data_53199 ####################### # Entry information # ####################### save_entry_information_1 _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information_1 _Entry.ID 53199 _Entry.Title ; Fc (Fragment Crystallizable) region of adalimumab ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2025-05-21 _Entry.Accession_date 2025-05-21 _Entry.Last_release_date 2025-05-22 _Entry.Original_release_date 2025-05-22 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.14.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 Donald Gagne . . . 0000-0002-3938-6567 53199 2 Yves Aubin . . . 0000-0002-8554-0297 53199 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . 'Regulatory Research Division, Center for Oncology, Radiopharmaceuticals and Research' . 53199 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 53199 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 653 53199 '15N chemical shifts' 183 53199 '1H chemical shifts' 477 53199 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2026-03-31 . original BMRB . 53199 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 53197 'FcEEM region of bevacizumab' 53199 stop_ save_ ############### # Citations # ############### save_citations_1 _Citation.Sf_category citations _Citation.Sf_framecode citations_1 _Citation.Entry_ID 53199 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID . _Citation.DOI . _Citation.Full_citation . _Citation.Title ; NMR assignment of the Fc (fragment crystallizable) region of human immunoglobulin G1 glycoprotein of adalimumab, in non-fucosylated and non-galactosylated (G0) glycoforms ; _Citation.Status 'in preparation' _Citation.Type journal _Citation.Journal_abbrev 'Not known' _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first . _Citation.Page_last . _Citation.Year . _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Donald Gagne . . . . 53199 1 2 Yves Aubin . . . . 53199 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly_1 _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly_1 _Assembly.Entry_ID 53199 _Assembly.ID 1 _Assembly.Name 'Fc (Fragment Crystallizable) of adalimumab' _Assembly.BMRB_code . _Assembly.Number_of_components 2 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds yes _Assembly.Ambiguous_conformational_states no _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange no _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 1 1 $entity_1 . . yes native no no . . . 53199 1 2 2 1 $entity_1 . . yes native no no . . . 53199 1 stop_ loop_ _Bond.ID _Bond.Type _Bond.Value_order _Bond.Assembly_atom_ID_1 _Bond.Entity_assembly_ID_1 _Bond.Entity_assembly_name_1 _Bond.Entity_ID_1 _Bond.Comp_ID_1 _Bond.Comp_index_ID_1 _Bond.Seq_ID_1 _Bond.Atom_ID_1 _Bond.Assembly_atom_ID_2 _Bond.Entity_assembly_ID_2 _Bond.Entity_assembly_name_2 _Bond.Entity_ID_2 _Bond.Comp_ID_2 _Bond.Comp_index_ID_2 _Bond.Seq_ID_2 _Bond.Atom_ID_2 _Bond.Auth_entity_assembly_ID_1 _Bond.Auth_entity_assembly_name_1 _Bond.Auth_asym_ID_1 _Bond.Auth_seq_ID_1 _Bond.Auth_comp_ID_1 _Bond.Auth_atom_ID_1 _Bond.Auth_entity_assembly_ID_2 _Bond.Auth_entity_assembly_name_2 _Bond.Auth_asym_ID_2 _Bond.Auth_seq_ID_2 _Bond.Auth_comp_ID_2 _Bond.Auth_atom_ID_2 _Bond.Entry_ID _Bond.Assembly_ID 1 disulfide single . 1 . 1 CYS 3 3 SG . 2 . 1 CYS 6 6 SG . . . . . . . . . . . . 53199 1 stop_ loop_ _Assembly_bio_function.Biological_function _Assembly_bio_function.Entry_ID _Assembly_bio_function.Assembly_ID ; The Fc (Fragment Crystallizable) is the tail region of an antibody that interacts with cell surface receptors called Fc receptors and some proteins of the complement system. This region allows antibodies to activate the immune system, for example, through binding to Fc receptors. ; 53199 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 53199 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity_1 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MTCPPCPAPELLGGPSVFLF PPKPKDTLMISRTPEVTCVV VDVSHEDPEVKFNWYVDGVE VHNAKTKPREEQYNSTYRVV SVLTVLHQDWLNGKEYKCKV SNKALPAPIEKTISKAKGQP REPQVYTLPPSRDELTKNQV SLTCLVKGFYPSDIAVEWES NGQPENNYKTTPPVLDSDGS FFLYSKLTVDKSRWQQGNVF SCSVMHEALHNHYTQKSLSL SPGK ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq 228-451 _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 224 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all disulfide bound' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 25197.65 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID ; The Fc (Fragment Crystallizable) is the tail region of an antibody that interacts with cell surface receptors called Fc receptors and some proteins of the complement system. This region allows antibodies to activate the immune system, for example, through binding to Fc receptors. ; 53199 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 228 MET . 53199 1 2 229 THR . 53199 1 3 230 CYS . 53199 1 4 231 PRO . 53199 1 5 232 PRO . 53199 1 6 233 CYS . 53199 1 7 234 PRO . 53199 1 8 235 ALA . 53199 1 9 236 PRO . 53199 1 10 237 GLU . 53199 1 11 238 LEU . 53199 1 12 239 LEU . 53199 1 13 240 GLY . 53199 1 14 241 GLY . 53199 1 15 242 PRO . 53199 1 16 243 SER . 53199 1 17 244 VAL . 53199 1 18 245 PHE . 53199 1 19 246 LEU . 53199 1 20 247 PHE . 53199 1 21 248 PRO . 53199 1 22 249 PRO . 53199 1 23 250 LYS . 53199 1 24 251 PRO . 53199 1 25 252 LYS . 53199 1 26 253 ASP . 53199 1 27 254 THR . 53199 1 28 255 LEU . 53199 1 29 256 MET . 53199 1 30 257 ILE . 53199 1 31 258 SER . 53199 1 32 259 ARG . 53199 1 33 260 THR . 53199 1 34 261 PRO . 53199 1 35 262 GLU . 53199 1 36 263 VAL . 53199 1 37 264 THR . 53199 1 38 265 CYS . 53199 1 39 266 VAL . 53199 1 40 267 VAL . 53199 1 41 268 VAL . 53199 1 42 269 ASP . 53199 1 43 270 VAL . 53199 1 44 271 SER . 53199 1 45 272 HIS . 53199 1 46 273 GLU . 53199 1 47 274 ASP . 53199 1 48 275 PRO . 53199 1 49 276 GLU . 53199 1 50 277 VAL . 53199 1 51 278 LYS . 53199 1 52 279 PHE . 53199 1 53 280 ASN . 53199 1 54 281 TRP . 53199 1 55 282 TYR . 53199 1 56 283 VAL . 53199 1 57 284 ASP . 53199 1 58 285 GLY . 53199 1 59 286 VAL . 53199 1 60 287 GLU . 53199 1 61 288 VAL . 53199 1 62 289 HIS . 53199 1 63 290 ASN . 53199 1 64 291 ALA . 53199 1 65 292 LYS . 53199 1 66 293 THR . 53199 1 67 294 LYS . 53199 1 68 295 PRO . 53199 1 69 296 ARG . 53199 1 70 297 GLU . 53199 1 71 298 GLU . 53199 1 72 299 GLN . 53199 1 73 300 TYR . 53199 1 74 301 ASN . 53199 1 75 302 SER . 53199 1 76 303 THR . 53199 1 77 304 TYR . 53199 1 78 305 ARG . 53199 1 79 306 VAL . 53199 1 80 307 VAL . 53199 1 81 308 SER . 53199 1 82 309 VAL . 53199 1 83 310 LEU . 53199 1 84 311 THR . 53199 1 85 312 VAL . 53199 1 86 313 LEU . 53199 1 87 314 HIS . 53199 1 88 315 GLN . 53199 1 89 316 ASP . 53199 1 90 317 TRP . 53199 1 91 318 LEU . 53199 1 92 319 ASN . 53199 1 93 320 GLY . 53199 1 94 321 LYS . 53199 1 95 322 GLU . 53199 1 96 323 TYR . 53199 1 97 324 LYS . 53199 1 98 325 CYS . 53199 1 99 326 LYS . 53199 1 100 327 VAL . 53199 1 101 328 SER . 53199 1 102 329 ASN . 53199 1 103 330 LYS . 53199 1 104 331 ALA . 53199 1 105 332 LEU . 53199 1 106 333 PRO . 53199 1 107 334 ALA . 53199 1 108 335 PRO . 53199 1 109 336 ILE . 53199 1 110 337 GLU . 53199 1 111 338 LYS . 53199 1 112 339 THR . 53199 1 113 340 ILE . 53199 1 114 341 SER . 53199 1 115 342 LYS . 53199 1 116 343 ALA . 53199 1 117 344 LYS . 53199 1 118 345 GLY . 53199 1 119 346 GLN . 53199 1 120 347 PRO . 53199 1 121 348 ARG . 53199 1 122 349 GLU . 53199 1 123 350 PRO . 53199 1 124 351 GLN . 53199 1 125 352 VAL . 53199 1 126 353 TYR . 53199 1 127 354 THR . 53199 1 128 355 LEU . 53199 1 129 356 PRO . 53199 1 130 357 PRO . 53199 1 131 358 SER . 53199 1 132 359 ARG . 53199 1 133 360 ASP . 53199 1 134 361 GLU . 53199 1 135 362 LEU . 53199 1 136 363 THR . 53199 1 137 364 LYS . 53199 1 138 365 ASN . 53199 1 139 366 GLN . 53199 1 140 367 VAL . 53199 1 141 368 SER . 53199 1 142 369 LEU . 53199 1 143 370 THR . 53199 1 144 371 CYS . 53199 1 145 372 LEU . 53199 1 146 373 VAL . 53199 1 147 374 LYS . 53199 1 148 375 GLY . 53199 1 149 376 PHE . 53199 1 150 377 TYR . 53199 1 151 378 PRO . 53199 1 152 379 SER . 53199 1 153 380 ASP . 53199 1 154 381 ILE . 53199 1 155 382 ALA . 53199 1 156 383 VAL . 53199 1 157 384 GLU . 53199 1 158 385 TRP . 53199 1 159 386 GLU . 53199 1 160 387 SER . 53199 1 161 388 ASN . 53199 1 162 389 GLY . 53199 1 163 390 GLN . 53199 1 164 391 PRO . 53199 1 165 392 GLU . 53199 1 166 393 ASN . 53199 1 167 394 ASN . 53199 1 168 395 TYR . 53199 1 169 396 LYS . 53199 1 170 397 THR . 53199 1 171 398 THR . 53199 1 172 399 PRO . 53199 1 173 400 PRO . 53199 1 174 401 VAL . 53199 1 175 402 LEU . 53199 1 176 403 ASP . 53199 1 177 404 SER . 53199 1 178 405 ASP . 53199 1 179 406 GLY . 53199 1 180 407 SER . 53199 1 181 408 PHE . 53199 1 182 409 PHE . 53199 1 183 410 LEU . 53199 1 184 411 TYR . 53199 1 185 412 SER . 53199 1 186 413 LYS . 53199 1 187 414 LEU . 53199 1 188 415 THR . 53199 1 189 416 VAL . 53199 1 190 417 ASP . 53199 1 191 418 LYS . 53199 1 192 419 SER . 53199 1 193 420 ARG . 53199 1 194 421 TRP . 53199 1 195 422 GLN . 53199 1 196 423 GLN . 53199 1 197 424 GLY . 53199 1 198 425 ASN . 53199 1 199 426 VAL . 53199 1 200 427 PHE . 53199 1 201 428 SER . 53199 1 202 429 CYS . 53199 1 203 430 SER . 53199 1 204 431 VAL . 53199 1 205 432 MET . 53199 1 206 433 HIS . 53199 1 207 434 GLU . 53199 1 208 435 ALA . 53199 1 209 436 LEU . 53199 1 210 437 HIS . 53199 1 211 438 ASN . 53199 1 212 439 HIS . 53199 1 213 440 TYR . 53199 1 214 441 THR . 53199 1 215 442 GLN . 53199 1 216 443 LYS . 53199 1 217 444 SER . 53199 1 218 445 LEU . 53199 1 219 446 SER . 53199 1 220 447 LEU . 53199 1 221 448 SER . 53199 1 222 449 PRO . 53199 1 223 450 GLY . 53199 1 224 451 LYS . 53199 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 53199 1 . THR 2 2 53199 1 . CYS 3 3 53199 1 . PRO 4 4 53199 1 . PRO 5 5 53199 1 . CYS 6 6 53199 1 . PRO 7 7 53199 1 . ALA 8 8 53199 1 . PRO 9 9 53199 1 . GLU 10 10 53199 1 . LEU 11 11 53199 1 . LEU 12 12 53199 1 . GLY 13 13 53199 1 . GLY 14 14 53199 1 . PRO 15 15 53199 1 . SER 16 16 53199 1 . VAL 17 17 53199 1 . PHE 18 18 53199 1 . LEU 19 19 53199 1 . PHE 20 20 53199 1 . PRO 21 21 53199 1 . PRO 22 22 53199 1 . LYS 23 23 53199 1 . PRO 24 24 53199 1 . LYS 25 25 53199 1 . ASP 26 26 53199 1 . THR 27 27 53199 1 . LEU 28 28 53199 1 . MET 29 29 53199 1 . ILE 30 30 53199 1 . SER 31 31 53199 1 . ARG 32 32 53199 1 . THR 33 33 53199 1 . PRO 34 34 53199 1 . GLU 35 35 53199 1 . VAL 36 36 53199 1 . THR 37 37 53199 1 . CYS 38 38 53199 1 . VAL 39 39 53199 1 . VAL 40 40 53199 1 . VAL 41 41 53199 1 . ASP 42 42 53199 1 . VAL 43 43 53199 1 . SER 44 44 53199 1 . HIS 45 45 53199 1 . GLU 46 46 53199 1 . ASP 47 47 53199 1 . PRO 48 48 53199 1 . GLU 49 49 53199 1 . VAL 50 50 53199 1 . LYS 51 51 53199 1 . PHE 52 52 53199 1 . ASN 53 53 53199 1 . TRP 54 54 53199 1 . TYR 55 55 53199 1 . VAL 56 56 53199 1 . ASP 57 57 53199 1 . GLY 58 58 53199 1 . VAL 59 59 53199 1 . GLU 60 60 53199 1 . VAL 61 61 53199 1 . HIS 62 62 53199 1 . ASN 63 63 53199 1 . ALA 64 64 53199 1 . LYS 65 65 53199 1 . THR 66 66 53199 1 . LYS 67 67 53199 1 . PRO 68 68 53199 1 . ARG 69 69 53199 1 . GLU 70 70 53199 1 . GLU 71 71 53199 1 . GLN 72 72 53199 1 . TYR 73 73 53199 1 . ASN 74 74 53199 1 . SER 75 75 53199 1 . THR 76 76 53199 1 . TYR 77 77 53199 1 . ARG 78 78 53199 1 . VAL 79 79 53199 1 . VAL 80 80 53199 1 . SER 81 81 53199 1 . VAL 82 82 53199 1 . LEU 83 83 53199 1 . THR 84 84 53199 1 . VAL 85 85 53199 1 . LEU 86 86 53199 1 . HIS 87 87 53199 1 . GLN 88 88 53199 1 . ASP 89 89 53199 1 . TRP 90 90 53199 1 . LEU 91 91 53199 1 . ASN 92 92 53199 1 . GLY 93 93 53199 1 . LYS 94 94 53199 1 . GLU 95 95 53199 1 . TYR 96 96 53199 1 . LYS 97 97 53199 1 . CYS 98 98 53199 1 . LYS 99 99 53199 1 . VAL 100 100 53199 1 . SER 101 101 53199 1 . ASN 102 102 53199 1 . LYS 103 103 53199 1 . ALA 104 104 53199 1 . LEU 105 105 53199 1 . PRO 106 106 53199 1 . ALA 107 107 53199 1 . PRO 108 108 53199 1 . ILE 109 109 53199 1 . GLU 110 110 53199 1 . LYS 111 111 53199 1 . THR 112 112 53199 1 . ILE 113 113 53199 1 . SER 114 114 53199 1 . LYS 115 115 53199 1 . ALA 116 116 53199 1 . LYS 117 117 53199 1 . GLY 118 118 53199 1 . GLN 119 119 53199 1 . PRO 120 120 53199 1 . ARG 121 121 53199 1 . GLU 122 122 53199 1 . PRO 123 123 53199 1 . GLN 124 124 53199 1 . VAL 125 125 53199 1 . TYR 126 126 53199 1 . THR 127 127 53199 1 . LEU 128 128 53199 1 . PRO 129 129 53199 1 . PRO 130 130 53199 1 . SER 131 131 53199 1 . ARG 132 132 53199 1 . ASP 133 133 53199 1 . GLU 134 134 53199 1 . LEU 135 135 53199 1 . THR 136 136 53199 1 . LYS 137 137 53199 1 . ASN 138 138 53199 1 . GLN 139 139 53199 1 . VAL 140 140 53199 1 . SER 141 141 53199 1 . LEU 142 142 53199 1 . THR 143 143 53199 1 . CYS 144 144 53199 1 . LEU 145 145 53199 1 . VAL 146 146 53199 1 . LYS 147 147 53199 1 . GLY 148 148 53199 1 . PHE 149 149 53199 1 . TYR 150 150 53199 1 . PRO 151 151 53199 1 . SER 152 152 53199 1 . ASP 153 153 53199 1 . ILE 154 154 53199 1 . ALA 155 155 53199 1 . VAL 156 156 53199 1 . GLU 157 157 53199 1 . TRP 158 158 53199 1 . GLU 159 159 53199 1 . SER 160 160 53199 1 . ASN 161 161 53199 1 . GLY 162 162 53199 1 . GLN 163 163 53199 1 . PRO 164 164 53199 1 . GLU 165 165 53199 1 . ASN 166 166 53199 1 . ASN 167 167 53199 1 . TYR 168 168 53199 1 . LYS 169 169 53199 1 . THR 170 170 53199 1 . THR 171 171 53199 1 . PRO 172 172 53199 1 . PRO 173 173 53199 1 . VAL 174 174 53199 1 . LEU 175 175 53199 1 . ASP 176 176 53199 1 . SER 177 177 53199 1 . ASP 178 178 53199 1 . GLY 179 179 53199 1 . SER 180 180 53199 1 . PHE 181 181 53199 1 . PHE 182 182 53199 1 . LEU 183 183 53199 1 . TYR 184 184 53199 1 . SER 185 185 53199 1 . LYS 186 186 53199 1 . LEU 187 187 53199 1 . THR 188 188 53199 1 . VAL 189 189 53199 1 . ASP 190 190 53199 1 . LYS 191 191 53199 1 . SER 192 192 53199 1 . ARG 193 193 53199 1 . TRP 194 194 53199 1 . GLN 195 195 53199 1 . GLN 196 196 53199 1 . GLY 197 197 53199 1 . ASN 198 198 53199 1 . VAL 199 199 53199 1 . PHE 200 200 53199 1 . SER 201 201 53199 1 . CYS 202 202 53199 1 . SER 203 203 53199 1 . VAL 204 204 53199 1 . MET 205 205 53199 1 . HIS 206 206 53199 1 . GLU 207 207 53199 1 . ALA 208 208 53199 1 . LEU 209 209 53199 1 . HIS 210 210 53199 1 . ASN 211 211 53199 1 . HIS 212 212 53199 1 . TYR 213 213 53199 1 . THR 214 214 53199 1 . GLN 215 215 53199 1 . LYS 216 216 53199 1 . SER 217 217 53199 1 . LEU 218 218 53199 1 . SER 219 219 53199 1 . LEU 220 220 53199 1 . SER 221 221 53199 1 . PRO 222 222 53199 1 . GLY 223 223 53199 1 . LYS 224 224 53199 1 stop_ save_ #################### # Natural source # #################### save_natural_source_1 _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source_1 _Entity_natural_src_list.Entry_ID 53199 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity_1 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . 53199 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source_1 _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source_1 _Entity_experimental_src_list.Entry_ID 53199 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli BL21(DE3) . . plasmid . . pET11a . . . 53199 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 53199 _Sample.ID 1 _Sample.Name DG2-250 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number 1 _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 entity_1 . . . 1 $entity_1 . . . . . uM . . . . 53199 1 2 'sodium acetate' d3 . . . . . . 50 . . uM . . . . 53199 1 3 DSS 'natural abundance' . . . . . . 1 . . mM . . . . 53199 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 53199 _Sample.ID 2 _Sample.Name DG2-275 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number 1 _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 entity_1 . . . 1 $entity_1 . . . . . uM . . . . 53199 2 2 'sodium acetate' d3 . . . . . . 50 . . uM . . . . 53199 2 3 DSS 'natural abundance' . . . . . . 1 . . mM . . . . 53199 2 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 53199 _Sample_condition_list.ID 1 _Sample_condition_list.Name sample_conditions_1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 5.0 . pH 53199 1 temperature 313 . K 53199 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 53199 _Software.ID 1 _Software.Type . _Software.Name TOPSPIN _Software.Version '3.5 pl7' _Software.DOI . _Software.Details 'Avance III HD 700MHz NMR Spectrometer' loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID collection . 53199 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 53199 _Software.ID 2 _Software.Type . _Software.Name TOPSPIN _Software.Version 4.0.8 _Software.DOI . _Software.Details 'Avance Neo 600MHz NMR Spectrometer' loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID collection . 53199 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 53199 _Software.ID 3 _Software.Type . _Software.Name NMRPipe _Software.Version '11.5 Rev 2023.105.21.31' _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID processing . 53199 3 stop_ save_ save_software_4 _Software.Sf_category software _Software.Sf_framecode software_4 _Software.Entry_ID 53199 _Software.ID 4 _Software.Type . _Software.Name NMRViewJ _Software.Version 9.2.0-b27 _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 53199 4 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID 53199 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name 'Avance III HD 700MHz NMR Spectrometer' _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE III' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 save_ save_NMR_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_2 _NMR_spectrometer.Entry_ID 53199 _NMR_spectrometer.ID 2 _NMR_spectrometer.Name 'Avance Neo 600MHz Spectrometer' _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE NEO' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ ############################# # NMR applied experiments # ############################# save_experiment_list_1 _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list_1 _Experiment_list.Entry_ID 53199 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NUS_flag _Experiment.Interleaved_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Details _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '3D HNCO' yes no yes . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 53199 1 2 '3D HN(CA)CO' yes no yes . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 53199 1 3 '3D HNCA' yes no yes . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 53199 1 4 '3D HN(CO)CA' yes no yes . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 53199 1 5 '3D HNCACB' yes no yes . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 53199 1 6 '3D HN(CO)CACB' yes no yes . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 53199 1 7 '3D CCC_TOCSY' yes no yes . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 53199 1 8 '3D HCC_TOCSY' yes no yes . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 53199 1 9 '3D CCC_CA_TOCSY' yes no yes . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 53199 1 10 '3D HCC_CA_TOCSY' yes no yes . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 53199 1 11 '2D 1H-15N TROSY' yes no yes . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 53199 1 12 '2D 1H-13C HSQC' yes no yes . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 53199 1 stop_ loop_ _Experiment_file.Experiment_ID _Experiment_file.Experiment_name _Experiment_file.Name _Experiment_file.Type _Experiment_file.Content _Experiment_file.Directory_path _Experiment_file.Details _Experiment_file.Entry_ID _Experiment_file.Experiment_list_ID 1 '3D HNCO' ser_hnco . 'Time-domain (raw spectral data)' . . 53199 1 2 '3D HN(CA)CO' ser_hncaco . 'Time-domain (raw spectral data)' . . 53199 1 3 '3D HNCA' ser_hnca . 'Time-domain (raw spectral data)' . . 53199 1 4 '3D HN(CO)CA' ser_hncoca . 'Time-domain (raw spectral data)' . . 53199 1 5 '3D HNCACB' ser_hncacb . 'Time-domain (raw spectral data)' . . 53199 1 6 '3D HN(CO)CACB' ser_hncocacb . 'Time-domain (raw spectral data)' . . 53199 1 7 '3D CCC_TOCSY' ser_ccc_toc_co_nnh . 'Time-domain (raw spectral data)' . . 53199 1 8 '3D HCC_TOCSY' ser_hcc_toc_co_nnh . 'Time-domain (raw spectral data)' . . 53199 1 9 '3D CCC_CA_TOCSY' ser_ccc_CA_tocsy_co_nnh . 'Time-domain (raw spectral data)' . . 53199 1 10 '3D HCC_CA_TOCSY' ser_hcc_CA_toc_co_nnh . 'Time-domain (raw spectral data)' . . 53199 1 11 '2D 1H-15N TROSY' ser_trosy . 'Time-domain (raw spectral data)' . . 53199 1 12 '2D 1H-13C HSQC' ser_methyls . 'Time-domain (raw spectral data)' . . 53199 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chem_shift_reference_1 _Chem_shift_reference.Entry_ID 53199 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name chemical_shifts_reference_1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0 internal indirect 0.101329118 . . . . . 53199 1 H 1 DSS 'methyl protons' . . . . ppm 0 internal direct 1.000000000 . . . . . 53199 1 N 15 DSS 'methyl protons' . . . . ppm 0 internal indirect 0.251449530 . . . . . 53199 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 53199 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name assigned_chemical_shifts_1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '3D HNCO' . . . 53199 1 2 '3D HN(CA)CO' . . . 53199 1 3 '3D HNCA' . . . 53199 1 4 '3D HN(CO)CA' . . . 53199 1 5 '3D HNCACB' . . . 53199 1 6 '3D HN(CO)CACB' . . . 53199 1 7 '3D CCC_TOCSY' . . . 53199 1 8 '3D HCC_TOCSY' . . . 53199 1 9 '3D CCC_CA_TOCSY' . . . 53199 1 10 '3D HCC_CA_TOCSY' . . . 53199 1 11 '2D 1H-15N TROSY' . . . 53199 1 12 '2D 1H-13C HSQC' . . . 53199 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $software_1 . . 53199 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 1 1 MET C C 13 176.6560 0.0000 . 1 . . 109495 . . 228 MET C . 53199 1 2 . 1 . 1 1 1 MET CA C 13 56.3124 0.0000 . 1 . . 109487 . . 228 MET CA . 53199 1 3 . 1 . 1 1 1 MET CB C 13 32.3033 0.0000 . 1 . . 109497 . . 228 MET CB . 53199 1 4 . 1 . 1 2 2 THR H H 1 7.9896 0.0000 . 1 . . 38373 . . 229 THR H . 53199 1 5 . 1 . 1 2 2 THR C C 13 176.0294 0.0000 . 1 . . 109526 . . 229 THR C . 53199 1 6 . 1 . 1 2 2 THR CA C 13 61.3417 0.0000 . 1 . . 109518 . . 229 THR CA . 53199 1 7 . 1 . 1 2 2 THR N N 15 115.9281 0.0000 . 1 . . 38375 . . 229 THR N . 53199 1 8 . 1 . 1 3 3 CYS H H 1 8.4574 0.0000 . 1 . . 70914 . . 230 CYS H . 53199 1 9 . 1 . 1 3 3 CYS C C 13 177.0620 0.0000 . 1 . . 109546 . . 230 CYS C . 53199 1 10 . 1 . 1 3 3 CYS CA C 13 54.0510 0.0000 . 1 . . 95886 . . 230 CYS CA . 53199 1 11 . 1 . 1 3 3 CYS CB C 13 29.2982 0.0000 . 1 . . 95894 . . 230 CYS CB . 53199 1 12 . 1 . 1 3 3 CYS N N 15 122.8146 0.0000 . 1 . . 70916 . . 230 CYS N . 53199 1 13 . 1 . 1 8 8 ALA H H 1 8.0920 0.0000 . 1 . . . . . 235 ALA H . 53199 1 14 . 1 . 1 8 8 ALA CA C 13 50.0710 0.0000 . 1 . . . . . 235 ALA CA . 53199 1 15 . 1 . 1 8 8 ALA N N 15 125.3770 0.0000 . 1 . . . . . 235 ALA N . 53199 1 16 . 1 . 1 9 9 PRO C C 13 176.9797 0.0000 . 1 . . 41293 . . 236 PRO C . 53199 1 17 . 1 . 1 9 9 PRO CA C 13 63.0630 0.0000 . 1 . . 41299 . . 236 PRO CA . 53199 1 18 . 1 . 1 9 9 PRO CB C 13 31.2375 0.0000 . 1 . . 41302 . . 236 PRO CB . 53199 1 19 . 1 . 1 10 10 GLU H H 1 8.4475 0.0000 . 1 . . 38208 . . 237 GLU H . 53199 1 20 . 1 . 1 10 10 GLU C C 13 176.2148 0.0000 . 1 . . 41300 . . 237 GLU C . 53199 1 21 . 1 . 1 10 10 GLU CA C 13 56.4232 0.0000 . 1 . . 41295 . . 237 GLU CA . 53199 1 22 . 1 . 1 10 10 GLU CB C 13 29.1026 0.0000 . 1 . . 41296 . . 237 GLU CB . 53199 1 23 . 1 . 1 10 10 GLU N N 15 120.4242 0.0000 . 1 . . 38210 . . 237 GLU N . 53199 1 24 . 1 . 1 11 11 LEU H H 1 8.0512 0.0000 . 1 . . 35589 . . 238 LEU H . 53199 1 25 . 1 . 1 11 11 LEU HD11 H 1 0.8790 0.0000 . 2 . . 91698 . . 238 LEU HD11 . 53199 1 26 . 1 . 1 11 11 LEU HD12 H 1 0.8790 0.0000 . 2 . . 91698 . . 238 LEU HD11 . 53199 1 27 . 1 . 1 11 11 LEU HD13 H 1 0.8790 0.0000 . 2 . . 91698 . . 238 LEU HD11 . 53199 1 28 . 1 . 1 11 11 LEU HD21 H 1 0.9260 0.0000 . 2 . . 91698 . . 238 LEU HD21 . 53199 1 29 . 1 . 1 11 11 LEU HD22 H 1 0.9260 0.0000 . 2 . . 91698 . . 238 LEU HD21 . 53199 1 30 . 1 . 1 11 11 LEU HD23 H 1 0.9260 0.0000 . 2 . . 91698 . . 238 LEU HD21 . 53199 1 31 . 1 . 1 11 11 LEU C C 13 177.0673 0.0000 . 1 . . 48858 . . 238 LEU C . 53199 1 32 . 1 . 1 11 11 LEU CA C 13 54.7595 0.0000 . 1 . . 48862 . . 238 LEU CA . 53199 1 33 . 1 . 1 11 11 LEU CD1 C 13 23.6690 0.0000 . 2 . . 87357 . . 238 LEU CD1 . 53199 1 34 . 1 . 1 11 11 LEU CD2 C 13 24.9570 0.0000 . 2 . . 87237 . . 238 LEU CD2 . 53199 1 35 . 1 . 1 11 11 LEU N N 15 123.0400 0.0000 . 1 . . 35591 . . 238 LEU N . 53199 1 36 . 1 . 1 12 12 LEU H H 1 8.0326 0.0000 . 1 . . 32394 . . 239 LEU H . 53199 1 37 . 1 . 1 12 12 LEU HD11 H 1 0.8690 0.0000 . 2 . . 91698 . . 239 LEU HD11 . 53199 1 38 . 1 . 1 12 12 LEU HD12 H 1 0.8690 0.0000 . 2 . . 91698 . . 239 LEU HD11 . 53199 1 39 . 1 . 1 12 12 LEU HD13 H 1 0.8690 0.0000 . 2 . . 91698 . . 239 LEU HD11 . 53199 1 40 . 1 . 1 12 12 LEU HD21 H 1 0.9260 0.0000 . 2 . . 91698 . . 239 LEU HD21 . 53199 1 41 . 1 . 1 12 12 LEU HD22 H 1 0.9260 0.0000 . 2 . . 91698 . . 239 LEU HD21 . 53199 1 42 . 1 . 1 12 12 LEU HD23 H 1 0.9260 0.0000 . 2 . . 91698 . . 239 LEU HD21 . 53199 1 43 . 1 . 1 12 12 LEU C C 13 177.6031 0.0000 . 1 . . 97342 . . 239 LEU C . 53199 1 44 . 1 . 1 12 12 LEU CA C 13 54.9411 0.0000 . 1 . . 97340 . . 239 LEU CA . 53199 1 45 . 1 . 1 12 12 LEU CB C 13 41.6285 0.0000 . 1 . . 97344 . . 239 LEU CB . 53199 1 46 . 1 . 1 12 12 LEU CD1 C 13 23.4500 0.0000 . 2 . . 87366 . . 239 LEU CD1 . 53199 1 47 . 1 . 1 12 12 LEU CD2 C 13 24.9570 0.0000 . 2 . . 87252 . . 239 LEU CD2 . 53199 1 48 . 1 . 1 12 12 LEU N N 15 123.3482 0.0000 . 1 . . 32396 . . 239 LEU N . 53199 1 49 . 1 . 1 13 13 GLY H H 1 8.2100 0.0000 . 1 . . 37680 . . 240 GLY H . 53199 1 50 . 1 . 1 13 13 GLY C C 13 174.1839 0.0000 . 1 . . 96954 . . 240 GLY C . 53199 1 51 . 1 . 1 13 13 GLY CA C 13 44.9355 0.0000 . 1 . . 96958 . . 240 GLY CA . 53199 1 52 . 1 . 1 13 13 GLY N N 15 109.8352 0.0000 . 1 . . 37682 . . 240 GLY N . 53199 1 53 . 1 . 1 14 14 GLY H H 1 7.9093 0.0000 . 1 . . 38580 . . 241 GLY H . 53199 1 54 . 1 . 1 14 14 GLY C C 13 170.8362 0.0000 . 1 . . 97091 . . 241 GLY C . 53199 1 55 . 1 . 1 14 14 GLY CA C 13 44.2004 0.0000 . 1 . . 97093 . . 241 GLY CA . 53199 1 56 . 1 . 1 14 14 GLY N N 15 108.9659 0.0000 . 1 . . 38582 . . 241 GLY N . 53199 1 57 . 1 . 1 15 15 PRO C C 13 175.8414 0.0000 . 1 . . 69121 . . 242 PRO C . 53199 1 58 . 1 . 1 15 15 PRO CA C 13 63.1550 0.0000 . 1 . . 104182 . . 242 PRO CA . 53199 1 59 . 1 . 1 16 16 SER H H 1 7.9935 0.0000 . 1 . . 69120 . . 243 SER H . 53199 1 60 . 1 . 1 16 16 SER C C 13 171.8349 0.0000 . 1 . . 104230 . . 243 SER C . 53199 1 61 . 1 . 1 16 16 SER CA C 13 57.5423 0.0000 . 1 . . 49975 . . 243 SER CA . 53199 1 62 . 1 . 1 16 16 SER CB C 13 65.6073 0.0000 . 1 . . 104242 . . 243 SER CB . 53199 1 63 . 1 . 1 16 16 SER N N 15 114.5285 0.0000 . 1 . . 69122 . . 243 SER N . 53199 1 64 . 1 . 1 17 17 VAL H H 1 7.9565 0.0000 . 1 . . 38127 . . 244 VAL H . 53199 1 65 . 1 . 1 17 17 VAL HG11 H 1 0.7120 0.0000 . 2 . . 92217 . . 244 VAL HG11 . 53199 1 66 . 1 . 1 17 17 VAL HG12 H 1 0.7120 0.0000 . 2 . . 92217 . . 244 VAL HG11 . 53199 1 67 . 1 . 1 17 17 VAL HG13 H 1 0.7120 0.0000 . 2 . . 92217 . . 244 VAL HG11 . 53199 1 68 . 1 . 1 17 17 VAL HG21 H 1 0.7530 0.0000 . 2 . . 92217 . . 244 VAL HG21 . 53199 1 69 . 1 . 1 17 17 VAL HG22 H 1 0.7530 0.0000 . 2 . . 92217 . . 244 VAL HG21 . 53199 1 70 . 1 . 1 17 17 VAL HG23 H 1 0.7530 0.0000 . 2 . . 92217 . . 244 VAL HG21 . 53199 1 71 . 1 . 1 17 17 VAL C C 13 174.0564 0.0000 . 1 . . 94278 . . 244 VAL C . 53199 1 72 . 1 . 1 17 17 VAL CA C 13 60.1655 0.0000 . 1 . . 93345 . . 244 VAL CA . 53199 1 73 . 1 . 1 17 17 VAL CB C 13 34.1103 0.0000 . 1 . . 93355 . . 244 VAL CB . 53199 1 74 . 1 . 1 17 17 VAL CG1 C 13 21.5310 0.0000 . 2 . . 87438 . . 244 VAL CG1 . 53199 1 75 . 1 . 1 17 17 VAL CG2 C 13 22.5220 0.0000 . 2 . . 87438 . . 244 VAL CG2 . 53199 1 76 . 1 . 1 17 17 VAL N N 15 122.0423 0.0000 . 1 . . 38129 . . 244 VAL N . 53199 1 77 . 1 . 1 18 18 PHE H H 1 9.3626 0.0000 . 1 . . 33930 . . 245 PHE H . 53199 1 78 . 1 . 1 18 18 PHE C C 13 172.8062 0.0000 . 1 . . 45796 . . 245 PHE C . 53199 1 79 . 1 . 1 18 18 PHE CA C 13 55.7407 0.0000 . 1 . . 45799 . . 245 PHE CA . 53199 1 80 . 1 . 1 18 18 PHE CB C 13 43.0459 0.0000 . 1 . . 45801 . . 245 PHE CB . 53199 1 81 . 1 . 1 18 18 PHE CG C 13 0.0000 0.0000 . 1 . . . . . 245 PHE CG . 53199 1 82 . 1 . 1 18 18 PHE N N 15 125.6186 0.0000 . 1 . . 33932 . . 245 PHE N . 53199 1 83 . 1 . 1 19 19 LEU H H 1 8.1544 0.0000 . 1 . . 31656 . . 246 LEU H . 53199 1 84 . 1 . 1 19 19 LEU HD11 H 1 1.0110 0.0000 . 2 . . . . . 246 LEU HD11 . 53199 1 85 . 1 . 1 19 19 LEU HD12 H 1 1.0110 0.0000 . 2 . . . . . 246 LEU HD11 . 53199 1 86 . 1 . 1 19 19 LEU HD13 H 1 1.0110 0.0000 . 2 . . . . . 246 LEU HD11 . 53199 1 87 . 1 . 1 19 19 LEU HD21 H 1 0.8240 0.0000 . 2 . . . . . 246 LEU HD21 . 53199 1 88 . 1 . 1 19 19 LEU HD22 H 1 0.8240 0.0000 . 2 . . . . . 246 LEU HD21 . 53199 1 89 . 1 . 1 19 19 LEU HD23 H 1 0.8240 0.0000 . 2 . . . . . 246 LEU HD21 . 53199 1 90 . 1 . 1 19 19 LEU C C 13 174.7764 0.0000 . 1 . . 75120 . . 246 LEU C . 53199 1 91 . 1 . 1 19 19 LEU CA C 13 53.1489 0.0000 . 1 . . 40687 . . 246 LEU CA . 53199 1 92 . 1 . 1 19 19 LEU CB C 13 44.7198 0.0000 . 1 . . 75124 . . 246 LEU CB . 53199 1 93 . 1 . 1 19 19 LEU CD1 C 13 24.7690 0.0000 . 2 . . 87468 . . 246 LEU CD1 . 53199 1 94 . 1 . 1 19 19 LEU CD2 C 13 27.5600 0.0000 . 2 . . 92890 . . 246 LEU CD2 . 53199 1 95 . 1 . 1 19 19 LEU N N 15 124.0914 0.0000 . 1 . . 31658 . . 246 LEU N . 53199 1 96 . 1 . 1 20 20 PHE H H 1 9.2951 0.0000 . 1 . . 37983 . . 247 PHE H . 53199 1 97 . 1 . 1 20 20 PHE C C 13 173.6517 0.0000 . 1 . . 46572 . . 247 PHE C . 53199 1 98 . 1 . 1 20 20 PHE CA C 13 54.9628 0.0000 . 1 . . 46575 . . 247 PHE CA . 53199 1 99 . 1 . 1 20 20 PHE CB C 13 41.0252 0.0000 . 1 . . 46576 . . 247 PHE CB . 53199 1 100 . 1 . 1 20 20 PHE N N 15 125.0583 0.0000 . 1 . . 37985 . . 247 PHE N . 53199 1 101 . 1 . 1 24 24 PRO C C 13 178.9355 0.0000 . 1 . . 57638 . . 251 PRO C . 53199 1 102 . 1 . 1 24 24 PRO CA C 13 65.1169 0.0000 . 1 . . 57640 . . 251 PRO CA . 53199 1 103 . 1 . 1 24 24 PRO CB C 13 31.5954 0.0000 . 1 . . 57645 . . 251 PRO CB . 53199 1 104 . 1 . 1 25 25 LYS H H 1 8.7719 0.0000 . 1 . . 32718 . . 252 LYS H . 53199 1 105 . 1 . 1 25 25 LYS C C 13 177.1077 0.0000 . 1 . . 75142 . . 252 LYS C . 53199 1 106 . 1 . 1 25 25 LYS CA C 13 60.0234 0.0000 . 1 . . 57644 . . 252 LYS CA . 53199 1 107 . 1 . 1 25 25 LYS CB C 13 32.4214 0.0000 . 1 . . 57648 . . 252 LYS CB . 53199 1 108 . 1 . 1 25 25 LYS N N 15 115.9984 0.0000 . 1 . . 32720 . . 252 LYS N . 53199 1 109 . 1 . 1 26 26 ASP H H 1 6.7671 0.0000 . 1 . . 38433 . . 253 ASP H . 53199 1 110 . 1 . 1 26 26 ASP C C 13 176.1684 0.0000 . 1 . . 64314 . . 253 ASP C . 53199 1 111 . 1 . 1 26 26 ASP CA C 13 55.7381 0.0000 . 1 . . 64315 . . 253 ASP CA . 53199 1 112 . 1 . 1 26 26 ASP CB C 13 39.7469 0.0000 . 1 . . 64321 . . 253 ASP CB . 53199 1 113 . 1 . 1 26 26 ASP N N 15 114.2205 0.0000 . 1 . . 38435 . . 253 ASP N . 53199 1 114 . 1 . 1 27 27 THR H H 1 7.0800 0.0000 . 1 . . 32967 . . 254 THR H . 53199 1 115 . 1 . 1 27 27 THR HG21 H 1 0.6720 0.0000 . 1 . . . . . 254 THR HG21 . 53199 1 116 . 1 . 1 27 27 THR HG22 H 1 0.6720 0.0000 . 1 . . . . . 254 THR HG21 . 53199 1 117 . 1 . 1 27 27 THR HG23 H 1 0.6720 0.0000 . 1 . . . . . 254 THR HG21 . 53199 1 118 . 1 . 1 27 27 THR C C 13 175.4958 0.0000 . 1 . . 64318 . . 254 THR C . 53199 1 119 . 1 . 1 27 27 THR CA C 13 63.3810 0.0000 . 1 . . 64316 . . 254 THR CA . 53199 1 120 . 1 . 1 27 27 THR CB C 13 68.7704 0.0000 . 1 . . 64320 . . 254 THR CB . 53199 1 121 . 1 . 1 27 27 THR CG2 C 13 22.5960 0.0000 . 1 . . 87399 . . 254 THR CG2 . 53199 1 122 . 1 . 1 27 27 THR N N 15 105.5695 0.0000 . 1 . . 32969 . . 254 THR N . 53199 1 123 . 1 . 1 28 28 LEU H H 1 7.1337 0.0000 . 1 . . 31209 . . 255 LEU H . 53199 1 124 . 1 . 1 28 28 LEU HD11 H 1 0.1190 0.0000 . 2 . . 99398 . . 255 LEU HD11 . 53199 1 125 . 1 . 1 28 28 LEU HD12 H 1 0.1190 0.0000 . 2 . . 99398 . . 255 LEU HD11 . 53199 1 126 . 1 . 1 28 28 LEU HD13 H 1 0.1190 0.0000 . 2 . . 99398 . . 255 LEU HD11 . 53199 1 127 . 1 . 1 28 28 LEU HD21 H 1 0.4220 0.0000 . 2 . . 99398 . . 255 LEU HD21 . 53199 1 128 . 1 . 1 28 28 LEU HD22 H 1 0.4220 0.0000 . 2 . . 99398 . . 255 LEU HD21 . 53199 1 129 . 1 . 1 28 28 LEU HD23 H 1 0.4220 0.0000 . 2 . . 99398 . . 255 LEU HD21 . 53199 1 130 . 1 . 1 28 28 LEU C C 13 176.9615 0.0000 . 1 . . 56728 . . 255 LEU C . 53199 1 131 . 1 . 1 28 28 LEU CA C 13 54.5488 0.0000 . 1 . . 56729 . . 255 LEU CA . 53199 1 132 . 1 . 1 28 28 LEU CB C 13 42.5303 0.0000 . 1 . . 56730 . . 255 LEU CB . 53199 1 133 . 1 . 1 28 28 LEU CD1 C 13 20.6350 0.0000 . 2 . . 87588 . . 255 LEU CD1 . 53199 1 134 . 1 . 1 28 28 LEU CD2 C 13 24.9470 0.0000 . 2 . . 87243 . . 255 LEU CD2 . 53199 1 135 . 1 . 1 28 28 LEU N N 15 117.9563 0.0000 . 1 . . 31211 . . 255 LEU N . 53199 1 136 . 1 . 1 29 29 MET H H 1 7.2069 0.0000 . 1 . . 38250 . . 256 MET H . 53199 1 137 . 1 . 1 29 29 MET C C 13 176.0664 0.0000 . 1 . . 75369 . . 256 MET C . 53199 1 138 . 1 . 1 29 29 MET CA C 13 53.9706 0.0000 . 1 . . 75372 . . 256 MET CA . 53199 1 139 . 1 . 1 29 29 MET CB C 13 33.6542 0.0000 . 1 . . 75384 . . 256 MET CB . 53199 1 140 . 1 . 1 29 29 MET N N 15 119.5110 0.0000 . 1 . . 38252 . . 256 MET N . 53199 1 141 . 1 . 1 30 30 ILE H H 1 8.1890 0.0000 . 1 . . 31002 . . 257 ILE H . 53199 1 142 . 1 . 1 30 30 ILE HG21 H 1 0.7250 0.0000 . 1 . . 91869 . . 257 ILE HG21 . 53199 1 143 . 1 . 1 30 30 ILE HG22 H 1 0.7250 0.0000 . 1 . . 91869 . . 257 ILE HG21 . 53199 1 144 . 1 . 1 30 30 ILE HG23 H 1 0.7250 0.0000 . 1 . . 91869 . . 257 ILE HG21 . 53199 1 145 . 1 . 1 30 30 ILE HD11 H 1 0.6230 0.0000 . 1 . . 91869 . . 257 ILE HD11 . 53199 1 146 . 1 . 1 30 30 ILE HD12 H 1 0.6230 0.0000 . 1 . . 91869 . . 257 ILE HD11 . 53199 1 147 . 1 . 1 30 30 ILE HD13 H 1 0.6230 0.0000 . 1 . . 91869 . . 257 ILE HD11 . 53199 1 148 . 1 . 1 30 30 ILE C C 13 175.0557 0.0000 . 1 . . 75379 . . 257 ILE C . 53199 1 149 . 1 . 1 30 30 ILE CA C 13 61.9802 0.0000 . 1 . . 75386 . . 257 ILE CA . 53199 1 150 . 1 . 1 30 30 ILE CB C 13 37.2322 0.0000 . 1 . . 75382 . . 257 ILE CB . 53199 1 151 . 1 . 1 30 30 ILE CG2 C 13 17.3900 0.0000 . 1 . . 87825 . . 257 ILE CG2 . 53199 1 152 . 1 . 1 30 30 ILE CD1 C 13 12.7380 0.0000 . 1 . . 88053 . . 257 ILE CD1 . 53199 1 153 . 1 . 1 30 30 ILE N N 15 123.2570 0.0000 . 1 . . 31004 . . 257 ILE N . 53199 1 154 . 1 . 1 31 31 SER H H 1 7.5472 0.0000 . 1 . . 32874 . . 258 SER H . 53199 1 155 . 1 . 1 31 31 SER C C 13 174.6282 0.0000 . 1 . . 67826 . . 258 SER C . 53199 1 156 . 1 . 1 31 31 SER CA C 13 58.1101 0.0000 . 1 . . 67822 . . 258 SER CA . 53199 1 157 . 1 . 1 31 31 SER CB C 13 62.7099 0.0000 . 1 . . 67830 . . 258 SER CB . 53199 1 158 . 1 . 1 31 31 SER N N 15 112.5951 0.0000 . 1 . . 32876 . . 258 SER N . 53199 1 159 . 1 . 1 32 32 ARG H H 1 7.6957 0.0000 . 1 . . 38079 . . 259 ARG H . 53199 1 160 . 1 . 1 32 32 ARG C C 13 175.4690 0.0000 . 1 . . 67810 . . 259 ARG C . 53199 1 161 . 1 . 1 32 32 ARG CA C 13 54.4499 0.0000 . 1 . . 67808 . . 259 ARG CA . 53199 1 162 . 1 . 1 32 32 ARG CB C 13 31.4019 0.0000 . 1 . . 67814 . . 259 ARG CB . 53199 1 163 . 1 . 1 32 32 ARG N N 15 123.0452 0.0000 . 1 . . 38081 . . 259 ARG N . 53199 1 164 . 1 . 1 33 33 THR H H 1 8.3824 0.0000 . 1 . . 38361 . . 260 THR H . 53199 1 165 . 1 . 1 33 33 THR C C 13 175.9077 0.0000 . 1 . . 75357 . . 260 THR C . 53199 1 166 . 1 . 1 33 33 THR CA C 13 58.7646 0.0000 . 1 . . 75363 . . 260 THR CA . 53199 1 167 . 1 . 1 33 33 THR CB C 13 69.8986 0.0000 . 1 . . 75358 . . 260 THR CB . 53199 1 168 . 1 . 1 33 33 THR N N 15 116.1043 0.0000 . 1 . . 38363 . . 260 THR N . 53199 1 169 . 1 . 1 34 34 PRO C C 13 174.6865 0.0000 . 1 . . 76495 . . 261 PRO C . 53199 1 170 . 1 . 1 34 34 PRO CA C 13 60.8574 0.0000 . 1 . . 76485 . . 261 PRO CA . 53199 1 171 . 1 . 1 34 34 PRO CB C 13 30.7120 0.0000 . 1 . . 56650 . . 261 PRO CB . 53199 1 172 . 1 . 1 35 35 GLU H H 1 7.7258 0.0000 . 1 . . 38307 . . 262 GLU H . 53199 1 173 . 1 . 1 35 35 GLU C C 13 175.3029 0.0000 . 1 . . 56643 . . 262 GLU C . 53199 1 174 . 1 . 1 35 35 GLU CA C 13 53.8337 0.0000 . 1 . . 56646 . . 262 GLU CA . 53199 1 175 . 1 . 1 35 35 GLU CB C 13 32.5695 0.0000 . 1 . . 56647 . . 262 GLU CB . 53199 1 176 . 1 . 1 35 35 GLU N N 15 118.1508 0.0000 . 1 . . 38309 . . 262 GLU N . 53199 1 177 . 1 . 1 36 36 VAL H H 1 8.4463 0.0000 . 1 . . 34221 . . 263 VAL H . 53199 1 178 . 1 . 1 36 36 VAL HG11 H 1 0.4920 0.0000 . 2 . . 91998 . . 263 VAL HG11 . 53199 1 179 . 1 . 1 36 36 VAL HG12 H 1 0.4920 0.0000 . 2 . . 91998 . . 263 VAL HG11 . 53199 1 180 . 1 . 1 36 36 VAL HG13 H 1 0.4920 0.0000 . 2 . . 91998 . . 263 VAL HG11 . 53199 1 181 . 1 . 1 36 36 VAL HG21 H 1 0.9200 0.0000 . 2 . . 91845 . . 263 VAL HG21 . 53199 1 182 . 1 . 1 36 36 VAL HG22 H 1 0.9200 0.0000 . 2 . . 91845 . . 263 VAL HG21 . 53199 1 183 . 1 . 1 36 36 VAL HG23 H 1 0.9200 0.0000 . 2 . . 91845 . . 263 VAL HG21 . 53199 1 184 . 1 . 1 36 36 VAL C C 13 174.8540 0.0000 . 1 . . 93915 . . 263 VAL C . 53199 1 185 . 1 . 1 36 36 VAL CA C 13 60.4429 0.0000 . 1 . . 93911 . . 263 VAL CA . 53199 1 186 . 1 . 1 36 36 VAL CB C 13 32.5790 0.0000 . 1 . . 93952 . . 263 VAL CB . 53199 1 187 . 1 . 1 36 36 VAL CG1 C 13 21.9040 0.0000 . 2 . . 87432 . . 263 VAL CG1 . 53199 1 188 . 1 . 1 36 36 VAL CG2 C 13 23.0460 0.0000 . 2 . . 92827 . . 263 VAL CG2 . 53199 1 189 . 1 . 1 36 36 VAL N N 15 120.8467 0.0000 . 1 . . 34223 . . 263 VAL N . 53199 1 190 . 1 . 1 37 37 THR H H 1 7.8643 0.0000 . 1 . . 38244 . . 264 THR H . 53199 1 191 . 1 . 1 37 37 THR HG21 H 1 1.0700 0.0000 . 1 . . 91794 . . 264 THR HG21 . 53199 1 192 . 1 . 1 37 37 THR HG22 H 1 1.0700 0.0000 . 1 . . 91794 . . 264 THR HG21 . 53199 1 193 . 1 . 1 37 37 THR HG23 H 1 1.0700 0.0000 . 1 . . 91794 . . 264 THR HG21 . 53199 1 194 . 1 . 1 37 37 THR C C 13 172.1522 0.0000 . 1 . . 54705 . . 264 THR C . 53199 1 195 . 1 . 1 37 37 THR CA C 13 62.0417 0.0000 . 1 . . 54708 . . 264 THR CA . 53199 1 196 . 1 . 1 37 37 THR CB C 13 70.3312 0.0000 . 1 . . 54707 . . 264 THR CB . 53199 1 197 . 1 . 1 37 37 THR CG2 C 13 21.5810 0.0000 . 1 . . 87456 . . 264 THR CG2 . 53199 1 198 . 1 . 1 37 37 THR N N 15 119.7834 0.0000 . 1 . . 38246 . . 264 THR N . 53199 1 199 . 1 . 1 38 38 CYS H H 1 9.9254 0.0000 . 1 . . 32142 . . 265 CYS H . 53199 1 200 . 1 . 1 38 38 CYS C C 13 171.7834 0.0000 . 1 . . 42854 . . 265 CYS C . 53199 1 201 . 1 . 1 38 38 CYS CA C 13 53.5482 0.0000 . 1 . . 42855 . . 265 CYS CA . 53199 1 202 . 1 . 1 38 38 CYS CB C 13 43.7587 0.0000 . 1 . . 42852 . . 265 CYS CB . 53199 1 203 . 1 . 1 38 38 CYS N N 15 130.6739 0.0000 . 1 . . 32144 . . 265 CYS N . 53199 1 204 . 1 . 1 39 39 VAL H H 1 9.4497 0.0000 . 1 . . 37914 . . 266 VAL H . 53199 1 205 . 1 . 1 39 39 VAL HG11 H 1 1.0960 0.0000 . 2 . . 92905 . . 266 VAL HG11 . 53199 1 206 . 1 . 1 39 39 VAL HG12 H 1 1.0960 0.0000 . 2 . . 92905 . . 266 VAL HG11 . 53199 1 207 . 1 . 1 39 39 VAL HG13 H 1 1.0960 0.0000 . 2 . . 92905 . . 266 VAL HG11 . 53199 1 208 . 1 . 1 39 39 VAL HG21 H 1 0.9760 0.0000 . 2 . . 92905 . . 266 VAL HG21 . 53199 1 209 . 1 . 1 39 39 VAL HG22 H 1 0.9760 0.0000 . 2 . . 92905 . . 266 VAL HG21 . 53199 1 210 . 1 . 1 39 39 VAL HG23 H 1 0.9760 0.0000 . 2 . . 92905 . . 266 VAL HG21 . 53199 1 211 . 1 . 1 39 39 VAL C C 13 173.7818 0.0000 . 1 . . 40234 . . 266 VAL C . 53199 1 212 . 1 . 1 39 39 VAL CA C 13 61.0919 0.0000 . 1 . . 40235 . . 266 VAL CA . 53199 1 213 . 1 . 1 39 39 VAL CB C 13 34.6091 0.0000 . 1 . . 40237 . . 266 VAL CB . 53199 1 214 . 1 . 1 39 39 VAL CG1 C 13 22.0000 0.0000 . 2 . . 92833 . . 266 VAL CG1 . 53199 1 215 . 1 . 1 39 39 VAL CG2 C 13 21.0040 0.0000 . 2 . . 92830 . . 266 VAL CG2 . 53199 1 216 . 1 . 1 39 39 VAL N N 15 127.2604 0.0000 . 1 . . 37916 . . 266 VAL N . 53199 1 217 . 1 . 1 40 40 VAL H H 1 9.2604 0.0000 . 1 . . 37896 . . 267 VAL H . 53199 1 218 . 1 . 1 40 40 VAL HG11 H 1 1.0110 0.0000 . 2 . . . . . 267 VAL HG11 . 53199 1 219 . 1 . 1 40 40 VAL HG12 H 1 1.0110 0.0000 . 2 . . . . . 267 VAL HG11 . 53199 1 220 . 1 . 1 40 40 VAL HG13 H 1 1.0110 0.0000 . 2 . . . . . 267 VAL HG11 . 53199 1 221 . 1 . 1 40 40 VAL HG21 H 1 0.8020 0.0000 . 2 . . . . . 267 VAL HG21 . 53199 1 222 . 1 . 1 40 40 VAL HG22 H 1 0.8020 0.0000 . 2 . . . . . 267 VAL HG21 . 53199 1 223 . 1 . 1 40 40 VAL HG23 H 1 0.8020 0.0000 . 2 . . . . . 267 VAL HG21 . 53199 1 224 . 1 . 1 40 40 VAL C C 13 174.8834 0.0000 . 1 . . 43159 . . 267 VAL C . 53199 1 225 . 1 . 1 40 40 VAL CA C 13 59.5833 0.0000 . 1 . . 43163 . . 267 VAL CA . 53199 1 226 . 1 . 1 40 40 VAL CB C 13 32.5876 0.0000 . 1 . . 43160 . . 267 VAL CB . 53199 1 227 . 1 . 1 40 40 VAL CG1 C 13 22.0060 0.0000 . 2 . . . . . 267 VAL CG1 . 53199 1 228 . 1 . 1 40 40 VAL CG2 C 13 21.0790 0.0000 . 2 . . . . . 267 VAL CG2 . 53199 1 229 . 1 . 1 40 40 VAL N N 15 127.5567 0.0000 . 1 . . 37898 . . 267 VAL N . 53199 1 230 . 1 . 1 50 50 VAL HG11 H 1 0.3370 0.0000 . 2 . . 92908 . . 277 VAL HG11 . 53199 1 231 . 1 . 1 50 50 VAL HG12 H 1 0.3370 0.0000 . 2 . . 92908 . . 277 VAL HG11 . 53199 1 232 . 1 . 1 50 50 VAL HG13 H 1 0.3370 0.0000 . 2 . . 92908 . . 277 VAL HG11 . 53199 1 233 . 1 . 1 50 50 VAL HG21 H 1 1.0610 0.0000 . 2 . . 91602 . . 277 VAL HG21 . 53199 1 234 . 1 . 1 50 50 VAL HG22 H 1 1.0610 0.0000 . 2 . . 91602 . . 277 VAL HG21 . 53199 1 235 . 1 . 1 50 50 VAL HG23 H 1 1.0610 0.0000 . 2 . . 91602 . . 277 VAL HG21 . 53199 1 236 . 1 . 1 50 50 VAL C C 13 174.2646 0.0000 . 1 . . 93603 . . 277 VAL C . 53199 1 237 . 1 . 1 50 50 VAL CA C 13 60.6175 0.0000 . 1 . . 93595 . . 277 VAL CA . 53199 1 238 . 1 . 1 50 50 VAL CB C 13 33.6782 0.0000 . 1 . . 67477 . . 277 VAL CB . 53199 1 239 . 1 . 1 50 50 VAL CG1 C 13 22.7900 0.0000 . 2 . . . . . 277 VAL CG1 . 53199 1 240 . 1 . 1 50 50 VAL CG2 C 13 25.1500 0.0000 . 2 . . . . . 277 VAL CG2 . 53199 1 241 . 1 . 1 51 51 LYS H H 1 8.1756 0.0000 . 1 . . 37929 . . 278 LYS H . 53199 1 242 . 1 . 1 51 51 LYS C C 13 174.5685 0.0000 . 1 . . 67473 . . 278 LYS C . 53199 1 243 . 1 . 1 51 51 LYS CA C 13 53.9519 0.0000 . 1 . . 67474 . . 278 LYS CA . 53199 1 244 . 1 . 1 51 51 LYS N N 15 126.6479 0.0000 . 1 . . 37931 . . 278 LYS N . 53199 1 245 . 1 . 1 52 52 PHE H H 1 8.5992 0.0000 . 1 . . 38121 . . 279 PHE H . 53199 1 246 . 1 . 1 52 52 PHE C C 13 176.4137 0.0000 . 1 . . 49939 . . 279 PHE C . 53199 1 247 . 1 . 1 52 52 PHE CA C 13 56.7668 0.0000 . 1 . . 49947 . . 279 PHE CA . 53199 1 248 . 1 . 1 52 52 PHE CB C 13 41.3107 0.0000 . 1 . . 49943 . . 279 PHE CB . 53199 1 249 . 1 . 1 52 52 PHE N N 15 122.2566 0.0000 . 1 . . 38123 . . 279 PHE N . 53199 1 250 . 1 . 1 53 53 ASN H H 1 9.1955 0.0000 . 1 . . 38175 . . 280 ASN H . 53199 1 251 . 1 . 1 53 53 ASN C C 13 171.9172 0.0000 . 1 . . 50994 . . 280 ASN C . 53199 1 252 . 1 . 1 53 53 ASN CA C 13 53.3628 0.0000 . 1 . . 50997 . . 280 ASN CA . 53199 1 253 . 1 . 1 53 53 ASN CB C 13 42.7295 0.0000 . 1 . . 50995 . . 280 ASN CB . 53199 1 254 . 1 . 1 53 53 ASN N N 15 121.1189 0.0000 . 1 . . 38177 . . 280 ASN N . 53199 1 255 . 1 . 1 54 54 TRP H H 1 8.7498 0.0000 . 1 . . 67280 . . 281 TRP H . 53199 1 256 . 1 . 1 54 54 TRP C C 13 175.4461 0.0000 . 1 . . 56956 . . 281 TRP C . 53199 1 257 . 1 . 1 54 54 TRP CA C 13 55.4120 0.0000 . 1 . . 56957 . . 281 TRP CA . 53199 1 258 . 1 . 1 54 54 TRP CB C 13 34.2865 0.0000 . 1 . . 56963 . . 281 TRP CB . 53199 1 259 . 1 . 1 54 54 TRP N N 15 123.3087 0.0000 . 1 . . 67282 . . 281 TRP N . 53199 1 260 . 1 . 1 55 55 TYR H H 1 9.1705 0.0000 . 1 . . 38325 . . 282 TYR H . 53199 1 261 . 1 . 1 55 55 TYR C C 13 175.0242 0.0000 . 1 . . 56960 . . 282 TYR C . 53199 1 262 . 1 . 1 55 55 TYR CA C 13 55.2246 0.0000 . 1 . . 56967 . . 282 TYR CA . 53199 1 263 . 1 . 1 55 55 TYR CB C 13 41.2882 0.0000 . 1 . . 56962 . . 282 TYR CB . 53199 1 264 . 1 . 1 55 55 TYR N N 15 117.2771 0.0000 . 1 . . 38327 . . 282 TYR N . 53199 1 265 . 1 . 1 56 56 VAL H H 1 8.8598 0.0000 . 1 . . 38118 . . 283 VAL H . 53199 1 266 . 1 . 1 56 56 VAL HG11 H 1 0.5290 0.0000 . 2 . . 91995 . . 283 VAL HG11 . 53199 1 267 . 1 . 1 56 56 VAL HG12 H 1 0.5290 0.0000 . 2 . . 91995 . . 283 VAL HG11 . 53199 1 268 . 1 . 1 56 56 VAL HG13 H 1 0.5290 0.0000 . 2 . . 91995 . . 283 VAL HG11 . 53199 1 269 . 1 . 1 56 56 VAL HG21 H 1 0.9920 0.0000 . 2 . . 92911 . . 283 VAL HG21 . 53199 1 270 . 1 . 1 56 56 VAL HG22 H 1 0.9920 0.0000 . 2 . . 92911 . . 283 VAL HG21 . 53199 1 271 . 1 . 1 56 56 VAL HG23 H 1 0.9920 0.0000 . 2 . . 92911 . . 283 VAL HG21 . 53199 1 272 . 1 . 1 56 56 VAL C C 13 176.9243 0.0000 . 1 . . 49816 . . 283 VAL C . 53199 1 273 . 1 . 1 56 56 VAL CA C 13 60.7561 0.0000 . 1 . . 49818 . . 283 VAL CA . 53199 1 274 . 1 . 1 56 56 VAL CB C 13 32.3979 0.0000 . 1 . . 49820 . . 283 VAL CB . 53199 1 275 . 1 . 1 56 56 VAL CG1 C 13 20.3840 0.0000 . 2 . . 92848 . . 283 VAL CG1 . 53199 1 276 . 1 . 1 56 56 VAL CG2 C 13 21.1600 0.0000 . 2 . . 92848 . . 283 VAL CG2 . 53199 1 277 . 1 . 1 56 56 VAL N N 15 122.2731 0.0000 . 1 . . 38120 . . 283 VAL N . 53199 1 278 . 1 . 1 57 57 ASP H H 1 9.8365 0.0000 . 1 . . 37842 . . 284 ASP H . 53199 1 279 . 1 . 1 57 57 ASP C C 13 176.1613 0.0000 . 1 . . 39961 . . 284 ASP C . 53199 1 280 . 1 . 1 57 57 ASP CA C 13 55.2091 0.0000 . 1 . . 39962 . . 284 ASP CA . 53199 1 281 . 1 . 1 57 57 ASP CB C 13 39.5873 0.0000 . 1 . . 39958 . . 284 ASP CB . 53199 1 282 . 1 . 1 57 57 ASP N N 15 131.8272 0.0000 . 1 . . 37844 . . 284 ASP N . 53199 1 283 . 1 . 1 58 58 GLY H H 1 8.9768 0.0000 . 1 . . 38607 . . 285 GLY H . 53199 1 284 . 1 . 1 58 58 GLY C C 13 173.8131 0.0000 . 1 . . 64462 . . 285 GLY C . 53199 1 285 . 1 . 1 58 58 GLY CA C 13 45.1343 0.0000 . 1 . . 64464 . . 285 GLY CA . 53199 1 286 . 1 . 1 58 58 GLY N N 15 102.6336 0.0000 . 1 . . 38609 . . 285 GLY N . 53199 1 287 . 1 . 1 59 59 VAL H H 1 7.8868 0.0000 . 1 . . 38001 . . 286 VAL H . 53199 1 288 . 1 . 1 59 59 VAL HG11 H 1 1.0030 0.0000 . 2 . . 92914 . . 286 VAL HG11 . 53199 1 289 . 1 . 1 59 59 VAL HG12 H 1 1.0030 0.0000 . 2 . . 92914 . . 286 VAL HG11 . 53199 1 290 . 1 . 1 59 59 VAL HG13 H 1 1.0030 0.0000 . 2 . . 92914 . . 286 VAL HG11 . 53199 1 291 . 1 . 1 59 59 VAL HG21 H 1 0.9640 0.0000 . 2 . . 92914 . . 286 VAL HG21 . 53199 1 292 . 1 . 1 59 59 VAL HG22 H 1 0.9640 0.0000 . 2 . . 92914 . . 286 VAL HG21 . 53199 1 293 . 1 . 1 59 59 VAL HG23 H 1 0.9640 0.0000 . 2 . . 92914 . . 286 VAL HG21 . 53199 1 294 . 1 . 1 59 59 VAL C C 13 175.6256 0.0000 . 1 . . 40626 . . 286 VAL C . 53199 1 295 . 1 . 1 59 59 VAL CA C 13 61.5356 0.0000 . 1 . . 40625 . . 286 VAL CA . 53199 1 296 . 1 . 1 59 59 VAL CB C 13 32.4323 0.0000 . 1 . . 40629 . . 286 VAL CB . 53199 1 297 . 1 . 1 59 59 VAL CG1 C 13 20.9010 0.0000 . 2 . . 87510 . . 286 VAL CG1 . 53199 1 298 . 1 . 1 59 59 VAL CG2 C 13 21.6300 0.0000 . 2 . . 92851 . . 286 VAL CG2 . 53199 1 299 . 1 . 1 59 59 VAL N N 15 124.3852 0.0000 . 1 . . 38003 . . 286 VAL N . 53199 1 300 . 1 . 1 60 60 GLU H H 1 8.8410 0.0000 . 1 . . 37857 . . 287 GLU H . 53199 1 301 . 1 . 1 60 60 GLU C C 13 176.3622 0.0000 . 1 . . 40015 . . 287 GLU C . 53199 1 302 . 1 . 1 60 60 GLU CA C 13 57.0129 0.0000 . 1 . . 40011 . . 287 GLU CA . 53199 1 303 . 1 . 1 60 60 GLU CB C 13 28.2657 0.0000 . 1 . . 40019 . . 287 GLU CB . 53199 1 304 . 1 . 1 60 60 GLU N N 15 129.7770 0.0000 . 1 . . 37859 . . 287 GLU N . 53199 1 305 . 1 . 1 61 61 VAL H H 1 8.1429 0.0000 . 1 . . 31878 . . 288 VAL H . 53199 1 306 . 1 . 1 61 61 VAL HG11 H 1 0.9820 0.0000 . 2 . . 91581 . . 288 VAL HG11 . 53199 1 307 . 1 . 1 61 61 VAL HG12 H 1 0.9820 0.0000 . 2 . . 91581 . . 288 VAL HG11 . 53199 1 308 . 1 . 1 61 61 VAL HG13 H 1 0.9820 0.0000 . 2 . . 91581 . . 288 VAL HG11 . 53199 1 309 . 1 . 1 61 61 VAL HG21 H 1 0.7740 0.0000 . 2 . . 91581 . . 288 VAL HG21 . 53199 1 310 . 1 . 1 61 61 VAL HG22 H 1 0.7740 0.0000 . 2 . . 91581 . . 288 VAL HG21 . 53199 1 311 . 1 . 1 61 61 VAL HG23 H 1 0.7740 0.0000 . 2 . . 91581 . . 288 VAL HG21 . 53199 1 312 . 1 . 1 61 61 VAL C C 13 176.8354 0.0000 . 1 . . 66240 . . 288 VAL C . 53199 1 313 . 1 . 1 61 61 VAL CA C 13 59.2346 0.0000 . 1 . . 66243 . . 288 VAL CA . 53199 1 314 . 1 . 1 61 61 VAL CG1 C 13 21.3550 0.0000 . 2 . . 99371 . . 288 VAL CG1 . 53199 1 315 . 1 . 1 61 61 VAL CG2 C 13 19.5480 0.0000 . 2 . . 107242 . . 288 VAL CG2 . 53199 1 316 . 1 . 1 61 61 VAL N N 15 119.5396 0.0000 . 1 . . 31880 . . 288 VAL N . 53199 1 317 . 1 . 1 62 62 HIS H H 1 8.7634 0.0000 . 1 . . 32682 . . 289 HIS H . 53199 1 318 . 1 . 1 62 62 HIS C C 13 174.7812 0.0000 . 1 . . 66248 . . 289 HIS C . 53199 1 319 . 1 . 1 62 62 HIS CA C 13 55.7145 0.0000 . 1 . . 66250 . . 289 HIS CA . 53199 1 320 . 1 . 1 62 62 HIS CB C 13 29.4564 0.0000 . 1 . . 66249 . . 289 HIS CB . 53199 1 321 . 1 . 1 62 62 HIS N N 15 118.2922 0.0000 . 1 . . 32684 . . 289 HIS N . 53199 1 322 . 1 . 1 63 63 ASN H H 1 8.0830 0.0000 . 1 . . 32709 . . 290 ASN H . 53199 1 323 . 1 . 1 63 63 ASN C C 13 174.8691 0.0000 . 1 . . 57328 . . 290 ASN C . 53199 1 324 . 1 . 1 63 63 ASN CA C 13 52.5418 0.0000 . 1 . . 57326 . . 290 ASN CA . 53199 1 325 . 1 . 1 63 63 ASN CB C 13 36.9798 0.0000 . 1 . . 57322 . . 290 ASN CB . 53199 1 326 . 1 . 1 63 63 ASN N N 15 116.2768 0.0000 . 1 . . 32711 . . 290 ASN N . 53199 1 327 . 1 . 1 64 64 ALA H H 1 7.9768 0.0000 . 1 . . 38010 . . 291 ALA H . 53199 1 328 . 1 . 1 64 64 ALA HB1 H 1 0.8970 0.0000 . 1 . . 91695 . . 291 ALA HB1 . 53199 1 329 . 1 . 1 64 64 ALA HB2 H 1 0.8970 0.0000 . 1 . . 91695 . . 291 ALA HB1 . 53199 1 330 . 1 . 1 64 64 ALA HB3 H 1 0.8970 0.0000 . 1 . . 91695 . . 291 ALA HB1 . 53199 1 331 . 1 . 1 64 64 ALA C C 13 176.9797 0.0000 . 1 . . 47166 . . 291 ALA C . 53199 1 332 . 1 . 1 64 64 ALA CA C 13 52.3162 0.0000 . 1 . . 47163 . . 291 ALA CA . 53199 1 333 . 1 . 1 64 64 ALA CB C 13 19.8567 0.0000 . 1 . . 47164 . . 291 ALA CB . 53199 1 334 . 1 . 1 64 64 ALA N N 15 124.1853 0.0000 . 1 . . 38012 . . 291 ALA N . 53199 1 335 . 1 . 1 65 65 LYS H H 1 8.4689 0.0000 . 1 . . 69246 . . 292 LYS H . 53199 1 336 . 1 . 1 65 65 LYS C C 13 175.6363 0.0000 . 1 . . . . . 292 LYS C . 53199 1 337 . 1 . 1 65 65 LYS CA C 13 54.6803 0.0000 . 1 . . . . . 292 LYS CA . 53199 1 338 . 1 . 1 65 65 LYS CB C 13 33.7800 0.0000 . 1 . . 98664 . . 292 LYS CB . 53199 1 339 . 1 . 1 65 65 LYS N N 15 121.0813 0.0000 . 1 . . 69248 . . 292 LYS N . 53199 1 340 . 1 . 1 68 68 PRO C C 13 177.4242 0.0000 . 1 . . 48523 . . 295 PRO C . 53199 1 341 . 1 . 1 68 68 PRO CA C 13 62.6104 0.0000 . 1 . . 48532 . . 295 PRO CA . 53199 1 342 . 1 . 1 68 68 PRO CB C 13 31.5201 0.0000 . 1 . . 48533 . . 295 PRO CB . 53199 1 343 . 1 . 1 69 69 ARG H H 1 8.3781 0.0000 . 1 . . 38058 . . 296 ARG H . 53199 1 344 . 1 . 1 69 69 ARG C C 13 175.0800 0.0000 . 1 . . 93706 . . 296 ARG C . 53199 1 345 . 1 . 1 69 69 ARG CA C 13 56.2066 0.0000 . 1 . . 66100 . . 296 ARG CA . 53199 1 346 . 1 . 1 69 69 ARG CB C 13 30.0524 0.0000 . 1 . . 93708 . . 296 ARG CB . 53199 1 347 . 1 . 1 69 69 ARG N N 15 123.2205 0.0000 . 1 . . 38060 . . 296 ARG N . 53199 1 348 . 1 . 1 70 70 GLU H H 1 8.7208 0.0000 . 1 . . 38115 . . 297 GLU H . 53199 1 349 . 1 . 1 70 70 GLU C C 13 176.0755 0.0000 . 1 . . 49794 . . 297 GLU C . 53199 1 350 . 1 . 1 70 70 GLU CA C 13 54.3887 0.0000 . 1 . . 49801 . . 297 GLU CA . 53199 1 351 . 1 . 1 70 70 GLU CB C 13 32.0611 0.0000 . 1 . . 49792 . . 297 GLU CB . 53199 1 352 . 1 . 1 70 70 GLU N N 15 122.3363 0.0000 . 1 . . 38117 . . 297 GLU N . 53199 1 353 . 1 . 1 71 71 GLU H H 1 9.0156 0.0000 . 1 . . 32298 . . 298 GLU H . 53199 1 354 . 1 . 1 71 71 GLU C C 13 176.4082 0.0000 . 1 . . 43365 . . 298 GLU C . 53199 1 355 . 1 . 1 71 71 GLU CA C 13 56.9359 0.0000 . 1 . . 43371 . . 298 GLU CA . 53199 1 356 . 1 . 1 71 71 GLU CB C 13 29.5736 0.0000 . 1 . . 43366 . . 298 GLU CB . 53199 1 357 . 1 . 1 71 71 GLU N N 15 127.2528 0.0000 . 1 . . 32300 . . 298 GLU N . 53199 1 358 . 1 . 1 72 72 GLN H H 1 8.7994 0.0000 . 1 . . 32400 . . 299 GLN H . 53199 1 359 . 1 . 1 72 72 GLN C C 13 177.0576 0.0000 . 1 . . 109536 . . 299 GLN C . 53199 1 360 . 1 . 1 72 72 GLN CA C 13 54.1101 0.0000 . 1 . . 47591 . . 299 GLN CA . 53199 1 361 . 1 . 1 72 72 GLN N N 15 123.8190 0.0000 . 1 . . 32402 . . 299 GLN N . 53199 1 362 . 1 . 1 73 73 TYR H H 1 8.3078 0.0000 . 1 . . 69240 . . 300 TYR H . 53199 1 363 . 1 . 1 73 73 TYR C C 13 175.2107 0.0000 . 1 . . 109552 . . 300 TYR C . 53199 1 364 . 1 . 1 73 73 TYR N N 15 120.4186 0.0000 . 1 . . 69242 . . 300 TYR N . 53199 1 365 . 1 . 1 74 74 ASN H H 1 7.4975 0.0000 . 1 . . 103314 . . 301 ASN H . 53199 1 366 . 1 . 1 74 74 ASN C C 13 175.2270 0.0000 . 1 . . 103594 . . 301 ASN C . 53199 1 367 . 1 . 1 74 74 ASN N N 15 118.2125 0.0000 . 1 . . 103316 . . 301 ASN N . 53199 1 368 . 1 . 1 75 75 SER H H 1 7.9948 0.0000 . 1 . . 38568 . . 302 SER H . 53199 1 369 . 1 . 1 75 75 SER C C 13 173.4473 0.0000 . 1 . . 103500 . . 302 SER C . 53199 1 370 . 1 . 1 75 75 SER CA C 13 59.9939 0.0000 . 1 . . 62635 . . 302 SER CA . 53199 1 371 . 1 . 1 75 75 SER N N 15 111.0982 0.0000 . 1 . . 38570 . . 302 SER N . 53199 1 372 . 1 . 1 76 76 THR H H 1 6.9088 0.0000 . 1 . . 103311 . . 303 THR H . 53199 1 373 . 1 . 1 76 76 THR CA C 13 60.1676 0.0000 . 1 . . 103428 . . 303 THR CA . 53199 1 374 . 1 . 1 76 76 THR N N 15 108.6726 0.0000 . 1 . . 103313 . . 303 THR N . 53199 1 375 . 1 . 1 77 77 TYR C C 13 174.8178 0.0000 . 1 . . 98090 . . 304 TYR C . 53199 1 376 . 1 . 1 77 77 TYR CA C 13 56.7415 0.0000 . 1 . . 52257 . . 304 TYR CA . 53199 1 377 . 1 . 1 77 77 TYR CB C 13 41.2134 0.0000 . 1 . . 52263 . . 304 TYR CB . 53199 1 378 . 1 . 1 78 78 ARG H H 1 8.7286 0.0000 . 1 . . 38211 . . 305 ARG H . 53199 1 379 . 1 . 1 78 78 ARG C C 13 175.3518 0.0000 . 1 . . 98040 . . 305 ARG C . 53199 1 380 . 1 . 1 78 78 ARG CA C 13 53.7832 0.0000 . 1 . . 52258 . . 305 ARG CA . 53199 1 381 . 1 . 1 78 78 ARG CB C 13 33.3194 0.0000 . 1 . . 98044 . . 305 ARG CB . 53199 1 382 . 1 . 1 78 78 ARG N N 15 120.5138 0.0000 . 1 . . 38213 . . 305 ARG N . 53199 1 383 . 1 . 1 79 79 VAL H H 1 9.2815 0.0000 . 1 . . 37935 . . 306 VAL H . 53199 1 384 . 1 . 1 79 79 VAL HG11 H 1 0.9910 0.0000 . 2 . . 91479 . . 306 VAL HG11 . 53199 1 385 . 1 . 1 79 79 VAL HG12 H 1 0.9910 0.0000 . 2 . . 91479 . . 306 VAL HG11 . 53199 1 386 . 1 . 1 79 79 VAL HG13 H 1 0.9910 0.0000 . 2 . . 91479 . . 306 VAL HG11 . 53199 1 387 . 1 . 1 79 79 VAL HG21 H 1 1.2260 0.0000 . 2 . . 92920 . . 306 VAL HG21 . 53199 1 388 . 1 . 1 79 79 VAL HG22 H 1 1.2260 0.0000 . 2 . . 92920 . . 306 VAL HG21 . 53199 1 389 . 1 . 1 79 79 VAL HG23 H 1 1.2260 0.0000 . 2 . . 92920 . . 306 VAL HG21 . 53199 1 390 . 1 . 1 79 79 VAL C C 13 173.7327 0.0000 . 1 . . 97893 . . 306 VAL C . 53199 1 391 . 1 . 1 79 79 VAL CA C 13 61.2716 0.0000 . 1 . . 93109 . . 306 VAL CA . 53199 1 392 . 1 . 1 79 79 VAL CB C 13 34.4040 0.0000 . 1 . . 97897 . . 306 VAL CB . 53199 1 393 . 1 . 1 79 79 VAL CG1 C 13 21.1320 0.0000 . 2 . . 92866 . . 306 VAL CG1 . 53199 1 394 . 1 . 1 79 79 VAL CG2 C 13 22.2260 0.0000 . 2 . . 92866 . . 306 VAL CG2 . 53199 1 395 . 1 . 1 79 79 VAL N N 15 126.2886 0.0000 . 1 . . 37937 . . 306 VAL N . 53199 1 396 . 1 . 1 80 80 VAL H H 1 8.3187 0.0000 . 1 . . 37911 . . 307 VAL H . 53199 1 397 . 1 . 1 80 80 VAL HG11 H 1 0.9190 0.0000 . 2 . . 92923 . . 307 VAL HG11 . 53199 1 398 . 1 . 1 80 80 VAL HG12 H 1 0.9190 0.0000 . 2 . . 92923 . . 307 VAL HG11 . 53199 1 399 . 1 . 1 80 80 VAL HG13 H 1 0.9190 0.0000 . 2 . . 92923 . . 307 VAL HG11 . 53199 1 400 . 1 . 1 80 80 VAL HG21 H 1 1.0100 0.0000 . 2 . . 91572 . . 307 VAL HG21 . 53199 1 401 . 1 . 1 80 80 VAL HG22 H 1 1.0100 0.0000 . 2 . . 91572 . . 307 VAL HG21 . 53199 1 402 . 1 . 1 80 80 VAL HG23 H 1 1.0100 0.0000 . 2 . . 91572 . . 307 VAL HG21 . 53199 1 403 . 1 . 1 80 80 VAL C C 13 173.6964 0.0000 . 1 . . 93322 . . 307 VAL C . 53199 1 404 . 1 . 1 80 80 VAL CA C 13 60.4097 0.0000 . 1 . . 97815 . . 307 VAL CA . 53199 1 405 . 1 . 1 80 80 VAL CB C 13 34.5188 0.0000 . 1 . . 97818 . . 307 VAL CB . 53199 1 406 . 1 . 1 80 80 VAL CG1 C 13 21.4120 0.0000 . 2 . . 87447 . . 307 VAL CG1 . 53199 1 407 . 1 . 1 80 80 VAL CG2 C 13 21.7090 0.0000 . 2 . . 87447 . . 307 VAL CG2 . 53199 1 408 . 1 . 1 80 80 VAL N N 15 127.3616 0.0000 . 1 . . 37913 . . 307 VAL N . 53199 1 409 . 1 . 1 81 81 SER H H 1 8.8660 0.0000 . 1 . . 97610 . . 308 SER H . 53199 1 410 . 1 . 1 81 81 SER C C 13 171.4108 0.0000 . 1 . . 68590 . . 308 SER C . 53199 1 411 . 1 . 1 81 81 SER CA C 13 57.1920 0.0000 . 1 . . 68582 . . 308 SER CA . 53199 1 412 . 1 . 1 81 81 SER CB C 13 64.9663 0.0000 . 1 . . 68594 . . 308 SER CB . 53199 1 413 . 1 . 1 81 81 SER N N 15 121.0998 0.0000 . 1 . . 97612 . . 308 SER N . 53199 1 414 . 1 . 1 82 82 VAL H H 1 8.6243 0.0000 . 1 . . 32316 . . 309 VAL H . 53199 1 415 . 1 . 1 82 82 VAL HG11 H 1 0.7990 0.0000 . 2 . . 91893 . . 309 VAL HG11 . 53199 1 416 . 1 . 1 82 82 VAL HG12 H 1 0.7990 0.0000 . 2 . . 91893 . . 309 VAL HG11 . 53199 1 417 . 1 . 1 82 82 VAL HG13 H 1 0.7990 0.0000 . 2 . . 91893 . . 309 VAL HG11 . 53199 1 418 . 1 . 1 82 82 VAL HG21 H 1 0.6650 0.0000 . 2 . . 91941 . . 309 VAL HG21 . 53199 1 419 . 1 . 1 82 82 VAL HG22 H 1 0.6650 0.0000 . 2 . . 91941 . . 309 VAL HG21 . 53199 1 420 . 1 . 1 82 82 VAL HG23 H 1 0.6650 0.0000 . 2 . . 91941 . . 309 VAL HG21 . 53199 1 421 . 1 . 1 82 82 VAL CA C 13 60.1004 0.0000 . 1 . . 76164 . . 309 VAL CA . 53199 1 422 . 1 . 1 82 82 VAL CB C 13 34.3028 0.0000 . 1 . . 99286 . . 309 VAL CB . 53199 1 423 . 1 . 1 82 82 VAL CG1 C 13 20.8230 0.0000 . 2 . . 87504 . . 309 VAL CG1 . 53199 1 424 . 1 . 1 82 82 VAL CG2 C 13 21.6910 0.0000 . 2 . . 87504 . . 309 VAL CG2 . 53199 1 425 . 1 . 1 82 82 VAL N N 15 126.2342 0.0000 . 1 . . 32318 . . 309 VAL N . 53199 1 426 . 1 . 1 83 83 LEU H H 1 8.4453 0.0000 . 1 . . 34671 . . 310 LEU H . 53199 1 427 . 1 . 1 83 83 LEU HD11 H 1 0.4470 0.0000 . 2 . . 92929 . . 310 LEU HD11 . 53199 1 428 . 1 . 1 83 83 LEU HD12 H 1 0.4470 0.0000 . 2 . . 92929 . . 310 LEU HD11 . 53199 1 429 . 1 . 1 83 83 LEU HD13 H 1 0.4470 0.0000 . 2 . . 92929 . . 310 LEU HD11 . 53199 1 430 . 1 . 1 83 83 LEU HD21 H 1 0.2540 0.0000 . 2 . . 92926 . . 310 LEU HD21 . 53199 1 431 . 1 . 1 83 83 LEU HD22 H 1 0.2540 0.0000 . 2 . . 92926 . . 310 LEU HD21 . 53199 1 432 . 1 . 1 83 83 LEU HD23 H 1 0.2540 0.0000 . 2 . . 92926 . . 310 LEU HD21 . 53199 1 433 . 1 . 1 83 83 LEU C C 13 175.5406 0.0000 . 1 . . 99314 . . 310 LEU C . 53199 1 434 . 1 . 1 83 83 LEU CA C 13 52.4824 0.0000 . 1 . . 40000 . . 310 LEU CA . 53199 1 435 . 1 . 1 83 83 LEU CB C 13 42.4486 0.0000 . 1 . . 99318 . . 310 LEU CB . 53199 1 436 . 1 . 1 83 83 LEU CD1 C 13 26.2410 0.0000 . 2 . . 92875 . . 310 LEU CD1 . 53199 1 437 . 1 . 1 83 83 LEU CD2 C 13 22.8080 0.0000 . 2 . . 87480 . . 310 LEU CD2 . 53199 1 438 . 1 . 1 83 83 LEU N N 15 130.1772 0.0000 . 1 . . 34673 . . 310 LEU N . 53199 1 439 . 1 . 1 84 84 THR H H 1 7.8690 0.0000 . 1 . . 38073 . . 311 THR H . 53199 1 440 . 1 . 1 84 84 THR HG21 H 1 0.8600 0.0000 . 1 . . 91776 . . 311 THR HG21 . 53199 1 441 . 1 . 1 84 84 THR HG22 H 1 0.8600 0.0000 . 1 . . 91776 . . 311 THR HG21 . 53199 1 442 . 1 . 1 84 84 THR HG23 H 1 0.8600 0.0000 . 1 . . 91776 . . 311 THR HG21 . 53199 1 443 . 1 . 1 84 84 THR C C 13 174.0237 0.0000 . 1 . . 48919 . . 311 THR C . 53199 1 444 . 1 . 1 84 84 THR CA C 13 62.9732 0.0000 . 1 . . 48915 . . 311 THR CA . 53199 1 445 . 1 . 1 84 84 THR CB C 13 68.4754 0.0000 . 1 . . 48920 . . 311 THR CB . 53199 1 446 . 1 . 1 84 84 THR CG2 C 13 22.0530 0.0000 . 1 . . 87429 . . 311 THR CG2 . 53199 1 447 . 1 . 1 84 84 THR N N 15 122.8628 0.0000 . 1 . . 38075 . . 311 THR N . 53199 1 448 . 1 . 1 85 85 VAL H H 1 7.8168 0.0000 . 1 . . 38184 . . 312 VAL H . 53199 1 449 . 1 . 1 85 85 VAL HG11 H 1 0.2550 0.0000 . 2 . . 92076 . . 312 VAL HG11 . 53199 1 450 . 1 . 1 85 85 VAL HG12 H 1 0.2550 0.0000 . 2 . . 92076 . . 312 VAL HG11 . 53199 1 451 . 1 . 1 85 85 VAL HG13 H 1 0.2550 0.0000 . 2 . . 92076 . . 312 VAL HG11 . 53199 1 452 . 1 . 1 85 85 VAL HG21 H 1 0.4530 0.0000 . 2 . . 92019 . . 312 VAL HG21 . 53199 1 453 . 1 . 1 85 85 VAL HG22 H 1 0.4530 0.0000 . 2 . . 92019 . . 312 VAL HG21 . 53199 1 454 . 1 . 1 85 85 VAL HG23 H 1 0.4530 0.0000 . 2 . . 92019 . . 312 VAL HG21 . 53199 1 455 . 1 . 1 85 85 VAL C C 13 174.7209 0.0000 . 1 . . 93041 . . 312 VAL C . 53199 1 456 . 1 . 1 85 85 VAL CA C 13 58.5737 0.0000 . 1 . . 41229 . . 312 VAL CA . 53199 1 457 . 1 . 1 85 85 VAL CB C 13 33.2185 0.0000 . 1 . . 93045 . . 312 VAL CB . 53199 1 458 . 1 . 1 85 85 VAL CG1 C 13 19.2450 0.0000 . 2 . . 92878 . . 312 VAL CG1 . 53199 1 459 . 1 . 1 85 85 VAL CG2 C 13 23.2950 0.0000 . 2 . . 87381 . . 312 VAL CG2 . 53199 1 460 . 1 . 1 85 85 VAL N N 15 121.0775 0.0000 . 1 . . 38186 . . 312 VAL N . 53199 1 461 . 1 . 1 86 86 LEU H H 1 8.3509 0.0000 . 1 . . 38103 . . 313 LEU H . 53199 1 462 . 1 . 1 86 86 LEU HD11 H 1 1.0130 0.0000 . 2 . . . . . 313 LEU HD11 . 53199 1 463 . 1 . 1 86 86 LEU HD12 H 1 1.0130 0.0000 . 2 . . . . . 313 LEU HD11 . 53199 1 464 . 1 . 1 86 86 LEU HD13 H 1 1.0130 0.0000 . 2 . . . . . 313 LEU HD11 . 53199 1 465 . 1 . 1 86 86 LEU HD21 H 1 0.9440 0.0000 . 2 . . . . . 313 LEU HD21 . 53199 1 466 . 1 . 1 86 86 LEU HD22 H 1 0.9440 0.0000 . 2 . . . . . 313 LEU HD21 . 53199 1 467 . 1 . 1 86 86 LEU HD23 H 1 0.9440 0.0000 . 2 . . . . . 313 LEU HD21 . 53199 1 468 . 1 . 1 86 86 LEU C C 13 178.7408 0.0000 . 1 . . 49467 . . 313 LEU C . 53199 1 469 . 1 . 1 86 86 LEU CD1 C 13 24.7790 0.0000 . 2 . . . . . 313 LEU CD1 . 53199 1 470 . 1 . 1 86 86 LEU CD2 C 13 23.3220 0.0000 . 2 . . . . . 313 LEU CD2 . 53199 1 471 . 1 . 1 86 86 LEU N N 15 122.6426 0.0000 . 1 . . 38105 . . 313 LEU N . 53199 1 472 . 1 . 1 87 87 HIS H H 1 8.8973 0.0000 . 1 . . 100271 . . 314 HIS H . 53199 1 473 . 1 . 1 87 87 HIS C C 13 177.2670 0.0000 . 1 . . 102862 . . 314 HIS C . 53199 1 474 . 1 . 1 87 87 HIS CA C 13 61.5309 0.0000 . 1 . . 102924 . . 314 HIS CA . 53199 1 475 . 1 . 1 87 87 HIS N N 15 123.8514 0.0000 . 1 . . 100273 . . 314 HIS N . 53199 1 476 . 1 . 1 88 88 GLN H H 1 9.1102 0.0000 . 1 . . 38451 . . 315 GLN H . 53199 1 477 . 1 . 1 88 88 GLN C C 13 177.6822 0.0000 . 1 . . 60479 . . 315 GLN C . 53199 1 478 . 1 . 1 88 88 GLN CA C 13 57.8395 0.0000 . 1 . . 60482 . . 315 GLN CA . 53199 1 479 . 1 . 1 88 88 GLN CB C 13 27.6239 0.0000 . 1 . . 60483 . . 315 GLN CB . 53199 1 480 . 1 . 1 88 88 GLN N N 15 113.8846 0.0000 . 1 . . 38453 . . 315 GLN N . 53199 1 481 . 1 . 1 89 89 ASP H H 1 6.8988 0.0000 . 1 . . 32586 . . 316 ASP H . 53199 1 482 . 1 . 1 89 89 ASP C C 13 177.6079 0.0000 . 1 . . 94544 . . 316 ASP C . 53199 1 483 . 1 . 1 89 89 ASP CA C 13 56.9016 0.0000 . 1 . . 52430 . . 316 ASP CA . 53199 1 484 . 1 . 1 89 89 ASP CB C 13 40.2670 0.0000 . 1 . . 94548 . . 316 ASP CB . 53199 1 485 . 1 . 1 89 89 ASP N N 15 120.1053 0.0000 . 1 . . 32588 . . 316 ASP N . 53199 1 486 . 1 . 1 90 90 TRP H H 1 7.6035 0.0000 . 1 . . 70893 . . 317 TRP H . 53199 1 487 . 1 . 1 90 90 TRP C C 13 179.9661 0.0000 . 1 . . 57578 . . 317 TRP C . 53199 1 488 . 1 . 1 90 90 TRP CA C 13 60.5950 0.0000 . 1 . . 57579 . . 317 TRP CA . 53199 1 489 . 1 . 1 90 90 TRP N N 15 119.2130 0.0000 . 1 . . 70895 . . 317 TRP N . 53199 1 490 . 1 . 1 91 91 LEU H H 1 8.1856 0.0000 . 1 . . 38346 . . 318 LEU H . 53199 1 491 . 1 . 1 91 91 LEU HD11 H 1 0.8390 0.0000 . 2 . . . . . 318 LEU HD11 . 53199 1 492 . 1 . 1 91 91 LEU HD12 H 1 0.8390 0.0000 . 2 . . . . . 318 LEU HD11 . 53199 1 493 . 1 . 1 91 91 LEU HD13 H 1 0.8390 0.0000 . 2 . . . . . 318 LEU HD11 . 53199 1 494 . 1 . 1 91 91 LEU HD21 H 1 0.8530 0.0000 . 2 . . . . . 318 LEU HD21 . 53199 1 495 . 1 . 1 91 91 LEU HD22 H 1 0.8530 0.0000 . 2 . . . . . 318 LEU HD21 . 53199 1 496 . 1 . 1 91 91 LEU HD23 H 1 0.8530 0.0000 . 2 . . . . . 318 LEU HD21 . 53199 1 497 . 1 . 1 91 91 LEU C C 13 178.1015 0.0000 . 1 . . 57581 . . 318 LEU C . 53199 1 498 . 1 . 1 91 91 LEU CA C 13 57.2232 0.0000 . 1 . . 57588 . . 318 LEU CA . 53199 1 499 . 1 . 1 91 91 LEU CB C 13 40.3580 0.0000 . 1 . . 57583 . . 318 LEU CB . 53199 1 500 . 1 . 1 91 91 LEU CD1 C 13 25.2410 0.0000 . 2 . . 92884 . . 318 LEU CD1 . 53199 1 501 . 1 . 1 91 91 LEU CD2 C 13 22.2100 0.0000 . 2 . . 92887 . . 318 LEU CD2 . 53199 1 502 . 1 . 1 91 91 LEU N N 15 116.2074 0.0000 . 1 . . 38348 . . 318 LEU N . 53199 1 503 . 1 . 1 92 92 ASN H H 1 7.8893 0.0000 . 1 . . 38352 . . 319 ASN H . 53199 1 504 . 1 . 1 92 92 ASN C C 13 176.5236 0.0000 . 1 . . 57701 . . 319 ASN C . 53199 1 505 . 1 . 1 92 92 ASN CA C 13 52.9684 0.0000 . 1 . . 57702 . . 319 ASN CA . 53199 1 506 . 1 . 1 92 92 ASN CB C 13 37.9238 0.0000 . 1 . . 57704 . . 319 ASN CB . 53199 1 507 . 1 . 1 92 92 ASN N N 15 116.1492 0.0000 . 1 . . 38354 . . 319 ASN N . 53199 1 508 . 1 . 1 93 93 GLY H H 1 7.6365 0.0000 . 1 . . 38592 . . 320 GLY H . 53199 1 509 . 1 . 1 93 93 GLY C C 13 175.3068 0.0000 . 1 . . 95006 . . 320 GLY C . 53199 1 510 . 1 . 1 93 93 GLY CA C 13 46.3490 0.0000 . 1 . . 64192 . . 320 GLY CA . 53199 1 511 . 1 . 1 93 93 GLY N N 15 107.6410 0.0000 . 1 . . 38594 . . 320 GLY N . 53199 1 512 . 1 . 1 94 94 LYS H H 1 7.3541 0.0000 . 1 . . 31896 . . 321 LYS H . 53199 1 513 . 1 . 1 94 94 LYS C C 13 174.7970 0.0000 . 1 . . 56039 . . 321 LYS C . 53199 1 514 . 1 . 1 94 94 LYS CA C 13 57.8425 0.0000 . 1 . . 56040 . . 321 LYS CA . 53199 1 515 . 1 . 1 94 94 LYS N N 15 118.9279 0.0000 . 1 . . 31898 . . 321 LYS N . 53199 1 516 . 1 . 1 95 95 GLU H H 1 8.4137 0.0000 . 1 . . 32607 . . 322 GLU H . 53199 1 517 . 1 . 1 95 95 GLU C C 13 175.5639 0.0000 . 1 . . 94524 . . 322 GLU C . 53199 1 518 . 1 . 1 95 95 GLU CA C 13 55.0642 0.0000 . 1 . . 94520 . . 322 GLU CA . 53199 1 519 . 1 . 1 95 95 GLU N N 15 119.7603 0.0000 . 1 . . 32609 . . 322 GLU N . 53199 1 520 . 1 . 1 96 96 TYR H H 1 9.0462 0.0000 . 1 . . 37908 . . 323 TYR H . 53199 1 521 . 1 . 1 96 96 TYR C C 13 174.1958 0.0000 . 1 . . 95059 . . 323 TYR C . 53199 1 522 . 1 . 1 96 96 TYR CA C 13 58.0709 0.0000 . 1 . . 95047 . . 323 TYR CA . 53199 1 523 . 1 . 1 96 96 TYR CB C 13 40.0421 0.0000 . 1 . . 95065 . . 323 TYR CB . 53199 1 524 . 1 . 1 96 96 TYR N N 15 127.3453 0.0000 . 1 . . 37910 . . 323 TYR N . 53199 1 525 . 1 . 1 97 97 LYS H H 1 9.3539 0.0000 . 1 . . 32385 . . 324 LYS H . 53199 1 526 . 1 . 1 97 97 LYS CA C 13 53.7176 0.0000 . 1 . . 95081 . . 324 LYS CA . 53199 1 527 . 1 . 1 97 97 LYS CB C 13 35.9007 0.0000 . 1 . . 95089 . . 324 LYS CB . 53199 1 528 . 1 . 1 97 97 LYS N N 15 124.1347 0.0000 . 1 . . 32387 . . 324 LYS N . 53199 1 529 . 1 . 1 98 98 CYS H H 1 8.6245 0.0000 . 1 . . 94608 . . 325 CYS H . 53199 1 530 . 1 . 1 98 98 CYS CA C 13 52.5242 0.0000 . 1 . . 98295 . . 325 CYS CA . 53199 1 531 . 1 . 1 98 98 CYS CB C 13 44.3859 0.0000 . 1 . . 98304 . . 325 CYS CB . 53199 1 532 . 1 . 1 98 98 CYS N N 15 125.6174 0.0000 . 1 . . 94610 . . 325 CYS N . 53199 1 533 . 1 . 1 99 99 LYS H H 1 9.0244 0.0000 . 1 . . 37881 . . 326 LYS H . 53199 1 534 . 1 . 1 99 99 LYS C C 13 174.6116 0.0000 . 1 . . 67481 . . 326 LYS C . 53199 1 535 . 1 . 1 99 99 LYS CA C 13 53.7524 0.0000 . 1 . . 67488 . . 326 LYS CA . 53199 1 536 . 1 . 1 99 99 LYS CB C 13 35.6386 0.0000 . 1 . . 67504 . . 326 LYS CB . 53199 1 537 . 1 . 1 99 99 LYS N N 15 128.8455 0.0000 . 1 . . 37883 . . 326 LYS N . 53199 1 538 . 1 . 1 100 100 VAL H H 1 9.1202 0.0000 . 1 . . 37887 . . 327 VAL H . 53199 1 539 . 1 . 1 100 100 VAL HG11 H 1 0.3670 0.0000 . 2 . . . . . 327 VAL HG11 . 53199 1 540 . 1 . 1 100 100 VAL HG12 H 1 0.3670 0.0000 . 2 . . . . . 327 VAL HG11 . 53199 1 541 . 1 . 1 100 100 VAL HG13 H 1 0.3670 0.0000 . 2 . . . . . 327 VAL HG11 . 53199 1 542 . 1 . 1 100 100 VAL HG21 H 1 0.5760 0.0000 . 2 . . . . . 327 VAL HG21 . 53199 1 543 . 1 . 1 100 100 VAL HG22 H 1 0.5760 0.0000 . 2 . . . . . 327 VAL HG21 . 53199 1 544 . 1 . 1 100 100 VAL HG23 H 1 0.5760 0.0000 . 2 . . . . . 327 VAL HG21 . 53199 1 545 . 1 . 1 100 100 VAL C C 13 174.3391 0.0000 . 1 . . 94982 . . 327 VAL C . 53199 1 546 . 1 . 1 100 100 VAL CA C 13 60.6812 0.0000 . 1 . . 67499 . . 327 VAL CA . 53199 1 547 . 1 . 1 100 100 VAL CB C 13 34.2759 0.0000 . 1 . . 94986 . . 327 VAL CB . 53199 1 548 . 1 . 1 100 100 VAL CG1 C 13 20.5910 0.0000 . 2 . . 99389 . . 327 VAL CG1 . 53199 1 549 . 1 . 1 100 100 VAL CG2 C 13 22.2080 0.0000 . 2 . . 99392 . . 327 VAL CG2 . 53199 1 550 . 1 . 1 100 100 VAL N N 15 128.5713 0.0000 . 1 . . 37889 . . 327 VAL N . 53199 1 551 . 1 . 1 101 101 SER H H 1 8.2657 0.0000 . 1 . . 38298 . . 328 SER H . 53199 1 552 . 1 . 1 101 101 SER C C 13 173.0017 0.0000 . 1 . . 56558 . . 328 SER C . 53199 1 553 . 1 . 1 101 101 SER CA C 13 56.6501 0.0000 . 1 . . 56578 . . 328 SER CA . 53199 1 554 . 1 . 1 101 101 SER N N 15 118.7426 0.0000 . 1 . . 38300 . . 328 SER N . 53199 1 555 . 1 . 1 102 102 ASN H H 1 8.1346 0.0000 . 1 . . 38160 . . 329 ASN H . 53199 1 556 . 1 . 1 102 102 ASN CA C 13 55.6552 0.0000 . 1 . . 107149 . . 329 ASN CA . 53199 1 557 . 1 . 1 102 102 ASN CB C 13 43.0459 0.0000 . 1 . . 41140 . . 329 ASN CB . 53199 1 558 . 1 . 1 102 102 ASN N N 15 121.6440 0.0000 . 1 . . 38162 . . 329 ASN N . 53199 1 559 . 1 . 1 103 103 LYS H H 1 8.1830 0.0000 . 1 . . 38016 . . 330 LYS H . 53199 1 560 . 1 . 1 103 103 LYS C C 13 176.1153 0.0000 . 1 . . 67711 . . 330 LYS C . 53199 1 561 . 1 . 1 103 103 LYS CB C 13 31.6996 0.0000 . 1 . . 67714 . . 330 LYS CB . 53199 1 562 . 1 . 1 103 103 LYS N N 15 124.1472 0.0000 . 1 . . 38018 . . 330 LYS N . 53199 1 563 . 1 . 1 104 104 ALA H H 1 7.7366 0.0000 . 1 . . 38268 . . 331 ALA H . 53199 1 564 . 1 . 1 104 104 ALA HB1 H 1 1.4670 0.0000 . 1 . . . . . 331 ALA HB1 . 53199 1 565 . 1 . 1 104 104 ALA HB2 H 1 1.4670 0.0000 . 1 . . . . . 331 ALA HB1 . 53199 1 566 . 1 . 1 104 104 ALA HB3 H 1 1.4670 0.0000 . 1 . . . . . 331 ALA HB1 . 53199 1 567 . 1 . 1 104 104 ALA C C 13 177.6150 0.0000 . 1 . . 106990 . . 331 ALA C . 53199 1 568 . 1 . 1 104 104 ALA CA C 13 52.3975 0.0000 . 1 . . 102576 . . 331 ALA CA . 53199 1 569 . 1 . 1 104 104 ALA CB C 13 18.6946 0.0000 . 1 . . 106994 . . 331 ALA CB . 53199 1 570 . 1 . 1 104 104 ALA N N 15 119.1504 0.0000 . 1 . . 38270 . . 331 ALA N . 53199 1 571 . 1 . 1 105 105 LEU H H 1 7.6026 0.0000 . 1 . . 31893 . . 332 LEU H . 53199 1 572 . 1 . 1 105 105 LEU C C 13 176.0316 0.0000 . 1 . . 55627 . . 332 LEU C . 53199 1 573 . 1 . 1 105 105 LEU CA C 13 60.4827 0.0000 . 1 . . 55628 . . 332 LEU CA . 53199 1 574 . 1 . 1 105 105 LEU CB C 13 41.7975 0.0000 . 1 . . 55630 . . 332 LEU CB . 53199 1 575 . 1 . 1 105 105 LEU N N 15 119.2120 0.0000 . 1 . . 31895 . . 332 LEU N . 53199 1 576 . 1 . 1 108 108 PRO C C 13 176.6007 0.0000 . 1 . . 49252 . . 335 PRO C . 53199 1 577 . 1 . 1 108 108 PRO CA C 13 62.6032 0.0000 . 1 . . 49253 . . 335 PRO CA . 53199 1 578 . 1 . 1 108 108 PRO CB C 13 32.0927 0.0000 . 1 . . 49260 . . 335 PRO CB . 53199 1 579 . 1 . 1 109 109 ILE H H 1 8.3094 0.0000 . 1 . . 38091 . . 336 ILE H . 53199 1 580 . 1 . 1 109 109 ILE HG21 H 1 0.8100 0.0000 . 1 . . 91821 . . 336 ILE HG21 . 53199 1 581 . 1 . 1 109 109 ILE HG22 H 1 0.8100 0.0000 . 1 . . 91821 . . 336 ILE HG21 . 53199 1 582 . 1 . 1 109 109 ILE HG23 H 1 0.8100 0.0000 . 1 . . 91821 . . 336 ILE HG21 . 53199 1 583 . 1 . 1 109 109 ILE HD11 H 1 0.8040 0.0000 . 1 . . 91821 . . 336 ILE HD11 . 53199 1 584 . 1 . 1 109 109 ILE HD12 H 1 0.8040 0.0000 . 1 . . 91821 . . 336 ILE HD11 . 53199 1 585 . 1 . 1 109 109 ILE HD13 H 1 0.8040 0.0000 . 1 . . 91821 . . 336 ILE HD11 . 53199 1 586 . 1 . 1 109 109 ILE C C 13 174.5506 0.0000 . 1 . . 49258 . . 336 ILE C . 53199 1 587 . 1 . 1 109 109 ILE CA C 13 60.0301 0.0000 . 1 . . 49259 . . 336 ILE CA . 53199 1 588 . 1 . 1 109 109 ILE CB C 13 39.8552 0.0000 . 1 . . 49262 . . 336 ILE CB . 53199 1 589 . 1 . 1 109 109 ILE CG2 C 13 17.1360 0.0000 . 1 . . 87852 . . 336 ILE CG2 . 53199 1 590 . 1 . 1 109 109 ILE CD1 C 13 13.6440 0.0000 . 1 . . 87996 . . 336 ILE CD1 . 53199 1 591 . 1 . 1 109 109 ILE N N 15 122.6416 0.0000 . 1 . . 38093 . . 336 ILE N . 53199 1 592 . 1 . 1 110 110 GLU H H 1 8.3953 0.0000 . 1 . . 38013 . . 337 GLU H . 53199 1 593 . 1 . 1 110 110 GLU C C 13 175.4246 0.0000 . 1 . . 95703 . . 337 GLU C . 53199 1 594 . 1 . 1 110 110 GLU CA C 13 53.6501 0.0000 . 1 . . 47208 . . 337 GLU CA . 53199 1 595 . 1 . 1 110 110 GLU CB C 13 32.3418 0.0000 . 1 . . 95707 . . 337 GLU CB . 53199 1 596 . 1 . 1 110 110 GLU N N 15 124.2045 0.0000 . 1 . . 38015 . . 337 GLU N . 53199 1 597 . 1 . 1 111 111 LYS H H 1 8.5587 0.0000 . 1 . . 70917 . . 338 LYS H . 53199 1 598 . 1 . 1 111 111 LYS C C 13 174.3501 0.0000 . 1 . . 72142 . . 338 LYS C . 53199 1 599 . 1 . 1 111 111 LYS CA C 13 53.4285 0.0000 . 1 . . 72136 . . 338 LYS CA . 53199 1 600 . 1 . 1 111 111 LYS CB C 13 36.0631 0.0000 . 1 . . 72140 . . 338 LYS CB . 53199 1 601 . 1 . 1 111 111 LYS N N 15 122.6717 0.0000 . 1 . . 70919 . . 338 LYS N . 53199 1 602 . 1 . 1 112 112 THR H H 1 8.1698 0.0000 . 1 . . 34494 . . 339 THR H . 53199 1 603 . 1 . 1 112 112 THR HG21 H 1 1.0190 0.0000 . 1 . . 91560 . . 339 THR HG21 . 53199 1 604 . 1 . 1 112 112 THR HG22 H 1 1.0190 0.0000 . 1 . . 91560 . . 339 THR HG21 . 53199 1 605 . 1 . 1 112 112 THR HG23 H 1 1.0190 0.0000 . 1 . . 91560 . . 339 THR HG21 . 53199 1 606 . 1 . 1 112 112 THR C C 13 174.2185 0.0000 . 1 . . 61140 . . 339 THR C . 53199 1 607 . 1 . 1 112 112 THR CA C 13 59.8373 0.0000 . 1 . . 61137 . . 339 THR CA . 53199 1 608 . 1 . 1 112 112 THR CB C 13 71.4329 0.0000 . 1 . . 61141 . . 339 THR CB . 53199 1 609 . 1 . 1 112 112 THR CG2 C 13 21.4230 0.0000 . 1 . . 87483 . . 339 THR CG2 . 53199 1 610 . 1 . 1 112 112 THR N N 15 113.6183 0.0000 . 1 . . 34496 . . 339 THR N . 53199 1 611 . 1 . 1 113 113 ILE H H 1 9.3255 0.0000 . 1 . . 38124 . . 340 ILE H . 53199 1 612 . 1 . 1 113 113 ILE HG21 H 1 1.0600 0.0000 . 1 . . 91515 . . 340 ILE HG21 . 53199 1 613 . 1 . 1 113 113 ILE HG22 H 1 1.0600 0.0000 . 1 . . 91515 . . 340 ILE HG21 . 53199 1 614 . 1 . 1 113 113 ILE HG23 H 1 1.0600 0.0000 . 1 . . 91515 . . 340 ILE HG21 . 53199 1 615 . 1 . 1 113 113 ILE HD11 H 1 1.0860 0.0000 . 1 . . 91515 . . 340 ILE HD11 . 53199 1 616 . 1 . 1 113 113 ILE HD12 H 1 1.0860 0.0000 . 1 . . 91515 . . 340 ILE HD11 . 53199 1 617 . 1 . 1 113 113 ILE HD13 H 1 1.0860 0.0000 . 1 . . 91515 . . 340 ILE HD11 . 53199 1 618 . 1 . 1 113 113 ILE C C 13 171.9063 0.0000 . 1 . . 41031 . . 340 ILE C . 53199 1 619 . 1 . 1 113 113 ILE CA C 13 59.8948 0.0000 . 1 . . 41029 . . 340 ILE CA . 53199 1 620 . 1 . 1 113 113 ILE CB C 13 41.9264 0.0000 . 1 . . 41037 . . 340 ILE CB . 53199 1 621 . 1 . 1 113 113 ILE CG2 C 13 17.3690 0.0000 . 1 . . 87822 . . 340 ILE CG2 . 53199 1 622 . 1 . 1 113 113 ILE CD1 C 13 14.6060 0.0000 . 1 . . 87945 . . 340 ILE CD1 . 53199 1 623 . 1 . 1 113 113 ILE N N 15 121.9908 0.0000 . 1 . . 38126 . . 340 ILE N . 53199 1 624 . 1 . 1 114 114 SER H H 1 7.6277 0.0000 . 1 . . 38394 . . 341 SER H . 53199 1 625 . 1 . 1 114 114 SER C C 13 173.1333 0.0000 . 1 . . 59375 . . 341 SER C . 53199 1 626 . 1 . 1 114 114 SER CA C 13 57.4716 0.0000 . 1 . . 59379 . . 341 SER CA . 53199 1 627 . 1 . 1 114 114 SER CB C 13 65.9975 0.0000 . 1 . . 59377 . . 341 SER CB . 53199 1 628 . 1 . 1 114 114 SER N N 15 115.3174 0.0000 . 1 . . 38396 . . 341 SER N . 53199 1 629 . 1 . 1 115 115 LYS H H 1 8.6504 0.0000 . 1 . . 32286 . . 342 LYS H . 53199 1 630 . 1 . 1 115 115 LYS C C 13 176.1234 0.0000 . 1 . . 98300 . . 342 LYS C . 53199 1 631 . 1 . 1 115 115 LYS CA C 13 56.2646 0.0000 . 1 . . 98294 . . 342 LYS CA . 53199 1 632 . 1 . 1 115 115 LYS CB C 13 30.7890 0.0000 . 1 . . 98303 . . 342 LYS CB . 53199 1 633 . 1 . 1 115 115 LYS N N 15 125.1229 0.0000 . 1 . . 32288 . . 342 LYS N . 53199 1 634 . 1 . 1 116 116 ALA H H 1 8.5502 0.0000 . 1 . . 37863 . . 343 ALA H . 53199 1 635 . 1 . 1 116 116 ALA HB1 H 1 1.4540 0.0000 . 1 . . 109555 . . 343 ALA HB1 . 53199 1 636 . 1 . 1 116 116 ALA HB2 H 1 1.4540 0.0000 . 1 . . 109555 . . 343 ALA HB1 . 53199 1 637 . 1 . 1 116 116 ALA HB3 H 1 1.4540 0.0000 . 1 . . 109555 . . 343 ALA HB1 . 53199 1 638 . 1 . 1 116 116 ALA C C 13 177.7228 0.0000 . 1 . . 40030 . . 343 ALA C . 53199 1 639 . 1 . 1 116 116 ALA CA C 13 53.0582 0.0000 . 1 . . 40037 . . 343 ALA CA . 53199 1 640 . 1 . 1 116 116 ALA CB C 13 18.4711 0.0000 . 1 . . 40036 . . 343 ALA CB . 53199 1 641 . 1 . 1 116 116 ALA N N 15 129.4165 0.0000 . 1 . . 37865 . . 343 ALA N . 53199 1 642 . 1 . 1 117 117 LYS H H 1 8.3063 0.0000 . 1 . . 38169 . . 344 LYS H . 53199 1 643 . 1 . 1 117 117 LYS C C 13 177.4861 0.0000 . 1 . . 41179 . . 344 LYS C . 53199 1 644 . 1 . 1 117 117 LYS CA C 13 55.7099 0.0000 . 1 . . 41181 . . 344 LYS CA . 53199 1 645 . 1 . 1 117 117 LYS CB C 13 33.2535 0.0000 . 1 . . 41183 . . 344 LYS CB . 53199 1 646 . 1 . 1 117 117 LYS N N 15 121.0985 0.0000 . 1 . . 38171 . . 344 LYS N . 53199 1 647 . 1 . 1 118 118 GLY H H 1 8.4194 0.0000 . 1 . . 38547 . . 345 GLY H . 53199 1 648 . 1 . 1 118 118 GLY C C 13 173.1148 0.0000 . 1 . . 62045 . . 345 GLY C . 53199 1 649 . 1 . 1 118 118 GLY CA C 13 43.7073 0.0000 . 1 . . 62047 . . 345 GLY CA . 53199 1 650 . 1 . 1 118 118 GLY N N 15 111.6232 0.0000 . 1 . . 38549 . . 345 GLY N . 53199 1 651 . 1 . 1 119 119 GLN H H 1 8.1174 0.0000 . 1 . . 38109 . . 346 GLN H . 53199 1 652 . 1 . 1 119 119 GLN C C 13 173.9640 0.0000 . 1 . . 49564 . . 346 GLN C . 53199 1 653 . 1 . 1 119 119 GLN CA C 13 53.5418 0.0000 . 1 . . 49565 . . 346 GLN CA . 53199 1 654 . 1 . 1 119 119 GLN CB C 13 28.5529 0.0000 . 1 . . 49568 . . 346 GLN CB . 53199 1 655 . 1 . 1 119 119 GLN N N 15 122.6090 0.0000 . 1 . . 38111 . . 346 GLN N . 53199 1 656 . 1 . 1 120 120 PRO C C 13 176.7352 0.0000 . 1 . . 49191 . . 347 PRO C . 53199 1 657 . 1 . 1 120 120 PRO CA C 13 63.0247 0.0000 . 1 . . 49195 . . 347 PRO CA . 53199 1 658 . 1 . 1 120 120 PRO CB C 13 31.8933 0.0000 . 1 . . 49202 . . 347 PRO CB . 53199 1 659 . 1 . 1 121 121 ARG H H 1 9.3702 0.0000 . 1 . . 38088 . . 348 ARG H . 53199 1 660 . 1 . 1 121 121 ARG C C 13 174.9502 0.0000 . 1 . . 94560 . . 348 ARG C . 53199 1 661 . 1 . 1 121 121 ARG CA C 13 54.9494 0.0000 . 1 . . 93612 . . 348 ARG CA . 53199 1 662 . 1 . 1 121 121 ARG CB C 13 33.6528 0.0000 . 1 . . 94564 . . 348 ARG CB . 53199 1 663 . 1 . 1 121 121 ARG N N 15 122.9919 0.0000 . 1 . . 38090 . . 348 ARG N . 53199 1 664 . 1 . 1 122 122 GLU H H 1 8.5537 0.0000 . 1 . . 38007 . . 349 GLU H . 53199 1 665 . 1 . 1 122 122 GLU C C 13 173.0901 0.0000 . 1 . . 94594 . . 349 GLU C . 53199 1 666 . 1 . 1 122 122 GLU CA C 13 53.5996 0.0000 . 1 . . 94595 . . 349 GLU CA . 53199 1 667 . 1 . 1 122 122 GLU CB C 13 29.9055 0.0000 . 1 . . 94599 . . 349 GLU CB . 53199 1 668 . 1 . 1 122 122 GLU N N 15 124.0177 0.0000 . 1 . . 38009 . . 349 GLU N . 53199 1 669 . 1 . 1 123 123 PRO C C 13 175.5022 0.0000 . 1 . . 51430 . . 350 PRO C . 53199 1 670 . 1 . 1 123 123 PRO CA C 13 62.0927 0.0000 . 1 . . 51436 . . 350 PRO CA . 53199 1 671 . 1 . 1 123 123 PRO CB C 13 31.3952 0.0000 . 1 . . 51435 . . 350 PRO CB . 53199 1 672 . 1 . 1 124 124 GLN H H 1 8.9317 0.0000 . 1 . . 34206 . . 351 GLN H . 53199 1 673 . 1 . 1 124 124 GLN C C 13 174.2076 0.0000 . 1 . . 51431 . . 351 GLN C . 53199 1 674 . 1 . 1 124 124 GLN CA C 13 53.8671 0.0000 . 1 . . 51433 . . 351 GLN CA . 53199 1 675 . 1 . 1 124 124 GLN CB C 13 29.5119 0.0000 . 1 . . 51434 . . 351 GLN CB . 53199 1 676 . 1 . 1 124 124 GLN N N 15 121.0305 0.0000 . 1 . . 34208 . . 351 GLN N . 53199 1 677 . 1 . 1 125 125 VAL H H 1 7.7387 0.0000 . 1 . . 38106 . . 352 VAL H . 53199 1 678 . 1 . 1 125 125 VAL HG11 H 1 0.4830 0.0000 . 2 . . 91977 . . 352 VAL HG11 . 53199 1 679 . 1 . 1 125 125 VAL HG12 H 1 0.4830 0.0000 . 2 . . 91977 . . 352 VAL HG11 . 53199 1 680 . 1 . 1 125 125 VAL HG13 H 1 0.4830 0.0000 . 2 . . 91977 . . 352 VAL HG11 . 53199 1 681 . 1 . 1 125 125 VAL HG21 H 1 0.5010 0.0000 . 2 . . 91977 . . 352 VAL HG21 . 53199 1 682 . 1 . 1 125 125 VAL HG22 H 1 0.5010 0.0000 . 2 . . 91977 . . 352 VAL HG21 . 53199 1 683 . 1 . 1 125 125 VAL HG23 H 1 0.5010 0.0000 . 2 . . 91977 . . 352 VAL HG21 . 53199 1 684 . 1 . 1 125 125 VAL C C 13 173.3980 0.0000 . 1 . . 40982 . . 352 VAL C . 53199 1 685 . 1 . 1 125 125 VAL CA C 13 60.9002 0.0000 . 1 . . 40975 . . 352 VAL CA . 53199 1 686 . 1 . 1 125 125 VAL CB C 13 32.5838 0.0000 . 1 . . 40979 . . 352 VAL CB . 53199 1 687 . 1 . 1 125 125 VAL CG1 C 13 21.0310 0.0000 . 2 . . 87468 . . 352 VAL CG1 . 53199 1 688 . 1 . 1 125 125 VAL CG2 C 13 21.3260 0.0000 . 2 . . 87468 . . 352 VAL CG2 . 53199 1 689 . 1 . 1 125 125 VAL N N 15 122.6514 0.0000 . 1 . . 38108 . . 352 VAL N . 53199 1 690 . 1 . 1 126 126 TYR H H 1 9.2846 0.0000 . 1 . . 37977 . . 353 TYR H . 53199 1 691 . 1 . 1 126 126 TYR C C 13 174.6580 0.0000 . 1 . . 46447 . . 353 TYR C . 53199 1 692 . 1 . 1 126 126 TYR CA C 13 55.1849 0.0000 . 1 . . 46453 . . 353 TYR CA . 53199 1 693 . 1 . 1 126 126 TYR CB C 13 41.0877 0.0000 . 1 . . 46449 . . 353 TYR CB . 53199 1 694 . 1 . 1 126 126 TYR N N 15 125.1771 0.0000 . 1 . . 37979 . . 353 TYR N . 53199 1 695 . 1 . 1 127 127 THR H H 1 8.5718 0.0000 . 1 . . 38523 . . 354 THR H . 53199 1 696 . 1 . 1 127 127 THR HG21 H 1 0.9230 0.0000 . 1 . . . . . 354 THR HG21 . 53199 1 697 . 1 . 1 127 127 THR HG22 H 1 0.9230 0.0000 . 1 . . . . . 354 THR HG21 . 53199 1 698 . 1 . 1 127 127 THR HG23 H 1 0.9230 0.0000 . 1 . . . . . 354 THR HG21 . 53199 1 699 . 1 . 1 127 127 THR C C 13 174.2152 0.0000 . 1 . . 61587 . . 354 THR C . 53199 1 700 . 1 . 1 127 127 THR CA C 13 58.2031 0.0000 . 1 . . 61585 . . 354 THR CA . 53199 1 701 . 1 . 1 127 127 THR CB C 13 69.3936 0.0000 . 1 . . 61588 . . 354 THR CB . 53199 1 702 . 1 . 1 127 127 THR CG2 C 13 23.3680 0.0000 . 1 . . 87354 . . 354 THR CG2 . 53199 1 703 . 1 . 1 127 127 THR N N 15 112.6222 0.0000 . 1 . . 38525 . . 354 THR N . 53199 1 704 . 1 . 1 128 128 LEU H H 1 9.4090 0.0000 . 1 . . 37998 . . 355 LEU H . 53199 1 705 . 1 . 1 128 128 LEU HD11 H 1 0.9430 0.0000 . 2 . . . . . 355 LEU HD11 . 53199 1 706 . 1 . 1 128 128 LEU HD12 H 1 0.9430 0.0000 . 2 . . . . . 355 LEU HD11 . 53199 1 707 . 1 . 1 128 128 LEU HD13 H 1 0.9430 0.0000 . 2 . . . . . 355 LEU HD11 . 53199 1 708 . 1 . 1 128 128 LEU HD21 H 1 0.9590 0.0000 . 2 . . . . . 355 LEU HD21 . 53199 1 709 . 1 . 1 128 128 LEU HD22 H 1 0.9590 0.0000 . 2 . . . . . 355 LEU HD21 . 53199 1 710 . 1 . 1 128 128 LEU HD23 H 1 0.9590 0.0000 . 2 . . . . . 355 LEU HD21 . 53199 1 711 . 1 . 1 128 128 LEU C C 13 173.8764 0.0000 . 1 . . 46920 . . 355 LEU C . 53199 1 712 . 1 . 1 128 128 LEU CA C 13 50.9628 0.0000 . 1 . . 46914 . . 355 LEU CA . 53199 1 713 . 1 . 1 128 128 LEU CB C 13 42.2500 0.0000 . 1 . . 46936 . . 355 LEU CB . 53199 1 714 . 1 . 1 128 128 LEU CD1 C 13 23.3250 0.0000 . 2 . . . . . 355 LEU CD1 . 53199 1 715 . 1 . 1 128 128 LEU CD2 C 13 26.6810 0.0000 . 2 . . . . . 355 LEU CD2 . 53199 1 716 . 1 . 1 128 128 LEU N N 15 124.5735 0.0000 . 1 . . 38000 . . 355 LEU N . 53199 1 717 . 1 . 1 130 130 PRO C C 13 177.5439 0.0000 . 1 . . 56665 . . 357 PRO C . 53199 1 718 . 1 . 1 130 130 PRO CA C 13 61.7661 0.0000 . 1 . . 56666 . . 357 PRO CA . 53199 1 719 . 1 . 1 130 130 PRO CB C 13 30.3770 0.0000 . 1 . . 56675 . . 357 PRO CB . 53199 1 720 . 1 . 1 131 131 SER H H 1 8.8655 0.0000 . 1 . . 38313 . . 358 SER H . 53199 1 721 . 1 . 1 131 131 SER C C 13 176.9018 0.0000 . 1 . . 99216 . . 358 SER C . 53199 1 722 . 1 . 1 131 131 SER CA C 13 57.1982 0.0000 . 1 . . 99212 . . 358 SER CA . 53199 1 723 . 1 . 1 131 131 SER CB C 13 63.3662 0.0000 . 1 . . 99220 . . 358 SER CB . 53199 1 724 . 1 . 1 131 131 SER N N 15 118.0060 0.0000 . 1 . . 38315 . . 358 SER N . 53199 1 725 . 1 . 1 132 132 ARG H H 1 8.9409 0.0000 . 1 . . 37884 . . 359 ARG H . 53199 1 726 . 1 . 1 132 132 ARG C C 13 179.0032 0.0000 . 1 . . 43007 . . 359 ARG C . 53199 1 727 . 1 . 1 132 132 ARG CA C 13 58.9867 0.0000 . 1 . . 43003 . . 359 ARG CA . 53199 1 728 . 1 . 1 132 132 ARG CB C 13 28.8822 0.0000 . 1 . . 43012 . . 359 ARG CB . 53199 1 729 . 1 . 1 132 132 ARG N N 15 128.5555 0.0000 . 1 . . 37886 . . 359 ARG N . 53199 1 730 . 1 . 1 133 133 ASP H H 1 8.2851 0.0000 . 1 . . 38310 . . 360 ASP H . 53199 1 731 . 1 . 1 133 133 ASP C C 13 177.1056 0.0000 . 1 . . 99200 . . 360 ASP C . 53199 1 732 . 1 . 1 133 133 ASP CA C 13 56.1498 0.0000 . 1 . . 99196 . . 360 ASP CA . 53199 1 733 . 1 . 1 133 133 ASP CB C 13 40.4141 0.0000 . 1 . . 99204 . . 360 ASP CB . 53199 1 734 . 1 . 1 133 133 ASP N N 15 117.9180 0.0000 . 1 . . 38312 . . 360 ASP N . 53199 1 735 . 1 . 1 134 134 GLU H H 1 7.6393 0.0000 . 1 . . 38112 . . 361 GLU H . 53199 1 736 . 1 . 1 134 134 GLU C C 13 177.0812 0.0000 . 1 . . 99154 . . 361 GLU C . 53199 1 737 . 1 . 1 134 134 GLU CA C 13 55.6650 0.0000 . 1 . . 49642 . . 361 GLU CA . 53199 1 738 . 1 . 1 134 134 GLU CB C 13 30.1940 0.0000 . 1 . . 99158 . . 361 GLU CB . 53199 1 739 . 1 . 1 134 134 GLU N N 15 122.2737 0.0000 . 1 . . 38114 . . 361 GLU N . 53199 1 740 . 1 . 1 135 135 LEU H H 1 7.1337 0.0000 . 1 . . 38403 . . 362 LEU H . 53199 1 741 . 1 . 1 135 135 LEU HD11 H 1 1.0890 0.0000 . 2 . . 91740 . . 362 LEU HD11 . 53199 1 742 . 1 . 1 135 135 LEU HD12 H 1 1.0890 0.0000 . 2 . . 91740 . . 362 LEU HD11 . 53199 1 743 . 1 . 1 135 135 LEU HD13 H 1 1.0890 0.0000 . 2 . . 91740 . . 362 LEU HD11 . 53199 1 744 . 1 . 1 135 135 LEU HD21 H 1 0.8850 0.0000 . 2 . . 91524 . . 362 LEU HD21 . 53199 1 745 . 1 . 1 135 135 LEU HD22 H 1 0.8850 0.0000 . 2 . . 91524 . . 362 LEU HD21 . 53199 1 746 . 1 . 1 135 135 LEU HD23 H 1 0.8850 0.0000 . 2 . . 91524 . . 362 LEU HD21 . 53199 1 747 . 1 . 1 135 135 LEU C C 13 176.2993 0.0000 . 1 . . 59622 . . 362 LEU C . 53199 1 748 . 1 . 1 135 135 LEU CA C 13 56.2459 0.0000 . 1 . . 59624 . . 362 LEU CA . 53199 1 749 . 1 . 1 135 135 LEU CB C 13 40.0630 0.0000 . 1 . . 59625 . . 362 LEU CB . 53199 1 750 . 1 . 1 135 135 LEU CD1 C 13 25.4920 0.0000 . 2 . . 87402 . . 362 LEU CD1 . 53199 1 751 . 1 . 1 135 135 LEU CD2 C 13 22.5500 0.0000 . 2 . . 87222 . . 362 LEU CD2 . 53199 1 752 . 1 . 1 135 135 LEU N N 15 114.7604 0.0000 . 1 . . 38405 . . 362 LEU N . 53199 1 753 . 1 . 1 136 136 THR H H 1 6.9387 0.0000 . 1 . . 38595 . . 363 THR H . 53199 1 754 . 1 . 1 136 136 THR HG21 H 1 1.3070 0.0000 . 1 . . . . . 363 THR HG21 . 53199 1 755 . 1 . 1 136 136 THR HG22 H 1 1.3070 0.0000 . 1 . . . . . 363 THR HG21 . 53199 1 756 . 1 . 1 136 136 THR HG23 H 1 1.3070 0.0000 . 1 . . . . . 363 THR HG21 . 53199 1 757 . 1 . 1 136 136 THR C C 13 175.5336 0.0000 . 1 . . 64206 . . 363 THR C . 53199 1 758 . 1 . 1 136 136 THR CA C 13 62.0833 0.0000 . 1 . . 64203 . . 363 THR CA . 53199 1 759 . 1 . 1 136 136 THR CB C 13 68.7336 0.0000 . 1 . . 64208 . . 363 THR CB . 53199 1 760 . 1 . 1 136 136 THR CG2 C 13 21.5950 0.0000 . 1 . . 87480 . . 363 THR CG2 . 53199 1 761 . 1 . 1 136 136 THR N N 15 107.3062 0.0000 . 1 . . 38597 . . 363 THR N . 53199 1 762 . 1 . 1 137 137 LYS H H 1 7.8271 0.0000 . 1 . . 38097 . . 364 LYS H . 53199 1 763 . 1 . 1 137 137 LYS C C 13 175.9134 0.0000 . 1 . . 49346 . . 364 LYS C . 53199 1 764 . 1 . 1 137 137 LYS CA C 13 53.8882 0.0000 . 1 . . 49348 . . 364 LYS CA . 53199 1 765 . 1 . 1 137 137 LYS CB C 13 31.9824 0.0000 . 1 . . 49349 . . 364 LYS CB . 53199 1 766 . 1 . 1 137 137 LYS N N 15 122.7365 0.0000 . 1 . . 38099 . . 364 LYS N . 53199 1 767 . 1 . 1 138 138 ASN H H 1 8.3086 0.0000 . 1 . . 34461 . . 365 ASN H . 53199 1 768 . 1 . 1 138 138 ASN C C 13 175.9567 0.0000 . 1 . . 60052 . . 365 ASN C . 53199 1 769 . 1 . 1 138 138 ASN CA C 13 54.3899 0.0000 . 1 . . 60047 . . 365 ASN CA . 53199 1 770 . 1 . 1 138 138 ASN CB C 13 38.1384 0.0000 . 1 . . 60048 . . 365 ASN CB . 53199 1 771 . 1 . 1 138 138 ASN N N 15 114.4937 0.0000 . 1 . . 34463 . . 365 ASN N . 53199 1 772 . 1 . 1 139 139 GLN H H 1 7.3548 0.0000 . 1 . . 32643 . . 366 GLN H . 53199 1 773 . 1 . 1 139 139 GLN C C 13 173.8770 0.0000 . 1 . . 56383 . . 366 GLN C . 53199 1 774 . 1 . 1 139 139 GLN CA C 13 54.5035 0.0000 . 1 . . 56389 . . 366 GLN CA . 53199 1 775 . 1 . 1 139 139 GLN CB C 13 31.1325 0.0000 . 1 . . 56386 . . 366 GLN CB . 53199 1 776 . 1 . 1 139 139 GLN N N 15 118.4673 0.0000 . 1 . . 32645 . . 366 GLN N . 53199 1 777 . 1 . 1 140 140 VAL H H 1 8.6028 0.0000 . 1 . . 38565 . . 367 VAL H . 53199 1 778 . 1 . 1 140 140 VAL HG11 H 1 0.1440 0.0000 . 2 . . 92133 . . 367 VAL HG11 . 53199 1 779 . 1 . 1 140 140 VAL HG12 H 1 0.1440 0.0000 . 2 . . 92133 . . 367 VAL HG11 . 53199 1 780 . 1 . 1 140 140 VAL HG13 H 1 0.1440 0.0000 . 2 . . 92133 . . 367 VAL HG11 . 53199 1 781 . 1 . 1 140 140 VAL HG21 H 1 0.5160 0.0000 . 2 . . 91986 . . 367 VAL HG21 . 53199 1 782 . 1 . 1 140 140 VAL HG22 H 1 0.5160 0.0000 . 2 . . 91986 . . 367 VAL HG21 . 53199 1 783 . 1 . 1 140 140 VAL HG23 H 1 0.5160 0.0000 . 2 . . 91986 . . 367 VAL HG21 . 53199 1 784 . 1 . 1 140 140 VAL C C 13 173.4256 0.0000 . 1 . . 62501 . . 367 VAL C . 53199 1 785 . 1 . 1 140 140 VAL CA C 13 57.3702 0.0000 . 1 . . 62498 . . 367 VAL CA . 53199 1 786 . 1 . 1 140 140 VAL CB C 13 33.9861 0.0000 . 1 . . 62504 . . 367 VAL CB . 53199 1 787 . 1 . 1 140 140 VAL CG1 C 13 17.6820 0.0000 . 2 . . 87819 . . 367 VAL CG1 . 53199 1 788 . 1 . 1 140 140 VAL CG2 C 13 21.6110 0.0000 . 2 . . 87492 . . 367 VAL CG2 . 53199 1 789 . 1 . 1 140 140 VAL N N 15 111.4014 0.0000 . 1 . . 38567 . . 367 VAL N . 53199 1 790 . 1 . 1 141 141 SER H H 1 8.7893 0.0000 . 1 . . 38397 . . 368 SER H . 53199 1 791 . 1 . 1 141 141 SER C C 13 172.8999 0.0000 . 1 . . 93588 . . 368 SER C . 53199 1 792 . 1 . 1 141 141 SER CA C 13 57.0588 0.0000 . 1 . . 93584 . . 368 SER CA . 53199 1 793 . 1 . 1 141 141 SER CB C 13 61.6128 0.0000 . 1 . . 93592 . . 368 SER CB . 53199 1 794 . 1 . 1 141 141 SER N N 15 115.1578 0.0000 . 1 . . 38399 . . 368 SER N . 53199 1 795 . 1 . 1 142 142 LEU H H 1 9.2290 0.0000 . 1 . . 37872 . . 369 LEU H . 53199 1 796 . 1 . 1 142 142 LEU HD11 H 1 -0.0680 0.0000 . 2 . . 92310 . . 369 LEU HD11 . 53199 1 797 . 1 . 1 142 142 LEU HD12 H 1 -0.0680 0.0000 . 2 . . 92310 . . 369 LEU HD11 . 53199 1 798 . 1 . 1 142 142 LEU HD13 H 1 -0.0680 0.0000 . 2 . . 92310 . . 369 LEU HD11 . 53199 1 799 . 1 . 1 142 142 LEU HD21 H 1 -0.1560 0.0000 . 2 . . 92310 . . 369 LEU HD21 . 53199 1 800 . 1 . 1 142 142 LEU HD22 H 1 -0.1560 0.0000 . 2 . . 92310 . . 369 LEU HD21 . 53199 1 801 . 1 . 1 142 142 LEU HD23 H 1 -0.1560 0.0000 . 2 . . 92310 . . 369 LEU HD21 . 53199 1 802 . 1 . 1 142 142 LEU C C 13 175.4107 0.0000 . 1 . . 40074 . . 369 LEU C . 53199 1 803 . 1 . 1 142 142 LEU CA C 13 53.2072 0.0000 . 1 . . 40070 . . 369 LEU CA . 53199 1 804 . 1 . 1 142 142 LEU CB C 13 40.4113 0.0000 . 1 . . 40068 . . 369 LEU CB . 53199 1 805 . 1 . 1 142 142 LEU CD1 C 13 24.9320 0.0000 . 2 . . 87336 . . 369 LEU CD1 . 53199 1 806 . 1 . 1 142 142 LEU CD2 C 13 23.6680 0.0000 . 2 . . 87246 . . 369 LEU CD2 . 53199 1 807 . 1 . 1 142 142 LEU N N 15 129.0998 0.0000 . 1 . . 37874 . . 369 LEU N . 53199 1 808 . 1 . 1 143 143 THR H H 1 7.8846 0.0000 . 1 . . 38304 . . 370 THR H . 53199 1 809 . 1 . 1 143 143 THR HG21 H 1 1.3190 0.0000 . 1 . . 91452 . . 370 THR HG21 . 53199 1 810 . 1 . 1 143 143 THR HG22 H 1 1.3190 0.0000 . 1 . . 91452 . . 370 THR HG21 . 53199 1 811 . 1 . 1 143 143 THR HG23 H 1 1.3190 0.0000 . 1 . . 91452 . . 370 THR HG21 . 53199 1 812 . 1 . 1 143 143 THR C C 13 172.5879 0.0000 . 1 . . 41622 . . 370 THR C . 53199 1 813 . 1 . 1 143 143 THR CA C 13 62.5651 0.0000 . 1 . . 41618 . . 370 THR CA . 53199 1 814 . 1 . 1 143 143 THR CB C 13 70.5332 0.0000 . 1 . . 41613 . . 370 THR CB . 53199 1 815 . 1 . 1 143 143 THR CG2 C 13 24.2350 0.0000 . 1 . . 87267 . . 370 THR CG2 . 53199 1 816 . 1 . 1 143 143 THR N N 15 118.1645 0.0000 . 1 . . 38306 . . 370 THR N . 53199 1 817 . 1 . 1 144 144 CYS H H 1 9.7029 0.0000 . 1 . . 37875 . . 371 CYS H . 53199 1 818 . 1 . 1 144 144 CYS C C 13 171.9956 0.0000 . 1 . . 40082 . . 371 CYS C . 53199 1 819 . 1 . 1 144 144 CYS CA C 13 53.6130 0.0000 . 1 . . 40084 . . 371 CYS CA . 53199 1 820 . 1 . 1 144 144 CYS CB C 13 41.9521 0.0000 . 1 . . 40085 . . 371 CYS CB . 53199 1 821 . 1 . 1 144 144 CYS N N 15 129.1933 0.0000 . 1 . . 37877 . . 371 CYS N . 53199 1 822 . 1 . 1 145 145 LEU H H 1 9.3588 0.0000 . 1 . . 31455 . . 372 LEU H . 53199 1 823 . 1 . 1 145 145 LEU HD11 H 1 0.6720 0.0000 . 2 . . 91887 . . 372 LEU HD11 . 53199 1 824 . 1 . 1 145 145 LEU HD12 H 1 0.6720 0.0000 . 2 . . 91887 . . 372 LEU HD11 . 53199 1 825 . 1 . 1 145 145 LEU HD13 H 1 0.6720 0.0000 . 2 . . 91887 . . 372 LEU HD11 . 53199 1 826 . 1 . 1 145 145 LEU HD21 H 1 0.1470 0.0000 . 2 . . 92121 . . 372 LEU HD21 . 53199 1 827 . 1 . 1 145 145 LEU HD22 H 1 0.1470 0.0000 . 2 . . 92121 . . 372 LEU HD21 . 53199 1 828 . 1 . 1 145 145 LEU HD23 H 1 0.1470 0.0000 . 2 . . 92121 . . 372 LEU HD21 . 53199 1 829 . 1 . 1 145 145 LEU C C 13 172.9167 0.0000 . 1 . . 42830 . . 372 LEU C . 53199 1 830 . 1 . 1 145 145 LEU CA C 13 53.4079 0.0000 . 1 . . 42837 . . 372 LEU CA . 53199 1 831 . 1 . 1 145 145 LEU CB C 13 41.3938 0.0000 . 1 . . 42835 . . 372 LEU CB . 53199 1 832 . 1 . 1 145 145 LEU CD1 C 13 24.9750 0.0000 . 2 . . 92860 . . 372 LEU CD1 . 53199 1 833 . 1 . 1 145 145 LEU CD2 C 13 20.9310 0.0000 . 2 . . 87234 . . 372 LEU CD2 . 53199 1 834 . 1 . 1 145 145 LEU N N 15 131.6772 0.0000 . 1 . . 31457 . . 372 LEU N . 53199 1 835 . 1 . 1 146 146 VAL H H 1 8.2481 0.0000 . 1 . . 37899 . . 373 VAL H . 53199 1 836 . 1 . 1 146 146 VAL HG11 H 1 0.5770 0.0000 . 2 . . 92959 . . 373 VAL HG11 . 53199 1 837 . 1 . 1 146 146 VAL HG12 H 1 0.5770 0.0000 . 2 . . 92959 . . 373 VAL HG11 . 53199 1 838 . 1 . 1 146 146 VAL HG13 H 1 0.5770 0.0000 . 2 . . 92959 . . 373 VAL HG11 . 53199 1 839 . 1 . 1 146 146 VAL HG21 H 1 0.5720 0.0000 . 2 . . 92953 . . 373 VAL HG21 . 53199 1 840 . 1 . 1 146 146 VAL HG22 H 1 0.5720 0.0000 . 2 . . 92953 . . 373 VAL HG21 . 53199 1 841 . 1 . 1 146 146 VAL HG23 H 1 0.5720 0.0000 . 2 . . 92953 . . 373 VAL HG21 . 53199 1 842 . 1 . 1 146 146 VAL C C 13 174.8409 0.0000 . 1 . . 43278 . . 373 VAL C . 53199 1 843 . 1 . 1 146 146 VAL CA C 13 60.0402 0.0000 . 1 . . 43275 . . 373 VAL CA . 53199 1 844 . 1 . 1 146 146 VAL CB C 13 31.6668 0.0000 . 1 . . 43282 . . 373 VAL CB . 53199 1 845 . 1 . 1 146 146 VAL CG1 C 13 21.7110 0.0000 . 2 . . 87444 . . 373 VAL CG1 . 53199 1 846 . 1 . 1 146 146 VAL CG2 C 13 23.4660 0.0000 . 2 . . 87360 . . 373 VAL CG2 . 53199 1 847 . 1 . 1 146 146 VAL N N 15 127.7780 0.0000 . 1 . . 37901 . . 373 VAL N . 53199 1 848 . 1 . 1 147 147 LYS H H 1 9.2436 0.0000 . 1 . . 38076 . . 374 LYS H . 53199 1 849 . 1 . 1 147 147 LYS C C 13 174.7934 0.0000 . 1 . . 48988 . . 374 LYS C . 53199 1 850 . 1 . 1 147 147 LYS CA C 13 54.2506 0.0000 . 1 . . 48978 . . 374 LYS CA . 53199 1 851 . 1 . 1 147 147 LYS CB C 13 35.5525 0.0000 . 1 . . 48979 . . 374 LYS CB . 53199 1 852 . 1 . 1 147 147 LYS N N 15 122.8792 0.0000 . 1 . . 38078 . . 374 LYS N . 53199 1 853 . 1 . 1 148 148 GLY H H 1 8.2062 0.0000 . 1 . . 32085 . . 375 GLY H . 53199 1 854 . 1 . 1 148 148 GLY C C 13 174.2317 0.0000 . 1 . . 62467 . . 375 GLY C . 53199 1 855 . 1 . 1 148 148 GLY CA C 13 45.5153 0.0000 . 1 . . 62464 . . 375 GLY CA . 53199 1 856 . 1 . 1 148 148 GLY N N 15 111.3811 0.0000 . 1 . . 32087 . . 375 GLY N . 53199 1 857 . 1 . 1 149 149 PHE H H 1 7.7192 0.0000 . 1 . . 38544 . . 376 PHE H . 53199 1 858 . 1 . 1 149 149 PHE C C 13 174.5801 0.0000 . 1 . . 61978 . . 376 PHE C . 53199 1 859 . 1 . 1 149 149 PHE CA C 13 53.9520 0.0000 . 1 . . 61975 . . 376 PHE CA . 53199 1 860 . 1 . 1 149 149 PHE CB C 13 41.5042 0.0000 . 1 . . 61982 . . 376 PHE CB . 53199 1 861 . 1 . 1 149 149 PHE N N 15 112.0006 0.0000 . 1 . . 38546 . . 376 PHE N . 53199 1 862 . 1 . 1 150 150 TYR H H 1 8.2523 0.0000 . 1 . . 35676 . . 377 TYR H . 53199 1 863 . 1 . 1 150 150 TYR CA C 13 58.8715 0.0000 . 1 . . 52945 . . 377 TYR CA . 53199 1 864 . 1 . 1 150 150 TYR CB C 13 42.0432 0.0000 . 1 . . 52950 . . 377 TYR CB . 53199 1 865 . 1 . 1 150 150 TYR N N 15 120.2005 0.0000 . 1 . . 35678 . . 377 TYR N . 53199 1 866 . 1 . 1 151 151 PRO C C 13 176.1483 0.0000 . 1 . . 95728 . . 378 PRO C . 53199 1 867 . 1 . 1 151 151 PRO CA C 13 62.3229 0.0000 . 1 . . 61789 . . 378 PRO CA . 53199 1 868 . 1 . 1 151 151 PRO CB C 13 33.6616 0.0000 . 1 . . 61799 . . 378 PRO CB . 53199 1 869 . 1 . 1 152 152 SER H H 1 8.0307 0.0000 . 1 . . 32892 . . 379 SER H . 53199 1 870 . 1 . 1 152 152 SER C C 13 173.0604 0.0000 . 1 . . 101346 . . 379 SER C . 53199 1 871 . 1 . 1 152 152 SER CA C 13 59.8347 0.0000 . 1 . . 61790 . . 379 SER CA . 53199 1 872 . 1 . 1 152 152 SER CB C 13 61.2106 0.0000 . 1 . . 101350 . . 379 SER CB . 53199 1 873 . 1 . 1 152 152 SER N N 15 111.9581 0.0000 . 1 . . 32894 . . 379 SER N . 53199 1 874 . 1 . 1 153 153 ASP H H 1 6.7730 0.0000 . 1 . . 38199 . . 380 ASP H . 53199 1 875 . 1 . 1 153 153 ASP C C 13 173.2394 0.0000 . 1 . . 52022 . . 380 ASP C . 53199 1 876 . 1 . 1 153 153 ASP CA C 13 54.5819 0.0000 . 1 . . 52024 . . 380 ASP CA . 53199 1 877 . 1 . 1 153 153 ASP CB C 13 40.4989 0.0000 . 1 . . 52025 . . 380 ASP CB . 53199 1 878 . 1 . 1 153 153 ASP N N 15 120.7654 0.0000 . 1 . . 38201 . . 380 ASP N . 53199 1 879 . 1 . 1 154 154 ILE H H 1 7.8725 0.0000 . 1 . . 38037 . . 381 ILE H . 53199 1 880 . 1 . 1 154 154 ILE HG21 H 1 0.5430 0.0000 . 1 . . 91944 . . 381 ILE HG21 . 53199 1 881 . 1 . 1 154 154 ILE HG22 H 1 0.5430 0.0000 . 1 . . 91944 . . 381 ILE HG21 . 53199 1 882 . 1 . 1 154 154 ILE HG23 H 1 0.5430 0.0000 . 1 . . 91944 . . 381 ILE HG21 . 53199 1 883 . 1 . 1 154 154 ILE HD11 H 1 -0.6000 0.0000 . 1 . . 91944 . . 381 ILE HD11 . 53199 1 884 . 1 . 1 154 154 ILE HD12 H 1 -0.6000 0.0000 . 1 . . 91944 . . 381 ILE HD11 . 53199 1 885 . 1 . 1 154 154 ILE HD13 H 1 -0.6000 0.0000 . 1 . . 91944 . . 381 ILE HD11 . 53199 1 886 . 1 . 1 154 154 ILE C C 13 171.3461 0.0000 . 1 . . 100523 . . 381 ILE C . 53199 1 887 . 1 . 1 154 154 ILE CA C 13 59.9925 0.0000 . 1 . . 99326 . . 381 ILE CA . 53199 1 888 . 1 . 1 154 154 ILE CG2 C 13 15.6930 0.0000 . 1 . . . . . 381 ILE CG2 . 53199 1 889 . 1 . 1 154 154 ILE CD1 C 13 12.9840 0.0000 . 1 . . . . . 381 ILE CD1 . 53199 1 890 . 1 . 1 154 154 ILE N N 15 123.9771 0.0000 . 1 . . 38039 . . 381 ILE N . 53199 1 891 . 1 . 1 155 155 ALA H H 1 8.0650 0.0000 . 1 . . 33888 . . 382 ALA H . 53199 1 892 . 1 . 1 155 155 ALA C C 13 175.0211 0.0000 . 1 . . 100509 . . 382 ALA C . 53199 1 893 . 1 . 1 155 155 ALA CA C 13 50.5875 0.0000 . 1 . . 100505 . . 382 ALA CA . 53199 1 894 . 1 . 1 155 155 ALA CB C 13 21.6283 0.0000 . 1 . . 100511 . . 382 ALA CB . 53199 1 895 . 1 . 1 155 155 ALA N N 15 126.6750 0.0000 . 1 . . 33890 . . 382 ALA N . 53199 1 896 . 1 . 1 156 156 VAL H H 1 8.0752 0.0000 . 1 . . 30927 . . 383 VAL H . 53199 1 897 . 1 . 1 156 156 VAL HG11 H 1 0.5470 0.0000 . 2 . . . . . 383 VAL HG11 . 53199 1 898 . 1 . 1 156 156 VAL HG12 H 1 0.5470 0.0000 . 2 . . . . . 383 VAL HG11 . 53199 1 899 . 1 . 1 156 156 VAL HG13 H 1 0.5470 0.0000 . 2 . . . . . 383 VAL HG11 . 53199 1 900 . 1 . 1 156 156 VAL HG21 H 1 0.7460 0.0000 . 2 . . . . . 383 VAL HG21 . 53199 1 901 . 1 . 1 156 156 VAL HG22 H 1 0.7460 0.0000 . 2 . . . . . 383 VAL HG21 . 53199 1 902 . 1 . 1 156 156 VAL HG23 H 1 0.7460 0.0000 . 2 . . . . . 383 VAL HG21 . 53199 1 903 . 1 . 1 156 156 VAL C C 13 174.6953 0.0000 . 1 . . 98650 . . 383 VAL C . 53199 1 904 . 1 . 1 156 156 VAL CA C 13 60.5116 0.0000 . 1 . . 98646 . . 383 VAL CA . 53199 1 905 . 1 . 1 156 156 VAL CB C 13 34.3824 0.0000 . 1 . . 98654 . . 383 VAL CB . 53199 1 906 . 1 . 1 156 156 VAL CG1 C 13 20.6930 0.0000 . 2 . . 92893 . . 383 VAL CG1 . 53199 1 907 . 1 . 1 156 156 VAL CG2 C 13 22.0360 0.0000 . 2 . . 87531 . . 383 VAL CG2 . 53199 1 908 . 1 . 1 156 156 VAL N N 15 122.5204 0.0000 . 1 . . 30929 . . 383 VAL N . 53199 1 909 . 1 . 1 157 157 GLU H H 1 8.7997 0.0000 . 1 . . 37944 . . 384 GLU H . 53199 1 910 . 1 . 1 157 157 GLU C C 13 172.9288 0.0000 . 1 . . 92975 . . 384 GLU C . 53199 1 911 . 1 . 1 157 157 GLU CA C 13 54.3800 0.0000 . 1 . . 92971 . . 384 GLU CA . 53199 1 912 . 1 . 1 157 157 GLU N N 15 126.0018 0.0000 . 1 . . 37946 . . 384 GLU N . 53199 1 913 . 1 . 1 158 158 TRP H H 1 5.9970 0.0000 . 1 . . 67803 . . 385 TRP H . 53199 1 914 . 1 . 1 158 158 TRP C C 13 176.4075 0.0000 . 1 . . 68180 . . 385 TRP C . 53199 1 915 . 1 . 1 158 158 TRP CA C 13 55.3440 0.0000 . 1 . . 68030 . . 385 TRP CA . 53199 1 916 . 1 . 1 158 158 TRP CB C 13 33.5510 0.0000 . 1 . . 68190 . . 385 TRP CB . 53199 1 917 . 1 . 1 158 158 TRP N N 15 116.5959 0.0000 . 1 . . 67805 . . 385 TRP N . 53199 1 918 . 1 . 1 159 159 GLU H H 1 9.0415 0.0000 . 1 . . 38283 . . 386 GLU H . 53199 1 919 . 1 . 1 159 159 GLU C C 13 175.1737 0.0000 . 1 . . 68208 . . 386 GLU C . 53199 1 920 . 1 . 1 159 159 GLU CA C 13 54.5303 0.0000 . 1 . . 56285 . . 386 GLU CA . 53199 1 921 . 1 . 1 159 159 GLU CB C 13 33.5858 0.0000 . 1 . . 68212 . . 386 GLU CB . 53199 1 922 . 1 . 1 159 159 GLU N N 15 118.5061 0.0000 . 1 . . 38285 . . 386 GLU N . 53199 1 923 . 1 . 1 160 160 SER H H 1 8.8863 0.0000 . 1 . . 32049 . . 387 SER H . 53199 1 924 . 1 . 1 160 160 SER C C 13 175.5119 0.0000 . 1 . . 98696 . . 387 SER C . 53199 1 925 . 1 . 1 160 160 SER CA C 13 57.5465 0.0000 . 1 . . 68111 . . 387 SER CA . 53199 1 926 . 1 . 1 160 160 SER CB C 13 64.4413 0.0000 . 1 . . 98700 . . 387 SER CB . 53199 1 927 . 1 . 1 160 160 SER N N 15 113.5614 0.0000 . 1 . . 32051 . . 387 SER N . 53199 1 928 . 1 . 1 161 161 ASN H H 1 9.3404 0.0000 . 1 . . 31536 . . 388 ASN H . 53199 1 929 . 1 . 1 161 161 ASN C C 13 175.3816 0.0000 . 1 . . 98752 . . 388 ASN C . 53199 1 930 . 1 . 1 161 161 ASN CA C 13 53.8217 0.0000 . 1 . . 98720 . . 388 ASN CA . 53199 1 931 . 1 . 1 161 161 ASN CB C 13 37.0320 0.0000 . 1 . . 98756 . . 388 ASN CB . 53199 1 932 . 1 . 1 161 161 ASN N N 15 126.7017 0.0000 . 1 . . 31538 . . 388 ASN N . 53199 1 933 . 1 . 1 162 162 GLY H H 1 8.6173 0.0000 . 1 . . 38604 . . 389 GLY H . 53199 1 934 . 1 . 1 162 162 GLY C C 13 173.7800 0.0000 . 1 . . 98740 . . 389 GLY C . 53199 1 935 . 1 . 1 162 162 GLY CA C 13 45.0821 0.0000 . 1 . . 95971 . . 389 GLY CA . 53199 1 936 . 1 . 1 162 162 GLY N N 15 104.0541 0.0000 . 1 . . 38606 . . 389 GLY N . 53199 1 937 . 1 . 1 163 163 GLN H H 1 7.8773 0.0000 . 1 . . 32574 . . 390 GLN H . 53199 1 938 . 1 . 1 163 163 GLN C C 13 173.1291 0.0000 . 1 . . 41327 . . 390 GLN C . 53199 1 939 . 1 . 1 163 163 GLN CA C 13 51.9008 0.0000 . 1 . . 41333 . . 390 GLN CA . 53199 1 940 . 1 . 1 163 163 GLN CB C 13 29.3085 0.0000 . 1 . . 41332 . . 390 GLN CB . 53199 1 941 . 1 . 1 163 163 GLN N N 15 120.3930 0.0000 . 1 . . 32576 . . 390 GLN N . 53199 1 942 . 1 . 1 164 164 PRO C C 13 177.3161 0.0000 . 1 . . 47368 . . 391 PRO C . 53199 1 943 . 1 . 1 164 164 PRO CA C 13 63.4557 0.0000 . 1 . . 47369 . . 391 PRO CA . 53199 1 944 . 1 . 1 164 164 PRO CB C 13 31.3645 0.0000 . 1 . . 47374 . . 391 PRO CB . 53199 1 945 . 1 . 1 165 165 GLU H H 1 8.0985 0.0000 . 1 . . 31665 . . 392 GLU H . 53199 1 946 . 1 . 1 165 165 GLU C C 13 175.9077 0.0000 . 1 . . 93881 . . 392 GLU C . 53199 1 947 . 1 . 1 165 165 GLU CA C 13 54.7521 0.0000 . 1 . . 66110 . . 392 GLU CA . 53199 1 948 . 1 . 1 165 165 GLU CB C 13 31.4019 0.0000 . 1 . . 93891 . . 392 GLU CB . 53199 1 949 . 1 . 1 165 165 GLU N N 15 123.7847 0.0000 . 1 . . 31667 . . 392 GLU N . 53199 1 950 . 1 . 1 166 166 ASN H H 1 8.3832 0.0000 . 1 . . 70881 . . 393 ASN H . 53199 1 951 . 1 . 1 166 166 ASN C C 13 176.4424 0.0000 . 1 . . 73154 . . 393 ASN C . 53199 1 952 . 1 . 1 166 166 ASN CA C 13 53.5834 0.0000 . 1 . . 73156 . . 393 ASN CA . 53199 1 953 . 1 . 1 166 166 ASN N N 15 116.1199 0.0000 . 1 . . 70883 . . 393 ASN N . 53199 1 954 . 1 . 1 167 167 ASN H H 1 8.3389 0.0000 . 1 . . 38205 . . 394 ASN H . 53199 1 955 . 1 . 1 167 167 ASN C C 13 173.2482 0.0000 . 1 . . 52231 . . 394 ASN C . 53199 1 956 . 1 . 1 167 167 ASN CA C 13 51.9806 0.0000 . 1 . . 52229 . . 394 ASN CA . 53199 1 957 . 1 . 1 167 167 ASN N N 15 120.8181 0.0000 . 1 . . 38207 . . 394 ASN N . 53199 1 958 . 1 . 1 168 168 TYR H H 1 7.4801 0.0000 . 1 . . 31293 . . 395 TYR H . 53199 1 959 . 1 . 1 168 168 TYR C C 13 174.0346 0.0000 . 1 . . 41851 . . 395 TYR C . 53199 1 960 . 1 . 1 168 168 TYR CA C 13 53.9798 0.0000 . 1 . . 41856 . . 395 TYR CA . 53199 1 961 . 1 . 1 168 168 TYR CB C 13 42.4899 0.0000 . 1 . . 41857 . . 395 TYR CB . 53199 1 962 . 1 . 1 168 168 TYR N N 15 115.8128 0.0000 . 1 . . 31295 . . 395 TYR N . 53199 1 963 . 1 . 1 169 169 LYS H H 1 8.4066 0.0000 . 1 . . 38259 . . 396 LYS H . 53199 1 964 . 1 . 1 169 169 LYS C C 13 174.9086 0.0000 . 1 . . 55513 . . 396 LYS C . 53199 1 965 . 1 . 1 169 169 LYS CA C 13 53.7883 0.0000 . 1 . . 55512 . . 396 LYS CA . 53199 1 966 . 1 . 1 169 169 LYS CB C 13 38.0134 0.0000 . 1 . . 55517 . . 396 LYS CB . 53199 1 967 . 1 . 1 169 169 LYS N N 15 119.5988 0.0000 . 1 . . 38261 . . 396 LYS N . 53199 1 968 . 1 . 1 170 170 THR H H 1 9.0344 0.0000 . 1 . . 38154 . . 397 THR H . 53199 1 969 . 1 . 1 170 170 THR HG21 H 1 1.6020 0.0000 . 1 . . 91281 . . 397 THR HG21 . 53199 1 970 . 1 . 1 170 170 THR HG22 H 1 1.6020 0.0000 . 1 . . 91281 . . 397 THR HG21 . 53199 1 971 . 1 . 1 170 170 THR HG23 H 1 1.6020 0.0000 . 1 . . 91281 . . 397 THR HG21 . 53199 1 972 . 1 . 1 170 170 THR C C 13 174.2923 0.0000 . 1 . . 41125 . . 397 THR C . 53199 1 973 . 1 . 1 170 170 THR CA C 13 60.7099 0.0000 . 1 . . 41117 . . 397 THR CA . 53199 1 974 . 1 . 1 170 170 THR CB C 13 70.4095 0.0000 . 1 . . 41123 . . 397 THR CB . 53199 1 975 . 1 . 1 170 170 THR CG2 C 13 24.4540 0.0000 . 1 . . 87255 . . 397 THR CG2 . 53199 1 976 . 1 . 1 170 170 THR N N 15 121.6179 0.0000 . 1 . . 38156 . . 397 THR N . 53199 1 977 . 1 . 1 171 171 THR H H 1 9.4899 0.0000 . 1 . . 30447 . . 398 THR H . 53199 1 978 . 1 . 1 171 171 THR C C 13 171.5870 0.0000 . 1 . . 56431 . . 398 THR C . 53199 1 979 . 1 . 1 171 171 THR CA C 13 61.3185 0.0000 . 1 . . 56435 . . 398 THR CA . 53199 1 980 . 1 . 1 171 171 THR CB C 13 68.1715 0.0000 . 1 . . 56434 . . 398 THR CB . 53199 1 981 . 1 . 1 171 171 THR N N 15 118.5592 0.0000 . 1 . . 30449 . . 398 THR N . 53199 1 982 . 1 . 1 173 173 PRO C C 13 176.5687 0.0000 . 1 . . 43944 . . 400 PRO C . 53199 1 983 . 1 . 1 173 173 PRO CA C 13 62.0221 0.0000 . 1 . . 43938 . . 400 PRO CA . 53199 1 984 . 1 . 1 173 173 PRO CB C 13 31.1733 0.0000 . 1 . . 43945 . . 400 PRO CB . 53199 1 985 . 1 . 1 174 174 VAL H H 1 9.1806 0.0000 . 1 . . 31551 . . 401 VAL H . 53199 1 986 . 1 . 1 174 174 VAL HG11 H 1 0.8190 0.0000 . 2 . . 91815 . . 401 VAL HG11 . 53199 1 987 . 1 . 1 174 174 VAL HG12 H 1 0.8190 0.0000 . 2 . . 91815 . . 401 VAL HG11 . 53199 1 988 . 1 . 1 174 174 VAL HG13 H 1 0.8190 0.0000 . 2 . . 91815 . . 401 VAL HG11 . 53199 1 989 . 1 . 1 174 174 VAL HG21 H 1 0.8350 0.0000 . 2 . . 91815 . . 401 VAL HG21 . 53199 1 990 . 1 . 1 174 174 VAL HG22 H 1 0.8350 0.0000 . 2 . . 91815 . . 401 VAL HG21 . 53199 1 991 . 1 . 1 174 174 VAL HG23 H 1 0.8350 0.0000 . 2 . . 91815 . . 401 VAL HG21 . 53199 1 992 . 1 . 1 174 174 VAL C C 13 174.3359 0.0000 . 1 . . 43941 . . 401 VAL C . 53199 1 993 . 1 . 1 174 174 VAL CA C 13 60.4264 0.0000 . 1 . . 43947 . . 401 VAL CA . 53199 1 994 . 1 . 1 174 174 VAL CB C 13 33.0693 0.0000 . 1 . . 43946 . . 401 VAL CB . 53199 1 995 . 1 . 1 174 174 VAL CG1 C 13 21.9340 0.0000 . 2 . . 87408 . . 401 VAL CG1 . 53199 1 996 . 1 . 1 174 174 VAL CG2 C 13 21.8180 0.0000 . 2 . . 92857 . . 401 VAL CG2 . 53199 1 997 . 1 . 1 174 174 VAL N N 15 126.5534 0.0000 . 1 . . 31553 . . 401 VAL N . 53199 1 998 . 1 . 1 175 175 LEU H H 1 8.2760 0.0000 . 1 . . 30171 . . 402 LEU H . 53199 1 999 . 1 . 1 175 175 LEU HD11 H 1 0.2310 0.0000 . 2 . . 92052 . . 402 LEU HD11 . 53199 1 1000 . 1 . 1 175 175 LEU HD12 H 1 0.2310 0.0000 . 2 . . 92052 . . 402 LEU HD11 . 53199 1 1001 . 1 . 1 175 175 LEU HD13 H 1 0.2310 0.0000 . 2 . . 92052 . . 402 LEU HD11 . 53199 1 1002 . 1 . 1 175 175 LEU HD21 H 1 0.7050 0.0000 . 2 . . 91938 . . 402 LEU HD21 . 53199 1 1003 . 1 . 1 175 175 LEU HD22 H 1 0.7050 0.0000 . 2 . . 91938 . . 402 LEU HD21 . 53199 1 1004 . 1 . 1 175 175 LEU HD23 H 1 0.7050 0.0000 . 2 . . 91938 . . 402 LEU HD21 . 53199 1 1005 . 1 . 1 175 175 LEU C C 13 175.4335 0.0000 . 1 . . 43070 . . 402 LEU C . 53199 1 1006 . 1 . 1 175 175 LEU CA C 13 55.4253 0.0000 . 1 . . 43071 . . 402 LEU CA . 53199 1 1007 . 1 . 1 175 175 LEU CB C 13 41.1226 0.0000 . 1 . . 43078 . . 402 LEU CB . 53199 1 1008 . 1 . 1 175 175 LEU CD1 C 13 22.8120 0.0000 . 2 . . 87384 . . 402 LEU CD1 . 53199 1 1009 . 1 . 1 175 175 LEU CD2 C 13 25.7430 0.0000 . 2 . . 87213 . . 402 LEU CD2 . 53199 1 1010 . 1 . 1 175 175 LEU N N 15 128.2096 0.0000 . 1 . . 30173 . . 402 LEU N . 53199 1 1011 . 1 . 1 176 176 ASP H H 1 9.4864 0.0000 . 1 . . 31473 . . 403 ASP H . 53199 1 1012 . 1 . 1 176 176 ASP C C 13 178.4345 0.0000 . 1 . . 40043 . . 403 ASP C . 53199 1 1013 . 1 . 1 176 176 ASP CA C 13 51.1207 0.0000 . 1 . . 40048 . . 403 ASP CA . 53199 1 1014 . 1 . 1 176 176 ASP CB C 13 43.0610 0.0000 . 1 . . 40049 . . 403 ASP CB . 53199 1 1015 . 1 . 1 176 176 ASP N N 15 129.2126 0.0000 . 1 . . 31475 . . 403 ASP N . 53199 1 1016 . 1 . 1 177 177 SER H H 1 9.7283 0.0000 . 1 . . 31959 . . 404 SER H . 53199 1 1017 . 1 . 1 177 177 SER C C 13 174.3057 0.0000 . 1 . . 41703 . . 404 SER C . 53199 1 1018 . 1 . 1 177 177 SER CA C 13 60.1409 0.0000 . 1 . . 41707 . . 404 SER CA . 53199 1 1019 . 1 . 1 177 177 SER CB C 13 62.9562 0.0000 . 1 . . 41710 . . 404 SER CB . 53199 1 1020 . 1 . 1 177 177 SER N N 15 116.6901 0.0000 . 1 . . 31961 . . 404 SER N . 53199 1 1021 . 1 . 1 178 178 ASP H H 1 7.5181 0.0000 . 1 . . 31932 . . 405 ASP H . 53199 1 1022 . 1 . 1 178 178 ASP C C 13 177.4973 0.0000 . 1 . . 56754 . . 405 ASP C . 53199 1 1023 . 1 . 1 178 178 ASP CA C 13 52.2202 0.0000 . 1 . . 56757 . . 405 ASP CA . 53199 1 1024 . 1 . 1 178 178 ASP CB C 13 39.9387 0.0000 . 1 . . 56758 . . 405 ASP CB . 53199 1 1025 . 1 . 1 178 178 ASP N N 15 117.9601 0.0000 . 1 . . 31934 . . 405 ASP N . 53199 1 1026 . 1 . 1 179 179 GLY H H 1 7.6232 0.0000 . 1 . . 38589 . . 406 GLY H . 53199 1 1027 . 1 . 1 179 179 GLY C C 13 172.6854 0.0000 . 1 . . 63993 . . 406 GLY C . 53199 1 1028 . 1 . 1 179 179 GLY CA C 13 45.3226 0.0000 . 1 . . 63995 . . 406 GLY CA . 53199 1 1029 . 1 . 1 179 179 GLY N N 15 108.1096 0.0000 . 1 . . 38591 . . 406 GLY N . 53199 1 1030 . 1 . 1 180 180 SER H H 1 7.4748 0.0000 . 1 . . 38391 . . 407 SER H . 53199 1 1031 . 1 . 1 180 180 SER C C 13 170.5851 0.0000 . 1 . . 41886 . . 407 SER C . 53199 1 1032 . 1 . 1 180 180 SER CA C 13 56.7782 0.0000 . 1 . . 41884 . . 407 SER CA . 53199 1 1033 . 1 . 1 180 180 SER CB C 13 64.5746 0.0000 . 1 . . 41890 . . 407 SER CB . 53199 1 1034 . 1 . 1 180 180 SER N N 15 115.4573 0.0000 . 1 . . 38393 . . 407 SER N . 53199 1 1035 . 1 . 1 181 181 PHE H H 1 8.6303 0.0000 . 1 . . 31980 . . 408 PHE H . 53199 1 1036 . 1 . 1 181 181 PHE C C 13 174.2408 0.0000 . 1 . . 41820 . . 408 PHE C . 53199 1 1037 . 1 . 1 181 181 PHE CA C 13 57.2983 0.0000 . 1 . . 41818 . . 408 PHE CA . 53199 1 1038 . 1 . 1 181 181 PHE CB C 13 42.5051 0.0000 . 1 . . 41824 . . 408 PHE CB . 53199 1 1039 . 1 . 1 181 181 PHE N N 15 116.0644 0.0000 . 1 . . 31982 . . 408 PHE N . 53199 1 1040 . 1 . 1 182 182 PHE H H 1 8.6526 0.0000 . 1 . . 32070 . . 409 PHE H . 53199 1 1041 . 1 . 1 182 182 PHE C C 13 172.4545 0.0000 . 1 . . 61914 . . 409 PHE C . 53199 1 1042 . 1 . 1 182 182 PHE CA C 13 55.8004 0.0000 . 1 . . 61916 . . 409 PHE CA . 53199 1 1043 . 1 . 1 182 182 PHE CB C 13 42.5590 0.0000 . 1 . . 61920 . . 409 PHE CB . 53199 1 1044 . 1 . 1 182 182 PHE N N 15 112.0593 0.0000 . 1 . . 32072 . . 409 PHE N . 53199 1 1045 . 1 . 1 183 183 LEU H H 1 9.5052 0.0000 . 1 . . 38400 . . 410 LEU H . 53199 1 1046 . 1 . 1 183 183 LEU HD11 H 1 0.6890 0.0000 . 2 . . 91833 . . 410 LEU HD11 . 53199 1 1047 . 1 . 1 183 183 LEU HD12 H 1 0.6890 0.0000 . 2 . . 91833 . . 410 LEU HD11 . 53199 1 1048 . 1 . 1 183 183 LEU HD13 H 1 0.6890 0.0000 . 2 . . 91833 . . 410 LEU HD11 . 53199 1 1049 . 1 . 1 183 183 LEU HD21 H 1 0.8080 0.0000 . 2 . . 92962 . . 410 LEU HD21 . 53199 1 1050 . 1 . 1 183 183 LEU HD22 H 1 0.8080 0.0000 . 2 . . 92962 . . 410 LEU HD21 . 53199 1 1051 . 1 . 1 183 183 LEU HD23 H 1 0.8080 0.0000 . 2 . . 92962 . . 410 LEU HD21 . 53199 1 1052 . 1 . 1 183 183 LEU C C 13 174.4194 0.0000 . 1 . . 59581 . . 410 LEU C . 53199 1 1053 . 1 . 1 183 183 LEU CA C 13 54.4400 0.0000 . 1 . . 59587 . . 410 LEU CA . 53199 1 1054 . 1 . 1 183 183 LEU CB C 13 43.7828 0.0000 . 1 . . 59584 . . 410 LEU CB . 53199 1 1055 . 1 . 1 183 183 LEU CD1 C 13 23.6620 0.0000 . 2 . . 87342 . . 410 LEU CD1 . 53199 1 1056 . 1 . 1 183 183 LEU CD2 C 13 27.8610 0.0000 . 2 . . 87120 . . 410 LEU CD2 . 53199 1 1057 . 1 . 1 183 183 LEU N N 15 115.1138 0.0000 . 1 . . 38402 . . 410 LEU N . 53199 1 1058 . 1 . 1 184 184 TYR H H 1 7.9937 0.0000 . 1 . . 31983 . . 411 TYR H . 53199 1 1059 . 1 . 1 184 184 TYR C C 13 175.1008 0.0000 . 1 . . 41808 . . 411 TYR C . 53199 1 1060 . 1 . 1 184 184 TYR CA C 13 56.3660 0.0000 . 1 . . 41817 . . 411 TYR CA . 53199 1 1061 . 1 . 1 184 184 TYR CB C 13 44.8299 0.0000 . 1 . . 41816 . . 411 TYR CB . 53199 1 1062 . 1 . 1 184 184 TYR N N 15 115.9937 0.0000 . 1 . . 31985 . . 411 TYR N . 53199 1 1063 . 1 . 1 185 185 SER H H 1 9.2957 0.0000 . 1 . . 31317 . . 412 SER H . 53199 1 1064 . 1 . 1 185 185 SER C C 13 173.2175 0.0000 . 1 . . 59654 . . 412 SER C . 53199 1 1065 . 1 . 1 185 185 SER CA C 13 56.9137 0.0000 . 1 . . 59652 . . 412 SER CA . 53199 1 1066 . 1 . 1 185 185 SER CB C 13 64.8975 0.0000 . 1 . . 59656 . . 412 SER CB . 53199 1 1067 . 1 . 1 185 185 SER N N 15 114.7910 0.0000 . 1 . . 31319 . . 412 SER N . 53199 1 1068 . 1 . 1 186 186 LYS H H 1 9.4764 0.0000 . 1 . . 37845 . . 413 LYS H . 53199 1 1069 . 1 . 1 186 186 LYS C C 13 175.1232 0.0000 . 1 . . 93145 . . 413 LYS C . 53199 1 1070 . 1 . 1 186 186 LYS CA C 13 54.9761 0.0000 . 1 . . 93150 . . 413 LYS CA . 53199 1 1071 . 1 . 1 186 186 LYS CB C 13 33.4903 0.0000 . 1 . . 93281 . . 413 LYS CB . 53199 1 1072 . 1 . 1 186 186 LYS N N 15 131.7346 0.0000 . 1 . . 37847 . . 413 LYS N . 53199 1 1073 . 1 . 1 187 187 LEU H H 1 9.1674 0.0000 . 1 . . 31443 . . 414 LEU H . 53199 1 1074 . 1 . 1 187 187 LEU HD11 H 1 0.0160 0.0000 . 2 . . 92184 . . 414 LEU HD11 . 53199 1 1075 . 1 . 1 187 187 LEU HD12 H 1 0.0160 0.0000 . 2 . . 92184 . . 414 LEU HD11 . 53199 1 1076 . 1 . 1 187 187 LEU HD13 H 1 0.0160 0.0000 . 2 . . 92184 . . 414 LEU HD11 . 53199 1 1077 . 1 . 1 187 187 LEU HD21 H 1 0.4830 0.0000 . 2 . . 91989 . . 414 LEU HD21 . 53199 1 1078 . 1 . 1 187 187 LEU HD22 H 1 0.4830 0.0000 . 2 . . 91989 . . 414 LEU HD21 . 53199 1 1079 . 1 . 1 187 187 LEU HD23 H 1 0.4830 0.0000 . 2 . . 91989 . . 414 LEU HD21 . 53199 1 1080 . 1 . 1 187 187 LEU C C 13 174.6485 0.0000 . 1 . . 93259 . . 414 LEU C . 53199 1 1081 . 1 . 1 187 187 LEU CA C 13 53.0875 0.0000 . 1 . . 93261 . . 414 LEU CA . 53199 1 1082 . 1 . 1 187 187 LEU CB C 13 40.0698 0.0000 . 1 . . 93262 . . 414 LEU CB . 53199 1 1083 . 1 . 1 187 187 LEU CD1 C 13 26.7170 0.0000 . 2 . . . . . 414 LEU CD1 . 53199 1 1084 . 1 . 1 187 187 LEU CD2 C 13 23.3870 0.0000 . 2 . . . . . 414 LEU CD2 . 53199 1 1085 . 1 . 1 187 187 LEU N N 15 134.7203 0.0000 . 1 . . 31445 . . 414 LEU N . 53199 1 1086 . 1 . 1 188 188 THR H H 1 8.1354 0.0000 . 1 . . 33933 . . 415 THR H . 53199 1 1087 . 1 . 1 188 188 THR HG21 H 1 0.8050 0.0000 . 1 . . . . . 415 THR HG21 . 53199 1 1088 . 1 . 1 188 188 THR HG22 H 1 0.8050 0.0000 . 1 . . . . . 415 THR HG21 . 53199 1 1089 . 1 . 1 188 188 THR HG23 H 1 0.8050 0.0000 . 1 . . . . . 415 THR HG21 . 53199 1 1090 . 1 . 1 188 188 THR C C 13 173.7880 0.0000 . 1 . . 99342 . . 415 THR C . 53199 1 1091 . 1 . 1 188 188 THR CA C 13 61.7437 0.0000 . 1 . . 99338 . . 415 THR CA . 53199 1 1092 . 1 . 1 188 188 THR CB C 13 68.6948 0.0000 . 1 . . 45731 . . 415 THR CB . 53199 1 1093 . 1 . 1 188 188 THR CG2 C 13 21.1280 0.0000 . 1 . . 87549 . . 415 THR CG2 . 53199 1 1094 . 1 . 1 188 188 THR N N 15 125.5319 0.0000 . 1 . . 33935 . . 415 THR N . 53199 1 1095 . 1 . 1 189 189 VAL H H 1 8.3563 0.0000 . 1 . . 31863 . . 416 VAL H . 53199 1 1096 . 1 . 1 189 189 VAL HG11 H 1 0.2740 0.0000 . 2 . . 92079 . . 416 VAL HG11 . 53199 1 1097 . 1 . 1 189 189 VAL HG12 H 1 0.2740 0.0000 . 2 . . 92079 . . 416 VAL HG11 . 53199 1 1098 . 1 . 1 189 189 VAL HG13 H 1 0.2740 0.0000 . 2 . . 92079 . . 416 VAL HG11 . 53199 1 1099 . 1 . 1 189 189 VAL HG21 H 1 0.4370 0.0000 . 2 . . 92022 . . 416 VAL HG21 . 53199 1 1100 . 1 . 1 189 189 VAL HG22 H 1 0.4370 0.0000 . 2 . . 92022 . . 416 VAL HG21 . 53199 1 1101 . 1 . 1 189 189 VAL HG23 H 1 0.4370 0.0000 . 2 . . 92022 . . 416 VAL HG21 . 53199 1 1102 . 1 . 1 189 189 VAL C C 13 174.6665 0.0000 . 1 . . 53013 . . 416 VAL C . 53199 1 1103 . 1 . 1 189 189 VAL CA C 13 57.8790 0.0000 . 1 . . 53014 . . 416 VAL CA . 53199 1 1104 . 1 . 1 189 189 VAL CB C 13 35.6046 0.0000 . 1 . . 53016 . . 416 VAL CB . 53199 1 1105 . 1 . 1 189 189 VAL CG1 C 13 19.2990 0.0000 . 2 . . 87720 . . 416 VAL CG1 . 53199 1 1106 . 1 . 1 189 189 VAL CG2 C 13 21.5610 0.0000 . 2 . . 87477 . . 416 VAL CG2 . 53199 1 1107 . 1 . 1 189 189 VAL N N 15 119.9574 0.0000 . 1 . . 31865 . . 416 VAL N . 53199 1 1108 . 1 . 1 190 190 ASP H H 1 8.4199 0.0000 . 1 . . 38043 . . 417 ASP H . 53199 1 1109 . 1 . 1 190 190 ASP C C 13 177.4834 0.0000 . 1 . . 47882 . . 417 ASP C . 53199 1 1110 . 1 . 1 190 190 ASP CA C 13 55.0960 0.0000 . 1 . . 47885 . . 417 ASP CA . 53199 1 1111 . 1 . 1 190 190 ASP CB C 13 40.7955 0.0000 . 1 . . 47887 . . 417 ASP CB . 53199 1 1112 . 1 . 1 190 190 ASP N N 15 123.6208 0.0000 . 1 . . 38045 . . 417 ASP N . 53199 1 1113 . 1 . 1 191 191 LYS H H 1 8.6284 0.0000 . 1 . . 37902 . . 418 LYS H . 53199 1 1114 . 1 . 1 191 191 LYS C C 13 178.0570 0.0000 . 1 . . 43305 . . 418 LYS C . 53199 1 1115 . 1 . 1 191 191 LYS CA C 13 60.6307 0.0000 . 1 . . 43308 . . 418 LYS CA . 53199 1 1116 . 1 . 1 191 191 LYS CB C 13 30.5570 0.0000 . 1 . . 43307 . . 418 LYS CB . 53199 1 1117 . 1 . 1 191 191 LYS N N 15 127.2632 0.0000 . 1 . . 37904 . . 418 LYS N . 53199 1 1118 . 1 . 1 192 192 SER H H 1 8.7181 0.0000 . 1 . . 38448 . . 419 SER H . 53199 1 1119 . 1 . 1 192 192 SER C C 13 176.2902 0.0000 . 1 . . 60433 . . 419 SER C . 53199 1 1120 . 1 . 1 192 192 SER CA C 13 61.1011 0.0000 . 1 . . 60438 . . 419 SER CA . 53199 1 1121 . 1 . 1 192 192 SER N N 15 113.9056 0.0000 . 1 . . 38450 . . 419 SER N . 53199 1 1122 . 1 . 1 193 193 ARG H H 1 7.3532 0.0000 . 1 . . 38190 . . 420 ARG H . 53199 1 1123 . 1 . 1 193 193 ARG C C 13 179.2318 0.0000 . 1 . . 51693 . . 420 ARG C . 53199 1 1124 . 1 . 1 193 193 ARG CA C 13 58.7934 0.0000 . 1 . . 51688 . . 420 ARG CA . 53199 1 1125 . 1 . 1 193 193 ARG CB C 13 30.4192 0.0000 . 1 . . 51691 . . 420 ARG CB . 53199 1 1126 . 1 . 1 193 193 ARG N N 15 120.6467 0.0000 . 1 . . 38192 . . 420 ARG N . 53199 1 1127 . 1 . 1 194 194 TRP C C 13 177.5420 0.0000 . 1 . . 58434 . . 421 TRP C . 53199 1 1128 . 1 . 1 194 194 TRP CA C 13 58.3070 0.0000 . 1 . . 58440 . . 421 TRP CA . 53199 1 1129 . 1 . 1 194 194 TRP CB C 13 30.1632 0.0000 . 1 . . 58444 . . 421 TRP CB . 53199 1 1130 . 1 . 1 195 195 GLN H H 1 8.4691 0.0000 . 1 . . 32733 . . 422 GLN H . 53199 1 1131 . 1 . 1 195 195 GLN C C 13 176.6980 0.0000 . 1 . . 58438 . . 422 GLN C . 53199 1 1132 . 1 . 1 195 195 GLN CA C 13 57.6155 0.0000 . 1 . . 58435 . . 422 GLN CA . 53199 1 1133 . 1 . 1 195 195 GLN CB C 13 28.4918 0.0000 . 1 . . 58441 . . 422 GLN CB . 53199 1 1134 . 1 . 1 195 195 GLN N N 15 115.6792 0.0000 . 1 . . 32735 . . 422 GLN N . 53199 1 1135 . 1 . 1 196 196 GLN H H 1 7.6252 0.0000 . 1 . . 38355 . . 423 GLN H . 53199 1 1136 . 1 . 1 196 196 GLN C C 13 176.8455 0.0000 . 1 . . 57775 . . 423 GLN C . 53199 1 1137 . 1 . 1 196 196 GLN CA C 13 56.0842 0.0000 . 1 . . 57772 . . 423 GLN CA . 53199 1 1138 . 1 . 1 196 196 GLN CB C 13 28.2467 0.0000 . 1 . . 57782 . . 423 GLN CB . 53199 1 1139 . 1 . 1 196 196 GLN N N 15 116.0161 0.0000 . 1 . . 38357 . . 423 GLN N . 53199 1 1140 . 1 . 1 197 197 GLY H H 1 7.4553 0.0000 . 1 . . 38598 . . 424 GLY H . 53199 1 1141 . 1 . 1 197 197 GLY C C 13 174.9721 0.0000 . 1 . . 64253 . . 424 GLY C . 53199 1 1142 . 1 . 1 197 197 GLY CA C 13 45.7442 0.0000 . 1 . . 64250 . . 424 GLY CA . 53199 1 1143 . 1 . 1 197 197 GLY N N 15 105.3656 0.0000 . 1 . . 38600 . . 424 GLY N . 53199 1 1144 . 1 . 1 198 198 ASN H H 1 6.7568 0.0000 . 1 . . 38337 . . 425 ASN H . 53199 1 1145 . 1 . 1 198 198 ASN C C 13 173.1255 0.0000 . 1 . . 41730 . . 425 ASN C . 53199 1 1146 . 1 . 1 198 198 ASN CA C 13 54.1537 0.0000 . 1 . . 41727 . . 425 ASN CA . 53199 1 1147 . 1 . 1 198 198 ASN CB C 13 39.4164 0.0000 . 1 . . 41732 . . 425 ASN CB . 53199 1 1148 . 1 . 1 198 198 ASN N N 15 116.5122 0.0000 . 1 . . 38339 . . 425 ASN N . 53199 1 1149 . 1 . 1 199 199 VAL H H 1 8.2251 0.0000 . 1 . . 38157 . . 426 VAL H . 53199 1 1150 . 1 . 1 199 199 VAL HG11 H 1 0.9140 0.0000 . 2 . . 92965 . . 426 VAL HG11 . 53199 1 1151 . 1 . 1 199 199 VAL HG12 H 1 0.9140 0.0000 . 2 . . 92965 . . 426 VAL HG11 . 53199 1 1152 . 1 . 1 199 199 VAL HG13 H 1 0.9140 0.0000 . 2 . . 92965 . . 426 VAL HG11 . 53199 1 1153 . 1 . 1 199 199 VAL HG21 H 1 0.9790 0.0000 . 2 . . 92965 . . 426 VAL HG21 . 53199 1 1154 . 1 . 1 199 199 VAL HG22 H 1 0.9790 0.0000 . 2 . . 92965 . . 426 VAL HG21 . 53199 1 1155 . 1 . 1 199 199 VAL HG23 H 1 0.9790 0.0000 . 2 . . 92965 . . 426 VAL HG21 . 53199 1 1156 . 1 . 1 199 199 VAL C C 13 175.5697 0.0000 . 1 . . 41133 . . 426 VAL C . 53199 1 1157 . 1 . 1 199 199 VAL CA C 13 61.6632 0.0000 . 1 . . 41128 . . 426 VAL CA . 53199 1 1158 . 1 . 1 199 199 VAL CB C 13 31.8770 0.0000 . 1 . . 41135 . . 426 VAL CB . 53199 1 1159 . 1 . 1 199 199 VAL CG1 C 13 21.4390 0.0000 . 2 . . 87516 . . 426 VAL CG1 . 53199 1 1160 . 1 . 1 199 199 VAL CG2 C 13 20.9430 0.0000 . 2 . . 87516 . . 426 VAL CG2 . 53199 1 1161 . 1 . 1 199 199 VAL N N 15 121.5111 0.0000 . 1 . . 38159 . . 426 VAL N . 53199 1 1162 . 1 . 1 200 200 PHE H H 1 8.9825 0.0000 . 1 . . 37878 . . 427 PHE H . 53199 1 1163 . 1 . 1 200 200 PHE C C 13 175.0242 0.0000 . 1 . . 42973 . . 427 PHE C . 53199 1 1164 . 1 . 1 200 200 PHE CA C 13 57.0474 0.0000 . 1 . . 42977 . . 427 PHE CA . 53199 1 1165 . 1 . 1 200 200 PHE CB C 13 42.0795 0.0000 . 1 . . 42979 . . 427 PHE CB . 53199 1 1166 . 1 . 1 200 200 PHE N N 15 128.9443 0.0000 . 1 . . 37880 . . 427 PHE N . 53199 1 1167 . 1 . 1 201 201 SER H H 1 9.4451 0.0000 . 1 . . 38376 . . 428 SER H . 53199 1 1168 . 1 . 1 201 201 SER CA C 13 57.1675 0.0000 . 1 . . 95038 . . 428 SER CA . 53199 1 1169 . 1 . 1 201 201 SER CB C 13 64.9101 0.0000 . 1 . . 95042 . . 428 SER CB . 53199 1 1170 . 1 . 1 201 201 SER N N 15 115.7411 0.0000 . 1 . . 38378 . . 428 SER N . 53199 1 1171 . 1 . 1 202 202 CYS H H 1 8.6156 0.0000 . 1 . . 30693 . . 429 CYS H . 53199 1 1172 . 1 . 1 202 202 CYS C C 13 172.1432 0.0000 . 1 . . 68577 . . 429 CYS C . 53199 1 1173 . 1 . 1 202 202 CYS CA C 13 52.5676 0.0000 . 1 . . 68573 . . 429 CYS CA . 53199 1 1174 . 1 . 1 202 202 CYS CB C 13 41.0780 0.0000 . 1 . . 68579 . . 429 CYS CB . 53199 1 1175 . 1 . 1 202 202 CYS N N 15 126.1222 0.0000 . 1 . . 30695 . . 429 CYS N . 53199 1 1176 . 1 . 1 203 203 SER H H 1 8.7261 0.0000 . 1 . . 68214 . . 430 SER H . 53199 1 1177 . 1 . 1 203 203 SER C C 13 172.3370 0.0000 . 1 . . 68529 . . 430 SER C . 53199 1 1178 . 1 . 1 203 203 SER CA C 13 56.6949 0.0000 . 1 . . 68528 . . 430 SER CA . 53199 1 1179 . 1 . 1 203 203 SER CB C 13 64.1565 0.0000 . 1 . . 68534 . . 430 SER CB . 53199 1 1180 . 1 . 1 203 203 SER N N 15 123.3207 0.0000 . 1 . . 68216 . . 430 SER N . 53199 1 1181 . 1 . 1 204 204 VAL H H 1 8.3321 0.0000 . 1 . . 38040 . . 431 VAL H . 53199 1 1182 . 1 . 1 204 204 VAL HG11 H 1 0.5740 0.0000 . 2 . . 92010 . . 431 VAL HG11 . 53199 1 1183 . 1 . 1 204 204 VAL HG12 H 1 0.5740 0.0000 . 2 . . 92010 . . 431 VAL HG11 . 53199 1 1184 . 1 . 1 204 204 VAL HG13 H 1 0.5740 0.0000 . 2 . . 92010 . . 431 VAL HG11 . 53199 1 1185 . 1 . 1 204 204 VAL HG21 H 1 0.4510 0.0000 . 2 . . 92010 . . 431 VAL HG21 . 53199 1 1186 . 1 . 1 204 204 VAL HG22 H 1 0.4510 0.0000 . 2 . . 92010 . . 431 VAL HG21 . 53199 1 1187 . 1 . 1 204 204 VAL HG23 H 1 0.4510 0.0000 . 2 . . 92010 . . 431 VAL HG21 . 53199 1 1188 . 1 . 1 204 204 VAL C C 13 173.6701 0.0000 . 1 . . 47766 . . 431 VAL C . 53199 1 1189 . 1 . 1 204 204 VAL CA C 13 60.0579 0.0000 . 1 . . 47772 . . 431 VAL CA . 53199 1 1190 . 1 . 1 204 204 VAL CB C 13 34.5233 0.0000 . 1 . . 47770 . . 431 VAL CB . 53199 1 1191 . 1 . 1 204 204 VAL CG1 C 13 22.5050 0.0000 . 2 . . 87441 . . 431 VAL CG1 . 53199 1 1192 . 1 . 1 204 204 VAL CG2 C 13 21.8520 0.0000 . 2 . . 92902 . . 431 VAL CG2 . 53199 1 1193 . 1 . 1 204 204 VAL N N 15 123.8365 0.0000 . 1 . . 38042 . . 431 VAL N . 53199 1 1194 . 1 . 1 205 205 MET H H 1 8.6648 0.0000 . 1 . . 31668 . . 432 MET H . 53199 1 1195 . 1 . 1 205 205 MET C C 13 173.7099 0.0000 . 1 . . 48331 . . 432 MET C . 53199 1 1196 . 1 . 1 205 205 MET CA C 13 54.0094 0.0000 . 1 . . 48333 . . 432 MET CA . 53199 1 1197 . 1 . 1 205 205 MET CB C 13 35.8402 0.0000 . 1 . . 48336 . . 432 MET CB . 53199 1 1198 . 1 . 1 205 205 MET N N 15 123.5567 0.0000 . 1 . . 31670 . . 432 MET N . 53199 1 1199 . 1 . 1 206 206 HIS H H 1 7.0023 0.0000 . 1 . . 38217 . . 433 HIS H . 53199 1 1200 . 1 . 1 206 206 HIS C C 13 175.2188 0.0000 . 1 . . 98782 . . 433 HIS C . 53199 1 1201 . 1 . 1 206 206 HIS CA C 13 57.5566 0.0000 . 1 . . 52318 . . 433 HIS CA . 53199 1 1202 . 1 . 1 206 206 HIS CB C 13 35.7475 0.0000 . 1 . . 98777 . . 433 HIS CB . 53199 1 1203 . 1 . 1 206 206 HIS N N 15 120.4072 0.0000 . 1 . . 38219 . . 433 HIS N . 53199 1 1204 . 1 . 1 207 207 GLU H H 1 8.6244 0.0000 . 1 . . 37917 . . 434 GLU H . 53199 1 1205 . 1 . 1 207 207 GLU C C 13 175.2799 0.0000 . 1 . . 46724 . . 434 GLU C . 53199 1 1206 . 1 . 1 207 207 GLU CA C 13 58.6079 0.0000 . 1 . . 100243 . . 434 GLU CA . 53199 1 1207 . 1 . 1 207 207 GLU CB C 13 29.3484 0.0000 . 1 . . 100247 . . 434 GLU CB . 53199 1 1208 . 1 . 1 207 207 GLU N N 15 127.0651 0.0000 . 1 . . 37919 . . 434 GLU N . 53199 1 1209 . 1 . 1 208 208 ALA H H 1 10.4140 0.0000 . 1 . . 37992 . . 435 ALA H . 53199 1 1210 . 1 . 1 208 208 ALA HB1 H 1 1.6300 0.0000 . 1 . . . . . 435 ALA HB1 . 53199 1 1211 . 1 . 1 208 208 ALA HB2 H 1 1.6300 0.0000 . 1 . . . . . 435 ALA HB1 . 53199 1 1212 . 1 . 1 208 208 ALA HB3 H 1 1.6300 0.0000 . 1 . . . . . 435 ALA HB1 . 53199 1 1213 . 1 . 1 208 208 ALA C C 13 177.9714 0.0000 . 1 . . 100231 . . 435 ALA C . 53199 1 1214 . 1 . 1 208 208 ALA CA C 13 51.7139 0.0000 . 1 . . 95683 . . 435 ALA CA . 53199 1 1215 . 1 . 1 208 208 ALA CB C 13 18.3244 0.0000 . 1 . . 100235 . . 435 ALA CB . 53199 1 1216 . 1 . 1 208 208 ALA N N 15 124.5255 0.0000 . 1 . . 37994 . . 435 ALA N . 53199 1 1217 . 1 . 1 209 209 LEU H H 1 7.1211 0.0000 . 1 . . 32976 . . 436 LEU H . 53199 1 1218 . 1 . 1 209 209 LEU HD11 H 1 0.6590 0.0000 . 2 . . . . . 436 LEU HD11 . 53199 1 1219 . 1 . 1 209 209 LEU HD12 H 1 0.6590 0.0000 . 2 . . . . . 436 LEU HD11 . 53199 1 1220 . 1 . 1 209 209 LEU HD13 H 1 0.6590 0.0000 . 2 . . . . . 436 LEU HD11 . 53199 1 1221 . 1 . 1 209 209 LEU HD21 H 1 0.8880 0.0000 . 2 . . . . . 436 LEU HD21 . 53199 1 1222 . 1 . 1 209 209 LEU HD22 H 1 0.8880 0.0000 . 2 . . . . . 436 LEU HD21 . 53199 1 1223 . 1 . 1 209 209 LEU HD23 H 1 0.8880 0.0000 . 2 . . . . . 436 LEU HD21 . 53199 1 1224 . 1 . 1 209 209 LEU C C 13 179.0876 0.0000 . 1 . . 98949 . . 436 LEU C . 53199 1 1225 . 1 . 1 209 209 LEU CA C 13 53.4738 0.0000 . 1 . . 42683 . . 436 LEU CA . 53199 1 1226 . 1 . 1 209 209 LEU CB C 13 43.4170 0.0000 . 1 . . 42684 . . 436 LEU CB . 53199 1 1227 . 1 . 1 209 209 LEU CD1 C 13 27.1690 0.0000 . 2 . . . . . 436 LEU CD1 . 53199 1 1228 . 1 . 1 209 209 LEU CD2 C 13 22.9650 0.0000 . 2 . . . . . 436 LEU CD2 . 53199 1 1229 . 1 . 1 209 209 LEU N N 15 116.8344 0.0000 . 1 . . 32978 . . 436 LEU N . 53199 1 1230 . 1 . 1 211 211 ASN C C 13 173.4455 0.0000 . 1 . . 63727 . . 438 ASN C . 53199 1 1231 . 1 . 1 211 211 ASN CA C 13 54.5774 0.0000 . 1 . . 63728 . . 438 ASN CA . 53199 1 1232 . 1 . 1 211 211 ASN CB C 13 36.7650 0.0000 . 1 . . 63734 . . 438 ASN CB . 53199 1 1233 . 1 . 1 212 212 HIS H H 1 8.3913 0.0000 . 1 . . 38583 . . 439 HIS H . 53199 1 1234 . 1 . 1 212 212 HIS C C 13 173.2079 0.0000 . 1 . . 68933 . . 439 HIS C . 53199 1 1235 . 1 . 1 212 212 HIS CA C 13 54.5654 0.0000 . 1 . . 68935 . . 439 HIS CA . 53199 1 1236 . 1 . 1 212 212 HIS CB C 13 27.0597 0.0000 . 1 . . 68950 . . 439 HIS CB . 53199 1 1237 . 1 . 1 212 212 HIS N N 15 108.9393 0.0000 . 1 . . 38585 . . 439 HIS N . 53199 1 1238 . 1 . 1 213 213 TYR H H 1 7.2800 0.0000 . 1 . . 38280 . . 440 TYR H . 53199 1 1239 . 1 . 1 213 213 TYR C C 13 174.0258 0.0000 . 1 . . 100201 . . 440 TYR C . 53199 1 1240 . 1 . 1 213 213 TYR CB C 13 42.3960 0.0000 . 1 . . 100205 . . 440 TYR CB . 53199 1 1241 . 1 . 1 213 213 TYR N N 15 118.9550 0.0000 . 1 . . 38282 . . 440 TYR N . 53199 1 1242 . 1 . 1 214 214 THR H H 1 8.2321 0.0000 . 1 . . 35628 . . 441 THR H . 53199 1 1243 . 1 . 1 214 214 THR HG21 H 1 0.9390 0.0000 . 1 . . 91620 . . 441 THR HG21 . 53199 1 1244 . 1 . 1 214 214 THR HG22 H 1 0.9390 0.0000 . 1 . . 91620 . . 441 THR HG21 . 53199 1 1245 . 1 . 1 214 214 THR HG23 H 1 0.9390 0.0000 . 1 . . 91620 . . 441 THR HG21 . 53199 1 1246 . 1 . 1 214 214 THR C C 13 169.5951 0.0000 . 1 . . 100179 . . 441 THR C . 53199 1 1247 . 1 . 1 214 214 THR CA C 13 60.8027 0.0000 . 1 . . 100175 . . 441 THR CA . 53199 1 1248 . 1 . 1 214 214 THR CB C 13 69.3081 0.0000 . 1 . . 100183 . . 441 THR CB . 53199 1 1249 . 1 . 1 214 214 THR CG2 C 13 19.4770 0.0000 . 1 . . 87729 . . 441 THR CG2 . 53199 1 1250 . 1 . 1 214 214 THR N N 15 121.7754 0.0000 . 1 . . 35630 . . 441 THR N . 53199 1 1251 . 1 . 1 215 215 GLN H H 1 7.5991 0.0000 . 1 . . 32580 . . 442 GLN H . 53199 1 1252 . 1 . 1 215 215 GLN C C 13 174.3249 0.0000 . 1 . . 99264 . . 442 GLN C . 53199 1 1253 . 1 . 1 215 215 GLN CA C 13 53.7460 0.0000 . 1 . . 99260 . . 442 GLN CA . 53199 1 1254 . 1 . 1 215 215 GLN CB C 13 32.5185 0.0000 . 1 . . 99268 . . 442 GLN CB . 53199 1 1255 . 1 . 1 215 215 GLN N N 15 120.4081 0.0000 . 1 . . 32582 . . 442 GLN N . 53199 1 1256 . 1 . 1 216 216 LYS H H 1 8.4281 0.0000 . 1 . . 38052 . . 443 LYS H . 53199 1 1257 . 1 . 1 216 216 LYS C C 13 175.2172 0.0000 . 1 . . 98774 . . 443 LYS C . 53199 1 1258 . 1 . 1 216 216 LYS CA C 13 53.6468 0.0000 . 1 . . 66088 . . 443 LYS CA . 53199 1 1259 . 1 . 1 216 216 LYS CB C 13 35.7067 0.0000 . 1 . . 98778 . . 443 LYS CB . 53199 1 1260 . 1 . 1 216 216 LYS N N 15 123.6155 0.0000 . 1 . . 38054 . . 443 LYS N . 53199 1 1261 . 1 . 1 217 217 SER H H 1 8.5504 0.0000 . 1 . . 31902 . . 444 SER H . 53199 1 1262 . 1 . 1 217 217 SER C C 13 173.8764 0.0000 . 1 . . 41524 . . 444 SER C . 53199 1 1263 . 1 . 1 217 217 SER CA C 13 57.8155 0.0000 . 1 . . 41520 . . 444 SER CA . 53199 1 1264 . 1 . 1 217 217 SER CB C 13 65.7957 0.0000 . 1 . . 41528 . . 444 SER CB . 53199 1 1265 . 1 . 1 217 217 SER N N 15 118.9478 0.0000 . 1 . . 31904 . . 444 SER N . 53199 1 1266 . 1 . 1 218 218 LEU H H 1 9.4235 0.0000 . 1 . . 37986 . . 445 LEU H . 53199 1 1267 . 1 . 1 218 218 LEU HD11 H 1 1.1330 0.0000 . 2 . . 91512 . . 445 LEU HD11 . 53199 1 1268 . 1 . 1 218 218 LEU HD12 H 1 1.1330 0.0000 . 2 . . 91512 . . 445 LEU HD11 . 53199 1 1269 . 1 . 1 218 218 LEU HD13 H 1 1.1330 0.0000 . 2 . . 91512 . . 445 LEU HD11 . 53199 1 1270 . 1 . 1 218 218 LEU HD21 H 1 1.0930 0.0000 . 2 . . 91512 . . 445 LEU HD21 . 53199 1 1271 . 1 . 1 218 218 LEU HD22 H 1 1.0930 0.0000 . 2 . . 91512 . . 445 LEU HD21 . 53199 1 1272 . 1 . 1 218 218 LEU HD23 H 1 1.0930 0.0000 . 2 . . 91512 . . 445 LEU HD21 . 53199 1 1273 . 1 . 1 218 218 LEU CA C 13 55.2232 0.0000 . 1 . . 46651 . . 445 LEU CA . 53199 1 1274 . 1 . 1 218 218 LEU CB C 13 44.3929 0.0000 . 1 . . 46655 . . 445 LEU CB . 53199 1 1275 . 1 . 1 218 218 LEU CD1 C 13 23.8970 0.0000 . 2 . . 87339 . . 445 LEU CD1 . 53199 1 1276 . 1 . 1 218 218 LEU CD2 C 13 26.7370 0.0000 . 2 . . . . . 445 LEU CD2 . 53199 1 1277 . 1 . 1 218 218 LEU N N 15 124.7103 0.0000 . 1 . . 37988 . . 445 LEU N . 53199 1 1278 . 1 . 1 219 219 SER H H 1 8.2206 0.0000 . 1 . . 38343 . . 446 SER H . 53199 1 1279 . 1 . 1 219 219 SER C C 13 173.2146 0.0000 . 1 . . 101645 . . 446 SER C . 53199 1 1280 . 1 . 1 219 219 SER CA C 13 57.6213 0.0000 . 1 . . 57377 . . 446 SER CA . 53199 1 1281 . 1 . 1 219 219 SER CB C 13 66.1323 0.0000 . 1 . . 101649 . . 446 SER CB . 53199 1 1282 . 1 . 1 219 219 SER N N 15 116.3212 0.0000 . 1 . . 38345 . . 446 SER N . 53199 1 1283 . 1 . 1 220 220 LEU H H 1 8.6903 0.0000 . 1 . . 101388 . . 447 LEU H . 53199 1 1284 . 1 . 1 220 220 LEU HD11 H 1 0.7150 0.0000 . 2 . . 91899 . . 447 LEU HD11 . 53199 1 1285 . 1 . 1 220 220 LEU HD12 H 1 0.7150 0.0000 . 2 . . 91899 . . 447 LEU HD11 . 53199 1 1286 . 1 . 1 220 220 LEU HD13 H 1 0.7150 0.0000 . 2 . . 91899 . . 447 LEU HD11 . 53199 1 1287 . 1 . 1 220 220 LEU HD21 H 1 0.6600 0.0000 . 2 . . 91902 . . 447 LEU HD21 . 53199 1 1288 . 1 . 1 220 220 LEU HD22 H 1 0.6600 0.0000 . 2 . . 91902 . . 447 LEU HD21 . 53199 1 1289 . 1 . 1 220 220 LEU HD23 H 1 0.6600 0.0000 . 2 . . 91902 . . 447 LEU HD21 . 53199 1 1290 . 1 . 1 220 220 LEU C C 13 176.9785 0.0000 . 1 . . 101418 . . 447 LEU C . 53199 1 1291 . 1 . 1 220 220 LEU CA C 13 55.4693 0.0000 . 1 . . 101536 . . 447 LEU CA . 53199 1 1292 . 1 . 1 220 220 LEU CB C 13 41.0826 0.0000 . 1 . . 101539 . . 447 LEU CB . 53199 1 1293 . 1 . 1 220 220 LEU CD1 C 13 23.9720 0.0000 . 2 . . 87297 . . 447 LEU CD1 . 53199 1 1294 . 1 . 1 220 220 LEU CD2 C 13 25.2760 0.0000 . 2 . . 87228 . . 447 LEU CD2 . 53199 1 1295 . 1 . 1 220 220 LEU N N 15 125.3650 0.0000 . 1 . . 101390 . . 447 LEU N . 53199 1 1296 . 1 . 1 221 221 SER H H 1 8.0872 0.0000 . 1 . . 38265 . . 448 SER H . 53199 1 1297 . 1 . 1 221 221 SER C C 13 172.7975 0.0000 . 1 . . 55696 . . 448 SER C . 53199 1 1298 . 1 . 1 221 221 SER CA C 13 56.8234 0.0000 . 1 . . 55698 . . 448 SER CA . 53199 1 1299 . 1 . 1 221 221 SER CB C 13 63.2385 0.0000 . 1 . . 55697 . . 448 SER CB . 53199 1 1300 . 1 . 1 221 221 SER N N 15 119.2006 0.0000 . 1 . . 38267 . . 448 SER N . 53199 1 1301 . 1 . 1 222 222 PRO C C 13 177.5060 0.0000 . 1 . . 95758 . . 449 PRO C . 53199 1 1302 . 1 . 1 222 222 PRO CA C 13 63.1100 0.0000 . 1 . . 63242 . . 449 PRO CA . 53199 1 1303 . 1 . 1 222 222 PRO CB C 13 31.3688 0.0000 . 1 . . 63242 . . 449 PRO CB . 53199 1 1304 . 1 . 1 223 223 GLY H H 1 8.2626 0.0000 . 1 . . 37695 . . 450 GLY H . 53199 1 1305 . 1 . 1 223 223 GLY C C 13 173.1410 0.0000 . 1 . . 99142 . . 450 GLY C . 53199 1 1306 . 1 . 1 223 223 GLY CA C 13 44.9937 0.0000 . 1 . . 76402 . . 450 GLY CA . 53199 1 1307 . 1 . 1 223 223 GLY N N 15 109.8816 0.0000 . 1 . . 37697 . . 450 GLY N . 53199 1 1308 . 1 . 1 224 224 LYS H H 1 7.6648 0.0000 . 1 . . 37938 . . 451 LYS H . 53199 1 1309 . 1 . 1 224 224 LYS C C 13 181.2846 0.0000 . 1 . . 44642 . . 451 LYS C . 53199 1 1310 . 1 . 1 224 224 LYS CA C 13 57.0174 0.0000 . 1 . . 44645 . . 451 LYS CA . 53199 1 1311 . 1 . 1 224 224 LYS CG C 13 0.0000 0.0000 . 1 . . . . . 451 LYS CG . 53199 1 1312 . 1 . 1 224 224 LYS CD C 13 0.0000 0.0000 . 1 . . . . . 451 LYS CD . 53199 1 1313 . 1 . 1 224 224 LYS N N 15 126.3499 0.0000 . 1 . . 37940 . . 451 LYS N . 53199 1 stop_ save_