data_18990 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 18990 _Entry.Title ; protein structure ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2013-01-30 _Entry.Accession_date 2013-01-30 _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 Yeong Noh . J. . 18990 2 Pascal Mercier . . . 18990 3 Donald Spratt . E. . 18990 4 Gary Shaw . S. . 18990 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' . 18990 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'E3 ligase' . 18990 IBR . 18990 Parkin . 18990 RING . 18990 Zn-binding . 18990 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 18990 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 540 18990 '15N chemical shifts' 134 18990 '1H chemical shifts' 760 18990 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 . . 2013-06-19 2011-03-31 update BMRB 'update entry citation' 18990 1 . . 2012-01-24 2011-03-31 original author 'original release' 18990 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 1WD2 . 18990 PDB 2JMO . 18990 PDB 2M48 'BMRB Entry Tracking System' 18990 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 18990 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title 'A molecular explanation for the recessive nature of parkin-linked Parkinson's disease' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Nat. Commun.' _Citation.Journal_name_full . _Citation.Journal_volume 4 _Citation.Journal_issue 1983 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first . _Citation.Page_last . _Citation.Year 2013 _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 Donald Spratt . E. . 18990 1 2 'R. Julio' Martinez-Torres . . . 18990 1 3 Yeong Noh . J. . 18990 1 4 Pascal Mercier . . . 18990 1 5 Noah Manczyk . . . 18990 1 6 Kathryn Barber . R. . 18990 1 7 Jacob Aguirre . D. . 18990 1 8 Lynn Burchell . . . 18990 1 9 Andrew Purkiss . . . 18990 1 10 Helen Walden . . . 18990 1 11 Gary Shaw . S. . 18990 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 18990 _Assembly.ID 1 _Assembly.Name protein _Assembly.BMRB_code . _Assembly.Number_of_components 5 _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 . _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 entity_1 1 $entity_1 A . yes native no no . . . 18990 1 2 'ZINC ION_1' 2 $entity_ZN B . no native no no . . . 18990 1 3 'ZINC ION_2' 2 $entity_ZN C . no native no no . . . 18990 1 4 'ZINC ION_3' 2 $entity_ZN D . no native no no . . . 18990 1 5 'ZINC ION_4' 2 $entity_ZN E . no native no no . . . 18990 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 18990 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity_1 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; EEYVLQAGGVLCPQPGCGMG LLVEPDCRKVTCQNGCGYVF CRNCLQGYHIGECLPEGTGA SATNSCEYTVDPNRAAEARW DEASNVTIKVSTKPCPKCRT PTERDGGCMHMVCTRAGCGF EWCWVCQTEWTRDCMGAHWF G ; _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 141 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state . _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 15460.624 _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 2M48 . "Solution Structure Of Ibr-ring2 Tandem Domain From Parkin" . . . . . 100.00 141 100.00 100.00 1.07e-97 . . . . 18990 1 2 no GB AAL13983 . "SD01679p [Drosophila melanogaster]" . . . . . 100.00 482 100.00 100.00 1.88e-97 . . . . 18990 1 3 no GB AAM18800 . "PARKIN [Drosophila melanogaster]" . . . . . 100.00 482 100.00 100.00 1.92e-97 . . . . 18990 1 4 no GB AAM43930 . "PARKIN [Drosophila melanogaster]" . . . . . 100.00 482 100.00 100.00 1.92e-97 . . . . 18990 1 5 no GB AAN12154 . "parkin, isoform B [Drosophila melanogaster]" . . . . . 100.00 482 100.00 100.00 1.92e-97 . . . . 18990 1 6 no GB AAN12155 . "parkin, isoform C [Drosophila melanogaster]" . . . . . 100.00 482 100.00 100.00 1.92e-97 . . . . 18990 1 7 no REF NP_730600 . "parkin, isoform B [Drosophila melanogaster]" . . . . . 100.00 482 100.00 100.00 1.92e-97 . . . . 18990 1 8 no REF NP_730601 . "parkin, isoform C [Drosophila melanogaster]" . . . . . 100.00 482 100.00 100.00 1.92e-97 . . . . 18990 1 9 no REF XP_001973584 . "GG13257 [Drosophila erecta]" . . . . . 100.00 468 98.58 99.29 4.53e-96 . . . . 18990 1 10 no REF XP_002040765 . "GM22162 [Drosophila sechellia]" . . . . . 100.00 468 100.00 100.00 2.09e-97 . . . . 18990 1 11 no REF XP_002085754 . "GD12138 [Drosophila simulans]" . . . . . 100.00 482 100.00 100.00 1.92e-97 . . . . 18990 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 1 342 GLU . 18990 1 2 343 GLU . 18990 1 3 344 TYR . 18990 1 4 345 VAL . 18990 1 5 346 LEU . 18990 1 6 347 GLN . 18990 1 7 348 ALA . 18990 1 8 349 GLY . 18990 1 9 350 GLY . 18990 1 10 351 VAL . 18990 1 11 352 LEU . 18990 1 12 353 CYS . 18990 1 13 354 PRO . 18990 1 14 355 GLN . 18990 1 15 356 PRO . 18990 1 16 357 GLY . 18990 1 17 358 CYS . 18990 1 18 359 GLY . 18990 1 19 360 MET . 18990 1 20 361 GLY . 18990 1 21 362 LEU . 18990 1 22 363 LEU . 18990 1 23 364 VAL . 18990 1 24 365 GLU . 18990 1 25 366 PRO . 18990 1 26 367 ASP . 18990 1 27 368 CYS . 18990 1 28 369 ARG . 18990 1 29 370 LYS . 18990 1 30 371 VAL . 18990 1 31 372 THR . 18990 1 32 373 CYS . 18990 1 33 374 GLN . 18990 1 34 375 ASN . 18990 1 35 376 GLY . 18990 1 36 377 CYS . 18990 1 37 378 GLY . 18990 1 38 379 TYR . 18990 1 39 380 VAL . 18990 1 40 381 PHE . 18990 1 41 382 CYS . 18990 1 42 383 ARG . 18990 1 43 384 ASN . 18990 1 44 385 CYS . 18990 1 45 386 LEU . 18990 1 46 387 GLN . 18990 1 47 388 GLY . 18990 1 48 389 TYR . 18990 1 49 390 HIS . 18990 1 50 391 ILE . 18990 1 51 392 GLY . 18990 1 52 393 GLU . 18990 1 53 394 CYS . 18990 1 54 395 LEU . 18990 1 55 396 PRO . 18990 1 56 397 GLU . 18990 1 57 398 GLY . 18990 1 58 399 THR . 18990 1 59 400 GLY . 18990 1 60 401 ALA . 18990 1 61 402 SER . 18990 1 62 403 ALA . 18990 1 63 404 THR . 18990 1 64 405 ASN . 18990 1 65 406 SER . 18990 1 66 407 CYS . 18990 1 67 408 GLU . 18990 1 68 409 TYR . 18990 1 69 410 THR . 18990 1 70 411 VAL . 18990 1 71 412 ASP . 18990 1 72 413 PRO . 18990 1 73 414 ASN . 18990 1 74 415 ARG . 18990 1 75 416 ALA . 18990 1 76 417 ALA . 18990 1 77 418 GLU . 18990 1 78 419 ALA . 18990 1 79 420 ARG . 18990 1 80 421 TRP . 18990 1 81 422 ASP . 18990 1 82 423 GLU . 18990 1 83 424 ALA . 18990 1 84 425 SER . 18990 1 85 426 ASN . 18990 1 86 427 VAL . 18990 1 87 428 THR . 18990 1 88 429 ILE . 18990 1 89 430 LYS . 18990 1 90 431 VAL . 18990 1 91 432 SER . 18990 1 92 433 THR . 18990 1 93 434 LYS . 18990 1 94 435 PRO . 18990 1 95 436 CYS . 18990 1 96 437 PRO . 18990 1 97 438 LYS . 18990 1 98 439 CYS . 18990 1 99 440 ARG . 18990 1 100 441 THR . 18990 1 101 442 PRO . 18990 1 102 443 THR . 18990 1 103 444 GLU . 18990 1 104 445 ARG . 18990 1 105 446 ASP . 18990 1 106 447 GLY . 18990 1 107 448 GLY . 18990 1 108 449 CYS . 18990 1 109 450 MET . 18990 1 110 451 HIS . 18990 1 111 452 MET . 18990 1 112 453 VAL . 18990 1 113 454 CYS . 18990 1 114 455 THR . 18990 1 115 456 ARG . 18990 1 116 457 ALA . 18990 1 117 458 GLY . 18990 1 118 459 CYS . 18990 1 119 460 GLY . 18990 1 120 461 PHE . 18990 1 121 462 GLU . 18990 1 122 463 TRP . 18990 1 123 464 CYS . 18990 1 124 465 TRP . 18990 1 125 466 VAL . 18990 1 126 467 CYS . 18990 1 127 468 GLN . 18990 1 128 469 THR . 18990 1 129 470 GLU . 18990 1 130 471 TRP . 18990 1 131 472 THR . 18990 1 132 473 ARG . 18990 1 133 474 ASP . 18990 1 134 475 CYS . 18990 1 135 476 MET . 18990 1 136 477 GLY . 18990 1 137 478 ALA . 18990 1 138 479 HIS . 18990 1 139 480 TRP . 18990 1 140 481 PHE . 18990 1 141 482 GLY . 18990 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 . GLU 1 1 18990 1 . GLU 2 2 18990 1 . TYR 3 3 18990 1 . VAL 4 4 18990 1 . LEU 5 5 18990 1 . GLN 6 6 18990 1 . ALA 7 7 18990 1 . GLY 8 8 18990 1 . GLY 9 9 18990 1 . VAL 10 10 18990 1 . LEU 11 11 18990 1 . CYS 12 12 18990 1 . PRO 13 13 18990 1 . GLN 14 14 18990 1 . PRO 15 15 18990 1 . GLY 16 16 18990 1 . CYS 17 17 18990 1 . GLY 18 18 18990 1 . MET 19 19 18990 1 . GLY 20 20 18990 1 . LEU 21 21 18990 1 . LEU 22 22 18990 1 . VAL 23 23 18990 1 . GLU 24 24 18990 1 . PRO 25 25 18990 1 . ASP 26 26 18990 1 . CYS 27 27 18990 1 . ARG 28 28 18990 1 . LYS 29 29 18990 1 . VAL 30 30 18990 1 . THR 31 31 18990 1 . CYS 32 32 18990 1 . GLN 33 33 18990 1 . ASN 34 34 18990 1 . GLY 35 35 18990 1 . CYS 36 36 18990 1 . GLY 37 37 18990 1 . TYR 38 38 18990 1 . VAL 39 39 18990 1 . PHE 40 40 18990 1 . CYS 41 41 18990 1 . ARG 42 42 18990 1 . ASN 43 43 18990 1 . CYS 44 44 18990 1 . LEU 45 45 18990 1 . GLN 46 46 18990 1 . GLY 47 47 18990 1 . TYR 48 48 18990 1 . HIS 49 49 18990 1 . ILE 50 50 18990 1 . GLY 51 51 18990 1 . GLU 52 52 18990 1 . CYS 53 53 18990 1 . LEU 54 54 18990 1 . PRO 55 55 18990 1 . GLU 56 56 18990 1 . GLY 57 57 18990 1 . THR 58 58 18990 1 . GLY 59 59 18990 1 . ALA 60 60 18990 1 . SER 61 61 18990 1 . ALA 62 62 18990 1 . THR 63 63 18990 1 . ASN 64 64 18990 1 . SER 65 65 18990 1 . CYS 66 66 18990 1 . GLU 67 67 18990 1 . TYR 68 68 18990 1 . THR 69 69 18990 1 . VAL 70 70 18990 1 . ASP 71 71 18990 1 . PRO 72 72 18990 1 . ASN 73 73 18990 1 . ARG 74 74 18990 1 . ALA 75 75 18990 1 . ALA 76 76 18990 1 . GLU 77 77 18990 1 . ALA 78 78 18990 1 . ARG 79 79 18990 1 . TRP 80 80 18990 1 . ASP 81 81 18990 1 . GLU 82 82 18990 1 . ALA 83 83 18990 1 . SER 84 84 18990 1 . ASN 85 85 18990 1 . VAL 86 86 18990 1 . THR 87 87 18990 1 . ILE 88 88 18990 1 . LYS 89 89 18990 1 . VAL 90 90 18990 1 . SER 91 91 18990 1 . THR 92 92 18990 1 . LYS 93 93 18990 1 . PRO 94 94 18990 1 . CYS 95 95 18990 1 . PRO 96 96 18990 1 . LYS 97 97 18990 1 . CYS 98 98 18990 1 . ARG 99 99 18990 1 . THR 100 100 18990 1 . PRO 101 101 18990 1 . THR 102 102 18990 1 . GLU 103 103 18990 1 . ARG 104 104 18990 1 . ASP 105 105 18990 1 . GLY 106 106 18990 1 . GLY 107 107 18990 1 . CYS 108 108 18990 1 . MET 109 109 18990 1 . HIS 110 110 18990 1 . MET 111 111 18990 1 . VAL 112 112 18990 1 . CYS 113 113 18990 1 . THR 114 114 18990 1 . ARG 115 115 18990 1 . ALA 116 116 18990 1 . GLY 117 117 18990 1 . CYS 118 118 18990 1 . GLY 119 119 18990 1 . PHE 120 120 18990 1 . GLU 121 121 18990 1 . TRP 122 122 18990 1 . CYS 123 123 18990 1 . TRP 124 124 18990 1 . VAL 125 125 18990 1 . CYS 126 126 18990 1 . GLN 127 127 18990 1 . THR 128 128 18990 1 . GLU 129 129 18990 1 . TRP 130 130 18990 1 . THR 131 131 18990 1 . ARG 132 132 18990 1 . ASP 133 133 18990 1 . CYS 134 134 18990 1 . MET 135 135 18990 1 . GLY 136 136 18990 1 . ALA 137 137 18990 1 . HIS 138 138 18990 1 . TRP 139 139 18990 1 . PHE 140 140 18990 1 . GLY 141 141 18990 1 stop_ save_ save_entity_ZN _Entity.Sf_category entity _Entity.Sf_framecode entity_ZN _Entity.Entry_ID 18990 _Entity.ID 2 _Entity.BMRB_code ZN _Entity.Name entity_ZN _Entity.Type non-polymer _Entity.Polymer_common_type . _Entity.Polymer_type . _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code . _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer . _Entity.Nstd_chirality . _Entity.Nstd_linkage . _Entity.Nonpolymer_comp_ID ZN _Entity.Nonpolymer_comp_label $chem_comp_ZN _Entity.Number_of_monomers . _Entity.Number_of_nonpolymer_components 1 _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID 2 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 65.409 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'ZINC ION' BMRB 18990 2 stop_ loop_ _Entity_systematic_name.Name _Entity_systematic_name.Naming_system _Entity_systematic_name.Entry_ID _Entity_systematic_name.Entity_ID 'ZINC ION' BMRB 18990 2 ZN 'Three letter code' 18990 2 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 1 ZN $chem_comp_ZN 18990 2 stop_ loop_ _Entity_atom_list.ID _Entity_atom_list.Comp_index_ID _Entity_atom_list.Comp_ID _Entity_atom_list.Atom_ID _Entity_atom_list.Entry_ID _Entity_atom_list.Entity_ID 1 1 ZN ZN 18990 2 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 18990 _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 $entity_1 . 7227 organism . 'Drosophila melanogaster' 'fruit fly' . . Eukaryota Metazoa Drosophila melanogaster . . . . . . . . . . . . . . . . park . . . . 18990 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 18990 _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 $entity_1 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . . . . . . . . . . . pGEX-6P2 . . . 'modified to have TEV site' . . 18990 1 stop_ save_ ################################# # Polymer residues and ligands # ################################# save_chem_comp_ZN _Chem_comp.Sf_category chem_comp _Chem_comp.Sf_framecode chem_comp_ZN _Chem_comp.Entry_ID 18990 _Chem_comp.ID ZN _Chem_comp.Provenance PDB _Chem_comp.Name 'ZINC ION' _Chem_comp.Type NON-POLYMER _Chem_comp.BMRB_code ZN _Chem_comp.PDB_code ZN _Chem_comp.Ambiguous_flag no _Chem_comp.Initial_date 2012-11-20 _Chem_comp.Modified_date 2012-11-20 _Chem_comp.Release_status REL _Chem_comp.Replaced_by . _Chem_comp.Replaces . _Chem_comp.One_letter_code . _Chem_comp.Three_letter_code ZN _Chem_comp.Number_atoms_all 1 _Chem_comp.Number_atoms_nh 1 _Chem_comp.PubChem_code . _Chem_comp.Subcomponent_list . _Chem_comp.InChI_code InChI=1S/Zn/q+2 _Chem_comp.Mon_nstd_flag . _Chem_comp.Mon_nstd_class . _Chem_comp.Mon_nstd_details . _Chem_comp.Mon_nstd_parent . _Chem_comp.Mon_nstd_parent_comp_ID . _Chem_comp.Std_deriv_one_letter_code . _Chem_comp.Std_deriv_three_letter_code . _Chem_comp.Std_deriv_BMRB_code . _Chem_comp.Std_deriv_PDB_code . _Chem_comp.Std_deriv_chem_comp_name . _Chem_comp.Synonyms . _Chem_comp.Formal_charge 2 _Chem_comp.Paramagnetic no _Chem_comp.Aromatic no _Chem_comp.Formula Zn _Chem_comp.Formula_weight 65.409 _Chem_comp.Formula_mono_iso_wt_nat . _Chem_comp.Formula_mono_iso_wt_13C . _Chem_comp.Formula_mono_iso_wt_15N . _Chem_comp.Formula_mono_iso_wt_13C_15N . _Chem_comp.Image_file_name . _Chem_comp.Image_file_format . _Chem_comp.Topo_file_name . _Chem_comp.Topo_file_format . _Chem_comp.Struct_file_name . _Chem_comp.Struct_file_format . _Chem_comp.Stereochem_param_file_name . _Chem_comp.Stereochem_param_file_format . _Chem_comp.Model_details . _Chem_comp.Model_erf . _Chem_comp.Model_source . _Chem_comp.Model_coordinates_details . _Chem_comp.Model_coordinates_missing_flag no _Chem_comp.Ideal_coordinates_details . _Chem_comp.Ideal_coordinates_missing_flag no _Chem_comp.Model_coordinates_db_code . _Chem_comp.Processing_site RCSB _Chem_comp.Vendor . _Chem_comp.Vendor_product_code . _Chem_comp.Details . _Chem_comp.DB_query_date . _Chem_comp.DB_last_query_revised_last_date . loop_ _Chem_comp_descriptor.Descriptor _Chem_comp_descriptor.Type _Chem_comp_descriptor.Program _Chem_comp_descriptor.Program_version _Chem_comp_descriptor.Entry_ID _Chem_comp_descriptor.Comp_ID InChI=1S/Zn/q+2 InChI InChI 1.03 18990 ZN PTFCDOFLOPIGGS-UHFFFAOYSA-N InChIKey InChI 1.03 18990 ZN [Zn++] SMILES CACTVS 3.341 18990 ZN [Zn++] SMILES_CANONICAL CACTVS 3.341 18990 ZN [Zn+2] SMILES ACDLabs 10.04 18990 ZN [Zn+2] SMILES 'OpenEye OEToolkits' 1.5.0 18990 ZN [Zn+2] SMILES_CANONICAL 'OpenEye OEToolkits' 1.5.0 18990 ZN stop_ loop_ _Chem_comp_identifier.Identifier _Chem_comp_identifier.Type _Chem_comp_identifier.Program _Chem_comp_identifier.Program_version _Chem_comp_identifier.Entry_ID _Chem_comp_identifier.Comp_ID zinc 'SYSTEMATIC NAME' ACDLabs 10.04 18990 ZN 'zinc(+2) cation' 'SYSTEMATIC NAME' 'OpenEye OEToolkits' 1.5.0 18990 ZN stop_ loop_ _Chem_comp_atom.Atom_ID _Chem_comp_atom.BMRB_code _Chem_comp_atom.PDB_atom_ID _Chem_comp_atom.Alt_atom_ID _Chem_comp_atom.Auth_atom_ID _Chem_comp_atom.Type_symbol _Chem_comp_atom.Isotope_number _Chem_comp_atom.Chirality _Chem_comp_atom.Stereo_config _Chem_comp_atom.Charge _Chem_comp_atom.Partial_charge _Chem_comp_atom.Oxidation_number _Chem_comp_atom.Unpaired_electron_number _Chem_comp_atom.Align _Chem_comp_atom.Aromatic_flag _Chem_comp_atom.Leaving_atom_flag _Chem_comp_atom.Substruct_code _Chem_comp_atom.Ionizable _Chem_comp_atom.Drawing_2D_coord_x _Chem_comp_atom.Drawing_2D_coord_y _Chem_comp_atom.Model_Cartn_x _Chem_comp_atom.Model_Cartn_x_esd _Chem_comp_atom.Model_Cartn_y _Chem_comp_atom.Model_Cartn_y_esd _Chem_comp_atom.Model_Cartn_z _Chem_comp_atom.Model_Cartn_z_esd _Chem_comp_atom.Model_Cartn_x_ideal _Chem_comp_atom.Model_Cartn_y_ideal _Chem_comp_atom.Model_Cartn_z_ideal _Chem_comp_atom.PDBX_ordinal _Chem_comp_atom.Details _Chem_comp_atom.Entry_ID _Chem_comp_atom.Comp_ID ZN ZN ZN ZN . ZN . . N 2 . . . 0 no no . . . . 0.000 . 0.000 . 0.000 . 0.000 0.000 0.000 1 . 18990 ZN stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 18990 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details 'Added Roche EDTA-free protease inhibitor cocktail (~10 uM) to limit proteolysis during data collection' _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 TRIS 'natural abundance' . . . . . . 25 . . mM . . . . 18990 1 2 'sodium chloride' 'natural abundance' . . . . . . 150 . . mM . . . . 18990 1 3 DTT 'natural abundance' . . . . . . 5 . . mM . . . . 18990 1 4 entity_1 '[U-98% 15N]' . . 1 $entity_1 . . 500 . . uM . . . . 18990 1 5 H20 'natural abundance' . . . . . . 90 . . % . . . . 18990 1 6 D20 'natural abundance' . . . . . . 10 . . % . . . . 18990 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 18990 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details 'Added Roche EDTA-free protease inhibitor cocktail (~10 uM) to limit proteolysis during data collection' _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 TRIS 'natural abundance' . . . . . . 25 . . mM . . . . 18990 2 2 'sodium chloride' 'natural abundance' . . . . . . 150 . . mM . . . . 18990 2 3 DTT 'natural abundance' . . . . . . 5 . . mM . . . . 18990 2 4 entity_1 '[U-98% 13C; U-98% 15N]' . . 1 $entity_1 . . 500 . . uM . . . . 18990 2 5 H2O 'natural abundance' . . . . . . 90 . . % . . . . 18990 2 6 D2O 'natural abundance' . . . . . . 10 . . % . . . . 18990 2 stop_ save_ save_sample_3 _Sample.Sf_category sample _Sample.Sf_framecode sample_3 _Sample.Entry_ID 18990 _Sample.ID 3 _Sample.Type solution _Sample.Sub_type . _Sample.Details 'Added Roche EDTA-free protease inhibitor cocktail (~10 uM) to limit proteolysis during data collection' _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% 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 TRIS 'natural abundance' . . . . . . 25 . . mM . . . . 18990 3 2 'sodium chloride' 'natural abundance' . . . . . . 150 . . mM . . . . 18990 3 3 DTT 'natural abundance' . . . . . . 5 . . mM . . . . 18990 3 4 entity_1 '[U-98% 13C; U-98% 15N]' . . 1 $entity_1 . . 500 . . uM . . . . 18990 3 5 H2O 'natural abundance' . . . . . . 90 . . % . . . . 18990 3 6 D2O 'natural abundance' . . . . . . 10 . . % . . . . 18990 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 18990 _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' 0.150 . M 18990 1 pH 7.5 . pH 18990 1 pressure 1 . atm 18990 1 temperature 298 . K 18990 1 stop_ save_ ############################ # Computer software used # ############################ save_VNMRJ _Software.Sf_category software _Software.Sf_framecode VNMRJ _Software.Entry_ID 18990 _Software.ID 1 _Software.Name VNMRJ _Software.Version 'Varian VnmrJ 2.2D' _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Varian . http://www.home.agilent.com 18990 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 18990 1 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 18990 _Software.ID 2 _Software.Name NMRPipe _Software.Version 2011.084.20.33 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . http://spin.niddk.nih.gov/NMRPipe 18990 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 18990 2 stop_ save_ save_NMRDraw _Software.Sf_category software _Software.Sf_framecode NMRDraw _Software.Entry_ID 18990 _Software.ID 3 _Software.Name NMRDraw _Software.Version 'Ver 5.7 Rev 2011.084.20.33' _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . http://spin.niddk.nih.gov/NMRPipe 18990 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 18990 3 stop_ save_ save_NMRView _Software.Sf_category software _Software.Sf_framecode NMRView _Software.Entry_ID 18990 _Software.ID 4 _Software.Name NMRView _Software.Version '8.2.33 with Java 1.6.0_31' _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Johnson, One Moon Scientific' . http://www.onemoonscientific.com 18990 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 18990 4 'data analysis' 18990 4 'peak picking' 18990 4 stop_ save_ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 18990 _Software.ID 5 _Software.Name CYANA _Software.Version 2.1 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . http://www.cyana.org 18990 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 18990 5 stop_ save_ save_X-PLOR_NIH _Software.Sf_category software _Software.Sf_framecode X-PLOR_NIH _Software.Entry_ID 18990 _Software.ID 6 _Software.Name 'X-PLOR NIH' _Software.Version 2.33 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Schwieters, Kuszewski, Tjandra and Clore' . http://nmr.cit.nih.gov/xplor-nih 18990 6 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 18990 6 stop_ save_ save_TALOS _Software.Sf_category software _Software.Sf_framecode TALOS _Software.Entry_ID 18990 _Software.ID 7 _Software.Name TALOS _Software.Version TALOSPlus _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Cornilescu, Delaglio and Bax' . http://spin.niddk.nih.gov/NMRPipe 18990 7 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'geometry optimization' 18990 7 stop_ save_ save_Procheck _Software.Sf_category software _Software.Sf_framecode Procheck _Software.Entry_ID 18990 _Software.ID 8 _Software.Name Procheck _Software.Version 3.5.4 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Laskowski, MacArthur, Smith, Jones, Hutchinson, Morris, Moss and Tho' . http://www.ebi.ac.uk/thornton-srv/software/PROCHECK 18990 8 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 18990 8 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 18990 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details '13C-enhanced triple resonance cold probe with z-gradients' _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _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 18990 _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 Varian INOVA . 600 '13C-enhanced triple resonance cold probe with z-gradients' . . 18990 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 18990 _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 . . . . . . . . . . . . . . . . 18990 1 2 '2D 1H-13C HSQC aliphatic' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18990 1 3 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18990 1 4 '3D HCCH-TOCSY' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18990 1 5 '3D 1H-13C NOESY aliphatic' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18990 1 6 '3D 1H-13C NOESY aromatic' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18990 1 7 '3D HNCA' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18990 1 8 '3D HCACO' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18990 1 9 '3D HNCACB' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18990 1 10 '3D CBCA(CO)NH' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18990 1 11 '3D HNCO' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18990 1 12 '3D HNHA' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18990 1 13 '3D C(CO)NH' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18990 1 14 '3D 1H-13C NOESY aliphatic' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18990 1 15 '2D (HB)CB(CGCD)HD' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18990 1 16 '2D (HB)CB(CGCDCE)HE' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18990 1 17 '3D HNHB' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18990 1 18 '2D 1H-13C HSQC aromatic' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18990 1 19 '3D H(CCO)NH' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18990 1 20 '3D 13C TOCSY aromatic' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 18990 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 18990 _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 . . . . . . . . . 18990 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 18990 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . . . . . 18990 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 18990 _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 1 '2D 1H-15N HSQC' . . . 18990 1 2 '2D 1H-13C HSQC aliphatic' . . . 18990 1 7 '3D HNCA' . . . 18990 1 8 '3D HCACO' . . . 18990 1 9 '3D HNCACB' . . . 18990 1 10 '3D CBCA(CO)NH' . . . 18990 1 11 '3D HNCO' . . . 18990 1 12 '3D HNHA' . . . 18990 1 13 '3D C(CO)NH' . . . 18990 1 14 '3D 1H-13C NOESY aliphatic' . . . 18990 1 15 '2D (HB)CB(CGCD)HD' . . . 18990 1 16 '2D (HB)CB(CGCDCE)HE' . . . 18990 1 17 '3D HNHB' . . . 18990 1 18 '2D 1H-13C HSQC aromatic' . . . 18990 1 20 '3D 13C TOCSY aromatic' . . . 18990 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 1 1 GLU C C 13 176.5760 0.0000 . 1 . . . A 342 GLU C . 18990 1 2 . 1 1 1 1 GLU CA C 13 57.4880 0.0000 . 1 . . . A 342 GLU CA . 18990 1 3 . 1 1 1 1 GLU CB C 13 29.4040 0.0000 . 1 . . . A 342 GLU CB . 18990 1 4 . 1 1 1 1 GLU N N 15 122.8480 0.0000 . 1 . . . A 342 GLU N . 18990 1 5 . 1 1 2 2 GLU H H 1 8.2930 0.0000 . 1 . . . A 343 GLU H . 18990 1 6 . 1 1 2 2 GLU HA H 1 4.1650 0.0000 . 1 . . . A 343 GLU HA . 18990 1 7 . 1 1 2 2 GLU C C 13 176.5290 0.0000 . 1 . . . A 343 GLU C . 18990 1 8 . 1 1 2 2 GLU CA C 13 57.1620 0.0000 . 1 . . . A 343 GLU CA . 18990 1 9 . 1 1 2 2 GLU CB C 13 30.2040 0.0000 . 1 . . . A 343 GLU CB . 18990 1 10 . 1 1 2 2 GLU N N 15 121.0450 0.0000 . 1 . . . A 343 GLU N . 18990 1 11 . 1 1 3 3 TYR H H 1 8.0400 0.0000 . 1 . . . A 344 TYR H . 18990 1 12 . 1 1 3 3 TYR HA H 1 4.5380 0.0000 . 1 . . . A 344 TYR HA . 18990 1 13 . 1 1 3 3 TYR HB2 H 1 3.0560 0.0000 . 2 . . . A 344 TYR HB2 . 18990 1 14 . 1 1 3 3 TYR HB3 H 1 2.9710 0.0000 . 2 . . . A 344 TYR HB3 . 18990 1 15 . 1 1 3 3 TYR HD2 H 1 7.1800 0.0000 . 3 . . . A 344 TYR HD2 . 18990 1 16 . 1 1 3 3 TYR HE2 H 1 6.8840 0.0000 . 3 . . . A 344 TYR HE2 . 18990 1 17 . 1 1 3 3 TYR C C 13 175.8970 0.0000 . 1 . . . A 344 TYR C . 18990 1 18 . 1 1 3 3 TYR CA C 13 58.1790 0.0000 . 1 . . . A 344 TYR CA . 18990 1 19 . 1 1 3 3 TYR CB C 13 38.6000 0.0000 . 1 . . . A 344 TYR CB . 18990 1 20 . 1 1 3 3 TYR CD2 C 13 133.4510 0.0000 . 1 . . . A 344 TYR CD2 . 18990 1 21 . 1 1 3 3 TYR CE2 C 13 118.5260 0.0000 . 1 . . . A 344 TYR CE2 . 18990 1 22 . 1 1 3 3 TYR N N 15 121.0000 0.0000 . 1 . . . A 344 TYR N . 18990 1 23 . 1 1 4 4 VAL H H 1 7.8560 0.0000 . 1 . . . A 345 VAL H . 18990 1 24 . 1 1 4 4 VAL HA H 1 3.9390 0.0000 . 1 . . . A 345 VAL HA . 18990 1 25 . 1 1 4 4 VAL HB H 1 2.0000 0.0000 . 1 . . . A 345 VAL HB . 18990 1 26 . 1 1 4 4 VAL HG11 H 1 0.8560 0.0000 . 2 . . . A 345 VAL HG11 . 18990 1 27 . 1 1 4 4 VAL HG12 H 1 0.8560 0.0000 . 2 . . . A 345 VAL HG12 . 18990 1 28 . 1 1 4 4 VAL HG13 H 1 0.8560 0.0000 . 2 . . . A 345 VAL HG13 . 18990 1 29 . 1 1 4 4 VAL HG21 H 1 0.9030 0.0000 . 2 . . . A 345 VAL HG21 . 18990 1 30 . 1 1 4 4 VAL HG22 H 1 0.9030 0.0000 . 2 . . . A 345 VAL HG22 . 18990 1 31 . 1 1 4 4 VAL HG23 H 1 0.9030 0.0000 . 2 . . . A 345 VAL HG23 . 18990 1 32 . 1 1 4 4 VAL C C 13 176.1430 0.0000 . 1 . . . A 345 VAL C . 18990 1 33 . 1 1 4 4 VAL CA C 13 62.8670 0.0000 . 1 . . . A 345 VAL CA . 18990 1 34 . 1 1 4 4 VAL CB C 13 32.7990 0.0000 . 1 . . . A 345 VAL CB . 18990 1 35 . 1 1 4 4 VAL CG1 C 13 21.1030 0.0000 . 2 . . . A 345 VAL CG1 . 18990 1 36 . 1 1 4 4 VAL CG2 C 13 20.8680 0.0000 . 2 . . . A 345 VAL CG2 . 18990 1 37 . 1 1 4 4 VAL N N 15 121.9000 0.0000 . 1 . . . A 345 VAL N . 18990 1 38 . 1 1 5 5 LEU H H 1 8.1270 0.0000 . 1 . . . A 346 LEU H . 18990 1 39 . 1 1 5 5 LEU HA H 1 4.2430 0.0000 . 1 . . . A 346 LEU HA . 18990 1 40 . 1 1 5 5 LEU HB2 H 1 1.6540 0.0000 . 2 . . . A 346 LEU HB2 . 18990 1 41 . 1 1 5 5 LEU HB3 H 1 1.5850 0.0000 . 2 . . . A 346 LEU HB3 . 18990 1 42 . 1 1 5 5 LEU HG H 1 1.6090 0.0000 . 1 . . . A 346 LEU HG . 18990 1 43 . 1 1 5 5 LEU HD11 H 1 0.9160 0.0000 . 2 . . . A 346 LEU HD11 . 18990 1 44 . 1 1 5 5 LEU HD12 H 1 0.9160 0.0000 . 2 . . . A 346 LEU HD12 . 18990 1 45 . 1 1 5 5 LEU HD13 H 1 0.9160 0.0000 . 2 . . . A 346 LEU HD13 . 18990 1 46 . 1 1 5 5 LEU HD21 H 1 0.8590 0.0000 . 2 . . . A 346 LEU HD21 . 18990 1 47 . 1 1 5 5 LEU HD22 H 1 0.8590 0.0000 . 2 . . . A 346 LEU HD22 . 18990 1 48 . 1 1 5 5 LEU HD23 H 1 0.8590 0.0000 . 2 . . . A 346 LEU HD23 . 18990 1 49 . 1 1 5 5 LEU C C 13 177.7470 0.0000 . 1 . . . A 346 LEU C . 18990 1 50 . 1 1 5 5 LEU CA C 13 55.5000 0.0000 . 1 . . . A 346 LEU CA . 18990 1 51 . 1 1 5 5 LEU CB C 13 42.2520 0.0000 . 1 . . . A 346 LEU CB . 18990 1 52 . 1 1 5 5 LEU CG C 13 27.0140 0.0000 . 1 . . . A 346 LEU CG . 18990 1 53 . 1 1 5 5 LEU CD1 C 13 24.8000 0.0000 . 2 . . . A 346 LEU CD1 . 18990 1 54 . 1 1 5 5 LEU CD2 C 13 23.7180 0.0000 . 2 . . . A 346 LEU CD2 . 18990 1 55 . 1 1 5 5 LEU N N 15 124.9500 0.0000 . 1 . . . A 346 LEU N . 18990 1 56 . 1 1 6 6 GLN H H 1 8.2700 0.0000 . 1 . . . A 347 GLN H . 18990 1 57 . 1 1 6 6 GLN HA H 1 4.2860 0.0000 . 1 . . . A 347 GLN HA . 18990 1 58 . 1 1 6 6 GLN HB2 H 1 2.1270 0.0000 . 2 . . . A 347 GLN HB2 . 18990 1 59 . 1 1 6 6 GLN HB3 H 1 1.9930 0.0000 . 2 . . . A 347 GLN HB3 . 18990 1 60 . 1 1 6 6 GLN HG2 H 1 2.3790 0.0000 . 2 . . . A 347 GLN HG2 . 18990 1 61 . 1 1 6 6 GLN HE21 H 1 7.5110 0.0000 . 2 . . . A 347 GLN HE21 . 18990 1 62 . 1 1 6 6 GLN HE22 H 1 6.8470 0.0000 . 2 . . . A 347 GLN HE22 . 18990 1 63 . 1 1 6 6 GLN C C 13 175.8330 0.0000 . 1 . . . A 347 GLN C . 18990 1 64 . 1 1 6 6 GLN CA C 13 55.9880 0.0000 . 1 . . . A 347 GLN CA . 18990 1 65 . 1 1 6 6 GLN CB C 13 29.3750 0.0000 . 1 . . . A 347 GLN CB . 18990 1 66 . 1 1 6 6 GLN CG C 13 33.7600 0.0000 . 1 . . . A 347 GLN CG . 18990 1 67 . 1 1 6 6 GLN N N 15 121.4520 0.0000 . 1 . . . A 347 GLN N . 18990 1 68 . 1 1 6 6 GLN NE2 N 15 112.2960 0.0000 . 1 . . . A 347 GLN NE2 . 18990 1 69 . 1 1 7 7 ALA H H 1 8.2270 0.0000 . 1 . . . A 348 ALA H . 18990 1 70 . 1 1 7 7 ALA HA H 1 4.3210 0.0000 . 1 . . . A 348 ALA HA . 18990 1 71 . 1 1 7 7 ALA HB1 H 1 1.3950 0.0000 . 1 . . . A 348 ALA HB1 . 18990 1 72 . 1 1 7 7 ALA HB2 H 1 1.3950 0.0000 . 1 . . . A 348 ALA HB2 . 18990 1 73 . 1 1 7 7 ALA HB3 H 1 1.3950 0.0000 . 1 . . . A 348 ALA HB3 . 18990 1 74 . 1 1 7 7 ALA C C 13 177.9290 0.0000 . 1 . . . A 348 ALA C . 18990 1 75 . 1 1 7 7 ALA CA C 13 52.7030 0.0000 . 1 . . . A 348 ALA CA . 18990 1 76 . 1 1 7 7 ALA CB C 13 19.0020 0.0000 . 1 . . . A 348 ALA CB . 18990 1 77 . 1 1 7 7 ALA N N 15 124.4660 0.0000 . 1 . . . A 348 ALA N . 18990 1 78 . 1 1 8 8 GLY H H 1 8.2980 0.0000 . 1 . . . A 349 GLY H . 18990 1 79 . 1 1 8 8 GLY HA2 H 1 4.0000 0.0000 . 2 . . . A 349 GLY HA2 . 18990 1 80 . 1 1 8 8 GLY C C 13 174.2690 0.0000 . 1 . . . A 349 GLY C . 18990 1 81 . 1 1 8 8 GLY CA C 13 45.2270 0.0000 . 1 . . . A 349 GLY CA . 18990 1 82 . 1 1 8 8 GLY N N 15 108.1930 0.0000 . 1 . . . A 349 GLY N . 18990 1 83 . 1 1 9 9 GLY H H 1 8.1560 0.0000 . 1 . . . A 350 GLY H . 18990 1 84 . 1 1 9 9 GLY HA2 H 1 4.4290 0.0000 . 2 . . . A 350 GLY HA2 . 18990 1 85 . 1 1 9 9 GLY HA3 H 1 3.8670 0.0000 . 2 . . . A 350 GLY HA3 . 18990 1 86 . 1 1 9 9 GLY C C 13 172.9790 0.0000 . 1 . . . A 350 GLY C . 18990 1 87 . 1 1 9 9 GLY CA C 13 44.9350 0.0000 . 1 . . . A 350 GLY CA . 18990 1 88 . 1 1 9 9 GLY N N 15 108.0730 0.0000 . 1 . . . A 350 GLY N . 18990 1 89 . 1 1 10 10 VAL H H 1 8.5410 0.0000 . 1 . . . A 351 VAL H . 18990 1 90 . 1 1 10 10 VAL HA H 1 4.4160 0.0000 . 1 . . . A 351 VAL HA . 18990 1 91 . 1 1 10 10 VAL HB H 1 2.0660 0.0000 . 1 . . . A 351 VAL HB . 18990 1 92 . 1 1 10 10 VAL HG11 H 1 1.0050 0.0000 . 2 . . . A 351 VAL HG11 . 18990 1 93 . 1 1 10 10 VAL HG12 H 1 1.0050 0.0000 . 2 . . . A 351 VAL HG12 . 18990 1 94 . 1 1 10 10 VAL HG13 H 1 1.0050 0.0000 . 2 . . . A 351 VAL HG13 . 18990 1 95 . 1 1 10 10 VAL C C 13 173.4120 0.0000 . 1 . . . A 351 VAL C . 18990 1 96 . 1 1 10 10 VAL CA C 13 60.6630 0.0000 . 1 . . . A 351 VAL CA . 18990 1 97 . 1 1 10 10 VAL CB C 13 34.8660 0.0000 . 1 . . . A 351 VAL CB . 18990 1 98 . 1 1 10 10 VAL CG1 C 13 21.2870 0.0000 . 2 . . . A 351 VAL CG1 . 18990 1 99 . 1 1 10 10 VAL N N 15 119.0580 0.0000 . 1 . . . A 351 VAL N . 18990 1 100 . 1 1 11 11 LEU H H 1 8.1510 0.0000 . 1 . . . A 352 LEU H . 18990 1 101 . 1 1 11 11 LEU HA H 1 4.7650 0.0000 . 1 . . . A 352 LEU HA . 18990 1 102 . 1 1 11 11 LEU HB2 H 1 1.4970 0.0000 . 2 . . . A 352 LEU HB2 . 18990 1 103 . 1 1 11 11 LEU HB3 H 1 1.1980 0.0000 . 2 . . . A 352 LEU HB3 . 18990 1 104 . 1 1 11 11 LEU HG H 1 0.8150 0.0000 . 1 . . . A 352 LEU HG . 18990 1 105 . 1 1 11 11 LEU HD11 H 1 0.7450 0.0000 . 2 . . . A 352 LEU HD11 . 18990 1 106 . 1 1 11 11 LEU HD12 H 1 0.7450 0.0000 . 2 . . . A 352 LEU HD12 . 18990 1 107 . 1 1 11 11 LEU HD13 H 1 0.7450 0.0000 . 2 . . . A 352 LEU HD13 . 18990 1 108 . 1 1 11 11 LEU C C 13 176.2180 0.0000 . 1 . . . A 352 LEU C . 18990 1 109 . 1 1 11 11 LEU CA C 13 53.3410 0.0000 . 1 . . . A 352 LEU CA . 18990 1 110 . 1 1 11 11 LEU CB C 13 42.7060 0.0000 . 1 . . . A 352 LEU CB . 18990 1 111 . 1 1 11 11 LEU CG C 13 25.0200 0.0000 . 1 . . . A 352 LEU CG . 18990 1 112 . 1 1 11 11 LEU CD1 C 13 23.2630 0.0000 . 2 . . . A 352 LEU CD1 . 18990 1 113 . 1 1 11 11 LEU N N 15 125.8000 0.0000 . 1 . . . A 352 LEU N . 18990 1 114 . 1 1 12 12 CYS H H 1 8.7940 0.0000 . 1 . . . A 353 CYS H . 18990 1 115 . 1 1 12 12 CYS HA H 1 4.1070 0.0000 . 1 . . . A 353 CYS HA . 18990 1 116 . 1 1 12 12 CYS HB2 H 1 3.2590 0.0000 . 2 . . . A 353 CYS HB2 . 18990 1 117 . 1 1 12 12 CYS HB3 H 1 2.8890 0.0000 . 2 . . . A 353 CYS HB3 . 18990 1 118 . 1 1 12 12 CYS C C 13 176.6550 0.0000 . 1 . . . A 353 CYS C . 18990 1 119 . 1 1 12 12 CYS CA C 13 57.7310 0.0000 . 1 . . . A 353 CYS CA . 18990 1 120 . 1 1 12 12 CYS CB C 13 31.8650 0.0000 . 1 . . . A 353 CYS CB . 18990 1 121 . 1 1 12 12 CYS N N 15 126.8250 0.0000 . 1 . . . A 353 CYS N . 18990 1 122 . 1 1 13 13 PRO HA H 1 4.4200 0.0000 . 1 . . . A 354 PRO HA . 18990 1 123 . 1 1 13 13 PRO HB2 H 1 2.0330 0.0000 . 2 . . . A 354 PRO HB2 . 18990 1 124 . 1 1 13 13 PRO HG2 H 1 1.4660 0.0000 . 2 . . . A 354 PRO HG2 . 18990 1 125 . 1 1 13 13 PRO HD2 H 1 3.2430 0.0000 . 2 . . . A 354 PRO HD2 . 18990 1 126 . 1 1 13 13 PRO HD3 H 1 2.8600 0.0000 . 2 . . . A 354 PRO HD3 . 18990 1 127 . 1 1 13 13 PRO C C 13 177.5120 0.0000 . 1 . . . A 354 PRO C . 18990 1 128 . 1 1 13 13 PRO CA C 13 62.9920 0.0000 . 1 . . . A 354 PRO CA . 18990 1 129 . 1 1 13 13 PRO CB C 13 32.5670 0.0000 . 1 . . . A 354 PRO CB . 18990 1 130 . 1 1 13 13 PRO CG C 13 27.0150 0.0000 . 1 . . . A 354 PRO CG . 18990 1 131 . 1 1 13 13 PRO CD C 13 50.3800 0.0000 . 1 . . . A 354 PRO CD . 18990 1 132 . 1 1 14 14 GLN H H 1 9.0330 0.0000 . 1 . . . A 355 GLN H . 18990 1 133 . 1 1 14 14 GLN HA H 1 4.2750 0.0000 . 1 . . . A 355 GLN HA . 18990 1 134 . 1 1 14 14 GLN HB2 H 1 2.1210 0.0000 . 2 . . . A 355 GLN HB2 . 18990 1 135 . 1 1 14 14 GLN C C 13 175.5160 0.0000 . 1 . . . A 355 GLN C . 18990 1 136 . 1 1 14 14 GLN CA C 13 54.7930 0.0000 . 1 . . . A 355 GLN CA . 18990 1 137 . 1 1 14 14 GLN CB C 13 28.5470 0.0000 . 1 . . . A 355 GLN CB . 18990 1 138 . 1 1 14 14 GLN N N 15 126.8000 0.0000 . 1 . . . A 355 GLN N . 18990 1 139 . 1 1 15 15 PRO HD2 H 1 3.9120 0.0000 . 2 . . . A 356 PRO HD2 . 18990 1 140 . 1 1 15 15 PRO HD3 H 1 3.5460 0.0000 . 2 . . . A 356 PRO HD3 . 18990 1 141 . 1 1 15 15 PRO CD C 13 51.0000 0.0000 . 1 . . . A 356 PRO CD . 18990 1 142 . 1 1 16 16 GLY HA2 H 1 4.0390 0.0000 . 2 . . . A 357 GLY HA2 . 18990 1 143 . 1 1 16 16 GLY HA3 H 1 3.7460 0.0000 . 2 . . . A 357 GLY HA3 . 18990 1 144 . 1 1 16 16 GLY C C 13 173.2290 0.0000 . 1 . . . A 357 GLY C . 18990 1 145 . 1 1 16 16 GLY CA C 13 45.2540 0.0000 . 1 . . . A 357 GLY CA . 18990 1 146 . 1 1 17 17 CYS H H 1 7.7200 0.0000 . 1 . . . A 358 CYS H . 18990 1 147 . 1 1 17 17 CYS HA H 1 4.5330 0.0000 . 1 . . . A 358 CYS HA . 18990 1 148 . 1 1 17 17 CYS HB2 H 1 3.0040 0.0000 . 2 . . . A 358 CYS HB2 . 18990 1 149 . 1 1 17 17 CYS HB3 H 1 2.5340 0.0000 . 2 . . . A 358 CYS HB3 . 18990 1 150 . 1 1 17 17 CYS C C 13 176.1570 0.0000 . 1 . . . A 358 CYS C . 18990 1 151 . 1 1 17 17 CYS CA C 13 60.2680 0.0000 . 1 . . . A 358 CYS CA . 18990 1 152 . 1 1 17 17 CYS CB C 13 29.3750 0.0000 . 1 . . . A 358 CYS CB . 18990 1 153 . 1 1 17 17 CYS N N 15 123.5000 0.0000 . 1 . . . A 358 CYS N . 18990 1 154 . 1 1 18 18 GLY H H 1 7.7560 0.0000 . 1 . . . A 359 GLY H . 18990 1 155 . 1 1 18 18 GLY HA2 H 1 4.1390 0.0000 . 2 . . . A 359 GLY HA2 . 18990 1 156 . 1 1 18 18 GLY HA3 H 1 3.9270 0.0000 . 2 . . . A 359 GLY HA3 . 18990 1 157 . 1 1 18 18 GLY C C 13 174.0800 0.0000 . 1 . . . A 359 GLY C . 18990 1 158 . 1 1 18 18 GLY CA C 13 46.0640 0.0000 . 1 . . . A 359 GLY CA . 18990 1 159 . 1 1 18 18 GLY N N 15 104.4000 0.0000 . 1 . . . A 359 GLY N . 18990 1 160 . 1 1 19 19 MET H H 1 8.2290 0.0000 . 1 . . . A 360 MET H . 18990 1 161 . 1 1 19 19 MET HA H 1 4.3430 0.0000 . 1 . . . A 360 MET HA . 18990 1 162 . 1 1 19 19 MET HB2 H 1 2.6540 0.0000 . 2 . . . A 360 MET HB2 . 18990 1 163 . 1 1 19 19 MET HB3 H 1 2.5250 0.0000 . 2 . . . A 360 MET HB3 . 18990 1 164 . 1 1 19 19 MET HG2 H 1 2.5790 0.0000 . 2 . . . A 360 MET HG2 . 18990 1 165 . 1 1 19 19 MET HE1 H 1 2.0620 0.0000 . 1 . . . A 360 MET HE1 . 18990 1 166 . 1 1 19 19 MET HE2 H 1 2.0620 0.0000 . 1 . . . A 360 MET HE2 . 18990 1 167 . 1 1 19 19 MET HE3 H 1 2.0620 0.0000 . 1 . . . A 360 MET HE3 . 18990 1 168 . 1 1 19 19 MET C C 13 175.6410 0.0000 . 1 . . . A 360 MET C . 18990 1 169 . 1 1 19 19 MET CA C 13 55.9230 0.0000 . 1 . . . A 360 MET CA . 18990 1 170 . 1 1 19 19 MET CB C 13 33.0910 0.0000 . 1 . . . A 360 MET CB . 18990 1 171 . 1 1 19 19 MET CG C 13 19.0560 0.0000 . 1 . . . A 360 MET CG . 18990 1 172 . 1 1 19 19 MET CE C 13 17.1020 0.0000 . 1 . . . A 360 MET CE . 18990 1 173 . 1 1 19 19 MET N N 15 121.3000 0.0000 . 1 . . . A 360 MET N . 18990 1 174 . 1 1 20 20 GLY H H 1 8.3470 0.0000 . 1 . . . A 361 GLY H . 18990 1 175 . 1 1 20 20 GLY HA2 H 1 4.4170 0.0000 . 2 . . . A 361 GLY HA2 . 18990 1 176 . 1 1 20 20 GLY HA3 H 1 3.4950 0.0000 . 2 . . . A 361 GLY HA3 . 18990 1 177 . 1 1 20 20 GLY C C 13 173.7740 0.0000 . 1 . . . A 361 GLY C . 18990 1 178 . 1 1 20 20 GLY CA C 13 45.8380 0.0000 . 1 . . . A 361 GLY CA . 18990 1 179 . 1 1 20 20 GLY N N 15 109.0000 0.0000 . 1 . . . A 361 GLY N . 18990 1 180 . 1 1 21 21 LEU H H 1 8.9350 0.0000 . 1 . . . A 362 LEU H . 18990 1 181 . 1 1 21 21 LEU HA H 1 4.6750 0.0000 . 1 . . . A 362 LEU HA . 18990 1 182 . 1 1 21 21 LEU HB2 H 1 1.7120 0.0000 . 2 . . . A 362 LEU HB2 . 18990 1 183 . 1 1 21 21 LEU HB3 H 1 1.3190 0.0000 . 2 . . . A 362 LEU HB3 . 18990 1 184 . 1 1 21 21 LEU HG H 1 0.9790 0.0000 . 1 . . . A 362 LEU HG . 18990 1 185 . 1 1 21 21 LEU HD11 H 1 1.1010 0.0000 . 2 . . . A 362 LEU HD11 . 18990 1 186 . 1 1 21 21 LEU HD12 H 1 1.1010 0.0000 . 2 . . . A 362 LEU HD12 . 18990 1 187 . 1 1 21 21 LEU HD13 H 1 1.1010 0.0000 . 2 . . . A 362 LEU HD13 . 18990 1 188 . 1 1 21 21 LEU C C 13 175.8650 0.0000 . 1 . . . A 362 LEU C . 18990 1 189 . 1 1 21 21 LEU CA C 13 54.1900 0.0000 . 1 . . . A 362 LEU CA . 18990 1 190 . 1 1 21 21 LEU CB C 13 44.0500 0.0000 . 1 . . . A 362 LEU CB . 18990 1 191 . 1 1 21 21 LEU CG C 13 26.0800 0.0000 . 1 . . . A 362 LEU CG . 18990 1 192 . 1 1 21 21 LEU CD1 C 13 23.7300 0.0000 . 2 . . . A 362 LEU CD1 . 18990 1 193 . 1 1 21 21 LEU N N 15 126.7250 0.0000 . 1 . . . A 362 LEU N . 18990 1 194 . 1 1 22 22 LEU H H 1 8.4810 0.0000 . 1 . . . A 363 LEU H . 18990 1 195 . 1 1 22 22 LEU HA H 1 4.6770 0.0000 . 1 . . . A 363 LEU HA . 18990 1 196 . 1 1 22 22 LEU HB2 H 1 1.6020 0.0000 . 2 . . . A 363 LEU HB2 . 18990 1 197 . 1 1 22 22 LEU HD11 H 1 0.9100 0.0000 . 2 . . . A 363 LEU HD11 . 18990 1 198 . 1 1 22 22 LEU HD12 H 1 0.9100 0.0000 . 2 . . . A 363 LEU HD12 . 18990 1 199 . 1 1 22 22 LEU HD13 H 1 0.9100 0.0000 . 2 . . . A 363 LEU HD13 . 18990 1 200 . 1 1 22 22 LEU HD21 H 1 0.8460 0.0000 . 2 . . . A 363 LEU HD21 . 18990 1 201 . 1 1 22 22 LEU HD22 H 1 0.8460 0.0000 . 2 . . . A 363 LEU HD22 . 18990 1 202 . 1 1 22 22 LEU HD23 H 1 0.8460 0.0000 . 2 . . . A 363 LEU HD23 . 18990 1 203 . 1 1 22 22 LEU C C 13 176.1620 0.0000 . 1 . . . A 363 LEU C . 18990 1 204 . 1 1 22 22 LEU CA C 13 54.3420 0.0000 . 1 . . . A 363 LEU CA . 18990 1 205 . 1 1 22 22 LEU CB C 13 42.2100 0.0000 . 1 . . . A 363 LEU CB . 18990 1 206 . 1 1 22 22 LEU CD1 C 13 24.6370 0.0000 . 2 . . . A 363 LEU CD1 . 18990 1 207 . 1 1 22 22 LEU CD2 C 13 24.0150 0.0000 . 2 . . . A 363 LEU CD2 . 18990 1 208 . 1 1 22 22 LEU N N 15 123.7420 0.0000 . 1 . . . A 363 LEU N . 18990 1 209 . 1 1 23 23 VAL H H 1 8.1550 0.0000 . 1 . . . A 364 VAL H . 18990 1 210 . 1 1 23 23 VAL HA H 1 4.3970 0.0000 . 1 . . . A 364 VAL HA . 18990 1 211 . 1 1 23 23 VAL HB H 1 2.0430 0.0000 . 1 . . . A 364 VAL HB . 18990 1 212 . 1 1 23 23 VAL HG11 H 1 0.8910 0.0000 . 2 . . . A 364 VAL HG11 . 18990 1 213 . 1 1 23 23 VAL HG12 H 1 0.8910 0.0000 . 2 . . . A 364 VAL HG12 . 18990 1 214 . 1 1 23 23 VAL HG13 H 1 0.8910 0.0000 . 2 . . . A 364 VAL HG13 . 18990 1 215 . 1 1 23 23 VAL HG21 H 1 0.8300 0.0000 . 2 . . . A 364 VAL HG21 . 18990 1 216 . 1 1 23 23 VAL HG22 H 1 0.8300 0.0000 . 2 . . . A 364 VAL HG22 . 18990 1 217 . 1 1 23 23 VAL HG23 H 1 0.8300 0.0000 . 2 . . . A 364 VAL HG23 . 18990 1 218 . 1 1 23 23 VAL C C 13 175.5920 0.0000 . 1 . . . A 364 VAL C . 18990 1 219 . 1 1 23 23 VAL CA C 13 60.4600 0.0000 . 1 . . . A 364 VAL CA . 18990 1 220 . 1 1 23 23 VAL CB C 13 34.1250 0.0000 . 1 . . . A 364 VAL CB . 18990 1 221 . 1 1 23 23 VAL CG1 C 13 21.9950 0.0000 . 2 . . . A 364 VAL CG1 . 18990 1 222 . 1 1 23 23 VAL CG2 C 13 20.4430 0.0000 . 2 . . . A 364 VAL CG2 . 18990 1 223 . 1 1 23 23 VAL N N 15 120.9800 0.0000 . 1 . . . A 364 VAL N . 18990 1 224 . 1 1 24 24 GLU H H 1 8.9000 0.0000 . 1 . . . A 365 GLU H . 18990 1 225 . 1 1 24 24 GLU HA H 1 4.6100 0.0000 . 1 . . . A 365 GLU HA . 18990 1 226 . 1 1 24 24 GLU HB2 H 1 2.1340 0.0000 . 2 . . . A 365 GLU HB2 . 18990 1 227 . 1 1 24 24 GLU HB3 H 1 1.9300 0.0000 . 2 . . . A 365 GLU HB3 . 18990 1 228 . 1 1 24 24 GLU HG2 H 1 2.3280 0.0000 . 2 . . . A 365 GLU HG2 . 18990 1 229 . 1 1 24 24 GLU HG3 H 1 2.2970 0.0000 . 2 . . . A 365 GLU HG3 . 18990 1 230 . 1 1 24 24 GLU C C 13 175.4270 0.0000 . 1 . . . A 365 GLU C . 18990 1 231 . 1 1 24 24 GLU CA C 13 54.5510 0.0000 . 1 . . . A 365 GLU CA . 18990 1 232 . 1 1 24 24 GLU CB C 13 29.7800 0.0000 . 1 . . . A 365 GLU CB . 18990 1 233 . 1 1 24 24 GLU CG C 13 36.3210 0.0000 . 1 . . . A 365 GLU CG . 18990 1 234 . 1 1 24 24 GLU N N 15 126.9500 0.0000 . 1 . . . A 365 GLU N . 18990 1 235 . 1 1 25 25 PRO HA H 1 4.2620 0.0000 . 1 . . . A 366 PRO HA . 18990 1 236 . 1 1 25 25 PRO HB2 H 1 2.2720 0.0000 . 2 . . . A 366 PRO HB2 . 18990 1 237 . 1 1 25 25 PRO HB3 H 1 1.9190 0.0000 . 2 . . . A 366 PRO HB3 . 18990 1 238 . 1 1 25 25 PRO HG2 H 1 2.0710 0.0000 . 2 . . . A 366 PRO HG2 . 18990 1 239 . 1 1 25 25 PRO HG3 H 1 1.9530 0.0000 . 2 . . . A 366 PRO HG3 . 18990 1 240 . 1 1 25 25 PRO HD2 H 1 3.8160 0.0000 . 2 . . . A 366 PRO HD2 . 18990 1 241 . 1 1 25 25 PRO C C 13 177.0130 0.0000 . 1 . . . A 366 PRO C . 18990 1 242 . 1 1 25 25 PRO CA C 13 64.4630 0.0000 . 1 . . . A 366 PRO CA . 18990 1 243 . 1 1 25 25 PRO CB C 13 32.0480 0.0000 . 1 . . . A 366 PRO CB . 18990 1 244 . 1 1 25 25 PRO CG C 13 27.6000 0.0000 . 1 . . . A 366 PRO CG . 18990 1 245 . 1 1 25 25 PRO CD C 13 50.7000 0.0000 . 1 . . . A 366 PRO CD . 18990 1 246 . 1 1 26 26 ASP H H 1 8.4390 0.0000 . 1 . . . A 367 ASP H . 18990 1 247 . 1 1 26 26 ASP HA H 1 4.4950 0.0000 . 1 . . . A 367 ASP HA . 18990 1 248 . 1 1 26 26 ASP HB2 H 1 2.7590 0.0000 . 2 . . . A 367 ASP HB2 . 18990 1 249 . 1 1 26 26 ASP C C 13 175.1230 0.0000 . 1 . . . A 367 ASP C . 18990 1 250 . 1 1 26 26 ASP CA C 13 54.5030 0.0000 . 1 . . . A 367 ASP CA . 18990 1 251 . 1 1 26 26 ASP CB C 13 40.1230 0.0000 . 1 . . . A 367 ASP CB . 18990 1 252 . 1 1 26 26 ASP N N 15 115.4590 0.0000 . 1 . . . A 367 ASP N . 18990 1 253 . 1 1 27 27 CYS H H 1 7.5150 0.0000 . 1 . . . A 368 CYS H . 18990 1 254 . 1 1 27 27 CYS HA H 1 4.5700 0.0000 . 1 . . . A 368 CYS HA . 18990 1 255 . 1 1 27 27 CYS HB2 H 1 2.8880 0.0000 . 2 . . . A 368 CYS HB2 . 18990 1 256 . 1 1 27 27 CYS HB3 H 1 2.8060 0.0000 . 2 . . . A 368 CYS HB3 . 18990 1 257 . 1 1 27 27 CYS C C 13 173.8060 0.0000 . 1 . . . A 368 CYS C . 18990 1 258 . 1 1 27 27 CYS CA C 13 58.5810 0.0000 . 1 . . . A 368 CYS CA . 18990 1 259 . 1 1 27 27 CYS CB C 13 28.4500 0.0000 . 1 . . . A 368 CYS CB . 18990 1 260 . 1 1 27 27 CYS N N 15 118.7000 0.0000 . 1 . . . A 368 CYS N . 18990 1 261 . 1 1 28 28 ARG HA H 1 4.2650 0.0000 . 1 . . . A 369 ARG HA . 18990 1 262 . 1 1 28 28 ARG HB2 H 1 2.1350 0.0000 . 2 . . . A 369 ARG HB2 . 18990 1 263 . 1 1 28 28 ARG HB3 H 1 1.8790 0.0000 . 2 . . . A 369 ARG HB3 . 18990 1 264 . 1 1 28 28 ARG HG2 H 1 1.6760 0.0000 . 2 . . . A 369 ARG HG2 . 18990 1 265 . 1 1 28 28 ARG HD2 H 1 3.4910 0.0000 . 2 . . . A 369 ARG HD2 . 18990 1 266 . 1 1 28 28 ARG HD3 H 1 3.1700 0.0000 . 2 . . . A 369 ARG HD3 . 18990 1 267 . 1 1 28 28 ARG C C 13 174.9080 0.0000 . 1 . . . A 369 ARG C . 18990 1 268 . 1 1 28 28 ARG CA C 13 57.6690 0.0000 . 1 . . . A 369 ARG CA . 18990 1 269 . 1 1 28 28 ARG CB C 13 32.2740 0.0000 . 1 . . . A 369 ARG CB . 18990 1 270 . 1 1 28 28 ARG CG C 13 29.0000 0.0000 . 1 . . . A 369 ARG CG . 18990 1 271 . 1 1 28 28 ARG CD C 13 43.8240 0.0000 . 1 . . . A 369 ARG CD . 18990 1 272 . 1 1 29 29 LYS H H 1 7.7400 0.0000 . 1 . . . A 370 LYS H . 18990 1 273 . 1 1 29 29 LYS HA H 1 4.1700 0.0000 . 1 . . . A 370 LYS HA . 18990 1 274 . 1 1 29 29 LYS HB2 H 1 1.4300 0.0000 . 2 . . . A 370 LYS HB2 . 18990 1 275 . 1 1 29 29 LYS HG2 H 1 0.5370 0.0000 . 2 . . . A 370 LYS HG2 . 18990 1 276 . 1 1 29 29 LYS HD2 H 1 0.9790 0.0000 . 2 . . . A 370 LYS HD2 . 18990 1 277 . 1 1 29 29 LYS HE2 H 1 2.2040 0.0000 . 2 . . . A 370 LYS HE2 . 18990 1 278 . 1 1 29 29 LYS C C 13 174.8680 0.0000 . 1 . . . A 370 LYS C . 18990 1 279 . 1 1 29 29 LYS CA C 13 56.5540 0.0000 . 1 . . . A 370 LYS CA . 18990 1 280 . 1 1 29 29 LYS CB C 13 33.1400 0.0000 . 1 . . . A 370 LYS CB . 18990 1 281 . 1 1 29 29 LYS CG C 13 23.8750 0.0000 . 1 . . . A 370 LYS CG . 18990 1 282 . 1 1 29 29 LYS CD C 13 29.0050 0.0000 . 1 . . . A 370 LYS CD . 18990 1 283 . 1 1 29 29 LYS CE C 13 41.1150 0.0000 . 1 . . . A 370 LYS CE . 18990 1 284 . 1 1 29 29 LYS N N 15 121.0220 0.0000 . 1 . . . A 370 LYS N . 18990 1 285 . 1 1 30 30 VAL H H 1 8.6470 0.0000 . 1 . . . A 371 VAL H . 18990 1 286 . 1 1 30 30 VAL HA H 1 4.1330 0.0000 . 1 . . . A 371 VAL HA . 18990 1 287 . 1 1 30 30 VAL HB H 1 0.9400 0.0000 . 1 . . . A 371 VAL HB . 18990 1 288 . 1 1 30 30 VAL HG11 H 1 0.6210 0.0000 . 2 . . . A 371 VAL HG11 . 18990 1 289 . 1 1 30 30 VAL HG12 H 1 0.6210 0.0000 . 2 . . . A 371 VAL HG12 . 18990 1 290 . 1 1 30 30 VAL HG13 H 1 0.6210 0.0000 . 2 . . . A 371 VAL HG13 . 18990 1 291 . 1 1 30 30 VAL HG21 H 1 0.5780 0.0000 . 2 . . . A 371 VAL HG21 . 18990 1 292 . 1 1 30 30 VAL HG22 H 1 0.5780 0.0000 . 2 . . . A 371 VAL HG22 . 18990 1 293 . 1 1 30 30 VAL HG23 H 1 0.5780 0.0000 . 2 . . . A 371 VAL HG23 . 18990 1 294 . 1 1 30 30 VAL C C 13 173.4020 0.0000 . 1 . . . A 371 VAL C . 18990 1 295 . 1 1 30 30 VAL CA C 13 60.7770 0.0000 . 1 . . . A 371 VAL CA . 18990 1 296 . 1 1 30 30 VAL CB C 13 33.0000 0.0000 . 1 . . . A 371 VAL CB . 18990 1 297 . 1 1 30 30 VAL CG1 C 13 24.3380 0.0000 . 2 . . . A 371 VAL CG1 . 18990 1 298 . 1 1 30 30 VAL CG2 C 13 21.3380 0.0000 . 2 . . . A 371 VAL CG2 . 18990 1 299 . 1 1 30 30 VAL N N 15 128.3620 0.0000 . 1 . . . A 371 VAL N . 18990 1 300 . 1 1 31 31 THR H H 1 8.0870 0.0000 . 1 . . . A 372 THR H . 18990 1 301 . 1 1 31 31 THR HA H 1 5.0320 0.0000 . 1 . . . A 372 THR HA . 18990 1 302 . 1 1 31 31 THR HB H 1 3.7890 0.0000 . 1 . . . A 372 THR HB . 18990 1 303 . 1 1 31 31 THR HG21 H 1 0.9220 0.0000 . 1 . . . A 372 THR HG21 . 18990 1 304 . 1 1 31 31 THR HG22 H 1 0.9220 0.0000 . 1 . . . A 372 THR HG22 . 18990 1 305 . 1 1 31 31 THR HG23 H 1 0.9220 0.0000 . 1 . . . A 372 THR HG23 . 18990 1 306 . 1 1 31 31 THR C C 13 174.3390 0.0000 . 1 . . . A 372 THR C . 18990 1 307 . 1 1 31 31 THR CA C 13 60.8810 0.0000 . 1 . . . A 372 THR CA . 18990 1 308 . 1 1 31 31 THR CB C 13 70.4710 0.0000 . 1 . . . A 372 THR CB . 18990 1 309 . 1 1 31 31 THR CG2 C 13 20.7510 0.0000 . 1 . . . A 372 THR CG2 . 18990 1 310 . 1 1 31 31 THR N N 15 119.6670 0.0000 . 1 . . . A 372 THR N . 18990 1 311 . 1 1 32 32 CYS H H 1 9.3220 0.0000 . 1 . . . A 373 CYS H . 18990 1 312 . 1 1 32 32 CYS HA H 1 4.8020 0.0000 . 1 . . . A 373 CYS HA . 18990 1 313 . 1 1 32 32 CYS HB2 H 1 3.4640 0.0000 . 2 . . . A 373 CYS HB2 . 18990 1 314 . 1 1 32 32 CYS HB3 H 1 3.0420 0.0000 . 2 . . . A 373 CYS HB3 . 18990 1 315 . 1 1 32 32 CYS C C 13 176.7910 0.0000 . 1 . . . A 373 CYS C . 18990 1 316 . 1 1 32 32 CYS CA C 13 58.5040 0.0000 . 1 . . . A 373 CYS CA . 18990 1 317 . 1 1 32 32 CYS CB C 13 28.3110 0.0000 . 1 . . . A 373 CYS CB . 18990 1 318 . 1 1 32 32 CYS N N 15 132.5540 0.0000 . 1 . . . A 373 CYS N . 18990 1 319 . 1 1 33 33 GLN H H 1 7.8560 0.0000 . 1 . . . A 374 GLN H . 18990 1 320 . 1 1 33 33 GLN HA H 1 4.0000 0.0000 . 1 . . . A 374 GLN HA . 18990 1 321 . 1 1 33 33 GLN HB2 H 1 1.9720 0.0000 . 2 . . . A 374 GLN HB2 . 18990 1 322 . 1 1 33 33 GLN HG2 H 1 2.3260 0.0000 . 2 . . . A 374 GLN HG2 . 18990 1 323 . 1 1 33 33 GLN HE21 H 1 7.5330 0.0000 . 2 . . . A 374 GLN HE21 . 18990 1 324 . 1 1 33 33 GLN HE22 H 1 6.8650 0.0000 . 2 . . . A 374 GLN HE22 . 18990 1 325 . 1 1 33 33 GLN C C 13 176.8270 0.0000 . 1 . . . A 374 GLN C . 18990 1 326 . 1 1 33 33 GLN CA C 13 58.3000 0.0000 . 1 . . . A 374 GLN CA . 18990 1 327 . 1 1 33 33 GLN CB C 13 29.6640 0.0000 . 1 . . . A 374 GLN CB . 18990 1 328 . 1 1 33 33 GLN CG C 13 33.3090 0.0000 . 1 . . . A 374 GLN CG . 18990 1 329 . 1 1 33 33 GLN N N 15 125.8900 0.0000 . 1 . . . A 374 GLN N . 18990 1 330 . 1 1 33 33 GLN NE2 N 15 111.9370 0.0000 . 1 . . . A 374 GLN NE2 . 18990 1 331 . 1 1 34 34 ASN H H 1 8.9130 0.0000 . 1 . . . A 375 ASN H . 18990 1 332 . 1 1 34 34 ASN HA H 1 4.8870 0.0000 . 1 . . . A 375 ASN HA . 18990 1 333 . 1 1 34 34 ASN HB2 H 1 3.0100 0.0000 . 2 . . . A 375 ASN HB2 . 18990 1 334 . 1 1 34 34 ASN HB3 H 1 2.7370 0.0000 . 2 . . . A 375 ASN HB3 . 18990 1 335 . 1 1 34 34 ASN HD21 H 1 7.6840 0.0000 . 2 . . . A 375 ASN HD21 . 18990 1 336 . 1 1 34 34 ASN HD22 H 1 6.9790 0.0000 . 2 . . . A 375 ASN HD22 . 18990 1 337 . 1 1 34 34 ASN C C 13 174.0490 0.0000 . 1 . . . A 375 ASN C . 18990 1 338 . 1 1 34 34 ASN CA C 13 53.0470 0.0000 . 1 . . . A 375 ASN CA . 18990 1 339 . 1 1 34 34 ASN CB C 13 38.9160 0.0000 . 1 . . . A 375 ASN CB . 18990 1 340 . 1 1 34 34 ASN N N 15 115.3420 0.0000 . 1 . . . A 375 ASN N . 18990 1 341 . 1 1 34 34 ASN ND2 N 15 113.3250 0.0000 . 1 . . . A 375 ASN ND2 . 18990 1 342 . 1 1 35 35 GLY H H 1 7.1620 0.0000 . 1 . . . A 376 GLY H . 18990 1 343 . 1 1 35 35 GLY HA2 H 1 4.3340 0.0000 . 2 . . . A 376 GLY HA2 . 18990 1 344 . 1 1 35 35 GLY HA3 H 1 3.9760 0.0000 . 2 . . . A 376 GLY HA3 . 18990 1 345 . 1 1 35 35 GLY C C 13 174.1100 0.0000 . 1 . . . A 376 GLY C . 18990 1 346 . 1 1 35 35 GLY CA C 13 46.3860 0.0000 . 1 . . . A 376 GLY CA . 18990 1 347 . 1 1 35 35 GLY N N 15 109.0980 0.0000 . 1 . . . A 376 GLY N . 18990 1 348 . 1 1 36 36 CYS H H 1 9.8000 0.0000 . 1 . . . A 377 CYS H . 18990 1 349 . 1 1 36 36 CYS HA H 1 4.7640 0.0000 . 1 . . . A 377 CYS HA . 18990 1 350 . 1 1 36 36 CYS HB2 H 1 3.1800 0.0000 . 2 . . . A 377 CYS HB2 . 18990 1 351 . 1 1 36 36 CYS HB3 H 1 2.8800 0.0000 . 2 . . . A 377 CYS HB3 . 18990 1 352 . 1 1 36 36 CYS C C 13 177.3550 0.0000 . 1 . . . A 377 CYS C . 18990 1 353 . 1 1 36 36 CYS CA C 13 59.9880 0.0000 . 1 . . . A 377 CYS CA . 18990 1 354 . 1 1 36 36 CYS CB C 13 32.3650 0.0000 . 1 . . . A 377 CYS CB . 18990 1 355 . 1 1 36 36 CYS N N 15 132.5460 0.0000 . 1 . . . A 377 CYS N . 18990 1 356 . 1 1 37 37 GLY H H 1 8.8200 0.0000 . 1 . . . A 378 GLY H . 18990 1 357 . 1 1 37 37 GLY HA2 H 1 4.2010 0.0000 . 2 . . . A 378 GLY HA2 . 18990 1 358 . 1 1 37 37 GLY HA3 H 1 3.5720 0.0000 . 2 . . . A 378 GLY HA3 . 18990 1 359 . 1 1 37 37 GLY C C 13 173.4040 0.0000 . 1 . . . A 378 GLY C . 18990 1 360 . 1 1 37 37 GLY CA C 13 45.8630 0.0000 . 1 . . . A 378 GLY CA . 18990 1 361 . 1 1 37 37 GLY N N 15 113.8510 0.0000 . 1 . . . A 378 GLY N . 18990 1 362 . 1 1 38 38 TYR H H 1 9.0540 0.0000 . 1 . . . A 379 TYR H . 18990 1 363 . 1 1 38 38 TYR HA H 1 4.4780 0.0000 . 1 . . . A 379 TYR HA . 18990 1 364 . 1 1 38 38 TYR HB2 H 1 3.5980 0.0000 . 2 . . . A 379 TYR HB2 . 18990 1 365 . 1 1 38 38 TYR HB3 H 1 2.7490 0.0000 . 2 . . . A 379 TYR HB3 . 18990 1 366 . 1 1 38 38 TYR HD1 H 1 7.0380 0.0000 . 3 . . . A 379 TYR HD1 . 18990 1 367 . 1 1 38 38 TYR HE1 H 1 6.6480 0.0000 . 3 . . . A 379 TYR HE1 . 18990 1 368 . 1 1 38 38 TYR C C 13 173.6610 0.0000 . 1 . . . A 379 TYR C . 18990 1 369 . 1 1 38 38 TYR CA C 13 59.1800 0.0000 . 1 . . . A 379 TYR CA . 18990 1 370 . 1 1 38 38 TYR CB C 13 40.1080 0.0000 . 1 . . . A 379 TYR CB . 18990 1 371 . 1 1 38 38 TYR CD1 C 13 132.8260 0.0000 . 1 . . . A 379 TYR CD1 . 18990 1 372 . 1 1 38 38 TYR CE1 C 13 117.9960 0.0000 . 1 . . . A 379 TYR CE1 . 18990 1 373 . 1 1 38 38 TYR N N 15 125.5320 0.0000 . 1 . . . A 379 TYR N . 18990 1 374 . 1 1 39 39 VAL H H 1 7.2380 0.0000 . 1 . . . A 380 VAL H . 18990 1 375 . 1 1 39 39 VAL HA H 1 4.8180 0.0000 . 1 . . . A 380 VAL HA . 18990 1 376 . 1 1 39 39 VAL HB H 1 1.7460 0.0000 . 1 . . . A 380 VAL HB . 18990 1 377 . 1 1 39 39 VAL HG11 H 1 0.9050 0.0000 . 2 . . . A 380 VAL HG11 . 18990 1 378 . 1 1 39 39 VAL HG12 H 1 0.9050 0.0000 . 2 . . . A 380 VAL HG12 . 18990 1 379 . 1 1 39 39 VAL HG13 H 1 0.9050 0.0000 . 2 . . . A 380 VAL HG13 . 18990 1 380 . 1 1 39 39 VAL HG21 H 1 0.9110 0.0000 . 2 . . . A 380 VAL HG21 . 18990 1 381 . 1 1 39 39 VAL HG22 H 1 0.9110 0.0000 . 2 . . . A 380 VAL HG22 . 18990 1 382 . 1 1 39 39 VAL HG23 H 1 0.9110 0.0000 . 2 . . . A 380 VAL HG23 . 18990 1 383 . 1 1 39 39 VAL C C 13 175.8760 0.0000 . 1 . . . A 380 VAL C . 18990 1 384 . 1 1 39 39 VAL CA C 13 60.7970 0.0000 . 1 . . . A 380 VAL CA . 18990 1 385 . 1 1 39 39 VAL CB C 13 32.6100 0.0000 . 1 . . . A 380 VAL CB . 18990 1 386 . 1 1 39 39 VAL CG1 C 13 21.0700 0.0000 . 2 . . . A 380 VAL CG1 . 18990 1 387 . 1 1 39 39 VAL CG2 C 13 21.0700 0.0000 . 2 . . . A 380 VAL CG2 . 18990 1 388 . 1 1 39 39 VAL N N 15 124.4610 0.0000 . 1 . . . A 380 VAL N . 18990 1 389 . 1 1 40 40 PHE H H 1 9.4240 0.0000 . 1 . . . A 381 PHE H . 18990 1 390 . 1 1 40 40 PHE HA H 1 5.2730 0.0000 . 1 . . . A 381 PHE HA . 18990 1 391 . 1 1 40 40 PHE HB2 H 1 2.7640 0.0000 . 2 . . . A 381 PHE HB2 . 18990 1 392 . 1 1 40 40 PHE HB3 H 1 2.4960 0.0000 . 2 . . . A 381 PHE HB3 . 18990 1 393 . 1 1 40 40 PHE HD2 H 1 6.9040 0.0000 . 3 . . . A 381 PHE HD2 . 18990 1 394 . 1 1 40 40 PHE HE2 H 1 7.1060 0.0000 . 3 . . . A 381 PHE HE2 . 18990 1 395 . 1 1 40 40 PHE HZ H 1 6.7440 0.0000 . 1 . . . A 381 PHE HZ . 18990 1 396 . 1 1 40 40 PHE C C 13 173.2420 0.0000 . 1 . . . A 381 PHE C . 18990 1 397 . 1 1 40 40 PHE CA C 13 55.2100 0.0000 . 1 . . . A 381 PHE CA . 18990 1 398 . 1 1 40 40 PHE CB C 13 42.0900 0.0000 . 1 . . . A 381 PHE CB . 18990 1 399 . 1 1 40 40 PHE CD2 C 13 133.1570 0.0000 . 1 . . . A 381 PHE CD2 . 18990 1 400 . 1 1 40 40 PHE CE2 C 13 130.6100 0.0000 . 1 . . . A 381 PHE CE2 . 18990 1 401 . 1 1 40 40 PHE CZ C 13 118.1230 0.0000 . 1 . . . A 381 PHE CZ . 18990 1 402 . 1 1 40 40 PHE N N 15 124.5880 0.0000 . 1 . . . A 381 PHE N . 18990 1 403 . 1 1 41 41 CYS H H 1 8.6730 0.0000 . 1 . . . A 382 CYS H . 18990 1 404 . 1 1 41 41 CYS HA H 1 4.9020 0.0000 . 1 . . . A 382 CYS HA . 18990 1 405 . 1 1 41 41 CYS HB2 H 1 3.6530 0.0000 . 2 . . . A 382 CYS HB2 . 18990 1 406 . 1 1 41 41 CYS HB3 H 1 2.5360 0.0000 . 2 . . . A 382 CYS HB3 . 18990 1 407 . 1 1 41 41 CYS C C 13 177.1650 0.0000 . 1 . . . A 382 CYS C . 18990 1 408 . 1 1 41 41 CYS CA C 13 57.6910 0.0000 . 1 . . . A 382 CYS CA . 18990 1 409 . 1 1 41 41 CYS CB C 13 32.4750 0.0000 . 1 . . . A 382 CYS CB . 18990 1 410 . 1 1 41 41 CYS N N 15 120.2210 0.0000 . 1 . . . A 382 CYS N . 18990 1 411 . 1 1 42 42 ARG H H 1 9.5340 0.0000 . 1 . . . A 383 ARG H . 18990 1 412 . 1 1 42 42 ARG HA H 1 4.0210 0.0000 . 1 . . . A 383 ARG HA . 18990 1 413 . 1 1 42 42 ARG HB2 H 1 1.9880 0.0000 . 2 . . . A 383 ARG HB2 . 18990 1 414 . 1 1 42 42 ARG HB3 H 1 1.6870 0.0000 . 2 . . . A 383 ARG HB3 . 18990 1 415 . 1 1 42 42 ARG HG2 H 1 1.8450 0.0000 . 2 . . . A 383 ARG HG2 . 18990 1 416 . 1 1 42 42 ARG HG3 H 1 1.5910 0.0000 . 2 . . . A 383 ARG HG3 . 18990 1 417 . 1 1 42 42 ARG HD2 H 1 3.1310 0.0000 . 2 . . . A 383 ARG HD2 . 18990 1 418 . 1 1 42 42 ARG C C 13 175.0120 0.0000 . 1 . . . A 383 ARG C . 18990 1 419 . 1 1 42 42 ARG CA C 13 58.6860 0.0000 . 1 . . . A 383 ARG CA . 18990 1 420 . 1 1 42 42 ARG CB C 13 30.9000 0.0000 . 1 . . . A 383 ARG CB . 18990 1 421 . 1 1 42 42 ARG CG C 13 26.8090 0.0000 . 1 . . . A 383 ARG CG . 18990 1 422 . 1 1 42 42 ARG CD C 13 43.7730 0.0000 . 1 . . . A 383 ARG CD . 18990 1 423 . 1 1 42 42 ARG N N 15 129.3470 0.0000 . 1 . . . A 383 ARG N . 18990 1 424 . 1 1 43 43 ASN H H 1 8.8400 0.0000 . 1 . . . A 384 ASN H . 18990 1 425 . 1 1 43 43 ASN HA H 1 4.7080 0.0000 . 1 . . . A 384 ASN HA . 18990 1 426 . 1 1 43 43 ASN HB2 H 1 2.9690 0.0000 . 2 . . . A 384 ASN HB2 . 18990 1 427 . 1 1 43 43 ASN HB3 H 1 2.7560 0.0000 . 2 . . . A 384 ASN HB3 . 18990 1 428 . 1 1 43 43 ASN HD21 H 1 7.8190 0.0000 . 2 . . . A 384 ASN HD21 . 18990 1 429 . 1 1 43 43 ASN HD22 H 1 7.0270 0.0000 . 2 . . . A 384 ASN HD22 . 18990 1 430 . 1 1 43 43 ASN C C 13 175.6560 0.0000 . 1 . . . A 384 ASN C . 18990 1 431 . 1 1 43 43 ASN CA C 13 55.7780 0.0000 . 1 . . . A 384 ASN CA . 18990 1 432 . 1 1 43 43 ASN CB C 13 39.4750 0.0000 . 1 . . . A 384 ASN CB . 18990 1 433 . 1 1 43 43 ASN N N 15 117.7720 0.0000 . 1 . . . A 384 ASN N . 18990 1 434 . 1 1 43 43 ASN ND2 N 15 113.6410 0.0000 . 1 . . . A 384 ASN ND2 . 18990 1 435 . 1 1 44 44 CYS H H 1 7.8680 0.0000 . 1 . . . A 385 CYS H . 18990 1 436 . 1 1 44 44 CYS HA H 1 5.0280 0.0000 . 1 . . . A 385 CYS HA . 18990 1 437 . 1 1 44 44 CYS HB2 H 1 3.4130 0.0000 . 2 . . . A 385 CYS HB2 . 18990 1 438 . 1 1 44 44 CYS HB3 H 1 3.0590 0.0000 . 2 . . . A 385 CYS HB3 . 18990 1 439 . 1 1 44 44 CYS C C 13 175.7030 0.0000 . 1 . . . A 385 CYS C . 18990 1 440 . 1 1 44 44 CYS CA C 13 58.1120 0.0000 . 1 . . . A 385 CYS CA . 18990 1 441 . 1 1 44 44 CYS CB C 13 32.3590 0.0000 . 1 . . . A 385 CYS CB . 18990 1 442 . 1 1 44 44 CYS N N 15 115.8760 0.0000 . 1 . . . A 385 CYS N . 18990 1 443 . 1 1 45 45 LEU H H 1 8.5140 0.0000 . 1 . . . A 386 LEU H . 18990 1 444 . 1 1 45 45 LEU HA H 1 4.3130 0.0000 . 1 . . . A 386 LEU HA . 18990 1 445 . 1 1 45 45 LEU HB2 H 1 2.1310 0.0000 . 2 . . . A 386 LEU HB2 . 18990 1 446 . 1 1 45 45 LEU HB3 H 1 1.6490 0.0000 . 2 . . . A 386 LEU HB3 . 18990 1 447 . 1 1 45 45 LEU HG H 1 0.9430 0.0000 . 1 . . . A 386 LEU HG . 18990 1 448 . 1 1 45 45 LEU HD11 H 1 0.9060 0.0000 . 2 . . . A 386 LEU HD11 . 18990 1 449 . 1 1 45 45 LEU HD12 H 1 0.9060 0.0000 . 2 . . . A 386 LEU HD12 . 18990 1 450 . 1 1 45 45 LEU HD13 H 1 0.9060 0.0000 . 2 . . . A 386 LEU HD13 . 18990 1 451 . 1 1 45 45 LEU C C 13 175.7220 0.0000 . 1 . . . A 386 LEU C . 18990 1 452 . 1 1 45 45 LEU CA C 13 57.0090 0.0000 . 1 . . . A 386 LEU CA . 18990 1 453 . 1 1 45 45 LEU CB C 13 38.4120 0.0000 . 1 . . . A 386 LEU CB . 18990 1 454 . 1 1 45 45 LEU CG C 13 25.3780 0.0000 . 1 . . . A 386 LEU CG . 18990 1 455 . 1 1 45 45 LEU CD1 C 13 22.8620 0.0000 . 2 . . . A 386 LEU CD1 . 18990 1 456 . 1 1 45 45 LEU N N 15 120.0820 0.0000 . 1 . . . A 386 LEU N . 18990 1 457 . 1 1 46 46 GLN H H 1 8.2480 0.0000 . 1 . . . A 387 GLN H . 18990 1 458 . 1 1 46 46 GLN HA H 1 4.7760 0.0000 . 1 . . . A 387 GLN HA . 18990 1 459 . 1 1 46 46 GLN HB2 H 1 2.4320 0.0000 . 2 . . . A 387 GLN HB2 . 18990 1 460 . 1 1 46 46 GLN HB3 H 1 2.4320 0.0000 . 2 . . . A 387 GLN HB3 . 18990 1 461 . 1 1 46 46 GLN HG2 H 1 2.5210 0.0000 . 2 . . . A 387 GLN HG2 . 18990 1 462 . 1 1 46 46 GLN HG3 H 1 2.5210 0.0000 . 2 . . . A 387 GLN HG3 . 18990 1 463 . 1 1 46 46 GLN C C 13 175.2990 0.0000 . 1 . . . A 387 GLN C . 18990 1 464 . 1 1 46 46 GLN CA C 13 54.0170 0.0000 . 1 . . . A 387 GLN CA . 18990 1 465 . 1 1 46 46 GLN CB C 13 30.3070 0.0000 . 1 . . . A 387 GLN CB . 18990 1 466 . 1 1 46 46 GLN CG C 13 34.3230 0.0000 . 1 . . . A 387 GLN CG . 18990 1 467 . 1 1 46 46 GLN N N 15 117.5790 0.0000 . 1 . . . A 387 GLN N . 18990 1 468 . 1 1 47 47 GLY H H 1 8.6950 0.0000 . 1 . . . A 388 GLY H . 18990 1 469 . 1 1 47 47 GLY HA2 H 1 4.0140 0.0000 . 2 . . . A 388 GLY HA2 . 18990 1 470 . 1 1 47 47 GLY HA3 H 1 3.8550 0.0000 . 2 . . . A 388 GLY HA3 . 18990 1 471 . 1 1 47 47 GLY C C 13 173.6930 0.0000 . 1 . . . A 388 GLY C . 18990 1 472 . 1 1 47 47 GLY CA C 13 46.1800 0.0000 . 1 . . . A 388 GLY CA . 18990 1 473 . 1 1 47 47 GLY N N 15 106.1070 0.0000 . 1 . . . A 388 GLY N . 18990 1 474 . 1 1 48 48 TYR H H 1 7.9230 0.0000 . 1 . . . A 389 TYR H . 18990 1 475 . 1 1 48 48 TYR HA H 1 3.6580 0.0000 . 1 . . . A 389 TYR HA . 18990 1 476 . 1 1 48 48 TYR HB2 H 1 2.5580 0.0000 . 2 . . . A 389 TYR HB2 . 18990 1 477 . 1 1 48 48 TYR HB3 H 1 2.4650 0.0000 . 2 . . . A 389 TYR HB3 . 18990 1 478 . 1 1 48 48 TYR HD1 H 1 6.7800 0.0000 . 3 . . . A 389 TYR HD1 . 18990 1 479 . 1 1 48 48 TYR HE1 H 1 6.5220 0.0000 . 3 . . . A 389 TYR HE1 . 18990 1 480 . 1 1 48 48 TYR C C 13 172.8600 0.0000 . 1 . . . A 389 TYR C . 18990 1 481 . 1 1 48 48 TYR CA C 13 62.9870 0.0000 . 1 . . . A 389 TYR CA . 18990 1 482 . 1 1 48 48 TYR CB C 13 38.0520 0.0000 . 1 . . . A 389 TYR CB . 18990 1 483 . 1 1 48 48 TYR CD1 C 13 132.0220 0.0000 . 1 . . . A 389 TYR CD1 . 18990 1 484 . 1 1 48 48 TYR CE1 C 13 118.7540 0.0000 . 1 . . . A 389 TYR CE1 . 18990 1 485 . 1 1 48 48 TYR N N 15 122.5140 0.0000 . 1 . . . A 389 TYR N . 18990 1 486 . 1 1 49 49 HIS H H 1 5.2910 0.0000 . 1 . . . A 390 HIS H . 18990 1 487 . 1 1 49 49 HIS HA H 1 4.7080 0.0000 . 1 . . . A 390 HIS HA . 18990 1 488 . 1 1 49 49 HIS HB2 H 1 3.1090 0.0000 . 2 . . . A 390 HIS HB2 . 18990 1 489 . 1 1 49 49 HIS HB3 H 1 2.9850 0.0000 . 2 . . . A 390 HIS HB3 . 18990 1 490 . 1 1 49 49 HIS HD2 H 1 6.8160 0.0000 . 1 . . . A 390 HIS HD2 . 18990 1 491 . 1 1 49 49 HIS C C 13 173.2350 0.0000 . 1 . . . A 390 HIS C . 18990 1 492 . 1 1 49 49 HIS CA C 13 51.4310 0.0000 . 1 . . . A 390 HIS CA . 18990 1 493 . 1 1 49 49 HIS CB C 13 31.9000 0.0000 . 1 . . . A 390 HIS CB . 18990 1 494 . 1 1 49 49 HIS CD2 C 13 127.1510 0.0000 . 1 . . . A 390 HIS CD2 . 18990 1 495 . 1 1 49 49 HIS N N 15 120.0800 0.0000 . 1 . . . A 390 HIS N . 18990 1 496 . 1 1 50 50 ILE H H 1 8.4180 0.0000 . 1 . . . A 391 ILE H . 18990 1 497 . 1 1 50 50 ILE HA H 1 4.1160 0.0000 . 1 . . . A 391 ILE HA . 18990 1 498 . 1 1 50 50 ILE HB H 1 1.9260 0.0000 . 1 . . . A 391 ILE HB . 18990 1 499 . 1 1 50 50 ILE HG12 H 1 1.3550 0.0000 . 2 . . . A 391 ILE HG12 . 18990 1 500 . 1 1 50 50 ILE HD11 H 1 0.9350 0.0000 . 1 . . . A 391 ILE HD11 . 18990 1 501 . 1 1 50 50 ILE HD12 H 1 0.9350 0.0000 . 1 . . . A 391 ILE HD12 . 18990 1 502 . 1 1 50 50 ILE HD13 H 1 0.9350 0.0000 . 1 . . . A 391 ILE HD13 . 18990 1 503 . 1 1 50 50 ILE C C 13 178.2080 0.0000 . 1 . . . A 391 ILE C . 18990 1 504 . 1 1 50 50 ILE CA C 13 60.8770 0.0000 . 1 . . . A 391 ILE CA . 18990 1 505 . 1 1 50 50 ILE CB C 13 39.0340 0.0000 . 1 . . . A 391 ILE CB . 18990 1 506 . 1 1 50 50 ILE CG1 C 13 26.7490 0.0000 . 1 . . . A 391 ILE CG1 . 18990 1 507 . 1 1 50 50 ILE CD1 C 13 18.0990 0.0000 . 1 . . . A 391 ILE CD1 . 18990 1 508 . 1 1 50 50 ILE N N 15 117.8100 0.0000 . 1 . . . A 391 ILE N . 18990 1 509 . 1 1 51 51 GLY H H 1 8.6540 0.0000 . 1 . . . A 392 GLY H . 18990 1 510 . 1 1 51 51 GLY HA2 H 1 4.1070 0.0000 . 2 . . . A 392 GLY HA2 . 18990 1 511 . 1 1 51 51 GLY HA3 H 1 3.9150 0.0000 . 2 . . . A 392 GLY HA3 . 18990 1 512 . 1 1 51 51 GLY C C 13 173.5650 0.0000 . 1 . . . A 392 GLY C . 18990 1 513 . 1 1 51 51 GLY CA C 13 45.2580 0.0000 . 1 . . . A 392 GLY CA . 18990 1 514 . 1 1 51 51 GLY N N 15 112.3870 0.0000 . 1 . . . A 392 GLY N . 18990 1 515 . 1 1 52 52 GLU H H 1 8.3910 0.0000 . 1 . . . A 393 GLU H . 18990 1 516 . 1 1 52 52 GLU HA H 1 4.2890 0.0000 . 1 . . . A 393 GLU HA . 18990 1 517 . 1 1 52 52 GLU HB2 H 1 2.0660 0.0000 . 2 . . . A 393 GLU HB2 . 18990 1 518 . 1 1 52 52 GLU HB3 H 1 1.8790 0.0000 . 2 . . . A 393 GLU HB3 . 18990 1 519 . 1 1 52 52 GLU HG2 H 1 2.3550 0.0000 . 2 . . . A 393 GLU HG2 . 18990 1 520 . 1 1 52 52 GLU C C 13 176.8990 0.0000 . 1 . . . A 393 GLU C . 18990 1 521 . 1 1 52 52 GLU CA C 13 56.4330 0.0000 . 1 . . . A 393 GLU CA . 18990 1 522 . 1 1 52 52 GLU CB C 13 30.4700 0.0000 . 1 . . . A 393 GLU CB . 18990 1 523 . 1 1 52 52 GLU CG C 13 36.3250 0.0000 . 1 . . . A 393 GLU CG . 18990 1 524 . 1 1 52 52 GLU N N 15 119.0980 0.0000 . 1 . . . A 393 GLU N . 18990 1 525 . 1 1 53 53 CYS H H 1 8.4740 0.0000 . 1 . . . A 394 CYS H . 18990 1 526 . 1 1 53 53 CYS HA H 1 3.7660 0.0000 . 1 . . . A 394 CYS HA . 18990 1 527 . 1 1 53 53 CYS HB2 H 1 2.8060 0.0000 . 2 . . . A 394 CYS HB2 . 18990 1 528 . 1 1 53 53 CYS HB3 H 1 2.6770 0.0000 . 2 . . . A 394 CYS HB3 . 18990 1 529 . 1 1 53 53 CYS C C 13 175.4610 0.0000 . 1 . . . A 394 CYS C . 18990 1 530 . 1 1 53 53 CYS CA C 13 59.8350 0.0000 . 1 . . . A 394 CYS CA . 18990 1 531 . 1 1 53 53 CYS CB C 13 30.7610 0.0000 . 1 . . . A 394 CYS CB . 18990 1 532 . 1 1 53 53 CYS N N 15 122.8450 0.0000 . 1 . . . A 394 CYS N . 18990 1 533 . 1 1 54 54 LEU H H 1 8.4180 0.0000 . 1 . . . A 395 LEU H . 18990 1 534 . 1 1 54 54 LEU HA H 1 4.5040 0.0000 . 1 . . . A 395 LEU HA . 18990 1 535 . 1 1 54 54 LEU HB2 H 1 1.4870 0.0000 . 2 . . . A 395 LEU HB2 . 18990 1 536 . 1 1 54 54 LEU HB3 H 1 1.4300 0.0000 . 2 . . . A 395 LEU HB3 . 18990 1 537 . 1 1 54 54 LEU HD11 H 1 0.8160 0.0000 . 2 . . . A 395 LEU HD11 . 18990 1 538 . 1 1 54 54 LEU HD12 H 1 0.8160 0.0000 . 2 . . . A 395 LEU HD12 . 18990 1 539 . 1 1 54 54 LEU HD13 H 1 0.8160 0.0000 . 2 . . . A 395 LEU HD13 . 18990 1 540 . 1 1 54 54 LEU C C 13 175.2590 0.0000 . 1 . . . A 395 LEU C . 18990 1 541 . 1 1 54 54 LEU CA C 13 52.8350 0.0000 . 1 . . . A 395 LEU CA . 18990 1 542 . 1 1 54 54 LEU CB C 13 41.4360 0.0000 . 1 . . . A 395 LEU CB . 18990 1 543 . 1 1 54 54 LEU CD1 C 13 23.1690 0.0000 . 2 . . . A 395 LEU CD1 . 18990 1 544 . 1 1 54 54 LEU N N 15 124.4030 0.0000 . 1 . . . A 395 LEU N . 18990 1 545 . 1 1 55 55 PRO HA H 1 4.3700 0.0000 . 1 . . . A 396 PRO HA . 18990 1 546 . 1 1 55 55 PRO HB2 H 1 2.2630 0.0000 . 2 . . . A 396 PRO HB2 . 18990 1 547 . 1 1 55 55 PRO HB3 H 1 1.8780 0.0000 . 2 . . . A 396 PRO HB3 . 18990 1 548 . 1 1 55 55 PRO HG2 H 1 1.9870 0.0000 . 2 . . . A 396 PRO HG2 . 18990 1 549 . 1 1 55 55 PRO HD2 H 1 3.7550 0.0000 . 2 . . . A 396 PRO HD2 . 18990 1 550 . 1 1 55 55 PRO HD3 H 1 3.5770 0.0000 . 2 . . . A 396 PRO HD3 . 18990 1 551 . 1 1 55 55 PRO C C 13 177.0060 0.0000 . 1 . . . A 396 PRO C . 18990 1 552 . 1 1 55 55 PRO CA C 13 63.0960 0.0000 . 1 . . . A 396 PRO CA . 18990 1 553 . 1 1 55 55 PRO CB C 13 32.0720 0.0000 . 1 . . . A 396 PRO CB . 18990 1 554 . 1 1 55 55 PRO CG C 13 27.4360 0.0000 . 1 . . . A 396 PRO CG . 18990 1 555 . 1 1 55 55 PRO CD C 13 50.4000 0.0000 . 1 . . . A 396 PRO CD . 18990 1 556 . 1 1 56 56 GLU H H 1 8.5680 0.0000 . 1 . . . A 397 GLU H . 18990 1 557 . 1 1 56 56 GLU HA H 1 4.2250 0.0000 . 1 . . . A 397 GLU HA . 18990 1 558 . 1 1 56 56 GLU HB2 H 1 2.2640 0.0000 . 2 . . . A 397 GLU HB2 . 18990 1 559 . 1 1 56 56 GLU HG2 H 1 2.4160 0.0000 . 2 . . . A 397 GLU HG2 . 18990 1 560 . 1 1 56 56 GLU C C 13 177.2020 0.0000 . 1 . . . A 397 GLU C . 18990 1 561 . 1 1 56 56 GLU CA C 13 57.0340 0.0000 . 1 . . . A 397 GLU CA . 18990 1 562 . 1 1 56 56 GLU CB C 13 30.2630 0.0000 . 1 . . . A 397 GLU CB . 18990 1 563 . 1 1 56 56 GLU CG C 13 36.2190 0.0000 . 1 . . . A 397 GLU CG . 18990 1 564 . 1 1 56 56 GLU N N 15 121.5740 0.0000 . 1 . . . A 397 GLU N . 18990 1 565 . 1 1 57 57 GLY H H 1 8.5150 0.0000 . 1 . . . A 398 GLY H . 18990 1 566 . 1 1 57 57 GLY HA2 H 1 4.0150 0.0000 . 2 . . . A 398 GLY HA2 . 18990 1 567 . 1 1 57 57 GLY C C 13 174.5790 0.0000 . 1 . . . A 398 GLY C . 18990 1 568 . 1 1 57 57 GLY CA C 13 45.4620 0.0000 . 1 . . . A 398 GLY CA . 18990 1 569 . 1 1 57 57 GLY N N 15 110.4950 0.0000 . 1 . . . A 398 GLY N . 18990 1 570 . 1 1 58 58 THR H H 1 8.0900 0.0000 . 1 . . . A 399 THR H . 18990 1 571 . 1 1 58 58 THR HA H 1 4.3980 0.0000 . 1 . . . A 399 THR HA . 18990 1 572 . 1 1 58 58 THR C C 13 175.3330 0.0000 . 1 . . . A 399 THR C . 18990 1 573 . 1 1 58 58 THR CA C 13 62.2330 0.0000 . 1 . . . A 399 THR CA . 18990 1 574 . 1 1 58 58 THR CB C 13 69.8330 0.0000 . 1 . . . A 399 THR CB . 18990 1 575 . 1 1 58 58 THR N N 15 113.2340 0.0000 . 1 . . . A 399 THR N . 18990 1 576 . 1 1 59 59 GLY H H 1 8.5240 0.0000 . 1 . . . A 400 GLY H . 18990 1 577 . 1 1 59 59 GLY HA2 H 1 3.9860 0.0000 . 2 . . . A 400 GLY HA2 . 18990 1 578 . 1 1 59 59 GLY C C 13 174.0480 0.0000 . 1 . . . A 400 GLY C . 18990 1 579 . 1 1 59 59 GLY CA C 13 45.4390 0.0000 . 1 . . . A 400 GLY CA . 18990 1 580 . 1 1 59 59 GLY N N 15 111.4790 0.0000 . 1 . . . A 400 GLY N . 18990 1 581 . 1 1 60 60 ALA H H 1 8.1790 0.0000 . 1 . . . A 401 ALA H . 18990 1 582 . 1 1 60 60 ALA HA H 1 4.2510 0.0000 . 1 . . . A 401 ALA HA . 18990 1 583 . 1 1 60 60 ALA HB1 H 1 1.2860 0.0000 . 1 . . . A 401 ALA HB1 . 18990 1 584 . 1 1 60 60 ALA HB2 H 1 1.2860 0.0000 . 1 . . . A 401 ALA HB2 . 18990 1 585 . 1 1 60 60 ALA HB3 H 1 1.2860 0.0000 . 1 . . . A 401 ALA HB3 . 18990 1 586 . 1 1 60 60 ALA C C 13 177.9420 0.0000 . 1 . . . A 401 ALA C . 18990 1 587 . 1 1 60 60 ALA CA C 13 52.7300 0.0000 . 1 . . . A 401 ALA CA . 18990 1 588 . 1 1 60 60 ALA CB C 13 19.1420 0.0000 . 1 . . . A 401 ALA CB . 18990 1 589 . 1 1 60 60 ALA N N 15 123.9190 0.0000 . 1 . . . A 401 ALA N . 18990 1 590 . 1 1 61 61 SER H H 1 8.3050 0.0000 . 1 . . . A 402 SER H . 18990 1 591 . 1 1 61 61 SER HA H 1 4.4480 0.0000 . 1 . . . A 402 SER HA . 18990 1 592 . 1 1 61 61 SER HB2 H 1 3.8890 0.0000 . 2 . . . A 402 SER HB2 . 18990 1 593 . 1 1 61 61 SER C C 13 174.4260 0.0000 . 1 . . . A 402 SER C . 18990 1 594 . 1 1 61 61 SER CA C 13 58.2890 0.0000 . 1 . . . A 402 SER CA . 18990 1 595 . 1 1 61 61 SER CB C 13 63.7720 0.0000 . 1 . . . A 402 SER CB . 18990 1 596 . 1 1 61 61 SER N N 15 114.9040 0.0000 . 1 . . . A 402 SER N . 18990 1 597 . 1 1 62 62 ALA H H 1 8.3450 0.0000 . 1 . . . A 403 ALA H . 18990 1 598 . 1 1 62 62 ALA HA H 1 4.3990 0.0000 . 1 . . . A 403 ALA HA . 18990 1 599 . 1 1 62 62 ALA HB1 H 1 1.4190 0.0000 . 1 . . . A 403 ALA HB1 . 18990 1 600 . 1 1 62 62 ALA HB2 H 1 1.4190 0.0000 . 1 . . . A 403 ALA HB2 . 18990 1 601 . 1 1 62 62 ALA HB3 H 1 1.4190 0.0000 . 1 . . . A 403 ALA HB3 . 18990 1 602 . 1 1 62 62 ALA C C 13 177.9840 0.0000 . 1 . . . A 403 ALA C . 18990 1 603 . 1 1 62 62 ALA CA C 13 52.6550 0.0000 . 1 . . . A 403 ALA CA . 18990 1 604 . 1 1 62 62 ALA CB C 13 19.1380 0.0000 . 1 . . . A 403 ALA CB . 18990 1 605 . 1 1 62 62 ALA N N 15 125.9650 0.0000 . 1 . . . A 403 ALA N . 18990 1 606 . 1 1 63 63 THR H H 1 8.1180 0.0000 . 1 . . . A 404 THR H . 18990 1 607 . 1 1 63 63 THR HB H 1 4.7940 0.0000 . 1 . . . A 404 THR HB . 18990 1 608 . 1 1 63 63 THR HG21 H 1 1.2790 0.0000 . 1 . . . A 404 THR HG21 . 18990 1 609 . 1 1 63 63 THR HG22 H 1 1.2790 0.0000 . 1 . . . A 404 THR HG22 . 18990 1 610 . 1 1 63 63 THR HG23 H 1 1.2790 0.0000 . 1 . . . A 404 THR HG23 . 18990 1 611 . 1 1 63 63 THR C C 13 174.4200 0.0000 . 1 . . . A 404 THR C . 18990 1 612 . 1 1 63 63 THR CA C 13 61.9880 0.0000 . 1 . . . A 404 THR CA . 18990 1 613 . 1 1 63 63 THR CB C 13 69.6880 0.0000 . 1 . . . A 404 THR CB . 18990 1 614 . 1 1 63 63 THR CG2 C 13 20.8510 0.0000 . 1 . . . A 404 THR CG2 . 18990 1 615 . 1 1 63 63 THR N N 15 112.7900 0.0000 . 1 . . . A 404 THR N . 18990 1 616 . 1 1 64 64 ASN H H 1 8.3960 0.0000 . 1 . . . A 405 ASN H . 18990 1 617 . 1 1 64 64 ASN N N 15 121.0500 0.0000 . 1 . . . A 405 ASN N . 18990 1 618 . 1 1 66 66 CYS HA H 1 4.5780 0.0000 . 1 . . . A 407 CYS HA . 18990 1 619 . 1 1 66 66 CYS HB2 H 1 2.8850 0.0000 . 2 . . . A 407 CYS HB2 . 18990 1 620 . 1 1 66 66 CYS C C 13 174.4890 0.0000 . 1 . . . A 407 CYS C . 18990 1 621 . 1 1 66 66 CYS CA C 13 58.7130 0.0000 . 1 . . . A 407 CYS CA . 18990 1 622 . 1 1 66 66 CYS CB C 13 28.1020 0.0000 . 1 . . . A 407 CYS CB . 18990 1 623 . 1 1 67 67 GLU H H 1 8.4150 0.0000 . 1 . . . A 408 GLU H . 18990 1 624 . 1 1 67 67 GLU C C 13 175.9540 0.0000 . 1 . . . A 408 GLU C . 18990 1 625 . 1 1 67 67 GLU CA C 13 56.8020 0.0000 . 1 . . . A 408 GLU CA . 18990 1 626 . 1 1 67 67 GLU CB C 13 30.3280 0.0000 . 1 . . . A 408 GLU CB . 18990 1 627 . 1 1 67 67 GLU N N 15 123.0210 0.0000 . 1 . . . A 408 GLU N . 18990 1 628 . 1 1 68 68 TYR H H 1 8.1350 0.0000 . 1 . . . A 409 TYR H . 18990 1 629 . 1 1 68 68 TYR HA H 1 4.6540 0.0000 . 1 . . . A 409 TYR HA . 18990 1 630 . 1 1 68 68 TYR HB2 H 1 3.0630 0.0000 . 2 . . . A 409 TYR HB2 . 18990 1 631 . 1 1 68 68 TYR HB3 H 1 2.9530 0.0000 . 2 . . . A 409 TYR HB3 . 18990 1 632 . 1 1 68 68 TYR HD1 H 1 7.1030 0.0000 . 3 . . . A 409 TYR HD1 . 18990 1 633 . 1 1 68 68 TYR HE1 H 1 6.8120 0.0000 . 3 . . . A 409 TYR HE1 . 18990 1 634 . 1 1 68 68 TYR C C 13 175.6130 0.0000 . 1 . . . A 409 TYR C . 18990 1 635 . 1 1 68 68 TYR CA C 13 57.6690 0.0000 . 1 . . . A 409 TYR CA . 18990 1 636 . 1 1 68 68 TYR CB C 13 38.8250 0.0000 . 1 . . . A 409 TYR CB . 18990 1 637 . 1 1 68 68 TYR CD1 C 13 133.1730 0.0000 . 1 . . . A 409 TYR CD1 . 18990 1 638 . 1 1 68 68 TYR CE1 C 13 118.2050 0.0000 . 1 . . . A 409 TYR CE1 . 18990 1 639 . 1 1 68 68 TYR N N 15 121.0150 0.0000 . 1 . . . A 409 TYR N . 18990 1 640 . 1 1 69 69 THR H H 1 8.0600 0.0000 . 1 . . . A 410 THR H . 18990 1 641 . 1 1 69 69 THR HA H 1 4.3060 0.0000 . 1 . . . A 410 THR HA . 18990 1 642 . 1 1 69 69 THR HB H 1 4.1040 0.0000 . 1 . . . A 410 THR HB . 18990 1 643 . 1 1 69 69 THR HG21 H 1 1.1560 0.0000 . 1 . . . A 410 THR HG21 . 18990 1 644 . 1 1 69 69 THR HG22 H 1 1.1560 0.0000 . 1 . . . A 410 THR HG22 . 18990 1 645 . 1 1 69 69 THR HG23 H 1 1.1560 0.0000 . 1 . . . A 410 THR HG23 . 18990 1 646 . 1 1 69 69 THR C C 13 173.8460 0.0000 . 1 . . . A 410 THR C . 18990 1 647 . 1 1 69 69 THR CA C 13 61.7300 0.0000 . 1 . . . A 410 THR CA . 18990 1 648 . 1 1 69 69 THR CB C 13 69.9140 0.0000 . 1 . . . A 410 THR CB . 18990 1 649 . 1 1 69 69 THR CG2 C 13 21.3350 0.0000 . 1 . . . A 410 THR CG2 . 18990 1 650 . 1 1 69 69 THR N N 15 116.9750 0.0000 . 1 . . . A 410 THR N . 18990 1 651 . 1 1 70 70 VAL H H 1 8.0890 0.0000 . 1 . . . A 411 VAL H . 18990 1 652 . 1 1 70 70 VAL HA H 1 4.0530 0.0000 . 1 . . . A 411 VAL HA . 18990 1 653 . 1 1 70 70 VAL HB H 1 2.0240 0.0000 . 1 . . . A 411 VAL HB . 18990 1 654 . 1 1 70 70 VAL HG11 H 1 0.8910 0.0000 . 2 . . . A 411 VAL HG11 . 18990 1 655 . 1 1 70 70 VAL HG12 H 1 0.8910 0.0000 . 2 . . . A 411 VAL HG12 . 18990 1 656 . 1 1 70 70 VAL HG13 H 1 0.8910 0.0000 . 2 . . . A 411 VAL HG13 . 18990 1 657 . 1 1 70 70 VAL C C 13 175.2750 0.0000 . 1 . . . A 411 VAL C . 18990 1 658 . 1 1 70 70 VAL CA C 13 61.8530 0.0000 . 1 . . . A 411 VAL CA . 18990 1 659 . 1 1 70 70 VAL CB C 13 32.9760 0.0000 . 1 . . . A 411 VAL CB . 18990 1 660 . 1 1 70 70 VAL CG1 C 13 20.6880 0.0000 . 2 . . . A 411 VAL CG1 . 18990 1 661 . 1 1 70 70 VAL N N 15 122.9000 0.0000 . 1 . . . A 411 VAL N . 18990 1 662 . 1 1 71 71 ASP H H 1 8.3970 0.0000 . 1 . . . A 412 ASP H . 18990 1 663 . 1 1 71 71 ASP HA H 1 4.8500 0.0000 . 1 . . . A 412 ASP HA . 18990 1 664 . 1 1 71 71 ASP HB2 H 1 2.7860 0.0000 . 2 . . . A 412 ASP HB2 . 18990 1 665 . 1 1 71 71 ASP HB3 H 1 2.5890 0.0000 . 2 . . . A 412 ASP HB3 . 18990 1 666 . 1 1 71 71 ASP CA C 13 51.5780 0.0000 . 1 . . . A 412 ASP CA . 18990 1 667 . 1 1 71 71 ASP CB C 13 41.5380 0.0000 . 1 . . . A 412 ASP CB . 18990 1 668 . 1 1 71 71 ASP N N 15 125.9240 0.0000 . 1 . . . A 412 ASP N . 18990 1 669 . 1 1 72 72 PRO HA H 1 4.3860 0.0000 . 1 . . . A 413 PRO HA . 18990 1 670 . 1 1 72 72 PRO HB2 H 1 2.2790 0.0000 . 2 . . . A 413 PRO HB2 . 18990 1 671 . 1 1 72 72 PRO HB3 H 1 1.9460 0.0000 . 2 . . . A 413 PRO HB3 . 18990 1 672 . 1 1 72 72 PRO HG2 H 1 1.9990 0.0000 . 2 . . . A 413 PRO HG2 . 18990 1 673 . 1 1 72 72 PRO HG3 H 1 1.9490 0.0000 . 2 . . . A 413 PRO HG3 . 18990 1 674 . 1 1 72 72 PRO HD2 H 1 3.8800 0.0000 . 2 . . . A 413 PRO HD2 . 18990 1 675 . 1 1 72 72 PRO C C 13 177.3520 0.0000 . 1 . . . A 413 PRO C . 18990 1 676 . 1 1 72 72 PRO CA C 13 63.9100 0.0000 . 1 . . . A 413 PRO CA . 18990 1 677 . 1 1 72 72 PRO CB C 13 32.2680 0.0000 . 1 . . . A 413 PRO CB . 18990 1 678 . 1 1 72 72 PRO CG C 13 26.9490 0.0000 . 1 . . . A 413 PRO CG . 18990 1 679 . 1 1 72 72 PRO CD C 13 50.9600 0.0000 . 1 . . . A 413 PRO CD . 18990 1 680 . 1 1 73 73 ASN H H 1 8.4960 0.0000 . 1 . . . A 414 ASN H . 18990 1 681 . 1 1 73 73 ASN HA H 1 4.6770 0.0000 . 1 . . . A 414 ASN HA . 18990 1 682 . 1 1 73 73 ASN HB2 H 1 2.8540 0.0000 . 2 . . . A 414 ASN HB2 . 18990 1 683 . 1 1 73 73 ASN HB3 H 1 2.7690 0.0000 . 2 . . . A 414 ASN HB3 . 18990 1 684 . 1 1 73 73 ASN HD21 H 1 7.8300 0.0000 . 2 . . . A 414 ASN HD21 . 18990 1 685 . 1 1 73 73 ASN HD22 H 1 6.9740 0.0000 . 2 . . . A 414 ASN HD22 . 18990 1 686 . 1 1 73 73 ASN C C 13 175.5320 0.0000 . 1 . . . A 414 ASN C . 18990 1 687 . 1 1 73 73 ASN CA C 13 53.8240 0.0000 . 1 . . . A 414 ASN CA . 18990 1 688 . 1 1 73 73 ASN CB C 13 38.7280 0.0000 . 1 . . . A 414 ASN CB . 18990 1 689 . 1 1 73 73 ASN N N 15 117.0350 0.0000 . 1 . . . A 414 ASN N . 18990 1 690 . 1 1 73 73 ASN ND2 N 15 114.3090 0.0000 . 1 . . . A 414 ASN ND2 . 18990 1 691 . 1 1 74 74 ARG H H 1 7.8040 0.0000 . 1 . . . A 415 ARG H . 18990 1 692 . 1 1 74 74 ARG HA H 1 4.2440 0.0000 . 1 . . . A 415 ARG HA . 18990 1 693 . 1 1 74 74 ARG C C 13 176.2430 0.0000 . 1 . . . A 415 ARG C . 18990 1 694 . 1 1 74 74 ARG CA C 13 56.4040 0.0000 . 1 . . . A 415 ARG CA . 18990 1 695 . 1 1 74 74 ARG CB C 13 30.6370 0.0000 . 1 . . . A 415 ARG CB . 18990 1 696 . 1 1 74 74 ARG N N 15 121.0000 0.0000 . 1 . . . A 415 ARG N . 18990 1 697 . 1 1 75 75 ALA H H 1 8.1890 0.0000 . 1 . . . A 416 ALA H . 18990 1 698 . 1 1 75 75 ALA C C 13 177.8310 0.0000 . 1 . . . A 416 ALA C . 18990 1 699 . 1 1 75 75 ALA CA C 13 52.9570 0.0000 . 1 . . . A 416 ALA CA . 18990 1 700 . 1 1 75 75 ALA CB C 13 19.0590 0.0000 . 1 . . . A 416 ALA CB . 18990 1 701 . 1 1 75 75 ALA N N 15 124.8800 0.0000 . 1 . . . A 416 ALA N . 18990 1 702 . 1 1 76 76 ALA H H 1 8.1690 0.0000 . 1 . . . A 417 ALA H . 18990 1 703 . 1 1 76 76 ALA HA H 1 4.2470 0.0000 . 1 . . . A 417 ALA HA . 18990 1 704 . 1 1 76 76 ALA HB1 H 1 1.3870 0.0000 . 1 . . . A 417 ALA HB1 . 18990 1 705 . 1 1 76 76 ALA HB2 H 1 1.3870 0.0000 . 1 . . . A 417 ALA HB2 . 18990 1 706 . 1 1 76 76 ALA HB3 H 1 1.3870 0.0000 . 1 . . . A 417 ALA HB3 . 18990 1 707 . 1 1 76 76 ALA C C 13 178.0240 0.0000 . 1 . . . A 417 ALA C . 18990 1 708 . 1 1 76 76 ALA CA C 13 52.7890 0.0000 . 1 . . . A 417 ALA CA . 18990 1 709 . 1 1 76 76 ALA CB C 13 19.0420 0.0000 . 1 . . . A 417 ALA CB . 18990 1 710 . 1 1 76 76 ALA N N 15 122.6140 0.0000 . 1 . . . A 417 ALA N . 18990 1 711 . 1 1 77 77 GLU H H 1 8.1840 0.0000 . 1 . . . A 418 GLU H . 18990 1 712 . 1 1 77 77 GLU HA H 1 4.1890 0.0000 . 1 . . . A 418 GLU HA . 18990 1 713 . 1 1 77 77 GLU HB2 H 1 2.0500 0.0000 . 2 . . . A 418 GLU HB2 . 18990 1 714 . 1 1 77 77 GLU HB3 H 1 1.9230 0.0000 . 2 . . . A 418 GLU HB3 . 18990 1 715 . 1 1 77 77 GLU HG2 H 1 2.2570 0.0000 . 2 . . . A 418 GLU HG2 . 18990 1 716 . 1 1 77 77 GLU C C 13 176.2660 0.0000 . 1 . . . A 418 GLU C . 18990 1 717 . 1 1 77 77 GLU CA C 13 56.5760 0.0000 . 1 . . . A 418 GLU CA . 18990 1 718 . 1 1 77 77 GLU CB C 13 30.3070 0.0000 . 1 . . . A 418 GLU CB . 18990 1 719 . 1 1 77 77 GLU CG C 13 36.2320 0.0000 . 1 . . . A 418 GLU CG . 18990 1 720 . 1 1 77 77 GLU N N 15 119.5000 0.0000 . 1 . . . A 418 GLU N . 18990 1 721 . 1 1 78 78 ALA H H 1 8.1350 0.0000 . 1 . . . A 419 ALA H . 18990 1 722 . 1 1 78 78 ALA HA H 1 4.2500 0.0000 . 1 . . . A 419 ALA HA . 18990 1 723 . 1 1 78 78 ALA HB1 H 1 1.2940 0.0000 . 1 . . . A 419 ALA HB1 . 18990 1 724 . 1 1 78 78 ALA HB2 H 1 1.2940 0.0000 . 1 . . . A 419 ALA HB2 . 18990 1 725 . 1 1 78 78 ALA HB3 H 1 1.2940 0.0000 . 1 . . . A 419 ALA HB3 . 18990 1 726 . 1 1 78 78 ALA C C 13 177.4880 0.0000 . 1 . . . A 419 ALA C . 18990 1 727 . 1 1 78 78 ALA CA C 13 52.5090 0.0000 . 1 . . . A 419 ALA CA . 18990 1 728 . 1 1 78 78 ALA CB C 13 19.1610 0.0000 . 1 . . . A 419 ALA CB . 18990 1 729 . 1 1 78 78 ALA N N 15 124.6430 0.0000 . 1 . . . A 419 ALA N . 18990 1 730 . 1 1 79 79 ARG H H 1 8.1350 0.0000 . 1 . . . A 420 ARG H . 18990 1 731 . 1 1 79 79 ARG HA H 1 4.2930 0.0000 . 1 . . . A 420 ARG HA . 18990 1 732 . 1 1 79 79 ARG HB2 H 1 1.7450 0.0000 . 2 . . . A 420 ARG HB2 . 18990 1 733 . 1 1 79 79 ARG HB3 H 1 1.6690 0.0000 . 2 . . . A 420 ARG HB3 . 18990 1 734 . 1 1 79 79 ARG HG2 H 1 1.4870 0.0000 . 2 . . . A 420 ARG HG2 . 18990 1 735 . 1 1 79 79 ARG HG3 H 1 1.5050 0.0000 . 2 . . . A 420 ARG HG3 . 18990 1 736 . 1 1 79 79 ARG HD2 H 1 3.1120 0.0000 . 2 . . . A 420 ARG HD2 . 18990 1 737 . 1 1 79 79 ARG C C 13 176.2970 0.0000 . 1 . . . A 420 ARG C . 18990 1 738 . 1 1 79 79 ARG CA C 13 55.9330 0.0000 . 1 . . . A 420 ARG CA . 18990 1 739 . 1 1 79 79 ARG CB C 13 30.8500 0.0000 . 1 . . . A 420 ARG CB . 18990 1 740 . 1 1 79 79 ARG CG C 13 26.9610 0.0000 . 1 . . . A 420 ARG CG . 18990 1 741 . 1 1 79 79 ARG CD C 13 43.2880 0.0000 . 1 . . . A 420 ARG CD . 18990 1 742 . 1 1 79 79 ARG N N 15 120.0030 0.0000 . 1 . . . A 420 ARG N . 18990 1 743 . 1 1 80 80 TRP H H 1 8.1590 0.0000 . 1 . . . A 421 TRP H . 18990 1 744 . 1 1 80 80 TRP HA H 1 4.6630 0.0000 . 1 . . . A 421 TRP HA . 18990 1 745 . 1 1 80 80 TRP HB2 H 1 3.3130 0.0000 . 2 . . . A 421 TRP HB2 . 18990 1 746 . 1 1 80 80 TRP HB3 H 1 3.2400 0.0000 . 2 . . . A 421 TRP HB3 . 18990 1 747 . 1 1 80 80 TRP HD1 H 1 7.2640 0.0000 . 1 . . . A 421 TRP HD1 . 18990 1 748 . 1 1 80 80 TRP HE1 H 1 10.1350 0.0000 . 1 . . . A 421 TRP HE1 . 18990 1 749 . 1 1 80 80 TRP HE3 H 1 7.6320 0.0000 . 1 . . . A 421 TRP HE3 . 18990 1 750 . 1 1 80 80 TRP HZ2 H 1 7.4920 0.0000 . 1 . . . A 421 TRP HZ2 . 18990 1 751 . 1 1 80 80 TRP HZ3 H 1 7.1590 0.0000 . 1 . . . A 421 TRP HZ3 . 18990 1 752 . 1 1 80 80 TRP HH2 H 1 7.2600 0.0000 . 1 . . . A 421 TRP HH2 . 18990 1 753 . 1 1 80 80 TRP C C 13 175.8560 0.0000 . 1 . . . A 421 TRP C . 18990 1 754 . 1 1 80 80 TRP CA C 13 57.4040 0.0000 . 1 . . . A 421 TRP CA . 18990 1 755 . 1 1 80 80 TRP CB C 13 29.4370 0.0000 . 1 . . . A 421 TRP CB . 18990 1 756 . 1 1 80 80 TRP CD1 C 13 124.8070 0.0000 . 1 . . . A 421 TRP CD1 . 18990 1 757 . 1 1 80 80 TRP CE3 C 13 120.8910 0.0000 . 1 . . . A 421 TRP CE3 . 18990 1 758 . 1 1 80 80 TRP CZ2 C 13 114.5400 0.0000 . 1 . . . A 421 TRP CZ2 . 18990 1 759 . 1 1 80 80 TRP CZ3 C 13 122.0840 0.0000 . 1 . . . A 421 TRP CZ3 . 18990 1 760 . 1 1 80 80 TRP CH2 C 13 127.1300 0.0000 . 1 . . . A 421 TRP CH2 . 18990 1 761 . 1 1 80 80 TRP N N 15 122.2800 0.0000 . 1 . . . A 421 TRP N . 18990 1 762 . 1 1 80 80 TRP NE1 N 15 129.4170 0.0000 . 1 . . . A 421 TRP NE1 . 18990 1 763 . 1 1 81 81 ASP H H 1 8.1350 0.0000 . 1 . . . A 422 ASP H . 18990 1 764 . 1 1 81 81 ASP HA H 1 4.4950 0.0000 . 1 . . . A 422 ASP HA . 18990 1 765 . 1 1 81 81 ASP HB2 H 1 2.5040 0.0000 . 2 . . . A 422 ASP HB2 . 18990 1 766 . 1 1 81 81 ASP HB3 H 1 2.4310 0.0000 . 2 . . . A 422 ASP HB3 . 18990 1 767 . 1 1 81 81 ASP C C 13 176.1840 0.0000 . 1 . . . A 422 ASP C . 18990 1 768 . 1 1 81 81 ASP CA C 13 53.8990 0.0000 . 1 . . . A 422 ASP CA . 18990 1 769 . 1 1 81 81 ASP CB C 13 40.9480 0.0000 . 1 . . . A 422 ASP CB . 18990 1 770 . 1 1 81 81 ASP N N 15 121.9800 0.0000 . 1 . . . A 422 ASP N . 18990 1 771 . 1 1 82 82 GLU H H 1 8.1530 0.0000 . 1 . . . A 423 GLU H . 18990 1 772 . 1 1 82 82 GLU HA H 1 4.0900 0.0000 . 1 . . . A 423 GLU HA . 18990 1 773 . 1 1 82 82 GLU HB2 H 1 2.0420 0.0000 . 2 . . . A 423 GLU HB2 . 18990 1 774 . 1 1 82 82 GLU HB3 H 1 1.9440 0.0000 . 2 . . . A 423 GLU HB3 . 18990 1 775 . 1 1 82 82 GLU HG2 H 1 2.2530 0.0000 . 2 . . . A 423 GLU HG2 . 18990 1 776 . 1 1 82 82 GLU C C 13 176.7200 0.0000 . 1 . . . A 423 GLU C . 18990 1 777 . 1 1 82 82 GLU CA C 13 57.1690 0.0000 . 1 . . . A 423 GLU CA . 18990 1 778 . 1 1 82 82 GLU CB C 13 30.1560 0.0000 . 1 . . . A 423 GLU CB . 18990 1 779 . 1 1 82 82 GLU CG C 13 36.2890 0.0000 . 1 . . . A 423 GLU CG . 18990 1 780 . 1 1 82 82 GLU N N 15 121.9900 0.0000 . 1 . . . A 423 GLU N . 18990 1 781 . 1 1 83 83 ALA H H 1 8.2430 0.0000 . 1 . . . A 424 ALA H . 18990 1 782 . 1 1 83 83 ALA HA H 1 4.2800 0.0000 . 1 . . . A 424 ALA HA . 18990 1 783 . 1 1 83 83 ALA HB1 H 1 1.3950 0.0000 . 1 . . . A 424 ALA HB1 . 18990 1 784 . 1 1 83 83 ALA HB2 H 1 1.3950 0.0000 . 1 . . . A 424 ALA HB2 . 18990 1 785 . 1 1 83 83 ALA HB3 H 1 1.3950 0.0000 . 1 . . . A 424 ALA HB3 . 18990 1 786 . 1 1 83 83 ALA C C 13 178.0950 0.0000 . 1 . . . A 424 ALA C . 18990 1 787 . 1 1 83 83 ALA CA C 13 53.0170 0.0000 . 1 . . . A 424 ALA CA . 18990 1 788 . 1 1 83 83 ALA CB C 13 19.0860 0.0000 . 1 . . . A 424 ALA CB . 18990 1 789 . 1 1 83 83 ALA N N 15 123.9000 0.0000 . 1 . . . A 424 ALA N . 18990 1 790 . 1 1 84 84 SER H H 1 8.0630 0.0000 . 1 . . . A 425 SER H . 18990 1 791 . 1 1 84 84 SER HA H 1 4.3870 0.0000 . 1 . . . A 425 SER HA . 18990 1 792 . 1 1 84 84 SER HB2 H 1 3.8500 0.0000 . 2 . . . A 425 SER HB2 . 18990 1 793 . 1 1 84 84 SER C C 13 174.3380 0.0000 . 1 . . . A 425 SER C . 18990 1 794 . 1 1 84 84 SER CA C 13 58.5460 0.0000 . 1 . . . A 425 SER CA . 18990 1 795 . 1 1 84 84 SER CB C 13 63.7840 0.0000 . 1 . . . A 425 SER CB . 18990 1 796 . 1 1 84 84 SER N N 15 113.8810 0.0000 . 1 . . . A 425 SER N . 18990 1 797 . 1 1 85 85 ASN H H 1 8.3910 0.0000 . 1 . . . A 426 ASN H . 18990 1 798 . 1 1 85 85 ASN HA H 1 4.7060 0.0000 . 1 . . . A 426 ASN HA . 18990 1 799 . 1 1 85 85 ASN HB2 H 1 2.8420 0.0000 . 2 . . . A 426 ASN HB2 . 18990 1 800 . 1 1 85 85 ASN HB3 H 1 2.7620 0.0000 . 2 . . . A 426 ASN HB3 . 18990 1 801 . 1 1 85 85 ASN HD21 H 1 7.5820 0.0000 . 2 . . . A 426 ASN HD21 . 18990 1 802 . 1 1 85 85 ASN HD22 H 1 6.8700 0.0000 . 2 . . . A 426 ASN HD22 . 18990 1 803 . 1 1 85 85 ASN C C 13 175.0460 0.0000 . 1 . . . A 426 ASN C . 18990 1 804 . 1 1 85 85 ASN CA C 13 53.4450 0.0000 . 1 . . . A 426 ASN CA . 18990 1 805 . 1 1 85 85 ASN CB C 13 38.8470 0.0000 . 1 . . . A 426 ASN CB . 18990 1 806 . 1 1 85 85 ASN N N 15 121.0320 0.0000 . 1 . . . A 426 ASN N . 18990 1 807 . 1 1 85 85 ASN ND2 N 15 112.8690 0.0000 . 1 . . . A 426 ASN ND2 . 18990 1 808 . 1 1 86 86 VAL H H 1 7.9540 0.0000 . 1 . . . A 427 VAL H . 18990 1 809 . 1 1 86 86 VAL HA H 1 4.1930 0.0000 . 1 . . . A 427 VAL HA . 18990 1 810 . 1 1 86 86 VAL HB H 1 2.1140 0.0000 . 1 . . . A 427 VAL HB . 18990 1 811 . 1 1 86 86 VAL HG11 H 1 0.9280 0.0000 . 2 . . . A 427 VAL HG11 . 18990 1 812 . 1 1 86 86 VAL HG12 H 1 0.9280 0.0000 . 2 . . . A 427 VAL HG12 . 18990 1 813 . 1 1 86 86 VAL HG13 H 1 0.9280 0.0000 . 2 . . . A 427 VAL HG13 . 18990 1 814 . 1 1 86 86 VAL HG21 H 1 0.9320 0.0000 . 2 . . . A 427 VAL HG21 . 18990 1 815 . 1 1 86 86 VAL HG22 H 1 0.9320 0.0000 . 2 . . . A 427 VAL HG22 . 18990 1 816 . 1 1 86 86 VAL HG23 H 1 0.9320 0.0000 . 2 . . . A 427 VAL HG23 . 18990 1 817 . 1 1 86 86 VAL C C 13 176.2130 0.0000 . 1 . . . A 427 VAL C . 18990 1 818 . 1 1 86 86 VAL CA C 13 62.4490 0.0000 . 1 . . . A 427 VAL CA . 18990 1 819 . 1 1 86 86 VAL CB C 13 32.8650 0.0000 . 1 . . . A 427 VAL CB . 18990 1 820 . 1 1 86 86 VAL CG1 C 13 20.6050 0.0000 . 2 . . . A 427 VAL CG1 . 18990 1 821 . 1 1 86 86 VAL CG2 C 13 20.9200 0.0000 . 2 . . . A 427 VAL CG2 . 18990 1 822 . 1 1 86 86 VAL N N 15 119.4630 0.0000 . 1 . . . A 427 VAL N . 18990 1 823 . 1 1 87 87 THR H H 1 8.2250 0.0000 . 1 . . . A 428 THR H . 18990 1 824 . 1 1 87 87 THR HA H 1 4.3530 0.0000 . 1 . . . A 428 THR HA . 18990 1 825 . 1 1 87 87 THR HB H 1 4.2640 0.0000 . 1 . . . A 428 THR HB . 18990 1 826 . 1 1 87 87 THR HG21 H 1 1.1960 0.0000 . 1 . . . A 428 THR HG21 . 18990 1 827 . 1 1 87 87 THR HG22 H 1 1.1960 0.0000 . 1 . . . A 428 THR HG22 . 18990 1 828 . 1 1 87 87 THR HG23 H 1 1.1960 0.0000 . 1 . . . A 428 THR HG23 . 18990 1 829 . 1 1 87 87 THR C C 13 174.3610 0.0000 . 1 . . . A 428 THR C . 18990 1 830 . 1 1 87 87 THR CA C 13 62.0650 0.0000 . 1 . . . A 428 THR CA . 18990 1 831 . 1 1 87 87 THR CB C 13 69.7290 0.0000 . 1 . . . A 428 THR CB . 18990 1 832 . 1 1 87 87 THR CG2 C 13 21.5370 0.0000 . 1 . . . A 428 THR CG2 . 18990 1 833 . 1 1 87 87 THR N N 15 118.2260 0.0000 . 1 . . . A 428 THR N . 18990 1 834 . 1 1 88 88 ILE H H 1 8.1480 0.0000 . 1 . . . A 429 ILE H . 18990 1 835 . 1 1 88 88 ILE HA H 1 4.1880 0.0000 . 1 . . . A 429 ILE HA . 18990 1 836 . 1 1 88 88 ILE HB H 1 1.8590 0.0000 . 1 . . . A 429 ILE HB . 18990 1 837 . 1 1 88 88 ILE HG12 H 1 1.4730 0.0000 . 2 . . . A 429 ILE HG12 . 18990 1 838 . 1 1 88 88 ILE HG13 H 1 1.1790 0.0000 . 2 . . . A 429 ILE HG13 . 18990 1 839 . 1 1 88 88 ILE HG21 H 1 0.8960 0.0000 . 1 . . . A 429 ILE HG21 . 18990 1 840 . 1 1 88 88 ILE HG22 H 1 0.8960 0.0000 . 1 . . . A 429 ILE HG22 . 18990 1 841 . 1 1 88 88 ILE HG23 H 1 0.8960 0.0000 . 1 . . . A 429 ILE HG23 . 18990 1 842 . 1 1 88 88 ILE HD11 H 1 0.8450 0.0000 . 1 . . . A 429 ILE HD11 . 18990 1 843 . 1 1 88 88 ILE HD12 H 1 0.8450 0.0000 . 1 . . . A 429 ILE HD12 . 18990 1 844 . 1 1 88 88 ILE HD13 H 1 0.8450 0.0000 . 1 . . . A 429 ILE HD13 . 18990 1 845 . 1 1 88 88 ILE C C 13 175.7740 0.0000 . 1 . . . A 429 ILE C . 18990 1 846 . 1 1 88 88 ILE CA C 13 60.8190 0.0000 . 1 . . . A 429 ILE CA . 18990 1 847 . 1 1 88 88 ILE CB C 13 38.7190 0.0000 . 1 . . . A 429 ILE CB . 18990 1 848 . 1 1 88 88 ILE CG1 C 13 27.3510 0.0000 . 1 . . . A 429 ILE CG1 . 18990 1 849 . 1 1 88 88 ILE CG2 C 13 17.4780 0.0000 . 1 . . . A 429 ILE CG2 . 18990 1 850 . 1 1 88 88 ILE CD1 C 13 12.8120 0.0000 . 1 . . . A 429 ILE CD1 . 18990 1 851 . 1 1 88 88 ILE N N 15 123.9100 0.0000 . 1 . . . A 429 ILE N . 18990 1 852 . 1 1 89 89 LYS H H 1 8.4060 0.0000 . 1 . . . A 430 LYS H . 18990 1 853 . 1 1 89 89 LYS HA H 1 4.4340 0.0000 . 1 . . . A 430 LYS HA . 18990 1 854 . 1 1 89 89 LYS HB2 H 1 1.8340 0.0000 . 2 . . . A 430 LYS HB2 . 18990 1 855 . 1 1 89 89 LYS HB3 H 1 1.7690 0.0000 . 2 . . . A 430 LYS HB3 . 18990 1 856 . 1 1 89 89 LYS HG2 H 1 1.4480 0.0000 . 2 . . . A 430 LYS HG2 . 18990 1 857 . 1 1 89 89 LYS HG3 H 1 1.3830 0.0000 . 2 . . . A 430 LYS HG3 . 18990 1 858 . 1 1 89 89 LYS HD2 H 1 1.6750 0.0000 . 2 . . . A 430 LYS HD2 . 18990 1 859 . 1 1 89 89 LYS HE2 H 1 2.9900 0.0000 . 2 . . . A 430 LYS HE2 . 18990 1 860 . 1 1 89 89 LYS C C 13 176.2410 0.0000 . 1 . . . A 430 LYS C . 18990 1 861 . 1 1 89 89 LYS CA C 13 55.9370 0.0000 . 1 . . . A 430 LYS CA . 18990 1 862 . 1 1 89 89 LYS CB C 13 33.1640 0.0000 . 1 . . . A 430 LYS CB . 18990 1 863 . 1 1 89 89 LYS CG C 13 24.8130 0.0000 . 1 . . . A 430 LYS CG . 18990 1 864 . 1 1 89 89 LYS CD C 13 29.0460 0.0000 . 1 . . . A 430 LYS CD . 18990 1 865 . 1 1 89 89 LYS CE C 13 42.1770 0.0000 . 1 . . . A 430 LYS CE . 18990 1 866 . 1 1 89 89 LYS N N 15 126.4530 0.0000 . 1 . . . A 430 LYS N . 18990 1 867 . 1 1 90 90 VAL H H 1 8.3120 0.0000 . 1 . . . A 431 VAL H . 18990 1 868 . 1 1 90 90 VAL HA H 1 4.2800 0.0000 . 1 . . . A 431 VAL HA . 18990 1 869 . 1 1 90 90 VAL HB H 1 2.1660 0.0000 . 1 . . . A 431 VAL HB . 18990 1 870 . 1 1 90 90 VAL HG11 H 1 1.0020 0.0000 . 2 . . . A 431 VAL HG11 . 18990 1 871 . 1 1 90 90 VAL HG12 H 1 1.0020 0.0000 . 2 . . . A 431 VAL HG12 . 18990 1 872 . 1 1 90 90 VAL HG13 H 1 1.0020 0.0000 . 2 . . . A 431 VAL HG13 . 18990 1 873 . 1 1 90 90 VAL CA C 13 62.3030 0.0000 . 1 . . . A 431 VAL CA . 18990 1 874 . 1 1 90 90 VAL CB C 13 33.1320 0.0000 . 1 . . . A 431 VAL CB . 18990 1 875 . 1 1 90 90 VAL CG1 C 13 21.3700 0.0000 . 2 . . . A 431 VAL CG1 . 18990 1 876 . 1 1 90 90 VAL N N 15 122.4960 0.0000 . 1 . . . A 431 VAL N . 18990 1 877 . 1 1 91 91 SER HA H 1 4.4860 0.0000 . 1 . . . A 432 SER HA . 18990 1 878 . 1 1 91 91 SER HB2 H 1 4.0780 0.0000 . 2 . . . A 432 SER HB2 . 18990 1 879 . 1 1 91 91 SER HB3 H 1 4.0010 0.0000 . 2 . . . A 432 SER HB3 . 18990 1 880 . 1 1 91 91 SER C C 13 173.8340 0.0000 . 1 . . . A 432 SER C . 18990 1 881 . 1 1 91 91 SER CA C 13 58.6500 0.0000 . 1 . . . A 432 SER CA . 18990 1 882 . 1 1 91 91 SER CB C 13 64.1520 0.0000 . 1 . . . A 432 SER CB . 18990 1 883 . 1 1 92 92 THR H H 1 7.8330 0.0000 . 1 . . . A 433 THR H . 18990 1 884 . 1 1 92 92 THR HA H 1 5.4460 0.0000 . 1 . . . A 433 THR HA . 18990 1 885 . 1 1 92 92 THR HB H 1 3.9620 0.0000 . 1 . . . A 433 THR HB . 18990 1 886 . 1 1 92 92 THR HG21 H 1 1.1330 0.0000 . 1 . . . A 433 THR HG21 . 18990 1 887 . 1 1 92 92 THR HG22 H 1 1.1330 0.0000 . 1 . . . A 433 THR HG22 . 18990 1 888 . 1 1 92 92 THR HG23 H 1 1.1330 0.0000 . 1 . . . A 433 THR HG23 . 18990 1 889 . 1 1 92 92 THR C C 13 173.9790 0.0000 . 1 . . . A 433 THR C . 18990 1 890 . 1 1 92 92 THR CA C 13 60.4120 0.0000 . 1 . . . A 433 THR CA . 18990 1 891 . 1 1 92 92 THR CB C 13 71.8960 0.0000 . 1 . . . A 433 THR CB . 18990 1 892 . 1 1 92 92 THR CG2 C 13 21.6810 0.0000 . 1 . . . A 433 THR CG2 . 18990 1 893 . 1 1 92 92 THR N N 15 114.7060 0.0000 . 1 . . . A 433 THR N . 18990 1 894 . 1 1 93 93 LYS H H 1 8.9370 0.0000 . 1 . . . A 434 LYS H . 18990 1 895 . 1 1 93 93 LYS HA H 1 4.7090 0.0000 . 1 . . . A 434 LYS HA . 18990 1 896 . 1 1 93 93 LYS HB2 H 1 1.4590 0.0000 . 2 . . . A 434 LYS HB2 . 18990 1 897 . 1 1 93 93 LYS HB3 H 1 1.3530 0.0000 . 2 . . . A 434 LYS HB3 . 18990 1 898 . 1 1 93 93 LYS HG2 H 1 1.0890 0.0000 . 2 . . . A 434 LYS HG2 . 18990 1 899 . 1 1 93 93 LYS HG3 H 1 0.7820 0.0000 . 2 . . . A 434 LYS HG3 . 18990 1 900 . 1 1 93 93 LYS HD2 H 1 1.0050 0.0000 . 2 . . . A 434 LYS HD2 . 18990 1 901 . 1 1 93 93 LYS HD3 H 1 -0.0880 0.0000 . 2 . . . A 434 LYS HD3 . 18990 1 902 . 1 1 93 93 LYS HE2 H 1 2.4040 0.0000 . 2 . . . A 434 LYS HE2 . 18990 1 903 . 1 1 93 93 LYS HE3 H 1 1.9850 0.0000 . 2 . . . A 434 LYS HE3 . 18990 1 904 . 1 1 93 93 LYS C C 13 173.5890 0.0000 . 1 . . . A 434 LYS C . 18990 1 905 . 1 1 93 93 LYS CA C 13 54.3750 0.0000 . 1 . . . A 434 LYS CA . 18990 1 906 . 1 1 93 93 LYS CB C 13 36.9250 0.0000 . 1 . . . A 434 LYS CB . 18990 1 907 . 1 1 93 93 LYS CG C 13 26.6100 0.0000 . 1 . . . A 434 LYS CG . 18990 1 908 . 1 1 93 93 LYS CD C 13 29.5240 0.0000 . 1 . . . A 434 LYS CD . 18990 1 909 . 1 1 93 93 LYS CE C 13 42.1400 0.0000 . 1 . . . A 434 LYS CE . 18990 1 910 . 1 1 93 93 LYS N N 15 122.4920 0.0000 . 1 . . . A 434 LYS N . 18990 1 911 . 1 1 94 94 PRO HA H 1 4.2670 0.0000 . 1 . . . A 435 PRO HA . 18990 1 912 . 1 1 94 94 PRO HB2 H 1 1.8260 0.0000 . 2 . . . A 435 PRO HB2 . 18990 1 913 . 1 1 94 94 PRO HB3 H 1 1.3200 0.0000 . 2 . . . A 435 PRO HB3 . 18990 1 914 . 1 1 94 94 PRO HG2 H 1 1.9370 0.0000 . 2 . . . A 435 PRO HG2 . 18990 1 915 . 1 1 94 94 PRO HG3 H 1 1.8310 0.0000 . 2 . . . A 435 PRO HG3 . 18990 1 916 . 1 1 94 94 PRO HD2 H 1 3.6990 0.0000 . 2 . . . A 435 PRO HD2 . 18990 1 917 . 1 1 94 94 PRO HD3 H 1 3.4080 0.0000 . 2 . . . A 435 PRO HD3 . 18990 1 918 . 1 1 94 94 PRO C C 13 175.2380 0.0000 . 1 . . . A 435 PRO C . 18990 1 919 . 1 1 94 94 PRO CA C 13 60.9230 0.0000 . 1 . . . A 435 PRO CA . 18990 1 920 . 1 1 94 94 PRO CB C 13 31.0860 0.0000 . 1 . . . A 435 PRO CB . 18990 1 921 . 1 1 94 94 PRO CG C 13 26.8910 0.0000 . 1 . . . A 435 PRO CG . 18990 1 922 . 1 1 94 94 PRO CD C 13 50.0630 0.0000 . 1 . . . A 435 PRO CD . 18990 1 923 . 1 1 95 95 CYS H H 1 7.7680 0.0000 . 1 . . . A 436 CYS H . 18990 1 924 . 1 1 95 95 CYS HA H 1 3.4300 0.0000 . 1 . . . A 436 CYS HA . 18990 1 925 . 1 1 95 95 CYS HB2 H 1 3.0910 0.0000 . 2 . . . A 436 CYS HB2 . 18990 1 926 . 1 1 95 95 CYS C C 13 176.7700 0.0000 . 1 . . . A 436 CYS C . 18990 1 927 . 1 1 95 95 CYS CA C 13 57.0160 0.0000 . 1 . . . A 436 CYS CA . 18990 1 928 . 1 1 95 95 CYS CB C 13 31.6980 0.0000 . 1 . . . A 436 CYS CB . 18990 1 929 . 1 1 95 95 CYS N N 15 125.4220 0.0000 . 1 . . . A 436 CYS N . 18990 1 930 . 1 1 96 96 PRO HA H 1 3.8580 0.0000 . 1 . . . A 437 PRO HA . 18990 1 931 . 1 1 96 96 PRO HB2 H 1 2.2070 0.0000 . 2 . . . A 437 PRO HB2 . 18990 1 932 . 1 1 96 96 PRO HB3 H 1 1.4950 0.0000 . 2 . . . A 437 PRO HB3 . 18990 1 933 . 1 1 96 96 PRO HG2 H 1 1.4270 0.0000 . 2 . . . A 437 PRO HG2 . 18990 1 934 . 1 1 96 96 PRO HG3 H 1 1.2910 0.0000 . 2 . . . A 437 PRO HG3 . 18990 1 935 . 1 1 96 96 PRO HD2 H 1 2.0780 0.0000 . 2 . . . A 437 PRO HD2 . 18990 1 936 . 1 1 96 96 PRO HD3 H 1 1.7300 0.0000 . 2 . . . A 437 PRO HD3 . 18990 1 937 . 1 1 96 96 PRO C C 13 173.6080 0.0000 . 1 . . . A 437 PRO C . 18990 1 938 . 1 1 96 96 PRO CA C 13 64.2130 0.0000 . 1 . . . A 437 PRO CA . 18990 1 939 . 1 1 96 96 PRO CB C 13 32.4490 0.0000 . 1 . . . A 437 PRO CB . 18990 1 940 . 1 1 96 96 PRO CG C 13 27.2880 0.0000 . 1 . . . A 437 PRO CG . 18990 1 941 . 1 1 96 96 PRO CD C 13 49.2170 0.0000 . 1 . . . A 437 PRO CD . 18990 1 942 . 1 1 97 97 LYS H H 1 8.3900 0.0000 . 1 . . . A 438 LYS H . 18990 1 943 . 1 1 97 97 LYS HA H 1 3.9700 0.0000 . 1 . . . A 438 LYS HA . 18990 1 944 . 1 1 97 97 LYS HB2 H 1 1.4310 0.0000 . 2 . . . A 438 LYS HB2 . 18990 1 945 . 1 1 97 97 LYS HB3 H 1 0.3490 0.0000 . 2 . . . A 438 LYS HB3 . 18990 1 946 . 1 1 97 97 LYS HG2 H 1 0.8470 0.0000 . 2 . . . A 438 LYS HG2 . 18990 1 947 . 1 1 97 97 LYS HG3 H 1 0.7900 0.0000 . 2 . . . A 438 LYS HG3 . 18990 1 948 . 1 1 97 97 LYS HD2 H 1 1.6340 0.0000 . 2 . . . A 438 LYS HD2 . 18990 1 949 . 1 1 97 97 LYS HD3 H 1 1.3260 0.0000 . 2 . . . A 438 LYS HD3 . 18990 1 950 . 1 1 97 97 LYS HE2 H 1 2.7790 0.0000 . 2 . . . A 438 LYS HE2 . 18990 1 951 . 1 1 97 97 LYS C C 13 176.8870 0.0000 . 1 . . . A 438 LYS C . 18990 1 952 . 1 1 97 97 LYS CA C 13 57.6870 0.0000 . 1 . . . A 438 LYS CA . 18990 1 953 . 1 1 97 97 LYS CB C 13 33.1240 0.0000 . 1 . . . A 438 LYS CB . 18990 1 954 . 1 1 97 97 LYS CG C 13 24.9480 0.0000 . 1 . . . A 438 LYS CG . 18990 1 955 . 1 1 97 97 LYS CD C 13 28.9690 0.0000 . 1 . . . A 438 LYS CD . 18990 1 956 . 1 1 97 97 LYS CE C 13 42.1960 0.0000 . 1 . . . A 438 LYS CE . 18990 1 957 . 1 1 97 97 LYS N N 15 118.6000 0.0000 . 1 . . . A 438 LYS N . 18990 1 958 . 1 1 98 98 CYS H H 1 8.3570 0.0000 . 1 . . . A 439 CYS H . 18990 1 959 . 1 1 98 98 CYS HA H 1 4.7460 0.0000 . 1 . . . A 439 CYS HA . 18990 1 960 . 1 1 98 98 CYS HB2 H 1 3.1760 0.0000 . 2 . . . A 439 CYS HB2 . 18990 1 961 . 1 1 98 98 CYS HB3 H 1 2.8930 0.0000 . 2 . . . A 439 CYS HB3 . 18990 1 962 . 1 1 98 98 CYS C C 13 176.6500 0.0000 . 1 . . . A 439 CYS C . 18990 1 963 . 1 1 98 98 CYS CA C 13 59.3480 0.0000 . 1 . . . A 439 CYS CA . 18990 1 964 . 1 1 98 98 CYS CB C 13 31.1960 0.0000 . 1 . . . A 439 CYS CB . 18990 1 965 . 1 1 98 98 CYS N N 15 118.9500 0.0000 . 1 . . . A 439 CYS N . 18990 1 966 . 1 1 99 99 ARG H H 1 8.0650 0.0000 . 1 . . . A 440 ARG H . 18990 1 967 . 1 1 99 99 ARG HA H 1 3.9680 0.0000 . 1 . . . A 440 ARG HA . 18990 1 968 . 1 1 99 99 ARG HB2 H 1 2.1600 0.0000 . 2 . . . A 440 ARG HB2 . 18990 1 969 . 1 1 99 99 ARG HB3 H 1 1.9610 0.0000 . 2 . . . A 440 ARG HB3 . 18990 1 970 . 1 1 99 99 ARG HG2 H 1 1.4670 0.0000 . 2 . . . A 440 ARG HG2 . 18990 1 971 . 1 1 99 99 ARG HG3 H 1 1.3350 0.0000 . 2 . . . A 440 ARG HG3 . 18990 1 972 . 1 1 99 99 ARG HD2 H 1 3.0060 0.0000 . 2 . . . A 440 ARG HD2 . 18990 1 973 . 1 1 99 99 ARG HD3 H 1 2.9650 0.0000 . 2 . . . A 440 ARG HD3 . 18990 1 974 . 1 1 99 99 ARG C C 13 175.2530 0.0000 . 1 . . . A 440 ARG C . 18990 1 975 . 1 1 99 99 ARG CA C 13 56.9000 0.0000 . 1 . . . A 440 ARG CA . 18990 1 976 . 1 1 99 99 ARG CB C 13 26.0410 0.0000 . 1 . . . A 440 ARG CB . 18990 1 977 . 1 1 99 99 ARG CG C 13 26.7210 0.0000 . 1 . . . A 440 ARG CG . 18990 1 978 . 1 1 99 99 ARG CD C 13 42.2210 0.0000 . 1 . . . A 440 ARG CD . 18990 1 979 . 1 1 99 99 ARG N N 15 117.2000 0.0000 . 1 . . . A 440 ARG N . 18990 1 980 . 1 1 100 100 THR H H 1 8.6430 0.0000 . 1 . . . A 441 THR H . 18990 1 981 . 1 1 100 100 THR HA H 1 4.3710 0.0000 . 1 . . . A 441 THR HA . 18990 1 982 . 1 1 100 100 THR HB H 1 4.0240 0.0000 . 1 . . . A 441 THR HB . 18990 1 983 . 1 1 100 100 THR HG21 H 1 1.2760 0.0000 . 1 . . . A 441 THR HG21 . 18990 1 984 . 1 1 100 100 THR HG22 H 1 1.2760 0.0000 . 1 . . . A 441 THR HG22 . 18990 1 985 . 1 1 100 100 THR HG23 H 1 1.2760 0.0000 . 1 . . . A 441 THR HG23 . 18990 1 986 . 1 1 100 100 THR C C 13 173.7020 0.0000 . 1 . . . A 441 THR C . 18990 1 987 . 1 1 100 100 THR CA C 13 63.1940 0.0000 . 1 . . . A 441 THR CA . 18990 1 988 . 1 1 100 100 THR CB C 13 68.9330 0.0000 . 1 . . . A 441 THR CB . 18990 1 989 . 1 1 100 100 THR CG2 C 13 21.0230 0.0000 . 1 . . . A 441 THR CG2 . 18990 1 990 . 1 1 100 100 THR N N 15 122.4000 0.0000 . 1 . . . A 441 THR N . 18990 1 991 . 1 1 101 101 PRO HA H 1 4.1470 0.0000 . 1 . . . A 442 PRO HA . 18990 1 992 . 1 1 101 101 PRO HB2 H 1 2.2010 0.0000 . 2 . . . A 442 PRO HB2 . 18990 1 993 . 1 1 101 101 PRO HB3 H 1 1.9410 0.0000 . 2 . . . A 442 PRO HB3 . 18990 1 994 . 1 1 101 101 PRO HG2 H 1 2.1990 0.0000 . 2 . . . A 442 PRO HG2 . 18990 1 995 . 1 1 101 101 PRO HG3 H 1 1.9410 0.0000 . 2 . . . A 442 PRO HG3 . 18990 1 996 . 1 1 101 101 PRO HD2 H 1 4.2200 0.0000 . 2 . . . A 442 PRO HD2 . 18990 1 997 . 1 1 101 101 PRO HD3 H 1 3.7780 0.0000 . 2 . . . A 442 PRO HD3 . 18990 1 998 . 1 1 101 101 PRO C C 13 176.2150 0.0000 . 1 . . . A 442 PRO C . 18990 1 999 . 1 1 101 101 PRO CA C 13 64.1970 0.0000 . 1 . . . A 442 PRO CA . 18990 1 1000 . 1 1 101 101 PRO CB C 13 32.0440 0.0000 . 1 . . . A 442 PRO CB . 18990 1 1001 . 1 1 101 101 PRO CG C 13 27.9010 0.0000 . 1 . . . A 442 PRO CG . 18990 1 1002 . 1 1 101 101 PRO CD C 13 51.9960 0.0000 . 1 . . . A 442 PRO CD . 18990 1 1003 . 1 1 102 102 THR H H 1 9.1160 0.0000 . 1 . . . A 443 THR H . 18990 1 1004 . 1 1 102 102 THR HA H 1 4.6650 0.0000 . 1 . . . A 443 THR HA . 18990 1 1005 . 1 1 102 102 THR HB H 1 4.6930 0.0000 . 1 . . . A 443 THR HB . 18990 1 1006 . 1 1 102 102 THR HG21 H 1 1.5500 0.0000 . 1 . . . A 443 THR HG21 . 18990 1 1007 . 1 1 102 102 THR HG22 H 1 1.5500 0.0000 . 1 . . . A 443 THR HG22 . 18990 1 1008 . 1 1 102 102 THR HG23 H 1 1.5500 0.0000 . 1 . . . A 443 THR HG23 . 18990 1 1009 . 1 1 102 102 THR C C 13 172.1330 0.0000 . 1 . . . A 443 THR C . 18990 1 1010 . 1 1 102 102 THR CA C 13 62.5660 0.0000 . 1 . . . A 443 THR CA . 18990 1 1011 . 1 1 102 102 THR CB C 13 71.5620 0.0000 . 1 . . . A 443 THR CB . 18990 1 1012 . 1 1 102 102 THR CG2 C 13 21.1930 0.0000 . 1 . . . A 443 THR CG2 . 18990 1 1013 . 1 1 102 102 THR N N 15 122.9320 0.0000 . 1 . . . A 443 THR N . 18990 1 1014 . 1 1 103 103 GLU H H 1 8.7200 0.0000 . 1 . . . A 444 GLU H . 18990 1 1015 . 1 1 103 103 GLU HA H 1 4.9420 0.0000 . 1 . . . A 444 GLU HA . 18990 1 1016 . 1 1 103 103 GLU HB2 H 1 1.9880 0.0000 . 2 . . . A 444 GLU HB2 . 18990 1 1017 . 1 1 103 103 GLU HB3 H 1 1.8770 0.0000 . 2 . . . A 444 GLU HB3 . 18990 1 1018 . 1 1 103 103 GLU HG2 H 1 2.2620 0.0000 . 2 . . . A 444 GLU HG2 . 18990 1 1019 . 1 1 103 103 GLU HG3 H 1 2.6360 0.0000 . 2 . . . A 444 GLU HG3 . 18990 1 1020 . 1 1 103 103 GLU C C 13 175.2920 0.0000 . 1 . . . A 444 GLU C . 18990 1 1021 . 1 1 103 103 GLU CA C 13 55.0490 0.0000 . 1 . . . A 444 GLU CA . 18990 1 1022 . 1 1 103 103 GLU CB C 13 31.8610 0.0000 . 1 . . . A 444 GLU CB . 18990 1 1023 . 1 1 103 103 GLU CG C 13 36.9200 0.0000 . 1 . . . A 444 GLU CG . 18990 1 1024 . 1 1 103 103 GLU N N 15 126.3900 0.0000 . 1 . . . A 444 GLU N . 18990 1 1025 . 1 1 104 104 ARG H H 1 8.1570 0.0000 . 1 . . . A 445 ARG H . 18990 1 1026 . 1 1 104 104 ARG HA H 1 3.7110 0.0000 . 1 . . . A 445 ARG HA . 18990 1 1027 . 1 1 104 104 ARG HB2 H 1 0.8680 0.0000 . 2 . . . A 445 ARG HB2 . 18990 1 1028 . 1 1 104 104 ARG HB3 H 1 0.1830 0.0000 . 2 . . . A 445 ARG HB3 . 18990 1 1029 . 1 1 104 104 ARG HG2 H 1 0.7690 0.0000 . 2 . . . A 445 ARG HG2 . 18990 1 1030 . 1 1 104 104 ARG HG3 H 1 0.6000 0.0000 . 2 . . . A 445 ARG HG3 . 18990 1 1031 . 1 1 104 104 ARG HD2 H 1 1.6330 0.0000 . 2 . . . A 445 ARG HD2 . 18990 1 1032 . 1 1 104 104 ARG HD3 H 1 1.6330 0.0000 . 2 . . . A 445 ARG HD3 . 18990 1 1033 . 1 1 104 104 ARG C C 13 175.2890 0.0000 . 1 . . . A 445 ARG C . 18990 1 1034 . 1 1 104 104 ARG CA C 13 55.8560 0.0000 . 1 . . . A 445 ARG CA . 18990 1 1035 . 1 1 104 104 ARG CB C 13 30.6750 0.0000 . 1 . . . A 445 ARG CB . 18990 1 1036 . 1 1 104 104 ARG CG C 13 26.6280 0.0000 . 1 . . . A 445 ARG CG . 18990 1 1037 . 1 1 104 104 ARG CD C 13 43.2350 0.0000 . 1 . . . A 445 ARG CD . 18990 1 1038 . 1 1 104 104 ARG N N 15 123.5050 0.0000 . 1 . . . A 445 ARG N . 18990 1 1039 . 1 1 105 105 ASP H H 1 8.4760 0.0000 . 1 . . . A 446 ASP H . 18990 1 1040 . 1 1 105 105 ASP HA H 1 4.6410 0.0000 . 1 . . . A 446 ASP HA . 18990 1 1041 . 1 1 105 105 ASP HB2 H 1 2.6330 0.0000 . 2 . . . A 446 ASP HB2 . 18990 1 1042 . 1 1 105 105 ASP HB3 H 1 2.4660 0.0000 . 2 . . . A 446 ASP HB3 . 18990 1 1043 . 1 1 105 105 ASP C C 13 176.0200 0.0000 . 1 . . . A 446 ASP C . 18990 1 1044 . 1 1 105 105 ASP CA C 13 52.9520 0.0000 . 1 . . . A 446 ASP CA . 18990 1 1045 . 1 1 105 105 ASP CB C 13 41.4000 0.0000 . 1 . . . A 446 ASP CB . 18990 1 1046 . 1 1 105 105 ASP N N 15 126.8000 0.0000 . 1 . . . A 446 ASP N . 18990 1 1047 . 1 1 106 106 GLY H H 1 8.0560 0.0000 . 1 . . . A 447 GLY H . 18990 1 1048 . 1 1 106 106 GLY HA2 H 1 3.8530 0.0000 . 2 . . . A 447 GLY HA2 . 18990 1 1049 . 1 1 106 106 GLY HA3 H 1 3.7380 0.0000 . 2 . . . A 447 GLY HA3 . 18990 1 1050 . 1 1 106 106 GLY C C 13 174.0730 0.0000 . 1 . . . A 447 GLY C . 18990 1 1051 . 1 1 106 106 GLY CA C 13 45.8320 0.0000 . 1 . . . A 447 GLY CA . 18990 1 1052 . 1 1 106 106 GLY N N 15 111.2620 0.0000 . 1 . . . A 447 GLY N . 18990 1 1053 . 1 1 107 107 GLY H H 1 8.3800 0.0000 . 1 . . . A 448 GLY H . 18990 1 1054 . 1 1 107 107 GLY HA2 H 1 3.9400 0.0000 . 2 . . . A 448 GLY HA2 . 18990 1 1055 . 1 1 107 107 GLY HA3 H 1 3.6570 0.0000 . 2 . . . A 448 GLY HA3 . 18990 1 1056 . 1 1 107 107 GLY C C 13 174.0200 0.0000 . 1 . . . A 448 GLY C . 18990 1 1057 . 1 1 107 107 GLY CA C 13 45.2670 0.0000 . 1 . . . A 448 GLY CA . 18990 1 1058 . 1 1 107 107 GLY N N 15 108.6550 0.0000 . 1 . . . A 448 GLY N . 18990 1 1059 . 1 1 108 108 CYS H H 1 7.8320 0.0000 . 1 . . . A 449 CYS H . 18990 1 1060 . 1 1 108 108 CYS HA H 1 3.9970 0.0000 . 1 . . . A 449 CYS HA . 18990 1 1061 . 1 1 108 108 CYS HB2 H 1 2.8220 0.0000 . 2 . . . A 449 CYS HB2 . 18990 1 1062 . 1 1 108 108 CYS HB3 H 1 2.6920 0.0000 . 2 . . . A 449 CYS HB3 . 18990 1 1063 . 1 1 108 108 CYS C C 13 174.8550 0.0000 . 1 . . . A 449 CYS C . 18990 1 1064 . 1 1 108 108 CYS CA C 13 59.2910 0.0000 . 1 . . . A 449 CYS CA . 18990 1 1065 . 1 1 108 108 CYS CB C 13 28.0000 0.0000 . 1 . . . A 449 CYS CB . 18990 1 1066 . 1 1 108 108 CYS N N 15 120.6280 0.0000 . 1 . . . A 449 CYS N . 18990 1 1067 . 1 1 109 109 MET H H 1 8.9160 0.0000 . 1 . . . A 450 MET H . 18990 1 1068 . 1 1 109 109 MET HA H 1 4.5510 0.0000 . 1 . . . A 450 MET HA . 18990 1 1069 . 1 1 109 109 MET HB2 H 1 3.0380 0.0000 . 2 . . . A 450 MET HB2 . 18990 1 1070 . 1 1 109 109 MET HB3 H 1 2.7100 0.0000 . 2 . . . A 450 MET HB3 . 18990 1 1071 . 1 1 109 109 MET HG2 H 1 2.8370 0.0000 . 2 . . . A 450 MET HG2 . 18990 1 1072 . 1 1 109 109 MET HG3 H 1 2.7000 0.0000 . 2 . . . A 450 MET HG3 . 18990 1 1073 . 1 1 109 109 MET HE1 H 1 1.9480 0.0000 . 1 . . . A 450 MET HE1 . 18990 1 1074 . 1 1 109 109 MET HE2 H 1 1.9480 0.0000 . 1 . . . A 450 MET HE2 . 18990 1 1075 . 1 1 109 109 MET HE3 H 1 1.9480 0.0000 . 1 . . . A 450 MET HE3 . 18990 1 1076 . 1 1 109 109 MET C C 13 174.6580 0.0000 . 1 . . . A 450 MET C . 18990 1 1077 . 1 1 109 109 MET CA C 13 54.9700 0.0000 . 1 . . . A 450 MET CA . 18990 1 1078 . 1 1 109 109 MET CB C 13 34.1000 0.0000 . 1 . . . A 450 MET CB . 18990 1 1079 . 1 1 109 109 MET CG C 13 33.6120 0.0000 . 1 . . . A 450 MET CG . 18990 1 1080 . 1 1 109 109 MET CE C 13 18.2190 0.0000 . 1 . . . A 450 MET CE . 18990 1 1081 . 1 1 109 109 MET N N 15 123.9470 0.0000 . 1 . . . A 450 MET N . 18990 1 1082 . 1 1 110 110 HIS H H 1 7.5570 0.0000 . 1 . . . A 451 HIS H . 18990 1 1083 . 1 1 110 110 HIS HA H 1 3.6790 0.0000 . 1 . . . A 451 HIS HA . 18990 1 1084 . 1 1 110 110 HIS HB2 H 1 2.6090 0.0000 . 2 . . . A 451 HIS HB2 . 18990 1 1085 . 1 1 110 110 HIS HB3 H 1 1.1120 0.0000 . 2 . . . A 451 HIS HB3 . 18990 1 1086 . 1 1 110 110 HIS HD2 H 1 5.7510 0.0000 . 1 . . . A 451 HIS HD2 . 18990 1 1087 . 1 1 110 110 HIS C C 13 172.4430 0.0000 . 1 . . . A 451 HIS C . 18990 1 1088 . 1 1 110 110 HIS CA C 13 53.8120 0.0000 . 1 . . . A 451 HIS CA . 18990 1 1089 . 1 1 110 110 HIS CB C 13 28.9000 0.0000 . 1 . . . A 451 HIS CB . 18990 1 1090 . 1 1 110 110 HIS CD2 C 13 113.6740 0.0000 . 1 . . . A 451 HIS CD2 . 18990 1 1091 . 1 1 110 110 HIS N N 15 120.4900 0.0000 . 1 . . . A 451 HIS N . 18990 1 1092 . 1 1 111 111 MET H H 1 9.0870 0.0000 . 1 . . . A 452 MET H . 18990 1 1093 . 1 1 111 111 MET HA H 1 4.3200 0.0000 . 1 . . . A 452 MET HA . 18990 1 1094 . 1 1 111 111 MET HB2 H 1 0.8910 0.0000 . 2 . . . A 452 MET HB2 . 18990 1 1095 . 1 1 111 111 MET HB3 H 1 0.1140 0.0000 . 2 . . . A 452 MET HB3 . 18990 1 1096 . 1 1 111 111 MET HG2 H 1 1.9970 0.0000 . 2 . . . A 452 MET HG2 . 18990 1 1097 . 1 1 111 111 MET HG3 H 1 0.6410 0.0000 . 2 . . . A 452 MET HG3 . 18990 1 1098 . 1 1 111 111 MET HE1 H 1 1.6700 0.0000 . 1 . . . A 452 MET HE1 . 18990 1 1099 . 1 1 111 111 MET HE2 H 1 1.6700 0.0000 . 1 . . . A 452 MET HE2 . 18990 1 1100 . 1 1 111 111 MET HE3 H 1 1.6700 0.0000 . 1 . . . A 452 MET HE3 . 18990 1 1101 . 1 1 111 111 MET C C 13 175.4790 0.0000 . 1 . . . A 452 MET C . 18990 1 1102 . 1 1 111 111 MET CA C 13 52.5890 0.0000 . 1 . . . A 452 MET CA . 18990 1 1103 . 1 1 111 111 MET CB C 13 28.0740 0.0000 . 1 . . . A 452 MET CB . 18990 1 1104 . 1 1 111 111 MET CG C 13 30.5770 0.0000 . 1 . . . A 452 MET CG . 18990 1 1105 . 1 1 111 111 MET CE C 13 16.0790 0.0000 . 1 . . . A 452 MET CE . 18990 1 1106 . 1 1 111 111 MET N N 15 128.8000 0.0000 . 1 . . . A 452 MET N . 18990 1 1107 . 1 1 112 112 VAL H H 1 8.0160 0.0000 . 1 . . . A 453 VAL H . 18990 1 1108 . 1 1 112 112 VAL HA H 1 4.7940 0.0000 . 1 . . . A 453 VAL HA . 18990 1 1109 . 1 1 112 112 VAL HB H 1 1.7520 0.0000 . 1 . . . A 453 VAL HB . 18990 1 1110 . 1 1 112 112 VAL HG11 H 1 0.7180 0.0000 . 2 . . . A 453 VAL HG11 . 18990 1 1111 . 1 1 112 112 VAL HG12 H 1 0.7180 0.0000 . 2 . . . A 453 VAL HG12 . 18990 1 1112 . 1 1 112 112 VAL HG13 H 1 0.7180 0.0000 . 2 . . . A 453 VAL HG13 . 18990 1 1113 . 1 1 112 112 VAL HG21 H 1 0.3820 0.0000 . 2 . . . A 453 VAL HG21 . 18990 1 1114 . 1 1 112 112 VAL HG22 H 1 0.3820 0.0000 . 2 . . . A 453 VAL HG22 . 18990 1 1115 . 1 1 112 112 VAL HG23 H 1 0.3820 0.0000 . 2 . . . A 453 VAL HG23 . 18990 1 1116 . 1 1 112 112 VAL C C 13 175.4760 0.0000 . 1 . . . A 453 VAL C . 18990 1 1117 . 1 1 112 112 VAL CA C 13 61.3800 0.0000 . 1 . . . A 453 VAL CA . 18990 1 1118 . 1 1 112 112 VAL CB C 13 33.0890 0.0000 . 1 . . . A 453 VAL CB . 18990 1 1119 . 1 1 112 112 VAL CG1 C 13 20.6120 0.0000 . 2 . . . A 453 VAL CG1 . 18990 1 1120 . 1 1 112 112 VAL CG2 C 13 20.1650 0.0000 . 2 . . . A 453 VAL CG2 . 18990 1 1121 . 1 1 112 112 VAL N N 15 122.2000 0.0000 . 1 . . . A 453 VAL N . 18990 1 1122 . 1 1 113 113 CYS H H 1 8.9890 0.0000 . 1 . . . A 454 CYS H . 18990 1 1123 . 1 1 113 113 CYS HA H 1 4.5950 0.0000 . 1 . . . A 454 CYS HA . 18990 1 1124 . 1 1 113 113 CYS HB2 H 1 3.4880 0.0000 . 2 . . . A 454 CYS HB2 . 18990 1 1125 . 1 1 113 113 CYS HB3 H 1 3.3420 0.0000 . 2 . . . A 454 CYS HB3 . 18990 1 1126 . 1 1 113 113 CYS C C 13 177.8330 0.0000 . 1 . . . A 454 CYS C . 18990 1 1127 . 1 1 113 113 CYS CA C 13 61.5710 0.0000 . 1 . . . A 454 CYS CA . 18990 1 1128 . 1 1 113 113 CYS CB C 13 32.0450 0.0000 . 1 . . . A 454 CYS CB . 18990 1 1129 . 1 1 113 113 CYS N N 15 130.3530 0.0000 . 1 . . . A 454 CYS N . 18990 1 1130 . 1 1 114 114 THR H H 1 8.5330 0.0000 . 1 . . . A 455 THR H . 18990 1 1131 . 1 1 114 114 THR HA H 1 4.3930 0.0000 . 1 . . . A 455 THR HA . 18990 1 1132 . 1 1 114 114 THR HB H 1 4.6180 0.0000 . 1 . . . A 455 THR HB . 18990 1 1133 . 1 1 114 114 THR HG21 H 1 1.3260 0.0000 . 1 . . . A 455 THR HG21 . 18990 1 1134 . 1 1 114 114 THR HG22 H 1 1.3260 0.0000 . 1 . . . A 455 THR HG22 . 18990 1 1135 . 1 1 114 114 THR HG23 H 1 1.3260 0.0000 . 1 . . . A 455 THR HG23 . 18990 1 1136 . 1 1 114 114 THR C C 13 175.2640 0.0000 . 1 . . . A 455 THR C . 18990 1 1137 . 1 1 114 114 THR CA C 13 61.6440 0.0000 . 1 . . . A 455 THR CA . 18990 1 1138 . 1 1 114 114 THR CB C 13 69.4000 0.0000 . 1 . . . A 455 THR CB . 18990 1 1139 . 1 1 114 114 THR CG2 C 13 21.6300 0.0000 . 1 . . . A 455 THR CG2 . 18990 1 1140 . 1 1 114 114 THR N N 15 119.0000 0.0000 . 1 . . . A 455 THR N . 18990 1 1141 . 1 1 115 115 ARG H H 1 9.0360 0.0000 . 1 . . . A 456 ARG H . 18990 1 1142 . 1 1 115 115 ARG HA H 1 4.2250 0.0000 . 1 . . . A 456 ARG HA . 18990 1 1143 . 1 1 115 115 ARG HB2 H 1 2.1340 0.0000 . 2 . . . A 456 ARG HB2 . 18990 1 1144 . 1 1 115 115 ARG HB3 H 1 1.8390 0.0000 . 2 . . . A 456 ARG HB3 . 18990 1 1145 . 1 1 115 115 ARG HG2 H 1 1.7510 0.0000 . 2 . . . A 456 ARG HG2 . 18990 1 1146 . 1 1 115 115 ARG HD2 H 1 3.3040 0.0000 . 2 . . . A 456 ARG HD2 . 18990 1 1147 . 1 1 115 115 ARG C C 13 177.7820 0.0000 . 1 . . . A 456 ARG C . 18990 1 1148 . 1 1 115 115 ARG CA C 13 56.9500 0.0000 . 1 . . . A 456 ARG CA . 18990 1 1149 . 1 1 115 115 ARG CB C 13 30.0500 0.0000 . 1 . . . A 456 ARG CB . 18990 1 1150 . 1 1 115 115 ARG CG C 13 26.8810 0.0000 . 1 . . . A 456 ARG CG . 18990 1 1151 . 1 1 115 115 ARG CD C 13 43.1980 0.0000 . 1 . . . A 456 ARG CD . 18990 1 1152 . 1 1 115 115 ARG N N 15 128.9000 0.0000 . 1 . . . A 456 ARG N . 18990 1 1153 . 1 1 116 116 ALA H H 1 9.0420 0.0000 . 1 . . . A 457 ALA H . 18990 1 1154 . 1 1 116 116 ALA HA H 1 4.1460 0.0000 . 1 . . . A 457 ALA HA . 18990 1 1155 . 1 1 116 116 ALA HB1 H 1 1.4080 0.0000 . 1 . . . A 457 ALA HB1 . 18990 1 1156 . 1 1 116 116 ALA HB2 H 1 1.4080 0.0000 . 1 . . . A 457 ALA HB2 . 18990 1 1157 . 1 1 116 116 ALA HB3 H 1 1.4080 0.0000 . 1 . . . A 457 ALA HB3 . 18990 1 1158 . 1 1 116 116 ALA C C 13 178.7570 0.0000 . 1 . . . A 457 ALA C . 18990 1 1159 . 1 1 116 116 ALA CA C 13 53.9290 0.0000 . 1 . . . A 457 ALA CA . 18990 1 1160 . 1 1 116 116 ALA CB C 13 17.7100 0.0000 . 1 . . . A 457 ALA CB . 18990 1 1161 . 1 1 116 116 ALA N N 15 133.1520 0.0000 . 1 . . . A 457 ALA N . 18990 1 1162 . 1 1 117 117 GLY H H 1 8.8300 0.0000 . 1 . . . A 458 GLY H . 18990 1 1163 . 1 1 117 117 GLY HA2 H 1 4.1430 0.0000 . 2 . . . A 458 GLY HA2 . 18990 1 1164 . 1 1 117 117 GLY HA3 H 1 3.7330 0.0000 . 2 . . . A 458 GLY HA3 . 18990 1 1165 . 1 1 117 117 GLY C C 13 173.5580 0.0000 . 1 . . . A 458 GLY C . 18990 1 1166 . 1 1 117 117 GLY CA C 13 45.4360 0.0000 . 1 . . . A 458 GLY CA . 18990 1 1167 . 1 1 117 117 GLY N N 15 111.2000 0.0000 . 1 . . . A 458 GLY N . 18990 1 1168 . 1 1 118 118 CYS H H 1 8.0420 0.0000 . 1 . . . A 459 CYS H . 18990 1 1169 . 1 1 118 118 CYS HA H 1 4.6220 0.0000 . 1 . . . A 459 CYS HA . 18990 1 1170 . 1 1 118 118 CYS HB2 H 1 3.1740 0.0000 . 2 . . . A 459 CYS HB2 . 18990 1 1171 . 1 1 118 118 CYS HB3 H 1 2.4970 0.0000 . 2 . . . A 459 CYS HB3 . 18990 1 1172 . 1 1 118 118 CYS C C 13 176.5910 0.0000 . 1 . . . A 459 CYS C . 18990 1 1173 . 1 1 118 118 CYS CA C 13 60.4990 0.0000 . 1 . . . A 459 CYS CA . 18990 1 1174 . 1 1 118 118 CYS CB C 13 30.1740 0.0000 . 1 . . . A 459 CYS CB . 18990 1 1175 . 1 1 118 118 CYS N N 15 123.0400 0.0000 . 1 . . . A 459 CYS N . 18990 1 1176 . 1 1 119 119 GLY H H 1 7.7050 0.0000 . 1 . . . A 460 GLY H . 18990 1 1177 . 1 1 119 119 GLY HA2 H 1 4.2380 0.0000 . 2 . . . A 460 GLY HA2 . 18990 1 1178 . 1 1 119 119 GLY HA3 H 1 4.0840 0.0000 . 2 . . . A 460 GLY HA3 . 18990 1 1179 . 1 1 119 119 GLY C C 13 173.7160 0.0000 . 1 . . . A 460 GLY C . 18990 1 1180 . 1 1 119 119 GLY CA C 13 46.0080 0.0000 . 1 . . . A 460 GLY CA . 18990 1 1181 . 1 1 119 119 GLY N N 15 104.5000 0.0000 . 1 . . . A 460 GLY N . 18990 1 1182 . 1 1 120 120 PHE H H 1 8.9470 0.0000 . 1 . . . A 461 PHE H . 18990 1 1183 . 1 1 120 120 PHE HA H 1 4.5800 0.0000 . 1 . . . A 461 PHE HA . 18990 1 1184 . 1 1 120 120 PHE HB2 H 1 3.3680 0.0000 . 2 . . . A 461 PHE HB2 . 18990 1 1185 . 1 1 120 120 PHE HB3 H 1 3.0510 0.0000 . 2 . . . A 461 PHE HB3 . 18990 1 1186 . 1 1 120 120 PHE HD1 H 1 7.3560 0.0000 . 3 . . . A 461 PHE HD1 . 18990 1 1187 . 1 1 120 120 PHE HE1 H 1 7.1650 0.0000 . 3 . . . A 461 PHE HE1 . 18990 1 1188 . 1 1 120 120 PHE HZ H 1 7.3160 0.0000 . 1 . . . A 461 PHE HZ . 18990 1 1189 . 1 1 120 120 PHE C C 13 174.4470 0.0000 . 1 . . . A 461 PHE C . 18990 1 1190 . 1 1 120 120 PHE CA C 13 59.9460 0.0000 . 1 . . . A 461 PHE CA . 18990 1 1191 . 1 1 120 120 PHE CB C 13 41.3000 0.0000 . 1 . . . A 461 PHE CB . 18990 1 1192 . 1 1 120 120 PHE CD1 C 13 132.1810 0.0000 . 1 . . . A 461 PHE CD1 . 18990 1 1193 . 1 1 120 120 PHE CE1 C 13 131.2350 0.0000 . 1 . . . A 461 PHE CE1 . 18990 1 1194 . 1 1 120 120 PHE CZ C 13 129.0510 0.0000 . 1 . . . A 461 PHE CZ . 18990 1 1195 . 1 1 120 120 PHE N N 15 124.9490 0.0000 . 1 . . . A 461 PHE N . 18990 1 1196 . 1 1 121 121 GLU H H 1 7.7990 0.0000 . 1 . . . A 462 GLU H . 18990 1 1197 . 1 1 121 121 GLU HA H 1 5.7210 0.0000 . 1 . . . A 462 GLU HA . 18990 1 1198 . 1 1 121 121 GLU HB2 H 1 2.1630 0.0000 . 2 . . . A 462 GLU HB2 . 18990 1 1199 . 1 1 121 121 GLU HB3 H 1 1.8890 0.0000 . 2 . . . A 462 GLU HB3 . 18990 1 1200 . 1 1 121 121 GLU HG2 H 1 2.6120 0.0000 . 2 . . . A 462 GLU HG2 . 18990 1 1201 . 1 1 121 121 GLU HG3 H 1 2.2500 0.0000 . 2 . . . A 462 GLU HG3 . 18990 1 1202 . 1 1 121 121 GLU C C 13 176.0670 0.0000 . 1 . . . A 462 GLU C . 18990 1 1203 . 1 1 121 121 GLU CA C 13 54.6240 0.0000 . 1 . . . A 462 GLU CA . 18990 1 1204 . 1 1 121 121 GLU CB C 13 31.2550 0.0000 . 1 . . . A 462 GLU CB . 18990 1 1205 . 1 1 121 121 GLU CG C 13 37.0630 0.0000 . 1 . . . A 462 GLU CG . 18990 1 1206 . 1 1 121 121 GLU N N 15 125.2720 0.0000 . 1 . . . A 462 GLU N . 18990 1 1207 . 1 1 122 122 TRP H H 1 9.3000 0.0000 . 1 . . . A 463 TRP H . 18990 1 1208 . 1 1 122 122 TRP HA H 1 5.5060 0.0000 . 1 . . . A 463 TRP HA . 18990 1 1209 . 1 1 122 122 TRP HB2 H 1 3.0990 0.0000 . 2 . . . A 463 TRP HB2 . 18990 1 1210 . 1 1 122 122 TRP HB3 H 1 3.0570 0.0000 . 2 . . . A 463 TRP HB3 . 18990 1 1211 . 1 1 122 122 TRP HD1 H 1 7.2320 0.0000 . 1 . . . A 463 TRP HD1 . 18990 1 1212 . 1 1 122 122 TRP HE1 H 1 10.0360 0.0000 . 1 . . . A 463 TRP HE1 . 18990 1 1213 . 1 1 122 122 TRP HE3 H 1 7.5320 0.0000 . 1 . . . A 463 TRP HE3 . 18990 1 1214 . 1 1 122 122 TRP HZ2 H 1 7.4900 0.0000 . 1 . . . A 463 TRP HZ2 . 18990 1 1215 . 1 1 122 122 TRP HZ3 H 1 6.7980 0.0000 . 1 . . . A 463 TRP HZ3 . 18990 1 1216 . 1 1 122 122 TRP HH2 H 1 7.0220 0.0000 . 1 . . . A 463 TRP HH2 . 18990 1 1217 . 1 1 122 122 TRP C C 13 172.8440 0.0000 . 1 . . . A 463 TRP C . 18990 1 1218 . 1 1 122 122 TRP CA C 13 53.7710 0.0000 . 1 . . . A 463 TRP CA . 18990 1 1219 . 1 1 122 122 TRP CB C 13 31.7360 0.0000 . 1 . . . A 463 TRP CB . 18990 1 1220 . 1 1 122 122 TRP CD1 C 13 124.7070 0.0000 . 1 . . . A 463 TRP CD1 . 18990 1 1221 . 1 1 122 122 TRP CE3 C 13 121.0500 0.0000 . 1 . . . A 463 TRP CE3 . 18990 1 1222 . 1 1 122 122 TRP CZ2 C 13 113.4410 0.0000 . 1 . . . A 463 TRP CZ2 . 18990 1 1223 . 1 1 122 122 TRP CZ3 C 13 120.0910 0.0000 . 1 . . . A 463 TRP CZ3 . 18990 1 1224 . 1 1 122 122 TRP CH2 C 13 125.2870 0.0000 . 1 . . . A 463 TRP CH2 . 18990 1 1225 . 1 1 122 122 TRP N N 15 121.5240 0.0000 . 1 . . . A 463 TRP N . 18990 1 1226 . 1 1 122 122 TRP NE1 N 15 131.6300 0.0000 . 1 . . . A 463 TRP NE1 . 18990 1 1227 . 1 1 123 123 CYS H H 1 8.7520 0.0000 . 1 . . . A 464 CYS H . 18990 1 1228 . 1 1 123 123 CYS HA H 1 5.4160 0.0000 . 1 . . . A 464 CYS HA . 18990 1 1229 . 1 1 123 123 CYS HB2 H 1 3.5210 0.0000 . 2 . . . A 464 CYS HB2 . 18990 1 1230 . 1 1 123 123 CYS HB3 H 1 3.1700 0.0000 . 2 . . . A 464 CYS HB3 . 18990 1 1231 . 1 1 123 123 CYS C C 13 177.2130 0.0000 . 1 . . . A 464 CYS C . 18990 1 1232 . 1 1 123 123 CYS CA C 13 57.7760 0.0000 . 1 . . . A 464 CYS CA . 18990 1 1233 . 1 1 123 123 CYS CB C 13 32.9300 0.0000 . 1 . . . A 464 CYS CB . 18990 1 1234 . 1 1 123 123 CYS N N 15 120.8680 0.0000 . 1 . . . A 464 CYS N . 18990 1 1235 . 1 1 124 124 TRP H H 1 9.8090 0.0000 . 1 . . . A 465 TRP H . 18990 1 1236 . 1 1 124 124 TRP HA H 1 4.4270 0.0000 . 1 . . . A 465 TRP HA . 18990 1 1237 . 1 1 124 124 TRP HB2 H 1 3.4480 0.0000 . 2 . . . A 465 TRP HB2 . 18990 1 1238 . 1 1 124 124 TRP HB3 H 1 3.4010 0.0000 . 2 . . . A 465 TRP HB3 . 18990 1 1239 . 1 1 124 124 TRP HD1 H 1 6.9920 0.0000 . 1 . . . A 465 TRP HD1 . 18990 1 1240 . 1 1 124 124 TRP HE1 H 1 10.2260 0.0000 . 1 . . . A 465 TRP HE1 . 18990 1 1241 . 1 1 124 124 TRP HE3 H 1 7.3940 0.0000 . 1 . . . A 465 TRP HE3 . 18990 1 1242 . 1 1 124 124 TRP HZ2 H 1 7.5040 0.0000 . 1 . . . A 465 TRP HZ2 . 18990 1 1243 . 1 1 124 124 TRP HZ3 H 1 7.2360 0.0000 . 1 . . . A 465 TRP HZ3 . 18990 1 1244 . 1 1 124 124 TRP HH2 H 1 7.1110 0.0000 . 1 . . . A 465 TRP HH2 . 18990 1 1245 . 1 1 124 124 TRP C C 13 176.0510 0.0000 . 1 . . . A 465 TRP C . 18990 1 1246 . 1 1 124 124 TRP CA C 13 60.7630 0.0000 . 1 . . . A 465 TRP CA . 18990 1 1247 . 1 1 124 124 TRP CB C 13 31.1260 0.0000 . 1 . . . A 465 TRP CB . 18990 1 1248 . 1 1 124 124 TRP CD1 C 13 126.2300 0.0000 . 1 . . . A 465 TRP CD1 . 18990 1 1249 . 1 1 124 124 TRP CE3 C 13 126.2660 0.0000 . 1 . . . A 465 TRP CE3 . 18990 1 1250 . 1 1 124 124 TRP CZ2 C 13 114.5400 0.0000 . 1 . . . A 465 TRP CZ2 . 18990 1 1251 . 1 1 124 124 TRP CZ3 C 13 128.6670 0.0000 . 1 . . . A 465 TRP CZ3 . 18990 1 1252 . 1 1 124 124 TRP CH2 C 13 122.5310 0.0000 . 1 . . . A 465 TRP CH2 . 18990 1 1253 . 1 1 124 124 TRP N N 15 131.2090 0.0000 . 1 . . . A 465 TRP N . 18990 1 1254 . 1 1 124 124 TRP NE1 N 15 128.2170 0.0000 . 1 . . . A 465 TRP NE1 . 18990 1 1255 . 1 1 125 125 VAL H H 1 8.6270 0.0000 . 1 . . . A 466 VAL H . 18990 1 1256 . 1 1 125 125 VAL HA H 1 3.6240 0.0000 . 1 . . . A 466 VAL HA . 18990 1 1257 . 1 1 125 125 VAL HB H 1 1.5580 0.0000 . 1 . . . A 466 VAL HB . 18990 1 1258 . 1 1 125 125 VAL HG11 H 1 1.0370 0.0000 . 2 . . . A 466 VAL HG11 . 18990 1 1259 . 1 1 125 125 VAL HG12 H 1 1.0370 0.0000 . 2 . . . A 466 VAL HG12 . 18990 1 1260 . 1 1 125 125 VAL HG13 H 1 1.0370 0.0000 . 2 . . . A 466 VAL HG13 . 18990 1 1261 . 1 1 125 125 VAL HG21 H 1 0.6770 0.0000 . 2 . . . A 466 VAL HG21 . 18990 1 1262 . 1 1 125 125 VAL HG22 H 1 0.6770 0.0000 . 2 . . . A 466 VAL HG22 . 18990 1 1263 . 1 1 125 125 VAL HG23 H 1 0.6770 0.0000 . 2 . . . A 466 VAL HG23 . 18990 1 1264 . 1 1 125 125 VAL C C 13 178.9430 0.0000 . 1 . . . A 466 VAL C . 18990 1 1265 . 1 1 125 125 VAL CA C 13 65.6020 0.0000 . 1 . . . A 466 VAL CA . 18990 1 1266 . 1 1 125 125 VAL CB C 13 33.1720 0.0000 . 1 . . . A 466 VAL CB . 18990 1 1267 . 1 1 125 125 VAL CG1 C 13 22.5500 0.0000 . 2 . . . A 466 VAL CG1 . 18990 1 1268 . 1 1 125 125 VAL CG2 C 13 21.1590 0.0000 . 2 . . . A 466 VAL CG2 . 18990 1 1269 . 1 1 125 125 VAL N N 15 118.2330 0.0000 . 1 . . . A 466 VAL N . 18990 1 1270 . 1 1 126 126 CYS H H 1 7.8200 0.0000 . 1 . . . A 467 CYS H . 18990 1 1271 . 1 1 126 126 CYS HA H 1 3.4310 0.0000 . 1 . . . A 467 CYS HA . 18990 1 1272 . 1 1 126 126 CYS HB2 H 1 3.0990 0.0000 . 2 . . . A 467 CYS HB2 . 18990 1 1273 . 1 1 126 126 CYS HB3 H 1 2.9400 0.0000 . 2 . . . A 467 CYS HB3 . 18990 1 1274 . 1 1 126 126 CYS CA C 13 56.9990 0.0000 . 1 . . . A 467 CYS CA . 18990 1 1275 . 1 1 126 126 CYS CB C 13 31.8700 0.0000 . 1 . . . A 467 CYS CB . 18990 1 1276 . 1 1 127 127 GLN HA H 1 4.0360 0.0000 . 1 . . . A 468 GLN HA . 18990 1 1277 . 1 1 127 127 GLN HB2 H 1 2.3210 0.0000 . 2 . . . A 468 GLN HB2 . 18990 1 1278 . 1 1 127 127 GLN HG2 H 1 2.2120 0.0000 . 2 . . . A 468 GLN HG2 . 18990 1 1279 . 1 1 127 127 GLN HG3 H 1 2.0520 0.0000 . 2 . . . A 468 GLN HG3 . 18990 1 1280 . 1 1 127 127 GLN HE21 H 1 6.7820 0.0000 . 2 . . . A 468 GLN HE21 . 18990 1 1281 . 1 1 127 127 GLN HE22 H 1 7.6050 0.0000 . 2 . . . A 468 GLN HE22 . 18990 1 1282 . 1 1 127 127 GLN CA C 13 58.0510 0.0000 . 1 . . . A 468 GLN CA . 18990 1 1283 . 1 1 127 127 GLN CB C 13 26.4760 0.0000 . 1 . . . A 468 GLN CB . 18990 1 1284 . 1 1 127 127 GLN CG C 13 36.1530 0.0000 . 1 . . . A 468 GLN CG . 18990 1 1285 . 1 1 127 127 GLN NE2 N 15 111.7290 0.0000 . 1 . . . A 468 GLN NE2 . 18990 1 1286 . 1 1 128 128 THR HA H 1 4.6850 0.0000 . 1 . . . A 469 THR HA . 18990 1 1287 . 1 1 128 128 THR HB H 1 4.4560 0.0000 . 1 . . . A 469 THR HB . 18990 1 1288 . 1 1 128 128 THR HG21 H 1 1.1820 0.0000 . 1 . . . A 469 THR HG21 . 18990 1 1289 . 1 1 128 128 THR HG22 H 1 1.1820 0.0000 . 1 . . . A 469 THR HG22 . 18990 1 1290 . 1 1 128 128 THR HG23 H 1 1.1820 0.0000 . 1 . . . A 469 THR HG23 . 18990 1 1291 . 1 1 128 128 THR C C 13 173.3510 0.0000 . 1 . . . A 469 THR C . 18990 1 1292 . 1 1 128 128 THR CA C 13 59.1760 0.0000 . 1 . . . A 469 THR CA . 18990 1 1293 . 1 1 128 128 THR CB C 13 71.7750 0.0000 . 1 . . . A 469 THR CB . 18990 1 1294 . 1 1 128 128 THR CG2 C 13 21.1150 0.0000 . 1 . . . A 469 THR CG2 . 18990 1 1295 . 1 1 129 129 GLU H H 1 8.9120 0.0000 . 1 . . . A 470 GLU H . 18990 1 1296 . 1 1 129 129 GLU HA H 1 4.2930 0.0000 . 1 . . . A 470 GLU HA . 18990 1 1297 . 1 1 129 129 GLU HB2 H 1 2.2310 0.0000 . 2 . . . A 470 GLU HB2 . 18990 1 1298 . 1 1 129 129 GLU HB3 H 1 2.0800 0.0000 . 2 . . . A 470 GLU HB3 . 18990 1 1299 . 1 1 129 129 GLU HG2 H 1 2.3990 0.0000 . 2 . . . A 470 GLU HG2 . 18990 1 1300 . 1 1 129 129 GLU HG3 H 1 2.3470 0.0000 . 2 . . . A 470 GLU HG3 . 18990 1 1301 . 1 1 129 129 GLU C C 13 175.5390 0.0000 . 1 . . . A 470 GLU C . 18990 1 1302 . 1 1 129 129 GLU CA C 13 57.0150 0.0000 . 1 . . . A 470 GLU CA . 18990 1 1303 . 1 1 129 129 GLU CB C 13 29.9650 0.0000 . 1 . . . A 470 GLU CB . 18990 1 1304 . 1 1 129 129 GLU CG C 13 35.6700 0.0000 . 1 . . . A 470 GLU CG . 18990 1 1305 . 1 1 129 129 GLU N N 15 120.9400 0.0000 . 1 . . . A 470 GLU N . 18990 1 1306 . 1 1 130 130 TRP H H 1 8.3500 0.0000 . 1 . . . A 471 TRP H . 18990 1 1307 . 1 1 130 130 TRP HA H 1 4.2930 0.0000 . 1 . . . A 471 TRP HA . 18990 1 1308 . 1 1 130 130 TRP HB2 H 1 2.7750 0.0000 . 2 . . . A 471 TRP HB2 . 18990 1 1309 . 1 1 130 130 TRP HB3 H 1 2.6460 0.0000 . 2 . . . A 471 TRP HB3 . 18990 1 1310 . 1 1 130 130 TRP HD1 H 1 7.1800 0.0000 . 1 . . . A 471 TRP HD1 . 18990 1 1311 . 1 1 130 130 TRP HE1 H 1 10.2780 0.0000 . 1 . . . A 471 TRP HE1 . 18990 1 1312 . 1 1 130 130 TRP HE3 H 1 7.7390 0.0000 . 1 . . . A 471 TRP HE3 . 18990 1 1313 . 1 1 130 130 TRP HZ2 H 1 7.5330 0.0000 . 1 . . . A 471 TRP HZ2 . 18990 1 1314 . 1 1 130 130 TRP HZ3 H 1 7.2660 0.0000 . 1 . . . A 471 TRP HZ3 . 18990 1 1315 . 1 1 130 130 TRP HH2 H 1 7.2090 0.0000 . 1 . . . A 471 TRP HH2 . 18990 1 1316 . 1 1 130 130 TRP C C 13 175.4080 0.0000 . 1 . . . A 471 TRP C . 18990 1 1317 . 1 1 130 130 TRP CA C 13 58.2200 0.0000 . 1 . . . A 471 TRP CA . 18990 1 1318 . 1 1 130 130 TRP CB C 13 29.5000 0.0000 . 1 . . . A 471 TRP CB . 18990 1 1319 . 1 1 130 130 TRP CD1 C 13 122.0840 0.0000 . 1 . . . A 471 TRP CD1 . 18990 1 1320 . 1 1 130 130 TRP CE3 C 13 121.1690 0.0000 . 1 . . . A 471 TRP CE3 . 18990 1 1321 . 1 1 130 130 TRP CZ2 C 13 114.4520 0.0000 . 1 . . . A 471 TRP CZ2 . 18990 1 1322 . 1 1 130 130 TRP CZ3 C 13 124.8810 0.0000 . 1 . . . A 471 TRP CZ3 . 18990 1 1323 . 1 1 130 130 TRP CH2 C 13 125.9220 0.0000 . 1 . . . A 471 TRP CH2 . 18990 1 1324 . 1 1 130 130 TRP N N 15 126.9980 0.0000 . 1 . . . A 471 TRP N . 18990 1 1325 . 1 1 130 130 TRP NE1 N 15 128.4420 0.0000 . 1 . . . A 471 TRP NE1 . 18990 1 1326 . 1 1 131 131 THR H H 1 8.0690 0.0000 . 1 . . . A 472 THR H . 18990 1 1327 . 1 1 131 131 THR HA H 1 4.4440 0.0000 . 1 . . . A 472 THR HA . 18990 1 1328 . 1 1 131 131 THR HG21 H 1 1.1600 0.0000 . 1 . . . A 472 THR HG21 . 18990 1 1329 . 1 1 131 131 THR HG22 H 1 1.1600 0.0000 . 1 . . . A 472 THR HG22 . 18990 1 1330 . 1 1 131 131 THR HG23 H 1 1.1600 0.0000 . 1 . . . A 472 THR HG23 . 18990 1 1331 . 1 1 131 131 THR CA C 13 58.9300 0.0000 . 1 . . . A 472 THR CA . 18990 1 1332 . 1 1 131 131 THR CG2 C 13 21.2100 0.0000 . 1 . . . A 472 THR CG2 . 18990 1 1333 . 1 1 131 131 THR N N 15 117.4800 0.0000 . 1 . . . A 472 THR N . 18990 1 1334 . 1 1 132 132 ARG HA H 1 3.7730 0.0000 . 1 . . . A 473 ARG HA . 18990 1 1335 . 1 1 132 132 ARG HB2 H 1 1.7730 0.0000 . 2 . . . A 473 ARG HB2 . 18990 1 1336 . 1 1 132 132 ARG HG2 H 1 1.6090 0.0000 . 2 . . . A 473 ARG HG2 . 18990 1 1337 . 1 1 132 132 ARG HD2 H 1 3.1830 0.0000 . 2 . . . A 473 ARG HD2 . 18990 1 1338 . 1 1 132 132 ARG C C 13 178.0530 0.0000 . 1 . . . A 473 ARG C . 18990 1 1339 . 1 1 132 132 ARG CA C 13 58.0880 0.0000 . 1 . . . A 473 ARG CA . 18990 1 1340 . 1 1 132 132 ARG CB C 13 29.4260 0.0000 . 1 . . . A 473 ARG CB . 18990 1 1341 . 1 1 132 132 ARG CG C 13 27.2400 0.0000 . 1 . . . A 473 ARG CG . 18990 1 1342 . 1 1 132 132 ARG CD C 13 43.1690 0.0000 . 1 . . . A 473 ARG CD . 18990 1 1343 . 1 1 133 133 ASP H H 1 7.7180 0.0000 . 1 . . . A 474 ASP H . 18990 1 1344 . 1 1 133 133 ASP HA H 1 4.2150 0.0000 . 1 . . . A 474 ASP HA . 18990 1 1345 . 1 1 133 133 ASP HB2 H 1 2.5120 0.0000 . 2 . . . A 474 ASP HB2 . 18990 1 1346 . 1 1 133 133 ASP HB3 H 1 2.4180 0.0000 . 2 . . . A 474 ASP HB3 . 18990 1 1347 . 1 1 133 133 ASP C C 13 178.1970 0.0000 . 1 . . . A 474 ASP C . 18990 1 1348 . 1 1 133 133 ASP CA C 13 56.8020 0.0000 . 1 . . . A 474 ASP CA . 18990 1 1349 . 1 1 133 133 ASP CB C 13 40.1820 0.0000 . 1 . . . A 474 ASP CB . 18990 1 1350 . 1 1 133 133 ASP N N 15 119.9000 0.0000 . 1 . . . A 474 ASP N . 18990 1 1351 . 1 1 134 134 CYS H H 1 6.9530 0.0000 . 1 . . . A 475 CYS H . 18990 1 1352 . 1 1 134 134 CYS HA H 1 3.3670 0.0000 . 1 . . . A 475 CYS HA . 18990 1 1353 . 1 1 134 134 CYS HB2 H 1 2.6800 0.0000 . 2 . . . A 475 CYS HB2 . 18990 1 1354 . 1 1 134 134 CYS HB3 H 1 1.4290 0.0000 . 2 . . . A 475 CYS HB3 . 18990 1 1355 . 1 1 134 134 CYS CA C 13 64.5330 0.0000 . 1 . . . A 475 CYS CA . 18990 1 1356 . 1 1 134 134 CYS CB C 13 29.0920 0.0000 . 1 . . . A 475 CYS CB . 18990 1 1357 . 1 1 134 134 CYS N N 15 121.0000 0.0000 . 1 . . . A 475 CYS N . 18990 1 1358 . 1 1 135 135 MET HA H 1 4.0210 0.0000 . 1 . . . A 476 MET HA . 18990 1 1359 . 1 1 135 135 MET HB2 H 1 2.0870 0.0000 . 2 . . . A 476 MET HB2 . 18990 1 1360 . 1 1 135 135 MET HB3 H 1 1.8540 0.0000 . 2 . . . A 476 MET HB3 . 18990 1 1361 . 1 1 135 135 MET HG2 H 1 2.2100 0.0000 . 2 . . . A 476 MET HG2 . 18990 1 1362 . 1 1 135 135 MET HE1 H 1 1.8750 0.0000 . 1 . . . A 476 MET HE1 . 18990 1 1363 . 1 1 135 135 MET HE2 H 1 1.8750 0.0000 . 1 . . . A 476 MET HE2 . 18990 1 1364 . 1 1 135 135 MET HE3 H 1 1.8750 0.0000 . 1 . . . A 476 MET HE3 . 18990 1 1365 . 1 1 135 135 MET CA C 13 58.0100 0.0000 . 1 . . . A 476 MET CA . 18990 1 1366 . 1 1 135 135 MET CB C 13 32.5500 0.0000 . 1 . . . A 476 MET CB . 18990 1 1367 . 1 1 135 135 MET CG C 13 36.1800 0.0000 . 1 . . . A 476 MET CG . 18990 1 1368 . 1 1 135 135 MET CE C 13 16.9530 0.0000 . 1 . . . A 476 MET CE . 18990 1 1369 . 1 1 136 136 GLY H H 1 9.1550 0.0000 . 1 . . . A 477 GLY H . 18990 1 1370 . 1 1 136 136 GLY HA2 H 1 4.0450 0.0000 . 2 . . . A 477 GLY HA2 . 18990 1 1371 . 1 1 136 136 GLY HA3 H 1 3.7510 0.0000 . 2 . . . A 477 GLY HA3 . 18990 1 1372 . 1 1 136 136 GLY C C 13 174.4060 0.0000 . 1 . . . A 477 GLY C . 18990 1 1373 . 1 1 136 136 GLY CA C 13 45.6160 0.0000 . 1 . . . A 477 GLY CA . 18990 1 1374 . 1 1 136 136 GLY N N 15 111.9380 0.0000 . 1 . . . A 477 GLY N . 18990 1 1375 . 1 1 137 137 ALA H H 1 7.3470 0.0000 . 1 . . . A 478 ALA H . 18990 1 1376 . 1 1 137 137 ALA HA H 1 4.2910 0.0000 . 1 . . . A 478 ALA HA . 18990 1 1377 . 1 1 137 137 ALA HB1 H 1 0.9840 0.0000 . 1 . . . A 478 ALA HB1 . 18990 1 1378 . 1 1 137 137 ALA HB2 H 1 0.9840 0.0000 . 1 . . . A 478 ALA HB2 . 18990 1 1379 . 1 1 137 137 ALA HB3 H 1 0.9840 0.0000 . 1 . . . A 478 ALA HB3 . 18990 1 1380 . 1 1 137 137 ALA C C 13 178.1960 0.0000 . 1 . . . A 478 ALA C . 18990 1 1381 . 1 1 137 137 ALA CA C 13 53.4400 0.0000 . 1 . . . A 478 ALA CA . 18990 1 1382 . 1 1 137 137 ALA CB C 13 20.3900 0.0000 . 1 . . . A 478 ALA CB . 18990 1 1383 . 1 1 137 137 ALA N N 15 121.9000 0.0000 . 1 . . . A 478 ALA N . 18990 1 1384 . 1 1 138 138 HIS H H 1 8.2970 0.0000 . 1 . . . A 479 HIS H . 18990 1 1385 . 1 1 138 138 HIS HA H 1 4.9030 0.0000 . 1 . . . A 479 HIS HA . 18990 1 1386 . 1 1 138 138 HIS HB2 H 1 3.3100 0.0000 . 2 . . . A 479 HIS HB2 . 18990 1 1387 . 1 1 138 138 HIS HB3 H 1 3.2050 0.0000 . 2 . . . A 479 HIS HB3 . 18990 1 1388 . 1 1 138 138 HIS HD1 H 1 9.6200 0.0000 . 1 . . . A 479 HIS HD1 . 18990 1 1389 . 1 1 138 138 HIS HD2 H 1 7.1800 0.0000 . 1 . . . A 479 HIS HD2 . 18990 1 1390 . 1 1 138 138 HIS HE1 H 1 7.7100 0.0000 . 1 . . . A 479 HIS HE1 . 18990 1 1391 . 1 1 138 138 HIS C C 13 173.3250 0.0000 . 1 . . . A 479 HIS C . 18990 1 1392 . 1 1 138 138 HIS CA C 13 54.5260 0.0000 . 1 . . . A 479 HIS CA . 18990 1 1393 . 1 1 138 138 HIS CB C 13 27.6000 0.0000 . 1 . . . A 479 HIS CB . 18990 1 1394 . 1 1 138 138 HIS CD2 C 13 125.9800 0.0000 . 1 . . . A 479 HIS CD2 . 18990 1 1395 . 1 1 138 138 HIS CE1 C 13 138.6000 0.0000 . 1 . . . A 479 HIS CE1 . 18990 1 1396 . 1 1 138 138 HIS N N 15 115.2000 0.0000 . 1 . . . A 479 HIS N . 18990 1 1397 . 1 1 139 139 TRP H H 1 8.0810 0.0000 . 1 . . . A 480 TRP H . 18990 1 1398 . 1 1 139 139 TRP HA H 1 4.2950 0.0000 . 1 . . . A 480 TRP HA . 18990 1 1399 . 1 1 139 139 TRP HB2 H 1 2.7730 0.0000 . 2 . . . A 480 TRP HB2 . 18990 1 1400 . 1 1 139 139 TRP HB3 H 1 2.6420 0.0000 . 2 . . . A 480 TRP HB3 . 18990 1 1401 . 1 1 139 139 TRP HD1 H 1 6.6290 0.0000 . 1 . . . A 480 TRP HD1 . 18990 1 1402 . 1 1 139 139 TRP HE1 H 1 9.3930 0.0000 . 1 . . . A 480 TRP HE1 . 18990 1 1403 . 1 1 139 139 TRP HE3 H 1 7.2550 0.0000 . 1 . . . A 480 TRP HE3 . 18990 1 1404 . 1 1 139 139 TRP HZ2 H 1 6.9580 0.0000 . 1 . . . A 480 TRP HZ2 . 18990 1 1405 . 1 1 139 139 TRP HZ3 H 1 7.4240 0.0000 . 1 . . . A 480 TRP HZ3 . 18990 1 1406 . 1 1 139 139 TRP HH2 H 1 7.1140 0.0000 . 1 . . . A 480 TRP HH2 . 18990 1 1407 . 1 1 139 139 TRP C C 13 175.5680 0.0000 . 1 . . . A 480 TRP C . 18990 1 1408 . 1 1 139 139 TRP CA C 13 58.3580 0.0000 . 1 . . . A 480 TRP CA . 18990 1 1409 . 1 1 139 139 TRP CB C 13 29.5500 0.0000 . 1 . . . A 480 TRP CB . 18990 1 1410 . 1 1 139 139 TRP CD1 C 13 126.5500 0.0000 . 1 . . . A 480 TRP CD1 . 18990 1 1411 . 1 1 139 139 TRP CE3 C 13 119.5390 0.0000 . 1 . . . A 480 TRP CE3 . 18990 1 1412 . 1 1 139 139 TRP CZ2 C 13 113.7020 0.0000 . 1 . . . A 480 TRP CZ2 . 18990 1 1413 . 1 1 139 139 TRP CZ3 C 13 122.7410 0.0000 . 1 . . . A 480 TRP CZ3 . 18990 1 1414 . 1 1 139 139 TRP CH2 C 13 123.7470 0.0000 . 1 . . . A 480 TRP CH2 . 18990 1 1415 . 1 1 139 139 TRP N N 15 121.7800 0.0000 . 1 . . . A 480 TRP N . 18990 1 1416 . 1 1 139 139 TRP NE1 N 15 128.9340 0.0000 . 1 . . . A 480 TRP NE1 . 18990 1 1417 . 1 1 140 140 PHE HA H 1 4.8450 0.0000 . 1 . . . A 481 PHE HA . 18990 1 1418 . 1 1 140 140 PHE HB2 H 1 3.0600 0.0000 . 2 . . . A 481 PHE HB2 . 18990 1 1419 . 1 1 140 140 PHE HB3 H 1 2.7920 0.0000 . 2 . . . A 481 PHE HB3 . 18990 1 1420 . 1 1 140 140 PHE HD2 H 1 7.0280 0.0000 . 3 . . . A 481 PHE HD2 . 18990 1 1421 . 1 1 140 140 PHE HE2 H 1 6.8670 0.0000 . 3 . . . A 481 PHE HE2 . 18990 1 1422 . 1 1 140 140 PHE HZ H 1 7.1350 0.0000 . 1 . . . A 481 PHE HZ . 18990 1 1423 . 1 1 140 140 PHE C C 13 175.1260 0.0000 . 1 . . . A 481 PHE C . 18990 1 1424 . 1 1 140 140 PHE CA C 13 56.4710 0.0000 . 1 . . . A 481 PHE CA . 18990 1 1425 . 1 1 140 140 PHE CB C 13 41.0060 0.0000 . 1 . . . A 481 PHE CB . 18990 1 1426 . 1 1 140 140 PHE CD2 C 13 131.7400 0.0000 . 1 . . . A 481 PHE CD2 . 18990 1 1427 . 1 1 140 140 PHE CE2 C 13 130.9590 0.0000 . 1 . . . A 481 PHE CE2 . 18990 1 1428 . 1 1 140 140 PHE CZ C 13 128.9610 0.0000 . 1 . . . A 481 PHE CZ . 18990 1 1429 . 1 1 141 141 GLY H H 1 7.7190 0.0000 . 1 . . . A 482 GLY H . 18990 1 1430 . 1 1 141 141 GLY HA2 H 1 3.7250 0.0000 . 2 . . . A 482 GLY HA2 . 18990 1 1431 . 1 1 141 141 GLY HA3 H 1 3.6590 0.0000 . 2 . . . A 482 GLY HA3 . 18990 1 1432 . 1 1 141 141 GLY C C 13 178.2980 0.0000 . 1 . . . A 482 GLY C . 18990 1 1433 . 1 1 141 141 GLY CA C 13 46.3790 0.0000 . 1 . . . A 482 GLY CA . 18990 1 1434 . 1 1 141 141 GLY N N 15 114.9060 0.0000 . 1 . . . A 482 GLY N . 18990 1 stop_ save_