A O 1 ATOM 246 C CB . PRO A 1 37 ? 46.612 2.852 -21.709 1.00 92.16 ? 58 PRO A CB 1 ATOM 247 C CG . PRO A 1 37 ? 47.931 3.428 -22.142 1.00 91.30 ? 58 PRO A CG 1 ATOM 248 C CD . PRO A 1 37 ? 47.696 4.892 -22.275 1.00 96.44 ? 58 PRO A CD 1 ATOM 249 N N . HIS A 1 38 ? 43.358 3.488 -21.264 1.00 104.24 ? 59 HIS A N 1 ATOM 250 C CA . HIS A 1 38 ? 42.333 3.663 -20.239 1.00 108.13 ? 59 HIS A CA 1 ATOM 251 C C . HIS A 1 38 ? 42.551 2.672 -19.098 1.00 108.67 ? 59 HIS A C 1 ATOM 252 O O . HIS A 1 38 ? 42.993 1.547 -19.324 1.00 109.26 ? 59 HIS A O 1 ATOM 253 C CB . HIS A 1 38 ? 40.934 3.477 -20.830 1.00 118.16 ? 59 HIS A CB 1 ATOM 254 C CG . HIS A 1 38 ? 39.871 3.247 -19.800 1.00 131.41 ? 59 HIS A CG 1 ATOM 255 N ND1 . HIS A 1 38 ? 39.523 4.197 -18.863 1.00 136.49 ? 59 HIS A ND1 1 ATOM 256 C CD2 . HIS A 1 38 ? 39.083 2.172 -19.554 1.00 135.16 ? 59 HIS A CD2 1 ATOM 257 C CE1 . HIS A 1 38 ? 38.568 3.719 -18.086 1.00 136.98 ? 59 HIS A CE1 1 ATOM 258 N NE2 . HIS A 1 38 ? 38.282 2.493 -18.484 1.00 137.03 ? 59 HIS A NE2 1 ATOM 259 N N . ILE A 1 39 ? 42.229 3.087 -17.876 1.00 107.40 ? 60 ILE A N 1 ATOM 260 C CA . ILE A 1 39 ? 42.513 2.269 -16.702 1.00 103.93 ? 60 ILE A CA 1 ATOM 261 C C . ILE A 1 39 ? 41.268 1.865 -15.918 1.00 106.90 ? 60 ILE A C 1 ATOM 262 O O . ILE A 1 39 ? 40.378 2.679 -15.665 1.00 107.13 ? 60 ILE A O 1 ATOM 263 C CB . ILE A 1 39 ? 43.539 2.956 -15.773 1.00 103.59 ? 60 ILE A CB 1 ATOM 264 C CG1 . ILE A 1 39 ? 44.947 2.809 -16.361 1.00 106.23 ? 60 ILE A CG1 1 ATOM 265 C CG2 . ILE A 1 39 ? 43.475 2.372 -14.368 1.00 102.09 ? 60 ILE A CG2 1 ATOM 266 C CD1 . ILE A 1 39 ? 45.988 3.696 -15.716 1.00 107.43 ? 60 ILE A CD1 1 ATOM 267 N N . ARG A 1 40 ? 41.225 0.590 -15.543 1.00 106.89 ? 61 ARG A N 1 ATOM 268 C CA . ARG A 1 40 ? 40.114 0.022 -14.789 1.00 104.38 ? 61 ARG A CA 1 ATOM 269 C C . ARG A 1 40 ? 40.645 -0.768 -13.581 1.00 98.09 ? 61 ARG A C 1 ATOM 270 O O . ARG A 1 40 ? 41.820 -1.138 -13.544 1.00 95.83 ? 61 ARG A O 1 ATOM 271 C CB . ARG A 1 40 ? 39.261 -0.862 -15.709 1.00 102.22 ? 61 ARG A CB 1 ATOM 272 C CG . ARG A 1 40 ? 38.417 -1.904 -14.993 1.00 108.21 ? 61 ARG A CG 1 ATOM 273 C CD . ARG A 1 40 ? 37.888 -2.927 -15.973 1.00 110.98 ? 61 ARG A CD 1 ATOM 274 N NE . ARG A 1 40 ? 38.669 -2.925 -17.203 1.00 110.61 ? 61 ARG A NE 1 ATOM 275 C CZ . ARG A 1 40 ? 38.934 -4.009 -17.924 1.00 113.13 ? 61 ARG A CZ 1 ATOM 276 N NH1 . ARG A 1 40 ? 38.496 -5.196 -17.518 1.00 112.94 ? 61 ARG A NH1 1 ATOM 277 N NH2 . ARG A 1 40 ? 39.653 -3.909 -19.040 1.00 110.66 ? 61 ARG A NH2 1 ATOM 278 N N . TRP A 1 41 ? 39.780 -1.017 -12.599 1.00 96.68 ? 62 TRP A N 1 ATOM 279 C CA . TRP A 1 41 ? 40.177 -1.689 -11.358 1.00 94.86 ? 62 TRP A CA 1 ATOM 280 C C . TRP A 1 41 ? 39.370 -2.957 -11.056 1.00 92.77 ? 62 TRP A C 1 ATOM 281 O O . TRP A 1 41 ? 38.255 -3.124 -11.538 1.00 94.36 ? 62 TRP A O 1 ATOM 282 C CB . TRP A 1 41 ? 40.076 -0.717 -10.183 1.00 93.63 ? 62 TRP A CB 1 ATOM 283 C CG . TRP A 1 41 ? 41.107 0.364 -10.218 1.00 97.03 ? 62 TRP A CG 1 ATOM 284 C CD1 . TRP A 1 41 ? 41.010 1.574 -10.844 1.00 101.12 ? 62 TRP A CD1 1 ATOM 285 C CD2 . TRP A 1 41 ? 42.399 0.334 -9.602 1.00 99.26 ? 62 TRP A CD2 1 ATOM 286 N NE1 . TRP A 1 41 ? 42.160 2.300 -10.651 1.00 100.45 ? 62 TRP A NE1 1 ATOM 287 C CE2 . TRP A 1 41 ? 43.029 1.560 -9.892 1.00 100.53 ? 62 TRP A CE2 1 ATOM 288 C CE3 . TRP A 1 41 ? 43.082 -0.611 -8.827 1.00 97.07 ? 62 TRP A CE3 1 ATOM 289 C CZ2 . TRP A 1 41 ? 44.311 1.866 -9.438 1.00 101.91 ? 62 TRP A CZ2 1 ATOM 290 C CZ3 . TRP A 1 41 ? 44.352 -0.305 -8.376 1.00 96.06 ? 62 TRP A CZ3 1 ATOM 291 C CH2 . TRP A 1 41 ? 44.954 0.922 -8.683 1.00 100.17 ? 62 TRP A CH2 1 ATOM 292 N N . LYS A 1 42 ? 39.939 -3.850 -10.251 1.00 92.64 ? 63 LYS A N 1 ATOM 293 C CA . LYS A 1 42 ? 39.259 -5.097 -9.910 1.00 98.94 ? 63 LYS A CA 1 ATOM 294 C C . LYS A 1 42 ? 39.480 -5.529 -8.459 1.00 103.03 ? 63 LYS A C 1 ATOM 295 O O . LYS A 1 42 ? 40.605 -5.815 -8.050 1.00 104.93 ? 63 LYS A O 1 ATOM 296 C CB . LYS A 1 42 ? 39.672 -6.221 -10.869 1.00 95.48 ? 63 LYS A CB 1 ATOM 297 C CG . LYS A 1 42 ? 39.034 -6.118 -12.237 1.00 108.38 ? 63 LYS A CG 1 ATOM 298 C CD . LYS A 1 42 ? 39.100 -7.435 -12.999 1.00 117.32 ? 63 LYS A CD 1 ATOM 299 C CE . LYS A 1 42 ? 40.495 -7.704 -13.544 1.00 118.68 ? 63 LYS A CE 1 ATOM 300 N NZ . LYS A 1 42 ? 40.554 -8.964 -14.338 1.00 117.65 ? 63 LYS A NZ 1 ATOM 301 N N . LEU A 1 43 ? 38.397 -5.580 -7.689 1.00 106.57 ? 64 LEU A N 1 ATOM 302 C CA . LEU A 1 43 ? 38.456 -6.030 -6.298 1.00 109.32 ? 64 LEU A CA 1 ATOM 303 C C . LEU A 1 43 ? 38.052 -7.497 -6.191 1.00 113.86 ? 64 LEU A C 1 ATOM 304 O O . LEU A 1 43 ? 36.948 -7.873 -6.582 1.00 120.60 ? 64 LEU A O 1 ATOM 305 C CB . LEU A 1 43 ? 37.562 -5.162 -5.411 1.00 107.62 ? 64 LEU A CB 1 ATOM 306 C CG . LEU A 1 43 ? 37.470 -5.516 -3.927 1.00 114.64 ? 64 LEU A CG 1 ATOM 307 C CD1 . LEU A 1 43 ? 38.824 -5.926 -3.354 1.00 112.36 ? 64 LEU A CD1 1 ATOM 308 C CD2 . LEU A 1 43 ? 36.888 -4.347 -3.151 1.00 119.62 ? 64 LEU A CD2 1 ATOM 309 N N . ASN A 1 44 ? 38.955 -8.320 -5.668 1.00 127.90 ? 65 ASN A N 1 ATOM 310 C CA . ASN A 1 44 ? 38.742 -9.764 -5.597 1.00 135.70 ? 65 ASN A CA 1 ATOM 311 C C . ASN A 1 44 ? 38.490 -10.392 -6.969 1.00 138.12 ? 65 ASN A C 1 ATOM 312 O O . ASN A 1 44 ? 38.352 -11.610 -7.084 1.00 142.11 ? 65 ASN A O 1 ATOM 313 C CB . ASN A 1 44 ? 37.604 -10.110 -4.629 1.00 145.77 ? 65 ASN A CB 1 ATOM 314 C CG . ASN A 1 44 ? 38.036 -10.070 -3.169 1.00 151.06 ? 65 ASN A CG 1 ATOM 315 O OD1 . ASN A 1 44 ? 39.110 -9.563 -2.839 1.00 141.51 ? 65 ASN A OD1 1 ATOM 316 N ND2 . ASN A 1 44 ? 37.190 -10.609 -2.286 1.00 168.31 ? 65 ASN A ND2 1 ATOM 317 N N . GLY A 1 45 ? 38.433 -9.557 -8.003 1.00 134.05 ? 66 GLY A N 1 ATOM 318 C CA . GLY A 1 45 ? 38.234 -10.030 -9.360 1.00 126.85 ? 66 GLY A CA 1 ATOM 319 C C . GLY A 1 45 ? 37.091 -9.345 -10.086 1.00 125.67 ? 66 GLY A C 1 ATOM 320 O O . GLY A 1 45 ? 36.934 -9.503 -11.297 1.00 121.85 ? 66 GLY A O 1 ATOM 321 N N . THR A 1 46 ? 36.290 -8.578 -9.355 1.00 126.60 ? 67 THR A N 1 ATOM 322 C CA . THR A 1 46 ? 35.119 -7.939 -9.948 1.00 128.79 ? 67 THR A CA 1 ATOM 323 C C . THR A 1 46 ? 35.355 -6.470 -10.276 1.00 125.77 ? 67 THR A C 1 ATOM 324 O O . THR A 1 46 ? 35.797 -5.695 -9.430 1.00 123.92 ? 67 THR A O 1 ATOM 325 C CB . THR A 1 46 ? 33.892 -8.054 -9.031 1.00 133.33 ? 67 THR A CB 1 ATOM 326 O OG1 . THR A 1 46 ? 33.647 -9.435 -8.734 1.00 132.23 ? 67 THR A OG1 1 ATOM 327 C CG2 . THR A 1 46 ? 32.667 -7.452 -9.705 1.00 135.35 ? 67 THR A CG2 1 ATOM 328 N N . ASP A 1 47 ? 35.051 -6.095 -11.513 1.00 129.65 ? 68 ASP A N 1 ATOM 329 C CA . ASP A 1 47 ? 35.217 -4.718 -11.958 1.00 133.17 ? 68 ASP A CA 1 ATOM 330 C C . ASP A 1 47 ? 34.544 -3.728 -11.013 1.00 136.47 ? 68 ASP A C 1 ATOM 331 O O . ASP A 1 47 ? 33.350 -3.833 -10.729 1.00 142.65 ? 68 ASP A O 1 ATOM 332 C CB . ASP A 1 47 ? 34.679 -4.541 -13.379 1.00 138.15 ? 68 ASP A CB 1 ATOM 333 C CG . ASP A 1 47 ? 35.663 -5.000 -14.438 1.00 139.05 ? 68 ASP A CG 1 ATOM 334 O OD1 . ASP A 1 47 ? 36.694 -5.607 -14.078 1.00 130.13 ? 68 ASP A OD1 1 ATOM 335 O OD2 . ASP A 1 47 ? 35.406 -4.749 -15.635 1.00 145.91 ? 68 ASP A OD2 1 ATOM 336 N N . VAL A 1 48 ? 35.326 -2.770 -10.530 1.00 130.42 ? 69 VAL A N 1 ATOM 337 C CA . VAL A 1 48 ? 34.816 -1.715 -9.667 1.00 129.32 ? 69 VAL A CA 1 ATOM 338 C C . VAL A 1 48 ? 34.181 -0.606 -10.500 1.00 136.83 ? 69 VAL A C 1 ATOM 339 O O . VAL A 1 48 ? 34.853 0.025 -11.317 1.00 136.99 ? 69 VAL A O 1 ATOM 340 C CB . VAL A 1 48 ? 35.944 -1.119 -8.807 1.00 119.38 ? 69 VAL A CB 1 ATOM 341 C CG1 . VAL A 1 48 ? 35.468 0.132 -8.089 1.00 120.73 ? 69 VAL A CG1 1 ATOM 342 C CG2 . VAL A 1 48 ? 36.453 -2.152 -7.818 1.00 112.37 ? 69 VAL A CG2 1 ATOM 343 N N . ASP A 1 49 ? 32.885 -0.379 -10.302 1.00 139.11 ? 70 ASP A N 1 ATOM 344 C CA . ASP A 1 49 ? 32.184 0.686 -11.015 1.00 142.11 ? 70 ASP A CA 1 ATOM 345 C C . ASP A 1 49 ? 32.403 2.019 -10.306 1.00 144.92 ? 70 ASP A C 1 ATOM 346 O O . ASP A 1 49 ? 31.706 2.348 -9.347 1.00 144.37 ? 70 ASP A O 1 ATOM 347 C CB . ASP A 1 49 ? 30.691 0.377 -11.133 1.00 145.04 ? 70 ASP A CB 1 ATOM 348 C CG . ASP A 1 49 ? 30.026 1.139 -12.268 1.00 149.17 ? 70 ASP A CG 1 ATOM 349 O OD1 . ASP A 1 49 ? 30.709 1.958 -12.920 1.00 149.18 ? 70 ASP A OD1 1 ATOM 350 O OD2 . ASP A 1 49 ? 28.821 0.916 -12.513 1.00 151.76 ? 70 ASP A OD2 1 ATOM 351 N N . ILE A 1 50 ? 33.372 2.783 -10.800 1.00 148.90 ? 71 ILE A N 1 ATOM 352 C CA . ILE A 1 50 ? 33.850 3.990 -10.127 1.00 153.93 ? 71 ILE A CA 1 ATOM 353 C C . ILE A 1 50 ? 32.854 5.150 -10.118 1.00 159.97 ? 71 ILE A C 1 ATOM 354 O O . ILE A 1 50 ? 32.628 5.772 -9.079 1.00 158.11 ? 71 ILE A O 1 ATOM 355 C CB . ILE A 1 50 ? 35.188 4.463 -10.736 1.00 152.40 ? 71 ILE A CB 1 ATOM 356 C CG1 . ILE A 1 50 ? 36.321 3.527 -10.302 1.00 141.42 ? 71 ILE A CG1 1 ATOM 357 C CG2 . ILE A 1 50 ? 35.482 5.898 -10.325 1.00 156.79 ? 71 ILE A CG2 1 ATOM 358 C CD1 . ILE A 1 50 ? 37.335 3.233 -11.390 1.00 133.88 ? 71 ILE A CD1 1 ATOM 359 N N . GLY A 1 51 ? 32.267 5.441 -11.274 1.00 166.64 ? 72 GLY A N 1 ATOM 360 C CA . GLY A 1 51 ? 31.325 6.540 -11.391 1.00 173.09 ? 72 GLY A CA 1 ATOM 361 C C . GLY A 1 51 ? 30.069 6.320 -10.569 1.00 178.21 ? 72 GLY A C 1 ATOM 362 O O . GLY A 1 51 ? 29.281 7.244 -10.360 1.00 179.93 ? 72 GLY A O 1 ATOM 363 N N . MET A 1 52 ? 29.890 5.091 -10.095 1.00 180.32 ? 73 MET A N 1 ATOM 364 C CA . MET A 1 52 ? 28.689 4.721 -9.359 1.00 185.83 ? 73 MET A CA 1 ATOM 365 C C . MET A 1 52 ? 28.783 3.301 -8.799 1.00 184.09 ? 73 MET A C 1 ATOM 366 O O . MET A 1 52 ? 28.792 2.323 -9.547 1.00 182.80 ? 73 MET A O 1 ATOM 367 C CB . MET A 1 52 ? 27.465 4.875 -10.261 1.00 193.23 ? 73 MET A CB 1 ATOM 368 C CG . MET A 1 52 ? 26.271 4.040 -9.870 1.00 196.62 ? 73 MET A CG 1 ATOM 369 S SD . MET A 1 52 ? 25.527 4.514 -8.301 1.00 305.51 ? 73 MET A SD 1 ATOM 370 C CE . MET A 1 52 ? 25.380 6.288 -8.480 1.00 222.70 ? 73 MET A CE 1 ATOM 371 N N . ASP A 1 53 ? 28.840 3.204 -7.473 1.00 185.06 ? 74 ASP A N 1 ATOM 372 C CA . ASP A 1 53 ? 28.721 4.390 -6.634 1.00 189.82 ? 74 ASP A CA 1 ATOM 373 C C . ASP A 1 53 ? 29.628 4.428 -5.422 1.00 186.39 ? 74 ASP A C 1 ATOM 374 O O . ASP A 1 53 ? 29.694 3.474 -4.656 1.00 185.83 ? 74 ASP A O 1 ATOM 375 C CB . ASP A 1 53 ? 27.297 4.538 -6.119 1.00 198.51 ? 74 ASP A CB 1 ATOM 376 C CG . ASP A 1 53 ? 27.110 5.797 -5.302 1.00 204.33 ? 74 ASP A CG 1 ATOM 377 O OD1 . ASP A 1 53 ? 27.667 6.845 -5.695 1.00 205.43 ? 74 ASP A OD1 1 ATOM 378 O OD2 . ASP A 1 53 ? 26.411 5.740 -4.269 1.00 206.81 ? 74 ASP A OD2 1 ATOM 379 N N . PHE A 1 54 ? 30.293 5.565 -5.255 1.00 186.33 ? 75 PHE A N 1 ATOM 380 C CA . PHE A 1 54 ? 30.917 5.964 -4.001 1.00 188.61 ? 75 PHE A CA 1 ATOM 381 C C . PHE A 1 54 ? 31.396 7.390 -4.200 1.00 188.12 ? 75 PHE A C 1 ATOM 382 O O . PHE A 1 54 ? 30.810 8.155 -4.969 1.00 185.92 ? 75 PHE A O 1 ATOM 383 C CB . PHE A 1 54 ? 32.114 5.075 -3.636 1.00 188.54 ? 75 PHE A CB 1 ATOM 384 C CG . PHE A 1 54 ? 31.738 3.705 -3.136 1.00 188.46 ? 75 PHE A CG 1 ATOM 385 C CD1 . PHE A 1 54 ? 32.006 2.583 -3.900 1.00 187.92 ? 75 PHE A CD1 1 ATOM 386 C CD2 . PHE A 1 54 ? 31.121 3.536 -1.908 1.00 189.87 ? 75 PHE A CD2 1 ATOM 387 C CE1 . PHE A 1 54 ? 31.667 1.320 -3.458 1.00 186.73 ? 75 PHE A CE1 1 ATOM 388 C CE2 . PHE A 1 54 ? 30.778 2.271 -1.458 1.00 190.17 ? 75 PHE A CE2 1 ATOM 389 C CZ . PHE A 1 54 ? 31.053 1.162 -2.237 1.00 188.10 ? 75 PHE A CZ 1 ATOM 390 N N . ARG A 1 55 ? 32.464 7.741 -3.496 1.00 189.24 ? 76 ARG A N 1 ATOM 391 C CA . ARG A 1 55 ? 33.223 8.934 -3.817 1.00 190.91 ? 76 ARG A CA 1 ATOM 392 C C . ARG A 1 55 ? 34.590 8.476 -4.307 1.00 180.97 ? 76 ARG A C 1 ATOM 393 O O . ARG A 1 55 ? 35.628 8.958 -3.849 1.00 178.80 ? 76 ARG A O 1 ATOM 394 C CB . ARG A 1 55 ? 33.364 9.851 -2.604 1.00 199.13 ? 76 ARG A CB 1 ATOM 395 C CG . ARG A 1 55 ? 33.693 11.290 -2.970 1.00 208.36 ? 76 ARG A CG 1 ATOM 396 C CD . ARG A 1 55 ? 34.494 11.974 -1.875 1.00 214.97 ? 76 ARG A CD 1 ATOM 397 N NE . ARG A 1 55 ? 34.731 13.386 -2.165 1.00 222.18 ? 76 ARG A NE 1 ATOM 398 C CZ . ARG A 1 55 ? 35.600 13.833 -3.067 1.00 224.00 ? 76 ARG A CZ 1 ATOM 399 N NH1 . ARG A 1 55 ? 36.321 12.980 -3.783 1.00 221.39 ? 76 ARG A NH1 1 ATOM 400 N NH2 . ARG A 1 55 ? 35.746 15.137 -3.257 1.00 227.01 ? 76 ARG A NH2 1 ATOM 401 N N . TYR A 1 56 ? 34.577 7.513 -5.224 1.00 171.28 ? 77 TYR A N 1 ATOM 402 C CA . TYR A 1 56 ? 35.795 7.061 -5.876 1.00 156.68 ? 77 TYR A CA 1 ATOM 403 C C . TYR A 1 56 ? 36.303 8.166 -6.785 1.00 153.75 ? 77 TYR A C 1 ATOM 404 O O . TYR A 1 56 ? 35.527 8.797 -7.500 1.00 158.10 ? 77 TYR A O 1 ATOM 405 C CB . TYR A 1 56 ? 35.537 5.803 -6.706 1.00 150.26 ? 77 TYR A CB 1 ATOM 406 C CG . TYR A 1 56 ? 35.375 4.530 -5.904 1.00 142.81 ? 77 TYR A CG 1 ATOM 407 C CD1 . TYR A 1 56 ? 36.153 4.287 -4.779 1.00 139.35 ? 77 TYR A CD1 1 ATOM 408 C CD2 . TYR A 1 56 ? 34.465 3.555 -6.292 1.00 138.97 ? 77 TYR A CD2 1 ATOM 409 C CE1 . TYR A 1 56 ? 36.014 3.117 -4.049 1.00 134.62 ? 77 TYR A CE1 1 ATOM 410 C CE2 . TYR A 1 56 ? 34.325 2.380 -5.577 1.00 134.26 ? 77 TYR A CE2 1 ATOM 411 C CZ . TYR A 1 56 ? 35.098 2.166 -4.452 1.00 131.26 ? 77 TYR A CZ 1 ATOM 412 O OH . TYR A 1 56 ? 34.959 1.000 -3.728 1.00 123.27 ? 77 TYR A OH 1 ATOM 413 N N . SER A 1 57 ? 37.607 8.398 -6.758 1.00 148.17 ? 78 SER A N 1 ATOM 414 C CA . SER A 1 57 ? 38.207 9.421 -7.598 1.00 147.19 ? 78 SER A CA 1 ATOM 415 C C . SER A 1 57 ? 39.445 8.875 -8.300 1.00 142.50 ? 78 SER A C 1 ATOM 416 O O . SER A 1 57 ? 40.531 8.852 -7.725 1.00 147.19 ? 78 SER A O 1 ATOM 417 C CB . SER A 1 57 ? 38.567 10.647 -6.759 1.00 146.79 ? 78 SER A CB 1 ATOM 418 O OG . SER A 1 57 ? 39.172 11.649 -7.555 1.00 147.73 ? 78 SER A OG 1 ATOM 419 N N . VAL A 1 58 ? 39.279 8.427 -9.540 1.00 132.93 ? 79 VAL A N 1 ATOM 420 C CA . VAL A 1 58 ? 40.391 7.860 -10.289 1.00 124.68 ? 79 VAL A CA 1 ATOM 421 C C . VAL A 1 58 ? 41.275 8.964 -10.833 1.00 131.65 ? 79 VAL A C 1 ATOM 422 O O . VAL A 1 58 ? 41.116 9.391 -11.974 1.00 135.02 ? 79 VAL A O 1 ATOM 423 C CB . VAL A 1 58 ? 39.907 7.000 -11.459 1.00 118.31 ? 79 VAL A CB 1 ATOM 424 C CG1 . VAL A 1 58 ? 41.067 6.213 -12.046 1.00 108.97 ? 79 VAL A CG1 1 ATOM 425 C CG2 . VAL A 1 58 ? 38.818 6.068 -10.994 1.00 119.26 ? 79 VAL A CG2 1 ATOM 426 N N . VAL A 1 59 ? 42.207 9.427 -10.009 1.00 137.62 ? 80 VAL A N 1 ATOM 427 C CA . VAL A 1 59 ? 43.120 10.487 -10.412 1.00 144.82 ? 80 VAL A CA 1 ATOM 428 C C . VAL A 1 59 ? 44.361 9.908 -11.092 1.00 140.95 ? 80 VAL A C 1 ATOM 429 O O . VAL A 1 59 ? 45.204 9.276 -10.449 1.00 131.90 ? 80 VAL A O 1 ATOM 430 C CB . VAL A 1 59 ? 43.518 11.380 -9.214 1.00 149.34 ? 80 VAL A CB 1 ATOM 431 C CG1 . VAL A 1 59 ? 44.184 10.553 -8.117 1.00 143.67 ? 80 VAL A CG1 1 ATOM 432 C CG2 . VAL A 1 59 ? 44.422 12.513 -9.671 1.00 152.19 ? 80 VAL A CG2 1 ATOM 433 N N . ASP A 1 60 ? 44.456 10.124 -12.401 1.00 146.01 ? 81 ASP A N 1 ATOM 434 C CA . ASP A 1 60 ? 45.565 9.606 -13.198 1.00 143.32 ? 81 ASP A CA 1 ATOM 435 C C . ASP A 1 60 ? 45.859 8.145 -12.878 1.00 134.54 ? 81 ASP A C 1 ATOM 436 O O . ASP A 1 60 ? 46.954 7.805 -12.428 1.00 133.51 ? 81 ASP A O 1 ATOM 437 C CB . ASP A 1 60 ? 46.820 10.458 -13.000 1.00 146.58 ? 81 ASP A CB 1 ATOM 438 C CG . ASP A 1 60 ? 46.649 11.872 -13.522 1.00 155.72 ? 81 ASP A CG 1 ATOM 439 O OD1 . ASP A 1 60 ? 45.630 12.512 -13.186 1.00 159.26 ? 81 ASP A OD1 1 ATOM 440 O OD2 . ASP A 1 60 ? 47.535 12.343 -14.268 1.00 157.94 ? 81 ASP A OD2 1 ATOM 441 N N . GLY A 1 61 ? 44.872 7.286 -13.113 1.00 127.95 ? 82 GLY A N 1 ATOM 442 C CA . GLY A 1 61 ? 45.015 5.867 -12.856 1.00 114.99 ? 82 GLY A CA 1 ATOM 443 C C . GLY A 1 61 ? 44.779 5.497 -11.406 1.00 106.71 ? 82 GLY A C 1 ATOM 444 O O . GLY A 1 61 ? 43.989 4.600 -11.114 1.00 110.82 ? 82 GLY A O 1 ATOM 445 N N . SER A 1 62 ? 45.458 6.195 -10.498 1.00 98.47 ? 83 SER A N 1 ATOM 446 C CA . SER A 1 62 ? 45.401 5.875 -9.069 1.00 96.09 ? 83 SER A CA 1 ATOM 447 C C . SER A 1 62 ? 43.990 5.987 -8.501 1.00 101.34 ? 83 SER A C 1 ATOM 448 O O . SER A 1 62 ? 43.382 7.057 -8.526 1.00 106.32 ? 83 SER A O 1 ATOM 449 C CB . SER A 1 62 ? 46.357 6.769 -8.271 1.00 95.16 ? 83 SER A CB 1 ATOM 450 O OG . SER A 1 62 ? 47.711 6.534 -8.627 1.00 92.97 ? 83 SER A OG 1 ATOM 451 N N . LEU A 1 63 ? 43.480 4.874 -7.984 1.00 100.28 ? 84 LEU A N 1 ATOM 452 C CA . LEU A 1 63 ? 42.151 4.833 -7.385 1.00 102.39 ? 84 LEU A CA 1 ATOM 453 C C . LEU A 1 63 ? 42.148 5.412 -5.975 1.00 104.47 ? 84 LEU A C 1 ATOM 454 O O . LEU A 1 63 ? 42.943 5.006 -5.125 1.00 101.48 ? 84 LEU A O 1 ATOM 455 C CB . LEU A 1 63 ? 41.628 3.394 -7.348 1.00 98.00 ? 84 LEU A CB 1 ATOM 456 C CG . LEU A 1 63 ? 40.409 3.129 -6.458 1.00 98.05 ? 84 LEU A CG 1 ATOM 457 C CD1 . LEU A 1 63 ? 39.168 3.788 -7.037 1.00 98.72 ? 84 LEU A CD1 1 ATOM 458 C CD2 . LEU A 1 63 ? 40.189 1.638 -6.286 1.00 89.88 ? 84 LEU A CD2 1 ATOM 459 N N . LEU A 1 64 ? 41.250 6.363 -5.732 1.00 108.00 ? 85 LEU A N 1 ATOM 460 C CA . LEU A 1 64 ? 41.060 6.905 -4.393 1.00 109.51 ? 85 LEU A CA 1 ATOM 461 C C . LEU A 1 64 ? 39.770 6.371 -3.792 1.00 114.14 ? 85 LEU A C 1 ATOM 462 O O . LEU A 1 64 ? 38.763 6.239 -4.490 1.00 113.58 ? 85 LEU A O 1 ATOM 463 C CB . LEU A 1 64 ? 40.994 8.433 -4.414 1.00 113.33 ? 85 LEU A CB 1 ATOM 464 C CG . LEU A 1 64 ? 42.128 9.247 -5.032 1.00 116.07 ? 85 LEU A CG 1 ATOM 465 C CD1 . LEU A 1 64 ? 42.053 10.680 -4.518 1.00 116.23 ? 85 LEU A CD1 1 ATOM 466 C CD2 . LEU A 1 64 ? 43.481 8.628 -4.721 1.00 115.57 ? 85 LEU A CD2 1 ATOM 467 N N . ILE A 1 65 ? 39.813 6.059 -2.498 1.00 116.50 ? 86 ILE A N 1 ATOM 468 C CA . ILE A 1 65 ? 38.616 5.740 -1.728 1.00 124.79 ? 86 ILE A CA 1 ATOM 469 C C . ILE A 1 65 ? 38.541 6.723 -0.565 1.00 131.26 ? 86 ILE A C 1 ATOM 470 O O . ILE A 1 65 ? 39.291 6.610 0.406 1.00 122.91 ? 86 ILE A O 1 ATOM 471 C CB . ILE A 1 65 ? 38.650 4.301 -1.186 1.00 122.43 ? 86 ILE A CB 1 ATOM 472 C CG1 . ILE A 1 65 ? 39.255 3.355 -2.225 1.00 95.52 ? 86 ILE A CG1 1 ATOM 473 C CG2 . ILE A 1 65 ? 37.249 3.852 -0.756 1.00 121.40 ? 86 ILE A CG2 1 ATOM 474 C CD1 . ILE A 1 65 ? 39.488 1.953 -1.704 1.00 104.16 ? 86 ILE A CD1 1 ATOM 475 N N . ASN A 1 66 ? 37.633 7.688 -0.666 1.00 147.06 ? 87 ASN A N 1 ATOM 476 C CA . ASN A 1 66 ? 37.676 8.858 0.207 1.00 157.50 ? 87 ASN A CA 1 ATOM 477 C C . ASN A 1 66 ? 37.088 8.665 1.607 1.00 156.10 ? 87 ASN A C 1 ATOM 478 O O . ASN A 1 66 ? 37.211 9.545 2.456 1.00 159.08 ? 87 ASN A O 1 ATOM 479 C CB . ASN A 1 66 ? 37.047 10.067 -0.488 1.00 170.87 ? 87 ASN A CB 1 ATOM 480 C CG . ASN A 1 66 ? 37.996 11.246 -0.566 1.00 180.77 ? 87 ASN A CG 1 ATOM 481 O OD1 . ASN A 1 66 ? 39.157 11.146 -0.167 1.00 180.81 ? 87 ASN A OD1 1 ATOM 482 N ND2 . ASN A 1 66 ? 37.514 12.364 -1.093 1.00 188.52 ? 87 ASN A ND2 1 ATOM 483 N N . ASN A 1 67 ? 36.460 7.517 1.839 1.00 153.76 ? 88 ASN A N 1 ATOM 484 C CA . ASN A 1 67 ? 35.988 7.140 3.173 1.00 153.61 ? 88 ASN A CA 1 ATOM 485 C C . ASN A 1 67 ? 35.768 5.632 3.264 1.00 153.64 ? 88 ASN A C 1 ATOM 486 O O . ASN A 1 67 ? 34.726 5.122 2.853 1.00 158.15 ? 88 ASN A O 1 ATOM 487 C CB . ASN A 1 67 ? 34.715 7.904 3.553 1.00 154.17 ? 88 ASN A CB 1 ATOM 488 C CG . ASN A 1 67 ? 35.011 9.260 4.174 1.00 151.13 ? 88 ASN A CG 1 ATOM 489 O OD1 . ASN A 1 67 ? 36.097 9.486 4.711 1.00 149.66 ? 88 ASN A OD1 1 ATOM 490 N ND2 . ASN A 1 67 ? 34.043 10.166 4.107 1.00 151.31 ? 88 ASN A ND2 1 ATOM 491 N N . PRO A 1 68 ? 36.763 4.918 3.807 1.00 148.67 ? 89 PRO A N 1 ATOM 492 C CA . PRO A 1 68 ? 36.885 3.454 3.798 1.00 145.82 ? 89 PRO A CA 1 ATOM 493 C C . PRO A 1 68 ? 36.018 2.711 4.819 1.00 146.32 ? 89 PRO A C 1 ATOM 494 O O . PRO A 1 68 ? 35.707 3.241 5.885 1.00 147.03 ? 89 PRO A O 1 ATOM 495 C CB . PRO A 1 68 ? 38.368 3.226 4.135 1.00 142.74 ? 89 PRO A CB 1 ATOM 496 C CG . PRO A 1 68 ? 39.025 4.587 4.056 1.00 143.14 ? 89 PRO A CG 1 ATOM 497 C CD . PRO A 1 68 ? 37.952 5.559 4.387 1.00 147.14 ? 89 PRO A CD 1 ATOM 498 N N . ASN A 1 69 ? 35.642 1.482 4.473 1.00 147.89 ? 90 ASN A N 1 ATOM 499 C CA . ASN A 1 69 ? 35.005 0.552 5.403 1.00 155.43 ? 90 ASN A CA 1 ATOM 500 C C . ASN A 1 69 ? 35.580 -0.846 5.214 1.00 143.90 ? 90 ASN A C 1 ATOM 501 O O . ASN A 1 69 ? 35.609 -1.364 4.100 1.00 138.79 ? 90 ASN A O 1 ATOM 502 C CB . ASN A 1 69 ? 33.484 0.532 5.219 1.00 176.66 ? 90 ASN A CB 1 ATOM 503 C CG . ASN A 1 69 ? 32.839 -0.731 5.783 1.00 195.16 ? 90 ASN A CG 1 ATOM 504 O OD1 . ASN A 1 69 ? 33.114 -1.839 5.322 1.00 190.69 ? 90 ASN A OD1 1 ATOM 505 N ND2 . ASN A 1 69 ? 31.966 -0.565 6.774 1.00 219.35 ? 90 ASN A ND2 1 ATOM 506 N N . LYS A 1 70 ? 36.034 -1.452 6.306 1.00 140.32 ? 91 LYS A N 1 ATOM 507 C CA . LYS A 1 70 ? 36.710 -2.746 6.246 1.00 136.14 ? 91 LYS A CA 1 ATOM 508 C C . LYS A 1 70 ? 35.889 -3.837 5.564 1.00 136.42 ? 91 LYS A C 1 ATOM 509 O O . LYS A 1 70 ? 36.360 -4.494 4.638 1.00 127.48 ? 91 LYS A O 1 ATOM 510 C CB . LYS A 1 70 ? 37.103 -3.209 7.651 1.00 134.82 ? 91 LYS A CB 1 ATOM 511 C CG . LYS A 1 70 ? 37.699 -4.611 7.698 1.00 131.89 ? 91 LYS A CG 1 ATOM 512 C CD . LYS A 1 70 ? 38.005 -5.039 9.128 1.00 131.49 ? 91 LYS A CD 1 ATOM 513 C CE . LYS A 1 70 ? 36.735 -5.154 9.960 1.00 134.17 ? 91 LYS A CE 1 ATOM 514 N NZ . LYS A 1 70 ? 37.016 -5.479 11.391 1.00 133.39 ? 91 LYS A NZ 1 ATOM 515 N N . THR A 1 71 ? 34.659 -4.023 6.028 1.00 144.60 ? 92 THR A N 1 ATOM 516 C CA . THR A 1 71 ? 33.853 -5.175 5.630 1.00 146.03 ? 92 THR A CA 1 ATOM 517 C C . THR A 1 71 ? 33.595 -5.278 4.123 1.00 144.28 ? 92 THR A C 1 ATOM 518 O O . THR A 1 71 ? 33.312 -6.363 3.612 1.00 145.11 ? 92 THR A O 1 ATOM 519 C CB . THR A 1 71 ? 32.508 -5.198 6.379 1.00 150.32 ? 92 THR A CB 1 ATOM 520 O OG1 . THR A 1 71 ? 32.192 -6.543 6.761 1.00 151.59 ? 92 THR A OG1 1 ATOM 521 C CG2 . THR A 1 71 ? 31.396 -4.629 5.505 1.00 152.19 ? 92 THR A CG2 1 ATOM 522 N N . GLN A 1 72 ? 33.692 -4.161 3.411 1.00 140.43 ? 93 GLN A N 1 ATOM 523 C CA . GLN A 1 72 ? 33.408 -4.174 1.980 1.00 139.61 ? 93 GLN A CA 1 ATOM 524 C C . GLN A 1 72 ? 34.620 -3.839 1.112 1.00 133.62 ? 93 GLN A C 1 ATOM 525 O O . GLN A 1 72 ? 34.521 -3.830 -0.114 1.00 129.22 ? 93 GLN A O 1 ATOM 526 C CB . GLN A 1 72 ? 32.231 -3.250 1.643 1.00 146.59 ? 93 GLN A CB 1 ATOM 527 C CG . GLN A 1 72 ? 32.455 -1.780 1.969 1.00 149.69 ? 93 GLN A CG 1 ATOM 528 C CD . GLN A 1 72 ? 31.288 -0.904 1.540 1.00 154.81 ? 93 GLN A CD 1 ATOM 529 O OE1 . GLN A 1 72 ? 30.572 -1.223 0.589 1.00 156.39 ? 93 GLN A OE1 1 ATOM 530 N NE2 . GLN A 1 72 ? 31.094 0.209 2.241 1.00 156.43 ? 93 GLN A NE2 1 ATOM 531 N N . ASP A 1 73 ? 35.758 -3.570 1.746 1.00 131.15 ? 94 ASP A N 1 ATOM 532 C CA . ASP A 1 73 ? 36.986 -3.253 1.020 1.00 126.49 ? 94 ASP A CA 1 ATOM 533 C C . ASP A 1 73 ? 38.122 -4.174 1.460 1.00 127.05 ? 94 ASP A C 1 ATOM 534 O O . ASP A 1 73 ? 39.296 -3.841 1.302 1.00 127.07 ? 94 ASP A O 1 ATOM 535 C CB . ASP A 1 73 ? 37.394 -1.790 1.247 1.00 122.01 ? 94 ASP A CB 1 ATOM 536 C CG . ASP A 1 73 ? 36.283 -0.802 0.906 1.00 121.52 ? 94 ASP A CG 1 ATOM 537 O OD1 . ASP A 1 73 ? 35.260 -1.224 0.332 1.00 123.95 ? 94 ASP A OD1 1 ATOM 538 O OD2 . ASP A 1 73 ? 36.435 0.401 1.211 1.00 117.63 ? 94 ASP A OD2 1 ATOM 539 N N . ALA A 1 74 ? 37.770 -5.335 2.002 1.00 129.71 ? 95 ALA A N 1 ATOM 540 C CA . ALA A 1 74 ? 38.751 -6.203 2.654 1.00 131.14 ? 95 ALA A CA 1 ATOM 541 C C . ALA A 1 74 ? 39.371 -7.252 1.732 1.00 129.27 ? 95 ALA A C 1 ATOM 542 O O . ALA A 1 74 ? 39.538 -8.406 2.128 1.00 132.66 ? 95 ALA A O 1 ATOM 543 C CB . ALA A 1 74 ? 38.127 -6.878 3.878 1.00 133.20 ? 95 ALA A CB 1 ATOM 544 N N . GLY A 1 75 ? 39.730 -6.850 0.516 1.00 120.51 ? 96 GLY A N 1 ATOM 545 C CA . GLY A 1 75 ? 40.284 -7.784 -0.449 1.00 116.56 ? 96 GLY A CA 1 ATOM 546 C C . GLY A 1 75 ? 41.484 -7.269 -1.222 1.00 113.08 ? 96 GLY A C 1 ATOM 547 O O . GLY A 1 75 ? 42.082 -6.252 -0.868 1.00 112.73 ? 96 GLY A O 1 ATOM 548 N N . THR A 1 76 ? 41.836 -7.978 -2.290 1.00 107.15 ? 97 THR A N 1 ATOM 549 C CA . THR A 1 76 ? 43.001 -7.621 -3.091 1.00 102.10 ? 97 THR A CA 1 ATOM 550 C C . THR A 1 76 ? 42.598 -6.906 -4.388 1.00 97.07 ? 97 THR A C 1 ATOM 551 O O . THR A 1 76 ? 41.702 -7.351 -5.103 1.00 99.26 ? 97 THR A O 1 ATOM 552 C CB . THR A 1 76 ? 43.860 -8.864 -3.416 1.00 97.31 ? 97 THR A CB 1 ATOM 553 O OG1 . THR A 1 76 ? 43.509 -9.375 -4.707 1.00 106.94 ? 97 THR A OG1 1 ATOM 554 C CG2 . THR A 1 76 ? 43.654 -9.943 -2.362 1.00 83.66 ? 97 THR A CG2 1 ATOM 555 N N . TYR A 1 77 ? 43.269 -5.794 -4.674 1.00 90.30 ? 98 TYR A N 1 ATOM 556 C CA . TYR A 1 77 ? 42.963 -4.968 -5.839 1.00 92.66 ? 98 TYR A CA 1 ATOM 557 C C . TYR A 1 77 ? 43.920 -5.221 -6.998 1.00 90.27 ? 98 TYR A C 1 ATOM 558 O O . TYR A 1 77 ? 45.078 -5.589 -6.793 1.00 88.85 ? 98 TYR A O 1 ATOM 559 C CB . TYR A 1 77 ? 43.019 -3.485 -5.467 1.00 93.80 ? 98 TYR A CB 1 ATOM 560 C CG . TYR A 1 77 ? 41.839 -2.998 -4.657 1.00 95.48 ? 98 TYR A CG 1 ATOM 561 C CD1 . TYR A 1 77 ? 41.771 -3.214 -3.290 1.00 88.32 ? 98 TYR A CD1 1 ATOM 562 C CD2 . TYR A 1 77 ? 40.796 -2.310 -5.264 1.00 99.21 ? 98 TYR A CD2 1 ATOM 563 C CE1 . TYR A 1 77 ? 40.693 -2.767 -2.548 1.00 91.18 ? 98 TYR A CE1 1 ATOM 564 C CE2 . TYR A 1 77 ? 39.716 -1.857 -4.531 1.00 100.84 ? 98 TYR A CE2 1 ATOM 565 C CZ . TYR A 1 77 ? 39.670 -2.088 -3.172 1.00 96.28 ? 98 TYR A CZ 1 ATOM 566 O OH . TYR A 1 77 ? 38.596 -1.638 -2.441 1.00 97.12 ? 98 TYR A OH 1 ATOM 567 N N . GLN A 1 78 ? 43.432 -5.013 -8.217 1.00 93.18 ? 99 GLN A N 1 ATOM 568 C CA . GLN A 1 78 ? 44.277 -5.106 -9.403 1.00 91.17 ? 99 GLN A CA 1 ATOM 569 C C . GLN A 1 78 ? 43.923 -4.008 -10.402 1.00 90.30 ? 99 GLN A C 1 ATOM 570 O O . GLN A 1 78 ? 42.753 -3.707 -10.624 1.00 92.82 ? 99 GLN A O 1 ATOM 571 C CB . GLN A 1 78 ? 44.165 -6.487 -10.054 1.00 92.08 ? 99 GLN A CB 1 ATOM 572 C CG . GLN A 1 78 ? 45.419 -6.905 -10.813 1.00 90.53 ? 99 GLN A CG 1 ATOM 573 C CD . GLN A 1 78 ? 45.282 -8.266 -11.466 1.00 91.64 ? 99 GLN A CD 1 ATOM 574 O OE1 . GLN A 1 78 ? 44.191 -8.661 -11.876 1.00 96.72 ? 99 GLN A OE1 1 ATOM 575 N NE2 . GLN A 1 78 ? 46.393 -8.990 -11.572 1.00 84.40 ? 99 GLN A NE2 1 ATOM 576 N N . CYS A 1 79 ? 44.952 -3.406 -10.986 1.00 85.18 ? 100 CYS A N 1 ATOM 577 C CA . CYS A 1 79 ? 44.794 -2.315 -11.935 1.00 81.44 ? 100 CYS A CA 1 ATOM 578 C C . CYS A 1 79 ? 45.047 -2.855 -13.330 1.00 83.20 ? 100 CYS A C 1 ATOM 579 O O . CYS A 1 79 ? 46.080 -3.473 -13.577 1.00 81.04 ? 100 CYS A O 1 ATOM 580 C CB . CYS A 1 79 ? 45.788 -1.196 -11.606 1.00 80.74 ? 100 CYS A CB 1 ATOM 581 S SG . CYS A 1 79 ? 45.925 0.168 -12.796 1.00 101.44 ? 100 CYS A SG 1 ATOM 582 N N . ILE A 1 80 ? 44.101 -2.640 -14.241 1.00 89.74 ? 101 ILE A N 1 ATOM 583 C CA . ILE A 1 80 ? 44.259 -3.129 -15.610 1.00 97.91 ? 101 ILE A CA 1 ATOM 584 C C . ILE A 1 80 ? 44.181 -1.998 -16.635 1.00 91.58 ? 101 ILE A C 1 ATOM 585 O O . ILE A 1 80 ? 43.239 -1.209 -16.631 1.00 92.28 ? 101 ILE A O 1 ATOM 586 C CB . ILE A 1 80 ? 43.247 -4.249 -15.935 1.00 110.34 ? 101 ILE A CB 1 ATOM 587 C CG1 . ILE A 1 80 ? 41.822 -3.711 -15.913 1.00 123.06 ? 101 ILE A CG1 1 ATOM 588 C CG2 . ILE A 1 80 ? 43.373 -5.390 -14.929 1.00 107.38 ? 101 ILE A CG2 1 ATOM 589 C CD1 . ILE A 1 80 ? 40.815 -4.743 -15.470 1.00 129.72 ? 101 ILE A CD1 1 ATOM 590 N N . ALA A 1 81 ? 45.191 -1.921 -17.498 1.00 86.74 ? 102 ALA A N 1 ATOM 591 C CA . ALA A 1 81 ? 45.307 -0.831 -18.466 1.00 85.09 ? 102 ALA A CA 1 ATOM 592 C C . ALA A 1 81 ? 45.211 -1.329 -19.907 1.00 93.41 ? 102 ALA A C 1 ATOM 593 O O . ALA A 1 81 ? 45.914 -2.262 -20.306 1.00 90.81 ? 102 ALA A O 1 ATOM 594 C CB . ALA A 1 81 ? 46.606 -0.060 -18.250 1.00 78.77 ? 102 ALA A CB 1 ATOM 595 N N . THR A 1 82 ? 44.345 -0.688 -20.686 1.00 97.14 ? 103 THR A N 1 ATOM 596 C CA . THR A 1 82 ? 44.034 -1.143 -22.033 1.00 93.83 ? 103 THR A CA 1 ATOM 597 C C . THR A 1 82 ? 44.090 -0.010 -23.051 1.00 98.16 ? 103 THR A C 1 ATOM 598 O O . THR A 1 82 ? 43.598 1.090 -22.802 1.00 96.87 ? 103 THR A O 1 ATOM 599 C CB . THR A 1 82 ? 42.616 -1.763 -22.098 1.00 95.18 ? 103 THR A CB 1 ATOM 600 O OG1 . THR A 1 82 ? 42.576 -2.975 -21.334 1.00 91.91 ? 103 THR A OG1 1 ATOM 601 C CG2 . THR A 1 82 ? 42.227 -2.067 -23.537 1.00 95.08 ? 103 THR A CG2 1 ATOM 602 N N . ASN A 1 83 ? 44.704 -0.284 -24.195 1.00 100.31 ? 104 ASN A N 1 ATOM 603 C CA . ASN A 1 83 ? 44.547 0.573 -25.362 1.00 103.65 ? 104 ASN A CA 1 ATOM 604 C C . ASN A 1 83 ? 44.317 -0.286 -26.602 1.00 107.63 ? 104 ASN A C 1 ATOM 605 O O . ASN A 1 83 ? 43.913 -1.444 -26.486 1.00 104.56 ? 104 ASN A O 1 ATOM 606 C CB . ASN A 1 83 ? 45.730 1.534 -25.530 1.00 98.05 ? 104 ASN A CB 1 ATOM 607 C CG . ASN A 1 83 ? 46.974 0.852 -26.050 1.00 89.31 ? 104 ASN A CG 1 ATOM 608 O OD1 . ASN A 1 83 ? 47.002 -0.366 -26.231 1.00 92.57 ? 104 ASN A OD1 1 ATOM 609 N ND2 . ASN A 1 83 ? 48.016 1.637 -26.298 1.00 76.36 ? 104 ASN A ND2 1 ATOM 610 N N . SER A 1 84 ? 44.574 0.275 -27.778 1.00 115.33 ? 105 SER A N 1 ATOM 611 C CA . SER A 1 84 ? 44.271 -0.401 -29.038 1.00 117.24 ? 105 SER A CA 1 ATOM 612 C C . SER A 1 84 ? 45.100 -1.668 -29.246 1.00 115.63 ? 105 SER A C 1 ATOM 613 O O . SER A 1 84 ? 44.618 -2.649 -29.815 1.00 117.60 ? 105 SER A O 1 ATOM 614 C CB . SER A 1 84 ? 44.487 0.553 -30.215 1.00 112.73 ? 105 SER A CB 1 ATOM 615 O OG . SER A 1 84 ? 44.118 1.875 -29.863 1.00 112.69 ? 105 SER A OG 1 ATOM 616 N N . PHE A 1 85 ? 46.345 -1.644 -28.783 1.00 109.15 ? 106 PHE A N 1 ATOM 617 C CA . PHE A 1 85 ? 47.272 -2.744 -29.030 1.00 99.75 ? 106 PHE A CA 1 ATOM 618 C C . PHE A 1 85 ? 47.210 -3.858 -27.985 1.00 92.67 ? 106 PHE A C 1 ATOM 619 O O . PHE A 1 85 ? 47.972 -4.821 -28.062 1.00 88.72 ? 106 PHE A O 1 ATOM 620 C CB . PHE A 1 85 ? 48.700 -2.216 -29.140 1.00 98.86 ? 106 PHE A CB 1 ATOM 621 C CG . PHE A 1 85 ? 48.869 -1.151 -30.183 1.00 104.96 ? 106 PHE A CG 1 ATOM 622 C CD1 . PHE A 1 85 ? 48.581 0.171 -29.892 1.00 109.42 ? 106 PHE A CD1 1 ATOM 623 C CD2 . PHE A 1 85 ? 49.313 -1.472 -31.454 1.00 106.29 ? 106 PHE A CD2 1 ATOM 624 C CE1 . PHE A 1 85 ? 48.733 1.154 -30.847 1.00 115.43 ? 106 PHE A CE1 1 ATOM 625 C CE2 . PHE A 1 85 ? 49.470 -0.494 -32.414 1.00 110.63 ? 106 PHE A CE2 1 ATOM 626 C CZ . PHE A 1 85 ? 49.179 0.822 -32.110 1.00 115.19 ? 106 PHE A CZ 1 ATOM 627 N N . GLY A 1 86 ? 46.314 -3.730 -27.009 1.00 85.76 ? 107 GLY A N 1 ATOM 628 C CA . GLY A 1 86 ? 46.107 -4.805 -26.057 1.00 90.60 ? 107 GLY A CA 1 ATOM 629 C C . GLY A 1 86 ? 45.980 -4.401 -24.600 1.00 94.53 ? 107 GLY A C 1 ATOM 630 O O . GLY A 1 86 ? 45.678 -3.249 -24.280 1.00 96.27 ? 107 GLY A O 1 ATOM 631 N N . THR A 1 87 ? 46.223 -5.362 -23.712 1.00 90.36 ? 108 THR A N 1 ATOM 632 C CA . THR A 1 87 ? 45.952 -5.185 -22.291 1.00 91.05 ? 108 THR A CA 1 ATOM 633 C C . THR A 1 87 ? 47.039 -5.763 -21.381 1.00 89.01 ? 108 THR A C 1 ATOM 634 O O . THR A 1 87 ? 47.559 -6.852 -21.623 1.00 92.24 ? 108 THR A O 1 ATOM 635 C CB . THR A 1 87 ? 44.606 -5.834 -21.910 1.00 91.86 ? 108 THR A CB 1 ATOM 636 O OG1 . THR A 1 87 ? 43.573 -5.341 -22.773 1.00 103.56 ? 108 THR A OG1 1 ATOM 637 C CG2 . THR A 1 87 ? 44.250 -5.531 -20.458 1.00 86.24 ? 108 THR A CG2 1 ATOM 638 N N . ILE A 1 88 ? 47.374 -5.020 -20.332 1.00 80.55 ? 109 ILE A N 1 ATOM 639 C CA . ILE A 1 88 ? 48.262 -5.518 -19.289 1.00 74.88 ? 109 ILE A CA 1 ATOM 640 C C . ILE A 1 88 ? 47.598 -5.377 -17.927 1.00 77.76 ? 109 ILE A C 1 ATOM 641 O O . ILE A 1 88 ? 46.955 -4.365 -17.640 1.00 79.15 ? 109 ILE A O 1 ATOM 642 C CB . ILE A 1 88 ? 49.615 -4.771 -19.254 1.00 72.03 ? 109 ILE A CB 1 ATOM 643 C CG1 . ILE A 1 88 ? 49.403 -3.268 -19.077 1.00 73.81 ? 109 ILE A CG1 1 ATOM 644 C CG2 . ILE A 1 88 ? 50.433 -5.054 -20.503 1.00 65.08 ? 109 ILE A CG2 1 ATOM 645 C CD1 . ILE A 1 88 ? 50.700 -2.502 -18.890 1.00 68.34 ? 109 ILE A CD1 1 ATOM 646 N N . VAL A 1 89 ? 47.743 -6.404 -17.096 1.00 80.42 ? 110 VAL A N 1 ATOM 647 C CA . VAL A 1 89 ? 47.280 -6.348 -15.712 1.00 74.90 ? 110 VAL A CA 1 ATOM 648 C C . VAL A 1 89 ? 48.459 -6.113 -14.764 1.00 73.91 ? 110 VAL A C 1 ATOM 649 O O . VAL A 1 89 ? 49.563 -6.611 -14.988 1.00 78.68 ? 110 VAL A O 1 ATOM 650 C CB . VAL A 1 89 ? 46.552 -7.639 -15.309 1.00 73.76 ? 110 VAL A CB 1 ATOM 651 C CG1 . VAL A 1 89 ? 45.559 -8.038 -16.390 1.00 82.07 ? 110 VAL A CG1 1 ATOM 652 C CG2 . VAL A 1 89 ? 47.547 -8.756 -15.063 1.00 63.20 ? 110 VAL A CG2 1 ATOM 653 N N . SER A 1 90 ? 48.222 -5.345 -13.709 1.00 69.82 ? 111 SER A N 1 ATOM 654 C CA . SER A 1 90 ? 49.261 -5.036 -12.738 1.00 65.76 ? 111 SER A CA 1 ATOM 655 C C . SER A 1 90 ? 49.334 -6.096 -11.641 1.00 76.09 ? 111 SER A C 1 ATOM 656 O O . SER A 1 90 ? 48.439 -6.934 -11.507 1.00 79.31 ? 111 SER A O 1 ATOM 657 C CB . SER A 1 90 ? 48.980 -3.682 -12.096 1.00 66.98 ? 111 SER A CB 1 ATOM 658 O OG . SER A 1 90 ? 47.962 -3.808 -11.118 1.00 67.50 ? 111 SER A OG 1 ATOM 659 N N . ARG A 1 91 ? 50.404 -6.042 -10.853 1.00 76.66 ? 112 ARG A N 1 ATOM 660 C CA . ARG A 1 91 ? 50.561 -6.925 -9.704 1.00 74.76 ? 112 ARG A CA 1 ATOM 661 C C . ARG A 1 91 ? 49.398 -6.728 -8.752 1.00 77.83 ? 112 ARG A C 1 ATOM 662 O O . ARG A 1 91 ? 48.798 -5.654 -8.709 1.00 78.59 ? 112 ARG A O 1 ATOM 663 C CB . ARG A 1 91 ? 51.874 -6.642 -8.973 1.00 73.58 ? 112 ARG A CB 1 ATOM 664 C CG . ARG A 1 91 ? 51.973 -5.252 -8.351 1.00 75.52 ? 112 ARG A CG 1 ATOM 665 C CD . ARG A 1 91 ? 53.262 -5.118 -7.560 1.00 82.65 ? 112 ARG A CD 1 ATOM 666 N NE . ARG A 1 91 ? 53.455 -3.784 -7.000 1.00 89.21 ? 112 ARG A NE 1 ATOM 667 C CZ . ARG A 1 91 ? 54.494 -3.002 -7.278 1.00 89.67 ? 112 ARG A CZ 1 ATOM 668 N NH1 . ARG A 1 91 ? 55.435 -3.425 -8.111 1.00 89.69 ? 112 ARG A NH1 1 ATOM 669 N NH2 . ARG A 1 91 ? 54.595 -1.802 -6.720 1.00 88.56 ? 112 ARG A NH2 1 ATOM 670 N N . GLU A 1 92 ? 49.081 -7.768 -7.989 1.00 79.73 ? 113 GLU A N 1 ATOM 671 C CA . GLU A 1 92 ? 47.981 -7.697 -7.038 1.00 85.56 ? 113 GLU A CA 1 ATOM 672 C C . GLU A 1 92 ? 48.402 -6.965 -5.769 1.00 82.19 ? 113 GLU A C 1 ATOM 673 O O . GLU A 1 92 ? 49.508 -7.159 -5.260 1.00 82.21 ? 113 GLU A O 1 ATOM 674 C CB . GLU A 1 92 ? 47.458 -9.097 -6.709 1.00 94.73 ? 113 GLU A CB 1 ATOM 675 C CG . GLU A 1 92 ? 46.642 -9.724 -7.831 1.00 107.27 ? 113 GLU A CG 1 ATOM 676 C CD . GLU A 1 92 ? 46.319 -11.185 -7.577 1.00 114.18 ? 113 GLU A CD 1 ATOM 677 O OE1 . GLU A 1 92 ? 45.366 -11.705 -8.200 1.00 114.44 ? 113 GLU A OE1 1 ATOM 678 O OE2 . GLU A 1 92 ? 47.020 -11.813 -6.756 1.00 115.11 ? 113 GLU A OE2 1 ATOM 679 N N . ALA A 1 93 ? 47.511 -6.114 -5.273 1.00 79.32 ? 114 ALA A N 1 ATOM 680 C CA . ALA A 1 93 ? 47.763 -5.361 -4.055 1.00 74.63 ? 114 ALA A CA 1 ATOM 681 C C . ALA A 1 93 ? 46.699 -5.648 -2.991 1.00 81.06 ? 114 ALA A C 1 ATOM 682 O O . ALA A 1 93 ? 45.519 -5.343 -3.170 1.00 81.50 ? 114 ALA A O 1 ATOM 683 C CB . ALA A 1 93 ? 47.841 -3.869 -4.361 1.00 69.55 ? 114 ALA A CB 1 ATOM 684 N N . LYS A 1 94 ? 47.123 -6.243 -1.883 1.00 84.51 ? 115 LYS A N 1 ATOM 685 C CA . LYS A 1 94 ? 46.212 -6.567 -0.789 1.00 85.68 ? 115 LYS A CA 1 ATOM 686 C C . LYS A 1 94 ? 45.901 -5.338 0.069 1.00 85.14 ? 115 LYS A C 1 ATOM 687 O O . LYS A 1 94 ? 46.804 -4.609 0.479 1.00 81.59 ? 115 LYS A O 1 ATOM 688 C CB . LYS A 1 94 ? 46.792 -7.700 0.065 1.00 82.22 ? 115 LYS A CB 1 ATOM 689 C CG . LYS A 1 94 ? 46.041 -7.979 1.360 1.00 93.91 ? 115 LYS A CG 1 ATOM 690 C CD . LYS A 1 94 ? 44.650 -8.562 1.120 1.00 102.35 ? 115 LYS A CD 1 ATOM 691 C CE . LYS A 1 94 ? 43.979 -8.926 2.443 1.00 105.52 ? 115 LYS A CE 1 ATOM 692 N NZ . LYS A 1 94 ? 42.534 -9.247 2.289 1.00 109.12 ? 115 LYS A NZ 1 ATOM 693 N N . LEU A 1 95 ? 44.616 -5.106 0.323 1.00 89.70 ? 116 LEU A N 1 ATOM 694 C CA . LEU A 1 95 ? 44.183 -3.986 1.154 1.00 93.03 ? 116 LEU A CA 1 ATOM 695 C C . LEU A 1 95 ? 43.593 -4.477 2.476 1.00 94.43 ? 116 LEU A C 1 ATOM 696 O O . LEU A 1 95 ? 42.498 -5.038 2.507 1.00 97.82 ? 116 LEU A O 1 ATOM 697 C CB . LEU A 1 95 ? 43.161 -3.121 0.410 1.00 93.50 ? 116 LEU A CB 1 ATOM 698 C CG . LEU A 1 95 ? 42.447 -2.063 1.260 1.00 98.74 ? 116 LEU A CG 1 ATOM 699 C CD1 . LEU A 1 95 ? 43.401 -0.953 1.690 1.00 97.60 ? 116 LEU A CD1 1 ATOM 700 C CD2 . LEU A 1 95 ? 41.255 -1.483 0.514 1.00 101.43 ? 116 LEU A CD2 1 ATOM 701 N N . GLN A 1 96 ? 44.326 -4.268 3.565 1.00 91.83 ? 117 GLN A N 1 ATOM 702 C CA . GLN A 1 96 ? 43.863 -4.674 4.888 1.00 94.52 ? 117 GLN A CA 1 ATOM 703 C C . GLN A 1 96 ? 43.670 -3.455 5.776 1.00 91.78 ? 117 GLN A C 1 ATOM 704 O O . GLN A 1 96 ? 44.272 -2.408 5.545 1.00 92.43 ? 117 GLN A O 1 ATOM 705 C CB . GLN A 1 96 ? 44.862 -5.631 5.534 1.00 97.87 ? 117 GLN A CB 1 ATOM 706 C CG . GLN A 1 96 ? 45.463 -6.631 4.564 1.00 100.28 ? 117 GLN A CG 1 ATOM 707 C CD . GLN A 1 96 ? 46.294 -7.686 5.263 1.00 96.00 ? 117 GLN A CD 1 ATOM 708 O OE1 . GLN A 1 96 ? 46.134 -7.923 6.466 1.00 91.77 ? 117 GLN A OE1 1 ATOM 709 N NE2 . GLN A 1 96 ? 47.186 -8.331 4.514 1.00 85.48 ? 117 GLN A NE2 1 ATOM 710 N N . PHE A 1 97 ? 42.827 -3.593 6.794 1.00 89.46 ? 118 PHE A N 1 ATOM 711 C CA . PHE A 1 97 ? 42.553 -2.484 7.698 1.00 94.77 ? 118 PHE A CA 1 ATOM 712 C C . PHE A 1 97 ? 42.973 -2.813 9.123 1.00 102.73 ? 118 PHE A C 1 ATOM 713 O O . PHE A 1 97 ? 42.779 -3.933 9.595 1.00 104.97 ? 118 PHE A O 1 ATOM 714 C CB . PHE A 1 97 ? 41.077 -2.093 7.633 1.00 97.48 ? 118 PHE A CB 1 ATOM 715 C CG . PHE A 1 97 ? 40.654 -1.580 6.283 1.00 102.19 ? 118 PHE A CG 1 ATOM 716 C CD1 . PHE A 1 97 ? 40.144 -2.442 5.324 1.00 100.83 ? 118 PHE A CD1 1 ATOM 717 C CD2 . PHE A 1 97 ? 40.786 -0.237 5.966 1.00 102.86 ? 118 PHE A CD2 1 ATOM 718 C CE1 . PHE A 1 97 ? 39.764 -1.973 4.081 1.00 100.19 ? 118 PHE A CE1 1 ATOM 719 C CE2 . PHE A 1 97 ? 40.406 0.237 4.727 1.00 102.24 ? 118 PHE A CE2 1 ATOM 720 C CZ . PHE A 1 97 ? 39.893 -0.633 3.782 1.00 101.03 ? 118 PHE A CZ 1 ATOM 721 N N . ALA A 1 98 ? 43.562 -1.831 9.799 1.00 75.20 ? 119 ALA A N 1 ATOM 722 C CA . ALA A 1 98 ? 44.084 -2.036 11.144 1.00 77.34 ? 119 ALA A CA 1 ATOM 723 C C . ALA A 1 98 ? 43.159 -1.430 12.181 1.00 73.93 ? 119 ALA A C 1 ATOM 724 O O . ALA A 1 98 ? 42.546 -0.391 11.953 1.00 74.61 ? 119 ALA A O 1 ATOM 725 C CB . ALA A 1 98 ? 45.479 -1.447 11.273 1.00 77.22 ? 119 ALA A CB 1 ATOM 726 N N . TYR A 1 99 ? 43.073 -2.088 13.327 1.00 68.16 ? 120 TYR A N 1 ATOM 727 C CA . TYR A 1 99 ? 42.213 -1.641 14.406 1.00 66.08 ? 120 TYR A CA 1 ATOM 728 C C . TYR A 1 99 ? 42.619 -2.404 15.659 1.00 63.03 ? 120 TYR A C 1 ATOM 729 O O . TYR A 1 99 ? 43.274 -3.447 15.577 1.00 53.35 ? 120 TYR A O 1 ATOM 730 C CB . TYR A 1 99 ? 40.740 -1.916 14.066 1.00 66.87 ? 120 TYR A CB 1 ATOM 731 C CG . TYR A 1 99 ? 40.440 -3.389 13.908 1.00 67.02 ? 120 TYR A CG 1 ATOM 732 C CD1 . TYR A 1 99 ? 39.926 -4.130 14.966 1.00 68.36 ? 120 TYR A CD1 1 ATOM 733 C CD2 . TYR A 1 99 ? 40.702 -4.045 12.716 1.00 72.45 ? 120 TYR A CD2 1 ATOM 734 C CE1 . TYR A 1 99 ? 39.668 -5.482 14.836 1.00 70.55 ? 120 TYR A CE1 1 ATOM 735 C CE2 . TYR A 1 99 ? 40.449 -5.396 12.573 1.00 78.64 ? 120 TYR A CE2 1 ATOM 736 C CZ . TYR A 1 99 ? 39.934 -6.112 13.635 1.00 78.38 ? 120 TYR A CZ 1 ATOM 737 O OH . TYR A 1 99 ? 39.685 -7.461 13.494 1.00 80.39 ? 120 TYR A OH 1 ATOM 738 N N . LEU A 1 100 ? 42.236 -1.872 16.815 1.00 66.26 ? 121 LEU A N 1 ATOM 739 C CA . LEU A 1 100 ? 42.458 -2.540 18.089 1.00 62.42 ? 121 LEU A CA 1 ATOM 740 C C . LEU A 1 100 ? 41.303 -2.216 19.029 1.00 63.83 ? 121 LEU A C 1 ATOM 741 O O . LEU A 1 100 ? 41.118 -1.064 19.445 1.00 55.70 ? 121 LEU A O 1 ATOM 742 C CB . LEU A 1 100 ? 43.797 -2.117 18.697 1.00 53.14 ? 121 LEU A CB 1 ATOM 743 C CG . LEU A 1 100 ? 44.091 -2.550 20.132 1.00 50.48 ? 121 LEU A CG 1 ATOM 744 C CD1 . LEU A 1 100 ? 44.364 -4.044 20.216 1.00 44.12 ? 121 LEU A CD1 1 ATOM 745 C CD2 . LEU A 1 100 ? 45.275 -1.762 20.666 1.00 54.84 ? 121 LEU A CD2 1 ATOM 746 N N . GLU A 1 101 ? 40.512 -3.237 19.338 1.00 67.40 ? 122 GLU A N 1 ATOM 747 C CA . GLU A 1 101 ? 39.339 -3.070 20.185 1.00 70.17 ? 122 GLU A CA 1 ATOM 748 C C . GLU A 1 101 ? 39.719 -3.011 21.658 1.00 70.76 ? 122 GLU A C 1 ATOM 749 O O . GLU A 1 101 ? 40.767 -3.520 22.072 1.00 63.15 ? 122 GLU A O 1 ATOM 750 C CB . GLU A 1 101 ? 38.344 -4.206 19.956 1.00 73.48 ? 122 GLU A CB 1 ATOM 751 C CG . GLU A 1 101 ? 37.638 -4.146 18.614 1.00 88.01 ? 122 GLU A CG 1 ATOM 752 C CD . GLU A 1 101 ? 36.872 -5.418 18.313 1.00 97.62 ? 122 GLU A CD 1 ATOM 753 O OE1 . GLU A 1 101 ? 36.606 -5.684 17.119 1.00 104.35 ? 122 GLU A OE1 1 ATOM 754 O OE2 . GLU A 1 101 ? 36.545 -6.156 19.272 1.00 96.03 ? 122 GLU A OE2 1 ATOM 755 N N . ASN A 1 102 ? 38.858 -2.379 22.443 1.00 72.04 ? 123 ASN A N 1 ATOM 756 C CA . ASN A 1 102 ? 39.070 -2.283 23.873 1.00 71.46 ? 123 ASN A CA 1 ATOM 757 C C . ASN A 1 102 ? 38.899 -3.639 24.534 1.00 69.47 ? 123 ASN A C 1 ATOM 758 O O . ASN A 1 102 ? 38.165 -4.494 24.034 1.00 66.25 ? 123 ASN A O 1 ATOM 759 C CB . ASN A 1 102 ? 38.104 -1.270 24.483 1.00 79.29 ? 123 ASN A CB 1 ATOM 760 C CG . ASN A 1 102 ? 38.292 0.124 23.916 1.00 93.38 ? 123 ASN A CG 1 ATOM 761 O OD1 . ASN A 1 102 ? 39.328 0.756 24.127 1.00 94.05 ? 123 ASN A OD1 1 ATOM 762 N ND2 . ASN A 1 102 ? 37.290 0.611 23.189 1.00 101.89 ? 123 ASN A ND2 1 ATOM 763 N N . PHE A 1 103 ? 39.612 -3.845 25.637 1.00 65.30 ? 124 PHE A N 1 ATOM 764 C CA . PHE A 1 103 ? 39.324 -4.960 26.521 1.00 58.57 ? 124 PHE A CA 1 ATOM 765 C C . PHE A 1 103 ? 37.870 -4.818 26.959 1.00 67.11 ? 124 PHE A C 1 ATOM 766 O O . PHE A 1 103 ? 37.344 -3.703 27.038 1.00 62.61 ? 124 PHE A O 1 ATOM 767 C CB . PHE A 1 103 ? 40.238 -4.924 27.742 1.00 50.59 ? 124 PHE A CB 1 ATOM 768 C CG . PHE A 1 103 ? 41.639 -5.391 27.472 1.00 40.20 ? 124 PHE A CG 1 ATOM 769 C CD1 . PHE A 1 103 ? 42.564 -4.545 26.878 1.00 35.60 ? 124 PHE A CD1 1 ATOM 770 C CD2 . PHE A 1 103 ? 42.036 -6.670 27.825 1.00 35.26 ? 124 PHE A CD2 1 ATOM 771 C CE1 . PHE A 1 103 ? 43.855 -4.969 26.628 1.00 37.09 ? 124 PHE A CE1 1 ATOM 772 C CE2 . PHE A 1 103 ? 43.332 -7.102 27.584 1.00 37.18 ? 124 PHE A CE2 1 ATOM 773 C CZ . PHE A 1 103 ? 44.243 -6.250 26.979 1.00 32.85 ? 124 PHE A CZ 1 ATOM 774 N N . LYS A 1 104 ? 37.218 -5.940 27.242 1.00 71.90 ? 125 LYS A N 1 ATOM 775 C CA . LYS A 1 104 ? 35.812 -5.900 27.620 1.00 82.28 ? 125 LYS A CA 1 ATOM 776 C C . LYS A 1 104 ? 35.570 -6.263 29.086 1.00 84.40 ? 125 LYS A C 1 ATOM 777 O O . LYS A 1 104 ? 34.575 -6.902 29.430 1.00 86.93 ? 125 LYS A O 1 ATOM 778 C CB . LYS A 1 104 ? 34.971 -6.747 26.659 1.00 88.11 ? 125 LYS A CB 1 ATOM 779 C CG . LYS A 1 104 ? 34.786 -6.064 25.305 1.00 93.10 ? 125 LYS A CG 1 ATOM 780 C CD . LYS A 1 104 ? 34.184 -6.988 24.260 1.00 97.17 ? 125 LYS A CD 1 ATOM 781 C CE . LYS A 1 104 ? 34.404 -6.439 22.851 1.00 96.01 ? 125 LYS A CE 1 ATOM 782 N NZ . LYS A 1 104 ? 35.859 -6.366 22.498 1.00 89.88 ? 125 LYS A NZ 1 ATOM 783 N N . THR A 1 105 ? 36.485 -5.823 29.946 1.00 81.74 ? 126 THR A N 1 ATOM 784 C CA . THR A 1 105 ? 36.367 -6.034 31.383 1.00 71.74 ? 126 THR A CA 1 ATOM 785 C C . THR A 1 105 ? 37.420 -5.194 32.104 1.00 69.29 ? 126 THR A C 1 ATOM 786 O O . THR A 1 105 ? 38.504 -4.964 31.569 1.00 73.53 ? 126 THR A O 1 ATOM 787 C CB . THR A 1 105 ? 36.515 -7.521 31.737 1.00 66.06 ? 126 THR A CB 1 ATOM 788 O OG1 . THR A 1 105 ? 35.429 -7.924 32.580 1.00 68.52 ? 126 THR A OG1 1 ATOM 789 C CG2 . THR A 1 105 ? 37.845 -7.793 32.426 1.00 57.60 ? 126 THR A CG2 1 ATOM 790 N N . ARG A 1 106 ? 37.097 -4.732 33.310 1.00 68.58 ? 127 ARG A N 1 ATOM 791 C CA . ARG A 1 106 ? 37.942 -3.766 34.018 1.00 74.00 ? 127 ARG A CA 1 ATOM 792 C C . ARG A 1 106 ? 38.641 -4.302 35.274 1.00 68.12 ? 127 ARG A C 1 ATOM 793 O O . ARG A 1 106 ? 39.457 -3.604 35.882 1.00 66.21 ? 127 ARG A O 1 ATOM 794 C CB . ARG A 1 106 ? 37.143 -2.501 34.360 1.00 88.46 ? 127 ARG A CB 1 ATOM 795 C CG . ARG A 1 106 ? 37.414 -1.310 33.442 1.00 100.97 ? 127 ARG A CG 1 ATOM 796 C CD . ARG A 1 106 ? 36.816 -0.034 34.023 1.00 112.06 ? 127 ARG A CD 1 ATOM 797 N NE . ARG A 1 106 ? 37.635 1.145 33.746 1.00 120.15 ? 127 ARG A NE 1 ATOM 798 C CZ . ARG A 1 106 ? 37.202 2.234 33.115 1.00 129.31 ? 127 ARG A CZ 1 ATOM 799 N NH1 . ARG A 1 106 ? 35.946 2.309 32.692 1.00 135.25 ? 127 ARG A NH1 1 ATOM 800 N NH2 . ARG A 1 106 ? 38.024 3.256 32.914 1.00 127.91 ? 127 ARG A NH2 1 ATOM 801 N N . THR A 1 107 ? 38.320 -5.525 35.676 1.00 60.92 ? 128 THR A N 1 ATOM 802 C CA . THR A 1 107 ? 39.034 -6.145 36.790 1.00 53.78 ? 128 THR A CA 1 ATOM 803 C C . THR A 1 107 ? 39.325 -7.612 36.500 1.00 52.53 ? 128 THR A C 1 ATOM 804 O O . THR A 1 107 ? 38.817 -8.192 35.540 1.00 54.65 ? 128 THR A O 1 ATOM 805 C CB . THR A 1 107 ? 38.280 -6.029 38.154 1.00 56.04 ? 128 THR A CB 1 ATOM 806 O OG1 . THR A 1 107 ? 37.182 -6.947 38.191 1.00 60.51 ? 128 THR A OG1 1 ATOM 807 C CG2 . THR A 1 107 ? 37.777 -4.603 38.406 1.00 48.92 ? 128 THR A CG2 1 ATOM 808 N N . ARG A 1 108 ? 40.135 -8.217 37.353 1.00 48.39 ? 129 ARG A N 1 ATOM 809 C CA . ARG A 1 108 ? 40.590 -9.568 37.103 1.00 47.30 ? 129 ARG A CA 1 ATOM 810 C C . ARG A 1 108 ? 40.922 -10.253 38.424 1.00 38.36 ? 129 ARG A C 1 ATOM 811 O O . ARG A 1 108 ? 41.392 -9.615 39.355 1.00 41.02 ? 129 ARG A O 1 ATOM 812 C CB . ARG A 1 108 ? 41.806 -9.516 36.170 1.00 49.35 ? 129 ARG A CB 1 ATOM 813 C CG . ARG A 1 108 ? 42.477 -10.840 35.933 1.00 58.83 ? 129 ARG A CG 1 ATOM 814 C CD . ARG A 1 108 ? 43.478 -10.721 34.800 1.00 66.02 ? 129 ARG A CD 1 ATOM 815 N NE . ARG A 1 108 ? 42.820 -10.519 33.514 1.00 62.46 ? 129 ARG A NE 1 ATOM 816 C CZ . ARG A 1 108 ? 43.461 -10.462 32.352 1.00 65.85 ? 129 ARG A CZ 1 ATOM 817 N NH1 . ARG A 1 108 ? 44.783 -10.590 32.314 1.00 68.33 ? 129 ARG A NH1 1 ATOM 818 N NH2 . ARG A 1 108 ? 42.781 -10.275 31.228 1.00 62.13 ? 129 ARG A NH2 1 ATOM 819 N N . SER A 1 109 ? 40.654 -11.550 38.504 1.00 41.23 ? 130 SER A N 1 ATOM 820 C CA . SER A 1 109 ? 40.939 -12.325 39.701 1.00 41.21 ? 130 SER A CA 1 ATOM 821 C C . SER A 1 109 ? 42.390 -12.150 40.143 1.00 43.38 ? 130 SER A C 1 ATOM 822 O O . SER A 1 109 ? 43.289 -12.014 39.316 1.00 43.14 ? 130 SER A O 1 ATOM 823 C CB . SER A 1 109 ? 40.666 -13.805 39.441 1.00 46.01 ? 130 SER A CB 1 ATOM 824 O OG . SER A 1 109 ? 39.382 -13.992 38.881 1.00 48.42 ? 130 SER A OG 1 ATOM 825 N N . THR A 1 110 ? 42.618 -12.161 41.449 1.00 46.08 ? 131 THR A N 1 ATOM 826 C CA . THR A 1 110 ? 43.966 -11.997 41.955 1.00 39.98 ? 131 THR A CA 1 ATOM 827 C C . THR A 1 110 ? 44.669 -13.328 41.813 1.00 35.99 ? 131 THR A C 1 ATOM 828 O O . THR A 1 110 ? 44.032 -14.372 41.897 1.00 37.25 ? 131 THR A O 1 ATOM 829 C CB . THR A 1 110 ? 43.991 -11.544 43.442 1.00 37.47 ? 131 THR A CB 1 ATOM 830 O OG1 . THR A 1 110 ? 44.297 -12.652 44.290 1.00 44.05 ? 131 THR A OG1 1 ATOM 831 C CG2 . THR A 1 110 ? 42.672 -10.930 43.855 1.00 32.86 ? 131 THR A CG2 1 ATOM 832 N N . VAL A 1 111 ? 45.975 -13.298 41.563 1.00 29.96 ? 132 VAL A N 1 ATOM 833 C CA . VAL A 1 111 ? 46.762 -14.530 41.591 1.00 34.60 ? 132 VAL A CA 1 ATOM 834 C C . VAL A 1 111 ? 47.689 -14.575 42.812 1.00 34.34 ? 132 VAL A C 1 ATOM 835 O O . VAL A 1 111 ? 48.247 -13.565 43.231 1.00 38.66 ? 132 VAL A O 1 ATOM 836 C CB . VAL A 1 111 ? 47.515 -14.811 40.247 1.00 30.94 ? 132 VAL A CB 1 ATOM 837 C CG1 . VAL A 1 111 ? 47.397 -13.645 39.283 1.00 28.29 ? 132 VAL A CG1 1 ATOM 838 C CG2 . VAL A 1 111 ? 48.956 -15.201 40.483 1.00 30.42 ? 132 VAL A CG2 1 ATOM 839 N N . SER A 1 112 ? 47.826 -15.757 43.388 1.00 29.02 ? 133 SER A N 1 ATOM 840 C CA . SER A 1 112 ? 48.576 -15.932 44.615 1.00 28.68 ? 133 SER A CA 1 ATOM 841 C C . SER A 1 112 ? 49.714 -16.887 44.340 1.00 31.36 ? 133 SER A C 1 ATOM 842 O O . SER A 1 112 ? 49.482 -18.017 43.929 1.00 32.61 ? 133 SER A O 1 ATOM 843 C CB . SER A 1 112 ? 47.650 -16.485 45.717 1.00 35.85 ? 133 SER A CB 1 ATOM 844 O OG . SER A 1 112 ? 48.390 -17.019 46.800 1.00 48.54 ? 133 SER A OG 1 ATOM 845 N N . VAL A 1 113 ? 50.939 -16.426 44.576 1.00 29.68 ? 134 VAL A N 1 ATOM 846 C CA . VAL A 1 113 ? 52.139 -17.155 44.184 1.00 31.30 ? 134 VAL A CA 1 ATOM 847 C C . VAL A 1 113 ? 53.057 -17.349 45.367 1.00 32.19 ? 134 VAL A C 1 ATOM 848 O O . VAL A 1 113 ? 53.099 -16.517 46.268 1.00 37.94 ? 134 VAL A O 1 ATOM 849 C CB . VAL A 1 113 ? 52.986 -16.327 43.196 1.00 27.42 ? 134 VAL A CB 1 ATOM 850 C CG1 . VAL A 1 113 ? 53.831 -17.243 42.331 1.00 23.48 ? 134 VAL A CG1 1 ATOM 851 C CG2 . VAL A 1 113 ? 52.103 -15.467 42.369 1.00 31.17 ? 134 VAL A CG2 1 ATOM 852 N N . ARG A 1 114 ? 53.825 -18.430 45.338 1.00 31.18 ? 135 ARG A N 1 ATOM 853 C CA . ARG A 1 114 ? 54.874 -18.642 46.323 1.00 31.90 ? 135 ARG A CA 1 ATOM 854 C C . ARG A 1 114 ? 56.107 -17.855 45.924 1.00 34.37 ? 135 ARG A C 1 ATOM 855 O O . ARG A 1 114 ? 56.512 -17.863 44.757 1.00 33.60 ? 135 ARG A O 1 ATOM 856 C CB . ARG A 1 114 ? 55.235 -20.114 46.394 1.00 31.28 ? 135 ARG A CB 1 ATOM 857 C CG . ARG A 1 114 ? 54.248 -20.945 47.150 1.00 34.06 ? 135 ARG A CG 1 ATOM 858 C CD . ARG A 1 114 ? 54.771 -22.355 47.318 1.00 35.42 ? 135 ARG A CD 1 ATOM 859 N NE . ARG A 1 114 ? 54.739 -23.068 46.057 1.00 41.18 ? 135 ARG A NE 1 ATOM 860 C CZ . ARG A 1 114 ? 54.892 -24.379 45.933 1.00 49.70 ? 135 ARG A CZ 1 ATOM 861 N NH1 . ARG A 1 114 ? 55.099 -25.129 47.008 1.00 49.99 ? 135 ARG A NH1 1 ATOM 862 N NH2 . ARG A 1 114 ? 54.830 -24.935 44.729 1.00 47.27 ? 135 ARG A NH2 1 ATOM 863 N N . ARG A 1 115 ? 56.707 -17.169 46.886 1.00 29.09 ? 136 ARG A N 1 ATOM 864 C CA . ARG A 1 115 ? 57.930 -16.433 46.607 1.00 29.89 ? 136 ARG A CA 1 ATOM 865 C C . ARG A 1 115 ? 58.977 -17.427 46.132 1.00 23.90 ? 136 ARG A C 1 ATOM 866 O O . ARG A 1 115 ? 59.052 -18.539 46.639 1.00 22.58 ? 136 ARG A O 1 ATOM 867 C CB . ARG A 1 115 ? 58.380 -15.663 47.845 1.00 39.15 ? 136 ARG A CB 1 ATOM 868 C CG . ARG A 1 115 ? 59.874 -15.449 47.988 1.00 58.05 ? 136 ARG A CG 1 ATOM 869 C CD . ARG A 1 115 ? 60.107 -14.741 49.302 1.00 70.32 ? 136 ARG A CD 1 ATOM 870 N NE . ARG A 1 115 ? 58.849 -14.741 50.042 1.00 84.02 ? 136 ARG A NE 1 ATOM 871 C CZ . ARG A 1 115 ? 58.721 -14.486 51.338 1.00 87.98 ? 136 ARG A CZ 1 ATOM 872 N NH1 . ARG A 1 115 ? 59.788 -14.209 52.078 1.00 90.75 ? 136 ARG A NH1 1 ATOM 873 N NH2 . ARG A 1 115 ? 57.515 -14.518 51.889 1.00 85.13 ? 136 ARG A NH2 1 ATOM 874 N N . GLY A 1 116 ? 59.749 -17.051 45.121 1.00 24.00 ? 137 GLY A N 1 ATOM 875 C CA . GLY A 1 116 ? 60.731 -17.963 44.572 1.00 19.49 ? 137 GLY A CA 1 ATOM 876 C C . GLY A 1 116 ? 60.229 -18.720 43.357 1.00 27.15 ? 137 GLY A C 1 ATOM 877 O O . GLY A 1 116 ? 61.022 -19.302 42.624 1.00 21.53 ? 137 GLY A O 1 ATOM 878 N N . GLN A 1 117 ? 58.917 -18.717 43.133 1.00 24.21 ? 138 GLN A N 1 ATOM 879 C CA . GLN A 1 117 ? 58.351 -19.441 41.994 1.00 26.49 ? 138 GLN A CA 1 ATOM 880 C C . GLN A 1 117 ? 58.414 -18.593 40.735 1.00 28.06 ? 138 GLN A C 1 ATOM 881 O O . GLN A 1 117 ? 58.367 -17.374 40.807 1.00 23.91 ? 138 GLN A O 1 ATOM 882 C CB . GLN A 1 117 ? 56.895 -19.825 42.254 1.00 23.15 ? 138 GLN A CB 1 ATOM 883 C CG . GLN A 1 117 ? 56.275 -20.711 41.183 1.00 28.71 ? 138 GLN A CG 1 ATOM 884 C CD . GLN A 1 117 ? 56.920 -22.081 41.119 1.00 32.66 ? 138 GLN A CD 1 ATOM 885 O OE1 . GLN A 1 117 ? 57.839 -22.305 40.339 1.00 38.05 ? 138 GLN A OE1 1 ATOM 886 N NE2 . GLN A 1 117 ? 56.452 -23.001 41.954 1.00 28.04 ? 138 GLN A NE2 1 ATOM 887 N N . GLY A 1 118 ? 58.507 -19.239 39.579 1.00 26.08 ? 139 GLY A N 1 ATOM 888 C CA . GLY A 1 118 ? 58.397 -18.516 38.323 1.00 21.23 ? 139 GLY A CA 1 ATOM 889 C C . GLY A 1 118 ? 56.941 -18.292 37.969 1.00 26.47 ? 139 GLY A C 1 ATOM 890 O O . GLY A 1 118 ? 56.065 -19.083 38.331 1.00 25.53 ? 139 GLY A O 1 ATOM 891 N N . MET A 1 119 ? 56.653 -17.214 37.262 1.00 29.10 ? 140 MET A N 1 ATOM 892 C CA . MET A 1 119 ? 55.282 -17.039 36.842 1.00 33.10 ? 140 MET A CA 1 ATOM 893 C C . MET A 1 119 ? 55.099 -16.277 35.542 1.00 30.39 ? 140 MET A C 1 ATOM 894 O O . MET A 1 119 ? 55.985 -15.535 35.112 1.00 33.65 ? 140 MET A O 1 ATOM 895 C CB . MET A 1 119 ? 54.458 -16.408 37.955 1.00 38.55 ? 140 MET A CB 1 ATOM 896 C CG . MET A 1 119 ? 54.577 -14.911 38.049 1.00 34.01 ? 140 MET A CG 1 ATOM 897 S SD . MET A 1 119 ? 53.226 -14.315 39.068 1.00 67.83 ? 140 MET A SD 1 ATOM 898 C CE . MET A 1 119 ? 51.861 -15.100 38.205 1.00 49.47 ? 140 MET A CE 1 ATOM 899 N N . VAL A 1 120 ? 53.922 -16.474 34.942 1.00 27.42 ? 141 VAL A N 1 ATOM 900 C CA . VAL A 1 120 ? 53.519 -15.821 33.703 1.00 31.13 ? 141 VAL A CA 1 ATOM 901 C C . VAL A 1 120 ? 52.210 -15.052 33.881 1.00 28.74 ? 141 VAL A C 1 ATOM 902 O O . VAL A 1 120 ? 51.194 -15.622 34.284 1.00 31.15 ? 141 VAL A O 1 ATOM 903 C CB . VAL A 1 120 ? 53.316 -16.872 32.580 1.00 34.62 ? 141 VAL A CB 1 ATOM 904 C CG1 . VAL A 1 120 ? 53.104 -16.197 31.233 1.00 29.29 ? 141 VAL A CG1 1 ATOM 905 C CG2 . VAL A 1 120 ? 54.501 -17.831 32.529 1.00 28.56 ? 141 VAL A CG2 1 ATOM 906 N N . LEU A 1 121 ? 52.238 -13.757 33.588 1.00 25.21 ? 142 LEU A N 1 ATOM 907 C CA . LEU A 1 121 ? 51.018 -12.950 33.481 1.00 30.38 ? 142 LEU A CA 1 ATOM 908 C C . LEU A 1 121 ? 50.643 -12.736 31.999 1.00 41.05 ? 142 LEU A C 1 ATOM 909 O O . LEU A 1 121 ? 51.373 -12.080 31.253 1.00 40.87 ? 142 LEU A O 1 ATOM 910 C CB . LEU A 1 121 ? 51.214 -11.594 34.165 1.00 32.05 ? 142 LEU A CB 1 ATOM 911 C CG . LEU A 1 121 ? 51.358 -11.576 35.697 1.00 39.89 ? 142 LEU A CG 1 ATOM 912 C CD1 . LEU A 1 121 ? 52.096 -10.345 36.155 1.00 43.97 ? 142 LEU A CD1 1 ATOM 913 C CD2 . LEU A 1 121 ? 50.005 -11.618 36.346 1.00 39.78 ? 142 LEU A CD2 1 ATOM 914 N N . LEU A 1 122 ? 49.511 -13.289 31.574 1.00 37.06 ? 143 LEU A N 1 ATOM 915 C CA . LEU A 1 122 ? 49.134 -13.251 30.165 1.00 37.81 ? 143 LEU A CA 1 ATOM 916 C C . LEU A 1 122 ? 48.450 -11.949 29.817 1.00 42.10 ? 143 LEU A C 1 ATOM 917 O O . LEU A 1 122 ? 47.563 -11.500 30.536 1.00 47.37 ? 143 LEU A O 1 ATOM 918 C CB . LEU A 1 122 ? 48.223 -14.431 29.805 1.00 33.79 ? 143 LEU A CB 1 ATOM 919 C CG . LEU A 1 122 ? 48.836 -15.803 30.113 1.00 36.95 ? 143 LEU A CG 1 ATOM 920 C CD1 . LEU A 1 122 ? 47.813 -16.913 29.961 1.00 38.49 ? 143 LEU A CD1 1 ATOM 921 C CD2 . LEU A 1 122 ? 50.068 -16.073 29.244 1.00 36.05 ? 143 LEU A CD2 1 ATOM 922 N N . CYS A 1 123 ? 48.871 -11.337 28.715 1.00 40.94 ? 144 CYS A N 1 ATOM 923 C CA . CYS A 1 123 ? 48.215 -10.128 28.231 1.00 53.13 ? 144 CYS A CA 1 ATOM 924 C C . CYS A 1 123 ? 46.781 -10.434 27.789 1.00 55.08 ? 144 CYS A C 1 ATOM 925 O O . CYS A 1 123 ? 45.817 -10.008 28.432 1.00 59.42 ? 144 CYS A O 1 ATOM 926 C CB . CYS A 1 123 ? 49.007 -9.505 27.076 1.00 57.51 ? 144 CYS A CB 1 ATOM 927 S SG . CYS A 1 123 ? 48.679 -7.736 26.808 1.00 76.85 ? 144 CYS A SG 1 ATOM 928 N N . GLY A 1 124 ? 46.652 -11.190 26.702 1.00 51.97 ? 145 GLY A N 1 ATOM 929 C CA . GLY A 1 124 ? 45.357 -11.488 26.117 1.00 48.37 ? 145 GLY A CA 1 ATOM 930 C C . GLY A 1 124 ? 44.825 -10.290 25.349 1.00 52.23 ? 145 GLY A C 1 ATOM 931 O O . GLY A 1 124 ? 43.791 -9.724 25.704 1.00 52.34 ? 145 GLY A O 1 ATOM 932 N N . PRO A 1 125 ? 45.533 -9.893 24.285 1.00 48.35 ? 146 PRO A N 1 ATOM 933 C CA . PRO A 1 125 ? 45.105 -8.762 23.455 1.00 54.95 ? 146 PRO A CA 1 ATOM 934 C C . PRO A 1 125 ? 43.676 -8.933 22.930 1.00 51.37 ? 146 PRO A C 1 ATOM 935 O O . PRO A 1 125 ? 43.255 -10.050 22.633 1.00 53.01 ? 146 PRO A O 1 ATOM 936 C CB . PRO A 1 125 ? 46.096 -8.789 22.281 1.00 61.21 ? 146 PRO A CB 1 ATOM 937 C CG . PRO A 1 125 ? 47.259 -9.601 22.765 1.00 62.90 ? 146 PRO A CG 1 ATOM 938 C CD . PRO A 1 125 ? 46.692 -10.599 23.718 1.00 51.26 ? 146 PRO A CD 1 ATOM 939 N N . PRO A 1 126 ? 42.928 -7.829 22.828 1.00 51.85 ? 147 PRO A N 1 ATOM 940 C CA . PRO A 1 126 ? 41.604 -7.840 22.193 1.00 57.18 ? 147 PRO A CA 1 ATOM 941 C C . PRO A 1 126 ? 41.736 -8.055 20.684 1.00 64.16 ? 147 PRO A C 1 ATOM 942 O O . PRO A 1 126 ? 42.839 -7.921 20.154 1.00 62.56 ? 147 PRO A O 1 ATOM 943 C CB . PRO A 1 126 ? 41.075 -6.428 22.470 1.00 59.12 ? 147 PRO A CB 1 ATOM 944 C CG . PRO A 1 126 ? 41.923 -5.912 23.620 1.00 61.92 ? 147 PRO A CG 1 ATOM 945 C CD . PRO A 1 126 ? 43.263 -6.510 23.387 1.00 50.73 ? 147 PRO A CD 1 ATOM 946 N N . PRO A 1 127 ? 40.626 -8.376 19.996 1.00 66.86 ? 148 PRO A N 1 ATOM 947 C CA . PRO A 1 127 ? 40.701 -8.568 18.545 1.00 64.23 ? 148 PRO A CA 1 ATOM 948 C C . PRO A 1 127 ? 41.287 -7.333 17.864 1.00 60.53 ? 148 PRO A C 1 ATOM 949 O O . PRO A 1 127 ? 40.959 -6.206 18.225 1.00 58.74 ? 148 PRO A O 1 ATOM 950 C CB . PRO A 1 127 ? 39.239 -8.770 18.144 1.00 71.37 ? 148 PRO A CB 1 ATOM 951 C CG . PRO A 1 127 ? 38.570 -9.257 19.389 1.00 71.22 ? 148 PRO A CG 1 ATOM 952 C CD . PRO A 1 127 ? 39.254 -8.544 20.506 1.00 66.04 ? 148 PRO A CD 1 ATOM 953 N N . HIS A 1 128 ? 42.157 -7.550 16.889 1.00 59.49 ? 149 HIS A N 1 ATOM 954 C CA . HIS A 1 128 ? 42.930 -6.459 16.320 1.00 61.51 ? 149 HIS A CA 1 ATOM 955 C C . HIS A 1 128 ? 43.440 -6.857 14.952 1.00 60.63 ? 149 HIS A C 1 ATOM 956 O O . HIS A 1 128 ? 43.360 -8.021 14.563 1.00 68.94 ? 149 HIS A O 1 ATOM 957 C CB . HIS A 1 128 ? 44.141 -6.185 17.212 1.00 57.64 ? 149 HIS A CB 1 ATOM 958 C CG . HIS A 1 128 ? 45.098 -7.331 17.276 1.00 45.63 ? 149 HIS A CG 1 ATOM 959 N ND1 . HIS A 1 128 ? 44.952 -8.376 18.166 1.00 51.97 ? 149 HIS A ND1 1 ATOM 960 C CD2 . HIS A 1 128 ? 46.197 -7.618 16.539 1.00 43.56 ? 149 HIS A CD2 1 ATOM 961 C CE1 . HIS A 1 128 ? 45.928 -9.247 17.984 1.00 50.79 ? 149 HIS A CE1 1 ATOM 962 N NE2 . HIS A 1 128 ? 46.695 -8.814 16.998 1.00 47.61 ? 149 HIS A NE2 1 ATOM 963 N N . SER A 1 129 ? 43.990 -5.889 14.233 1.00 53.46 ? 150 SER A N 1 ATOM 964 C CA . SER A 1 129 ? 44.700 -6.173 12.992 1.00 58.73 ? 150 SER A CA 1 ATOM 965 C C . SER A 1 129 ? 45.806 -5.150 12.807 1.00 59.25 ? 150 SER A C 1 ATOM 966 O O . SER A 1 129 ? 45.601 -3.948 13.012 1.00 60.74 ? 150 SER A O 1 ATOM 967 C CB . SER A 1 129 ? 43.752 -6.162 11.783 1.00 61.10 ? 150 SER A CB 1 ATOM 968 O OG . SER A 1 129 ? 44.476 -6.376 10.575 1.00 64.98 ? 150 SER A OG 1 ATOM 969 N N . GLY A 1 130 ? 46.970 -5.640 12.396 1.00 54.15 ? 151 GLY A N 1 ATOM 970 C CA . GLY A 1 130 ? 48.177 -4.842 12.362 1.00 58.58 ? 151 GLY A CA 1 ATOM 971 C C . GLY A 1 130 ? 49.086 -5.293 13.491 1.00 59.44 ? 151 GLY A C 1 ATOM 972 O O . GLY A 1 130 ? 48.668 -6.044 14.372 1.00 60.64 ? 151 GLY A O 1 ATOM 973 N N . GLU A 1 131 ? 50.331 -4.838 13.470 1.00 62.89 ? 152 GLU A N 1 ATOM 974 C CA . GLU A 1 131 ? 51.308 -5.276 14.459 1.00 67.56 ? 152 GLU A CA 1 ATOM 975 C C . GLU A 1 131 ? 51.110 -4.577 15.808 1.00 62.82 ? 152 GLU A C 1 ATOM 976 O O . GLU A 1 131 ? 50.815 -3.383 15.860 1.00 67.37 ? 152 GLU A O 1 ATOM 977 C CB . GLU A 1 131 ? 52.717 -5.045 13.926 1.00 73.49 ? 152 GLU A CB 1 ATOM 978 C CG . GLU A 1 131 ? 53.816 -5.583 14.808 1.00 86.65 ? 152 GLU A CG 1 ATOM 979 C CD . GLU A 1 131 ? 55.170 -5.486 14.145 1.00 98.18 ? 152 GLU A CD 1 ATOM 980 O OE1 . GLU A 1 131 ? 55.393 -6.194 13.135 1.00 99.41 ? 152 GLU A OE1 1 ATOM 981 O OE2 . GLU A 1 131 ? 56.007 -4.697 14.634 1.00 101.82 ? 152 GLU A OE2 1 ATOM 982 N N . LEU A 1 132 ? 51.269 -5.324 16.896 1.00 57.69 ? 153 LEU A N 1 ATOM 983 C CA . LEU A 1 132 ? 51.094 -4.749 18.235 1.00 63.21 ? 153 LEU A CA 1 ATOM 984 C C . LEU A 1 132 ? 52.391 -4.573 19.026 1.00 63.03 ? 153 LEU A C 1 ATOM 985 O O . LEU A 1 132 ? 53.376 -5.288 18.833 1.00 63.49 ? 153 LEU A O 1 ATOM 986 C CB . LEU A 1 132 ? 50.086 -5.561 19.059 1.00 55.76 ? 153 LEU A CB 1 ATOM 987 C CG . LEU A 1 132 ? 48.701 -5.741 18.425 1.00 54.07 ? 153 LEU A CG 1 ATOM 988 C CD1 . LEU A 1 132 ? 47.727 -6.353 19.426 1.00 50.20 ? 153 LEU A CD1 1 ATOM 989 C CD2 . LEU A 1 132 ? 48.179 -4.417 17.918 1.00 48.95 ? 153 LEU A CD2 1 ATOM 990 N N . SER A 1 133 ? 52.360 -3.604 19.927 1.00 56.69 ? 154 SER A N 1 ATOM 991 C CA . SER A 1 133 ? 53.474 -3.291 20.798 1.00 42.87 ? 154 SER A CA 1 ATOM 992 C C . SER A 1 133 ? 52.958 -3.415 22.228 1.00 50.69 ? 154 SER A C 1 ATOM 993 O O . SER A 1 133 ? 51.799 -3.083 22.490 1.00 51.42 ? 154 SER A O 1 ATOM 994 C CB . SER A 1 133 ? 53.908 -1.854 20.546 1.00 37.69 ? 154 SER A CB 1 ATOM 995 O OG . SER A 1 133 ? 55.174 -1.606 21.108 1.00 54.10 ? 154 SER A OG 1 ATOM 996 N N . TYR A 1 134 ? 53.811 -3.861 23.151 1.00 41.53 ? 155 TYR A N 1 ATOM 997 C CA . TYR A 1 134 ? 53.388 -4.126 24.529 1.00 40.33 ? 155 TYR A CA 1 ATOM 998 C C . TYR A 1 134 ? 54.277 -3.527 25.622 1.00 46.68 ? 155 TYR A C 1 ATOM 999 O O . TYR A 1 134 ? 55.501 -3.498 25.493 1.00 46.77 ? 155 TYR A O 1 ATOM 1000 C CB . TYR A 1 134 ? 53.351 -5.620 24.773 1.00 34.54 ? 155 TYR A CB 1 ATOM 1001 C CG . TYR A 1 134 ? 52.445 -6.400 23.870 1.00 45.54 ? 155 TYR A CG 1 ATOM 1002 C CD1 . TYR A 1 134 ? 52.898 -6.869 22.639 1.00 39.56 ? 155 TYR A CD1 1 ATOM 1003 C CD2 . TYR A 1 134 ? 51.141 -6.703 24.257 1.00 42.72 ? 155 TYR A CD2 1 ATOM 1004 C CE1 . TYR A 1 134 ? 52.075 -7.609 21.817 1.00 37.26 ? 155 TYR A CE1 1 ATOM 1005 C CE2 . TYR A 1 134 ? 50.312 -7.445 23.436 1.00 52.06 ? 155 TYR A CE2 1 ATOM 1006 C CZ . TYR A 1 134 ? 50.783 -7.890 22.211 1.00 47.69 ? 155 TYR A CZ 1 ATOM 1007 O OH . TYR A 1 134 ? 49.962 -8.625 21.380 1.00 45.51 ? 155 TYR A OH 1 ATOM 1008 N N . ALA A 1 135 ? 53.648 -3.091 26.713 1.00 42.72 ? 156 ALA A N 1 ATOM 1009 C CA . ALA A 1 135 ? 54.363 -2.701 27.931 1.00 44.00 ? 156 ALA A CA 1 ATOM 1010 C C . ALA A 1 135 ? 53.494 -2.986 29.156 1.00 45.49 ? 156 ALA A C 1 ATOM 1011 O O . ALA A 1 135 ? 52.277 -3.106 29.047 1.00 46.32 ? 156 ALA A O 1 ATOM 1012 C CB . ALA A 1 135 ? 54.757 -1.235 27.885 1.00 39.75 ? 156 ALA A CB 1 ATOM 1013 N N . TRP A 1 136 ? 54.114 -3.107 30.321 1.00 47.90 ? 157 TRP A N 1 ATOM 1014 C CA . TRP A 1 136 ? 53.347 -3.339 31.537 1.00 44.39 ? 157 TRP A CA 1 ATOM 1015 C C . TRP A 1 136 ? 53.508 -2.244 32.564 1.00 42.65 ? 157 TRP A C 1 ATOM 1016 O O . TRP A 1 136 ? 54.536 -1.569 32.629 1.00 45.16 ? 157 TRP A O 1 ATOM 1017 C CB . TRP A 1 136 ? 53.702 -4.674 32.163 1.00 36.45 ? 157 TRP A CB 1 ATOM 1018 C CG . TRP A 1 136 ? 53.168 -5.839 31.420 1.00 38.34 ? 157 TRP A CG 1 ATOM 1019 C CD1 . TRP A 1 136 ? 53.635 -6.344 30.241 1.00 34.15 ? 157 TRP A CD1 1 ATOM 1020 C CD2 . TRP A 1 136 ? 52.068 -6.668 31.807 1.00 34.08 ? 157 TRP A CD2 1 ATOM 1021 N NE1 . TRP A 1 136 ? 52.893 -7.440 29.873 1.00 33.67 ? 157 TRP A NE1 1 ATOM 1022 C CE2 . TRP A 1 136 ? 51.921 -7.657 30.816 1.00 31.77 ? 157 TRP A CE2 1 ATOM 1023 C CE3 . TRP A 1 136 ? 51.185 -6.663 32.893 1.00 32.62 ? 157 TRP A CE3 1 ATOM 1024 C CZ2 . TRP A 1 136 ? 50.929 -8.636 30.877 1.00 33.06 ? 157 TRP A CZ2 1 ATOM 1025 C CZ3 . TRP A 1 136 ? 50.207 -7.641 32.960 1.00 29.75 ? 157 TRP A CZ3 1 ATOM 1026 C CH2 . TRP A 1 136 ? 50.086 -8.615 31.956 1.00 32.14 ? 157 TRP A CH2 1 ATOM 1027 N N . ILE A 1 137 ? 52.468 -2.078 33.366 1.00 40.36 ? 158 ILE A N 1 ATOM 1028 C CA . ILE A 1 137 ? 52.477 -1.130 34.471 1.00 42.89 ? 158 ILE A CA 1 ATOM 1029 C C . ILE A 1 137 ? 52.438 -1.900 35.790 1.00 42.14 ? 158 ILE A C 1 ATOM 1030 O O . ILE A 1 137 ? 51.685 -2.871 35.928 1.00 37.76 ? 158 ILE A O 1 ATOM 1031 C CB . ILE A 1 137 ? 51.277 -0.170 34.371 1.00 41.93 ? 158 ILE A CB 1 ATOM 1032 C CG1 . ILE A 1 137 ? 51.429 0.736 33.142 1.00 40.36 ? 158 ILE A CG1 1 ATOM 1033 C CG2 . ILE A 1 137 ? 51.140 0.671 35.630 1.00 39.57 ? 158 ILE A CG2 1 ATOM 1034 C CD1 . ILE A 1 137 ? 50.203 1.594 32.877 1.00 37.73 ? 158 ILE A CD1 1 ATOM 1035 N N . PHE A 1 138 ? 53.276 -1.491 36.741 1.00 39.22 ? 159 PHE A N 1 ATOM 1036 C CA . PHE A 1 138 ? 53.262 -2.072 38.083 1.00 30.50 ? 159 PHE A CA 1 ATOM 1037 C C . PHE A 1 138 ? 53.061 -0.989 39.151 1.00 38.40 ? 159 PHE A C 1 ATOM 1038 O O . PHE A 1 138 ? 53.827 -0.025 39.242 1.00 38.97 ? 159 PHE A O 1 ATOM 1039 C CB . PHE A 1 138 ? 54.526 -2.898 38.339 1.00 34.75 ? 159 PHE A CB 1 ATOM 1040 C CG . PHE A 1 138 ? 54.625 -3.453 39.746 1.00 36.93 ? 159 PHE A CG 1 ATOM 1041 C CD1 . PHE A 1 138 ? 53.691 -4.364 40.221 1.00 41.36 ? 159 PHE A CD1 1 ATOM 1042 C CD2 . PHE A 1 138 ? 55.660 -3.070 40.583 1.00 28.51 ? 159 PHE A CD2 1 ATOM 1043 C CE1 . PHE A 1 138 ? 53.776 -4.874 41.516 1.00 40.54 ? 159 PHE A CE1 1 ATOM 1044 C CE2 . PHE A 1 138 ? 55.753 -3.573 41.883 1.00 36.36 ? 159 PHE A CE2 1 ATOM 1045 C CZ . PHE A 1 138 ? 54.808 -4.474 42.348 1.00 28.74 ? 159 PHE A CZ 1 ATOM 1046 N N . ASN A 1 139 ? 52.007 -1.136 39.942 1.00 38.15 ? 160 ASN A N 1 ATOM 1047 C CA . ASN A 1 139 ? 51.694 -0.140 40.964 1.00 39.49 ? 160 ASN A CA 1 ATOM 1048 C C . ASN A 1 139 ? 51.834 1.299 40.476 1.00 47.69 ? 160 ASN A C 1 ATOM 1049 O O . ASN A 1 139 ? 52.577 2.090 41.057 1.00 49.52 ? 160 ASN A O 1 ATOM 1050 C CB . ASN A 1 139 ? 52.553 -0.374 42.209 1.00 33.01 ? 160 ASN A CB 1 ATOM 1051 C CG . ASN A 1 139 ? 52.159 -1.631 42.935 1.00 41.66 ? 160 ASN A CG 1 ATOM 1052 O OD1 . ASN A 1 139 ? 51.050 -2.136 42.740 1.00 37.34 ? 160 ASN A OD1 1 ATOM 1053 N ND2 . ASN A 1 139 ? 53.057 -2.157 43.769 1.00 45.36 ? 160 ASN A ND2 1 ATOM 1054 N N . GLU A 1 140 ? 51.118 1.614 39.399 1.00 51.85 ? 161 GLU A N 1 ATOM 1055 C CA . GLU A 1 140 ? 51.002 2.978 38.869 1.00 56.28 ? 161 GLU A CA 1 ATOM 1056 C C . GLU A 1 140 ? 52.193 3.460 38.039 1.00 54.91 ? 161 GLU A C 1 ATOM 1057 O O . GLU A 1 140 ? 52.143 4.543 37.452 1.00 59.02 ? 161 GLU A O 1 ATOM 1058 C CB . GLU A 1 140 ? 50.696 3.988 39.984 1.00 64.50 ? 161 GLU A CB 1 ATOM 1059 C CG . GLU A 1 140 ? 49.432 3.690 40.796 1.00 76.28 ? 161 GLU A CG 1 ATOM 1060 C CD . GLU A 1 140 ? 48.140 3.921 40.023 1.00 92.18 ? 161 GLU A CD 1 ATOM 1061 O OE1 . GLU A 1 140 ? 48.160 3.878 38.772 1.00 99.09 ? 161 GLU A OE1 1 ATOM 1062 O OE2 . GLU A 1 140 ? 47.095 4.142 40.673 1.00 96.20 ? 161 GLU A OE2 1 ATOM 1063 N N . TYR A 1 141 ? 53.255 2.663 37.982 1.00 48.67 ? 162 TYR A N 1 ATOM 1064 C CA . TYR A 1 141 ? 54.445 3.048 37.223 1.00 52.62 ? 162 TYR A CA 1 ATOM 1065 C C . TYR A 1 141 ? 54.931 1.976 36.245 1.00 50.63 ? 162 TYR A C 1 ATOM 1066 O O . TYR A 1 141 ? 54.695 0.785 36.451 1.00 50.22 ? 162 TYR A O 1 ATOM 1067 C CB . TYR A 1 141 ? 55.576 3.435 38.176 1.00 57.77 ? 162 TYR A CB 1 ATOM 1068 C CG . TYR A 1 141 ? 55.289 4.701 38.937 1.00 73.29 ? 162 TYR A CG 1 ATOM 1069 C CD1 . TYR A 1 141 ? 55.523 5.943 38.363 1.00 84.34 ? 162 TYR A CD1 1 ATOM 1070 C CD2 . TYR A 1 141 ? 54.772 4.658 40.223 1.00 78.97 ? 162 TYR A CD2 1 ATOM 1071 C CE1 . TYR A 1 141 ? 55.259 7.107 39.053 1.00 89.50 ? 162 TYR A CE1 1 ATOM 1072 C CE2 . TYR A 1 141 ? 54.505 5.816 40.921 1.00 85.22 ? 162 TYR A CE2 1 ATOM 1073 C CZ . TYR A 1 141 ? 54.751 7.037 40.331 1.00 91.05 ? 162 TYR A CZ 1 ATOM 1074 O OH . TYR A 1 141 ? 54.485 8.196 41.018 1.00 97.73 ? 162 TYR A OH 1 ATOM 1075 N N . PRO A 1 142 ? 55.613 2.400 35.168 1.00 45.06 ? 163 PRO A N 1 ATOM 1076 C CA . PRO A 1 142 ? 56.164 1.437 34.214 1.00 47.92 ? 163 PRO A CA 1 ATOM 1077 C C . PRO A 1 142 ? 56.916 0.315 34.923 1.00 52.44 ? 163 PRO A C 1 ATOM 1078 O O . PRO A 1 142 ? 57.742 0.571 35.804 1.00 50.12 ? 163 PRO A O 1 ATOM 1079 C CB . PRO A 1 142 ? 57.116 2.292 33.368 1.00 45.72 ? 163 PRO A CB 1 ATOM 1080 C CG . PRO A 1 142 ? 56.475 3.636 33.364 1.00 47.98 ? 163 PRO A CG 1 ATOM 1081 C CD . PRO A 1 142 ? 55.806 3.791 34.722 1.00 48.34 ? 163 PRO A CD 1 ATOM 1082 N N . SER A 1 143 ? 56.603 -0.920 34.546 1.00 49.73 ? 164 SER A N 1 ATOM 1083 C CA . SER A 1 143 ? 57.238 -2.100 35.114 1.00 36.85 ? 164 SER A CA 1 ATOM 1084 C C . SER A 1 143 ? 58.658 -2.233 34.576 1.00 46.79 ? 164 SER A C 1 ATOM 1085 O O . SER A 1 143 ? 58.888 -2.130 33.371 1.00 59.10 ? 164 SER A O 1 ATOM 1086 C CB . SER A 1 143 ? 56.420 -3.349 34.776 1.00 37.04 ? 164 SER A CB 1 ATOM 1087 O OG . SER A 1 143 ? 56.928 -4.502 35.434 1.00 45.28 ? 164 SER A OG 1 ATOM 1088 N N . TYR A 1 144 ? 59.607 -2.462 35.476 1.00 44.17 ? 165 TYR A N 1 ATOM 1089 C CA . TYR A 1 144 ? 61.018 -2.484 35.115 1.00 41.76 ? 165 TYR A CA 1 ATOM 1090 C C . TYR A 1 144 ? 61.395 -3.816 34.471 1.00 40.05 ? 165 TYR A C 1 ATOM 1091 O O . TYR A 1 144 ? 60.996 -4.876 34.947 1.00 46.99 ? 165 TYR A O 1 ATOM 1092 C CB . TYR A 1 144 ? 61.894 -2.204 36.345 1.00 43.54 ? 165 TYR A CB 1 ATOM 1093 C CG . TYR A 1 144 ? 63.347 -2.002 35.999 1.00 43.25 ? 165 TYR A CG 1 ATOM 1094 C CD1 . TYR A 1 144 ? 63.780 -0.819 35.416 1.00 48.41 ? 165 TYR A CD1 1 ATOM 1095 C CD2 . TYR A 1 144 ? 64.285 -3.002 36.233 1.00 39.70 ? 165 TYR A CD2 1 ATOM 1096 C CE1 . TYR A 1 144 ? 65.113 -0.629 35.079 1.00 53.30 ? 165 TYR A CE1 1 ATOM 1097 C CE2 . TYR A 1 144 ? 65.620 -2.824 35.898 1.00 41.69 ? 165 TYR A CE2 1 ATOM 1098 C CZ . TYR A 1 144 ? 66.029 -1.636 35.320 1.00 53.83 ? 165 TYR A CZ 1 ATOM 1099 O OH . TYR A 1 144 ? 67.356 -1.452 34.986 1.00 60.71 ? 165 TYR A OH 1 ATOM 1100 N N . GLN A 1 145 ? 62.156 -3.753 33.381 1.00 35.45 ? 166 GLN A N 1 ATOM 1101 C CA . GLN A 1 145 ? 62.536 -4.949 32.632 1.00 33.50 ? 166 GLN A CA 1 ATOM 1102 C C . GLN A 1 145 ? 63.990 -5.308 32.885 1.00 23.22 ? 166 GLN A C 1 ATOM 1103 O O . GLN A 1 145 ? 64.857 -4.436 32.896 1.00 29.58 ? 166 GLN A O 1 ATOM 1104 C CB . GLN A 1 145 ? 62.307 -4.744 31.126 1.00 40.94 ? 166 GLN A CB 1 ATOM 1105 C CG . GLN A 1 145 ? 60.863 -4.912 30.682 1.00 45.77 ? 166 GLN A CG 1 ATOM 1106 C CD . GLN A 1 145 ? 60.583 -4.287 29.319 1.00 51.40 ? 166 GLN A CD 1 ATOM 1107 O OE1 . GLN A 1 145 ? 59.644 -3.508 29.172 1.00 60.12 ? 166 GLN A OE1 1 ATOM 1108 N NE2 . GLN A 1 145 ? 61.395 -4.627 28.320 1.00 41.20 ? 166 GLN A NE2 1 ATOM 1109 N N . ASP A 1 146 ? 64.263 -6.594 33.093 1.00 19.91 ? 167 ASP A N 1 ATOM 1110 C CA . ASP A 1 146 ? 65.636 -7.019 33.317 1.00 15.05 ? 167 ASP A CA 1 ATOM 1111 C C . ASP A 1 146 ? 65.790 -8.521 33.296 1.00 26.57 ? 167 ASP A C 1 ATOM 1112 O O . ASP A 1 146 ? 64.904 -9.252 32.857 1.00 29.74 ? 167 ASP A O 1 ATOM 1113 C CB . ASP A 1 146 ? 66.193 -6.432 34.641 1.00 35.74 ? 167 ASP A CB 1 ATOM 1114 C CG . ASP A 1 146 ? 65.495 -6.992 35.905 1.00 43.35 ? 167 ASP A CG 1 ATOM 1115 O OD1 . ASP A 1 146 ? 65.790 -6.492 37.009 1.00 52.83 ? 167 ASP A OD1 1 ATOM 1116 O OD2 . ASP A 1 146 ? 64.668 -7.924 35.818 1.00 40.29 ? 167 ASP A OD2 1 ATOM 1117 N N . ASN A 1 147 ? 66.956 -8.942 33.761 1.00 25.89 ? 168 ASN A N 1 ATOM 1118 C CA . ASN A 1 147 ? 67.310 -10.324 34.045 1.00 34.24 ? 168 ASN A CA 1 ATOM 1119 C C . ASN A 1 147 ? 66.122 -11.191 34.484 1.00 31.58 ? 168 ASN A C 1 ATOM 1120 O O . ASN A 1 147 ? 66.001 -12.350 34.082 1.00 38.62 ? 168 ASN A O 1 ATOM 1121 C CB . ASN A 1 147 ? 68.342 -10.270 35.191 1.00 51.59 ? 168 ASN A CB 1 ATOM 1122 C CG . ASN A 1 147 ? 69.184 -11.515 35.302 1.00 70.54 ? 168 ASN A CG 1 ATOM 1123 O OD1 . ASN A 1 147 ? 69.498 -12.168 34.306 1.00 84.59 ? 168 ASN A OD1 1 ATOM 1124 N ND2 . ASN A 1 147 ? 69.579 -11.842 36.524 1.00 72.89 ? 168 ASN A ND2 1 ATOM 1125 N N . ARG A 1 148 ? 65.258 -10.616 35.323 1.00 28.96 ? 169 ARG A N 1 ATOM 1126 C CA . ARG A 1 148 ? 64.249 -11.364 36.067 1.00 26.52 ? 169 ARG A CA 1 ATOM 1127 C C . ARG A 1 148 ? 62.823 -11.145 35.519 1.00 31.31 ? 169 ARG A C 1 ATOM 1128 O O . ARG A 1 148 ? 61.933 -11.983 35.733 1.00 24.60 ? 169 ARG A O 1 ATOM 1129 C CB . ARG A 1 148 ? 64.320 -10.964 37.553 1.00 18.89 ? 169 ARG A CB 1 ATOM 1130 C CG . ARG A 1 148 ? 63.494 -11.837 38.540 1.00 32.45 ? 169 ARG A CG 1 ATOM 1131 C CD . ARG A 1 148 ? 63.759 -11.436 40.024 1.00 24.15 ? 169 ARG A CD 1 ATOM 1132 N NE . ARG A 1 148 ? 63.293 -10.075 40.289 1.00 26.97 ? 169 ARG A NE 1 ATOM 1133 C CZ . ARG A 1 148 ? 62.032 -9.764 40.575 1.00 27.47 ? 169 ARG A CZ 1 ATOM 1134 N NH1 . ARG A 1 148 ? 61.114 -10.715 40.664 1.00 25.54 ? 169 ARG A NH1 1 ATOM 1135 N NH2 . ARG A 1 148 ? 61.688 -8.503 40.768 1.00 22.85 ? 169 ARG A NH2 1 ATOM 1136 N N . ARG A 1 149 ? 62.610 -10.015 34.839 1.00 26.84 ? 170 ARG A N 1 ATOM 1137 C CA . ARG A 1 149 ? 61.312 -9.675 34.239 1.00 32.26 ? 170 ARG A CA 1 ATOM 1138 C C . ARG A 1 149 ? 61.411 -9.411 32.727 1.00 37.54 ? 170 ARG A C 1 ATOM 1139 O O . ARG A 1 149 ? 62.108 -8.497 32.279 1.00 37.76 ? 170 ARG A O 1 ATOM 1140 C CB . ARG A 1 149 ? 60.674 -8.457 34.921 1.00 36.29 ? 170 ARG A CB 1 ATOM 1141 C CG . ARG A 1 149 ? 60.454 -8.593 36.426 1.00 38.99 ? 170 ARG A CG 1 ATOM 1142 C CD . ARG A 1 149 ? 61.532 -7.839 37.192 1.00 36.18 ? 170 ARG A CD 1 ATOM 1143 N NE . ARG A 1 149 ? 61.018 -6.654 37.859 1.00 41.13 ? 170 ARG A NE 1 ATOM 1144 C CZ . ARG A 1 149 ? 61.772 -5.794 38.539 1.00 47.64 ? 170 ARG A CZ 1 ATOM 1145 N NH1 . ARG A 1 149 ? 63.088 -5.969 38.613 1.00 37.13 ? 170 ARG A NH1 1 ATOM 1146 N NH2 . ARG A 1 149 ? 61.210 -4.750 39.134 1.00 59.63 ? 170 ARG A NH2 1 ATOM 1147 N N . PHE A 1 150 ? 60.692 -10.206 31.947 1.00 34.01 ? 171 PHE A N 1 ATOM 1148 C CA . PHE A 1 150 ? 60.769 -10.122 30.501 1.00 28.09 ? 171 PHE A CA 1 ATOM 1149 C C . PHE A 1 150 ? 59.364 -9.950 29.926 1.00 33.44 ? 171 PHE A C 1 ATOM 1150 O O . PHE A 1 150 ? 58.459 -10.698 30.277 1.00 37.21 ? 171 PHE A O 1 ATOM 1151 C CB . PHE A 1 150 ? 61.446 -11.384 29.948 1.00 29.88 ? 171 PHE A CB 1 ATOM 1152 C CG . PHE A 1 150 ? 61.431 -11.488 28.435 1.00 32.58 ? 171 PHE A CG 1 ATOM 1153 C CD1 . PHE A 1 150 ? 62.426 -10.897 27.675 1.00 26.47 ? 171 PHE A CD1 1 ATOM 1154 C CD2 . PHE A 1 150 ? 60.428 -12.191 27.783 1.00 30.65 ? 171 PHE A CD2 1 ATOM 1155 C CE1 . PHE A 1 150 ? 62.419 -10.989 26.284 1.00 31.54 ? 171 PHE A CE1 1 ATOM 1156 C CE2 . PHE A 1 150 ? 60.412 -12.288 26.389 1.00 38.42 ? 171 PHE A CE2 1 ATOM 1157 C CZ . PHE A 1 150 ? 61.412 -11.691 25.640 1.00 28.56 ? 171 PHE A CZ 1 ATOM 1158 N N . VAL A 1 151 ? 59.184 -8.945 29.068 1.00 33.70 ? 172 VAL A N 1 ATOM 1159 C CA . VAL A 1 151 ? 57.925 -8.753 28.343 1.00 30.43 ? 172 VAL A CA 1 ATOM 1160 C C . VAL A 1 151 ? 58.065 -9.151 26.874 1.00 37.17 ? 172 VAL A C 1 ATOM 1161 O O . VAL A 1 151 ? 58.848 -8.549 26.144 1.00 31.15 ? 172 VAL A O 1 ATOM 1162 C CB . VAL A 1 151 ? 57.475 -7.293 28.359 1.00 29.04 ? 172 VAL A CB 1 ATOM 1163 C CG1 . VAL A 1 151 ? 56.218 -7.125 27.506 1.00 30.74 ? 172 VAL A CG1 1 ATOM 1164 C CG2 . VAL A 1 151 ? 57.220 -6.837 29.779 1.00 32.03 ? 172 VAL A CG2 1 ATOM 1165 N N . SER A 1 152 ? 57.301 -10.150 26.443 1.00 36.59 ? 173 SER A N 1 ATOM 1166 C CA . SER A 1 152 ? 57.341 -10.599 25.053 1.00 39.67 ? 173 SER A CA 1 ATOM 1167 C C . SER A 1 152 ? 56.613 -9.651 24.088 1.00 46.98 ? 173 SER A C 1 ATOM 1168 O O . SER A 1 152 ? 55.492 -9.217 24.354 1.00 44.79 ? 173 SER A O 1 ATOM 1169 C CB . SER A 1 152 ? 56.752 -12.001 24.932 1.00 40.13 ? 173 SER A CB 1 ATOM 1170 O OG . SER A 1 152 ? 56.769 -12.419 23.582 1.00 41.55 ? 173 SER A OG 1 ATOM 1171 N N . GLN A 1 153 ? 57.258 -9.340 22.965 1.00 45.07 ? 174 GLN A N 1 ATOM 1172 C CA . GLN A 1 153 ? 56.664 -8.474 21.951 1.00 39.36 ? 174 GLN A CA 1 ATOM 1173 C C . GLN A 1 153 ? 55.872 -9.283 20.917 1.00 41.15 ? 174 GLN A C 1 ATOM 1174 O O . GLN A 1 153 ? 55.120 -8.729 20.121 1.00 53.71 ? 174 GLN A O 1 ATOM 1175 C CB . GLN A 1 153 ? 57.731 -7.600 21.282 1.00 35.25 ? 174 GLN A CB 1 ATOM 1176 C CG . GLN A 1 153 ? 58.348 -6.554 22.218 1.00 32.97 ? 174 GLN A CG 1 ATOM 1177 C CD . GLN A 1 153 ? 57.311 -5.627 22.854 1.00 44.85 ? 174 GLN A CD 1 ATOM 1178 O OE1 . GLN A 1 153 ? 56.340 -5.223 22.214 1.00 45.09 ? 174 GLN A OE1 1 ATOM 1179 N NE2 . GLN A 1 153 ? 57.522 -5.282 24.119 1.00 48.45 ? 174 GLN A NE2 1 ATOM 1180 N N . GLU A 1 154 ? 56.043 -10.599 20.944 1.00 38.78 ? 175 GLU A N 1 ATOM 1181 C CA . GLU A 1 154 ? 55.202 -11.498 20.163 1.00 45.19 ? 175 GLU A CA 1 ATOM 1182 C C . GLU A 1 154 ? 53.837 -11.690 20.830 1.00 53.08 ? 175 GLU A C 1 ATOM 1183 O O . GLU A 1 154 ? 52.804 -11.595 20.170 1.00 54.10 ? 175 GLU A O 1 ATOM 1184 C CB . GLU A 1 154 ? 55.878 -12.864 19.978 1.00 47.06 ? 175 GLU A CB 1 ATOM 1185 C CG . GLU A 1 154 ? 57.338 -12.802 19.559 1.00 67.24 ? 175 GLU A CG 1 ATOM 1186 C CD . GLU A 1 154 ? 57.526 -12.283 18.143 1.00 86.02 ? 175 GLU A CD 1 ATOM 1187 O OE1 . GLU A 1 154 ? 56.901 -12.843 17.213 1.00 87.05 ? 175 GLU A OE1 1 ATOM 1188 O OE2 . GLU A 1 154 ? 58.305 -11.320 17.962 1.00 93.41 ? 175 GLU A OE2 1 ATOM 1189 N N . THR A 1 155 ? 53.830 -11.965 22.136 1.00 42.67 ? 176 THR A N 1 ATOM 1190 C CA . THR A 1 155 ? 52.578 -12.283 22.826 1.00 38.00 ? 176 THR A CA 1 ATOM 1191 C C . THR A 1 155 ? 52.077 -11.222 23.796 1.00 40.36 ? 176 THR A C 1 ATOM 1192 O O . THR A 1 155 ? 50.888 -11.169 24.087 1.00 43.03 ? 176 THR A O 1 ATOM 1193 C CB . THR A 1 155 ? 52.675 -13.612 23.586 1.00 45.80 ? 176 THR A CB 1 ATOM 1194 O OG1 . THR A 1 155 ? 53.712 -13.536 24.582 1.00 45.90 ? 176 THR A OG1 1 ATOM 1195 C CG2 . THR A 1 155 ? 52.968 -14.735 22.617 1.00 37.66 ? 176 THR A CG2 1 ATOM 1196 N N . GLY A 1 156 ? 52.984 -10.396 24.311 1.00 47.15 ? 177 GLY A N 1 ATOM 1197 C CA . GLY A 1 156 ? 52.629 -9.379 25.288 1.00 37.88 ? 177 GLY A CA 1 ATOM 1198 C C . GLY A 1 156 ? 52.675 -9.901 26.717 1.00 38.71 ? 177 GLY A C 1 ATOM 1199 O O . GLY A 1 156 ? 52.487 -9.157 27.672 1.00 38.61 ? 177 GLY A O 1 ATOM 1200 N N . ASN A 1 157 ? 52.916 -11.195 26.864 1.00 28.79 ? 178 ASN A N 1 ATOM 1201 C CA . ASN A 1 157 ? 52.997 -11.794 28.175 1.00 26.45 ? 178 ASN A CA 1 ATOM 1202 C C . ASN A 1 157 ? 54.152 -11.222 29.009 1.00 32.94 ? 178 ASN A C 1 ATOM 1203 O O . ASN A 1 157 ? 55.188 -10.847 28.464 1.00 31.73 ? 178 ASN A O 1 ATOM 1204 C CB . ASN A 1 157 ? 53.144 -13.303 28.029 1.00 27.27 ? 178 ASN A CB 1 ATOM 1205 C CG . ASN A 1 157 ? 51.940 -13.940 27.392 1.00 33.87 ? 178 ASN A CG 1 ATOM 1206 O OD1 . ASN A 1 157 ? 50.877 -13.330 27.302 1.00 36.73 ? 178 ASN A OD1 1 ATOM 1207 N ND2 . ASN A 1 157 ? 52.097 -15.181 26.942 1.00 29.95 ? 178 ASN A ND2 1 ATOM 1208 N N . LEU A 1 158 ? 53.966 -11.144 30.327 1.00 29.49 ? 179 LEU A N 1 ATOM 1209 C CA . LEU A 1 158 ? 55.046 -10.735 31.224 1.00 27.55 ? 179 LEU A CA 1 ATOM 1210 C C . LEU A 1 158 ? 55.533 -11.959 31.973 1.00 32.88 ? 179 LEU A C 1 ATOM 1211 O O . LEU A 1 158 ? 54.748 -12.671 32.591 1.00 29.18 ? 179 LEU A O 1 ATOM 1212 C CB . LEU A 1 158 ? 54.594 -9.659 32.209 1.00 26.77 ? 179 LEU A CB 1 ATOM 1213 C CG . LEU A 1 158 ? 55.531 -9.339 33.386 1.00 27.93 ? 179 LEU A CG 1 ATOM 1214 C CD1 . LEU A 1 158 ? 56.751 -8.573 32.946 1.00 28.13 ? 179 LEU A CD1 1 ATOM 1215 C CD2 . LEU A 1 158 ? 54.823 -8.539 34.434 1.00 28.83 ? 179 LEU A CD2 1 ATOM 1216 N N . TYR A 1 159 ? 56.833 -12.205 31.888 1.00 29.23 ? 180 TYR A N 1 ATOM 1217 C CA . TYR A 1 159 ? 57.460 -13.341 32.542 1.00 23.81 ? 180 TYR A CA 1 ATOM 1218 C C . TYR A 1 159 ? 58.293 -12.863 33.743 1.00 28.49 ? 180 TYR A C 1 ATOM 1219 O O . TYR A 1 159 ? 59.077 -11.913 33.640 1.00 23.38 ? 180 TYR A O 1 ATOM 1220 C CB . TYR A 1 159 ? 58.313 -14.120 31.527 1.00 28.56 ? 180 TYR A CB 1 ATOM 1221 C CG . TYR A 1 159 ? 57.468 -14.681 30.400 1.00 29.88 ? 180 TYR A CG 1 ATOM 1222 C CD1 . TYR A 1 159 ? 57.074 -13.887 29.330 1.00 29.92 ? 180 TYR A CD1 1 ATOM 1223 C CD2 . TYR A 1 159 ? 57.023 -15.985 30.436 1.00 30.97 ? 180 TYR A CD2 1 ATOM 1224 C CE1 . TYR A 1 159 ? 56.269 -14.394 28.321 1.00 31.50 ? 180 TYR A CE1 1 ATOM 1225 C CE2 . TYR A 1 159 ? 56.233 -16.494 29.447 1.00 33.11 ? 180 TYR A CE2 1 ATOM 1226 C CZ . TYR A 1 159 ? 55.852 -15.702 28.390 1.00 32.84 ? 180 TYR A CZ 1 ATOM 1227 O OH . TYR A 1 159 ? 55.058 -16.259 27.413 1.00 34.99 ? 180 TYR A OH 1 ATOM 1228 N N . ILE A 1 160 ? 58.083 -13.504 34.887 1.00 22.86 ? 181 ILE A N 1 ATOM 1229 C CA . ILE A 1 160 ? 58.902 -13.259 36.062 1.00 25.19 ? 181 ILE A CA 1 ATOM 1230 C C . ILE A 1 160 ? 59.646 -14.533 36.386 1.00 29.00 ? 181 ILE A C 1 ATOM 1231 O O . ILE A 1 160 ? 59.046 -15.512 36.837 1.00 28.91 ? 181 ILE A O 1 ATOM 1232 C CB . ILE A 1 160 ? 58.053 -12.860 37.289 1.00 20.13 ? 181 ILE A CB 1 ATOM 1233 C CG1 . ILE A 1 160 ? 57.231 -11.619 36.980 1.00 21.03 ? 181 ILE A CG1 1 ATOM 1234 C CG2 . ILE A 1 160 ? 58.956 -12.566 38.471 1.00 21.51 ? 181 ILE A CG2 1 ATOM 1235 C CD1 . ILE A 1 160 ? 56.190 -11.322 38.018 1.00 29.92 ? 181 ILE A CD1 1 ATOM 1236 N N . ALA A 1 161 ? 60.951 -14.523 36.147 1.00 28.45 ? 182 ALA A N 1 ATOM 1237 C CA . ALA A 1 161 ? 61.769 -15.710 36.376 1.00 24.63 ? 182 ALA A CA 1 ATOM 1238 C C . ALA A 1 161 ? 61.626 -16.208 37.801 1.00 23.67 ? 182 ALA A C 1 ATOM 1239 O O . ALA A 1 161 ? 61.637 -17.411 38.053 1.00 24.96 ? 182 ALA A O 1 ATOM 1240 C CB . ALA A 1 161 ? 63.217 -15.421 36.073 1.00 22.75 ? 182 ALA A CB 1 ATOM 1241 N N . LYS A 1 162 ? 61.474 -15.280 38.735 1.00 30.50 ? 183 LYS A N 1 ATOM 1242 C CA . LYS A 1 162 ? 61.482 -15.646 40.140 1.00 25.75 ? 183 LYS A CA 1 ATOM 1243 C C . LYS A 1 162 ? 60.777 -14.592 40.991 1.00 23.10 ? 183 LYS A C 1 ATOM 1244 O O . LYS A 1 162 ? 61.245 -13.457 41.119 1.00 26.48 ? 183 LYS A O 1 ATOM 1245 C CB . LYS A 1 162 ? 62.932 -15.876 40.606 1.00 23.93 ? 183 LYS A CB 1 ATOM 1246 C CG . LYS A 1 162 ? 63.087 -16.026 42.113 1.00 30.97 ? 183 LYS A CG 1 ATOM 1247 C CD . LYS A 1 162 ? 64.538 -15.897 42.512 1.00 37.44 ? 183 LYS A CD 1 ATOM 1248 C CE . LYS A 1 162 ? 64.726 -16.007 44.011 1.00 38.49 ? 183 LYS A CE 1 ATOM 1249 N NZ . LYS A 1 162 ? 66.122 -16.458 44.302 1.00 52.19 ? 183 LYS A NZ 1 ATOM 1250 N N . VAL A 1 163 ? 59.631 -14.951 41.559 1.00 23.97 ? 184 VAL A N 1 ATOM 1251 C CA . VAL A 1 163 ? 58.872 -13.968 42.312 1.00 30.01 ? 184 VAL A CA 1 ATOM 1252 C C . VAL A 1 163 ? 59.620 -13.648 43.599 1.00 32.85 ? 184 VAL A C 1 ATOM 1253 O O . VAL A 1 163 ? 60.142 -14.546 44.268 1.00 30.71 ? 184 VAL A O 1 ATOM 1254 C CB . VAL A 1 163 ? 57.435 -14.445 42.613 1.00 26.56 ? 184 VAL A CB 1 ATOM 1255 C CG1 . VAL A 1 163 ? 56.665 -13.381 43.415 1.00 20.80 ? 184 VAL A CG1 1 ATOM 1256 C CG2 . VAL A 1 163 ? 56.725 -14.729 41.332 1.00 25.58 ? 184 VAL A CG2 1 ATOM 1257 N N . GLU A 1 164 ? 59.694 -12.359 43.912 1.00 30.65 ? 185 GLU A N 1 ATOM 1258 C CA . GLU A 1 164 ? 60.350 -11.883 45.117 1.00 31.46 ? 185 GLU A CA 1 ATOM 1259 C C . GLU A 1 164 ? 59.387 -11.059 45.977 1.00 35.75 ? 185 GLU A C 1 ATOM 1260 O O . GLU A 1 164 ? 58.306 -10.679 45.519 1.00 32.18 ? 185 GLU A O 1 ATOM 1261 C CB . GLU A 1 164 ? 61.594 -11.076 44.747 1.00 41.86 ? 185 GLU A CB 1 ATOM 1262 C CG . GLU A 1 164 ? 62.467 -11.753 43.702 1.00 51.45 ? 185 GLU A CG 1 ATOM 1263 C CD . GLU A 1 164 ? 63.954 -11.509 43.907 1.00 65.65 ? 185 GLU A CD 1 ATOM 1264 O OE1 . GLU A 1 164 ? 64.346 -10.342 44.124 1.00 81.09 ? 185 GLU A OE1 1 ATOM 1265 O OE2 . GLU A 1 164 ? 64.737 -12.486 43.843 1.00 60.27 ? 185 GLU A OE2 1 ATOM 1266 N N . LYS A 1 165 ? 59.765 -10.769 47.220 1.00 30.05 ? 186 LYS A N 1 ATOM 1267 C CA . LYS A 1 165 ? 58.842 -10.050 48.101 1.00 30.76 ? 186 LYS A CA 1 ATOM 1268 C C . LYS A 1 165 ? 58.480 -8.659 47.587 1.00 35.11 ? 186 LYS A C 1 ATOM 1269 O O . LYS A 1 165 ? 57.463 -8.096 47.972 1.00 45.21 ? 186 LYS A O 1 ATOM 1270 C CB . LYS A 1 165 ? 59.356 -10.002 49.547 1.00 48.59 ? 186 LYS A CB 1 ATOM 1271 C CG . LYS A 1 165 ? 60.861 -9.854 49.685 1.00 61.19 ? 186 LYS A CG 1 ATOM 1272 C CD . LYS A 1 165 ? 61.406 -8.882 48.655 1.00 65.03 ? 186 LYS A CD 1 ATOM 1273 C CE . LYS A 1 165 ? 62.402 -7.920 49.259 1.00 58.62 ? 186 LYS A CE 1 ATOM 1274 N NZ . LYS A 1 165 ? 62.586 -6.742 48.376 1.00 39.90 ? 186 LYS A NZ 1 ATOM 1275 N N . SER A 1 166 ? 59.305 -8.123 46.694 1.00 32.27 ? 187 SER A N 1 ATOM 1276 C CA . SER A 1 166 ? 59.069 -6.813 46.102 1.00 27.74 ? 187 SER A CA 1 ATOM 1277 C C . SER A 1 166 ? 57.998 -6.792 45.005 1.00 28.29 ? 187 SER A C 1 ATOM 1278 O O . SER A 1 166 ? 57.689 -5.727 44.482 1.00 24.77 ? 187 SER A O 1 ATOM 1279 C CB . SER A 1 166 ? 60.377 -6.277 45.507 1.00 27.31 ? 187 SER A CB 1 ATOM 1280 O OG . SER A 1 166 ? 60.970 -7.256 44.660 1.00 32.86 ? 187 SER A OG 1 ATOM 1281 N N . ASP A 1 167 ? 57.429 -7.942 44.652 1.00 23.01 ? 188 ASP A N 1 ATOM 1282 C CA . ASP A 1 167 ? 56.550 -8.002 43.473 1.00 32.17 ? 188 ASP A CA 1 ATOM 1283 C C . ASP A 1 167 ? 55.052 -7.907 43.743 1.00 29.30 ? 188 ASP A C 1 ATOM 1284 O O . ASP A 1 167 ? 54.260 -8.155 42.850 1.00 29.34 ? 188 ASP A O 1 ATOM 1285 C CB . ASP A 1 167 ? 56.824 -9.274 42.638 1.00 28.96 ? 188 ASP A CB 1 ATOM 1286 C CG . ASP A 1 167 ? 58.252 -9.326 42.088 1.00 34.22 ? 188 ASP A CG 1 ATOM 1287 O OD1 . ASP A 1 167 ? 58.848 -8.257 41.824 1.00 38.65 ? 188 ASP A OD1 1 ATOM 1288 O OD2 . ASP A 1 167 ? 58.778 -10.441 41.928 1.00 26.87 ? 188 ASP A OD2 1 ATOM 1289 N N . VAL A 1 168 ? 54.654 -7.557 44.958 1.00 30.76 ? 189 VAL A N 1 ATOM 1290 C CA . VAL A 1 168 ? 53.235 -7.592 45.316 1.00 23.00 ? 189 VAL A CA 1 ATOM 1291 C C . VAL A 1 168 ? 52.509 -6.314 44.926 1.00 33.72 ? 189 VAL A C 1 ATOM 1292 O O . VAL A 1 168 ? 52.930 -5.214 45.296 1.00 37.14 ? 189 VAL A O 1 ATOM 1293 C CB . VAL A 1 168 ? 53.038 -7.849 46.833 1.00 27.30 ? 189 VAL A CB 1 ATOM 1294 C CG1 . VAL A 1 168 ? 51.617 -7.500 47.272 1.00 17.05 ? 189 VAL A CG1 1 ATOM 1295 C CG2 . VAL A 1 168 ? 53.370 -9.285 47.170 1.00 22.04 ? 189 VAL A CG2 1 ATOM 1296 N N . GLY A 1 169 ? 51.410 -6.463 44.188 1.00 33.69 ? 190 GLY A N 1 ATOM 1297 C CA . GLY A 1 169 ? 50.612 -5.322 43.762 1.00 33.39 ? 190 GLY A CA 1 ATOM 1298 C C . GLY A 1 169 ? 49.781 -5.599 42.515 1.00 35.19 ? 190 GLY A C 1 ATOM 1299 O O . GLY A 1 169 ? 49.279 -6.705 42.326 1.00 29.25 ? 190 GLY A O 1 ATOM 1300 N N . ASN A 1 170 ? 49.649 -4.590 41.658 1.00 29.77 ? 191 ASN A N 1 ATOM 1301 C CA . ASN A 1 170 ? 48.800 -4.679 40.475 1.00 38.29 ? 191 ASN A CA 1 ATOM 1302 C C . ASN A 1 170 ? 49.562 -4.512 39.167 1.00 42.40 ? 191 ASN A C 1 ATOM 1303 O O . ASN A 1 170 ? 50.369 -3.590 39.015 1.00 31.56 ? 191 ASN A O 1 ATOM 1304 C CB . ASN A 1 170 ? 47.656 -3.668 40.555 1.00 43.68 ? 191 ASN A CB 1 ATOM 1305 C CG . ASN A 1 170 ? 46.663 -4.014 41.643 1.00 55.15 ? 191 ASN A CG 1 ATOM 1306 O OD1 . ASN A 1 170 ? 45.763 -4.820 41.433 1.00 51.05 ? 191 ASN A OD1 1 ATOM 1307 N ND2 . ASN A 1 170 ? 46.848 -3.424 42.831 1.00 73.97 ? 191 ASN A ND2 1 ATOM 1308 N N . TYR A 1 171 ? 49.295 -5.414 38.226 1.00 40.19 ? 192 TYR A N 1 ATOM 1309 C CA . TYR A 1 171 ? 49.961 -5.407 36.925 1.00 39.09 ? 192 TYR A CA 1 ATOM 1310 C C . TYR A 1 171 ? 48.977 -5.155 35.783 1.00 41.63 ? 192 TYR A C 1 ATOM 1311 O O . TYR A 1 171 ? 47.981 -5.862 35.646 1.00 42.87 ? 192 TYR A O 1 ATOM 1312 C CB . TYR A 1 171 ? 50.644 -6.752 36.696 1.00 31.77 ? 192 TYR A CB 1 ATOM 1313 C CG . TYR A 1 171 ? 51.790 -7.053 37.641 1.00 32.83 ? 192 TYR A CG 1 ATOM 1314 C CD1 . TYR A 1 171 ? 51.557 -7.546 38.919 1.00 31.32 ? 192 TYR A CD1 1 ATOM 1315 C CD2 . TYR A 1 171 ? 53.106 -6.860 37.245 1.00 28.56 ? 192 TYR A CD2 1 ATOM 1316 C CE1 . TYR A 1 171 ? 52.608 -7.827 39.780 1.00 31.44 ? 192 TYR A CE1 1 ATOM 1317 C CE2 . TYR A 1 171 ? 54.157 -7.146 38.083 1.00 33.20 ? 192 TYR A CE2 1 ATOM 1318 C CZ . TYR A 1 171 ? 53.902 -7.624 39.355 1.00 37.15 ? 192 TYR A CZ 1 ATOM 1319 O OH . TYR A 1 171 ? 54.952 -7.899 40.188 1.00 34.30 ? 192 TYR A OH 1 ATOM 1320 N N . THR A 1 172 ? 49.269 -4.165 34.949 1.00 38.09 ? 193 THR A N 1 ATOM 1321 C CA . THR A 1 172 ? 48.398 -3.840 33.820 1.00 43.28 ? 193 THR A CA 1 ATOM 1322 C C . THR A 1 172 ? 49.130 -3.912 32.482 1.00 44.73 ? 193 THR A C 1 ATOM 1323 O O . THR A 1 172 ? 50.143 -3.243 32.287 1.00 37.49 ? 193 THR A O 1 ATOM 1324 C CB . THR A 1 172 ? 47.840 -2.409 33.940 1.00 42.78 ? 193 THR A CB 1 ATOM 1325 O OG1 . THR A 1 172 ? 47.127 -2.270 35.170 1.00 44.18 ? 193 THR A OG1 1 ATOM 1326 C CG2 . THR A 1 172 ? 46.912 -2.099 32.777 1.00 41.05 ? 193 THR A CG2 1 ATOM 1327 N N . CYS A 1 173 ? 48.608 -4.707 31.555 1.00 48.28 ? 194 CYS A N 1 ATOM 1328 C CA . CYS A 1 173 ? 49.127 -4.713 30.190 1.00 46.69 ? 194 CYS A CA 1 ATOM 1329 C C . CYS A 1 173 ? 48.595 -3.525 29.399 1.00 45.39 ? 194 CYS A C 1 ATOM 1330 O O . CYS A 1 173 ? 47.389 -3.286 29.360 1.00 53.21 ? 194 CYS A O 1 ATOM 1331 C CB . CYS A 1 173 ? 48.766 -6.017 29.471 1.00 47.57 ? 194 CYS A CB 1 ATOM 1332 S SG . CYS A 1 173 ? 49.630 -6.266 27.889 1.00 61.42 ? 194 CYS A SG 1 ATOM 1333 N N . VAL A 1 174 ? 49.499 -2.768 28.787 1.00 41.61 ? 195 VAL A N 1 ATOM 1334 C CA . VAL A 1 174 ? 49.097 -1.714 27.858 1.00 49.70 ? 195 VAL A CA 1 ATOM 1335 C C . VAL A 1 174 ? 49.433 -2.105 26.413 1.00 52.11 ? 195 VAL A C 1 ATOM 1336 O O . VAL A 1 174 ? 50.604 -2.176 26.024 1.00 45.07 ? 195 VAL A O 1 ATOM 1337 C CB . VAL A 1 174 ? 49.696 -0.337 28.233 1.00 49.09 ? 195 VAL A CB 1 ATOM 1338 C CG1 . VAL A 1 174 ? 51.069 -0.494 28.825 1.00 57.82 ? 195 VAL A CG1 1 ATOM 1339 C CG2 . VAL A 1 174 ? 49.739 0.566 27.034 1.00 48.88 ? 195 VAL A CG2 1 ATOM 1340 N N . VAL A 1 175 ? 48.394 -2.387 25.631 1.00 55.34 ? 196 VAL A N 1 ATOM 1341 C CA . VAL A 1 175 ? 48.567 -2.825 24.247 1.00 51.21 ? 196 VAL A CA 1 ATOM 1342 C C . VAL A 1 175 ? 48.565 -1.646 23.288 1.00 49.51 ? 196 VAL A C 1 ATOM 1343 O O . VAL A 1 175 ? 47.766 -0.724 23.428 1.00 61.55 ? 196 VAL A O 1 ATOM 1344 C CB . VAL A 1 175 ? 47.458 -3.795 23.822 1.00 47.46 ? 196 VAL A CB 1 ATOM 1345 C CG1 . VAL A 1 175 ? 47.813 -4.436 22.499 1.00 43.40 ? 196 VAL A CG1 1 ATOM 1346 C CG2 . VAL A 1 175 ? 47.254 -4.856 24.885 1.00 49.32 ? 196 VAL A CG2 1 ATOM 1347 N N . THR A 1 176 ? 49.461 -1.677 22.311 1.00 51.71 ? 197 THR A N 1 ATOM 1348 C CA . THR A 1 176 ? 49.535 -0.607 21.320 1.00 53.06 ? 197 THR A CA 1 ATOM 1349 C C . THR A 1 176 ? 49.520 -1.146 19.893 1.00 53.99 ? 197 THR A C 1 ATOM 1350 O O . THR A 1 176 ? 50.284 -2.051 19.545 1.00 48.86 ? 197 THR A O 1 ATOM 1351 C CB . THR A 1 176 ? 50.792 0.269 21.516 1.00 50.79 ? 197 THR A CB 1 ATOM 1352 O OG1 . THR A 1 176 ? 50.650 1.049 22.706 1.00 46.86 ? 197 THR A OG1 1 ATOM 1353 C CG2 . THR A 1 176 ? 51.005 1.207 20.316 1.00 39.98 ? 197 THR A CG2 1 ATOM 1354 N N . ASN A 1 177 ? 48.633 -0.591 19.072 1.00 53.88 ? 198 ASN A N 1 ATOM 1355 C CA . ASN A 1 177 ? 48.649 -0.871 17.651 1.00 53.46 ? 198 ASN A CA 1 ATOM 1356 C C . ASN A 1 177 ? 49.680 0.045 16.986 1.00 63.57 ? 198 ASN A C 1 ATOM 1357 O O . ASN A 1 177 ? 49.524 1.263 16.985 1.00 63.06 ? 198 ASN A O 1 ATOM 1358 C CB . ASN A 1 177 ? 47.261 -0.665 17.055 1.00 64.80 ? 198 ASN A CB 1 ATOM 1359 C CG . ASN A 1 177 ? 47.137 -1.239 15.660 1.00 68.97 ? 198 ASN A CG 1 ATOM 1360 O OD1 . ASN A 1 177 ? 47.736 -0.730 14.711 1.00 61.70 ? 198 ASN A OD1 1 ATOM 1361 N ND2 . ASN A 1 177 ? 46.360 -2.310 15.528 1.00 70.38 ? 198 ASN A ND2 1 ATOM 1362 N N . THR A 1 178 ? 50.742 -0.544 16.443 1.00 65.21 ? 199 THR A N 1 ATOM 1363 C CA . THR A 1 178 ? 51.884 0.233 15.965 1.00 70.63 ? 199 THR A CA 1 ATOM 1364 C C . THR A 1 178 ? 51.578 1.037 14.707 1.00 74.45 ? 199 THR A C 1 ATOM 1365 O O . THR A 1 178 ? 52.232 2.044 14.436 1.00 70.39 ? 199 THR A O 1 ATOM 1366 C CB . THR A 1 178 ? 53.117 -0.659 15.712 1.00 70.90 ? 199 THR A CB 1 ATOM 1367 O OG1 . THR A 1 178 ? 52.766 -1.731 14.829 1.00 71.43 ? 199 THR A OG1 1 ATOM 1368 C CG2 . THR A 1 178 ? 53.629 -1.240 17.022 1.00 64.89 ? 199 THR A CG2 1 ATOM 1369 N N . VAL A 1 179 ? 50.581 0.593 13.946 1.00 80.72 ? 200 VAL A N 1 ATOM 1370 C CA . VAL A 1 179 ? 50.209 1.260 12.698 1.00 77.35 ? 200 VAL A CA 1 ATOM 1371 C C . VAL A 1 179 ? 49.181 2.381 12.886 1.00 76.27 ? 200 VAL A C 1 ATOM 1372 O O . VAL A 1 179 ? 49.265 3.412 12.221 1.00 79.90 ? 200 VAL A O 1 ATOM 1373 C CB . VAL A 1 179 ? 49.754 0.248 11.609 1.00 93.45 ? 200 VAL A CB 1 ATOM 1374 C CG1 . VAL A 1 179 ? 49.245 -1.040 12.237 1.00 92.70 ? 200 VAL A CG1 1 ATOM 1375 C CG2 . VAL A 1 179 ? 48.712 0.865 10.690 1.00 96.35 ? 200 VAL A CG2 1 ATOM 1376 N N . THR A 1 180 ? 48.227 2.195 13.798 1.00 79.04 ? 201 THR A N 1 ATOM 1377 C CA . THR A 1 180 ? 47.258 3.251 14.107 1.00 85.77 ? 201 THR A CA 1 ATOM 1378 C C . THR A 1 180 ? 47.686 4.081 15.319 1.00 87.89 ? 201 THR A C 1 ATOM 1379 O O . THR A 1 180 ? 47.197 5.190 15.528 1.00 91.62 ? 201 THR A O 1 ATOM 1380 C CB . THR A 1 180 ? 45.839 2.691 14.363 1.00 85.42 ? 201 THR A CB 1 ATOM 1381 O OG1 . THR A 1 180 ? 45.717 2.272 15.729 1.00 79.46 ? 201 THR A OG1 1 ATOM 1382 C CG2 . THR A 1 180 ? 45.544 1.523 13.433 1.00 84.71 ? 201 THR A CG2 1 ATOM 1383 N N . ASN A 1 181 ? 48.593 3.526 16.114 1.00 87.30 ? 202 ASN A N 1 ATOM 1384 C CA . ASN A 1 181 ? 49.118 4.190 17.309 1.00 89.46 ? 202 ASN A CA 1 ATOM 1385 C C . ASN A 1 181 ? 48.112 4.349 18.467 1.00 84.37 ? 202 ASN A C 1 ATOM 1386 O O . ASN A 1 181 ? 48.367 5.077 19.430 1.00 76.84 ? 202 ASN A O 1 ATOM 1387 C CB . ASN A 1 181 ? 49.762 5.533 16.947 1.00 89.75 ? 202 ASN A CB 1 ATOM 1388 C CG . ASN A 1 181 ? 50.807 5.962 17.957 1.00 89.91 ? 202 ASN A CG 1 ATOM 1389 O OD1 . ASN A 1 181 ? 51.167 5.198 18.856 1.00 79.83 ? 202 ASN A OD1 1 ATOM 1390 N ND2 . ASN A 1 181 ? 51.301 7.186 17.817 1.00 92.76 ? 202 ASN A ND2 1 ATOM 1391 N N . HIS A 1 182 ? 46.977 3.660 18.370 1.00 81.80 ? 203 HIS A N 1 ATOM 1392 C CA . HIS A 1 182 ? 45.992 3.645 19.448 1.00 74.69 ? 203 HIS A CA 1 ATOM 1393 C C . HIS A 1 182 ? 46.415 2.636 20.511 1.00 78.50 ? 203 HIS A C 1 ATOM 1394 O O . HIS A 1 182 ? 46.984 1.589 20.194 1.00 79.00 ? 203 HIS A O 1 ATOM 1395 C CB . HIS A 1 182 ? 44.596 3.293 18.914 1.00 68.08 ? 203 HIS A CB 1 ATOM 1396 C CG . HIS A 1 182 ? 44.009 4.335 18.008 1.00 81.51 ? 203 HIS A CG 1 ATOM 1397 N ND1 . HIS A 1 182 ? 42.700 4.757 18.108 1.00 90.22 ? 203 HIS A ND1 1 ATOM 1398 C CD2 . HIS A 1 182 ? 44.554 5.042 16.991 1.00 81.54 ? 203 HIS A CD2 1 ATOM 1399 C CE1 . HIS A 1 182 ? 42.463 5.679 17.189 1.00 90.79 ? 203 HIS A CE1 1 ATOM 1400 N NE2 . HIS A 1 182 ? 43.575 5.872 16.501 1.00 84.84 ? 203 HIS A NE2 1 ATOM 1401 N N . LYS A 1 183 ? 46.144 2.948 21.773 1.00 76.00 ? 204 LYS A N 1 ATOM 1402 C CA . LYS A 1 183 ? 46.473 2.028 22.854 1.00 70.45 ? 204 LYS A CA 1 ATOM 1403 C C . LYS A 1 183 ? 45.223 1.694 23.656 1.00 62.17 ? 204 LYS A C 1 ATOM 1404 O O . LYS A 1 183 ? 44.314 2.516 23.772 1.00 63.09 ? 204 LYS A O 1 ATOM 1405 C CB . LYS A 1 183 ? 47.549 2.626 23.766 1.00 69.43 ? 204 LYS A CB 1 ATOM 1406 C CG . LYS A 1 183 ? 47.007 3.269 25.033 1.00 71.88 ? 204 LYS A CG 1 ATOM 1407 C CD . LYS A 1 183 ? 47.843 4.463 25.491 1.00 78.72 ? 204 LYS A CD 1 ATOM 1408 C CE . LYS A 1 183 ? 49.334 4.146 25.547 1.00 83.01 ? 204 LYS A CE 1 ATOM 1409 N NZ . LYS A 1 183 ? 49.992 4.174 24.204 1.00 84.31 ? 204 LYS A NZ 1 ATOM 1410 N N . VAL A 1 184 ? 45.168 0.478 24.190 1.00 45.80 ? 205 VAL A N 1 ATOM 1411 C CA . VAL A 1 184 ? 44.100 0.103 25.114 1.00 49.78 ? 205 VAL A CA 1 ATOM 1412 C C . VAL A 1 184 ? 44.719 -0.574 26.335 1.00 54.25 ? 205 VAL A C 1 ATOM 1413 O O . VAL A 1 184 ? 45.724 -1.281 26.209 1.00 53.79 ? 205 VAL A O 1 ATOM 1414 C CB . VAL A 1 184 ? 43.062 -0.831 24.446 1.00 55.87 ? 205 VAL A CB 1 ATOM 1415 C CG1 . VAL A 1 184 ? 42.330 -0.101 23.312 1.00 60.39 ? 205 VAL A CG1 1 ATOM 1416 C CG2 . VAL A 1 184 ? 43.734 -2.092 23.919 1.00 53.18 ? 205 VAL A CG2 1 ATOM 1417 N N . LEU A 1 185 ? 44.129 -0.350 27.509 1.00 60.29 ? 206 LEU A N 1 ATOM 1418 C CA . LEU A 1 185 ? 44.637 -0.923 28.762 1.00 59.85 ? 206 LEU A CA 1 ATOM 1419 C C . LEU A 1 185 ? 43.862 -2.151 29.210 1.00 54.17 ? 206 LEU A C 1 ATOM 1420 O O . LEU A 1 185 ? 42.632 -2.167 29.191 1.00 63.42 ? 206 LEU A O 1 ATOM 1421 C CB . LEU A 1 185 ? 44.614 0.113 29.886 1.00 67.33 ? 206 LEU A CB 1 ATOM 1422 C CG . LEU A 1 185 ? 45.645 1.238 29.850 1.00 74.96 ? 206 LEU A CG 1 ATOM 1423 C CD1 . LEU A 1 185 ? 45.420 2.163 31.027 1.00 83.15 ? 206 LEU A CD1 1 ATOM 1424 C CD2 . LEU A 1 185 ? 47.034 0.662 29.901 1.00 74.07 ? 206 LEU A CD2 1 ATOM 1425 N N . GLY A 1 186 ? 44.589 -3.182 29.618 1.00 48.52 ? 207 GLY A N 1 ATOM 1426 C CA . GLY A 1 186 ? 43.963 -4.363 30.179 1.00 45.83 ? 207 GLY A CA 1 ATOM 1427 C C . GLY A 1 186 ? 43.524 -4.122 31.615 1.00 50.02 ? 207 GLY A C 1 ATOM 1428 O O . GLY A 1 186 ? 43.842 -3.087 32.212 1.00 47.98 ? 207 GLY A O 1 ATOM 1429 N N . PRO A 1 187 ? 42.788 -5.082 32.181 1.00 46.35 ? 208 PRO A N 1 ATOM 1430 C CA . PRO A 1 187 ? 42.401 -5.043 33.589 1.00 51.36 ? 208 PRO A CA 1 ATOM 1431 C C . PRO A 1 187 ? 43.624 -5.274 34.476 1.00 50.23 ? 208 PRO A C 1 ATOM 1432 O O . PRO A 1 187 ? 44.470 -6.110 34.151 1.00 39.73 ? 208 PRO A O 1 ATOM 1433 C CB . PRO A 1 187 ? 41.457 -6.244 33.728 1.00 53.37 ? 208 PRO A CB 1 ATOM 1434 C CG . PRO A 1 187 ? 41.234 -6.767 32.344 1.00 59.61 ? 208 PRO A CG 1 ATOM 1435 C CD . PRO A 1 187 ? 42.414 -6.351 31.545 1.00 55.10 ? 208 PRO A CD 1 ATOM 1436 N N . PRO A 1 188 ? 43.719 -4.539 35.589 1.00 53.89 ? 209 PRO A N 1 ATOM 1437 C CA . PRO A 1 188 ? 44.779 -4.827 36.552 1.00 49.36 ? 209 PRO A CA 1 ATOM 1438 C C . PRO A 1 188 ? 44.626 -6.248 37.069 1.00 46.79 ? 209 PRO A C 1 ATOM 1439 O O . PRO A 1 188 ? 43.522 -6.676 37.410 1.00 49.68 ? 209 PRO A O 1 ATOM 1440 C CB . PRO A 1 188 ? 44.500 -3.841 37.688 1.00 52.60 ? 209 PRO A CB 1 ATOM 1441 C CG . PRO A 1 188 ? 43.681 -2.766 37.080 1.00 61.24 ? 209 PRO A CG 1 ATOM 1442 C CD . PRO A 1 188 ? 42.867 -3.417 36.014 1.00 61.18 ? 209 PRO A CD 1 ATOM 1443 N N . THR A 1 189 ? 45.721 -6.989 37.101 1.00 35.94 ? 210 THR A N 1 ATOM 1444 C CA . THR A 1 189 ? 45.705 -8.272 37.765 1.00 41.16 ? 210 THR A CA 1 ATOM 1445 C C . THR A 1 189 ? 46.536 -8.155 39.031 1.00 41.50 ? 210 THR A C 1 ATOM 1446 O O . THR A 1 189 ? 47.713 -7.807 38.967 1.00 41.26 ? 210 THR A O 1 ATOM 1447 C CB . THR A 1 189 ? 46.195 -9.423 36.850 1.00 47.97 ? 210 THR A CB 1 ATOM 1448 O OG1 . THR A 1 189 ? 46.751 -10.473 37.652 1.00 52.33 ? 210 THR A OG1 1 ATOM 1449 C CG2 . THR A 1 189 ? 47.232 -8.927 35.878 1.00 60.12 ? 210 THR A CG2 1 ATOM 1450 N N . PRO A 1 190 ? 45.900 -8.391 40.189 1.00 38.52 ? 211 PRO A N 1 ATOM 1451 C CA . PRO A 1 190 ? 46.536 -8.373 41.513 1.00 35.92 ? 211 PRO A CA 1 ATOM 1452 C C . PRO A 1 190 ? 47.403 -9.601 41.758 1.00 31.95 ? 211 PRO A C 1 ATOM 1453 O O . PRO A 1 190 ? 46.954 -10.737 41.584 1.00 37.33 ? 211 PRO A O 1 ATOM 1454 C CB . PRO A 1 190 ? 45.342 -8.382 42.482 1.00 35.24 ? 211 PRO A CB 1 ATOM 1455 C CG . PRO A 1 190 ? 44.143 -8.011 41.644 1.00 45.15 ? 211 PRO A CG 1 ATOM 1456 C CD . PRO A 1 190 ? 44.443 -8.569 40.290 1.00 37.30 ? 211 PRO A CD 1 ATOM 1457 N N . LEU A 1 191 ? 48.645 -9.368 42.157 1.00 24.57 ? 212 LEU A N 1 ATOM 1458 C CA . LEU A 1 191 ? 49.538 -10.447 42.571 1.00 27.01 ? 212 LEU A CA 1 ATOM 1459 C C . LEU A 1 191 ? 49.797 -10.381 44.093 1.00 32.60 ? 212 LEU A C 1 ATOM 1460 O O . LEU A 1 191 ? 50.210 -9.345 44.603 1.00 33.07 ? 212 LEU A O 1 ATOM 1461 C CB . LEU A 1 191 ? 50.862 -10.309 41.822 1.00 28.67 ? 212 LEU A CB 1 ATOM 1462 C CG . LEU A 1 191 ? 51.897 -11.407 42.041 1.00 30.65 ? 212 LEU A CG 1 ATOM 1463 C CD1 . LEU A 1 191 ? 51.249 -12.692 41.658 1.00 32.25 ? 212 LEU A CD1 1 ATOM 1464 C CD2 . LEU A 1 191 ? 53.101 -11.156 41.174 1.00 42.51 ? 212 LEU A CD2 1 ATOM 1465 N N . ILE A 1 192 ? 49.539 -11.470 44.809 1.00 33.67 ? 213 ILE A N 1 ATOM 1466 C CA . ILE A 1 192 ? 49.934 -11.581 46.219 1.00 37.41 ? 213 ILE A CA 1 ATOM 1467 C C . ILE A 1 192 ? 50.767 -12.834 46.504 1.00 36.23 ? 213 ILE A C 1 ATOM 1468 O O . ILE A 1 192 ? 50.684 -13.840 45.789 1.00 32.91 ? 213 ILE A O 1 ATOM 1469 C CB . ILE A 1 192 ? 48.735 -11.603 47.186 1.00 39.26 ? 213 ILE A CB 1 ATOM 1470 C CG1 . ILE A 1 192 ? 47.786 -12.737 46.824 1.00 40.92 ? 213 ILE A CG1 1 ATOM 1471 C CG2 . ILE A 1 192 ? 48.017 -10.269 47.212 1.00 35.87 ? 213 ILE A CG2 1 ATOM 1472 C CD1 . ILE A 1 192 ? 46.835 -13.071 47.938 1.00 43.92 ? 213 ILE A CD1 1 ATOM 1473 N N . LEU A 1 193 ? 51.556 -12.765 47.572 1.00 26.88 ? 214 LEU A N 1 ATOM 1474 C CA . LEU A 1 193 ? 52.410 -13.872 47.992 1.00 23.25 ? 214 LEU A CA 1 ATOM 1475 C C . LEU A 1 193 ? 51.680 -14.861 48.892 1.00 25.45 ? 214 LEU A C 1 ATOM 1476 O O . LEU A 1 193 ? 50.951 -14.470 49.793 1.00 31.89 ? 214 LEU A O 1 ATOM 1477 C CB . LEU A 1 193 ? 53.636 -13.327 48.728 1.00 29.78 ? 214 LEU A CB 1 ATOM 1478 C CG . LEU A 1 193 ? 54.481 -12.390 47.863 1.00 36.88 ? 214 LEU A CG 1 ATOM 1479 C CD1 . LEU A 1 193 ? 55.679 -11.859 48.632 1.00 39.86 ? 214 LEU A CD1 1 ATOM 1480 C CD2 . LEU A 1 193 ? 54.926 -13.118 46.609 1.00 23.30 ? 214 LEU A CD2 1 ATOM 1481 N N . ARG A 1 194 ? 51.876 -16.149 48.640 1.00 26.90 ? 215 ARG A N 1 ATOM 1482 C CA . ARG A 1 194 ? 51.459 -17.172 49.588 1.00 34.88 ? 215 ARG A CA 1 ATOM 1483 C C . ARG A 1 194 ? 52.163 -16.947 50.937 1.00 42.78 ? 215 ARG A C 1 ATOM 1484 O O . ARG A 1 194 ? 53.316 -16.520 50.988 1.00 38.98 ? 215 ARG A O 1 ATOM 1485 C CB . ARG A 1 194 ? 51.824 -18.558 49.044 1.00 34.21 ? 215 ARG A CB 1 ATOM 1486 C CG . ARG A 1 194 ? 51.094 -18.944 47.764 1.00 45.21 ? 215 ARG A CG 1 ATOM 1487 C CD . ARG A 1 194 ? 49.717 -19.509 48.047 1.00 50.49 ? 215 ARG A CD 1 ATOM 1488 N NE . ARG A 1 194 ? 49.799 -20.757 48.799 1.00 49.16 ? 215 ARG A NE 1 ATOM 1489 C CZ . ARG A 1 194 ? 49.956 -21.958 48.251 1.00 54.67 ? 215 ARG A CZ 1 ATOM 1490 N NH1 . ARG A 1 194 ? 50.043 -22.090 46.933 1.00 53.10 ? 215 ARG A NH1 1 ATOM 1491 N NH2 . ARG A 1 194 ? 50.022 -23.035 49.024 1.00 59.46 ? 215 ARG A NH2 1 ATOM 1492 N N . ASN A 1 195 ? 51.484 -17.232 52.037 1.00 50.87 ? 216 ASN A N 1 ATOM 1493 C CA . ASN A 1 195 ? 52.189 -17.270 53.316 1.00 58.72 ? 216 ASN A CA 1 ATOM 1494 C C . ASN A 1 195 ? 52.324 -18.699 53.831 1.00 59.48 ? 216 ASN A C 1 ATOM 1495 O O . ASN A 1 195 ? 52.508 -18.927 55.018 1.00 64.08 ? 216 ASN A O 1 ATOM 1496 C CB . ASN A 1 195 ? 51.543 -16.341 54.348 1.00 63.18 ? 216 ASN A CB 1 ATOM 1497 C CG . ASN A 1 195 ? 50.046 -16.514 54.430 1.00 68.01 ? 216 ASN A CG 1 ATOM 1498 O OD1 . ASN A 1 195 ? 49.542 -17.635 54.534 1.00 62.70 ? 216 ASN A OD1 1 ATOM 1499 N ND2 . ASN A 1 195 ? 49.320 -15.400 54.386 1.00 71.30 ? 216 ASN A ND2 1 ATOM 1500 N N . ASP A 1 196 ? 52.259 -19.650 52.902 1.00 66.37 ? 217 ASP A N 1 ATOM 1501 C CA . ASP A 1 196 ? 52.274 -21.079 53.201 1.00 65.87 ? 217 ASP A CA 1 ATOM 1502 C C . ASP A 1 196 ? 53.657 -21.687 53.077 1.00 56.32 ? 217 ASP A C 1 ATOM 1503 O O . ASP A 1 196 ? 53.818 -22.895 53.222 1.00 57.92 ? 217 ASP A O 1 ATOM 1504 C CB . ASP A 1 196 ? 51.383 -21.820 52.200 1.00 74.60 ? 217 ASP A CB 1 ATOM 1505 C CG . ASP A 1 196 ? 49.920 -21.671 52.501 1.00 82.99 ? 217 ASP A CG 1 ATOM 1506 O OD1 . ASP A 1 196 ? 49.595 -21.154 53.588 1.00 92.07 ? 217 ASP A OD1 1 ATOM 1507 O OD2 . ASP A 1 196 ? 49.097 -22.075 51.653 1.00 83.43 ? 217 ASP A OD2 1 ATOM 1508 N N . GLY A 1 197 ? 54.652 -20.870 52.767 1.00 51.44 ? 218 GLY A N 1 ATOM 1509 C CA . GLY A 1 197 ? 55.956 -21.403 52.414 1.00 47.12 ? 218 GLY A CA 1 ATOM 1510 C C . GLY A 1 197 ? 56.481 -20.807 51.120 1.00 44.32 ? 218 GLY A C 1 ATOM 1511 O O . GLY A 1 197 ? 55.828 -19.974 50.488 1.00 46.97 ? 218 GLY A O 1 ATOM 1512 N N . VAL A 1 198 ? 57.673 -21.233 50.725 1.00 31.20 ? 219 VAL A N 1 ATOM 1513 C CA . VAL A 1 198 ? 58.327 -20.676 49.560 1.00 36.54 ? 219 VAL A CA 1 ATOM 1514 C C . VAL A 1 198 ? 58.714 -21.772 48.565 1.00 39.38 ? 219 VAL A C 1 ATOM 1515 O O . VAL A 1 198 ? 58.693 -22.959 48.897 1.00 30.51 ? 219 VAL A O 1 ATOM 1516 C CB . VAL A 1 198 ? 59.553 -19.869 49.988 1.00 36.35 ? 219 VAL A CB 1 ATOM 1517 C CG1 . VAL A 1 198 ? 59.148 -18.907 51.082 1.00 34.31 ? 219 VAL A CG1 1 ATOM 1518 C CG2 . VAL A 1 198 ? 60.647 -20.792 50.494 1.00 30.65 ? 219 VAL A CG2 1 ATOM 1519 N N . MET A 1 199 ? 59.042 -21.377 47.338 1.00 28.10 ? 220 MET A N 1 ATOM 1520 C CA . MET A 1 199 ? 59.558 -22.334 46.362 1.00 25.80 ? 220 MET A CA 1 ATOM 1521 C C . MET A 1 199 ? 61.086 -22.398 46.409 1.00 26.24 ? 220 MET A C 1 ATOM 1522 O O . MET A 1 199 ? 61.773 -21.388 46.293 1.00 32.32 ? 220 MET A O 1 ATOM 1523 C CB . MET A 1 199 ? 59.091 -21.985 44.945 1.00 27.77 ? 220 MET A CB 1 ATOM 1524 C CG . MET A 1 199 ? 59.813 -22.758 43.854 1.00 33.25 ? 220 MET A CG 1 ATOM 1525 S SD . MET A 1 199 ? 59.247 -24.466 43.702 1.00 37.12 ? 220 MET A SD 1 ATOM 1526 C CE . MET A 1 199 ? 57.587 -24.292 44.315 1.00 141.16 ? 220 MET A CE 1 ATOM 1527 N N . GLY A 1 200 ? 61.619 -23.592 46.589 1.00 22.99 ? 221 GLY A N 1 ATOM 1528 C CA . GLY A 1 200 ? 63.053 -23.756 46.574 1.00 24.70 ? 221 GLY A CA 1 ATOM 1529 C C . GLY A 1 200 ? 63.611 -23.588 45.170 1.00 34.50 ? 221 GLY A C 1 ATOM 1530 O O . GLY A 1 200 ? 62.947 -23.081 44.260 1.00 22.45 ? 221 GLY A O 1 ATOM 1531 N N . GLU A 1 201 ? 64.844 -24.044 45.014 1.00 28.83 ? 222 GLU A N 1 ATOM 1532 C CA . GLU A 1 201 ? 65.609 -23.874 43.809 1.00 31.29 ? 222 GLU A CA 1 ATOM 1533 C C . GLU A 1 201 ? 65.298 -24.969 42.787 1.00 34.98 ? 222 GLU A C 1 ATOM 1534 O O . GLU A 1 201 ? 64.968 -26.101 43.153 1.00 35.05 ? 222 GLU A O 1 ATOM 1535 C CB . GLU A 1 201 ? 67.094 -23.890 44.174 1.00 30.32 ? 222 GLU A CB 1 ATOM 1536 C CG . GLU A 1 201 ? 67.572 -22.619 44.832 1.00 34.32 ? 222 GLU A CG 1 ATOM 1537 C CD . GLU A 1 201 ? 69.052 -22.660 45.126 1.00 46.97 ? 222 GLU A CD 1 ATOM 1538 O OE1 . GLU A 1 201 ? 69.641 -23.753 44.988 1.00 42.63 ? 222 GLU A OE1 1 ATOM 1539 O OE2 . GLU A 1 201 ? 69.625 -21.609 45.493 1.00 54.95 ? 222 GLU A OE2 1 ATOM 1540 N N . TYR A 1 202 ? 65.403 -24.622 41.508 1.00 29.23 ? 223 TYR A N 1 ATOM 1541 C CA . TYR A 1 202 ? 65.180 -25.579 40.423 1.00 29.08 ? 223 TYR A CA 1 ATOM 1542 C C . TYR A 1 202 ? 65.822 -25.097 39.121 1.00 28.63 ? 223 TYR A C 1 ATOM 1543 O O . TYR A 1 202 ? 65.974 -23.892 38.899 1.00 27.46 ? 223 TYR A O 1 ATOM 1544 C CB . TYR A 1 202 ? 63.681 -25.841 40.234 1.00 25.07 ? 223 TYR A CB 1 ATOM 1545 C CG . TYR A 1 202 ? 62.899 -24.625 39.794 1.00 29.60 ? 223 TYR A CG 1 ATOM 1546 C CD1 . TYR A 1 202 ? 62.522 -24.460 38.456 1.00 31.14 ? 223 TYR A CD1 1 ATOM 1547 C CD2 . TYR A 1 202 ? 62.530 -23.639 40.710 1.00 19.54 ? 223 TYR A CD2 1 ATOM 1548 C CE1 . TYR A 1 202 ? 61.796 -23.336 38.037 1.00 26.17 ? 223 TYR A CE1 1 ATOM 1549 C CE2 . TYR A 1 202 ? 61.807 -22.518 40.301 1.00 25.72 ? 223 TYR A CE2 1 ATOM 1550 C CZ . TYR A 1 202 ? 61.456 -22.372 38.958 1.00 26.92 ? 223 TYR A CZ 1 ATOM 1551 O OH . TYR A 1 202 ? 60.753 -21.270 38.549 1.00 29.91 ? 223 TYR A OH 1 ATOM 1552 N N . GLU A 1 203 ? 66.217 -26.047 38.275 1.00 33.32 ? 224 GLU A N 1 ATOM 1553 C CA . GLU A 1 203 ? 66.884 -25.747 37.008 1.00 34.72 ? 224 GLU A CA 1 ATOM 1554 C C . GLU A 1 203 ? 66.016 -24.916 36.045 1.00 33.40 ? 224 GLU A C 1 ATOM 1555 O O . GLU A 1 203 ? 64.784 -24.931 36.134 1.00 26.70 ? 224 GLU A O 1 ATOM 1556 C CB . GLU A 1 203 ? 67.358 -27.039 36.330 1.00 35.97 ? 224 GLU A CB 1 ATOM 1557 C CG . GLU A 1 203 ? 66.264 -27.841 35.643 1.00 44.48 ? 224 GLU A CG 1 ATOM 1558 C CD . GLU A 1 203 ? 66.797 -29.108 34.973 1.00 59.61 ? 224 GLU A CD 1 ATOM 1559 O OE1 . GLU A 1 203 ? 66.061 -29.726 34.165 1.00 57.83 ? 224 GLU A OE1 1 ATOM 1560 O OE2 . GLU A 1 203 ? 67.956 -29.484 35.255 1.00 66.36 ? 224 GLU A OE2 1 ATOM 1561 N N . PRO A 1 204 ? 66.660 -24.190 35.116 1.00 26.69 ? 225 PRO A N 1 ATOM 1562 C CA . PRO A 1 204 ? 65.889 -23.300 34.241 1.00 29.15 ? 225 PRO A CA 1 ATOM 1563 C C . PRO A 1 204 ? 64.886 -24.057 33.375 1.00 27.08 ? 225 PRO A C 1 ATOM 1564 O O . PRO A 1 204 ? 65.114 -25.201 32.978 1.00 24.61 ? 225 PRO A O 1 ATOM 1565 C CB . PRO A 1 204 ? 66.965 -22.618 33.390 1.00 27.89 ? 225 PRO A CB 1 ATOM 1566 C CG . PRO A 1 204 ? 68.265 -22.823 34.175 1.00 26.04 ? 225 PRO A CG 1 ATOM 1567 C CD . PRO A 1 204 ? 68.096 -24.170 34.790 1.00 26.35 ? 225 PRO A CD 1 ATOM 1568 N N . LYS A 1 205 ? 63.749 -23.412 33.140 1.00 27.68 ? 226 LYS A N 1 ATOM 1569 C CA . LYS A 1 205 ? 62.706 -23.933 32.280 1.00 30.25 ? 226 LYS A CA 1 ATOM 1570 C C . LYS A 1 205 ? 62.363 -22.844 31.286 1.00 37.28 ? 226 LYS A C 1 ATOM 1571 O O . LYS A 1 205 ? 61.785 -21.818 31.657 1.00 33.10 ? 226 LYS A O 1 ATOM 1572 C CB . LYS A 1 205 ? 61.465 -24.254 33.088 1.00 36.22 ? 226 LYS A CB 1 ATOM 1573 C CG . LYS A 1 205 ? 60.257 -24.511 32.232 1.00 43.18 ? 226 LYS A CG 1 ATOM 1574 C CD . LYS A 1 205 ? 60.404 -25.823 31.481 1.00 50.06 ? 226 LYS A CD 1 ATOM 1575 C CE . LYS A 1 205 ? 59.260 -26.018 30.495 1.00 58.25 ? 226 LYS A CE 1 ATOM 1576 N NZ . LYS A 1 205 ? 59.109 -27.450 30.121 1.00 63.17 ? 226 LYS A NZ 1 ATOM 1577 N N . ILE A 1 206 ? 62.736 -23.057 30.027 1.00 35.99 ? 227 ILE A N 1 ATOM 1578 C CA . ILE A 1 206 ? 62.480 -22.074 28.977 1.00 31.44 ? 227 ILE A CA 1 ATOM 1579 C C . ILE A 1 206 ? 60.988 -22.005 28.694 1.00 24.79 ? 227 ILE A C 1 ATOM 1580 O O . ILE A 1 206 ? 60.359 -23.016 28.392 1.00 33.34 ? 227 ILE A O 1 ATOM 1581 C CB . ILE A 1 206 ? 63.260 -22.408 27.693 1.00 31.11 ? 227 ILE A CB 1 ATOM 1582 C CG1 . ILE A 1 206 ? 64.761 -22.222 27.921 1.00 33.10 ? 227 ILE A CG1 1 ATOM 1583 C CG2 . ILE A 1 206 ? 62.808 -21.533 26.540 1.00 23.93 ? 227 ILE A CG2 1 ATOM 1584 C CD1 . ILE A 1 206 ? 65.614 -22.869 26.853 1.00 37.29 ? 227 ILE A CD1 1 ATOM 1585 N N . GLU A 1 207 ? 60.427 -20.806 28.798 1.00 23.29 ? 228 GLU A N 1 ATOM 1586 C CA . GLU A 1 207 ? 58.985 -20.619 28.678 1.00 36.48 ? 228 GLU A CA 1 ATOM 1587 C C . GLU A 1 207 ? 58.605 -19.813 27.447 1.00 35.55 ? 228 GLU A C 1 ATOM 1588 O O . GLU A 1 207 ? 57.500 -19.948 26.935 1.00 31.56 ? 228 GLU A O 1 ATOM 1589 C CB . GLU A 1 207 ? 58.410 -19.947 29.936 1.00 34.18 ? 228 GLU A CB 1 ATOM 1590 C CG . GLU A 1 207 ? 57.814 -20.935 30.910 1.00 47.12 ? 228 GLU A CG 1 ATOM 1591 C CD . GLU A 1 207 ? 56.824 -21.878 30.251 1.00 55.40 ? 228 GLU A CD 1 ATOM 1592 O OE1 . GLU A 1 207 ? 55.964 -21.398 29.476 1.00 66.92 ? 228 GLU A OE1 1 ATOM 1593 O OE2 . GLU A 1 207 ? 56.909 -23.100 30.506 1.00 51.82 ? 228 GLU A OE2 1 ATOM 1594 N N . VAL A 1 208 ? 59.513 -18.951 27.008 1.00 30.46 ? 229 VAL A N 1 ATOM 1595 C CA . VAL A 1 208 ? 59.337 -18.215 25.773 1.00 32.13 ? 229 VAL A CA 1 ATOM 1596 C C . VAL A 1 208 ? 60.463 -18.620 24.854 1.00 39.30 ? 229 VAL A C 1 ATOM 1597 O O . VAL A 1 208 ? 61.633 -18.550 25.236 1.00 39.31 ? 229 VAL A O 1 ATOM 1598 C CB . VAL A 1 208 ? 59.467 -16.707 25.970 1.00 43.53 ? 229 VAL A CB 1 ATOM 1599 C CG1 . VAL A 1 208 ? 59.075 -15.984 24.692 1.00 49.60 ? 229 VAL A CG1 1 ATOM 1600 C CG2 . VAL A 1 208 ? 58.617 -16.247 27.113 1.00 47.57 ? 229 VAL A CG2 1 ATOM 1601 N N . GLN A 1 209 ? 60.123 -19.048 23.646 1.00 42.64 ? 230 GLN A N 1 ATOM 1602 C CA . GLN A 1 209 ? 61.149 -19.398 22.672 1.00 42.47 ? 230 GLN A CA 1 ATOM 1603 C C . GLN A 1 209 ? 60.668 -19.273 21.238 1.00 46.97 ? 230 GLN A C 1 ATOM 1604 O O . GLN A 1 209 ? 59.474 -19.384 20.947 1.00 45.36 ? 230 GLN A O 1 ATOM 1605 C CB . GLN A 1 209 ? 61.649 -20.815 22.910 1.00 28.19 ? 230 GLN A CB 1 ATOM 1606 C CG . GLN A 1 209 ? 60.694 -21.897 22.468 1.00 26.38 ? 230 GLN A CG 1 ATOM 1607 C CD . GLN A 1 209 ? 61.119 -23.265 22.981 1.00 45.31 ? 230 GLN A CD 1 ATOM 1608 O OE1 . GLN A 1 209 ? 60.958 -23.577 24.168 1.00 44.39 ? 230 GLN A OE1 1 ATOM 1609 N NE2 . GLN A 1 209 ? 61.667 -24.087 22.092 1.00 44.38 ? 230 GLN A NE2 1 ATOM 1610 N N . PHE A 1 210 ? 61.614 -19.047 20.342 1.00 43.17 ? 231 PHE A N 1 ATOM 1611 C CA . PHE A 1 210 ? 61.304 -19.011 18.930 1.00 45.55 ? 231 PHE A CA 1 ATOM 1612 C C . PHE A 1 210 ? 60.764 -20.359 18.465 1.00 42.63 ? 231 PHE A C 1 ATOM 1613 O O . PHE A 1 210 ? 61.108 -21.399 19.027 1.00 43.21 ? 231 PHE A O 1 ATOM 1614 C CB . PHE A 1 210 ? 62.526 -18.580 18.119 1.00 47.61 ? 231 PHE A CB 1 ATOM 1615 C CG . PHE A 1 210 ? 63.770 -19.386 18.390 1.00 44.74 ? 231 PHE A CG 1 ATOM 1616 C CD1 . PHE A 1 210 ? 64.294 -20.219 17.410 1.00 45.17 ? 231 PHE A CD1 1 ATOM 1617 C CD2 . PHE A 1 210 ? 64.438 -19.284 19.600 1.00 43.15 ? 231 PHE A CD2 1 ATOM 1618 C CE1 . PHE A 1 210 ? 65.449 -20.937 17.632 1.00 46.64 ? 231 PHE A CE1 1 ATOM 1619 C CE2 . PHE A 1 210 ? 65.594 -20.012 19.835 1.00 43.48 ? 231 PHE A CE2 1 ATOM 1620 C CZ . PHE A 1 210 ? 66.099 -20.837 18.851 1.00 50.44 ? 231 PHE A CZ 1 ATOM 1621 N N . PRO A 1 211 ? 59.895 -20.340 17.445 1.00 44.76 ? 232 PRO A N 1 ATOM 1622 C CA . PRO A 1 211 ? 59.284 -21.573 16.925 1.00 44.64 ? 232 PRO A CA 1 ATOM 1623 C C . PRO A 1 211 ? 60.339 -22.531 16.382 1.00 41.47 ? 232 PRO A C 1 ATOM 1624 O O . PRO A 1 211 ? 61.462 -22.115 16.100 1.00 38.21 ? 232 PRO A O 1 ATOM 1625 C CB . PRO A 1 211 ? 58.387 -21.076 15.778 1.00 42.05 ? 232 PRO A CB 1 ATOM 1626 C CG . PRO A 1 211 ? 58.219 -19.606 16.007 1.00 47.79 ? 232 PRO A CG 1 ATOM 1627 C CD . PRO A 1 211 ? 59.457 -19.141 16.711 1.00 48.74 ? 232 PRO A CD 1 ATOM 1628 N N . GLU A 1 212 ? 59.968 -23.798 16.233 1.00 40.60 ? 233 GLU A N 1 ATOM 1629 C CA . GLU A 1 212 ? 60.870 -24.828 15.740 1.00 46.34 ? 233 GLU A CA 1 ATOM 1630 C C . GLU A 1 212 ? 61.334 -24.582 14.295 1.00 48.79 ? 233 GLU A C 1 ATOM 1631 O O . GLU A 1 212 ? 62.380 -25.080 13.868 1.00 43.16 ? 233 GLU A O 1 ATOM 1632 C CB . GLU A 1 212 ? 60.182 -26.184 15.855 1.00 63.26 ? 233 GLU A CB 1 ATOM 1633 C CG . GLU A 1 212 ? 61.065 -27.374 15.544 1.00 80.55 ? 233 GLU A CG 1 ATOM 1634 C CD . GLU A 1 212 ? 60.542 -28.651 16.179 1.00 90.21 ? 233 GLU A CD 1 ATOM 1635 O OE1 . GLU A 1 212 ? 60.137 -29.567 15.426 1.00 97.95 ? 233 GLU A OE1 1 ATOM 1636 O OE2 . GLU A 1 212 ? 60.524 -28.727 17.431 1.00 80.57 ? 233 GLU A OE2 1 ATOM 1637 N N . THR A 1 213 ? 60.539 -23.829 13.544 1.00 50.14 ? 234 THR A N 1 ATOM 1638 C CA . THR A 1 213 ? 60.910 -23.394 12.204 1.00 44.08 ? 234 THR A CA 1 ATOM 1639 C C . THR A 1 213 ? 60.575 -21.925 12.098 1.00 44.78 ? 234 THR A C 1 ATOM 1640 O O . THR A 1 213 ? 59.428 -21.529 12.306 1.00 49.34 ? 234 THR A O 1 ATOM 1641 C CB . THR A 1 213 ? 60.120 -24.131 11.103 1.00 53.16 ? 234 THR A CB 1 ATOM 1642 O OG1 . THR A 1 213 ? 60.433 -25.528 11.135 1.00 56.16 ? 234 THR A OG1 1 ATOM 1643 C CG2 . THR A 1 213 ? 60.476 -23.567 9.716 1.00 51.55 ? 234 THR A CG2 1 ATOM 1644 N N . VAL A 1 214 ? 61.571 -21.107 11.789 1.00 39.94 ? 235 VAL A N 1 ATOM 1645 C CA . VAL A 1 214 ? 61.321 -19.679 11.651 1.00 52.57 ? 235 VAL A CA 1 ATOM 1646 C C . VAL A 1 214 ? 61.796 -19.182 10.288 1.00 58.92 ? 235 VAL A C 1 ATOM 1647 O O . VAL A 1 214 ? 62.996 -19.082 10.031 1.00 54.71 ? 235 VAL A O 1 ATOM 1648 C CB . VAL A 1 214 ? 61.810 -18.830 12.905 1.00 39.84 ? 235 VAL A CB 1 ATOM 1649 C CG1 . VAL A 1 214 ? 62.424 -19.713 13.979 1.00 42.59 ? 235 VAL A CG1 1 ATOM 1650 C CG2 . VAL A 1 214 ? 62.737 -17.689 12.530 1.00 30.49 ? 235 VAL A CG2 1 ATOM 1651 N N . PRO A 1 215 ? 60.831 -18.931 9.387 1.00 64.60 ? 236 PRO A N 1 ATOM 1652 C CA . PRO A 1 215 ? 61.104 -18.415 8.047 1.00 60.71 ? 236 PRO A CA 1 ATOM 1653 C C . PRO A 1 215 ? 61.765 -17.056 8.172 1.00 59.46 ? 236 PRO A C 1 ATOM 1654 O O . PRO A 1 215 ? 61.258 -16.188 8.884 1.00 64.20 ? 236 PRO A O 1 ATOM 1655 C CB . PRO A 1 215 ? 59.706 -18.269 7.434 1.00 59.34 ? 236 PRO A CB 1 ATOM 1656 C CG . PRO A 1 215 ? 58.827 -19.168 8.239 1.00 62.15 ? 236 PRO A CG 1 ATOM 1657 C CD . PRO A 1 215 ? 59.388 -19.108 9.624 1.00 66.64 ? 236 PRO A CD 1 ATOM 1658 N N . ALA A 1 216 ? 62.896 -16.881 7.504 1.00 51.35 ? 237 ALA A N 1 ATOM 1659 C CA . ALA A 1 216 ? 63.619 -15.619 7.562 1.00 55.55 ? 237 ALA A CA 1 ATOM 1660 C C . ALA A 1 216 ? 63.787 -15.031 6.165 1.00 53.91 ? 237 ALA A C 1 ATOM 1661 O O . ALA A 1 216 ? 64.530 -15.574 5.348 1.00 49.33 ? 237 ALA A O 1 ATOM 1662 C CB . ALA A 1 216 ? 64.973 -15.828 8.209 1.00 51.93 ? 237 ALA A CB 1 ATOM 1663 N N . GLU A 1 217 ? 63.108 -13.919 5.896 1.00 54.61 ? 238 GLU A N 1 ATOM 1664 C CA . GLU A 1 217 ? 63.165 -13.304 4.575 1.00 57.46 ? 238 GLU A CA 1 ATOM 1665 C C . GLU A 1 217 ? 64.480 -12.567 4.340 1.00 61.26 ? 238 GLU A C 1 ATOM 1666 O O . GLU A 1 217 ? 64.962 -11.837 5.213 1.00 57.96 ? 238 GLU A O 1 ATOM 1667 C CB . GLU A 1 217 ? 61.982 -12.361 4.348 1.00 63.41 ? 238 GLU A CB 1 ATOM 1668 C CG . GLU A 1 217 ? 62.083 -11.569 3.046 1.00 72.69 ? 238 GLU A CG 1 ATOM 1669 C CD . GLU A 1 217 ? 60.760 -10.963 2.608 1.00 81.26 ? 238 GLU A CD 1 ATOM 1670 O OE1 . GLU A 1 217 ? 59.714 -11.310 3.194 1.00 80.75 ? 238 GLU A OE1 1 ATOM 1671 O OE2 . GLU A 1 217 ? 60.770 -10.138 1.668 1.00 88.97 ? 238 GLU A OE2 1 ATOM 1672 N N . LYS A 1 218 ? 65.046 -12.763 3.151 1.00 66.81 ? 239 LYS A N 1 ATOM 1673 C CA . LYS A 1 218 ? 66.293 -12.114 2.761 1.00 63.92 ? 239 LYS A CA 1 ATOM 1674 C C . LYS A 1 218 ? 66.228 -10.610 2.958 1.00 60.25 ? 239 LYS A C 1 ATOM 1675 O O . LYS A 1 218 ? 65.274 -9.960 2.534 1.00 60.01 ? 239 LYS A O 1 ATOM 1676 C CB . LYS A 1 218 ? 66.624 -12.415 1.299 1.00 68.11 ? 239 LYS A CB 1 ATOM 1677 C CG . LYS A 1 218 ? 67.686 -11.486 0.723 1.00 77.49 ? 239 LYS A CG 1 ATOM 1678 C CD . LYS A 1 218 ? 67.788 -11.583 -0.798 1.00 86.13 ? 239 LYS A CD 1 ATOM 1679 C CE . LYS A 1 218 ? 68.749 -12.683 -1.231 1.00 91.13 ? 239 LYS A CE 1 ATOM 1680 N NZ . LYS A 1 218 ? 68.956 -12.694 -2.707 1.00 96.02 ? 239 LYS A NZ 1 ATOM 1681 N N . GLY A 1 219 ? 67.247 -10.062 3.613 1.00 61.28 ? 240 GLY A N 1 ATOM 1682 C CA . GLY A 1 219 ? 67.360 -8.624 3.784 1.00 63.94 ? 240 GLY A CA 1 ATOM 1683 C C . GLY A 1 219 ? 66.572 -8.011 4.930 1.00 64.57 ? 240 GLY A C 1 ATOM 1684 O O . GLY A 1 219 ? 66.574 -6.791 5.085 1.00 66.27 ? 240 GLY A O 1 ATOM 1685 N N . THR A 1 220 ? 65.897 -8.837 5.728 1.00 53.20 ? 241 THR A N 1 ATOM 1686 C CA . THR A 1 220 ? 65.141 -8.332 6.874 1.00 61.13 ? 241 THR A CA 1 ATOM 1687 C C . THR A 1 220 ? 65.833 -8.633 8.198 1.00 59.09 ? 241 THR A C 1 ATOM 1688 O O . THR A 1 220 ? 66.773 -9.428 8.259 1.00 51.80 ? 241 THR A O 1 ATOM 1689 C CB . THR A 1 220 ? 63.717 -8.925 6.941 1.00 64.19 ? 241 THR A CB 1 ATOM 1690 O OG1 . THR A 1 220 ? 63.793 -10.353 7.030 1.00 69.34 ? 241 THR A OG1 1 ATOM 1691 C CG2 . THR A 1 220 ? 62.916 -8.538 5.718 1.00 55.91 ? 241 THR A CG2 1 ATOM 1692 N N . THR A 1 221 ? 65.358 -7.993 9.261 1.00 65.34 ? 242 THR A N 1 ATOM 1693 C CA . THR A 1 221 ? 65.885 -8.242 10.596 1.00 57.67 ? 242 THR A CA 1 ATOM 1694 C C . THR A 1 221 ? 65.063 -9.328 11.269 1.00 50.48 ? 242 THR A C 1 ATOM 1695 O O . THR A 1 221 ? 63.878 -9.143 11.551 1.00 53.05 ? 242 THR A O 1 ATOM 1696 C CB . THR A 1 221 ? 65.869 -6.975 11.472 1.00 67.74 ? 242 THR A CB 1 ATOM 1697 O OG1 . THR A 1 221 ? 66.582 -5.922 10.813 1.00 79.05 ? 242 THR A OG1 1 ATOM 1698 C CG2 . THR A 1 221 ? 66.527 -7.245 12.810 1.00 67.95 ? 242 THR A CG2 1 ATOM 1699 N N . VAL A 1 222 ? 65.692 -10.472 11.502 1.00 45.64 ? 243 VAL A N 1 ATOM 1700 C CA . VAL A 1 222 ? 65.064 -11.548 12.256 1.00 50.78 ? 243 VAL A CA 1 ATOM 1701 C C . VAL A 1 222 ? 65.301 -11.364 13.763 1.00 47.52 ? 243 VAL A C 1 ATOM 1702 O O . VAL A 1 222 ? 66.436 -11.133 14.186 1.00 41.70 ? 243 VAL A O 1 ATOM 1703 C CB . VAL A 1 222 ? 65.629 -12.895 11.812 1.00 50.18 ? 243 VAL A CB 1 ATOM 1704 C CG1 . VAL A 1 222 ? 64.980 -14.024 12.574 1.00 43.18 ? 243 VAL A CG1 1 ATOM 1705 C CG2 . VAL A 1 222 ? 65.422 -13.065 10.323 1.00 49.21 ? 243 VAL A CG2 1 ATOM 1706 N N . LYS A 1 223 ? 64.231 -11.451 14.557 1.00 48.65 ? 244 LYS A N 1 ATOM 1707 C CA . LYS A 1 223 ? 64.320 -11.350 16.020 1.00 45.28 ? 244 LYS A CA 1 ATOM 1708 C C . LYS A 1 223 ? 63.974 -12.653 16.717 1.00 43.97 ? 244 LYS A C 1 ATOM 1709 O O . LYS A 1 223 ? 62.877 -13.181 16.543 1.00 47.87 ? 244 LYS A O 1 ATOM 1710 C CB . LYS A 1 223 ? 63.396 -10.258 16.560 1.00 51.20 ? 244 LYS A CB 1 ATOM 1711 C CG . LYS A 1 223 ? 64.037 -8.884 16.643 1.00 66.09 ? 244 LYS A CG 1 ATOM 1712 C CD . LYS A 1 223 ? 63.040 -7.835 17.110 1.00 72.23 ? 244 LYS A CD 1 ATOM 1713 C CE . LYS A 1 223 ? 63.510 -6.426 16.758 1.00 74.15 ? 244 LYS A CE 1 ATOM 1714 N NZ . LYS A 1 223 ? 62.395 -5.430 16.750 1.00 68.04 ? 244 LYS A NZ 1 ATOM 1715 N N . LEU A 1 224 ? 64.900 -13.161 17.525 1.00 43.18 ? 245 LEU A N 1 ATOM 1716 C CA . LEU A 1 224 ? 64.642 -14.381 18.287 1.00 40.46 ? 245 LEU A CA 1 ATOM 1717 C C . LEU A 1 224 ? 64.408 -14.057 19.760 1.00 40.39 ? 245 LEU A C 1 ATOM 1718 O O . LEU A 1 224 ? 65.130 -13.255 20.354 1.00 42.78 ? 245 LEU A O 1 ATOM 1719 C CB . LEU A 1 224 ? 65.786 -15.385 18.123 1.00 38.18 ? 245 LEU A CB 1 ATOM 1720 C CG . LEU A 1 224 ? 66.173 -15.733 16.676 1.00 47.28 ? 245 LEU A CG 1 ATOM 1721 C CD1 . LEU A 1 224 ? 67.210 -16.840 16.655 1.00 45.41 ? 245 LEU A CD1 1 ATOM 1722 C CD2 . LEU A 1 224 ? 64.955 -16.133 15.865 1.00 41.02 ? 245 LEU A CD2 1 ATOM 1723 N N . GLU A 1 225 ? 63.379 -14.665 20.334 1.00 37.37 ? 246 GLU A N 1 ATOM 1724 C CA . GLU A 1 225 ? 63.070 -14.480 21.746 1.00 41.86 ? 246 GLU A CA 1 ATOM 1725 C C . GLU A 1 225 ? 63.393 -15.744 22.500 1.00 41.28 ? 246 GLU A C 1 ATOM 1726 O O . GLU A 1 225 ? 63.104 -16.848 22.035 1.00 42.85 ? 246 GLU A O 1 ATOM 1727 C CB . GLU A 1 225 ? 61.589 -14.138 21.961 1.00 42.10 ? 246 GLU A CB 1 ATOM 1728 C CG . GLU A 1 225 ? 61.237 -12.678 21.698 1.00 52.43 ? 246 GLU A CG 1 ATOM 1729 C CD . GLU A 1 225 ? 59.836 -12.294 22.183 1.00 52.51 ? 246 GLU A CD 1 ATOM 1730 O OE1 . GLU A 1 225 ? 59.023 -13.202 22.483 1.00 46.83 ? 246 GLU A OE1 1 ATOM 1731 O OE2 . GLU A 1 225 ? 59.551 -11.075 22.258 1.00 49.03 ? 246 GLU A OE2 1 ATOM 1732 N N . CYS A 1 226 ? 63.996 -15.577 23.669 1.00 40.32 ? 247 CYS A N 1 ATOM 1733 C CA . CYS A 1 226 ? 64.250 -16.696 24.558 1.00 41.18 ? 247 CYS A CA 1 ATOM 1734 C C . CYS A 1 226 ? 64.299 -16.229 26.010 1.00 41.34 ? 247 CYS A C 1 ATOM 1735 O O . CYS A 1 226 ? 64.999 -15.274 26.341 1.00 40.36 ? 247 CYS A O 1 ATOM 1736 C CB . CYS A 1 226 ? 65.550 -17.388 24.179 1.00 43.21 ? 247 CYS A CB 1 ATOM 1737 S SG . CYS A 1 226 ? 65.957 -18.806 25.216 1.00 55.68 ? 247 CYS A SG 1 ATOM 1738 N N . PHE A 1 227 ? 63.549 -16.903 26.875 1.00 35.93 ? 248 PHE A N 1 ATOM 1739 C CA . PHE A 1 227 ? 63.521 -16.537 28.288 1.00 31.09 ? 248 PHE A CA 1 ATOM 1740 C C . PHE A 1 227 ? 63.024 -17.692 29.122 1.00 29.35 ? 248 PHE A C 1 ATOM 1741 O O . PHE A 1 227 ? 62.059 -18.366 28.751 1.00 33.95 ? 248 PHE A O 1 ATOM 1742 C CB . PHE A 1 227 ? 62.638 -15.325 28.524 1.00 23.37 ? 248 PHE A CB 1 ATOM 1743 C CG . PHE A 1 227 ? 62.690 -14.805 29.930 1.00 26.67 ? 248 PHE A CG 1 ATOM 1744 C CD1 . PHE A 1 227 ? 63.717 -13.974 30.331 1.00 26.85 ? 248 PHE A CD1 1 ATOM 1745 C CD2 . PHE A 1 227 ? 61.705 -15.136 30.847 1.00 25.29 ? 248 PHE A CD2 1 ATOM 1746 C CE1 . PHE A 1 227 ? 63.762 -13.483 31.616 1.00 27.92 ? 248 PHE A CE1 1 ATOM 1747 C CE2 . PHE A 1 227 ? 61.751 -14.646 32.143 1.00 24.48 ? 248 PHE A CE2 1 ATOM 1748 C CZ . PHE A 1 227 ? 62.776 -13.823 32.522 1.00 19.95 ? 248 PHE A CZ 1 ATOM 1749 N N . ALA A 1 228 ? 63.694 -17.903 30.253 1.00 19.82 ? 249 ALA A N 1 ATOM 1750 C CA . ALA A 1 228 ? 63.439 -19.045 31.121 1.00 20.49 ? 249 ALA A CA 1 ATOM 1751 C C . ALA A 1 228 ? 63.078 -18.604 32.526 1.00 26.58 ? 249 ALA A C 1 ATOM 1752 O O . ALA A 1 228 ? 63.590 -17.606 33.026 1.00 29.71 ? 249 ALA A O 1 ATOM 1753 C CB . ALA A 1 228 ? 64.653 -19.969 31.155 1.00 21.85 ? 249 ALA A CB 1 ATOM 1754 N N . LEU A 1 229 ? 62.163 -19.354 33.130 1.00 27.90 ? 250 LEU A N 1 ATOM 1755 C CA . LEU A 1 229 ? 61.847 -19.277 34.547 1.00 25.52 ? 250 LEU A CA 1 ATOM 1756 C C . LEU A 1 229 ? 62.845 -20.139 35.307 1.00 28.79 ? 250 LEU A C 1 ATOM 1757 O O . LEU A 1 229 ? 63.247 -21.191 34.824 1.00 31.03 ? 250 LEU A O 1 ATOM 1758 C CB . LEU A 1 229 ? 60.441 -19.833 34.791 1.00 20.37 ? 250 LEU A CB 1 ATOM 1759 C CG . LEU A 1 229 ? 59.313 -19.189 33.956 1.00 27.64 ? 250 LEU A CG 1 ATOM 1760 C CD1 . LEU A 1 229 ? 57.966 -19.692 34.397 1.00 32.01 ? 250 LEU A CD1 1 ATOM 1761 C CD2 . LEU A 1 229 ? 59.342 -17.680 34.041 1.00 19.33 ? 250 LEU A CD2 1 ATOM 1762 N N . GLY A 1 230 ? 63.251 -19.706 36.494 1.00 27.50 ? 251 GLY A N 1 ATOM 1763 C CA . GLY A 1 230 ? 64.163 -20.515 37.285 1.00 25.24 ? 251 GLY A CA 1 ATOM 1764 C C . GLY A 1 230 ? 64.657 -19.841 38.549 1.00 26.86 ? 251 GLY A C 1 ATOM 1765 O O . GLY A 1 230 ? 64.582 -18.628 38.692 1.00 29.04 ? 251 GLY A O 1 ATOM 1766 N N . ASN A 1 231 ? 65.190 -20.643 39.459 1.00 28.51 ? 252 ASN A N 1 ATOM 1767 C CA . ASN A 1 231 ? 65.629 -20.165 40.761 1.00 23.11 ? 252 ASN A CA 1 ATOM 1768 C C . ASN A 1 231 ? 66.904 -20.907 41.144 1.00 27.62 ? 252 ASN A C 1 ATOM 1769 O O . ASN A 1 231 ? 66.867 -22.106 41.450 1.00 30.79 ? 252 ASN A O 1 ATOM 1770 C CB . ASN A 1 231 ? 64.514 -20.404 41.791 1.00 32.59 ? 252 ASN A CB 1 ATOM 1771 C CG . ASN A 1 231 ? 64.890 -19.962 43.204 1.00 36.79 ? 252 ASN A CG 1 ATOM 1772 O OD1 . ASN A 1 231 ? 65.929 -19.348 43.436 1.00 29.90 ? 252 ASN A OD1 1 ATOM 1773 N ND2 . ASN A 1 231 ? 64.022 -20.272 44.154 1.00 37.62 ? 252 ASN A ND2 1 ATOM 1774 N N . PRO A 1 232 ? 68.045 -20.203 41.136 1.00 23.34 ? 253 PRO A N 1 ATOM 1775 C CA . PRO A 1 232 ? 68.200 -18.761 40.899 1.00 26.67 ? 253 PRO A CA 1 ATOM 1776 C C . PRO A 1 232 ? 67.857 -18.368 39.461 1.00 27.00 ? 253 PRO A C 1 ATOM 1777 O O . PRO A 1 232 ? 67.696 -19.249 38.609 1.00 25.05 ? 253 PRO A O 1 ATOM 1778 C CB . PRO A 1 232 ? 69.692 -18.521 41.164 1.00 28.03 ? 253 PRO A CB 1 ATOM 1779 C CG . PRO A 1 232 ? 70.153 -19.728 41.954 1.00 28.52 ? 253 PRO A CG 1 ATOM 1780 C CD . PRO A 1 232 ? 69.337 -20.854 41.408 1.00 27.69 ? 253 PRO A CD 1 ATOM 1781 N N . VAL A 1 233 ? 67.741 -17.069 39.196 1.00 21.66 ? 254 VAL A N 1 ATOM 1782 C CA . VAL A 1 233 ? 67.324 -16.626 37.872 1.00 31.86 ? 254 VAL A CA 1 ATOM 1783 C C . VAL A 1 233 ? 68.397 -16.900 36.833 1.00 33.53 ? 254 VAL A C 1 ATOM 1784 O O . VAL A 1 233 ? 69.564 -16.552 37.009 1.00 39.64 ? 254 VAL A O 1 ATOM 1785 C CB . VAL A 1 233 ? 66.818 -15.157 37.832 1.00 26.90 ? 254 VAL A CB 1 ATOM 1786 C CG1 . VAL A 1 233 ? 67.246 -14.404 39.041 1.00 27.47 ? 254 VAL A CG1 1 ATOM 1787 C CG2 . VAL A 1 233 ? 67.266 -14.464 36.558 1.00 28.05 ? 254 VAL A CG2 1 ATOM 1788 N N . PRO A 1 234 ? 67.994 -17.566 35.754 1.00 32.79 ? 255 PRO A N 1 ATOM 1789 C CA . PRO A 1 234 ? 68.934 -18.073 34.750 1.00 34.64 ? 255 PRO A CA 1 ATOM 1790 C C . PRO A 1 234 ? 69.633 -16.956 33.999 1.00 31.84 ? 255 PRO A C 1 ATOM 1791 O O . PRO A 1 234 ? 69.146 -15.823 33.979 1.00 33.09 ? 255 PRO A O 1 ATOM 1792 C CB . PRO A 1 234 ? 68.033 -18.881 33.807 1.00 26.48 ? 255 PRO A CB 1 ATOM 1793 C CG . PRO A 1 234 ? 66.832 -19.259 34.656 1.00 31.80 ? 255 PRO A CG 1 ATOM 1794 C CD . PRO A 1 234 ? 66.618 -18.047 35.530 1.00 28.93 ? 255 PRO A CD 1 ATOM 1795 N N . THR A 1 235 ? 70.788 -17.273 33.430 1.00 30.23 ? 256 THR A N 1 ATOM 1796 C CA . THR A 1 235 ? 71.417 -16.432 32.409 1.00 26.82 ? 256 THR A CA 1 ATOM 1797 C C . THR A 1 235 ? 71.050 -17.040 31.066 1.00 33.31 ? 256 THR A C 1 ATOM 1798 O O . THR A 1 235 ? 70.888 -18.261 30.964 1.00 30.01 ? 256 THR A O 1 ATOM 1799 C CB . THR A 1 235 ? 72.938 -16.498 32.483 1.00 27.17 ? 256 THR A CB 1 ATOM 1800 O OG1 . THR A 1 235 ? 73.350 -17.874 32.442 1.00 30.80 ? 256 THR A OG1 1 ATOM 1801 C CG2 . THR A 1 235 ? 73.452 -15.852 33.764 1.00 31.00 ? 256 THR A CG2 1 ATOM 1802 N N . ILE A 1 236 ? 70.932 -16.196 30.044 1.00 40.53 ? 257 ILE A N 1 ATOM 1803 C CA . ILE A 1 236 ? 70.657 -16.640 28.676 1.00 38.91 ? 257 ILE A CA 1 ATOM 1804 C C . ILE A 1 236 ? 71.889 -16.513 27.776 1.00 41.41 ? 257 ILE A C 1 ATOM 1805 O O . ILE A 1 236 ? 72.635 -15.533 27.851 1.00 42.75 ? 257 ILE A O 1 ATOM 1806 C CB . ILE A 1 236 ? 69.509 -15.826 28.034 1.00 35.47 ? 257 ILE A CB 1 ATOM 1807 C CG1 . ILE A 1 236 ? 68.219 -15.947 28.863 1.00 25.68 ? 257 ILE A CG1 1 ATOM 1808 C CG2 . ILE A 1 236 ? 69.286 -16.265 26.578 1.00 27.09 ? 257 ILE A CG2 1 ATOM 1809 C CD1 . ILE A 1 236 ? 67.608 -17.329 28.818 1.00 35.52 ? 257 ILE A CD1 1 ATOM 1810 N N . LEU A 1 237 ? 72.095 -17.502 26.914 1.00 39.54 ? 258 LEU A N 1 ATOM 1811 C CA . LEU A 1 237 ? 73.190 -17.446 25.947 1.00 42.70 ? 258 LEU A CA 1 ATOM 1812 C C . LEU A 1 237 ? 72.769 -18.019 24.585 1.00 39.80 ? 258 LEU A C 1 ATOM 1813 O O . LEU A 1 237 ? 72.007 -18.986 24.519 1.00 32.35 ? 258 LEU A O 1 ATOM 1814 C CB . LEU A 1 237 ? 74.402 -18.190 26.509 1.00 46.96 ? 258 LEU A CB 1 ATOM 1815 C CG . LEU A 1 237 ? 75.384 -18.897 25.580 1.00 60.44 ? 258 LEU A CG 1 ATOM 1816 C CD1 . LEU A 1 237 ? 76.082 -17.904 24.669 1.00 70.71 ? 258 LEU A CD1 1 ATOM 1817 C CD2 . LEU A 1 237 ? 76.401 -19.658 26.415 1.00 57.92 ? 258 LEU A CD2 1 ATOM 1818 N N . TRP A 1 238 ? 73.267 -17.421 23.506 1.00 45.65 ? 259 TRP A N 1 ATOM 1819 C CA . TRP A 1 238 ? 72.934 -17.861 22.143 1.00 40.91 ? 259 TRP A CA 1 ATOM 1820 C C . TRP A 1 238 ? 74.132 -18.439 21.413 1.00 39.42 ? 259 TRP A C 1 ATOM 1821 O O . TRP A 1 238 ? 75.250 -17.944 21.543 1.00 42.11 ? 259 TRP A O 1 ATOM 1822 C CB . TRP A 1 238 ? 72.401 -16.704 21.311 1.00 36.89 ? 259 TRP A CB 1 ATOM 1823 C CG . TRP A 1 238 ? 71.164 -16.046 21.837 1.00 38.32 ? 259 TRP A CG 1 ATOM 1824 C CD1 . TRP A 1 238 ? 71.102 -15.008 22.715 1.00 30.32 ? 259 TRP A CD1 1 ATOM 1825 C CD2 . TRP A 1 238 ? 69.813 -16.338 21.464 1.00 37.80 ? 259 TRP A CD2 1 ATOM 1826 N NE1 . TRP A 1 238 ? 69.793 -14.654 22.934 1.00 27.39 ? 259 TRP A NE1 1 ATOM 1827 C CE2 . TRP A 1 238 ? 68.980 -15.462 22.179 1.00 38.36 ? 259 TRP A CE2 1 ATOM 1828 C CE3 . TRP A 1 238 ? 69.223 -17.269 20.600 1.00 34.15 ? 259 TRP A CE3 1 ATOM 1829 C CZ2 . TRP A 1 238 ? 67.592 -15.478 22.059 1.00 38.52 ? 259 TRP A CZ2 1 ATOM 1830 C CZ3 . TRP A 1 238 ? 67.850 -17.294 20.491 1.00 29.52 ? 259 TRP A CZ3 1 ATOM 1831 C CH2 . TRP A 1 238 ? 67.048 -16.401 21.210 1.00 30.85 ? 259 TRP A CH2 1 ATOM 1832 N N . ARG A 1 239 ? 73.882 -19.475 20.622 1.00 41.08 ? 260 ARG A N 1 ATOM 1833 C CA . ARG A 1 239 ? 74.921 -20.134 19.855 1.00 37.73 ? 260 ARG A CA 1 ATOM 1834 C C . ARG A 1 239 ? 74.260 -20.890 18.709 1.00 46.98 ? 260 ARG A C 1 ATOM 1835 O O . ARG A 1 239 ? 73.045 -21.081 18.725 1.00 45.72 ? 260 ARG A O 1 ATOM 1836 C CB . ARG A 1 239 ? 75.676 -21.113 20.738 1.00 28.35 ? 260 ARG A CB 1 ATOM 1837 C CG . ARG A 1 239 ? 74.831 -22.289 21.173 1.00 34.66 ? 260 ARG A CG 1 ATOM 1838 C CD . ARG A 1 239 ? 75.545 -23.112 22.213 1.00 37.94 ? 260 ARG A CD 1 ATOM 1839 N NE . ARG A 1 239 ? 74.791 -24.304 22.597 1.00 39.14 ? 260 ARG A NE 1 ATOM 1840 C CZ . ARG A 1 239 ? 75.088 -25.039 23.663 1.00 42.82 ? 260 ARG A CZ 1 ATOM 1841 N NH1 . ARG A 1 239 ? 76.104 -24.682 24.435 1.00 43.21 ? 260 ARG A NH1 1 ATOM 1842 N NH2 . ARG A 1 239 ? 74.376 -26.117 23.963 1.00 37.52 ? 260 ARG A NH2 1 ATOM 1843 N N . ARG A 1 240 ? 75.056 -21.316 17.723 1.00 44.38 ? 261 ARG A N 1 ATOM 1844 C CA . ARG A 1 240 ? 74.546 -22.068 16.574 1.00 41.12 ? 261 ARG A CA 1 ATOM 1845 C C . ARG A 1 240 ? 74.847 -23.549 16.724 1.00 37.33 ? 261 ARG A C 1 ATOM 1846 O O . ARG A 1 240 ? 75.937 -23.929 17.139 1.00 48.11 ? 261 ARG A O 1 ATOM 1847 C CB . ARG A 1 240 ? 75.109 -21.516 15.248 1.00 41.06 ? 261 ARG A CB 1 ATOM 1848 C CG . ARG A 1 240 ? 74.478 -20.186 14.834 1.00 38.99 ? 261 ARG A CG 1 ATOM 1849 C CD . ARG A 1 240 ? 75.213 -19.509 13.683 1.00 42.66 ? 261 ARG A CD 1 ATOM 1850 N NE . ARG A 1 240 ? 74.718 -19.924 12.374 1.00 46.31 ? 261 ARG A NE 1 ATOM 1851 C CZ . ARG A 1 240 ? 75.124 -19.390 11.224 1.00 52.51 ? 261 ARG A CZ 1 ATOM 1852 N NH1 . ARG A 1 240 ? 76.033 -18.421 11.236 1.00 45.93 ? 261 ARG A NH1 1 ATOM 1853 N NH2 . ARG A 1 240 ? 74.624 -19.817 10.063 1.00 43.63 ? 261 ARG A NH2 1 ATOM 1854 N N . ALA A 1 241 ? 73.873 -24.382 16.377 1.00 35.05 ? 262 ALA A N 1 ATOM 1855 C CA . ALA A 1 241 ? 73.934 -25.810 16.678 1.00 34.55 ? 262 ALA A CA 1 ATOM 1856 C C . ALA A 1 241 ? 74.936 -26.588 15.827 1.00 43.56 ? 262 ALA A C 1 ATOM 1857 O O . ALA A 1 241 ? 75.179 -27.770 16.078 1.00 49.53 ? 262 ALA A O 1 ATOM 1858 C CB . ALA A 1 241 ? 72.558 -26.427 16.571 1.00 38.68 ? 262 ALA A CB 1 ATOM 1859 N N . ASP A 1 242 ? 75.516 -25.926 14.829 1.00 37.62 ? 263 ASP A N 1 ATOM 1860 C CA . ASP A 1 242 ? 76.532 -26.542 13.984 1.00 41.03 ? 263 ASP A CA 1 ATOM 1861 C C . ASP A 1 242 ? 77.880 -25.854 14.185 1.00 47.32 ? 263 ASP A C 1 ATOM 1862 O O . ASP A 1 242 ? 78.778 -25.960 13.349 1.00 52.92 ? 263 ASP A O 1 ATOM 1863 C CB . ASP A 1 242 ? 76.116 -26.488 12.510 1.00 41.81 ? 263 ASP A CB 1 ATOM 1864 C CG . ASP A 1 242 ? 75.761 -25.080 12.056 1.00 57.11 ? 263 ASP A CG 1 ATOM 1865 O OD1 . ASP A 1 242 ? 76.115 -24.115 12.769 1.00 63.33 ? 263 ASP A OD1 1 ATOM 1866 O OD2 . ASP A 1 242 ? 75.125 -24.934 10.991 1.00 64.39 ? 263 ASP A OD2 1 ATOM 1867 N N . GLY A 1 243 ? 78.010 -25.132 15.292 1.00 47.15 ? 264 GLY A N 1 ATOM 1868 C CA . GLY A 1 243 ? 79.287 -24.559 15.679 1.00 50.08 ? 264 GLY A CA 1 ATOM 1869 C C . GLY A 1 243 ? 79.682 -23.297 14.938 1.00 54.48 ? 264 GLY A C 1 ATOM 1870 O O . GLY A 1 243 ? 80.716 -22.692 15.241 1.00 54.11 ? 264 GLY A O 1 ATOM 1871 N N . LYS A 1 244 ? 78.867 -22.894 13.967 1.00 53.04 ? 265 LYS A N 1 ATOM 1872 C CA . LYS A 1 244 ? 79.149 -21.677 13.220 1.00 54.37 ? 265 LYS A CA 1 ATOM 1873 C C . LYS A 1 244 ? 79.016 -20.475 14.137 1.00 55.75 ? 265 LYS A C 1 ATOM 1874 O O . LYS A 1 244 ? 78.046 -20.361 14.884 1.00 61.98 ? 265 LYS A O 1 ATOM 1875 C CB . LYS A 1 244 ? 78.196 -21.515 12.030 1.00 56.06 ? 265 LYS A CB 1 ATOM 1876 C CG . LYS A 1 244 ? 78.403 -22.501 10.883 1.00 59.21 ? 265 LYS A CG 1 ATOM 1877 C CD . LYS A 1 244 ? 77.572 -22.081 9.669 1.00 62.98 ? 265 LYS A CD 1 ATOM 1878 C CE . LYS A 1 244 ? 77.567 -23.140 8.568 1.00 67.58 ? 265 LYS A CE 1 ATOM 1879 N NZ . LYS A 1 244 ? 76.870 -22.669 7.325 1.00 67.66 ? 265 LYS A NZ 1 ATOM 1880 N N . PRO A 1 245 ? 80.003 -19.580 14.095 1.00 51.82 ? 266 PRO A N 1 ATOM 1881 C CA . PRO A 1 245 ? 79.909 -18.293 14.784 1.00 50.19 ? 266 PRO A CA 1 ATOM 1882 C C . PRO A 1 245 ? 78.640 -17.535 14.403 1.00 54.68 ? 266 PRO A C 1 ATOM 1883 O O . PRO A 1 245 ? 78.294 -17.469 13.225 1.00 63.85 ? 266 PRO A O 1 ATOM 1884 C CB . PRO A 1 245 ? 81.127 -17.531 14.254 1.00 49.72 ? 266 PRO A CB 1 ATOM 1885 C CG . PRO A 1 245 ? 82.109 -18.586 13.903 1.00 46.22 ? 266 PRO A CG 1 ATOM 1886 C CD . PRO A 1 245 ? 81.327 -19.798 13.484 1.00 49.53 ? 266 PRO A CD 1 ATOM 1887 N N . ILE A 1 246 ? 77.954 -16.978 15.395 1.00 58.10 ? 267 ILE A N 1 ATOM 1888 C CA . ILE A 1 246 ? 76.889 -16.021 15.138 1.00 55.08 ? 267 ILE A CA 1 ATOM 1889 C C . ILE A 1 246 ? 77.545 -14.837 14.440 1.00 52.05 ? 267 ILE A C 1 ATOM 1890 O O . ILE A 1 246 ? 78.704 -14.527 14.704 1.00 57.32 ? 267 ILE A O 1 ATOM 1891 C CB . ILE A 1 246 ? 76.234 -15.530 16.452 1.00 50.25 ? 267 ILE A CB 1 ATOM 1892 C CG1 . ILE A 1 246 ? 75.754 -16.709 17.304 1.00 49.78 ? 267 ILE A CG1 1 ATOM 1893 C CG2 . ILE A 1 246 ? 75.089 -14.564 16.162 1.00 40.53 ? 267 ILE A CG2 1 ATOM 1894 C CD1 . ILE A 1 246 ? 74.363 -17.146 17.003 1.00 51.87 ? 267 ILE A CD1 1 ATOM 1895 N N . ALA A 1 247 ? 76.822 -14.176 13.547 1.00 51.74 ? 268 ALA A N 1 ATOM 1896 C CA . ALA A 1 247 ? 77.402 -13.049 12.826 1.00 53.16 ? 268 ALA A CA 1 ATOM 1897 C C . ALA A 1 247 ? 77.745 -11.924 13.794 1.00 63.73 ? 268 ALA A C 1 ATOM 1898 O O . ALA A 1 247 ? 77.061 -11.733 14.798 1.00 67.94 ? 268 ALA A O 1 ATOM 1899 C CB . ALA A 1 247 ? 76.447 -12.552 11.754 1.00 52.95 ? 268 ALA A CB 1 ATOM 1900 N N . ARG A 1 248 ? 78.806 -11.181 13.490 1.00 67.83 ? 269 ARG A N 1 ATOM 1901 C CA . ARG A 1 248 ? 79.199 -10.036 14.304 1.00 69.47 ? 269 ARG A CA 1 ATOM 1902 C C . ARG A 1 248 ? 78.172 -8.918 14.230 1.00 69.65 ? 269 ARG A C 1 ATOM 1903 O O . ARG A 1 248 ? 78.124 -8.052 15.101 1.00 78.04 ? 269 ARG A O 1 ATOM 1904 C CB . ARG A 1 248 ? 80.562 -9.499 13.869 1.00 77.77 ? 269 ARG A CB 1 ATOM 1905 C CG . ARG A 1 248 ? 81.719 -9.881 14.774 1.00 84.56 ? 269 ARG A CG 1 ATOM 1906 C CD . ARG A 1 248 ? 83.009 -9.226 14.290 1.00 96.94 ? 269 ARG A CD 1 ATOM 1907 N NE . ARG A 1 248 ? 83.412 -9.742 12.985 1.00 104.61 ? 269 ARG A NE 1 ATOM 1908 C CZ . ARG A 1 248 ? 84.456 -10.540 12.788 1.00 108.52 ? 269 ARG A CZ 1 ATOM 1909 N NH1 . ARG A 1 248 ? 85.219 -10.901 13.811 1.00 111.84 ? 269 ARG A NH1 1 ATOM 1910 N NH2 . ARG A 1 248 ? 84.743 -10.970 11.566 1.00 106.62 ? 269 ARG A NH2 1 ATOM 1911 N N . LYS A 1 249 ? 77.355 -8.930 13.184 1.00 65.73 ? 270 LYS A N 1 ATOM 1912 C CA . LYS A 1 249 ? 76.356 -7.884 13.002 1.00 61.15 ? 270 LYS A CA 1 ATOM 1913 C C . LYS A 1 249 ? 75.170 -8.119 13.934 1.00 55.53 ? 270 LYS A C 1 ATOM 1914 O O . LYS A 1 249 ? 74.372 -7.213 14.186 1.00 55.48 ? 270 LYS A O 1 ATOM 1915 C CB . LYS A 1 249 ? 75.889 -7.839 11.547 1.00 58.10 ? 270 LYS A CB 1 ATOM 1916 C CG . LYS A 1 249 ? 74.854 -8.890 11.205 1.00 60.72 ? 270 LYS A CG 1 ATOM 1917 C CD . LYS A 1 249 ? 74.953 -9.327 9.748 1.00 65.61 ? 270 LYS A CD 1 ATOM 1918 C CE . LYS A 1 249 ? 73.741 -10.160 9.351 1.00 64.96 ? 270 LYS A CE 1 ATOM 1919 N NZ . LYS A 1 249 ? 73.996 -11.007 8.163 1.00 64.26 ? 270 LYS A NZ 1 ATOM 1920 N N . ALA A 1 250 ? 75.055 -9.343 14.439 1.00 49.03 ? 271 ALA A N 1 ATOM 1921 C CA . ALA A 1 250 ? 73.985 -9.678 15.373 1.00 58.27 ? 271 ALA A CA 1 ATOM 1922 C C . ALA A 1 250 ? 74.172 -8.942 16.694 1.00 56.73 ? 271 ALA A C 1 ATOM 1923 O O . ALA A 1 250 ? 75.278 -8.894 17.237 1.00 57.05 ? 271 ALA A O 1 ATOM 1924 C CB . ALA A 1 250 ? 73.925 -11.184 15.608 1.00 57.70 ? 271 ALA A CB 1 ATOM 1925 N N . ARG A 1 251 ? 73.088 -8.359 17.195 1.00 53.85 ? 272 ARG A N 1 ATOM 1926 C CA . ARG A 1 251 ? 73.085 -7.728 18.511 1.00 64.36 ? 272 ARG A CA 1 ATOM 1927 C C . ARG A 1 251 ? 72.180 -8.501 19.469 1.00 60.24 ? 272 ARG A C 1 ATOM 1928 O O . ARG A 1 251 ? 71.315 -9.262 19.038 1.00 57.84 ? 272 ARG A O 1 ATOM 1929 C CB . ARG A 1 251 ? 72.595 -6.287 18.415 1.00 68.87 ? 272 ARG A CB 1 ATOM 1930 C CG . ARG A 1 251 ? 72.961 -5.579 17.130 1.00 79.30 ? 272 ARG A CG 1 ATOM 1931 C CD . ARG A 1 251 ? 72.489 -4.137 17.196 1.00 92.71 ? 272 ARG A CD 1 ATOM 1932 N NE . ARG A 1 251 ? 73.147 -3.421 18.288 1.00 101.41 ? 272 ARG A NE 1 ATOM 1933 C CZ . ARG A 1 251 ? 72.599 -2.421 18.973 1.00 100.05 ? 272 ARG A CZ 1 ATOM 1934 N NH1 . ARG A 1 251 ? 71.366 -2.014 18.689 1.00 100.03 ? 272 ARG A NH1 1 ATOM 1935 N NH2 . ARG A 1 251 ? 73.284 -1.837 19.948 1.00 94.85 ? 272 ARG A NH2 1 ATOM 1936 N N . ARG A 1 252 ? 72.377 -8.303 20.767 1.00 60.33 ? 273 ARG A N 1 ATOM 1937 C CA . ARG A 1 252 ? 71.507 -8.917 21.772 1.00 56.06 ? 273 ARG A CA 1 ATOM 1938 C C . ARG A 1 252 ? 70.882 -7.834 22.641 1.00 52.39 ? 273 ARG A C 1 ATOM 1939 O O . ARG A 1 252 ? 71.537 -6.853 22.992 1.00 53.66 ? 273 ARG A O 1 ATOM 1940 C CB . ARG A 1 252 ? 72.294 -9.906 22.631 1.00 51.38 ? 273 ARG A CB 1 ATOM 1941 C CG . ARG A 1 252 ? 72.966 -11.007 21.822 1.00 59.40 ? 273 ARG A CG 1 ATOM 1942 C CD . ARG A 1 252 ? 74.201 -11.539 22.532 1.00 67.16 ? 273 ARG A CD 1 ATOM 1943 N NE . ARG A 1 252 ? 74.765 -12.725 21.885 1.00 72.89 ? 273 ARG A NE 1 ATOM 1944 C CZ . ARG A 1 252 ? 75.476 -12.706 20.759 1.00 71.53 ? 273 ARG A CZ 1 ATOM 1945 N NH1 . ARG A 1 252 ? 75.701 -11.558 20.134 1.00 73.38 ? 273 ARG A NH1 1 ATOM 1946 N NH2 . ARG A 1 252 ? 75.956 -13.838 20.255 1.00 63.95 ? 273 ARG A NH2 1 ATOM 1947 N N . HIS A 1 253 ? 69.611 -8.001 22.977 1.00 53.81 ? 274 HIS A N 1 ATOM 1948 C CA . HIS A 1 253 ? 68.908 -7.002 23.777 1.00 60.33 ? 274 HIS A CA 1 ATOM 1949 C C . HIS A 1 253 ? 68.179 -7.623 24.958 1.00 56.33 ? 274 HIS A C 1 ATOM 1950 O O . HIS A 1 253 ? 68.059 -8.848 25.057 1.00 49.36 ? 274 HIS A O 1 ATOM 1951 C CB . HIS A 1 253 ? 67.907 -6.231 22.915 1.00 60.48 ? 274 HIS A CB 1 ATOM 1952 C CG . HIS A 1 253 ? 68.480 -5.738 21.625 1.00 69.15 ? 274 HIS A CG 1 ATOM 1953 N ND1 . HIS A 1 253 ? 69.475 -4.786 21.569 1.00 72.79 ? 274 HIS A ND1 1 ATOM 1954 C CD2 . HIS A 1 253 ? 68.198 -6.066 20.342 1.00 73.54 ? 274 HIS A CD2 1 ATOM 1955 C CE1 . HIS A 1 253 ? 69.782 -4.548 20.307 1.00 79.09 ? 274 HIS A CE1 1 ATOM 1956 N NE2 . HIS A 1 253 ? 69.022 -5.312 19.541 1.00 79.13 ? 274 HIS A NE2 1 ATOM 1957 N N . LYS A 1 254 ? 67.677 -6.763 25.840 1.00 51.45 ? 275 LYS A N 1 ATOM 1958 C CA . LYS A 1 254 ? 66.883 -7.206 26.983 1.00 46.76 ? 275 LYS A CA 1 ATOM 1959 C C . LYS A 1 254 ? 67.564 -8.343 27.736 1.00 39.71 ? 275 LYS A C 1 ATOM 1960 O O . LYS A 1 254 ? 67.060 -9.470 27.774 1.00 34.06 ? 275 LYS A O 1 ATOM 1961 C CB . LYS A 1 254 ? 65.480 -7.618 26.538 1.00 46.79 ? 275 LYS A CB 1 ATOM 1962 C CG . LYS A 1 254 ? 64.780 -6.548 25.718 1.00 51.82 ? 275 LYS A CG 1 ATOM 1963 C CD . LYS A 1 254 ? 63.364 -6.937 25.355 1.00 62.86 ? 275 LYS A CD 1 ATOM 1964 C CE . LYS A 1 254 ? 62.693 -5.794 24.617 1.00 75.99 ? 275 LYS A CE 1 ATOM 1965 N NZ . LYS A 1 254 ? 63.003 -4.492 25.278 1.00 77.86 ? 275 LYS A NZ 1 ATOM 1966 N N . SER A 1 255 ? 68.717 -8.028 28.324 1.00 37.09 ? 276 SER A N 1 ATOM 1967 C CA . SER A 1 255 ? 69.477 -8.984 29.113 1.00 47.62 ? 276 SER A CA 1 ATOM 1968 C C . SER A 1 255 ? 69.536 -10.336 28.399 1.00 49.82 ? 276 SER A C 1 ATOM 1969 O O . SER A 1 255 ? 69.350 -11.388 29.014 1.00 46.03 ? 276 SER A O 1 ATOM 1970 C CB . SER A 1 255 ? 68.874 -9.102 30.518 1.00 44.12 ? 276 SER A CB 1 ATOM 1971 O OG . SER A 1 255 ? 68.474 -7.819 30.985 1.00 38.97 ? 276 SER A OG 1 ATOM 1972 N N . ASN A 1 256 ? 69.784 -10.275 27.091 1.00 49.78 ? 277 ASN A N 1 ATOM 1973 C CA . ASN A 1 256 ? 69.980 -11.453 26.241 1.00 49.65 ? 277 ASN A CA 1 ATOM 1974 C C . ASN A 1 256 ? 68.740 -12.284 25.925 1.00 40.78 ? 277 ASN A C 1 ATOM 1975 O O . ASN A 1 256 ? 68.850 -13.366 25.346 1.00 41.98 ? 277 ASN A O 1 ATOM 1976 C CB . ASN A 1 256 ? 71.091 -12.350 26.788 1.00 57.75 ? 277 ASN A CB 1 ATOM 1977 C CG . ASN A 1 256 ? 72.463 -11.837 26.442 1.00 69.44 ? 277 ASN A CG 1 ATOM 1978 O OD1 . ASN A 1 256 ? 73.253 -12.531 25.797 1.00 75.80 ? 277 ASN A OD1 1 ATOM 1979 N ND2 . ASN A 1 256 ? 72.752 -10.606 26.848 1.00 70.37 ? 277 ASN A ND2 1 ATOM 1980 N N . GLY A 1 257 ? 67.564 -11.790 26.299 1.00 29.46 ? 278 GLY A N 1 ATOM 1981 C CA . GLY A 1 257 ? 66.337 -12.467 25.923 1.00 35.12 ? 278 GLY A CA 1 ATOM 1982 C C . GLY A 1 257 ? 66.107 -12.414 24.413 1.00 37.10 ? 278 GLY A C 1 ATOM 1983 O O . GLY A 1 257 ? 65.331 -13.188 23.863 1.00 30.46 ? 278 GLY A O 1 ATOM 1984 N N . ILE A 1 258 ? 66.789 -11.497 23.738 1.00 32.15 ? 279 ILE A N 1 ATOM 1985 C CA . ILE A 1 258 ? 66.544 -11.274 22.325 1.00 39.26 ? 279 ILE A CA 1 ATOM 1986 C C . ILE A 1 258 ? 67.823 -11.252 21.496 1.00 44.71 ? 279 ILE A C 1 ATOM 1987 O O . ILE A 1 258 ? 68.784 -10.541 21.819 1.00 40.80 ? 279 ILE A O 1 ATOM 1988 C CB . ILE A 1 258 ? 65.758 -9.974 22.100 1.00 48.74 ? 279 ILE A CB 1 ATOM 1989 C CG1 . ILE A 1 258 ? 64.290 -10.184 22.464 1.00 50.99 ? 279 ILE A CG1 1 ATOM 1990 C CG2 . ILE A 1 258 ? 65.866 -9.530 20.655 1.00 53.35 ? 279 ILE A CG2 1 ATOM 1991 C CD1 . ILE A 1 258 ? 63.489 -8.915 22.496 1.00 58.46 ? 279 ILE A CD1 1 ATOM 1992 N N . LEU A 1 259 ? 67.828 -12.058 20.438 1.00 44.79 ? 280 LEU A N 1 ATOM 1993 C CA . LEU A 1 259 ? 68.888 -12.019 19.437 1.00 39.05 ? 280 LEU A CA 1 ATOM 1994 C C . LEU A 1 259 ? 68.328 -11.430 18.145 1.00 38.86 ? 280 LEU A C 1 ATOM 1995 O O . LEU A 1 259 ? 67.379 -11.961 17.557 1.00 40.27 ? 280 LEU A O 1 ATOM 1996 C CB . LEU A 1 259 ? 69.463 -13.414 19.189 1.00 38.41 ? 280 LEU A CB 1 ATOM 1997 C CG . LEU A 1 259 ? 70.563 -13.528 18.129 1.00 41.75 ? 280 LEU A CG 1 ATOM 1998 C CD1 . LEU A 1 259 ? 71.809 -12.811 18.593 1.00 42.28 ? 280 LEU A CD1 1 ATOM 1999 C CD2 . LEU A 1 259 ? 70.882 -14.985 17.806 1.00 34.14 ? 280 LEU A CD2 1 ATOM 2000 N N . GLU A 1 260 ? 68.902 -10.307 17.735 1.00 39.30 ? 281 GLU A N 1 ATOM 2001 C CA . GLU A 1 260 ? 68.548 -9.660 16.484 1.00 45.18 ? 281 GLU A CA 1 ATOM 2002 C C . GLU A 1 260 ? 69.570 -9.985 15.411 1.00 48.79 ? 281 GLU A C 1 ATOM 2003 O O . GLU A 1 260 ? 70.770 -9.810 15.614 1.00 48.85 ? 281 GLU A O 1 ATOM 2004 C CB . GLU A 1 260 ? 68.493 -8.148 16.665 1.00 51.03 ? 281 GLU A CB 1 ATOM 2005 C CG . GLU A 1 260 ? 67.102 -7.573 16.689 1.00 67.44 ? 281 GLU A CG 1 ATOM 2006 C CD . GLU A 1 260 ? 67.118 -6.063 16.612 1.00 84.87 ? 281 GLU A CD 1 ATOM 2007 O OE1 . GLU A 1 260 ? 67.998 -5.515 15.910 1.00 90.06 ? 281 GLU A OE1 1 ATOM 2008 O OE2 . GLU A 1 260 ? 66.258 -5.423 17.255 1.00 89.82 ? 281 GLU A OE2 1 ATOM 2009 N N . ILE A 1 261 ? 69.096 -10.462 14.267 1.00 54.52 ? 282 ILE A N 1 ATOM 2010 C CA . ILE A 1 261 ? 69.967 -10.642 13.106 1.00 52.88 ? 282 ILE A CA 1 ATOM 2011 C C . ILE A 1 261 ? 69.490 -9.731 11.982 1.00 48.90 ? 282 ILE A C 1 ATOM 2012 O O . ILE A 1 261 ? 68.466 -10.002 11.353 1.00 43.79 ? 282 ILE A O 1 ATOM 2013 C CB . ILE A 1 261 ? 69.981 -12.089 12.637 1.00 45.57 ? 282 ILE A CB 1 ATOM 2014 C CG1 . ILE A 1 261 ? 70.229 -13.007 13.836 1.00 40.93 ? 282 ILE A CG1 1 ATOM 2015 C CG2 . ILE A 1 261 ? 71.050 -12.292 11.566 1.00 43.51 ? 282 ILE A CG2 1 ATOM 2016 C CD1 . ILE A 1 261 ? 69.766 -14.421 13.628 1.00 40.53 ? 282 ILE A CD1 1 ATOM 2017 N N . PRO A 1 262 ? 70.222 -8.632 11.752 1.00 55.52 ? 283 PRO A N 1 ATOM 2018 C CA . PRO A 1 262 ? 69.888 -7.620 10.745 1.00 58.24 ? 283 PRO A CA 1 ATOM 2019 C C . PRO A 1 262 ? 70.247 -8.130 9.357 1.00 56.14 ? 283 PRO A C 1 ATOM 2020 O O . PRO A 1 262 ? 71.113 -8.999 9.257 1.00 52.22 ? 283 PRO A O 1 ATOM 2021 C CB . PRO A 1 262 ? 70.804 -6.438 11.107 1.00 57.71 ? 283 PRO A CB 1 ATOM 2022 C CG . PRO A 1 262 ? 71.562 -6.842 12.345 1.00 62.37 ? 283 PRO A CG 1 ATOM 2023 C CD . PRO A 1 262 ? 71.494 -8.332 12.428 1.00 62.95 ? 283 PRO A CD 1 ATOM 2024 N N . ASN A 1 263 ? 69.595 -7.609 8.319 1.00 59.32 ? 284 ASN A N 1 ATOM 2025 C CA . ASN A 1 263 ? 69.939 -7.943 6.934 1.00 59.87 ? 284 ASN A CA 1 ATOM 2026 C C . ASN A 1 263 ? 70.269 -9.419 6.745 1.00 53.87 ? 284 ASN A C 1 ATOM 2027 O O . ASN A 1 263 ? 71.405 -9.765 6.440 1.00 51.96 ? 284 ASN A O 1 ATOM 2028 C CB . ASN A 1 263 ? 71.127 -7.098 6.472 1.00 64.90 ? 284 ASN A CB 1 ATOM 2029 C CG . ASN A 1 263 ? 71.387 -7.215 4.981 1.00 71.97 ? 284 ASN A CG 1 ATOM 2030 O OD1 . ASN A 1 263 ? 72.532 -7.354 4.546 1.00 70.23 ? 284 ASN A OD1 1 ATOM 2031 N ND2 . ASN A 1 263 ? 70.322 -7.158 4.190 1.00 75.39 ? 284 ASN A ND2 1 ATOM 2032 N N . PHE A 1 264 ? 69.275 -10.279 6.941 1.00 53.78 ? 285 PHE A N 1 ATOM 2033 C CA . PHE A 1 264 ? 69.464 -11.731 6.913 1.00 52.88 ? 285 PHE A CA 1 ATOM 2034 C C . PHE A 1 264 ? 69.932 -12.237 5.543 1.00 57.10 ? 285 PHE A C 1 ATOM 2035 O O . PHE A 1 264 ? 69.425 -11.817 4.503 1.00 54.29 ? 285 PHE A O 1 ATOM 2036 C CB . PHE A 1 264 ? 68.150 -12.414 7.307 1.00 55.36 ? 285 PHE A CB 1 ATOM 2037 C CG . PHE A 1 264 ? 68.298 -13.856 7.706 1.00 55.69 ? 285 PHE A CG 1 ATOM 2038 C CD1 . PHE A 1 264 ? 68.674 -14.196 8.994 1.00 52.28 ? 285 PHE A CD1 1 ATOM 2039 C CD2 . PHE A 1 264 ? 68.031 -14.870 6.803 1.00 59.04 ? 285 PHE A CD2 1 ATOM 2040 C CE1 . PHE A 1 264 ? 68.798 -15.517 9.370 1.00 55.13 ? 285 PHE A CE1 1 ATOM 2041 C CE2 . PHE A 1 264 ? 68.158 -16.196 7.172 1.00 57.59 ? 285 PHE A CE2 1 ATOM 2042 C CZ . PHE A 1 264 ? 68.543 -16.520 8.455 1.00 58.65 ? 285 PHE A CZ 1 ATOM 2043 N N . GLN A 1 265 ? 70.898 -13.143 5.544 1.00 55.48 ? 286 GLN A N 1 ATOM 2044 C CA . GLN A 1 265 ? 71.419 -13.689 4.300 1.00 50.40 ? 286 GLN A CA 1 ATOM 2045 C C . GLN A 1 265 ? 71.590 -15.197 4.431 1.00 56.50 ? 286 GLN A C 1 ATOM 2046 O O . GLN A 1 265 ? 71.534 -15.744 5.527 1.00 51.70 ? 286 GLN A O 1 ATOM 2047 C CB . GLN A 1 265 ? 72.747 -13.026 3.925 1.00 48.89 ? 286 GLN A CB 1 ATOM 2048 C CG . GLN A 1 265 ? 72.665 -11.507 3.732 1.00 62.57 ? 286 GLN A CG 1 ATOM 2049 C CD . GLN A 1 265 ? 71.641 -11.078 2.680 1.00 70.66 ? 286 GLN A CD 1 ATOM 2050 O OE1 . GLN A 1 265 ? 71.486 -11.719 1.635 1.00 66.92 ? 286 GLN A OE1 1 ATOM 2051 N NE2 . GLN A 1 265 ? 70.943 -9.982 2.955 1.00 71.24 ? 286 GLN A NE2 1 ATOM 2052 N N . GLN A 1 266 ? 71.794 -15.865 3.305 1.00 63.46 ? 287 GLN A N 1 ATOM 2053 C CA . GLN A 1 266 ? 71.889 -17.316 3.277 1.00 64.46 ? 287 GLN A CA 1 ATOM 2054 C C . GLN A 1 266 ? 72.858 -17.866 4.320 1.00 54.02 ? 287 GLN A C 1 ATOM 2055 O O . GLN A 1 266 ? 72.624 -18.930 4.897 1.00 58.78 ? 287 GLN A O 1 ATOM 2056 C CB . GLN A 1 266 ? 72.307 -17.779 1.877 1.00 78.43 ? 287 GLN A CB 1 ATOM 2057 C CG . GLN A 1 266 ? 72.543 -19.276 1.735 1.00 89.48 ? 287 GLN A CG 1 ATOM 2058 C CD . GLN A 1 266 ? 71.270 -20.097 1.867 1.00 98.97 ? 287 GLN A CD 1 ATOM 2059 O OE1 . GLN A 1 266 ? 70.765 -20.641 0.884 1.00 101.91 ? 287 GLN A OE1 1 ATOM 2060 N NE2 . GLN A 1 266 ? 70.746 -20.191 3.087 1.00 101.32 ? 287 GLN A NE2 1 ATOM 2061 N N . GLU A 1 267 ? 73.951 -17.147 4.552 1.00 53.90 ? 288 GLU A N 1 ATOM 2062 C CA . GLU A 1 267 ? 75.016 -17.646 5.420 1.00 62.17 ? 288 GLU A CA 1 ATOM 2063 C C . GLU A 1 267 ? 74.545 -17.702 6.869 1.00 61.40 ? 288 GLU A C 1 ATOM 2064 O O . GLU A 1 267 ? 75.108 -18.434 7.679 1.00 65.37 ? 288 GLU A O 1 ATOM 2065 C CB . GLU A 1 267 ? 76.281 -16.780 5.312 1.00 66.47 ? 288 GLU A CB 1 ATOM 2066 C CG . GLU A 1 267 ? 76.646 -16.354 3.887 1.00 82.04 ? 288 GLU A CG 1 ATOM 2067 C CD . GLU A 1 267 ? 75.918 -15.093 3.451 1.00 88.43 ? 288 GLU A CD 1 ATOM 2068 O OE1 . GLU A 1 267 ? 76.037 -14.059 4.149 1.00 86.71 ? 288 GLU A OE1 1 ATOM 2069 O OE2 . GLU A 1 267 ? 75.227 -15.133 2.411 1.00 91.32 ? 288 GLU A OE2 1 ATOM 2070 N N . ASP A 1 268 ? 73.505 -16.927 7.171 1.00 56.66 ? 289 ASP A N 1 ATOM 2071 C CA . ASP A 1 268 ? 72.973 -16.796 8.522 1.00 55.35 ? 289 ASP A CA 1 ATOM 2072 C C . ASP A 1 268 ? 71.925 -17.854 8.824 1.00 57.29 ? 289 ASP A C 1 ATOM 2073 O O . ASP A 1 268 ? 71.435 -17.944 9.948 1.00 55.18 ? 289 ASP A O 1 ATOM 2074 C CB . ASP A 1 268 ? 72.331 -15.424 8.705 1.00 50.92 ? 289 ASP A CB 1 ATOM 2075 C CG . ASP A 1 268 ? 73.294 -14.291 8.465 1.00 60.92 ? 289 ASP A CG 1 ATOM 2076 O OD1 . ASP A 1 268 ? 74.512 -14.492 8.658 1.00 70.63 ? 289 ASP A OD1 1 ATOM 2077 O OD2 . ASP A 1 268 ? 72.827 -13.196 8.088 1.00 60.32 ? 289 ASP A OD2 1 ATOM 2078 N N . ALA A 1 269 ? 71.555 -18.639 7.821 1.00 53.05 ? 290 ALA A N 1 ATOM 2079 C CA . ALA A 1 269 ? 70.539 -19.655 8.033 1.00 44.99 ? 290 ALA A CA 1 ATOM 2080 C C . ALA A 1 269 ? 71.114 -20.830 8.816 1.00 43.52 ? 290 ALA A C 1 ATOM 2081 O O . ALA A 1 269 ? 72.328 -21.046 8.842 1.00 41.17 ? 290 ALA A O 1 ATOM 2082 C CB . ALA A 1 269 ? 69.965 -20.116 6.712 1.00 43.86 ? 290 ALA A CB 1 ATOM 2083 N N . GLY A 1 270 ? 70.242 -21.584 9.471 1.00 41.15 ? 291 GLY A N 1 ATOM 2084 C CA . GLY A 1 270 ? 70.685 -22.782 10.153 1.00 38.23 ? 291 GLY A CA 1 ATOM 2085 C C . GLY A 1 270 ? 69.993 -23.013 11.476 1.00 37.88 ? 291 GLY A C 1 ATOM 2086 O O . GLY A 1 270 ? 69.022 -22.333 11.811 1.00 35.21 ? 291 GLY A O 1 ATOM 2087 N N . SER A 1 271 ? 70.497 -23.992 12.219 1.00 40.16 ? 292 SER A N 1 ATOM 2088 C CA . SER A 1 271 ? 69.961 -24.329 13.527 1.00 43.26 ? 292 SER A CA 1 ATOM 2089 C C . SER A 1 271 ? 70.523 -23.394 14.591 1.00 35.68 ? 292 SER A C 1 ATOM 2090 O O . SER A 1 271 ? 71.741 -23.307 14.754 1.00 35.36 ? 292 SER A O 1 ATOM 2091 C CB . SER A 1 271 ? 70.302 -25.774 13.873 1.00 47.03 ? 292 SER A CB 1 ATOM 2092 O OG . SER A 1 271 ? 69.780 -26.117 15.142 1.00 56.45 ? 292 SER A OG 1 ATOM 2093 N N . TYR A 1 272 ? 69.637 -22.686 15.294 1.00 29.29 ? 293 TYR A N 1 ATOM 2094 C CA . TYR A 1 272 ? 70.046 -21.780 16.382 1.00 32.08 ? 293 TYR A CA 1 ATOM 2095 C C . TYR A 1 272 ? 69.597 -22.301 17.734 1.00 35.60 ? 293 TYR A C 1 ATOM 2096 O O . TYR A 1 272 ? 68.512 -22.867 17.867 1.00 30.40 ? 293 TYR A O 1 ATOM 2097 C CB . TYR A 1 272 ? 69.485 -20.371 16.191 1.00 33.43 ? 293 TYR A CB 1 ATOM 2098 C CG . TYR A 1 272 ? 70.275 -19.519 15.224 1.00 39.92 ? 293 TYR A CG 1 ATOM 2099 C CD1 . TYR A 1 272 ? 70.249 -19.779 13.852 1.00 46.34 ? 293 TYR A CD1 1 ATOM 2100 C CD2 . TYR A 1 272 ? 71.039 -18.453 15.673 1.00 33.13 ? 293 TYR A CD2 1 ATOM 2101 C CE1 . TYR A 1 272 ? 70.972 -19.004 12.956 1.00 41.71 ? 293 TYR A CE1 1 ATOM 2102 C CE2 . TYR A 1 272 ? 71.769 -17.671 14.786 1.00 36.13 ? 293 TYR A CE2 1 ATOM 2103 C CZ . TYR A 1 272 ? 71.728 -17.954 13.427 1.00 40.66 ? 293 TYR A CZ 1 ATOM 2104 O OH . TYR A 1 272 ? 72.442 -17.178 12.547 1.00 42.54 ? 293 TYR A OH 1 ATOM 2105 N N . GLU A 1 273 ? 70.431 -22.098 18.744 1.00 36.69 ? 294 GLU A N 1 ATOM 2106 C CA . GLU A 1 273 ? 70.085 -22.540 20.080 1.00 30.13 ? 294 GLU A CA 1 ATOM 2107 C C . GLU A 1 273 ? 70.158 -21.416 21.086 1.00 33.12 ? 294 GLU A C 1 ATOM 2108 O O . GLU A 1 273 ? 71.017 -20.536 20.993 1.00 35.18 ? 294 GLU A O 1 ATOM 2109 C CB . GLU A 1 273 ? 70.995 -23.679 20.519 1.00 30.13 ? 294 GLU A CB 1 ATOM 2110 C CG . GLU A 1 273 ? 70.572 -25.032 20.017 1.00 32.85 ? 294 GLU A CG 1 ATOM 2111 C CD . GLU A 1 273 ? 71.542 -26.102 20.444 1.00 44.75 ? 294 GLU A CD 1 ATOM 2112 O OE1 . GLU A 1 273 ? 72.614 -25.731 20.972 1.00 48.67 ? 294 GLU A OE1 1 ATOM 2113 O OE2 . GLU A 1 273 ? 71.239 -27.300 20.254 1.00 50.72 ? 294 GLU A OE2 1 ATOM 2114 N N . CYS A 1 274 ? 69.245 -21.437 22.048 1.00 32.93 ? 295 CYS A N 1 ATOM 2115 C CA . CYS A 1 274 ? 69.428 -20.611 23.231 1.00 40.27 ? 295 CYS A CA 1 ATOM 2116 C C . CYS A 1 274 ? 69.587 -21.501 24.459 1.00 36.96 ? 295 CYS A C 1 ATOM 2117 O O . CYS A 1 274 ? 68.954 -22.556 24.573 1.00 28.31 ? 295 CYS A O 1 ATOM 2118 C CB . CYS A 1 274 ? 68.313 -19.578 23.395 1.00 47.77 ? 295 CYS A CB 1 ATOM 2119 S SG . CYS A 1 274 ? 66.757 -20.212 23.973 1.00 67.03 ? 295 CYS A SG 1 ATOM 2120 N N . VAL A 1 275 ? 70.476 -21.084 25.351 1.00 38.85 ? 296 VAL A N 1 ATOM 2121 C CA . VAL A 1 275 ? 70.838 -21.872 26.518 1.00 38.05 ? 296 VAL A CA 1 ATOM 2122 C C . VAL A 1 275 ? 70.488 -21.120 27.801 1.00 37.28 ? 296 VAL A C 1 ATOM 2123 O O . VAL A 1 275 ? 70.936 -19.987 28.010 1.00 31.62 ? 296 VAL A O 1 ATOM 2124 C CB . VAL A 1 275 ? 72.346 -22.178 26.515 1.00 40.09 ? 296 VAL A CB 1 ATOM 2125 C CG1 . VAL A 1 275 ? 72.743 -22.969 27.757 1.00 40.46 ? 296 VAL A CG1 1 ATOM 2126 C CG2 . VAL A 1 275 ? 72.726 -22.917 25.252 1.00 37.66 ? 296 VAL A CG2 1 ATOM 2127 N N . ALA A 1 276 ? 69.672 -21.741 28.645 1.00 32.25 ? 297 ALA A N 1 ATOM 2128 C CA . ALA A 1 276 ? 69.323 -21.145 29.929 1.00 27.98 ? 297 ALA A CA 1 ATOM 2129 C C . ALA A 1 276 ? 70.025 -21.903 31.047 1.00 27.30 ? 297 ALA A C 1 ATOM 2130 O O . ALA A 1 276 ? 69.896 -23.121 31.177 1.00 27.17 ? 297 ALA A O 1 ATOM 2131 C CB . ALA A 1 276 ? 67.817 -21.157 30.141 1.00 25.51 ? 297 ALA A CB 1 ATOM 2132 N N . GLU A 1 277 ? 70.771 -21.176 31.856 1.00 22.58 ? 298 GLU A N 1 ATOM 2133 C CA . GLU A 1 277 ? 71.561 -21.819 32.886 1.00 33.44 ? 298 GLU A CA 1 ATOM 2134 C C . GLU A 1 277 ? 71.422 -21.114 34.218 1.00 29.86 ? 298 GLU A C 1 ATOM 2135 O O . GLU A 1 277 ? 71.397 -19.881 34.292 1.00 24.53 ? 298 GLU A O 1 ATOM 2136 C CB . GLU A 1 277 ? 73.032 -21.867 32.477 1.00 33.57 ? 298 GLU A CB 1 ATOM 2137 C CG . GLU A 1 277 ? 73.889 -22.719 33.393 1.00 54.29 ? 298 GLU A CG 1 ATOM 2138 C CD . GLU A 1 277 ? 75.278 -22.979 32.830 1.00 71.65 ? 298 GLU A CD 1 ATOM 2139 O OE1 . GLU A 1 277 ? 75.737 -22.188 31.979 1.00 76.31 ? 298 GLU A OE1 1 ATOM 2140 O OE2 . GLU A 1 277 ? 75.908 -23.977 33.243 1.00 78.68 ? 298 GLU A OE2 1 ATOM 2141 N N . ASN A 1 278 ? 71.302 -21.918 35.264 1.00 26.86 ? 299 ASN A N 1 ATOM 2142 C CA . ASN A 1 278 ? 71.557 -21.451 36.612 1.00 26.23 ? 299 ASN A CA 1 ATOM 2143 C C . ASN A 1 278 ? 72.349 -22.518 37.380 1.00 42.07 ? 299 ASN A C 1 ATOM 2144 O O . ASN A 1 278 ? 72.793 -23.514 36.786 1.00 38.55 ? 299 ASN A O 1 ATOM 2145 C CB . ASN A 1 278 ? 70.266 -21.006 37.326 1.00 24.67 ? 299 ASN A CB 1 ATOM 2146 C CG . ASN A 1 278 ? 69.314 -22.148 37.624 1.00 27.70 ? 299 ASN A CG 1 ATOM 2147 O OD1 . ASN A 1 278 ? 69.651 -23.315 37.466 1.00 26.06 ? 299 ASN A OD1 1 ATOM 2148 N ND2 . ASN A 1 278 ? 68.110 -21.805 38.087 1.00 20.03 ? 299 ASN A ND2 1 ATOM 2149 N N . SER A 1 279 ? 72.543 -22.309 38.681 1.00 42.26 ? 300 SER A N 1 ATOM 2150 C CA . SER A 1 279 ? 73.380 -23.204 39.489 1.00 45.13 ? 300 SER A CA 1 ATOM 2151 C C . SER A 1 279 ? 72.843 -24.628 39.565 1.00 37.13 ? 300 SER A C 1 ATOM 2152 O O . SER A 1 279 ? 73.559 -25.551 39.946 1.00 42.04 ? 300 SER A O 1 ATOM 2153 C CB . SER A 1 279 ? 73.532 -22.651 40.907 1.00 46.03 ? 300 SER A CB 1 ATOM 2154 O OG . SER A 1 279 ? 72.260 -22.485 41.499 1.00 45.91 ? 300 SER A OG 1 ATOM 2155 N N . ARG A 1 280 ? 71.580 -24.797 39.202 1.00 30.11 ? 301 ARG A N 1 ATOM 2156 C CA . ARG A 1 280 ? 70.896 -26.073 39.364 1.00 30.32 ? 301 ARG A CA 1 ATOM 2157 C C . ARG A 1 280 ? 70.864 -26.867 38.046 1.00 34.60 ? 301 ARG A C 1 ATOM 2158 O O . ARG A 1 280 ? 70.380 -27.996 37.990 1.00 36.38 ? 301 ARG A O 1 ATOM 2159 C CB . ARG A 1 280 ? 69.481 -25.813 39.890 1.00 37.79 ? 301 ARG A CB 1 ATOM 2160 C CG . ARG A 1 280 ? 68.787 -27.006 40.496 1.00 60.83 ? 301 ARG A CG 1 ATOM 2161 C CD . ARG A 1 280 ? 69.335 -27.340 41.882 1.00 65.85 ? 301 ARG A CD 1 ATOM 2162 N NE . ARG A 1 280 ? 69.950 -26.186 42.534 1.00 54.80 ? 301 ARG A NE 1 ATOM 2163 C CZ . ARG A 1 280 ? 71.163 -26.202 43.083 1.00 57.11 ? 301 ARG A CZ 1 ATOM 2164 N NH1 . ARG A 1 280 ? 71.898 -27.312 43.073 1.00 52.05 ? 301 ARG A NH1 1 ATOM 2165 N NH2 . ARG A 1 280 ? 71.642 -25.107 43.649 1.00 63.47 ? 301 ARG A NH2 1 ATOM 2166 N N . GLY A 1 281 ? 71.391 -26.280 36.981 1.00 29.21 ? 302 GLY A N 1 ATOM 2167 C CA . GLY A 1 281 ? 71.398 -26.969 35.704 1.00 36.77 ? 302 GLY A CA 1 ATOM 2168 C C . GLY A 1 281 ? 71.127 -26.074 34.510 1.00 39.91 ? 302 GLY A C 1 ATOM 2169 O O . GLY A 1 281 ? 71.213 -24.842 34.584 1.00 35.57 ? 302 GLY A O 1 ATOM 2170 N N . LYS A 1 282 ? 70.798 -26.699 33.390 1.00 39.23 ? 303 LYS A N 1 ATOM 2171 C CA . LYS A 1 282 ? 70.619 -25.947 32.165 1.00 36.76 ? 303 LYS A CA 1 ATOM 2172 C C . LYS A 1 282 ? 69.553 -26.531 31.235 1.00 36.60 ? 303 LYS A C 1 ATOM 2173 O O . LYS A 1 282 ? 69.257 -27.725 31.263 1.00 36.53 ? 303 LYS A O 1 ATOM 2174 C CB . LYS A 1 282 ? 71.958 -25.797 31.447 1.00 42.31 ? 303 LYS A CB 1 ATOM 2175 C CG . LYS A 1 282 ? 72.318 -26.956 30.560 1.00 57.02 ? 303 LYS A CG 1 ATOM 2176 C CD . LYS A 1 282 ? 73.780 -26.876 30.172 1.00 70.43 ? 303 LYS A CD 1 ATOM 2177 C CE . LYS A 1 282 ? 74.203 -25.435 29.921 1.00 75.15 ? 303 LYS A CE 1 ATOM 2178 N NZ . LYS A 1 282 ? 75.679 -25.304 29.791 1.00 76.13 ? 303 LYS A NZ 1 ATOM 2179 N N . ASN A 1 283 ? 68.974 -25.657 30.421 1.00 27.85 ? 304 ASN A N 1 ATOM 2180 C CA . ASN A 1 283 ? 67.897 -26.022 29.517 1.00 27.36 ? 304 ASN A CA 1 ATOM 2181 C C . ASN A 1 283 ? 68.209 -25.421 28.137 1.00 29.79 ? 304 ASN A C 1 ATOM 2182 O O . ASN A 1 283 ? 68.678 -24.280 28.037 1.00 25.96 ? 304 ASN A O 1 ATOM 2183 C CB . ASN A 1 283 ? 66.568 -25.494 30.067 1.00 23.15 ? 304 ASN A CB 1 ATOM 2184 C CG . ASN A 1 283 ? 65.359 -26.192 29.464 1.00 41.30 ? 304 ASN A CG 1 ATOM 2185 O OD1 . ASN A 1 283 ? 65.397 -27.387 29.183 1.00 54.18 ? 304 ASN A OD1 1 ATOM 2186 N ND2 . ASN A 1 283 ? 64.273 -25.442 29.269 1.00 33.62 ? 304 ASN A ND2 1 ATOM 2187 N N . VAL A 1 284 ? 67.970 -26.196 27.084 1.00 37.62 ? 305 VAL A N 1 ATOM 2188 C CA . VAL A 1 284 ? 68.287 -25.767 25.722 1.00 33.85 ? 305 VAL A CA 1 ATOM 2189 C C . VAL A 1 284 ? 67.072 -25.761 24.797 1.00 35.45 ? 305 VAL A C 1 ATOM 2190 O O . VAL A 1 284 ? 66.344 -26.741 24.713 1.00 37.52 ? 305 VAL A O 1 ATOM 2191 C CB . VAL A 1 284 ? 69.379 -26.649 25.111 1.00 38.72 ? 305 VAL A CB 1 ATOM 2192 C CG1 . VAL A 1 284 ? 69.694 -26.200 23.688 1.00 38.56 ? 305 VAL A CG1 1 ATOM 2193 C CG2 . VAL A 1 284 ? 70.622 -26.596 25.979 1.00 35.45 ? 305 VAL A CG2 1 ATOM 2194 N N . ALA A 1 285 ? 66.866 -24.642 24.108 1.00 39.28 ? 306 ALA A N 1 ATOM 2195 C CA . ALA A 1 285 ? 65.827 -24.528 23.090 1.00 33.07 ? 306 ALA A CA 1 ATOM 2196 C C . ALA A 1 285 ? 66.492 -24.376 21.732 1.00 42.09 ? 306 ALA A C 1 ATOM 2197 O O . ALA A 1 285 ? 67.462 -23.630 21.589 1.00 40.89 ? 306 ALA A O 1 ATOM 2198 C CB . ALA A 1 285 ? 64.941 -23.327 23.362 1.00 27.44 ? 306 ALA A CB 1 ATOM 2199 N N . LYS A 1 286 ? 65.972 -25.074 20.729 1.00 37.91 ? 307 LYS A N 1 ATOM 2200 C CA . LYS A 1 286 ? 66.528 -24.946 19.397 1.00 43.31 ? 307 LYS A CA 1 ATOM 2201 C C . LYS A 1 286 ? 65.460 -24.802 18.310 1.00 42.60 ? 307 LYS A C 1 ATOM 2202 O O . LYS A 1 286 ? 64.332 -25.273 18.455 1.00 40.41 ? 307 LYS A O 1 ATOM 2203 C CB . LYS A 1 286 ? 67.482 -26.102 19.092 1.00 41.66 ? 307 LYS A CB 1 ATOM 2204 C CG . LYS A 1 286 ? 66.812 -27.434 18.903 1.00 49.13 ? 307 LYS A CG 1 ATOM 2205 C CD . LYS A 1 286 ? 67.840 -28.489 18.547 1.00 57.58 ? 307 LYS A CD 1 ATOM 2206 C CE . LYS A 1 286 ? 68.782 -28.008 17.445 1.00 57.52 ? 307 LYS A CE 1 ATOM 2207 N NZ . LYS A 1 286 ? 69.731 -29.086 17.046 1.00 58.20 ? 307 LYS A NZ 1 ATOM 2208 N N . GLY A 1 287 ? 65.836 -24.129 17.229 1.00 36.34 ? 308 GLY A N 1 ATOM 2209 C CA . GLY A 1 287 ? 64.959 -23.942 16.090 1.00 43.82 ? 308 GLY A CA 1 ATOM 2210 C C . GLY A 1 287 ? 65.753 -23.674 14.826 1.00 43.82 ? 308 GLY A C 1 ATOM 2211 O O . GLY A 1 287 ? 66.935 -23.321 14.882 1.00 39.48 ? 308 GLY A O 1 ATOM 2212 N N . GLN A 1 288 ? 65.093 -23.841 13.683 1.00 43.06 ? 309 GLN A N 1 ATOM 2213 C CA . GLN A 1 288 ? 65.731 -23.699 12.379 1.00 39.09 ? 309 GLN A CA 1 ATOM 2214 C C . GLN A 1 288 ? 65.348 -22.385 11.692 1.00 42.58 ? 309 GLN A C 1 ATOM 2215 O O . GLN A 1 288 ? 64.189 -22.169 11.340 1.00 48.78 ? 309 GLN A O 1 ATOM 2216 C CB . GLN A 1 288 ? 65.339 -24.876 11.491 1.00 40.46 ? 309 GLN A CB 1 ATOM 2217 C CG . GLN A 1 288 ? 66.044 -24.909 10.137 1.00 54.95 ? 309 GLN A CG 1 ATOM 2218 C CD . GLN A 1 288 ? 67.439 -25.504 10.217 1.00 59.25 ? 309 GLN A CD 1 ATOM 2219 O OE1 . GLN A 1 288 ? 67.760 -26.239 11.150 1.00 62.68 ? 309 GLN A OE1 1 ATOM 2220 N NE2 . GLN A 1 288 ? 68.271 -25.195 9.230 1.00 58.35 ? 309 GLN A NE2 1 ATOM 2221 N N . LEU A 1 289 ? 66.326 -21.504 11.516 1.00 38.81 ? 310 LEU A N 1 ATOM 2222 C CA . LEU A 1 289 ? 66.132 -20.298 10.721 1.00 39.37 ? 310 LEU A CA 1 ATOM 2223 C C . LEU A 1 289 ? 66.253 -20.686 9.241 1.00 41.16 ? 310 LEU A C 1 ATOM 2224 O O . LEU A 1 289 ? 67.341 -20.999 8.768 1.00 35.97 ? 310 LEU A O 1 ATOM 2225 C CB . LEU A 1 289 ? 67.178 -19.241 11.086 1.00 37.46 ? 310 LEU A CB 1 ATOM 2226 C CG . LEU A 1 289 ? 67.097 -18.563 12.463 1.00 43.20 ? 310 LEU A CG 1 ATOM 2227 C CD1 . LEU A 1 289 ? 66.701 -17.108 12.362 1.00 42.93 ? 310 LEU A CD1 1 ATOM 2228 C CD2 . LEU A 1 289 ? 66.153 -19.303 13.400 1.00 40.31 ? 310 LEU A CD2 1 ATOM 2229 N N . THR A 1 290 ? 65.125 -20.695 8.533 1.00 39.65 ? 311 THR A N 1 ATOM 2230 C CA . THR A 1 290 ? 65.078 -21.114 7.135 1.00 49.82 ? 311 THR A CA 1 ATOM 2231 C C . THR A 1 290 ? 64.968 -19.922 6.191 1.00 48.19 ? 311 THR A C 1 ATOM 2232 O O . THR A 1 290 ? 63.997 -19.170 6.239 1.00 47.78 ? 311 THR A O 1 ATOM 2233 C CB . THR A 1 290 ? 63.898 -22.050 6.876 1.00 59.62 ? 311 THR A CB 1 ATOM 2234 O OG1 . THR A 1 290 ? 64.160 -23.324 7.473 1.00 63.48 ? 311 THR A OG1 1 ATOM 2235 C CG2 . THR A 1 290 ? 63.697 -22.235 5.381 1.00 66.95 ? 311 THR A CG2 1 ATOM 2236 N N . PHE A 1 291 ? 65.978 -19.764 5.341 1.00 46.14 ? 312 PHE A N 1 ATOM 2237 C CA . PHE A 1 291 ? 66.077 -18.623 4.425 1.00 55.34 ? 312 PHE A CA 1 ATOM 2238 C C . PHE A 1 291 ? 65.073 -18.709 3.268 1.00 54.12 ? 312 PHE A C 1 ATOM 2239 O O . PHE A 1 291 ? 64.942 -19.754 2.630 1.00 56.49 ? 312 PHE A O 1 ATOM 2240 C CB . PHE A 1 291 ? 67.514 -18.529 3.888 1.00 54.40 ? 312 PHE A CB 1 ATOM 2241 C CG . PHE A 1 291 ? 67.724 -17.453 2.852 1.00 59.35 ? 312 PHE A CG 1 ATOM 2242 C CD1 . PHE A 1 291 ? 68.132 -16.182 3.224 1.00 55.41 ? 312 PHE A CD1 1 ATOM 2243 C CD2 . PHE A 1 291 ? 67.546 -17.724 1.501 1.00 69.69 ? 312 PHE A CD2 1 ATOM 2244 C CE1 . PHE A 1 291 ? 68.340 -15.193 2.273 1.00 56.87 ? 312 PHE A CE1 1 ATOM 2245 C CE2 . PHE A 1 291 ? 67.748 -16.738 0.544 1.00 71.53 ? 312 PHE A CE2 1 ATOM 2246 C CZ . PHE A 1 291 ? 68.147 -15.472 0.933 1.00 66.58 ? 312 PHE A CZ 1 ATOM 2247 N N . TYR A 1 292 ? 64.357 -17.617 3.012 1.00 50.32 ? 313 TYR A N 1 ATOM 2248 C CA . TYR A 1 292 ? 63.515 -17.523 1.814 1.00 57.97 ? 313 TYR A CA 1 ATOM 2249 C C . TYR A 1 292 ? 63.550 -16.131 1.174 1.00 61.61 ? 313 TYR A C 1 ATOM 2250 O O . TYR A 1 292 ? 63.878 -15.144 1.835 1.00 65.99 ? 313 TYR A O 1 ATOM 2251 C CB . TYR A 1 292 ? 62.072 -17.936 2.109 1.00 53.73 ? 313 TYR A CB 1 ATOM 2252 C CG . TYR A 1 292 ? 61.234 -16.877 2.787 1.00 55.92 ? 313 TYR A CG 1 ATOM 2253 C CD1 . TYR A 1 292 ? 61.087 -16.859 4.172 1.00 59.51 ? 313 TYR A CD1 1 ATOM 2254 C CD2 . TYR A 1 292 ? 60.577 -15.904 2.047 1.00 53.34 ? 313 TYR A CD2 1 ATOM 2255 C CE1 . TYR A 1 292 ? 60.315 -15.899 4.799 1.00 56.43 ? 313 TYR A CE1 1 ATOM 2256 C CE2 . TYR A 1 292 ? 59.802 -14.935 2.666 1.00 56.52 ? 313 TYR A CE2 1 ATOM 2257 C CZ . TYR A 1 292 ? 59.671 -14.939 4.040 1.00 62.10 ? 313 TYR A CZ 1 ATOM 2258 O OH . TYR A 1 292 ? 58.902 -13.980 4.666 1.00 67.56 ? 313 TYR A OH 1 ATOM 2259 N N . ALA A 1 293 ? 63.204 -16.066 -0.110 1.00 57.27 ? 314 ALA A N 1 ATOM 2260 C CA . ALA A 1 293 ? 63.228 -14.815 -0.879 1.00 59.65 ? 314 ALA A CA 1 ATOM 2261 C C . ALA A 1 293 ? 62.092 -14.756 -1.891 1.00 63.64 ? 314 ALA A C 1 ATOM 2262 O O . ALA A 1 293 ? 61.856 -15.717 -2.627 1.00 63.10 ? 314 ALA A O 1 ATOM 2263 C CB . ALA A 1 293 ? 64.572 -14.658 -1.610 1.00 53.08 ? 314 ALA A CB 1 ATOM 2264 N N . GLN A 1 294 ? 61.401 -13.623 -1.944 1.00 52.76 ? 315 GLN A N 1 ATOM 2265 C CA . GLN A 1 294 ? 60.398 -13.403 -2.985 1.00 57.57 ? 315 GLN A CA 1 ATOM 2266 C C . GLN A 1 294 ? 61.049 -13.372 -4.372 1.00 45.88 ? 315 GLN A C 1 ATOM 2267 O O . GLN A 1 294 ? 62.234 -13.062 -4.498 1.00 45.98 ? 315 GLN A O 1 ATOM 2268 C CB . GLN A 1 294 ? 59.649 -12.097 -2.743 1.00 64.52 ? 315 GLN A CB 1 ATOM 2269 C CG . GLN A 1 294 ? 59.214 -11.878 -1.314 1.00 73.62 ? 315 GLN A CG 1 ATOM 2270 C CD . GLN A 1 294 ? 58.053 -10.914 -1.223 1.00 83.15 ? 315 GLN A CD 1 ATOM 2271 O OE1 . GLN A 1 294 ? 57.049 -11.072 -1.919 1.00 90.16 ? 315 GLN A OE1 1 ATOM 2272 N NE2 . GLN A 1 294 ? 58.181 -9.906 -0.367 1.00 81.39 ? 315 GLN A NE2 1 ATOM 2273 N N . PRO A 1 295 ? 60.274 -13.696 -5.420 1.00 40.29 ? 316 PRO A N 1 ATOM 2274 C CA . PRO A 1 295 ? 60.835 -13.710 -6.774 1.00 43.00 ? 316 PRO A CA 1 ATOM 2275 C C . PRO A 1 295 ? 61.461 -12.370 -7.163 1.00 47.01 ? 316 PRO A C 1 ATOM 2276 O O . PRO A 1 295 ? 61.023 -11.313 -6.699 1.00 47.83 ? 316 PRO A O 1 ATOM 2277 C CB . PRO A 1 295 ? 59.618 -14.017 -7.652 1.00 47.21 ? 316 PRO A CB 1 ATOM 2278 C CG . PRO A 1 295 ? 58.681 -14.760 -6.747 1.00 49.21 ? 316 PRO A CG 1 ATOM 2279 C CD . PRO A 1 295 ? 58.860 -14.110 -5.406 1.00 46.64 ? 316 PRO A CD 1 ATOM 2280 N N . ASN A 1 296 ? 62.495 -12.433 -7.998 1.00 40.34 ? 317 ASN A N 1 ATOM 2281 C CA . ASN A 1 296 ? 63.144 -11.244 -8.543 1.00 47.52 ? 317 ASN A CA 1 ATOM 2282 C C . ASN A 1 296 ? 63.548 -11.521 -9.986 1.00 48.90 ? 317 ASN A C 1 ATOM 2283 O O . ASN A 1 296 ? 64.097 -12.581 -10.288 1.00 45.46 ? 317 ASN A O 1 ATOM 2284 C CB . ASN A 1 296 ? 64.381 -10.873 -7.720 1.00 53.50 ? 317 ASN A CB 1 ATOM 2285 C CG . ASN A 1 296 ? 65.343 -12.042 -7.558 1.00 59.32 ? 317 ASN A CG 1 ATOM 2286 O OD1 . ASN A 1 296 ? 64.984 -13.074 -6.993 1.00 65.12 ? 317 ASN A OD1 1 ATOM 2287 N ND2 . ASN A 1 296 ? 66.569 -11.886 -8.057 1.00 52.85 ? 317 ASN A ND2 1 ATOM 2288 N N . TRP A 1 297 ? 63.271 -10.584 -10.885 1.00 47.75 ? 318 TRP A N 1 ATOM 2289 C CA . TRP A 1 297 ? 63.576 -10.815 -12.290 1.00 51.33 ? 318 TRP A CA 1 ATOM 2290 C C . TRP A 1 297 ? 65.073 -10.850 -12.561 1.00 47.57 ? 318 TRP A C 1 ATOM 2291 O O . TRP A 1 297 ? 65.800 -9.917 -12.224 1.00 46.71 ? 318 TRP A O 1 ATOM 2292 C CB . TRP A 1 297 ? 62.898 -9.777 -13.192 1.00 49.47 ? 318 TRP A CB 1 ATOM 2293 C CG . TRP A 1 297 ? 61.424 -9.975 -13.326 1.00 43.04 ? 318 TRP A CG 1 ATOM 2294 C CD1 . TRP A 1 297 ? 60.440 -9.081 -13.005 1.00 34.84 ? 318 TRP A CD1 1 ATOM 2295 C CD2 . TRP A 1 297 ? 60.759 -11.154 -13.789 1.00 49.07 ? 318 TRP A CD2 1 ATOM 2296 N NE1 . TRP A 1 297 ? 59.201 -9.631 -13.252 1.00 39.41 ? 318 TRP A NE1 1 ATOM 2297 C CE2 . TRP A 1 297 ? 59.370 -10.900 -13.737 1.00 42.43 ? 318 TRP A CE2 1 ATOM 2298 C CE3 . TRP A 1 297 ? 61.203 -12.397 -14.249 1.00 48.95 ? 318 TRP A CE3 1 ATOM 2299 C CZ2 . TRP A 1 297 ? 58.424 -11.843 -14.137 1.00 37.04 ? 318 TRP A CZ2 1 ATOM 2300 C CZ3 . TRP A 1 297 ? 60.265 -13.332 -14.640 1.00 46.88 ? 318 TRP A CZ3 1 ATOM 2301 C CH2 . TRP A 1 297 ? 58.888 -13.051 -14.579 1.00 44.37 ? 318 TRP A CH2 1 ATOM 2302 N N . VAL A 1 298 ? 65.520 -11.946 -13.166 1.00 45.94 ? 319 VAL A N 1 ATOM 2303 C CA . VAL A 1 298 ? 66.861 -12.035 -13.728 1.00 52.18 ? 319 VAL A CA 1 ATOM 2304 C C . VAL A 1 298 ? 66.812 -11.698 -15.219 1.00 53.35 ? 319 VAL A C 1 ATOM 2305 O O . VAL A 1 298 ? 67.501 -10.794 -15.687 1.00 55.46 ? 319 VAL A O 1 ATOM 2306 C CB . VAL A 1 298 ? 67.447 -13.441 -13.548 1.00 54.35 ? 319 VAL A CB 1 ATOM 2307 C CG1 . VAL A 1 298 ? 68.717 -13.602 -14.375 1.00 51.32 ? 319 VAL A CG1 1 ATOM 2308 C CG2 . VAL A 1 298 ? 67.712 -13.715 -12.074 1.00 53.44 ? 319 VAL A CG2 1 ATOM 2309 N N . GLN A 1 299 ? 65.984 -12.433 -15.953 1.00 52.64 ? 320 GLN A N 1 ATOM 2310 C CA . GLN A 1 299 ? 65.759 -12.182 -17.372 1.00 53.91 ? 320 GLN A CA 1 ATOM 2311 C C . GLN A 1 299 ? 64.265 -11.956 -17.614 1.00 51.64 ? 320 GLN A C 1 ATOM 2312 O O . GLN A 1 299 ? 63.444 -12.816 -17.293 1.00 56.65 ? 320 GLN A O 1 ATOM 2313 C CB . GLN A 1 299 ? 66.272 -13.367 -18.197 1.00 61.83 ? 320 GLN A CB 1 ATOM 2314 C CG . GLN A 1 299 ? 66.055 -13.255 -19.698 1.00 69.82 ? 320 GLN A CG 1 ATOM 2315 C CD . GLN A 1 299 ? 66.672 -14.418 -20.463 1.00 79.71 ? 320 GLN A CD 1 ATOM 2316 O OE1 . GLN A 1 299 ? 67.887 -14.613 -20.445 1.00 81.37 ? 320 GLN A OE1 1 ATOM 2317 N NE2 . GLN A 1 299 ? 65.832 -15.194 -21.143 1.00 84.28 ? 320 GLN A NE2 1 ATOM 2318 N N . ILE A 1 300 ? 63.915 -10.791 -18.151 1.00 47.59 ? 321 ILE A N 1 ATOM 2319 C CA . ILE A 1 300 ? 62.522 -10.469 -18.463 1.00 49.34 ? 321 ILE A CA 1 ATOM 2320 C C . ILE A 1 300 ? 62.274 -10.547 -19.958 1.00 53.79 ? 321 ILE A C 1 ATOM 2321 O O . ILE A 1 300 ? 63.215 -10.488 -20.755 1.00 59.62 ? 321 ILE A O 1 ATOM 2322 C CB . ILE A 1 300 ? 62.154 -9.034 -18.047 1.00 45.16 ? 321 ILE A CB 1 ATOM 2323 C CG1 . ILE A 1 300 ? 63.088 -8.034 -18.728 1.00 46.73 ? 321 ILE A CG1 1 ATOM 2324 C CG2 . ILE A 1 300 ? 62.212 -8.869 -16.559 1.00 44.25 ? 321 ILE A CG2 1 ATOM 2325 C CD1 . ILE A 1 300 ? 62.786 -6.596 -18.379 1.00 52.60 ? 321 ILE A CD1 1 ATOM 2326 N N . ILE A 1 301 ? 61.005 -10.659 -20.340 1.00 53.42 ? 322 ILE A N 1 ATOM 2327 C CA . ILE A 1 301 ? 60.635 -10.547 -21.746 1.00 58.04 ? 322 ILE A CA 1 ATOM 2328 C C . ILE A 1 301 ? 60.678 -9.084 -22.163 1.00 59.72 ? 322 ILE A C 1 ATOM 2329 O O . ILE A 1 301 ? 60.445 -8.190 -21.345 1.00 58.66 ? 322 ILE A O 1 ATOM 2330 C CB . ILE A 1 301 ? 59.230 -11.112 -22.040 1.00 54.00 ? 322 ILE A CB 1 ATOM 2331 C CG1 . ILE A 1 301 ? 58.184 -10.441 -21.153 1.00 55.24 ? 322 ILE A CG1 1 ATOM 2332 C CG2 . ILE A 1 301 ? 59.202 -12.618 -21.849 1.00 54.56 ? 322 ILE A CG2 1 ATOM 2333 C CD1 . ILE A 1 301 ? 56.775 -10.899 -21.452 1.00 63.50 ? 322 ILE A CD1 1 ATOM 2334 N N . ASN A 1 302 ? 60.987 -8.850 -23.437 1.00 54.61 ? 323 ASN A N 1 ATOM 2335 C CA . ASN A 1 302 ? 61.043 -7.507 -23.984 1.00 48.86 ? 323 ASN A CA 1 ATOM 2336 C C . ASN A 1 302 ? 60.294 -7.409 -25.302 1.00 49.61 ? 323 ASN A C 1 ATOM 2337 O O . ASN A 1 302 ? 60.046 -8.420 -25.962 1.00 57.28 ? 323 ASN A O 1 ATOM 2338 C CB . ASN A 1 302 ? 62.496 -7.051 -24.143 1.00 49.39 ? 323 ASN A CB 1 ATOM 2339 C CG . ASN A 1 302 ? 63.144 -6.715 -22.806 1.00 58.10 ? 323 ASN A CG 1 ATOM 2340 O OD1 . ASN A 1 302 ? 64.059 -7.404 -22.351 1.00 62.60 ? 323 ASN A OD1 1 ATOM 2341 N ND2 . ASN A 1 302 ? 62.651 -5.665 -22.160 1.00 50.67 ? 323 ASN A ND2 1 ATOM 2342 N N . ASP A 1 303 ? 59.913 -6.190 -25.666 1.00 42.60 ? 324 ASP A N 1 ATOM 2343 C CA . ASP A 1 303 ? 59.217 -5.943 -26.928 1.00 48.75 ? 324 ASP A CA 1 ATOM 2344 C C . ASP A 1 303 ? 59.885 -6.657 -28.088 1.00 56.01 ? 324 ASP A C 1 ATOM 2345 O O . ASP A 1 303 ? 61.112 -6.724 -28.165 1.00 57.97 ? 324 ASP A O 1 ATOM 2346 C CB . ASP A 1 303 ? 59.140 -4.443 -27.218 1.00 52.09 ? 324 ASP A CB 1 ATOM 2347 C CG . ASP A 1 303 ? 58.145 -3.729 -26.320 1.00 66.97 ? 324 ASP A CG 1 ATOM 2348 O OD1 . ASP A 1 303 ? 57.587 -4.383 -25.410 1.00 66.37 ? 324 ASP A OD1 1 ATOM 2349 O OD2 . ASP A 1 303 ? 57.921 -2.517 -26.527 1.00 74.82 ? 324 ASP A OD2 1 ATOM 2350 N N . ILE A 1 304 ? 59.060 -7.180 -28.989 1.00 63.59 ? 325 ILE A N 1 ATOM 2351 C CA . ILE A 1 304 ? 59.527 -7.932 -30.146 1.00 62.27 ? 325 ILE A CA 1 ATOM 2352 C C . ILE A 1 304 ? 58.726 -7.584 -31.395 1.00 62.86 ? 325 ILE A C 1 ATOM 2353 O O . ILE A 1 304 ? 57.495 -7.548 -31.361 1.00 59.71 ? 325 ILE A O 1 ATOM 2354 C CB . ILE A 1 304 ? 59.420 -9.451 -29.899 1.00 65.79 ? 325 ILE A CB 1 ATOM 2355 C CG1 . ILE A 1 304 ? 60.678 -9.968 -29.205 1.00 69.39 ? 325 ILE A CG1 1 ATOM 2356 C CG2 . ILE A 1 304 ? 59.222 -10.192 -31.203 1.00 68.08 ? 325 ILE A CG2 1 ATOM 2357 C CD1 . ILE A 1 304 ? 60.560 -11.402 -28.724 1.00 71.73 ? 325 ILE A CD1 1 ATOM 2358 N N . HIS A 1 305 ? 59.433 -7.314 -32.491 1.00 66.78 ? 326 HIS A N 1 ATOM 2359 C CA . HIS A 1 305 ? 58.812 -7.122 -33.802 1.00 77.47 ? 326 HIS A CA 1 ATOM 2360 C C . HIS A 1 305 ? 59.195 -8.309 -34.667 1.00 78.11 ? 326 HIS A C 1 ATOM 2361 O O . HIS A 1 305 ? 60.359 -8.706 -34.694 1.00 78.20 ? 326 HIS A O 1 ATOM 2362 C CB . HIS A 1 305 ? 59.319 -5.842 -34.473 1.00 90.65 ? 326 HIS A CB 1 ATOM 2363 C CG . HIS A 1 305 ? 59.090 -4.601 -33.669 1.00 106.49 ? 326 HIS A CG 1 ATOM 2364 N ND1 . HIS A 1 305 ? 58.339 -3.540 -34.133 1.00 113.13 ? 326 HIS A ND1 1 ATOM 2365 C CD2 . HIS A 1 305 ? 59.515 -4.245 -32.433 1.00 111.34 ? 326 HIS A CD2 1 ATOM 2366 C CE1 . HIS A 1 305 ? 58.311 -2.589 -33.218 1.00 115.09 ? 326 HIS A CE1 1 ATOM 2367 N NE2 . HIS A 1 305 ? 59.016 -2.992 -32.175 1.00 114.09 ? 326 HIS A NE2 1 ATOM 2368 N N . VAL A 1 306 ? 58.223 -8.885 -35.365 1.00 79.26 ? 327 VAL A N 1 ATOM 2369 C CA . VAL A 1 306 ? 58.508 -9.961 -36.310 1.00 79.43 ? 327 VAL A CA 1 ATOM 2370 C C . VAL A 1 306 ? 57.699 -9.802 -37.587 1.00 86.46 ? 327 VAL A C 1 ATOM 2371 O O . VAL A 1 306 ? 56.613 -9.215 -37.575 1.00 83.02 ? 327 VAL A O 1 ATOM 2372 C CB . VAL A 1 306 ? 58.217 -11.349 -35.718 1.00 77.02 ? 327 VAL A CB 1 ATOM 2373 C CG1 . VAL A 1 306 ? 59.114 -11.613 -34.519 1.00 81.58 ? 327 VAL A CG1 1 ATOM 2374 C CG2 . VAL A 1 306 ? 56.752 -11.464 -35.341 1.00 76.22 ? 327 VAL A CG2 1 ATOM 2375 N N . ALA A 1 307 ? 58.244 -10.327 -38.683 1.00 93.25 ? 328 ALA A N 1 ATOM 2376 C CA . ALA A 1 307 ? 57.564 -10.332 -39.972 1.00 96.64 ? 328 ALA A CA 1 ATOM 2377 C C . ALA A 1 307 ? 56.422 -11.339 -39.949 1.00 97.04 ? 328 ALA A C 1 ATOM 2378 O O . ALA A 1 307 ? 56.337 -12.173 -39.043 1.00 87.05 ? 328 ALA A O 1 ATOM 2379 C CB . ALA A 1 307 ? 58.541 -10.647 -41.097 1.00 98.03 ? 328 ALA A CB 1 ATOM 2380 N N . MET A 1 308 ? 55.566 -11.266 -40.965 1.00 104.55 ? 329 MET A N 1 ATOM 2381 C CA . MET A 1 308 ? 54.254 -11.913 -40.945 1.00 110.70 ? 329 MET A CA 1 ATOM 2382 C C . MET A 1 308 ? 54.218 -13.409 -40.621 1.00 113.63 ? 329 MET A C 1 ATOM 2383 O O . MET A 1 308 ? 53.423 -13.834 -39.789 1.00 118.52 ? 329 MET A O 1 ATOM 2384 C CB . MET A 1 308 ? 53.495 -11.640 -42.247 1.00 116.87 ? 329 MET A CB 1 ATOM 2385 C CG . MET A 1 308 ? 52.086 -12.220 -42.267 1.00 123.28 ? 329 MET A CG 1 ATOM 2386 S SD . MET A 1 308 ? 51.022 -11.558 -40.968 1.00 118.38 ? 329 MET A SD 1 ATOM 2387 C CE . MET A 1 308 ? 51.047 -9.816 -41.383 1.00 196.45 ? 329 MET A CE 1 ATOM 2388 N N . GLU A 1 309 ? 55.056 -14.209 -41.271 1.00 113.27 ? 330 GLU A N 1 ATOM 2389 C CA . GLU A 1 309 ? 54.955 -15.661 -41.114 1.00 117.21 ? 330 GLU A CA 1 ATOM 2390 C C . GLU A 1 309 ? 56.113 -16.289 -40.337 1.00 115.13 ? 330 GLU A C 1 ATOM 2391 O O . GLU A 1 309 ? 56.221 -17.512 -40.253 1.00 118.68 ? 330 GLU A O 1 ATOM 2392 C CB . GLU A 1 309 ? 54.784 -16.336 -42.482 1.00 125.65 ? 330 GLU A CB 1 ATOM 2393 C CG . GLU A 1 309 ? 53.382 -16.188 -43.060 1.00 135.16 ? 330 GLU A CG 1 ATOM 2394 C CD . GLU A 1 309 ? 53.360 -16.225 -44.577 1.00 151.39 ? 330 GLU A CD 1 ATOM 2395 O OE1 . GLU A 1 309 ? 54.261 -16.849 -45.175 1.00 157.37 ? 330 GLU A OE1 1 ATOM 2396 O OE2 . GLU A 1 309 ? 52.438 -15.627 -45.175 1.00 156.03 ? 330 GLU A OE2 1 ATOM 2397 N N . GLU A 1 310 ? 56.963 -15.452 -39.751 1.00 109.64 ? 331 GLU A N 1 ATOM 2398 C CA . GLU A 1 310 ? 58.139 -15.950 -39.047 1.00 103.67 ? 331 GLU A CA 1 ATOM 2399 C C . GLU A 1 310 ? 57.885 -16.272 -37.576 1.00 96.65 ? 331 GLU A C 1 ATOM 2400 O O . GLU A 1 310 ? 56.767 -16.136 -37.079 1.00 99.12 ? 331 GLU A O 1 ATOM 2401 C CB . GLU A 1 310 ? 59.318 -14.990 -39.206 1.00 105.37 ? 331 GLU A CB 1 ATOM 2402 C CG . GLU A 1 310 ? 59.996 -15.109 -40.557 1.00 116.89 ? 331 GLU A CG 1 ATOM 2403 C CD . GLU A 1 310 ? 61.255 -14.274 -40.661 1.00 121.82 ? 331 GLU A CD 1 ATOM 2404 O OE1 . GLU A 1 310 ? 61.729 -13.782 -39.615 1.00 115.11 ? 331 GLU A OE1 1 ATOM 2405 O OE2 . GLU A 1 310 ? 61.768 -14.113 -41.792 1.00 127.15 ? 331 GLU A OE2 1 ATOM 2406 N N . SER A 1 311 ? 58.940 -16.700 -36.891 1.00 88.17 ? 332 SER A N 1 ATOM 2407 C CA . SER A 1 311 ? 58.822 -17.270 -35.556 1.00 95.89 ? 332 SER A CA 1 ATOM 2408 C C . SER A 1 311 ? 59.299 -16.327 -34.455 1.00 94.31 ? 332 SER A C 1 ATOM 2409 O O . SER A 1 311 ? 60.060 -15.393 -34.711 1.00 95.60 ? 332 SER A O 1 ATOM 2410 C CB . SER A 1 311 ? 59.623 -18.568 -35.488 1.00 103.12 ? 332 SER A CB 1 ATOM 2411 O OG . SER A 1 311 ? 60.971 -18.335 -35.866 1.00 104.28 ? 332 SER A OG 1 ATOM 2412 N N . VAL A 1 312 ? 58.852 -16.588 -33.228 1.00 94.21 ? 333 VAL A N 1 ATOM 2413 C CA . VAL A 1 312 ? 59.265 -15.802 -32.065 1.00 91.10 ? 333 VAL A CA 1 ATOM 2414 C C . VAL A 1 312 ? 59.566 -16.697 -30.863 1.00 82.19 ? 333 VAL A C 1 ATOM 2415 O O . VAL A 1 312 ? 58.997 -17.784 -30.719 1.00 82.65 ? 333 VAL A O 1 ATOM 2416 C CB . VAL A 1 312 ? 58.190 -14.778 -31.644 1.00 93.14 ? 333 VAL A CB 1 ATOM 2417 C CG1 . VAL A 1 312 ? 57.514 -14.175 -32.867 1.00 94.82 ? 333 VAL A CG1 1 ATOM 2418 C CG2 . VAL A 1 312 ? 57.164 -15.429 -30.731 1.00 93.93 ? 333 VAL A CG2 1 ATOM 2419 N N . PHE A 1 313 ? 60.468 -16.238 -30.004 1.00 73.43 ? 334 PHE A N 1 ATOM 2420 C CA . PHE A 1 313 ? 60.801 -16.985 -28.797 1.00 74.47 ? 334 PHE A CA 1 ATOM 2421 C C . PHE A 1 313 ? 61.075 -16.075 -27.597 1.00 69.83 ? 334 PHE A C 1 ATOM 2422 O O . PHE A 1 313 ? 61.896 -15.158 -27.665 1.00 64.92 ? 334 PHE A O 1 ATOM 2423 C CB . PHE A 1 313 ? 61.980 -17.932 -29.039 1.00 74.20 ? 334 PHE A CB 1 ATOM 2424 C CG . PHE A 1 313 ? 62.228 -18.880 -27.901 1.00 74.61 ? 334 PHE A CG 1 ATOM 2425 C CD1 . PHE A 1 313 ? 61.547 -20.085 -27.825 1.00 78.00 ? 334 PHE A CD1 1 ATOM 2426 C CD2 . PHE A 1 313 ? 63.131 -18.560 -26.901 1.00 68.64 ? 334 PHE A CD2 1 ATOM 2427 C CE1 . PHE A 1 313 ? 61.767 -20.955 -26.774 1.00 83.06 ? 334 PHE A CE1 1 ATOM 2428 C CE2 . PHE A 1 313 ? 63.353 -19.423 -25.846 1.00 70.00 ? 334 PHE A CE2 1 ATOM 2429 C CZ . PHE A 1 313 ? 62.672 -20.622 -25.781 1.00 76.53 ? 334 PHE A CZ 1 ATOM 2430 N N . TRP A 1 314 ? 60.374 -16.343 -26.501 1.00 70.25 ? 335 TRP A N 1 ATOM 2431 C CA . TRP A 1 314 ? 60.517 -15.569 -25.273 1.00 65.87 ? 335 TRP A CA 1 ATOM 2432 C C . TRP A 1 314 ? 60.913 -16.464 -24.109 1.00 64.42 ? 335 TRP A C 1 ATOM 2433 O O . TRP A 1 314 ? 60.418 -17.579 -23.984 1.00 65.14 ? 335 TRP A O 1 ATOM 2434 C CB . TRP A 1 314 ? 59.195 -14.886 -24.929 1.00 68.87 ? 335 TRP A CB 1 ATOM 2435 C CG . TRP A 1 314 ? 59.110 -13.440 -25.306 1.00 67.82 ? 335 TRP A CG 1 ATOM 2436 C CD1 . TRP A 1 314 ? 60.118 -12.521 -25.267 1.00 68.17 ? 335 TRP A CD1 1 ATOM 2437 C CD2 . TRP A 1 314 ? 57.938 -12.732 -25.727 1.00 60.33 ? 335 TRP A CD2 1 ATOM 2438 N NE1 . TRP A 1 314 ? 59.651 -11.291 -25.666 1.00 61.87 ? 335 TRP A NE1 1 ATOM 2439 C CE2 . TRP A 1 314 ? 58.315 -11.393 -25.947 1.00 57.38 ? 335 TRP A CE2 1 ATOM 2440 C CE3 . TRP A 1 314 ? 56.609 -13.104 -25.949 1.00 62.95 ? 335 TRP A CE3 1 ATOM 2441 C CZ2 . TRP A 1 314 ? 57.412 -10.426 -26.381 1.00 64.28 ? 335 TRP A CZ2 1 ATOM 2442 C CZ3 . TRP A 1 314 ? 55.713 -12.140 -26.381 1.00 64.49 ? 335 TRP A CZ3 1 ATOM 2443 C CH2 . TRP A 1 314 ? 56.119 -10.818 -26.590 1.00 67.48 ? 335 TRP A CH2 1 ATOM 2444 N N . GLU A 1 315 ? 61.797 -15.980 -23.247 1.00 67.43 ? 336 GLU A N 1 ATOM 2445 C CA . GLU A 1 315 ? 62.067 -16.689 -22.003 1.00 68.44 ? 336 GLU A CA 1 ATOM 2446 C C . GLU A 1 315 ? 62.034 -15.763 -20.792 1.00 63.83 ? 336 GLU A C 1 ATOM 2447 O O . GLU A 1 315 ? 62.522 -14.638 -20.846 1.00 60.73 ? 336 GLU A O 1 ATOM 2448 C CB . GLU A 1 315 ? 63.390 -17.462 -22.057 1.00 74.85 ? 336 GLU A CB 1 ATOM 2449 C CG . GLU A 1 315 ? 63.815 -18.003 -20.692 1.00 82.12 ? 336 GLU A CG 1 ATOM 2450 C CD . GLU A 1 315 ? 64.473 -19.369 -20.762 1.00 89.92 ? 336 GLU A CD 1 ATOM 2451 O OE1 . GLU A 1 315 ? 65.396 -19.555 -21.580 1.00 93.36 ? 336 GLU A OE1 1 ATOM 2452 O OE2 . GLU A 1 315 ? 64.070 -20.257 -19.983 1.00 93.80 ? 336 GLU A OE2 1 ATOM 2453 N N . CYS A 1 316 ? 61.436 -16.259 -19.711 1.00 61.76 ? 337 CYS A N 1 ATOM 2454 C CA . CYS A 1 316 ? 61.394 -15.579 -18.424 1.00 54.43 ? 337 CYS A CA 1 ATOM 2455 C C . CYS A 1 316 ? 62.321 -16.304 -17.460 1.00 54.60 ? 337 CYS A C 1 ATOM 2456 O O . CYS A 1 316 ? 62.328 -17.536 -17.426 1.00 53.22 ? 337 CYS A O 1 ATOM 2457 C CB . CYS A 1 316 ? 59.978 -15.644 -17.849 1.00 49.99 ? 337 CYS A CB 1 ATOM 2458 S SG . CYS A 1 316 ? 58.836 -14.387 -18.424 1.00 155.35 ? 337 CYS A SG 1 ATOM 2459 N N . LYS A 1 317 ? 63.090 -15.553 -16.671 1.00 54.40 ? 338 LYS A N 1 ATOM 2460 C CA . LYS A 1 317 ? 63.887 -16.140 -15.588 1.00 53.64 ? 338 LYS A CA 1 ATOM 2461 C C . LYS A 1 317 ? 63.802 -15.316 -14.303 1.00 56.12 ? 338 LYS A C 1 ATOM 2462 O O . LYS A 1 317 ? 64.092 -14.120 -14.296 1.00 56.77 ? 338 LYS A O 1 ATOM 2463 C CB . LYS A 1 317 ? 65.355 -16.298 -15.996 1.00 58.27 ? 338 LYS A CB 1 ATOM 2464 C CG . LYS A 1 317 ? 65.604 -17.287 -17.116 1.00 70.11 ? 338 LYS A CG 1 ATOM 2465 C CD . LYS A 1 317 ? 66.929 -17.997 -16.917 1.00 71.05 ? 338 LYS A CD 1 ATOM 2466 C CE . LYS A 1 317 ? 67.455 -18.570 -18.220 1.00 67.13 ? 338 LYS A CE 1 ATOM 2467 N NZ . LYS A 1 317 ? 68.040 -17.502 -19.077 1.00 65.63 ? 338 LYS A NZ 1 ATOM 2468 N N . ALA A 1 318 ? 63.417 -15.960 -13.210 1.00 53.83 ? 339 ALA A N 1 ATOM 2469 C CA . ALA A 1 318 ? 63.348 -15.275 -11.929 1.00 58.31 ? 339 ALA A CA 1 ATOM 2470 C C . ALA A 1 318 ? 64.067 -16.061 -10.844 1.00 67.38 ? 339 ALA A C 1 ATOM 2471 O O . ALA A 1 318 ? 63.971 -17.288 -10.781 1.00 72.37 ? 339 ALA A O 1 ATOM 2472 C CB . ALA A 1 318 ? 61.900 -15.034 -11.529 1.00 56.91 ? 339 ALA A CB 1 ATOM 2473 N N . ASN A 1 319 ? 64.798 -15.341 -10.000 1.00 64.85 ? 340 ASN A N 1 ATOM 2474 C CA . ASN A 1 319 ? 65.393 -15.917 -8.807 1.00 67.57 ? 340 ASN A CA 1 ATOM 2475 C C . ASN A 1 319 ? 64.385 -15.883 -7.670 1.00 61.85 ? 340 ASN A C 1 ATOM 2476 O O . ASN A 1 319 ? 63.374 -15.183 -7.756 1.00 51.75 ? 340 ASN A O 1 ATOM 2477 C CB . ASN A 1 319 ? 66.647 -15.141 -8.408 1.00 74.05 ? 340 ASN A CB 1 ATOM 2478 C CG . ASN A 1 319 ? 67.886 -15.618 -9.136 1.00 81.24 ? 340 ASN A CG 1 ATOM 2479 O OD1 . ASN A 1 319 ? 67.882 -16.680 -9.762 1.00 85.06 ? 340 ASN A OD1 1 ATOM 2480 N ND2 . ASN A 1 319 ? 68.959 -14.838 -9.051 1.00 79.47 ? 340 ASN A ND2 1 ATOM 2481 N N . GLY A 1 320 ? 64.668 -16.630 -6.606 1.00 59.90 ? 341 GLY A N 1 ATOM 2482 C CA . GLY A 1 320 ? 63.800 -16.673 -5.441 1.00 61.30 ? 341 GLY A CA 1 ATOM 2483 C C . GLY A 1 320 ? 64.003 -17.943 -4.636 1.00 62.57 ? 341 GLY A C 1 ATOM 2484 O O . GLY A 1 320 ? 64.857 -18.761 -4.974 1.00 61.46 ? 341 GLY A O 1 ATOM 2485 N N . ARG A 1 321 ? 63.219 -18.117 -3.576 1.00 64.29 ? 342 ARG A N 1 ATOM 2486 C CA . ARG A 1 321 ? 63.377 -19.284 -2.712 1.00 66.84 ? 342 ARG A CA 1 ATOM 2487 C C . ARG A 1 321 ? 62.108 -19.575 -1.911 1.00 62.37 ? 342 ARG A C 1 ATOM 2488 O O . ARG A 1 321 ? 61.699 -18.770 -1.074 1.00 54.13 ? 342 ARG A O 1 ATOM 2489 C CB . ARG A 1 321 ? 64.575 -19.089 -1.785 1.00 73.48 ? 342 ARG A CB 1 ATOM 2490 C CG . ARG A 1 321 ? 65.340 -20.361 -1.496 1.00 81.65 ? 342 ARG A CG 1 ATOM 2491 C CD . ARG A 1 321 ? 66.827 -20.076 -1.452 1.00 86.24 ? 342 ARG A CD 1 ATOM 2492 N NE . ARG A 1 321 ? 67.603 -21.265 -1.122 1.00 89.91 ? 342 ARG A NE 1 ATOM 2493 C CZ . ARG A 1 321 ? 67.852 -21.672 0.117 1.00 96.12 ? 342 ARG A CZ 1 ATOM 2494 N NH1 . ARG A 1 321 ? 67.383 -20.989 1.153 1.00 98.75 ? 342 ARG A NH1 1 ATOM 2495 N NH2 . ARG A 1 321 ? 68.570 -22.766 0.323 1.00 101.27 ? 342 ARG A NH2 1 ATOM 2496 N N . PRO A 1 322 ? 61.456 -20.713 -2.193 1.00 66.46 ? 343 PRO A N 1 ATOM 2497 C CA . PRO A 1 322 ? 61.800 -21.704 -3.223 1.00 74.88 ? 343 PRO A CA 1 ATOM 2498 C C . PRO A 1 322 ? 61.958 -21.093 -4.609 1.00 77.68 ? 343 PRO A C 1 ATOM 2499 O O . PRO A 1 322 ? 61.588 -19.937 -4.824 1.00 74.42 ? 343 PRO A O 1 ATOM 2500 C CB . PRO A 1 322 ? 60.569 -22.628 -3.237 1.00 77.53 ? 343 PRO A CB 1 ATOM 2501 C CG . PRO A 1 322 ? 59.471 -21.793 -2.639 1.00 78.43 ? 343 PRO A CG 1 ATOM 2502 C CD . PRO A 1 322 ? 60.192 -21.068 -1.534 1.00 71.89 ? 343 PRO A CD 1 ATOM 2503 N N . LYS A 1 323 ? 62.502 -21.871 -5.540 1.00 79.31 ? 344 LYS A N 1 ATOM 2504 C CA . LYS A 1 323 ? 62.586 -21.437 -6.926 1.00 68.75 ? 344 LYS A CA 1 ATOM 2505 C C . LYS A 1 323 ? 61.183 -21.150 -7.435 1.00 63.25 ? 344 LYS A C 1 ATOM 2506 O O . LYS A 1 323 ? 60.254 -21.922 -7.185 1.00 68.03 ? 344 LYS A O 1 ATOM 2507 C CB . LYS A 1 323 ? 63.276 -22.492 -7.788 1.00 70.45 ? 344 LYS A CB 1 ATOM 2508 C CG . LYS A 1 323 ? 64.790 -22.482 -7.665 1.00 75.06 ? 344 LYS A CG 1 ATOM 2509 C CD . LYS A 1 323 ? 65.352 -21.141 -8.105 1.00 81.96 ? 344 LYS A CD 1 ATOM 2510 C CE . LYS A 1 323 ? 66.861 -21.191 -8.257 1.00 85.69 ? 344 LYS A CE 1 ATOM 2511 N NZ . LYS A 1 323 ? 67.341 -20.123 -9.180 1.00 88.08 ? 344 LYS A NZ 1 ATOM 2512 N N . PRO A 1 324 ? 61.022 -20.009 -8.114 1.00 56.43 ? 345 PRO A N 1 ATOM 2513 C CA . PRO A 1 324 ? 59.762 -19.512 -8.683 1.00 66.83 ? 345 PRO A CA 1 ATOM 2514 C C . PRO A 1 324 ? 59.167 -20.398 -9.779 1.00 72.84 ? 345 PRO A C 1 ATOM 2515 O O . PRO A 1 324 ? 59.869 -21.200 -10.396 1.00 71.27 ? 345 PRO A O 1 ATOM 2516 C CB . PRO A 1 324 ? 60.159 -18.155 -9.273 1.00 62.35 ? 345 PRO A CB 1 ATOM 2517 C CG . PRO A 1 324 ? 61.363 -17.742 -8.486 1.00 59.94 ? 345 PRO A CG 1 ATOM 2518 C CD . PRO A 1 324 ? 62.099 -19.009 -8.196 1.00 49.51 ? 345 PRO A CD 1 ATOM 2519 N N . THR A 1 325 ? 57.868 -20.222 -10.007 1.00 78.09 ? 346 THR A N 1 ATOM 2520 C CA . THR A 1 325 ? 57.119 -20.937 -11.040 1.00 74.73 ? 346 THR A CA 1 ATOM 2521 C C . THR A 1 325 ? 56.449 -19.955 -12.023 1.00 72.43 ? 346 THR A C 1 ATOM 2522 O O . THR A 1 325 ? 56.152 -18.815 -11.661 1.00 70.04 ? 346 THR A O 1 ATOM 2523 C CB . THR A 1 325 ? 56.095 -21.884 -10.395 1.00 74.44 ? 346 THR A CB 1 ATOM 2524 O OG1 . THR A 1 325 ? 56.657 -23.198 -10.343 1.00 79.86 ? 346 THR A OG1 1 ATOM 2525 C CG2 . THR A 1 325 ? 54.801 -21.929 -11.185 1.00 79.90 ? 346 THR A CG2 1 ATOM 2526 N N . TYR A 1 326 ? 56.219 -20.393 -13.261 1.00 70.13 ? 347 TYR A N 1 ATOM 2527 C CA . TYR A 1 326 ? 55.887 -19.464 -14.346 1.00 67.09 ? 347 TYR A CA 1 ATOM 2528 C C . TYR A 1 326 ? 54.543 -19.711 -15.031 1.00 72.70 ? 347 TYR A C 1 ATOM 2529 O O . TYR A 1 326 ? 54.247 -20.825 -15.466 1.00 70.77 ? 347 TYR A O 1 ATOM 2530 C CB . TYR A 1 326 ? 56.989 -19.483 -15.411 1.00 62.45 ? 347 TYR A CB 1 ATOM 2531 C CG . TYR A 1 326 ? 58.372 -19.181 -14.884 1.00 60.59 ? 347 TYR A CG 1 ATOM 2532 C CD1 . TYR A 1 326 ? 59.257 -20.205 -14.567 1.00 59.32 ? 347 TYR A CD1 1 ATOM 2533 C CD2 . TYR A 1 326 ? 58.795 -17.873 -14.706 1.00 65.02 ? 347 TYR A CD2 1 ATOM 2534 C CE1 . TYR A 1 326 ? 60.524 -19.930 -14.085 1.00 57.95 ? 347 TYR A CE1 1 ATOM 2535 C CE2 . TYR A 1 326 ? 60.058 -17.589 -14.223 1.00 64.05 ? 347 TYR A CE2 1 ATOM 2536 C CZ . TYR A 1 326 ? 60.917 -18.618 -13.915 1.00 63.57 ? 347 TYR A CZ 1 ATOM 2537 O OH . TYR A 1 326 ? 62.172 -18.327 -13.434 1.00 68.17 ? 347 TYR A OH 1 ATOM 2538 N N . ARG A 1 327 ? 53.740 -18.659 -15.145 1.00 75.15 ? 348 ARG A N 1 ATOM 2539 C CA . ARG A 1 327 ? 52.527 -18.720 -15.955 1.00 81.06 ? 348 ARG A CA 1 ATOM 2540 C C . ARG A 1 327 ? 52.474 -17.539 -16.927 1.00 78.00 ? 348 ARG A C 1 ATOM 2541 O O . ARG A 1 327 ? 53.160 -16.539 -16.725 1.00 77.02 ? 348 ARG A O 1 ATOM 2542 C CB . ARG A 1 327 ? 51.275 -18.793 -15.073 1.00 87.02 ? 348 ARG A CB 1 ATOM 2543 C CG . ARG A 1 327 ? 51.081 -17.629 -14.119 1.00 87.94 ? 348 ARG A CG 1 ATOM 2544 C CD . ARG A 1 327 ? 49.762 -17.764 -13.363 1.00 88.31 ? 348 ARG A CD 1 ATOM 2545 N NE . ARG A 1 327 ? 48.982 -16.531 -13.445 1.00 92.48 ? 348 ARG A NE 1 ATOM 2546 C CZ . ARG A 1 327 ? 48.804 -15.680 -12.440 1.00 88.44 ? 348 ARG A CZ 1 ATOM 2547 N NH1 . ARG A 1 327 ? 49.338 -15.931 -11.250 1.00 84.20 ? 348 ARG A NH1 1 ATOM 2548 N NH2 . ARG A 1 327 ? 48.082 -14.580 -12.626 1.00 86.86 ? 348 ARG A NH2 1 ATOM 2549 N N . TRP A 1 328 ? 51.675 -17.660 -17.986 1.00 78.86 ? 349 TRP A N 1 ATOM 2550 C CA . TRP A 1 328 ? 51.649 -16.646 -19.043 1.00 77.66 ? 349 TRP A CA 1 ATOM 2551 C C . TRP A 1 328 ? 50.273 -16.024 -19.265 1.00 83.01 ? 349 TRP A C 1 ATOM 2552 O O . TRP A 1 328 ? 49.248 -16.630 -18.956 1.00 88.93 ? 349 TRP A O 1 ATOM 2553 C CB . TRP A 1 328 ? 52.144 -17.236 -20.364 1.00 73.93 ? 349 TRP A CB 1 ATOM 2554 C CG . TRP A 1 328 ? 53.594 -17.602 -20.385 1.00 70.77 ? 349 TRP A CG 1 ATOM 2555 C CD1 . TRP A 1 328 ? 54.154 -18.748 -19.905 1.00 72.45 ? 349 TRP A CD1 1 ATOM 2556 C CD2 . TRP A 1 328 ? 54.669 -16.831 -20.938 1.00 71.50 ? 349 TRP A CD2 1 ATOM 2557 N NE1 . TRP A 1 328 ? 55.512 -18.735 -20.110 1.00 76.03 ? 349 TRP A NE1 1 ATOM 2558 C CE2 . TRP A 1 328 ? 55.855 -17.569 -20.747 1.00 72.54 ? 349 TRP A CE2 1 ATOM 2559 C CE3 . TRP A 1 328 ? 54.745 -15.586 -21.573 1.00 67.16 ? 349 TRP A CE3 1 ATOM 2560 C CZ2 . TRP A 1 328 ? 57.103 -17.108 -21.167 1.00 64.24 ? 349 TRP A CZ2 1 ATOM 2561 C CZ3 . TRP A 1 328 ? 55.988 -15.125 -21.988 1.00 61.44 ? 349 TRP A CZ3 1 ATOM 2562 C CH2 . TRP A 1 328 ? 57.147 -15.885 -21.785 1.00 60.80 ? 349 TRP A CH2 1 ATOM 2563 N N . LEU A 1 329 ? 50.271 -14.819 -19.832 1.00 78.77 ? 350 LEU A N 1 ATOM 2564 C CA . LEU A 1 329 ? 49.053 -14.051 -20.079 1.00 76.03 ? 350 LEU A CA 1 ATOM 2565 C C . LEU A 1 329 ? 49.086 -13.367 -21.442 1.00 79.11 ? 350 LEU A C 1 ATOM 2566 O O . LEU A 1 329 ? 50.132 -12.882 -21.873 1.00 75.35 ? 350 LEU A O 1 ATOM 2567 C CB . LEU A 1 329 ? 48.901 -12.965 -19.018 1.00 77.83 ? 350 LEU A CB 1 ATOM 2568 C CG . LEU A 1 329 ? 48.156 -13.221 -17.711 1.00 77.23 ? 350 LEU A CG 1 ATOM 2569 C CD1 . LEU A 1 329 ? 48.537 -14.545 -17.081 1.00 80.13 ? 350 LEU A CD1 1 ATOM 2570 C CD2 . LEU A 1 329 ? 48.453 -12.068 -16.772 1.00 74.92 ? 350 LEU A CD2 1 ATOM 2571 N N . LYS A 1 330 ? 47.938 -13.326 -22.115 1.00 84.94 ? 351 LYS A N 1 ATOM 2572 C CA . LYS A 1 330 ? 47.773 -12.496 -23.303 1.00 82.62 ? 351 LYS A CA 1 ATOM 2573 C C . LYS A 1 330 ? 46.624 -11.517 -23.107 1.00 82.84 ? 351 LYS A C 1 ATOM 2574 O O . LYS A 1 330 ? 45.471 -11.928 -22.974 1.00 88.68 ? 351 LYS A O 1 ATOM 2575 C CB . LYS A 1 330 ? 47.512 -13.342 -24.550 1.00 87.60 ? 351 LYS A CB 1 ATOM 2576 C CG . LYS A 1 330 ? 47.167 -12.513 -25.787 1.00 85.75 ? 351 LYS A CG 1 ATOM 2577 C CD . LYS A 1 330 ? 46.863 -13.384 -27.000 1.00 90.78 ? 351 LYS A CD 1 ATOM 2578 C CE . LYS A 1 330 ? 46.374 -12.540 -28.179 1.00 92.03 ? 351 LYS A CE 1 ATOM 2579 N NZ . LYS A 1 330 ? 46.437 -13.267 -29.481 1.00 88.29 ? 351 LYS A NZ 1 ATOM 2580 N N . ASN A 1 331 ? 46.942 -10.225 -23.089 1.00 78.21 ? 352 ASN A N 1 ATOM 2581 C CA . ASN A 1 331 ? 45.917 -9.186 -23.010 1.00 81.97 ? 352 ASN A CA 1 ATOM 2582 C C . ASN A 1 331 ? 45.063 -9.303 -21.748 1.00 88.24 ? 352 ASN A C 1 ATOM 2583 O O . ASN A 1 331 ? 43.881 -8.951 -21.750 1.00 90.23 ? 352 ASN A O 1 ATOM 2584 C CB . ASN A 1 331 ? 45.021 -9.217 -24.257 1.00 81.13 ? 352 ASN A CB 1 ATOM 2585 C CG . ASN A 1 331 ? 45.739 -8.737 -25.513 1.00 84.92 ? 352 ASN A CG 1 ATOM 2586 O OD1 . ASN A 1 331 ? 46.822 -8.159 -25.441 1.00 82.30 ? 352 ASN A OD1 1 ATOM 2587 N ND2 . ASN A 1 331 ? 45.124 -8.967 -26.672 1.00 93.44 ? 352 ASN A ND2 1 ATOM 2588 N N . GLY A 1 332 ? 45.665 -9.808 -20.677 1.00 90.65 ? 353 GLY A N 1 ATOM 2589 C CA . GLY A 1 332 ? 44.992 -9.894 -19.393 1.00 91.62 ? 353 GLY A CA 1 ATOM 2590 C C . GLY A 1 332 ? 44.292 -11.214 -19.137 1.00 94.35 ? 353 GLY A C 1 ATOM 2591 O O . GLY A 1 332 ? 43.685 -11.403 -18.082 1.00 92.99 ? 353 GLY A O 1 ATOM 2592 N N . ASP A 1 333 ? 44.374 -12.129 -20.097 1.00 100.15 ? 354 ASP A N 1 ATOM 2593 C CA . ASP A 1 333 ? 43.711 -13.423 -19.973 1.00 107.83 ? 354 ASP A CA 1 ATOM 2594 C C . ASP A 1 333 ? 44.717 -14.565 -19.937 1.00 97.96 ? 354 ASP A C 1 ATOM 2595 O O . ASP A 1 333 ? 45.698 -14.558 -20.678 1.00 94.92 ? 354 ASP A O 1 ATOM 2596 C CB . ASP A 1 333 ? 42.727 -13.637 -21.128 1.00 121.48 ? 354 ASP A CB 1 ATOM 2597 C CG . ASP A 1 333 ? 41.689 -12.533 -21.226 1.00 130.65 ? 354 ASP A CG 1 ATOM 2598 O OD1 . ASP A 1 333 ? 41.498 -11.800 -20.232 1.00 132.42 ? 354 ASP A OD1 1 ATOM 2599 O OD2 . ASP A 1 333 ? 41.063 -12.399 -22.300 1.00 135.26 ? 354 ASP A OD2 1 ATOM 2600 N N . PRO A 1 334 ? 44.472 -15.555 -19.070 1.00 96.86 ? 355 PRO A N 1 ATOM 2601 C CA . PRO A 1 334 ? 45.326 -16.741 -18.966 1.00 100.01 ? 355 PRO A CA 1 ATOM 2602 C C . PRO A 1 334 ? 45.617 -17.358 -20.328 1.00 100.73 ? 355 PRO A C 1 ATOM 2603 O O . PRO A 1 334 ? 44.694 -17.676 -21.078 1.00 110.44 ? 355 PRO A O 1 ATOM 2604 C CB . PRO A 1 334 ? 44.487 -17.693 -18.113 1.00 106.03 ? 355 PRO A CB 1 ATOM 2605 C CG . PRO A 1 334 ? 43.705 -16.783 -17.228 1.00 105.84 ? 355 PRO A CG 1 ATOM 2606 C CD . PRO A 1 334 ? 43.395 -15.562 -18.065 1.00 103.73 ? 355 PRO A CD 1 ATOM 2607 N N . LEU A 1 335 ? 46.899 -17.521 -20.634 1.00 97.24 ? 356 LEU A N 1 ATOM 2608 C CA . LEU A 1 335 ? 47.332 -18.051 -21.921 1.00 100.32 ? 356 LEU A CA 1 ATOM 2609 C C . LEU A 1 335 ? 48.005 -19.407 -21.743 1.00 100.15 ? 356 LEU A C 1 ATOM 2610 O O . LEU A 1 335 ? 49.092 -19.492 -21.177 1.00 100.09 ? 356 LEU A O 1 ATOM 2611 C CB . LEU A 1 335 ? 48.299 -17.065 -22.587 1.00 100.41 ? 356 LEU A CB 1 ATOM 2612 C CG . LEU A 1 335 ? 48.901 -17.366 -23.964 1.00 109.58 ? 356 LEU A CG 1 ATOM 2613 C CD1 . LEU A 1 335 ? 49.527 -16.108 -24.531 1.00 109.80 ? 356 LEU A CD1 1 ATOM 2614 C CD2 . LEU A 1 335 ? 49.935 -18.483 -23.910 1.00 112.37 ? 356 LEU A CD2 1 ATOM 2615 N N . LEU A 1 336 ? 47.364 -20.465 -22.226 1.00 100.85 ? 357 LEU A N 1 ATOM 2616 C CA . LEU A 1 336 ? 47.955 -21.796 -22.147 1.00 101.10 ? 357 LEU A CA 1 ATOM 2617 C C . LEU A 1 336 ? 48.293 -22.331 -23.541 1.00 107.18 ? 357 LEU A C 1 ATOM 2618 O O . LEU A 1 336 ? 47.813 -21.811 -24.550 1.00 110.51 ? 357 LEU A O 1 ATOM 2619 C CB . LEU A 1 336 ? 47.041 -22.761 -21.388 1.00 99.73 ? 357 LEU A CB 1 ATOM 2620 C CG . LEU A 1 336 ? 47.746 -23.884 -20.623 1.00 96.76 ? 357 LEU A CG 1 ATOM 2621 C CD1 . LEU A 1 336 ? 48.550 -23.314 -19.460 1.00 89.62 ? 357 LEU A CD1 1 ATOM 2622 C CD2 . LEU A 1 336 ? 46.745 -24.923 -20.128 1.00 99.45 ? 357 LEU A CD2 1 ATOM 2623 N N . THR A 1 337 ? 49.119 -23.371 -23.587 1.00 108.33 ? 358 THR A N 1 ATOM 2624 C CA . THR A 1 337 ? 49.678 -23.865 -24.845 1.00 109.25 ? 358 THR A CA 1 ATOM 2625 C C . THR A 1 337 ? 48.661 -24.436 -25.837 1.00 119.13 ? 358 THR A C 1 ATOM 2626 O O . THR A 1 337 ? 47.772 -25.204 -25.468 1.00 119.81 ? 358 THR A O 1 ATOM 2627 C CB . THR A 1 337 ? 50.798 -24.902 -24.595 1.00 108.98 ? 358 THR A CB 1 ATOM 2628 O OG1 . THR A 1 337 ? 50.735 -25.925 -25.595 1.00 113.65 ? 358 THR A OG1 1 ATOM 2629 C CG2 . THR A 1 337 ? 50.644 -25.536 -23.217 1.00 111.51 ? 358 THR A CG2 1 ATOM 2630 N N . ARG A 1 338 ? 48.811 -24.041 -27.099 1.00 126.80 ? 359 ARG A N 1 ATOM 2631 C CA . ARG A 1 338 ? 48.014 -24.570 -28.200 1.00 135.44 ? 359 ARG A CA 1 ATOM 2632 C C . ARG A 1 338 ? 48.889 -24.724 -29.434 1.00 138.31 ? 359 ARG A C 1 ATOM 2633 O O . ARG A 1 338 ? 50.000 -25.250 -29.367 1.00 138.61 ? 359 ARG A O 1 ATOM 2634 C CB . ARG A 1 338 ? 46.864 -23.626 -28.548 1.00 137.90 ? 359 ARG A CB 1 ATOM 2635 C CG . ARG A 1 338 ? 45.992 -23.226 -27.385 1.00 140.50 ? 359 ARG A CG 1 ATOM 2636 C CD . ARG A 1 338 ? 44.817 -22.391 -27.862 1.00 146.15 ? 359 ARG A CD 1 ATOM 2637 N NE . ARG A 1 338 ? 45.225 -21.342 -28.793 1.00 146.11 ? 359 ARG A NE 1 ATOM 2638 C CZ . ARG A 1 338 ? 45.740 -20.173 -28.425 1.00 140.56 ? 359 ARG A CZ 1 ATOM 2639 N NH1 . ARG A 1 338 ? 45.921 -19.899 -27.138 1.00 132.10 ? 359 ARG A NH1 1 ATOM 2640 N NH2 . ARG A 1 338 ? 46.077 -19.279 -29.345 1.00 140.05 ? 359 ARG A NH2 1 ATOM 2641 N N . ASP A 1 339 ? 48.372 -24.246 -30.560 1.00 140.60 ? 360 ASP A N 1 ATOM 2642 C CA . ASP A 1 339 ? 49.109 -24.217 -31.816 1.00 142.29 ? 360 ASP A CA 1 ATOM 2643 C C . ASP A 1 339 ? 48.825 -22.888 -32.503 1.00 134.31 ? 360 ASP A C 1 ATOM 2644 O O . ASP A 1 339 ? 47.675 -22.451 -32.561 1.00 131.83 ? 360 ASP A O 1 ATOM 2645 C CB . ASP A 1 339 ? 48.675 -25.373 -32.717 1.00 154.07 ? 360 ASP A CB 1 ATOM 2646 C CG . ASP A 1 339 ? 48.781 -26.721 -32.030 1.00 160.86 ? 360 ASP A CG 1 ATOM 2647 O OD1 . ASP A 1 339 ? 47.947 -27.604 -32.324 1.00 164.16 ? 360 ASP A OD1 1 ATOM 2648 O OD2 . ASP A 1 339 ? 49.693 -26.897 -31.194 1.00 160.40 ? 360 ASP A OD2 1 ATOM 2649 N N . ARG A 1 340 ? 49.864 -22.241 -33.023 1.00 130.10 ? 361 ARG A N 1 ATOM 2650 C CA . ARG A 1 340 ? 51.223 -22.771 -33.001 1.00 126.39 ? 361 ARG A CA 1 ATOM 2651 C C . ARG A 1 340 ? 51.965 -22.292 -31.755 1.00 118.65 ? 361 ARG A C 1 ATOM 2652 O O . ARG A 1 340 ? 53.179 -22.077 -31.777 1.00 113.00 ? 361 ARG A O 1 ATOM 2653 C CB . ARG A 1 340 ? 51.974 -22.337 -34.265 1.00 128.97 ? 361 ARG A CB 1 ATOM 2654 C CG . ARG A 1 340 ? 51.123 -22.352 -35.538 1.00 133.16 ? 361 ARG A CG 1 ATOM 2655 C CD . ARG A 1 340 ? 50.556 -20.970 -35.884 1.00 133.77 ? 361 ARG A CD 1 ATOM 2656 N NE . ARG A 1 340 ? 49.783 -20.374 -34.796 1.00 134.40 ? 361 ARG A NE 1 ATOM 2657 C CZ . ARG A 1 340 ? 49.219 -19.171 -34.849 1.00 132.79 ? 361 ARG A CZ 1 ATOM 2658 N NH1 . ARG A 1 340 ? 49.340 -18.430 -35.940 1.00 134.37 ? 361 ARG A NH1 1 ATOM 2659 N NH2 . ARG A 1 340 ? 48.535 -18.706 -33.811 1.00 129.17 ? 361 ARG A NH2 1 ATOM 2660 N N . ILE A 1 341 ? 51.218 -22.137 -30.668 1.00 116.09 ? 362 ILE A N 1 ATOM 2661 C CA . ILE A 1 341 ? 51.741 -21.583 -29.429 1.00 111.54 ? 362 ILE A CA 1 ATOM 2662 C C . ILE A 1 341 ? 52.190 -22.665 -28.453 1.00 114.13 ? 362 ILE A C 1 ATOM 2663 O O . ILE A 1 341 ? 51.367 -23.343 -27.839 1.00 115.73 ? 362 ILE A O 1 ATOM 2664 C CB . ILE A 1 341 ? 50.685 -20.709 -28.740 1.00 109.51 ? 362 ILE A CB 1 ATOM 2665 C CG1 . ILE A 1 341 ? 50.226 -19.598 -29.684 1.00 109.86 ? 362 ILE A CG1 1 ATOM 2666 C CG2 . ILE A 1 341 ? 51.236 -20.141 -27.436 1.00 105.85 ? 362 ILE A CG2 1 ATOM 2667 C CD1 . ILE A 1 341 ? 49.040 -18.818 -29.176 1.00 110.59 ? 362 ILE A CD1 1 ATOM 2668 N N . GLN A 1 342 ? 53.501 -22.814 -28.310 1.00 111.16 ? 363 GLN A N 1 ATOM 2669 C CA . GLN A 1 342 ? 54.065 -23.805 -27.409 1.00 110.33 ? 363 GLN A CA 1 ATOM 2670 C C . GLN A 1 342 ? 54.624 -23.148 -26.148 1.00 103.43 ? 363 GLN A C 1 ATOM 2671 O O . GLN A 1 342 ? 55.691 -22.530 -26.183 1.00 99.11 ? 363 GLN A O 1 ATOM 2672 C CB . GLN A 1 342 ? 55.163 -24.601 -28.118 1.00 116.32 ? 363 GLN A CB 1 ATOM 2673 C CG . GLN A 1 342 ? 55.798 -25.655 -27.242 1.00 125.70 ? 363 GLN A CG 1 ATOM 2674 C CD . GLN A 1 342 ? 54.759 -26.495 -26.527 1.00 137.72 ? 363 GLN A CD 1 ATOM 2675 O OE1 . GLN A 1 342 ? 53.789 -26.950 -27.136 1.00 145.59 ? 363 GLN A OE1 1 ATOM 2676 N NE2 . GLN A 1 342 ? 54.951 -26.701 -25.228 1.00 135.86 ? 363 GLN A NE2 1 ATOM 2677 N N . ILE A 1 343 ? 53.906 -23.275 -25.033 1.00 98.78 ? 364 ILE A N 1 ATOM 2678 C CA . ILE A 1 343 ? 54.383 -22.691 -23.782 1.00 93.03 ? 364 ILE A CA 1 ATOM 2679 C C . ILE A 1 343 ? 54.781 -23.733 -22.737 1.00 93.39 ? 364 ILE A C 1 ATOM 2680 O O . ILE A 1 343 ? 53.943 -24.472 -22.220 1.00 94.67 ? 364 ILE A O 1 ATOM 2681 C CB . ILE A 1 343 ? 53.383 -21.675 -23.165 1.00 79.42 ? 364 ILE A CB 1 ATOM 2682 C CG1 . ILE A 1 343 ? 52.122 -22.362 -22.667 1.00 89.09 ? 364 ILE A CG1 1 ATOM 2683 C CG2 . ILE A 1 343 ? 53.011 -20.594 -24.156 1.00 73.27 ? 364 ILE A CG2 1 ATOM 2684 C CD1 . ILE A 1 343 ? 51.242 -21.432 -21.886 1.00 91.68 ? 364 ILE A CD1 1 ATOM 2685 N N . GLU A 1 344 ? 56.074 -23.785 -22.437 1.00 94.37 ? 365 GLU A N 1 ATOM 2686 C CA . GLU A 1 344 ? 56.583 -24.658 -21.388 1.00 100.03 ? 365 GLU A CA 1 ATOM 2687 C C . GLU A 1 344 ? 57.295 -23.874 -20.285 1.00 93.35 ? 365 GLU A C 1 ATOM 2688 O O . GLU A 1 344 ? 58.415 -23.395 -20.466 1.00 88.62 ? 365 GLU A O 1 ATOM 2689 C CB . GLU A 1 344 ? 57.508 -25.728 -21.973 1.00 108.54 ? 365 GLU A CB 1 ATOM 2690 C CG . GLU A 1 344 ? 56.777 -26.977 -22.433 1.00 119.99 ? 365 GLU A CG 1 ATOM 2691 C CD . GLU A 1 344 ? 56.045 -27.673 -21.298 1.00 128.98 ? 365 GLU A CD 1 ATOM 2692 O OE1 . GLU A 1 344 ? 56.380 -27.415 -20.121 1.00 130.39 ? 365 GLU A OE1 1 ATOM 2693 O OE2 . GLU A 1 344 ? 55.135 -28.482 -21.584 1.00 133.20 ? 365 GLU A OE2 1 ATOM 2694 N N . GLN A 1 345 ? 56.627 -23.745 -19.143 1.00 91.89 ? 366 GLN A N 1 ATOM 2695 C CA . GLN A 1 345 ? 57.193 -23.052 -17.993 1.00 86.33 ? 366 GLN A CA 1 ATOM 2696 C C . GLN A 1 345 ? 57.479 -21.585 -18.306 1.00 84.83 ? 366 GLN A C 1 ATOM 2697 O O . GLN A 1 345 ? 56.557 -20.816 -18.571 1.00 86.23 ? 366 GLN A O 1 ATOM 2698 C CB . GLN A 1 345 ? 58.453 -23.773 -17.506 1.00 85.53 ? 366 GLN A CB 1 ATOM 2699 C CG . GLN A 1 345 ? 58.200 -25.230 -17.126 1.00 90.01 ? 366 GLN A CG 1 ATOM 2700 C CD . GLN A 1 345 ? 59.477 -26.038 -16.977 1.00 94.34 ? 366 GLN A CD 1 ATOM 2701 O OE1 . GLN A 1 345 ? 59.682 -27.027 -17.683 1.00 98.16 ? 366 GLN A OE1 1 ATOM 2702 N NE2 . GLN A 1 345 ? 60.346 -25.617 -16.059 1.00 91.04 ? 366 GLN A NE2 1 ATOM 2703 N N . GLY A 1 346 ? 58.752 -21.202 -18.275 1.00 79.04 ? 367 GLY A N 1 ATOM 2704 C CA . GLY A 1 346 ? 59.136 -19.824 -18.519 1.00 74.90 ? 367 GLY A CA 1 ATOM 2705 C C . GLY A 1 346 ? 59.477 -19.544 -19.971 1.00 75.33 ? 367 GLY A C 1 ATOM 2706 O O . GLY A 1 346 ? 60.254 -18.636 -20.275 1.00 71.71 ? 367 GLY A O 1 ATOM 2707 N N . THR A 1 347 ? 58.895 -20.323 -20.876 1.00 74.05 ? 368 THR A N 1 ATOM 2708 C CA . THR A 1 347 ? 59.190 -20.173 -22.296 1.00 72.75 ? 368 THR A CA 1 ATOM 2709 C C . THR A 1 347 ? 57.934 -20.144 -23.160 1.00 73.08 ? 368 THR A C 1 ATOM 2710 O O . THR A 1 347 ? 57.006 -20.927 -22.961 1.00 79.16 ? 368 THR A O 1 ATOM 2711 C CB . THR A 1 347 ? 60.122 -21.291 -22.805 1.00 76.92 ? 368 THR A CB 1 ATOM 2712 O OG1 . THR A 1 347 ? 59.445 -22.554 -22.744 1.00 84.41 ? 368 THR A OG1 1 ATOM 2713 C CG2 . THR A 1 347 ? 61.394 -21.349 -21.968 1.00 68.81 ? 368 THR A CG2 1 ATOM 2714 N N . LEU A 1 348 ? 57.918 -19.232 -24.125 1.00 64.10 ? 369 LEU A N 1 ATOM 2715 C CA . LEU A 1 348 ? 56.811 -19.122 -25.057 1.00 68.24 ? 369 LEU A CA 1 ATOM 2716 C C . LEU A 1 348 ? 57.368 -19.274 -26.462 1.00 76.65 ? 369 LEU A C 1 ATOM 2717 O O . LEU A 1 348 ? 58.381 -18.659 -26.808 1.00 75.20 ? 369 LEU A O 1 ATOM 2718 C CB . LEU A 1 348 ? 56.084 -17.779 -24.892 1.00 54.36 ? 369 LEU A CB 1 ATOM 2719 C CG . LEU A 1 348 ? 54.909 -17.501 -25.847 1.00 56.87 ? 369 LEU A CG 1 ATOM 2720 C CD1 . LEU A 1 348 ? 53.863 -16.579 -25.235 1.00 59.40 ? 369 LEU A CD1 1 ATOM 2721 C CD2 . LEU A 1 348 ? 55.405 -16.932 -27.175 1.00 57.23 ? 369 LEU A CD2 1 ATOM 2722 N N . ASN A 1 349 ? 56.702 -20.096 -27.266 1.00 84.77 ? 370 ASN A N 1 ATOM 2723 C CA . ASN A 1 349 ? 57.176 -20.410 -28.608 1.00 87.92 ? 370 ASN A CA 1 ATOM 2724 C C . ASN A 1 349 ? 56.068 -20.330 -29.652 1.00 85.95 ? 370 ASN A C 1 ATOM 2725 O O . ASN A 1 349 ? 55.132 -21.126 -29.639 1.00 87.73 ? 370 ASN A O 1 ATOM 2726 C CB . ASN A 1 349 ? 57.802 -21.806 -28.625 1.00 96.48 ? 370 ASN A CB 1 ATOM 2727 C CG . ASN A 1 349 ? 58.966 -21.909 -29.583 1.00 106.93 ? 370 ASN A CG 1 ATOM 2728 O OD1 . ASN A 1 349 ? 58.933 -21.353 -30.679 1.00 103.71 ? 370 ASN A OD1 1 ATOM 2729 N ND2 . ASN A 1 349 ? 60.016 -22.608 -29.162 1.00 125.92 ? 370 ASN A ND2 1 ATOM 2730 N N . ILE A 1 350 ? 56.171 -19.360 -30.552 1.00 85.75 ? 371 ILE A N 1 ATOM 2731 C CA . ILE A 1 350 ? 55.262 -19.298 -31.686 1.00 89.87 ? 371 ILE A CA 1 ATOM 2732 C C . ILE A 1 350 ? 55.998 -19.748 -32.946 1.00 92.33 ? 371 ILE A C 1 ATOM 2733 O O . ILE A 1 350 ? 56.905 -19.069 -33.417 1.00 87.84 ? 371 ILE A O 1 ATOM 2734 C CB . ILE A 1 350 ? 54.689 -17.882 -31.885 1.00 85.62 ? 371 ILE A CB 1 ATOM 2735 C CG1 . ILE A 1 350 ? 54.173 -17.323 -30.559 1.00 85.37 ? 371 ILE A CG1 1 ATOM 2736 C CG2 . ILE A 1 350 ? 53.577 -17.902 -32.914 1.00 85.67 ? 371 ILE A CG2 1 ATOM 2737 C CD1 . ILE A 1 350 ? 53.313 -16.086 -30.717 1.00 86.93 ? 371 ILE A CD1 1 ATOM 2738 N N . THR A 1 351 ? 55.614 -20.906 -33.474 1.00 103.01 ? 372 THR A N 1 ATOM 2739 C CA . THR A 1 351 ? 56.270 -21.470 -34.653 1.00 109.35 ? 372 THR A CA 1 ATOM 2740 C C . THR A 1 351 ? 56.046 -20.619 -35.902 1.00 110.64 ? 372 THR A C 1 ATOM 2741 O O . THR A 1 351 ? 56.989 -20.312 -36.632 1.00 111.47 ? 372 THR A O 1 ATOM 2742 C CB . THR A 1 351 ? 55.804 -22.912 -34.915 1.00 115.26 ? 372 THR A CB 1 ATOM 2743 O OG1 . THR A 1 351 ? 56.500 -23.802 -34.033 1.00 114.67 ? 372 THR A OG1 1 ATOM 2744 C CG2 . THR A 1 351 ? 56.079 -23.315 -36.359 1.00 117.62 ? 372 THR A CG2 1 ATOM 2745 N N . ILE A 1 352 ? 54.795 -20.248 -36.148 1.00 109.87 ? 373 ILE A N 1 ATOM 2746 C CA . ILE A 1 352 ? 54.470 -19.330 -37.236 1.00 107.57 ? 373 ILE A CA 1 ATOM 2747 C C . ILE A 1 352 ? 53.484 -18.281 -36.737 1.00 108.98 ? 373 ILE A C 1 ATOM 2748 O O . ILE A 1 352 ? 52.593 -18.579 -35.942 1.00 115.62 ? 373 ILE A O 1 ATOM 2749 C CB . ILE A 1 352 ? 53.907 -20.067 -38.469 1.00 103.98 ? 373 ILE A CB 1 ATOM 2750 C CG1 . ILE A 1 352 ? 54.979 -20.969 -39.083 1.00 97.64 ? 373 ILE A CG1 1 ATOM 2751 C CG2 . ILE A 1 352 ? 53.409 -19.076 -39.512 1.00 107.51 ? 373 ILE A CG2 1 ATOM 2752 C CD1 . ILE A 1 352 ? 54.527 -21.676 -40.335 1.00 103.86 ? 373 ILE A CD1 1 ATOM 2753 N N . VAL A 1 353 ? 53.654 -17.049 -37.198 1.00 102.39 ? 374 VAL A N 1 ATOM 2754 C CA . VAL A 1 353 ? 52.900 -15.925 -36.661 1.00 99.10 ? 374 VAL A CA 1 ATOM 2755 C C . VAL A 1 353 ? 51.836 -15.417 -37.630 1.00 99.73 ? 374 VAL A C 1 ATOM 2756 O O . VAL A 1 353 ? 51.997 -15.513 -38.841 1.00 101.89 ? 374 VAL A O 1 ATOM 2757 C CB . VAL A 1 353 ? 53.854 -14.775 -36.265 1.00 91.48 ? 374 VAL A CB 1 ATOM 2758 C CG1 . VAL A 1 353 ? 53.140 -13.428 -36.288 1.00 95.65 ? 374 VAL A CG1 1 ATOM 2759 C CG2 . VAL A 1 353 ? 54.471 -15.053 -34.904 1.00 73.16 ? 374 VAL A CG2 1 ATOM 2760 N N . ASN A 1 354 ? 50.738 -14.903 -37.084 1.00 102.36 ? 375 ASN A N 1 ATOM 2761 C CA . ASN A 1 354 ? 49.725 -14.221 -37.882 1.00 107.89 ? 375 ASN A CA 1 ATOM 2762 C C . ASN A 1 354 ? 49.275 -12.934 -37.197 1.00 108.04 ? 375 ASN A C 1 ATOM 2763 O O . ASN A 1 354 ? 49.482 -12.760 -35.996 1.00 104.04 ? 375 ASN A O 1 ATOM 2764 C CB . ASN A 1 354 ? 48.531 -15.138 -38.177 1.00 112.31 ? 375 ASN A CB 1 ATOM 2765 C CG . ASN A 1 354 ? 47.869 -15.669 -36.920 1.00 113.66 ? 375 ASN A CG 1 ATOM 2766 O OD1 . ASN A 1 354 ? 47.839 -15.002 -35.886 1.00 108.67 ? 375 ASN A OD1 1 ATOM 2767 N ND2 . ASN A 1 354 ? 47.327 -16.876 -37.006 1.00 118.97 ? 375 ASN A ND2 1 ATOM 2768 N N . LEU A 1 355 ? 48.672 -12.033 -37.966 1.00 112.68 ? 376 LEU A N 1 ATOM 2769 C CA . LEU A 1 355 ? 48.236 -10.741 -37.441 1.00 111.04 ? 376 LEU A CA 1 ATOM 2770 C C . LEU A 1 355 ? 47.480 -10.885 -36.126 1.00 105.27 ? 376 LEU A C 1 ATOM 2771 O O . LEU A 1 355 ? 47.491 -9.984 -35.289 1.00 97.09 ? 376 LEU A O 1 ATOM 2772 C CB . LEU A 1 355 ? 47.368 -10.007 -38.470 1.00 113.16 ? 376 LEU A CB 1 ATOM 2773 C CG . LEU A 1 355 ? 48.111 -9.154 -39.500 1.00 113.35 ? 376 LEU A CG 1 ATOM 2774 C CD1 . LEU A 1 355 ? 47.247 -8.902 -40.727 1.00 120.66 ? 376 LEU A CD1 1 ATOM 2775 C CD2 . LEU A 1 355 ? 48.573 -7.840 -38.885 1.00 106.61 ? 376 LEU A CD2 1 ATOM 2776 N N . SER A 1 356 ? 46.831 -12.030 -35.953 1.00 111.75 ? 377 SER A N 1 ATOM 2777 C CA . SER A 1 356 ? 46.014 -12.290 -34.775 1.00 112.43 ? 377 SER A CA 1 ATOM 2778 C C . SER A 1 356 ? 46.841 -12.284 -33.495 1.00 111.85 ? 377 SER A C 1 ATOM 2779 O O . SER A 1 356 ? 46.326 -11.999 -32.412 1.00 115.50 ? 377 SER A O 1 ATOM 2780 C CB . SER A 1 356 ? 45.303 -13.637 -34.923 1.00 112.36 ? 377 SER A CB 1 ATOM 2781 O OG . SER A 1 356 ? 44.219 -13.747 -34.024 1.00 110.80 ? 377 SER A OG 1 ATOM 2782 N N . ASP A 1 357 ? 48.125 -12.599 -33.623 1.00 108.71 ? 378 ASP A N 1 ATOM 2783 C CA . ASP A 1 357 ? 48.985 -12.776 -32.456 1.00 101.94 ? 378 ASP A CA 1 ATOM 2784 C C . ASP A 1 357 ? 49.419 -11.455 -31.823 1.00 89.20 ? 378 ASP A C 1 ATOM 2785 O O . ASP A 1 357 ? 49.533 -11.361 -30.605 1.00 86.30 ? 378 ASP A O 1 ATOM 2786 C CB . ASP A 1 357 ? 50.200 -13.635 -32.814 1.00 104.83 ? 378 ASP A CB 1 ATOM 2787 C CG . ASP A 1 357 ? 49.810 -15.026 -33.291 1.00 110.80 ? 378 ASP A CG 1 ATOM 2788 O OD1 . ASP A 1 357 ? 48.786 -15.563 -32.808 1.00 107.84 ? 378 ASP A OD1 1 ATOM 2789 O OD2 . ASP A 1 357 ? 50.529 -15.582 -34.150 1.00 114.92 ? 378 ASP A OD2 1 ATOM 2790 N N . ALA A 1 358 ? 49.652 -10.442 -32.652 1.00 86.50 ? 379 ALA A N 1 ATOM 2791 C CA . ALA A 1 358 ? 50.013 -9.114 -32.161 1.00 81.46 ? 379 ALA A CA 1 ATOM 2792 C C . ALA A 1 358 ? 49.226 -8.747 -30.904 1.00 79.43 ? 379 ALA A C 1 ATOM 2793 O O . ALA A 1 358 ? 48.003 -8.876 -30.869 1.00 83.05 ? 379 ALA A O 1 ATOM 2794 C CB . ALA A 1 358 ? 49.799 -8.069 -33.247 1.00 80.43 ? 379 ALA A CB 1 ATOM 2795 N N . GLY A 1 359 ? 49.931 -8.294 -29.871 1.00 74.31 ? 380 GLY A N 1 ATOM 2796 C CA . GLY A 1 359 ? 49.284 -7.945 -28.619 1.00 74.93 ? 380 GLY A CA 1 ATOM 2797 C C . GLY A 1 359 ? 50.216 -7.872 -27.421 1.00 75.30 ? 380 GLY A C 1 ATOM 2798 O O . GLY A 1 359 ? 51.438 -7.927 -27.554 1.00 72.70 ? 380 GLY A O 1 ATOM 2799 N N . MET A 1 360 ? 49.623 -7.743 -26.240 1.00 73.06 ? 381 MET A N 1 ATOM 2800 C CA . MET A 1 360 ? 50.379 -7.627 -25.008 1.00 75.95 ? 381 MET A CA 1 ATOM 2801 C C . MET A 1 360 ? 50.514 -8.981 -24.335 1.00 70.29 ? 381 MET A C 1 ATOM 2802 O O . MET A 1 360 ? 49.532 -9.708 -24.185 1.00 69.50 ? 381 MET A O 1 ATOM 2803 C CB . MET A 1 360 ? 49.686 -6.648 -24.068 1.00 81.46 ? 381 MET A CB 1 ATOM 2804 C CG . MET A 1 360 ? 49.371 -5.321 -24.721 1.00 79.53 ? 381 MET A CG 1 ATOM 2805 S SD . MET A 1 360 ? 50.874 -4.463 -25.218 1.00 77.57 ? 381 MET A SD 1 ATOM 2806 C CE . MET A 1 360 ? 51.737 -4.294 -23.658 1.00 78.60 ? 381 MET A CE 1 ATOM 2807 N N . TYR A 1 361 ? 51.734 -9.319 -23.934 1.00 63.66 ? 382 TYR A N 1 ATOM 2808 C CA . TYR A 1 361 ? 51.969 -10.570 -23.222 1.00 62.49 ? 382 TYR A CA 1 ATOM 2809 C C . TYR A 1 361 ? 52.626 -10.333 -21.867 1.00 61.08 ? 382 TYR A C 1 ATOM 2810 O O . TYR A 1 361 ? 53.266 -9.307 -21.642 1.00 59.99 ? 382 TYR A O 1 ATOM 2811 C CB . TYR A 1 361 ? 52.802 -11.531 -24.068 1.00 63.04 ? 382 TYR A CB 1 ATOM 2812 C CG . TYR A 1 361 ? 52.090 -11.985 -25.322 1.00 76.53 ? 382 TYR A CG 1 ATOM 2813 C CD1 . TYR A 1 361 ? 52.074 -11.191 -26.464 1.00 77.01 ? 382 TYR A CD1 1 ATOM 2814 C CD2 . TYR A 1 361 ? 51.430 -13.202 -25.363 1.00 81.82 ? 382 TYR A CD2 1 ATOM 2815 C CE1 . TYR A 1 361 ? 51.420 -11.603 -27.613 1.00 85.23 ? 382 TYR A CE1 1 ATOM 2816 C CE2 . TYR A 1 361 ? 50.775 -13.621 -26.506 1.00 88.21 ? 382 TYR A CE2 1 ATOM 2817 C CZ . TYR A 1 361 ? 50.773 -12.822 -27.627 1.00 89.27 ? 382 TYR A CZ 1 ATOM 2818 O OH . TYR A 1 361 ? 50.121 -13.246 -28.762 1.00 95.02 ? 382 TYR A OH 1 ATOM 2819 N N . GLN A 1 362 ? 52.457 -11.290 -20.964 1.00 60.86 ? 383 GLN A N 1 ATOM 2820 C CA . GLN A 1 362 ? 52.951 -11.144 -19.608 1.00 61.55 ? 383 GLN A CA 1 ATOM 2821 C C . GLN A 1 362 ? 53.432 -12.473 -19.047 1.00 67.14 ? 383 GLN A C 1 ATOM 2822 O O . GLN A 1 362 ? 52.735 -13.480 -19.130 1.00 73.63 ? 383 GLN A O 1 ATOM 2823 C CB . GLN A 1 362 ? 51.859 -10.569 -18.709 1.00 61.97 ? 383 GLN A CB 1 ATOM 2824 C CG . GLN A 1 362 ? 51.557 -9.101 -18.943 1.00 64.82 ? 383 GLN A CG 1 ATOM 2825 C CD . GLN A 1 362 ? 50.493 -8.577 -17.997 1.00 70.71 ? 383 GLN A CD 1 ATOM 2826 O OE1 . GLN A 1 362 ? 49.332 -8.983 -18.066 1.00 73.42 ? 383 GLN A OE1 1 ATOM 2827 N NE2 . GLN A 1 362 ? 50.886 -7.676 -17.100 1.00 66.99 ? 383 GLN A NE2 1 ATOM 2828 N N . CYS A 1 363 ? 54.637 -12.469 -18.489 1.00 65.66 ? 384 CYS A N 1 ATOM 2829 C CA . CYS A 1 363 ? 55.159 -13.630 -17.788 1.00 61.25 ? 384 CYS A CA 1 ATOM 2830 C C . CYS A 1 363 ? 55.068 -13.351 -16.299 1.00 62.49 ? 384 CYS A C 1 ATOM 2831 O O . CYS A 1 363 ? 55.549 -12.325 -15.815 1.00 61.28 ? 384 CYS A O 1 ATOM 2832 C CB . CYS A 1 363 ? 56.607 -13.904 -18.190 1.00 59.85 ? 384 CYS A CB 1 ATOM 2833 S SG . CYS A 1 363 ? 57.353 -15.386 -17.443 1.00 85.54 ? 384 CYS A SG 1 ATOM 2834 N N . VAL A 1 364 ? 54.428 -14.262 -15.580 1.00 63.32 ? 385 VAL A N 1 ATOM 2835 C CA . VAL A 1 364 ? 54.266 -14.118 -14.147 1.00 60.58 ? 385 VAL A CA 1 ATOM 2836 C C . VAL A 1 364 ? 55.094 -15.169 -13.428 1.00 59.65 ? 385 VAL A C 1 ATOM 2837 O O . VAL A 1 364 ? 54.998 -16.359 -13.729 1.00 57.33 ? 385 VAL A O 1 ATOM 2838 C CB . VAL A 1 364 ? 52.791 -14.248 -13.738 1.00 61.48 ? 385 VAL A CB 1 ATOM 2839 C CG1 . VAL A 1 364 ? 52.631 -13.967 -12.256 1.00 56.42 ? 385 VAL A CG1 1 ATOM 2840 C CG2 . VAL A 1 364 ? 51.940 -13.289 -14.555 1.00 60.55 ? 385 VAL A CG2 1 ATOM 2841 N N . ALA A 1 365 ? 55.915 -14.719 -12.483 1.00 57.52 ? 386 ALA A N 1 ATOM 2842 C CA . ALA A 1 365 ? 56.755 -15.614 -11.701 1.00 51.69 ? 386 ALA A CA 1 ATOM 2843 C C . ALA A 1 365 ? 56.305 -15.589 -10.244 1.00 56.62 ? 386 ALA A C 1 ATOM 2844 O O . ALA A 1 365 ? 56.062 -14.523 -9.682 1.00 63.08 ? 386 ALA A O 1 ATOM 2845 C CB . ALA A 1 365 ? 58.218 -15.207 -11.826 1.00 45.78 ? 386 ALA A CB 1 ATOM 2846 N N . GLU A 1 366 ? 56.184 -16.761 -9.634 1.00 56.66 ? 387 GLU A N 1 ATOM 2847 C CA . GLU A 1 366 ? 55.623 -16.849 -8.289 1.00 62.38 ? 387 GLU A CA 1 ATOM 2848 C C . GLU A 1 366 ? 56.238 -17.967 -7.460 1.00 63.30 ? 387 GLU A C 1 ATOM 2849 O O . GLU A 1 366 ? 56.590 -19.024 -7.983 1.00 61.23 ? 387 GLU A O 1 ATOM 2850 C CB . GLU A 1 366 ? 54.107 -17.058 -8.365 1.00 71.93 ? 387 GLU A CB 1 ATOM 2851 C CG . GLU A 1 366 ? 53.704 -18.435 -8.873 1.00 84.97 ? 387 GLU A CG 1 ATOM 2852 C CD . GLU A 1 366 ? 52.507 -18.392 -9.810 1.00 103.33 ? 387 GLU A CD 1 ATOM 2853 O OE1 . GLU A 1 366 ? 52.276 -19.389 -10.530 1.00 109.45 ? 387 GLU A OE1 1 ATOM 2854 O OE2 . GLU A 1 366 ? 51.802 -17.360 -9.834 1.00 108.46 ? 387 GLU A OE2 1 ATOM 2855 N N . ASN A 1 367 ? 56.382 -17.707 -6.165 1.00 66.91 ? 388 ASN A N 1 ATOM 2856 C CA . ASN A 1 367 ? 56.595 -18.754 -5.175 1.00 65.26 ? 388 ASN A CA 1 ATOM 2857 C C . ASN A 1 367 ? 55.655 -18.485 -4.008 1.00 69.35 ? 388 ASN A C 1 ATOM 2858 O O . ASN A 1 367 ? 54.992 -17.448 -3.977 1.00 66.49 ? 388 ASN A O 1 ATOM 2859 C CB . ASN A 1 367 ? 58.060 -18.839 -4.727 1.00 57.97 ? 388 ASN A CB 1 ATOM 2860 C CG . ASN A 1 367 ? 58.530 -17.602 -3.985 1.00 57.47 ? 388 ASN A CG 1 ATOM 2861 O OD1 . ASN A 1 367 ? 57.731 -16.771 -3.560 1.00 61.79 ? 388 ASN A OD1 1 ATOM 2862 N ND2 . ASN A 1 367 ? 59.844 -17.481 -3.819 1.00 55.09 ? 388 ASN A ND2 1 ATOM 2863 N N . LYS A 1 368 ? 55.583 -19.406 -3.052 1.00 71.51 ? 389 LYS A N 1 ATOM 2864 C CA . LYS A 1 368 ? 54.593 -19.275 -1.991 1.00 74.01 ? 389 LYS A CA 1 ATOM 2865 C C . LYS A 1 368 ? 54.754 -17.984 -1.193 1.00 76.76 ? 389 LYS A C 1 ATOM 2866 O O . LYS A 1 368 ? 53.901 -17.660 -0.367 1.00 82.06 ? 389 LYS A O 1 ATOM 2867 C CB . LYS A 1 368 ? 54.618 -20.485 -1.064 1.00 80.85 ? 389 LYS A CB 1 ATOM 2868 C CG . LYS A 1 368 ? 55.797 -20.523 -0.110 1.00 82.01 ? 389 LYS A CG 1 ATOM 2869 C CD . LYS A 1 368 ? 55.695 -21.729 0.807 1.00 85.17 ? 389 LYS A CD 1 ATOM 2870 C CE . LYS A 1 368 ? 56.878 -21.797 1.754 1.00 85.14 ? 389 LYS A CE 1 ATOM 2871 N NZ . LYS A 1 368 ? 56.736 -22.915 2.728 1.00 82.57 ? 389 LYS A NZ 1 ATOM 2872 N N . HIS A 1 369 ? 55.838 -17.248 -1.447 1.00 70.51 ? 390 HIS A N 1 ATOM 2873 C CA . HIS A 1 369 ? 56.091 -15.980 -0.755 1.00 67.23 ? 390 HIS A CA 1 ATOM 2874 C C . HIS A 1 369 ? 55.752 -14.738 -1.586 1.00 67.70 ? 390 HIS A C 1 ATOM 2875 O O . HIS A 1 369 ? 55.523 -13.667 -1.027 1.00 69.02 ? 390 HIS A O 1 ATOM 2876 C CB . HIS A 1 369 ? 57.543 -15.883 -0.260 1.00 63.74 ? 390 HIS A CB 1 ATOM 2877 C CG . HIS A 1 369 ? 57.971 -17.023 0.609 1.00 70.50 ? 390 HIS A CG 1 ATOM 2878 N ND1 . HIS A 1 369 ? 57.514 -17.190 1.900 1.00 72.69 ? 390 HIS A ND1 1 ATOM 2879 C CD2 . HIS A 1 369 ? 58.826 -18.049 0.378 1.00 74.54 ? 390 HIS A CD2 1 ATOM 2880 C CE1 . HIS A 1 369 ? 58.063 -18.272 2.421 1.00 75.67 ? 390 HIS A CE1 1 ATOM 2881 N NE2 . HIS A 1 369 ? 58.862 -18.812 1.522 1.00 77.48 ? 390 HIS A NE2 1 ATOM 2882 N N . GLY A 1 370 ? 55.728 -14.862 -2.909 1.00 75.93 ? 391 GLY A N 1 ATOM 2883 C CA . GLY A 1 370 ? 55.457 -13.699 -3.739 1.00 76.29 ? 391 GLY A CA 1 ATOM 2884 C C . GLY A 1 370 ? 55.220 -13.944 -5.217 1.00 78.44 ? 391 GLY A C 1 ATOM 2885 O O . GLY A 1 370 ? 55.585 -14.986 -5.760 1.00 81.83 ? 391 GLY A O 1 ATOM 2886 N N . VAL A 1 371 ? 54.598 -12.960 -5.863 1.00 73.98 ? 392 VAL A N 1 ATOM 2887 C CA . VAL A 1 371 ? 54.386 -12.968 -7.306 1.00 74.36 ? 392 VAL A CA 1 ATOM 2888 C C . VAL A 1 371 ? 54.961 -11.703 -7.953 1.00 69.59 ? 392 VAL A C 1 ATOM 2889 O O . VAL A 1 371 ? 54.942 -10.619 -7.362 1.00 68.09 ? 392 VAL A O 1 ATOM 2890 C CB . VAL A 1 371 ? 52.890 -13.062 -7.658 1.00 80.07 ? 392 VAL A CB 1 ATOM 2891 C CG1 . VAL A 1 371 ? 52.298 -14.358 -7.130 1.00 83.98 ? 392 VAL A CG1 1 ATOM 2892 C CG2 . VAL A 1 371 ? 52.140 -11.861 -7.101 1.00 80.43 ? 392 VAL A CG2 1 ATOM 2893 N N . ILE A 1 372 ? 55.484 -11.848 -9.166 1.00 62.31 ? 393 ILE A N 1 ATOM 2894 C CA . ILE A 1 372 ? 55.974 -10.701 -9.925 1.00 59.90 ? 393 ILE A CA 1 ATOM 2895 C C . ILE A 1 372 ? 55.485 -10.761 -11.366 1.00 60.78 ? 393 ILE A C 1 ATOM 2896 O O . ILE A 1 372 ? 55.337 -11.843 -11.942 1.00 61.43 ? 393 ILE A O 1 ATOM 2897 C CB . ILE A 1 372 ? 57.512 -10.591 -9.907 1.00 54.12 ? 393 ILE A CB 1 ATOM 2898 C CG1 . ILE A 1 372 ? 58.146 -11.863 -10.470 1.00 52.51 ? 393 ILE A CG1 1 ATOM 2899 C CG2 . ILE A 1 372 ? 58.020 -10.296 -8.492 1.00 53.49 ? 393 ILE A CG2 1 ATOM 2900 C CD1 . ILE A 1 372 ? 59.649 -11.838 -10.443 1.00 52.71 ? 393 ILE A CD1 1 ATOM 2901 N N . PHE A 1 373 ? 55.226 -9.590 -11.938 1.00 62.93 ? 394 PHE A N 1 ATOM 2902 C CA . PHE A 1 373 ? 54.693 -9.490 -13.294 1.00 65.38 ? 394 PHE A CA 1 ATOM 2903 C C . PHE A 1 373 ? 55.666 -8.792 -14.240 1.00 67.92 ? 394 PHE A C 1 ATOM 2904 O O . PHE A 1 373 ? 56.305 -7.804 -13.873 1.00 65.95 ? 394 PHE A O 1 ATOM 2905 C CB . PHE A 1 373 ? 53.367 -8.729 -13.279 1.00 63.79 ? 394 PHE A CB 1 ATOM 2906 C CG . PHE A 1 373 ? 52.227 -9.502 -12.674 1.00 64.32 ? 394 PHE A CG 1 ATOM 2907 C CD1 . PHE A 1 373 ? 51.244 -10.056 -13.481 1.00 67.64 ? 394 PHE A CD1 1 ATOM 2908 C CD2 . PHE A 1 373 ? 52.134 -9.673 -11.303 1.00 64.19 ? 394 PHE A CD2 1 ATOM 2909 C CE1 . PHE A 1 373 ? 50.195 -10.763 -12.932 1.00 71.78 ? 394 PHE A CE1 1 ATOM 2910 C CE2 . PHE A 1 373 ? 51.089 -10.380 -10.749 1.00 66.20 ? 394 PHE A CE2 1 ATOM 2911 C CZ . PHE A 1 373 ? 50.118 -10.926 -11.563 1.00 71.01 ? 394 PHE A CZ 1 ATOM 2912 N N . SER A 1 374 ? 55.775 -9.312 -15.458 1.00 70.03 ? 395 SER A N 1 ATOM 2913 C CA . SER A 1 374 ? 56.514 -8.634 -16.519 1.00 63.96 ? 395 SER A CA 1 ATOM 2914 C C . SER A 1 374 ? 55.664 -8.609 -17.776 1.00 67.33 ? 395 SER A C 1 ATOM 2915 O O . SER A 1 374 ? 54.872 -9.520 -18.004 1.00 74.73 ? 395 SER A O 1 ATOM 2916 C CB . SER A 1 374 ? 57.853 -9.321 -16.800 1.00 64.56 ? 395 SER A CB 1 ATOM 2917 O OG . SER A 1 374 ? 57.683 -10.511 -17.546 1.00 65.83 ? 395 SER A OG 1 ATOM 2918 N N . SER A 1 375 ? 55.819 -7.569 -18.589 1.00 63.15 ? 396 SER A N 1 ATOM 2919 C CA . SER A 1 375 ? 55.006 -7.438 -19.796 1.00 64.44 ? 396 SER A CA 1 ATOM 2920 C C . SER A 1 375 ? 55.785 -6.913 -21.000 1.00 62.18 ? 396 SER A C 1 ATOM 2921 O O . SER A 1 375 ? 56.733 -6.140 -20.862 1.00 58.51 ? 396 SER A O 1 ATOM 2922 C CB . SER A 1 375 ? 53.793 -6.544 -19.534 1.00 68.32 ? 396 SER A CB 1 ATOM 2923 O OG . SER A 1 375 ? 54.172 -5.182 -19.488 1.00 72.53 ? 396 SER A OG 1 ATOM 2924 N N . ALA A 1 376 ? 55.376 -7.344 -22.187 1.00 61.86 ? 397 ALA A N 1 ATOM 2925 C CA . ALA A 1 376 ? 55.978 -6.850 -23.419 1.00 57.78 ? 397 ALA A CA 1 ATOM 2926 C C . ALA A 1 376 ? 54.966 -6.868 -24.554 1.00 63.73 ? 397 ALA A C 1 ATOM 2927 O O . ALA A 1 376 ? 54.003 -7.642 -24.539 1.00 62.20 ? 397 ALA A O 1 ATOM 2928 C CB . ALA A 1 376 ? 57.216 -7.669 -23.785 1.00 44.89 ? 397 ALA A CB 1 ATOM 2929 N N . GLU A 1 377 ? 55.182 -6.005 -25.537 1.00 69.50 ? 398 GLU A N 1 ATOM 2930 C CA . GLU A 1 377 ? 54.316 -5.976 -26.703 1.00 68.64 ? 398 GLU A CA 1 ATOM 2931 C C . GLU A 1 377 ? 54.878 -6.865 -27.806 1.00 71.95 ? 398 GLU A C 1 ATOM 2932 O O . GLU A 1 377 ? 56.093 -6.997 -27.959 1.00 65.19 ? 398 GLU A O 1 ATOM 2933 C CB . GLU A 1 377 ? 54.123 -4.543 -27.213 1.00 65.45 ? 398 GLU A CB 1 ATOM 2934 C CG . GLU A 1 377 ? 53.033 -4.423 -28.282 1.00 74.51 ? 398 GLU A CG 1 ATOM 2935 C CD . GLU A 1 377 ? 52.836 -3.004 -28.786 1.00 81.75 ? 398 GLU A CD 1 ATOM 2936 O OE1 . GLU A 1 377 ? 52.047 -2.815 -29.738 1.00 92.74 ? 398 GLU A OE1 1 ATOM 2937 O OE2 . GLU A 1 377 ? 53.469 -2.077 -28.239 1.00 80.66 ? 398 GLU A OE2 1 ATOM 2938 N N . LEU A 1 378 ? 53.979 -7.492 -28.555 1.00 79.36 ? 399 LEU A N 1 ATOM 2939 C CA . LEU A 1 378 ? 54.354 -8.216 -29.761 1.00 77.66 ? 399 LEU A CA 1 ATOM 2940 C C . LEU A 1 378 ? 53.644 -7.593 -30.947 1.00 79.26 ? 399 LEU A C 1 ATOM 2941 O O . LEU A 1 378 ? 52.432 -7.727 -31.084 1.00 83.28 ? 399 LEU A O 1 ATOM 2942 C CB . LEU A 1 378 ? 53.969 -9.690 -29.658 1.00 75.16 ? 399 LEU A CB 1 ATOM 2943 C CG . LEU A 1 378 ? 54.176 -10.475 -30.952 1.00 75.54 ? 399 LEU A CG 1 ATOM 2944 C CD1 . LEU A 1 378 ? 55.632 -10.402 -31.354 1.00 77.59 ? 399 LEU A CD1 1 ATOM 2945 C CD2 . LEU A 1 378 ? 53.731 -11.922 -30.797 1.00 74.70 ? 399 LEU A CD2 1 ATOM 2946 N N . SER A 1 379 ? 54.395 -6.896 -31.794 1.00 79.90 ? 400 SER A N 1 ATOM 2947 C CA . SER A 1 379 ? 53.822 -6.309 -33.001 1.00 87.09 ? 400 SER A CA 1 ATOM 2948 C C . SER A 1 379 ? 54.269 -7.079 -34.238 1.00 82.83 ? 400 SER A C 1 ATOM 2949 O O . SER A 1 379 ? 55.423 -7.494 -34.333 1.00 76.35 ? 400 SER A O 1 ATOM 2950 C CB . SER A 1 379 ? 54.194 -4.827 -33.120 1.00 92.46 ? 400 SER A CB 1 ATOM 2951 O OG . SER A 1 379 ? 55.581 -4.624 -32.914 1.00 95.69 ? 400 SER A OG 1 ATOM 2952 N N . VAL A 1 380 ? 53.347 -7.280 -35.177 1.00 86.33 ? 401 VAL A N 1 ATOM 2953 C CA . VAL A 1 380 ? 53.661 -7.999 -36.407 1.00 93.87 ? 401 VAL A CA 1 ATOM 2954 C C . VAL A 1 380 ? 53.583 -7.089 -37.637 1.00 94.13 ? 401 VAL A C 1 ATOM 2955 O O . VAL A 1 380 ? 52.624 -6.336 -37.820 1.00 90.90 ? 401 VAL A O 1 ATOM 2956 C CB . VAL A 1 380 ? 52.766 -9.243 -36.579 1.00 101.23 ? 401 VAL A CB 1 ATOM 2957 C CG1 . VAL A 1 380 ? 52.627 -9.969 -35.242 1.00 97.51 ? 401 VAL A CG1 1 ATOM 2958 C CG2 . VAL A 1 380 ? 51.402 -8.854 -37.117 1.00 105.89 ? 401 VAL A CG2 1 ATOM 2959 N N . ILE A 1 381 ? 54.609 -7.166 -38.476 1.00 96.27 ? 402 ILE A N 1 ATOM 2960 C CA . ILE A 1 381 ? 54.769 -6.235 -39.586 1.00 98.10 ? 402 ILE A CA 1 ATOM 2961 C C . ILE A 1 381 ? 53.947 -6.622 -40.816 1.00 101.87 ? 402 ILE A C 1 ATOM 2962 O O . ILE A 1 381 ? 53.930 -7.783 -41.230 1.00 101.62 ? 402 ILE A O 1 ATOM 2963 C CB . ILE A 1 381 ? 56.255 -6.108 -39.983 1.00 99.03 ? 402 ILE A CB 1 ATOM 2964 C CG1 . ILE A 1 381 ? 57.138 -6.134 -38.730 1.00 102.12 ? 402 ILE A CG1 1 ATOM 2965 C CG2 . ILE A 1 381 ? 56.487 -4.849 -40.819 1.00 93.73 ? 402 ILE A CG2 1 ATOM 2966 C CD1 . ILE A 1 381 ? 58.613 -5.943 -39.007 1.00 103.93 ? 402 ILE A CD1 1 ATOM 2967 N N . ALA A 1 382 ? 53.269 -5.636 -41.396 1.00 105.38 ? 403 ALA A N 1 ATOM 2968 C CA . ALA A 1 382 ? 52.493 -5.845 -42.614 1.00 105.65 ? 403 ALA A CA 1 ATOM 2969 C C . ALA A 1 382 ? 53.377 -6.374 -43.741 1.00 107.54 ? 403 ALA A C 1 ATOM 2970 O O . ALA A 1 382 ? 52.965 -7.238 -44.512 1.00 113.89 ? 403 ALA A O 1 ATOM 2971 C CB . ALA A 1 382 ? 51.817 -4.550 -43.035 1.00 101.90 ? 403 ALA A CB 1 ATOM 2972 N N . PRO B 1 1 ? 52.904 -23.188 21.886 1.00 112.10 ? 22 PRO B N 1 ATOM 2973 C CA . PRO B 1 1 ? 52.510 -22.741 20.546 1.00 111.91 ? 22 PRO B CA 1 ATOM 2974 C C . PRO B 1 1 ? 51.068 -23.136 20.259 1.00 109.42 ? 22 PRO B C 1 ATOM 2975 O O . PRO B 1 1 ? 50.382 -22.505 19.447 1.00 108.97 ? 22 PRO B O 1 ATOM 2976 C CB . PRO B 1 1 ? 53.456 -23.520 19.619 1.00 113.91 ? 22 PRO B CB 1 ATOM 2977 C CG . PRO B 1 1 ? 54.445 -24.227 20.526 1.00 113.65 ? 22 PRO B CG 1 ATOM 2978 C CD . PRO B 1 1 ? 53.753 -24.387 21.833 1.00 112.04 ? 22 PRO B CD 1 ATOM 2979 N N . GLY B 1 2 ? 50.621 -24.192 20.929 1.00 102.55 ? 23 GLY B N 1 ATOM 2980 C CA . GLY B 1 2 ? 49.257 -24.659 20.800 1.00 94.25 ? 23 GLY B CA 1 ATOM 2981 C C . GLY B 1 2 ? 48.340 -23.892 21.729 1.00 84.08 ? 23 GLY B C 1 ATOM 2982 O O . GLY B 1 2 ? 48.709 -23.571 22.862 1.00 78.83 ? 23 GLY B O 1 ATOM 2983 N N . SER B 1 3 ? 47.142 -23.592 21.242 1.00 75.06 ? 24 SER B N 1 ATOM 2984 C CA . SER B 1 3 ? 46.158 -22.873 22.028 1.00 67.74 ? 24 SER B CA 1 ATOM 2985 C C . SER B 1 3 ? 44.801 -23.549 21.937 1.00 63.96 ? 24 SER B C 1 ATOM 2986 O O . SER B 1 3 ? 44.361 -23.926 20.852 1.00 66.53 ? 24 SER B O 1 ATOM 2987 C CB . SER B 1 3 ? 46.055 -21.432 21.543 1.00 73.47 ? 24 SER B CB 1 ATOM 2988 O OG . SER B 1 3 ? 47.310 -20.784 21.652 1.00 85.20 ? 24 SER B OG 1 ATOM 2989 N N . GLY B 1 4 ? 44.141 -23.699 23.079 1.00 52.99 ? 25 GLY B N 1 ATOM 2990 C CA . GLY B 1 4 ? 42.797 -24.239 23.108 1.00 49.90 ? 25 GLY B CA 1 ATOM 2991 C C . GLY B 1 4 ? 41.837 -23.385 22.295 1.00 58.00 ? 25 GLY B C 1 ATOM 2992 O O . GLY B 1 4 ? 42.219 -22.338 21.765 1.00 58.51 ? 25 GLY B O 1 ATOM 2993 N N . PRO B 1 5 ? 40.574 -23.822 22.203 1.00 58.09 ? 26 PRO B N 1 ATOM 2994 C CA . PRO B 1 5 ? 39.560 -23.148 21.383 1.00 62.43 ? 26 PRO B CA 1 ATOM 2995 C C . PRO B 1 5 ? 39.220 -21.758 21.904 1.00 64.22 ? 26 PRO B C 1 ATOM 2996 O O . PRO B 1 5 ? 39.171 -21.548 23.119 1.00 62.99 ? 26 PRO B O 1 ATOM 2997 C CB . PRO B 1 5 ? 38.331 -24.060 21.511 1.00 62.32 ? 26 PRO B CB 1 ATOM 2998 C CG . PRO B 1 5 ? 38.843 -25.357 22.047 1.00 65.48 ? 26 PRO B CG 1 ATOM 2999 C CD . PRO B 1 5 ? 40.039 -25.014 22.880 1.00 58.89 ? 26 PRO B CD 1 ATOM 3000 N N . VAL B 1 6 ? 38.997 -20.823 20.983 1.00 56.32 ? 27 VAL B N 1 ATOM 3001 C CA . VAL B 1 6 ? 38.517 -19.491 21.320 1.00 55.25 ? 27 VAL B CA 1 ATOM 3002 C C . VAL B 1 6 ? 37.534 -19.023 20.247 1.00 62.22 ? 27 VAL B C 1 ATOM 3003 O O . VAL B 1 6 ? 37.860 -19.014 19.059 1.00 64.02 ? 27 VAL B O 1 ATOM 3004 C CB . VAL B 1 6 ? 39.666 -18.465 21.418 1.00 53.78 ? 27 VAL B CB 1 ATOM 3005 C CG1 . VAL B 1 6 ? 39.102 -17.068 21.621 1.00 59.33 ? 27 VAL B CG1 1 ATOM 3006 C CG2 . VAL B 1 6 ? 40.625 -18.823 22.542 1.00 44.20 ? 27 VAL B CG2 1 ATOM 3007 N N . PHE B 1 7 ? 36.329 -18.646 20.665 1.00 60.42 ? 28 PHE B N 1 ATOM 3008 C CA . PHE B 1 7 ? 35.313 -18.181 19.726 1.00 59.52 ? 28 PHE B CA 1 ATOM 3009 C C . PHE B 1 7 ? 35.683 -16.830 19.144 1.00 66.52 ? 28 PHE B C 1 ATOM 3010 O O . PHE B 1 7 ? 35.960 -15.881 19.881 1.00 67.17 ? 28 PHE B O 1 ATOM 3011 C CB . PHE B 1 7 ? 33.938 -18.091 20.394 1.00 56.29 ? 28 PHE B CB 1 ATOM 3012 C CG . PHE B 1 7 ? 33.295 -19.421 20.635 1.00 57.57 ? 28 PHE B CG 1 ATOM 3013 C CD1 . PHE B 1 7 ? 33.080 -19.879 21.920 1.00 55.81 ? 28 PHE B CD1 1 ATOM 3014 C CD2 . PHE B 1 7 ? 32.913 -20.220 19.573 1.00 61.19 ? 28 PHE B CD2 1 ATOM 3015 C CE1 . PHE B 1 7 ? 32.491 -21.111 22.139 1.00 57.61 ? 28 PHE B CE1 1 ATOM 3016 C CE2 . PHE B 1 7 ? 32.325 -21.452 19.786 1.00 57.98 ? 28 PHE B CE2 1 ATOM 3017 C CZ . PHE B 1 7 ? 32.114 -21.897 21.066 1.00 56.32 ? 28 PHE B CZ 1 ATOM 3018 N N . VAL B 1 8 ? 35.698 -16.758 17.818 1.00 73.68 ? 29 VAL B N 1 ATOM 3019 C CA . VAL B 1 8 ? 35.857 -15.496 17.113 1.00 76.65 ? 29 VAL B CA 1 ATOM 3020 C C . VAL B 1 8 ? 34.478 -14.887 16.905 1.00 84.34 ? 29 VAL B C 1 ATOM 3021 O O . VAL B 1 8 ? 34.260 -13.707 17.177 1.00 88.69 ? 29 VAL B O 1 ATOM 3022 C CB . VAL B 1 8 ? 36.534 -15.691 15.751 1.00 75.68 ? 29 VAL B CB 1 ATOM 3023 C CG1 . VAL B 1 8 ? 36.471 -14.405 14.937 1.00 73.19 ? 29 VAL B CG1 1 ATOM 3024 C CG2 . VAL B 1 8 ? 37.972 -16.153 15.936 1.00 74.07 ? 29 VAL B CG2 1 ATOM 3025 N N . GLN B 1 9 ? 33.545 -15.705 16.426 1.00 87.58 ? 30 GLN B N 1 ATOM 3026 C CA . GLN B 1 9 ? 32.158 -15.278 16.275 1.00 82.47 ? 30 GLN B CA 1 ATOM 3027 C C . GLN B 1 9 ? 31.201 -16.362 16.759 1.00 75.37 ? 30 GLN B C 1 ATOM 3028 O O . GLN B 1 9 ? 31.313 -17.519 16.363 1.00 74.63 ? 30 GLN B O 1 ATOM 3029 C CB . GLN B 1 9 ? 31.857 -14.929 14.824 1.00 86.00 ? 30 GLN B CB 1 ATOM 3030 C CG . GLN B 1 9 ? 30.557 -14.175 14.647 1.00 91.72 ? 30 GLN B CG 1 ATOM 3031 C CD . GLN B 1 9 ? 29.913 -14.454 13.308 1.00 99.93 ? 30 GLN B CD 1 ATOM 3032 O OE1 . GLN B 1 9 ? 28.733 -14.167 13.102 1.00 104.28 ? 30 GLN B OE1 1 ATOM 3033 N NE2 . GLN B 1 9 ? 30.684 -15.030 12.389 1.00 100.73 ? 30 GLN B NE2 1 ATOM 3034 N N . GLU B 1 10 ? 30.265 -15.983 17.622 1.00 73.27 ? 31 GLU B N 1 ATOM 3035 C CA . GLU B 1 10 ? 29.328 -16.937 18.205 1.00 74.98 ? 31 GLU B CA 1 ATOM 3036 C C . GLU B 1 10 ? 27.955 -16.901 17.530 1.00 80.39 ? 31 GLU B C 1 ATOM 3037 O O . GLU B 1 10 ? 27.628 -15.949 16.819 1.00 80.61 ? 31 GLU B O 1 ATOM 3038 C CB . GLU B 1 10 ? 29.182 -16.687 19.708 1.00 76.73 ? 31 GLU B CB 1 ATOM 3039 C CG . GLU B 1 10 ? 30.381 -17.133 20.535 1.00 79.69 ? 31 GLU B CG 1 ATOM 3040 C CD . GLU B 1 10 ? 30.108 -17.112 22.030 1.00 82.69 ? 31 GLU B CD 1 ATOM 3041 O OE1 . GLU B 1 10 ? 28.978 -16.769 22.436 1.00 84.88 ? 31 GLU B OE1 1 ATOM 3042 O OE2 . GLU B 1 10 ? 31.027 -17.443 22.802 1.00 87.11 ? 31 GLU B OE2 1 ATOM 3043 N N . PRO B 1 11 ? 27.146 -17.950 17.751 1.00 80.31 ? 32 PRO B N 1 ATOM 3044 C CA . PRO B 1 11 ? 25.800 -18.055 17.178 1.00 79.11 ? 32 PRO B CA 1 ATOM 3045 C C . PRO B 1 11 ? 24.905 -16.900 17.601 1.00 81.14 ? 32 PRO B C 1 ATOM 3046 O O . PRO B 1 11 ? 24.766 -16.636 18.797 1.00 73.76 ? 32 PRO B O 1 ATOM 3047 C CB . PRO B 1 11 ? 25.271 -19.359 17.775 1.00 77.97 ? 32 PRO B CB 1 ATOM 3048 C CG . PRO B 1 11 ? 26.485 -20.153 18.081 1.00 79.50 ? 32 PRO B CG 1 ATOM 3049 C CD . PRO B 1 11 ? 27.515 -19.158 18.510 1.00 76.74 ? 32 PRO B CD 1 ATOM 3050 N N . SER B 1 12 ? 24.302 -16.231 16.621 1.00 85.55 ? 33 SER B N 1 ATOM 3051 C CA . SER B 1 12 ? 23.403 -15.111 16.876 1.00 84.73 ? 33 SER B CA 1 ATOM 3052 C C . SER B 1 12 ? 21.974 -15.504 16.532 1.00 86.52 ? 33 SER B C 1 ATOM 3053 O O . SER B 1 12 ? 21.745 -16.272 15.597 1.00 80.86 ? 33 SER B O 1 ATOM 3054 C CB . SER B 1 12 ? 23.813 -13.900 16.037 1.00 86.80 ? 33 SER B CB 1 ATOM 3055 O OG . SER B 1 12 ? 25.222 -13.738 16.024 1.00 87.92 ? 33 SER B OG 1 ATOM 3056 N N . HIS B 1 13 ? 21.017 -14.976 17.292 1.00 91.71 ? 34 HIS B N 1 ATOM 3057 C CA . HIS B 1 13 ? 19.603 -15.230 17.040 1.00 93.41 ? 34 HIS B CA 1 ATOM 3058 C C . HIS B 1 13 ? 19.264 -14.879 15.600 1.00 95.72 ? 34 HIS B C 1 ATOM 3059 O O . HIS B 1 13 ? 19.679 -13.836 15.095 1.00 98.07 ? 34 HIS B O 1 ATOM 3060 C CB . HIS B 1 13 ? 18.728 -14.405 17.983 1.00 97.54 ? 34 HIS B CB 1 ATOM 3061 C CG . HIS B 1 13 ? 19.044 -14.602 19.434 1.00 105.30 ? 34 HIS B CG 1 ATOM 3062 N ND1 . HIS B 1 13 ? 18.309 -15.434 20.249 1.00 107.96 ? 34 HIS B ND1 1 ATOM 3063 C CD2 . HIS B 1 13 ? 20.012 -14.067 20.215 1.00 105.89 ? 34 HIS B CD2 1 ATOM 3064 C CE1 . HIS B 1 13 ? 18.811 -15.406 21.472 1.00 105.34 ? 34 HIS B CE1 1 ATOM 3065 N NE2 . HIS B 1 13 ? 19.845 -14.585 21.477 1.00 105.44 ? 34 HIS B NE2 1 ATOM 3066 N N . VAL B 1 14 ? 18.510 -15.753 14.943 1.00 94.68 ? 35 VAL B N 1 ATOM 3067 C CA . VAL B 1 14 ? 18.129 -15.542 13.551 1.00 92.73 ? 35 VAL B CA 1 ATOM 3068 C C . VAL B 1 14 ? 16.627 -15.711 13.368 1.00 95.43 ? 35 VAL B C 1 ATOM 3069 O O . VAL B 1 14 ? 16.046 -16.696 13.824 1.00 93.43 ? 35 VAL B O 1 ATOM 3070 C CB . VAL B 1 14 ? 18.841 -16.538 12.607 1.00 89.12 ? 35 VAL B CB 1 ATOM 3071 C CG1 . VAL B 1 14 ? 18.386 -16.323 11.170 1.00 94.06 ? 35 VAL B CG1 1 ATOM 3072 C CG2 . VAL B 1 14 ? 20.357 -16.411 12.719 1.00 85.94 ? 35 VAL B CG2 1 ATOM 3073 N N . MET B 1 15 ? 15.994 -14.749 12.706 1.00 98.55 ? 36 MET B N 1 ATOM 3074 C CA . MET B 1 15 ? 14.604 -14.917 12.312 1.00 98.15 ? 36 MET B CA 1 ATOM 3075 C C . MET B 1 15 ? 14.517 -14.999 10.795 1.00 98.96 ? 36 MET B C 1 ATOM 3076 O O . MET B 1 15 ? 14.855 -14.052 10.087 1.00 105.05 ? 36 MET B O 1 ATOM 3077 C CB . MET B 1 15 ? 13.709 -13.806 12.870 1.00 98.22 ? 36 MET B CB 1 ATOM 3078 C CG . MET B 1 15 ? 12.225 -14.168 12.842 1.00 103.99 ? 36 MET B CG 1 ATOM 3079 S SD . MET B 1 15 ? 11.201 -13.234 13.997 1.00 163.26 ? 36 MET B SD 1 ATOM 3080 C CE . MET B 1 15 ? 12.050 -13.557 15.541 1.00 104.69 ? 36 MET B CE 1 ATOM 3081 N N . PHE B 1 16 ? 14.070 -16.151 10.308 1.00 93.71 ? 37 PHE B N 1 ATOM 3082 C CA . PHE B 1 16 ? 14.081 -16.454 8.882 1.00 95.91 ? 37 PHE B CA 1 ATOM 3083 C C . PHE B 1 16 ? 12.683 -16.357 8.251 1.00 98.73 ? 37 PHE B C 1 ATOM 3084 O O . PHE B 1 16 ? 11.706 -16.859 8.814 1.00 91.37 ? 37 PHE B O 1 ATOM 3085 C CB . PHE B 1 16 ? 14.683 -17.847 8.662 1.00 97.22 ? 37 PHE B CB 1 ATOM 3086 C CG . PHE B 1 16 ? 14.693 -18.287 7.228 1.00 107.29 ? 37 PHE B CG 1 ATOM 3087 C CD1 . PHE B 1 16 ? 15.752 -17.961 6.397 1.00 109.96 ? 37 PHE B CD1 1 ATOM 3088 C CD2 . PHE B 1 16 ? 13.643 -19.029 6.710 1.00 110.89 ? 37 PHE B CD2 1 ATOM 3089 C CE1 . PHE B 1 16 ? 15.762 -18.366 5.074 1.00 112.79 ? 37 PHE B CE1 1 ATOM 3090 C CE2 . PHE B 1 16 ? 13.648 -19.437 5.389 1.00 113.65 ? 37 PHE B CE2 1 ATOM 3091 C CZ . PHE B 1 16 ? 14.707 -19.105 4.570 1.00 114.80 ? 37 PHE B CZ 1 ATOM 3092 N N . PRO B 1 17 ? 12.591 -15.701 7.078 1.00 101.69 ? 38 PRO B N 1 ATOM 3093 C CA . PRO B 1 17 ? 11.345 -15.507 6.328 1.00 103.48 ? 38 PRO B CA 1 ATOM 3094 C C . PRO B 1 17 ? 10.830 -16.817 5.747 1.00 112.54 ? 38 PRO B C 1 ATOM 3095 O O . PRO B 1 17 ? 11.440 -17.360 4.826 1.00 113.62 ? 38 PRO B O 1 ATOM 3096 C CB . PRO B 1 17 ? 11.761 -14.570 5.189 1.00 102.59 ? 38 PRO B CB 1 ATOM 3097 C CG . PRO B 1 17 ? 13.061 -13.984 5.606 1.00 102.62 ? 38 PRO B CG 1 ATOM 3098 C CD . PRO B 1 17 ? 13.728 -15.036 6.423 1.00 103.85 ? 38 PRO B CD 1 ATOM 3099 N N . LEU B 1 18 ? 9.715 -17.311 6.275 1.00 121.17 ? 39 LEU B N 1 ATOM 3100 C CA . LEU B 1 18 ? 9.158 -18.585 5.834 1.00 129.24 ? 39 LEU B CA 1 ATOM 3101 C C . LEU B 1 18 ? 8.783 -18.531 4.353 1.00 136.15 ? 39 LEU B C 1 ATOM 3102 O O . LEU B 1 18 ? 8.915 -19.522 3.635 1.00 138.37 ? 39 LEU B O 1 ATOM 3103 C CB . LEU B 1 18 ? 7.938 -18.957 6.679 1.00 130.08 ? 39 LEU B CB 1 ATOM 3104 C CG . LEU B 1 18 ? 7.969 -20.349 7.316 1.00 129.72 ? 39 LEU B CG 1 ATOM 3105 C CD1 . LEU B 1 18 ? 6.594 -20.729 7.850 1.00 129.90 ? 39 LEU B CD1 1 ATOM 3106 C CD2 . LEU B 1 18 ? 8.479 -21.393 6.331 1.00 131.52 ? 39 LEU B CD2 1 ATOM 3107 N N . ASP B 1 19 ? 8.318 -17.369 3.904 1.00 139.89 ? 40 ASP B N 1 ATOM 3108 C CA . ASP B 1 19 ? 8.000 -17.158 2.495 1.00 146.19 ? 40 ASP B CA 1 ATOM 3109 C C . ASP B 1 19 ? 9.116 -16.384 1.795 1.00 146.24 ? 40 ASP B C 1 ATOM 3110 O O . ASP B 1 19 ? 8.888 -15.306 1.245 1.00 145.20 ? 40 ASP B O 1 ATOM 3111 C CB . ASP B 1 19 ? 6.666 -16.420 2.348 1.00 150.44 ? 40 ASP B CB 1 ATOM 3112 C CG . ASP B 1 19 ? 5.468 -17.322 2.586 1.00 153.23 ? 40 ASP B CG 1 ATOM 3113 O OD1 . ASP B 1 19 ? 5.360 -18.365 1.905 1.00 152.95 ? 40 ASP B OD1 1 ATOM 3114 O OD2 . ASP B 1 19 ? 4.629 -16.985 3.448 1.00 154.75 ? 40 ASP B OD2 1 ATOM 3115 N N . SER B 1 20 ? 10.320 -16.946 1.818 1.00 148.49 ? 41 SER B N 1 ATOM 3116 C CA . SER B 1 20 ? 11.495 -16.283 1.264 1.00 151.92 ? 41 SER B CA 1 ATOM 3117 C C . SER B 1 20 ? 11.913 -16.889 -0.069 1.00 155.32 ? 41 SER B C 1 ATOM 3118 O O . SER B 1 20 ? 11.349 -17.890 -0.515 1.00 150.16 ? 41 SER B O 1 ATOM 3119 C CB . SER B 1 20 ? 12.660 -16.361 2.256 1.00 152.28 ? 41 SER B CB 1 ATOM 3120 O OG . SER B 1 20 ? 13.882 -15.950 1.666 1.00 153.92 ? 41 SER B OG 1 ATOM 3121 N N . GLU B 1 21 ? 12.904 -16.269 -0.702 1.00 162.15 ? 42 GLU B N 1 ATOM 3122 C CA . GLU B 1 21 ? 13.487 -16.795 -1.928 1.00 169.12 ? 42 GLU B CA 1 ATOM 3123 C C . GLU B 1 21 ? 14.594 -17.787 -1.602 1.00 168.70 ? 42 GLU B C 1 ATOM 3124 O O . GLU B 1 21 ? 14.848 -18.720 -2.362 1.00 169.53 ? 42 GLU B O 1 ATOM 3125 C CB . GLU B 1 21 ? 14.057 -15.662 -2.783 1.00 172.81 ? 42 GLU B CB 1 ATOM 3126 C CG . GLU B 1 21 ? 13.016 -14.840 -3.516 1.00 178.18 ? 42 GLU B CG 1 ATOM 3127 C CD . GLU B 1 21 ? 13.639 -13.861 -4.493 1.00 179.79 ? 42 GLU B CD 1 ATOM 3128 O OE1 . GLU B 1 21 ? 14.819 -13.499 -4.303 1.00 177.89 ? 42 GLU B OE1 1 ATOM 3129 O OE2 . GLU B 1 21 ? 12.947 -13.451 -5.450 1.00 181.73 ? 42 GLU B OE2 1 ATOM 3130 N N . GLU B 1 22 ? 15.254 -17.579 -0.467 1.00 166.80 ? 43 GLU B N 1 ATOM 3131 C CA . GLU B 1 22 ? 16.389 -18.411 -0.087 1.00 165.09 ? 43 GLU B CA 1 ATOM 3132 C C . GLU B 1 22 ? 15.986 -19.698 0.618 1.00 161.45 ? 43 GLU B C 1 ATOM 3133 O O . GLU B 1 22 ? 15.212 -19.690 1.576 1.00 158.15 ? 43 GLU B O 1 ATOM 3134 C CB . GLU B 1 22 ? 17.393 -17.619 0.751 1.00 165.71 ? 43 GLU B CB 1 ATOM 3135 C CG . GLU B 1 22 ? 18.585 -17.119 -0.050 1.00 168.83 ? 43 GLU B CG 1 ATOM 3136 C CD . GLU B 1 22 ? 18.202 -16.660 -1.446 1.00 174.22 ? 43 GLU B CD 1 ATOM 3137 O OE1 . GLU B 1 22 ? 17.160 -15.986 -1.593 1.00 176.60 ? 43 GLU B OE1 1 ATOM 3138 O OE2 . GLU B 1 22 ? 18.948 -16.970 -2.399 1.00 175.26 ? 43 GLU B OE2 1 ATOM 3139 N N . LYS B 1 23 ? 16.529 -20.802 0.122 1.00 161.61 ? 44 LYS B N 1 ATOM 3140 C CA . LYS B 1 23 ? 16.250 -22.124 0.656 1.00 159.14 ? 44 LYS B CA 1 ATOM 3141 C C . LYS B 1 23 ? 17.048 -22.381 1.924 1.00 147.56 ? 44 LYS B C 1 ATOM 3142 O O . LYS B 1 23 ? 16.827 -23.375 2.611 1.00 144.48 ? 44 LYS B O 1 ATOM 3143 C CB . LYS B 1 23 ? 16.603 -23.193 -0.383 1.00 164.88 ? 44 LYS B CB 1 ATOM 3144 C CG . LYS B 1 23 ? 18.106 -23.404 -0.586 1.00 164.86 ? 44 LYS B CG 1 ATOM 3145 C CD . LYS B 1 23 ? 18.775 -22.197 -1.238 1.00 163.67 ? 44 LYS B CD 1 ATOM 3146 C CE . LYS B 1 23 ? 20.272 -22.413 -1.410 1.00 161.39 ? 44 LYS B CE 1 ATOM 3147 N NZ . LYS B 1 23 ? 20.932 -21.256 -2.076 1.00 160.54 ? 44 LYS B NZ 1 ATOM 3148 N N . LYS B 1 24 ? 17.980 -21.487 2.232 1.00 141.59 ? 45 LYS B N 1 ATOM 3149 C CA . LYS B 1 24 ? 18.917 -21.741 3.318 1.00 138.99 ? 45 LYS B CA 1 ATOM 3150 C C . LYS B 1 24 ? 19.062 -20.590 4.309 1.00 130.40 ? 45 LYS B C 1 ATOM 3151 O O . LYS B 1 24 ? 18.947 -19.417 3.951 1.00 132.10 ? 45 LYS B O 1 ATOM 3152 C CB . LYS B 1 24 ? 20.293 -22.108 2.754 1.00 144.32 ? 45 LYS B CB 1 ATOM 3153 C CG . LYS B 1 24 ? 20.911 -21.022 1.891 1.00 148.85 ? 45 LYS B CG 1 ATOM 3154 C CD . LYS B 1 24 ? 22.360 -21.332 1.567 1.00 151.80 ? 45 LYS B CD 1 ATOM 3155 C CE . LYS B 1 24 ? 23.005 -20.184 0.809 1.00 154.45 ? 45 LYS B CE 1 ATOM 3156 N NZ . LYS B 1 24 ? 24.467 -20.397 0.626 1.00 154.98 ? 45 LYS B NZ 1 ATOM 3157 N N . VAL B 1 25 ? 19.312 -20.954 5.561 1.00 119.43 ? 46 VAL B N 1 ATOM 3158 C CA . VAL B 1 25 ? 19.681 -20.002 6.596 1.00 111.05 ? 46 VAL B CA 1 ATOM 3159 C C . VAL B 1 25 ? 21.030 -20.431 7.159 1.00 100.38 ? 46 VAL B C 1 ATOM 3160 O O . VAL B 1 25 ? 21.393 -21.605 7.080 1.00 95.01 ? 46 VAL B O 1 ATOM 3161 C CB . VAL B 1 25 ? 18.635 -19.956 7.729 1.00 111.04 ? 46 VAL B CB 1 ATOM 3162 C CG1 . VAL B 1 25 ? 18.455 -21.336 8.345 1.00 108.29 ? 46 VAL B CG1 1 ATOM 3163 C CG2 . VAL B 1 25 ? 19.036 -18.936 8.789 1.00 110.24 ? 46 VAL B CG2 1 ATOM 3164 N N . LYS B 1 26 ? 21.774 -19.480 7.714 1.00 96.98 ? 47 LYS B N 1 ATOM 3165 C CA . LYS B 1 26 ? 23.085 -19.777 8.282 1.00 90.10 ? 47 LYS B CA 1 ATOM 3166 C C . LYS B 1 26 ? 23.182 -19.420 9.767 1.00 88.06 ? 47 LYS B C 1 ATOM 3167 O O . LYS B 1 26 ? 22.824 -18.317 10.185 1.00 85.52 ? 47 LYS B O 1 ATOM 3168 C CB . LYS B 1 26 ? 24.184 -19.051 7.502 1.00 89.33 ? 47 LYS B CB 1 ATOM 3169 C CG . LYS B 1 26 ? 25.564 -19.222 8.112 1.00 95.38 ? 47 LYS B CG 1 ATOM 3170 C CD . LYS B 1 26 ? 26.553 -18.187 7.604 1.00 103.20 ? 47 LYS B CD 1 ATOM 3171 C CE . LYS B 1 26 ? 26.834 -18.354 6.118 1.00 107.99 ? 47 LYS B CE 1 ATOM 3172 N NZ . LYS B 1 26 ? 27.876 -17.394 5.651 1.00 107.66 ? 47 LYS B NZ 1 ATOM 3173 N N . LEU B 1 27 ? 23.668 -20.368 10.562 1.00 86.09 ? 48 LEU B N 1 ATOM 3174 C CA . LEU B 1 27 ? 24.001 -20.101 11.954 1.00 82.65 ? 48 LEU B CA 1 ATOM 3175 C C . LEU B 1 27 ? 25.517 -20.012 12.091 1.00 83.79 ? 48 LEU B C 1 ATOM 3176 O O . LEU B 1 27 ? 26.229 -20.990 11.861 1.00 85.34 ? 48 LEU B O 1 ATOM 3177 C CB . LEU B 1 27 ? 23.428 -21.188 12.865 1.00 83.22 ? 48 LEU B CB 1 ATOM 3178 C CG . LEU B 1 27 ? 21.906 -21.127 13.034 1.00 85.08 ? 48 LEU B CG 1 ATOM 3179 C CD1 . LEU B 1 27 ? 21.327 -22.504 13.303 1.00 85.67 ? 48 LEU B CD1 1 ATOM 3180 C CD2 . LEU B 1 27 ? 21.529 -20.153 14.140 1.00 81.91 ? 48 LEU B CD2 1 ATOM 3181 N N . SER B 1 28 ? 26.005 -18.830 12.457 1.00 80.12 ? 49 SER B N 1 ATOM 3182 C CA . SER B 1 28 ? 27.436 -18.553 12.440 1.00 83.38 ? 49 SER B CA 1 ATOM 3183 C C . SER B 1 28 ? 28.146 -18.972 13.727 1.00 78.52 ? 49 SER B C 1 ATOM 3184 O O . SER B 1 28 ? 27.620 -18.799 14.826 1.00 77.25 ? 49 SER B O 1 ATOM 3185 C CB . SER B 1 28 ? 27.687 -17.069 12.156 1.00 91.48 ? 49 SER B CB 1 ATOM 3186 O OG . SER B 1 28 ? 27.219 -16.707 10.866 1.00 98.37 ? 49 SER B OG 1 ATOM 3187 N N . CYS B 1 29 ? 29.347 -19.521 13.572 1.00 74.86 ? 50 CYS B N 1 ATOM 3188 C CA . CYS B 1 29 ? 30.167 -19.936 14.701 1.00 83.20 ? 50 CYS B CA 1 ATOM 3189 C C . CYS B 1 29 ? 31.622 -20.106 14.268 1.00 90.60 ? 50 CYS B C 1 ATOM 3190 O O . CYS B 1 29 ? 32.014 -21.159 13.763 1.00 98.07 ? 50 CYS B O 1 ATOM 3191 C CB . CYS B 1 29 ? 29.635 -21.235 15.305 1.00 84.87 ? 50 CYS B CB 1 ATOM 3192 S SG . CYS B 1 29 ? 30.564 -21.825 16.737 1.00 92.43 ? 50 CYS B SG 1 ATOM 3193 N N . GLU B 1 30 ? 32.417 -19.060 14.471 1.00 85.80 ? 51 GLU B N 1 ATOM 3194 C CA . GLU B 1 30 ? 33.801 -19.043 14.016 1.00 85.74 ? 51 GLU B CA 1 ATOM 3195 C C . GLU B 1 30 ? 34.756 -19.288 15.174 1.00 81.14 ? 51 GLU B C 1 ATOM 3196 O O . GLU B 1 30 ? 34.654 -18.650 16.223 1.00 76.95 ? 51 GLU B O 1 ATOM 3197 C CB . GLU B 1 30 ? 34.113 -17.704 13.352 1.00 91.58 ? 51 GLU B CB 1 ATOM 3198 C CG . GLU B 1 30 ? 35.432 -17.668 12.608 1.00 100.60 ? 51 GLU B CG 1 ATOM 3199 C CD . GLU B 1 30 ? 35.579 -16.415 11.769 1.00 111.98 ? 51 GLU B CD 1 ATOM 3200 O OE1 . GLU B 1 30 ? 36.725 -15.949 11.589 1.00 116.03 ? 51 GLU B OE1 1 ATOM 3201 O OE2 . GLU B 1 30 ? 34.546 -15.893 11.292 1.00 115.81 ? 51 GLU B OE2 1 ATOM 3202 N N . VAL B 1 31 ? 35.690 -20.213 14.981 1.00 76.09 ? 52 VAL B N 1 ATOM 3203 C CA . VAL B 1 31 ? 36.580 -20.605 16.060 1.00 69.29 ? 52 VAL B CA 1 ATOM 3204 C C . VAL B 1 31 ? 38.053 -20.575 15.673 1.00 74.28 ? 52 VAL B C 1 ATOM 3205 O O . VAL B 1 31 ? 38.461 -21.154 14.664 1.00 82.25 ? 52 VAL B O 1 ATOM 3206 C CB . VAL B 1 31 ? 36.227 -22.000 16.615 1.00 66.57 ? 52 VAL B CB 1 ATOM 3207 C CG1 . VAL B 1 31 ? 37.250 -22.426 17.642 1.00 64.33 ? 52 VAL B CG1 1 ATOM 3208 C CG2 . VAL B 1 31 ? 34.850 -21.983 17.244 1.00 66.60 ? 52 VAL B CG2 1 ATOM 3209 N N . LYS B 1 32 ? 38.835 -19.882 16.496 1.00 60.15 ? 53 LYS B N 1 ATOM 3210 C CA . LYS B 1 32 ? 40.284 -19.832 16.388 1.00 63.09 ? 53 LYS B CA 1 ATOM 3211 C C . LYS B 1 32 ? 40.898 -20.817 17.384 1.00 67.67 ? 53 LYS B C 1 ATOM 3212 O O . LYS B 1 32 ? 40.368 -21.022 18.479 1.00 67.97 ? 53 LYS B O 1 ATOM 3213 C CB . LYS B 1 32 ? 40.759 -18.416 16.706 1.00 71.00 ? 53 LYS B CB 1 ATOM 3214 C CG . LYS B 1 32 ? 42.214 -18.307 17.097 1.00 82.76 ? 53 LYS B CG 1 ATOM 3215 C CD . LYS B 1 32 ? 42.417 -17.185 18.106 1.00 88.83 ? 53 LYS B CD 1 ATOM 3216 C CE . LYS B 1 32 ? 41.552 -15.976 17.781 1.00 88.31 ? 53 LYS B CE 1 ATOM 3217 N NZ . LYS B 1 32 ? 41.882 -14.817 18.659 1.00 86.02 ? 53 LYS B NZ 1 ATOM 3218 N N . GLY B 1 33 ? 42.015 -21.425 17.004 1.00 63.87 ? 54 GLY B N 1 ATOM 3219 C CA . GLY B 1 33 ? 42.685 -22.382 17.862 1.00 60.67 ? 54 GLY B CA 1 ATOM 3220 C C . GLY B 1 33 ? 43.840 -23.070 17.161 1.00 64.35 ? 54 GLY B C 1 ATOM 3221 O O . GLY B 1 33 ? 43.971 -22.998 15.941 1.00 66.63 ? 54 GLY B O 1 ATOM 3222 N N . ASN B 1 34 ? 44.688 -23.732 17.940 1.00 62.40 ? 55 ASN B N 1 ATOM 3223 C CA . ASN B 1 34 ? 45.788 -24.510 17.390 1.00 67.10 ? 55 ASN B CA 1 ATOM 3224 C C . ASN B 1 34 ? 46.045 -25.759 18.235 1.00 65.49 ? 55 ASN B C 1 ATOM 3225 O O . ASN B 1 34 ? 46.511 -25.662 19.365 1.00 64.03 ? 55 ASN B O 1 ATOM 3226 C CB . ASN B 1 34 ? 47.053 -23.654 17.282 1.00 71.75 ? 55 ASN B CB 1 ATOM 3227 C CG . ASN B 1 34 ? 48.146 -24.325 16.468 1.00 75.58 ? 55 ASN B CG 1 ATOM 3228 O OD1 . ASN B 1 34 ? 49.330 -24.011 16.614 1.00 73.66 ? 55 ASN B OD1 1 ATOM 3229 N ND2 . ASN B 1 34 ? 47.754 -25.255 15.603 1.00 77.91 ? 55 ASN B ND2 1 ATOM 3230 N N . PRO B 1 35 ? 45.754 -26.945 17.683 1.00 68.36 ? 56 PRO B N 1 ATOM 3231 C CA . PRO B 1 35 ? 45.279 -27.186 16.311 1.00 69.57 ? 56 PRO B CA 1 ATOM 3232 C C . PRO B 1 35 ? 43.914 -26.562 16.023 1.00 73.50 ? 56 PRO B C 1 ATOM 3233 O O . PRO B 1 35 ? 43.240 -26.086 16.937 1.00 73.10 ? 56 PRO B O 1 ATOM 3234 C CB . PRO B 1 35 ? 45.172 -28.716 16.239 1.00 64.80 ? 56 PRO B CB 1 ATOM 3235 C CG . PRO B 1 35 ? 46.049 -29.220 17.345 1.00 67.44 ? 56 PRO B CG 1 ATOM 3236 C CD . PRO B 1 35 ? 45.943 -28.200 18.429 1.00 65.34 ? 56 PRO B CD 1 ATOM 3237 N N . LYS B 1 36 ? 43.524 -26.559 14.751 1.00 78.84 ? 57 LYS B N 1 ATOM 3238 C CA . LYS B 1 36 ? 42.207 -26.091 14.352 1.00 81.02 ? 57 LYS B CA 1 ATOM 3239 C C . LYS B 1 36 ? 41.156 -26.986 14.999 1.00 75.30 ? 57 LYS B C 1 ATOM 3240 O O . LYS B 1 36 ? 41.184 -28.204 14.833 1.00 78.84 ? 57 LYS B O 1 ATOM 3241 C CB . LYS B 1 36 ? 42.082 -26.107 12.828 1.00 90.73 ? 57 LYS B CB 1 ATOM 3242 C CG . LYS B 1 36 ? 43.227 -25.381 12.121 1.00 99.83 ? 57 LYS B CG 1 ATOM 3243 C CD . LYS B 1 36 ? 43.448 -25.898 10.699 1.00 101.74 ? 57 LYS B CD 1 ATOM 3244 C CE . LYS B 1 36 ? 44.774 -25.403 10.120 1.00 95.09 ? 57 LYS B CE 1 ATOM 3245 N NZ . LYS B 1 36 ? 45.202 -26.201 8.934 1.00 92.43 ? 57 LYS B NZ 1 ATOM 3246 N N . PRO B 1 37 ? 40.239 -26.381 15.768 1.00 65.70 ? 58 PRO B N 1 ATOM 3247 C CA . PRO B 1 37 ? 39.246 -27.126 16.548 1.00 65.38 ? 58 PRO B CA 1 ATOM 3248 C C . PRO B 1 37 ? 38.149 -27.761 15.699 1.00 68.74 ? 58 PRO B C 1 ATOM 3249 O O . PRO B 1 37 ? 37.712 -27.176 14.711 1.00 62.16 ? 58 PRO B O 1 ATOM 3250 C CB . PRO B 1 37 ? 38.640 -26.050 17.458 1.00 65.04 ? 58 PRO B CB 1 ATOM 3251 C CG . PRO B 1 37 ? 39.637 -24.931 17.465 1.00 66.07 ? 58 PRO B CG 1 ATOM 3252 C CD . PRO B 1 37 ? 40.230 -24.946 16.095 1.00 65.03 ? 58 PRO B CD 1 ATOM 3253 N N . HIS B 1 38 ? 37.716 -28.954 16.095 1.00 71.27 ? 59 HIS B N 1 ATOM 3254 C CA . HIS B 1 38 ? 36.574 -29.611 15.477 1.00 60.69 ? 59 HIS B CA 1 ATOM 3255 C C . HIS B 1 38 ? 35.308 -28.969 16.031 1.00 67.39 ? 59 HIS B C 1 ATOM 3256 O O . HIS B 1 38 ? 35.282 -28.529 17.176 1.00 67.54 ? 59 HIS B O 1 ATOM 3257 C CB . HIS B 1 38 ? 36.588 -31.114 15.774 1.00 66.74 ? 59 HIS B CB 1 ATOM 3258 C CG . HIS B 1 38 ? 37.961 -31.713 15.788 1.00 87.80 ? 59 HIS B CG 1 ATOM 3259 N ND1 . HIS B 1 38 ? 38.612 -32.059 16.957 1.00 98.33 ? 59 HIS B ND1 1 ATOM 3260 C CD2 . HIS B 1 38 ? 38.815 -32.021 14.786 1.00 95.16 ? 59 HIS B CD2 1 ATOM 3261 C CE1 . HIS B 1 38 ? 39.800 -32.555 16.672 1.00 100.51 ? 59 HIS B CE1 1 ATOM 3262 N NE2 . HIS B 1 38 ? 39.950 -32.542 15.356 1.00 100.37 ? 59 HIS B NE2 1 ATOM 3263 N N . ILE B 1 39 ? 34.255 -28.906 15.223 1.00 77.76 ? 60 ILE B N 1 ATOM 3264 C CA . ILE B 1 39 ? 33.026 -28.250 15.654 1.00 71.33 ? 60 ILE B CA 1 ATOM 3265 C C . ILE B 1 39 ? 31.792 -29.136 15.491 1.00 71.99 ? 60 ILE B C 1 ATOM 3266 O O . ILE B 1 39 ? 31.676 -29.888 14.524 1.00 76.90 ? 60 ILE B O 1 ATOM 3267 C CB . ILE B 1 39 ? 32.837 -26.912 14.924 1.00 71.09 ? 60 ILE B CB 1 ATOM 3268 C CG1 . ILE B 1 39 ? 33.826 -25.884 15.482 1.00 68.46 ? 60 ILE B CG1 1 ATOM 3269 C CG2 . ILE B 1 39 ? 31.404 -26.419 15.070 1.00 70.46 ? 60 ILE B CG2 1 ATOM 3270 C CD1 . ILE B 1 39 ? 34.073 -24.708 14.573 1.00 70.51 ? 60 ILE B CD1 1 ATOM 3271 N N . ARG B 1 40 ? 30.883 -29.052 16.458 1.00 68.39 ? 61 ARG B N 1 ATOM 3272 C CA . ARG B 1 40 ? 29.621 -29.779 16.393 1.00 73.23 ? 61 ARG B CA 1 ATOM 3273 C C . ARG B 1 40 ? 28.491 -28.936 16.982 1.00 74.88 ? 61 ARG B C 1 ATOM 3274 O O . ARG B 1 40 ? 28.736 -28.027 17.776 1.00 71.61 ? 61 ARG B O 1 ATOM 3275 C CB . ARG B 1 40 ? 29.724 -31.134 17.095 1.00 78.14 ? 61 ARG B CB 1 ATOM 3276 C CG . ARG B 1 40 ? 29.597 -31.095 18.611 1.00 85.99 ? 61 ARG B CG 1 ATOM 3277 C CD . ARG B 1 40 ? 29.654 -32.509 19.181 1.00 92.39 ? 61 ARG B CD 1 ATOM 3278 N NE . ARG B 1 40 ? 29.123 -32.598 20.538 1.00 94.15 ? 61 ARG B NE 1 ATOM 3279 C CZ . ARG B 1 40 ? 29.872 -32.764 21.623 1.00 95.62 ? 61 ARG B CZ 1 ATOM 3280 N NH1 . ARG B 1 40 ? 31.191 -32.860 21.512 1.00 93.77 ? 61 ARG B NH1 1 ATOM 3281 N NH2 . ARG B 1 40 ? 29.301 -32.836 22.819 1.00 95.72 ? 61 ARG B NH2 1 ATOM 3282 N N . TRP B 1 41 ? 27.257 -29.232 16.582 1.00 75.93 ? 62 TRP B N 1 ATOM 3283 C CA . TRP B 1 41 ? 26.112 -28.408 16.957 1.00 69.66 ? 62 TRP B CA 1 ATOM 3284 C C . TRP B 1 41 ? 25.064 -29.152 17.783 1.00 73.45 ? 62 TRP B C 1 ATOM 3285 O O . TRP B 1 41 ? 24.874 -30.359 17.624 1.00 77.12 ? 62 TRP B O 1 ATOM 3286 C CB . TRP B 1 41 ? 25.451 -27.843 15.707 1.00 68.57 ? 62 TRP B CB 1 ATOM 3287 C CG . TRP B 1 41 ? 26.241 -26.784 15.026 1.00 68.79 ? 62 TRP B CG 1 ATOM 3288 C CD1 . TRP B 1 41 ? 27.273 -26.961 14.145 1.00 67.41 ? 62 TRP B CD1 1 ATOM 3289 C CD2 . TRP B 1 41 ? 26.058 -25.371 15.154 1.00 64.70 ? 62 TRP B CD2 1 ATOM 3290 N NE1 . TRP B 1 41 ? 27.742 -25.741 13.721 1.00 66.57 ? 62 TRP B NE1 1 ATOM 3291 C CE2 . TRP B 1 41 ? 27.013 -24.749 14.327 1.00 64.69 ? 62 TRP B CE2 1 ATOM 3292 C CE3 . TRP B 1 41 ? 25.179 -24.572 15.893 1.00 61.11 ? 62 TRP B CE3 1 ATOM 3293 C CZ2 . TRP B 1 41 ? 27.116 -23.365 14.219 1.00 63.71 ? 62 TRP B CZ2 1 ATOM 3294 C CZ3 . TRP B 1 41 ? 25.279 -23.199 15.780 1.00 59.35 ? 62 TRP B CZ3 1 ATOM 3295 C CH2 . TRP B 1 41 ? 26.242 -22.608 14.951 1.00 63.21 ? 62 TRP B CH2 1 ATOM 3296 N N . LYS B 1 42 ? 24.381 -28.412 18.655 1.00 73.74 ? 63 LYS B N 1 ATOM 3297 C CA . LYS B 1 42 ? 23.291 -28.954 19.464 1.00 79.34 ? 63 LYS B CA 1 ATOM 3298 C C . LYS B 1 42 ? 21.978 -28.213 19.207 1.00 80.89 ? 63 LYS B C 1 ATOM 3299 O O . LYS B 1 42 ? 21.959 -26.991 19.057 1.00 78.27 ? 63 LYS B O 1 ATOM 3300 C CB . LYS B 1 42 ? 23.629 -28.881 20.955 1.00 81.25 ? 63 LYS B CB 1 ATOM 3301 C CG . LYS B 1 42 ? 24.467 -30.034 21.482 1.00 86.25 ? 63 LYS B CG 1 ATOM 3302 C CD . LYS B 1 42 ? 24.640 -29.924 22.992 1.00 89.85 ? 63 LYS B CD 1 ATOM 3303 C CE . LYS B 1 42 ? 25.609 -30.967 23.526 1.00 97.60 ? 63 LYS B CE 1 ATOM 3304 N NZ . LYS B 1 42 ? 25.082 -32.352 23.380 1.00 103.78 ? 63 LYS B NZ 1 ATOM 3305 N N . LEU B 1 43 ? 20.883 -28.963 19.164 1.00 83.00 ? 64 LEU B N 1 ATOM 3306 C CA . LEU B 1 43 ? 19.555 -28.381 19.008 1.00 87.00 ? 64 LEU B CA 1 ATOM 3307 C C . LEU B 1 43 ? 18.675 -28.725 20.205 1.00 92.72 ? 64 LEU B C 1 ATOM 3308 O O . LEU B 1 43 ? 18.444 -29.900 20.499 1.00 91.44 ? 64 LEU B O 1 ATOM 3309 C CB . LEU B 1 43 ? 18.901 -28.875 17.714 1.00 82.70 ? 64 LEU B CB 1 ATOM 3310 C CG . LEU B 1 43 ? 17.484 -28.371 17.439 1.00 78.02 ? 64 LEU B CG 1 ATOM 3311 C CD1 . LEU B 1 43 ? 17.351 -26.893 17.768 1.00 73.19 ? 64 LEU B CD1 1 ATOM 3312 C CD2 . LEU B 1 43 ? 17.104 -28.636 15.993 1.00 81.78 ? 64 LEU B CD2 1 ATOM 3313 N N . ASN B 1 44 ? 18.187 -27.694 20.890 1.00 99.97 ? 65 ASN B N 1 ATOM 3314 C CA . ASN B 1 44 ? 17.372 -27.881 22.088 1.00 110.80 ? 65 ASN B CA 1 ATOM 3315 C C . ASN B 1 44 ? 17.994 -28.890 23.054 1.00 110.76 ? 65 ASN B C 1 ATOM 3316 O O . ASN B 1 44 ? 17.283 -29.612 23.753 1.00 112.49 ? 65 ASN B O 1 ATOM 3317 C CB . ASN B 1 44 ? 15.937 -28.299 21.725 1.00 120.86 ? 65 ASN B CB 1 ATOM 3318 C CG . ASN B 1 44 ? 14.988 -27.110 21.583 1.00 128.90 ? 65 ASN B CG 1 ATOM 3319 O OD1 . ASN B 1 44 ? 15.380 -26.037 21.121 1.00 125.76 ? 65 ASN B OD1 1 ATOM 3320 N ND2 . ASN B 1 44 ? 13.731 -27.301 21.994 1.00 140.83 ? 65 ASN B ND2 1 ATOM 3321 N N . GLY B 1 45 ? 19.323 -28.940 23.082 1.00 106.73 ? 66 GLY B N 1 ATOM 3322 C CA . GLY B 1 45 ? 20.035 -29.815 23.996 1.00 101.84 ? 66 GLY B CA 1 ATOM 3323 C C . GLY B 1 45 ? 20.719 -31.004 23.344 1.00 102.39 ? 66 GLY B C 1 ATOM 3324 O O . GLY B 1 45 ? 21.857 -31.330 23.681 1.00 102.92 ? 66 GLY B O 1 ATOM 3325 N N . THR B 1 46 ? 20.030 -31.655 22.411 1.00 103.17 ? 67 THR B N 1 ATOM 3326 C CA . THR B 1 46 ? 20.547 -32.870 21.781 1.00 103.88 ? 67 THR B CA 1 ATOM 3327 C C . THR B 1 46 ? 21.466 -32.589 20.590 1.00 99.98 ? 67 THR B C 1 ATOM 3328 O O . THR B 1 46 ? 21.404 -31.523 19.980 1.00 101.61 ? 67 THR B O 1 ATOM 3329 C CB . THR B 1 46 ? 19.402 -33.802 21.334 1.00 111.90 ? 67 THR B CB 1 ATOM 3330 O OG1 . THR B 1 46 ? 18.511 -33.091 20.464 1.00 115.91 ? 67 THR B OG1 1 ATOM 3331 C CG2 . THR B 1 46 ? 18.626 -34.307 22.542 1.00 112.51 ? 67 THR B CG2 1 ATOM 3332 N N . ASP B 1 47 ? 22.311 -33.561 20.261 1.00 96.26 ? 68 ASP B N 1 ATOM 3333 C CA . ASP B 1 47 ? 23.282 -33.409 19.181 1.00 94.63 ? 68 ASP B CA 1 ATOM 3334 C C . ASP B 1 47 ? 22.630 -33.421 17.802 1.00 89.54 ? 68 ASP B C 1 ATOM 3335 O O . ASP B 1 47 ? 21.610 -34.076 17.590 1.00 86.22 ? 68 ASP B O 1 ATOM 3336 C CB . ASP B 1 47 ? 24.347 -34.507 19.254 1.00 100.23 ? 68 ASP B CB 1 ATOM 3337 C CG . ASP B 1 47 ? 25.188 -34.427 20.515 1.00 104.18 ? 68 ASP B CG 1 ATOM 3338 O OD1 . ASP B 1 47 ? 26.430 -34.486 20.402 1.00 106.99 ? 68 ASP B OD1 1 ATOM 3339 O OD2 . ASP B 1 47 ? 24.610 -34.301 21.617 1.00 102.97 ? 68 ASP B OD2 1 ATOM 3340 N N . VAL B 1 48 ? 23.238 -32.699 16.866 1.00 87.63 ? 69 VAL B N 1 ATOM 3341 C CA . VAL B 1 48 ? 22.751 -32.634 15.492 1.00 90.72 ? 69 VAL B CA 1 ATOM 3342 C C . VAL B 1 48 ? 23.561 -33.555 14.577 1.00 101.37 ? 69 VAL B C 1 ATOM 3343 O O . VAL B 1 48 ? 24.710 -33.260 14.247 1.00 105.43 ? 69 VAL B O 1 ATOM 3344 C CB . VAL B 1 48 ? 22.823 -31.187 14.942 1.00 81.79 ? 69 VAL B CB 1 ATOM 3345 C CG1 . VAL B 1 48 ? 22.549 -31.165 13.447 1.00 77.77 ? 69 VAL B CG1 1 ATOM 3346 C CG2 . VAL B 1 48 ? 21.862 -30.267 15.695 1.00 76.82 ? 69 VAL B CG2 1 ATOM 3347 N N . ASP B 1 49 ? 22.962 -34.671 14.169 1.00 107.08 ? 70 ASP B N 1 ATOM 3348 C CA . ASP B 1 49 ? 23.642 -35.616 13.285 1.00 110.98 ? 70 ASP B CA 1 ATOM 3349 C C . ASP B 1 49 ? 23.582 -35.158 11.828 1.00 111.14 ? 70 ASP B C 1 ATOM 3350 O O . ASP B 1 49 ? 22.576 -35.348 11.143 1.00 119.50 ? 70 ASP B O 1 ATOM 3351 C CB . ASP B 1 49 ? 23.055 -37.021 13.433 1.00 116.04 ? 70 ASP B CB 1 ATOM 3352 C CG . ASP B 1 49 ? 23.910 -38.085 12.767 1.00 120.73 ? 70 ASP B CG 1 ATOM 3353 O OD1 . ASP B 1 49 ? 24.939 -37.727 12.155 1.00 121.36 ? 70 ASP B OD1 1 ATOM 3354 O OD2 . ASP B 1 49 ? 23.554 -39.279 12.857 1.00 122.17 ? 70 ASP B OD2 1 ATOM 3355 N N . ILE B 1 50 ? 24.675 -34.561 11.365 1.00 104.41 ? 71 ILE B N 1 ATOM 3356 C CA . ILE B 1 50 ? 24.744 -33.976 10.031 1.00 105.90 ? 71 ILE B CA 1 ATOM 3357 C C . ILE B 1 50 ? 24.513 -34.993 8.915 1.00 114.59 ? 71 ILE B C 1 ATOM 3358 O O . ILE B 1 50 ? 23.582 -34.856 8.121 1.00 113.78 ? 71 ILE B O 1 ATOM 3359 C CB . ILE B 1 50 ? 26.108 -33.299 9.796 1.00 102.78 ? 71 ILE B CB 1 ATOM 3360 C CG1 . ILE B 1 50 ? 26.471 -32.394 10.978 1.00 95.88 ? 71 ILE B CG1 1 ATOM 3361 C CG2 . ILE B 1 50 ? 26.095 -32.514 8.493 1.00 104.53 ? 71 ILE B CG2 1 ATOM 3362 C CD1 . ILE B 1 50 ? 25.593 -31.165 11.102 1.00 92.89 ? 71 ILE B CD1 1 ATOM 3363 N N . GLY B 1 51 ? 25.371 -36.007 8.862 1.00 124.03 ? 72 GLY B N 1 ATOM 3364 C CA . GLY B 1 51 ? 25.363 -36.981 7.783 1.00 134.32 ? 72 GLY B CA 1 ATOM 3365 C C . GLY B 1 51 ? 24.006 -37.574 7.454 1.00 142.57 ? 72 GLY B C 1 ATOM 3366 O O . GLY B 1 51 ? 23.617 -37.646 6.287 1.00 144.33 ? 72 GLY B O 1 ATOM 3367 N N . MET B 1 52 ? 23.284 -38.005 8.482 1.00 147.44 ? 73 MET B N 1 ATOM 3368 C CA . MET B 1 52 ? 21.979 -38.620 8.284 1.00 155.25 ? 73 MET B CA 1 ATOM 3369 C C . MET B 1 52 ? 20.934 -38.034 9.236 1.00 155.75 ? 73 MET B C 1 ATOM 3370 O O . MET B 1 52 ? 20.878 -38.407 10.408 1.00 151.67 ? 73 MET B O 1 ATOM 3371 C CB . MET B 1 52 ? 22.079 -40.144 8.434 1.00 159.90 ? 73 MET B CB 1 ATOM 3372 C CG . MET B 1 52 ? 20.759 -40.910 8.331 1.00 163.54 ? 73 MET B CG 1 ATOM 3373 S SD . MET B 1 52 ? 19.905 -40.810 6.740 1.00 328.34 ? 73 MET B SD 1 ATOM 3374 C CE . MET B 1 52 ? 21.233 -41.111 5.578 1.00 95.21 ? 73 MET B CE 1 ATOM 3375 N N . ASP B 1 53 ? 20.114 -37.111 8.731 1.00 160.57 ? 74 ASP B N 1 ATOM 3376 C CA . ASP B 1 53 ? 20.190 -36.668 7.338 1.00 167.03 ? 74 ASP B CA 1 ATOM 3377 C C . ASP B 1 53 ? 19.302 -35.473 7.013 1.00 163.35 ? 74 ASP B C 1 ATOM 3378 O O . ASP B 1 53 ? 18.120 -35.455 7.350 1.00 169.17 ? 74 ASP B O 1 ATOM 3379 C CB . ASP B 1 53 ? 19.793 -37.797 6.385 1.00 177.90 ? 74 ASP B CB 1 ATOM 3380 C CG . ASP B 1 53 ? 19.599 -37.315 4.959 1.00 186.55 ? 74 ASP B CG 1 ATOM 3381 O OD1 . ASP B 1 53 ? 20.569 -36.792 4.368 1.00 189.09 ? 74 ASP B OD1 1 ATOM 3382 O OD2 . ASP B 1 53 ? 18.478 -37.464 4.426 1.00 188.86 ? 74 ASP B OD2 1 ATOM 3383 N N . PHE B 1 54 ? 19.889 -34.488 6.342 1.00 152.23 ? 75 PHE B N 1 ATOM 3384 C CA . PHE B 1 54 ? 19.145 -33.491 5.580 1.00 142.89 ? 75 PHE B CA 1 ATOM 3385 C C . PHE B 1 54 ? 20.121 -32.928 4.569 1.00 129.72 ? 75 PHE B C 1 ATOM 3386 O O . PHE B 1 54 ? 21.055 -33.608 4.144 1.00 126.28 ? 75 PHE B O 1 ATOM 3387 C CB . PHE B 1 54 ? 18.641 -32.343 6.455 1.00 144.75 ? 75 PHE B CB 1 ATOM 3388 C CG . PHE B 1 54 ? 17.758 -32.772 7.590 1.00 149.17 ? 75 PHE B CG 1 ATOM 3389 C CD1 . PHE B 1 54 ? 18.307 -33.119 8.813 1.00 150.93 ? 75 PHE B CD1 1 ATOM 3390 C CD2 . PHE B 1 54 ? 16.381 -32.807 7.446 1.00 151.84 ? 75 PHE B CD2 1 ATOM 3391 C CE1 . PHE B 1 54 ? 17.505 -33.507 9.869 1.00 150.91 ? 75 PHE B CE1 1 ATOM 3392 C CE2 . PHE B 1 54 ? 15.573 -33.195 8.499 1.00 154.36 ? 75 PHE B CE2 1 ATOM 3393 C CZ . PHE B 1 54 ? 16.137 -33.545 9.714 1.00 152.78 ? 75 PHE B CZ 1 ATOM 3394 N N . ARG B 1 55 ? 19.909 -31.677 4.190 1.00 124.56 ? 76 ARG B N 1 ATOM 3395 C CA . ARG B 1 55 ? 20.960 -30.932 3.525 1.00 129.33 ? 76 ARG B CA 1 ATOM 3396 C C . ARG B 1 55 ? 21.649 -30.054 4.558 1.00 125.07 ? 76 ARG B C 1 ATOM 3397 O O . ARG B 1 55 ? 22.186 -28.992 4.236 1.00 124.82 ? 76 ARG B O 1 ATOM 3398 C CB . ARG B 1 55 ? 20.428 -30.118 2.346 1.00 139.78 ? 76 ARG B CB 1 ATOM 3399 C CG . ARG B 1 55 ? 20.167 -30.973 1.118 1.00 151.07 ? 76 ARG B CG 1 ATOM 3400 C CD . ARG B 1 55 ? 21.158 -32.130 1.067 1.00 156.25 ? 76 ARG B CD 1 ATOM 3401 N NE . ARG B 1 55 ? 20.616 -33.295 0.375 1.00 161.09 ? 76 ARG B NE 1 ATOM 3402 C CZ . ARG B 1 55 ? 20.888 -34.552 0.710 1.00 163.87 ? 76 ARG B CZ 1 ATOM 3403 N NH1 . ARG B 1 55 ? 21.688 -34.809 1.737 1.00 162.20 ? 76 ARG B NH1 1 ATOM 3404 N NH2 . ARG B 1 55 ? 20.351 -35.554 0.027 1.00 167.35 ? 76 ARG B NH2 1 ATOM 3405 N N . TYR B 1 56 ? 21.611 -30.507 5.810 1.00 116.92 ? 77 TYR B N 1 ATOM 3406 C CA . TYR B 1 56 ? 22.440 -29.916 6.843 1.00 107.63 ? 77 TYR B CA 1 ATOM 3407 C C . TYR B 1 56 ? 23.837 -29.854 6.269 1.00 104.84 ? 77 TYR B C 1 ATOM 3408 O O . TYR B 1 56 ? 24.394 -30.876 5.871 1.00 108.49 ? 77 TYR B O 1 ATOM 3409 C CB . TYR B 1 56 ? 22.472 -30.782 8.104 1.00 103.20 ? 77 TYR B CB 1 ATOM 3410 C CG . TYR B 1 56 ? 21.301 -30.610 9.043 1.00 103.24 ? 77 TYR B CG 1 ATOM 3411 C CD1 . TYR B 1 56 ? 20.973 -31.605 9.954 1.00 104.55 ? 77 TYR B CD1 1 ATOM 3412 C CD2 . TYR B 1 56 ? 20.522 -29.463 9.019 1.00 105.85 ? 77 TYR B CD2 1 ATOM 3413 C CE1 . TYR B 1 56 ? 19.909 -31.459 10.825 1.00 106.88 ? 77 TYR B CE1 1 ATOM 3414 C CE2 . TYR B 1 56 ? 19.448 -29.310 9.881 1.00 108.01 ? 77 TYR B CE2 1 ATOM 3415 C CZ . TYR B 1 56 ? 19.146 -30.311 10.783 1.00 108.79 ? 77 TYR B CZ 1 ATOM 3416 O OH . TYR B 1 56 ? 18.080 -30.168 11.645 1.00 108.95 ? 77 TYR B OH 1 ATOM 3417 N N . SER B 1 57 ? 24.397 -28.656 6.207 1.00 100.96 ? 78 SER B N 1 ATOM 3418 C CA . SER B 1 57 ? 25.759 -28.492 5.738 1.00 103.70 ? 78 SER B CA 1 ATOM 3419 C C . SER B 1 57 ? 26.542 -27.629 6.721 1.00 107.61 ? 78 SER B C 1 ATOM 3420 O O . SER B 1 57 ? 26.208 -26.466 6.940 1.00 112.20 ? 78 SER B O 1 ATOM 3421 C CB . SER B 1 57 ? 25.766 -27.867 4.342 1.00 101.57 ? 78 SER B CB 1 ATOM 3422 O OG . SER B 1 57 ? 27.005 -28.088 3.690 1.00 101.18 ? 78 SER B OG 1 ATOM 3423 N N . VAL B 1 58 ? 27.570 -28.206 7.331 1.00 106.70 ? 79 VAL B N 1 ATOM 3424 C CA . VAL B 1 58 ? 28.424 -27.446 8.235 1.00 102.09 ? 79 VAL B CA 1 ATOM 3425 C C . VAL B 1 58 ? 29.752 -27.127 7.560 1.00 103.76 ? 79 VAL B C 1 ATOM 3426 O O . VAL B 1 58 ? 30.567 -28.015 7.312 1.00 105.16 ? 79 VAL B O 1 ATOM 3427 C CB . VAL B 1 58 ? 28.650 -28.180 9.578 1.00 96.38 ? 79 VAL B CB 1 ATOM 3428 C CG1 . VAL B 1 58 ? 28.732 -29.683 9.363 1.00 100.23 ? 79 VAL B CG1 1 ATOM 3429 C CG2 . VAL B 1 58 ? 29.898 -27.653 10.279 1.00 92.58 ? 79 VAL B CG2 1 ATOM 3430 N N . VAL B 1 59 ? 29.952 -25.850 7.251 1.00 103.34 ? 80 VAL B N 1 ATOM 3431 C CA . VAL B 1 59 ? 31.160 -25.401 6.571 1.00 103.93 ? 80 VAL B CA 1 ATOM 3432 C C . VAL B 1 59 ? 31.782 -24.196 7.273 1.00 99.34 ? 80 VAL B C 1 ATOM 3433 O O . VAL B 1 59 ? 31.127 -23.169 7.466 1.00 93.43 ? 80 VAL B O 1 ATOM 3434 C CB . VAL B 1 59 ? 30.876 -25.056 5.098 1.00 108.10 ? 80 VAL B CB 1 ATOM 3435 C CG1 . VAL B 1 59 ? 31.876 -24.032 4.584 1.00 106.95 ? 80 VAL B CG1 1 ATOM 3436 C CG2 . VAL B 1 59 ? 30.891 -26.322 4.246 1.00 111.37 ? 80 VAL B CG2 1 ATOM 3437 N N . ASP B 1 60 ? 33.051 -24.335 7.649 1.00 100.40 ? 81 ASP B N 1 ATOM 3438 C CA . ASP B 1 60 ? 33.758 -23.307 8.406 1.00 99.66 ? 81 ASP B CA 1 ATOM 3439 C C . ASP B 1 60 ? 33.154 -23.168 9.802 1.00 93.65 ? 81 ASP B C 1 ATOM 3440 O O . ASP B 1 60 ? 33.193 -22.095 10.411 1.00 92.10 ? 81 ASP B O 1 ATOM 3441 C CB . ASP B 1 60 ? 33.723 -21.966 7.669 1.00 110.24 ? 81 ASP B CB 1 ATOM 3442 C CG . ASP B 1 60 ? 34.758 -20.986 8.191 1.00 120.11 ? 81 ASP B CG 1 ATOM 3443 O OD1 . ASP B 1 60 ? 35.968 -21.280 8.078 1.00 124.65 ? 81 ASP B OD1 1 ATOM 3444 O OD2 . ASP B 1 60 ? 34.360 -19.919 8.707 1.00 121.65 ? 81 ASP B OD2 1 ATOM 3445 N N . GLY B 1 61 ? 32.594 -24.265 10.303 1.00 90.49 ? 82 GLY B N 1 ATOM 3446 C CA . GLY B 1 61 ? 31.968 -24.278 11.613 1.00 89.68 ? 82 GLY B CA 1 ATOM 3447 C C . GLY B 1 61 ? 30.519 -23.832 11.594 1.00 89.86 ? 82 GLY B C 1 ATOM 3448 O O . GLY B 1 61 ? 29.736 -24.219 12.461 1.00 94.20 ? 82 GLY B O 1 ATOM 3449 N N . SER B 1 62 ? 30.163 -23.020 10.603 1.00 85.58 ? 83 SER B N 1 ATOM 3450 C CA . SER B 1 62 ? 28.810 -22.486 10.480 1.00 79.98 ? 83 SER B CA 1 ATOM 3451 C C . SER B 1 62 ? 27.810 -23.528 9.985 1.00 79.38 ? 83 SER B C 1 ATOM 3452 O O . SER B 1 62 ? 28.072 -24.260 9.028 1.00 78.65 ? 83 SER B O 1 ATOM 3453 C CB . SER B 1 62 ? 28.800 -21.265 9.559 1.00 86.70 ? 83 SER B CB 1 ATOM 3454 O OG . SER B 1 62 ? 29.642 -20.246 10.070 1.00 96.61 ? 83 SER B OG 1 ATOM 3455 N N . LEU B 1 63 ? 26.658 -23.580 10.644 1.00 80.01 ? 84 LEU B N 1 ATOM 3456 C CA . LEU B 1 63 ? 25.610 -24.529 10.290 1.00 81.93 ? 84 LEU B CA 1 ATOM 3457 C C . LEU B 1 63 ? 24.676 -23.953 9.229 1.00 84.41 ? 84 LEU B C 1 ATOM 3458 O O . LEU B 1 63 ? 23.893 -23.039 9.500 1.00 84.58 ? 84 LEU B O 1 ATOM 3459 C CB . LEU B 1 63 ? 24.819 -24.935 11.538 1.00 82.46 ? 84 LEU B CB 1 ATOM 3460 C CG . LEU B 1 63 ? 23.622 -25.874 11.366 1.00 83.49 ? 84 LEU B CG 1 ATOM 3461 C CD1 . LEU B 1 63 ? 24.028 -27.166 10.671 1.00 83.34 ? 84 LEU B CD1 1 ATOM 3462 C CD2 . LEU B 1 63 ? 22.977 -26.165 12.718 1.00 81.34 ? 84 LEU B CD2 1 ATOM 3463 N N . LEU B 1 64 ? 24.774 -24.485 8.015 1.00 85.30 ? 85 LEU B N 1 ATOM 3464 C CA . LEU B 1 64 ? 23.881 -24.095 6.936 1.00 84.62 ? 85 LEU B CA 1 ATOM 3465 C C . LEU B 1 64 ? 22.758 -25.113 6.820 1.00 86.30 ? 85 LEU B C 1 ATOM 3466 O O . LEU B 1 64 ? 23.009 -26.312 6.724 1.00 88.75 ? 85 LEU B O 1 ATOM 3467 C CB . LEU B 1 64 ? 24.636 -24.002 5.610 1.00 87.85 ? 85 LEU B CB 1 ATOM 3468 C CG . LEU B 1 64 ? 25.960 -23.237 5.621 1.00 90.05 ? 85 LEU B CG 1 ATOM 3469 C CD1 . LEU B 1 64 ? 26.446 -22.991 4.199 1.00 87.74 ? 85 LEU B CD1 1 ATOM 3470 C CD2 . LEU B 1 64 ? 25.824 -21.926 6.372 1.00 91.99 ? 85 LEU B CD2 1 ATOM 3471 N N . ILE B 1 65 ? 21.519 -24.633 6.832 1.00 85.39 ? 86 ILE B N 1 ATOM 3472 C CA . ILE B 1 65 ? 20.358 -25.510 6.718 1.00 81.75 ? 86 ILE B CA 1 ATOM 3473 C C . ILE B 1 65 ? 19.585 -25.232 5.432 1.00 89.14 ? 86 ILE B C 1 ATOM 3474 O O . ILE B 1 65 ? 19.160 -24.104 5.184 1.00 88.94 ? 86 ILE B O 1 ATOM 3475 C CB . ILE B 1 65 ? 19.406 -25.335 7.920 1.00 73.63 ? 86 ILE B CB 1 ATOM 3476 C CG1 . ILE B 1 65 ? 20.189 -25.375 9.236 1.00 68.17 ? 86 ILE B CG1 1 ATOM 3477 C CG2 . ILE B 1 65 ? 18.304 -26.392 7.896 1.00 70.51 ? 86 ILE B CG2 1 ATOM 3478 C CD1 . ILE B 1 65 ? 19.321 -25.233 10.473 1.00 67.64 ? 86 ILE B CD1 1 ATOM 3479 N N . ASN B 1 66 ? 19.403 -26.262 4.612 1.00 94.98 ? 87 ASN B N 1 ATOM 3480 C CA . ASN B 1 66 ? 18.610 -26.121 3.394 1.00 99.63 ? 87 ASN B CA 1 ATOM 3481 C C . ASN B 1 66 ? 17.188 -26.653 3.563 1.00 99.86 ? 87 ASN B C 1 ATOM 3482 O O . ASN B 1 66 ? 16.982 -27.738 4.112 1.00 96.42 ? 87 ASN B O 1 ATOM 3483 C CB . ASN B 1 66 ? 19.307 -26.777 2.195 1.00 101.95 ? 87 ASN B CB 1 ATOM 3484 C CG . ASN B 1 66 ? 20.367 -25.878 1.569 1.00 101.70 ? 87 ASN B CG 1 ATOM 3485 O OD1 . ASN B 1 66 ? 21.228 -25.327 2.262 1.00 99.83 ? 87 ASN B OD1 1 ATOM 3486 N ND2 . ASN B 1 66 ? 20.307 -25.727 0.252 1.00 101.73 ? 87 ASN B ND2 1 ATOM 3487 N N . ASN B 1 67 ? 16.219 -25.873 3.086 1.00 103.43 ? 88 ASN B N 1 ATOM 3488 C CA . ASN B 1 67 ? 14.799 -26.186 3.239 1.00 107.29 ? 88 ASN B CA 1 ATOM 3489 C C . ASN B 1 67 ? 14.355 -26.119 4.698 1.00 111.10 ? 88 ASN B C 1 ATOM 3490 O O . ASN B 1 67 ? 13.975 -27.133 5.283 1.00 116.55 ? 88 ASN B O 1 ATOM 3491 C CB . ASN B 1 67 ? 14.469 -27.561 2.645 1.00 106.77 ? 88 ASN B CB 1 ATOM 3492 C CG . ASN B 1 67 ? 14.399 -27.547 1.126 1.00 108.99 ? 88 ASN B CG 1 ATOM 3493 O OD1 . ASN B 1 67 ? 14.404 -26.487 0.496 1.00 105.41 ? 88 ASN B OD1 1 ATOM 3494 N ND2 . ASN B 1 67 ? 14.324 -28.732 0.529 1.00 114.26 ? 88 ASN B ND2 1 ATOM 3495 N N . PRO B 1 68 ? 14.400 -24.918 5.293 1.00 109.34 ? 89 PRO B N 1 ATOM 3496 C CA . PRO B 1 68 ? 14.080 -24.761 6.716 1.00 110.43 ? 89 PRO B CA 1 ATOM 3497 C C . PRO B 1 68 ? 12.626 -25.121 7.021 1.00 120.24 ? 89 PRO B C 1 ATOM 3498 O O . PRO B 1 68 ? 11.704 -24.631 6.368 1.00 120.04 ? 89 PRO B O 1 ATOM 3499 C CB . PRO B 1 68 ? 14.344 -23.273 6.977 1.00 104.28 ? 89 PRO B CB 1 ATOM 3500 C CG . PRO B 1 68 ? 15.208 -22.821 5.837 1.00 104.04 ? 89 PRO B CG 1 ATOM 3501 C CD . PRO B 1 68 ? 14.766 -23.639 4.668 1.00 107.89 ? 89 PRO B CD 1 ATOM 3502 N N . ASN B 1 69 ? 12.441 -25.976 8.021 1.00 129.46 ? 90 ASN B N 1 ATOM 3503 C CA . ASN B 1 69 ? 11.134 -26.512 8.369 1.00 139.17 ? 90 ASN B CA 1 ATOM 3504 C C . ASN B 1 69 ? 10.850 -26.271 9.847 1.00 131.68 ? 90 ASN B C 1 ATOM 3505 O O . ASN B 1 69 ? 11.456 -26.909 10.707 1.00 130.19 ? 90 ASN B O 1 ATOM 3506 C CB . ASN B 1 69 ? 11.109 -28.011 8.066 1.00 155.18 ? 90 ASN B CB 1 ATOM 3507 C CG . ASN B 1 69 ? 9.707 -28.565 7.948 1.00 172.77 ? 90 ASN B CG 1 ATOM 3508 O OD1 . ASN B 1 69 ? 8.749 -27.985 8.460 1.00 171.93 ? 90 ASN B OD1 1 ATOM 3509 N ND2 . ASN B 1 69 ? 9.580 -29.699 7.265 1.00 192.21 ? 90 ASN B ND2 1 ATOM 3510 N N . LYS B 1 70 ? 9.931 -25.354 10.140 1.00 126.38 ? 91 LYS B N 1 ATOM 3511 C CA . LYS B 1 70 ? 9.681 -24.923 11.518 1.00 122.43 ? 91 LYS B CA 1 ATOM 3512 C C . LYS B 1 70 ? 9.527 -26.066 12.522 1.00 118.19 ? 91 LYS B C 1 ATOM 3513 O O . LYS B 1 70 ? 9.937 -25.947 13.678 1.00 114.34 ? 91 LYS B O 1 ATOM 3514 C CB . LYS B 1 70 ? 8.455 -24.007 11.599 1.00 123.31 ? 91 LYS B CB 1 ATOM 3515 C CG . LYS B 1 70 ? 8.154 -23.535 13.018 1.00 122.78 ? 91 LYS B CG 1 ATOM 3516 C CD . LYS B 1 70 ? 6.859 -22.741 13.103 1.00 125.24 ? 91 LYS B CD 1 ATOM 3517 C CE . LYS B 1 70 ? 6.553 -22.352 14.545 1.00 122.26 ? 91 LYS B CE 1 ATOM 3518 N NZ . LYS B 1 70 ? 5.307 -21.545 14.661 1.00 121.55 ? 91 LYS B NZ 1 ATOM 3519 N N . THR B 1 71 ? 8.931 -27.168 12.083 1.00 117.86 ? 92 THR B N 1 ATOM 3520 C CA . THR B 1 71 ? 8.645 -28.276 12.985 1.00 115.52 ? 92 THR B CA 1 ATOM 3521 C C . THR B 1 71 ? 9.916 -29.011 13.410 1.00 113.84 ? 92 THR B C 1 ATOM 3522 O O . THR B 1 71 ? 10.007 -29.513 14.533 1.00 110.60 ? 92 THR B O 1 ATOM 3523 C CB . THR B 1 71 ? 7.638 -29.267 12.364 1.00 113.41 ? 92 THR B CB 1 ATOM 3524 O OG1 . THR B 1 71 ? 8.205 -29.849 11.185 1.00 115.09 ? 92 THR B OG1 1 ATOM 3525 C CG2 . THR B 1 71 ? 6.340 -28.552 12.001 1.00 110.07 ? 92 THR B CG2 1 ATOM 3526 N N . GLN B 1 72 ? 10.897 -29.062 12.515 1.00 115.60 ? 93 GLN B N 1 ATOM 3527 C CA . GLN B 1 72 ? 12.164 -29.723 12.814 1.00 115.51 ? 93 GLN B CA 1 ATOM 3528 C C . GLN B 1 72 ? 13.240 -28.730 13.262 1.00 110.14 ? 93 GLN B C 1 ATOM 3529 O O . GLN B 1 72 ? 13.963 -28.974 14.233 1.00 103.75 ? 93 GLN B O 1 ATOM 3530 C CB . GLN B 1 72 ? 12.676 -30.488 11.590 1.00 118.89 ? 93 GLN B CB 1 ATOM 3531 C CG . GLN B 1 72 ? 11.595 -31.028 10.676 1.00 127.02 ? 93 GLN B CG 1 ATOM 3532 C CD . GLN B 1 72 ? 12.162 -31.898 9.569 1.00 133.01 ? 93 GLN B CD 1 ATOM 3533 O OE1 . GLN B 1 72 ? 13.100 -32.663 9.788 1.00 135.89 ? 93 GLN B OE1 1 ATOM 3534 N NE2 . GLN B 1 72 ? 11.591 -31.787 8.374 1.00 132.52 ? 93 GLN B NE2 1 ATOM 3535 N N . ASP B 1 73 ? 13.330 -27.609 12.552 1.00 107.17 ? 94 ASP B N 1 ATOM 3536 C CA . ASP B 1 73 ? 14.488 -26.723 12.648 1.00 101.52 ? 94 ASP B CA 1 ATOM 3537 C C . ASP B 1 73 ? 14.349 -25.544 13.620 1.00 97.90 ? 94 ASP B C 1 ATOM 3538 O O . ASP B 1 73 ? 15.346 -24.900 13.958 1.00 99.93 ? 94 ASP B O 1 ATOM 3539 C CB . ASP B 1 73 ? 14.870 -26.218 11.254 1.00 98.22 ? 94 ASP B CB 1 ATOM 3540 C CG . ASP B 1 73 ? 15.066 -27.348 10.261 1.00 98.97 ? 94 ASP B CG 1 ATOM 3541 O OD1 . ASP B 1 73 ? 15.417 -28.466 10.693 1.00 96.20 ? 94 ASP B OD1 1 ATOM 3542 O OD2 . ASP B 1 73 ? 14.870 -27.120 9.048 1.00 103.04 ? 94 ASP B OD2 1 ATOM 3543 N N . ALA B 1 74 ? 13.132 -25.253 14.068 1.00 89.52 ? 95 ALA B N 1 ATOM 3544 C CA . ALA B 1 74 ? 12.941 -24.167 15.028 1.00 84.59 ? 95 ALA B CA 1 ATOM 3545 C C . ALA B 1 74 ? 13.466 -24.552 16.411 1.00 83.92 ? 95 ALA B C 1 ATOM 3546 O O . ALA B 1 74 ? 13.265 -25.678 16.867 1.00 85.68 ? 95 ALA B O 1 ATOM 3547 C CB . ALA B 1 74 ? 11.478 -23.771 15.108 1.00 80.88 ? 95 ALA B CB 1 ATOM 3548 N N . GLY B 1 75 ? 14.140 -23.622 17.079 1.00 74.94 ? 96 GLY B N 1 ATOM 3549 C CA . GLY B 1 75 ? 14.584 -23.880 18.432 1.00 76.64 ? 96 GLY B CA 1 ATOM 3550 C C . GLY B 1 75 ? 15.888 -23.217 18.819 1.00 85.54 ? 96 GLY B C 1 ATOM 3551 O O . GLY B 1 75 ? 16.353 -22.289 18.154 1.00 86.13 ? 96 GLY B O 1 ATOM 3552 N N . THR B 1 76 ? 16.476 -23.709 19.908 1.00 86.34 ? 97 THR B N 1 ATOM 3553 C CA . THR B 1 76 ? 17.680 -23.123 20.485 1.00 85.65 ? 97 THR B CA 1 ATOM 3554 C C . THR B 1 76 ? 18.932 -23.896 20.070 1.00 87.12 ? 97 THR B C 1 ATOM 3555 O O . THR B 1 76 ? 19.100 -25.065 20.419 1.00 88.60 ? 97 THR B O 1 ATOM 3556 C CB . THR B 1 76 ? 17.590 -23.071 22.026 1.00 84.61 ? 97 THR B CB 1 ATOM 3557 O OG1 . THR B 1 76 ? 16.330 -22.511 22.414 1.00 87.84 ? 97 THR B OG1 1 ATOM 3558 C CG2 . THR B 1 76 ? 18.711 -22.221 22.602 1.00 80.73 ? 97 THR B CG2 1 ATOM 3559 N N . TYR B 1 77 ? 19.807 -23.230 19.326 1.00 83.56 ? 98 TYR B N 1 ATOM 3560 C CA . TYR B 1 77 ? 21.022 -23.851 18.820 1.00 82.97 ? 98 TYR B CA 1 ATOM 3561 C C . TYR B 1 77 ? 22.248 -23.503 19.661 1.00 82.96 ? 98 TYR B C 1 ATOM 3562 O O . TYR B 1 77 ? 22.335 -22.416 20.240 1.00 85.02 ? 98 TYR B O 1 ATOM 3563 C CB . TYR B 1 77 ? 21.258 -23.440 17.370 1.00 81.35 ? 98 TYR B CB 1 ATOM 3564 C CG . TYR B 1 77 ? 20.319 -24.097 16.389 1.00 79.44 ? 98 TYR B CG 1 ATOM 3565 C CD1 . TYR B 1 77 ? 19.039 -23.600 16.179 1.00 81.06 ? 98 TYR B CD1 1 ATOM 3566 C CD2 . TYR B 1 77 ? 20.715 -25.212 15.663 1.00 81.23 ? 98 TYR B CD2 1 ATOM 3567 C CE1 . TYR B 1 77 ? 18.176 -24.200 15.278 1.00 82.07 ? 98 TYR B CE1 1 ATOM 3568 C CE2 . TYR B 1 77 ? 19.862 -25.820 14.759 1.00 82.42 ? 98 TYR B CE2 1 ATOM 3569 C CZ . TYR B 1 77 ? 18.594 -25.312 14.570 1.00 82.92 ? 98 TYR B CZ 1 ATOM 3570 O OH . TYR B 1 77 ? 17.746 -25.916 13.667 1.00 84.06 ? 98 TYR B OH 1 ATOM 3571 N N . GLN B 1 78 ? 23.197 -24.432 19.716 1.00 79.12 ? 99 GLN B N 1 ATOM 3572 C CA . GLN B 1 78 ? 24.429 -24.229 20.471 1.00 72.92 ? 99 GLN B CA 1 ATOM 3573 C C . GLN B 1 78 ? 25.620 -24.861 19.755 1.00 68.42 ? 99 GLN B C 1 ATOM 3574 O O . GLN B 1 78 ? 25.540 -25.986 19.272 1.00 72.62 ? 99 GLN B O 1 ATOM 3575 C CB . GLN B 1 78 ? 24.284 -24.807 21.878 1.00 76.74 ? 99 GLN B CB 1 ATOM 3576 C CG . GLN B 1 78 ? 25.328 -24.321 22.867 1.00 82.11 ? 99 GLN B CG 1 ATOM 3577 C CD . GLN B 1 78 ? 24.971 -24.672 24.300 1.00 86.73 ? 99 GLN B CD 1 ATOM 3578 O OE1 . GLN B 1 78 ? 24.215 -25.612 24.553 1.00 90.42 ? 99 GLN B OE1 1 ATOM 3579 N NE2 . GLN B 1 78 ? 25.509 -23.912 25.247 1.00 80.99 ? 99 GLN B NE2 1 ATOM 3580 N N . CYS B 1 79 ? 26.722 -24.124 19.692 1.00 65.07 ? 100 CYS B N 1 ATOM 3581 C CA . CYS B 1 79 ? 27.926 -24.571 18.999 1.00 66.35 ? 100 CYS B CA 1 ATOM 3582 C C . CYS B 1 79 ? 29.011 -25.090 19.971 1.00 71.22 ? 100 CYS B C 1 ATOM 3583 O O . CYS B 1 79 ? 29.278 -24.479 21.010 1.00 63.14 ? 100 CYS B O 1 ATOM 3584 C CB . CYS B 1 79 ? 28.462 -23.412 18.157 1.00 63.30 ? 100 CYS B CB 1 ATOM 3585 S SG . CYS B 1 79 ? 30.070 -23.675 17.416 1.00 83.82 ? 100 CYS B SG 1 ATOM 3586 N N . ILE B 1 80 ? 29.635 -26.215 19.625 1.00 71.52 ? 101 ILE B N 1 ATOM 3587 C CA . ILE B 1 80 ? 30.633 -26.836 20.494 1.00 62.63 ? 101 ILE B CA 1 ATOM 3588 C C . ILE B 1 80 ? 31.988 -26.987 19.805 1.00 66.00 ? 101 ILE B C 1 ATOM 3589 O O . ILE B 1 80 ? 32.090 -27.652 18.779 1.00 72.88 ? 101 ILE B O 1 ATOM 3590 C CB . ILE B 1 80 ? 30.190 -28.235 20.969 1.00 59.49 ? 101 ILE B CB 1 ATOM 3591 C CG1 . ILE B 1 80 ? 28.734 -28.226 21.423 1.00 63.98 ? 101 ILE B CG1 1 ATOM 3592 C CG2 . ILE B 1 80 ? 31.080 -28.710 22.098 1.00 55.94 ? 101 ILE B CG2 1 ATOM 3593 C CD1 . ILE B 1 80 ? 28.462 -27.284 22.560 1.00 66.57 ? 101 ILE B CD1 1 ATOM 3594 N N . ALA B 1 81 ? 33.027 -26.388 20.384 1.00 59.80 ? 102 ALA B N 1 ATOM 3595 C CA . ALA B 1 81 ? 34.366 -26.427 19.804 1.00 58.93 ? 102 ALA B CA 1 ATOM 3596 C C . ALA B 1 81 ? 35.310 -27.300 20.631 1.00 58.57 ? 102 ALA B C 1 ATOM 3597 O O . ALA B 1 81 ? 35.404 -27.136 21.844 1.00 60.77 ? 102 ALA B O 1 ATOM 3598 C CB . ALA B 1 81 ? 34.925 -25.020 19.678 1.00 61.66 ? 102 ALA B CB 1 ATOM 3599 N N . THR B 1 82 ? 36.013 -28.219 19.972 1.00 58.25 ? 103 THR B N 1 ATOM 3600 C CA . THR B 1 82 ? 36.893 -29.146 20.679 1.00 65.12 ? 103 THR B CA 1 ATOM 3601 C C . THR B 1 82 ? 38.300 -29.202 20.094 1.00 71.71 ? 103 THR B C 1 ATOM 3602 O O . THR B 1 82 ? 38.500 -29.100 18.881 1.00 75.75 ? 103 THR B O 1 ATOM 3603 C CB . THR B 1 82 ? 36.314 -30.580 20.753 1.00 65.90 ? 103 THR B CB 1 ATOM 3604 O OG1 . THR B 1 82 ? 35.063 -30.563 21.452 1.00 68.99 ? 103 THR B OG1 1 ATOM 3605 C CG2 . THR B 1 82 ? 37.276 -31.505 21.492 1.00 60.94 ? 103 THR B CG2 1 ATOM 3606 N N . ASN B 1 83 ? 39.263 -29.386 20.987 1.00 65.97 ? 104 ASN B N 1 ATOM 3607 C CA . ASN B 1 83 ? 40.671 -29.365 20.656 1.00 65.40 ? 104 ASN B CA 1 ATOM 3608 C C . ASN B 1 83 ? 41.362 -30.454 21.459 1.00 63.47 ? 104 ASN B C 1 ATOM 3609 O O . ASN B 1 83 ? 40.737 -31.109 22.292 1.00 63.28 ? 104 ASN B O 1 ATOM 3610 C CB . ASN B 1 83 ? 41.250 -28.016 21.066 1.00 66.60 ? 104 ASN B CB 1 ATOM 3611 C CG . ASN B 1 83 ? 42.165 -27.445 20.030 1.00 64.91 ? 104 ASN B CG 1 ATOM 3612 O OD1 . ASN B 1 83 ? 41.995 -27.688 18.839 1.00 77.41 ? 104 ASN B OD1 1 ATOM 3613 N ND2 . ASN B 1 83 ? 43.139 -26.670 20.468 1.00 52.59 ? 104 ASN B ND2 1 ATOM 3614 N N . SER B 1 84 ? 42.651 -30.647 21.219 1.00 62.22 ? 105 SER B N 1 ATOM 3615 C CA . SER B 1 84 ? 43.438 -31.528 22.067 1.00 70.03 ? 105 SER B CA 1 ATOM 3616 C C . SER B 1 84 ? 43.625 -30.879 23.440 1.00 68.77 ? 105 SER B C 1 ATOM 3617 O O . SER B 1 84 ? 44.017 -31.536 24.402 1.00 71.34 ? 105 SER B O 1 ATOM 3618 C CB . SER B 1 84 ? 44.795 -31.819 21.427 1.00 72.47 ? 105 SER B CB 1 ATOM 3619 O OG . SER B 1 84 ? 45.542 -30.626 21.263 1.00 70.31 ? 105 SER B OG 1 ATOM 3620 N N . PHE B 1 85 ? 43.329 -29.586 23.518 1.00 62.84 ? 106 PHE B N 1 ATOM 3621 C CA . PHE B 1 85 ? 43.497 -28.822 24.748 1.00 57.07 ? 106 PHE B CA 1 ATOM 3622 C C . PHE B 1 85 ? 42.216 -28.751 25.571 1.00 56.09 ? 106 PHE B C 1 ATOM 3623 O O . PHE B 1 85 ? 42.230 -28.306 26.716 1.00 61.82 ? 106 PHE B O 1 ATOM 3624 C CB . PHE B 1 85 ? 43.990 -27.407 24.432 1.00 56.71 ? 106 PHE B CB 1 ATOM 3625 C CG . PHE B 1 85 ? 45.429 -27.353 23.999 1.00 62.63 ? 106 PHE B CG 1 ATOM 3626 C CD1 . PHE B 1 85 ? 46.448 -27.585 24.911 1.00 62.27 ? 106 PHE B CD1 1 ATOM 3627 C CD2 . PHE B 1 85 ? 45.765 -27.070 22.684 1.00 64.71 ? 106 PHE B CD2 1 ATOM 3628 C CE1 . PHE B 1 85 ? 47.773 -27.540 24.517 1.00 65.34 ? 106 PHE B CE1 1 ATOM 3629 C CE2 . PHE B 1 85 ? 47.091 -27.022 22.284 1.00 67.26 ? 106 PHE B CE2 1 ATOM 3630 C CZ . PHE B 1 85 ? 48.096 -27.255 23.200 1.00 67.11 ? 106 PHE B CZ 1 ATOM 3631 N N . GLY B 1 86 ? 41.109 -29.187 24.984 1.00 56.20 ? 107 GLY B N 1 ATOM 3632 C CA . GLY B 1 86 ? 39.833 -29.168 25.672 1.00 57.86 ? 107 GLY B CA 1 ATOM 3633 C C . GLY B 1 86 ? 38.716 -28.680 24.775 1.00 60.29 ? 107 GLY B C 1 ATOM 3634 O O . GLY B 1 86 ? 38.931 -28.411 23.595 1.00 63.31 ? 107 GLY B O 1 ATOM 3635 N N . THR B 1 87 ? 37.521 -28.556 25.339 1.00 57.60 ? 108 THR B N 1 ATOM 3636 C CA . THR B 1 87 ? 36.362 -28.141 24.565 1.00 62.12 ? 108 THR B CA 1 ATOM 3637 C C . THR B 1 87 ? 35.560 -27.047 25.272 1.00 61.46 ? 108 THR B C 1 ATOM 3638 O O . THR B 1 87 ? 35.480 -27.023 26.500 1.00 60.62 ? 108 THR B O 1 ATOM 3639 C CB . THR B 1 87 ? 35.467 -29.362 24.184 1.00 57.31 ? 108 THR B CB 1 ATOM 3640 O OG1 . THR B 1 87 ? 34.085 -29.031 24.365 1.00 56.37 ? 108 THR B OG1 1 ATOM 3641 C CG2 . THR B 1 87 ? 35.802 -30.561 25.044 1.00 57.95 ? 108 THR B CG2 1 ATOM 3642 N N . ILE B 1 88 ? 34.989 -26.138 24.482 1.00 59.85 ? 109 ILE B N 1 ATOM 3643 C CA . ILE B 1 88 ? 34.186 -25.035 25.009 1.00 58.29 ? 109 ILE B CA 1 ATOM 3644 C C . ILE B 1 88 ? 32.782 -24.970 24.399 1.00 66.07 ? 109 ILE B C 1 ATOM 3645 O O . ILE B 1 88 ? 32.544 -25.425 23.278 1.00 69.35 ? 109 ILE B O 1 ATOM 3646 C CB . ILE B 1 88 ? 34.876 -23.675 24.806 1.00 55.01 ? 109 ILE B CB 1 ATOM 3647 C CG1 . ILE B 1 88 ? 35.115 -23.407 23.319 1.00 54.37 ? 109 ILE B CG1 1 ATOM 3648 C CG2 . ILE B 1 88 ? 36.192 -23.613 25.578 1.00 50.86 ? 109 ILE B CG2 1 ATOM 3649 C CD1 . ILE B 1 88 ? 35.728 -22.041 23.049 1.00 50.23 ? 109 ILE B CD1 1 ATOM 3650 N N . VAL B 1 89 ? 31.857 -24.384 25.150 1.00 65.47 ? 110 VAL B N 1 ATOM 3651 C CA . VAL B 1 89 ? 30.460 -24.297 24.748 1.00 60.37 ? 110 VAL B CA 1 ATOM 3652 C C . VAL B 1 89 ? 30.091 -22.853 24.438 1.00 61.78 ? 110 VAL B C 1 ATOM 3653 O O . VAL B 1 89 ? 30.505 -21.940 25.146 1.00 61.86 ? 110 VAL B O 1 ATOM 3654 C CB . VAL B 1 89 ? 29.553 -24.824 25.870 1.00 59.10 ? 110 VAL B CB 1 ATOM 3655 C CG1 . VAL B 1 89 ? 28.271 -24.039 25.934 1.00 66.74 ? 110 VAL B CG1 1 ATOM 3656 C CG2 . VAL B 1 89 ? 29.286 -26.307 25.687 1.00 56.34 ? 110 VAL B CG2 1 ATOM 3657 N N . SER B 1 90 ? 29.309 -22.642 23.382 1.00 63.98 ? 111 SER B N 1 ATOM 3658 C CA . SER B 1 90 ? 28.951 -21.289 22.968 1.00 62.11 ? 111 SER B CA 1 ATOM 3659 C C . SER B 1 90 ? 27.655 -20.796 23.616 1.00 61.74 ? 111 SER B C 1 ATOM 3660 O O . SER B 1 90 ? 26.895 -21.574 24.198 1.00 59.44 ? 111 SER B O 1 ATOM 3661 C CB . SER B 1 90 ? 28.830 -21.210 21.444 1.00 65.77 ? 111 SER B CB 1 ATOM 3662 O OG . SER B 1 90 ? 27.545 -21.633 21.001 1.00 67.75 ? 111 SER B OG 1 ATOM 3663 N N . ARG B 1 91 ? 27.412 -19.493 23.513 1.00 57.00 ? 112 ARG B N 1 ATOM 3664 C CA . ARG B 1 91 ? 26.130 -18.934 23.903 1.00 61.39 ? 112 ARG B CA 1 ATOM 3665 C C . ARG B 1 91 ? 25.055 -19.626 23.076 1.00 74.27 ? 112 ARG B C 1 ATOM 3666 O O . ARG B 1 91 ? 25.359 -20.320 22.105 1.00 75.63 ? 112 ARG B O 1 ATOM 3667 C CB . ARG B 1 91 ? 26.096 -17.431 23.626 1.00 61.43 ? 112 ARG B CB 1 ATOM 3668 C CG . ARG B 1 91 ? 25.753 -17.086 22.184 1.00 67.72 ? 112 ARG B CG 1 ATOM 3669 C CD . ARG B 1 91 ? 25.413 -15.611 22.025 1.00 74.29 ? 112 ARG B CD 1 ATOM 3670 N NE . ARG B 1 91 ? 26.595 -14.800 21.752 1.00 77.51 ? 112 ARG B NE 1 ATOM 3671 C CZ . ARG B 1 91 ? 26.828 -14.175 20.601 1.00 82.25 ? 112 ARG B CZ 1 ATOM 3672 N NH1 . ARG B 1 91 ? 25.956 -14.253 19.606 1.00 81.43 ? 112 ARG B NH1 1 ATOM 3673 N NH2 . ARG B 1 91 ? 27.936 -13.460 20.448 1.00 85.98 ? 112 ARG B NH2 1 ATOM 3674 N N . GLU B 1 92 ? 23.798 -19.436 23.453 1.00 79.10 ? 113 GLU B N 1 ATOM 3675 C CA . GLU B 1 92 ? 22.701 -20.047 22.724 1.00 81.59 ? 113 GLU B CA 1 ATOM 3676 C C . GLU B 1 92 ? 22.139 -19.070 21.704 1.00 79.43 ? 113 GLU B C 1 ATOM 3677 O O . GLU B 1 92 ? 22.215 -17.856 21.893 1.00 78.12 ? 113 GLU B O 1 ATOM 3678 C CB . GLU B 1 92 ? 21.606 -20.492 23.688 1.00 90.39 ? 113 GLU B CB 1 ATOM 3679 C CG . GLU B 1 92 ? 22.043 -21.586 24.643 1.00 100.22 ? 113 GLU B CG 1 ATOM 3680 C CD . GLU B 1 92 ? 20.927 -22.029 25.569 1.00 109.85 ? 113 GLU B CD 1 ATOM 3681 O OE1 . GLU B 1 92 ? 20.029 -21.207 25.855 1.00 110.30 ? 113 GLU B OE1 1 ATOM 3682 O OE2 . GLU B 1 92 ? 20.950 -23.198 26.011 1.00 114.09 ? 113 GLU B OE2 1 ATOM 3683 N N . ALA B 1 93 ? 21.588 -19.608 20.620 1.00 80.83 ? 114 ALA B N 1 ATOM 3684 C CA . ALA B 1 93 ? 20.952 -18.794 19.586 1.00 79.77 ? 114 ALA B CA 1 ATOM 3685 C C . ALA B 1 93 ? 19.627 -19.406 19.174 1.00 80.15 ? 114 ALA B C 1 ATOM 3686 O O . ALA B 1 93 ? 19.528 -20.613 18.963 1.00 80.54 ? 114 ALA B O 1 ATOM 3687 C CB . ALA B 1 93 ? 21.861 -18.654 18.378 1.00 80.65 ? 114 ALA B CB 1 ATOM 3688 N N . LYS B 1 94 ? 18.604 -18.570 19.058 1.00 85.46 ? 115 LYS B N 1 ATOM 3689 C CA . LYS B 1 94 ? 17.303 -19.043 18.617 1.00 87.13 ? 115 LYS B CA 1 ATOM 3690 C C . LYS B 1 94 ? 17.113 -18.855 17.122 1.00 81.99 ? 115 LYS B C 1 ATOM 3691 O O . LYS B 1 94 ? 17.369 -17.781 16.580 1.00 84.44 ? 115 LYS B O 1 ATOM 3692 C CB . LYS B 1 94 ? 16.177 -18.351 19.388 1.00 95.37 ? 115 LYS B CB 1 ATOM 3693 C CG . LYS B 1 94 ? 15.706 -19.135 20.601 1.00 105.90 ? 115 LYS B CG 1 ATOM 3694 C CD . LYS B 1 94 ? 14.997 -18.248 21.610 1.00 112.43 ? 115 LYS B CD 1 ATOM 3695 C CE . LYS B 1 94 ? 14.808 -18.979 22.934 1.00 114.60 ? 115 LYS B CE 1 ATOM 3696 N NZ . LYS B 1 94 ? 14.540 -18.043 24.063 1.00 113.60 ? 115 LYS B NZ 1 ATOM 3697 N N . LEU B 1 95 ? 16.685 -19.922 16.460 1.00 76.57 ? 116 LEU B N 1 ATOM 3698 C CA . LEU B 1 95 ? 16.195 -19.820 15.098 1.00 81.26 ? 116 LEU B CA 1 ATOM 3699 C C . LEU B 1 95 ? 14.667 -19.766 15.137 1.00 83.52 ? 116 LEU B C 1 ATOM 3700 O O . LEU B 1 95 ? 14.018 -20.683 15.643 1.00 77.76 ? 116 LEU B O 1 ATOM 3701 C CB . LEU B 1 95 ? 16.674 -21.006 14.260 1.00 81.93 ? 116 LEU B CB 1 ATOM 3702 C CG . LEU B 1 95 ? 16.012 -21.185 12.889 1.00 80.15 ? 116 LEU B CG 1 ATOM 3703 C CD1 . LEU B 1 95 ? 16.227 -19.956 12.024 1.00 83.59 ? 116 LEU B CD1 1 ATOM 3704 C CD2 . LEU B 1 95 ? 16.543 -22.427 12.198 1.00 74.50 ? 116 LEU B CD2 1 ATOM 3705 N N . GLN B 1 96 ? 14.103 -18.676 14.627 1.00 89.66 ? 117 GLN B N 1 ATOM 3706 C CA . GLN B 1 96 ? 12.656 -18.511 14.574 1.00 94.87 ? 117 GLN B CA 1 ATOM 3707 C C . GLN B 1 96 ? 12.234 -18.247 13.141 1.00 98.32 ? 117 GLN B C 1 ATOM 3708 O O . GLN B 1 96 ? 13.043 -17.833 12.312 1.00 100.40 ? 117 GLN B O 1 ATOM 3709 C CB . GLN B 1 96 ? 12.202 -17.344 15.449 1.00 101.85 ? 117 GLN B CB 1 ATOM 3710 C CG . GLN B 1 96 ? 12.707 -17.377 16.879 1.00 108.59 ? 117 GLN B CG 1 ATOM 3711 C CD . GLN B 1 96 ? 12.211 -16.191 17.684 1.00 113.13 ? 117 GLN B CD 1 ATOM 3712 O OE1 . GLN B 1 96 ? 11.022 -15.871 17.666 1.00 117.37 ? 117 GLN B OE1 1 ATOM 3713 N NE2 . GLN B 1 96 ? 13.122 -15.528 18.390 1.00 111.08 ? 117 GLN B NE2 1 ATOM 3714 N N . PHE B 1 97 ? 10.960 -18.473 12.852 1.00 96.88 ? 118 PHE B N 1 ATOM 3715 C CA . PHE B 1 97 ? 10.463 -18.286 11.501 1.00 101.34 ? 118 PHE B CA 1 ATOM 3716 C C . PHE B 1 97 ? 9.404 -17.201 11.443 1.00 98.42 ? 118 PHE B C 1 ATOM 3717 O O . PHE B 1 97 ? 8.346 -17.316 12.060 1.00 99.57 ? 118 PHE B O 1 ATOM 3718 C CB . PHE B 1 97 ? 9.934 -19.605 10.946 1.00 109.87 ? 118 PHE B CB 1 ATOM 3719 C CG . PHE B 1 97 ? 10.986 -20.668 10.837 1.00 114.15 ? 118 PHE B CG 1 ATOM 3720 C CD1 . PHE B 1 97 ? 11.597 -20.932 9.625 1.00 118.68 ? 118 PHE B CD1 1 ATOM 3721 C CD2 . PHE B 1 97 ? 11.380 -21.386 11.952 1.00 113.10 ? 118 PHE B CD2 1 ATOM 3722 C CE1 . PHE B 1 97 ? 12.572 -21.904 9.524 1.00 119.23 ? 118 PHE B CE1 1 ATOM 3723 C CE2 . PHE B 1 97 ? 12.355 -22.359 11.859 1.00 113.48 ? 118 PHE B CE2 1 ATOM 3724 C CZ . PHE B 1 97 ? 12.951 -22.618 10.642 1.00 117.26 ? 118 PHE B CZ 1 ATOM 3725 N N . ALA B 1 98 ? 9.712 -16.139 10.706 1.00 94.93 ? 119 ALA B N 1 ATOM 3726 C CA . ALA B 1 98 ? 8.782 -15.036 10.509 1.00 96.26 ? 119 ALA B CA 1 ATOM 3727 C C . ALA B 1 98 ? 7.929 -15.268 9.270 1.00 98.70 ? 119 ALA B C 1 ATOM 3728 O O . ALA B 1 98 ? 8.321 -15.991 8.354 1.00 99.72 ? 119 ALA B O 1 ATOM 3729 C CB . ALA B 1 98 ? 9.534 -13.718 10.393 1.00 94.78 ? 119 ALA B CB 1 ATOM 3730 N N . TYR B 1 99 ? 6.755 -14.650 9.253 1.00 97.21 ? 120 TYR B N 1 ATOM 3731 C CA . TYR B 1 99 ? 5.874 -14.709 8.101 1.00 95.51 ? 120 TYR B CA 1 ATOM 3732 C C . TYR B 1 99 ? 4.687 -13.798 8.353 1.00 96.46 ? 120 TYR B C 1 ATOM 3733 O O . TYR B 1 99 ? 4.492 -13.310 9.468 1.00 95.17 ? 120 TYR B O 1 ATOM 3734 C CB . TYR B 1 99 ? 5.399 -16.141 7.840 1.00 94.10 ? 120 TYR B CB 1 ATOM 3735 C CG . TYR B 1 99 ? 4.410 -16.647 8.861 1.00 98.01 ? 120 TYR B CG 1 ATOM 3736 C CD1 . TYR B 1 99 ? 4.837 -17.343 9.983 1.00 99.09 ? 120 TYR B CD1 1 ATOM 3737 C CD2 . TYR B 1 99 ? 3.047 -16.427 8.707 1.00 105.14 ? 120 TYR B CD2 1 ATOM 3738 C CE1 . TYR B 1 99 ? 3.938 -17.807 10.924 1.00 102.14 ? 120 TYR B CE1 1 ATOM 3739 C CE2 . TYR B 1 99 ? 2.137 -16.886 9.643 1.00 108.55 ? 120 TYR B CE2 1 ATOM 3740 C CZ . TYR B 1 99 ? 2.590 -17.576 10.751 1.00 107.62 ? 120 TYR B CZ 1 ATOM 3741 O OH . TYR B 1 99 ? 1.693 -18.038 11.688 1.00 108.16 ? 120 TYR B OH 1 ATOM 3742 N N . LEU B 1 100 ? 3.900 -13.573 7.309 1.00 95.81 ? 121 LEU B N 1 ATOM 3743 C CA . LEU B 1 100 ? 2.727 -12.718 7.394 1.00 92.74 ? 121 LEU B CA 1 ATOM 3744 C C . LEU B 1 100 ? 1.805 -13.034 6.228 1.00 91.71 ? 121 LEU B C 1 ATOM 3745 O O . LEU B 1 100 ? 2.142 -12.765 5.077 1.00 76.87 ? 121 LEU B O 1 ATOM 3746 C CB . LEU B 1 100 ? 3.137 -11.245 7.360 1.00 88.21 ? 121 LEU B CB 1 ATOM 3747 C CG . LEU B 1 100 ? 2.024 -10.201 7.270 1.00 87.76 ? 121 LEU B CG 1 ATOM 3748 C CD1 . LEU B 1 100 ? 1.102 -10.273 8.480 1.00 75.99 ? 121 LEU B CD1 1 ATOM 3749 C CD2 . LEU B 1 100 ? 2.622 -8.813 7.123 1.00 74.09 ? 121 LEU B CD2 1 ATOM 3750 N N . GLU B 1 101 ? 0.653 -13.623 6.532 1.00 92.04 ? 122 GLU B N 1 ATOM 3751 C CA . GLU B 1 101 ? -0.324 -13.977 5.509 1.00 95.88 ? 122 GLU B CA 1 ATOM 3752 C C . GLU B 1 101 ? -1.080 -12.749 5.030 1.00 93.59 ? 122 GLU B C 1 ATOM 3753 O O . GLU B 1 101 ? -1.042 -11.693 5.663 1.00 87.88 ? 122 GLU B O 1 ATOM 3754 C CB . GLU B 1 101 ? -1.335 -14.987 6.053 1.00 102.23 ? 122 GLU B CB 1 ATOM 3755 C CG . GLU B 1 101 ? -0.735 -16.248 6.637 1.00 106.12 ? 122 GLU B CG 1 ATOM 3756 C CD . GLU B 1 101 ? -1.795 -17.147 7.245 1.00 110.02 ? 122 GLU B CD 1 ATOM 3757 O OE1 . GLU B 1 101 ? -2.990 -16.792 7.165 1.00 109.86 ? 122 GLU B OE1 1 ATOM 3758 O OE2 . GLU B 1 101 ? -1.434 -18.205 7.803 1.00 111.13 ? 122 GLU B OE2 1 ATOM 3759 N N . ASN B 1 102 ? -1.775 -12.894 3.908 1.00 98.48 ? 123 ASN B N 1 ATOM 3760 C CA . ASN B 1 102 ? -2.678 -11.853 3.446 1.00 96.24 ? 123 ASN B CA 1 ATOM 3761 C C . ASN B 1 102 ? -3.974 -11.940 4.230 1.00 94.22 ? 123 ASN B C 1 ATOM 3762 O O . ASN B 1 102 ? -4.245 -12.953 4.876 1.00 91.42 ? 123 ASN B O 1 ATOM 3763 C CB . ASN B 1 102 ? -2.964 -12.005 1.952 1.00 96.68 ? 123 ASN B CB 1 ATOM 3764 C CG . ASN B 1 102 ? -1.705 -11.967 1.111 1.00 95.59 ? 123 ASN B CG 1 ATOM 3765 O OD1 . ASN B 1 102 ? -1.351 -10.928 0.552 1.00 98.80 ? 123 ASN B OD1 1 ATOM 3766 N ND2 . ASN B 1 102 ? -1.016 -13.100 1.021 1.00 90.98 ? 123 ASN B ND2 1 ATOM 3767 N N . PHE B 1 103 ? -4.767 -10.876 4.187 1.00 96.16 ? 124 PHE B N 1 ATOM 3768 C CA . PHE B 1 103 ? -6.091 -10.906 4.792 1.00 101.37 ? 124 PHE B CA 1 ATOM 3769 C C . PHE B 1 103 ? -6.967 -11.903 4.046 1.00 108.81 ? 124 PHE B C 1 ATOM 3770 O O . PHE B 1 103 ? -6.834 -12.072 2.833 1.00 106.32 ? 124 PHE B O 1 ATOM 3771 C CB . PHE B 1 103 ? -6.736 -9.524 4.752 1.00 98.48 ? 124 PHE B CB 1 ATOM 3772 C CG . PHE B 1 103 ? -6.074 -8.519 5.647 1.00 91.50 ? 124 PHE B CG 1 ATOM 3773 C CD1 . PHE B 1 103 ? -4.892 -7.910 5.271 1.00 86.71 ? 124 PHE B CD1 1 ATOM 3774 C CD2 . PHE B 1 103 ? -6.641 -8.177 6.862 1.00 89.64 ? 124 PHE B CD2 1 ATOM 3775 C CE1 . PHE B 1 103 ? -4.287 -6.981 6.090 1.00 88.93 ? 124 PHE B CE1 1 ATOM 3776 C CE2 . PHE B 1 103 ? -6.042 -7.250 7.685 1.00 89.52 ? 124 PHE B CE2 1 ATOM 3777 C CZ . PHE B 1 103 ? -4.863 -6.651 7.300 1.00 90.24 ? 124 PHE B CZ 1 ATOM 3778 N N . LYS B 1 104 ? -7.855 -12.567 4.777 1.00 119.88 ? 125 LYS B N 1 ATOM 3779 C CA . LYS B 1 104 ? -8.796 -13.502 4.173 1.00 132.28 ? 125 LYS B CA 1 ATOM 3780 C C . LYS B 1 104 ? -9.704 -12.798 3.173 1.00 136.63 ? 125 LYS B C 1 ATOM 3781 O O . LYS B 1 104 ? -9.576 -12.980 1.961 1.00 138.69 ? 125 LYS B O 1 ATOM 3782 C CB . LYS B 1 104 ? -9.643 -14.174 5.256 1.00 137.81 ? 125 LYS B CB 1 ATOM 3783 C CG . LYS B 1 104 ? -9.222 -15.593 5.602 1.00 139.46 ? 125 LYS B CG 1 ATOM 3784 C CD . LYS B 1 104 ? -9.792 -16.583 4.597 1.00 141.70 ? 125 LYS B CD 1 ATOM 3785 C CE . LYS B 1 104 ? -9.838 -17.990 5.170 1.00 140.79 ? 125 LYS B CE 1 ATOM 3786 N NZ . LYS B 1 104 ? -10.613 -18.919 4.301 1.00 141.27 ? 125 LYS B NZ 1 ATOM 3787 N N . THR B 1 105 ? -10.618 -11.987 3.693 1.00 138.05 ? 126 THR B N 1 ATOM 3788 C CA . THR B 1 105 ? -11.626 -11.339 2.866 1.00 142.64 ? 126 THR B CA 1 ATOM 3789 C C . THR B 1 105 ? -11.059 -10.178 2.054 1.00 139.07 ? 126 THR B C 1 ATOM 3790 O O . THR B 1 105 ? -9.964 -9.686 2.327 1.00 136.48 ? 126 THR B O 1 ATOM 3791 C CB . THR B 1 105 ? -12.804 -10.827 3.718 1.00 146.87 ? 126 THR B CB 1 ATOM 3792 O OG1 . THR B 1 105 ? -13.844 -10.340 2.860 1.00 150.25 ? 126 THR B OG1 1 ATOM 3793 C CG2 . THR B 1 105 ? -12.347 -9.714 4.648 1.00 144.73 ? 126 THR B CG2 1 ATOM 3794 N N . ARG B 1 106 ? -11.819 -9.754 1.049 1.00 136.27 ? 127 ARG B N 1 ATOM 3795 C CA . ARG B 1 106 ? -11.456 -8.602 0.236 1.00 130.80 ? 127 ARG B CA 1 ATOM 3796 C C . ARG B 1 106 ? -12.583 -7.567 0.299 1.00 127.61 ? 127 ARG B C 1 ATOM 3797 O O . ARG B 1 106 ? -12.537 -6.533 -0.370 1.00 124.10 ? 127 ARG B O 1 ATOM 3798 C CB . ARG B 1 106 ? -11.156 -9.039 -1.206 1.00 131.10 ? 127 ARG B CB 1 ATOM 3799 C CG . ARG B 1 106 ? -10.271 -10.290 -1.282 1.00 129.50 ? 127 ARG B CG 1 ATOM 3800 C CD . ARG B 1 106 ? -9.785 -10.619 -2.695 1.00 125.90 ? 127 ARG B CD 1 ATOM 3801 N NE . ARG B 1 106 ? -9.452 -12.039 -2.822 1.00 120.05 ? 127 ARG B NE 1 ATOM 3802 C CZ . ARG B 1 106 ? -8.668 -12.558 -3.764 1.00 113.24 ? 127 ARG B CZ 1 ATOM 3803 N NH1 . ARG B 1 106 ? -8.109 -11.782 -4.676 1.00 110.42 ? 127 ARG B NH1 1 ATOM 3804 N NH2 . ARG B 1 106 ? -8.435 -13.862 -3.789 1.00 111.90 ? 127 ARG B NH2 1 ATOM 3805 N N . THR B 1 107 ? -13.586 -7.856 1.126 1.00 129.58 ? 128 THR B N 1 ATOM 3806 C CA . THR B 1 107 ? -14.729 -6.965 1.335 1.00 130.84 ? 128 THR B CA 1 ATOM 3807 C C . THR B 1 107 ? -15.138 -6.903 2.809 1.00 135.03 ? 128 THR B C 1 ATOM 3808 O O . THR B 1 107 ? -15.255 -7.934 3.472 1.00 137.38 ? 128 THR B O 1 ATOM 3809 C CB . THR B 1 107 ? -15.961 -7.402 0.503 1.00 125.39 ? 128 THR B CB 1 ATOM 3810 O OG1 . THR B 1 107 ? -17.138 -6.781 1.032 1.00 121.46 ? 128 THR B OG1 1 ATOM 3811 C CG2 . THR B 1 107 ? -16.143 -8.912 0.557 1.00 125.45 ? 128 THR B CG2 1 ATOM 3812 N N . ARG B 1 108 ? -15.358 -5.694 3.317 1.00 133.84 ? 129 ARG B N 1 ATOM 3813 C CA . ARG B 1 108 ? -15.820 -5.524 4.693 1.00 132.99 ? 129 ARG B CA 1 ATOM 3814 C C . ARG B 1 108 ? -17.044 -4.623 4.776 1.00 142.14 ? 129 ARG B C 1 ATOM 3815 O O . ARG B 1 108 ? -17.230 -3.730 3.949 1.00 142.36 ? 129 ARG B O 1 ATOM 3816 C CB . ARG B 1 108 ? -14.708 -4.973 5.584 1.00 125.31 ? 129 ARG B CB 1 ATOM 3817 C CG . ARG B 1 108 ? -13.702 -6.017 6.028 1.00 119.40 ? 129 ARG B CG 1 ATOM 3818 C CD . ARG B 1 108 ? -12.864 -5.510 7.184 1.00 116.98 ? 129 ARG B CD 1 ATOM 3819 N NE . ARG B 1 108 ? -11.770 -6.425 7.495 1.00 119.86 ? 129 ARG B NE 1 ATOM 3820 C CZ . ARG B 1 108 ? -10.864 -6.214 8.444 1.00 122.49 ? 129 ARG B CZ 1 ATOM 3821 N NH1 . ARG B 1 108 ? -10.920 -5.116 9.186 1.00 122.73 ? 129 ARG B NH1 1 ATOM 3822 N NH2 . ARG B 1 108 ? -9.903 -7.104 8.653 1.00 123.78 ? 129 ARG B NH2 1 ATOM 3823 N N . SER B 1 109 ? -17.874 -4.865 5.787 1.00 105.99 ? 130 SER B N 1 ATOM 3824 C CA . SER B 1 109 ? -19.094 -4.089 5.990 1.00 109.37 ? 130 SER B CA 1 ATOM 3825 C C . SER B 1 109 ? -18.822 -2.590 6.021 1.00 108.47 ? 130 SER B C 1 ATOM 3826 O O . SER B 1 109 ? -17.751 -2.149 6.432 1.00 111.78 ? 130 SER B O 1 ATOM 3827 C CB . SER B 1 109 ? -19.791 -4.516 7.282 1.00 112.16 ? 130 SER B CB 1 ATOM 3828 O OG . SER B 1 109 ? -20.793 -3.583 7.648 1.00 115.44 ? 130 SER B OG 1 ATOM 3829 N N . THR B 1 110 ? -19.805 -1.812 5.586 1.00 108.16 ? 131 THR B N 1 ATOM 3830 C CA . THR B 1 110 ? -19.683 -0.361 5.559 1.00 103.43 ? 131 THR B CA 1 ATOM 3831 C C . THR B 1 110 ? -20.185 0.266 6.863 1.00 100.22 ? 131 THR B C 1 ATOM 3832 O O . THR B 1 110 ? -21.390 0.371 7.088 1.00 100.42 ? 131 THR B O 1 ATOM 3833 C CB . THR B 1 110 ? -20.419 0.232 4.337 1.00 99.96 ? 131 THR B CB 1 ATOM 3834 O OG1 . THR B 1 110 ? -20.960 1.516 4.671 1.00 98.93 ? 131 THR B OG1 1 ATOM 3835 C CG2 . THR B 1 110 ? -21.548 -0.688 3.900 1.00 102.83 ? 131 THR B CG2 1 ATOM 3836 N N . VAL B 1 111 ? -19.243 0.671 7.714 1.00 93.29 ? 132 VAL B N 1 ATOM 3837 C CA . VAL B 1 111 ? -19.537 1.240 9.030 1.00 91.48 ? 132 VAL B CA 1 ATOM 3838 C C . VAL B 1 111 ? -20.195 2.619 8.930 1.00 101.66 ? 132 VAL B C 1 ATOM 3839 O O . VAL B 1 111 ? -20.170 3.252 7.875 1.00 104.73 ? 132 VAL B O 1 ATOM 3840 C CB . VAL B 1 111 ? -18.238 1.366 9.881 1.00 84.40 ? 132 VAL B CB 1 ATOM 3841 C CG1 . VAL B 1 111 ? -18.545 1.870 11.283 1.00 87.78 ? 132 VAL B CG1 1 ATOM 3842 C CG2 . VAL B 1 111 ? -17.497 0.030 9.948 1.00 72.73 ? 132 VAL B CG2 1 ATOM 3843 N N . SER B 1 112 ? -20.780 3.080 10.034 1.00 107.83 ? 133 SER B N 1 ATOM 3844 C CA . SER B 1 112 ? -21.402 4.401 10.086 1.00 112.30 ? 133 SER B CA 1 ATOM 3845 C C . SER B 1 112 ? -21.552 4.904 11.522 1.00 112.47 ? 133 SER B C 1 ATOM 3846 O O . SER B 1 112 ? -21.628 4.110 12.460 1.00 114.32 ? 133 SER B O 1 ATOM 3847 C CB . SER B 1 112 ? -22.765 4.356 9.422 1.00 119.57 ? 133 SER B CB 1 ATOM 3848 O OG . SER B 1 112 ? -23.632 3.507 10.150 1.00 124.78 ? 133 SER B OG 1 ATOM 3849 N N . VAL B 1 113 ? -21.619 6.224 11.682 1.00 111.36 ? 134 VAL B N 1 ATOM 3850 C CA . VAL B 1 113 ? -21.588 6.841 13.008 1.00 110.47 ? 134 VAL B CA 1 ATOM 3851 C C . VAL B 1 113 ? -22.149 8.268 13.023 1.00 110.37 ? 134 VAL B C 1 ATOM 3852 O O . VAL B 1 113 ? -22.161 8.950 11.998 1.00 105.01 ? 134 VAL B O 1 ATOM 3853 C CB . VAL B 1 113 ? -20.144 6.828 13.582 1.00 132.08 ? 134 VAL B CB 1 ATOM 3854 C CG1 . VAL B 1 113 ? -19.818 8.125 14.307 1.00 133.13 ? 134 VAL B CG1 1 ATOM 3855 C CG2 . VAL B 1 113 ? -19.938 5.624 14.490 1.00 129.76 ? 134 VAL B CG2 1 ATOM 3856 N N . ARG B 1 114 ? -22.625 8.701 14.189 1.00 116.50 ? 135 ARG B N 1 ATOM 3857 C CA . ARG B 1 114 ? -23.106 10.069 14.378 1.00 122.42 ? 135 ARG B CA 1 ATOM 3858 C C . ARG B 1 114 ? -21.948 11.061 14.351 1.00 126.62 ? 135 ARG B C 1 ATOM 3859 O O . ARG B 1 114 ? -20.915 10.830 14.976 1.00 126.43 ? 135 ARG B O 1 ATOM 3860 C CB . ARG B 1 114 ? -23.836 10.198 15.716 1.00 121.36 ? 135 ARG B CB 1 ATOM 3861 C CG . ARG B 1 114 ? -25.208 9.560 15.762 1.00 123.85 ? 135 ARG B CG 1 ATOM 3862 C CD . ARG B 1 114 ? -25.763 9.608 17.176 1.00 128.00 ? 135 ARG B CD 1 ATOM 3863 N NE . ARG B 1 114 ? -27.222 9.594 17.201 1.00 135.40 ? 135 ARG B NE 1 ATOM 3864 C CZ . ARG B 1 114 ? -27.946 9.736 18.306 1.00 140.71 ? 135 ARG B CZ 1 ATOM 3865 N NH1 . ARG B 1 114 ? -27.341 9.898 19.476 1.00 142.59 ? 135 ARG B NH1 1 ATOM 3866 N NH2 . ARG B 1 114 ? -29.272 9.716 18.246 1.00 139.71 ? 135 ARG B NH2 1 ATOM 3867 N N . ARG B 1 115 ? -22.127 12.173 13.646 1.00 131.23 ? 136 ARG B N 1 ATOM 3868 C CA . ARG B 1 115 ? -21.074 13.179 13.553 1.00 134.00 ? 136 ARG B CA 1 ATOM 3869 C C . ARG B 1 115 ? -20.754 13.780 14.919 1.00 130.10 ? 136 ARG B C 1 ATOM 3870 O O . ARG B 1 115 ? -21.650 14.230 15.632 1.00 131.49 ? 136 ARG B O 1 ATOM 3871 C CB . ARG B 1 115 ? -21.452 14.292 12.574 1.00 145.20 ? 136 ARG B CB 1 ATOM 3872 C CG . ARG B 1 115 ? -20.236 15.006 12.011 1.00 154.63 ? 136 ARG B CG 1 ATOM 3873 C CD . ARG B 1 115 ? -20.465 16.491 11.787 1.00 164.15 ? 136 ARG B CD 1 ATOM 3874 N NE . ARG B 1 115 ? -19.190 17.208 11.772 1.00 169.21 ? 136 ARG B NE 1 ATOM 3875 C CZ . ARG B 1 115 ? -19.057 18.509 11.536 1.00 172.15 ? 136 ARG B CZ 1 ATOM 3876 N NH1 . ARG B 1 115 ? -20.126 19.254 11.287 1.00 174.72 ? 136 ARG B NH1 1 ATOM 3877 N NH2 . ARG B 1 115 ? -17.851 19.063 11.548 1.00 170.23 ? 136 ARG B NH2 1 ATOM 3878 N N . GLY B 1 116 ? -19.472 13.786 15.273 1.00 126.57 ? 137 GLY B N 1 ATOM 3879 C CA . GLY B 1 116 ? -19.028 14.322 16.548 1.00 121.89 ? 137 GLY B CA 1 ATOM 3880 C C . GLY B 1 116 ? -18.849 13.242 17.596 1.00 118.37 ? 137 GLY B C 1 ATOM 3881 O O . GLY B 1 116 ? -18.686 13.529 18.782 1.00 119.17 ? 137 GLY B O 1 ATOM 3882 N N . GLN B 1 117 ? -18.879 11.989 17.156 1.00 115.66 ? 138 GLN B N 1 ATOM 3883 C CA . GLN B 1 117 ? -18.743 10.859 18.064 1.00 116.08 ? 138 GLN B CA 1 ATOM 3884 C C . GLN B 1 117 ? -17.358 10.230 17.947 1.00 108.07 ? 138 GLN B C 1 ATOM 3885 O O . GLN B 1 117 ? -16.596 10.547 17.033 1.00 102.49 ? 138 GLN B O 1 ATOM 3886 C CB . GLN B 1 117 ? -19.819 9.813 17.770 1.00 124.99 ? 138 GLN B CB 1 ATOM 3887 C CG . GLN B 1 117 ? -19.896 8.694 18.795 1.00 132.74 ? 138 GLN B CG 1 ATOM 3888 C CD . GLN B 1 117 ? -20.615 7.470 18.268 1.00 139.26 ? 138 GLN B CD 1 ATOM 3889 O OE1 . GLN B 1 117 ? -20.942 7.390 17.083 1.00 141.29 ? 138 GLN B OE1 1 ATOM 3890 N NE2 . GLN B 1 117 ? -20.861 6.504 19.146 1.00 141.10 ? 138 GLN B NE2 1 ATOM 3891 N N . GLY B 1 118 ? -17.039 9.338 18.879 1.00 104.37 ? 139 GLY B N 1 ATOM 3892 C CA . GLY B 1 118 ? -15.774 8.629 18.855 1.00 99.00 ? 139 GLY B CA 1 ATOM 3893 C C . GLY B 1 118 ? -15.867 7.315 18.104 1.00 94.03 ? 139 GLY B C 1 ATOM 3894 O O . GLY B 1 118 ? -16.835 6.570 18.257 1.00 89.46 ? 139 GLY B O 1 ATOM 3895 N N . MET B 1 119 ? -14.854 7.031 17.289 1.00 94.76 ? 140 MET B N 1 ATOM 3896 C CA . MET B 1 119 ? -14.801 5.786 16.525 1.00 91.43 ? 140 MET B CA 1 ATOM 3897 C C . MET B 1 119 ? -13.517 4.990 16.728 1.00 93.66 ? 140 MET B C 1 ATOM 3898 O O . MET B 1 119 ? -12.514 5.505 17.221 1.00 95.10 ? 140 MET B O 1 ATOM 3899 C CB . MET B 1 119 ? -14.991 6.056 15.033 1.00 83.84 ? 140 MET B CB 1 ATOM 3900 C CG . MET B 1 119 ? -16.328 5.595 14.513 1.00 80.03 ? 140 MET B CG 1 ATOM 3901 S SD . MET B 1 119 ? -16.580 3.827 14.769 1.00 206.91 ? 140 MET B SD 1 ATOM 3902 C CE . MET B 1 119 ? -15.361 3.145 13.650 1.00 120.47 ? 140 MET B CE 1 ATOM 3903 N N . VAL B 1 120 ? -13.564 3.724 16.332 1.00 92.75 ? 141 VAL B N 1 ATOM 3904 C CA . VAL B 1 120 ? -12.394 2.862 16.364 1.00 95.76 ? 141 VAL B CA 1 ATOM 3905 C C . VAL B 1 120 ? -12.470 1.850 15.227 1.00 95.00 ? 141 VAL B C 1 ATOM 3906 O O . VAL B 1 120 ? -13.336 0.974 15.220 1.00 92.02 ? 141 VAL B O 1 ATOM 3907 C CB . VAL B 1 120 ? -12.262 2.131 17.716 1.00 99.47 ? 141 VAL B CB 1 ATOM 3908 C CG1 . VAL B 1 120 ? -13.632 1.704 18.229 1.00 107.86 ? 141 VAL B CG1 1 ATOM 3909 C CG2 . VAL B 1 120 ? -11.324 0.939 17.588 1.00 94.59 ? 141 VAL B CG2 1 ATOM 3910 N N . LEU B 1 121 ? -11.567 1.987 14.259 1.00 95.38 ? 142 LEU B N 1 ATOM 3911 C CA . LEU B 1 121 ? -11.527 1.087 13.112 1.00 96.05 ? 142 LEU B CA 1 ATOM 3912 C C . LEU B 1 121 ? -10.572 -0.073 13.343 1.00 94.89 ? 142 LEU B C 1 ATOM 3913 O O . LEU B 1 121 ? -9.361 0.116 13.445 1.00 96.56 ? 142 LEU B O 1 ATOM 3914 C CB . LEU B 1 121 ? -11.136 1.839 11.839 1.00 100.31 ? 142 LEU B CB 1 ATOM 3915 C CG . LEU B 1 121 ? -12.268 2.592 11.139 1.00 107.60 ? 142 LEU B CG 1 ATOM 3916 C CD1 . LEU B 1 121 ? -12.517 3.941 11.795 1.00 111.55 ? 142 LEU B CD1 1 ATOM 3917 C CD2 . LEU B 1 121 ? -11.947 2.766 9.671 1.00 107.35 ? 142 LEU B CD2 1 ATOM 3918 N N . LEU B 1 122 ? -11.133 -1.275 13.414 1.00 93.17 ? 143 LEU B N 1 ATOM 3919 C CA . LEU B 1 122 ? -10.364 -2.479 13.691 1.00 88.44 ? 143 LEU B CA 1 ATOM 3920 C C . LEU B 1 122 ? -9.513 -2.893 12.497 1.00 84.41 ? 143 LEU B C 1 ATOM 3921 O O . LEU B 1 122 ? -10.031 -3.124 11.405 1.00 81.89 ? 143 LEU B O 1 ATOM 3922 C CB . LEU B 1 122 ? -11.310 -3.618 14.067 1.00 90.34 ? 143 LEU B CB 1 ATOM 3923 C CG . LEU B 1 122 ? -12.322 -3.275 15.161 1.00 92.80 ? 143 LEU B CG 1 ATOM 3924 C CD1 . LEU B 1 122 ? -13.708 -3.807 14.815 1.00 94.17 ? 143 LEU B CD1 1 ATOM 3925 C CD2 . LEU B 1 122 ? -11.849 -3.789 16.512 1.00 91.74 ? 143 LEU B CD2 1 ATOM 3926 N N . CYS B 1 123 ? -8.204 -2.977 12.713 1.00 84.58 ? 144 CYS B N 1 ATOM 3927 C CA . CYS B 1 123 ? -7.292 -3.480 11.696 1.00 84.66 ? 144 CYS B CA 1 ATOM 3928 C C . CYS B 1 123 ? -7.462 -4.989 11.596 1.00 85.40 ? 144 CYS B C 1 ATOM 3929 O O . CYS B 1 123 ? -7.791 -5.517 10.534 1.00 81.38 ? 144 CYS B O 1 ATOM 3930 C CB . CYS B 1 123 ? -5.843 -3.133 12.052 1.00 84.91 ? 144 CYS B CB 1 ATOM 3931 S SG . CYS B 1 123 ? -4.639 -3.339 10.706 1.00 117.36 ? 144 CYS B SG 1 ATOM 3932 N N . GLY B 1 124 ? -7.249 -5.678 12.713 1.00 88.00 ? 145 GLY B N 1 ATOM 3933 C CA . GLY B 1 124 ? -7.393 -7.120 12.758 1.00 89.49 ? 145 GLY B CA 1 ATOM 3934 C C . GLY B 1 124 ? -6.407 -7.811 11.840 1.00 89.98 ? 145 GLY B C 1 ATOM 3935 O O . GLY B 1 124 ? -6.760 -8.210 10.733 1.00 92.91 ? 145 GLY B O 1 ATOM 3936 N N . PRO B 1 125 ? -5.159 -7.961 12.301 1.00 89.30 ? 146 PRO B N 1 ATOM 3937 C CA . PRO B 1 125 ? -4.063 -8.520 11.501 1.00 86.43 ? 146 PRO B CA 1 ATOM 3938 C C . PRO B 1 125 ? -4.298 -9.980 11.133 1.00 82.30 ? 146 PRO B C 1 ATOM 3939 O O . PRO B 1 125 ? -5.037 -10.672 11.835 1.00 75.31 ? 146 PRO B O 1 ATOM 3940 C CB . PRO B 1 125 ? -2.853 -8.421 12.441 1.00 86.80 ? 146 PRO B CB 1 ATOM 3941 C CG . PRO B 1 125 ? -3.253 -7.449 13.505 1.00 89.88 ? 146 PRO B CG 1 ATOM 3942 C CD . PRO B 1 125 ? -4.726 -7.609 13.663 1.00 90.36 ? 146 PRO B CD 1 ATOM 3943 N N . PRO B 1 126 ? -3.684 -10.437 10.030 1.00 83.30 ? 147 PRO B N 1 ATOM 3944 C CA . PRO B 1 126 ? -3.665 -11.846 9.625 1.00 83.88 ? 147 PRO B CA 1 ATOM 3945 C C . PRO B 1 126 ? -2.645 -12.617 10.449 1.00 87.81 ? 147 PRO B C 1 ATOM 3946 O O . PRO B 1 126 ? -1.751 -12.000 11.029 1.00 88.57 ? 147 PRO B O 1 ATOM 3947 C CB . PRO B 1 126 ? -3.209 -11.787 8.161 1.00 81.51 ? 147 PRO B CB 1 ATOM 3948 C CG . PRO B 1 126 ? -3.384 -10.356 7.745 1.00 82.86 ? 147 PRO B CG 1 ATOM 3949 C CD . PRO B 1 126 ? -3.132 -9.565 8.984 1.00 84.08 ? 147 PRO B CD 1 ATOM 3950 N N . PRO B 1 127 ? -2.771 -13.952 10.498 1.00 92.06 ? 148 PRO B N 1 ATOM 3951 C CA . PRO B 1 127 ? -1.824 -14.772 11.264 1.00 90.66 ? 148 PRO B CA 1 ATOM 3952 C C . PRO B 1 127 ? -0.395 -14.447 10.854 1.00 88.57 ? 148 PRO B C 1 ATOM 3953 O O . PRO B 1 127 ? -0.135 -14.202 9.678 1.00 89.48 ? 148 PRO B O 1 ATOM 3954 C CB . PRO B 1 127 ? -2.188 -16.201 10.856 1.00 91.79 ? 148 PRO B CB 1 ATOM 3955 C CG . PRO B 1 127 ? -3.617 -16.117 10.419 1.00 93.90 ? 148 PRO B CG 1 ATOM 3956 C CD . PRO B 1 127 ? -3.766 -14.769 9.782 1.00 91.80 ? 148 PRO B CD 1 ATOM 3957 N N . HIS B 1 128 ? 0.519 -14.442 11.814 1.00 89.27 ? 149 HIS B N 1 ATOM 3958 C CA . HIS B 1 128 ? 1.871 -13.974 11.558 1.00 90.47 ? 149 HIS B CA 1 ATOM 3959 C C . HIS B 1 128 ? 2.844 -14.496 12.605 1.00 89.22 ? 149 HIS B C 1 ATOM 3960 O O . HIS B 1 128 ? 2.443 -15.135 13.576 1.00 91.88 ? 149 HIS B O 1 ATOM 3961 C CB . HIS B 1 128 ? 1.886 -12.450 11.599 1.00 89.76 ? 149 HIS B CB 1 ATOM 3962 C CG . HIS B 1 128 ? 1.511 -11.891 12.936 1.00 91.55 ? 149 HIS B CG 1 ATOM 3963 N ND1 . HIS B 1 128 ? 0.200 -11.780 13.352 1.00 92.54 ? 149 HIS B ND1 1 ATOM 3964 C CD2 . HIS B 1 128 ? 2.269 -11.437 13.958 1.00 94.84 ? 149 HIS B CD2 1 ATOM 3965 C CE1 . HIS B 1 128 ? 0.168 -11.268 14.567 1.00 94.74 ? 149 HIS B CE1 1 ATOM 3966 N NE2 . HIS B 1 128 ? 1.415 -11.051 14.961 1.00 98.33 ? 149 HIS B NE2 1 ATOM 3967 N N . SER B 1 129 ? 4.125 -14.213 12.395 1.00 84.95 ? 150 SER B N 1 ATOM 3968 C CA . SER B 1 129 ? 5.149 -14.458 13.400 1.00 82.10 ? 150 SER B CA 1 ATOM 3969 C C . SER B 1 129 ? 6.210 -13.367 13.308 1.00 81.65 ? 150 SER B C 1 ATOM 3970 O O . SER B 1 129 ? 6.908 -13.250 12.300 1.00 78.32 ? 150 SER B O 1 ATOM 3971 C CB . SER B 1 129 ? 5.780 -15.837 13.217 1.00 82.39 ? 150 SER B CB 1 ATOM 3972 O OG . SER B 1 129 ? 6.675 -16.131 14.282 1.00 84.20 ? 150 SER B OG 1 ATOM 3973 N N . GLY B 1 130 ? 6.320 -12.566 14.362 1.00 85.08 ? 151 GLY B N 1 ATOM 3974 C CA . GLY B 1 130 ? 7.219 -11.427 14.365 1.00 86.06 ? 151 GLY B CA 1 ATOM 3975 C C . GLY B 1 130 ? 6.488 -10.156 14.754 1.00 88.85 ? 151 GLY B C 1 ATOM 3976 O O . GLY B 1 130 ? 5.259 -10.115 14.760 1.00 90.06 ? 151 GLY B O 1 ATOM 3977 N N . GLU B 1 131 ? 7.245 -9.116 15.082 1.00 90.70 ? 152 GLU B N 1 ATOM 3978 C CA . GLU B 1 131 ? 6.662 -7.843 15.492 1.00 90.15 ? 152 GLU B CA 1 ATOM 3979 C C . GLU B 1 131 ? 6.123 -7.067 14.292 1.00 83.88 ? 152 GLU B C 1 ATOM 3980 O O . GLU B 1 131 ? 6.827 -6.865 13.299 1.00 82.03 ? 152 GLU B O 1 ATOM 3981 C CB . GLU B 1 131 ? 7.694 -7.008 16.252 1.00 95.22 ? 152 GLU B CB 1 ATOM 3982 C CG . GLU B 1 131 ? 7.222 -5.615 16.645 1.00 101.34 ? 152 GLU B CG 1 ATOM 3983 C CD . GLU B 1 131 ? 8.268 -4.856 17.446 1.00 106.36 ? 152 GLU B CD 1 ATOM 3984 O OE1 . GLU B 1 131 ? 8.706 -5.378 18.493 1.00 110.84 ? 152 GLU B OE1 1 ATOM 3985 O OE2 . GLU B 1 131 ? 8.653 -3.741 17.032 1.00 104.14 ? 152 GLU B OE2 1 ATOM 3986 N N . LEU B 1 132 ? 4.870 -6.635 14.389 1.00 75.14 ? 153 LEU B N 1 ATOM 3987 C CA . LEU B 1 132 ? 4.236 -5.904 13.302 1.00 76.17 ? 153 LEU B CA 1 ATOM 3988 C C . LEU B 1 132 ? 4.170 -4.411 13.590 1.00 76.03 ? 153 LEU B C 1 ATOM 3989 O O . LEU B 1 132 ? 4.067 -3.992 14.742 1.00 78.85 ? 153 LEU B O 1 ATOM 3990 C CB . LEU B 1 132 ? 2.820 -6.432 13.049 1.00 77.20 ? 153 LEU B CB 1 ATOM 3991 C CG . LEU B 1 132 ? 2.643 -7.923 12.758 1.00 74.54 ? 153 LEU B CG 1 ATOM 3992 C CD1 . LEU B 1 132 ? 1.212 -8.341 13.042 1.00 75.50 ? 153 LEU B CD1 1 ATOM 3993 C CD2 . LEU B 1 132 ? 3.028 -8.256 11.328 1.00 71.01 ? 153 LEU B CD2 1 ATOM 3994 N N . SER B 1 133 ? 4.233 -3.615 12.530 1.00 73.04 ? 154 SER B N 1 ATOM 3995 C CA . SER B 1 133 ? 3.942 -2.192 12.617 1.00 72.01 ? 154 SER B CA 1 ATOM 3996 C C . SER B 1 133 ? 2.730 -1.884 11.741 1.00 77.92 ? 154 SER B C 1 ATOM 3997 O O . SER B 1 133 ? 2.480 -2.570 10.751 1.00 81.41 ? 154 SER B O 1 ATOM 3998 C CB . SER B 1 133 ? 5.148 -1.366 12.181 1.00 68.55 ? 154 SER B CB 1 ATOM 3999 O OG . SER B 1 133 ? 5.801 -1.971 11.081 1.00 75.69 ? 154 SER B OG 1 ATOM 4000 N N . TYR B 1 134 ? 1.978 -0.854 12.105 1.00 76.03 ? 155 TYR B N 1 ATOM 4001 C CA . TYR B 1 134 ? 0.732 -0.560 11.418 1.00 71.84 ? 155 TYR B CA 1 ATOM 4002 C C . TYR B 1 134 ? 0.682 0.859 10.884 1.00 73.60 ? 155 TYR B C 1 ATOM 4003 O O . TYR B 1 134 ? 1.206 1.785 11.496 1.00 76.31 ? 155 TYR B O 1 ATOM 4004 C CB . TYR B 1 134 ? -0.455 -0.799 12.352 1.00 74.55 ? 155 TYR B CB 1 ATOM 4005 C CG . TYR B 1 134 ? -0.463 -2.174 12.976 1.00 79.53 ? 155 TYR B CG 1 ATOM 4006 C CD1 . TYR B 1 134 ? -1.318 -3.167 12.513 1.00 83.20 ? 155 TYR B CD1 1 ATOM 4007 C CD2 . TYR B 1 134 ? 0.391 -2.482 14.023 1.00 80.94 ? 155 TYR B CD2 1 ATOM 4008 C CE1 . TYR B 1 134 ? -1.321 -4.430 13.086 1.00 84.84 ? 155 TYR B CE1 1 ATOM 4009 C CE2 . TYR B 1 134 ? 0.398 -3.736 14.598 1.00 84.79 ? 155 TYR B CE2 1 ATOM 4010 C CZ . TYR B 1 134 ? -0.457 -4.707 14.130 1.00 87.46 ? 155 TYR B CZ 1 ATOM 4011 O OH . TYR B 1 134 ? -0.440 -5.954 14.714 1.00 89.53 ? 155 TYR B OH 1 ATOM 4012 N N . ALA B 1 135 ? 0.044 1.015 9.731 1.00 75.23 ? 156 ALA B N 1 ATOM 4013 C CA . ALA B 1 135 ? -0.233 2.327 9.173 1.00 74.02 ? 156 ALA B CA 1 ATOM 4014 C C . ALA B 1 135 ? -1.588 2.273 8.490 1.00 84.48 ? 156 ALA B C 1 ATOM 4015 O O . ALA B 1 135 ? -2.047 1.205 8.082 1.00 88.32 ? 156 ALA B O 1 ATOM 4016 C CB . ALA B 1 135 ? 0.847 2.728 8.188 1.00 70.55 ? 156 ALA B CB 1 ATOM 4017 N N . TRP B 1 136 ? -2.236 3.423 8.371 1.00 86.03 ? 157 TRP B N 1 ATOM 4018 C CA . TRP B 1 136 ? -3.539 3.470 7.733 1.00 79.66 ? 157 TRP B CA 1 ATOM 4019 C C . TRP B 1 136 ? -3.549 4.384 6.519 1.00 80.30 ? 157 TRP B C 1 ATOM 4020 O O . TRP B 1 136 ? -2.807 5.364 6.451 1.00 78.14 ? 157 TRP B O 1 ATOM 4021 C CB . TRP B 1 136 ? -4.622 3.882 8.731 1.00 77.27 ? 157 TRP B CB 1 ATOM 4022 C CG . TRP B 1 136 ? -5.057 2.753 9.608 1.00 77.90 ? 157 TRP B CG 1 ATOM 4023 C CD1 . TRP B 1 136 ? -4.411 2.275 10.709 1.00 78.53 ? 157 TRP B CD1 1 ATOM 4024 C CD2 . TRP B 1 136 ? -6.232 1.947 9.451 1.00 80.18 ? 157 TRP B CD2 1 ATOM 4025 N NE1 . TRP B 1 136 ? -5.113 1.227 11.252 1.00 79.08 ? 157 TRP B NE1 1 ATOM 4026 C CE2 . TRP B 1 136 ? -6.235 1.006 10.499 1.00 77.83 ? 157 TRP B CE2 1 ATOM 4027 C CE3 . TRP B 1 136 ? -7.283 1.932 8.524 1.00 79.24 ? 157 TRP B CE3 1 ATOM 4028 C CZ2 . TRP B 1 136 ? -7.246 0.059 10.649 1.00 78.29 ? 157 TRP B CZ2 1 ATOM 4029 C CZ3 . TRP B 1 136 ? -8.288 0.992 8.675 1.00 77.01 ? 157 TRP B CZ3 1 ATOM 4030 C CH2 . TRP B 1 136 ? -8.262 0.067 9.729 1.00 81.17 ? 157 TRP B CH2 1 ATOM 4031 N N . ILE B 1 137 ? -4.391 4.037 5.555 1.00 76.01 ? 158 ILE B N 1 ATOM 4032 C CA . ILE B 1 137 ? -4.557 4.838 4.363 1.00 81.19 ? 158 ILE B CA 1 ATOM 4033 C C . ILE B 1 137 ? -5.992 5.339 4.311 1.00 80.79 ? 158 ILE B C 1 ATOM 4034 O O . ILE B 1 137 ? -6.932 4.549 4.362 1.00 79.31 ? 158 ILE B O 1 ATOM 4035 C CB . ILE B 1 137 ? -4.255 4.016 3.100 1.00 81.33 ? 158 ILE B CB 1 ATOM 4036 C CG1 . ILE B 1 137 ? -2.772 3.656 3.049 1.00 75.81 ? 158 ILE B CG1 1 ATOM 4037 C CG2 . ILE B 1 137 ? -4.666 4.778 1.854 1.00 79.36 ? 158 ILE B CG2 1 ATOM 4038 C CD1 . ILE B 1 137 ? -2.391 2.868 1.817 1.00 76.51 ? 158 ILE B CD1 1 ATOM 4039 N N . PHE B 1 138 ? -6.156 6.655 4.237 1.00 79.72 ? 159 PHE B N 1 ATOM 4040 C CA . PHE B 1 138 ? -7.477 7.246 4.112 1.00 83.18 ? 159 PHE B CA 1 ATOM 4041 C C . PHE B 1 138 ? -7.669 7.792 2.704 1.00 85.75 ? 159 PHE B C 1 ATOM 4042 O O . PHE B 1 138 ? -6.953 8.699 2.281 1.00 84.04 ? 159 PHE B O 1 ATOM 4043 C CB . PHE B 1 138 ? -7.688 8.353 5.147 1.00 84.60 ? 159 PHE B CB 1 ATOM 4044 C CG . PHE B 1 138 ? -8.976 9.112 4.960 1.00 85.20 ? 159 PHE B CG 1 ATOM 4045 C CD1 . PHE B 1 138 ? -10.195 8.461 5.041 1.00 85.13 ? 159 PHE B CD1 1 ATOM 4046 C CD2 . PHE B 1 138 ? -8.967 10.473 4.697 1.00 85.20 ? 159 PHE B CD2 1 ATOM 4047 C CE1 . PHE B 1 138 ? -11.380 9.151 4.865 1.00 85.38 ? 159 PHE B CE1 1 ATOM 4048 C CE2 . PHE B 1 138 ? -10.151 11.170 4.522 1.00 84.84 ? 159 PHE B CE2 1 ATOM 4049 C CZ . PHE B 1 138 ? -11.357 10.508 4.606 1.00 84.69 ? 159 PHE B CZ 1 ATOM 4050 N N . ASN B 1 139 ? -8.635 7.229 1.984 1.00 89.57 ? 160 ASN B N 1 ATOM 4051 C CA . ASN B 1 139 ? -8.912 7.633 0.609 1.00 90.57 ? 160 ASN B CA 1 ATOM 4052 C C . ASN B 1 139 ? -7.666 7.638 -0.273 1.00 94.31 ? 160 ASN B C 1 ATOM 4053 O O . ASN B 1 139 ? -7.367 8.637 -0.930 1.00 92.90 ? 160 ASN B O 1 ATOM 4054 C CB . ASN B 1 139 ? -9.596 9.003 0.574 1.00 86.97 ? 160 ASN B CB 1 ATOM 4055 C CG . ASN B 1 139 ? -11.039 8.945 1.040 1.00 87.52 ? 160 ASN B CG 1 ATOM 4056 O OD1 . ASN B 1 139 ? -11.695 7.908 0.940 1.00 87.33 ? 160 ASN B OD1 1 ATOM 4057 N ND2 . ASN B 1 139 ? -11.543 10.064 1.550 1.00 86.62 ? 160 ASN B ND2 1 ATOM 4058 N N . GLU B 1 140 ? -6.943 6.520 -0.269 1.00 96.17 ? 161 GLU B N 1 ATOM 4059 C CA . GLU B 1 140 ? -5.810 6.315 -1.172 1.00 103.97 ? 161 GLU B CA 1 ATOM 4060 C C . GLU B 1 140 ? -4.586 7.158 -0.821 1.00 107.39 ? 161 GLU B C 1 ATOM 4061 O O . GLU B 1 140 ? -3.620 7.208 -1.579 1.00 111.42 ? 161 GLU B O 1 ATOM 4062 C CB . GLU B 1 140 ? -6.233 6.589 -2.615 1.00 114.09 ? 161 GLU B CB 1 ATOM 4063 C CG . GLU B 1 140 ? -7.482 5.841 -3.046 1.00 122.64 ? 161 GLU B CG 1 ATOM 4064 C CD . GLU B 1 140 ? -7.197 4.411 -3.456 1.00 129.39 ? 161 GLU B CD 1 ATOM 4065 O OE1 . GLU B 1 140 ? -6.286 3.788 -2.871 1.00 129.06 ? 161 GLU B OE1 1 ATOM 4066 O OE2 . GLU B 1 140 ? -7.889 3.908 -4.367 1.00 135.27 ? 161 GLU B OE2 1 ATOM 4067 N N . TYR B 1 141 ? -4.626 7.804 0.336 1.00 106.05 ? 162 TYR B N 1 ATOM 4068 C CA . TYR B 1 141 ? -3.580 8.733 0.734 1.00 99.04 ? 162 TYR B CA 1 ATOM 4069 C C . TYR B 1 141 ? -3.274 8.479 2.201 1.00 97.18 ? 162 TYR B C 1 ATOM 4070 O O . TYR B 1 141 ? -4.183 8.197 2.979 1.00 101.71 ? 162 TYR B O 1 ATOM 4071 C CB . TYR B 1 141 ? -4.085 10.163 0.532 1.00 102.05 ? 162 TYR B CB 1 ATOM 4072 C CG . TYR B 1 141 ? -3.013 11.213 0.373 1.00 105.41 ? 162 TYR B CG 1 ATOM 4073 C CD1 . TYR B 1 141 ? -2.243 11.279 -0.783 1.00 105.00 ? 162 TYR B CD1 1 ATOM 4074 C CD2 . TYR B 1 141 ? -2.789 12.160 1.368 1.00 108.36 ? 162 TYR B CD2 1 ATOM 4075 C CE1 . TYR B 1 141 ? -1.267 12.248 -0.934 1.00 106.45 ? 162 TYR B CE1 1 ATOM 4076 C CE2 . TYR B 1 141 ? -1.814 13.133 1.223 1.00 108.73 ? 162 TYR B CE2 1 ATOM 4077 C CZ . TYR B 1 141 ? -1.055 13.171 0.071 1.00 107.33 ? 162 TYR B CZ 1 ATOM 4078 O OH . TYR B 1 141 ? 0.000 14.054 0.000 0.50 104.40 ? 162 TYR B OH 1 ATOM 4079 N N . PRO B 1 142 ? -1.992 8.572 2.588 1.00 95.09 ? 163 PRO B N 1 ATOM 4080 C CA . PRO B 1 142 ? -1.591 8.255 3.964 1.00 92.95 ? 163 PRO B CA 1 ATOM 4081 C C . PRO B 1 142 ? -2.482 8.935 4.994 1.00 96.74 ? 163 PRO B C 1 ATOM 4082 O O . PRO B 1 142 ? -2.657 10.154 4.949 1.00 95.53 ? 163 PRO B O 1 ATOM 4083 C CB . PRO B 1 142 ? -0.168 8.812 4.046 1.00 86.11 ? 163 PRO B CB 1 ATOM 4084 C CG . PRO B 1 142 ? 0.341 8.707 2.647 1.00 88.23 ? 163 PRO B CG 1 ATOM 4085 C CD . PRO B 1 142 ? -0.847 8.988 1.760 1.00 93.34 ? 163 PRO B CD 1 ATOM 4086 N N . SER B 1 143 ? -3.041 8.146 5.907 1.00 98.48 ? 164 SER B N 1 ATOM 4087 C CA . SER B 1 143 ? -3.896 8.671 6.964 1.00 100.25 ? 164 SER B CA 1 ATOM 4088 C C . SER B 1 143 ? -3.118 9.614 7.873 1.00 101.16 ? 164 SER B C 1 ATOM 4089 O O . SER B 1 143 ? -2.019 9.291 8.318 1.00 98.52 ? 164 SER B O 1 ATOM 4090 C CB . SER B 1 143 ? -4.488 7.527 7.790 1.00 101.10 ? 164 SER B CB 1 ATOM 4091 O OG . SER B 1 143 ? -5.333 8.022 8.814 1.00 103.82 ? 164 SER B OG 1 ATOM 4092 N N . TYR B 1 144 ? -3.694 10.778 8.147 1.00 107.03 ? 165 TYR B N 1 ATOM 4093 C CA . TYR B 1 144 ? -3.043 11.760 9.000 1.00 111.85 ? 165 TYR B CA 1 ATOM 4094 C C . TYR B 1 144 ? -3.263 11.423 10.471 1.00 109.87 ? 165 TYR B C 1 ATOM 4095 O O . TYR B 1 144 ? -4.385 11.129 10.884 1.00 108.49 ? 165 TYR B O 1 ATOM 4096 C CB . TYR B 1 144 ? -3.575 13.165 8.712 1.00 121.51 ? 165 TYR B CB 1 ATOM 4097 C CG . TYR B 1 144 ? -2.614 14.267 9.098 1.00 132.13 ? 165 TYR B CG 1 ATOM 4098 C CD1 . TYR B 1 144 ? -1.531 14.008 9.931 1.00 136.65 ? 165 TYR B CD1 1 ATOM 4099 C CD2 . TYR B 1 144 ? -2.794 15.566 8.645 1.00 136.29 ? 165 TYR B CD2 1 ATOM 4100 C CE1 . TYR B 1 144 ? -0.649 15.006 10.290 1.00 138.48 ? 165 TYR B CE1 1 ATOM 4101 C CE2 . TYR B 1 144 ? -1.915 16.575 9.003 1.00 139.33 ? 165 TYR B CE2 1 ATOM 4102 C CZ . TYR B 1 144 ? -0.845 16.287 9.826 1.00 140.10 ? 165 TYR B CZ 1 ATOM 4103 O OH . TYR B 1 144 ? 0.035 17.281 10.187 1.00 141.51 ? 165 TYR B OH 1 ATOM 4104 N N . GLN B 1 145 ? -2.188 11.469 11.254 1.00 107.63 ? 166 GLN B N 1 ATOM 4105 C CA . GLN B 1 145 ? -2.274 11.267 12.697 1.00 105.95 ? 166 GLN B CA 1 ATOM 4106 C C . GLN B 1 145 ? -2.085 12.587 13.442 1.00 103.94 ? 166 GLN B C 1 ATOM 4107 O O . GLN B 1 145 ? -1.166 13.350 13.145 1.00 101.57 ? 166 GLN B O 1 ATOM 4108 C CB . GLN B 1 145 ? -1.221 10.265 13.165 1.00 106.59 ? 166 GLN B CB 1 ATOM 4109 C CG . GLN B 1 145 ? -1.211 8.955 12.405 1.00 108.09 ? 166 GLN B CG 1 ATOM 4110 C CD . GLN B 1 145 ? -0.071 8.058 12.840 1.00 112.77 ? 166 GLN B CD 1 ATOM 4111 O OE1 . GLN B 1 145 ? 0.765 7.657 12.028 1.00 111.80 ? 166 GLN B OE1 1 ATOM 4112 N NE2 . GLN B 1 145 ? -0.020 7.752 14.133 1.00 114.74 ? 166 GLN B NE2 1 ATOM 4113 N N . ASP B 1 146 ? -2.961 12.850 14.407 1.00 103.44 ? 167 ASP B N 1 ATOM 4114 C CA . ASP B 1 146 ? -2.872 14.051 15.232 1.00 105.39 ? 167 ASP B CA 1 ATOM 4115 C C . ASP B 1 146 ? -3.518 13.811 16.591 1.00 106.44 ? 167 ASP B C 1 ATOM 4116 O O . ASP B 1 146 ? -3.709 12.666 16.995 1.00 108.75 ? 167 ASP B O 1 ATOM 4117 C CB . ASP B 1 146 ? -3.509 15.258 14.532 1.00 110.25 ? 167 ASP B CB 1 ATOM 4118 C CG . ASP B 1 146 ? -4.878 14.948 13.947 1.00 114.50 ? 167 ASP B CG 1 ATOM 4119 O OD1 . ASP B 1 146 ? -5.546 14.011 14.433 1.00 117.24 ? 167 ASP B OD1 1 ATOM 4120 O OD2 . ASP B 1 146 ? -5.288 15.649 12.998 1.00 113.97 ? 167 ASP B OD2 1 ATOM 4121 N N . ASN B 1 147 ? -3.852 14.888 17.294 1.00 107.26 ? 168 ASN B N 1 ATOM 4122 C CA . ASN B 1 147 ? -4.433 14.768 18.628 1.00 110.90 ? 168 ASN B CA 1 ATOM 4123 C C . ASN B 1 147 ? -5.821 14.134 18.607 1.00 108.48 ? 168 ASN B C 1 ATOM 4124 O O . ASN B 1 147 ? -6.325 13.685 19.638 1.00 107.99 ? 168 ASN B O 1 ATOM 4125 C CB . ASN B 1 147 ? -4.482 16.130 19.327 1.00 118.09 ? 168 ASN B CB 1 ATOM 4126 C CG . ASN B 1 147 ? -5.518 17.061 18.723 1.00 126.64 ? 168 ASN B CG 1 ATOM 4127 O OD1 . ASN B 1 147 ? -6.128 17.867 19.427 1.00 130.03 ? 168 ASN B OD1 1 ATOM 4128 N ND2 . ASN B 1 147 ? -5.727 16.952 17.415 1.00 126.87 ? 168 ASN B ND2 1 ATOM 4129 N N . ARG B 1 148 ? -6.427 14.096 17.424 1.00 104.18 ? 169 ARG B N 1 ATOM 4130 C CA . ARG B 1 148 ? -7.774 13.562 17.261 1.00 97.21 ? 169 ARG B CA 1 ATOM 4131 C C . ARG B 1 148 ? -7.764 12.168 16.634 1.00 92.04 ? 169 ARG B C 1 ATOM 4132 O O . ARG B 1 148 ? -8.667 11.370 16.878 1.00 87.78 ? 169 ARG B O 1 ATOM 4133 C CB . ARG B 1 148 ? -8.618 14.519 16.417 1.00 99.16 ? 169 ARG B CB 1 ATOM 4134 C CG . ARG B 1 148 ? -10.097 14.186 16.375 1.00 98.78 ? 169 ARG B CG 1 ATOM 4135 C CD . ARG B 1 148 ? -10.870 15.228 15.579 1.00 98.64 ? 169 ARG B CD 1 ATOM 4136 N NE . ARG B 1 148 ? -10.467 15.265 14.175 1.00 96.84 ? 169 ARG B NE 1 ATOM 4137 C CZ . ARG B 1 148 ? -10.978 14.480 13.231 1.00 94.35 ? 169 ARG B CZ 1 ATOM 4138 N NH1 . ARG B 1 148 ? -11.910 13.591 13.540 1.00 94.03 ? 169 ARG B NH1 1 ATOM 4139 N NH2 . ARG B 1 148 ? -10.557 14.579 11.977 1.00 91.38 ? 169 ARG B NH2 1 ATOM 4140 N N . ARG B 1 149 ? -6.742 11.882 15.828 1.00 92.97 ? 170 ARG B N 1 ATOM 4141 C CA . ARG B 1 149 ? -6.605 10.573 15.187 1.00 93.57 ? 170 ARG B CA 1 ATOM 4142 C C . ARG B 1 149 ? -5.318 9.861 15.600 1.00 92.25 ? 170 ARG B C 1 ATOM 4143 O O . ARG B 1 149 ? -4.230 10.436 15.557 1.00 93.30 ? 170 ARG B O 1 ATOM 4144 C CB . ARG B 1 149 ? -6.681 10.685 13.662 1.00 95.74 ? 170 ARG B CB 1 ATOM 4145 C CG . ARG B 1 149 ? -8.040 11.127 13.141 1.00 104.82 ? 170 ARG B CG 1 ATOM 4146 C CD . ARG B 1 149 ? -8.003 12.553 12.628 1.00 111.49 ? 170 ARG B CD 1 ATOM 4147 N NE . ARG B 1 149 ? -7.328 12.629 11.338 1.00 117.24 ? 170 ARG B NE 1 ATOM 4148 C CZ . ARG B 1 149 ? -7.131 13.754 10.661 1.00 124.80 ? 170 ARG B CZ 1 ATOM 4149 N NH1 . ARG B 1 149 ? -7.556 14.910 11.152 1.00 126.22 ? 170 ARG B NH1 1 ATOM 4150 N NH2 . ARG B 1 149 ? -6.506 13.723 9.492 1.00 128.39 ? 170 ARG B NH2 1 ATOM 4151 N N . PHE B 1 150 ? -5.453 8.595 15.976 1.00 88.82 ? 171 PHE B N 1 ATOM 4152 C CA . PHE B 1 150 ? -4.363 7.861 16.603 1.00 84.14 ? 171 PHE B CA 1 ATOM 4153 C C . PHE B 1 150 ? -4.335 6.412 16.127 1.00 82.73 ? 171 PHE B C 1 ATOM 4154 O O . PHE B 1 150 ? -5.379 5.774 16.004 1.00 80.12 ? 171 PHE B O 1 ATOM 4155 C CB . PHE B 1 150 ? -4.525 7.934 18.124 1.00 83.84 ? 171 PHE B CB 1 ATOM 4156 C CG . PHE B 1 150 ? -3.549 7.093 18.890 1.00 88.54 ? 171 PHE B CG 1 ATOM 4157 C CD1 . PHE B 1 150 ? -2.231 7.497 19.041 1.00 89.30 ? 171 PHE B CD1 1 ATOM 4158 C CD2 . PHE B 1 150 ? -3.954 5.909 19.486 1.00 90.03 ? 171 PHE B CD2 1 ATOM 4159 C CE1 . PHE B 1 150 ? -1.332 6.727 19.758 1.00 82.86 ? 171 PHE B CE1 1 ATOM 4160 C CE2 . PHE B 1 150 ? -3.059 5.134 20.204 1.00 87.09 ? 171 PHE B CE2 1 ATOM 4161 C CZ . PHE B 1 150 ? -1.748 5.545 20.340 1.00 82.06 ? 171 PHE B CZ 1 ATOM 4162 N N . VAL B 1 151 ? -3.136 5.905 15.852 1.00 83.51 ? 172 VAL B N 1 ATOM 4163 C CA . VAL B 1 151 ? -2.954 4.524 15.412 1.00 79.25 ? 172 VAL B CA 1 ATOM 4164 C C . VAL B 1 151 ? -2.103 3.734 16.400 1.00 82.95 ? 172 VAL B C 1 ATOM 4165 O O . VAL B 1 151 ? -0.942 4.066 16.641 1.00 81.48 ? 172 VAL B O 1 ATOM 4166 C CB . VAL B 1 151 ? -2.289 4.457 14.025 1.00 68.85 ? 172 VAL B CB 1 ATOM 4167 C CG1 . VAL B 1 151 ? -1.803 3.039 13.725 1.00 65.86 ? 172 VAL B CG1 1 ATOM 4168 C CG2 . VAL B 1 151 ? -3.249 4.930 12.967 1.00 57.49 ? 172 VAL B CG2 1 ATOM 4169 N N . SER B 1 152 ? -2.687 2.685 16.967 1.00 85.42 ? 173 SER B N 1 ATOM 4170 C CA . SER B 1 152 ? -1.989 1.863 17.946 1.00 83.65 ? 173 SER B CA 1 ATOM 4171 C C . SER B 1 152 ? -1.006 0.917 17.264 1.00 81.26 ? 173 SER B C 1 ATOM 4172 O O . SER B 1 152 ? -1.376 0.187 16.346 1.00 81.97 ? 173 SER B O 1 ATOM 4173 C CB . SER B 1 152 ? -2.990 1.066 18.784 1.00 84.84 ? 173 SER B CB 1 ATOM 4174 O OG . SER B 1 152 ? -2.329 0.306 19.782 1.00 87.48 ? 173 SER B OG 1 ATOM 4175 N N . GLN B 1 153 ? 0.246 0.935 17.714 1.00 79.68 ? 174 GLN B N 1 ATOM 4176 C CA . GLN B 1 153 ? 1.266 0.041 17.175 1.00 77.20 ? 174 GLN B CA 1 ATOM 4177 C C . GLN B 1 153 ? 1.219 -1.317 17.866 1.00 81.05 ? 174 GLN B C 1 ATOM 4178 O O . GLN B 1 153 ? 1.984 -2.221 17.532 1.00 82.45 ? 174 GLN B O 1 ATOM 4179 C CB . GLN B 1 153 ? 2.662 0.660 17.297 1.00 72.00 ? 174 GLN B CB 1 ATOM 4180 C CG . GLN B 1 153 ? 2.909 1.826 16.353 1.00 72.06 ? 174 GLN B CG 1 ATOM 4181 C CD . GLN B 1 153 ? 2.588 1.475 14.916 1.00 77.44 ? 174 GLN B CD 1 ATOM 4182 O OE1 . GLN B 1 153 ? 2.932 0.394 14.441 1.00 83.49 ? 174 GLN B OE1 1 ATOM 4183 N NE2 . GLN B 1 153 ? 1.919 2.387 14.214 1.00 71.05 ? 174 GLN B NE2 1 ATOM 4184 N N . GLU B 1 154 ? 0.314 -1.455 18.831 1.00 85.16 ? 175 GLU B N 1 ATOM 4185 C CA . GLU B 1 154 ? 0.131 -2.725 19.525 1.00 91.59 ? 175 GLU B CA 1 ATOM 4186 C C . GLU B 1 154 ? -1.105 -3.491 19.048 1.00 94.78 ? 175 GLU B C 1 ATOM 4187 O O . GLU B 1 154 ? -1.087 -4.719 18.981 1.00 96.38 ? 175 GLU B O 1 ATOM 4188 C CB . GLU B 1 154 ? 0.099 -2.523 21.045 1.00 96.23 ? 175 GLU B CB 1 ATOM 4189 C CG . GLU B 1 154 ? 1.303 -3.113 21.789 1.00 101.64 ? 175 GLU B CG 1 ATOM 4190 C CD . GLU B 1 154 ? 2.620 -2.388 21.512 1.00 104.54 ? 175 GLU B CD 1 ATOM 4191 O OE1 . GLU B 1 154 ? 2.783 -1.236 21.975 1.00 108.84 ? 175 GLU B OE1 1 ATOM 4192 O OE2 . GLU B 1 154 ? 3.505 -2.982 20.855 1.00 98.40 ? 175 GLU B OE2 1 ATOM 4193 N N . THR B 1 155 ? -2.171 -2.773 18.711 1.00 95.85 ? 176 THR B N 1 ATOM 4194 C CA . THR B 1 155 ? -3.394 -3.420 18.235 1.00 97.13 ? 176 THR B CA 1 ATOM 4195 C C . THR B 1 155 ? -3.635 -3.203 16.743 1.00 95.65 ? 176 THR B C 1 ATOM 4196 O O . THR B 1 155 ? -4.290 -4.018 16.093 1.00 99.54 ? 176 THR B O 1 ATOM 4197 C CB . THR B 1 155 ? -4.643 -2.948 19.010 1.00 96.99 ? 176 THR B CB 1 ATOM 4198 O OG1 . THR B 1 155 ? -5.020 -1.638 18.571 1.00 93.51 ? 176 THR B OG1 1 ATOM 4199 C CG2 . THR B 1 155 ? -4.368 -2.927 20.506 1.00 101.82 ? 176 THR B CG2 1 ATOM 4200 N N . GLY B 1 156 ? -3.114 -2.101 16.209 1.00 89.92 ? 177 GLY B N 1 ATOM 4201 C CA . GLY B 1 156 ? -3.272 -1.779 14.800 1.00 83.68 ? 177 GLY B CA 1 ATOM 4202 C C . GLY B 1 156 ? -4.543 -1.011 14.481 1.00 79.90 ? 177 GLY B C 1 ATOM 4203 O O . GLY B 1 156 ? -4.713 -0.501 13.375 1.00 81.37 ? 177 GLY B O 1 ATOM 4204 N N . ASN B 1 157 ? -5.446 -0.931 15.449 1.00 75.33 ? 178 ASN B N 1 ATOM 4205 C CA . ASN B 1 157 ? -6.681 -0.185 15.267 1.00 75.90 ? 178 ASN B CA 1 ATOM 4206 C C . ASN B 1 157 ? -6.423 1.293 15.028 1.00 76.10 ? 178 ASN B C 1 ATOM 4207 O O . ASN B 1 157 ? -5.383 1.823 15.418 1.00 73.94 ? 178 ASN B O 1 ATOM 4208 C CB . ASN B 1 157 ? -7.593 -0.357 16.480 1.00 78.41 ? 178 ASN B CB 1 ATOM 4209 C CG . ASN B 1 157 ? -7.858 -1.810 16.804 1.00 83.00 ? 178 ASN B CG 1 ATOM 4210 O OD1 . ASN B 1 157 ? -7.651 -2.690 15.965 1.00 82.25 ? 178 ASN B OD1 1 ATOM 4211 N ND2 . ASN B 1 157 ? -8.318 -2.072 18.026 1.00 82.16 ? 178 ASN B ND2 1 ATOM 4212 N N . LEU B 1 158 ? -7.375 1.950 14.376 1.00 79.40 ? 179 LEU B N 1 ATOM 4213 C CA . LEU B 1 158 ? -7.313 3.389 14.174 1.00 81.20 ? 179 LEU B CA 1 ATOM 4214 C C . LEU B 1 158 ? -8.409 4.061 14.990 1.00 85.93 ? 179 LEU B C 1 ATOM 4215 O O . LEU B 1 158 ? -9.594 3.856 14.741 1.00 92.53 ? 179 LEU B O 1 ATOM 4216 C CB . LEU B 1 158 ? -7.463 3.738 12.692 1.00 79.31 ? 179 LEU B CB 1 ATOM 4217 C CG . LEU B 1 158 ? -7.736 5.216 12.400 1.00 80.81 ? 179 LEU B CG 1 ATOM 4218 C CD1 . LEU B 1 158 ? -6.762 6.112 13.152 1.00 81.07 ? 179 LEU B CD1 1 ATOM 4219 C CD2 . LEU B 1 158 ? -7.673 5.492 10.910 1.00 83.10 ? 179 LEU B CD2 1 ATOM 4220 N N . TYR B 1 159 ? -8.001 4.866 15.964 1.00 85.74 ? 180 TYR B N 1 ATOM 4221 C CA . TYR B 1 159 ? -8.938 5.513 16.872 1.00 89.37 ? 180 TYR B CA 1 ATOM 4222 C C . TYR B 1 159 ? -9.181 6.973 16.489 1.00 92.34 ? 180 TYR B C 1 ATOM 4223 O O . TYR B 1 159 ? -8.268 7.797 16.540 1.00 95.59 ? 180 TYR B O 1 ATOM 4224 C CB . TYR B 1 159 ? -8.419 5.442 18.314 1.00 88.86 ? 180 TYR B CB 1 ATOM 4225 C CG . TYR B 1 159 ? -8.014 4.055 18.773 1.00 86.57 ? 180 TYR B CG 1 ATOM 4226 C CD1 . TYR B 1 159 ? -6.834 3.470 18.327 1.00 90.42 ? 180 TYR B CD1 1 ATOM 4227 C CD2 . TYR B 1 159 ? -8.804 3.336 19.662 1.00 82.73 ? 180 TYR B CD2 1 ATOM 4228 C CE1 . TYR B 1 159 ? -6.458 2.203 18.746 1.00 92.48 ? 180 TYR B CE1 1 ATOM 4229 C CE2 . TYR B 1 159 ? -8.439 2.069 20.085 1.00 83.70 ? 180 TYR B CE2 1 ATOM 4230 C CZ . TYR B 1 159 ? -7.264 1.507 19.627 1.00 89.16 ? 180 TYR B CZ 1 ATOM 4231 O OH . TYR B 1 159 ? -6.890 0.249 20.050 1.00 83.60 ? 180 TYR B OH 1 ATOM 4232 N N . ILE B 1 160 ? -10.415 7.286 16.099 1.00 87.57 ? 181 ILE B N 1 ATOM 4233 C CA . ILE B 1 160 ? -10.816 8.669 15.884 1.00 86.80 ? 181 ILE B CA 1 ATOM 4234 C C . ILE B 1 160 ? -11.566 9.162 17.122 1.00 89.99 ? 181 ILE B C 1 ATOM 4235 O O . ILE B 1 160 ? -12.585 8.591 17.506 1.00 90.93 ? 181 ILE B O 1 ATOM 4236 C CB . ILE B 1 160 ? -11.703 8.813 14.630 1.00 90.29 ? 181 ILE B CB 1 ATOM 4237 C CG1 . ILE B 1 160 ? -11.022 8.178 13.417 1.00 85.88 ? 181 ILE B CG1 1 ATOM 4238 C CG2 . ILE B 1 160 ? -12.015 10.277 14.350 1.00 89.43 ? 181 ILE B CG2 1 ATOM 4239 C CD1 . ILE B 1 160 ? -11.827 8.308 12.147 1.00 87.55 ? 181 ILE B CD1 1 ATOM 4240 N N . ALA B 1 161 ? -11.054 10.216 17.750 1.00 94.57 ? 182 ALA B N 1 ATOM 4241 C CA . ALA B 1 161 ? -11.597 10.697 19.020 1.00 99.61 ? 182 ALA B CA 1 ATOM 4242 C C . ALA B 1 161 ? -12.956 11.372 18.869 1.00 104.47 ? 182 ALA B C 1 ATOM 4243 O O . ALA B 1 161 ? -13.842 11.201 19.708 1.00 108.00 ? 182 ALA B O 1 ATOM 4244 C CB . ALA B 1 161 ? -10.612 11.645 19.691 1.00 100.64 ? 182 ALA B CB 1 ATOM 4245 N N . LYS B 1 162 ? -13.108 12.142 17.797 1.00 105.40 ? 183 LYS B N 1 ATOM 4246 C CA . LYS B 1 162 ? -14.315 12.923 17.565 1.00 106.20 ? 183 LYS B CA 1 ATOM 4247 C C . LYS B 1 162 ? -14.478 13.150 16.071 1.00 106.93 ? 183 LYS B C 1 ATOM 4248 O O . LYS B 1 162 ? -13.715 13.899 15.466 1.00 108.09 ? 183 LYS B O 1 ATOM 4249 C CB . LYS B 1 162 ? -14.209 14.264 18.285 1.00 107.85 ? 183 LYS B CB 1 ATOM 4250 C CG . LYS B 1 162 ? -15.503 15.042 18.369 1.00 111.85 ? 183 LYS B CG 1 ATOM 4251 C CD . LYS B 1 162 ? -15.243 16.450 18.879 1.00 115.43 ? 183 LYS B CD 1 ATOM 4252 C CE . LYS B 1 162 ? -14.734 17.357 17.772 1.00 114.51 ? 183 LYS B CE 1 ATOM 4253 N NZ . LYS B 1 162 ? -15.809 17.661 16.787 1.00 113.52 ? 183 LYS B NZ 1 ATOM 4254 N N . VAL B 1 163 ? -15.479 12.505 15.482 1.00 108.08 ? 184 VAL B N 1 ATOM 4255 C CA . VAL B 1 163 ? -15.650 12.495 14.030 1.00 105.39 ? 184 VAL B CA 1 ATOM 4256 C C . VAL B 1 163 ? -16.066 13.838 13.427 1.00 111.60 ? 184 VAL B C 1 ATOM 4257 O O . VAL B 1 163 ? -17.026 14.464 13.875 1.00 111.74 ? 184 VAL B O 1 ATOM 4258 C CB . VAL B 1 163 ? -16.668 11.418 13.602 1.00 98.32 ? 184 VAL B CB 1 ATOM 4259 C CG1 . VAL B 1 163 ? -17.112 11.644 12.165 1.00 98.36 ? 184 VAL B CG1 1 ATOM 4260 C CG2 . VAL B 1 163 ? -16.070 10.033 13.775 1.00 88.85 ? 184 VAL B CG2 1 ATOM 4261 N N . GLU B 1 164 ? -15.327 14.267 12.407 1.00 117.74 ? 185 GLU B N 1 ATOM 4262 C CA . GLU B 1 164 ? -15.699 15.425 11.603 1.00 123.42 ? 185 GLU B CA 1 ATOM 4263 C C . GLU B 1 164 ? -16.342 14.909 10.323 1.00 120.92 ? 185 GLU B C 1 ATOM 4264 O O . GLU B 1 164 ? -16.316 13.707 10.061 1.00 116.49 ? 185 GLU B O 1 ATOM 4265 C CB . GLU B 1 164 ? -14.465 16.259 11.251 1.00 129.42 ? 185 GLU B CB 1 ATOM 4266 C CG . GLU B 1 164 ? -13.449 16.415 12.375 1.00 133.63 ? 185 GLU B CG 1 ATOM 4267 C CD . GLU B 1 164 ? -13.857 17.447 13.409 1.00 139.77 ? 185 GLU B CD 1 ATOM 4268 O OE1 . GLU B 1 164 ? -15.018 17.410 13.867 1.00 144.93 ? 185 GLU B OE1 1 ATOM 4269 O OE2 . GLU B 1 164 ? -13.009 18.291 13.771 1.00 139.89 ? 185 GLU B OE2 1 ATOM 4270 N N . LYS B 1 165 ? -16.908 15.806 9.520 1.00 124.54 ? 186 LYS B N 1 ATOM 4271 C CA . LYS B 1 165 ? -17.524 15.394 8.258 1.00 126.70 ? 186 LYS B CA 1 ATOM 4272 C C . LYS B 1 165 ? -16.479 15.069 7.190 1.00 128.17 ? 186 LYS B C 1 ATOM 4273 O O . LYS B 1 165 ? -16.779 14.407 6.197 1.00 126.18 ? 186 LYS B O 1 ATOM 4274 C CB . LYS B 1 165 ? -18.497 16.456 7.738 1.00 127.41 ? 186 LYS B CB 1 ATOM 4275 C CG . LYS B 1 165 ? -19.188 16.051 6.440 1.00 130.04 ? 186 LYS B CG 1 ATOM 4276 C CD . LYS B 1 165 ? -20.303 17.008 6.048 1.00 133.82 ? 186 LYS B CD 1 ATOM 4277 C CE . LYS B 1 165 ? -20.995 16.544 4.768 1.00 134.43 ? 186 LYS B CE 1 ATOM 4278 N NZ . LYS B 1 165 ? -22.109 17.447 4.355 1.00 135.46 ? 186 LYS B NZ 1 ATOM 4279 N N . SER B 1 166 ? -15.251 15.533 7.400 1.00 129.36 ? 187 SER B N 1 ATOM 4280 C CA . SER B 1 166 ? -14.173 15.310 6.442 1.00 129.10 ? 187 SER B CA 1 ATOM 4281 C C . SER B 1 166 ? -13.682 13.866 6.468 1.00 124.00 ? 187 SER B C 1 ATOM 4282 O O . SER B 1 166 ? -12.934 13.439 5.587 1.00 123.28 ? 187 SER B O 1 ATOM 4283 C CB . SER B 1 166 ? -13.003 16.248 6.740 1.00 132.57 ? 187 SER B CB 1 ATOM 4284 O OG . SER B 1 166 ? -12.374 15.899 7.963 1.00 134.03 ? 187 SER B OG 1 ATOM 4285 N N . ASP B 1 167 ? -14.112 13.118 7.478 1.00 117.90 ? 188 ASP B N 1 ATOM 4286 C CA . ASP B 1 167 ? -13.578 11.783 7.732 1.00 106.89 ? 188 ASP B CA 1 ATOM 4287 C C . ASP B 1 167 ? -14.245 10.673 6.921 1.00 100.27 ? 188 ASP B C 1 ATOM 4288 O O . ASP B 1 167 ? -13.685 9.585 6.789 1.00 99.72 ? 188 ASP B O 1 ATOM 4289 C CB . ASP B 1 167 ? -13.649 11.465 9.226 1.00 106.62 ? 188 ASP B CB 1 ATOM 4290 C CG . ASP B 1 167 ? -12.891 12.474 10.071 1.00 108.23 ? 188 ASP B CG 1 ATOM 4291 O OD1 . ASP B 1 167 ? -12.098 13.256 9.501 1.00 108.61 ? 188 ASP B OD1 1 ATOM 4292 O OD2 . ASP B 1 167 ? -13.089 12.486 11.303 1.00 107.24 ? 188 ASP B OD2 1 ATOM 4293 N N . VAL B 1 168 ? -15.434 10.936 6.385 1.00 94.73 ? 189 VAL B N 1 ATOM 4294 C CA . VAL B 1 168 ? -16.103 9.948 5.542 1.00 93.85 ? 189 VAL B CA 1 ATOM 4295 C C . VAL B 1 168 ? -15.248 9.596 4.320 1.00 93.91 ? 189 VAL B C 1 ATOM 4296 O O . VAL B 1 168 ? -14.748 10.477 3.614 1.00 94.40 ? 189 VAL B O 1 ATOM 4297 C CB . VAL B 1 168 ? -17.537 10.392 5.119 1.00 92.89 ? 189 VAL B CB 1 ATOM 4298 C CG1 . VAL B 1 168 ? -17.639 11.902 5.046 1.00 95.67 ? 189 VAL B CG1 1 ATOM 4299 C CG2 . VAL B 1 168 ? -17.938 9.753 3.792 1.00 88.59 ? 189 VAL B CG2 1 ATOM 4300 N N . GLY B 1 169 ? -15.074 8.298 4.092 1.00 89.12 ? 190 GLY B N 1 ATOM 4301 C CA . GLY B 1 169 ? -14.241 7.813 3.011 1.00 84.98 ? 190 GLY B CA 1 ATOM 4302 C C . GLY B 1 169 ? -13.949 6.331 3.138 1.00 86.47 ? 190 GLY B C 1 ATOM 4303 O O . GLY B 1 169 ? -14.723 5.580 3.734 1.00 85.64 ? 190 GLY B O 1 ATOM 4304 N N . ASN B 1 170 ? -12.825 5.908 2.570 1.00 88.07 ? 191 ASN B N 1 ATOM 4305 C CA . ASN B 1 170 ? -12.419 4.512 2.614 1.00 91.21 ? 191 ASN B CA 1 ATOM 4306 C C . ASN B 1 170 ? -11.150 4.305 3.444 1.00 96.79 ? 191 ASN B C 1 ATOM 4307 O O . ASN B 1 170 ? -10.081 4.834 3.121 1.00 94.44 ? 191 ASN B O 1 ATOM 4308 C CB . ASN B 1 170 ? -12.217 3.975 1.196 1.00 94.63 ? 191 ASN B CB 1 ATOM 4309 C CG . ASN B 1 170 ? -13.510 3.879 0.420 1.00 104.23 ? 191 ASN B CG 1 ATOM 4310 O OD1 . ASN B 1 170 ? -14.320 2.981 0.650 1.00 96.69 ? 191 ASN B OD1 1 ATOM 4311 N ND2 . ASN B 1 170 ? -13.707 4.802 -0.516 1.00 125.59 ? 191 ASN B ND2 1 ATOM 4312 N N . TYR B 1 171 ? -11.275 3.524 4.511 1.00 96.49 ? 192 TYR B N 1 ATOM 4313 C CA . TYR B 1 171 ? -10.152 3.252 5.396 1.00 91.93 ? 192 TYR B CA 1 ATOM 4314 C C . TYR B 1 171 ? -9.603 1.843 5.219 1.00 90.76 ? 192 TYR B C 1 ATOM 4315 O O . TYR B 1 171 ? -10.320 0.854 5.386 1.00 90.33 ? 192 TYR B O 1 ATOM 4316 C CB . TYR B 1 171 ? -10.560 3.457 6.851 1.00 90.23 ? 192 TYR B CB 1 ATOM 4317 C CG . TYR B 1 171 ? -10.769 4.901 7.233 1.00 90.61 ? 192 TYR B CG 1 ATOM 4318 C CD1 . TYR B 1 171 ? -9.711 5.676 7.689 1.00 95.17 ? 192 TYR B CD1 1 ATOM 4319 C CD2 . TYR B 1 171 ? -12.022 5.487 7.146 1.00 86.40 ? 192 TYR B CD2 1 ATOM 4320 C CE1 . TYR B 1 171 ? -9.898 6.998 8.043 1.00 97.59 ? 192 TYR B CE1 1 ATOM 4321 C CE2 . TYR B 1 171 ? -12.218 6.807 7.496 1.00 89.47 ? 192 TYR B CE2 1 ATOM 4322 C CZ . TYR B 1 171 ? -11.155 7.559 7.944 1.00 94.82 ? 192 TYR B CZ 1 ATOM 4323 O OH . TYR B 1 171 ? -11.347 8.875 8.295 1.00 96.90 ? 192 TYR B OH 1 ATOM 4324 N N . THR B 1 172 ? -8.321 1.758 4.888 1.00 89.03 ? 193 THR B N 1 ATOM 4325 C CA . THR B 1 172 ? -7.655 0.470 4.760 1.00 83.69 ? 193 THR B CA 1 ATOM 4326 C C . THR B 1 172 ? -6.335 0.450 5.528 1.00 88.26 ? 193 THR B C 1 ATOM 4327 O O . THR B 1 172 ? -5.597 1.437 5.554 1.00 89.98 ? 193 THR B O 1 ATOM 4328 C CB . THR B 1 172 ? -7.470 0.063 3.279 1.00 77.62 ? 193 THR B CB 1 ATOM 4329 O OG1 . THR B 1 172 ? -6.162 -0.487 3.086 1.00 73.59 ? 193 THR B OG1 1 ATOM 4330 C CG2 . THR B 1 172 ? -7.658 1.262 2.359 1.00 75.60 ? 193 THR B CG2 1 ATOM 4331 N N . CYS B 1 173 ? -6.056 -0.680 6.168 1.00 86.91 ? 194 CYS B N 1 ATOM 4332 C CA . CYS B 1 173 ? -4.897 -0.806 7.041 1.00 83.18 ? 194 CYS B CA 1 ATOM 4333 C C . CYS B 1 173 ? -3.761 -1.563 6.368 1.00 78.20 ? 194 CYS B C 1 ATOM 4334 O O . CYS B 1 173 ? -3.961 -2.657 5.846 1.00 75.67 ? 194 CYS B O 1 ATOM 4335 C CB . CYS B 1 173 ? -5.300 -1.520 8.335 1.00 85.65 ? 194 CYS B CB 1 ATOM 4336 S SG . CYS B 1 173 ? -3.954 -1.833 9.513 1.00 129.31 ? 194 CYS B SG 1 ATOM 4337 N N . VAL B 1 174 ? -2.568 -0.974 6.382 1.00 76.16 ? 195 VAL B N 1 ATOM 4338 C CA . VAL B 1 174 ? -1.372 -1.658 5.898 1.00 75.68 ? 195 VAL B CA 1 ATOM 4339 C C . VAL B 1 174 ? -0.515 -2.174 7.058 1.00 70.10 ? 195 VAL B C 1 ATOM 4340 O O . VAL B 1 174 ? -0.053 -1.401 7.902 1.00 68.14 ? 195 VAL B O 1 ATOM 4341 C CB . VAL B 1 174 ? -0.518 -0.753 4.984 1.00 79.93 ? 195 VAL B CB 1 ATOM 4342 C CG1 . VAL B 1 174 ? -0.326 0.615 5.614 1.00 83.10 ? 195 VAL B CG1 1 ATOM 4343 C CG2 . VAL B 1 174 ? 0.830 -1.408 4.689 1.00 73.36 ? 195 VAL B CG2 1 ATOM 4344 N N . VAL B 1 175 ? -0.309 -3.487 7.092 1.00 63.80 ? 196 VAL B N 1 ATOM 4345 C CA . VAL B 1 175 ? 0.471 -4.113 8.151 1.00 64.37 ? 196 VAL B CA 1 ATOM 4346 C C . VAL B 1 175 ? 1.853 -4.555 7.676 1.00 67.93 ? 196 VAL B C 1 ATOM 4347 O O . VAL B 1 175 ? 2.003 -5.116 6.588 1.00 67.69 ? 196 VAL B O 1 ATOM 4348 C CB . VAL B 1 175 ? -0.291 -5.292 8.795 1.00 68.56 ? 196 VAL B CB 1 ATOM 4349 C CG1 . VAL B 1 175 ? -1.524 -5.625 7.996 1.00 73.35 ? 196 VAL B CG1 1 ATOM 4350 C CG2 . VAL B 1 175 ? 0.605 -6.504 8.932 1.00 68.71 ? 196 VAL B CG2 1 ATOM 4351 N N . THR B 1 176 ? 2.861 -4.294 8.504 1.00 69.47 ? 197 THR B N 1 ATOM 4352 C CA . THR B 1 176 ? 4.241 -4.598 8.156 1.00 68.71 ? 197 THR B CA 1 ATOM 4353 C C . THR B 1 176 ? 4.889 -5.565 9.140 1.00 74.72 ? 197 THR B C 1 ATOM 4354 O O . THR B 1 176 ? 4.731 -5.430 10.349 1.00 79.32 ? 197 THR B O 1 ATOM 4355 C CB . THR B 1 176 ? 5.085 -3.314 8.095 1.00 65.74 ? 197 THR B CB 1 ATOM 4356 O OG1 . THR B 1 176 ? 4.615 -2.487 7.023 1.00 69.77 ? 197 THR B OG1 1 ATOM 4357 C CG2 . THR B 1 176 ? 6.556 -3.647 7.872 1.00 57.39 ? 197 THR B CG2 1 ATOM 4358 N N . ASN B 1 177 ? 5.610 -6.546 8.611 1.00 75.52 ? 198 ASN B N 1 ATOM 4359 C CA . ASN B 1 177 ? 6.408 -7.441 9.436 1.00 78.63 ? 198 ASN B CA 1 ATOM 4360 C C . ASN B 1 177 ? 7.812 -6.863 9.587 1.00 77.94 ? 198 ASN B C 1 ATOM 4361 O O . ASN B 1 177 ? 8.647 -7.006 8.699 1.00 76.86 ? 198 ASN B O 1 ATOM 4362 C CB . ASN B 1 177 ? 6.461 -8.838 8.812 1.00 82.11 ? 198 ASN B CB 1 ATOM 4363 C CG . ASN B 1 177 ? 7.061 -9.880 9.745 1.00 81.57 ? 198 ASN B CG 1 ATOM 4364 O OD1 . ASN B 1 177 ? 7.872 -9.564 10.615 1.00 82.62 ? 198 ASN B OD1 1 ATOM 4365 N ND2 . ASN B 1 177 ? 6.664 -11.135 9.559 1.00 78.85 ? 198 ASN B ND2 1 ATOM 4366 N N . THR B 1 178 ? 8.063 -6.209 10.717 1.00 75.30 ? 199 THR B N 1 ATOM 4367 C CA . THR B 1 178 ? 9.294 -5.445 10.911 1.00 76.64 ? 199 THR B CA 1 ATOM 4368 C C . THR B 1 178 ? 10.575 -6.242 10.662 1.00 77.30 ? 199 THR B C 1 ATOM 4369 O O . THR B 1 178 ? 11.618 -5.663 10.361 1.00 73.45 ? 199 THR B O 1 ATOM 4370 C CB . THR B 1 178 ? 9.352 -4.826 12.318 1.00 79.29 ? 199 THR B CB 1 ATOM 4371 O OG1 . THR B 1 178 ? 9.213 -5.859 13.300 1.00 82.07 ? 199 THR B OG1 1 ATOM 4372 C CG2 . THR B 1 178 ? 8.234 -3.813 12.497 1.00 77.58 ? 199 THR B CG2 1 ATOM 4373 N N . VAL B 1 179 ? 10.498 -7.564 10.781 1.00 80.75 ? 200 VAL B N 1 ATOM 4374 C CA . VAL B 1 179 ? 11.667 -8.414 10.569 1.00 84.12 ? 200 VAL B CA 1 ATOM 4375 C C . VAL B 1 179 ? 11.997 -8.586 9.086 1.00 89.08 ? 200 VAL B C 1 ATOM 4376 O O . VAL B 1 179 ? 13.124 -8.329 8.657 1.00 88.66 ? 200 VAL B O 1 ATOM 4377 C CB . VAL B 1 179 ? 11.482 -9.802 11.206 1.00 83.71 ? 200 VAL B CB 1 ATOM 4378 C CG1 . VAL B 1 179 ? 12.659 -10.703 10.865 1.00 78.97 ? 200 VAL B CG1 1 ATOM 4379 C CG2 . VAL B 1 179 ? 11.320 -9.675 12.712 1.00 87.20 ? 200 VAL B CG2 1 ATOM 4380 N N . THR B 1 180 ? 11.010 -9.025 8.309 1.00 91.06 ? 201 THR B N 1 ATOM 4381 C CA . THR B 1 180 ? 11.209 -9.267 6.883 1.00 88.25 ? 201 THR B CA 1 ATOM 4382 C C . THR B 1 180 ? 10.896 -8.026 6.061 1.00 81.94 ? 201 THR B C 1 ATOM 4383 O O . THR B 1 180 ? 11.358 -7.889 4.931 1.00 78.02 ? 201 THR B O 1 ATOM 4384 C CB . THR B 1 180 ? 10.335 -10.428 6.380 1.00 89.11 ? 201 THR B CB 1 ATOM 4385 O OG1 . THR B 1 180 ? 8.952 -10.112 6.584 1.00 89.97 ? 201 THR B OG1 1 ATOM 4386 C CG2 . THR B 1 180 ? 10.670 -11.707 7.126 1.00 89.55 ? 201 THR B CG2 1 ATOM 4387 N N . ASN B 1 181 ? 10.118 -7.123 6.650 1.00 82.16 ? 202 ASN B N 1 ATOM 4388 C CA . ASN B 1 181 ? 9.626 -5.933 5.963 1.00 88.04 ? 202 ASN B CA 1 ATOM 4389 C C . ASN B 1 181 ? 8.534 -6.280 4.951 1.00 87.64 ? 202 ASN B C 1 ATOM 4390 O O . ASN B 1 181 ? 8.131 -5.447 4.140 1.00 87.41 ? 202 ASN B O 1 ATOM 4391 C CB . ASN B 1 181 ? 10.767 -5.160 5.298 1.00 94.96 ? 202 ASN B CB 1 ATOM 4392 C CG . ASN B 1 181 ? 10.411 -3.709 5.030 1.00 102.35 ? 202 ASN B CG 1 ATOM 4393 O OD1 . ASN B 1 181 ? 9.264 -3.296 5.198 1.00 103.41 ? 202 ASN B OD1 1 ATOM 4394 N ND2 . ASN B 1 181 ? 11.399 -2.926 4.616 1.00 107.75 ? 202 ASN B ND2 1 ATOM 4395 N N . HIS B 1 182 ? 8.060 -7.521 5.005 1.00 86.47 ? 203 HIS B N 1 ATOM 4396 C CA . HIS B 1 182 ? 6.931 -7.938 4.186 1.00 82.15 ? 203 HIS B CA 1 ATOM 4397 C C . HIS B 1 182 ? 5.715 -7.108 4.570 1.00 82.44 ? 203 HIS B C 1 ATOM 4398 O O . HIS B 1 182 ? 5.552 -6.725 5.730 1.00 82.61 ? 203 HIS B O 1 ATOM 4399 C CB . HIS B 1 182 ? 6.657 -9.430 4.367 1.00 81.00 ? 203 HIS B CB 1 ATOM 4400 C CG . HIS B 1 182 ? 5.561 -9.953 3.496 1.00 87.87 ? 203 HIS B CG 1 ATOM 4401 N ND1 . HIS B 1 182 ? 4.830 -11.077 3.818 1.00 92.87 ? 203 HIS B ND1 1 ATOM 4402 C CD2 . HIS B 1 182 ? 5.058 -9.503 2.321 1.00 86.66 ? 203 HIS B CD2 1 ATOM 4403 C CE1 . HIS B 1 182 ? 3.931 -11.302 2.873 1.00 91.39 ? 203 HIS B CE1 1 ATOM 4404 N NE2 . HIS B 1 182 ? 4.052 -10.356 1.956 1.00 89.34 ? 203 HIS B NE2 1 ATOM 4405 N N . LYS B 1 183 ? 4.860 -6.832 3.594 1.00 82.05 ? 204 LYS B N 1 ATOM 4406 C CA . LYS B 1 183 ? 3.815 -5.839 3.771 1.00 81.60 ? 204 LYS B CA 1 ATOM 4407 C C . LYS B 1 183 ? 2.526 -6.268 3.068 1.00 77.39 ? 204 LYS B C 1 ATOM 4408 O O . LYS B 1 183 ? 2.554 -6.679 1.912 1.00 71.71 ? 204 LYS B O 1 ATOM 4409 C CB . LYS B 1 183 ? 4.311 -4.506 3.208 1.00 87.80 ? 204 LYS B CB 1 ATOM 4410 C CG . LYS B 1 183 ? 3.841 -3.276 3.954 1.00 93.99 ? 204 LYS B CG 1 ATOM 4411 C CD . LYS B 1 183 ? 4.422 -2.015 3.326 1.00 93.54 ? 204 LYS B CD 1 ATOM 4412 C CE . LYS B 1 183 ? 5.897 -1.848 3.650 1.00 89.61 ? 204 LYS B CE 1 ATOM 4413 N NZ . LYS B 1 183 ? 6.112 -1.311 5.023 1.00 92.36 ? 204 LYS B NZ 1 ATOM 4414 N N . VAL B 1 184 ? 1.402 -6.181 3.771 1.00 77.33 ? 205 VAL B N 1 ATOM 4415 C CA . VAL B 1 184 ? 0.111 -6.558 3.202 1.00 75.32 ? 205 VAL B CA 1 ATOM 4416 C C . VAL B 1 184 ? -0.931 -5.480 3.469 1.00 78.08 ? 205 VAL B C 1 ATOM 4417 O O . VAL B 1 184 ? -0.905 -4.835 4.520 1.00 79.46 ? 205 VAL B O 1 ATOM 4418 C CB . VAL B 1 184 ? -0.397 -7.906 3.764 1.00 75.16 ? 205 VAL B CB 1 ATOM 4419 C CG1 . VAL B 1 184 ? 0.562 -9.034 3.403 1.00 73.83 ? 205 VAL B CG1 1 ATOM 4420 C CG2 . VAL B 1 184 ? -0.577 -7.821 5.273 1.00 77.80 ? 205 VAL B CG2 1 ATOM 4421 N N . LEU B 1 185 ? -1.836 -5.279 2.512 1.00 75.38 ? 206 LEU B N 1 ATOM 4422 C CA . LEU B 1 185 ? -2.923 -4.316 2.665 1.00 73.59 ? 206 LEU B CA 1 ATOM 4423 C C . LEU B 1 185 ? -4.226 -5.047 2.927 1.00 76.47 ? 206 LEU B C 1 ATOM 4424 O O . LEU B 1 185 ? -4.530 -6.039 2.263 1.00 75.76 ? 206 LEU B O 1 ATOM 4425 C CB . LEU B 1 185 ? -3.082 -3.457 1.411 1.00 74.68 ? 206 LEU B CB 1 ATOM 4426 C CG . LEU B 1 185 ? -1.823 -2.876 0.769 1.00 82.92 ? 206 LEU B CG 1 ATOM 4427 C CD1 . LEU B 1 185 ? -2.186 -2.083 -0.478 1.00 83.95 ? 206 LEU B CD1 1 ATOM 4428 C CD2 . LEU B 1 185 ? -1.054 -2.012 1.753 1.00 87.02 ? 206 LEU B CD2 1 ATOM 4429 N N . GLY B 1 186 ? -4.996 -4.544 3.889 1.00 77.81 ? 207 GLY B N 1 ATOM 4430 C CA . GLY B 1 186 ? -6.281 -5.127 4.233 1.00 83.45 ? 207 GLY B CA 1 ATOM 4431 C C . GLY B 1 186 ? -7.427 -4.597 3.393 1.00 88.45 ? 207 GLY B C 1 ATOM 4432 O O . GLY B 1 186 ? -7.249 -3.674 2.600 1.00 87.54 ? 207 GLY B O 1 ATOM 4433 N N . PRO B 1 187 ? -8.621 -5.182 3.562 1.00 93.03 ? 208 PRO B N 1 ATOM 4434 C CA . PRO B 1 187 ? -9.797 -4.730 2.819 1.00 90.85 ? 208 PRO B CA 1 ATOM 4435 C C . PRO B 1 187 ? -10.179 -3.319 3.238 1.00 92.61 ? 208 PRO B C 1 ATOM 4436 O O . PRO B 1 187 ? -10.033 -2.978 4.415 1.00 83.57 ? 208 PRO B O 1 ATOM 4437 C CB . PRO B 1 187 ? -10.888 -5.712 3.258 1.00 90.72 ? 208 PRO B CB 1 ATOM 4438 C CG . PRO B 1 187 ? -10.166 -6.882 3.827 1.00 90.84 ? 208 PRO B CG 1 ATOM 4439 C CD . PRO B 1 187 ? -8.937 -6.308 4.455 1.00 95.14 ? 208 PRO B CD 1 ATOM 4440 N N . PRO B 1 188 ? -10.661 -2.506 2.285 1.00 99.30 ? 209 PRO B N 1 ATOM 4441 C CA . PRO B 1 188 ? -11.104 -1.140 2.571 1.00 99.71 ? 209 PRO B CA 1 ATOM 4442 C C . PRO B 1 188 ? -12.445 -1.156 3.284 1.00 97.20 ? 209 PRO B C 1 ATOM 4443 O O . PRO B 1 188 ? -13.367 -1.843 2.843 1.00 104.36 ? 209 PRO B O 1 ATOM 4444 C CB . PRO B 1 188 ? -11.276 -0.520 1.175 1.00 100.66 ? 209 PRO B CB 1 ATOM 4445 C CG . PRO B 1 188 ? -10.680 -1.502 0.209 1.00 103.43 ? 209 PRO B CG 1 ATOM 4446 C CD . PRO B 1 188 ? -10.803 -2.837 0.860 1.00 102.65 ? 209 PRO B CD 1 ATOM 4447 N N . THR B 1 189 ? -12.550 -0.416 4.379 1.00 89.35 ? 210 THR B N 1 ATOM 4448 C CA . THR B 1 189 ? -13.829 -0.254 5.051 1.00 91.53 ? 210 THR B CA 1 ATOM 4449 C C . THR B 1 189 ? -14.314 1.186 4.906 1.00 87.46 ? 210 THR B C 1 ATOM 4450 O O . THR B 1 189 ? -13.601 2.124 5.257 1.00 85.13 ? 210 THR B O 1 ATOM 4451 C CB . THR B 1 189 ? -13.757 -0.660 6.539 1.00 93.73 ? 210 THR B CB 1 ATOM 4452 O OG1 . THR B 1 189 ? -14.961 -0.260 7.203 1.00 97.68 ? 210 THR B OG1 1 ATOM 4453 C CG2 . THR B 1 189 ? -12.572 -0.004 7.220 1.00 91.43 ? 210 THR B CG2 1 ATOM 4454 N N . PRO B 1 190 ? -15.520 1.364 4.351 1.00 85.31 ? 211 PRO B N 1 ATOM 4455 C CA . PRO B 1 190 ? -16.112 2.695 4.192 1.00 86.16 ? 211 PRO B CA 1 ATOM 4456 C C . PRO B 1 190 ? -16.787 3.156 5.477 1.00 92.50 ? 211 PRO B C 1 ATOM 4457 O O . PRO B 1 190 ? -17.360 2.333 6.191 1.00 97.76 ? 211 PRO B O 1 ATOM 4458 C CB . PRO B 1 190 ? -17.180 2.478 3.107 1.00 82.97 ? 211 PRO B CB 1 ATOM 4459 C CG . PRO B 1 190 ? -16.935 1.094 2.556 1.00 82.78 ? 211 PRO B CG 1 ATOM 4460 C CD . PRO B 1 190 ? -16.317 0.331 3.673 1.00 85.02 ? 211 PRO B CD 1 ATOM 4461 N N . LEU B 1 191 ? -16.717 4.450 5.771 1.00 91.93 ? 212 LEU B N 1 ATOM 4462 C CA . LEU B 1 191 ? -17.498 5.012 6.868 1.00 96.70 ? 212 LEU B CA 1 ATOM 4463 C C . LEU B 1 191 ? -18.287 6.230 6.388 1.00 103.58 ? 212 LEU B C 1 ATOM 4464 O O . LEU B 1 191 ? -17.834 6.970 5.515 1.00 109.81 ? 212 LEU B O 1 ATOM 4465 C CB . LEU B 1 191 ? -16.618 5.343 8.083 1.00 94.91 ? 212 LEU B CB 1 ATOM 4466 C CG . LEU B 1 191 ? -15.994 6.729 8.269 1.00 95.00 ? 212 LEU B CG 1 ATOM 4467 C CD1 . LEU B 1 191 ? -17.040 7.795 8.570 1.00 96.48 ? 212 LEU B CD1 1 ATOM 4468 C CD2 . LEU B 1 191 ? -14.987 6.679 9.395 1.00 94.94 ? 212 LEU B CD2 1 ATOM 4469 N N . ILE B 1 192 ? -19.471 6.427 6.957 1.00 102.16 ? 213 ILE B N 1 ATOM 4470 C CA . ILE B 1 192 ? -20.361 7.496 6.517 1.00 101.75 ? 213 ILE B CA 1 ATOM 4471 C C . ILE B 1 192 ? -21.077 8.135 7.699 1.00 104.41 ? 213 ILE B C 1 ATOM 4472 O O . ILE B 1 192 ? -21.125 7.564 8.788 1.00 112.45 ? 213 ILE B O 1 ATOM 4473 C CB . ILE B 1 192 ? -21.412 6.958 5.547 1.00 99.84 ? 213 ILE B CB 1 ATOM 4474 C CG1 . ILE B 1 192 ? -22.346 5.991 6.276 1.00 96.63 ? 213 ILE B CG1 1 ATOM 4475 C CG2 . ILE B 1 192 ? -20.737 6.270 4.367 1.00 101.01 ? 213 ILE B CG2 1 ATOM 4476 C CD1 . ILE B 1 192 ? -23.288 5.243 5.365 1.00 96.60 ? 213 ILE B CD1 1 ATOM 4477 N N . LEU B 1 193 ? -21.637 9.318 7.481 1.00 98.40 ? 214 LEU B N 1 ATOM 4478 C CA . LEU B 1 193 ? -22.338 10.032 8.543 1.00 97.45 ? 214 LEU B CA 1 ATOM 4479 C C . LEU B 1 193 ? -23.817 9.657 8.627 1.00 102.64 ? 214 LEU B C 1 ATOM 4480 O O . LEU B 1 193 ? -24.514 9.574 7.611 1.00 94.55 ? 214 LEU B O 1 ATOM 4481 C CB . LEU B 1 193 ? -22.202 11.546 8.361 1.00 94.91 ? 214 LEU B CB 1 ATOM 4482 C CG . LEU B 1 193 ? -20.807 12.157 8.463 1.00 94.34 ? 214 LEU B CG 1 ATOM 4483 C CD1 . LEU B 1 193 ? -20.917 13.672 8.524 1.00 97.91 ? 214 LEU B CD1 1 ATOM 4484 C CD2 . LEU B 1 193 ? -20.068 11.617 9.681 1.00 86.35 ? 214 LEU B CD2 1 ATOM 4485 N N . ARG B 1 194 ? -24.288 9.433 9.848 1.00 108.80 ? 215 ARG B N 1 ATOM 4486 C CA . ARG B 1 194 ? -25.702 9.214 10.088 1.00 112.99 ? 215 ARG B CA 1 ATOM 4487 C C . ARG B 1 194 ? -26.420 10.551 10.014 1.00 125.45 ? 215 ARG B C 1 ATOM 4488 O O . ARG B 1 194 ? -25.807 11.602 10.204 1.00 127.03 ? 215 ARG B O 1 ATOM 4489 C CB . ARG B 1 194 ? -25.929 8.587 11.464 1.00 110.52 ? 215 ARG B CB 1 ATOM 4490 C CG . ARG B 1 194 ? -25.284 7.227 11.655 1.00 111.88 ? 215 ARG B CG 1 ATOM 4491 C CD . ARG B 1 194 ? -25.528 6.710 13.062 1.00 114.70 ? 215 ARG B CD 1 ATOM 4492 N NE . ARG B 1 194 ? -26.951 6.713 13.388 1.00 117.93 ? 215 ARG B NE 1 ATOM 4493 C CZ . ARG B 1 194 ? -27.716 5.627 13.405 1.00 115.78 ? 215 ARG B CZ 1 ATOM 4494 N NH1 . ARG B 1 194 ? -27.196 4.439 13.127 1.00 110.58 ? 215 ARG B NH1 1 ATOM 4495 N NH2 . ARG B 1 194 ? -29.003 5.729 13.710 1.00 116.30 ? 215 ARG B NH2 1 ATOM 4496 N N . ASN B 1 195 ? -27.718 10.505 9.726 1.00 132.31 ? 216 ASN B N 1 ATOM 4497 C CA . ASN B 1 195 ? -28.562 11.690 9.760 1.00 137.38 ? 216 ASN B CA 1 ATOM 4498 C C . ASN B 1 195 ? -29.336 11.705 11.071 1.00 144.28 ? 216 ASN B C 1 ATOM 4499 O O . ASN B 1 195 ? -30.083 12.638 11.364 1.00 148.82 ? 216 ASN B O 1 ATOM 4500 C CB . ASN B 1 195 ? -29.521 11.692 8.568 1.00 137.39 ? 216 ASN B CB 1 ATOM 4501 C CG . ASN B 1 195 ? -30.389 12.937 8.514 1.00 138.33 ? 216 ASN B CG 1 ATOM 4502 O OD1 . ASN B 1 195 ? -30.123 13.927 9.195 1.00 139.33 ? 216 ASN B OD1 1 ATOM 4503 N ND2 . ASN B 1 195 ? -31.434 12.892 7.697 1.00 137.97 ? 216 ASN B ND2 1 ATOM 4504 N N . ASP B 1 196 ? -29.144 10.650 11.857 1.00 145.82 ? 217 ASP B N 1 ATOM 4505 C CA . ASP B 1 196 ? -29.792 10.510 13.153 1.00 148.38 ? 217 ASP B CA 1 ATOM 4506 C C . ASP B 1 196 ? -29.734 11.819 13.935 1.00 148.78 ? 217 ASP B C 1 ATOM 4507 O O . ASP B 1 196 ? -30.758 12.463 14.167 1.00 153.47 ? 217 ASP B O 1 ATOM 4508 C CB . ASP B 1 196 ? -29.120 9.387 13.949 1.00 149.31 ? 217 ASP B CB 1 ATOM 4509 C CG . ASP B 1 196 ? -29.991 8.864 15.074 1.00 151.86 ? 217 ASP B CG 1 ATOM 4510 O OD1 . ASP B 1 196 ? -30.832 9.631 15.588 1.00 153.33 ? 217 ASP B OD1 1 ATOM 4511 O OD2 . ASP B 1 196 ? -29.832 7.683 15.445 1.00 151.60 ? 217 ASP B OD2 1 ATOM 4512 N N . GLY B 1 197 ? -28.527 12.210 14.331 1.00 143.20 ? 218 GLY B N 1 ATOM 4513 C CA . GLY B 1 197 ? -28.321 13.429 15.090 1.00 138.36 ? 218 GLY B CA 1 ATOM 4514 C C . GLY B 1 197 ? -26.897 13.514 15.602 1.00 134.11 ? 218 GLY B C 1 ATOM 4515 O O . GLY B 1 197 ? -26.158 12.529 15.567 1.00 129.93 ? 218 GLY B O 1 ATOM 4516 N N . VAL B 1 198 ? -26.508 14.691 16.080 1.00 132.56 ? 219 VAL B N 1 ATOM 4517 C CA . VAL B 1 198 ? -25.148 14.909 16.560 1.00 127.50 ? 219 VAL B CA 1 ATOM 4518 C C . VAL B 1 198 ? -25.009 14.602 18.049 1.00 126.72 ? 219 VAL B C 1 ATOM 4519 O O . VAL B 1 198 ? -25.871 14.966 18.851 1.00 125.34 ? 219 VAL B O 1 ATOM 4520 C CB . VAL B 1 198 ? -24.677 16.353 16.288 1.00 123.98 ? 219 VAL B CB 1 ATOM 4521 C CG1 . VAL B 1 198 ? -23.340 16.618 16.968 1.00 121.78 ? 219 VAL B CG1 1 ATOM 4522 C CG2 . VAL B 1 198 ? -24.582 16.606 14.791 1.00 121.11 ? 219 VAL B CG2 1 ATOM 4523 N N . MET B 1 199 ? -23.919 13.928 18.409 1.00 124.82 ? 220 MET B N 1 ATOM 4524 C CA . MET B 1 199 ? -23.638 13.603 19.803 1.00 121.95 ? 220 MET B CA 1 ATOM 4525 C C . MET B 1 199 ? -22.974 14.779 20.511 1.00 121.95 ? 220 MET B C 1 ATOM 4526 O O . MET B 1 199 ? -22.074 15.419 19.965 1.00 119.64 ? 220 MET B O 1 ATOM 4527 C CB . MET B 1 199 ? -22.751 12.362 19.906 1.00 117.11 ? 220 MET B CB 1 ATOM 4528 C CG . MET B 1 199 ? -22.718 11.752 21.297 1.00 114.56 ? 220 MET B CG 1 ATOM 4529 S SD . MET B 1 199 ? -21.441 10.494 21.480 1.00 218.69 ? 220 MET B SD 1 ATOM 4530 C CE . MET B 1 199 ? -21.874 9.808 23.077 1.00 146.04 ? 220 MET B CE 1 ATOM 4531 N N . GLY B 1 200 ? -23.423 15.056 21.730 1.00 124.15 ? 221 GLY B N 1 ATOM 4532 C CA . GLY B 1 200 ? -22.931 16.190 22.490 1.00 123.39 ? 221 GLY B CA 1 ATOM 4533 C C . GLY B 1 200 ? -21.693 15.865 23.298 1.00 119.88 ? 221 GLY B C 1 ATOM 4534 O O . GLY B 1 200 ? -21.296 14.706 23.401 1.00 117.23 ? 221 GLY B O 1 ATOM 4535 N N . GLU B 1 201 ? -21.092 16.899 23.881 1.00 121.86 ? 222 GLU B N 1 ATOM 4536 C CA . GLU B 1 201 ? -19.842 16.769 24.624 1.00 124.94 ? 222 GLU B CA 1 ATOM 4537 C C . GLU B 1 201 ? -19.959 15.837 25.833 1.00 123.54 ? 222 GLU B C 1 ATOM 4538 O O . GLU B 1 201 ? -20.945 15.880 26.570 1.00 119.92 ? 222 GLU B O 1 ATOM 4539 C CB . GLU B 1 201 ? -19.347 18.152 25.058 1.00 128.99 ? 222 GLU B CB 1 ATOM 4540 C CG . GLU B 1 201 ? -19.290 19.162 23.918 1.00 130.47 ? 222 GLU B CG 1 ATOM 4541 C CD . GLU B 1 201 ? -18.513 20.416 24.274 1.00 132.27 ? 222 GLU B CD 1 ATOM 4542 O OE1 . GLU B 1 201 ? -18.146 20.577 25.457 1.00 134.03 ? 222 GLU B OE1 1 ATOM 4543 O OE2 . GLU B 1 201 ? -18.269 21.241 23.368 1.00 131.38 ? 222 GLU B OE2 1 ATOM 4544 N N . TYR B 1 202 ? -18.945 14.997 26.029 1.00 124.10 ? 223 TYR B N 1 ATOM 4545 C CA . TYR B 1 202 ? -18.956 14.020 27.115 1.00 128.46 ? 223 TYR B CA 1 ATOM 4546 C C . TYR B 1 202 ? -17.554 13.722 27.648 1.00 132.35 ? 223 TYR B C 1 ATOM 4547 O O . TYR B 1 202 ? -16.555 14.032 26.999 1.00 134.72 ? 223 TYR B O 1 ATOM 4548 C CB . TYR B 1 202 ? -19.643 12.723 26.667 1.00 128.22 ? 223 TYR B CB 1 ATOM 4549 C CG . TYR B 1 202 ? -18.969 12.016 25.506 1.00 127.68 ? 223 TYR B CG 1 ATOM 4550 C CD1 . TYR B 1 202 ? -18.324 10.799 25.688 1.00 126.40 ? 223 TYR B CD1 1 ATOM 4551 C CD2 . TYR B 1 202 ? -18.985 12.562 24.229 1.00 129.19 ? 223 TYR B CD2 1 ATOM 4552 C CE1 . TYR B 1 202 ? -17.710 10.148 24.631 1.00 125.61 ? 223 TYR B CE1 1 ATOM 4553 C CE2 . TYR B 1 202 ? -18.374 11.919 23.166 1.00 128.14 ? 223 TYR B CE2 1 ATOM 4554 C CZ . TYR B 1 202 ? -17.739 10.713 23.372 1.00 124.50 ? 223 TYR B CZ 1 ATOM 4555 O OH . TYR B 1 202 ? -17.132 10.074 22.314 1.00 119.10 ? 223 TYR B OH 1 ATOM 4556 N N . GLU B 1 203 ? -17.493 13.125 28.837 1.00 131.47 ? 224 GLU B N 1 ATOM 4557 C CA . GLU B 1 203 ? -16.224 12.732 29.446 1.00 127.37 ? 224 GLU B CA 1 ATOM 4558 C C . GLU B 1 203 ? -15.384 11.880 28.504 1.00 123.03 ? 224 GLU B C 1 ATOM 4559 O O . GLU B 1 203 ? -15.923 11.101 27.718 1.00 123.33 ? 224 GLU B O 1 ATOM 4560 C CB . GLU B 1 203 ? -16.463 11.953 30.742 1.00 128.06 ? 224 GLU B CB 1 ATOM 4561 C CG . GLU B 1 203 ? -16.422 12.789 32.006 1.00 131.32 ? 224 GLU B CG 1 ATOM 4562 C CD . GLU B 1 203 ? -16.272 11.938 33.253 1.00 131.80 ? 224 GLU B CD 1 ATOM 4563 O OE1 . GLU B 1 203 ? -16.179 10.699 33.118 1.00 130.87 ? 224 GLU B OE1 1 ATOM 4564 O OE2 . GLU B 1 203 ? -16.243 12.505 34.366 1.00 132.48 ? 224 GLU B OE2 1 ATOM 4565 N N . PRO B 1 204 ? -14.054 12.022 28.586 1.00 117.24 ? 225 PRO B N 1 ATOM 4566 C CA . PRO B 1 204 ? -13.150 11.181 27.801 1.00 113.11 ? 225 PRO B CA 1 ATOM 4567 C C . PRO B 1 204 ? -13.175 9.748 28.316 1.00 112.23 ? 225 PRO B C 1 ATOM 4568 O O . PRO B 1 204 ? -13.194 9.536 29.530 1.00 114.10 ? 225 PRO B O 1 ATOM 4569 C CB . PRO B 1 204 ? -11.772 11.804 28.061 1.00 109.65 ? 225 PRO B CB 1 ATOM 4570 C CG . PRO B 1 204 ? -12.048 13.165 28.620 1.00 110.00 ? 225 PRO B CG 1 ATOM 4571 C CD . PRO B 1 204 ? -13.323 13.024 29.378 1.00 114.44 ? 225 PRO B CD 1 ATOM 4572 N N . LYS B 1 205 ? -13.188 8.780 27.406 1.00 108.87 ? 226 LYS B N 1 ATOM 4573 C CA . LYS B 1 205 ? -13.109 7.375 27.788 1.00 110.38 ? 226 LYS B CA 1 ATOM 4574 C C . LYS B 1 205 ? -11.898 6.704 27.135 1.00 111.32 ? 226 LYS B C 1 ATOM 4575 O O . LYS B 1 205 ? -11.864 6.504 25.919 1.00 113.84 ? 226 LYS B O 1 ATOM 4576 C CB . LYS B 1 205 ? -14.403 6.635 27.425 1.00 108.41 ? 226 LYS B CB 1 ATOM 4577 C CG . LYS B 1 205 ? -14.424 5.167 27.848 1.00 113.03 ? 226 LYS B CG 1 ATOM 4578 C CD . LYS B 1 205 ? -13.987 5.000 29.302 1.00 121.61 ? 226 LYS B CD 1 ATOM 4579 C CE . LYS B 1 205 ? -14.102 3.553 29.774 1.00 124.47 ? 226 LYS B CE 1 ATOM 4580 N NZ . LYS B 1 205 ? -13.054 2.660 29.198 1.00 123.28 ? 226 LYS B NZ 1 ATOM 4581 N N . ILE B 1 206 ? -10.904 6.367 27.951 1.00 105.77 ? 227 ILE B N 1 ATOM 4582 C CA . ILE B 1 206 ? -9.687 5.736 27.455 1.00 100.99 ? 227 ILE B CA 1 ATOM 4583 C C . ILE B 1 206 ? -10.007 4.383 26.841 1.00 98.57 ? 227 ILE B C 1 ATOM 4584 O O . ILE B 1 206 ? -10.620 3.531 27.483 1.00 99.64 ? 227 ILE B O 1 ATOM 4585 C CB . ILE B 1 206 ? -8.646 5.556 28.572 1.00 97.66 ? 227 ILE B CB 1 ATOM 4586 C CG1 . ILE B 1 206 ? -8.346 6.899 29.238 1.00 95.98 ? 227 ILE B CG1 1 ATOM 4587 C CG2 . ILE B 1 206 ? -7.369 4.936 28.021 1.00 93.01 ? 227 ILE B CG2 1 ATOM 4588 C CD1 . ILE B 1 206 ? -7.257 6.821 30.278 1.00 95.00 ? 227 ILE B CD1 1 ATOM 4589 N N . GLU B 1 207 ? -9.589 4.193 25.595 1.00 96.58 ? 228 GLU B N 1 ATOM 4590 C CA . GLU B 1 207 ? -9.916 2.981 24.855 1.00 99.66 ? 228 GLU B CA 1 ATOM 4591 C C . GLU B 1 207 ? -8.676 2.131 24.594 1.00 94.47 ? 228 GLU B C 1 ATOM 4592 O O . GLU B 1 207 ? -8.783 0.935 24.327 1.00 91.91 ? 228 GLU B O 1 ATOM 4593 C CB . GLU B 1 207 ? -10.623 3.334 23.539 1.00 107.71 ? 228 GLU B CB 1 ATOM 4594 C CG . GLU B 1 207 ? -11.092 2.134 22.719 1.00 112.40 ? 228 GLU B CG 1 ATOM 4595 C CD . GLU B 1 207 ? -12.290 1.429 23.332 1.00 117.19 ? 228 GLU B CD 1 ATOM 4596 O OE1 . GLU B 1 207 ? -12.736 1.845 24.423 1.00 118.20 ? 228 GLU B OE1 1 ATOM 4597 O OE2 . GLU B 1 207 ? -12.786 0.458 22.720 1.00 118.32 ? 228 GLU B OE2 1 ATOM 4598 N N . VAL B 1 208 ? -7.502 2.751 24.676 1.00 93.18 ? 229 VAL B N 1 ATOM 4599 C CA . VAL B 1 208 ? -6.242 2.021 24.562 1.00 92.77 ? 229 VAL B CA 1 ATOM 4600 C C . VAL B 1 208 ? -5.352 2.357 25.748 1.00 95.40 ? 229 VAL B C 1 ATOM 4601 O O . VAL B 1 208 ? -5.049 3.526 25.984 1.00 97.82 ? 229 VAL B O 1 ATOM 4602 C CB . VAL B 1 208 ? -5.472 2.394 23.285 1.00 88.56 ? 229 VAL B CB 1 ATOM 4603 C CG1 . VAL B 1 208 ? -4.930 1.141 22.613 1.00 82.80 ? 229 VAL B CG1 1 ATOM 4604 C CG2 . VAL B 1 208 ? -6.363 3.161 22.335 1.00 89.58 ? 229 VAL B CG2 1 ATOM 4605 N N . GLN B 1 209 ? -4.936 1.334 26.492 1.00 94.79 ? 230 GLN B N 1 ATOM 4606 C CA . GLN B 1 209 ? -4.050 1.528 27.635 1.00 93.39 ? 230 GLN B CA 1 ATOM 4607 C C . GLN B 1 209 ? -2.840 0.614 27.542 1.00 91.08 ? 230 GLN B C 1 ATOM 4608 O O . GLN B 1 209 ? -2.834 -0.351 26.783 1.00 91.52 ? 230 GLN B O 1 ATOM 4609 C CB . GLN B 1 209 ? -4.774 1.224 28.947 1.00 95.79 ? 230 GLN B CB 1 ATOM 4610 C CG . GLN B 1 209 ? -6.146 1.839 29.090 1.00 104.89 ? 230 GLN B CG 1 ATOM 4611 C CD . GLN B 1 209 ? -6.744 1.567 30.455 1.00 112.04 ? 230 GLN B CD 1 ATOM 4612 O OE1 . GLN B 1 209 ? -6.045 1.134 31.372 1.00 110.95 ? 230 GLN B OE1 1 ATOM 4613 N NE2 . GLN B 1 209 ? -8.041 1.823 30.600 1.00 116.16 ? 230 GLN B NE2 1 ATOM 4614 N N . PHE B 1 210 ? -1.816 0.917 28.329 1.00 93.36 ? 231 PHE B N 1 ATOM 4615 C CA . PHE B 1 210 ? -0.701 -0.004 28.497 1.00 96.82 ? 231 PHE B CA 1 ATOM 4616 C C . PHE B 1 210 ? -1.050 -1.007 29.592 1.00 102.54 ? 231 PHE B C 1 ATOM 4617 O O . PHE B 1 210 ? -1.755 -0.667 30.541 1.00 105.50 ? 231 PHE B O 1 ATOM 4618 C CB . PHE B 1 210 ? 0.589 0.749 28.830 1.00 93.02 ? 231 PHE B CB 1 ATOM 4619 C CG . PHE B 1 210 ? 0.451 1.728 29.961 1.00 93.22 ? 231 PHE B CG 1 ATOM 4620 C CD1 . PHE B 1 210 ? 0.905 1.408 31.231 1.00 97.30 ? 231 PHE B CD1 1 ATOM 4621 C CD2 . PHE B 1 210 ? -0.119 2.973 29.753 1.00 92.26 ? 231 PHE B CD2 1 ATOM 4622 C CE1 . PHE B 1 210 ? 0.786 2.308 32.275 1.00 97.06 ? 231 PHE B CE1 1 ATOM 4623 C CE2 . PHE B 1 210 ? -0.244 3.877 30.790 1.00 94.79 ? 231 PHE B CE2 1 ATOM 4624 C CZ . PHE B 1 210 ? 0.209 3.544 32.054 1.00 97.35 ? 231 PHE B CZ 1 ATOM 4625 N N . PRO B 1 211 ? -0.571 -2.252 29.453 1.00 104.86 ? 232 PRO B N 1 ATOM 4626 C CA . PRO B 1 211 ? -0.879 -3.329 30.401 1.00 108.93 ? 232 PRO B CA 1 ATOM 4627 C C . PRO B 1 211 ? -0.754 -2.882 31.856 1.00 112.40 ? 232 PRO B C 1 ATOM 4628 O O . PRO B 1 211 ? -0.075 -1.898 32.145 1.00 112.58 ? 232 PRO B O 1 ATOM 4629 C CB . PRO B 1 211 ? 0.184 -4.381 30.079 1.00 107.11 ? 232 PRO B CB 1 ATOM 4630 C CG . PRO B 1 211 ? 0.474 -4.178 28.635 1.00 103.69 ? 232 PRO B CG 1 ATOM 4631 C CD . PRO B 1 211 ? 0.335 -2.701 28.381 1.00 103.45 ? 232 PRO B CD 1 ATOM 4632 N N . GLU B 1 212 ? -1.408 -3.597 32.765 1.00 116.64 ? 233 GLU B N 1 ATOM 4633 C CA . GLU B 1 212 ? -1.324 -3.262 34.180 1.00 122.64 ? 233 GLU B CA 1 ATOM 4634 C C . GLU B 1 212 ? 0.072 -3.541 34.726 1.00 121.36 ? 233 GLU B C 1 ATOM 4635 O O . GLU B 1 212 ? 0.506 -2.912 35.690 1.00 124.68 ? 233 GLU B O 1 ATOM 4636 C CB . GLU B 1 212 ? -2.388 -4.009 34.985 1.00 129.35 ? 233 GLU B CB 1 ATOM 4637 C CG . GLU B 1 212 ? -3.806 -3.547 34.688 1.00 135.51 ? 233 GLU B CG 1 ATOM 4638 C CD . GLU B 1 212 ? -4.765 -3.848 35.820 1.00 141.70 ? 233 GLU B CD 1 ATOM 4639 O OE1 . GLU B 1 212 ? -5.852 -3.233 35.857 1.00 142.68 ? 233 GLU B OE1 1 ATOM 4640 O OE2 . GLU B 1 212 ? -4.430 -4.691 36.678 1.00 144.57 ? 233 GLU B OE2 1 ATOM 4641 N N . THR B 1 213 ? 0.770 -4.486 34.102 1.00 116.77 ? 234 THR B N 1 ATOM 4642 C CA . THR B 1 213 ? 2.172 -4.736 34.418 1.00 115.88 ? 234 THR B CA 1 ATOM 4643 C C . THR B 1 213 ? 2.991 -4.761 33.129 1.00 110.92 ? 234 THR B C 1 ATOM 4644 O O . THR B 1 213 ? 2.621 -5.425 32.155 1.00 108.26 ? 234 THR B O 1 ATOM 4645 C CB . THR B 1 213 ? 2.369 -6.057 35.189 1.00 118.10 ? 234 THR B CB 1 ATOM 4646 O OG1 . THR B 1 213 ? 1.252 -6.278 36.059 1.00 121.52 ? 234 THR B OG1 1 ATOM 4647 C CG2 . THR B 1 213 ? 3.648 -6.007 36.017 1.00 117.85 ? 234 THR B CG2 1 ATOM 4648 N N . VAL B 1 214 ? 4.099 -4.026 33.126 1.00 105.76 ? 235 VAL B N 1 ATOM 4649 C CA . VAL B 1 214 ? 4.924 -3.880 31.931 1.00 99.40 ? 235 VAL B CA 1 ATOM 4650 C C . VAL B 1 214 ? 6.390 -4.210 32.200 1.00 98.16 ? 235 VAL B C 1 ATOM 4651 O O . VAL B 1 214 ? 7.112 -3.404 32.784 1.00 97.33 ? 235 VAL B O 1 ATOM 4652 C CB . VAL B 1 214 ? 4.850 -2.447 31.371 1.00 89.92 ? 235 VAL B CB 1 ATOM 4653 C CG1 . VAL B 1 214 ? 5.629 -2.348 30.074 1.00 85.98 ? 235 VAL B CG1 1 ATOM 4654 C CG2 . VAL B 1 214 ? 3.408 -2.031 31.160 1.00 84.58 ? 235 VAL B CG2 1 ATOM 4655 N N . PRO B 1 215 ? 6.832 -5.403 31.774 1.00 99.14 ? 236 PRO B N 1 ATOM 4656 C CA . PRO B 1 215 ? 8.251 -5.755 31.868 1.00 101.42 ? 236 PRO B CA 1 ATOM 4657 C C . PRO B 1 215 ? 9.085 -4.764 31.069 1.00 100.21 ? 236 PRO B C 1 ATOM 4658 O O . PRO B 1 215 ? 8.769 -4.502 29.907 1.00 101.54 ? 236 PRO B O 1 ATOM 4659 C CB . PRO B 1 215 ? 8.312 -7.139 31.214 1.00 101.70 ? 236 PRO B CB 1 ATOM 4660 C CG . PRO B 1 215 ? 6.939 -7.687 31.359 1.00 104.13 ? 236 PRO B CG 1 ATOM 4661 C CD . PRO B 1 215 ? 6.023 -6.506 31.231 1.00 101.86 ? 236 PRO B CD 1 ATOM 4662 N N . ALA B 1 216 ? 10.125 -4.216 31.686 1.00 91.28 ? 237 ALA B N 1 ATOM 4663 C CA . ALA B 1 216 ? 10.969 -3.228 31.025 1.00 92.44 ? 237 ALA B CA 1 ATOM 4664 C C . ALA B 1 216 ? 12.440 -3.614 31.117 1.00 94.66 ? 237 ALA B C 1 ATOM 4665 O O . ALA B 1 216 ? 13.043 -3.549 32.190 1.00 87.58 ? 237 ALA B O 1 ATOM 4666 C CB . ALA B 1 216 ? 10.741 -1.850 31.628 1.00 93.99 ? 237 ALA B CB 1 ATOM 4667 N N . GLU B 1 217 ? 13.016 -4.017 29.988 1.00 99.18 ? 238 GLU B N 1 ATOM 4668 C CA . GLU B 1 217 ? 14.403 -4.468 29.961 1.00 97.87 ? 238 GLU B CA 1 ATOM 4669 C C . GLU B 1 217 ? 15.374 -3.295 30.023 1.00 94.41 ? 238 GLU B C 1 ATOM 4670 O O . GLU B 1 217 ? 15.195 -2.294 29.327 1.00 91.91 ? 238 GLU B O 1 ATOM 4671 C CB . GLU B 1 217 ? 14.676 -5.310 28.715 1.00 99.30 ? 238 GLU B CB 1 ATOM 4672 C CG . GLU B 1 217 ? 15.991 -6.066 28.773 1.00 103.75 ? 238 GLU B CG 1 ATOM 4673 C CD . GLU B 1 217 ? 16.315 -6.786 27.480 1.00 109.10 ? 238 GLU B CD 1 ATOM 4674 O OE1 . GLU B 1 217 ? 15.535 -6.659 26.512 1.00 110.07 ? 238 GLU B OE1 1 ATOM 4675 O OE2 . GLU B 1 217 ? 17.355 -7.477 27.431 1.00 111.05 ? 238 GLU B OE2 1 ATOM 4676 N N . LYS B 1 218 ? 16.402 -3.424 30.858 1.00 93.93 ? 239 LYS B N 1 ATOM 4677 C CA . LYS B 1 218 ? 17.391 -2.366 31.017 1.00 93.78 ? 239 LYS B CA 1 ATOM 4678 C C . LYS B 1 218 ? 18.112 -2.107 29.702 1.00 94.07 ? 239 LYS B C 1 ATOM 4679 O O . LYS B 1 218 ? 18.443 -3.039 28.968 1.00 94.55 ? 239 LYS B O 1 ATOM 4680 C CB . LYS B 1 218 ? 18.401 -2.715 32.115 1.00 96.01 ? 239 LYS B CB 1 ATOM 4681 C CG . LYS B 1 218 ? 19.692 -3.343 31.620 1.00 96.25 ? 239 LYS B CG 1 ATOM 4682 C CD . LYS B 1 218 ? 20.747 -3.361 32.721 1.00 99.11 ? 239 LYS B CD 1 ATOM 4683 C CE . LYS B 1 218 ? 22.014 -4.090 32.283 1.00 100.05 ? 239 LYS B CE 1 ATOM 4684 N NZ . LYS B 1 218 ? 22.922 -4.382 33.433 1.00 100.00 ? 239 LYS B NZ 1 ATOM 4685 N N . GLY B 1 219 ? 18.346 -0.833 29.403 1.00 93.75 ? 240 GLY B N 1 ATOM 4686 C CA . GLY B 1 219 ? 19.005 -0.453 28.169 1.00 93.68 ? 240 GLY B CA 1 ATOM 4687 C C . GLY B 1 219 ? 18.039 -0.107 27.051 1.00 94.79 ? 240 GLY B C 1 ATOM 4688 O O . GLY B 1 219 ? 18.236 0.884 26.349 1.00 96.86 ? 240 GLY B O 1 ATOM 4689 N N . THR B 1 220 ? 16.995 -0.917 26.887 1.00 94.02 ? 241 THR B N 1 ATOM 4690 C CA . THR B 1 220 ? 16.049 -0.734 25.782 1.00 93.81 ? 241 THR B CA 1 ATOM 4691 C C . THR B 1 220 ? 15.209 0.526 25.930 1.00 92.72 ? 241 THR B C 1 ATOM 4692 O O . THR B 1 220 ? 15.361 1.283 26.888 1.00 92.84 ? 241 THR B O 1 ATOM 4693 C CB . THR B 1 220 ? 15.086 -1.933 25.628 1.00 92.63 ? 241 THR B CB 1 ATOM 4694 O OG1 . THR B 1 220 ? 14.232 -2.019 26.776 1.00 95.03 ? 241 THR B OG1 1 ATOM 4695 C CG2 . THR B 1 220 ? 15.860 -3.230 25.470 1.00 91.78 ? 241 THR B CG2 1 ATOM 4696 N N . THR B 1 221 ? 14.320 0.737 24.966 1.00 88.74 ? 242 THR B N 1 ATOM 4697 C CA . THR B 1 221 ? 13.418 1.880 24.986 1.00 93.08 ? 242 THR B CA 1 ATOM 4698 C C . THR B 1 221 ? 11.957 1.426 24.992 1.00 96.39 ? 242 THR B C 1 ATOM 4699 O O . THR B 1 221 ? 11.446 0.911 23.996 1.00 98.35 ? 242 THR B O 1 ATOM 4700 C CB . THR B 1 221 ? 13.679 2.826 23.799 1.00 95.44 ? 242 THR B CB 1 ATOM 4701 O OG1 . THR B 1 221 ? 12.475 3.535 23.478 1.00 102.05 ? 242 THR B OG1 1 ATOM 4702 C CG2 . THR B 1 221 ? 14.134 2.038 22.583 1.00 93.50 ? 242 THR B CG2 1 ATOM 4703 N N . VAL B 1 222 ? 11.291 1.621 26.125 1.00 93.47 ? 243 VAL B N 1 ATOM 4704 C CA . VAL B 1 222 ? 9.925 1.150 26.300 1.00 91.76 ? 243 VAL B CA 1 ATOM 4705 C C . VAL B 1 222 ? 8.911 2.253 26.009 1.00 86.73 ? 243 VAL B C 1 ATOM 4706 O O . VAL B 1 222 ? 9.084 3.398 26.436 1.00 76.09 ? 243 VAL B O 1 ATOM 4707 C CB . VAL B 1 222 ? 9.698 0.604 27.722 1.00 96.57 ? 243 VAL B CB 1 ATOM 4708 C CG1 . VAL B 1 222 ? 10.707 -0.498 28.036 1.00 97.71 ? 243 VAL B CG1 1 ATOM 4709 C CG2 . VAL B 1 222 ? 9.802 1.725 28.739 1.00 100.56 ? 243 VAL B CG2 1 ATOM 4710 N N . LYS B 1 223 ? 7.858 1.896 25.276 1.00 86.65 ? 244 LYS B N 1 ATOM 4711 C CA . LYS B 1 223 ? 6.804 2.836 24.918 1.00 91.97 ? 244 LYS B CA 1 ATOM 4712 C C . LYS B 1 223 ? 5.506 2.499 25.647 1.00 94.33 ? 244 LYS B C 1 ATOM 4713 O O . LYS B 1 223 ? 5.173 1.329 25.834 1.00 94.98 ? 244 LYS B O 1 ATOM 4714 C CB . LYS B 1 223 ? 6.573 2.814 23.407 1.00 100.21 ? 244 LYS B CB 1 ATOM 4715 C CG . LYS B 1 223 ? 7.852 2.915 22.594 1.00 107.99 ? 244 LYS B CG 1 ATOM 4716 C CD . LYS B 1 223 ? 7.638 2.474 21.156 1.00 111.98 ? 244 LYS B CD 1 ATOM 4717 C CE . LYS B 1 223 ? 8.967 2.231 20.451 1.00 114.08 ? 244 LYS B CE 1 ATOM 4718 N NZ . LYS B 1 223 ? 8.783 1.584 19.120 1.00 114.62 ? 244 LYS B NZ 1 ATOM 4719 N N . LEU B 1 224 ? 4.777 3.530 26.057 1.00 95.79 ? 245 LEU B N 1 ATOM 4720 C CA . LEU B 1 224 ? 3.489 3.340 26.715 1.00 94.02 ? 245 LEU B CA 1 ATOM 4721 C C . LEU B 1 224 ? 2.374 4.024 25.929 1.00 91.97 ? 245 LEU B C 1 ATOM 4722 O O . LEU B 1 224 ? 2.489 5.196 25.572 1.00 92.62 ? 245 LEU B O 1 ATOM 4723 C CB . LEU B 1 224 ? 3.539 3.874 28.145 1.00 91.51 ? 245 LEU B CB 1 ATOM 4724 C CG . LEU B 1 224 ? 4.595 3.234 29.045 1.00 94.60 ? 245 LEU B CG 1 ATOM 4725 C CD1 . LEU B 1 224 ? 4.496 3.781 30.459 1.00 98.36 ? 245 LEU B CD1 1 ATOM 4726 C CD2 . LEU B 1 224 ? 4.460 1.719 29.049 1.00 95.18 ? 245 LEU B CD2 1 ATOM 4727 N N . GLU B 1 225 ? 1.299 3.286 25.662 1.00 91.31 ? 246 GLU B N 1 ATOM 4728 C CA . GLU B 1 225 ? 0.172 3.805 24.884 1.00 92.01 ? 246 GLU B CA 1 ATOM 4729 C C . GLU B 1 225 ? -1.013 4.239 25.743 1.00 90.48 ? 246 GLU B C 1 ATOM 4730 O O . GLU B 1 225 ? -1.396 3.552 26.691 1.00 88.37 ? 246 GLU B O 1 ATOM 4731 C CB . GLU B 1 225 ? -0.311 2.752 23.886 1.00 95.77 ? 246 GLU B CB 1 ATOM 4732 C CG . GLU B 1 225 ? 0.556 2.599 22.654 1.00 100.61 ? 246 GLU B CG 1 ATOM 4733 C CD . GLU B 1 225 ? 0.024 1.536 21.716 1.00 102.13 ? 246 GLU B CD 1 ATOM 4734 O OE1 . GLU B 1 225 ? -0.776 0.693 22.177 1.00 105.12 ? 246 GLU B OE1 1 ATOM 4735 O OE2 . GLU B 1 225 ? 0.403 1.540 20.526 1.00 99.24 ? 246 GLU B OE2 1 ATOM 4736 N N . CYS B 1 226 ? -1.608 5.374 25.391 1.00 92.33 ? 247 CYS B N 1 ATOM 4737 C CA . CYS B 1 226 ? -2.817 5.839 26.060 1.00 94.43 ? 247 CYS B CA 1 ATOM 4738 C C . CYS B 1 226 ? -3.555 6.868 25.208 1.00 96.27 ? 247 CYS B C 1 ATOM 4739 O O . CYS B 1 226 ? -3.019 7.934 24.907 1.00 99.71 ? 247 CYS B O 1 ATOM 4740 C CB . CYS B 1 226 ? -2.485 6.424 27.433 1.00 96.45 ? 247 CYS B CB 1 ATOM 4741 S SG . CYS B 1 226 ? -3.908 6.653 28.523 1.00 172.86 ? 247 CYS B SG 1 ATOM 4742 N N . PHE B 1 227 ? -4.784 6.538 24.821 1.00 90.61 ? 248 PHE B N 1 ATOM 4743 C CA . PHE B 1 227 ? -5.596 7.423 23.993 1.00 91.14 ? 248 PHE B CA 1 ATOM 4744 C C . PHE B 1 227 ? -7.072 7.249 24.334 1.00 92.43 ? 248 PHE B C 1 ATOM 4745 O O . PHE B 1 227 ? -7.524 6.140 24.628 1.00 93.97 ? 248 PHE B O 1 ATOM 4746 C CB . PHE B 1 227 ? -5.355 7.144 22.506 1.00 91.86 ? 248 PHE B CB 1 ATOM 4747 C CG . PHE B 1 227 ? -5.944 8.185 21.586 1.00 93.43 ? 248 PHE B CG 1 ATOM 4748 C CD1 . PHE B 1 227 ? -5.283 9.382 21.358 1.00 94.44 ? 248 PHE B CD1 1 ATOM 4749 C CD2 . PHE B 1 227 ? -7.156 7.963 20.946 1.00 91.75 ? 248 PHE B CD2 1 ATOM 4750 C CE1 . PHE B 1 227 ? -5.821 10.340 20.514 1.00 96.49 ? 248 PHE B CE1 1 ATOM 4751 C CE2 . PHE B 1 227 ? -7.699 8.916 20.101 1.00 90.05 ? 248 PHE B CE2 1 ATOM 4752 C CZ . PHE B 1 227 ? -7.032 10.106 19.884 1.00 93.77 ? 248 PHE B CZ 1 ATOM 4753 N N . ALA B 1 228 ? -7.822 8.346 24.295 1.00 90.17 ? 249 ALA B N 1 ATOM 4754 C CA . ALA B 1 228 ? -9.234 8.307 24.666 1.00 95.37 ? 249 ALA B CA 1 ATOM 4755 C C . ALA B 1 228 ? -10.153 8.922 23.610 1.00 93.08 ? 249 ALA B C 1 ATOM 4756 O O . ALA B 1 228 ? -9.713 9.661 22.730 1.00 91.58 ? 249 ALA B O 1 ATOM 4757 C CB . ALA B 1 228 ? -9.445 8.990 26.017 1.00 96.79 ? 249 ALA B CB 1 ATOM 4758 N N . LEU B 1 229 ? -11.436 8.602 23.704 1.00 93.27 ? 250 LEU B N 1 ATOM 4759 C CA . LEU B 1 229 ? -12.439 9.245 22.873 1.00 95.22 ? 250 LEU B CA 1 ATOM 4760 C C . LEU B 1 229 ? -13.066 10.382 23.669 1.00 99.38 ? 250 LEU B C 1 ATOM 4761 O O . LEU B 1 229 ? -12.697 10.614 24.822 1.00 97.14 ? 250 LEU B O 1 ATOM 4762 C CB . LEU B 1 229 ? -13.509 8.240 22.447 1.00 90.94 ? 250 LEU B CB 1 ATOM 4763 C CG . LEU B 1 229 ? -12.984 6.923 21.872 1.00 87.75 ? 250 LEU B CG 1 ATOM 4764 C CD1 . LEU B 1 229 ? -14.137 6.057 21.388 1.00 88.12 ? 250 LEU B CD1 1 ATOM 4765 C CD2 . LEU B 1 229 ? -11.992 7.185 20.747 1.00 84.24 ? 250 LEU B CD2 1 ATOM 4766 N N . GLY B 1 230 ? -14.004 11.095 23.056 1.00 101.29 ? 251 GLY B N 1 ATOM 4767 C CA . GLY B 1 230 ? -14.725 12.133 23.766 1.00 104.10 ? 251 GLY B CA 1 ATOM 4768 C C . GLY B 1 230 ? -14.838 13.450 23.029 1.00 104.47 ? 251 GLY B C 1 ATOM 4769 O O . GLY B 1 230 ? -14.087 13.722 22.094 1.00 102.89 ? 251 GLY B O 1 ATOM 4770 N N . ASN B 1 231 ? -15.790 14.266 23.466 1.00 106.48 ? 252 ASN B N 1 ATOM 4771 C CA . ASN B 1 231 ? -16.014 15.586 22.899 1.00 109.25 ? 252 ASN B CA 1 ATOM 4772 C C . ASN B 1 231 ? -16.042 16.624 24.016 1.00 113.54 ? 252 ASN B C 1 ATOM 4773 O O . ASN B 1 231 ? -16.828 16.503 24.956 1.00 114.03 ? 252 ASN B O 1 ATOM 4774 C CB . ASN B 1 231 ? -17.334 15.602 22.123 1.00 107.05 ? 252 ASN B CB 1 ATOM 4775 C CG . ASN B 1 231 ? -17.493 16.837 21.254 1.00 107.90 ? 252 ASN B CG 1 ATOM 4776 O OD1 . ASN B 1 231 ? -17.899 16.741 20.097 1.00 108.34 ? 252 ASN B OD1 1 ATOM 4777 N ND2 . ASN B 1 231 ? -17.178 18.002 21.807 1.00 108.11 ? 252 ASN B ND2 1 ATOM 4778 N N . PRO B 1 232 ? -15.178 17.648 23.926 1.00 115.27 ? 253 PRO B N 1 ATOM 4779 C CA . PRO B 1 232 ? -14.198 17.871 22.856 1.00 115.66 ? 253 PRO B CA 1 ATOM 4780 C C . PRO B 1 232 ? -13.064 16.849 22.867 1.00 116.52 ? 253 PRO B C 1 ATOM 4781 O O . PRO B 1 232 ? -13.018 15.980 23.738 1.00 119.03 ? 253 PRO B O 1 ATOM 4782 C CB . PRO B 1 232 ? -13.639 19.263 23.178 1.00 116.21 ? 253 PRO B CB 1 ATOM 4783 C CG . PRO B 1 232 ? -14.648 19.893 24.081 1.00 117.97 ? 253 PRO B CG 1 ATOM 4784 C CD . PRO B 1 232 ? -15.203 18.766 24.883 1.00 117.07 ? 253 PRO B CD 1 ATOM 4785 N N . VAL B 1 233 ? -12.158 16.968 21.901 1.00 113.83 ? 254 VAL B N 1 ATOM 4786 C CA . VAL B 1 233 ? -11.029 16.052 21.780 1.00 110.94 ? 254 VAL B CA 1 ATOM 4787 C C . VAL B 1 233 ? -10.144 16.112 23.023 1.00 111.33 ? 254 VAL B C 1 ATOM 4788 O O . VAL B 1 233 ? -9.570 17.157 23.332 1.00 112.34 ? 254 VAL B O 1 ATOM 4789 C CB . VAL B 1 233 ? -10.178 16.368 20.533 1.00 108.58 ? 254 VAL B CB 1 ATOM 4790 C CG1 . VAL B 1 233 ? -9.150 15.273 20.300 1.00 105.54 ? 254 VAL B CG1 1 ATOM 4791 C CG2 . VAL B 1 233 ? -11.065 16.538 19.309 1.00 107.42 ? 254 VAL B CG2 1 ATOM 4792 N N . PRO B 1 234 ? -10.030 14.984 23.737 1.00 110.41 ? 255 PRO B N 1 ATOM 4793 C CA . PRO B 1 234 ? -9.288 14.908 25.002 1.00 112.52 ? 255 PRO B CA 1 ATOM 4794 C C . PRO B 1 234 ? -7.786 15.133 24.833 1.00 113.69 ? 255 PRO B C 1 ATOM 4795 O O . PRO B 1 234 ? -7.216 14.777 23.802 1.00 114.99 ? 255 PRO B O 1 ATOM 4796 C CB . PRO B 1 234 ? -9.549 13.471 25.478 1.00 109.50 ? 255 PRO B CB 1 ATOM 4797 C CG . PRO B 1 234 ? -10.739 13.004 24.700 1.00 109.41 ? 255 PRO B CG 1 ATOM 4798 C CD . PRO B 1 234 ? -10.650 13.698 23.383 1.00 108.65 ? 255 PRO B CD 1 ATOM 4799 N N . THR B 1 235 ? -7.158 15.726 25.844 1.00 112.09 ? 256 THR B N 1 ATOM 4800 C CA . THR B 1 235 ? -5.706 15.850 25.869 1.00 110.70 ? 256 THR B CA 1 ATOM 4801 C C . THR B 1 235 ? -5.120 14.773 26.769 1.00 108.29 ? 256 THR B C 1 ATOM 4802 O O . THR B 1 235 ? -5.789 14.282 27.679 1.00 108.79 ? 256 THR B O 1 ATOM 4803 C CB . THR B 1 235 ? -5.248 17.228 26.376 1.00 111.47 ? 256 THR B CB 1 ATOM 4804 O OG1 . THR B 1 235 ? -5.920 17.534 27.605 1.00 112.94 ? 256 THR B OG1 1 ATOM 4805 C CG2 . THR B 1 235 ? -5.550 18.306 25.346 1.00 111.80 ? 256 THR B CG2 1 ATOM 4806 N N . ILE B 1 236 ? -3.868 14.412 26.511 1.00 104.78 ? 257 ILE B N 1 ATOM 4807 C CA . ILE B 1 236 ? -3.203 13.365 27.274 1.00 101.31 ? 257 ILE B CA 1 ATOM 4808 C C . ILE B 1 236 ? -2.064 13.931 28.121 1.00 101.65 ? 257 ILE B C 1 ATOM 4809 O O . ILE B 1 236 ? -1.292 14.772 27.661 1.00 97.76 ? 257 ILE B O 1 ATOM 4810 C CB . ILE B 1 236 ? -2.653 12.264 26.347 1.00 95.05 ? 257 ILE B CB 1 ATOM 4811 C CG1 . ILE B 1 236 ? -3.652 11.958 25.229 1.00 91.56 ? 257 ILE B CG1 1 ATOM 4812 C CG2 . ILE B 1 236 ? -2.343 11.008 27.138 1.00 93.21 ? 257 ILE B CG2 1 ATOM 4813 C CD1 . ILE B 1 236 ? -4.954 11.366 25.718 1.00 91.38 ? 257 ILE B CD1 1 ATOM 4814 N N . LEU B 1 237 ? -1.974 13.467 29.364 1.00 105.91 ? 258 LEU B N 1 ATOM 4815 C CA . LEU B 1 237 ? -0.912 13.874 30.277 1.00 106.74 ? 258 LEU B CA 1 ATOM 4816 C C . LEU B 1 237 ? -0.284 12.641 30.922 1.00 104.90 ? 258 LEU B C 1 ATOM 4817 O O . LEU B 1 237 ? -0.950 11.620 31.100 1.00 103.05 ? 258 LEU B O 1 ATOM 4818 C CB . LEU B 1 237 ? -1.465 14.809 31.356 1.00 111.72 ? 258 LEU B CB 1 ATOM 4819 C CG . LEU B 1 237 ? -0.495 15.263 32.454 1.00 114.69 ? 258 LEU B CG 1 ATOM 4820 C CD1 . LEU B 1 237 ? 0.526 16.244 31.901 1.00 114.79 ? 258 LEU B CD1 1 ATOM 4821 C CD2 . LEU B 1 237 ? -1.247 15.877 33.628 1.00 116.59 ? 258 LEU B CD2 1 ATOM 4822 N N . TRP B 1 238 ? 0.995 12.736 31.273 1.00 105.12 ? 259 TRP B N 1 ATOM 4823 C CA . TRP B 1 238 ? 1.707 11.610 31.871 1.00 103.64 ? 259 TRP B CA 1 ATOM 4824 C C . TRP B 1 238 ? 2.317 11.966 33.227 1.00 106.16 ? 259 TRP B C 1 ATOM 4825 O O . TRP B 1 238 ? 3.066 12.936 33.347 1.00 104.98 ? 259 TRP B O 1 ATOM 4826 C CB . TRP B 1 238 ? 2.802 11.104 30.926 1.00 100.66 ? 259 TRP B CB 1 ATOM 4827 C CG . TRP B 1 238 ? 2.292 10.627 29.596 1.00 96.20 ? 259 TRP B CG 1 ATOM 4828 C CD1 . TRP B 1 238 ? 2.116 11.377 28.470 1.00 94.21 ? 259 TRP B CD1 1 ATOM 4829 C CD2 . TRP B 1 238 ? 1.900 9.290 29.253 1.00 91.28 ? 259 TRP B CD2 1 ATOM 4830 N NE1 . TRP B 1 238 ? 1.638 10.592 27.449 1.00 92.24 ? 259 TRP B NE1 1 ATOM 4831 C CE2 . TRP B 1 238 ? 1.495 9.308 27.904 1.00 90.58 ? 259 TRP B CE2 1 ATOM 4832 C CE3 . TRP B 1 238 ? 1.849 8.084 29.957 1.00 88.34 ? 259 TRP B CE3 1 ATOM 4833 C CZ2 . TRP B 1 238 ? 1.046 8.165 27.244 1.00 87.48 ? 259 TRP B CZ2 1 ATOM 4834 C CZ3 . TRP B 1 238 ? 1.401 6.950 29.300 1.00 86.94 ? 259 TRP B CZ3 1 ATOM 4835 C CH2 . TRP B 1 238 ? 1.007 6.999 27.958 1.00 86.64 ? 259 TRP B CH2 1 ATOM 4836 N N . ARG B 1 239 ? 1.997 11.169 34.243 1.00 109.19 ? 260 ARG B N 1 ATOM 4837 C CA . ARG B 1 239 ? 2.542 11.376 35.581 1.00 111.77 ? 260 ARG B CA 1 ATOM 4838 C C . ARG B 1 239 ? 3.120 10.087 36.144 1.00 111.90 ? 260 ARG B C 1 ATOM 4839 O O . ARG B 1 239 ? 2.897 9.001 35.608 1.00 110.30 ? 260 ARG B O 1 ATOM 4840 C CB . ARG B 1 239 ? 1.460 11.876 36.543 1.00 111.79 ? 260 ARG B CB 1 ATOM 4841 C CG . ARG B 1 239 ? 0.638 13.046 36.048 1.00 113.68 ? 260 ARG B CG 1 ATOM 4842 C CD . ARG B 1 239 ? -0.489 13.351 37.025 1.00 114.80 ? 260 ARG B CD 1 ATOM 4843 N NE . ARG B 1 239 ? -1.105 12.130 37.539 1.00 111.82 ? 260 ARG B NE 1 ATOM 4844 C CZ . ARG B 1 239 ? -2.286 12.085 38.148 1.00 108.18 ? 260 ARG B CZ 1 ATOM 4845 N NH1 . ARG B 1 239 ? -2.992 13.194 38.316 1.00 102.16 ? 260 ARG B NH1 1 ATOM 4846 N NH2 . ARG B 1 239 ? -2.767 10.927 38.582 1.00 108.62 ? 260 ARG B NH2 1 ATOM 4847 N N . ARG B 1 240 ? 3.860 10.222 37.239 1.00 113.70 ? 261 ARG B N 1 ATOM 4848 C CA . ARG B 1 240 ? 4.282 9.076 38.030 1.00 114.29 ? 261 ARG B CA 1 ATOM 4849 C C . ARG B 1 240 ? 3.488 9.095 39.331 1.00 116.37 ? 261 ARG B C 1 ATOM 4850 O O . ARG B 1 240 ? 3.524 10.080 40.072 1.00 114.03 ? 261 ARG B O 1 ATOM 4851 C CB . ARG B 1 240 ? 5.783 9.138 38.306 1.00 112.98 ? 261 ARG B CB 1 ATOM 4852 C CG . ARG B 1 240 ? 6.623 9.303 37.049 1.00 112.35 ? 261 ARG B CG 1 ATOM 4853 C CD . ARG B 1 240 ? 8.114 9.261 37.349 1.00 114.83 ? 261 ARG B CD 1 ATOM 4854 N NE . ARG B 1 240 ? 8.483 8.086 38.133 1.00 115.47 ? 261 ARG B NE 1 ATOM 4855 C CZ . ARG B 1 240 ? 9.672 7.497 38.080 1.00 115.28 ? 261 ARG B CZ 1 ATOM 4856 N NH1 . ARG B 1 240 ? 10.610 7.963 37.266 1.00 112.51 ? 261 ARG B NH1 1 ATOM 4857 N NH2 . ARG B 1 240 ? 9.919 6.433 38.831 1.00 117.92 ? 261 ARG B NH2 1 ATOM 4858 N N . ALA B 1 241 ? 2.761 8.013 39.597 1.00 121.05 ? 262 ALA B N 1 ATOM 4859 C CA . ALA B 1 241 ? 1.837 7.959 40.730 1.00 127.33 ? 262 ALA B CA 1 ATOM 4860 C C . ALA B 1 241 ? 2.530 8.119 42.083 1.00 132.46 ? 262 ALA B C 1 ATOM 4861 O O . ALA B 1 241 ? 1.897 7.995 43.131 1.00 135.70 ? 262 ALA B O 1 ATOM 4862 C CB . ALA B 1 241 ? 1.019 6.671 40.694 1.00 127.49 ? 262 ALA B CB 1 ATOM 4863 N N . ASP B 1 242 ? 3.830 8.394 42.054 1.00 132.17 ? 263 ASP B N 1 ATOM 4864 C CA . ASP B 1 242 ? 4.584 8.648 43.274 1.00 134.20 ? 263 ASP B CA 1 ATOM 4865 C C . ASP B 1 242 ? 5.155 10.066 43.295 1.00 131.12 ? 263 ASP B C 1 ATOM 4866 O O . ASP B 1 242 ? 6.135 10.342 43.986 1.00 130.97 ? 263 ASP B O 1 ATOM 4867 C CB . ASP B 1 242 ? 5.689 7.601 43.467 1.00 138.58 ? 263 ASP B CB 1 ATOM 4868 C CG . ASP B 1 242 ? 6.398 7.245 42.171 1.00 141.54 ? 263 ASP B CG 1 ATOM 4869 O OD1 . ASP B 1 242 ? 6.628 8.153 41.345 1.00 144.30 ? 263 ASP B OD1 1 ATOM 4870 O OD2 . ASP B 1 242 ? 6.731 6.055 41.981 1.00 140.06 ? 263 ASP B OD2 1 ATOM 4871 N N . GLY B 1 243 ? 4.534 10.958 42.527 1.00 127.82 ? 264 GLY B N 1 ATOM 4872 C CA . GLY B 1 243 ? 4.882 12.369 42.546 1.00 127.57 ? 264 GLY B CA 1 ATOM 4873 C C . GLY B 1 243 ? 6.177 12.750 41.850 1.00 126.16 ? 264 GLY B C 1 ATOM 4874 O O . GLY B 1 243 ? 6.337 13.891 41.415 1.00 123.65 ? 264 GLY B O 1 ATOM 4875 N N . LYS B 1 244 ? 7.103 11.802 41.747 1.00 127.83 ? 265 LYS B N 1 ATOM 4876 C CA . LYS B 1 244 ? 8.400 12.061 41.127 1.00 131.36 ? 265 LYS B CA 1 ATOM 4877 C C . LYS B 1 244 ? 8.256 12.637 39.724 1.00 131.78 ? 265 LYS B C 1 ATOM 4878 O O . LYS B 1 244 ? 7.387 12.216 38.961 1.00 132.04 ? 265 LYS B O 1 ATOM 4879 C CB . LYS B 1 244 ? 9.236 10.780 41.068 1.00 134.04 ? 265 LYS B CB 1 ATOM 4880 C CG . LYS B 1 244 ? 9.606 10.209 42.426 1.00 138.48 ? 265 LYS B CG 1 ATOM 4881 C CD . LYS B 1 244 ? 10.523 9.004 42.276 1.00 138.85 ? 265 LYS B CD 1 ATOM 4882 C CE . LYS B 1 244 ? 10.898 8.417 43.626 1.00 138.15 ? 265 LYS B CE 1 ATOM 4883 N NZ . LYS B 1 244 ? 11.798 7.242 43.472 1.00 137.09 ? 265 LYS B NZ 1 ATOM 4884 N N . PRO B 1 245 ? 9.110 13.611 39.380 1.00 132.32 ? 266 PRO B N 1 ATOM 4885 C CA . PRO B 1 245 ? 9.136 14.194 38.035 1.00 131.17 ? 266 PRO B CA 1 ATOM 4886 C C . PRO B 1 245 ? 9.538 13.151 36.999 1.00 130.72 ? 266 PRO B C 1 ATOM 4887 O O . PRO B 1 245 ? 10.222 12.187 37.340 1.00 128.84 ? 266 PRO B O 1 ATOM 4888 C CB . PRO B 1 245 ? 10.222 15.270 38.140 1.00 132.36 ? 266 PRO B CB 1 ATOM 4889 C CG . PRO B 1 245 ? 10.331 15.569 39.599 1.00 134.69 ? 266 PRO B CG 1 ATOM 4890 C CD . PRO B 1 245 ? 10.063 14.270 40.288 1.00 133.98 ? 266 PRO B CD 1 ATOM 4891 N N . ILE B 1 246 ? 9.119 13.345 35.753 1.00 132.69 ? 267 ILE B N 1 ATOM 4892 C CA . ILE B 1 246 ? 9.411 12.390 34.690 1.00 132.67 ? 267 ILE B CA 1 ATOM 4893 C C . ILE B 1 246 ? 10.901 12.415 34.362 1.00 135.03 ? 267 ILE B C 1 ATOM 4894 O O . ILE B 1 246 ? 11.581 13.407 34.621 1.00 136.73 ? 267 ILE B O 1 ATOM 4895 C CB . ILE B 1 246 ? 8.582 12.680 33.419 1.00 132.53 ? 267 ILE B CB 1 ATOM 4896 C CG1 . ILE B 1 246 ? 7.940 11.394 32.889 1.00 130.20 ? 267 ILE B CG1 1 ATOM 4897 C CG2 . ILE B 1 246 ? 9.429 13.381 32.360 1.00 131.87 ? 267 ILE B CG2 1 ATOM 4898 C CD1 . ILE B 1 246 ? 6.858 10.837 33.795 1.00 129.29 ? 267 ILE B CD1 1 ATOM 4899 N N . ALA B 1 247 ? 11.399 11.321 33.791 1.00 136.57 ? 268 ALA B N 1 ATOM 4900 C CA . ALA B 1 247 ? 12.832 11.148 33.543 1.00 137.51 ? 268 ALA B CA 1 ATOM 4901 C C . ALA B 1 247 ? 13.471 12.275 32.729 1.00 137.54 ? 268 ALA B C 1 ATOM 4902 O O . ALA B 1 247 ? 14.676 12.504 32.826 1.00 139.77 ? 268 ALA B O 1 ATOM 4903 C CB . ALA B 1 247 ? 13.095 9.801 32.878 1.00 136.48 ? 268 ALA B CB 1 ATOM 4904 N N . ARG B 1 248 ? 12.662 12.960 31.925 1.00 134.55 ? 269 ARG B N 1 ATOM 4905 C CA . ARG B 1 248 ? 13.127 14.082 31.108 1.00 131.99 ? 269 ARG B CA 1 ATOM 4906 C C . ARG B 1 248 ? 13.791 13.616 29.814 1.00 126.72 ? 269 ARG B C 1 ATOM 4907 O O . ARG B 1 248 ? 13.726 14.304 28.794 1.00 125.39 ? 269 ARG B O 1 ATOM 4908 C CB . ARG B 1 248 ? 14.052 15.008 31.907 1.00 135.37 ? 269 ARG B CB 1 ATOM 4909 C CG . ARG B 1 248 ? 14.372 16.332 31.224 1.00 137.80 ? 269 ARG B CG 1 ATOM 4910 C CD . ARG B 1 248 ? 15.688 16.275 30.457 1.00 137.74 ? 269 ARG B CD 1 ATOM 4911 N NE . ARG B 1 248 ? 16.067 17.582 29.923 1.00 137.61 ? 269 ARG B NE 1 ATOM 4912 C CZ . ARG B 1 248 ? 16.703 18.522 30.617 1.00 138.71 ? 269 ARG B CZ 1 ATOM 4913 N NH1 . ARG B 1 248 ? 17.037 18.309 31.884 1.00 138.76 ? 269 ARG B NH1 1 ATOM 4914 N NH2 . ARG B 1 248 ? 17.005 19.680 30.045 1.00 138.49 ? 269 ARG B NH2 1 ATOM 4915 N N . LYS B 1 249 ? 14.431 12.451 29.855 1.00 123.35 ? 270 LYS B N 1 ATOM 4916 C CA . LYS B 1 249 ? 14.878 11.804 28.628 1.00 120.02 ? 270 LYS B CA 1 ATOM 4917 C C . LYS B 1 249 ? 13.658 11.188 27.956 1.00 121.09 ? 270 LYS B C 1 ATOM 4918 O O . LYS B 1 249 ? 13.679 10.865 26.767 1.00 119.74 ? 270 LYS B O 1 ATOM 4919 C CB . LYS B 1 249 ? 15.932 10.733 28.913 1.00 115.57 ? 270 LYS B CB 1 ATOM 4920 C CG . LYS B 1 249 ? 15.531 9.714 29.968 1.00 113.51 ? 270 LYS B CG 1 ATOM 4921 C CD . LYS B 1 249 ? 16.401 8.467 29.883 1.00 110.22 ? 270 LYS B CD 1 ATOM 4922 C CE . LYS B 1 249 ? 16.265 7.607 31.127 1.00 109.92 ? 270 LYS B CE 1 ATOM 4923 N NZ . LYS B 1 249 ? 16.903 8.253 32.310 1.00 112.44 ? 270 LYS B NZ 1 ATOM 4924 N N . ALA B 1 250 ? 12.594 11.032 28.739 1.00 122.03 ? 271 ALA B N 1 ATOM 4925 C CA . ALA B 1 250 ? 11.321 10.543 28.233 1.00 119.60 ? 271 ALA B CA 1 ATOM 4926 C C . ALA B 1 250 ? 10.765 11.537 27.229 1.00 123.23 ? 271 ALA B C 1 ATOM 4927 O O . ALA B 1 250 ? 10.766 12.743 27.476 1.00 123.35 ? 271 ALA B O 1 ATOM 4928 C CB . ALA B 1 250 ? 10.341 10.338 29.371 1.00 116.56 ? 271 ALA B CB 1 ATOM 4929 N N . ARG B 1 251 ? 10.286 11.023 26.101 1.00 127.21 ? 272 ARG B N 1 ATOM 4930 C CA . ARG B 1 251 ? 9.823 11.865 25.006 1.00 132.02 ? 272 ARG B CA 1 ATOM 4931 C C . ARG B 1 251 ? 8.304 11.835 24.847 1.00 132.35 ? 272 ARG B C 1 ATOM 4932 O O . ARG B 1 251 ? 7.612 11.038 25.482 1.00 131.66 ? 272 ARG B O 1 ATOM 4933 C CB . ARG B 1 251 ? 10.476 11.422 23.697 1.00 134.40 ? 272 ARG B CB 1 ATOM 4934 C CG . ARG B 1 251 ? 11.898 10.911 23.850 1.00 138.03 ? 272 ARG B CG 1 ATOM 4935 C CD . ARG B 1 251 ? 12.345 10.191 22.590 1.00 141.03 ? 272 ARG B CD 1 ATOM 4936 N NE . ARG B 1 251 ? 13.669 9.595 22.735 1.00 144.81 ? 272 ARG B NE 1 ATOM 4937 C CZ . ARG B 1 251 ? 14.300 8.941 21.765 1.00 146.28 ? 272 ARG B CZ 1 ATOM 4938 N NH1 . ARG B 1 251 ? 13.725 8.800 20.577 1.00 146.34 ? 272 ARG B NH1 1 ATOM 4939 N NH2 . ARG B 1 251 ? 15.505 8.430 21.981 1.00 145.55 ? 272 ARG B NH2 1 ATOM 4940 N N . ARG B 1 252 ? 7.797 12.713 23.987 1.00 132.26 ? 273 ARG B N 1 ATOM 4941 C CA . ARG B 1 252 ? 6.382 12.741 23.640 1.00 130.63 ? 273 ARG B CA 1 ATOM 4942 C C . ARG B 1 252 ? 6.201 12.822 22.124 1.00 128.96 ? 273 ARG B C 1 ATOM 4943 O O . ARG B 1 252 ? 6.633 13.785 21.490 1.00 126.28 ? 273 ARG B O 1 ATOM 4944 C CB . ARG B 1 252 ? 5.682 13.929 24.308 1.00 130.10 ? 273 ARG B CB 1 ATOM 4945 C CG . ARG B 1 252 ? 5.247 13.694 25.747 1.00 131.03 ? 273 ARG B CG 1 ATOM 4946 C CD . ARG B 1 252 ? 6.369 13.960 26.742 1.00 133.23 ? 273 ARG B CD 1 ATOM 4947 N NE . ARG B 1 252 ? 5.865 14.019 28.113 1.00 135.72 ? 273 ARG B NE 1 ATOM 4948 C CZ . ARG B 1 252 ? 6.630 14.158 29.192 1.00 135.30 ? 273 ARG B CZ 1 ATOM 4949 N NH1 . ARG B 1 252 ? 7.948 14.252 29.070 1.00 134.78 ? 273 ARG B NH1 1 ATOM 4950 N NH2 . ARG B 1 252 ? 6.075 14.200 30.398 1.00 133.42 ? 273 ARG B NH2 1 ATOM 4951 N N . HIS B 1 253 ? 5.570 11.806 21.543 1.00 130.97 ? 274 HIS B N 1 ATOM 4952 C CA . HIS B 1 253 ? 5.206 11.854 20.130 1.00 134.78 ? 274 HIS B CA 1 ATOM 4953 C C . HIS B 1 253 ? 3.778 11.341 19.916 1.00 132.30 ? 274 HIS B C 1 ATOM 4954 O O . HIS B 1 253 ? 3.095 10.966 20.872 1.00 127.69 ? 274 HIS B O 1 ATOM 4955 C CB . HIS B 1 253 ? 6.203 11.068 19.271 1.00 138.42 ? 274 HIS B CB 1 ATOM 4956 C CG . HIS B 1 253 ? 6.312 11.568 17.861 1.00 143.08 ? 274 HIS B CG 1 ATOM 4957 N ND1 . HIS B 1 253 ? 5.245 11.581 16.987 1.00 144.27 ? 274 HIS B ND1 1 ATOM 4958 C CD2 . HIS B 1 253 ? 7.365 12.068 17.172 1.00 143.88 ? 274 HIS B CD2 1 ATOM 4959 C CE1 . HIS B 1 253 ? 5.634 12.073 15.825 1.00 143.31 ? 274 HIS B CE1 1 ATOM 4960 N NE2 . HIS B 1 253 ? 6.917 12.375 15.910 1.00 143.06 ? 274 HIS B NE2 1 ATOM 4961 N N . LYS B 1 254 ? 3.338 11.329 18.660 1.00 134.38 ? 275 LYS B N 1 ATOM 4962 C CA . LYS B 1 254 ? 1.979 10.924 18.311 1.00 135.25 ? 275 LYS B CA 1 ATOM 4963 C C . LYS B 1 254 ? 0.973 11.786 19.067 1.00 136.84 ? 275 LYS B C 1 ATOM 4964 O O . LYS B 1 254 ? 0.028 11.273 19.667 1.00 138.38 ? 275 LYS B O 1 ATOM 4965 C CB . LYS B 1 254 ? 1.753 9.443 18.627 1.00 134.80 ? 275 LYS B CB 1 ATOM 4966 C CG . LYS B 1 254 ? 2.722 8.487 17.939 1.00 134.25 ? 275 LYS B CG 1 ATOM 4967 C CD . LYS B 1 254 ? 2.200 8.021 16.589 1.00 134.89 ? 275 LYS B CD 1 ATOM 4968 C CE . LYS B 1 254 ? 3.002 6.831 16.075 1.00 134.24 ? 275 LYS B CE 1 ATOM 4969 N NZ . LYS B 1 254 ? 2.325 6.139 14.941 1.00 133.74 ? 275 LYS B NZ 1 ATOM 4970 N N . SER B 1 255 ? 1.192 13.099 19.033 1.00 135.43 ? 276 SER B N 1 ATOM 4971 C CA . SER B 1 255 ? 0.368 14.057 19.768 1.00 132.74 ? 276 SER B CA 1 ATOM 4972 C C . SER B 1 255 ? 0.203 13.660 21.234 1.00 130.95 ? 276 SER B C 1 ATOM 4973 O O . SER B 1 255 ? -0.907 13.655 21.768 1.00 130.33 ? 276 SER B O 1 ATOM 4974 C CB . SER B 1 255 ? -0.996 14.245 19.096 1.00 132.28 ? 276 SER B CB 1 ATOM 4975 O OG . SER B 1 255 ? -1.718 13.028 19.033 1.00 132.00 ? 276 SER B OG 1 ATOM 4976 N N . ASN B 1 256 ? 1.323 13.331 21.872 1.00 129.19 ? 277 ASN B N 1 ATOM 4977 C CA . ASN B 1 256 ? 1.341 12.939 23.279 1.00 125.63 ? 277 ASN B CA 1 ATOM 4978 C C . ASN B 1 256 ? 0.430 11.760 23.608 1.00 118.95 ? 277 ASN B C 1 ATOM 4979 O O . ASN B 1 256 ? -0.020 11.612 24.743 1.00 118.52 ? 277 ASN B O 1 ATOM 4980 C CB . ASN B 1 256 ? 1.023 14.132 24.185 1.00 129.83 ? 277 ASN B CB 1 ATOM 4981 C CG . ASN B 1 256 ? 2.201 15.072 24.341 1.00 132.14 ? 277 ASN B CG 1 ATOM 4982 O OD1 . ASN B 1 256 ? 2.524 15.505 25.449 1.00 135.31 ? 277 ASN B OD1 1 ATOM 4983 N ND2 . ASN B 1 256 ? 2.861 15.383 23.229 1.00 128.95 ? 277 ASN B ND2 1 ATOM 4984 N N . GLY B 1 257 ? 0.161 10.925 22.610 1.00 114.41 ? 278 GLY B N 1 ATOM 4985 C CA . GLY B 1 257 ? -0.600 9.709 22.825 1.00 109.55 ? 278 GLY B CA 1 ATOM 4986 C C . GLY B 1 257 ? 0.322 8.576 23.229 1.00 105.94 ? 278 GLY B C 1 ATOM 4987 O O . GLY B 1 257 ? -0.124 7.524 23.693 1.00 103.98 ? 278 GLY B O 1 ATOM 4988 N N . ILE B 1 258 ? 1.621 8.797 23.048 1.00 101.96 ? 279 ILE B N 1 ATOM 4989 C CA . ILE B 1 258 ? 2.626 7.800 23.391 1.00 100.62 ? 279 ILE B CA 1 ATOM 4990 C C . ILE B 1 258 ? 3.769 8.392 24.213 1.00 99.45 ? 279 ILE B C 1 ATOM 4991 O O . ILE B 1 258 ? 4.238 9.498 23.944 1.00 100.20 ? 279 ILE B O 1 ATOM 4992 C CB . ILE B 1 258 ? 3.209 7.120 22.135 1.00 98.00 ? 279 ILE B CB 1 ATOM 4993 C CG1 . ILE B 1 258 ? 2.165 6.220 21.480 1.00 96.67 ? 279 ILE B CG1 1 ATOM 4994 C CG2 . ILE B 1 258 ? 4.442 6.306 22.497 1.00 100.14 ? 279 ILE B CG2 1 ATOM 4995 C CD1 . ILE B 1 258 ? 2.746 5.237 20.486 1.00 99.11 ? 279 ILE B CD1 1 ATOM 4996 N N . LEU B 1 259 ? 4.203 7.646 25.222 1.00 96.14 ? 280 LEU B N 1 ATOM 4997 C CA . LEU B 1 259 ? 5.344 8.039 26.034 1.00 93.99 ? 280 LEU B CA 1 ATOM 4998 C C . LEU B 1 259 ? 6.491 7.079 25.767 1.00 93.33 ? 280 LEU B C 1 ATOM 4999 O O . LEU B 1 259 ? 6.325 5.865 25.879 1.00 90.26 ? 280 LEU B O 1 ATOM 5000 C CB . LEU B 1 259 ? 4.979 8.015 27.519 1.00 93.21 ? 280 LEU B CB 1 ATOM 5001 C CG . LEU B 1 259 ? 6.061 8.471 28.504 1.00 89.82 ? 280 LEU B CG 1 ATOM 5002 C CD1 . LEU B 1 259 ? 6.278 9.974 28.405 1.00 90.23 ? 280 LEU B CD1 1 ATOM 5003 C CD2 . LEU B 1 259 ? 5.697 8.075 29.927 1.00 85.91 ? 280 LEU B CD2 1 ATOM 5004 N N . GLU B 1 260 ? 7.650 7.620 25.402 1.00 98.20 ? 281 GLU B N 1 ATOM 5005 C CA . GLU B 1 260 ? 8.830 6.795 25.162 1.00 103.13 ? 281 GLU B CA 1 ATOM 5006 C C . GLU B 1 260 ? 9.887 6.991 26.241 1.00 103.98 ? 281 GLU B C 1 ATOM 5007 O O . GLU B 1 260 ? 10.136 8.112 26.685 1.00 106.79 ? 281 GLU B O 1 ATOM 5008 C CB . GLU B 1 260 ? 9.430 7.081 23.784 1.00 108.92 ? 281 GLU B CB 1 ATOM 5009 C CG . GLU B 1 260 ? 8.679 6.434 22.633 1.00 116.50 ? 281 GLU B CG 1 ATOM 5010 C CD . GLU B 1 260 ? 9.456 6.478 21.331 1.00 122.64 ? 281 GLU B CD 1 ATOM 5011 O OE1 . GLU B 1 260 ? 10.650 6.850 21.359 1.00 124.35 ? 281 GLU B OE1 1 ATOM 5012 O OE2 . GLU B 1 260 ? 8.874 6.137 20.279 1.00 124.38 ? 281 GLU B OE2 1 ATOM 5013 N N . ILE B 1 261 ? 10.506 5.890 26.655 1.00 100.62 ? 282 ILE B N 1 ATOM 5014 C CA . ILE B 1 261 ? 11.561 5.919 27.660 1.00 94.21 ? 282 ILE B CA 1 ATOM 5015 C C . ILE B 1 261 ? 12.820 5.235 27.136 1.00 98.02 ? 282 ILE B C 1 ATOM 5016 O O . ILE B 1 261 ? 12.895 4.008 27.102 1.00 96.56 ? 282 ILE B O 1 ATOM 5017 C CB . ILE B 1 261 ? 11.121 5.213 28.955 1.00 86.07 ? 282 ILE B CB 1 ATOM 5018 C CG1 . ILE B 1 261 ? 9.872 5.878 29.528 1.00 82.71 ? 282 ILE B CG1 1 ATOM 5019 C CG2 . ILE B 1 261 ? 12.248 5.221 29.979 1.00 85.93 ? 282 ILE B CG2 1 ATOM 5020 C CD1 . ILE B 1 261 ? 9.083 4.984 30.455 1.00 83.61 ? 282 ILE B CD1 1 ATOM 5021 N N . PRO B 1 262 ? 13.811 6.032 26.712 1.00 102.93 ? 283 PRO B N 1 ATOM 5022 C CA . PRO B 1 262 ? 15.080 5.489 26.216 1.00 104.83 ? 283 PRO B CA 1 ATOM 5023 C C . PRO B 1 262 ? 15.975 4.987 27.347 1.00 106.93 ? 283 PRO B C 1 ATOM 5024 O O . PRO B 1 262 ? 15.940 5.539 28.448 1.00 107.51 ? 283 PRO B O 1 ATOM 5025 C CB . PRO B 1 262 ? 15.737 6.698 25.536 1.00 105.63 ? 283 PRO B CB 1 ATOM 5026 C CG . PRO B 1 262 ? 14.642 7.712 25.367 1.00 105.84 ? 283 PRO B CG 1 ATOM 5027 C CD . PRO B 1 262 ? 13.721 7.487 26.515 1.00 105.59 ? 283 PRO B CD 1 ATOM 5028 N N . ASN B 1 263 ? 16.762 3.950 27.071 1.00 107.93 ? 284 ASN B N 1 ATOM 5029 C CA . ASN B 1 263 ? 17.775 3.470 28.007 1.00 109.08 ? 284 ASN B CA 1 ATOM 5030 C C . ASN B 1 263 ? 17.231 3.277 29.422 1.00 108.71 ? 284 ASN B C 1 ATOM 5031 O O . ASN B 1 263 ? 17.541 4.051 30.328 1.00 110.83 ? 284 ASN B O 1 ATOM 5032 C CB . ASN B 1 263 ? 18.962 4.436 28.026 1.00 110.33 ? 284 ASN B CB 1 ATOM 5033 C CG . ASN B 1 263 ? 20.083 3.964 28.927 1.00 113.33 ? 284 ASN B CG 1 ATOM 5034 O OD1 . ASN B 1 263 ? 20.547 2.830 28.814 1.00 116.11 ? 284 ASN B OD1 1 ATOM 5035 N ND2 . ASN B 1 263 ? 20.528 4.836 29.825 1.00 113.92 ? 284 ASN B ND2 1 ATOM 5036 N N . PHE B 1 264 ? 16.426 2.236 29.604 1.00 104.50 ? 285 PHE B N 1 ATOM 5037 C CA . PHE B 1 264 ? 15.725 2.014 30.866 1.00 100.94 ? 285 PHE B CA 1 ATOM 5038 C C . PHE B 1 264 ? 16.666 1.674 32.025 1.00 99.19 ? 285 PHE B C 1 ATOM 5039 O O . PHE B 1 264 ? 17.558 0.839 31.889 1.00 98.51 ? 285 PHE B O 1 ATOM 5040 C CB . PHE B 1 264 ? 14.666 0.920 30.702 1.00 97.31 ? 285 PHE B CB 1 ATOM 5041 C CG . PHE B 1 264 ? 13.502 1.066 31.637 1.00 96.29 ? 285 PHE B CG 1 ATOM 5042 C CD1 . PHE B 1 264 ? 12.493 1.972 31.365 1.00 97.24 ? 285 PHE B CD1 1 ATOM 5043 C CD2 . PHE B 1 264 ? 13.418 0.303 32.788 1.00 98.90 ? 285 PHE B CD2 1 ATOM 5044 C CE1 . PHE B 1 264 ? 11.421 2.114 32.221 1.00 99.65 ? 285 PHE B CE1 1 ATOM 5045 C CE2 . PHE B 1 264 ? 12.347 0.442 33.651 1.00 102.13 ? 285 PHE B CE2 1 ATOM 5046 C CZ . PHE B 1 264 ? 11.347 1.349 33.367 1.00 101.97 ? 285 PHE B CZ 1 ATOM 5047 N N . GLN B 1 265 ? 16.457 2.327 33.165 1.00 98.60 ? 286 GLN B N 1 ATOM 5048 C CA . GLN B 1 265 ? 17.253 2.069 34.361 1.00 102.75 ? 286 GLN B CA 1 ATOM 5049 C C . GLN B 1 265 ? 16.355 1.775 35.559 1.00 105.76 ? 286 GLN B C 1 ATOM 5050 O O . GLN B 1 265 ? 15.166 2.086 35.541 1.00 106.39 ? 286 GLN B O 1 ATOM 5051 C CB . GLN B 1 265 ? 18.165 3.259 34.668 1.00 104.38 ? 286 GLN B CB 1 ATOM 5052 C CG . GLN B 1 265 ? 19.025 3.703 33.495 1.00 105.27 ? 286 GLN B CG 1 ATOM 5053 C CD . GLN B 1 265 ? 19.949 2.606 32.994 1.00 105.59 ? 286 GLN B CD 1 ATOM 5054 O OE1 . GLN B 1 265 ? 20.064 1.544 33.608 1.00 106.34 ? 286 GLN B OE1 1 ATOM 5055 N NE2 . GLN B 1 265 ? 20.615 2.860 31.873 1.00 102.68 ? 286 GLN B NE2 1 ATOM 5056 N N . GLN B 1 266 ? 16.930 1.181 36.599 1.00 108.20 ? 287 GLN B N 1 ATOM 5057 C CA . GLN B 1 266 ? 16.180 0.832 37.803 1.00 111.32 ? 287 GLN B CA 1 ATOM 5058 C C . GLN B 1 266 ? 15.342 2.003 38.313 1.00 110.35 ? 287 GLN B C 1 ATOM 5059 O O . GLN B 1 266 ? 14.319 1.806 38.968 1.00 107.87 ? 287 GLN B O 1 ATOM 5060 C CB . GLN B 1 266 ? 17.131 0.358 38.908 1.00 113.70 ? 287 GLN B CB 1 ATOM 5061 C CG . GLN B 1 266 ? 18.012 -0.822 38.520 1.00 117.79 ? 287 GLN B CG 1 ATOM 5062 C CD . GLN B 1 266 ? 18.984 -1.220 39.623 1.00 126.13 ? 287 GLN B CD 1 ATOM 5063 O OE1 . GLN B 1 266 ? 18.895 -0.732 40.751 1.00 127.86 ? 287 GLN B OE1 1 ATOM 5064 N NE2 . GLN B 1 266 ? 19.918 -2.112 39.299 1.00 126.48 ? 287 GLN B NE2 1 ATOM 5065 N N . GLU B 1 267 ? 15.786 3.220 38.010 1.00 113.79 ? 288 GLU B N 1 ATOM 5066 C CA . GLU B 1 267 ? 15.120 4.428 38.487 1.00 118.65 ? 288 GLU B CA 1 ATOM 5067 C C . GLU B 1 267 ? 13.780 4.654 37.801 1.00 119.57 ? 288 GLU B C 1 ATOM 5068 O O . GLU B 1 267 ? 12.830 5.138 38.417 1.00 122.80 ? 288 GLU B O 1 ATOM 5069 C CB . GLU B 1 267 ? 16.011 5.657 38.277 1.00 122.44 ? 288 GLU B CB 1 ATOM 5070 C CG . GLU B 1 267 ? 17.190 5.765 39.236 1.00 127.89 ? 288 GLU B CG 1 ATOM 5071 C CD . GLU B 1 267 ? 18.412 5.005 38.758 1.00 129.17 ? 288 GLU B CD 1 ATOM 5072 O OE1 . GLU B 1 267 ? 18.383 4.479 37.624 1.00 128.50 ? 288 GLU B OE1 1 ATOM 5073 O OE2 . GLU B 1 267 ? 19.404 4.941 39.517 1.00 129.83 ? 288 GLU B OE2 1 ATOM 5074 N N . ASP B 1 268 ? 13.710 4.302 36.523 1.00 117.55 ? 289 ASP B N 1 ATOM 5075 C CA . ASP B 1 268 ? 12.532 4.578 35.709 1.00 113.24 ? 289 ASP B CA 1 ATOM 5076 C C . ASP B 1 268 ? 11.413 3.568 35.943 1.00 108.93 ? 289 ASP B C 1 ATOM 5077 O O . ASP B 1 268 ? 10.356 3.650 35.323 1.00 109.28 ? 289 ASP B O 1 ATOM 5078 C CB . ASP B 1 268 ? 12.919 4.613 34.230 1.00 116.46 ? 289 ASP B CB 1 ATOM 5079 C CG . ASP B 1 268 ? 14.027 5.608 33.946 1.00 123.97 ? 289 ASP B CG 1 ATOM 5080 O OD1 . ASP B 1 268 ? 13.790 6.823 34.114 1.00 128.11 ? 289 ASP B OD1 1 ATOM 5081 O OD2 . ASP B 1 268 ? 15.135 5.178 33.559 1.00 125.54 ? 289 ASP B OD2 1 ATOM 5082 N N . ALA B 1 269 ? 11.649 2.616 36.837 1.00 109.98 ? 290 ALA B N 1 ATOM 5083 C CA . ALA B 1 269 ? 10.626 1.641 37.193 1.00 111.98 ? 290 ALA B CA 1 ATOM 5084 C C . ALA B 1 269 ? 9.524 2.322 37.996 1.00 110.81 ? 290 ALA B C 1 ATOM 5085 O O . ALA B 1 269 ? 9.565 3.533 38.213 1.00 113.66 ? 290 ALA B O 1 ATOM 5086 C CB . ALA B 1 269 ? 11.238 0.498 37.989 1.00 112.80 ? 290 ALA B CB 1 ATOM 5087 N N . GLY B 1 270 ? 8.535 1.549 38.432 1.00 105.64 ? 291 GLY B N 1 ATOM 5088 C CA . GLY B 1 270 ? 7.492 2.085 39.287 1.00 106.76 ? 291 GLY B CA 1 ATOM 5089 C C . GLY B 1 270 ? 6.128 2.196 38.637 1.00 107.26 ? 291 GLY B C 1 ATOM 5090 O O . GLY B 1 270 ? 5.921 1.739 37.513 1.00 109.24 ? 291 GLY B O 1 ATOM 5091 N N . SER B 1 271 ? 5.192 2.811 39.354 1.00 105.26 ? 292 SER B N 1 ATOM 5092 C CA . SER B 1 271 ? 3.820 2.936 38.880 1.00 104.12 ? 292 SER B CA 1 ATOM 5093 C C . SER B 1 271 ? 3.632 4.165 37.990 1.00 105.31 ? 292 SER B C 1 ATOM 5094 O O . SER B 1 271 ? 4.035 5.273 38.346 1.00 107.38 ? 292 SER B O 1 ATOM 5095 C CB . SER B 1 271 ? 2.845 2.980 40.061 1.00 99.70 ? 292 SER B CB 1 ATOM 5096 O OG . SER B 1 271 ? 1.508 2.814 39.617 1.00 99.20 ? 292 SER B OG 1 ATOM 5097 N N . TYR B 1 272 ? 3.017 3.953 36.830 1.00 101.98 ? 293 TYR B N 1 ATOM 5098 C CA . TYR B 1 272 ? 2.761 5.030 35.881 1.00 101.32 ? 293 TYR B CA 1 ATOM 5099 C C . TYR B 1 272 ? 1.271 5.192 35.624 1.00 106.76 ? 293 TYR B C 1 ATOM 5100 O O . TYR B 1 272 ? 0.542 4.208 35.503 1.00 109.93 ? 293 TYR B O 1 ATOM 5101 C CB . TYR B 1 272 ? 3.483 4.767 34.559 1.00 98.15 ? 293 TYR B CB 1 ATOM 5102 C CG . TYR B 1 272 ? 4.950 5.133 34.575 1.00 93.83 ? 293 TYR B CG 1 ATOM 5103 C CD1 . TYR B 1 272 ? 5.873 4.345 35.246 1.00 93.62 ? 293 TYR B CD1 1 ATOM 5104 C CD2 . TYR B 1 272 ? 5.410 6.264 33.914 1.00 92.51 ? 293 TYR B CD2 1 ATOM 5105 C CE1 . TYR B 1 272 ? 7.217 4.676 35.265 1.00 97.98 ? 293 TYR B CE1 1 ATOM 5106 C CE2 . TYR B 1 272 ? 6.750 6.604 33.924 1.00 93.95 ? 293 TYR B CE2 1 ATOM 5107 C CZ . TYR B 1 272 ? 7.651 5.807 34.602 1.00 95.57 ? 293 TYR B CZ 1 ATOM 5108 O OH . TYR B 1 272 ? 8.988 6.139 34.617 1.00 91.39 ? 293 TYR B OH 1 ATOM 5109 N N . GLU B 1 273 ? 0.825 6.441 35.540 1.00 108.16 ? 294 GLU B N 1 ATOM 5110 C CA . GLU B 1 273 ? -0.577 6.731 35.268 1.00 107.76 ? 294 GLU B CA 1 ATOM 5111 C C . GLU B 1 273 ? -0.727 7.732 34.126 1.00 104.85 ? 294 GLU B C 1 ATOM 5112 O O . GLU B 1 273 ? 0.171 8.532 33.857 1.00 99.90 ? 294 GLU B O 1 ATOM 5113 C CB . GLU B 1 273 ? -1.293 7.219 36.532 1.00 112.88 ? 294 GLU B CB 1 ATOM 5114 C CG . GLU B 1 273 ? -1.632 6.097 37.509 1.00 119.70 ? 294 GLU B CG 1 ATOM 5115 C CD . GLU B 1 273 ? -2.063 6.607 38.872 1.00 126.14 ? 294 GLU B CD 1 ATOM 5116 O OE1 . GLU B 1 273 ? -2.258 5.775 39.785 1.00 128.61 ? 294 GLU B OE1 1 ATOM 5117 O OE2 . GLU B 1 273 ? -2.203 7.838 39.031 1.00 126.95 ? 294 GLU B OE2 1 ATOM 5118 N N . CYS B 1 274 ? -1.875 7.668 33.461 1.00 105.21 ? 295 CYS B N 1 ATOM 5119 C CA . CYS B 1 274 ? -2.138 8.455 32.264 1.00 106.15 ? 295 CYS B CA 1 ATOM 5120 C C . CYS B 1 274 ? -3.435 9.252 32.428 1.00 109.21 ? 295 CYS B C 1 ATOM 5121 O O . CYS B 1 274 ? -4.455 8.706 32.851 1.00 110.61 ? 295 CYS B O 1 ATOM 5122 C CB . CYS B 1 274 ? -2.214 7.516 31.056 1.00 103.31 ? 295 CYS B CB 1 ATOM 5123 S SG . CYS B 1 274 ? -3.087 8.154 29.621 1.00 107.06 ? 295 CYS B SG 1 ATOM 5124 N N . VAL B 1 275 ? -3.392 10.543 32.099 1.00 107.48 ? 296 VAL B N 1 ATOM 5125 C CA . VAL B 1 275 ? -4.526 11.437 32.344 1.00 106.55 ? 296 VAL B CA 1 ATOM 5126 C C . VAL B 1 275 ? -5.149 11.999 31.066 1.00 106.55 ? 296 VAL B C 1 ATOM 5127 O O . VAL B 1 275 ? -4.558 12.847 30.397 1.00 107.23 ? 296 VAL B O 1 ATOM 5128 C CB . VAL B 1 275 ? -4.128 12.613 33.264 1.00 103.56 ? 296 VAL B CB 1 ATOM 5129 C CG1 . VAL B 1 275 ? -5.225 13.656 33.301 1.00 104.69 ? 296 VAL B CG1 1 ATOM 5130 C CG2 . VAL B 1 275 ? -3.835 12.110 34.662 1.00 104.13 ? 296 VAL B CG2 1 ATOM 5131 N N . ALA B 1 276 ? -6.349 11.523 30.741 1.00 106.11 ? 297 ALA B N 1 ATOM 5132 C CA . ALA B 1 276 ? -7.093 12.009 29.581 1.00 105.52 ? 297 ALA B CA 1 ATOM 5133 C C . ALA B 1 276 ? -8.252 12.876 30.047 1.00 112.22 ? 297 ALA B C 1 ATOM 5134 O O . ALA B 1 276 ? -9.003 12.484 30.941 1.00 112.45 ? 297 ALA B O 1 ATOM 5135 C CB . ALA B 1 276 ? -7.608 10.842 28.751 1.00 100.31 ? 297 ALA B CB 1 ATOM 5136 N N . GLU B 1 277 ? -8.405 14.053 29.447 1.00 118.63 ? 298 GLU B N 1 ATOM 5137 C CA . GLU B 1 277 ? -9.456 14.962 29.890 1.00 126.30 ? 298 GLU B CA 1 ATOM 5138 C C . GLU B 1 277 ? -9.817 16.062 28.898 1.00 125.26 ? 298 GLU B C 1 ATOM 5139 O O . GLU B 1 277 ? -9.060 16.378 27.980 1.00 124.48 ? 298 GLU B O 1 ATOM 5140 C CB . GLU B 1 277 ? -9.069 15.598 31.226 1.00 134.79 ? 298 GLU B CB 1 ATOM 5141 C CG . GLU B 1 277 ? -8.232 16.856 31.091 1.00 141.49 ? 298 GLU B CG 1 ATOM 5142 C CD . GLU B 1 277 ? -7.580 17.260 32.397 1.00 147.21 ? 298 GLU B CD 1 ATOM 5143 O OE1 . GLU B 1 277 ? -8.073 18.209 33.042 1.00 148.75 ? 298 GLU B OE1 1 ATOM 5144 O OE2 . GLU B 1 277 ? -6.579 16.619 32.783 1.00 149.11 ? 298 GLU B OE2 1 ATOM 5145 N N . ASN B 1 278 ? -10.997 16.635 29.107 1.00 126.22 ? 299 ASN B N 1 ATOM 5146 C CA . ASN B 1 278 ? -11.451 17.812 28.382 1.00 125.52 ? 299 ASN B CA 1 ATOM 5147 C C . ASN B 1 278 ? -12.234 18.720 29.326 1.00 126.86 ? 299 ASN B C 1 ATOM 5148 O O . ASN B 1 278 ? -11.874 18.868 30.494 1.00 128.44 ? 299 ASN B O 1 ATOM 5149 C CB . ASN B 1 278 ? -12.306 17.418 27.176 1.00 121.73 ? 299 ASN B CB 1 ATOM 5150 C CG . ASN B 1 278 ? -13.404 16.438 27.534 1.00 116.87 ? 299 ASN B CG 1 ATOM 5151 O OD1 . ASN B 1 278 ? -13.591 16.096 28.701 1.00 117.50 ? 299 ASN B OD1 1 ATOM 5152 N ND2 . ASN B 1 278 ? -14.137 15.978 26.527 1.00 113.24 ? 299 ASN B ND2 1 ATOM 5153 N N . SER B 1 279 ? -13.310 19.317 28.826 1.00 123.85 ? 300 SER B N 1 ATOM 5154 C CA . SER B 1 279 ? -14.117 20.218 29.640 1.00 122.22 ? 300 SER B CA 1 ATOM 5155 C C . SER B 1 279 ? -15.164 19.459 30.447 1.00 123.17 ? 300 SER B C 1 ATOM 5156 O O . SER B 1 279 ? -15.850 20.038 31.290 1.00 125.58 ? 300 SER B O 1 ATOM 5157 C CB . SER B 1 279 ? -14.804 21.261 28.759 1.00 121.41 ? 300 SER B CB 1 ATOM 5158 O OG . SER B 1 279 ? -15.806 20.663 27.953 1.00 119.72 ? 300 SER B OG 1 ATOM 5159 N N . ARG B 1 280 ? -15.285 18.161 30.190 1.00 121.23 ? 301 ARG B N 1 ATOM 5160 C CA . ARG B 1 280 ? -16.343 17.367 30.805 1.00 120.79 ? 301 ARG B CA 1 ATOM 5161 C C . ARG B 1 280 ? -15.868 16.531 31.984 1.00 120.53 ? 301 ARG B C 1 ATOM 5162 O O . ARG B 1 280 ? -16.613 16.331 32.944 1.00 120.72 ? 301 ARG B O 1 ATOM 5163 C CB . ARG B 1 280 ? -17.015 16.472 29.766 1.00 118.81 ? 301 ARG B CB 1 ATOM 5164 C CG . ARG B 1 280 ? -17.790 17.246 28.725 1.00 120.21 ? 301 ARG B CG 1 ATOM 5165 C CD . ARG B 1 280 ? -18.705 18.257 29.388 1.00 120.26 ? 301 ARG B CD 1 ATOM 5166 N NE . ARG B 1 280 ? -19.416 19.071 28.410 1.00 122.42 ? 301 ARG B NE 1 ATOM 5167 C CZ . ARG B 1 280 ? -20.390 19.919 28.717 1.00 126.35 ? 301 ARG B CZ 1 ATOM 5168 N NH1 . ARG B 1 280 ? -20.768 20.062 29.980 1.00 129.66 ? 301 ARG B NH1 1 ATOM 5169 N NH2 . ARG B 1 280 ? -20.986 20.622 27.764 1.00 124.31 ? 301 ARG B NH2 1 ATOM 5170 N N . GLY B 1 281 ? -14.637 16.035 31.913 1.00 118.52 ? 302 GLY B N 1 ATOM 5171 C CA . GLY B 1 281 ? -14.101 15.234 32.997 1.00 120.64 ? 302 GLY B CA 1 ATOM 5172 C C . GLY B 1 281 ? -12.729 14.647 32.739 1.00 122.99 ? 302 GLY B C 1 ATOM 5173 O O . GLY B 1 281 ? -11.954 15.159 31.931 1.00 123.46 ? 302 GLY B O 1 ATOM 5174 N N . LYS B 1 282 ? -12.430 13.559 33.439 1.00 120.96 ? 303 LYS B N 1 ATOM 5175 C CA . LYS B 1 282 ? -11.125 12.930 33.353 1.00 119.39 ? 303 LYS B CA 1 ATOM 5176 C C . LYS B 1 282 ? -11.245 11.418 33.333 1.00 116.48 ? 303 LYS B C 1 ATOM 5177 O O . LYS B 1 282 ? -12.339 10.864 33.421 1.00 111.89 ? 303 LYS B O 1 ATOM 5178 C CB . LYS B 1 282 ? -10.255 13.342 34.542 1.00 123.27 ? 303 LYS B CB 1 ATOM 5179 C CG . LYS B 1 282 ? -9.844 14.801 34.557 1.00 126.58 ? 303 LYS B CG 1 ATOM 5180 C CD . LYS B 1 282 ? -8.895 15.071 35.712 1.00 128.97 ? 303 LYS B CD 1 ATOM 5181 C CE . LYS B 1 282 ? -8.371 16.495 35.688 1.00 130.98 ? 303 LYS B CE 1 ATOM 5182 N NZ . LYS B 1 282 ? -7.299 16.697 36.703 1.00 131.03 ? 303 LYS B NZ 1 ATOM 5183 N N . ASN B 1 283 ? -10.096 10.761 33.226 1.00 118.66 ? 304 ASN B N 1 ATOM 5184 C CA . ASN B 1 283 ? -10.015 9.311 33.264 1.00 122.28 ? 304 ASN B CA 1 ATOM 5185 C C . ASN B 1 283 ? -8.550 8.910 33.348 1.00 122.11 ? 304 ASN B C 1 ATOM 5186 O O . ASN B 1 283 ? -7.728 9.380 32.561 1.00 122.74 ? 304 ASN B O 1 ATOM 5187 C CB . ASN B 1 283 ? -10.663 8.706 32.017 1.00 126.06 ? 304 ASN B CB 1 ATOM 5188 C CG . ASN B 1 283 ? -11.089 7.264 32.222 1.00 130.15 ? 304 ASN B CG 1 ATOM 5189 O OD1 . ASN B 1 283 ? -11.472 6.869 33.325 1.00 133.37 ? 304 ASN B OD1 1 ATOM 5190 N ND2 . ASN B 1 283 ? -11.031 6.471 31.157 1.00 129.05 ? 304 ASN B ND2 1 ATOM 5191 N N . VAL B 1 284 ? -8.213 8.059 34.310 1.00 120.11 ? 305 VAL B N 1 ATOM 5192 C CA . VAL B 1 284 ? -6.831 7.620 34.452 1.00 117.77 ? 305 VAL B CA 1 ATOM 5193 C C . VAL B 1 284 ? -6.664 6.130 34.186 1.00 114.22 ? 305 VAL B C 1 ATOM 5194 O O . VAL B 1 284 ? -7.549 5.326 34.481 1.00 111.99 ? 305 VAL B O 1 ATOM 5195 C CB . VAL B 1 284 ? -6.250 7.960 35.839 1.00 120.11 ? 305 VAL B CB 1 ATOM 5196 C CG1 . VAL B 1 284 ? -5.951 9.446 35.937 1.00 120.05 ? 305 VAL B CG1 1 ATOM 5197 C CG2 . VAL B 1 284 ? -7.200 7.514 36.941 1.00 122.88 ? 305 VAL B CG2 1 ATOM 5198 N N . ALA B 1 285 ? -5.518 5.783 33.609 1.00 110.33 ? 306 ALA B N 1 ATOM 5199 C CA . ALA B 1 285 ? -5.134 4.396 33.411 1.00 104.88 ? 306 ALA B CA 1 ATOM 5200 C C . ALA B 1 285 ? -3.818 4.172 34.136 1.00 101.31 ? 306 ALA B C 1 ATOM 5201 O O . ALA B 1 285 ? -2.893 4.973 34.014 1.00 99.04 ? 306 ALA B O 1 ATOM 5202 C CB . ALA B 1 285 ? -4.985 4.091 31.930 1.00 101.58 ? 306 ALA B CB 1 ATOM 5203 N N . LYS B 1 286 ? -3.737 3.094 34.905 1.00 102.67 ? 307 LYS B N 1 ATOM 5204 C CA . LYS B 1 286 ? -2.524 2.808 35.658 1.00 106.05 ? 307 LYS B CA 1 ATOM 5205 C C . LYS B 1 286 ? -1.832 1.563 35.124 1.00 105.85 ? 307 LYS B C 1 ATOM 5206 O O . LYS B 1 286 ? -2.462 0.699 34.511 1.00 105.83 ? 307 LYS B O 1 ATOM 5207 C CB . LYS B 1 286 ? -2.839 2.645 37.146 1.00 108.81 ? 307 LYS B CB 1 ATOM 5208 C CG . LYS B 1 286 ? -3.733 1.459 37.451 1.00 113.16 ? 307 LYS B CG 1 ATOM 5209 C CD . LYS B 1 286 ? -4.646 1.741 38.630 1.00 115.08 ? 307 LYS B CD 1 ATOM 5210 C CE . LYS B 1 286 ? -5.816 0.772 38.655 1.00 112.67 ? 307 LYS B CE 1 ATOM 5211 N NZ . LYS B 1 286 ? -7.011 1.382 39.298 1.00 110.32 ? 307 LYS B NZ 1 ATOM 5212 N N . GLY B 1 287 ? -0.527 1.490 35.361 1.00 105.10 ? 308 GLY B N 1 ATOM 5213 C CA . GLY B 1 287 ? 0.282 0.358 34.954 1.00 100.65 ? 308 GLY B CA 1 ATOM 5214 C C . GLY B 1 287 ? 1.610 0.410 35.680 1.00 99.98 ? 308 GLY B C 1 ATOM 5215 O O . GLY B 1 287 ? 2.061 1.485 36.077 1.00 97.97 ? 308 GLY B O 1 ATOM 5216 N N . GLN B 1 288 ? 2.231 -0.749 35.864 1.00 103.13 ? 309 GLN B N 1 ATOM 5217 C CA . GLN B 1 288 ? 3.514 -0.833 36.554 1.00 105.92 ? 309 GLN B CA 1 ATOM 5218 C C . GLN B 1 288 ? 4.646 -1.242 35.626 1.00 107.96 ? 309 GLN B C 1 ATOM 5219 O O . GLN B 1 288 ? 4.533 -2.220 34.890 1.00 112.07 ? 309 GLN B O 1 ATOM 5220 C CB . GLN B 1 288 ? 3.443 -1.836 37.700 1.00 110.21 ? 309 GLN B CB 1 ATOM 5221 C CG . GLN B 1 288 ? 3.618 -1.224 39.070 1.00 118.96 ? 309 GLN B CG 1 ATOM 5222 C CD . GLN B 1 288 ? 4.438 -2.113 39.978 1.00 126.67 ? 309 GLN B CD 1 ATOM 5223 O OE1 . GLN B 1 288 ? 4.404 -1.975 41.200 1.00 132.54 ? 309 GLN B OE1 1 ATOM 5224 N NE2 . GLN B 1 288 ? 5.187 -3.035 39.381 1.00 126.92 ? 309 GLN B NE2 1 ATOM 5225 N N . LEU B 1 289 ? 5.744 -0.498 35.675 1.00 103.40 ? 310 LEU B N 1 ATOM 5226 C CA . LEU B 1 289 ? 6.932 -0.859 34.914 1.00 99.97 ? 310 LEU B CA 1 ATOM 5227 C C . LEU B 1 289 ? 7.937 -1.566 35.817 1.00 103.03 ? 310 LEU B C 1 ATOM 5228 O O . LEU B 1 289 ? 8.515 -0.960 36.720 1.00 99.61 ? 310 LEU B O 1 ATOM 5229 C CB . LEU B 1 289 ? 7.550 0.368 34.236 1.00 96.59 ? 310 LEU B CB 1 ATOM 5230 C CG . LEU B 1 289 ? 6.902 0.772 32.904 1.00 93.72 ? 310 LEU B CG 1 ATOM 5231 C CD1 . LEU B 1 289 ? 5.408 0.966 33.064 1.00 90.16 ? 310 LEU B CD1 1 ATOM 5232 C CD2 . LEU B 1 289 ? 7.537 2.028 32.336 1.00 93.23 ? 310 LEU B CD2 1 ATOM 5233 N N . THR B 1 290 ? 8.124 -2.859 35.566 1.00 107.07 ? 311 THR B N 1 ATOM 5234 C CA . THR B 1 290 ? 8.989 -3.698 36.386 1.00 108.01 ? 311 THR B CA 1 ATOM 5235 C C . THR B 1 290 ? 10.365 -3.868 35.751 1.00 106.06 ? 311 THR B C 1 ATOM 5236 O O . THR B 1 290 ? 10.503 -4.512 34.711 1.00 102.84 ? 311 THR B O 1 ATOM 5237 C CB . THR B 1 290 ? 8.362 -5.086 36.609 1.00 108.28 ? 311 THR B CB 1 ATOM 5238 O OG1 . THR B 1 290 ? 7.015 -4.932 37.075 1.00 111.14 ? 311 THR B OG1 1 ATOM 5239 C CG2 . THR B 1 290 ? 9.163 -5.879 37.630 1.00 107.27 ? 311 THR B CG2 1 ATOM 5240 N N . PHE B 1 291 ? 11.378 -3.290 36.388 1.00 108.22 ? 312 PHE B N 1 ATOM 5241 C CA . PHE B 1 291 ? 12.743 -3.344 35.877 1.00 108.18 ? 312 PHE B CA 1 ATOM 5242 C C . PHE B 1 291 ? 13.303 -4.762 35.890 1.00 106.88 ? 312 PHE B C 1 ATOM 5243 O O . PHE B 1 291 ? 13.174 -5.484 36.881 1.00 111.98 ? 312 PHE B O 1 ATOM 5244 C CB . PHE B 1 291 ? 13.657 -2.416 36.686 1.00 111.15 ? 312 PHE B CB 1 ATOM 5245 C CG . PHE B 1 291 ? 15.093 -2.420 36.227 1.00 113.87 ? 312 PHE B CG 1 ATOM 5246 C CD1 . PHE B 1 291 ? 15.525 -1.542 35.245 1.00 114.82 ? 312 PHE B CD1 1 ATOM 5247 C CD2 . PHE B 1 291 ? 16.011 -3.303 36.777 1.00 114.98 ? 312 PHE B CD2 1 ATOM 5248 C CE1 . PHE B 1 291 ? 16.844 -1.543 34.821 1.00 113.65 ? 312 PHE B CE1 1 ATOM 5249 C CE2 . PHE B 1 291 ? 17.332 -3.311 36.356 1.00 113.84 ? 312 PHE B CE2 1 ATOM 5250 C CZ . PHE B 1 291 ? 17.749 -2.429 35.377 1.00 113.18 ? 312 PHE B CZ 1 ATOM 5251 N N . TYR B 1 292 ? 13.923 -5.153 34.780 1.00 121.57 ? 313 TYR B N 1 ATOM 5252 C CA . TYR B 1 292 ? 14.642 -6.419 34.707 1.00 112.55 ? 313 TYR B CA 1 ATOM 5253 C C . TYR B 1 292 ? 15.835 -6.298 33.759 1.00 106.46 ? 313 TYR B C 1 ATOM 5254 O O . TYR B 1 292 ? 15.872 -5.417 32.899 1.00 103.23 ? 313 TYR B O 1 ATOM 5255 C CB . TYR B 1 292 ? 13.717 -7.563 34.277 1.00 111.75 ? 313 TYR B CB 1 ATOM 5256 C CG . TYR B 1 292 ? 13.487 -7.656 32.786 1.00 114.24 ? 313 TYR B CG 1 ATOM 5257 C CD1 . TYR B 1 292 ? 12.416 -7.004 32.188 1.00 121.75 ? 313 TYR B CD1 1 ATOM 5258 C CD2 . TYR B 1 292 ? 14.333 -8.401 31.976 1.00 110.54 ? 313 TYR B CD2 1 ATOM 5259 C CE1 . TYR B 1 292 ? 12.197 -7.086 30.827 1.00 123.27 ? 313 TYR B CE1 1 ATOM 5260 C CE2 . TYR B 1 292 ? 14.123 -8.488 30.612 1.00 113.82 ? 313 TYR B CE2 1 ATOM 5261 C CZ . TYR B 1 292 ? 13.054 -7.829 30.044 1.00 121.36 ? 313 TYR B CZ 1 ATOM 5262 O OH . TYR B 1 292 ? 12.837 -7.910 28.688 1.00 126.53 ? 313 TYR B OH 1 ATOM 5263 N N . ALA B 1 293 ? 16.815 -7.179 33.930 1.00 100.40 ? 314 ALA B N 1 ATOM 5264 C CA . ALA B 1 293 ? 18.003 -7.158 33.087 1.00 97.00 ? 314 ALA B CA 1 ATOM 5265 C C . ALA B 1 293 ? 18.667 -8.528 33.001 1.00 92.53 ? 314 ALA B C 1 ATOM 5266 O O . ALA B 1 293 ? 18.814 -9.224 34.006 1.00 92.09 ? 314 ALA B O 1 ATOM 5267 C CB . ALA B 1 293 ? 18.991 -6.125 33.595 1.00 94.47 ? 314 ALA B CB 1 ATOM 5268 N N . GLN B 1 294 ? 19.063 -8.908 31.792 1.00 89.72 ? 315 GLN B N 1 ATOM 5269 C CA . GLN B 1 294 ? 19.803 -10.144 31.589 1.00 88.07 ? 315 GLN B CA 1 ATOM 5270 C C . GLN B 1 294 ? 21.191 -9.998 32.192 1.00 83.68 ? 315 GLN B C 1 ATOM 5271 O O . GLN B 1 294 ? 21.670 -8.880 32.392 1.00 84.69 ? 315 GLN B O 1 ATOM 5272 C CB . GLN B 1 294 ? 19.929 -10.459 30.100 1.00 92.33 ? 315 GLN B CB 1 ATOM 5273 C CG . GLN B 1 294 ? 18.625 -10.397 29.332 1.00 100.69 ? 315 GLN B CG 1 ATOM 5274 C CD . GLN B 1 294 ? 18.780 -10.892 27.912 1.00 103.92 ? 315 GLN B CD 1 ATOM 5275 O OE1 . GLN B 1 294 ? 18.501 -10.167 26.960 1.00 108.74 ? 315 GLN B OE1 1 ATOM 5276 N NE2 . GLN B 1 294 ? 19.245 -12.127 27.761 1.00 103.44 ? 315 GLN B NE2 1 ATOM 5277 N N . PRO B 1 295 ? 21.848 -11.129 32.481 1.00 78.10 ? 316 PRO B N 1 ATOM 5278 C CA . PRO B 1 295 ? 23.183 -11.039 33.072 1.00 78.52 ? 316 PRO B CA 1 ATOM 5279 C C . PRO B 1 295 ? 24.152 -10.385 32.101 1.00 79.54 ? 316 PRO B C 1 ATOM 5280 O O . PRO B 1 295 ? 24.027 -10.573 30.888 1.00 71.21 ? 316 PRO B O 1 ATOM 5281 C CB . PRO B 1 295 ? 23.574 -12.507 33.290 1.00 77.22 ? 316 PRO B CB 1 ATOM 5282 C CG . PRO B 1 295 ? 22.286 -13.266 33.261 1.00 79.99 ? 316 PRO B CG 1 ATOM 5283 C CD . PRO B 1 295 ? 21.411 -12.523 32.305 1.00 77.84 ? 316 PRO B CD 1 ATOM 5284 N N . ASN B 1 296 ? 25.087 -9.607 32.635 1.00 83.07 ? 317 ASN B N 1 ATOM 5285 C CA . ASN B 1 296 ? 26.214 -9.112 31.856 1.00 81.93 ? 317 ASN B CA 1 ATOM 5286 C C . ASN B 1 296 ? 27.490 -9.147 32.692 1.00 74.02 ? 317 ASN B C 1 ATOM 5287 O O . ASN B 1 296 ? 27.465 -8.894 33.897 1.00 72.56 ? 317 ASN B O 1 ATOM 5288 C CB . ASN B 1 296 ? 25.948 -7.706 31.310 1.00 89.45 ? 317 ASN B CB 1 ATOM 5289 C CG . ASN B 1 296 ? 25.742 -6.682 32.405 1.00 98.44 ? 317 ASN B CG 1 ATOM 5290 O OD1 . ASN B 1 296 ? 26.595 -5.823 32.635 1.00 97.42 ? 317 ASN B OD1 1 ATOM 5291 N ND2 . ASN B 1 296 ? 24.606 -6.769 33.091 1.00 104.79 ? 317 ASN B ND2 1 ATOM 5292 N N . TRP B 1 297 ? 28.604 -9.474 32.051 1.00 70.34 ? 318 TRP B N 1 ATOM 5293 C CA . TRP B 1 297 ? 29.862 -9.642 32.763 1.00 63.08 ? 318 TRP B CA 1 ATOM 5294 C C . TRP B 1 297 ? 30.400 -8.344 33.351 1.00 61.22 ? 318 TRP B C 1 ATOM 5295 O O . TRP B 1 297 ? 30.240 -7.267 32.780 1.00 62.62 ? 318 TRP B O 1 ATOM 5296 C CB . TRP B 1 297 ? 30.909 -10.287 31.856 1.00 57.41 ? 318 TRP B CB 1 ATOM 5297 C CG . TRP B 1 297 ? 30.597 -11.706 31.521 1.00 57.77 ? 318 TRP B CG 1 ATOM 5298 C CD1 . TRP B 1 297 ? 30.449 -12.238 30.278 1.00 56.55 ? 318 TRP B CD1 1 ATOM 5299 C CD2 . TRP B 1 297 ? 30.384 -12.783 32.447 1.00 59.94 ? 318 TRP B CD2 1 ATOM 5300 N NE1 . TRP B 1 297 ? 30.163 -13.583 30.367 1.00 58.99 ? 318 TRP B NE1 1 ATOM 5301 C CE2 . TRP B 1 297 ? 30.117 -13.940 31.688 1.00 59.97 ? 318 TRP B CE2 1 ATOM 5302 C CE3 . TRP B 1 297 ? 30.394 -12.880 33.841 1.00 63.29 ? 318 TRP B CE3 1 ATOM 5303 C CZ2 . TRP B 1 297 ? 29.861 -15.177 32.277 1.00 61.19 ? 318 TRP B CZ2 1 ATOM 5304 C CZ3 . TRP B 1 297 ? 30.144 -14.112 34.424 1.00 64.71 ? 318 TRP B CZ3 1 ATOM 5305 C CH2 . TRP B 1 297 ? 29.881 -15.243 33.643 1.00 63.21 ? 318 TRP B CH2 1 ATOM 5306 N N . VAL B 1 298 ? 31.026 -8.471 34.513 1.00 58.93 ? 319 VAL B N 1 ATOM 5307 C CA . VAL B 1 298 ? 31.716 -7.373 35.168 1.00 55.92 ? 319 VAL B CA 1 ATOM 5308 C C . VAL B 1 298 ? 33.160 -7.810 35.369 1.00 55.58 ? 319 VAL B C 1 ATOM 5309 O O . VAL B 1 298 ? 34.084 -6.998 35.321 1.00 58.75 ? 319 VAL B O 1 ATOM 5310 C CB . VAL B 1 298 ? 31.074 -7.046 36.521 1.00 57.09 ? 319 VAL B CB 1 ATOM 5311 C CG1 . VAL B 1 298 ? 32.016 -6.218 37.387 1.00 56.83 ? 319 VAL B CG1 1 ATOM 5312 C CG2 . VAL B 1 298 ? 29.771 -6.320 36.308 1.00 62.32 ? 319 VAL B CG2 1 ATOM 5313 N N . GLN B 1 299 ? 33.336 -9.110 35.588 1.00 54.04 ? 320 GLN B N 1 ATOM 5314 C CA . GLN B 1 299 ? 34.657 -9.729 35.673 1.00 48.96 ? 320 GLN B CA 1 ATOM 5315 C C . GLN B 1 299 ? 34.581 -11.145 35.126 1.00 48.93 ? 320 GLN B C 1 ATOM 5316 O O . GLN B 1 299 ? 33.806 -11.965 35.612 1.00 53.42 ? 320 GLN B O 1 ATOM 5317 C CB . GLN B 1 299 ? 35.154 -9.760 37.118 1.00 40.17 ? 320 GLN B CB 1 ATOM 5318 C CG . GLN B 1 299 ? 36.400 -10.618 37.331 1.00 42.15 ? 320 GLN B CG 1 ATOM 5319 C CD . GLN B 1 299 ? 36.991 -10.435 38.717 1.00 48.59 ? 320 GLN B CD 1 ATOM 5320 O OE1 . GLN B 1 299 ? 37.199 -9.309 39.169 1.00 48.12 ? 320 GLN B OE1 1 ATOM 5321 N NE2 . GLN B 1 299 ? 37.254 -11.541 39.403 1.00 49.63 ? 320 GLN B NE2 1 ATOM 5322 N N . ILE B 1 300 ? 35.380 -11.426 34.106 1.00 48.45 ? 321 ILE B N 1 ATOM 5323 C CA . ILE B 1 300 ? 35.350 -12.728 33.461 1.00 51.48 ? 321 ILE B CA 1 ATOM 5324 C C . ILE B 1 300 ? 36.603 -13.495 33.838 1.00 51.63 ? 321 ILE B C 1 ATOM 5325 O O . ILE B 1 300 ? 37.583 -12.903 34.294 1.00 54.12 ? 321 ILE B O 1 ATOM 5326 C CB . ILE B 1 300 ? 35.295 -12.590 31.924 1.00 53.71 ? 321 ILE B CB 1 ATOM 5327 C CG1 . ILE B 1 300 ? 36.512 -11.817 31.420 1.00 52.83 ? 321 ILE B CG1 1 ATOM 5328 C CG2 . ILE B 1 300 ? 34.017 -11.879 31.484 1.00 54.99 ? 321 ILE B CG2 1 ATOM 5329 C CD1 . ILE B 1 300 ? 36.457 -11.492 29.943 1.00 52.43 ? 321 ILE B CD1 1 ATOM 5330 N N . ILE B 1 301 ? 36.581 -14.811 33.653 1.00 44.83 ? 322 ILE B N 1 ATOM 5331 C CA . ILE B 1 301 ? 37.784 -15.590 33.886 1.00 42.07 ? 322 ILE B CA 1 ATOM 5332 C C . ILE B 1 301 ? 38.780 -15.352 32.754 1.00 42.47 ? 322 ILE B C 1 ATOM 5333 O O . ILE B 1 301 ? 38.406 -14.931 31.656 1.00 39.67 ? 322 ILE B O 1 ATOM 5334 C CB . ILE B 1 301 ? 37.501 -17.096 34.107 1.00 44.96 ? 322 ILE B CB 1 ATOM 5335 C CG1 . ILE B 1 301 ? 36.894 -17.745 32.865 1.00 41.56 ? 322 ILE B CG1 1 ATOM 5336 C CG2 . ILE B 1 301 ? 36.571 -17.295 35.291 1.00 47.91 ? 322 ILE B CG2 1 ATOM 5337 C CD1 . ILE B 1 301 ? 36.652 -19.235 33.058 1.00 37.26 ? 322 ILE B CD1 1 ATOM 5338 N N . ASN B 1 302 ? 40.052 -15.606 33.044 1.00 37.43 ? 323 ASN B N 1 ATOM 5339 C CA . ASN B 1 302 ? 41.136 -15.302 32.133 1.00 34.97 ? 323 ASN B CA 1 ATOM 5340 C C . ASN B 1 302 ? 42.033 -16.517 31.984 1.00 40.59 ? 323 ASN B C 1 ATOM 5341 O O . ASN B 1 302 ? 42.033 -17.401 32.846 1.00 39.40 ? 323 ASN B O 1 ATOM 5342 C CB . ASN B 1 302 ? 41.947 -14.125 32.670 1.00 40.36 ? 323 ASN B CB 1 ATOM 5343 C CG . ASN B 1 302 ? 42.469 -14.371 34.087 1.00 48.53 ? 323 ASN B CG 1 ATOM 5344 O OD1 . ASN B 1 302 ? 41.702 -14.401 35.058 1.00 43.71 ? 323 ASN B OD1 1 ATOM 5345 N ND2 . ASN B 1 302 ? 43.779 -14.551 34.208 1.00 52.52 ? 323 ASN B ND2 1 ATOM 5346 N N . ASP B 1 303 ? 42.798 -16.559 30.895 1.00 34.62 ? 324 ASP B N 1 ATOM 5347 C CA . ASP B 1 303 ? 43.742 -17.651 30.664 1.00 38.61 ? 324 ASP B CA 1 ATOM 5348 C C . ASP B 1 303 ? 44.785 -17.707 31.777 1.00 41.79 ? 324 ASP B C 1 ATOM 5349 O O . ASP B 1 303 ? 45.346 -16.681 32.185 1.00 30.50 ? 324 ASP B O 1 ATOM 5350 C CB . ASP B 1 303 ? 44.452 -17.484 29.316 1.00 42.35 ? 324 ASP B CB 1 ATOM 5351 C CG . ASP B 1 303 ? 43.646 -18.048 28.144 1.00 56.62 ? 324 ASP B CG 1 ATOM 5352 O OD1 . ASP B 1 303 ? 42.508 -18.533 28.354 1.00 52.24 ? 324 ASP B OD1 1 ATOM 5353 O OD2 . ASP B 1 303 ? 44.164 -18.016 27.005 1.00 66.04 ? 324 ASP B OD2 1 ATOM 5354 N N . ILE B 1 304 ? 45.063 -18.908 32.262 1.00 36.07 ? 325 ILE B N 1 ATOM 5355 C CA . ILE B 1 304 ? 46.104 -19.052 33.256 1.00 33.07 ? 325 ILE B CA 1 ATOM 5356 C C . ILE B 1 304 ? 47.147 -20.086 32.869 1.00 35.99 ? 325 ILE B C 1 ATOM 5357 O O . ILE B 1 304 ? 46.821 -21.228 32.535 1.00 45.43 ? 325 ILE B O 1 ATOM 5358 C CB . ILE B 1 304 ? 45.519 -19.337 34.666 1.00 38.01 ? 325 ILE B CB 1 ATOM 5359 C CG1 . ILE B 1 304 ? 44.939 -18.048 35.249 1.00 35.93 ? 325 ILE B CG1 1 ATOM 5360 C CG2 . ILE B 1 304 ? 46.599 -19.872 35.581 1.00 37.31 ? 325 ILE B CG2 1 ATOM 5361 C CD1 . ILE B 1 304 ? 44.251 -18.223 36.572 1.00 50.71 ? 325 ILE B CD1 1 ATOM 5362 N N . HIS B 1 305 ? 48.405 -19.660 32.912 1.00 25.90 ? 326 HIS B N 1 ATOM 5363 C CA . HIS B 1 305 ? 49.533 -20.530 32.641 1.00 30.29 ? 326 HIS B CA 1 ATOM 5364 C C . HIS B 1 305 ? 50.391 -20.612 33.914 1.00 39.65 ? 326 HIS B C 1 ATOM 5365 O O . HIS B 1 305 ? 51.089 -19.665 34.264 1.00 40.64 ? 326 HIS B O 1 ATOM 5366 C CB . HIS B 1 305 ? 50.324 -19.971 31.454 1.00 25.76 ? 326 HIS B CB 1 ATOM 5367 C CG . HIS B 1 305 ? 51.383 -20.907 30.938 1.00 33.98 ? 326 HIS B CG 1 ATOM 5368 N ND1 . HIS B 1 305 ? 51.109 -22.189 30.554 1.00 41.20 ? 326 HIS B ND1 1 ATOM 5369 C CD2 . HIS B 1 305 ? 52.709 -20.710 30.739 1.00 37.98 ? 326 HIS B CD2 1 ATOM 5370 C CE1 . HIS B 1 305 ? 52.233 -22.771 30.138 1.00 33.87 ? 326 HIS B CE1 1 ATOM 5371 N NE2 . HIS B 1 305 ? 53.208 -21.896 30.243 1.00 37.18 ? 326 HIS B NE2 1 ATOM 5372 N N . VAL B 1 306 ? 50.327 -21.744 34.609 1.00 44.25 ? 327 VAL B N 1 ATOM 5373 C CA . VAL B 1 306 ? 50.777 -21.817 36.002 1.00 33.36 ? 327 VAL B CA 1 ATOM 5374 C C . VAL B 1 306 ? 51.712 -22.995 36.291 1.00 32.44 ? 327 VAL B C 1 ATOM 5375 O O . VAL B 1 306 ? 51.544 -24.079 35.739 1.00 40.82 ? 327 VAL B O 1 ATOM 5376 C CB . VAL B 1 306 ? 49.559 -21.886 36.962 1.00 36.30 ? 327 VAL B CB 1 ATOM 5377 C CG1 . VAL B 1 306 ? 48.889 -23.246 36.877 1.00 32.30 ? 327 VAL B CG1 1 ATOM 5378 C CG2 . VAL B 1 306 ? 49.968 -21.577 38.398 1.00 39.64 ? 327 VAL B CG2 1 ATOM 5379 N N . ALA B 1 307 ? 52.700 -22.764 37.155 1.00 24.22 ? 328 ALA B N 1 ATOM 5380 C CA . ALA B 1 307 ? 53.618 -23.811 37.616 1.00 34.85 ? 328 ALA B CA 1 ATOM 5381 C C . ALA B 1 307 ? 52.908 -24.914 38.402 1.00 36.88 ? 328 ALA B C 1 ATOM 5382 O O . ALA B 1 307 ? 51.863 -24.682 39.023 1.00 34.82 ? 328 ALA B O 1 ATOM 5383 C CB . ALA B 1 307 ? 54.744 -23.205 38.474 1.00 26.41 ? 328 ALA B CB 1 ATOM 5384 N N . MET B 1 308 ? 53.486 -26.113 38.377 1.00 34.03 ? 329 MET B N 1 ATOM 5385 C CA . MET B 1 308 ? 52.942 -27.244 39.127 1.00 41.99 ? 329 MET B CA 1 ATOM 5386 C C . MET B 1 308 ? 52.910 -26.996 40.626 1.00 40.88 ? 329 MET B C 1 ATOM 5387 O O . MET B 1 308 ? 53.875 -26.485 41.204 1.00 39.14 ? 329 MET B O 1 ATOM 5388 C CB . MET B 1 308 ? 53.726 -28.523 38.841 1.00 43.16 ? 329 MET B CB 1 ATOM 5389 C CG . MET B 1 308 ? 53.558 -29.033 37.426 1.00 48.92 ? 329 MET B CG 1 ATOM 5390 S SD . MET B 1 308 ? 53.781 -30.807 37.302 1.00 90.73 ? 329 MET B SD 1 ATOM 5391 C CE . MET B 1 308 ? 52.286 -31.381 38.108 1.00 117.54 ? 329 MET B CE 1 ATOM 5392 N N . GLU B 1 309 ? 51.786 -27.363 41.236 1.00 39.24 ? 330 GLU B N 1 ATOM 5393 C CA . GLU B 1 309 ? 51.609 -27.342 42.691 1.00 40.09 ? 330 GLU B CA 1 ATOM 5394 C C . GLU B 1 309 ? 51.309 -25.968 43.278 1.00 39.65 ? 330 GLU B C 1 ATOM 5395 O O . GLU B 1 309 ? 51.130 -25.838 44.484 1.00 41.62 ? 330 GLU B O 1 ATOM 5396 C CB . GLU B 1 309 ? 52.793 -27.997 43.408 1.00 37.67 ? 330 GLU B CB 1 ATOM 5397 C CG . GLU B 1 309 ? 52.901 -29.483 43.123 1.00 48.31 ? 330 GLU B CG 1 ATOM 5398 C CD . GLU B 1 309 ? 54.112 -30.118 43.765 1.00 66.17 ? 330 GLU B CD 1 ATOM 5399 O OE1 . GLU B 1 309 ? 54.641 -29.550 44.743 1.00 75.10 ? 330 GLU B OE1 1 ATOM 5400 O OE2 . GLU B 1 309 ? 54.533 -31.195 43.297 1.00 69.74 ? 330 GLU B OE2 1 ATOM 5401 N N . GLU B 1 310 ? 51.256 -24.944 42.436 1.00 39.60 ? 331 GLU B N 1 ATOM 5402 C CA . GLU B 1 310 ? 50.767 -23.653 42.885 1.00 35.42 ? 331 GLU B CA 1 ATOM 5403 C C . GLU B 1 310 ? 49.259 -23.760 42.989 1.00 37.86 ? 331 GLU B C 1 ATOM 5404 O O . GLU B 1 310 ? 48.678 -24.792 42.638 1.00 41.01 ? 331 GLU B O 1 ATOM 5405 C CB . GLU B 1 310 ? 51.165 -22.539 41.915 1.00 31.72 ? 331 GLU B CB 1 ATOM 5406 C CG . GLU B 1 310 ? 52.668 -22.342 41.787 1.00 42.14 ? 331 GLU B CG 1 ATOM 5407 C CD . GLU B 1 310 ? 53.305 -21.791 43.062 1.00 46.01 ? 331 GLU B CD 1 ATOM 5408 O OE1 . GLU B 1 310 ? 52.805 -20.777 43.586 1.00 45.33 ? 331 GLU B OE1 1 ATOM 5409 O OE2 . GLU B 1 310 ? 54.311 -22.365 43.531 1.00 39.90 ? 331 GLU B OE2 1 ATOM 5410 N N . SER B 1 311 ? 48.620 -22.707 43.479 1.00 34.87 ? 332 SER B N 1 ATOM 5411 C CA . SER B 1 311 ? 47.171 -22.680 43.519 1.00 43.07 ? 332 SER B CA 1 ATOM 5412 C C . SER B 1 311 ? 46.642 -21.811 42.389 1.00 50.55 ? 332 SER B C 1 ATOM 5413 O O . SER B 1 311 ? 47.364 -20.978 41.835 1.00 50.67 ? 332 SER B O 1 ATOM 5414 C CB . SER B 1 311 ? 46.666 -22.173 44.873 1.00 49.27 ? 332 SER B CB 1 ATOM 5415 O OG . SER B 1 311 ? 46.692 -20.760 44.924 1.00 54.29 ? 332 SER B OG 1 ATOM 5416 N N . VAL B 1 312 ? 45.377 -22.022 42.048 1.00 49.92 ? 333 VAL B N 1 ATOM 5417 C CA . VAL B 1 312 ? 44.731 -21.306 40.961 1.00 46.08 ? 333 VAL B CA 1 ATOM 5418 C C . VAL B 1 312 ? 43.365 -20.829 41.425 1.00 44.22 ? 333 VAL B C 1 ATOM 5419 O O . VAL B 1 312 ? 42.548 -21.616 41.923 1.00 41.93 ? 333 VAL B O 1 ATOM 5420 C CB . VAL B 1 312 ? 44.552 -22.212 39.734 1.00 45.05 ? 333 VAL B CB 1 ATOM 5421 C CG1 . VAL B 1 312 ? 43.657 -21.541 38.679 1.00 35.24 ? 333 VAL B CG1 1 ATOM 5422 C CG2 . VAL B 1 312 ? 45.901 -22.562 39.161 1.00 49.24 ? 333 VAL B CG2 1 ATOM 5423 N N . PHE B 1 313 ? 43.127 -19.535 41.277 1.00 34.59 ? 334 PHE B N 1 ATOM 5424 C CA . PHE B 1 313 ? 41.867 -18.952 41.705 1.00 42.41 ? 334 PHE B CA 1 ATOM 5425 C C . PHE B 1 313 ? 41.226 -18.167 40.571 1.00 38.77 ? 334 PHE B C 1 ATOM 5426 O O . PHE B 1 313 ? 41.897 -17.417 39.865 1.00 37.29 ? 334 PHE B O 1 ATOM 5427 C CB . PHE B 1 313 ? 42.088 -18.048 42.918 1.00 43.78 ? 334 PHE B CB 1 ATOM 5428 C CG . PHE B 1 313 ? 40.895 -17.198 43.283 1.00 43.07 ? 334 PHE B CG 1 ATOM 5429 C CD1 . PHE B 1 313 ? 39.754 -17.770 43.824 1.00 47.14 ? 334 PHE B CD1 1 ATOM 5430 C CD2 . PHE B 1 313 ? 40.927 -15.822 43.101 1.00 42.52 ? 334 PHE B CD2 1 ATOM 5431 C CE1 . PHE B 1 313 ? 38.655 -16.987 44.177 1.00 47.25 ? 334 PHE B CE1 1 ATOM 5432 C CE2 . PHE B 1 313 ? 39.837 -15.031 43.450 1.00 49.91 ? 334 PHE B CE2 1 ATOM 5433 C CZ . PHE B 1 313 ? 38.698 -15.617 43.992 1.00 48.13 ? 334 PHE B CZ 1 ATOM 5434 N N . TRP B 1 314 ? 39.924 -18.362 40.404 1.00 42.56 ? 335 TRP B N 1 ATOM 5435 C CA . TRP B 1 314 ? 39.119 -17.593 39.459 1.00 43.44 ? 335 TRP B CA 1 ATOM 5436 C C . TRP B 1 314 ? 37.853 -17.116 40.133 1.00 47.10 ? 335 TRP B C 1 ATOM 5437 O O . TRP B 1 314 ? 37.180 -17.885 40.815 1.00 47.59 ? 335 TRP B O 1 ATOM 5438 C CB . TRP B 1 314 ? 38.680 -18.457 38.287 1.00 32.71 ? 335 TRP B CB 1 ATOM 5439 C CG . TRP B 1 314 ? 39.621 -18.502 37.153 1.00 32.33 ? 335 TRP B CG 1 ATOM 5440 C CD1 . TRP B 1 314 ? 40.349 -17.464 36.640 1.00 33.99 ? 335 TRP B CD1 1 ATOM 5441 C CD2 . TRP B 1 314 ? 39.910 -19.638 36.339 1.00 40.19 ? 335 TRP B CD2 1 ATOM 5442 N NE1 . TRP B 1 314 ? 41.095 -17.896 35.569 1.00 37.11 ? 335 TRP B NE1 1 ATOM 5443 C CE2 . TRP B 1 314 ? 40.839 -19.227 35.362 1.00 40.20 ? 335 TRP B CE2 1 ATOM 5444 C CE3 . TRP B 1 314 ? 39.478 -20.968 36.347 1.00 42.99 ? 335 TRP B CE3 1 ATOM 5445 C CZ2 . TRP B 1 314 ? 41.342 -20.099 34.401 1.00 45.10 ? 335 TRP B CZ2 1 ATOM 5446 C CZ3 . TRP B 1 314 ? 39.982 -21.831 35.393 1.00 47.78 ? 335 TRP B CZ3 1 ATOM 5447 C CH2 . TRP B 1 314 ? 40.903 -21.393 34.433 1.00 46.95 ? 335 TRP B CH2 1 ATOM 5448 N N . GLU B 1 315 ? 37.523 -15.851 39.928 1.00 41.57 ? 336 GLU B N 1 ATOM 5449 C CA . GLU B 1 315 ? 36.209 -15.366 40.281 1.00 46.53 ? 336 GLU B CA 1 ATOM 5450 C C . GLU B 1 315 ? 35.606 -14.646 39.082 1.00 48.93 ? 336 GLU B C 1 ATOM 5451 O O . GLU B 1 315 ? 36.251 -13.804 38.456 1.00 47.90 ? 336 GLU B O 1 ATOM 5452 C CB . GLU B 1 315 ? 36.264 -14.441 41.496 1.00 47.04 ? 336 GLU B CB 1 ATOM 5453 C CG . GLU B 1 315 ? 34.886 -14.138 42.055 1.00 54.30 ? 336 GLU B CG 1 ATOM 5454 C CD . GLU B 1 315 ? 34.901 -13.142 43.197 1.00 62.38 ? 336 GLU B CD 1 ATOM 5455 O OE1 . GLU B 1 315 ? 36.005 -12.747 43.634 1.00 67.36 ? 336 GLU B OE1 1 ATOM 5456 O OE2 . GLU B 1 315 ? 33.799 -12.757 43.656 1.00 61.92 ? 336 GLU B OE2 1 ATOM 5457 N N . CYS B 1 316 ? 34.376 -15.001 38.742 1.00 47.17 ? 337 CYS B N 1 ATOM 5458 C CA . CYS B 1 316 ? 33.646 -14.247 37.737 1.00 53.13 ? 337 CYS B CA 1 ATOM 5459 C C . CYS B 1 316 ? 32.476 -13.536 38.398 1.00 55.45 ? 337 CYS B C 1 ATOM 5460 O O . CYS B 1 316 ? 31.911 -14.023 39.383 1.00 57.11 ? 337 CYS B O 1 ATOM 5461 C CB . CYS B 1 316 ? 33.172 -15.149 36.599 1.00 57.79 ? 337 CYS B CB 1 ATOM 5462 S SG . CYS B 1 316 ? 32.222 -16.565 37.127 1.00 79.26 ? 337 CYS B SG 1 ATOM 5463 N N . LYS B 1 317 ? 32.135 -12.368 37.871 1.00 51.90 ? 338 LYS B N 1 ATOM 5464 C CA . LYS B 1 317 ? 31.047 -11.582 38.424 1.00 47.69 ? 338 LYS B CA 1 ATOM 5465 C C . LYS B 1 317 ? 30.144 -11.067 37.315 1.00 57.88 ? 338 LYS B C 1 ATOM 5466 O O . LYS B 1 317 ? 30.617 -10.544 36.308 1.00 62.40 ? 338 LYS B O 1 ATOM 5467 C CB . LYS B 1 317 ? 31.591 -10.404 39.225 1.00 42.09 ? 338 LYS B CB 1 ATOM 5468 C CG . LYS B 1 317 ? 32.599 -10.779 40.313 1.00 52.26 ? 338 LYS B CG 1 ATOM 5469 C CD . LYS B 1 317 ? 32.953 -9.558 41.153 1.00 55.37 ? 338 LYS B CD 1 ATOM 5470 C CE . LYS B 1 317 ? 34.378 -9.623 41.665 1.00 58.63 ? 338 LYS B CE 1 ATOM 5471 N NZ . LYS B 1 317 ? 34.799 -8.304 42.208 1.00 63.45 ? 338 LYS B NZ 1 ATOM 5472 N N . ALA B 1 318 ? 28.842 -11.223 37.505 1.00 60.43 ? 339 ALA B N 1 ATOM 5473 C CA . ALA B 1 318 ? 27.870 -10.663 36.582 1.00 62.27 ? 339 ALA B CA 1 ATOM 5474 C C . ALA B 1 318 ? 26.804 -9.922 37.371 1.00 72.30 ? 339 ALA B C 1 ATOM 5475 O O . ALA B 1 318 ? 26.502 -10.284 38.506 1.00 74.41 ? 339 ALA B O 1 ATOM 5476 C CB . ALA B 1 318 ? 27.243 -11.762 35.739 1.00 55.71 ? 339 ALA B CB 1 ATOM 5477 N N . ASN B 1 319 ? 26.245 -8.872 36.783 1.00 81.18 ? 340 ASN B N 1 ATOM 5478 C CA . ASN B 1 319 ? 25.061 -8.258 37.366 1.00 87.57 ? 340 ASN B CA 1 ATOM 5479 C C . ASN B 1 319 ? 23.839 -8.472 36.488 1.00 81.16 ? 340 ASN B C 1 ATOM 5480 O O . ASN B 1 319 ? 23.928 -9.105 35.435 1.00 76.59 ? 340 ASN B O 1 ATOM 5481 C CB . ASN B 1 319 ? 25.277 -6.776 37.691 1.00 94.55 ? 340 ASN B CB 1 ATOM 5482 C CG . ASN B 1 319 ? 26.133 -6.067 36.667 1.00 96.38 ? 340 ASN B CG 1 ATOM 5483 O OD1 . ASN B 1 319 ? 25.988 -6.275 35.462 1.00 97.76 ? 340 ASN B OD1 1 ATOM 5484 N ND2 . ASN B 1 319 ? 27.028 -5.210 37.144 1.00 95.66 ? 340 ASN B ND2 1 ATOM 5485 N N . GLY B 1 320 ? 22.703 -7.952 36.941 1.00 82.75 ? 341 GLY B N 1 ATOM 5486 C CA . GLY B 1 320 ? 21.431 -8.137 36.269 1.00 85.15 ? 341 GLY B CA 1 ATOM 5487 C C . GLY B 1 320 ? 20.342 -8.287 37.314 1.00 90.52 ? 341 GLY B C 1 ATOM 5488 O O . GLY B 1 320 ? 20.638 -8.452 38.496 1.00 93.89 ? 341 GLY B O 1 ATOM 5489 N N . ARG B 1 321 ? 19.084 -8.225 36.889 1.00 91.48 ? 342 ARG B N 1 ATOM 5490 C CA . ARG B 1 321 ? 17.965 -8.404 37.809 1.00 94.21 ? 342 ARG B CA 1 ATOM 5491 C C . ARG B 1 321 ? 16.951 -9.398 37.250 1.00 97.49 ? 342 ARG B C 1 ATOM 5492 O O . ARG B 1 321 ? 16.365 -9.161 36.193 1.00 96.33 ? 342 ARG B O 1 ATOM 5493 C CB . ARG B 1 321 ? 17.288 -7.067 38.114 1.00 95.78 ? 342 ARG B CB 1 ATOM 5494 C CG . ARG B 1 321 ? 16.249 -7.156 39.215 1.00 102.93 ? 342 ARG B CG 1 ATOM 5495 C CD . ARG B 1 321 ? 15.618 -5.805 39.513 1.00 112.71 ? 342 ARG B CD 1 ATOM 5496 N NE . ARG B 1 321 ? 16.523 -4.909 40.229 1.00 113.25 ? 342 ARG B NE 1 ATOM 5497 C CZ . ARG B 1 321 ? 16.141 -3.776 40.811 1.00 117.96 ? 342 ARG B CZ 1 ATOM 5498 N NH1 . ARG B 1 321 ? 14.869 -3.398 40.767 1.00 122.52 ? 342 ARG B NH1 1 ATOM 5499 N NH2 . ARG B 1 321 ? 17.029 -3.020 41.441 1.00 116.66 ? 342 ARG B NH2 1 ATOM 5500 N N . PRO B 1 322 ? 16.723 -10.510 37.971 1.00 99.80 ? 343 PRO B N 1 ATOM 5501 C CA . PRO B 1 322 ? 17.264 -10.804 39.306 1.00 99.12 ? 343 PRO B CA 1 ATOM 5502 C C . PRO B 1 322 ? 18.775 -11.014 39.300 1.00 96.41 ? 343 PRO B C 1 ATOM 5503 O O . PRO B 1 322 ? 19.364 -11.182 38.233 1.00 98.42 ? 343 PRO B O 1 ATOM 5504 C CB . PRO B 1 322 ? 16.568 -12.120 39.688 1.00 98.88 ? 343 PRO B CB 1 ATOM 5505 C CG . PRO B 1 322 ? 15.457 -12.296 38.698 1.00 101.06 ? 343 PRO B CG 1 ATOM 5506 C CD . PRO B 1 322 ? 15.922 -11.629 37.453 1.00 99.82 ? 343 PRO B CD 1 ATOM 5507 N N . LYS B 1 323 ? 19.389 -11.010 40.479 1.00 93.33 ? 344 LYS B N 1 ATOM 5508 C CA . LYS B 1 323 ? 20.830 -11.223 40.586 1.00 85.12 ? 344 LYS B CA 1 ATOM 5509 C C . LYS B 1 323 ? 21.203 -12.635 40.144 1.00 80.93 ? 344 LYS B C 1 ATOM 5510 O O . LYS B 1 323 ? 20.713 -13.617 40.702 1.00 84.27 ? 344 LYS B O 1 ATOM 5511 C CB . LYS B 1 323 ? 21.317 -10.959 42.011 1.00 86.72 ? 344 LYS B CB 1 ATOM 5512 C CG . LYS B 1 323 ? 22.825 -11.020 42.163 1.00 91.16 ? 344 LYS B CG 1 ATOM 5513 C CD . LYS B 1 323 ? 23.283 -10.405 43.475 1.00 95.80 ? 344 LYS B CD 1 ATOM 5514 C CE . LYS B 1 323 ? 24.803 -10.329 43.536 1.00 95.24 ? 344 LYS B CE 1 ATOM 5515 N NZ . LYS B 1 323 ? 25.287 -9.601 44.741 1.00 93.52 ? 344 LYS B NZ 1 ATOM 5516 N N . PRO B 1 324 ? 22.071 -12.733 39.129 1.00 75.23 ? 345 PRO B N 1 ATOM 5517 C CA . PRO B 1 324 ? 22.503 -13.979 38.478 1.00 73.34 ? 345 PRO B CA 1 ATOM 5518 C C . PRO B 1 324 ? 23.142 -14.991 39.425 1.00 72.39 ? 345 PRO B C 1 ATOM 5519 O O . PRO B 1 324 ? 23.850 -14.601 40.351 1.00 75.03 ? 345 PRO B O 1 ATOM 5520 C CB . PRO B 1 324 ? 23.552 -13.498 37.473 1.00 69.83 ? 345 PRO B CB 1 ATOM 5521 C CG . PRO B 1 324 ? 23.202 -12.084 37.201 1.00 73.70 ? 345 PRO B CG 1 ATOM 5522 C CD . PRO B 1 324 ? 22.648 -11.542 38.483 1.00 74.75 ? 345 PRO B CD 1 ATOM 5523 N N . THR B 1 325 ? 22.895 -16.276 39.181 1.00 70.42 ? 346 THR B N 1 ATOM 5524 C CA . THR B 1 325 ? 23.607 -17.346 39.876 1.00 74.86 ? 346 THR B CA 1 ATOM 5525 C C . THR B 1 325 ? 24.620 -17.965 38.916 1.00 75.20 ? 346 THR B C 1 ATOM 5526 O O . THR B 1 325 ? 24.505 -17.796 37.704 1.00 75.87 ? 346 THR B O 1 ATOM 5527 C CB . THR B 1 325 ? 22.656 -18.446 40.386 1.00 77.35 ? 346 THR B CB 1 ATOM 5528 O OG1 . THR B 1 325 ? 22.058 -19.123 39.272 1.00 78.96 ? 346 THR B OG1 1 ATOM 5529 C CG2 . THR B 1 325 ? 21.566 -17.855 41.281 1.00 74.95 ? 346 THR B CG2 1 ATOM 5530 N N . TYR B 1 326 ? 25.600 -18.690 39.450 1.00 72.22 ? 347 TYR B N 1 ATOM 5531 C CA . TYR B 1 326 ? 26.699 -19.196 38.627 1.00 68.43 ? 347 TYR B CA 1 ATOM 5532 C C . TYR B 1 326 ? 26.873 -20.713 38.653 1.00 67.80 ? 347 TYR B C 1 ATOM 5533 O O . TYR B 1 326 ? 26.601 -21.362 39.657 1.00 73.54 ? 347 TYR B O 1 ATOM 5534 C CB . TYR B 1 326 ? 28.017 -18.565 39.069 1.00 66.51 ? 347 TYR B CB 1 ATOM 5535 C CG . TYR B 1 326 ? 27.978 -17.069 39.229 1.00 67.79 ? 347 TYR B CG 1 ATOM 5536 C CD1 . TYR B 1 326 ? 27.701 -16.494 40.459 1.00 69.24 ? 347 TYR B CD1 1 ATOM 5537 C CD2 . TYR B 1 326 ? 28.241 -16.226 38.155 1.00 64.17 ? 347 TYR B CD2 1 ATOM 5538 C CE1 . TYR B 1 326 ? 27.673 -15.125 40.620 1.00 67.27 ? 347 TYR B CE1 1 ATOM 5539 C CE2 . TYR B 1 326 ? 28.217 -14.850 38.306 1.00 63.62 ? 347 TYR B CE2 1 ATOM 5540 C CZ . TYR B 1 326 ? 27.932 -14.307 39.546 1.00 65.86 ? 347 TYR B CZ 1 ATOM 5541 O OH . TYR B 1 326 ? 27.904 -12.944 39.722 1.00 64.18 ? 347 TYR B OH 1 ATOM 5542 N N . ARG B 1 327 ? 27.350 -21.268 37.545 1.00 65.70 ? 348 ARG B N 1 ATOM 5543 C CA . ARG B 1 327 ? 27.780 -22.663 37.508 1.00 69.16 ? 348 ARG B CA 1 ATOM 5544 C C . ARG B 1 327 ? 29.042 -22.780 36.656 1.00 70.92 ? 348 ARG B C 1 ATOM 5545 O O . ARG B 1 327 ? 29.421 -21.834 35.968 1.00 69.69 ? 348 ARG B O 1 ATOM 5546 C CB . ARG B 1 327 ? 26.666 -23.586 36.992 1.00 71.72 ? 348 ARG B CB 1 ATOM 5547 C CG . ARG B 1 327 ? 26.182 -23.309 35.572 1.00 73.50 ? 348 ARG B CG 1 ATOM 5548 C CD . ARG B 1 327 ? 24.920 -24.120 35.264 1.00 80.28 ? 348 ARG B CD 1 ATOM 5549 N NE . ARG B 1 327 ? 24.441 -23.929 33.897 1.00 87.31 ? 348 ARG B NE 1 ATOM 5550 C CZ . ARG B 1 327 ? 24.784 -24.702 32.869 1.00 91.53 ? 348 ARG B CZ 1 ATOM 5551 N NH1 . ARG B 1 327 ? 25.612 -25.722 33.051 1.00 94.15 ? 348 ARG B NH1 1 ATOM 5552 N NH2 . ARG B 1 327 ? 24.304 -24.455 31.655 1.00 86.28 ? 348 ARG B NH2 1 ATOM 5553 N N . TRP B 1 328 ? 29.702 -23.932 36.710 1.00 68.86 ? 349 TRP B N 1 ATOM 5554 C CA . TRP B 1 328 ? 30.972 -24.091 36.018 1.00 63.93 ? 349 TRP B CA 1 ATOM 5555 C C . TRP B 1 328 ? 31.001 -25.329 35.143 1.00 66.54 ? 349 TRP B C 1 ATOM 5556 O O . TRP B 1 328 ? 30.273 -26.292 35.383 1.00 69.89 ? 349 TRP B O 1 ATOM 5557 C CB . TRP B 1 328 ? 32.136 -24.162 37.015 1.00 57.64 ? 349 TRP B CB 1 ATOM 5558 C CG . TRP B 1 328 ? 32.334 -22.928 37.836 1.00 54.70 ? 349 TRP B CG 1 ATOM 5559 C CD1 . TRP B 1 328 ? 31.603 -22.543 38.927 1.00 59.34 ? 349 TRP B CD1 1 ATOM 5560 C CD2 . TRP B 1 328 ? 33.339 -21.925 37.654 1.00 49.48 ? 349 TRP B CD2 1 ATOM 5561 N NE1 . TRP B 1 328 ? 32.088 -21.360 39.428 1.00 57.86 ? 349 TRP B NE1 1 ATOM 5562 C CE2 . TRP B 1 328 ? 33.156 -20.960 38.667 1.00 55.27 ? 349 TRP B CE2 1 ATOM 5563 C CE3 . TRP B 1 328 ? 34.384 -21.750 36.738 1.00 46.09 ? 349 TRP B CE3 1 ATOM 5564 C CZ2 . TRP B 1 328 ? 33.971 -19.833 38.785 1.00 52.07 ? 349 TRP B CZ2 1 ATOM 5565 C CZ3 . TRP B 1 328 ? 35.195 -20.629 36.857 1.00 37.75 ? 349 TRP B CZ3 1 ATOM 5566 C CH2 . TRP B 1 328 ? 34.980 -19.684 37.866 1.00 43.11 ? 349 TRP B CH2 1 ATOM 5567 N N . LEU B 1 329 ? 31.870 -25.288 34.138 1.00 64.48 ? 350 LEU B N 1 ATOM 5568 C CA . LEU B 1 329 ? 32.109 -26.414 33.250 1.00 62.45 ? 350 LEU B CA 1 ATOM 5569 C C . LEU B 1 329 ? 33.607 -26.646 33.096 1.00 60.01 ? 350 LEU B C 1 ATOM 5570 O O . LEU B 1 329 ? 34.401 -25.704 33.144 1.00 53.55 ? 350 LEU B O 1 ATOM 5571 C CB . LEU B 1 329 ? 31.532 -26.125 31.867 1.00 62.68 ? 350 LEU B CB 1 ATOM 5572 C CG . LEU B 1 329 ? 30.086 -25.651 31.776 1.00 68.16 ? 350 LEU B CG 1 ATOM 5573 C CD1 . LEU B 1 329 ? 29.763 -25.263 30.334 1.00 65.00 ? 350 LEU B CD1 1 ATOM 5574 C CD2 . LEU B 1 329 ? 29.145 -26.732 32.287 1.00 66.16 ? 350 LEU B CD2 1 ATOM 5575 N N . LYS B 1 330 ? 33.988 -27.904 32.900 1.00 58.59 ? 351 LYS B N 1 ATOM 5576 C CA . LYS B 1 330 ? 35.334 -28.228 32.454 1.00 56.73 ? 351 LYS B CA 1 ATOM 5577 C C . LYS B 1 330 ? 35.213 -29.107 31.225 1.00 58.75 ? 351 LYS B C 1 ATOM 5578 O O . LYS B 1 330 ? 34.656 -30.209 31.288 1.00 57.50 ? 351 LYS B O 1 ATOM 5579 C CB . LYS B 1 330 ? 36.141 -28.943 33.539 1.00 57.63 ? 351 LYS B CB 1 ATOM 5580 C CG . LYS B 1 330 ? 37.599 -29.145 33.162 1.00 55.30 ? 351 LYS B CG 1 ATOM 5581 C CD . LYS B 1 330 ? 38.304 -30.080 34.118 1.00 58.81 ? 351 LYS B CD 1 ATOM 5582 C CE . LYS B 1 330 ? 39.671 -30.474 33.585 1.00 58.93 ? 351 LYS B CE 1 ATOM 5583 N NZ . LYS B 1 330 ? 40.354 -31.411 34.518 1.00 63.05 ? 351 LYS B NZ 1 ATOM 5584 N N . ASN B 1 331 ? 35.722 -28.605 30.105 1.00 59.50 ? 352 ASN B N 1 ATOM 5585 C CA . ASN B 1 331 ? 35.593 -29.296 28.829 1.00 62.72 ? 352 ASN B CA 1 ATOM 5586 C C . ASN B 1 331 ? 34.142 -29.660 28.513 1.00 67.06 ? 352 ASN B C 1 ATOM 5587 O O . ASN B 1 331 ? 33.867 -30.717 27.949 1.00 73.75 ? 352 ASN B O 1 ATOM 5588 C CB . ASN B 1 331 ? 36.490 -30.535 28.801 1.00 58.13 ? 352 ASN B CB 1 ATOM 5589 C CG . ASN B 1 331 ? 37.968 -30.185 28.890 1.00 56.65 ? 352 ASN B CG 1 ATOM 5590 O OD1 . ASN B 1 331 ? 38.394 -29.106 28.464 1.00 49.39 ? 352 ASN B OD1 1 ATOM 5591 N ND2 . ASN B 1 331 ? 38.757 -31.096 29.445 1.00 56.93 ? 352 ASN B ND2 1 ATOM 5592 N N . GLY B 1 332 ? 33.219 -28.779 28.891 1.00 65.62 ? 353 GLY B N 1 ATOM 5593 C CA . GLY B 1 332 ? 31.810 -28.961 28.593 1.00 70.90 ? 353 GLY B CA 1 ATOM 5594 C C . GLY B 1 332 ? 31.008 -29.705 29.647 1.00 76.87 ? 353 GLY B C 1 ATOM 5595 O O . GLY B 1 332 ? 29.777 -29.684 29.619 1.00 78.57 ? 353 GLY B O 1 ATOM 5596 N N . ASP B 1 333 ? 31.695 -30.367 30.574 1.00 78.27 ? 354 ASP B N 1 ATOM 5597 C CA . ASP B 1 333 ? 31.024 -31.164 31.600 1.00 85.69 ? 354 ASP B CA 1 ATOM 5598 C C . ASP B 1 333 ? 30.882 -30.390 32.906 1.00 88.15 ? 354 ASP B C 1 ATOM 5599 O O . ASP B 1 333 ? 31.811 -29.697 33.324 1.00 88.95 ? 354 ASP B O 1 ATOM 5600 C CB . ASP B 1 333 ? 31.789 -32.466 31.852 1.00 94.95 ? 354 ASP B CB 1 ATOM 5601 C CG . ASP B 1 333 ? 31.918 -33.321 30.604 1.00 105.29 ? 354 ASP B CG 1 ATOM 5602 O OD1 . ASP B 1 333 ? 30.931 -33.415 29.841 1.00 110.59 ? 354 ASP B OD1 1 ATOM 5603 O OD2 . ASP B 1 333 ? 33.005 -33.904 30.391 1.00 105.66 ? 354 ASP B OD2 1 ATOM 5604 N N . PRO B 1 334 ? 29.713 -30.511 33.557 1.00 89.12 ? 355 PRO B N 1 ATOM 5605 C CA . PRO B 1 334 ? 29.426 -29.859 34.841 1.00 89.74 ? 355 PRO B CA 1 ATOM 5606 C C . PRO B 1 334 ? 30.528 -30.090 35.874 1.00 90.62 ? 355 PRO B C 1 ATOM 5607 O O . PRO B 1 334 ? 30.874 -31.235 36.160 1.00 96.49 ? 355 PRO B O 1 ATOM 5608 C CB . PRO B 1 334 ? 28.134 -30.542 35.289 1.00 90.45 ? 355 PRO B CB 1 ATOM 5609 C CG . PRO B 1 334 ? 27.463 -30.914 34.016 1.00 92.15 ? 355 PRO B CG 1 ATOM 5610 C CD . PRO B 1 334 ? 28.562 -31.286 33.064 1.00 91.03 ? 355 PRO B CD 1 ATOM 5611 N N . LEU B 1 335 ? 31.061 -29.006 36.430 1.00 84.01 ? 356 LEU B N 1 ATOM 5612 C CA . LEU B 1 335 ? 32.159 -29.088 37.388 1.00 77.43 ? 356 LEU B CA 1 ATOM 5613 C C . LEU B 1 335 ? 31.698 -28.754 38.803 1.00 76.61 ? 356 LEU B C 1 ATOM 5614 O O . LEU B 1 335 ? 31.246 -27.640 39.070 1.00 76.58 ? 356 LEU B O 1 ATOM 5615 C CB . LEU B 1 335 ? 33.283 -28.137 36.979 1.00 73.14 ? 356 LEU B CB 1 ATOM 5616 C CG . LEU B 1 335 ? 34.500 -28.111 37.901 1.00 70.26 ? 356 LEU B CG 1 ATOM 5617 C CD1 . LEU B 1 335 ? 35.233 -29.440 37.824 1.00 73.86 ? 356 LEU B CD1 1 ATOM 5618 C CD2 . LEU B 1 335 ? 35.427 -26.959 37.541 1.00 60.47 ? 356 LEU B CD2 1 ATOM 5619 N N . LEU B 1 336 ? 31.816 -29.720 39.709 1.00 76.67 ? 357 LEU B N 1 ATOM 5620 C CA . LEU B 1 336 ? 31.413 -29.515 41.099 1.00 78.35 ? 357 LEU B CA 1 ATOM 5621 C C . LEU B 1 336 ? 32.561 -29.769 42.065 1.00 75.01 ? 357 LEU B C 1 ATOM 5622 O O . LEU B 1 336 ? 33.555 -30.400 41.709 1.00 74.74 ? 357 LEU B O 1 ATOM 5623 C CB . LEU B 1 336 ? 30.224 -30.408 41.458 1.00 78.94 ? 357 LEU B CB 1 ATOM 5624 C CG . LEU B 1 336 ? 28.848 -29.895 41.034 1.00 74.15 ? 357 LEU B CG 1 ATOM 5625 C CD1 . LEU B 1 336 ? 27.772 -30.842 41.526 1.00 70.54 ? 357 LEU B CD1 1 ATOM 5626 C CD2 . LEU B 1 336 ? 28.624 -28.497 41.585 1.00 73.59 ? 357 LEU B CD2 1 ATOM 5627 N N . THR B 1 337 ? 32.419 -29.277 43.289 1.00 73.15 ? 358 THR B N 1 ATOM 5628 C CA . THR B 1 337 ? 33.456 -29.460 44.295 1.00 77.46 ? 358 THR B CA 1 ATOM 5629 C C . THR B 1 337 ? 33.910 -30.916 44.342 1.00 84.15 ? 358 THR B C 1 ATOM 5630 O O . THR B 1 337 ? 33.095 -31.833 44.240 1.00 87.22 ? 358 THR B O 1 ATOM 5631 C CB . THR B 1 337 ? 32.977 -29.030 45.697 1.00 77.25 ? 358 THR B CB 1 ATOM 5632 O OG1 . THR B 1 337 ? 32.584 -27.652 45.673 1.00 75.95 ? 358 THR B OG1 1 ATOM 5633 C CG2 . THR B 1 337 ? 34.090 -29.213 46.721 1.00 72.50 ? 358 THR B CG2 1 ATOM 5634 N N . ARG B 1 338 ? 35.218 -31.116 44.467 1.00 86.14 ? 359 ARG B N 1 ATOM 5635 C CA . ARG B 1 338 ? 35.780 -32.441 44.706 1.00 91.01 ? 359 ARG B CA 1 ATOM 5636 C C . ARG B 1 338 ? 37.210 -32.317 45.232 1.00 90.01 ? 359 ARG B C 1 ATOM 5637 O O . ARG B 1 338 ? 37.583 -31.275 45.776 1.00 84.48 ? 359 ARG B O 1 ATOM 5638 C CB . ARG B 1 338 ? 35.704 -33.331 43.456 1.00 91.32 ? 359 ARG B CB 1 ATOM 5639 C CG . ARG B 1 338 ? 36.796 -33.118 42.422 1.00 93.23 ? 359 ARG B CG 1 ATOM 5640 C CD . ARG B 1 338 ? 36.376 -32.144 41.336 1.00 101.21 ? 359 ARG B CD 1 ATOM 5641 N NE . ARG B 1 338 ? 37.294 -32.185 40.200 1.00 105.82 ? 359 ARG B NE 1 ATOM 5642 C CZ . ARG B 1 338 ? 37.042 -32.809 39.053 1.00 110.17 ? 359 ARG B CZ 1 ATOM 5643 N NH1 . ARG B 1 338 ? 35.888 -33.441 38.875 1.00 111.63 ? 359 ARG B NH1 1 ATOM 5644 N NH2 . ARG B 1 338 ? 37.943 -32.792 38.078 1.00 108.70 ? 359 ARG B NH2 1 ATOM 5645 N N . ASP B 1 339 ? 38.005 -33.372 45.081 1.00 93.77 ? 360 ASP B N 1 ATOM 5646 C CA . ASP B 1 339 ? 39.360 -33.373 45.629 1.00 96.61 ? 360 ASP B CA 1 ATOM 5647 C C . ASP B 1 339 ? 40.235 -32.292 45.005 1.00 86.68 ? 360 ASP B C 1 ATOM 5648 O O . ASP B 1 339 ? 40.436 -32.272 43.790 1.00 81.52 ? 360 ASP B O 1 ATOM 5649 C CB . ASP B 1 339 ? 40.020 -34.745 45.461 1.00 105.19 ? 360 ASP B CB 1 ATOM 5650 C CG . ASP B 1 339 ? 41.245 -34.917 46.349 1.00 108.86 ? 360 ASP B CG 1 ATOM 5651 O OD1 . ASP B 1 339 ? 41.461 -34.072 47.249 1.00 103.73 ? 360 ASP B OD1 1 ATOM 5652 O OD2 . ASP B 1 339 ? 41.991 -35.900 46.150 1.00 112.27 ? 360 ASP B OD2 1 ATOM 5653 N N . ARG B 1 340 ? 40.750 -31.402 45.851 1.00 81.26 ? 361 ARG B N 1 ATOM 5654 C CA . ARG B 1 340 ? 41.612 -30.294 45.426 1.00 81.01 ? 361 ARG B CA 1 ATOM 5655 C C . ARG B 1 340 ? 40.852 -29.129 44.791 1.00 81.75 ? 361 ARG B C 1 ATOM 5656 O O . ARG B 1 340 ? 41.314 -27.991 44.830 1.00 84.96 ? 361 ARG B O 1 ATOM 5657 C CB . ARG B 1 340 ? 42.717 -30.769 44.477 1.00 73.79 ? 361 ARG B CB 1 ATOM 5658 C CG . ARG B 1 340 ? 43.749 -31.677 45.116 1.00 69.12 ? 361 ARG B CG 1 ATOM 5659 C CD . ARG B 1 340 ? 44.677 -32.253 44.058 1.00 70.03 ? 361 ARG B CD 1 ATOM 5660 N NE . ARG B 1 340 ? 43.957 -32.595 42.831 1.00 69.83 ? 361 ARG B NE 1 ATOM 5661 C CZ . ARG B 1 340 ? 44.002 -31.880 41.710 1.00 64.02 ? 361 ARG B CZ 1 ATOM 5662 N NH1 . ARG B 1 340 ? 44.742 -30.776 41.648 1.00 49.13 ? 361 ARG B NH1 1 ATOM 5663 N NH2 . ARG B 1 340 ? 43.310 -32.270 40.646 1.00 67.91 ? 361 ARG B NH2 1 ATOM 5664 N N . ILE B 1 341 ? 39.692 -29.412 44.207 1.00 80.59 ? 362 ILE B N 1 ATOM 5665 C CA . ILE B 1 341 ? 38.907 -28.370 43.547 1.00 76.88 ? 362 ILE B CA 1 ATOM 5666 C C . ILE B 1 341 ? 37.671 -27.953 44.351 1.00 75.98 ? 362 ILE B C 1 ATOM 5667 O O . ILE B 1 341 ? 36.769 -28.750 44.596 1.00 78.68 ? 362 ILE B O 1 ATOM 5668 C CB . ILE B 1 341 ? 38.503 -28.787 42.119 1.00 72.27 ? 362 ILE B CB 1 ATOM 5669 C CG1 . ILE B 1 341 ? 39.756 -29.079 41.290 1.00 74.21 ? 362 ILE B CG1 1 ATOM 5670 C CG2 . ILE B 1 341 ? 37.661 -27.707 41.463 1.00 65.50 ? 362 ILE B CG2 1 ATOM 5671 C CD1 . ILE B 1 341 ? 39.498 -29.180 39.808 1.00 80.17 ? 362 ILE B CD1 1 ATOM 5672 N N . GLN B 1 342 ? 37.647 -26.691 44.759 1.00 73.93 ? 363 GLN B N 1 ATOM 5673 C CA . GLN B 1 342 ? 36.540 -26.147 45.525 1.00 74.27 ? 363 GLN B CA 1 ATOM 5674 C C . GLN B 1 342 ? 35.723 -25.170 44.688 1.00 68.30 ? 363 GLN B C 1 ATOM 5675 O O . GLN B 1 342 ? 36.197 -24.087 44.342 1.00 63.94 ? 363 GLN B O 1 ATOM 5676 C CB . GLN B 1 342 ? 37.061 -25.443 46.778 1.00 81.92 ? 363 GLN B CB 1 ATOM 5677 C CG . GLN B 1 342 ? 36.010 -24.615 47.493 1.00 94.83 ? 363 GLN B CG 1 ATOM 5678 C CD . GLN B 1 342 ? 36.614 -23.597 48.441 1.00 103.99 ? 363 GLN B CD 1 ATOM 5679 O OE1 . GLN B 1 342 ? 35.898 -22.803 49.054 1.00 108.17 ? 363 GLN B OE1 1 ATOM 5680 N NE2 . GLN B 1 342 ? 37.938 -23.613 48.564 1.00 103.77 ? 363 GLN B NE2 1 ATOM 5681 N N . ILE B 1 343 ? 34.497 -25.563 44.363 1.00 68.84 ? 364 ILE B N 1 ATOM 5682 C CA . ILE B 1 343 ? 33.570 -24.703 43.639 1.00 66.20 ? 364 ILE B CA 1 ATOM 5683 C C . ILE B 1 343 ? 32.551 -24.122 44.602 1.00 74.94 ? 364 ILE B C 1 ATOM 5684 O O . ILE B 1 343 ? 31.709 -24.848 45.130 1.00 79.38 ? 364 ILE B O 1 ATOM 5685 C CB . ILE B 1 343 ? 32.779 -25.487 42.580 1.00 65.64 ? 364 ILE B CB 1 ATOM 5686 C CG1 . ILE B 1 343 ? 33.711 -26.019 41.492 1.00 65.06 ? 364 ILE B CG1 1 ATOM 5687 C CG2 . ILE B 1 343 ? 31.680 -24.618 41.986 1.00 67.45 ? 364 ILE B CG2 1 ATOM 5688 C CD1 . ILE B 1 343 ? 34.755 -25.033 41.059 1.00 64.43 ? 364 ILE B CD1 1 ATOM 5689 N N . GLU B 1 344 ? 32.622 -22.818 44.838 1.00 73.14 ? 365 GLU B N 1 ATOM 5690 C CA . GLU B 1 344 ? 31.601 -22.167 45.642 1.00 72.22 ? 365 GLU B CA 1 ATOM 5691 C C . GLU B 1 344 ? 31.051 -20.939 44.933 1.00 72.42 ? 365 GLU B C 1 ATOM 5692 O O . GLU B 1 344 ? 31.656 -19.866 44.958 1.00 72.34 ? 365 GLU B O 1 ATOM 5693 C CB . GLU B 1 344 ? 32.122 -21.797 47.029 1.00 77.07 ? 365 GLU B CB 1 ATOM 5694 C CG . GLU B 1 344 ? 31.082 -22.028 48.114 1.00 91.56 ? 365 GLU B CG 1 ATOM 5695 C CD . GLU B 1 344 ? 30.881 -20.822 49.006 1.00 98.52 ? 365 GLU B CD 1 ATOM 5696 O OE1 . GLU B 1 344 ? 31.871 -20.112 49.291 1.00 103.58 ? 365 GLU B OE1 1 ATOM 5697 O OE2 . GLU B 1 344 ? 29.727 -20.584 49.416 1.00 97.56 ? 365 GLU B OE2 1 ATOM 5698 N N . GLN B 1 345 ? 29.899 -21.119 44.296 1.00 72.53 ? 366 GLN B N 1 ATOM 5699 C CA . GLN B 1 345 ? 29.213 -20.045 43.594 1.00 68.52 ? 366 GLN B CA 1 ATOM 5700 C C . GLN B 1 345 ? 30.046 -19.523 42.437 1.00 68.58 ? 366 GLN B C 1 ATOM 5701 O O . GLN B 1 345 ? 30.431 -20.286 41.553 1.00 76.09 ? 366 GLN B O 1 ATOM 5702 C CB . GLN B 1 345 ? 28.835 -18.918 44.556 1.00 66.91 ? 366 GLN B CB 1 ATOM 5703 C CG . GLN B 1 345 ? 27.727 -19.309 45.524 1.00 75.56 ? 366 GLN B CG 1 ATOM 5704 C CD . GLN B 1 345 ? 27.358 -18.191 46.468 1.00 79.77 ? 366 GLN B CD 1 ATOM 5705 O OE1 . GLN B 1 345 ? 28.078 -17.911 47.425 1.00 83.04 ? 366 GLN B OE1 1 ATOM 5706 N NE2 . GLN B 1 345 ? 26.226 -17.548 46.209 1.00 79.50 ? 366 GLN B NE2 1 ATOM 5707 N N . GLY B 1 346 ? 30.325 -18.226 42.440 1.00 62.37 ? 367 GLY B N 1 ATOM 5708 C CA . GLY B 1 346 ? 31.053 -17.623 41.341 1.00 61.32 ? 367 GLY B CA 1 ATOM 5709 C C . GLY B 1 346 ? 32.561 -17.728 41.473 1.00 51.37 ? 367 GLY B C 1 ATOM 5710 O O . GLY B 1 346 ? 33.290 -16.977 40.831 1.00 49.74 ? 367 GLY B O 1 ATOM 5711 N N . THR B 1 347 ? 33.035 -18.652 42.304 1.00 44.96 ? 368 THR B N 1 ATOM 5712 C CA . THR B 1 347 ? 34.469 -18.769 42.558 1.00 48.46 ? 368 THR B CA 1 ATOM 5713 C C . THR B 1 347 ? 34.964 -20.201 42.409 1.00 49.99 ? 368 THR B C 1 ATOM 5714 O O . THR B 1 347 ? 34.254 -21.160 42.719 1.00 44.96 ? 368 THR B O 1 ATOM 5715 C CB . THR B 1 347 ? 34.854 -18.254 43.961 1.00 55.58 ? 368 THR B CB 1 ATOM 5716 O OG1 . THR B 1 347 ? 34.477 -19.219 44.953 1.00 58.54 ? 368 THR B OG1 1 ATOM 5717 C CG2 . THR B 1 347 ? 34.171 -16.917 44.257 1.00 54.56 ? 368 THR B CG2 1 ATOM 5718 N N . LEU B 1 348 ? 36.198 -20.334 41.941 1.00 47.65 ? 369 LEU B N 1 ATOM 5719 C CA . LEU B 1 348 ? 36.796 -21.639 41.721 1.00 49.50 ? 369 LEU B CA 1 ATOM 5720 C C . LEU B 1 348 ? 38.212 -21.598 42.257 1.00 44.14 ? 369 LEU B C 1 ATOM 5721 O O . LEU B 1 348 ? 39.009 -20.765 41.838 1.00 51.55 ? 369 LEU B O 1 ATOM 5722 C CB . LEU B 1 348 ? 36.798 -21.983 40.223 1.00 50.94 ? 369 LEU B CB 1 ATOM 5723 C CG . LEU B 1 348 ? 37.611 -23.196 39.755 1.00 55.64 ? 369 LEU B CG 1 ATOM 5724 C CD1 . LEU B 1 348 ? 37.102 -23.695 38.418 1.00 62.94 ? 369 LEU B CD1 1 ATOM 5725 C CD2 . LEU B 1 348 ? 39.102 -22.891 39.672 1.00 54.27 ? 369 LEU B CD2 1 ATOM 5726 N N . ASN B 1 349 ? 38.522 -22.485 43.193 1.00 52.15 ? 370 ASN B N 1 ATOM 5727 C CA . ASN B 1 349 ? 39.862 -22.548 43.762 1.00 55.07 ? 370 ASN B CA 1 ATOM 5728 C C . ASN B 1 349 ? 40.451 -23.931 43.577 1.00 59.85 ? 370 ASN B C 1 ATOM 5729 O O . ASN B 1 349 ? 39.848 -24.927 43.981 1.00 65.16 ? 370 ASN B O 1 ATOM 5730 C CB . ASN B 1 349 ? 39.845 -22.186 45.253 1.00 69.57 ? 370 ASN B CB 1 ATOM 5731 C CG . ASN B 1 349 ? 41.242 -22.148 45.869 1.00 91.90 ? 370 ASN B CG 1 ATOM 5732 O OD1 . ASN B 1 349 ? 42.236 -21.924 45.180 1.00 92.19 ? 370 ASN B OD1 1 ATOM 5733 N ND2 . ASN B 1 349 ? 41.316 -22.361 47.179 1.00 119.72 ? 370 ASN B ND2 1 ATOM 5734 N N . ILE B 1 350 ? 41.619 -23.996 42.946 1.00 55.34 ? 371 ILE B N 1 ATOM 5735 C CA . ILE B 1 350 ? 42.388 -25.233 42.913 1.00 53.97 ? 371 ILE B CA 1 ATOM 5736 C C . ILE B 1 350 ? 43.581 -25.088 43.847 1.00 52.24 ? 371 ILE B C 1 ATOM 5737 O O . ILE B 1 350 ? 44.414 -24.203 43.671 1.00 48.40 ? 371 ILE B O 1 ATOM 5738 C CB . ILE B 1 350 ? 42.860 -25.575 41.503 1.00 50.96 ? 371 ILE B CB 1 ATOM 5739 C CG1 . ILE B 1 350 ? 41.651 -25.826 40.597 1.00 48.36 ? 371 ILE B CG1 1 ATOM 5740 C CG2 . ILE B 1 350 ? 43.771 -26.794 41.526 1.00 47.34 ? 371 ILE B CG2 1 ATOM 5741 C CD1 . ILE B 1 350 ? 42.016 -25.974 39.153 1.00 44.06 ? 371 ILE B CD1 1 ATOM 5742 N N . THR B 1 351 ? 43.648 -25.949 44.852 1.00 49.71 ? 372 THR B N 1 ATOM 5743 C CA . THR B 1 351 ? 44.655 -25.808 45.891 1.00 57.31 ? 372 THR B CA 1 ATOM 5744 C C . THR B 1 351 ? 46.049 -26.203 45.409 1.00 52.94 ? 372 THR B C 1 ATOM 5745 O O . THR B 1 351 ? 47.012 -25.469 45.607 1.00 48.73 ? 372 THR B O 1 ATOM 5746 C CB . THR B 1 351 ? 44.288 -26.645 47.119 1.00 65.27 ? 372 THR B CB 1 ATOM 5747 O OG1 . THR B 1 351 ? 43.935 -27.966 46.695 1.00 69.07 ? 372 THR B OG1 1 ATOM 5748 C CG2 . THR B 1 351 ? 43.108 -26.021 47.848 1.00 66.51 ? 372 THR B CG2 1 ATOM 5749 N N . ILE B 1 352 ? 46.156 -27.368 44.784 1.00 52.64 ? 373 ILE B N 1 ATOM 5750 C CA . ILE B 1 352 ? 47.446 -27.861 44.322 1.00 52.37 ? 373 ILE B CA 1 ATOM 5751 C C . ILE B 1 352 ? 47.301 -28.339 42.890 1.00 48.31 ? 373 ILE B C 1 ATOM 5752 O O . ILE B 1 352 ? 46.942 -29.487 42.646 1.00 54.82 ? 373 ILE B O 1 ATOM 5753 C CB . ILE B 1 352 ? 47.959 -29.011 45.213 1.00 53.68 ? 373 ILE B CB 1 ATOM 5754 C CG1 . ILE B 1 352 ? 48.158 -28.518 46.645 1.00 53.43 ? 373 ILE B CG1 1 ATOM 5755 C CG2 . ILE B 1 352 ? 49.258 -29.592 44.674 1.00 44.50 ? 373 ILE B CG2 1 ATOM 5756 C CD1 . ILE B 1 352 ? 48.444 -29.630 47.620 1.00 53.59 ? 373 ILE B CD1 1 ATOM 5757 N N . VAL B 1 353 ? 47.566 -27.444 41.945 1.00 44.29 ? 374 VAL B N 1 ATOM 5758 C CA . VAL B 1 353 ? 47.349 -27.740 40.535 1.00 37.63 ? 374 VAL B CA 1 ATOM 5759 C C . VAL B 1 353 ? 48.284 -28.846 40.041 1.00 40.58 ? 374 VAL B C 1 ATOM 5760 O O . VAL B 1 353 ? 49.462 -28.891 40.403 1.00 42.97 ? 374 VAL B O 1 ATOM 5761 C CB . VAL B 1 353 ? 47.521 -26.473 39.667 1.00 34.94 ? 374 VAL B CB 1 ATOM 5762 C CG1 . VAL B 1 353 ? 48.984 -26.128 39.522 1.00 35.38 ? 374 VAL B CG1 1 ATOM 5763 C CG2 . VAL B 1 353 ? 46.904 -26.674 38.306 1.00 46.13 ? 374 VAL B CG2 1 ATOM 5764 N N . ASN B 1 354 ? 47.745 -29.747 39.224 1.00 45.98 ? 375 ASN B N 1 ATOM 5765 C CA . ASN B 1 354 ? 48.561 -30.743 38.534 1.00 45.16 ? 375 ASN B CA 1 ATOM 5766 C C . ASN B 1 354 ? 48.225 -30.819 37.037 1.00 48.49 ? 375 ASN B C 1 ATOM 5767 O O . ASN B 1 354 ? 47.279 -30.181 36.569 1.00 42.78 ? 375 ASN B O 1 ATOM 5768 C CB . ASN B 1 354 ? 48.474 -32.119 39.214 1.00 56.33 ? 375 ASN B CB 1 ATOM 5769 C CG . ASN B 1 354 ? 47.080 -32.729 39.151 1.00 66.65 ? 375 ASN B CG 1 ATOM 5770 O OD1 . ASN B 1 354 ? 46.549 -32.980 38.072 1.00 72.36 ? 375 ASN B OD1 1 ATOM 5771 N ND2 . ASN B 1 354 ? 46.495 -32.997 40.314 1.00 67.17 ? 375 ASN B ND2 1 ATOM 5772 N N . LEU B 1 355 ? 49.017 -31.587 36.296 1.00 52.10 ? 376 LEU B N 1 ATOM 5773 C CA . LEU B 1 355 ? 48.861 -31.714 34.850 1.00 49.14 ? 376 LEU B CA 1 ATOM 5774 C C . LEU B 1 355 ? 47.435 -32.039 34.437 1.00 48.71 ? 376 LEU B C 1 ATOM 5775 O O . LEU B 1 355 ? 46.920 -31.479 33.467 1.00 52.59 ? 376 LEU B O 1 ATOM 5776 C CB . LEU B 1 355 ? 49.811 -32.776 34.307 1.00 54.63 ? 376 LEU B CB 1 ATOM 5777 C CG . LEU B 1 355 ? 51.294 -32.433 34.434 1.00 62.35 ? 376 LEU B CG 1 ATOM 5778 C CD1 . LEU B 1 355 ? 52.153 -33.657 34.167 1.00 67.62 ? 376 LEU B CD1 1 ATOM 5779 C CD2 . LEU B 1 355 ? 51.650 -31.298 33.490 1.00 66.07 ? 376 LEU B CD2 1 ATOM 5780 N N . SER B 1 356 ? 46.796 -32.932 35.181 1.00 48.27 ? 377 SER B N 1 ATOM 5781 C CA . SER B 1 356 ? 45.442 -33.366 34.857 1.00 49.89 ? 377 SER B CA 1 ATOM 5782 C C . SER B 1 356 ? 44.436 -32.219 34.926 1.00 53.60 ? 377 SER B C 1 ATOM 5783 O O . SER B 1 356 ? 43.337 -32.320 34.377 1.00 58.67 ? 377 SER B O 1 ATOM 5784 C CB . SER B 1 356 ? 45.006 -34.515 35.773 1.00 52.46 ? 377 SER B CB 1 ATOM 5785 O OG . SER B 1 356 ? 44.410 -34.026 36.964 1.00 55.02 ? 377 SER B OG 1 ATOM 5786 N N . ASP B 1 357 ? 44.809 -31.127 35.591 1.00 42.54 ? 378 ASP B N 1 ATOM 5787 C CA . ASP B 1 357 ? 43.924 -29.964 35.683 1.00 47.40 ? 378 ASP B CA 1 ATOM 5788 C C . ASP B 1 357 ? 43.912 -29.081 34.427 1.00 50.00 ? 378 ASP B C 1 ATOM 5789 O O . ASP B 1 357 ? 43.018 -28.248 34.258 1.00 51.34 ? 378 ASP B O 1 ATOM 5790 C CB . ASP B 1 357 ? 44.256 -29.133 36.916 1.00 59.12 ? 378 ASP B CB 1 ATOM 5791 C CG . ASP B 1 357 ? 44.023 -29.897 38.203 1.00 77.07 ? 378 ASP B CG 1 ATOM 5792 O OD1 . ASP B 1 357 ? 42.897 -30.410 38.388 1.00 87.25 ? 378 ASP B OD1 1 ATOM 5793 O OD2 . ASP B 1 357 ? 44.960 -29.988 39.027 1.00 76.88 ? 378 ASP B OD2 1 ATOM 5794 N N . ALA B 1 358 ? 44.898 -29.253 33.550 1.00 41.63 ? 379 ALA B N 1 ATOM 5795 C CA . ALA B 1 358 ? 44.918 -28.485 32.311 1.00 40.85 ? 379 ALA B CA 1 ATOM 5796 C C . ALA B 1 358 ? 43.660 -28.821 31.525 1.00 46.38 ? 379 ALA B C 1 ATOM 5797 O O . ALA B 1 358 ? 43.270 -29.981 31.451 1.00 48.59 ? 379 ALA B O 1 ATOM 5798 C CB . ALA B 1 358 ? 46.164 -28.797 31.492 1.00 32.63 ? 379 ALA B CB 1 ATOM 5799 N N . GLY B 1 359 ? 43.022 -27.803 30.958 1.00 49.55 ? 380 GLY B N 1 ATOM 5800 C CA . GLY B 1 359 ? 41.786 -27.988 30.215 1.00 54.35 ? 380 GLY B CA 1 ATOM 5801 C C . GLY B 1 359 ? 41.083 -26.664 29.988 1.00 50.15 ? 380 GLY B C 1 ATOM 5802 O O . GLY B 1 359 ? 41.612 -25.612 30.345 1.00 43.13 ? 380 GLY B O 1 ATOM 5803 N N . MET B 1 360 ? 39.895 -26.710 29.390 1.00 51.75 ? 381 MET B N 1 ATOM 5804 C CA . MET B 1 360 ? 39.097 -25.506 29.184 1.00 42.44 ? 381 MET B CA 1 ATOM 5805 C C . MET B 1 360 ? 38.016 -25.379 30.249 1.00 45.89 ? 381 MET B C 1 ATOM 5806 O O . MET B 1 360 ? 37.308 -26.337 30.560 1.00 45.82 ? 381 MET B O 1 ATOM 5807 C CB . MET B 1 360 ? 38.487 -25.493 27.786 1.00 50.47 ? 381 MET B CB 1 ATOM 5808 C CG . MET B 1 360 ? 39.505 -25.672 26.667 1.00 46.03 ? 381 MET B CG 1 ATOM 5809 S SD . MET B 1 360 ? 40.719 -24.334 26.515 1.00 48.35 ? 381 MET B SD 1 ATOM 5810 C CE . MET B 1 360 ? 39.659 -22.906 26.301 1.00 47.84 ? 381 MET B CE 1 ATOM 5811 N N . TYR B 1 361 ? 37.907 -24.193 30.829 1.00 50.06 ? 382 TYR B N 1 ATOM 5812 C CA . TYR B 1 361 ? 36.953 -23.969 31.904 1.00 49.28 ? 382 TYR B CA 1 ATOM 5813 C C . TYR B 1 361 ? 36.000 -22.876 31.507 1.00 51.31 ? 382 TYR B C 1 ATOM 5814 O O . TYR B 1 361 ? 36.342 -21.993 30.715 1.00 49.61 ? 382 TYR B O 1 ATOM 5815 C CB . TYR B 1 361 ? 37.668 -23.566 33.197 1.00 42.52 ? 382 TYR B CB 1 ATOM 5816 C CG . TYR B 1 361 ? 38.488 -24.674 33.794 1.00 45.59 ? 382 TYR B CG 1 ATOM 5817 C CD1 . TYR B 1 361 ? 39.672 -25.081 33.200 1.00 44.87 ? 382 TYR B CD1 1 ATOM 5818 C CD2 . TYR B 1 361 ? 38.074 -25.319 34.952 1.00 47.73 ? 382 TYR B CD2 1 ATOM 5819 C CE1 . TYR B 1 361 ? 40.421 -26.101 33.744 1.00 50.39 ? 382 TYR B CE1 1 ATOM 5820 C CE2 . TYR B 1 361 ? 38.817 -26.334 35.502 1.00 44.94 ? 382 TYR B CE2 1 ATOM 5821 C CZ . TYR B 1 361 ? 39.985 -26.723 34.897 1.00 48.42 ? 382 TYR B CZ 1 ATOM 5822 O OH . TYR B 1 361 ? 40.722 -27.739 35.456 1.00 57.65 ? 382 TYR B OH 1 ATOM 5823 N N . GLN B 1 362 ? 34.801 -22.929 32.069 1.00 51.09 ? 383 GLN B N 1 ATOM 5824 C CA . GLN B 1 362 ? 33.807 -21.916 31.779 1.00 53.17 ? 383 GLN B CA 1 ATOM 5825 C C . GLN B 1 362 ? 32.987 -21.570 33.011 1.00 56.62 ? 383 GLN B C 1 ATOM 5826 O O . GLN B 1 362 ? 32.550 -22.447 33.759 1.00 55.94 ? 383 GLN B O 1 ATOM 5827 C CB . GLN B 1 362 ? 32.896 -22.371 30.631 1.00 52.42 ? 383 GLN B CB 1 ATOM 5828 C CG . GLN B 1 362 ? 33.561 -22.312 29.251 1.00 53.78 ? 383 GLN B CG 1 ATOM 5829 C CD . GLN B 1 362 ? 32.657 -22.804 28.130 1.00 55.96 ? 383 GLN B CD 1 ATOM 5830 O OE1 . GLN B 1 362 ? 32.330 -23.990 28.053 1.00 54.20 ? 383 GLN B OE1 1 ATOM 5831 N NE2 . GLN B 1 362 ? 32.258 -21.893 27.249 1.00 52.11 ? 383 GLN B NE2 1 ATOM 5832 N N . CYS B 1 363 ? 32.797 -20.278 33.227 1.00 55.19 ? 384 CYS B N 1 ATOM 5833 C CA . CYS B 1 363 ? 31.822 -19.830 34.195 1.00 59.76 ? 384 CYS B CA 1 ATOM 5834 C C . CYS B 1 363 ? 30.541 -19.479 33.456 1.00 60.21 ? 384 CYS B C 1 ATOM 5835 O O . CYS B 1 363 ? 30.577 -18.900 32.372 1.00 61.51 ? 384 CYS B O 1 ATOM 5836 C CB . CYS B 1 363 ? 32.335 -18.623 34.976 1.00 66.32 ? 384 CYS B CB 1 ATOM 5837 S SG . CYS B 1 363 ? 31.254 -18.173 36.355 1.00 84.99 ? 384 CYS B SG 1 ATOM 5838 N N . VAL B 1 364 ? 29.410 -19.841 34.046 1.00 63.49 ? 385 VAL B N 1 ATOM 5839 C CA . VAL B 1 364 ? 28.114 -19.566 33.456 1.00 65.46 ? 385 VAL B CA 1 ATOM 5840 C C . VAL B 1 364 ? 27.264 -18.802 34.459 1.00 69.92 ? 385 VAL B C 1 ATOM 5841 O O . VAL B 1 364 ? 27.111 -19.224 35.606 1.00 71.51 ? 385 VAL B O 1 ATOM 5842 C CB . VAL B 1 364 ? 27.401 -20.868 33.072 1.00 72.56 ? 385 VAL B CB 1 ATOM 5843 C CG1 . VAL B 1 364 ? 26.100 -20.570 32.340 1.00 72.39 ? 385 VAL B CG1 1 ATOM 5844 C CG2 . VAL B 1 364 ? 28.322 -21.734 32.220 1.00 75.59 ? 385 VAL B CG2 1 ATOM 5845 N N . ALA B 1 365 ? 26.728 -17.666 34.026 1.00 66.15 ? 386 ALA B N 1 ATOM 5846 C CA . ALA B 1 365 ? 25.900 -16.835 34.887 1.00 60.47 ? 386 ALA B CA 1 ATOM 5847 C C . ALA B 1 365 ? 24.512 -16.713 34.276 1.00 68.77 ? 386 ALA B C 1 ATOM 5848 O O . ALA B 1 365 ? 24.377 -16.416 33.090 1.00 65.95 ? 386 ALA B O 1 ATOM 5849 C CB . ALA B 1 365 ? 26.528 -15.466 35.067 1.00 49.42 ? 386 ALA B CB 1 ATOM 5850 N N . GLU B 1 366 ? 23.483 -16.940 35.087 1.00 72.75 ? 387 GLU B N 1 ATOM 5851 C CA . GLU B 1 366 ? 22.124 -17.026 34.569 1.00 83.22 ? 387 GLU B CA 1 ATOM 5852 C C . GLU B 1 366 ? 21.074 -16.503 35.531 1.00 83.91 ? 387 GLU B C 1 ATOM 5853 O O . GLU B 1 366 ? 21.282 -16.471 36.741 1.00 84.86 ? 387 GLU B O 1 ATOM 5854 C CB . GLU B 1 366 ? 21.796 -18.476 34.212 1.00 92.10 ? 387 GLU B CB 1 ATOM 5855 C CG . GLU B 1 366 ? 22.298 -19.490 35.233 1.00 96.36 ? 387 GLU B CG 1 ATOM 5856 C CD . GLU B 1 366 ? 22.045 -20.922 34.801 1.00 100.33 ? 387 GLU B CD 1 ATOM 5857 O OE1 . GLU B 1 366 ? 23.015 -21.708 34.742 1.00 91.44 ? 387 GLU B OE1 1 ATOM 5858 O OE2 . GLU B 1 366 ? 20.877 -21.258 34.509 1.00 110.13 ? 387 GLU B OE2 1 ATOM 5859 N N . ASN B 1 367 ? 19.948 -16.086 34.965 1.00 89.38 ? 388 ASN B N 1 ATOM 5860 C CA . ASN B 1 367 ? 18.749 -15.766 35.727 1.00 93.73 ? 388 ASN B CA 1 ATOM 5861 C C . ASN B 1 367 ? 17.536 -15.988 34.838 1.00 101.08 ? 388 ASN B C 1 ATOM 5862 O O . ASN B 1 367 ? 17.669 -16.509 33.731 1.00 103.34 ? 388 ASN B O 1 ATOM 5863 C CB . ASN B 1 367 ? 18.786 -14.329 36.250 1.00 90.53 ? 388 ASN B CB 1 ATOM 5864 C CG . ASN B 1 367 ? 18.790 -13.299 35.138 1.00 85.77 ? 388 ASN B CG 1 ATOM 5865 O OD1 . ASN B 1 367 ? 18.654 -13.632 33.960 1.00 79.66 ? 388 ASN B OD1 1 ATOM 5866 N ND2 . ASN B 1 367 ? 18.949 -12.034 35.511 1.00 85.37 ? 388 ASN B ND2 1 ATOM 5867 N N . LYS B 1 368 ? 16.361 -15.591 35.318 1.00 107.12 ? 389 LYS B N 1 ATOM 5868 C CA . LYS B 1 368 ? 15.114 -15.790 34.579 1.00 107.92 ? 389 LYS B CA 1 ATOM 5869 C C . LYS B 1 368 ? 15.196 -15.392 33.105 1.00 107.13 ? 389 LYS B C 1 ATOM 5870 O O . LYS B 1 368 ? 14.621 -16.059 32.245 1.00 105.32 ? 389 LYS B O 1 ATOM 5871 C CB . LYS B 1 368 ? 13.969 -15.014 35.235 1.00 109.89 ? 389 LYS B CB 1 ATOM 5872 C CG . LYS B 1 368 ? 13.337 -15.690 36.437 1.00 113.00 ? 389 LYS B CG 1 ATOM 5873 C CD . LYS B 1 368 ? 12.121 -14.907 36.908 1.00 118.23 ? 389 LYS B CD 1 ATOM 5874 C CE . LYS B 1 368 ? 11.330 -15.674 37.951 1.00 121.21 ? 389 LYS B CE 1 ATOM 5875 N NZ . LYS B 1 368 ? 10.072 -14.958 38.299 1.00 125.06 ? 389 LYS B NZ 1 ATOM 5876 N N . HIS B 1 369 ? 15.909 -14.307 32.817 1.00 109.01 ? 390 HIS B N 1 ATOM 5877 C CA . HIS B 1 369 ? 15.842 -13.690 31.494 1.00 111.24 ? 390 HIS B CA 1 ATOM 5878 C C . HIS B 1 369 ? 17.046 -13.937 30.580 1.00 107.20 ? 390 HIS B C 1 ATOM 5879 O O . HIS B 1 369 ? 17.177 -13.276 29.550 1.00 110.05 ? 390 HIS B O 1 ATOM 5880 C CB . HIS B 1 369 ? 15.611 -12.180 31.623 1.00 114.46 ? 390 HIS B CB 1 ATOM 5881 C CG . HIS B 1 369 ? 14.700 -11.798 32.749 1.00 120.18 ? 390 HIS B CG 1 ATOM 5882 N ND1 . HIS B 1 369 ? 13.373 -12.167 32.792 1.00 125.72 ? 390 HIS B ND1 1 ATOM 5883 C CD2 . HIS B 1 369 ? 14.923 -11.066 33.866 1.00 121.55 ? 390 HIS B CD2 1 ATOM 5884 C CE1 . HIS B 1 369 ? 12.820 -11.686 33.892 1.00 129.32 ? 390 HIS B CE1 1 ATOM 5885 N NE2 . HIS B 1 369 ? 13.740 -11.013 34.561 1.00 127.09 ? 390 HIS B NE2 1 ATOM 5886 N N . GLY B 1 370 ? 17.925 -14.869 30.936 1.00 99.67 ? 391 GLY B N 1 ATOM 5887 C CA . GLY B 1 370 ? 19.055 -15.159 30.071 1.00 95.80 ? 391 GLY B CA 1 ATOM 5888 C C . GLY B 1 370 ? 20.218 -15.923 30.678 1.00 92.39 ? 391 GLY B C 1 ATOM 5889 O O . GLY B 1 370 ? 20.253 -16.192 31.880 1.00 91.33 ? 391 GLY B O 1 ATOM 5890 N N . VAL B 1 371 ? 21.178 -16.269 29.822 1.00 85.58 ? 392 VAL B N 1 ATOM 5891 C CA . VAL B 1 371 ? 22.345 -17.048 30.214 1.00 78.61 ? 392 VAL B CA 1 ATOM 5892 C C . VAL B 1 371 ? 23.574 -16.601 29.425 1.00 79.23 ? 392 VAL B C 1 ATOM 5893 O O . VAL B 1 371 ? 23.511 -16.437 28.208 1.00 80.71 ? 392 VAL B O 1 ATOM 5894 C CB . VAL B 1 371 ? 22.126 -18.549 29.955 1.00 74.45 ? 392 VAL B CB 1 ATOM 5895 C CG1 . VAL B 1 371 ? 23.403 -19.323 30.229 1.00 70.92 ? 392 VAL B CG1 1 ATOM 5896 C CG2 . VAL B 1 371 ? 20.983 -19.082 30.805 1.00 77.65 ? 392 VAL B CG2 1 ATOM 5897 N N . ILE B 1 372 ? 24.691 -16.405 30.118 1.00 76.36 ? 393 ILE B N 1 ATOM 5898 C CA . ILE B 1 372 ? 25.929 -16.008 29.456 1.00 74.99 ? 393 ILE B CA 1 ATOM 5899 C C . ILE B 1 372 ? 27.093 -16.910 29.842 1.00 78.05 ? 393 ILE B C 1 ATOM 5900 O O . ILE B 1 372 ? 27.174 -17.391 30.977 1.00 76.44 ? 393 ILE B O 1 ATOM 5901 C CB . ILE B 1 372 ? 26.308 -14.546 29.757 1.00 65.72 ? 393 ILE B CB 1 ATOM 5902 C CG1 . ILE B 1 372 ? 26.419 -14.315 31.267 1.00 61.05 ? 393 ILE B CG1 1 ATOM 5903 C CG2 . ILE B 1 372 ? 25.300 -13.601 29.128 1.00 65.68 ? 393 ILE B CG2 1 ATOM 5904 C CD1 . ILE B 1 372 ? 27.011 -12.964 31.638 1.00 58.01 ? 393 ILE B CD1 1 ATOM 5905 N N . PHE B 1 373 ? 27.993 -17.126 28.886 1.00 76.65 ? 394 PHE B N 1 ATOM 5906 C CA . PHE B 1 373 ? 29.151 -17.988 29.087 1.00 65.26 ? 394 PHE B CA 1 ATOM 5907 C C . PHE B 1 373 ? 30.429 -17.181 28.999 1.00 60.65 ? 394 PHE B C 1 ATOM 5908 O O . PHE B 1 373 ? 30.462 -16.129 28.365 1.00 53.93 ? 394 PHE B O 1 ATOM 5909 C CB . PHE B 1 373 ? 29.182 -19.099 28.035 1.00 66.70 ? 394 PHE B CB 1 ATOM 5910 C CG . PHE B 1 373 ? 27.972 -19.985 28.055 1.00 68.91 ? 394 PHE B CG 1 ATOM 5911 C CD1 . PHE B 1 373 ? 28.043 -21.267 28.574 1.00 71.95 ? 394 PHE B CD1 1 ATOM 5912 C CD2 . PHE B 1 373 ? 26.761 -19.530 27.569 1.00 69.10 ? 394 PHE B CD2 1 ATOM 5913 C CE1 . PHE B 1 373 ? 26.928 -22.083 28.597 1.00 74.59 ? 394 PHE B CE1 1 ATOM 5914 C CE2 . PHE B 1 373 ? 25.641 -20.340 27.591 1.00 77.91 ? 394 PHE B CE2 1 ATOM 5915 C CZ . PHE B 1 373 ? 25.726 -21.618 28.106 1.00 78.24 ? 394 PHE B CZ 1 ATOM 5916 N N . SER B 1 374 ? 31.475 -17.681 29.651 1.00 66.34 ? 395 SER B N 1 ATOM 5917 C CA . SER B 1 374 ? 32.808 -17.102 29.561 1.00 62.83 ? 395 SER B CA 1 ATOM 5918 C C . SER B 1 374 ? 33.832 -18.237 29.558 1.00 63.49 ? 395 SER B C 1 ATOM 5919 O O . SER B 1 374 ? 33.631 -19.257 30.215 1.00 69.81 ? 395 SER B O 1 ATOM 5920 C CB . SER B 1 374 ? 33.060 -16.149 30.725 1.00 65.00 ? 395 SER B CB 1 ATOM 5921 O OG . SER B 1 374 ? 33.290 -16.863 31.926 1.00 74.46 ? 395 SER B OG 1 ATOM 5922 N N . SER B 1 375 ? 34.923 -18.067 28.816 1.00 57.22 ? 396 SER B N 1 ATOM 5923 C CA . SER B 1 375 ? 35.896 -19.146 28.653 1.00 54.93 ? 396 SER B CA 1 ATOM 5924 C C . SER B 1 375 ? 37.324 -18.761 29.022 1.00 48.96 ? 396 SER B C 1 ATOM 5925 O O . SER B 1 375 ? 37.698 -17.588 28.981 1.00 47.55 ? 396 SER B O 1 ATOM 5926 C CB . SER B 1 375 ? 35.862 -19.674 27.219 1.00 57.34 ? 396 SER B CB 1 ATOM 5927 O OG . SER B 1 375 ? 34.546 -20.069 26.880 1.00 72.33 ? 396 SER B OG 1 ATOM 5928 N N . ALA B 1 376 ? 38.114 -19.773 29.375 1.00 40.74 ? 397 ALA B N 1 ATOM 5929 C CA . ALA B 1 376 ? 39.525 -19.594 29.679 1.00 43.03 ? 397 ALA B CA 1 ATOM 5930 C C . ALA B 1 376 ? 40.222 -20.941 29.686 1.00 46.00 ? 397 ALA B C 1 ATOM 5931 O O . ALA B 1 376 ? 39.633 -21.957 30.049 1.00 51.03 ? 397 ALA B O 1 ATOM 5932 C CB . ALA B 1 376 ? 39.707 -18.910 31.021 1.00 44.68 ? 397 ALA B CB 1 ATOM 5933 N N . GLU B 1 377 ? 41.482 -20.940 29.277 1.00 39.13 ? 398 GLU B N 1 ATOM 5934 C CA . GLU B 1 377 ? 42.287 -22.144 29.289 1.00 41.80 ? 398 GLU B CA 1 ATOM 5935 C C . GLU B 1 377 ? 43.213 -22.130 30.502 1.00 39.61 ? 398 GLU B C 1 ATOM 5936 O O . GLU B 1 377 ? 43.834 -21.110 30.817 1.00 30.98 ? 398 GLU B O 1 ATOM 5937 C CB . GLU B 1 377 ? 43.115 -22.237 28.002 1.00 37.08 ? 398 GLU B CB 1 ATOM 5938 C CG . GLU B 1 377 ? 43.996 -23.476 27.908 1.00 44.66 ? 398 GLU B CG 1 ATOM 5939 C CD . GLU B 1 377 ? 44.870 -23.493 26.657 1.00 54.20 ? 398 GLU B CD 1 ATOM 5940 O OE1 . GLU B 1 377 ? 45.571 -24.506 26.430 1.00 58.49 ? 398 GLU B OE1 1 ATOM 5941 O OE2 . GLU B 1 377 ? 44.860 -22.494 25.904 1.00 53.64 ? 398 GLU B OE2 1 ATOM 5942 N N . LEU B 1 378 ? 43.291 -23.267 31.180 1.00 42.51 ? 399 LEU B N 1 ATOM 5943 C CA . LEU B 1 378 ? 44.290 -23.479 32.212 1.00 40.06 ? 399 LEU B CA 1 ATOM 5944 C C . LEU B 1 378 ? 45.384 -24.335 31.601 1.00 42.53 ? 399 LEU B C 1 ATOM 5945 O O . LEU B 1 378 ? 45.115 -25.420 31.078 1.00 43.82 ? 399 LEU B O 1 ATOM 5946 C CB . LEU B 1 378 ? 43.671 -24.211 33.404 1.00 44.50 ? 399 LEU B CB 1 ATOM 5947 C CG . LEU B 1 378 ? 44.235 -23.929 34.803 1.00 47.29 ? 399 LEU B CG 1 ATOM 5948 C CD1 . LEU B 1 378 ? 43.678 -24.929 35.818 1.00 44.30 ? 399 LEU B CD1 1 ATOM 5949 C CD2 . LEU B 1 378 ? 45.755 -23.925 34.832 1.00 40.11 ? 399 LEU B CD2 1 ATOM 5950 N N . SER B 1 379 ? 46.616 -23.844 31.637 1.00 37.16 ? 400 SER B N 1 ATOM 5951 C CA . SER B 1 379 ? 47.750 -24.658 31.215 1.00 35.02 ? 400 SER B CA 1 ATOM 5952 C C . SER B 1 379 ? 48.810 -24.669 32.308 1.00 40.05 ? 400 SER B C 1 ATOM 5953 O O . SER B 1 379 ? 49.014 -23.670 33.002 1.00 41.10 ? 400 SER B O 1 ATOM 5954 C CB . SER B 1 379 ? 48.343 -24.153 29.890 1.00 36.58 ? 400 SER B CB 1 ATOM 5955 O OG . SER B 1 379 ? 48.469 -22.738 29.874 1.00 37.66 ? 400 SER B OG 1 ATOM 5956 N N . VAL B 1 380 ? 49.484 -25.802 32.452 1.00 36.17 ? 401 VAL B N 1 ATOM 5957 C CA . VAL B 1 380 ? 50.458 -25.973 33.513 1.00 39.80 ? 401 VAL B CA 1 ATOM 5958 C C . VAL B 1 380 ? 51.859 -25.989 32.937 1.00 42.15 ? 401 VAL B C 1 ATOM 5959 O O . VAL B 1 380 ? 52.159 -26.791 32.051 1.00 38.33 ? 401 VAL B O 1 ATOM 5960 C CB . VAL B 1 380 ? 50.225 -27.288 34.277 1.00 42.41 ? 401 VAL B CB 1 ATOM 5961 C CG1 . VAL B 1 380 ? 51.305 -27.490 35.326 1.00 50.65 ? 401 VAL B CG1 1 ATOM 5962 C CG2 . VAL B 1 380 ? 48.848 -27.290 34.911 1.00 33.96 ? 401 VAL B CG2 1 ATOM 5963 N N . ILE B 1 381 ? 52.716 -25.106 33.439 1.00 37.76 ? 402 ILE B N 1 ATOM 5964 C CA . ILE B 1 381 ? 54.094 -25.024 32.969 1.00 36.83 ? 402 ILE B CA 1 ATOM 5965 C C . ILE B 1 381 ? 54.794 -26.374 33.078 1.00 42.31 ? 402 ILE B C 1 ATOM 5966 O O . ILE B 1 381 ? 55.010 -26.885 34.177 1.00 45.53 ? 402 ILE B O 1 ATOM 5967 C CB . ILE B 1 381 ? 54.898 -23.974 33.759 1.00 37.45 ? 402 ILE B CB 1 ATOM 5968 C CG1 . ILE B 1 381 ? 54.422 -22.563 33.409 1.00 34.11 ? 402 ILE B CG1 1 ATOM 5969 C CG2 . ILE B 1 381 ? 56.386 -24.124 33.483 1.00 39.58 ? 402 ILE B CG2 1 ATOM 5970 C CD1 . ILE B 1 381 ? 54.707 -21.537 34.484 1.00 37.32 ? 402 ILE B CD1 1 ATOM 5971 N N . ALA B 1 382 ? 55.146 -26.946 31.931 1.00 48.35 ? 403 ALA B N 1 ATOM 5972 C CA . ALA B 1 382 ? 55.822 -28.238 31.895 1.00 49.45 ? 403 ALA B CA 1 ATOM 5973 C C . ALA B 1 382 ? 57.016 -28.263 32.844 1.00 52.26 ? 403 ALA B C 1 ATOM 5974 O O . ALA B 1 382 ? 57.413 -27.231 33.385 1.00 54.59 ? 403 ALA B O 1 ATOM 5975 C CB . ALA B 1 382 ? 56.261 -28.567 30.477 1.00 45.40 ? 403 ALA B CB 1 ATOM 5976 N N . GLU B 1 383 ? 57.584 -29.448 33.041 1.00 111.53 ? 404 GLU B N 1 ATOM 5977 C CA . GLU B 1 383 ? 58.733 -29.610 33.923 1.00 115.09 ? 404 GLU B CA 1 ATOM 5978 C C . GLU B 1 383 ? 59.984 -28.978 33.322 1.00 115.00 ? 404 GLU B C 1 ATOM 5979 O O . GLU B 1 383 ? 60.936 -29.675 32.972 1.00 116.59 ? 404 GLU B O 1 ATOM 5980 C CB . GLU B 1 383 ? 58.980 -31.092 34.215 1.00 121.03 ? 404 GLU B CB 1 ATOM 5981 C CG . GLU B 1 383 ? 58.582 -31.524 35.616 1.00 121.28 ? 404 GLU B CG 1 ATOM 5982 C CD . GLU B 1 383 ? 58.066 -32.948 35.663 1.00 118.37 ? 404 GLU B CD 1 ATOM 5983 O OE1 . GLU B 1 383 ? 58.872 -33.881 35.465 1.00 115.97 ? 404 GLU B OE1 1 ATOM 5984 O OE2 . GLU B 1 383 ? 56.853 -33.135 35.897 1.00 116.45 ? 404 GLU B OE2 1 HETATM 5985 C C1 . NAG C 2 . ? 37.677 -10.503 -0.928 1.00 96.45 ? 1 NAG A C1 1 HETATM 5986 C C2 . NAG C 2 . ? 36.551 -9.826 -0.147 1.00 103.26 ? 1 NAG A C2 1 HETATM 5987 C C3 . NAG C 2 . ? 36.890 -9.721 1.332 1.00 109.06 ? 1 NAG A C3 1 HETATM 5988 C C4 . NAG C 2 . ? 37.247 -11.093 1.880 1.00 109.99 ? 1 NAG A C4 1 HETATM 5989 C C5 . NAG C 2 . ? 38.288 -11.798 1.018 1.00 105.89 ? 1 NAG A C5 1 HETATM 5990 C C6 . NAG C 2 . ? 38.412 -13.250 1.472 1.00 106.52 ? 1 NAG A C6 1 HETATM 5991 C C7 . NAG C 2 . ? 35.005 -8.099 -0.843 1.00 106.17 ? 1 NAG A C7 1 HETATM 5992 C C8 . NAG C 2 . ? 34.565 -6.966 0.035 1.00 107.89 ? 1 NAG A C8 1 HETATM 5993 N N2 . NAG C 2 . ? 36.260 -8.510 -0.683 1.00 103.69 ? 1 NAG A N2 1 HETATM 5994 O O3 . NAG C 2 . ? 35.789 -9.198 2.045 1.00 111.51 ? 1 NAG A O3 1 HETATM 5995 O O4 . NAG C 2 . ? 37.760 -10.948 3.186 1.00 113.64 ? 1 NAG A O4 1 HETATM 5996 O O5 . NAG C 2 . ? 37.977 -11.769 -0.365 1.00 101.29 ? 1 NAG A O5 1 HETATM 5997 O O6 . NAG C 2 . ? 39.230 -13.966 0.575 1.00 108.04 ? 1 NAG A O6 1 HETATM 5998 O O7 . NAG C 2 . ? 34.228 -8.603 -1.654 1.00 106.79 ? 1 NAG A O7 1 HETATM 5999 C C1 . NDG D 3 . ? 30.620 -0.663 6.260 1.00 127.51 ? 2 NDG A C1 1 HETATM 6000 C C2 . NDG D 3 . ? 30.003 0.605 6.833 1.00 137.71 ? 2 NDG A C2 1 HETATM 6001 C C3 . NDG D 3 . ? 30.023 0.553 8.353 1.00 136.54 ? 2 NDG A C3 1 HETATM 6002 C C4 . NDG D 3 . ? 29.322 -0.710 8.836 1.00 135.47 ? 2 NDG A C4 1 HETATM 6003 C C5 . NDG D 3 . ? 29.785 -1.973 8.107 1.00 132.92 ? 2 NDG A C5 1 HETATM 6004 C C6 . NDG D 3 . ? 28.797 -3.105 8.387 1.00 127.08 ? 2 NDG A C6 1 HETATM 6005 C C7 . NDG D 3 . ? 30.382 2.322 5.176 1.00 149.00 ? 2 NDG A C7 1 HETATM 6006 C C8 . NDG D 3 . ? 31.247 3.450 4.696 1.00 148.98 ? 2 NDG A C8 1 HETATM 6007 O O . NDG D 3 . ? 29.911 -1.807 6.705 1.00 133.28 ? 2 NDG A O 1 HETATM 6008 O O3 . NDG D 3 . ? 29.368 1.686 8.881 1.00 134.88 ? 2 NDG A O3 1 HETATM 6009 O O4 . NDG D 3 . ? 29.561 -0.870 10.216 1.00 135.18 ? 2 NDG A O4 1 HETATM 6010 O O6 . NDG D 3 . ? 28.882 -4.094 7.384 1.00 122.91 ? 2 NDG A O6 1 HETATM 6011 O O7 . NDG D 3 . ? 29.421 1.944 4.506 1.00 150.06 ? 2 NDG A O7 1 HETATM 6012 N N2 . NDG D 3 . ? 30.715 1.767 6.338 1.00 145.16 ? 2 NDG A N2 1 HETATM 6013 C C1 . NAG E 2 . ? 45.695 -3.487 43.704 1.00 66.53 ? 3 NAG A C1 1 HETATM 6014 C C2 . NAG E 2 . ? 45.899 -3.994 45.139 1.00 67.55 ? 3 NAG A C2 1 HETATM 6015 C C3 . NAG E 2 . ? 44.717 -3.750 46.091 1.00 63.70 ? 3 NAG A C3 1 HETATM 6016 C C4 . NAG E 2 . ? 43.867 -2.531 45.758 1.00 70.73 ? 3 NAG A C4 1 HETATM 6017 C C5 . NAG E 2 . ? 43.674 -2.361 44.260 1.00 72.12 ? 3 NAG A C5 1 HETATM 6018 C C6 . NAG E 2 . ? 42.898 -1.076 43.978 1.00 76.76 ? 3 NAG A C6 1 HETATM 6019 C C7 . NAG E 2 . ? 47.157 -6.044 45.672 1.00 67.81 ? 3 NAG A C7 1 HETATM 6020 C C8 . NAG E 2 . ? 47.338 -7.486 45.304 1.00 66.70 ? 3 NAG A C8 1 HETATM 6021 N N2 . NAG E 2 . ? 46.137 -5.428 45.081 1.00 66.69 ? 3 NAG A N2 1 HETATM 6022 O O3 . NAG E 2 . ? 45.192 -3.583 47.413 1.00 43.66 ? 3 NAG A O3 1 HETATM 6023 O O4 . NAG E 2 . ? 42.605 -2.661 46.377 1.00 68.25 ? 3 NAG A O4 1 HETATM 6024 O O5 . NAG E 2 . ? 44.939 -2.293 43.649 1.00 71.36 ? 3 NAG A O5 1 HETATM 6025 O O6 . NAG E 2 . ? 42.569 -0.985 42.609 1.00 85.07 ? 3 NAG A O6 1 HETATM 6026 O O7 . NAG E 2 . ? 47.918 -5.500 46.476 1.00 67.36 ? 3 NAG A O7 1 HETATM 6027 C C1 . NDG F 3 . ? 60.422 -23.570 -30.152 1.00 86.90 ? 4 NDG A C1 1 HETATM 6028 C C2 . NDG F 3 . ? 61.796 -24.130 -30.503 1.00 96.64 ? 4 NDG A C2 1 HETATM 6029 C C3 . NDG F 3 . ? 61.686 -24.972 -31.771 1.00 98.49 ? 4 NDG A C3 1 HETATM 6030 C C4 . NDG F 3 . ? 60.402 -25.798 -31.714 1.00 101.19 ? 4 NDG A C4 1 HETATM 6031 C C5 . NDG F 3 . ? 59.186 -24.874 -31.687 1.00 101.13 ? 4 NDG A C5 1 HETATM 6032 C C6 . NDG F 3 . ? 58.095 -25.371 -30.741 1.00 99.12 ? 4 NDG A C6 1 HETATM 6033 C C7 . NDG F 3 . ? 63.792 -22.883 -29.852 1.00 104.89 ? 4 NDG A C7 1 HETATM 6034 C C8 . NDG F 3 . ? 65.027 -22.265 -30.444 1.00 103.61 ? 4 NDG A C8 1 HETATM 6035 O O . NDG F 3 . ? 59.608 -23.580 -31.307 1.00 98.74 ? 4 NDG A O 1 HETATM 6036 O O3 . NDG F 3 . ? 62.814 -25.813 -31.904 1.00 95.46 ? 4 NDG A O3 1 HETATM 6037 O O4 . NDG F 3 . ? 60.320 -26.659 -32.828 1.00 100.48 ? 4 NDG A O4 1 HETATM 6038 O O6 . NDG F 3 . ? 56.920 -24.610 -30.929 1.00 94.77 ? 4 NDG A O6 1 HETATM 6039 O O7 . NDG F 3 . ? 63.768 -23.208 -28.664 1.00 102.88 ? 4 NDG A O7 1 HETATM 6040 N N2 . NDG F 3 . ? 62.755 -23.051 -30.675 1.00 102.77 ? 4 NDG A N2 1 HETATM 6041 C C1 . NAG G 2 . ? 12.769 -26.880 20.999 1.00 98.32 ? 5 NAG B C1 1 HETATM 6042 C C2 . NAG G 2 . ? 11.575 -25.917 21.034 1.00 103.66 ? 5 NAG B C2 1 HETATM 6043 C C3 . NAG G 2 . ? 10.368 -26.403 20.240 1.00 103.34 ? 5 NAG B C3 1 HETATM 6044 C C4 . NAG G 2 . ? 10.806 -26.940 18.892 1.00 103.51 ? 5 NAG B C4 1 HETATM 6045 C C5 . NAG G 2 . ? 11.864 -28.015 19.079 1.00 101.45 ? 5 NAG B C5 1 HETATM 6046 C C6 . NAG G 2 . ? 12.270 -28.581 17.721 1.00 98.81 ? 5 NAG B C6 1 HETATM 6047 C C7 . NAG G 2 . ? 10.521 -24.555 22.750 1.00 114.03 ? 5 NAG B C7 1 HETATM 6048 C C8 . NAG G 2 . ? 9.596 -24.644 23.929 1.00 113.12 ? 5 NAG B C8 1 HETATM 6049 N N2 . NAG G 2 . ? 11.162 -25.672 22.405 1.00 108.89 ? 5 NAG B N2 1 HETATM 6050 O O3 . NAG G 2 . ? 9.459 -25.340 20.047 1.00 101.30 ? 5 NAG B O3 1 HETATM 6051 O O4 . NAG G 2 . ? 9.696 -27.482 18.215 1.00 104.13 ? 5 NAG B O4 1 HETATM 6052 O O5 . NAG G 2 . ? 12.996 -27.475 19.732 1.00 100.73 ? 5 NAG B O5 1 HETATM 6053 O O6 . NAG G 2 . ? 12.841 -29.859 17.877 1.00 95.92 ? 5 NAG B O6 1 HETATM 6054 O O7 . NAG G 2 . ? 10.656 -23.490 22.148 1.00 117.22 ? 5 NAG B O7 1 HETATM 6055 C C1 . NAG H 2 . ? 8.426 -30.426 7.730 1.00 127.24 ? 6 NAG B C1 1 HETATM 6056 C C2 . NAG H 2 . ? 8.315 -31.251 6.451 1.00 131.29 ? 6 NAG B C2 1 HETATM 6057 C C3 . NAG H 2 . ? 7.280 -32.347 6.626 1.00 133.99 ? 6 NAG B C3 1 HETATM 6058 C C4 . NAG H 2 . ? 7.669 -33.199 7.821 1.00 135.75 ? 6 NAG B C4 1 HETATM 6059 C C5 . NAG H 2 . ? 7.830 -32.337 9.068 1.00 135.42 ? 6 NAG B C5 1 HETATM 6060 C C6 . NAG H 2 . ? 8.352 -33.190 10.222 1.00 135.17 ? 6 NAG B C6 1 HETATM 6061 C C7 . NAG H 2 . ? 8.762 -30.436 4.210 1.00 131.91 ? 6 NAG B C7 1 HETATM 6062 C C8 . NAG H 2 . ? 8.392 -29.473 3.120 1.00 131.08 ? 6 NAG B C8 1 HETATM 6063 N N2 . NAG H 2 . ? 8.001 -30.418 5.304 1.00 131.83 ? 6 NAG B N2 1 HETATM 6064 O O3 . NAG H 2 . ? 7.237 -33.151 5.472 1.00 135.68 ? 6 NAG B O3 1 HETATM 6065 O O4 . NAG H 2 . ? 6.686 -34.186 8.042 1.00 136.79 ? 6 NAG B O4 1 HETATM 6066 O O5 . NAG H 2 . ? 8.714 -31.251 8.848 1.00 133.62 ? 6 NAG B O5 1 HETATM 6067 O O6 . NAG H 2 . ? 8.457 -32.416 11.397 1.00 133.87 ? 6 NAG B O6 1 HETATM 6068 O O7 . NAG H 2 . ? 9.724 -31.193 4.074 1.00 131.26 ? 6 NAG B O7 1 HETATM 6069 C C1 . NAG I 2 . ? -14.736 4.372 -1.431 1.00 84.12 ? 7 NAG B C1 1 HETATM 6070 C C2 . NAG I 2 . ? -14.746 5.619 -2.314 1.00 88.35 ? 7 NAG B C2 1 HETATM 6071 C C3 . NAG I 2 . ? -15.438 5.416 -3.659 1.00 93.62 ? 7 NAG B C3 1 HETATM 6072 C C4 . NAG I 2 . ? -15.082 4.075 -4.286 1.00 97.29 ? 7 NAG B C4 1 HETATM 6073 C C5 . NAG I 2 . ? -15.175 2.946 -3.269 1.00 98.71 ? 7 NAG B C5 1 HETATM 6074 C C6 . NAG I 2 . ? -14.730 1.624 -3.879 1.00 104.28 ? 7 NAG B C6 1 HETATM 6075 C C7 . NAG I 2 . ? -14.730 7.836 -1.338 1.00 82.18 ? 7 NAG B C7 1 HETATM 6076 C C8 . NAG I 2 . ? -15.188 8.600 -0.130 1.00 76.33 ? 7 NAG B C8 1 HETATM 6077 N N2 . NAG I 2 . ? -15.384 6.707 -1.598 1.00 85.52 ? 7 NAG B N2 1 HETATM 6078 O O3 . NAG I 2 . ? -15.039 6.446 -4.538 1.00 94.24 ? 7 NAG B O3 1 HETATM 6079 O O4 . NAG I 2 . ? -15.967 3.811 -5.351 1.00 96.64 ? 7 NAG B O4 1 HETATM 6080 O O5 . NAG I 2 . ? -14.364 3.214 -2.149 1.00 92.85 ? 7 NAG B O5 1 HETATM 6081 O O6 . NAG I 2 . ? -14.427 0.722 -2.836 1.00 107.20 ? 7 NAG B O6 1 HETATM 6082 O O7 . NAG I 2 . ? -13.801 8.251 -2.035 1.00 79.84 ? 7 NAG B O7 1 HETATM 6083 C C1 . NDG J 3 . ? 41.498 -21.102 47.856 1.00 109.29 ? 8 NDG B C1 1 HETATM 6084 C C2 . NDG J 3 . ? 42.662 -20.433 48.583 1.00 118.30 ? 8 NDG B C2 1 HETATM 6085 C C3 . NDG J 3 . ? 42.113 -19.457 49.618 1.00 123.53 ? 8 NDG B C3 1 HETATM 6086 C C4 . NDG J 3 . ? 41.147 -18.498 48.931 1.00 124.01 ? 8 NDG B C4 1 HETATM 6087 C C5 . NDG J 3 . ? 40.059 -19.295 48.232 1.00 120.72 ? 8 NDG B C5 1 HETATM 6088 C C6 . NDG J 3 . ? 40.069 -19.015 46.737 1.00 122.55 ? 8 NDG B C6 1 HETATM 6089 C C7 . NDG J 3 . ? 44.761 -21.653 48.792 1.00 115.78 ? 8 NDG B C7 1 HETATM 6090 C C8 . NDG J 3 . ? 45.877 -21.182 49.678 1.00 113.81 ? 8 NDG B C8 1 HETATM 6091 O O . NDG J 3 . ? 40.301 -20.664 48.464 1.00 116.42 ? 8 NDG B O 1 HETATM 6092 O O3 . NDG J 3 . ? 43.164 -18.738 50.225 1.00 125.79 ? 8 NDG B O3 1 HETATM 6093 O O4 . NDG J 3 . ? 40.556 -17.641 49.880 1.00 126.91 ? 8 NDG B O4 1 HETATM 6094 O O6 . NDG J 3 . ? 38.953 -19.633 46.134 1.00 123.54 ? 8 NDG B O6 1 HETATM 6095 O O7 . NDG J 3 . ? 45.008 -22.230 47.735 1.00 113.49 ? 8 NDG B O7 1 HETATM 6096 N N2 . NDG J 3 . ? 43.519 -21.420 49.215 1.00 119.66 ? 8 NDG B N2 1 HETATM 6097 O O . HOH K 4 . ? 65.655 -16.450 31.886 1.00 29.83 ? 6 HOH A O 1 HETATM 6098 O O . HOH K 4 . ? 55.260 -0.380 44.541 1.00 36.58 ? 7 HOH A O 1 HETATM 6099 O O . HOH K 4 . ? 50.041 -20.554 44.348 1.00 34.63 ? 9 HOH A O 1 HETATM 6100 O O . HOH K 4 . ? 72.128 -17.922 37.244 1.00 35.06 ? 12 HOH A O 1 HETATM 6101 O O . HOH K 4 . ? 53.495 -19.911 38.218 1.00 31.55 ? 13 HOH A O 1 HETATM 6102 O O . HOH K 4 . ? 73.738 -22.282 12.163 1.00 37.43 ? 14 HOH A O 1 HETATM 6103 O O . HOH K 4 . ? 61.549 -7.363 28.377 1.00 34.38 ? 16 HOH A O 1 HETATM 6104 O O . HOH K 4 . ? 67.458 -29.016 27.387 1.00 37.81 ? 17 HOH A O 1 HETATM 6105 O O . HOH K 4 . ? 41.567 -6.228 39.167 1.00 44.73 ? 19 HOH A O 1 HETATM 6106 O O . HOH K 4 . ? 67.664 -12.438 30.587 1.00 51.34 ? 20 HOH A O 1 HETATM 6107 O O . HOH K 4 . ? 55.944 -6.116 47.464 1.00 32.49 ? 21 HOH A O 1 HETATM 6108 O O . HOH K 4 . ? 40.075 -1.643 26.949 1.00 67.37 ? 405 HOH A O 1 HETATM 6109 O O . HOH K 4 . ? 61.856 -19.389 39.787 1.00 35.57 ? 406 HOH A O 1 HETATM 6110 O O . HOH K 4 . ? 58.712 -15.333 21.227 1.00 44.88 ? 407 HOH A O 1 HETATM 6111 O O . HOH K 4 . ? 40.895 -2.564 41.221 1.00 50.36 ? 408 HOH A O 1 HETATM 6112 O O . HOH K 4 . ? 43.811 -2.297 40.970 1.00 38.65 ? 409 HOH A O 1 HETATM 6113 O O . HOH K 4 . ? 62.711 -26.856 35.415 1.00 49.77 ? 410 HOH A O 1 HETATM 6114 O O . HOH K 4 . ? 58.461 -2.307 38.077 1.00 37.99 ? 411 HOH A O 1 HETATM 6115 O O . HOH K 4 . ? 56.517 -24.741 49.799 1.00 37.00 ? 412 HOH A O 1 HETATM 6116 O O . HOH K 4 . ? 61.850 -24.004 19.223 1.00 38.31 ? 413 HOH A O 1 HETATM 6117 O O . HOH K 4 . ? 59.236 -5.157 42.028 1.00 33.08 ? 414 HOH A O 1 HETATM 6118 O O . HOH K 4 . ? 57.500 -6.541 40.322 1.00 35.94 ? 415 HOH A O 1 HETATM 6119 O O . HOH K 4 . ? 62.399 -7.481 -32.150 1.00 49.35 ? 416 HOH A O 1 HETATM 6120 O O . HOH K 4 . ? 62.228 -12.211 47.904 1.00 43.72 ? 417 HOH A O 1 HETATM 6121 O O . HOH K 4 . ? 51.697 -9.418 19.120 1.00 43.27 ? 418 HOH A O 1 HETATM 6122 O O . HOH K 4 . ? 72.440 -21.879 44.174 1.00 32.65 ? 419 HOH A O 1 HETATM 6123 O O . HOH K 4 . ? 74.934 -27.069 19.955 1.00 48.79 ? 420 HOH A O 1 HETATM 6124 O O . HOH K 4 . ? 43.489 1.091 16.328 1.00 44.17 ? 421 HOH A O 1 HETATM 6125 O O . HOH K 4 . ? 71.696 -7.802 26.247 1.00 43.73 ? 422 HOH A O 1 HETATM 6126 O O . HOH K 4 . ? 63.535 -8.051 45.670 1.00 43.01 ? 423 HOH A O 1 HETATM 6127 O O . HOH K 4 . ? 52.174 -0.324 24.609 1.00 43.83 ? 424 HOH A O 1 HETATM 6128 O O . HOH K 4 . ? 40.635 -9.358 42.002 1.00 47.46 ? 425 HOH A O 1 HETATM 6129 O O . HOH K 4 . ? 74.652 -29.213 18.523 1.00 48.43 ? 426 HOH A O 1 HETATM 6130 O O . HOH K 4 . ? 67.952 -21.432 4.965 1.00 48.18 ? 427 HOH A O 1 HETATM 6131 O O . HOH K 4 . ? 58.550 -24.861 39.711 1.00 36.46 ? 428 HOH A O 1 HETATM 6132 O O . HOH K 4 . ? 71.742 -13.385 30.711 1.00 47.25 ? 429 HOH A O 1 HETATM 6133 O O . HOH K 4 . ? 54.499 -19.472 27.698 1.00 64.46 ? 430 HOH A O 1 HETATM 6134 O O . HOH K 4 . ? 51.795 -18.976 40.092 1.00 48.08 ? 431 HOH A O 1 HETATM 6135 O O . HOH K 4 . ? 46.228 -6.309 31.842 1.00 47.55 ? 432 HOH A O 1 HETATM 6136 O O . HOH K 4 . ? 47.624 -14.907 33.343 1.00 32.84 ? 433 HOH A O 1 HETATM 6137 O O . HOH K 4 . ? 72.592 -19.639 39.169 1.00 34.29 ? 434 HOH A O 1 HETATM 6138 O O . HOH K 4 . ? 46.223 -18.142 42.777 1.00 40.97 ? 435 HOH A O 1 HETATM 6139 O O . HOH K 4 . ? 75.279 -14.891 23.598 1.00 47.15 ? 436 HOH A O 1 HETATM 6140 O O . HOH K 4 . ? 48.391 -14.501 50.906 1.00 59.30 ? 437 HOH A O 1 HETATM 6141 O O . HOH K 4 . ? 51.246 -5.103 -31.043 1.00 51.35 ? 438 HOH A O 1 HETATM 6142 O O . HOH K 4 . ? 47.174 -16.392 49.405 1.00 49.84 ? 439 HOH A O 1 HETATM 6143 O O . HOH K 4 . ? 48.990 5.501 36.771 1.00 57.05 ? 440 HOH A O 1 HETATM 6144 O O . HOH K 4 . ? 57.321 0.055 38.609 1.00 42.74 ? 441 HOH A O 1 HETATM 6145 O O . HOH K 4 . ? 78.745 -17.652 18.493 1.00 51.15 ? 442 HOH A O 1 HETATM 6146 O O . HOH K 4 . ? 48.662 -1.684 43.508 1.00 45.13 ? 443 HOH A O 1 HETATM 6147 O O . HOH K 4 . ? 62.171 -8.179 -9.762 1.00 39.77 ? 444 HOH A O 1 HETATM 6148 O O . HOH K 4 . ? 54.435 -2.752 -17.865 1.00 49.99 ? 445 HOH A O 1 HETATM 6149 O O . HOH K 4 . ? 63.194 -8.261 -27.409 1.00 46.12 ? 446 HOH A O 1 HETATM 6150 O O . HOH K 4 . ? 53.412 -7.705 17.686 1.00 68.95 ? 447 HOH A O 1 HETATM 6151 O O . HOH K 4 . ? 56.381 -4.426 -30.461 1.00 64.70 ? 448 HOH A O 1 HETATM 6152 O O . HOH K 4 . ? 63.434 -29.466 37.358 1.00 58.69 ? 449 HOH A O 1 HETATM 6153 O O . HOH K 4 . ? 72.253 -25.768 11.239 1.00 53.11 ? 450 HOH A O 1 HETATM 6154 O O . HOH K 4 . ? 57.015 -3.076 30.393 1.00 52.65 ? 451 HOH A O 1 HETATM 6155 O O . HOH K 4 . ? 42.636 -4.501 40.892 1.00 50.51 ? 452 HOH A O 1 HETATM 6156 O O . HOH K 4 . ? 73.396 -19.781 29.619 1.00 47.74 ? 453 HOH A O 1 HETATM 6157 O O . HOH K 4 . ? 58.841 -22.990 25.941 1.00 51.40 ? 454 HOH A O 1 HETATM 6158 O O . HOH K 4 . ? 42.976 -0.698 33.238 1.00 50.45 ? 455 HOH A O 1 HETATM 6159 O O . HOH K 4 . ? 60.709 -9.725 19.527 1.00 48.71 ? 456 HOH A O 1 HETATM 6160 O O . HOH K 4 . ? 61.598 -7.459 2.061 1.00 58.30 ? 457 HOH A O 1 HETATM 6161 O O . HOH K 4 . ? 57.244 -20.041 12.268 1.00 45.06 ? 458 HOH A O 1 HETATM 6162 O O . HOH K 4 . ? 65.720 -8.210 39.291 1.00 41.67 ? 459 HOH A O 1 HETATM 6163 O O . HOH K 4 . ? 61.384 -25.994 25.023 1.00 43.78 ? 460 HOH A O 1 HETATM 6164 O O . HOH K 4 . ? 61.008 -15.721 18.871 1.00 47.04 ? 461 HOH A O 1 HETATM 6165 O O . HOH K 4 . ? 57.916 -2.974 26.941 1.00 46.01 ? 462 HOH A O 1 HETATM 6166 O O . HOH K 4 . ? 54.147 3.841 15.456 1.00 65.56 ? 463 HOH A O 1 HETATM 6167 O O . HOH K 4 . ? 74.397 -15.091 12.403 1.00 48.85 ? 464 HOH A O 1 HETATM 6168 O O . HOH K 4 . ? 71.157 -14.581 39.170 1.00 47.20 ? 465 HOH A O 1 HETATM 6169 O O . HOH K 4 . ? 63.580 -26.566 21.767 1.00 55.65 ? 466 HOH A O 1 HETATM 6170 O O . HOH K 4 . ? 59.923 -8.975 -5.433 1.00 52.63 ? 467 HOH A O 1 HETATM 6171 O O . HOH K 4 . ? 65.625 -28.530 38.874 1.00 40.69 ? 468 HOH A O 1 HETATM 6172 O O . HOH K 4 . ? 70.271 -20.347 -6.657 1.00 62.89 ? 469 HOH A O 1 HETATM 6173 O O . HOH K 4 . ? 57.101 -21.891 -6.120 1.00 66.76 ? 470 HOH A O 1 HETATM 6174 O O . HOH K 4 . ? 72.198 -14.261 0.859 1.00 55.66 ? 471 HOH A O 1 HETATM 6175 O O . HOH K 4 . ? 77.940 -20.357 17.756 1.00 53.24 ? 472 HOH A O 1 HETATM 6176 O O . HOH K 4 . ? 56.128 -15.455 3.419 1.00 57.04 ? 473 HOH A O 1 HETATM 6177 O O . HOH K 4 . ? 71.756 -29.686 18.886 1.00 48.67 ? 474 HOH A O 1 HETATM 6178 O O . HOH K 4 . ? 70.515 -5.876 28.377 1.00 45.62 ? 475 HOH A O 1 HETATM 6179 O O . HOH K 4 . ? 63.317 -20.210 -17.334 1.00 60.31 ? 476 HOH A O 1 HETATM 6180 O O . HOH K 4 . ? 67.125 -0.846 31.734 1.00 65.40 ? 477 HOH A O 1 HETATM 6181 O O . HOH K 4 . ? 64.090 -27.778 33.073 1.00 49.94 ? 478 HOH A O 1 HETATM 6182 O O . HOH K 4 . ? 48.481 -18.165 51.525 1.00 64.11 ? 479 HOH A O 1 HETATM 6183 O O . HOH K 4 . ? 55.670 -7.273 -10.399 1.00 53.87 ? 480 HOH A O 1 HETATM 6184 O O . HOH K 4 . ? 34.426 -2.635 30.032 1.00 65.82 ? 481 HOH A O 1 HETATM 6185 O O . HOH K 4 . ? 74.346 -25.800 43.459 1.00 55.70 ? 482 HOH A O 1 HETATM 6186 O O . HOH K 4 . ? 76.845 -16.262 9.561 1.00 49.23 ? 483 HOH A O 1 HETATM 6187 O O . HOH K 4 . ? 44.443 -5.718 -29.563 1.00 75.74 ? 484 HOH A O 1 HETATM 6188 O O . HOH K 4 . ? 63.685 -24.311 -4.515 1.00 68.08 ? 485 HOH A O 1 HETATM 6189 O O . HOH K 4 . ? 67.288 -14.392 32.481 1.00 22.06 ? 486 HOH A O 1 HETATM 6190 O O . HOH K 4 . ? 59.458 -6.327 18.096 1.00 58.80 ? 487 HOH A O 1 HETATM 6191 O O . HOH K 4 . ? 61.697 -12.410 8.479 1.00 57.69 ? 488 HOH A O 1 HETATM 6192 O O . HOH K 4 . ? 51.633 -12.778 51.492 1.00 46.05 ? 489 HOH A O 1 HETATM 6193 O O . HOH K 4 . ? 33.277 3.261 7.208 1.00 70.08 ? 490 HOH A O 1 HETATM 6194 O O . HOH K 4 . ? 67.735 -3.372 32.417 1.00 54.86 ? 491 HOH A O 1 HETATM 6195 O O . HOH K 4 . ? 48.560 -12.861 25.713 1.00 47.52 ? 492 HOH A O 1 HETATM 6196 O O . HOH K 4 . ? 73.827 -4.820 21.862 1.00 62.14 ? 493 HOH A O 1 HETATM 6197 O O . HOH K 4 . ? 57.977 -6.177 -17.609 1.00 42.86 ? 494 HOH A O 1 HETATM 6198 O O . HOH K 4 . ? 48.444 -5.464 -30.799 1.00 49.19 ? 495 HOH A O 1 HETATM 6199 O O . HOH K 4 . ? 45.436 -8.156 -29.460 1.00 65.22 ? 496 HOH A O 1 HETATM 6200 O O . HOH K 4 . ? 55.514 -17.336 49.444 1.00 24.71 ? 497 HOH A O 1 HETATM 6201 O O . HOH K 4 . ? 44.918 -0.697 35.536 1.00 50.01 ? 498 HOH A O 1 HETATM 6202 O O . HOH K 4 . ? 54.539 -0.663 23.404 1.00 48.39 ? 499 HOH A O 1 HETATM 6203 O O . HOH K 4 . ? 78.707 -23.433 18.936 1.00 55.05 ? 500 HOH A O 1 HETATM 6204 O O . HOH K 4 . ? 57.657 -4.236 19.757 1.00 44.74 ? 501 HOH A O 1 HETATM 6205 O O . HOH K 4 . ? 48.981 -2.040 37.146 1.00 45.75 ? 502 HOH A O 1 HETATM 6206 O O . HOH K 4 . ? 65.680 -7.128 -26.805 1.00 55.03 ? 503 HOH A O 1 HETATM 6207 O O . HOH K 4 . ? 66.827 -29.108 30.627 1.00 52.85 ? 504 HOH A O 1 HETATM 6208 O O . HOH K 4 . ? 62.815 -4.666 -30.579 1.00 48.33 ? 505 HOH A O 1 HETATM 6209 O O . HOH K 4 . ? 64.781 -9.850 -24.186 1.00 64.96 ? 506 HOH A O 1 HETATM 6210 O O . HOH K 4 . ? 42.472 3.464 21.322 1.00 50.60 ? 507 HOH A O 1 HETATM 6211 O O . HOH K 4 . ? 58.639 -5.557 33.638 1.00 55.86 ? 508 HOH A O 1 HETATM 6212 O O . HOH K 4 . ? 48.696 0.274 38.956 1.00 41.90 ? 509 HOH A O 1 HETATM 6213 O O . HOH K 4 . ? 61.199 -22.094 -17.640 1.00 66.45 ? 510 HOH A O 1 HETATM 6214 O O . HOH K 4 . ? 64.551 -27.825 14.972 1.00 64.10 ? 511 HOH A O 1 HETATM 6215 O O . HOH K 4 . ? 41.714 1.052 27.501 1.00 52.95 ? 512 HOH A O 1 HETATM 6216 O O . HOH K 4 . ? 39.942 -2.426 30.818 1.00 56.16 ? 513 HOH A O 1 HETATM 6217 O O . HOH K 4 . ? 61.013 -11.408 -38.404 1.00 62.08 ? 514 HOH A O 1 HETATM 6218 O O . HOH K 4 . ? 74.574 -18.987 35.196 1.00 68.46 ? 515 HOH A O 1 HETATM 6219 O O . HOH K 4 . ? 60.936 -21.178 2.109 1.00 61.76 ? 516 HOH A O 1 HETATM 6220 O O . HOH K 4 . ? 70.784 -29.595 33.512 1.00 53.08 ? 517 HOH A O 1 HETATM 6221 O O . HOH K 4 . ? 65.300 -3.910 22.727 1.00 63.22 ? 518 HOH A O 1 HETATM 6222 O O . HOH K 4 . ? 50.274 -16.510 25.134 1.00 52.04 ? 519 HOH A O 1 HETATM 6223 O O . HOH K 4 . ? 64.744 -5.546 20.396 1.00 63.85 ? 520 HOH A O 1 HETATM 6224 O O . HOH K 4 . ? 67.819 -20.456 -4.881 1.00 66.68 ? 521 HOH A O 1 HETATM 6225 O O . HOH K 4 . ? 68.412 -15.387 41.820 1.00 40.53 ? 522 HOH A O 1 HETATM 6226 O O . HOH K 4 . ? 61.928 -26.471 28.382 1.00 64.44 ? 523 HOH A O 1 HETATM 6227 O O . HOH K 4 . ? 65.061 -7.137 -9.167 1.00 47.59 ? 524 HOH A O 1 HETATM 6228 O O . HOH K 4 . ? 68.699 -18.310 -3.500 1.00 66.48 ? 525 HOH A O 1 HETATM 6229 O O . HOH K 4 . ? 58.083 -0.020 30.535 1.00 50.67 ? 526 HOH A O 1 HETATM 6230 O O . HOH K 4 . ? 54.592 -1.143 -25.694 1.00 52.05 ? 527 HOH A O 1 HETATM 6231 O O . HOH K 4 . ? 57.056 -4.178 -36.578 1.00 73.56 ? 528 HOH A O 1 HETATM 6232 O O . HOH K 4 . ? 67.333 -15.239 -4.396 1.00 47.82 ? 529 HOH A O 1 HETATM 6233 O O . HOH K 4 . ? 68.767 -3.518 25.319 1.00 48.85 ? 530 HOH A O 1 HETATM 6234 O O . HOH K 4 . ? 44.188 -17.198 -24.320 1.00 70.39 ? 531 HOH A O 1 HETATM 6235 O O . HOH K 4 . ? 41.210 5.366 -23.170 1.00 57.73 ? 532 HOH A O 1 HETATM 6236 O O . HOH K 4 . ? 37.629 -13.903 -9.258 1.00 77.30 ? 533 HOH A O 1 HETATM 6237 O O . HOH K 4 . ? 67.087 -29.112 22.867 1.00 66.19 ? 534 HOH A O 1 HETATM 6238 O O . HOH K 4 . ? 45.107 -22.245 -24.863 1.00 78.68 ? 535 HOH A O 1 HETATM 6239 O O . HOH K 4 . ? 62.974 -1.442 31.859 1.00 59.37 ? 536 HOH A O 1 HETATM 6240 O O . HOH K 4 . ? 54.048 9.202 -7.371 1.00 67.41 ? 537 HOH A O 1 HETATM 6241 O O . HOH K 4 . ? 63.785 -13.331 -23.239 1.00 63.60 ? 538 HOH A O 1 HETATM 6242 O O . HOH K 4 . ? 75.523 -15.705 29.463 1.00 54.27 ? 539 HOH A O 1 HETATM 6243 O O . HOH K 4 . ? 44.396 5.541 21.968 1.00 60.19 ? 540 HOH A O 1 HETATM 6244 O O . HOH K 4 . ? 63.963 -3.909 18.462 1.00 70.60 ? 541 HOH A O 1 HETATM 6245 O O . HOH K 4 . ? 56.119 -18.248 53.861 1.00 53.88 ? 542 HOH A O 1 HETATM 6246 O O . HOH K 4 . ? 70.346 -6.617 1.393 1.00 57.75 ? 543 HOH A O 1 HETATM 6247 O O . HOH K 4 . ? 33.632 0.158 -14.100 1.00 72.36 ? 544 HOH A O 1 HETATM 6248 O O . HOH K 4 . ? 60.368 -16.471 54.614 1.00 63.65 ? 545 HOH A O 1 HETATM 6249 O O . HOH L 4 . ? 38.948 -10.659 33.517 1.00 47.80 ? 4 HOH B O 1 HETATM 6250 O O . HOH L 4 . ? 44.457 -28.631 28.197 1.00 36.74 ? 10 HOH B O 1 HETATM 6251 O O . HOH L 4 . ? 46.596 -21.170 29.383 1.00 39.28 ? 11 HOH B O 1 HETATM 6252 O O . HOH L 4 . ? 49.474 -19.289 41.506 1.00 27.93 ? 15 HOH B O 1 HETATM 6253 O O . HOH L 4 . ? 45.155 -14.206 31.891 1.00 41.31 ? 18 HOH B O 1 HETATM 6254 O O . HOH L 4 . ? 39.685 -13.169 36.338 1.00 40.03 ? 405 HOH B O 1 HETATM 6255 O O . HOH L 4 . ? 49.358 -24.847 46.331 1.00 37.58 ? 406 HOH B O 1 HETATM 6256 O O . HOH L 4 . ? 45.746 -26.450 28.314 1.00 44.80 ? 407 HOH B O 1 HETATM 6257 O O . HOH L 4 . ? 47.818 -19.168 38.921 1.00 34.54 ? 408 HOH B O 1 HETATM 6258 O O . HOH L 4 . ? 45.404 -18.069 40.108 1.00 32.83 ? 409 HOH B O 1 HETATM 6259 O O . HOH L 4 . ? 52.152 -18.441 36.288 1.00 36.65 ? 410 HOH B O 1 HETATM 6260 O O . HOH L 4 . ? 55.487 -26.250 36.800 1.00 40.93 ? 411 HOH B O 1 HETATM 6261 O O . HOH L 4 . ? 49.103 -17.326 33.869 1.00 38.81 ? 412 HOH B O 1 HETATM 6262 O O . HOH L 4 . ? 42.094 -31.058 29.326 1.00 56.66 ? 413 HOH B O 1 HETATM 6263 O O . HOH L 4 . ? 43.975 -15.890 39.484 1.00 47.08 ? 414 HOH B O 1 HETATM 6264 O O . HOH L 4 . ? 55.239 -25.378 29.630 1.00 57.53 ? 415 HOH B O 1 HETATM 6265 O O . HOH L 4 . ? 28.450 -22.239 41.537 1.00 55.91 ? 416 HOH B O 1 HETATM 6266 O O . HOH L 4 . ? 43.833 -14.080 37.169 1.00 35.27 ? 417 HOH B O 1 HETATM 6267 O O . HOH L 4 . ? 24.272 -22.780 41.061 1.00 57.52 ? 418 HOH B O 1 HETATM 6268 O O . HOH L 4 . ? 45.487 -18.284 48.705 1.00 71.76 ? 420 HOH B O 1 HETATM 6269 O O . HOH L 4 . ? 42.072 -14.704 28.692 1.00 50.91 ? 421 HOH B O 1 HETATM 6270 O O . HOH L 4 . ? 5.068 12.820 37.669 1.00 83.89 ? 422 HOH B O 1 HETATM 6271 O O . HOH L 4 . ? 42.703 -20.460 24.893 1.00 68.72 ? 423 HOH B O 1 HETATM 6272 O O . HOH L 4 . ? 33.824 -26.100 28.935 1.00 56.24 ? 424 HOH B O 1 HETATM 6273 O O . HOH L 4 . ? 36.163 -21.365 45.390 1.00 59.87 ? 425 HOH B O 1 HETATM 6274 O O . HOH L 4 . ? 46.886 -19.872 26.677 1.00 57.30 ? 426 HOH B O 1 HETATM 6275 O O . HOH L 4 . ? 21.334 -4.749 36.698 1.00 69.54 ? 427 HOH B O 1 HETATM 6276 O O . HOH L 4 . ? 43.769 -19.993 20.607 1.00 70.80 ? 428 HOH B O 1 HETATM 6277 O O . HOH L 4 . ? 11.791 -10.664 37.302 1.00 72.93 ? 429 HOH B O 1 HETATM 6278 O O . HOH L 4 . ? 56.641 -26.346 41.149 1.00 42.63 ? 430 HOH B O 1 HETATM 6279 O O . HOH L 4 . ? 2.681 -0.911 7.851 1.00 55.93 ? 431 HOH B O 1 HETATM 6280 O O . HOH L 4 . ? 5.881 -13.844 4.404 1.00 64.45 ? 432 HOH B O 1 HETATM 6281 O O . HOH L 4 . ? 6.973 -12.150 6.907 1.00 58.67 ? 433 HOH B O 1 HETATM 6282 O O . HOH L 4 . ? -8.342 17.151 14.601 1.00 80.86 ? 434 HOH B O 1 HETATM 6283 O O . HOH L 4 . ? 44.764 -19.061 45.018 1.00 55.31 ? 435 HOH B 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 . PRO A 1 ? 2.0053 1.9847 1.7097 0.4692 0.2971 0.2906 22 PRO A N 2 C CA . PRO A 1 ? 1.9606 2.0236 1.6643 0.5078 0.2939 0.3127 22 PRO A CA 3 C C . PRO A 1 ? 1.8080 1.9475 1.5418 0.5026 0.2739 0.3145 22 PRO A C 4 O O . PRO A 1 ? 1.8044 1.9272 1.5441 0.4898 0.2726 0.3089 22 PRO A O 5 C CB . PRO A 1 ? 2.0265 2.0661 1.6973 0.5421 0.3180 0.3298 22 PRO A CB 6 C CG . PRO A 1 ? 2.1019 2.0473 1.7520 0.5264 0.3367 0.3197 22 PRO A CG 7 C CD . PRO A 1 ? 2.0839 1.9931 1.7591 0.4764 0.3230 0.2937 22 PRO A CD 8 N N . GLY A 2 ? 1.6226 1.8494 1.3763 0.5108 0.2589 0.3226 23 GLY A N 9 C CA . GLY A 2 ? 1.4349 1.7485 1.2223 0.5011 0.2394 0.3258 23 GLY A CA 10 C C . GLY A 2 ? 1.3012 1.6159 1.1081 0.4593 0.2187 0.3082 23 GLY A C 11 O O . GLY A 2 ? 1.2812 1.5519 1.0952 0.4298 0.2119 0.2924 23 GLY A O 12 N N . SER A 3 ? 1.2153 1.5765 1.0239 0.4542 0.2083 0.3108 24 SER A N 13 C CA . SER A 3 ? 1.1758 1.5358 0.9933 0.4135 0.1881 0.2950 24 SER A CA 14 C C . SER A 3 ? 1.0646 1.5077 0.8759 0.4016 0.1713 0.3067 24 SER A C 15 O O . SER A 3 ? 1.0140 1.4960 0.8223 0.4311 0.1805 0.3182 24 SER A O 16 C CB . SER A 3 ? 1.2334 1.5143 1.0620 0.4172 0.1962 0.2731 24 SER A CB 17 O OG . SER A 3 ? 1.3287 1.6142 1.1431 0.4356 0.2025 0.2795 24 SER A OG 18 N N . GLY A 4 ? 1.0078 1.4755 0.8156 0.3586 0.1461 0.3042 25 GLY A N 19 C CA . GLY A 4 ? 0.9973 1.5338 0.7996 0.3422 0.1288 0.3115 25 GLY A CA 20 C C . GLY A 4 ? 0.9148 1.4290 0.7263 0.3501 0.1344 0.2965 25 GLY A C 21 O O . GLY A 4 ? 0.8615 1.3044 0.6840 0.3618 0.1478 0.2789 25 GLY A O 22 N N . PRO A 5 ? 0.8553 1.4300 0.6623 0.3431 0.1235 0.3030 26 PRO A N 23 C CA . PRO A 5 ? 0.8134 1.3787 0.6267 0.3514 0.1273 0.2914 26 PRO A CA 24 C C . PRO A 5 ? 0.8280 1.3348 0.6457 0.3229 0.1166 0.2666 26 PRO A C 25 O O . PRO A 5 ? 0.9008 1.4062 0.7107 0.2865 0.0967 0.2628 26 PRO A O 26 C CB . PRO A 5 ? 0.6980 1.3503 0.5022 0.3418 0.1134 0.3064 26 PRO A CB 27 C CG . PRO A 5 ? 0.8020 1.5125 0.5972 0.3395 0.1080 0.3278 26 PRO A CG 28 C CD . PRO A 5 ? 0.8204 1.4783 0.6152 0.3244 0.1057 0.3220 26 PRO A CD 29 N N . VAL A 6 ? 0.7934 1.2514 0.6222 0.3404 0.1286 0.2502 27 VAL A N 30 C CA . VAL A 6 ? 0.6779 1.0918 0.5100 0.3173 0.1180 0.2260 27 VAL A CA 31 C C . VAL A 6 ? 0.8369 1.2525 0.6738 0.3362 0.1234 0.2196 27 VAL A C 32 O O . VAL A 6 ? 0.8753 1.2835 0.7167 0.3719 0.1385 0.2284 27 VAL A O 33 C CB . VAL A 6 ? 0.7237 1.0546 0.5665 0.3129 0.1234 0.2061 27 VAL A CB 34 C CG1 . VAL A 6 ? 0.7516 1.0559 0.6000 0.3398 0.1413 0.2167 27 VAL A CG1 35 C CG2 . VAL A 6 ? 0.6938 0.9678 0.5459 0.3185 0.1234 0.1850 27 VAL A CG2 36 N N . PHE A 7 ? 0.7903 1.2117 0.6218 0.3128 0.1081 0.2068 28 PHE A N 37 C CA . PHE A 7 ? 0.8135 1.2416 0.6473 0.3274 0.1106 0.2008 28 PHE A CA 38 C C . PHE A 7 ? 0.8801 1.2281 0.7232 0.3419 0.1151 0.1829 28 PHE A C 39 O O . PHE A 7 ? 0.9078 1.2005 0.7521 0.3221 0.1064 0.1635 28 PHE A O 40 C CB . PHE A 7 ? 0.8385 1.2964 0.6584 0.2974 0.0894 0.1947 28 PHE A CB 41 C CG . PHE A 7 ? 0.8183 1.3557 0.6252 0.2876 0.0788 0.2181 28 PHE A CG 42 C CD1 . PHE A 7 ? 0.7637 1.3220 0.5557 0.2513 0.0566 0.2221 28 PHE A CD1 43 C CD2 . PHE A 7 ? 0.8348 1.4255 0.6438 0.3150 0.0906 0.2361 28 PHE A CD2 44 C CE1 . PHE A 7 ? 0.7646 1.3963 0.5454 0.2405 0.0468 0.2427 28 PHE A CE1 45 C CE2 . PHE A 7 ? 0.8362 1.5038 0.6347 0.3055 0.0807 0.2566 28 PHE A CE2 46 C CZ . PHE A 7 ? 0.8063 1.4950 0.5916 0.2672 0.0589 0.2595 28 PHE A CZ 47 N N . VAL A 8 ? 0.8633 1.1939 0.6930 0.3660 0.1249 0.1934 29 VAL A N 48 C CA . VAL A 8 ? 0.9883 1.2340 0.7974 0.3581 0.1287 0.1803 29 VAL A CA 49 C C . VAL A 8 ? 1.0189 1.2757 0.8268 0.3537 0.1177 0.1679 29 VAL A C 50 O O . VAL A 8 ? 1.0472 1.2454 0.8464 0.3352 0.1115 0.1492 29 VAL A O 51 C CB . VAL A 8 ? 1.1253 1.3410 0.9149 0.3806 0.1491 0.1972 29 VAL A CB 52 C CG1 . VAL A 8 ? 1.2018 1.3338 0.9756 0.3645 0.1543 0.1847 29 VAL A CG1 53 C CG2 . VAL A 8 ? 1.2038 1.4167 0.9930 0.3900 0.1610 0.2108 29 VAL A CG2 54 N N . GLN A 9 ? 0.9965 1.3335 0.8147 0.3695 0.1151 0.1790 30 GLN A N 55 C CA . GLN A 9 ? 1.0164 1.3766 0.8355 0.3677 0.1053 0.1689 30 GLN A CA 56 C C . GLN A 9 ? 0.9422 1.3937 0.7705 0.3581 0.1028 0.1742 30 GLN A C 57 O O . GLN A 9 ? 1.0027 1.5105 0.8283 0.3655 0.1089 0.1968 30 GLN A O 58 C CB . GLN A 9 ? 1.0944 1.4416 0.8951 0.3891 0.1159 0.1786 30 GLN A CB 59 C CG . GLN A 9 ? 1.2337 1.4965 1.0155 0.3771 0.1154 0.1624 30 GLN A CG 60 C CD . GLN A 9 ? 1.3499 1.6244 1.1232 0.3886 0.1148 0.1610 30 GLN A CD 61 O OE1 . GLN A 9 ? 1.4563 1.7159 1.2135 0.4074 0.1280 0.1752 30 GLN A OE1 62 N NE2 . GLN A 9 ? 1.2750 1.5764 1.0585 0.3783 0.1008 0.1442 30 GLN A NE2 63 N N . GLU A 10 ? 0.8460 1.3003 0.6657 0.3337 0.0885 0.1579 31 GLU A N 64 C CA . GLU A 10 ? 0.8830 1.3985 0.6847 0.3117 0.0729 0.1710 31 GLU A CA 65 C C . GLU A 10 ? 0.8593 1.3953 0.6529 0.3159 0.0676 0.1670 31 GLU A C 66 O O . GLU A 10 ? 0.9018 1.3967 0.7015 0.3288 0.0723 0.1480 31 GLU A O 67 C CB . GLU A 10 ? 0.9105 1.4092 0.7000 0.2738 0.0514 0.1626 31 GLU A CB 68 C CG . GLU A 10 ? 0.9098 1.3982 0.7041 0.2671 0.0547 0.1706 31 GLU A CG 69 C CD . GLU A 10 ? 0.9518 1.4325 0.7310 0.2292 0.0319 0.1671 31 GLU A CD 70 O OE1 . GLU A 10 ? 0.9742 1.4923 0.7359 0.2079 0.0148 0.1739 31 GLU A OE1 71 O OE2 . GLU A 10 ? 1.0183 1.4538 0.8018 0.2208 0.0316 0.1575 31 GLU A OE2 72 N N . PRO A 11 ? 0.7812 1.3810 0.5619 0.3046 0.0575 0.1847 32 PRO A N 73 C CA . PRO A 11 ? 0.8172 1.4423 0.5898 0.3104 0.0540 0.1845 32 PRO A CA 74 C C . PRO A 11 ? 0.8903 1.4744 0.6504 0.2889 0.0356 0.1604 32 PRO A C 75 O O . PRO A 11 ? 0.8938 1.4561 0.6443 0.2605 0.0194 0.1518 32 PRO A O 76 C CB . PRO A 11 ? 0.7222 1.4265 0.4844 0.2977 0.0465 0.2097 32 PRO A CB 77 C CG . PRO A 11 ? 0.6774 1.3985 0.4440 0.2903 0.0483 0.2236 32 PRO A CG 78 C CD . PRO A 11 ? 0.7456 1.3951 0.5177 0.2827 0.0474 0.2045 32 PRO A CD 79 N N . SER A 12 ? 0.8740 1.4467 0.6328 0.3040 0.0379 0.1494 33 SER A N 80 C CA . SER A 12 ? 0.8971 1.4289 0.6439 0.2891 0.0209 0.1246 33 SER A CA 81 C C . SER A 12 ? 0.9090 1.4780 0.6378 0.2830 0.0109 0.1309 33 SER A C 82 O O . SER A 12 ? 0.8331 1.4492 0.5646 0.3007 0.0219 0.1489 33 SER A O 83 C CB . SER A 12 ? 0.9248 1.3981 0.6852 0.3108 0.0308 0.0995 33 SER A CB 84 O OG . SER A 12 ? 0.9628 1.3971 0.7390 0.3132 0.0400 0.0911 33 SER A OG 85 N N . HIS A 13 ? 0.9442 1.4910 0.6537 0.2588 -0.0095 0.1158 34 HIS A N 86 C CA . HIS A 13 ? 0.9854 1.5563 0.6744 0.2522 -0.0192 0.1183 34 HIS A CA 87 C C . HIS A 13 ? 0.9647 1.5358 0.6627 0.2843 -0.0062 0.1151 34 HIS A C 88 O O . HIS A 13 ? 0.9145 1.4448 0.6290 0.3061 0.0041 0.0996 34 HIS A O 89 C CB . HIS A 13 ? 1.0298 1.5570 0.6959 0.2286 -0.0407 0.0959 34 HIS A CB 90 C CG . HIS A 13 ? 1.1617 1.6910 0.8120 0.1950 -0.0543 0.1012 34 HIS A CG 91 N ND1 . HIS A 13 ? 1.2054 1.6850 0.8577 0.1835 -0.0622 0.0842 34 HIS A ND1 92 C CD2 . HIS A 13 ? 1.2303 1.8061 0.8621 0.1700 -0.0605 0.1215 34 HIS A CD2 93 C CE1 . HIS A 13 ? 1.2571 1.7499 0.8911 0.1536 -0.0731 0.0946 34 HIS A CE1 94 N NE2 . HIS A 13 ? 1.2734 1.8241 0.8944 0.1442 -0.0722 0.1169 34 HIS A NE2 95 N N . VAL A 14 ? 1.0022 1.6192 0.6887 0.2867 -0.0060 0.1298 35 VAL A N 96 C CA . VAL A 14 ? 1.0546 1.6785 0.7479 0.3178 0.0071 0.1308 35 VAL A CA 97 C C . VAL A 14 ? 1.0684 1.7090 0.7396 0.3124 -0.0024 0.1310 35 VAL A C 98 O O . VAL A 14 ? 1.0950 1.7809 0.7501 0.2914 -0.0097 0.1467 35 VAL A O 99 C CB . VAL A 14 ? 1.0567 1.7334 0.7667 0.3409 0.0278 0.1570 35 VAL A CB 100 C CG1 . VAL A 14 ? 1.1231 1.8238 0.8322 0.3670 0.0381 0.1645 35 VAL A CG1 101 C CG2 . VAL A 14 ? 1.0382 1.6818 0.7697 0.3591 0.0429 0.1521 35 VAL A CG2 102 N N . MET A 15 ? 1.0539 1.6562 0.7234 0.3312 -0.0018 0.1127 36 MET A N 103 C CA . MET A 15 ? 0.9729 1.5917 0.6246 0.3358 -0.0054 0.1151 36 MET A CA 104 C C . MET A 15 ? 0.9340 1.5701 0.6008 0.3719 0.0143 0.1247 36 MET A C 105 O O . MET A 15 ? 0.9218 1.5131 0.5989 0.3943 0.0210 0.1072 36 MET A O 106 C CB . MET A 15 ? 1.0853 1.6449 0.7189 0.3297 -0.0220 0.0857 36 MET A CB 107 C CG . MET A 15 ? 1.0993 1.6593 0.7017 0.2962 -0.0410 0.0838 36 MET A CG 108 S SD . MET A 15 ? 1.0343 1.6193 0.6069 0.2959 -0.0446 0.0915 36 MET A SD 109 C CE . MET A 15 ? 0.7174 1.3716 0.3127 0.3216 -0.0220 0.1214 36 MET A CE 110 N N . PHE A 16 ? 0.9921 1.6943 0.6603 0.3779 0.0242 0.1522 37 PHE A N 111 C CA . PHE A 16 ? 1.0752 1.7985 0.7579 0.4138 0.0446 0.1648 37 PHE A CA 112 C C . PHE A 16 ? 1.1114 1.8536 0.7805 0.4259 0.0452 0.1695 37 PHE A C 113 O O . PHE A 16 ? 1.1235 1.9048 0.7760 0.4067 0.0361 0.1799 37 PHE A O 114 C CB . PHE A 16 ? 1.1236 1.9089 0.8205 0.4200 0.0576 0.1924 37 PHE A CB 115 C CG . PHE A 16 ? 1.1930 1.9932 0.9045 0.4599 0.0796 0.2050 37 PHE A CG 116 C CD1 . PHE A 16 ? 1.2230 1.9744 0.9500 0.4822 0.0922 0.1949 37 PHE A CD1 117 C CD2 . PHE A 16 ? 1.1925 2.0541 0.9014 0.4753 0.0874 0.2270 37 PHE A CD2 118 C CE1 . PHE A 16 ? 1.2504 2.0089 0.9878 0.5197 0.1101 0.2081 37 PHE A CE1 119 C CE2 . PHE A 16 ? 1.2233 2.0963 0.9432 0.5142 0.1068 0.2393 37 PHE A CE2 120 C CZ . PHE A 16 ? 1.2571 2.0762 0.9901 0.5366 0.1176 0.2303 37 PHE A CZ 121 N N . PRO A 17 ? 1.1093 1.8217 0.7844 0.4574 0.0566 0.1615 38 PRO A N 122 C CA . PRO A 17 ? 1.1324 1.8610 0.7967 0.4753 0.0605 0.1676 38 PRO A CA 123 C C . PRO A 17 ? 1.2377 2.0465 0.9058 0.4841 0.0718 0.1996 38 PRO A C 124 O O . PRO A 17 ? 1.3296 2.1715 1.0135 0.4915 0.0828 0.2155 38 PRO A O 125 C CB . PRO A 17 ? 1.0858 1.7665 0.7618 0.5094 0.0741 0.1549 38 PRO A CB 126 C CG . PRO A 17 ? 1.0704 1.6942 0.7571 0.5006 0.0696 0.1317 38 PRO A CG 127 C CD . PRO A 17 ? 1.0397 1.6952 0.7312 0.4762 0.0657 0.1438 38 PRO A CD 128 N N . LEU A 18 ? 1.3001 2.1402 0.9533 0.4840 0.0692 0.2083 39 LEU A N 129 C CA . LEU A 18 ? 1.4153 2.3333 1.0731 0.4962 0.0806 0.2371 39 LEU A CA 130 C C . LEU A 18 ? 1.6080 2.5217 1.2695 0.5365 0.0965 0.2424 39 LEU A C 131 O O . LEU A 18 ? 1.6717 2.6218 1.3236 0.5439 0.0986 0.2543 39 LEU A O 132 C CB . LEU A 18 ? 1.3363 2.3016 0.9756 0.4673 0.0688 0.2461 39 LEU A CB 133 C CG . LEU A 18 ? 1.2019 2.1957 0.8380 0.4286 0.0569 0.2500 39 LEU A CG 134 C CD1 . LEU A 18 ? 1.1711 2.1846 0.7812 0.3974 0.0439 0.2503 39 LEU A CD1 135 C CD2 . LEU A 18 ? 1.1616 2.2277 0.8171 0.4354 0.0678 0.2744 39 LEU A CD2 136 N N . ASP A 19 ? 1.6641 2.5309 1.3384 0.5620 0.1075 0.2333 40 ASP A N 137 C CA . ASP A 19 ? 1.6872 2.5403 1.3642 0.6014 0.1224 0.2378 40 ASP A CA 138 C C . ASP A 19 ? 1.6811 2.4949 1.3734 0.6262 0.1325 0.2375 40 ASP A C 139 O O . ASP A 19 ? 1.6647 2.5150 1.3651 0.6443 0.1430 0.2602 40 ASP A O 140 C CB . ASP A 19 ? 1.6872 2.4874 1.3486 0.6042 0.1149 0.2168 40 ASP A CB 141 C CG . ASP A 19 ? 1.6761 2.4173 1.3301 0.5765 0.0972 0.1872 40 ASP A CG 142 O OD1 . ASP A 19 ? 1.6708 2.4257 1.3100 0.5461 0.0812 0.1845 40 ASP A OD1 143 O OD2 . ASP A 19 ? 1.6682 2.3484 1.3308 0.5856 0.0975 0.1669 40 ASP A OD2 144 N N . LYS A 24 ? 1.4364 2.2883 1.1645 0.6576 0.1750 0.3218 45 LYS A N 145 C CA . LYS A 24 ? 1.4102 2.2283 1.1447 0.6288 0.1606 0.2961 45 LYS A CA 146 C C . LYS A 24 ? 1.3440 2.1551 1.0974 0.5975 0.1489 0.2810 45 LYS A C 147 O O . LYS A 24 ? 1.4228 2.1769 1.1686 0.5920 0.1514 0.2760 45 LYS A O 148 C CB . LYS A 24 ? 1.4020 2.2858 1.1468 0.6272 0.1560 0.2974 45 LYS A CB 149 C CG . LYS A 24 ? 1.4773 2.3476 1.2024 0.6553 0.1641 0.3059 45 LYS A CG 150 C CD . LYS A 24 ? 1.4867 2.4092 1.2188 0.6495 0.1593 0.3035 45 LYS A CD 151 C CE . LYS A 24 ? 1.5447 2.4398 1.2566 0.6766 0.1658 0.3084 45 LYS A CE 152 N NZ . LYS A 24 ? 1.5286 2.4688 1.2448 0.6718 0.1620 0.3061 45 LYS A NZ 153 N N . VAL A 25 ? 1.2258 2.0833 0.9877 0.5673 0.1415 0.2718 46 VAL A N 154 C CA . VAL A 25 ? 1.2200 2.0608 0.9852 0.5299 0.1304 0.2563 46 VAL A CA 155 C C . VAL A 25 ? 1.2568 2.0988 1.0310 0.5300 0.1349 0.2649 46 VAL A C 156 O O . VAL A 25 ? 1.1962 2.0999 0.9721 0.5401 0.1414 0.2873 46 VAL A O 157 C CB . VAL A 25 ? 1.1749 2.0668 0.9285 0.4947 0.1150 0.2582 46 VAL A CB 158 C CG1 . VAL A 25 ? 1.1804 2.1626 0.9334 0.5004 0.1186 0.2863 46 VAL A CG1 159 C CG2 . VAL A 25 ? 1.1376 2.0047 0.8885 0.4567 0.0995 0.2451 46 VAL A CG2 160 N N . LYS A 26 ? 1.2563 2.0289 1.0349 0.5188 0.1304 0.2466 47 LYS A N 161 C CA . LYS A 26 ? 1.2214 1.9811 1.0065 0.5173 0.1337 0.2520 47 LYS A CA 162 C C . LYS A 26 ? 1.1780 1.9267 0.9657 0.4770 0.1216 0.2357 47 LYS A C 163 O O . LYS A 26 ? 1.2268 1.9276 1.0116 0.4587 0.1114 0.2122 47 LYS A O 164 C CB . LYS A 26 ? 1.2348 1.9042 1.0037 0.5345 0.1385 0.2501 47 LYS A CB 165 C CG . LYS A 26 ? 1.2327 1.8533 1.0023 0.5200 0.1384 0.2438 47 LYS A CG 166 C CD . LYS A 26 ? 1.2698 1.8085 1.0127 0.5328 0.1520 0.2472 47 LYS A CD 167 C CE . LYS A 26 ? 1.2366 1.6924 0.9753 0.5064 0.1472 0.2277 47 LYS A CE 168 N NZ . LYS A 26 ? 1.1483 1.6174 0.9008 0.4980 0.1470 0.2317 47 LYS A NZ 169 N N . LEU A 27 ? 1.0906 1.8815 0.8789 0.4637 0.1201 0.2496 48 LEU A N 170 C CA . LEU A 27 ? 1.0166 1.7917 0.8016 0.4259 0.1054 0.2390 48 LEU A CA 171 C C . LEU A 27 ? 1.0648 1.8036 0.8608 0.4322 0.1136 0.2383 48 LEU A C 172 O O . LEU A 27 ? 1.0351 1.8144 0.8322 0.4331 0.1167 0.2562 48 LEU A O 173 C CB . LEU A 27 ? 0.9299 1.7769 0.7039 0.3987 0.0911 0.2552 48 LEU A CB 174 C CG . LEU A 27 ? 0.8754 1.7483 0.6352 0.3811 0.0774 0.2529 48 LEU A CG 175 C CD1 . LEU A 27 ? 0.8273 1.7653 0.5764 0.3501 0.0626 0.2679 48 LEU A CD1 176 C CD2 . LEU A 27 ? 0.9007 1.7043 0.6528 0.3641 0.0654 0.2253 48 LEU A CD2 177 N N . SER A 28 ? 1.0899 1.7508 0.8928 0.4362 0.1153 0.2177 49 SER A N 178 C CA . SER A 28 ? 1.0791 1.6891 0.8883 0.4447 0.1208 0.2177 49 SER A CA 179 C C . SER A 28 ? 0.9993 1.6264 0.8115 0.4193 0.1168 0.2193 49 SER A C 180 O O . SER A 28 ? 0.9755 1.6106 0.7796 0.3851 0.1013 0.2102 49 SER A O 181 C CB . SER A 28 ? 1.1937 1.7055 0.9919 0.4394 0.1138 0.1972 49 SER A CB 182 O OG . SER A 28 ? 1.2341 1.7383 1.0352 0.4199 0.1018 0.1737 49 SER A OG 183 N N . CYS A 29 ? 0.9774 1.6023 0.7939 0.4361 0.1270 0.2337 50 CYS A N 184 C CA . CYS A 29 ? 0.9869 1.6246 0.8045 0.4164 0.1240 0.2383 50 CYS A CA 185 C C . CYS A 29 ? 1.0635 1.6839 0.8844 0.4464 0.1386 0.2531 50 CYS A C 186 O O . CYS A 29 ? 1.0930 1.7598 0.9100 0.4738 0.1485 0.2743 50 CYS A O 187 C CB . CYS A 29 ? 0.9999 1.7201 0.8065 0.3951 0.1124 0.2553 50 CYS A CB 188 S SG . CYS A 29 ? 1.2049 1.9463 1.0077 0.3689 0.1028 0.2663 50 CYS A SG 189 N N . GLU A 30 ? 1.1036 1.6528 0.9265 0.4416 0.1385 0.2433 51 GLU A N 190 C CA . GLU A 30 ? 1.1371 1.6554 0.9498 0.4633 0.1514 0.2582 51 GLU A CA 191 C C . GLU A 30 ? 1.0075 1.5063 0.8304 0.4458 0.1484 0.2531 51 GLU A C 192 O O . GLU A 30 ? 0.8589 1.3237 0.6887 0.4171 0.1378 0.2330 51 GLU A O 193 C CB . GLU A 30 ? 1.2707 1.6967 1.0541 0.4722 0.1642 0.2541 51 GLU A CB 194 C CG . GLU A 30 ? 1.3392 1.6761 1.1169 0.4420 0.1583 0.2298 51 GLU A CG 195 C CD . GLU A 30 ? 1.4591 1.7116 1.2119 0.4457 0.1739 0.2299 51 GLU A CD 196 O OE1 . GLU A 30 ? 1.5082 1.7417 1.2497 0.4613 0.1901 0.2442 51 GLU A OE1 197 O OE2 . GLU A 30 ? 1.5090 1.7160 1.2538 0.4316 0.1703 0.2160 51 GLU A OE2 198 N N . VAL A 31 ? 1.0116 1.5321 0.8327 0.4639 0.1588 0.2711 52 VAL A N 199 C CA . VAL A 31 ? 0.9791 1.4903 0.8071 0.4475 0.1578 0.2685 52 VAL A CA 200 C C . VAL A 31 ? 1.0419 1.4861 0.8508 0.4662 0.1743 0.2760 52 VAL A C 201 O O . VAL A 31 ? 1.0610 1.4962 0.8493 0.4946 0.1893 0.2900 52 VAL A O 202 C CB . VAL A 31 ? 0.9408 1.5428 0.7652 0.4326 0.1527 0.2837 52 VAL A CB 203 C CG1 . VAL A 31 ? 1.0431 1.6938 0.8612 0.4701 0.1664 0.3083 52 VAL A CG1 204 C CG2 . VAL A 31 ? 0.8584 1.4443 0.6823 0.4016 0.1432 0.2791 52 VAL A CG2 205 N N . LYS A 32 ? 1.0322 1.4260 0.8434 0.4471 0.1733 0.2656 53 LYS A N 206 C CA . LYS A 32 ? 1.0670 1.4025 0.8596 0.4585 0.1903 0.2722 53 LYS A CA 207 C C . LYS A 32 ? 1.1044 1.4797 0.9132 0.4560 0.1868 0.2788 53 LYS A C 208 O O . LYS A 32 ? 1.0242 1.4461 0.8571 0.4342 0.1708 0.2722 53 LYS A O 209 C CB . LYS A 32 ? 1.0951 1.3236 0.8741 0.4340 0.1948 0.2528 53 LYS A CB 210 C CG . LYS A 32 ? 1.0651 1.2693 0.8604 0.3999 0.1813 0.2335 53 LYS A CG 211 C CD . LYS A 32 ? 1.1961 1.3048 0.9806 0.3727 0.1856 0.2146 53 LYS A CD 212 C CE . LYS A 32 ? 1.2473 1.3348 1.0467 0.3403 0.1720 0.1955 53 LYS A CE 213 N NZ . LYS A 32 ? 1.3352 1.3443 1.1299 0.3093 0.1742 0.1768 53 LYS A NZ 214 N N . GLY A 33 ? 1.1374 1.4940 0.9306 0.4770 0.2026 0.2921 54 GLY A N 215 C CA . GLY A 33 ? 1.1061 1.4982 0.9121 0.4774 0.2008 0.2996 54 GLY A CA 216 C C . GLY A 33 ? 1.1676 1.5694 0.9536 0.5136 0.2188 0.3206 54 GLY A C 217 O O . GLY A 33 ? 1.1754 1.5805 0.9414 0.5415 0.2306 0.3324 54 GLY A O 218 N N . ASN A 34 ? 1.1985 1.6052 0.9884 0.5145 0.2212 0.3253 55 ASN A N 219 C CA . ASN A 34 ? 1.2863 1.6953 1.0543 0.5493 0.2389 0.3439 55 ASN A CA 220 C C . ASN A 34 ? 1.2319 1.7226 1.0165 0.5523 0.2316 0.3560 55 ASN A C 221 O O . ASN A 34 ? 1.2444 1.7117 1.0332 0.5245 0.2251 0.3477 55 ASN A O 222 C CB . ASN A 34 ? 1.3741 1.6694 1.1146 0.5456 0.2570 0.3358 55 ASN A CB 223 C CG . ASN A 34 ? 1.4346 1.7244 1.1486 0.5816 0.2767 0.3541 55 ASN A CG 224 O OD1 . ASN A 34 ? 1.4346 1.7817 1.1375 0.6176 0.2828 0.3732 55 ASN A OD1 225 N ND2 . ASN A 34 ? 1.3921 1.6136 1.0942 0.5726 0.2873 0.3481 55 ASN A ND2 226 N N . PRO A 35 ? 1.1734 1.7491 0.9459 0.5721 0.2319 0.3764 56 PRO A N 227 C CA . PRO A 35 ? 1.2235 1.8333 0.9879 0.6090 0.2407 0.3886 56 PRO A CA 228 C C . PRO A 35 ? 1.2632 1.8886 1.0386 0.5909 0.2297 0.3793 56 PRO A C 229 O O . PRO A 35 ? 1.1861 1.8365 0.9719 0.5472 0.2111 0.3692 56 PRO A O 230 C CB . PRO A 35 ? 1.1922 1.9053 0.9442 0.6195 0.2368 0.4100 56 PRO A CB 231 C CG . PRO A 35 ? 1.1967 1.9041 0.9448 0.6035 0.2323 0.4119 56 PRO A CG 232 C CD . PRO A 35 ? 1.1448 1.7888 0.9081 0.5594 0.2211 0.3908 56 PRO A CD 233 N N . LYS A 36 ? 1.3235 1.9241 1.0836 0.6206 0.2410 0.3844 57 LYS A N 234 C CA . LYS A 36 ? 1.3283 1.9482 1.0958 0.6124 0.2328 0.3787 57 LYS A CA 235 C C . LYS A 36 ? 1.2771 2.0060 1.0574 0.5877 0.2163 0.3831 57 LYS A C 236 O O . LYS A 36 ? 1.3406 2.1475 1.1115 0.6031 0.2171 0.4015 57 LYS A O 237 C CB . LYS A 36 ? 1.4235 2.0253 1.1589 0.6498 0.2500 0.3913 57 LYS A CB 238 C CG . LYS A 36 ? 1.4734 2.0812 1.2109 0.6446 0.2445 0.3856 57 LYS A CG 239 C CD . LYS A 36 ? 1.5030 2.2330 1.2587 0.6574 0.2349 0.3991 57 LYS A CD 240 C CE . LYS A 36 ? 1.5789 2.3061 1.3228 0.6696 0.2380 0.4001 57 LYS A CE 241 N NZ . LYS A 36 ? 1.6725 2.3303 1.3761 0.7040 0.2607 0.4096 57 LYS A NZ 242 N N . PRO A 37 ? 1.1449 1.8721 0.9370 0.5450 0.1994 0.3672 58 PRO A N 243 C CA . PRO A 37 ? 1.0470 1.8563 0.8391 0.5098 0.1786 0.3720 58 PRO A CA 244 C C . PRO A 37 ? 1.0062 1.8795 0.7963 0.5244 0.1783 0.3808 58 PRO A C 245 O O . PRO A 37 ? 0.9273 1.7642 0.7202 0.5454 0.1882 0.3743 58 PRO A O 246 C CB . PRO A 37 ? 0.9799 1.7411 0.7806 0.4648 0.1628 0.3502 58 PRO A CB 247 C CG . PRO A 37 ? 0.9997 1.6619 0.8074 0.4746 0.1756 0.3345 58 PRO A CG 248 C CD . PRO A 37 ? 1.0741 1.7132 0.8769 0.5257 0.1967 0.3440 58 PRO A CD 249 N N . HIS A 38 ? 1.0700 2.0361 0.8546 0.5130 0.1660 0.3960 59 HIS A N 250 C CA . HIS A 38 ? 1.0967 2.1318 0.8799 0.5217 0.1635 0.4045 59 HIS A CA 251 C C . HIS A 38 ? 1.1002 2.1403 0.8883 0.4775 0.1439 0.3919 59 HIS A C 252 O O . HIS A 38 ? 1.1116 2.1405 0.8994 0.4361 0.1265 0.3847 59 HIS A O 253 C CB . HIS A 38 ? 1.1925 2.3291 0.9678 0.5319 0.1597 0.4265 59 HIS A CB 254 C CG . HIS A 38 ? 1.3333 2.5509 1.1089 0.5256 0.1507 0.4338 59 HIS A CG 255 N ND1 . HIS A 38 ? 1.3954 2.6195 1.1711 0.5575 0.1632 0.4359 59 HIS A ND1 256 C CD2 . HIS A 38 ? 1.3555 2.6492 1.1306 0.4908 0.1307 0.4393 59 HIS A CD2 257 C CE1 . HIS A 38 ? 1.3755 2.6774 1.1518 0.5431 0.1517 0.4423 59 HIS A CE1 258 N NE2 . HIS A 38 ? 1.3617 2.7069 1.1377 0.5022 0.1321 0.4442 59 HIS A NE2 259 N N . ILE A 39 ? 1.0786 2.1334 0.8685 0.4875 0.1464 0.3899 60 ILE A N 260 C CA . ILE A 39 ? 1.0361 2.0847 0.8278 0.4508 0.1301 0.3763 60 ILE A CA 261 C C . ILE A 39 ? 1.0454 2.1832 0.8333 0.4422 0.1201 0.3879 60 ILE A C 262 O O . ILE A 39 ? 1.0326 2.2184 0.8197 0.4762 0.1315 0.4009 60 ILE A O 263 C CB . ILE A 39 ? 1.0565 2.0250 0.8545 0.4619 0.1393 0.3572 60 ILE A CB 264 C CG1 . ILE A 39 ? 1.1178 1.9979 0.9207 0.4486 0.1401 0.3397 60 ILE A CG1 265 C CG2 . ILE A 39 ? 1.0340 2.0141 0.8307 0.4371 0.1259 0.3475 60 ILE A CG2 266 C CD1 . ILE A 39 ? 1.1579 1.9559 0.9682 0.4663 0.1517 0.3218 60 ILE A CD1 267 N N . ARG A 40 ? 1.0401 2.1972 0.8239 0.3965 0.0987 0.3829 61 ARG A N 268 C CA . ARG A 40 ? 0.9832 2.2205 0.7622 0.3803 0.0872 0.3916 61 ARG A CA 269 C C . ARG A 40 ? 0.9164 2.1199 0.6907 0.3458 0.0730 0.3749 61 ARG A C 270 O O . ARG A 40 ? 0.9134 2.0414 0.6865 0.3274 0.0676 0.3578 61 ARG A O 271 C CB . ARG A 40 ? 0.9330 2.2439 0.7070 0.3576 0.0745 0.4058 61 ARG A CB 272 C CG . ARG A 40 ? 0.9891 2.3661 0.7562 0.3214 0.0570 0.4089 61 ARG A CG 273 C CD . ARG A 40 ? 1.0088 2.4382 0.7698 0.2904 0.0427 0.4180 61 ARG A CD 274 N NE . ARG A 40 ? 1.0204 2.4001 0.7822 0.2924 0.0446 0.4163 61 ARG A NE 275 C CZ . ARG A 40 ? 1.0573 2.4298 0.8114 0.2551 0.0295 0.4148 61 ARG A CZ 276 N NH1 . ARG A 40 ? 1.0462 2.4555 0.7895 0.2115 0.0116 0.4140 61 ARG A NH1 277 N NH2 . ARG A 40 ? 1.0414 2.3663 0.7968 0.2610 0.0329 0.4137 61 ARG A NH2 278 N N . TRP A 41 ? 0.8815 2.1404 0.6516 0.3384 0.0673 0.3796 62 TRP A N 279 C CA . TRP A 41 ? 0.8709 2.1000 0.6333 0.3106 0.0553 0.3647 62 TRP A CA 280 C C . TRP A 41 ? 0.8285 2.1182 0.5783 0.2695 0.0370 0.3697 62 TRP A C 281 O O . TRP A 41 ? 0.8210 2.1929 0.5713 0.2680 0.0357 0.3863 62 TRP A O 282 C CB . TRP A 41 ? 0.8570 2.0768 0.6238 0.3415 0.0677 0.3613 62 TRP A CB 283 C CG . TRP A 41 ? 0.9231 2.0649 0.6985 0.3730 0.0837 0.3500 62 TRP A CG 284 C CD1 . TRP A 41 ? 0.9732 2.1120 0.7569 0.4153 0.1034 0.3589 62 TRP A CD1 285 C CD2 . TRP A 41 ? 0.9804 2.0353 0.7557 0.3645 0.0816 0.3270 62 TRP A CD2 286 N NE1 . TRP A 41 ? 0.9913 2.0448 0.7804 0.4318 0.1142 0.3426 62 TRP A NE1 287 C CE2 . TRP A 41 ? 1.0101 2.0138 0.7957 0.4010 0.1009 0.3225 62 TRP A CE2 288 C CE3 . TRP A 41 ? 0.9690 1.9842 0.7350 0.3307 0.0652 0.3092 62 TRP A CE3 289 C CZ2 . TRP A 41 ? 1.0547 1.9732 0.8443 0.4026 0.1041 0.3001 62 TRP A CZ2 290 C CZ3 . TRP A 41 ? 0.9830 1.9151 0.7519 0.3347 0.0678 0.2871 62 TRP A CZ3 291 C CH2 . TRP A 41 ? 1.0458 1.9324 0.8278 0.3693 0.0872 0.2823 62 TRP A CH2 292 N N . LYS A 42 ? 0.8448 2.0934 0.5818 0.2366 0.0232 0.3546 63 LYS A N 293 C CA . LYS A 42 ? 0.9147 2.2096 0.6351 0.1952 0.0069 0.3575 63 LYS A CA 294 C C . LYS A 42 ? 0.9809 2.2464 0.6873 0.1799 -0.0001 0.3440 63 LYS A C 295 O O . LYS A 42 ? 1.0338 2.2210 0.7322 0.1699 -0.0060 0.3259 63 LYS A O 296 C CB . LYS A 42 ? 0.8802 2.1584 0.5894 0.1574 -0.0075 0.3554 63 LYS A CB 297 C CG . LYS A 42 ? 1.0218 2.3565 0.7395 0.1631 -0.0046 0.3722 63 LYS A CG 298 C CD . LYS A 42 ? 1.1390 2.4775 0.8411 0.1183 -0.0212 0.3726 63 LYS A CD 299 C CE . LYS A 42 ? 1.1879 2.4352 0.8864 0.1092 -0.0255 0.3594 63 LYS A CE 300 N NZ . LYS A 42 ? 1.1799 2.4291 0.8613 0.0673 -0.0412 0.3609 63 LYS A NZ 301 N N . LEU A 43 ? 1.0056 2.3354 0.7081 0.1788 0.0006 0.3526 64 LEU A N 302 C CA . LEU A 43 ? 1.0530 2.3614 0.7393 0.1642 -0.0056 0.3414 64 LEU A CA 303 C C . LEU A 43 ? 1.1111 2.4426 0.7726 0.1147 -0.0217 0.3407 64 LEU A C 304 O O . LEU A 43 ? 1.1700 2.5816 0.8306 0.1001 -0.0231 0.3550 64 LEU A O 305 C CB . LEU A 43 ? 1.0122 2.3694 0.7074 0.1943 0.0063 0.3502 64 LEU A CB 306 C CG . LEU A 43 ? 1.1116 2.4539 0.7903 0.1839 0.0019 0.3407 64 LEU A CG 307 C CD1 . LEU A 43 ? 1.1203 2.3640 0.7849 0.1720 -0.0066 0.3179 64 LEU A CD1 308 C CD2 . LEU A 43 ? 1.1608 2.5314 0.8527 0.2242 0.0168 0.3480 64 LEU A CD2 309 N N . ASN A 44 ? 1.1638 2.6251 1.0709 0.0837 0.0792 0.3301 65 ASN A N 310 C CA . ASN A 44 ? 1.2522 2.7457 1.1582 0.0308 0.0760 0.3239 65 ASN A CA 311 C C . ASN A 44 ? 1.2542 2.8099 1.1841 -0.0002 0.0637 0.3319 65 ASN A C 312 O O . ASN A 44 ? 1.2947 2.8780 1.2267 -0.0467 0.0601 0.3262 65 ASN A O 313 C CB . ASN A 44 ? 1.3573 2.9125 1.2688 0.0317 0.0863 0.3224 65 ASN A CB 314 C CG . ASN A 44 ? 1.4577 2.9433 1.3384 0.0388 0.0978 0.3094 65 ASN A CG 315 O OD1 . ASN A 44 ? 1.3751 2.7704 1.2313 0.0522 0.0983 0.3024 65 ASN A OD1 316 N ND2 . ASN A 44 ? 1.6620 3.1900 1.5429 0.0296 0.1067 0.3054 65 ASN A ND2 317 N N . GLY A 45 ? 1.1893 2.7665 1.1374 0.0260 0.0576 0.3447 66 GLY A N 318 C CA . GLY A 45 ? 1.0714 2.7069 1.0415 0.0000 0.0455 0.3529 66 GLY A CA 319 C C . GLY A 45 ? 1.0129 2.7478 1.0140 0.0324 0.0434 0.3709 66 GLY A C 320 O O . GLY A 45 ? 0.9419 2.7264 0.9615 0.0198 0.0331 0.3800 66 GLY A O 321 N N . THR A 46 ? 1.0132 2.7775 1.0195 0.0745 0.0525 0.3766 67 THR A N 322 C CA . THR A 46 ? 0.9995 2.8607 1.0333 0.1073 0.0495 0.3945 67 THR A CA 323 C C . THR A 46 ? 0.9684 2.8009 1.0093 0.1631 0.0531 0.4072 67 THR A C 324 O O . THR A 46 ? 0.9734 2.7356 0.9996 0.1943 0.0634 0.4023 67 THR A O 325 C CB . THR A 46 ? 1.0347 2.9590 1.0723 0.1179 0.0552 0.3942 67 THR A CB 326 O OG1 . THR A 46 ? 1.0138 2.9643 1.0461 0.0662 0.0541 0.3810 67 THR A OG1 327 C CG2 . THR A 46 ? 1.0203 3.0466 1.0757 0.1490 0.0531 0.4145 67 THR A CG2 328 N N . ASP A 47 ? 0.9914 2.8795 1.0552 0.1756 0.0454 0.4231 68 ASP A N 329 C CA . ASP A 47 ? 1.0406 2.9055 1.1136 0.2282 0.0526 0.4361 68 ASP A CA 330 C C . ASP A 47 ? 1.0880 2.9468 1.1504 0.2771 0.0645 0.4419 68 ASP A C 331 O O . ASP A 47 ? 1.1383 3.0811 1.2005 0.2848 0.0649 0.4522 68 ASP A O 332 C CB . ASP A 47 ? 1.0784 3.0137 1.1570 0.2310 0.0536 0.4556 68 ASP A CB 333 C CG . ASP A 47 ? 1.1001 2.9980 1.1853 0.1967 0.0461 0.4497 68 ASP A CG 334 O OD1 . ASP A 47 ? 1.0121 2.8415 1.0909 0.1652 0.0396 0.4326 68 ASP A OD1 335 O OD2 . ASP A 47 ? 1.1683 3.1173 1.2582 0.2020 0.0478 0.4667 68 ASP A OD2 336 N N . VAL A 48 ? 1.0443 2.8149 1.0962 0.3108 0.0745 0.4374 69 VAL A N 337 C CA . VAL A 48 ? 1.0422 2.7916 1.0798 0.3572 0.0869 0.4426 69 VAL A CA 338 C C . VAL A 48 ? 1.1323 2.9033 1.1635 0.3965 0.0991 0.4637 69 VAL A C 339 O O . VAL A 48 ? 1.1524 2.8727 1.1798 0.4095 0.1053 0.4662 69 VAL A O 340 C CB . VAL A 48 ? 0.9565 2.5987 0.9806 0.3765 0.0935 0.4282 69 VAL A CB 341 C CG1 . VAL A 48 ? 0.9902 2.6016 0.9953 0.4250 0.1078 0.4352 69 VAL A CG1 342 C CG2 . VAL A 48 ? 0.8843 2.4922 0.8932 0.3363 0.0918 0.4070 69 VAL A CG2 343 N N . ASP A 49 ? 1.1313 2.9934 1.1610 0.4182 0.1034 0.4825 70 ASP A N 344 C CA . ASP A 49 ? 1.1572 3.0624 1.1801 0.4612 0.1167 0.5088 70 ASP A CA 345 C C . ASP A 49 ? 1.2280 3.0482 1.2299 0.5062 0.1323 0.5099 70 ASP A C 346 O O . ASP A 49 ? 1.2185 3.0548 1.2122 0.5259 0.1368 0.5140 70 ASP A O 347 C CB . ASP A 49 ? 1.1468 3.1881 1.1760 0.4655 0.1148 0.5285 70 ASP A CB 348 C CG . ASP A 49 ? 1.1775 3.2846 1.2056 0.4977 0.1249 0.5567 70 ASP A CG 349 O OD1 . ASP A 49 ? 1.2014 3.2439 1.2228 0.5184 0.1344 0.5615 70 ASP A OD1 350 O OD2 . ASP A 49 ? 1.1671 3.3911 1.2080 0.5018 0.1244 0.5713 70 ASP A OD2 351 N N . ILE A 50 ? 1.3120 3.0414 1.3040 0.5204 0.1405 0.5058 71 ILE A N 352 C CA . ILE A 50 ? 1.4172 3.0456 1.3859 0.5545 0.1545 0.5012 71 ILE A CA 353 C C . ILE A 50 ? 1.4857 3.1519 1.4407 0.6023 0.1709 0.5282 71 ILE A C 354 O O . ILE A 50 ? 1.4784 3.1107 1.4184 0.6237 0.1785 0.5276 71 ILE A O 355 C CB . ILE A 50 ? 1.4368 2.9572 1.3966 0.5530 0.1585 0.4874 71 ILE A CB 356 C CG1 . ILE A 50 ? 1.3122 2.7824 1.2787 0.5177 0.1463 0.4618 71 ILE A CG1 357 C CG2 . ILE A 50 ? 1.5305 2.9639 1.4628 0.5923 0.1760 0.4894 71 ILE A CG2 358 C CD1 . ILE A 50 ? 1.2245 2.6638 1.1986 0.4988 0.1424 0.4555 71 ILE A CD1 359 N N . GLY A 51 ? 1.5451 3.2814 1.5052 0.6182 0.1766 0.5523 72 GLY A N 360 C CA . GLY A 51 ? 1.6177 3.3932 1.5656 0.6640 0.1930 0.5803 72 GLY A CA 361 C C . GLY A 51 ? 1.6527 3.5146 1.6036 0.6721 0.1911 0.5912 72 GLY A C 362 O O . GLY A 51 ? 1.6708 3.5559 1.6099 0.7101 0.2048 0.6122 72 GLY A O 363 N N . MET A 52 ? 1.6591 3.5667 1.6253 0.6352 0.1744 0.5765 73 MET A N 364 C CA . MET A 52 ? 1.6969 3.6930 1.6706 0.6366 0.1709 0.5826 73 MET A CA 365 C C . MET A 52 ? 1.6608 3.6823 1.6516 0.5885 0.1532 0.5591 73 MET A C 366 O O . MET A 52 ? 1.6197 3.6987 1.6272 0.5551 0.1417 0.5561 73 MET A O 367 C CB . MET A 52 ? 1.7387 3.8602 1.7431 0.6552 0.1774 0.6045 73 MET A CB 368 C CG . MET A 52 ? 1.7298 3.9685 1.7723 0.6386 0.1729 0.5990 73 MET A CG 369 S SD . MET A 52 ? 3.1108 5.3404 3.1567 0.6590 0.1856 0.5918 73 MET A SD 370 C CE . MET A 52 ? 2.0826 4.2674 2.1116 0.7200 0.2054 0.6178 73 MET A CE 371 N N . ASP A 53 ? 1.6886 3.6667 1.6760 0.5840 0.1529 0.5422 74 ASP A N 372 C CA . ASP A 53 ? 1.7737 3.6943 1.7442 0.6227 0.1678 0.5473 74 ASP A CA 373 C C . ASP A 53 ? 1.7732 3.5847 1.7242 0.6146 0.1626 0.5258 74 ASP A C 374 O O . ASP A 53 ? 1.7608 3.5765 1.7236 0.5829 0.1527 0.5051 74 ASP A O 375 C CB . ASP A 53 ? 1.8449 3.8571 1.8407 0.6386 0.1803 0.5537 74 ASP A CB 376 C CG . ASP A 53 ? 1.9412 3.8993 1.9229 0.6781 0.1970 0.5605 74 ASP A CG 377 O OD1 . ASP A 53 ? 1.9861 3.8757 1.9436 0.7062 0.2052 0.5733 74 ASP A OD1 378 O OD2 . ASP A 53 ? 1.9607 3.9428 1.9543 0.6789 0.2034 0.5523 74 ASP A OD2 379 N N . PHE A 54 ? 1.8113 3.5269 1.7417 0.6416 0.1752 0.5266 75 PHE A N 380 C CA . PHE A 54 ? 1.8775 3.4964 1.7924 0.6446 0.1777 0.5085 75 PHE A CA 381 C C . PHE A 54 ? 1.9058 3.4438 1.7981 0.6790 0.1958 0.5176 75 PHE A C 382 O O . PHE A 54 ? 1.8668 3.4427 1.7548 0.7083 0.2082 0.5431 75 PHE A O 383 C CB . PHE A 54 ? 1.8981 3.4468 1.8187 0.6058 0.1644 0.4769 75 PHE A CB 384 C CG . PHE A 54 ? 1.8705 3.4803 1.8099 0.5699 0.1479 0.4649 75 PHE A CG 385 C CD1 . PHE A 54 ? 1.8447 3.4923 1.8030 0.5337 0.1353 0.4578 75 PHE A CD1 386 C CD2 . PHE A 54 ? 1.8828 3.5108 1.8205 0.5703 0.1457 0.4602 75 PHE A CD2 387 C CE1 . PHE A 54 ? 1.8066 3.5082 1.7802 0.4981 0.1212 0.4469 75 PHE A CE1 388 C CE2 . PHE A 54 ? 1.8635 3.5414 1.8207 0.5322 0.1387 0.4440 75 PHE A CE2 389 C CZ . PHE A 54 ? 1.8201 3.5339 1.7928 0.4962 0.1259 0.4384 75 PHE A CZ 390 N N . ARG A 55 ? 1.9619 3.3891 1.8392 0.6741 0.1974 0.4963 76 ARG A N 391 C CA . ARG A 55 ? 2.0205 3.3573 1.8761 0.6957 0.2122 0.4982 76 ARG A CA 392 C C . ARG A 55 ? 1.9189 3.1813 1.7761 0.6674 0.2038 0.4733 76 ARG A C 393 O O . ARG A 55 ? 1.9303 3.0941 1.7692 0.6671 0.2077 0.4568 76 ARG A O 394 C CB . ARG A 55 ? 2.1555 3.4217 1.9890 0.7131 0.2222 0.4943 76 ARG A CB 395 C CG . ARG A 55 ? 2.3018 3.5026 2.1122 0.7432 0.2423 0.5073 76 ARG A CG 396 C CD . ARG A 55 ? 2.4278 3.5241 2.2158 0.7433 0.2477 0.4904 76 ARG A CD 397 N NE . ARG A 55 ? 2.5461 3.5841 2.3117 0.7707 0.2685 0.5046 76 ARG A NE 398 C CZ . ARG A 55 ? 2.5917 3.5714 2.3479 0.7694 0.2746 0.5003 76 ARG A CZ 399 N NH1 . ARG A 55 ? 2.5577 3.5289 2.3252 0.7428 0.2608 0.4821 76 ARG A NH1 400 N NH2 . ARG A 55 ? 2.6533 3.5829 2.3892 0.7938 0.2949 0.5143 76 ARG A NH2 401 N N . TYR A 56 ? 1.7703 3.0888 1.6488 0.6447 0.1927 0.4728 77 TYR A N 402 C CA . TYR A 56 ? 1.6009 2.8700 1.4823 0.6238 0.1868 0.4565 77 TYR A CA 403 C C . TYR A 56 ? 1.5892 2.7983 1.4543 0.6448 0.2008 0.4635 77 TYR A C 404 O O . TYR A 56 ? 1.6292 2.8839 1.4939 0.6682 0.2109 0.4874 77 TYR A O 405 C CB . TYR A 56 ? 1.4822 2.8353 1.3918 0.5937 0.1725 0.4580 77 TYR A CB 406 C CG . TYR A 56 ? 1.3668 2.7667 1.2926 0.5636 0.1573 0.4462 77 TYR A CG 407 C CD1 . TYR A 56 ? 1.3452 2.6868 1.2625 0.5565 0.1540 0.4268 77 TYR A CD1 408 C CD2 . TYR A 56 ? 1.2763 2.7790 1.2248 0.5407 0.1463 0.4538 77 TYR A CD2 409 C CE1 . TYR A 56 ? 1.2658 2.6510 1.1980 0.5286 0.1408 0.4164 77 TYR A CE1 410 C CE2 . TYR A 56 ? 1.1984 2.7426 1.1604 0.5103 0.1330 0.4426 77 TYR A CE2 411 C CZ . TYR A 56 ? 1.1823 2.6679 1.1369 0.5047 0.1305 0.4244 77 TYR A CZ 412 O OH . TYR A 56 ? 1.0654 2.5875 1.0308 0.4708 0.1237 0.4110 77 TYR A OH 413 N N . SER A 57 ? 1.5544 2.6715 1.4039 0.6414 0.2032 0.4463 78 SER A N 414 C CA . SER A 57 ? 1.5695 2.6220 1.4012 0.6580 0.2164 0.4501 78 SER A CA 415 C C . SER A 57 ? 1.5243 2.5320 1.3582 0.6370 0.2095 0.4328 78 SER A C 416 O O . SER A 57 ? 1.6153 2.5434 1.4339 0.6289 0.2079 0.4117 78 SER A O 417 C CB . SER A 57 ? 1.6036 2.5688 1.4048 0.6791 0.2306 0.4468 78 SER A CB 418 O OG . SER A 57 ? 1.6430 2.5441 1.4259 0.6925 0.2440 0.4498 78 SER A OG 419 N N . VAL A 58 ? 1.3794 2.4391 1.2322 0.6276 0.2051 0.4416 79 VAL A N 420 C CA . VAL A 58 ? 1.2852 2.3085 1.1435 0.6055 0.1979 0.4264 79 VAL A CA 421 C C . VAL A 58 ? 1.4139 2.3425 1.2455 0.6221 0.2116 0.4219 79 VAL A C 422 O O . VAL A 58 ? 1.4512 2.3942 1.2847 0.6318 0.2182 0.4351 79 VAL A O 423 C CB . VAL A 58 ? 1.1642 2.2783 1.0528 0.5866 0.1881 0.4381 79 VAL A CB 424 C CG1 . VAL A 58 ? 1.0540 2.1339 0.9525 0.5569 0.1778 0.4201 79 VAL A CG1 425 C CG2 . VAL A 58 ? 1.1343 2.3510 1.0462 0.5713 0.1767 0.4464 79 VAL A CG2 426 N N . VAL A 59 ? 1.5303 2.3631 1.3357 0.6243 0.2157 0.4033 80 VAL A N 427 C CA . VAL A 59 ? 1.6632 2.3997 1.4395 0.6356 0.2285 0.3965 80 VAL A CA 428 C C . VAL A 59 ? 1.6311 2.3168 1.4075 0.6121 0.2203 0.3758 80 VAL A C 429 O O . VAL A 59 ? 1.5322 2.1748 1.3048 0.5927 0.2104 0.3534 80 VAL A O 430 C CB . VAL A 59 ? 1.7572 2.4145 1.5024 0.6471 0.2379 0.3876 80 VAL A CB 431 C CG1 . VAL A 59 ? 1.6956 2.3240 1.4391 0.6271 0.2250 0.3644 80 VAL A CG1 432 C CG2 . VAL A 59 ? 1.8345 2.3980 1.5499 0.6552 0.2517 0.3822 80 VAL A CG2 433 N N . ASP A 60 ? 1.6915 2.3835 1.4726 0.6144 0.2244 0.3839 81 ASP A N 434 C CA . ASP A 60 ? 1.6716 2.3194 1.4547 0.5921 0.2170 0.3660 81 ASP A CA 435 C C . ASP A 60 ? 1.5413 2.2207 1.3499 0.5602 0.1978 0.3513 81 ASP A C 436 O O . ASP A 60 ? 1.5562 2.1639 1.3525 0.5435 0.1916 0.3266 81 ASP A O 437 C CB . ASP A 60 ? 1.7666 2.2913 1.5113 0.5936 0.2253 0.3460 81 ASP A CB 438 C CG . ASP A 60 ? 1.9004 2.3937 1.6227 0.6196 0.2447 0.3608 81 ASP A CG 439 O OD1 . ASP A 60 ? 1.9312 2.4662 1.6536 0.6430 0.2547 0.3819 81 ASP A OD1 440 O OD2 . ASP A 60 ? 1.9565 2.3835 1.6612 0.6156 0.2501 0.3515 81 ASP A OD2 441 N N . GLY A 61 ? 1.4098 2.1986 1.2531 0.5502 0.1886 0.3673 82 GLY A N 442 C CA . GLY A 61 ? 1.2210 2.0551 1.0929 0.5160 0.1707 0.3575 82 GLY A CA 443 C C . GLY A 61 ? 1.1144 1.9560 0.9842 0.5139 0.1660 0.3504 82 GLY A C 444 O O . GLY A 61 ? 1.1279 2.0586 1.0242 0.4977 0.1558 0.3589 82 GLY A O 445 N N . SER A 62 ? 1.0516 1.8012 0.8885 0.5283 0.1731 0.3350 83 SER A N 446 C CA . SER A 62 ? 1.0249 1.7696 0.8566 0.5266 0.1686 0.3257 83 SER A CA 447 C C . SER A 62 ? 1.0599 1.8884 0.9021 0.5413 0.1712 0.3465 83 SER A C 448 O O . SER A 62 ? 1.1289 1.9546 0.9560 0.5688 0.1843 0.3615 83 SER A O 449 C CB . SER A 62 ? 1.0650 1.6951 0.8557 0.5399 0.1768 0.3079 83 SER A CB 450 O OG . SER A 62 ? 1.0682 1.6176 0.8465 0.5225 0.1721 0.2850 83 SER A OG 451 N N . LEU A 63 ? 1.0134 1.9156 0.8811 0.5208 0.1585 0.3470 84 LEU A N 452 C CA . LEU A 63 ? 1.0098 1.9930 0.8874 0.5301 0.1588 0.3639 84 LEU A CA 453 C C . LEU A 63 ? 1.0595 1.9962 0.9135 0.5489 0.1647 0.3571 84 LEU A C 454 O O . LEU A 63 ? 1.0401 1.9293 0.8863 0.5383 0.1591 0.3377 84 LEU A O 455 C CB . LEU A 63 ? 0.9112 1.9896 0.8228 0.4963 0.1427 0.3658 84 LEU A CB 456 C CG . LEU A 63 ? 0.8839 2.0378 0.8036 0.4993 0.1402 0.3763 84 LEU A CG 457 C CD1 . LEU A 63 ? 0.8715 2.0865 0.7928 0.5209 0.1482 0.4006 84 LEU A CD1 458 C CD2 . LEU A 63 ? 0.7512 1.9722 0.6916 0.4553 0.1265 0.3708 84 LEU A CD2 459 N N . LEU A 64 ? 1.1031 2.0545 0.9460 0.5761 0.1761 0.3738 85 LEU A N 460 C CA . LEU A 64 ? 1.1387 2.0595 0.9627 0.5921 0.1814 0.3708 85 LEU A CA 461 C C . LEU A 64 ? 1.1594 2.1747 1.0028 0.5900 0.1757 0.3830 85 LEU A C 462 O O . LEU A 64 ? 1.1200 2.2147 0.9808 0.5910 0.1753 0.4012 85 LEU A O 463 C CB . LEU A 64 ? 1.2156 2.0785 1.0120 0.6218 0.1990 0.3804 85 LEU A CB 464 C CG . LEU A 64 ? 1.2902 2.0577 1.0623 0.6268 0.2081 0.3715 85 LEU A CG 465 C CD1 . LEU A 64 ? 1.3208 2.0306 1.0647 0.6511 0.2248 0.3785 85 LEU A CD1 466 C CD2 . LEU A 64 ? 1.3090 2.0097 1.0724 0.6060 0.1988 0.3445 85 LEU A CD2 467 N N . ILE A 65 ? 1.1938 2.2000 1.0326 0.5867 0.1712 0.3723 86 ILE A N 468 C CA . ILE A 65 ? 1.2697 2.3512 1.1206 0.5880 0.1677 0.3821 86 ILE A CA 469 C C . ILE A 65 ? 1.3777 2.4059 1.2036 0.6114 0.1775 0.3812 86 ILE A C 470 O O . ILE A 65 ? 1.2934 2.2675 1.1091 0.6055 0.1788 0.3609 86 ILE A O 471 C CB . ILE A 65 ? 1.2170 2.3453 1.0894 0.5528 0.1588 0.3657 86 ILE A CB 472 C CG1 . ILE A 65 ? 0.8658 2.0095 0.7539 0.5220 0.1507 0.3593 86 ILE A CG1 473 C CG2 . ILE A 65 ? 1.1672 2.3891 1.0562 0.5470 0.1579 0.3759 86 ILE A CG2 474 C CD1 . ILE A 65 ? 0.9701 2.1298 0.8576 0.4737 0.1516 0.3390 86 ILE A CD1 475 N N . ASN A 66 ? 1.5748 2.6186 1.3943 0.6343 0.1888 0.3999 87 ASN A N 476 C CA . ASN A 66 ? 1.7364 2.7173 1.5305 0.6563 0.2010 0.4012 87 ASN A CA 477 C C . ASN A 66 ? 1.7112 2.7144 1.5055 0.6575 0.1974 0.3988 87 ASN A C 478 O O . ASN A 66 ? 1.7731 2.7223 1.5489 0.6713 0.2074 0.3965 87 ASN A O 479 C CB . ASN A 66 ? 1.9090 2.8881 1.6954 0.6797 0.2163 0.4224 87 ASN A CB 480 C CG . ASN A 66 ? 2.0774 2.9553 1.8358 0.6921 0.2300 0.4182 87 ASN A CG 481 O OD1 . ASN A 66 ? 2.1060 2.9142 1.8497 0.6825 0.2273 0.3987 87 ASN A OD1 482 N ND2 . ASN A 66 ? 2.1807 3.0508 1.9314 0.7122 0.2449 0.4367 87 ASN A ND2 483 N N . ASN A 67 ? 1.6458 2.7284 1.4680 0.6377 0.1896 0.3931 88 ASN A N 484 C CA . ASN A 67 ? 1.6333 2.7377 1.4655 0.6283 0.1953 0.3785 88 ASN A CA 485 C C . ASN A 67 ? 1.6030 2.7751 1.4596 0.5937 0.1896 0.3647 88 ASN A C 486 O O . ASN A 67 ? 1.6259 2.8824 1.5008 0.5867 0.1834 0.3779 88 ASN A O 487 C CB . ASN A 67 ? 1.6292 2.7690 1.4597 0.6496 0.2002 0.3985 88 ASN A CB 488 C CG . ASN A 67 ? 1.6256 2.6861 1.4304 0.6729 0.2125 0.4012 88 ASN A CG 489 O OD1 . ASN A 67 ? 1.6366 2.6217 1.4282 0.6694 0.2180 0.3819 88 ASN A OD1 490 N ND2 . ASN A 67 ? 1.6250 2.7024 1.4217 0.6946 0.2177 0.4251 88 ASN A ND2 491 N N . PRO A 68 ? 1.5555 2.6868 1.4066 0.5693 0.1929 0.3386 89 PRO A N 492 C CA . PRO A 68 ? 1.5032 2.6741 1.3632 0.5287 0.1900 0.3247 89 PRO A CA 493 C C . PRO A 68 ? 1.4906 2.7140 1.3549 0.5092 0.1956 0.3179 89 PRO A C 494 O O . PRO A 68 ? 1.5076 2.7141 1.3649 0.5232 0.2044 0.3133 89 PRO A O 495 C CB . PRO A 68 ? 1.5005 2.5853 1.3377 0.5141 0.1939 0.3002 89 PRO A CB 496 C CG . PRO A 68 ? 1.5360 2.5431 1.3596 0.5487 0.1965 0.3025 89 PRO A CG 497 C CD . PRO A 68 ? 1.5770 2.6092 1.4043 0.5782 0.2001 0.3215 89 PRO A CD 498 N N . ASN A 69 ? 1.4872 2.7712 1.3609 0.4746 0.1907 0.3173 90 ASN A N 499 C CA . ASN A 69 ? 1.5703 2.8940 1.4412 0.4474 0.1963 0.3080 90 ASN A CA 500 C C . ASN A 69 ? 1.4290 2.7517 1.2867 0.4005 0.1933 0.2965 90 ASN A C 501 O O . ASN A 69 ? 1.3499 2.7047 1.2189 0.3838 0.1831 0.3048 90 ASN A O 502 C CB . ASN A 69 ? 1.8005 3.2160 1.6957 0.4539 0.1928 0.3247 90 ASN A CB 503 C CG . ASN A 69 ? 2.0176 3.4850 1.9126 0.4161 0.1958 0.3159 90 ASN A CG 504 O OD1 . ASN A 69 ? 1.9565 3.4406 1.8483 0.3798 0.1912 0.3115 90 ASN A OD1 505 N ND2 . ASN A 69 ? 2.3156 3.8061 2.2126 0.4235 0.2036 0.3137 90 ASN A ND2 506 N N . LYS A 70 ? 1.4055 2.6894 1.2365 0.3785 0.2013 0.2785 91 LYS A N 507 C CA . LYS A 70 ? 1.3665 2.6316 1.1747 0.3336 0.1978 0.2682 91 LYS A CA 508 C C . LYS A 70 ? 1.3378 2.6826 1.1627 0.3011 0.1905 0.2777 91 LYS A C 509 O O . LYS A 70 ? 1.2248 2.5699 1.0491 0.2757 0.1807 0.2801 91 LYS A O 510 C CB . LYS A 70 ? 1.3762 2.5956 1.1508 0.3178 0.2078 0.2503 91 LYS A CB 511 C CG . LYS A 70 ? 1.3549 2.5545 1.1019 0.2705 0.2036 0.2421 91 LYS A CG 512 C CD . LYS A 70 ? 1.3756 2.5333 1.0871 0.2579 0.2136 0.2265 91 LYS A CD 513 C CE . LYS A 70 ? 1.3860 2.6027 1.1092 0.2603 0.2240 0.2287 91 LYS A CE 514 N NZ . LYS A 70 ? 1.4018 2.5768 1.0897 0.2512 0.2349 0.2140 91 LYS A NZ 515 N N . THR A 71 ? 1.4143 2.8255 1.2543 0.3011 0.1952 0.2820 92 THR A N 516 C CA . THR A 71 ? 1.4041 2.8884 1.2562 0.2662 0.1907 0.2861 92 THR A CA 517 C C . THR A 71 ? 1.3549 2.8935 1.2337 0.2622 0.1771 0.3008 92 THR A C 518 O O . THR A 71 ? 1.3488 2.9318 1.2330 0.2256 0.1715 0.3015 92 THR A O 519 C CB . THR A 71 ? 1.4333 2.9795 1.2988 0.2720 0.1981 0.2873 92 THR A CB 520 O OG1 . THR A 71 ? 1.4444 3.0158 1.2995 0.2293 0.2014 0.2790 92 THR A OG1 521 C CG2 . THR A 71 ? 1.4184 3.0443 1.3199 0.2953 0.1901 0.3048 92 THR A CG2 522 N N . GLN A 72 ? 1.3022 2.8367 1.1967 0.2991 0.1721 0.3126 93 GLN A N 523 C CA . GLN A 72 ? 1.2658 2.8542 1.1845 0.2987 0.1593 0.3279 93 GLN A CA 524 C C . GLN A 72 ? 1.2122 2.7408 1.1240 0.3026 0.1529 0.3291 93 GLN A C 525 O O . GLN A 72 ? 1.1379 2.7038 1.0679 0.3018 0.1424 0.3414 93 GLN A O 526 C CB . GLN A 72 ? 1.3236 2.9775 1.2687 0.3372 0.1561 0.3458 93 GLN A CB 527 C CG . GLN A 72 ? 1.3809 2.9842 1.3226 0.3867 0.1607 0.3515 93 GLN A CG 528 C CD . GLN A 72 ? 1.4194 3.0830 1.3795 0.4225 0.1553 0.3727 93 GLN A CD 529 O OE1 . GLN A 72 ? 1.4094 3.1470 1.3858 0.4161 0.1449 0.3860 93 GLN A OE1 530 N NE2 . GLN A 72 ? 1.4538 3.0831 1.4067 0.4592 0.1620 0.3766 93 GLN A NE2 531 N N . ASP A 73 ? 1.2207 2.6570 1.1053 0.3062 0.1591 0.3153 94 ASP A N 532 C CA . ASP A 73 ? 1.1877 2.5567 1.0619 0.3089 0.1536 0.3128 94 ASP A CA 533 C C . ASP A 73 ? 1.2300 2.5280 1.0694 0.2706 0.1530 0.2950 94 ASP A C 534 O O . ASP A 73 ? 1.2629 2.4818 1.0833 0.2747 0.1510 0.2865 94 ASP A O 535 C CB . ASP A 73 ? 1.1499 2.4632 1.0227 0.3582 0.1598 0.3134 94 ASP A CB 536 C CG . ASP A 73 ? 1.1144 2.4876 1.0154 0.3990 0.1591 0.3334 94 ASP A CG 537 O OD1 . ASP A 73 ? 1.1091 2.5688 1.0318 0.3902 0.1522 0.3469 94 ASP A OD1 538 O OD2 . ASP A 73 ? 1.0802 2.4109 0.9781 0.4391 0.1642 0.3362 94 ASP A OD2 539 N N . ALA A 74 ? 1.2581 2.5825 1.0879 0.2334 0.1543 0.2893 95 ALA A N 540 C CA . ALA A 74 ? 1.3112 2.5673 1.1040 0.1997 0.1545 0.2734 95 ALA A CA 541 C C . ALA A 74 ? 1.2926 2.5390 1.0802 0.1563 0.1416 0.2734 95 ALA A C 542 O O . ALA A 74 ? 1.3438 2.5827 1.1140 0.1170 0.1409 0.2664 95 ALA A O 543 C CB . ALA A 74 ? 1.3344 2.6118 1.1149 0.1840 0.1645 0.2664 95 ALA A CB 544 N N . GLY A 75 ? 1.1775 2.4214 0.9799 0.1633 0.1319 0.2812 96 GLY A N 545 C CA . GLY A 75 ? 1.1300 2.3675 0.9314 0.1221 0.1188 0.2818 96 GLY A CA 546 C C . GLY A 75 ? 1.1134 2.2776 0.9054 0.1291 0.1098 0.2789 96 GLY A C 547 O O . GLY A 75 ? 1.1336 2.2364 0.9130 0.1636 0.1145 0.2726 96 GLY A O 548 N N . THR A 76 ? 1.0341 2.2040 0.8330 0.0954 0.0971 0.2822 97 THR A N 549 C CA . THR A 76 ? 0.9971 2.0953 0.7869 0.0959 0.0871 0.2781 97 THR A CA 550 C C . THR A 76 ? 0.9076 2.0520 0.7288 0.1175 0.0823 0.2935 97 THR A C 551 O O . THR A 76 ? 0.8971 2.1288 0.7454 0.1032 0.0784 0.3063 97 THR A O 552 C CB . THR A 76 ? 0.9551 2.0129 0.7293 0.0426 0.0752 0.2698 97 THR A CB 553 O OG1 . THR A 76 ? 1.0487 2.1646 0.8499 0.0171 0.0653 0.2809 97 THR A OG1 554 C CG2 . THR A 76 ? 0.7856 1.8499 0.5431 0.0120 0.0807 0.2626 97 THR A CG2 555 N N . TYR A 77 ? 0.8429 1.9285 0.6598 0.1525 0.0832 0.2915 98 TYR A N 556 C CA . TYR A 77 ? 0.8524 1.9718 0.6965 0.1796 0.0809 0.3062 98 TYR A CA 557 C C . TYR A 77 ? 0.8385 1.9119 0.6797 0.1559 0.0673 0.3038 98 TYR A C 558 O O . TYR A 77 ? 0.8581 1.8452 0.6726 0.1338 0.0613 0.2878 98 TYR A O 559 C CB . TYR A 77 ? 0.8778 1.9636 0.7227 0.2373 0.0933 0.3063 98 TYR A CB 560 C CG . TYR A 77 ? 0.8726 2.0226 0.7328 0.2685 0.1058 0.3147 98 TYR A CG 561 C CD1 . TYR A 77 ? 0.7946 1.9257 0.6355 0.2661 0.1142 0.3030 98 TYR A CD1 562 C CD2 . TYR A 77 ? 0.8825 2.1108 0.7762 0.3008 0.1083 0.3345 98 TYR A CD2 563 C CE1 . TYR A 77 ? 0.8076 1.9941 0.6629 0.2931 0.1246 0.3099 98 TYR A CE1 564 C CE2 . TYR A 77 ? 0.8800 2.1638 0.7877 0.3290 0.1171 0.3424 98 TYR A CE2 565 C CZ . TYR A 77 ? 0.8362 2.0973 0.7246 0.3242 0.1252 0.3294 98 TYR A CZ 566 O OH . TYR A 77 ? 0.8255 2.1377 0.7270 0.3504 0.1329 0.3367 98 TYR A OH 567 N N . GLN A 78 ? 0.8464 1.9781 0.7158 0.1608 0.0622 0.3195 99 GLN A N 568 C CA . GLN A 78 ? 0.8344 1.9252 0.7043 0.1427 0.0503 0.3184 99 GLN A CA 569 C C . GLN A 78 ? 0.8054 1.9256 0.6999 0.1829 0.0538 0.3335 99 GLN A C 570 O O . GLN A 78 ? 0.7974 2.0105 0.7189 0.2043 0.0592 0.3508 99 GLN A O 571 C CB . GLN A 78 ? 0.8287 1.9635 0.7064 0.0850 0.0372 0.3204 99 GLN A CB 572 C CG . GLN A 78 ? 0.8392 1.8966 0.7041 0.0521 0.0240 0.3099 99 GLN A CG 573 C CD . GLN A 78 ? 0.8343 1.9378 0.7098 -0.0060 0.0126 0.3120 99 GLN A CD 574 O OE1 . GLN A 78 ? 0.8558 2.0624 0.7569 -0.0156 0.0129 0.3254 99 GLN A OE1 575 N NE2 . GLN A 78 ? 0.7736 1.8021 0.6311 -0.0453 0.0029 0.2978 99 GLN A NE2 576 N N . CYS A 79 ? 0.7709 1.8099 0.6556 0.1939 0.0516 0.3264 100 CYS A N 577 C CA . CYS A 79 ? 0.7134 1.7635 0.6176 0.2329 0.0577 0.3386 100 CYS A CA 578 C C . CYS A 79 ? 0.7269 1.7919 0.6423 0.2000 0.0438 0.3444 100 CYS A C 579 O O . CYS A 79 ? 0.7286 1.7247 0.6261 0.1632 0.0318 0.3304 100 CYS A O 580 C CB . CYS A 79 ? 0.7463 1.6902 0.6311 0.2701 0.0681 0.3243 100 CYS A CB 581 S SG . CYS A 79 ? 1.0085 1.9357 0.9100 0.3157 0.0797 0.3335 100 CYS A SG 582 N N . ILE A 80 ? 0.7693 1.9258 0.7145 0.2119 0.0457 0.3648 101 ILE A N 583 C CA . ILE A 80 ? 0.8611 2.0407 0.8182 0.1809 0.0332 0.3716 101 ILE A CA 584 C C . ILE A 80 ? 0.7751 1.9581 0.7466 0.2208 0.0424 0.3839 101 ILE A C 585 O O . ILE A 80 ? 0.7567 2.0031 0.7465 0.2628 0.0577 0.3993 101 ILE A O 586 C CB . ILE A 80 ? 0.9733 2.2674 0.9515 0.1425 0.0248 0.3832 101 ILE A CB 587 C CG1 . ILE A 80 ? 1.0885 2.4928 1.0943 0.1793 0.0367 0.4029 101 ILE A CG1 588 C CG2 . ILE A 80 ? 0.9447 2.2287 0.9065 0.1015 0.0189 0.3696 101 ILE A CG2 589 C CD1 . ILE A 80 ? 1.1367 2.6372 1.1549 0.1497 0.0325 0.4065 101 ILE A CD1 590 N N . ALA A 81 ? 0.7409 1.8524 0.7024 0.2074 0.0348 0.3764 102 ALA A N 591 C CA . ALA A 81 ? 0.7229 1.8184 0.6916 0.2440 0.0452 0.3848 102 ALA A CA 592 C C . ALA A 81 ? 0.8083 1.9492 0.7914 0.2137 0.0327 0.3962 102 ALA A C 593 O O . ALA A 81 ? 0.7889 1.8973 0.7640 0.1641 0.0149 0.3863 102 ALA A O 594 C CB . ALA A 81 ? 0.6953 1.6591 0.6385 0.2634 0.0510 0.3644 102 ALA A CB 595 N N . THR A 82 ? 0.8241 2.0397 0.8272 0.2439 0.0437 0.4172 103 THR A N 596 C CA . THR A 82 ? 0.7557 2.0350 0.7745 0.2182 0.0336 0.4312 103 THR A CA 597 C C . THR A 82 ? 0.8144 2.0799 0.8353 0.2576 0.0462 0.4424 103 THR A C 598 O O . THR A 82 ? 0.7942 2.0698 0.8165 0.3102 0.0687 0.4511 103 THR A O 599 C CB . THR A 82 ? 0.7176 2.1380 0.7608 0.2067 0.0335 0.4495 103 THR A CB 600 O OG1 . THR A 82 ? 0.6711 2.1089 0.7123 0.1615 0.0209 0.4386 103 THR A OG1 601 C CG2 . THR A 82 ? 0.6874 2.1794 0.7460 0.1869 0.0265 0.4653 103 THR A CG2 602 N N . ASN A 83 ? 0.8508 2.0906 0.8698 0.2308 0.0333 0.4417 104 ASN A N 603 C CA . ASN A 83 ? 0.8868 2.1405 0.9109 0.2603 0.0427 0.4567 104 ASN A CA 604 C C . ASN A 83 ? 0.9101 2.2315 0.9477 0.2169 0.0250 0.4681 104 ASN A C 605 O O . ASN A 83 ? 0.8464 2.2326 0.8940 0.1719 0.0114 0.4686 104 ASN A O 606 C CB . ASN A 83 ? 0.8656 1.9916 0.8681 0.2861 0.0513 0.4413 104 ASN A CB 607 C CG . ASN A 83 ? 0.7874 1.8292 0.7767 0.2390 0.0300 0.4231 104 ASN A CG 608 O OD1 . ASN A 83 ? 0.8161 1.8900 0.8111 0.1849 0.0096 0.4213 104 ASN A OD1 609 N ND2 . ASN A 83 ? 0.6662 1.5984 0.6367 0.2580 0.0369 0.4081 104 ASN A ND2 610 N N . SER A 84 ? 1.0131 2.3195 1.0497 0.2294 0.0265 0.4763 105 SER A N 611 C CA . SER A 84 ? 1.0090 2.3872 1.0585 0.1936 0.0122 0.4894 105 SER A CA 612 C C . SER A 84 ? 1.0028 2.3435 1.0473 0.1251 -0.0114 0.4728 105 SER A C 613 O O . SER A 84 ? 0.9955 2.4193 1.0534 0.0816 -0.0229 0.4803 105 SER A O 614 C CB . SER A 84 ? 0.9603 2.3165 1.0063 0.2245 0.0196 0.5003 105 SER A CB 615 O OG . SER A 84 ? 0.9650 2.3103 1.0065 0.2895 0.0457 0.5083 105 SER A OG 616 N N . PHE A 85 ? 0.9693 2.1850 0.9932 0.1149 -0.0165 0.4493 106 PHE A N 617 C CA . PHE A 85 ? 0.8702 2.0339 0.8859 0.0516 -0.0366 0.4322 106 PHE A CA 618 C C . PHE A 85 ? 0.7761 1.9536 0.7913 0.0117 -0.0439 0.4205 106 PHE A C 619 O O . PHE A 85 ? 0.7434 1.8763 0.7511 -0.0422 -0.0579 0.4054 106 PHE A O 620 C CB . PHE A 85 ? 0.9150 1.9344 0.9068 0.0568 -0.0386 0.4111 106 PHE A CB 621 C CG . PHE A 85 ? 1.0010 1.9961 0.9908 0.0933 -0.0305 0.4199 106 PHE A CG 622 C CD1 . PHE A 85 ? 1.0632 2.0446 1.0495 0.1589 -0.0082 0.4260 106 PHE A CD1 623 C CD2 . PHE A 85 ? 1.0210 2.0065 1.0112 0.0611 -0.0433 0.4216 106 PHE A CD2 624 C CE1 . PHE A 85 ? 1.1483 2.1063 1.1311 0.1928 0.0021 0.4336 106 PHE A CE1 625 C CE2 . PHE A 85 ? 1.0850 2.0468 1.0714 0.0952 -0.0354 0.4296 106 PHE A CE2 626 C CZ . PHE A 85 ? 1.1488 2.0966 1.1312 0.1616 -0.0122 0.4357 106 PHE A CZ 627 N N . GLY A 86 ? 0.6663 1.9033 0.6888 0.0375 -0.0331 0.4271 107 GLY A N 628 C CA . GLY A 86 ? 0.7186 1.9821 0.7417 0.0007 -0.0387 0.4182 107 GLY A CA 629 C C . GLY A 86 ? 0.7809 2.0164 0.7943 0.0340 -0.0280 0.4107 107 GLY A C 630 O O . GLY A 86 ? 0.8056 2.0340 0.8183 0.0910 -0.0126 0.4172 107 GLY A O 631 N N . THR A 87 ? 0.7366 1.9551 0.7414 -0.0030 -0.0349 0.3965 108 THR A N 632 C CA . THR A 87 ? 0.7510 1.9609 0.7475 0.0212 -0.0258 0.3906 108 THR A CA 633 C C . THR A 87 ? 0.7677 1.8760 0.7382 -0.0073 -0.0326 0.3665 108 THR A C 634 O O . THR A 87 ? 0.8156 1.9068 0.7823 -0.0626 -0.0453 0.3569 108 THR A O 635 C CB . THR A 87 ? 0.7123 2.0490 0.7291 0.0111 -0.0227 0.4031 108 THR A CB 636 O OG1 . THR A 87 ? 0.8194 2.2556 0.8598 0.0362 -0.0157 0.4253 108 THR A OG1 637 C CG2 . THR A 87 ? 0.6459 1.9762 0.6545 0.0412 -0.0122 0.3985 108 THR A CG2 638 N N . ILE A 88 ? 0.6885 1.7307 0.6413 0.0308 -0.0229 0.3568 109 ILE A N 639 C CA . ILE A 88 ? 0.6540 1.6104 0.5809 0.0097 -0.0267 0.3350 109 ILE A CA 640 C C . ILE A 88 ? 0.6822 1.6677 0.6048 0.0349 -0.0155 0.3355 109 ILE A C 641 O O . ILE A 88 ? 0.6877 1.7020 0.6177 0.0865 -0.0017 0.3454 109 ILE A O 642 C CB . ILE A 88 ? 0.6703 1.4937 0.5727 0.0273 -0.0261 0.3161 109 ILE A CB 643 C CG1 . ILE A 88 ? 0.6983 1.5052 0.6009 0.0944 -0.0086 0.3209 109 ILE A CG1 644 C CG2 . ILE A 88 ? 0.5967 1.3764 0.4996 -0.0053 -0.0388 0.3114 109 ILE A CG2 645 C CD1 . ILE A 88 ? 0.6807 1.3578 0.5581 0.1140 -0.0047 0.2991 109 ILE A CD1 646 N N . VAL A 89 ? 0.7223 1.7005 0.6327 -0.0020 -0.0205 0.3248 110 VAL A N 647 C CA . VAL A 89 ? 0.6518 1.6418 0.5524 0.0173 -0.0104 0.3219 110 VAL A CA 648 C C . VAL A 89 ? 0.6901 1.5604 0.5576 0.0238 -0.0088 0.2997 110 VAL A C 649 O O . VAL A 89 ? 0.7817 1.5740 0.6335 -0.0090 -0.0192 0.2846 110 VAL A O 650 C CB . VAL A 89 ? 0.6090 1.6764 0.5173 -0.0253 -0.0136 0.3247 110 VAL A CB 651 C CG1 . VAL A 89 ? 0.6657 1.8466 0.6060 -0.0421 -0.0177 0.3428 110 VAL A CG1 652 C CG2 . VAL A 89 ? 0.5042 1.5041 0.3930 -0.0784 -0.0236 0.3071 110 VAL A CG2 653 N N . SER A 90 ? 0.6459 1.5034 0.5035 0.0662 0.0044 0.2973 111 SER A N 654 C CA . SER A 90 ? 0.6403 1.3920 0.4664 0.0767 0.0077 0.2760 111 SER A CA 655 C C . SER A 90 ? 0.7787 1.5255 0.5869 0.0431 0.0053 0.2663 111 SER A C 656 O O . SER A 90 ? 0.7874 1.6174 0.6087 0.0190 0.0047 0.2765 111 SER A O 657 C CB . SER A 90 ? 0.6603 1.4004 0.4842 0.1382 0.0251 0.2772 111 SER A CB 658 O OG . SER A 90 ? 0.6426 1.4509 0.4713 0.1496 0.0342 0.2849 111 SER A OG 659 N N . ARG A 91 ? 0.8284 1.4779 0.6065 0.0424 0.0049 0.2457 112 ARG A N 660 C CA . ARG A 91 ? 0.8162 1.4510 0.5735 0.0167 0.0047 0.2354 112 ARG A CA 661 C C . ARG A 91 ? 0.8290 1.5362 0.5917 0.0418 0.0185 0.2453 112 ARG A C 662 O O . ARG A 91 ? 0.8253 1.5612 0.5996 0.0881 0.0296 0.2539 112 ARG A O 663 C CB . ARG A 91 ? 0.8509 1.3701 0.5745 0.0232 0.0038 0.2117 112 ARG A CB 664 C CG . ARG A 91 ? 0.8914 1.3734 0.6046 0.0803 0.0180 0.2053 112 ARG A CG 665 C CD . ARG A 91 ? 1.0293 1.4032 0.7079 0.0815 0.0166 0.1796 112 ARG A CD 666 N NE . ARG A 91 ? 1.1293 1.4625 0.7977 0.1340 0.0314 0.1706 112 ARG A NE 667 C CZ . ARG A 91 ? 1.1684 1.4145 0.8242 0.1525 0.0323 0.1537 112 ARG A CZ 668 N NH1 . ARG A 91 ? 1.1889 1.3785 0.8406 0.1226 0.0177 0.1442 112 ARG A NH1 669 N NH2 . ARG A 91 ? 1.1672 1.3822 0.8154 0.2000 0.0487 0.1453 112 ARG A NH2 670 N N . GLU A 92 ? 0.8463 1.5817 0.6013 0.0109 0.0187 0.2438 113 GLU A N 671 C CA . GLU A 92 ? 0.8963 1.6988 0.6556 0.0298 0.0317 0.2514 113 GLU A CA 672 C C . GLU A 92 ? 0.8834 1.6239 0.6157 0.0639 0.0423 0.2379 113 GLU A C 673 O O . GLU A 92 ? 0.9220 1.5759 0.6256 0.0526 0.0380 0.2201 113 GLU A O 674 C CB . GLU A 92 ? 0.9939 1.8500 0.7555 -0.0163 0.0300 0.2541 113 GLU A CB 675 C CG . GLU A 92 ? 1.1114 2.0587 0.9056 -0.0434 0.0242 0.2693 113 GLU A CG 676 C CD . GLU A 92 ? 1.1851 2.1722 0.9811 -0.0943 0.0228 0.2681 113 GLU A CD 677 O OE1 . GLU A 92 ? 1.1483 2.2279 0.9719 -0.1127 0.0222 0.2796 113 GLU A OE1 678 O OE2 . GLU A 92 ? 1.2257 2.1520 0.9958 -0.1154 0.0229 0.2551 113 GLU A OE2 679 N N . ALA A 93 ? 0.8281 1.6147 0.5710 0.1055 0.0562 0.2459 114 ALA A N 680 C CA . ALA A 93 ? 0.7916 1.5311 0.5130 0.1395 0.0686 0.2339 114 ALA A CA 681 C C . ALA A 93 ? 0.8507 1.6550 0.5744 0.1431 0.0799 0.2392 114 ALA A C 682 O O . ALA A 93 ? 0.8192 1.7072 0.5703 0.1613 0.0866 0.2549 114 ALA A O 683 C CB . ALA A 93 ? 0.7315 1.4487 0.4625 0.1916 0.0776 0.2353 114 ALA A CB 684 N N . LYS A 94 ? 0.9171 1.6820 0.6119 0.1257 0.0816 0.2257 115 LYS A N 685 C CA . LYS A 94 ? 0.9155 1.7318 0.6083 0.1268 0.0928 0.2282 115 LYS A CA 686 C C . LYS A 94 ? 0.9109 1.7211 0.6028 0.1767 0.1084 0.2248 115 LYS A C 687 O O . LYS A 94 ? 0.8983 1.6317 0.5700 0.1985 0.1115 0.2102 115 LYS A O 688 C CB . LYS A 94 ? 0.8956 1.6716 0.5570 0.0891 0.0894 0.2159 115 LYS A CB 689 C CG . LYS A 94 ? 1.0353 1.8456 0.6872 0.0921 0.1023 0.2150 115 LYS A CG 690 C CD . LYS A 94 ? 1.0976 2.0124 0.7787 0.0781 0.1065 0.2308 115 LYS A CD 691 C CE . LYS A 94 ? 1.1333 2.0738 0.8023 0.0774 0.1193 0.2278 115 LYS A CE 692 N NZ . LYS A 94 ? 1.1343 2.1775 0.8343 0.0730 0.1255 0.2411 115 LYS A NZ 693 N N . LEU A 95 ? 0.9335 1.8255 0.6490 0.1939 0.1183 0.2376 116 LEU A N 694 C CA . LEU A 95 ? 0.9735 1.8681 0.6932 0.2392 0.1335 0.2359 116 LEU A CA 695 C C . LEU A 95 ? 0.9872 1.9062 0.6946 0.2311 0.1429 0.2312 116 LEU A C 696 O O . LEU A 95 ? 0.9979 1.9957 0.7232 0.2183 0.1447 0.2424 116 LEU A O 697 C CB . LEU A 95 ? 0.9427 1.9078 0.7021 0.2730 0.1375 0.2548 116 LEU A CB 698 C CG . LEU A 95 ? 0.9988 1.9831 0.7697 0.3172 0.1522 0.2570 116 LEU A CG 699 C CD1 . LEU A 95 ? 1.0186 1.9160 0.7738 0.3504 0.1594 0.2428 116 LEU A CD1 700 C CD2 . LEU A 95 ? 0.9916 2.0602 0.8022 0.3434 0.1526 0.2792 116 LEU A CD2 701 N N . GLN A 96 ? 0.9872 1.8385 0.6636 0.2382 0.1489 0.2139 117 GLN A N 702 C CA . GLN A 96 ? 1.0216 1.8874 0.6824 0.2322 0.1586 0.2081 117 GLN A CA 703 C C . GLN A 96 ? 0.9908 1.8425 0.6539 0.2759 0.1730 0.2018 117 GLN A C 704 O O . GLN A 96 ? 1.0137 1.8186 0.6797 0.3062 0.1750 0.1960 117 GLN A O 705 C CB . GLN A 96 ? 1.0991 1.9012 0.7185 0.1987 0.1528 0.1930 117 GLN A CB 706 C CG . GLN A 96 ? 1.1360 1.9229 0.7512 0.1586 0.1366 0.1958 117 GLN A CG 707 C CD . GLN A 96 ? 1.1124 1.8454 0.6896 0.1241 0.1310 0.1837 117 GLN A CD 708 O OE1 . GLN A 96 ? 1.0676 1.7959 0.6234 0.1240 0.1398 0.1771 117 GLN A OE1 709 N NE2 . GLN A 96 ? 0.9959 1.6873 0.5647 0.0946 0.1160 0.1811 117 GLN A NE2 710 N N . PHE A 97 ? 0.9484 1.8391 0.6117 0.2784 0.1833 0.2022 118 PHE A N 711 C CA . PHE A 97 ? 1.0170 1.8987 0.6850 0.3168 0.1967 0.1967 118 PHE A CA 712 C C . PHE A 97 ? 1.1438 1.9836 0.7757 0.3074 0.2040 0.1794 118 PHE A C 713 O O . PHE A 97 ? 1.1729 2.0289 0.7864 0.2750 0.2029 0.1787 118 PHE A O 714 C CB . PHE A 97 ? 1.0106 1.9779 0.7155 0.3356 0.2026 0.2137 118 PHE A CB 715 C CG . PHE A 97 ? 1.0451 2.0530 0.7848 0.3524 0.1956 0.2315 118 PHE A CG 716 C CD1 . PHE A 97 ? 1.0026 2.0705 0.7581 0.3257 0.1860 0.2446 118 PHE A CD1 717 C CD2 . PHE A 97 ? 1.0560 2.0404 0.8116 0.3942 0.1982 0.2355 118 PHE A CD2 718 C CE1 . PHE A 97 ? 0.9709 2.0786 0.7571 0.3415 0.1791 0.2611 118 PHE A CE1 719 C CE2 . PHE A 97 ? 1.0269 2.0467 0.8111 0.4109 0.1913 0.2536 118 PHE A CE2 720 C CZ . PHE A 97 ? 0.9851 2.0688 0.7848 0.3850 0.1818 0.2663 118 PHE A CZ 721 N N . ALA A 98 ? 0.9892 1.1620 0.7059 0.3610 0.0293 0.1946 119 ALA A N 722 C CA . ALA A 98 ? 1.0181 1.1596 0.7610 0.3323 0.0368 0.1837 119 ALA A CA 723 C C . ALA A 98 ? 0.9662 1.1172 0.7257 0.3365 0.0457 0.1837 119 ALA A C 724 O O . ALA A 98 ? 0.9781 1.1339 0.7229 0.3635 0.0573 0.1962 119 ALA A O 725 C CB . ALA A 98 ? 1.0404 1.1212 0.7725 0.3251 0.0563 0.1872 119 ALA A CB 726 N N . TYR A 99 ? 0.8832 1.0354 0.6710 0.3102 0.0412 0.1703 120 TYR A N 727 C CA . TYR A 99 ? 0.8491 1.0095 0.6521 0.3106 0.0492 0.1691 120 TYR A CA 728 C C . TYR A 99 ? 0.8072 0.9514 0.6362 0.2777 0.0468 0.1545 120 TYR A C 729 O O . TYR A 99 ? 0.6829 0.8235 0.5206 0.2571 0.0348 0.1448 120 TYR A O 730 C CB . TYR A 99 ? 0.8363 1.0584 0.6462 0.3246 0.0364 0.1694 120 TYR A CB 731 C CG . TYR A 99 ? 0.8183 1.0795 0.6485 0.3038 0.0134 0.1543 120 TYR A CG 732 C CD1 . TYR A 99 ? 0.8211 1.0965 0.6796 0.2806 0.0089 0.1415 120 TYR A CD1 733 C CD2 . TYR A 99 ? 0.8843 1.1653 0.7033 0.3062 -0.0024 0.1520 120 TYR A CD2 734 C CE1 . TYR A 99 ? 0.8321 1.1396 0.7089 0.2601 -0.0093 0.1262 120 TYR A CE1 735 C CE2 . TYR A 99 ? 0.9453 1.2605 0.7820 0.2853 -0.0218 0.1357 120 TYR A CE2 736 C CZ . TYR A 99 ? 0.9280 1.2557 0.7945 0.2619 -0.0244 0.1225 120 TYR A CZ 737 O OH . TYR A 99 ? 0.9374 1.2958 0.8214 0.2397 -0.0409 0.1051 120 TYR A OH 738 N N . LEU A 100 ? 0.8486 0.9822 0.6869 0.2740 0.0587 0.1533 121 LEU A N 739 C CA . LEU A 100 ? 0.7963 0.9182 0.6573 0.2458 0.0569 0.1406 121 LEU A CA 740 C C . LEU A 100 ? 0.8047 0.9452 0.6753 0.2487 0.0626 0.1411 121 LEU A C 741 O O . LEU A 100 ? 0.7115 0.8347 0.5704 0.2621 0.0798 0.1487 121 LEU A O 742 C CB . LEU A 100 ? 0.6974 0.7670 0.5546 0.2324 0.0698 0.1370 121 LEU A CB 743 C CG . LEU A 100 ? 0.6627 0.7165 0.5389 0.2071 0.0709 0.1250 121 LEU A CG 744 C CD1 . LEU A 100 ? 0.5724 0.6377 0.4664 0.1848 0.0535 0.1140 121 LEU A CD1 745 C CD2 . LEU A 100 ? 0.7354 0.7444 0.6038 0.2002 0.0861 0.1222 121 LEU A CD2 746 N N . GLU A 101 ? 0.8316 1.0072 0.7220 0.2359 0.0494 0.1329 122 GLU A N 747 C CA . GLU A 101 ? 0.8565 1.0536 0.7559 0.2370 0.0539 0.1333 122 GLU A CA 748 C C . GLU A 101 ? 0.8726 1.0360 0.7801 0.2179 0.0636 0.1278 122 GLU A C 749 O O . GLU A 101 ? 0.7836 0.9183 0.6975 0.1985 0.0614 0.1195 122 GLU A O 750 C CB . GLU A 101 ? 0.8759 1.1230 0.7928 0.2283 0.0375 0.1252 122 GLU A CB 751 C CG . GLU A 101 ? 1.0473 1.3401 0.9566 0.2499 0.0280 0.1297 122 GLU A CG 752 C CD . GLU A 101 ? 1.1468 1.4875 1.0748 0.2356 0.0107 0.1166 122 GLU A CD 753 O OE1 . GLU A 101 ? 1.2213 1.5983 1.1451 0.2466 -0.0014 0.1152 122 GLU A OE1 754 O OE2 . GLU A 101 ? 1.1208 1.4616 1.0661 0.2130 0.0100 0.1070 122 GLU A OE2 755 N N . ASN A 102 ? 0.8876 1.0563 0.7931 0.2246 0.0742 0.1327 123 ASN A N 756 C CA . ASN A 102 ? 0.8877 1.0291 0.7985 0.2085 0.0831 0.1280 123 ASN A CA 757 C C . ASN A 102 ? 0.8518 1.0043 0.7835 0.1832 0.0711 0.1171 123 ASN A C 758 O O . ASN A 102 ? 0.7958 0.9840 0.7375 0.1800 0.0588 0.1141 123 ASN A O 759 C CB . ASN A 102 ? 0.9888 1.1349 0.8890 0.2236 0.0975 0.1374 123 ASN A CB 760 C CG . ASN A 102 ? 1.1806 1.3101 1.0573 0.2492 0.1127 0.1484 123 ASN A CG 761 O OD1 . ASN A 102 ? 1.2057 1.2951 1.0725 0.2469 0.1227 0.1469 123 ASN A OD1 762 N ND2 . ASN A 102 ? 1.2813 1.4419 1.1483 0.2736 0.1147 0.1593 123 ASN A ND2 763 N N . PHE A 103 ? 0.8073 0.9292 0.7446 0.1650 0.0749 0.1101 124 PHE A N 764 C CA . PHE A 103 ? 0.7151 0.8413 0.6692 0.1433 0.0667 0.1023 124 PHE A CA 765 C C . PHE A 103 ? 0.8118 0.9671 0.7710 0.1581 0.0648 0.1143 124 PHE A C 766 O O . PHE A 103 ? 0.7597 0.9155 0.7035 0.1727 0.0786 0.1217 124 PHE A O 767 C CB . PHE A 103 ? 0.6252 0.7129 0.5841 0.1287 0.0686 0.0958 124 PHE A CB 768 C CG . PHE A 103 ? 0.4997 0.5677 0.4602 0.1176 0.0657 0.0874 124 PHE A CG 769 C CD1 . PHE A 103 ? 0.4521 0.5018 0.3985 0.1274 0.0734 0.0891 124 PHE A CD1 770 C CD2 . PHE A 103 ? 0.4330 0.4992 0.4076 0.0977 0.0560 0.0780 124 PHE A CD2 771 C CE1 . PHE A 103 ? 0.4770 0.5075 0.4248 0.1168 0.0685 0.0817 124 PHE A CE1 772 C CE2 . PHE A 103 ? 0.4627 0.5122 0.4380 0.0887 0.0536 0.0707 124 PHE A CE2 773 C CZ . PHE A 103 ? 0.4181 0.4495 0.3806 0.0979 0.0580 0.0726 124 PHE A CZ 774 N N . LYS A 104 ? 0.8552 1.0370 0.8396 0.1551 0.0468 0.1151 125 LYS A N 775 C CA . LYS A 104 ? 0.9690 1.1882 0.9692 0.1701 0.0415 0.1243 125 LYS A CA 776 C C . LYS A 104 ? 0.9946 1.2014 1.0108 0.1624 0.0434 0.1250 125 LYS A C 777 O O . LYS A 104 ? 1.0035 1.2492 1.0504 0.1667 0.0331 0.1260 125 LYS A O 778 C CB . LYS A 104 ? 1.0145 1.2942 1.0391 0.1766 0.0204 0.1218 125 LYS A CB 779 C CG . LYS A 104 ? 1.0779 1.3772 1.0822 0.1930 0.0218 0.1254 125 LYS A CG 780 C CD . LYS A 104 ? 1.1025 1.4614 1.1281 0.1943 -0.0001 0.1185 125 LYS A CD 781 C CE . LYS A 104 ? 1.0947 1.4595 1.0939 0.2064 0.0032 0.1192 125 LYS A CE 782 N NZ . LYS A 104 ? 1.0417 1.3541 1.0192 0.1931 0.0139 0.1131 125 LYS A NZ 783 N N . THR A 105 ? 0.9833 1.1411 0.9814 0.1504 0.0582 0.1220 126 THR A N 784 C CA . THR A 105 ? 0.8601 1.0000 0.8657 0.1430 0.0635 0.1224 126 THR A CA 785 C C . THR A 105 ? 0.8525 0.9478 0.8325 0.1317 0.0818 0.1166 126 THR A C 786 O O . THR A 105 ? 0.9147 0.9898 0.8894 0.1242 0.0785 0.1058 126 THR A O 787 C CB . THR A 105 ? 0.7761 0.9234 0.8106 0.1289 0.0494 0.1149 126 THR A CB 788 O OG1 . THR A 105 ? 0.7905 0.9619 0.8510 0.1345 0.0478 0.1186 126 THR A OG1 789 C CG2 . THR A 105 ? 0.6876 0.7906 0.7104 0.1088 0.0559 0.1058 126 THR A CG2 790 N N . ARG A 106 ? 0.8494 0.9281 0.8283 0.1330 0.0881 0.1180 127 ARG A N 791 C CA . ARG A 106 ? 0.9342 0.9747 0.9027 0.1265 0.0908 0.1065 127 ARG A CA 792 C C . ARG A 106 ? 0.8654 0.8849 0.8380 0.1177 0.0937 0.1017 127 ARG A C 793 O O . ARG A 106 ? 0.8556 0.8480 0.8121 0.1298 0.1098 0.1066 127 ARG A O 794 C CB . ARG A 106 ? 1.1225 1.1596 1.0789 0.1418 0.1003 0.1144 127 ARG A CB 795 C CG . ARG A 106 ? 1.2884 1.3189 1.2290 0.1541 0.1058 0.1168 127 ARG A CG 796 C CD . ARG A 106 ? 1.4380 1.4574 1.3624 0.1745 0.1215 0.1285 127 ARG A CD 797 N NE . ARG A 106 ? 1.5580 1.5493 1.4577 0.1938 0.1393 0.1362 127 ARG A NE 798 C CZ . ARG A 106 ? 1.6788 1.6702 1.5642 0.2108 0.1472 0.1442 127 ARG A CZ 799 N NH1 . ARG A 106 ? 1.7417 1.7628 1.6344 0.2140 0.1401 0.1472 127 ARG A NH1 800 N NH2 . ARG A 106 ? 1.6804 1.6391 1.5404 0.2281 0.1655 0.1512 127 ARG A NH2 801 N N . THR A 107 ? 0.7655 0.7949 0.7544 0.1047 0.0853 0.0981 128 THR A N 802 C CA . THR A 107 ? 0.6800 0.6910 0.6725 0.0996 0.0905 0.0956 128 THR A CA 803 C C . THR A 107 ? 0.6557 0.6751 0.6651 0.0820 0.0775 0.0872 128 THR A C 804 O O . THR A 107 ? 0.6718 0.7145 0.6902 0.0830 0.0729 0.0941 128 THR A O 805 C CB . THR A 107 ? 0.7106 0.7151 0.7034 0.1045 0.0987 0.1008 128 THR A CB 806 O OG1 . THR A 107 ? 0.7545 0.7802 0.7643 0.0985 0.0913 0.1039 128 THR A OG1 807 C CG2 . THR A 107 ? 0.6287 0.6257 0.6042 0.1223 0.1109 0.1095 128 THR A CG2 808 N N . ARG A 108 ? 0.6075 0.6106 0.6205 0.0799 0.0846 0.0862 129 ARG A N 809 C CA . ARG A 108 ? 0.5875 0.5944 0.6154 0.0658 0.0751 0.0792 129 ARG A CA 810 C C . ARG A 108 ? 0.4795 0.4649 0.5133 0.0663 0.0794 0.0773 129 ARG A C 811 O O . ARG A 108 ? 0.5283 0.4825 0.5479 0.0776 0.0850 0.0789 129 ARG A O 812 C CB . ARG A 108 ? 0.6187 0.6138 0.6426 0.0668 0.0668 0.0745 129 ARG A CB 813 C CG . ARG A 108 ? 0.7360 0.7277 0.7715 0.0551 0.0570 0.0676 129 ARG A CG 814 C CD . ARG A 108 ? 0.8321 0.8162 0.8603 0.0544 0.0484 0.0649 129 ARG A CD 815 N NE . ARG A 108 ? 0.7760 0.7925 0.8045 0.0498 0.0474 0.0634 129 ARG A NE 816 C CZ . ARG A 108 ? 0.8204 0.8381 0.8435 0.0486 0.0417 0.0602 129 ARG A CZ 817 N NH1 . ARG A 108 ? 0.8634 0.8520 0.8806 0.0507 0.0355 0.0600 129 ARG A NH1 818 N NH2 . ARG A 108 ? 0.7674 0.8063 0.7871 0.0504 0.0403 0.0625 129 ARG A NH2 819 N N . SER A 109 ? 0.5066 0.5031 0.5570 0.0533 0.0763 0.0738 130 SER A N 820 C CA . SER A 109 ? 0.5120 0.4874 0.5664 0.0537 0.0822 0.0710 130 SER A CA 821 C C . SER A 109 ? 0.5620 0.4913 0.5950 0.0587 0.0786 0.0685 130 SER A C 822 O O . SER A 109 ? 0.5644 0.4843 0.5905 0.0566 0.0693 0.0667 130 SER A O 823 C CB . SER A 109 ? 0.5623 0.5493 0.6366 0.0405 0.0761 0.0648 130 SER A CB 824 O OG . SER A 109 ? 0.5847 0.5881 0.6670 0.0375 0.0651 0.0680 130 SER A OG 825 N N . THR A 110 ? 0.6105 0.5105 0.6298 0.0627 0.0864 0.0694 131 THR A N 826 C CA . THR A 110 ? 0.5556 0.4126 0.5509 0.0630 0.0827 0.0676 131 THR A CA 827 C C . THR A 110 ? 0.5070 0.3551 0.5053 0.0497 0.0776 0.0631 131 THR A C 828 O O . THR A 110 ? 0.5128 0.3761 0.5263 0.0423 0.0817 0.0615 131 THR A O 829 C CB . THR A 110 ? 0.5398 0.3686 0.5153 0.0713 0.0924 0.0691 131 THR A CB 830 O OG1 . THR A 110 ? 0.6300 0.4431 0.6007 0.0646 0.0954 0.0666 131 THR A OG1 831 C CG2 . THR A 110 ? 0.4723 0.3219 0.4542 0.0811 0.1038 0.0739 131 THR A CG2 832 N N . VAL A 111 ? 0.4408 0.2718 0.4257 0.0450 0.0697 0.0587 132 VAL A N 833 C CA . VAL A 111 ? 0.5016 0.3277 0.4853 0.0333 0.0667 0.0527 132 VAL A CA 834 C C . VAL A 111 ? 0.5112 0.3201 0.4734 0.0341 0.0688 0.0476 132 VAL A C 835 O O . VAL A 111 ? 0.5742 0.3740 0.5209 0.0393 0.0673 0.0459 132 VAL A O 836 C CB . VAL A 111 ? 0.4504 0.2854 0.4397 0.0256 0.0561 0.0493 132 VAL A CB 837 C CG1 . VAL A 111 ? 0.4134 0.2570 0.4043 0.0322 0.0514 0.0529 132 VAL A CG1 838 C CG2 . VAL A 111 ? 0.4511 0.2778 0.4269 0.0202 0.0517 0.0418 132 VAL A CG2 839 N N . SER A 112 ? 0.4464 0.2493 0.4068 0.0289 0.0727 0.0458 133 SER A N 840 C CA . SER A 112 ? 0.4548 0.2413 0.3935 0.0316 0.0750 0.0429 133 SER A CA 841 C C . SER A 112 ? 0.4900 0.2764 0.4253 0.0246 0.0689 0.0381 133 SER A C 842 O O . SER A 112 ? 0.5010 0.2911 0.4468 0.0181 0.0717 0.0380 133 SER A O 843 C CB . SER A 112 ? 0.5500 0.3264 0.4859 0.0355 0.0884 0.0475 133 SER A CB 844 O OG . SER A 112 ? 0.7234 0.4832 0.6377 0.0377 0.0907 0.0454 133 SER A OG 845 N N . VAL A 113 ? 0.4755 0.2562 0.3961 0.0258 0.0611 0.0341 134 VAL A N 846 C CA . VAL A 113 ? 0.4959 0.2787 0.4147 0.0207 0.0541 0.0303 134 VAL A CA 847 C C . VAL A 113 ? 0.5192 0.2867 0.4169 0.0251 0.0526 0.0288 134 VAL A C 848 O O . VAL A 113 ? 0.6010 0.3567 0.4837 0.0309 0.0525 0.0287 134 VAL A O 849 C CB . VAL A 113 ? 0.4423 0.2340 0.3657 0.0178 0.0438 0.0274 134 VAL A CB 850 C CG1 . VAL A 113 ? 0.3872 0.1872 0.3175 0.0119 0.0389 0.0250 134 VAL A CG1 851 C CG2 . VAL A 113 ? 0.4829 0.2834 0.4182 0.0186 0.0447 0.0300 134 VAL A CG2 852 N N . ARG A 114 ? 0.5078 0.2738 0.4029 0.0229 0.0512 0.0277 135 ARG A N 853 C CA . ARG A 114 ? 0.5280 0.2804 0.4036 0.0282 0.0472 0.0268 135 ARG A CA 854 C C . ARG A 114 ? 0.5576 0.3145 0.4339 0.0262 0.0345 0.0227 135 ARG A C 855 O O . ARG A 114 ? 0.5382 0.3088 0.4296 0.0202 0.0299 0.0212 135 ARG A O 856 C CB . ARG A 114 ? 0.5227 0.2703 0.3955 0.0283 0.0517 0.0283 135 ARG A CB 857 C CG . ARG A 114 ? 0.5643 0.2994 0.4305 0.0316 0.0659 0.0328 135 ARG A CG 858 C CD . ARG A 114 ? 0.5874 0.3121 0.4462 0.0333 0.0712 0.0348 135 ARG A CD 859 N NE . ARG A 114 ? 0.6509 0.3858 0.5281 0.0243 0.0721 0.0330 135 ARG A NE 860 C CZ . ARG A 114 ? 0.7630 0.4875 0.6380 0.0234 0.0802 0.0345 135 ARG A CZ 861 N NH1 . ARG A 114 ? 0.7801 0.4839 0.6352 0.0320 0.0888 0.0389 135 ARG A NH1 862 N NH2 . ARG A 114 ? 0.7241 0.4568 0.6150 0.0146 0.0806 0.0316 135 ARG A NH2 863 N N . ARG A 115 ? 0.5007 0.2442 0.3604 0.0314 0.0289 0.0209 136 ARG A N 864 C CA . ARG A 115 ? 0.5098 0.2543 0.3717 0.0288 0.0171 0.0167 136 ARG A CA 865 C C . ARG A 115 ? 0.4293 0.1810 0.2979 0.0271 0.0123 0.0162 136 ARG A C 866 O O . ARG A 115 ? 0.4175 0.1632 0.2773 0.0319 0.0160 0.0186 136 ARG A O 867 C CB . ARG A 115 ? 0.6401 0.3653 0.4822 0.0350 0.0115 0.0137 136 ARG A CB 868 C CG . ARG A 115 ? 0.8811 0.6021 0.7223 0.0348 -0.0015 0.0088 136 ARG A CG 869 C CD . ARG A 115 ? 1.0511 0.7500 0.8707 0.0419 -0.0067 0.0045 136 ARG A CD 870 N NE . ARG A 115 ? 1.2332 0.9222 1.0370 0.0480 0.0041 0.0083 136 ARG A NE 871 C CZ . ARG A 115 ? 1.2984 0.9669 1.0775 0.0577 0.0038 0.0067 136 ARG A CZ 872 N NH1 . ARG A 115 ? 1.3421 0.9972 1.1086 0.0627 -0.0084 -0.0003 136 ARG A NH1 873 N NH2 . ARG A 115 ? 1.2687 0.9298 1.0361 0.0630 0.0159 0.0112 136 ARG A NH2 874 N N . GLY A 116 ? 0.4218 0.1848 0.3053 0.0211 0.0059 0.0139 137 GLY A N 875 C CA . GLY A 116 ? 0.3598 0.1297 0.2510 0.0200 0.0025 0.0139 137 GLY A CA 876 C C . GLY A 116 ? 0.4478 0.2312 0.3525 0.0150 0.0090 0.0157 137 GLY A C 877 O O . GLY A 116 ? 0.3716 0.1616 0.2847 0.0132 0.0070 0.0153 137 GLY A O 878 N N . GLN A 117 ? 0.4087 0.1951 0.3161 0.0133 0.0166 0.0174 138 GLN A N 879 C CA . GLN A 117 ? 0.4299 0.2269 0.3497 0.0086 0.0217 0.0181 138 GLN A CA 880 C C . GLN A 117 ? 0.4412 0.2513 0.3738 0.0039 0.0177 0.0169 138 GLN A C 881 O O . GLN A 117 ? 0.3887 0.1985 0.3211 0.0043 0.0148 0.0165 138 GLN A O 882 C CB . GLN A 117 ? 0.3885 0.1827 0.3084 0.0086 0.0311 0.0203 138 GLN A CB 883 C CG . GLN A 117 ? 0.4526 0.2539 0.3846 0.0030 0.0359 0.0201 138 GLN A CG 884 C CD . GLN A 117 ? 0.5063 0.3002 0.4345 0.0027 0.0394 0.0199 138 GLN A CD 885 O OE1 . GLN A 117 ? 0.5716 0.3705 0.5034 0.0011 0.0350 0.0182 138 GLN A OE1 886 N NE2 . GLN A 117 ? 0.4553 0.2349 0.3750 0.0049 0.0489 0.0221 138 GLN A NE2 887 N N . GLY A 118 ? 0.4101 0.2287 0.3520 0.0001 0.0185 0.0164 139 GLY A N 888 C CA . GLY A 118 ? 0.3421 0.1710 0.2935 -0.0030 0.0162 0.0162 139 GLY A CA 889 C C . GLY A 118 ? 0.4059 0.2381 0.3619 -0.0039 0.0199 0.0178 139 GLY A C 890 O O . GLY A 118 ? 0.3948 0.2242 0.3511 -0.0044 0.0251 0.0184 139 GLY A O 891 N N . MET A 119 ? 0.4362 0.2730 0.3963 -0.0038 0.0179 0.0190 140 MET A N 892 C CA . MET A 119 ? 0.4838 0.3241 0.4497 -0.0036 0.0205 0.0215 140 MET A CA 893 C C . MET A 119 ? 0.4461 0.2919 0.4168 -0.0037 0.0180 0.0236 140 MET A C 894 O O . MET A 119 ? 0.4885 0.3333 0.4568 -0.0031 0.0158 0.0235 140 MET A O 895 C CB . MET A 119 ? 0.5561 0.3903 0.5182 0.0010 0.0243 0.0237 140 MET A CB 896 C CG . MET A 119 ? 0.5016 0.3315 0.4592 0.0051 0.0234 0.0253 140 MET A CG 897 S SD . MET A 119 ? 0.9332 0.7564 0.8876 0.0114 0.0300 0.0288 140 MET A SD 898 C CE . MET A 119 ? 0.6915 0.5265 0.6617 0.0096 0.0321 0.0324 140 MET A CE 899 N N . VAL A 120 ? 0.4047 0.2549 0.3823 -0.0045 0.0187 0.0262 141 VAL A N 900 C CA . VAL A 120 ? 0.4494 0.3035 0.4299 -0.0031 0.0162 0.0300 141 VAL A CA 901 C C . VAL A 120 ? 0.4172 0.2732 0.4016 0.0029 0.0183 0.0361 141 VAL A C 902 O O . VAL A 120 ? 0.4445 0.3028 0.4363 0.0015 0.0204 0.0373 141 VAL A O 903 C CB . VAL A 120 ? 0.4909 0.3489 0.4756 -0.0097 0.0137 0.0284 141 VAL A CB 904 C CG1 . VAL A 120 ? 0.4229 0.2834 0.4064 -0.0074 0.0102 0.0334 141 VAL A CG1 905 C CG2 . VAL A 120 ? 0.4160 0.2722 0.3969 -0.0143 0.0137 0.0226 141 VAL A CG2 906 N N . LEU A 121 ? 0.3745 0.2291 0.3541 0.0101 0.0190 0.0403 142 LEU A N 907 C CA . LEU A 121 ? 0.4374 0.2973 0.4198 0.0189 0.0212 0.0476 142 LEU A CA 908 C C . LEU A 121 ? 0.5686 0.4393 0.5520 0.0226 0.0171 0.0531 142 LEU A C 909 O O . LEU A 121 ? 0.5698 0.4374 0.5455 0.0248 0.0173 0.0537 142 LEU A O 910 C CB . LEU A 121 ? 0.4648 0.3151 0.4380 0.0263 0.0267 0.0489 142 LEU A CB 911 C CG . LEU A 121 ? 0.5692 0.4089 0.5375 0.0257 0.0306 0.0451 142 LEU A CG 912 C CD1 . LEU A 121 ? 0.6303 0.4543 0.5861 0.0288 0.0340 0.0442 142 LEU A CD1 913 C CD2 . LEU A 121 ? 0.5644 0.4088 0.5382 0.0316 0.0351 0.0493 142 LEU A CD2 914 N N . LEU A 122 ? 0.5054 0.4025 0.5002 0.0221 0.0143 0.0522 143 LEU A N 915 C CA . LEU A 122 ? 0.5045 0.4302 0.5017 0.0232 0.0096 0.0499 143 LEU A CA 916 C C . LEU A 122 ? 0.5541 0.4964 0.5493 0.0350 0.0140 0.0536 143 LEU A C 917 O O . LEU A 122 ? 0.6159 0.5673 0.6166 0.0402 0.0189 0.0556 143 LEU A O 918 C CB . LEU A 122 ? 0.4389 0.3937 0.4511 0.0145 0.0046 0.0426 143 LEU A CB 919 C CG . LEU A 122 ? 0.4853 0.4210 0.4976 0.0017 0.0034 0.0380 143 LEU A CG 920 C CD1 . LEU A 122 ? 0.4913 0.4525 0.5187 -0.0073 0.0008 0.0304 143 LEU A CD1 921 C CD2 . LEU A 122 ? 0.4832 0.4035 0.4830 -0.0026 0.0008 0.0363 143 LEU A CD2 922 N N . CYS A 123 ? 0.5416 0.4864 0.5274 0.0393 0.0144 0.0545 144 CYS A N 923 C CA . CYS A 123 ? 0.6924 0.6522 0.6740 0.0507 0.0214 0.0572 144 CYS A CA 924 C C . CYS A 123 ? 0.6990 0.7005 0.6935 0.0472 0.0233 0.0496 144 CYS A C 925 O O . CYS A 123 ? 0.7489 0.7616 0.7472 0.0506 0.0296 0.0518 144 CYS A O 926 C CB . CYS A 123 ? 0.7550 0.7068 0.7232 0.0559 0.0234 0.0593 144 CYS A CB 927 S SG . CYS A 123 ? 1.0059 0.9532 0.9606 0.0738 0.0361 0.0679 144 CYS A SG 928 N N . GLY A 124 ? 0.6520 0.6719 0.6507 0.0389 0.0197 0.0414 145 GLY A N 929 C CA . GLY A 124 ? 0.5968 0.6424 0.5987 0.0429 0.0160 0.0461 145 GLY A CA 930 C C . GLY A 124 ? 0.6453 0.7031 0.6360 0.0624 0.0199 0.0556 145 GLY A C 931 O O . GLY A 124 ? 0.6419 0.7141 0.6325 0.0701 0.0254 0.0606 145 GLY A O 932 N N . PRO A 125 ? 0.6024 0.6536 0.5812 0.0714 0.0180 0.0589 146 PRO A N 933 C CA . PRO A 125 ? 0.6871 0.7482 0.6525 0.0923 0.0224 0.0690 146 PRO A CA 934 C C . PRO A 125 ? 0.6272 0.7285 0.5962 0.1012 0.0169 0.0724 146 PRO A C 935 O O . PRO A 125 ? 0.6377 0.7606 0.6160 0.0912 0.0064 0.0657 146 PRO A O 936 C CB . PRO A 125 ? 0.7744 0.8244 0.7271 0.0965 0.0183 0.0708 146 PRO A CB 937 C CG . PRO A 125 ? 0.8018 0.8281 0.7600 0.0778 0.0159 0.0617 146 PRO A CG 938 C CD . PRO A 125 ? 0.6454 0.6813 0.6209 0.0630 0.0116 0.0542 146 PRO A CD 939 N N . PRO A 126 ? 0.6322 0.7448 0.5930 0.1197 0.0248 0.0814 147 PRO A N 940 C CA . PRO A 126 ? 0.6852 0.8405 0.6468 0.1317 0.0197 0.0848 147 PRO A CA 941 C C . PRO A 126 ? 0.7695 0.9457 0.7227 0.1421 0.0089 0.0862 147 PRO A C 942 O O . PRO A 126 ? 0.7611 0.9125 0.7033 0.1435 0.0087 0.0881 147 PRO A O 943 C CB . PRO A 126 ? 0.7144 0.8672 0.6647 0.1515 0.0335 0.0958 147 PRO A CB 944 C CG . PRO A 126 ? 0.7644 0.8754 0.7130 0.1428 0.0455 0.0943 147 PRO A CG 945 C CD . PRO A 126 ? 0.6305 0.7170 0.5802 0.1296 0.0399 0.0875 147 PRO A CD 946 N N . PRO A 127 ? 0.7870 1.0094 0.7439 0.1491 0.0002 0.0846 148 PRO A N 947 C CA . PRO A 127 ? 0.7490 0.9957 0.6959 0.1600 -0.0111 0.0849 148 PRO A CA 948 C C . PRO A 127 ? 0.7168 0.9431 0.6400 0.1838 -0.0034 0.0993 148 PRO A C 949 O O . PRO A 127 ? 0.6995 0.9170 0.6151 0.1997 0.0097 0.1093 148 PRO A O 950 C CB . PRO A 127 ? 0.8183 1.1205 0.7730 0.1670 -0.0178 0.0815 148 PRO A CB 951 C CG . PRO A 127 ? 0.8102 1.1132 0.7826 0.1491 -0.0130 0.0745 148 PRO A CG 952 C CD . PRO A 127 ? 0.7619 1.0171 0.7302 0.1474 0.0008 0.0819 148 PRO A CD 953 N N . HIS A 128 ? 0.7117 0.9278 0.6208 0.1859 -0.0097 0.1003 149 HIS A N 954 C CA . HIS A 128 ? 0.7556 0.9412 0.6404 0.2045 0.0007 0.1134 149 HIS A CA 955 C C . HIS A 128 ? 0.7480 0.9412 0.6145 0.2104 -0.0101 0.1147 149 HIS A C 956 O O . HIS A 128 ? 0.8430 1.0599 0.7164 0.1964 -0.0254 0.1034 149 HIS A O 957 C CB . HIS A 128 ? 0.7241 0.8562 0.6098 0.1905 0.0134 0.1123 149 HIS A CB 958 C CG . HIS A 128 ? 0.5749 0.6915 0.4673 0.1671 0.0048 0.1019 149 HIS A CG 959 N ND1 . HIS A 128 ? 0.6463 0.7679 0.5604 0.1447 -0.0014 0.0898 149 HIS A ND1 960 C CD2 . HIS A 128 ? 0.5601 0.6562 0.4386 0.1636 0.0026 0.1022 149 HIS A CD2 961 C CE1 . HIS A 128 ? 0.6373 0.7419 0.5505 0.1292 -0.0072 0.0832 149 HIS A CE1 962 N NE2 . HIS A 128 ? 0.6092 0.6989 0.5008 0.1398 -0.0051 0.0904 149 HIS A NE2 963 N N . SER A 129 ? 0.6731 0.8439 0.5143 0.2303 -0.0005 0.1279 150 SER A N 964 C CA . SER A 129 ? 0.7486 0.9157 0.5670 0.2352 -0.0073 0.1309 150 SER A CA 965 C C . SER A 129 ? 0.7790 0.8956 0.5768 0.2446 0.0116 0.1426 150 SER A C 966 O O . SER A 129 ? 0.8049 0.9072 0.5956 0.2619 0.0275 0.1528 150 SER A O 967 C CB . SER A 129 ? 0.7672 0.9835 0.5709 0.2575 -0.0197 0.1350 150 SER A CB 968 O OG . SER A 129 ? 0.8277 1.0372 0.6040 0.2635 -0.0250 0.1386 150 SER A OG 969 N N . GLY A 130 ? 0.7262 0.8170 0.5143 0.2325 0.0110 0.1400 151 GLY A N 970 C CA . GLY A 130 ? 0.8029 0.8446 0.5784 0.2337 0.0300 0.1467 151 GLY A CA 971 C C . GLY A 130 ? 0.8163 0.8287 0.6133 0.2058 0.0343 0.1346 151 GLY A C 972 O O . GLY A 130 ? 0.8191 0.8462 0.6388 0.1894 0.0251 0.1241 151 GLY A O 973 N N . GLU A 131 ? 0.8751 0.8486 0.6659 0.2006 0.0489 0.1356 152 GLU A N 974 C CA . GLU A 131 ? 0.9356 0.8855 0.7458 0.1751 0.0522 0.1230 152 GLU A CA 975 C C . GLU A 131 ? 0.8730 0.8130 0.7007 0.1695 0.0622 0.1176 152 GLU A C 976 O O . GLU A 131 ? 0.9362 0.8679 0.7557 0.1846 0.0759 0.1246 152 GLU A O 977 C CB . GLU A 131 ? 1.0248 0.9433 0.8243 0.1712 0.0641 0.1236 152 GLU A CB 978 C CG . GLU A 131 ? 1.1909 1.0918 1.0098 0.1462 0.0659 0.1097 152 GLU A CG 979 C CD . GLU A 131 ? 1.3475 1.2251 1.1576 0.1428 0.0763 0.1096 152 GLU A CD 980 O OE1 . GLU A 131 ? 1.3668 1.2484 1.1619 0.1449 0.0697 0.1137 152 GLU A OE1 981 O OE2 . GLU A 131 ? 1.3977 1.2556 1.2153 0.1378 0.0911 0.1045 152 GLU A OE2 982 N N . LEU A 132 ? 0.8007 0.7416 0.6498 0.1483 0.0558 0.1051 153 LEU A N 983 C CA . LEU A 132 ? 0.8683 0.8021 0.7312 0.1417 0.0638 0.0990 153 LEU A CA 984 C C . LEU A 132 ? 0.8715 0.7808 0.7425 0.1246 0.0724 0.0882 153 LEU A C 985 O O . LEU A 132 ? 0.8787 0.7807 0.7529 0.1121 0.0685 0.0821 153 LEU A O 986 C CB . LEU A 132 ? 0.7600 0.7182 0.6406 0.1335 0.0516 0.0936 153 LEU A CB 987 C CG . LEU A 132 ? 0.7281 0.7208 0.6055 0.1490 0.0422 0.1012 153 LEU A CG 988 C CD1 . LEU A 132 ? 0.6651 0.6797 0.5625 0.1395 0.0348 0.0946 153 LEU A CD1 989 C CD2 . LEU A 132 ? 0.6687 0.6617 0.5294 0.1737 0.0540 0.1137 153 LEU A CD2 990 N N . SER A 133 ? 0.7981 0.6896 0.6661 0.1275 0.0818 0.0929 154 SER A N 991 C CA . SER A 133 ? 0.6388 0.4886 0.5015 0.1184 0.0851 0.1009 154 SER A CA 992 C C . SER A 133 ? 0.7346 0.5831 0.6081 0.1121 0.0799 0.0993 154 SER A C 993 O O . SER A 133 ? 0.7372 0.6036 0.6129 0.1215 0.0811 0.0995 154 SER A O 994 C CB . SER A 133 ? 0.5893 0.4083 0.4343 0.1304 0.1032 0.1120 154 SER A CB 995 O OG . SER A 133 ? 0.8099 0.5921 0.6534 0.1181 0.1087 0.1152 154 SER A OG 996 N N . TYR A 134 ? 0.6231 0.4514 0.5033 0.0969 0.0755 0.0970 155 TYR A N 997 C CA . TYR A 134 ? 0.6047 0.4321 0.4955 0.0905 0.0701 0.0935 155 TYR A CA 998 C C . TYR A 134 ? 0.6969 0.4902 0.5864 0.0827 0.0764 0.0938 155 TYR A C 999 O O . TYR A 134 ? 0.7046 0.4792 0.5932 0.0737 0.0796 0.0929 155 TYR A O 1000 C CB . TYR A 134 ? 0.5205 0.3662 0.4256 0.0777 0.0556 0.0854 155 TYR A CB 1001 C CG . TYR A 134 ? 0.6467 0.5271 0.5566 0.0810 0.0476 0.0816 155 TYR A CG 1002 C CD1 . TYR A 134 ? 0.5685 0.4594 0.4752 0.0793 0.0458 0.0774 155 TYR A CD1 1003 C CD2 . TYR A 134 ? 0.5972 0.5070 0.5190 0.0824 0.0438 0.0761 155 TYR A CD2 1004 C CE1 . TYR A 134 ? 0.5235 0.4523 0.4399 0.0786 0.0403 0.0656 155 TYR A CE1 1005 C CE2 . TYR A 134 ? 0.6988 0.6478 0.6313 0.0797 0.0393 0.0647 155 TYR A CE2 1006 C CZ . TYR A 134 ? 0.6429 0.5977 0.5716 0.0788 0.0367 0.0611 155 TYR A CZ 1007 O OH . TYR A 134 ? 0.6084 0.5841 0.5367 0.0834 0.0260 0.0655 155 TYR A OH 1008 N N . ALA A 135 ? 0.6483 0.4358 0.5390 0.0857 0.0785 0.0939 156 ALA A N 1009 C CA . ALA A 135 ? 0.6736 0.4334 0.5647 0.0767 0.0819 0.0905 156 ALA A CA 1010 C C . ALA A 135 ? 0.6876 0.4555 0.5852 0.0768 0.0769 0.0867 156 ALA A C 1011 O O . ALA A 135 ? 0.6901 0.4799 0.5899 0.0865 0.0752 0.0893 156 ALA A O 1012 C CB . ALA A 135 ? 0.6361 0.3622 0.5122 0.0831 0.0976 0.0972 156 ALA A CB 1013 N N . TRP A 136 ? 0.7221 0.4748 0.6230 0.0662 0.0751 0.0799 157 TRP A N 1014 C CA . TRP A 136 ? 0.6749 0.4322 0.5794 0.0670 0.0722 0.0765 157 TRP A CA 1015 C C . TRP A 136 ? 0.6669 0.3934 0.5603 0.0690 0.0813 0.0763 157 TRP A C 1016 O O . TRP A 136 ? 0.7094 0.4100 0.5966 0.0630 0.0870 0.0748 157 TRP A O 1017 C CB . TRP A 136 ? 0.5657 0.3367 0.4827 0.0543 0.0607 0.0675 157 TRP A CB 1018 C CG . TRP A 136 ? 0.5767 0.3758 0.5043 0.0533 0.0521 0.0675 157 TRP A CG 1019 C CD1 . TRP A 136 ? 0.5197 0.3281 0.4495 0.0502 0.0483 0.0680 157 TRP A CD1 1020 C CD2 . TRP A 136 ? 0.5128 0.3322 0.4498 0.0548 0.0467 0.0667 157 TRP A CD2 1021 N NE1 . TRP A 136 ? 0.5028 0.3347 0.4417 0.0493 0.0402 0.0671 157 TRP A NE1 1022 C CE2 . TRP A 136 ? 0.4744 0.3135 0.4190 0.0516 0.0392 0.0665 157 TRP A CE2 1023 C CE3 . TRP A 136 ? 0.4929 0.3143 0.4322 0.0584 0.0484 0.0666 157 TRP A CE3 1024 C CZ2 . TRP A 136 ? 0.4801 0.3401 0.4360 0.0508 0.0330 0.0660 157 TRP A CZ2 1025 C CZ3 . TRP A 136 ? 0.4451 0.2886 0.3968 0.0582 0.0432 0.0666 157 TRP A CZ3 1026 C CH2 . TRP A 136 ? 0.4662 0.3284 0.4266 0.0539 0.0354 0.0663 157 TRP A CH2 1027 N N . ILE A 137 ? 0.6376 0.3670 0.5290 0.0769 0.0833 0.0776 158 ILE A N 1028 C CA . ILE A 137 ? 0.6837 0.3833 0.5626 0.0795 0.0917 0.0766 158 ILE A CA 1029 C C . ILE A 137 ? 0.6710 0.3751 0.5549 0.0720 0.0843 0.0682 158 ILE A C 1030 O O . ILE A 137 ? 0.6032 0.3338 0.4978 0.0727 0.0778 0.0676 158 ILE A O 1031 C CB . ILE A 137 ? 0.6762 0.3722 0.5448 0.0980 0.1029 0.0861 158 ILE A CB 1032 C CG1 . ILE A 137 ? 0.6630 0.3487 0.5219 0.1071 0.1126 0.0950 158 ILE A CG1 1033 C CG2 . ILE A 137 ? 0.6613 0.3260 0.5162 0.1014 0.1115 0.0844 158 ILE A CG2 1034 C CD1 . ILE A 137 ? 0.6318 0.3211 0.4805 0.1276 0.1238 0.1051 158 ILE A CD1 1035 N N . PHE A 138 ? 0.6456 0.3232 0.5215 0.0642 0.0856 0.0614 159 PHE A N 1036 C CA . PHE A 138 ? 0.5351 0.2131 0.4106 0.0592 0.0800 0.0539 159 PHE A CA 1037 C C . PHE A 138 ? 0.6522 0.2971 0.5099 0.0645 0.0891 0.0525 159 PHE A C 1038 O O . PHE A 138 ? 0.6731 0.2870 0.5205 0.0606 0.0950 0.0500 159 PHE A O 1039 C CB . PHE A 138 ? 0.5846 0.2682 0.4675 0.0440 0.0695 0.0448 159 PHE A CB 1040 C CG . PHE A 138 ? 0.6142 0.2958 0.4931 0.0401 0.0639 0.0375 159 PHE A CG 1041 C CD1 . PHE A 138 ? 0.6626 0.3632 0.5456 0.0445 0.0614 0.0386 159 PHE A CD1 1042 C CD2 . PHE A 138 ? 0.5172 0.1777 0.3884 0.0320 0.0617 0.0294 159 PHE A CD2 1043 C CE1 . PHE A 138 ? 0.6558 0.3521 0.5323 0.0424 0.0578 0.0331 159 PHE A CE1 1044 C CE2 . PHE A 138 ? 0.6197 0.2775 0.4841 0.0302 0.0562 0.0231 159 PHE A CE2 1045 C CZ . PHE A 138 ? 0.5170 0.1920 0.3829 0.0361 0.0549 0.0256 159 PHE A CZ 1046 N N . ASN A 139 ? 0.6486 0.2984 0.5025 0.0734 0.0915 0.0543 160 ASN A N 1047 C CA . ASN A 139 ? 0.6825 0.3003 0.5175 0.0804 0.1011 0.0533 160 ASN A CA 1048 C C . ASN A 139 ? 0.8018 0.3870 0.6233 0.0866 0.1140 0.0579 160 ASN A C 1049 O O . ASN A 139 ? 0.8415 0.3905 0.6496 0.0808 0.1183 0.0514 160 ASN A O 1050 C CB . ASN A 139 ? 0.6088 0.2099 0.4357 0.0696 0.0948 0.0418 160 ASN A CB 1051 C CG . ASN A 139 ? 0.7081 0.3334 0.5415 0.0684 0.0869 0.0393 160 ASN A CG 1052 O OD1 . ASN A 139 ? 0.6430 0.2912 0.4847 0.0766 0.0890 0.0458 160 ASN A OD1 1053 N ND2 . ASN A 139 ? 0.7578 0.3781 0.5876 0.0584 0.0781 0.0302 160 ASN A ND2 1054 N N . GLU A 140 ? 0.8490 0.4470 0.6740 0.0984 0.1202 0.0687 161 GLU A N 1055 C CA . GLU A 140 ? 0.9200 0.4881 0.7301 0.1091 0.1353 0.0764 161 GLU A CA 1056 C C . GLU A 140 ? 0.9097 0.4577 0.7188 0.0993 0.1377 0.0755 161 GLU A C 1057 O O . GLU A 140 ? 0.9745 0.4967 0.7712 0.1081 0.1516 0.0831 161 GLU A O 1058 C CB . GLU A 140 ? 1.0442 0.5730 0.8333 0.1164 0.1471 0.0746 161 GLU A CB 1059 C CG . GLU A 140 ? 1.1885 0.7338 0.9762 0.1288 0.1486 0.0773 161 GLU A CG 1060 C CD . GLU A 140 ? 1.3801 0.9508 1.1714 0.1480 0.1563 0.0908 161 GLU A CD 1061 O OE1 . GLU A 140 ? 1.4586 1.0481 1.2582 0.1503 0.1552 0.0972 161 GLU A OE1 1062 O OE2 . GLU A 140 ? 1.4321 1.0058 1.2174 0.1611 0.1637 0.0948 161 GLU A OE2 1063 N N . TYR A 141 ? 0.8227 0.3821 0.6444 0.0820 0.1257 0.0671 162 TYR A N 1064 C CA . TYR A 141 ? 0.8775 0.4208 0.7011 0.0712 0.1285 0.0657 162 TYR A CA 1065 C C . TYR A 141 ? 0.8344 0.4131 0.6762 0.0638 0.1172 0.0659 162 TYR A C 1066 O O . TYR A 141 ? 0.8141 0.4258 0.6683 0.0608 0.1046 0.0625 162 TYR A O 1067 C CB . TYR A 141 ? 0.9544 0.4672 0.7735 0.0550 0.1281 0.0529 162 TYR A CB 1068 C CG . TYR A 141 ? 1.1730 0.6406 0.9711 0.0606 0.1422 0.0516 162 TYR A CG 1069 C CD1 . TYR A 141 ? 1.3298 0.7589 1.1159 0.0633 0.1593 0.0567 162 TYR A CD1 1070 C CD2 . TYR A 141 ? 1.2505 0.7109 1.0391 0.0640 0.1400 0.0456 162 TYR A CD2 1071 C CE1 . TYR A 141 ? 1.4174 0.8006 1.1827 0.0685 0.1738 0.0550 162 TYR A CE1 1072 C CE2 . TYR A 141 ? 1.3514 0.7677 1.1188 0.0696 0.1536 0.0436 162 TYR A CE2 1073 C CZ . TYR A 141 ? 1.4421 0.8194 1.1981 0.0716 0.1705 0.0479 162 TYR A CZ 1074 O OH . TYR A 141 ? 1.5502 0.8795 1.2835 0.0772 0.1856 0.0453 162 TYR A OH 1075 N N . PRO A 142 ? 0.7667 0.3362 0.6090 0.0611 0.1235 0.0703 163 PRO A N 1076 C CA . PRO A 142 ? 0.7881 0.3871 0.6456 0.0541 0.1142 0.0701 163 PRO A CA 1077 C C . PRO A 142 ? 0.8342 0.4524 0.7057 0.0390 0.0994 0.0584 163 PRO A C 1078 O O . PRO A 142 ? 0.8110 0.4115 0.6818 0.0278 0.0985 0.0493 163 PRO A O 1079 C CB . PRO A 142 ? 0.7703 0.3431 0.6236 0.0494 0.1260 0.0735 163 PRO A CB 1080 C CG . PRO A 142 ? 0.8170 0.3554 0.6507 0.0629 0.1430 0.0820 163 PRO A CG 1081 C CD . PRO A 142 ? 0.8267 0.3562 0.6538 0.0661 0.1414 0.0768 163 PRO A CD 1082 N N . SER A 143 ? 0.7840 0.4380 0.6675 0.0394 0.0882 0.0584 164 SER A N 1083 C CA . SER A 143 ? 0.6102 0.2841 0.5058 0.0279 0.0752 0.0492 164 SER A CA 1084 C C . SER A 143 ? 0.7334 0.4065 0.6378 0.0157 0.0737 0.0453 164 SER A C 1085 O O . SER A 143 ? 0.8878 0.5636 0.7942 0.0171 0.0781 0.0509 164 SER A O 1086 C CB . SER A 143 ? 0.5983 0.3058 0.5032 0.0320 0.0664 0.0510 164 SER A CB 1087 O OG . SER A 143 ? 0.6944 0.4177 0.6082 0.0230 0.0556 0.0431 164 SER A OG 1088 N N . TYR A 144 ? 0.6995 0.3698 0.6088 0.0046 0.0678 0.0358 165 TYR A N 1089 C CA . TYR A 144 ? 0.6657 0.3354 0.5855 -0.0074 0.0672 0.0312 165 TYR A CA 1090 C C . TYR A 144 ? 0.6292 0.3302 0.5622 -0.0095 0.0582 0.0311 165 TYR A C 1091 O O . TYR A 144 ? 0.7096 0.4304 0.6455 -0.0074 0.0486 0.0289 165 TYR A O 1092 C CB . TYR A 144 ? 0.6919 0.3491 0.6132 -0.0181 0.0635 0.0203 165 TYR A CB 1093 C CG . TYR A 144 ? 0.6845 0.3399 0.6188 -0.0312 0.0649 0.0149 165 TYR A CG 1094 C CD1 . TYR A 144 ? 0.7592 0.3888 0.6915 -0.0363 0.0787 0.0164 165 TYR A CD1 1095 C CD2 . TYR A 144 ? 0.6268 0.3058 0.5760 -0.0381 0.0537 0.0087 165 TYR A CD2 1096 C CE1 . TYR A 144 ? 0.8163 0.4458 0.7631 -0.0497 0.0816 0.0108 165 TYR A CE1 1097 C CE2 . TYR A 144 ? 0.6464 0.3272 0.6104 -0.0499 0.0555 0.0036 165 TYR A CE2 1098 C CZ . TYR A 144 ? 0.8081 0.4654 0.7719 -0.0564 0.0695 0.0042 165 TYR A CZ 1099 O OH . TYR A 144 ? 0.8882 0.5492 0.8692 -0.0694 0.0727 -0.0016 165 TYR A OH 1100 N N . GLN A 145 ? 0.5683 0.2708 0.5080 -0.0133 0.0626 0.0335 166 GLN A N 1101 C CA . GLN A 145 ? 0.5316 0.2595 0.4816 -0.0145 0.0561 0.0337 166 GLN A CA 1102 C C . GLN A 145 ? 0.3949 0.1288 0.3587 -0.0255 0.0524 0.0267 166 GLN A C 1103 O O . GLN A 145 ? 0.4793 0.1973 0.4472 -0.0333 0.0593 0.0241 166 GLN A O 1104 C CB . GLN A 145 ? 0.6275 0.3546 0.5736 -0.0090 0.0639 0.0423 166 GLN A CB 1105 C CG . GLN A 145 ? 0.6892 0.4237 0.6260 0.0029 0.0631 0.0490 166 GLN A CG 1106 C CD . GLN A 145 ? 0.7662 0.4927 0.6942 0.0107 0.0727 0.0587 166 GLN A CD 1107 O OE1 . GLN A 145 ? 0.8836 0.6001 0.8004 0.0212 0.0788 0.0655 166 GLN A OE1 1108 N NE2 . GLN A 145 ? 0.6341 0.3653 0.5661 0.0071 0.0748 0.0600 166 GLN A NE2 1109 N N . ASP A 146 ? 0.3428 0.0990 0.3147 -0.0261 0.0423 0.0234 167 ASP A N 1110 C CA . ASP A 146 ? 0.2737 0.0380 0.2600 -0.0344 0.0384 0.0175 167 ASP A CA 1111 C C . ASP A 146 ? 0.4103 0.1967 0.4025 -0.0318 0.0296 0.0164 167 ASP A C 1112 O O . ASP A 146 ? 0.4494 0.2450 0.4357 -0.0255 0.0280 0.0201 167 ASP A O 1113 C CB . ASP A 146 ? 0.5385 0.2922 0.5271 -0.0412 0.0348 0.0095 167 ASP A CB 1114 C CG . ASP A 146 ? 0.6366 0.3938 0.6167 -0.0362 0.0253 0.0067 167 ASP A CG 1115 O OD1 . ASP A 146 ? 0.7612 0.5072 0.7389 -0.0404 0.0220 0.0002 167 ASP A OD1 1116 O OD2 . ASP A 146 ? 0.5954 0.3650 0.5706 -0.0287 0.0216 0.0105 167 ASP A OD2 1117 N N . ASN A 147 ? 0.3952 0.1885 0.3999 -0.0374 0.0247 0.0112 168 ASN A N 1118 C CA . ASN A 147 ? 0.4937 0.3030 0.5041 -0.0351 0.0167 0.0095 168 ASN A CA 1119 C C . ASN A 147 ? 0.4622 0.2769 0.4608 -0.0276 0.0119 0.0114 168 ASN A C 1120 O O . ASN A 147 ? 0.5476 0.3730 0.5467 -0.0244 0.0104 0.0127 168 ASN A O 1121 C CB . ASN A 147 ? 0.7104 0.5193 0.7305 -0.0406 0.0097 0.0022 168 ASN A CB 1122 C CG . ASN A 147 ? 0.9426 0.7647 0.9731 -0.0394 0.0035 0.0006 168 ASN A CG 1123 O OD1 . ASN A 147 ? 1.1158 0.9460 1.1522 -0.0382 0.0074 0.0038 168 ASN A OD1 1124 N ND2 . ASN A 147 ? 0.9720 0.7936 1.0038 -0.0394 -0.0058 -0.0048 168 ASN A ND2 1125 N N . ARG A 148 ? 0.4357 0.2410 0.4237 -0.0254 0.0111 0.0110 169 ARG A N 1126 C CA . ARG A 148 ? 0.4066 0.2156 0.3853 -0.0197 0.0070 0.0116 169 ARG A CA 1127 C C . ARG A 148 ? 0.4701 0.2790 0.4406 -0.0151 0.0118 0.0160 169 ARG A C 1128 O O . ARG A 148 ? 0.3840 0.2001 0.3507 -0.0114 0.0103 0.0168 169 ARG A O 1129 C CB . ARG A 148 ? 0.3159 0.1135 0.2882 -0.0200 0.0023 0.0074 169 ARG A CB 1130 C CG . ARG A 148 ? 0.4906 0.2896 0.4526 -0.0142 -0.0013 0.0076 169 ARG A CG 1131 C CD . ARG A 148 ? 0.3933 0.1777 0.3465 -0.0139 -0.0065 0.0029 169 ARG A CD 1132 N NE . ARG A 148 ? 0.4369 0.2054 0.3825 -0.0151 -0.0023 0.0018 169 ARG A NE 1133 C CZ . ARG A 148 ? 0.4491 0.2111 0.3834 -0.0100 0.0026 0.0047 169 ARG A CZ 1134 N NH1 . ARG A 148 ? 0.4226 0.1944 0.3535 -0.0047 0.0035 0.0082 169 ARG A NH1 1135 N NH2 . ARG A 148 ? 0.3989 0.1434 0.3258 -0.0103 0.0077 0.0039 169 ARG A NH2 1136 N N . ARG A 149 ? 0.4173 0.2167 0.3858 -0.0152 0.0183 0.0189 170 ARG A N 1137 C CA . ARG A 149 ? 0.4887 0.2868 0.4504 -0.0096 0.0228 0.0239 170 ARG A CA 1138 C C . ARG A 149 ? 0.5548 0.3535 0.5180 -0.0090 0.0280 0.0285 170 ARG A C 1139 O O . ARG A 149 ? 0.5614 0.3483 0.5251 -0.0116 0.0340 0.0300 170 ARG A O 1140 C CB . ARG A 149 ? 0.5487 0.3292 0.5011 -0.0066 0.0272 0.0251 170 ARG A CB 1141 C CG . ARG A 149 ? 0.5863 0.3621 0.5331 -0.0061 0.0231 0.0210 170 ARG A CG 1142 C CD . ARG A 149 ? 0.5561 0.3162 0.5022 -0.0120 0.0223 0.0158 170 ARG A CD 1143 N NE . ARG A 149 ? 0.6301 0.3679 0.5646 -0.0098 0.0276 0.0155 170 ARG A NE 1144 C CZ . ARG A 149 ? 0.7199 0.4387 0.6516 -0.0157 0.0283 0.0098 170 ARG A CZ 1145 N NH1 . ARG A 149 ? 0.5819 0.3046 0.5241 -0.0244 0.0234 0.0040 170 ARG A NH1 1146 N NH2 . ARG A 149 ? 0.8838 0.5792 0.8025 -0.0131 0.0343 0.0092 170 ARG A NH2 1147 N N . PHE A 150 ? 0.5064 0.3167 0.4692 -0.0060 0.0264 0.0308 171 PHE A N 1148 C CA . PHE A 150 ? 0.4317 0.2425 0.3932 -0.0047 0.0303 0.0351 171 PHE A CA 1149 C C . PHE A 150 ? 0.5010 0.3138 0.4559 0.0025 0.0310 0.0405 171 PHE A C 1150 O O . PHE A 150 ? 0.5451 0.3673 0.5015 0.0037 0.0261 0.0393 171 PHE A O 1151 C CB . PHE A 150 ? 0.4486 0.2710 0.4158 -0.0085 0.0268 0.0322 171 PHE A CB 1152 C CG . PHE A 150 ? 0.4843 0.3066 0.4472 -0.0068 0.0301 0.0364 171 PHE A CG 1153 C CD1 . PHE A 150 ? 0.4093 0.2240 0.3726 -0.0085 0.0369 0.0389 171 PHE A CD1 1154 C CD2 . PHE A 150 ? 0.4590 0.2880 0.4174 -0.0042 0.0267 0.0379 171 PHE A CD2 1155 C CE1 . PHE A 150 ? 0.4762 0.2894 0.4326 -0.0060 0.0408 0.0435 171 PHE A CE1 1156 C CE2 . PHE A 150 ? 0.5603 0.3880 0.5117 -0.0023 0.0290 0.0421 171 PHE A CE2 1157 C CZ . PHE A 150 ? 0.4386 0.2585 0.3879 -0.0024 0.0362 0.0450 171 PHE A CZ 1158 N N . VAL A 151 ? 0.5098 0.3131 0.4576 0.0078 0.0377 0.0472 172 VAL A N 1159 C CA . VAL A 151 ? 0.4688 0.2771 0.4102 0.0168 0.0382 0.0537 172 VAL A CA 1160 C C . VAL A 151 ? 0.5536 0.3677 0.4908 0.0185 0.0382 0.0572 172 VAL A C 1161 O O . VAL A 151 ? 0.4824 0.2867 0.4146 0.0193 0.0452 0.0606 172 VAL A O 1162 C CB . VAL A 151 ? 0.4589 0.2532 0.3914 0.0256 0.0469 0.0604 172 VAL A CB 1163 C CG1 . VAL A 151 ? 0.4786 0.2842 0.4051 0.0374 0.0470 0.0674 172 VAL A CG1 1164 C CG2 . VAL A 151 ? 0.4993 0.2849 0.4327 0.0251 0.0477 0.0574 172 VAL A CG2 1165 N N . SER A 152 ? 0.5411 0.3695 0.4794 0.0189 0.0309 0.0565 173 SER A N 1166 C CA . SER A 152 ? 0.5806 0.4146 0.5121 0.0207 0.0297 0.0592 173 SER A CA 1167 C C . SER A 152 ? 0.6750 0.5140 0.5958 0.0334 0.0337 0.0668 173 SER A C 1168 O O . SER A 152 ? 0.6440 0.4926 0.5653 0.0410 0.0326 0.0691 173 SER A O 1169 C CB . SER A 152 ? 0.5813 0.4269 0.5164 0.0158 0.0205 0.0554 173 SER A CB 1170 O OG . SER A 152 ? 0.6004 0.4520 0.5263 0.0174 0.0189 0.0570 173 SER A OG 1171 N N . GLN A 153 ? 0.6556 0.4901 0.5667 0.0366 0.0393 0.0701 174 GLN A N 1172 C CA . GLN A 153 ? 0.5848 0.4264 0.4845 0.0503 0.0445 0.0758 174 GLN A CA 1173 C C . GLN A 153 ? 0.5968 0.4699 0.4969 0.0533 0.0368 0.0678 174 GLN A C 1174 O O . GLN A 153 ? 0.7506 0.6422 0.6480 0.0647 0.0398 0.0660 174 GLN A O 1175 C CB . GLN A 153 ? 0.5423 0.3649 0.4324 0.0532 0.0572 0.0813 174 GLN A CB 1176 C CG . GLN A 153 ? 0.5205 0.3189 0.4132 0.0504 0.0669 0.0842 174 GLN A CG 1177 C CD . GLN A 153 ? 0.6724 0.4693 0.5626 0.0600 0.0697 0.0878 174 GLN A CD 1178 O OE1 . GLN A 153 ? 0.6736 0.4837 0.5560 0.0735 0.0712 0.0917 174 GLN A OE1 1179 N NE2 . GLN A 153 ? 0.7203 0.5032 0.6173 0.0536 0.0710 0.0854 174 GLN A NE2 1180 N N . GLU A 154 ? 0.5624 0.4429 0.4684 0.0424 0.0282 0.0600 175 GLU A N 1181 C CA . GLU A 154 ? 0.6315 0.5420 0.5434 0.0414 0.0202 0.0479 175 GLU A CA 1182 C C . GLU A 154 ? 0.7194 0.6518 0.6457 0.0405 0.0145 0.0427 175 GLU A C 1183 O O . GLU A 154 ? 0.7288 0.6762 0.6505 0.0499 0.0100 0.0495 175 GLU A O 1184 C CB . GLU A 154 ? 0.6573 0.5629 0.5680 0.0296 0.0146 0.0418 175 GLU A CB 1185 C CG . GLU A 154 ? 0.9241 0.8070 0.8237 0.0279 0.0221 0.0470 175 GLU A CG 1186 C CD . GLU A 154 ? 1.1628 1.0522 1.0534 0.0377 0.0276 0.0456 175 GLU A CD 1187 O OE1 . GLU A 154 ? 1.1764 1.0747 1.0564 0.0413 0.0208 0.0479 175 GLU A OE1 1188 O OE2 . GLU A 154 ? 1.2648 1.1370 1.1474 0.0431 0.0383 0.0549 175 GLU A OE2 1189 N N . THR A 155 ? 0.5900 0.5101 0.5211 0.0341 0.0116 0.0466 176 THR A N 1190 C CA . THR A 155 ? 0.5194 0.4596 0.4647 0.0321 0.0070 0.0420 176 THR A CA 1191 C C . THR A 155 ? 0.5507 0.4853 0.4977 0.0399 0.0123 0.0498 176 THR A C 1192 O O . THR A 155 ? 0.5733 0.5305 0.5312 0.0417 0.0121 0.0460 176 THR A O 1193 C CB . THR A 155 ? 0.6183 0.5523 0.5697 0.0195 0.0000 0.0386 176 THR A CB 1194 O OG1 . THR A 155 ? 0.6320 0.5327 0.5793 0.0164 0.0037 0.0460 176 THR A OG1 1195 C CG2 . THR A 155 ? 0.5140 0.4544 0.4625 0.0118 -0.0049 0.0300 176 THR A CG2 1196 N N . GLY A 156 ? 0.6503 0.5535 0.5875 0.0434 0.0185 0.0597 177 GLY A N 1197 C CA . GLY A 156 ? 0.5374 0.4277 0.4741 0.0505 0.0243 0.0668 177 GLY A CA 1198 C C . GLY A 156 ? 0.5499 0.4262 0.4947 0.0428 0.0214 0.0659 177 GLY A C 1199 O O . GLY A 156 ? 0.5514 0.4189 0.4967 0.0463 0.0267 0.0671 177 GLY A O 1200 N N . ASN A 157 ? 0.4215 0.2996 0.3728 0.0321 0.0147 0.0604 178 ASN A N 1201 C CA . ASN A 157 ? 0.3926 0.2607 0.3516 0.0247 0.0138 0.0566 178 ASN A CA 1202 C C . ASN A 157 ? 0.4813 0.3325 0.4378 0.0214 0.0193 0.0529 178 ASN A C 1203 O O . ASN A 157 ? 0.4705 0.3135 0.4215 0.0200 0.0222 0.0528 178 ASN A O 1204 C CB . ASN A 157 ? 0.4008 0.2706 0.3649 0.0140 0.0080 0.0515 178 ASN A CB 1205 C CG . ASN A 157 ? 0.4706 0.3739 0.4422 0.0131 0.0025 0.0461 178 ASN A CG 1206 O OD1 . ASN A 157 ? 0.4975 0.4234 0.4745 0.0202 0.0028 0.0465 178 ASN A OD1 1207 N ND2 . ASN A 157 ? 0.4191 0.3263 0.3924 0.0033 -0.0017 0.0396 178 ASN A ND2 1208 N N . LEU A 158 ? 0.4378 0.2850 0.3978 0.0204 0.0208 0.0501 179 LEU A N 1209 C CA . LEU A 158 ? 0.4182 0.2529 0.3756 0.0165 0.0238 0.0455 179 LEU A CA 1210 C C . LEU A 158 ? 0.4827 0.3213 0.4453 0.0085 0.0197 0.0384 179 LEU A C 1211 O O . LEU A 158 ? 0.4326 0.2764 0.3995 0.0079 0.0182 0.0372 179 LEU A O 1212 C CB . LEU A 158 ? 0.4133 0.2381 0.3659 0.0225 0.0292 0.0474 179 LEU A CB 1213 C CG . LEU A 158 ? 0.4334 0.2452 0.3827 0.0179 0.0304 0.0421 179 LEU A CG 1214 C CD1 . LEU A 158 ? 0.4413 0.2407 0.3869 0.0150 0.0335 0.0419 179 LEU A CD1 1215 C CD2 . LEU A 158 ? 0.4504 0.2518 0.3934 0.0238 0.0350 0.0435 179 LEU A CD2 1216 N N . TYR A 159 ? 0.4373 0.2735 0.3998 0.0034 0.0189 0.0344 180 TYR A N 1217 C CA . TYR A 159 ? 0.3661 0.2067 0.3319 -0.0019 0.0157 0.0288 180 TYR A CA 1218 C C . TYR A 159 ? 0.4285 0.2618 0.3921 -0.0026 0.0159 0.0259 180 TYR A C 1219 O O . TYR A 159 ? 0.3669 0.1923 0.3291 -0.0032 0.0178 0.0264 180 TYR A O 1220 C CB . TYR A 159 ? 0.4242 0.2690 0.3920 -0.0058 0.0143 0.0271 180 TYR A CB 1221 C CG . TYR A 159 ? 0.4397 0.2885 0.4071 -0.0060 0.0131 0.0293 180 TYR A CG 1222 C CD1 . TYR A 159 ? 0.4422 0.2890 0.4055 -0.0021 0.0142 0.0349 180 TYR A CD1 1223 C CD2 . TYR A 159 ? 0.4512 0.3041 0.4212 -0.0099 0.0111 0.0261 180 TYR A CD2 1224 C CE1 . TYR A 159 ? 0.4615 0.3120 0.4231 -0.0021 0.0115 0.0377 180 TYR A CE1 1225 C CE2 . TYR A 159 ? 0.4780 0.3322 0.4477 -0.0120 0.0092 0.0274 180 TYR A CE2 1226 C CZ . TYR A 159 ? 0.4763 0.3298 0.4418 -0.0081 0.0084 0.0335 180 TYR A CZ 1227 O OH . TYR A 159 ? 0.5037 0.3585 0.4674 -0.0107 0.0050 0.0357 180 TYR A OH 1228 N N . ILE A 160 ? 0.3572 0.1914 0.3198 -0.0027 0.0144 0.0233 181 ILE A N 1229 C CA . ILE A 160 ? 0.3906 0.2173 0.3494 -0.0034 0.0127 0.0205 181 ILE A CA 1230 C C . ILE A 160 ? 0.4365 0.2682 0.3972 -0.0055 0.0096 0.0176 181 ILE A C 1231 O O . ILE A 160 ? 0.4352 0.2691 0.3942 -0.0045 0.0104 0.0173 181 ILE A O 1232 C CB . ILE A 160 ? 0.3317 0.1502 0.2830 0.0003 0.0146 0.0208 181 ILE A CB 1233 C CG1 . ILE A 160 ? 0.3463 0.1578 0.2948 0.0043 0.0192 0.0245 181 ILE A CG1 1234 C CG2 . ILE A 160 ? 0.3550 0.1627 0.2996 -0.0004 0.0116 0.0175 181 ILE A CG2 1235 C CD1 . ILE A 160 ? 0.4634 0.2681 0.4053 0.0094 0.0227 0.0257 181 ILE A CD1 1236 N N . ALA A 161 ? 0.4280 0.2601 0.3928 -0.0080 0.0072 0.0161 182 ALA A N 1237 C CA . ALA A 161 ? 0.3778 0.2132 0.3448 -0.0086 0.0048 0.0144 182 ALA A CA 1238 C C . ALA A 161 ? 0.3704 0.1993 0.3296 -0.0057 0.0030 0.0133 182 ALA A C 1239 O O . ALA A 161 ? 0.3874 0.2166 0.3443 -0.0043 0.0039 0.0132 182 ALA A O 1240 C CB . ALA A 161 ? 0.3515 0.1869 0.3259 -0.0111 0.0025 0.0131 182 ALA A CB 1241 N N . LYS A 162 ? 0.4621 0.2818 0.4150 -0.0045 0.0014 0.0127 183 LYS A N 1242 C CA . LYS A 162 ? 0.4087 0.2187 0.3511 -0.0009 -0.0007 0.0116 183 LYS A CA 1243 C C . LYS A 162 ? 0.3821 0.1809 0.3147 0.0011 0.0004 0.0113 183 LYS A C 1244 O O . LYS A 162 ? 0.4277 0.2185 0.3599 -0.0007 -0.0019 0.0093 183 LYS A O 1245 C CB . LYS A 162 ? 0.3863 0.1923 0.3305 -0.0008 -0.0076 0.0091 183 LYS A CB 1246 C CG . LYS A 162 ? 0.4848 0.2768 0.4152 0.0044 -0.0118 0.0075 183 LYS A CG 1247 C CD . LYS A 162 ? 0.5670 0.3539 0.5017 0.0046 -0.0207 0.0036 183 LYS A CD 1248 C CE . LYS A 162 ? 0.5910 0.3620 0.5096 0.0119 -0.0266 0.0010 183 LYS A CE 1249 N NZ . LYS A 162 ? 0.7633 0.5322 0.6874 0.0155 -0.0356 -0.0026 183 LYS A NZ 1250 N N . VAL A 163 ? 0.3967 0.1926 0.3216 0.0048 0.0052 0.0132 184 VAL A N 1251 C CA . VAL A 163 ? 0.4803 0.2645 0.3954 0.0078 0.0080 0.0133 184 VAL A CA 1252 C C . VAL A 163 ? 0.5263 0.2940 0.4280 0.0103 0.0026 0.0100 184 VAL A C 1253 O O . VAL A 163 ? 0.5023 0.2668 0.3978 0.0131 -0.0008 0.0093 184 VAL A O 1254 C CB . VAL A 163 ? 0.4372 0.2225 0.3493 0.0115 0.0158 0.0165 184 VAL A CB 1255 C CG1 . VAL A 163 ? 0.3724 0.1441 0.2737 0.0162 0.0198 0.0171 184 VAL A CG1 1256 C CG2 . VAL A 163 ? 0.4152 0.2153 0.3416 0.0088 0.0190 0.0188 184 VAL A CG2 1257 N N . GLU A 164 ? 0.5045 0.2593 0.4008 0.0099 0.0019 0.0076 185 GLU A N 1258 C CA . GLU A 164 ? 0.5257 0.2615 0.4083 0.0117 -0.0040 0.0025 185 GLU A CA 1259 C C . GLU A 164 ? 0.5914 0.3094 0.4576 0.0167 0.0016 0.0023 185 GLU A C 1260 O O . GLU A 164 ? 0.5444 0.2656 0.4128 0.0184 0.0100 0.0064 185 GLU A O 1261 C CB . GLU A 164 ? 0.6553 0.3879 0.5472 0.0046 -0.0103 -0.0031 185 GLU A CB 1262 C CG . GLU A 164 ? 0.7646 0.5155 0.6749 -0.0001 -0.0133 -0.0019 185 GLU A CG 1263 C CD . GLU A 164 ? 0.9428 0.6906 0.8609 -0.0052 -0.0221 -0.0092 185 GLU A CD 1264 O OE1 . GLU A 164 ? 1.1422 0.8786 1.0603 -0.0107 -0.0231 -0.0154 185 GLU A OE1 1265 O OE2 . GLU A 164 ? 0.8695 0.6258 0.7946 -0.0040 -0.0275 -0.0095 185 GLU A OE2 1266 N N . LYS A 165 ? 0.5314 0.2297 0.3805 0.0204 -0.0031 -0.0031 186 LYS A N 1267 C CA . LYS A 165 ? 0.5530 0.2323 0.3836 0.0266 0.0033 -0.0034 186 LYS A CA 1268 C C . LYS A 165 ? 0.6103 0.2804 0.4433 0.0236 0.0092 -0.0042 186 LYS A C 1269 O O . LYS A 165 ? 0.7458 0.4042 0.5678 0.0297 0.0178 -0.0019 186 LYS A O 1270 C CB . LYS A 165 ? 0.7933 0.4511 0.6019 0.0322 -0.0035 -0.0108 186 LYS A CB 1271 C CG . LYS A 165 ? 0.9522 0.6077 0.7652 0.0265 -0.0166 -0.0209 186 LYS A CG 1272 C CD . LYS A 165 ? 0.9929 0.6535 0.8245 0.0147 -0.0166 -0.0241 186 LYS A CD 1273 C CE . LYS A 165 ? 0.9178 0.5646 0.7447 0.0079 -0.0244 -0.0385 186 LYS A CE 1274 N NZ . LYS A 165 ? 0.6774 0.3216 0.5171 -0.0027 -0.0187 -0.0401 186 LYS A NZ 1275 N N . SER A 166 ? 0.5680 0.2427 0.4153 0.0151 0.0062 -0.0068 187 SER A N 1276 C CA . SER A 166 ? 0.5138 0.1771 0.3629 0.0124 0.0134 -0.0068 187 SER A CA 1277 C C . SER A 166 ? 0.5130 0.1902 0.3716 0.0161 0.0227 0.0026 187 SER A C 1278 O O . SER A 166 ? 0.4724 0.1383 0.3304 0.0166 0.0300 0.0044 187 SER A O 1279 C CB . SER A 166 ? 0.5044 0.1672 0.3659 0.0014 0.0087 -0.0127 187 SER A CB 1280 O OG . SER A 166 ? 0.5603 0.2483 0.4398 -0.0021 0.0037 -0.0096 187 SER A OG 1281 N N . ASP A 167 ? 0.4359 0.1354 0.3028 0.0187 0.0227 0.0079 188 ASP A N 1282 C CA . ASP A 167 ? 0.5424 0.2583 0.4218 0.0207 0.0288 0.0147 188 ASP A CA 1283 C C . ASP A 167 ? 0.5075 0.2232 0.3824 0.0296 0.0376 0.0199 188 ASP A C 1284 O O . ASP A 167 ? 0.4988 0.2305 0.3856 0.0318 0.0411 0.0251 188 ASP A O 1285 C CB . ASP A 167 ? 0.4880 0.2292 0.3830 0.0166 0.0241 0.0162 188 ASP A CB 1286 C CG . ASP A 167 ? 0.5507 0.2957 0.4539 0.0089 0.0173 0.0127 188 ASP A CG 1287 O OD1 . ASP A 167 ? 0.6110 0.3436 0.5139 0.0055 0.0182 0.0108 188 ASP A OD1 1288 O OD2 . ASP A 167 ? 0.4505 0.2095 0.3608 0.0064 0.0122 0.0119 188 ASP A OD2 1289 N N . VAL A 168 ? 0.5378 0.2351 0.3960 0.0354 0.0411 0.0185 189 VAL A N 1290 C CA . VAL A 168 ? 0.4398 0.1389 0.2954 0.0445 0.0505 0.0238 189 VAL A CA 1291 C C . VAL A 168 ? 0.5801 0.2683 0.4328 0.0516 0.0594 0.0280 189 VAL A C 1292 O O . VAL A 168 ? 0.6366 0.2993 0.4753 0.0525 0.0615 0.0248 189 VAL A O 1293 C CB . VAL A 168 ? 0.5058 0.1891 0.3424 0.0497 0.0524 0.0215 189 VAL A CB 1294 C CG1 . VAL A 168 ? 0.3789 0.0581 0.2106 0.0605 0.0646 0.0271 189 VAL A CG1 1295 C CG2 . VAL A 168 ? 0.4340 0.1298 0.2736 0.0464 0.0474 0.0207 189 VAL A CG2 1296 N N . GLY A 169 ? 0.5693 0.2756 0.4352 0.0570 0.0648 0.0351 190 GLY A N 1297 C CA . GLY A 169 ? 0.5686 0.2679 0.4321 0.0666 0.0739 0.0410 190 GLY A CA 1298 C C . GLY A 169 ? 0.5762 0.3021 0.4589 0.0699 0.0750 0.0483 190 GLY A C 1299 O O . GLY A 169 ? 0.4884 0.2371 0.3859 0.0676 0.0722 0.0497 190 GLY A O 1300 N N . ASN A 170 ? 0.5094 0.2309 0.3910 0.0757 0.0793 0.0530 191 ASN A N 1301 C CA . ASN A 170 ? 0.6039 0.3503 0.5005 0.0815 0.0804 0.0606 191 ASN A CA 1302 C C . ASN A 170 ? 0.6532 0.4033 0.5544 0.0767 0.0757 0.0612 191 ASN A C 1303 O O . ASN A 170 ? 0.5275 0.2546 0.4171 0.0757 0.0786 0.0602 191 ASN A O 1304 C CB . ASN A 170 ? 0.6751 0.4188 0.5656 0.0973 0.0918 0.0686 191 ASN A CB 1305 C CG . ASN A 170 ? 0.8185 0.5672 0.7096 0.1033 0.0973 0.0700 191 ASN A CG 1306 O OD1 . ASN A 170 ? 0.7514 0.5283 0.6600 0.1045 0.0962 0.0736 191 ASN A OD1 1307 N ND2 . ASN A 170 ? 1.0730 0.7929 0.9445 0.1065 0.1034 0.0669 191 ASN A ND2 1308 N N . TYR A 171 ? 0.6107 0.3880 0.5283 0.0735 0.0693 0.0629 192 TYR A N 1309 C CA . TYR A 171 ? 0.5936 0.3765 0.5150 0.0695 0.0649 0.0637 192 TYR A CA 1310 C C . TYR A 171 ? 0.6165 0.4208 0.5443 0.0797 0.0669 0.0718 192 TYR A C 1311 O O . TYR A 171 ? 0.6194 0.4491 0.5603 0.0819 0.0641 0.0740 192 TYR A O 1312 C CB . TYR A 171 ? 0.4932 0.2886 0.4254 0.0566 0.0547 0.0577 192 TYR A CB 1313 C CG . TYR A 171 ? 0.5136 0.2941 0.4397 0.0468 0.0514 0.0495 192 TYR A CG 1314 C CD1 . TYR A 171 ? 0.4966 0.2737 0.4197 0.0458 0.0516 0.0460 192 TYR A CD1 1315 C CD2 . TYR A 171 ? 0.4634 0.2350 0.3868 0.0393 0.0482 0.0458 192 TYR A CD2 1316 C CE1 . TYR A 171 ? 0.5043 0.2702 0.4201 0.0385 0.0477 0.0390 192 TYR A CE1 1317 C CE2 . TYR A 171 ? 0.5265 0.2892 0.4459 0.0312 0.0441 0.0387 192 TYR A CE2 1318 C CZ . TYR A 171 ? 0.5788 0.3389 0.4936 0.0313 0.0432 0.0354 192 TYR A CZ 1319 O OH . TYR A 171 ? 0.5471 0.2994 0.4566 0.0250 0.0382 0.0290 192 TYR A OH 1320 N N . THR A 172 ? 0.5780 0.3729 0.4965 0.0858 0.0718 0.0763 193 THR A N 1321 C CA . THR A 172 ? 0.6353 0.4527 0.5564 0.0970 0.0743 0.0838 193 THR A CA 1322 C C . THR A 172 ? 0.6527 0.4737 0.5731 0.0938 0.0707 0.0844 193 THR A C 1323 O O . THR A 172 ? 0.5732 0.3685 0.4826 0.0918 0.0751 0.0847 193 THR A O 1324 C CB . THR A 172 ? 0.6385 0.4422 0.5447 0.1127 0.0877 0.0912 193 THR A CB 1325 O OG1 . THR A 172 ? 0.6581 0.4573 0.5631 0.1172 0.0926 0.0911 193 THR A OG1 1326 C CG2 . THR A 172 ? 0.6063 0.4392 0.5142 0.1249 0.0908 0.0980 193 THR A CG2 1327 N N . CYS A 173 ? 0.6835 0.5358 0.6150 0.0932 0.0634 0.0846 194 CYS A N 1328 C CA . CYS A 173 ? 0.6625 0.5208 0.5907 0.0931 0.0614 0.0857 194 CYS A CA 1329 C C . CYS A 173 ? 0.6485 0.5112 0.5650 0.1089 0.0718 0.0930 194 CYS A C 1330 O O . CYS A 173 ? 0.7385 0.6254 0.6577 0.1186 0.0754 0.0955 194 CYS A O 1331 C CB . CYS A 173 ? 0.6586 0.5479 0.6008 0.0861 0.0499 0.0816 194 CYS A CB 1332 S SG . CYS A 173 ? 0.8348 0.7274 0.7715 0.0832 0.0461 0.0808 194 CYS A SG 1333 N N . VAL A 174 ? 0.6128 0.4522 0.5159 0.1116 0.0784 0.0965 195 VAL A N 1334 C CA . VAL A 174 ? 0.7187 0.5610 0.6086 0.1277 0.0893 0.1039 195 VAL A CA 1335 C C . VAL A 174 ? 0.7438 0.6031 0.6332 0.1274 0.0858 0.1028 195 VAL A C 1336 O O . VAL A 174 ? 0.6631 0.5016 0.5479 0.1203 0.0854 0.1028 195 VAL A O 1337 C CB . VAL A 174 ? 0.7318 0.5303 0.6032 0.1347 0.1040 0.1109 195 VAL A CB 1338 C CG1 . VAL A 174 ? 0.8532 0.6189 0.7249 0.1187 0.1018 0.1062 195 VAL A CG1 1339 C CG2 . VAL A 174 ? 0.7357 0.5298 0.5917 0.1487 0.1154 0.1188 195 VAL A CG2 1340 N N . VAL A 175 ? 0.7697 0.6686 0.6643 0.1340 0.0839 0.1003 196 VAL A N 1341 C CA . VAL A 175 ? 0.7101 0.6304 0.6052 0.1335 0.0810 0.0956 196 VAL A CA 1342 C C . VAL A 175 ? 0.6968 0.6106 0.5737 0.1514 0.0950 0.1030 196 VAL A C 1343 O O . VAL A 175 ? 0.8507 0.7682 0.7196 0.1657 0.1062 0.1084 196 VAL A O 1344 C CB . VAL A 175 ? 0.6406 0.6098 0.5527 0.1275 0.0743 0.0837 196 VAL A CB 1345 C CG1 . VAL A 175 ? 0.5885 0.5637 0.4970 0.1302 0.0649 0.0868 196 VAL A CG1 1346 C CG2 . VAL A 175 ? 0.6559 0.6324 0.5855 0.1108 0.0644 0.0762 196 VAL A CG2 1347 N N . THR A 176 ? 0.7306 0.6342 0.6000 0.1512 0.0960 0.1036 197 THR A N 1348 C CA . THR A 176 ? 0.7563 0.6523 0.6075 0.1689 0.1107 0.1105 197 THR A CA 1349 C C . THR A 176 ? 0.7619 0.6784 0.6109 0.1748 0.1053 0.1102 197 THR A C 1350 O O . THR A 176 ? 0.6956 0.6106 0.5502 0.1621 0.0956 0.1050 197 THR A O 1351 C CB . THR A 176 ? 0.7505 0.5941 0.5852 0.1692 0.1214 0.1214 197 THR A CB 1352 O OG1 . THR A 176 ? 0.7114 0.5276 0.5413 0.1710 0.1286 0.1275 197 THR A OG1 1353 C CG2 . THR A 176 ? 0.6236 0.4570 0.4385 0.1867 0.1369 0.1290 197 THR A CG2 1354 N N . ASN A 177 ? 0.7615 0.6897 0.5959 0.1990 0.1088 0.1235 198 ASN A N 1355 C CA . ASN A 177 ? 0.7577 0.6950 0.5786 0.2128 0.1026 0.1329 198 ASN A CA 1356 C C . ASN A 177 ? 0.9026 0.8076 0.7053 0.2201 0.1200 0.1375 198 ASN A C 1357 O O . ASN A 177 ? 0.9057 0.7955 0.6947 0.2353 0.1380 0.1439 198 ASN A O 1358 C CB . ASN A 177 ? 0.8936 0.8629 0.7057 0.2373 0.0982 0.1448 198 ASN A CB 1359 C CG . ASN A 177 ? 0.9435 0.9338 0.7432 0.2496 0.0854 0.1524 198 ASN A CG 1360 O OD1 . ASN A 177 ? 0.8642 0.8368 0.6431 0.2622 0.0938 0.1608 198 ASN A OD1 1361 N ND2 . ASN A 177 ? 0.9445 0.9737 0.7558 0.2452 0.0654 0.1486 198 ASN A ND2 1362 N N . THR A 178 ? 0.9271 0.8209 0.7296 0.2089 0.1159 0.1338 199 THR A N 1363 C CA . THR A 178 ? 1.0102 0.8729 0.8005 0.2106 0.1334 0.1348 199 THR A CA 1364 C C . THR A 178 ? 1.0694 0.9267 0.8326 0.2390 0.1442 0.1515 199 THR A C 1365 O O . THR A 178 ? 1.0312 0.8611 0.7823 0.2457 0.1647 0.1542 199 THR A O 1366 C CB . THR A 178 ? 1.0138 0.8683 0.8118 0.1912 0.1268 0.1263 199 THR A CB 1367 O OG1 . THR A 178 ? 1.0155 0.8903 0.8082 0.1949 0.1094 0.1319 199 THR A OG1 1368 C CG2 . THR A 178 ? 0.9312 0.7831 0.7510 0.1659 0.1198 0.1129 199 THR A CG2 1369 N N . VAL A 179 ? 1.1425 1.0284 0.8960 0.2562 0.1307 0.1621 200 VAL A N 1370 C CA . VAL A 179 ? 1.1092 0.9959 0.8341 0.2863 0.1382 0.1792 200 VAL A CA 1371 C C . VAL A 179 ? 1.0975 0.9885 0.8118 0.3103 0.1508 0.1888 200 VAL A C 1372 O O . VAL A 179 ? 1.1576 1.0295 0.8485 0.3324 0.1693 0.2006 200 VAL A O 1373 C CB . VAL A 179 ? 1.3056 1.2252 1.0197 0.2951 0.1165 0.1857 200 VAL A CB 1374 C CG1 . VAL A 179 ? 1.2773 1.2293 1.0155 0.2755 0.0931 0.1738 200 VAL A CG1 1375 C CG2 . VAL A 179 ? 1.3434 1.2848 1.0328 0.3298 0.1174 0.2023 200 VAL A CG2 1376 N N . THR A 180 ? 1.1192 1.0338 0.8500 0.3065 0.1427 0.1841 201 THR A N 1377 C CA . THR A 180 ? 1.2063 1.1247 0.9280 0.3278 0.1561 0.1923 201 THR A CA 1378 C C . THR A 180 ? 1.2412 1.1282 0.9700 0.3144 0.1751 0.1832 201 THR A C 1379 O O . THR A 180 ? 1.2964 1.1730 1.0117 0.3315 0.1931 0.1900 201 THR A O 1380 C CB . THR A 180 ? 1.1821 1.1481 0.9152 0.3347 0.1386 0.1935 201 THR A CB 1381 O OG1 . THR A 180 ? 1.0973 1.0656 0.8561 0.3102 0.1342 0.1798 201 THR A OG1 1382 C CG2 . THR A 180 ? 1.1601 1.1639 0.8945 0.3362 0.1139 0.1945 201 THR A CG2 1383 N N . ASN A 181 ? 1.2315 1.1055 0.9800 0.2843 0.1705 0.1676 202 ASN A N 1384 C CA . ASN A 181 ? 1.2641 1.1147 1.0204 0.2677 0.1853 0.1550 202 ASN A CA 1385 C C . ASN A 181 ? 1.1919 1.0568 0.9569 0.2663 0.1845 0.1522 202 ASN A C 1386 O O . ASN A 181 ? 1.1102 0.9411 0.8684 0.2638 0.1940 0.1570 202 ASN A O 1387 C CB . ASN A 181 ? 1.2890 1.0993 1.0216 0.2809 0.2106 0.1637 202 ASN A CB 1388 C CG . ASN A 181 ? 1.3128 1.0644 1.0391 0.2669 0.2151 0.1734 202 ASN A CG 1389 O OD1 . ASN A 181 ? 1.1797 0.9298 0.9237 0.2450 0.2001 0.1667 202 ASN A OD1 1390 N ND2 . ASN A 181 ? 1.3735 1.0756 1.0755 0.2787 0.2373 0.1883 202 ASN A ND2 1391 N N . HIS A 182 ? 1.1458 1.0448 0.9175 0.2746 0.1680 0.1585 203 HIS A N 1392 C CA . HIS A 182 ? 1.0464 0.9627 0.8288 0.2720 0.1659 0.1558 203 HIS A CA 1393 C C . HIS A 182 ? 1.0854 1.0048 0.8926 0.2415 0.1522 0.1401 203 HIS A C 1394 O O . HIS A 182 ? 1.0857 1.0112 0.9046 0.2272 0.1371 0.1342 203 HIS A O 1395 C CB . HIS A 182 ? 0.9486 0.9070 0.7311 0.2919 0.1546 0.1663 203 HIS A CB 1396 C CG . HIS A 182 ? 1.1266 1.0868 0.8835 0.3255 0.1683 0.1828 203 HIS A CG 1397 N ND1 . HIS A 182 ? 1.2298 1.2166 0.9814 0.3462 0.1714 0.1919 203 HIS A ND1 1398 C CD2 . HIS A 182 ? 1.1418 1.0805 0.8759 0.3429 0.1808 0.1922 203 HIS A CD2 1399 C CE1 . HIS A 182 ? 1.2472 1.2294 0.9731 0.3763 0.1848 0.2065 203 HIS A CE1 1400 N NE2 . HIS A 182 ? 1.1858 1.1375 0.9002 0.3749 0.1910 0.2071 203 HIS A NE2 1401 N N . LYS A 183 ? 1.0533 0.9682 0.8662 0.2323 0.1584 0.1335 204 LYS A N 1402 C CA . LYS A 183 ? 0.9788 0.8883 0.8098 0.2108 0.1432 0.1271 204 LYS A CA 1403 C C . LYS A 183 ? 0.8591 0.8004 0.7026 0.2081 0.1401 0.1225 204 LYS A C 1404 O O . LYS A 183 ? 0.8726 0.8178 0.7067 0.2237 0.1483 0.1312 204 LYS A O 1405 C CB . LYS A 183 ? 0.9885 0.8402 0.8094 0.2066 0.1474 0.1356 204 LYS A CB 1406 C CG . LYS A 183 ? 1.0270 0.8606 0.8438 0.2116 0.1542 0.1406 204 LYS A CG 1407 C CD . LYS A 183 ? 1.1406 0.9134 0.9370 0.2169 0.1692 0.1507 204 LYS A CD 1408 C CE . LYS A 183 ? 1.2055 0.9445 1.0041 0.1987 0.1644 0.1479 204 LYS A CE 1409 N NZ . LYS A 183 ? 1.2242 0.9633 1.0157 0.2014 0.1678 0.1506 204 LYS A NZ 1410 N N . VAL A 184 ? 0.6391 0.5975 0.5035 0.1887 0.1248 0.1127 205 VAL A N 1411 C CA . VAL A 184 ? 0.6792 0.6569 0.5555 0.1848 0.1194 0.1124 205 VAL A CA 1412 C C . VAL A 184 ? 0.7384 0.6966 0.6263 0.1680 0.1111 0.1076 205 VAL A C 1413 O O . VAL A 184 ? 0.7353 0.6792 0.6292 0.1563 0.1004 0.1041 205 VAL A O 1414 C CB . VAL A 184 ? 0.7392 0.7574 0.6260 0.1903 0.1066 0.1164 205 VAL A CB 1415 C CG1 . VAL A 184 ? 0.7961 0.8310 0.6673 0.2179 0.1115 0.1301 205 VAL A CG1 1416 C CG2 . VAL A 184 ? 0.6991 0.7227 0.5988 0.1750 0.0899 0.1090 205 VAL A CG2 1417 N N . LEU A 185 ? 0.8164 0.7688 0.7058 0.1700 0.1140 0.1112 206 LEU A N 1418 C CA . LEU A 185 ? 0.8159 0.7436 0.7146 0.1591 0.1050 0.1102 206 LEU A CA 1419 C C . LEU A 185 ? 0.7248 0.6891 0.6444 0.1437 0.0963 0.1005 206 LEU A C 1420 O O . LEU A 185 ? 0.8297 0.8266 0.7532 0.1437 0.1000 0.0989 206 LEU A O 1421 C CB . LEU A 185 ? 0.9267 0.8193 0.8123 0.1690 0.1163 0.1173 206 LEU A CB 1422 C CG . LEU A 185 ? 1.0466 0.8900 0.9115 0.1759 0.1266 0.1233 206 LEU A CG 1423 C CD1 . LEU A 185 ? 1.1653 0.9764 1.0177 0.1843 0.1381 0.1282 206 LEU A CD1 1424 C CD2 . LEU A 185 ? 1.0422 0.8612 0.9110 0.1593 0.1174 0.1176 206 LEU A CD2 1425 N N . GLY A 186 ? 0.6526 0.6066 0.5842 0.1294 0.0839 0.0950 207 GLY A N 1426 C CA . GLY A 186 ? 0.6040 0.5833 0.5540 0.1151 0.0768 0.0875 207 GLY A CA 1427 C C . GLY A 186 ? 0.6615 0.6268 0.6122 0.1191 0.0815 0.0918 207 GLY A C 1428 O O . GLY A 186 ? 0.6520 0.5831 0.5881 0.1318 0.0892 0.0993 207 GLY A O 1429 N N . PRO A 187 ? 0.6023 0.5907 0.5680 0.1077 0.0781 0.0869 208 PRO A N 1430 C CA . PRO A 187 ? 0.6692 0.6452 0.6371 0.1103 0.0825 0.0900 208 PRO A CA 1431 C C . PRO A 187 ? 0.6705 0.6026 0.6355 0.1090 0.0773 0.0892 208 PRO A C 1432 O O . PRO A 187 ? 0.5378 0.4635 0.5082 0.0986 0.0674 0.0843 208 PRO A O 1433 C CB . PRO A 187 ? 0.6776 0.6881 0.6621 0.0941 0.0790 0.0850 208 PRO A CB 1434 C CG . PRO A 187 ? 0.7478 0.7789 0.7383 0.0837 0.0647 0.0778 208 PRO A CG 1435 C CD . PRO A 187 ? 0.6977 0.7179 0.6780 0.0899 0.0698 0.0781 208 PRO A CD 1436 N N . PRO A 188 ? 0.7316 0.6315 0.6846 0.1184 0.0851 0.0934 209 PRO A N 1437 C CA . PRO A 188 ? 0.6882 0.5523 0.6347 0.1107 0.0825 0.0882 209 PRO A CA 1438 C C . PRO A 188 ? 0.6465 0.5217 0.6095 0.1001 0.0753 0.0839 209 PRO A C 1439 O O . PRO A 188 ? 0.6698 0.5727 0.6452 0.0998 0.0787 0.0844 209 PRO A O 1440 C CB . PRO A 188 ? 0.7425 0.5828 0.6734 0.1207 0.0945 0.0907 209 PRO A CB 1441 C CG . PRO A 188 ? 0.8501 0.7021 0.7745 0.1357 0.1037 0.0990 209 PRO A CG 1442 C CD . PRO A 188 ? 0.8279 0.7267 0.7699 0.1330 0.0982 0.1003 209 PRO A CD 1443 N N . THR A 189 ? 0.5141 0.3750 0.4766 0.0877 0.0676 0.0773 210 THR A N 1444 C CA . THR A 189 ? 0.5761 0.4386 0.5490 0.0783 0.0636 0.0734 210 THR A CA 1445 C C . THR A 189 ? 0.5954 0.4288 0.5526 0.0744 0.0670 0.0675 210 THR A C 1446 O O . THR A 189 ? 0.6021 0.4181 0.5475 0.0690 0.0641 0.0627 210 THR A O 1447 C CB . THR A 189 ? 0.6553 0.5280 0.6393 0.0670 0.0530 0.0702 210 THR A CB 1448 O OG1 . THR A 189 ? 0.7147 0.5745 0.6992 0.0564 0.0513 0.0644 210 THR A OG1 1449 C CG2 . THR A 189 ? 0.8146 0.6803 0.7894 0.0645 0.0489 0.0684 210 THR A CG2 1450 N N . PRO A 190 ? 0.5591 0.3885 0.5158 0.0775 0.0733 0.0682 211 PRO A N 1451 C CA . PRO A 190 ? 0.5402 0.3448 0.4799 0.0749 0.0765 0.0626 211 PRO A CA 1452 C C . PRO A 190 ? 0.4900 0.2924 0.4314 0.0622 0.0697 0.0559 211 PRO A C 1453 O O . PRO A 190 ? 0.5488 0.3644 0.5050 0.0575 0.0684 0.0569 211 PRO A O 1454 C CB . PRO A 190 ? 0.5304 0.3371 0.4717 0.0840 0.0868 0.0674 211 PRO A CB 1455 C CG . PRO A 190 ? 0.6419 0.4745 0.5992 0.0932 0.0896 0.0758 211 PRO A CG 1456 C CD . PRO A 190 ? 0.5316 0.3824 0.5032 0.0857 0.0790 0.0752 211 PRO A CD 1457 N N . LEU A 191 ? 0.4075 0.1926 0.3335 0.0571 0.0658 0.0494 212 LEU A N 1458 C CA . LEU A 191 ? 0.4398 0.2229 0.3635 0.0476 0.0602 0.0434 212 LEU A CA 1459 C C . LEU A 191 ? 0.5235 0.2871 0.4279 0.0503 0.0638 0.0403 212 LEU A C 1460 O O . LEU A 191 ? 0.5411 0.2862 0.4293 0.0539 0.0645 0.0384 212 LEU A O 1461 C CB . LEU A 191 ? 0.4615 0.2440 0.3840 0.0402 0.0516 0.0388 212 LEU A CB 1462 C CG . LEU A 191 ? 0.4861 0.2706 0.4079 0.0317 0.0450 0.0334 212 LEU A CG 1463 C CD1 . LEU A 191 ? 0.4967 0.2960 0.4326 0.0285 0.0459 0.0351 212 LEU A CD1 1464 C CD2 . LEU A 191 ? 0.6351 0.4215 0.5588 0.0259 0.0378 0.0304 212 LEU A CD2 1465 N N . ILE A 192 ? 0.5368 0.3014 0.4412 0.0491 0.0666 0.0403 213 ILE A N 1466 C CA . ILE A 192 ? 0.5976 0.3430 0.4807 0.0519 0.0688 0.0376 213 ILE A CA 1467 C C . ILE A 192 ? 0.5834 0.3295 0.4637 0.0457 0.0639 0.0343 213 ILE A C 1468 O O . ILE A 192 ? 0.5313 0.2919 0.4273 0.0398 0.0629 0.0351 213 ILE A O 1469 C CB . ILE A 192 ? 0.6252 0.3638 0.5029 0.0609 0.0811 0.0425 213 ILE A CB 1470 C CG1 . ILE A 192 ? 0.6337 0.3887 0.5324 0.0583 0.0870 0.0473 213 ILE A CG1 1471 C CG2 . ILE A 192 ? 0.5855 0.3181 0.4592 0.0701 0.0872 0.0457 213 ILE A CG2 1472 C CD1 . ILE A 192 ? 0.6766 0.4226 0.5696 0.0654 0.1000 0.0521 213 ILE A CD1 1473 N N . LEU A 193 ? 0.4781 0.2065 0.3368 0.0481 0.0610 0.0309 214 LEU A N 1474 C CA . LEU A 193 ? 0.4352 0.1612 0.2870 0.0455 0.0567 0.0288 214 LEU A CA 1475 C C . LEU A 193 ? 0.4677 0.1871 0.3123 0.0504 0.0674 0.0328 214 LEU A C 1476 O O . LEU A 193 ? 0.5577 0.2645 0.3896 0.0582 0.0759 0.0354 214 LEU A O 1477 C CB . LEU A 193 ? 0.5302 0.2393 0.3621 0.0472 0.0473 0.0235 214 LEU A CB 1478 C CG . LEU A 193 ? 0.6160 0.3289 0.4563 0.0411 0.0380 0.0194 214 LEU A CG 1479 C CD1 . LEU A 193 ? 0.6654 0.3599 0.4890 0.0418 0.0284 0.0133 214 LEU A CD1 1480 C CD2 . LEU A 193 ? 0.4300 0.1642 0.2910 0.0333 0.0336 0.0197 214 LEU A CD2 1481 N N . ARG A 194 ? 0.4816 0.2072 0.3332 0.0462 0.0685 0.0338 215 ARG A N 1482 C CA . ARG A 194 ? 0.5904 0.3041 0.4309 0.0510 0.0792 0.0377 215 ARG A CA 1483 C C . ARG A 194 ? 0.7079 0.4002 0.5172 0.0603 0.0766 0.0366 215 ARG A C 1484 O O . ARG A 194 ? 0.6640 0.3529 0.4642 0.0602 0.0639 0.0317 215 ARG A O 1485 C CB . ARG A 194 ? 0.5767 0.2964 0.4269 0.0449 0.0800 0.0381 215 ARG A CB 1486 C CG . ARG A 194 ? 0.7004 0.4381 0.5790 0.0358 0.0825 0.0387 215 ARG A CG 1487 C CD . ARG A 194 ? 0.7655 0.4998 0.6532 0.0357 0.0976 0.0441 215 ARG A CD 1488 N NE . ARG A 194 ? 0.7581 0.4760 0.6339 0.0374 0.1080 0.0468 215 ARG A NE 1489 C CZ . ARG A 194 ? 0.8250 0.5428 0.7094 0.0302 0.1113 0.0462 215 ARG A CZ 1490 N NH1 . ARG A 194 ? 0.7929 0.5272 0.6976 0.0207 0.1041 0.0423 215 ARG A NH1 1491 N NH2 . ARG A 194 ? 0.8967 0.5953 0.7671 0.0335 0.1229 0.0498 215 ARG A NH2 1492 N N . ASN A 195 ? 0.8212 0.4979 0.6138 0.0689 0.0886 0.0410 216 ASN A N 1493 C CA . ASN A 195 ? 0.9385 0.5939 0.6986 0.0793 0.0859 0.0404 216 ASN A CA 1494 C C . ASN A 195 ? 0.9544 0.6015 0.7042 0.0836 0.0941 0.0450 216 ASN A C 1495 O O . ASN A 195 ? 1.0285 0.6566 0.7495 0.0952 0.0977 0.0473 216 ASN A O 1496 C CB . ASN A 195 ? 1.0076 0.6458 0.7470 0.0893 0.0922 0.0413 216 ASN A CB 1497 C CG . ASN A 195 ? 1.0646 0.7047 0.8147 0.0910 0.1105 0.0482 216 ASN A CG 1498 O OD1 . ASN A 195 ? 0.9956 0.6356 0.7512 0.0906 0.1224 0.0537 216 ASN A OD1 1499 N ND2 . ASN A 195 ? 1.1049 0.7455 0.8587 0.0934 0.1137 0.0482 216 ASN A ND2 1500 N N . ASP A 196 ? 1.0300 0.6899 0.8019 0.0748 0.0972 0.0464 217 ASP A N 1501 C CA . ASP A 196 ? 1.0290 0.6792 0.7947 0.0773 0.1079 0.0514 217 ASP A CA 1502 C C . ASP A 196 ? 0.9110 0.5608 0.6683 0.0791 0.0971 0.0491 217 ASP A C 1503 O O . ASP A 196 ? 0.9361 0.5769 0.6876 0.0820 0.1056 0.0532 217 ASP A O 1504 C CB . ASP A 196 ? 1.1260 0.7872 0.9212 0.0660 0.1181 0.0536 217 ASP A CB 1505 C CG . ASP A 196 ? 1.2304 0.8887 1.0341 0.0660 0.1336 0.0584 217 ASP A CG 1506 O OD1 . ASP A 196 ? 1.3567 1.0016 1.1399 0.0764 0.1393 0.0612 217 ASP A OD1 1507 O OD2 . ASP A 196 ? 1.2234 0.8925 1.0542 0.0557 0.1399 0.0593 217 ASP A OD2 1508 N N . GLY A 197 ? 0.8460 0.5044 0.6041 0.0776 0.0794 0.0429 218 GLY A N 1509 C CA . GLY A 197 ? 0.7899 0.4528 0.5478 0.0778 0.0686 0.0407 218 GLY A CA 1510 C C . GLY A 197 ? 0.7392 0.4222 0.5224 0.0660 0.0560 0.0352 218 GLY A C 1511 O O . GLY A 197 ? 0.7638 0.4574 0.5633 0.0583 0.0557 0.0331 218 GLY A O 1512 N N . VAL A 198 ? 0.5704 0.2587 0.3565 0.0660 0.0466 0.0333 219 VAL A N 1513 C CA . VAL A 198 ? 0.6250 0.3307 0.4328 0.0563 0.0353 0.0285 219 VAL A CA 1514 C C . VAL A 198 ? 0.6531 0.3677 0.4754 0.0514 0.0378 0.0296 219 VAL A C 1515 O O . VAL A 198 ? 0.5474 0.2518 0.3601 0.0568 0.0469 0.0339 219 VAL A O 1516 C CB . VAL A 198 ? 0.6261 0.3291 0.4260 0.0606 0.0192 0.0237 219 VAL A CB 1517 C CG1 . VAL A 198 ? 0.6115 0.2998 0.3923 0.0668 0.0178 0.0221 219 VAL A CG1 1518 C CG2 . VAL A 198 ? 0.5596 0.2577 0.3472 0.0707 0.0145 0.0251 219 VAL A CG2 1519 N N . MET A 199 ? 0.4977 0.2290 0.3410 0.0419 0.0313 0.0262 220 MET A N 1520 C CA . MET A 199 ? 0.4621 0.2006 0.3174 0.0382 0.0326 0.0265 220 MET A CA 1521 C C . MET A 199 ? 0.4681 0.2077 0.3213 0.0431 0.0216 0.0251 220 MET A C 1522 O O . MET A 199 ? 0.5409 0.2869 0.4001 0.0412 0.0100 0.0213 220 MET A O 1523 C CB . MET A 199 ? 0.4738 0.2296 0.3516 0.0270 0.0324 0.0241 220 MET A CB 1524 C CG . MET A 199 ? 0.5372 0.3002 0.4260 0.0233 0.0316 0.0232 220 MET A CG 1525 S SD . MET A 199 ? 0.5916 0.3418 0.4769 0.0233 0.0465 0.0263 220 MET A SD 1526 C CE . MET A 199 ? 1.9119 1.6564 1.7953 0.0214 0.0566 0.0281 220 MET A CE 1527 N N . GLY A 200 ? 0.4319 0.1641 0.2773 0.0500 0.0260 0.0283 221 GLY A N 1528 C CA . GLY A 200 ? 0.4524 0.1880 0.2982 0.0563 0.0163 0.0275 221 GLY A CA 1529 C C . GLY A 200 ? 0.5638 0.3145 0.4326 0.0470 0.0121 0.0247 221 GLY A C 1530 O O . GLY A 200 ? 0.4033 0.1635 0.2861 0.0360 0.0139 0.0225 221 GLY A O 1531 N N . GLU A 201 ? 0.4899 0.2437 0.3617 0.0530 0.0070 0.0250 222 GLU A N 1532 C CA . GLU A 201 ? 0.5101 0.2766 0.4022 0.0468 0.0029 0.0227 222 GLU A CA 1533 C C . GLU A 201 ? 0.5558 0.3209 0.4523 0.0430 0.0145 0.0247 222 GLU A C 1534 O O . GLU A 201 ? 0.5657 0.3172 0.4488 0.0489 0.0248 0.0286 222 GLU A O 1535 C CB . GLU A 201 ? 0.4956 0.2667 0.3900 0.0568 -0.0074 0.0222 222 GLU A CB 1536 C CG . GLU A 201 ? 0.5442 0.3183 0.4417 0.0576 -0.0214 0.0176 222 GLU A CG 1537 C CD . GLU A 201 ? 0.6987 0.4829 0.6033 0.0680 -0.0327 0.0158 222 GLU A CD 1538 O OE1 . GLU A 201 ? 0.6425 0.4324 0.5450 0.0765 -0.0285 0.0194 222 GLU A OE1 1539 O OE2 . GLU A 201 ? 0.7933 0.5891 0.7055 0.0651 -0.0447 0.0089 222 GLU A OE2 1540 N N . TYR A 202 ? 0.4733 0.2501 0.3870 0.0336 0.0135 0.0219 223 TYR A N 1541 C CA . TYR A 202 ? 0.4709 0.2456 0.3885 0.0298 0.0232 0.0224 223 TYR A CA 1542 C C . TYR A 202 ? 0.4549 0.2432 0.3898 0.0234 0.0194 0.0197 223 TYR A C 1543 O O . TYR A 202 ? 0.4328 0.2327 0.3778 0.0185 0.0116 0.0173 223 TYR A O 1544 C CB . TYR A 202 ? 0.4226 0.1931 0.3368 0.0228 0.0320 0.0219 223 TYR A CB 1545 C CG . TYR A 202 ? 0.4719 0.2568 0.3960 0.0142 0.0271 0.0189 223 TYR A CG 1546 C CD1 . TYR A 202 ? 0.4843 0.2795 0.4194 0.0065 0.0281 0.0164 223 TYR A CD1 1547 C CD2 . TYR A 202 ? 0.3452 0.1316 0.2655 0.0154 0.0220 0.0190 223 TYR A CD2 1548 C CE1 . TYR A 202 ? 0.4148 0.2224 0.3572 0.0012 0.0241 0.0148 223 TYR A CE1 1549 C CE2 . TYR A 202 ? 0.4172 0.2147 0.3452 0.0094 0.0190 0.0171 223 TYR A CE2 1550 C CZ . TYR A 202 ? 0.4250 0.2335 0.3643 0.0029 0.0200 0.0155 223 TYR A CZ 1551 O OH . TYR A 202 ? 0.4578 0.2756 0.4030 -0.0007 0.0175 0.0147 223 TYR A OH 1552 N N . GLU A 203 ? 0.5153 0.2991 0.4517 0.0244 0.0260 0.0201 224 GLU A N 1553 C CA . GLU A 203 ? 0.5250 0.3188 0.4752 0.0199 0.0246 0.0181 224 GLU A CA 1554 C C . GLU A 203 ? 0.5024 0.3072 0.4594 0.0092 0.0239 0.0150 224 GLU A C 1555 O O . GLU A 203 ? 0.4197 0.2235 0.3714 0.0053 0.0267 0.0143 224 GLU A O 1556 C CB . GLU A 203 ? 0.5458 0.3283 0.4923 0.0239 0.0340 0.0191 224 GLU A CB 1557 C CG . GLU A 203 ? 0.6597 0.4317 0.5986 0.0175 0.0440 0.0170 224 GLU A CG 1558 C CD . GLU A 203 ? 0.8585 0.6145 0.7918 0.0213 0.0543 0.0173 224 GLU A CD 1559 O OE1 . GLU A 203 ? 0.8407 0.5870 0.7694 0.0142 0.0621 0.0138 224 GLU A OE1 1560 O OE2 . GLU A 203 ? 0.9451 0.6978 0.8783 0.0319 0.0545 0.0206 224 GLU A OE2 1561 N N . PRO A 204 ? 0.4101 0.2252 0.3789 0.0059 0.0208 0.0138 225 PRO A N 1562 C CA . PRO A 204 ? 0.4367 0.2616 0.4094 -0.0015 0.0199 0.0121 225 PRO A CA 1563 C C . PRO A 204 ? 0.4139 0.2347 0.3801 -0.0053 0.0264 0.0104 225 PRO A C 1564 O O . PRO A 204 ? 0.3878 0.1981 0.3493 -0.0043 0.0329 0.0096 225 PRO A O 1565 C CB . PRO A 204 ? 0.4144 0.2464 0.3989 -0.0030 0.0182 0.0120 225 PRO A CB 1566 C CG . PRO A 204 ? 0.3900 0.2188 0.3808 0.0029 0.0149 0.0131 225 PRO A CG 1567 C CD . PRO A 204 ? 0.4016 0.2187 0.3807 0.0094 0.0191 0.0144 225 PRO A CD 1568 N N . LYS A 205 ? 0.4197 0.2467 0.3854 -0.0095 0.0247 0.0097 226 LYS A N 1569 C CA . LYS A 205 ? 0.4544 0.2790 0.4161 -0.0143 0.0286 0.0074 226 LYS A CA 1570 C C . LYS A 205 ? 0.5390 0.3731 0.5043 -0.0172 0.0248 0.0076 226 LYS A C 1571 O O . LYS A 205 ? 0.4831 0.3237 0.4507 -0.0168 0.0207 0.0093 226 LYS A O 1572 C CB . LYS A 205 ? 0.5324 0.3534 0.4904 -0.0156 0.0305 0.0071 226 LYS A CB 1573 C CG . LYS A 205 ? 0.6205 0.4419 0.5783 -0.0222 0.0325 0.0043 226 LYS A CG 1574 C CD . LYS A 205 ? 0.7134 0.5228 0.6660 -0.0263 0.0394 0.0003 226 LYS A CD 1575 C CE . LYS A 205 ? 0.8163 0.6277 0.7694 -0.0348 0.0396 -0.0043 226 LYS A CE 1576 N NZ . LYS A 205 ? 0.8855 0.6820 0.8326 -0.0410 0.0483 -0.0102 226 LYS A NZ 1577 N N . ILE A 206 ? 0.5237 0.3558 0.4877 -0.0193 0.0269 0.0062 227 ILE A N 1578 C CA . ILE A 206 ? 0.4644 0.3015 0.4285 -0.0213 0.0245 0.0074 227 ILE A CA 1579 C C . ILE A 206 ? 0.3808 0.2191 0.3418 -0.0249 0.0223 0.0065 227 ILE A C 1580 O O . ILE A 206 ? 0.4922 0.3251 0.4494 -0.0294 0.0247 0.0026 227 ILE A O 1581 C CB . ILE A 206 ? 0.4633 0.2947 0.4241 -0.0226 0.0284 0.0062 227 ILE A CB 1582 C CG1 . ILE A 206 ? 0.4857 0.3181 0.4539 -0.0190 0.0304 0.0080 227 ILE A CG1 1583 C CG2 . ILE A 206 ? 0.3733 0.2056 0.3301 -0.0245 0.0267 0.0081 227 ILE A CG2 1584 C CD1 . ILE A 206 ? 0.5425 0.3664 0.5077 -0.0192 0.0366 0.0068 227 ILE A CD1 1585 N N . GLU A 207 ? 0.3590 0.2033 0.3226 -0.0234 0.0183 0.0099 228 GLU A N 1586 C CA . GLU A 207 ? 0.5255 0.3716 0.4891 -0.0257 0.0158 0.0103 228 GLU A CA 1587 C C . GLU A 207 ? 0.5151 0.3605 0.4751 -0.0262 0.0133 0.0134 228 GLU A C 1588 O O . GLU A 207 ? 0.4648 0.3101 0.4241 -0.0301 0.0106 0.0131 228 GLU A O 1589 C CB . GLU A 207 ? 0.4934 0.3436 0.4616 -0.0223 0.0143 0.0128 228 GLU A CB 1590 C CG . GLU A 207 ? 0.6575 0.5057 0.6271 -0.0241 0.0170 0.0102 228 GLU A CG 1591 C CD . GLU A 207 ? 0.7628 0.6094 0.7328 -0.0313 0.0185 0.0064 228 GLU A CD 1592 O OE1 . GLU A 207 ? 0.9065 0.7571 0.8790 -0.0342 0.0149 0.0071 228 GLU A OE1 1593 O OE2 . GLU A 207 ? 0.7201 0.5606 0.6882 -0.0347 0.0237 0.0023 228 GLU A OE2 1594 N N . VAL A 208 ? 0.4515 0.2959 0.4098 -0.0226 0.0143 0.0169 229 VAL A N 1595 C CA . VAL A 208 ? 0.4764 0.3167 0.4278 -0.0214 0.0141 0.0217 229 VAL A CA 1596 C C . VAL A 208 ? 0.5710 0.4052 0.5172 -0.0228 0.0183 0.0205 229 VAL A C 1597 O O . VAL A 208 ? 0.5689 0.4044 0.5202 -0.0214 0.0218 0.0197 229 VAL A O 1598 C CB . VAL A 208 ? 0.6199 0.4615 0.5724 -0.0153 0.0153 0.0279 229 VAL A CB 1599 C CG1 . VAL A 208 ? 0.7014 0.5392 0.6439 -0.0114 0.0159 0.0350 229 VAL A CG1 1600 C CG2 . VAL A 208 ? 0.6677 0.5139 0.6258 -0.0131 0.0130 0.0285 229 VAL A CG2 1601 N N . GLN A 209 ? 0.6190 0.4459 0.5551 -0.0259 0.0181 0.0205 230 GLN A N 1602 C CA . GLN A 209 ? 0.6222 0.4404 0.5509 -0.0265 0.0234 0.0199 230 GLN A CA 1603 C C . GLN A 209 ? 0.6811 0.5087 0.5946 -0.0241 0.0221 0.0200 230 GLN A C 1604 O O . GLN A 209 ? 0.6573 0.4994 0.5669 -0.0243 0.0156 0.0169 230 GLN A O 1605 C CB . GLN A 209 ? 0.4419 0.2568 0.3723 -0.0311 0.0261 0.0111 230 GLN A CB 1606 C CG . GLN A 209 ? 0.4216 0.2352 0.3454 -0.0383 0.0235 0.0025 230 GLN A CG 1607 C CD . GLN A 209 ? 0.6628 0.4701 0.5886 -0.0416 0.0282 -0.0051 230 GLN A CD 1608 O OE1 . GLN A 209 ? 0.6464 0.4599 0.5803 -0.0402 0.0283 -0.0051 230 GLN A OE1 1609 N NE2 . GLN A 209 ? 0.6583 0.4537 0.5743 -0.0444 0.0332 -0.0111 230 GLN A NE2 1610 N N . PHE A 210 ? 0.6369 0.4608 0.5425 -0.0208 0.0284 0.0226 231 PHE A N 1611 C CA . PHE A 210 ? 0.6696 0.5039 0.5574 -0.0167 0.0278 0.0210 231 PHE A CA 1612 C C . PHE A 210 ? 0.6341 0.4720 0.5138 -0.0235 0.0240 0.0096 231 PHE A C 1613 O O . PHE A 210 ? 0.6426 0.4703 0.5291 -0.0305 0.0265 0.0028 231 PHE A O 1614 C CB . PHE A 210 ? 0.7000 0.5278 0.5812 -0.0118 0.0376 0.0253 231 PHE A CB 1615 C CG . PHE A 210 ? 0.6658 0.4800 0.5540 -0.0167 0.0450 0.0229 231 PHE A CG 1616 C CD1 . PHE A 210 ? 0.6767 0.4874 0.5522 -0.0168 0.0504 0.0176 231 PHE A CD1 1617 C CD2 . PHE A 210 ? 0.6422 0.4482 0.5491 -0.0196 0.0468 0.0252 231 PHE A CD2 1618 C CE1 . PHE A 210 ? 0.6964 0.4963 0.5793 -0.0189 0.0581 0.0154 231 PHE A CE1 1619 C CE2 . PHE A 210 ? 0.6463 0.4445 0.5614 -0.0216 0.0529 0.0224 231 PHE A CE2 1620 C CZ . PHE A 210 ? 0.7392 0.5343 0.6428 -0.0208 0.0591 0.0180 231 PHE A CZ 1621 N N . PRO A 211 ? 0.6603 0.5143 0.5260 -0.0211 0.0179 0.0054 232 PRO A N 1622 C CA . PRO A 211 ? 0.6582 0.5208 0.5169 -0.0294 0.0144 -0.0034 232 PRO A CA 1623 C C . PRO A 211 ? 0.6252 0.4747 0.4759 -0.0324 0.0229 -0.0087 232 PRO A C 1624 O O . PRO A 211 ? 0.5915 0.4249 0.4355 -0.0270 0.0311 -0.0058 232 PRO A O 1625 C CB . PRO A 211 ? 0.6257 0.5053 0.4667 -0.0238 0.0060 -0.0060 232 PRO A CB 1626 C CG . PRO A 211 ? 0.6958 0.5790 0.5411 -0.0123 0.0055 0.0097 232 PRO A CG 1627 C CD . PRO A 211 ? 0.7076 0.5738 0.5706 -0.0099 0.0146 0.0103 232 PRO A CD 1628 N N . GLU A 212 ? 0.6103 0.4674 0.4650 -0.0406 0.0230 -0.0153 233 GLU A N 1629 C CA . GLU A 212 ? 0.6905 0.5338 0.5363 -0.0435 0.0316 -0.0215 233 GLU A CA 1630 C C . GLU A 212 ? 0.7295 0.5666 0.5576 -0.0387 0.0328 -0.0223 233 GLU A C 1631 O O . GLU A 212 ? 0.6646 0.4889 0.4865 -0.0374 0.0422 -0.0214 233 GLU A O 1632 C CB . GLU A 212 ? 0.9007 0.7509 0.7519 -0.0535 0.0319 -0.0305 233 GLU A CB 1633 C CG . GLU A 212 ? 1.1296 0.9601 0.9707 -0.0569 0.0422 -0.0388 233 GLU A CG 1634 C CD . GLU A 212 ? 1.2520 1.0773 1.0982 -0.0667 0.0457 -0.0498 233 GLU A CD 1635 O OE1 . GLU A 212 ? 1.3494 1.1811 1.1912 -0.0736 0.0481 -0.0550 233 GLU A OE1 1636 O OE2 . GLU A 212 ? 1.1307 0.9438 0.9868 -0.0679 0.0467 -0.0522 233 GLU A OE2 1637 N N . THR A 213 ? 0.7478 0.5972 0.5600 -0.0338 0.0242 -0.0268 234 THR A N 1638 C CA . THR A 213 ? 0.6803 0.5308 0.4638 -0.0242 0.0268 -0.0266 234 THR A CA 1639 C C . THR A 213 ? 0.6879 0.5499 0.4637 -0.0126 0.0239 -0.0130 234 THR A C 1640 O O . THR A 213 ? 0.7383 0.6198 0.5166 -0.0118 0.0130 -0.0128 234 THR A O 1641 C CB . THR A 213 ? 0.7964 0.6622 0.5614 -0.0280 0.0194 -0.0409 234 THR A CB 1642 O OG1 . THR A 213 ? 0.8358 0.6893 0.6089 -0.0391 0.0245 -0.0508 234 THR A OG1 1643 C CG2 . THR A 213 ? 0.7861 0.6551 0.5174 -0.0154 0.0222 -0.0375 234 THR A CG2 1644 N N . VAL A 214 ? 0.6320 0.4819 0.4036 -0.0032 0.0344 0.0004 235 VAL A N 1645 C CA . VAL A 214 ? 0.7905 0.6464 0.5605 0.0084 0.0338 0.0159 235 VAL A CA 1646 C C . VAL A 214 ? 0.8803 0.7341 0.6243 0.0201 0.0412 0.0231 235 VAL A C 1647 O O . VAL A 214 ? 0.8314 0.6683 0.5790 0.0223 0.0537 0.0270 235 VAL A O 1648 C CB . VAL A 214 ? 0.6219 0.4667 0.4253 0.0084 0.0377 0.0232 235 VAL A CB 1649 C CG1 . VAL A 214 ? 0.6526 0.4876 0.4782 -0.0020 0.0395 0.0126 235 VAL A CG1 1650 C CG2 . VAL A 214 ? 0.5048 0.3408 0.3128 0.0186 0.0486 0.0316 235 VAL A CG2 1651 N N . PRO A 215 ? 0.9544 0.8276 0.6725 0.0285 0.0327 0.0239 236 PRO A N 1652 C CA . PRO A 215 ? 0.9152 0.7883 0.6031 0.0422 0.0386 0.0319 236 PRO A CA 1653 C C . PRO A 215 ? 0.9007 0.7579 0.6005 0.0525 0.0506 0.0500 236 PRO A C 1654 O O . PRO A 215 ? 0.9539 0.8142 0.6713 0.0559 0.0473 0.0572 236 PRO A O 1655 C CB . PRO A 215 ? 0.8953 0.7978 0.5617 0.0498 0.0228 0.0293 236 PRO A CB 1656 C CG . PRO A 215 ? 0.9194 0.8377 0.6042 0.0352 0.0092 0.0129 236 PRO A CG 1657 C CD . PRO A 215 ? 0.9715 0.8707 0.6900 0.0260 0.0160 0.0165 236 PRO A CD 1658 N N . ALA A 216 ? 0.8059 0.6462 0.4990 0.0572 0.0653 0.0549 237 ALA A N 1659 C CA . ALA A 216 ? 0.8591 0.6841 0.5673 0.0656 0.0782 0.0673 237 ALA A CA 1660 C C . ALA A 216 ? 0.8507 0.6717 0.5259 0.0816 0.0876 0.0784 237 ALA A C 1661 O O . ALA A 216 ? 0.8007 0.6143 0.4594 0.0823 0.0960 0.0762 237 ALA A O 1662 C CB . ALA A 216 ? 0.8080 0.6172 0.5478 0.0565 0.0886 0.0611 237 ALA A CB 1663 N N . GLU A 217 ? 0.8616 0.6865 0.5266 0.0958 0.0871 0.0905 238 GLU A N 1664 C CA . GLU A 217 ? 0.9106 0.7315 0.5411 0.1139 0.0960 0.1028 238 GLU A CA 1665 C C . GLU A 217 ? 0.9628 0.7581 0.6066 0.1173 0.1175 0.1092 238 GLU A C 1666 O O . GLU A 217 ? 0.9127 0.6976 0.5918 0.1128 0.1244 0.1080 238 GLU A O 1667 C CB . GLU A 217 ? 0.9870 0.8208 0.6015 0.1307 0.0890 0.1141 238 GLU A CB 1668 C CG . GLU A 217 ? 1.1189 0.9452 0.6979 0.1524 0.1003 0.1292 238 GLU A CG 1669 C CD . GLU A 217 ? 1.2289 1.0761 0.7827 0.1718 0.0892 0.1388 238 GLU A CD 1670 O OE1 . GLU A 217 ? 1.2112 1.0833 0.7735 0.1674 0.0705 0.1317 238 GLU A OE1 1671 O OE2 . GLU A 217 ? 1.3382 1.1776 0.8645 0.1926 0.0995 0.1534 238 GLU A OE2 1672 N N . LYS A 218 ? 1.0452 0.8330 0.6603 0.1254 0.1279 0.1137 239 LYS A N 1673 C CA . LYS A 218 ? 1.0126 0.7777 0.6383 0.1298 0.1491 0.1194 239 LYS A CA 1674 C C . LYS A 218 ? 0.9658 0.7194 0.6040 0.1404 0.1592 0.1295 239 LYS A C 1675 O O . LYS A 218 ? 0.9696 0.7280 0.5826 0.1558 0.1561 0.1408 239 LYS A O 1676 C CB . LYS A 218 ? 1.0815 0.8416 0.6650 0.1416 0.1585 0.1258 239 LYS A CB 1677 C CG . LYS A 218 ? 1.2064 0.9428 0.7952 0.1511 0.1817 0.1357 239 LYS A CG 1678 C CD . LYS A 218 ? 1.3340 1.0653 0.8735 0.1675 0.1915 0.1455 239 LYS A CD 1679 C CE . LYS A 218 ? 1.3996 1.1270 0.9362 0.1594 0.1977 0.1364 239 LYS A CE 1680 N NZ . LYS A 218 ? 1.4799 1.1999 0.9685 0.1761 0.2101 0.1455 239 LYS A NZ 1681 N N . GLY A 219 ? 0.9702 0.7109 0.6472 0.1331 0.1710 0.1233 240 GLY A N 1682 C CA . GLY A 219 ? 1.0038 0.7321 0.6936 0.1419 0.1840 0.1283 240 GLY A CA 1683 C C . GLY A 219 ? 1.0021 0.7389 0.7125 0.1386 0.1754 0.1240 240 GLY A C 1684 O O . GLY A 219 ? 1.0244 0.7511 0.7422 0.1464 0.1871 0.1270 240 GLY A O 1685 N N . THR A 220 ? 0.8495 0.6038 0.5680 0.1273 0.1566 0.1165 241 THR A N 1686 C CA . THR A 220 ? 0.9404 0.7037 0.6787 0.1235 0.1484 0.1117 241 THR A CA 1687 C C . THR A 220 ? 0.8988 0.6689 0.6775 0.1051 0.1451 0.0936 241 THR A C 1688 O O . THR A 220 ? 0.8021 0.5730 0.5932 0.0953 0.1456 0.0847 241 THR A O 1689 C CB . THR A 220 ? 0.9791 0.7607 0.6990 0.1259 0.1288 0.1160 241 THR A CB 1690 O OG1 . THR A 220 ? 1.0412 0.8334 0.7601 0.1127 0.1164 0.1075 241 THR A OG1 1691 C CG2 . THR A 220 ? 0.8873 0.6713 0.5657 0.1472 0.1291 0.1327 241 THR A CG2 1692 N N . THR A 221 ? 0.9697 0.7466 0.7664 0.1019 0.1418 0.0881 242 THR A N 1693 C CA . THR A 221 ? 0.8679 0.6420 0.6812 0.0829 0.1404 0.0877 242 THR A CA 1694 C C . THR A 221 ? 0.7676 0.5616 0.5890 0.0753 0.1200 0.0772 242 THR A C 1695 O O . THR A 221 ? 0.7957 0.6021 0.6177 0.0803 0.1100 0.0748 242 THR A O 1696 C CB . THR A 221 ? 1.0005 0.7570 0.8162 0.0798 0.1505 0.0998 242 THR A CB 1697 O OG1 . THR A 221 ? 1.1539 0.8885 0.9610 0.0867 0.1716 0.1099 242 THR A OG1 1698 C CG2 . THR A 221 ? 0.9989 0.7491 0.8339 0.0599 0.1489 0.1005 242 THR A CG2 1699 N N . VAL A 222 ? 0.7029 0.4999 0.5313 0.0638 0.1155 0.0708 243 VAL A N 1700 C CA . VAL A 222 ? 0.7612 0.5716 0.5966 0.0544 0.0992 0.0622 243 VAL A CA 1701 C C . VAL A 222 ? 0.7177 0.5209 0.5671 0.0413 0.0991 0.0680 243 VAL A C 1702 O O . VAL A 222 ? 0.6446 0.4354 0.5045 0.0331 0.1095 0.0730 243 VAL A O 1703 C CB . VAL A 222 ? 0.7531 0.5660 0.5877 0.0493 0.0959 0.0531 243 VAL A CB 1704 C CG1 . VAL A 222 ? 0.6593 0.4821 0.4991 0.0395 0.0815 0.0450 243 VAL A CG1 1705 C CG2 . VAL A 222 ? 0.7520 0.5587 0.5593 0.0596 0.0983 0.0606 243 VAL A CG2 1706 N N . LYS A 223 ? 0.7277 0.5396 0.5810 0.0395 0.0870 0.0661 244 LYS A N 1707 C CA . LYS A 223 ? 0.6828 0.4868 0.5508 0.0286 0.0842 0.0697 244 LYS A CA 1708 C C . LYS A 223 ? 0.6609 0.4738 0.5361 0.0198 0.0715 0.0616 244 LYS A C 1709 O O . LYS A 223 ? 0.7070 0.5348 0.5772 0.0226 0.0606 0.0552 244 LYS A O 1710 C CB . LYS A 223 ? 0.7588 0.5602 0.6262 0.0344 0.0830 0.0758 244 LYS A CB 1711 C CG . LYS A 223 ? 0.9545 0.7348 0.8219 0.0362 0.0982 0.0861 244 LYS A CG 1712 C CD . LYS A 223 ? 1.0340 0.8120 0.8984 0.0443 0.0979 0.0903 244 LYS A CD 1713 C CE . LYS A 223 ? 1.0675 0.8248 0.9252 0.0505 0.1155 0.0994 244 LYS A CE 1714 N NZ . LYS A 223 ? 0.9941 0.7500 0.8411 0.0643 0.1176 0.1047 244 LYS A NZ 1715 N N . LEU A 224 ? 0.6488 0.4533 0.5383 0.0091 0.0734 0.0609 245 LEU A N 1716 C CA . LEU A 224 ? 0.6106 0.4192 0.5076 0.0016 0.0635 0.0538 245 LEU A CA 1717 C C . LEU A 224 ? 0.6050 0.4113 0.5182 -0.0030 0.0583 0.0534 245 LEU A C 1718 O O . LEU A 224 ? 0.6319 0.4361 0.5576 -0.0048 0.0636 0.0540 245 LEU A O 1719 C CB . LEU A 224 ? 0.5810 0.3866 0.4832 -0.0039 0.0684 0.0493 245 LEU A CB 1720 C CG . LEU A 224 ? 0.7003 0.5094 0.5867 0.0015 0.0749 0.0471 245 LEU A CG 1721 C CD1 . LEU A 224 ? 0.6759 0.4816 0.5680 -0.0034 0.0798 0.0423 245 LEU A CD1 1722 C CD2 . LEU A 224 ? 0.6235 0.4433 0.4916 0.0072 0.0660 0.0409 245 LEU A CD2 1723 N N . GLU A 225 ? 0.5648 0.3767 0.4784 -0.0044 0.0480 0.0496 246 GLU A N 1724 C CA . GLU A 225 ? 0.6153 0.4322 0.5431 -0.0069 0.0427 0.0456 246 GLU A CA 1725 C C . GLU A 225 ? 0.6034 0.4243 0.5407 -0.0131 0.0384 0.0371 246 GLU A C 1726 O O . GLU A 225 ? 0.6262 0.4448 0.5569 -0.0155 0.0359 0.0341 246 GLU A O 1727 C CB . GLU A 225 ? 0.6184 0.4401 0.5411 -0.0026 0.0358 0.0481 246 GLU A CB 1728 C CG . GLU A 225 ? 0.7517 0.5714 0.6689 0.0058 0.0406 0.0556 246 GLU A CG 1729 C CD . GLU A 225 ? 0.7505 0.5776 0.6671 0.0110 0.0345 0.0574 246 GLU A CD 1730 O OE1 . GLU A 225 ? 0.6752 0.5099 0.5943 0.0082 0.0261 0.0541 246 GLU A OE1 1731 O OE2 . GLU A 225 ? 0.7082 0.5324 0.6222 0.0182 0.0394 0.0625 246 GLU A OE2 1732 N N . CYS A 226 ? 0.5848 0.4107 0.5362 -0.0150 0.0378 0.0337 247 CYS A N 1733 C CA . CYS A 226 ? 0.5912 0.4228 0.5506 -0.0178 0.0340 0.0270 247 CYS A CA 1734 C C . CYS A 226 ? 0.5877 0.4254 0.5574 -0.0177 0.0304 0.0252 247 CYS A C 1735 O O . CYS A 226 ? 0.5734 0.4100 0.5501 -0.0181 0.0330 0.0269 247 CYS A O 1736 C CB . CYS A 226 ? 0.6162 0.4456 0.5799 -0.0194 0.0394 0.0251 247 CYS A CB 1737 S SG . CYS A 226 ? 0.7701 0.6040 0.7414 -0.0201 0.0364 0.0188 247 CYS A SG 1738 N N . PHE A 227 ? 0.5177 0.3600 0.4876 -0.0176 0.0249 0.0221 248 PHE A N 1739 C CA . PHE A 227 ? 0.4530 0.2991 0.4294 -0.0169 0.0216 0.0208 248 PHE A CA 1740 C C . PHE A 227 ? 0.4301 0.2793 0.4058 -0.0169 0.0183 0.0173 248 PHE A C 1741 O O . PHE A 227 ? 0.4904 0.3389 0.4607 -0.0178 0.0176 0.0164 248 PHE A O 1742 C CB . PHE A 227 ? 0.3569 0.2008 0.3303 -0.0150 0.0209 0.0240 248 PHE A CB 1743 C CG . PHE A 227 ? 0.3973 0.2412 0.3748 -0.0146 0.0184 0.0226 248 PHE A CG 1744 C CD1 . PHE A 227 ? 0.3990 0.2389 0.3823 -0.0164 0.0201 0.0224 248 PHE A CD1 1745 C CD2 . PHE A 227 ? 0.3797 0.2260 0.3549 -0.0131 0.0150 0.0214 248 PHE A CD2 1746 C CE1 . PHE A 227 ? 0.4131 0.2499 0.3977 -0.0166 0.0172 0.0206 248 PHE A CE1 1747 C CE2 . PHE A 227 ? 0.3703 0.2139 0.3460 -0.0124 0.0132 0.0202 248 PHE A CE2 1748 C CZ . PHE A 227 ? 0.3133 0.1517 0.2929 -0.0142 0.0137 0.0197 248 PHE A CZ 1749 N N . ALA A 228 ? 0.3072 0.1578 0.2882 -0.0161 0.0166 0.0158 249 ALA A N 1750 C CA . ALA A 228 ? 0.3164 0.1665 0.2954 -0.0151 0.0155 0.0135 249 ALA A CA 1751 C C . ALA A 228 ? 0.3938 0.2438 0.3724 -0.0134 0.0122 0.0137 249 ALA A C 1752 O O . ALA A 228 ? 0.4325 0.2820 0.4145 -0.0133 0.0100 0.0143 249 ALA A O 1753 C CB . ALA A 228 ? 0.3333 0.1811 0.3158 -0.0143 0.0175 0.0123 249 ALA A CB 1754 N N . LEU A 229 ? 0.4127 0.2609 0.3864 -0.0127 0.0128 0.0130 250 LEU A N 1755 C CA . LEU A 229 ? 0.3848 0.2296 0.3551 -0.0103 0.0112 0.0132 250 LEU A CA 1756 C C . LEU A 229 ? 0.4285 0.2680 0.3974 -0.0079 0.0108 0.0125 250 LEU A C 1757 O O . LEU A 229 ? 0.4578 0.2947 0.4266 -0.0078 0.0141 0.0119 250 LEU A O 1758 C CB . LEU A 229 ? 0.3215 0.1647 0.2879 -0.0108 0.0142 0.0132 250 LEU A CB 1759 C CG . LEU A 229 ? 0.4113 0.2590 0.3800 -0.0126 0.0142 0.0143 250 LEU A CG 1760 C CD1 . LEU A 229 ? 0.4672 0.3133 0.4357 -0.0135 0.0171 0.0144 250 LEU A CD1 1761 C CD2 . LEU A 229 ? 0.3054 0.1541 0.2749 -0.0107 0.0119 0.0164 250 LEU A CD2 1762 N N . GLY A 230 ? 0.4143 0.2496 0.3809 -0.0053 0.0069 0.0127 251 GLY A N 1763 C CA . GLY A 230 ? 0.3890 0.2173 0.3528 -0.0012 0.0055 0.0128 251 GLY A CA 1764 C C . GLY A 230 ? 0.4126 0.2350 0.3729 0.0017 -0.0011 0.0122 251 GLY A C 1765 O O . GLY A 230 ? 0.4390 0.2626 0.4017 -0.0009 -0.0045 0.0110 251 GLY A O 1766 N N . ASN A 231 ? 0.4389 0.2523 0.3921 0.0080 -0.0025 0.0129 252 ASN A N 1767 C CA . ASN A 231 ? 0.3757 0.1804 0.3220 0.0128 -0.0098 0.0118 252 ASN A CA 1768 C C . ASN A 231 ? 0.4338 0.2345 0.3810 0.0207 -0.0141 0.0122 252 ASN A C 1769 O O . ASN A 231 ? 0.4793 0.2742 0.4166 0.0280 -0.0091 0.0153 252 ASN A O 1770 C CB . ASN A 231 ? 0.5046 0.3000 0.4338 0.0167 -0.0061 0.0134 252 ASN A CB 1771 C CG . ASN A 231 ? 0.5658 0.3493 0.4828 0.0236 -0.0135 0.0121 252 ASN A CG 1772 O OD1 . ASN A 231 ? 0.4770 0.2592 0.3998 0.0246 -0.0229 0.0088 252 ASN A OD1 1773 N ND2 . ASN A 231 ? 0.5855 0.3587 0.4853 0.0285 -0.0088 0.0141 252 ASN A ND2 1774 N N . PRO A 232 ? 0.3747 0.1777 0.3345 0.0203 -0.0226 0.0090 253 PRO A N 1775 C CA . PRO A 232 ? 0.4124 0.2178 0.3830 0.0112 -0.0269 0.0047 253 PRO A CA 1776 C C . PRO A 232 ? 0.4092 0.2261 0.3906 0.0022 -0.0199 0.0060 253 PRO A C 1777 O O . PRO A 232 ? 0.3822 0.2046 0.3649 0.0028 -0.0135 0.0088 253 PRO A O 1778 C CB . PRO A 232 ? 0.4258 0.2292 0.4101 0.0134 -0.0359 -0.0003 253 PRO A CB 1779 C CG . PRO A 232 ? 0.4359 0.2370 0.4108 0.0291 -0.0391 0.0027 253 PRO A CG 1780 C CD . PRO A 232 ? 0.4280 0.2308 0.3930 0.0301 -0.0276 0.0092 253 PRO A CD 1781 N N . VAL A 233 ? 0.3391 0.1578 0.3262 -0.0049 -0.0204 0.0038 254 VAL A N 1782 C CA . VAL A 233 ? 0.4633 0.2910 0.4564 -0.0102 -0.0134 0.0059 254 VAL A CA 1783 C C . VAL A 233 ? 0.4771 0.3115 0.4853 -0.0127 -0.0111 0.0060 254 VAL A C 1784 O O . VAL A 233 ? 0.5505 0.3840 0.5715 -0.0157 -0.0150 0.0026 254 VAL A O 1785 C CB . VAL A 233 ? 0.4019 0.2264 0.3937 -0.0149 -0.0121 0.0050 254 VAL A CB 1786 C CG1 . VAL A 233 ? 0.4135 0.2272 0.4031 -0.0163 -0.0187 0.0000 254 VAL A CG1 1787 C CG2 . VAL A 233 ? 0.4110 0.2406 0.4141 -0.0203 -0.0067 0.0057 254 VAL A CG2 1788 N N . PRO A 234 ? 0.4663 0.3065 0.4732 -0.0120 -0.0045 0.0088 255 PRO A N 1789 C CA . PRO A 234 ? 0.4848 0.3289 0.5024 -0.0128 -0.0007 0.0094 255 PRO A CA 1790 C C . PRO A 234 ? 0.4440 0.2911 0.4746 -0.0193 0.0019 0.0088 255 PRO A C 1791 O O . PRO A 234 ? 0.4613 0.3068 0.4893 -0.0229 0.0028 0.0086 255 PRO A O 1792 C CB . PRO A 234 ? 0.3839 0.2301 0.3922 -0.0114 0.0058 0.0115 255 PRO A CB 1793 C CG . PRO A 234 ? 0.4566 0.2998 0.4517 -0.0087 0.0043 0.0116 255 PRO A CG 1794 C CD . PRO A 234 ? 0.4212 0.2625 0.4156 -0.0101 -0.0006 0.0107 255 PRO A CD 1795 N N . THR A 235 ? 0.4185 0.2677 0.4626 -0.0207 0.0045 0.0085 256 THR A N 1796 C CA . THR A 235 ? 0.3703 0.2227 0.4260 -0.0272 0.0109 0.0088 256 THR A CA 1797 C C . THR A 235 ? 0.4548 0.3078 0.5032 -0.0248 0.0190 0.0125 256 THR A C 1798 O O . THR A 235 ? 0.4156 0.2672 0.4575 -0.0196 0.0196 0.0130 256 THR A O 1799 C CB . THR A 235 ? 0.3664 0.2223 0.4438 -0.0314 0.0103 0.0061 256 THR A CB 1800 O OG1 . THR A 235 ? 0.4130 0.2663 0.4908 -0.0241 0.0103 0.0075 256 THR A OG1 1801 C CG2 . THR A 235 ? 0.4114 0.2680 0.4984 -0.0362 0.0009 -0.0004 256 THR A CG2 1802 N N . ILE A 236 ? 0.5468 0.3989 0.5944 -0.0283 0.0260 0.0145 257 ILE A N 1803 C CA . ILE A 236 ? 0.5297 0.3799 0.5689 -0.0265 0.0335 0.0174 257 ILE A CA 1804 C C . ILE A 236 ? 0.5570 0.4073 0.6092 -0.0299 0.0421 0.0190 257 ILE A C 1805 O O . ILE A 236 ? 0.5688 0.4209 0.6346 -0.0360 0.0450 0.0187 257 ILE A O 1806 C CB . ILE A 236 ? 0.4922 0.3383 0.5173 -0.0263 0.0360 0.0200 257 ILE A CB 1807 C CG1 . ILE A 236 ? 0.3716 0.2186 0.3856 -0.0234 0.0287 0.0188 257 ILE A CG1 1808 C CG2 . ILE A 236 ? 0.3908 0.2328 0.4056 -0.0247 0.0428 0.0226 257 ILE A CG2 1809 C CD1 . ILE A 236 ? 0.4985 0.3471 0.5040 -0.0201 0.0268 0.0173 257 ILE A CD1 1810 N N . LEU A 237 ? 0.5356 0.3832 0.5834 -0.0269 0.0474 0.0204 258 LEU A N 1811 C CA . LEU A 237 ? 0.5725 0.4193 0.6306 -0.0296 0.0577 0.0229 258 LEU A CA 1812 C C . LEU A 237 ? 0.5444 0.3828 0.5850 -0.0264 0.0653 0.0256 258 LEU A C 1813 O O . LEU A 237 ? 0.4566 0.2901 0.4824 -0.0222 0.0622 0.0236 258 LEU A O 1814 C CB . LEU A 237 ? 0.6190 0.4694 0.6960 -0.0293 0.0567 0.0216 258 LEU A CB 1815 C CG . LEU A 237 ? 0.7848 0.6433 0.8684 -0.0253 0.0668 0.0227 258 LEU A CG 1816 C CD1 . LEU A 237 ? 0.9081 0.7762 1.0024 -0.0304 0.0775 0.0246 258 LEU A CD1 1817 C CD2 . LEU A 237 ? 0.7415 0.6163 0.8429 -0.0193 0.0627 0.0196 258 LEU A CD2 1818 N N . TRP A 238 ? 0.6190 0.4548 0.6606 -0.0289 0.0760 0.0297 259 TRP A N 1819 C CA . TRP A 238 ? 0.5688 0.3944 0.5912 -0.0258 0.0838 0.0328 259 TRP A CA 1820 C C . TRP A 238 ? 0.5454 0.3769 0.5756 -0.0234 0.0946 0.0331 259 TRP A C 1821 O O . TRP A 238 ? 0.5677 0.4128 0.6194 -0.0255 0.0999 0.0332 259 TRP A O 1822 C CB . TRP A 238 ? 0.5234 0.3445 0.5337 -0.0264 0.0888 0.0375 259 TRP A CB 1823 C CG . TRP A 238 ? 0.5447 0.3655 0.5456 -0.0255 0.0798 0.0368 259 TRP A CG 1824 C CD1 . TRP A 238 ? 0.4389 0.2633 0.4499 -0.0282 0.0764 0.0362 259 TRP A CD1 1825 C CD2 . TRP A 238 ? 0.5468 0.3627 0.5267 -0.0219 0.0742 0.0368 259 TRP A CD2 1826 N NE1 . TRP A 238 ? 0.4072 0.2289 0.4044 -0.0254 0.0697 0.0365 259 TRP A NE1 1827 C CE2 . TRP A 238 ? 0.5533 0.3715 0.5329 -0.0217 0.0679 0.0370 259 TRP A CE2 1828 C CE3 . TRP A 238 ? 0.5090 0.3178 0.4706 -0.0197 0.0740 0.0364 259 TRP A CE3 1829 C CZ2 . TRP A 238 ? 0.5609 0.3774 0.5252 -0.0187 0.0614 0.0375 259 TRP A CZ2 1830 C CZ3 . TRP A 238 ? 0.4561 0.2629 0.4027 -0.0182 0.0665 0.0361 259 TRP A CZ3 1831 C CH2 . TRP A 238 ? 0.4704 0.2822 0.4195 -0.0173 0.0604 0.0371 259 TRP A CH2 1832 N N . ARG A 239 ? 0.5744 0.3991 0.5874 -0.0183 0.0980 0.0317 260 ARG A N 1833 C CA . ARG A 239 ? 0.5290 0.3594 0.5452 -0.0134 0.1094 0.0312 260 ARG A CA 1834 C C . ARG A 239 ? 0.6602 0.4772 0.6476 -0.0093 0.1134 0.0295 260 ARG A C 1835 O O . ARG A 239 ? 0.6537 0.4602 0.6233 -0.0107 0.1054 0.0276 260 ARG A O 1836 C CB . ARG A 239 ? 0.4026 0.2394 0.4351 -0.0096 0.1068 0.0279 260 ARG A CB 1837 C CG . ARG A 239 ? 0.4932 0.3144 0.5096 -0.0059 0.0996 0.0238 260 ARG A CG 1838 C CD . ARG A 239 ? 0.5277 0.3547 0.5593 0.0003 0.0965 0.0217 260 ARG A CD 1839 N NE . ARG A 239 ? 0.5543 0.3638 0.5691 0.0049 0.0926 0.0176 260 ARG A NE 1840 C CZ . ARG A 239 ? 0.5982 0.4086 0.6200 0.0119 0.0885 0.0164 260 ARG A CZ 1841 N NH1 . ARG A 239 ? 0.5883 0.4196 0.6338 0.0152 0.0855 0.0185 260 ARG A NH1 1842 N NH2 . ARG A 239 ? 0.5429 0.3347 0.5480 0.0155 0.0875 0.0130 260 ARG A NH2 1843 N N . ARG A 240 ? 0.6279 0.4468 0.6114 -0.0042 0.1259 0.0296 261 ARG A N 1844 C CA . ARG A 240 ? 0.6007 0.4067 0.5550 -0.0003 0.1306 0.0265 261 ARG A CA 1845 C C . ARG A 240 ? 0.5571 0.3537 0.5078 0.0043 0.1329 0.0210 261 ARG A C 1846 O O . ARG A 240 ? 0.6843 0.4892 0.6545 0.0087 0.1384 0.0218 261 ARG A O 1847 C CB . ARG A 240 ? 0.6015 0.4109 0.5475 0.0045 0.1436 0.0290 261 ARG A CB 1848 C CG . ARG A 240 ? 0.5777 0.3875 0.5160 0.0032 0.1413 0.0330 261 ARG A CG 1849 C CD . ARG A 240 ? 0.6248 0.4351 0.5608 0.0099 0.1538 0.0353 261 ARG A CD 1850 N NE . ARG A 240 ? 0.6854 0.4833 0.5910 0.0175 0.1552 0.0315 261 ARG A NE 1851 C CZ . ARG A 240 ? 0.7687 0.5599 0.6666 0.0253 0.1629 0.0334 261 ARG A CZ 1852 N NH1 . ARG A 240 ? 0.6770 0.4734 0.5947 0.0255 0.1725 0.0391 261 ARG A NH1 1853 N NH2 . ARG A 240 ? 0.6694 0.4469 0.5413 0.0322 0.1598 0.0299 261 ARG A NH2 1854 N N . ALA A 241 ? 0.5417 0.3221 0.4679 0.0040 0.1289 0.0144 262 ALA A N 1855 C CA . ALA A 241 ? 0.5413 0.3092 0.4622 0.0083 0.1301 0.0065 262 ALA A CA 1856 C C . ALA A 241 ? 0.6584 0.4240 0.5728 0.0167 0.1452 0.0047 262 ALA A C 1857 O O . ALA A 241 ? 0.7379 0.4952 0.6489 0.0217 0.1488 -0.0003 262 ALA A O 1858 C CB . ALA A 241 ? 0.6057 0.3595 0.5043 0.0032 0.1220 -0.0021 262 ALA A CB 1859 N N . ASP A 242 ? 0.5818 0.3543 0.4934 0.0183 0.1551 0.0099 263 ASP A N 1860 C CA . ASP A 242 ? 0.6263 0.3999 0.5328 0.0248 0.1701 0.0117 263 ASP A CA 1861 C C . ASP A 242 ? 0.6897 0.4814 0.6270 0.0271 0.1776 0.0214 263 ASP A C 1862 O O . ASP A 242 ? 0.7615 0.5491 0.7003 0.0311 0.1838 0.0263 263 ASP A O 1863 C CB . ASP A 242 ? 0.6505 0.4104 0.5276 0.0228 0.1718 0.0132 263 ASP A CB 1864 C CG . ASP A 242 ? 0.8429 0.6063 0.7208 0.0224 0.1668 0.0157 263 ASP A CG 1865 O OD1 . ASP A 242 ? 0.9078 0.6880 0.8103 0.0227 0.1674 0.0179 263 ASP A OD1 1866 O OD2 . ASP A 242 ? 0.9462 0.6987 0.8014 0.0226 0.1616 0.0146 263 ASP A OD2 1867 N N . GLY A 243 ? 0.6730 0.4806 0.6378 0.0249 0.1709 0.0223 264 GLY A N 1868 C CA . GLY A 243 ? 0.6916 0.5208 0.6906 0.0270 0.1745 0.0269 264 GLY A CA 1869 C C . GLY A 243 ? 0.7435 0.5758 0.7505 0.0272 0.1763 0.0284 264 GLY A C 1870 O O . GLY A 243 ? 0.7245 0.5710 0.7604 0.0273 0.1762 0.0309 264 GLY A O 1871 N N . LYS A 244 ? 0.7388 0.5577 0.7189 0.0262 0.1773 0.0276 265 LYS A N 1872 C CA . LYS A 244 ? 0.7542 0.5742 0.7375 0.0266 0.1809 0.0309 265 LYS A CA 1873 C C . LYS A 244 ? 0.7593 0.5954 0.7634 0.0180 0.1757 0.0334 265 LYS A C 1874 O O . LYS A 244 ? 0.8401 0.6765 0.8385 0.0111 0.1661 0.0336 265 LYS A O 1875 C CB . LYS A 244 ? 0.7934 0.5951 0.7415 0.0291 0.1805 0.0301 265 LYS A CB 1876 C CG . LYS A 244 ? 0.8475 0.6284 0.7736 0.0359 0.1842 0.0294 265 LYS A CG 1877 C CD . LYS A 244 ? 0.9101 0.6762 0.8067 0.0388 0.1812 0.0293 265 LYS A CD 1878 C CE . LYS A 244 ? 0.9818 0.7322 0.8537 0.0415 0.1813 0.0294 265 LYS A CE 1879 N NZ . LYS A 244 ? 0.9946 0.7340 0.8422 0.0458 0.1765 0.0301 265 LYS A NZ 1880 N N . PRO A 245 ? 0.6988 0.5438 0.7265 0.0176 0.1810 0.0356 266 PRO A N 1881 C CA . PRO A 245 ? 0.6695 0.5238 0.7138 0.0086 0.1778 0.0379 266 PRO A CA 1882 C C . PRO A 245 ? 0.7395 0.5802 0.7579 0.0057 0.1758 0.0416 266 PRO A C 1883 O O . PRO A 245 ? 0.8684 0.6955 0.8621 0.0122 0.1814 0.0431 266 PRO A O 1884 C CB . PRO A 245 ? 0.6561 0.5135 0.7195 0.0104 0.1881 0.0391 266 PRO A CB 1885 C CG . PRO A 245 ? 0.6094 0.4671 0.6797 0.0187 0.1908 0.0375 266 PRO A CG 1886 C CD . PRO A 245 ? 0.6654 0.5097 0.7068 0.0244 0.1890 0.0364 266 PRO A CD 1887 N N . ILE A 246 ? 0.7804 0.6234 0.8038 -0.0029 0.1661 0.0429 267 ILE A N 1888 C CA . ILE A 246 ? 0.7529 0.5832 0.7569 -0.0048 0.1640 0.0476 267 ILE A CA 1889 C C . ILE A 246 ? 0.7140 0.5402 0.7236 -0.0039 0.1777 0.0518 267 ILE A C 1890 O O . ILE A 246 ? 0.7683 0.6045 0.8050 -0.0072 0.1841 0.0502 267 ILE A O 1891 C CB . ILE A 246 ? 0.6882 0.5194 0.7018 -0.0139 0.1517 0.0483 267 ILE A CB 1892 C CG1 . ILE A 246 ? 0.6815 0.5154 0.6944 -0.0149 0.1387 0.0439 267 ILE A CG1 1893 C CG2 . ILE A 246 ? 0.5769 0.3937 0.5694 -0.0134 0.1498 0.0539 267 ILE A CG2 1894 C CD1 . ILE A 246 ? 0.7218 0.5434 0.7057 -0.0121 0.1305 0.0439 267 ILE A CD1 1895 N N . ALA A 247 ? 0.7234 0.5348 0.7079 0.0013 0.1821 0.0569 268 ALA A N 1896 C CA . ALA A 247 ? 0.7432 0.5462 0.7302 0.0032 0.1973 0.0621 268 ALA A CA 1897 C C . ALA A 247 ? 0.8686 0.6731 0.8797 -0.0086 0.1998 0.0639 268 ALA A C 1898 O O . ALA A 247 ? 0.9209 0.7259 0.9347 -0.0155 0.1887 0.0637 268 ALA A O 1899 C CB . ALA A 247 ? 0.7574 0.5437 0.7109 0.0132 0.2002 0.0675 268 ALA A CB 1900 N N . ARG A 248 ? 0.9152 0.7186 0.9435 -0.0112 0.2144 0.0649 269 ARG A N 1901 C CA . ARG A 248 ? 0.9287 0.7312 0.9795 -0.0235 0.2188 0.0650 269 ARG A CA 1902 C C . ARG A 248 ? 0.9455 0.7256 0.9754 -0.0243 0.2225 0.0733 269 ARG A C 1903 O O . ARG A 248 ? 1.0493 0.8242 1.0918 -0.0352 0.2222 0.0731 269 ARG A O 1904 C CB . ARG A 248 ? 1.0256 0.8306 1.0985 -0.0261 0.2351 0.0633 269 ARG A CB 1905 C CG . ARG A 248 ? 1.0910 0.9206 1.2012 -0.0334 0.2288 0.0530 269 ARG A CG 1906 C CD . ARG A 248 ? 1.2406 1.0708 1.3717 -0.0360 0.2450 0.0509 269 ARG A CD 1907 N NE . ARG A 248 ? 1.3444 1.1675 1.4628 -0.0233 0.2552 0.0546 269 ARG A NE 1908 C CZ . ARG A 248 ? 1.3841 1.2203 1.5189 -0.0180 0.2539 0.0495 269 ARG A CZ 1909 N NH1 . ARG A 248 ? 1.4088 1.2676 1.5730 -0.0232 0.2421 0.0405 269 ARG A NH1 1910 N NH2 . ARG A 248 ? 1.3686 1.1936 1.4887 -0.0064 0.2632 0.0537 269 ARG A NH2 1911 N N . LYS A 249 ? 0.9114 0.6777 0.9085 -0.0116 0.2254 0.0799 270 LYS A N 1912 C CA . LYS A 249 ? 0.8679 0.6130 0.8425 -0.0081 0.2291 0.0887 270 LYS A CA 1913 C C . LYS A 249 ? 0.7985 0.5456 0.7656 -0.0101 0.2104 0.0878 270 LYS A C 1914 O O . LYS A 249 ? 0.8071 0.5385 0.7626 -0.0094 0.2108 0.0940 270 LYS A O 1915 C CB . LYS A 249 ? 0.8438 0.5773 0.7863 0.0093 0.2365 0.0946 270 LYS A CB 1916 C CG . LYS A 249 ? 0.8817 0.6241 0.8012 0.0199 0.2195 0.0910 270 LYS A CG 1917 C CD . LYS A 249 ? 0.9517 0.6908 0.8503 0.0352 0.2248 0.0905 270 LYS A CD 1918 C CE . LYS A 249 ? 0.9494 0.6949 0.8238 0.0455 0.2073 0.0856 270 LYS A CE 1919 N NZ . LYS A 249 ? 0.9450 0.6904 0.8062 0.0565 0.2073 0.0805 270 LYS A NZ 1920 N N . ALA A 250 ? 0.7082 0.4731 0.6815 -0.0115 0.1948 0.0805 271 ALA A N 1921 C CA . ALA A 250 ? 0.8262 0.5932 0.7947 -0.0138 0.1771 0.0787 271 ALA A CA 1922 C C . ALA A 250 ? 0.8001 0.5648 0.7908 -0.0262 0.1740 0.0764 271 ALA A C 1923 O O . ALA A 250 ? 0.7918 0.5658 0.8099 -0.0361 0.1775 0.0713 271 ALA A O 1924 C CB . ALA A 250 ? 0.8128 0.5963 0.7833 -0.0130 0.1639 0.0712 271 ALA A CB 1925 N N . ARG A 251 ? 0.7704 0.5262 0.7495 -0.0237 0.1666 0.0782 272 ARG A N 1926 C CA . ARG A 251 ? 0.8983 0.6528 0.8943 -0.0328 0.1609 0.0732 272 ARG A CA 1927 C C . ARG A 251 ? 0.8431 0.6084 0.8373 -0.0314 0.1409 0.0673 272 ARG A C 1928 O O . ARG A 251 ? 0.8174 0.5865 0.7940 -0.0232 0.1330 0.0688 272 ARG A O 1929 C CB . ARG A 251 ? 0.9669 0.6987 0.9511 -0.0309 0.1712 0.0798 272 ARG A CB 1930 C CG . ARG A 251 ? 1.1086 0.8244 1.0801 -0.0254 0.1916 0.0891 272 ARG A CG 1931 C CD . ARG A 251 ? 1.2908 0.9806 1.2511 -0.0236 0.2030 0.0959 272 ARG A CD 1932 N NE . ARG A 251 ? 1.3951 1.0790 1.3791 -0.0393 0.2060 0.0891 272 ARG A NE 1933 C CZ . ARG A 251 ? 1.3858 1.0505 1.3650 -0.0413 0.2081 0.0899 272 ARG A CZ 1934 N NH1 . ARG A 251 ? 1.3991 1.0500 1.3517 -0.0272 0.2073 0.0985 272 ARG A NH1 1935 N NH2 . ARG A 251 ? 1.3140 0.9747 1.3151 -0.0568 0.2104 0.0814 272 ARG A NH2 1936 N N . ARG A 252 ? 0.8366 0.6071 0.8487 -0.0395 0.1331 0.0602 273 ARG A N 1937 C CA . ARG A 252 ? 0.7804 0.5594 0.7903 -0.0374 0.1157 0.0549 273 ARG A CA 1938 C C . ARG A 252 ? 0.7385 0.5062 0.7459 -0.0390 0.1138 0.0543 273 ARG A C 1939 O O . ARG A 252 ? 0.7540 0.5123 0.7726 -0.0470 0.1222 0.0530 273 ARG A O 1940 C CB . ARG A 252 ? 0.7080 0.5053 0.7389 -0.0430 0.1064 0.0464 273 ARG A CB 1941 C CG . ARG A 252 ? 0.8057 0.6119 0.8394 -0.0413 0.1097 0.0470 273 ARG A CG 1942 C CD . ARG A 252 ? 0.8898 0.7115 0.9503 -0.0480 0.1072 0.0406 273 ARG A CD 1943 N NE . ARG A 252 ? 0.9592 0.7885 1.0217 -0.0450 0.1100 0.0413 273 ARG A NE 1944 C CZ . ARG A 252 ? 0.9420 0.7705 1.0052 -0.0444 0.1239 0.0455 273 ARG A CZ 1945 N NH1 . ARG A 252 ? 0.9689 0.7885 1.0307 -0.0464 0.1366 0.0497 273 ARG A NH1 1946 N NH2 . ARG A 252 ? 0.8424 0.6816 0.9060 -0.0385 0.1256 0.0436 273 ARG A NH2 1947 N N . HIS A 253 ? 0.7612 0.5291 0.7542 -0.0318 0.1040 0.0550 274 HIS A N 1948 C CA . HIS A 253 ? 0.8494 0.6052 0.8376 -0.0315 0.1030 0.0552 274 HIS A CA 1949 C C . HIS A 253 ? 0.7943 0.5621 0.7841 -0.0304 0.0874 0.0488 274 HIS A C 1950 O O . HIS A 253 ? 0.6998 0.4839 0.6917 -0.0287 0.0776 0.0453 274 HIS A O 1951 C CB . HIS A 253 ? 0.8640 0.6042 0.8298 -0.0211 0.1107 0.0653 274 HIS A CB 1952 C CG . HIS A 253 ? 0.9800 0.7084 0.9390 -0.0190 0.1267 0.0733 274 HIS A CG 1953 N ND1 . HIS A 253 ? 1.0282 0.7410 0.9966 -0.0272 0.1417 0.0743 274 HIS A ND1 1954 C CD2 . HIS A 253 ? 1.0405 0.7703 0.9835 -0.0096 0.1308 0.0801 274 HIS A CD2 1955 C CE1 . HIS A 253 ? 1.1142 0.8186 1.0724 -0.0222 0.1554 0.0824 274 HIS A CE1 1956 N NE2 . HIS A 253 ? 1.1168 0.8316 1.0584 -0.0107 0.1485 0.0860 274 HIS A NE2 1957 N N . LYS A 254 ? 0.7369 0.4941 0.7240 -0.0310 0.0865 0.0478 275 LYS A N 1958 C CA . LYS A 254 ? 0.6748 0.4408 0.6609 -0.0288 0.0737 0.0428 275 LYS A CA 1959 C C . LYS A 254 ? 0.5747 0.3593 0.5750 -0.0334 0.0631 0.0350 275 LYS A C 1960 O O . LYS A 254 ? 0.4995 0.2977 0.4969 -0.0290 0.0547 0.0337 275 LYS A O 1961 C CB . LYS A 254 ? 0.6788 0.4495 0.6494 -0.0185 0.0691 0.0474 275 LYS A CB 1962 C CG . LYS A 254 ? 0.7531 0.5073 0.7085 -0.0107 0.0791 0.0568 275 LYS A CG 1963 C CD . LYS A 254 ? 0.8942 0.6570 0.8371 -0.0004 0.0730 0.0606 275 LYS A CD 1964 C CE . LYS A 254 ? 1.0708 0.8184 0.9981 0.0100 0.0833 0.0706 275 LYS A CE 1965 N NZ . LYS A 254 ? 1.1026 0.8266 1.0293 0.0075 0.0932 0.0719 275 LYS A NZ 1966 N N . SER A 255 ? 0.5364 0.3206 0.5522 -0.0423 0.0644 0.0296 276 SER A N 1967 C CA . SER A 255 ? 0.6596 0.4601 0.6897 -0.0457 0.0547 0.0229 276 SER A CA 1968 C C . SER A 255 ? 0.6832 0.4971 0.7129 -0.0408 0.0521 0.0246 276 SER A C 1969 O O . SER A 255 ? 0.6315 0.4558 0.6616 -0.0378 0.0429 0.0216 276 SER A O 1970 C CB . SER A 255 ? 0.6161 0.4181 0.6422 -0.0441 0.0439 0.0184 276 SER A CB 1971 O OG . SER A 255 ? 0.5589 0.3433 0.5784 -0.0465 0.0482 0.0181 276 SER A OG 1972 N N . ASN A 256 ? 0.6846 0.4950 0.7117 -0.0401 0.0617 0.0296 277 ASN A N 1973 C CA . ASN A 256 ? 0.6807 0.4995 0.7063 -0.0366 0.0620 0.0309 277 ASN A CA 1974 C C . ASN A 256 ? 0.5730 0.3946 0.5820 -0.0294 0.0561 0.0324 277 ASN A C 1975 O O . ASN A 256 ? 0.5875 0.4139 0.5938 -0.0275 0.0557 0.0319 277 ASN A O 1976 C CB . ASN A 256 ? 0.7734 0.6043 0.8167 -0.0400 0.0577 0.0259 277 ASN A CB 1977 C CG . ASN A 256 ? 0.9148 0.7469 0.9766 -0.0474 0.0667 0.0255 277 ASN A CG 1978 O OD1 . ASN A 256 ? 0.9907 0.8288 1.0604 -0.0476 0.0715 0.0263 277 ASN A OD1 1979 N ND2 . ASN A 256 ? 0.9264 0.7522 0.9952 -0.0541 0.0704 0.0237 277 ASN A ND2 1980 N N . GLY A 257 ? 0.4345 0.2520 0.4326 -0.0260 0.0523 0.0335 278 GLY A N 1981 C CA . GLY A 257 ? 0.5096 0.3304 0.4942 -0.0207 0.0475 0.0347 278 GLY A CA 1982 C C . GLY A 257 ? 0.5408 0.3557 0.5132 -0.0173 0.0540 0.0405 278 GLY A C 1983 O O . GLY A 257 ? 0.4592 0.2768 0.4213 -0.0144 0.0502 0.0406 278 GLY A O 1984 N N . ILE A 258 ? 0.4812 0.2866 0.4537 -0.0180 0.0646 0.0452 279 ILE A N 1985 C CA . ILE A 258 ? 0.5787 0.3769 0.5361 -0.0129 0.0719 0.0523 279 ILE A CA 1986 C C . ILE A 258 ? 0.6476 0.4416 0.6096 -0.0157 0.0830 0.0545 279 ILE A C 1987 O O . ILE A 258 ? 0.5950 0.3848 0.5705 -0.0212 0.0903 0.0543 279 ILE A O 1988 C CB . ILE A 258 ? 0.7063 0.4933 0.6522 -0.0069 0.0767 0.0593 279 ILE A CB 1989 C CG1 . ILE A 258 ? 0.7355 0.5288 0.6733 -0.0013 0.0666 0.0590 279 ILE A CG1 1990 C CG2 . ILE A 258 ? 0.7725 0.5510 0.7036 -0.0005 0.0875 0.0676 279 ILE A CG2 1991 C CD1 . ILE A 258 ? 0.8363 0.6200 0.7651 0.0060 0.0710 0.0654 279 ILE A CD1 1992 N N . LEU A 259 ? 0.6519 0.4471 0.6028 -0.0126 0.0848 0.0562 280 LEU A N 1993 C CA . LEU A 259 ? 0.5808 0.3715 0.5315 -0.0131 0.0973 0.0598 280 LEU A CA 1994 C C . LEU A 259 ? 0.5889 0.3711 0.5167 -0.0040 0.1046 0.0680 280 LEU A C 1995 O O . LEU A 259 ? 0.6116 0.3970 0.5215 0.0021 0.0979 0.0685 280 LEU A O 1996 C CB . LEU A 259 ? 0.5695 0.3665 0.5233 -0.0152 0.0957 0.0554 280 LEU A CB 1997 C CG . LEU A 259 ? 0.6131 0.4069 0.5663 -0.0150 0.1095 0.0589 280 LEU A CG 1998 C CD1 . LEU A 259 ? 0.6109 0.4070 0.5884 -0.0215 0.1182 0.0587 280 LEU A CD1 1999 C CD2 . LEU A 259 ? 0.5153 0.3155 0.4662 -0.0141 0.1075 0.0532 280 LEU A CD2 2000 N N . GLU A 260 ? 0.5976 0.3697 0.5261 -0.0030 0.1181 0.0739 281 GLU A N 2001 C CA . GLU A 260 ? 0.6822 0.4456 0.5887 0.0078 0.1275 0.0821 281 GLU A CA 2002 C C . GLU A 260 ? 0.7289 0.4920 0.6329 0.0092 0.1395 0.0830 281 GLU A C 2003 O O . GLU A 260 ? 0.7244 0.4848 0.6467 0.0010 0.1493 0.0828 281 GLU A O 2004 C CB . GLU A 260 ? 0.7616 0.5097 0.6678 0.0097 0.1379 0.0885 281 GLU A CB 2005 C CG . GLU A 260 ? 0.9754 0.7216 0.8655 0.0204 0.1320 0.0924 281 GLU A CG 2006 C CD . GLU A 260 ? 1.2048 0.9305 1.0893 0.0250 0.1467 0.1007 281 GLU A CD 2007 O OE1 . GLU A 260 ? 1.2754 0.9882 1.1582 0.0250 0.1632 0.1057 281 GLU A OE1 2008 O OE2 . GLU A 260 ? 1.2702 0.9911 1.1516 0.0285 0.1430 0.1023 281 GLU A OE2 2009 N N . ILE A 261 ? 0.8059 0.5760 0.6896 0.0206 0.1376 0.0807 282 ILE A N 2010 C CA . ILE A 261 ? 0.7872 0.5563 0.6655 0.0260 0.1495 0.0800 282 ILE A CA 2011 C C . ILE A 261 ? 0.7465 0.5075 0.6039 0.0411 0.1573 0.0856 282 ILE A C 2012 O O . ILE A 261 ? 0.6846 0.4539 0.5255 0.0523 0.1473 0.0815 282 ILE A O 2013 C CB . ILE A 261 ? 0.6927 0.4736 0.5652 0.0274 0.1413 0.0703 282 ILE A CB 2014 C CG1 . ILE A 261 ? 0.6256 0.4134 0.5163 0.0149 0.1327 0.0655 282 ILE A CG1 2015 C CG2 . ILE A 261 ? 0.6684 0.4458 0.5388 0.0325 0.1544 0.0695 282 ILE A CG2 2016 C CD1 . ILE A 261 ? 0.6211 0.4169 0.5020 0.0157 0.1220 0.0564 282 ILE A CD1 2017 N N . PRO A 262 ? 0.8347 0.5798 0.6951 0.0414 0.1753 0.0941 283 PRO A N 2018 C CA . PRO A 262 ? 0.8798 0.6123 0.7208 0.0566 0.1865 0.1015 283 PRO A CA 2019 C C . PRO A 262 ? 0.8566 0.5914 0.6850 0.0686 0.1908 0.0977 283 PRO A C 2020 O O . PRO A 262 ? 0.8018 0.5420 0.6402 0.0622 0.1915 0.0920 283 PRO A O 2021 C CB . PRO A 262 ? 0.8763 0.5875 0.7290 0.0483 0.2066 0.1109 283 PRO A CB 2022 C CG . PRO A 262 ? 0.9236 0.6407 0.8053 0.0284 0.2026 0.1061 283 PRO A CG 2023 C CD . PRO A 262 ? 0.9227 0.6612 0.8080 0.0268 0.1867 0.0959 283 PRO A CD 2024 N N . ASN A 263 ? 0.9051 0.6355 0.7134 0.0869 0.1932 0.1003 284 ASN A N 2025 C CA . ASN A 263 ? 0.9166 0.6447 0.7133 0.1003 0.1978 0.0973 284 ASN A CA 2026 C C . ASN A 263 ? 0.8348 0.5751 0.6369 0.0951 0.1858 0.0858 284 ASN A C 2027 O O . ASN A 263 ? 0.8106 0.5449 0.6189 0.0913 0.1961 0.0857 284 ASN A O 2028 C CB . ASN A 263 ? 0.9872 0.6940 0.7848 0.1010 0.2228 0.1071 284 ASN A CB 2029 C CG . ASN A 263 ? 1.0842 0.7839 0.8666 0.1185 0.2293 0.1067 284 ASN A CG 2030 O OD1 . ASN A 263 ? 1.0634 0.7539 0.8512 0.1160 0.2428 0.1081 284 ASN A OD1 2031 N ND2 . ASN A 263 ? 1.1349 0.8360 0.8934 0.1349 0.2220 0.1102 284 ASN A ND2 2032 N N . PHE A 264 ? 0.8308 0.5852 0.6272 0.0936 0.1666 0.0797 285 PHE A N 2033 C CA . PHE A 264 ? 0.8187 0.5786 0.6119 0.0849 0.1577 0.0744 285 PHE A CA 2034 C C . PHE A 264 ? 0.8853 0.6336 0.6507 0.0919 0.1671 0.0828 285 PHE A C 2035 O O . PHE A 264 ? 0.8634 0.6046 0.5948 0.1043 0.1726 0.0963 285 PHE A O 2036 C CB . PHE A 264 ? 0.8512 0.6222 0.6300 0.0802 0.1400 0.0752 285 PHE A CB 2037 C CG . PHE A 264 ? 0.8516 0.6290 0.6353 0.0684 0.1304 0.0651 285 PHE A CG 2038 C CD1 . PHE A 264 ? 0.7943 0.5811 0.6111 0.0578 0.1245 0.0513 285 PHE A CD1 2039 C CD2 . PHE A 264 ? 0.9049 0.6811 0.6571 0.0691 0.1279 0.0679 285 PHE A CD2 2040 C CE1 . PHE A 264 ? 0.8282 0.6182 0.6484 0.0488 0.1173 0.0427 285 PHE A CE1 2041 C CE2 . PHE A 264 ? 0.8841 0.6638 0.6402 0.0584 0.1211 0.0575 285 PHE A CE2 2042 C CZ . PHE A 264 ? 0.8845 0.6684 0.6756 0.0485 0.1162 0.0461 285 PHE A CZ 2043 N N . GLN A 265 ? 0.8609 0.6085 0.6386 0.0854 0.1692 0.0746 286 GLN A N 2044 C CA . GLN A 265 ? 0.8084 0.5457 0.5607 0.0914 0.1792 0.0810 286 GLN A CA 2045 C C . GLN A 265 ? 0.8848 0.6270 0.6348 0.0822 0.1717 0.0723 286 GLN A C 2046 O O . GLN A 265 ? 0.8132 0.5640 0.5871 0.0718 0.1609 0.0615 286 GLN A O 2047 C CB . GLN A 265 ? 0.7868 0.5124 0.5585 0.0967 0.1962 0.0814 286 GLN A CB 2048 C CG . GLN A 265 ? 0.9622 0.6794 0.7356 0.1065 0.2071 0.0888 286 GLN A CG 2049 C CD . GLN A 265 ? 1.0827 0.7923 0.8097 0.1201 0.2107 0.1059 286 GLN A CD 2050 O OE1 . GLN A 265 ? 1.0486 0.7554 0.7388 0.1264 0.2130 0.1135 286 GLN A OE1 2051 N NE2 . GLN A 265 ? 1.0907 0.7989 0.8171 0.1263 0.2111 0.1111 286 GLN A NE2 2052 N N . GLN A 266 ? 0.9855 0.7214 0.7041 0.0872 0.1788 0.0762 287 GLN A N 2053 C CA . GLN A 266 ? 1.0002 0.7388 0.7102 0.0800 0.1739 0.0669 287 GLN A CA 2054 C C . GLN A 266 ? 0.8535 0.5919 0.6071 0.0706 0.1718 0.0564 287 GLN A C 2055 O O . GLN A 266 ? 0.9113 0.6537 0.6684 0.0620 0.1627 0.0475 287 GLN A O 2056 C CB . GLN A 266 ? 1.1917 0.9219 0.8662 0.0887 0.1863 0.0707 287 GLN A CB 2057 C CG . GLN A 266 ? 1.3351 1.0650 0.9998 0.0828 0.1846 0.0591 287 GLN A CG 2058 C CD . GLN A 266 ? 1.4598 1.2018 1.0988 0.0768 0.1694 0.0486 287 GLN A CD 2059 O OE1 . GLN A 266 ? 1.5103 1.2550 1.1068 0.0818 0.1689 0.0434 287 GLN A OE1 2060 N NE2 . GLN A 266 ? 1.4784 1.2283 1.1431 0.0664 0.1562 0.0434 287 GLN A NE2 2061 N N . GLU A 267 ? 0.8426 0.5771 0.6282 0.0736 0.1801 0.0563 288 GLU A N 2062 C CA . GLU A 267 ? 0.9336 0.6710 0.7576 0.0687 0.1777 0.0459 288 GLU A CA 2063 C C . GLU A 267 ? 0.9137 0.6661 0.7530 0.0579 0.1695 0.0411 288 GLU A C 2064 O O . GLU A 267 ? 0.9573 0.7157 0.8108 0.0504 0.1714 0.0382 288 GLU A O 2065 C CB . GLU A 267 ? 0.9824 0.7177 0.8254 0.0718 0.1949 0.0517 288 GLU A CB 2066 C CG . GLU A 267 ? 1.1901 0.9092 1.0179 0.0845 0.2048 0.0581 288 GLU A CG 2067 C CD . GLU A 267 ? 1.2778 0.9936 1.0885 0.0910 0.2104 0.0670 288 GLU A CD 2068 O OE1 . GLU A 267 ? 1.2478 0.9686 1.0780 0.0884 0.2142 0.0673 288 GLU A OE1 2069 O OE2 . GLU A 267 ? 1.3307 1.0397 1.0995 0.0976 0.2157 0.0779 288 GLU A OE2 2070 N N . ASP A 268 ? 0.8534 0.6118 0.6876 0.0578 0.1619 0.0424 289 ASP A N 2071 C CA . ASP A 268 ? 0.8290 0.6001 0.6738 0.0473 0.1557 0.0417 289 ASP A CA 2072 C C . ASP A 268 ? 0.8562 0.6301 0.6904 0.0429 0.1394 0.0334 289 ASP A C 2073 O O . ASP A 268 ? 0.8240 0.6069 0.6656 0.0343 0.1333 0.0326 289 ASP A O 2074 C CB . ASP A 268 ? 0.7725 0.5459 0.6163 0.0494 0.1559 0.0487 289 ASP A CB 2075 C CG . ASP A 268 ? 0.8978 0.6651 0.7517 0.0517 0.1736 0.0576 289 ASP A CG 2076 O OD1 . ASP A 268 ? 1.0146 0.7828 0.8863 0.0470 0.1843 0.0582 289 ASP A OD1 2077 O OD2 . ASP A 268 ? 0.8952 0.6565 0.7402 0.0586 0.1772 0.0639 289 ASP A OD2 2078 N N . ALA A 269 ? 0.8132 0.5780 0.6246 0.0459 0.1357 0.0324 290 ALA A N 2079 C CA . ALA A 269 ? 0.7164 0.4831 0.5098 0.0381 0.1251 0.0284 290 ALA A CA 2080 C C . ALA A 269 ? 0.6924 0.4556 0.5053 0.0315 0.1224 0.0181 290 ALA A C 2081 O O . ALA A 269 ? 0.6603 0.4195 0.4845 0.0334 0.1340 0.0191 290 ALA A O 2082 C CB . ALA A 269 ? 0.7173 0.4819 0.4671 0.0414 0.1276 0.0322 290 ALA A CB 2083 N N . GLY A 270 ? 0.6628 0.4283 0.4723 0.0230 0.1121 0.0124 291 GLY A N 2084 C CA . GLY A 270 ? 0.6264 0.3862 0.4401 0.0160 0.1161 0.0078 291 GLY A CA 2085 C C . GLY A 270 ? 0.6177 0.3853 0.4361 0.0077 0.1116 0.0045 291 GLY A C 2086 O O . GLY A 270 ? 0.5807 0.3577 0.3993 0.0062 0.1015 0.0051 291 GLY A O 2087 N N . SER A 271 ? 0.6468 0.4100 0.4691 0.0033 0.1194 0.0020 292 SER A N 2088 C CA . SER A 271 ? 0.6814 0.4454 0.5171 -0.0041 0.1116 0.0005 292 SER A CA 2089 C C . SER A 271 ? 0.5723 0.3461 0.4372 -0.0044 0.1107 0.0099 292 SER A C 2090 O O . SER A 271 ? 0.5618 0.3387 0.4430 -0.0012 0.1201 0.0140 292 SER A O 2091 C CB . SER A 271 ? 0.7322 0.4858 0.5690 -0.0046 0.1152 -0.0097 292 SER A CB 2092 O OG . SER A 271 ? 0.8472 0.5985 0.6992 -0.0094 0.1062 -0.0127 292 SER A OG 2093 N N . TYR A 272 ? 0.4870 0.2670 0.3589 -0.0082 0.0994 0.0125 293 TYR A N 2094 C CA . TYR A 272 ? 0.5114 0.2987 0.4088 -0.0096 0.0973 0.0196 293 TYR A CA 2095 C C . TYR A 272 ? 0.5527 0.3365 0.4634 -0.0141 0.0877 0.0159 293 TYR A C 2096 O O . TYR A 272 ? 0.4918 0.2711 0.3923 -0.0172 0.0800 0.0098 293 TYR A O 2097 C CB . TYR A 272 ? 0.5267 0.3217 0.4219 -0.0085 0.0941 0.0262 293 TYR A CB 2098 C CG . TYR A 272 ? 0.6085 0.4072 0.5009 -0.0028 0.1055 0.0312 293 TYR A CG 2099 C CD1 . TYR A 272 ? 0.6980 0.4945 0.5682 0.0039 0.1106 0.0277 293 TYR A CD1 2100 C CD2 . TYR A 272 ? 0.5146 0.3172 0.4271 -0.0040 0.1110 0.0379 293 TYR A CD2 2101 C CE1 . TYR A 272 ? 0.6397 0.4363 0.5089 0.0109 0.1210 0.0312 293 TYR A CE1 2102 C CE2 . TYR A 272 ? 0.5524 0.3561 0.4641 0.0011 0.1229 0.0419 293 TYR A CE2 2103 C CZ . TYR A 272 ? 0.6182 0.4184 0.5081 0.0093 0.1281 0.0389 293 TYR A CZ 2104 O OH . TYR A 272 ? 0.6430 0.4407 0.5326 0.0156 0.1399 0.0427 293 TYR A OH 2105 N N . GLU A 273 ? 0.5577 0.3451 0.4913 -0.0141 0.0884 0.0188 294 GLU A N 2106 C CA . GLU A 273 ? 0.4721 0.2562 0.4165 -0.0162 0.0800 0.0159 294 GLU A CA 2107 C C . GLU A 273 ? 0.5007 0.2950 0.4627 -0.0181 0.0743 0.0208 294 GLU A C 2108 O O . GLU A 273 ? 0.5207 0.3211 0.4950 -0.0185 0.0793 0.0259 294 GLU A O 2109 C CB . GLU A 273 ? 0.4711 0.2504 0.4234 -0.0119 0.0847 0.0124 294 GLU A CB 2110 C CG . GLU A 273 ? 0.5164 0.2813 0.4505 -0.0107 0.0878 0.0041 294 GLU A CG 2111 C CD . GLU A 273 ? 0.6670 0.4257 0.6077 -0.0037 0.0944 0.0020 294 GLU A CD 2112 O OE1 . GLU A 273 ? 0.7062 0.4765 0.6667 0.0008 0.0962 0.0073 294 GLU A OE1 2113 O OE2 . GLU A 273 ? 0.7524 0.4958 0.6790 -0.0024 0.0981 -0.0052 294 GLU A OE2 2114 N N . CYS A 274 ? 0.4955 0.2974 0.4583 -0.0190 0.0648 0.0176 295 CYS A N 2115 C CA . CYS A 274 ? 0.5782 0.3943 0.5574 -0.0190 0.0592 0.0189 295 CYS A CA 2116 C C . CYS A 274 ? 0.5329 0.3522 0.5194 -0.0167 0.0547 0.0154 295 CYS A C 2117 O O . CYS A 274 ? 0.4288 0.2417 0.4052 -0.0160 0.0537 0.0115 295 CYS A O 2118 C CB . CYS A 274 ? 0.6733 0.4945 0.6472 -0.0203 0.0531 0.0206 295 CYS A CB 2119 S SG . CYS A 274 ? 0.9202 0.7425 0.8841 -0.0208 0.0444 0.0164 295 CYS A SG 2120 N N . VAL A 275 ? 0.5484 0.3755 0.5522 -0.0159 0.0527 0.0167 296 VAL A N 2121 C CA . VAL A 275 ? 0.5357 0.3638 0.5461 -0.0119 0.0489 0.0150 296 VAL A CA 2122 C C . VAL A 275 ? 0.5209 0.3581 0.5374 -0.0130 0.0399 0.0149 296 VAL A C 2123 O O . VAL A 275 ? 0.4435 0.2866 0.4713 -0.0163 0.0380 0.0161 296 VAL A O 2124 C CB . VAL A 275 ? 0.5571 0.3831 0.5830 -0.0086 0.0536 0.0166 296 VAL A CB 2125 C CG1 . VAL A 275 ? 0.5604 0.3854 0.5915 -0.0017 0.0488 0.0160 296 VAL A CG1 2126 C CG2 . VAL A 275 ? 0.5328 0.3468 0.5512 -0.0063 0.0640 0.0170 296 VAL A CG2 2127 N N . ALA A 276 ? 0.4604 0.2965 0.4684 -0.0107 0.0353 0.0132 297 ALA A N 2128 C CA . ALA A 276 ? 0.4035 0.2452 0.4143 -0.0107 0.0275 0.0131 297 ALA A CA 2129 C C . ALA A 276 ? 0.3947 0.2328 0.4097 -0.0051 0.0245 0.0131 297 ALA A C 2130 O O . ALA A 276 ? 0.3986 0.2288 0.4051 -0.0005 0.0278 0.0129 297 ALA A O 2131 C CB . ALA A 276 ? 0.3764 0.2184 0.3743 -0.0119 0.0252 0.0122 297 ALA A CB 2132 N N . GLU A 277 ? 0.3298 0.1714 0.3569 -0.0053 0.0186 0.0131 298 GLU A N 2133 C CA . GLU A 277 ? 0.4674 0.3046 0.4987 0.0022 0.0143 0.0133 298 GLU A CA 2134 C C . GLU A 277 ? 0.4219 0.2595 0.4533 0.0021 0.0047 0.0118 298 GLU A C 2135 O O . GLU A 277 ? 0.3507 0.1924 0.3889 -0.0053 0.0014 0.0099 298 GLU A O 2136 C CB . GLU A 277 ? 0.4628 0.3004 0.5122 0.0049 0.0161 0.0137 298 GLU A CB 2137 C CG . GLU A 277 ? 0.7229 0.5638 0.7760 0.0182 0.0121 0.0143 298 GLU A CG 2138 C CD . GLU A 277 ? 0.9289 0.7930 1.0004 0.0225 0.0158 0.0140 298 GLU A CD 2139 O OE1 . GLU A 277 ? 0.9801 0.8529 1.0662 0.0134 0.0197 0.0128 298 GLU A OE1 2140 O OE2 . GLU A 277 ? 1.0144 0.8896 1.0854 0.0349 0.0161 0.0155 298 GLU A OE2 2141 N N . ASN A 278 ? 0.3891 0.2209 0.4106 0.0108 0.0015 0.0127 299 ASN A N 2142 C CA . ASN A 278 ? 0.3820 0.2112 0.4034 0.0147 -0.0085 0.0110 299 ASN A CA 2143 C C . ASN A 278 ? 0.5842 0.4114 0.6029 0.0304 -0.0111 0.0131 299 ASN A C 2144 O O . ASN A 278 ? 0.5389 0.3674 0.5584 0.0369 -0.0043 0.0159 299 ASN A O 2145 C CB . ASN A 278 ? 0.3683 0.1946 0.3744 0.0112 -0.0103 0.0105 299 ASN A CB 2146 C CG . ASN A 278 ? 0.4147 0.2351 0.4025 0.0162 -0.0045 0.0134 299 ASN A CG 2147 O OD1 . ASN A 278 ? 0.3968 0.2130 0.3806 0.0231 0.0006 0.0157 299 ASN A OD1 2148 N ND2 . ASN A 278 ? 0.3220 0.1405 0.2987 0.0130 -0.0040 0.0132 299 ASN A ND2 2149 N N . SER A 279 ? 0.5858 0.4202 0.5998 0.0365 -0.0205 0.0113 300 SER A N 2150 C CA . SER A 279 ? 0.6174 0.4701 0.6271 0.0500 -0.0244 0.0122 300 SER A CA 2151 C C . SER A 279 ? 0.5294 0.3628 0.5187 0.0606 -0.0144 0.0190 300 SER A C 2152 O O . SER A 279 ? 0.5895 0.4347 0.5732 0.0718 -0.0131 0.0211 300 SER A O 2153 C CB . SER A 279 ? 0.6271 0.4918 0.6301 0.0527 -0.0366 0.0076 300 SER A CB 2154 O OG . SER A 279 ? 0.6409 0.4791 0.6242 0.0525 -0.0352 0.0098 300 SER A OG 2155 N N . ARG A 280 ? 0.4508 0.2654 0.4280 0.0528 -0.0062 0.0205 301 ARG A N 2156 C CA . ARG A 280 ? 0.4644 0.2662 0.4215 0.0576 0.0047 0.0244 301 ARG A CA 2157 C C . ARG A 280 ? 0.5194 0.3159 0.4793 0.0540 0.0163 0.0251 301 ARG A C 2158 O O . ARG A 280 ? 0.5518 0.3336 0.4970 0.0572 0.0271 0.0276 301 ARG A O 2159 C CB . ARG A 280 ? 0.5667 0.3589 0.5101 0.0504 0.0069 0.0238 301 ARG A CB 2160 C CG . ARG A 280 ? 0.8711 0.6470 0.7931 0.0571 0.0174 0.0278 301 ARG A CG 2161 C CD . ARG A 280 ? 0.9404 0.7142 0.8476 0.0725 0.0133 0.0310 301 ARG A CD 2162 N NE . ARG A 280 ? 0.7931 0.5809 0.7081 0.0741 -0.0021 0.0275 301 ARG A NE 2163 C CZ . ARG A 280 ? 0.8165 0.6190 0.7344 0.0859 -0.0111 0.0272 301 ARG A CZ 2164 N NH1 . ARG A 280 ? 0.7531 0.5596 0.6650 0.0977 -0.0054 0.0309 301 ARG A NH1 2165 N NH2 . ARG A 280 ? 0.8891 0.7076 0.8149 0.0841 -0.0251 0.0213 301 ARG A NH2 2166 N N . GLY A 281 ? 0.4421 0.2477 0.4198 0.0475 0.0151 0.0227 302 GLY A N 2167 C CA . GLY A 281 ? 0.5395 0.3395 0.5181 0.0447 0.0257 0.0226 302 GLY A CA 2168 C C . GLY A 281 ? 0.5733 0.3802 0.5630 0.0315 0.0258 0.0191 302 GLY A C 2169 O O . GLY A 281 ? 0.5113 0.3282 0.5121 0.0252 0.0182 0.0173 302 GLY A O 2170 N N . LYS A 282 ? 0.5689 0.3684 0.5533 0.0278 0.0352 0.0180 303 LYS A N 2171 C CA . LYS A 282 ? 0.5328 0.3392 0.5245 0.0179 0.0362 0.0153 303 LYS A CA 2172 C C . LYS A 282 ? 0.5380 0.3359 0.5168 0.0116 0.0436 0.0126 303 LYS A C 2173 O O . LYS A 282 ? 0.5462 0.3288 0.5128 0.0146 0.0510 0.0121 303 LYS A O 2174 C CB . LYS A 282 ? 0.5970 0.4071 0.6034 0.0216 0.0384 0.0163 303 LYS A CB 2175 C CG . LYS A 282 ? 0.7898 0.5875 0.7893 0.0270 0.0494 0.0163 303 LYS A CG 2176 C CD . LYS A 282 ? 0.9521 0.7557 0.9684 0.0351 0.0516 0.0182 303 LYS A CD 2177 C CE . LYS A 282 ? 1.0015 0.8175 1.0365 0.0271 0.0460 0.0179 303 LYS A CE 2178 N NZ . LYS A 282 ? 0.9975 0.8412 1.0537 0.0323 0.0474 0.0184 303 LYS A NZ 2179 N N . ASN A 283 ? 0.4235 0.2301 0.4045 0.0032 0.0417 0.0107 304 ASN A N 2180 C CA . ASN A 283 ? 0.4230 0.2238 0.3928 -0.0030 0.0459 0.0073 304 ASN A CA 2181 C C . ASN A 283 ? 0.4517 0.2560 0.4241 -0.0067 0.0477 0.0066 304 ASN A C 2182 O O . ASN A 283 ? 0.3961 0.2114 0.3789 -0.0076 0.0441 0.0088 304 ASN A O 2183 C CB . ASN A 283 ? 0.3683 0.1762 0.3349 -0.0075 0.0405 0.0067 304 ASN A CB 2184 C CG . ASN A 283 ? 0.6046 0.4044 0.5604 -0.0132 0.0446 0.0029 304 ASN A CG 2185 O OD1 . ASN A 283 ? 0.7755 0.5598 0.7234 -0.0134 0.0522 0.0003 304 ASN A OD1 2186 N ND2 . ASN A 283 ? 0.5042 0.3131 0.4602 -0.0180 0.0399 0.0021 304 ASN A ND2 2187 N N . VAL A 284 ? 0.5586 0.3506 0.5203 -0.0090 0.0544 0.0032 305 VAL A N 2188 C CA . VAL A 284 ? 0.5120 0.3023 0.4718 -0.0115 0.0576 0.0026 305 VAL A CA 2189 C C . VAL A 284 ? 0.5380 0.3244 0.4847 -0.0186 0.0567 -0.0014 305 VAL A C 2190 O O . VAL A 284 ? 0.5710 0.3469 0.5076 -0.0220 0.0590 -0.0066 305 VAL A O 2191 C CB . VAL A 284 ? 0.5790 0.3551 0.5370 -0.0065 0.0670 0.0017 305 VAL A CB 2192 C CG1 . VAL A 284 ? 0.5799 0.3515 0.5337 -0.0088 0.0716 0.0015 305 VAL A CG1 2193 C CG2 . VAL A 284 ? 0.5307 0.3122 0.5042 0.0017 0.0668 0.0062 305 VAL A CG2 2194 N N . ALA A 285 ? 0.5840 0.3775 0.5310 -0.0210 0.0535 0.0011 306 ALA A N 2195 C CA . ALA A 285 ? 0.5114 0.2998 0.4454 -0.0266 0.0517 -0.0018 306 ALA A CA 2196 C C . ALA A 285 ? 0.6321 0.4093 0.5580 -0.0265 0.0578 -0.0012 306 ALA A C 2197 O O . ALA A 285 ? 0.6127 0.3941 0.5467 -0.0229 0.0612 0.0048 306 ALA A O 2198 C CB . ALA A 285 ? 0.4347 0.2359 0.3721 -0.0278 0.0439 0.0021 306 ALA A CB 2199 N N . LYS A 286 ? 0.5888 0.3530 0.4986 -0.0307 0.0597 -0.0083 307 LYS A N 2200 C CA . LYS A 286 ? 0.6606 0.4266 0.5584 -0.0277 0.0658 -0.0083 307 LYS A CA 2201 C C . LYS A 286 ? 0.6548 0.4295 0.5343 -0.0309 0.0611 -0.0127 307 LYS A C 2202 O O . LYS A 286 ? 0.6267 0.4062 0.5024 -0.0368 0.0547 -0.0195 307 LYS A O 2203 C CB . LYS A 286 ? 0.6455 0.3986 0.5387 -0.0245 0.0759 -0.0135 307 LYS A CB 2204 C CG . LYS A 286 ? 0.7482 0.4909 0.6277 -0.0294 0.0773 -0.0253 307 LYS A CG 2205 C CD . LYS A 286 ? 0.8622 0.5903 0.7355 -0.0240 0.0893 -0.0293 307 LYS A CD 2206 C CE . LYS A 286 ? 0.8616 0.5949 0.7290 -0.0178 0.0966 -0.0253 307 LYS A CE 2207 N NZ . LYS A 286 ? 0.8769 0.5973 0.7371 -0.0116 0.1093 -0.0293 307 LYS A NZ 2208 N N . GLY A 287 ? 0.5775 0.3567 0.4465 -0.0264 0.0647 -0.0081 308 GLY A N 2209 C CA . GLY A 287 ? 0.6758 0.4648 0.5244 -0.0266 0.0603 -0.0111 308 GLY A CA 2210 C C . GLY A 287 ? 0.6820 0.4685 0.5144 -0.0201 0.0693 -0.0078 308 GLY A C 2211 O O . GLY A 287 ? 0.6258 0.4072 0.4669 -0.0157 0.0789 -0.0006 308 GLY A O 2212 N N . GLN A 288 ? 0.6757 0.4711 0.4892 -0.0206 0.0651 -0.0090 309 GLN A N 2213 C CA . GLN A 288 ? 0.6297 0.4186 0.4371 -0.0145 0.0684 -0.0054 309 GLN A CA 2214 C C . GLN A 288 ? 0.6752 0.4738 0.4687 -0.0047 0.0669 -0.0005 309 GLN A C 2215 O O . GLN A 288 ? 0.7545 0.5676 0.5314 -0.0044 0.0583 -0.0020 309 GLN A O 2216 C CB . GLN A 288 ? 0.6534 0.4433 0.4406 -0.0187 0.0679 -0.0169 309 GLN A CB 2217 C CG . GLN A 288 ? 0.8470 0.6299 0.6109 -0.0106 0.0769 -0.0184 309 GLN A CG 2218 C CD . GLN A 288 ? 0.9027 0.6698 0.6787 -0.0099 0.0887 -0.0134 309 GLN A CD 2219 O OE1 . GLN A 288 ? 0.9422 0.7065 0.7329 -0.0160 0.0917 -0.0125 309 GLN A OE1 2220 N NE2 . GLN A 288 ? 0.8977 0.6583 0.6612 -0.0008 0.0985 -0.0103 309 GLN A NE2 2221 N N . LEU A 289 ? 0.6259 0.4199 0.4288 0.0039 0.0752 0.0062 310 LEU A N 2222 C CA . LEU A 289 ? 0.6354 0.4353 0.4253 0.0133 0.0775 0.0168 310 LEU A CA 2223 C C . LEU A 289 ? 0.6700 0.4680 0.4259 0.0184 0.0836 0.0177 310 LEU A C 2224 O O . LEU A 289 ? 0.6076 0.3944 0.3645 0.0210 0.0944 0.0175 310 LEU A O 2225 C CB . LEU A 289 ? 0.6033 0.4018 0.4184 0.0200 0.0857 0.0193 310 LEU A CB 2226 C CG . LEU A 289 ? 0.6667 0.4739 0.5009 0.0156 0.0847 0.0223 310 LEU A CG 2227 C CD1 . LEU A 289 ? 0.6607 0.4728 0.4976 0.0229 0.0847 0.0298 310 LEU A CD1 2228 C CD2 . LEU A 289 ? 0.6282 0.4395 0.4639 0.0066 0.0736 0.0180 310 LEU A CD2 2229 N N . THR A 290 ? 0.6562 0.4677 0.3826 0.0211 0.0756 0.0159 311 THR A N 2230 C CA . THR A 290 ? 0.7962 0.6102 0.4864 0.0271 0.0784 0.0114 311 THR A CA 2231 C C . THR A 290 ? 0.7817 0.5996 0.4497 0.0418 0.0825 0.0259 311 THR A C 2232 O O . THR A 290 ? 0.7740 0.6057 0.4357 0.0471 0.0733 0.0322 311 THR A O 2233 C CB . THR A 290 ? 0.9215 0.7506 0.5933 0.0207 0.0644 -0.0057 311 THR A CB 2234 O OG1 . THR A 290 ? 0.9680 0.7870 0.6568 0.0080 0.0646 -0.0196 311 THR A OG1 2235 C CG2 . THR A 290 ? 1.0256 0.8613 0.6569 0.0289 0.0644 -0.0107 311 THR A CG2 2236 N N . PHE A 291 ? 0.7636 0.5686 0.4210 0.0493 0.0969 0.0316 312 PHE A N 2237 C CA . PHE A 291 ? 0.8873 0.6903 0.5252 0.0644 0.1048 0.0469 312 PHE A CA 2238 C C . PHE A 291 ? 0.8821 0.7011 0.4732 0.0743 0.0966 0.0448 312 PHE A C 2239 O O . PHE A 291 ? 0.9186 0.7421 0.4859 0.0714 0.0932 0.0301 312 PHE A O 2240 C CB . PHE A 291 ? 0.8797 0.6640 0.5231 0.0687 0.1235 0.0521 312 PHE A CB 2241 C CG . PHE A 291 ? 0.9517 0.7299 0.5736 0.0846 0.1348 0.0671 312 PHE A CG 2242 C CD1 . PHE A 291 ? 0.8964 0.6656 0.5435 0.0894 0.1428 0.0788 312 PHE A CD1 2243 C CD2 . PHE A 291 ? 1.0972 0.8775 0.6732 0.0953 0.1384 0.0677 312 PHE A CD2 2244 C CE1 . PHE A 291 ? 0.9243 0.6844 0.5522 0.1046 0.1554 0.0924 312 PHE A CE1 2245 C CE2 . PHE A 291 ? 1.1304 0.9031 0.6843 0.1115 0.1502 0.0830 312 PHE A CE2 2246 C CZ . PHE A 291 ? 1.0626 0.8238 0.6433 0.1162 0.1594 0.0963 312 PHE A CZ 2247 N N . TYR A 292 ? 0.8351 0.6629 0.4140 0.0866 0.0925 0.0579 313 TYR A N 2248 C CA . TYR A 292 ? 0.9417 0.7862 0.4747 0.1004 0.0849 0.0584 313 TYR A CA 2249 C C . TYR A 292 ? 0.9951 0.8332 0.5126 0.1202 0.0944 0.0803 313 TYR A C 2250 O O . TYR A 292 ? 1.0453 0.8702 0.5919 0.1218 0.1026 0.0929 313 TYR A O 2251 C CB . TYR A 292 ? 0.8797 0.7535 0.4082 0.0959 0.0617 0.0463 313 TYR A CB 2252 C CG . TYR A 292 ? 0.8982 0.7830 0.4435 0.1024 0.0536 0.0590 313 TYR A CG 2253 C CD1 . TYR A 292 ? 0.9308 0.8136 0.5166 0.0897 0.0496 0.0570 313 TYR A CD1 2254 C CD2 . TYR A 292 ? 0.8701 0.7664 0.3901 0.1225 0.0505 0.0730 313 TYR A CD2 2255 C CE1 . TYR A 292 ? 0.8836 0.7752 0.4852 0.0961 0.0434 0.0676 313 TYR A CE1 2256 C CE2 . TYR A 292 ? 0.9017 0.8071 0.4386 0.1300 0.0444 0.0844 313 TYR A CE2 2257 C CZ . TYR A 292 ? 0.9596 0.8623 0.5376 0.1163 0.0410 0.0810 313 TYR A CZ 2258 O OH . TYR A 292 ? 1.0205 0.9308 0.6155 0.1244 0.0364 0.0912 313 TYR A OH 2259 N N . ALA A 293 ? 0.9525 0.7993 0.4240 0.1357 0.0933 0.0832 314 ALA A N 2260 C CA . ALA A 293 ? 0.9926 0.8315 0.4424 0.1576 0.1039 0.1045 314 ALA A CA 2261 C C . ALA A 293 ? 1.0501 0.9154 0.4524 0.1750 0.0890 0.1050 314 ALA A C 2262 O O . ALA A 293 ? 1.0486 0.9287 0.4202 0.1733 0.0798 0.0893 314 ALA A O 2263 C CB . ALA A 293 ? 0.9212 0.7326 0.3630 0.1626 0.1280 0.1123 314 ALA A CB 2264 N N . GLN A 294 ? 0.7032 0.7303 0.5713 -0.1016 -0.0228 0.1078 315 GLN A N 2265 C CA . GLN A 294 ? 0.7555 0.8052 0.6267 -0.1298 -0.0321 0.1157 315 GLN A CA 2266 C C . GLN A 294 ? 0.6288 0.6373 0.4771 -0.1232 -0.0270 0.1041 315 GLN A C 2267 O O . GLN A 294 ? 0.6361 0.6226 0.4883 -0.0910 -0.0130 0.0893 315 GLN A O 2268 C CB . GLN A 294 ? 0.7922 0.9321 0.7272 -0.1259 -0.0321 0.1233 315 GLN A CB 2269 C CG . GLN A 294 ? 0.8825 1.0681 0.8466 -0.1226 -0.0346 0.1318 315 GLN A CG 2270 C CD . GLN A 294 ? 0.9660 1.2253 0.9678 -0.1295 -0.0472 0.1434 315 GLN A CD 2271 O OE1 . GLN A 294 ? 1.0573 1.3231 1.0455 -0.1575 -0.0608 0.1516 315 GLN A OE1 2272 N NE2 . GLN A 294 ? 0.9182 1.2242 0.9501 -0.1049 -0.0389 0.1508 315 GLN A NE2 2273 N N . PRO A 295 ? 0.5701 0.5674 0.3935 -0.1529 -0.0384 0.1100 316 PRO A N 2274 C CA . PRO A 295 ? 0.6273 0.5830 0.4235 -0.1483 -0.0339 0.1001 316 PRO A CA 2275 C C . PRO A 295 ? 0.6497 0.6441 0.4924 -0.1156 -0.0161 0.0917 316 PRO A C 2276 O O . PRO A 295 ? 0.6167 0.6844 0.5162 -0.1062 -0.0129 0.0975 316 PRO A O 2277 C CB . PRO A 295 ? 0.6851 0.6473 0.4615 -0.1863 -0.0502 0.1114 316 PRO A CB 2278 C CG . PRO A 295 ? 0.7100 0.6806 0.4791 -0.2132 -0.0649 0.1226 316 PRO A CG 2279 C CD . PRO A 295 ? 0.6456 0.6647 0.4619 -0.1914 -0.0564 0.1248 316 PRO A CD 2280 N N . ASN A 296 ? 0.5904 0.5335 0.4089 -0.0969 -0.0052 0.0770 317 ASN A N 2281 C CA . ASN A 296 ? 0.6596 0.6283 0.5175 -0.0657 0.0134 0.0669 317 ASN A CA 2282 C C . ASN A 296 ? 0.7105 0.6230 0.5245 -0.0684 0.0168 0.0591 317 ASN A C 2283 O O . ASN A 296 ? 0.7103 0.5486 0.4685 -0.0742 0.0125 0.0510 317 ASN A O 2284 C CB . ASN A 296 ? 0.7272 0.6916 0.6140 -0.0257 0.0300 0.0511 317 ASN A CB 2285 C CG . ASN A 296 ? 0.8469 0.7282 0.6789 -0.0202 0.0290 0.0385 317 ASN A CG 2286 O OD1 . ASN A 296 ? 0.9411 0.7954 0.7376 -0.0411 0.0139 0.0457 317 ASN A OD1 2287 N ND2 . ASN A 296 ? 0.7807 0.6197 0.6076 0.0086 0.0445 0.0189 317 ASN A ND2 2288 N N . TRP A 297 ? 0.6769 0.6231 0.5145 -0.0638 0.0238 0.0615 318 TRP A N 2289 C CA . TRP A 297 ? 0.7543 0.6487 0.5474 -0.0670 0.0272 0.0557 318 TRP A CA 2290 C C . TRP A 297 ? 0.7298 0.5662 0.5114 -0.0344 0.0466 0.0338 318 TRP A C 2291 O O . TRP A 297 ? 0.6931 0.5544 0.5274 -0.0003 0.0648 0.0236 318 TRP A O 2292 C CB . TRP A 297 ? 0.7051 0.6497 0.5248 -0.0684 0.0303 0.0646 318 TRP A CB 2293 C CG . TRP A 297 ? 0.6137 0.5954 0.4261 -0.1061 0.0085 0.0843 318 TRP A CG 2294 C CD1 . TRP A 297 ? 0.4656 0.5277 0.3303 -0.1115 0.0028 0.0975 318 TRP A CD1 2295 C CD2 . TRP A 297 ? 0.7243 0.6636 0.4766 -0.1432 -0.0119 0.0915 318 TRP A CD2 2296 N NE1 . TRP A 297 ? 0.5281 0.6004 0.3688 -0.1506 -0.0188 0.1123 318 TRP A NE1 2297 C CE2 . TRP A 297 ? 0.6139 0.6117 0.3867 -0.1703 -0.0278 0.1087 318 TRP A CE2 2298 C CE3 . TRP A 297 ? 0.7724 0.6298 0.4577 -0.1557 -0.0188 0.0838 318 TRP A CE3 2299 C CZ2 . TRP A 297 ? 0.5668 0.5436 0.2968 -0.2090 -0.0494 0.1177 318 TRP A CZ2 2300 C CZ3 . TRP A 297 ? 0.7667 0.6046 0.4100 -0.1938 -0.0406 0.0931 318 TRP A CZ3 2301 C CH2 . TRP A 297 ? 0.7075 0.6047 0.3737 -0.2199 -0.0552 0.1096 318 TRP A CH2 2302 N N . VAL A 298 ? 0.7574 0.5147 0.4733 -0.0454 0.0408 0.0260 319 VAL A N 2303 C CA . VAL A 298 ? 0.8638 0.5587 0.5600 -0.0192 0.0584 0.0044 319 VAL A CA 2304 C C . VAL A 298 ? 0.8927 0.5681 0.5664 -0.0214 0.0655 0.0042 319 VAL A C 2305 O O . VAL A 298 ? 0.9096 0.5869 0.6109 0.0056 0.0883 0.0015 319 VAL A O 2306 C CB . VAL A 298 ? 0.9405 0.5541 0.5703 -0.0297 0.0495 0.0012 319 VAL A CB 2307 C CG1 . VAL A 298 ? 0.9307 0.4779 0.5412 -0.0085 0.0646 -0.0209 319 VAL A CG1 2308 C CG2 . VAL A 298 ? 0.9185 0.5412 0.5707 -0.0201 0.0457 0.0010 319 VAL A CG2 2309 N N . GLN A 299 ? 0.9081 0.5625 0.5297 -0.0556 0.0464 0.0155 320 GLN A N 2310 C CA . GLN A 299 ? 0.9389 0.5782 0.5312 -0.0615 0.0492 0.0179 320 GLN A CA 2311 C C . GLN A 299 ? 0.8896 0.5863 0.4863 -0.0908 0.0307 0.0400 320 GLN A C 2312 O O . GLN A 299 ? 0.9614 0.6566 0.5344 -0.1229 0.0081 0.0503 320 GLN A O 2313 C CB . GLN A 299 ? 1.0940 0.6435 0.6120 -0.0745 0.0431 0.0075 320 GLN A CB 2314 C CG . GLN A 299 ? 1.2165 0.7428 0.6937 -0.0820 0.0442 0.0092 320 GLN A CG 2315 C CD . GLN A 299 ? 1.3948 0.8314 0.8025 -0.0927 0.0398 -0.0041 320 GLN A CD 2316 O OE1 . GLN A 299 ? 1.4287 0.8267 0.8362 -0.0701 0.0560 -0.0168 320 GLN A OE1 2317 N NE2 . GLN A 299 ? 1.4752 0.8952 0.8320 -0.1261 0.0180 0.0044 320 GLN A NE2 2318 N N . ILE A 300 ? 0.8100 0.5574 0.4409 -0.0789 0.0408 0.0466 321 ILE A N 2319 C CA . ILE A 300 ? 0.8111 0.6147 0.4490 -0.1040 0.0240 0.0667 321 ILE A CA 2320 C C . ILE A 300 ? 0.8946 0.6681 0.4810 -0.1129 0.0206 0.0692 321 ILE A C 2321 O O . ILE A 300 ? 0.9944 0.7170 0.5540 -0.0928 0.0372 0.0559 321 ILE A O 2322 C CB . ILE A 300 ? 0.7036 0.5934 0.4189 -0.0854 0.0352 0.0745 321 ILE A CB 2323 C CG1 . ILE A 300 ? 0.7182 0.6012 0.4560 -0.0473 0.0627 0.0632 321 ILE A CG1 2324 C CG2 . ILE A 300 ? 0.6605 0.5913 0.4295 -0.0781 0.0357 0.0739 321 ILE A CG2 2325 C CD1 . ILE A 300 ? 0.7391 0.7030 0.5567 -0.0259 0.0726 0.0696 321 ILE A CD1 2326 N N . ILE A 301 ? 0.8838 0.6890 0.4570 -0.1424 -0.0008 0.0852 322 ILE A N 2327 C CA . ILE A 301 ? 0.9616 0.7519 0.4918 -0.1485 -0.0055 0.0892 322 ILE A CA 2328 C C . ILE A 301 ? 0.9512 0.7916 0.5264 -0.1204 0.0141 0.0939 322 ILE A C 2329 O O . ILE A 301 ? 0.8925 0.7994 0.5369 -0.1090 0.0214 0.1001 322 ILE A O 2330 C CB . ILE A 301 ? 0.9121 0.7227 0.4170 -0.1880 -0.0359 0.1033 322 ILE A CB 2331 C CG1 . ILE A 301 ? 0.8775 0.7737 0.4475 -0.1984 -0.0436 0.1191 322 ILE A CG1 2332 C CG2 . ILE A 301 ? 0.9549 0.7079 0.4103 -0.2159 -0.0542 0.0972 322 ILE A CG2 2333 C CD1 . ILE A 301 ? 0.9798 0.8995 0.5332 -0.2361 -0.0717 0.1318 322 ILE A CD1 2334 N N . ASN A 302 ? 0.9106 0.7180 0.4465 -0.1086 0.0230 0.0905 323 ASN A N 2335 C CA . ASN A 302 ? 0.8125 0.6593 0.3848 -0.0812 0.0428 0.0954 323 ASN A CA 2336 C C . ASN A 302 ? 0.8384 0.6835 0.3630 -0.0921 0.0309 0.1059 323 ASN A C 2337 O O . ASN A 302 ? 0.9745 0.7716 0.4305 -0.1151 0.0117 0.1036 323 ASN A O 2338 C CB . ASN A 302 ? 0.8283 0.6345 0.4139 -0.0422 0.0759 0.0772 323 ASN A CB 2339 C CG . ASN A 302 ? 0.9075 0.7384 0.5618 -0.0231 0.0893 0.0680 323 ASN A CG 2340 O OD1 . ASN A 302 ? 0.9860 0.7656 0.6270 -0.0175 0.0950 0.0522 323 ASN A OD1 2341 N ND2 . ASN A 302 ? 0.7622 0.6722 0.4906 -0.0130 0.0920 0.0775 323 ASN A ND2 2342 N N . ASP A 303 ? 0.7185 0.6181 0.2820 -0.0752 0.0411 0.1169 324 ASP A N 2343 C CA . ASP A 303 ? 0.8093 0.7121 0.3309 -0.0805 0.0313 0.1277 324 ASP A CA 2344 C C . ASP A 303 ? 0.9574 0.7752 0.3954 -0.0773 0.0342 0.1158 324 ASP A C 2345 O O . ASP A 303 ? 1.0025 0.7674 0.4326 -0.0546 0.0586 0.0998 324 ASP A O 2346 C CB . ASP A 303 ? 0.8154 0.7731 0.3908 -0.0512 0.0520 0.1373 324 ASP A CB 2347 C CG . ASP A 303 ? 0.9481 0.9975 0.5988 -0.0607 0.0419 0.1522 324 ASP A CG 2348 O OD1 . ASP A 303 ? 0.9303 0.9985 0.5929 -0.0886 0.0216 0.1544 324 ASP A OD1 2349 O OD2 . ASP A 303 ? 1.0142 1.1156 0.7130 -0.0401 0.0546 0.1616 324 ASP A OD2 2350 N N . ILE A 304 ? 1.0771 0.8833 0.4557 -0.1002 0.0088 0.1220 325 ILE A N 2351 C CA . ILE A 304 ? 1.1142 0.8432 0.4087 -0.1015 0.0064 0.1107 325 ILE A CA 2352 C C . ILE A 304 ? 1.1312 0.8729 0.3842 -0.1033 -0.0068 0.1215 325 ILE A C 2353 O O . ILE A 304 ? 1.0707 0.8641 0.3338 -0.1252 -0.0334 0.1345 325 ILE A O 2354 C CB . ILE A 304 ? 1.1890 0.8723 0.4385 -0.1348 -0.0187 0.1003 325 ILE A CB 2355 C CG1 . ILE A 304 ? 1.2497 0.8810 0.5056 -0.1243 0.0003 0.0832 325 ILE A CG1 2356 C CG2 . ILE A 304 ? 1.2629 0.8948 0.4289 -0.1480 -0.0356 0.0941 325 ILE A CG2 2357 C CD1 . ILE A 304 ? 1.3017 0.8960 0.5276 -0.1564 -0.0227 0.0748 325 ILE A CD1 2358 N N . HIS A 305 ? 1.2120 0.9056 0.4197 -0.0794 0.0126 0.1154 326 HIS A N 2359 C CA . HIS A 305 ? 1.3666 1.0576 0.5192 -0.0790 0.0001 0.1231 326 HIS A CA 2360 C C . HIS A 305 ? 1.4306 1.0413 0.4960 -0.0921 -0.0112 0.1068 326 HIS A C 2361 O O . HIS A 305 ? 1.4593 1.0066 0.5053 -0.0804 0.0101 0.0904 326 HIS A O 2362 C CB . HIS A 305 ? 1.5276 1.2238 0.6930 -0.0390 0.0333 0.1295 326 HIS A CB 2363 C CG . HIS A 305 ? 1.6721 1.4448 0.9291 -0.0221 0.0493 0.1430 326 HIS A CG 2364 N ND1 . HIS A 305 ? 1.7304 1.5592 1.0089 -0.0100 0.0492 0.1612 326 HIS A ND1 2365 C CD2 . HIS A 305 ? 1.6975 1.5011 1.0320 -0.0145 0.0653 0.1398 326 HIS A CD2 2366 C CE1 . HIS A 305 ? 1.7047 1.5960 1.0723 0.0032 0.0652 0.1684 326 HIS A CE1 2367 N NE2 . HIS A 305 ? 1.6847 1.5627 1.0876 0.0010 0.0747 0.1552 326 HIS A NE2 2368 N N . VAL A 306 ? 1.4603 1.0743 0.4769 -0.1163 -0.0449 0.1093 327 VAL A N 2369 C CA . VAL A 306 ? 1.5140 1.0561 0.4477 -0.1284 -0.0569 0.0929 327 VAL A CA 2370 C C . VAL A 306 ? 1.6187 1.1683 0.4981 -0.1294 -0.0769 0.0990 327 VAL A C 2371 O O . VAL A 306 ? 1.5442 1.1594 0.4509 -0.1343 -0.0946 0.1150 327 VAL A O 2372 C CB . VAL A 306 ? 1.4924 1.0162 0.4177 -0.1662 -0.0839 0.0811 327 VAL A CB 2373 C CG1 . VAL A 306 ? 1.5416 1.0479 0.5102 -0.1636 -0.0647 0.0734 327 VAL A CG1 2374 C CG2 . VAL A 306 ? 1.4503 1.0407 0.4051 -0.1950 -0.1186 0.0930 327 VAL A CG2 2375 N N . ALA A 307 ? 1.7528 1.2342 0.5559 -0.1245 -0.0739 0.0853 328 ALA A N 2376 C CA . ALA A 307 ? 1.8178 1.2961 0.5580 -0.1253 -0.0943 0.0875 328 ALA A CA 2377 C C . ALA A 307 ? 1.8198 1.3186 0.5487 -0.1649 -0.1392 0.0823 328 ALA A C 2378 O O . ALA A 307 ? 1.6835 1.1823 0.4416 -0.1914 -0.1505 0.0748 328 ALA A O 2379 C CB . ALA A 307 ? 1.8883 1.2847 0.5516 -0.1088 -0.0762 0.0725 328 ALA A CB 2380 N N . MET A 308 ? 1.9237 1.4379 0.6108 -0.1676 -0.1633 0.0856 329 MET A N 2381 C CA . MET A 308 ? 1.9863 1.5394 0.6802 -0.2013 -0.2056 0.0839 329 MET A CA 2382 C C . MET A 308 ? 2.0385 1.5565 0.7222 -0.2374 -0.2251 0.0641 329 MET A C 2383 O O . MET A 308 ? 2.0708 1.6284 0.8040 -0.2652 -0.2447 0.0661 329 MET A O 2384 C CB . MET A 308 ? 2.0782 1.6425 0.7198 -0.1944 -0.2269 0.0867 329 MET A CB 2385 C CG . MET A 308 ? 2.1397 1.7485 0.7960 -0.2270 -0.2699 0.0838 329 MET A CG 2386 S SD . MET A 308 ? 2.0119 1.7141 0.7717 -0.2410 -0.2790 0.1031 329 MET A SD 2387 C CE . MET A 308 ? 2.9831 2.7268 1.7543 -0.1989 -0.2579 0.1273 329 MET A CE 2388 N N . GLU A 309 ? 2.0791 1.5230 0.7018 -0.2375 -0.2181 0.0453 330 GLU A N 2389 C CA . GLU A 309 ? 2.1441 1.5542 0.7553 -0.2720 -0.2376 0.0263 330 GLU A CA 2390 C C . GLU A 309 ? 2.1312 1.4891 0.7542 -0.2751 -0.2145 0.0153 330 GLU A C 2391 O O . GLU A 309 ? 2.1930 1.5129 0.8034 -0.3008 -0.2255 -0.0008 330 GLU A O 2392 C CB . GLU A 309 ? 2.2892 1.6595 0.8254 -0.2784 -0.2560 0.0102 330 GLU A CB 2393 C CG . GLU A 309 ? 2.3923 1.8167 0.9266 -0.2891 -0.2905 0.0154 330 GLU A CG 2394 C CD . GLU A 309 ? 2.6348 2.0282 1.0890 -0.2765 -0.3001 0.0062 330 GLU A CD 2395 O OE1 . GLU A 309 ? 2.7519 2.0761 1.1512 -0.2736 -0.2884 -0.0105 330 GLU A OE1 2396 O OE2 . GLU A 309 ? 2.6814 2.1194 1.1276 -0.2689 -0.3195 0.0153 330 GLU A OE2 2397 N N . GLU A 310 ? 2.0521 1.4098 0.7040 -0.2486 -0.1823 0.0239 331 GLU A N 2398 C CA . GLU A 310 ? 1.9894 1.2963 0.6532 -0.2466 -0.1587 0.0125 331 GLU A CA 2399 C C . GLU A 310 ? 1.8670 1.2071 0.5983 -0.2658 -0.1638 0.0178 331 GLU A C 2400 O O . GLU A 310 ? 1.8641 1.2666 0.6353 -0.2827 -0.1850 0.0301 331 GLU A O 2401 C CB . GLU A 310 ? 2.0210 1.3010 0.6816 -0.2072 -0.1184 0.0147 331 GLU A CB 2402 C CG . GLU A 310 ? 2.2137 1.4283 0.7994 -0.1919 -0.1064 0.0016 331 GLU A CG 2403 C CD . GLU A 310 ? 2.2870 1.4662 0.8753 -0.1543 -0.0624 0.0008 331 GLU A CD 2404 O OE1 . GLU A 310 ? 2.1751 1.3735 0.8251 -0.1423 -0.0417 0.0063 331 GLU A OE1 2405 O OE2 . GLU A 310 ? 2.3895 1.5213 0.9204 -0.1364 -0.0476 -0.0062 331 GLU A OE2 2406 N N . SER A 311 ? 1.7699 1.0663 0.5139 -0.2624 -0.1435 0.0079 332 SER A N 2407 C CA . SER A 311 ? 1.8454 1.1573 0.6407 -0.2824 -0.1490 0.0095 332 SER A CA 2408 C C . SER A 311 ? 1.7944 1.1394 0.6498 -0.2594 -0.1248 0.0211 332 SER A C 2409 O O . SER A 311 ? 1.8126 1.1503 0.6694 -0.2265 -0.0972 0.0229 332 SER A O 2410 C CB . SER A 311 ? 1.9696 1.2085 0.7399 -0.2974 -0.1465 -0.0103 332 SER A CB 2411 O OG . SER A 311 ? 2.0117 1.1924 0.7581 -0.2703 -0.1165 -0.0221 332 SER A OG 2412 N N . VAL A 312 ? 1.7639 1.1446 0.6709 -0.2767 -0.1338 0.0284 333 VAL A N 2413 C CA . VAL A 312 ? 1.6928 1.1074 0.6610 -0.2576 -0.1131 0.0381 333 VAL A CA 2414 C C . VAL A 312 ? 1.5776 0.9741 0.5714 -0.2739 -0.1150 0.0325 333 VAL A C 2415 O O . VAL A 312 ? 1.5912 0.9758 0.5732 -0.3057 -0.1371 0.0289 333 VAL A O 2416 C CB . VAL A 312 ? 1.6721 1.1740 0.6928 -0.2567 -0.1209 0.0595 333 VAL A CB 2417 C CG1 . VAL A 312 ? 1.6961 1.2199 0.6868 -0.2512 -0.1307 0.0662 333 VAL A CG1 2418 C CG2 . VAL A 312 ? 1.6586 1.1974 0.7131 -0.2908 -0.1455 0.0661 333 VAL A CG2 2419 N N . PHE A 313 ? 1.4550 0.8493 0.4857 -0.2509 -0.0905 0.0319 334 PHE A N 2420 C CA . PHE A 313 ? 1.4647 0.8442 0.5208 -0.2617 -0.0909 0.0279 334 PHE A CA 2421 C C . PHE A 313 ? 1.3681 0.7946 0.4903 -0.2403 -0.0731 0.0375 334 PHE A C 2422 O O . PHE A 313 ? 1.2996 0.7263 0.4407 -0.2073 -0.0470 0.0348 334 PHE A O 2423 C CB . PHE A 313 ? 1.5023 0.7966 0.5205 -0.2592 -0.0808 0.0066 334 PHE A CB 2424 C CG . PHE A 313 ? 1.5081 0.7817 0.5451 -0.2739 -0.0852 0.0031 334 PHE A CG 2425 C CD1 . PHE A 313 ? 1.5617 0.8205 0.5816 -0.3093 -0.1082 0.0036 334 PHE A CD1 2426 C CD2 . PHE A 313 ? 1.4213 0.6911 0.4958 -0.2511 -0.0653 0.0000 334 PHE A CD2 2427 C CE1 . PHE A 313 ? 1.6266 0.8655 0.6638 -0.3212 -0.1099 0.0039 334 PHE A CE1 2428 C CE2 . PHE A 313 ? 1.4398 0.6904 0.5296 -0.2626 -0.0696 -0.0016 334 PHE A CE2 2429 C CZ . PHE A 313 ? 1.5346 0.7690 0.6043 -0.2974 -0.0913 0.0019 334 PHE A CZ 2430 N N . TRP A 314 ? 1.3477 0.8138 0.5076 -0.2594 -0.0866 0.0479 335 TRP A N 2431 C CA . TRP A 314 ? 1.2541 0.7691 0.4794 -0.2428 -0.0729 0.0567 335 TRP A CA 2432 C C . TRP A 314 ? 1.2409 0.7299 0.4768 -0.2520 -0.0748 0.0516 335 TRP A C 2433 O O . TRP A 314 ? 1.2658 0.7321 0.4772 -0.2821 -0.0943 0.0510 335 TRP A O 2434 C CB . TRP A 314 ? 1.2500 0.8478 0.5191 -0.2557 -0.0865 0.0763 335 TRP A CB 2435 C CG . TRP A 314 ? 1.2083 0.8578 0.5106 -0.2299 -0.0716 0.0851 335 TRP A CG 2436 C CD1 . TRP A 314 ? 1.2046 0.8531 0.5326 -0.1931 -0.0424 0.0801 335 TRP A CD1 2437 C CD2 . TRP A 314 ? 1.0869 0.7988 0.4066 -0.2388 -0.0844 0.1004 335 TRP A CD2 2438 N NE1 . TRP A 314 ? 1.0954 0.8007 0.4545 -0.1784 -0.0352 0.0919 335 TRP A NE1 2439 C CE2 . TRP A 314 ? 1.0270 0.7724 0.3807 -0.2058 -0.0614 0.1050 335 TRP A CE2 2440 C CE3 . TRP A 314 ? 1.1122 0.8545 0.4251 -0.2710 -0.1125 0.1095 335 TRP A CE3 2441 C CZ2 . TRP A 314 ? 1.0857 0.8931 0.4636 -0.2041 -0.0662 0.1198 335 TRP A CZ2 2442 C CZ3 . TRP A 314 ? 1.1030 0.9068 0.4404 -0.2691 -0.1182 0.1231 335 TRP A CZ3 2443 C CH2 . TRP A 314 ? 1.1199 0.9557 0.4882 -0.2360 -0.0956 0.1287 335 TRP A CH2 2444 N N . GLU A 315 ? 1.2651 0.7577 0.5394 -0.2251 -0.0542 0.0476 336 GLU A N 2445 C CA . GLU A 315 ? 1.2767 0.7562 0.5675 -0.2314 -0.0567 0.0455 336 GLU A CA 2446 C C . GLU A 315 ? 1.1738 0.7169 0.5347 -0.2134 -0.0459 0.0537 336 GLU A C 2447 O O . GLU A 315 ? 1.1135 0.6844 0.5097 -0.1831 -0.0257 0.0517 336 GLU A O 2448 C CB . GLU A 315 ? 1.3958 0.7947 0.6533 -0.2191 -0.0456 0.0257 336 GLU A CB 2449 C CG . GLU A 315 ? 1.4838 0.8723 0.7639 -0.2171 -0.0449 0.0237 336 GLU A CG 2450 C CD . GLU A 315 ? 1.6240 0.9325 0.8599 -0.2284 -0.0496 0.0113 336 GLU A CD 2451 O OE1 . GLU A 315 ? 1.6906 0.9544 0.9021 -0.2122 -0.0363 0.0031 336 GLU A OE1 2452 O OE2 . GLU A 315 ? 1.6761 0.9812 0.9067 -0.2482 -0.0625 0.0200 336 GLU A OE2 2453 N N . CYS A 316 ? 1.1331 0.6988 0.5145 -0.2324 -0.0589 0.0619 337 CYS A N 2454 C CA . CYS A 316 ? 1.0005 0.6226 0.4448 -0.2184 -0.0512 0.0677 337 CYS A CA 2455 C C . CYS A 316 ? 1.0184 0.5969 0.4593 -0.2081 -0.0462 0.0563 337 CYS A C 2456 O O . CYS A 316 ? 1.0322 0.5586 0.4313 -0.2289 -0.0588 0.0526 337 CYS A O 2457 C CB . CYS A 316 ? 0.9168 0.5965 0.3859 -0.2484 -0.0702 0.0852 337 CYS A CB 2458 S SG . CYS A 316 ? 2.2116 1.9733 1.7177 -0.2526 -0.0735 0.1009 337 CYS A SG 2459 N N . LYS A 317 ? 0.9932 0.5943 0.4794 -0.1757 -0.0283 0.0499 338 LYS A N 2460 C CA . LYS A 317 ? 0.9923 0.5638 0.4818 -0.1635 -0.0251 0.0397 338 LYS A CA 2461 C C . LYS A 317 ? 0.9802 0.6181 0.5341 -0.1457 -0.0179 0.0449 338 LYS A C 2462 O O . LYS A 317 ? 0.9585 0.6400 0.5584 -0.1193 -0.0010 0.0430 338 LYS A O 2463 C CB . LYS A 317 ? 1.0801 0.5872 0.5469 -0.1355 -0.0087 0.0176 338 LYS A CB 2464 C CG . LYS A 317 ? 1.2768 0.7114 0.6757 -0.1519 -0.0156 0.0091 338 LYS A CG 2465 C CD . LYS A 317 ? 1.3153 0.6940 0.6902 -0.1315 -0.0053 -0.0016 338 LYS A CD 2466 C CE . LYS A 317 ? 1.3039 0.6159 0.6309 -0.1368 -0.0026 -0.0119 338 LYS A CE 2467 N NZ . LYS A 317 ? 1.2789 0.5921 0.6228 -0.1116 0.0185 -0.0223 338 LYS A NZ 2468 N N . ALA A 318 ? 0.9476 0.5925 0.5050 -0.1592 -0.0296 0.0508 339 ALA A N 2469 C CA . ALA A 318 ? 0.9660 0.6699 0.5797 -0.1432 -0.0236 0.0555 339 ALA A CA 2470 C C . ALA A 318 ? 1.0968 0.7642 0.6990 -0.1324 -0.0244 0.0470 339 ALA A C 2471 O O . ALA A 318 ? 1.1921 0.8094 0.7483 -0.1528 -0.0378 0.0462 339 ALA A O 2472 C CB . ALA A 318 ? 0.9172 0.6870 0.5580 -0.1705 -0.0372 0.0754 339 ALA A CB 2473 N N . ASN A 319 ? 1.0420 0.7356 0.6864 -0.0991 -0.0098 0.0398 340 ASN A N 2474 C CA . ASN A 319 ? 1.0846 0.7574 0.7255 -0.0859 -0.0108 0.0336 340 ASN A CA 2475 C C . ASN A 319 ? 0.9852 0.7116 0.6532 -0.1017 -0.0201 0.0516 340 ASN A C 2476 O O . ASN A 319 ? 0.8256 0.6142 0.5264 -0.1161 -0.0226 0.0656 340 ASN A O 2477 C CB . ASN A 319 ? 1.1532 0.8327 0.8275 -0.0414 0.0089 0.0158 340 ASN A CB 2478 C CG . ASN A 319 ? 1.2887 0.8793 0.9185 -0.0263 0.0180 0.0072 340 ASN A CG 2479 O OD1 . ASN A 319 ? 1.3757 0.9053 0.9508 -0.0474 0.0073 0.0066 340 ASN A OD1 2480 N ND2 . ASN A 319 ? 1.2510 0.8475 0.9209 0.0122 0.0362 -0.0134 340 ASN A ND2 2481 N N . GLY A 320 ? 0.9733 0.6757 0.6268 -0.0980 -0.0250 0.0505 341 GLY A N 2482 C CA . GLY A 320 ? 0.9691 0.7158 0.6442 -0.1110 -0.0320 0.0664 341 GLY A CA 2483 C C . GLY A 320 ? 1.0163 0.7107 0.6505 -0.1171 -0.0412 0.0658 341 GLY A C 2484 O O . GLY A 320 ? 1.0389 0.6660 0.6304 -0.1101 -0.0427 0.0517 341 GLY A O 2485 N N . ARG A 321 ? 1.0235 0.7493 0.6699 -0.1299 -0.0470 0.0802 342 ARG A N 2486 C CA . ARG A 321 ? 1.0836 0.7629 0.6932 -0.1338 -0.0540 0.0811 342 ARG A CA 2487 C C . ARG A 321 ? 1.0132 0.7263 0.6303 -0.1614 -0.0623 0.0999 342 ARG A C 2488 O O . ARG A 321 ? 0.8740 0.6485 0.5343 -0.1541 -0.0573 0.1092 342 ARG A O 2489 C CB . ARG A 321 ? 1.1689 0.8363 0.7869 -0.0934 -0.0445 0.0697 342 ARG A CB 2490 C CG . ARG A 321 ? 1.3150 0.9067 0.8805 -0.0878 -0.0503 0.0595 342 ARG A CG 2491 C CD . ARG A 321 ? 1.3807 0.9484 0.9474 -0.0464 -0.0415 0.0369 342 ARG A CD 2492 N NE . ARG A 321 ? 1.4753 0.9609 0.9798 -0.0389 -0.0478 0.0407 342 ARG A NE 2493 C CZ . ARG A 321 ? 1.5593 1.0369 1.0560 -0.0241 -0.0503 0.0424 342 ARG A CZ 2494 N NH1 . ARG A 321 ? 1.5531 1.0992 1.0999 -0.0162 -0.0459 0.0409 342 ARG A NH1 2495 N NH2 . ARG A 321 ? 1.6689 1.0671 1.1117 -0.0170 -0.0568 0.0455 342 ARG A NH2 2496 N N . PRO A 322 ? 1.0910 0.7664 0.6676 -0.1932 -0.0747 0.1043 343 PRO A N 2497 C CA . PRO A 322 ? 1.2371 0.8454 0.7627 -0.2056 -0.0818 0.0933 343 PRO A CA 2498 C C . PRO A 322 ? 1.2697 0.8822 0.7996 -0.2062 -0.0799 0.0860 343 PRO A C 2499 O O . PRO A 322 ? 1.1944 0.8659 0.7675 -0.2023 -0.0747 0.0916 343 PRO A O 2500 C CB . PRO A 322 ? 1.2797 0.8832 0.7830 -0.2447 -0.0952 0.1038 343 PRO A CB 2501 C CG . PRO A 322 ? 1.2502 0.9289 0.8008 -0.2552 -0.0953 0.1193 343 PRO A CG 2502 C CD . PRO A 322 ? 1.1489 0.8522 0.7305 -0.2213 -0.0827 0.1200 343 PRO A CD 2503 N N . LYS A 323 ? 1.3259 0.8775 0.8102 -0.2104 -0.0839 0.0734 344 LYS A N 2504 C CA . LYS A 323 ? 1.1950 0.7430 0.6741 -0.2141 -0.0827 0.0673 344 LYS A CA 2505 C C . LYS A 323 ? 1.1054 0.6988 0.5991 -0.2467 -0.0921 0.0817 344 LYS A C 2506 O O . LYS A 323 ? 1.1713 0.7640 0.6495 -0.2749 -0.1044 0.0899 344 LYS A O 2507 C CB . LYS A 323 ? 1.2601 0.7358 0.6808 -0.2171 -0.0872 0.0525 344 LYS A CB 2508 C CG . LYS A 323 ? 1.3357 0.7729 0.7433 -0.1806 -0.0756 0.0374 344 LYS A CG 2509 C CD . LYS A 323 ? 1.4006 0.8676 0.8460 -0.1540 -0.0609 0.0312 344 LYS A CD 2510 C CE . LYS A 323 ? 1.4778 0.8757 0.9024 -0.1247 -0.0469 0.0283 344 LYS A CE 2511 N NZ . LYS A 323 ? 1.4960 0.9051 0.9456 -0.1067 -0.0327 0.0194 344 LYS A NZ 2512 N N . PRO A 324 ? 0.9943 0.6303 0.5197 -0.2409 -0.0861 0.0841 345 PRO A N 2513 C CA . PRO A 324 ? 1.1024 0.7894 0.6472 -0.2668 -0.0943 0.0966 345 PRO A CA 2514 C C . PRO A 324 ? 1.2062 0.8562 0.7051 -0.2990 -0.1089 0.0958 345 PRO A C 2515 O O . PRO A 324 ? 1.2233 0.8088 0.6759 -0.2980 -0.1098 0.0840 345 PRO A O 2516 C CB . PRO A 324 ? 1.0213 0.7461 0.6018 -0.2435 -0.0809 0.0945 345 PRO A CB 2517 C CG . PRO A 324 ? 0.9859 0.7052 0.5864 -0.2050 -0.0651 0.0846 345 PRO A CG 2518 C CD . PRO A 324 ? 0.8946 0.5400 0.4467 -0.2035 -0.0689 0.0743 345 PRO A CD 2519 N N . THR A 325 ? 1.2532 0.9474 0.7663 -0.3265 -0.1205 0.1075 346 THR A N 2520 C CA . THR A 325 ? 1.2307 0.9022 0.7066 -0.3582 -0.1356 0.1078 346 THR A CA 2521 C C . THR A 325 ? 1.1788 0.8959 0.6771 -0.3666 -0.1378 0.1148 346 THR A C 2522 O O . THR A 325 ? 1.1106 0.8915 0.6589 -0.3555 -0.1317 0.1229 346 THR A O 2523 C CB . THR A 325 ? 1.2296 0.9054 0.6933 -0.3851 -0.1505 0.1134 346 THR A CB 2524 O OG1 . THR A 325 ? 1.3376 0.9459 0.7506 -0.3870 -0.1530 0.1038 346 THR A OG1 2525 C CG2 . THR A 325 ? 1.2913 0.9946 0.7497 -0.4158 -0.1666 0.1200 346 THR A CG2 2526 N N . TYR A 326 ? 1.1730 0.8579 0.6337 -0.3853 -0.1463 0.1117 347 TYR A N 2527 C CA . TYR A 326 ? 1.1204 0.8351 0.5938 -0.3862 -0.1448 0.1171 347 TYR A CA 2528 C C . TYR A 326 ? 1.1867 0.9219 0.6537 -0.4223 -0.1628 0.1250 347 TYR A C 2529 O O . TYR A 326 ? 1.1910 0.8827 0.6153 -0.4433 -0.1727 0.1228 347 TYR A O 2530 C CB . TYR A 326 ? 1.0927 0.7519 0.5284 -0.3680 -0.1348 0.1061 347 TYR A CB 2531 C CG . TYR A 326 ? 1.0741 0.7110 0.5171 -0.3308 -0.1165 0.0955 347 TYR A CG 2532 C CD1 . TYR A 326 ? 1.0916 0.6630 0.4991 -0.3251 -0.1150 0.0829 347 TYR A CD1 2533 C CD2 . TYR A 326 ? 1.1002 0.7829 0.5872 -0.3003 -0.1005 0.0967 347 TYR A CD2 2534 C CE1 . TYR A 326 ? 1.0784 0.6295 0.4940 -0.2904 -0.0989 0.0718 347 TYR A CE1 2535 C CE2 . TYR A 326 ? 1.0911 0.7541 0.5882 -0.2656 -0.0834 0.0853 347 TYR A CE2 2536 C CZ . TYR A 326 ? 1.1192 0.7157 0.5805 -0.2609 -0.0829 0.0729 347 TYR A CZ 2537 O OH . TYR A 326 ? 1.1799 0.7577 0.6527 -0.2257 -0.0667 0.0601 347 TYR A OH 2538 N N . ARG A 327 ? 1.1809 0.9839 0.6905 -0.4249 -0.1640 0.1363 348 ARG A N 2539 C CA . ARG A 327 ? 1.2501 1.0736 0.7564 -0.4538 -0.1769 0.1458 348 ARG A CA 2540 C C . ARG A 327 ? 1.1942 1.0530 0.7163 -0.4414 -0.1717 0.1507 348 ARG A C 2541 O O . ARG A 327 ? 1.1643 1.0493 0.7127 -0.4099 -0.1576 0.1494 348 ARG A O 2542 C CB . ARG A 327 ? 1.3005 1.1740 0.8318 -0.4642 -0.1832 0.1599 348 ARG A CB 2543 C CG . ARG A 327 ? 1.2688 1.2133 0.8591 -0.4471 -0.1772 0.1666 348 ARG A CG 2544 C CD . ARG A 327 ? 1.2551 1.2391 0.8611 -0.4580 -0.1834 0.1802 348 ARG A CD 2545 N NE . ARG A 327 ? 1.2706 1.3229 0.9203 -0.4527 -0.1814 0.1922 348 ARG A NE 2546 C CZ . ARG A 327 ? 1.1874 1.2922 0.8809 -0.4355 -0.1755 0.1979 348 ARG A CZ 2547 N NH1 . ARG A 327 ? 1.1328 1.2321 0.8341 -0.4238 -0.1718 0.1931 348 ARG A NH1 2548 N NH2 . ARG A 327 ? 1.1373 1.2982 0.8648 -0.4296 -0.1732 0.2086 348 ARG A NH2 2549 N N . TRP A 328 ? 1.2111 1.0707 0.7146 -0.4612 -0.1819 0.1562 349 TRP A N 2550 C CA . TRP A 328 ? 1.1860 1.0739 0.6911 -0.4448 -0.1808 0.1570 349 TRP A CA 2551 C C . TRP A 328 ? 1.2205 1.1722 0.7615 -0.4630 -0.1895 0.1718 349 TRP A C 2552 O O . TRP A 328 ? 1.2918 1.2491 0.8382 -0.4923 -0.1962 0.1827 349 TRP A O 2553 C CB . TRP A 328 ? 1.1800 1.0073 0.6216 -0.4426 -0.1862 0.1447 349 TRP A CB 2554 C CG . TRP A 328 ? 1.1724 0.9378 0.5789 -0.4190 -0.1735 0.1304 349 TRP A CG 2555 C CD1 . TRP A 328 ? 1.2223 0.9291 0.6013 -0.4267 -0.1726 0.1227 349 TRP A CD1 2556 C CD2 . TRP A 328 ? 1.1891 0.9423 0.5852 -0.3837 -0.1578 0.1227 349 TRP A CD2 2557 N NE1 . TRP A 328 ? 1.2921 0.9515 0.6454 -0.3987 -0.1583 0.1099 349 TRP A NE1 2558 C CE2 . TRP A 328 ? 1.2355 0.9215 0.5991 -0.3720 -0.1481 0.1095 349 TRP A CE2 2559 C CE3 . TRP A 328 ? 1.1159 0.9073 0.5285 -0.3602 -0.1493 0.1260 349 TRP A CE3 2560 C CZ2 . TRP A 328 ? 1.1456 0.8007 0.4943 -0.3386 -0.1296 0.0988 349 TRP A CZ2 2561 C CZ3 . TRP A 328 ? 1.0590 0.8194 0.4560 -0.3264 -0.1296 0.1161 349 TRP A CZ3 2562 C CH2 . TRP A 328 ? 1.0839 0.7764 0.4499 -0.3162 -0.1197 0.1022 349 TRP A CH2 2563 N N . LEU A 329 ? 1.1452 1.1406 0.7072 -0.4430 -0.1855 0.1746 350 LEU A N 2564 C CA . LEU A 329 ? 1.0767 1.1360 0.6763 -0.4550 -0.1913 0.1887 350 LEU A CA 2565 C C . LEU A 329 ? 1.1199 1.1868 0.6991 -0.4393 -0.1959 0.1853 350 LEU A C 2566 O O . LEU A 329 ? 1.0839 1.1333 0.6458 -0.4089 -0.1850 0.1776 350 LEU A O 2567 C CB . LEU A 329 ? 1.0535 1.1810 0.7228 -0.4445 -0.1783 0.1996 350 LEU A CB 2568 C CG . LEU A 329 ? 1.0284 1.1810 0.7250 -0.4552 -0.1776 0.2099 350 LEU A CG 2569 C CD1 . LEU A 329 ? 1.0964 1.1914 0.7567 -0.4637 -0.1817 0.2013 350 LEU A CD1 2570 C CD2 . LEU A 329 ? 0.9627 1.1718 0.7122 -0.4250 -0.1659 0.2117 350 LEU A CD2 2571 N N . LYS A 330 ? 1.1856 1.2762 0.7656 -0.4584 -0.2099 0.1922 351 LYS A N 2572 C CA . LYS A 330 ? 1.1520 1.2644 0.7227 -0.4435 -0.2152 0.1920 351 LYS A CA 2573 C C . LYS A 330 ? 1.1106 1.2980 0.7387 -0.4505 -0.2151 0.2089 351 LYS A C 2574 O O . LYS A 330 ? 1.1770 1.3774 0.8153 -0.4776 -0.2238 0.2174 351 LYS A O 2575 C CB . LYS A 330 ? 1.2506 1.3171 0.7607 -0.4560 -0.2340 0.1814 351 LYS A CB 2576 C CG . LYS A 330 ? 1.2227 1.3144 0.7211 -0.4425 -0.2421 0.1826 351 LYS A CG 2577 C CD . LYS A 330 ? 1.3207 1.3689 0.7597 -0.4554 -0.2622 0.1707 351 LYS A CD 2578 C CE . LYS A 330 ? 1.3299 1.4082 0.7588 -0.4427 -0.2722 0.1735 351 LYS A CE 2579 N NZ . LYS A 330 ? 1.3216 1.3507 0.6822 -0.4451 -0.2889 0.1589 351 LYS A NZ 2580 N N . ASN A 331 ? 1.0245 1.2581 0.6890 -0.4245 -0.2022 0.2148 352 ASN A N 2581 C CA . ASN A 331 ? 1.0305 1.3351 0.7488 -0.4282 -0.1996 0.2312 352 ASN A CA 2582 C C . ASN A 331 ? 1.0860 1.4197 0.8470 -0.4509 -0.1909 0.2470 352 ASN A C 2583 O O . ASN A 331 ? 1.0937 1.4615 0.8729 -0.4639 -0.1913 0.2625 352 ASN A O 2584 C CB . ASN A 331 ? 1.0283 1.3350 0.7193 -0.4380 -0.2189 0.2315 352 ASN A CB 2585 C CG . ASN A 331 ? 1.0956 1.3852 0.7459 -0.4093 -0.2217 0.2232 352 ASN A CG 2586 O OD1 . ASN A 331 ? 1.0640 1.3480 0.7149 -0.3793 -0.2045 0.2208 352 ASN A OD1 2587 N ND2 . ASN A 331 ? 1.2196 1.4984 0.8322 -0.4164 -0.2411 0.2197 352 ASN A ND2 2588 N N . GLY A 332 ? 1.1217 1.4347 0.8877 -0.4520 -0.1809 0.2449 353 GLY A N 2589 C CA . GLY A 332 ? 1.1223 1.4531 0.9058 -0.4523 -0.1775 0.2540 353 GLY A CA 2590 C C . GLY A 332 ? 1.1830 1.4728 0.9292 -0.4779 -0.1890 0.2548 353 GLY A C 2591 O O . GLY A 332 ? 1.1598 1.4594 0.9139 -0.4759 -0.1898 0.2588 353 GLY A O 2592 N N . ASP A 333 ? 1.2864 1.5281 0.9909 -0.5007 -0.1973 0.2506 354 ASP A N 2593 C CA . ASP A 333 ? 1.4096 1.6105 1.0770 -0.5229 -0.2073 0.2509 354 ASP A CA 2594 C C . ASP A 333 ? 1.3192 1.4547 0.9480 -0.5284 -0.2088 0.2373 354 ASP A C 2595 O O . ASP A 333 ? 1.2952 1.4052 0.9061 -0.5170 -0.2141 0.2192 354 ASP A O 2596 C CB . ASP A 333 ? 1.5885 1.7885 1.2388 -0.5398 -0.2221 0.2510 354 ASP A CB 2597 C CG . ASP A 333 ? 1.6735 1.9325 1.3581 -0.5365 -0.2193 0.2664 354 ASP A CG 2598 O OD1 . ASP A 333 ? 1.6729 1.9693 1.3892 -0.5217 -0.2086 0.2760 354 ASP A OD1 2599 O OD2 . ASP A 333 ? 1.7304 1.9988 1.4102 -0.5423 -0.2334 0.2618 354 ASP A OD2 2600 N N . PRO A 334 ? 1.3191 1.4298 0.9313 -0.5337 -0.2120 0.2351 355 PRO A N 2601 C CA . PRO A 334 ? 1.3937 1.4402 0.9662 -0.5385 -0.2134 0.2228 355 PRO A CA 2602 C C . PRO A 334 ? 1.4330 1.4312 0.9632 -0.5512 -0.2226 0.2126 355 PRO A C 2603 O O . PRO A 334 ? 1.5597 1.5595 1.0772 -0.5652 -0.2339 0.2132 355 PRO A O 2604 C CB . PRO A 334 ? 1.4764 1.5144 1.0378 -0.5473 -0.2181 0.2258 355 PRO A CB 2605 C CG . PRO A 334 ? 1.4389 1.5381 1.0445 -0.5361 -0.2148 0.2356 355 PRO A CG 2606 C CD . PRO A 334 ? 1.3893 1.5316 1.0203 -0.5328 -0.2132 0.2435 355 PRO A CD 2607 N N . LEU A 335 ? 1.4094 1.3679 0.9172 -0.5377 -0.2221 0.1950 356 LEU A N 2608 C CA . LEU A 335 ? 1.4801 1.3926 0.9390 -0.5367 -0.2341 0.1772 356 LEU A CA 2609 C C . LEU A 335 ? 1.5163 1.3574 0.9316 -0.5441 -0.2326 0.1679 356 LEU A C 2610 O O . LEU A 335 ? 1.5269 1.3401 0.9359 -0.5297 -0.2226 0.1615 356 LEU A O 2611 C CB . LEU A 335 ? 1.4813 1.3999 0.9339 -0.5066 -0.2314 0.1665 356 LEU A CB 2612 C CG . LEU A 335 ? 1.6326 1.5041 1.0269 -0.4968 -0.2396 0.1500 356 LEU A CG 2613 C CD1 . LEU A 335 ? 1.6272 1.5218 1.0230 -0.4640 -0.2320 0.1486 356 LEU A CD1 2614 C CD2 . LEU A 335 ? 1.7084 1.5045 1.0568 -0.4963 -0.2351 0.1364 356 LEU A CD2 2615 N N . LEU A 336 ? 1.5445 1.3567 0.9307 -0.5645 -0.2416 0.1670 357 LEU A N 2616 C CA . LEU A 336 ? 1.5841 1.3295 0.9276 -0.5710 -0.2394 0.1595 357 LEU A CA 2617 C C . LEU A 336 ? 1.6906 1.3929 0.9888 -0.5726 -0.2502 0.1415 357 LEU A C 2618 O O . LEU A 336 ? 1.7253 1.4513 1.0221 -0.5723 -0.2618 0.1367 357 LEU A O 2619 C CB . LEU A 336 ? 1.5684 1.3116 0.9093 -0.5884 -0.2373 0.1740 357 LEU A CB 2620 C CG . LEU A 336 ? 1.5589 1.2503 0.8673 -0.5862 -0.2291 0.1735 357 LEU A CG 2621 C CD1 . LEU A 336 ? 1.4550 1.1605 0.7896 -0.5658 -0.2206 0.1706 357 LEU A CD1 2622 C CD2 . LEU A 336 ? 1.5955 1.2887 0.8944 -0.5982 -0.2320 0.1800 357 LEU A CD2 2623 N N . THR A 337 ? 1.7393 1.3784 0.9983 -0.5728 -0.2459 0.1321 358 THR A N 2624 C CA . THR A 337 ? 1.7822 1.3740 0.9947 -0.5707 -0.2527 0.1141 358 THR A CA 2625 C C . THR A 337 ? 1.9108 1.5061 1.1095 -0.5897 -0.2674 0.1111 358 THR A C 2626 O O . THR A 337 ? 1.9143 1.5159 1.1219 -0.6075 -0.2682 0.1206 358 THR A O 2627 C CB . THR A 337 ? 1.8138 1.3366 0.9904 -0.5665 -0.2423 0.1065 358 THR A CB 2628 O OG1 . THR A 337 ? 1.8996 1.3815 1.0371 -0.5783 -0.2494 0.0964 358 THR A OG1 2629 C CG2 . THR A 337 ? 1.8417 1.3629 1.0322 -0.5724 -0.2325 0.1216 358 THR A CG2 2630 N N . ARG A 338 ? 2.0173 1.6091 1.1916 -0.5823 -0.2782 0.0975 359 ARG A N 2631 C CA . ARG A 338 ? 2.1336 1.7235 1.2889 -0.5968 -0.2935 0.0901 359 ARG A CA 2632 C C . ARG A 338 ? 2.2027 1.7469 1.3056 -0.5858 -0.2983 0.0706 359 ARG A C 2633 O O . ARG A 338 ? 2.2340 1.7243 1.3082 -0.5784 -0.2876 0.0627 359 ARG A O 2634 C CB . ARG A 338 ? 2.1330 1.7877 1.3190 -0.5988 -0.3061 0.0968 359 ARG A CB 2635 C CG . ARG A 338 ? 2.1314 1.8365 1.3705 -0.6065 -0.2998 0.1167 359 ARG A CG 2636 C CD . ARG A 338 ? 2.1737 1.9383 1.4411 -0.6091 -0.3122 0.1223 359 ARG A CD 2637 N NE . ARG A 338 ? 2.1726 1.9531 1.4257 -0.5893 -0.3206 0.1142 359 ARG A NE 2638 C CZ . ARG A 338 ? 2.0862 1.8958 1.3585 -0.5689 -0.3125 0.1206 359 ARG A CZ 2639 N NH1 . ARG A 338 ? 1.9608 1.7878 1.2704 -0.5674 -0.2973 0.1333 359 ARG A NH1 2640 N NH2 . ARG A 338 ? 2.0823 1.9039 1.3349 -0.5478 -0.3183 0.1150 359 ARG A NH2 2641 N N . ASP A 339 ? 2.2289 1.7948 1.3183 -0.5832 -0.3139 0.0635 360 ASP A N 2642 C CA . ASP A 339 ? 2.2807 1.8092 1.3164 -0.5697 -0.3189 0.0462 360 ASP A CA 2643 C C . ASP A 339 ? 2.1655 1.7382 1.1995 -0.5510 -0.3280 0.0475 360 ASP A C 2644 O O . ASP A 339 ? 2.1060 1.7323 1.1707 -0.5590 -0.3403 0.0557 360 ASP A O 2645 C CB . ASP A 339 ? 2.4491 1.9485 1.4564 -0.5882 -0.3307 0.0342 360 ASP A CB 2646 C CG . ASP A 339 ? 2.5453 2.0085 1.5581 -0.6063 -0.3204 0.0368 360 ASP A CG 2647 O OD1 . ASP A 339 ? 2.5854 2.0504 1.6015 -0.6252 -0.3282 0.0355 360 ASP A OD1 2648 O OD2 . ASP A 339 ? 2.5490 1.9829 1.5624 -0.5995 -0.3040 0.0409 360 ASP A OD2 2649 N N . ARG A 340 ? 2.1318 1.6816 1.1298 -0.5245 -0.3200 0.0407 361 ARG A N 2650 C CA . ARG A 340 ? 2.1188 1.6021 1.0812 -0.5145 -0.3039 0.0300 361 ARG A CA 2651 C C . ARG A 340 ? 2.0090 1.4963 1.0029 -0.5006 -0.2837 0.0393 361 ARG A C 2652 O O . ARG A 340 ? 1.9581 1.4067 0.9286 -0.4788 -0.2670 0.0327 361 ARG A O 2653 C CB . ARG A 340 ? 2.1814 1.6333 1.0857 -0.4912 -0.3023 0.0173 361 ARG A CB 2654 C CG . ARG A 340 ? 2.2390 1.7059 1.1147 -0.4971 -0.3244 0.0106 361 ARG A CG 2655 C CD . ARG A 340 ? 2.2235 1.7495 1.1098 -0.4780 -0.3309 0.0218 361 ARG A CD 2656 N NE . ARG A 340 ? 2.1880 1.7772 1.1413 -0.4843 -0.3309 0.0398 361 ARG A NE 2657 C CZ . ARG A 340 ? 2.1399 1.7877 1.1180 -0.4703 -0.3343 0.0529 361 ARG A CZ 2658 N NH1 . ARG A 340 ? 2.1719 1.8228 1.1107 -0.4477 -0.3380 0.0513 361 ARG A NH1 2659 N NH2 . ARG A 340 ? 2.0545 1.7571 1.0964 -0.4784 -0.3328 0.0686 361 ARG A NH2 2660 N N . ILE A 341 ? 1.9430 1.4766 0.9913 -0.5129 -0.2844 0.0543 362 ILE A N 2661 C CA . ILE A 341 ? 1.8679 1.4174 0.9526 -0.5000 -0.2676 0.0644 362 ILE A CA 2662 C C . ILE A 341 ? 1.9125 1.4212 1.0027 -0.5129 -0.2581 0.0644 362 ILE A C 2663 O O . ILE A 341 ? 1.9204 1.4421 1.0348 -0.5367 -0.2629 0.0734 362 ILE A O 2664 C CB . ILE A 341 ? 1.7974 1.4235 0.9398 -0.5045 -0.2720 0.0821 362 ILE A CB 2665 C CG1 . ILE A 341 ? 1.7887 1.4575 0.9279 -0.4898 -0.2808 0.0846 362 ILE A CG1 2666 C CG2 . ILE A 341 ? 1.7320 1.3763 0.9134 -0.4906 -0.2543 0.0917 362 ILE A CG2 2667 C CD1 . ILE A 341 ? 1.7538 1.4978 0.9503 -0.4977 -0.2871 0.1013 362 ILE A CD1 2668 N N . GLN A 342 ? 1.8993 1.3580 0.9663 -0.4951 -0.2424 0.0554 363 GLN A N 2669 C CA . GLN A 342 ? 1.9024 1.3186 0.9709 -0.5026 -0.2322 0.0558 363 GLN A CA 2670 C C . GLN A 342 ? 1.7971 1.2317 0.9009 -0.4849 -0.2173 0.0634 363 GLN A C 2671 O O . GLN A 342 ? 1.7508 1.1687 0.8464 -0.4571 -0.2033 0.0560 363 GLN A O 2672 C CB . GLN A 342 ? 2.0197 1.3613 1.0385 -0.4964 -0.2249 0.0399 363 GLN A CB 2673 C CG . GLN A 342 ? 2.1539 1.4506 1.1715 -0.5010 -0.2133 0.0424 363 GLN A CG 2674 C CD . GLN A 342 ? 2.2925 1.6094 1.3307 -0.5272 -0.2203 0.0571 363 GLN A CD 2675 O OE1 . GLN A 342 ? 2.3893 1.7198 1.4227 -0.5475 -0.2335 0.0583 363 GLN A OE1 2676 N NE2 . GLN A 342 ? 2.2609 1.5805 1.3206 -0.5244 -0.2106 0.0686 363 GLN A NE2 2677 N N . ILE A 343 ? 1.7135 1.1826 0.8570 -0.4993 -0.2187 0.0781 364 ILE A N 2678 C CA . ILE A 343 ? 1.6221 1.1116 0.8009 -0.4834 -0.2058 0.0850 364 ILE A CA 2679 C C . ILE A 343 ? 1.6408 1.0913 0.8165 -0.4906 -0.1979 0.0890 364 ILE A C 2680 O O . ILE A 343 ? 1.6520 1.1108 0.8343 -0.5124 -0.2027 0.1018 364 ILE A O 2681 C CB . ILE A 343 ? 1.4053 0.9745 0.6378 -0.4861 -0.2095 0.1004 364 ILE A CB 2682 C CG1 . ILE A 343 ? 1.5145 1.1049 0.7658 -0.5173 -0.2185 0.1145 364 ILE A CG1 2683 C CG2 . ILE A 343 ? 1.3127 0.9231 0.5481 -0.4749 -0.2156 0.1000 364 ILE A CG2 2684 C CD1 . ILE A 343 ? 1.5044 1.1676 0.8112 -0.5200 -0.2185 0.1305 364 ILE A CD1 2685 N N . GLU A 344 ? 1.6718 1.0800 0.8339 -0.4683 -0.1840 0.0799 365 GLU A N 2686 C CA . GLU A 344 ? 1.7568 1.1314 0.9126 -0.4670 -0.1753 0.0857 365 GLU A CA 2687 C C . GLU A 344 ? 1.6557 1.0464 0.8447 -0.4430 -0.1630 0.0854 365 GLU A C 2688 O O . GLU A 344 ? 1.6050 0.9727 0.7894 -0.4161 -0.1513 0.0722 365 GLU A O 2689 C CB . GLU A 344 ? 1.9045 1.2094 1.0100 -0.4615 -0.1700 0.0758 365 GLU A CB 2690 C CG . GLU A 344 ? 2.0645 1.3528 1.1417 -0.4870 -0.1800 0.0804 365 GLU A CG 2691 C CD . GLU A 344 ? 2.1684 1.4790 1.2534 -0.4986 -0.1832 0.0953 365 GLU A CD 2692 O OE1 . GLU A 344 ? 2.1716 1.5003 1.2822 -0.4832 -0.1787 0.0934 365 GLU A OE1 2693 O OE2 . GLU A 344 ? 2.2239 1.5388 1.2983 -0.5204 -0.1917 0.1008 365 GLU A OE2 2694 N N . GLN A 345 ? 1.6084 1.0482 0.8349 -0.4477 -0.1675 0.0928 366 GLN A N 2695 C CA . GLN A 345 ? 1.5165 0.9826 0.7811 -0.4244 -0.1591 0.0879 366 GLN A CA 2696 C C . GLN A 345 ? 1.4743 0.9780 0.7707 -0.4032 -0.1498 0.0872 366 GLN A C 2697 O O . GLN A 345 ? 1.4638 1.0258 0.7866 -0.4102 -0.1553 0.0981 366 GLN A O 2698 C CB . GLN A 345 ? 1.5327 0.9463 0.7706 -0.4014 -0.1494 0.0759 366 GLN A CB 2699 C CG . GLN A 345 ? 1.6092 0.9953 0.8156 -0.4151 -0.1561 0.0787 366 GLN A CG 2700 C CD . GLN A 345 ? 1.6940 1.0239 0.8668 -0.3943 -0.1468 0.0679 366 GLN A CD 2701 O OE1 . GLN A 345 ? 1.7706 1.0576 0.9013 -0.4020 -0.1479 0.0665 366 GLN A OE1 2702 N NE2 . GLN A 345 ? 1.6444 0.9773 0.8375 -0.3672 -0.1371 0.0607 366 GLN A NE2 2703 N N . GLY A 346 ? 1.4108 0.8889 0.7034 -0.3700 -0.1336 0.0763 367 GLY A N 2704 C CA . GLY A 346 ? 1.3352 0.8536 0.6572 -0.3393 -0.1193 0.0773 367 GLY A CA 2705 C C . GLY A 346 ? 1.3609 0.8541 0.6472 -0.3311 -0.1161 0.0697 367 GLY A C 2706 O O . GLY A 346 ? 1.3099 0.8079 0.6069 -0.2999 -0.0990 0.0641 367 GLY A O 2707 N N . THR A 347 ? 1.3671 0.8337 0.6127 -0.3581 -0.1317 0.0684 368 THR A N 2708 C CA . THR A 347 ? 1.3729 0.8121 0.5793 -0.3517 -0.1308 0.0587 368 THR A CA 2709 C C . THR A 347 ? 1.3695 0.8408 0.5665 -0.3762 -0.1498 0.0659 368 THR A C 2710 O O . THR A 347 ? 1.4448 0.9214 0.6418 -0.4075 -0.1659 0.0721 368 THR A O 2711 C CB . THR A 347 ? 1.4706 0.8246 0.6274 -0.3538 -0.1279 0.0423 368 THR A CB 2712 O OG1 . THR A 347 ? 1.5790 0.9106 0.7175 -0.3878 -0.1433 0.0471 368 THR A OG1 2713 C CG2 . THR A 347 ? 1.3759 0.6955 0.5431 -0.3285 -0.1096 0.0344 368 THR A CG2 2714 N N . LEU A 348 ? 1.2513 0.7428 0.4412 -0.3605 -0.1465 0.0653 369 LEU A N 2715 C CA . LEU A 348 ? 1.2982 0.8186 0.4762 -0.3789 -0.1647 0.0704 369 LEU A CA 2716 C C . LEU A 348 ? 1.4397 0.9108 0.5619 -0.3701 -0.1634 0.0563 369 LEU A C 2717 O O . LEU A 348 ? 1.4321 0.8820 0.5433 -0.3399 -0.1439 0.0494 369 LEU A O 2718 C CB . LEU A 348 ? 1.0798 0.6805 0.3053 -0.3687 -0.1637 0.0859 369 LEU A CB 2719 C CG . LEU A 348 ? 1.1016 0.7390 0.3201 -0.3842 -0.1826 0.0920 369 LEU A CG 2720 C CD1 . LEU A 348 ? 1.0860 0.8061 0.3647 -0.3887 -0.1869 0.1098 369 LEU A CD1 2721 C CD2 . LEU A 348 ? 1.1259 0.7441 0.3044 -0.3616 -0.1766 0.0851 369 LEU A CD2 2722 N N . ASN A 349 ? 1.5597 1.0122 0.6489 -0.3962 -0.1824 0.0517 370 ASN A N 2723 C CA . ASN A 349 ? 1.6354 1.0372 0.6682 -0.3917 -0.1831 0.0371 370 ASN A CA 2724 C C . ASN A 349 ? 1.6070 1.0368 0.6220 -0.4071 -0.2041 0.0395 370 ASN A C 2725 O O . ASN A 349 ? 1.6254 1.0633 0.6445 -0.4372 -0.2226 0.0415 370 ASN A O 2726 C CB . ASN A 349 ? 1.7782 1.1074 0.7803 -0.4064 -0.1824 0.0239 370 ASN A CB 2727 C CG . ASN A 349 ? 1.9473 1.2129 0.9027 -0.3876 -0.1686 0.0071 370 ASN A CG 2728 O OD1 . ASN A 349 ? 1.9158 1.1829 0.8417 -0.3765 -0.1693 0.0029 370 ASN A OD1 2729 N ND2 . ASN A 349 ? 2.2086 1.4176 1.1581 -0.3825 -0.1546 -0.0012 370 ASN A ND2 2730 N N . ILE A 350 ? 1.6055 1.0500 0.6025 -0.3849 -0.1998 0.0400 371 ILE A N 2731 C CA . ILE A 350 ? 1.6604 1.1230 0.6312 -0.3952 -0.2198 0.0398 371 ILE A CA 2732 C C . ILE A 350 ? 1.7355 1.1328 0.6397 -0.3875 -0.2168 0.0224 371 ILE A C 2733 O O . ILE A 350 ? 1.6938 1.0688 0.5751 -0.3579 -0.1973 0.0189 371 ILE A O 2734 C CB . ILE A 350 ? 1.5759 1.1052 0.5719 -0.3766 -0.2193 0.0551 371 ILE A CB 2735 C CG1 . ILE A 350 ? 1.5287 1.1200 0.5950 -0.3800 -0.2164 0.0716 371 ILE A CG1 2736 C CG2 . ILE A 350 ? 1.5752 1.1291 0.5506 -0.3907 -0.2440 0.0557 371 ILE A CG2 2737 C CD1 . ILE A 350 ? 1.5126 1.1772 0.6131 -0.3705 -0.2209 0.0876 371 ILE A CD1 2738 N N . THR A 351 ? 1.8904 1.2569 0.7666 -0.4140 -0.2339 0.0118 372 THR A N 2739 C CA . THR A 351 ? 2.0124 1.3156 0.8268 -0.4107 -0.2322 -0.0056 372 THR A CA 2740 C C . THR A 351 ? 2.0369 1.3541 0.8129 -0.3922 -0.2367 -0.0059 372 THR A C 2741 O O . THR A 351 ? 2.0757 1.3501 0.8095 -0.3689 -0.2198 -0.0145 372 THR A O 2742 C CB . THR A 351 ? 2.1016 1.3756 0.9021 -0.4441 -0.2492 -0.0151 372 THR A CB 2743 O OG1 . THR A 351 ? 2.1027 1.3358 0.9183 -0.4530 -0.2369 -0.0175 372 THR A OG1 2744 C CG2 . THR A 351 ? 2.1674 1.3961 0.9056 -0.4427 -0.2544 -0.0313 372 THR A CG2 2745 N N . ILE A 352 ? 2.0025 1.3781 0.7938 -0.4021 -0.2583 0.0037 373 ILE A N 2746 C CA . ILE A 352 ? 1.9764 1.3744 0.7364 -0.3827 -0.2637 0.0072 373 ILE A CA 2747 C C . ILE A 352 ? 1.9497 1.4289 0.7620 -0.3788 -0.2712 0.0274 373 ILE A C 2748 O O . ILE A 352 ? 2.0041 1.5235 0.8654 -0.4028 -0.2848 0.0344 373 ILE A O 2749 C CB . ILE A 352 ? 1.9539 1.3321 0.6646 -0.3985 -0.2870 -0.0063 373 ILE A CB 2750 C CG1 . ILE A 352 ? 1.9187 1.2156 0.5756 -0.3986 -0.2762 -0.0260 373 ILE A CG1 2751 C CG2 . ILE A 352 ? 1.9978 1.4075 0.6795 -0.3784 -0.2958 -0.0001 373 ILE A CG2 2752 C CD1 . ILE A 352 ? 2.0214 1.2967 0.6281 -0.4118 -0.2970 -0.0406 373 ILE A CD1 2753 N N . VAL A 353 ? 1.8616 1.3634 0.6656 -0.3483 -0.2599 0.0376 374 VAL A N 2754 C CA . VAL A 353 ? 1.7760 1.3537 0.6356 -0.3403 -0.2611 0.0582 374 VAL A CA 2755 C C . VAL A 353 ? 1.7753 1.3939 0.6201 -0.3392 -0.2832 0.0639 374 VAL A C 2756 O O . VAL A 353 ? 1.8342 1.4203 0.6167 -0.3293 -0.2887 0.0551 374 VAL A O 2757 C CB . VAL A 353 ? 1.6713 1.2542 0.5504 -0.3045 -0.2277 0.0690 374 VAL A CB 2758 C CG1 . VAL A 353 ? 1.6875 1.3423 0.6045 -0.2880 -0.2275 0.0892 374 VAL A CG1 2759 C CG2 . VAL A 353 ? 1.4263 1.0022 0.3511 -0.3089 -0.2114 0.0690 374 VAL A CG2 2760 N N . ASN A 354 ? 1.7659 1.4549 0.6685 -0.3496 -0.2962 0.0781 375 ASN A N 2761 C CA . ASN A 354 ? 1.8213 1.5573 0.7208 -0.3446 -0.3151 0.0861 375 ASN A CA 2762 C C . ASN A 354 ? 1.7776 1.5849 0.7425 -0.3317 -0.3062 0.1080 375 ASN A C 2763 O O . ASN A 354 ? 1.7017 1.5294 0.7221 -0.3353 -0.2916 0.1154 375 ASN A O 2764 C CB . ASN A 354 ? 1.8722 1.6213 0.7737 -0.3781 -0.3479 0.0766 375 ASN A CB 2765 C CG . ASN A 354 ? 1.8567 1.6356 0.8261 -0.4090 -0.3527 0.0804 375 ASN A CG 2766 O OD1 . ASN A 354 ? 1.7614 1.5798 0.7877 -0.4054 -0.3393 0.0951 375 ASN A OD1 2767 N ND2 . ASN A 354 ? 1.9321 1.6916 0.8964 -0.4391 -0.3700 0.0677 375 ASN A ND2 2768 N N . LEU A 355 ? 1.8258 1.6710 0.7846 -0.3158 -0.3146 0.1178 376 LEU A N 2769 C CA . LEU A 355 ? 1.7613 1.6754 0.7824 -0.3017 -0.3052 0.1388 376 LEU A CA 2770 C C . LEU A 355 ? 1.6451 1.6088 0.7460 -0.3295 -0.3107 0.1452 376 LEU A C 2771 O O . LEU A 355 ? 1.5061 1.5159 0.6669 -0.3198 -0.2942 0.1601 376 LEU A O 2772 C CB . LEU A 355 ? 1.7810 1.7319 0.7868 -0.2901 -0.3225 0.1467 376 LEU A CB 2773 C CG . LEU A 355 ? 1.8091 1.7364 0.7611 -0.2500 -0.3047 0.1527 376 LEU A CG 2774 C CD1 . LEU A 355 ? 1.9094 1.8533 0.8220 -0.2441 -0.3300 0.1537 376 LEU A CD1 2775 C CD2 . LEU A 355 ? 1.6940 1.6580 0.6987 -0.2223 -0.2730 0.1722 376 LEU A CD2 2776 N N . SER A 356 ? 1.7304 1.6831 0.8324 -0.3637 -0.3320 0.1337 377 SER A N 2777 C CA . SER A 356 ? 1.7019 1.6957 0.8744 -0.3925 -0.3368 0.1395 377 SER A CA 2778 C C . SER A 356 ? 1.6852 1.6717 0.8930 -0.3902 -0.3123 0.1438 377 SER A C 2779 O O . SER A 356 ? 1.6940 1.7266 0.9678 -0.4026 -0.3077 0.1548 377 SER A O 2780 C CB . SER A 356 ? 1.7132 1.6834 0.8727 -0.4269 -0.3590 0.1253 377 SER A CB 2781 O OG . SER A 356 ? 1.6560 1.6723 0.8817 -0.4532 -0.3646 0.1336 377 SER A OG 2782 N N . ASP A 357 ? 1.6797 1.6071 0.8435 -0.3739 -0.2958 0.1348 378 ASP A N 2783 C CA . ASP A 357 ? 1.5908 1.5015 0.7811 -0.3717 -0.2742 0.1351 378 ASP A CA 2784 C C . ASP A 357 ? 1.3987 1.3524 0.6379 -0.3441 -0.2494 0.1504 378 ASP A C 2785 O O . ASP A 357 ? 1.3373 1.3130 0.6287 -0.3490 -0.2380 0.1560 378 ASP A O 2786 C CB . ASP A 357 ? 1.6748 1.5044 0.8038 -0.3649 -0.2644 0.1185 378 ASP A CB 2787 C CG . ASP A 357 ? 1.7774 1.5653 0.8673 -0.3945 -0.2865 0.1028 378 ASP A CG 2788 O OD1 . ASP A 357 ? 1.7194 1.5342 0.8437 -0.4244 -0.3027 0.1049 378 ASP A OD1 2789 O OD2 . ASP A 357 ? 1.8708 1.5981 0.8976 -0.3877 -0.2853 0.0884 378 ASP A OD2 2790 N N . ALA A 358 ? 1.3661 1.3313 0.5893 -0.3145 -0.2402 0.1569 379 ALA A N 2791 C CA . ALA A 358 ? 1.2706 1.2799 0.5448 -0.2866 -0.2148 0.1714 379 ALA A CA 2792 C C . ALA A 358 ? 1.1944 1.2718 0.5517 -0.3038 -0.2165 0.1833 379 ALA A C 2793 O O . ALA A 358 ? 1.2193 1.3360 0.6002 -0.3289 -0.2387 0.1880 379 ALA A O 2794 C CB . ALA A 358 ? 1.2554 1.2873 0.5132 -0.2613 -0.2127 0.1809 379 ALA A CB 2795 N N . GLY A 359 ? 1.1100 1.2002 0.5132 -0.2900 -0.1920 0.1872 380 GLY A N 2796 C CA . GLY A 359 ? 1.0713 1.2236 0.5522 -0.3050 -0.1911 0.1977 380 GLY A CA 2797 C C . GLY A 359 ? 1.0655 1.2130 0.5827 -0.2936 -0.1673 0.1957 380 GLY A C 2798 O O . GLY A 359 ? 1.0578 1.1572 0.5472 -0.2695 -0.1477 0.1867 380 GLY A O 2799 N N . MET A 360 ? 0.9993 1.1966 0.5801 -0.3107 -0.1684 0.2034 381 MET A N 2800 C CA . MET A 360 ? 1.0207 1.2227 0.6423 -0.3003 -0.1484 0.2017 381 MET A CA 2801 C C . MET A 360 ? 0.9726 1.1279 0.5702 -0.3248 -0.1578 0.1924 381 MET A C 2802 O O . MET A 360 ? 0.9617 1.1218 0.5573 -0.3582 -0.1780 0.1946 381 MET A O 2803 C CB . MET A 360 ? 1.0344 1.3199 0.7408 -0.3031 -0.1423 0.2156 381 MET A CB 2804 C CG . MET A 360 ? 0.9825 1.3205 0.7187 -0.2829 -0.1348 0.2265 381 MET A CG 2805 S SD . MET A 360 ? 0.9691 1.2819 0.6964 -0.2324 -0.1027 0.2207 381 MET A SD 2806 C CE . MET A 360 ? 0.9569 1.2841 0.7454 -0.2192 -0.0811 0.2142 381 MET A CE 2807 N N . TYR A 361 ? 0.9097 1.0181 0.4911 -0.3072 -0.1413 0.1817 382 TYR A N 2808 C CA . TYR A 361 ? 0.9171 0.9797 0.4777 -0.3270 -0.1477 0.1733 382 TYR A CA 2809 C C . TYR A 361 ? 0.8784 0.9558 0.4865 -0.3135 -0.1297 0.1726 382 TYR A C 2810 O O . TYR A 361 ? 0.8432 0.9474 0.4886 -0.2827 -0.1086 0.1731 382 TYR A O 2811 C CB . TYR A 361 ? 0.9775 0.9558 0.4619 -0.3237 -0.1494 0.1580 382 TYR A CB 2812 C CG . TYR A 361 ? 1.1707 1.1315 0.6056 -0.3412 -0.1712 0.1559 382 TYR A CG 2813 C CD1 . TYR A 361 ? 1.1796 1.1505 0.5959 -0.3223 -0.1693 0.1582 382 TYR A CD1 2814 C CD2 . TYR A 361 ? 1.2553 1.1896 0.6639 -0.3754 -0.1928 0.1511 382 TYR A CD2 2815 C CE1 . TYR A 361 ? 1.3042 1.2600 0.6742 -0.3367 -0.1906 0.1550 382 TYR A CE1 2816 C CE2 . TYR A 361 ? 1.3545 1.2749 0.7223 -0.3904 -0.2128 0.1471 382 TYR A CE2 2817 C CZ . TYR A 361 ? 1.3709 1.3026 0.7183 -0.3708 -0.2129 0.1485 382 TYR A CZ 2818 O OH . TYR A 361 ? 1.4621 1.3805 0.7677 -0.3844 -0.2339 0.1433 382 TYR A OH 2819 N N . GLN A 362 ? 0.8816 0.9412 0.4893 -0.3359 -0.1378 0.1706 383 GLN A N 2820 C CA . GLN A 362 ? 0.8703 0.9464 0.5218 -0.3254 -0.1248 0.1697 383 GLN A CA 2821 C C . GLN A 362 ? 0.9744 0.9875 0.5892 -0.3377 -0.1289 0.1603 383 GLN A C 2822 O O . GLN A 362 ? 1.0736 1.0636 0.6606 -0.3698 -0.1467 0.1615 383 GLN A O 2823 C CB . GLN A 362 ? 0.8276 0.9818 0.5453 -0.3414 -0.1305 0.1830 383 GLN A CB 2824 C CG . GLN A 362 ? 0.8225 1.0474 0.5931 -0.3232 -0.1218 0.1919 383 GLN A CG 2825 C CD . GLN A 362 ? 0.8489 1.1506 0.6870 -0.3404 -0.1286 0.2035 383 GLN A CD 2826 O OE1 . GLN A 362 ? 0.8811 1.1933 0.7153 -0.3720 -0.1420 0.2136 383 GLN A OE1 2827 N NE2 . GLN A 362 ? 0.7681 1.1169 0.6603 -0.3133 -0.1186 0.2018 383 GLN A NE2 2828 N N . CYS A 363 ? 0.9643 0.9491 0.5814 -0.3114 -0.1115 0.1503 384 CYS A N 2829 C CA . CYS A 363 ? 0.9356 0.8657 0.5259 -0.3192 -0.1135 0.1419 384 CYS A CA 2830 C C . CYS A 363 ? 0.9186 0.8924 0.5635 -0.3149 -0.1089 0.1457 384 CYS A C 2831 O O . CYS A 363 ? 0.8741 0.8884 0.5659 -0.2863 -0.0929 0.1450 384 CYS A O 2832 C CB . CYS A 363 ? 0.9532 0.8158 0.5051 -0.2923 -0.0981 0.1262 384 CYS A CB 2833 S SG . CYS A 363 ? 1.3164 1.1036 0.8302 -0.3000 -0.1006 0.1147 384 CYS A SG 2834 N N . VAL A 364 ? 0.9331 0.9002 0.5724 -0.3427 -0.1231 0.1490 385 VAL A N 2835 C CA . VAL A 364 ? 0.8709 0.8766 0.5541 -0.3397 -0.1220 0.1519 385 VAL A CA 2836 C C . VAL A 364 ? 0.8897 0.8347 0.5420 -0.3349 -0.1191 0.1422 385 VAL A C 2837 O O . VAL A 364 ? 0.8951 0.7842 0.4988 -0.3565 -0.1299 0.1384 385 VAL A O 2838 C CB . VAL A 364 ? 0.8589 0.9127 0.5643 -0.3724 -0.1416 0.1628 385 VAL A CB 2839 C CG1 . VAL A 364 ? 0.7665 0.8645 0.5127 -0.3627 -0.1418 0.1652 385 VAL A CG1 2840 C CG2 . VAL A 364 ? 0.8196 0.9287 0.5524 -0.3796 -0.1461 0.1724 385 VAL A CG2 2841 N N . ALA A 365 ? 0.8488 0.8058 0.5307 -0.3056 -0.1043 0.1376 386 ALA A N 2842 C CA . ALA A 365 ? 0.8009 0.7047 0.4582 -0.2968 -0.1003 0.1287 386 ALA A CA 2843 C C . ALA A 365 ? 0.8380 0.7827 0.5305 -0.2985 -0.1032 0.1351 386 ALA A C 2844 O O . ALA A 365 ? 0.8797 0.8911 0.6259 -0.2848 -0.0976 0.1406 386 ALA A O 2845 C CB . ALA A 365 ? 0.7365 0.6104 0.3926 -0.2585 -0.0802 0.1157 386 ALA A CB 2846 N N . GLU A 366 ? 0.8621 0.7672 0.5235 -0.3142 -0.1122 0.1342 387 GLU A N 2847 C CA . GLU A 366 ? 0.9145 0.8544 0.6013 -0.3187 -0.1163 0.1414 387 GLU A CA 2848 C C . GLU A 366 ? 0.9560 0.8389 0.6100 -0.3152 -0.1149 0.1360 387 GLU A C 2849 O O . GLU A 366 ? 0.9688 0.7856 0.5721 -0.3248 -0.1196 0.1285 387 GLU A O 2850 C CB . GLU A 366 ? 1.0230 0.9980 0.7122 -0.3521 -0.1358 0.1514 387 GLU A CB 2851 C CG . GLU A 366 ? 1.2258 1.1437 0.8588 -0.3806 -0.1503 0.1482 387 GLU A CG 2852 C CD . GLU A 366 ? 1.4529 1.3946 1.0787 -0.4069 -0.1659 0.1544 387 GLU A CD 2853 O OE1 . GLU A 366 ? 1.5617 1.4553 1.1417 -0.4254 -0.1728 0.1525 387 GLU A OE1 2854 O OE2 . GLU A 366 ? 1.4836 1.4878 1.1495 -0.4035 -0.1644 0.1653 387 GLU A OE2 2855 N N . ASN A 367 ? 0.9831 0.8928 0.6663 -0.3001 -0.1081 0.1396 388 ASN A N 2856 C CA . ASN A 367 ? 0.9847 0.8536 0.6415 -0.3018 -0.1095 0.1389 388 ASN A CA 2857 C C . ASN A 367 ? 1.0067 0.9308 0.6975 -0.3097 -0.1132 0.1507 388 ASN A C 2858 O O . ASN A 367 ? 0.9331 0.9252 0.6681 -0.3099 -0.1147 0.1576 388 ASN A O 2859 C CB . ASN A 367 ? 0.9093 0.7370 0.5563 -0.2682 -0.0950 0.1287 388 ASN A CB 2860 C CG . ASN A 367 ? 0.8670 0.7492 0.5674 -0.2369 -0.0807 0.1296 388 ASN A CG 2861 O OD1 . ASN A 367 ? 0.8837 0.8351 0.6291 -0.2411 -0.0816 0.1393 388 ASN A OD1 2862 N ND2 . ASN A 367 ? 0.8486 0.7003 0.5443 -0.2040 -0.0680 0.1179 388 ASN A ND2 2863 N N . LYS A 368 ? 1.0506 0.9460 0.7203 -0.3150 -0.1150 0.1530 389 LYS A N 2864 C CA . LYS A 368 ? 1.0585 0.9999 0.7535 -0.3253 -0.1193 0.1642 389 LYS A CA 2865 C C . LYS A 368 ? 1.0528 1.0598 0.8039 -0.3014 -0.1089 0.1691 389 LYS A C 2866 O O . LYS A 368 ? 1.0954 1.1496 0.8729 -0.3078 -0.1129 0.1783 389 LYS A O 2867 C CB . LYS A 368 ? 1.1722 1.0664 0.8333 -0.3311 -0.1196 0.1655 389 LYS A CB 2868 C CG . LYS A 368 ? 1.1961 1.0652 0.8548 -0.3007 -0.1052 0.1632 389 LYS A CG 2869 C CD . LYS A 368 ? 1.2627 1.0869 0.8864 -0.3077 -0.1060 0.1663 389 LYS A CD 2870 C CE . LYS A 368 ? 1.2741 1.0707 0.8901 -0.2753 -0.0934 0.1643 389 LYS A CE 2871 N NZ . LYS A 368 ? 1.2662 1.0222 0.8490 -0.2805 -0.0933 0.1692 389 LYS A NZ 2872 N N . HIS A 369 ? 0.9669 0.9769 0.7352 -0.2726 -0.0959 0.1618 390 HIS A N 2873 C CA . HIS A 369 ? 0.8857 0.9595 0.7093 -0.2462 -0.0850 0.1637 390 HIS A CA 2874 C C . HIS A 369 ? 0.8585 0.9912 0.7225 -0.2419 -0.0863 0.1637 390 HIS A C 2875 O O . HIS A 369 ? 0.8379 1.0354 0.7492 -0.2265 -0.0840 0.1678 390 HIS A O 2876 C CB . HIS A 369 ? 0.8514 0.8972 0.6733 -0.2101 -0.0685 0.1543 390 HIS A CB 2877 C CG . HIS A 369 ? 0.9701 0.9580 0.7505 -0.2079 -0.0677 0.1544 390 HIS A CG 2878 N ND1 . HIS A 369 ? 0.9885 0.9960 0.7773 -0.2100 -0.0676 0.1643 390 HIS A ND1 2879 C CD2 . HIS A 369 ? 1.0643 0.9744 0.7933 -0.2021 -0.0676 0.1456 390 HIS A CD2 2880 C CE1 . HIS A 369 ? 1.0626 1.0065 0.8061 -0.2054 -0.0667 0.1625 390 HIS A CE1 2881 N NE2 . HIS A 369 ? 1.1173 1.0020 0.8248 -0.2004 -0.0676 0.1508 390 HIS A NE2 2882 N N . GLY A 370 ? 0.9776 1.0870 0.8204 -0.2532 -0.0908 0.1594 391 GLY A N 2883 C CA . GLY A 370 ? 0.9539 1.1144 0.8305 -0.2466 -0.0912 0.1600 391 GLY A CA 2884 C C . GLY A 370 ? 0.9995 1.1336 0.8473 -0.2649 -0.0981 0.1576 391 GLY A C 2885 O O . GLY A 370 ? 1.0813 1.1479 0.8799 -0.2769 -0.0999 0.1520 391 GLY A O 2886 N N . VAL A 371 ? 0.9161 1.1032 0.7918 -0.2651 -0.1032 0.1625 392 VAL A N 2887 C CA . VAL A 371 ? 0.9330 1.1043 0.7880 -0.2792 -0.1078 0.1611 392 VAL A CA 2888 C C . VAL A 371 ? 0.8505 1.0539 0.7396 -0.2510 -0.0943 0.1572 392 VAL A C 2889 O O . VAL A 371 ? 0.7981 1.0577 0.7313 -0.2266 -0.0904 0.1602 392 VAL A O 2890 C CB . VAL A 371 ? 0.9991 1.1973 0.8458 -0.3081 -0.1264 0.1735 392 VAL A CB 2891 C CG1 . VAL A 371 ? 1.0730 1.2351 0.8828 -0.3345 -0.1385 0.1761 392 VAL A CG1 2892 C CG2 . VAL A 371 ? 0.9682 1.2312 0.8566 -0.2918 -0.1205 0.1865 392 VAL A CG2 2893 N N . ILE A 372 ? 0.7808 0.9434 0.6433 -0.2512 -0.0876 0.1508 393 ILE A N 2894 C CA . ILE A 372 ? 0.7326 0.9207 0.6226 -0.2255 -0.0740 0.1470 393 ILE A CA 2895 C C . ILE A 372 ? 0.7573 0.9318 0.6201 -0.2452 -0.0804 0.1506 393 ILE A C 2896 O O . ILE A 372 ? 0.8021 0.9203 0.6118 -0.2699 -0.0895 0.1499 393 ILE A O 2897 C CB . ILE A 372 ? 0.6740 0.8215 0.5608 -0.1906 -0.0517 0.1320 393 ILE A CB 2898 C CG1 . ILE A 372 ? 0.7061 0.7639 0.5253 -0.2010 -0.0523 0.1239 393 ILE A CG1 2899 C CG2 . ILE A 372 ? 0.6460 0.8176 0.5689 -0.1663 -0.0442 0.1282 393 ILE A CG2 2900 C CD1 . ILE A 372 ? 0.7266 0.7391 0.5372 -0.1663 -0.0331 0.1075 393 ILE A CD1 2901 N N . PHE A 373 ? 0.7560 0.9814 0.6536 -0.2324 -0.0769 0.1546 394 PHE A N 2902 C CA . PHE A 373 ? 0.7953 1.0168 0.6719 -0.2489 -0.0822 0.1599 394 PHE A CA 2903 C C . PHE A 373 ? 0.8340 1.0382 0.7085 -0.2185 -0.0617 0.1522 394 PHE A C 2904 O O . PHE A 373 ? 0.7839 1.0192 0.7027 -0.1840 -0.0463 0.1469 394 PHE A O 2905 C CB . PHE A 373 ? 0.7385 1.0344 0.6508 -0.2617 -0.0991 0.1733 394 PHE A CB 2906 C CG . PHE A 373 ? 0.7527 1.0456 0.6456 -0.2906 -0.1134 0.1842 394 PHE A CG 2907 C CD1 . PHE A 373 ? 0.8091 1.0890 0.6720 -0.3231 -0.1262 0.1922 394 PHE A CD1 2908 C CD2 . PHE A 373 ? 0.7450 1.0455 0.6485 -0.2832 -0.1122 0.1865 394 PHE A CD2 2909 C CE1 . PHE A 373 ? 0.8692 1.1437 0.7145 -0.3455 -0.1368 0.2015 394 PHE A CE1 2910 C CE2 . PHE A 373 ? 0.7780 1.0739 0.6634 -0.3074 -0.1233 0.1961 394 PHE A CE2 2911 C CZ . PHE A 373 ? 0.8529 1.1356 0.7097 -0.3375 -0.1352 0.2032 394 PHE A CZ 2912 N N . SER A 374 ? 0.8964 1.0482 0.7162 -0.2290 -0.0630 0.1507 395 SER A N 2913 C CA . SER A 374 ? 0.8278 0.9636 0.6387 -0.2021 -0.0460 0.1448 395 SER A CA 2914 C C . SER A 374 ? 0.8800 1.0180 0.6603 -0.2221 -0.0583 0.1544 395 SER A C 2915 O O . SER A 374 ? 0.9926 1.1109 0.7359 -0.2559 -0.0788 0.1596 395 SER A O 2916 C CB . SER A 374 ? 0.8786 0.9326 0.6416 -0.1845 -0.0331 0.1284 395 SER A CB 2917 O OG . SER A 374 ? 0.9400 0.9297 0.6316 -0.2100 -0.0481 0.1271 395 SER A OG 2918 N N . SER A 375 ? 0.8140 0.9753 0.6100 -0.2000 -0.0459 0.1561 396 SER A N 2919 C CA . SER A 375 ? 0.8378 1.0053 0.6052 -0.2152 -0.0577 0.1658 396 SER A CA 2920 C C . SER A 375 ? 0.8291 0.9651 0.5684 -0.1866 -0.0405 0.1600 396 SER A C 2921 O O . SER A 375 ? 0.7707 0.9106 0.5418 -0.1517 -0.0161 0.1522 396 SER A O 2922 C CB . SER A 375 ? 0.8384 1.0926 0.6650 -0.2265 -0.0670 0.1812 396 SER A CB 2923 O OG . SER A 375 ? 0.8567 1.1596 0.7395 -0.1925 -0.0484 0.1819 396 SER A OG 2924 N N . ALA A 376 ? 0.8554 0.9594 0.5355 -0.2009 -0.0539 0.1626 397 ALA A N 2925 C CA . ALA A 376 ? 0.8245 0.8990 0.4720 -0.1757 -0.0395 0.1587 397 ALA A CA 2926 C C . ALA A 376 ? 0.9095 0.9927 0.5193 -0.1934 -0.0599 0.1687 397 ALA A C 2927 O O . ALA A 376 ? 0.8959 0.9818 0.4856 -0.2277 -0.0867 0.1730 397 ALA A O 2928 C CB . ALA A 376 ? 0.7098 0.6965 0.2995 -0.1639 -0.0287 0.1411 397 ALA A CB 2929 N N . GLU A 377 ? 0.9836 1.0710 0.5859 -0.1689 -0.0466 0.1717 398 GLU A N 2930 C CA . GLU A 377 ? 0.9848 1.0768 0.5463 -0.1806 -0.0653 0.1800 398 GLU A CA 2931 C C . GLU A 377 ? 1.0840 1.0930 0.5568 -0.1805 -0.0700 0.1677 398 GLU A C 2932 O O . GLU A 377 ? 1.0242 0.9784 0.4742 -0.1584 -0.0480 0.1552 398 GLU A O 2933 C CB . GLU A 377 ? 0.9144 1.0589 0.5137 -0.1547 -0.0503 0.1919 398 GLU A CB 2934 C CG . GLU A 377 ? 1.0337 1.1967 0.6005 -0.1679 -0.0732 0.2027 398 GLU A CG 2935 C CD . GLU A 377 ? 1.0961 1.3103 0.7000 -0.1413 -0.0579 0.2158 398 GLU A CD 2936 O OE1 . GLU A 377 ? 1.2407 1.4675 0.8157 -0.1465 -0.0744 0.2244 398 GLU A OE1 2937 O OE2 . GLU A 377 ? 1.0529 1.2952 0.7166 -0.1143 -0.0297 0.2165 398 GLU A OE2 2938 N N . LEU A 378 ? 1.1962 1.1968 0.6225 -0.2058 -0.0988 0.1697 399 LEU A N 2939 C CA . LEU A 378 ? 1.2258 1.1565 0.5683 -0.2056 -0.1056 0.1586 399 LEU A CA 2940 C C . LEU A 378 ? 1.2465 1.2000 0.5650 -0.1995 -0.1159 0.1678 399 LEU A C 2941 O O . LEU A 378 ? 1.2826 1.2746 0.6071 -0.2237 -0.1434 0.1748 399 LEU A O 2942 C CB . LEU A 378 ? 1.2202 1.1127 0.5230 -0.2418 -0.1327 0.1483 399 LEU A CB 2943 C CG . LEU A 378 ? 1.2748 1.1020 0.4934 -0.2458 -0.1443 0.1359 399 LEU A CG 2944 C CD1 . LEU A 378 ? 1.3333 1.0974 0.5174 -0.2159 -0.1152 0.1245 399 LEU A CD1 2945 C CD2 . LEU A 378 ? 1.2842 1.0796 0.4744 -0.2828 -0.1703 0.1252 399 LEU A CD2 2946 N N . SER A 379 ? 1.2708 1.2004 0.5645 -0.1664 -0.0929 0.1676 400 SER A N 2947 C CA . SER A 379 ? 1.3676 1.3115 0.6298 -0.1564 -0.1009 0.1765 400 SER A CA 2948 C C . SER A 379 ? 1.3700 1.2379 0.5391 -0.1545 -0.1069 0.1634 400 SER A C 2949 O O . SER A 379 ? 1.3196 1.1237 0.4574 -0.1422 -0.0869 0.1500 400 SER A O 2950 C CB . SER A 379 ? 1.4092 1.3889 0.7148 -0.1190 -0.0696 0.1886 400 SER A CB 2951 O OG . SER A 379 ? 1.4625 1.3993 0.7738 -0.0912 -0.0336 0.1787 400 SER A OG 2952 N N . VAL A 380 ? 1.4259 1.3013 0.5530 -0.1672 -0.1349 0.1661 401 VAL A N 2953 C CA . VAL A 380 ? 1.5735 1.3817 0.6113 -0.1664 -0.1435 0.1531 401 VAL A CA 2954 C C . VAL A 380 ? 1.5880 1.3992 0.5895 -0.1378 -0.1363 0.1627 401 VAL A C 2955 O O . VAL A 380 ? 1.5181 1.3896 0.5461 -0.1361 -0.1488 0.1777 401 VAL A O 2956 C CB . VAL A 380 ? 1.6795 1.4795 0.6872 -0.2055 -0.1833 0.1425 401 VAL A CB 2957 C CG1 . VAL A 380 ? 1.6121 1.4237 0.6691 -0.2337 -0.1898 0.1383 401 VAL A CG1 2958 C CG2 . VAL A 380 ? 1.7178 1.5739 0.7318 -0.2152 -0.2118 0.1529 401 VAL A CG2 2959 N N . ILE A 381 ? 1.6577 1.4016 0.5987 -0.1151 -0.1148 0.1536 402 ILE A N 2960 C CA . ILE A 381 ? 1.6945 1.4321 0.6007 -0.0822 -0.0989 0.1631 402 ILE A CA 2961 C C . ILE A 381 ? 1.7690 1.4977 0.6038 -0.0913 -0.1315 0.1616 402 ILE A C 2962 O O . ILE A 381 ? 1.7994 1.4829 0.5787 -0.1129 -0.1528 0.1444 402 ILE A O 2963 C CB . ILE A 381 ? 1.7410 1.4069 0.6146 -0.0522 -0.0580 0.1535 402 ILE A CB 2964 C CG1 . ILE A 381 ? 1.7608 1.4219 0.6975 -0.0500 -0.0322 0.1468 402 ILE A CG1 2965 C CG2 . ILE A 381 ? 1.6748 1.3464 0.5402 -0.0128 -0.0308 0.1675 402 ILE A CG2 2966 C CD1 . ILE A 381 ? 1.8113 1.4061 0.7314 -0.0198 0.0102 0.1352 402 ILE A CD1 2967 N N . ALA A 382 ? 1.7971 1.5706 0.6363 -0.0740 -0.1353 0.1786 403 ALA A N 2968 C CA . ALA A 382 ? 1.8242 1.5932 0.5968 -0.0767 -0.1652 0.1781 403 ALA A CA 2969 C C . ALA A 382 ? 1.9080 1.5920 0.5859 -0.0626 -0.1542 0.1639 403 ALA A C 2970 O O . ALA A 382 ? 2.0182 1.6757 0.6335 -0.0791 -0.1839 0.1509 403 ALA A O 2971 C CB . ALA A 382 ? 1.7503 1.5767 0.5448 -0.0533 -0.1634 0.2003 403 ALA A CB 2972 N N . PRO B 1 ? 1.1939 1.6617 1.4036 0.0496 -0.0997 -0.0180 22 PRO B N 2973 C CA . PRO B 1 ? 1.2033 1.6607 1.3879 0.0409 -0.1022 -0.0265 22 PRO B CA 2974 C C . PRO B 1 ? 1.1866 1.5971 1.3739 0.0438 -0.1084 -0.0360 22 PRO B C 2975 O O . PRO B 1 ? 1.1941 1.5846 1.3615 0.0338 -0.1118 -0.0386 22 PRO B O 2976 C CB . PRO B 1 ? 1.2183 1.7086 1.4010 0.0526 -0.0959 -0.0384 22 PRO B CB 2977 C CG . PRO B 1 ? 1.1970 1.7192 1.4020 0.0666 -0.0894 -0.0338 22 PRO B CG 2978 C CD . PRO B 1 ? 1.1793 1.6738 1.4041 0.0693 -0.0923 -0.0263 22 PRO B CD 2979 N N . GLY B 2 ? 1.0972 1.4906 1.3087 0.0577 -0.1089 -0.0409 23 GLY B N 2980 C CA . GLY B 2 ? 1.0041 1.3553 1.2215 0.0601 -0.1148 -0.0494 23 GLY B CA 2981 C C . GLY B 2 ? 0.8832 1.2067 1.1049 0.0502 -0.1206 -0.0367 23 GLY B C 2982 O O . GLY B 2 ? 0.8107 1.1417 1.0427 0.0487 -0.1190 -0.0233 23 GLY B O 2983 N N . SER B 3 ? 0.7823 1.0741 0.9957 0.0439 -0.1269 -0.0402 24 SER B N 2984 C CA . SER B 3 ? 0.6983 0.9615 0.9141 0.0356 -0.1321 -0.0283 24 SER B CA 2985 C C . SER B 3 ? 0.6578 0.8865 0.8859 0.0402 -0.1381 -0.0378 24 SER B C 2986 O O . SER B 3 ? 0.6955 0.9169 0.9153 0.0418 -0.1401 -0.0510 24 SER B O 2987 C CB . SER B 3 ? 0.7815 1.0419 0.9680 0.0200 -0.1328 -0.0184 24 SER B CB 2988 O OG . SER B 3 ? 0.9237 1.2158 1.0977 0.0134 -0.1270 -0.0094 24 SER B OG 2989 N N . GLY B 4 ? 0.5193 0.7272 0.7669 0.0418 -0.1407 -0.0308 25 GLY B N 2990 C CA . GLY B 4 ? 0.4867 0.6627 0.7467 0.0441 -0.1466 -0.0379 25 GLY B CA 2991 C C . GLY B 4 ? 0.6013 0.7608 0.8418 0.0344 -0.1523 -0.0367 25 GLY B C 2992 O O . GLY B 4 ? 0.6126 0.7819 0.8286 0.0259 -0.1507 -0.0298 25 GLY B O 2993 N N . PRO B 5 ? 0.6075 0.7414 0.8583 0.0357 -0.1583 -0.0430 26 PRO B N 2994 C CA . PRO B 5 ? 0.6732 0.7915 0.9074 0.0290 -0.1635 -0.0429 26 PRO B CA 2995 C C . PRO B 5 ? 0.7035 0.8121 0.9243 0.0195 -0.1646 -0.0243 26 PRO B C 2996 O O . PRO B 5 ? 0.6863 0.7876 0.9197 0.0184 -0.1644 -0.0125 26 PRO B O 2997 C CB . PRO B 5 ? 0.6724 0.7681 0.9274 0.0333 -0.1695 -0.0520 26 PRO B CB 2998 C CG . PRO B 5 ? 0.7037 0.8034 0.9809 0.0425 -0.1659 -0.0616 26 PRO B CG 2999 C CD . PRO B 5 ? 0.6135 0.7321 0.8920 0.0437 -0.1595 -0.0506 26 PRO B CD 3000 N N . VAL B 6 ? 0.6129 0.7197 0.8071 0.0128 -0.1645 -0.0215 27 VAL B N 3001 C CA . VAL B 6 ? 0.6099 0.7021 0.7871 0.0039 -0.1646 -0.0049 27 VAL B CA 3002 C C . VAL B 6 ? 0.7081 0.7875 0.8684 0.0016 -0.1675 -0.0080 27 VAL B C 3003 O O . VAL B 6 ? 0.7327 0.8227 0.8769 0.0017 -0.1649 -0.0167 27 VAL B O 3004 C CB . VAL B 6 ? 0.5941 0.7012 0.7482 -0.0041 -0.1568 0.0067 27 VAL B CB 3005 C CG1 . VAL B 6 ? 0.6783 0.7656 0.8105 -0.0139 -0.1552 0.0225 27 VAL B CG1 3006 C CG2 . VAL B 6 ? 0.4625 0.5841 0.6328 -0.0021 -0.1539 0.0120 27 VAL B CG2 3007 N N . PHE B 7 ? 0.6913 0.7487 0.8558 -0.0001 -0.1725 -0.0008 28 PHE B N 3008 C CA . PHE B 7 ? 0.6884 0.7347 0.8386 -0.0016 -0.1755 -0.0024 28 PHE B CA 3009 C C . PHE B 7 ? 0.7882 0.8346 0.9048 -0.0094 -0.1683 0.0071 28 PHE B C 3010 O O . PHE B 7 ? 0.8024 0.8418 0.9080 -0.0163 -0.1634 0.0218 28 PHE B O 3011 C CB . PHE B 7 ? 0.6496 0.6753 0.8139 -0.0016 -0.1823 0.0039 28 PHE B CB 3012 C CG . PHE B 7 ? 0.6561 0.6796 0.8517 0.0053 -0.1894 -0.0077 28 PHE B CG 3013 C CD1 . PHE B 7 ? 0.6279 0.6434 0.8494 0.0068 -0.1913 -0.0031 28 PHE B CD1 3014 C CD2 . PHE B 7 ? 0.6993 0.7276 0.8980 0.0097 -0.1930 -0.0233 28 PHE B CD2 3015 C CE1 . PHE B 7 ? 0.6424 0.6542 0.8924 0.0124 -0.1964 -0.0141 28 PHE B CE1 3016 C CE2 . PHE B 7 ? 0.6509 0.6752 0.8768 0.0149 -0.1983 -0.0343 28 PHE B CE2 3017 C CZ . PHE B 7 ? 0.6241 0.6400 0.8757 0.0162 -0.1998 -0.0298 28 PHE B CZ 3018 N N . VAL B 8 ? 0.8819 0.9349 0.9827 -0.0087 -0.1665 -0.0015 29 VAL B N 3019 C CA . VAL B 8 ? 0.9306 0.9807 1.0011 -0.0157 -0.1588 0.0062 29 VAL B CA 3020 C C . VAL B 8 ? 1.0365 1.0666 1.1014 -0.0165 -0.1624 0.0111 29 VAL B C 3021 O O . VAL B 8 ? 1.1016 1.1182 1.1499 -0.0235 -0.1570 0.0239 29 VAL B O 3022 C CB . VAL B 8 ? 0.9170 0.9842 0.9745 -0.0143 -0.1540 -0.0051 29 VAL B CB 3023 C CG1 . VAL B 8 ? 0.8968 0.9577 0.9265 -0.0211 -0.1459 0.0023 29 VAL B CG1 3024 C CG2 . VAL B 8 ? 0.8880 0.9779 0.9484 -0.0144 -0.1491 -0.0089 29 VAL B CG2 3025 N N . GLN B 9 ? 1.0732 1.1019 1.1525 -0.0099 -0.1710 0.0004 30 GLN B N 3026 C CA . GLN B 9 ? 1.0140 1.0276 1.0919 -0.0098 -0.1760 0.0041 30 GLN B CA 3027 C C . GLN B 9 ? 0.9151 0.9258 1.0228 -0.0042 -0.1872 -0.0025 30 GLN B C 3028 O O . GLN B 9 ? 0.8975 0.9177 1.0205 0.0011 -0.1911 -0.0164 30 GLN B O 3029 C CB . GLN B 9 ? 1.0638 1.0804 1.1234 -0.0090 -0.1738 -0.0020 30 GLN B CB 3030 C CG . GLN B 9 ? 1.1431 1.1460 1.1958 -0.0101 -0.1765 0.0044 30 GLN B CG 3031 C CD . GLN B 9 ? 1.2466 1.2552 1.2952 -0.0058 -0.1801 -0.0062 30 GLN B CD 3032 O OE1 . GLN B 9 ? 1.3038 1.3060 1.3525 -0.0048 -0.1850 -0.0043 30 GLN B OE1 3033 N NE2 . GLN B 9 ? 1.2533 1.2753 1.2987 -0.0033 -0.1774 -0.0175 30 GLN B NE2 3034 N N . GLU B 10 ? 0.8903 0.8871 1.0063 -0.0060 -0.1911 0.0075 31 GLU B N 3035 C CA . GLU B 10 ? 0.9029 0.8968 1.0493 -0.0019 -0.2009 0.0033 31 GLU B CA 3036 C C . GLU B 10 ? 0.9718 0.9635 1.1193 -0.0005 -0.2079 0.0004 31 GLU B C 3037 O O . GLU B 10 ? 0.9831 0.9723 1.1074 -0.0027 -0.2049 0.0046 31 GLU B O 3038 C CB . GLU B 10 ? 0.9243 0.9066 1.0845 -0.0048 -0.2008 0.0159 31 GLU B CB 3039 C CG . GLU B 10 ? 0.9568 0.9440 1.1272 -0.0046 -0.1966 0.0165 31 GLU B CG 3040 C CD . GLU B 10 ? 0.9921 0.9677 1.1818 -0.0066 -0.1974 0.0272 31 GLU B CD 3041 O OE1 . GLU B 10 ? 1.0215 0.9859 1.2175 -0.0085 -0.2011 0.0339 31 GLU B OE1 3042 O OE2 . GLU B 10 ? 1.0437 1.0229 1.2430 -0.0063 -0.1937 0.0288 31 GLU B OE2 3043 N N . PRO B 11 ? 0.9610 0.9543 1.1362 0.0031 -0.2168 -0.0072 32 PRO B N 3044 C CA . PRO B 11 ? 0.9435 0.9386 1.1238 0.0042 -0.2247 -0.0103 32 PRO B CA 3045 C C . PRO B 11 ? 0.9752 0.9613 1.1464 0.0008 -0.2250 0.0046 32 PRO B C 3046 O O . PRO B 11 ? 0.8813 0.8581 1.0630 -0.0014 -0.2243 0.0153 32 PRO B O 3047 C CB . PRO B 11 ? 0.9170 0.9132 1.1323 0.0069 -0.2321 -0.0180 32 PRO B CB 3048 C CG . PRO B 11 ? 0.9330 0.9312 1.1565 0.0091 -0.2273 -0.0256 32 PRO B CG 3049 C CD . PRO B 11 ? 0.9058 0.9008 1.1094 0.0062 -0.2189 -0.0142 32 PRO B CD 3050 N N . SER B 12 ? 1.0365 1.0254 1.1884 0.0005 -0.2252 0.0049 33 SER B N 3051 C CA . SER B 12 ? 1.0322 1.0140 1.1731 -0.0020 -0.2243 0.0175 33 SER B CA 3052 C C . SER B 12 ? 1.0468 1.0378 1.2029 0.0006 -0.2349 0.0143 33 SER B C 3053 O O . SER B 12 ? 0.9693 0.9720 1.1308 0.0031 -0.2405 0.0018 33 SER B O 3054 C CB . SER B 12 ? 1.0715 1.0495 1.1772 -0.0042 -0.2144 0.0208 33 SER B CB 3055 O OG . SER B 12 ? 1.0910 1.0663 1.1833 -0.0066 -0.2053 0.0204 33 SER B OG 3056 N N . HIS B 13 ? 1.1114 1.0985 1.2745 -0.0005 -0.2371 0.0256 34 HIS B N 3057 C CA . HIS B 13 ? 1.1241 1.1230 1.3018 0.0018 -0.2470 0.0249 34 HIS B CA 3058 C C . HIS B 13 ? 1.1571 1.1661 1.3139 0.0035 -0.2476 0.0185 34 HIS B C 3059 O O . HIS B 13 ? 1.1988 1.2013 1.3262 0.0026 -0.2385 0.0223 34 HIS B O 3060 C CB . HIS B 13 ? 1.1774 1.1709 1.3579 0.0005 -0.2459 0.0401 34 HIS B CB 3061 C CG . HIS B 13 ? 1.2732 1.2554 1.4724 -0.0018 -0.2437 0.0477 34 HIS B CG 3062 N ND1 . HIS B 13 ? 1.2940 1.2805 1.5277 -0.0006 -0.2515 0.0490 34 HIS B ND1 3063 C CD2 . HIS B 13 ? 1.2892 1.2565 1.4778 -0.0061 -0.2339 0.0544 34 HIS B CD2 3064 C CE1 . HIS B 13 ? 1.2617 1.2355 1.5053 -0.0033 -0.2464 0.0562 34 HIS B CE1 3065 N NE2 . HIS B 13 ? 1.2757 1.2386 1.4922 -0.0070 -0.2361 0.0595 34 HIS B NE2 3066 N N . VAL B 14 ? 1.1334 1.1580 1.3060 0.0052 -0.2577 0.0086 35 VAL B N 3067 C CA . VAL B 14 ? 1.1106 1.1466 1.2661 0.0066 -0.2592 0.0015 35 VAL B CA 3068 C C . VAL B 14 ? 1.1341 1.1873 1.3046 0.0076 -0.2699 0.0026 35 VAL B C 3069 O O . VAL B 14 ? 1.0961 1.1578 1.2962 0.0065 -0.2788 -0.0011 35 VAL B O 3070 C CB . VAL B 14 ? 1.0629 1.1044 1.2190 0.0068 -0.2598 -0.0150 35 VAL B CB 3071 C CG1 . VAL B 14 ? 1.1272 1.1800 1.2665 0.0080 -0.2613 -0.0218 35 VAL B CG1 3072 C CG2 . VAL B 14 ? 1.0314 1.0604 1.1734 0.0065 -0.2494 -0.0161 35 VAL B CG2 3073 N N . MET B 15 ? 1.1783 1.2374 1.3286 0.0096 -0.2684 0.0076 36 MET B N 3074 C CA . MET B 15 ? 1.1622 1.2426 1.3245 0.0109 -0.2788 0.0074 36 MET B CA 3075 C C . MET B 15 ? 1.1738 1.2659 1.3204 0.0117 -0.2802 -0.0039 36 MET B C 3076 O O . MET B 15 ? 1.2623 1.3485 1.3804 0.0139 -0.2716 -0.0022 36 MET B O 3077 C CB . MET B 15 ? 1.1644 1.2465 1.3208 0.0139 -0.2768 0.0231 36 MET B CB 3078 C CG . MET B 15 ? 1.2217 1.3293 1.4000 0.0153 -0.2892 0.0252 36 MET B CG 3079 S SD . MET B 15 ? 1.9697 2.0796 2.1538 0.0194 -0.2875 0.0452 36 MET B SD 3080 C CE . MET B 15 ? 1.2305 1.3163 1.4310 0.0159 -0.2824 0.0510 36 MET B CE 3081 N N . PHE B 16 ? 1.0957 1.2032 1.2616 0.0092 -0.2901 -0.0158 37 PHE B N 3082 C CA . PHE B 16 ? 1.1244 1.2416 1.2780 0.0087 -0.2913 -0.0283 37 PHE B CA 3083 C C . PHE B 16 ? 1.1504 1.2925 1.3083 0.0089 -0.3009 -0.0280 37 PHE B C 3084 O O . PHE B 16 ? 1.0437 1.2009 1.2271 0.0066 -0.3108 -0.0256 37 PHE B O 3085 C CB . PHE B 16 ? 1.1369 1.2521 1.3050 0.0049 -0.2933 -0.0434 37 PHE B CB 3086 C CG . PHE B 16 ? 1.2651 1.3892 1.4222 0.0038 -0.2941 -0.0566 37 PHE B CG 3087 C CD1 . PHE B 16 ? 1.3106 1.4240 1.4433 0.0063 -0.2841 -0.0612 37 PHE B CD1 3088 C CD2 . PHE B 16 ? 1.2994 1.4428 1.4710 -0.0001 -0.3044 -0.0641 37 PHE B CD2 3089 C CE1 . PHE B 16 ? 1.3473 1.4680 1.4704 0.0057 -0.2841 -0.0727 37 PHE B CE1 3090 C CE2 . PHE B 16 ? 1.3358 1.4860 1.4964 -0.0015 -0.3045 -0.0758 37 PHE B CE2 3091 C CZ . PHE B 16 ? 1.3624 1.5007 1.4988 0.0019 -0.2942 -0.0800 37 PHE B CZ 3092 N N . PRO B 17 ? 1.1943 1.3416 1.3278 0.0117 -0.2976 -0.0302 38 PRO B N 3093 C CA . PRO B 17 ? 1.2088 1.3811 1.3421 0.0128 -0.3056 -0.0302 38 PRO B CA 3094 C C . PRO B 17 ? 1.3109 1.5012 1.4639 0.0064 -0.3165 -0.0438 38 PRO B C 3095 O O . PRO B 17 ? 1.3292 1.5146 1.4733 0.0042 -0.3137 -0.0563 38 PRO B O 3096 C CB . PRO B 17 ? 1.2102 1.3767 1.3109 0.0174 -0.2962 -0.0316 38 PRO B CB 3097 C CG . PRO B 17 ? 1.2253 1.3642 1.3093 0.0190 -0.2826 -0.0276 38 PRO B CG 3098 C CD . PRO B 17 ? 1.2372 1.3669 1.3417 0.0144 -0.2848 -0.0321 38 PRO B CD 3099 N N . LEU B 18 ? 1.4047 1.6154 1.5837 0.0030 -0.3278 -0.0412 39 LEU B N 3100 C CA . LEU B 18 ? 1.4948 1.7220 1.6938 -0.0052 -0.3375 -0.0539 39 LEU B CA 3101 C C . LEU B 18 ? 1.5828 1.8252 1.7652 -0.0059 -0.3397 -0.0622 39 LEU B C 3102 O O . LEU B 18 ? 1.6094 1.8533 1.7948 -0.0122 -0.3415 -0.0760 39 LEU B O 3103 C CB . LEU B 18 ? 1.4877 1.7371 1.7176 -0.0090 -0.3487 -0.0476 39 LEU B CB 3104 C CG . LEU B 18 ? 1.4745 1.7204 1.7337 -0.0174 -0.3528 -0.0566 39 LEU B CG 3105 C CD1 . LEU B 18 ? 1.4575 1.7315 1.7465 -0.0226 -0.3646 -0.0519 39 LEU B CD1 3106 C CD2 . LEU B 18 ? 1.5015 1.7408 1.7546 -0.0234 -0.3510 -0.0746 39 LEU B CD2 3107 N N . ASP B 19 ? 1.6328 1.8855 1.7969 0.0007 -0.3384 -0.0536 40 ASP B N 3108 C CA . ASP B 19 ? 1.7141 1.9802 1.8604 0.0015 -0.3393 -0.0602 40 ASP B CA 3109 C C . ASP B 19 ? 1.7329 1.9756 1.8481 0.0078 -0.3256 -0.0615 40 ASP B C 3110 O O . ASP B 19 ? 1.7253 1.9717 1.8200 0.0147 -0.3211 -0.0558 40 ASP B O 3111 C CB . ASP B 19 ? 1.7577 2.0539 1.9046 0.0055 -0.3467 -0.0506 40 ASP B CB 3112 C CG . ASP B 19 ? 1.7726 2.0999 1.9495 -0.0027 -0.3615 -0.0527 40 ASP B CG 3113 O OD1 . ASP B 19 ? 1.7641 2.0988 1.9484 -0.0118 -0.3666 -0.0662 40 ASP B OD1 3114 O OD2 . ASP B 19 ? 1.7808 2.1251 1.9737 -0.0002 -0.3671 -0.0405 40 ASP B OD2 3115 N N . SER B 20 ? 1.7700 1.9894 1.8825 0.0056 -0.3183 -0.0692 41 SER B N 3116 C CA . SER B 20 ? 1.8295 2.0270 1.9158 0.0108 -0.3047 -0.0700 41 SER B CA 3117 C C . SER B 20 ? 1.8759 2.0730 1.9527 0.0087 -0.3023 -0.0835 41 SER B C 3118 O O . SER B 20 ? 1.8015 2.0126 1.8913 0.0025 -0.3107 -0.0929 41 SER B O 3119 C CB . SER B 20 ? 1.8415 2.0145 1.9299 0.0109 -0.2967 -0.0670 41 SER B CB 3120 O OG . SER B 20 ? 1.8757 2.0303 1.9422 0.0140 -0.2839 -0.0696 41 SER B OG 3121 N N . GLU B 21 ? 1.9753 2.1561 2.0297 0.0134 -0.2902 -0.0841 42 GLU B N 3122 C CA . GLU B 21 ? 2.0679 2.2449 2.1128 0.0126 -0.2857 -0.0957 42 GLU B CA 3123 C C . GLU B 21 ? 2.0653 2.2266 2.1180 0.0098 -0.2810 -0.1027 42 GLU B C 3124 O O . GLU B 21 ? 2.0752 2.2366 2.1297 0.0070 -0.2807 -0.1137 42 GLU B O 3125 C CB . GLU B 21 ? 2.1264 2.2940 2.1455 0.0193 -0.2740 -0.0925 42 GLU B CB 3126 C CG . GLU B 21 ? 2.1925 2.3762 2.2013 0.0231 -0.2772 -0.0892 42 GLU B CG 3127 C CD . GLU B 21 ? 2.2179 2.4131 2.2003 0.0263 -0.2888 -0.0918 42 GLU B CD 3128 O OE1 . GLU B 21 ? 2.2016 2.3851 2.1723 0.0266 -0.2873 -0.0910 42 GLU B OE1 3129 O OE2 . GLU B 21 ? 2.2391 2.4551 2.2107 0.0284 -0.3000 -0.0945 42 GLU B OE2 3130 N N . GLU B 22 ? 2.0443 2.1922 2.1011 0.0109 -0.2767 -0.0962 43 GLU B N 3131 C CA . GLU B 22 ? 2.0253 2.1590 2.0885 0.0097 -0.2711 -0.1019 43 GLU B CA 3132 C C . GLU B 22 ? 1.9693 2.1070 2.0581 0.0043 -0.2797 -0.1080 43 GLU B C 3133 O O . GLU B 22 ? 1.9199 2.0641 2.0250 0.0020 -0.2877 -0.1022 43 GLU B O 3134 C CB . GLU B 22 ? 2.0412 2.1588 2.0961 0.0130 -0.2617 -0.0926 43 GLU B CB 3135 C CG . GLU B 22 ? 2.0912 2.1984 2.1251 0.0166 -0.2486 -0.0937 43 GLU B CG 3136 C CD . GLU B 22 ? 2.1623 2.2766 2.1809 0.0188 -0.2470 -0.0966 43 GLU B CD 3137 O OE1 . GLU B 22 ? 2.1905 2.3140 2.2054 0.0198 -0.2520 -0.0917 43 GLU B OE1 3138 O OE2 . GLU B 22 ? 2.1779 2.2932 2.1881 0.0190 -0.2450 -0.1048 43 GLU B OE2 3139 N N . LYS B 23 ? 1.9716 2.1047 2.0640 0.0026 -0.2769 -0.1195 44 LYS B N 3140 C CA . LYS B 23 ? 1.9327 2.0665 2.0474 -0.0025 -0.2823 -0.1270 44 LYS B CA 3141 C C . LYS B 23 ? 1.7867 1.9070 1.9130 -0.0008 -0.2784 -0.1241 44 LYS B C 3142 O O . LYS B 23 ? 1.7414 1.8601 1.8880 -0.0042 -0.2822 -0.1285 44 LYS B O 3143 C CB . LYS B 23 ? 2.0075 2.1386 2.1186 -0.0038 -0.2783 -0.1397 44 LYS B CB 3144 C CG . LYS B 23 ? 2.0156 2.1316 2.1167 0.0017 -0.2657 -0.1431 44 LYS B CG 3145 C CD . LYS B 23 ? 2.0088 2.1225 2.0873 0.0069 -0.2579 -0.1372 44 LYS B CD 3146 C CE . LYS B 23 ? 1.9864 2.0888 2.0570 0.0116 -0.2458 -0.1400 44 LYS B CE 3147 N NZ . LYS B 23 ? 1.9832 2.0838 2.0327 0.0157 -0.2374 -0.1343 44 LYS B NZ 3148 N N . LYS B 24 ? 1.7186 1.8292 1.8319 0.0040 -0.2704 -0.1166 45 LYS B N 3149 C CA . LYS B 24 ? 1.6870 1.7852 1.8088 0.0057 -0.2655 -0.1145 45 LYS B CA 3150 C C . LYS B 24 ? 1.5812 1.6742 1.6993 0.0073 -0.2641 -0.1004 45 LYS B C 3151 O O . LYS B 24 ? 1.6083 1.7024 1.7083 0.0092 -0.2614 -0.0923 45 LYS B O 3152 C CB . LYS B 24 ? 1.7612 1.8509 1.8714 0.0093 -0.2543 -0.1213 45 LYS B CB 3153 C CG . LYS B 24 ? 1.8272 1.9161 1.9121 0.0127 -0.2461 -0.1170 45 LYS B CG 3154 C CD . LYS B 24 ? 1.8696 1.9520 1.9463 0.0161 -0.2349 -0.1217 45 LYS B CD 3155 C CE . LYS B 24 ? 1.9111 1.9927 1.9645 0.0187 -0.2260 -0.1162 45 LYS B CE 3156 N NZ . LYS B 24 ? 1.9211 1.9991 1.9681 0.0214 -0.2150 -0.1190 45 LYS B NZ 3157 N N . VAL B 25 ? 1.4388 1.5250 1.5741 0.0068 -0.2650 -0.0973 46 VAL B N 3158 C CA . VAL B 25 ? 1.3364 1.4144 1.4685 0.0082 -0.2617 -0.0842 46 VAL B CA 3159 C C . VAL B 25 ? 1.2042 1.2714 1.3384 0.0098 -0.2538 -0.0866 46 VAL B C 3160 O O . VAL B 25 ? 1.1325 1.1990 1.2785 0.0102 -0.2533 -0.0977 46 VAL B O 3161 C CB . VAL B 25 ? 1.3282 1.4093 1.4814 0.0059 -0.2707 -0.0758 46 VAL B CB 3162 C CG1 . VAL B 25 ? 1.2839 1.3650 1.4655 0.0034 -0.2758 -0.0842 46 VAL B CG1 3163 C CG2 . VAL B 25 ? 1.3234 1.3939 1.4713 0.0072 -0.2660 -0.0612 46 VAL B CG2 3164 N N . LYS B 26 ? 1.1678 1.2270 1.2898 0.0110 -0.2468 -0.0762 47 LYS B N 3165 C CA . LYS B 26 ? 1.0828 1.1347 1.2060 0.0122 -0.2393 -0.0774 47 LYS B CA 3166 C C . LYS B 26 ? 1.0559 1.0998 1.1902 0.0110 -0.2398 -0.0660 47 LYS B C 3167 O O . LYS B 26 ? 1.0283 1.0679 1.1532 0.0098 -0.2391 -0.0530 47 LYS B O 3168 C CB . LYS B 26 ? 1.0821 1.1329 1.1792 0.0136 -0.2283 -0.0763 47 LYS B CB 3169 C CG . LYS B 26 ? 1.1600 1.2070 1.2570 0.0143 -0.2204 -0.0761 47 LYS B CG 3170 C CD . LYS B 26 ? 1.2678 1.3141 1.3392 0.0139 -0.2093 -0.0704 47 LYS B CD 3171 C CE . LYS B 26 ? 1.3305 1.3838 1.3889 0.0160 -0.2049 -0.0796 47 LYS B CE 3172 N NZ . LYS B 26 ? 1.3336 1.3870 1.3698 0.0150 -0.1932 -0.0741 47 LYS B NZ 3173 N N . LEU B 27 ? 1.0255 1.0662 1.1793 0.0118 -0.2401 -0.0707 48 LEU B N 3174 C CA . LEU B 27 ? 0.9812 1.0138 1.1454 0.0110 -0.2388 -0.0605 48 LEU B CA 3175 C C . LEU B 27 ? 1.0000 1.0304 1.1533 0.0121 -0.2290 -0.0610 48 LEU B C 3176 O O . LEU B 27 ? 1.0163 1.0499 1.1762 0.0146 -0.2263 -0.0725 48 LEU B O 3177 C CB . LEU B 27 ? 0.9782 1.0091 1.1747 0.0111 -0.2458 -0.0645 48 LEU B CB 3178 C CG . LEU B 27 ? 0.9959 1.0306 1.2062 0.0088 -0.2557 -0.0603 48 LEU B CG 3179 C CD1 . LEU B 27 ? 0.9932 1.0299 1.2321 0.0083 -0.2617 -0.0708 48 LEU B CD1 3180 C CD2 . LEU B 27 ? 0.9570 0.9852 1.1699 0.0075 -0.2565 -0.0433 48 LEU B CD2 3181 N N . SER B 28 ? 0.9611 0.9864 1.0969 0.0100 -0.2229 -0.0483 49 SER B N 3182 C CA . SER B 28 ? 1.0067 1.0332 1.1281 0.0097 -0.2130 -0.0474 49 SER B CA 3183 C C . SER B 28 ? 0.9407 0.9641 1.0785 0.0097 -0.2116 -0.0444 49 SER B C 3184 O O . SER B 28 ? 0.9228 0.9382 1.0742 0.0082 -0.2154 -0.0352 49 SER B O 3185 C CB . SER B 28 ? 1.1203 1.1424 1.2133 0.0063 -0.2053 -0.0355 49 SER B CB 3186 O OG . SER B 28 ? 1.2116 1.2373 1.2888 0.0072 -0.2046 -0.0394 49 SER B OG 3187 N N . CYS B 29 ? 0.8923 0.9230 1.0291 0.0114 -0.2059 -0.0520 50 CYS B N 3188 C CA . CYS B 29 ? 0.9930 1.0238 1.1443 0.0119 -0.2036 -0.0500 50 CYS B CA 3189 C C . CYS B 29 ? 1.0866 1.1294 1.2263 0.0130 -0.1950 -0.0559 50 CYS B C 3190 O O . CYS B 29 ? 1.1764 1.2264 1.3235 0.0174 -0.1942 -0.0700 50 CYS B O 3191 C CB . CYS B 29 ? 1.0050 1.0324 1.1873 0.0156 -0.2101 -0.0588 50 CYS B CB 3192 S SG . CYS B 29 ? 1.0939 1.1205 1.2974 0.0172 -0.2070 -0.0568 50 CYS B SG 3193 N N . GLU B 30 ? 1.0312 1.0764 1.1522 0.0086 -0.1879 -0.0449 51 GLU B N 3194 C CA . GLU B 30 ? 1.0301 1.0899 1.1379 0.0082 -0.1792 -0.0487 51 GLU B CA 3195 C C . GLU B 30 ? 0.9660 1.0318 1.0853 0.0078 -0.1766 -0.0447 51 GLU B C 3196 O O . GLU B 30 ? 0.9149 0.9726 1.0363 0.0039 -0.1768 -0.0311 51 GLU B O 3197 C CB . GLU B 30 ? 1.1135 1.1740 1.1919 0.0026 -0.1716 -0.0394 51 GLU B CB 3198 C CG . GLU B 30 ? 1.2267 1.3046 1.2909 0.0018 -0.1624 -0.0444 51 GLU B CG 3199 C CD . GLU B 30 ? 1.3801 1.4571 1.4176 -0.0038 -0.1545 -0.0369 51 GLU B CD 3200 O OE1 . GLU B 30 ? 1.4316 1.5209 1.4562 -0.0081 -0.1454 -0.0338 51 GLU B OE1 3201 O OE2 . GLU B 30 ? 1.4350 1.4997 1.4655 -0.0040 -0.1569 -0.0340 51 GLU B OE2 3202 N N . VAL B 31 ? 0.8948 0.9749 1.0214 0.0121 -0.1736 -0.0561 52 VAL B N 3203 C CA . VAL B 31 ? 0.8012 0.8897 0.9419 0.0131 -0.1715 -0.0538 52 VAL B CA 3204 C C . VAL B 31 ? 0.8610 0.9720 0.9893 0.0127 -0.1630 -0.0567 52 VAL B C 3205 O O . VAL B 31 ? 0.9602 1.0816 1.0833 0.0167 -0.1602 -0.0696 52 VAL B O 3206 C CB . VAL B 31 ? 0.7585 0.8421 0.9288 0.0202 -0.1764 -0.0646 52 VAL B CB 3207 C CG1 . VAL B 31 ? 0.7218 0.8161 0.9063 0.0225 -0.1728 -0.0626 52 VAL B CG1 3208 C CG2 . VAL B 31 ? 0.7604 0.8242 0.9461 0.0194 -0.1843 -0.0593 52 VAL B CG2 3209 N N . LYS B 32 ? 0.6810 0.7998 0.8046 0.0077 -0.1588 -0.0442 53 LYS B N 3210 C CA . LYS B 32 ? 0.7126 0.8567 0.8278 0.0065 -0.1513 -0.0447 53 LYS B CA 3211 C C . LYS B 32 ? 0.7587 0.9135 0.8988 0.0127 -0.1520 -0.0480 53 LYS B C 3212 O O . LYS B 32 ? 0.7605 0.9023 0.9197 0.0142 -0.1564 -0.0422 53 LYS B O 3213 C CB . LYS B 32 ? 0.8190 0.9655 0.9132 -0.0041 -0.1455 -0.0277 53 LYS B CB 3214 C CG . LYS B 32 ? 0.9601 1.1333 1.0511 -0.0071 -0.1389 -0.0237 53 LYS B CG 3215 C CD . LYS B 32 ? 1.0418 1.2096 1.1238 -0.0171 -0.1359 -0.0046 53 LYS B CD 3216 C CE . LYS B 32 ? 1.0504 1.1939 1.1112 -0.0250 -0.1343 0.0054 53 LYS B CE 3217 N NZ . LYS B 32 ? 1.0278 1.1651 1.0754 -0.0361 -0.1287 0.0236 53 LYS B NZ 3218 N N . GLY B 33 ? 0.7026 0.8816 0.8427 0.0171 -0.1470 -0.0569 54 GLY B N 3219 C CA . GLY B 33 ? 0.6502 0.8420 0.8130 0.0248 -0.1462 -0.0602 54 GLY B CA 3220 C C . GLY B 33 ? 0.6891 0.9077 0.8480 0.0311 -0.1401 -0.0718 54 GLY B C 3221 O O . GLY B 33 ? 0.7222 0.9458 0.8635 0.0305 -0.1375 -0.0800 54 GLY B O 3222 N N . ASN B 34 ? 0.6529 0.8893 0.8286 0.0382 -0.1372 -0.0718 55 ASN B N 3223 C CA . ASN B 34 ? 0.7040 0.9669 0.8785 0.0469 -0.1311 -0.0824 55 ASN B CA 3224 C C . ASN B 34 ? 0.6746 0.9390 0.8748 0.0601 -0.1293 -0.0875 55 ASN B C 3225 O O . ASN B 34 ? 0.6480 0.9226 0.8622 0.0618 -0.1273 -0.0766 55 ASN B O 3226 C CB . ASN B 34 ? 0.7567 1.0537 0.9156 0.0405 -0.1251 -0.0730 55 ASN B CB 3227 C CG . ASN B 34 ? 0.7974 1.1235 0.9506 0.0489 -0.1186 -0.0841 55 ASN B CG 3228 O OD1 . ASN B 34 ? 0.7631 1.1232 0.9123 0.0478 -0.1133 -0.0778 55 ASN B OD1 3229 N ND2 . ASN B 34 ? 0.8317 1.1447 0.9838 0.0572 -0.1189 -0.1004 55 ASN B ND2 3230 N N . PRO B 35 ? 0.7135 0.9658 0.9180 0.0698 -0.1289 -0.1041 56 PRO B N 3231 C CA . PRO B 35 ? 0.7383 0.9790 0.9260 0.0691 -0.1302 -0.1179 56 PRO B CA 3232 C C . PRO B 35 ? 0.7991 1.0116 0.9819 0.0597 -0.1376 -0.1157 56 PRO B C 3233 O O . PRO B 35 ? 0.7950 0.9937 0.9889 0.0546 -0.1424 -0.1048 56 PRO B O 3234 C CB . PRO B 35 ? 0.6787 0.9064 0.8771 0.0818 -0.1281 -0.1338 56 PRO B CB 3235 C CG . PRO B 35 ? 0.7015 0.9449 0.9162 0.0913 -0.1222 -0.1281 56 PRO B CG 3236 C CD . PRO B 35 ? 0.6700 0.9175 0.8949 0.0831 -0.1252 -0.1097 56 PRO B CD 3237 N N . LYS B 36 ? 0.8748 1.0797 1.0410 0.0584 -0.1377 -0.1251 57 LYS B N 3238 C CA . LYS B 36 ? 0.9121 1.0922 1.0741 0.0521 -0.1437 -0.1236 57 LYS B CA 3239 C C . LYS B 36 ? 0.8408 0.9956 1.0247 0.0561 -0.1495 -0.1288 57 LYS B C 3240 O O . LYS B 36 ? 0.8853 1.0334 1.0771 0.0644 -0.1477 -0.1426 57 LYS B O 3241 C CB . LYS B 36 ? 1.0418 1.2209 1.1847 0.0527 -0.1409 -0.1332 57 LYS B CB 3242 C CG . LYS B 36 ? 1.1551 1.3605 1.2774 0.0496 -0.1335 -0.1300 57 LYS B CG 3243 C CD . LYS B 36 ? 1.1825 1.3911 1.2922 0.0551 -0.1282 -0.1432 57 LYS B CD 3244 C CE . LYS B 36 ? 1.0935 1.3323 1.1870 0.0536 -0.1197 -0.1414 57 LYS B CE 3245 N NZ . LYS B 36 ? 1.0602 1.3048 1.1467 0.0622 -0.1134 -0.1551 57 LYS B NZ 3246 N N . PRO B 37 ? 0.7212 0.8609 0.9143 0.0501 -0.1557 -0.1177 58 PRO B N 3247 C CA . PRO B 37 ? 0.7168 0.8342 0.9333 0.0525 -0.1611 -0.1203 58 PRO B CA 3248 C C . PRO B 37 ? 0.7658 0.8640 0.9821 0.0542 -0.1648 -0.1320 58 PRO B C 3249 O O . PRO B 37 ? 0.6881 0.7857 0.8880 0.0506 -0.1662 -0.1314 58 PRO B O 3250 C CB . PRO B 37 ? 0.7132 0.8232 0.9346 0.0448 -0.1660 -0.1028 58 PRO B CB 3251 C CG . PRO B 37 ? 0.7254 0.8560 0.9291 0.0396 -0.1614 -0.0909 58 PRO B CG 3252 C CD . PRO B 37 ? 0.7148 0.8590 0.8971 0.0407 -0.1569 -0.1004 58 PRO B CD 3253 N N . HIS B 38 ? 0.7968 0.8799 1.0313 0.0598 -0.1656 -0.1419 59 HIS B N 3254 C CA . HIS B 38 ? 0.6676 0.7324 0.9058 0.0615 -0.1692 -0.1510 59 HIS B CA 3255 C C . HIS B 38 ? 0.7531 0.8054 1.0020 0.0547 -0.1777 -0.1401 59 HIS B C 3256 O O . HIS B 38 ? 0.7514 0.8021 1.0128 0.0516 -0.1798 -0.1291 59 HIS B O 3257 C CB . HIS B 38 ? 0.7438 0.7954 0.9967 0.0699 -0.1656 -0.1644 59 HIS B CB 3258 C CG . HIS B 38 ? 1.0087 1.0720 1.2553 0.0768 -0.1573 -0.1722 59 HIS B CG 3259 N ND1 . HIS B 38 ? 1.1372 1.2026 1.3962 0.0785 -0.1548 -0.1702 59 HIS B ND1 3260 C CD2 . HIS B 38 ? 1.1039 1.1791 1.3325 0.0825 -0.1506 -0.1810 59 HIS B CD2 3261 C CE1 . HIS B 38 ? 1.1639 1.2432 1.4118 0.0848 -0.1475 -0.1774 59 HIS B CE1 3262 N NE2 . HIS B 38 ? 1.1667 1.2514 1.3957 0.0875 -0.1449 -0.1848 59 HIS B NE2 3263 N N . ILE B 39 ? 0.8885 0.9334 1.1326 0.0529 -0.1823 -0.1421 60 ILE B N 3264 C CA . ILE B 39 ? 0.8075 0.8431 1.0597 0.0468 -0.1906 -0.1317 60 ILE B CA 3265 C C . ILE B 39 ? 0.8154 0.8376 1.0822 0.0485 -0.1954 -0.1390 60 ILE B C 3266 O O . ILE B 39 ? 0.8795 0.9016 1.1405 0.0525 -0.1931 -0.1499 60 ILE B O 3267 C CB . ILE B 39 ? 0.8093 0.8528 1.0392 0.0407 -0.1928 -0.1222 60 ILE B CB 3268 C CG1 . ILE B 39 ? 0.7758 0.8298 0.9956 0.0373 -0.1891 -0.1101 60 ILE B CG1 3269 C CG2 . ILE B 39 ? 0.8024 0.8362 1.0385 0.0360 -0.2016 -0.1144 60 ILE B CG2 3270 C CD1 . ILE B 39 ? 0.8077 0.8711 1.0001 0.0329 -0.1868 -0.1035 60 ILE B CD1 3271 N N . ARG B 40 ? 0.7668 0.7789 1.0529 0.0454 -0.2014 -0.1318 61 ARG B N 3272 C CA . ARG B 40 ? 0.8264 0.8285 1.1276 0.0456 -0.2066 -0.1365 61 ARG B CA 3273 C C . ARG B 40 ? 0.8454 0.8440 1.1558 0.0388 -0.2153 -0.1237 61 ARG B C 3274 O O . ARG B 40 ? 0.8035 0.8028 1.1146 0.0357 -0.2160 -0.1111 61 ARG B O 3275 C CB . ARG B 40 ? 0.8850 0.8766 1.2075 0.0523 -0.2023 -0.1452 61 ARG B CB 3276 C CG . ARG B 40 ? 0.9799 0.9618 1.3255 0.0511 -0.2036 -0.1373 61 ARG B CG 3277 C CD . ARG B 40 ? 1.0580 1.0290 1.4234 0.0593 -0.1983 -0.1467 61 ARG B CD 3278 N NE . ARG B 40 ? 1.0758 1.0346 1.4667 0.0580 -0.2005 -0.1397 61 ARG B NE 3279 C CZ . ARG B 40 ? 1.0913 1.0504 1.4914 0.0558 -0.1959 -0.1368 61 ARG B CZ 3280 N NH1 . ARG B 40 ? 1.0700 1.0360 1.4570 0.0576 -0.1892 -0.1414 61 ARG B NH1 3281 N NH2 . ARG B 40 ? 1.0864 1.0415 1.5089 0.0509 -0.1978 -0.1289 61 ARG B NH2 3282 N N . TRP B 41 ? 0.8575 0.8534 1.1742 0.0367 -0.2214 -0.1263 62 TRP B N 3283 C CA . TRP B 41 ? 0.7760 0.7714 1.0992 0.0304 -0.2300 -0.1146 62 TRP B CA 3284 C C . TRP B 41 ? 0.8176 0.8040 1.1691 0.0297 -0.2344 -0.1150 62 TRP B C 3285 O O . TRP B 41 ? 0.8622 0.8443 1.2237 0.0332 -0.2321 -0.1264 62 TRP B O 3286 C CB . TRP B 41 ? 0.7657 0.7700 1.0698 0.0267 -0.2346 -0.1149 62 TRP B CB 3287 C CG . TRP B 41 ? 0.7750 0.7872 1.0517 0.0261 -0.2312 -0.1101 62 TRP B CG 3288 C CD1 . TRP B 41 ? 0.7617 0.7795 1.0200 0.0294 -0.2240 -0.1180 62 TRP B CD1 3289 C CD2 . TRP B 41 ? 0.7265 0.7418 0.9900 0.0220 -0.2336 -0.0955 62 TRP B CD2 3290 N NE1 . TRP B 41 ? 0.7564 0.7811 0.9919 0.0271 -0.2220 -0.1096 62 TRP B NE1 3291 C CE2 . TRP B 41 ? 0.7329 0.7551 0.9699 0.0227 -0.2275 -0.0957 62 TRP B CE2 3292 C CE3 . TRP B 41 ? 0.6795 0.6918 0.9505 0.0183 -0.2396 -0.0820 62 TRP B CE3 3293 C CZ2 . TRP B 41 ? 0.7264 0.7510 0.9433 0.0195 -0.2265 -0.0830 62 TRP B CZ2 3294 C CZ3 . TRP B 41 ? 0.6636 0.6778 0.9135 0.0158 -0.2386 -0.0692 62 TRP B CZ3 3295 C CH2 . TRP B 41 ? 0.7199 0.7393 0.9425 0.0163 -0.2318 -0.0700 62 TRP B CH2 3296 N N . LYS B 42 ? 0.8181 0.8024 1.1814 0.0256 -0.2399 -0.1018 63 LYS B N 3297 C CA . LYS B 42 ? 0.8821 0.8596 1.2728 0.0240 -0.2445 -0.1002 63 LYS B CA 3298 C C . LYS B 42 ? 0.8990 0.8843 1.2900 0.0178 -0.2539 -0.0919 63 LYS B C 3299 O O . LYS B 42 ? 0.8691 0.8601 1.2447 0.0154 -0.2563 -0.0806 63 LYS B O 3300 C CB . LYS B 42 ? 0.9034 0.8701 1.3138 0.0255 -0.2415 -0.0911 63 LYS B CB 3301 C CG . LYS B 42 ? 0.9658 0.9228 1.3884 0.0321 -0.2333 -0.1010 63 LYS B CG 3302 C CD . LYS B 42 ? 1.0085 0.9536 1.4517 0.0323 -0.2308 -0.0913 63 LYS B CD 3303 C CE . LYS B 42 ? 1.1068 1.0424 1.5592 0.0392 -0.2217 -0.1005 63 LYS B CE 3304 N NZ . LYS B 42 ? 1.1803 1.1157 1.6474 0.0446 -0.2201 -0.1124 63 LYS B NZ 3305 N N . LEU B 43 ? 0.9199 0.9061 1.3277 0.0154 -0.2587 -0.0973 64 LEU B N 3306 C CA . LEU B 43 ? 0.9657 0.9619 1.3779 0.0092 -0.2681 -0.0898 64 LEU B CA 3307 C C . LEU B 43 ? 1.0295 1.0204 1.4730 0.0074 -0.2712 -0.0838 64 LEU B C 3308 O O . LEU B 43 ? 1.0096 0.9941 1.4708 0.0083 -0.2691 -0.0932 64 LEU B O 3309 C CB . LEU B 43 ? 0.9111 0.9179 1.3133 0.0058 -0.2719 -0.1011 64 LEU B CB 3310 C CG . LEU B 43 ? 0.8454 0.8665 1.2523 -0.0009 -0.2822 -0.0950 64 LEU B CG 3311 C CD1 . LEU B 43 ? 0.7853 0.8116 1.1842 -0.0009 -0.2854 -0.0780 64 LEU B CD1 3312 C CD2 . LEU B 43 ? 0.8951 0.9275 1.2846 -0.0042 -0.2848 -0.1054 64 LEU B CD2 3313 N N . ASN B 44 ? 1.1186 1.1120 1.5677 0.0055 -0.2753 -0.0677 65 ASN B N 3314 C CA . ASN B 44 ? 1.2474 1.2360 1.7264 0.0041 -0.2776 -0.0598 65 ASN B CA 3315 C C . ASN B 44 ? 1.2463 1.2175 1.7447 0.0084 -0.2700 -0.0654 65 ASN B C 3316 O O . ASN B 44 ? 1.2612 1.2276 1.7854 0.0076 -0.2707 -0.0665 65 ASN B O 3317 C CB . ASN B 44 ? 1.3657 1.3677 1.8586 -0.0017 -0.2859 -0.0631 65 ASN B CB 3318 C CG . ASN B 44 ? 1.4637 1.4817 1.9523 -0.0049 -0.2938 -0.0488 65 ASN B CG 3319 O OD1 . ASN B 44 ? 1.4307 1.4526 1.8948 -0.0033 -0.2936 -0.0415 65 ASN B OD1 3320 N ND2 . ASN B 44 ? 1.6037 1.6315 2.1158 -0.0090 -0.3001 -0.0445 65 ASN B ND2 3321 N N . GLY B 45 ? 1.2024 1.1651 1.6879 0.0133 -0.2624 -0.0689 66 GLY B N 3322 C CA . GLY B 45 ? 1.1403 1.0874 1.6419 0.0188 -0.2543 -0.0735 66 GLY B CA 3323 C C . GLY B 45 ? 1.1501 1.0950 1.6454 0.0245 -0.2482 -0.0908 66 GLY B C 3324 O O . GLY B 45 ? 1.1601 1.0973 1.6531 0.0305 -0.2404 -0.0943 66 GLY B O 3325 N N . THR B 46 ? 1.1584 1.1113 1.6502 0.0224 -0.2514 -0.1014 67 THR B N 3326 C CA . THR B 46 ? 1.1700 1.1216 1.6553 0.0282 -0.2446 -0.1168 67 THR B CA 3327 C C . THR B 46 ? 1.1283 1.0866 1.5837 0.0297 -0.2420 -0.1230 67 THR B C 3328 O O . THR B 46 ? 1.1520 1.1189 1.5900 0.0248 -0.2470 -0.1172 67 THR B O 3329 C CB . THR B 46 ? 1.2675 1.2234 1.7607 0.0244 -0.2473 -0.1251 67 THR B CB 3330 O OG1 . THR B 46 ? 1.3178 1.2863 1.7998 0.0151 -0.2567 -0.1227 67 THR B OG1 3331 C CG2 . THR B 46 ? 1.2672 1.2168 1.7910 0.0244 -0.2475 -0.1209 67 THR B CG2 3332 N N . ASP B 47 ? 1.0839 1.0400 1.5336 0.0375 -0.2334 -0.1340 68 ASP B N 3333 C CA . ASP B 47 ? 1.0702 1.0323 1.4931 0.0401 -0.2294 -0.1401 68 ASP B CA 3334 C C . ASP B 47 ? 1.0086 0.9798 1.4138 0.0349 -0.2334 -0.1460 68 ASP B C 3335 O O . ASP B 47 ? 0.9635 0.9358 1.3768 0.0313 -0.2363 -0.1501 68 ASP B O 3336 C CB . ASP B 47 ? 1.1414 1.1016 1.5654 0.0509 -0.2186 -0.1490 68 ASP B CB 3337 C CG . ASP B 47 ? 1.1887 1.1423 1.6273 0.0566 -0.2140 -0.1436 68 ASP B CG 3338 O OD1 . ASP B 47 ? 1.2270 1.1849 1.6532 0.0596 -0.2074 -0.1468 68 ASP B OD1 3339 O OD2 . ASP B 47 ? 1.1673 1.1154 1.6298 0.0533 -0.2184 -0.1367 68 ASP B OD2 3340 N N . VAL B 48 ? 0.9902 0.9687 1.3708 0.0342 -0.2331 -0.1462 69 VAL B N 3341 C CA . VAL B 48 ? 1.0327 1.0200 1.3944 0.0301 -0.2361 -0.1513 69 VAL B CA 3342 C C . VAL B 48 ? 1.1720 1.1600 1.5194 0.0369 -0.2269 -0.1626 69 VAL B C 3343 O O . VAL B 48 ? 1.2276 1.2180 1.5601 0.0416 -0.2212 -0.1636 69 VAL B O 3344 C CB . VAL B 48 ? 0.9228 0.9194 1.2654 0.0256 -0.2411 -0.1430 69 VAL B CB 3345 C CG1 . VAL B 48 ? 0.8759 0.8815 1.1974 0.0233 -0.2422 -0.1492 69 VAL B CG1 3346 C CG2 . VAL B 48 ? 0.8549 0.8539 1.2100 0.0194 -0.2503 -0.1303 69 VAL B CG2 3347 N N . ASP B 49 ? 1.2433 1.2306 1.5947 0.0370 -0.2250 -0.1701 70 ASP B N 3348 C CA . ASP B 49 ? 1.2964 1.2856 1.6346 0.0436 -0.2158 -0.1787 70 ASP B CA 3349 C C . ASP B 49 ? 1.3040 1.3009 1.6178 0.0399 -0.2172 -0.1812 70 ASP B C 3350 O O . ASP B 49 ? 1.4102 1.4101 1.7203 0.0333 -0.2216 -0.1834 70 ASP B O 3351 C CB . ASP B 49 ? 1.3573 1.3441 1.7075 0.0449 -0.2118 -0.1837 70 ASP B CB 3352 C CG . ASP B 49 ? 1.4185 1.4095 1.7590 0.0509 -0.2027 -0.1913 70 ASP B CG 3353 O OD1 . ASP B 49 ? 1.4305 1.4258 1.7549 0.0579 -0.1968 -0.1902 70 ASP B OD1 3354 O OD2 . ASP B 49 ? 1.4344 1.4237 1.7837 0.0428 -0.2053 -0.2021 70 ASP B OD2 3355 N N . ILE B 50 ? 1.2229 1.2237 1.5203 0.0441 -0.2131 -0.1806 71 ILE B N 3356 C CA . ILE B 50 ? 1.2469 1.2555 1.5213 0.0415 -0.2136 -0.1817 71 ILE B CA 3357 C C . ILE B 50 ? 1.3593 1.3695 1.6250 0.0426 -0.2088 -0.1888 71 ILE B C 3358 O O . ILE B 50 ? 1.3503 1.3640 1.6088 0.0356 -0.2141 -0.1896 71 ILE B O 3359 C CB . ILE B 50 ? 1.2110 1.2238 1.4702 0.0467 -0.2078 -0.1802 71 ILE B CB 3360 C CG1 . ILE B 50 ? 1.1217 1.1324 1.3889 0.0455 -0.2108 -0.1722 71 ILE B CG1 3361 C CG2 . ILE B 50 ? 1.2381 1.2591 1.4745 0.0434 -0.2089 -0.1796 71 ILE B CG2 3362 C CD1 . ILE B 50 ? 1.0833 1.0974 1.3487 0.0370 -0.2208 -0.1628 71 ILE B CD1 3363 N N . GLY B 51 ? 1.4792 1.4883 1.7452 0.0514 -0.1988 -0.1928 72 GLY B N 3364 C CA . GLY B 51 ? 1.6119 1.6236 1.8678 0.0534 -0.1924 -0.1970 72 GLY B CA 3365 C C . GLY B 51 ? 1.7163 1.7257 1.9751 0.0453 -0.1966 -0.1989 72 GLY B C 3366 O O . GLY B 51 ? 1.7423 1.7548 1.9868 0.0413 -0.1968 -0.2007 72 GLY B O 3367 N N . MET B 52 ? 1.7733 1.7777 2.0509 0.0425 -0.1999 -0.1984 73 MET B N 3368 C CA . MET B 52 ? 1.8716 1.8745 2.1528 0.0339 -0.2036 -0.2003 73 MET B CA 3369 C C . MET B 52 ? 1.8726 1.8738 2.1712 0.0258 -0.2144 -0.1976 73 MET B C 3370 O O . MET B 52 ? 1.8164 1.8124 2.1339 0.0281 -0.2136 -0.1961 73 MET B O 3371 C CB . MET B 52 ? 1.9298 1.9293 2.2162 0.0308 -0.2001 -0.2091 73 MET B CB 3372 C CG . MET B 52 ? 1.9758 1.9725 2.2656 0.0188 -0.2041 -0.2132 73 MET B CG 3373 S SD . MET B 52 ? 4.0684 4.0705 4.3364 0.0149 -0.2021 -0.2099 73 MET B SD 3374 C CE . MET B 52 ? 1.1224 1.1257 1.3694 0.0185 -0.1968 -0.2156 73 MET B CE 3375 N N . ASP B 53 ? 1.9335 1.9411 2.2264 0.0166 -0.2245 -0.1959 74 ASP B N 3376 C CA . ASP B 53 ? 2.0203 2.0350 2.2912 0.0144 -0.2250 -0.1975 74 ASP B CA 3377 C C . ASP B 53 ? 1.9714 1.9962 2.2391 0.0053 -0.2373 -0.1936 74 ASP B C 3378 O O . ASP B 53 ? 2.0396 2.0688 2.3191 -0.0036 -0.2458 -0.1926 74 ASP B O 3379 C CB . ASP B 53 ? 2.1614 2.1755 2.4225 0.0118 -0.2196 -0.2027 74 ASP B CB 3380 C CG . ASP B 53 ? 2.2752 2.2969 2.5160 0.0076 -0.2217 -0.2039 74 ASP B CG 3381 O OD1 . ASP B 53 ? 2.3112 2.3347 2.5388 0.0141 -0.2176 -0.2029 74 ASP B OD1 3382 O OD2 . ASP B 53 ? 2.3037 2.3303 2.5420 -0.0025 -0.2276 -0.2056 74 ASP B OD2 3383 N N . PHE B 54 ? 1.8340 1.8643 2.0856 0.0077 -0.2376 -0.1910 75 PHE B N 3384 C CA . PHE B 54 ? 1.7152 1.7575 1.9566 0.0007 -0.2465 -0.1881 75 PHE B CA 3385 C C . PHE B 54 ? 1.5550 1.5994 1.7744 0.0064 -0.2406 -0.1880 75 PHE B C 3386 O O . PHE B 54 ? 1.5159 1.5545 1.7277 0.0133 -0.2303 -0.1922 75 PHE B O 3387 C CB . PHE B 54 ? 1.7330 1.7816 1.9852 -0.0029 -0.2566 -0.1792 75 PHE B CB 3388 C CG . PHE B 54 ? 1.7813 1.8283 2.0581 -0.0079 -0.2623 -0.1775 75 PHE B CG 3389 C CD1 . PHE B 54 ? 1.8019 1.8379 2.0947 -0.0027 -0.2582 -0.1759 75 PHE B CD1 3390 C CD2 . PHE B 54 ? 1.8089 1.8669 2.0936 -0.0179 -0.2719 -0.1772 75 PHE B CD2 3391 C CE1 . PHE B 54 ? 1.7944 1.8283 2.1109 -0.0070 -0.2628 -0.1740 75 PHE B CE1 3392 C CE2 . PHE B 54 ? 1.8329 1.8906 2.1414 -0.0229 -0.2768 -0.1754 75 PHE B CE2 3393 C CZ . PHE B 54 ? 1.8119 1.8566 2.1363 -0.0173 -0.2719 -0.1736 75 PHE B CZ 3394 N N . ARG B 55 ? 1.4898 1.5435 1.6993 0.0039 -0.2466 -0.1824 76 ARG B N 3395 C CA . ARG B 55 ? 1.5561 1.6110 1.7468 0.0098 -0.2405 -0.1805 76 ARG B CA 3396 C C . ARG B 55 ? 1.5017 1.5543 1.6960 0.0134 -0.2402 -0.1729 76 ARG B C 3397 O O . ARG B 55 ? 1.5022 1.5587 1.6817 0.0153 -0.2386 -0.1676 76 ARG B O 3398 C CB . ARG B 55 ? 1.6906 1.7559 1.8645 0.0061 -0.2447 -0.1788 76 ARG B CB 3399 C CG . ARG B 55 ? 1.8363 1.9023 2.0013 0.0043 -0.2414 -0.1861 76 ARG B CG 3400 C CD . ARG B 55 ? 1.9052 1.9608 2.0707 0.0111 -0.2298 -0.1916 76 ARG B CD 3401 N NE . ARG B 55 ? 1.9676 2.0210 2.1323 0.0078 -0.2275 -0.1974 76 ARG B NE 3402 C CZ . ARG B 55 ? 2.0031 2.0478 2.1755 0.0107 -0.2205 -0.2010 76 ARG B CZ 3403 N NH1 . ARG B 55 ? 1.9805 2.0188 2.1633 0.0176 -0.2158 -0.2002 76 ARG B NH1 3404 N NH2 . ARG B 55 ? 2.0489 2.0917 2.2179 0.0067 -0.2179 -0.2047 76 ARG B NH2 3405 N N . TYR B 56 ? 1.3941 1.4402 1.6080 0.0139 -0.2414 -0.1720 77 TYR B N 3406 C CA . TYR B 56 ? 1.2764 1.3185 1.4947 0.0178 -0.2391 -0.1656 77 TYR B CA 3407 C C . TYR B 56 ? 1.2468 1.2881 1.4486 0.0247 -0.2287 -0.1682 77 TYR B C 3408 O O . TYR B 56 ? 1.2945 1.3323 1.4954 0.0296 -0.2211 -0.1760 77 TYR B O 3409 C CB . TYR B 56 ? 1.2156 1.2485 1.4569 0.0196 -0.2382 -0.1672 77 TYR B CB 3410 C CG . TYR B 56 ? 1.2093 1.2428 1.4706 0.0134 -0.2480 -0.1615 77 TYR B CG 3411 C CD1 . TYR B 56 ? 1.2211 1.2468 1.5044 0.0135 -0.2477 -0.1646 77 TYR B CD1 3412 C CD2 . TYR B 56 ? 1.2402 1.2829 1.4987 0.0080 -0.2568 -0.1525 77 TYR B CD2 3413 C CE1 . TYR B 56 ? 1.2435 1.2705 1.5468 0.0076 -0.2563 -0.1590 77 TYR B CE1 3414 C CE2 . TYR B 56 ? 1.2600 1.3055 1.5382 0.0027 -0.2657 -0.1463 77 TYR B CE2 3415 C CZ . TYR B 56 ? 1.2648 1.3026 1.5662 0.0021 -0.2655 -0.1498 77 TYR B CZ 3416 O OH . TYR B 56 ? 1.2586 1.3000 1.5810 -0.0032 -0.2738 -0.1434 77 TYR B OH 3417 N N . SER B 57 ? 1.2007 1.2462 1.3889 0.0253 -0.2277 -0.1610 78 SER B N 3418 C CA . SER B 57 ? 1.2399 1.2869 1.4131 0.0308 -0.2177 -0.1625 78 SER B CA 3419 C C . SER B 57 ? 1.2898 1.3365 1.4625 0.0315 -0.2160 -0.1541 78 SER B C 3420 O O . SER B 57 ? 1.3492 1.3984 1.5156 0.0277 -0.2203 -0.1442 78 SER B O 3421 C CB . SER B 57 ? 1.2178 1.2719 1.3694 0.0301 -0.2158 -0.1624 78 SER B CB 3422 O OG . SER B 57 ? 1.2161 1.2723 1.3561 0.0357 -0.2054 -0.1666 78 SER B OG 3423 N N . VAL B 58 ? 1.2770 1.3208 1.4563 0.0365 -0.2095 -0.1574 79 VAL B N 3424 C CA . VAL B 58 ? 1.2187 1.2635 1.3967 0.0366 -0.2070 -0.1497 79 VAL B CA 3425 C C . VAL B 58 ? 1.2433 1.2962 1.4027 0.0399 -0.1974 -0.1512 79 VAL B C 3426 O O . VAL B 58 ? 1.2602 1.3146 1.4207 0.0456 -0.1904 -0.1596 79 VAL B O 3427 C CB . VAL B 58 ? 1.1415 1.1791 1.3416 0.0391 -0.2070 -0.1508 79 VAL B CB 3428 C CG1 . VAL B 58 ? 1.1883 1.2214 1.3987 0.0448 -0.2027 -0.1628 79 VAL B CG1 3429 C CG2 . VAL B 58 ? 1.0935 1.1347 1.2895 0.0404 -0.2014 -0.1456 79 VAL B CG2 3430 N N . VAL B 59 ? 1.2420 1.3004 1.3840 0.0364 -0.1966 -0.1424 80 VAL B N 3431 C CA . VAL B 59 ? 1.2525 1.3202 1.3762 0.0381 -0.1874 -0.1426 80 VAL B CA 3432 C C . VAL B 59 ? 1.1961 1.2674 1.3108 0.0342 -0.1852 -0.1306 80 VAL B C 3433 O O . VAL B 59 ? 1.1244 1.1925 1.2329 0.0296 -0.1893 -0.1201 80 VAL B O 3434 C CB . VAL B 59 ? 1.3097 1.3813 1.4165 0.0377 -0.1856 -0.1444 80 VAL B CB 3435 C CG1 . VAL B 59 ? 1.2987 1.3793 1.3856 0.0367 -0.1775 -0.1388 80 VAL B CG1 3436 C CG2 . VAL B 59 ? 1.3496 1.4211 1.4608 0.0428 -0.1827 -0.1564 80 VAL B CG2 3437 N N . ASP B 60 ? 1.2076 1.2862 1.3211 0.0363 -0.1781 -0.1318 81 ASP B N 3438 C CA . ASP B 60 ? 1.1991 1.2826 1.3051 0.0320 -0.1752 -0.1202 81 ASP B CA 3439 C C . ASP B 60 ? 1.1208 1.1948 1.2429 0.0294 -0.1822 -0.1121 81 ASP B C 3440 O O . ASP B 60 ? 1.1038 1.1767 1.2190 0.0245 -0.1822 -0.0989 81 ASP B O 3441 C CB . ASP B 60 ? 1.3397 1.4261 1.4230 0.0273 -0.1720 -0.1110 81 ASP B CB 3442 C CG . ASP B 60 ? 1.4661 1.5601 1.5374 0.0228 -0.1653 -0.1004 81 ASP B CG 3443 O OD1 . ASP B 60 ? 1.5201 1.6273 1.5886 0.0244 -0.1582 -0.1048 81 ASP B OD1 3444 O OD2 . ASP B 60 ? 1.4901 1.5774 1.5546 0.0176 -0.1667 -0.0873 81 ASP B OD2 3445 N N . GLY B 61 ? 1.0760 1.1425 1.2198 0.0327 -0.1873 -0.1194 82 GLY B N 3446 C CA . GLY B 61 ? 1.0624 1.1196 1.2254 0.0308 -0.1938 -0.1125 82 GLY B CA 3447 C C . GLY B 61 ? 1.0664 1.1152 1.2327 0.0273 -0.2024 -0.1065 82 GLY B C 3448 O O . GLY B 61 ? 1.1172 1.1580 1.3040 0.0268 -0.2087 -0.1047 82 GLY B O 3449 N N . SER B 62 ? 1.0179 1.0695 1.1644 0.0250 -0.2023 -0.1033 83 SER B N 3450 C CA . SER B 62 ? 0.9486 0.9951 1.0953 0.0219 -0.2100 -0.0973 83 SER B CA 3451 C C . SER B 62 ? 0.9368 0.9819 1.0972 0.0234 -0.2163 -0.1082 83 SER B C 3452 O O . SER B 62 ? 0.9280 0.9765 1.0840 0.0263 -0.2131 -0.1195 83 SER B O 3453 C CB . SER B 62 ? 1.0415 1.0911 1.1617 0.0195 -0.2066 -0.0906 83 SER B CB 3454 O OG . SER B 62 ? 1.1715 1.2210 1.2784 0.0169 -0.2000 -0.0793 83 SER B OG 3455 N N . LEU B 63 ? 0.9411 0.9813 1.1178 0.0210 -0.2250 -0.1039 84 LEU B N 3456 C CA . LEU B 63 ? 0.9607 1.0006 1.1517 0.0208 -0.2314 -0.1128 84 LEU B CA 3457 C C . LEU B 63 ? 0.9946 1.0405 1.1720 0.0181 -0.2359 -0.1117 84 LEU B C 3458 O O . LEU B 63 ? 0.9971 1.0440 1.1725 0.0150 -0.2412 -0.1012 84 LEU B O 3459 C CB . LEU B 63 ? 0.9605 0.9944 1.1784 0.0190 -0.2383 -0.1091 84 LEU B CB 3460 C CG . LEU B 63 ? 0.9675 1.0019 1.2027 0.0172 -0.2453 -0.1167 84 LEU B CG 3461 C CD1 . LEU B 63 ? 0.9659 0.9988 1.2019 0.0205 -0.2402 -0.1318 84 LEU B CD1 3462 C CD2 . LEU B 63 ? 0.9334 0.9616 1.1957 0.0155 -0.2506 -0.1113 84 LEU B CD2 3463 N N . LEU B 64 ? 1.0077 1.0577 1.1755 0.0195 -0.2333 -0.1221 85 LEU B N 3464 C CA . LEU B 64 ? 1.0007 1.0572 1.1572 0.0172 -0.2374 -0.1226 85 LEU B CA 3465 C C . LEU B 64 ? 1.0157 1.0738 1.1894 0.0146 -0.2451 -0.1303 85 LEU B C 3466 O O . LEU B 64 ? 1.0449 1.0996 1.2277 0.0164 -0.2422 -0.1405 85 LEU B O 3467 C CB . LEU B 64 ? 1.0475 1.1077 1.1827 0.0199 -0.2295 -0.1283 85 LEU B CB 3468 C CG . LEU B 64 ? 1.0808 1.1408 1.1997 0.0223 -0.2199 -0.1232 85 LEU B CG 3469 C CD1 . LEU B 64 ? 1.0566 1.1218 1.1553 0.0241 -0.2130 -0.1272 85 LEU B CD1 3470 C CD2 . LEU B 64 ? 1.1084 1.1661 1.2208 0.0196 -0.2211 -0.1088 85 LEU B CD2 3471 N N . ILE B 65 ? 1.0009 1.0651 1.1785 0.0102 -0.2540 -0.1249 86 ILE B N 3472 C CA . ILE B 65 ? 0.9479 1.0166 1.1416 0.0060 -0.2619 -0.1312 86 ILE B CA 3473 C C . ILE B 65 ? 1.0424 1.1220 1.2225 0.0032 -0.2657 -0.1337 86 ILE B C 3474 O O . ILE B 65 ? 1.0415 1.1279 1.2101 0.0027 -0.2687 -0.1253 86 ILE B O 3475 C CB . ILE B 65 ? 0.8373 0.9077 1.0526 0.0024 -0.2706 -0.1230 86 ILE B CB 3476 C CG1 . ILE B 65 ? 0.7678 0.8271 0.9952 0.0054 -0.2666 -0.1179 86 ILE B CG1 3477 C CG2 . ILE B 65 ? 0.7897 0.8652 1.0241 -0.0029 -0.2776 -0.1304 86 ILE B CG2 3478 C CD1 . ILE B 65 ? 0.7532 0.8128 1.0038 0.0025 -0.2740 -0.1089 86 ILE B CD1 3479 N N . ASN B 66 ? 1.1159 1.1966 1.2964 0.0018 -0.2648 -0.1450 87 ASN B N 3480 C CA . ASN B 66 ? 1.1749 1.2664 1.3442 -0.0016 -0.2688 -0.1480 87 ASN B CA 3481 C C . ASN B 66 ? 1.1689 1.2703 1.3552 -0.0092 -0.2794 -0.1500 87 ASN B C 3482 O O . ASN B 66 ? 1.1212 1.2177 1.3249 -0.0118 -0.2801 -0.1556 87 ASN B O 3483 C CB . ASN B 66 ? 1.2102 1.2980 1.3654 0.0012 -0.2603 -0.1576 87 ASN B CB 3484 C CG . ASN B 66 ? 1.2148 1.3006 1.3485 0.0069 -0.2519 -0.1542 87 ASN B CG 3485 O OD1 . ASN B 66 ? 1.1937 1.2741 1.3252 0.0105 -0.2472 -0.1484 87 ASN B OD1 3486 N ND2 . ASN B 66 ? 1.2190 1.3096 1.3368 0.0072 -0.2496 -0.1574 87 ASN B ND2 3487 N N . ASN B 67 ? 1.2109 1.3270 1.3918 -0.0125 -0.2871 -0.1452 88 ASN B N 3488 C CA . ASN B 67 ? 1.2496 1.3806 1.4465 -0.0204 -0.2984 -0.1453 88 ASN B CA 3489 C C . ASN B 67 ? 1.2899 1.4213 1.5102 -0.0220 -0.3040 -0.1377 88 ASN B C 3490 O O . ASN B 67 ? 1.3529 1.4822 1.5931 -0.0266 -0.3062 -0.1426 88 ASN B O 3491 C CB . ASN B 67 ? 1.2414 1.3719 1.4433 -0.0261 -0.2979 -0.1577 88 ASN B CB 3492 C CG . ASN B 67 ? 1.2744 1.4107 1.4560 -0.0270 -0.2960 -0.1633 88 ASN B CG 3493 O OD1 . ASN B 67 ? 1.2318 1.3755 1.3976 -0.0240 -0.2966 -0.1583 88 ASN B OD1 3494 N ND2 . ASN B 67 ? 1.3425 1.4746 1.5240 -0.0309 -0.2929 -0.1732 88 ASN B ND2 3495 N N . PRO B 68 ? 1.2679 1.4013 1.4854 -0.0180 -0.3054 -0.1251 89 PRO B N 3496 C CA . PRO B 68 ? 1.2749 1.4070 1.5139 -0.0185 -0.3094 -0.1159 89 PRO B CA 3497 C C . PRO B 68 ? 1.3857 1.5360 1.6468 -0.0258 -0.3208 -0.1147 89 PRO B C 3498 O O . PRO B 68 ? 1.3783 1.5483 1.6342 -0.0284 -0.3278 -0.1121 89 PRO B O 3499 C CB . PRO B 68 ? 1.2021 1.3335 1.4263 -0.0127 -0.3075 -0.1018 89 PRO B CB 3500 C CG . PRO B 68 ? 1.2105 1.3365 1.4060 -0.0086 -0.2993 -0.1058 89 PRO B CG 3501 C CD . PRO B 68 ? 1.2572 1.3921 1.4498 -0.0128 -0.3018 -0.1181 89 PRO B CD 3502 N N . ASN B 69 ? 1.4960 1.6409 1.7822 -0.0291 -0.3221 -0.1165 90 ASN B N 3503 C CA . ASN B 69 ? 1.6055 1.7670 1.9154 -0.0373 -0.3317 -0.1167 90 ASN B CA 3504 C C . ASN B 69 ? 1.5030 1.6628 1.8374 -0.0361 -0.3344 -0.1054 90 ASN B C 3505 O O . ASN B 69 ? 1.4858 1.6276 1.8331 -0.0346 -0.3290 -0.1078 90 ASN B O 3506 C CB . ASN B 69 ? 1.8083 1.9626 2.1251 -0.0435 -0.3290 -0.1316 90 ASN B CB 3507 C CG . ASN B 69 ? 2.0188 2.1938 2.3520 -0.0543 -0.3386 -0.1344 90 ASN B CG 3508 O OD1 . ASN B 69 ? 1.9966 2.1910 2.3451 -0.0569 -0.3476 -0.1244 90 ASN B OD1 3509 N ND2 . ASN B 69 ? 2.2673 2.4389 2.5969 -0.0607 -0.3360 -0.1472 90 ASN B ND2 3510 N N . LYS B 70 ? 1.4274 1.6063 1.7682 -0.0360 -0.3423 -0.0926 91 LYS B N 3511 C CA . LYS B 70 ? 1.3709 1.5483 1.7325 -0.0334 -0.3438 -0.0790 91 LYS B CA 3512 C C . LYS B 70 ? 1.3101 1.4789 1.7016 -0.0380 -0.3436 -0.0836 91 LYS B C 3513 O O . LYS B 70 ? 1.2616 1.4163 1.6664 -0.0340 -0.3398 -0.0761 91 LYS B O 3514 C CB . LYS B 70 ? 1.3711 1.5753 1.7386 -0.0332 -0.3529 -0.0655 91 LYS B CB 3515 C CG . LYS B 70 ? 1.3579 1.5605 1.7465 -0.0295 -0.3536 -0.0498 91 LYS B CG 3516 C CD . LYS B 70 ? 1.3770 1.6085 1.7732 -0.0283 -0.3620 -0.0362 91 LYS B CD 3517 C CE . LYS B 70 ? 1.3328 1.5613 1.7511 -0.0242 -0.3615 -0.0201 91 LYS B CE 3518 N NZ . LYS B 70 ? 1.3119 1.5693 1.7370 -0.0210 -0.3684 -0.0051 91 LYS B NZ 3519 N N . THR B 71 ? 1.3001 1.4766 1.7014 -0.0467 -0.3468 -0.0959 92 THR B N 3520 C CA . THR B 71 ? 1.2640 1.4326 1.6925 -0.0520 -0.3459 -0.1006 92 THR B CA 3521 C C . THR B 71 ? 1.2540 1.3917 1.6797 -0.0469 -0.3345 -0.1086 92 THR B C 3522 O O . THR B 71 ? 1.2099 1.3350 1.6573 -0.0461 -0.3314 -0.1070 92 THR B O 3523 C CB . THR B 71 ? 1.2295 1.4138 1.6657 -0.0638 -0.3513 -0.1117 92 THR B CB 3524 O OG1 . THR B 71 ? 1.2619 1.4372 1.6738 -0.0649 -0.3460 -0.1253 92 THR B OG1 3525 C CG2 . THR B 71 ? 1.1736 1.3932 1.6153 -0.0687 -0.3633 -0.1032 92 THR B CG2 3526 N N . GLN B 72 ? 1.2887 1.4153 1.6884 -0.0426 -0.3278 -0.1165 93 GLN B N 3527 C CA . GLN B 72 ? 1.2976 1.3986 1.6927 -0.0364 -0.3166 -0.1236 93 GLN B CA 3528 C C . GLN B 72 ? 1.2366 1.3270 1.6213 -0.0273 -0.3117 -0.1142 93 GLN B C 3529 O O . GLN B 72 ? 1.1578 1.2316 1.5527 -0.0225 -0.3056 -0.1124 93 GLN B O 3530 C CB . GLN B 72 ? 1.3494 1.4447 1.7230 -0.0366 -0.3105 -0.1378 93 GLN B CB 3531 C CG . GLN B 72 ? 1.4478 1.5589 1.8194 -0.0464 -0.3164 -0.1451 93 GLN B CG 3532 C CD . GLN B 72 ? 1.5338 1.6354 1.8848 -0.0458 -0.3084 -0.1582 93 GLN B CD 3533 O OE1 . GLN B 72 ? 1.5776 1.6596 1.9259 -0.0397 -0.2980 -0.1642 93 GLN B OE1 3534 N NE2 . GLN B 72 ? 1.5275 1.6438 1.8638 -0.0515 -0.3128 -0.1619 93 GLN B NE2 3535 N N . ASP B 73 ? 1.2029 1.3030 1.5661 -0.0252 -0.3138 -0.1079 94 ASP B N 3536 C CA . ASP B 73 ? 1.1411 1.2302 1.4858 -0.0175 -0.3072 -0.1014 94 ASP B CA 3537 C C . ASP B 73 ? 1.0935 1.1832 1.4429 -0.0147 -0.3092 -0.0838 94 ASP B C 3538 O O . ASP B 73 ? 1.1274 1.2052 1.4643 -0.0094 -0.3025 -0.0777 94 ASP B O 3539 C CB . ASP B 73 ? 1.1079 1.2022 1.4218 -0.0161 -0.3050 -0.1055 94 ASP B CB 3540 C CG . ASP B 73 ? 1.1205 1.2126 1.4274 -0.0181 -0.3016 -0.1216 94 ASP B CG 3541 O OD1 . ASP B 73 ? 1.0853 1.1653 1.4047 -0.0177 -0.2969 -0.1297 94 ASP B OD1 3542 O OD2 . ASP B 73 ? 1.1750 1.2766 1.4632 -0.0196 -0.3028 -0.1256 94 ASP B OD2 3543 N N . ALA B 74 ? 0.9768 1.0809 1.3434 -0.0180 -0.3176 -0.0751 95 ALA B N 3544 C CA . ALA B 74 ? 0.9131 1.0169 1.2843 -0.0145 -0.3183 -0.0571 95 ALA B CA 3545 C C . ALA B 74 ? 0.9037 0.9895 1.2956 -0.0123 -0.3134 -0.0532 95 ALA B C 3546 O O . ALA B 74 ? 0.9196 1.0013 1.3347 -0.0152 -0.3139 -0.0613 95 ALA B O 3547 C CB . ALA B 74 ? 0.8541 0.9805 1.2385 -0.0175 -0.3280 -0.0482 95 ALA B CB 3548 N N . GLY B 75 ? 0.7969 0.8710 1.1794 -0.0075 -0.3080 -0.0406 96 GLY B N 3549 C CA . GLY B 75 ? 0.8173 0.8752 1.2195 -0.0055 -0.3035 -0.0351 96 GLY B CA 3550 C C . GLY B 75 ? 0.9418 0.9828 1.3256 -0.0012 -0.2944 -0.0290 96 GLY B C 3551 O O . GLY B 75 ? 0.9589 1.0005 1.3133 0.0002 -0.2913 -0.0254 96 GLY B O 3552 N N . THR B 76 ? 0.9511 0.9772 1.3523 0.0003 -0.2894 -0.0281 97 THR B N 3553 C CA . THR B 76 ? 0.9517 0.9630 1.3397 0.0032 -0.2809 -0.0211 97 THR B CA 3554 C C . THR B 76 ? 0.9750 0.9799 1.3553 0.0054 -0.2747 -0.0353 97 THR B C 3555 O O . THR B 76 ? 0.9889 0.9882 1.3892 0.0063 -0.2733 -0.0455 97 THR B O 3556 C CB . THR B 76 ? 0.9348 0.9340 1.3459 0.0037 -0.2784 -0.0092 97 THR B CB 3557 O OG1 . THR B 76 ? 0.9697 0.9764 1.3913 0.0022 -0.2839 0.0032 97 THR B OG1 3558 C CG2 . THR B 76 ? 0.8959 0.8821 1.2893 0.0047 -0.2698 0.0008 97 THR B CG2 3559 N N . TYR B 77 ? 0.9397 0.9454 1.2900 0.0065 -0.2701 -0.0356 98 TYR B N 3560 C CA . TYR B 77 ? 0.9364 0.9394 1.2767 0.0091 -0.2638 -0.0482 98 TYR B CA 3561 C C . TYR B 77 ? 0.9411 0.9341 1.2770 0.0109 -0.2557 -0.0415 98 TYR B C 3562 O O . TYR B 77 ? 0.9717 0.9603 1.2982 0.0094 -0.2536 -0.0265 98 TYR B O 3563 C CB . TYR B 77 ? 0.9227 0.9348 1.2334 0.0089 -0.2631 -0.0541 98 TYR B CB 3564 C CG . TYR B 77 ? 0.8939 0.9162 1.2082 0.0070 -0.2694 -0.0651 98 TYR B CG 3565 C CD1 . TYR B 77 ? 0.9103 0.9425 1.2270 0.0039 -0.2774 -0.0588 98 TYR B CD1 3566 C CD2 . TYR B 77 ? 0.9164 0.9393 1.2305 0.0083 -0.2669 -0.0815 98 TYR B CD2 3567 C CE1 . TYR B 77 ? 0.9184 0.9620 1.2381 0.0011 -0.2834 -0.0687 98 TYR B CE1 3568 C CE2 . TYR B 77 ? 0.9283 0.9596 1.2438 0.0057 -0.2719 -0.0912 98 TYR B CE2 3569 C CZ . TYR B 77 ? 0.9299 0.9722 1.2485 0.0014 -0.2805 -0.0849 98 TYR B CZ 3570 O OH . TYR B 77 ? 0.9405 0.9931 1.2603 -0.0023 -0.2857 -0.0944 98 TYR B OH 3571 N N . GLN B 78 ? 0.8916 0.8815 1.2332 0.0141 -0.2504 -0.0526 99 GLN B N 3572 C CA . GLN B 78 ? 0.8160 0.7999 1.1547 0.0157 -0.2428 -0.0479 99 GLN B CA 3573 C C . GLN B 78 ? 0.7613 0.7499 1.0883 0.0193 -0.2366 -0.0614 99 GLN B C 3574 O O . GLN B 78 ? 0.8116 0.8007 1.1469 0.0221 -0.2366 -0.0760 99 GLN B O 3575 C CB . GLN B 78 ? 0.8581 0.8309 1.2269 0.0165 -0.2420 -0.0443 99 GLN B CB 3576 C CG . GLN B 78 ? 0.9286 0.8957 1.2954 0.0165 -0.2350 -0.0344 99 GLN B CG 3577 C CD . GLN B 78 ? 0.9815 0.9367 1.3770 0.0158 -0.2343 -0.0277 99 GLN B CD 3578 O OE1 . GLN B 78 ? 1.0218 0.9722 1.4414 0.0170 -0.2375 -0.0347 99 GLN B OE1 3579 N NE2 . GLN B 78 ? 0.9116 0.8617 1.3038 0.0132 -0.2296 -0.0141 99 GLN B NE2 3580 N N . CYS B 79 ? 0.7246 0.7167 1.0311 0.0191 -0.2305 -0.0560 100 CYS B N 3581 C CA . CYS B 79 ? 0.7426 0.7424 1.0361 0.0224 -0.2240 -0.0671 100 CYS B CA 3582 C C . CYS B 79 ? 0.8006 0.7987 1.1068 0.0253 -0.2177 -0.0679 100 CYS B C 3583 O O . CYS B 79 ? 0.6981 0.6925 1.0086 0.0232 -0.2159 -0.0548 100 CYS B O 3584 C CB . CYS B 79 ? 0.7120 0.7200 0.9732 0.0198 -0.2208 -0.0613 100 CYS B CB 3585 S SG . CYS B 79 ? 0.9738 0.9941 1.2168 0.0228 -0.2118 -0.0709 100 CYS B SG 3586 N N . ILE B 80 ? 0.8020 0.8026 1.1129 0.0302 -0.2137 -0.0829 101 ILE B N 3587 C CA . ILE B 80 ? 0.6855 0.6853 1.0090 0.0338 -0.2074 -0.0853 101 ILE B CA 3588 C C . ILE B 80 ? 0.7295 0.7432 1.0351 0.0370 -0.2003 -0.0931 101 ILE B C 3589 O O . ILE B 80 ? 0.8184 0.8351 1.1157 0.0404 -0.1988 -0.1067 101 ILE B O 3590 C CB . ILE B 80 ? 0.6413 0.6285 0.9905 0.0381 -0.2073 -0.0967 101 ILE B CB 3591 C CG1 . ILE B 80 ? 0.6959 0.6720 1.0632 0.0350 -0.2147 -0.0914 101 ILE B CG1 3592 C CG2 . ILE B 80 ? 0.5925 0.5768 0.9563 0.0407 -0.2010 -0.0961 101 ILE B CG2 3593 C CD1 . ILE B 80 ? 0.7275 0.6991 1.1030 0.0305 -0.2167 -0.0737 101 ILE B CD1 3594 N N . ALA B 81 ? 0.6497 0.6728 0.9496 0.0361 -0.1954 -0.0839 102 ALA B N 3595 C CA . ALA B 81 ? 0.6384 0.6786 0.9218 0.0388 -0.1886 -0.0893 102 ALA B CA 3596 C C . ALA B 81 ? 0.6272 0.6717 0.9263 0.0445 -0.1825 -0.0937 102 ALA B C 3597 O O . ALA B 81 ? 0.6513 0.6922 0.9654 0.0439 -0.1816 -0.0833 102 ALA B O 3598 C CB . ALA B 81 ? 0.6765 0.7286 0.9375 0.0332 -0.1866 -0.0752 102 ALA B CB 3599 N N . THR B 82 ? 0.6225 0.6740 0.9169 0.0505 -0.1776 -0.1085 103 THR B N 3600 C CA . THR B 82 ? 0.7040 0.7591 1.0113 0.0572 -0.1711 -0.1138 103 THR B CA 3601 C C . THR B 82 ? 0.7850 0.8637 1.0758 0.0619 -0.1639 -0.1181 103 THR B C 3602 O O . THR B 82 ? 0.8401 0.9266 1.1113 0.0618 -0.1633 -0.1256 103 THR B O 3603 C CB . THR B 82 ? 0.7157 0.7505 1.0378 0.0614 -0.1709 -0.1293 103 THR B CB 3604 O OG1 . THR B 82 ? 0.7551 0.7704 1.0958 0.0571 -0.1770 -0.1243 103 THR B OG1 3605 C CG2 . THR B 82 ? 0.6489 0.6868 0.9798 0.0676 -0.1630 -0.1340 103 THR B CG2 3606 N N . ASN B 83 ? 0.7055 0.7960 1.0051 0.0667 -0.1578 -0.1127 104 ASN B N 3607 C CA . ASN B 83 ? 0.6934 0.8110 0.9806 0.0721 -0.1503 -0.1134 104 ASN B CA 3608 C C . ASN B 83 ? 0.6643 0.7824 0.9649 0.0825 -0.1423 -0.1173 104 ASN B C 3609 O O . ASN B 83 ? 0.6633 0.7597 0.9812 0.0833 -0.1427 -0.1185 104 ASN B O 3610 C CB . ASN B 83 ? 0.7045 0.8415 0.9846 0.0662 -0.1498 -0.0952 104 ASN B CB 3611 C CG . ASN B 83 ? 0.6825 0.8450 0.9388 0.0644 -0.1468 -0.0963 104 ASN B CG 3612 O OD1 . ASN B 83 ? 0.8463 1.0070 1.0881 0.0644 -0.1475 -0.1083 104 ASN B OD1 3613 N ND2 . ASN B 83 ? 0.5203 0.7065 0.7715 0.0621 -0.1429 -0.0834 104 ASN B ND2 3614 N N . SER B 84 ? 0.6435 0.7862 0.9346 0.0901 -0.1344 -0.1186 105 SER B N 3615 C CA . SER B 84 ? 0.7384 0.8839 1.0384 0.1010 -0.1249 -0.1186 105 SER B CA 3616 C C . SER B 84 ? 0.7158 0.8660 1.0314 0.1001 -0.1234 -0.1006 105 SER B C 3617 O O . SER B 84 ? 0.7463 0.8919 1.0723 0.1077 -0.1162 -0.0982 105 SER B O 3618 C CB . SER B 84 ? 0.7652 0.9387 1.0496 0.1104 -0.1164 -0.1230 105 SER B CB 3619 O OG . SER B 84 ? 0.7293 0.9352 1.0069 0.1063 -0.1166 -0.1109 105 SER B OG 3620 N N . PHE B 85 ? 0.6390 0.7958 0.9528 0.0897 -0.1299 -0.0877 106 PHE B N 3621 C CA . PHE B 85 ? 0.5612 0.7217 0.8856 0.0866 -0.1293 -0.0698 106 PHE B CA 3622 C C . PHE B 85 ? 0.5542 0.6828 0.8942 0.0808 -0.1350 -0.0649 106 PHE B C 3623 O O . PHE B 85 ? 0.6245 0.7493 0.9750 0.0791 -0.1339 -0.0510 106 PHE B O 3624 C CB . PHE B 85 ? 0.5541 0.7382 0.8625 0.0770 -0.1319 -0.0571 106 PHE B CB 3625 C CG . PHE B 85 ? 0.6204 0.8417 0.9176 0.0818 -0.1249 -0.0571 106 PHE B CG 3626 C CD1 . PHE B 85 ? 0.6061 0.8467 0.9133 0.0899 -0.1170 -0.0494 106 PHE B CD1 3627 C CD2 . PHE B 85 ? 0.6481 0.8860 0.9247 0.0782 -0.1257 -0.0644 106 PHE B CD2 3628 C CE1 . PHE B 85 ? 0.6353 0.9139 0.9334 0.0945 -0.1105 -0.0489 106 PHE B CE1 3629 C CE2 . PHE B 85 ? 0.6715 0.9457 0.9385 0.0823 -0.1191 -0.0642 106 PHE B CE2 3630 C CZ . PHE B 85 ? 0.6584 0.9545 0.9369 0.0905 -0.1117 -0.0563 106 PHE B CZ 3631 N N . GLY B 86 ? 0.5625 0.6692 0.9038 0.0775 -0.1411 -0.0762 107 GLY B N 3632 C CA . GLY B 86 ? 0.5875 0.6666 0.9443 0.0717 -0.1469 -0.0726 107 GLY B CA 3633 C C . GLY B 86 ? 0.6245 0.6929 0.9733 0.0633 -0.1567 -0.0762 107 GLY B C 3634 O O . GLY B 86 ? 0.6651 0.7453 0.9951 0.0620 -0.1584 -0.0823 107 GLY B O 3635 N N . THR B 87 ? 0.5932 0.6397 0.9556 0.0579 -0.1624 -0.0717 108 THR B N 3636 C CA . THR B 87 ? 0.6563 0.6919 1.0122 0.0514 -0.1712 -0.0740 108 THR B CA 3637 C C . THR B 87 ? 0.6502 0.6756 1.0094 0.0439 -0.1762 -0.0568 108 THR B C 3638 O O . THR B 87 ? 0.6370 0.6541 1.0122 0.0434 -0.1740 -0.0472 108 THR B O 3639 C CB . THR B 87 ? 0.5974 0.6151 0.9649 0.0527 -0.1742 -0.0911 108 THR B CB 3640 O OG1 . THR B 87 ? 0.5880 0.5890 0.9648 0.0468 -0.1820 -0.0863 108 THR B OG1 3641 C CG2 . THR B 87 ? 0.6023 0.6124 0.9870 0.0571 -0.1678 -0.0979 108 THR B CG2 3642 N N . ILE B 88 ? 0.6356 0.6610 0.9773 0.0383 -0.1818 -0.0527 109 ILE B N 3643 C CA . ILE B 88 ? 0.6203 0.6349 0.9596 0.0315 -0.1861 -0.0366 109 ILE B CA 3644 C C . ILE B 88 ? 0.7228 0.7250 1.0624 0.0286 -0.1942 -0.0399 109 ILE B C 3645 O O . ILE B 88 ? 0.7658 0.7713 1.0979 0.0305 -0.1966 -0.0528 109 ILE B O 3646 C CB . ILE B 88 ? 0.5838 0.6099 0.8963 0.0263 -0.1837 -0.0231 109 ILE B CB 3647 C CG1 . ILE B 88 ? 0.5801 0.6183 0.8674 0.0254 -0.1844 -0.0314 109 ILE B CG1 3648 C CG2 . ILE B 88 ? 0.5263 0.5660 0.8401 0.0283 -0.1762 -0.0164 109 ILE B CG2 3649 C CD1 . ILE B 88 ? 0.5344 0.5815 0.7927 0.0189 -0.1810 -0.0188 109 ILE B CD1 3650 N N . VAL B 89 ? 0.7171 0.7058 1.0647 0.0241 -0.1979 -0.0275 110 VAL B N 3651 C CA . VAL B 89 ? 0.6546 0.6336 1.0056 0.0218 -0.2056 -0.0283 110 VAL B CA 3652 C C . VAL B 89 ? 0.6807 0.6592 1.0074 0.0161 -0.2076 -0.0144 110 VAL B C 3653 O O . VAL B 89 ? 0.6855 0.6618 1.0032 0.0122 -0.2037 0.0000 110 VAL B O 3654 C CB . VAL B 89 ? 0.6336 0.5975 1.0144 0.0209 -0.2078 -0.0256 110 VAL B CB 3655 C CG1 . VAL B 89 ? 0.7331 0.6894 1.1132 0.0161 -0.2142 -0.0150 110 VAL B CG1 3656 C CG2 . VAL B 89 ? 0.5933 0.5529 0.9944 0.0254 -0.2086 -0.0432 110 VAL B CG2 3657 N N . SER B 90 ? 0.7120 0.6920 1.0269 0.0154 -0.2129 -0.0187 111 SER B N 3658 C CA . SER B 90 ? 0.6973 0.6762 0.9863 0.0105 -0.2137 -0.0069 111 SER B CA 3659 C C . SER B 90 ? 0.6934 0.6603 0.9922 0.0070 -0.2185 0.0043 111 SER B C 3660 O O . SER B 90 ? 0.6568 0.6181 0.9836 0.0086 -0.2227 0.0013 111 SER B O 3661 C CB . SER B 90 ? 0.7475 0.7356 1.0157 0.0113 -0.2155 -0.0166 111 SER B CB 3662 O OG . SER B 90 ? 0.7697 0.7555 1.0491 0.0122 -0.2233 -0.0224 111 SER B OG 3663 N N . ARG B 91 ? 0.6427 0.6055 0.9177 0.0021 -0.2170 0.0171 112 ARG B N 3664 C CA . ARG B 91 ? 0.6994 0.6538 0.9793 -0.0011 -0.2210 0.0269 112 ARG B CA 3665 C C . ARG B 91 ? 0.8567 0.8173 1.1481 0.0025 -0.2298 0.0161 112 ARG B C 3666 O O . ARG B 91 ? 0.8715 0.8414 1.1605 0.0060 -0.2313 0.0020 112 ARG B O 3667 C CB . ARG B 91 ? 0.7125 0.6625 0.9592 -0.0069 -0.2164 0.0388 112 ARG B CB 3668 C CG . ARG B 91 ? 0.7972 0.7543 1.0215 -0.0055 -0.2186 0.0328 112 ARG B CG 3669 C CD . ARG B 91 ? 0.8924 0.8424 1.0878 -0.0112 -0.2134 0.0446 112 ARG B CD 3670 N NE . ARG B 91 ? 0.9435 0.8916 1.1099 -0.0155 -0.2034 0.0478 112 ARG B NE 3671 C CZ . ARG B 91 ? 1.0116 0.9630 1.1505 -0.0162 -0.1993 0.0450 112 ARG B CZ 3672 N NH1 . ARG B 91 ? 1.0006 0.9574 1.1361 -0.0126 -0.2046 0.0389 112 ARG B NH1 3673 N NH2 . ARG B 91 ? 1.0672 1.0172 1.1825 -0.0210 -0.1892 0.0485 112 ARG B NH2 3674 N N . GLU B 92 ? 0.9148 0.8719 1.2189 0.0011 -0.2349 0.0229 113 GLU B N 3675 C CA . GLU B 92 ? 0.9396 0.9049 1.2555 0.0035 -0.2435 0.0140 113 GLU B CA 3676 C C . GLU B 92 ? 0.9191 0.8906 1.2081 0.0022 -0.2453 0.0176 113 GLU B C 3677 O O . GLU B 92 ? 0.9120 0.8773 1.1789 -0.0011 -0.2402 0.0301 113 GLU B O 3678 C CB . GLU B 92 ? 1.0417 1.0033 1.3896 0.0032 -0.2485 0.0187 113 GLU B CB 3679 C CG . GLU B 92 ? 1.1589 1.1134 1.5357 0.0047 -0.2463 0.0133 113 GLU B CG 3680 C CD . GLU B 92 ? 1.2715 1.2220 1.6801 0.0039 -0.2503 0.0177 113 GLU B CD 3681 O OE1 . GLU B 92 ? 1.2777 1.2288 1.6845 0.0014 -0.2524 0.0304 113 GLU B OE1 3682 O OE2 . GLU B 92 ? 1.3179 1.2643 1.7528 0.0057 -0.2504 0.0085 113 GLU B OE2 3683 N N . ALA B 93 ? 0.9329 0.9158 1.2227 0.0041 -0.2516 0.0061 114 ALA B N 3684 C CA . ALA B 93 ? 0.9246 0.9150 1.1912 0.0034 -0.2538 0.0080 114 ALA B CA 3685 C C . ALA B 93 ? 0.9191 0.9218 1.2045 0.0041 -0.2638 0.0024 114 ALA B C 3686 O O . ALA B 93 ? 0.9157 0.9236 1.2209 0.0049 -0.2680 -0.0108 114 ALA B O 3687 C CB . ALA B 93 ? 0.9433 0.9382 1.1829 0.0042 -0.2492 -0.0010 114 ALA B CB 3688 N N . LYS B 94 ? 0.9871 0.9948 1.2654 0.0035 -0.2670 0.0121 115 LYS B N 3689 C CA . LYS B 94 ? 0.9975 1.0210 1.2923 0.0035 -0.2769 0.0080 115 LYS B CA 3690 C C . LYS B 94 ? 0.9355 0.9714 1.2083 0.0037 -0.2792 -0.0005 115 LYS B C 3691 O O . LYS B 94 ? 0.9773 1.0107 1.2202 0.0044 -0.2738 0.0051 115 LYS B O 3692 C CB . LYS B 94 ? 1.0979 1.1238 1.4020 0.0036 -0.2796 0.0236 115 LYS B CB 3693 C CG . LYS B 94 ? 1.2197 1.2431 1.5609 0.0031 -0.2830 0.0265 115 LYS B CG 3694 C CD . LYS B 94 ? 1.3022 1.3218 1.6476 0.0035 -0.2810 0.0449 115 LYS B CD 3695 C CE . LYS B 94 ? 1.3206 1.3327 1.7011 0.0030 -0.2813 0.0484 115 LYS B CE 3696 N NZ . LYS B 94 ? 1.3116 1.3137 1.6910 0.0026 -0.2751 0.0666 115 LYS B NZ 3697 N N . LEU B 95 ? 0.8581 0.9060 1.1452 0.0026 -0.2860 -0.0144 116 LEU B N 3698 C CA . LEU B 95 ? 0.9179 0.9803 1.1893 0.0020 -0.2898 -0.0218 116 LEU B CA 3699 C C . LEU B 95 ? 0.9353 1.0153 1.2226 0.0007 -0.2995 -0.0167 116 LEU B C 3700 O O . LEU B 95 ? 0.8503 0.9368 1.1675 -0.0019 -0.3059 -0.0203 116 LEU B O 3701 C CB . LEU B 95 ? 0.9248 0.9896 1.1987 0.0007 -0.2900 -0.0404 116 LEU B CB 3702 C CG . LEU B 95 ? 0.9003 0.9809 1.1642 -0.0011 -0.2951 -0.0497 116 LEU B CG 3703 C CD1 . LEU B 95 ? 0.9545 1.0365 1.1852 0.0014 -0.2907 -0.0442 116 LEU B CD1 3704 C CD2 . LEU B 95 ? 0.8283 0.9074 1.0949 -0.0024 -0.2934 -0.0674 116 LEU B CD2 3705 N N . GLN B 96 ? 1.0170 1.1053 1.2843 0.0026 -0.2999 -0.0081 117 GLN B N 3706 C CA . GLN B 96 ? 1.0720 1.1811 1.3516 0.0023 -0.3088 -0.0023 117 GLN B CA 3707 C C . GLN B 96 ? 1.1169 1.2421 1.3767 0.0025 -0.3119 -0.0089 117 GLN B C 3708 O O . GLN B 96 ? 1.1553 1.2721 1.3874 0.0039 -0.3051 -0.0136 117 GLN B O 3709 C CB . GLN B 96 ? 1.1631 1.2684 1.4382 0.0062 -0.3055 0.0170 117 GLN B CB 3710 C CG . GLN B 96 ? 1.2501 1.3363 1.5395 0.0062 -0.3003 0.0258 117 GLN B CG 3711 C CD . GLN B 96 ? 1.3117 1.3931 1.5935 0.0094 -0.2954 0.0447 117 GLN B CD 3712 O OE1 . GLN B 96 ? 1.3573 1.4564 1.6460 0.0118 -0.3007 0.0523 117 GLN B OE1 3713 N NE2 . GLN B 96 ? 1.2984 1.3571 1.5652 0.0091 -0.2846 0.0524 117 GLN B NE2 3714 N N . PHE B 97 ? 1.0858 1.2351 1.3600 0.0008 -0.3218 -0.0089 118 PHE B N 3715 C CA . PHE B 97 ? 1.1418 1.3090 1.3996 0.0005 -0.3256 -0.0154 118 PHE B CA 3716 C C . PHE B 97 ? 1.1017 1.2861 1.3517 0.0054 -0.3282 -0.0016 118 PHE B C 3717 O O . PHE B 97 ? 1.1027 1.3047 1.3759 0.0051 -0.3356 0.0061 118 PHE B O 3718 C CB . PHE B 97 ? 1.2377 1.4212 1.5156 -0.0067 -0.3346 -0.0304 118 PHE B CB 3719 C CG . PHE B 97 ? 1.2969 1.4627 1.5776 -0.0101 -0.3300 -0.0449 118 PHE B CG 3720 C CD1 . PHE B 97 ? 1.3623 1.5247 1.6224 -0.0108 -0.3263 -0.0575 118 PHE B CD1 3721 C CD2 . PHE B 97 ? 1.2806 1.4327 1.5841 -0.0115 -0.3283 -0.0455 118 PHE B CD2 3722 C CE1 . PHE B 97 ? 1.3740 1.5206 1.6356 -0.0124 -0.3208 -0.0700 118 PHE B CE1 3723 C CE2 . PHE B 97 ? 1.2904 1.4263 1.5950 -0.0131 -0.3229 -0.0586 118 PHE B CE2 3724 C CZ . PHE B 97 ? 1.3461 1.4797 1.6295 -0.0133 -0.3191 -0.0707 118 PHE B CZ 3725 N N . ALA B 98 ? 1.0704 1.2494 1.2872 0.0102 -0.3209 0.0014 119 ALA B N 3726 C CA . ALA B 98 ? 1.0866 1.2803 1.2904 0.0164 -0.3208 0.0133 119 ALA B CA 3727 C C . ALA B 98 ? 1.1088 1.3306 1.3108 0.0154 -0.3295 0.0053 119 ALA B C 3728 O O . ALA B 98 ? 1.1224 1.3452 1.3213 0.0106 -0.3315 -0.0096 119 ALA B O 3729 C CB . ALA B 98 ? 1.0873 1.2585 1.2555 0.0218 -0.3063 0.0205 119 ALA B CB 3730 N N . TYR B 99 ? 1.1640 1.1334 1.3960 0.0891 -0.1890 -0.1593 120 TYR B N 3731 C CA . TYR B 99 ? 1.1404 1.1109 1.3775 0.0901 -0.1907 -0.1621 120 TYR B CA 3732 C C . TYR B 99 ? 1.1524 1.1363 1.3762 0.0964 -0.1916 -0.1556 120 TYR B C 3733 O O . TYR B 99 ? 1.1340 1.1306 1.3516 0.1038 -0.1881 -0.1434 120 TYR B O 3734 C CB . TYR B 99 ? 1.1113 1.0807 1.3835 0.0837 -0.1934 -0.1612 120 TYR B CB 3735 C CG . TYR B 99 ? 1.1484 1.1343 1.4412 0.0777 -0.1975 -0.1495 120 TYR B CG 3736 C CD1 . TYR B 99 ? 1.1628 1.1327 1.4696 0.0750 -0.1963 -0.1511 120 TYR B CD1 3737 C CD2 . TYR B 99 ? 1.2189 1.2545 1.5214 0.0750 -0.2023 -0.1290 120 TYR B CD2 3738 C CE1 . TYR B 99 ? 1.1826 1.1847 1.5136 0.0726 -0.1982 -0.1314 120 TYR B CE1 3739 C CE2 . TYR B 99 ? 1.2431 1.3110 1.5704 0.0735 -0.2042 -0.1090 120 TYR B CE2 3740 C CZ . TYR B 99 ? 1.2323 1.2828 1.5740 0.0734 -0.2016 -0.1100 120 TYR B CZ 3741 O OH . TYR B 99 ? 1.2204 1.3019 1.5872 0.0737 -0.2021 -0.0894 120 TYR B OH 3742 N N . LEU B 100 ? 1.1349 1.1439 1.3615 0.0969 -0.1938 -0.1481 121 LEU B N 3743 C CA . LEU B 100 ? 1.0828 1.1353 1.3056 0.1052 -0.1936 -0.1268 121 LEU B CA 3744 C C . LEU B 100 ? 1.0542 1.1392 1.2910 0.0945 -0.2008 -0.1195 121 LEU B C 3745 O O . LEU B 100 ? 0.8749 0.9479 1.0977 0.0915 -0.2010 -0.1313 121 LEU B O 3746 C CB . LEU B 100 ? 1.0421 1.0830 1.2265 0.1192 -0.1867 -0.1317 121 LEU B CB 3747 C CG . LEU B 100 ? 1.0256 1.1064 1.2023 0.1314 -0.1838 -0.1112 121 LEU B CG 3748 C CD1 . LEU B 100 ? 0.8601 0.9725 1.0546 0.1397 -0.1805 -0.0864 121 LEU B CD1 3749 C CD2 . LEU B 100 ? 0.8721 0.9347 1.0082 0.1436 -0.1763 -0.1201 121 LEU B CD2 3750 N N . GLU B 101 ? 1.0356 1.1621 1.2993 0.0875 -0.2064 -0.0997 122 GLU B N 3751 C CA . GLU B 101 ? 1.0684 1.2304 1.3443 0.0728 -0.2147 -0.0916 122 GLU B CA 3752 C C . GLU B 101 ? 1.0349 1.2265 1.2946 0.0830 -0.2137 -0.0798 122 GLU B C 3753 O O . GLU B 101 ? 0.9685 1.1593 1.2114 0.1022 -0.2061 -0.0735 122 GLU B O 3754 C CB . GLU B 101 ? 1.1255 1.3235 1.4352 0.0614 -0.2210 -0.0741 122 GLU B CB 3755 C CG . GLU B 101 ? 1.1765 1.3503 1.5053 0.0514 -0.2216 -0.0828 122 GLU B CG 3756 C CD . GLU B 101 ? 1.2024 1.4138 1.5640 0.0414 -0.2270 -0.0643 122 GLU B CD 3757 O OE1 . GLU B 101 ? 1.1829 1.4392 1.5523 0.0424 -0.2306 -0.0446 122 GLU B OE1 3758 O OE2 . GLU B 101 ? 1.2157 1.4115 1.5952 0.0331 -0.2273 -0.0689 122 GLU B OE2 3759 N N . ASN B 102 ? 1.0873 1.3042 1.3505 0.0696 -0.2206 -0.0765 123 ASN B N 3760 C CA . ASN B 102 ? 1.0506 1.3024 1.3036 0.0773 -0.2210 -0.0623 123 ASN B CA 3761 C C . ASN B 102 ? 1.0012 1.3014 1.2773 0.0808 -0.2237 -0.0356 123 ASN B C 3762 O O . ASN B 102 ? 0.9542 1.2633 1.2559 0.0721 -0.2272 -0.0293 123 ASN B O 3763 C CB . ASN B 102 ? 1.0544 1.3163 1.3028 0.0606 -0.2273 -0.0683 123 ASN B CB 3764 C CG . ASN B 102 ? 1.0634 1.2779 1.2908 0.0579 -0.2231 -0.0934 123 ASN B CG 3765 O OD1 . ASN B 102 ? 1.1160 1.3188 1.3192 0.0685 -0.2182 -0.0999 123 ASN B OD1 3766 N ND2 . ASN B 102 ? 1.0109 1.1978 1.2481 0.0449 -0.2237 -0.1066 123 ASN B ND2 3767 N N . PHE B 103 ? 1.0185 1.3492 1.2860 0.0941 -0.2210 -0.0195 124 PHE B N 3768 C CA . PHE B 103 ? 1.0608 1.4406 1.3503 0.0977 -0.2232 0.0073 124 PHE B CA 3769 C C . PHE B 103 ? 1.1362 1.5488 1.4494 0.0738 -0.2356 0.0132 124 PHE B C 3770 O O . PHE B 103 ? 1.1089 1.5168 1.4138 0.0586 -0.2411 0.0013 124 PHE B O 3771 C CB . PHE B 103 ? 1.0215 1.4257 1.2946 0.1165 -0.2172 0.0221 124 PHE B CB 3772 C CG . PHE B 103 ? 0.9496 1.3272 1.1997 0.1402 -0.2035 0.0203 124 PHE B CG 3773 C CD1 . PHE B 103 ? 0.9135 1.2476 1.1334 0.1457 -0.1977 -0.0015 124 PHE B CD1 3774 C CD2 . PHE B 103 ? 0.9176 1.3133 1.1750 0.1564 -0.1959 0.0402 124 PHE B CD2 3775 C CE1 . PHE B 103 ? 0.9576 1.2675 1.1539 0.1655 -0.1849 -0.0038 124 PHE B CE1 3776 C CE2 . PHE B 103 ? 0.9323 1.3030 1.1659 0.1764 -0.1824 0.0383 124 PHE B CE2 3777 C CZ . PHE B 103 ? 0.9661 1.2942 1.1684 0.1804 -0.1771 0.0161 124 PHE B CZ 3778 N N . LYS B 104 ? 1.2559 1.7012 1.5980 0.0701 -0.2391 0.0316 125 LYS B N 3779 C CA . LYS B 104 ? 1.3934 1.8737 1.7588 0.0474 -0.2504 0.0393 125 LYS B CA 3780 C C . LYS B 104 ? 1.4392 1.9552 1.7970 0.0453 -0.2549 0.0496 125 LYS B C 3781 O O . LYS B 104 ? 1.4702 1.9810 1.8184 0.0290 -0.2604 0.0375 125 LYS B O 3782 C CB . LYS B 104 ? 1.4426 1.9539 1.8397 0.0474 -0.2519 0.0596 125 LYS B CB 3783 C CG . LYS B 104 ? 1.4629 1.9558 1.8800 0.0299 -0.2556 0.0497 125 LYS B CG 3784 C CD . LYS B 104 ? 1.4805 1.9927 1.9109 0.0015 -0.2664 0.0472 125 LYS B CD 3785 C CE . LYS B 104 ? 1.4605 1.9709 1.9181 -0.0145 -0.2697 0.0466 125 LYS B CE 3786 N NZ . LYS B 104 ? 1.4535 1.9891 1.9250 -0.0413 -0.2793 0.0485 125 LYS B NZ 3787 N N . THR B 105 ? 1.4439 1.9956 1.8058 0.0622 -0.2516 0.0721 126 THR B N 3788 C CA . THR B 105 ? 1.4898 2.0814 1.8486 0.0612 -0.2560 0.0853 126 THR B CA 3789 C C . THR B 105 ? 1.4623 2.0337 1.7881 0.0711 -0.2510 0.0737 126 THR B C 3790 O O . THR B 105 ? 1.4505 1.9802 1.7551 0.0836 -0.2424 0.0587 126 THR B O 3791 C CB . THR B 105 ? 1.5231 2.1596 1.8975 0.0773 -0.2530 0.1142 126 THR B CB 3792 O OG1 . THR B 105 ? 1.5520 2.2301 1.9269 0.0734 -0.2587 0.1274 126 THR B OG1 3793 C CG2 . THR B 105 ? 1.5086 2.1261 1.8645 0.1060 -0.2390 0.1175 126 THR B CG2 3794 N N . ARG B 106 ? 1.4181 2.0198 1.7398 0.0650 -0.2564 0.0807 127 ARG B N 3795 C CA . ARG B 106 ? 1.3628 1.9520 1.6549 0.0744 -0.2518 0.0724 127 ARG B CA 3796 C C . ARG B 106 ? 1.3075 1.9410 1.6000 0.0896 -0.2496 0.0961 127 ARG B C 3797 O O . ARG B 106 ? 1.2706 1.9035 1.5413 0.0981 -0.2460 0.0939 127 ARG B O 3798 C CB . ARG B 106 ? 1.3737 1.9509 1.6566 0.0516 -0.2593 0.0552 127 ARG B CB 3799 C CG . ARG B 106 ? 1.3638 1.9045 1.6522 0.0331 -0.2624 0.0352 127 ARG B CG 3800 C CD . ARG B 106 ? 1.3301 1.8498 1.6038 0.0133 -0.2663 0.0158 127 ARG B CD 3801 N NE . ARG B 106 ? 1.2573 1.7598 1.5444 -0.0092 -0.2711 0.0046 127 ARG B NE 3802 C CZ . ARG B 106 ? 1.1865 1.6551 1.4609 -0.0247 -0.2710 -0.0162 127 ARG B CZ 3803 N NH1 . ARG B 106 ? 1.1664 1.6142 1.4149 -0.0204 -0.2667 -0.0283 127 ARG B NH1 3804 N NH2 . ARG B 106 ? 1.1700 1.6245 1.4571 -0.0438 -0.2740 -0.0245 127 ARG B NH2 3805 N N . THR B 107 ? 1.3115 1.9827 1.6293 0.0930 -0.2512 0.1188 128 THR B N 3806 C CA . THR B 107 ? 1.3112 2.0267 1.6333 0.1080 -0.2486 0.1437 128 THR B CA 3807 C C . THR B 107 ? 1.3548 2.0832 1.6924 0.1255 -0.2411 0.1623 128 THR B C 3808 O O . THR B 107 ? 1.3756 2.1074 1.7367 0.1169 -0.2447 0.1657 128 THR B O 3809 C CB . THR B 107 ? 1.2194 1.9840 1.5606 0.0896 -0.2613 0.1576 128 THR B CB 3810 O OG1 . THR B 107 ? 1.1505 1.9606 1.5040 0.1043 -0.2587 0.1848 128 THR B OG1 3811 C CG2 . THR B 107 ? 1.2093 1.9802 1.5770 0.0654 -0.2715 0.1554 128 THR B CG2 3812 N N . ARG B 108 ? 1.3419 2.0772 1.6660 0.1499 -0.2298 0.1741 129 ARG B N 3813 C CA . ARG B 108 ? 1.3225 2.0714 1.6590 0.1676 -0.2211 0.1933 129 ARG B CA 3814 C C . ARG B 108 ? 1.4215 2.2169 1.7624 0.1816 -0.2179 0.2187 129 ARG B C 3815 O O . ARG B 108 ? 1.4268 2.2315 1.7508 0.1859 -0.2172 0.2188 129 ARG B O 3816 C CB . ARG B 108 ? 1.2481 1.9507 1.5624 0.1862 -0.2067 0.1818 129 ARG B CB 3817 C CG . ARG B 108 ? 1.1845 1.8481 1.5041 0.1760 -0.2084 0.1640 129 ARG B CG 3818 C CD . ARG B 108 ? 1.1717 1.7986 1.4745 0.1957 -0.1936 0.1593 129 ARG B CD 3819 N NE . ARG B 108 ? 1.2216 1.8068 1.5259 0.1860 -0.1950 0.1397 129 ARG B NE 3820 C CZ . ARG B 108 ? 1.2723 1.8195 1.5624 0.1984 -0.1839 0.1314 129 ARG B CZ 3821 N NH1 . ARG B 108 ? 1.2820 1.8271 1.5542 0.2207 -0.1700 0.1407 129 ARG B NH1 3822 N NH2 . ARG B 108 ? 1.2995 1.8106 1.5928 0.1880 -0.1864 0.1136 129 ARG B NH2 3823 N N . SER B 109 ? 0.8516 1.7706 1.4050 0.1084 -0.2014 0.0453 130 SER B N 3824 C CA . SER B 109 ? 0.8794 1.8247 1.4517 0.1176 -0.2042 0.0474 130 SER B CA 3825 C C . SER B 109 ? 0.8698 1.8041 1.4475 0.1326 -0.2069 0.0437 130 SER B C 3826 O O . SER B 109 ? 0.9219 1.8340 1.4911 0.1388 -0.2043 0.0369 130 SER B O 3827 C CB . SER B 109 ? 0.9028 1.8738 1.4850 0.1219 -0.1983 0.0449 130 SER B CB 3828 O OG . SER B 109 ? 0.9305 1.9240 1.5317 0.1340 -0.1999 0.0449 130 SER B OG 3829 N N . THR B 110 ? 0.8555 1.8060 1.4480 0.1383 -0.2119 0.0484 131 THR B N 3830 C CA . THR B 110 ? 0.7967 1.7374 1.3957 0.1526 -0.2141 0.0459 131 THR B CA 3831 C C . THR B 110 ? 0.7455 1.7033 1.3590 0.1675 -0.2092 0.0400 131 THR B C 3832 O O . THR B 110 ? 0.7327 1.7193 1.3634 0.1716 -0.2099 0.0433 131 THR B O 3833 C CB . THR B 110 ? 0.7485 1.6948 1.3548 0.1518 -0.2222 0.0546 131 THR B CB 3834 O OG1 . THR B 110 ? 0.7277 1.6816 1.3496 0.1679 -0.2230 0.0536 131 THR B OG1 3835 C CG2 . THR B 110 ? 0.7729 1.7479 1.3865 0.1408 -0.2251 0.0626 131 THR B CG2 3836 N N . VAL B 111 ? 0.6657 1.6064 1.2724 0.1750 -0.2042 0.0309 132 VAL B N 3837 C CA . VAL B 111 ? 0.6350 1.5884 1.2523 0.1882 -0.1983 0.0236 132 VAL B CA 3838 C C . VAL B 111 ? 0.7568 1.7157 1.3900 0.2020 -0.2004 0.0238 132 VAL B C 3839 O O . VAL B 111 ? 0.7999 1.7465 1.4330 0.2023 -0.2062 0.0287 132 VAL B O 3840 C CB . VAL B 111 ? 0.5574 1.4885 1.1610 0.1918 -0.1929 0.0136 132 VAL B CB 3841 C CG1 . VAL B 111 ? 0.5922 1.5375 1.2053 0.2038 -0.1864 0.0057 132 VAL B CG1 3842 C CG2 . VAL B 111 ? 0.4175 1.3408 1.0051 0.1790 -0.1908 0.0140 132 VAL B CG2 3843 N N . SER B 112 ? 0.8245 1.8012 1.4713 0.2131 -0.1952 0.0186 133 SER B N 3844 C CA . SER B 112 ? 0.8741 1.8557 1.5369 0.2273 -0.1955 0.0178 133 SER B CA 3845 C C . SER B 112 ? 0.8703 1.8616 1.5414 0.2391 -0.1872 0.0079 133 SER B C 3846 O O . SER B 112 ? 0.8896 1.8951 1.5591 0.2358 -0.1820 0.0043 133 SER B O 3847 C CB . SER B 112 ? 0.9515 1.9599 1.6319 0.2270 -0.2007 0.0279 133 SER B CB 3848 O OG . SER B 112 ? 1.0037 2.0434 1.6940 0.2240 -0.1972 0.0283 133 SER B OG 3849 N N . VAL B 113 ? 0.8561 1.8396 1.5357 0.2522 -0.1856 0.0038 134 VAL B N 3850 C CA . VAL B 113 ? 0.8417 1.8289 1.5266 0.2631 -0.1771 -0.0071 134 VAL B CA 3851 C C . VAL B 113 ? 0.8353 1.8220 1.5362 0.2778 -0.1757 -0.0087 134 VAL B C 3852 O O . VAL B 113 ? 0.7716 1.7445 1.4739 0.2802 -0.1812 -0.0030 134 VAL B O 3853 C CB . VAL B 113 ? 1.1308 2.0921 1.7956 0.2610 -0.1733 -0.0170 134 VAL B CB 3854 C CG1 . VAL B 113 ? 1.1471 2.0962 1.8148 0.2736 -0.1674 -0.0276 134 VAL B CG1 3855 C CG2 . VAL B 113 ? 1.1000 2.0736 1.7567 0.2534 -0.1690 -0.0200 134 VAL B CG2 3856 N N . ARG B 114 ? 0.9043 1.9055 1.6165 0.2874 -0.1679 -0.0165 135 ARG B N 3857 C CA . ARG B 114 ? 0.9751 1.9744 1.7020 0.3020 -0.1644 -0.0198 135 ARG B CA 3858 C C . ARG B 114 ? 1.0445 2.0085 1.7581 0.3062 -0.1625 -0.0278 135 ARG B C 3859 O O . ARG B 114 ? 1.0521 2.0021 1.7496 0.3021 -0.1589 -0.0367 135 ARG B O 3860 C CB . ARG B 114 ? 0.9489 1.9722 1.6898 0.3098 -0.1553 -0.0276 135 ARG B CB 3861 C CG . ARG B 114 ? 0.9617 2.0223 1.7219 0.3092 -0.1561 -0.0203 135 ARG B CG 3862 C CD . ARG B 114 ? 1.0035 2.0854 1.7743 0.3153 -0.1459 -0.0295 135 ARG B CD 3863 N NE . ARG B 114 ? 1.0778 2.1933 1.8736 0.3205 -0.1453 -0.0240 135 ARG B NE 3864 C CZ . ARG B 114 ? 1.1330 2.2707 1.9428 0.3270 -0.1364 -0.0308 135 ARG B CZ 3865 N NH1 . ARG B 114 ? 1.1629 2.2922 1.9628 0.3287 -0.1275 -0.0433 135 ARG B NH1 3866 N NH2 . ARG B 114 ? 1.1019 2.2708 1.9356 0.3315 -0.1362 -0.0254 135 ARG B NH2 3867 N N . ARG B 115 ? 1.1053 2.0552 1.8256 0.3142 -0.1647 -0.0246 136 ARG B N 3868 C CA . ARG B 115 ? 1.1559 2.0715 1.8640 0.3177 -0.1626 -0.0320 136 ARG B CA 3869 C C . ARG B 115 ? 1.1075 2.0204 1.8155 0.3250 -0.1523 -0.0467 136 ARG B C 3870 O O . ARG B 115 ? 1.1135 2.0441 1.8382 0.3344 -0.1462 -0.0497 136 ARG B O 3871 C CB . ARG B 115 ? 1.2995 2.2017 2.0159 0.3255 -0.1662 -0.0250 136 ARG B CB 3872 C CG . ARG B 115 ? 1.4375 2.3013 2.1365 0.3237 -0.1672 -0.0288 136 ARG B CG 3873 C CD . ARG B 115 ? 1.5611 2.4079 2.2681 0.3357 -0.1644 -0.0296 136 ARG B CD 3874 N NE . ARG B 115 ? 1.6426 2.4543 2.3325 0.3344 -0.1615 -0.0388 136 ARG B NE 3875 C CZ . ARG B 115 ? 1.6872 2.4756 2.3781 0.3424 -0.1584 -0.0411 136 ARG B CZ 3876 N NH1 . ARG B 115 ? 1.7113 2.5073 2.4198 0.3529 -0.1578 -0.0343 136 ARG B NH1 3877 N NH2 . ARG B 115 ? 1.6786 2.4363 2.3530 0.3395 -0.1558 -0.0502 136 ARG B NH2 3878 N N . GLY B 116 ? 1.0764 1.9673 1.7656 0.3203 -0.1499 -0.0561 137 GLY B N 3879 C CA . GLY B 116 ? 1.0195 1.9062 1.7054 0.3254 -0.1405 -0.0706 137 GLY B CA 3880 C C . GLY B 116 ? 0.9708 1.8762 1.6504 0.3191 -0.1371 -0.0757 137 GLY B C 3881 O O . GLY B 116 ? 0.9799 1.8895 1.6586 0.3228 -0.1290 -0.0871 137 GLY B O 3882 N N . GLN B 117 ? 0.9346 1.8508 1.6092 0.3090 -0.1431 -0.0670 138 GLN B N 3883 C CA . GLN B 117 ? 0.9364 1.8699 1.6043 0.3022 -0.1403 -0.0699 138 GLN B CA 3884 C C . GLN B 117 ? 0.8489 1.7628 1.4944 0.2923 -0.1431 -0.0722 138 GLN B C 3885 O O . GLN B 117 ? 0.7894 1.6787 1.4259 0.2896 -0.1479 -0.0704 138 GLN B O 3886 C CB . GLN B 117 ? 1.0365 1.9978 1.7148 0.2975 -0.1438 -0.0588 138 GLN B CB 3887 C CG . GLN B 117 ? 1.1293 2.1111 1.8031 0.2915 -0.1396 -0.0612 138 GLN B CG 3888 C CD . GLN B 117 ? 1.2038 2.2057 1.8816 0.2826 -0.1444 -0.0497 138 GLN B CD 3889 O OE1 . GLN B 117 ? 1.2288 2.2286 1.9110 0.2797 -0.1516 -0.0399 138 GLN B OE1 3890 N NE2 . GLN B 117 ? 1.2213 2.2429 1.8970 0.2777 -0.1402 -0.0509 138 GLN B NE2 3891 N N . GLY B 118 ? 0.8012 1.7264 1.4381 0.2871 -0.1397 -0.0761 139 GLY B N 3892 C CA . GLY B 118 ? 0.7450 1.6547 1.3618 0.2780 -0.1420 -0.0778 139 GLY B CA 3893 C C . GLY B 118 ? 0.6819 1.5970 1.2939 0.2671 -0.1481 -0.0661 139 GLY B C 3894 O O . GLY B 118 ? 0.6131 1.5520 1.2338 0.2648 -0.1476 -0.0599 139 GLY B O 3895 N N . MET B 119 ? 0.7032 1.5960 1.3013 0.2599 -0.1531 -0.0637 140 MET B N 3896 C CA . MET B 119 ? 0.6629 1.5568 1.2544 0.2485 -0.1583 -0.0536 140 MET B CA 3897 C C . MET B 119 ? 0.7021 1.5818 1.2746 0.2405 -0.1583 -0.0561 140 MET B C 3898 O O . MET B 119 ? 0.7283 1.5934 1.2916 0.2432 -0.1560 -0.0653 140 MET B O 3899 C CB . MET B 119 ? 0.5697 1.4514 1.1643 0.2458 -0.1654 -0.0450 140 MET B CB 3900 C CG . MET B 119 ? 0.5094 1.4136 1.1179 0.2439 -0.1685 -0.0345 140 MET B CG 3901 S SD . MET B 119 ? 2.1119 3.0349 2.7148 0.2316 -0.1681 -0.0281 140 MET B SD 3902 C CE . MET B 119 ? 1.0329 1.9279 1.6166 0.2192 -0.1735 -0.0239 140 MET B CE 3903 N N . VAL B 120 ? 0.6909 1.5754 1.2577 0.2304 -0.1608 -0.0478 141 VAL B N 3904 C CA . VAL B 120 ? 0.7394 1.6098 1.2891 0.2222 -0.1611 -0.0482 141 VAL B CA 3905 C C . VAL B 120 ? 0.7326 1.5986 1.2783 0.2110 -0.1660 -0.0376 141 VAL B C 3906 O O . VAL B 120 ? 0.6871 1.5715 1.2377 0.2060 -0.1658 -0.0304 141 VAL B O 3907 C CB . VAL B 120 ? 0.7836 1.6684 1.3275 0.2220 -0.1554 -0.0518 141 VAL B CB 3908 C CG1 . VAL B 120 ? 0.8760 1.7897 1.4324 0.2230 -0.1526 -0.0475 141 VAL B CG1 3909 C CG2 . VAL B 120 ? 0.7305 1.6047 1.2588 0.2123 -0.1563 -0.0481 141 VAL B CG2 3910 N N . LEU B 121 ? 0.7486 1.5901 1.2853 0.2065 -0.1700 -0.0369 142 LEU B N 3911 C CA . LEU B 121 ? 0.7612 1.5956 1.2927 0.1951 -0.1743 -0.0277 142 LEU B CA 3912 C C . LEU B 121 ? 0.7540 1.5801 1.2711 0.1868 -0.1724 -0.0273 142 LEU B C 3913 O O . LEU B 121 ? 0.7849 1.5923 1.2916 0.1872 -0.1719 -0.0331 142 LEU B O 3914 C CB . LEU B 121 ? 0.8230 1.6356 1.3528 0.1938 -0.1795 -0.0265 142 LEU B CB 3915 C CG . LEU B 121 ? 0.9078 1.7291 1.4514 0.1979 -0.1832 -0.0213 142 LEU B CG 3916 C CD1 . LEU B 121 ? 0.9539 1.7776 1.5071 0.2113 -0.1807 -0.0287 142 LEU B CD1 3917 C CD2 . LEU B 121 ? 0.9129 1.7144 1.4514 0.1913 -0.1891 -0.0160 142 LEU B CD2 3918 N N . LEU B 122 ? 0.7277 1.5678 1.2446 0.1794 -0.1712 -0.0203 143 LEU B N 3919 C CA . LEU B 122 ? 0.6741 1.5079 1.1782 0.1719 -0.1686 -0.0186 143 LEU B CA 3920 C C . LEU B 122 ? 0.6341 1.4445 1.1286 0.1626 -0.1719 -0.0153 143 LEU B C 3921 O O . LEU B 122 ? 0.6017 1.4110 1.0990 0.1554 -0.1756 -0.0086 143 LEU B O 3922 C CB . LEU B 122 ? 0.6900 1.5452 1.1973 0.1662 -0.1658 -0.0117 143 LEU B CB 3923 C CG . LEU B 122 ? 0.7088 1.5899 1.2272 0.1743 -0.1623 -0.0142 143 LEU B CG 3924 C CD1 . LEU B 122 ? 0.7151 1.6182 1.2447 0.1691 -0.1629 -0.0065 143 LEU B CD1 3925 C CD2 . LEU B 122 ? 0.6963 1.5826 1.2066 0.1766 -0.1566 -0.0180 143 LEU B CD2 3926 N N . CYS B 123 ? 0.6459 1.4384 1.1292 0.1626 -0.1707 -0.0203 144 CYS B N 3927 C CA . CYS B 123 ? 0.6575 1.4278 1.1313 0.1536 -0.1727 -0.0178 144 CYS B CA 3928 C C . CYS B 123 ? 0.6671 1.4419 1.1360 0.1434 -0.1703 -0.0101 144 CYS B C 3929 O O . CYS B 123 ? 0.6177 1.3884 1.0861 0.1338 -0.1725 -0.0036 144 CYS B O 3930 C CB . CYS B 123 ? 0.6697 1.4220 1.1344 0.1572 -0.1717 -0.0257 144 CYS B CB 3931 S SG . CYS B 123 ? 1.0936 1.8166 1.5488 0.1482 -0.1745 -0.0253 144 CYS B SG 3932 N N . GLY B 124 ? 0.6986 1.4817 1.1633 0.1453 -0.1656 -0.0106 145 GLY B N 3933 C CA . GLY B 124 ? 0.7180 1.5048 1.1776 0.1364 -0.1623 -0.0034 145 GLY B CA 3934 C C . GLY B 124 ? 0.7349 1.4989 1.1851 0.1274 -0.1627 -0.0010 145 GLY B C 3935 O O . GLY B 124 ? 0.7733 1.5325 1.2242 0.1178 -0.1646 0.0042 145 GLY B O 3936 N N . PRO B 125 ? 0.7335 1.4843 1.1753 0.1302 -0.1608 -0.0050 146 PRO B N 3937 C CA . PRO B 125 ? 0.7073 1.4356 1.1411 0.1230 -0.1608 -0.0040 146 PRO B CA 3938 C C . PRO B 125 ? 0.6566 1.3840 1.0866 0.1121 -0.1573 0.0045 146 PRO B C 3939 O O . PRO B 125 ? 0.5623 1.3057 0.9935 0.1115 -0.1538 0.0090 146 PRO B O 3940 C CB . PRO B 125 ? 0.7162 1.4383 1.1437 0.1304 -0.1587 -0.0097 146 PRO B CB 3941 C CG . PRO B 125 ? 0.7483 1.4862 1.1805 0.1413 -0.1590 -0.0156 146 PRO B CG 3942 C CD . PRO B 125 ? 0.7451 1.5033 1.1848 0.1403 -0.1584 -0.0106 146 PRO B CD 3943 N N . PRO B 126 ? 0.6771 1.3855 1.1024 0.1031 -0.1578 0.0063 147 PRO B N 3944 C CA . PRO B 126 ? 0.6879 1.3907 1.1085 0.0921 -0.1536 0.0132 147 PRO B CA 3945 C C . PRO B 126 ? 0.7424 1.4380 1.1560 0.0953 -0.1488 0.0135 147 PRO B C 3946 O O . PRO B 126 ? 0.7540 1.4451 1.1659 0.1042 -0.1498 0.0076 147 PRO B O 3947 C CB . PRO B 126 ? 0.6653 1.3484 1.0832 0.0828 -0.1562 0.0130 147 PRO B CB 3948 C CG . PRO B 126 ? 0.6809 1.3638 1.1036 0.0882 -0.1622 0.0079 147 PRO B CG 3949 C CD . PRO B 126 ? 0.6928 1.3843 1.1177 0.1018 -0.1623 0.0020 147 PRO B CD 3950 N N . PRO B 127 ? 0.7976 1.4926 1.2076 0.0880 -0.1435 0.0204 148 PRO B N 3951 C CA . PRO B 127 ? 0.7845 1.4724 1.1880 0.0912 -0.1387 0.0222 148 PRO B CA 3952 C C . PRO B 127 ? 0.7657 1.4334 1.1661 0.0934 -0.1402 0.0171 148 PRO B C 3953 O O . PRO B 127 ? 0.7816 1.4357 1.1826 0.0868 -0.1426 0.0151 148 PRO B O 3954 C CB . PRO B 127 ? 0.8009 1.4850 1.2018 0.0797 -0.1330 0.0303 148 PRO B CB 3955 C CG . PRO B 127 ? 0.8208 1.5201 1.2271 0.0729 -0.1345 0.0328 148 PRO B CG 3956 C CD . PRO B 127 ? 0.7923 1.4921 1.2037 0.0757 -0.1416 0.0269 148 PRO B CD 3957 N N . HIS B 128 ? 0.7762 1.4429 1.1730 0.1023 -0.1389 0.0149 149 HIS B N 3958 C CA . HIS B 128 ? 0.7970 1.4483 1.1922 0.1058 -0.1408 0.0088 149 HIS B CA 3959 C C . HIS B 128 ? 0.7830 1.4336 1.1733 0.1130 -0.1377 0.0098 149 HIS B C 3960 O O . HIS B 128 ? 0.8138 1.4760 1.2012 0.1159 -0.1342 0.0152 149 HIS B O 3961 C CB . HIS B 128 ? 0.7854 1.4407 1.1842 0.1126 -0.1465 -0.0001 149 HIS B CB 3962 C CG . HIS B 128 ? 0.8017 1.4757 1.2010 0.1228 -0.1470 -0.0027 149 HIS B CG 3963 N ND1 . HIS B 128 ? 0.8071 1.4992 1.2100 0.1236 -0.1467 -0.0002 149 HIS B ND1 3964 C CD2 . HIS B 128 ? 0.8428 1.5212 1.2395 0.1322 -0.1473 -0.0080 149 HIS B CD2 3965 C CE1 . HIS B 128 ? 0.8304 1.5364 1.2329 0.1331 -0.1467 -0.0039 149 HIS B CE1 3966 N NE2 . HIS B 128 ? 0.8800 1.5780 1.2782 0.1382 -0.1471 -0.0086 149 HIS B NE2 3967 N N . SER B 129 ? 0.7336 1.3711 1.1229 0.1157 -0.1390 0.0049 150 SER B N 3968 C CA . SER B 129 ? 0.6984 1.3371 1.0838 0.1238 -0.1375 0.0044 150 SER B CA 3969 C C . SER B 129 ? 0.6942 1.3272 1.0810 0.1290 -0.1419 -0.0057 150 SER B C 3970 O O . SER B 129 ? 0.6568 1.2737 1.0454 0.1244 -0.1429 -0.0090 150 SER B O 3971 C CB . SER B 129 ? 0.7072 1.3337 1.0897 0.1199 -0.1320 0.0121 150 SER B CB 3972 O OG . SER B 129 ? 0.7303 1.3602 1.1088 0.1284 -0.1306 0.0131 150 SER B OG 3973 N N . GLY B 130 ? 0.7337 1.3799 1.1192 0.1382 -0.1442 -0.0111 151 GLY B N 3974 C CA . GLY B 130 ? 0.7466 1.3897 1.1336 0.1430 -0.1483 -0.0218 151 GLY B CA 3975 C C . GLY B 130 ? 0.7771 1.4324 1.1665 0.1477 -0.1516 -0.0287 151 GLY B C 3976 O O . GLY B 130 ? 0.7887 1.4530 1.1802 0.1461 -0.1513 -0.0254 151 GLY B O 3977 N N . GLU B 131 ? 0.7999 1.4562 1.1899 0.1533 -0.1545 -0.0386 152 GLU B N 3978 C CA . GLU B 131 ? 0.7888 1.4554 1.1812 0.1583 -0.1571 -0.0463 152 GLU B CA 3979 C C . GLU B 131 ? 0.7110 1.3672 1.1087 0.1537 -0.1596 -0.0491 152 GLU B C 3980 O O . GLU B 131 ? 0.6930 1.3324 1.0914 0.1493 -0.1611 -0.0520 152 GLU B O 3981 C CB . GLU B 131 ? 0.8521 1.5229 1.2431 0.1652 -0.1589 -0.0564 152 GLU B CB 3982 C CG . GLU B 131 ? 0.9257 1.6050 1.3196 0.1703 -0.1609 -0.0658 152 GLU B CG 3983 C CD . GLU B 131 ? 0.9883 1.6726 1.3801 0.1762 -0.1622 -0.0762 152 GLU B CD 3984 O OE1 . GLU B 131 ? 1.0428 1.7389 1.4297 0.1801 -0.1609 -0.0746 152 GLU B OE1 3985 O OE2 . GLU B 131 ? 0.9617 1.6386 1.3564 0.1768 -0.1643 -0.0859 152 GLU B OE2 3986 N N . LEU B 132 ? 0.5957 1.2624 0.9969 0.1547 -0.1601 -0.0480 153 LEU B N 3987 C CA . LEU B 132 ? 0.6098 1.2685 1.0160 0.1510 -0.1628 -0.0492 153 LEU B CA 3988 C C . LEU B 132 ? 0.6057 1.2677 1.0154 0.1578 -0.1652 -0.0592 153 LEU B C 3989 O O . LEU B 132 ? 0.6367 1.3130 1.0462 0.1652 -0.1643 -0.0636 153 LEU B O 3990 C CB . LEU B 132 ? 0.6187 1.2866 1.0280 0.1470 -0.1620 -0.0405 153 LEU B CB 3991 C CG . LEU B 132 ? 0.5865 1.2526 0.9929 0.1395 -0.1589 -0.0303 153 LEU B CG 3992 C CD1 . LEU B 132 ? 0.5921 1.2749 1.0018 0.1381 -0.1575 -0.0234 153 LEU B CD1 3993 C CD2 . LEU B 132 ? 0.5486 1.1951 0.9545 0.1299 -0.1598 -0.0281 153 LEU B CD2 3994 N N . SER B 133 ? 0.5716 1.2195 0.9839 0.1550 -0.1679 -0.0626 154 SER B N 3995 C CA . SER B 133 ? 0.5568 1.2059 0.9733 0.1608 -0.1698 -0.0705 154 SER B CA 3996 C C . SER B 133 ? 0.6302 1.2784 1.0519 0.1579 -0.1717 -0.0653 154 SER B C 3997 O O . SER B 133 ? 0.6772 1.3176 1.0982 0.1498 -0.1725 -0.0579 154 SER B O 3998 C CB . SER B 133 ? 0.5192 1.1517 0.9338 0.1609 -0.1713 -0.0799 154 SER B CB 3999 O OG . SER B 133 ? 0.6164 1.2315 1.0280 0.1525 -0.1719 -0.0765 154 SER B OG 4000 N N . TYR B 134 ? 0.6015 1.2584 1.0289 0.1645 -0.1724 -0.0691 155 TYR B N 4001 C CA . TYR B 134 ? 0.5452 1.2054 0.9790 0.1632 -0.1743 -0.0635 155 TYR B CA 4002 C C . TYR B 134 ? 0.5697 1.2194 1.0072 0.1669 -0.1766 -0.0695 155 TYR B C 4003 O O . TYR B 134 ? 0.6046 1.2527 1.0422 0.1734 -0.1757 -0.0790 155 TYR B O 4004 C CB . TYR B 134 ? 0.5698 1.2536 1.0091 0.1679 -0.1724 -0.0599 155 TYR B CB 4005 C CG . TYR B 134 ? 0.6307 1.3251 1.0659 0.1647 -0.1695 -0.0538 155 TYR B CG 4006 C CD1 . TYR B 134 ? 0.6747 1.3753 1.1113 0.1579 -0.1693 -0.0437 155 TYR B CD1 4007 C CD2 . TYR B 134 ? 0.6492 1.3475 1.0786 0.1682 -0.1670 -0.0580 155 TYR B CD2 4008 C CE1 . TYR B 134 ? 0.6941 1.4029 1.1265 0.1548 -0.1660 -0.0380 155 TYR B CE1 4009 C CE2 . TYR B 134 ? 0.6966 1.4033 1.1216 0.1657 -0.1642 -0.0517 155 TYR B CE2 4010 C CZ . TYR B 134 ? 0.7286 1.4397 1.1549 0.1591 -0.1634 -0.0417 155 TYR B CZ 4011 O OH . TYR B 134 ? 0.7540 1.4722 1.1757 0.1566 -0.1600 -0.0353 155 TYR B OH 4012 N N . ALA B 135 ? 0.5920 1.2344 1.0321 0.1624 -0.1795 -0.0634 156 ALA B N 4013 C CA . ALA B 135 ? 0.5783 1.2117 1.0226 0.1662 -0.1817 -0.0668 156 ALA B CA 4014 C C . ALA B 135 ? 0.7059 1.3472 1.1567 0.1643 -0.1843 -0.0573 156 ALA B C 4015 O O . ALA B 135 ? 0.7528 1.4001 1.2028 0.1569 -0.1849 -0.0487 156 ALA B O 4016 C CB . ALA B 135 ? 0.5446 1.1533 0.9826 0.1611 -0.1834 -0.0706 156 ALA B CB 4017 N N . TRP B 136 ? 0.7230 1.3650 1.1807 0.1708 -0.1856 -0.0588 157 TRP B N 4018 C CA . TRP B 136 ? 0.6369 1.2880 1.1019 0.1700 -0.1885 -0.0498 157 TRP B CA 4019 C C . TRP B 136 ? 0.6512 1.2840 1.1157 0.1686 -0.1922 -0.0480 157 TRP B C 4020 O O . TRP B 136 ? 0.6304 1.2466 1.0921 0.1723 -0.1917 -0.0556 157 TRP B O 4021 C CB . TRP B 136 ? 0.5954 1.2691 1.0716 0.1798 -0.1866 -0.0504 157 TRP B CB 4022 C CG . TRP B 136 ? 0.5958 1.2907 1.0732 0.1785 -0.1840 -0.0472 157 TRP B CG 4023 C CD1 . TRP B 136 ? 0.6036 1.3040 1.0762 0.1803 -0.1802 -0.0527 157 TRP B CD1 4024 C CD2 . TRP B 136 ? 0.6165 1.3301 1.1000 0.1747 -0.1850 -0.0377 157 TRP B CD2 4025 N NE1 . TRP B 136 ? 0.6032 1.3234 1.0780 0.1781 -0.1783 -0.0467 157 TRP B NE1 4026 C CE2 . TRP B 136 ? 0.5822 1.3109 1.0640 0.1744 -0.1811 -0.0378 157 TRP B CE2 4027 C CE3 . TRP B 136 ? 0.6003 1.3200 1.0903 0.1713 -0.1888 -0.0288 157 TRP B CE3 4028 C CZ2 . TRP B 136 ? 0.5799 1.3286 1.0663 0.1706 -0.1805 -0.0300 157 TRP B CZ2 4029 C CZ3 . TRP B 136 ? 0.5632 1.3044 1.0585 0.1673 -0.1885 -0.0213 157 TRP B CZ3 4030 C CH2 . TRP B 136 ? 0.6119 1.3668 1.1054 0.1668 -0.1841 -0.0221 157 TRP B CH2 4031 N N . ILE B 137 ? 0.5951 1.2311 1.0618 0.1627 -0.1958 -0.0379 158 ILE B N 4032 C CA . ILE B 137 ? 0.6660 1.2868 1.1320 0.1610 -0.1997 -0.0343 158 ILE B CA 4033 C C . ILE B 137 ? 0.6513 1.2891 1.1293 0.1671 -0.2020 -0.0276 158 ILE B C 4034 O O . ILE B 137 ? 0.6240 1.2819 1.1074 0.1642 -0.2031 -0.0203 158 ILE B O 4035 C CB . ILE B 137 ? 0.6749 1.2836 1.1319 0.1473 -0.2026 -0.0275 158 ILE B CB 4036 C CG1 . ILE B 137 ? 0.6149 1.2046 1.0610 0.1419 -0.2002 -0.0344 158 ILE B CG1 4037 C CG2 . ILE B 137 ? 0.6541 1.2509 1.1105 0.1452 -0.2071 -0.0217 158 ILE B CG2 4038 C CD1 . ILE B 137 ? 0.6314 1.2075 1.0683 0.1283 -0.2020 -0.0289 158 ILE B CD1 4039 N N . PHE B 138 ? 0.6388 1.2688 1.1215 0.1757 -0.2025 -0.0305 159 PHE B N 4040 C CA . PHE B 138 ? 0.6738 1.3181 1.1686 0.1825 -0.2047 -0.0240 159 PHE B CA 4041 C C . PHE B 138 ? 0.7125 1.3413 1.2043 0.1785 -0.2097 -0.0166 159 PHE B C 4042 O O . PHE B 138 ? 0.7006 1.3061 1.1866 0.1800 -0.2096 -0.0209 159 PHE B O 4043 C CB . PHE B 138 ? 0.6873 1.3362 1.1911 0.1963 -0.2009 -0.0319 159 PHE B CB 4044 C CG . PHE B 138 ? 0.6865 1.3472 1.2036 0.2044 -0.2028 -0.0255 159 PHE B CG 4045 C CD1 . PHE B 138 ? 0.6732 1.3605 1.2007 0.2042 -0.2047 -0.0171 159 PHE B CD1 4046 C CD2 . PHE B 138 ? 0.6908 1.3360 1.2104 0.2123 -0.2025 -0.0279 159 PHE B CD2 4047 C CE1 . PHE B 138 ? 0.6677 1.3676 1.2088 0.2121 -0.2066 -0.0110 159 PHE B CE1 4048 C CE2 . PHE B 138 ? 0.6783 1.3343 1.2109 0.2204 -0.2041 -0.0214 159 PHE B CE2 4049 C CZ . PHE B 138 ? 0.6634 1.3474 1.2072 0.2205 -0.2063 -0.0129 159 PHE B CZ 4050 N N . ASN B 139 ? 0.7551 1.3974 1.2506 0.1728 -0.2141 -0.0053 160 ASN B N 4051 C CA . ASN B 139 ? 0.7729 1.4034 1.2651 0.1678 -0.2194 0.0032 160 ASN B CA 4052 C C . ASN B 139 ? 0.8354 1.4362 1.3117 0.1585 -0.2198 0.0005 160 ASN B C 4053 O O . ASN B 139 ? 0.8256 1.4063 1.2978 0.1605 -0.2211 0.0004 160 ASN B O 4054 C CB . ASN B 139 ? 0.7242 1.3540 1.2262 0.1799 -0.2205 0.0050 160 ASN B CB 4055 C CG . ASN B 139 ? 0.7154 1.3758 1.2340 0.1870 -0.2217 0.0112 160 ASN B CG 4056 O OD1 . ASN B 139 ? 0.7051 1.3862 1.2269 0.1803 -0.2239 0.0178 160 ASN B OD1 4057 N ND2 . ASN B 139 ? 0.6993 1.3628 1.2291 0.2005 -0.2199 0.0091 160 ASN B ND2 4058 N N . GLU B 140 ? 0.8629 1.4610 1.3302 0.1485 -0.2183 -0.0016 161 GLU B N 4059 C CA . GLU B 140 ? 0.9750 1.5476 1.4279 0.1380 -0.2186 -0.0035 161 GLU B CA 4060 C C . GLU B 140 ? 1.0274 1.5778 1.4750 0.1430 -0.2150 -0.0149 161 GLU B C 4061 O O . GLU B 140 ? 1.0899 1.6174 1.5263 0.1357 -0.2150 -0.0173 161 GLU B O 4062 C CB . GLU B 140 ? 1.1080 1.6708 1.5561 0.1309 -0.2237 0.0063 161 GLU B CB 4063 C CG . GLU B 140 ? 1.2069 1.7925 1.6603 0.1253 -0.2277 0.0176 161 GLU B CG 4064 C CD . GLU B 140 ? 1.2947 1.8820 1.7394 0.1106 -0.2272 0.0201 161 GLU B CD 4065 O OE1 . GLU B 140 ? 1.2939 1.8757 1.7340 0.1084 -0.2228 0.0127 161 GLU B OE1 4066 O OE2 . GLU B 140 ? 1.3675 1.9619 1.8101 0.1010 -0.2311 0.0296 161 GLU B OE2 4067 N N . TYR B 141 ? 1.0054 1.5631 1.4609 0.1551 -0.2118 -0.0223 162 TYR B N 4068 C CA . TYR B 141 ? 0.9241 1.4630 1.3758 0.1605 -0.2084 -0.0336 162 TYR B CA 4069 C C . TYR B 141 ? 0.8945 1.4472 1.3506 0.1671 -0.2037 -0.0428 162 TYR B C 4070 O O . TYR B 141 ? 0.9410 1.5170 1.4066 0.1727 -0.2030 -0.0404 162 TYR B O 4071 C CB . TYR B 141 ? 0.9632 1.4942 1.4201 0.1697 -0.2092 -0.0331 162 TYR B CB 4072 C CG . TYR B 141 ? 1.0169 1.5213 1.4668 0.1715 -0.2067 -0.0422 162 TYR B CG 4073 C CD1 . TYR B 141 ? 1.0237 1.5040 1.4617 0.1620 -0.2085 -0.0409 162 TYR B CD1 4074 C CD2 . TYR B 141 ? 1.0532 1.5561 1.5080 0.1821 -0.2024 -0.0524 162 TYR B CD2 4075 C CE1 . TYR B 141 ? 1.0523 1.5084 1.4840 0.1632 -0.2061 -0.0496 162 TYR B CE1 4076 C CE2 . TYR B 141 ? 1.0682 1.5468 1.5164 0.1830 -0.1999 -0.0612 162 TYR B CE2 4077 C CZ . TYR B 141 ? 1.0619 1.5173 1.4987 0.1735 -0.2019 -0.0596 162 TYR B CZ 4078 O OH . TYR B 141 ? 1.0146 1.4733 1.4790 0.0000 -0.2065 0.0000 162 TYR B OH 4079 N N . PRO B 142 ? 0.8748 1.4142 1.3241 0.1662 -0.2005 -0.0532 163 PRO B N 4080 C CA . PRO B 142 ? 0.8426 1.3949 1.2942 0.1713 -0.1963 -0.0617 163 PRO B CA 4081 C C . PRO B 142 ? 0.8811 1.4507 1.3439 0.1834 -0.1942 -0.0641 163 PRO B C 4082 O O . PRO B 142 ? 0.8676 1.4283 1.3339 0.1904 -0.1935 -0.0673 163 PRO B O 4083 C CB . PRO B 142 ? 0.7652 1.2972 1.2092 0.1707 -0.1939 -0.0731 163 PRO B CB 4084 C CG . PRO B 142 ? 0.8023 1.3127 1.2374 0.1606 -0.1968 -0.0688 163 PRO B CG 4085 C CD . PRO B 142 ? 0.8652 1.3772 1.3039 0.1603 -0.2007 -0.0576 163 PRO B CD 4086 N N . SER B 143 ? 0.8934 1.4867 1.3617 0.1855 -0.1927 -0.0626 164 SER B N 4087 C CA . SER B 143 ? 0.9060 1.5178 1.3852 0.1965 -0.1899 -0.0652 164 SER B CA 4088 C C . SER B 143 ? 0.9204 1.5249 1.3984 0.2037 -0.1855 -0.0786 164 SER B C 4089 O O . SER B 143 ? 0.8912 1.4905 1.3617 0.2008 -0.1835 -0.0861 164 SER B O 4090 C CB . SER B 143 ? 0.9068 1.5444 1.3901 0.1958 -0.1887 -0.0617 164 SER B CB 4091 O OG . SER B 143 ? 0.9316 1.5876 1.4254 0.2061 -0.1857 -0.0645 164 SER B OG 4092 N N . TYR B 144 ? 0.9921 1.5966 1.4780 0.2131 -0.1837 -0.0816 165 TYR B N 4093 C CA . TYR B 144 ? 1.0558 1.6532 1.5409 0.2197 -0.1788 -0.0948 165 TYR B CA 4094 C C . TYR B 144 ? 1.0215 1.6421 1.5111 0.2250 -0.1746 -0.1008 165 TYR B C 4095 O O . TYR B 144 ? 0.9940 1.6352 1.4927 0.2291 -0.1741 -0.0953 165 TYR B O 4096 C CB . TYR B 144 ? 1.1796 1.7661 1.6709 0.2274 -0.1777 -0.0960 165 TYR B CB 4097 C CG . TYR B 144 ? 1.3216 1.8902 1.8084 0.2305 -0.1734 -0.1093 165 TYR B CG 4098 C CD1 . TYR B 144 ? 1.3807 1.9506 1.8609 0.2284 -0.1705 -0.1203 165 TYR B CD1 4099 C CD2 . TYR B 144 ? 1.3796 1.9304 1.8686 0.2354 -0.1721 -0.1110 165 TYR B CD2 4100 C CE1 . TYR B 144 ? 1.4101 1.9651 1.8864 0.2304 -0.1666 -0.1331 165 TYR B CE1 4101 C CE2 . TYR B 144 ? 1.4252 1.9591 1.9096 0.2374 -0.1676 -0.1237 165 TYR B CE2 4102 C CZ . TYR B 144 ? 1.4360 1.9728 1.9144 0.2346 -0.1650 -0.1350 165 TYR B CZ 4103 O OH . TYR B 144 ? 1.4604 1.9819 1.9345 0.2357 -0.1606 -0.1482 165 TYR B OH 4104 N N . GLN B 145 ? 0.9963 1.6139 1.4792 0.2246 -0.1714 -0.1118 166 GLN B N 4105 C CA . GLN B 145 ? 0.9675 1.6055 1.4528 0.2294 -0.1670 -0.1186 166 GLN B CA 4106 C C . GLN B 145 ? 0.9426 1.5760 1.4307 0.2371 -0.1619 -0.1312 166 GLN B C 4107 O O . GLN B 145 ? 0.9212 1.5344 1.4036 0.2359 -0.1612 -0.1390 166 GLN B O 4108 C CB . GLN B 145 ? 0.9775 1.6191 1.4532 0.2232 -0.1671 -0.1217 166 GLN B CB 4109 C CG . GLN B 145 ? 0.9977 1.6400 1.4693 0.2145 -0.1713 -0.1105 166 GLN B CG 4110 C CD . GLN B 145 ? 1.0599 1.7028 1.5220 0.2091 -0.1709 -0.1137 166 GLN B CD 4111 O OE1 . GLN B 145 ? 1.0550 1.6826 1.5102 0.2018 -0.1733 -0.1121 166 GLN B OE1 4112 N NE2 . GLN B 145 ? 1.0789 1.7398 1.5407 0.2127 -0.1676 -0.1185 166 GLN B NE2 4113 N N . ASP B 146 ? 0.9274 1.5790 1.4240 0.2446 -0.1579 -0.1336 167 ASP B N 4114 C CA . ASP B 146 ? 0.9520 1.6012 1.4513 0.2518 -0.1520 -0.1460 167 ASP B CA 4115 C C . ASP B 146 ? 0.9547 1.6298 1.4598 0.2571 -0.1473 -0.1498 167 ASP B C 4116 O O . ASP B 146 ? 0.9783 1.6716 1.4820 0.2541 -0.1487 -0.1445 167 ASP B O 4117 C CB . ASP B 146 ? 1.0162 1.6501 1.5228 0.2574 -0.1512 -0.1445 167 ASP B CB 4118 C CG . ASP B 146 ? 1.0629 1.7077 1.5801 0.2602 -0.1542 -0.1308 167 ASP B CG 4119 O OD1 . ASP B 146 ? 1.0883 1.7565 1.6100 0.2600 -0.1547 -0.1253 167 ASP B OD1 4120 O OD2 . ASP B 146 ? 1.0597 1.6898 1.5807 0.2622 -0.1562 -0.1252 167 ASP B OD2 4121 N N . ASN B 147 ? 0.9629 1.6390 1.4736 0.2645 -0.1414 -0.1590 168 ASN B N 4122 C CA . ASN B 147 ? 0.9993 1.6993 1.5151 0.2693 -0.1360 -0.1640 168 ASN B CA 4123 C C . ASN B 147 ? 0.9582 1.6786 1.4849 0.2723 -0.1370 -0.1526 168 ASN B C 4124 O O . ASN B 147 ? 0.9434 1.6864 1.4732 0.2745 -0.1335 -0.1542 168 ASN B O 4125 C CB . ASN B 147 ? 1.0911 1.7855 1.6105 0.2760 -0.1287 -0.1771 168 ASN B CB 4126 C CG . ASN B 147 ? 1.1983 1.8840 1.7295 0.2831 -0.1272 -0.1727 168 ASN B CG 4127 O OD1 . ASN B 147 ? 1.2370 1.9277 1.7759 0.2901 -0.1205 -0.1793 168 ASN B OD1 4128 N ND2 . ASN B 147 ? 1.2049 1.8779 1.7376 0.2811 -0.1332 -0.1612 168 ASN B ND2 4129 N N . ARG B 148 ? 0.9044 1.6173 1.4367 0.2720 -0.1418 -0.1411 169 ARG B N 4130 C CA . ARG B 148 ? 0.8058 1.5380 1.3498 0.2745 -0.1432 -0.1298 169 ARG B CA 4131 C C . ARG B 148 ? 0.7396 1.4785 1.2790 0.2659 -0.1496 -0.1181 169 ARG B C 4132 O O . ARG B 148 ? 0.6762 1.4367 1.2222 0.2657 -0.1500 -0.1108 169 ARG B O 4133 C CB . ARG B 148 ? 0.8300 1.5526 1.3851 0.2807 -0.1440 -0.1246 169 ARG B CB 4134 C CG . ARG B 148 ? 0.8127 1.5577 1.3828 0.2851 -0.1447 -0.1146 169 ARG B CG 4135 C CD . ARG B 148 ? 0.8105 1.5456 1.3917 0.2921 -0.1453 -0.1096 169 ARG B CD 4136 N NE . ARG B 148 ? 0.7968 1.5108 1.3717 0.2868 -0.1522 -0.1015 169 ARG B NE 4137 C CZ . ARG B 148 ? 0.7624 1.4830 1.3394 0.2817 -0.1590 -0.0882 169 ARG B CZ 4138 N NH1 . ARG B 148 ? 0.7464 1.4942 1.3321 0.2813 -0.1599 -0.0815 169 ARG B NH1 4139 N NH2 . ARG B 148 ? 0.7339 1.4342 1.3041 0.2764 -0.1647 -0.0819 169 ARG B NH2 4140 N N . ARG B 149 ? 0.7615 1.4813 1.2897 0.2584 -0.1540 -0.1167 170 ARG B N 4141 C CA . ARG B 149 ? 0.7701 1.4927 1.2925 0.2493 -0.1592 -0.1063 170 ARG B CA 4142 C C . ARG B 149 ? 0.7594 1.4775 1.2681 0.2429 -0.1591 -0.1114 170 ARG B C 4143 O O . ARG B 149 ? 0.7811 1.4818 1.2822 0.2419 -0.1585 -0.1200 170 ARG B O 4144 C CB . ARG B 149 ? 0.8034 1.5087 1.3256 0.2451 -0.1650 -0.0972 170 ARG B CB 4145 C CG . ARG B 149 ? 0.9111 1.6244 1.4470 0.2504 -0.1665 -0.0888 170 ARG B CG 4146 C CD . ARG B 149 ? 1.0013 1.6945 1.5402 0.2565 -0.1658 -0.0923 170 ARG B CD 4147 N NE . ARG B 149 ? 1.0851 1.7543 1.6151 0.2497 -0.1708 -0.0879 170 ARG B NE 4148 C CZ . ARG B 149 ? 1.1885 1.8357 1.7178 0.2525 -0.1711 -0.0894 170 ARG B CZ 4149 N NH1 . ARG B 149 ? 1.2042 1.8498 1.7416 0.2623 -0.1665 -0.0952 170 ARG B NH1 4150 N NH2 . ARG B 149 ? 1.2439 1.8702 1.7642 0.2452 -0.1756 -0.0853 170 ARG B NH2 4151 N N . PHE B 150 ? 0.7117 1.4457 1.2175 0.2382 -0.1598 -0.1059 171 PHE B N 4152 C CA . PHE B 150 ? 0.6562 1.3906 1.1503 0.2335 -0.1589 -0.1102 171 PHE B CA 4153 C C . PHE B 150 ? 0.6389 1.3768 1.1277 0.2249 -0.1621 -0.0993 171 PHE B C 4154 O O . PHE B 150 ? 0.5988 1.3513 1.0939 0.2238 -0.1628 -0.0903 171 PHE B O 4155 C CB . PHE B 150 ? 0.6456 1.3995 1.1406 0.2390 -0.1534 -0.1179 171 PHE B CB 4156 C CG . PHE B 150 ? 0.7073 1.4660 1.1907 0.2348 -0.1526 -0.1209 171 PHE B CG 4157 C CD1 . PHE B 150 ? 0.7243 1.4696 1.1990 0.2335 -0.1527 -0.1301 171 PHE B CD1 4158 C CD2 . PHE B 150 ? 0.7208 1.4978 1.2022 0.2322 -0.1518 -0.1142 171 PHE B CD2 4159 C CE1 . PHE B 150 ? 0.6442 1.3952 1.1088 0.2302 -0.1522 -0.1323 171 PHE B CE1 4160 C CE2 . PHE B 150 ? 0.6859 1.4669 1.1562 0.2289 -0.1511 -0.1160 171 PHE B CE2 4161 C CZ . PHE B 150 ? 0.6292 1.3976 1.0913 0.2282 -0.1515 -0.1248 171 PHE B CZ 4162 N N . VAL B 151 ? 0.6569 1.3814 1.1348 0.2186 -0.1638 -0.1005 172 VAL B N 4163 C CA . VAL B 151 ? 0.6048 1.3297 1.0766 0.2101 -0.1660 -0.0912 172 VAL B CA 4164 C C . VAL B 151 ? 0.6525 1.3841 1.1153 0.2086 -0.1638 -0.0943 172 VAL B C 4165 O O . VAL B 151 ? 0.6394 1.3609 1.0954 0.2088 -0.1635 -0.1024 172 VAL B O 4166 C CB . VAL B 151 ? 0.4824 1.1842 0.9494 0.2029 -0.1701 -0.0877 172 VAL B CB 4167 C CG1 . VAL B 151 ? 0.4478 1.1477 0.9070 0.1941 -0.1712 -0.0806 172 VAL B CG1 4168 C CG2 . VAL B 151 ? 0.3373 1.0349 0.8122 0.2028 -0.1732 -0.0811 172 VAL B CG2 4169 N N . SER B 152 ? 0.6780 1.4269 1.1405 0.2069 -0.1621 -0.0875 173 SER B N 4170 C CA . SER B 152 ? 0.6561 1.4127 1.1097 0.2058 -0.1599 -0.0888 173 SER B CA 4171 C C . SER B 152 ? 0.6336 1.3754 1.0784 0.1980 -0.1620 -0.0838 173 SER B C 4172 O O . SER B 152 ? 0.6440 1.3808 1.0897 0.1915 -0.1638 -0.0747 173 SER B O 4173 C CB . SER B 152 ? 0.6627 1.4422 1.1187 0.2066 -0.1570 -0.0828 173 SER B CB 4174 O OG . SER B 152 ? 0.6968 1.4837 1.1434 0.2061 -0.1547 -0.0835 173 SER B OG 4175 N N . GLN B 153 ? 0.6183 1.3540 1.0553 0.1983 -0.1617 -0.0904 174 GLN B N 4176 C CA . GLN B 153 ? 0.5938 1.3164 1.0232 0.1918 -0.1631 -0.0864 174 GLN B CA 4177 C C . GLN B 153 ? 0.6404 1.3748 1.0643 0.1896 -0.1608 -0.0787 174 GLN B C 4178 O O . GLN B 153 ? 0.6632 1.3885 1.0811 0.1846 -0.1612 -0.0742 174 GLN B O 4179 C CB . GLN B 153 ? 0.5333 1.2445 0.9577 0.1931 -0.1638 -0.0966 174 GLN B CB 4180 C CG . GLN B 153 ? 0.5387 1.2325 0.9667 0.1931 -0.1660 -0.1028 174 GLN B CG 4181 C CD . GLN B 153 ? 0.6111 1.2902 1.0409 0.1862 -0.1686 -0.0945 174 GLN B CD 4182 O OE1 . GLN B 153 ? 0.6910 1.3646 1.1167 0.1798 -0.1691 -0.0875 174 GLN B OE1 4183 N NE2 . GLN B 153 ? 0.5303 1.2029 0.9662 0.1875 -0.1701 -0.0951 174 GLN B NE2 4184 N N . GLU B 154 ? 0.6851 1.4395 1.1112 0.1934 -0.1582 -0.0772 175 GLU B N 4185 C CA . GLU B 154 ? 0.7644 1.5306 1.1850 0.1914 -0.1556 -0.0692 175 GLU B CA 4186 C C . GLU B 154 ? 0.8010 1.5736 1.2266 0.1868 -0.1548 -0.0588 175 GLU B C 4187 O O . GLU B 154 ? 0.8229 1.5954 1.2438 0.1816 -0.1534 -0.0501 175 GLU B O 4188 C CB . GLU B 154 ? 0.8181 1.6028 1.2354 0.1978 -0.1526 -0.0744 175 GLU B CB 4189 C CG . GLU B 154 ? 0.8902 1.6749 1.2967 0.1981 -0.1520 -0.0752 175 GLU B CG 4190 C CD . GLU B 154 ? 0.9324 1.7033 1.3364 0.1990 -0.1546 -0.0844 175 GLU B CD 4191 O OE1 . GLU B 154 ? 0.9848 1.7597 1.3908 0.2039 -0.1547 -0.0953 175 GLU B OE1 4192 O OE2 . GLU B 154 ? 0.8606 1.6172 1.2609 0.1947 -0.1562 -0.0809 175 GLU B OE2 4193 N N . THR B 155 ? 0.8092 1.5879 1.2447 0.1888 -0.1556 -0.0595 176 THR B N 4194 C CA . THR B 155 ? 0.8206 1.6078 1.2621 0.1843 -0.1552 -0.0502 176 THR B CA 4195 C C . THR B 155 ? 0.8049 1.5781 1.2514 0.1790 -0.1591 -0.0467 176 THR B C 4196 O O . THR B 155 ? 0.8527 1.6279 1.3013 0.1721 -0.1594 -0.0379 176 THR B O 4197 C CB . THR B 155 ? 0.8085 1.6179 1.2588 0.1900 -0.1529 -0.0516 176 THR B CB 4198 O OG1 . THR B 155 ? 0.7622 1.5690 1.2219 0.1950 -0.1550 -0.0575 176 THR B OG1 4199 C CG2 . THR B 155 ? 0.8671 1.6899 1.3119 0.1957 -0.1491 -0.0569 176 THR B CG2 4200 N N . GLY B 156 ? 0.7363 1.4958 1.1846 0.1818 -0.1619 -0.0536 177 GLY B N 4201 C CA . GLY B 156 ? 0.6609 1.4060 1.1127 0.1770 -0.1657 -0.0507 177 GLY B CA 4202 C C . GLY B 156 ? 0.6058 1.3609 1.0692 0.1805 -0.1673 -0.0494 177 GLY B C 4203 O O . GLY B 156 ? 0.6270 1.3708 1.0938 0.1782 -0.1708 -0.0476 177 GLY B O 4204 N N . ASN B 157 ? 0.5386 1.3151 1.0083 0.1860 -0.1645 -0.0499 178 ASN B N 4205 C CA . ASN B 157 ? 0.5377 1.3262 1.0201 0.1906 -0.1654 -0.0488 178 ASN B CA 4206 C C . ASN B 157 ? 0.5426 1.3198 1.0291 0.1977 -0.1669 -0.0569 178 ASN B C 4207 O O . ASN B 157 ? 0.5211 1.2868 1.0013 0.2007 -0.1660 -0.0654 178 ASN B O 4208 C CB . ASN B 157 ? 0.5590 1.3728 1.0474 0.1957 -0.1612 -0.0493 178 ASN B CB 4209 C CG . ASN B 157 ? 0.6150 1.4399 1.0989 0.1888 -0.1590 -0.0415 178 ASN B CG 4210 O OD1 . ASN B 157 ? 0.6102 1.4258 1.0892 0.1798 -0.1607 -0.0343 178 ASN B OD1 4211 N ND2 . ASN B 157 ? 0.5975 1.4417 1.0823 0.1925 -0.1545 -0.0429 178 ASN B ND2 4212 N N . LEU B 158 ? 0.5799 1.3600 1.0770 0.2001 -0.1693 -0.0538 179 LEU B N 4213 C CA . LEU B 158 ? 0.6042 1.3746 1.1065 0.2076 -0.1701 -0.0604 179 LEU B CA 4214 C C . LEU B 158 ? 0.6532 1.4437 1.1683 0.2170 -0.1669 -0.0630 179 LEU B C 4215 O O . LEU B 158 ? 0.7280 1.5342 1.2535 0.2172 -0.1679 -0.0559 179 LEU B O 4216 C CB . LEU B 158 ? 0.5847 1.3397 1.0888 0.2037 -0.1753 -0.0546 179 LEU B CB 4217 C CG . LEU B 158 ? 0.6038 1.3509 1.1157 0.2119 -0.1760 -0.0588 179 LEU B CG 4218 C CD1 . LEU B 158 ? 0.6124 1.3485 1.1195 0.2180 -0.1725 -0.0715 179 LEU B CD1 4219 C CD2 . LEU B 158 ? 0.6393 1.3683 1.1496 0.2068 -0.1814 -0.0527 179 LEU B CD2 4220 N N . TYR B 159 ? 0.6509 1.4414 1.1655 0.2246 -0.1630 -0.0738 180 TYR B N 4221 C CA . TYR B 159 ? 0.6868 1.4961 1.2129 0.2336 -0.1588 -0.0780 180 TYR B CA 4222 C C . TYR B 159 ? 0.7251 1.5238 1.2596 0.2415 -0.1587 -0.0827 180 TYR B C 4223 O O . TYR B 159 ? 0.7739 1.5552 1.3028 0.2438 -0.1578 -0.0914 180 TYR B O 4224 C CB . TYR B 159 ? 0.6793 1.4976 1.1992 0.2366 -0.1534 -0.0873 180 TYR B CB 4225 C CG . TYR B 159 ? 0.6513 1.4770 1.1609 0.2295 -0.1529 -0.0830 180 TYR B CG 4226 C CD1 . TYR B 159 ? 0.7101 1.5188 1.2069 0.2226 -0.1556 -0.0819 180 TYR B CD1 4227 C CD2 . TYR B 159 ? 0.5940 1.4431 1.1065 0.2297 -0.1493 -0.0800 180 TYR B CD2 4228 C CE1 . TYR B 159 ? 0.7374 1.5516 1.2249 0.2168 -0.1548 -0.0774 180 TYR B CE1 4229 C CE2 . TYR B 159 ? 0.6078 1.4622 1.1102 0.2234 -0.1486 -0.0755 180 TYR B CE2 4230 C CZ . TYR B 159 ? 0.6870 1.5236 1.1769 0.2172 -0.1512 -0.0739 180 TYR B CZ 4231 O OH . TYR B 159 ? 0.6184 1.4593 1.0986 0.2115 -0.1501 -0.0689 180 TYR B OH 4232 N N . ILE B 160 ? 0.6563 1.4662 1.2048 0.2454 -0.1598 -0.0766 181 ILE B N 4233 C CA . ILE B 160 ? 0.6456 1.4484 1.2039 0.2544 -0.1587 -0.0804 181 ILE B CA 4234 C C . ILE B 160 ? 0.6760 1.4985 1.2448 0.2635 -0.1520 -0.0871 181 ILE B C 4235 O O . ILE B 160 ? 0.6769 1.5232 1.2549 0.2642 -0.1507 -0.0821 181 ILE B O 4236 C CB . ILE B 160 ? 0.6869 1.4891 1.2547 0.2540 -0.1641 -0.0692 181 ILE B CB 4237 C CG1 . ILE B 160 ? 0.6406 1.4253 1.1972 0.2434 -0.1704 -0.0621 181 ILE B CG1 4238 C CG2 . ILE B 160 ? 0.6766 1.4679 1.2533 0.2635 -0.1631 -0.0724 181 ILE B CG2 4239 C CD1 . ILE B 160 ? 0.6596 1.4434 1.2236 0.2418 -0.1762 -0.0510 181 ILE B CD1 4240 N N . ALA B 161 ? 0.7377 1.5504 1.3051 0.2698 -0.1474 -0.0989 182 ALA B N 4241 C CA . ALA B 161 ? 0.7935 1.6229 1.3685 0.2777 -0.1399 -0.1074 182 ALA B CA 4242 C C . ALA B 161 ? 0.8449 1.6857 1.4386 0.2861 -0.1381 -0.1037 182 ALA B C 4243 O O . ALA B 161 ? 0.8786 1.7429 1.4820 0.2902 -0.1335 -0.1048 182 ALA B O 4244 C CB . ALA B 161 ? 0.8141 1.6284 1.3813 0.2809 -0.1352 -0.1216 182 ALA B CB 4245 N N . LYS B 162 ? 0.8605 1.6850 1.4591 0.2890 -0.1417 -0.0994 183 LYS B N 4246 C CA . LYS B 162 ? 0.8620 1.6944 1.4786 0.2980 -0.1403 -0.0956 183 LYS B CA 4247 C C . LYS B 162 ? 0.8754 1.6934 1.4941 0.2965 -0.1477 -0.0848 183 LYS B C 4248 O O . LYS B 162 ? 0.9015 1.6930 1.5125 0.2965 -0.1492 -0.0874 183 LYS B O 4249 C CB . LYS B 162 ? 0.8848 1.7077 1.5051 0.3074 -0.1326 -0.1080 183 LYS B CB 4250 C CG . LYS B 162 ? 0.9251 1.7597 1.5651 0.3180 -0.1289 -0.1059 183 LYS B CG 4251 C CD . LYS B 162 ? 0.9757 1.7934 1.6168 0.3260 -0.1213 -0.1180 183 LYS B CD 4252 C CE . LYS B 162 ? 0.9756 1.7627 1.6124 0.3269 -0.1249 -0.1157 183 LYS B CE 4253 N NZ . LYS B 162 ? 0.9572 1.7474 1.6087 0.3323 -0.1291 -0.1028 183 LYS B NZ 4254 N N . VAL B 163 ? 0.8807 1.7166 1.5093 0.2948 -0.1525 -0.0726 184 VAL B N 4255 C CA . VAL B 163 ? 0.8500 1.6754 1.4791 0.2911 -0.1605 -0.0609 184 VAL B CA 4256 C C . VAL B 163 ? 0.9300 1.7420 1.5685 0.3004 -0.1605 -0.0591 184 VAL B C 4257 O O . VAL B 163 ? 0.9220 1.7474 1.5764 0.3104 -0.1565 -0.0598 184 VAL B O 4258 C CB . VAL B 163 ? 0.7489 1.6000 1.3867 0.2861 -0.1654 -0.0486 184 VAL B CB 4259 C CG1 . VAL B 163 ? 0.7502 1.5946 1.3922 0.2846 -0.1730 -0.0366 184 VAL B CG1 4260 C CG2 . VAL B 163 ? 0.6318 1.4876 1.2563 0.2741 -0.1669 -0.0477 184 VAL B CG2 4261 N N . GLU B 164 ? 1.0203 1.8050 1.6484 0.2969 -0.1649 -0.0568 185 GLU B N 4262 C CA . GLU B 164 ? 1.0951 1.8646 1.7298 0.3039 -0.1664 -0.0523 185 GLU B CA 4263 C C . GLU B 164 ? 1.0599 1.8361 1.6983 0.2989 -0.1752 -0.0367 185 GLU B C 4264 O O . GLU B 164 ? 1.0016 1.7896 1.6350 0.2890 -0.1797 -0.0314 185 GLU B O 4265 C CB . GLU B 164 ? 1.1878 1.9221 1.8077 0.3024 -0.1653 -0.0594 185 GLU B CB 4266 C CG . GLU B 164 ? 1.2469 1.9733 1.8571 0.3020 -0.1584 -0.0750 185 GLU B CG 4267 C CD . GLU B 164 ? 1.3204 2.0497 1.9405 0.3133 -0.1495 -0.0849 185 GLU B CD 4268 O OE1 . GLU B 164 ? 1.3726 2.1255 2.0087 0.3202 -0.1472 -0.0817 185 GLU B OE1 4269 O OE2 . GLU B 164 ? 1.3317 2.0399 1.9437 0.3148 -0.1445 -0.0962 185 GLU B OE2 4270 N N . LYS B 165 ? 1.1059 1.8741 1.7522 0.3051 -0.1778 -0.0295 186 LYS B N 4271 C CA . LYS B 165 ? 1.1301 1.9046 1.7793 0.3001 -0.1866 -0.0144 186 LYS B CA 4272 C C . LYS B 165 ? 1.1636 1.9130 1.7933 0.2883 -0.1923 -0.0114 186 LYS B C 4273 O O . LYS B 165 ? 1.1371 1.8923 1.7648 0.2801 -0.1996 -0.0003 186 LYS B O 4274 C CB . LYS B 165 ? 1.1339 1.9092 1.7980 0.3110 -0.1877 -0.0065 186 LYS B CB 4275 C CG . LYS B 165 ? 1.1630 1.9474 1.8305 0.3058 -0.1973 0.0095 186 LYS B CG 4276 C CD . LYS B 165 ? 1.2026 1.9942 1.8878 0.3176 -0.1985 0.0183 186 LYS B CD 4277 C CE . LYS B 165 ? 1.2054 2.0090 1.8935 0.3117 -0.2087 0.0345 186 LYS B CE 4278 N NZ . LYS B 165 ? 1.2093 2.0220 1.9154 0.3234 -0.2104 0.0443 186 LYS B NZ 4279 N N . SER B 166 ? 1.1924 1.9147 1.8080 0.2867 -0.1886 -0.0218 187 SER B N 4280 C CA . SER B 166 ? 1.2036 1.9005 1.8011 0.2758 -0.1929 -0.0205 187 SER B CA 4281 C C . SER B 166 ? 1.1393 1.8452 1.7269 0.2634 -0.1955 -0.0202 187 SER B C 4282 O O . SER B 166 ? 1.1403 1.8297 1.7142 0.2530 -0.1996 -0.0173 187 SER B O 4283 C CB . SER B 166 ? 1.2612 1.9283 1.8477 0.2780 -0.1876 -0.0328 187 SER B CB 4284 O OG . SER B 166 ? 1.2790 1.9515 1.8619 0.2778 -0.1819 -0.0454 187 SER B OG 4285 N N . ASP B 167 ? 1.0512 1.7827 1.6459 0.2644 -0.1925 -0.0231 188 ASP B N 4286 C CA . ASP B 167 ? 0.9124 1.6514 1.4974 0.2537 -0.1931 -0.0243 188 ASP B CA 4287 C C . ASP B 167 ? 0.8228 1.5780 1.4092 0.2441 -0.1995 -0.0119 188 ASP B C 4288 O O . ASP B 167 ? 0.8196 1.5740 1.3951 0.2332 -0.2009 -0.0113 188 ASP B O 4289 C CB . ASP B 167 ? 0.9013 1.6586 1.4910 0.2582 -0.1865 -0.0334 188 ASP B CB 4290 C CG . ASP B 167 ? 0.9282 1.6697 1.5145 0.2658 -0.1799 -0.0470 188 ASP B CG 4291 O OD1 . ASP B 167 ? 0.9448 1.6592 1.5225 0.2655 -0.1805 -0.0501 188 ASP B OD1 4292 O OD2 . ASP B 167 ? 0.9088 1.6652 1.5006 0.2714 -0.1739 -0.0546 188 ASP B OD2 4293 N N . VAL B 168 ? 0.7431 1.5134 1.3430 0.2481 -0.2033 -0.0020 189 VAL B N 4294 C CA . VAL B 168 ? 0.7261 1.5125 1.3275 0.2383 -0.2098 0.0099 189 VAL B CA 4295 C C . VAL B 168 ? 0.7404 1.5032 1.3245 0.2258 -0.2148 0.0140 189 VAL B C 4296 O O . VAL B 168 ? 0.7570 1.4951 1.3348 0.2272 -0.2163 0.0142 189 VAL B O 4297 C CB . VAL B 168 ? 0.7008 1.5083 1.3204 0.2450 -0.2136 0.0201 189 VAL B CB 4298 C CG1 . VAL B 168 ? 0.7388 1.5314 1.3648 0.2580 -0.2119 0.0186 189 VAL B CG1 4299 C CG2 . VAL B 168 ? 0.6459 1.4580 1.2621 0.2337 -0.2219 0.0330 189 VAL B CG2 4300 N N . GLY B 169 ? 0.6800 1.4498 1.2563 0.2131 -0.2165 0.0170 190 GLY B N 4301 C CA . GLY B 169 ? 0.6401 1.3887 1.1999 0.2001 -0.2202 0.0201 190 GLY B CA 4302 C C . GLY B 169 ? 0.6590 1.4156 1.2107 0.1876 -0.2196 0.0204 190 GLY B C 4303 O O . GLY B 169 ? 0.6369 1.4197 1.1971 0.1870 -0.2184 0.0225 190 GLY B O 4304 N N . ASN B 170 ? 0.6926 1.4260 1.2279 0.1776 -0.2198 0.0184 191 ASN B N 4305 C CA . ASN B 170 ? 0.7342 1.4708 1.2604 0.1654 -0.2186 0.0185 191 ASN B CA 4306 C C . ASN B 170 ? 0.8131 1.5349 1.3297 0.1661 -0.2130 0.0077 191 ASN B C 4307 O O . ASN B 170 ? 0.7951 1.4912 1.3020 0.1657 -0.2125 0.0025 191 ASN B O 4308 C CB . ASN B 170 ? 0.7853 1.5096 1.3004 0.1512 -0.2233 0.0260 191 ASN B CB 4309 C CG . ASN B 170 ? 0.8976 1.6413 1.4212 0.1479 -0.2290 0.0375 191 ASN B CG 4310 O OD1 . ASN B 170 ? 0.7919 1.5602 1.3218 0.1431 -0.2292 0.0418 191 ASN B OD1 4311 N ND2 . ASN B 170 ? 1.1716 1.9049 1.6955 0.1499 -0.2337 0.0427 191 ASN B ND2 4312 N N . TYR B 171 ? 0.8026 1.5414 1.3220 0.1668 -0.2088 0.0047 192 TYR B N 4313 C CA . TYR B 171 ? 0.7511 1.4799 1.2621 0.1678 -0.2037 -0.0047 192 TYR B CA 4314 C C . TYR B 171 ? 0.7407 1.4667 1.2411 0.1552 -0.2025 -0.0026 192 TYR B C 4315 O O . TYR B 171 ? 0.7278 1.4728 1.2314 0.1498 -0.2021 0.0028 192 TYR B O 4316 C CB . TYR B 171 ? 0.7200 1.4679 1.2404 0.1785 -0.1989 -0.0106 192 TYR B CB 4317 C CG . TYR B 171 ? 0.7227 1.4683 1.2517 0.1918 -0.1980 -0.0160 192 TYR B CG 4318 C CD1 . TYR B 171 ? 0.7888 1.5157 1.3115 0.1972 -0.1950 -0.0263 192 TYR B CD1 4319 C CD2 . TYR B 171 ? 0.6590 1.4213 1.2025 0.1987 -0.1997 -0.0109 192 TYR B CD2 4320 C CE1 . TYR B 171 ? 0.8182 1.5416 1.3483 0.2087 -0.1932 -0.0318 192 TYR B CE1 4321 C CE2 . TYR B 171 ? 0.6963 1.4551 1.2479 0.2111 -0.1981 -0.0158 192 TYR B CE2 4322 C CZ . TYR B 171 ? 0.7731 1.5119 1.3176 0.2157 -0.1946 -0.0264 192 TYR B CZ 4323 O OH . TYR B 171 ? 0.7986 1.5326 1.3506 0.2274 -0.1922 -0.0317 192 TYR B OH 4324 N N . THR B 172 ? 0.7309 1.4328 1.2189 0.1505 -0.2018 -0.0072 193 THR B N 4325 C CA . THR B 172 ? 0.6685 1.3649 1.1462 0.1395 -0.1998 -0.0061 193 THR B CA 4326 C C . THR B 172 ? 0.7334 1.4166 1.2036 0.1426 -0.1956 -0.0154 193 THR B C 4327 O O . THR B 172 ? 0.7612 1.4288 1.2290 0.1483 -0.1956 -0.0225 193 THR B O 4328 C CB . THR B 172 ? 0.5994 1.2807 1.0690 0.1266 -0.2034 0.0002 193 THR B CB 4329 O OG1 . THR B 172 ? 0.5592 1.2202 1.0167 0.1200 -0.2010 -0.0039 193 THR B OG1 4330 C CG2 . THR B 172 ? 0.5772 1.2470 1.0483 0.1294 -0.2081 0.0019 193 THR B CG2 4331 N N . CYS B 173 ? 0.7154 1.4053 1.1817 0.1387 -0.1921 -0.0153 194 CYS B N 4332 C CA . CYS B 173 ? 0.6727 1.3549 1.1327 0.1422 -0.1881 -0.0233 194 CYS B CA 4333 C C . CYS B 173 ? 0.6201 1.2823 1.0690 0.1324 -0.1876 -0.0232 194 CYS B C 4334 O O . CYS B 173 ? 0.5888 1.2520 1.0343 0.1224 -0.1871 -0.0165 194 CYS B O 4335 C CB . CYS B 173 ? 0.6961 1.3993 1.1590 0.1458 -0.1840 -0.0231 194 CYS B CB 4336 S SG . CYS B 173 ? 1.2536 1.9513 1.7084 0.1498 -0.1794 -0.0313 194 CYS B SG 4337 N N . VAL B 174 ? 0.6020 1.2462 1.0454 0.1351 -0.1871 -0.0311 195 VAL B N 4338 C CA . VAL B 174 ? 0.6050 1.2314 1.0392 0.1272 -0.1858 -0.0323 195 VAL B CA 4339 C C . VAL B 174 ? 0.5341 1.1640 0.9652 0.1312 -0.1817 -0.0374 195 VAL B C 4340 O O . VAL B 174 ? 0.5085 1.1399 0.9407 0.1401 -0.1808 -0.0454 195 VAL B O 4341 C CB . VAL B 174 ? 0.6681 1.2710 1.0979 0.1256 -0.1880 -0.0373 195 VAL B CB 4342 C CG1 . VAL B 174 ? 0.7073 1.3092 1.1408 0.1369 -0.1883 -0.0460 195 VAL B CG1 4343 C CG2 . VAL B 174 ? 0.5932 1.1794 1.0148 0.1192 -0.1860 -0.0404 195 VAL B CG2 4344 N N . VAL B 175 ? 0.4553 1.0865 0.8823 0.1244 -0.1791 -0.0325 196 VAL B N 4345 C CA . VAL B 175 ? 0.4624 1.0974 0.8860 0.1278 -0.1753 -0.0355 196 VAL B CA 4346 C C . VAL B 175 ? 0.5161 1.1318 0.9330 0.1226 -0.1742 -0.0381 196 VAL B C 4347 O O . VAL B 175 ? 0.5184 1.1215 0.9321 0.1128 -0.1745 -0.0340 196 VAL B O 4348 C CB . VAL B 175 ? 0.5093 1.1618 0.9339 0.1258 -0.1723 -0.0279 196 VAL B CB 4349 C CG1 . VAL B 175 ? 0.5665 1.2258 0.9948 0.1187 -0.1739 -0.0199 196 VAL B CG1 4350 C CG2 . VAL B 175 ? 0.5159 1.1608 0.9338 0.1210 -0.1687 -0.0257 196 VAL B CG2 4351 N N . THR B 176 ? 0.5369 1.1510 0.9516 0.1290 -0.1728 -0.0453 197 THR B N 4352 C CA . THR B 176 ? 0.5344 1.1321 0.9443 0.1256 -0.1718 -0.0489 197 THR B CA 4353 C C . THR B 176 ? 0.6091 1.2137 1.0163 0.1281 -0.1682 -0.0479 197 THR B C 4354 O O . THR B 176 ? 0.6620 1.2818 1.0699 0.1360 -0.1672 -0.0498 197 THR B O 4355 C CB . THR B 176 ? 0.5002 1.0876 0.9101 0.1304 -0.1738 -0.0595 197 THR B CB 4356 O OG1 . THR B 176 ? 0.5542 1.1312 0.9654 0.1272 -0.1769 -0.0595 197 THR B OG1 4357 C CG2 . THR B 176 ? 0.4004 0.9738 0.8065 0.1275 -0.1725 -0.0639 197 THR B CG2 4358 N N . ASN B 177 ? 0.6242 1.2172 1.0281 0.1213 -0.1662 -0.0447 198 ASN B N 4359 C CA . ASN B 177 ? 0.6633 1.2597 1.0646 0.1239 -0.1628 -0.0435 198 ASN B CA 4360 C C . ASN B 177 ? 0.6576 1.2455 1.0581 0.1278 -0.1637 -0.0526 198 ASN B C 4361 O O . ASN B 177 ? 0.6497 1.2212 1.0495 0.1222 -0.1636 -0.0544 198 ASN B O 4362 C CB . ASN B 177 ? 0.7107 1.2991 1.1100 0.1149 -0.1595 -0.0350 198 ASN B CB 4363 C CG . ASN B 177 ? 0.7029 1.2965 1.0999 0.1184 -0.1556 -0.0314 198 ASN B CG 4364 O OD1 . ASN B 177 ? 0.7150 1.3132 1.1111 0.1261 -0.1559 -0.0364 198 ASN B OD1 4365 N ND2 . ASN B 177 ? 0.6691 1.2620 1.0647 0.1123 -0.1518 -0.0223 198 ASN B ND2 4366 N N . THR B 178 ? 0.6202 1.2199 1.0208 0.1370 -0.1644 -0.0586 199 THR B N 4367 C CA . THR B 178 ? 0.6391 1.2334 1.0396 0.1408 -0.1658 -0.0688 199 THR B CA 4368 C C . THR B 178 ? 0.6510 1.2356 1.0504 0.1379 -0.1640 -0.0685 199 THR B C 4369 O O . THR B 178 ? 0.6051 1.1805 1.0053 0.1379 -0.1653 -0.0766 199 THR B O 4370 C CB . THR B 178 ? 0.6669 1.2786 1.0671 0.1505 -0.1661 -0.0747 199 THR B CB 4371 O OG1 . THR B 178 ? 0.6986 1.3238 1.0959 0.1534 -0.1636 -0.0678 199 THR B OG1 4372 C CG2 . THR B 178 ? 0.6416 1.2613 1.0446 0.1540 -0.1677 -0.0774 199 THR B CG2 4373 N N . VAL B 179 ? 0.6947 1.2808 1.0927 0.1354 -0.1609 -0.0593 200 VAL B N 4374 C CA . VAL B 179 ? 0.7404 1.3175 1.1383 0.1332 -0.1587 -0.0580 200 VAL B CA 4375 C C . VAL B 179 ? 0.8096 1.3663 1.2089 0.1235 -0.1582 -0.0580 200 VAL B C 4376 O O . VAL B 179 ? 0.8071 1.3535 1.2082 0.1224 -0.1585 -0.0643 200 VAL B O 4377 C CB . VAL B 179 ? 0.7335 1.3178 1.1293 0.1340 -0.1548 -0.0476 200 VAL B CB 4378 C CG1 . VAL B 179 ? 0.6768 1.2499 1.0737 0.1318 -0.1520 -0.0456 200 VAL B CG1 4379 C CG2 . VAL B 179 ? 0.7720 1.3760 1.1650 0.1434 -0.1551 -0.0477 200 VAL B CG2 4380 N N . THR B 180 ? 0.8365 1.3884 1.2350 0.1161 -0.1573 -0.0513 201 THR B N 4381 C CA . THR B 180 ? 0.8071 1.3404 1.2058 0.1056 -0.1565 -0.0506 201 THR B CA 4382 C C . THR B 180 ? 0.7298 1.2554 1.1283 0.1028 -0.1604 -0.0565 201 THR B C 4383 O O . THR B 180 ? 0.6859 1.1948 1.0837 0.0954 -0.1604 -0.0590 201 THR B O 4384 C CB . THR B 180 ? 0.8190 1.3505 1.2163 0.0974 -0.1532 -0.0404 201 THR B CB 4385 O OG1 . THR B 180 ? 0.8261 1.3696 1.2229 0.0980 -0.1552 -0.0367 201 THR B OG1 4386 C CG2 . THR B 180 ? 0.8229 1.3594 1.2201 0.0999 -0.1485 -0.0338 201 THR B CG2 4387 N N . ASN B 181 ? 0.7285 1.2658 1.1274 0.1090 -0.1632 -0.0586 202 ASN B N 4388 C CA . ASN B 181 ? 0.8049 1.3363 1.2039 0.1076 -0.1668 -0.0626 202 ASN B CA 4389 C C . ASN B 181 ? 0.8018 1.3288 1.1994 0.0987 -0.1673 -0.0549 202 ASN B C 4390 O O . ASN B 181 ? 0.8016 1.3210 1.1987 0.0957 -0.1702 -0.0564 202 ASN B O 4391 C CB . ASN B 181 ? 0.8981 1.4132 1.2967 0.1058 -0.1680 -0.0717 202 ASN B CB 4392 C CG . ASN B 181 ? 0.9928 1.5044 1.3917 0.1083 -0.1714 -0.0777 202 ASN B CG 4393 O OD1 . ASN B 181 ? 1.0031 1.5233 1.4027 0.1109 -0.1732 -0.0745 202 ASN B OD1 4394 N ND2 . ASN B 181 ? 1.0656 1.5645 1.4640 0.1077 -0.1721 -0.0865 202 ASN B ND2 4395 N N . HIS B 182 ? 0.7855 1.3176 1.1825 0.0944 -0.1644 -0.0463 203 HIS B N 4396 C CA . HIS B 182 ? 0.7311 1.2631 1.1269 0.0857 -0.1647 -0.0387 203 HIS B CA 4397 C C . HIS B 182 ? 0.7291 1.2755 1.1277 0.0910 -0.1681 -0.0377 203 HIS B C 4398 O O . HIS B 182 ? 0.7257 1.2864 1.1268 0.1010 -0.1684 -0.0401 203 HIS B O 4399 C CB . HIS B 182 ? 0.7154 1.2519 1.1104 0.0807 -0.1601 -0.0305 203 HIS B CB 4400 C CG . HIS B 182 ? 0.8029 1.3396 1.1964 0.0702 -0.1600 -0.0231 203 HIS B CG 4401 N ND1 . HIS B 182 ? 0.8628 1.4095 1.2563 0.0667 -0.1565 -0.0153 203 HIS B ND1 4402 C CD2 . HIS B 182 ? 0.7908 1.3195 1.1822 0.0622 -0.1628 -0.0224 203 HIS B CD2 4403 C CE1 . HIS B 182 ? 0.8449 1.3906 1.2368 0.0564 -0.1573 -0.0105 203 HIS B CE1 4404 N NE2 . HIS B 182 ? 0.8231 1.3581 1.2134 0.0537 -0.1614 -0.0144 203 HIS B NE2 4405 N N . LYS B 183 ? 0.7255 1.2687 1.1235 0.0845 -0.1706 -0.0341 204 LYS B N 4406 C CA . LYS B 183 ? 0.7148 1.2691 1.1165 0.0899 -0.1744 -0.0339 204 LYS B CA 4407 C C . LYS B 183 ? 0.6592 1.2201 1.0614 0.0820 -0.1757 -0.0252 204 LYS B C 4408 O O . LYS B 183 ? 0.5927 1.1414 0.9906 0.0710 -0.1758 -0.0218 204 LYS B O 4409 C CB . LYS B 183 ? 0.7982 1.3388 1.1992 0.0923 -0.1777 -0.0409 204 LYS B CB 4410 C CG . LYS B 183 ? 0.8714 1.4224 1.2773 0.1034 -0.1800 -0.0455 204 LYS B CG 4411 C CD . LYS B 183 ? 0.8717 1.4062 1.2761 0.1048 -0.1825 -0.0525 204 LYS B CD 4412 C CE . LYS B 183 ? 0.8262 1.3502 1.2282 0.1070 -0.1806 -0.0616 204 LYS B CE 4413 N NZ . LYS B 183 ? 0.8556 1.3926 1.2612 0.1183 -0.1797 -0.0683 204 LYS B NZ 4414 N N . VAL B 184 ? 0.6499 1.2310 1.0574 0.0873 -0.1765 -0.0217 205 VAL B N 4415 C CA . VAL B 184 ? 0.6205 1.2116 1.0298 0.0803 -0.1780 -0.0135 205 VAL B CA 4416 C C . VAL B 184 ? 0.6483 1.2537 1.0647 0.0883 -0.1819 -0.0133 205 VAL B C 4417 O O . VAL B 184 ? 0.6614 1.2758 1.0821 0.0996 -0.1816 -0.0182 205 VAL B O 4418 C CB . VAL B 184 ? 0.6138 1.2184 1.0236 0.0765 -0.1738 -0.0073 205 VAL B CB 4419 C CG1 . VAL B 184 ? 0.6040 1.1938 1.0075 0.0681 -0.1694 -0.0064 205 VAL B CG1 4420 C CG2 . VAL B 184 ? 0.6399 1.2620 1.0541 0.0882 -0.1719 -0.0092 205 VAL B CG2 4421 N N . LEU B 185 ? 0.6132 1.2203 1.0308 0.0821 -0.1854 -0.0079 206 LEU B N 4422 C CA . LEU B 185 ? 0.5829 1.2045 1.0085 0.0894 -0.1892 -0.0064 206 LEU B CA 4423 C C . LEU B 185 ? 0.6099 1.2546 1.0411 0.0865 -0.1889 0.0010 206 LEU B C 4424 O O . LEU B 185 ? 0.6020 1.2471 1.0296 0.0746 -0.1881 0.0070 206 LEU B O 4425 C CB . LEU B 185 ? 0.6014 1.2106 1.0253 0.0857 -0.1940 -0.0049 206 LEU B CB 4426 C CG . LEU B 185 ? 0.7170 1.3001 1.1334 0.0841 -0.1944 -0.0109 206 LEU B CG 4427 C CD1 . LEU B 185 ? 0.7343 1.3069 1.1483 0.0800 -0.1991 -0.0075 206 LEU B CD1 4428 C CD2 . LEU B 185 ? 0.7692 1.3491 1.1879 0.0965 -0.1930 -0.0203 206 LEU B CD2 4429 N N . GLY B 186 ? 0.6172 1.2816 1.0577 0.0969 -0.1891 0.0003 207 GLY B N 4430 C CA . GLY B 186 ? 0.6783 1.3670 1.1256 0.0953 -0.1887 0.0066 207 GLY B CA 4431 C C . GLY B 186 ? 0.7362 1.4345 1.1900 0.0931 -0.1940 0.0123 207 GLY B C 4432 O O . GLY B 186 ? 0.7293 1.4149 1.1820 0.0941 -0.1980 0.0116 207 GLY B O 4433 N N . PRO B 187 ? 0.7844 1.5057 1.2448 0.0898 -0.1939 0.0185 208 PRO B N 4434 C CA . PRO B 187 ? 0.7498 1.4843 1.2179 0.0879 -0.1992 0.0246 208 PRO B CA 4435 C C . PRO B 187 ? 0.7665 1.5073 1.2448 0.1025 -0.2020 0.0215 208 PRO B C 4436 O O . PRO B 187 ? 0.6484 1.3957 1.1313 0.1134 -0.1988 0.0158 208 PRO B O 4437 C CB . PRO B 187 ? 0.7375 1.4979 1.2117 0.0830 -0.1971 0.0299 208 PRO B CB 4438 C CG . PRO B 187 ? 0.7439 1.4979 1.2098 0.0779 -0.1909 0.0280 208 PRO B CG 4439 C CD . PRO B 187 ? 0.8055 1.5423 1.2671 0.0876 -0.1889 0.0201 208 PRO B CD 4440 N N . PRO B 188 ? 0.8509 1.5896 1.3324 0.1025 -0.2076 0.0254 209 PRO B N 4441 C CA . PRO B 188 ? 0.8509 1.5949 1.3428 0.1162 -0.2101 0.0235 209 PRO B CA 4442 C C . PRO B 188 ? 0.8037 1.5790 1.3107 0.1223 -0.2101 0.0267 209 PRO B C 4443 O O . PRO B 188 ? 0.8873 1.6799 1.3981 0.1141 -0.2121 0.0340 209 PRO B O 4444 C CB . PRO B 188 ? 0.8676 1.6000 1.3569 0.1117 -0.2162 0.0291 209 PRO B CB 4445 C CG . PRO B 188 ? 0.9123 1.6297 1.3877 0.0956 -0.2162 0.0319 209 PRO B CG 4446 C CD . PRO B 188 ? 0.8984 1.6289 1.3730 0.0893 -0.2116 0.0321 209 PRO B CD 4447 N N . THR B 189 ? 0.6988 1.4819 1.2143 0.1360 -0.2075 0.0208 210 THR B N 4448 C CA . THR B 189 ? 0.7112 1.5237 1.2426 0.1433 -0.2072 0.0231 210 THR B CA 4449 C C . THR B 189 ? 0.6558 1.4693 1.1980 0.1554 -0.2103 0.0229 210 THR B C 4450 O O . THR B 189 ? 0.6324 1.4296 1.1725 0.1644 -0.2086 0.0157 210 THR B O 4451 C CB . THR B 189 ? 0.7341 1.5592 1.2679 0.1491 -0.2007 0.0170 210 THR B CB 4452 O OG1 . THR B 189 ? 0.7696 1.6217 1.3199 0.1579 -0.2000 0.0180 210 THR B OG1 4453 C CG2 . THR B 189 ? 0.7138 1.5193 1.2407 0.1573 -0.1973 0.0072 210 THR B CG2 4454 N N . PRO B 190 ? 0.6184 1.4509 1.1723 0.1554 -0.2148 0.0309 211 PRO B N 4455 C CA . PRO B 190 ? 0.6243 1.4596 1.1900 0.1675 -0.2177 0.0322 211 PRO B CA 4456 C C . PRO B 190 ? 0.6924 1.5488 1.2735 0.1808 -0.2133 0.0275 211 PRO B C 4457 O O . PRO B 190 ? 0.7494 1.6287 1.3363 0.1786 -0.2104 0.0277 211 PRO B O 4458 C CB . PRO B 190 ? 0.5764 1.4276 1.1487 0.1606 -0.2243 0.0436 211 PRO B CB 4459 C CG . PRO B 190 ? 0.5783 1.4285 1.1386 0.1433 -0.2249 0.0473 211 PRO B CG 4460 C CD . PRO B 190 ? 0.6086 1.4581 1.1635 0.1428 -0.2179 0.0398 211 PRO B CD 4461 N N . LEU B 191 ? 0.6858 1.5341 1.2732 0.1939 -0.2123 0.0228 212 LEU B N 4462 C CA . LEU B 191 ? 0.7339 1.6028 1.3375 0.2070 -0.2082 0.0189 212 LEU B CA 4463 C C . LEU B 191 ? 0.8154 1.6875 1.4328 0.2175 -0.2114 0.0233 212 LEU B C 4464 O O . LEU B 191 ? 0.9038 1.7533 1.5152 0.2180 -0.2149 0.0253 212 LEU B O 4465 C CB . LEU B 191 ? 0.7166 1.5746 1.3148 0.2141 -0.2010 0.0066 212 LEU B CB 4466 C CG . LEU B 191 ? 0.7254 1.5617 1.3226 0.2250 -0.1989 -0.0011 212 LEU B CG 4467 C CD1 . LEU B 191 ? 0.7332 1.5836 1.3491 0.2385 -0.1977 -0.0007 212 LEU B CD1 4468 C CD2 . LEU B 191 ? 0.7308 1.5577 1.3187 0.2272 -0.1925 -0.0130 212 LEU B CD2 4469 N N . ILE B 192 ? 0.7816 1.6820 1.4179 0.2256 -0.2101 0.0251 213 ILE B N 4470 C CA . ILE B 192 ? 0.7689 1.6762 1.4208 0.2360 -0.2132 0.0307 213 ILE B CA 4471 C C . ILE B 192 ? 0.7905 1.7164 1.4601 0.2503 -0.2070 0.0249 213 ILE B C 4472 O O . ILE B 192 ? 0.8870 1.8271 1.5583 0.2503 -0.2012 0.0185 213 ILE B O 4473 C CB . ILE B 192 ? 0.7347 1.6639 1.3948 0.2289 -0.2206 0.0434 213 ILE B CB 4474 C CG1 . ILE B 192 ? 0.6784 1.6428 1.3502 0.2260 -0.2182 0.0443 213 ILE B CG1 4475 C CG2 . ILE B 192 ? 0.7616 1.6729 1.4035 0.2135 -0.2261 0.0488 213 ILE B CG2 4476 C CD1 . ILE B 192 ? 0.6685 1.6558 1.3462 0.2159 -0.2251 0.0558 213 ILE B CD1 4477 N N . LEU B 193 ? 0.7104 1.6356 1.3928 0.2623 -0.2077 0.0272 214 LEU B N 4478 C CA . LEU B 193 ? 0.6870 1.6284 1.3873 0.2765 -0.2012 0.0216 214 LEU B CA 4479 C C . LEU B 193 ? 0.7327 1.7127 1.4544 0.2788 -0.2030 0.0290 214 LEU B C 4480 O O . LEU B 193 ? 0.6244 1.6151 1.3529 0.2759 -0.2105 0.0405 214 LEU B O 4481 C CB . LEU B 193 ? 0.6605 1.5808 1.3647 0.2893 -0.1998 0.0195 214 LEU B CB 4482 C CG . LEU B 193 ? 0.6717 1.5550 1.3577 0.2894 -0.1964 0.0100 214 LEU B CG 4483 C CD1 . LEU B 193 ? 0.7195 1.5873 1.4132 0.3033 -0.1930 0.0070 214 LEU B CD1 4484 C CD2 . LEU B 193 ? 0.5738 1.4566 1.2507 0.2867 -0.1894 -0.0023 214 LEU B CD2 4485 N N . ARG B 194 ? 0.8001 1.8015 1.5323 0.2837 -0.1959 0.0222 215 ARG B N 4486 C CA . ARG B 194 ? 0.8330 1.8720 1.5879 0.2877 -0.1960 0.0274 215 ARG B CA 4487 C C . ARG B 194 ? 0.9838 2.0254 1.7575 0.3036 -0.1951 0.0293 215 ARG B C 4488 O O . ARG B 194 ? 1.0139 2.0297 1.7829 0.3123 -0.1913 0.0230 215 ARG B O 4489 C CB . ARG B 194 ? 0.7935 1.8530 1.5527 0.2877 -0.1876 0.0188 215 ARG B CB 4490 C CG . ARG B 194 ? 0.8170 1.8753 1.5585 0.2726 -0.1874 0.0173 215 ARG B CG 4491 C CD . ARG B 194 ? 0.8450 1.9227 1.5905 0.2737 -0.1786 0.0090 215 ARG B CD 4492 N NE . ARG B 194 ? 0.8658 1.9796 1.6355 0.2791 -0.1769 0.0122 215 ARG B NE 4493 C CZ . ARG B 194 ? 0.8269 1.9692 1.6030 0.2700 -0.1780 0.0173 215 ARG B CZ 4494 N NH1 . ARG B 194 ? 0.7684 1.9056 1.5275 0.2550 -0.1803 0.0198 215 ARG B NH1 4495 N NH2 . ARG B 194 ? 0.8146 1.9901 1.6141 0.2758 -0.1761 0.0194 215 ARG B NH2 4496 N N . ASN B 195 ? 1.0532 2.1259 1.8481 0.3071 -0.1985 0.0380 216 ASN B N 4497 C CA . ASN B 195 ? 1.1077 2.1882 1.9238 0.3231 -0.1970 0.0403 216 ASN B CA 4498 C C . ASN B 195 ? 1.1799 2.2874 2.0146 0.3315 -0.1878 0.0326 216 ASN B C 4499 O O . ASN B 195 ? 1.2278 2.3446 2.0821 0.3457 -0.1841 0.0324 216 ASN B O 4500 C CB . ASN B 195 ? 1.0974 2.1963 1.9266 0.3224 -0.2069 0.0555 216 ASN B CB 4501 C CG . ASN B 195 ? 1.0996 2.2055 1.9510 0.3396 -0.2058 0.0594 216 ASN B CG 4502 O OD1 . ASN B 195 ? 1.1168 2.2060 1.9709 0.3516 -0.1979 0.0510 216 ASN B OD1 4503 N ND2 . ASN B 195 ? 1.0812 2.2122 1.9489 0.3406 -0.2137 0.0723 216 ASN B ND2 4504 N N . ASP B 196 ? 1.1978 2.3172 2.0254 0.3224 -0.1838 0.0264 217 ASP B N 4505 C CA . ASP B 196 ? 1.2171 2.3618 2.0590 0.3279 -0.1745 0.0184 217 ASP B CA 4506 C C . ASP B 196 ? 1.2238 2.3557 2.0735 0.3437 -0.1656 0.0089 217 ASP B C 4507 O O . ASP B 196 ? 1.2690 2.4203 2.1421 0.3555 -0.1625 0.0102 217 ASP B O 4508 C CB . ASP B 196 ? 1.2347 2.3791 2.0594 0.3161 -0.1701 0.0109 217 ASP B CB 4509 C CG . ASP B 196 ? 1.2508 2.4289 2.0901 0.3172 -0.1624 0.0060 217 ASP B CG 4510 O OD1 . ASP B 196 ? 1.2572 2.4512 2.1175 0.3298 -0.1571 0.0033 217 ASP B OD1 4511 O OD2 . ASP B 196 ? 1.2475 2.4356 2.0770 0.3051 -0.1613 0.0049 217 ASP B OD2 4512 N N . GLY B 197 ? 1.1703 2.2699 2.0006 0.3436 -0.1613 -0.0008 218 GLY B N 4513 C CA . GLY B 197 ? 1.1131 2.1968 1.9471 0.3567 -0.1523 -0.0111 218 GLY B CA 4514 C C . GLY B 197 ? 1.0779 2.1302 1.8873 0.3522 -0.1482 -0.0225 218 GLY B C 4515 O O . GLY B 197 ? 1.0326 2.0801 1.8241 0.3398 -0.1510 -0.0229 218 GLY B O 4516 N N . VAL B 198 ? 1.0657 2.0968 1.8743 0.3621 -0.1411 -0.0317 219 VAL B N 4517 C CA . VAL B 198 ? 1.0189 2.0203 1.8052 0.3584 -0.1371 -0.0431 219 VAL B CA 4518 C C . VAL B 198 ? 1.0062 2.0191 1.7896 0.3580 -0.1271 -0.0562 219 VAL B C 4519 O O . VAL B 198 ? 0.9767 2.0086 1.7770 0.3664 -0.1194 -0.0608 219 VAL B O 4520 C CB . VAL B 198 ? 0.9857 1.9553 1.7695 0.3675 -0.1344 -0.0472 219 VAL B CB 4521 C CG1 . VAL B 198 ? 0.9737 1.9168 1.7365 0.3641 -0.1289 -0.0609 219 VAL B CG1 4522 C CG2 . VAL B 198 ? 0.9557 1.9091 1.7367 0.3659 -0.1446 -0.0345 219 VAL B CG2 4523 N N . MET B 199 ? 0.9930 1.9945 1.7551 0.3481 -0.1271 -0.0619 220 MET B N 4524 C CA . MET B 199 ? 0.9558 1.9659 1.7116 0.3465 -0.1183 -0.0740 220 MET B CA 4525 C C . MET B 199 ? 0.9654 1.9530 1.7153 0.3535 -0.1101 -0.0878 220 MET B C 4526 O O . MET B 199 ? 0.9499 1.9077 1.6881 0.3534 -0.1125 -0.0895 220 MET B O 4527 C CB . MET B 199 ? 0.9020 1.9101 1.6375 0.3330 -0.1219 -0.0737 220 MET B CB 4528 C CG . MET B 199 ? 0.8656 1.8906 1.5964 0.3302 -0.1139 -0.0827 220 MET B CG 4529 S SD . MET B 199 ? 2.1966 3.2121 2.9007 0.3159 -0.1173 -0.0833 220 MET B SD 4530 C CE . MET B 199 ? 1.2670 2.3102 1.9717 0.3143 -0.1078 -0.0909 220 MET B CE 4531 N N . GLY B 200 ? 0.9859 1.9880 1.7434 0.3589 -0.0999 -0.0978 221 GLY B N 4532 C CA . GLY B 200 ? 0.9839 1.9674 1.7372 0.3653 -0.0909 -0.1117 221 GLY B CA 4533 C C . GLY B 200 ? 0.9508 1.9227 1.6815 0.3575 -0.0880 -0.1228 221 GLY B C 4534 O O . GLY B 200 ? 0.9181 1.8989 1.6373 0.3479 -0.0920 -0.1197 221 GLY B O 4535 N N . GLU B 201 ? 0.9845 1.9369 1.7088 0.3615 -0.0808 -0.1356 222 GLU B N 4536 C CA . GLU B 201 ? 1.0349 1.9746 1.7377 0.3547 -0.0781 -0.1471 222 GLU B CA 4537 C C . GLU B 201 ? 1.0103 1.9752 1.7084 0.3496 -0.0732 -0.1522 222 GLU B C 4538 O O . GLU B 201 ? 0.9528 1.9394 1.6643 0.3542 -0.0661 -0.1549 222 GLU B O 4539 C CB . GLU B 201 ? 1.0951 2.0116 1.7944 0.3603 -0.0703 -0.1606 222 GLU B CB 4540 C CG . GLU B 201 ? 1.1209 2.0113 1.8249 0.3657 -0.0738 -0.1555 222 GLU B CG 4541 C CD . GLU B 201 ? 1.1559 2.0185 1.8512 0.3681 -0.0669 -0.1691 222 GLU B CD 4542 O OE1 . GLU B 201 ? 1.1796 2.0453 1.8676 0.3663 -0.0588 -0.1830 222 GLU B OE1 4543 O OE2 . GLU B 201 ? 1.1531 1.9904 1.8482 0.3710 -0.0696 -0.1658 222 GLU B OE2 4544 N N . TYR B 202 ? 1.0249 1.9863 1.7038 0.3400 -0.0771 -0.1533 223 TYR B N 4545 C CA . TYR B 202 ? 1.0752 2.0588 1.7469 0.3340 -0.0734 -0.1565 223 TYR B CA 4546 C C . TYR B 202 ? 1.1364 2.1076 1.7848 0.3265 -0.0740 -0.1642 223 TYR B C 4547 O O . TYR B 202 ? 1.1779 2.1250 1.8159 0.3243 -0.0791 -0.1647 223 TYR B O 4548 C CB . TYR B 202 ? 1.0632 2.0682 1.7403 0.3288 -0.0794 -0.1426 223 TYR B CB 4549 C CG . TYR B 202 ? 1.0643 2.0556 1.7314 0.3214 -0.0905 -0.1316 223 TYR B CG 4550 C CD1 . TYR B 202 ? 1.0520 2.0472 1.7034 0.3114 -0.0941 -0.1282 223 TYR B CD1 4551 C CD2 . TYR B 202 ? 1.0871 2.0612 1.7601 0.3243 -0.0970 -0.1246 223 TYR B CD2 4552 C CE1 . TYR B 202 ? 1.0496 2.0314 1.6918 0.3043 -0.1034 -0.1187 223 TYR B CE1 4553 C CE2 . TYR B 202 ? 1.0814 2.0428 1.7445 0.3168 -0.1066 -0.1152 223 TYR B CE2 4554 C CZ . TYR B 202 ? 1.0391 2.0043 1.6872 0.3067 -0.1095 -0.1126 223 TYR B CZ 4555 O OH . TYR B 202 ? 0.9785 1.9300 1.6168 0.2990 -0.1182 -0.1037 223 TYR B OH 4556 N N . GLU B 203 ? 1.1219 2.1107 1.7627 0.3225 -0.0687 -0.1700 224 GLU B N 4557 C CA . GLU B 203 ? 1.0795 2.0613 1.6986 0.3153 -0.0694 -0.1765 224 GLU B CA 4558 C C . GLU B 203 ? 1.0325 2.0022 1.6400 0.3081 -0.0800 -0.1663 224 GLU B C 4559 O O . GLU B 203 ? 1.0320 2.0085 1.6456 0.3057 -0.0859 -0.1533 224 GLU B O 4560 C CB . GLU B 203 ? 1.0821 2.0884 1.6951 0.3113 -0.0637 -0.1801 224 GLU B CB 4561 C CG . GLU B 203 ? 1.1230 2.1330 1.7334 0.3143 -0.0530 -0.1960 224 GLU B CG 4562 C CD . GLU B 203 ? 1.1268 2.1567 1.7244 0.3080 -0.0489 -0.1995 224 GLU B CD 4563 O OE1 . GLU B 203 ? 1.1141 2.1534 1.7049 0.3018 -0.0544 -0.1890 224 GLU B OE1 4564 O OE2 . GLU B 203 ? 1.1349 2.1703 1.7286 0.3090 -0.0402 -0.2125 224 GLU B OE2 4565 N N . PRO B 204 ? 0.9705 1.9228 1.5615 0.3040 -0.0821 -0.1725 225 PRO B N 4566 C CA . PRO B 204 ? 0.9262 1.8667 1.5049 0.2966 -0.0912 -0.1642 225 PRO B CA 4567 C C . PRO B 204 ? 0.9117 1.8708 1.4819 0.2896 -0.0926 -0.1573 225 PRO B C 4568 O O . PRO B 204 ? 0.9321 1.9066 1.4967 0.2888 -0.0867 -0.1638 225 PRO B O 4569 C CB . PRO B 204 ? 0.8936 1.8149 1.4578 0.2950 -0.0909 -0.1754 225 PRO B CB 4570 C CG . PRO B 204 ? 0.8969 1.8143 1.4683 0.3021 -0.0827 -0.1884 225 PRO B CG 4571 C CD . PRO B 204 ? 0.9410 1.8830 1.5243 0.3060 -0.0759 -0.1882 225 PRO B CD 4572 N N . LYS B 205 ? 0.8703 1.8273 1.4390 0.2842 -0.0999 -0.1444 226 LYS B N 4573 C CA . LYS B 205 ? 0.8882 1.8587 1.4472 0.2767 -0.1014 -0.1370 226 LYS B CA 4574 C C . LYS B 205 ? 0.9112 1.8636 1.4549 0.2696 -0.1086 -0.1319 226 LYS B C 4575 O O . LYS B 205 ? 0.9465 1.8863 1.4928 0.2671 -0.1149 -0.1235 226 LYS B O 4576 C CB . LYS B 205 ? 0.8529 1.8415 1.4246 0.2756 -0.1020 -0.1257 226 LYS B CB 4577 C CG . LYS B 205 ? 0.9101 1.9126 1.4721 0.2675 -0.1025 -0.1179 226 LYS B CG 4578 C CD . LYS B 205 ? 1.0194 2.0321 1.5692 0.2668 -0.0964 -0.1262 226 LYS B CD 4579 C CE . LYS B 205 ? 1.0542 2.0808 1.5944 0.2593 -0.0961 -0.1178 226 LYS B CE 4580 N NZ . LYS B 205 ? 1.0494 2.0600 1.5746 0.2522 -0.1027 -0.1102 226 LYS B NZ 4581 N N . ILE B 206 ? 0.8464 1.7981 1.3743 0.2663 -0.1076 -0.1371 227 ILE B N 4582 C CA . ILE B 206 ? 0.7960 1.7315 1.3095 0.2600 -0.1136 -0.1332 227 ILE B CA 4583 C C . ILE B 206 ? 0.7648 1.7038 1.2765 0.2533 -0.1177 -0.1188 227 ILE B C 4584 O O . ILE B 206 ? 0.7724 1.7300 1.2833 0.2510 -0.1148 -0.1140 227 ILE B O 4585 C CB . ILE B 206 ? 0.7583 1.6967 1.2558 0.2580 -0.1115 -0.1407 227 ILE B CB 4586 C CG1 . ILE B 206 ? 0.7372 1.6735 1.2361 0.2636 -0.1067 -0.1561 227 ILE B CG1 4587 C CG2 . ILE B 206 ? 0.7094 1.6310 1.1934 0.2522 -0.1177 -0.1366 227 ILE B CG2 4588 C CD1 . ILE B 206 ? 0.7290 1.6684 1.2122 0.2613 -0.1053 -0.1644 227 ILE B CD1 4589 N N . GLU B 207 ? 0.7461 1.6668 1.2567 0.2497 -0.1240 -0.1123 228 GLU B N 4590 C CA . GLU B 207 ? 0.7849 1.7067 1.2948 0.2427 -0.1277 -0.0990 228 GLU B CA 4591 C C . GLU B 207 ? 0.7294 1.6365 1.2234 0.2358 -0.1314 -0.0953 228 GLU B C 4592 O O . GLU B 207 ? 0.6978 1.6071 1.1872 0.2292 -0.1328 -0.0853 228 GLU B O 4593 C CB . GLU B 207 ? 0.8849 1.7998 1.4077 0.2430 -0.1318 -0.0929 228 GLU B CB 4594 C CG . GLU B 207 ? 0.9432 1.8610 1.4666 0.2351 -0.1354 -0.0797 228 GLU B CG 4595 C CD . GLU B 207 ? 0.9928 1.9365 1.5235 0.2341 -0.1314 -0.0746 228 GLU B CD 4596 O OE1 . GLU B 207 ? 0.9989 1.9585 1.5337 0.2397 -0.1258 -0.0814 228 GLU B OE1 4597 O OE2 . GLU B 207 ? 1.0049 1.9534 1.5372 0.2272 -0.1336 -0.0644 228 GLU B OE2 4598 N N . VAL B 208 ? 0.7209 1.6128 1.2068 0.2373 -0.1325 -0.1036 229 VAL B N 4599 C CA . VAL B 208 ? 0.7246 1.6041 1.1960 0.2318 -0.1354 -0.1015 229 VAL B CA 4600 C C . VAL B 208 ? 0.7599 1.6434 1.2213 0.2344 -0.1327 -0.1117 229 VAL B C 4601 O O . VAL B 208 ? 0.7911 1.6705 1.2550 0.2392 -0.1315 -0.1228 229 VAL B O 4602 C CB . VAL B 208 ? 0.6798 1.5346 1.1504 0.2294 -0.1406 -0.1013 229 VAL B CB 4603 C CG1 . VAL B 208 ? 0.6129 1.4579 1.0750 0.2213 -0.1439 -0.0911 229 VAL B CG1 4604 C CG2 . VAL B 208 ? 0.6897 1.5399 1.1740 0.2320 -0.1422 -0.0997 229 VAL B CG2 4605 N N . GLN B 209 ? 0.7533 1.6450 1.2033 0.2312 -0.1318 -0.1076 230 GLN B N 4606 C CA . GLN B 209 ? 0.7373 1.6347 1.1764 0.2329 -0.1299 -0.1160 230 GLN B CA 4607 C C . GLN B 209 ? 0.7158 1.6035 1.1415 0.2282 -0.1332 -0.1111 230 GLN B C 4608 O O . GLN B 209 ? 0.7245 1.6040 1.1486 0.2233 -0.1356 -0.1002 230 GLN B O 4609 C CB . GLN B 209 ? 0.7603 1.6817 1.1976 0.2346 -0.1245 -0.1166 230 GLN B CB 4610 C CG . GLN B 209 ? 0.8665 1.8009 1.3180 0.2387 -0.1204 -0.1191 230 GLN B CG 4611 C CD . GLN B 209 ? 0.9503 1.9081 1.3988 0.2399 -0.1145 -0.1211 230 GLN B CD 4612 O OE1 . GLN B 209 ? 0.9390 1.9030 1.3738 0.2384 -0.1136 -0.1225 230 GLN B OE1 4613 N NE2 . GLN B 209 ? 0.9935 1.9652 1.4547 0.2427 -0.1104 -0.1210 230 GLN B NE2 4614 N N . PHE B 210 ? 0.7472 1.6366 1.1635 0.2295 -0.1330 -0.1192 231 PHE B N 4615 C CA . PHE B 210 ? 0.7968 1.6818 1.2003 0.2261 -0.1354 -0.1143 231 PHE B CA 4616 C C . PHE B 210 ? 0.8660 1.7692 1.2610 0.2252 -0.1323 -0.1075 231 PHE B C 4617 O O . PHE B 210 ? 0.8972 1.8180 1.2935 0.2281 -0.1283 -0.1119 231 PHE B O 4618 C CB . PHE B 210 ? 0.7522 1.6324 1.1499 0.2276 -0.1371 -0.1256 231 PHE B CB 4619 C CG . PHE B 210 ? 0.7497 1.6452 1.1472 0.2318 -0.1335 -0.1382 231 PHE B CG 4620 C CD1 . PHE B 210 ? 0.7997 1.7115 1.1858 0.2320 -0.1320 -0.1405 231 PHE B CD1 4621 C CD2 . PHE B 210 ? 0.7346 1.6280 1.1430 0.2354 -0.1313 -0.1477 231 PHE B CD2 4622 C CE1 . PHE B 210 ? 0.7920 1.7185 1.1775 0.2350 -0.1283 -0.1528 231 PHE B CE1 4623 C CE2 . PHE B 210 ? 0.7622 1.6689 1.1706 0.2388 -0.1271 -0.1601 231 PHE B CE2 4624 C CZ . PHE B 210 ? 0.7927 1.7164 1.1896 0.2382 -0.1256 -0.1630 231 PHE B CZ 4625 N N . PRO B 211 ? 0.8999 1.7982 1.2862 0.2213 -0.1338 -0.0965 232 PRO B N 4626 C CA . PRO B 211 ? 0.9498 1.8625 1.3268 0.2200 -0.1308 -0.0880 232 PRO B CA 4627 C C . PRO B 211 ? 0.9897 1.9216 1.3594 0.2235 -0.1280 -0.0961 232 PRO B C 4628 O O . PRO B 211 ? 0.9922 1.9242 1.3613 0.2261 -0.1291 -0.1080 232 PRO B O 4629 C CB . PRO B 211 ? 0.9341 1.8342 1.3014 0.2168 -0.1334 -0.0791 232 PRO B CB 4630 C CG . PRO B 211 ? 0.8951 1.7743 1.2702 0.2144 -0.1370 -0.0787 232 PRO B CG 4631 C CD . PRO B 211 ? 0.8896 1.7671 1.2741 0.2178 -0.1379 -0.0916 232 PRO B CD 4632 N N . GLU B 212 ? 1.0399 1.9880 1.4038 0.2229 -0.1241 -0.0901 233 GLU B N 4633 C CA . GLU B 212 ? 1.1123 2.0795 1.4679 0.2253 -0.1212 -0.0971 233 GLU B CA 4634 C C . GLU B 212 ? 1.1012 2.0674 1.4425 0.2253 -0.1241 -0.0975 233 GLU B C 4635 O O . GLU B 212 ? 1.1412 2.1198 1.4764 0.2272 -0.1235 -0.1071 233 GLU B O 4636 C CB . GLU B 212 ? 1.1927 2.1771 1.5449 0.2240 -0.1162 -0.0899 233 GLU B CB 4637 C CG . GLU B 212 ? 1.2635 2.2546 1.6308 0.2248 -0.1126 -0.0922 233 GLU B CG 4638 C CD . GLU B 212 ? 1.3354 2.3488 1.6999 0.2245 -0.1065 -0.0911 233 GLU B CD 4639 O OE1 . GLU B 212 ? 1.3404 2.3635 1.7173 0.2262 -0.1028 -0.0964 233 GLU B OE1 4640 O OE2 . GLU B 212 ? 1.3741 2.3950 1.7238 0.2226 -0.1054 -0.0848 233 GLU B OE2 4641 N N . THR B 213 ? 1.0494 2.0013 1.3859 0.2229 -0.1272 -0.0871 234 THR B N 4642 C CA . THR B 213 ? 1.0429 1.9917 1.3683 0.2233 -0.1305 -0.0869 234 THR B CA 4643 C C . THR B 213 ? 0.9857 1.9119 1.3166 0.2219 -0.1348 -0.0857 234 THR B C 4644 O O . THR B 213 ? 0.9548 1.8676 1.2909 0.2191 -0.1350 -0.0766 234 THR B O 4645 C CB . THR B 213 ? 1.0735 2.0290 1.3846 0.2222 -0.1290 -0.0739 234 THR B CB 4646 O OG1 . THR B 213 ? 1.1121 2.0848 1.4205 0.2219 -0.1241 -0.0716 234 THR B OG1 4647 C CG2 . THR B 213 ? 1.0721 2.0346 1.3711 0.2241 -0.1316 -0.0771 234 THR B CG2 4648 N N . VAL B 214 ? 0.9218 1.8450 1.2517 0.2234 -0.1382 -0.0954 235 VAL B N 4649 C CA . VAL B 214 ? 0.8461 1.7488 1.1817 0.2220 -0.1421 -0.0965 235 VAL B CA 4650 C C . VAL B 214 ? 0.8338 1.7350 1.1608 0.2225 -0.1453 -0.0961 235 VAL B C 4651 O O . VAL B 214 ? 0.8212 1.7311 1.1455 0.2242 -0.1468 -0.1073 235 VAL B O 4652 C CB . VAL B 214 ? 0.7246 1.6211 1.0710 0.2231 -0.1431 -0.1105 235 VAL B CB 4653 C CG1 . VAL B 214 ? 0.6802 1.5546 1.0321 0.2209 -0.1468 -0.1107 235 VAL B CG1 4654 C CG2 . VAL B 214 ? 0.6528 1.5523 1.0087 0.2237 -0.1399 -0.1112 235 VAL B CG2 4655 N N . PRO B 215 ? 0.8510 1.7418 1.1741 0.2208 -0.1461 -0.0834 236 PRO B N 4656 C CA . PRO B 215 ? 0.8827 1.7706 1.2000 0.2215 -0.1493 -0.0823 236 PRO B CA 4657 C C . PRO B 215 ? 0.8685 1.7453 1.1938 0.2211 -0.1528 -0.0941 236 PRO B C 4658 O O . PRO B 215 ? 0.8877 1.7478 1.2224 0.2187 -0.1533 -0.0950 236 PRO B O 4659 C CB . PRO B 215 ? 0.8914 1.7653 1.2075 0.2193 -0.1485 -0.0667 236 PRO B CB 4660 C CG . PRO B 215 ? 0.9210 1.7988 1.2369 0.2178 -0.1443 -0.0585 236 PRO B CG 4661 C CD . PRO B 215 ? 0.8878 1.7703 1.2122 0.2180 -0.1436 -0.0695 236 PRO B CD 4662 N N . ALA B 216 ? 0.7536 1.6399 1.0748 0.2228 -0.1553 -0.1030 237 ALA B N 4663 C CA . ALA B 216 ? 0.7689 1.6462 1.0972 0.2221 -0.1583 -0.1153 237 ALA B CA 4664 C C . ALA B 216 ? 0.7981 1.6759 1.1226 0.2225 -0.1618 -0.1145 237 ALA B C 4665 O O . ALA B 216 ? 0.7051 1.6009 1.0216 0.2245 -0.1628 -0.1176 237 ALA B O 4666 C CB . ALA B 216 ? 0.7840 1.6732 1.1139 0.2232 -0.1575 -0.1310 237 ALA B CB 4667 N N . GLU B 217 ? 0.8597 1.7186 1.1900 0.2206 -0.1635 -0.1103 238 GLU B N 4668 C CA . GLU B 217 ? 0.8438 1.7023 1.1725 0.2212 -0.1666 -0.1086 238 GLU B CA 4669 C C . GLU B 217 ? 0.7973 1.6607 1.1293 0.2210 -0.1696 -0.1246 238 GLU B C 4670 O O . GLU B 217 ? 0.7665 1.6196 1.1059 0.2189 -0.1695 -0.1351 238 GLU B O 4671 C CB . GLU B 217 ? 0.8674 1.7038 1.2019 0.2188 -0.1668 -0.0992 238 GLU B CB 4672 C CG . GLU B 217 ? 0.9241 1.7611 1.2569 0.2203 -0.1690 -0.0939 238 GLU B CG 4673 C CD . GLU B 217 ? 0.9970 1.8115 1.3368 0.2174 -0.1688 -0.0866 238 GLU B CD 4674 O OE1 . GLU B 217 ? 1.0127 1.8112 1.3580 0.2137 -0.1671 -0.0861 238 GLU B OE1 4675 O OE2 . GLU B 217 ? 1.0221 1.8352 1.3621 0.2188 -0.1701 -0.0815 238 GLU B OE2 4676 N N . LYS B 218 ? 0.7878 1.6672 1.1141 0.2230 -0.1719 -0.1262 239 LYS B N 4677 C CA . LYS B 218 ? 0.7825 1.6695 1.1114 0.2223 -0.1747 -0.1416 239 LYS B CA 4678 C C . LYS B 218 ? 0.7894 1.6562 1.1286 0.2195 -0.1765 -0.1460 239 LYS B C 4679 O O . LYS B 218 ? 0.7988 1.6525 1.1410 0.2191 -0.1770 -0.1355 239 LYS B O 4680 C CB . LYS B 218 ? 0.8060 1.7149 1.1270 0.2248 -0.1774 -0.1407 239 LYS B CB 4681 C CG . LYS B 218 ? 0.8093 1.7133 1.1343 0.2254 -0.1807 -0.1361 239 LYS B CG 4682 C CD . LYS B 218 ? 0.8394 1.7681 1.1581 0.2277 -0.1839 -0.1388 239 LYS B CD 4683 C CE . LYS B 218 ? 0.8507 1.7765 1.1744 0.2291 -0.1872 -0.1326 239 LYS B CE 4684 N NZ . LYS B 218 ? 0.8439 1.7952 1.1603 0.2323 -0.1904 -0.1308 239 LYS B NZ 4685 N N . GLY B 219 ? 0.7844 1.6485 1.1291 0.2172 -0.1769 -0.1615 240 GLY B N 4686 C CA . GLY B 219 ? 0.7868 1.6318 1.1408 0.2139 -0.1782 -0.1671 240 GLY B CA 4687 C C . GLY B 219 ? 0.8064 1.6289 1.1665 0.2114 -0.1759 -0.1666 240 GLY B C 4688 O O . GLY B 219 ? 0.8344 1.6454 1.2006 0.2086 -0.1759 -0.1776 240 GLY B O 4689 N N . THR B 220 ? 0.7991 1.6159 1.1575 0.2121 -0.1738 -0.1537 241 THR B N 4690 C CA . THR B 220 ? 0.8012 1.5978 1.1653 0.2096 -0.1721 -0.1513 241 THR B CA 4691 C C . THR B 220 ? 0.7861 1.5841 1.1525 0.2099 -0.1702 -0.1621 241 THR B C 4692 O O . THR B 220 ? 0.7833 1.5974 1.1468 0.2118 -0.1698 -0.1723 241 THR B O 4693 C CB . THR B 220 ? 0.7884 1.5809 1.1501 0.2098 -0.1701 -0.1351 241 THR B CB 4694 O OG1 . THR B 220 ? 0.8150 1.6253 1.1703 0.2129 -0.1681 -0.1326 241 THR B OG1 4695 C CG2 . THR B 220 ? 0.7794 1.5687 1.1392 0.2097 -0.1710 -0.1236 241 THR B CG2 4696 N N . THR B 221 ? 0.7395 1.5208 1.1113 0.2081 -0.1689 -0.1596 242 THR B N 4697 C CA . THR B 221 ? 0.7936 1.5741 1.1689 0.2090 -0.1668 -0.1680 242 THR B CA 4698 C C . THR B 221 ? 0.8350 1.6165 1.2108 0.2103 -0.1645 -0.1580 242 THR B C 4699 O O . THR B 221 ? 0.8634 1.6305 1.2428 0.2078 -0.1645 -0.1489 242 THR B O 4700 C CB . THR B 221 ? 0.8280 1.5877 1.2104 0.2060 -0.1673 -0.1761 242 THR B CB 4701 O OG1 . THR B 221 ? 0.9123 1.6657 1.2992 0.2070 -0.1651 -0.1774 242 THR B OG1 4702 C CG2 . THR B 221 ? 0.8090 1.5500 1.1938 0.2020 -0.1691 -0.1675 242 THR B CG2 4703 N N . VAL B 222 ? 0.7929 1.5932 1.1653 0.2137 -0.1623 -0.1600 243 VAL B N 4704 C CA . VAL B 222 ? 0.7694 1.5746 1.1423 0.2150 -0.1598 -0.1509 243 VAL B CA 4705 C C . VAL B 222 ? 0.7046 1.5058 1.0850 0.2164 -0.1577 -0.1576 243 VAL B C 4706 O O . VAL B 222 ? 0.5679 1.3734 0.9499 0.2183 -0.1565 -0.1708 243 VAL B O 4707 C CB . VAL B 222 ? 0.8255 1.6539 1.1899 0.2178 -0.1581 -0.1477 243 VAL B CB 4708 C CG1 . VAL B 222 ? 0.8411 1.6734 1.1979 0.2171 -0.1602 -0.1399 243 VAL B CG1 4709 C CG2 . VAL B 222 ? 0.8714 1.7152 1.2344 0.2202 -0.1567 -0.1621 243 VAL B CG2 4710 N N . LYS B 223 ? 0.7045 1.4977 1.0900 0.2155 -0.1569 -0.1486 244 LYS B N 4711 C CA . LYS B 223 ? 0.7705 1.5598 1.1642 0.2174 -0.1551 -0.1527 244 LYS B CA 4712 C C . LYS B 223 ? 0.7945 1.6004 1.1892 0.2201 -0.1519 -0.1472 244 LYS B C 4713 O O . LYS B 223 ? 0.8019 1.6140 1.1927 0.2187 -0.1517 -0.1357 244 LYS B O 4714 C CB . LYS B 223 ? 0.8800 1.6476 1.2800 0.2140 -0.1570 -0.1472 244 LYS B CB 4715 C CG . LYS B 223 ? 0.9846 1.7350 1.3833 0.2103 -0.1600 -0.1505 244 LYS B CG 4716 C CD . LYS B 223 ? 1.0405 1.7715 1.4429 0.2057 -0.1618 -0.1418 244 LYS B CD 4717 C CE . LYS B 223 ? 1.0727 1.7890 1.4727 0.2013 -0.1643 -0.1431 244 LYS B CE 4718 N NZ . LYS B 223 ? 1.0847 1.7835 1.4868 0.1959 -0.1657 -0.1335 244 LYS B NZ 4719 N N . LEU B 224 ? 0.8089 1.6216 1.2091 0.2239 -0.1490 -0.1556 245 LEU B N 4720 C CA . LEU B 224 ? 0.7802 1.6090 1.1832 0.2266 -0.1455 -0.1515 245 LEU B CA 4721 C C . LEU B 224 ? 0.7528 1.5740 1.1677 0.2284 -0.1445 -0.1512 245 LEU B C 4722 O O . LEU B 224 ? 0.7625 1.5739 1.1828 0.2304 -0.1440 -0.1607 245 LEU B O 4723 C CB . LEU B 224 ? 0.7433 1.5917 1.1420 0.2299 -0.1422 -0.1617 245 LEU B CB 4724 C CG . LEU B 224 ? 0.7828 1.6422 1.1694 0.2285 -0.1434 -0.1619 245 LEU B CG 4725 C CD1 . LEU B 224 ? 0.8249 1.7053 1.2071 0.2311 -0.1398 -0.1719 245 LEU B CD1 4726 C CD2 . LEU B 224 ? 0.7912 1.6536 1.1717 0.2261 -0.1446 -0.1465 245 LEU B CD2 4727 N N . GLU B 225 ? 0.7415 1.5674 1.1604 0.2277 -0.1439 -0.1399 246 GLU B N 4728 C CA . GLU B 225 ? 0.7481 1.5690 1.1788 0.2294 -0.1434 -0.1376 246 GLU B CA 4729 C C . GLU B 225 ? 0.7203 1.5599 1.1578 0.2344 -0.1386 -0.1406 246 GLU B C 4730 O O . GLU B 225 ? 0.6889 1.5466 1.1223 0.2346 -0.1361 -0.1374 246 GLU B O 4731 C CB . GLU B 225 ? 0.7974 1.6117 1.2299 0.2247 -0.1461 -0.1235 246 GLU B CB 4732 C CG . GLU B 225 ? 0.8668 1.6586 1.2972 0.2198 -0.1503 -0.1207 246 GLU B CG 4733 C CD . GLU B 225 ? 0.8873 1.6739 1.3193 0.2144 -0.1522 -0.1072 246 GLU B CD 4734 O OE1 . GLU B 225 ? 0.9202 1.7214 1.3523 0.2136 -0.1503 -0.0995 246 GLU B OE1 4735 O OE2 . GLU B 225 ? 0.8566 1.6248 1.2894 0.2102 -0.1555 -0.1046 246 GLU B OE2 4736 N N . CYS B 226 ? 0.7419 1.5766 1.1897 0.2386 -0.1372 -0.1466 247 CYS B N 4737 C CA . CYS B 226 ? 0.7600 1.6111 1.2167 0.2438 -0.1322 -0.1492 247 CYS B CA 4738 C C . CYS B 226 ? 0.7825 1.6232 1.2524 0.2478 -0.1319 -0.1507 247 CYS B C 4739 O O . CYS B 226 ? 0.8304 1.6565 1.3015 0.2499 -0.1318 -0.1597 247 CYS B O 4740 C CB . CYS B 226 ? 0.7828 1.6472 1.2348 0.2469 -0.1274 -0.1617 247 CYS B CB 4741 S SG . CYS B 226 ? 1.7395 2.6286 2.1997 0.2519 -0.1203 -0.1643 247 CYS B SG 4742 N N . PHE B 227 ? 0.7049 1.5532 1.1846 0.2488 -0.1317 -0.1418 248 PHE B N 4743 C CA . PHE B 227 ? 0.7099 1.5503 1.2028 0.2531 -0.1320 -0.1411 248 PHE B CA 4744 C C . PHE B 227 ? 0.7155 1.5763 1.2203 0.2566 -0.1286 -0.1362 248 PHE B C 4745 O O . PHE B 227 ? 0.7306 1.6063 1.2337 0.2531 -0.1286 -0.1280 248 PHE B O 4746 C CB . PHE B 227 ? 0.7254 1.5466 1.2184 0.2484 -0.1382 -0.1322 248 PHE B CB 4747 C CG . PHE B 227 ? 0.7454 1.5547 1.2497 0.2527 -0.1392 -0.1321 248 PHE B CG 4748 C CD1 . PHE B 227 ? 0.7646 1.5557 1.2681 0.2556 -0.1385 -0.1418 248 PHE B CD1 4749 C CD2 . PHE B 227 ? 0.7180 1.5345 1.2336 0.2536 -0.1407 -0.1221 248 PHE B CD2 4750 C CE1 . PHE B 227 ? 0.7915 1.5703 1.3045 0.2597 -0.1391 -0.1409 248 PHE B CE1 4751 C CE2 . PHE B 227 ? 0.6966 1.5025 1.2223 0.2579 -0.1419 -0.1210 248 PHE B CE2 4752 C CZ . PHE B 227 ? 0.7508 1.5372 1.2750 0.2612 -0.1410 -0.1301 248 PHE B CZ 4753 N N . ALA B 228 ? 0.6827 1.5437 1.1998 0.2635 -0.1255 -0.1411 249 ALA B N 4754 C CA . ALA B 228 ? 0.7372 1.6189 1.2676 0.2678 -0.1217 -0.1377 249 ALA B CA 4755 C C . ALA B 228 ? 0.7052 1.5809 1.2506 0.2720 -0.1236 -0.1321 249 ALA B C 4756 O O . ALA B 228 ? 0.6931 1.5476 1.2388 0.2731 -0.1267 -0.1332 249 ALA B O 4757 C CB . ALA B 228 ? 0.7503 1.6452 1.2822 0.2733 -0.1136 -0.1499 249 ALA B CB 4758 N N . LEU B 229 ? 0.6969 1.5922 1.2548 0.2742 -0.1220 -0.1257 250 LEU B N 4759 C CA . LEU B 229 ? 0.7164 1.6109 1.2905 0.2795 -0.1232 -0.1207 250 LEU B CA 4760 C C . LEU B 229 ? 0.7630 1.6648 1.3482 0.2891 -0.1156 -0.1306 250 LEU B C 4761 O O . LEU B 229 ? 0.7348 1.6421 1.3141 0.2904 -0.1095 -0.1414 250 LEU B O 4762 C CB . LEU B 229 ? 0.6532 1.5662 1.2359 0.2762 -0.1261 -0.1078 250 LEU B CB 4763 C CG . LEU B 229 ? 0.6180 1.5272 1.1889 0.2657 -0.1319 -0.0984 250 LEU B CG 4764 C CD1 . LEU B 229 ? 0.6132 1.5407 1.1943 0.2621 -0.1342 -0.0864 250 LEU B CD1 4765 C CD2 . LEU B 229 ? 0.5856 1.4671 1.1481 0.2621 -0.1379 -0.0969 250 LEU B CD2 4766 N N . GLY B 230 ? 0.7818 1.6837 1.3830 0.2956 -0.1156 -0.1270 251 GLY B N 4767 C CA . GLY B 230 ? 0.8109 1.7201 1.4243 0.3050 -0.1077 -0.1354 251 GLY B CA 4768 C C . GLY B 230 ? 0.8194 1.7088 1.4413 0.3122 -0.1077 -0.1372 251 GLY B C 4769 O O . GLY B 230 ? 0.8096 1.6756 1.4241 0.3097 -0.1131 -0.1349 251 GLY B O 4770 N N . ASN B 231 ? 0.8369 1.7351 1.4737 0.3212 -0.1011 -0.1412 252 ASN B N 4771 C CA . ASN B 231 ? 0.8750 1.7551 1.5210 0.3292 -0.0995 -0.1430 252 ASN B CA 4772 C C . ASN B 231 ? 0.9291 1.8074 1.5774 0.3357 -0.0887 -0.1579 252 ASN B C 4773 O O . ASN B 231 ? 0.9250 1.8255 1.5820 0.3388 -0.0820 -0.1617 252 ASN B O 4774 C CB . ASN B 231 ? 0.8365 1.7288 1.5019 0.3347 -0.1025 -0.1306 252 ASN B CB 4775 C CG . ASN B 231 ? 0.8522 1.7226 1.5250 0.3421 -0.1033 -0.1287 252 ASN B CG 4776 O OD1 . ASN B 231 ? 0.8566 1.7242 1.5357 0.3423 -0.1107 -0.1163 252 ASN B OD1 4777 N ND2 . ASN B 231 ? 0.8604 1.7153 1.5321 0.3476 -0.0956 -0.1409 252 ASN B ND2 4778 N N . PRO B 232 ? 0.9627 1.8144 1.6028 0.3367 -0.0865 -0.1671 253 PRO B N 4779 C CA . PRO B 232 ? 0.9804 1.8046 1.6096 0.3326 -0.0935 -0.1639 253 PRO B CA 4780 C C . PRO B 232 ? 0.9976 1.8205 1.6090 0.3223 -0.0990 -0.1637 253 PRO B C 4781 O O . PRO B 232 ? 1.0243 1.8670 1.6311 0.3183 -0.0975 -0.1659 253 PRO B O 4782 C CB . PRO B 232 ? 0.9964 1.7973 1.6217 0.3364 -0.0865 -0.1775 253 PRO B CB 4783 C CG . PRO B 232 ? 1.0097 1.8240 1.6487 0.3445 -0.0768 -0.1838 253 PRO B CG 4784 C CD . PRO B 232 ? 0.9867 1.8329 1.6286 0.3423 -0.0759 -0.1817 253 PRO B CD 4785 N N . VAL B 233 ? 0.9747 1.7739 1.5764 0.3178 -0.1052 -0.1611 254 VAL B N 4786 C CA . VAL B 233 ? 0.9448 1.7401 1.5304 0.3081 -0.1106 -0.1604 254 VAL B CA 4787 C C . VAL B 233 ? 0.9526 1.7509 1.5266 0.3056 -0.1051 -0.1748 254 VAL B C 4788 O O . VAL B 233 ? 0.9718 1.7546 1.5419 0.3075 -0.1002 -0.1866 254 VAL B O 4789 C CB . VAL B 233 ? 0.9269 1.6940 1.5046 0.3043 -0.1170 -0.1570 254 VAL B CB 4790 C CG1 . VAL B 233 ? 0.8939 1.6590 1.4571 0.2943 -0.1229 -0.1541 254 VAL B CG1 4791 C CG2 . VAL B 233 ? 0.9101 1.6724 1.4990 0.3074 -0.1219 -0.1437 254 VAL B CG2 4792 N N . PRO B 234 ? 0.9362 1.7547 1.5042 0.3007 -0.1057 -0.1734 255 PRO B N 4793 C CA . PRO B 234 ? 0.9640 1.7903 1.5210 0.2981 -0.1008 -0.1857 255 PRO B CA 4794 C C . PRO B 234 ? 0.9903 1.7969 1.5325 0.2927 -0.1033 -0.1931 255 PRO B C 4795 O O . PRO B 234 ? 1.0132 1.8053 1.5505 0.2883 -0.1104 -0.1858 255 PRO B O 4796 C CB . PRO B 234 ? 0.9189 1.7691 1.4726 0.2934 -0.1030 -0.1781 255 PRO B CB 4797 C CG . PRO B 234 ? 0.9104 1.7694 1.4772 0.2953 -0.1064 -0.1642 255 PRO B CG 4798 C CD . PRO B 234 ? 0.9072 1.7428 1.4783 0.2971 -0.1109 -0.1597 255 PRO B CD 4799 N N . THR B 235 ? 0.9721 1.7791 1.5076 0.2926 -0.0973 -0.2076 256 THR B N 4800 C CA . THR B 235 ? 0.9637 1.7571 1.4852 0.2869 -0.0994 -0.2156 256 THR B CA 4801 C C . THR B 235 ? 0.9307 1.7430 1.4409 0.2815 -0.1007 -0.2164 256 THR B C 4802 O O . THR B 235 ? 0.9289 1.7637 1.4410 0.2826 -0.0971 -0.2158 256 THR B O 4803 C CB . THR B 235 ? 0.9783 1.7590 1.4981 0.2891 -0.0924 -0.2321 256 THR B CB 4804 O OG1 . THR B 235 ? 0.9897 1.7881 1.5134 0.2928 -0.0840 -0.2404 256 THR B OG1 4805 C CG2 . THR B 235 ? 0.9881 1.7440 1.5158 0.2935 -0.0920 -0.2308 256 THR B CG2 4806 N N . ILE B 236 ? 0.8931 1.6963 1.3917 0.2754 -0.1056 -0.2174 257 ILE B N 4807 C CA . ILE B 236 ? 0.8477 1.6669 1.3348 0.2702 -0.1077 -0.2169 257 ILE B CA 4808 C C . ILE B 236 ? 0.8555 1.6744 1.3325 0.2677 -0.1046 -0.2322 257 ILE B C 4809 O O . ILE B 236 ? 0.8131 1.6129 1.2883 0.2667 -0.1049 -0.2400 257 ILE B O 4810 C CB . ILE B 236 ? 0.7727 1.5848 1.2540 0.2645 -0.1160 -0.2044 257 ILE B CB 4811 C CG1 . ILE B 236 ? 0.7270 1.5336 1.2184 0.2661 -0.1194 -0.1908 257 ILE B CG1 4812 C CG2 . ILE B 236 ? 0.7463 1.5774 1.2180 0.2604 -0.1176 -0.1999 257 ILE B CG2 4813 C CD1 . ILE B 236 ? 0.7147 1.5433 1.2139 0.2688 -0.1169 -0.1835 257 ILE B CD1 4814 N N . LEU B 237 ? 0.9043 1.7451 1.3747 0.2662 -0.1019 -0.2364 258 LEU B N 4815 C CA . LEU B 237 ? 0.9168 1.7621 1.3768 0.2631 -0.0994 -0.2504 258 LEU B CA 4816 C C . LEU B 237 ? 0.8916 1.7543 1.3397 0.2584 -0.1034 -0.2453 258 LEU B C 4817 O O . LEU B 237 ? 0.8636 1.7399 1.3118 0.2585 -0.1048 -0.2339 258 LEU B O 4818 C CB . LEU B 237 ? 0.9755 1.8308 1.4385 0.2664 -0.0900 -0.2639 258 LEU B CB 4819 C CG . LEU B 237 ? 1.0138 1.8777 1.4661 0.2625 -0.0864 -0.2796 258 LEU B CG 4820 C CD1 . LEU B 237 ? 1.0230 1.8650 1.4733 0.2603 -0.0868 -0.2900 258 LEU B CD1 4821 C CD2 . LEU B 237 ? 1.0324 1.9108 1.4866 0.2648 -0.0768 -0.2903 258 LEU B CD2 4822 N N . TRP B 238 ? 0.8979 1.7604 1.3358 0.2541 -0.1053 -0.2535 259 TRP B N 4823 C CA . TRP B 238 ? 0.8780 1.7557 1.3040 0.2499 -0.1094 -0.2485 259 TRP B CA 4824 C C . TRP B 238 ? 0.9071 1.8026 1.3240 0.2478 -0.1056 -0.2620 259 TRP B C 4825 O O . TRP B 238 ? 0.8947 1.7837 1.3102 0.2463 -0.1036 -0.2760 259 TRP B O 4826 C CB . TRP B 238 ? 0.8468 1.7095 1.2683 0.2460 -0.1169 -0.2425 259 TRP B CB 4827 C CG . TRP B 238 ? 0.7935 1.6398 1.2218 0.2466 -0.1211 -0.2288 259 TRP B CG 4828 C CD1 . TRP B 238 ? 0.7728 1.5973 1.2096 0.2480 -0.1216 -0.2293 259 TRP B CD1 4829 C CD2 . TRP B 238 ? 0.7303 1.5808 1.1570 0.2451 -0.1250 -0.2126 259 TRP B CD2 4830 N NE1 . TRP B 238 ? 0.7494 1.5655 1.1898 0.2473 -0.1260 -0.2145 259 TRP B NE1 4831 C CE2 . TRP B 238 ? 0.7251 1.5568 1.1598 0.2453 -0.1279 -0.2045 259 TRP B CE2 4832 C CE3 . TRP B 238 ? 0.6899 1.5578 1.1088 0.2433 -0.1262 -0.2041 259 TRP B CE3 4833 C CZ2 . TRP B 238 ? 0.6861 1.5164 1.1213 0.2432 -0.1316 -0.1891 259 TRP B CZ2 4834 C CZ3 . TRP B 238 ? 0.6729 1.5380 1.0925 0.2415 -0.1295 -0.1886 259 TRP B CZ3 4835 C CH2 . TRP B 238 ? 0.6724 1.5193 1.1002 0.2413 -0.1321 -0.1816 259 TRP B CH2 4836 N N . ARG B 239 ? 0.9401 1.8584 1.3503 0.2471 -0.1046 -0.2579 260 ARG B N 4837 C CA . ARG B 239 ? 0.9696 1.9075 1.3696 0.2444 -0.1014 -0.2694 260 ARG B CA 4838 C C . ARG B 239 ? 0.9703 1.9241 1.3575 0.2411 -0.1067 -0.2598 260 ARG B C 4839 O O . ARG B 239 ? 0.9512 1.9019 1.3379 0.2413 -0.1112 -0.2442 260 ARG B O 4840 C CB . ARG B 239 ? 0.9638 1.9164 1.3673 0.2469 -0.0927 -0.2765 260 ARG B CB 4841 C CG . ARG B 239 ? 0.9883 1.9259 1.4053 0.2513 -0.0866 -0.2837 260 ARG B CG 4842 C CD . ARG B 239 ? 0.9960 1.9495 1.4163 0.2537 -0.0777 -0.2890 260 ARG B CD 4843 N NE . ARG B 239 ? 0.9530 1.9260 1.3694 0.2534 -0.0791 -0.2766 260 ARG B NE 4844 C CZ . ARG B 239 ? 0.9010 1.8873 1.3222 0.2559 -0.0725 -0.2761 260 ARG B CZ 4845 N NH1 . ARG B 239 ? 0.8230 1.8051 1.2535 0.2592 -0.0642 -0.2870 260 ARG B NH1 4846 N NH2 . ARG B 239 ? 0.9023 1.9055 1.3190 0.2547 -0.0738 -0.2646 260 ARG B NH2 4847 N N . ARG B 240 ? 0.9910 1.9618 1.3673 0.2379 -0.1057 -0.2692 261 ARG B N 4848 C CA . ARG B 240 ? 0.9968 1.9861 1.3596 0.2353 -0.1093 -0.2608 261 ARG B CA 4849 C C . ARG B 240 ? 1.0170 2.0294 1.3752 0.2353 -0.1029 -0.2649 261 ARG B C 4850 O O . ARG B 240 ? 0.9847 2.0056 1.3423 0.2341 -0.0972 -0.2807 261 ARG B O 4851 C CB . ARG B 240 ? 0.9822 1.9754 1.3350 0.2311 -0.1139 -0.2673 261 ARG B CB 4852 C CG . ARG B 240 ? 0.9801 1.9503 1.3382 0.2306 -0.1190 -0.2663 261 ARG B CG 4853 C CD . ARG B 240 ? 1.0127 1.9890 1.3614 0.2265 -0.1236 -0.2719 261 ARG B CD 4854 N NE . ARG B 240 ? 1.0191 2.0135 1.3546 0.2253 -0.1272 -0.2616 261 ARG B NE 4855 C CZ . ARG B 240 ? 1.0186 2.0147 1.3467 0.2232 -0.1331 -0.2575 261 ARG B CZ 4856 N NH1 . ARG B 240 ? 0.9869 1.9683 1.3197 0.2215 -0.1362 -0.2632 261 ARG B NH1 4857 N NH2 . ARG B 240 ? 1.0507 2.0629 1.3667 0.2227 -0.1357 -0.2472 261 ARG B NH2 4858 N N . ALA B 241 ? 1.0741 2.0961 1.4290 0.2360 -0.1033 -0.2510 262 ALA B N 4859 C CA . ALA B 241 ? 1.1478 2.1906 1.4996 0.2361 -0.0967 -0.2534 262 ALA B CA 4860 C C . ALA B 241 ? 1.2103 2.2749 1.5475 0.2319 -0.0951 -0.2634 262 ALA B C 4861 O O . ALA B 241 ? 1.2469 2.3306 1.5785 0.2309 -0.0899 -0.2653 262 ALA B O 4862 C CB . ALA B 241 ? 1.1486 2.1967 1.4988 0.2370 -0.0978 -0.2356 262 ALA B CB 4863 N N . ASP B 242 ? 1.2095 2.2720 1.5403 0.2292 -0.0997 -0.2698 263 ASP B N 4864 C CA . ASP B 242 ? 1.2327 2.3162 1.5500 0.2245 -0.0988 -0.2805 263 ASP B CA 4865 C C . ASP B 242 ? 1.1937 2.2729 1.5154 0.2223 -0.0954 -0.3009 263 ASP B C 4866 O O . ASP B 242 ? 1.1909 2.2830 1.5025 0.2176 -0.0967 -0.3104 263 ASP B O 4867 C CB . ASP B 242 ? 1.2906 2.3811 1.5937 0.2222 -0.1071 -0.2698 263 ASP B CB 4868 C CG . ASP B 242 ? 1.3336 2.4018 1.6424 0.2237 -0.1141 -0.2614 263 ASP B CG 4869 O OD1 . ASP B 242 ? 1.3707 2.4218 1.6902 0.2244 -0.1137 -0.2705 263 ASP B OD1 4870 O OD2 . ASP B 242 ? 1.3177 2.3845 1.6195 0.2242 -0.1195 -0.2456 263 ASP B OD2 4871 N N . GLY B 243 ? 1.1532 2.2137 1.4897 0.2256 -0.0907 -0.3071 264 GLY B N 4872 C CA . GLY B 243 ? 1.1508 2.2043 1.4921 0.2237 -0.0854 -0.3268 264 GLY B CA 4873 C C . GLY B 243 ? 1.1372 2.1775 1.4787 0.2213 -0.0910 -0.3320 264 GLY B C 4874 O O . GLY B 243 ? 1.1078 2.1331 1.4570 0.2210 -0.0869 -0.3451 264 GLY B O 4875 N N . LYS B 244 ? 1.1595 2.2049 1.4924 0.2196 -0.0997 -0.3218 265 LYS B N 4876 C CA . LYS B 244 ? 1.2077 2.2428 1.5404 0.2170 -0.1052 -0.3262 265 LYS B CA 4877 C C . LYS B 244 ? 1.2183 2.2236 1.5651 0.2200 -0.1052 -0.3263 265 LYS B C 4878 O O . LYS B 244 ? 1.2236 2.2153 1.5782 0.2247 -0.1057 -0.3140 265 LYS B O 4879 C CB . LYS B 244 ? 1.2429 2.2842 1.5657 0.2161 -0.1143 -0.3115 265 LYS B CB 4880 C CG . LYS B 244 ? 1.2949 2.3650 1.6016 0.2127 -0.1153 -0.3108 265 LYS B CG 4881 C CD . LYS B 244 ? 1.3018 2.3746 1.5994 0.2126 -0.1239 -0.2961 265 LYS B CD 4882 C CE . LYS B 244 ? 1.2893 2.3900 1.5698 0.2096 -0.1250 -0.2941 265 LYS B CE 4883 N NZ . LYS B 244 ? 1.2782 2.3801 1.5504 0.2103 -0.1326 -0.2790 265 LYS B NZ 4884 N N . PRO B 245 ? 1.2277 2.2227 1.5773 0.2169 -0.1044 -0.3402 266 PRO B N 4885 C CA . PRO B 245 ? 1.2190 2.1848 1.5802 0.2190 -0.1048 -0.3407 266 PRO B CA 4886 C C . PRO B 245 ? 1.2171 2.1707 1.5790 0.2204 -0.1135 -0.3237 266 PRO B C 4887 O O . PRO B 245 ? 1.1920 2.1587 1.5448 0.2186 -0.1194 -0.3158 266 PRO B O 4888 C CB . PRO B 245 ? 1.2352 2.1988 1.5951 0.2135 -0.1027 -0.3593 266 PRO B CB 4889 C CG . PRO B 245 ? 1.2589 2.2491 1.6094 0.2092 -0.0981 -0.3718 266 PRO B CG 4890 C CD . PRO B 245 ? 1.2459 2.2573 1.5873 0.2105 -0.1025 -0.3572 266 PRO B CD 4891 N N . ILE B 246 ? 1.2469 2.1752 1.6193 0.2235 -0.1140 -0.3180 267 ILE B N 4892 C CA . ILE B 246 ? 1.2509 2.1656 1.6245 0.2243 -0.1213 -0.3024 267 ILE B CA 4893 C C . ILE B 246 ? 1.2833 2.1942 1.6531 0.2197 -0.1262 -0.3072 267 ILE B C 4894 O O . ILE B 246 ? 1.3047 2.2163 1.6742 0.2164 -0.1236 -0.3233 267 ILE B O 4895 C CB . ILE B 246 ? 1.2537 2.1427 1.6391 0.2279 -0.1204 -0.2961 267 ILE B CB 4896 C CG1 . ILE B 246 ? 1.2248 2.1114 1.6107 0.2303 -0.1248 -0.2761 267 ILE B CG1 4897 C CG2 . ILE B 246 ? 1.2516 2.1176 1.6413 0.2256 -0.1222 -0.3024 267 ILE B CG2 4898 C CD1 . ILE B 246 ? 1.2077 2.1134 1.5914 0.2329 -0.1217 -0.2699 267 ILE B CD1 4899 N N . ALA B 247 ? 1.3052 2.2117 1.6721 0.2194 -0.1330 -0.2934 268 ALA B N 4900 C CA . ALA B 247 ? 1.3187 2.2244 1.6818 0.2155 -0.1380 -0.2961 268 ALA B CA 4901 C C . ALA B 247 ? 1.3230 2.2096 1.6930 0.2127 -0.1367 -0.3090 268 ALA B C 4902 O O . ALA B 247 ? 1.3508 2.2418 1.7179 0.2084 -0.1388 -0.3176 268 ALA B O 4903 C CB . ALA B 247 ? 1.3083 2.2076 1.6696 0.2162 -0.1442 -0.2782 268 ALA B CB 4904 N N . ARG B 248 ? 1.2892 2.1550 1.6681 0.2151 -0.1332 -0.3099 269 ARG B N 4905 C CA . ARG B 248 ? 1.2617 2.1065 1.6469 0.2127 -0.1310 -0.3213 269 ARG B CA 4906 C C . ARG B 248 ? 1.2008 2.0256 1.5886 0.2109 -0.1365 -0.3130 269 ARG B C 4907 O O . ARG B 248 ? 1.1897 1.9907 1.5838 0.2106 -0.1352 -0.3156 269 ARG B O 4908 C CB . ARG B 248 ? 1.3018 2.1585 1.6834 0.2078 -0.1279 -0.3407 269 ARG B CB 4909 C CG . ARG B 248 ? 1.3377 2.1727 1.7254 0.2053 -0.1235 -0.3546 269 ARG B CG 4910 C CD . ARG B 248 ? 1.3401 2.1654 1.7278 0.2004 -0.1280 -0.3569 269 ARG B CD 4911 N NE . ARG B 248 ? 1.3434 2.1495 1.7357 0.1969 -0.1232 -0.3717 269 ARG B NE 4912 C CZ . ARG B 248 ? 1.3551 2.1700 1.7452 0.1919 -0.1184 -0.3902 269 ARG B CZ 4913 N NH1 . ARG B 248 ? 1.3484 2.1924 1.7316 0.1896 -0.1183 -0.3965 269 ARG B NH1 4914 N NH2 . ARG B 248 ? 1.3579 2.1521 1.7520 0.1886 -0.1134 -0.4027 269 ARG B NH2 4915 N N . LYS B 249 ? 1.1567 1.9906 1.5393 0.2098 -0.1424 -0.3029 270 LYS B N 4916 C CA . LYS B 249 ? 1.1200 1.9354 1.5050 0.2085 -0.1472 -0.2925 270 LYS B CA 4917 C C . LYS B 249 ? 1.1361 1.9398 1.5248 0.2123 -0.1475 -0.2769 270 LYS B C 4918 O O . LYS B 249 ? 1.1244 1.9082 1.5168 0.2113 -0.1501 -0.2687 270 LYS B O 4919 C CB . LYS B 249 ? 1.0612 1.8899 1.4402 0.2065 -0.1525 -0.2863 270 LYS B CB 4920 C CG . LYS B 249 ? 1.0300 1.8814 1.4015 0.2093 -0.1537 -0.2766 270 LYS B CG 4921 C CD . LYS B 249 ? 0.9880 1.8449 1.3551 0.2085 -0.1592 -0.2655 270 LYS B CD 4922 C CE . LYS B 249 ? 0.9790 1.8610 1.3367 0.2107 -0.1601 -0.2585 270 LYS B CE 4923 N NZ . LYS B 249 ? 1.0052 1.9099 1.3571 0.2087 -0.1591 -0.2725 270 LYS B NZ 4924 N N . ALA B 250 ? 1.1439 1.9610 1.5315 0.2160 -0.1448 -0.2735 271 ALA B N 4925 C CA . ALA B 250 ? 1.1143 1.9237 1.5061 0.2195 -0.1444 -0.2602 271 ALA B CA 4926 C C . ALA B 250 ? 1.1651 1.9514 1.5656 0.2205 -0.1419 -0.2637 271 ALA B C 4927 O O . ALA B 250 ? 1.1667 1.9500 1.5700 0.2210 -0.1374 -0.2774 271 ALA B O 4928 C CB . ALA B 250 ? 1.0698 1.9000 1.4592 0.2230 -0.1410 -0.2585 271 ALA B CB 4929 N N . ARG B 251 ? 1.2198 1.9894 1.6242 0.2207 -0.1444 -0.2511 272 ARG B N 4930 C CA . ARG B 251 ? 1.2861 2.0323 1.6978 0.2214 -0.1431 -0.2522 272 ARG B CA 4931 C C . ARG B 251 ? 1.2884 2.0340 1.7062 0.2260 -0.1411 -0.2436 272 ARG B C 4932 O O . ARG B 251 ? 1.2746 2.0370 1.6910 0.2281 -0.1409 -0.2356 272 ARG B O 4933 C CB . ARG B 251 ? 1.3228 2.0490 1.7347 0.2172 -0.1477 -0.2451 272 ARG B CB 4934 C CG . ARG B 251 ? 1.3691 2.1002 1.7752 0.2128 -0.1509 -0.2481 272 ARG B CG 4935 C CD . ARG B 251 ? 1.4129 2.1263 1.8194 0.2089 -0.1552 -0.2383 272 ARG B CD 4936 N NE . ARG B 251 ? 1.4603 2.1794 1.8625 0.2053 -0.1581 -0.2399 272 ARG B NE 4937 C CZ . ARG B 251 ? 1.4833 2.1891 1.8855 0.2014 -0.1613 -0.2332 272 ARG B CZ 4938 N NH1 . ARG B 251 ? 1.4895 2.1758 1.8950 0.2000 -0.1620 -0.2246 272 ARG B NH1 4939 N NH2 . ARG B 251 ? 1.4727 2.1855 1.8720 0.1988 -0.1636 -0.2351 272 ARG B NH2 4940 N N . ARG B 252 ? 1.2915 2.0176 1.7160 0.2275 -0.1394 -0.2449 273 ARG B N 4941 C CA . ARG B 252 ? 1.2693 1.9930 1.7009 0.2319 -0.1380 -0.2360 273 ARG B CA 4942 C C . ARG B 252 ? 1.2550 1.9544 1.6905 0.2304 -0.1411 -0.2279 273 ARG B C 4943 O O . ARG B 252 ? 1.2270 1.9073 1.6639 0.2292 -0.1403 -0.2350 273 ARG B O 4944 C CB . ARG B 252 ? 1.2598 1.9869 1.6966 0.2369 -0.1314 -0.2466 273 ARG B CB 4945 C CG . ARG B 252 ? 1.2635 2.0169 1.6983 0.2395 -0.1277 -0.2503 273 ARG B CG 4946 C CD . ARG B 252 ? 1.2900 2.0550 1.7171 0.2365 -0.1261 -0.2640 273 ARG B CD 4947 N NE . ARG B 252 ? 1.3143 2.1026 1.7398 0.2389 -0.1213 -0.2698 273 ARG B NE 4948 C CZ . ARG B 252 ? 1.3060 2.1104 1.7243 0.2364 -0.1196 -0.2809 273 ARG B CZ 4949 N NH1 . ARG B 252 ? 1.3024 2.1032 1.7153 0.2317 -0.1225 -0.2875 273 ARG B NH1 4950 N NH2 . ARG B 252 ? 1.2758 2.1011 1.6924 0.2383 -0.1149 -0.2855 273 ARG B NH2 4951 N N . HIS B 253 ? 1.2797 1.9800 1.7166 0.2295 -0.1447 -0.2130 274 HIS B N 4952 C CA . HIS B 253 ? 1.3336 2.0133 1.7742 0.2280 -0.1475 -0.2042 274 HIS B CA 4953 C C . HIS B 253 ? 1.2974 1.9848 1.7445 0.2309 -0.1480 -0.1916 274 HIS B C 4954 O O . HIS B 253 ? 1.2317 1.9395 1.6803 0.2343 -0.1457 -0.1900 274 HIS B O 4955 C CB . HIS B 253 ? 1.3855 2.0536 1.8204 0.2211 -0.1523 -0.1990 274 HIS B CB 4956 C CG . HIS B 253 ? 1.4523 2.0950 1.8891 0.2182 -0.1544 -0.1964 274 HIS B CG 4957 N ND1 . HIS B 253 ? 1.4683 2.1030 1.9104 0.2193 -0.1558 -0.1862 274 HIS B ND1 4958 C CD2 . HIS B 253 ? 1.4697 2.0938 1.9034 0.2140 -0.1553 -0.2028 274 HIS B CD2 4959 C CE1 . HIS B 253 ? 1.4640 2.0757 1.9053 0.2158 -0.1575 -0.1860 274 HIS B CE1 4960 N NE2 . HIS B 253 ? 1.4650 2.0695 1.9013 0.2125 -0.1571 -0.1961 274 HIS B NE2 4961 N N . LYS B 254 ? 1.3279 1.9994 1.7785 0.2293 -0.1509 -0.1825 275 LYS B N 4962 C CA . LYS B 254 ? 1.3344 2.0127 1.7920 0.2316 -0.1518 -0.1706 275 LYS B CA 4963 C C . LYS B 254 ? 1.3482 2.0370 1.8139 0.2395 -0.1469 -0.1756 275 LYS B C 4964 O O . LYS B 254 ? 1.3599 2.0680 1.8301 0.2423 -0.1455 -0.1705 275 LYS B O 4965 C CB . LYS B 254 ? 1.3241 2.0190 1.7787 0.2285 -0.1537 -0.1605 275 LYS B CB 4966 C CG . LYS B 254 ? 1.3231 2.0080 1.7699 0.2208 -0.1578 -0.1552 275 LYS B CG 4967 C CD . LYS B 254 ? 1.3344 2.0073 1.7836 0.2165 -0.1615 -0.1431 275 LYS B CD 4968 C CE . LYS B 254 ? 1.3304 1.9977 1.7723 0.2088 -0.1644 -0.1367 275 LYS B CE 4969 N NZ . LYS B 254 ? 1.3256 1.9866 1.7695 0.2038 -0.1674 -0.1239 275 LYS B NZ 4970 N N . SER B 255 ? 1.3341 2.0097 1.8019 0.2427 -0.1438 -0.1860 276 SER B N 4971 C CA . SER B 255 ? 1.2951 1.9780 1.7705 0.2501 -0.1379 -0.1927 276 SER B CA 4972 C C . SER B 255 ? 1.2643 1.9726 1.7384 0.2522 -0.1341 -0.1979 276 SER B C 4973 O O . SER B 255 ? 1.2490 1.9725 1.7306 0.2572 -0.1310 -0.1954 276 SER B O 4974 C CB . SER B 255 ? 1.2861 1.9678 1.7721 0.2546 -0.1385 -0.1825 276 SER B CB 4975 O OG . SER B 255 ? 1.2764 1.9745 1.7647 0.2531 -0.1416 -0.1699 276 SER B OG 4976 N N . ASN B 256 ? 1.2434 1.9570 1.7082 0.2483 -0.1344 -0.2051 277 ASN B N 4977 C CA . ASN B 256 ? 1.1916 1.9291 1.6529 0.2493 -0.1311 -0.2103 277 ASN B CA 4978 C C . ASN B 256 ? 1.0999 1.8569 1.5629 0.2498 -0.1323 -0.1983 277 ASN B C 4979 O O . ASN B 256 ? 1.0876 1.8650 1.5507 0.2523 -0.1283 -0.2013 277 ASN B O 4980 C CB . ASN B 256 ? 1.2419 1.9840 1.7071 0.2544 -0.1238 -0.2238 277 ASN B CB 4981 C CG . ASN B 256 ? 1.2770 2.0069 1.7366 0.2520 -0.1218 -0.2387 277 ASN B CG 4982 O OD1 . ASN B 256 ? 1.3145 2.0560 1.7708 0.2524 -0.1171 -0.2510 277 ASN B OD1 4983 N ND2 . ASN B 256 ? 1.2448 1.9518 1.7031 0.2489 -0.1252 -0.2378 277 ASN B ND2 4984 N N . GLY B 257 ? 1.0440 1.7950 1.5082 0.2467 -0.1372 -0.1847 278 GLY B N 4985 C CA . GLY B 257 ? 0.9765 1.7444 1.4413 0.2457 -0.1384 -0.1729 278 GLY B CA 4986 C C . GLY B 257 ? 0.9325 1.7069 1.3860 0.2403 -0.1410 -0.1701 278 GLY B C 4987 O O . GLY B 257 ? 0.9032 1.6932 1.3546 0.2391 -0.1410 -0.1620 278 GLY B O 4988 N N . ILE B 258 ? 0.8885 1.6508 1.3348 0.2372 -0.1428 -0.1767 279 ILE B N 4989 C CA . ILE B 258 ? 0.8734 1.6405 1.3094 0.2326 -0.1453 -0.1744 279 ILE B CA 4990 C C . ILE B 258 ? 0.8596 1.6299 1.2893 0.2326 -0.1438 -0.1881 279 ILE B C 4991 O O . ILE B 258 ? 0.8725 1.6303 1.3042 0.2332 -0.1428 -0.1986 279 ILE B O 4992 C CB . ILE B 258 ? 0.8470 1.5961 1.2805 0.2268 -0.1503 -0.1658 279 ILE B CB 4993 C CG1 . ILE B 258 ? 0.8283 1.5788 1.2659 0.2250 -0.1518 -0.1512 279 ILE B CG1 4994 C CG2 . ILE B 258 ? 0.8765 1.6282 1.3000 0.2228 -0.1522 -0.1658 279 ILE B CG2 4995 C CD1 . ILE B 258 ? 0.8651 1.6024 1.2981 0.2183 -0.1559 -0.1419 279 ILE B CD1 4996 N N . LEU B 259 ? 0.8146 1.6020 1.2362 0.2316 -0.1437 -0.1878 280 LEU B N 4997 C CA . LEU B 259 ? 0.7875 1.5813 1.2023 0.2308 -0.1431 -0.1997 280 LEU B CA 4998 C C . LEU B 259 ? 0.7830 1.5731 1.1899 0.2263 -0.1477 -0.1943 280 LEU B C 4999 O O . LEU B 259 ? 0.7431 1.5401 1.1461 0.2249 -0.1492 -0.1826 280 LEU B O 5000 C CB . LEU B 259 ? 0.7707 1.5891 1.1817 0.2335 -0.1392 -0.2044 280 LEU B CB 5001 C CG . LEU B 259 ? 0.7267 1.5558 1.1304 0.2325 -0.1383 -0.2175 280 LEU B CG 5002 C CD1 . LEU B 259 ? 0.7334 1.5527 1.1420 0.2336 -0.1351 -0.2329 280 LEU B CD1 5003 C CD2 . LEU B 259 ? 0.6706 1.5255 1.0682 0.2339 -0.1355 -0.2181 280 LEU B CD2 5004 N N . GLU B 260 ? 0.8489 1.6278 1.2544 0.2238 -0.1493 -0.2029 281 GLU B N 5005 C CA . GLU B 260 ? 0.9145 1.6902 1.3137 0.2198 -0.1532 -0.1990 281 GLU B CA 5006 C C . GLU B 260 ? 0.9223 1.7135 1.3149 0.2195 -0.1531 -0.2093 281 GLU B C 5007 O O . GLU B 260 ? 0.9566 1.7506 1.3504 0.2203 -0.1506 -0.2233 281 GLU B O 5008 C CB . GLU B 260 ? 0.9948 1.7461 1.3976 0.2161 -0.1558 -0.1993 281 GLU B CB 5009 C CG . GLU B 260 ? 1.0942 1.8314 1.5007 0.2145 -0.1574 -0.1858 281 GLU B CG 5010 C CD . GLU B 260 ? 1.1792 1.8938 1.5869 0.2096 -0.1602 -0.1851 281 GLU B CD 5011 O OE1 . GLU B 260 ? 1.2028 1.9138 1.6082 0.2077 -0.1611 -0.1942 281 GLU B OE1 5012 O OE2 . GLU B 260 ? 1.2046 1.9059 1.6155 0.2075 -0.1615 -0.1758 281 GLU B OE2 5013 N N . ILE B 261 ? 0.8790 1.6799 1.2644 0.2182 -0.1556 -0.2021 282 ILE B N 5014 C CA . ILE B 261 ? 0.7946 1.6120 1.1731 0.2177 -0.1565 -0.2099 282 ILE B CA 5015 C C . ILE B 261 ? 0.8459 1.6563 1.2221 0.2146 -0.1606 -0.2060 282 ILE B C 5016 O O . ILE B 261 ? 0.8281 1.6405 1.2005 0.2144 -0.1624 -0.1931 282 ILE B O 5017 C CB . ILE B 261 ? 0.6860 1.5271 1.0570 0.2201 -0.1552 -0.2046 282 ILE B CB 5018 C CG1 . ILE B 261 ? 0.6397 1.4893 1.0137 0.2231 -0.1506 -0.2090 282 ILE B CG1 5019 C CG2 . ILE B 261 ? 0.6809 1.5400 1.0440 0.2194 -0.1566 -0.2118 282 ILE B CG2 5020 C CD1 . ILE B 261 ? 0.6469 1.5148 1.0153 0.2251 -0.1490 -0.1995 282 ILE B CD1 5021 N N . PRO B 262 ? 0.9102 1.7118 1.2888 0.2121 -0.1616 -0.2174 283 PRO B N 5022 C CA . PRO B 262 ? 0.9364 1.7323 1.3142 0.2091 -0.1652 -0.2155 283 PRO B CA 5023 C C . PRO B 262 ? 0.9579 1.7765 1.3285 0.2098 -0.1670 -0.2165 283 PRO B C 5024 O O . PRO B 262 ? 0.9604 1.7974 1.3270 0.2111 -0.1654 -0.2254 283 PRO B O 5025 C CB . PRO B 262 ? 0.9496 1.7313 1.3327 0.2061 -0.1648 -0.2294 283 PRO B CB 5026 C CG . PRO B 262 ? 0.9534 1.7272 1.3409 0.2078 -0.1611 -0.2347 283 PRO B CG 5027 C CD . PRO B 262 ? 0.9448 1.7386 1.3287 0.2117 -0.1589 -0.2319 283 PRO B CD 5028 N N . ASN B 263 ? 0.9716 1.7887 1.3406 0.2089 -0.1701 -0.2075 284 ASN B N 5029 C CA . ASN B 263 ? 0.9814 1.8186 1.3445 0.2097 -0.1726 -0.2079 284 ASN B CA 5030 C C . ASN B 263 ? 0.9715 1.8327 1.3261 0.2128 -0.1713 -0.2064 284 ASN B C 5031 O O . ASN B 263 ? 0.9940 1.8719 1.3453 0.2126 -0.1706 -0.2185 284 ASN B O 5032 C CB . ASN B 263 ? 0.9953 1.8357 1.3610 0.2068 -0.1738 -0.2238 284 ASN B CB 5033 C CG . ASN B 263 ? 1.0278 1.8900 1.3882 0.2075 -0.1769 -0.2244 284 ASN B CG 5034 O OD1 . ASN B 263 ? 1.0631 1.9263 1.4223 0.2088 -0.1794 -0.2123 284 ASN B OD1 5035 N ND2 . ASN B 263 ? 1.0303 1.9104 1.3878 0.2064 -0.1764 -0.2385 284 ASN B ND2 5036 N N . PHE B 264 ? 0.9190 1.7818 1.2697 0.2151 -0.1705 -0.1917 285 PHE B N 5037 C CA . PHE B 264 ? 0.8698 1.7532 1.2124 0.2178 -0.1685 -0.1889 285 PHE B CA 5038 C C . PHE B 264 ? 0.8429 1.7495 1.1765 0.2187 -0.1708 -0.1898 285 PHE B C 5039 O O . PHE B 264 ? 0.8347 1.7415 1.1668 0.2191 -0.1738 -0.1821 285 PHE B O 5040 C CB . PHE B 264 ? 0.8261 1.7044 1.1668 0.2194 -0.1669 -0.1724 285 PHE B CB 5041 C CG . PHE B 264 ? 0.8098 1.7025 1.1462 0.2213 -0.1633 -0.1723 285 PHE B CG 5042 C CD1 . PHE B 264 ? 0.8216 1.7085 1.1645 0.2214 -0.1602 -0.1792 285 PHE B CD1 5043 C CD2 . PHE B 264 ? 0.8400 1.7520 1.1659 0.2232 -0.1629 -0.1650 285 PHE B CD2 5044 C CE1 . PHE B 264 ? 0.8485 1.7492 1.1884 0.2233 -0.1566 -0.1795 285 PHE B CE1 5045 C CE2 . PHE B 264 ? 0.8776 1.8032 1.1995 0.2245 -0.1593 -0.1653 285 PHE B CE2 5046 C CZ . PHE B 264 ? 0.8748 1.7952 1.2043 0.2245 -0.1560 -0.1729 285 PHE B CZ 5047 N N . GLN B 265 ? 0.8307 1.7573 1.1584 0.2191 -0.1690 -0.1993 286 GLN B N 5048 C CA . GLN B 265 ? 0.8783 1.8296 1.1963 0.2196 -0.1710 -0.2005 286 GLN B CA 5049 C C . GLN B 265 ? 0.9136 1.8833 1.2217 0.2213 -0.1681 -0.1961 286 GLN B C 5050 O O . GLN B 265 ? 0.9222 1.8878 1.2325 0.2219 -0.1643 -0.1967 286 GLN B O 5051 C CB . GLN B 265 ? 0.8953 1.8562 1.2146 0.2165 -0.1718 -0.2191 286 GLN B CB 5052 C CG . GLN B 265 ? 0.9092 1.8519 1.2386 0.2140 -0.1739 -0.2255 286 GLN B CG 5053 C CD . GLN B 265 ? 0.9145 1.8526 1.2451 0.2150 -0.1782 -0.2136 286 GLN B CD 5054 O OE1 . GLN B 265 ? 0.9224 1.8721 1.2458 0.2179 -0.1797 -0.2010 286 GLN B OE1 5055 N NE2 . GLN B 265 ? 0.8804 1.8009 1.2202 0.2128 -0.1797 -0.2175 286 GLN B NE2 5056 N N . GLN B 266 ? 0.9411 1.9315 1.2384 0.2224 -0.1700 -0.1914 287 GLN B N 5057 C CA . GLN B 266 ? 0.9781 1.9872 1.2642 0.2235 -0.1673 -0.1867 287 GLN B CA 5058 C C . GLN B 266 ? 0.9629 1.9798 1.2500 0.2218 -0.1629 -0.2012 287 GLN B C 5059 O O . GLN B 266 ? 0.9306 1.9558 1.2123 0.2227 -0.1593 -0.1974 287 GLN B O 5060 C CB . GLN B 266 ? 1.0044 2.0371 1.2786 0.2240 -0.1702 -0.1839 287 GLN B CB 5061 C CG . GLN B 266 ? 1.0581 2.0854 1.3318 0.2265 -0.1743 -0.1691 287 GLN B CG 5062 C CD . GLN B 266 ? 1.1592 2.2111 1.4218 0.2274 -0.1773 -0.1664 287 GLN B CD 5063 O OE1 . GLN B 266 ? 1.1769 2.2508 1.4303 0.2258 -0.1760 -0.1741 287 GLN B OE1 5064 N NE2 . GLN B 266 ? 1.1643 2.2131 1.4281 0.2299 -0.1811 -0.1555 287 GLN B NE2 5065 N N . GLU B 267 ? 1.0054 2.0189 1.2993 0.2192 -0.1627 -0.2182 288 GLU B N 5066 C CA . GLU B 267 ? 1.0641 2.0843 1.3597 0.2175 -0.1579 -0.2339 288 GLU B CA 5067 C C . GLU B 267 ? 1.0785 2.0815 1.3832 0.2193 -0.1539 -0.2315 288 GLU B C 5068 O O . GLU B 267 ? 1.1168 2.1284 1.4208 0.2196 -0.1491 -0.2368 288 GLU B O 5069 C CB . GLU B 267 ? 1.1107 2.1298 1.4116 0.2137 -0.1582 -0.2525 288 GLU B CB 5070 C CG . GLU B 267 ? 1.1751 2.2178 1.4665 0.2108 -0.1608 -0.2599 288 GLU B CG 5071 C CD . GLU B 267 ? 1.1920 2.2319 1.4838 0.2113 -0.1669 -0.2517 288 GLU B CD 5072 O OE1 . GLU B 267 ? 1.1882 2.2063 1.4880 0.2134 -0.1687 -0.2419 288 GLU B OE1 5073 O OE2 . GLU B 267 ? 1.1961 2.2564 1.4806 0.2095 -0.1696 -0.2551 288 GLU B OE2 5074 N N . ASP B 268 ? 1.0578 2.0372 1.3713 0.2204 -0.1556 -0.2234 289 ASP B N 5075 C CA . ASP B 268 ? 1.0058 1.9677 1.3292 0.2219 -0.1524 -0.2213 289 ASP B CA 5076 C C . ASP B 268 ? 0.9512 1.9161 1.2714 0.2243 -0.1506 -0.2061 289 ASP B C 5077 O O . ASP B 268 ? 0.9570 1.9100 1.2850 0.2256 -0.1481 -0.2025 289 ASP B O 5078 C CB . ASP B 268 ? 1.0519 1.9878 1.3851 0.2213 -0.1551 -0.2189 289 ASP B CB 5079 C CG . ASP B 268 ? 1.1473 2.0791 1.4839 0.2184 -0.1564 -0.2340 289 ASP B CG 5080 O OD1 . ASP B 268 ? 1.1983 2.1305 1.5389 0.2175 -0.1529 -0.2488 289 ASP B OD1 5081 O OD2 . ASP B 268 ? 1.1685 2.0968 1.5045 0.2170 -0.1607 -0.2314 289 ASP B OD2 5082 N N . ALA B 269 ? 0.9630 1.9442 1.2714 0.2247 -0.1518 -0.1970 290 ALA B N 5083 C CA . ALA B 269 ? 0.9883 1.9743 1.2921 0.2263 -0.1495 -0.1830 290 ALA B CA 5084 C C . ALA B 269 ? 0.9690 1.9684 1.2729 0.2267 -0.1441 -0.1910 290 ALA B C 5085 O O . ALA B 269 ? 1.0024 2.0057 1.3104 0.2259 -0.1419 -0.2070 290 ALA B O 5086 C CB . ALA B 269 ? 0.9987 1.9982 1.2891 0.2267 -0.1519 -0.1715 290 ALA B CB 5087 N N . GLY B 270 ? 0.9025 1.9089 1.2024 0.2278 -0.1414 -0.1802 291 GLY B N 5088 C CA . GLY B 270 ? 0.9119 1.9333 1.2113 0.2280 -0.1358 -0.1871 291 GLY B CA 5089 C C . GLY B 270 ? 0.9175 1.9288 1.2290 0.2298 -0.1320 -0.1838 291 GLY B C 5090 O O . GLY B 270 ? 0.9462 1.9390 1.2652 0.2303 -0.1339 -0.1747 291 GLY B O 5091 N N . SER B 271 ? 0.8872 1.9117 1.2007 0.2303 -0.1264 -0.1918 292 SER B N 5092 C CA . SER B 271 ? 0.8706 1.8894 1.1961 0.2323 -0.1223 -0.1890 292 SER B CA 5093 C C . SER B 271 ? 0.8860 1.8891 1.2263 0.2339 -0.1211 -0.2003 292 SER B C 5094 O O . SER B 271 ? 0.9106 1.9171 1.2522 0.2337 -0.1192 -0.2158 292 SER B O 5095 C CB . SER B 271 ? 0.8088 1.8490 1.1304 0.2323 -0.1161 -0.1916 292 SER B CB 5096 O OG . SER B 271 ? 0.8001 1.8366 1.1326 0.2342 -0.1125 -0.1857 292 SER B OG 5097 N N . TYR B 272 ? 0.8459 1.8318 1.1972 0.2353 -0.1220 -0.1922 293 TYR B N 5098 C CA . TYR B 272 ? 0.8385 1.8076 1.2037 0.2372 -0.1210 -0.2003 293 TYR B CA 5099 C C . TYR B 272 ? 0.9032 1.8727 1.2803 0.2400 -0.1164 -0.1972 293 TYR B C 5100 O O . TYR B 272 ? 0.9423 1.9150 1.3195 0.2397 -0.1165 -0.1841 293 TYR B O 5101 C CB . TYR B 272 ? 0.8048 1.7512 1.1732 0.2359 -0.1268 -0.1942 293 TYR B CB 5102 C CG . TYR B 272 ? 0.7535 1.6957 1.1158 0.2339 -0.1305 -0.2024 293 TYR B CG 5103 C CD1 . TYR B 272 ? 0.7516 1.7047 1.1009 0.2319 -0.1335 -0.1983 293 TYR B CD1 5104 C CD2 . TYR B 272 ? 0.7394 1.6669 1.1089 0.2340 -0.1307 -0.2140 293 TYR B CD2 5105 C CE1 . TYR B 272 ? 0.8089 1.7603 1.1537 0.2300 -0.1369 -0.2059 293 TYR B CE1 5106 C CE2 . TYR B 272 ? 0.7601 1.6849 1.1247 0.2316 -0.1337 -0.2220 293 TYR B CE2 5107 C CZ . TYR B 272 ? 0.7803 1.7179 1.1330 0.2296 -0.1370 -0.2181 293 TYR B CZ 5108 O OH . TYR B 272 ? 0.7290 1.6657 1.0777 0.2271 -0.1402 -0.2262 293 TYR B OH 5109 N N . GLU B 273 ? 0.9189 1.8847 1.3061 0.2428 -0.1121 -0.2094 294 GLU B N 5110 C CA . GLU B 273 ? 0.9093 1.8754 1.3095 0.2462 -0.1075 -0.2075 294 GLU B CA 5111 C C . GLU B 273 ? 0.8753 1.8201 1.2886 0.2489 -0.1078 -0.2121 294 GLU B C 5112 O O . GLU B 273 ? 0.8167 1.7497 1.2292 0.2484 -0.1090 -0.2219 294 GLU B O 5113 C CB . GLU B 273 ? 0.9674 1.9540 1.3675 0.2477 -0.0998 -0.2169 294 GLU B CB 5114 C CG . GLU B 273 ? 1.0503 2.0578 1.4401 0.2455 -0.0987 -0.2084 294 GLU B CG 5115 C CD . GLU B 273 ? 1.1261 2.1545 1.5122 0.2457 -0.0912 -0.2196 294 GLU B CD 5116 O OE1 . GLU B 273 ? 1.1549 2.2011 1.5307 0.2433 -0.0899 -0.2140 294 GLU B OE1 5117 O OE2 . GLU B 273 ? 1.1347 2.1609 1.5278 0.2477 -0.0861 -0.2339 294 GLU B OE2 5118 N N . CYS B 274 ? 0.8771 1.8179 1.3025 0.2517 -0.1066 -0.2048 295 CYS B N 5119 C CA . CYS B 274 ? 0.8918 1.8122 1.3294 0.2545 -0.1076 -0.2057 295 CYS B CA 5120 C C . CYS B 274 ? 0.9243 1.8499 1.3754 0.2598 -0.1009 -0.2101 295 CYS B C 5121 O O . CYS B 274 ? 0.9354 1.8769 1.3902 0.2608 -0.0980 -0.2039 295 CYS B O 5122 C CB . CYS B 274 ? 0.8592 1.7674 1.2988 0.2521 -0.1139 -0.1902 295 CYS B CB 5123 S SG . CYS B 274 ? 0.9073 1.7973 1.3633 0.2555 -0.1150 -0.1858 295 CYS B SG 5124 N N . VAL B 275 ? 0.9044 1.8164 1.3628 0.2631 -0.0981 -0.2206 296 VAL B N 5125 C CA . VAL B 275 ? 0.8874 1.8031 1.3582 0.2688 -0.0908 -0.2265 296 VAL B CA 5126 C C . VAL B 275 ? 0.8888 1.7860 1.3735 0.2730 -0.0924 -0.2214 296 VAL B C 5127 O O . VAL B 275 ? 0.9040 1.7806 1.3897 0.2736 -0.0936 -0.2269 296 VAL B O 5128 C CB . VAL B 275 ? 0.8500 1.7669 1.3178 0.2697 -0.0838 -0.2448 296 VAL B CB 5129 C CG1 . VAL B 275 ? 0.8606 1.7748 1.3422 0.2759 -0.0760 -0.2510 296 VAL B CG1 5130 C CG2 . VAL B 275 ? 0.8536 1.7935 1.3093 0.2662 -0.0809 -0.2498 296 VAL B CG2 5131 N N . ALA B 276 ? 0.8770 1.7825 1.3722 0.2755 -0.0922 -0.2107 297 ALA B N 5132 C CA . ALA B 276 ? 0.8693 1.7613 1.3785 0.2798 -0.0938 -0.2046 297 ALA B CA 5133 C C . ALA B 276 ? 0.9471 1.8470 1.4698 0.2868 -0.0856 -0.2106 297 ALA B C 5134 O O . ALA B 276 ? 0.9419 1.8636 1.4670 0.2876 -0.0808 -0.2107 297 ALA B O 5135 C CB . ALA B 276 ? 0.8011 1.6968 1.3136 0.2772 -0.1001 -0.1878 297 ALA B CB 5136 N N . GLU B 277 ? 1.0313 1.9134 1.5626 0.2916 -0.0838 -0.2154 298 GLU B N 5137 C CA . GLU B 277 ? 1.1225 2.0096 1.6666 0.2987 -0.0754 -0.2217 298 GLU B CA 5138 C C . GLU B 277 ? 1.1126 1.9783 1.6683 0.3046 -0.0752 -0.2212 298 GLU B C 5139 O O . GLU B 277 ? 1.1115 1.9552 1.6631 0.3029 -0.0803 -0.2198 298 GLU B O 5140 C CB . GLU B 277 ? 1.2304 2.1238 1.7671 0.2981 -0.0669 -0.2383 298 GLU B CB 5141 C CG . GLU B 277 ? 1.3244 2.1945 1.8570 0.2985 -0.0643 -0.2512 298 GLU B CG 5142 C CD . GLU B 277 ? 1.3982 2.2756 1.9194 0.2950 -0.0576 -0.2675 298 GLU B CD 5143 O OE1 . GLU B 277 ? 1.4162 2.2934 1.9421 0.2982 -0.0484 -0.2786 298 GLU B OE1 5144 O OE2 . GLU B 277 ? 1.4249 2.3086 1.9322 0.2887 -0.0615 -0.2690 298 GLU B OE2 5145 N N . ASN B 278 ? 1.1176 1.9903 1.6880 0.3116 -0.0689 -0.2221 299 ASN B N 5146 C CA . ASN B 278 ? 1.1112 1.9648 1.6931 0.3185 -0.0667 -0.2228 299 ASN B CA 5147 C C . ASN B 278 ? 1.1229 1.9833 1.7137 0.3246 -0.0555 -0.2337 299 ASN B C 5148 O O . ASN B 278 ? 1.1433 2.0115 1.7256 0.3218 -0.0489 -0.2463 299 ASN B O 5149 C CB . ASN B 278 ? 1.0588 1.9129 1.6536 0.3217 -0.0735 -0.2062 299 ASN B CB 5150 C CG . ASN B 278 ? 0.9844 1.8676 1.5885 0.3224 -0.0732 -0.1976 299 ASN B CG 5151 O OD1 . ASN B 278 ? 0.9868 1.8894 1.5883 0.3212 -0.0674 -0.2040 299 ASN B OD1 5152 N ND2 . ASN B 278 ? 0.9336 1.8205 1.5484 0.3239 -0.0795 -0.1833 299 ASN B ND2 5153 N N . SER B 279 ? 1.0800 1.9377 1.6879 0.3325 -0.0531 -0.2287 300 SER B N 5154 C CA . SER B 279 ? 1.0546 1.9168 1.6724 0.3387 -0.0420 -0.2385 300 SER B CA 5155 C C . SER B 279 ? 1.0531 1.9472 1.6796 0.3401 -0.0379 -0.2358 300 SER B C 5156 O O . SER B 279 ? 1.0784 1.9806 1.7124 0.3442 -0.0279 -0.2445 300 SER B O 5157 C CB . SER B 279 ? 1.0452 1.8897 1.6781 0.3473 -0.0407 -0.2340 300 SER B CB 5158 O OG . SER B 279 ? 1.0146 1.8720 1.6622 0.3516 -0.0466 -0.2180 300 SER B OG 5159 N N . ARG B 280 ? 1.0233 1.9345 1.6484 0.3360 -0.0452 -0.2240 301 ARG B N 5160 C CA . ARG B 280 ? 1.0046 1.9459 1.6388 0.3368 -0.0421 -0.2195 301 ARG B CA 5161 C C . ARG B 280 ? 1.0005 1.9594 1.6196 0.3293 -0.0396 -0.2255 301 ARG B C 5162 O O . ARG B 280 ? 0.9943 1.9745 1.6179 0.3300 -0.0322 -0.2295 301 ARG B O 5163 C CB . ARG B 280 ? 0.9728 1.9240 1.6174 0.3371 -0.0509 -0.2019 301 ARG B CB 5164 C CG . ARG B 280 ? 0.9881 1.9289 1.6505 0.3456 -0.0526 -0.1948 301 ARG B CG 5165 C CD . ARG B 280 ? 0.9822 1.9278 1.6592 0.3542 -0.0415 -0.2034 301 ARG B CD 5166 N NE . ARG B 280 ? 1.0076 1.9422 1.7017 0.3630 -0.0429 -0.1964 301 ARG B NE 5167 C CZ . ARG B 280 ? 1.0503 1.9891 1.7613 0.3719 -0.0345 -0.2002 301 ARG B CZ 5168 N NH1 . ARG B 280 ? 1.0868 2.0401 1.7995 0.3726 -0.0239 -0.2116 301 ARG B NH1 5169 N NH2 . ARG B 280 ? 1.0229 1.9512 1.7489 0.3800 -0.0367 -0.1923 301 ARG B NH2 5170 N N . GLY B 281 ? 0.9838 1.9342 1.5851 0.3220 -0.0457 -0.2258 302 GLY B N 5171 C CA . GLY B 281 ? 1.0106 1.9770 1.5963 0.3149 -0.0442 -0.2303 302 GLY B CA 5172 C C . GLY B 281 ? 1.0497 2.0059 1.6176 0.3076 -0.0523 -0.2284 302 GLY B C 5173 O O . GLY B 281 ? 1.0643 1.9976 1.6288 0.3075 -0.0570 -0.2291 302 GLY B O 5174 N N . LYS B 282 ? 1.0221 1.9955 1.5781 0.3013 -0.0536 -0.2259 303 LYS B N 5175 C CA . LYS B 282 ? 1.0104 1.9768 1.5490 0.2944 -0.0607 -0.2242 303 LYS B CA 5176 C C . LYS B 282 ? 0.9703 1.9520 1.5034 0.2891 -0.0661 -0.2107 303 LYS B C 5177 O O . LYS B 282 ? 0.9035 1.9018 1.4459 0.2903 -0.0641 -0.2033 303 LYS B O 5178 C CB . LYS B 282 ? 1.0633 2.0328 1.5874 0.2911 -0.0556 -0.2393 303 LYS B CB 5179 C CG . LYS B 282 ? 1.1111 2.0620 1.6365 0.2941 -0.0506 -0.2537 303 LYS B CG 5180 C CD . LYS B 282 ? 1.1450 2.1008 1.6544 0.2890 -0.0466 -0.2681 303 LYS B CD 5181 C CE . LYS B 282 ? 1.1773 2.1128 1.6865 0.2904 -0.0419 -0.2829 303 LYS B CE 5182 N NZ . LYS B 282 ? 1.1818 2.1222 1.6744 0.2841 -0.0395 -0.2967 303 LYS B NZ 5183 N N . ASN B 283 ? 1.0051 1.9805 1.5229 0.2832 -0.0725 -0.2078 304 ASN B N 5184 C CA . ASN B 283 ? 1.0500 2.0366 1.5595 0.2774 -0.0774 -0.1956 304 ASN B CA 5185 C C . ASN B 283 ? 1.0568 2.0343 1.5485 0.2720 -0.0828 -0.1967 304 ASN B C 5186 O O . ASN B 283 ? 1.0722 2.0293 1.5621 0.2718 -0.0874 -0.1985 304 ASN B O 5187 C CB . ASN B 283 ? 1.0960 2.0779 1.6158 0.2774 -0.0833 -0.1807 304 ASN B CB 5188 C CG . ASN B 283 ? 1.1437 2.1420 1.6593 0.2722 -0.0851 -0.1686 304 ASN B CG 5189 O OD1 . ASN B 283 ? 1.1793 2.1971 1.6909 0.2710 -0.0795 -0.1708 304 ASN B OD1 5190 N ND2 . ASN B 283 ? 1.1325 2.1224 1.6484 0.2686 -0.0922 -0.1559 304 ASN B ND2 5191 N N . VAL B 284 ? 1.0308 2.0237 1.5092 0.2674 -0.0822 -0.1955 305 VAL B N 5192 C CA . VAL B 284 ? 1.0088 1.9955 1.4706 0.2627 -0.0874 -0.1957 305 VAL B CA 5193 C C . VAL B 284 ? 0.9656 1.9551 1.4191 0.2576 -0.0930 -0.1804 305 VAL B C 5194 O O . VAL B 284 ? 0.9318 1.9359 1.3873 0.2565 -0.0909 -0.1722 305 VAL B O 5195 C CB . VAL B 284 ? 1.0381 2.0377 1.4878 0.2612 -0.0826 -0.2082 305 VAL B CB 5196 C CG1 . VAL B 284 ? 1.0391 2.0289 1.4932 0.2645 -0.0784 -0.2245 305 VAL B CG1 5197 C CG2 . VAL B 284 ? 1.0654 2.0892 1.5144 0.2608 -0.0760 -0.2076 305 VAL B CG2 5198 N N . ALA B 285 ? 0.9243 1.8989 1.3688 0.2543 -0.0997 -0.1770 306 ALA B N 5199 C CA . ALA B 285 ? 0.8587 1.8331 1.2932 0.2493 -0.1046 -0.1636 306 ALA B CA 5200 C C . ALA B 285 ? 0.8185 1.7946 1.2363 0.2465 -0.1067 -0.1678 306 ALA B C 5201 O O . ALA B 285 ? 0.7939 1.7596 1.2095 0.2471 -0.1082 -0.1775 306 ALA B O 5202 C CB . ALA B 285 ? 0.8218 1.7761 1.2616 0.2477 -0.1107 -0.1543 306 ALA B CB 5203 N N . LYS B 286 ? 0.8352 1.8245 1.2412 0.2435 -0.1064 -0.1604 307 LYS B N 5204 C CA . LYS B 286 ? 0.8821 1.8753 1.2720 0.2410 -0.1086 -0.1630 307 LYS B CA 5205 C C . LYS B 286 ? 0.8858 1.8693 1.2668 0.2373 -0.1143 -0.1494 307 LYS B C 5206 O O . LYS B 286 ? 0.8856 1.8652 1.2703 0.2357 -0.1149 -0.1370 307 LYS B O 5207 C CB . LYS B 286 ? 0.9120 1.9291 1.2930 0.2406 -0.1034 -0.1666 307 LYS B CB 5208 C CG . LYS B 286 ? 0.9643 1.9928 1.3426 0.2386 -0.1012 -0.1535 307 LYS B CG 5209 C CD . LYS B 286 ? 0.9810 2.0317 1.3597 0.2395 -0.0936 -0.1598 307 LYS B CD 5210 C CE . LYS B 286 ? 0.9463 2.0063 1.3284 0.2379 -0.0907 -0.1478 307 LYS B CE 5211 N NZ . LYS B 286 ? 0.9078 1.9843 1.2995 0.2400 -0.0827 -0.1555 307 LYS B NZ 5212 N N . GLY B 287 ? 0.8812 1.8610 1.2510 0.2360 -0.1179 -0.1519 308 GLY B N 5213 C CA . GLY B 287 ? 0.8310 1.8015 1.1918 0.2330 -0.1227 -0.1401 308 GLY B CA 5214 C C . GLY B 287 ? 0.8251 1.8006 1.1731 0.2324 -0.1252 -0.1454 308 GLY B C 5215 O O . GLY B 287 ? 0.7982 1.7776 1.1466 0.2337 -0.1245 -0.1594 308 GLY B O 5216 N N . GLN B 288 ? 0.8689 1.8443 1.2054 0.2304 -0.1276 -0.1341 309 GLN B N 5217 C CA . GLN B 288 ? 0.9062 1.8879 1.2303 0.2300 -0.1304 -0.1372 309 GLN B CA 5218 C C . GLN B 288 ? 0.9384 1.9017 1.2618 0.2289 -0.1357 -0.1324 309 GLN B C 5219 O O . GLN B 288 ? 0.9942 1.9454 1.3186 0.2274 -0.1369 -0.1194 309 GLN B O 5220 C CB . GLN B 288 ? 0.9599 1.9584 1.2693 0.2293 -0.1287 -0.1281 309 GLN B CB 5221 C CG . GLN B 288 ? 1.0663 2.0868 1.3668 0.2296 -0.1266 -0.1389 309 GLN B CG 5222 C CD . GLN B 288 ? 1.1660 2.1975 1.4493 0.2287 -0.1283 -0.1311 309 GLN B CD 5223 O OE1 . GLN B 288 ? 1.2371 2.2888 1.5102 0.2282 -0.1261 -0.1353 309 GLN B OE1 5224 N NE2 . GLN B 288 ? 1.1747 2.1930 1.4547 0.2285 -0.1322 -0.1194 309 GLN B NE2 5225 N N . LEU B 289 ? 0.8815 1.8436 1.2037 0.2290 -0.1385 -0.1432 310 LEU B N 5226 C CA . LEU B 289 ? 0.8432 1.7905 1.1647 0.2280 -0.1434 -0.1397 310 LEU B CA 5227 C C . LEU B 289 ? 0.8826 1.8421 1.1902 0.2280 -0.1455 -0.1351 310 LEU B C 5228 O O . LEU B 289 ? 0.8362 1.8111 1.1376 0.2283 -0.1458 -0.1453 310 LEU B O 5229 C CB . LEU B 289 ? 0.8013 1.7375 1.1312 0.2278 -0.1454 -0.1538 310 LEU B CB 5230 C CG . LEU B 289 ? 0.7672 1.6831 1.1106 0.2275 -0.1451 -0.1536 310 LEU B CG 5231 C CD1 . LEU B 289 ? 0.7182 1.6399 1.0674 0.2289 -0.1407 -0.1524 310 LEU B CD1 5232 C CD2 . LEU B 289 ? 0.7623 1.6674 1.1126 0.2273 -0.1465 -0.1677 310 LEU B CD2 5233 N N . THR B 290 ? 0.9375 1.8904 1.2402 0.2276 -0.1466 -0.1197 311 THR B N 5234 C CA . THR B 290 ? 0.9502 1.9138 1.2400 0.2283 -0.1481 -0.1122 311 THR B CA 5235 C C . THR B 290 ? 0.9287 1.8811 1.2199 0.2283 -0.1528 -0.1118 311 THR B C 5236 O O . THR B 290 ? 0.8923 1.8260 1.1889 0.2274 -0.1538 -0.1032 311 THR B O 5237 C CB . THR B 290 ? 0.9559 1.9195 1.2387 0.2282 -0.1455 -0.0946 311 THR B CB 5238 O OG1 . THR B 290 ? 0.9888 1.9619 1.2723 0.2278 -0.1410 -0.0951 311 THR B OG1 5239 C CG2 . THR B 290 ? 0.9437 1.9203 1.2118 0.2296 -0.1465 -0.0869 311 THR B CG2 5240 N N . PHE B 291 ? 0.9535 1.9184 1.2401 0.2288 -0.1554 -0.1214 312 PHE B N 5241 C CA . PHE B 291 ? 0.9546 1.9122 1.2435 0.2289 -0.1599 -0.1227 312 PHE B CA 5242 C C . PHE B 291 ? 0.9413 1.8957 1.2239 0.2304 -0.1611 -0.1060 312 PHE B C 5243 O O . PHE B 291 ? 1.0052 1.9734 1.2763 0.2319 -0.1597 -0.0971 312 PHE B O 5244 C CB . PHE B 291 ? 0.9876 1.9630 1.2725 0.2287 -0.1621 -0.1371 312 PHE B CB 5245 C CG . PHE B 291 ? 1.0225 1.9935 1.3105 0.2286 -0.1668 -0.1395 312 PHE B CG 5246 C CD1 . PHE B 291 ? 1.0355 1.9924 1.3346 0.2267 -0.1683 -0.1508 312 PHE B CD1 5247 C CD2 . PHE B 291 ? 1.0359 2.0170 1.3158 0.2306 -0.1694 -0.1302 312 PHE B CD2 5248 C CE1 . PHE B 291 ? 1.0206 1.9742 1.3232 0.2262 -0.1724 -0.1535 312 PHE B CE1 5249 C CE2 . PHE B 291 ? 1.0210 1.9994 1.3051 0.2306 -0.1737 -0.1326 312 PHE B CE2 5250 C CZ . PHE B 291 ? 1.0132 1.9782 1.3088 0.2283 -0.1751 -0.1445 312 PHE B CZ 5251 N N . TYR B 292 ? 0.9347 2.1847 1.4997 0.4124 -0.1541 -0.3673 313 TYR B N 5252 C CA . TYR B 292 ? 0.8146 2.0548 1.4068 0.3648 -0.1383 -0.3385 313 TYR B CA 5253 C C . TYR B 292 ? 0.8087 1.9142 1.3220 0.3620 -0.1482 -0.3182 313 TYR B C 5254 O O . TYR B 292 ? 0.8152 1.8453 1.2617 0.3920 -0.1704 -0.3311 313 TYR B O 5255 C CB . TYR B 292 ? 0.7461 2.0813 1.4187 0.3408 -0.1424 -0.3484 313 TYR B CB 5256 C CG . TYR B 292 ? 0.7991 2.0904 1.4510 0.3532 -0.1717 -0.3572 313 TYR B CG 5257 C CD1 . TYR B 292 ? 0.8819 2.2062 1.5379 0.3917 -0.1970 -0.3906 313 TYR B CD1 5258 C CD2 . TYR B 292 ? 0.7864 2.0011 1.4124 0.3265 -0.1740 -0.3333 313 TYR B CD2 5259 C CE1 . TYR B 292 ? 0.9243 2.2021 1.5573 0.4018 -0.2231 -0.3993 313 TYR B CE1 5260 C CE2 . TYR B 292 ? 0.8505 2.0197 1.4543 0.3362 -0.1990 -0.3412 313 TYR B CE2 5261 C CZ . TYR B 292 ? 0.9352 2.1342 1.5419 0.3730 -0.2231 -0.3738 313 TYR B CZ 5262 O OH . TYR B 292 ? 1.0262 2.1739 1.6073 0.3817 -0.2473 -0.3824 313 TYR B OH 5263 N N . ALA B 293 ? 0.7415 1.8150 1.2583 0.3238 -0.1308 -0.2886 314 ALA B N 5264 C CA . ALA B 293 ? 0.7612 1.7150 1.2094 0.3171 -0.1368 -0.2696 314 ALA B CA 5265 C C . ALA B 293 ? 0.6953 1.6463 1.1742 0.2727 -0.1238 -0.2439 314 ALA B C 5266 O O . ALA B 293 ? 0.6587 1.6602 1.1800 0.2437 -0.1014 -0.2306 314 ALA B O 5267 C CB . ALA B 293 ? 0.7820 1.6525 1.1548 0.3297 -0.1289 -0.2590 314 ALA B CB 5268 N N . GLN B 294 ? 0.6905 1.5766 1.1417 0.2663 -0.1380 -0.2382 315 GLN B N 5269 C CA . GLN B 294 ? 0.6717 1.5376 1.1372 0.2268 -0.1286 -0.2140 315 GLN B CA 5270 C C . GLN B 294 ? 0.6524 1.4508 1.0761 0.2155 -0.1106 -0.1906 315 GLN B C 5271 O O . GLN B 294 ? 0.7017 1.4461 1.0701 0.2387 -0.1101 -0.1929 315 GLN B O 5272 C CB . GLN B 294 ? 0.7559 1.5590 1.1933 0.2262 -0.1483 -0.2147 315 GLN B CB 5273 C CG . GLN B 294 ? 0.8370 1.6877 1.3011 0.2436 -0.1701 -0.2397 315 GLN B CG 5274 C CD . GLN B 294 ? 0.9072 1.6945 1.3466 0.2363 -0.1862 -0.2371 315 GLN B CD 5275 O OE1 . GLN B 294 ? 0.9996 1.7352 1.3968 0.2627 -0.2044 -0.2547 315 GLN B OE1 5276 N NE2 . GLN B 294 ? 0.8957 1.6795 1.3550 0.1991 -0.1786 -0.2158 315 GLN B NE2 5277 N N . PRO B 295 ? 0.5749 1.3729 1.0196 0.1783 -0.0964 -0.1689 316 PRO B N 5278 C CA . PRO B 295 ? 0.6126 1.3500 1.0207 0.1677 -0.0798 -0.1479 316 PRO B CA 5279 C C . PRO B 295 ? 0.6853 1.3163 1.0204 0.1828 -0.0902 -0.1446 316 PRO B C 5280 O O . PRO B 295 ? 0.5966 1.1929 0.9162 0.1854 -0.1064 -0.1506 316 PRO B O 5281 C CB . PRO B 295 ? 0.5803 1.3324 1.0211 0.1248 -0.0683 -0.1294 316 PRO B CB 5282 C CG . PRO B 295 ? 0.5665 1.4064 1.0663 0.1094 -0.0726 -0.1411 316 PRO B CG 5283 C CD . PRO B 295 ? 0.5380 1.3860 1.0335 0.1430 -0.0955 -0.1635 316 PRO B CD 5284 N N . ASN B 296 ? 0.7633 1.3420 1.0508 0.1899 -0.0798 -0.1361 317 ASN B N 5285 C CA . ASN B 296 ? 0.8065 1.2842 1.0224 0.1927 -0.0840 -0.1308 317 ASN B CA 5286 C C . ASN B 296 ? 0.7235 1.1688 0.9201 0.1774 -0.0651 -0.1101 317 ASN B C 5287 O O . ASN B 296 ? 0.6887 1.1683 0.9000 0.1779 -0.0514 -0.1048 317 ASN B O 5288 C CB . ASN B 296 ? 0.9403 1.3683 1.0901 0.2216 -0.0977 -0.1505 317 ASN B CB 5289 C CG . ASN B 296 ? 1.0534 1.5006 1.1862 0.2390 -0.0915 -0.1544 317 ASN B CG 5290 O OD1 . ASN B 296 ? 1.0827 1.4682 1.1507 0.2405 -0.0871 -0.1489 317 ASN B OD1 5291 N ND2 . ASN B 296 ? 1.0856 1.6206 1.2753 0.2498 -0.0909 -0.1643 317 ASN B ND2 5292 N N . TRP B 297 ? 0.7094 1.0893 0.8738 0.1634 -0.0640 -0.0995 318 TRP B N 5293 C CA . TRP B 297 ? 0.6314 0.9832 0.7822 0.1477 -0.0474 -0.0807 318 TRP B CA 5294 C C . TRP B 297 ? 0.6395 0.9533 0.7333 0.1602 -0.0421 -0.0801 318 TRP B C 5295 O O . TRP B 297 ? 0.6896 0.9627 0.7268 0.1757 -0.0536 -0.0937 318 TRP B O 5296 C CB . TRP B 297 ? 0.5854 0.8802 0.7157 0.1311 -0.0488 -0.0726 318 TRP B CB 5297 C CG . TRP B 297 ? 0.5614 0.8899 0.7438 0.1123 -0.0518 -0.0670 318 TRP B CG 5298 C CD1 . TRP B 297 ? 0.5552 0.8593 0.7342 0.1078 -0.0646 -0.0717 318 TRP B CD1 5299 C CD2 . TRP B 297 ? 0.5511 0.9379 0.7883 0.0908 -0.0412 -0.0559 318 TRP B CD2 5300 N NE1 . TRP B 297 ? 0.5568 0.9006 0.7838 0.0856 -0.0644 -0.0630 318 TRP B NE1 5301 C CE2 . TRP B 297 ? 0.5415 0.9349 0.8022 0.0731 -0.0500 -0.0540 318 TRP B CE2 5302 C CE3 . TRP B 297 ? 0.5722 0.9992 0.8335 0.0816 -0.0246 -0.0481 318 TRP B CE3 5303 C CZ2 . TRP B 297 ? 0.5293 0.9650 0.8306 0.0447 -0.0434 -0.0449 318 TRP B CZ2 5304 C CZ3 . TRP B 297 ? 0.5626 1.0308 0.8652 0.0527 -0.0168 -0.0398 318 TRP B CZ3 5305 C CH2 . TRP B 297 ? 0.5372 1.0079 0.8567 0.0339 -0.0267 -0.0385 318 TRP B CH2 5306 N N . VAL B 298 ? 0.6033 0.9281 0.7078 0.1500 -0.0253 -0.0646 319 VAL B N 5307 C CA . VAL B 298 ? 0.5961 0.8821 0.6466 0.1558 -0.0198 -0.0584 319 VAL B CA 5308 C C . VAL B 298 ? 0.6094 0.8559 0.6464 0.1357 -0.0088 -0.0409 319 VAL B C 5309 O O . VAL B 298 ? 0.6866 0.8799 0.6656 0.1338 -0.0109 -0.0347 319 VAL B O 5310 C CB . VAL B 298 ? 0.5849 0.9231 0.6613 0.1635 -0.0093 -0.0565 319 VAL B CB 5311 C CG1 . VAL B 298 ? 0.6110 0.9086 0.6397 0.1617 -0.0012 -0.0421 319 VAL B CG1 5312 C CG2 . VAL B 298 ? 0.6410 1.0105 0.7164 0.1880 -0.0222 -0.0764 319 VAL B CG2 5313 N N . GLN B 299 ? 0.5627 0.8382 0.6523 0.1182 0.0003 -0.0326 320 GLN B N 5314 C CA . GLN B 299 ? 0.5118 0.7537 0.5948 0.0998 0.0090 -0.0191 320 GLN B CA 5315 C C . GLN B 299 ? 0.4907 0.7514 0.6172 0.0837 0.0070 -0.0177 320 GLN B C 5316 O O . GLN B 299 ? 0.5135 0.8275 0.6889 0.0732 0.0103 -0.0163 320 GLN B O 5317 C CB . GLN B 299 ? 0.3942 0.6472 0.4850 0.0907 0.0257 -0.0053 320 GLN B CB 5318 C CG . GLN B 299 ? 0.4267 0.6547 0.5202 0.0709 0.0341 0.0070 320 GLN B CG 5319 C CD . GLN B 299 ? 0.5120 0.7357 0.5987 0.0635 0.0472 0.0199 320 GLN B CD 5320 O OE1 . GLN B 299 ? 0.5244 0.7276 0.5764 0.0744 0.0465 0.0229 320 GLN B OE1 5321 N NE2 . GLN B 299 ? 0.5112 0.7484 0.6262 0.0435 0.0559 0.0282 320 GLN B NE2 5322 N N . ILE B 300 ? 0.5073 0.7225 0.6112 0.0786 0.0008 -0.0181 321 ILE B N 5323 C CA . ILE B 300 ? 0.5324 0.7556 0.6681 0.0639 -0.0042 -0.0164 321 ILE B CA 5324 C C . ILE B 300 ? 0.5414 0.7431 0.6770 0.0468 0.0054 -0.0045 321 ILE B C 5325 O O . ILE B 300 ? 0.5926 0.7654 0.6982 0.0487 0.0139 -0.0001 321 ILE B O 5326 C CB . ILE B 300 ? 0.5824 0.7668 0.6916 0.0699 -0.0192 -0.0273 321 ILE B CB 5327 C CG1 . ILE B 300 ? 0.6121 0.7329 0.6623 0.0705 -0.0175 -0.0294 321 ILE B CG1 5328 C CG2 . ILE B 300 ? 0.5940 0.7954 0.6999 0.0871 -0.0310 -0.0416 321 ILE B CG2 5329 C CD1 . ILE B 300 ? 0.6341 0.7115 0.6465 0.0711 -0.0302 -0.0431 321 ILE B CD1 5330 N N . ILE B 301 ? 0.4422 0.6548 0.6063 0.0290 0.0028 0.0003 322 ILE B N 5331 C CA . ILE B 301 ? 0.4183 0.6038 0.5764 0.0145 0.0088 0.0091 322 ILE B CA 5332 C C . ILE B 301 ? 0.4508 0.5867 0.5763 0.0207 0.0039 0.0035 322 ILE B C 5333 O O . ILE B 301 ? 0.4264 0.5452 0.5358 0.0300 -0.0062 -0.0060 322 ILE B O 5334 C CB . ILE B 301 ? 0.4416 0.6411 0.6255 -0.0084 0.0062 0.0160 322 ILE B CB 5335 C CG1 . ILE B 301 ? 0.3972 0.5934 0.5883 -0.0118 -0.0086 0.0108 322 ILE B CG1 5336 C CG2 . ILE B 301 ? 0.4563 0.6999 0.6640 -0.0189 0.0130 0.0203 322 ILE B CG2 5337 C CD1 . ILE B 301 ? 0.3390 0.5362 0.5404 -0.0349 -0.0118 0.0183 322 ILE B CD1 5338 N N . ASN B 302 ? 0.3999 0.5103 0.5119 0.0145 0.0114 0.0082 323 ASN B N 5339 C CA . ASN B 302 ? 0.3942 0.4611 0.4735 0.0178 0.0102 0.0018 323 ASN B CA 5340 C C . ASN B 302 ? 0.4664 0.5202 0.5556 0.0058 0.0101 0.0049 323 ASN B C 5341 O O . ASN B 302 ? 0.4402 0.5080 0.5486 -0.0049 0.0122 0.0137 323 ASN B O 5342 C CB . ASN B 302 ? 0.4809 0.5280 0.5244 0.0225 0.0180 0.0024 323 ASN B CB 5343 C CG . ASN B 302 ? 0.5762 0.6361 0.6315 0.0174 0.0285 0.0127 323 ASN B CG 5344 O OD1 . ASN B 302 ? 0.4985 0.5886 0.5737 0.0166 0.0327 0.0191 323 ASN B OD1 5345 N ND2 . ASN B 302 ? 0.6393 0.6752 0.6810 0.0127 0.0311 0.0133 323 ASN B ND2 5346 N N . ASP B 303 ? 0.4090 0.4293 0.4772 0.0064 0.0067 -0.0031 324 ASP B N 5347 C CA . ASP B 303 ? 0.4632 0.4678 0.5361 -0.0015 0.0059 -0.0028 324 ASP B CA 5348 C C . ASP B 303 ? 0.5043 0.5094 0.5742 -0.0027 0.0155 0.0015 324 ASP B C 5349 O O . ASP B 303 ? 0.3704 0.3689 0.4196 0.0007 0.0226 0.0001 324 ASP B O 5350 C CB . ASP B 303 ? 0.5286 0.5025 0.5781 0.0007 0.0032 -0.0143 324 ASP B CB 5351 C CG . ASP B 303 ? 0.7118 0.6745 0.7648 -0.0011 -0.0101 -0.0170 324 ASP B CG 5352 O OD1 . ASP B 303 ? 0.6422 0.6260 0.7168 -0.0037 -0.0173 -0.0102 324 ASP B OD1 5353 O OD2 . ASP B 303 ? 0.8472 0.7820 0.8802 -0.0007 -0.0127 -0.0256 324 ASP B OD2 5354 N N . ILE B 304 ? 0.4275 0.4334 0.5095 -0.0076 0.0118 0.0069 325 ILE B N 5355 C CA . ILE B 304 ? 0.3910 0.3951 0.4705 -0.0071 0.0176 0.0090 325 ILE B CA 5356 C C . ILE B 304 ? 0.4307 0.4232 0.5135 -0.0094 0.0138 0.0045 325 ILE B C 5357 O O . ILE B 304 ? 0.5499 0.5360 0.6402 -0.0146 0.0035 0.0071 325 ILE B O 5358 C CB . ILE B 304 ? 0.4443 0.4645 0.5356 -0.0134 0.0186 0.0210 325 ILE B CB 5359 C CG1 . ILE B 304 ? 0.4133 0.4502 0.5018 -0.0104 0.0272 0.0244 325 ILE B CG1 5360 C CG2 . ILE B 304 ? 0.4389 0.4512 0.5274 -0.0125 0.0192 0.0225 325 ILE B CG2 5361 C CD1 . ILE B 304 ? 0.5906 0.6458 0.6902 -0.0166 0.0296 0.0344 325 ILE B CD1 5362 N N . HIS B 305 ? 0.3078 0.2936 0.3826 -0.0079 0.0217 -0.0024 326 HIS B N 5363 C CA . HIS B 305 ? 0.3678 0.3395 0.4437 -0.0078 0.0177 -0.0097 326 HIS B CA 5364 C C . HIS B 305 ? 0.4827 0.4613 0.5626 -0.0064 0.0216 -0.0067 326 HIS B C 5365 O O . HIS B 305 ? 0.4953 0.4816 0.5673 -0.0040 0.0323 -0.0102 326 HIS B O 5366 C CB . HIS B 305 ? 0.3179 0.2826 0.3783 -0.0044 0.0226 -0.0242 326 HIS B CB 5367 C CG . HIS B 305 ? 0.4234 0.3814 0.4863 -0.0019 0.0176 -0.0337 326 HIS B CG 5368 N ND1 . HIS B 305 ? 0.5182 0.4596 0.5875 -0.0015 0.0048 -0.0328 326 HIS B ND1 5369 C CD2 . HIS B 305 ? 0.4717 0.4401 0.5311 -0.0007 0.0228 -0.0430 326 HIS B CD2 5370 C CE1 . HIS B 305 ? 0.4262 0.3658 0.4950 0.0036 0.0025 -0.0435 326 HIS B CE1 5371 N NE2 . HIS B 305 ? 0.4624 0.4222 0.5282 0.0037 0.0134 -0.0498 326 HIS B NE2 5372 N N . VAL B 306 ? 0.5400 0.5131 0.6283 -0.0091 0.0119 0.0000 327 VAL B N 5373 C CA . VAL B 306 ? 0.3998 0.3774 0.4901 -0.0091 0.0133 0.0064 327 VAL B CA 5374 C C . VAL B 306 ? 0.3945 0.3527 0.4852 -0.0061 0.0016 0.0018 327 VAL B C 5375 O O . VAL B 306 ? 0.5074 0.4477 0.5959 -0.0063 -0.0110 -0.0002 327 VAL B O 5376 C CB . VAL B 306 ? 0.4333 0.4213 0.5246 -0.0133 0.0116 0.0192 327 VAL B CB 5377 C CG1 . VAL B 306 ? 0.3862 0.3624 0.4788 -0.0218 -0.0023 0.0241 327 VAL B CG1 5378 C CG2 . VAL B 306 ? 0.4755 0.4672 0.5636 -0.0121 0.0156 0.0244 327 VAL B CG2 5379 N N . ALA B 307 ? 0.2895 0.2507 0.3800 -0.0012 0.0046 -0.0006 328 ALA B N 5380 C CA . ALA B 307 ? 0.4297 0.3757 0.5188 0.0058 -0.0086 -0.0061 328 ALA B CA 5381 C C . ALA B 307 ? 0.4663 0.3871 0.5478 -0.0024 -0.0225 0.0056 328 ALA B C 5382 O O . ALA B 307 ? 0.4383 0.3658 0.5188 -0.0148 -0.0181 0.0188 328 ALA B O 5383 C CB . ALA B 307 ? 0.3174 0.2779 0.4082 0.0112 -0.0025 -0.0102 328 ALA B CB 5384 N N . MET B 308 ? 0.4415 0.3372 0.5142 0.0048 -0.0395 -0.0009 329 MET B N 5385 C CA . MET B 308 ? 0.5590 0.4222 0.6144 -0.0042 -0.0551 0.0085 329 MET B CA 5386 C C . MET B 308 ? 0.5478 0.4076 0.5977 -0.0119 -0.0530 0.0183 329 MET B C 5387 O O . MET B 308 ? 0.5216 0.3889 0.5766 -0.0026 -0.0493 0.0137 329 MET B O 5388 C CB . MET B 308 ? 0.5892 0.4209 0.6296 0.0086 -0.0758 -0.0023 329 MET B CB 5389 C CG . MET B 308 ? 0.6643 0.4912 0.7034 0.0128 -0.0806 -0.0094 329 MET B CG 5390 S SD . MET B 308 ? 1.2214 0.9970 1.2290 0.0194 -0.1086 -0.0135 329 MET B SD 5391 C CE . MET B 308 ? 1.5785 1.3256 1.5620 -0.0087 -0.1144 0.0071 329 MET B CE 5392 N N . GLU B 309 ? 0.5335 0.3855 0.5720 -0.0297 -0.0550 0.0311 330 GLU B N 5393 C CA . GLU B 309 ? 0.5510 0.3943 0.5779 -0.0402 -0.0551 0.0401 330 GLU B CA 5394 C C . GLU B 309 ? 0.5276 0.4090 0.5699 -0.0425 -0.0348 0.0458 330 GLU B C 5395 O O . GLU B 309 ? 0.5570 0.4342 0.5903 -0.0505 -0.0328 0.0526 330 GLU B O 5396 C CB . GLU B 309 ? 0.5382 0.3439 0.5490 -0.0302 -0.0708 0.0344 330 GLU B CB 5397 C CG . GLU B 309 ? 0.6972 0.4569 0.6813 -0.0281 -0.0947 0.0296 330 GLU B CG 5398 C CD . GLU B 309 ? 0.9409 0.6652 0.9080 -0.0123 -0.1134 0.0205 330 GLU B CD 5399 O OE1 . GLU B 309 ? 1.0513 0.7798 1.0222 -0.0103 -0.1090 0.0221 330 GLU B OE1 5400 O OE2 . GLU B 309 ? 1.0032 0.6955 0.9513 -0.0008 -0.1336 0.0110 330 GLU B OE2 5401 N N . GLU B 310 ? 0.5099 0.4242 0.5706 -0.0348 -0.0207 0.0421 331 GLU B N 5402 C CA . GLU B 310 ? 0.4434 0.3903 0.5119 -0.0340 -0.0041 0.0460 331 GLU B CA 5403 C C . GLU B 310 ? 0.4706 0.4310 0.5370 -0.0421 -0.0041 0.0507 331 GLU B C 5404 O O . GLU B 310 ? 0.5168 0.4649 0.5764 -0.0508 -0.0146 0.0520 331 GLU B O 5405 C CB . GLU B 310 ? 0.3859 0.3546 0.4647 -0.0224 0.0078 0.0389 331 GLU B CB 5406 C CG . GLU B 310 ? 0.5195 0.4816 0.6000 -0.0144 0.0091 0.0312 331 GLU B CG 5407 C CD . GLU B 310 ? 0.5697 0.5331 0.6455 -0.0136 0.0140 0.0353 331 GLU B CD 5408 O OE1 . GLU B 310 ? 0.5567 0.5364 0.6293 -0.0125 0.0241 0.0393 331 GLU B OE1 5409 O OE2 . GLU B 310 ? 0.4995 0.4437 0.5726 -0.0105 0.0049 0.0321 331 GLU B OE2 5410 N N . SER B 311 ? 0.4244 0.4073 0.4932 -0.0377 0.0058 0.0517 332 SER B N 5411 C CA . SER B 311 ? 0.5240 0.5216 0.5909 -0.0404 0.0046 0.0526 332 SER B CA 5412 C C . SER B 311 ? 0.6111 0.6240 0.6855 -0.0293 0.0091 0.0484 332 SER B C 5413 O O . SER B 311 ? 0.6112 0.6243 0.6898 -0.0219 0.0165 0.0458 332 SER B O 5414 C CB . SER B 311 ? 0.6028 0.6060 0.6634 -0.0430 0.0085 0.0550 332 SER B CB 5415 O OG . SER B 311 ? 0.6607 0.6757 0.7265 -0.0310 0.0176 0.0536 332 SER B OG 5416 N N . VAL B 312 ? 0.5991 0.6206 0.6768 -0.0384 0.0083 0.0520 333 VAL B N 5417 C CA . VAL B 312 ? 0.5421 0.5768 0.6320 -0.0389 0.0150 0.0527 333 VAL B CA 5418 C C . VAL B 312 ? 0.5082 0.5658 0.6061 -0.0485 0.0215 0.0579 333 VAL B C 5419 O O . VAL B 312 ? 0.4791 0.5405 0.5735 -0.0603 0.0167 0.0599 333 VAL B O 5420 C CB . VAL B 312 ? 0.5309 0.5593 0.6214 -0.0399 0.0056 0.0492 333 VAL B CB 5421 C CG1 . VAL B 312 ? 0.3968 0.4418 0.5005 -0.0418 0.0105 0.0488 333 VAL B CG1 5422 C CG2 . VAL B 312 ? 0.5909 0.6034 0.6767 -0.0291 0.0013 0.0424 333 VAL B CG2 5423 N N . PHE B 313 ? 0.3783 0.4525 0.4835 -0.0428 0.0322 0.0587 334 PHE B N 5424 C CA . PHE B 313 ? 0.4639 0.5674 0.5800 -0.0487 0.0395 0.0618 334 PHE B CA 5425 C C . PHE B 313 ? 0.4060 0.5325 0.5344 -0.0419 0.0431 0.0576 334 PHE B C 5426 O O . PHE B 313 ? 0.3938 0.5095 0.5136 -0.0292 0.0446 0.0538 334 PHE B O 5427 C CB . PHE B 313 ? 0.4837 0.5875 0.5922 -0.0441 0.0476 0.0655 334 PHE B CB 5428 C CG . PHE B 313 ? 0.4602 0.5971 0.5793 -0.0450 0.0569 0.0672 334 PHE B CG 5429 C CD1 . PHE B 313 ? 0.5002 0.6603 0.6305 -0.0602 0.0581 0.0676 334 PHE B CD1 5430 C CD2 . PHE B 313 ? 0.4525 0.5966 0.5663 -0.0300 0.0635 0.0665 334 PHE B CD2 5431 C CE1 . PHE B 313 ? 0.4844 0.6824 0.6283 -0.0601 0.0675 0.0666 334 PHE B CE1 5432 C CE2 . PHE B 313 ? 0.5327 0.7087 0.6549 -0.0269 0.0710 0.0663 334 PHE B CE2 5433 C CZ . PHE B 313 ? 0.4935 0.7006 0.6347 -0.0416 0.0739 0.0658 334 PHE B CZ 5434 N N . TRP B 314 ? 0.4373 0.5957 0.5841 -0.0502 0.0431 0.0563 335 TRP B N 5435 C CA . TRP B 314 ? 0.4336 0.6212 0.5956 -0.0408 0.0441 0.0496 335 TRP B CA 5436 C C . TRP B 314 ? 0.4593 0.6911 0.6393 -0.0430 0.0509 0.0484 335 TRP B C 5437 O O . TRP B 314 ? 0.4571 0.7046 0.6463 -0.0605 0.0514 0.0506 335 TRP B O 5438 C CB . TRP B 314 ? 0.2931 0.4832 0.4667 -0.0469 0.0332 0.0451 335 TRP B CB 5439 C CG . TRP B 314 ? 0.3030 0.4613 0.4639 -0.0382 0.0269 0.0414 335 TRP B CG 5440 C CD1 . TRP B 314 ? 0.3341 0.4775 0.4800 -0.0221 0.0301 0.0366 335 TRP B CD1 5441 C CD2 . TRP B 314 ? 0.4120 0.5463 0.5686 -0.0450 0.0161 0.0406 335 TRP B CD2 5442 N NE1 . TRP B 314 ? 0.3862 0.5012 0.5225 -0.0205 0.0232 0.0321 335 TRP B NE1 5443 C CE2 . TRP B 314 ? 0.4246 0.5340 0.5687 -0.0332 0.0143 0.0347 335 TRP B CE2 5444 C CE3 . TRP B 314 ? 0.4500 0.5778 0.6055 -0.0594 0.0074 0.0440 335 TRP B CE3 5445 C CZ2 . TRP B 314 ? 0.4990 0.5802 0.6345 -0.0347 0.0050 0.0320 335 TRP B CZ2 5446 C CZ3 . TRP B 314 ? 0.5252 0.6221 0.6682 -0.0583 -0.0028 0.0425 335 TRP B CZ3 5447 C CH2 . TRP B 314 ? 0.5244 0.5997 0.6598 -0.0456 -0.0037 0.0365 335 TRP B CH2 5448 N N . GLU B 315 ? 0.3831 0.6328 0.5636 -0.0245 0.0551 0.0433 336 GLU B N 5449 C CA . GLU B 315 ? 0.4223 0.7212 0.6242 -0.0214 0.0592 0.0379 336 GLU B CA 5450 C C . GLU B 315 ? 0.4446 0.7609 0.6534 -0.0008 0.0508 0.0259 336 GLU B C 5451 O O . GLU B 315 ? 0.4513 0.7359 0.6328 0.0173 0.0473 0.0231 336 GLU B O 5452 C CB . GLU B 315 ? 0.4326 0.7335 0.6213 -0.0147 0.0702 0.0421 336 GLU B CB 5453 C CG . GLU B 315 ? 0.4977 0.8538 0.7115 -0.0148 0.0759 0.0358 336 GLU B CG 5454 C CD . GLU B 315 ? 0.6056 0.9612 0.8035 -0.0059 0.0860 0.0396 336 GLU B CD 5455 O OE1 . GLU B 315 ? 0.6944 1.0040 0.8612 -0.0023 0.0875 0.0487 336 GLU B OE1 5456 O OE2 . GLU B 315 ? 0.5778 0.9800 0.7949 -0.0025 0.0914 0.0326 336 GLU B OE2 5457 N N . CYS B 316 ? 0.3968 0.7586 0.6369 -0.0044 0.0453 0.0179 337 CYS B N 5458 C CA . CYS B 316 ? 0.4650 0.8440 0.7099 0.0183 0.0344 0.0046 337 CYS B CA 5459 C C . CYS B 316 ? 0.4703 0.9023 0.7341 0.0291 0.0389 -0.0037 337 CYS B C 5460 O O . CYS B 316 ? 0.4708 0.9409 0.7582 0.0112 0.0489 -0.0014 337 CYS B O 5461 C CB . CYS B 316 ? 0.5152 0.9018 0.7788 0.0099 0.0203 -0.0004 337 CYS B CB 5462 S SG . CYS B 316 ? 0.7600 1.1920 1.0595 -0.0234 0.0222 0.0022 337 CYS B SG 5463 N N . LYS B 317 ? 0.4323 0.8609 0.6787 0.0580 0.0308 -0.0146 338 LYS B N 5464 C CA . LYS B 317 ? 0.3587 0.8348 0.6184 0.0737 0.0328 -0.0251 338 LYS B CA 5465 C C . LYS B 317 ? 0.4830 0.9726 0.7437 0.0970 0.0143 -0.0425 338 LYS B C 5466 O O . LYS B 317 ? 0.5713 1.0077 0.7920 0.1115 0.0018 -0.0460 338 LYS B O 5467 C CB . LYS B 317 ? 0.3116 0.7573 0.5305 0.0888 0.0409 -0.0202 338 LYS B CB 5468 C CG . LYS B 317 ? 0.4520 0.8728 0.6609 0.0682 0.0568 -0.0027 338 LYS B CG 5469 C CD . LYS B 317 ? 0.5127 0.9086 0.6827 0.0828 0.0627 0.0022 338 LYS B CD 5470 C CE . LYS B 317 ? 0.5828 0.9236 0.7213 0.0707 0.0692 0.0188 338 LYS B CE 5471 N NZ . LYS B 317 ? 0.6706 0.9768 0.7633 0.0861 0.0684 0.0243 338 LYS B NZ 5472 N N . ALA B 318 ? 0.4778 1.0369 0.7812 0.0986 0.0124 -0.0546 339 ALA B N 5473 C CA . ALA B 318 ? 0.4945 1.0716 0.7998 0.1233 -0.0061 -0.0736 339 ALA B CA 5474 C C . ALA B 318 ? 0.5954 1.2321 0.9195 0.1407 -0.0024 -0.0871 339 ALA B C 5475 O O . ALA B 318 ? 0.5948 1.2807 0.9515 0.1241 0.0147 -0.0835 339 ALA B O 5476 C CB . ALA B 318 ? 0.3878 0.9966 0.7323 0.1075 -0.0170 -0.0782 339 ALA B CB 5477 N N . ASN B 319 ? 0.7199 1.3472 1.0172 0.1729 -0.0185 -0.1039 340 ASN B N 5478 C CA . ASN B 319 ? 0.7711 1.4640 1.0922 0.1922 -0.0188 -0.1213 340 ASN B CA 5479 C C . ASN B 319 ? 0.6608 1.4054 1.0174 0.2035 -0.0370 -0.1426 340 ASN B C 5480 O O . ASN B 319 ? 0.6086 1.3330 0.9685 0.1948 -0.0492 -0.1418 340 ASN B O 5481 C CB . ASN B 319 ? 0.8955 1.5431 1.1537 0.2212 -0.0225 -0.1253 340 ASN B CB 5482 C CG . ASN B 319 ? 0.9774 1.5272 1.1576 0.2318 -0.0378 -0.1234 340 ASN B CG 5483 O OD1 . ASN B 319 ? 1.0053 1.5324 1.1768 0.2347 -0.0536 -0.1323 340 ASN B OD1 5484 N ND2 . ASN B 319 ? 1.0088 1.4985 1.1275 0.2342 -0.0329 -0.1120 340 ASN B ND2 5485 N N . GLY B 320 ? 0.6496 1.4617 1.0328 0.2228 -0.0389 -0.1619 341 GLY B N 5486 C CA . GLY B 320 ? 0.6447 1.5211 1.0695 0.2342 -0.0553 -0.1848 341 GLY B CA 5487 C C . GLY B 320 ? 0.6557 1.6400 1.1435 0.2302 -0.0420 -0.1982 341 GLY B C 5488 O O . GLY B 320 ? 0.6883 1.6913 1.1878 0.2116 -0.0186 -0.1868 341 GLY B O 5489 N N . ARG B 321 ? 0.6313 1.6863 1.1582 0.2462 -0.0562 -0.2233 342 ARG B N 5490 C CA . ARG B 321 ? 0.6065 1.7748 1.1982 0.2403 -0.0433 -0.2400 342 ARG B CA 5491 C C . ARG B 321 ? 0.5988 1.8497 1.2555 0.2208 -0.0510 -0.2537 342 ARG B C 5492 O O . ARG B 321 ? 0.5832 1.8369 1.2398 0.2445 -0.0761 -0.2706 342 ARG B O 5493 C CB . ARG B 321 ? 0.6257 1.8140 1.1997 0.2856 -0.0519 -0.2634 342 ARG B CB 5494 C CG . ARG B 321 ? 0.6569 1.9600 1.2940 0.2799 -0.0344 -0.2806 342 ARG B CG 5495 C CD . ARG B 321 ? 0.7833 2.1014 1.3978 0.3276 -0.0444 -0.3043 342 ARG B CD 5496 N NE . ARG B 321 ? 0.8388 2.0782 1.3860 0.3392 -0.0354 -0.2880 342 ARG B NE 5497 C CZ . ARG B 321 ? 0.9057 2.1508 1.4253 0.3726 -0.0383 -0.3023 342 ARG B CZ 5498 N NH1 . ARG B 321 ? 0.9233 2.2522 1.4796 0.4002 -0.0494 -0.3351 342 ARG B NH1 5499 N NH2 . ARG B 321 ? 0.9371 2.1045 1.3908 0.3777 -0.0311 -0.2840 342 ARG B NH2 5500 N N . PRO B 322 ? 0.5908 1.9045 1.2968 0.1748 -0.0297 -0.2469 343 PRO B N 5501 C CA . PRO B 322 ? 0.5828 1.8962 1.2872 0.1446 0.0004 -0.2303 343 PRO B CA 5502 C C . PRO B 322 ? 0.6024 1.8083 1.2524 0.1308 0.0062 -0.1995 343 PRO B C 5503 O O . PRO B 322 ? 0.6588 1.8000 1.2808 0.1356 -0.0106 -0.1904 343 PRO B O 5504 C CB . PRO B 322 ? 0.5352 1.9279 1.2939 0.0934 0.0144 -0.2330 343 PRO B CB 5505 C CG . PRO B 322 ? 0.5274 1.9853 1.3270 0.1038 -0.0073 -0.2561 343 PRO B CG 5506 C CD . PRO B 322 ? 0.5518 1.9316 1.3093 0.1443 -0.0352 -0.2546 343 PRO B CD 5507 N N . LYS B 323 ? 0.5749 1.7620 1.2094 0.1132 0.0299 -0.1847 344 LYS B N 5508 C CA . LYS B 323 ? 0.5190 1.6104 1.1047 0.0994 0.0364 -0.1569 344 LYS B CA 5509 C C . LYS B 323 ? 0.4693 1.5425 1.0632 0.0574 0.0362 -0.1424 344 LYS B C 5510 O O . LYS B 323 ? 0.4861 1.6065 1.1091 0.0179 0.0488 -0.1425 344 LYS B O 5511 C CB . LYS B 323 ? 0.5495 1.6278 1.1176 0.0878 0.0609 -0.1453 344 LYS B CB 5512 C CG . LYS B 323 ? 0.6557 1.6364 1.1717 0.0790 0.0662 -0.1187 344 LYS B CG 5513 C CD . LYS B 323 ? 0.7304 1.6897 1.2199 0.0796 0.0850 -0.1093 344 LYS B CD 5514 C CE . LYS B 323 ? 0.7732 1.6359 1.2095 0.0759 0.0870 -0.0848 344 LYS B CE 5515 N NZ . LYS B 323 ? 0.7716 1.6057 1.1759 0.0798 0.1017 -0.0750 344 LYS B NZ 5516 N N . PRO B 324 ? 0.4332 1.4315 0.9937 0.0649 0.0213 -0.1305 345 PRO B N 5517 C CA . PRO B 324 ? 0.4203 1.3875 0.9789 0.0325 0.0160 -0.1172 345 PRO B CA 5518 C C . PRO B 324 ? 0.4194 1.3636 0.9674 -0.0112 0.0355 -0.0983 345 PRO B C 5519 O O . PRO B 324 ? 0.4716 1.3839 0.9952 -0.0107 0.0501 -0.0877 345 PRO B O 5520 C CB . PRO B 324 ? 0.4207 1.2997 0.9327 0.0569 0.0009 -0.1080 345 PRO B CB 5521 C CG . PRO B 324 ? 0.4754 1.3539 0.9711 0.1029 -0.0100 -0.1239 345 PRO B CG 5522 C CD . PRO B 324 ? 0.4638 1.3981 0.9782 0.1075 0.0068 -0.1315 345 PRO B CD 5523 N N . THR B 325 ? 0.3885 1.3407 0.9466 -0.0484 0.0337 -0.0941 346 THR B N 5524 C CA . THR B 325 ? 0.4692 1.3756 0.9996 -0.0884 0.0460 -0.0757 346 THR B CA 5525 C C . THR B 325 ? 0.5104 1.3386 1.0081 -0.0918 0.0329 -0.0605 346 THR B C 5526 O O . THR B 325 ? 0.5191 1.3414 1.0223 -0.0730 0.0154 -0.0657 346 THR B O 5527 C CB . THR B 325 ? 0.4786 1.4346 1.0258 -0.1314 0.0535 -0.0813 346 THR B CB 5528 O OG1 . THR B 325 ? 0.4880 1.4620 1.0500 -0.1401 0.0372 -0.0871 346 THR B OG1 5529 C CG2 . THR B 325 ? 0.4068 1.4498 0.9911 -0.1294 0.0671 -0.0999 346 THR B CG2 5530 N N . TYR B 326 ? 0.5058 1.2715 0.9666 -0.1145 0.0403 -0.0428 347 TYR B N 5531 C CA . TYR B 326 ? 0.4943 1.1837 0.9221 -0.1137 0.0294 -0.0292 347 TYR B CA 5532 C C . TYR B 326 ? 0.5082 1.1597 0.9084 -0.1501 0.0271 -0.0187 347 TYR B C 5533 O O . TYR B 326 ? 0.5832 1.2400 0.9709 -0.1777 0.0372 -0.0165 347 TYR B O 5534 C CB . TYR B 326 ? 0.4993 1.1311 0.8968 -0.0973 0.0363 -0.0176 347 TYR B CB 5535 C CG . TYR B 326 ? 0.5056 1.1581 0.9122 -0.0620 0.0402 -0.0254 347 TYR B CG 5536 C CD1 . TYR B 326 ? 0.5126 1.1940 0.9243 -0.0613 0.0560 -0.0273 347 TYR B CD1 5537 C CD2 . TYR B 326 ? 0.4685 1.1015 0.8681 -0.0290 0.0271 -0.0308 347 TYR B CD2 5538 C CE1 . TYR B 326 ? 0.4847 1.1765 0.8949 -0.0273 0.0585 -0.0339 347 TYR B CE1 5539 C CE2 . TYR B 326 ? 0.4623 1.1004 0.8545 0.0045 0.0285 -0.0381 347 TYR B CE2 5540 C CZ . TYR B 326 ? 0.4790 1.1468 0.8765 0.0058 0.0441 -0.0393 347 TYR B CZ 5541 O OH . TYR B 326 ? 0.4640 1.1294 0.8452 0.0394 0.0446 -0.0459 347 TYR B OH 5542 N N . ARG B 327 ? 0.5025 1.1083 0.8853 -0.1483 0.0130 -0.0128 348 ARG B N 5543 C CA . ARG B 327 ? 0.5784 1.1286 0.9207 -0.1746 0.0090 -0.0007 348 ARG B CA 5544 C C . ARG B 327 ? 0.6340 1.1124 0.9483 -0.1588 -0.0005 0.0092 348 ARG B C 5545 O O . ARG B 327 ? 0.6150 1.0909 0.9422 -0.1318 -0.0049 0.0054 348 ARG B O 5546 C CB . ARG B 327 ? 0.5990 1.1790 0.9471 -0.1976 0.0016 -0.0060 348 ARG B CB 5547 C CG . ARG B 327 ? 0.6066 1.2061 0.9798 -0.1815 -0.0136 -0.0137 348 ARG B CG 5548 C CD . ARG B 327 ? 0.6743 1.3174 1.0584 -0.2063 -0.0185 -0.0205 348 ARG B CD 5549 N NE . ARG B 327 ? 0.7523 1.4086 1.1564 -0.1915 -0.0349 -0.0274 348 ARG B NE 5550 C CZ . ARG B 327 ? 0.8346 1.4347 1.2084 -0.1950 -0.0468 -0.0179 348 ARG B CZ 5551 N NH1 . ARG B 327 ? 0.9082 1.4381 1.2309 -0.2100 -0.0445 -0.0016 348 ARG B NH1 5552 N NH2 . ARG B 327 ? 0.7590 1.3696 1.1497 -0.1809 -0.0618 -0.0250 348 ARG B NH2 5553 N N . TRP B 328 ? 0.6424 1.0604 0.9134 -0.1735 -0.0042 0.0207 349 TRP B N 5554 C CA . TRP B 328 ? 0.6107 0.9632 0.8550 -0.1584 -0.0116 0.0288 349 TRP B CA 5555 C C . TRP B 328 ? 0.6677 0.9790 0.8814 -0.1679 -0.0238 0.0350 349 TRP B C 5556 O O . TRP B 328 ? 0.7139 1.0310 0.9105 -0.1897 -0.0255 0.0370 349 TRP B O 5557 C CB . TRP B 328 ? 0.5554 0.8640 0.7706 -0.1559 -0.0049 0.0371 349 TRP B CB 5558 C CG . TRP B 328 ? 0.5023 0.8375 0.7385 -0.1437 0.0076 0.0341 349 TRP B CG 5559 C CD1 . TRP B 328 ? 0.5414 0.9202 0.7930 -0.1529 0.0190 0.0301 349 TRP B CD1 5560 C CD2 . TRP B 328 ? 0.4418 0.7585 0.6799 -0.1200 0.0105 0.0348 349 TRP B CD2 5561 N NE1 . TRP B 328 ? 0.5168 0.9031 0.7786 -0.1343 0.0286 0.0298 349 TRP B NE1 5562 C CE2 . TRP B 328 ? 0.5000 0.8480 0.7520 -0.1143 0.0235 0.0329 349 TRP B CE2 5563 C CE3 . TRP B 328 ? 0.4168 0.6922 0.6421 -0.1035 0.0042 0.0363 349 TRP B CE3 5564 C CZ2 . TRP B 328 ? 0.4643 0.8006 0.7136 -0.0923 0.0296 0.0335 349 TRP B CZ2 5565 C CZ3 . TRP B 328 ? 0.3139 0.5816 0.5390 -0.0838 0.0108 0.0356 349 TRP B CZ3 5566 C CH2 . TRP B 328 ? 0.3689 0.6652 0.6038 -0.0780 0.0230 0.0348 349 TRP B CH2 5567 N N . LEU B 329 ? 0.6600 0.9278 0.8622 -0.1506 -0.0316 0.0380 350 LEU B N 5568 C CA . LEU B 329 ? 0.6612 0.8817 0.8297 -0.1534 -0.0427 0.0454 350 LEU B CA 5569 C C . LEU B 329 ? 0.6604 0.8209 0.7988 -0.1373 -0.0450 0.0517 350 LEU B C 5570 O O . LEU B 329 ? 0.5753 0.7324 0.7270 -0.1216 -0.0402 0.0480 350 LEU B O 5571 C CB . LEU B 329 ? 0.6541 0.8858 0.8417 -0.1463 -0.0518 0.0399 350 LEU B CB 5572 C CG . LEU B 329 ? 0.6874 0.9878 0.9147 -0.1541 -0.0525 0.0292 350 LEU B CG 5573 C CD1 . LEU B 329 ? 0.6438 0.9421 0.8838 -0.1398 -0.0647 0.0231 350 LEU B CD1 5574 C CD2 . LEU B 329 ? 0.6600 0.9795 0.8741 -0.1825 -0.0515 0.0327 350 LEU B CD2 5575 N N . LYS B 330 ? 0.6707 0.7879 0.7673 -0.1392 -0.0531 0.0604 351 LYS B N 5576 C CA . LYS B 330 ? 0.6713 0.7405 0.7437 -0.1199 -0.0586 0.0641 351 LYS B CA 5577 C C . LYS B 330 ? 0.7133 0.7560 0.7631 -0.1160 -0.0699 0.0695 351 LYS B C 5578 O O . LYS B 330 ? 0.7100 0.7454 0.7295 -0.1272 -0.0764 0.0770 351 LYS B O 5579 C CB . LYS B 330 ? 0.7014 0.7472 0.7410 -0.1178 -0.0600 0.0684 351 LYS B CB 5580 C CG . LYS B 330 ? 0.6878 0.7004 0.7130 -0.0956 -0.0656 0.0680 351 LYS B CG 5581 C CD . LYS B 330 ? 0.7481 0.7427 0.7437 -0.0975 -0.0724 0.0707 351 LYS B CD 5582 C CE . LYS B 330 ? 0.7567 0.7211 0.7611 -0.1005 -0.0805 0.0684 351 LYS B CE 5583 N NZ . LYS B 330 ? 0.8254 0.7625 0.8079 -0.1144 -0.0887 0.0703 351 LYS B NZ 5584 N N . ASN B 331 ? 0.7242 0.7523 0.7842 -0.1001 -0.0721 0.0661 352 ASN B N 5585 C CA . ASN B 331 ? 0.7790 0.7837 0.8203 -0.0942 -0.0824 0.0713 352 ASN B CA 5586 C C . ASN B 331 ? 0.8265 0.8506 0.8709 -0.1128 -0.0856 0.0746 352 ASN B C 5587 O O . ASN B 331 ? 0.9279 0.9328 0.9415 -0.1152 -0.0946 0.0840 352 ASN B O 5588 C CB . ASN B 331 ? 0.7403 0.7156 0.7527 -0.0958 -0.0942 0.0768 352 ASN B CB 5589 C CG . ASN B 331 ? 0.7217 0.6814 0.7494 -0.0917 -0.0940 0.0686 352 ASN B CG 5590 O OD1 . ASN B 331 ? 0.6212 0.5856 0.6699 -0.0789 -0.0871 0.0606 352 ASN B OD1 5591 N ND2 . ASN B 331 ? 0.7380 0.6748 0.7501 -0.1027 -0.1013 0.0698 352 ASN B ND2 5592 N N . GLY B 332 ? 0.7807 0.8499 0.8628 -0.1248 -0.0791 0.0659 353 GLY B N 5593 C CA . GLY B 332 ? 0.8319 0.9345 0.9275 -0.1421 -0.0823 0.0647 353 GLY B CA 5594 C C . GLY B 332 ? 0.9030 1.0315 0.9864 -0.1663 -0.0790 0.0681 353 GLY B C 5595 O O . GLY B 332 ? 0.9032 1.0756 1.0066 -0.1833 -0.0790 0.0634 353 GLY B O 5596 N N . ASP B 333 ? 0.9409 1.0438 0.9892 -0.1673 -0.0770 0.0749 354 ASP B N 5597 C CA . ASP B 333 ? 1.0391 1.1556 1.0613 -0.1897 -0.0747 0.0780 354 ASP B CA 5598 C C . ASP B 333 ? 1.0483 1.2035 1.0974 -0.1981 -0.0628 0.0692 354 ASP B C 5599 O O . ASP B 333 ? 1.0575 1.2034 1.1190 -0.1828 -0.0583 0.0668 354 ASP B O 5600 C CB . ASP B 333 ? 1.1955 1.2595 1.1525 -0.1835 -0.0833 0.0897 354 ASP B CB 5601 C CG . ASP B 333 ? 1.3484 1.3781 1.2741 -0.1736 -0.0957 0.0997 354 ASP B CG 5602 O OD1 . ASP B 333 ? 1.4074 1.4523 1.3422 -0.1857 -0.0974 0.1013 354 ASP B OD1 5603 O OD2 . ASP B 333 ? 1.3710 1.3652 1.2785 -0.1545 -0.1011 0.0993 354 ASP B OD2 5604 N N . PRO B 334 ? 1.0431 1.2433 1.0998 -0.2227 -0.0573 0.0644 355 PRO B N 5605 C CA . PRO B 334 ? 1.0295 1.2710 1.1093 -0.2327 -0.0452 0.0560 355 PRO B CA 5606 C C . PRO B 334 ? 1.0669 1.2653 1.1110 -0.2245 -0.0434 0.0610 355 PRO B C 5607 O O . PRO B 334 ? 1.1754 1.3298 1.1612 -0.2271 -0.0509 0.0686 355 PRO B O 5608 C CB . PRO B 334 ? 1.0313 1.3079 1.0976 -0.2633 -0.0426 0.0528 355 PRO B CB 5609 C CG . PRO B 334 ? 1.0486 1.3325 1.1203 -0.2669 -0.0512 0.0545 355 PRO B CG 5610 C CD . PRO B 334 ? 1.0660 1.2832 1.1094 -0.2433 -0.0618 0.0660 355 PRO B CD 5611 N N . LEU B 335 ? 0.9675 1.1805 1.0439 -0.2128 -0.0349 0.0563 356 LEU B N 5612 C CA . LEU B 335 ? 0.9060 1.0811 0.9548 -0.2029 -0.0338 0.0598 356 LEU B CA 5613 C C . LEU B 335 ? 0.8848 1.0885 0.9375 -0.2181 -0.0227 0.0546 356 LEU B C 5614 O O . LEU B 335 ? 0.8521 1.1054 0.9522 -0.2186 -0.0113 0.0479 356 LEU B O 5615 C CB . LEU B 335 ? 0.8477 1.0092 0.9219 -0.1776 -0.0322 0.0595 356 LEU B CB 5616 C CG . LEU B 335 ? 0.8298 0.9573 0.8826 -0.1653 -0.0316 0.0619 356 LEU B CG 5617 C CD1 . LEU B 335 ? 0.9100 0.9871 0.9092 -0.1582 -0.0458 0.0676 356 LEU B CD1 5618 C CD2 . LEU B 335 ? 0.6959 0.8227 0.7792 -0.1447 -0.0265 0.0599 356 LEU B CD2 5619 N N . LEU B 336 ? 0.9138 1.0863 0.9128 -0.2280 -0.0269 0.0570 357 LEU B N 5620 C CA . LEU B 336 ? 0.9310 1.1219 0.9239 -0.2433 -0.0173 0.0512 357 LEU B CA 5621 C C . LEU B 336 ? 0.9177 1.0605 0.8717 -0.2302 -0.0224 0.0535 357 LEU B C 5622 O O . LEU B 336 ? 0.9393 1.0376 0.8627 -0.2122 -0.0352 0.0588 357 LEU B O 5623 C CB . LEU B 336 ? 0.9441 1.1511 0.9044 -0.2728 -0.0171 0.0472 357 LEU B CB 5624 C CG . LEU B 336 ? 0.8423 1.1216 0.8534 -0.2919 -0.0072 0.0390 357 LEU B CG 5625 C CD1 . LEU B 336 ? 0.8056 1.0981 0.7766 -0.3237 -0.0060 0.0338 357 LEU B CD1 5626 C CD2 . LEU B 336 ? 0.7969 1.1308 0.8685 -0.2878 0.0079 0.0311 357 LEU B CD2 5627 N N . THR B 337 ? 0.8888 1.0448 0.8457 -0.2383 -0.0130 0.0485 358 THR B N 5628 C CA . THR B 337 ? 0.9689 1.0833 0.8911 -0.2260 -0.0185 0.0488 358 THR B CA 5629 C C . THR B 337 ? 1.0923 1.1596 0.9452 -0.2218 -0.0366 0.0506 358 THR B C 5630 O O . THR B 337 ? 1.1442 1.2109 0.9589 -0.2393 -0.0409 0.0499 358 THR B O 5631 C CB . THR B 337 ? 0.9617 1.0927 0.8809 -0.2413 -0.0077 0.0418 358 THR B CB 5632 O OG1 . THR B 337 ? 0.9080 1.0878 0.8900 -0.2411 0.0090 0.0408 358 THR B OG1 5633 C CG2 . THR B 337 ? 0.9279 1.0154 0.8113 -0.2268 -0.0154 0.0410 358 THR B CG2 5634 N N . ARG B 338 ? 1.1347 1.1675 0.9707 -0.1978 -0.0471 0.0524 359 ARG B N 5635 C CA . ARG B 338 ? 1.2224 1.2146 1.0211 -0.2131 -0.0585 0.0574 359 ARG B CA 5636 C C . ARG B 338 ? 1.2190 1.1823 1.0188 -0.2066 -0.0644 0.0604 359 ARG B C 5637 O O . ARG B 338 ? 1.1348 1.1119 0.9629 -0.1918 -0.0556 0.0562 359 ARG B O 5638 C CB . ARG B 338 ? 1.2328 1.2117 1.0254 -0.2166 -0.0674 0.0642 359 ARG B CB 5639 C CG . ARG B 338 ? 1.2541 1.2209 1.0675 -0.1962 -0.0758 0.0697 359 ARG B CG 5640 C CD . ARG B 338 ? 1.3295 1.3298 1.1861 -0.1696 -0.0664 0.0664 359 ARG B CD 5641 N NE . ARG B 338 ? 1.3871 1.3716 1.2620 -0.1610 -0.0744 0.0722 359 ARG B NE 5642 C CZ . ARG B 338 ? 1.4468 1.4232 1.3160 -0.1645 -0.0821 0.0771 359 ARG B CZ 5643 N NH1 . ARG B 338 ? 1.4689 1.4531 1.3196 -0.1764 -0.0806 0.0771 359 ARG B NH1 5644 N NH2 . ARG B 338 ? 1.4263 1.3854 1.3186 -0.1568 -0.0873 0.0787 359 ARG B NH2 5645 N N . ASP B 339 ? 1.2899 1.2061 1.0669 -0.2235 -0.0774 0.0684 360 ASP B N 5646 C CA . ASP B 339 ? 1.3374 1.2140 1.1195 -0.2244 -0.0820 0.0718 360 ASP B CA 5647 C C . ASP B 339 ? 1.1872 1.0821 1.0242 -0.1961 -0.0751 0.0708 360 ASP B C 5648 O O . ASP B 339 ? 1.1132 1.0134 0.9708 -0.1838 -0.0780 0.0720 360 ASP B O 5649 C CB . ASP B 339 ? 1.4824 1.2931 1.2212 -0.2433 -0.1016 0.0786 360 ASP B CB 5650 C CG . ASP B 339 ? 1.5515 1.3088 1.2761 -0.2467 -0.1094 0.0806 360 ASP B CG 5651 O OD1 . ASP B 339 ? 1.4749 1.2483 1.2180 -0.2412 -0.0980 0.0781 360 ASP B OD1 5652 O OD2 . ASP B 339 ? 1.6268 1.3210 1.3179 -0.2531 -0.1284 0.0841 360 ASP B OD2 5653 N N . ARG B 340 ? 1.1097 1.0120 0.9660 -0.1874 -0.0658 0.0684 361 ARG B N 5654 C CA . ARG B 340 ? 1.0860 1.0046 0.9873 -0.1627 -0.0578 0.0673 361 ARG B CA 5655 C C . ARG B 340 ? 1.0682 1.0366 1.0014 -0.1411 -0.0463 0.0618 361 ARG B C 5656 O O . ARG B 340 ? 1.0942 1.0783 1.0556 -0.1231 -0.0372 0.0596 361 ARG B O 5657 C CB . ARG B 340 ? 1.0025 0.8902 0.9110 -0.1569 -0.0677 0.0704 361 ARG B CB 5658 C CG . ARG B 340 ? 0.9741 0.8009 0.8514 -0.1685 -0.0818 0.0736 361 ARG B CG 5659 C CD . ARG B 340 ? 0.9965 0.7897 0.8747 -0.1589 -0.0949 0.0730 361 ARG B CD 5660 N NE . ARG B 340 ? 0.9873 0.7966 0.8692 -0.1592 -0.0975 0.0730 361 ARG B NE 5661 C CZ . ARG B 340 ? 0.8909 0.7322 0.8095 -0.1418 -0.0895 0.0700 361 ARG B CZ 5662 N NH1 . ARG B 340 ? 0.6842 0.5455 0.6369 -0.1234 -0.0781 0.0664 361 ARG B NH1 5663 N NH2 . ARG B 340 ? 0.9378 0.7876 0.8549 -0.1439 -0.0935 0.0709 361 ARG B NH2 5664 N N . ILE B 341 ? 1.0508 1.0376 0.9734 -0.1423 -0.0480 0.0599 362 ILE B N 5665 C CA . ILE B 341 ? 0.9837 1.0042 0.9332 -0.1278 -0.0387 0.0567 362 ILE B CA 5666 C C . ILE B 341 ? 0.9620 1.0075 0.9174 -0.1497 -0.0271 0.0554 362 ILE B C 5667 O O . ILE B 341 ? 1.0052 1.0526 0.9317 -0.1671 -0.0305 0.0538 362 ILE B O 5668 C CB . ILE B 341 ? 0.9222 0.9458 0.8779 -0.1281 -0.0429 0.0599 362 ILE B CB 5669 C CG1 . ILE B 341 ? 0.9518 0.9535 0.9144 -0.1153 -0.0506 0.0618 362 ILE B CG1 5670 C CG2 . ILE B 341 ? 0.8094 0.8678 0.8116 -0.1361 -0.0289 0.0610 362 ILE B CG2 5671 C CD1 . ILE B 341 ? 1.0228 1.0280 0.9954 -0.1080 -0.0536 0.0632 362 ILE B CD1 5672 N N . GLN B 342 ? 0.9171 0.9841 0.9079 -0.1486 -0.0128 0.0559 363 GLN B N 5673 C CA . GLN B 342 ? 0.9066 1.0055 0.9099 -0.1669 0.0000 0.0539 363 GLN B CA 5674 C C . GLN B 342 ? 0.7985 0.9456 0.8511 -0.1698 0.0129 0.0550 363 GLN B C 5675 O O . GLN B 342 ? 0.7295 0.8880 0.8118 -0.1543 0.0202 0.0574 363 GLN B O 5676 C CB . GLN B 342 ? 1.0063 1.0979 1.0082 -0.1616 0.0062 0.0530 363 GLN B CB 5677 C CG . GLN B 342 ? 1.1499 1.2800 1.1731 -0.1764 0.0222 0.0513 363 GLN B CG 5678 C CD . GLN B 342 ? 1.2651 1.3900 1.2960 -0.1654 0.0302 0.0530 363 GLN B CD 5679 O OE1 . GLN B 342 ? 1.3024 1.4572 1.3504 -0.1728 0.0437 0.0521 363 GLN B OE1 5680 N NE2 . GLN B 342 ? 1.2782 1.3680 1.2967 -0.1471 0.0220 0.0548 363 GLN B NE2 5681 N N . ILE B 343 ? 0.7932 0.9711 0.8515 -0.1886 0.0146 0.0517 364 ILE B N 5682 C CA . ILE B 343 ? 0.7242 0.9595 0.8317 -0.1906 0.0249 0.0489 364 ILE B CA 5683 C C . ILE B 343 ? 0.8126 1.0959 0.9388 -0.2052 0.0391 0.0429 364 ILE B C 5684 O O . ILE B 343 ? 0.8714 1.1653 0.9793 -0.2285 0.0395 0.0377 364 ILE B O 5685 C CB . ILE B 343 ? 0.7119 0.9611 0.8209 -0.2019 0.0173 0.0467 364 ILE B CB 5686 C CG1 . ILE B 343 ? 0.7247 0.9298 0.8177 -0.1861 0.0039 0.0522 364 ILE B CG1 5687 C CG2 . ILE B 343 ? 0.6937 1.0128 0.8563 -0.2036 0.0261 0.0397 364 ILE B CG2 5688 C CD1 . ILE B 343 ? 0.7128 0.9080 0.8271 -0.1619 0.0066 0.0543 364 ILE B CD1 5689 N N . GLU B 344 ? 0.7696 1.0817 0.9278 -0.1910 0.0510 0.0426 365 GLU B N 5690 C CA . GLU B 344 ? 0.7323 1.0982 0.9137 -0.2007 0.0654 0.0356 365 GLU B CA 5691 C C . GLU B 344 ? 0.6976 1.1246 0.9294 -0.1821 0.0734 0.0303 365 GLU B C 5692 O O . GLU B 344 ? 0.6954 1.1180 0.9349 -0.1587 0.0783 0.0336 365 GLU B O 5693 C CB . GLU B 344 ? 0.8099 1.1490 0.9692 -0.1998 0.0719 0.0388 365 GLU B CB 5694 C CG . GLU B 344 ? 0.9858 1.3536 1.1396 -0.2246 0.0808 0.0304 365 GLU B CG 5695 C CD . GLU B 344 ? 1.0582 1.4543 1.2310 -0.2164 0.0961 0.0290 365 GLU B CD 5696 O OE1 . GLU B 344 ? 1.1359 1.4988 1.3008 -0.1961 0.0965 0.0372 365 GLU B OE1 5697 O OE2 . GLU B 344 ? 1.0197 1.4728 1.2144 -0.2301 0.1077 0.0189 365 GLU B OE2 5698 N N . GLN B 345 ? 0.6705 1.1531 0.9322 -0.1910 0.0728 0.0204 366 GLN B N 5699 C CA . GLN B 345 ? 0.5826 1.1291 0.8917 -0.1698 0.0761 0.0107 366 GLN B CA 5700 C C . GLN B 345 ? 0.5919 1.1110 0.9029 -0.1420 0.0666 0.0146 366 GLN B C 5701 O O . GLN B 345 ? 0.7022 1.1882 1.0008 -0.1459 0.0545 0.0185 366 GLN B O 5702 C CB . GLN B 345 ? 0.5436 1.1293 0.8694 -0.1588 0.0912 0.0054 366 GLN B CB 5703 C CG . GLN B 345 ? 0.6349 1.2668 0.9692 -0.1861 0.1015 -0.0041 366 GLN B CG 5704 C CD . GLN B 345 ? 0.6706 1.3400 1.0203 -0.1737 0.1166 -0.0098 366 GLN B CD 5705 O OE1 . GLN B 345 ? 0.7362 1.3619 1.0570 -0.1728 0.1227 -0.0005 366 GLN B OE1 5706 N NE2 . GLN B 345 ? 0.6254 1.3757 1.0196 -0.1621 0.1211 -0.0261 366 GLN B NE2 5707 N N . GLY B 346 ? 0.5069 1.0355 0.8273 -0.1134 0.0717 0.0129 367 GLY B N 5708 C CA . GLY B 346 ? 0.5039 1.0060 0.8199 -0.0866 0.0627 0.0138 367 GLY B CA 5709 C C . GLY B 346 ? 0.4138 0.8450 0.6930 -0.0836 0.0621 0.0268 367 GLY B C 5710 O O . GLY B 346 ? 0.4045 0.8118 0.6735 -0.0609 0.0589 0.0273 367 GLY B O 5711 N N . THR B 347 ? 0.3522 0.7482 0.6077 -0.1053 0.0635 0.0356 368 THR B N 5712 C CA . THR B 347 ? 0.4284 0.7617 0.6512 -0.1003 0.0615 0.0456 368 THR B CA 5713 C C . THR B 347 ? 0.4702 0.7601 0.6692 -0.1166 0.0501 0.0501 368 THR B C 5714 O O . THR B 347 ? 0.4059 0.7030 0.5994 -0.1376 0.0470 0.0485 368 THR B O 5715 C CB . THR B 347 ? 0.5286 0.8484 0.7349 -0.1000 0.0714 0.0511 368 THR B CB 5716 O OG1 . THR B 347 ? 0.5727 0.8857 0.7659 -0.1244 0.0713 0.0519 368 THR B OG1 5717 C CG2 . THR B 347 ? 0.4948 0.8588 0.7194 -0.0845 0.0826 0.0460 368 THR B CG2 5718 N N . LEU B 348 ? 0.4619 0.7061 0.6425 -0.1054 0.0435 0.0545 369 LEU B N 5719 C CA . LEU B 348 ? 0.5082 0.7092 0.6633 -0.1131 0.0310 0.0572 369 LEU B CA 5720 C C . LEU B 348 ? 0.4625 0.6199 0.5945 -0.1019 0.0290 0.0612 369 LEU B C 5721 O O . LEU B 348 ? 0.5574 0.7076 0.6938 -0.0857 0.0324 0.0613 369 LEU B O 5722 C CB . LEU B 348 ? 0.5256 0.7223 0.6878 -0.1083 0.0217 0.0546 369 LEU B CB 5723 C CG . LEU B 348 ? 0.6104 0.7594 0.7442 -0.1082 0.0082 0.0570 369 LEU B CG 5724 C CD1 . LEU B 348 ? 0.6997 0.8519 0.8397 -0.1101 -0.0004 0.0547 369 LEU B CD1 5725 C CD2 . LEU B 348 ? 0.6080 0.7234 0.7308 -0.0909 0.0074 0.0578 369 LEU B CD2 5726 N N . ASN B 349 ? 0.5819 0.7121 0.6874 -0.1097 0.0227 0.0624 370 ASN B N 5727 C CA . ASN B 349 ? 0.6369 0.7318 0.7236 -0.0977 0.0183 0.0634 370 ASN B CA 5728 C C . ASN B 349 ? 0.7172 0.7799 0.7770 -0.0968 0.0023 0.0610 370 ASN B C 5729 O O . ASN B 349 ? 0.7938 0.8509 0.8312 -0.1091 -0.0052 0.0596 370 ASN B O 5730 C CB . ASN B 349 ? 0.8242 0.9177 0.9014 -0.1015 0.0238 0.0642 370 ASN B CB 5731 C CG . ASN B 349 ? 1.1221 1.1852 1.1844 -0.0879 0.0190 0.0633 370 ASN B CG 5732 O OD1 . ASN B 349 ? 1.1277 1.1804 1.1949 -0.0743 0.0172 0.0628 370 ASN B OD1 5733 N ND2 . ASN B 349 ? 1.4842 1.5359 1.5286 -0.0924 0.0169 0.0614 370 ASN B ND2 5734 N N . ILE B 350 ? 0.6665 0.7107 0.7256 -0.0814 -0.0028 0.0593 371 ILE B N 5735 C CA . ILE B 350 ? 0.6658 0.6850 0.6997 -0.0755 -0.0181 0.0557 371 ILE B CA 5736 C C . ILE B 350 ? 0.6493 0.6540 0.6815 -0.0735 -0.0165 0.0560 371 ILE B C 5737 O O . ILE B 350 ? 0.5949 0.6023 0.6418 -0.0609 -0.0097 0.0548 371 ILE B O 5738 C CB . ILE B 350 ? 0.6280 0.6405 0.6677 -0.0666 -0.0237 0.0542 371 ILE B CB 5739 C CG1 . ILE B 350 ? 0.5899 0.6132 0.6342 -0.0769 -0.0244 0.0567 371 ILE B CG1 5740 C CG2 . ILE B 350 ? 0.5956 0.5771 0.6261 -0.0806 -0.0332 0.0578 371 ILE B CG2 5741 C CD1 . ILE B 350 ? 0.5352 0.5520 0.5867 -0.0677 -0.0287 0.0549 371 ILE B CD1 5742 N N . THR B 351 ? 0.6303 0.6156 0.6428 -0.0911 -0.0216 0.0594 372 THR B N 5743 C CA . THR B 351 ? 0.7342 0.7000 0.7433 -0.0948 -0.0191 0.0625 372 THR B CA 5744 C C . THR B 351 ? 0.6871 0.6251 0.6994 -0.0916 -0.0246 0.0643 372 THR B C 5745 O O . THR B 351 ? 0.6300 0.5679 0.6537 -0.0813 -0.0182 0.0639 372 THR B O 5746 C CB . THR B 351 ? 0.8524 0.7960 0.8316 -0.1164 -0.0247 0.0654 372 THR B CB 5747 O OG1 . THR B 351 ? 0.9157 0.8373 0.8713 -0.1317 -0.0374 0.0670 372 THR B OG1 5748 C CG2 . THR B 351 ? 0.8597 0.8307 0.8364 -0.1168 -0.0172 0.0608 372 THR B CG2 5749 N N . ILE B 352 ? 0.6965 0.6083 0.6953 -0.0996 -0.0378 0.0651 373 ILE B N 5750 C CA . ILE B 352 ? 0.7050 0.5829 0.7018 -0.0934 -0.0474 0.0635 373 ILE B CA 5751 C C . ILE B 352 ? 0.6521 0.5292 0.6541 -0.0892 -0.0538 0.0602 373 ILE B C 5752 O O . ILE B 352 ? 0.7512 0.6014 0.7301 -0.1004 -0.0678 0.0616 373 ILE B O 5753 C CB . ILE B 352 ? 0.7516 0.5747 0.7131 -0.1054 -0.0642 0.0661 373 ILE B CB 5754 C CG1 . ILE B 352 ? 0.7521 0.5713 0.7068 -0.1105 -0.0580 0.0699 373 ILE B CG1 5755 C CG2 . ILE B 352 ? 0.6501 0.4343 0.6063 -0.0916 -0.0787 0.0604 373 ILE B CG2 5756 C CD1 . ILE B 352 ? 0.7876 0.5483 0.7004 -0.1250 -0.0753 0.0727 373 ILE B CD1 5757 N N . VAL B 353 ? 0.5838 0.4872 0.6118 -0.0743 -0.0438 0.0555 374 VAL B N 5758 C CA . VAL B 353 ? 0.4969 0.4018 0.5312 -0.0705 -0.0480 0.0519 374 VAL B CA 5759 C C . VAL B 353 ? 0.5546 0.4143 0.5731 -0.0678 -0.0647 0.0474 374 VAL B C 5760 O O . VAL B 353 ? 0.5929 0.4313 0.6085 -0.0576 -0.0688 0.0423 374 VAL B O 5761 C CB . VAL B 353 ? 0.4443 0.3799 0.5034 -0.0558 -0.0339 0.0466 374 VAL B CB 5762 C CG1 . VAL B 353 ? 0.4521 0.3753 0.5169 -0.0441 -0.0317 0.0397 374 VAL B CG1 5763 C CG2 . VAL B 353 ? 0.5828 0.5235 0.6463 -0.0551 -0.0370 0.0443 374 VAL B CG2 5764 N N . ASN B 354 ? 0.6324 0.4764 0.6381 -0.0741 -0.0756 0.0479 375 ASN B N 5765 C CA . ASN B 354 ? 0.6421 0.4430 0.6309 -0.0664 -0.0921 0.0413 375 ASN B CA 5766 C C . ASN B 354 ? 0.6795 0.4866 0.6765 -0.0628 -0.0925 0.0379 375 ASN B C 5767 O O . ASN B 354 ? 0.5899 0.4320 0.6034 -0.0680 -0.0819 0.0415 375 ASN B O 5768 C CB . ASN B 354 ? 0.8138 0.5654 0.7612 -0.0783 -0.1122 0.0452 375 ASN B CB 5769 C CG . ASN B 354 ? 0.9495 0.7048 0.8781 -0.1006 -0.1156 0.0543 375 ASN B CG 5770 O OD1 . ASN B 354 ? 1.0192 0.7802 0.9498 -0.1024 -0.1176 0.0547 375 ASN B OD1 5771 N ND2 . ASN B 354 ? 0.9646 0.7158 0.8719 -0.1179 -0.1167 0.0609 375 ASN B ND2 5772 N N . LEU B 355 ? 0.7412 0.5134 0.7248 -0.0513 -0.1055 0.0297 376 LEU B N 5773 C CA . LEU B 355 ? 0.7028 0.4737 0.6905 -0.0467 -0.1066 0.0253 376 LEU B CA 5774 C C . LEU B 355 ? 0.6967 0.4762 0.6779 -0.0657 -0.1084 0.0358 376 LEU B C 5775 O O . LEU B 355 ? 0.7325 0.5349 0.7308 -0.0652 -0.1007 0.0351 376 LEU B O 5776 C CB . LEU B 355 ? 0.7946 0.5214 0.7596 -0.0321 -0.1239 0.0156 376 LEU B CB 5777 C CG . LEU B 355 ? 0.8870 0.6185 0.8634 -0.0077 -0.1222 0.0003 376 LEU B CG 5778 C CD1 . LEU B 355 ? 0.9765 0.6668 0.9259 0.0085 -0.1429 -0.0098 376 LEU B CD1 5779 C CD2 . LEU B 355 ? 0.9116 0.6809 0.9177 0.0017 -0.1045 -0.0092 376 LEU B CD2 5780 N N . SER B 356 ? 0.7064 0.4676 0.6601 -0.0825 -0.1190 0.0445 377 SER B N 5781 C CA . SER B 356 ? 0.7270 0.4991 0.6696 -0.1007 -0.1220 0.0535 377 SER B CA 5782 C C . SER B 356 ? 0.7440 0.5755 0.7171 -0.1024 -0.1046 0.0567 377 SER B C 5783 O O . SER B 356 ? 0.8021 0.6524 0.7745 -0.1099 -0.1048 0.0613 377 SER B O 5784 C CB . SER B 356 ? 0.7841 0.5249 0.6841 -0.1198 -0.1359 0.0608 377 SER B CB 5785 O OG . SER B 356 ? 0.8045 0.5766 0.7093 -0.1295 -0.1259 0.0655 377 SER B OG 5786 N N . ASP B 357 ? 0.5870 0.4457 0.5836 -0.0929 -0.0905 0.0539 378 ASP B N 5787 C CA . ASP B 357 ? 0.6242 0.5325 0.6442 -0.0884 -0.0752 0.0551 378 ASP B CA 5788 C C . ASP B 357 ? 0.6441 0.5688 0.6868 -0.0760 -0.0680 0.0496 378 ASP B C 5789 O O . ASP B 357 ? 0.6468 0.6029 0.7012 -0.0706 -0.0594 0.0503 378 ASP B O 5790 C CB . ASP B 357 ? 0.7638 0.6896 0.7929 -0.0835 -0.0640 0.0546 378 ASP B CB 5791 C CG . ASP B 357 ? 1.0042 0.9158 1.0083 -0.0981 -0.0702 0.0599 378 ASP B CG 5792 O OD1 . ASP B 357 ? 1.1360 1.0561 1.1230 -0.1101 -0.0737 0.0643 378 ASP B OD1 5793 O OD2 . ASP B 357 ? 1.0110 0.9010 1.0091 -0.0979 -0.0719 0.0591 378 ASP B OD2 5794 N N . ALA B 358 ? 0.5466 0.4450 0.5903 -0.0698 -0.0721 0.0428 379 ALA B N 5795 C CA . ALA B 358 ? 0.5291 0.4357 0.5874 -0.0609 -0.0664 0.0363 379 ALA B CA 5796 C C . ALA B 358 ? 0.5977 0.5119 0.6528 -0.0683 -0.0723 0.0415 379 ALA B C 5797 O O . ALA B 358 ? 0.6383 0.5334 0.6743 -0.0797 -0.0847 0.0473 379 ALA B O 5798 C CB . ALA B 358 ? 0.4384 0.3109 0.4904 -0.0523 -0.0707 0.0263 379 ALA B CB 5799 N N . GLY B 359 ? 0.6247 0.5635 0.6945 -0.0615 -0.0645 0.0394 380 GLY B N 5800 C CA . GLY B 359 ? 0.6830 0.6310 0.7509 -0.0653 -0.0698 0.0438 380 GLY B CA 5801 C C . GLY B 359 ? 0.6166 0.5911 0.6979 -0.0536 -0.0598 0.0410 380 GLY B C 5802 O O . GLY B 359 ? 0.5221 0.5051 0.6115 -0.0442 -0.0494 0.0354 380 GLY B O 5803 N N . MET B 360 ? 0.6350 0.6176 0.7138 -0.0538 -0.0632 0.0447 381 MET B N 5804 C CA . MET B 360 ? 0.5071 0.5068 0.5985 -0.0477 -0.0557 0.0407 381 MET B CA 5805 C C . MET B 360 ? 0.5345 0.5666 0.6425 -0.0649 -0.0515 0.0436 381 MET B C 5806 O O . MET B 360 ? 0.5352 0.5718 0.6339 -0.0774 -0.0562 0.0507 381 MET B O 5807 C CB . MET B 360 ? 0.6124 0.6032 0.7020 -0.0438 -0.0629 0.0395 381 MET B CB 5808 C CG . MET B 360 ? 0.5643 0.5296 0.6551 -0.0475 -0.0716 0.0321 381 MET B CG 5809 S SD . MET B 360 ? 0.5951 0.5523 0.6897 -0.0387 -0.0622 0.0180 381 MET B SD 5810 C CE . MET B 360 ? 0.5804 0.5569 0.6803 -0.0262 -0.0582 0.0139 381 MET B CE 5811 N N . TYR B 361 ? 0.5707 0.6302 0.7010 -0.0645 -0.0426 0.0379 382 TYR B N 5812 C CA . TYR B 361 ? 0.5403 0.6421 0.6901 -0.0774 -0.0372 0.0392 382 TYR B CA 5813 C C . TYR B 361 ? 0.5430 0.6853 0.7214 -0.0729 -0.0370 0.0304 382 TYR B C 5814 O O . TYR B 361 ? 0.5248 0.6575 0.7029 -0.0574 -0.0387 0.0230 382 TYR B O 5815 C CB . TYR B 361 ? 0.4535 0.5593 0.6029 -0.0762 -0.0269 0.0412 382 TYR B CB 5816 C CG . TYR B 361 ? 0.5129 0.5854 0.6341 -0.0781 -0.0301 0.0479 382 TYR B CG 5817 C CD1 . TYR B 361 ? 0.5216 0.5588 0.6245 -0.0648 -0.0353 0.0468 382 TYR B CD1 5818 C CD2 . TYR B 361 ? 0.5410 0.6206 0.6521 -0.0912 -0.0294 0.0532 382 TYR B CD2 5819 C CE1 . TYR B 361 ? 0.6063 0.6226 0.6855 -0.0617 -0.0412 0.0504 382 TYR B CE1 5820 C CE2 . TYR B 361 ? 0.5258 0.5754 0.6063 -0.0888 -0.0358 0.0571 382 TYR B CE2 5821 C CZ . TYR B 361 ? 0.5840 0.6051 0.6506 -0.0729 -0.0425 0.0555 382 TYR B CZ 5822 O OH . TYR B 361 ? 0.7159 0.7175 0.7573 -0.0702 -0.0510 0.0573 382 TYR B OH 5823 N N . GLN B 362 ? 0.5181 0.7059 0.7173 -0.0847 -0.0358 0.0299 383 GLN B N 5824 C CA . GLN B 362 ? 0.5190 0.7539 0.7474 -0.0755 -0.0376 0.0195 383 GLN B CA 5825 C C . GLN B 362 ? 0.5355 0.8267 0.7890 -0.0829 -0.0282 0.0179 383 GLN B C 5826 O O . GLN B 362 ? 0.5240 0.8262 0.7753 -0.1043 -0.0246 0.0232 383 GLN B O 5827 C CB . GLN B 362 ? 0.5068 0.7455 0.7395 -0.0788 -0.0506 0.0158 383 GLN B CB 5828 C CG . GLN B 362 ? 0.5491 0.7353 0.7591 -0.0656 -0.0592 0.0141 383 GLN B CG 5829 C CD . GLN B 362 ? 0.5774 0.7610 0.7878 -0.0692 -0.0715 0.0122 383 GLN B CD 5830 O OE1 . GLN B 362 ? 0.5613 0.7360 0.7620 -0.0861 -0.0742 0.0209 383 GLN B OE1 5831 N NE2 . GLN B 362 ? 0.5265 0.7119 0.7414 -0.0520 -0.0794 0.0011 383 GLN B NE2 5832 N N . CYS B 363 ? 0.5018 0.8233 0.7718 -0.0639 -0.0239 0.0100 384 CYS B N 5833 C CA . CYS B 363 ? 0.5305 0.9122 0.8278 -0.0663 -0.0157 0.0053 384 CYS B CA 5834 C C . CYS B 363 ? 0.5120 0.9399 0.8358 -0.0573 -0.0266 -0.0076 384 CYS B C 5835 O O . CYS B 363 ? 0.5370 0.9467 0.8533 -0.0367 -0.0382 -0.0146 384 CYS B O 5836 C CB . CYS B 363 ? 0.6133 0.9991 0.9076 -0.0476 -0.0042 0.0046 384 CYS B CB 5837 S SG . CYS B 363 ? 0.8175 1.2716 1.1402 -0.0523 0.0092 0.0001 384 CYS B SG 5838 N N . VAL B 364 ? 0.5256 1.0105 0.8764 -0.0734 -0.0231 -0.0118 385 VAL B N 5839 C CA . VAL B 364 ? 0.5226 1.0613 0.9034 -0.0659 -0.0334 -0.0259 385 VAL B CA 5840 C C . VAL B 364 ? 0.5455 1.1537 0.9574 -0.0590 -0.0233 -0.0363 385 VAL B C 5841 O O . VAL B 364 ? 0.5560 1.1872 0.9740 -0.0811 -0.0088 -0.0320 385 VAL B O 5842 C CB . VAL B 364 ? 0.6077 1.1567 0.9927 -0.0950 -0.0399 -0.0238 385 VAL B CB 5843 C CG1 . VAL B 364 ? 0.5765 1.1807 0.9932 -0.0858 -0.0526 -0.0394 385 VAL B CG1 5844 C CG2 . VAL B 364 ? 0.6839 1.1572 1.0312 -0.1023 -0.0474 -0.0115 385 VAL B CG2 5845 N N . ALA B 365 ? 0.4845 1.1193 0.9094 -0.0269 -0.0314 -0.0506 386 ALA B N 5846 C CA . ALA B 365 ? 0.3818 1.0817 0.8342 -0.0138 -0.0232 -0.0628 386 ALA B CA 5847 C C . ALA B 365 ? 0.4543 1.2174 0.9413 -0.0046 -0.0369 -0.0816 386 ALA B C 5848 O O . ALA B 365 ? 0.4297 1.1696 0.9065 0.0155 -0.0554 -0.0886 386 ALA B O 5849 C CB . ALA B 365 ? 0.2608 0.9299 0.6872 0.0212 -0.0206 -0.0646 386 ALA B CB 5850 N N . GLU B 366 ? 0.4659 1.3070 0.9912 -0.0200 -0.0275 -0.0908 387 GLU B N 5851 C CA . GLU B 366 ? 0.5622 1.4735 1.1261 -0.0177 -0.0396 -0.1095 387 GLU B CA 5852 C C . GLU B 366 ? 0.5274 1.5290 1.1319 -0.0126 -0.0288 -0.1269 387 GLU B C 5853 O O . GLU B 366 ? 0.5350 1.5493 1.1399 -0.0260 -0.0083 -0.1218 387 GLU B O 5854 C CB . GLU B 366 ? 0.6715 1.5873 1.2408 -0.0588 -0.0423 -0.1029 387 GLU B CB 5855 C CG . GLU B 366 ? 0.7382 1.6338 1.2893 -0.1002 -0.0232 -0.0866 387 GLU B CG 5856 C CD . GLU B 366 ? 0.7977 1.6785 1.3358 -0.1384 -0.0280 -0.0790 387 GLU B CD 5857 O OE1 . GLU B 366 ? 0.7246 1.5299 1.2199 -0.1547 -0.0263 -0.0607 387 GLU B OE1 5858 O OE2 . GLU B 366 ? 0.8913 1.8344 1.4588 -0.1505 -0.0337 -0.0920 387 GLU B OE2 5859 N N . ASN B 367 ? 0.5659 1.6276 1.2024 0.0079 -0.0434 -0.1486 388 ASN B N 5860 C CA . ASN B 367 ? 0.5716 1.7342 1.2554 0.0100 -0.0353 -0.1696 388 ASN B CA 5861 C C . ASN B 367 ? 0.6316 1.8567 1.3522 0.0138 -0.0544 -0.1896 388 ASN B C 5862 O O . ASN B 367 ? 0.6786 1.8631 1.3848 0.0090 -0.0714 -0.1838 388 ASN B O 5863 C CB . ASN B 367 ? 0.5319 1.6996 1.2083 0.0536 -0.0322 -0.1801 388 ASN B CB 5864 C CG . ASN B 367 ? 0.4942 1.6207 1.1440 0.1022 -0.0574 -0.1912 388 ASN B CG 5865 O OD1 . ASN B 367 ? 0.4265 1.5296 1.0707 0.1043 -0.0772 -0.1931 388 ASN B OD1 5866 N ND2 . ASN B 367 ? 0.5037 1.6119 1.1280 0.1399 -0.0569 -0.1984 388 ASN B ND2 5867 N N . LYS B 368 ? 0.6597 1.9832 1.4272 0.0230 -0.0515 -0.2138 389 LYS B N 5868 C CA . LYS B 368 ? 0.6316 2.0284 1.4405 0.0261 -0.0689 -0.2360 389 LYS B CA 5869 C C . LYS B 368 ? 0.6481 1.9893 1.4331 0.0600 -0.0991 -0.2395 389 LYS B C 5870 O O . LYS B 368 ? 0.6143 1.9731 1.4143 0.0463 -0.1139 -0.2442 389 LYS B O 5871 C CB . LYS B 368 ? 0.6049 2.1080 1.4625 0.0488 -0.0648 -0.2658 389 LYS B CB 5872 C CG . LYS B 368 ? 0.6022 2.1922 1.4991 0.0049 -0.0382 -0.2716 389 LYS B CG 5873 C CD . LYS B 368 ? 0.6136 2.3156 1.5629 0.0310 -0.0369 -0.3052 389 LYS B CD 5874 C CE . LYS B 368 ? 0.6060 2.4031 1.5964 -0.0180 -0.0115 -0.3153 389 LYS B CE 5875 N NZ . LYS B 368 ? 0.5958 2.5123 1.6435 0.0078 -0.0114 -0.3517 389 LYS B NZ 5876 N N . HIS B 369 ? 0.7110 1.9790 1.4518 0.1019 -0.1075 -0.2374 390 HIS B N 5877 C CA . HIS B 369 ? 0.7675 1.9815 1.4775 0.1388 -0.1357 -0.2470 390 HIS B CA 5878 C C . HIS B 369 ? 0.7762 1.8705 1.4264 0.1343 -0.1428 -0.2244 390 HIS B C 5879 O O . HIS B 369 ? 0.8475 1.8769 1.4568 0.1648 -0.1625 -0.2314 390 HIS B O 5880 C CB . HIS B 369 ? 0.8172 2.0257 1.5061 0.1918 -0.1443 -0.2670 390 HIS B CB 5881 C CG . HIS B 369 ? 0.8375 2.1523 1.5764 0.1992 -0.1318 -0.2866 390 HIS B CG 5882 N ND1 . HIS B 369 ? 0.8484 2.2760 1.6525 0.1924 -0.1361 -0.3098 390 HIS B ND1 5883 C CD2 . HIS B 369 ? 0.8537 2.1791 1.5857 0.2124 -0.1144 -0.2875 390 HIS B CD2 5884 C CE1 . HIS B 369 ? 0.8570 2.3627 1.6939 0.2012 -0.1210 -0.3252 390 HIS B CE1 5885 N NE2 . HIS B 369 ? 0.8645 2.3074 1.6571 0.2138 -0.1077 -0.3113 390 HIS B NE2 5886 N N . GLY B 370 ? 0.6954 1.7558 1.3357 0.0962 -0.1267 -0.1993 391 GLY B N 5887 C CA . GLY B 370 ? 0.6994 1.6533 1.2872 0.0914 -0.1326 -0.1799 391 GLY B CA 5888 C C . GLY B 370 ? 0.6775 1.5867 1.2464 0.0586 -0.1132 -0.1536 391 GLY B C 5889 O O . GLY B 370 ? 0.6433 1.5939 1.2329 0.0382 -0.0930 -0.1484 391 GLY B O 5890 N N . VAL B 371 ? 0.6351 1.4554 1.1609 0.0537 -0.1192 -0.1386 392 VAL B N 5891 C CA . VAL B 371 ? 0.5717 1.3407 1.0745 0.0254 -0.1045 -0.1151 392 VAL B CA 5892 C C . VAL B 371 ? 0.6317 1.2997 1.0790 0.0429 -0.1098 -0.1060 392 VAL B C 5893 O O . VAL B 371 ? 0.6728 1.2968 1.0970 0.0564 -0.1262 -0.1114 392 VAL B O 5894 C CB . VAL B 371 ? 0.5141 1.2884 1.0263 -0.0159 -0.1044 -0.1044 392 VAL B CB 5895 C CG1 . VAL B 371 ? 0.5037 1.2100 0.9810 -0.0394 -0.0925 -0.0818 392 VAL B CG1 5896 C CG2 . VAL B 371 ? 0.5073 1.3766 1.0663 -0.0413 -0.0955 -0.1131 392 VAL B CG2 5897 N N . ILE B 372 ? 0.6157 1.2459 1.0399 0.0407 -0.0951 -0.0931 393 ILE B N 5898 C CA . ILE B 372 ? 0.6460 1.1854 1.0179 0.0530 -0.0972 -0.0853 393 ILE B CA 5899 C C . ILE B 372 ? 0.7020 1.2030 1.0606 0.0263 -0.0844 -0.0653 393 ILE B C 5900 O O . ILE B 372 ? 0.6639 1.1981 1.0422 0.0063 -0.0696 -0.0572 393 ILE B O 5901 C CB . ILE B 372 ? 0.5474 1.0618 0.8880 0.0850 -0.0941 -0.0930 393 ILE B CB 5902 C CG1 . ILE B 372 ? 0.4668 1.0253 0.8274 0.0810 -0.0753 -0.0878 393 ILE B CG1 5903 C CG2 . ILE B 372 ? 0.5448 1.0712 0.8796 0.1152 -0.1102 -0.1149 393 ILE B CG2 5904 C CD1 . ILE B 372 ? 0.4549 0.9753 0.7737 0.1078 -0.0701 -0.0908 393 ILE B CD1 5905 N N . PHE B 373 ? 0.7212 1.1486 1.0426 0.0262 -0.0898 -0.0587 394 PHE B N 5906 C CA . PHE B 373 ? 0.5967 0.9816 0.9012 0.0050 -0.0804 -0.0421 394 PHE B CA 5907 C C . PHE B 373 ? 0.5711 0.8970 0.8363 0.0210 -0.0748 -0.0399 394 PHE B C 5908 O O . PHE B 373 ? 0.5052 0.8010 0.7428 0.0444 -0.0808 -0.0505 394 PHE B O 5909 C CB . PHE B 373 ? 0.6305 0.9797 0.9242 -0.0118 -0.0897 -0.0362 394 PHE B CB 5910 C CG . PHE B 373 ? 0.6312 1.0315 0.9555 -0.0318 -0.0950 -0.0373 394 PHE B CG 5911 C CD1 . PHE B 373 ? 0.6685 1.0714 0.9939 -0.0630 -0.0877 -0.0246 394 PHE B CD1 5912 C CD2 . PHE B 373 ? 0.6124 1.0547 0.9586 -0.0192 -0.1070 -0.0519 394 PHE B CD2 5913 C CE1 . PHE B 373 ? 0.6809 1.1270 1.0263 -0.0844 -0.0912 -0.0257 394 PHE B CE1 5914 C CE2 . PHE B 373 ? 0.6968 1.1913 1.0722 -0.0396 -0.1113 -0.0540 394 PHE B CE2 5915 C CZ . PHE B 373 ? 0.7009 1.1972 1.0747 -0.0739 -0.1026 -0.0406 394 PHE B CZ 5916 N N . SER B 374 ? 0.6522 0.9583 0.9100 0.0066 -0.0627 -0.0271 395 SER B N 5917 C CA . SER B 374 ? 0.6380 0.8897 0.8597 0.0165 -0.0564 -0.0243 395 SER B CA 5918 C C . SER B 374 ? 0.6604 0.8783 0.8735 -0.0037 -0.0519 -0.0121 395 SER B C 5919 O O . SER B 374 ? 0.7277 0.9664 0.9583 -0.0245 -0.0479 -0.0036 395 SER B O 5920 C CB . SER B 374 ? 0.6592 0.9305 0.8801 0.0277 -0.0438 -0.0240 395 SER B CB 5921 O OG . SER B 374 ? 0.7634 1.0604 1.0055 0.0081 -0.0311 -0.0127 395 SER B OG 5922 N N . SER B 375 ? 0.6109 0.7723 0.7909 0.0021 -0.0522 -0.0127 396 SER B N 5923 C CA . SER B 375 ? 0.5972 0.7235 0.7663 -0.0128 -0.0498 -0.0038 396 SER B CA 5924 C C . SER B 375 ? 0.5377 0.6358 0.6867 -0.0085 -0.0395 -0.0022 396 SER B C 5925 O O . SER B 375 ? 0.5294 0.6171 0.6602 0.0061 -0.0356 -0.0088 396 SER B O 5926 C CB . SER B 375 ? 0.6475 0.7324 0.7989 -0.0134 -0.0598 -0.0063 396 SER B CB 5927 O OG . SER B 375 ? 0.8220 0.9339 0.9921 -0.0184 -0.0694 -0.0073 396 SER B OG 5928 N N . ALA B 376 ? 0.4400 0.5215 0.5863 -0.0209 -0.0355 0.0061 397 ALA B N 5929 C CA . ALA B 376 ? 0.4832 0.5393 0.6124 -0.0178 -0.0268 0.0067 397 ALA B CA 5930 C C . ALA B 376 ? 0.5323 0.5630 0.6526 -0.0255 -0.0282 0.0136 397 ALA B C 5931 O O . ALA B 376 ? 0.5910 0.6300 0.7181 -0.0360 -0.0325 0.0214 397 ALA B O 5932 C CB . ALA B 376 ? 0.4921 0.5753 0.6301 -0.0159 -0.0152 0.0103 397 ALA B CB 5933 N N . GLU B 377 ? 0.4604 0.4640 0.5622 -0.0166 -0.0255 0.0099 398 GLU B N 5934 C CA . GLU B 377 ? 0.4993 0.4906 0.5983 -0.0210 -0.0294 0.0133 398 GLU B CA 5935 C C . GLU B 377 ? 0.4705 0.4656 0.5688 -0.0202 -0.0211 0.0153 398 GLU B C 5936 O O . GLU B 377 ? 0.3616 0.3591 0.4563 -0.0148 -0.0114 0.0105 398 GLU B O 5937 C CB . GLU B 377 ? 0.4523 0.4135 0.5431 -0.0246 -0.0338 0.0034 398 GLU B CB 5938 C CG . GLU B 377 ? 0.5576 0.4958 0.6436 -0.0304 -0.0385 0.0042 398 GLU B CG 5939 C CD . GLU B 377 ? 0.6953 0.5989 0.7651 -0.0277 -0.0397 -0.0073 398 GLU B CD 5940 O OE1 . GLU B 377 ? 0.7586 0.6410 0.8226 -0.0292 -0.0445 -0.0086 398 GLU B OE1 5941 O OE2 . GLU B 377 ? 0.6943 0.5902 0.7535 -0.0229 -0.0361 -0.0157 398 GLU B OE2 5942 N N . LEU B 378 ? 0.5078 0.5012 0.6063 -0.0265 -0.0258 0.0223 399 LEU B N 5943 C CA . LEU B 378 ? 0.4780 0.4686 0.5756 -0.0276 -0.0216 0.0234 399 LEU B CA 5944 C C . LEU B 378 ? 0.5197 0.4826 0.6138 -0.0320 -0.0280 0.0183 399 LEU B C 5945 O O . LEU B 378 ? 0.5432 0.4896 0.6320 -0.0387 -0.0394 0.0207 399 LEU B O 5946 C CB . LEU B 378 ? 0.5331 0.5315 0.6260 -0.0324 -0.0252 0.0327 399 LEU B CB 5947 C CG . LEU B 378 ? 0.5675 0.5708 0.6584 -0.0306 -0.0189 0.0348 399 LEU B CG 5948 C CD1 . LEU B 378 ? 0.5328 0.5362 0.6141 -0.0404 -0.0257 0.0422 399 LEU B CD1 5949 C CD2 . LEU B 378 ? 0.4803 0.4693 0.5744 -0.0300 -0.0160 0.0297 399 LEU B CD2 5950 N N . SER B 379 ? 0.4553 0.4093 0.5471 -0.0262 -0.0208 0.0102 400 SER B N 5951 C CA . SER B 379 ? 0.4399 0.3666 0.5242 -0.0236 -0.0266 0.0027 400 SER B CA 5952 C C . SER B 379 ? 0.5030 0.4306 0.5880 -0.0191 -0.0229 0.0012 400 SER B C 5953 O O . SER B 379 ? 0.5088 0.4550 0.5978 -0.0167 -0.0115 0.0019 400 SER B O 5954 C CB . SER B 379 ? 0.4662 0.3807 0.5429 -0.0169 -0.0229 -0.0107 400 SER B CB 5955 O OG . SER B 379 ? 0.4758 0.4051 0.5502 -0.0132 -0.0101 -0.0155 400 SER B OG 5956 N N . VAL B 380 ? 0.4635 0.3689 0.5420 -0.0168 -0.0337 -0.0012 401 VAL B N 5957 C CA . VAL B 380 ? 0.5104 0.4134 0.5884 -0.0111 -0.0341 -0.0031 401 VAL B CA 5958 C C . VAL B 380 ? 0.5413 0.4421 0.6182 0.0033 -0.0334 -0.0199 401 VAL B C 5959 O O . VAL B 380 ? 0.5007 0.3848 0.5711 0.0084 -0.0425 -0.0273 401 VAL B O 5960 C CB . VAL B 380 ? 0.5552 0.4345 0.6217 -0.0172 -0.0497 0.0050 401 VAL B CB 5961 C CG1 . VAL B 380 ? 0.6633 0.5348 0.7264 -0.0090 -0.0529 0.0012 401 VAL B CG1 5962 C CG2 . VAL B 380 ? 0.4436 0.3365 0.5103 -0.0330 -0.0489 0.0197 401 VAL B CG2 5963 N N . ILE B 381 ? 0.4764 0.3989 0.5592 0.0089 -0.0222 -0.0258 402 ILE B N 5964 C CA . ILE B 381 ? 0.4599 0.3951 0.5443 0.0193 -0.0214 -0.0415 402 ILE B CA 5965 C C . ILE B 381 ? 0.5375 0.4527 0.6172 0.0282 -0.0393 -0.0457 402 ILE B C 5966 O O . ILE B 381 ? 0.5855 0.4841 0.6605 0.0278 -0.0488 -0.0378 402 ILE B O 5967 C CB . ILE B 381 ? 0.4568 0.4198 0.5462 0.0193 -0.0100 -0.0440 402 ILE B CB 5968 C CG1 . ILE B 381 ? 0.4110 0.3883 0.4966 0.0109 0.0062 -0.0403 402 ILE B CG1 5969 C CG2 . ILE B 381 ? 0.4760 0.4587 0.5690 0.0242 -0.0128 -0.0583 402 ILE B CG2 5970 C CD1 . ILE B 381 ? 0.4468 0.4409 0.5304 0.0062 0.0156 -0.0364 402 ILE B CD1 5971 N N . ALA B 382 ? 0.6151 0.5291 0.6927 0.0356 -0.0449 -0.0578 403 ALA B N 5972 C CA . ALA B 382 ? 0.6402 0.5309 0.7080 0.0463 -0.0641 -0.0632 403 ALA B CA 5973 C C . ALA B 382 ? 0.6697 0.5747 0.7413 0.0558 -0.0709 -0.0700 403 ALA B C 5974 O O . ALA B 382 ? 0.6823 0.6247 0.7670 0.0547 -0.0605 -0.0766 403 ALA B O 5975 C CB . ALA B 382 ? 0.5896 0.4803 0.6551 0.0524 -0.0666 -0.0751 403 ALA B CB 5976 N N . GLU B 383 ? 1.4595 1.2821 1.4961 0.0768 -0.1018 -0.0723 404 GLU B N 5977 C CA . GLU B 383 ? 1.4879 1.3454 1.5394 0.0821 -0.0980 -0.0803 404 GLU B CA 5978 C C . GLU B 383 ? 1.4642 1.3689 1.5365 0.0794 -0.0814 -0.0908 404 GLU B C 5979 O O . GLU B 383 ? 1.4760 1.4003 1.5536 0.0871 -0.0866 -0.1046 404 GLU B O 5980 C CB . GLU B 383 ? 1.5718 1.4161 1.6107 0.0980 -0.1199 -0.0904 404 GLU B CB 5981 C CG . GLU B 383 ? 1.5972 1.3979 1.6130 0.0979 -0.1358 -0.0800 404 GLU B CG 5982 C CD . GLU B 383 ? 1.5881 1.3354 1.5743 0.0918 -0.1479 -0.0687 404 GLU B CD 5983 O OE1 . GLU B 383 ? 1.5750 1.2934 1.5380 0.1037 -0.1663 -0.0756 404 GLU B OE1 5984 O OE2 . GLU B 383 ? 1.5685 1.3039 1.5522 0.0736 -0.1400 -0.0525 404 GLU B OE2 # 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 PRO 1 22 22 PRO PRO A . n A 1 2 GLY 2 23 23 GLY GLY A . n A 1 3 SER 3 24 24 SER SER A . n A 1 4 GLY 4 25 25 GLY GLY A . n A 1 5 PRO 5 26 26 PRO PRO A . n A 1 6 VAL 6 27 27 VAL VAL A . n A 1 7 PHE 7 28 28 PHE PHE A . n A 1 8 VAL 8 29 29 VAL VAL A . n A 1 9 GLN 9 30 30 GLN GLN A . n A 1 10 GLU 10 31 31 GLU GLU A . n A 1 11 PRO 11 32 32 PRO PRO A . n A 1 12 SER 12 33 33 SER SER A . n A 1 13 HIS 13 34 34 HIS HIS A . n A 1 14 VAL 14 35 35 VAL VAL A . n A 1 15 MET 15 36 36 MET MET A . n A 1 16 PHE 16 37 37 PHE PHE A . n A 1 17 PRO 17 38 38 PRO PRO A . n A 1 18 LEU 18 39 39 LEU LEU A . n A 1 19 ASP 19 40 40 ASP ASP A . n A 1 20 SER 20 41 ? ? ? A . n A 1 21 GLU 21 42 ? ? ? A . n A 1 22 GLU 22 43 ? ? ? A . n A 1 23 LYS 23 44 ? ? ? A . n A 1 24 LYS 24 45 45 LYS LYS A . n A 1 25 VAL 25 46 46 VAL VAL A . n A 1 26 LYS 26 47 47 LYS LYS A . n A 1 27 LEU 27 48 48 LEU LEU A . n A 1 28 SER 28 49 49 SER SER A . n A 1 29 CYS 29 50 50 CYS CYS A . n A 1 30 GLU 30 51 51 GLU GLU A . n A 1 31 VAL 31 52 52 VAL VAL A . n A 1 32 LYS 32 53 53 LYS LYS A . n A 1 33 GLY 33 54 54 GLY GLY A . n A 1 34 ASN 34 55 55 ASN ASN A . n A 1 35 PRO 35 56 56 PRO PRO A . n A 1 36 LYS 36 57 57 LYS LYS A . n A 1 37 PRO 37 58 58 PRO PRO A . n A 1 38 HIS 38 59 59 HIS HIS A . n A 1 39 ILE 39 60 60 ILE ILE A . n A 1 40 ARG 40 61 61 ARG ARG A . n A 1 41 TRP 41 62 62 TRP TRP A . n A 1 42 LYS 42 63 63 LYS LYS A . n A 1 43 LEU 43 64 64 LEU LEU A . n A 1 44 ASN 44 65 65 ASN ASN A . n A 1 45 GLY 45 66 66 GLY GLY A . n A 1 46 THR 46 67 67 THR THR A . n A 1 47 ASP 47 68 68 ASP ASP A . n A 1 48 VAL 48 69 69 VAL VAL A . n A 1 49 ASP 49 70 70 ASP ASP A . n A 1 50 ILE 50 71 71 ILE ILE A . n A 1 51 GLY 51 72 72 GLY GLY A . n A 1 52 MET 52 73 73 MET MET A . n A 1 53 ASP 53 74 74 ASP ASP A . n A 1 54 PHE 54 75 75 PHE PHE A . n A 1 55 ARG 55 76 76 ARG ARG A . n A 1 56 TYR 56 77 77 TYR TYR A . n A 1 57 SER 57 78 78 SER SER A . n A 1 58 VAL 58 79 79 VAL VAL A . n A 1 59 VAL 59 80 80 VAL VAL A . n A 1 60 ASP 60 81 81 ASP ASP A . n A 1 61 GLY 61 82 82 GLY GLY A . n A 1 62 SER 62 83 83 SER SER A . n A 1 63 LEU 63 84 84 LEU LEU A . n A 1 64 LEU 64 85 85 LEU LEU A . n A 1 65 ILE 65 86 86 ILE ILE A . n A 1 66 ASN 66 87 87 ASN ASN A . n A 1 67 ASN 67 88 88 ASN ASN A . n A 1 68 PRO 68 89 89 PRO PRO A . n A 1 69 ASN 69 90 90 ASN ASN A . n A 1 70 LYS 70 91 91 LYS LYS A . n A 1 71 THR 71 92 92 THR THR A . n A 1 72 GLN 72 93 93 GLN GLN A . n A 1 73 ASP 73 94 94 ASP ASP A . n A 1 74 ALA 74 95 95 ALA ALA A . n A 1 75 GLY 75 96 96 GLY GLY A . n A 1 76 THR 76 97 97 THR THR A . n A 1 77 TYR 77 98 98 TYR TYR A . n A 1 78 GLN 78 99 99 GLN GLN A . n A 1 79 CYS 79 100 100 CYS CYS A . n A 1 80 ILE 80 101 101 ILE ILE A . n A 1 81 ALA 81 102 102 ALA ALA A . n A 1 82 THR 82 103 103 THR THR A . n A 1 83 ASN 83 104 104 ASN ASN A . n A 1 84 SER 84 105 105 SER SER A . n A 1 85 PHE 85 106 106 PHE PHE A . n A 1 86 GLY 86 107 107 GLY GLY A . n A 1 87 THR 87 108 108 THR THR A . n A 1 88 ILE 88 109 109 ILE ILE A . n A 1 89 VAL 89 110 110 VAL VAL A . n A 1 90 SER 90 111 111 SER SER A . n A 1 91 ARG 91 112 112 ARG ARG A . n A 1 92 GLU 92 113 113 GLU GLU A . n A 1 93 ALA 93 114 114 ALA ALA A . n A 1 94 LYS 94 115 115 LYS LYS A . n A 1 95 LEU 95 116 116 LEU LEU A . n A 1 96 GLN 96 117 117 GLN GLN A . n A 1 97 PHE 97 118 118 PHE PHE A . n A 1 98 ALA 98 119 119 ALA ALA A . n A 1 99 TYR 99 120 120 TYR TYR A . n A 1 100 LEU 100 121 121 LEU LEU A . n A 1 101 GLU 101 122 122 GLU GLU A . n A 1 102 ASN 102 123 123 ASN ASN A . n A 1 103 PHE 103 124 124 PHE PHE A . n A 1 104 LYS 104 125 125 LYS LYS A . n A 1 105 THR 105 126 126 THR THR A . n A 1 106 ARG 106 127 127 ARG ARG A . n A 1 107 THR 107 128 128 THR THR A . n A 1 108 ARG 108 129 129 ARG ARG A . n A 1 109 SER 109 130 130 SER SER A . n A 1 110 THR 110 131 131 THR THR A . n A 1 111 VAL 111 132 132 VAL VAL A . n A 1 112 SER 112 133 133 SER SER A . n A 1 113 VAL 113 134 134 VAL VAL A . n A 1 114 ARG 114 135 135 ARG ARG A . n A 1 115 ARG 115 136 136 ARG ARG A . n A 1 116 GLY 116 137 137 GLY GLY A . n A 1 117 GLN 117 138 138 GLN GLN A . n A 1 118 GLY 118 139 139 GLY GLY A . n A 1 119 MET 119 140 140 MET MET A . n A 1 120 VAL 120 141 141 VAL VAL A . n A 1 121 LEU 121 142 142 LEU LEU A . n A 1 122 LEU 122 143 143 LEU LEU A . n A 1 123 CYS 123 144 144 CYS CYS A . n A 1 124 GLY 124 145 145 GLY GLY A . n A 1 125 PRO 125 146 146 PRO PRO A . n A 1 126 PRO 126 147 147 PRO PRO A . n A 1 127 PRO 127 148 148 PRO PRO A . n A 1 128 HIS 128 149 149 HIS HIS A . n A 1 129 SER 129 150 150 SER SER A . n A 1 130 GLY 130 151 151 GLY GLY A . n A 1 131 GLU 131 152 152 GLU GLU A . n A 1 132 LEU 132 153 153 LEU LEU A . n A 1 133 SER 133 154 154 SER SER A . n A 1 134 TYR 134 155 155 TYR TYR A . n A 1 135 ALA 135 156 156 ALA ALA A . n A 1 136 TRP 136 157 157 TRP TRP A . n A 1 137 ILE 137 158 158 ILE ILE A . n A 1 138 PHE 138 159 159 PHE PHE A . n A 1 139 ASN 139 160 160 ASN ASN A . n A 1 140 GLU 140 161 161 GLU GLU A . n A 1 141 TYR 141 162 162 TYR TYR A . n A 1 142 PRO 142 163 163 PRO PRO A . n A 1 143 SER 143 164 164 SER SER A . n A 1 144 TYR 144 165 165 TYR TYR A . n A 1 145 GLN 145 166 166 GLN GLN A . n A 1 146 ASP 146 167 167 ASP ASP A . n A 1 147 ASN 147 168 168 ASN ASN A . n A 1 148 ARG 148 169 169 ARG ARG A . n A 1 149 ARG 149 170 170 ARG ARG A . n A 1 150 PHE 150 171 171 PHE PHE A . n A 1 151 VAL 151 172 172 VAL VAL A . n A 1 152 SER 152 173 173 SER SER A . n A 1 153 GLN 153 174 174 GLN GLN A . n A 1 154 GLU 154 175 175 GLU GLU A . n A 1 155 THR 155 176 176 THR THR A . n A 1 156 GLY 156 177 177 GLY GLY A . n A 1 157 ASN 157 178 178 ASN ASN A . n A 1 158 LEU 158 179 179 LEU LEU A . n A 1 159 TYR 159 180 180 TYR TYR A . n A 1 160 ILE 160 181 181 ILE ILE A . n A 1 161 ALA 161 182 182 ALA ALA A . n A 1 162 LYS 162 183 183 LYS LYS A . n A 1 163 VAL 163 184 184 VAL VAL A . n A 1 164 GLU 164 185 185 GLU GLU A . n A 1 165 LYS 165 186 186 LYS LYS A . n A 1 166 SER 166 187 187 SER SER A . n A 1 167 ASP 167 188 188 ASP ASP A . n A 1 168 VAL 168 189 189 VAL VAL A . n A 1 169 GLY 169 190 190 GLY GLY A . n A 1 170 ASN 170 191 191 ASN ASN A . n A 1 171 TYR 171 192 192 TYR TYR A . n A 1 172 THR 172 193 193 THR THR A . n A 1 173 CYS 173 194 194 CYS CYS A . n A 1 174 VAL 174 195 195 VAL VAL A . n A 1 175 VAL 175 196 196 VAL VAL A . n A 1 176 THR 176 197 197 THR THR A . n A 1 177 ASN 177 198 198 ASN ASN A . n A 1 178 THR 178 199 199 THR THR A . n A 1 179 VAL 179 200 200 VAL VAL A . n A 1 180 THR 180 201 201 THR THR A . n A 1 181 ASN 181 202 202 ASN ASN A . n A 1 182 HIS 182 203 203 HIS HIS A . n A 1 183 LYS 183 204 204 LYS LYS A . n A 1 184 VAL 184 205 205 VAL VAL A . n A 1 185 LEU 185 206 206 LEU LEU A . n A 1 186 GLY 186 207 207 GLY GLY A . n A 1 187 PRO 187 208 208 PRO PRO A . n A 1 188 PRO 188 209 209 PRO PRO A . n A 1 189 THR 189 210 210 THR THR A . n A 1 190 PRO 190 211 211 PRO PRO A . n A 1 191 LEU 191 212 212 LEU LEU A . n A 1 192 ILE 192 213 213 ILE ILE A . n A 1 193 LEU 193 214 214 LEU LEU A . n A 1 194 ARG 194 215 215 ARG ARG A . n A 1 195 ASN 195 216 216 ASN ASN A . n A 1 196 ASP 196 217 217 ASP ASP A . n A 1 197 GLY 197 218 218 GLY GLY A . n A 1 198 VAL 198 219 219 VAL VAL A . n A 1 199 MET 199 220 220 MET MET A . n A 1 200 GLY 200 221 221 GLY GLY A . n A 1 201 GLU 201 222 222 GLU GLU A . n A 1 202 TYR 202 223 223 TYR TYR A . n A 1 203 GLU 203 224 224 GLU GLU A . n A 1 204 PRO 204 225 225 PRO PRO A . n A 1 205 LYS 205 226 226 LYS LYS A . n A 1 206 ILE 206 227 227 ILE ILE A . n A 1 207 GLU 207 228 228 GLU GLU A . n A 1 208 VAL 208 229 229 VAL VAL A . n A 1 209 GLN 209 230 230 GLN GLN A . n A 1 210 PHE 210 231 231 PHE PHE A . n A 1 211 PRO 211 232 232 PRO PRO A . n A 1 212 GLU 212 233 233 GLU GLU A . n A 1 213 THR 213 234 234 THR THR A . n A 1 214 VAL 214 235 235 VAL VAL A . n A 1 215 PRO 215 236 236 PRO PRO A . n A 1 216 ALA 216 237 237 ALA ALA A . n A 1 217 GLU 217 238 238 GLU GLU A . n A 1 218 LYS 218 239 239 LYS LYS A . n A 1 219 GLY 219 240 240 GLY GLY A . n A 1 220 THR 220 241 241 THR THR A . n A 1 221 THR 221 242 242 THR THR A . n A 1 222 VAL 222 243 243 VAL VAL A . n A 1 223 LYS 223 244 244 LYS LYS A . n A 1 224 LEU 224 245 245 LEU LEU A . n A 1 225 GLU 225 246 246 GLU GLU A . n A 1 226 CYS 226 247 247 CYS CYS A . n A 1 227 PHE 227 248 248 PHE PHE A . n A 1 228 ALA 228 249 249 ALA ALA A . n A 1 229 LEU 229 250 250 LEU LEU A . n A 1 230 GLY 230 251 251 GLY GLY A . n A 1 231 ASN 231 252 252 ASN ASN A . n A 1 232 PRO 232 253 253 PRO PRO A . n A 1 233 VAL 233 254 254 VAL VAL A . n A 1 234 PRO 234 255 255 PRO PRO A . n A 1 235 THR 235 256 256 THR THR A . n A 1 236 ILE 236 257 257 ILE ILE A . n A 1 237 LEU 237 258 258 LEU LEU A . n A 1 238 TRP 238 259 259 TRP TRP A . n A 1 239 ARG 239 260 260 ARG ARG A . n A 1 240 ARG 240 261 261 ARG ARG A . n A 1 241 ALA 241 262 262 ALA ALA A . n A 1 242 ASP 242 263 263 ASP ASP A . n A 1 243 GLY 243 264 264 GLY GLY A . n A 1 244 LYS 244 265 265 LYS LYS A . n A 1 245 PRO 245 266 266 PRO PRO A . n A 1 246 ILE 246 267 267 ILE ILE A . n A 1 247 ALA 247 268 268 ALA ALA A . n A 1 248 ARG 248 269 269 ARG ARG A . n A 1 249 LYS 249 270 270 LYS LYS A . n A 1 250 ALA 250 271 271 ALA ALA A . n A 1 251 ARG 251 272 272 ARG ARG A . n A 1 252 ARG 252 273 273 ARG ARG A . n A 1 253 HIS 253 274 274 HIS HIS A . n A 1 254 LYS 254 275 275 LYS LYS A . n A 1 255 SER 255 276 276 SER SER A . n A 1 256 ASN 256 277 277 ASN ASN A . n A 1 257 GLY 257 278 278 GLY GLY A . n A 1 258 ILE 258 279 279 ILE ILE A . n A 1 259 LEU 259 280 280 LEU LEU A . n A 1 260 GLU 260 281 281 GLU GLU A . n A 1 261 ILE 261 282 282 ILE ILE A . n A 1 262 PRO 262 283 283 PRO PRO A . n A 1 263 ASN 263 284 284 ASN ASN A . n A 1 264 PHE 264 285 285 PHE PHE A . n A 1 265 GLN 265 286 286 GLN GLN A . n A 1 266 GLN 266 287 287 GLN GLN A . n A 1 267 GLU 267 288 288 GLU GLU A . n A 1 268 ASP 268 289 289 ASP ASP A . n A 1 269 ALA 269 290 290 ALA ALA A . n A 1 270 GLY 270 291 291 GLY GLY A . n A 1 271 SER 271 292 292 SER SER A . n A 1 272 TYR 272 293 293 TYR TYR A . n A 1 273 GLU 273 294 294 GLU GLU A . n A 1 274 CYS 274 295 295 CYS CYS A . n A 1 275 VAL 275 296 296 VAL VAL A . n A 1 276 ALA 276 297 297 ALA ALA A . n A 1 277 GLU 277 298 298 GLU GLU A . n A 1 278 ASN 278 299 299 ASN ASN A . n A 1 279 SER 279 300 300 SER SER A . n A 1 280 ARG 280 301 301 ARG ARG A . n A 1 281 GLY 281 302 302 GLY GLY A . n A 1 282 LYS 282 303 303 LYS LYS A . n A 1 283 ASN 283 304 304 ASN ASN A . n A 1 284 VAL 284 305 305 VAL VAL A . n A 1 285 ALA 285 306 306 ALA ALA A . n A 1 286 LYS 286 307 307 LYS LYS A . n A 1 287 GLY 287 308 308 GLY GLY A . n A 1 288 GLN 288 309 309 GLN GLN A . n A 1 289 LEU 289 310 310 LEU LEU A . n A 1 290 THR 290 311 311 THR THR A . n A 1 291 PHE 291 312 312 PHE PHE A . n A 1 292 TYR 292 313 313 TYR TYR A . n A 1 293 ALA 293 314 314 ALA ALA A . n A 1 294 GLN 294 315 315 GLN GLN A . n A 1 295 PRO 295 316 316 PRO PRO A . n A 1 296 ASN 296 317 317 ASN ASN A . n A 1 297 TRP 297 318 318 TRP TRP A . n A 1 298 VAL 298 319 319 VAL VAL A . n A 1 299 GLN 299 320 320 GLN GLN A . n A 1 300 ILE 300 321 321 ILE ILE A . n A 1 301 ILE 301 322 322 ILE ILE A . n A 1 302 ASN 302 323 323 ASN ASN A . n A 1 303 ASP 303 324 324 ASP ASP A . n A 1 304 ILE 304 325 325 ILE ILE A . n A 1 305 HIS 305 326 326 HIS HIS A . n A 1 306 VAL 306 327 327 VAL VAL A . n A 1 307 ALA 307 328 328 ALA ALA A . n A 1 308 MET 308 329 329 MET MET A . n A 1 309 GLU 309 330 330 GLU GLU A . n A 1 310 GLU 310 331 331 GLU GLU A . n A 1 311 SER 311 332 332 SER SER A . n A 1 312 VAL 312 333 333 VAL VAL A . n A 1 313 PHE 313 334 334 PHE PHE A . n A 1 314 TRP 314 335 335 TRP TRP A . n A 1 315 GLU 315 336 336 GLU GLU A . n A 1 316 CYS 316 337 337 CYS CYS A . n A 1 317 LYS 317 338 338 LYS LYS A . n A 1 318 ALA 318 339 339 ALA ALA A . n A 1 319 ASN 319 340 340 ASN ASN A . n A 1 320 GLY 320 341 341 GLY GLY A . n A 1 321 ARG 321 342 342 ARG ARG A . n A 1 322 PRO 322 343 343 PRO PRO A . n A 1 323 LYS 323 344 344 LYS LYS A . n A 1 324 PRO 324 345 345 PRO PRO A . n A 1 325 THR 325 346 346 THR THR A . n A 1 326 TYR 326 347 347 TYR TYR A . n A 1 327 ARG 327 348 348 ARG ARG A . n A 1 328 TRP 328 349 349 TRP TRP A . n A 1 329 LEU 329 350 350 LEU LEU A . n A 1 330 LYS 330 351 351 LYS LYS A . n A 1 331 ASN 331 352 352 ASN ASN A . n A 1 332 GLY 332 353 353 GLY GLY A . n A 1 333 ASP 333 354 354 ASP ASP A . n A 1 334 PRO 334 355 355 PRO PRO A . n A 1 335 LEU 335 356 356 LEU LEU A . n A 1 336 LEU 336 357 357 LEU LEU A . n A 1 337 THR 337 358 358 THR THR A . n A 1 338 ARG 338 359 359 ARG ARG A . n A 1 339 ASP 339 360 360 ASP ASP A . n A 1 340 ARG 340 361 361 ARG ARG A . n A 1 341 ILE 341 362 362 ILE ILE A . n A 1 342 GLN 342 363 363 GLN GLN A . n A 1 343 ILE 343 364 364 ILE ILE A . n A 1 344 GLU 344 365 365 GLU GLU A . n A 1 345 GLN 345 366 366 GLN GLN A . n A 1 346 GLY 346 367 367 GLY GLY A . n A 1 347 THR 347 368 368 THR THR A . n A 1 348 LEU 348 369 369 LEU LEU A . n A 1 349 ASN 349 370 370 ASN ASN A . n A 1 350 ILE 350 371 371 ILE ILE A . n A 1 351 THR 351 372 372 THR THR A . n A 1 352 ILE 352 373 373 ILE ILE A . n A 1 353 VAL 353 374 374 VAL VAL A . n A 1 354 ASN 354 375 375 ASN ASN A . n A 1 355 LEU 355 376 376 LEU LEU A . n A 1 356 SER 356 377 377 SER SER A . n A 1 357 ASP 357 378 378 ASP ASP A . n A 1 358 ALA 358 379 379 ALA ALA A . n A 1 359 GLY 359 380 380 GLY GLY A . n A 1 360 MET 360 381 381 MET MET A . n A 1 361 TYR 361 382 382 TYR TYR A . n A 1 362 GLN 362 383 383 GLN GLN A . n A 1 363 CYS 363 384 384 CYS CYS A . n A 1 364 VAL 364 385 385 VAL VAL A . n A 1 365 ALA 365 386 386 ALA ALA A . n A 1 366 GLU 366 387 387 GLU GLU A . n A 1 367 ASN 367 388 388 ASN ASN A . n A 1 368 LYS 368 389 389 LYS LYS A . n A 1 369 HIS 369 390 390 HIS HIS A . n A 1 370 GLY 370 391 391 GLY GLY A . n A 1 371 VAL 371 392 392 VAL VAL A . n A 1 372 ILE 372 393 393 ILE ILE A . n A 1 373 PHE 373 394 394 PHE PHE A . n A 1 374 SER 374 395 395 SER SER A . n A 1 375 SER 375 396 396 SER SER A . n A 1 376 ALA 376 397 397 ALA ALA A . n A 1 377 GLU 377 398 398 GLU GLU A . n A 1 378 LEU 378 399 399 LEU LEU A . n A 1 379 SER 379 400 400 SER SER A . n A 1 380 VAL 380 401 401 VAL VAL A . n A 1 381 ILE 381 402 402 ILE ILE A . n A 1 382 ALA 382 403 403 ALA ALA A . n A 1 383 GLU 383 404 ? ? ? A . n B 1 1 PRO 1 22 22 PRO PRO B . n B 1 2 GLY 2 23 23 GLY GLY B . n B 1 3 SER 3 24 24 SER SER B . n B 1 4 GLY 4 25 25 GLY GLY B . n B 1 5 PRO 5 26 26 PRO PRO B . n B 1 6 VAL 6 27 27 VAL VAL B . n B 1 7 PHE 7 28 28 PHE PHE B . n B 1 8 VAL 8 29 29 VAL VAL B . n B 1 9 GLN 9 30 30 GLN GLN B . n B 1 10 GLU 10 31 31 GLU GLU B . n B 1 11 PRO 11 32 32 PRO PRO B . n B 1 12 SER 12 33 33 SER SER B . n B 1 13 HIS 13 34 34 HIS HIS B . n B 1 14 VAL 14 35 35 VAL VAL B . n B 1 15 MET 15 36 36 MET MET B . n B 1 16 PHE 16 37 37 PHE PHE B . n B 1 17 PRO 17 38 38 PRO PRO B . n B 1 18 LEU 18 39 39 LEU LEU B . n B 1 19 ASP 19 40 40 ASP ASP B . n B 1 20 SER 20 41 41 SER SER B . n B 1 21 GLU 21 42 42 GLU GLU B . n B 1 22 GLU 22 43 43 GLU GLU B . n B 1 23 LYS 23 44 44 LYS LYS B . n B 1 24 LYS 24 45 45 LYS LYS B . n B 1 25 VAL 25 46 46 VAL VAL B . n B 1 26 LYS 26 47 47 LYS LYS B . n B 1 27 LEU 27 48 48 LEU LEU B . n B 1 28 SER 28 49 49 SER SER B . n B 1 29 CYS 29 50 50 CYS CYS B . n B 1 30 GLU 30 51 51 GLU GLU B . n B 1 31 VAL 31 52 52 VAL VAL B . n B 1 32 LYS 32 53 53 LYS LYS B . n B 1 33 GLY 33 54 54 GLY GLY B . n B 1 34 ASN 34 55 55 ASN ASN B . n B 1 35 PRO 35 56 56 PRO PRO B . n B 1 36 LYS 36 57 57 LYS LYS B . n B 1 37 PRO 37 58 58 PRO PRO B . n B 1 38 HIS 38 59 59 HIS HIS B . n B 1 39 ILE 39 60 60 ILE ILE B . n B 1 40 ARG 40 61 61 ARG ARG B . n B 1 41 TRP 41 62 62 TRP TRP B . n B 1 42 LYS 42 63 63 LYS LYS B . n B 1 43 LEU 43 64 64 LEU LEU B . n B 1 44 ASN 44 65 65 ASN ASN B . n B 1 45 GLY 45 66 66 GLY GLY B . n B 1 46 THR 46 67 67 THR THR B . n B 1 47 ASP 47 68 68 ASP ASP B . n B 1 48 VAL 48 69 69 VAL VAL B . n B 1 49 ASP 49 70 70 ASP ASP B . n B 1 50 ILE 50 71 71 ILE ILE B . n B 1 51 GLY 51 72 72 GLY GLY B . n B 1 52 MET 52 73 73 MET MET B . n B 1 53 ASP 53 74 74 ASP ASP B . n B 1 54 PHE 54 75 75 PHE PHE B . n B 1 55 ARG 55 76 76 ARG ARG B . n B 1 56 TYR 56 77 77 TYR TYR B . n B 1 57 SER 57 78 78 SER SER B . n B 1 58 VAL 58 79 79 VAL VAL B . n B 1 59 VAL 59 80 80 VAL VAL B . n B 1 60 ASP 60 81 81 ASP ASP B . n B 1 61 GLY 61 82 82 GLY GLY B . n B 1 62 SER 62 83 83 SER SER B . n B 1 63 LEU 63 84 84 LEU LEU B . n B 1 64 LEU 64 85 85 LEU LEU B . n B 1 65 ILE 65 86 86 ILE ILE B . n B 1 66 ASN 66 87 87 ASN ASN B . n B 1 67 ASN 67 88 88 ASN ASN B . n B 1 68 PRO 68 89 89 PRO PRO B . n B 1 69 ASN 69 90 90 ASN ASN B . n B 1 70 LYS 70 91 91 LYS LYS B . n B 1 71 THR 71 92 92 THR THR B . n B 1 72 GLN 72 93 93 GLN GLN B . n B 1 73 ASP 73 94 94 ASP ASP B . n B 1 74 ALA 74 95 95 ALA ALA B . n B 1 75 GLY 75 96 96 GLY GLY B . n B 1 76 THR 76 97 97 THR THR B . n B 1 77 TYR 77 98 98 TYR TYR B . n B 1 78 GLN 78 99 99 GLN GLN B . n B 1 79 CYS 79 100 100 CYS CYS B . n B 1 80 ILE 80 101 101 ILE ILE B . n B 1 81 ALA 81 102 102 ALA ALA B . n B 1 82 THR 82 103 103 THR THR B . n B 1 83 ASN 83 104 104 ASN ASN B . n B 1 84 SER 84 105 105 SER SER B . n B 1 85 PHE 85 106 106 PHE PHE B . n B 1 86 GLY 86 107 107 GLY GLY B . n B 1 87 THR 87 108 108 THR THR B . n B 1 88 ILE 88 109 109 ILE ILE B . n B 1 89 VAL 89 110 110 VAL VAL B . n B 1 90 SER 90 111 111 SER SER B . n B 1 91 ARG 91 112 112 ARG ARG B . n B 1 92 GLU 92 113 113 GLU GLU B . n B 1 93 ALA 93 114 114 ALA ALA B . n B 1 94 LYS 94 115 115 LYS LYS B . n B 1 95 LEU 95 116 116 LEU LEU B . n B 1 96 GLN 96 117 117 GLN GLN B . n B 1 97 PHE 97 118 118 PHE PHE B . n B 1 98 ALA 98 119 119 ALA ALA B . n B 1 99 TYR 99 120 120 TYR TYR B . n B 1 100 LEU 100 121 121 LEU LEU B . n B 1 101 GLU 101 122 122 GLU GLU B . n B 1 102 ASN 102 123 123 ASN ASN B . n B 1 103 PHE 103 124 124 PHE PHE B . n B 1 104 LYS 104 125 125 LYS LYS B . n B 1 105 THR 105 126 126 THR THR B . n B 1 106 ARG 106 127 127 ARG ARG B . n B 1 107 THR 107 128 128 THR THR B . n B 1 108 ARG 108 129 129 ARG ARG B . n B 1 109 SER 109 130 130 SER SER B . n B 1 110 THR 110 131 131 THR THR B . n B 1 111 VAL 111 132 132 VAL VAL B . n B 1 112 SER 112 133 133 SER SER B . n B 1 113 VAL 113 134 134 VAL VAL B . n B 1 114 ARG 114 135 135 ARG ARG B . n B 1 115 ARG 115 136 136 ARG ARG B . n B 1 116 GLY 116 137 137 GLY GLY B . n B 1 117 GLN 117 138 138 GLN GLN B . n B 1 118 GLY 118 139 139 GLY GLY B . n B 1 119 MET 119 140 140 MET MET B . n B 1 120 VAL 120 141 141 VAL VAL B . n B 1 121 LEU 121 142 142 LEU LEU B . n B 1 122 LEU 122 143 143 LEU LEU B . n B 1 123 CYS 123 144 144 CYS CYS B . n B 1 124 GLY 124 145 145 GLY GLY B . n B 1 125 PRO 125 146 146 PRO PRO B . n B 1 126 PRO 126 147 147 PRO PRO B . n B 1 127 PRO 127 148 148 PRO PRO B . n B 1 128 HIS 128 149 149 HIS HIS B . n B 1 129 SER 129 150 150 SER SER B . n B 1 130 GLY 130 151 151 GLY GLY B . n B 1 131 GLU 131 152 152 GLU GLU B . n B 1 132 LEU 132 153 153 LEU LEU B . n B 1 133 SER 133 154 154 SER SER B . n B 1 134 TYR 134 155 155 TYR TYR B . n B 1 135 ALA 135 156 156 ALA ALA B . n B 1 136 TRP 136 157 157 TRP TRP B . n B 1 137 ILE 137 158 158 ILE ILE B . n B 1 138 PHE 138 159 159 PHE PHE B . n B 1 139 ASN 139 160 160 ASN ASN B . n B 1 140 GLU 140 161 161 GLU GLU B . n B 1 141 TYR 141 162 162 TYR TYR B . n B 1 142 PRO 142 163 163 PRO PRO B . n B 1 143 SER 143 164 164 SER SER B . n B 1 144 TYR 144 165 165 TYR TYR B . n B 1 145 GLN 145 166 166 GLN GLN B . n B 1 146 ASP 146 167 167 ASP ASP B . n B 1 147 ASN 147 168 168 ASN ASN B . n B 1 148 ARG 148 169 169 ARG ARG B . n B 1 149 ARG 149 170 170 ARG ARG B . n B 1 150 PHE 150 171 171 PHE PHE B . n B 1 151 VAL 151 172 172 VAL VAL B . n B 1 152 SER 152 173 173 SER SER B . n B 1 153 GLN 153 174 174 GLN GLN B . n B 1 154 GLU 154 175 175 GLU GLU B . n B 1 155 THR 155 176 176 THR THR B . n B 1 156 GLY 156 177 177 GLY GLY B . n B 1 157 ASN 157 178 178 ASN ASN B . n B 1 158 LEU 158 179 179 LEU LEU B . n B 1 159 TYR 159 180 180 TYR TYR B . n B 1 160 ILE 160 181 181 ILE ILE B . n B 1 161 ALA 161 182 182 ALA ALA B . n B 1 162 LYS 162 183 183 LYS LYS B . n B 1 163 VAL 163 184 184 VAL VAL B . n B 1 164 GLU 164 185 185 GLU GLU B . n B 1 165 LYS 165 186 186 LYS LYS B . n B 1 166 SER 166 187 187 SER SER B . n B 1 167 ASP 167 188 188 ASP ASP B . n B 1 168 VAL 168 189 189 VAL VAL B . n B 1 169 GLY 169 190 190 GLY GLY B . n B 1 170 ASN 170 191 191 ASN ASN B . n B 1 171 TYR 171 192 192 TYR TYR B . n B 1 172 THR 172 193 193 THR THR B . n B 1 173 CYS 173 194 194 CYS CYS B . n B 1 174 VAL 174 195 195 VAL VAL B . n B 1 175 VAL 175 196 196 VAL VAL B . n B 1 176 THR 176 197 197 THR THR B . n B 1 177 ASN 177 198 198 ASN ASN B . n B 1 178 THR 178 199 199 THR THR B . n B 1 179 VAL 179 200 200 VAL VAL B . n B 1 180 THR 180 201 201 THR THR B . n B 1 181 ASN 181 202 202 ASN ASN B . n B 1 182 HIS 182 203 203 HIS HIS B . n B 1 183 LYS 183 204 204 LYS LYS B . n B 1 184 VAL 184 205 205 VAL VAL B . n B 1 185 LEU 185 206 206 LEU LEU B . n B 1 186 GLY 186 207 207 GLY GLY B . n B 1 187 PRO 187 208 208 PRO PRO B . n B 1 188 PRO 188 209 209 PRO PRO B . n B 1 189 THR 189 210 210 THR THR B . n B 1 190 PRO 190 211 211 PRO PRO B . n B 1 191 LEU 191 212 212 LEU LEU B . n B 1 192 ILE 192 213 213 ILE ILE B . n B 1 193 LEU 193 214 214 LEU LEU B . n B 1 194 ARG 194 215 215 ARG ARG B . n B 1 195 ASN 195 216 216 ASN ASN B . n B 1 196 ASP 196 217 217 ASP ASP B . n B 1 197 GLY 197 218 218 GLY GLY B . n B 1 198 VAL 198 219 219 VAL VAL B . n B 1 199 MET 199 220 220 MET MET B . n B 1 200 GLY 200 221 221 GLY GLY B . n B 1 201 GLU 201 222 222 GLU GLU B . n B 1 202 TYR 202 223 223 TYR TYR B . n B 1 203 GLU 203 224 224 GLU GLU B . n B 1 204 PRO 204 225 225 PRO PRO B . n B 1 205 LYS 205 226 226 LYS LYS B . n B 1 206 ILE 206 227 227 ILE ILE B . n B 1 207 GLU 207 228 228 GLU GLU B . n B 1 208 VAL 208 229 229 VAL VAL B . n B 1 209 GLN 209 230 230 GLN GLN B . n B 1 210 PHE 210 231 231 PHE PHE B . n B 1 211 PRO 211 232 232 PRO PRO B . n B 1 212 GLU 212 233 233 GLU GLU B . n B 1 213 THR 213 234 234 THR THR B . n B 1 214 VAL 214 235 235 VAL VAL B . n B 1 215 PRO 215 236 236 PRO PRO B . n B 1 216 ALA 216 237 237 ALA ALA B . n B 1 217 GLU 217 238 238 GLU GLU B . n B 1 218 LYS 218 239 239 LYS LYS B . n B 1 219 GLY 219 240 240 GLY GLY B . n B 1 220 THR 220 241 241 THR THR B . n B 1 221 THR 221 242 242 THR THR B . n B 1 222 VAL 222 243 243 VAL VAL B . n B 1 223 LYS 223 244 244 LYS LYS B . n B 1 224 LEU 224 245 245 LEU LEU B . n B 1 225 GLU 225 246 246 GLU GLU B . n B 1 226 CYS 226 247 247 CYS CYS B . n B 1 227 PHE 227 248 248 PHE PHE B . n B 1 228 ALA 228 249 249 ALA ALA B . n B 1 229 LEU 229 250 250 LEU LEU B . n B 1 230 GLY 230 251 251 GLY GLY B . n B 1 231 ASN 231 252 252 ASN ASN B . n B 1 232 PRO 232 253 253 PRO PRO B . n B 1 233 VAL 233 254 254 VAL VAL B . n B 1 234 PRO 234 255 255 PRO PRO B . n B 1 235 THR 235 256 256 THR THR B . n B 1 236 ILE 236 257 257 ILE ILE B . n B 1 237 LEU 237 258 258 LEU LEU B . n B 1 238 TRP 238 259 259 TRP TRP B . n B 1 239 ARG 239 260 260 ARG ARG B . n B 1 240 ARG 240 261 261 ARG ARG B . n B 1 241 ALA 241 262 262 ALA ALA B . n B 1 242 ASP 242 263 263 ASP ASP B . n B 1 243 GLY 243 264 264 GLY GLY B . n B 1 244 LYS 244 265 265 LYS LYS B . n B 1 245 PRO 245 266 266 PRO PRO B . n B 1 246 ILE 246 267 267 ILE ILE B . n B 1 247 ALA 247 268 268 ALA ALA B . n B 1 248 ARG 248 269 269 ARG ARG B . n B 1 249 LYS 249 270 270 LYS LYS B . n B 1 250 ALA 250 271 271 ALA ALA B . n B 1 251 ARG 251 272 272 ARG ARG B . n B 1 252 ARG 252 273 273 ARG ARG B . n B 1 253 HIS 253 274 274 HIS HIS B . n B 1 254 LYS 254 275 275 LYS LYS B . n B 1 255 SER 255 276 276 SER SER B . n B 1 256 ASN 256 277 277 ASN ASN B . n B 1 257 GLY 257 278 278 GLY GLY B . n B 1 258 ILE 258 279 279 ILE ILE B . n B 1 259 LEU 259 280 280 LEU LEU B . n B 1 260 GLU 260 281 281 GLU GLU B . n B 1 261 ILE 261 282 282 ILE ILE B . n B 1 262 PRO 262 283 283 PRO PRO B . n B 1 263 ASN 263 284 284 ASN ASN B . n B 1 264 PHE 264 285 285 PHE PHE B . n B 1 265 GLN 265 286 286 GLN GLN B . n B 1 266 GLN 266 287 287 GLN GLN B . n B 1 267 GLU 267 288 288 GLU GLU B . n B 1 268 ASP 268 289 289 ASP ASP B . n B 1 269 ALA 269 290 290 ALA ALA B . n B 1 270 GLY 270 291 291 GLY GLY B . n B 1 271 SER 271 292 292 SER SER B . n B 1 272 TYR 272 293 293 TYR TYR B . n B 1 273 GLU 273 294 294 GLU GLU B . n B 1 274 CYS 274 295 295 CYS CYS B . n B 1 275 VAL 275 296 296 VAL VAL B . n B 1 276 ALA 276 297 297 ALA ALA B . n B 1 277 GLU 277 298 298 GLU GLU B . n B 1 278 ASN 278 299 299 ASN ASN B . n B 1 279 SER 279 300 300 SER SER B . n B 1 280 ARG 280 301 301 ARG ARG B . n B 1 281 GLY 281 302 302 GLY GLY B . n B 1 282 LYS 282 303 303 LYS LYS B . n B 1 283 ASN 283 304 304 ASN ASN B . n B 1 284 VAL 284 305 305 VAL VAL B . n B 1 285 ALA 285 306 306 ALA ALA B . n B 1 286 LYS 286 307 307 LYS LYS B . n B 1 287 GLY 287 308 308 GLY GLY B . n B 1 288 GLN 288 309 309 GLN GLN B . n B 1 289 LEU 289 310 310 LEU LEU B . n B 1 290 THR 290 311 311 THR THR B . n B 1 291 PHE 291 312 312 PHE PHE B . n B 1 292 TYR 292 313 313 TYR TYR B . n B 1 293 ALA 293 314 314 ALA ALA B . n B 1 294 GLN 294 315 315 GLN GLN B . n B 1 295 PRO 295 316 316 PRO PRO B . n B 1 296 ASN 296 317 317 ASN ASN B . n B 1 297 TRP 297 318 318 TRP TRP B . n B 1 298 VAL 298 319 319 VAL VAL B . n B 1 299 GLN 299 320 320 GLN GLN B . n B 1 300 ILE 300 321 321 ILE ILE B . n B 1 301 ILE 301 322 322 ILE ILE B . n B 1 302 ASN 302 323 323 ASN ASN B . n B 1 303 ASP 303 324 324 ASP ASP B . n B 1 304 ILE 304 325 325 ILE ILE B . n B 1 305 HIS 305 326 326 HIS HIS B . n B 1 306 VAL 306 327 327 VAL VAL B . n B 1 307 ALA 307 328 328 ALA ALA B . n B 1 308 MET 308 329 329 MET MET B . n B 1 309 GLU 309 330 330 GLU GLU B . n B 1 310 GLU 310 331 331 GLU GLU B . n B 1 311 SER 311 332 332 SER SER B . n B 1 312 VAL 312 333 333 VAL VAL B . n B 1 313 PHE 313 334 334 PHE PHE B . n B 1 314 TRP 314 335 335 TRP TRP B . n B 1 315 GLU 315 336 336 GLU GLU B . n B 1 316 CYS 316 337 337 CYS CYS B . n B 1 317 LYS 317 338 338 LYS LYS B . n B 1 318 ALA 318 339 339 ALA ALA B . n B 1 319 ASN 319 340 340 ASN ASN B . n B 1 320 GLY 320 341 341 GLY GLY B . n B 1 321 ARG 321 342 342 ARG ARG B . n B 1 322 PRO 322 343 343 PRO PRO B . n B 1 323 LYS 323 344 344 LYS LYS B . n B 1 324 PRO 324 345 345 PRO PRO B . n B 1 325 THR 325 346 346 THR THR B . n B 1 326 TYR 326 347 347 TYR TYR B . n B 1 327 ARG 327 348 348 ARG ARG B . n B 1 328 TRP 328 349 349 TRP TRP B . n B 1 329 LEU 329 350 350 LEU LEU B . n B 1 330 LYS 330 351 351 LYS LYS B . n B 1 331 ASN 331 352 352 ASN ASN B . n B 1 332 GLY 332 353 353 GLY GLY B . n B 1 333 ASP 333 354 354 ASP ASP B . n B 1 334 PRO 334 355 355 PRO PRO B . n B 1 335 LEU 335 356 356 LEU LEU B . n B 1 336 LEU 336 357 357 LEU LEU B . n B 1 337 THR 337 358 358 THR THR B . n B 1 338 ARG 338 359 359 ARG ARG B . n B 1 339 ASP 339 360 360 ASP ASP B . n B 1 340 ARG 340 361 361 ARG ARG B . n B 1 341 ILE 341 362 362 ILE ILE B . n B 1 342 GLN 342 363 363 GLN GLN B . n B 1 343 ILE 343 364 364 ILE ILE B . n B 1 344 GLU 344 365 365 GLU GLU B . n B 1 345 GLN 345 366 366 GLN GLN B . n B 1 346 GLY 346 367 367 GLY GLY B . n B 1 347 THR 347 368 368 THR THR B . n B 1 348 LEU 348 369 369 LEU LEU B . n B 1 349 ASN 349 370 370 ASN ASN B . n B 1 350 ILE 350 371 371 ILE ILE B . n B 1 351 THR 351 372 372 THR THR B . n B 1 352 ILE 352 373 373 ILE ILE B . n B 1 353 VAL 353 374 374 VAL VAL B . n B 1 354 ASN 354 375 375 ASN ASN B . n B 1 355 LEU 355 376 376 LEU LEU B . n B 1 356 SER 356 377 377 SER SER B . n B 1 357 ASP 357 378 378 ASP ASP B . n B 1 358 ALA 358 379 379 ALA ALA B . n B 1 359 GLY 359 380 380 GLY GLY B . n B 1 360 MET 360 381 381 MET MET B . n B 1 361 TYR 361 382 382 TYR TYR B . n B 1 362 GLN 362 383 383 GLN GLN B . n B 1 363 CYS 363 384 384 CYS CYS B . n B 1 364 VAL 364 385 385 VAL VAL B . n B 1 365 ALA 365 386 386 ALA ALA B . n B 1 366 GLU 366 387 387 GLU GLU B . n B 1 367 ASN 367 388 388 ASN ASN B . n B 1 368 LYS 368 389 389 LYS LYS B . n B 1 369 HIS 369 390 390 HIS HIS B . n B 1 370 GLY 370 391 391 GLY GLY B . n B 1 371 VAL 371 392 392 VAL VAL B . n B 1 372 ILE 372 393 393 ILE ILE B . n B 1 373 PHE 373 394 394 PHE PHE B . n B 1 374 SER 374 395 395 SER SER B . n B 1 375 SER 375 396 396 SER SER B . n B 1 376 ALA 376 397 397 ALA ALA B . n B 1 377 GLU 377 398 398 GLU GLU B . n B 1 378 LEU 378 399 399 LEU LEU B . n B 1 379 SER 379 400 400 SER SER B . n B 1 380 VAL 380 401 401 VAL VAL B . n B 1 381 ILE 381 402 402 ILE ILE B . n B 1 382 ALA 382 403 403 ALA ALA B . n B 1 383 GLU 383 404 404 GLU GLU B . n # loop_ _pdbx_nonpoly_scheme.asym_id _pdbx_nonpoly_scheme.entity_id _pdbx_nonpoly_scheme.mon_id _pdbx_nonpoly_scheme.ndb_seq_num _pdbx_nonpoly_scheme.pdb_seq_num _pdbx_nonpoly_scheme.auth_seq_num _pdbx_nonpoly_scheme.pdb_mon_id _pdbx_nonpoly_scheme.auth_mon_id _pdbx_nonpoly_scheme.pdb_strand_id _pdbx_nonpoly_scheme.pdb_ins_code C 2 NAG 1 1 1 NAG NAG A . D 3 NDG 1 2 2 NDG NDG A . E 2 NAG 1 3 3 NAG NAG A . F 3 NDG 1 4 4 NDG NDG A . G 2 NAG 1 5 5 NAG NAG B . H 2 NAG 1 6 6 NAG NAG B . I 2 NAG 1 7 7 NAG NAG B . J 3 NDG 1 8 8 NDG NDG B . K 4 HOH 1 6 6 HOH HOH A . K 4 HOH 2 7 7 HOH HOH A . K 4 HOH 3 9 9 HOH HOH A . K 4 HOH 4 12 12 HOH HOH A . K 4 HOH 5 13 13 HOH HOH A . K 4 HOH 6 14 14 HOH HOH A . K 4 HOH 7 16 16 HOH HOH A . K 4 HOH 8 17 17 HOH HOH A . K 4 HOH 9 19 19 HOH HOH A . K 4 HOH 10 20 20 HOH HOH A . K 4 HOH 11 21 21 HOH HOH A . K 4 HOH 12 405 405 HOH HOH A . K 4 HOH 13 406 406 HOH HOH A . K 4 HOH 14 407 407 HOH HOH A . K 4 HOH 15 408 408 HOH HOH A . K 4 HOH 16 409 409 HOH HOH A . K 4 HOH 17 410 410 HOH HOH A . K 4 HOH 18 411 411 HOH HOH A . K 4 HOH 19 412 412 HOH HOH A . K 4 HOH 20 413 413 HOH HOH A . K 4 HOH 21 414 414 HOH HOH A . K 4 HOH 22 415 415 HOH HOH A . K 4 HOH 23 416 416 HOH HOH A . K 4 HOH 24 417 417 HOH HOH A . K 4 HOH 25 418 418 HOH HOH A . K 4 HOH 26 419 419 HOH HOH A . K 4 HOH 27 420 420 HOH HOH A . K 4 HOH 28 421 421 HOH HOH A . K 4 HOH 29 422 422 HOH HOH A . K 4 HOH 30 423 423 HOH HOH A . K 4 HOH 31 424 424 HOH HOH A . K 4 HOH 32 425 425 HOH HOH A . K 4 HOH 33 426 426 HOH HOH A . K 4 HOH 34 427 427 HOH HOH A . K 4 HOH 35 428 428 HOH HOH A . K 4 HOH 36 429 429 HOH HOH A . K 4 HOH 37 430 430 HOH HOH A . K 4 HOH 38 431 431 HOH HOH A . K 4 HOH 39 432 432 HOH HOH A . K 4 HOH 40 433 433 HOH HOH A . K 4 HOH 41 434 434 HOH HOH A . K 4 HOH 42 435 435 HOH HOH A . K 4 HOH 43 436 436 HOH HOH A . K 4 HOH 44 437 437 HOH HOH A . K 4 HOH 45 438 438 HOH HOH A . K 4 HOH 46 439 439 HOH HOH A . K 4 HOH 47 440 440 HOH HOH A . K 4 HOH 48 441 441 HOH HOH A . K 4 HOH 49 442 442 HOH HOH A . K 4 HOH 50 443 443 HOH HOH A . K 4 HOH 51 444 444 HOH HOH A . K 4 HOH 52 445 445 HOH HOH A . K 4 HOH 53 446 446 HOH HOH A . K 4 HOH 54 447 447 HOH HOH A . K 4 HOH 55 448 448 HOH HOH A . K 4 HOH 56 449 449 HOH HOH A . K 4 HOH 57 450 450 HOH HOH A . K 4 HOH 58 451 451 HOH HOH A . K 4 HOH 59 452 452 HOH HOH A . K 4 HOH 60 453 453 HOH HOH A . K 4 HOH 61 454 454 HOH HOH A . K 4 HOH 62 455 455 HOH HOH A . K 4 HOH 63 456 456 HOH HOH A . K 4 HOH 64 457 457 HOH HOH A . K 4 HOH 65 458 458 HOH HOH A . K 4 HOH 66 459 459 HOH HOH A . K 4 HOH 67 460 460 HOH HOH A . K 4 HOH 68 461 461 HOH HOH A . K 4 HOH 69 462 462 HOH HOH A . K 4 HOH 70 463 463 HOH HOH A . K 4 HOH 71 464 464 HOH HOH A . K 4 HOH 72 465 465 HOH HOH A . K 4 HOH 73 466 466 HOH HOH A . K 4 HOH 74 467 467 HOH HOH A . K 4 HOH 75 468 468 HOH HOH A . K 4 HOH 76 469 469 HOH HOH A . K 4 HOH 77 470 470 HOH HOH A . K 4 HOH 78 471 471 HOH HOH A . K 4 HOH 79 472 472 HOH HOH A . K 4 HOH 80 473 473 HOH HOH A . K 4 HOH 81 474 474 HOH HOH A . K 4 HOH 82 475 475 HOH HOH A . K 4 HOH 83 476 476 HOH HOH A . K 4 HOH 84 477 477 HOH HOH A . K 4 HOH 85 478 478 HOH HOH A . K 4 HOH 86 479 479 HOH HOH A . K 4 HOH 87 480 480 HOH HOH A . K 4 HOH 88 481 481 HOH HOH A . K 4 HOH 89 482 482 HOH HOH A . K 4 HOH 90 483 483 HOH HOH A . K 4 HOH 91 484 484 HOH HOH A . K 4 HOH 92 485 485 HOH HOH A . K 4 HOH 93 486 486 HOH HOH A . K 4 HOH 94 487 487 HOH HOH A . K 4 HOH 95 488 488 HOH HOH A . K 4 HOH 96 489 489 HOH HOH A . K 4 HOH 97 490 490 HOH HOH A . K 4 HOH 98 491 491 HOH HOH A . K 4 HOH 99 492 492 HOH HOH A . K 4 HOH 100 493 493 HOH HOH A . K 4 HOH 101 494 494 HOH HOH A . K 4 HOH 102 495 495 HOH HOH A . K 4 HOH 103 496 496 HOH HOH A . K 4 HOH 104 497 497 HOH HOH A . K 4 HOH 105 498 498 HOH HOH A . K 4 HOH 106 499 499 HOH HOH A . K 4 HOH 107 500 500 HOH HOH A . K 4 HOH 108 501 501 HOH HOH A . K 4 HOH 109 502 502 HOH HOH A . K 4 HOH 110 503 503 HOH HOH A . K 4 HOH 111 504 504 HOH HOH A . K 4 HOH 112 505 505 HOH HOH A . K 4 HOH 113 506 506 HOH HOH A . K 4 HOH 114 507 507 HOH HOH A . K 4 HOH 115 508 508 HOH HOH A . K 4 HOH 116 509 509 HOH HOH A . K 4 HOH 117 510 510 HOH HOH A . K 4 HOH 118 511 511 HOH HOH A . K 4 HOH 119 512 512 HOH HOH A . K 4 HOH 120 513 513 HOH HOH A . K 4 HOH 121 514 514 HOH HOH A . K 4 HOH 122 515 515 HOH HOH A . K 4 HOH 123 516 516 HOH HOH A . K 4 HOH 124 517 517 HOH HOH A . K 4 HOH 125 518 518 HOH HOH A . K 4 HOH 126 519 519 HOH HOH A . K 4 HOH 127 520 520 HOH HOH A . K 4 HOH 128 521 521 HOH HOH A . K 4 HOH 129 522 522 HOH HOH A . K 4 HOH 130 523 523 HOH HOH A . K 4 HOH 131 524 524 HOH HOH A . K 4 HOH 132 525 525 HOH HOH A . K 4 HOH 133 526 526 HOH HOH A . K 4 HOH 134 527 527 HOH HOH A . K 4 HOH 135 528 528 HOH HOH A . K 4 HOH 136 529 529 HOH HOH A . K 4 HOH 137 530 530 HOH HOH A . K 4 HOH 138 531 531 HOH HOH A . K 4 HOH 139 532 532 HOH HOH A . K 4 HOH 140 533 533 HOH HOH A . K 4 HOH 141 534 534 HOH HOH A . K 4 HOH 142 535 535 HOH HOH A . K 4 HOH 143 536 536 HOH HOH A . K 4 HOH 144 537 537 HOH HOH A . K 4 HOH 145 538 538 HOH HOH A . K 4 HOH 146 539 539 HOH HOH A . K 4 HOH 147 540 540 HOH HOH A . K 4 HOH 148 541 541 HOH HOH A . K 4 HOH 149 542 542 HOH HOH A . K 4 HOH 150 543 543 HOH HOH A . K 4 HOH 151 544 544 HOH HOH A . K 4 HOH 152 545 545 HOH HOH A . L 4 HOH 1 4 4 HOH HOH B . L 4 HOH 2 10 10 HOH HOH B . L 4 HOH 3 11 11 HOH HOH B . L 4 HOH 4 15 15 HOH HOH B . L 4 HOH 5 18 18 HOH HOH B . L 4 HOH 6 405 405 HOH HOH B . L 4 HOH 7 406 406 HOH HOH B . L 4 HOH 8 407 407 HOH HOH B . L 4 HOH 9 408 408 HOH HOH B . L 4 HOH 10 409 409 HOH HOH B . L 4 HOH 11 410 410 HOH HOH B . L 4 HOH 12 411 411 HOH HOH B . L 4 HOH 13 412 412 HOH HOH B . L 4 HOH 14 413 413 HOH HOH B . L 4 HOH 15 414 414 HOH HOH B . L 4 HOH 16 415 415 HOH HOH B . L 4 HOH 17 416 416 HOH HOH B . L 4 HOH 18 417 417 HOH HOH B . L 4 HOH 19 418 418 HOH HOH B . L 4 HOH 20 420 420 HOH HOH B . L 4 HOH 21 421 421 HOH HOH B . L 4 HOH 22 422 422 HOH HOH B . L 4 HOH 23 423 423 HOH HOH B . L 4 HOH 24 424 424 HOH HOH B . L 4 HOH 25 425 425 HOH HOH B . L 4 HOH 26 426 426 HOH HOH B . L 4 HOH 27 427 427 HOH HOH B . L 4 HOH 28 428 428 HOH HOH B . L 4 HOH 29 429 429 HOH HOH B . L 4 HOH 30 430 430 HOH HOH B . L 4 HOH 31 431 431 HOH HOH B . L 4 HOH 32 432 432 HOH HOH B . L 4 HOH 33 433 433 HOH HOH B . L 4 HOH 34 434 434 HOH HOH B . L 4 HOH 35 435 435 HOH HOH B . # 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 44 A ASN 65 ? ASN 'GLYCOSYLATION SITE' 2 A ASN 170 A ASN 191 ? ASN 'GLYCOSYLATION SITE' 3 B ASN 44 B ASN 65 ? ASN 'GLYCOSYLATION SITE' 4 B ASN 69 B ASN 90 ? ASN 'GLYCOSYLATION SITE' 5 B ASN 170 B ASN 191 ? ASN 'GLYCOSYLATION SITE' 6 A ASN 349 A ASN 370 ? ASN 'GLYCOSYLATION SITE' 7 B ASN 349 B ASN 370 ? ASN 'GLYCOSYLATION SITE' 8 A ASN 69 A ASN 90 ? ASN 'GLYCOSYLATION SITE' # loop_ _pdbx_struct_assembly.id _pdbx_struct_assembly.details _pdbx_struct_assembly.method_details _pdbx_struct_assembly.oligomeric_details _pdbx_struct_assembly.oligomeric_count 1 author_and_software_defined_assembly PISA monomeric 1 2 author_and_software_defined_assembly PISA monomeric 1 # loop_ _pdbx_struct_assembly_gen.assembly_id _pdbx_struct_assembly_gen.oper_expression _pdbx_struct_assembly_gen.asym_id_list 1 1 A,C,D,E,F,K 2 1 B,G,H,I,J,L # _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 # _pdbx_struct_special_symmetry.id 1 _pdbx_struct_special_symmetry.PDB_model_num 1 _pdbx_struct_special_symmetry.auth_asym_id B _pdbx_struct_special_symmetry.auth_comp_id TYR _pdbx_struct_special_symmetry.auth_seq_id 162 _pdbx_struct_special_symmetry.PDB_ins_code ? _pdbx_struct_special_symmetry.label_asym_id B _pdbx_struct_special_symmetry.label_comp_id TYR _pdbx_struct_special_symmetry.label_seq_id 141 # 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 2009-12-22 2 'Structure model' 1 1 2011-07-13 3 'Structure model' 1 2 2017-11-01 # _pdbx_audit_revision_details.ordinal 1 _pdbx_audit_revision_details.revision_ordinal 1 _pdbx_audit_revision_details.data_content_type 'Structure model' _pdbx_audit_revision_details.provider repository _pdbx_audit_revision_details.type 'Initial release' _pdbx_audit_revision_details.description ? # loop_ _pdbx_audit_revision_group.ordinal _pdbx_audit_revision_group.revision_ordinal _pdbx_audit_revision_group.data_content_type _pdbx_audit_revision_group.group 1 2 'Structure model' 'Non-polymer description' 2 2 'Structure model' 'Version format compliance' 3 3 'Structure model' 'Refinement description' # _pdbx_audit_revision_category.ordinal 1 _pdbx_audit_revision_category.revision_ordinal 3 _pdbx_audit_revision_category.data_content_type 'Structure model' _pdbx_audit_revision_category.category software # loop_ _pdbx_audit_revision_item.ordinal _pdbx_audit_revision_item.revision_ordinal _pdbx_audit_revision_item.data_content_type _pdbx_audit_revision_item.item 1 3 'Structure model' '_software.classification' 2 3 'Structure model' '_software.contact_author' 3 3 'Structure model' '_software.contact_author_email' 4 3 'Structure model' '_software.date' 5 3 'Structure model' '_software.language' 6 3 'Structure model' '_software.location' 7 3 'Structure model' '_software.name' 8 3 'Structure model' '_software.type' 9 3 'Structure model' '_software.version' # loop_ _pdbx_refine_tls.pdbx_refine_id _pdbx_refine_tls.id _pdbx_refine_tls.details _pdbx_refine_tls.method _pdbx_refine_tls.origin_x _pdbx_refine_tls.origin_y _pdbx_refine_tls.origin_z _pdbx_refine_tls.T[1][1] _pdbx_refine_tls.T[2][2] _pdbx_refine_tls.T[3][3] _pdbx_refine_tls.T[1][2] _pdbx_refine_tls.T[1][3] _pdbx_refine_tls.T[2][3] _pdbx_refine_tls.L[1][1] _pdbx_refine_tls.L[2][2] _pdbx_refine_tls.L[3][3] _pdbx_refine_tls.L[1][2] _pdbx_refine_tls.L[1][3] _pdbx_refine_tls.L[2][3] _pdbx_refine_tls.S[1][1] _pdbx_refine_tls.S[1][2] _pdbx_refine_tls.S[1][3] _pdbx_refine_tls.S[2][1] _pdbx_refine_tls.S[2][2] _pdbx_refine_tls.S[2][3] _pdbx_refine_tls.S[3][1] _pdbx_refine_tls.S[3][2] _pdbx_refine_tls.S[3][3] 'X-RAY DIFFRACTION' 1 ? refined 47.1969 2.1194 -10.7233 0.6307 1.3646 0.3589 0.3963 0.1182 0.2754 -0.1593 0.6632 2.2275 -0.5756 -0.8413 0.6458 0.3667 0.0509 0.4521 -0.0562 0.3197 -0.2397 -0.2384 -1.4982 -0.4248 'X-RAY DIFFRACTION' 2 ? refined 40.2451 -0.2946 -7.3657 0.6456 1.8868 0.5064 0.3537 0.1315 0.3885 1.1354 0.5947 0.4485 0.1731 -1.5201 0.8509 0.1474 0.2683 0.5702 0.2858 0.2150 0.5662 -0.4806 -1.8589 -0.2655 'X-RAY DIFFRACTION' 3 ? refined 59.4472 -12.6188 26.7324 0.1987 -0.0099 0.1429 0.0001 0.0274 0.0603 1.4345 1.6463 2.1373 -0.6093 -0.9717 0.1510 0.1064 0.3135 0.1584 -0.1675 -0.0148 -0.0697 -0.2483 -0.2325 -0.1153 'X-RAY DIFFRACTION' 4 ? refined 55.7086 -14.9748 -22.1132 0.8721 0.6415 0.2359 -0.3236 -0.1385 0.1250 1.2738 1.5680 -0.5920 -0.5429 -0.7034 0.9829 0.2014 0.3992 -0.3212 -0.8872 0.1648 0.2375 1.1174 -0.9565 -0.2410 'X-RAY DIFFRACTION' 5 ? refined 25.2634 -24.1654 13.9504 0.4352 0.6154 0.7586 -0.0160 -0.3405 -0.1091 -0.3483 0.3557 1.6680 0.0363 -0.3700 -0.1305 -0.1016 0.6191 -0.4756 -0.4652 0.0842 0.2931 0.1107 -0.1056 -0.0659 'X-RAY DIFFRACTION' 6 ? refined -6.1196 -11.3519 4.5840 0.7297 1.2545 1.1477 0.1044 -0.2843 0.0134 0.1240 0.2538 0.1990 0.1233 -0.1562 -0.0598 -0.1132 0.2970 -0.4660 -0.1686 0.5317 0.3463 0.0810 -0.9602 -0.5370 'X-RAY DIFFRACTION' 7 ? refined -3.4254 5.3463 20.3651 0.1901 1.0721 0.7544 0.2424 -0.1675 -0.1113 0.4781 0.6272 0.7974 0.3952 -0.4552 0.2301 -0.0370 -0.3749 0.2784 0.0540 0.1242 0.2105 -0.1284 -0.2641 -0.1492 'X-RAY DIFFRACTION' 8 ? refined 35.2781 -20.8050 36.5824 0.2261 0.5158 0.4745 -0.0872 0.0042 0.0321 -1.1091 1.4990 3.2432 0.7178 0.7419 1.0696 0.2310 -0.2605 -0.2366 -0.0608 -0.2228 0.5057 0.2971 -1.0281 -0.0130 # loop_ _pdbx_refine_tls_group.pdbx_refine_id _pdbx_refine_tls_group.id _pdbx_refine_tls_group.refine_tls_id _pdbx_refine_tls_group.beg_auth_asym_id _pdbx_refine_tls_group.beg_auth_seq_id _pdbx_refine_tls_group.beg_label_asym_id _pdbx_refine_tls_group.beg_label_seq_id _pdbx_refine_tls_group.end_auth_asym_id _pdbx_refine_tls_group.end_auth_seq_id _pdbx_refine_tls_group.end_label_asym_id _pdbx_refine_tls_group.end_label_seq_id _pdbx_refine_tls_group.selection _pdbx_refine_tls_group.selection_details 'X-RAY DIFFRACTION' 1 1 A 22 ? ? A 64 ? ? ? 'chain A and resid 22:64' 'X-RAY DIFFRACTION' 2 2 A 65 ? ? A 118 ? ? ? '(chain A and resid 65:118)' 'X-RAY DIFFRACTION' 3 3 A 119 ? ? A 314 ? ? ? '(chain A and resid 119:314)' 'X-RAY DIFFRACTION' 4 4 A 315 ? ? A 403 ? ? ? '(chain A and resid 315:403)' 'X-RAY DIFFRACTION' 5 5 B 22 ? ? B 119 ? ? ? '(chain B and resid 22:119)' 'X-RAY DIFFRACTION' 6 6 B 120 ? ? B 129 ? ? ? '(chain B and resid 120:129)' 'X-RAY DIFFRACTION' 7 7 B 130 ? ? B 312 ? ? ? '(chain B and resid 130:312)' 'X-RAY DIFFRACTION' 8 8 B 313 ? ? B 404 ? ? ? '(chain B and resid 313:404)' # _pdbx_phasing_MR.entry_id 3JXA _pdbx_phasing_MR.method_rotation ? _pdbx_phasing_MR.method_translation ? _pdbx_phasing_MR.model_details ? _pdbx_phasing_MR.R_factor 51.670 _pdbx_phasing_MR.R_rigid_body ? _pdbx_phasing_MR.correlation_coeff_Fo_to_Fc ? _pdbx_phasing_MR.correlation_coeff_Io_to_Ic ? _pdbx_phasing_MR.d_res_high_rotation 2.500 _pdbx_phasing_MR.d_res_low_rotation 45.150 _pdbx_phasing_MR.d_res_high_translation 2.500 _pdbx_phasing_MR.d_res_low_translation 45.150 _pdbx_phasing_MR.packing ? _pdbx_phasing_MR.reflns_percent_rotation ? _pdbx_phasing_MR.reflns_percent_translation ? _pdbx_phasing_MR.sigma_F_rotation ? _pdbx_phasing_MR.sigma_F_translation ? _pdbx_phasing_MR.sigma_I_rotation ? _pdbx_phasing_MR.sigma_I_translation ? # _phasing.method MR # loop_ _software.pdbx_ordinal _software.name _software.version _software.date _software.type _software.contact_author _software.contact_author_email _software.classification _software.location _software.language _software.citation_id 1 DENZO . ? package 'Zbyszek Otwinowski' hkl@hkl-xray.com 'data reduction' http://www.hkl-xray.com/ ? ? 2 SCALEPACK . ? package 'Zbyszek Otwinowski' hkl@hkl-xray.com 'data scaling' http://www.hkl-xray.com/ ? ? 3 PHASER 2.1.4 'Sun Aug 10 22:58:44 2008' program 'Randy J. Read' cimr-phaser@lists.cam.ac.uk phasing http://www-structmed.cimr.cam.ac.uk/phaser/ ? ? 4 PHENIX . ? package 'Paul D. Adams' PDAdams@lbl.gov refinement http://www.phenix-online.org/ C++ ? 5 PDB_EXTRACT 3.005 'June 11, 2008' package PDB help@deposit.rcsb.org 'data extraction' http://sw-tools.pdb.org/apps/PDB_EXTRACT/ C++ ? 6 SERGUI . ? ? ? ? 'data collection' ? ? ? 7 DPS . ? ? ? ? 'data reduction' ? ? ? # _pdbx_validate_close_contact.id 1 _pdbx_validate_close_contact.PDB_model_num 1 _pdbx_validate_close_contact.auth_atom_id_1 ND2 _pdbx_validate_close_contact.auth_asym_id_1 B _pdbx_validate_close_contact.auth_comp_id_1 ASN _pdbx_validate_close_contact.auth_seq_id_1 90 _pdbx_validate_close_contact.PDB_ins_code_1 ? _pdbx_validate_close_contact.label_alt_id_1 ? _pdbx_validate_close_contact.auth_atom_id_2 C2 _pdbx_validate_close_contact.auth_asym_id_2 B _pdbx_validate_close_contact.auth_comp_id_2 NAG _pdbx_validate_close_contact.auth_seq_id_2 6 _pdbx_validate_close_contact.PDB_ins_code_2 ? _pdbx_validate_close_contact.label_alt_id_2 ? _pdbx_validate_close_contact.dist 2.16 # loop_ _pdbx_validate_symm_contact.id _pdbx_validate_symm_contact.PDB_model_num _pdbx_validate_symm_contact.auth_atom_id_1 _pdbx_validate_symm_contact.auth_asym_id_1 _pdbx_validate_symm_contact.auth_comp_id_1 _pdbx_validate_symm_contact.auth_seq_id_1 _pdbx_validate_symm_contact.PDB_ins_code_1 _pdbx_validate_symm_contact.label_alt_id_1 _pdbx_validate_symm_contact.site_symmetry_1 _pdbx_validate_symm_contact.auth_atom_id_2 _pdbx_validate_symm_contact.auth_asym_id_2 _pdbx_validate_symm_contact.auth_comp_id_2 _pdbx_validate_symm_contact.auth_seq_id_2 _pdbx_validate_symm_contact.PDB_ins_code_2 _pdbx_validate_symm_contact.label_alt_id_2 _pdbx_validate_symm_contact.site_symmetry_2 _pdbx_validate_symm_contact.dist 1 1 CZ B TYR 162 ? ? 1_555 OH B TYR 162 ? ? 2_555 1.38 2 1 CZ B TYR 162 ? ? 1_555 CZ B TYR 162 ? ? 2_555 2.11 # 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 LEU A 39 ? ? -102.68 52.81 2 1 CYS A 50 ? ? -174.91 111.98 3 1 ASN A 65 ? ? 57.82 -3.19 4 1 MET A 73 ? ? -174.19 112.91 5 1 PHE A 75 ? ? -172.60 -150.52 6 1 ALA A 95 ? ? -92.34 43.25 7 1 ASN A 104 ? ? -135.34 -159.21 8 1 GLU A 161 ? ? 79.11 -6.11 9 1 ASP A 167 ? ? -170.08 -167.02 10 1 ARG A 359 ? ? -141.94 -132.83 11 1 ARG A 361 ? ? -91.59 33.40 12 1 GLN A 366 ? ? 61.91 -115.81 13 1 ALA A 379 ? ? -39.10 130.21 14 1 LYS A 389 ? ? -59.38 -7.87 15 1 ASP B 40 ? ? -101.17 59.03 16 1 CYS B 50 ? ? -162.01 95.32 17 1 ASP B 74 ? ? -171.78 132.05 18 1 PHE B 75 ? ? -158.18 -151.10 19 1 ASN B 88 ? ? 66.72 65.18 20 1 LEU B 121 ? ? -160.82 111.37 21 1 LYS B 125 ? ? -61.19 -71.49 22 1 PRO B 232 ? ? -45.20 158.60 23 1 THR B 241 ? ? -68.76 -179.17 24 1 CYS B 247 ? ? -160.97 118.13 25 1 ALA B 262 ? ? -62.02 5.45 26 1 ARG B 269 ? ? 81.70 -31.41 27 1 ASN B 284 ? ? 49.03 72.67 28 1 ASN B 299 ? ? -142.68 -140.96 29 1 ASN B 304 ? ? -170.70 128.71 30 1 GLU B 330 ? ? 79.52 -0.86 31 1 ARG B 359 ? ? -162.38 -158.14 32 1 ARG B 361 ? ? 77.31 -26.46 33 1 GLN B 366 ? ? 63.26 -123.41 34 1 ALA B 403 ? ? -49.74 170.34 # _pdbx_validate_chiral.id 1 _pdbx_validate_chiral.PDB_model_num 1 _pdbx_validate_chiral.auth_atom_id C1 _pdbx_validate_chiral.label_alt_id ? _pdbx_validate_chiral.auth_asym_id B _pdbx_validate_chiral.auth_comp_id NAG _pdbx_validate_chiral.auth_seq_id 5 _pdbx_validate_chiral.PDB_ins_code ? _pdbx_validate_chiral.details PLANAR _pdbx_validate_chiral.omega . # 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 SER 41 ? A SER 20 2 1 Y 1 A GLU 42 ? A GLU 21 3 1 Y 1 A GLU 43 ? A GLU 22 4 1 Y 1 A LYS 44 ? A LYS 23 5 1 Y 1 A GLU 404 ? A GLU 383 # loop_ _pdbx_entity_nonpoly.entity_id _pdbx_entity_nonpoly.name _pdbx_entity_nonpoly.comp_id 2 N-ACETYL-D-GLUCOSAMINE NAG 3 '2-(ACETYLAMINO)-2-DEOXY-A-D-GLUCOPYRANOSE' NDG 4 water HOH #