data_51188 ####################### # Entry information # ####################### save_entry_information_1 _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information_1 _Entry.ID 51188 _Entry.Title ; Backbone and ILV side chain assignment of the catalytic domain of human deubiquitinating enzyme USP7 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2021-11-23 _Entry.Accession_date 2021-11-23 _Entry.Last_release_date 2021-11-23 _Entry.Original_release_date 2021-11-23 _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 Dmitry Korzhnev . M. . . 51188 2 Gabrielle Valles . J. . . 51188 3 Alexandra Pozhidaeva . . . . 51188 4 Irina Bezsonova . . . . 51188 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 51188 spectral_peak_list 5 51188 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 1135 51188 '15N chemical shifts' 315 51188 '1H chemical shifts' 690 51188 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 2 . . 2022-09-28 2021-11-23 update BMRB 'update entry citation' 51188 1 . . 2021-12-19 2021-11-23 original author 'original release' 51188 stop_ save_ ############### # Citations # ############### save_citations_1 _Citation.Sf_category citations _Citation.Sf_framecode citations_1 _Citation.Entry_ID 51188 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 35536398 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; Backbone and ILV side-chain NMR resonance assignments of the catalytic domain of human deubiquitinating enzyme USP7 ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assign.' _Citation.Journal_name_full 'Biomolecular NMR assignments' _Citation.Journal_volume 16 _Citation.Journal_issue 2 _Citation.Journal_ASTM . _Citation.Journal_ISSN 1874-270X _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 197 _Citation.Page_last 203 _Citation.Year 2022 _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 Gabrielle Valles G. . . . 51188 1 2 Alexandra Pozhidaeva A. . . . 51188 1 3 Dmitry Korzhnev D. M. . . 51188 1 4 Irina Bezsonova I. . . . 51188 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly_1 _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly_1 _Assembly.Entry_ID 51188 _Assembly.ID 1 _Assembly.Name USP7 _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds no _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 USP7 1 $entity_1 . . yes native no no . . . 51188 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 51188 _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 ; GSSKKHTGYVGLKNQGATCY MNSLLQTLFFTNQLRKAVYM MPTEGDDSSKSVPLALQRVF YELQHSDKPVGTKKLTKSFG WETLDSFMQHDVQELCRVLL DNVENKMKGTCVEGTIPKLF RGKMVSYIQCKEVDYRSDRR EDYYDIQLSIKGKKNIFESF VDYVAVEQLDGDNKYDAGEH GLQEAEKGVKFLTLPPVLHL QLMRFMYDPQTDQNIKINDR FEFPEQLPLDEFLQKTDPKD PANYILHAVLVHSGDNHGGH YVVYLNPKGDGKWCKFDDDV VSRCTKEEAIEHNYGGHDDD LSVRHCTNAYMLVYIRESKL SEVLQAVTDHDIPQQLVERL QEEKRIEAQKRKERQE ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _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 356 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . 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 1 205 GLY . 51188 1 2 206 SER . 51188 1 3 207 SER . 51188 1 4 208 LYS . 51188 1 5 209 LYS . 51188 1 6 210 HIS . 51188 1 7 211 THR . 51188 1 8 212 GLY . 51188 1 9 213 TYR . 51188 1 10 214 VAL . 51188 1 11 215 GLY . 51188 1 12 216 LEU . 51188 1 13 217 LYS . 51188 1 14 218 ASN . 51188 1 15 219 GLN . 51188 1 16 220 GLY . 51188 1 17 221 ALA . 51188 1 18 222 THR . 51188 1 19 223 CYS . 51188 1 20 224 TYR . 51188 1 21 225 MET . 51188 1 22 226 ASN . 51188 1 23 227 SER . 51188 1 24 228 LEU . 51188 1 25 229 LEU . 51188 1 26 230 GLN . 51188 1 27 231 THR . 51188 1 28 232 LEU . 51188 1 29 233 PHE . 51188 1 30 234 PHE . 51188 1 31 235 THR . 51188 1 32 236 ASN . 51188 1 33 237 GLN . 51188 1 34 238 LEU . 51188 1 35 239 ARG . 51188 1 36 240 LYS . 51188 1 37 241 ALA . 51188 1 38 242 VAL . 51188 1 39 243 TYR . 51188 1 40 244 MET . 51188 1 41 245 MET . 51188 1 42 246 PRO . 51188 1 43 247 THR . 51188 1 44 248 GLU . 51188 1 45 249 GLY . 51188 1 46 250 ASP . 51188 1 47 251 ASP . 51188 1 48 252 SER . 51188 1 49 253 SER . 51188 1 50 254 LYS . 51188 1 51 255 SER . 51188 1 52 256 VAL . 51188 1 53 257 PRO . 51188 1 54 258 LEU . 51188 1 55 259 ALA . 51188 1 56 260 LEU . 51188 1 57 261 GLN . 51188 1 58 262 ARG . 51188 1 59 263 VAL . 51188 1 60 264 PHE . 51188 1 61 265 TYR . 51188 1 62 266 GLU . 51188 1 63 267 LEU . 51188 1 64 268 GLN . 51188 1 65 269 HIS . 51188 1 66 270 SER . 51188 1 67 271 ASP . 51188 1 68 272 LYS . 51188 1 69 273 PRO . 51188 1 70 274 VAL . 51188 1 71 275 GLY . 51188 1 72 276 THR . 51188 1 73 277 LYS . 51188 1 74 278 LYS . 51188 1 75 279 LEU . 51188 1 76 280 THR . 51188 1 77 281 LYS . 51188 1 78 282 SER . 51188 1 79 283 PHE . 51188 1 80 284 GLY . 51188 1 81 285 TRP . 51188 1 82 286 GLU . 51188 1 83 287 THR . 51188 1 84 288 LEU . 51188 1 85 289 ASP . 51188 1 86 290 SER . 51188 1 87 291 PHE . 51188 1 88 292 MET . 51188 1 89 293 GLN . 51188 1 90 294 HIS . 51188 1 91 295 ASP . 51188 1 92 296 VAL . 51188 1 93 297 GLN . 51188 1 94 298 GLU . 51188 1 95 299 LEU . 51188 1 96 300 CYS . 51188 1 97 301 ARG . 51188 1 98 302 VAL . 51188 1 99 303 LEU . 51188 1 100 304 LEU . 51188 1 101 305 ASP . 51188 1 102 306 ASN . 51188 1 103 307 VAL . 51188 1 104 308 GLU . 51188 1 105 309 ASN . 51188 1 106 310 LYS . 51188 1 107 311 MET . 51188 1 108 312 LYS . 51188 1 109 313 GLY . 51188 1 110 314 THR . 51188 1 111 315 CYS . 51188 1 112 316 VAL . 51188 1 113 317 GLU . 51188 1 114 318 GLY . 51188 1 115 319 THR . 51188 1 116 320 ILE . 51188 1 117 321 PRO . 51188 1 118 322 LYS . 51188 1 119 323 LEU . 51188 1 120 324 PHE . 51188 1 121 325 ARG . 51188 1 122 326 GLY . 51188 1 123 327 LYS . 51188 1 124 328 MET . 51188 1 125 329 VAL . 51188 1 126 330 SER . 51188 1 127 331 TYR . 51188 1 128 332 ILE . 51188 1 129 333 GLN . 51188 1 130 334 CYS . 51188 1 131 335 LYS . 51188 1 132 336 GLU . 51188 1 133 337 VAL . 51188 1 134 338 ASP . 51188 1 135 339 TYR . 51188 1 136 340 ARG . 51188 1 137 341 SER . 51188 1 138 342 ASP . 51188 1 139 343 ARG . 51188 1 140 344 ARG . 51188 1 141 345 GLU . 51188 1 142 346 ASP . 51188 1 143 347 TYR . 51188 1 144 348 TYR . 51188 1 145 349 ASP . 51188 1 146 350 ILE . 51188 1 147 351 GLN . 51188 1 148 352 LEU . 51188 1 149 353 SER . 51188 1 150 354 ILE . 51188 1 151 355 LYS . 51188 1 152 356 GLY . 51188 1 153 357 LYS . 51188 1 154 358 LYS . 51188 1 155 359 ASN . 51188 1 156 360 ILE . 51188 1 157 361 PHE . 51188 1 158 362 GLU . 51188 1 159 363 SER . 51188 1 160 364 PHE . 51188 1 161 365 VAL . 51188 1 162 366 ASP . 51188 1 163 367 TYR . 51188 1 164 368 VAL . 51188 1 165 369 ALA . 51188 1 166 370 VAL . 51188 1 167 371 GLU . 51188 1 168 372 GLN . 51188 1 169 373 LEU . 51188 1 170 374 ASP . 51188 1 171 375 GLY . 51188 1 172 376 ASP . 51188 1 173 377 ASN . 51188 1 174 378 LYS . 51188 1 175 379 TYR . 51188 1 176 380 ASP . 51188 1 177 381 ALA . 51188 1 178 382 GLY . 51188 1 179 383 GLU . 51188 1 180 384 HIS . 51188 1 181 385 GLY . 51188 1 182 386 LEU . 51188 1 183 387 GLN . 51188 1 184 388 GLU . 51188 1 185 389 ALA . 51188 1 186 390 GLU . 51188 1 187 391 LYS . 51188 1 188 392 GLY . 51188 1 189 393 VAL . 51188 1 190 394 LYS . 51188 1 191 395 PHE . 51188 1 192 396 LEU . 51188 1 193 397 THR . 51188 1 194 398 LEU . 51188 1 195 399 PRO . 51188 1 196 400 PRO . 51188 1 197 401 VAL . 51188 1 198 402 LEU . 51188 1 199 403 HIS . 51188 1 200 404 LEU . 51188 1 201 405 GLN . 51188 1 202 406 LEU . 51188 1 203 407 MET . 51188 1 204 408 ARG . 51188 1 205 409 PHE . 51188 1 206 410 MET . 51188 1 207 411 TYR . 51188 1 208 412 ASP . 51188 1 209 413 PRO . 51188 1 210 414 GLN . 51188 1 211 415 THR . 51188 1 212 416 ASP . 51188 1 213 417 GLN . 51188 1 214 418 ASN . 51188 1 215 419 ILE . 51188 1 216 420 LYS . 51188 1 217 421 ILE . 51188 1 218 422 ASN . 51188 1 219 423 ASP . 51188 1 220 424 ARG . 51188 1 221 425 PHE . 51188 1 222 426 GLU . 51188 1 223 427 PHE . 51188 1 224 428 PRO . 51188 1 225 429 GLU . 51188 1 226 430 GLN . 51188 1 227 431 LEU . 51188 1 228 432 PRO . 51188 1 229 433 LEU . 51188 1 230 434 ASP . 51188 1 231 435 GLU . 51188 1 232 436 PHE . 51188 1 233 437 LEU . 51188 1 234 438 GLN . 51188 1 235 439 LYS . 51188 1 236 440 THR . 51188 1 237 441 ASP . 51188 1 238 442 PRO . 51188 1 239 443 LYS . 51188 1 240 444 ASP . 51188 1 241 445 PRO . 51188 1 242 446 ALA . 51188 1 243 447 ASN . 51188 1 244 448 TYR . 51188 1 245 449 ILE . 51188 1 246 450 LEU . 51188 1 247 451 HIS . 51188 1 248 452 ALA . 51188 1 249 453 VAL . 51188 1 250 454 LEU . 51188 1 251 455 VAL . 51188 1 252 456 HIS . 51188 1 253 457 SER . 51188 1 254 458 GLY . 51188 1 255 459 ASP . 51188 1 256 460 ASN . 51188 1 257 461 HIS . 51188 1 258 462 GLY . 51188 1 259 463 GLY . 51188 1 260 464 HIS . 51188 1 261 465 TYR . 51188 1 262 466 VAL . 51188 1 263 467 VAL . 51188 1 264 468 TYR . 51188 1 265 469 LEU . 51188 1 266 470 ASN . 51188 1 267 471 PRO . 51188 1 268 472 LYS . 51188 1 269 473 GLY . 51188 1 270 474 ASP . 51188 1 271 475 GLY . 51188 1 272 476 LYS . 51188 1 273 477 TRP . 51188 1 274 478 CYS . 51188 1 275 479 LYS . 51188 1 276 480 PHE . 51188 1 277 481 ASP . 51188 1 278 482 ASP . 51188 1 279 483 ASP . 51188 1 280 484 VAL . 51188 1 281 485 VAL . 51188 1 282 486 SER . 51188 1 283 487 ARG . 51188 1 284 488 CYS . 51188 1 285 489 THR . 51188 1 286 490 LYS . 51188 1 287 491 GLU . 51188 1 288 492 GLU . 51188 1 289 493 ALA . 51188 1 290 494 ILE . 51188 1 291 495 GLU . 51188 1 292 496 HIS . 51188 1 293 497 ASN . 51188 1 294 498 TYR . 51188 1 295 499 GLY . 51188 1 296 500 GLY . 51188 1 297 501 HIS . 51188 1 298 502 ASP . 51188 1 299 503 ASP . 51188 1 300 504 ASP . 51188 1 301 505 LEU . 51188 1 302 506 SER . 51188 1 303 507 VAL . 51188 1 304 508 ARG . 51188 1 305 509 HIS . 51188 1 306 510 CYS . 51188 1 307 511 THR . 51188 1 308 512 ASN . 51188 1 309 513 ALA . 51188 1 310 514 TYR . 51188 1 311 515 MET . 51188 1 312 516 LEU . 51188 1 313 517 VAL . 51188 1 314 518 TYR . 51188 1 315 519 ILE . 51188 1 316 520 ARG . 51188 1 317 521 GLU . 51188 1 318 522 SER . 51188 1 319 523 LYS . 51188 1 320 524 LEU . 51188 1 321 525 SER . 51188 1 322 526 GLU . 51188 1 323 527 VAL . 51188 1 324 528 LEU . 51188 1 325 529 GLN . 51188 1 326 530 ALA . 51188 1 327 531 VAL . 51188 1 328 532 THR . 51188 1 329 533 ASP . 51188 1 330 534 HIS . 51188 1 331 535 ASP . 51188 1 332 536 ILE . 51188 1 333 537 PRO . 51188 1 334 538 GLN . 51188 1 335 539 GLN . 51188 1 336 540 LEU . 51188 1 337 541 VAL . 51188 1 338 542 GLU . 51188 1 339 543 ARG . 51188 1 340 544 LEU . 51188 1 341 545 GLN . 51188 1 342 546 GLU . 51188 1 343 547 GLU . 51188 1 344 548 LYS . 51188 1 345 549 ARG . 51188 1 346 550 ILE . 51188 1 347 551 GLU . 51188 1 348 552 ALA . 51188 1 349 553 GLN . 51188 1 350 554 LYS . 51188 1 351 555 ARG . 51188 1 352 556 LYS . 51188 1 353 557 GLU . 51188 1 354 558 ARG . 51188 1 355 559 GLN . 51188 1 356 560 GLU . 51188 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 . GLY 1 1 51188 1 . SER 2 2 51188 1 . SER 3 3 51188 1 . LYS 4 4 51188 1 . LYS 5 5 51188 1 . HIS 6 6 51188 1 . THR 7 7 51188 1 . GLY 8 8 51188 1 . TYR 9 9 51188 1 . VAL 10 10 51188 1 . GLY 11 11 51188 1 . LEU 12 12 51188 1 . LYS 13 13 51188 1 . ASN 14 14 51188 1 . GLN 15 15 51188 1 . GLY 16 16 51188 1 . ALA 17 17 51188 1 . THR 18 18 51188 1 . CYS 19 19 51188 1 . TYR 20 20 51188 1 . MET 21 21 51188 1 . ASN 22 22 51188 1 . SER 23 23 51188 1 . LEU 24 24 51188 1 . LEU 25 25 51188 1 . GLN 26 26 51188 1 . THR 27 27 51188 1 . LEU 28 28 51188 1 . PHE 29 29 51188 1 . PHE 30 30 51188 1 . THR 31 31 51188 1 . ASN 32 32 51188 1 . GLN 33 33 51188 1 . LEU 34 34 51188 1 . ARG 35 35 51188 1 . LYS 36 36 51188 1 . ALA 37 37 51188 1 . VAL 38 38 51188 1 . TYR 39 39 51188 1 . MET 40 40 51188 1 . MET 41 41 51188 1 . PRO 42 42 51188 1 . THR 43 43 51188 1 . GLU 44 44 51188 1 . GLY 45 45 51188 1 . ASP 46 46 51188 1 . ASP 47 47 51188 1 . SER 48 48 51188 1 . SER 49 49 51188 1 . LYS 50 50 51188 1 . SER 51 51 51188 1 . VAL 52 52 51188 1 . PRO 53 53 51188 1 . LEU 54 54 51188 1 . ALA 55 55 51188 1 . LEU 56 56 51188 1 . GLN 57 57 51188 1 . ARG 58 58 51188 1 . VAL 59 59 51188 1 . PHE 60 60 51188 1 . TYR 61 61 51188 1 . GLU 62 62 51188 1 . LEU 63 63 51188 1 . GLN 64 64 51188 1 . HIS 65 65 51188 1 . SER 66 66 51188 1 . ASP 67 67 51188 1 . LYS 68 68 51188 1 . PRO 69 69 51188 1 . VAL 70 70 51188 1 . GLY 71 71 51188 1 . THR 72 72 51188 1 . LYS 73 73 51188 1 . LYS 74 74 51188 1 . LEU 75 75 51188 1 . THR 76 76 51188 1 . LYS 77 77 51188 1 . SER 78 78 51188 1 . PHE 79 79 51188 1 . GLY 80 80 51188 1 . TRP 81 81 51188 1 . GLU 82 82 51188 1 . THR 83 83 51188 1 . LEU 84 84 51188 1 . ASP 85 85 51188 1 . SER 86 86 51188 1 . PHE 87 87 51188 1 . MET 88 88 51188 1 . GLN 89 89 51188 1 . HIS 90 90 51188 1 . ASP 91 91 51188 1 . VAL 92 92 51188 1 . GLN 93 93 51188 1 . GLU 94 94 51188 1 . LEU 95 95 51188 1 . CYS 96 96 51188 1 . ARG 97 97 51188 1 . VAL 98 98 51188 1 . LEU 99 99 51188 1 . LEU 100 100 51188 1 . ASP 101 101 51188 1 . ASN 102 102 51188 1 . VAL 103 103 51188 1 . GLU 104 104 51188 1 . ASN 105 105 51188 1 . LYS 106 106 51188 1 . MET 107 107 51188 1 . LYS 108 108 51188 1 . GLY 109 109 51188 1 . THR 110 110 51188 1 . CYS 111 111 51188 1 . VAL 112 112 51188 1 . GLU 113 113 51188 1 . GLY 114 114 51188 1 . THR 115 115 51188 1 . ILE 116 116 51188 1 . PRO 117 117 51188 1 . LYS 118 118 51188 1 . LEU 119 119 51188 1 . PHE 120 120 51188 1 . ARG 121 121 51188 1 . GLY 122 122 51188 1 . LYS 123 123 51188 1 . MET 124 124 51188 1 . VAL 125 125 51188 1 . SER 126 126 51188 1 . TYR 127 127 51188 1 . ILE 128 128 51188 1 . GLN 129 129 51188 1 . CYS 130 130 51188 1 . LYS 131 131 51188 1 . GLU 132 132 51188 1 . VAL 133 133 51188 1 . ASP 134 134 51188 1 . TYR 135 135 51188 1 . ARG 136 136 51188 1 . SER 137 137 51188 1 . ASP 138 138 51188 1 . ARG 139 139 51188 1 . ARG 140 140 51188 1 . GLU 141 141 51188 1 . ASP 142 142 51188 1 . TYR 143 143 51188 1 . TYR 144 144 51188 1 . ASP 145 145 51188 1 . ILE 146 146 51188 1 . GLN 147 147 51188 1 . LEU 148 148 51188 1 . SER 149 149 51188 1 . ILE 150 150 51188 1 . LYS 151 151 51188 1 . GLY 152 152 51188 1 . LYS 153 153 51188 1 . LYS 154 154 51188 1 . ASN 155 155 51188 1 . ILE 156 156 51188 1 . PHE 157 157 51188 1 . GLU 158 158 51188 1 . SER 159 159 51188 1 . PHE 160 160 51188 1 . VAL 161 161 51188 1 . ASP 162 162 51188 1 . TYR 163 163 51188 1 . VAL 164 164 51188 1 . ALA 165 165 51188 1 . VAL 166 166 51188 1 . GLU 167 167 51188 1 . GLN 168 168 51188 1 . LEU 169 169 51188 1 . ASP 170 170 51188 1 . GLY 171 171 51188 1 . ASP 172 172 51188 1 . ASN 173 173 51188 1 . LYS 174 174 51188 1 . TYR 175 175 51188 1 . ASP 176 176 51188 1 . ALA 177 177 51188 1 . GLY 178 178 51188 1 . GLU 179 179 51188 1 . HIS 180 180 51188 1 . GLY 181 181 51188 1 . LEU 182 182 51188 1 . GLN 183 183 51188 1 . GLU 184 184 51188 1 . ALA 185 185 51188 1 . GLU 186 186 51188 1 . LYS 187 187 51188 1 . GLY 188 188 51188 1 . VAL 189 189 51188 1 . LYS 190 190 51188 1 . PHE 191 191 51188 1 . LEU 192 192 51188 1 . THR 193 193 51188 1 . LEU 194 194 51188 1 . PRO 195 195 51188 1 . PRO 196 196 51188 1 . VAL 197 197 51188 1 . LEU 198 198 51188 1 . HIS 199 199 51188 1 . LEU 200 200 51188 1 . GLN 201 201 51188 1 . LEU 202 202 51188 1 . MET 203 203 51188 1 . ARG 204 204 51188 1 . PHE 205 205 51188 1 . MET 206 206 51188 1 . TYR 207 207 51188 1 . ASP 208 208 51188 1 . PRO 209 209 51188 1 . GLN 210 210 51188 1 . THR 211 211 51188 1 . ASP 212 212 51188 1 . GLN 213 213 51188 1 . ASN 214 214 51188 1 . ILE 215 215 51188 1 . LYS 216 216 51188 1 . ILE 217 217 51188 1 . ASN 218 218 51188 1 . ASP 219 219 51188 1 . ARG 220 220 51188 1 . PHE 221 221 51188 1 . GLU 222 222 51188 1 . PHE 223 223 51188 1 . PRO 224 224 51188 1 . GLU 225 225 51188 1 . GLN 226 226 51188 1 . LEU 227 227 51188 1 . PRO 228 228 51188 1 . LEU 229 229 51188 1 . ASP 230 230 51188 1 . GLU 231 231 51188 1 . PHE 232 232 51188 1 . LEU 233 233 51188 1 . GLN 234 234 51188 1 . LYS 235 235 51188 1 . THR 236 236 51188 1 . ASP 237 237 51188 1 . PRO 238 238 51188 1 . LYS 239 239 51188 1 . ASP 240 240 51188 1 . PRO 241 241 51188 1 . ALA 242 242 51188 1 . ASN 243 243 51188 1 . TYR 244 244 51188 1 . ILE 245 245 51188 1 . LEU 246 246 51188 1 . HIS 247 247 51188 1 . ALA 248 248 51188 1 . VAL 249 249 51188 1 . LEU 250 250 51188 1 . VAL 251 251 51188 1 . HIS 252 252 51188 1 . SER 253 253 51188 1 . GLY 254 254 51188 1 . ASP 255 255 51188 1 . ASN 256 256 51188 1 . HIS 257 257 51188 1 . GLY 258 258 51188 1 . GLY 259 259 51188 1 . HIS 260 260 51188 1 . TYR 261 261 51188 1 . VAL 262 262 51188 1 . VAL 263 263 51188 1 . TYR 264 264 51188 1 . LEU 265 265 51188 1 . ASN 266 266 51188 1 . PRO 267 267 51188 1 . LYS 268 268 51188 1 . GLY 269 269 51188 1 . ASP 270 270 51188 1 . GLY 271 271 51188 1 . LYS 272 272 51188 1 . TRP 273 273 51188 1 . CYS 274 274 51188 1 . LYS 275 275 51188 1 . PHE 276 276 51188 1 . ASP 277 277 51188 1 . ASP 278 278 51188 1 . ASP 279 279 51188 1 . VAL 280 280 51188 1 . VAL 281 281 51188 1 . SER 282 282 51188 1 . ARG 283 283 51188 1 . CYS 284 284 51188 1 . THR 285 285 51188 1 . LYS 286 286 51188 1 . GLU 287 287 51188 1 . GLU 288 288 51188 1 . ALA 289 289 51188 1 . ILE 290 290 51188 1 . GLU 291 291 51188 1 . HIS 292 292 51188 1 . ASN 293 293 51188 1 . TYR 294 294 51188 1 . GLY 295 295 51188 1 . GLY 296 296 51188 1 . HIS 297 297 51188 1 . ASP 298 298 51188 1 . ASP 299 299 51188 1 . ASP 300 300 51188 1 . LEU 301 301 51188 1 . SER 302 302 51188 1 . VAL 303 303 51188 1 . ARG 304 304 51188 1 . HIS 305 305 51188 1 . CYS 306 306 51188 1 . THR 307 307 51188 1 . ASN 308 308 51188 1 . ALA 309 309 51188 1 . TYR 310 310 51188 1 . MET 311 311 51188 1 . LEU 312 312 51188 1 . VAL 313 313 51188 1 . TYR 314 314 51188 1 . ILE 315 315 51188 1 . ARG 316 316 51188 1 . GLU 317 317 51188 1 . SER 318 318 51188 1 . LYS 319 319 51188 1 . LEU 320 320 51188 1 . SER 321 321 51188 1 . GLU 322 322 51188 1 . VAL 323 323 51188 1 . LEU 324 324 51188 1 . GLN 325 325 51188 1 . ALA 326 326 51188 1 . VAL 327 327 51188 1 . THR 328 328 51188 1 . ASP 329 329 51188 1 . HIS 330 330 51188 1 . ASP 331 331 51188 1 . ILE 332 332 51188 1 . PRO 333 333 51188 1 . GLN 334 334 51188 1 . GLN 335 335 51188 1 . LEU 336 336 51188 1 . VAL 337 337 51188 1 . GLU 338 338 51188 1 . ARG 339 339 51188 1 . LEU 340 340 51188 1 . GLN 341 341 51188 1 . GLU 342 342 51188 1 . GLU 343 343 51188 1 . LYS 344 344 51188 1 . ARG 345 345 51188 1 . ILE 346 346 51188 1 . GLU 347 347 51188 1 . ALA 348 348 51188 1 . GLN 349 349 51188 1 . LYS 350 350 51188 1 . ARG 351 351 51188 1 . LYS 352 352 51188 1 . GLU 353 353 51188 1 . ARG 354 354 51188 1 . GLN 355 355 51188 1 . GLU 356 356 51188 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 51188 _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 . . . . . . . . . . . . . 51188 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 51188 _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 . . . plasmid . . pet28a-LIC . . . 51188 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 51188 _Sample.ID 1 _Sample.Name USP7 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number 1 _Sample.Solvent_system '95% H2O/5% 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 USP7 '[U-15N; U-2H; U-13C]' . . 1 $entity_1 . . 1 . . mM . . . . 51188 1 2 'TRIS HCL' 'natural abundance' . . . . . . 20 . . mM . . . . 51188 1 3 NaCl 'natural abundance' . . . . . . 100 . . mM . . . . 51188 1 4 DTT 'natural abundance' . . . . . . 2 . . mM . . . . 51188 1 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 51188 _Sample_condition_list.ID 1 _Sample_condition_list.Name 'condition 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 'ionic strength' 120 . mM 51188 1 pH 7.5 . pH 51188 1 pressure 1 . atm 51188 1 temperature 303 . K 51188 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 51188 _Software.ID 1 _Software.Type . _Software.Name NMRPipe _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID processing . 51188 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 51188 _Software.ID 2 _Software.Type . _Software.Name NMRFAM-SPARKY _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 51188 2 'data analysis' . 51188 2 'peak picking' . 51188 2 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 51188 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name '800 MHz (1H) Agilent VNMRS' _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Agilent _NMR_spectrometer.Model VXRS _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 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 51188 _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 '2D 1H-15N TROSY' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51188 1 2 '2D 1H-13C TROSY-HMQC' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51188 1 3 HMCMCGCBCACO no yes no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51188 1 4 HMCMCGCBCA no yes no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51188 1 5 '3D CBCANH' no yes no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51188 1 6 '3D HNCA' no yes no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51188 1 7 '3D HNCO' no yes no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51188 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 51188 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name 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 water protons . . . . ppm 20.025 internal indirect 1 . . . . . 51188 1 H 1 water protons . . . . ppm 4.725 internal direct 1 . . . . . 51188 1 N 15 water protons . . . . ppm 118.511 internal indirect 1 . . . . . 51188 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 51188 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name 'USP7 backbone and ILV side chain asignment' _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 '2D 1H-15N TROSY' . . . 51188 1 2 '2D 1H-13C TROSY-HMQC' . . . 51188 1 3 HMCMCGCBCACO . . . 51188 1 4 HMCMCGCBCA . . . 51188 1 5 '3D CBCANH' . . . 51188 1 6 '3D HNCA' . . . 51188 1 7 '3D HNCO' . . . 51188 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 2 $software_2 . . 51188 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 7 7 THR C C 13 174.467 0.00 . 1 . . . . . 211 THR C . 51188 1 2 . 1 . 1 8 8 GLY H H 1 8.400 0.00 . 1 . . . . . 212 GLY H . 51188 1 3 . 1 . 1 8 8 GLY C C 13 173.097 0.00 . 1 . . . . . 212 GLY C . 51188 1 4 . 1 . 1 8 8 GLY CA C 13 44.594 0.01 . 1 . . . . . 212 GLY CA . 51188 1 5 . 1 . 1 8 8 GLY N N 15 107.095 0.03 . 1 . . . . . 212 GLY N . 51188 1 6 . 1 . 1 9 9 TYR H H 1 7.792 0.00 . 1 . . . . . 213 TYR H . 51188 1 7 . 1 . 1 9 9 TYR CA C 13 55.316 0.00 . 1 . . . . . 213 TYR CA . 51188 1 8 . 1 . 1 9 9 TYR CB C 13 40.167 0.00 . 1 . . . . . 213 TYR CB . 51188 1 9 . 1 . 1 9 9 TYR N N 15 121.599 0.02 . 1 . . . . . 213 TYR N . 51188 1 10 . 1 . 1 10 10 VAL H H 1 8.310 0.00 . 1 . . . . . 214 VAL H . 51188 1 11 . 1 . 1 10 10 VAL HG11 H 1 0.946 0.00 . 1 . . . . . 214 VAL HG1 . 51188 1 12 . 1 . 1 10 10 VAL HG12 H 1 0.946 0.00 . 1 . . . . . 214 VAL HG1 . 51188 1 13 . 1 . 1 10 10 VAL HG13 H 1 0.946 0.00 . 1 . . . . . 214 VAL HG1 . 51188 1 14 . 1 . 1 10 10 VAL HG21 H 1 0.893 0.00 . 1 . . . . . 214 VAL HG2 . 51188 1 15 . 1 . 1 10 10 VAL HG22 H 1 0.893 0.00 . 1 . . . . . 214 VAL HG2 . 51188 1 16 . 1 . 1 10 10 VAL HG23 H 1 0.893 0.00 . 1 . . . . . 214 VAL HG2 . 51188 1 17 . 1 . 1 10 10 VAL C C 13 174.804 0.04 . 1 . . . . . 214 VAL C . 51188 1 18 . 1 . 1 10 10 VAL CA C 13 60.129 0.05 . 1 . . . . . 214 VAL CA . 51188 1 19 . 1 . 1 10 10 VAL CB C 13 34.940 0.01 . 1 . . . . . 214 VAL CB . 51188 1 20 . 1 . 1 10 10 VAL CG1 C 13 21.921 0.01 . 2 . . . . . 214 VAL CG1 . 51188 1 21 . 1 . 1 10 10 VAL CG2 C 13 21.926 0.01 . 2 . . . . . 214 VAL CG2 . 51188 1 22 . 1 . 1 10 10 VAL N N 15 121.020 0.00 . 1 . . . . . 214 VAL N . 51188 1 23 . 1 . 1 11 11 GLY H H 1 8.463 0.00 . 1 . . . . . 215 GLY H . 51188 1 24 . 1 . 1 11 11 GLY C C 13 171.229 0.00 . 1 . . . . . 215 GLY C . 51188 1 25 . 1 . 1 11 11 GLY CA C 13 42.872 0.03 . 1 . . . . . 215 GLY CA . 51188 1 26 . 1 . 1 11 11 GLY N N 15 110.184 0.03 . 1 . . . . . 215 GLY N . 51188 1 27 . 1 . 1 12 12 LEU H H 1 6.737 0.01 . 1 . . . . . 216 LEU H . 51188 1 28 . 1 . 1 12 12 LEU HD11 H 1 0.642 0.00 . 1 . . . . . 216 LEU HD1 . 51188 1 29 . 1 . 1 12 12 LEU HD12 H 1 0.642 0.00 . 1 . . . . . 216 LEU HD1 . 51188 1 30 . 1 . 1 12 12 LEU HD13 H 1 0.642 0.00 . 1 . . . . . 216 LEU HD1 . 51188 1 31 . 1 . 1 12 12 LEU HD21 H 1 0.876 0.00 . 1 . . . . . 216 LEU HD2 . 51188 1 32 . 1 . 1 12 12 LEU HD22 H 1 0.876 0.00 . 1 . . . . . 216 LEU HD2 . 51188 1 33 . 1 . 1 12 12 LEU HD23 H 1 0.876 0.00 . 1 . . . . . 216 LEU HD2 . 51188 1 34 . 1 . 1 12 12 LEU CA C 13 53.260 0.04 . 1 . . . . . 216 LEU CA . 51188 1 35 . 1 . 1 12 12 LEU CB C 13 44.898 0.01 . 1 . . . . . 216 LEU CB . 51188 1 36 . 1 . 1 12 12 LEU CG C 13 26.504 0.00 . 1 . . . . . 216 LEU CG . 51188 1 37 . 1 . 1 12 12 LEU CD1 C 13 24.485 0.01 . 2 . . . . . 216 LEU CD1 . 51188 1 38 . 1 . 1 12 12 LEU CD2 C 13 29.398 0.02 . 2 . . . . . 216 LEU CD2 . 51188 1 39 . 1 . 1 12 12 LEU N N 15 119.314 0.03 . 1 . . . . . 216 LEU N . 51188 1 40 . 1 . 1 22 22 ASN C C 13 177.307 0.00 . 1 . . . . . 226 ASN C . 51188 1 41 . 1 . 1 23 23 SER H H 1 8.414 0.01 . 1 . . . . . 227 SER H . 51188 1 42 . 1 . 1 23 23 SER C C 13 175.606 0.00 . 1 . . . . . 227 SER C . 51188 1 43 . 1 . 1 23 23 SER CA C 13 61.801 0.03 . 1 . . . . . 227 SER CA . 51188 1 44 . 1 . 1 23 23 SER CB C 13 62.927 0.00 . 1 . . . . . 227 SER CB . 51188 1 45 . 1 . 1 23 23 SER N N 15 116.255 0.03 . 1 . . . . . 227 SER N . 51188 1 46 . 1 . 1 24 24 LEU H H 1 7.873 0.00 . 1 . . . . . 228 LEU H . 51188 1 47 . 1 . 1 24 24 LEU HD11 H 1 0.754 0.00 . 1 . . . . . 228 LEU HD1 . 51188 1 48 . 1 . 1 24 24 LEU HD12 H 1 0.754 0.00 . 1 . . . . . 228 LEU HD1 . 51188 1 49 . 1 . 1 24 24 LEU HD13 H 1 0.754 0.00 . 1 . . . . . 228 LEU HD1 . 51188 1 50 . 1 . 1 24 24 LEU HD21 H 1 0.753 0.01 . 1 . . . . . 228 LEU HD2 . 51188 1 51 . 1 . 1 24 24 LEU HD22 H 1 0.753 0.01 . 1 . . . . . 228 LEU HD2 . 51188 1 52 . 1 . 1 24 24 LEU HD23 H 1 0.753 0.01 . 1 . . . . . 228 LEU HD2 . 51188 1 53 . 1 . 1 24 24 LEU C C 13 178.076 0.06 . 1 . . . . . 228 LEU C . 51188 1 54 . 1 . 1 24 24 LEU CA C 13 56.817 0.02 . 1 . . . . . 228 LEU CA . 51188 1 55 . 1 . 1 24 24 LEU CB C 13 40.973 0.03 . 1 . . . . . 228 LEU CB . 51188 1 56 . 1 . 1 24 24 LEU CG C 13 26.333 0.00 . 1 . . . . . 228 LEU CG . 51188 1 57 . 1 . 1 24 24 LEU CD1 C 13 21.728 0.01 . 2 . . . . . 228 LEU CD1 . 51188 1 58 . 1 . 1 24 24 LEU CD2 C 13 25.732 0.00 . 2 . . . . . 228 LEU CD2 . 51188 1 59 . 1 . 1 24 24 LEU N N 15 123.753 0.02 . 1 . . . . . 228 LEU N . 51188 1 60 . 1 . 1 25 25 LEU H H 1 8.777 0.00 . 1 . . . . . 229 LEU H . 51188 1 61 . 1 . 1 25 25 LEU HD11 H 1 0.669 0.00 . 1 . . . . . 229 LEU HD1 . 51188 1 62 . 1 . 1 25 25 LEU HD12 H 1 0.669 0.00 . 1 . . . . . 229 LEU HD1 . 51188 1 63 . 1 . 1 25 25 LEU HD13 H 1 0.669 0.00 . 1 . . . . . 229 LEU HD1 . 51188 1 64 . 1 . 1 25 25 LEU C C 13 179.166 0.01 . 1 . . . . . 229 LEU C . 51188 1 65 . 1 . 1 25 25 LEU CA C 13 58.272 0.04 . 1 . . . . . 229 LEU CA . 51188 1 66 . 1 . 1 25 25 LEU CB C 13 41.465 0.05 . 1 . . . . . 229 LEU CB . 51188 1 67 . 1 . 1 25 25 LEU CG C 13 26.037 0.00 . 1 . . . . . 229 LEU CG . 51188 1 68 . 1 . 1 25 25 LEU CD1 C 13 22.100 0.01 . 2 . . . . . 229 LEU CD1 . 51188 1 69 . 1 . 1 25 25 LEU N N 15 119.284 0.03 . 1 . . . . . 229 LEU N . 51188 1 70 . 1 . 1 26 26 GLN H H 1 7.642 0.01 . 1 . . . . . 230 GLN H . 51188 1 71 . 1 . 1 26 26 GLN C C 13 177.790 0.00 . 1 . . . . . 230 GLN C . 51188 1 72 . 1 . 1 26 26 GLN CA C 13 58.300 0.01 . 1 . . . . . 230 GLN CA . 51188 1 73 . 1 . 1 26 26 GLN CB C 13 26.837 0.00 . 1 . . . . . 230 GLN CB . 51188 1 74 . 1 . 1 26 26 GLN N N 15 114.998 0.03 . 1 . . . . . 230 GLN N . 51188 1 75 . 1 . 1 27 27 THR H H 1 7.091 0.00 . 1 . . . . . 231 THR H . 51188 1 76 . 1 . 1 27 27 THR C C 13 176.653 0.00 . 1 . . . . . 231 THR C . 51188 1 77 . 1 . 1 27 27 THR CA C 13 67.276 0.01 . 1 . . . . . 231 THR CA . 51188 1 78 . 1 . 1 27 27 THR CB C 13 67.999 0.00 . 1 . . . . . 231 THR CB . 51188 1 79 . 1 . 1 27 27 THR N N 15 113.721 0.02 . 1 . . . . . 231 THR N . 51188 1 80 . 1 . 1 28 28 LEU H H 1 8.101 0.00 . 1 . . . . . 232 LEU H . 51188 1 81 . 1 . 1 28 28 LEU HD11 H 1 0.850 0.00 . 1 . . . . . 232 LEU HD1 . 51188 1 82 . 1 . 1 28 28 LEU HD12 H 1 0.850 0.00 . 1 . . . . . 232 LEU HD1 . 51188 1 83 . 1 . 1 28 28 LEU HD13 H 1 0.850 0.00 . 1 . . . . . 232 LEU HD1 . 51188 1 84 . 1 . 1 28 28 LEU C C 13 178.318 0.02 . 1 . . . . . 232 LEU C . 51188 1 85 . 1 . 1 28 28 LEU CA C 13 57.446 0.02 . 1 . . . . . 232 LEU CA . 51188 1 86 . 1 . 1 28 28 LEU CB C 13 41.070 0.00 . 1 . . . . . 232 LEU CB . 51188 1 87 . 1 . 1 28 28 LEU CG C 13 25.735 0.00 . 1 . . . . . 232 LEU CG . 51188 1 88 . 1 . 1 28 28 LEU CD1 C 13 20.845 0.02 . 2 . . . . . 232 LEU CD1 . 51188 1 89 . 1 . 1 28 28 LEU N N 15 119.160 0.03 . 1 . . . . . 232 LEU N . 51188 1 90 . 1 . 1 29 29 PHE H H 1 8.414 0.00 . 1 . . . . . 233 PHE H . 51188 1 91 . 1 . 1 29 29 PHE C C 13 177.228 0.00 . 1 . . . . . 233 PHE C . 51188 1 92 . 1 . 1 29 29 PHE CA C 13 61.418 0.01 . 1 . . . . . 233 PHE CA . 51188 1 93 . 1 . 1 29 29 PHE CB C 13 38.233 0.00 . 1 . . . . . 233 PHE CB . 51188 1 94 . 1 . 1 29 29 PHE N N 15 121.733 0.03 . 1 . . . . . 233 PHE N . 51188 1 95 . 1 . 1 30 30 PHE H H 1 7.638 0.00 . 1 . . . . . 234 PHE H . 51188 1 96 . 1 . 1 30 30 PHE C C 13 174.471 0.00 . 1 . . . . . 234 PHE C . 51188 1 97 . 1 . 1 30 30 PHE CA C 13 60.079 0.01 . 1 . . . . . 234 PHE CA . 51188 1 98 . 1 . 1 30 30 PHE CB C 13 36.811 0.00 . 1 . . . . . 234 PHE CB . 51188 1 99 . 1 . 1 30 30 PHE N N 15 113.813 0.05 . 1 . . . . . 234 PHE N . 51188 1 100 . 1 . 1 31 31 THR H H 1 7.408 0.00 . 1 . . . . . 235 THR H . 51188 1 101 . 1 . 1 31 31 THR C C 13 176.517 0.00 . 1 . . . . . 235 THR C . 51188 1 102 . 1 . 1 31 31 THR CA C 13 60.290 0.02 . 1 . . . . . 235 THR CA . 51188 1 103 . 1 . 1 31 31 THR CB C 13 65.373 0.00 . 1 . . . . . 235 THR CB . 51188 1 104 . 1 . 1 31 31 THR N N 15 116.791 0.02 . 1 . . . . . 235 THR N . 51188 1 105 . 1 . 1 32 32 ASN H H 1 7.130 0.00 . 1 . . . . . 236 ASN H . 51188 1 106 . 1 . 1 32 32 ASN C C 13 176.651 0.00 . 1 . . . . . 236 ASN C . 51188 1 107 . 1 . 1 32 32 ASN CA C 13 57.947 0.00 . 1 . . . . . 236 ASN CA . 51188 1 108 . 1 . 1 32 32 ASN CB C 13 36.370 0.00 . 1 . . . . . 236 ASN CB . 51188 1 109 . 1 . 1 32 32 ASN N N 15 125.902 0.02 . 1 . . . . . 236 ASN N . 51188 1 110 . 1 . 1 33 33 GLN H H 1 9.005 0.00 . 1 . . . . . 237 GLN H . 51188 1 111 . 1 . 1 33 33 GLN C C 13 178.756 0.00 . 1 . . . . . 237 GLN C . 51188 1 112 . 1 . 1 33 33 GLN CA C 13 59.808 0.00 . 1 . . . . . 237 GLN CA . 51188 1 113 . 1 . 1 33 33 GLN CB C 13 29.047 0.00 . 1 . . . . . 237 GLN CB . 51188 1 114 . 1 . 1 33 33 GLN N N 15 117.654 0.03 . 1 . . . . . 237 GLN N . 51188 1 115 . 1 . 1 34 34 LEU H H 1 7.202 0.00 . 1 . . . . . 238 LEU H . 51188 1 116 . 1 . 1 34 34 LEU HD11 H 1 0.953 0.00 . 1 . . . . . 238 LEU HD1 . 51188 1 117 . 1 . 1 34 34 LEU HD12 H 1 0.953 0.00 . 1 . . . . . 238 LEU HD1 . 51188 1 118 . 1 . 1 34 34 LEU HD13 H 1 0.953 0.00 . 1 . . . . . 238 LEU HD1 . 51188 1 119 . 1 . 1 34 34 LEU C C 13 176.702 0.01 . 1 . . . . . 238 LEU C . 51188 1 120 . 1 . 1 34 34 LEU CA C 13 57.187 0.00 . 1 . . . . . 238 LEU CA . 51188 1 121 . 1 . 1 34 34 LEU CB C 13 39.945 0.04 . 1 . . . . . 238 LEU CB . 51188 1 122 . 1 . 1 34 34 LEU CG C 13 27.283 0.00 . 1 . . . . . 238 LEU CG . 51188 1 123 . 1 . 1 34 34 LEU CD1 C 13 24.553 0.02 . 2 . . . . . 238 LEU CD1 . 51188 1 124 . 1 . 1 34 34 LEU N N 15 117.044 0.04 . 1 . . . . . 238 LEU N . 51188 1 125 . 1 . 1 35 35 ARG H H 1 7.572 0.00 . 1 . . . . . 239 ARG H . 51188 1 126 . 1 . 1 35 35 ARG C C 13 176.588 0.00 . 1 . . . . . 239 ARG C . 51188 1 127 . 1 . 1 35 35 ARG CA C 13 59.663 0.05 . 1 . . . . . 239 ARG CA . 51188 1 128 . 1 . 1 35 35 ARG CB C 13 29.502 0.00 . 1 . . . . . 239 ARG CB . 51188 1 129 . 1 . 1 35 35 ARG N N 15 122.065 0.03 . 1 . . . . . 239 ARG N . 51188 1 130 . 1 . 1 36 36 LYS H H 1 8.185 0.00 . 1 . . . . . 240 LYS H . 51188 1 131 . 1 . 1 36 36 LYS C C 13 177.947 0.00 . 1 . . . . . 240 LYS C . 51188 1 132 . 1 . 1 36 36 LYS CA C 13 59.855 0.04 . 1 . . . . . 240 LYS CA . 51188 1 133 . 1 . 1 36 36 LYS CB C 13 32.219 0.00 . 1 . . . . . 240 LYS CB . 51188 1 134 . 1 . 1 36 36 LYS N N 15 114.390 0.03 . 1 . . . . . 240 LYS N . 51188 1 135 . 1 . 1 37 37 ALA H H 1 7.105 0.00 . 1 . . . . . 241 ALA H . 51188 1 136 . 1 . 1 37 37 ALA C C 13 179.881 0.00 . 1 . . . . . 241 ALA C . 51188 1 137 . 1 . 1 37 37 ALA CA C 13 55.155 0.00 . 1 . . . . . 241 ALA CA . 51188 1 138 . 1 . 1 37 37 ALA CB C 13 18.236 0.00 . 1 . . . . . 241 ALA CB . 51188 1 139 . 1 . 1 37 37 ALA N N 15 120.815 0.02 . 1 . . . . . 241 ALA N . 51188 1 140 . 1 . 1 38 38 VAL H H 1 8.564 0.00 . 1 . . . . . 242 VAL H . 51188 1 141 . 1 . 1 38 38 VAL HG11 H 1 0.954 0.00 . 1 . . . . . 242 VAL HG1 . 51188 1 142 . 1 . 1 38 38 VAL HG12 H 1 0.954 0.00 . 1 . . . . . 242 VAL HG1 . 51188 1 143 . 1 . 1 38 38 VAL HG13 H 1 0.954 0.00 . 1 . . . . . 242 VAL HG1 . 51188 1 144 . 1 . 1 38 38 VAL HG21 H 1 0.440 0.00 . 1 . . . . . 242 VAL HG2 . 51188 1 145 . 1 . 1 38 38 VAL HG22 H 1 0.440 0.00 . 1 . . . . . 242 VAL HG2 . 51188 1 146 . 1 . 1 38 38 VAL HG23 H 1 0.440 0.00 . 1 . . . . . 242 VAL HG2 . 51188 1 147 . 1 . 1 38 38 VAL C C 13 179.803 0.18 . 1 . . . . . 242 VAL C . 51188 1 148 . 1 . 1 38 38 VAL CA C 13 65.872 0.08 . 1 . . . . . 242 VAL CA . 51188 1 149 . 1 . 1 38 38 VAL CB C 13 31.219 0.03 . 1 . . . . . 242 VAL CB . 51188 1 150 . 1 . 1 38 38 VAL CG1 C 13 23.025 0.03 . 2 . . . . . 242 VAL CG1 . 51188 1 151 . 1 . 1 38 38 VAL CG2 C 13 20.648 0.01 . 2 . . . . . 242 VAL CG2 . 51188 1 152 . 1 . 1 38 38 VAL N N 15 118.926 0.02 . 1 . . . . . 242 VAL N . 51188 1 153 . 1 . 1 39 39 TYR H H 1 7.989 0.00 . 1 . . . . . 243 TYR H . 51188 1 154 . 1 . 1 39 39 TYR C C 13 175.270 0.00 . 1 . . . . . 243 TYR C . 51188 1 155 . 1 . 1 39 39 TYR CA C 13 58.579 0.02 . 1 . . . . . 243 TYR CA . 51188 1 156 . 1 . 1 39 39 TYR CB C 13 36.744 0.00 . 1 . . . . . 243 TYR CB . 51188 1 157 . 1 . 1 39 39 TYR N N 15 120.231 0.03 . 1 . . . . . 243 TYR N . 51188 1 158 . 1 . 1 40 40 MET H H 1 7.395 0.00 . 1 . . . . . 244 MET H . 51188 1 159 . 1 . 1 40 40 MET C C 13 176.581 0.00 . 1 . . . . . 244 MET C . 51188 1 160 . 1 . 1 40 40 MET CA C 13 54.897 0.01 . 1 . . . . . 244 MET CA . 51188 1 161 . 1 . 1 40 40 MET CB C 13 31.952 0.00 . 1 . . . . . 244 MET CB . 51188 1 162 . 1 . 1 40 40 MET N N 15 114.233 0.03 . 1 . . . . . 244 MET N . 51188 1 163 . 1 . 1 41 41 MET H H 1 7.237 0.00 . 1 . . . . . 245 MET H . 51188 1 164 . 1 . 1 41 41 MET CA C 13 55.107 0.00 . 1 . . . . . 245 MET CA . 51188 1 165 . 1 . 1 41 41 MET CB C 13 32.270 0.00 . 1 . . . . . 245 MET CB . 51188 1 166 . 1 . 1 41 41 MET N N 15 118.491 0.02 . 1 . . . . . 245 MET N . 51188 1 167 . 1 . 1 42 42 PRO C C 13 176.328 0.00 . 1 . . . . . 246 PRO C . 51188 1 168 . 1 . 1 42 42 PRO CA C 13 62.907 0.00 . 1 . . . . . 246 PRO CA . 51188 1 169 . 1 . 1 42 42 PRO CB C 13 29.241 0.00 . 1 . . . . . 246 PRO CB . 51188 1 170 . 1 . 1 43 43 THR H H 1 7.936 0.00 . 1 . . . . . 247 THR H . 51188 1 171 . 1 . 1 43 43 THR C C 13 176.003 0.00 . 1 . . . . . 247 THR C . 51188 1 172 . 1 . 1 43 43 THR CA C 13 59.987 0.11 . 1 . . . . . 247 THR CA . 51188 1 173 . 1 . 1 43 43 THR CB C 13 68.918 0.00 . 1 . . . . . 247 THR CB . 51188 1 174 . 1 . 1 43 43 THR N N 15 114.422 0.02 . 1 . . . . . 247 THR N . 51188 1 175 . 1 . 1 44 44 GLU H H 1 9.075 0.00 . 1 . . . . . 248 GLU H . 51188 1 176 . 1 . 1 44 44 GLU C C 13 177.318 0.00 . 1 . . . . . 248 GLU C . 51188 1 177 . 1 . 1 44 44 GLU CA C 13 59.492 0.01 . 1 . . . . . 248 GLU CA . 51188 1 178 . 1 . 1 44 44 GLU CB C 13 28.317 0.00 . 1 . . . . . 248 GLU CB . 51188 1 179 . 1 . 1 44 44 GLU N N 15 124.829 0.03 . 1 . . . . . 248 GLU N . 51188 1 180 . 1 . 1 45 45 GLY H H 1 8.608 0.01 . 1 . . . . . 249 GLY H . 51188 1 181 . 1 . 1 45 45 GLY C C 13 174.443 0.00 . 1 . . . . . 249 GLY C . 51188 1 182 . 1 . 1 45 45 GLY CA C 13 44.581 0.06 . 1 . . . . . 249 GLY CA . 51188 1 183 . 1 . 1 45 45 GLY N N 15 108.762 0.03 . 1 . . . . . 249 GLY N . 51188 1 184 . 1 . 1 46 46 ASP H H 1 7.808 0.00 . 1 . . . . . 250 ASP H . 51188 1 185 . 1 . 1 46 46 ASP C C 13 175.711 0.00 . 1 . . . . . 250 ASP C . 51188 1 186 . 1 . 1 46 46 ASP CA C 13 54.095 0.04 . 1 . . . . . 250 ASP CA . 51188 1 187 . 1 . 1 46 46 ASP CB C 13 40.613 0.00 . 1 . . . . . 250 ASP CB . 51188 1 188 . 1 . 1 46 46 ASP N N 15 122.360 0.02 . 1 . . . . . 250 ASP N . 51188 1 189 . 1 . 1 47 47 ASP H H 1 8.536 0.00 . 1 . . . . . 251 ASP H . 51188 1 190 . 1 . 1 47 47 ASP C C 13 176.360 0.00 . 1 . . . . . 251 ASP C . 51188 1 191 . 1 . 1 47 47 ASP CA C 13 53.627 0.03 . 1 . . . . . 251 ASP CA . 51188 1 192 . 1 . 1 47 47 ASP CB C 13 42.828 0.00 . 1 . . . . . 251 ASP CB . 51188 1 193 . 1 . 1 47 47 ASP N N 15 122.112 0.03 . 1 . . . . . 251 ASP N . 51188 1 194 . 1 . 1 48 48 SER H H 1 8.302 0.00 . 1 . . . . . 252 SER H . 51188 1 195 . 1 . 1 48 48 SER C C 13 175.143 0.00 . 1 . . . . . 252 SER C . 51188 1 196 . 1 . 1 48 48 SER CA C 13 57.690 0.00 . 1 . . . . . 252 SER CA . 51188 1 197 . 1 . 1 48 48 SER CB C 13 62.855 0.00 . 1 . . . . . 252 SER CB . 51188 1 198 . 1 . 1 48 48 SER N N 15 116.247 0.02 . 1 . . . . . 252 SER N . 51188 1 199 . 1 . 1 49 49 SER H H 1 8.544 0.01 . 1 . . . . . 253 SER H . 51188 1 200 . 1 . 1 49 49 SER C C 13 175.079 0.00 . 1 . . . . . 253 SER C . 51188 1 201 . 1 . 1 49 49 SER CA C 13 59.461 0.05 . 1 . . . . . 253 SER CA . 51188 1 202 . 1 . 1 49 49 SER CB C 13 63.199 0.00 . 1 . . . . . 253 SER CB . 51188 1 203 . 1 . 1 49 49 SER N N 15 115.613 0.02 . 1 . . . . . 253 SER N . 51188 1 204 . 1 . 1 50 50 LYS H H 1 7.827 0.00 . 1 . . . . . 254 LYS H . 51188 1 205 . 1 . 1 50 50 LYS C C 13 176.065 0.00 . 1 . . . . . 254 LYS C . 51188 1 206 . 1 . 1 50 50 LYS CA C 13 55.704 0.00 . 1 . . . . . 254 LYS CA . 51188 1 207 . 1 . 1 50 50 LYS CB C 13 33.383 0.00 . 1 . . . . . 254 LYS CB . 51188 1 208 . 1 . 1 50 50 LYS N N 15 118.983 0.03 . 1 . . . . . 254 LYS N . 51188 1 209 . 1 . 1 51 51 SER H H 1 7.279 0.00 . 1 . . . . . 255 SER H . 51188 1 210 . 1 . 1 51 51 SER C C 13 175.116 0.00 . 1 . . . . . 255 SER C . 51188 1 211 . 1 . 1 51 51 SER CA C 13 56.710 0.00 . 1 . . . . . 255 SER CA . 51188 1 212 . 1 . 1 51 51 SER CB C 13 62.612 0.00 . 1 . . . . . 255 SER CB . 51188 1 213 . 1 . 1 51 51 SER N N 15 111.889 0.02 . 1 . . . . . 255 SER N . 51188 1 214 . 1 . 1 52 52 VAL H H 1 9.091 0.00 . 1 . . . . . 256 VAL H . 51188 1 215 . 1 . 1 52 52 VAL HG11 H 1 0.686 0.01 . 1 . . . . . 256 VAL HG1 . 51188 1 216 . 1 . 1 52 52 VAL HG12 H 1 0.686 0.01 . 1 . . . . . 256 VAL HG1 . 51188 1 217 . 1 . 1 52 52 VAL HG13 H 1 0.686 0.01 . 1 . . . . . 256 VAL HG1 . 51188 1 218 . 1 . 1 52 52 VAL HG21 H 1 0.940 0.01 . 1 . . . . . 256 VAL HG2 . 51188 1 219 . 1 . 1 52 52 VAL HG22 H 1 0.940 0.01 . 1 . . . . . 256 VAL HG2 . 51188 1 220 . 1 . 1 52 52 VAL HG23 H 1 0.940 0.01 . 1 . . . . . 256 VAL HG2 . 51188 1 221 . 1 . 1 52 52 VAL C C 13 174.703 0.04 . 1 . . . . . 256 VAL C . 51188 1 222 . 1 . 1 52 52 VAL CA C 13 66.001 0.04 . 1 . . . . . 256 VAL CA . 51188 1 223 . 1 . 1 52 52 VAL CB C 13 29.016 0.01 . 1 . . . . . 256 VAL CB . 51188 1 224 . 1 . 1 52 52 VAL CG1 C 13 21.457 0.02 . 2 . . . . . 256 VAL CG1 . 51188 1 225 . 1 . 1 52 52 VAL CG2 C 13 22.552 0.01 . 2 . . . . . 256 VAL CG2 . 51188 1 226 . 1 . 1 52 52 VAL N N 15 131.906 0.02 . 1 . . . . . 256 VAL N . 51188 1 227 . 1 . 1 53 53 PRO C C 13 177.480 0.00 . 1 . . . . . 257 PRO C . 51188 1 228 . 1 . 1 53 53 PRO CA C 13 66.933 0.00 . 1 . . . . . 257 PRO CA . 51188 1 229 . 1 . 1 53 53 PRO CB C 13 31.246 0.00 . 1 . . . . . 257 PRO CB . 51188 1 230 . 1 . 1 54 54 LEU H H 1 7.906 0.00 . 1 . . . . . 258 LEU H . 51188 1 231 . 1 . 1 54 54 LEU HD11 H 1 0.904 0.00 . 1 . . . . . 258 LEU HD1 . 51188 1 232 . 1 . 1 54 54 LEU HD12 H 1 0.904 0.00 . 1 . . . . . 258 LEU HD1 . 51188 1 233 . 1 . 1 54 54 LEU HD13 H 1 0.904 0.00 . 1 . . . . . 258 LEU HD1 . 51188 1 234 . 1 . 1 54 54 LEU C C 13 178.092 0.01 . 1 . . . . . 258 LEU C . 51188 1 235 . 1 . 1 54 54 LEU CA C 13 56.504 0.04 . 1 . . . . . 258 LEU CA . 51188 1 236 . 1 . 1 54 54 LEU CB C 13 41.502 0.02 . 1 . . . . . 258 LEU CB . 51188 1 237 . 1 . 1 54 54 LEU CG C 13 26.629 0.00 . 1 . . . . . 258 LEU CG . 51188 1 238 . 1 . 1 54 54 LEU CD1 C 13 23.049 0.01 . 2 . . . . . 258 LEU CD1 . 51188 1 239 . 1 . 1 54 54 LEU N N 15 118.178 0.03 . 1 . . . . . 258 LEU N . 51188 1 240 . 1 . 1 55 55 ALA H H 1 7.945 0.00 . 1 . . . . . 259 ALA H . 51188 1 241 . 1 . 1 55 55 ALA C C 13 181.335 0.00 . 1 . . . . . 259 ALA C . 51188 1 242 . 1 . 1 55 55 ALA CA C 13 54.382 0.02 . 1 . . . . . 259 ALA CA . 51188 1 243 . 1 . 1 55 55 ALA CB C 13 17.614 0.00 . 1 . . . . . 259 ALA CB . 51188 1 244 . 1 . 1 55 55 ALA N N 15 121.101 0.02 . 1 . . . . . 259 ALA N . 51188 1 245 . 1 . 1 56 56 LEU H H 1 8.398 0.00 . 1 . . . . . 260 LEU H . 51188 1 246 . 1 . 1 56 56 LEU HD11 H 1 0.398 0.00 . 1 . . . . . 260 LEU HD1 . 51188 1 247 . 1 . 1 56 56 LEU HD12 H 1 0.398 0.00 . 1 . . . . . 260 LEU HD1 . 51188 1 248 . 1 . 1 56 56 LEU HD13 H 1 0.398 0.00 . 1 . . . . . 260 LEU HD1 . 51188 1 249 . 1 . 1 56 56 LEU HD21 H 1 0.371 0.00 . 1 . . . . . 260 LEU HD2 . 51188 1 250 . 1 . 1 56 56 LEU HD22 H 1 0.371 0.00 . 1 . . . . . 260 LEU HD2 . 51188 1 251 . 1 . 1 56 56 LEU HD23 H 1 0.371 0.00 . 1 . . . . . 260 LEU HD2 . 51188 1 252 . 1 . 1 56 56 LEU C C 13 177.900 0.00 . 1 . . . . . 260 LEU C . 51188 1 253 . 1 . 1 56 56 LEU CA C 13 56.605 0.03 . 1 . . . . . 260 LEU CA . 51188 1 254 . 1 . 1 56 56 LEU CB C 13 41.069 0.01 . 1 . . . . . 260 LEU CB . 51188 1 255 . 1 . 1 56 56 LEU CG C 13 25.409 0.04 . 1 . . . . . 260 LEU CG . 51188 1 256 . 1 . 1 56 56 LEU CD1 C 13 25.346 0.02 . 2 . . . . . 260 LEU CD1 . 51188 1 257 . 1 . 1 56 56 LEU CD2 C 13 24.583 0.01 . 2 . . . . . 260 LEU CD2 . 51188 1 258 . 1 . 1 56 56 LEU N N 15 120.492 0.02 . 1 . . . . . 260 LEU N . 51188 1 259 . 1 . 1 57 57 GLN H H 1 7.847 0.00 . 1 . . . . . 261 GLN H . 51188 1 260 . 1 . 1 57 57 GLN C C 13 177.957 0.00 . 1 . . . . . 261 GLN C . 51188 1 261 . 1 . 1 57 57 GLN CA C 13 60.089 0.05 . 1 . . . . . 261 GLN CA . 51188 1 262 . 1 . 1 57 57 GLN CB C 13 28.636 0.00 . 1 . . . . . 261 GLN CB . 51188 1 263 . 1 . 1 57 57 GLN N N 15 117.906 0.02 . 1 . . . . . 261 GLN N . 51188 1 264 . 1 . 1 58 58 ARG H H 1 8.487 0.00 . 1 . . . . . 262 ARG H . 51188 1 265 . 1 . 1 58 58 ARG C C 13 177.755 0.00 . 1 . . . . . 262 ARG C . 51188 1 266 . 1 . 1 58 58 ARG CA C 13 59.787 0.02 . 1 . . . . . 262 ARG CA . 51188 1 267 . 1 . 1 58 58 ARG CB C 13 29.102 0.00 . 1 . . . . . 262 ARG CB . 51188 1 268 . 1 . 1 58 58 ARG N N 15 117.991 0.02 . 1 . . . . . 262 ARG N . 51188 1 269 . 1 . 1 59 59 VAL H H 1 7.706 0.00 . 1 . . . . . 263 VAL H . 51188 1 270 . 1 . 1 59 59 VAL HG11 H 1 1.113 0.00 . 1 . . . . . 263 VAL HG1 . 51188 1 271 . 1 . 1 59 59 VAL HG12 H 1 1.113 0.00 . 1 . . . . . 263 VAL HG1 . 51188 1 272 . 1 . 1 59 59 VAL HG13 H 1 1.113 0.00 . 1 . . . . . 263 VAL HG1 . 51188 1 273 . 1 . 1 59 59 VAL HG21 H 1 0.955 0.00 . 1 . . . . . 263 VAL HG2 . 51188 1 274 . 1 . 1 59 59 VAL HG22 H 1 0.955 0.00 . 1 . . . . . 263 VAL HG2 . 51188 1 275 . 1 . 1 59 59 VAL HG23 H 1 0.955 0.00 . 1 . . . . . 263 VAL HG2 . 51188 1 276 . 1 . 1 59 59 VAL C C 13 177.822 0.01 . 1 . . . . . 263 VAL C . 51188 1 277 . 1 . 1 59 59 VAL CA C 13 66.010 0.05 . 1 . . . . . 263 VAL CA . 51188 1 278 . 1 . 1 59 59 VAL CB C 13 31.387 0.02 . 1 . . . . . 263 VAL CB . 51188 1 279 . 1 . 1 59 59 VAL CG1 C 13 24.003 0.00 . 2 . . . . . 263 VAL CG1 . 51188 1 280 . 1 . 1 59 59 VAL CG2 C 13 21.926 0.02 . 2 . . . . . 263 VAL CG2 . 51188 1 281 . 1 . 1 59 59 VAL N N 15 117.870 0.02 . 1 . . . . . 263 VAL N . 51188 1 282 . 1 . 1 60 60 PHE H H 1 8.536 0.00 . 1 . . . . . 264 PHE H . 51188 1 283 . 1 . 1 60 60 PHE C C 13 176.257 0.00 . 1 . . . . . 264 PHE C . 51188 1 284 . 1 . 1 60 60 PHE CA C 13 57.323 0.00 . 1 . . . . . 264 PHE CA . 51188 1 285 . 1 . 1 60 60 PHE CB C 13 35.242 0.00 . 1 . . . . . 264 PHE CB . 51188 1 286 . 1 . 1 60 60 PHE N N 15 118.340 0.03 . 1 . . . . . 264 PHE N . 51188 1 287 . 1 . 1 61 61 TYR H H 1 9.291 0.00 . 1 . . . . . 265 TYR H . 51188 1 288 . 1 . 1 61 61 TYR C C 13 180.182 0.00 . 1 . . . . . 265 TYR C . 51188 1 289 . 1 . 1 61 61 TYR CA C 13 62.881 0.00 . 1 . . . . . 265 TYR CA . 51188 1 290 . 1 . 1 61 61 TYR CB C 13 38.599 0.00 . 1 . . . . . 265 TYR CB . 51188 1 291 . 1 . 1 61 61 TYR N N 15 120.604 0.02 . 1 . . . . . 265 TYR N . 51188 1 292 . 1 . 1 62 62 GLU H H 1 8.772 0.00 . 1 . . . . . 266 GLU H . 51188 1 293 . 1 . 1 62 62 GLU C C 13 179.099 0.00 . 1 . . . . . 266 GLU C . 51188 1 294 . 1 . 1 62 62 GLU CA C 13 59.754 0.00 . 1 . . . . . 266 GLU CA . 51188 1 295 . 1 . 1 62 62 GLU CB C 13 29.822 0.00 . 1 . . . . . 266 GLU CB . 51188 1 296 . 1 . 1 62 62 GLU N N 15 121.110 0.03 . 1 . . . . . 266 GLU N . 51188 1 297 . 1 . 1 63 63 LEU H H 1 8.870 0.00 . 1 . . . . . 267 LEU H . 51188 1 298 . 1 . 1 63 63 LEU HD11 H 1 0.442 0.00 . 1 . . . . . 267 LEU HD1 . 51188 1 299 . 1 . 1 63 63 LEU HD12 H 1 0.442 0.00 . 1 . . . . . 267 LEU HD1 . 51188 1 300 . 1 . 1 63 63 LEU HD13 H 1 0.442 0.00 . 1 . . . . . 267 LEU HD1 . 51188 1 301 . 1 . 1 63 63 LEU C C 13 179.029 0.04 . 1 . . . . . 267 LEU C . 51188 1 302 . 1 . 1 63 63 LEU CA C 13 57.408 0.06 . 1 . . . . . 267 LEU CA . 51188 1 303 . 1 . 1 63 63 LEU CB C 13 39.550 0.02 . 1 . . . . . 267 LEU CB . 51188 1 304 . 1 . 1 63 63 LEU CG C 13 25.880 0.00 . 1 . . . . . 267 LEU CG . 51188 1 305 . 1 . 1 63 63 LEU CD1 C 13 22.541 0.02 . 2 . . . . . 267 LEU CD1 . 51188 1 306 . 1 . 1 63 63 LEU N N 15 122.895 0.03 . 1 . . . . . 267 LEU N . 51188 1 307 . 1 . 1 64 64 GLN H H 1 8.067 0.00 . 1 . . . . . 268 GLN H . 51188 1 308 . 1 . 1 64 64 GLN C C 13 176.097 0.00 . 1 . . . . . 268 GLN C . 51188 1 309 . 1 . 1 64 64 GLN CA C 13 57.111 0.05 . 1 . . . . . 268 GLN CA . 51188 1 310 . 1 . 1 64 64 GLN CB C 13 28.120 0.00 . 1 . . . . . 268 GLN CB . 51188 1 311 . 1 . 1 64 64 GLN N N 15 117.860 0.02 . 1 . . . . . 268 GLN N . 51188 1 312 . 1 . 1 65 65 HIS H H 1 7.573 0.00 . 1 . . . . . 269 HIS H . 51188 1 313 . 1 . 1 65 65 HIS C C 13 175.045 0.00 . 1 . . . . . 269 HIS C . 51188 1 314 . 1 . 1 65 65 HIS CA C 13 57.959 0.04 . 1 . . . . . 269 HIS CA . 51188 1 315 . 1 . 1 65 65 HIS CB C 13 30.938 0.00 . 1 . . . . . 269 HIS CB . 51188 1 316 . 1 . 1 65 65 HIS N N 15 114.907 0.06 . 1 . . . . . 269 HIS N . 51188 1 317 . 1 . 1 66 66 SER H H 1 9.274 0.00 . 1 . . . . . 270 SER H . 51188 1 318 . 1 . 1 66 66 SER C C 13 174.450 0.00 . 1 . . . . . 270 SER C . 51188 1 319 . 1 . 1 66 66 SER CA C 13 58.626 0.03 . 1 . . . . . 270 SER CA . 51188 1 320 . 1 . 1 66 66 SER CB C 13 64.043 0.00 . 1 . . . . . 270 SER CB . 51188 1 321 . 1 . 1 66 66 SER N N 15 116.835 0.02 . 1 . . . . . 270 SER N . 51188 1 322 . 1 . 1 67 67 ASP H H 1 8.408 0.00 . 1 . . . . . 271 ASP H . 51188 1 323 . 1 . 1 67 67 ASP C C 13 175.619 0.00 . 1 . . . . . 271 ASP C . 51188 1 324 . 1 . 1 67 67 ASP CA C 13 53.445 0.04 . 1 . . . . . 271 ASP CA . 51188 1 325 . 1 . 1 67 67 ASP CB C 13 40.461 0.00 . 1 . . . . . 271 ASP CB . 51188 1 326 . 1 . 1 67 67 ASP N N 15 121.830 0.02 . 1 . . . . . 271 ASP N . 51188 1 327 . 1 . 1 68 68 LYS H H 1 8.044 0.00 . 1 . . . . . 272 LYS H . 51188 1 328 . 1 . 1 68 68 LYS CA C 13 53.003 0.00 . 1 . . . . . 272 LYS CA . 51188 1 329 . 1 . 1 68 68 LYS CB C 13 32.890 0.00 . 1 . . . . . 272 LYS CB . 51188 1 330 . 1 . 1 68 68 LYS N N 15 121.847 0.03 . 1 . . . . . 272 LYS N . 51188 1 331 . 1 . 1 69 69 PRO C C 13 176.378 0.00 . 1 . . . . . 273 PRO C . 51188 1 332 . 1 . 1 69 69 PRO CA C 13 63.019 0.00 . 1 . . . . . 273 PRO CA . 51188 1 333 . 1 . 1 69 69 PRO CB C 13 31.569 0.00 . 1 . . . . . 273 PRO CB . 51188 1 334 . 1 . 1 70 70 VAL H H 1 8.272 0.00 . 1 . . . . . 274 VAL H . 51188 1 335 . 1 . 1 70 70 VAL HG11 H 1 1.008 0.00 . 1 . . . . . 274 VAL HG1 . 51188 1 336 . 1 . 1 70 70 VAL HG12 H 1 1.008 0.00 . 1 . . . . . 274 VAL HG1 . 51188 1 337 . 1 . 1 70 70 VAL HG13 H 1 1.008 0.00 . 1 . . . . . 274 VAL HG1 . 51188 1 338 . 1 . 1 70 70 VAL HG21 H 1 1.139 0.00 . 1 . . . . . 274 VAL HG2 . 51188 1 339 . 1 . 1 70 70 VAL HG22 H 1 1.139 0.00 . 1 . . . . . 274 VAL HG2 . 51188 1 340 . 1 . 1 70 70 VAL HG23 H 1 1.139 0.00 . 1 . . . . . 274 VAL HG2 . 51188 1 341 . 1 . 1 70 70 VAL C C 13 175.930 0.00 . 1 . . . . . 274 VAL C . 51188 1 342 . 1 . 1 70 70 VAL CA C 13 63.069 0.08 . 1 . . . . . 274 VAL CA . 51188 1 343 . 1 . 1 70 70 VAL CB C 13 34.086 0.01 . 1 . . . . . 274 VAL CB . 51188 1 344 . 1 . 1 70 70 VAL CG1 C 13 23.599 0.01 . 2 . . . . . 274 VAL CG1 . 51188 1 345 . 1 . 1 70 70 VAL CG2 C 13 21.996 0.01 . 2 . . . . . 274 VAL CG2 . 51188 1 346 . 1 . 1 70 70 VAL N N 15 126.737 0.03 . 1 . . . . . 274 VAL N . 51188 1 347 . 1 . 1 71 71 GLY H H 1 8.756 0.00 . 1 . . . . . 275 GLY H . 51188 1 348 . 1 . 1 71 71 GLY C C 13 174.525 0.00 . 1 . . . . . 275 GLY C . 51188 1 349 . 1 . 1 71 71 GLY CA C 13 44.629 0.01 . 1 . . . . . 275 GLY CA . 51188 1 350 . 1 . 1 71 71 GLY N N 15 114.015 0.02 . 1 . . . . . 275 GLY N . 51188 1 351 . 1 . 1 72 72 THR H H 1 8.271 0.00 . 1 . . . . . 276 THR H . 51188 1 352 . 1 . 1 72 72 THR C C 13 179.351 0.00 . 1 . . . . . 276 THR C . 51188 1 353 . 1 . 1 72 72 THR CA C 13 59.070 0.01 . 1 . . . . . 276 THR CA . 51188 1 354 . 1 . 1 72 72 THR CB C 13 68.887 0.00 . 1 . . . . . 276 THR CB . 51188 1 355 . 1 . 1 72 72 THR N N 15 115.360 0.03 . 1 . . . . . 276 THR N . 51188 1 356 . 1 . 1 73 73 LYS H H 1 7.369 0.00 . 1 . . . . . 277 LYS H . 51188 1 357 . 1 . 1 73 73 LYS C C 13 179.148 0.00 . 1 . . . . . 277 LYS C . 51188 1 358 . 1 . 1 73 73 LYS CA C 13 58.590 0.07 . 1 . . . . . 277 LYS CA . 51188 1 359 . 1 . 1 73 73 LYS CB C 13 31.412 0.00 . 1 . . . . . 277 LYS CB . 51188 1 360 . 1 . 1 73 73 LYS N N 15 117.817 0.02 . 1 . . . . . 277 LYS N . 51188 1 361 . 1 . 1 74 74 LYS H H 1 7.891 0.00 . 1 . . . . . 278 LYS H . 51188 1 362 . 1 . 1 74 74 LYS C C 13 179.108 0.00 . 1 . . . . . 278 LYS C . 51188 1 363 . 1 . 1 74 74 LYS CA C 13 59.282 0.03 . 1 . . . . . 278 LYS CA . 51188 1 364 . 1 . 1 74 74 LYS CB C 13 29.675 0.00 . 1 . . . . . 278 LYS CB . 51188 1 365 . 1 . 1 74 74 LYS N N 15 122.249 0.02 . 1 . . . . . 278 LYS N . 51188 1 366 . 1 . 1 75 75 LEU H H 1 7.273 0.00 . 1 . . . . . 279 LEU H . 51188 1 367 . 1 . 1 75 75 LEU HD11 H 1 0.945 0.00 . 1 . . . . . 279 LEU HD1 . 51188 1 368 . 1 . 1 75 75 LEU HD12 H 1 0.945 0.00 . 1 . . . . . 279 LEU HD1 . 51188 1 369 . 1 . 1 75 75 LEU HD13 H 1 0.945 0.00 . 1 . . . . . 279 LEU HD1 . 51188 1 370 . 1 . 1 75 75 LEU HD21 H 1 0.774 0.01 . 1 . . . . . 279 LEU HD2 . 51188 1 371 . 1 . 1 75 75 LEU HD22 H 1 0.774 0.01 . 1 . . . . . 279 LEU HD2 . 51188 1 372 . 1 . 1 75 75 LEU HD23 H 1 0.774 0.01 . 1 . . . . . 279 LEU HD2 . 51188 1 373 . 1 . 1 75 75 LEU C C 13 178.360 0.02 . 1 . . . . . 279 LEU C . 51188 1 374 . 1 . 1 75 75 LEU CA C 13 57.185 0.05 . 1 . . . . . 279 LEU CA . 51188 1 375 . 1 . 1 75 75 LEU CB C 13 40.311 0.03 . 1 . . . . . 279 LEU CB . 51188 1 376 . 1 . 1 75 75 LEU CG C 13 26.825 0.01 . 1 . . . . . 279 LEU CG . 51188 1 377 . 1 . 1 75 75 LEU CD1 C 13 28.736 0.01 . 2 . . . . . 279 LEU CD1 . 51188 1 378 . 1 . 1 75 75 LEU CD2 C 13 23.935 0.01 . 2 . . . . . 279 LEU CD2 . 51188 1 379 . 1 . 1 75 75 LEU N N 15 120.285 0.02 . 1 . . . . . 279 LEU N . 51188 1 380 . 1 . 1 76 76 THR H H 1 8.224 0.00 . 1 . . . . . 280 THR H . 51188 1 381 . 1 . 1 76 76 THR C C 13 176.950 0.00 . 1 . . . . . 280 THR C . 51188 1 382 . 1 . 1 76 76 THR CA C 13 65.263 0.01 . 1 . . . . . 280 THR CA . 51188 1 383 . 1 . 1 76 76 THR CB C 13 67.062 0.00 . 1 . . . . . 280 THR CB . 51188 1 384 . 1 . 1 76 76 THR N N 15 112.541 0.03 . 1 . . . . . 280 THR N . 51188 1 385 . 1 . 1 77 77 LYS H H 1 7.507 0.00 . 1 . . . . . 281 LYS H . 51188 1 386 . 1 . 1 77 77 LYS C C 13 179.186 0.00 . 1 . . . . . 281 LYS C . 51188 1 387 . 1 . 1 77 77 LYS CA C 13 58.382 0.02 . 1 . . . . . 281 LYS CA . 51188 1 388 . 1 . 1 77 77 LYS CB C 13 31.285 0.00 . 1 . . . . . 281 LYS CB . 51188 1 389 . 1 . 1 77 77 LYS N N 15 119.898 0.03 . 1 . . . . . 281 LYS N . 51188 1 390 . 1 . 1 78 78 SER H H 1 7.328 0.00 . 1 . . . . . 282 SER H . 51188 1 391 . 1 . 1 78 78 SER C C 13 175.113 0.00 . 1 . . . . . 282 SER C . 51188 1 392 . 1 . 1 78 78 SER CA C 13 62.040 0.07 . 1 . . . . . 282 SER CA . 51188 1 393 . 1 . 1 78 78 SER CB C 13 62.777 0.00 . 1 . . . . . 282 SER CB . 51188 1 394 . 1 . 1 78 78 SER N N 15 116.108 0.03 . 1 . . . . . 282 SER N . 51188 1 395 . 1 . 1 79 79 PHE H H 1 6.829 0.01 . 1 . . . . . 283 PHE H . 51188 1 396 . 1 . 1 79 79 PHE C C 13 176.346 0.00 . 1 . . . . . 283 PHE C . 51188 1 397 . 1 . 1 79 79 PHE CA C 13 56.355 0.02 . 1 . . . . . 283 PHE CA . 51188 1 398 . 1 . 1 79 79 PHE CB C 13 37.687 0.00 . 1 . . . . . 283 PHE CB . 51188 1 399 . 1 . 1 79 79 PHE N N 15 115.733 0.04 . 1 . . . . . 283 PHE N . 51188 1 400 . 1 . 1 80 80 GLY H H 1 7.469 0.00 . 1 . . . . . 284 GLY H . 51188 1 401 . 1 . 1 80 80 GLY C C 13 175.075 0.00 . 1 . . . . . 284 GLY C . 51188 1 402 . 1 . 1 80 80 GLY CA C 13 46.571 0.02 . 1 . . . . . 284 GLY CA . 51188 1 403 . 1 . 1 80 80 GLY N N 15 108.590 0.03 . 1 . . . . . 284 GLY N . 51188 1 404 . 1 . 1 81 81 TRP H H 1 6.865 0.00 . 1 . . . . . 285 TRP H . 51188 1 405 . 1 . 1 81 81 TRP C C 13 174.620 0.00 . 1 . . . . . 285 TRP C . 51188 1 406 . 1 . 1 81 81 TRP CA C 13 54.696 0.04 . 1 . . . . . 285 TRP CA . 51188 1 407 . 1 . 1 81 81 TRP CB C 13 28.209 0.00 . 1 . . . . . 285 TRP CB . 51188 1 408 . 1 . 1 81 81 TRP N N 15 122.895 0.03 . 1 . . . . . 285 TRP N . 51188 1 409 . 1 . 1 82 82 GLU H H 1 8.177 0.00 . 1 . . . . . 286 GLU H . 51188 1 410 . 1 . 1 82 82 GLU C C 13 176.554 0.00 . 1 . . . . . 286 GLU C . 51188 1 411 . 1 . 1 82 82 GLU CA C 13 56.837 0.00 . 1 . . . . . 286 GLU CA . 51188 1 412 . 1 . 1 82 82 GLU CB C 13 31.401 0.00 . 1 . . . . . 286 GLU CB . 51188 1 413 . 1 . 1 82 82 GLU N N 15 117.743 0.03 . 1 . . . . . 286 GLU N . 51188 1 414 . 1 . 1 83 83 THR H H 1 7.672 0.00 . 1 . . . . . 287 THR H . 51188 1 415 . 1 . 1 83 83 THR CA C 13 59.665 0.00 . 1 . . . . . 287 THR CA . 51188 1 416 . 1 . 1 83 83 THR CB C 13 71.416 0.00 . 1 . . . . . 287 THR CB . 51188 1 417 . 1 . 1 83 83 THR N N 15 109.493 0.03 . 1 . . . . . 287 THR N . 51188 1 418 . 1 . 1 84 84 LEU HD11 H 1 0.925 0.00 . 1 . . . . . 288 LEU HD1 . 51188 1 419 . 1 . 1 84 84 LEU HD12 H 1 0.925 0.00 . 1 . . . . . 288 LEU HD1 . 51188 1 420 . 1 . 1 84 84 LEU HD13 H 1 0.925 0.00 . 1 . . . . . 288 LEU HD1 . 51188 1 421 . 1 . 1 84 84 LEU HD21 H 1 0.941 0.01 . 1 . . . . . 288 LEU HD2 . 51188 1 422 . 1 . 1 84 84 LEU HD22 H 1 0.941 0.01 . 1 . . . . . 288 LEU HD2 . 51188 1 423 . 1 . 1 84 84 LEU HD23 H 1 0.941 0.01 . 1 . . . . . 288 LEU HD2 . 51188 1 424 . 1 . 1 84 84 LEU C C 13 178.55 0.00 . 1 . . . . . 288 LEU C . 51188 1 425 . 1 . 1 84 84 LEU CA C 13 57.39 0.00 . 1 . . . . . 288 LEU CA . 51188 1 426 . 1 . 1 84 84 LEU CB C 13 41.016 0.00 . 1 . . . . . 288 LEU CB . 51188 1 427 . 1 . 1 84 84 LEU CG C 13 26.631 0.02 . 1 . . . . . 288 LEU CG . 51188 1 428 . 1 . 1 84 84 LEU CD1 C 13 25.195 0.01 . 2 . . . . . 288 LEU CD1 . 51188 1 429 . 1 . 1 84 84 LEU CD2 C 13 24.340 0.02 . 2 . . . . . 288 LEU CD2 . 51188 1 430 . 1 . 1 85 85 ASP H H 1 8.216 0.00 . 1 . . . . . 289 ASP H . 51188 1 431 . 1 . 1 85 85 ASP CA C 13 56.303 0.00 . 1 . . . . . 289 ASP CA . 51188 1 432 . 1 . 1 85 85 ASP N N 15 116.719 0.03 . 1 . . . . . 289 ASP N . 51188 1 433 . 1 . 1 86 86 SER H H 1 8.300 0.00 . 1 . . . . . 290 SER H . 51188 1 434 . 1 . 1 86 86 SER C C 13 175.706 0.00 . 1 . . . . . 290 SER C . 51188 1 435 . 1 . 1 86 86 SER CA C 13 61.866 0.00 . 1 . . . . . 290 SER CA . 51188 1 436 . 1 . 1 86 86 SER CB C 13 62.891 0.00 . 1 . . . . . 290 SER CB . 51188 1 437 . 1 . 1 86 86 SER N N 15 116.240 0.00 . 1 . . . . . 290 SER N . 51188 1 438 . 1 . 1 87 87 PHE H H 1 7.705 0.00 . 1 . . . . . 291 PHE H . 51188 1 439 . 1 . 1 87 87 PHE C C 13 178.380 0.00 . 1 . . . . . 291 PHE C . 51188 1 440 . 1 . 1 87 87 PHE CA C 13 60.941 0.02 . 1 . . . . . 291 PHE CA . 51188 1 441 . 1 . 1 87 87 PHE CB C 13 39.300 0.00 . 1 . . . . . 291 PHE CB . 51188 1 442 . 1 . 1 87 87 PHE N N 15 119.511 0.03 . 1 . . . . . 291 PHE N . 51188 1 443 . 1 . 1 88 88 MET H H 1 8.067 0.00 . 1 . . . . . 292 MET H . 51188 1 444 . 1 . 1 88 88 MET C C 13 177.304 0.00 . 1 . . . . . 292 MET C . 51188 1 445 . 1 . 1 88 88 MET CA C 13 56.642 0.01 . 1 . . . . . 292 MET CA . 51188 1 446 . 1 . 1 88 88 MET CB C 13 31.408 0.00 . 1 . . . . . 292 MET CB . 51188 1 447 . 1 . 1 88 88 MET N N 15 117.718 0.02 . 1 . . . . . 292 MET N . 51188 1 448 . 1 . 1 89 89 GLN H H 1 7.328 0.00 . 1 . . . . . 293 GLN H . 51188 1 449 . 1 . 1 89 89 GLN C C 13 174.943 0.00 . 1 . . . . . 293 GLN C . 51188 1 450 . 1 . 1 89 89 GLN CA C 13 55.503 0.02 . 1 . . . . . 293 GLN CA . 51188 1 451 . 1 . 1 89 89 GLN CB C 13 28.177 0.00 . 1 . . . . . 293 GLN CB . 51188 1 452 . 1 . 1 89 89 GLN N N 15 116.256 0.02 . 1 . . . . . 293 GLN N . 51188 1 453 . 1 . 1 90 90 HIS H H 1 7.075 0.00 . 1 . . . . . 294 HIS H . 51188 1 454 . 1 . 1 90 90 HIS C C 13 172.587 0.00 . 1 . . . . . 294 HIS C . 51188 1 455 . 1 . 1 90 90 HIS CA C 13 54.337 0.00 . 1 . . . . . 294 HIS CA . 51188 1 456 . 1 . 1 90 90 HIS CB C 13 32.237 0.00 . 1 . . . . . 294 HIS CB . 51188 1 457 . 1 . 1 90 90 HIS N N 15 116.628 0.03 . 1 . . . . . 294 HIS N . 51188 1 458 . 1 . 1 91 91 ASP H H 1 8.085 0.00 . 1 . . . . . 295 ASP H . 51188 1 459 . 1 . 1 91 91 ASP C C 13 176.669 0.00 . 1 . . . . . 295 ASP C . 51188 1 460 . 1 . 1 91 91 ASP CA C 13 52.489 0.00 . 1 . . . . . 295 ASP CA . 51188 1 461 . 1 . 1 91 91 ASP CB C 13 42.562 0.00 . 1 . . . . . 295 ASP CB . 51188 1 462 . 1 . 1 91 91 ASP N N 15 119.307 0.02 . 1 . . . . . 295 ASP N . 51188 1 463 . 1 . 1 92 92 VAL H H 1 8.062 0.00 . 1 . . . . . 296 VAL H . 51188 1 464 . 1 . 1 92 92 VAL HG11 H 1 1.133 0.01 . 1 . . . . . 296 VAL HG1 . 51188 1 465 . 1 . 1 92 92 VAL HG12 H 1 1.133 0.01 . 1 . . . . . 296 VAL HG1 . 51188 1 466 . 1 . 1 92 92 VAL HG13 H 1 1.133 0.01 . 1 . . . . . 296 VAL HG1 . 51188 1 467 . 1 . 1 92 92 VAL HG21 H 1 0.956 0.01 . 1 . . . . . 296 VAL HG2 . 51188 1 468 . 1 . 1 92 92 VAL HG22 H 1 0.956 0.01 . 1 . . . . . 296 VAL HG2 . 51188 1 469 . 1 . 1 92 92 VAL HG23 H 1 0.956 0.01 . 1 . . . . . 296 VAL HG2 . 51188 1 470 . 1 . 1 92 92 VAL C C 13 175.646 0.00 . 1 . . . . . 296 VAL C . 51188 1 471 . 1 . 1 92 92 VAL CA C 13 64.448 0.05 . 1 . . . . . 296 VAL CA . 51188 1 472 . 1 . 1 92 92 VAL CB C 13 30.804 0.07 . 1 . . . . . 296 VAL CB . 51188 1 473 . 1 . 1 92 92 VAL CG1 C 13 21.032 0.01 . 2 . . . . . 296 VAL CG1 . 51188 1 474 . 1 . 1 92 92 VAL CG2 C 13 23.166 0.02 . 2 . . . . . 296 VAL CG2 . 51188 1 475 . 1 . 1 92 92 VAL N N 15 119.656 0.02 . 1 . . . . . 296 VAL N . 51188 1 476 . 1 . 1 93 93 GLN H H 1 8.201 0.00 . 1 . . . . . 297 GLN H . 51188 1 477 . 1 . 1 93 93 GLN C C 13 178.405 0.00 . 1 . . . . . 297 GLN C . 51188 1 478 . 1 . 1 93 93 GLN CA C 13 58.047 0.03 . 1 . . . . . 297 GLN CA . 51188 1 479 . 1 . 1 93 93 GLN CB C 13 26.562 0.00 . 1 . . . . . 297 GLN CB . 51188 1 480 . 1 . 1 93 93 GLN N N 15 123.006 0.03 . 1 . . . . . 297 GLN N . 51188 1 481 . 1 . 1 94 94 GLU H H 1 8.060 0.00 . 1 . . . . . 298 GLU H . 51188 1 482 . 1 . 1 94 94 GLU C C 13 179.392 0.00 . 1 . . . . . 298 GLU C . 51188 1 483 . 1 . 1 94 94 GLU CA C 13 58.986 0.00 . 1 . . . . . 298 GLU CA . 51188 1 484 . 1 . 1 94 94 GLU CB C 13 29.312 0.00 . 1 . . . . . 298 GLU CB . 51188 1 485 . 1 . 1 94 94 GLU N N 15 121.878 0.02 . 1 . . . . . 298 GLU N . 51188 1 486 . 1 . 1 95 95 LEU H H 1 7.734 0.00 . 1 . . . . . 299 LEU H . 51188 1 487 . 1 . 1 95 95 LEU HD11 H 1 -0.102 0.01 . 1 . . . . . 299 LEU HD1 . 51188 1 488 . 1 . 1 95 95 LEU HD12 H 1 -0.102 0.01 . 1 . . . . . 299 LEU HD1 . 51188 1 489 . 1 . 1 95 95 LEU HD13 H 1 -0.102 0.01 . 1 . . . . . 299 LEU HD1 . 51188 1 490 . 1 . 1 95 95 LEU C C 13 176.959 0.02 . 1 . . . . . 299 LEU C . 51188 1 491 . 1 . 1 95 95 LEU CA C 13 57.041 0.04 . 1 . . . . . 299 LEU CA . 51188 1 492 . 1 . 1 95 95 LEU CB C 13 39.496 0.01 . 1 . . . . . 299 LEU CB . 51188 1 493 . 1 . 1 95 95 LEU CG C 13 26.696 0.00 . 1 . . . . . 299 LEU CG . 51188 1 494 . 1 . 1 95 95 LEU CD1 C 13 22.104 0.02 . 2 . . . . . 299 LEU CD1 . 51188 1 495 . 1 . 1 95 95 LEU N N 15 119.479 0.03 . 1 . . . . . 299 LEU N . 51188 1 496 . 1 . 1 96 96 CYS H H 1 8.298 0.00 . 1 . . . . . 300 CYS H . 51188 1 497 . 1 . 1 96 96 CYS C C 13 175.713 0.00 . 1 . . . . . 300 CYS C . 51188 1 498 . 1 . 1 96 96 CYS CA C 13 63.265 0.01 . 1 . . . . . 300 CYS CA . 51188 1 499 . 1 . 1 96 96 CYS CB C 13 25.865 0.00 . 1 . . . . . 300 CYS CB . 51188 1 500 . 1 . 1 96 96 CYS N N 15 118.641 0.02 . 1 . . . . . 300 CYS N . 51188 1 501 . 1 . 1 97 97 ARG H H 1 7.805 0.00 . 1 . . . . . 301 ARG H . 51188 1 502 . 1 . 1 97 97 ARG C C 13 178.294 0.00 . 1 . . . . . 301 ARG C . 51188 1 503 . 1 . 1 97 97 ARG CA C 13 58.745 0.01 . 1 . . . . . 301 ARG CA . 51188 1 504 . 1 . 1 97 97 ARG CB C 13 29.691 0.00 . 1 . . . . . 301 ARG CB . 51188 1 505 . 1 . 1 97 97 ARG N N 15 117.492 0.02 . 1 . . . . . 301 ARG N . 51188 1 506 . 1 . 1 98 98 VAL H H 1 7.759 0.00 . 1 . . . . . 302 VAL H . 51188 1 507 . 1 . 1 98 98 VAL HG11 H 1 0.706 0.00 . 1 . . . . . 302 VAL HG1 . 51188 1 508 . 1 . 1 98 98 VAL HG12 H 1 0.706 0.00 . 1 . . . . . 302 VAL HG1 . 51188 1 509 . 1 . 1 98 98 VAL HG13 H 1 0.706 0.00 . 1 . . . . . 302 VAL HG1 . 51188 1 510 . 1 . 1 98 98 VAL HG21 H 1 0.922 0.00 . 1 . . . . . 302 VAL HG2 . 51188 1 511 . 1 . 1 98 98 VAL HG22 H 1 0.922 0.00 . 1 . . . . . 302 VAL HG2 . 51188 1 512 . 1 . 1 98 98 VAL HG23 H 1 0.922 0.00 . 1 . . . . . 302 VAL HG2 . 51188 1 513 . 1 . 1 98 98 VAL C C 13 179.651 0.00 . 1 . . . . . 302 VAL C . 51188 1 514 . 1 . 1 98 98 VAL CA C 13 65.868 0.04 . 1 . . . . . 302 VAL CA . 51188 1 515 . 1 . 1 98 98 VAL CB C 13 31.017 0.01 . 1 . . . . . 302 VAL CB . 51188 1 516 . 1 . 1 98 98 VAL CG1 C 13 21.511 0.01 . 2 . . . . . 302 VAL CG1 . 51188 1 517 . 1 . 1 98 98 VAL CG2 C 13 24.400 0.00 . 2 . . . . . 302 VAL CG2 . 51188 1 518 . 1 . 1 98 98 VAL N N 15 119.143 0.02 . 1 . . . . . 302 VAL N . 51188 1 519 . 1 . 1 99 99 LEU H H 1 7.796 0.00 . 1 . . . . . 303 LEU H . 51188 1 520 . 1 . 1 99 99 LEU HD11 H 1 0.328 0.00 . 1 . . . . . 303 LEU HD1 . 51188 1 521 . 1 . 1 99 99 LEU HD12 H 1 0.328 0.00 . 1 . . . . . 303 LEU HD1 . 51188 1 522 . 1 . 1 99 99 LEU HD13 H 1 0.328 0.00 . 1 . . . . . 303 LEU HD1 . 51188 1 523 . 1 . 1 99 99 LEU HD21 H 1 0.454 0.01 . 1 . . . . . 303 LEU HD2 . 51188 1 524 . 1 . 1 99 99 LEU HD22 H 1 0.454 0.01 . 1 . . . . . 303 LEU HD2 . 51188 1 525 . 1 . 1 99 99 LEU HD23 H 1 0.454 0.01 . 1 . . . . . 303 LEU HD2 . 51188 1 526 . 1 . 1 99 99 LEU C C 13 178.290 0.01 . 1 . . . . . 303 LEU C . 51188 1 527 . 1 . 1 99 99 LEU CA C 13 57.913 0.06 . 1 . . . . . 303 LEU CA . 51188 1 528 . 1 . 1 99 99 LEU CB C 13 41.091 0.01 . 1 . . . . . 303 LEU CB . 51188 1 529 . 1 . 1 99 99 LEU CG C 13 25.367 0.07 . 1 . . . . . 303 LEU CG . 51188 1 530 . 1 . 1 99 99 LEU CD1 C 13 22.731 0.02 . 2 . . . . . 303 LEU CD1 . 51188 1 531 . 1 . 1 99 99 LEU CD2 C 13 25.368 0.00 . 2 . . . . . 303 LEU CD2 . 51188 1 532 . 1 . 1 99 99 LEU N N 15 119.081 0.04 . 1 . . . . . 303 LEU N . 51188 1 533 . 1 . 1 100 100 LEU H H 1 8.647 0.00 . 1 . . . . . 304 LEU H . 51188 1 534 . 1 . 1 100 100 LEU HD11 H 1 0.444 0.00 . 1 . . . . . 304 LEU HD1 . 51188 1 535 . 1 . 1 100 100 LEU HD12 H 1 0.444 0.00 . 1 . . . . . 304 LEU HD1 . 51188 1 536 . 1 . 1 100 100 LEU HD13 H 1 0.444 0.00 . 1 . . . . . 304 LEU HD1 . 51188 1 537 . 1 . 1 100 100 LEU HD21 H 1 0.295 0.00 . 1 . . . . . 304 LEU HD2 . 51188 1 538 . 1 . 1 100 100 LEU HD22 H 1 0.295 0.00 . 1 . . . . . 304 LEU HD2 . 51188 1 539 . 1 . 1 100 100 LEU HD23 H 1 0.295 0.00 . 1 . . . . . 304 LEU HD2 . 51188 1 540 . 1 . 1 100 100 LEU C C 13 179.069 0.01 . 1 . . . . . 304 LEU C . 51188 1 541 . 1 . 1 100 100 LEU CA C 13 57.274 0.09 . 1 . . . . . 304 LEU CA . 51188 1 542 . 1 . 1 100 100 LEU CB C 13 38.998 0.04 . 1 . . . . . 304 LEU CB . 51188 1 543 . 1 . 1 100 100 LEU CG C 13 25.886 0.00 . 1 . . . . . 304 LEU CG . 51188 1 544 . 1 . 1 100 100 LEU CD1 C 13 21.633 0.01 . 2 . . . . . 304 LEU CD1 . 51188 1 545 . 1 . 1 100 100 LEU CD2 C 13 26.193 0.02 . 2 . . . . . 304 LEU CD2 . 51188 1 546 . 1 . 1 100 100 LEU N N 15 116.385 0.03 . 1 . . . . . 304 LEU N . 51188 1 547 . 1 . 1 101 101 ASP H H 1 8.913 0.00 . 1 . . . . . 305 ASP H . 51188 1 548 . 1 . 1 101 101 ASP C C 13 179.322 0.00 . 1 . . . . . 305 ASP C . 51188 1 549 . 1 . 1 101 101 ASP CA C 13 57.320 0.06 . 1 . . . . . 305 ASP CA . 51188 1 550 . 1 . 1 101 101 ASP CB C 13 39.923 0.00 . 1 . . . . . 305 ASP CB . 51188 1 551 . 1 . 1 101 101 ASP N N 15 120.812 0.02 . 1 . . . . . 305 ASP N . 51188 1 552 . 1 . 1 102 102 ASN H H 1 7.216 0.00 . 1 . . . . . 306 ASN H . 51188 1 553 . 1 . 1 102 102 ASN C C 13 178.732 0.00 . 1 . . . . . 306 ASN C . 51188 1 554 . 1 . 1 102 102 ASN CA C 13 56.905 0.03 . 1 . . . . . 306 ASN CA . 51188 1 555 . 1 . 1 102 102 ASN CB C 13 39.908 0.00 . 1 . . . . . 306 ASN CB . 51188 1 556 . 1 . 1 102 102 ASN N N 15 116.855 0.02 . 1 . . . . . 306 ASN N . 51188 1 557 . 1 . 1 103 103 VAL H H 1 7.728 0.00 . 1 . . . . . 307 VAL H . 51188 1 558 . 1 . 1 103 103 VAL HG11 H 1 0.931 0.00 . 1 . . . . . 307 VAL HG1 . 51188 1 559 . 1 . 1 103 103 VAL HG12 H 1 0.931 0.00 . 1 . . . . . 307 VAL HG1 . 51188 1 560 . 1 . 1 103 103 VAL HG13 H 1 0.931 0.00 . 1 . . . . . 307 VAL HG1 . 51188 1 561 . 1 . 1 103 103 VAL HG21 H 1 0.921 0.00 . 1 . . . . . 307 VAL HG2 . 51188 1 562 . 1 . 1 103 103 VAL HG22 H 1 0.921 0.00 . 1 . . . . . 307 VAL HG2 . 51188 1 563 . 1 . 1 103 103 VAL HG23 H 1 0.921 0.00 . 1 . . . . . 307 VAL HG2 . 51188 1 564 . 1 . 1 103 103 VAL C C 13 176.783 0.00 . 1 . . . . . 307 VAL C . 51188 1 565 . 1 . 1 103 103 VAL CA C 13 65.409 0.07 . 1 . . . . . 307 VAL CA . 51188 1 566 . 1 . 1 103 103 VAL CB C 13 30.620 0.01 . 1 . . . . . 307 VAL CB . 51188 1 567 . 1 . 1 103 103 VAL CG1 C 13 21.555 0.01 . 2 . . . . . 307 VAL CG1 . 51188 1 568 . 1 . 1 103 103 VAL CG2 C 13 23.186 0.02 . 2 . . . . . 307 VAL CG2 . 51188 1 569 . 1 . 1 103 103 VAL N N 15 115.547 0.02 . 1 . . . . . 307 VAL N . 51188 1 570 . 1 . 1 104 104 GLU H H 1 8.914 0.00 . 1 . . . . . 308 GLU H . 51188 1 571 . 1 . 1 104 104 GLU C C 13 180.525 0.00 . 1 . . . . . 308 GLU C . 51188 1 572 . 1 . 1 104 104 GLU CA C 13 59.295 0.02 . 1 . . . . . 308 GLU CA . 51188 1 573 . 1 . 1 104 104 GLU CB C 13 28.402 0.00 . 1 . . . . . 308 GLU CB . 51188 1 574 . 1 . 1 104 104 GLU N N 15 123.251 0.02 . 1 . . . . . 308 GLU N . 51188 1 575 . 1 . 1 105 105 ASN H H 1 7.875 0.00 . 1 . . . . . 309 ASN H . 51188 1 576 . 1 . 1 105 105 ASN C C 13 177.964 0.00 . 1 . . . . . 309 ASN C . 51188 1 577 . 1 . 1 105 105 ASN CA C 13 56.573 0.00 . 1 . . . . . 309 ASN CA . 51188 1 578 . 1 . 1 105 105 ASN CB C 13 38.047 0.00 . 1 . . . . . 309 ASN CB . 51188 1 579 . 1 . 1 105 105 ASN N N 15 117.131 0.02 . 1 . . . . . 309 ASN N . 51188 1 580 . 1 . 1 106 106 LYS H H 1 7.448 0.00 . 1 . . . . . 310 LYS H . 51188 1 581 . 1 . 1 106 106 LYS C C 13 176.697 0.00 . 1 . . . . . 310 LYS C . 51188 1 582 . 1 . 1 106 106 LYS CA C 13 55.151 0.00 . 1 . . . . . 310 LYS CA . 51188 1 583 . 1 . 1 106 106 LYS CB C 13 31.620 0.00 . 1 . . . . . 310 LYS CB . 51188 1 584 . 1 . 1 106 106 LYS N N 15 120.910 0.02 . 1 . . . . . 310 LYS N . 51188 1 585 . 1 . 1 107 107 MET H H 1 7.654 0.00 . 1 . . . . . 311 MET H . 51188 1 586 . 1 . 1 107 107 MET C C 13 177.353 0.00 . 1 . . . . . 311 MET C . 51188 1 587 . 1 . 1 107 107 MET CA C 13 56.396 0.01 . 1 . . . . . 311 MET CA . 51188 1 588 . 1 . 1 107 107 MET CB C 13 31.986 0.00 . 1 . . . . . 311 MET CB . 51188 1 589 . 1 . 1 107 107 MET N N 15 114.372 0.02 . 1 . . . . . 311 MET N . 51188 1 590 . 1 . 1 108 108 LYS H H 1 7.418 0.00 . 1 . . . . . 312 LYS H . 51188 1 591 . 1 . 1 108 108 LYS C C 13 177.455 0.00 . 1 . . . . . 312 LYS C . 51188 1 592 . 1 . 1 108 108 LYS CA C 13 58.835 0.01 . 1 . . . . . 312 LYS CA . 51188 1 593 . 1 . 1 108 108 LYS CB C 13 31.279 0.00 . 1 . . . . . 312 LYS CB . 51188 1 594 . 1 . 1 108 108 LYS N N 15 124.584 0.03 . 1 . . . . . 312 LYS N . 51188 1 595 . 1 . 1 109 109 GLY H H 1 9.720 0.00 . 1 . . . . . 313 GLY H . 51188 1 596 . 1 . 1 109 109 GLY C C 13 174.387 0.00 . 1 . . . . . 313 GLY C . 51188 1 597 . 1 . 1 109 109 GLY CA C 13 45.538 0.02 . 1 . . . . . 313 GLY CA . 51188 1 598 . 1 . 1 109 109 GLY N N 15 113.526 0.03 . 1 . . . . . 313 GLY N . 51188 1 599 . 1 . 1 110 110 THR H H 1 7.606 0.00 . 1 . . . . . 314 THR H . 51188 1 600 . 1 . 1 110 110 THR C C 13 177.237 0.00 . 1 . . . . . 314 THR C . 51188 1 601 . 1 . 1 110 110 THR CA C 13 60.156 0.00 . 1 . . . . . 314 THR CA . 51188 1 602 . 1 . 1 110 110 THR CB C 13 73.092 0.00 . 1 . . . . . 314 THR CB . 51188 1 603 . 1 . 1 110 110 THR N N 15 109.050 0.03 . 1 . . . . . 314 THR N . 51188 1 604 . 1 . 1 111 111 CYS H H 1 8.380 0.00 . 1 . . . . . 315 CYS H . 51188 1 605 . 1 . 1 111 111 CYS C C 13 175.221 0.00 . 1 . . . . . 315 CYS C . 51188 1 606 . 1 . 1 111 111 CYS CA C 13 59.269 0.00 . 1 . . . . . 315 CYS CA . 51188 1 607 . 1 . 1 111 111 CYS CB C 13 26.970 0.00 . 1 . . . . . 315 CYS CB . 51188 1 608 . 1 . 1 111 111 CYS N N 15 120.140 0.00 . 1 . . . . . 315 CYS N . 51188 1 609 . 1 . 1 112 112 VAL H H 1 7.796 0.00 . 1 . . . . . 316 VAL H . 51188 1 610 . 1 . 1 112 112 VAL HG11 H 1 1.045 0.00 . 1 . . . . . 316 VAL HG1 . 51188 1 611 . 1 . 1 112 112 VAL HG12 H 1 1.045 0.00 . 1 . . . . . 316 VAL HG1 . 51188 1 612 . 1 . 1 112 112 VAL HG13 H 1 1.045 0.00 . 1 . . . . . 316 VAL HG1 . 51188 1 613 . 1 . 1 112 112 VAL HG21 H 1 0.895 0.00 . 1 . . . . . 316 VAL HG2 . 51188 1 614 . 1 . 1 112 112 VAL HG22 H 1 0.895 0.00 . 1 . . . . . 316 VAL HG2 . 51188 1 615 . 1 . 1 112 112 VAL HG23 H 1 0.895 0.00 . 1 . . . . . 316 VAL HG2 . 51188 1 616 . 1 . 1 112 112 VAL C C 13 175.605 0.00 . 1 . . . . . 316 VAL C . 51188 1 617 . 1 . 1 112 112 VAL CA C 13 60.162 0.04 . 1 . . . . . 316 VAL CA . 51188 1 618 . 1 . 1 112 112 VAL CB C 13 30.853 0.00 . 1 . . . . . 316 VAL CB . 51188 1 619 . 1 . 1 112 112 VAL CG1 C 13 23.165 0.01 . 2 . . . . . 316 VAL CG1 . 51188 1 620 . 1 . 1 112 112 VAL CG2 C 13 18.940 0.01 . 2 . . . . . 316 VAL CG2 . 51188 1 621 . 1 . 1 112 112 VAL N N 15 112.256 0.03 . 1 . . . . . 316 VAL N . 51188 1 622 . 1 . 1 113 113 GLU H H 1 7.467 0.00 . 1 . . . . . 317 GLU H . 51188 1 623 . 1 . 1 113 113 GLU C C 13 176.881 0.00 . 1 . . . . . 317 GLU C . 51188 1 624 . 1 . 1 113 113 GLU CA C 13 58.871 0.02 . 1 . . . . . 317 GLU CA . 51188 1 625 . 1 . 1 113 113 GLU CB C 13 29.227 0.00 . 1 . . . . . 317 GLU CB . 51188 1 626 . 1 . 1 113 113 GLU N N 15 125.794 0.02 . 1 . . . . . 317 GLU N . 51188 1 627 . 1 . 1 114 114 GLY H H 1 8.337 0.01 . 1 . . . . . 318 GLY H . 51188 1 628 . 1 . 1 114 114 GLY C C 13 174.673 0.00 . 1 . . . . . 318 GLY C . 51188 1 629 . 1 . 1 114 114 GLY CA C 13 44.754 0.13 . 1 . . . . . 318 GLY CA . 51188 1 630 . 1 . 1 114 114 GLY N N 15 109.718 0.02 . 1 . . . . . 318 GLY N . 51188 1 631 . 1 . 1 115 115 THR H H 1 7.890 0.00 . 1 . . . . . 319 THR H . 51188 1 632 . 1 . 1 115 115 THR C C 13 174.284 0.00 . 1 . . . . . 319 THR C . 51188 1 633 . 1 . 1 115 115 THR CA C 13 68.071 0.01 . 1 . . . . . 319 THR CA . 51188 1 634 . 1 . 1 115 115 THR CB C 13 68.521 0.00 . 1 . . . . . 319 THR CB . 51188 1 635 . 1 . 1 115 115 THR N N 15 120.272 0.03 . 1 . . . . . 319 THR N . 51188 1 636 . 1 . 1 116 116 ILE H H 1 8.891 0.00 . 1 . . . . . 320 ILE H . 51188 1 637 . 1 . 1 116 116 ILE HD11 H 1 0.897 0.00 . 1 . . . . . 320 ILE HD1 . 51188 1 638 . 1 . 1 116 116 ILE HD12 H 1 0.897 0.00 . 1 . . . . . 320 ILE HD1 . 51188 1 639 . 1 . 1 116 116 ILE HD13 H 1 0.897 0.00 . 1 . . . . . 320 ILE HD1 . 51188 1 640 . 1 . 1 116 116 ILE C C 13 175.915 0.00 . 1 . . . . . 320 ILE C . 51188 1 641 . 1 . 1 116 116 ILE CA C 13 65.811 0.05 . 1 . . . . . 320 ILE CA . 51188 1 642 . 1 . 1 116 116 ILE CB C 13 32.701 0.01 . 1 . . . . . 320 ILE CB . 51188 1 643 . 1 . 1 116 116 ILE CG1 C 13 31.021 0.00 . 1 . . . . . 320 ILE CG1 . 51188 1 644 . 1 . 1 116 116 ILE CD1 C 13 13.729 0.01 . 1 . . . . . 320 ILE CD1 . 51188 1 645 . 1 . 1 116 116 ILE N N 15 118.987 0.02 . 1 . . . . . 320 ILE N . 51188 1 646 . 1 . 1 117 117 PRO C C 13 178.556 0.00 . 1 . . . . . 321 PRO C . 51188 1 647 . 1 . 1 117 117 PRO CA C 13 64.963 0.00 . 1 . . . . . 321 PRO CA . 51188 1 648 . 1 . 1 117 117 PRO CB C 13 29.339 0.00 . 1 . . . . . 321 PRO CB . 51188 1 649 . 1 . 1 118 118 LYS H H 1 7.558 0.00 . 1 . . . . . 322 LYS H . 51188 1 650 . 1 . 1 118 118 LYS C C 13 178.652 0.00 . 1 . . . . . 322 LYS C . 51188 1 651 . 1 . 1 118 118 LYS CA C 13 59.429 0.01 . 1 . . . . . 322 LYS CA . 51188 1 652 . 1 . 1 118 118 LYS CB C 13 31.572 0.00 . 1 . . . . . 322 LYS CB . 51188 1 653 . 1 . 1 118 118 LYS N N 15 116.506 0.02 . 1 . . . . . 322 LYS N . 51188 1 654 . 1 . 1 119 119 LEU H H 1 7.504 0.00 . 1 . . . . . 323 LEU H . 51188 1 655 . 1 . 1 119 119 LEU HD11 H 1 0.474 0.00 . 1 . . . . . 323 LEU HD1 . 51188 1 656 . 1 . 1 119 119 LEU HD12 H 1 0.474 0.00 . 1 . . . . . 323 LEU HD1 . 51188 1 657 . 1 . 1 119 119 LEU HD13 H 1 0.474 0.00 . 1 . . . . . 323 LEU HD1 . 51188 1 658 . 1 . 1 119 119 LEU HD21 H 1 0.521 0.00 . 1 . . . . . 323 LEU HD2 . 51188 1 659 . 1 . 1 119 119 LEU HD22 H 1 0.521 0.00 . 1 . . . . . 323 LEU HD2 . 51188 1 660 . 1 . 1 119 119 LEU HD23 H 1 0.521 0.00 . 1 . . . . . 323 LEU HD2 . 51188 1 661 . 1 . 1 119 119 LEU C C 13 176.713 0.01 . 1 . . . . . 323 LEU C . 51188 1 662 . 1 . 1 119 119 LEU CA C 13 56.868 0.05 . 1 . . . . . 323 LEU CA . 51188 1 663 . 1 . 1 119 119 LEU CB C 13 43.273 0.03 . 1 . . . . . 323 LEU CB . 51188 1 664 . 1 . 1 119 119 LEU CG C 13 26.432 0.00 . 1 . . . . . 323 LEU CG . 51188 1 665 . 1 . 1 119 119 LEU CD1 C 13 26.767 0.01 . 2 . . . . . 323 LEU CD1 . 51188 1 666 . 1 . 1 119 119 LEU CD2 C 13 23.461 0.02 . 2 . . . . . 323 LEU CD2 . 51188 1 667 . 1 . 1 119 119 LEU N N 15 116.526 0.02 . 1 . . . . . 323 LEU N . 51188 1 668 . 1 . 1 120 120 PHE H H 1 7.781 0.00 . 1 . . . . . 324 PHE H . 51188 1 669 . 1 . 1 120 120 PHE C C 13 173.850 0.00 . 1 . . . . . 324 PHE C . 51188 1 670 . 1 . 1 120 120 PHE CA C 13 58.561 0.02 . 1 . . . . . 324 PHE CA . 51188 1 671 . 1 . 1 120 120 PHE CB C 13 42.215 0.00 . 1 . . . . . 324 PHE CB . 51188 1 672 . 1 . 1 120 120 PHE N N 15 110.880 0.02 . 1 . . . . . 324 PHE N . 51188 1 673 . 1 . 1 121 121 ARG H H 1 7.648 0.00 . 1 . . . . . 325 ARG H . 51188 1 674 . 1 . 1 121 121 ARG C C 13 177.157 0.00 . 1 . . . . . 325 ARG C . 51188 1 675 . 1 . 1 121 121 ARG CA C 13 54.808 0.01 . 1 . . . . . 325 ARG CA . 51188 1 676 . 1 . 1 121 121 ARG CB C 13 31.779 0.00 . 1 . . . . . 325 ARG CB . 51188 1 677 . 1 . 1 121 121 ARG N N 15 115.815 0.03 . 1 . . . . . 325 ARG N . 51188 1 678 . 1 . 1 122 122 GLY H H 1 8.057 0.00 . 1 . . . . . 326 GLY H . 51188 1 679 . 1 . 1 122 122 GLY C C 13 171.039 0.00 . 1 . . . . . 326 GLY C . 51188 1 680 . 1 . 1 122 122 GLY CA C 13 42.533 0.02 . 1 . . . . . 326 GLY CA . 51188 1 681 . 1 . 1 122 122 GLY N N 15 115.479 0.02 . 1 . . . . . 326 GLY N . 51188 1 682 . 1 . 1 123 123 LYS H H 1 7.699 0.00 . 1 . . . . . 327 LYS H . 51188 1 683 . 1 . 1 123 123 LYS C C 13 175.908 0.00 . 1 . . . . . 327 LYS C . 51188 1 684 . 1 . 1 123 123 LYS CA C 13 54.655 0.05 . 1 . . . . . 327 LYS CA . 51188 1 685 . 1 . 1 123 123 LYS CB C 13 35.977 0.00 . 1 . . . . . 327 LYS CB . 51188 1 686 . 1 . 1 123 123 LYS N N 15 117.866 0.02 . 1 . . . . . 327 LYS N . 51188 1 687 . 1 . 1 124 124 MET H H 1 9.715 0.00 . 1 . . . . . 328 MET H . 51188 1 688 . 1 . 1 124 124 MET C C 13 173.175 0.00 . 1 . . . . . 328 MET C . 51188 1 689 . 1 . 1 124 124 MET CA C 13 54.233 0.02 . 1 . . . . . 328 MET CA . 51188 1 690 . 1 . 1 124 124 MET CB C 13 36.877 0.00 . 1 . . . . . 328 MET CB . 51188 1 691 . 1 . 1 124 124 MET N N 15 125.089 0.03 . 1 . . . . . 328 MET N . 51188 1 692 . 1 . 1 125 125 VAL H H 1 9.133 0.00 . 1 . . . . . 329 VAL H . 51188 1 693 . 1 . 1 125 125 VAL HG11 H 1 0.970 0.00 . 1 . . . . . 329 VAL HG1 . 51188 1 694 . 1 . 1 125 125 VAL HG12 H 1 0.970 0.00 . 1 . . . . . 329 VAL HG1 . 51188 1 695 . 1 . 1 125 125 VAL HG13 H 1 0.970 0.00 . 1 . . . . . 329 VAL HG1 . 51188 1 696 . 1 . 1 125 125 VAL HG21 H 1 0.960 0.00 . 1 . . . . . 329 VAL HG2 . 51188 1 697 . 1 . 1 125 125 VAL HG22 H 1 0.960 0.00 . 1 . . . . . 329 VAL HG2 . 51188 1 698 . 1 . 1 125 125 VAL HG23 H 1 0.960 0.00 . 1 . . . . . 329 VAL HG2 . 51188 1 699 . 1 . 1 125 125 VAL C C 13 173.271 0.00 . 1 . . . . . 329 VAL C . 51188 1 700 . 1 . 1 125 125 VAL CA C 13 59.313 0.04 . 1 . . . . . 329 VAL CA . 51188 1 701 . 1 . 1 125 125 VAL CB C 13 34.909 0.00 . 1 . . . . . 329 VAL CB . 51188 1 702 . 1 . 1 125 125 VAL CG1 C 13 20.196 0.01 . 2 . . . . . 329 VAL CG1 . 51188 1 703 . 1 . 1 125 125 VAL CG2 C 13 22.359 0.01 . 2 . . . . . 329 VAL CG2 . 51188 1 704 . 1 . 1 125 125 VAL N N 15 120.173 0.02 . 1 . . . . . 329 VAL N . 51188 1 705 . 1 . 1 126 126 SER H H 1 8.756 0.00 . 1 . . . . . 330 SER H . 51188 1 706 . 1 . 1 126 126 SER C C 13 174.258 0.00 . 1 . . . . . 330 SER C . 51188 1 707 . 1 . 1 126 126 SER CA C 13 56.252 0.01 . 1 . . . . . 330 SER CA . 51188 1 708 . 1 . 1 126 126 SER CB C 13 63.540 0.00 . 1 . . . . . 330 SER CB . 51188 1 709 . 1 . 1 126 126 SER N N 15 122.975 0.02 . 1 . . . . . 330 SER N . 51188 1 710 . 1 . 1 127 127 TYR H H 1 8.862 0.01 . 1 . . . . . 331 TYR H . 51188 1 711 . 1 . 1 127 127 TYR C C 13 173.595 0.00 . 1 . . . . . 331 TYR C . 51188 1 712 . 1 . 1 127 127 TYR CA C 13 55.272 0.00 . 1 . . . . . 331 TYR CA . 51188 1 713 . 1 . 1 127 127 TYR CB C 13 42.633 0.00 . 1 . . . . . 331 TYR CB . 51188 1 714 . 1 . 1 127 127 TYR N N 15 124.776 0.02 . 1 . . . . . 331 TYR N . 51188 1 715 . 1 . 1 128 128 ILE H H 1 8.420 0.00 . 1 . . . . . 332 ILE H . 51188 1 716 . 1 . 1 128 128 ILE HD11 H 1 0.536 0.00 . 1 . . . . . 332 ILE HD1 . 51188 1 717 . 1 . 1 128 128 ILE HD12 H 1 0.536 0.00 . 1 . . . . . 332 ILE HD1 . 51188 1 718 . 1 . 1 128 128 ILE HD13 H 1 0.536 0.00 . 1 . . . . . 332 ILE HD1 . 51188 1 719 . 1 . 1 128 128 ILE C C 13 174.976 0.00 . 1 . . . . . 332 ILE C . 51188 1 720 . 1 . 1 128 128 ILE CA C 13 60.377 0.05 . 1 . . . . . 332 ILE CA . 51188 1 721 . 1 . 1 128 128 ILE CB C 13 40.085 0.01 . 1 . . . . . 332 ILE CB . 51188 1 722 . 1 . 1 128 128 ILE CG1 C 13 27.052 0.00 . 1 . . . . . 332 ILE CG1 . 51188 1 723 . 1 . 1 128 128 ILE CD1 C 13 13.791 0.01 . 1 . . . . . 332 ILE CD1 . 51188 1 724 . 1 . 1 128 128 ILE N N 15 119.955 0.02 . 1 . . . . . 332 ILE N . 51188 1 725 . 1 . 1 129 129 GLN H H 1 9.301 0.00 . 1 . . . . . 333 GLN H . 51188 1 726 . 1 . 1 129 129 GLN C C 13 176.248 0.00 . 1 . . . . . 333 GLN C . 51188 1 727 . 1 . 1 129 129 GLN CA C 13 53.346 0.01 . 1 . . . . . 333 GLN CA . 51188 1 728 . 1 . 1 129 129 GLN CB C 13 31.534 0.00 . 1 . . . . . 333 GLN CB . 51188 1 729 . 1 . 1 129 129 GLN N N 15 125.279 0.02 . 1 . . . . . 333 GLN N . 51188 1 730 . 1 . 1 130 130 CYS H H 1 8.695 0.00 . 1 . . . . . 334 CYS H . 51188 1 731 . 1 . 1 130 130 CYS C C 13 174.533 0.00 . 1 . . . . . 334 CYS C . 51188 1 732 . 1 . 1 130 130 CYS CA C 13 61.304 0.01 . 1 . . . . . 334 CYS CA . 51188 1 733 . 1 . 1 130 130 CYS CB C 13 28.471 0.00 . 1 . . . . . 334 CYS CB . 51188 1 734 . 1 . 1 130 130 CYS N N 15 125.569 0.02 . 1 . . . . . 334 CYS N . 51188 1 735 . 1 . 1 131 131 LYS H H 1 8.052 0.00 . 1 . . . . . 335 LYS H . 51188 1 736 . 1 . 1 131 131 LYS C C 13 178.097 0.00 . 1 . . . . . 335 LYS C . 51188 1 737 . 1 . 1 131 131 LYS CA C 13 58.400 0.01 . 1 . . . . . 335 LYS CA . 51188 1 738 . 1 . 1 131 131 LYS CB C 13 33.365 0.00 . 1 . . . . . 335 LYS CB . 51188 1 739 . 1 . 1 131 131 LYS N N 15 121.433 0.03 . 1 . . . . . 335 LYS N . 51188 1 740 . 1 . 1 132 132 GLU H H 1 9.601 0.00 . 1 . . . . . 336 GLU H . 51188 1 741 . 1 . 1 132 132 GLU C C 13 176.315 0.00 . 1 . . . . . 336 GLU C . 51188 1 742 . 1 . 1 132 132 GLU CA C 13 56.189 0.02 . 1 . . . . . 336 GLU CA . 51188 1 743 . 1 . 1 132 132 GLU CB C 13 31.029 0.00 . 1 . . . . . 336 GLU CB . 51188 1 744 . 1 . 1 132 132 GLU N N 15 116.646 0.02 . 1 . . . . . 336 GLU N . 51188 1 745 . 1 . 1 133 133 VAL H H 1 6.894 0.00 . 1 . . . . . 337 VAL H . 51188 1 746 . 1 . 1 133 133 VAL HG11 H 1 0.42 0.01 . 1 . . . . . 337 VAL HG1 . 51188 1 747 . 1 . 1 133 133 VAL HG12 H 1 0.42 0.01 . 1 . . . . . 337 VAL HG1 . 51188 1 748 . 1 . 1 133 133 VAL HG13 H 1 0.42 0.01 . 1 . . . . . 337 VAL HG1 . 51188 1 749 . 1 . 1 133 133 VAL HG21 H 1 0.702 0.01 . 1 . . . . . 337 VAL HG2 . 51188 1 750 . 1 . 1 133 133 VAL HG22 H 1 0.702 0.01 . 1 . . . . . 337 VAL HG2 . 51188 1 751 . 1 . 1 133 133 VAL HG23 H 1 0.702 0.01 . 1 . . . . . 337 VAL HG2 . 51188 1 752 . 1 . 1 133 133 VAL C C 13 174.708 0.00 . 1 . . . . . 337 VAL C . 51188 1 753 . 1 . 1 133 133 VAL CA C 13 58.489 0.05 . 1 . . . . . 337 VAL CA . 51188 1 754 . 1 . 1 133 133 VAL CB C 13 34.529 0.04 . 1 . . . . . 337 VAL CB . 51188 1 755 . 1 . 1 133 133 VAL CG1 C 13 19.129 0.01 . 2 . . . . . 337 VAL CG1 . 51188 1 756 . 1 . 1 133 133 VAL CG2 C 13 21.159 0.01 . 2 . . . . . 337 VAL CG2 . 51188 1 757 . 1 . 1 133 133 VAL N N 15 110.812 0.03 . 1 . . . . . 337 VAL N . 51188 1 758 . 1 . 1 134 134 ASP H H 1 8.370 0.00 . 1 . . . . . 338 ASP H . 51188 1 759 . 1 . 1 134 134 ASP C C 13 174.519 0.00 . 1 . . . . . 338 ASP C . 51188 1 760 . 1 . 1 134 134 ASP CA C 13 53.075 0.03 . 1 . . . . . 338 ASP CA . 51188 1 761 . 1 . 1 134 134 ASP CB C 13 39.094 0.00 . 1 . . . . . 338 ASP CB . 51188 1 762 . 1 . 1 134 134 ASP N N 15 122.369 0.02 . 1 . . . . . 338 ASP N . 51188 1 763 . 1 . 1 135 135 TYR H H 1 7.541 0.00 . 1 . . . . . 339 TYR H . 51188 1 764 . 1 . 1 135 135 TYR C C 13 172.596 0.00 . 1 . . . . . 339 TYR C . 51188 1 765 . 1 . 1 135 135 TYR CA C 13 58.678 0.03 . 1 . . . . . 339 TYR CA . 51188 1 766 . 1 . 1 135 135 TYR CB C 13 40.042 0.00 . 1 . . . . . 339 TYR CB . 51188 1 767 . 1 . 1 135 135 TYR N N 15 124.976 0.02 . 1 . . . . . 339 TYR N . 51188 1 768 . 1 . 1 136 136 ARG H H 1 7.756 0.00 . 1 . . . . . 340 ARG H . 51188 1 769 . 1 . 1 136 136 ARG C C 13 173.924 0.00 . 1 . . . . . 340 ARG C . 51188 1 770 . 1 . 1 136 136 ARG CA C 13 53.804 0.01 . 1 . . . . . 340 ARG CA . 51188 1 771 . 1 . 1 136 136 ARG CB C 13 32.776 0.00 . 1 . . . . . 340 ARG CB . 51188 1 772 . 1 . 1 136 136 ARG N N 15 128.798 0.02 . 1 . . . . . 340 ARG N . 51188 1 773 . 1 . 1 137 137 SER H H 1 8.797 0.00 . 1 . . . . . 341 SER H . 51188 1 774 . 1 . 1 137 137 SER C C 13 173.218 0.00 . 1 . . . . . 341 SER C . 51188 1 775 . 1 . 1 137 137 SER CA C 13 56.281 0.01 . 1 . . . . . 341 SER CA . 51188 1 776 . 1 . 1 137 137 SER CB C 13 64.448 0.00 . 1 . . . . . 341 SER CB . 51188 1 777 . 1 . 1 137 137 SER N N 15 118.239 0.02 . 1 . . . . . 341 SER N . 51188 1 778 . 1 . 1 138 138 ASP H H 1 8.482 0.00 . 1 . . . . . 342 ASP H . 51188 1 779 . 1 . 1 138 138 ASP C C 13 175.007 0.00 . 1 . . . . . 342 ASP C . 51188 1 780 . 1 . 1 138 138 ASP CA C 13 53.584 0.00 . 1 . . . . . 342 ASP CA . 51188 1 781 . 1 . 1 138 138 ASP CB C 13 43.846 0.00 . 1 . . . . . 342 ASP CB . 51188 1 782 . 1 . 1 138 138 ASP N N 15 125.890 0.03 . 1 . . . . . 342 ASP N . 51188 1 783 . 1 . 1 139 139 ARG H H 1 8.771 0.00 . 1 . . . . . 343 ARG H . 51188 1 784 . 1 . 1 139 139 ARG C C 13 174.983 0.00 . 1 . . . . . 343 ARG C . 51188 1 785 . 1 . 1 139 139 ARG CA C 13 55.037 0.08 . 1 . . . . . 343 ARG CA . 51188 1 786 . 1 . 1 139 139 ARG CB C 13 31.933 0.00 . 1 . . . . . 343 ARG CB . 51188 1 787 . 1 . 1 139 139 ARG N N 15 122.301 0.03 . 1 . . . . . 343 ARG N . 51188 1 788 . 1 . 1 140 140 ARG H H 1 8.801 0.00 . 1 . . . . . 344 ARG H . 51188 1 789 . 1 . 1 140 140 ARG C C 13 175.951 0.00 . 1 . . . . . 344 ARG C . 51188 1 790 . 1 . 1 140 140 ARG CA C 13 55.340 0.01 . 1 . . . . . 344 ARG CA . 51188 1 791 . 1 . 1 140 140 ARG CB C 13 30.600 0.00 . 1 . . . . . 344 ARG CB . 51188 1 792 . 1 . 1 140 140 ARG N N 15 127.016 0.03 . 1 . . . . . 344 ARG N . 51188 1 793 . 1 . 1 141 141 GLU H H 1 8.845 0.01 . 1 . . . . . 345 GLU H . 51188 1 794 . 1 . 1 141 141 GLU C C 13 174.797 0.00 . 1 . . . . . 345 GLU C . 51188 1 795 . 1 . 1 141 141 GLU CA C 13 54.903 0.03 . 1 . . . . . 345 GLU CA . 51188 1 796 . 1 . 1 141 141 GLU CB C 13 33.658 0.00 . 1 . . . . . 345 GLU CB . 51188 1 797 . 1 . 1 141 141 GLU N N 15 123.274 0.02 . 1 . . . . . 345 GLU N . 51188 1 798 . 1 . 1 142 142 ASP H H 1 8.584 0.00 . 1 . . . . . 346 ASP H . 51188 1 799 . 1 . 1 142 142 ASP C C 13 176.172 0.00 . 1 . . . . . 346 ASP C . 51188 1 800 . 1 . 1 142 142 ASP CA C 13 53.453 0.02 . 1 . . . . . 346 ASP CA . 51188 1 801 . 1 . 1 142 142 ASP CB C 13 42.291 0.00 . 1 . . . . . 346 ASP CB . 51188 1 802 . 1 . 1 142 142 ASP N N 15 123.619 0.02 . 1 . . . . . 346 ASP N . 51188 1 803 . 1 . 1 143 143 TYR H H 1 8.219 0.00 . 1 . . . . . 347 TYR H . 51188 1 804 . 1 . 1 143 143 TYR C C 13 172.301 0.00 . 1 . . . . . 347 TYR C . 51188 1 805 . 1 . 1 143 143 TYR CA C 13 56.736 0.03 . 1 . . . . . 347 TYR CA . 51188 1 806 . 1 . 1 143 143 TYR CB C 13 40.660 0.00 . 1 . . . . . 347 TYR CB . 51188 1 807 . 1 . 1 143 143 TYR N N 15 118.252 0.02 . 1 . . . . . 347 TYR N . 51188 1 808 . 1 . 1 144 144 TYR H H 1 9.111 0.00 . 1 . . . . . 348 TYR H . 51188 1 809 . 1 . 1 144 144 TYR C C 13 174.652 0.00 . 1 . . . . . 348 TYR C . 51188 1 810 . 1 . 1 144 144 TYR CA C 13 57.569 0.03 . 1 . . . . . 348 TYR CA . 51188 1 811 . 1 . 1 144 144 TYR CB C 13 40.198 0.00 . 1 . . . . . 348 TYR CB . 51188 1 812 . 1 . 1 144 144 TYR N N 15 119.357 0.02 . 1 . . . . . 348 TYR N . 51188 1 813 . 1 . 1 145 145 ASP H H 1 8.259 0.00 . 1 . . . . . 349 ASP H . 51188 1 814 . 1 . 1 145 145 ASP C C 13 174.144 0.00 . 1 . . . . . 349 ASP C . 51188 1 815 . 1 . 1 145 145 ASP CA C 13 52.421 0.01 . 1 . . . . . 349 ASP CA . 51188 1 816 . 1 . 1 145 145 ASP CB C 13 42.688 0.00 . 1 . . . . . 349 ASP CB . 51188 1 817 . 1 . 1 145 145 ASP N N 15 118.488 0.05 . 1 . . . . . 349 ASP N . 51188 1 818 . 1 . 1 146 146 ILE H H 1 7.996 0.00 . 1 . . . . . 350 ILE H . 51188 1 819 . 1 . 1 146 146 ILE HD11 H 1 0.259 0.00 . 1 . . . . . 350 ILE HD1 . 51188 1 820 . 1 . 1 146 146 ILE HD12 H 1 0.259 0.00 . 1 . . . . . 350 ILE HD1 . 51188 1 821 . 1 . 1 146 146 ILE HD13 H 1 0.259 0.00 . 1 . . . . . 350 ILE HD1 . 51188 1 822 . 1 . 1 146 146 ILE C C 13 174.207 0.01 . 1 . . . . . 350 ILE C . 51188 1 823 . 1 . 1 146 146 ILE CA C 13 60.450 0.05 . 1 . . . . . 350 ILE CA . 51188 1 824 . 1 . 1 146 146 ILE CB C 13 40.355 0.01 . 1 . . . . . 350 ILE CB . 51188 1 825 . 1 . 1 146 146 ILE CG1 C 13 26.487 0.00 . 1 . . . . . 350 ILE CG1 . 51188 1 826 . 1 . 1 146 146 ILE CD1 C 13 13.537 0.01 . 1 . . . . . 350 ILE CD1 . 51188 1 827 . 1 . 1 146 146 ILE N N 15 117.988 0.02 . 1 . . . . . 350 ILE N . 51188 1 828 . 1 . 1 147 147 GLN H H 1 8.317 0.00 . 1 . . . . . 351 GLN H . 51188 1 829 . 1 . 1 147 147 GLN C C 13 174.373 0.00 . 1 . . . . . 351 GLN C . 51188 1 830 . 1 . 1 147 147 GLN CA C 13 55.047 0.01 . 1 . . . . . 351 GLN CA . 51188 1 831 . 1 . 1 147 147 GLN CB C 13 28.864 0.00 . 1 . . . . . 351 GLN CB . 51188 1 832 . 1 . 1 147 147 GLN N N 15 126.614 0.02 . 1 . . . . . 351 GLN N . 51188 1 833 . 1 . 1 148 148 LEU H H 1 8.753 0.00 . 1 . . . . . 352 LEU H . 51188 1 834 . 1 . 1 148 148 LEU HD11 H 1 0.424 0.00 . 1 . . . . . 352 LEU HD1 . 51188 1 835 . 1 . 1 148 148 LEU HD12 H 1 0.424 0.00 . 1 . . . . . 352 LEU HD1 . 51188 1 836 . 1 . 1 148 148 LEU HD13 H 1 0.424 0.00 . 1 . . . . . 352 LEU HD1 . 51188 1 837 . 1 . 1 148 148 LEU HD21 H 1 -0.155 0.00 . 1 . . . . . 352 LEU HD2 . 51188 1 838 . 1 . 1 148 148 LEU HD22 H 1 -0.155 0.00 . 1 . . . . . 352 LEU HD2 . 51188 1 839 . 1 . 1 148 148 LEU HD23 H 1 -0.155 0.00 . 1 . . . . . 352 LEU HD2 . 51188 1 840 . 1 . 1 148 148 LEU C C 13 175.727 0.00 . 1 . . . . . 352 LEU C . 51188 1 841 . 1 . 1 148 148 LEU CA C 13 52.488 0.03 . 1 . . . . . 352 LEU CA . 51188 1 842 . 1 . 1 148 148 LEU CB C 13 42.191 0.01 . 1 . . . . . 352 LEU CB . 51188 1 843 . 1 . 1 148 148 LEU CG C 13 25.269 0.02 . 1 . . . . . 352 LEU CG . 51188 1 844 . 1 . 1 148 148 LEU CD1 C 13 27.061 0.01 . 2 . . . . . 352 LEU CD1 . 51188 1 845 . 1 . 1 148 148 LEU CD2 C 13 21.228 0.00 . 2 . . . . . 352 LEU CD2 . 51188 1 846 . 1 . 1 148 148 LEU N N 15 124.169 0.02 . 1 . . . . . 352 LEU N . 51188 1 847 . 1 . 1 149 149 SER H H 1 8.685 0.00 . 1 . . . . . 353 SER H . 51188 1 848 . 1 . 1 149 149 SER C C 13 174.502 0.00 . 1 . . . . . 353 SER C . 51188 1 849 . 1 . 1 149 149 SER CA C 13 58.257 0.01 . 1 . . . . . 353 SER CA . 51188 1 850 . 1 . 1 149 149 SER CB C 13 62.904 0.00 . 1 . . . . . 353 SER CB . 51188 1 851 . 1 . 1 149 149 SER N N 15 118.529 0.02 . 1 . . . . . 353 SER N . 51188 1 852 . 1 . 1 150 150 ILE H H 1 8.549 0.00 . 1 . . . . . 354 ILE H . 51188 1 853 . 1 . 1 150 150 ILE HD11 H 1 0.290 0.00 . 1 . . . . . 354 ILE HD1 . 51188 1 854 . 1 . 1 150 150 ILE HD12 H 1 0.290 0.00 . 1 . . . . . 354 ILE HD1 . 51188 1 855 . 1 . 1 150 150 ILE HD13 H 1 0.290 0.00 . 1 . . . . . 354 ILE HD1 . 51188 1 856 . 1 . 1 150 150 ILE C C 13 176.183 0.01 . 1 . . . . . 354 ILE C . 51188 1 857 . 1 . 1 150 150 ILE CA C 13 59.543 0.05 . 1 . . . . . 354 ILE CA . 51188 1 858 . 1 . 1 150 150 ILE CB C 13 38.597 0.01 . 1 . . . . . 354 ILE CB . 51188 1 859 . 1 . 1 150 150 ILE CG1 C 13 25.503 0.00 . 1 . . . . . 354 ILE CG1 . 51188 1 860 . 1 . 1 150 150 ILE CD1 C 13 14.120 0.01 . 1 . . . . . 354 ILE CD1 . 51188 1 861 . 1 . 1 150 150 ILE N N 15 119.172 0.03 . 1 . . . . . 354 ILE N . 51188 1 862 . 1 . 1 151 151 LYS H H 1 7.471 0.00 . 1 . . . . . 355 LYS H . 51188 1 863 . 1 . 1 151 151 LYS C C 13 177.992 0.00 . 1 . . . . . 355 LYS C . 51188 1 864 . 1 . 1 151 151 LYS CA C 13 57.424 0.00 . 1 . . . . . 355 LYS CA . 51188 1 865 . 1 . 1 151 151 LYS CB C 13 30.974 0.00 . 1 . . . . . 355 LYS CB . 51188 1 866 . 1 . 1 151 151 LYS N N 15 123.863 0.02 . 1 . . . . . 355 LYS N . 51188 1 867 . 1 . 1 152 152 GLY H H 1 9.858 0.00 . 1 . . . . . 356 GLY H . 51188 1 868 . 1 . 1 152 152 GLY C C 13 173.865 0.00 . 1 . . . . . 356 GLY C . 51188 1 869 . 1 . 1 152 152 GLY CA C 13 45.570 0.02 . 1 . . . . . 356 GLY CA . 51188 1 870 . 1 . 1 152 152 GLY N N 15 118.058 0.03 . 1 . . . . . 356 GLY N . 51188 1 871 . 1 . 1 153 153 LYS H H 1 8.338 0.00 . 1 . . . . . 357 LYS H . 51188 1 872 . 1 . 1 153 153 LYS C C 13 175.771 0.00 . 1 . . . . . 357 LYS C . 51188 1 873 . 1 . 1 153 153 LYS CA C 13 53.835 0.00 . 1 . . . . . 357 LYS CA . 51188 1 874 . 1 . 1 153 153 LYS CB C 13 33.135 0.00 . 1 . . . . . 357 LYS CB . 51188 1 875 . 1 . 1 153 153 LYS N N 15 121.357 0.02 . 1 . . . . . 357 LYS N . 51188 1 876 . 1 . 1 154 154 LYS H H 1 8.967 0.00 . 1 . . . . . 358 LYS H . 51188 1 877 . 1 . 1 154 154 LYS C C 13 177.884 0.00 . 1 . . . . . 358 LYS C . 51188 1 878 . 1 . 1 154 154 LYS CA C 13 57.153 0.00 . 1 . . . . . 358 LYS CA . 51188 1 879 . 1 . 1 154 154 LYS CB C 13 33.425 0.00 . 1 . . . . . 358 LYS CB . 51188 1 880 . 1 . 1 154 154 LYS N N 15 119.397 0.02 . 1 . . . . . 358 LYS N . 51188 1 881 . 1 . 1 155 155 ASN H H 1 7.121 0.00 . 1 . . . . . 359 ASN H . 51188 1 882 . 1 . 1 155 155 ASN C C 13 175.097 0.00 . 1 . . . . . 359 ASN C . 51188 1 883 . 1 . 1 155 155 ASN CA C 13 51.006 0.01 . 1 . . . . . 359 ASN CA . 51188 1 884 . 1 . 1 155 155 ASN CB C 13 40.971 0.00 . 1 . . . . . 359 ASN CB . 51188 1 885 . 1 . 1 155 155 ASN N N 15 110.218 0.02 . 1 . . . . . 359 ASN N . 51188 1 886 . 1 . 1 156 156 ILE H H 1 7.010 0.00 . 1 . . . . . 360 ILE H . 51188 1 887 . 1 . 1 156 156 ILE HD11 H 1 0.930 0.00 . 1 . . . . . 360 ILE HD1 . 51188 1 888 . 1 . 1 156 156 ILE HD12 H 1 0.930 0.00 . 1 . . . . . 360 ILE HD1 . 51188 1 889 . 1 . 1 156 156 ILE HD13 H 1 0.930 0.00 . 1 . . . . . 360 ILE HD1 . 51188 1 890 . 1 . 1 156 156 ILE C C 13 175.778 0.02 . 1 . . . . . 360 ILE C . 51188 1 891 . 1 . 1 156 156 ILE CA C 13 63.394 0.05 . 1 . . . . . 360 ILE CA . 51188 1 892 . 1 . 1 156 156 ILE CB C 13 38.780 0.01 . 1 . . . . . 360 ILE CB . 51188 1 893 . 1 . 1 156 156 ILE CG1 C 13 29.466 0.00 . 1 . . . . . 360 ILE CG1 . 51188 1 894 . 1 . 1 156 156 ILE CD1 C 13 15.372 0.01 . 1 . . . . . 360 ILE CD1 . 51188 1 895 . 1 . 1 156 156 ILE N N 15 116.948 0.03 . 1 . . . . . 360 ILE N . 51188 1 896 . 1 . 1 157 157 PHE H H 1 7.881 0.00 . 1 . . . . . 361 PHE H . 51188 1 897 . 1 . 1 157 157 PHE C C 13 177.622 0.00 . 1 . . . . . 361 PHE C . 51188 1 898 . 1 . 1 157 157 PHE CA C 13 62.268 0.01 . 1 . . . . . 361 PHE CA . 51188 1 899 . 1 . 1 157 157 PHE CB C 13 37.598 0.00 . 1 . . . . . 361 PHE CB . 51188 1 900 . 1 . 1 157 157 PHE N N 15 123.832 0.02 . 1 . . . . . 361 PHE N . 51188 1 901 . 1 . 1 158 158 GLU H H 1 8.056 0.00 . 1 . . . . . 362 GLU H . 51188 1 902 . 1 . 1 158 158 GLU C C 13 180.535 0.00 . 1 . . . . . 362 GLU C . 51188 1 903 . 1 . 1 158 158 GLU CA C 13 59.395 0.00 . 1 . . . . . 362 GLU CA . 51188 1 904 . 1 . 1 158 158 GLU CB C 13 29.610 0.00 . 1 . . . . . 362 GLU CB . 51188 1 905 . 1 . 1 158 158 GLU N N 15 117.540 0.03 . 1 . . . . . 362 GLU N . 51188 1 906 . 1 . 1 159 159 SER H H 1 7.801 0.00 . 1 . . . . . 363 SER H . 51188 1 907 . 1 . 1 159 159 SER C C 13 177.333 0.00 . 1 . . . . . 363 SER C . 51188 1 908 . 1 . 1 159 159 SER CA C 13 63.424 0.03 . 1 . . . . . 363 SER CA . 51188 1 909 . 1 . 1 159 159 SER CB C 13 62.738 0.00 . 1 . . . . . 363 SER CB . 51188 1 910 . 1 . 1 159 159 SER N N 15 115.124 0.02 . 1 . . . . . 363 SER N . 51188 1 911 . 1 . 1 160 160 PHE H H 1 8.220 0.01 . 1 . . . . . 364 PHE H . 51188 1 912 . 1 . 1 160 160 PHE C C 13 177.496 0.00 . 1 . . . . . 364 PHE C . 51188 1 913 . 1 . 1 160 160 PHE CA C 13 63.473 0.02 . 1 . . . . . 364 PHE CA . 51188 1 914 . 1 . 1 160 160 PHE CB C 13 37.710 0.00 . 1 . . . . . 364 PHE CB . 51188 1 915 . 1 . 1 160 160 PHE N N 15 124.491 0.02 . 1 . . . . . 364 PHE N . 51188 1 916 . 1 . 1 161 161 VAL H H 1 8.294 0.01 . 1 . . . . . 365 VAL H . 51188 1 917 . 1 . 1 161 161 VAL HG11 H 1 1.147 0.00 . 1 . . . . . 365 VAL HG1 . 51188 1 918 . 1 . 1 161 161 VAL HG12 H 1 1.147 0.00 . 1 . . . . . 365 VAL HG1 . 51188 1 919 . 1 . 1 161 161 VAL HG13 H 1 1.147 0.00 . 1 . . . . . 365 VAL HG1 . 51188 1 920 . 1 . 1 161 161 VAL HG21 H 1 1.050 0.00 . 1 . . . . . 365 VAL HG2 . 51188 1 921 . 1 . 1 161 161 VAL HG22 H 1 1.050 0.00 . 1 . . . . . 365 VAL HG2 . 51188 1 922 . 1 . 1 161 161 VAL HG23 H 1 1.050 0.00 . 1 . . . . . 365 VAL HG2 . 51188 1 923 . 1 . 1 161 161 VAL C C 13 178.853 0.01 . 1 . . . . . 365 VAL C . 51188 1 924 . 1 . 1 161 161 VAL CA C 13 66.521 0.03 . 1 . . . . . 365 VAL CA . 51188 1 925 . 1 . 1 161 161 VAL CB C 13 31.466 0.01 . 1 . . . . . 365 VAL CB . 51188 1 926 . 1 . 1 161 161 VAL CG1 C 13 23.837 0.01 . 2 . . . . . 365 VAL CG1 . 51188 1 927 . 1 . 1 161 161 VAL CG2 C 13 21.448 0.00 . 2 . . . . . 365 VAL CG2 . 51188 1 928 . 1 . 1 161 161 VAL N N 15 119.355 0.03 . 1 . . . . . 365 VAL N . 51188 1 929 . 1 . 1 162 162 ASP H H 1 7.536 0.01 . 1 . . . . . 366 ASP H . 51188 1 930 . 1 . 1 162 162 ASP C C 13 177.937 0.00 . 1 . . . . . 366 ASP C . 51188 1 931 . 1 . 1 162 162 ASP CA C 13 56.697 0.00 . 1 . . . . . 366 ASP CA . 51188 1 932 . 1 . 1 162 162 ASP CB C 13 41.745 0.00 . 1 . . . . . 366 ASP CB . 51188 1 933 . 1 . 1 162 162 ASP N N 15 118.165 0.02 . 1 . . . . . 366 ASP N . 51188 1 934 . 1 . 1 163 163 TYR H H 1 8.042 0.00 . 1 . . . . . 367 TYR H . 51188 1 935 . 1 . 1 163 163 TYR C C 13 178.547 0.00 . 1 . . . . . 367 TYR C . 51188 1 936 . 1 . 1 163 163 TYR CA C 13 61.511 0.02 . 1 . . . . . 367 TYR CA . 51188 1 937 . 1 . 1 163 163 TYR CB C 13 38.655 0.00 . 1 . . . . . 367 TYR CB . 51188 1 938 . 1 . 1 163 163 TYR N N 15 122.884 0.02 . 1 . . . . . 367 TYR N . 51188 1 939 . 1 . 1 164 164 VAL H H 1 7.558 0.00 . 1 . . . . . 368 VAL H . 51188 1 940 . 1 . 1 164 164 VAL HG11 H 1 1.457 0.00 . 1 . . . . . 368 VAL HG1 . 51188 1 941 . 1 . 1 164 164 VAL HG12 H 1 1.457 0.00 . 1 . . . . . 368 VAL HG1 . 51188 1 942 . 1 . 1 164 164 VAL HG13 H 1 1.457 0.00 . 1 . . . . . 368 VAL HG1 . 51188 1 943 . 1 . 1 164 164 VAL HG21 H 1 1.349 0.00 . 1 . . . . . 368 VAL HG2 . 51188 1 944 . 1 . 1 164 164 VAL HG22 H 1 1.349 0.00 . 1 . . . . . 368 VAL HG2 . 51188 1 945 . 1 . 1 164 164 VAL HG23 H 1 1.349 0.00 . 1 . . . . . 368 VAL HG2 . 51188 1 946 . 1 . 1 164 164 VAL C C 13 175.800 0.00 . 1 . . . . . 368 VAL C . 51188 1 947 . 1 . 1 164 164 VAL CA C 13 60.490 0.04 . 1 . . . . . 368 VAL CA . 51188 1 948 . 1 . 1 164 164 VAL CB C 13 31.173 0.01 . 1 . . . . . 368 VAL CB . 51188 1 949 . 1 . 1 164 164 VAL CG1 C 13 19.104 0.01 . 2 . . . . . 368 VAL CG1 . 51188 1 950 . 1 . 1 164 164 VAL CG2 C 13 22.220 0.01 . 2 . . . . . 368 VAL CG2 . 51188 1 951 . 1 . 1 165 165 ALA H H 1 7.331 0.00 . 1 . . . . . 369 ALA H . 51188 1 952 . 1 . 1 165 165 ALA C C 13 178.178 0.00 . 1 . . . . . 369 ALA C . 51188 1 953 . 1 . 1 165 165 ALA CA C 13 52.861 0.01 . 1 . . . . . 369 ALA CA . 51188 1 954 . 1 . 1 165 165 ALA CB C 13 18.542 0.00 . 1 . . . . . 369 ALA CB . 51188 1 955 . 1 . 1 165 165 ALA N N 15 127.414 0.02 . 1 . . . . . 369 ALA N . 51188 1 956 . 1 . 1 166 166 VAL H H 1 8.290 0.00 . 1 . . . . . 370 VAL H . 51188 1 957 . 1 . 1 166 166 VAL HG11 H 1 0.902 0.00 . 1 . . . . . 370 VAL HG1 . 51188 1 958 . 1 . 1 166 166 VAL HG12 H 1 0.902 0.00 . 1 . . . . . 370 VAL HG1 . 51188 1 959 . 1 . 1 166 166 VAL HG13 H 1 0.902 0.00 . 1 . . . . . 370 VAL HG1 . 51188 1 960 . 1 . 1 166 166 VAL HG21 H 1 1.014 0.00 . 1 . . . . . 370 VAL HG2 . 51188 1 961 . 1 . 1 166 166 VAL HG22 H 1 1.014 0.00 . 1 . . . . . 370 VAL HG2 . 51188 1 962 . 1 . 1 166 166 VAL HG23 H 1 1.014 0.00 . 1 . . . . . 370 VAL HG2 . 51188 1 963 . 1 . 1 166 166 VAL C C 13 176.598 0.01 . 1 . . . . . 370 VAL C . 51188 1 964 . 1 . 1 166 166 VAL CA C 13 61.495 0.04 . 1 . . . . . 370 VAL CA . 51188 1 965 . 1 . 1 166 166 VAL CB C 13 32.591 0.03 . 1 . . . . . 370 VAL CB . 51188 1 966 . 1 . 1 166 166 VAL CG1 C 13 22.157 0.01 . 2 . . . . . 370 VAL CG1 . 51188 1 967 . 1 . 1 166 166 VAL CG2 C 13 21.063 0.01 . 2 . . . . . 370 VAL CG2 . 51188 1 968 . 1 . 1 166 166 VAL N N 15 121.008 0.02 . 1 . . . . . 370 VAL N . 51188 1 969 . 1 . 1 167 167 GLU H H 1 9.292 0.01 . 1 . . . . . 371 GLU H . 51188 1 970 . 1 . 1 167 167 GLU C C 13 175.499 0.00 . 1 . . . . . 371 GLU C . 51188 1 971 . 1 . 1 167 167 GLU CA C 13 54.369 0.02 . 1 . . . . . 371 GLU CA . 51188 1 972 . 1 . 1 167 167 GLU CB C 13 31.884 0.00 . 1 . . . . . 371 GLU CB . 51188 1 973 . 1 . 1 167 167 GLU N N 15 127.999 0.03 . 1 . . . . . 371 GLU N . 51188 1 974 . 1 . 1 168 168 GLN H H 1 8.662 0.00 . 1 . . . . . 372 GLN H . 51188 1 975 . 1 . 1 168 168 GLN C C 13 175.448 0.00 . 1 . . . . . 372 GLN C . 51188 1 976 . 1 . 1 168 168 GLN CA C 13 54.929 0.04 . 1 . . . . . 372 GLN CA . 51188 1 977 . 1 . 1 168 168 GLN CB C 13 28.090 0.00 . 1 . . . . . 372 GLN CB . 51188 1 978 . 1 . 1 168 168 GLN N N 15 122.785 0.02 . 1 . . . . . 372 GLN N . 51188 1 979 . 1 . 1 169 169 LEU H H 1 8.903 0.00 . 1 . . . . . 373 LEU H . 51188 1 980 . 1 . 1 169 169 LEU HD11 H 1 0.793 0.01 . 1 . . . . . 373 LEU HD1 . 51188 1 981 . 1 . 1 169 169 LEU HD12 H 1 0.793 0.01 . 1 . . . . . 373 LEU HD1 . 51188 1 982 . 1 . 1 169 169 LEU HD13 H 1 0.793 0.01 . 1 . . . . . 373 LEU HD1 . 51188 1 983 . 1 . 1 169 169 LEU HD21 H 1 0.804 0.00 . 1 . . . . . 373 LEU HD2 . 51188 1 984 . 1 . 1 169 169 LEU HD22 H 1 0.804 0.00 . 1 . . . . . 373 LEU HD2 . 51188 1 985 . 1 . 1 169 169 LEU HD23 H 1 0.804 0.00 . 1 . . . . . 373 LEU HD2 . 51188 1 986 . 1 . 1 169 169 LEU C C 13 174.152 0.00 . 1 . . . . . 373 LEU C . 51188 1 987 . 1 . 1 169 169 LEU CA C 13 54.060 0.04 . 1 . . . . . 373 LEU CA . 51188 1 988 . 1 . 1 169 169 LEU CB C 13 38.942 0.02 . 1 . . . . . 373 LEU CB . 51188 1 989 . 1 . 1 169 169 LEU CG C 13 26.431 0.01 . 1 . . . . . 373 LEU CG . 51188 1 990 . 1 . 1 169 169 LEU CD1 C 13 26.664 0.03 . 2 . . . . . 373 LEU CD1 . 51188 1 991 . 1 . 1 169 169 LEU CD2 C 13 23.582 0.01 . 2 . . . . . 373 LEU CD2 . 51188 1 992 . 1 . 1 169 169 LEU N N 15 128.035 0.02 . 1 . . . . . 373 LEU N . 51188 1 993 . 1 . 1 170 170 ASP H H 1 7.689 0.00 . 1 . . . . . 374 ASP H . 51188 1 994 . 1 . 1 170 170 ASP C C 13 176.186 0.00 . 1 . . . . . 374 ASP C . 51188 1 995 . 1 . 1 170 170 ASP CA C 13 51.813 0.01 . 1 . . . . . 374 ASP CA . 51188 1 996 . 1 . 1 170 170 ASP CB C 13 41.794 0.00 . 1 . . . . . 374 ASP CB . 51188 1 997 . 1 . 1 170 170 ASP N N 15 121.139 0.02 . 1 . . . . . 374 ASP N . 51188 1 998 . 1 . 1 171 171 GLY H H 1 8.921 0.00 . 1 . . . . . 375 GLY H . 51188 1 999 . 1 . 1 171 171 GLY C C 13 176.329 0.00 . 1 . . . . . 375 GLY C . 51188 1 1000 . 1 . 1 171 171 GLY CA C 13 47.106 0.02 . 1 . . . . . 375 GLY CA . 51188 1 1001 . 1 . 1 171 171 GLY N N 15 109.131 0.02 . 1 . . . . . 375 GLY N . 51188 1 1002 . 1 . 1 172 172 ASP H H 1 8.304 0.01 . 1 . . . . . 376 ASP H . 51188 1 1003 . 1 . 1 172 172 ASP C C 13 175.757 0.00 . 1 . . . . . 376 ASP C . 51188 1 1004 . 1 . 1 172 172 ASP CA C 13 55.345 0.06 . 1 . . . . . 376 ASP CA . 51188 1 1005 . 1 . 1 172 172 ASP CB C 13 40.370 0.00 . 1 . . . . . 376 ASP CB . 51188 1 1006 . 1 . 1 172 172 ASP N N 15 120.557 0.06 . 1 . . . . . 376 ASP N . 51188 1 1007 . 1 . 1 173 173 ASN H H 1 8.422 0.00 . 1 . . . . . 377 ASN H . 51188 1 1008 . 1 . 1 173 173 ASN C C 13 174.237 0.00 . 1 . . . . . 377 ASN C . 51188 1 1009 . 1 . 1 173 173 ASN CA C 13 51.996 0.01 . 1 . . . . . 377 ASN CA . 51188 1 1010 . 1 . 1 173 173 ASN CB C 13 39.102 0.00 . 1 . . . . . 377 ASN CB . 51188 1 1011 . 1 . 1 173 173 ASN N N 15 119.248 0.03 . 1 . . . . . 377 ASN N . 51188 1 1012 . 1 . 1 174 174 LYS H H 1 6.764 0.00 . 1 . . . . . 378 LYS H . 51188 1 1013 . 1 . 1 174 174 LYS C C 13 174.823 0.00 . 1 . . . . . 378 LYS C . 51188 1 1014 . 1 . 1 174 174 LYS CA C 13 57.962 0.01 . 1 . . . . . 378 LYS CA . 51188 1 1015 . 1 . 1 174 174 LYS CB C 13 33.442 0.00 . 1 . . . . . 378 LYS CB . 51188 1 1016 . 1 . 1 174 174 LYS N N 15 116.571 0.03 . 1 . . . . . 378 LYS N . 51188 1 1017 . 1 . 1 175 175 TYR H H 1 8.144 0.00 . 1 . . . . . 379 TYR H . 51188 1 1018 . 1 . 1 175 175 TYR C C 13 174.523 0.00 . 1 . . . . . 379 TYR C . 51188 1 1019 . 1 . 1 175 175 TYR CA C 13 56.465 0.01 . 1 . . . . . 379 TYR CA . 51188 1 1020 . 1 . 1 175 175 TYR CB C 13 41.011 0.00 . 1 . . . . . 379 TYR CB . 51188 1 1021 . 1 . 1 175 175 TYR N N 15 121.636 0.02 . 1 . . . . . 379 TYR N . 51188 1 1022 . 1 . 1 176 176 ASP H H 1 7.776 0.00 . 1 . . . . . 380 ASP H . 51188 1 1023 . 1 . 1 176 176 ASP C C 13 173.157 0.00 . 1 . . . . . 380 ASP C . 51188 1 1024 . 1 . 1 176 176 ASP CA C 13 53.584 0.00 . 1 . . . . . 380 ASP CA . 51188 1 1025 . 1 . 1 176 176 ASP CB C 13 38.913 0.00 . 1 . . . . . 380 ASP CB . 51188 1 1026 . 1 . 1 176 176 ASP N N 15 127.068 0.02 . 1 . . . . . 380 ASP N . 51188 1 1027 . 1 . 1 177 177 ALA H H 1 7.743 0.00 . 1 . . . . . 381 ALA H . 51188 1 1028 . 1 . 1 177 177 ALA C C 13 177.529 0.00 . 1 . . . . . 381 ALA C . 51188 1 1029 . 1 . 1 177 177 ALA CA C 13 49.888 0.00 . 1 . . . . . 381 ALA CA . 51188 1 1030 . 1 . 1 177 177 ALA CB C 13 17.710 0.00 . 1 . . . . . 381 ALA CB . 51188 1 1031 . 1 . 1 177 177 ALA N N 15 131.254 0.02 . 1 . . . . . 381 ALA N . 51188 1 1032 . 1 . 1 178 178 GLY H H 1 7.728 0.00 . 1 . . . . . 382 GLY H . 51188 1 1033 . 1 . 1 178 178 GLY C C 13 177.336 0.00 . 1 . . . . . 382 GLY C . 51188 1 1034 . 1 . 1 178 178 GLY CA C 13 46.900 0.02 . 1 . . . . . 382 GLY CA . 51188 1 1035 . 1 . 1 178 178 GLY N N 15 108.283 0.03 . 1 . . . . . 382 GLY N . 51188 1 1036 . 1 . 1 179 179 GLU H H 1 8.330 0.00 . 1 . . . . . 383 GLU H . 51188 1 1037 . 1 . 1 179 179 GLU C C 13 176.803 0.00 . 1 . . . . . 383 GLU C . 51188 1 1038 . 1 . 1 179 179 GLU CA C 13 58.054 0.01 . 1 . . . . . 383 GLU CA . 51188 1 1039 . 1 . 1 179 179 GLU CB C 13 29.360 0.00 . 1 . . . . . 383 GLU CB . 51188 1 1040 . 1 . 1 179 179 GLU N N 15 120.530 0.03 . 1 . . . . . 383 GLU N . 51188 1 1041 . 1 . 1 180 180 HIS H H 1 7.447 0.00 . 1 . . . . . 384 HIS H . 51188 1 1042 . 1 . 1 180 180 HIS C C 13 176.183 0.00 . 1 . . . . . 384 HIS C . 51188 1 1043 . 1 . 1 180 180 HIS CA C 13 55.863 0.01 . 1 . . . . . 384 HIS CA . 51188 1 1044 . 1 . 1 180 180 HIS CB C 13 30.343 0.00 . 1 . . . . . 384 HIS CB . 51188 1 1045 . 1 . 1 180 180 HIS N N 15 116.811 0.03 . 1 . . . . . 384 HIS N . 51188 1 1046 . 1 . 1 181 181 GLY H H 1 7.693 0.00 . 1 . . . . . 385 GLY H . 51188 1 1047 . 1 . 1 181 181 GLY C C 13 172.759 0.00 . 1 . . . . . 385 GLY C . 51188 1 1048 . 1 . 1 181 181 GLY CA C 13 44.355 0.03 . 1 . . . . . 385 GLY CA . 51188 1 1049 . 1 . 1 181 181 GLY N N 15 109.299 0.02 . 1 . . . . . 385 GLY N . 51188 1 1050 . 1 . 1 182 182 LEU H H 1 8.009 0.00 . 1 . . . . . 386 LEU H . 51188 1 1051 . 1 . 1 182 182 LEU HD11 H 1 0.578 0.00 . 1 . . . . . 386 LEU HD1 . 51188 1 1052 . 1 . 1 182 182 LEU HD12 H 1 0.578 0.00 . 1 . . . . . 386 LEU HD1 . 51188 1 1053 . 1 . 1 182 182 LEU HD13 H 1 0.578 0.00 . 1 . . . . . 386 LEU HD1 . 51188 1 1054 . 1 . 1 182 182 LEU HD21 H 1 0.804 0.00 . 1 . . . . . 386 LEU HD2 . 51188 1 1055 . 1 . 1 182 182 LEU HD22 H 1 0.804 0.00 . 1 . . . . . 386 LEU HD2 . 51188 1 1056 . 1 . 1 182 182 LEU HD23 H 1 0.804 0.00 . 1 . . . . . 386 LEU HD2 . 51188 1 1057 . 1 . 1 182 182 LEU C C 13 178.612 0.01 . 1 . . . . . 386 LEU C . 51188 1 1058 . 1 . 1 182 182 LEU CA C 13 54.753 0.04 . 1 . . . . . 386 LEU CA . 51188 1 1059 . 1 . 1 182 182 LEU CB C 13 40.877 0.01 . 1 . . . . . 386 LEU CB . 51188 1 1060 . 1 . 1 182 182 LEU CG C 13 26.374 0.01 . 1 . . . . . 386 LEU CG . 51188 1 1061 . 1 . 1 182 182 LEU CD1 C 13 22.654 0.01 . 2 . . . . . 386 LEU CD1 . 51188 1 1062 . 1 . 1 182 182 LEU CD2 C 13 25.359 0.01 . 2 . . . . . 386 LEU CD2 . 51188 1 1063 . 1 . 1 182 182 LEU N N 15 120.337 0.02 . 1 . . . . . 386 LEU N . 51188 1 1064 . 1 . 1 183 183 GLN H H 1 9.401 0.00 . 1 . . . . . 387 GLN H . 51188 1 1065 . 1 . 1 183 183 GLN C C 13 175.522 0.00 . 1 . . . . . 387 GLN C . 51188 1 1066 . 1 . 1 183 183 GLN CA C 13 53.487 0.01 . 1 . . . . . 387 GLN CA . 51188 1 1067 . 1 . 1 183 183 GLN CB C 13 33.204 0.00 . 1 . . . . . 387 GLN CB . 51188 1 1068 . 1 . 1 183 183 GLN N N 15 123.266 0.02 . 1 . . . . . 387 GLN N . 51188 1 1069 . 1 . 1 184 184 GLU H H 1 9.065 0.00 . 1 . . . . . 388 GLU H . 51188 1 1070 . 1 . 1 184 184 GLU C C 13 177.971 0.00 . 1 . . . . . 388 GLU C . 51188 1 1071 . 1 . 1 184 184 GLU CA C 13 57.175 0.00 . 1 . . . . . 388 GLU CA . 51188 1 1072 . 1 . 1 184 184 GLU CB C 13 29.117 0.00 . 1 . . . . . 388 GLU CB . 51188 1 1073 . 1 . 1 184 184 GLU N N 15 122.382 0.02 . 1 . . . . . 388 GLU N . 51188 1 1074 . 1 . 1 185 185 ALA H H 1 9.150 0.00 . 1 . . . . . 389 ALA H . 51188 1 1075 . 1 . 1 185 185 ALA C C 13 174.086 0.00 . 1 . . . . . 389 ALA C . 51188 1 1076 . 1 . 1 185 185 ALA CA C 13 51.312 0.01 . 1 . . . . . 389 ALA CA . 51188 1 1077 . 1 . 1 185 185 ALA CB C 13 23.805 0.00 . 1 . . . . . 389 ALA CB . 51188 1 1078 . 1 . 1 185 185 ALA N N 15 127.534 0.01 . 1 . . . . . 389 ALA N . 51188 1 1079 . 1 . 1 186 186 GLU H H 1 8.627 0.00 . 1 . . . . . 390 GLU H . 51188 1 1080 . 1 . 1 186 186 GLU C C 13 173.764 0.00 . 1 . . . . . 390 GLU C . 51188 1 1081 . 1 . 1 186 186 GLU CA C 13 54.490 0.00 . 1 . . . . . 390 GLU CA . 51188 1 1082 . 1 . 1 186 186 GLU CB C 13 32.677 0.00 . 1 . . . . . 390 GLU CB . 51188 1 1083 . 1 . 1 186 186 GLU N N 15 119.313 0.02 . 1 . . . . . 390 GLU N . 51188 1 1084 . 1 . 1 187 187 LYS H H 1 8.793 0.00 . 1 . . . . . 391 LYS H . 51188 1 1085 . 1 . 1 187 187 LYS C C 13 174.274 0.00 . 1 . . . . . 391 LYS C . 51188 1 1086 . 1 . 1 187 187 LYS CA C 13 53.316 0.01 . 1 . . . . . 391 LYS CA . 51188 1 1087 . 1 . 1 187 187 LYS CB C 13 36.258 0.00 . 1 . . . . . 391 LYS CB . 51188 1 1088 . 1 . 1 187 187 LYS N N 15 123.900 0.02 . 1 . . . . . 391 LYS N . 51188 1 1089 . 1 . 1 188 188 GLY H H 1 7.167 0.00 . 1 . . . . . 392 GLY H . 51188 1 1090 . 1 . 1 188 188 GLY C C 13 170.785 0.00 . 1 . . . . . 392 GLY C . 51188 1 1091 . 1 . 1 188 188 GLY CA C 13 44.837 0.01 . 1 . . . . . 392 GLY CA . 51188 1 1092 . 1 . 1 188 188 GLY N N 15 110.137 0.03 . 1 . . . . . 392 GLY N . 51188 1 1093 . 1 . 1 189 189 VAL H H 1 7.720 0.00 . 1 . . . . . 393 VAL H . 51188 1 1094 . 1 . 1 189 189 VAL HG11 H 1 0.730 0.00 . 1 . . . . . 393 VAL HG1 . 51188 1 1095 . 1 . 1 189 189 VAL HG12 H 1 0.730 0.00 . 1 . . . . . 393 VAL HG1 . 51188 1 1096 . 1 . 1 189 189 VAL HG13 H 1 0.730 0.00 . 1 . . . . . 393 VAL HG1 . 51188 1 1097 . 1 . 1 189 189 VAL HG21 H 1 0.690 0.00 . 1 . . . . . 393 VAL HG2 . 51188 1 1098 . 1 . 1 189 189 VAL HG22 H 1 0.690 0.00 . 1 . . . . . 393 VAL HG2 . 51188 1 1099 . 1 . 1 189 189 VAL HG23 H 1 0.690 0.00 . 1 . . . . . 393 VAL HG2 . 51188 1 1100 . 1 . 1 189 189 VAL C C 13 176.124 0.00 . 1 . . . . . 393 VAL C . 51188 1 1101 . 1 . 1 189 189 VAL CA C 13 59.537 0.04 . 1 . . . . . 393 VAL CA . 51188 1 1102 . 1 . 1 189 189 VAL CB C 13 35.218 0.02 . 1 . . . . . 393 VAL CB . 51188 1 1103 . 1 . 1 189 189 VAL CG1 C 13 21.190 0.01 . 2 . . . . . 393 VAL CG1 . 51188 1 1104 . 1 . 1 189 189 VAL CG2 C 13 21.615 0.01 . 2 . . . . . 393 VAL CG2 . 51188 1 1105 . 1 . 1 189 189 VAL N N 15 117.834 0.03 . 1 . . . . . 393 VAL N . 51188 1 1106 . 1 . 1 190 190 LYS H H 1 8.856 0.00 . 1 . . . . . 394 LYS H . 51188 1 1107 . 1 . 1 190 190 LYS C C 13 175.554 0.00 . 1 . . . . . 394 LYS C . 51188 1 1108 . 1 . 1 190 190 LYS CA C 13 53.978 0.00 . 1 . . . . . 394 LYS CA . 51188 1 1109 . 1 . 1 190 190 LYS CB C 13 36.457 0.00 . 1 . . . . . 394 LYS CB . 51188 1 1110 . 1 . 1 190 190 LYS N N 15 121.525 0.02 . 1 . . . . . 394 LYS N . 51188 1 1111 . 1 . 1 191 191 PHE H H 1 8.165 0.00 . 1 . . . . . 395 PHE H . 51188 1 1112 . 1 . 1 191 191 PHE C C 13 175.018 0.00 . 1 . . . . . 395 PHE C . 51188 1 1113 . 1 . 1 191 191 PHE CA C 13 59.957 0.01 . 1 . . . . . 395 PHE CA . 51188 1 1114 . 1 . 1 191 191 PHE CB C 13 38.823 0.00 . 1 . . . . . 395 PHE CB . 51188 1 1115 . 1 . 1 191 191 PHE N N 15 119.647 0.02 . 1 . . . . . 395 PHE N . 51188 1 1116 . 1 . 1 192 192 LEU H H 1 9.189 0.00 . 1 . . . . . 396 LEU H . 51188 1 1117 . 1 . 1 192 192 LEU HD11 H 1 0.829 0.00 . 1 . . . . . 396 LEU HD1 . 51188 1 1118 . 1 . 1 192 192 LEU HD12 H 1 0.829 0.00 . 1 . . . . . 396 LEU HD1 . 51188 1 1119 . 1 . 1 192 192 LEU HD13 H 1 0.829 0.00 . 1 . . . . . 396 LEU HD1 . 51188 1 1120 . 1 . 1 192 192 LEU HD21 H 1 0.847 0.00 . 1 . . . . . 396 LEU HD2 . 51188 1 1121 . 1 . 1 192 192 LEU HD22 H 1 0.847 0.00 . 1 . . . . . 396 LEU HD2 . 51188 1 1122 . 1 . 1 192 192 LEU HD23 H 1 0.847 0.00 . 1 . . . . . 396 LEU HD2 . 51188 1 1123 . 1 . 1 192 192 LEU C C 13 178.126 0.01 . 1 . . . . . 396 LEU C . 51188 1 1124 . 1 . 1 192 192 LEU CA C 13 55.608 0.05 . 1 . . . . . 396 LEU CA . 51188 1 1125 . 1 . 1 192 192 LEU CB C 13 41.807 0.03 . 1 . . . . . 396 LEU CB . 51188 1 1126 . 1 . 1 192 192 LEU CG C 13 26.782 0.01 . 1 . . . . . 396 LEU CG . 51188 1 1127 . 1 . 1 192 192 LEU CD1 C 13 23.465 0.01 . 2 . . . . . 396 LEU CD1 . 51188 1 1128 . 1 . 1 192 192 LEU CD2 C 13 25.444 0.01 . 2 . . . . . 396 LEU CD2 . 51188 1 1129 . 1 . 1 192 192 LEU N N 15 123.690 0.03 . 1 . . . . . 396 LEU N . 51188 1 1130 . 1 . 1 193 193 THR H H 1 8.588 0.00 . 1 . . . . . 397 THR H . 51188 1 1131 . 1 . 1 193 193 THR C C 13 173.487 0.00 . 1 . . . . . 397 THR C . 51188 1 1132 . 1 . 1 193 193 THR CA C 13 59.436 0.01 . 1 . . . . . 397 THR CA . 51188 1 1133 . 1 . 1 193 193 THR CB C 13 71.970 0.00 . 1 . . . . . 397 THR CB . 51188 1 1134 . 1 . 1 193 193 THR N N 15 109.173 0.03 . 1 . . . . . 397 THR N . 51188 1 1135 . 1 . 1 194 194 LEU H H 1 8.407 0.01 . 1 . . . . . 398 LEU H . 51188 1 1136 . 1 . 1 194 194 LEU HD11 H 1 0.625 0.00 . 1 . . . . . 398 LEU HD1 . 51188 1 1137 . 1 . 1 194 194 LEU HD12 H 1 0.625 0.00 . 1 . . . . . 398 LEU HD1 . 51188 1 1138 . 1 . 1 194 194 LEU HD13 H 1 0.625 0.00 . 1 . . . . . 398 LEU HD1 . 51188 1 1139 . 1 . 1 194 194 LEU HD21 H 1 0.336 0.00 . 1 . . . . . 398 LEU HD2 . 51188 1 1140 . 1 . 1 194 194 LEU HD22 H 1 0.336 0.00 . 1 . . . . . 398 LEU HD2 . 51188 1 1141 . 1 . 1 194 194 LEU HD23 H 1 0.336 0.00 . 1 . . . . . 398 LEU HD2 . 51188 1 1142 . 1 . 1 194 194 LEU C C 13 174.189 0.00 . 1 . . . . . 398 LEU C . 51188 1 1143 . 1 . 1 194 194 LEU CA C 13 52.102 0.05 . 1 . . . . . 398 LEU CA . 51188 1 1144 . 1 . 1 194 194 LEU CB C 13 44.987 0.01 . 1 . . . . . 398 LEU CB . 51188 1 1145 . 1 . 1 194 194 LEU CG C 13 26.715 0.01 . 1 . . . . . 398 LEU CG . 51188 1 1146 . 1 . 1 194 194 LEU CD1 C 13 29.128 0.02 . 2 . . . . . 398 LEU CD1 . 51188 1 1147 . 1 . 1 194 194 LEU CD2 C 13 23.549 0.01 . 2 . . . . . 398 LEU CD2 . 51188 1 1148 . 1 . 1 194 194 LEU N N 15 124.234 0.02 . 1 . . . . . 398 LEU N . 51188 1 1149 . 1 . 1 196 196 PRO C C 13 174.473 0.00 . 1 . . . . . 400 PRO C . 51188 1 1150 . 1 . 1 196 196 PRO CA C 13 61.750 0.00 . 1 . . . . . 400 PRO CA . 51188 1 1151 . 1 . 1 196 196 PRO CB C 13 31.185 0.00 . 1 . . . . . 400 PRO CB . 51188 1 1152 . 1 . 1 197 197 VAL H H 1 7.936 0.00 . 1 . . . . . 401 VAL H . 51188 1 1153 . 1 . 1 197 197 VAL HG11 H 1 0.921 0.00 . 1 . . . . . 401 VAL HG1 . 51188 1 1154 . 1 . 1 197 197 VAL HG12 H 1 0.921 0.00 . 1 . . . . . 401 VAL HG1 . 51188 1 1155 . 1 . 1 197 197 VAL HG13 H 1 0.921 0.00 . 1 . . . . . 401 VAL HG1 . 51188 1 1156 . 1 . 1 197 197 VAL HG21 H 1 0.553 0.00 . 1 . . . . . 401 VAL HG2 . 51188 1 1157 . 1 . 1 197 197 VAL HG22 H 1 0.553 0.00 . 1 . . . . . 401 VAL HG2 . 51188 1 1158 . 1 . 1 197 197 VAL HG23 H 1 0.553 0.00 . 1 . . . . . 401 VAL HG2 . 51188 1 1159 . 1 . 1 197 197 VAL C C 13 173.030 0.00 . 1 . . . . . 401 VAL C . 51188 1 1160 . 1 . 1 197 197 VAL CA C 13 61.627 0.09 . 1 . . . . . 401 VAL CA . 51188 1 1161 . 1 . 1 197 197 VAL CB C 13 30.747 0.05 . 1 . . . . . 401 VAL CB . 51188 1 1162 . 1 . 1 197 197 VAL CG1 C 13 23.204 0.00 . 2 . . . . . 401 VAL CG1 . 51188 1 1163 . 1 . 1 197 197 VAL CG2 C 13 22.626 0.01 . 2 . . . . . 401 VAL CG2 . 51188 1 1164 . 1 . 1 197 197 VAL N N 15 115.001 0.03 . 1 . . . . . 401 VAL N . 51188 1 1165 . 1 . 1 198 198 LEU H H 1 9.295 0.00 . 1 . . . . . 402 LEU H . 51188 1 1166 . 1 . 1 198 198 LEU HD11 H 1 0.134 0.00 . 1 . . . . . 402 LEU HD1 . 51188 1 1167 . 1 . 1 198 198 LEU HD12 H 1 0.134 0.00 . 1 . . . . . 402 LEU HD1 . 51188 1 1168 . 1 . 1 198 198 LEU HD13 H 1 0.134 0.00 . 1 . . . . . 402 LEU HD1 . 51188 1 1169 . 1 . 1 198 198 LEU HD21 H 1 0.475 0.00 . 1 . . . . . 402 LEU HD2 . 51188 1 1170 . 1 . 1 198 198 LEU HD22 H 1 0.475 0.00 . 1 . . . . . 402 LEU HD2 . 51188 1 1171 . 1 . 1 198 198 LEU HD23 H 1 0.475 0.00 . 1 . . . . . 402 LEU HD2 . 51188 1 1172 . 1 . 1 198 198 LEU C C 13 175.169 0.01 . 1 . . . . . 402 LEU C . 51188 1 1173 . 1 . 1 198 198 LEU CA C 13 52.728 0.04 . 1 . . . . . 402 LEU CA . 51188 1 1174 . 1 . 1 198 198 LEU CB C 13 44.733 0.02 . 1 . . . . . 402 LEU CB . 51188 1 1175 . 1 . 1 198 198 LEU CG C 13 26.250 0.01 . 1 . . . . . 402 LEU CG . 51188 1 1176 . 1 . 1 198 198 LEU CD1 C 13 25.510 0.01 . 2 . . . . . 402 LEU CD1 . 51188 1 1177 . 1 . 1 198 198 LEU CD2 C 13 23.749 0.01 . 2 . . . . . 402 LEU CD2 . 51188 1 1178 . 1 . 1 198 198 LEU N N 15 127.451 0.03 . 1 . . . . . 402 LEU N . 51188 1 1179 . 1 . 1 199 199 HIS H H 1 9.545 0.00 . 1 . . . . . 403 HIS H . 51188 1 1180 . 1 . 1 199 199 HIS C C 13 174.031 0.00 . 1 . . . . . 403 HIS C . 51188 1 1181 . 1 . 1 199 199 HIS CA C 13 54.501 0.01 . 1 . . . . . 403 HIS CA . 51188 1 1182 . 1 . 1 199 199 HIS CB C 13 32.421 0.00 . 1 . . . . . 403 HIS CB . 51188 1 1183 . 1 . 1 199 199 HIS N N 15 128.465 0.02 . 1 . . . . . 403 HIS N . 51188 1 1184 . 1 . 1 200 200 LEU H H 1 8.796 0.00 . 1 . . . . . 404 LEU H . 51188 1 1185 . 1 . 1 200 200 LEU HD11 H 1 0.846 0.00 . 1 . . . . . 404 LEU HD1 . 51188 1 1186 . 1 . 1 200 200 LEU HD12 H 1 0.846 0.00 . 1 . . . . . 404 LEU HD1 . 51188 1 1187 . 1 . 1 200 200 LEU HD13 H 1 0.846 0.00 . 1 . . . . . 404 LEU HD1 . 51188 1 1188 . 1 . 1 200 200 LEU HD21 H 1 0.726 0.01 . 1 . . . . . 404 LEU HD2 . 51188 1 1189 . 1 . 1 200 200 LEU HD22 H 1 0.726 0.01 . 1 . . . . . 404 LEU HD2 . 51188 1 1190 . 1 . 1 200 200 LEU HD23 H 1 0.726 0.01 . 1 . . . . . 404 LEU HD2 . 51188 1 1191 . 1 . 1 200 200 LEU C C 13 175.983 0.01 . 1 . . . . . 404 LEU C . 51188 1 1192 . 1 . 1 200 200 LEU CA C 13 51.962 0.07 . 1 . . . . . 404 LEU CA . 51188 1 1193 . 1 . 1 200 200 LEU CB C 13 42.348 0.03 . 1 . . . . . 404 LEU CB . 51188 1 1194 . 1 . 1 200 200 LEU CG C 13 25.770 0.00 . 1 . . . . . 404 LEU CG . 51188 1 1195 . 1 . 1 200 200 LEU CD1 C 13 27.540 0.02 . 2 . . . . . 404 LEU CD1 . 51188 1 1196 . 1 . 1 200 200 LEU CD2 C 13 25.182 0.02 . 2 . . . . . 404 LEU CD2 . 51188 1 1197 . 1 . 1 200 200 LEU N N 15 121.548 0.03 . 1 . . . . . 404 LEU N . 51188 1 1198 . 1 . 1 201 201 GLN H H 1 9.038 0.00 . 1 . . . . . 405 GLN H . 51188 1 1199 . 1 . 1 201 201 GLN C C 13 174.246 0.00 . 1 . . . . . 405 GLN C . 51188 1 1200 . 1 . 1 201 201 GLN CA C 13 55.522 0.01 . 1 . . . . . 405 GLN CA . 51188 1 1201 . 1 . 1 201 201 GLN CB C 13 27.972 0.00 . 1 . . . . . 405 GLN CB . 51188 1 1202 . 1 . 1 201 201 GLN N N 15 122.801 0.03 . 1 . . . . . 405 GLN N . 51188 1 1203 . 1 . 1 202 202 LEU H H 1 8.404 0.00 . 1 . . . . . 406 LEU H . 51188 1 1204 . 1 . 1 202 202 LEU HD11 H 1 0.700 0.00 . 1 . . . . . 406 LEU HD1 . 51188 1 1205 . 1 . 1 202 202 LEU HD12 H 1 0.700 0.00 . 1 . . . . . 406 LEU HD1 . 51188 1 1206 . 1 . 1 202 202 LEU HD13 H 1 0.700 0.00 . 1 . . . . . 406 LEU HD1 . 51188 1 1207 . 1 . 1 202 202 LEU HD21 H 1 0.531 0.00 . 1 . . . . . 406 LEU HD2 . 51188 1 1208 . 1 . 1 202 202 LEU HD22 H 1 0.531 0.00 . 1 . . . . . 406 LEU HD2 . 51188 1 1209 . 1 . 1 202 202 LEU HD23 H 1 0.531 0.00 . 1 . . . . . 406 LEU HD2 . 51188 1 1210 . 1 . 1 202 202 LEU C C 13 178.183 0.02 . 1 . . . . . 406 LEU C . 51188 1 1211 . 1 . 1 202 202 LEU CA C 13 52.503 0.05 . 1 . . . . . 406 LEU CA . 51188 1 1212 . 1 . 1 202 202 LEU CB C 13 40.165 0.01 . 1 . . . . . 406 LEU CB . 51188 1 1213 . 1 . 1 202 202 LEU CG C 13 26.853 0.00 . 1 . . . . . 406 LEU CG . 51188 1 1214 . 1 . 1 202 202 LEU CD1 C 13 24.243 0.01 . 2 . . . . . 406 LEU CD1 . 51188 1 1215 . 1 . 1 202 202 LEU CD2 C 13 22.891 0.00 . 2 . . . . . 406 LEU CD2 . 51188 1 1216 . 1 . 1 202 202 LEU N N 15 123.314 0.03 . 1 . . . . . 406 LEU N . 51188 1 1217 . 1 . 1 203 203 MET H H 1 8.121 0.00 . 1 . . . . . 407 MET H . 51188 1 1218 . 1 . 1 203 203 MET C C 13 175.289 0.00 . 1 . . . . . 407 MET C . 51188 1 1219 . 1 . 1 203 203 MET CA C 13 55.309 0.01 . 1 . . . . . 407 MET CA . 51188 1 1220 . 1 . 1 203 203 MET CB C 13 30.303 0.00 . 1 . . . . . 407 MET CB . 51188 1 1221 . 1 . 1 203 203 MET N N 15 123.612 0.02 . 1 . . . . . 407 MET N . 51188 1 1222 . 1 . 1 204 204 ARG H H 1 8.428 0.00 . 1 . . . . . 408 ARG H . 51188 1 1223 . 1 . 1 204 204 ARG C C 13 174.959 0.00 . 1 . . . . . 408 ARG C . 51188 1 1224 . 1 . 1 204 204 ARG CA C 13 56.889 0.13 . 1 . . . . . 408 ARG CA . 51188 1 1225 . 1 . 1 204 204 ARG CB C 13 31.474 0.00 . 1 . . . . . 408 ARG CB . 51188 1 1226 . 1 . 1 204 204 ARG N N 15 123.678 0.03 . 1 . . . . . 408 ARG N . 51188 1 1227 . 1 . 1 205 205 PHE H H 1 8.194 0.00 . 1 . . . . . 409 PHE H . 51188 1 1228 . 1 . 1 205 205 PHE C C 13 175.466 0.00 . 1 . . . . . 409 PHE C . 51188 1 1229 . 1 . 1 205 205 PHE CA C 13 56.445 0.02 . 1 . . . . . 409 PHE CA . 51188 1 1230 . 1 . 1 205 205 PHE CB C 13 38.858 0.00 . 1 . . . . . 409 PHE CB . 51188 1 1231 . 1 . 1 205 205 PHE N N 15 117.279 0.02 . 1 . . . . . 409 PHE N . 51188 1 1232 . 1 . 1 206 206 MET H H 1 8.537 0.00 . 1 . . . . . 410 MET H . 51188 1 1233 . 1 . 1 206 206 MET C C 13 173.868 0.00 . 1 . . . . . 410 MET C . 51188 1 1234 . 1 . 1 206 206 MET CA C 13 54.090 0.01 . 1 . . . . . 410 MET CA . 51188 1 1235 . 1 . 1 206 206 MET CB C 13 35.375 0.00 . 1 . . . . . 410 MET CB . 51188 1 1236 . 1 . 1 206 206 MET N N 15 120.736 0.02 . 1 . . . . . 410 MET N . 51188 1 1237 . 1 . 1 207 207 TYR H H 1 8.564 0.00 . 1 . . . . . 411 TYR H . 51188 1 1238 . 1 . 1 207 207 TYR C C 13 174.411 0.00 . 1 . . . . . 411 TYR C . 51188 1 1239 . 1 . 1 207 207 TYR CA C 13 57.981 0.00 . 1 . . . . . 411 TYR CA . 51188 1 1240 . 1 . 1 207 207 TYR CB C 13 38.522 0.00 . 1 . . . . . 411 TYR CB . 51188 1 1241 . 1 . 1 207 207 TYR N N 15 123.672 0.02 . 1 . . . . . 411 TYR N . 51188 1 1242 . 1 . 1 208 208 ASP H H 1 8.201 0.00 . 1 . . . . . 412 ASP H . 51188 1 1243 . 1 . 1 208 208 ASP CA C 13 49.666 0.00 . 1 . . . . . 412 ASP CA . 51188 1 1244 . 1 . 1 208 208 ASP CB C 13 42.693 0.00 . 1 . . . . . 412 ASP CB . 51188 1 1245 . 1 . 1 208 208 ASP N N 15 128.822 0.02 . 1 . . . . . 412 ASP N . 51188 1 1246 . 1 . 1 209 209 PRO C C 13 178.406 0.00 . 1 . . . . . 413 PRO C . 51188 1 1247 . 1 . 1 209 209 PRO CA C 13 63.424 0.00 . 1 . . . . . 413 PRO CA . 51188 1 1248 . 1 . 1 209 209 PRO CB C 13 31.677 0.00 . 1 . . . . . 413 PRO CB . 51188 1 1249 . 1 . 1 210 210 GLN H H 1 7.909 0.00 . 1 . . . . . 414 GLN H . 51188 1 1250 . 1 . 1 210 210 GLN C C 13 177.711 0.00 . 1 . . . . . 414 GLN C . 51188 1 1251 . 1 . 1 210 210 GLN CA C 13 58.357 0.02 . 1 . . . . . 414 GLN CA . 51188 1 1252 . 1 . 1 210 210 GLN CB C 13 27.972 0.00 . 1 . . . . . 414 GLN CB . 51188 1 1253 . 1 . 1 210 210 GLN N N 15 116.192 0.02 . 1 . . . . . 414 GLN N . 51188 1 1254 . 1 . 1 211 211 THR H H 1 6.978 0.00 . 1 . . . . . 415 THR H . 51188 1 1255 . 1 . 1 211 211 THR C C 13 174.715 0.00 . 1 . . . . . 415 THR C . 51188 1 1256 . 1 . 1 211 211 THR CA C 13 60.955 0.00 . 1 . . . . . 415 THR CA . 51188 1 1257 . 1 . 1 211 211 THR CB C 13 69.819 0.00 . 1 . . . . . 415 THR CB . 51188 1 1258 . 1 . 1 211 211 THR N N 15 106.278 0.02 . 1 . . . . . 415 THR N . 51188 1 1259 . 1 . 1 212 212 ASP H H 1 7.994 0.00 . 1 . . . . . 416 ASP H . 51188 1 1260 . 1 . 1 212 212 ASP C C 13 174.080 0.00 . 1 . . . . . 416 ASP C . 51188 1 1261 . 1 . 1 212 212 ASP CA C 13 54.631 0.02 . 1 . . . . . 416 ASP CA . 51188 1 1262 . 1 . 1 212 212 ASP CB C 13 39.116 0.00 . 1 . . . . . 416 ASP CB . 51188 1 1263 . 1 . 1 212 212 ASP N N 15 122.355 0.02 . 1 . . . . . 416 ASP N . 51188 1 1264 . 1 . 1 213 213 GLN H H 1 7.081 0.00 . 1 . . . . . 417 GLN H . 51188 1 1265 . 1 . 1 213 213 GLN C C 13 174.182 0.00 . 1 . . . . . 417 GLN C . 51188 1 1266 . 1 . 1 213 213 GLN CA C 13 53.839 0.01 . 1 . . . . . 417 GLN CA . 51188 1 1267 . 1 . 1 213 213 GLN CB C 13 32.066 0.00 . 1 . . . . . 417 GLN CB . 51188 1 1268 . 1 . 1 213 213 GLN N N 15 114.183 0.02 . 1 . . . . . 417 GLN N . 51188 1 1269 . 1 . 1 214 214 ASN H H 1 8.654 0.00 . 1 . . . . . 418 ASN H . 51188 1 1270 . 1 . 1 214 214 ASN C C 13 174.966 0.00 . 1 . . . . . 418 ASN C . 51188 1 1271 . 1 . 1 214 214 ASN CA C 13 53.083 0.02 . 1 . . . . . 418 ASN CA . 51188 1 1272 . 1 . 1 214 214 ASN CB C 13 38.843 0.00 . 1 . . . . . 418 ASN CB . 51188 1 1273 . 1 . 1 214 214 ASN N N 15 120.931 0.02 . 1 . . . . . 418 ASN N . 51188 1 1274 . 1 . 1 215 215 ILE H H 1 8.980 0.00 . 1 . . . . . 419 ILE H . 51188 1 1275 . 1 . 1 215 215 ILE HD11 H 1 0.750 0.00 . 1 . . . . . 419 ILE HD1 . 51188 1 1276 . 1 . 1 215 215 ILE HD12 H 1 0.750 0.00 . 1 . . . . . 419 ILE HD1 . 51188 1 1277 . 1 . 1 215 215 ILE HD13 H 1 0.750 0.00 . 1 . . . . . 419 ILE HD1 . 51188 1 1278 . 1 . 1 215 215 ILE C C 13 174.413 0.00 . 1 . . . . . 419 ILE C . 51188 1 1279 . 1 . 1 215 215 ILE CA C 13 59.423 0.04 . 1 . . . . . 419 ILE CA . 51188 1 1280 . 1 . 1 215 215 ILE CB C 13 41.127 0.00 . 1 . . . . . 419 ILE CB . 51188 1 1281 . 1 . 1 215 215 ILE CG1 C 13 25.983 0.00 . 1 . . . . . 419 ILE CG1 . 51188 1 1282 . 1 . 1 215 215 ILE CD1 C 13 14.005 0.01 . 1 . . . . . 419 ILE CD1 . 51188 1 1283 . 1 . 1 215 215 ILE N N 15 120.782 0.02 . 1 . . . . . 419 ILE N . 51188 1 1284 . 1 . 1 216 216 LYS H H 1 8.171 0.00 . 1 . . . . . 420 LYS H . 51188 1 1285 . 1 . 1 216 216 LYS C C 13 175.916 0.00 . 1 . . . . . 420 LYS C . 51188 1 1286 . 1 . 1 216 216 LYS CA C 13 54.270 0.00 . 1 . . . . . 420 LYS CA . 51188 1 1287 . 1 . 1 216 216 LYS CB C 13 34.467 0.00 . 1 . . . . . 420 LYS CB . 51188 1 1288 . 1 . 1 216 216 LYS N N 15 123.679 0.02 . 1 . . . . . 420 LYS N . 51188 1 1289 . 1 . 1 217 217 ILE H H 1 9.154 0.00 . 1 . . . . . 421 ILE H . 51188 1 1290 . 1 . 1 217 217 ILE HD11 H 1 0.805 0.00 . 1 . . . . . 421 ILE HD1 . 51188 1 1291 . 1 . 1 217 217 ILE HD12 H 1 0.805 0.00 . 1 . . . . . 421 ILE HD1 . 51188 1 1292 . 1 . 1 217 217 ILE HD13 H 1 0.805 0.00 . 1 . . . . . 421 ILE HD1 . 51188 1 1293 . 1 . 1 217 217 ILE C C 13 176.231 0.01 . 1 . . . . . 421 ILE C . 51188 1 1294 . 1 . 1 217 217 ILE CA C 13 59.972 0.04 . 1 . . . . . 421 ILE CA . 51188 1 1295 . 1 . 1 217 217 ILE CB C 13 37.995 0.02 . 1 . . . . . 421 ILE CB . 51188 1 1296 . 1 . 1 217 217 ILE CG1 C 13 26.278 0.00 . 1 . . . . . 421 ILE CG1 . 51188 1 1297 . 1 . 1 217 217 ILE CD1 C 13 13.413 0.01 . 1 . . . . . 421 ILE CD1 . 51188 1 1298 . 1 . 1 217 217 ILE N N 15 127.475 0.02 . 1 . . . . . 421 ILE N . 51188 1 1299 . 1 . 1 218 218 ASN H H 1 8.979 0.00 . 1 . . . . . 422 ASN H . 51188 1 1300 . 1 . 1 218 218 ASN C C 13 173.835 0.00 . 1 . . . . . 422 ASN C . 51188 1 1301 . 1 . 1 218 218 ASN CA C 13 53.797 0.01 . 1 . . . . . 422 ASN CA . 51188 1 1302 . 1 . 1 218 218 ASN CB C 13 39.680 0.00 . 1 . . . . . 422 ASN CB . 51188 1 1303 . 1 . 1 218 218 ASN N N 15 126.874 0.03 . 1 . . . . . 422 ASN N . 51188 1 1304 . 1 . 1 219 219 ASP H H 1 7.128 0.00 . 1 . . . . . 423 ASP H . 51188 1 1305 . 1 . 1 219 219 ASP C C 13 174.746 0.00 . 1 . . . . . 423 ASP C . 51188 1 1306 . 1 . 1 219 219 ASP CA C 13 54.530 0.02 . 1 . . . . . 423 ASP CA . 51188 1 1307 . 1 . 1 219 219 ASP CB C 13 40.729 0.00 . 1 . . . . . 423 ASP CB . 51188 1 1308 . 1 . 1 219 219 ASP N N 15 117.113 0.02 . 1 . . . . . 423 ASP N . 51188 1 1309 . 1 . 1 220 220 ARG H H 1 8.654 0.00 . 1 . . . . . 424 ARG H . 51188 1 1310 . 1 . 1 220 220 ARG C C 13 176.224 0.00 . 1 . . . . . 424 ARG C . 51188 1 1311 . 1 . 1 220 220 ARG CA C 13 56.624 0.01 . 1 . . . . . 424 ARG CA . 51188 1 1312 . 1 . 1 220 220 ARG CB C 13 29.617 0.00 . 1 . . . . . 424 ARG CB . 51188 1 1313 . 1 . 1 220 220 ARG N N 15 122.508 0.02 . 1 . . . . . 424 ARG N . 51188 1 1314 . 1 . 1 221 221 PHE H H 1 9.300 0.00 . 1 . . . . . 425 PHE H . 51188 1 1315 . 1 . 1 221 221 PHE C C 13 173.439 0.00 . 1 . . . . . 425 PHE C . 51188 1 1316 . 1 . 1 221 221 PHE CA C 13 58.643 0.01 . 1 . . . . . 425 PHE CA . 51188 1 1317 . 1 . 1 221 221 PHE CB C 13 40.791 0.00 . 1 . . . . . 425 PHE CB . 51188 1 1318 . 1 . 1 221 221 PHE N N 15 129.862 0.02 . 1 . . . . . 425 PHE N . 51188 1 1319 . 1 . 1 222 222 GLU H H 1 7.452 0.00 . 1 . . . . . 426 GLU H . 51188 1 1320 . 1 . 1 222 222 GLU C C 13 173.739 0.00 . 1 . . . . . 426 GLU C . 51188 1 1321 . 1 . 1 222 222 GLU CA C 13 55.319 0.01 . 1 . . . . . 426 GLU CA . 51188 1 1322 . 1 . 1 222 222 GLU CB C 13 29.642 0.00 . 1 . . . . . 426 GLU CB . 51188 1 1323 . 1 . 1 222 222 GLU N N 15 126.014 0.03 . 1 . . . . . 426 GLU N . 51188 1 1324 . 1 . 1 223 223 PHE CA C 13 51.953 0.00 . 1 . . . . . 427 PHE CA . 51188 1 1325 . 1 . 1 223 223 PHE CB C 13 39.472 0.00 . 1 . . . . . 427 PHE CB . 51188 1 1326 . 1 . 1 223 223 PHE N N 15 115.611 0.02 . 1 . . . . . 427 PHE N . 51188 1 1327 . 1 . 1 224 224 PRO C C 13 177.127 0.00 . 1 . . . . . 428 PRO C . 51188 1 1328 . 1 . 1 224 224 PRO CA C 13 61.456 0.00 . 1 . . . . . 428 PRO CA . 51188 1 1329 . 1 . 1 224 224 PRO CB C 13 32.715 0.00 . 1 . . . . . 428 PRO CB . 51188 1 1330 . 1 . 1 225 225 GLU H H 1 8.882 0.00 . 1 . . . . . 429 GLU H . 51188 1 1331 . 1 . 1 225 225 GLU C C 13 175.393 0.00 . 1 . . . . . 429 GLU C . 51188 1 1332 . 1 . 1 225 225 GLU CA C 13 58.625 0.00 . 1 . . . . . 429 GLU CA . 51188 1 1333 . 1 . 1 225 225 GLU CB C 13 30.247 0.00 . 1 . . . . . 429 GLU CB . 51188 1 1334 . 1 . 1 225 225 GLU N N 15 119.702 0.02 . 1 . . . . . 429 GLU N . 51188 1 1335 . 1 . 1 226 226 GLN H H 1 7.758 0.00 . 1 . . . . . 430 GLN H . 51188 1 1336 . 1 . 1 226 226 GLN C C 13 173.596 0.00 . 1 . . . . . 430 GLN C . 51188 1 1337 . 1 . 1 226 226 GLN CA C 13 54.660 0.00 . 1 . . . . . 430 GLN CA . 51188 1 1338 . 1 . 1 226 226 GLN CB C 13 29.739 0.00 . 1 . . . . . 430 GLN CB . 51188 1 1339 . 1 . 1 226 226 GLN N N 15 116.134 0.02 . 1 . . . . . 430 GLN N . 51188 1 1340 . 1 . 1 227 227 LEU H H 1 9.412 0.00 . 1 . . . . . 431 LEU H . 51188 1 1341 . 1 . 1 227 227 LEU HD11 H 1 -0.172 0.00 . 1 . . . . . 431 LEU HD1 . 51188 1 1342 . 1 . 1 227 227 LEU HD12 H 1 -0.172 0.00 . 1 . . . . . 431 LEU HD1 . 51188 1 1343 . 1 . 1 227 227 LEU HD13 H 1 -0.172 0.00 . 1 . . . . . 431 LEU HD1 . 51188 1 1344 . 1 . 1 227 227 LEU HD21 H 1 0.380 0.00 . 1 . . . . . 431 LEU HD2 . 51188 1 1345 . 1 . 1 227 227 LEU HD22 H 1 0.380 0.00 . 1 . . . . . 431 LEU HD2 . 51188 1 1346 . 1 . 1 227 227 LEU HD23 H 1 0.380 0.00 . 1 . . . . . 431 LEU HD2 . 51188 1 1347 . 1 . 1 227 227 LEU C C 13 173.111 0.01 . 1 . . . . . 431 LEU C . 51188 1 1348 . 1 . 1 227 227 LEU CA C 13 50.953 0.04 . 1 . . . . . 431 LEU CA . 51188 1 1349 . 1 . 1 227 227 LEU CB C 13 46.054 0.02 . 1 . . . . . 431 LEU CB . 51188 1 1350 . 1 . 1 227 227 LEU CG C 13 25.691 0.05 . 1 . . . . . 431 LEU CG . 51188 1 1351 . 1 . 1 227 227 LEU CD1 C 13 25.075 0.02 . 2 . . . . . 431 LEU CD1 . 51188 1 1352 . 1 . 1 227 227 LEU CD2 C 13 24.128 0.01 . 2 . . . . . 431 LEU CD2 . 51188 1 1353 . 1 . 1 227 227 LEU N N 15 127.149 0.02 . 1 . . . . . 431 LEU N . 51188 1 1354 . 1 . 1 228 228 PRO C C 13 178.252 0.00 . 1 . . . . . 432 PRO C . 51188 1 1355 . 1 . 1 228 228 PRO CA C 13 61.861 0.00 . 1 . . . . . 432 PRO CA . 51188 1 1356 . 1 . 1 228 228 PRO CB C 13 31.197 0.00 . 1 . . . . . 432 PRO CB . 51188 1 1357 . 1 . 1 229 229 LEU H H 1 8.846 0.00 . 1 . . . . . 433 LEU H . 51188 1 1358 . 1 . 1 229 229 LEU HD11 H 1 0.67 0.00 . 1 . . . . . 433 LEU HD1 . 51188 1 1359 . 1 . 1 229 229 LEU HD12 H 1 0.67 0.00 . 1 . . . . . 433 LEU HD1 . 51188 1 1360 . 1 . 1 229 229 LEU HD13 H 1 0.67 0.00 . 1 . . . . . 433 LEU HD1 . 51188 1 1361 . 1 . 1 229 229 LEU HD21 H 1 -0.060 0.00 . 1 . . . . . 433 LEU HD2 . 51188 1 1362 . 1 . 1 229 229 LEU HD22 H 1 -0.060 0.00 . 1 . . . . . 433 LEU HD2 . 51188 1 1363 . 1 . 1 229 229 LEU HD23 H 1 -0.060 0.00 . 1 . . . . . 433 LEU HD2 . 51188 1 1364 . 1 . 1 229 229 LEU C C 13 177.363 0.01 . 1 . . . . . 433 LEU C . 51188 1 1365 . 1 . 1 229 229 LEU CA C 13 53.721 0.05 . 1 . . . . . 433 LEU CA . 51188 1 1366 . 1 . 1 229 229 LEU CB C 13 43.071 0.01 . 1 . . . . . 433 LEU CB . 51188 1 1367 . 1 . 1 229 229 LEU CG C 13 25.774 0.00 . 1 . . . . . 433 LEU CG . 51188 1 1368 . 1 . 1 229 229 LEU CD1 C 13 21.735 0.01 . 2 . . . . . 433 LEU CD1 . 51188 1 1369 . 1 . 1 229 229 LEU CD2 C 13 26.220 0.00 . 2 . . . . . 433 LEU CD2 . 51188 1 1370 . 1 . 1 229 229 LEU N N 15 123.639 0.02 . 1 . . . . . 433 LEU N . 51188 1 1371 . 1 . 1 230 230 ASP H H 1 8.092 0.00 . 1 . . . . . 434 ASP H . 51188 1 1372 . 1 . 1 230 230 ASP C C 13 178.730 0.00 . 1 . . . . . 434 ASP C . 51188 1 1373 . 1 . 1 230 230 ASP CA C 13 57.941 0.02 . 1 . . . . . 434 ASP CA . 51188 1 1374 . 1 . 1 230 230 ASP CB C 13 40.386 0.00 . 1 . . . . . 434 ASP CB . 51188 1 1375 . 1 . 1 230 230 ASP N N 15 121.553 0.02 . 1 . . . . . 434 ASP N . 51188 1 1376 . 1 . 1 231 231 GLU H H 1 8.191 0.00 . 1 . . . . . 435 GLU H . 51188 1 1377 . 1 . 1 231 231 GLU C C 13 176.330 0.00 . 1 . . . . . 435 GLU C . 51188 1 1378 . 1 . 1 231 231 GLU CA C 13 57.739 0.00 . 1 . . . . . 435 GLU CA . 51188 1 1379 . 1 . 1 231 231 GLU CB C 13 28.661 0.00 . 1 . . . . . 435 GLU CB . 51188 1 1380 . 1 . 1 231 231 GLU N N 15 114.606 0.02 . 1 . . . . . 435 GLU N . 51188 1 1381 . 1 . 1 232 232 PHE H H 1 7.612 0.00 . 1 . . . . . 436 PHE H . 51188 1 1382 . 1 . 1 232 232 PHE C C 13 174.672 0.00 . 1 . . . . . 436 PHE C . 51188 1 1383 . 1 . 1 232 232 PHE CA C 13 57.744 0.00 . 1 . . . . . 436 PHE CA . 51188 1 1384 . 1 . 1 232 232 PHE CB C 13 38.297 0.00 . 1 . . . . . 436 PHE CB . 51188 1 1385 . 1 . 1 232 232 PHE N N 15 117.562 0.03 . 1 . . . . . 436 PHE N . 51188 1 1386 . 1 . 1 233 233 LEU H H 1 7.221 0.00 . 1 . . . . . 437 LEU H . 51188 1 1387 . 1 . 1 233 233 LEU HD11 H 1 1.077 0.00 . 1 . . . . . 437 LEU HD1 . 51188 1 1388 . 1 . 1 233 233 LEU HD12 H 1 1.077 0.00 . 1 . . . . . 437 LEU HD1 . 51188 1 1389 . 1 . 1 233 233 LEU HD13 H 1 1.077 0.00 . 1 . . . . . 437 LEU HD1 . 51188 1 1390 . 1 . 1 233 233 LEU HD21 H 1 0.759 0.00 . 1 . . . . . 437 LEU HD2 . 51188 1 1391 . 1 . 1 233 233 LEU HD22 H 1 0.759 0.00 . 1 . . . . . 437 LEU HD2 . 51188 1 1392 . 1 . 1 233 233 LEU HD23 H 1 0.759 0.00 . 1 . . . . . 437 LEU HD2 . 51188 1 1393 . 1 . 1 233 233 LEU C C 13 178.398 0.02 . 1 . . . . . 437 LEU C . 51188 1 1394 . 1 . 1 233 233 LEU CA C 13 53.246 0.03 . 1 . . . . . 437 LEU CA . 51188 1 1395 . 1 . 1 233 233 LEU CB C 13 43.262 0.01 . 1 . . . . . 437 LEU CB . 51188 1 1396 . 1 . 1 233 233 LEU CG C 13 26.304 0.04 . 1 . . . . . 437 LEU CG . 51188 1 1397 . 1 . 1 233 233 LEU CD1 C 13 27.717 0.01 . 2 . . . . . 437 LEU CD1 . 51188 1 1398 . 1 . 1 233 233 LEU CD2 C 13 23.656 0.01 . 2 . . . . . 437 LEU CD2 . 51188 1 1399 . 1 . 1 233 233 LEU N N 15 119.255 0.02 . 1 . . . . . 437 LEU N . 51188 1 1400 . 1 . 1 234 234 GLN H H 1 8.576 0.00 . 1 . . . . . 438 GLN H . 51188 1 1401 . 1 . 1 234 234 GLN C C 13 175.804 0.00 . 1 . . . . . 438 GLN C . 51188 1 1402 . 1 . 1 234 234 GLN CA C 13 58.367 0.01 . 1 . . . . . 438 GLN CA . 51188 1 1403 . 1 . 1 234 234 GLN CB C 13 28.840 0.00 . 1 . . . . . 438 GLN CB . 51188 1 1404 . 1 . 1 234 234 GLN N N 15 121.276 0.02 . 1 . . . . . 438 GLN N . 51188 1 1405 . 1 . 1 235 235 LYS H H 1 7.839 0.00 . 1 . . . . . 439 LYS H . 51188 1 1406 . 1 . 1 235 235 LYS C C 13 175.497 0.00 . 1 . . . . . 439 LYS C . 51188 1 1407 . 1 . 1 235 235 LYS CA C 13 55.037 0.01 . 1 . . . . . 439 LYS CA . 51188 1 1408 . 1 . 1 235 235 LYS CB C 13 34.465 0.00 . 1 . . . . . 439 LYS CB . 51188 1 1409 . 1 . 1 235 235 LYS N N 15 117.438 0.02 . 1 . . . . . 439 LYS N . 51188 1 1410 . 1 . 1 236 236 THR H H 1 8.391 0.00 . 1 . . . . . 440 THR H . 51188 1 1411 . 1 . 1 236 236 THR C C 13 173.246 0.00 . 1 . . . . . 440 THR C . 51188 1 1412 . 1 . 1 236 236 THR CA C 13 60.925 0.01 . 1 . . . . . 440 THR CA . 51188 1 1413 . 1 . 1 236 236 THR CB C 13 69.925 0.00 . 1 . . . . . 440 THR CB . 51188 1 1414 . 1 . 1 236 236 THR N N 15 118.017 0.02 . 1 . . . . . 440 THR N . 51188 1 1415 . 1 . 1 237 237 ASP H H 1 8.827 0.00 . 1 . . . . . 441 ASP H . 51188 1 1416 . 1 . 1 237 237 ASP CA C 13 49.903 0.00 . 1 . . . . . 441 ASP CA . 51188 1 1417 . 1 . 1 237 237 ASP CB C 13 42.400 0.00 . 1 . . . . . 441 ASP CB . 51188 1 1418 . 1 . 1 237 237 ASP N N 15 121.625 0.02 . 1 . . . . . 441 ASP N . 51188 1 1419 . 1 . 1 238 238 PRO C C 13 177.742 0.00 . 1 . . . . . 442 PRO C . 51188 1 1420 . 1 . 1 238 238 PRO CA C 13 63.898 0.00 . 1 . . . . . 442 PRO CA . 51188 1 1421 . 1 . 1 238 238 PRO CB C 13 31.301 0.00 . 1 . . . . . 442 PRO CB . 51188 1 1422 . 1 . 1 239 239 LYS H H 1 8.087 0.00 . 1 . . . . . 443 LYS H . 51188 1 1423 . 1 . 1 239 239 LYS C C 13 176.394 0.00 . 1 . . . . . 443 LYS C . 51188 1 1424 . 1 . 1 239 239 LYS CA C 13 55.593 0.02 . 1 . . . . . 443 LYS CA . 51188 1 1425 . 1 . 1 239 239 LYS CB C 13 31.673 0.00 . 1 . . . . . 443 LYS CB . 51188 1 1426 . 1 . 1 239 239 LYS N N 15 115.066 0.03 . 1 . . . . . 443 LYS N . 51188 1 1427 . 1 . 1 240 240 ASP H H 1 7.470 0.00 . 1 . . . . . 444 ASP H . 51188 1 1428 . 1 . 1 240 240 ASP CA C 13 51.418 0.00 . 1 . . . . . 444 ASP CA . 51188 1 1429 . 1 . 1 240 240 ASP CB C 13 40.427 0.00 . 1 . . . . . 444 ASP CB . 51188 1 1430 . 1 . 1 240 240 ASP N N 15 117.788 0.02 . 1 . . . . . 444 ASP N . 51188 1 1431 . 1 . 1 241 241 PRO C C 13 177.127 0.00 . 1 . . . . . 445 PRO C . 51188 1 1432 . 1 . 1 241 241 PRO CA C 13 62.528 0.00 . 1 . . . . . 445 PRO CA . 51188 1 1433 . 1 . 1 241 241 PRO CB C 13 31.704 0.00 . 1 . . . . . 445 PRO CB . 51188 1 1434 . 1 . 1 242 242 ALA H H 1 9.249 0.00 . 1 . . . . . 446 ALA H . 51188 1 1435 . 1 . 1 242 242 ALA C C 13 174.918 0.00 . 1 . . . . . 446 ALA C . 51188 1 1436 . 1 . 1 242 242 ALA CA C 13 50.064 0.00 . 1 . . . . . 446 ALA CA . 51188 1 1437 . 1 . 1 242 242 ALA CB C 13 16.448 0.00 . 1 . . . . . 446 ALA CB . 51188 1 1438 . 1 . 1 242 242 ALA N N 15 130.616 0.02 . 1 . . . . . 446 ALA N . 51188 1 1439 . 1 . 1 243 243 ASN H H 1 7.630 0.00 . 1 . . . . . 447 ASN H . 51188 1 1440 . 1 . 1 243 243 ASN C C 13 174.234 0.00 . 1 . . . . . 447 ASN C . 51188 1 1441 . 1 . 1 243 243 ASN CA C 13 51.855 0.00 . 1 . . . . . 447 ASN CA . 51188 1 1442 . 1 . 1 243 243 ASN CB C 13 39.314 0.00 . 1 . . . . . 447 ASN CB . 51188 1 1443 . 1 . 1 243 243 ASN N N 15 121.506 0.02 . 1 . . . . . 447 ASN N . 51188 1 1444 . 1 . 1 244 244 TYR H H 1 8.612 0.00 . 1 . . . . . 448 TYR H . 51188 1 1445 . 1 . 1 244 244 TYR C C 13 174.954 0.00 . 1 . . . . . 448 TYR C . 51188 1 1446 . 1 . 1 244 244 TYR CA C 13 58.168 0.01 . 1 . . . . . 448 TYR CA . 51188 1 1447 . 1 . 1 244 244 TYR CB C 13 39.973 0.00 . 1 . . . . . 448 TYR CB . 51188 1 1448 . 1 . 1 244 244 TYR N N 15 125.425 0.02 . 1 . . . . . 448 TYR N . 51188 1 1449 . 1 . 1 245 245 ILE H H 1 9.625 0.00 . 1 . . . . . 449 ILE H . 51188 1 1450 . 1 . 1 245 245 ILE HD11 H 1 0.840 0.00 . 1 . . . . . 449 ILE HD1 . 51188 1 1451 . 1 . 1 245 245 ILE HD12 H 1 0.840 0.00 . 1 . . . . . 449 ILE HD1 . 51188 1 1452 . 1 . 1 245 245 ILE HD13 H 1 0.840 0.00 . 1 . . . . . 449 ILE HD1 . 51188 1 1453 . 1 . 1 245 245 ILE C C 13 176.355 0.02 . 1 . . . . . 449 ILE C . 51188 1 1454 . 1 . 1 245 245 ILE CA C 13 58.368 0.04 . 1 . . . . . 449 ILE CA . 51188 1 1455 . 1 . 1 245 245 ILE CB C 13 39.516 0.05 . 1 . . . . . 449 ILE CB . 51188 1 1456 . 1 . 1 245 245 ILE CG1 C 13 26.888 0.00 . 1 . . . . . 449 ILE CG1 . 51188 1 1457 . 1 . 1 245 245 ILE CD1 C 13 12.378 0.01 . 1 . . . . . 449 ILE CD1 . 51188 1 1458 . 1 . 1 245 245 ILE N N 15 123.355 0.03 . 1 . . . . . 449 ILE N . 51188 1 1459 . 1 . 1 246 246 LEU H H 1 8.869 0.00 . 1 . . . . . 450 LEU H . 51188 1 1460 . 1 . 1 246 246 LEU HD11 H 1 1.011 0.00 . 1 . . . . . 450 LEU HD1 . 51188 1 1461 . 1 . 1 246 246 LEU HD12 H 1 1.011 0.00 . 1 . . . . . 450 LEU HD1 . 51188 1 1462 . 1 . 1 246 246 LEU HD13 H 1 1.011 0.00 . 1 . . . . . 450 LEU HD1 . 51188 1 1463 . 1 . 1 246 246 LEU HD21 H 1 0.401 0.00 . 1 . . . . . 450 LEU HD2 . 51188 1 1464 . 1 . 1 246 246 LEU HD22 H 1 0.401 0.00 . 1 . . . . . 450 LEU HD2 . 51188 1 1465 . 1 . 1 246 246 LEU HD23 H 1 0.401 0.00 . 1 . . . . . 450 LEU HD2 . 51188 1 1466 . 1 . 1 246 246 LEU C C 13 174.389 0.01 . 1 . . . . . 450 LEU C . 51188 1 1467 . 1 . 1 246 246 LEU CA C 13 56.879 0.10 . 1 . . . . . 450 LEU CA . 51188 1 1468 . 1 . 1 246 246 LEU CB C 13 42.312 0.04 . 1 . . . . . 450 LEU CB . 51188 1 1469 . 1 . 1 246 246 LEU CG C 13 26.398 0.02 . 1 . . . . . 450 LEU CG . 51188 1 1470 . 1 . 1 246 246 LEU CD1 C 13 27.430 0.02 . 2 . . . . . 450 LEU CD1 . 51188 1 1471 . 1 . 1 246 246 LEU CD2 C 13 21.021 0.01 . 2 . . . . . 450 LEU CD2 . 51188 1 1472 . 1 . 1 246 246 LEU N N 15 129.603 0.03 . 1 . . . . . 450 LEU N . 51188 1 1473 . 1 . 1 248 248 ALA C C 13 175.457 0.00 . 1 . . . . . 452 ALA C . 51188 1 1474 . 1 . 1 248 248 ALA CA C 13 50.683 0.00 . 1 . . . . . 452 ALA CA . 51188 1 1475 . 1 . 1 248 248 ALA CB C 13 23.647 0.00 . 1 . . . . . 452 ALA CB . 51188 1 1476 . 1 . 1 249 249 VAL H H 1 9.280 0.00 . 1 . . . . . 453 VAL H . 51188 1 1477 . 1 . 1 249 249 VAL HG11 H 1 0.953 0.00 . 1 . . . . . 453 VAL HG1 . 51188 1 1478 . 1 . 1 249 249 VAL HG12 H 1 0.953 0.00 . 1 . . . . . 453 VAL HG1 . 51188 1 1479 . 1 . 1 249 249 VAL HG13 H 1 0.953 0.00 . 1 . . . . . 453 VAL HG1 . 51188 1 1480 . 1 . 1 249 249 VAL CA C 13 61.325 0.07 . 1 . . . . . 453 VAL CA . 51188 1 1481 . 1 . 1 249 249 VAL CB C 13 34.602 0.01 . 1 . . . . . 453 VAL CB . 51188 1 1482 . 1 . 1 249 249 VAL CG1 C 13 21.467 0.02 . 2 . . . . . 453 VAL CG1 . 51188 1 1483 . 1 . 1 249 249 VAL N N 15 120.211 0.03 . 1 . . . . . 453 VAL N . 51188 1 1484 . 1 . 1 250 250 LEU HD11 H 1 0.954 0.00 . 1 . . . . . 454 LEU HD1 . 51188 1 1485 . 1 . 1 250 250 LEU HD12 H 1 0.954 0.00 . 1 . . . . . 454 LEU HD1 . 51188 1 1486 . 1 . 1 250 250 LEU HD13 H 1 0.954 0.00 . 1 . . . . . 454 LEU HD1 . 51188 1 1487 . 1 . 1 250 250 LEU HD21 H 1 0.764 0.00 . 1 . . . . . 454 LEU HD2 . 51188 1 1488 . 1 . 1 250 250 LEU HD22 H 1 0.764 0.00 . 1 . . . . . 454 LEU HD2 . 51188 1 1489 . 1 . 1 250 250 LEU HD23 H 1 0.764 0.00 . 1 . . . . . 454 LEU HD2 . 51188 1 1490 . 1 . 1 250 250 LEU C C 13 175.518 0.03 . 1 . . . . . 454 LEU C . 51188 1 1491 . 1 . 1 250 250 LEU CA C 13 58.755 0.02 . 1 . . . . . 454 LEU CA . 51188 1 1492 . 1 . 1 250 250 LEU CB C 13 38.782 0.00 . 1 . . . . . 454 LEU CB . 51188 1 1493 . 1 . 1 250 250 LEU CD1 C 13 26.205 0.01 . 2 . . . . . 454 LEU CD1 . 51188 1 1494 . 1 . 1 250 250 LEU CD2 C 13 24.426 0.01 . 2 . . . . . 454 LEU CD2 . 51188 1 1495 . 1 . 1 251 251 VAL HG11 H 1 1.045 0.00 . 1 . . . . . 455 VAL HG1 . 51188 1 1496 . 1 . 1 251 251 VAL HG12 H 1 1.045 0.00 . 1 . . . . . 455 VAL HG1 . 51188 1 1497 . 1 . 1 251 251 VAL HG13 H 1 1.045 0.00 . 1 . . . . . 455 VAL HG1 . 51188 1 1498 . 1 . 1 251 251 VAL HG21 H 1 0.932 0.00 . 1 . . . . . 455 VAL HG2 . 51188 1 1499 . 1 . 1 251 251 VAL HG22 H 1 0.932 0.00 . 1 . . . . . 455 VAL HG2 . 51188 1 1500 . 1 . 1 251 251 VAL HG23 H 1 0.932 0.00 . 1 . . . . . 455 VAL HG2 . 51188 1 1501 . 1 . 1 251 251 VAL C C 13 175.160 0.08 . 1 . . . . . 455 VAL C . 51188 1 1502 . 1 . 1 251 251 VAL CA C 13 61.102 0.04 . 1 . . . . . 455 VAL CA . 51188 1 1503 . 1 . 1 251 251 VAL CB C 13 35.383 0.07 . 1 . . . . . 455 VAL CB . 51188 1 1504 . 1 . 1 251 251 VAL CG1 C 13 23.188 0.01 . 2 . . . . . 455 VAL CG1 . 51188 1 1505 . 1 . 1 251 251 VAL CG2 C 13 21.942 0.01 . 2 . . . . . 455 VAL CG2 . 51188 1 1506 . 1 . 1 252 252 HIS H H 1 8.865 0.00 . 1 . . . . . 456 HIS H . 51188 1 1507 . 1 . 1 252 252 HIS C C 13 173.846 0.00 . 1 . . . . . 456 HIS C . 51188 1 1508 . 1 . 1 252 252 HIS CA C 13 55.656 0.00 . 1 . . . . . 456 HIS CA . 51188 1 1509 . 1 . 1 252 252 HIS CB C 13 34.832 0.00 . 1 . . . . . 456 HIS CB . 51188 1 1510 . 1 . 1 252 252 HIS N N 15 127.793 0.03 . 1 . . . . . 456 HIS N . 51188 1 1511 . 1 . 1 253 253 SER H H 1 8.027 0.00 . 1 . . . . . 457 SER H . 51188 1 1512 . 1 . 1 253 253 SER C C 13 173.279 0.00 . 1 . . . . . 457 SER C . 51188 1 1513 . 1 . 1 253 253 SER CA C 13 55.938 0.04 . 1 . . . . . 457 SER CA . 51188 1 1514 . 1 . 1 253 253 SER CB C 13 64.677 0.00 . 1 . . . . . 457 SER CB . 51188 1 1515 . 1 . 1 253 253 SER N N 15 121.649 0.02 . 1 . . . . . 457 SER N . 51188 1 1516 . 1 . 1 254 254 GLY H H 1 7.916 0.00 . 1 . . . . . 458 GLY H . 51188 1 1517 . 1 . 1 254 254 GLY C C 13 172.716 0.00 . 1 . . . . . 458 GLY C . 51188 1 1518 . 1 . 1 254 254 GLY CA C 13 44.312 0.03 . 1 . . . . . 458 GLY CA . 51188 1 1519 . 1 . 1 254 254 GLY N N 15 112.037 0.02 . 1 . . . . . 458 GLY N . 51188 1 1520 . 1 . 1 255 255 ASP H H 1 8.322 0.00 . 1 . . . . . 459 ASP H . 51188 1 1521 . 1 . 1 255 255 ASP C C 13 175.622 0.00 . 1 . . . . . 459 ASP C . 51188 1 1522 . 1 . 1 255 255 ASP CA C 13 53.715 0.04 . 1 . . . . . 459 ASP CA . 51188 1 1523 . 1 . 1 255 255 ASP CB C 13 41.633 0.00 . 1 . . . . . 459 ASP CB . 51188 1 1524 . 1 . 1 255 255 ASP N N 15 120.588 0.03 . 1 . . . . . 459 ASP N . 51188 1 1525 . 1 . 1 256 256 ASN H H 1 8.336 0.00 . 1 . . . . . 460 ASN H . 51188 1 1526 . 1 . 1 256 256 ASN CA C 13 54.145 0.01 . 1 . . . . . 460 ASN CA . 51188 1 1527 . 1 . 1 256 256 ASN CB C 13 37.880 0.00 . 1 . . . . . 460 ASN CB . 51188 1 1528 . 1 . 1 256 256 ASN N N 15 116.244 0.02 . 1 . . . . . 460 ASN N . 51188 1 1529 . 1 . 1 257 257 HIS H H 1 8.261 0.00 . 1 . . . . . 461 HIS H . 51188 1 1530 . 1 . 1 257 257 HIS C C 13 175.881 0.00 . 1 . . . . . 461 HIS C . 51188 1 1531 . 1 . 1 257 257 HIS CA C 13 56.620 0.12 . 1 . . . . . 461 HIS CA . 51188 1 1532 . 1 . 1 257 257 HIS CB C 13 29.660 0.00 . 1 . . . . . 461 HIS CB . 51188 1 1533 . 1 . 1 257 257 HIS N N 15 119.600 0.03 . 1 . . . . . 461 HIS N . 51188 1 1534 . 1 . 1 258 258 GLY H H 1 8.225 0.00 . 1 . . . . . 462 GLY H . 51188 1 1535 . 1 . 1 258 258 GLY C C 13 174.058 0.00 . 1 . . . . . 462 GLY C . 51188 1 1536 . 1 . 1 258 258 GLY CA C 13 45.355 0.03 . 1 . . . . . 462 GLY CA . 51188 1 1537 . 1 . 1 258 258 GLY N N 15 110.327 0.03 . 1 . . . . . 462 GLY N . 51188 1 1538 . 1 . 1 259 259 GLY H H 1 8.364 0.00 . 1 . . . . . 463 GLY H . 51188 1 1539 . 1 . 1 259 259 GLY C C 13 172.212 0.00 . 1 . . . . . 463 GLY C . 51188 1 1540 . 1 . 1 259 259 GLY CA C 13 45.116 0.04 . 1 . . . . . 463 GLY CA . 51188 1 1541 . 1 . 1 259 259 GLY N N 15 110.478 0.02 . 1 . . . . . 463 GLY N . 51188 1 1542 . 1 . 1 260 260 HIS H H 1 8.078 0.00 . 1 . . . . . 464 HIS H . 51188 1 1543 . 1 . 1 260 260 HIS C C 13 173.331 0.00 . 1 . . . . . 464 HIS C . 51188 1 1544 . 1 . 1 260 260 HIS CA C 13 54.692 0.04 . 1 . . . . . 464 HIS CA . 51188 1 1545 . 1 . 1 260 260 HIS CB C 13 32.477 0.00 . 1 . . . . . 464 HIS CB . 51188 1 1546 . 1 . 1 260 260 HIS N N 15 119.860 0.02 . 1 . . . . . 464 HIS N . 51188 1 1547 . 1 . 1 261 261 TYR H H 1 8.652 0.00 . 1 . . . . . 465 TYR H . 51188 1 1548 . 1 . 1 261 261 TYR CA C 13 57.744 0.00 . 1 . . . . . 465 TYR CA . 51188 1 1549 . 1 . 1 261 261 TYR CB C 13 40.184 0.00 . 1 . . . . . 465 TYR CB . 51188 1 1550 . 1 . 1 261 261 TYR N N 15 127.846 0.04 . 1 . . . . . 465 TYR N . 51188 1 1551 . 1 . 1 262 262 VAL HG11 H 1 0.721 0.01 . 1 . . . . . 466 VAL HG1 . 51188 1 1552 . 1 . 1 262 262 VAL HG12 H 1 0.721 0.01 . 1 . . . . . 466 VAL HG1 . 51188 1 1553 . 1 . 1 262 262 VAL HG13 H 1 0.721 0.01 . 1 . . . . . 466 VAL HG1 . 51188 1 1554 . 1 . 1 262 262 VAL HG21 H 1 0.678 0.01 . 1 . . . . . 466 VAL HG2 . 51188 1 1555 . 1 . 1 262 262 VAL HG22 H 1 0.678 0.01 . 1 . . . . . 466 VAL HG2 . 51188 1 1556 . 1 . 1 262 262 VAL HG23 H 1 0.678 0.01 . 1 . . . . . 466 VAL HG2 . 51188 1 1557 . 1 . 1 262 262 VAL C C 13 172.749 0.05 . 1 . . . . . 466 VAL C . 51188 1 1558 . 1 . 1 262 262 VAL CA C 13 59.994 0.04 . 1 . . . . . 466 VAL CA . 51188 1 1559 . 1 . 1 262 262 VAL CB C 13 36.004 0.00 . 1 . . . . . 466 VAL CB . 51188 1 1560 . 1 . 1 262 262 VAL CG1 C 13 22.127 0.02 . 2 . . . . . 466 VAL CG1 . 51188 1 1561 . 1 . 1 262 262 VAL CG2 C 13 20.582 0.03 . 2 . . . . . 466 VAL CG2 . 51188 1 1562 . 1 . 1 263 263 VAL H H 1 7.912 0.00 . 1 . . . . . 467 VAL H . 51188 1 1563 . 1 . 1 263 263 VAL HG11 H 1 1.171 0.00 . 1 . . . . . 467 VAL HG1 . 51188 1 1564 . 1 . 1 263 263 VAL HG12 H 1 1.171 0.00 . 1 . . . . . 467 VAL HG1 . 51188 1 1565 . 1 . 1 263 263 VAL HG13 H 1 1.171 0.00 . 1 . . . . . 467 VAL HG1 . 51188 1 1566 . 1 . 1 263 263 VAL HG21 H 1 0.964 0.00 . 1 . . . . . 467 VAL HG2 . 51188 1 1567 . 1 . 1 263 263 VAL HG22 H 1 0.964 0.00 . 1 . . . . . 467 VAL HG2 . 51188 1 1568 . 1 . 1 263 263 VAL HG23 H 1 0.964 0.00 . 1 . . . . . 467 VAL HG2 . 51188 1 1569 . 1 . 1 263 263 VAL C C 13 171.293 0.12 . 1 . . . . . 467 VAL C . 51188 1 1570 . 1 . 1 263 263 VAL CA C 13 58.540 0.06 . 1 . . . . . 467 VAL CA . 51188 1 1571 . 1 . 1 263 263 VAL CB C 13 35.529 0.02 . 1 . . . . . 467 VAL CB . 51188 1 1572 . 1 . 1 263 263 VAL CG1 C 13 21.107 0.02 . 2 . . . . . 467 VAL CG1 . 51188 1 1573 . 1 . 1 263 263 VAL CG2 C 13 22.870 0.01 . 2 . . . . . 467 VAL CG2 . 51188 1 1574 . 1 . 1 263 263 VAL N N 15 118.857 0.03 . 1 . . . . . 467 VAL N . 51188 1 1575 . 1 . 1 264 264 TYR H H 1 9.142 0.00 . 1 . . . . . 468 TYR H . 51188 1 1576 . 1 . 1 264 264 TYR C C 13 175.413 0.00 . 1 . . . . . 468 TYR C . 51188 1 1577 . 1 . 1 264 264 TYR CA C 13 56.413 0.03 . 1 . . . . . 468 TYR CA . 51188 1 1578 . 1 . 1 264 264 TYR CB C 13 39.919 0.00 . 1 . . . . . 468 TYR CB . 51188 1 1579 . 1 . 1 264 264 TYR N N 15 127.523 0.04 . 1 . . . . . 468 TYR N . 51188 1 1580 . 1 . 1 265 265 LEU H H 1 9.361 0.00 . 1 . . . . . 469 LEU H . 51188 1 1581 . 1 . 1 265 265 LEU HD11 H 1 0.213 0.00 . 1 . . . . . 469 LEU HD1 . 51188 1 1582 . 1 . 1 265 265 LEU HD12 H 1 0.213 0.00 . 1 . . . . . 469 LEU HD1 . 51188 1 1583 . 1 . 1 265 265 LEU HD13 H 1 0.213 0.00 . 1 . . . . . 469 LEU HD1 . 51188 1 1584 . 1 . 1 265 265 LEU HD21 H 1 0.351 0.00 . 1 . . . . . 469 LEU HD2 . 51188 1 1585 . 1 . 1 265 265 LEU HD22 H 1 0.351 0.00 . 1 . . . . . 469 LEU HD2 . 51188 1 1586 . 1 . 1 265 265 LEU HD23 H 1 0.351 0.00 . 1 . . . . . 469 LEU HD2 . 51188 1 1587 . 1 . 1 265 265 LEU C C 13 175.569 0.01 . 1 . . . . . 469 LEU C . 51188 1 1588 . 1 . 1 265 265 LEU CA C 13 54.986 0.07 . 1 . . . . . 469 LEU CA . 51188 1 1589 . 1 . 1 265 265 LEU CB C 13 38.6 0.01 . 1 . . . . . 469 LEU CB . 51188 1 1590 . 1 . 1 265 265 LEU CG C 13 28.213 0.00 . 1 . . . . . 469 LEU CG . 51188 1 1591 . 1 . 1 265 265 LEU CD1 C 13 27.570 0.01 . 2 . . . . . 469 LEU CD1 . 51188 1 1592 . 1 . 1 265 265 LEU CD2 C 13 26.575 0.02 . 2 . . . . . 469 LEU CD2 . 51188 1 1593 . 1 . 1 265 265 LEU N N 15 124.480 0.03 . 1 . . . . . 469 LEU N . 51188 1 1594 . 1 . 1 266 266 ASN H H 1 7.099 0.00 . 1 . . . . . 470 ASN H . 51188 1 1595 . 1 . 1 266 266 ASN CA C 13 49.196 0.00 . 1 . . . . . 470 ASN CA . 51188 1 1596 . 1 . 1 266 266 ASN N N 15 119.210 0.03 . 1 . . . . . 470 ASN N . 51188 1 1597 . 1 . 1 267 267 PRO C C 13 178.752 0.00 . 1 . . . . . 471 PRO C . 51188 1 1598 . 1 . 1 267 267 PRO CA C 13 66.567 0.00 . 1 . . . . . 471 PRO CA . 51188 1 1599 . 1 . 1 267 267 PRO CB C 13 31.158 0.00 . 1 . . . . . 471 PRO CB . 51188 1 1600 . 1 . 1 268 268 LYS H H 1 8.445 0.00 . 1 . . . . . 472 LYS H . 51188 1 1601 . 1 . 1 268 268 LYS C C 13 177.337 0.00 . 1 . . . . . 472 LYS C . 51188 1 1602 . 1 . 1 268 268 LYS CA C 13 55.665 0.00 . 1 . . . . . 472 LYS CA . 51188 1 1603 . 1 . 1 268 268 LYS CB C 13 31.567 0.00 . 1 . . . . . 472 LYS CB . 51188 1 1604 . 1 . 1 268 268 LYS N N 15 113.205 0.02 . 1 . . . . . 472 LYS N . 51188 1 1605 . 1 . 1 269 269 GLY H H 1 8.225 0.01 . 1 . . . . . 473 GLY H . 51188 1 1606 . 1 . 1 269 269 GLY C C 13 172.682 0.00 . 1 . . . . . 473 GLY C . 51188 1 1607 . 1 . 1 269 269 GLY CA C 13 46.189 0.02 . 1 . . . . . 473 GLY CA . 51188 1 1608 . 1 . 1 269 269 GLY N N 15 109.162 0.03 . 1 . . . . . 473 GLY N . 51188 1 1609 . 1 . 1 270 270 ASP H H 1 7.797 0.00 . 1 . . . . . 474 ASP H . 51188 1 1610 . 1 . 1 270 270 ASP C C 13 177.482 0.00 . 1 . . . . . 474 ASP C . 51188 1 1611 . 1 . 1 270 270 ASP CA C 13 52.129 0.04 . 1 . . . . . 474 ASP CA . 51188 1 1612 . 1 . 1 270 270 ASP CB C 13 40.678 0.00 . 1 . . . . . 474 ASP CB . 51188 1 1613 . 1 . 1 270 270 ASP N N 15 116.083 0.03 . 1 . . . . . 474 ASP N . 51188 1 1614 . 1 . 1 271 271 GLY H H 1 8.914 0.01 . 1 . . . . . 475 GLY H . 51188 1 1615 . 1 . 1 271 271 GLY C C 13 173.503 0.00 . 1 . . . . . 475 GLY C . 51188 1 1616 . 1 . 1 271 271 GLY CA C 13 45.319 0.02 . 1 . . . . . 475 GLY CA . 51188 1 1617 . 1 . 1 271 271 GLY N N 15 110.563 0.03 . 1 . . . . . 475 GLY N . 51188 1 1618 . 1 . 1 272 272 LYS H H 1 7.153 0.00 . 1 . . . . . 476 LYS H . 51188 1 1619 . 1 . 1 272 272 LYS C C 13 175.664 0.00 . 1 . . . . . 476 LYS C . 51188 1 1620 . 1 . 1 272 272 LYS CA C 13 54.922 0.00 . 1 . . . . . 476 LYS CA . 51188 1 1621 . 1 . 1 272 272 LYS CB C 13 29.523 0.00 . 1 . . . . . 476 LYS CB . 51188 1 1622 . 1 . 1 272 272 LYS N N 15 121.209 0.03 . 1 . . . . . 476 LYS N . 51188 1 1623 . 1 . 1 273 273 TRP H H 1 8.840 0.00 . 1 . . . . . 477 TRP H . 51188 1 1624 . 1 . 1 273 273 TRP C C 13 177.157 0.00 . 1 . . . . . 477 TRP C . 51188 1 1625 . 1 . 1 273 273 TRP CA C 13 58.172 0.13 . 1 . . . . . 477 TRP CA . 51188 1 1626 . 1 . 1 273 273 TRP CB C 13 30.797 0.00 . 1 . . . . . 477 TRP CB . 51188 1 1627 . 1 . 1 273 273 TRP N N 15 125.881 0.02 . 1 . . . . . 477 TRP N . 51188 1 1628 . 1 . 1 274 274 CYS H H 1 9.362 0.00 . 1 . . . . . 478 CYS H . 51188 1 1629 . 1 . 1 274 274 CYS C C 13 172.000 0.00 . 1 . . . . . 478 CYS C . 51188 1 1630 . 1 . 1 274 274 CYS CA C 13 57.696 0.07 . 1 . . . . . 478 CYS CA . 51188 1 1631 . 1 . 1 274 274 CYS CB C 13 32.493 0.00 . 1 . . . . . 478 CYS CB . 51188 1 1632 . 1 . 1 274 274 CYS N N 15 117.769 0.02 . 1 . . . . . 478 CYS N . 51188 1 1633 . 1 . 1 275 275 LYS H H 1 9.311 0.00 . 1 . . . . . 479 LYS H . 51188 1 1634 . 1 . 1 275 275 LYS C C 13 174.213 0.00 . 1 . . . . . 479 LYS C . 51188 1 1635 . 1 . 1 275 275 LYS CA C 13 55.001 0.00 . 1 . . . . . 479 LYS CA . 51188 1 1636 . 1 . 1 275 275 LYS CB C 13 34.229 0.00 . 1 . . . . . 479 LYS CB . 51188 1 1637 . 1 . 1 275 275 LYS N N 15 125.138 0.02 . 1 . . . . . 479 LYS N . 51188 1 1638 . 1 . 1 276 276 PHE H H 1 9.235 0.00 . 1 . . . . . 480 PHE H . 51188 1 1639 . 1 . 1 276 276 PHE C C 13 174.812 0.00 . 1 . . . . . 480 PHE C . 51188 1 1640 . 1 . 1 276 276 PHE CA C 13 56.986 0.01 . 1 . . . . . 480 PHE CA . 51188 1 1641 . 1 . 1 276 276 PHE CB C 13 37.431 0.00 . 1 . . . . . 480 PHE CB . 51188 1 1642 . 1 . 1 276 276 PHE N N 15 126.278 0.02 . 1 . . . . . 480 PHE N . 51188 1 1643 . 1 . 1 277 277 ASP H H 1 8.810 0.00 . 1 . . . . . 481 ASP H . 51188 1 1644 . 1 . 1 277 277 ASP C C 13 175.191 0.00 . 1 . . . . . 481 ASP C . 51188 1 1645 . 1 . 1 277 277 ASP CA C 13 51.024 0.01 . 1 . . . . . 481 ASP CA . 51188 1 1646 . 1 . 1 277 277 ASP CB C 13 40.061 0.00 . 1 . . . . . 481 ASP CB . 51188 1 1647 . 1 . 1 277 277 ASP N N 15 129.084 0.03 . 1 . . . . . 481 ASP N . 51188 1 1648 . 1 . 1 278 278 ASP H H 1 8.265 0.00 . 1 . . . . . 482 ASP H . 51188 1 1649 . 1 . 1 278 278 ASP C C 13 176.237 0.00 . 1 . . . . . 482 ASP C . 51188 1 1650 . 1 . 1 278 278 ASP CA C 13 57.654 0.01 . 1 . . . . . 482 ASP CA . 51188 1 1651 . 1 . 1 278 278 ASP CB C 13 39.211 0.00 . 1 . . . . . 482 ASP CB . 51188 1 1652 . 1 . 1 278 278 ASP N N 15 119.293 0.03 . 1 . . . . . 482 ASP N . 51188 1 1653 . 1 . 1 279 279 ASP H H 1 9.254 0.00 . 1 . . . . . 483 ASP H . 51188 1 1654 . 1 . 1 279 279 ASP C C 13 175.106 0.00 . 1 . . . . . 483 ASP C . 51188 1 1655 . 1 . 1 279 279 ASP CA C 13 55.246 0.00 . 1 . . . . . 483 ASP CA . 51188 1 1656 . 1 . 1 279 279 ASP CB C 13 39.218 0.00 . 1 . . . . . 483 ASP CB . 51188 1 1657 . 1 . 1 279 279 ASP N N 15 121.376 0.02 . 1 . . . . . 483 ASP N . 51188 1 1658 . 1 . 1 280 280 VAL H H 1 8.012 0.00 . 1 . . . . . 484 VAL H . 51188 1 1659 . 1 . 1 280 280 VAL HG11 H 1 0.932 0.00 . 1 . . . . . 484 VAL HG1 . 51188 1 1660 . 1 . 1 280 280 VAL HG12 H 1 0.932 0.00 . 1 . . . . . 484 VAL HG1 . 51188 1 1661 . 1 . 1 280 280 VAL HG13 H 1 0.932 0.00 . 1 . . . . . 484 VAL HG1 . 51188 1 1662 . 1 . 1 280 280 VAL HG21 H 1 0.859 0.00 . 1 . . . . . 484 VAL HG2 . 51188 1 1663 . 1 . 1 280 280 VAL HG22 H 1 0.859 0.00 . 1 . . . . . 484 VAL HG2 . 51188 1 1664 . 1 . 1 280 280 VAL HG23 H 1 0.859 0.00 . 1 . . . . . 484 VAL HG2 . 51188 1 1665 . 1 . 1 280 280 VAL C C 13 174.214 0.00 . 1 . . . . . 484 VAL C . 51188 1 1666 . 1 . 1 280 280 VAL CA C 13 62.507 0.04 . 1 . . . . . 484 VAL CA . 51188 1 1667 . 1 . 1 280 280 VAL CB C 13 32.347 0.00 . 1 . . . . . 484 VAL CB . 51188 1 1668 . 1 . 1 280 280 VAL CG1 C 13 21.398 0.00 . 2 . . . . . 484 VAL CG1 . 51188 1 1669 . 1 . 1 280 280 VAL CG2 C 13 21.375 0.00 . 2 . . . . . 484 VAL CG2 . 51188 1 1670 . 1 . 1 280 280 VAL N N 15 123.575 0.03 . 1 . . . . . 484 VAL N . 51188 1 1671 . 1 . 1 281 281 VAL H H 1 8.356 0.00 . 1 . . . . . 485 VAL H . 51188 1 1672 . 1 . 1 281 281 VAL HG11 H 1 -0.010 0.00 . 1 . . . . . 485 VAL HG1 . 51188 1 1673 . 1 . 1 281 281 VAL HG12 H 1 -0.010 0.00 . 1 . . . . . 485 VAL HG1 . 51188 1 1674 . 1 . 1 281 281 VAL HG13 H 1 -0.010 0.00 . 1 . . . . . 485 VAL HG1 . 51188 1 1675 . 1 . 1 281 281 VAL HG21 H 1 0.503 0.00 . 1 . . . . . 485 VAL HG2 . 51188 1 1676 . 1 . 1 281 281 VAL HG22 H 1 0.503 0.00 . 1 . . . . . 485 VAL HG2 . 51188 1 1677 . 1 . 1 281 281 VAL HG23 H 1 0.503 0.00 . 1 . . . . . 485 VAL HG2 . 51188 1 1678 . 1 . 1 281 281 VAL C C 13 175.803 0.05 . 1 . . . . . 485 VAL C . 51188 1 1679 . 1 . 1 281 281 VAL CA C 13 60.044 0.04 . 1 . . . . . 485 VAL CA . 51188 1 1680 . 1 . 1 281 281 VAL CB C 13 32.425 0.01 . 1 . . . . . 485 VAL CB . 51188 1 1681 . 1 . 1 281 281 VAL CG1 C 13 20.648 0.02 . 2 . . . . . 485 VAL CG1 . 51188 1 1682 . 1 . 1 281 281 VAL CG2 C 13 20.896 0.01 . 2 . . . . . 485 VAL CG2 . 51188 1 1683 . 1 . 1 281 281 VAL N N 15 131.127 0.02 . 1 . . . . . 485 VAL N . 51188 1 1684 . 1 . 1 282 282 SER H H 1 8.735 0.00 . 1 . . . . . 486 SER H . 51188 1 1685 . 1 . 1 282 282 SER C C 13 173.816 0.00 . 1 . . . . . 486 SER C . 51188 1 1686 . 1 . 1 282 282 SER CA C 13 55.857 0.01 . 1 . . . . . 486 SER CA . 51188 1 1687 . 1 . 1 282 282 SER CB C 13 65.452 0.00 . 1 . . . . . 486 SER CB . 51188 1 1688 . 1 . 1 282 282 SER N N 15 120.531 0.03 . 1 . . . . . 486 SER N . 51188 1 1689 . 1 . 1 283 283 ARG H H 1 8.823 0.00 . 1 . . . . . 487 ARG H . 51188 1 1690 . 1 . 1 283 283 ARG C C 13 175.994 0.00 . 1 . . . . . 487 ARG C . 51188 1 1691 . 1 . 1 283 283 ARG CA C 13 56.681 0.01 . 1 . . . . . 487 ARG CA . 51188 1 1692 . 1 . 1 283 283 ARG CB C 13 29.422 0.00 . 1 . . . . . 487 ARG CB . 51188 1 1693 . 1 . 1 283 283 ARG N N 15 124.005 0.02 . 1 . . . . . 487 ARG N . 51188 1 1694 . 1 . 1 284 284 CYS H H 1 8.480 0.00 . 1 . . . . . 488 CYS H . 51188 1 1695 . 1 . 1 284 284 CYS C C 13 172.646 0.00 . 1 . . . . . 488 CYS C . 51188 1 1696 . 1 . 1 284 284 CYS CA C 13 55.629 0.01 . 1 . . . . . 488 CYS CA . 51188 1 1697 . 1 . 1 284 284 CYS CB C 13 31.665 0.00 . 1 . . . . . 488 CYS CB . 51188 1 1698 . 1 . 1 284 284 CYS N N 15 119.905 0.03 . 1 . . . . . 488 CYS N . 51188 1 1699 . 1 . 1 285 285 THR H H 1 8.503 0.00 . 1 . . . . . 489 THR H . 51188 1 1700 . 1 . 1 285 285 THR C C 13 175.570 0.00 . 1 . . . . . 489 THR C . 51188 1 1701 . 1 . 1 285 285 THR CA C 13 60.390 0.02 . 1 . . . . . 489 THR CA . 51188 1 1702 . 1 . 1 285 285 THR CB C 13 71.287 0.00 . 1 . . . . . 489 THR CB . 51188 1 1703 . 1 . 1 285 285 THR N N 15 111.269 0.02 . 1 . . . . . 489 THR N . 51188 1 1704 . 1 . 1 286 286 LYS H H 1 8.659 0.00 . 1 . . . . . 490 LYS H . 51188 1 1705 . 1 . 1 286 286 LYS C C 13 177.487 0.00 . 1 . . . . . 490 LYS C . 51188 1 1706 . 1 . 1 286 286 LYS CA C 13 59.358 0.03 . 1 . . . . . 490 LYS CA . 51188 1 1707 . 1 . 1 286 286 LYS CB C 13 31.232 0.00 . 1 . . . . . 490 LYS CB . 51188 1 1708 . 1 . 1 286 286 LYS N N 15 121.354 0.02 . 1 . . . . . 490 LYS N . 51188 1 1709 . 1 . 1 287 287 GLU H H 1 8.243 0.00 . 1 . . . . . 491 GLU H . 51188 1 1710 . 1 . 1 287 287 GLU C C 13 176.800 0.00 . 1 . . . . . 491 GLU C . 51188 1 1711 . 1 . 1 287 287 GLU CA C 13 59.389 0.07 . 1 . . . . . 491 GLU CA . 51188 1 1712 . 1 . 1 287 287 GLU CB C 13 28.160 0.00 . 1 . . . . . 491 GLU CB . 51188 1 1713 . 1 . 1 287 287 GLU N N 15 117.802 0.02 . 1 . . . . . 491 GLU N . 51188 1 1714 . 1 . 1 288 288 GLU H H 1 6.831 0.00 . 1 . . . . . 492 GLU H . 51188 1 1715 . 1 . 1 288 288 GLU C C 13 175.376 0.00 . 1 . . . . . 492 GLU C . 51188 1 1716 . 1 . 1 288 288 GLU CA C 13 57.596 0.01 . 1 . . . . . 492 GLU CA . 51188 1 1717 . 1 . 1 288 288 GLU CB C 13 29.075 0.00 . 1 . . . . . 492 GLU CB . 51188 1 1718 . 1 . 1 288 288 GLU N N 15 116.133 0.03 . 1 . . . . . 492 GLU N . 51188 1 1719 . 1 . 1 289 289 ALA H H 1 6.294 0.00 . 1 . . . . . 493 ALA H . 51188 1 1720 . 1 . 1 289 289 ALA C C 13 177.029 0.00 . 1 . . . . . 493 ALA C . 51188 1 1721 . 1 . 1 289 289 ALA CA C 13 52.672 0.00 . 1 . . . . . 493 ALA CA . 51188 1 1722 . 1 . 1 289 289 ALA CB C 13 19.140 0.00 . 1 . . . . . 493 ALA CB . 51188 1 1723 . 1 . 1 289 289 ALA N N 15 116.207 0.03 . 1 . . . . . 493 ALA N . 51188 1 1724 . 1 . 1 290 290 ILE H H 1 7.119 0.00 . 1 . . . . . 494 ILE H . 51188 1 1725 . 1 . 1 290 290 ILE HD11 H 1 0.592 0.00 . 1 . . . . . 494 ILE HD1 . 51188 1 1726 . 1 . 1 290 290 ILE HD12 H 1 0.592 0.00 . 1 . . . . . 494 ILE HD1 . 51188 1 1727 . 1 . 1 290 290 ILE HD13 H 1 0.592 0.00 . 1 . . . . . 494 ILE HD1 . 51188 1 1728 . 1 . 1 290 290 ILE C C 13 175.405 0.00 . 1 . . . . . 494 ILE C . 51188 1 1729 . 1 . 1 290 290 ILE CA C 13 61.866 0.05 . 1 . . . . . 494 ILE CA . 51188 1 1730 . 1 . 1 290 290 ILE CB C 13 36.468 0.00 . 1 . . . . . 494 ILE CB . 51188 1 1731 . 1 . 1 290 290 ILE CG1 C 13 26.209 0.00 . 1 . . . . . 494 ILE CG1 . 51188 1 1732 . 1 . 1 290 290 ILE CD1 C 13 14.104 0.01 . 1 . . . . . 494 ILE CD1 . 51188 1 1733 . 1 . 1 290 290 ILE N N 15 116.984 0.02 . 1 . . . . . 494 ILE N . 51188 1 1734 . 1 . 1 291 291 GLU H H 1 7.464 0.00 . 1 . . . . . 495 GLU H . 51188 1 1735 . 1 . 1 291 291 GLU C C 13 179.601 0.00 . 1 . . . . . 495 GLU C . 51188 1 1736 . 1 . 1 291 291 GLU CA C 13 56.225 2.47 . 1 . . . . . 495 GLU CA . 51188 1 1737 . 1 . 1 291 291 GLU CB C 13 28.335 0.00 . 1 . . . . . 495 GLU CB . 51188 1 1738 . 1 . 1 291 291 GLU N N 15 119.032 0.03 . 1 . . . . . 495 GLU N . 51188 1 1739 . 1 . 1 292 292 HIS H H 1 8.408 0.00 . 1 . . . . . 496 HIS H . 51188 1 1740 . 1 . 1 292 292 HIS C C 13 176.211 0.00 . 1 . . . . . 496 HIS C . 51188 1 1741 . 1 . 1 292 292 HIS CA C 13 55.051 2.30 . 1 . . . . . 496 HIS CA . 51188 1 1742 . 1 . 1 292 292 HIS CB C 13 29.574 0.00 . 1 . . . . . 496 HIS CB . 51188 1 1743 . 1 . 1 292 292 HIS N N 15 117.447 0.03 . 1 . . . . . 496 HIS N . 51188 1 1744 . 1 . 1 293 293 ASN H H 1 8.003 0.00 . 1 . . . . . 497 ASN H . 51188 1 1745 . 1 . 1 293 293 ASN C C 13 177.606 0.00 . 1 . . . . . 497 ASN C . 51188 1 1746 . 1 . 1 293 293 ASN CA C 13 53.258 0.04 . 1 . . . . . 497 ASN CA . 51188 1 1747 . 1 . 1 293 293 ASN CB C 13 39.422 0.00 . 1 . . . . . 497 ASN CB . 51188 1 1748 . 1 . 1 293 293 ASN N N 15 114.568 0.03 . 1 . . . . . 497 ASN N . 51188 1 1749 . 1 . 1 294 294 TYR H H 1 7.748 0.00 . 1 . . . . . 498 TYR H . 51188 1 1750 . 1 . 1 294 294 TYR C C 13 176.680 0.00 . 1 . . . . . 498 TYR C . 51188 1 1751 . 1 . 1 294 294 TYR CA C 13 55.939 0.01 . 1 . . . . . 498 TYR CA . 51188 1 1752 . 1 . 1 294 294 TYR CB C 13 35.999 0.00 . 1 . . . . . 498 TYR CB . 51188 1 1753 . 1 . 1 294 294 TYR N N 15 121.051 0.03 . 1 . . . . . 498 TYR N . 51188 1 1754 . 1 . 1 295 295 GLY H H 1 8.505 0.00 . 1 . . . . . 499 GLY H . 51188 1 1755 . 1 . 1 295 295 GLY C C 13 173.311 0.00 . 1 . . . . . 499 GLY C . 51188 1 1756 . 1 . 1 295 295 GLY CA C 13 44.180 0.02 . 1 . . . . . 499 GLY CA . 51188 1 1757 . 1 . 1 295 295 GLY N N 15 107.280 0.03 . 1 . . . . . 499 GLY N . 51188 1 1758 . 1 . 1 296 296 GLY H H 1 8.152 0.00 . 1 . . . . . 500 GLY H . 51188 1 1759 . 1 . 1 296 296 GLY C C 13 173.237 0.00 . 1 . . . . . 500 GLY C . 51188 1 1760 . 1 . 1 296 296 GLY CA C 13 45.289 0.03 . 1 . . . . . 500 GLY CA . 51188 1 1761 . 1 . 1 296 296 GLY N N 15 106.609 0.03 . 1 . . . . . 500 GLY N . 51188 1 1762 . 1 . 1 297 297 HIS H H 1 8.163 0.00 . 1 . . . . . 501 HIS H . 51188 1 1763 . 1 . 1 297 297 HIS C C 13 175.102 0.00 . 1 . . . . . 501 HIS C . 51188 1 1764 . 1 . 1 297 297 HIS CA C 13 56.088 0.01 . 1 . . . . . 501 HIS CA . 51188 1 1765 . 1 . 1 297 297 HIS CB C 13 30.852 0.00 . 1 . . . . . 501 HIS CB . 51188 1 1766 . 1 . 1 297 297 HIS N N 15 119.409 0.02 . 1 . . . . . 501 HIS N . 51188 1 1767 . 1 . 1 298 298 ASP H H 1 8.232 0.00 . 1 . . . . . 502 ASP H . 51188 1 1768 . 1 . 1 298 298 ASP C C 13 175.910 0.00 . 1 . . . . . 502 ASP C . 51188 1 1769 . 1 . 1 298 298 ASP CA C 13 54.446 0.01 . 1 . . . . . 502 ASP CA . 51188 1 1770 . 1 . 1 298 298 ASP CB C 13 41.445 0.00 . 1 . . . . . 502 ASP CB . 51188 1 1771 . 1 . 1 298 298 ASP N N 15 122.349 0.02 . 1 . . . . . 502 ASP N . 51188 1 1772 . 1 . 1 299 299 ASP H H 1 8.307 0.00 . 1 . . . . . 503 ASP H . 51188 1 1773 . 1 . 1 299 299 ASP C C 13 176.043 0.00 . 1 . . . . . 503 ASP C . 51188 1 1774 . 1 . 1 299 299 ASP CA C 13 54.467 0.02 . 1 . . . . . 503 ASP CA . 51188 1 1775 . 1 . 1 299 299 ASP CB C 13 40.862 0.00 . 1 . . . . . 503 ASP CB . 51188 1 1776 . 1 . 1 299 299 ASP N N 15 120.349 0.02 . 1 . . . . . 503 ASP N . 51188 1 1777 . 1 . 1 300 300 ASP H H 1 8.206 0.00 . 1 . . . . . 504 ASP H . 51188 1 1778 . 1 . 1 300 300 ASP C C 13 176.439 0.00 . 1 . . . . . 504 ASP C . 51188 1 1779 . 1 . 1 300 300 ASP CA C 13 54.506 0.00 . 1 . . . . . 504 ASP CA . 51188 1 1780 . 1 . 1 300 300 ASP CB C 13 41.042 0.00 . 1 . . . . . 504 ASP CB . 51188 1 1781 . 1 . 1 300 300 ASP N N 15 120.413 0.03 . 1 . . . . . 504 ASP N . 51188 1 1782 . 1 . 1 301 301 LEU H H 1 8.162 0.00 . 1 . . . . . 505 LEU H . 51188 1 1783 . 1 . 1 301 301 LEU HD11 H 1 0.867 0.00 . 1 . . . . . 505 LEU HD1 . 51188 1 1784 . 1 . 1 301 301 LEU HD12 H 1 0.867 0.00 . 1 . . . . . 505 LEU HD1 . 51188 1 1785 . 1 . 1 301 301 LEU HD13 H 1 0.867 0.00 . 1 . . . . . 505 LEU HD1 . 51188 1 1786 . 1 . 1 301 301 LEU HD21 H 1 0.793 0.00 . 1 . . . . . 505 LEU HD2 . 51188 1 1787 . 1 . 1 301 301 LEU HD22 H 1 0.793 0.00 . 1 . . . . . 505 LEU HD2 . 51188 1 1788 . 1 . 1 301 301 LEU HD23 H 1 0.793 0.00 . 1 . . . . . 505 LEU HD2 . 51188 1 1789 . 1 . 1 301 301 LEU C C 13 177.733 0.00 . 1 . . . . . 505 LEU C . 51188 1 1790 . 1 . 1 301 301 LEU CA C 13 55.316 0.04 . 1 . . . . . 505 LEU CA . 51188 1 1791 . 1 . 1 301 301 LEU CB C 13 40.956 0.00 . 1 . . . . . 505 LEU CB . 51188 1 1792 . 1 . 1 301 301 LEU CG C 13 26.420 0.05 . 1 . . . . . 505 LEU CG . 51188 1 1793 . 1 . 1 301 301 LEU CD1 C 13 25.221 0.01 . 2 . . . . . 505 LEU CD1 . 51188 1 1794 . 1 . 1 301 301 LEU CD2 C 13 23.293 0.01 . 2 . . . . . 505 LEU CD2 . 51188 1 1795 . 1 . 1 301 301 LEU N N 15 121.596 0.02 . 1 . . . . . 505 LEU N . 51188 1 1796 . 1 . 1 302 302 SER H H 1 8.267 0.00 . 1 . . . . . 506 SER H . 51188 1 1797 . 1 . 1 302 302 SER C C 13 175.157 0.00 . 1 . . . . . 506 SER C . 51188 1 1798 . 1 . 1 302 302 SER CA C 13 58.740 0.02 . 1 . . . . . 506 SER CA . 51188 1 1799 . 1 . 1 302 302 SER CB C 13 63.589 0.00 . 1 . . . . . 506 SER CB . 51188 1 1800 . 1 . 1 302 302 SER N N 15 116.099 0.03 . 1 . . . . . 506 SER N . 51188 1 1801 . 1 . 1 303 303 VAL H H 1 7.934 0.01 . 1 . . . . . 507 VAL H . 51188 1 1802 . 1 . 1 303 303 VAL HG11 H 1 0.833 0.00 . 1 . . . . . 507 VAL HG1 . 51188 1 1803 . 1 . 1 303 303 VAL HG12 H 1 0.833 0.00 . 1 . . . . . 507 VAL HG1 . 51188 1 1804 . 1 . 1 303 303 VAL HG13 H 1 0.833 0.00 . 1 . . . . . 507 VAL HG1 . 51188 1 1805 . 1 . 1 303 303 VAL HG21 H 1 0.821 0.00 . 1 . . . . . 507 VAL HG2 . 51188 1 1806 . 1 . 1 303 303 VAL HG22 H 1 0.821 0.00 . 1 . . . . . 507 VAL HG2 . 51188 1 1807 . 1 . 1 303 303 VAL HG23 H 1 0.821 0.00 . 1 . . . . . 507 VAL HG2 . 51188 1 1808 . 1 . 1 303 303 VAL C C 13 176.491 0.01 . 1 . . . . . 507 VAL C . 51188 1 1809 . 1 . 1 303 303 VAL CA C 13 62.576 0.08 . 1 . . . . . 507 VAL CA . 51188 1 1810 . 1 . 1 303 303 VAL CB C 13 31.830 0.00 . 1 . . . . . 507 VAL CB . 51188 1 1811 . 1 . 1 303 303 VAL CG1 C 13 21.162 0.02 . 2 . . . . . 507 VAL CG1 . 51188 1 1812 . 1 . 1 303 303 VAL CG2 C 13 20.723 0.02 . 2 . . . . . 507 VAL CG2 . 51188 1 1813 . 1 . 1 303 303 VAL N N 15 120.766 0.04 . 1 . . . . . 507 VAL N . 51188 1 1814 . 1 . 1 304 304 ARG H H 1 8.136 0.00 . 1 . . . . . 508 ARG H . 51188 1 1815 . 1 . 1 304 304 ARG CA C 13 56.497 0.00 . 1 . . . . . 508 ARG CA . 51188 1 1816 . 1 . 1 304 304 ARG CB C 13 29.751 0.00 . 1 . . . . . 508 ARG CB . 51188 1 1817 . 1 . 1 304 304 ARG N N 15 122.981 0.02 . 1 . . . . . 508 ARG N . 51188 1 1818 . 1 . 1 306 306 CYS C C 13 174.124 0.00 . 1 . . . . . 510 CYS C . 51188 1 1819 . 1 . 1 306 306 CYS CA C 13 57.529 0.00 . 1 . . . . . 510 CYS CA . 51188 1 1820 . 1 . 1 307 307 THR H H 1 7.839 0.00 . 1 . . . . . 511 THR H . 51188 1 1821 . 1 . 1 307 307 THR C C 13 173.615 0.00 . 1 . . . . . 511 THR C . 51188 1 1822 . 1 . 1 307 307 THR CA C 13 61.573 0.02 . 1 . . . . . 511 THR CA . 51188 1 1823 . 1 . 1 307 307 THR CB C 13 69.585 0.00 . 1 . . . . . 511 THR CB . 51188 1 1824 . 1 . 1 307 307 THR N N 15 120.510 0.02 . 1 . . . . . 511 THR N . 51188 1 1825 . 1 . 1 308 308 ASN H H 1 8.545 0.00 . 1 . . . . . 512 ASN H . 51188 1 1826 . 1 . 1 308 308 ASN C C 13 174.339 0.00 . 1 . . . . . 512 ASN C . 51188 1 1827 . 1 . 1 308 308 ASN CA C 13 51.602 0.02 . 1 . . . . . 512 ASN CA . 51188 1 1828 . 1 . 1 308 308 ASN CB C 13 41.019 0.00 . 1 . . . . . 512 ASN CB . 51188 1 1829 . 1 . 1 308 308 ASN N N 15 117.242 0.02 . 1 . . . . . 512 ASN N . 51188 1 1830 . 1 . 1 309 309 ALA H H 1 7.596 0.00 . 1 . . . . . 513 ALA H . 51188 1 1831 . 1 . 1 309 309 ALA C C 13 176.152 0.00 . 1 . . . . . 513 ALA C . 51188 1 1832 . 1 . 1 309 309 ALA CA C 13 51.946 0.03 . 1 . . . . . 513 ALA CA . 51188 1 1833 . 1 . 1 309 309 ALA CB C 13 20.492 0.00 . 1 . . . . . 513 ALA CB . 51188 1 1834 . 1 . 1 309 309 ALA N N 15 120.481 0.02 . 1 . . . . . 513 ALA N . 51188 1 1835 . 1 . 1 310 310 TYR H H 1 8.792 0.00 . 1 . . . . . 514 TYR H . 51188 1 1836 . 1 . 1 310 310 TYR C C 13 173.749 0.00 . 1 . . . . . 514 TYR C . 51188 1 1837 . 1 . 1 310 310 TYR CA C 13 57.013 0.00 . 1 . . . . . 514 TYR CA . 51188 1 1838 . 1 . 1 310 310 TYR CB C 13 38.886 0.00 . 1 . . . . . 514 TYR CB . 51188 1 1839 . 1 . 1 310 310 TYR N N 15 114.192 0.02 . 1 . . . . . 514 TYR N . 51188 1 1840 . 1 . 1 311 311 MET H H 1 7.202 0.01 . 1 . . . . . 515 MET H . 51188 1 1841 . 1 . 1 311 311 MET C C 13 171.848 0.00 . 1 . . . . . 515 MET C . 51188 1 1842 . 1 . 1 311 311 MET CA C 13 55.483 0.00 . 1 . . . . . 515 MET CA . 51188 1 1843 . 1 . 1 311 311 MET CB C 13 33.353 0.00 . 1 . . . . . 515 MET CB . 51188 1 1844 . 1 . 1 311 311 MET N N 15 124.245 0.03 . 1 . . . . . 515 MET N . 51188 1 1845 . 1 . 1 312 312 LEU H H 1 9.130 0.01 . 1 . . . . . 516 LEU H . 51188 1 1846 . 1 . 1 312 312 LEU HD11 H 1 0.715 0.00 . 1 . . . . . 516 LEU HD1 . 51188 1 1847 . 1 . 1 312 312 LEU HD12 H 1 0.715 0.00 . 1 . . . . . 516 LEU HD1 . 51188 1 1848 . 1 . 1 312 312 LEU HD13 H 1 0.715 0.00 . 1 . . . . . 516 LEU HD1 . 51188 1 1849 . 1 . 1 312 312 LEU HD21 H 1 0.119 0.00 . 1 . . . . . 516 LEU HD2 . 51188 1 1850 . 1 . 1 312 312 LEU HD22 H 1 0.119 0.00 . 1 . . . . . 516 LEU HD2 . 51188 1 1851 . 1 . 1 312 312 LEU HD23 H 1 0.119 0.00 . 1 . . . . . 516 LEU HD2 . 51188 1 1852 . 1 . 1 312 312 LEU C C 13 174.948 0.05 . 1 . . . . . 516 LEU C . 51188 1 1853 . 1 . 1 312 312 LEU CA C 13 52.191 0.08 . 1 . . . . . 516 LEU CA . 51188 1 1854 . 1 . 1 312 312 LEU CB C 13 45.368 0.03 . 1 . . . . . 516 LEU CB . 51188 1 1855 . 1 . 1 312 312 LEU CG C 13 26.381 0.06 . 1 . . . . . 516 LEU CG . 51188 1 1856 . 1 . 1 312 312 LEU CD1 C 13 27.839 0.02 . 2 . . . . . 516 LEU CD1 . 51188 1 1857 . 1 . 1 312 312 LEU CD2 C 13 23.062 0.01 . 2 . . . . . 516 LEU CD2 . 51188 1 1858 . 1 . 1 312 312 LEU N N 15 126.393 0.02 . 1 . . . . . 516 LEU N . 51188 1 1859 . 1 . 1 313 313 VAL H H 1 8.499 0.00 . 1 . . . . . 517 VAL H . 51188 1 1860 . 1 . 1 313 313 VAL HG11 H 1 1.198 0.00 . 1 . . . . . 517 VAL HG1 . 51188 1 1861 . 1 . 1 313 313 VAL HG12 H 1 1.198 0.00 . 1 . . . . . 517 VAL HG1 . 51188 1 1862 . 1 . 1 313 313 VAL HG13 H 1 1.198 0.00 . 1 . . . . . 517 VAL HG1 . 51188 1 1863 . 1 . 1 313 313 VAL HG21 H 1 0.732 0.00 . 1 . . . . . 517 VAL HG2 . 51188 1 1864 . 1 . 1 313 313 VAL HG22 H 1 0.732 0.00 . 1 . . . . . 517 VAL HG2 . 51188 1 1865 . 1 . 1 313 313 VAL HG23 H 1 0.732 0.00 . 1 . . . . . 517 VAL HG2 . 51188 1 1866 . 1 . 1 313 313 VAL C C 13 175.498 0.03 . 1 . . . . . 517 VAL C . 51188 1 1867 . 1 . 1 313 313 VAL CA C 13 60.977 0.09 . 1 . . . . . 517 VAL CA . 51188 1 1868 . 1 . 1 313 313 VAL CB C 13 33.506 0.02 . 1 . . . . . 517 VAL CB . 51188 1 1869 . 1 . 1 313 313 VAL CG1 C 13 21.651 0.01 . 2 . . . . . 517 VAL CG1 . 51188 1 1870 . 1 . 1 313 313 VAL CG2 C 13 20.650 0.00 . 2 . . . . . 517 VAL CG2 . 51188 1 1871 . 1 . 1 313 313 VAL N N 15 119.707 0.02 . 1 . . . . . 517 VAL N . 51188 1 1872 . 1 . 1 314 314 TYR H H 1 9.201 0.00 . 1 . . . . . 518 TYR H . 51188 1 1873 . 1 . 1 314 314 TYR C C 13 174.358 0.00 . 1 . . . . . 518 TYR C . 51188 1 1874 . 1 . 1 314 314 TYR CA C 13 56.282 0.00 . 1 . . . . . 518 TYR CA . 51188 1 1875 . 1 . 1 314 314 TYR N N 15 127.261 0.03 . 1 . . . . . 518 TYR N . 51188 1 1876 . 1 . 1 315 315 ILE H H 1 9.563 0.00 . 1 . . . . . 519 ILE H . 51188 1 1877 . 1 . 1 315 315 ILE HD11 H 1 0.214 0.00 . 1 . . . . . 519 ILE HD1 . 51188 1 1878 . 1 . 1 315 315 ILE HD12 H 1 0.214 0.00 . 1 . . . . . 519 ILE HD1 . 51188 1 1879 . 1 . 1 315 315 ILE HD13 H 1 0.214 0.00 . 1 . . . . . 519 ILE HD1 . 51188 1 1880 . 1 . 1 315 315 ILE C C 13 175.473 0.04 . 1 . . . . . 519 ILE C . 51188 1 1881 . 1 . 1 315 315 ILE CA C 13 58.878 0.06 . 1 . . . . . 519 ILE CA . 51188 1 1882 . 1 . 1 315 315 ILE CB C 13 40.526 0.01 . 1 . . . . . 519 ILE CB . 51188 1 1883 . 1 . 1 315 315 ILE CG1 C 13 27.870 0.00 . 1 . . . . . 519 ILE CG1 . 51188 1 1884 . 1 . 1 315 315 ILE CD1 C 13 12.932 0.01 . 1 . . . . . 519 ILE CD1 . 51188 1 1885 . 1 . 1 315 315 ILE N N 15 120.029 0.03 . 1 . . . . . 519 ILE N . 51188 1 1886 . 1 . 1 316 316 ARG H H 1 9.262 0.00 . 1 . . . . . 520 ARG H . 51188 1 1887 . 1 . 1 316 316 ARG C C 13 177.828 0.00 . 1 . . . . . 520 ARG C . 51188 1 1888 . 1 . 1 316 316 ARG CA C 13 56.643 0.03 . 1 . . . . . 520 ARG CA . 51188 1 1889 . 1 . 1 316 316 ARG CB C 13 30.477 0.00 . 1 . . . . . 520 ARG CB . 51188 1 1890 . 1 . 1 316 316 ARG N N 15 132.497 0.03 . 1 . . . . . 520 ARG N . 51188 1 1891 . 1 . 1 317 317 GLU H H 1 9.182 0.00 . 1 . . . . . 521 GLU H . 51188 1 1892 . 1 . 1 317 317 GLU C C 13 179.083 0.00 . 1 . . . . . 521 GLU C . 51188 1 1893 . 1 . 1 317 317 GLU CA C 13 60.719 0.00 . 1 . . . . . 521 GLU CA . 51188 1 1894 . 1 . 1 317 317 GLU CB C 13 29.109 0.00 . 1 . . . . . 521 GLU CB . 51188 1 1895 . 1 . 1 317 317 GLU N N 15 130.692 0.02 . 1 . . . . . 521 GLU N . 51188 1 1896 . 1 . 1 318 318 SER H H 1 8.375 0.00 . 1 . . . . . 522 SER H . 51188 1 1897 . 1 . 1 318 318 SER C C 13 175.729 0.00 . 1 . . . . . 522 SER C . 51188 1 1898 . 1 . 1 318 318 SER CA C 13 59.093 0.19 . 1 . . . . . 522 SER CA . 51188 1 1899 . 1 . 1 318 318 SER CB C 13 61.803 0.00 . 1 . . . . . 522 SER CB . 51188 1 1900 . 1 . 1 318 318 SER N N 15 112.439 0.03 . 1 . . . . . 522 SER N . 51188 1 1901 . 1 . 1 319 319 LYS H H 1 7.510 0.00 . 1 . . . . . 523 LYS H . 51188 1 1902 . 1 . 1 319 319 LYS C C 13 176.604 0.00 . 1 . . . . . 523 LYS C . 51188 1 1903 . 1 . 1 319 319 LYS CA C 13 53.339 0.00 . 1 . . . . . 523 LYS CA . 51188 1 1904 . 1 . 1 319 319 LYS CB C 13 31.857 0.00 . 1 . . . . . 523 LYS CB . 51188 1 1905 . 1 . 1 319 319 LYS N N 15 118.996 0.03 . 1 . . . . . 523 LYS N . 51188 1 1906 . 1 . 1 320 320 LEU H H 1 7.387 0.00 . 1 . . . . . 524 LEU H . 51188 1 1907 . 1 . 1 320 320 LEU HD11 H 1 0.870 0.00 . 1 . . . . . 524 LEU HD1 . 51188 1 1908 . 1 . 1 320 320 LEU HD12 H 1 0.870 0.00 . 1 . . . . . 524 LEU HD1 . 51188 1 1909 . 1 . 1 320 320 LEU HD13 H 1 0.870 0.00 . 1 . . . . . 524 LEU HD1 . 51188 1 1910 . 1 . 1 320 320 LEU HD21 H 1 0.831 0.00 . 1 . . . . . 524 LEU HD2 . 51188 1 1911 . 1 . 1 320 320 LEU HD22 H 1 0.831 0.00 . 1 . . . . . 524 LEU HD2 . 51188 1 1912 . 1 . 1 320 320 LEU HD23 H 1 0.831 0.00 . 1 . . . . . 524 LEU HD2 . 51188 1 1913 . 1 . 1 320 320 LEU C C 13 177.771 0.01 . 1 . . . . . 524 LEU C . 51188 1 1914 . 1 . 1 320 320 LEU CA C 13 59.706 0.05 . 1 . . . . . 524 LEU CA . 51188 1 1915 . 1 . 1 320 320 LEU CB C 13 42.543 0.00 . 1 . . . . . 524 LEU CB . 51188 1 1916 . 1 . 1 320 320 LEU CG C 13 26.135 0.08 . 1 . . . . . 524 LEU CG . 51188 1 1917 . 1 . 1 320 320 LEU CD1 C 13 26.093 0.01 . 2 . . . . . 524 LEU CD1 . 51188 1 1918 . 1 . 1 320 320 LEU CD2 C 13 25.032 0.01 . 2 . . . . . 524 LEU CD2 . 51188 1 1919 . 1 . 1 320 320 LEU N N 15 125.121 0.02 . 1 . . . . . 524 LEU N . 51188 1 1920 . 1 . 1 321 321 SER H H 1 8.482 0.00 . 1 . . . . . 525 SER H . 51188 1 1921 . 1 . 1 321 321 SER C C 13 175.440 0.00 . 1 . . . . . 525 SER C . 51188 1 1922 . 1 . 1 321 321 SER CA C 13 60.574 0.02 . 1 . . . . . 525 SER CA . 51188 1 1923 . 1 . 1 321 321 SER CB C 13 62.041 0.00 . 1 . . . . . 525 SER CB . 51188 1 1924 . 1 . 1 321 321 SER N N 15 111.148 0.03 . 1 . . . . . 525 SER N . 51188 1 1925 . 1 . 1 322 322 GLU H H 1 7.353 0.00 . 1 . . . . . 526 GLU H . 51188 1 1926 . 1 . 1 322 322 GLU C C 13 178.852 0.00 . 1 . . . . . 526 GLU C . 51188 1 1927 . 1 . 1 322 322 GLU CA C 13 57.968 0.02 . 1 . . . . . 526 GLU CA . 51188 1 1928 . 1 . 1 322 322 GLU CB C 13 30.385 0.00 . 1 . . . . . 526 GLU CB . 51188 1 1929 . 1 . 1 322 322 GLU N N 15 121.589 0.03 . 1 . . . . . 526 GLU N . 51188 1 1930 . 1 . 1 323 323 VAL H H 1 8.594 0.00 . 1 . . . . . 527 VAL H . 51188 1 1931 . 1 . 1 323 323 VAL HG11 H 1 0.868 0.00 . 1 . . . . . 527 VAL HG1 . 51188 1 1932 . 1 . 1 323 323 VAL HG12 H 1 0.868 0.00 . 1 . . . . . 527 VAL HG1 . 51188 1 1933 . 1 . 1 323 323 VAL HG13 H 1 0.868 0.00 . 1 . . . . . 527 VAL HG1 . 51188 1 1934 . 1 . 1 323 323 VAL HG21 H 1 0.788 0.00 . 1 . . . . . 527 VAL HG2 . 51188 1 1935 . 1 . 1 323 323 VAL HG22 H 1 0.788 0.00 . 1 . . . . . 527 VAL HG2 . 51188 1 1936 . 1 . 1 323 323 VAL HG23 H 1 0.788 0.00 . 1 . . . . . 527 VAL HG2 . 51188 1 1937 . 1 . 1 323 323 VAL C C 13 177.014 0.02 . 1 . . . . . 527 VAL C . 51188 1 1938 . 1 . 1 323 323 VAL CA C 13 65.917 0.08 . 1 . . . . . 527 VAL CA . 51188 1 1939 . 1 . 1 323 323 VAL CB C 13 31.720 0.12 . 1 . . . . . 527 VAL CB . 51188 1 1940 . 1 . 1 323 323 VAL CG1 C 13 23.056 0.00 . 2 . . . . . 527 VAL CG1 . 51188 1 1941 . 1 . 1 323 323 VAL CG2 C 13 22.487 0.00 . 2 . . . . . 527 VAL CG2 . 51188 1 1942 . 1 . 1 323 323 VAL N N 15 121.158 0.03 . 1 . . . . . 527 VAL N . 51188 1 1943 . 1 . 1 324 324 LEU H H 1 7.937 0.00 . 1 . . . . . 528 LEU H . 51188 1 1944 . 1 . 1 324 324 LEU HD11 H 1 0.602 0.01 . 1 . . . . . 528 LEU HD1 . 51188 1 1945 . 1 . 1 324 324 LEU HD12 H 1 0.602 0.01 . 1 . . . . . 528 LEU HD1 . 51188 1 1946 . 1 . 1 324 324 LEU HD13 H 1 0.602 0.01 . 1 . . . . . 528 LEU HD1 . 51188 1 1947 . 1 . 1 324 324 LEU HD21 H 1 0.751 0.00 . 1 . . . . . 528 LEU HD2 . 51188 1 1948 . 1 . 1 324 324 LEU HD22 H 1 0.751 0.00 . 1 . . . . . 528 LEU HD2 . 51188 1 1949 . 1 . 1 324 324 LEU HD23 H 1 0.751 0.00 . 1 . . . . . 528 LEU HD2 . 51188 1 1950 . 1 . 1 324 324 LEU C C 13 175.743 0.01 . 1 . . . . . 528 LEU C . 51188 1 1951 . 1 . 1 324 324 LEU CA C 13 52.769 0.06 . 1 . . . . . 528 LEU CA . 51188 1 1952 . 1 . 1 324 324 LEU CB C 13 38.032 0.03 . 1 . . . . . 528 LEU CB . 51188 1 1953 . 1 . 1 324 324 LEU CG C 13 26.042 0.00 . 1 . . . . . 528 LEU CG . 51188 1 1954 . 1 . 1 324 324 LEU CD1 C 13 25.156 0.01 . 2 . . . . . 528 LEU CD1 . 51188 1 1955 . 1 . 1 324 324 LEU CD2 C 13 22.842 0.01 . 2 . . . . . 528 LEU CD2 . 51188 1 1956 . 1 . 1 324 324 LEU N N 15 114.034 0.03 . 1 . . . . . 528 LEU N . 51188 1 1957 . 1 . 1 325 325 GLN H H 1 6.551 0.00 . 1 . . . . . 529 GLN H . 51188 1 1958 . 1 . 1 325 325 GLN C C 13 174.357 0.00 . 1 . . . . . 529 GLN C . 51188 1 1959 . 1 . 1 325 325 GLN CA C 13 55.501 0.01 . 1 . . . . . 529 GLN CA . 51188 1 1960 . 1 . 1 325 325 GLN CB C 13 29.806 0.00 . 1 . . . . . 529 GLN CB . 51188 1 1961 . 1 . 1 325 325 GLN N N 15 119.511 0.02 . 1 . . . . . 529 GLN N . 51188 1 1962 . 1 . 1 326 326 ALA H H 1 8.379 0.00 . 1 . . . . . 530 ALA H . 51188 1 1963 . 1 . 1 326 326 ALA C C 13 177.485 0.00 . 1 . . . . . 530 ALA C . 51188 1 1964 . 1 . 1 326 326 ALA CA C 13 52.943 0.00 . 1 . . . . . 530 ALA CA . 51188 1 1965 . 1 . 1 326 326 ALA CB C 13 18.184 0.00 . 1 . . . . . 530 ALA CB . 51188 1 1966 . 1 . 1 326 326 ALA N N 15 125.119 0.02 . 1 . . . . . 530 ALA N . 51188 1 1967 . 1 . 1 327 327 VAL H H 1 8.297 0.00 . 1 . . . . . 531 VAL H . 51188 1 1968 . 1 . 1 327 327 VAL HG11 H 1 1.149 0.00 . 1 . . . . . 531 VAL HG1 . 51188 1 1969 . 1 . 1 327 327 VAL HG12 H 1 1.149 0.00 . 1 . . . . . 531 VAL HG1 . 51188 1 1970 . 1 . 1 327 327 VAL HG13 H 1 1.149 0.00 . 1 . . . . . 531 VAL HG1 . 51188 1 1971 . 1 . 1 327 327 VAL HG21 H 1 0.825 0.00 . 1 . . . . . 531 VAL HG2 . 51188 1 1972 . 1 . 1 327 327 VAL HG22 H 1 0.825 0.00 . 1 . . . . . 531 VAL HG2 . 51188 1 1973 . 1 . 1 327 327 VAL HG23 H 1 0.825 0.00 . 1 . . . . . 531 VAL HG2 . 51188 1 1974 . 1 . 1 327 327 VAL C C 13 175.916 0.02 . 1 . . . . . 531 VAL C . 51188 1 1975 . 1 . 1 327 327 VAL CA C 13 60.839 0.05 . 1 . . . . . 531 VAL CA . 51188 1 1976 . 1 . 1 327 327 VAL CB C 13 32.726 0.01 . 1 . . . . . 531 VAL CB . 51188 1 1977 . 1 . 1 327 327 VAL CG1 C 13 22.402 0.01 . 2 . . . . . 531 VAL CG1 . 51188 1 1978 . 1 . 1 327 327 VAL CG2 C 13 22.107 0.02 . 2 . . . . . 531 VAL CG2 . 51188 1 1979 . 1 . 1 327 327 VAL N N 15 122.440 0.02 . 1 . . . . . 531 VAL N . 51188 1 1980 . 1 . 1 328 328 THR H H 1 9.462 0.00 . 1 . . . . . 532 THR H . 51188 1 1981 . 1 . 1 328 328 THR CA C 13 59.911 0.00 . 1 . . . . . 532 THR CA . 51188 1 1982 . 1 . 1 328 328 THR CB C 13 71.875 0.00 . 1 . . . . . 532 THR CB . 51188 1 1983 . 1 . 1 328 328 THR N N 15 119.980 0.02 . 1 . . . . . 532 THR N . 51188 1 1984 . 1 . 1 329 329 ASP CA C 13 58.415 0.00 . 1 . . . . . 533 ASP CA . 51188 1 1985 . 1 . 1 329 329 ASP CB C 13 39.544 0.00 . 1 . . . . . 533 ASP CB . 51188 1 1986 . 1 . 1 330 330 HIS H H 1 8.871 0.00 . 1 . . . . . 534 HIS H . 51188 1 1987 . 1 . 1 330 330 HIS C C 13 175.992 0.00 . 1 . . . . . 534 HIS C . 51188 1 1988 . 1 . 1 330 330 HIS CA C 13 57.286 0.00 . 1 . . . . . 534 HIS CA . 51188 1 1989 . 1 . 1 330 330 HIS CB C 13 29.666 0.00 . 1 . . . . . 534 HIS CB . 51188 1 1990 . 1 . 1 330 330 HIS N N 15 129.593 0.00 . 1 . . . . . 534 HIS N . 51188 1 1991 . 1 . 1 331 331 ASP H H 1 7.463 0.00 . 1 . . . . . 535 ASP H . 51188 1 1992 . 1 . 1 331 331 ASP C C 13 174.421 0.00 . 1 . . . . . 535 ASP C . 51188 1 1993 . 1 . 1 331 331 ASP CA C 13 55.291 0.01 . 1 . . . . . 535 ASP CA . 51188 1 1994 . 1 . 1 331 331 ASP CB C 13 41.932 0.00 . 1 . . . . . 535 ASP CB . 51188 1 1995 . 1 . 1 331 331 ASP N N 15 117.260 0.03 . 1 . . . . . 535 ASP N . 51188 1 1996 . 1 . 1 332 332 ILE H H 1 7.004 0.00 . 1 . . . . . 536 ILE H . 51188 1 1997 . 1 . 1 332 332 ILE HD11 H 1 0.607 0.00 . 1 . . . . . 536 ILE HD1 . 51188 1 1998 . 1 . 1 332 332 ILE HD12 H 1 0.607 0.00 . 1 . . . . . 536 ILE HD1 . 51188 1 1999 . 1 . 1 332 332 ILE HD13 H 1 0.607 0.00 . 1 . . . . . 536 ILE HD1 . 51188 1 2000 . 1 . 1 332 332 ILE C C 13 173.556 0.00 . 1 . . . . . 536 ILE C . 51188 1 2001 . 1 . 1 332 332 ILE CA C 13 58.561 0.04 . 1 . . . . . 536 ILE CA . 51188 1 2002 . 1 . 1 332 332 ILE CB C 13 37.243 0.00 . 1 . . . . . 536 ILE CB . 51188 1 2003 . 1 . 1 332 332 ILE CG1 C 13 26.442 0.00 . 1 . . . . . 536 ILE CG1 . 51188 1 2004 . 1 . 1 332 332 ILE CD1 C 13 14.443 0.02 . 1 . . . . . 536 ILE CD1 . 51188 1 2005 . 1 . 1 332 332 ILE N N 15 119.974 0.02 . 1 . . . . . 536 ILE N . 51188 1 2006 . 1 . 1 333 333 PRO C C 13 177.960 0.00 . 1 . . . . . 537 PRO C . 51188 1 2007 . 1 . 1 333 333 PRO CA C 13 63.212 0.00 . 1 . . . . . 537 PRO CA . 51188 1 2008 . 1 . 1 333 333 PRO CB C 13 32.123 0.00 . 1 . . . . . 537 PRO CB . 51188 1 2009 . 1 . 1 334 334 GLN H H 1 8.851 0.01 . 1 . . . . . 538 GLN H . 51188 1 2010 . 1 . 1 334 334 GLN C C 13 177.718 0.00 . 1 . . . . . 538 GLN C . 51188 1 2011 . 1 . 1 334 334 GLN CA C 13 58.511 0.11 . 1 . . . . . 538 GLN CA . 51188 1 2012 . 1 . 1 334 334 GLN CB C 13 27.333 0.00 . 1 . . . . . 538 GLN CB . 51188 1 2013 . 1 . 1 334 334 GLN N N 15 126.091 0.09 . 1 . . . . . 538 GLN N . 51188 1 2014 . 1 . 1 335 335 GLN H H 1 8.987 0.00 . 1 . . . . . 539 GLN H . 51188 1 2015 . 1 . 1 335 335 GLN C C 13 178.597 0.00 . 1 . . . . . 539 GLN C . 51188 1 2016 . 1 . 1 335 335 GLN CA C 13 58.680 0.01 . 1 . . . . . 539 GLN CA . 51188 1 2017 . 1 . 1 335 335 GLN CB C 13 26.800 0.00 . 1 . . . . . 539 GLN CB . 51188 1 2018 . 1 . 1 335 335 GLN N N 15 116.416 0.03 . 1 . . . . . 539 GLN N . 51188 1 2019 . 1 . 1 336 336 LEU H H 1 7.039 0.00 . 1 . . . . . 540 LEU H . 51188 1 2020 . 1 . 1 336 336 LEU HD11 H 1 0.745 0.00 . 1 . . . . . 540 LEU HD1 . 51188 1 2021 . 1 . 1 336 336 LEU HD12 H 1 0.745 0.00 . 1 . . . . . 540 LEU HD1 . 51188 1 2022 . 1 . 1 336 336 LEU HD13 H 1 0.745 0.00 . 1 . . . . . 540 LEU HD1 . 51188 1 2023 . 1 . 1 336 336 LEU C C 13 177.350 0.01 . 1 . . . . . 540 LEU C . 51188 1 2024 . 1 . 1 336 336 LEU CA C 13 56.964 0.05 . 1 . . . . . 540 LEU CA . 51188 1 2025 . 1 . 1 336 336 LEU CB C 13 40.456 0.01 . 1 . . . . . 540 LEU CB . 51188 1 2026 . 1 . 1 336 336 LEU CG C 13 26.656 0.00 . 1 . . . . . 540 LEU CG . 51188 1 2027 . 1 . 1 336 336 LEU CD1 C 13 22.828 0.01 . 2 . . . . . 540 LEU CD1 . 51188 1 2028 . 1 . 1 336 336 LEU N N 15 121.537 0.02 . 1 . . . . . 540 LEU N . 51188 1 2029 . 1 . 1 337 337 VAL H H 1 7.150 0.00 . 1 . . . . . 541 VAL H . 51188 1 2030 . 1 . 1 337 337 VAL HG11 H 1 0.780 0.00 . 1 . . . . . 541 VAL HG1 . 51188 1 2031 . 1 . 1 337 337 VAL HG12 H 1 0.780 0.00 . 1 . . . . . 541 VAL HG1 . 51188 1 2032 . 1 . 1 337 337 VAL HG13 H 1 0.780 0.00 . 1 . . . . . 541 VAL HG1 . 51188 1 2033 . 1 . 1 337 337 VAL HG21 H 1 0.847 0.00 . 1 . . . . . 541 VAL HG2 . 51188 1 2034 . 1 . 1 337 337 VAL HG22 H 1 0.847 0.00 . 1 . . . . . 541 VAL HG2 . 51188 1 2035 . 1 . 1 337 337 VAL HG23 H 1 0.847 0.00 . 1 . . . . . 541 VAL HG2 . 51188 1 2036 . 1 . 1 337 337 VAL C C 13 178.353 0.00 . 1 . . . . . 541 VAL C . 51188 1 2037 . 1 . 1 337 337 VAL CA C 13 66.813 0.07 . 1 . . . . . 541 VAL CA . 51188 1 2038 . 1 . 1 337 337 VAL CB C 13 31.106 0.01 . 1 . . . . . 541 VAL CB . 51188 1 2039 . 1 . 1 337 337 VAL CG1 C 13 21.105 0.02 . 2 . . . . . 541 VAL CG1 . 51188 1 2040 . 1 . 1 337 337 VAL CG2 C 13 22.901 0.01 . 2 . . . . . 541 VAL CG2 . 51188 1 2041 . 1 . 1 337 337 VAL N N 15 119.151 0.02 . 1 . . . . . 541 VAL N . 51188 1 2042 . 1 . 1 338 338 GLU H H 1 8.276 0.01 . 1 . . . . . 542 GLU H . 51188 1 2043 . 1 . 1 338 338 GLU C C 13 179.341 0.00 . 1 . . . . . 542 GLU C . 51188 1 2044 . 1 . 1 338 338 GLU CA C 13 59.076 0.05 . 1 . . . . . 542 GLU CA . 51188 1 2045 . 1 . 1 338 338 GLU CB C 13 28.738 0.00 . 1 . . . . . 542 GLU CB . 51188 1 2046 . 1 . 1 338 338 GLU N N 15 116.760 0.03 . 1 . . . . . 542 GLU N . 51188 1 2047 . 1 . 1 339 339 ARG H H 1 7.496 0.00 . 1 . . . . . 543 ARG H . 51188 1 2048 . 1 . 1 339 339 ARG C C 13 179.483 0.00 . 1 . . . . . 543 ARG C . 51188 1 2049 . 1 . 1 339 339 ARG CA C 13 59.189 0.03 . 1 . . . . . 543 ARG CA . 51188 1 2050 . 1 . 1 339 339 ARG CB C 13 29.369 0.00 . 1 . . . . . 543 ARG CB . 51188 1 2051 . 1 . 1 339 339 ARG N N 15 120.768 0.02 . 1 . . . . . 543 ARG N . 51188 1 2052 . 1 . 1 340 340 LEU H H 1 8.203 0.00 . 1 . . . . . 544 LEU H . 51188 1 2053 . 1 . 1 340 340 LEU HD11 H 1 0.628 0.00 . 1 . . . . . 544 LEU HD1 . 51188 1 2054 . 1 . 1 340 340 LEU HD12 H 1 0.628 0.00 . 1 . . . . . 544 LEU HD1 . 51188 1 2055 . 1 . 1 340 340 LEU HD13 H 1 0.628 0.00 . 1 . . . . . 544 LEU HD1 . 51188 1 2056 . 1 . 1 340 340 LEU C C 13 180.670 0.00 . 1 . . . . . 544 LEU C . 51188 1 2057 . 1 . 1 340 340 LEU CA C 13 57.243 0.04 . 1 . . . . . 544 LEU CA . 51188 1 2058 . 1 . 1 340 340 LEU CB C 13 39.081 0.02 . 1 . . . . . 544 LEU CB . 51188 1 2059 . 1 . 1 340 340 LEU CG C 13 25.514 0.00 . 1 . . . . . 544 LEU CG . 51188 1 2060 . 1 . 1 340 340 LEU CD1 C 13 21.331 0.01 . 2 . . . . . 544 LEU CD1 . 51188 1 2061 . 1 . 1 340 340 LEU N N 15 119.385 0.02 . 1 . . . . . 544 LEU N . 51188 1 2062 . 1 . 1 342 342 GLU H H 1 8.332 0.00 . 1 . . . . . 546 GLU H . 51188 1 2063 . 1 . 1 342 342 GLU C C 13 180.683 0.00 . 1 . . . . . 546 GLU C . 51188 1 2064 . 1 . 1 342 342 GLU CA C 13 57.178 0.07 . 1 . . . . . 546 GLU CA . 51188 1 2065 . 1 . 1 342 342 GLU CB C 13 34.252 0.00 . 1 . . . . . 546 GLU CB . 51188 1 2066 . 1 . 1 342 342 GLU N N 15 120.538 0.03 . 1 . . . . . 546 GLU N . 51188 1 2067 . 1 . 1 343 343 GLU H H 1 8.516 0.00 . 1 . . . . . 547 GLU H . 51188 1 2068 . 1 . 1 343 343 GLU C C 13 179.297 0.00 . 1 . . . . . 547 GLU C . 51188 1 2069 . 1 . 1 343 343 GLU CA C 13 58.588 0.01 . 1 . . . . . 547 GLU CA . 51188 1 2070 . 1 . 1 343 343 GLU CB C 13 27.626 0.00 . 1 . . . . . 547 GLU CB . 51188 1 2071 . 1 . 1 343 343 GLU N N 15 119.715 0.02 . 1 . . . . . 547 GLU N . 51188 1 2072 . 1 . 1 344 344 LYS H H 1 8.088 0.00 . 1 . . . . . 548 LYS H . 51188 1 2073 . 1 . 1 344 344 LYS C C 13 178.292 0.00 . 1 . . . . . 548 LYS C . 51188 1 2074 . 1 . 1 344 344 LYS CA C 13 58.565 0.03 . 1 . . . . . 548 LYS CA . 51188 1 2075 . 1 . 1 344 344 LYS CB C 13 28.688 0.00 . 1 . . . . . 548 LYS CB . 51188 1 2076 . 1 . 1 344 344 LYS N N 15 122.916 0.02 . 1 . . . . . 548 LYS N . 51188 1 2077 . 1 . 1 345 345 ARG H H 1 7.828 0.00 . 1 . . . . . 549 ARG H . 51188 1 2078 . 1 . 1 345 345 ARG C C 13 179.302 0.00 . 1 . . . . . 549 ARG C . 51188 1 2079 . 1 . 1 345 345 ARG CA C 13 59.253 0.01 . 1 . . . . . 549 ARG CA . 51188 1 2080 . 1 . 1 345 345 ARG CB C 13 29.451 0.00 . 1 . . . . . 549 ARG CB . 51188 1 2081 . 1 . 1 345 345 ARG N N 15 118.535 0.02 . 1 . . . . . 549 ARG N . 51188 1 2082 . 1 . 1 346 346 ILE H H 1 8.193 0.00 . 1 . . . . . 550 ILE H . 51188 1 2083 . 1 . 1 346 346 ILE HD11 H 1 0.817 0.00 . 1 . . . . . 550 ILE HD1 . 51188 1 2084 . 1 . 1 346 346 ILE HD12 H 1 0.817 0.00 . 1 . . . . . 550 ILE HD1 . 51188 1 2085 . 1 . 1 346 346 ILE HD13 H 1 0.817 0.00 . 1 . . . . . 550 ILE HD1 . 51188 1 2086 . 1 . 1 346 346 ILE C C 13 179.024 0.00 . 1 . . . . . 550 ILE C . 51188 1 2087 . 1 . 1 346 346 ILE CA C 13 63.727 0.05 . 1 . . . . . 550 ILE CA . 51188 1 2088 . 1 . 1 346 346 ILE CB C 13 37.102 0.01 . 1 . . . . . 550 ILE CB . 51188 1 2089 . 1 . 1 346 346 ILE CG1 C 13 28.088 0.00 . 1 . . . . . 550 ILE CG1 . 51188 1 2090 . 1 . 1 346 346 ILE CD1 C 13 12.874 0.01 . 1 . . . . . 550 ILE CD1 . 51188 1 2091 . 1 . 1 346 346 ILE N N 15 120.720 0.02 . 1 . . . . . 550 ILE N . 51188 1 2092 . 1 . 1 347 347 GLU H H 1 7.954 0.00 . 1 . . . . . 551 GLU H . 51188 1 2093 . 1 . 1 347 347 GLU C C 13 178.665 0.00 . 1 . . . . . 551 GLU C . 51188 1 2094 . 1 . 1 347 347 GLU CA C 13 58.748 0.01 . 1 . . . . . 551 GLU CA . 51188 1 2095 . 1 . 1 347 347 GLU CB C 13 28.900 0.00 . 1 . . . . . 551 GLU CB . 51188 1 2096 . 1 . 1 347 347 GLU N N 15 120.535 0.02 . 1 . . . . . 551 GLU N . 51188 1 2097 . 1 . 1 348 348 ALA H H 1 7.797 0.00 . 1 . . . . . 552 ALA H . 51188 1 2098 . 1 . 1 348 348 ALA C C 13 179.545 0.00 . 1 . . . . . 552 ALA C . 51188 1 2099 . 1 . 1 348 348 ALA CA C 13 53.945 0.00 . 1 . . . . . 552 ALA CA . 51188 1 2100 . 1 . 1 348 348 ALA CB C 13 17.741 0.00 . 1 . . . . . 552 ALA CB . 51188 1 2101 . 1 . 1 348 348 ALA N N 15 121.161 0.02 . 1 . . . . . 552 ALA N . 51188 1 2102 . 1 . 1 349 349 GLN H H 1 7.755 0.00 . 1 . . . . . 553 GLN H . 51188 1 2103 . 1 . 1 349 349 GLN C C 13 177.479 0.00 . 1 . . . . . 553 GLN C . 51188 1 2104 . 1 . 1 349 349 GLN CA C 13 57.191 0.03 . 1 . . . . . 553 GLN CA . 51188 1 2105 . 1 . 1 349 349 GLN CB C 13 28.062 0.00 . 1 . . . . . 553 GLN CB . 51188 1 2106 . 1 . 1 349 349 GLN N N 15 118.170 0.02 . 1 . . . . . 553 GLN N . 51188 1 2107 . 1 . 1 350 350 LYS H H 1 7.886 0.00 . 1 . . . . . 554 LYS H . 51188 1 2108 . 1 . 1 350 350 LYS C C 13 177.659 0.00 . 1 . . . . . 554 LYS C . 51188 1 2109 . 1 . 1 350 350 LYS CA C 13 57.150 0.06 . 1 . . . . . 554 LYS CA . 51188 1 2110 . 1 . 1 350 350 LYS CB C 13 31.794 0.00 . 1 . . . . . 554 LYS CB . 51188 1 2111 . 1 . 1 350 350 LYS N N 15 120.039 0.02 . 1 . . . . . 554 LYS N . 51188 1 2112 . 1 . 1 351 351 ARG H H 1 7.852 0.00 . 1 . . . . . 555 ARG H . 51188 1 2113 . 1 . 1 351 351 ARG C C 13 176.993 0.00 . 1 . . . . . 555 ARG C . 51188 1 2114 . 1 . 1 351 351 ARG CA C 13 56.713 0.00 . 1 . . . . . 555 ARG CA . 51188 1 2115 . 1 . 1 351 351 ARG CB C 13 29.896 0.00 . 1 . . . . . 555 ARG CB . 51188 1 2116 . 1 . 1 351 351 ARG N N 15 120.374 0.03 . 1 . . . . . 555 ARG N . 51188 1 2117 . 1 . 1 352 352 LYS H H 1 7.961 0.00 . 1 . . . . . 556 LYS H . 51188 1 2118 . 1 . 1 352 352 LYS C C 13 177.135 0.00 . 1 . . . . . 556 LYS C . 51188 1 2119 . 1 . 1 352 352 LYS CA C 13 56.658 0.00 . 1 . . . . . 556 LYS CA . 51188 1 2120 . 1 . 1 352 352 LYS CB C 13 32.026 0.00 . 1 . . . . . 556 LYS CB . 51188 1 2121 . 1 . 1 352 352 LYS N N 15 121.514 0.03 . 1 . . . . . 556 LYS N . 51188 1 2122 . 1 . 1 353 353 GLU H H 1 8.131 0.00 . 1 . . . . . 557 GLU H . 51188 1 2123 . 1 . 1 353 353 GLU C C 13 176.508 0.00 . 1 . . . . . 557 GLU C . 51188 1 2124 . 1 . 1 353 353 GLU CA C 13 56.643 0.01 . 1 . . . . . 557 GLU CA . 51188 1 2125 . 1 . 1 353 353 GLU CB C 13 29.785 0.00 . 1 . . . . . 557 GLU CB . 51188 1 2126 . 1 . 1 353 353 GLU N N 15 120.924 0.02 . 1 . . . . . 557 GLU N . 51188 1 2127 . 1 . 1 354 354 ARG H H 1 8.050 0.00 . 1 . . . . . 558 ARG H . 51188 1 2128 . 1 . 1 354 354 ARG C C 13 175.880 0.00 . 1 . . . . . 558 ARG C . 51188 1 2129 . 1 . 1 354 354 ARG CA C 13 55.844 0.04 . 1 . . . . . 558 ARG CA . 51188 1 2130 . 1 . 1 354 354 ARG CB C 13 30.117 0.00 . 1 . . . . . 558 ARG CB . 51188 1 2131 . 1 . 1 354 354 ARG N N 15 120.819 0.03 . 1 . . . . . 558 ARG N . 51188 1 2132 . 1 . 1 355 355 GLN H H 1 8.284 0.00 . 1 . . . . . 559 GLN H . 51188 1 2133 . 1 . 1 355 355 GLN C C 13 174.954 0.00 . 1 . . . . . 559 GLN C . 51188 1 2134 . 1 . 1 355 355 GLN CA C 13 55.472 0.06 . 1 . . . . . 559 GLN CA . 51188 1 2135 . 1 . 1 355 355 GLN CB C 13 28.902 0.00 . 1 . . . . . 559 GLN CB . 51188 1 2136 . 1 . 1 355 355 GLN N N 15 122.337 0.03 . 1 . . . . . 559 GLN N . 51188 1 2137 . 1 . 1 356 356 GLU H H 1 7.948 0.00 . 1 . . . . . 560 GLU H . 51188 1 2138 . 1 . 1 356 356 GLU CA C 13 57.687 0.00 . 1 . . . . . 560 GLU CA . 51188 1 2139 . 1 . 1 356 356 GLU CB C 13 30.503 0.00 . 1 . . . . . 560 GLU CB . 51188 1 2140 . 1 . 1 356 356 GLU N N 15 127.874 0.02 . 1 . . . . . 560 GLU N . 51188 1 stop_ save_ ######################### # Spectral peak lists # ######################### save_spectral_peak_list_1 _Spectral_peak_list.Sf_category spectral_peak_list _Spectral_peak_list.Sf_framecode spectral_peak_list_1 _Spectral_peak_list.Entry_ID 51188 _Spectral_peak_list.ID 1 _Spectral_peak_list.Name . _Spectral_peak_list.Sample_ID 1 _Spectral_peak_list.Sample_label $sample_1 _Spectral_peak_list.Sample_condition_list_ID 1 _Spectral_peak_list.Sample_condition_list_label $sample_conditions_1 _Spectral_peak_list.Chem_shift_reference_ID 1 _Spectral_peak_list.Chem_shift_reference_label $chem_shift_reference_1 _Spectral_peak_list.Experiment_ID 1 _Spectral_peak_list.Experiment_name '2D 1H-15N TROSY' _Spectral_peak_list.Experiment_class . _Spectral_peak_list.Experiment_type . _Spectral_peak_list.Number_of_spectral_dimensions 2 _Spectral_peak_list.Chemical_shift_list . _Spectral_peak_list.Assigned_chem_shift_list_ID 1 _Spectral_peak_list.Assigned_chem_shift_list_label $assigned_chemical_shifts_1 _Spectral_peak_list.Details . _Spectral_peak_list.Text_data_format text _Spectral_peak_list.Text_data ; Assignment w1 w2 G212N-H 107.137 8.405 Y213N-H 121.648 7.797 G215N-H 110.250 8.469 L216N-H 119.385 6.745 S227N-H 116.303 8.401 L228N-H 123.803 7.875 L229N-H 119.346 8.781 Q230N-H 115.068 7.652 T231N-H 113.776 7.096 L232N-H 119.216 8.109 F233N-H 121.817 8.416 F234N-H 113.943 7.639 T235N-H 116.842 7.417 N236N-H 125.966 7.135 Q237N-H 117.719 9.009 L238N-H 117.122 7.206 R239N-H 122.132 7.577 K240N-H 114.420 8.194 A241N-H 120.869 7.109 V242N-H 118.986 8.569 Y243N-H 120.285 7.993 M244N-H 114.304 7.399 M245N-H 118.541 7.243 T247N-H 114.479 7.939 E248N-H 124.904 9.082 G249N-H 108.814 8.621 D250N-H 122.414 7.814 D251N-H 122.174 8.543 S252N-H 116.302 8.310 S253N-H 115.667 8.553 K254N-H 119.046 7.830 S255N-H 111.951 7.284 V256N-H 131.969 9.095 L258N-H 118.250 7.911 A259N-H 121.156 7.951 L260N-H 120.548 8.403 Q261N-H 117.967 7.852 R262N-H 118.036 8.493 V263N-H 117.922 7.707 F264N-H 118.404 8.542 Y265N-H 120.663 9.297 E266N-H 121.182 8.778 L267N-H 122.964 8.874 Q268N-H 117.908 8.070 H269N-H 115.005 7.579 S270N-H 116.894 9.280 D271N-H 121.858 8.412 K272N-H 121.911 8.052 V274N-H 126.803 8.279 G275N-H 114.073 8.760 T276N-H 115.423 8.276 K277N-H 117.875 7.374 K278N-H 122.315 7.897 L279N-H 120.344 7.278 T280N-H 112.610 8.229 K281N-H 119.974 7.512 S282N-H 116.175 7.332 F283N-H 115.817 6.836 G284N-H 108.662 7.473 W285N-H 122.967 6.867 E286N-H 117.814 8.181 T287N-H 109.555 7.677 D289N-H 116.766 8.221 F291N-H 119.577 7.713 M292N-H 117.714 8.066 Q293N-H 116.297 7.331 H294N-H 116.697 7.080 D295N-H 119.359 8.088 V296N-H 119.707 8.065 Q297N-H 123.074 8.207 E298N-H 121.930 8.064 L299N-H 119.547 7.737 C300N-H 118.696 8.303 R301N-H 117.547 7.812 V302N-H 119.201 7.766 L303N-H 119.154 7.800 L304N-H 116.463 8.654 D305N-H 120.864 8.921 N306N-H 116.912 7.220 V307N-H 115.606 7.733 E308N-H 123.311 8.917 N309N-H 117.192 7.879 K310N-H 120.970 7.452 M311N-H 114.429 7.659 K312N-H 124.654 7.423 G313N-H 113.590 9.724 T314N-H 109.120 7.611 V316N-H 112.326 7.801 E317N-H 125.849 7.471 G318N-H 109.774 8.358 T319N-H 120.341 7.888 I320N-H 119.044 8.896 K322N-H 116.569 7.563 L323N-H 116.585 7.510 F324N-H 110.937 7.788 R325N-H 115.880 7.652 G326N-H 115.538 8.060 K327N-H 117.921 7.704 M328N-H 125.158 9.720 V329N-H 120.230 9.137 S330N-H 123.031 8.761 Y331N-H 124.841 8.870 I332N-H 120.016 8.425 Q333N-H 125.344 9.305 C334N-H 125.629 8.699 K335N-H 121.498 8.056 E336N-H 116.702 9.606 V337N-H 110.865 6.898 D338N-H 122.423 8.375 Y339N-H 125.037 7.549 R340N-H 128.856 7.762 S341N-H 118.300 8.802 D342N-H 125.957 8.486 R343N-H 122.368 8.775 R344N-H 127.087 8.806 E345N-H 123.319 8.856 D346N-H 123.680 8.585 Y347N-H 118.314 8.223 Y348N-H 119.418 9.116 D349N-H 118.590 8.264 I350N-H 118.049 8.000 Q351N-H 126.665 8.321 L352N-H 124.232 8.757 S353N-H 118.592 8.690 I354N-H 119.237 8.555 K355N-H 123.919 7.476 G356N-H 118.123 9.863 K357N-H 121.413 8.342 K358N-H 119.459 8.972 N359N-H 110.260 7.128 I360N-H 117.019 7.015 F361N-H 123.862 7.883 E362N-H 117.613 8.064 S363N-H 115.178 7.805 F364N-H 124.550 8.231 V365N-H 119.415 8.301 D366N-H 118.227 7.544 Y367N-H 122.945 8.048 V368N-H 106.867 7.563 A369N-H 127.479 7.335 V370N-H 121.067 8.295 E371N-H 128.062 9.302 Q372N-H 122.843 8.669 L373N-H 128.099 8.908 D374N-H 121.197 7.694 G375N-H 109.188 8.926 D376N-H 120.704 8.293 N377N-H 119.315 8.426 K378N-H 116.640 6.771 Y379N-H 121.677 8.150 D380N-H 127.131 7.781 A381N-H 131.313 7.748 G382N-H 108.320 7.733 E383N-H 120.593 8.336 H384N-H 116.880 7.449 G385N-H 109.352 7.698 L386N-H 120.392 8.013 Q387N-H 123.326 9.405 E388N-H 122.443 9.066 A389N-H 127.571 9.155 E390N-H 119.377 8.632 K391N-H 123.960 8.798 G392N-H 110.203 7.174 V393N-H 117.904 7.725 K394N-H 121.583 8.859 F395N-H 119.701 8.169 L396N-H 123.756 9.193 T397N-H 109.224 8.594 L398N-H 124.283 8.416 V401N-H 115.068 7.942 L402N-H 127.525 9.299 H403N-H 128.527 9.550 L404N-H 121.617 8.803 Q405N-H 122.866 9.042 L406N-H 123.387 8.408 M407N-H 123.671 8.125 R408N-H 123.746 8.433 F409N-H 117.339 8.201 M410N-H 120.796 8.542 Y411N-H 123.725 8.569 D412N-H 128.877 8.206 Q414N-H 116.252 7.913 T415N-H 106.334 6.983 D416N-H 122.414 7.997 Q417N-H 114.239 7.086 N418N-H 120.991 8.659 I419N-H 120.845 8.985 K420N-H 123.735 8.176 I421N-H 127.523 9.158 N422N-H 126.939 8.983 D423N-H 117.154 7.130 R424N-H 122.548 8.662 F425N-H 129.924 9.305 E426N-H 126.082 7.457 F427N-H 115.658 5.708 E429N-H 119.763 8.885 Q430N-H 116.190 7.762 L431N-H 127.206 9.416 L433N-H 123.694 8.851 D434N-H 121.612 8.097 E435N-H 114.656 8.198 F436N-H 117.640 7.617 L437N-H 119.314 7.226 Q438N-H 121.331 8.582 K439N-H 117.496 7.844 T440N-H 118.069 8.396 D441N-H 121.670 8.830 K443N-H 115.132 8.092 D444N-H 117.843 7.475 A446N-H 130.678 9.254 N447N-H 121.563 7.634 Y448N-H 125.482 8.616 I449N-H 123.421 9.630 L450N-H 129.667 8.873 V453N-H 120.285 9.286 H456N-H 127.857 8.868 S457N-H 121.701 8.031 G458N-H 112.093 7.921 D459N-H 120.656 8.325 N460N-H 116.308 8.345 H461N-H 119.663 8.266 G462N-H 110.395 8.229 G463N-H 110.521 8.370 H464N-H 119.905 8.083 Y465N-H 127.875 8.659 V467N-H 118.924 7.916 Y468N-H 127.613 9.141 L469N-H 124.543 9.366 N470N-H 119.262 7.103 K472N-H 113.257 8.451 G473N-H 109.227 8.234 D474N-H 116.156 7.799 G475N-H 110.628 8.923 K476N-H 121.271 7.158 W477N-H 125.931 8.844 C478N-H 117.823 9.368 K479N-H 125.197 9.315 F480N-H 126.338 9.239 D481N-H 129.155 8.815 D482N-H 119.365 8.264 D483N-H 121.429 9.257 V484N-H 123.638 8.016 V485N-H 131.190 8.361 S486N-H 120.598 8.740 R487N-H 124.061 8.825 C488N-H 119.973 8.486 T489N-H 111.326 8.507 K490N-H 121.408 8.663 E491N-H 117.861 8.247 E492N-H 116.154 6.835 A493N-H 116.273 6.300 I494N-H 117.037 7.123 E495N-H 119.098 7.470 H496N-H 117.516 8.412 N497N-H 114.623 8.009 Y498N-H 121.117 7.752 G499N-H 107.339 8.510 G500N-H 106.665 8.157 H501N-H 119.451 8.171 D502N-H 122.408 8.238 D503N-H 120.411 8.313 D504N-H 120.488 8.210 L505N-H 121.646 8.166 S506N-H 116.180 8.271 V507N-H 120.856 7.937 R508N-H 123.032 8.140 T511N-H 120.567 7.844 N512N-H 117.294 8.549 A513N-H 120.542 7.600 Y514N-H 114.249 8.795 M515N-H 124.289 7.207 L516N-H 126.438 9.136 V517N-H 119.768 8.502 Y518N-H 127.314 9.207 I519N-H 120.085 9.566 R520N-H 132.561 9.266 E521N-H 130.752 9.187 S522N-H 112.501 8.380 K523N-H 119.060 7.517 L524N-H 125.173 7.391 S525N-H 111.223 8.486 E526N-H 121.655 7.356 V527N-H 121.226 8.596 L528N-H 114.111 7.940 Q529N-H 119.570 6.556 A530N-H 125.172 8.384 V531N-H 122.481 8.301 T532N-H 120.027 9.466 D535N-H 117.329 7.466 I536N-H 120.032 7.009 Q538N-H 126.186 8.858 Q539N-H 116.485 8.991 L540N-H 121.594 7.042 V541N-H 119.212 7.153 E542N-H 116.808 8.284 R543N-H 120.830 7.501 L544N-H 119.445 8.207 E546N-H 120.593 8.336 E547N-H 119.773 8.518 K548N-H 122.978 8.092 R549N-H 118.594 7.832 I550N-H 120.779 8.198 E551N-H 120.598 7.959 A552N-H 121.219 7.802 Q553N-H 118.227 7.759 K554N-H 120.102 7.890 R555N-H 120.401 7.861 K556N-H 121.530 7.966 E557N-H 120.972 8.135 R558N-H 120.885 8.055 Q559N-H 122.404 8.291 E560N-H 127.929 7.953 ; loop_ _Spectral_dim.ID _Spectral_dim.Axis_code _Spectral_dim.Spectrometer_frequency _Spectral_dim.Atom_type _Spectral_dim.Atom_isotope_number _Spectral_dim.Spectral_region _Spectral_dim.Magnetization_linkage_ID _Spectral_dim.Under_sampling_type _Spectral_dim.Sweep_width _Spectral_dim.Sweep_width_units _Spectral_dim.Value_first_point _Spectral_dim.Absolute_peak_positions _Spectral_dim.Acquisition _Spectral_dim.Center_frequency_offset _Spectral_dim.Encoding_code _Spectral_dim.Encoded_reduced_dimension_ID _Spectral_dim.Entry_ID _Spectral_dim.Spectral_peak_list_ID 1 . . N 15 NH . . . ppm . . . . . . 51188 1 2 . . HN 1 HN . . . ppm . . . . . . 51188 1 stop_ loop_ _Spectral_peak_software.Software_ID _Spectral_peak_software.Software_label _Spectral_peak_software.Method_ID _Spectral_peak_software.Method_label _Spectral_peak_software.Entry_ID _Spectral_peak_software.Spectral_peak_list_ID 2 $software_2 . . 51188 1 stop_ save_ save_spectral_peak_list_2 _Spectral_peak_list.Sf_category spectral_peak_list _Spectral_peak_list.Sf_framecode spectral_peak_list_2 _Spectral_peak_list.Entry_ID 51188 _Spectral_peak_list.ID 2 _Spectral_peak_list.Name . _Spectral_peak_list.Sample_ID 1 _Spectral_peak_list.Sample_label $sample_1 _Spectral_peak_list.Sample_condition_list_ID 1 _Spectral_peak_list.Sample_condition_list_label $sample_conditions_1 _Spectral_peak_list.Chem_shift_reference_ID 1 _Spectral_peak_list.Chem_shift_reference_label $chem_shift_reference_1 _Spectral_peak_list.Experiment_ID 2 _Spectral_peak_list.Experiment_name '2D 1H-13C TROSY-HMQC' _Spectral_peak_list.Experiment_class . _Spectral_peak_list.Experiment_type . _Spectral_peak_list.Number_of_spectral_dimensions 2 _Spectral_peak_list.Chemical_shift_list . _Spectral_peak_list.Assigned_chem_shift_list_ID 1 _Spectral_peak_list.Assigned_chem_shift_list_label $assigned_chemical_shifts_1 _Spectral_peak_list.Details . _Spectral_peak_list.Text_data_format text _Spectral_peak_list.Text_data ; Assignment w1 w2 V214CG1-HG1 21.933 0.946 V214CG2-HG2 21.934 0.899 L216CD1-HD1 24.472 0.649 L216CD2-HD2 29.409 0.878 L228CD1-HD1 21.703 0.757 L228CD2-HD2 25.737 0.754 L229CD1-HD1 22.090 0.673 L232CD1-HD1 20.822 0.852 L238CD1-HD1 24.530 0.955 V242CG1-HG1 22.989 0.954 V242CG2-HG2 20.631 0.436 V256CG1-HG1 21.439 0.695 V256CG2-HG2 22.574 0.953 L258CD1-HD1 23.031 0.905 L260CD1-HD1 25.315 0.401 L260CD2-HD2 24.573 0.375 V263CG1-HG1 23.997 1.116 V263CG2-HG2 21.950 0.954 L267CD1-HD1 22.510 0.450 V274CG1-HG1 23.591 1.011 V274CG2-HG2 21.982 1.143 L279CD1-HD1 28.732 0.949 L279CD2-HD2 23.917 0.782 L288CD1-HD1 25.209 0.934 L288CD2-HD2 24.323 0.948 V296CG1-HG1 21.037 1.141 V296CG2-HG2 23.197 0.968 L299CD1-HD1 22.073 -0.114 V302CG1-HG1 21.497 0.710 V302CG2-HG2 24.400 0.924 L303CD1-HD1 22.683 0.326 L303CD2-HD2 25.368 0.463 L304CD1-HD1 21.622 0.446 L304CD2-HD2 26.153 0.299 V307CG1-HG1 21.547 0.937 V307CG2-HG2 23.169 0.920 V316CG1-HG1 23.153 1.050 V316CG2-HG2 18.923 0.900 I320CD1-HD1 13.718 0.900 L323CD1-HD1 26.761 0.479 L323CD2-HD2 23.432 0.524 V329CG1-HG1 20.186 0.971 V329CG2-HG2 22.342 0.962 I332CD1-HD1 13.770 0.542 V337CG1-HG1 19.138 0.431 V337CG2-HG2 21.153 0.710 I350CD1-HD1 13.518 0.263 L352CD1-HD1 27.040 0.428 L352CD2-HD2 21.232 -0.147 I354CD1-HD1 14.091 0.293 I360CD1-HD1 15.361 0.932 V365CG1-HG1 23.824 1.149 V365CG2-HG2 21.447 1.053 V368CG1-HG1 19.099 1.459 V368CG2-HG2 22.211 1.350 V370CG1-HG1 22.134 0.905 V370CG2-HG2 21.057 1.017 L373CD1-HD1 26.620 0.795 L373CD2-HD2 23.567 0.808 L386CD1-HD1 22.663 0.586 L386CD2-HD2 25.338 0.807 V393CG1-HG1 21.182 0.734 V393CG2-HG2 21.599 0.695 L396CD1-HD1 23.466 0.832 L396CD2-HD2 25.421 0.851 L398CD1-HD1 29.098 0.631 L398CD2-HD2 23.549 0.340 V401CG1-HG1 23.205 0.924 V401CG2-HG2 22.609 0.560 L402CD1-HD1 25.518 0.136 L402CD2-HD2 23.731 0.481 L404CD1-HD1 27.529 0.850 L404CD2-HD2 25.209 0.733 L406CD1-HD1 24.229 0.704 L406CD2-HD2 22.885 0.536 I419CD1-HD1 13.986 0.754 I421CD1-HD1 13.389 0.808 L431CD1-HD1 25.068 -0.165 L431CD2-HD2 24.122 0.383 L433CD1-HD1 21.728 -0.202 L433CD2-HD2 26.220 -0.060 L437CD1-HD1 27.700 1.081 L437CD2-HD2 23.643 0.764 I449CD1-HD1 12.369 0.845 L450CD1-HD1 27.407 1.011 L450CD2-HD2 21.010 0.405 V453CG1-HG1 21.454 0.953 L454CD1-HD1 26.185 0.959 L454CD2-HD2 24.419 0.769 V455CG1-HG1 23.206 1.044 V455CG2-HG2 21.941 0.929 V466CG1-HG1 22.090 0.732 V466CG2-HG2 20.628 0.690 V467CG1-HG1 21.109 1.175 V467CG2-HG2 22.861 0.967 L469CD1-HD1 27.553 0.217 L469CD2-HD2 26.546 0.357 V484CG1-HG1 21.398 0.938 V484CG2-HG2 21.370 0.863 V485CG1-HG1 20.620 -0.005 V485CG2-HG2 20.893 0.508 I494CD1-HD1 14.084 0.595 L505CD1-HD1 25.206 0.872 L505CD2-HD2 23.265 0.797 V507CG1-HG1 21.131 0.837 V507CG2-HG2 20.732 0.829 L516CD1-HD1 27.805 0.718 L516CD2-HD2 23.049 0.124 V517CG1-HG1 21.640 1.199 V517CG2-HG2 20.653 0.730 I519CD1-HD1 12.915 0.219 L524CD1-HD1 26.082 0.874 L524CD2-HD2 25.020 0.835 V527CG1-HG1 23.049 0.871 V527CG2-HG2 22.484 0.792 L528CD1-HD1 25.152 0.607 L528CD2-HD2 22.834 0.751 V531CG1-HG1 22.395 1.148 V531CG2-HG2 22.132 0.830 I536CD1-HD1 14.396 0.607 L540CD1-HD1 22.834 0.751 V541CG1-HG1 21.086 0.779 V541CG2-HG2 22.887 0.849 L544CD1-HD1 21.325 0.632 I550CD1-HD1 12.867 0.820 ; loop_ _Spectral_dim.ID _Spectral_dim.Axis_code _Spectral_dim.Spectrometer_frequency _Spectral_dim.Atom_type _Spectral_dim.Atom_isotope_number _Spectral_dim.Spectral_region _Spectral_dim.Magnetization_linkage_ID _Spectral_dim.Under_sampling_type _Spectral_dim.Sweep_width _Spectral_dim.Sweep_width_units _Spectral_dim.Value_first_point _Spectral_dim.Absolute_peak_positions _Spectral_dim.Acquisition _Spectral_dim.Center_frequency_offset _Spectral_dim.Encoding_code _Spectral_dim.Encoded_reduced_dimension_ID _Spectral_dim.Entry_ID _Spectral_dim.Spectral_peak_list_ID 1 . . C 13 C . . . ppm . . . . . . 51188 2 2 . . HN 1 HN . . . ppm . . . . . . 51188 2 stop_ loop_ _Spectral_peak_software.Software_ID _Spectral_peak_software.Software_label _Spectral_peak_software.Method_ID _Spectral_peak_software.Method_label _Spectral_peak_software.Entry_ID _Spectral_peak_software.Spectral_peak_list_ID 2 $software_2 . . 51188 2 stop_ save_ save_spectral_peak_list_3 _Spectral_peak_list.Sf_category spectral_peak_list _Spectral_peak_list.Sf_framecode spectral_peak_list_3 _Spectral_peak_list.Entry_ID 51188 _Spectral_peak_list.ID 3 _Spectral_peak_list.Name . _Spectral_peak_list.Sample_ID 1 _Spectral_peak_list.Sample_label $sample_1 _Spectral_peak_list.Sample_condition_list_ID 1 _Spectral_peak_list.Sample_condition_list_label $sample_conditions_1 _Spectral_peak_list.Chem_shift_reference_ID 1 _Spectral_peak_list.Chem_shift_reference_label $chem_shift_reference_1 _Spectral_peak_list.Experiment_ID 3 _Spectral_peak_list.Experiment_name HMCMCGCBCACO _Spectral_peak_list.Experiment_class . _Spectral_peak_list.Experiment_type . _Spectral_peak_list.Number_of_spectral_dimensions 3 _Spectral_peak_list.Chemical_shift_list . _Spectral_peak_list.Assigned_chem_shift_list_ID 1 _Spectral_peak_list.Assigned_chem_shift_list_label $assigned_chemical_shifts_1 _Spectral_peak_list.Details . _Spectral_peak_list.Text_data_format text _Spectral_peak_list.Text_data ; Assignment w1 w2 w3 V214CG1-C-HG1 21.915 174.779 0.947 V214CG2-C-HG2 21.915 174.861 0.895 L228CD1-C-HD1 21.735 178.124 0.755 L228CD2-C-HD2 25.732 177.996 0.745 L229CD1-C-HD1 22.106 179.172 0.673 L232CD1-C-HD1 20.862 178.298 0.852 L238CD1-C-HD1 24.556 176.709 0.954 V242CG1-C-HG1 23.060 179.626 0.959 V256CG1-C-HG1 21.498 174.742 0.678 V256CG2-C-HG2 22.535 174.664 0.936 L258CD1-C-HD1 23.061 178.105 0.909 L260CD1-C-HD1 25.378 177.894 0.398 L260CD2-C-HD2 24.572 177.906 0.373 V263CG2-C-HG2 21.911 177.832 0.958 L267CD1-C-HD1 22.550 179.066 0.445 L279CD1-C-HD1 28.716 178.366 0.947 L279CD2-C-HD2 23.935 178.334 0.779 L288CD1-C-HD1 25.198 178.567 0.926 L299CD1-C-HD1 22.112 176.934 -0.086 L303CD1-C-HD1 22.749 178.297 0.333 L304CD1-C-HD1 21.640 179.082 0.447 I320CD1-C-HD1 13.736 175.915 0.898 L323CD2-C-HD2 23.481 176.720 0.524 V329CG1-C-HG1 20.207 173.274 0.972 V329CG2-C-HG2 22.363 173.266 0.961 I332CD1-C-HD1 13.801 174.977 0.539 V337CG1-C-HG1 19.148 174.703 0.415 I350CD1-C-HD1 13.544 174.213 0.262 L352CD1-C-HD1 27.056 175.725 0.426 L352CD2-C-HD2 21.226 175.730 -0.153 I354CD1-C-HD1 14.130 176.178 0.293 I360CD1-C-HD1 15.380 175.794 0.931 V365CG1-C-HG1 23.848 178.861 1.153 V365CG2-C-HG2 21.446 178.854 1.052 V370CG1-C-HG1 22.170 176.604 0.903 V370CG2-C-HG2 21.073 176.600 1.016 L373CD1-C-HD1 26.664 174.155 0.793 L373CD2-C-HD2 23.583 174.147 0.806 L386CD1-C-HD1 22.658 178.618 0.580 L386CD2-C-HD2 25.356 178.612 0.806 V393CG1-C-HG1 21.196 176.123 0.731 L396CD1-C-HD1 23.462 178.135 0.831 L398CD1-C-HD1 29.164 174.192 0.629 L398CD2-C-HD2 23.539 174.185 0.338 L402CD1-C-HD1 25.516 175.167 0.137 L402CD2-C-HD2 23.757 175.180 0.477 L404CD1-C-HD1 27.547 175.989 0.850 L406CD1-C-HD1 24.263 178.166 0.703 I419CD1-C-HD1 14.013 174.418 0.753 I421CD1-C-HD1 13.424 176.226 0.807 L431CD1-C-HD1 25.049 173.118 -0.171 L431CD2-C-HD2 24.135 173.105 0.383 L433CD1-C-HD1 21.728 177.376 -0.207 L437CD1-C-HD1 27.727 178.373 1.079 L437CD2-C-HD2 23.672 178.418 0.761 I449CD1-C-HD1 12.386 176.330 0.842 L450CD1-C-HD1 27.457 174.377 1.016 L450CD2-C-HD2 21.027 174.400 0.405 L454CD1-C-HD1 26.222 175.549 0.955 L454CD2-C-HD2 24.425 175.487 0.767 V455CG1-C-HG1 23.188 175.262 1.048 V455CG2-C-HG2 21.933 175.063 0.937 V466CG1-C-HG1 22.138 172.778 0.720 V466CG2-C-HG2 20.570 172.684 0.678 V467CG1-C-HG1 21.067 171.120 1.176 V467CG2-C-HG2 22.892 171.397 0.964 L469CD1-C-HD1 27.584 175.569 0.217 L469CD2-C-HD2 26.590 175.560 0.353 V485CG1-C-HG1 20.669 175.743 -0.009 V485CG2-C-HG2 20.885 175.859 0.504 I494CD1-C-HD1 14.117 175.402 0.596 L505CD1-C-HD1 25.223 177.731 0.869 L505CD2-C-HD2 23.302 177.737 0.795 V507CG1-C-HG1 21.168 176.487 0.834 V507CG2-C-HG2 20.709 176.488 0.820 L516CD2-C-HD2 23.080 174.899 0.120 V517CG1-C-HG1 21.657 175.457 1.202 V517CG2-C-HG2 20.645 175.517 0.738 I519CD1-C-HD1 12.943 175.437 0.217 L524CD1-C-HD1 26.103 177.778 0.872 L524CD2-C-HD2 25.034 177.769 0.833 V527CG1-C-HG1 23.059 177.030 0.869 L528CD1-C-HD1 25.160 175.736 0.607 L528CD2-C-HD2 22.844 175.744 0.753 V531CG1-C-HG1 22.387 175.894 1.152 V531CG2-C-HG2 22.105 175.924 0.829 I536CD1-C-HD1 14.462 173.556 0.612 L540CD1-C-HD1 22.840 177.363 0.747 V541CG1-C-HG1 21.138 178.351 0.784 L544CD1-C-HD1 21.348 180.670 0.631 I550CD1-C-HD1 12.881 179.026 0.819 ; loop_ _Spectral_dim.ID _Spectral_dim.Axis_code _Spectral_dim.Spectrometer_frequency _Spectral_dim.Atom_type _Spectral_dim.Atom_isotope_number _Spectral_dim.Spectral_region _Spectral_dim.Magnetization_linkage_ID _Spectral_dim.Under_sampling_type _Spectral_dim.Sweep_width _Spectral_dim.Sweep_width_units _Spectral_dim.Value_first_point _Spectral_dim.Absolute_peak_positions _Spectral_dim.Acquisition _Spectral_dim.Center_frequency_offset _Spectral_dim.Encoding_code _Spectral_dim.Encoded_reduced_dimension_ID _Spectral_dim.Entry_ID _Spectral_dim.Spectral_peak_list_ID 1 . . CO 13 CO . . . ppm . . . . . . 51188 3 2 . . N 15 NH . . . ppm . . . . . . 51188 3 3 . . HN 1 HN . . . ppm . . . . . . 51188 3 stop_ loop_ _Spectral_peak_software.Software_ID _Spectral_peak_software.Software_label _Spectral_peak_software.Method_ID _Spectral_peak_software.Method_label _Spectral_peak_software.Entry_ID _Spectral_peak_software.Spectral_peak_list_ID 2 $software_2 . . 51188 3 stop_ save_ save_spectral_peak_list_4 _Spectral_peak_list.Sf_category spectral_peak_list _Spectral_peak_list.Sf_framecode spectral_peak_list_4 _Spectral_peak_list.Entry_ID 51188 _Spectral_peak_list.ID 4 _Spectral_peak_list.Name . _Spectral_peak_list.Sample_ID 1 _Spectral_peak_list.Sample_label $sample_1 _Spectral_peak_list.Sample_condition_list_ID 1 _Spectral_peak_list.Sample_condition_list_label $sample_conditions_1 _Spectral_peak_list.Chem_shift_reference_ID 1 _Spectral_peak_list.Chem_shift_reference_label $chem_shift_reference_1 _Spectral_peak_list.Experiment_ID 4 _Spectral_peak_list.Experiment_name HMCMCGCBCA _Spectral_peak_list.Experiment_class . _Spectral_peak_list.Experiment_type . _Spectral_peak_list.Number_of_spectral_dimensions 3 _Spectral_peak_list.Chemical_shift_list . _Spectral_peak_list.Assigned_chem_shift_list_ID 1 _Spectral_peak_list.Assigned_chem_shift_list_label $assigned_chemical_shifts_1 _Spectral_peak_list.Details . _Spectral_peak_list.Text_data_format text _Spectral_peak_list.Text_data ; Assignment w1 w2 w3 V214CG1-CA-HG1 21.915 60.121 0.944 V214CG2-CA-HG2 21.930 60.052 0.889 V214CG1-CB-HG1 21.921 34.946 0.945 V214CG2-CB-HG2 21.926 34.917 0.890 L216CD1-CA-HD1 24.495 53.251 0.639 L216CD2-CA-HD2 29.377 53.331 0.875 L216CD1-CB-HD1 24.487 44.901 0.638 L216CD2-CB-HD2 29.409 44.889 0.874 L216CD1-CG-HD1 24.487 26.504 0.641 L228CD1-CA-HD1 21.740 56.772 0.753 L228CD2-CA-HD2 25.729 56.820 0.759 L228CD1-CB-HD1 21.732 40.926 0.753 L228CD2-CB-HD2 25.732 40.996 0.755 L228CD1-CG-HD1 21.730 26.333 0.750 L229CD1-CA-HD1 22.104 58.256 0.667 L229CD1-CB-HD1 22.099 41.399 0.667 L229CD1-CG-HD1 22.099 26.037 0.667 L232CD1-CA-HD1 20.837 57.425 0.849 L232CD1-CB-HD1 20.840 41.065 0.848 L232CD1-CG-HD1 20.864 25.735 0.850 L238CD1-CA-HD1 24.540 57.179 0.951 L238CD1-CB-HD1 24.564 39.891 0.951 L238CD1-CG-HD1 24.576 27.283 0.952 V242CG1-CA-HG1 23.021 65.779 0.952 V242CG2-CA-HG2 20.656 65.772 0.443 V242CG1-CB-HG1 23.031 31.196 0.953 V242CG2-CB-HG2 20.656 31.279 0.441 V256CG1-CA-HG1 21.446 66.007 0.686 V256CG2-CA-HG2 22.542 65.942 0.934 V256CG1-CB-HG1 21.446 29.013 0.687 V256CG2-CB-HG2 22.556 29.026 0.937 L258CD1-CA-HD1 23.054 56.444 0.902 L258CD1-CB-HD1 23.050 41.474 0.902 L258CD1-CG-HD1 23.050 26.629 0.903 L260CD1-CA-HD1 25.341 56.574 0.398 L260CD2-CA-HD2 24.579 56.574 0.367 L260CD1-CB-HD1 25.356 41.058 0.396 L260CD2-CB-HD2 24.579 41.063 0.369 L260CD1-CG-HD1 25.341 25.449 0.397 L260CD2-CG-HD2 24.611 25.368 0.369 V263CG1-CA-HG1 24.008 65.948 1.112 V263CG2-CA-HG2 21.928 65.935 0.955 V263CG1-CB-HG1 24.004 31.398 1.110 V263CG2-CB-HG2 21.914 31.417 0.954 L267CD1-CA-HD1 22.552 57.303 0.437 L267CD1-CB-HD1 22.537 39.523 0.439 L267CD1-CG-HD1 22.554 25.880 0.440 V274CG1-CA-HG1 23.610 63.018 1.007 V274CG2-CA-HG2 22.015 62.958 1.138 V274CG1-CB-HG1 23.595 34.106 1.006 V274CG2-CB-HG2 21.991 34.088 1.136 L279CD1-CA-HD1 28.748 57.116 0.945 L279CD2-CA-HD2 23.927 57.151 0.771 L279CD1-CB-HD1 28.756 40.338 0.944 L279CD2-CB-HD2 23.953 40.266 0.770 L279CD1-CG-HD1 28.728 26.812 0.942 L279CD2-CG-HD2 23.942 26.837 0.770 L288CD1-CA-HD1 25.189 57.388 0.922 L288CD1-CB-HD1 25.188 41.016 0.922 L288CD1-CG-HD1 25.191 26.612 0.922 L288CD2-CG-HD2 24.356 26.651 0.934 V296CG1-CA-HG1 21.034 64.376 1.130 V296CG2-CA-HG2 23.153 64.387 0.953 V296CG1-CB-HG1 21.025 30.925 1.129 V296CG2-CB-HG2 23.148 30.745 0.947 L299CD1-CA-HD1 22.119 56.973 -0.104 L299CD1-CB-HD1 22.110 39.489 -0.103 L299CD1-CG-HD1 22.105 26.696 -0.104 V302CG1-CA-HG1 21.526 65.894 0.702 V302CG2-CA-HG2 24.404 65.783 0.920 V302CG1-CB-HG1 21.510 30.997 0.707 V302CG2-CB-HG2 24.396 31.016 0.922 L303CD1-CA-HD1 22.741 57.929 0.327 L303CD2-CA-HD2 25.368 57.939 0.454 L303CD1-CB-HD1 22.738 41.076 0.327 L303CD1-CG-HD1 22.742 25.436 0.327 L303CD2-CG-HD2 25.368 25.297 0.446 L304CD1-CA-HD1 21.631 57.269 0.441 L304CD2-CA-HD2 26.215 57.106 0.294 L304CD1-CB-HD1 21.637 38.932 0.441 L304CD2-CB-HD2 26.198 39.024 0.295 L304CD1-CG-HD1 21.635 25.888 0.443 L304CD2-CG-HD2 26.205 25.884 0.293 V307CG1-CA-HG1 21.561 65.309 0.927 V307CG2-CA-HG2 23.203 65.350 0.923 V307CG1-CB-HG1 21.557 30.637 0.930 V316CG1-CA-HG1 23.174 60.129 1.043 V316CG2-CA-HG2 18.951 60.109 0.893 V316CG1-CB-HG1 23.167 30.845 1.043 V316CG2-CB-HG2 18.945 30.852 0.891 I320CD1-CA-HD1 13.730 65.752 0.895 I320CD1-CB-HD1 13.729 32.690 0.895 I320CD1-CG1-HD1 13.731 31.021 0.895 L323CD1-CA-HD1 26.785 56.911 0.469 L323CD2-CA-HD2 23.467 56.773 0.519 L323CD1-CB-HD1 26.755 43.293 0.474 L323CD2-CB-HD2 23.464 43.304 0.519 L323CD2-CG-HD2 23.461 26.432 0.519 V329CG1-CA-HG1 20.192 59.263 0.968 V329CG2-CA-HG2 22.362 59.260 0.958 V329CG1-CB-HG1 20.198 34.904 0.968 V329CG2-CB-HG2 22.368 34.915 0.957 I332CD1-CA-HD1 13.794 60.292 0.533 I332CD1-CB-HD1 13.794 40.102 0.534 I332CD1-CG1-HD1 13.796 27.052 0.533 V337CG1-CA-HG1 19.111 58.430 0.410 V337CG2-CA-HG2 21.166 58.436 0.698 V337CG1-CB-HD1 19.118 34.510 0.410 V337CG2-CB-HG2 21.159 34.474 0.698 I350CD1-CA-HD1 13.541 60.366 0.257 I350CD1-CB-HD1 13.540 40.348 0.257 I350CD1-CG1-HD1 13.543 26.487 0.256 L352CD1-CA-HD1 27.064 52.447 0.422 L352CD2-CA-HD2 21.229 52.455 -0.158 L352CD1-CB-HD1 27.076 42.198 0.421 L352CD2-CB-HD2 21.227 42.183 -0.158 L352CD1-CG-HD1 27.070 25.292 0.422 L352CD2-CG-HD2 21.228 25.246 -0.158 I354CD1-CA-HD1 14.127 59.452 0.288 I354CD1-CB-HD1 14.125 38.612 0.288 I354CD1-CG1-HD1 14.126 25.503 0.287 I360CD1-CA-HD1 15.367 63.304 0.928 I360CD1-CB-HD1 15.372 38.800 0.928 I360CD1-CG1-HD1 15.381 29.466 0.929 V365CG1-CA-HG1 23.838 66.500 1.142 V365CG2-CA-HG2 21.455 66.481 1.047 V365CG1-CB-HG1 23.840 31.459 1.142 V365CG2-CB-HG2 21.445 31.485 1.047 V368CG1-CA-HG1 19.102 60.441 1.456 V368CG2-CA-HG2 22.225 60.450 1.348 V368CG1-CB-HG1 19.111 31.162 1.455 V368CG2-CB-HG2 22.225 31.183 1.348 V370CG1-CA-HG1 22.163 61.437 0.900 V370CG2-CA-HG2 21.064 61.450 1.012 V370CG1-CB-HG1 22.163 32.626 0.900 V370CG2-CB-HG2 21.058 32.612 1.012 L373CD1-CA-HD1 26.689 54.045 0.789 L373CD2-CA-HD2 23.582 53.993 0.801 L373CD1-CB-HD1 26.655 38.968 0.787 L373CD2-CB-HD1 23.574 38.921 0.802 L373CD1-CG-HD1 26.692 26.443 0.789 L373CD2-CG-HD2 23.602 26.418 0.799 L386CD1-CA-HD1 22.650 54.699 0.574 L386CD2-CA-HD2 25.362 54.706 0.802 L386CD1-CB-HD1 22.647 40.870 0.574 L386CD2-CB-HD2 25.366 40.869 0.801 L386CD1-CG-HD1 22.650 26.380 0.575 L386CD2-CG-HD2 25.374 26.369 0.802 V393CG1-CA-HG1 21.191 59.491 0.727 V393CG2-CA-HG2 21.624 59.506 0.688 V393CG1-CB-HG1 21.192 35.195 0.727 V393CG2-CB-HG2 21.623 35.199 0.688 L396CD1-CA-HD1 23.472 55.582 0.828 L396CD2-CA-HD2 25.454 55.598 0.845 L396CD1-CB-HD1 23.468 41.859 0.828 L396CD2-CB-HD2 25.445 41.801 0.845 L396CD1-CG-HD1 23.456 26.791 0.827 L396CD2-CG-HD2 25.454 26.772 0.846 L398CD1-CA-HD1 29.124 52.062 0.622 L398CD2-CA-HD2 23.554 52.066 0.334 L398CD1-CB-HD1 29.134 44.991 0.623 L398CD2-CB-HD2 23.540 44.977 0.334 L398CD1-CG-HD1 29.118 26.704 0.622 L398CD2-CG-HD2 23.563 26.725 0.336 V401CG1-CA-HG1 23.203 61.550 0.916 V401CG2-CA-HG2 22.633 61.493 0.550 V401CG1-CB-HG1 23.204 30.678 0.923 V401CG2-CB-HG2 22.637 30.823 0.550 L402CD1-CA-HD1 25.511 52.683 0.131 L402CD2-CA-HD2 23.751 52.679 0.472 L402CD1-CB-HD1 25.512 44.710 0.131 L402CD2-CB-HD2 23.753 44.726 0.473 L402CD1-CG-HD1 25.491 26.239 0.134 L402CD2-CG-HD2 23.751 26.260 0.472 L404CD1-CA-HD1 27.556 51.843 0.845 L404CD2-CA-HD2 25.169 52.060 0.723 L404CD1-CB-HD1 27.560 42.374 0.843 L404CD2-CB-HD2 25.169 42.306 0.721 L404CD1-CG-HD1 27.507 25.770 0.843 L406CD1-CA-HD1 24.247 52.465 0.697 L406CD2-CA-HD2 22.892 52.440 0.528 L406CD1-CB-HD1 24.245 40.163 0.697 L406CD2-CB-HD2 22.897 40.142 0.528 L406CD1-CG-HD1 24.233 26.853 0.697 I419CD1-CA-HD1 14.009 59.344 0.748 I419CD1-CB-HD1 14.009 41.121 0.749 I419CD1-CG1-HD1 14.010 25.983 0.748 I421CD1-CA-HD1 13.418 59.899 0.803 I421CD1-CB-HD1 13.418 37.961 0.803 I421CD1-CG1-HD1 13.415 26.278 0.803 L431CD1-CA-HD1 25.090 50.922 -0.176 L431CD2-CA-HD2 24.132 50.913 0.379 L431CD1-CB-HD1 25.055 46.033 -0.177 L431CD2-CB-HD2 24.122 46.073 0.378 L431CD1-CG-HD1 25.115 25.639 -0.172 L431CD2-CG-HD2 24.130 25.743 0.378 L433CD1-CA-HD1 21.739 53.687 -0.213 L433CD1-CB-HD1 21.745 43.060 -0.213 L433CD1-CG-HD1 21.733 25.774 -0.213 L437CD1-CA-HD1 27.726 53.214 1.076 L437CD2-CA-HD2 23.645 53.210 0.757 L437CD1-CB-HD1 27.727 43.249 1.076 L437CD2-CB-HD2 23.657 43.273 0.757 L437CD1-CG-HD1 27.707 26.341 1.075 L437CD2-CG-HD2 23.661 26.267 0.757 I449CD1-CA-HD1 12.381 58.304 0.838 I449CD1-CB-HD1 12.378 39.452 0.838 I449CD1-CG1-HD1 12.378 26.888 0.838 L450CD1-CA-HD1 27.426 56.825 1.010 L450CD2-CA-HD2 21.020 56.769 0.399 L450CD1-CB-HD1 27.430 42.359 1.009 L450CD2-CB-HD2 21.029 42.263 0.399 L450CD1-CG-HD1 27.429 26.382 1.010 L450CD2-CG-HD2 21.018 26.414 0.398 V453CG1-CA-HG1 21.489 61.242 0.953 V453CG1-CB-HG1 21.458 34.588 0.954 L454CD1-CA-HD1 26.204 58.735 0.952 L454CD2-CA-HD2 24.434 58.775 0.762 L454CD1-CB-HD1 26.209 38.786 0.954 L454CD2-CB-HD2 24.422 38.779 0.761 L454CD1-CG-HD1 26.204 32.015 0.952 L454CD2-CG-HD2 24.428 32.098 0.762 V455CG1-CA-HG1 23.177 61.047 1.042 V455CG2-CA-HG2 21.959 61.137 0.932 V455CG1-CB-HG1 23.181 35.455 1.044 V455CG2-CB-HG2 21.933 35.283 0.929 V466CG1-CA-HG1 22.145 59.960 0.716 V466CG2-CA-HG2 20.566 59.954 0.672 V466CG1-CB-HG1 22.134 36.003 0.716 V466CG2-CB-HG2 20.565 36.005 0.672 V467CG1-CA-HG1 21.117 58.456 1.168 V467CG2-CA-HG2 22.856 58.478 0.963 V467CG1-CB-HG1 21.133 35.521 1.167 V467CG2-CB-HG2 22.870 35.505 0.960 L469CD1-CA-HD1 27.572 54.904 0.210 L469CD2-CA-HD2 26.581 54.928 0.346 L469CD1-CB-HD1 27.582 49.351 0.210 L469CD2-CB-HD2 26.585 49.382 0.347 L469CD1-CG-HD1 27.558 28.213 0.213 V484CG1-CA-HG1 21.400 62.438 0.930 V484CG2-CA-HG2 21.376 62.472 0.857 V484CG1-CB-HG1 21.395 32.354 0.929 V484CG2-CB-HG2 21.378 32.347 0.858 V485CG1-CA-HG1 20.652 60.010 -0.014 V485CG2-CA-HG2 20.905 60.003 0.500 V485CG1-CB-HG1 20.653 32.426 -0.013 V485CG2-CB-HG2 20.903 32.444 0.500 I494CD1-CA-HD1 14.107 61.768 0.590 I494CD1-CB-HD1 14.104 36.464 0.590 I494CD1-CG1-HD1 14.109 26.209 0.591 L505CD1-CA-HD1 25.222 55.264 0.865 L505CD2-CA-HD2 23.298 55.279 0.791 L505CD1-CB-HD1 25.225 40.953 0.865 L505CD2-CB-HD2 23.301 40.950 0.791 L505CD1-CG-HD1 25.227 26.374 0.865 L505CD2-CG-HD2 23.300 26.467 0.791 V507CG1-CA-HG1 21.178 62.491 0.831 V507CG2-CA-HG2 20.745 62.482 0.819 V507CG1-CB-HG1 21.171 31.833 0.830 V507CG2-CB-HG2 20.706 31.827 0.817 L516CD1-CA-HD1 27.848 52.130 0.718 L516CD2-CA-HD2 23.059 52.111 0.116 L516CD1-CB-HD1 27.832 45.347 0.712 L516CD2-CB-HD2 23.062 45.333 0.116 L516CD1-CG-HD1 27.872 26.437 0.712 L516CD2-CG-HD2 23.059 26.325 0.117 V517CG1-CA-HG1 21.647 60.861 1.195 V517CG2-CA-HG2 20.650 60.883 0.730 V517CG1-CB-HG1 21.659 33.531 1.196 V517CG2-CB-HG2 20.652 33.484 0.730 I519CD1-CA-HD1 12.933 58.766 0.212 I519CD1-CB-HD1 12.936 40.536 0.212 I519CD1-CG1-HD1 12.932 27.870 0.212 L524CD1-CA-HD1 26.096 59.666 0.868 L524CD2-CA-HD2 25.035 59.636 0.829 L524CD1-CB-HD1 26.095 42.545 0.868 L524CD2-CB-HD2 25.035 42.538 0.829 L524CD1-CG-HD1 26.088 26.210 0.868 L524CD2-CG-HD2 25.037 26.059 0.829 V527CG1-CA-HG1 23.053 65.800 0.865 V527CG2-CA-HG2 22.488 65.815 0.786 V527CG1-CB-HG1 23.061 31.863 0.865 V527CG2-CB-HG2 22.490 31.813 0.785 L528CD1-CA-HD1 25.160 52.656 0.593 L528CD2-CA-HD2 22.864 52.738 0.753 L528CD1-CB-HD1 25.168 38.006 0.600 L528CD2-CB-HD2 22.827 38.086 0.748 L528CD1-CG-HD1 25.141 26.042 0.603 V531CG1-CA-HG1 22.422 60.784 1.148 V531CG2-CA-HG2 22.094 60.767 0.820 V531CG1-CB-HG1 22.403 32.724 1.148 V531CG2-CB-HG2 22.096 32.737 0.820 I536CD1-CA-HD1 14.453 58.516 0.606 I536CD1-CB-HD1 14.445 37.244 0.605 I536CD1-CG1-HD1 14.461 26.442 0.607 L540CD1-CA-HD1 22.812 56.876 0.742 L540CD1-CB-HD1 22.834 40.446 0.740 L540CD1-CG-HD1 22.818 26.656 0.744 V541CG1-CA-HG1 21.102 66.723 0.778 V541CG2-CA-HG2 22.909 66.736 0.845 V541CG1-CB-HG1 21.092 31.118 0.779 V541CG2-CB-HG2 22.907 31.094 0.846 L544CD1-CA-HD1 21.342 57.194 0.626 L544CD1-CB-HD1 21.328 39.064 0.628 L544CD1-CG-HD1 21.313 25.514 0.625 I550CD1-CA-HD1 12.871 63.651 0.815 I550CD1-CB-HD1 12.879 37.082 0.815 I550CD1-CG1-HD1 12.870 28.088 0.814 ; loop_ _Spectral_dim.ID _Spectral_dim.Axis_code _Spectral_dim.Spectrometer_frequency _Spectral_dim.Atom_type _Spectral_dim.Atom_isotope_number _Spectral_dim.Spectral_region _Spectral_dim.Magnetization_linkage_ID _Spectral_dim.Under_sampling_type _Spectral_dim.Sweep_width _Spectral_dim.Sweep_width_units _Spectral_dim.Value_first_point _Spectral_dim.Absolute_peak_positions _Spectral_dim.Acquisition _Spectral_dim.Center_frequency_offset _Spectral_dim.Encoding_code _Spectral_dim.Encoded_reduced_dimension_ID _Spectral_dim.Entry_ID _Spectral_dim.Spectral_peak_list_ID 1 . . CO 13 CO . . . ppm . . . . . . 51188 4 2 . . N 15 NH . . . ppm . . . . . . 51188 4 3 . . HN 1 HN . . . ppm . . . . . . 51188 4 stop_ loop_ _Spectral_peak_software.Software_ID _Spectral_peak_software.Software_label _Spectral_peak_software.Method_ID _Spectral_peak_software.Method_label _Spectral_peak_software.Entry_ID _Spectral_peak_software.Spectral_peak_list_ID 2 $software_2 . . 51188 4 stop_ save_ save_spectral_peak_list_5 _Spectral_peak_list.Sf_category spectral_peak_list _Spectral_peak_list.Sf_framecode spectral_peak_list_5 _Spectral_peak_list.Entry_ID 51188 _Spectral_peak_list.ID 5 _Spectral_peak_list.Name . _Spectral_peak_list.Sample_ID 1 _Spectral_peak_list.Sample_label $sample_1 _Spectral_peak_list.Sample_condition_list_ID 1 _Spectral_peak_list.Sample_condition_list_label $sample_conditions_1 _Spectral_peak_list.Chem_shift_reference_ID 1 _Spectral_peak_list.Chem_shift_reference_label $chem_shift_reference_1 _Spectral_peak_list.Experiment_ID 7 _Spectral_peak_list.Experiment_name '3D HNCO' _Spectral_peak_list.Experiment_class . _Spectral_peak_list.Experiment_type . _Spectral_peak_list.Number_of_spectral_dimensions 3 _Spectral_peak_list.Chemical_shift_list . _Spectral_peak_list.Assigned_chem_shift_list_ID 1 _Spectral_peak_list.Assigned_chem_shift_list_label $assigned_chemical_shifts_1 _Spectral_peak_list.Details . _Spectral_peak_list.Text_data_format text _Spectral_peak_list.Text_data ; Assignment w1 w2 w3 G212N-T211C-G212H 107.061 174.467 8.398 Y213N-G212C-Y213H 121.585 173.097 7.792 G215N-V214C-G215H 110.166 174.773 8.465 L216N-G215C-L216H 119.294 171.229 6.725 S227N-N226C-S227H 116.228 177.307 8.422 L228N-S227C-L228H 123.746 175.606 7.872 L229N-L228C-L229H 119.292 178.108 8.779 Q230N-L229C-Q230H 114.990 179.161 7.647 T231N-Q230C-T231H 113.691 177.790 7.092 L232N-T231C-L232H 119.145 176.653 8.099 F233N-L232C-F233H 121.702 178.338 8.416 F234N-F233C-F234H 113.811 177.228 7.639 T235N-F234C-T235H 116.775 174.471 7.412 N236N-T235C-N236H 125.887 176.517 7.131 Q237N-N236C-Q237H 117.656 176.651 9.005 L238N-Q237C-L238H 117.030 178.756 7.203 R239N-L238C-R239H 122.060 176.695 7.572 K240N-R239C-K240H 114.329 176.588 8.189 A241N-K240C-A241H 120.824 177.947 7.107 V242N-A241C-V242H 118.920 179.881 8.565 Y243N-V242C-Y243H 120.201 179.979 7.990 M244N-Y243C-M244H 114.224 175.270 7.396 M245N-M244C-M245H 118.480 176.581 7.237 T247N-P246C-T247H 114.420 176.328 7.937 E248N-T247C-E248H 124.836 176.003 9.078 G249N-E248C-G249H 108.739 177.318 8.613 D250N-G249C-D250H 122.353 174.443 7.809 D251N-D250C-D251H 122.135 175.711 8.538 S252N-D251C-S252H 116.240 176.360 8.300 S253N-S252C-S253H 115.594 175.143 8.553 K254N-S253C-K254H 118.967 175.079 7.828 S255N-K254C-S255H 111.879 176.065 7.280 V256N-S255C-V256H 131.894 175.116 9.091 L258N-P257C-L258H 118.175 177.480 7.908 A259N-L258C-A259H 121.089 178.079 7.947 L260N-A259C-L260H 120.486 181.335 8.398 Q261N-L260C-Q261H 117.898 177.899 7.846 R262N-Q261C-R262H 117.979 177.957 8.489 V263N-R262C-V263H 117.865 177.755 7.707 F264N-V263C-F264H 118.334 177.813 8.537 Y265N-F264C-Y265H 120.596 176.257 9.292 E266N-Y265C-E266H 121.091 180.182 8.774 L267N-E266C-L267H 122.873 179.099 8.870 Q268N-L267C-Q268H 117.861 178.993 8.068 H269N-Q268C-H269H 114.784 176.097 7.566 S270N-H269C-S270H 116.831 175.045 9.275 D271N-S270C-D271H 121.857 174.450 8.407 K272N-D271C-K272H 121.847 175.619 8.046 V274N-P273C-V274H 126.717 176.378 8.274 G275N-V274C-G275H 114.007 175.930 8.757 T276N-G275C-T276H 115.350 174.525 8.270 K277N-T276C-K277H 117.814 179.351 7.370 K278N-K277C-K278H 122.237 179.148 7.893 L279N-K278C-L279H 120.284 179.108 7.275 T280N-L279C-T280H 112.526 178.379 8.225 K281N-T280C-K281H 119.902 176.950 7.512 S282N-K281C-S282H 116.117 179.186 7.330 F283N-S282C-F283H 115.767 175.113 6.840 G284N-F283C-G284H 108.590 176.346 7.470 W285N-G284C-W285H 122.887 175.075 6.870 E286N-W285C-E286H 117.766 174.620 8.180 T287N-E286C-T287H 109.463 176.554 7.673 D289N-D288C-D289H 116.698 178.550 8.217 F291N-S290C-F291H 119.498 175.706 7.703 M292N-F291C-M292H 117.713 178.380 8.062 Q293N-M292C-Q293H 116.284 177.304 7.331 H294N-Q293C-H294H 116.646 174.943 7.076 D295N-H294C-D295H 119.315 172.587 8.086 V296N-D295C-V296H 119.680 176.669 8.067 Q297N-V296C-Q297H 123.005 175.646 8.204 E298N-Q297C-E298H 121.867 178.405 8.061 L299N-E298C-L299H 119.488 179.392 7.734 C300N-L299C-C300H 118.643 176.984 8.299 R301N-C300C-R301H 117.488 175.713 7.808 V302N-R301C-V302H 119.148 178.294 7.761 L303N-V302C-L303H 119.115 179.651 7.800 L304N-L303C-L304H 116.392 178.283 8.650 D305N-L304C-D305H 120.821 179.055 8.904 N306N-D305C-N306H 116.844 179.322 7.222 V307N-N306C-V307H 115.551 178.732 7.729 E308N-V307C-E308H 123.233 176.783 8.915 N309N-E308C-N309H 117.133 180.525 7.877 K310N-N309C-K310H 120.891 177.964 7.449 M311N-K310C-M311H 114.355 176.697 7.656 K312N-M311C-K312H 124.564 177.353 7.419 G313N-K312C-G313H 113.513 177.455 9.720 T314N-G313C-T314H 109.044 174.387 7.607 C315N-T314C-C315H 120.140 177.237 8.380 V316N-C315C-V316H 112.247 175.221 7.798 E317N-V316C-E317H 125.786 175.605 7.467 G318N-E317C-G318H 109.710 176.881 8.330 T319N-G318C-T319H 120.264 174.673 7.891 I320N-T319C-I320H 118.979 174.284 8.891 K322N-P321C-K322H 116.499 178.556 7.559 L323N-K322C-L323H 116.518 178.652 7.504 F324N-L323C-F324H 110.857 176.706 7.783 R325N-F324C-R325H 115.825 173.850 7.649 G326N-R325C-G326H 115.481 177.157 8.058 K327N-G326C-K327H 117.850 171.039 7.700 M328N-K327C-M328H 125.072 175.908 9.716 V329N-M328C-V329H 120.173 173.175 9.134 S330N-V329C-S330H 122.977 173.272 8.757 Y331N-S330C-Y331H 124.764 174.258 8.849 I332N-Y331C-I332H 119.961 173.595 8.421 Q333N-I332C-Q333H 125.273 174.976 9.302 C334N-Q333C-C334H 125.555 176.248 8.696 K335N-C334C-K335H 121.437 174.533 8.052 E336N-K335C-E336H 116.651 178.097 9.604 V337N-E336C-V337H 110.801 176.315 6.894 D338N-V337C-D338H 122.355 174.713 8.371 Y339N-D338C-Y339H 124.977 174.519 7.545 R340N-Y339C-R340H 128.796 172.596 7.757 S341N-R340C-S341H 118.222 173.924 8.797 D342N-S341C-D342H 125.876 173.218 8.482 R343N-D342C-R343H 122.298 175.007 8.772 R344N-R343C-R344H 127.024 174.983 8.801 E345N-R344C-E345H 123.274 175.951 8.835 D346N-E345C-D346H 123.606 174.797 8.585 Y347N-D346C-Y347H 118.242 176.172 8.220 Y348N-Y347C-Y348H 119.349 172.301 9.111 D349N-Y348C-D349H 118.500 174.652 8.261 I350N-D349C-I350H 117.982 174.144 7.997 Q351N-I350C-Q351H 126.609 174.202 8.316 L352N-Q351C-L352H 124.171 174.373 8.754 S353N-L352C-S353H 118.521 175.727 8.686 I354N-S353C-I354H 119.175 174.502 8.550 K355N-I354C-K355H 123.856 176.188 7.471 G356N-K355C-G356H 118.044 177.992 9.859 K357N-G356C-K357H 121.349 173.865 8.339 K358N-K357C-K358H 119.381 175.771 8.968 N359N-K358C-N359H 110.254 177.884 7.113 I360N-N359C-I360H 116.946 175.097 7.011 F361N-I360C-F361H 123.817 175.761 7.881 E362N-F361C-E362H 117.521 177.622 8.057 S363N-E362C-S363H 115.117 180.535 7.802 F364N-S363C-F364H 124.496 177.333 8.227 V365N-F364C-V365H 119.352 177.496 8.299 D366N-V365C-D366H 118.164 178.844 7.541 Y367N-D366C-Y367H 122.869 177.937 8.043 V368N-Y367C-V368H 106.798 178.547 7.558 A369N-V368C-A369H 127.402 175.800 7.332 V370N-A369C-V370H 121.005 178.178 8.291 E371N-V370C-E371H 127.964 176.589 9.275 Q372N-E371C-Q372H 122.796 175.499 8.664 L373N-Q372C-L373H 128.028 175.448 8.904 D374N-L373C-D374H 121.135 174.153 7.690 G375N-D374C-G375H 109.130 176.186 8.923 D376N-G375C-D376H 120.510 176.329 8.310 N377N-D376C-N377H 119.232 175.757 8.422 K378N-N377C-K378H 116.556 174.237 6.766 Y379N-K378C-Y379H 121.644 174.823 8.144 D380N-Y379C-D380H 127.060 174.523 7.777 A381N-D380C-A381H 131.240 173.157 7.743 G382N-A381C-G382H 108.348 177.529 7.728 E383N-G382C-E383H 120.520 177.336 8.330 H384N-E383C-H384H 116.818 176.803 7.447 G385N-H384C-G385H 109.293 176.183 7.694 L386N-G385C-L386H 120.334 172.759 8.009 Q387N-L386C-Q387H 123.246 178.605 9.401 E388N-Q387C-E388H 122.365 175.522 9.067 A389N-E388C-A389H 127.536 177.971 9.150 E390N-A389C-E390H 119.313 174.086 8.628 K391N-E390C-K391H 123.900 173.764 8.793 G392N-K391C-G392H 110.121 174.274 7.163 V393N-G392C-V393H 117.824 170.785 7.722 K394N-V393C-K394H 121.517 176.125 8.857 F395N-K394C-F395H 119.656 175.554 8.167 L396N-F395C-L396H 123.684 175.018 9.190 T397N-L396C-T397H 109.156 178.117 8.588 L398N-T397C-L398H 124.245 173.487 8.394 V401N-P400C-V401H 115.000 174.473 7.939 L402N-V401C-L402H 127.443 173.030 9.296 H403N-L402C-H403H 128.470 175.160 9.546 L404N-H403C-L404H 121.535 174.031 8.797 Q405N-L404C-Q405H 122.807 175.978 9.039 L406N-Q405C-L406H 123.310 174.246 8.405 M407N-L406C-M407H 123.605 178.199 8.122 R408N-M407C-R408H 123.676 175.289 8.428 F409N-R408C-F409H 117.285 174.959 8.198 M410N-F409C-M410H 120.718 175.466 8.537 Y411N-M410C-Y411H 123.672 173.868 8.567 D412N-Y411C-D412H 128.831 174.411 8.202 Q414N-P413C-Q414H 116.180 178.406 7.909 T415N-Q414C-T415H 106.284 177.711 6.979 D416N-T415C-D416H 122.347 174.715 7.994 Q417N-D416C-Q417H 114.174 174.080 7.081 N418N-Q417C-N418H 120.922 174.182 8.654 I419N-N418C-I419H 120.781 174.966 8.981 K420N-I419C-K420H 123.676 174.409 8.172 I421N-K420C-I421H 127.479 175.916 9.155 N422N-I421C-N422H 126.858 176.236 8.976 D423N-N422C-D423H 117.125 173.835 7.129 R424N-D423C-R424H 122.482 174.746 8.659 F425N-R424C-F425H 129.857 176.224 9.301 E426N-F425C-E426H 126.018 173.439 7.452 F427N-E426C-F427H 115.621 173.739 5.707 E429N-P428C-E429H 119.696 177.127 8.883 Q430N-E429C-Q430H 116.135 175.393 7.759 L431N-Q430C-L431H 127.149 173.596 9.412 L433N-P432C-L433H 123.630 178.252 8.847 D434N-L433C-D434H 121.538 177.350 8.094 E435N-D434C-E435H 114.600 178.730 8.196 F436N-E435C-F436H 117.542 176.330 7.613 L437N-F436C-L437H 119.245 174.672 7.222 Q438N-L437C-Q438H 121.268 178.404 8.577 K439N-Q438C-K439H 117.442 175.804 7.839 T440N-K439C-T440H 118.005 175.497 8.391 D441N-T440C-D441H 121.633 173.246 8.828 K443N-P442C-K443H 115.051 177.742 8.088 D444N-K443C-D444H 117.791 176.394 7.470 A446N-P445C-A446H 130.604 177.127 9.250 N447N-A446C-N447H 121.502 174.918 7.630 Y448N-N447C-Y448H 125.414 174.234 8.613 I449N-Y448C-I449H 123.349 174.954 9.627 L450N-I449C-L450H 129.593 176.379 8.871 V453N-A452C-V453H 120.200 175.457 9.284 H456N-V455C-H456H 127.801 175.154 8.866 S457N-H456C-S457H 121.650 173.846 8.028 G458N-S457C-G458H 112.023 173.279 7.917 D459N-G458C-D459H 120.581 172.716 8.323 N460N-D459C-N460H 116.230 175.622 8.338 G462N-H461C-G462H 110.325 175.881 8.225 G463N-G462C-G463H 110.473 174.058 8.362 H464N-G463C-H464H 119.856 172.212 8.078 Y465N-H464C-Y465H 127.794 173.331 8.649 V467N-V466C-V467H 118.850 172.785 7.914 Y468N-V467C-Y468H 127.524 171.363 9.144 L469N-Y468C-L469H 124.485 175.413 9.363 N470N-L469C-N470H 119.192 175.578 7.099 K472N-P471C-K472H 113.181 178.752 8.446 G473N-K472C-G473H 109.152 177.337 8.231 D474N-G473C-D474H 116.056 172.682 7.799 G475N-D474C-G475H 110.553 177.482 8.903 K476N-G475C-K476H 121.197 173.503 7.154 W477N-K476C-W477H 125.868 175.664 8.841 C478N-W477C-C478H 117.748 177.157 9.363 K479N-C478C-K479H 125.126 172.000 9.313 F480N-K479C-F480H 126.264 174.213 9.235 D481N-F480C-D481H 129.073 174.812 8.811 D482N-D481C-D482H 119.298 175.191 8.267 D483N-D482C-D483H 121.355 176.237 9.253 V484N-D483C-V484H 123.556 175.106 8.013 V485N-V484C-V485H 131.118 174.214 8.355 S486N-V485C-S486H 120.520 175.808 8.736 R487N-S486C-R487H 123.986 173.816 8.833 C488N-R487C-C488H 119.886 175.994 8.481 T489N-C488C-T489H 111.281 172.646 8.504 K490N-T489C-K490H 121.344 175.570 8.660 E491N-K490C-E491H 117.812 177.487 8.245 E492N-E491C-E492H 116.198 176.800 6.834 A493N-E492C-A493H 116.195 175.376 6.296 I494N-A493C-I494H 116.983 177.029 7.121 E495N-I494C-E495H 119.020 175.409 7.464 H496N-E495C-H496H 117.460 179.601 8.408 N497N-H496C-N497H 114.537 176.211 8.004 Y498N-N497C-Y498H 121.030 177.606 7.748 G499N-Y498C-G499H 107.283 176.680 8.504 G500N-G499C-G500H 106.606 173.311 8.152 H501N-G500C-H501H 119.384 173.237 8.164 D502N-H501C-D502H 122.350 175.102 8.233 D503N-D502C-D503H 120.348 175.910 8.308 D504N-D503C-D504H 120.392 176.043 8.207 L505N-D504C-L505H 121.587 176.439 8.163 S506N-L505C-S506H 116.104 177.731 8.268 V507N-S506C-V507H 120.796 175.157 7.932 R508N-V507C-R508H 122.980 176.499 8.137 T511N-C510C-T511H 120.503 174.124 7.841 N512N-T511C-N512H 117.229 173.615 8.545 A513N-N512C-A513H 120.480 174.339 7.597 Y514N-A513C-Y514H 114.172 176.152 8.795 M515N-M514C-M515H 124.224 173.749 7.205 L516N-M515C-L516H 126.368 171.848 9.133 V517N-L516C-V517H 119.697 174.998 8.500 Y518N-V517C-Y518H 127.242 175.520 9.202 I519N-Y518C-I519H 120.019 174.358 9.563 R520N-I519C-R520H 132.507 175.508 9.264 E521N-R520C-E521H 130.696 177.828 9.183 S522N-E521C-S522H 112.451 179.083 8.376 K523N-S522C-K523H 118.988 175.729 7.514 L524N-K523C-L524H 125.117 176.604 7.388 S525N-L524C-S525H 111.133 177.766 8.481 E526N-S525C-E526H 121.572 175.440 7.353 V527N-E526C-V527H 121.180 178.852 8.596 L528N-V527C-L528H 114.023 176.998 7.936 Q529N-L528C-Q529H 119.504 175.749 6.552 A530N-Q529C-A530H 125.118 174.357 8.381 V531N-A530C-V531H 122.449 177.485 8.298 T532N-V531C-T532H 119.981 175.929 9.463 D535N-H534C-D535H 117.264 175.992 7.465 I536N-D535C-I536H 119.973 174.421 7.005 Q538N-P537C-Q538H 126.145 177.960 8.855 Q539N-Q538C-Q539H 116.401 177.718 8.988 L540N-Q539C-L540H 121.525 178.597 7.039 V541N-L540C-V541H 119.149 177.337 7.151 E542N-V541C-E542H 116.734 178.355 8.279 R543N-E542C-R543H 120.758 179.341 7.497 L544N-R543C-L544H 119.363 179.483 8.205 E547N-E546C-E547H 119.702 180.683 8.517 K548N-E547C-K548H 122.901 179.297 8.088 R549N-K548C-R549H 118.525 178.292 7.829 I550N-R549C-I550H 120.713 179.302 8.194 E551N-I550C-E551H 120.529 179.021 7.955 A552N-E551C-A552H 121.164 178.665 7.799 Q553N-A552C-Q553H 118.170 179.545 7.755 K554N-Q553C-K554H 120.031 177.479 7.886 R555N-K554C-R555H 120.329 177.659 7.856 K556N-R555C-K556H 121.475 176.993 7.962 E557N-K556C-E557H 120.892 177.135 8.131 R558N-E557C-R558H 120.819 176.508 8.051 Q559N-R558C-Q559H 122.331 175.880 8.290 E560N-Q559C-E560H 127.865 174.954 7.947 ; loop_ _Spectral_dim.ID _Spectral_dim.Axis_code _Spectral_dim.Spectrometer_frequency _Spectral_dim.Atom_type _Spectral_dim.Atom_isotope_number _Spectral_dim.Spectral_region _Spectral_dim.Magnetization_linkage_ID _Spectral_dim.Under_sampling_type _Spectral_dim.Sweep_width _Spectral_dim.Sweep_width_units _Spectral_dim.Value_first_point _Spectral_dim.Absolute_peak_positions _Spectral_dim.Acquisition _Spectral_dim.Center_frequency_offset _Spectral_dim.Encoding_code _Spectral_dim.Encoded_reduced_dimension_ID _Spectral_dim.Entry_ID _Spectral_dim.Spectral_peak_list_ID 1 . . CO 13 CO . . . ppm . . . . . . 51188 5 2 . . N 15 NH . . . ppm . . . . . . 51188 5 3 . . HN 1 HN . . . ppm . . . . . . 51188 5 stop_ loop_ _Spectral_peak_software.Software_ID _Spectral_peak_software.Software_label _Spectral_peak_software.Method_ID _Spectral_peak_software.Method_label _Spectral_peak_software.Entry_ID _Spectral_peak_software.Spectral_peak_list_ID 2 $software_2 . . 51188 5 stop_ save_