data_18097 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 18097 _Entry.Title ; Backbone 1H, 13C, and 15N Chemical Shift Assignments for primate innate immunity protein ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2011-11-21 _Entry.Accession_date 2011-11-21 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _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.Entry_ID 1 Nikolaos Biris . . . 18097 2 Yang Yang . . . 18097 3 Alexander Taylor . B. . 18097 4 Andrei Tomashevski . . . 18097 5 Miao Guo . . . 18097 6 P. Hart . John . 18097 7 Felipe Diaz-Griffero . . . 18097 8 Dmitri Ivanov . N. . 18097 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID 1 'not applicable' 'not applicable' . 18097 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'innate immunity' . 18097 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 18097 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 326 18097 '15N chemical shifts' 143 18097 '1H chemical shifts' 341 18097 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 . . 2013-02-14 2011-11-21 update BMRB 'update entry citation' 18097 1 . . 2012-08-06 2011-11-21 original author 'original release' 18097 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2LM3 'BMRB Entry Tracking System' 18097 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 18097 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 22847415 _Citation.Full_citation . _Citation.Title 'Structure of the rhesus monkey TRIM5 PRYSPRY domain, the HIV capsid recognition module.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Proc. Natl. Acad. Sci. U.S.A.' _Citation.Journal_name_full 'Proceedings of the National Academy of Sciences of the United States of America' _Citation.Journal_volume 109 _Citation.Journal_issue 33 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 13278 _Citation.Page_last 13283 _Citation.Year 2012 _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.Entry_ID _Citation_author.Citation_ID 1 Nikolaos Biris . . . 18097 1 2 Yang Yang . . . 18097 1 3 Alexander Taylor . B. . 18097 1 4 Andrei Tomashevski . . . 18097 1 5 Miao Guo . . . 18097 1 6 'P. John' Hart . . . 18097 1 7 Felipe Diaz-Griffero . . . 18097 1 8 Dmitri Ivanov . N. . 18097 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID HIV 18097 1 SPRY 18097 1 trim5a 18097 1 'Tripartite motif' 18097 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 18097 _Assembly.ID 1 _Assembly.Name 'rhesus SPRY domain' _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass 23342 _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 'rhesus SPRY' 1 $SPRY A . yes native no no . . . 18097 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_SPRY _Entity.Sf_category entity _Entity.Sf_framecode SPRY _Entity.Entry_ID 18097 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name SPRY _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GTELTDARRYWVDVTLATNN ISHAVIAEDKRQVSSRNPQI MYQAPGTLFTFPSLTNFNYC TGVLGSQSITSGKHYWEVDV SKKSAWILGVCAGFQSDAMY NIEQNENYQPKYGYWVIGLQ EGVKYSVFQDGSSHTPFAPF IVPLSVIICPDRVGVFVDYE ACTVSFFNITNHGFLIYKFS QCSFSKPVFPYLNPRKCTVP MTLCSPSS ; _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 208 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _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 2015-11-25 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 2LM3 . "Structure Of The Rhesus Monkey Trim5alpha Pryspry Domain" . . . . . 100.00 208 100.00 100.00 1.80e-152 . . . . 18097 1 2 no PDB 4B3N . "Crystal Structure Of Rhesus Trim5alpha PrySPRY DOMAIN" . . . . . 97.12 602 100.00 100.00 2.62e-145 . . . . 18097 1 3 no GB AAS48505 . "tripartite motif-containing 5 alpha isoform [Macaca mulatta]" . . . . . 99.04 497 100.00 100.00 1.81e-150 . . . . 18097 1 4 no GB AAT48102 . "Trim5 alpha [Macaca mulatta]" . . . . . 99.04 497 100.00 100.00 1.60e-150 . . . . 18097 1 5 no GB AAV91976 . "TRIM5alpha [Papio anubis]" . . . . . 99.04 497 97.57 98.06 4.95e-146 . . . . 18097 1 6 no GB AAW55814 . "TRIM5, partial [Papio cynocephalus]" . . . . . 94.71 197 96.95 97.97 1.34e-137 . . . . 18097 1 7 no GB AAW55816 . "TRIM5, partial [Theropithecus gelada]" . . . . . 94.71 197 97.46 98.48 1.15e-138 . . . . 18097 1 8 no REF NP_001028082 . "tripartite motif-containing protein 5 [Macaca mulatta]" . . . . . 99.04 497 100.00 100.00 1.81e-150 . . . . 18097 1 9 no REF NP_001106102 . "tripartite motif-containing protein 5 [Papio anubis]" . . . . . 99.04 497 97.57 98.06 4.95e-146 . . . . 18097 1 10 no REF NP_001292893 . "tripartite motif containing 5 [Cercocebus atys]" . . . . . 99.04 497 97.09 97.57 4.75e-145 . . . . 18097 1 11 no REF XP_011827364 . "PREDICTED: tripartite motif-containing protein 5 [Mandrillus leucophaeus]" . . . . . 99.04 497 97.09 98.06 1.67e-145 . . . . 18097 1 12 no REF XP_011900561 . "PREDICTED: tripartite motif-containing protein 5 [Cercocebus atys]" . . . . . 99.04 497 97.09 97.57 4.75e-145 . . . . 18097 1 13 no SP Q0PF16 . "RecName: Full=Tripartite motif-containing protein 5; AltName: Full=TRIM5alpha" . . . . . 99.04 497 99.51 99.51 3.06e-149 . . . . 18097 1 14 no SP Q2YEN2 . "RecName: Full=Tripartite motif-containing protein 5; AltName: Full=TRIM5alpha" . . . . . 99.04 497 99.03 99.51 1.08e-148 . . . . 18097 1 15 no SP Q5D7J2 . "RecName: Full=Tripartite motif-containing protein 5; AltName: Full=TRIM5alpha" . . . . . 99.04 497 97.57 98.06 4.95e-146 . . . . 18097 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 290 GLY . 18097 1 2 291 THR . 18097 1 3 292 GLU . 18097 1 4 293 LEU . 18097 1 5 294 THR . 18097 1 6 295 ASP . 18097 1 7 296 ALA . 18097 1 8 297 ARG . 18097 1 9 298 ARG . 18097 1 10 299 TYR . 18097 1 11 300 TRP . 18097 1 12 301 VAL . 18097 1 13 302 ASP . 18097 1 14 303 VAL . 18097 1 15 304 THR . 18097 1 16 305 LEU . 18097 1 17 306 ALA . 18097 1 18 307 THR . 18097 1 19 308 ASN . 18097 1 20 309 ASN . 18097 1 21 310 ILE . 18097 1 22 311 SER . 18097 1 23 312 HIS . 18097 1 24 313 ALA . 18097 1 25 314 VAL . 18097 1 26 315 ILE . 18097 1 27 316 ALA . 18097 1 28 317 GLU . 18097 1 29 318 ASP . 18097 1 30 319 LYS . 18097 1 31 320 ARG . 18097 1 32 321 GLN . 18097 1 33 322 VAL . 18097 1 34 323 SER . 18097 1 35 324 SER . 18097 1 36 325 ARG . 18097 1 37 326 ASN . 18097 1 38 327 PRO . 18097 1 39 328 GLN . 18097 1 40 329 ILE . 18097 1 41 330 MET . 18097 1 42 331 TYR . 18097 1 43 332 GLN . 18097 1 44 333 ALA . 18097 1 45 334 PRO . 18097 1 46 335 GLY . 18097 1 47 336 THR . 18097 1 48 337 LEU . 18097 1 49 338 PHE . 18097 1 50 339 THR . 18097 1 51 340 PHE . 18097 1 52 341 PRO . 18097 1 53 342 SER . 18097 1 54 343 LEU . 18097 1 55 344 THR . 18097 1 56 345 ASN . 18097 1 57 346 PHE . 18097 1 58 347 ASN . 18097 1 59 348 TYR . 18097 1 60 349 CYS . 18097 1 61 350 THR . 18097 1 62 351 GLY . 18097 1 63 352 VAL . 18097 1 64 353 LEU . 18097 1 65 354 GLY . 18097 1 66 355 SER . 18097 1 67 356 GLN . 18097 1 68 357 SER . 18097 1 69 358 ILE . 18097 1 70 359 THR . 18097 1 71 360 SER . 18097 1 72 361 GLY . 18097 1 73 362 LYS . 18097 1 74 363 HIS . 18097 1 75 364 TYR . 18097 1 76 365 TRP . 18097 1 77 366 GLU . 18097 1 78 367 VAL . 18097 1 79 368 ASP . 18097 1 80 369 VAL . 18097 1 81 370 SER . 18097 1 82 371 LYS . 18097 1 83 372 LYS . 18097 1 84 373 SER . 18097 1 85 374 ALA . 18097 1 86 375 TRP . 18097 1 87 376 ILE . 18097 1 88 377 LEU . 18097 1 89 378 GLY . 18097 1 90 379 VAL . 18097 1 91 380 CYS . 18097 1 92 381 ALA . 18097 1 93 382 GLY . 18097 1 94 383 PHE . 18097 1 95 384 GLN . 18097 1 96 385 SER . 18097 1 97 386 ASP . 18097 1 98 387 ALA . 18097 1 99 388 MET . 18097 1 100 389 TYR . 18097 1 101 390 ASN . 18097 1 102 391 ILE . 18097 1 103 392 GLU . 18097 1 104 393 GLN . 18097 1 105 394 ASN . 18097 1 106 395 GLU . 18097 1 107 396 ASN . 18097 1 108 397 TYR . 18097 1 109 398 GLN . 18097 1 110 399 PRO . 18097 1 111 400 LYS . 18097 1 112 401 TYR . 18097 1 113 402 GLY . 18097 1 114 403 TYR . 18097 1 115 404 TRP . 18097 1 116 405 VAL . 18097 1 117 406 ILE . 18097 1 118 407 GLY . 18097 1 119 408 LEU . 18097 1 120 409 GLN . 18097 1 121 410 GLU . 18097 1 122 411 GLY . 18097 1 123 412 VAL . 18097 1 124 413 LYS . 18097 1 125 414 TYR . 18097 1 126 415 SER . 18097 1 127 416 VAL . 18097 1 128 417 PHE . 18097 1 129 418 GLN . 18097 1 130 419 ASP . 18097 1 131 420 GLY . 18097 1 132 421 SER . 18097 1 133 422 SER . 18097 1 134 423 HIS . 18097 1 135 424 THR . 18097 1 136 425 PRO . 18097 1 137 426 PHE . 18097 1 138 427 ALA . 18097 1 139 428 PRO . 18097 1 140 429 PHE . 18097 1 141 430 ILE . 18097 1 142 431 VAL . 18097 1 143 432 PRO . 18097 1 144 433 LEU . 18097 1 145 434 SER . 18097 1 146 435 VAL . 18097 1 147 436 ILE . 18097 1 148 437 ILE . 18097 1 149 438 CYS . 18097 1 150 439 PRO . 18097 1 151 440 ASP . 18097 1 152 441 ARG . 18097 1 153 442 VAL . 18097 1 154 443 GLY . 18097 1 155 444 VAL . 18097 1 156 445 PHE . 18097 1 157 446 VAL . 18097 1 158 447 ASP . 18097 1 159 448 TYR . 18097 1 160 449 GLU . 18097 1 161 450 ALA . 18097 1 162 451 CYS . 18097 1 163 452 THR . 18097 1 164 453 VAL . 18097 1 165 454 SER . 18097 1 166 455 PHE . 18097 1 167 456 PHE . 18097 1 168 457 ASN . 18097 1 169 458 ILE . 18097 1 170 459 THR . 18097 1 171 460 ASN . 18097 1 172 461 HIS . 18097 1 173 462 GLY . 18097 1 174 463 PHE . 18097 1 175 464 LEU . 18097 1 176 465 ILE . 18097 1 177 466 TYR . 18097 1 178 467 LYS . 18097 1 179 468 PHE . 18097 1 180 469 SER . 18097 1 181 470 GLN . 18097 1 182 471 CYS . 18097 1 183 472 SER . 18097 1 184 473 PHE . 18097 1 185 474 SER . 18097 1 186 475 LYS . 18097 1 187 476 PRO . 18097 1 188 477 VAL . 18097 1 189 478 PHE . 18097 1 190 479 PRO . 18097 1 191 480 TYR . 18097 1 192 481 LEU . 18097 1 193 482 ASN . 18097 1 194 483 PRO . 18097 1 195 484 ARG . 18097 1 196 485 LYS . 18097 1 197 486 CYS . 18097 1 198 487 THR . 18097 1 199 488 VAL . 18097 1 200 489 PRO . 18097 1 201 490 MET . 18097 1 202 491 THR . 18097 1 203 492 LEU . 18097 1 204 493 CYS . 18097 1 205 494 SER . 18097 1 206 495 PRO . 18097 1 207 496 SER . 18097 1 208 497 SER . 18097 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 18097 1 . THR 2 2 18097 1 . GLU 3 3 18097 1 . LEU 4 4 18097 1 . THR 5 5 18097 1 . ASP 6 6 18097 1 . ALA 7 7 18097 1 . ARG 8 8 18097 1 . ARG 9 9 18097 1 . TYR 10 10 18097 1 . TRP 11 11 18097 1 . VAL 12 12 18097 1 . ASP 13 13 18097 1 . VAL 14 14 18097 1 . THR 15 15 18097 1 . LEU 16 16 18097 1 . ALA 17 17 18097 1 . THR 18 18 18097 1 . ASN 19 19 18097 1 . ASN 20 20 18097 1 . ILE 21 21 18097 1 . SER 22 22 18097 1 . HIS 23 23 18097 1 . ALA 24 24 18097 1 . VAL 25 25 18097 1 . ILE 26 26 18097 1 . ALA 27 27 18097 1 . GLU 28 28 18097 1 . ASP 29 29 18097 1 . LYS 30 30 18097 1 . ARG 31 31 18097 1 . GLN 32 32 18097 1 . VAL 33 33 18097 1 . SER 34 34 18097 1 . SER 35 35 18097 1 . ARG 36 36 18097 1 . ASN 37 37 18097 1 . PRO 38 38 18097 1 . GLN 39 39 18097 1 . ILE 40 40 18097 1 . MET 41 41 18097 1 . TYR 42 42 18097 1 . GLN 43 43 18097 1 . ALA 44 44 18097 1 . PRO 45 45 18097 1 . GLY 46 46 18097 1 . THR 47 47 18097 1 . LEU 48 48 18097 1 . PHE 49 49 18097 1 . THR 50 50 18097 1 . PHE 51 51 18097 1 . PRO 52 52 18097 1 . SER 53 53 18097 1 . LEU 54 54 18097 1 . THR 55 55 18097 1 . ASN 56 56 18097 1 . PHE 57 57 18097 1 . ASN 58 58 18097 1 . TYR 59 59 18097 1 . CYS 60 60 18097 1 . THR 61 61 18097 1 . GLY 62 62 18097 1 . VAL 63 63 18097 1 . LEU 64 64 18097 1 . GLY 65 65 18097 1 . SER 66 66 18097 1 . GLN 67 67 18097 1 . SER 68 68 18097 1 . ILE 69 69 18097 1 . THR 70 70 18097 1 . SER 71 71 18097 1 . GLY 72 72 18097 1 . LYS 73 73 18097 1 . HIS 74 74 18097 1 . TYR 75 75 18097 1 . TRP 76 76 18097 1 . GLU 77 77 18097 1 . VAL 78 78 18097 1 . ASP 79 79 18097 1 . VAL 80 80 18097 1 . SER 81 81 18097 1 . LYS 82 82 18097 1 . LYS 83 83 18097 1 . SER 84 84 18097 1 . ALA 85 85 18097 1 . TRP 86 86 18097 1 . ILE 87 87 18097 1 . LEU 88 88 18097 1 . GLY 89 89 18097 1 . VAL 90 90 18097 1 . CYS 91 91 18097 1 . ALA 92 92 18097 1 . GLY 93 93 18097 1 . PHE 94 94 18097 1 . GLN 95 95 18097 1 . SER 96 96 18097 1 . ASP 97 97 18097 1 . ALA 98 98 18097 1 . MET 99 99 18097 1 . TYR 100 100 18097 1 . ASN 101 101 18097 1 . ILE 102 102 18097 1 . GLU 103 103 18097 1 . GLN 104 104 18097 1 . ASN 105 105 18097 1 . GLU 106 106 18097 1 . ASN 107 107 18097 1 . TYR 108 108 18097 1 . GLN 109 109 18097 1 . PRO 110 110 18097 1 . LYS 111 111 18097 1 . TYR 112 112 18097 1 . GLY 113 113 18097 1 . TYR 114 114 18097 1 . TRP 115 115 18097 1 . VAL 116 116 18097 1 . ILE 117 117 18097 1 . GLY 118 118 18097 1 . LEU 119 119 18097 1 . GLN 120 120 18097 1 . GLU 121 121 18097 1 . GLY 122 122 18097 1 . VAL 123 123 18097 1 . LYS 124 124 18097 1 . TYR 125 125 18097 1 . SER 126 126 18097 1 . VAL 127 127 18097 1 . PHE 128 128 18097 1 . GLN 129 129 18097 1 . ASP 130 130 18097 1 . GLY 131 131 18097 1 . SER 132 132 18097 1 . SER 133 133 18097 1 . HIS 134 134 18097 1 . THR 135 135 18097 1 . PRO 136 136 18097 1 . PHE 137 137 18097 1 . ALA 138 138 18097 1 . PRO 139 139 18097 1 . PHE 140 140 18097 1 . ILE 141 141 18097 1 . VAL 142 142 18097 1 . PRO 143 143 18097 1 . LEU 144 144 18097 1 . SER 145 145 18097 1 . VAL 146 146 18097 1 . ILE 147 147 18097 1 . ILE 148 148 18097 1 . CYS 149 149 18097 1 . PRO 150 150 18097 1 . ASP 151 151 18097 1 . ARG 152 152 18097 1 . VAL 153 153 18097 1 . GLY 154 154 18097 1 . VAL 155 155 18097 1 . PHE 156 156 18097 1 . VAL 157 157 18097 1 . ASP 158 158 18097 1 . TYR 159 159 18097 1 . GLU 160 160 18097 1 . ALA 161 161 18097 1 . CYS 162 162 18097 1 . THR 163 163 18097 1 . VAL 164 164 18097 1 . SER 165 165 18097 1 . PHE 166 166 18097 1 . PHE 167 167 18097 1 . ASN 168 168 18097 1 . ILE 169 169 18097 1 . THR 170 170 18097 1 . ASN 171 171 18097 1 . HIS 172 172 18097 1 . GLY 173 173 18097 1 . PHE 174 174 18097 1 . LEU 175 175 18097 1 . ILE 176 176 18097 1 . TYR 177 177 18097 1 . LYS 178 178 18097 1 . PHE 179 179 18097 1 . SER 180 180 18097 1 . GLN 181 181 18097 1 . CYS 182 182 18097 1 . SER 183 183 18097 1 . PHE 184 184 18097 1 . SER 185 185 18097 1 . LYS 186 186 18097 1 . PRO 187 187 18097 1 . VAL 188 188 18097 1 . PHE 189 189 18097 1 . PRO 190 190 18097 1 . TYR 191 191 18097 1 . LEU 192 192 18097 1 . ASN 193 193 18097 1 . PRO 194 194 18097 1 . ARG 195 195 18097 1 . LYS 196 196 18097 1 . CYS 197 197 18097 1 . THR 198 198 18097 1 . VAL 199 199 18097 1 . PRO 200 200 18097 1 . MET 201 201 18097 1 . THR 202 202 18097 1 . LEU 203 203 18097 1 . CYS 204 204 18097 1 . SER 205 205 18097 1 . PRO 206 206 18097 1 . SER 207 207 18097 1 . SER 208 208 18097 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 18097 _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.Subvariant _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.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $SPRY . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 18097 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source _Entity_experimental_src_list.Entry_ID 18097 _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_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _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.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $SPRY . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . . . . . . . . . . . 'pET 30a' . . . . . . 18097 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 18097 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '93% H2O/7% 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 SPRY '[U-98% 15N]' . . 1 $SPRY . . 250 . . mM . . . . 18097 1 2 H2O 'natural abundance' . . . . . . 93 . . % . . . . 18097 1 3 D2O 'natural abundance' . . . . . . 7 . . % . . . . 18097 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 18097 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '93% H2O/7% 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 SPRY '[U-99% 13C; U-99% 15N]' . . 1 $SPRY . . 250 . . mM . . . . 18097 2 2 H2O 'natural abundance' . . . . . . 93 . . % . . . . 18097 2 3 D2O 'natural abundance' . . . . . . 7 . . % . . . . 18097 2 stop_ save_ save_sample_3 _Sample.Sf_category sample _Sample.Sf_framecode sample_3 _Sample.Entry_ID 18097 _Sample.ID 3 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '93% H2O/7% 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 SPRY '[U-13C; U-15N; U-2H]' . . 1 $SPRY . . 250 . . mM . . . . 18097 3 2 H2O 'natural abundance' . . . . . . 93 . . % . . . . 18097 3 3 D2O 'natural abundance' . . . . . . 7 . . % . . . . 18097 3 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 18097 _Sample_condition_list.ID 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' 0.05 . M 18097 1 pH 7.2 . pH 18097 1 pressure 1 . atm 18097 1 temperature 298 . K 18097 1 stop_ save_ ############################ # Computer software used # ############################ save_X-PLOR_NIH _Software.Sf_category software _Software.Sf_framecode X-PLOR_NIH _Software.Entry_ID 18097 _Software.ID 1 _Software.Name 'X-PLOR NIH' _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Schwieters, Kuszewski, Tjandra and Clore' . . 18097 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 18097 1 stop_ save_ save_CARA _Software.Sf_category software _Software.Sf_framecode CARA _Software.Entry_ID 18097 _Software.ID 2 _Software.Name CARA _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Keller and Wuthrich' . . 18097 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 18097 2 'peak picking' 18097 2 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 18097 _Software.ID 3 _Software.Name NMRPipe _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 18097 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 18097 3 stop_ save_ save_TOPSPIN _Software.Sf_category software _Software.Sf_framecode TOPSPIN _Software.Entry_ID 18097 _Software.ID 4 _Software.Name TOPSPIN _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 18097 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 18097 4 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 18097 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 18097 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 18097 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker Avance . 700 . . . 18097 1 2 spectrometer_2 Bruker Avance . 600 . . . 18097 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 18097 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_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.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18097 1 2 '2D 1H-13C HSQC' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18097 1 3 '3D HNCO' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18097 1 4 '3D HNCA' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18097 1 5 '3D HN(CO)CA' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18097 1 6 '3D HNCACB' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18097 1 7 '3D HN(COCA)CB' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18097 1 8 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18097 1 9 '3D H(CCO)NH' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18097 1 10 '3D C(CO)NH' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18097 1 11 '3D 1H-13C NOESY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18097 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 18097 _Chem_shift_reference.ID 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.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . . . . . 18097 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 18097 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . . . . . 18097 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_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 18097 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_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 3 '3D HNCO' . . . 18097 1 4 '3D HNCA' . . . 18097 1 5 '3D HN(CO)CA' . . . 18097 1 6 '3D HNCACB' . . . 18097 1 7 '3D HN(COCA)CB' . . . 18097 1 8 '3D 1H-15N NOESY' . . . 18097 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_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.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 3 3 GLU H H 1 8.831 0.020 . 1 . . . A 292 GLU H . 18097 1 2 . 1 1 3 3 GLU HA H 1 3.992 0.020 . 1 . . . A 292 GLU HA . 18097 1 3 . 1 1 3 3 GLU C C 13 178.218 0.3 . 1 . . . A 292 GLU C . 18097 1 4 . 1 1 3 3 GLU CA C 13 58.828 0.3 . 1 . . . A 292 GLU CA . 18097 1 5 . 1 1 3 3 GLU N N 15 122.345 0.3 . 1 . . . A 292 GLU N . 18097 1 6 . 1 1 4 4 LEU H H 1 7.976 0.020 . 1 . . . A 293 LEU H . 18097 1 7 . 1 1 4 4 LEU C C 13 177.175 0.3 . 1 . . . A 293 LEU C . 18097 1 8 . 1 1 4 4 LEU CA C 13 57.044 0.3 . 1 . . . A 293 LEU CA . 18097 1 9 . 1 1 4 4 LEU N N 15 121.001 0.3 . 1 . . . A 293 LEU N . 18097 1 10 . 1 1 5 5 THR H H 1 7.535 0.020 . 1 . . . A 294 THR H . 18097 1 11 . 1 1 5 5 THR HA H 1 3.916 0.020 . 1 . . . A 294 THR HA . 18097 1 12 . 1 1 5 5 THR C C 13 176.200 0.3 . 1 . . . A 294 THR C . 18097 1 13 . 1 1 5 5 THR CA C 13 66.164 0.3 . 1 . . . A 294 THR CA . 18097 1 14 . 1 1 5 5 THR N N 15 113.069 0.3 . 1 . . . A 294 THR N . 18097 1 15 . 1 1 6 6 ASP H H 1 7.530 0.020 . 1 . . . A 295 ASP H . 18097 1 16 . 1 1 6 6 ASP HA H 1 4.085 0.020 . 1 . . . A 295 ASP HA . 18097 1 17 . 1 1 6 6 ASP C C 13 177.314 0.3 . 1 . . . A 295 ASP C . 18097 1 18 . 1 1 6 6 ASP CA C 13 56.808 0.3 . 1 . . . A 295 ASP CA . 18097 1 19 . 1 1 6 6 ASP N N 15 119.926 0.3 . 1 . . . A 295 ASP N . 18097 1 20 . 1 1 7 7 ALA H H 1 7.227 0.020 . 1 . . . A 296 ALA H . 18097 1 21 . 1 1 7 7 ALA HA H 1 4.109 0.020 . 1 . . . A 296 ALA HA . 18097 1 22 . 1 1 7 7 ALA C C 13 178.659 0.3 . 1 . . . A 296 ALA C . 18097 1 23 . 1 1 7 7 ALA CA C 13 54.655 0.3 . 1 . . . A 296 ALA CA . 18097 1 24 . 1 1 7 7 ALA N N 15 121.726 0.3 . 1 . . . A 296 ALA N . 18097 1 25 . 1 1 8 8 ARG H H 1 7.370 0.020 . 1 . . . A 297 ARG H . 18097 1 26 . 1 1 8 8 ARG C C 13 178.033 0.3 . 1 . . . A 297 ARG C . 18097 1 27 . 1 1 8 8 ARG CA C 13 58.424 0.3 . 1 . . . A 297 ARG CA . 18097 1 28 . 1 1 8 8 ARG N N 15 112.468 0.3 . 1 . . . A 297 ARG N . 18097 1 29 . 1 1 9 9 ARG H H 1 7.059 0.020 . 1 . . . A 298 ARG H . 18097 1 30 . 1 1 9 9 ARG HA H 1 3.832 0.020 . 1 . . . A 298 ARG HA . 18097 1 31 . 1 1 9 9 ARG C C 13 176.827 0.3 . 1 . . . A 298 ARG C . 18097 1 32 . 1 1 9 9 ARG CA C 13 58.289 0.3 . 1 . . . A 298 ARG CA . 18097 1 33 . 1 1 9 9 ARG N N 15 118.926 0.3 . 1 . . . A 298 ARG N . 18097 1 34 . 1 1 10 10 TYR H H 1 7.800 0.020 . 1 . . . A 299 TYR H . 18097 1 35 . 1 1 10 10 TYR HA H 1 4.853 0.020 . 1 . . . A 299 TYR HA . 18097 1 36 . 1 1 10 10 TYR C C 13 174.832 0.3 . 1 . . . A 299 TYR C . 18097 1 37 . 1 1 10 10 TYR CA C 13 56.943 0.3 . 1 . . . A 299 TYR CA . 18097 1 38 . 1 1 10 10 TYR N N 15 118.201 0.3 . 1 . . . A 299 TYR N . 18097 1 39 . 1 1 11 11 TRP H H 1 7.122 0.020 . 1 . . . A 300 TRP H . 18097 1 40 . 1 1 11 11 TRP HA H 1 4.577 0.020 . 1 . . . A 300 TRP HA . 18097 1 41 . 1 1 11 11 TRP C C 13 177.082 0.3 . 1 . . . A 300 TRP C . 18097 1 42 . 1 1 11 11 TRP CA C 13 58.558 0.3 . 1 . . . A 300 TRP CA . 18097 1 43 . 1 1 11 11 TRP N N 15 123.427 0.3 . 1 . . . A 300 TRP N . 18097 1 44 . 1 1 13 13 ASP H H 1 8.496 0.020 . 1 . . . A 302 ASP H . 18097 1 45 . 1 1 13 13 ASP HA H 1 4.605 0.020 . 1 . . . A 302 ASP HA . 18097 1 46 . 1 1 13 13 ASP C C 13 174.786 0.3 . 1 . . . A 302 ASP C . 18097 1 47 . 1 1 13 13 ASP CA C 13 53.005 0.3 . 1 . . . A 302 ASP CA . 18097 1 48 . 1 1 13 13 ASP N N 15 122.160 0.3 . 1 . . . A 302 ASP N . 18097 1 49 . 1 1 14 14 VAL H H 1 7.877 0.020 . 1 . . . A 303 VAL H . 18097 1 50 . 1 1 14 14 VAL HA H 1 4.096 0.020 . 1 . . . A 303 VAL HA . 18097 1 51 . 1 1 14 14 VAL C C 13 174.670 0.3 . 1 . . . A 303 VAL C . 18097 1 52 . 1 1 14 14 VAL CA C 13 62.429 0.3 . 1 . . . A 303 VAL CA . 18097 1 53 . 1 1 14 14 VAL N N 15 126.934 0.3 . 1 . . . A 303 VAL N . 18097 1 54 . 1 1 15 15 THR H H 1 8.321 0.020 . 1 . . . A 304 THR H . 18097 1 55 . 1 1 15 15 THR HA H 1 4.536 0.020 . 1 . . . A 304 THR HA . 18097 1 56 . 1 1 15 15 THR C C 13 173.951 0.3 . 1 . . . A 304 THR C . 18097 1 57 . 1 1 15 15 THR CA C 13 58.592 0.3 . 1 . . . A 304 THR CA . 18097 1 58 . 1 1 15 15 THR N N 15 114.829 0.3 . 1 . . . A 304 THR N . 18097 1 59 . 1 1 16 16 LEU H H 1 8.967 0.020 . 1 . . . A 305 LEU H . 18097 1 60 . 1 1 16 16 LEU HA H 1 4.322 0.020 . 1 . . . A 305 LEU HA . 18097 1 61 . 1 1 16 16 LEU C C 13 175.876 0.3 . 1 . . . A 305 LEU C . 18097 1 62 . 1 1 16 16 LEU CA C 13 54.526 0.3 . 1 . . . A 305 LEU CA . 18097 1 63 . 1 1 16 16 LEU N N 15 121.392 0.3 . 1 . . . A 305 LEU N . 18097 1 64 . 1 1 17 17 ALA H H 1 8.409 0.020 . 1 . . . A 306 ALA H . 18097 1 65 . 1 1 17 17 ALA HA H 1 4.385 0.020 . 1 . . . A 306 ALA HA . 18097 1 66 . 1 1 17 17 ALA C C 13 177.360 0.3 . 1 . . . A 306 ALA C . 18097 1 67 . 1 1 17 17 ALA CA C 13 50.515 0.3 . 1 . . . A 306 ALA CA . 18097 1 68 . 1 1 17 17 ALA N N 15 124.039 0.3 . 1 . . . A 306 ALA N . 18097 1 69 . 1 1 18 18 THR H H 1 8.146 0.020 . 1 . . . A 307 THR H . 18097 1 70 . 1 1 18 18 THR HA H 1 4.398 0.020 . 1 . . . A 307 THR HA . 18097 1 71 . 1 1 18 18 THR C C 13 174.206 0.3 . 1 . . . A 307 THR C . 18097 1 72 . 1 1 18 18 THR CA C 13 61.722 0.3 . 1 . . . A 307 THR CA . 18097 1 73 . 1 1 18 18 THR N N 15 114.041 0.3 . 1 . . . A 307 THR N . 18097 1 74 . 1 1 19 19 ASN H H 1 8.470 0.020 . 1 . . . A 308 ASN H . 18097 1 75 . 1 1 19 19 ASN HA H 1 4.687 0.020 . 1 . . . A 308 ASN HA . 18097 1 76 . 1 1 19 19 ASN C C 13 174.577 0.3 . 1 . . . A 308 ASN C . 18097 1 77 . 1 1 19 19 ASN CA C 13 52.871 0.3 . 1 . . . A 308 ASN CA . 18097 1 78 . 1 1 19 19 ASN N N 15 119.841 0.3 . 1 . . . A 308 ASN N . 18097 1 79 . 1 1 38 38 PRO HA H 1 4.207 0.020 . 1 . . . A 327 PRO HA . 18097 1 80 . 1 1 38 38 PRO HB2 H 1 2.036 0.020 . 2 . . . A 327 PRO HB2 . 18097 1 81 . 1 1 38 38 PRO HB3 H 1 1.958 0.020 . 2 . . . A 327 PRO HB3 . 18097 1 82 . 1 1 38 38 PRO HG2 H 1 1.735 0.020 . 1 . . . A 327 PRO HG2 . 18097 1 83 . 1 1 38 38 PRO HG3 H 1 1.735 0.020 . 1 . . . A 327 PRO HG3 . 18097 1 84 . 1 1 38 38 PRO HD2 H 1 3.638 0.020 . 1 . . . A 327 PRO HD2 . 18097 1 85 . 1 1 38 38 PRO HD3 H 1 3.638 0.020 . 1 . . . A 327 PRO HD3 . 18097 1 86 . 1 1 38 38 PRO C C 13 176.641 0.3 . 1 . . . A 327 PRO C . 18097 1 87 . 1 1 38 38 PRO CA C 13 63.443 0.3 . 1 . . . A 327 PRO CA . 18097 1 88 . 1 1 38 38 PRO CB C 13 31.714 0.3 . 1 . . . A 327 PRO CB . 18097 1 89 . 1 1 38 38 PRO CG C 13 26.649 0.3 . 1 . . . A 327 PRO CG . 18097 1 90 . 1 1 39 39 GLN H H 1 8.139 0.020 . 1 . . . A 328 GLN H . 18097 1 91 . 1 1 39 39 GLN HA H 1 4.111 0.020 . 1 . . . A 328 GLN HA . 18097 1 92 . 1 1 39 39 GLN HB2 H 1 1.979 0.020 . 2 . . . A 328 GLN HB2 . 18097 1 93 . 1 1 39 39 GLN HB3 H 1 1.836 0.020 . 2 . . . A 328 GLN HB3 . 18097 1 94 . 1 1 39 39 GLN HG2 H 1 2.209 0.020 . 1 . . . A 328 GLN HG2 . 18097 1 95 . 1 1 39 39 GLN HG3 H 1 2.209 0.020 . 1 . . . A 328 GLN HG3 . 18097 1 96 . 1 1 39 39 GLN C C 13 175.853 0.3 . 1 . . . A 328 GLN C . 18097 1 97 . 1 1 39 39 GLN CA C 13 56.136 0.3 . 1 . . . A 328 GLN CA . 18097 1 98 . 1 1 39 39 GLN CB C 13 28.981 0.3 . 1 . . . A 328 GLN CB . 18097 1 99 . 1 1 39 39 GLN CG C 13 33.996 0.3 . 1 . . . A 328 GLN CG . 18097 1 100 . 1 1 39 39 GLN N N 15 118.424 0.3 . 1 . . . A 328 GLN N . 18097 1 101 . 1 1 40 40 ILE H H 1 7.688 0.020 . 1 . . . A 329 ILE H . 18097 1 102 . 1 1 40 40 ILE HA H 1 3.998 0.020 . 1 . . . A 329 ILE HA . 18097 1 103 . 1 1 40 40 ILE HB H 1 1.709 0.020 . 1 . . . A 329 ILE HB . 18097 1 104 . 1 1 40 40 ILE HG12 H 1 1.286 0.020 . 1 . . . A 329 ILE HG12 . 18097 1 105 . 1 1 40 40 ILE HG21 H 1 0.989 0.020 . 1 . . . A 329 ILE HG21 . 18097 1 106 . 1 1 40 40 ILE HG22 H 1 0.989 0.020 . 1 . . . A 329 ILE HG22 . 18097 1 107 . 1 1 40 40 ILE HG23 H 1 0.989 0.020 . 1 . . . A 329 ILE HG23 . 18097 1 108 . 1 1 40 40 ILE HD11 H 1 0.653 0.020 . 1 . . . A 329 ILE HD11 . 18097 1 109 . 1 1 40 40 ILE HD12 H 1 0.653 0.020 . 1 . . . A 329 ILE HD12 . 18097 1 110 . 1 1 40 40 ILE HD13 H 1 0.653 0.020 . 1 . . . A 329 ILE HD13 . 18097 1 111 . 1 1 40 40 ILE C C 13 175.690 0.3 . 1 . . . A 329 ILE C . 18097 1 112 . 1 1 40 40 ILE CA C 13 60.601 0.3 . 1 . . . A 329 ILE CA . 18097 1 113 . 1 1 40 40 ILE CB C 13 38.274 0.3 . 1 . . . A 329 ILE CB . 18097 1 114 . 1 1 40 40 ILE CG1 C 13 27.041 0.3 . 1 . . . A 329 ILE CG1 . 18097 1 115 . 1 1 40 40 ILE CG2 C 13 17.676 0.3 . 1 . . . A 329 ILE CG2 . 18097 1 116 . 1 1 40 40 ILE CD1 C 13 12.645 0.3 . 1 . . . A 329 ILE CD1 . 18097 1 117 . 1 1 40 40 ILE N N 15 119.966 0.3 . 1 . . . A 329 ILE N . 18097 1 118 . 1 1 41 41 MET H H 1 8.044 0.020 . 1 . . . A 330 MET H . 18097 1 119 . 1 1 41 41 MET HA H 1 4.286 0.020 . 1 . . . A 330 MET HA . 18097 1 120 . 1 1 41 41 MET HB2 H 1 1.769 0.020 . 1 . . . A 330 MET HB2 . 18097 1 121 . 1 1 41 41 MET HB3 H 1 1.769 0.020 . 1 . . . A 330 MET HB3 . 18097 1 122 . 1 1 41 41 MET HG2 H 1 2.237 0.020 . 1 . . . A 330 MET HG2 . 18097 1 123 . 1 1 41 41 MET HG3 H 1 2.237 0.020 . 1 . . . A 330 MET HG3 . 18097 1 124 . 1 1 41 41 MET HE1 H 1 1.840 0.020 . 1 . . . A 330 MET HE1 . 18097 1 125 . 1 1 41 41 MET HE2 H 1 1.840 0.020 . 1 . . . A 330 MET HE2 . 18097 1 126 . 1 1 41 41 MET HE3 H 1 1.840 0.020 . 1 . . . A 330 MET HE3 . 18097 1 127 . 1 1 41 41 MET C C 13 175.389 0.3 . 1 . . . A 330 MET C . 18097 1 128 . 1 1 41 41 MET CA C 13 55.046 0.3 . 1 . . . A 330 MET CA . 18097 1 129 . 1 1 41 41 MET CB C 13 32.499 0.3 . 1 . . . A 330 MET CB . 18097 1 130 . 1 1 41 41 MET CG C 13 31.730 0.3 . 1 . . . A 330 MET CG . 18097 1 131 . 1 1 41 41 MET CE C 13 16.586 0.3 . 1 . . . A 330 MET CE . 18097 1 132 . 1 1 41 41 MET N N 15 123.189 0.3 . 1 . . . A 330 MET N . 18097 1 133 . 1 1 42 42 TYR H H 1 8.024 0.020 . 1 . . . A 331 TYR H . 18097 1 134 . 1 1 42 42 TYR HA H 1 4.398 0.020 . 1 . . . A 331 TYR HA . 18097 1 135 . 1 1 42 42 TYR HB2 H 1 2.794 0.020 . 1 . . . A 331 TYR HB2 . 18097 1 136 . 1 1 42 42 TYR HB3 H 1 2.794 0.020 . 1 . . . A 331 TYR HB3 . 18097 1 137 . 1 1 42 42 TYR HD1 H 1 6.918 0.020 . 1 . . . A 331 TYR HD1 . 18097 1 138 . 1 1 42 42 TYR HD2 H 1 6.918 0.020 . 1 . . . A 331 TYR HD2 . 18097 1 139 . 1 1 42 42 TYR C C 13 174.879 0.3 . 1 . . . A 331 TYR C . 18097 1 140 . 1 1 42 42 TYR CA C 13 57.599 0.3 . 1 . . . A 331 TYR CA . 18097 1 141 . 1 1 42 42 TYR CB C 13 38.825 0.3 . 1 . . . A 331 TYR CB . 18097 1 142 . 1 1 42 42 TYR N N 15 121.297 0.3 . 1 . . . A 331 TYR N . 18097 1 143 . 1 1 43 43 GLN H H 1 7.894 0.020 . 1 . . . A 332 GLN H . 18097 1 144 . 1 1 43 43 GLN HA H 1 4.148 0.020 . 1 . . . A 332 GLN HA . 18097 1 145 . 1 1 43 43 GLN HB2 H 1 1.844 0.020 . 2 . . . A 332 GLN HB2 . 18097 1 146 . 1 1 43 43 GLN HB3 H 1 1.707 0.020 . 2 . . . A 332 GLN HB3 . 18097 1 147 . 1 1 43 43 GLN HG2 H 1 2.075 0.020 . 1 . . . A 332 GLN HG2 . 18097 1 148 . 1 1 43 43 GLN HG3 H 1 2.075 0.020 . 1 . . . A 332 GLN HG3 . 18097 1 149 . 1 1 43 43 GLN C C 13 174.345 0.3 . 1 . . . A 332 GLN C . 18097 1 150 . 1 1 43 43 GLN CA C 13 54.714 0.3 . 1 . . . A 332 GLN CA . 18097 1 151 . 1 1 43 43 GLN CB C 13 29.741 0.3 . 1 . . . A 332 GLN CB . 18097 1 152 . 1 1 43 43 GLN CG C 13 33.461 0.3 . 1 . . . A 332 GLN CG . 18097 1 153 . 1 1 43 43 GLN N N 15 122.431 0.3 . 1 . . . A 332 GLN N . 18097 1 154 . 1 1 44 44 ALA H H 1 8.141 0.020 . 1 . . . A 333 ALA H . 18097 1 155 . 1 1 44 44 ALA HA H 1 4.367 0.020 . 1 . . . A 333 ALA HA . 18097 1 156 . 1 1 44 44 ALA HB1 H 1 1.229 0.020 . 1 . . . A 333 ALA HB1 . 18097 1 157 . 1 1 44 44 ALA HB2 H 1 1.229 0.020 . 1 . . . A 333 ALA HB2 . 18097 1 158 . 1 1 44 44 ALA HB3 H 1 1.229 0.020 . 1 . . . A 333 ALA HB3 . 18097 1 159 . 1 1 44 44 ALA C C 13 175.459 0.3 . 1 . . . A 333 ALA C . 18097 1 160 . 1 1 44 44 ALA CA C 13 50.358 0.3 . 1 . . . A 333 ALA CA . 18097 1 161 . 1 1 44 44 ALA CB C 13 17.603 0.3 . 1 . . . A 333 ALA CB . 18097 1 162 . 1 1 44 44 ALA N N 15 126.670 0.3 . 1 . . . A 333 ALA N . 18097 1 163 . 1 1 45 45 PRO HA H 1 4.273 0.020 . 1 . . . A 334 PRO HA . 18097 1 164 . 1 1 45 45 PRO HB2 H 1 2.129 0.020 . 2 . . . A 334 PRO HB2 . 18097 1 165 . 1 1 45 45 PRO HB3 H 1 1.804 0.020 . 2 . . . A 334 PRO HB3 . 18097 1 166 . 1 1 45 45 PRO HG2 H 1 1.979 0.020 . 2 . . . A 334 PRO HG2 . 18097 1 167 . 1 1 45 45 PRO HG3 H 1 1.921 0.020 . 2 . . . A 334 PRO HG3 . 18097 1 168 . 1 1 45 45 PRO HD2 H 1 3.725 0.020 . 2 . . . A 334 PRO HD2 . 18097 1 169 . 1 1 45 45 PRO HD3 H 1 3.551 0.020 . 2 . . . A 334 PRO HD3 . 18097 1 170 . 1 1 45 45 PRO CA C 13 63.318 0.3 . 1 . . . A 334 PRO CA . 18097 1 171 . 1 1 45 45 PRO CB C 13 31.697 0.3 . 1 . . . A 334 PRO CB . 18097 1 172 . 1 1 45 45 PRO CG C 13 27.238 0.3 . 1 . . . A 334 PRO CG . 18097 1 173 . 1 1 45 45 PRO CD C 13 50.280 0.3 . 1 . . . A 334 PRO CD . 18097 1 174 . 1 1 46 46 GLY H H 1 8.478 0.020 . 1 . . . A 335 GLY H . 18097 1 175 . 1 1 46 46 GLY HA2 H 1 3.965 0.020 . 2 . . . A 335 GLY HA2 . 18097 1 176 . 1 1 46 46 GLY HA3 H 1 3.758 0.020 . 2 . . . A 335 GLY HA3 . 18097 1 177 . 1 1 46 46 GLY C C 13 174.322 0.3 . 1 . . . A 335 GLY C . 18097 1 178 . 1 1 46 46 GLY CA C 13 45.255 0.3 . 1 . . . A 335 GLY CA . 18097 1 179 . 1 1 46 46 GLY N N 15 109.630 0.3 . 1 . . . A 335 GLY N . 18097 1 180 . 1 1 47 47 THR H H 1 7.734 0.020 . 1 . . . A 336 THR H . 18097 1 181 . 1 1 47 47 THR HA H 1 4.210 0.020 . 1 . . . A 336 THR HA . 18097 1 182 . 1 1 47 47 THR HB H 1 4.036 0.020 . 1 . . . A 336 THR HB . 18097 1 183 . 1 1 47 47 THR HG21 H 1 0.998 0.020 . 1 . . . A 336 THR HG21 . 18097 1 184 . 1 1 47 47 THR HG22 H 1 0.998 0.020 . 1 . . . A 336 THR HG22 . 18097 1 185 . 1 1 47 47 THR HG23 H 1 0.998 0.020 . 1 . . . A 336 THR HG23 . 18097 1 186 . 1 1 47 47 THR C C 13 174.067 0.3 . 1 . . . A 336 THR C . 18097 1 187 . 1 1 47 47 THR CA C 13 61.547 0.3 . 1 . . . A 336 THR CA . 18097 1 188 . 1 1 47 47 THR CB C 13 69.516 0.3 . 1 . . . A 336 THR CB . 18097 1 189 . 1 1 47 47 THR CG2 C 13 21.160 0.3 . 1 . . . A 336 THR CG2 . 18097 1 190 . 1 1 47 47 THR N N 15 113.015 0.3 . 1 . . . A 336 THR N . 18097 1 191 . 1 1 48 48 LEU H H 1 8.087 0.020 . 1 . . . A 337 LEU H . 18097 1 192 . 1 1 48 48 LEU HA H 1 4.152 0.020 . 1 . . . A 337 LEU HA . 18097 1 193 . 1 1 48 48 LEU HB2 H 1 1.381 0.020 . 2 . . . A 337 LEU HB2 . 18097 1 194 . 1 1 48 48 LEU HB3 H 1 1.312 0.020 . 2 . . . A 337 LEU HB3 . 18097 1 195 . 1 1 48 48 LEU HG H 1 1.391 0.020 . 1 . . . A 337 LEU HG . 18097 1 196 . 1 1 48 48 LEU HD11 H 1 0.672 0.020 . 2 . . . A 337 LEU HD11 . 18097 1 197 . 1 1 48 48 LEU HD12 H 1 0.672 0.020 . 2 . . . A 337 LEU HD12 . 18097 1 198 . 1 1 48 48 LEU HD13 H 1 0.672 0.020 . 2 . . . A 337 LEU HD13 . 18097 1 199 . 1 1 48 48 LEU HD21 H 1 0.672 0.020 . 2 . . . A 337 LEU HD21 . 18097 1 200 . 1 1 48 48 LEU HD22 H 1 0.672 0.020 . 2 . . . A 337 LEU HD22 . 18097 1 201 . 1 1 48 48 LEU HD23 H 1 0.672 0.020 . 2 . . . A 337 LEU HD23 . 18097 1 202 . 1 1 48 48 LEU C C 13 176.618 0.3 . 1 . . . A 337 LEU C . 18097 1 203 . 1 1 48 48 LEU CA C 13 55.025 0.3 . 1 . . . A 337 LEU CA . 18097 1 204 . 1 1 48 48 LEU CB C 13 42.098 0.3 . 1 . . . A 337 LEU CB . 18097 1 205 . 1 1 48 48 LEU CG C 13 26.810 0.3 . 1 . . . A 337 LEU CG . 18097 1 206 . 1 1 48 48 LEU CD1 C 13 23.398 0.3 . 1 . . . A 337 LEU CD1 . 18097 1 207 . 1 1 48 48 LEU CD2 C 13 23.134 0.3 . 1 . . . A 337 LEU CD2 . 18097 1 208 . 1 1 48 48 LEU N N 15 123.635 0.3 . 1 . . . A 337 LEU N . 18097 1 209 . 1 1 49 49 PHE H H 1 8.017 0.020 . 1 . . . A 338 PHE H . 18097 1 210 . 1 1 49 49 PHE HA H 1 4.496 0.020 . 1 . . . A 338 PHE HA . 18097 1 211 . 1 1 49 49 PHE HB2 H 1 2.911 0.020 . 2 . . . A 338 PHE HB2 . 18097 1 212 . 1 1 49 49 PHE HB3 H 1 2.814 0.020 . 2 . . . A 338 PHE HB3 . 18097 1 213 . 1 1 49 49 PHE HD1 H 1 7.028 0.020 . 1 . . . A 338 PHE HD1 . 18097 1 214 . 1 1 49 49 PHE HD2 H 1 7.028 0.020 . 1 . . . A 338 PHE HD2 . 18097 1 215 . 1 1 49 49 PHE C C 13 175.227 0.3 . 1 . . . A 338 PHE C . 18097 1 216 . 1 1 49 49 PHE CA C 13 57.234 0.3 . 1 . . . A 338 PHE CA . 18097 1 217 . 1 1 49 49 PHE CB C 13 39.290 0.3 . 1 . . . A 338 PHE CB . 18097 1 218 . 1 1 49 49 PHE N N 15 120.255 0.3 . 1 . . . A 338 PHE N . 18097 1 219 . 1 1 50 50 THR H H 1 7.741 0.020 . 1 . . . A 339 THR H . 18097 1 220 . 1 1 50 50 THR HA H 1 4.137 0.020 . 1 . . . A 339 THR HA . 18097 1 221 . 1 1 50 50 THR HB H 1 3.906 0.020 . 1 . . . A 339 THR HB . 18097 1 222 . 1 1 50 50 THR HG21 H 1 0.936 0.020 . 1 . . . A 339 THR HG21 . 18097 1 223 . 1 1 50 50 THR HG22 H 1 0.936 0.020 . 1 . . . A 339 THR HG22 . 18097 1 224 . 1 1 50 50 THR HG23 H 1 0.936 0.020 . 1 . . . A 339 THR HG23 . 18097 1 225 . 1 1 50 50 THR C C 13 173.255 0.3 . 1 . . . A 339 THR C . 18097 1 226 . 1 1 50 50 THR CA C 13 61.244 0.3 . 1 . . . A 339 THR CA . 18097 1 227 . 1 1 50 50 THR CB C 13 69.643 0.3 . 1 . . . A 339 THR CB . 18097 1 228 . 1 1 50 50 THR CG2 C 13 21.204 0.3 . 1 . . . A 339 THR CG2 . 18097 1 229 . 1 1 50 50 THR N N 15 115.141 0.3 . 1 . . . A 339 THR N . 18097 1 230 . 1 1 51 51 PHE H H 1 7.996 0.020 . 1 . . . A 340 PHE H . 18097 1 231 . 1 1 51 51 PHE HA H 1 4.571 0.020 . 1 . . . A 340 PHE HA . 18097 1 232 . 1 1 51 51 PHE HB2 H 1 2.992 0.020 . 1 . . . A 340 PHE HB2 . 18097 1 233 . 1 1 51 51 PHE HB3 H 1 2.992 0.020 . 1 . . . A 340 PHE HB3 . 18097 1 234 . 1 1 51 51 PHE HD1 H 1 6.794 0.020 . 1 . . . A 340 PHE HD1 . 18097 1 235 . 1 1 51 51 PHE HD2 H 1 6.794 0.020 . 1 . . . A 340 PHE HD2 . 18097 1 236 . 1 1 51 51 PHE HE1 H 1 7.110 0.020 . 1 . . . A 340 PHE HE1 . 18097 1 237 . 1 1 51 51 PHE HE2 H 1 7.110 0.020 . 1 . . . A 340 PHE HE2 . 18097 1 238 . 1 1 51 51 PHE C C 13 173.858 0.3 . 1 . . . A 340 PHE C . 18097 1 239 . 1 1 51 51 PHE CA C 13 56.874 0.3 . 1 . . . A 340 PHE CA . 18097 1 240 . 1 1 51 51 PHE CB C 13 39.250 0.3 . 1 . . . A 340 PHE CB . 18097 1 241 . 1 1 51 51 PHE N N 15 122.603 0.3 . 1 . . . A 340 PHE N . 18097 1 242 . 1 1 52 52 PRO HA H 1 4.278 0.020 . 1 . . . A 341 PRO HA . 18097 1 243 . 1 1 52 52 PRO HB2 H 1 2.050 0.020 . 2 . . . A 341 PRO HB2 . 18097 1 244 . 1 1 52 52 PRO HB3 H 1 1.780 0.020 . 2 . . . A 341 PRO HB3 . 18097 1 245 . 1 1 52 52 PRO HG2 H 1 1.839 0.020 . 1 . . . A 341 PRO HG2 . 18097 1 246 . 1 1 52 52 PRO HG3 H 1 1.839 0.020 . 1 . . . A 341 PRO HG3 . 18097 1 247 . 1 1 52 52 PRO HD2 H 1 3.638 0.020 . 2 . . . A 341 PRO HD2 . 18097 1 248 . 1 1 52 52 PRO HD3 H 1 3.427 0.020 . 2 . . . A 341 PRO HD3 . 18097 1 249 . 1 1 52 52 PRO CA C 13 63.297 0.3 . 1 . . . A 341 PRO CA . 18097 1 250 . 1 1 52 52 PRO CB C 13 31.190 0.3 . 1 . . . A 341 PRO CB . 18097 1 251 . 1 1 52 52 PRO CG C 13 26.750 0.3 . 1 . . . A 341 PRO CG . 18097 1 252 . 1 1 52 52 PRO CD C 13 50.279 0.3 . 1 . . . A 341 PRO CD . 18097 1 253 . 1 1 53 53 SER H H 1 8.119 0.020 . 1 . . . A 342 SER H . 18097 1 254 . 1 1 53 53 SER HA H 1 4.334 0.020 . 1 . . . A 342 SER HA . 18097 1 255 . 1 1 53 53 SER HB2 H 1 3.780 0.020 . 2 . . . A 342 SER HB2 . 18097 1 256 . 1 1 53 53 SER HB3 H 1 3.727 0.020 . 2 . . . A 342 SER HB3 . 18097 1 257 . 1 1 53 53 SER C C 13 174.508 0.3 . 1 . . . A 342 SER C . 18097 1 258 . 1 1 53 53 SER CA C 13 58.019 0.3 . 1 . . . A 342 SER CA . 18097 1 259 . 1 1 53 53 SER CB C 13 63.587 0.3 . 1 . . . A 342 SER CB . 18097 1 260 . 1 1 53 53 SER N N 15 114.918 0.3 . 1 . . . A 342 SER N . 18097 1 261 . 1 1 54 54 LEU H H 1 8.180 0.020 . 1 . . . A 343 LEU H . 18097 1 262 . 1 1 54 54 LEU HA H 1 4.307 0.020 . 1 . . . A 343 LEU HA . 18097 1 263 . 1 1 54 54 LEU HB2 H 1 1.558 0.020 . 2 . . . A 343 LEU HB2 . 18097 1 264 . 1 1 54 54 LEU HB3 H 1 1.505 0.020 . 2 . . . A 343 LEU HB3 . 18097 1 265 . 1 1 54 54 LEU HG H 1 1.508 0.020 . 1 . . . A 343 LEU HG . 18097 1 266 . 1 1 54 54 LEU HD11 H 1 0.750 0.020 . 2 . . . A 343 LEU HD11 . 18097 1 267 . 1 1 54 54 LEU HD12 H 1 0.750 0.020 . 2 . . . A 343 LEU HD12 . 18097 1 268 . 1 1 54 54 LEU HD13 H 1 0.750 0.020 . 2 . . . A 343 LEU HD13 . 18097 1 269 . 1 1 54 54 LEU HD21 H 1 0.708 0.020 . 2 . . . A 343 LEU HD21 . 18097 1 270 . 1 1 54 54 LEU HD22 H 1 0.708 0.020 . 2 . . . A 343 LEU HD22 . 18097 1 271 . 1 1 54 54 LEU HD23 H 1 0.708 0.020 . 2 . . . A 343 LEU HD23 . 18097 1 272 . 1 1 54 54 LEU C C 13 177.314 0.3 . 1 . . . A 343 LEU C . 18097 1 273 . 1 1 54 54 LEU CA C 13 55.224 0.3 . 1 . . . A 343 LEU CA . 18097 1 274 . 1 1 54 54 LEU CB C 13 41.934 0.3 . 1 . . . A 343 LEU CB . 18097 1 275 . 1 1 54 54 LEU CG C 13 26.860 0.3 . 1 . . . A 343 LEU CG . 18097 1 276 . 1 1 54 54 LEU CD1 C 13 24.867 0.3 . 1 . . . A 343 LEU CD1 . 18097 1 277 . 1 1 54 54 LEU CD2 C 13 23.088 0.3 . 1 . . . A 343 LEU CD2 . 18097 1 278 . 1 1 54 54 LEU N N 15 123.426 0.3 . 1 . . . A 343 LEU N . 18097 1 279 . 1 1 55 55 THR H H 1 7.911 0.020 . 1 . . . A 344 THR H . 18097 1 280 . 1 1 55 55 THR HA H 1 4.144 0.020 . 1 . . . A 344 THR HA . 18097 1 281 . 1 1 55 55 THR HB H 1 4.019 0.020 . 1 . . . A 344 THR HB . 18097 1 282 . 1 1 55 55 THR HG21 H 1 0.984 0.020 . 1 . . . A 344 THR HG21 . 18097 1 283 . 1 1 55 55 THR HG22 H 1 0.984 0.020 . 1 . . . A 344 THR HG22 . 18097 1 284 . 1 1 55 55 THR HG23 H 1 0.984 0.020 . 1 . . . A 344 THR HG23 . 18097 1 285 . 1 1 55 55 THR C C 13 173.928 0.3 . 1 . . . A 344 THR C . 18097 1 286 . 1 1 55 55 THR CA C 13 61.565 0.3 . 1 . . . A 344 THR CA . 18097 1 287 . 1 1 55 55 THR CB C 13 69.396 0.3 . 1 . . . A 344 THR CB . 18097 1 288 . 1 1 55 55 THR CG2 C 13 21.020 0.3 . 1 . . . A 344 THR CG2 . 18097 1 289 . 1 1 55 55 THR N N 15 112.921 0.3 . 1 . . . A 344 THR N . 18097 1 290 . 1 1 56 56 ASN H H 1 8.097 0.020 . 1 . . . A 345 ASN H . 18097 1 291 . 1 1 56 56 ASN HA H 1 4.482 0.020 . 1 . . . A 345 ASN HA . 18097 1 292 . 1 1 56 56 ASN HB2 H 1 2.610 0.020 . 2 . . . A 345 ASN HB2 . 18097 1 293 . 1 1 56 56 ASN HB3 H 1 2.529 0.020 . 2 . . . A 345 ASN HB3 . 18097 1 294 . 1 1 56 56 ASN C C 13 174.137 0.3 . 1 . . . A 345 ASN C . 18097 1 295 . 1 1 56 56 ASN CA C 13 52.938 0.3 . 1 . . . A 345 ASN CA . 18097 1 296 . 1 1 56 56 ASN CB C 13 38.110 0.3 . 1 . . . A 345 ASN CB . 18097 1 297 . 1 1 56 56 ASN N N 15 119.978 0.3 . 1 . . . A 345 ASN N . 18097 1 298 . 1 1 57 57 PHE H H 1 7.919 0.020 . 1 . . . A 346 PHE H . 18097 1 299 . 1 1 57 57 PHE HA H 1 4.482 0.020 . 1 . . . A 346 PHE HA . 18097 1 300 . 1 1 57 57 PHE HB3 H 1 2.809 0.020 . 1 . . . A 346 PHE HB3 . 18097 1 301 . 1 1 57 57 PHE HD1 H 1 6.959 0.020 . 1 . . . A 346 PHE HD1 . 18097 1 302 . 1 1 57 57 PHE HD2 H 1 6.959 0.020 . 1 . . . A 346 PHE HD2 . 18097 1 303 . 1 1 57 57 PHE C C 13 174.693 0.3 . 1 . . . A 346 PHE C . 18097 1 304 . 1 1 57 57 PHE CA C 13 57.381 0.3 . 1 . . . A 346 PHE CA . 18097 1 305 . 1 1 57 57 PHE CB C 13 39.313 0.3 . 1 . . . A 346 PHE CB . 18097 1 306 . 1 1 57 57 PHE N N 15 120.030 0.3 . 1 . . . A 346 PHE N . 18097 1 307 . 1 1 58 58 ASN H H 1 7.656 0.020 . 1 . . . A 347 ASN H . 18097 1 308 . 1 1 58 58 ASN CA C 13 57.145 0.3 . 1 . . . A 347 ASN CA . 18097 1 309 . 1 1 58 58 ASN N N 15 125.759 0.3 . 1 . . . A 347 ASN N . 18097 1 310 . 1 1 64 64 LEU H H 1 8.518 0.020 . 1 . . . A 353 LEU H . 18097 1 311 . 1 1 64 64 LEU HA H 1 4.398 0.020 . 1 . . . A 353 LEU HA . 18097 1 312 . 1 1 64 64 LEU C C 13 178.380 0.3 . 1 . . . A 353 LEU C . 18097 1 313 . 1 1 64 64 LEU CA C 13 51.933 0.3 . 1 . . . A 353 LEU CA . 18097 1 314 . 1 1 64 64 LEU N N 15 120.532 0.3 . 1 . . . A 353 LEU N . 18097 1 315 . 1 1 65 65 GLY H H 1 8.051 0.020 . 1 . . . A 354 GLY H . 18097 1 316 . 1 1 65 65 GLY C C 13 172.884 0.3 . 1 . . . A 354 GLY C . 18097 1 317 . 1 1 65 65 GLY CA C 13 44.491 0.3 . 1 . . . A 354 GLY CA . 18097 1 318 . 1 1 65 65 GLY N N 15 102.514 0.3 . 1 . . . A 354 GLY N . 18097 1 319 . 1 1 66 66 SER H H 1 8.724 0.020 . 1 . . . A 355 SER H . 18097 1 320 . 1 1 66 66 SER HA H 1 4.015 0.020 . 1 . . . A 355 SER HA . 18097 1 321 . 1 1 66 66 SER C C 13 174.276 0.3 . 1 . . . A 355 SER C . 18097 1 322 . 1 1 66 66 SER CA C 13 59.770 0.3 . 1 . . . A 355 SER CA . 18097 1 323 . 1 1 66 66 SER N N 15 113.869 0.3 . 1 . . . A 355 SER N . 18097 1 324 . 1 1 67 67 GLN H H 1 7.995 0.020 . 1 . . . A 356 GLN H . 18097 1 325 . 1 1 67 67 GLN HA H 1 4.474 0.020 . 1 . . . A 356 GLN HA . 18097 1 326 . 1 1 67 67 GLN C C 13 173.905 0.3 . 1 . . . A 356 GLN C . 18097 1 327 . 1 1 67 67 GLN CA C 13 54.655 0.3 . 1 . . . A 356 GLN CA . 18097 1 328 . 1 1 67 67 GLN N N 15 121.985 0.3 . 1 . . . A 356 GLN N . 18097 1 329 . 1 1 68 68 SER H H 1 8.145 0.020 . 1 . . . A 357 SER H . 18097 1 330 . 1 1 68 68 SER HA H 1 4.852 0.020 . 1 . . . A 357 SER HA . 18097 1 331 . 1 1 68 68 SER C C 13 173.835 0.3 . 1 . . . A 357 SER C . 18097 1 332 . 1 1 68 68 SER CA C 13 56.472 0.3 . 1 . . . A 357 SER CA . 18097 1 333 . 1 1 68 68 SER N N 15 118.695 0.3 . 1 . . . A 357 SER N . 18097 1 334 . 1 1 69 69 ILE H H 1 8.813 0.020 . 1 . . . A 358 ILE H . 18097 1 335 . 1 1 69 69 ILE C C 13 175.018 0.3 . 1 . . . A 358 ILE C . 18097 1 336 . 1 1 69 69 ILE CA C 13 60.780 0.3 . 1 . . . A 358 ILE CA . 18097 1 337 . 1 1 69 69 ILE N N 15 123.370 0.3 . 1 . . . A 358 ILE N . 18097 1 338 . 1 1 70 70 THR H H 1 8.250 0.020 . 1 . . . A 359 THR H . 18097 1 339 . 1 1 70 70 THR HA H 1 3.967 0.020 . 1 . . . A 359 THR HA . 18097 1 340 . 1 1 70 70 THR C C 13 172.026 0.3 . 1 . . . A 359 THR C . 18097 1 341 . 1 1 70 70 THR CA C 13 59.366 0.3 . 1 . . . A 359 THR CA . 18097 1 342 . 1 1 70 70 THR N N 15 113.324 0.3 . 1 . . . A 359 THR N . 18097 1 343 . 1 1 71 71 SER H H 1 6.964 0.020 . 1 . . . A 360 SER H . 18097 1 344 . 1 1 71 71 SER HA H 1 4.085 0.020 . 1 . . . A 360 SER HA . 18097 1 345 . 1 1 71 71 SER C C 13 173.835 0.3 . 1 . . . A 360 SER C . 18097 1 346 . 1 1 71 71 SER CA C 13 57.818 0.3 . 1 . . . A 360 SER CA . 18097 1 347 . 1 1 71 71 SER N N 15 111.494 0.3 . 1 . . . A 360 SER N . 18097 1 348 . 1 1 72 72 GLY H H 1 10.408 0.020 . 1 . . . A 361 GLY H . 18097 1 349 . 1 1 72 72 GLY HA2 H 1 3.995 0.020 . 2 . . . A 361 GLY HA2 . 18097 1 350 . 1 1 72 72 GLY HA3 H 1 3.840 0.020 . 2 . . . A 361 GLY HA3 . 18097 1 351 . 1 1 72 72 GLY C C 13 171.400 0.3 . 1 . . . A 361 GLY C . 18097 1 352 . 1 1 72 72 GLY CA C 13 45.265 0.3 . 1 . . . A 361 GLY CA . 18097 1 353 . 1 1 72 72 GLY N N 15 112.909 0.3 . 1 . . . A 361 GLY N . 18097 1 354 . 1 1 73 73 LYS H H 1 7.310 0.020 . 1 . . . A 362 LYS H . 18097 1 355 . 1 1 73 73 LYS C C 13 175.366 0.3 . 1 . . . A 362 LYS C . 18097 1 356 . 1 1 73 73 LYS CA C 13 54.621 0.3 . 1 . . . A 362 LYS CA . 18097 1 357 . 1 1 73 73 LYS N N 15 118.005 0.3 . 1 . . . A 362 LYS N . 18097 1 358 . 1 1 74 74 HIS H H 1 8.399 0.020 . 1 . . . A 363 HIS H . 18097 1 359 . 1 1 74 74 HIS HA H 1 4.880 0.020 . 1 . . . A 363 HIS HA . 18097 1 360 . 1 1 74 74 HIS C C 13 172.467 0.3 . 1 . . . A 363 HIS C . 18097 1 361 . 1 1 74 74 HIS CA C 13 56.371 0.3 . 1 . . . A 363 HIS CA . 18097 1 362 . 1 1 74 74 HIS N N 15 118.405 0.3 . 1 . . . A 363 HIS N . 18097 1 363 . 1 1 75 75 TYR H H 1 8.153 0.020 . 1 . . . A 364 TYR H . 18097 1 364 . 1 1 75 75 TYR C C 13 172.852 0.3 . 1 . . . A 364 TYR C . 18097 1 365 . 1 1 75 75 TYR CA C 13 55.361 0.3 . 1 . . . A 364 TYR CA . 18097 1 366 . 1 1 75 75 TYR N N 15 125.182 0.3 . 1 . . . A 364 TYR N . 18097 1 367 . 1 1 76 76 TRP H H 1 7.621 0.020 . 1 . . . A 365 TRP H . 18097 1 368 . 1 1 76 76 TRP C C 13 171.510 0.3 . 1 . . . A 365 TRP C . 18097 1 369 . 1 1 76 76 TRP CA C 13 57.549 0.3 . 1 . . . A 365 TRP CA . 18097 1 370 . 1 1 76 76 TRP N N 15 123.210 0.3 . 1 . . . A 365 TRP N . 18097 1 371 . 1 1 78 78 VAL H H 1 8.910 0.020 . 1 . . . A 367 VAL H . 18097 1 372 . 1 1 78 78 VAL HA H 1 4.756 0.020 . 1 . . . A 367 VAL HA . 18097 1 373 . 1 1 78 78 VAL C C 13 174.461 0.3 . 1 . . . A 367 VAL C . 18097 1 374 . 1 1 78 78 VAL CA C 13 60.208 0.3 . 1 . . . A 367 VAL CA . 18097 1 375 . 1 1 78 78 VAL N N 15 122.416 0.3 . 1 . . . A 367 VAL N . 18097 1 376 . 1 1 79 79 ASP H H 1 9.795 0.020 . 1 . . . A 368 ASP H . 18097 1 377 . 1 1 79 79 ASP C C 13 175.343 0.3 . 1 . . . A 368 ASP C . 18097 1 378 . 1 1 79 79 ASP CA C 13 53.914 0.3 . 1 . . . A 368 ASP CA . 18097 1 379 . 1 1 79 79 ASP N N 15 128.257 0.3 . 1 . . . A 368 ASP N . 18097 1 380 . 1 1 80 80 VAL H H 1 8.394 0.020 . 1 . . . A 369 VAL H . 18097 1 381 . 1 1 80 80 VAL C C 13 176.131 0.3 . 1 . . . A 369 VAL C . 18097 1 382 . 1 1 80 80 VAL CA C 13 59.027 0.3 . 1 . . . A 369 VAL CA . 18097 1 383 . 1 1 80 80 VAL N N 15 118.519 0.3 . 1 . . . A 369 VAL N . 18097 1 384 . 1 1 81 81 SER H H 1 8.754 0.020 . 1 . . . A 370 SER H . 18097 1 385 . 1 1 81 81 SER C C 13 174.829 0.3 . 1 . . . A 370 SER C . 18097 1 386 . 1 1 81 81 SER CA C 13 61.285 0.3 . 1 . . . A 370 SER CA . 18097 1 387 . 1 1 81 81 SER N N 15 123.584 0.3 . 1 . . . A 370 SER N . 18097 1 388 . 1 1 82 82 LYS H H 1 8.789 0.020 . 1 . . . A 371 LYS H . 18097 1 389 . 1 1 82 82 LYS C C 13 175.922 0.3 . 1 . . . A 371 LYS C . 18097 1 390 . 1 1 82 82 LYS CA C 13 58.222 0.3 . 1 . . . A 371 LYS CA . 18097 1 391 . 1 1 82 82 LYS N N 15 115.025 0.3 . 1 . . . A 371 LYS N . 18097 1 392 . 1 1 83 83 LYS H H 1 7.825 0.020 . 1 . . . A 372 LYS H . 18097 1 393 . 1 1 83 83 LYS C C 13 177.824 0.3 . 1 . . . A 372 LYS C . 18097 1 394 . 1 1 83 83 LYS CA C 13 57.784 0.3 . 1 . . . A 372 LYS CA . 18097 1 395 . 1 1 83 83 LYS N N 15 117.904 0.3 . 1 . . . A 372 LYS N . 18097 1 396 . 1 1 84 84 SER H H 1 9.839 0.020 . 1 . . . A 373 SER H . 18097 1 397 . 1 1 84 84 SER HA H 1 4.348 0.020 . 1 . . . A 373 SER HA . 18097 1 398 . 1 1 84 84 SER C C 13 172.270 0.3 . 1 . . . A 373 SER C . 18097 1 399 . 1 1 84 84 SER CA C 13 58.996 0.3 . 1 . . . A 373 SER CA . 18097 1 400 . 1 1 84 84 SER N N 15 122.569 0.3 . 1 . . . A 373 SER N . 18097 1 401 . 1 1 85 85 ALA H H 1 7.130 0.020 . 1 . . . A 374 ALA H . 18097 1 402 . 1 1 85 85 ALA C C 13 174.253 0.3 . 1 . . . A 374 ALA C . 18097 1 403 . 1 1 85 85 ALA CA C 13 51.020 0.3 . 1 . . . A 374 ALA CA . 18097 1 404 . 1 1 85 85 ALA N N 15 120.821 0.3 . 1 . . . A 374 ALA N . 18097 1 405 . 1 1 86 86 TRP H H 1 7.876 0.020 . 1 . . . A 375 TRP H . 18097 1 406 . 1 1 86 86 TRP C C 13 176.096 0.3 . 1 . . . A 375 TRP C . 18097 1 407 . 1 1 86 86 TRP CA C 13 56.909 0.3 . 1 . . . A 375 TRP CA . 18097 1 408 . 1 1 86 86 TRP N N 15 109.378 0.3 . 1 . . . A 375 TRP N . 18097 1 409 . 1 1 87 87 ILE H H 1 9.270 0.020 . 1 . . . A 376 ILE H . 18097 1 410 . 1 1 87 87 ILE C C 13 175.405 0.3 . 1 . . . A 376 ILE C . 18097 1 411 . 1 1 87 87 ILE CA C 13 60.679 0.3 . 1 . . . A 376 ILE CA . 18097 1 412 . 1 1 87 87 ILE N N 15 118.409 0.3 . 1 . . . A 376 ILE N . 18097 1 413 . 1 1 88 88 LEU H H 1 9.422 0.020 . 1 . . . A 377 LEU H . 18097 1 414 . 1 1 88 88 LEU C C 13 174.967 0.3 . 1 . . . A 377 LEU C . 18097 1 415 . 1 1 88 88 LEU CA C 13 54.520 0.3 . 1 . . . A 377 LEU CA . 18097 1 416 . 1 1 88 88 LEU N N 15 122.952 0.3 . 1 . . . A 377 LEU N . 18097 1 417 . 1 1 89 89 GLY H H 1 8.366 0.020 . 1 . . . A 378 GLY H . 18097 1 418 . 1 1 89 89 GLY C C 13 171.976 0.3 . 1 . . . A 378 GLY C . 18097 1 419 . 1 1 89 89 GLY CA C 13 47.251 0.3 . 1 . . . A 378 GLY CA . 18097 1 420 . 1 1 89 89 GLY N N 15 103.446 0.3 . 1 . . . A 378 GLY N . 18097 1 421 . 1 1 90 90 VAL H H 1 9.224 0.020 . 1 . . . A 379 VAL H . 18097 1 422 . 1 1 90 90 VAL HA H 1 4.164 0.020 . 1 . . . A 379 VAL HA . 18097 1 423 . 1 1 90 90 VAL C C 13 172.847 0.3 . 1 . . . A 379 VAL C . 18097 1 424 . 1 1 90 90 VAL CA C 13 60.477 0.3 . 1 . . . A 379 VAL CA . 18097 1 425 . 1 1 90 90 VAL N N 15 130.348 0.3 . 1 . . . A 379 VAL N . 18097 1 426 . 1 1 91 91 CYS H H 1 9.398 0.020 . 1 . . . A 380 CYS H . 18097 1 427 . 1 1 91 91 CYS C C 13 173.630 0.3 . 1 . . . A 380 CYS C . 18097 1 428 . 1 1 91 91 CYS CA C 13 55.429 0.3 . 1 . . . A 380 CYS CA . 18097 1 429 . 1 1 91 91 CYS N N 15 122.658 0.3 . 1 . . . A 380 CYS N . 18097 1 430 . 1 1 92 92 ALA H H 1 9.478 0.020 . 1 . . . A 381 ALA H . 18097 1 431 . 1 1 92 92 ALA HA H 1 5.049 0.020 . 1 . . . A 381 ALA HA . 18097 1 432 . 1 1 92 92 ALA C C 13 176.479 0.3 . 1 . . . A 381 ALA C . 18097 1 433 . 1 1 92 92 ALA CA C 13 52.400 0.3 . 1 . . . A 381 ALA CA . 18097 1 434 . 1 1 92 92 ALA N N 15 127.998 0.3 . 1 . . . A 381 ALA N . 18097 1 435 . 1 1 93 93 GLY H H 1 8.194 0.020 . 1 . . . A 382 GLY H . 18097 1 436 . 1 1 93 93 GLY C C 13 173.580 0.3 . 1 . . . A 382 GLY C . 18097 1 437 . 1 1 93 93 GLY CA C 13 43.212 0.3 . 1 . . . A 382 GLY CA . 18097 1 438 . 1 1 93 93 GLY N N 15 108.533 0.3 . 1 . . . A 382 GLY N . 18097 1 439 . 1 1 94 94 PHE H H 1 8.290 0.020 . 1 . . . A 383 PHE H . 18097 1 440 . 1 1 94 94 PHE HA H 1 4.536 0.020 . 1 . . . A 383 PHE HA . 18097 1 441 . 1 1 94 94 PHE C C 13 178.079 0.3 . 1 . . . A 383 PHE C . 18097 1 442 . 1 1 94 94 PHE CA C 13 56.627 0.3 . 1 . . . A 383 PHE CA . 18097 1 443 . 1 1 94 94 PHE N N 15 116.476 0.3 . 1 . . . A 383 PHE N . 18097 1 444 . 1 1 105 105 ASN H H 1 6.912 0.020 . 1 . . . A 394 ASN H . 18097 1 445 . 1 1 105 105 ASN HA H 1 4.715 0.020 . 1 . . . A 394 ASN HA . 18097 1 446 . 1 1 105 105 ASN C C 13 173.835 0.3 . 1 . . . A 394 ASN C . 18097 1 447 . 1 1 105 105 ASN CA C 13 51.929 0.3 . 1 . . . A 394 ASN CA . 18097 1 448 . 1 1 105 105 ASN N N 15 112.033 0.3 . 1 . . . A 394 ASN N . 18097 1 449 . 1 1 106 106 GLU H H 1 7.354 0.020 . 1 . . . A 395 GLU H . 18097 1 450 . 1 1 106 106 GLU C C 13 175.574 0.3 . 1 . . . A 395 GLU C . 18097 1 451 . 1 1 106 106 GLU CA C 13 56.808 0.3 . 1 . . . A 395 GLU CA . 18097 1 452 . 1 1 106 106 GLU N N 15 117.585 0.3 . 1 . . . A 395 GLU N . 18097 1 453 . 1 1 107 107 ASN H H 1 8.082 0.020 . 1 . . . A 396 ASN H . 18097 1 454 . 1 1 107 107 ASN HA H 1 4.536 0.020 . 1 . . . A 396 ASN HA . 18097 1 455 . 1 1 107 107 ASN C C 13 173.441 0.3 . 1 . . . A 396 ASN C . 18097 1 456 . 1 1 107 107 ASN CA C 13 50.448 0.3 . 1 . . . A 396 ASN CA . 18097 1 457 . 1 1 107 107 ASN N N 15 118.664 0.3 . 1 . . . A 396 ASN N . 18097 1 458 . 1 1 108 108 TYR H H 1 6.101 0.020 . 1 . . . A 397 TYR H . 18097 1 459 . 1 1 108 108 TYR HA H 1 4.605 0.020 . 1 . . . A 397 TYR HA . 18097 1 460 . 1 1 108 108 TYR C C 13 173.186 0.3 . 1 . . . A 397 TYR C . 18097 1 461 . 1 1 108 108 TYR CA C 13 55.530 0.3 . 1 . . . A 397 TYR CA . 18097 1 462 . 1 1 108 108 TYR N N 15 117.301 0.3 . 1 . . . A 397 TYR N . 18097 1 463 . 1 1 109 109 GLN H H 1 6.115 0.020 . 1 . . . A 398 GLN H . 18097 1 464 . 1 1 109 109 GLN C C 13 175.064 0.3 . 1 . . . A 398 GLN C . 18097 1 465 . 1 1 109 109 GLN CA C 13 53.241 0.3 . 1 . . . A 398 GLN CA . 18097 1 466 . 1 1 109 109 GLN N N 15 114.934 0.3 . 1 . . . A 398 GLN N . 18097 1 467 . 1 1 111 111 LYS H H 1 10.775 0.020 . 1 . . . A 400 LYS H . 18097 1 468 . 1 1 111 111 LYS HA H 1 4.068 0.020 . 1 . . . A 400 LYS HA . 18097 1 469 . 1 1 111 111 LYS C C 13 177.244 0.3 . 1 . . . A 400 LYS C . 18097 1 470 . 1 1 111 111 LYS CA C 13 58.289 0.3 . 1 . . . A 400 LYS CA . 18097 1 471 . 1 1 111 111 LYS N N 15 120.723 0.3 . 1 . . . A 400 LYS N . 18097 1 472 . 1 1 112 112 TYR H H 1 7.647 0.020 . 1 . . . A 401 TYR H . 18097 1 473 . 1 1 112 112 TYR HA H 1 3.612 0.020 . 1 . . . A 401 TYR HA . 18097 1 474 . 1 1 112 112 TYR C C 13 175.853 0.3 . 1 . . . A 401 TYR C . 18097 1 475 . 1 1 112 112 TYR CA C 13 53.847 0.3 . 1 . . . A 401 TYR CA . 18097 1 476 . 1 1 112 112 TYR N N 15 120.182 0.3 . 1 . . . A 401 TYR N . 18097 1 477 . 1 1 113 113 GLY H H 1 8.057 0.020 . 1 . . . A 402 GLY H . 18097 1 478 . 1 1 113 113 GLY HA2 H 1 3.768 0.020 . 2 . . . A 402 GLY HA2 . 18097 1 479 . 1 1 113 113 GLY HA3 H 1 3.055 0.020 . 2 . . . A 402 GLY HA3 . 18097 1 480 . 1 1 113 113 GLY C C 13 171.679 0.3 . 1 . . . A 402 GLY C . 18097 1 481 . 1 1 113 113 GLY CA C 13 45.972 0.3 . 1 . . . A 402 GLY CA . 18097 1 482 . 1 1 113 113 GLY N N 15 107.764 0.3 . 1 . . . A 402 GLY N . 18097 1 483 . 1 1 114 114 TYR H H 1 6.585 0.020 . 1 . . . A 403 TYR H . 18097 1 484 . 1 1 114 114 TYR C C 13 173.013 0.3 . 1 . . . A 403 TYR C . 18097 1 485 . 1 1 114 114 TYR CA C 13 57.515 0.3 . 1 . . . A 403 TYR CA . 18097 1 486 . 1 1 114 114 TYR N N 15 115.659 0.3 . 1 . . . A 403 TYR N . 18097 1 487 . 1 1 115 115 TRP H H 1 8.420 0.020 . 1 . . . A 404 TRP H . 18097 1 488 . 1 1 115 115 TRP C C 13 175.405 0.3 . 1 . . . A 404 TRP C . 18097 1 489 . 1 1 115 115 TRP CA C 13 57.650 0.3 . 1 . . . A 404 TRP CA . 18097 1 490 . 1 1 115 115 TRP N N 15 125.437 0.3 . 1 . . . A 404 TRP N . 18097 1 491 . 1 1 116 116 VAL H H 1 9.825 0.020 . 1 . . . A 405 VAL H . 18097 1 492 . 1 1 116 116 VAL C C 13 174.368 0.3 . 1 . . . A 405 VAL C . 18097 1 493 . 1 1 116 116 VAL CA C 13 58.525 0.3 . 1 . . . A 405 VAL CA . 18097 1 494 . 1 1 116 116 VAL N N 15 116.317 0.3 . 1 . . . A 405 VAL N . 18097 1 495 . 1 1 117 117 ILE H H 1 8.268 0.020 . 1 . . . A 406 ILE H . 18097 1 496 . 1 1 117 117 ILE C C 13 174.879 0.3 . 1 . . . A 406 ILE C . 18097 1 497 . 1 1 117 117 ILE CA C 13 58.929 0.3 . 1 . . . A 406 ILE CA . 18097 1 498 . 1 1 117 117 ILE N N 15 110.464 0.3 . 1 . . . A 406 ILE N . 18097 1 499 . 1 1 118 118 GLY H H 1 9.115 0.020 . 1 . . . A 407 GLY H . 18097 1 500 . 1 1 118 118 GLY HA2 H 1 3.700 0.020 . 1 . . . A 407 GLY HA2 . 18097 1 501 . 1 1 118 118 GLY HA3 H 1 3.700 0.020 . 1 . . . A 407 GLY HA3 . 18097 1 502 . 1 1 118 118 GLY C C 13 169.418 0.3 . 1 . . . A 407 GLY C . 18097 1 503 . 1 1 118 118 GLY CA C 13 45.770 0.3 . 1 . . . A 407 GLY CA . 18097 1 504 . 1 1 118 118 GLY N N 15 105.424 0.3 . 1 . . . A 407 GLY N . 18097 1 505 . 1 1 119 119 LEU H H 1 7.892 0.020 . 1 . . . A 408 LEU H . 18097 1 506 . 1 1 119 119 LEU C C 13 176.224 0.3 . 1 . . . A 408 LEU C . 18097 1 507 . 1 1 119 119 LEU CA C 13 52.265 0.3 . 1 . . . A 408 LEU CA . 18097 1 508 . 1 1 119 119 LEU N N 15 118.628 0.3 . 1 . . . A 408 LEU N . 18097 1 509 . 1 1 120 120 GLN H H 1 8.375 0.020 . 1 . . . A 409 GLN H . 18097 1 510 . 1 1 120 120 GLN HA H 1 4.233 0.020 . 1 . . . A 409 GLN HA . 18097 1 511 . 1 1 120 120 GLN C C 13 173.000 0.3 . 1 . . . A 409 GLN C . 18097 1 512 . 1 1 120 120 GLN CA C 13 54.284 0.3 . 1 . . . A 409 GLN CA . 18097 1 513 . 1 1 120 120 GLN N N 15 123.541 0.3 . 1 . . . A 409 GLN N . 18097 1 514 . 1 1 121 121 GLU H H 1 8.864 0.020 . 1 . . . A 410 GLU H . 18097 1 515 . 1 1 121 121 GLU C C 13 176.800 0.3 . 1 . . . A 410 GLU C . 18097 1 516 . 1 1 121 121 GLU CA C 13 56.809 0.3 . 1 . . . A 410 GLU CA . 18097 1 517 . 1 1 121 121 GLU N N 15 117.179 0.3 . 1 . . . A 410 GLU N . 18097 1 518 . 1 1 125 125 TYR H H 1 9.145 0.020 . 1 . . . A 414 TYR H . 18097 1 519 . 1 1 125 125 TYR HA H 1 5.192 0.020 . 1 . . . A 414 TYR HA . 18097 1 520 . 1 1 125 125 TYR C C 13 176.827 0.3 . 1 . . . A 414 TYR C . 18097 1 521 . 1 1 125 125 TYR CA C 13 57.212 0.3 . 1 . . . A 414 TYR CA . 18097 1 522 . 1 1 125 125 TYR N N 15 128.783 0.3 . 1 . . . A 414 TYR N . 18097 1 523 . 1 1 126 126 SER H H 1 9.192 0.020 . 1 . . . A 415 SER H . 18097 1 524 . 1 1 126 126 SER HA H 1 5.049 0.020 . 1 . . . A 415 SER HA . 18097 1 525 . 1 1 126 126 SER C C 13 170.913 0.3 . 1 . . . A 415 SER C . 18097 1 526 . 1 1 126 126 SER CA C 13 57.482 0.3 . 1 . . . A 415 SER CA . 18097 1 527 . 1 1 126 126 SER N N 15 117.388 0.3 . 1 . . . A 415 SER N . 18097 1 528 . 1 1 127 127 VAL H H 1 8.761 0.020 . 1 . . . A 416 VAL H . 18097 1 529 . 1 1 127 127 VAL C C 13 172.653 0.3 . 1 . . . A 416 VAL C . 18097 1 530 . 1 1 127 127 VAL CA C 13 59.703 0.3 . 1 . . . A 416 VAL CA . 18097 1 531 . 1 1 127 127 VAL N N 15 119.557 0.3 . 1 . . . A 416 VAL N . 18097 1 532 . 1 1 128 128 PHE H H 1 7.150 0.020 . 1 . . . A 417 PHE H . 18097 1 533 . 1 1 128 128 PHE HA H 1 4.267 0.020 . 1 . . . A 417 PHE HA . 18097 1 534 . 1 1 128 128 PHE C C 13 174.925 0.3 . 1 . . . A 417 PHE C . 18097 1 535 . 1 1 128 128 PHE CA C 13 58.458 0.3 . 1 . . . A 417 PHE CA . 18097 1 536 . 1 1 128 128 PHE N N 15 127.341 0.3 . 1 . . . A 417 PHE N . 18097 1 537 . 1 1 129 129 GLN H H 1 8.693 0.020 . 1 . . . A 418 GLN H . 18097 1 538 . 1 1 129 129 GLN HA H 1 4.125 0.020 . 1 . . . A 418 GLN HA . 18097 1 539 . 1 1 129 129 GLN C C 13 176.038 0.3 . 1 . . . A 418 GLN C . 18097 1 540 . 1 1 129 129 GLN CA C 13 53.679 0.3 . 1 . . . A 418 GLN CA . 18097 1 541 . 1 1 129 129 GLN N N 15 122.834 0.3 . 1 . . . A 418 GLN N . 18097 1 542 . 1 1 130 130 ASP H H 1 8.425 0.020 . 1 . . . A 419 ASP H . 18097 1 543 . 1 1 130 130 ASP HA H 1 4.964 0.020 . 1 . . . A 419 ASP HA . 18097 1 544 . 1 1 130 130 ASP C C 13 178.218 0.3 . 1 . . . A 419 ASP C . 18097 1 545 . 1 1 130 130 ASP CA C 13 54.991 0.3 . 1 . . . A 419 ASP CA . 18097 1 546 . 1 1 130 130 ASP N N 15 119.994 0.3 . 1 . . . A 419 ASP N . 18097 1 547 . 1 1 131 131 GLY H H 1 8.112 0.020 . 1 . . . A 420 GLY H . 18097 1 548 . 1 1 131 131 GLY HA2 H 1 4.033 0.020 . 2 . . . A 420 GLY HA2 . 18097 1 549 . 1 1 131 131 GLY HA3 H 1 3.763 0.020 . 2 . . . A 420 GLY HA3 . 18097 1 550 . 1 1 131 131 GLY C C 13 174.415 0.3 . 1 . . . A 420 GLY C . 18097 1 551 . 1 1 131 131 GLY CA C 13 44.735 0.3 . 1 . . . A 420 GLY CA . 18097 1 552 . 1 1 131 131 GLY N N 15 107.499 0.3 . 1 . . . A 420 GLY N . 18097 1 553 . 1 1 132 132 SER H H 1 8.016 0.020 . 1 . . . A 421 SER H . 18097 1 554 . 1 1 132 132 SER C C 13 176.177 0.3 . 1 . . . A 421 SER C . 18097 1 555 . 1 1 132 132 SER CA C 13 57.515 0.3 . 1 . . . A 421 SER CA . 18097 1 556 . 1 1 132 132 SER N N 15 115.128 0.3 . 1 . . . A 421 SER N . 18097 1 557 . 1 1 137 137 PHE H H 1 7.817 0.020 . 1 . . . A 426 PHE H . 18097 1 558 . 1 1 137 137 PHE HA H 1 4.525 0.020 . 1 . . . A 426 PHE HA . 18097 1 559 . 1 1 137 137 PHE C C 13 173.511 0.3 . 1 . . . A 426 PHE C . 18097 1 560 . 1 1 137 137 PHE CA C 13 56.707 0.3 . 1 . . . A 426 PHE CA . 18097 1 561 . 1 1 137 137 PHE N N 15 115.968 0.3 . 1 . . . A 426 PHE N . 18097 1 562 . 1 1 138 138 ALA H H 1 7.451 0.020 . 1 . . . A 427 ALA H . 18097 1 563 . 1 1 138 138 ALA HA H 1 4.219 0.020 . 1 . . . A 427 ALA HA . 18097 1 564 . 1 1 138 138 ALA C C 13 173.835 0.3 . 1 . . . A 427 ALA C . 18097 1 565 . 1 1 138 138 ALA CA C 13 48.933 0.3 . 1 . . . A 427 ALA CA . 18097 1 566 . 1 1 138 138 ALA N N 15 124.435 0.3 . 1 . . . A 427 ALA N . 18097 1 567 . 1 1 140 140 PHE H H 1 8.009 0.020 . 1 . . . A 429 PHE H . 18097 1 568 . 1 1 140 140 PHE HA H 1 4.795 0.020 . 1 . . . A 429 PHE HA . 18097 1 569 . 1 1 140 140 PHE C C 13 173.232 0.3 . 1 . . . A 429 PHE C . 18097 1 570 . 1 1 140 140 PHE CA C 13 55.556 0.3 . 1 . . . A 429 PHE CA . 18097 1 571 . 1 1 140 140 PHE N N 15 122.819 0.3 . 1 . . . A 429 PHE N . 18097 1 572 . 1 1 141 141 ILE H H 1 8.069 0.020 . 1 . . . A 430 ILE H . 18097 1 573 . 1 1 141 141 ILE HA H 1 3.992 0.020 . 1 . . . A 430 ILE HA . 18097 1 574 . 1 1 141 141 ILE C C 13 175.459 0.3 . 1 . . . A 430 ILE C . 18097 1 575 . 1 1 141 141 ILE CA C 13 60.443 0.3 . 1 . . . A 430 ILE CA . 18097 1 576 . 1 1 141 141 ILE N N 15 127.916 0.3 . 1 . . . A 430 ILE N . 18097 1 577 . 1 1 142 142 VAL H H 1 8.332 0.020 . 1 . . . A 431 VAL H . 18097 1 578 . 1 1 142 142 VAL HA H 1 4.261 0.020 . 1 . . . A 431 VAL HA . 18097 1 579 . 1 1 142 142 VAL C C 13 173.580 0.3 . 1 . . . A 431 VAL C . 18097 1 580 . 1 1 142 142 VAL CA C 13 58.828 0.3 . 1 . . . A 431 VAL CA . 18097 1 581 . 1 1 142 142 VAL N N 15 131.283 0.3 . 1 . . . A 431 VAL N . 18097 1 582 . 1 1 145 145 SER H H 1 8.546 0.020 . 1 . . . A 434 SER H . 18097 1 583 . 1 1 145 145 SER C C 13 174.529 0.3 . 1 . . . A 434 SER C . 18097 1 584 . 1 1 145 145 SER N N 15 121.965 0.3 . 1 . . . A 434 SER N . 18097 1 585 . 1 1 149 149 CYS H H 1 8.557 0.020 . 1 . . . A 438 CYS H . 18097 1 586 . 1 1 149 149 CYS C C 13 173.441 0.3 . 1 . . . A 438 CYS C . 18097 1 587 . 1 1 149 149 CYS CA C 13 58.256 0.3 . 1 . . . A 438 CYS CA . 18097 1 588 . 1 1 149 149 CYS N N 15 126.863 0.3 . 1 . . . A 438 CYS N . 18097 1 589 . 1 1 151 151 ASP H H 1 9.027 0.020 . 1 . . . A 440 ASP H . 18097 1 590 . 1 1 151 151 ASP HA H 1 4.550 0.020 . 1 . . . A 440 ASP HA . 18097 1 591 . 1 1 151 151 ASP C C 13 175.505 0.3 . 1 . . . A 440 ASP C . 18097 1 592 . 1 1 151 151 ASP CA C 13 55.227 0.3 . 1 . . . A 440 ASP CA . 18097 1 593 . 1 1 151 151 ASP N N 15 123.283 0.3 . 1 . . . A 440 ASP N . 18097 1 594 . 1 1 152 152 ARG H H 1 6.962 0.020 . 1 . . . A 441 ARG H . 18097 1 595 . 1 1 152 152 ARG HA H 1 4.316 0.020 . 1 . . . A 441 ARG HA . 18097 1 596 . 1 1 152 152 ARG C C 13 173.858 0.3 . 1 . . . A 441 ARG C . 18097 1 597 . 1 1 152 152 ARG CA C 13 54.486 0.3 . 1 . . . A 441 ARG CA . 18097 1 598 . 1 1 152 152 ARG N N 15 116.407 0.3 . 1 . . . A 441 ARG N . 18097 1 599 . 1 1 153 153 VAL H H 1 8.689 0.020 . 1 . . . A 442 VAL H . 18097 1 600 . 1 1 153 153 VAL C C 13 174.967 0.3 . 1 . . . A 442 VAL C . 18097 1 601 . 1 1 153 153 VAL CA C 13 60.174 0.3 . 1 . . . A 442 VAL CA . 18097 1 602 . 1 1 153 153 VAL N N 15 123.155 0.3 . 1 . . . A 442 VAL N . 18097 1 603 . 1 1 154 154 GLY H H 1 9.100 0.020 . 1 . . . A 443 GLY H . 18097 1 604 . 1 1 154 154 GLY HA2 H 1 3.600 0.020 . 1 . . . A 443 GLY HA2 . 18097 1 605 . 1 1 154 154 GLY HA3 H 1 3.600 0.020 . 1 . . . A 443 GLY HA3 . 18097 1 606 . 1 1 154 154 GLY C C 13 171.584 0.3 . 1 . . . A 443 GLY C . 18097 1 607 . 1 1 154 154 GLY CA C 13 44.827 0.3 . 1 . . . A 443 GLY CA . 18097 1 608 . 1 1 154 154 GLY N N 15 114.213 0.3 . 1 . . . A 443 GLY N . 18097 1 609 . 1 1 155 155 VAL H H 1 8.485 0.020 . 1 . . . A 444 VAL H . 18097 1 610 . 1 1 155 155 VAL HA H 1 4.123 0.020 . 1 . . . A 444 VAL HA . 18097 1 611 . 1 1 155 155 VAL C C 13 171.856 0.3 . 1 . . . A 444 VAL C . 18097 1 612 . 1 1 155 155 VAL CA C 13 60.712 0.3 . 1 . . . A 444 VAL CA . 18097 1 613 . 1 1 155 155 VAL N N 15 126.435 0.3 . 1 . . . A 444 VAL N . 18097 1 614 . 1 1 156 156 PHE H H 1 8.441 0.020 . 1 . . . A 445 PHE H . 18097 1 615 . 1 1 156 156 PHE HA H 1 4.580 0.020 . 1 . . . A 445 PHE HA . 18097 1 616 . 1 1 156 156 PHE C C 13 174.598 0.3 . 1 . . . A 445 PHE C . 18097 1 617 . 1 1 156 156 PHE CA C 13 53.174 0.3 . 1 . . . A 445 PHE CA . 18097 1 618 . 1 1 156 156 PHE N N 15 122.110 0.3 . 1 . . . A 445 PHE N . 18097 1 619 . 1 1 157 157 VAL H H 1 9.139 0.020 . 1 . . . A 446 VAL H . 18097 1 620 . 1 1 157 157 VAL HA H 1 4.275 0.020 . 1 . . . A 446 VAL HA . 18097 1 621 . 1 1 157 157 VAL C C 13 172.086 0.3 . 1 . . . A 446 VAL C . 18097 1 622 . 1 1 157 157 VAL CA C 13 59.837 0.3 . 1 . . . A 446 VAL CA . 18097 1 623 . 1 1 157 157 VAL N N 15 130.057 0.3 . 1 . . . A 446 VAL N . 18097 1 624 . 1 1 158 158 ASP H H 1 7.608 0.020 . 1 . . . A 447 ASP H . 18097 1 625 . 1 1 158 158 ASP HA H 1 4.491 0.020 . 1 . . . A 447 ASP HA . 18097 1 626 . 1 1 158 158 ASP C C 13 176.456 0.3 . 1 . . . A 447 ASP C . 18097 1 627 . 1 1 158 158 ASP CA C 13 51.794 0.3 . 1 . . . A 447 ASP CA . 18097 1 628 . 1 1 158 158 ASP N N 15 124.791 0.3 . 1 . . . A 447 ASP N . 18097 1 629 . 1 1 159 159 TYR H H 1 8.778 0.020 . 1 . . . A 448 TYR H . 18097 1 630 . 1 1 159 159 TYR HA H 1 3.793 0.020 . 1 . . . A 448 TYR HA . 18097 1 631 . 1 1 159 159 TYR C C 13 177.894 0.3 . 1 . . . A 448 TYR C . 18097 1 632 . 1 1 159 159 TYR CA C 13 61.688 0.3 . 1 . . . A 448 TYR CA . 18097 1 633 . 1 1 159 159 TYR N N 15 125.168 0.3 . 1 . . . A 448 TYR N . 18097 1 634 . 1 1 160 160 GLU H H 1 8.003 0.020 . 1 . . . A 449 GLU H . 18097 1 635 . 1 1 160 160 GLU HA H 1 3.967 0.020 . 1 . . . A 449 GLU HA . 18097 1 636 . 1 1 160 160 GLU C C 13 178.520 0.3 . 1 . . . A 449 GLU C . 18097 1 637 . 1 1 160 160 GLU CA C 13 60.578 0.3 . 1 . . . A 449 GLU CA . 18097 1 638 . 1 1 160 160 GLU N N 15 116.788 0.3 . 1 . . . A 449 GLU N . 18097 1 639 . 1 1 161 161 ALA H H 1 7.695 0.020 . 1 . . . A 450 ALA H . 18097 1 640 . 1 1 161 161 ALA HA H 1 4.026 0.020 . 1 . . . A 450 ALA HA . 18097 1 641 . 1 1 161 161 ALA C C 13 176.664 0.3 . 1 . . . A 450 ALA C . 18097 1 642 . 1 1 161 161 ALA CA C 13 51.895 0.3 . 1 . . . A 450 ALA CA . 18097 1 643 . 1 1 161 161 ALA N N 15 119.184 0.3 . 1 . . . A 450 ALA N . 18097 1 644 . 1 1 162 162 CYS H H 1 7.880 0.020 . 1 . . . A 451 CYS H . 18097 1 645 . 1 1 162 162 CYS C C 13 173.047 0.3 . 1 . . . A 451 CYS C . 18097 1 646 . 1 1 162 162 CYS CA C 13 59.063 0.3 . 1 . . . A 451 CYS CA . 18097 1 647 . 1 1 162 162 CYS N N 15 112.485 0.3 . 1 . . . A 451 CYS N . 18097 1 648 . 1 1 163 163 THR H H 1 7.623 0.020 . 1 . . . A 452 THR H . 18097 1 649 . 1 1 163 163 THR C C 13 173.335 0.3 . 1 . . . A 452 THR C . 18097 1 650 . 1 1 163 163 THR CA C 13 58.727 0.3 . 1 . . . A 452 THR CA . 18097 1 651 . 1 1 163 163 THR N N 15 106.985 0.3 . 1 . . . A 452 THR N . 18097 1 652 . 1 1 164 164 VAL H H 1 7.900 0.020 . 1 . . . A 453 VAL H . 18097 1 653 . 1 1 164 164 VAL C C 13 174.741 0.3 . 1 . . . A 453 VAL C . 18097 1 654 . 1 1 164 164 VAL CA C 13 61.756 0.3 . 1 . . . A 453 VAL CA . 18097 1 655 . 1 1 164 164 VAL N N 15 119.085 0.3 . 1 . . . A 453 VAL N . 18097 1 656 . 1 1 165 165 SER H H 1 9.034 0.020 . 1 . . . A 454 SER H . 18097 1 657 . 1 1 165 165 SER C C 13 170.888 0.3 . 1 . . . A 454 SER C . 18097 1 658 . 1 1 165 165 SER CA C 13 57.482 0.3 . 1 . . . A 454 SER CA . 18097 1 659 . 1 1 165 165 SER N N 15 121.792 0.3 . 1 . . . A 454 SER N . 18097 1 660 . 1 1 166 166 PHE H H 1 8.076 0.020 . 1 . . . A 455 PHE H . 18097 1 661 . 1 1 166 166 PHE C C 13 175.064 0.3 . 1 . . . A 455 PHE C . 18097 1 662 . 1 1 166 166 PHE CA C 13 55.361 0.3 . 1 . . . A 455 PHE CA . 18097 1 663 . 1 1 166 166 PHE N N 15 117.889 0.3 . 1 . . . A 455 PHE N . 18097 1 664 . 1 1 167 167 PHE H H 1 10.023 0.020 . 1 . . . A 456 PHE H . 18097 1 665 . 1 1 167 167 PHE C C 13 175.018 0.3 . 1 . . . A 456 PHE C . 18097 1 666 . 1 1 167 167 PHE CA C 13 56.808 0.3 . 1 . . . A 456 PHE CA . 18097 1 667 . 1 1 167 167 PHE N N 15 121.297 0.3 . 1 . . . A 456 PHE N . 18097 1 668 . 1 1 168 168 ASN H H 1 9.646 0.020 . 1 . . . A 457 ASN H . 18097 1 669 . 1 1 168 168 ASN HA H 1 4.591 0.020 . 1 . . . A 457 ASN HA . 18097 1 670 . 1 1 168 168 ASN C C 13 175.157 0.3 . 1 . . . A 457 ASN C . 18097 1 671 . 1 1 168 168 ASN CA C 13 51.659 0.3 . 1 . . . A 457 ASN CA . 18097 1 672 . 1 1 168 168 ASN N N 15 120.535 0.3 . 1 . . . A 457 ASN N . 18097 1 673 . 1 1 169 169 ILE H H 1 7.792 0.020 . 1 . . . A 458 ILE H . 18097 1 674 . 1 1 169 169 ILE C C 13 176.548 0.3 . 1 . . . A 458 ILE C . 18097 1 675 . 1 1 169 169 ILE CA C 13 62.698 0.3 . 1 . . . A 458 ILE CA . 18097 1 676 . 1 1 169 169 ILE N N 15 124.615 0.3 . 1 . . . A 458 ILE N . 18097 1 677 . 1 1 170 170 THR H H 1 7.382 0.020 . 1 . . . A 459 THR H . 18097 1 678 . 1 1 170 170 THR HA H 1 4.004 0.020 . 1 . . . A 459 THR HA . 18097 1 679 . 1 1 170 170 THR C C 13 173.719 0.3 . 1 . . . A 459 THR C . 18097 1 680 . 1 1 170 170 THR CA C 13 64.549 0.3 . 1 . . . A 459 THR CA . 18097 1 681 . 1 1 170 170 THR N N 15 114.704 0.3 . 1 . . . A 459 THR N . 18097 1 682 . 1 1 171 171 ASN H H 1 7.079 0.020 . 1 . . . A 460 ASN H . 18097 1 683 . 1 1 171 171 ASN HA H 1 4.770 0.020 . 1 . . . A 460 ASN HA . 18097 1 684 . 1 1 171 171 ASN C C 13 173.835 0.3 . 1 . . . A 460 ASN C . 18097 1 685 . 1 1 171 171 ASN CA C 13 49.674 0.3 . 1 . . . A 460 ASN CA . 18097 1 686 . 1 1 171 171 ASN N N 15 119.172 0.3 . 1 . . . A 460 ASN N . 18097 1 687 . 1 1 172 172 HIS H H 1 7.350 0.020 . 1 . . . A 461 HIS H . 18097 1 688 . 1 1 172 172 HIS HA H 1 3.942 0.020 . 1 . . . A 461 HIS HA . 18097 1 689 . 1 1 172 172 HIS C C 13 174.114 0.3 . 1 . . . A 461 HIS C . 18097 1 690 . 1 1 172 172 HIS CA C 13 57.313 0.3 . 1 . . . A 461 HIS CA . 18097 1 691 . 1 1 172 172 HIS N N 15 111.334 0.3 . 1 . . . A 461 HIS N . 18097 1 692 . 1 1 173 173 GLY H H 1 7.818 0.020 . 1 . . . A 462 GLY H . 18097 1 693 . 1 1 173 173 GLY HA2 H 1 3.840 0.020 . 1 . . . A 462 GLY HA2 . 18097 1 694 . 1 1 173 173 GLY HA3 H 1 3.840 0.020 . 1 . . . A 462 GLY HA3 . 18097 1 695 . 1 1 173 173 GLY C C 13 173.603 0.3 . 1 . . . A 462 GLY C . 18097 1 696 . 1 1 173 173 GLY CA C 13 47.486 0.3 . 1 . . . A 462 GLY CA . 18097 1 697 . 1 1 173 173 GLY N N 15 105.400 0.3 . 1 . . . A 462 GLY N . 18097 1 698 . 1 1 174 174 PHE H H 1 7.626 0.020 . 1 . . . A 463 PHE H . 18097 1 699 . 1 1 174 174 PHE HA H 1 4.423 0.020 . 1 . . . A 463 PHE HA . 18097 1 700 . 1 1 174 174 PHE C C 13 176.502 0.3 . 1 . . . A 463 PHE C . 18097 1 701 . 1 1 174 174 PHE CA C 13 57.549 0.3 . 1 . . . A 463 PHE CA . 18097 1 702 . 1 1 174 174 PHE N N 15 120.249 0.3 . 1 . . . A 463 PHE N . 18097 1 703 . 1 1 175 175 LEU H H 1 8.561 0.020 . 1 . . . A 464 LEU H . 18097 1 704 . 1 1 175 175 LEU C C 13 176.780 0.3 . 1 . . . A 464 LEU C . 18097 1 705 . 1 1 175 175 LEU CA C 13 56.068 0.3 . 1 . . . A 464 LEU CA . 18097 1 706 . 1 1 175 175 LEU N N 15 125.969 0.3 . 1 . . . A 464 LEU N . 18097 1 707 . 1 1 176 176 ILE H H 1 9.330 0.020 . 1 . . . A 465 ILE H . 18097 1 708 . 1 1 176 176 ILE C C 13 175.528 0.3 . 1 . . . A 465 ILE C . 18097 1 709 . 1 1 176 176 ILE CA C 13 63.169 0.3 . 1 . . . A 465 ILE CA . 18097 1 710 . 1 1 176 176 ILE N N 15 126.876 0.3 . 1 . . . A 465 ILE N . 18097 1 711 . 1 1 177 177 TYR H H 1 7.212 0.020 . 1 . . . A 466 TYR H . 18097 1 712 . 1 1 177 177 TYR HA H 1 4.068 0.020 . 1 . . . A 466 TYR HA . 18097 1 713 . 1 1 177 177 TYR C C 13 171.006 0.3 . 1 . . . A 466 TYR C . 18097 1 714 . 1 1 177 177 TYR CA C 13 59.097 0.3 . 1 . . . A 466 TYR CA . 18097 1 715 . 1 1 177 177 TYR N N 15 115.047 0.3 . 1 . . . A 466 TYR N . 18097 1 716 . 1 1 178 178 LYS H H 1 6.811 0.020 . 1 . . . A 467 LYS H . 18097 1 717 . 1 1 178 178 LYS C C 13 175.273 0.3 . 1 . . . A 467 LYS C . 18097 1 718 . 1 1 178 178 LYS CA C 13 54.520 0.3 . 1 . . . A 467 LYS CA . 18097 1 719 . 1 1 178 178 LYS N N 15 127.911 0.3 . 1 . . . A 467 LYS N . 18097 1 720 . 1 1 179 179 PHE H H 1 9.651 0.020 . 1 . . . A 468 PHE H . 18097 1 721 . 1 1 179 179 PHE HA H 1 4.632 0.020 . 1 . . . A 468 PHE HA . 18097 1 722 . 1 1 179 179 PHE C C 13 175.336 0.3 . 1 . . . A 468 PHE C . 18097 1 723 . 1 1 179 179 PHE CA C 13 58.289 0.3 . 1 . . . A 468 PHE CA . 18097 1 724 . 1 1 179 179 PHE N N 15 126.383 0.3 . 1 . . . A 468 PHE N . 18097 1 725 . 1 1 180 180 SER H H 1 8.485 0.020 . 1 . . . A 469 SER H . 18097 1 726 . 1 1 180 180 SER HA H 1 4.837 0.020 . 1 . . . A 469 SER HA . 18097 1 727 . 1 1 180 180 SER C C 13 172.861 0.3 . 1 . . . A 469 SER C . 18097 1 728 . 1 1 180 180 SER CA C 13 56.707 0.3 . 1 . . . A 469 SER CA . 18097 1 729 . 1 1 180 180 SER N N 15 115.506 0.3 . 1 . . . A 469 SER N . 18097 1 730 . 1 1 181 181 GLN H H 1 9.298 0.020 . 1 . . . A 470 GLN H . 18097 1 731 . 1 1 181 181 GLN HA H 1 3.629 0.020 . 1 . . . A 470 GLN HA . 18097 1 732 . 1 1 181 181 GLN C C 13 176.015 0.3 . 1 . . . A 470 GLN C . 18097 1 733 . 1 1 181 181 GLN CA C 13 56.472 0.3 . 1 . . . A 470 GLN CA . 18097 1 734 . 1 1 181 181 GLN N N 15 117.133 0.3 . 1 . . . A 470 GLN N . 18097 1 735 . 1 1 182 182 CYS H H 1 7.876 0.020 . 1 . . . A 471 CYS H . 18097 1 736 . 1 1 182 182 CYS C C 13 175.899 0.3 . 1 . . . A 471 CYS C . 18097 1 737 . 1 1 182 182 CYS CA C 13 60.039 0.3 . 1 . . . A 471 CYS CA . 18097 1 738 . 1 1 182 182 CYS N N 15 116.032 0.3 . 1 . . . A 471 CYS N . 18097 1 739 . 1 1 183 183 SER H H 1 8.561 0.020 . 1 . . . A 472 SER H . 18097 1 740 . 1 1 183 183 SER HA H 1 4.194 0.020 . 1 . . . A 472 SER HA . 18097 1 741 . 1 1 183 183 SER C C 13 174.392 0.3 . 1 . . . A 472 SER C . 18097 1 742 . 1 1 183 183 SER CA C 13 56.337 0.3 . 1 . . . A 472 SER CA . 18097 1 743 . 1 1 183 183 SER N N 15 118.074 0.3 . 1 . . . A 472 SER N . 18097 1 744 . 1 1 184 184 PHE H H 1 7.275 0.020 . 1 . . . A 473 PHE H . 18097 1 745 . 1 1 184 184 PHE HA H 1 4.825 0.020 . 1 . . . A 473 PHE HA . 18097 1 746 . 1 1 184 184 PHE C C 13 175.157 0.3 . 1 . . . A 473 PHE C . 18097 1 747 . 1 1 184 184 PHE CA C 13 52.534 0.3 . 1 . . . A 473 PHE CA . 18097 1 748 . 1 1 184 184 PHE N N 15 125.605 0.3 . 1 . . . A 473 PHE N . 18097 1 749 . 1 1 188 188 VAL H H 1 7.959 0.020 . 1 . . . A 477 VAL H . 18097 1 750 . 1 1 188 188 VAL C C 13 173.279 0.3 . 1 . . . A 477 VAL C . 18097 1 751 . 1 1 188 188 VAL CA C 13 58.626 0.3 . 1 . . . A 477 VAL CA . 18097 1 752 . 1 1 188 188 VAL N N 15 111.123 0.3 . 1 . . . A 477 VAL N . 18097 1 753 . 1 1 189 189 PHE H H 1 8.774 0.020 . 1 . . . A 478 PHE H . 18097 1 754 . 1 1 189 189 PHE CA C 13 54.957 0.3 . 1 . . . A 478 PHE CA . 18097 1 755 . 1 1 189 189 PHE N N 15 114.592 0.3 . 1 . . . A 478 PHE N . 18097 1 756 . 1 1 191 191 TYR H H 1 8.356 0.020 . 1 . . . A 480 TYR H . 18097 1 757 . 1 1 191 191 TYR HA H 1 5.142 0.020 . 1 . . . A 480 TYR HA . 18097 1 758 . 1 1 191 191 TYR C C 13 174.693 0.3 . 1 . . . A 480 TYR C . 18097 1 759 . 1 1 191 191 TYR CA C 13 57.078 0.3 . 1 . . . A 480 TYR CA . 18097 1 760 . 1 1 191 191 TYR N N 15 121.836 0.3 . 1 . . . A 480 TYR N . 18097 1 761 . 1 1 192 192 LEU H H 1 8.261 0.020 . 1 . . . A 481 LEU H . 18097 1 762 . 1 1 192 192 LEU HA H 1 4.605 0.020 . 1 . . . A 481 LEU HA . 18097 1 763 . 1 1 192 192 LEU C C 13 174.137 0.3 . 1 . . . A 481 LEU C . 18097 1 764 . 1 1 192 192 LEU CA C 13 55.563 0.3 . 1 . . . A 481 LEU CA . 18097 1 765 . 1 1 192 192 LEU N N 15 129.065 0.3 . 1 . . . A 481 LEU N . 18097 1 766 . 1 1 193 193 ASN H H 1 8.007 0.020 . 1 . . . A 482 ASN H . 18097 1 767 . 1 1 193 193 ASN CA C 13 49.505 0.3 . 1 . . . A 482 ASN CA . 18097 1 768 . 1 1 193 193 ASN N N 15 114.217 0.3 . 1 . . . A 482 ASN N . 18097 1 769 . 1 1 198 198 THR H H 1 8.265 0.020 . 1 . . . A 487 THR H . 18097 1 770 . 1 1 198 198 THR HA H 1 4.044 0.020 . 1 . . . A 487 THR HA . 18097 1 771 . 1 1 198 198 THR C C 13 174.206 0.3 . 1 . . . A 487 THR C . 18097 1 772 . 1 1 198 198 THR CA C 13 63.203 0.3 . 1 . . . A 487 THR CA . 18097 1 773 . 1 1 198 198 THR N N 15 121.563 0.3 . 1 . . . A 487 THR N . 18097 1 774 . 1 1 199 199 VAL H H 1 8.737 0.020 . 1 . . . A 488 VAL H . 18097 1 775 . 1 1 199 199 VAL C C 13 174.832 0.3 . 1 . . . A 488 VAL C . 18097 1 776 . 1 1 199 199 VAL CA C 13 61.419 0.3 . 1 . . . A 488 VAL CA . 18097 1 777 . 1 1 199 199 VAL N N 15 129.507 0.3 . 1 . . . A 488 VAL N . 18097 1 778 . 1 1 201 201 MET H H 1 8.545 0.020 . 1 . . . A 490 MET H . 18097 1 779 . 1 1 201 201 MET HA H 1 5.073 0.020 . 1 . . . A 490 MET HA . 18097 1 780 . 1 1 201 201 MET C C 13 175.180 0.3 . 1 . . . A 490 MET C . 18097 1 781 . 1 1 201 201 MET CA C 13 53.712 0.3 . 1 . . . A 490 MET CA . 18097 1 782 . 1 1 201 201 MET N N 15 116.897 0.3 . 1 . . . A 490 MET N . 18097 1 783 . 1 1 202 202 THR H H 1 8.312 0.020 . 1 . . . A 491 THR H . 18097 1 784 . 1 1 202 202 THR HA H 1 4.977 0.020 . 1 . . . A 491 THR HA . 18097 1 785 . 1 1 202 202 THR C C 13 173.981 0.3 . 1 . . . A 491 THR C . 18097 1 786 . 1 1 202 202 THR CA C 13 62.058 0.3 . 1 . . . A 491 THR CA . 18097 1 787 . 1 1 202 202 THR N N 15 117.791 0.3 . 1 . . . A 491 THR N . 18097 1 788 . 1 1 203 203 LEU H H 1 9.048 0.020 . 1 . . . A 492 LEU H . 18097 1 789 . 1 1 203 203 LEU HA H 1 4.756 0.020 . 1 . . . A 492 LEU HA . 18097 1 790 . 1 1 203 203 LEU C C 13 176.131 0.3 . 1 . . . A 492 LEU C . 18097 1 791 . 1 1 203 203 LEU CA C 13 55.294 0.3 . 1 . . . A 492 LEU CA . 18097 1 792 . 1 1 203 203 LEU N N 15 129.237 0.3 . 1 . . . A 492 LEU N . 18097 1 793 . 1 1 204 204 CYS H H 1 8.609 0.020 . 1 . . . A 493 CYS H . 18097 1 794 . 1 1 204 204 CYS HA H 1 4.577 0.020 . 1 . . . A 493 CYS HA . 18097 1 795 . 1 1 204 204 CYS C C 13 174.531 0.3 . 1 . . . A 493 CYS C . 18097 1 796 . 1 1 204 204 CYS CA C 13 58.188 0.3 . 1 . . . A 493 CYS CA . 18097 1 797 . 1 1 204 204 CYS N N 15 122.012 0.3 . 1 . . . A 493 CYS N . 18097 1 798 . 1 1 205 205 SER H H 1 8.665 0.020 . 1 . . . A 494 SER H . 18097 1 799 . 1 1 205 205 SER C C 13 171.632 0.3 . 1 . . . A 494 SER C . 18097 1 800 . 1 1 205 205 SER CA C 13 56.909 0.3 . 1 . . . A 494 SER CA . 18097 1 801 . 1 1 205 205 SER N N 15 120.249 0.3 . 1 . . . A 494 SER N . 18097 1 802 . 1 1 207 207 SER H H 1 7.052 0.020 . 1 . . . . 496 SER H . 18097 1 803 . 1 1 207 207 SER HA H 1 4.161 0.020 . 1 . . . . 496 SER HA . 18097 1 804 . 1 1 207 207 SER C C 13 173.279 0.3 . 1 . . . . 496 SER C . 18097 1 805 . 1 1 207 207 SER CA C 13 57.751 0.3 . 1 . . . . 496 SER CA . 18097 1 806 . 1 1 207 207 SER N N 15 115.376 0.3 . 1 . . . . 496 SER N . 18097 1 807 . 1 1 208 208 SER H H 1 7.725 0.020 . 1 . . . . 497 SER H . 18097 1 808 . 1 1 208 208 SER C C 13 178.543 0.3 . 1 . . . . 497 SER C . 18097 1 809 . 1 1 208 208 SER CA C 13 59.871 0.3 . 1 . . . . 497 SER CA . 18097 1 810 . 1 1 208 208 SER N N 15 122.837 0.3 . 1 . . . . 497 SER N . 18097 1 stop_ save_