data_51542 ####################### # Entry information # ####################### save_entry_information_1 _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information_1 _Entry.ID 51542 _Entry.Title ; 1H, 13C and 15N resonance assignments for the BRCT domain of the kinetoplastid kinetochore protein KKT4 from Trypanosoma brucei ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2022-08-02 _Entry.Accession_date 2022-08-02 _Entry.Last_release_date 2022-08-03 _Entry.Original_release_date 2022-08-03 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.14.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 Patryk Ludzia . . . 0000-0002-1678-6875 51542 2 Timothy Robinson . . . . 51542 3 Bungo Akiyoshi . . . 0000-0001-6010-394X 51542 4 Christina Redfield . . . 0000-0001-7297-7708 51542 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . 'University of Oxford' . 51542 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 51542 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 642 51542 '15N chemical shifts' 180 51542 '1H chemical shifts' 988 51542 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2024-03-20 . original BMRB . 51542 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 6ZPK 'Crystal structure of the unconventional kinetochore protein Trypanosoma brucei KKT4 BRCT domain' 51542 stop_ save_ ############### # Citations # ############### save_citations_1 _Citation.Sf_category citations _Citation.Sf_framecode citations_1 _Citation.Entry_ID 51542 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 38453826 _Citation.DOI 10.1007/s12104-024-10163-9 _Citation.Full_citation . _Citation.Title ; NMR study of the structure and dynamics of the BRCT domain from the kinetochore protein KKT4 ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assignments' _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first . _Citation.Page_last . _Citation.Year 2024 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Patryk Ludzia P. . . . 51542 1 2 Hanako Hayashi H. . . . 51542 1 3 Timothy Robinson T. . . . 51542 1 4 Bungo Akiyoshi B. . . . 51542 1 5 Christina Redfield C. . . . 51542 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID BRCT 51542 1 KKT4 51542 1 'NMR resonance assignments' 51542 1 kinetochore 51542 1 kinetoplastid 51542 1 trypanosomes 51542 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly_1 _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly_1 _Assembly.Entry_ID 51542 _Assembly.ID 1 _Assembly.Name 'KKT4 463-645' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states no _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange no _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass 19889.60 _Assembly.Enzyme_commission_number . _Assembly.Details 'KKT4 BRCT domain' _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 KKT4 1 $entity_1 . . yes native no no . . . 51542 1 stop_ loop_ _Assembly_db_link.Author_supplied _Assembly_db_link.Database_code _Assembly_db_link.Accession_code _Assembly_db_link.Entry_mol_code _Assembly_db_link.Entry_mol_name _Assembly_db_link.Entry_experimental_method _Assembly_db_link.Entry_structure_resolution _Assembly_db_link.Entry_relation_type _Assembly_db_link.Entry_details _Assembly_db_link.Entry_ID _Assembly_db_link.Assembly_ID yes PDB 6ZPK . . X-ray 1.57 . . 51542 1 stop_ loop_ _Assembly_bio_function.Biological_function _Assembly_bio_function.Entry_ID _Assembly_bio_function.Assembly_ID 'kinetochore protein' 51542 1 phosphopeptide-binding 51542 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 51542 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity_1 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; SMSGASSAVGGSTRSPSPVD PKRGAVQPRYFITTSLTEKE RNSVMEAIQKLGQRAVLVDN KVDEILPLNTTHIVLRGPPR SVKALCGVVSSKWLVQPSYV FDSLGAGFWLDEEVEGGLRY FPPPLRCQRFLLTMPEGVVK TMLQRVVEFGGGEVVGTKRN GSSNDQDVVVVSSGDELLRF AISRD ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details 'Residues 1-2 (461S, 462M) represent part of a remained linker after TEV protease cleavage.' _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 185 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 19889.60 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . 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 yes UNP Q580Y8 . KKT4 . . . . . . . . . . . . . . 51542 1 stop_ loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID 'kinetochore protein' 51542 1 phosphopeptide-binding 51542 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 1 461 SER . 51542 1 2 462 MET . 51542 1 3 463 SER . 51542 1 4 464 GLY . 51542 1 5 465 ALA . 51542 1 6 466 SER . 51542 1 7 467 SER . 51542 1 8 468 ALA . 51542 1 9 469 VAL . 51542 1 10 470 GLY . 51542 1 11 471 GLY . 51542 1 12 472 SER . 51542 1 13 473 THR . 51542 1 14 474 ARG . 51542 1 15 475 SER . 51542 1 16 476 PRO . 51542 1 17 477 SER . 51542 1 18 478 PRO . 51542 1 19 479 VAL . 51542 1 20 480 ASP . 51542 1 21 481 PRO . 51542 1 22 482 LYS . 51542 1 23 483 ARG . 51542 1 24 484 GLY . 51542 1 25 485 ALA . 51542 1 26 486 VAL . 51542 1 27 487 GLN . 51542 1 28 488 PRO . 51542 1 29 489 ARG . 51542 1 30 490 TYR . 51542 1 31 491 PHE . 51542 1 32 492 ILE . 51542 1 33 493 THR . 51542 1 34 494 THR . 51542 1 35 495 SER . 51542 1 36 496 LEU . 51542 1 37 497 THR . 51542 1 38 498 GLU . 51542 1 39 499 LYS . 51542 1 40 500 GLU . 51542 1 41 501 ARG . 51542 1 42 502 ASN . 51542 1 43 503 SER . 51542 1 44 504 VAL . 51542 1 45 505 MET . 51542 1 46 506 GLU . 51542 1 47 507 ALA . 51542 1 48 508 ILE . 51542 1 49 509 GLN . 51542 1 50 510 LYS . 51542 1 51 511 LEU . 51542 1 52 512 GLY . 51542 1 53 513 GLN . 51542 1 54 514 ARG . 51542 1 55 515 ALA . 51542 1 56 516 VAL . 51542 1 57 517 LEU . 51542 1 58 518 VAL . 51542 1 59 519 ASP . 51542 1 60 520 ASN . 51542 1 61 521 LYS . 51542 1 62 522 VAL . 51542 1 63 523 ASP . 51542 1 64 524 GLU . 51542 1 65 525 ILE . 51542 1 66 526 LEU . 51542 1 67 527 PRO . 51542 1 68 528 LEU . 51542 1 69 529 ASN . 51542 1 70 530 THR . 51542 1 71 531 THR . 51542 1 72 532 HIS . 51542 1 73 533 ILE . 51542 1 74 534 VAL . 51542 1 75 535 LEU . 51542 1 76 536 ARG . 51542 1 77 537 GLY . 51542 1 78 538 PRO . 51542 1 79 539 PRO . 51542 1 80 540 ARG . 51542 1 81 541 SER . 51542 1 82 542 VAL . 51542 1 83 543 LYS . 51542 1 84 544 ALA . 51542 1 85 545 LEU . 51542 1 86 546 CYS . 51542 1 87 547 GLY . 51542 1 88 548 VAL . 51542 1 89 549 VAL . 51542 1 90 550 SER . 51542 1 91 551 SER . 51542 1 92 552 LYS . 51542 1 93 553 TRP . 51542 1 94 554 LEU . 51542 1 95 555 VAL . 51542 1 96 556 GLN . 51542 1 97 557 PRO . 51542 1 98 558 SER . 51542 1 99 559 TYR . 51542 1 100 560 VAL . 51542 1 101 561 PHE . 51542 1 102 562 ASP . 51542 1 103 563 SER . 51542 1 104 564 LEU . 51542 1 105 565 GLY . 51542 1 106 566 ALA . 51542 1 107 567 GLY . 51542 1 108 568 PHE . 51542 1 109 569 TRP . 51542 1 110 570 LEU . 51542 1 111 571 ASP . 51542 1 112 572 GLU . 51542 1 113 573 GLU . 51542 1 114 574 VAL . 51542 1 115 575 GLU . 51542 1 116 576 GLY . 51542 1 117 577 GLY . 51542 1 118 578 LEU . 51542 1 119 579 ARG . 51542 1 120 580 TYR . 51542 1 121 581 PHE . 51542 1 122 582 PRO . 51542 1 123 583 PRO . 51542 1 124 584 PRO . 51542 1 125 585 LEU . 51542 1 126 586 ARG . 51542 1 127 587 CYS . 51542 1 128 588 GLN . 51542 1 129 589 ARG . 51542 1 130 590 PHE . 51542 1 131 591 LEU . 51542 1 132 592 LEU . 51542 1 133 593 THR . 51542 1 134 594 MET . 51542 1 135 595 PRO . 51542 1 136 596 GLU . 51542 1 137 597 GLY . 51542 1 138 598 VAL . 51542 1 139 599 VAL . 51542 1 140 600 LYS . 51542 1 141 601 THR . 51542 1 142 602 MET . 51542 1 143 603 LEU . 51542 1 144 604 GLN . 51542 1 145 605 ARG . 51542 1 146 606 VAL . 51542 1 147 607 VAL . 51542 1 148 608 GLU . 51542 1 149 609 PHE . 51542 1 150 610 GLY . 51542 1 151 611 GLY . 51542 1 152 612 GLY . 51542 1 153 613 GLU . 51542 1 154 614 VAL . 51542 1 155 615 VAL . 51542 1 156 616 GLY . 51542 1 157 617 THR . 51542 1 158 618 LYS . 51542 1 159 619 ARG . 51542 1 160 620 ASN . 51542 1 161 621 GLY . 51542 1 162 622 SER . 51542 1 163 623 SER . 51542 1 164 624 ASN . 51542 1 165 625 ASP . 51542 1 166 626 GLN . 51542 1 167 627 ASP . 51542 1 168 628 VAL . 51542 1 169 629 VAL . 51542 1 170 630 VAL . 51542 1 171 631 VAL . 51542 1 172 632 SER . 51542 1 173 633 SER . 51542 1 174 634 GLY . 51542 1 175 635 ASP . 51542 1 176 636 GLU . 51542 1 177 637 LEU . 51542 1 178 638 LEU . 51542 1 179 639 ARG . 51542 1 180 640 PHE . 51542 1 181 641 ALA . 51542 1 182 642 ILE . 51542 1 183 643 SER . 51542 1 184 644 ARG . 51542 1 185 645 ASP . 51542 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 . SER 1 1 51542 1 . MET 2 2 51542 1 . SER 3 3 51542 1 . GLY 4 4 51542 1 . ALA 5 5 51542 1 . SER 6 6 51542 1 . SER 7 7 51542 1 . ALA 8 8 51542 1 . VAL 9 9 51542 1 . GLY 10 10 51542 1 . GLY 11 11 51542 1 . SER 12 12 51542 1 . THR 13 13 51542 1 . ARG 14 14 51542 1 . SER 15 15 51542 1 . PRO 16 16 51542 1 . SER 17 17 51542 1 . PRO 18 18 51542 1 . VAL 19 19 51542 1 . ASP 20 20 51542 1 . PRO 21 21 51542 1 . LYS 22 22 51542 1 . ARG 23 23 51542 1 . GLY 24 24 51542 1 . ALA 25 25 51542 1 . VAL 26 26 51542 1 . GLN 27 27 51542 1 . PRO 28 28 51542 1 . ARG 29 29 51542 1 . TYR 30 30 51542 1 . PHE 31 31 51542 1 . ILE 32 32 51542 1 . THR 33 33 51542 1 . THR 34 34 51542 1 . SER 35 35 51542 1 . LEU 36 36 51542 1 . THR 37 37 51542 1 . GLU 38 38 51542 1 . LYS 39 39 51542 1 . GLU 40 40 51542 1 . ARG 41 41 51542 1 . ASN 42 42 51542 1 . SER 43 43 51542 1 . VAL 44 44 51542 1 . MET 45 45 51542 1 . GLU 46 46 51542 1 . ALA 47 47 51542 1 . ILE 48 48 51542 1 . GLN 49 49 51542 1 . LYS 50 50 51542 1 . LEU 51 51 51542 1 . GLY 52 52 51542 1 . GLN 53 53 51542 1 . ARG 54 54 51542 1 . ALA 55 55 51542 1 . VAL 56 56 51542 1 . LEU 57 57 51542 1 . VAL 58 58 51542 1 . ASP 59 59 51542 1 . ASN 60 60 51542 1 . LYS 61 61 51542 1 . VAL 62 62 51542 1 . ASP 63 63 51542 1 . GLU 64 64 51542 1 . ILE 65 65 51542 1 . LEU 66 66 51542 1 . PRO 67 67 51542 1 . LEU 68 68 51542 1 . ASN 69 69 51542 1 . THR 70 70 51542 1 . THR 71 71 51542 1 . HIS 72 72 51542 1 . ILE 73 73 51542 1 . VAL 74 74 51542 1 . LEU 75 75 51542 1 . ARG 76 76 51542 1 . GLY 77 77 51542 1 . PRO 78 78 51542 1 . PRO 79 79 51542 1 . ARG 80 80 51542 1 . SER 81 81 51542 1 . VAL 82 82 51542 1 . LYS 83 83 51542 1 . ALA 84 84 51542 1 . LEU 85 85 51542 1 . CYS 86 86 51542 1 . GLY 87 87 51542 1 . VAL 88 88 51542 1 . VAL 89 89 51542 1 . SER 90 90 51542 1 . SER 91 91 51542 1 . LYS 92 92 51542 1 . TRP 93 93 51542 1 . LEU 94 94 51542 1 . VAL 95 95 51542 1 . GLN 96 96 51542 1 . PRO 97 97 51542 1 . SER 98 98 51542 1 . TYR 99 99 51542 1 . VAL 100 100 51542 1 . PHE 101 101 51542 1 . ASP 102 102 51542 1 . SER 103 103 51542 1 . LEU 104 104 51542 1 . GLY 105 105 51542 1 . ALA 106 106 51542 1 . GLY 107 107 51542 1 . PHE 108 108 51542 1 . TRP 109 109 51542 1 . LEU 110 110 51542 1 . ASP 111 111 51542 1 . GLU 112 112 51542 1 . GLU 113 113 51542 1 . VAL 114 114 51542 1 . GLU 115 115 51542 1 . GLY 116 116 51542 1 . GLY 117 117 51542 1 . LEU 118 118 51542 1 . ARG 119 119 51542 1 . TYR 120 120 51542 1 . PHE 121 121 51542 1 . PRO 122 122 51542 1 . PRO 123 123 51542 1 . PRO 124 124 51542 1 . LEU 125 125 51542 1 . ARG 126 126 51542 1 . CYS 127 127 51542 1 . GLN 128 128 51542 1 . ARG 129 129 51542 1 . PHE 130 130 51542 1 . LEU 131 131 51542 1 . LEU 132 132 51542 1 . THR 133 133 51542 1 . MET 134 134 51542 1 . PRO 135 135 51542 1 . GLU 136 136 51542 1 . GLY 137 137 51542 1 . VAL 138 138 51542 1 . VAL 139 139 51542 1 . LYS 140 140 51542 1 . THR 141 141 51542 1 . MET 142 142 51542 1 . LEU 143 143 51542 1 . GLN 144 144 51542 1 . ARG 145 145 51542 1 . VAL 146 146 51542 1 . VAL 147 147 51542 1 . GLU 148 148 51542 1 . PHE 149 149 51542 1 . GLY 150 150 51542 1 . GLY 151 151 51542 1 . GLY 152 152 51542 1 . GLU 153 153 51542 1 . VAL 154 154 51542 1 . VAL 155 155 51542 1 . GLY 156 156 51542 1 . THR 157 157 51542 1 . LYS 158 158 51542 1 . ARG 159 159 51542 1 . ASN 160 160 51542 1 . GLY 161 161 51542 1 . SER 162 162 51542 1 . SER 163 163 51542 1 . ASN 164 164 51542 1 . ASP 165 165 51542 1 . GLN 166 166 51542 1 . ASP 167 167 51542 1 . VAL 168 168 51542 1 . VAL 169 169 51542 1 . VAL 170 170 51542 1 . VAL 171 171 51542 1 . SER 172 172 51542 1 . SER 173 173 51542 1 . GLY 174 174 51542 1 . ASP 175 175 51542 1 . GLU 176 176 51542 1 . LEU 177 177 51542 1 . LEU 178 178 51542 1 . ARG 179 179 51542 1 . PHE 180 180 51542 1 . ALA 181 181 51542 1 . ILE 182 182 51542 1 . SER 183 183 51542 1 . ARG 184 184 51542 1 . ASP 185 185 51542 1 stop_ save_ #################### # Natural source # #################### save_natural_source_1 _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source_1 _Entity_natural_src_list.Entry_ID 51542 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity_1 . 5691 organism . 'Trypanosoma brucei brucei' 'Trypanosoma brucei' . . Eukaryota . Trypanosoma brucei '927/4 GUTat10.1' . . . . . . . . . . Tb927.8.3680 . 51542 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source_1 _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source_1 _Entity_experimental_src_list.Entry_ID 51542 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli BL-21(DE3) . . plasmid . . pNIC28-Bsa4 . . . 51542 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 51542 _Sample.ID 1 _Sample.Name '15N-KKT4 463-645' _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number 1 _Sample.Solvent_system '95% H2O/5% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'KKT4 463-645' '[U-100% 15N]' . . 1 $entity_1 . . 0.475 . . mM . . . . 51542 1 2 'sodium phosphate' 'natural abundance' . . . . . . 50 . . mM . . . . 51542 1 3 'sodium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 51542 1 4 TCEP 'natural abundance' . . . . . . 0.5 . . mM . . . . 51542 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 51542 _Sample.ID 2 _Sample.Name '13C/15N-KKT4 463-645' _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number 1 _Sample.Solvent_system '95% H2O/5% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'KKT4 463-645' '[U-100% 13C; U-100% 15N]' . . 1 $entity_1 . . 0.475 . . mM . . . . 51542 2 2 'sodium phosphate' 'natural abundance' . . . . . . 50 . . mM . . . . 51542 2 3 'sodium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 51542 2 4 TCEP 'natural abundance' . . . . . . 0.5 . . mM . . . . 51542 2 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 51542 _Sample_condition_list.ID 1 _Sample_condition_list.Name 'sample conditions 1' _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 100 10 mM 51542 1 pH 7.0 . pH 51542 1 pressure 1 . atm 51542 1 temperature 293.15 . K 51542 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 51542 _Software.ID 1 _Software.Type . _Software.Name CcpNMR _Software.Version 2.5.1 _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 51542 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 51542 _Software.ID 2 _Software.Type . _Software.Name NMRPipe _Software.Version 9.7 _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID processing . 51542 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 51542 _Software.ID 3 _Software.Type . _Software.Name TOPSPIN _Software.Version 3.2 _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID collection . 51542 3 stop_ save_ save_software_4 _Software.Sf_category software _Software.Sf_framecode software_4 _Software.Entry_ID 51542 _Software.ID 4 _Software.Type . _Software.Name hmsIST _Software.Version 211_64b _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID processing . 51542 4 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID 51542 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name '750 MHz' _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE III' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 750 save_ save_NMR_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_2 _NMR_spectrometer.Entry_ID 51542 _NMR_spectrometer.ID 2 _NMR_spectrometer.Name '950 MHz' _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE III' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 950 save_ ############################# # NMR applied experiments # ############################# save_experiment_list_1 _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list_1 _Experiment_list.Entry_ID 51542 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NUS_flag _Experiment.Interleaved_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Details _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N BEST TROSY' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51542 1 2 '2D 1H-15N BEST TROSY' no no no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51542 1 3 '2D 1H-13C HSQC' no no no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51542 1 4 '3D 1H-15N TOCSY' no yes no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51542 1 5 '3D 1H-15N NOESY' no yes no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51542 1 6 '3D HBHA(CO)NH' no yes no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51542 1 7 '3D (H)CC(CO)NH' no yes no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51542 1 8 '3D H(CCCO)NH' no yes no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51542 1 9 '3D HCCH-TOCSY' no yes no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 51542 1 10 '3D BT-HNCA' no yes no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51542 1 11 '3D BT-HNCO' no yes no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51542 1 12 '3D BT-HN(CA)CO' no yes no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51542 1 13 '3D BT-HNCACB' no yes no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51542 1 14 '3D BT-HN(CO)CACB' no yes no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51542 1 15 '3D (H)CCH-TOCSY' no yes no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51542 1 16 '3D HCCH-COSY' no yes no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51542 1 17 '3D (H)CCH-COSY' no yes no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51542 1 18 '3D 1H-13C NOESY' no yes no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51542 1 19 '2D 1H-15N HSQC' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51542 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chem_shift_reference_1 _Chem_shift_reference.Entry_ID 51542 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name 'chemical shift reference' _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl carbons' . . . . ppm 0.0 internal direct 1 . . . . . 51542 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 internal direct 1 . . . . . 51542 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 na indirect 0.101329 . . . . . 51542 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 51542 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name 'KKT4 463-645 chemical shifts' _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 2 '2D 1H-15N BEST TROSY' . . . 51542 1 3 '2D 1H-13C HSQC' . . . 51542 1 4 '3D 1H-15N TOCSY' . . . 51542 1 5 '3D 1H-15N NOESY' . . . 51542 1 6 '3D HBHA(CO)NH' . . . 51542 1 7 '3D (H)CC(CO)NH' . . . 51542 1 8 '3D H(CCCO)NH' . . . 51542 1 9 '3D HCCH-TOCSY' . . . 51542 1 10 '3D BT-HNCA' . . . 51542 1 11 '3D BT-HNCO' . . . 51542 1 12 '3D BT-HN(CA)CO' . . . 51542 1 13 '3D BT-HNCACB' . . . 51542 1 14 '3D BT-HN(CO)CACB' . . . 51542 1 15 '3D (H)CCH-TOCSY' . . . 51542 1 16 '3D HCCH-COSY' . . . 51542 1 17 '3D (H)CCH-COSY' . . . 51542 1 18 '3D 1H-13C NOESY' . . . 51542 1 19 '2D 1H-15N HSQC' . . . 51542 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $software_1 . . 51542 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 2 2 MET HE1 H 1 2.067 0.020 . 1 . . . . . 462 MET HE1 . 51542 1 2 . 1 . 1 2 2 MET HE2 H 1 2.067 0.020 . 1 . . . . . 462 MET HE2 . 51542 1 3 . 1 . 1 2 2 MET HE3 H 1 2.067 0.020 . 1 . . . . . 462 MET HE3 . 51542 1 4 . 1 . 1 2 2 MET CE C 13 16.912 0.200 . 1 . . . . . 462 MET CE . 51542 1 5 . 1 . 1 3 3 SER HA H 1 4.426 0.003 . 1 . . . . . 463 SER HA . 51542 1 6 . 1 . 1 3 3 SER HB2 H 1 3.844 0.020 . 1 . . . . . 463 SER HB2 . 51542 1 7 . 1 . 1 3 3 SER HB3 H 1 3.844 0.020 . 1 . . . . . 463 SER HB3 . 51542 1 8 . 1 . 1 3 3 SER C C 13 175.070 0.200 . 1 . . . . . 463 SER C . 51542 1 9 . 1 . 1 3 3 SER CA C 13 58.530 0.045 . 1 . . . . . 463 SER CA . 51542 1 10 . 1 . 1 3 3 SER CB C 13 63.649 0.200 . 1 . . . . . 463 SER CB . 51542 1 11 . 1 . 1 4 4 GLY H H 1 8.456 0.003 . 1 . . . . . 464 GLY H . 51542 1 12 . 1 . 1 4 4 GLY HA2 H 1 3.943 0.003 . 1 . . . . . 464 GLY HA2 . 51542 1 13 . 1 . 1 4 4 GLY HA3 H 1 3.943 0.003 . 1 . . . . . 464 GLY HA3 . 51542 1 14 . 1 . 1 4 4 GLY C C 13 174.005 0.009 . 1 . . . . . 464 GLY C . 51542 1 15 . 1 . 1 4 4 GLY CA C 13 45.312 0.032 . 1 . . . . . 464 GLY CA . 51542 1 16 . 1 . 1 4 4 GLY N N 15 111.413 0.046 . 1 . . . . . 464 GLY N . 51542 1 17 . 1 . 1 5 5 ALA H H 1 8.189 0.001 . 1 . . . . . 465 ALA H . 51542 1 18 . 1 . 1 5 5 ALA HA H 1 4.326 0.005 . 1 . . . . . 465 ALA HA . 51542 1 19 . 1 . 1 5 5 ALA HB1 H 1 1.372 0.001 . 1 . . . . . 465 ALA HB1 . 51542 1 20 . 1 . 1 5 5 ALA HB2 H 1 1.372 0.001 . 1 . . . . . 465 ALA HB2 . 51542 1 21 . 1 . 1 5 5 ALA HB3 H 1 1.372 0.001 . 1 . . . . . 465 ALA HB3 . 51542 1 22 . 1 . 1 5 5 ALA C C 13 178.043 0.026 . 1 . . . . . 465 ALA C . 51542 1 23 . 1 . 1 5 5 ALA CA C 13 52.637 0.048 . 1 . . . . . 465 ALA CA . 51542 1 24 . 1 . 1 5 5 ALA CB C 13 19.326 0.011 . 1 . . . . . 465 ALA CB . 51542 1 25 . 1 . 1 5 5 ALA N N 15 123.905 0.059 . 1 . . . . . 465 ALA N . 51542 1 26 . 1 . 1 6 6 SER H H 1 8.373 0.004 . 1 . . . . . 466 SER H . 51542 1 27 . 1 . 1 6 6 SER HA H 1 4.436 0.006 . 1 . . . . . 466 SER HA . 51542 1 28 . 1 . 1 6 6 SER HB2 H 1 3.861 0.004 . 1 . . . . . 466 SER HB2 . 51542 1 29 . 1 . 1 6 6 SER HB3 H 1 3.861 0.004 . 1 . . . . . 466 SER HB3 . 51542 1 30 . 1 . 1 6 6 SER C C 13 174.749 0.035 . 1 . . . . . 466 SER C . 51542 1 31 . 1 . 1 6 6 SER CA C 13 58.426 0.023 . 1 . . . . . 466 SER CA . 51542 1 32 . 1 . 1 6 6 SER CB C 13 63.836 0.200 . 1 . . . . . 466 SER CB . 51542 1 33 . 1 . 1 6 6 SER N N 15 115.265 0.049 . 1 . . . . . 466 SER N . 51542 1 34 . 1 . 1 7 7 SER H H 1 8.308 0.002 . 1 . . . . . 467 SER H . 51542 1 35 . 1 . 1 7 7 SER HA H 1 4.428 0.001 . 1 . . . . . 467 SER HA . 51542 1 36 . 1 . 1 7 7 SER HB2 H 1 3.839 0.020 . 1 . . . . . 467 SER HB2 . 51542 1 37 . 1 . 1 7 7 SER HB3 H 1 3.839 0.020 . 1 . . . . . 467 SER HB3 . 51542 1 38 . 1 . 1 7 7 SER C C 13 174.255 0.029 . 1 . . . . . 467 SER C . 51542 1 39 . 1 . 1 7 7 SER CA C 13 58.379 0.045 . 1 . . . . . 467 SER CA . 51542 1 40 . 1 . 1 7 7 SER CB C 13 63.807 0.014 . 1 . . . . . 467 SER CB . 51542 1 41 . 1 . 1 7 7 SER N N 15 117.814 0.065 . 1 . . . . . 467 SER N . 51542 1 42 . 1 . 1 8 8 ALA H H 1 8.278 0.002 . 1 . . . . . 468 ALA H . 51542 1 43 . 1 . 1 8 8 ALA HA H 1 4.333 0.020 . 1 . . . . . 468 ALA HA . 51542 1 44 . 1 . 1 8 8 ALA HB1 H 1 1.343 0.004 . 1 . . . . . 468 ALA HB1 . 51542 1 45 . 1 . 1 8 8 ALA HB2 H 1 1.343 0.004 . 1 . . . . . 468 ALA HB2 . 51542 1 46 . 1 . 1 8 8 ALA HB3 H 1 1.343 0.004 . 1 . . . . . 468 ALA HB3 . 51542 1 47 . 1 . 1 8 8 ALA C C 13 177.794 0.010 . 1 . . . . . 468 ALA C . 51542 1 48 . 1 . 1 8 8 ALA CA C 13 52.545 0.061 . 1 . . . . . 468 ALA CA . 51542 1 49 . 1 . 1 8 8 ALA CB C 13 19.191 0.020 . 1 . . . . . 468 ALA CB . 51542 1 50 . 1 . 1 8 8 ALA N N 15 126.142 0.061 . 1 . . . . . 468 ALA N . 51542 1 51 . 1 . 1 9 9 VAL H H 1 8.088 0.001 . 1 . . . . . 469 VAL H . 51542 1 52 . 1 . 1 9 9 VAL HA H 1 4.081 0.004 . 1 . . . . . 469 VAL HA . 51542 1 53 . 1 . 1 9 9 VAL HB H 1 2.060 0.001 . 1 . . . . . 469 VAL HB . 51542 1 54 . 1 . 1 9 9 VAL HG11 H 1 0.913 0.001 . 1 . . . . . 469 VAL HG11 . 51542 1 55 . 1 . 1 9 9 VAL HG12 H 1 0.913 0.001 . 1 . . . . . 469 VAL HG12 . 51542 1 56 . 1 . 1 9 9 VAL HG13 H 1 0.913 0.001 . 1 . . . . . 469 VAL HG13 . 51542 1 57 . 1 . 1 9 9 VAL HG21 H 1 0.913 0.001 . 1 . . . . . 469 VAL HG21 . 51542 1 58 . 1 . 1 9 9 VAL HG22 H 1 0.913 0.001 . 1 . . . . . 469 VAL HG22 . 51542 1 59 . 1 . 1 9 9 VAL HG23 H 1 0.913 0.001 . 1 . . . . . 469 VAL HG23 . 51542 1 60 . 1 . 1 9 9 VAL C C 13 176.871 0.010 . 1 . . . . . 469 VAL C . 51542 1 61 . 1 . 1 9 9 VAL CA C 13 62.386 0.146 . 1 . . . . . 469 VAL CA . 51542 1 62 . 1 . 1 9 9 VAL CB C 13 32.643 0.019 . 1 . . . . . 469 VAL CB . 51542 1 63 . 1 . 1 9 9 VAL CG1 C 13 20.552 0.138 . 2 . . . . . 469 VAL CG1 . 51542 1 64 . 1 . 1 9 9 VAL CG2 C 13 21.532 0.179 . 2 . . . . . 469 VAL CG2 . 51542 1 65 . 1 . 1 9 9 VAL N N 15 119.260 0.054 . 1 . . . . . 469 VAL N . 51542 1 66 . 1 . 1 10 10 GLY H H 1 8.484 0.001 . 1 . . . . . 470 GLY H . 51542 1 67 . 1 . 1 10 10 GLY HA2 H 1 3.948 0.020 . 1 . . . . . 470 GLY HA2 . 51542 1 68 . 1 . 1 10 10 GLY HA3 H 1 3.948 0.020 . 1 . . . . . 470 GLY HA3 . 51542 1 69 . 1 . 1 10 10 GLY C C 13 174.696 0.009 . 1 . . . . . 470 GLY C . 51542 1 70 . 1 . 1 10 10 GLY CA C 13 45.328 0.019 . 1 . . . . . 470 GLY CA . 51542 1 71 . 1 . 1 10 10 GLY N N 15 112.719 0.070 . 1 . . . . . 470 GLY N . 51542 1 72 . 1 . 1 11 11 GLY H H 1 8.282 0.001 . 1 . . . . . 471 GLY H . 51542 1 73 . 1 . 1 11 11 GLY HA2 H 1 3.974 0.001 . 1 . . . . . 471 GLY HA2 . 51542 1 74 . 1 . 1 11 11 GLY HA3 H 1 3.974 0.001 . 1 . . . . . 471 GLY HA3 . 51542 1 75 . 1 . 1 11 11 GLY C C 13 174.339 0.013 . 1 . . . . . 471 GLY C . 51542 1 76 . 1 . 1 11 11 GLY CA C 13 45.277 0.027 . 1 . . . . . 471 GLY CA . 51542 1 77 . 1 . 1 11 11 GLY N N 15 108.945 0.050 . 1 . . . . . 471 GLY N . 51542 1 78 . 1 . 1 12 12 SER H H 1 8.317 0.002 . 1 . . . . . 472 SER H . 51542 1 79 . 1 . 1 12 12 SER HA H 1 4.506 0.001 . 1 . . . . . 472 SER HA . 51542 1 80 . 1 . 1 12 12 SER HB2 H 1 3.859 0.004 . 1 . . . . . 472 SER HB2 . 51542 1 81 . 1 . 1 12 12 SER HB3 H 1 3.859 0.004 . 1 . . . . . 472 SER HB3 . 51542 1 82 . 1 . 1 12 12 SER C C 13 174.914 0.013 . 1 . . . . . 472 SER C . 51542 1 83 . 1 . 1 12 12 SER CA C 13 58.314 0.046 . 1 . . . . . 472 SER CA . 51542 1 84 . 1 . 1 12 12 SER CB C 13 63.902 0.017 . 1 . . . . . 472 SER CB . 51542 1 85 . 1 . 1 12 12 SER N N 15 115.668 0.037 . 1 . . . . . 472 SER N . 51542 1 86 . 1 . 1 13 13 THR H H 1 8.267 0.003 . 1 . . . . . 473 THR H . 51542 1 87 . 1 . 1 13 13 THR HA H 1 4.322 0.007 . 1 . . . . . 473 THR HA . 51542 1 88 . 1 . 1 13 13 THR HB H 1 4.199 0.008 . 1 . . . . . 473 THR HB . 51542 1 89 . 1 . 1 13 13 THR HG21 H 1 1.174 0.010 . 1 . . . . . 473 THR HG21 . 51542 1 90 . 1 . 1 13 13 THR HG22 H 1 1.174 0.010 . 1 . . . . . 473 THR HG22 . 51542 1 91 . 1 . 1 13 13 THR HG23 H 1 1.174 0.010 . 1 . . . . . 473 THR HG23 . 51542 1 92 . 1 . 1 13 13 THR C C 13 174.377 0.015 . 1 . . . . . 473 THR C . 51542 1 93 . 1 . 1 13 13 THR CA C 13 61.948 0.056 . 1 . . . . . 473 THR CA . 51542 1 94 . 1 . 1 13 13 THR CB C 13 69.623 0.056 . 1 . . . . . 473 THR CB . 51542 1 95 . 1 . 1 13 13 THR CG2 C 13 21.532 0.040 . 1 . . . . . 473 THR CG2 . 51542 1 96 . 1 . 1 13 13 THR N N 15 116.309 0.083 . 1 . . . . . 473 THR N . 51542 1 97 . 1 . 1 14 14 ARG H H 1 8.328 0.002 . 1 . . . . . 474 ARG H . 51542 1 98 . 1 . 1 14 14 ARG HA H 1 4.355 0.001 . 1 . . . . . 474 ARG HA . 51542 1 99 . 1 . 1 14 14 ARG HB2 H 1 1.712 0.005 . 2 . . . . . 474 ARG HB2 . 51542 1 100 . 1 . 1 14 14 ARG HB3 H 1 1.808 0.007 . 2 . . . . . 474 ARG HB3 . 51542 1 101 . 1 . 1 14 14 ARG HG2 H 1 1.599 0.002 . 2 . . . . . 474 ARG HG2 . 51542 1 102 . 1 . 1 14 14 ARG HG3 H 1 1.596 0.020 . 2 . . . . . 474 ARG HG3 . 51542 1 103 . 1 . 1 14 14 ARG HD2 H 1 3.167 0.002 . 2 . . . . . 474 ARG HD2 . 51542 1 104 . 1 . 1 14 14 ARG HD3 H 1 3.164 0.020 . 2 . . . . . 474 ARG HD3 . 51542 1 105 . 1 . 1 14 14 ARG C C 13 176.036 0.011 . 1 . . . . . 474 ARG C . 51542 1 106 . 1 . 1 14 14 ARG CA C 13 55.891 0.017 . 1 . . . . . 474 ARG CA . 51542 1 107 . 1 . 1 14 14 ARG CB C 13 30.941 0.035 . 1 . . . . . 474 ARG CB . 51542 1 108 . 1 . 1 14 14 ARG CG C 13 26.864 0.033 . 1 . . . . . 474 ARG CG . 51542 1 109 . 1 . 1 14 14 ARG CD C 13 43.162 0.028 . 1 . . . . . 474 ARG CD . 51542 1 110 . 1 . 1 14 14 ARG N N 15 123.835 0.036 . 1 . . . . . 474 ARG N . 51542 1 111 . 1 . 1 15 15 SER H H 1 8.455 0.002 . 1 . . . . . 475 SER H . 51542 1 112 . 1 . 1 15 15 SER HA H 1 4.704 0.004 . 1 . . . . . 475 SER HA . 51542 1 113 . 1 . 1 15 15 SER HB2 H 1 3.772 0.003 . 2 . . . . . 475 SER HB2 . 51542 1 114 . 1 . 1 15 15 SER HB3 H 1 3.851 0.006 . 2 . . . . . 475 SER HB3 . 51542 1 115 . 1 . 1 15 15 SER C C 13 172.486 0.200 . 1 . . . . . 475 SER C . 51542 1 116 . 1 . 1 15 15 SER CA C 13 56.443 0.062 . 1 . . . . . 475 SER CA . 51542 1 117 . 1 . 1 15 15 SER CB C 13 63.189 0.048 . 1 . . . . . 475 SER CB . 51542 1 118 . 1 . 1 15 15 SER N N 15 119.646 0.058 . 1 . . . . . 475 SER N . 51542 1 119 . 1 . 1 16 16 PRO HA H 1 4.436 0.005 . 1 . . . . . 476 PRO HA . 51542 1 120 . 1 . 1 16 16 PRO HB2 H 1 2.256 0.004 . 2 . . . . . 476 PRO HB2 . 51542 1 121 . 1 . 1 16 16 PRO HB3 H 1 1.891 0.008 . 2 . . . . . 476 PRO HB3 . 51542 1 122 . 1 . 1 16 16 PRO HG2 H 1 1.986 0.007 . 2 . . . . . 476 PRO HG2 . 51542 1 123 . 1 . 1 16 16 PRO HG3 H 1 1.990 0.008 . 2 . . . . . 476 PRO HG3 . 51542 1 124 . 1 . 1 16 16 PRO HD2 H 1 3.779 0.003 . 2 . . . . . 476 PRO HD2 . 51542 1 125 . 1 . 1 16 16 PRO HD3 H 1 3.688 0.002 . 2 . . . . . 476 PRO HD3 . 51542 1 126 . 1 . 1 16 16 PRO C C 13 176.663 0.006 . 1 . . . . . 476 PRO C . 51542 1 127 . 1 . 1 16 16 PRO CA C 13 63.166 0.004 . 1 . . . . . 476 PRO CA . 51542 1 128 . 1 . 1 16 16 PRO CB C 13 32.063 0.020 . 1 . . . . . 476 PRO CB . 51542 1 129 . 1 . 1 16 16 PRO CG C 13 27.260 0.021 . 1 . . . . . 476 PRO CG . 51542 1 130 . 1 . 1 16 16 PRO CD C 13 50.587 0.200 . 1 . . . . . 476 PRO CD . 51542 1 131 . 1 . 1 17 17 SER H H 1 8.406 0.002 . 1 . . . . . 477 SER H . 51542 1 132 . 1 . 1 17 17 SER HA H 1 4.708 0.004 . 1 . . . . . 477 SER HA . 51542 1 133 . 1 . 1 17 17 SER HB2 H 1 3.791 0.020 . 1 . . . . . 477 SER HB2 . 51542 1 134 . 1 . 1 17 17 SER HB3 H 1 3.791 0.020 . 1 . . . . . 477 SER HB3 . 51542 1 135 . 1 . 1 17 17 SER C C 13 172.778 0.200 . 1 . . . . . 477 SER C . 51542 1 136 . 1 . 1 17 17 SER CA C 13 56.431 0.029 . 1 . . . . . 477 SER CA . 51542 1 137 . 1 . 1 17 17 SER CB C 13 63.483 0.200 . 1 . . . . . 477 SER CB . 51542 1 138 . 1 . 1 17 17 SER N N 15 118.113 0.040 . 1 . . . . . 477 SER N . 51542 1 139 . 1 . 1 18 18 PRO HA H 1 4.430 0.020 . 1 . . . . . 478 PRO HA . 51542 1 140 . 1 . 1 18 18 PRO HB2 H 1 2.253 0.013 . 2 . . . . . 478 PRO HB2 . 51542 1 141 . 1 . 1 18 18 PRO HB3 H 1 1.878 0.002 . 2 . . . . . 478 PRO HB3 . 51542 1 142 . 1 . 1 18 18 PRO HG2 H 1 1.986 0.006 . 1 . . . . . 478 PRO HG2 . 51542 1 143 . 1 . 1 18 18 PRO HG3 H 1 1.986 0.006 . 1 . . . . . 478 PRO HG3 . 51542 1 144 . 1 . 1 18 18 PRO HD2 H 1 3.690 0.020 . 2 . . . . . 478 PRO HD2 . 51542 1 145 . 1 . 1 18 18 PRO HD3 H 1 3.777 0.020 . 2 . . . . . 478 PRO HD3 . 51542 1 146 . 1 . 1 18 18 PRO C C 13 176.652 0.200 . 1 . . . . . 478 PRO C . 51542 1 147 . 1 . 1 18 18 PRO CA C 13 63.287 0.017 . 1 . . . . . 478 PRO CA . 51542 1 148 . 1 . 1 18 18 PRO CB C 13 32.159 0.067 . 1 . . . . . 478 PRO CB . 51542 1 149 . 1 . 1 18 18 PRO CG C 13 27.361 0.200 . 1 . . . . . 478 PRO CG . 51542 1 150 . 1 . 1 18 18 PRO CD C 13 50.587 0.200 . 1 . . . . . 478 PRO CD . 51542 1 151 . 1 . 1 19 19 VAL H H 1 8.100 0.002 . 1 . . . . . 479 VAL H . 51542 1 152 . 1 . 1 19 19 VAL HA H 1 4.080 0.005 . 1 . . . . . 479 VAL HA . 51542 1 153 . 1 . 1 19 19 VAL HB H 1 2.011 0.001 . 1 . . . . . 479 VAL HB . 51542 1 154 . 1 . 1 19 19 VAL HG11 H 1 0.895 0.006 . 1 . . . . . 479 VAL HG11 . 51542 1 155 . 1 . 1 19 19 VAL HG12 H 1 0.895 0.006 . 1 . . . . . 479 VAL HG12 . 51542 1 156 . 1 . 1 19 19 VAL HG13 H 1 0.895 0.006 . 1 . . . . . 479 VAL HG13 . 51542 1 157 . 1 . 1 19 19 VAL HG21 H 1 0.895 0.006 . 1 . . . . . 479 VAL HG21 . 51542 1 158 . 1 . 1 19 19 VAL HG22 H 1 0.895 0.006 . 1 . . . . . 479 VAL HG22 . 51542 1 159 . 1 . 1 19 19 VAL HG23 H 1 0.895 0.006 . 1 . . . . . 479 VAL HG23 . 51542 1 160 . 1 . 1 19 19 VAL C C 13 175.595 0.003 . 1 . . . . . 479 VAL C . 51542 1 161 . 1 . 1 19 19 VAL CA C 13 61.816 0.072 . 1 . . . . . 479 VAL CA . 51542 1 162 . 1 . 1 19 19 VAL CB C 13 32.879 0.012 . 1 . . . . . 479 VAL CB . 51542 1 163 . 1 . 1 19 19 VAL CG1 C 13 20.409 0.022 . 2 . . . . . 479 VAL CG1 . 51542 1 164 . 1 . 1 19 19 VAL CG2 C 13 21.257 0.033 . 2 . . . . . 479 VAL CG2 . 51542 1 165 . 1 . 1 19 19 VAL N N 15 119.609 0.130 . 1 . . . . . 479 VAL N . 51542 1 166 . 1 . 1 20 20 ASP H H 1 8.347 0.003 . 1 . . . . . 480 ASP H . 51542 1 167 . 1 . 1 20 20 ASP HA H 1 4.841 0.009 . 1 . . . . . 480 ASP HA . 51542 1 168 . 1 . 1 20 20 ASP HB2 H 1 2.708 0.005 . 2 . . . . . 480 ASP HB2 . 51542 1 169 . 1 . 1 20 20 ASP HB3 H 1 2.470 0.002 . 2 . . . . . 480 ASP HB3 . 51542 1 170 . 1 . 1 20 20 ASP C C 13 173.949 0.200 . 1 . . . . . 480 ASP C . 51542 1 171 . 1 . 1 20 20 ASP CA C 13 52.645 0.029 . 1 . . . . . 480 ASP CA . 51542 1 172 . 1 . 1 20 20 ASP CB C 13 40.701 0.095 . 1 . . . . . 480 ASP CB . 51542 1 173 . 1 . 1 20 20 ASP N N 15 125.433 0.046 . 1 . . . . . 480 ASP N . 51542 1 174 . 1 . 1 21 21 PRO HA H 1 4.430 0.020 . 1 . . . . . 481 PRO HA . 51542 1 175 . 1 . 1 21 21 PRO HB2 H 1 2.236 0.020 . 2 . . . . . 481 PRO HB2 . 51542 1 176 . 1 . 1 21 21 PRO HB3 H 1 1.860 0.020 . 2 . . . . . 481 PRO HB3 . 51542 1 177 . 1 . 1 21 21 PRO C C 13 176.159 0.021 . 1 . . . . . 481 PRO C . 51542 1 178 . 1 . 1 21 21 PRO CA C 13 62.818 0.018 . 1 . . . . . 481 PRO CA . 51542 1 179 . 1 . 1 21 21 PRO CB C 13 32.546 0.200 . 1 . . . . . 481 PRO CB . 51542 1 180 . 1 . 1 21 21 PRO CG C 13 27.309 0.200 . 1 . . . . . 481 PRO CG . 51542 1 181 . 1 . 1 22 22 LYS H H 1 8.568 0.002 . 1 . . . . . 482 LYS H . 51542 1 182 . 1 . 1 22 22 LYS HA H 1 4.208 0.002 . 1 . . . . . 482 LYS HA . 51542 1 183 . 1 . 1 22 22 LYS HB2 H 1 1.843 0.003 . 2 . . . . . 482 LYS HB2 . 51542 1 184 . 1 . 1 22 22 LYS HB3 H 1 1.845 0.020 . 2 . . . . . 482 LYS HB3 . 51542 1 185 . 1 . 1 22 22 LYS HG2 H 1 1.442 0.020 . 1 . . . . . 482 LYS HG2 . 51542 1 186 . 1 . 1 22 22 LYS HG3 H 1 1.442 0.020 . 1 . . . . . 482 LYS HG3 . 51542 1 187 . 1 . 1 22 22 LYS C C 13 176.127 0.200 . 1 . . . . . 482 LYS C . 51542 1 188 . 1 . 1 22 22 LYS CA C 13 56.190 0.040 . 1 . . . . . 482 LYS CA . 51542 1 189 . 1 . 1 22 22 LYS CB C 13 32.847 0.086 . 1 . . . . . 482 LYS CB . 51542 1 190 . 1 . 1 22 22 LYS CG C 13 25.103 0.200 . 1 . . . . . 482 LYS CG . 51542 1 191 . 1 . 1 22 22 LYS N N 15 121.781 0.030 . 1 . . . . . 482 LYS N . 51542 1 192 . 1 . 1 23 23 ARG H H 1 8.248 0.002 . 1 . . . . . 483 ARG H . 51542 1 193 . 1 . 1 23 23 ARG HA H 1 4.101 0.009 . 1 . . . . . 483 ARG HA . 51542 1 194 . 1 . 1 23 23 ARG HB2 H 1 1.391 0.020 . 2 . . . . . 483 ARG HB2 . 51542 1 195 . 1 . 1 23 23 ARG HB3 H 1 1.558 0.020 . 2 . . . . . 483 ARG HB3 . 51542 1 196 . 1 . 1 23 23 ARG HG2 H 1 1.096 0.001 . 2 . . . . . 483 ARG HG2 . 51542 1 197 . 1 . 1 23 23 ARG HG3 H 1 0.835 0.004 . 2 . . . . . 483 ARG HG3 . 51542 1 198 . 1 . 1 23 23 ARG HD2 H 1 2.662 0.002 . 1 . . . . . 483 ARG HD2 . 51542 1 199 . 1 . 1 23 23 ARG HD3 H 1 2.662 0.002 . 1 . . . . . 483 ARG HD3 . 51542 1 200 . 1 . 1 23 23 ARG C C 13 177.224 0.004 . 1 . . . . . 483 ARG C . 51542 1 201 . 1 . 1 23 23 ARG CA C 13 56.870 0.086 . 1 . . . . . 483 ARG CA . 51542 1 202 . 1 . 1 23 23 ARG CB C 13 30.715 0.101 . 1 . . . . . 483 ARG CB . 51542 1 203 . 1 . 1 23 23 ARG CG C 13 27.004 0.028 . 1 . . . . . 483 ARG CG . 51542 1 204 . 1 . 1 23 23 ARG CD C 13 43.107 0.011 . 1 . . . . . 483 ARG CD . 51542 1 205 . 1 . 1 23 23 ARG N N 15 123.628 0.055 . 1 . . . . . 483 ARG N . 51542 1 206 . 1 . 1 24 24 GLY H H 1 8.700 0.003 . 1 . . . . . 484 GLY H . 51542 1 207 . 1 . 1 24 24 GLY HA2 H 1 4.199 0.004 . 2 . . . . . 484 GLY HA2 . 51542 1 208 . 1 . 1 24 24 GLY HA3 H 1 3.398 0.002 . 2 . . . . . 484 GLY HA3 . 51542 1 209 . 1 . 1 24 24 GLY C C 13 173.949 0.041 . 1 . . . . . 484 GLY C . 51542 1 210 . 1 . 1 24 24 GLY CA C 13 43.802 0.067 . 1 . . . . . 484 GLY CA . 51542 1 211 . 1 . 1 24 24 GLY N N 15 111.111 0.070 . 1 . . . . . 484 GLY N . 51542 1 212 . 1 . 1 25 25 ALA H H 1 9.192 0.002 . 1 . . . . . 485 ALA H . 51542 1 213 . 1 . 1 25 25 ALA HA H 1 4.127 0.005 . 1 . . . . . 485 ALA HA . 51542 1 214 . 1 . 1 25 25 ALA HB1 H 1 1.320 0.013 . 1 . . . . . 485 ALA HB1 . 51542 1 215 . 1 . 1 25 25 ALA HB2 H 1 1.320 0.013 . 1 . . . . . 485 ALA HB2 . 51542 1 216 . 1 . 1 25 25 ALA HB3 H 1 1.320 0.013 . 1 . . . . . 485 ALA HB3 . 51542 1 217 . 1 . 1 25 25 ALA C C 13 177.648 0.007 . 1 . . . . . 485 ALA C . 51542 1 218 . 1 . 1 25 25 ALA CA C 13 52.870 0.058 . 1 . . . . . 485 ALA CA . 51542 1 219 . 1 . 1 25 25 ALA CB C 13 18.882 0.042 . 1 . . . . . 485 ALA CB . 51542 1 220 . 1 . 1 25 25 ALA N N 15 124.932 0.058 . 1 . . . . . 485 ALA N . 51542 1 221 . 1 . 1 26 26 VAL H H 1 8.598 0.003 . 1 . . . . . 486 VAL H . 51542 1 222 . 1 . 1 26 26 VAL HA H 1 4.490 0.008 . 1 . . . . . 486 VAL HA . 51542 1 223 . 1 . 1 26 26 VAL HB H 1 2.047 0.008 . 1 . . . . . 486 VAL HB . 51542 1 224 . 1 . 1 26 26 VAL HG11 H 1 0.911 0.001 . 2 . . . . . 486 VAL HG11 . 51542 1 225 . 1 . 1 26 26 VAL HG12 H 1 0.911 0.001 . 2 . . . . . 486 VAL HG12 . 51542 1 226 . 1 . 1 26 26 VAL HG13 H 1 0.911 0.001 . 2 . . . . . 486 VAL HG13 . 51542 1 227 . 1 . 1 26 26 VAL HG21 H 1 0.996 0.002 . 2 . . . . . 486 VAL HG21 . 51542 1 228 . 1 . 1 26 26 VAL HG22 H 1 0.996 0.002 . 2 . . . . . 486 VAL HG22 . 51542 1 229 . 1 . 1 26 26 VAL HG23 H 1 0.996 0.002 . 2 . . . . . 486 VAL HG23 . 51542 1 230 . 1 . 1 26 26 VAL C C 13 175.364 0.042 . 1 . . . . . 486 VAL C . 51542 1 231 . 1 . 1 26 26 VAL CA C 13 61.992 0.060 . 1 . . . . . 486 VAL CA . 51542 1 232 . 1 . 1 26 26 VAL CB C 13 30.491 0.050 . 1 . . . . . 486 VAL CB . 51542 1 233 . 1 . 1 26 26 VAL CG1 C 13 21.006 0.200 . 2 . . . . . 486 VAL CG1 . 51542 1 234 . 1 . 1 26 26 VAL CG2 C 13 20.609 0.200 . 2 . . . . . 486 VAL CG2 . 51542 1 235 . 1 . 1 26 26 VAL N N 15 123.177 0.059 . 1 . . . . . 486 VAL N . 51542 1 236 . 1 . 1 27 27 GLN H H 1 7.787 0.003 . 1 . . . . . 487 GLN H . 51542 1 237 . 1 . 1 27 27 GLN HA H 1 4.806 0.003 . 1 . . . . . 487 GLN HA . 51542 1 238 . 1 . 1 27 27 GLN HB2 H 1 2.002 0.020 . 2 . . . . . 487 GLN HB2 . 51542 1 239 . 1 . 1 27 27 GLN HB3 H 1 1.899 0.020 . 2 . . . . . 487 GLN HB3 . 51542 1 240 . 1 . 1 27 27 GLN HG2 H 1 2.263 0.020 . 1 . . . . . 487 GLN HG2 . 51542 1 241 . 1 . 1 27 27 GLN HG3 H 1 2.263 0.020 . 1 . . . . . 487 GLN HG3 . 51542 1 242 . 1 . 1 27 27 GLN C C 13 171.113 0.200 . 1 . . . . . 487 GLN C . 51542 1 243 . 1 . 1 27 27 GLN CA C 13 52.855 0.141 . 1 . . . . . 487 GLN CA . 51542 1 244 . 1 . 1 27 27 GLN CB C 13 28.244 0.200 . 1 . . . . . 487 GLN CB . 51542 1 245 . 1 . 1 27 27 GLN N N 15 123.361 0.033 . 1 . . . . . 487 GLN N . 51542 1 246 . 1 . 1 28 28 PRO HA H 1 4.545 0.020 . 1 . . . . . 488 PRO HA . 51542 1 247 . 1 . 1 28 28 PRO HB2 H 1 1.821 0.020 . 2 . . . . . 488 PRO HB2 . 51542 1 248 . 1 . 1 28 28 PRO HB3 H 1 2.220 0.020 . 2 . . . . . 488 PRO HB3 . 51542 1 249 . 1 . 1 28 28 PRO HG2 H 1 1.922 0.020 . 1 . . . . . 488 PRO HG2 . 51542 1 250 . 1 . 1 28 28 PRO HG3 H 1 1.922 0.020 . 1 . . . . . 488 PRO HG3 . 51542 1 251 . 1 . 1 28 28 PRO C C 13 176.122 0.015 . 1 . . . . . 488 PRO C . 51542 1 252 . 1 . 1 28 28 PRO CA C 13 63.342 0.034 . 1 . . . . . 488 PRO CA . 51542 1 253 . 1 . 1 28 28 PRO CB C 13 32.338 0.200 . 1 . . . . . 488 PRO CB . 51542 1 254 . 1 . 1 29 29 ARG H H 1 7.367 0.003 . 1 . . . . . 489 ARG H . 51542 1 255 . 1 . 1 29 29 ARG HA H 1 4.357 0.007 . 1 . . . . . 489 ARG HA . 51542 1 256 . 1 . 1 29 29 ARG C C 13 173.266 0.020 . 1 . . . . . 489 ARG C . 51542 1 257 . 1 . 1 29 29 ARG CA C 13 55.038 0.004 . 1 . . . . . 489 ARG CA . 51542 1 258 . 1 . 1 29 29 ARG CB C 13 33.646 0.200 . 1 . . . . . 489 ARG CB . 51542 1 259 . 1 . 1 29 29 ARG N N 15 123.681 0.060 . 1 . . . . . 489 ARG N . 51542 1 260 . 1 . 1 30 30 TYR H H 1 9.509 0.004 . 1 . . . . . 490 TYR H . 51542 1 261 . 1 . 1 30 30 TYR HA H 1 5.030 0.007 . 1 . . . . . 490 TYR HA . 51542 1 262 . 1 . 1 30 30 TYR HB2 H 1 2.559 0.020 . 2 . . . . . 490 TYR HB2 . 51542 1 263 . 1 . 1 30 30 TYR HB3 H 1 3.163 0.020 . 2 . . . . . 490 TYR HB3 . 51542 1 264 . 1 . 1 30 30 TYR HD1 H 1 6.877 0.003 . 1 . . . . . 490 TYR HD1 . 51542 1 265 . 1 . 1 30 30 TYR HD2 H 1 6.877 0.003 . 1 . . . . . 490 TYR HD2 . 51542 1 266 . 1 . 1 30 30 TYR HE1 H 1 6.689 0.007 . 1 . . . . . 490 TYR HE1 . 51542 1 267 . 1 . 1 30 30 TYR HE2 H 1 6.689 0.007 . 1 . . . . . 490 TYR HE2 . 51542 1 268 . 1 . 1 30 30 TYR C C 13 175.825 0.200 . 1 . . . . . 490 TYR C . 51542 1 269 . 1 . 1 30 30 TYR CA C 13 56.122 0.072 . 1 . . . . . 490 TYR CA . 51542 1 270 . 1 . 1 30 30 TYR CB C 13 39.488 0.082 . 1 . . . . . 490 TYR CB . 51542 1 271 . 1 . 1 30 30 TYR CD1 C 13 133.734 0.200 . 1 . . . . . 490 TYR CD1 . 51542 1 272 . 1 . 1 30 30 TYR CD2 C 13 133.734 0.200 . 1 . . . . . 490 TYR CD2 . 51542 1 273 . 1 . 1 30 30 TYR CE1 C 13 117.553 0.200 . 1 . . . . . 490 TYR CE1 . 51542 1 274 . 1 . 1 30 30 TYR CE2 C 13 117.553 0.200 . 1 . . . . . 490 TYR CE2 . 51542 1 275 . 1 . 1 30 30 TYR N N 15 124.413 0.041 . 1 . . . . . 490 TYR N . 51542 1 276 . 1 . 1 31 31 PHE H H 1 9.451 0.003 . 1 . . . . . 491 PHE H . 51542 1 277 . 1 . 1 31 31 PHE HA H 1 5.511 0.002 . 1 . . . . . 491 PHE HA . 51542 1 278 . 1 . 1 31 31 PHE HB2 H 1 2.891 0.005 . 2 . . . . . 491 PHE HB2 . 51542 1 279 . 1 . 1 31 31 PHE HB3 H 1 2.600 0.008 . 2 . . . . . 491 PHE HB3 . 51542 1 280 . 1 . 1 31 31 PHE HD1 H 1 6.793 0.006 . 1 . . . . . 491 PHE HD1 . 51542 1 281 . 1 . 1 31 31 PHE HD2 H 1 6.793 0.006 . 1 . . . . . 491 PHE HD2 . 51542 1 282 . 1 . 1 31 31 PHE C C 13 175.174 0.014 . 1 . . . . . 491 PHE C . 51542 1 283 . 1 . 1 31 31 PHE CA C 13 58.007 0.063 . 1 . . . . . 491 PHE CA . 51542 1 284 . 1 . 1 31 31 PHE CB C 13 43.821 0.120 . 1 . . . . . 491 PHE CB . 51542 1 285 . 1 . 1 31 31 PHE N N 15 123.472 0.075 . 1 . . . . . 491 PHE N . 51542 1 286 . 1 . 1 32 32 ILE H H 1 8.728 0.002 . 1 . . . . . 492 ILE H . 51542 1 287 . 1 . 1 32 32 ILE HA H 1 4.868 0.007 . 1 . . . . . 492 ILE HA . 51542 1 288 . 1 . 1 32 32 ILE HB H 1 1.889 0.007 . 1 . . . . . 492 ILE HB . 51542 1 289 . 1 . 1 32 32 ILE HG12 H 1 1.403 0.003 . 2 . . . . . 492 ILE HG12 . 51542 1 290 . 1 . 1 32 32 ILE HG13 H 1 1.824 0.004 . 2 . . . . . 492 ILE HG13 . 51542 1 291 . 1 . 1 32 32 ILE HG21 H 1 0.926 0.004 . 1 . . . . . 492 ILE HG21 . 51542 1 292 . 1 . 1 32 32 ILE HG22 H 1 0.926 0.004 . 1 . . . . . 492 ILE HG22 . 51542 1 293 . 1 . 1 32 32 ILE HG23 H 1 0.926 0.004 . 1 . . . . . 492 ILE HG23 . 51542 1 294 . 1 . 1 32 32 ILE HD11 H 1 0.905 0.003 . 1 . . . . . 492 ILE HD11 . 51542 1 295 . 1 . 1 32 32 ILE HD12 H 1 0.905 0.003 . 1 . . . . . 492 ILE HD12 . 51542 1 296 . 1 . 1 32 32 ILE HD13 H 1 0.905 0.003 . 1 . . . . . 492 ILE HD13 . 51542 1 297 . 1 . 1 32 32 ILE C C 13 173.684 0.030 . 1 . . . . . 492 ILE C . 51542 1 298 . 1 . 1 32 32 ILE CA C 13 59.913 0.083 . 1 . . . . . 492 ILE CA . 51542 1 299 . 1 . 1 32 32 ILE CB C 13 42.840 0.088 . 1 . . . . . 492 ILE CB . 51542 1 300 . 1 . 1 32 32 ILE CG1 C 13 28.687 0.144 . 1 . . . . . 492 ILE CG1 . 51542 1 301 . 1 . 1 32 32 ILE CG2 C 13 18.215 0.064 . 1 . . . . . 492 ILE CG2 . 51542 1 302 . 1 . 1 32 32 ILE CD1 C 13 15.331 0.077 . 1 . . . . . 492 ILE CD1 . 51542 1 303 . 1 . 1 32 32 ILE N N 15 117.552 0.044 . 1 . . . . . 492 ILE N . 51542 1 304 . 1 . 1 33 33 THR H H 1 8.309 0.002 . 1 . . . . . 493 THR H . 51542 1 305 . 1 . 1 33 33 THR HA H 1 5.654 0.005 . 1 . . . . . 493 THR HA . 51542 1 306 . 1 . 1 33 33 THR HB H 1 4.139 0.003 . 1 . . . . . 493 THR HB . 51542 1 307 . 1 . 1 33 33 THR HG21 H 1 1.026 0.004 . 1 . . . . . 493 THR HG21 . 51542 1 308 . 1 . 1 33 33 THR HG22 H 1 1.026 0.004 . 1 . . . . . 493 THR HG22 . 51542 1 309 . 1 . 1 33 33 THR HG23 H 1 1.026 0.004 . 1 . . . . . 493 THR HG23 . 51542 1 310 . 1 . 1 33 33 THR C C 13 173.110 0.022 . 1 . . . . . 493 THR C . 51542 1 311 . 1 . 1 33 33 THR CA C 13 59.809 0.143 . 1 . . . . . 493 THR CA . 51542 1 312 . 1 . 1 33 33 THR CB C 13 71.419 0.089 . 1 . . . . . 493 THR CB . 51542 1 313 . 1 . 1 33 33 THR CG2 C 13 20.852 0.015 . 1 . . . . . 493 THR CG2 . 51542 1 314 . 1 . 1 33 33 THR N N 15 113.050 0.035 . 1 . . . . . 493 THR N . 51542 1 315 . 1 . 1 34 34 THR H H 1 8.704 0.002 . 1 . . . . . 494 THR H . 51542 1 316 . 1 . 1 34 34 THR HA H 1 4.952 0.006 . 1 . . . . . 494 THR HA . 51542 1 317 . 1 . 1 34 34 THR HB H 1 4.000 0.004 . 1 . . . . . 494 THR HB . 51542 1 318 . 1 . 1 34 34 THR HG21 H 1 0.944 0.001 . 1 . . . . . 494 THR HG21 . 51542 1 319 . 1 . 1 34 34 THR HG22 H 1 0.944 0.001 . 1 . . . . . 494 THR HG22 . 51542 1 320 . 1 . 1 34 34 THR HG23 H 1 0.944 0.001 . 1 . . . . . 494 THR HG23 . 51542 1 321 . 1 . 1 34 34 THR C C 13 171.360 0.029 . 1 . . . . . 494 THR C . 51542 1 322 . 1 . 1 34 34 THR CA C 13 59.982 0.067 . 1 . . . . . 494 THR CA . 51542 1 323 . 1 . 1 34 34 THR CB C 13 69.030 0.053 . 1 . . . . . 494 THR CB . 51542 1 324 . 1 . 1 34 34 THR CG2 C 13 19.716 0.045 . 1 . . . . . 494 THR CG2 . 51542 1 325 . 1 . 1 34 34 THR N N 15 113.986 0.030 . 1 . . . . . 494 THR N . 51542 1 326 . 1 . 1 35 35 SER H H 1 9.629 0.006 . 1 . . . . . 495 SER H . 51542 1 327 . 1 . 1 35 35 SER HA H 1 4.098 0.020 . 1 . . . . . 495 SER HA . 51542 1 328 . 1 . 1 35 35 SER HB2 H 1 4.212 0.006 . 1 . . . . . 495 SER HB2 . 51542 1 329 . 1 . 1 35 35 SER C C 13 173.449 0.016 . 1 . . . . . 495 SER C . 51542 1 330 . 1 . 1 35 35 SER CA C 13 59.302 0.059 . 1 . . . . . 495 SER CA . 51542 1 331 . 1 . 1 35 35 SER CB C 13 62.053 0.083 . 1 . . . . . 495 SER CB . 51542 1 332 . 1 . 1 35 35 SER N N 15 118.453 0.060 . 1 . . . . . 495 SER N . 51542 1 333 . 1 . 1 36 36 LEU H H 1 7.753 0.002 . 1 . . . . . 496 LEU H . 51542 1 334 . 1 . 1 36 36 LEU HA H 1 4.964 0.003 . 1 . . . . . 496 LEU HA . 51542 1 335 . 1 . 1 36 36 LEU HB2 H 1 1.641 0.028 . 2 . . . . . 496 LEU HB2 . 51542 1 336 . 1 . 1 36 36 LEU HB3 H 1 1.590 0.012 . 2 . . . . . 496 LEU HB3 . 51542 1 337 . 1 . 1 36 36 LEU HD11 H 1 0.715 0.008 . 1 . . . . . 496 LEU HD11 . 51542 1 338 . 1 . 1 36 36 LEU HD12 H 1 0.715 0.008 . 1 . . . . . 496 LEU HD12 . 51542 1 339 . 1 . 1 36 36 LEU HD13 H 1 0.715 0.008 . 1 . . . . . 496 LEU HD13 . 51542 1 340 . 1 . 1 36 36 LEU HD21 H 1 0.715 0.008 . 1 . . . . . 496 LEU HD21 . 51542 1 341 . 1 . 1 36 36 LEU HD22 H 1 0.715 0.008 . 1 . . . . . 496 LEU HD22 . 51542 1 342 . 1 . 1 36 36 LEU HD23 H 1 0.715 0.008 . 1 . . . . . 496 LEU HD23 . 51542 1 343 . 1 . 1 36 36 LEU C C 13 178.753 0.008 . 1 . . . . . 496 LEU C . 51542 1 344 . 1 . 1 36 36 LEU CA C 13 52.772 0.046 . 1 . . . . . 496 LEU CA . 51542 1 345 . 1 . 1 36 36 LEU CB C 13 45.033 0.133 . 1 . . . . . 496 LEU CB . 51542 1 346 . 1 . 1 36 36 LEU N N 15 116.644 0.029 . 1 . . . . . 496 LEU N . 51542 1 347 . 1 . 1 37 37 THR H H 1 9.106 0.003 . 1 . . . . . 497 THR H . 51542 1 348 . 1 . 1 37 37 THR HA H 1 4.358 0.002 . 1 . . . . . 497 THR HA . 51542 1 349 . 1 . 1 37 37 THR HB H 1 4.694 0.008 . 1 . . . . . 497 THR HB . 51542 1 350 . 1 . 1 37 37 THR HG21 H 1 1.403 0.004 . 1 . . . . . 497 THR HG21 . 51542 1 351 . 1 . 1 37 37 THR HG22 H 1 1.403 0.004 . 1 . . . . . 497 THR HG22 . 51542 1 352 . 1 . 1 37 37 THR HG23 H 1 1.403 0.004 . 1 . . . . . 497 THR HG23 . 51542 1 353 . 1 . 1 37 37 THR C C 13 174.842 0.011 . 1 . . . . . 497 THR C . 51542 1 354 . 1 . 1 37 37 THR CA C 13 61.542 0.008 . 1 . . . . . 497 THR CA . 51542 1 355 . 1 . 1 37 37 THR CB C 13 70.711 0.085 . 1 . . . . . 497 THR CB . 51542 1 356 . 1 . 1 37 37 THR CG2 C 13 22.055 0.081 . 1 . . . . . 497 THR CG2 . 51542 1 357 . 1 . 1 37 37 THR N N 15 113.918 0.056 . 1 . . . . . 497 THR N . 51542 1 358 . 1 . 1 38 38 GLU H H 1 8.903 0.003 . 1 . . . . . 498 GLU H . 51542 1 359 . 1 . 1 38 38 GLU HA H 1 3.930 0.004 . 1 . . . . . 498 GLU HA . 51542 1 360 . 1 . 1 38 38 GLU HB2 H 1 2.005 0.005 . 2 . . . . . 498 GLU HB2 . 51542 1 361 . 1 . 1 38 38 GLU HB3 H 1 2.098 0.006 . 2 . . . . . 498 GLU HB3 . 51542 1 362 . 1 . 1 38 38 GLU HG2 H 1 2.242 0.020 . 2 . . . . . 498 GLU HG2 . 51542 1 363 . 1 . 1 38 38 GLU HG3 H 1 2.313 0.020 . 2 . . . . . 498 GLU HG3 . 51542 1 364 . 1 . 1 38 38 GLU C C 13 178.479 0.006 . 1 . . . . . 498 GLU C . 51542 1 365 . 1 . 1 38 38 GLU CA C 13 60.313 0.069 . 1 . . . . . 498 GLU CA . 51542 1 366 . 1 . 1 38 38 GLU CB C 13 29.461 0.100 . 1 . . . . . 498 GLU CB . 51542 1 367 . 1 . 1 38 38 GLU CG C 13 36.133 0.154 . 1 . . . . . 498 GLU CG . 51542 1 368 . 1 . 1 38 38 GLU N N 15 122.512 0.079 . 1 . . . . . 498 GLU N . 51542 1 369 . 1 . 1 39 39 LYS H H 1 8.366 0.007 . 1 . . . . . 499 LYS H . 51542 1 370 . 1 . 1 39 39 LYS HA H 1 4.060 0.008 . 1 . . . . . 499 LYS HA . 51542 1 371 . 1 . 1 39 39 LYS HB2 H 1 1.836 0.020 . 2 . . . . . 499 LYS HB2 . 51542 1 372 . 1 . 1 39 39 LYS HB3 H 1 1.724 0.020 . 2 . . . . . 499 LYS HB3 . 51542 1 373 . 1 . 1 39 39 LYS HG2 H 1 1.485 0.020 . 2 . . . . . 499 LYS HG2 . 51542 1 374 . 1 . 1 39 39 LYS HG3 H 1 1.380 0.020 . 2 . . . . . 499 LYS HG3 . 51542 1 375 . 1 . 1 39 39 LYS C C 13 179.419 0.019 . 1 . . . . . 499 LYS C . 51542 1 376 . 1 . 1 39 39 LYS CA C 13 59.527 0.062 . 1 . . . . . 499 LYS CA . 51542 1 377 . 1 . 1 39 39 LYS CB C 13 32.759 0.025 . 1 . . . . . 499 LYS CB . 51542 1 378 . 1 . 1 39 39 LYS CG C 13 24.990 0.200 . 1 . . . . . 499 LYS CG . 51542 1 379 . 1 . 1 39 39 LYS N N 15 117.336 0.076 . 1 . . . . . 499 LYS N . 51542 1 380 . 1 . 1 40 40 GLU H H 1 7.837 0.002 . 1 . . . . . 500 GLU H . 51542 1 381 . 1 . 1 40 40 GLU HA H 1 4.193 0.006 . 1 . . . . . 500 GLU HA . 51542 1 382 . 1 . 1 40 40 GLU HB2 H 1 2.091 0.003 . 2 . . . . . 500 GLU HB2 . 51542 1 383 . 1 . 1 40 40 GLU HB3 H 1 2.091 0.003 . 2 . . . . . 500 GLU HB3 . 51542 1 384 . 1 . 1 40 40 GLU HG2 H 1 2.333 0.022 . 2 . . . . . 500 GLU HG2 . 51542 1 385 . 1 . 1 40 40 GLU HG3 H 1 2.382 0.015 . 2 . . . . . 500 GLU HG3 . 51542 1 386 . 1 . 1 40 40 GLU C C 13 178.315 0.035 . 1 . . . . . 500 GLU C . 51542 1 387 . 1 . 1 40 40 GLU CA C 13 59.828 0.037 . 1 . . . . . 500 GLU CA . 51542 1 388 . 1 . 1 40 40 GLU CB C 13 29.989 0.152 . 1 . . . . . 500 GLU CB . 51542 1 389 . 1 . 1 40 40 GLU CG C 13 38.635 0.064 . 1 . . . . . 500 GLU CG . 51542 1 390 . 1 . 1 40 40 GLU N N 15 120.697 0.040 . 1 . . . . . 500 GLU N . 51542 1 391 . 1 . 1 41 41 ARG H H 1 9.237 0.003 . 1 . . . . . 501 ARG H . 51542 1 392 . 1 . 1 41 41 ARG C C 13 178.280 0.013 . 1 . . . . . 501 ARG C . 51542 1 393 . 1 . 1 41 41 ARG CA C 13 60.536 0.065 . 1 . . . . . 501 ARG CA . 51542 1 394 . 1 . 1 41 41 ARG CB C 13 29.803 0.200 . 1 . . . . . 501 ARG CB . 51542 1 395 . 1 . 1 41 41 ARG N N 15 121.225 0.058 . 1 . . . . . 501 ARG N . 51542 1 396 . 1 . 1 42 42 ASN H H 1 8.350 0.004 . 1 . . . . . 502 ASN H . 51542 1 397 . 1 . 1 42 42 ASN HA H 1 4.480 0.004 . 1 . . . . . 502 ASN HA . 51542 1 398 . 1 . 1 42 42 ASN HB2 H 1 2.909 0.002 . 2 . . . . . 502 ASN HB2 . 51542 1 399 . 1 . 1 42 42 ASN HB3 H 1 2.846 0.003 . 2 . . . . . 502 ASN HB3 . 51542 1 400 . 1 . 1 42 42 ASN HD21 H 1 7.054 0.002 . 1 . . . . . 502 ASN HD21 . 51542 1 401 . 1 . 1 42 42 ASN HD22 H 1 7.628 0.020 . 1 . . . . . 502 ASN HD22 . 51542 1 402 . 1 . 1 42 42 ASN C C 13 177.828 0.057 . 1 . . . . . 502 ASN C . 51542 1 403 . 1 . 1 42 42 ASN CA C 13 56.606 0.068 . 1 . . . . . 502 ASN CA . 51542 1 404 . 1 . 1 42 42 ASN CB C 13 37.882 0.003 . 1 . . . . . 502 ASN CB . 51542 1 405 . 1 . 1 42 42 ASN N N 15 117.504 0.068 . 1 . . . . . 502 ASN N . 51542 1 406 . 1 . 1 42 42 ASN ND2 N 15 112.518 0.001 . 1 . . . . . 502 ASN ND2 . 51542 1 407 . 1 . 1 43 43 SER H H 1 8.103 0.005 . 1 . . . . . 503 SER H . 51542 1 408 . 1 . 1 43 43 SER HA H 1 4.337 0.020 . 1 . . . . . 503 SER HA . 51542 1 409 . 1 . 1 43 43 SER HB2 H 1 4.073 0.020 . 2 . . . . . 503 SER HB2 . 51542 1 410 . 1 . 1 43 43 SER HB3 H 1 4.179 0.020 . 2 . . . . . 503 SER HB3 . 51542 1 411 . 1 . 1 43 43 SER C C 13 177.656 0.200 . 1 . . . . . 503 SER C . 51542 1 412 . 1 . 1 43 43 SER CA C 13 62.379 0.036 . 1 . . . . . 503 SER CA . 51542 1 413 . 1 . 1 43 43 SER CB C 13 63.046 0.200 . 1 . . . . . 503 SER CB . 51542 1 414 . 1 . 1 43 43 SER N N 15 116.730 0.063 . 1 . . . . . 503 SER N . 51542 1 415 . 1 . 1 44 44 VAL H H 1 8.887 0.005 . 1 . . . . . 504 VAL H . 51542 1 416 . 1 . 1 44 44 VAL HA H 1 3.466 0.007 . 1 . . . . . 504 VAL HA . 51542 1 417 . 1 . 1 44 44 VAL HB H 1 2.269 0.003 . 1 . . . . . 504 VAL HB . 51542 1 418 . 1 . 1 44 44 VAL HG11 H 1 0.705 0.012 . 2 . . . . . 504 VAL HG11 . 51542 1 419 . 1 . 1 44 44 VAL HG12 H 1 0.705 0.012 . 2 . . . . . 504 VAL HG12 . 51542 1 420 . 1 . 1 44 44 VAL HG13 H 1 0.705 0.012 . 2 . . . . . 504 VAL HG13 . 51542 1 421 . 1 . 1 44 44 VAL HG21 H 1 0.892 0.001 . 2 . . . . . 504 VAL HG21 . 51542 1 422 . 1 . 1 44 44 VAL HG22 H 1 0.892 0.001 . 2 . . . . . 504 VAL HG22 . 51542 1 423 . 1 . 1 44 44 VAL HG23 H 1 0.892 0.001 . 2 . . . . . 504 VAL HG23 . 51542 1 424 . 1 . 1 44 44 VAL C C 13 176.785 0.027 . 1 . . . . . 504 VAL C . 51542 1 425 . 1 . 1 44 44 VAL CA C 13 66.893 0.045 . 1 . . . . . 504 VAL CA . 51542 1 426 . 1 . 1 44 44 VAL CB C 13 31.692 0.107 . 1 . . . . . 504 VAL CB . 51542 1 427 . 1 . 1 44 44 VAL CG1 C 13 22.145 0.146 . 2 . . . . . 504 VAL CG1 . 51542 1 428 . 1 . 1 44 44 VAL CG2 C 13 24.310 0.200 . 2 . . . . . 504 VAL CG2 . 51542 1 429 . 1 . 1 44 44 VAL N N 15 124.401 0.034 . 1 . . . . . 504 VAL N . 51542 1 430 . 1 . 1 45 45 MET H H 1 8.576 0.005 . 1 . . . . . 505 MET H . 51542 1 431 . 1 . 1 45 45 MET HA H 1 3.767 0.008 . 1 . . . . . 505 MET HA . 51542 1 432 . 1 . 1 45 45 MET HB2 H 1 2.205 0.004 . 2 . . . . . 505 MET HB2 . 51542 1 433 . 1 . 1 45 45 MET HB3 H 1 2.153 0.005 . 2 . . . . . 505 MET HB3 . 51542 1 434 . 1 . 1 45 45 MET HG2 H 1 2.300 0.008 . 2 . . . . . 505 MET HG2 . 51542 1 435 . 1 . 1 45 45 MET HG3 H 1 2.805 0.005 . 2 . . . . . 505 MET HG3 . 51542 1 436 . 1 . 1 45 45 MET HE1 H 1 2.118 0.002 . 1 . . . . . 505 MET HE1 . 51542 1 437 . 1 . 1 45 45 MET HE2 H 1 2.118 0.002 . 1 . . . . . 505 MET HE2 . 51542 1 438 . 1 . 1 45 45 MET HE3 H 1 2.118 0.002 . 1 . . . . . 505 MET HE3 . 51542 1 439 . 1 . 1 45 45 MET C C 13 178.102 0.016 . 1 . . . . . 505 MET C . 51542 1 440 . 1 . 1 45 45 MET CA C 13 60.479 0.104 . 1 . . . . . 505 MET CA . 51542 1 441 . 1 . 1 45 45 MET CB C 13 32.699 0.081 . 1 . . . . . 505 MET CB . 51542 1 442 . 1 . 1 45 45 MET CG C 13 31.510 0.051 . 1 . . . . . 505 MET CG . 51542 1 443 . 1 . 1 45 45 MET CE C 13 16.888 0.012 . 1 . . . . . 505 MET CE . 51542 1 444 . 1 . 1 45 45 MET N N 15 119.206 0.038 . 1 . . . . . 505 MET N . 51542 1 445 . 1 . 1 46 46 GLU H H 1 8.228 0.003 . 1 . . . . . 506 GLU H . 51542 1 446 . 1 . 1 46 46 GLU HA H 1 3.962 0.020 . 1 . . . . . 506 GLU HA . 51542 1 447 . 1 . 1 46 46 GLU HB2 H 1 2.133 0.020 . 2 . . . . . 506 GLU HB2 . 51542 1 448 . 1 . 1 46 46 GLU HB3 H 1 2.016 0.020 . 2 . . . . . 506 GLU HB3 . 51542 1 449 . 1 . 1 46 46 GLU HG2 H 1 2.423 0.020 . 2 . . . . . 506 GLU HG2 . 51542 1 450 . 1 . 1 46 46 GLU HG3 H 1 2.289 0.020 . 2 . . . . . 506 GLU HG3 . 51542 1 451 . 1 . 1 46 46 GLU C C 13 178.636 0.044 . 1 . . . . . 506 GLU C . 51542 1 452 . 1 . 1 46 46 GLU CA C 13 59.330 0.026 . 1 . . . . . 506 GLU CA . 51542 1 453 . 1 . 1 46 46 GLU CB C 13 29.777 0.032 . 1 . . . . . 506 GLU CB . 51542 1 454 . 1 . 1 46 46 GLU CG C 13 36.591 0.200 . 1 . . . . . 506 GLU CG . 51542 1 455 . 1 . 1 46 46 GLU N N 15 118.338 0.070 . 1 . . . . . 506 GLU N . 51542 1 456 . 1 . 1 47 47 ALA H H 1 7.846 0.002 . 1 . . . . . 507 ALA H . 51542 1 457 . 1 . 1 47 47 ALA HA H 1 4.026 0.002 . 1 . . . . . 507 ALA HA . 51542 1 458 . 1 . 1 47 47 ALA HB1 H 1 1.366 0.006 . 1 . . . . . 507 ALA HB1 . 51542 1 459 . 1 . 1 47 47 ALA HB2 H 1 1.366 0.006 . 1 . . . . . 507 ALA HB2 . 51542 1 460 . 1 . 1 47 47 ALA HB3 H 1 1.366 0.006 . 1 . . . . . 507 ALA HB3 . 51542 1 461 . 1 . 1 47 47 ALA C C 13 178.731 0.026 . 1 . . . . . 507 ALA C . 51542 1 462 . 1 . 1 47 47 ALA CA C 13 55.274 0.097 . 1 . . . . . 507 ALA CA . 51542 1 463 . 1 . 1 47 47 ALA CB C 13 19.522 0.067 . 1 . . . . . 507 ALA CB . 51542 1 464 . 1 . 1 47 47 ALA N N 15 121.866 0.055 . 1 . . . . . 507 ALA N . 51542 1 465 . 1 . 1 48 48 ILE H H 1 8.015 0.002 . 1 . . . . . 508 ILE H . 51542 1 466 . 1 . 1 48 48 ILE HA H 1 3.480 0.003 . 1 . . . . . 508 ILE HA . 51542 1 467 . 1 . 1 48 48 ILE HB H 1 1.682 0.005 . 1 . . . . . 508 ILE HB . 51542 1 468 . 1 . 1 48 48 ILE HG12 H 1 1.702 0.020 . 2 . . . . . 508 ILE HG12 . 51542 1 469 . 1 . 1 48 48 ILE HG13 H 1 0.251 0.020 . 2 . . . . . 508 ILE HG13 . 51542 1 470 . 1 . 1 48 48 ILE HG21 H 1 0.635 0.002 . 1 . . . . . 508 ILE HG21 . 51542 1 471 . 1 . 1 48 48 ILE HG22 H 1 0.635 0.002 . 1 . . . . . 508 ILE HG22 . 51542 1 472 . 1 . 1 48 48 ILE HG23 H 1 0.635 0.002 . 1 . . . . . 508 ILE HG23 . 51542 1 473 . 1 . 1 48 48 ILE HD11 H 1 0.124 0.001 . 1 . . . . . 508 ILE HD11 . 51542 1 474 . 1 . 1 48 48 ILE HD12 H 1 0.124 0.001 . 1 . . . . . 508 ILE HD12 . 51542 1 475 . 1 . 1 48 48 ILE HD13 H 1 0.124 0.001 . 1 . . . . . 508 ILE HD13 . 51542 1 476 . 1 . 1 48 48 ILE C C 13 178.166 0.020 . 1 . . . . . 508 ILE C . 51542 1 477 . 1 . 1 48 48 ILE CA C 13 66.331 0.086 . 1 . . . . . 508 ILE CA . 51542 1 478 . 1 . 1 48 48 ILE CB C 13 38.528 0.107 . 1 . . . . . 508 ILE CB . 51542 1 479 . 1 . 1 48 48 ILE CG1 C 13 30.430 0.064 . 1 . . . . . 508 ILE CG1 . 51542 1 480 . 1 . 1 48 48 ILE CG2 C 13 16.759 0.060 . 1 . . . . . 508 ILE CG2 . 51542 1 481 . 1 . 1 48 48 ILE CD1 C 13 15.127 0.034 . 1 . . . . . 508 ILE CD1 . 51542 1 482 . 1 . 1 48 48 ILE N N 15 117.277 0.096 . 1 . . . . . 508 ILE N . 51542 1 483 . 1 . 1 49 49 GLN H H 1 7.729 0.003 . 1 . . . . . 509 GLN H . 51542 1 484 . 1 . 1 49 49 GLN HA H 1 4.035 0.002 . 1 . . . . . 509 GLN HA . 51542 1 485 . 1 . 1 49 49 GLN HB2 H 1 2.164 0.003 . 2 . . . . . 509 GLN HB2 . 51542 1 486 . 1 . 1 49 49 GLN HB3 H 1 2.075 0.003 . 2 . . . . . 509 GLN HB3 . 51542 1 487 . 1 . 1 49 49 GLN HG2 H 1 2.547 0.004 . 2 . . . . . 509 GLN HG2 . 51542 1 488 . 1 . 1 49 49 GLN HG3 H 1 2.353 0.007 . 2 . . . . . 509 GLN HG3 . 51542 1 489 . 1 . 1 49 49 GLN HE21 H 1 6.855 0.003 . 1 . . . . . 509 GLN HE21 . 51542 1 490 . 1 . 1 49 49 GLN HE22 H 1 7.287 0.002 . 1 . . . . . 509 GLN HE22 . 51542 1 491 . 1 . 1 49 49 GLN C C 13 178.189 0.005 . 1 . . . . . 509 GLN C . 51542 1 492 . 1 . 1 49 49 GLN CA C 13 58.476 0.065 . 1 . . . . . 509 GLN CA . 51542 1 493 . 1 . 1 49 49 GLN CB C 13 28.762 0.068 . 1 . . . . . 509 GLN CB . 51542 1 494 . 1 . 1 49 49 GLN CG C 13 34.376 0.101 . 1 . . . . . 509 GLN CG . 51542 1 495 . 1 . 1 49 49 GLN N N 15 116.958 0.051 . 1 . . . . . 509 GLN N . 51542 1 496 . 1 . 1 49 49 GLN NE2 N 15 110.907 0.001 . 1 . . . . . 509 GLN NE2 . 51542 1 497 . 1 . 1 50 50 LYS H H 1 8.142 0.003 . 1 . . . . . 510 LYS H . 51542 1 498 . 1 . 1 50 50 LYS HA H 1 3.935 0.005 . 1 . . . . . 510 LYS HA . 51542 1 499 . 1 . 1 50 50 LYS HB2 H 1 1.795 0.001 . 2 . . . . . 510 LYS HB2 . 51542 1 500 . 1 . 1 50 50 LYS HB3 H 1 1.728 0.001 . 2 . . . . . 510 LYS HB3 . 51542 1 501 . 1 . 1 50 50 LYS HG2 H 1 1.330 0.020 . 2 . . . . . 510 LYS HG2 . 51542 1 502 . 1 . 1 50 50 LYS HG3 H 1 1.476 0.001 . 2 . . . . . 510 LYS HG3 . 51542 1 503 . 1 . 1 50 50 LYS C C 13 178.413 0.019 . 1 . . . . . 510 LYS C . 51542 1 504 . 1 . 1 50 50 LYS CA C 13 58.625 0.055 . 1 . . . . . 510 LYS CA . 51542 1 505 . 1 . 1 50 50 LYS CB C 13 32.893 0.200 . 1 . . . . . 510 LYS CB . 51542 1 506 . 1 . 1 50 50 LYS CG C 13 25.589 0.200 . 1 . . . . . 510 LYS CG . 51542 1 507 . 1 . 1 50 50 LYS N N 15 119.172 0.058 . 1 . . . . . 510 LYS N . 51542 1 508 . 1 . 1 51 51 LEU H H 1 8.096 0.002 . 1 . . . . . 511 LEU H . 51542 1 509 . 1 . 1 51 51 LEU HA H 1 3.871 0.008 . 1 . . . . . 511 LEU HA . 51542 1 510 . 1 . 1 51 51 LEU HB2 H 1 0.910 0.009 . 2 . . . . . 511 LEU HB2 . 51542 1 511 . 1 . 1 51 51 LEU HB3 H 1 1.295 0.003 . 2 . . . . . 511 LEU HB3 . 51542 1 512 . 1 . 1 51 51 LEU HG H 1 0.586 0.001 . 1 . . . . . 511 LEU HG . 51542 1 513 . 1 . 1 51 51 LEU HD11 H 1 -1.212 0.012 . 2 . . . . . 511 LEU HD11 . 51542 1 514 . 1 . 1 51 51 LEU HD12 H 1 -1.212 0.012 . 2 . . . . . 511 LEU HD12 . 51542 1 515 . 1 . 1 51 51 LEU HD13 H 1 -1.212 0.012 . 2 . . . . . 511 LEU HD13 . 51542 1 516 . 1 . 1 51 51 LEU HD21 H 1 0.078 0.004 . 2 . . . . . 511 LEU HD21 . 51542 1 517 . 1 . 1 51 51 LEU HD22 H 1 0.078 0.004 . 2 . . . . . 511 LEU HD22 . 51542 1 518 . 1 . 1 51 51 LEU HD23 H 1 0.078 0.004 . 2 . . . . . 511 LEU HD23 . 51542 1 519 . 1 . 1 51 51 LEU C C 13 178.167 0.006 . 1 . . . . . 511 LEU C . 51542 1 520 . 1 . 1 51 51 LEU CA C 13 56.998 0.139 . 1 . . . . . 511 LEU CA . 51542 1 521 . 1 . 1 51 51 LEU CB C 13 41.546 0.087 . 1 . . . . . 511 LEU CB . 51542 1 522 . 1 . 1 51 51 LEU CG C 13 26.616 0.059 . 1 . . . . . 511 LEU CG . 51542 1 523 . 1 . 1 51 51 LEU CD1 C 13 23.330 0.080 . 2 . . . . . 511 LEU CD1 . 51542 1 524 . 1 . 1 51 51 LEU CD2 C 13 22.738 0.090 . 2 . . . . . 511 LEU CD2 . 51542 1 525 . 1 . 1 51 51 LEU N N 15 120.801 0.059 . 1 . . . . . 511 LEU N . 51542 1 526 . 1 . 1 52 52 GLY H H 1 8.156 0.002 . 1 . . . . . 512 GLY H . 51542 1 527 . 1 . 1 52 52 GLY HA2 H 1 3.731 0.020 . 1 . . . . . 512 GLY HA2 . 51542 1 528 . 1 . 1 52 52 GLY HA3 H 1 3.731 0.020 . 1 . . . . . 512 GLY HA3 . 51542 1 529 . 1 . 1 52 52 GLY C C 13 175.509 0.004 . 1 . . . . . 512 GLY C . 51542 1 530 . 1 . 1 52 52 GLY CA C 13 47.566 0.058 . 1 . . . . . 512 GLY CA . 51542 1 531 . 1 . 1 52 52 GLY N N 15 105.045 0.050 . 1 . . . . . 512 GLY N . 51542 1 532 . 1 . 1 53 53 GLN H H 1 9.512 0.003 . 1 . . . . . 513 GLN H . 51542 1 533 . 1 . 1 53 53 GLN HA H 1 3.968 0.004 . 1 . . . . . 513 GLN HA . 51542 1 534 . 1 . 1 53 53 GLN HB2 H 1 2.074 0.002 . 2 . . . . . 513 GLN HB2 . 51542 1 535 . 1 . 1 53 53 GLN HB3 H 1 2.386 0.010 . 2 . . . . . 513 GLN HB3 . 51542 1 536 . 1 . 1 53 53 GLN HG2 H 1 2.372 0.004 . 2 . . . . . 513 GLN HG2 . 51542 1 537 . 1 . 1 53 53 GLN HG3 H 1 2.668 0.003 . 2 . . . . . 513 GLN HG3 . 51542 1 538 . 1 . 1 53 53 GLN HE21 H 1 7.149 0.002 . 1 . . . . . 513 GLN HE21 . 51542 1 539 . 1 . 1 53 53 GLN HE22 H 1 7.538 0.003 . 1 . . . . . 513 GLN HE22 . 51542 1 540 . 1 . 1 53 53 GLN C C 13 175.987 0.023 . 1 . . . . . 513 GLN C . 51542 1 541 . 1 . 1 53 53 GLN CA C 13 57.471 0.012 . 1 . . . . . 513 GLN CA . 51542 1 542 . 1 . 1 53 53 GLN CB C 13 26.645 0.093 . 1 . . . . . 513 GLN CB . 51542 1 543 . 1 . 1 53 53 GLN CG C 13 33.870 0.129 . 1 . . . . . 513 GLN CG . 51542 1 544 . 1 . 1 53 53 GLN N N 15 127.105 0.082 . 1 . . . . . 513 GLN N . 51542 1 545 . 1 . 1 53 53 GLN NE2 N 15 112.758 0.044 . 1 . . . . . 513 GLN NE2 . 51542 1 546 . 1 . 1 54 54 ARG H H 1 8.674 0.002 . 1 . . . . . 514 ARG H . 51542 1 547 . 1 . 1 54 54 ARG HA H 1 3.712 0.007 . 1 . . . . . 514 ARG HA . 51542 1 548 . 1 . 1 54 54 ARG C C 13 174.514 0.013 . 1 . . . . . 514 ARG C . 51542 1 549 . 1 . 1 54 54 ARG CA C 13 57.488 0.050 . 1 . . . . . 514 ARG CA . 51542 1 550 . 1 . 1 54 54 ARG CB C 13 26.947 0.200 . 1 . . . . . 514 ARG CB . 51542 1 551 . 1 . 1 54 54 ARG N N 15 109.260 0.071 . 1 . . . . . 514 ARG N . 51542 1 552 . 1 . 1 55 55 ALA H H 1 7.572 0.001 . 1 . . . . . 515 ALA H . 51542 1 553 . 1 . 1 55 55 ALA HA H 1 5.258 0.004 . 1 . . . . . 515 ALA HA . 51542 1 554 . 1 . 1 55 55 ALA HB1 H 1 1.475 0.007 . 1 . . . . . 515 ALA HB1 . 51542 1 555 . 1 . 1 55 55 ALA HB2 H 1 1.475 0.007 . 1 . . . . . 515 ALA HB2 . 51542 1 556 . 1 . 1 55 55 ALA HB3 H 1 1.475 0.007 . 1 . . . . . 515 ALA HB3 . 51542 1 557 . 1 . 1 55 55 ALA C C 13 177.508 0.035 . 1 . . . . . 515 ALA C . 51542 1 558 . 1 . 1 55 55 ALA CA C 13 50.857 0.071 . 1 . . . . . 515 ALA CA . 51542 1 559 . 1 . 1 55 55 ALA CB C 13 22.873 0.061 . 1 . . . . . 515 ALA CB . 51542 1 560 . 1 . 1 55 55 ALA N N 15 123.407 0.077 . 1 . . . . . 515 ALA N . 51542 1 561 . 1 . 1 56 56 VAL H H 1 8.724 0.005 . 1 . . . . . 516 VAL H . 51542 1 562 . 1 . 1 56 56 VAL HA H 1 4.334 0.006 . 1 . . . . . 516 VAL HA . 51542 1 563 . 1 . 1 56 56 VAL HB H 1 1.941 0.007 . 1 . . . . . 516 VAL HB . 51542 1 564 . 1 . 1 56 56 VAL HG11 H 1 0.704 0.008 . 2 . . . . . 516 VAL HG11 . 51542 1 565 . 1 . 1 56 56 VAL HG12 H 1 0.704 0.008 . 2 . . . . . 516 VAL HG12 . 51542 1 566 . 1 . 1 56 56 VAL HG13 H 1 0.704 0.008 . 2 . . . . . 516 VAL HG13 . 51542 1 567 . 1 . 1 56 56 VAL HG21 H 1 0.882 0.005 . 2 . . . . . 516 VAL HG21 . 51542 1 568 . 1 . 1 56 56 VAL HG22 H 1 0.882 0.005 . 2 . . . . . 516 VAL HG22 . 51542 1 569 . 1 . 1 56 56 VAL HG23 H 1 0.882 0.005 . 2 . . . . . 516 VAL HG23 . 51542 1 570 . 1 . 1 56 56 VAL C C 13 174.250 0.023 . 1 . . . . . 516 VAL C . 51542 1 571 . 1 . 1 56 56 VAL CA C 13 60.286 0.093 . 1 . . . . . 516 VAL CA . 51542 1 572 . 1 . 1 56 56 VAL CB C 13 36.588 0.085 . 1 . . . . . 516 VAL CB . 51542 1 573 . 1 . 1 56 56 VAL CG1 C 13 20.658 0.077 . 2 . . . . . 516 VAL CG1 . 51542 1 574 . 1 . 1 56 56 VAL CG2 C 13 21.583 0.033 . 2 . . . . . 516 VAL CG2 . 51542 1 575 . 1 . 1 56 56 VAL N N 15 119.440 0.060 . 1 . . . . . 516 VAL N . 51542 1 576 . 1 . 1 57 57 LEU H H 1 8.746 0.002 . 1 . . . . . 517 LEU H . 51542 1 577 . 1 . 1 57 57 LEU HA H 1 5.088 0.005 . 1 . . . . . 517 LEU HA . 51542 1 578 . 1 . 1 57 57 LEU HB2 H 1 1.542 0.008 . 2 . . . . . 517 LEU HB2 . 51542 1 579 . 1 . 1 57 57 LEU HB3 H 1 1.803 0.009 . 2 . . . . . 517 LEU HB3 . 51542 1 580 . 1 . 1 57 57 LEU HG H 1 1.633 0.020 . 1 . . . . . 517 LEU HG . 51542 1 581 . 1 . 1 57 57 LEU HD11 H 1 0.940 0.005 . 1 . . . . . 517 LEU HD11 . 51542 1 582 . 1 . 1 57 57 LEU HD12 H 1 0.940 0.005 . 1 . . . . . 517 LEU HD12 . 51542 1 583 . 1 . 1 57 57 LEU HD13 H 1 0.940 0.005 . 1 . . . . . 517 LEU HD13 . 51542 1 584 . 1 . 1 57 57 LEU HD21 H 1 0.940 0.005 . 1 . . . . . 517 LEU HD21 . 51542 1 585 . 1 . 1 57 57 LEU HD22 H 1 0.940 0.005 . 1 . . . . . 517 LEU HD22 . 51542 1 586 . 1 . 1 57 57 LEU HD23 H 1 0.940 0.005 . 1 . . . . . 517 LEU HD23 . 51542 1 587 . 1 . 1 57 57 LEU C C 13 176.909 0.011 . 1 . . . . . 517 LEU C . 51542 1 588 . 1 . 1 57 57 LEU CA C 13 54.124 0.079 . 1 . . . . . 517 LEU CA . 51542 1 589 . 1 . 1 57 57 LEU CB C 13 42.731 0.061 . 1 . . . . . 517 LEU CB . 51542 1 590 . 1 . 1 57 57 LEU CG C 13 27.447 0.200 . 1 . . . . . 517 LEU CG . 51542 1 591 . 1 . 1 57 57 LEU CD1 C 13 25.113 0.200 . 1 . . . . . 517 LEU CD1 . 51542 1 592 . 1 . 1 57 57 LEU CD2 C 13 25.113 0.200 . 1 . . . . . 517 LEU CD2 . 51542 1 593 . 1 . 1 57 57 LEU N N 15 126.030 0.081 . 1 . . . . . 517 LEU N . 51542 1 594 . 1 . 1 58 58 VAL H H 1 9.035 0.003 . 1 . . . . . 518 VAL H . 51542 1 595 . 1 . 1 58 58 VAL HA H 1 4.482 0.005 . 1 . . . . . 518 VAL HA . 51542 1 596 . 1 . 1 58 58 VAL HB H 1 2.180 0.006 . 1 . . . . . 518 VAL HB . 51542 1 597 . 1 . 1 58 58 VAL HG11 H 1 1.047 0.002 . 2 . . . . . 518 VAL HG11 . 51542 1 598 . 1 . 1 58 58 VAL HG12 H 1 1.047 0.002 . 2 . . . . . 518 VAL HG12 . 51542 1 599 . 1 . 1 58 58 VAL HG13 H 1 1.047 0.002 . 2 . . . . . 518 VAL HG13 . 51542 1 600 . 1 . 1 58 58 VAL HG21 H 1 0.920 0.020 . 2 . . . . . 518 VAL HG21 . 51542 1 601 . 1 . 1 58 58 VAL HG22 H 1 0.920 0.020 . 2 . . . . . 518 VAL HG22 . 51542 1 602 . 1 . 1 58 58 VAL HG23 H 1 0.920 0.020 . 2 . . . . . 518 VAL HG23 . 51542 1 603 . 1 . 1 58 58 VAL C C 13 174.168 0.003 . 1 . . . . . 518 VAL C . 51542 1 604 . 1 . 1 58 58 VAL CA C 13 60.599 0.081 . 1 . . . . . 518 VAL CA . 51542 1 605 . 1 . 1 58 58 VAL CB C 13 33.625 0.064 . 1 . . . . . 518 VAL CB . 51542 1 606 . 1 . 1 58 58 VAL CG1 C 13 22.990 0.029 . 2 . . . . . 518 VAL CG1 . 51542 1 607 . 1 . 1 58 58 VAL CG2 C 13 20.139 0.014 . 2 . . . . . 518 VAL CG2 . 51542 1 608 . 1 . 1 58 58 VAL N N 15 122.042 0.052 . 1 . . . . . 518 VAL N . 51542 1 609 . 1 . 1 59 59 ASP H H 1 8.217 0.002 . 1 . . . . . 519 ASP H . 51542 1 610 . 1 . 1 59 59 ASP HA H 1 4.796 0.020 . 1 . . . . . 519 ASP HA . 51542 1 611 . 1 . 1 59 59 ASP HB2 H 1 2.639 0.003 . 2 . . . . . 519 ASP HB2 . 51542 1 612 . 1 . 1 59 59 ASP HB3 H 1 2.522 0.005 . 2 . . . . . 519 ASP HB3 . 51542 1 613 . 1 . 1 59 59 ASP C C 13 175.503 0.054 . 1 . . . . . 519 ASP C . 51542 1 614 . 1 . 1 59 59 ASP CA C 13 53.564 0.017 . 1 . . . . . 519 ASP CA . 51542 1 615 . 1 . 1 59 59 ASP CB C 13 42.708 0.170 . 1 . . . . . 519 ASP CB . 51542 1 616 . 1 . 1 59 59 ASP N N 15 121.432 0.079 . 1 . . . . . 519 ASP N . 51542 1 617 . 1 . 1 60 60 ASN H H 1 8.558 0.002 . 1 . . . . . 520 ASN H . 51542 1 618 . 1 . 1 60 60 ASN HA H 1 4.622 0.013 . 1 . . . . . 520 ASN HA . 51542 1 619 . 1 . 1 60 60 ASN HB2 H 1 2.656 0.004 . 2 . . . . . 520 ASN HB2 . 51542 1 620 . 1 . 1 60 60 ASN HB3 H 1 2.657 0.004 . 2 . . . . . 520 ASN HB3 . 51542 1 621 . 1 . 1 60 60 ASN HD21 H 1 6.781 0.020 . 1 . . . . . 520 ASN HD21 . 51542 1 622 . 1 . 1 60 60 ASN HD22 H 1 7.436 0.020 . 1 . . . . . 520 ASN HD22 . 51542 1 623 . 1 . 1 60 60 ASN C C 13 175.631 0.012 . 1 . . . . . 520 ASN C . 51542 1 624 . 1 . 1 60 60 ASN CA C 13 53.602 0.038 . 1 . . . . . 520 ASN CA . 51542 1 625 . 1 . 1 60 60 ASN CB C 13 39.416 0.057 . 1 . . . . . 520 ASN CB . 51542 1 626 . 1 . 1 60 60 ASN N N 15 119.293 0.083 . 1 . . . . . 520 ASN N . 51542 1 627 . 1 . 1 60 60 ASN ND2 N 15 112.835 0.002 . 1 . . . . . 520 ASN ND2 . 51542 1 628 . 1 . 1 61 61 LYS H H 1 8.914 0.003 . 1 . . . . . 521 LYS H . 51542 1 629 . 1 . 1 61 61 LYS HA H 1 4.447 0.002 . 1 . . . . . 521 LYS HA . 51542 1 630 . 1 . 1 61 61 LYS HB2 H 1 1.637 0.004 . 2 . . . . . 521 LYS HB2 . 51542 1 631 . 1 . 1 61 61 LYS HB3 H 1 1.925 0.005 . 2 . . . . . 521 LYS HB3 . 51542 1 632 . 1 . 1 61 61 LYS HG2 H 1 1.423 0.005 . 2 . . . . . 521 LYS HG2 . 51542 1 633 . 1 . 1 61 61 LYS HG3 H 1 1.523 0.005 . 2 . . . . . 521 LYS HG3 . 51542 1 634 . 1 . 1 61 61 LYS C C 13 177.208 0.012 . 1 . . . . . 521 LYS C . 51542 1 635 . 1 . 1 61 61 LYS CA C 13 55.751 0.038 . 1 . . . . . 521 LYS CA . 51542 1 636 . 1 . 1 61 61 LYS CB C 13 33.511 0.099 . 1 . . . . . 521 LYS CB . 51542 1 637 . 1 . 1 61 61 LYS N N 15 123.523 0.060 . 1 . . . . . 521 LYS N . 51542 1 638 . 1 . 1 62 62 VAL H H 1 8.267 0.003 . 1 . . . . . 522 VAL H . 51542 1 639 . 1 . 1 62 62 VAL HA H 1 3.924 0.013 . 1 . . . . . 522 VAL HA . 51542 1 640 . 1 . 1 62 62 VAL HB H 1 2.100 0.006 . 1 . . . . . 522 VAL HB . 51542 1 641 . 1 . 1 62 62 VAL HG11 H 1 0.935 0.020 . 1 . . . . . 522 VAL HG11 . 51542 1 642 . 1 . 1 62 62 VAL HG12 H 1 0.935 0.020 . 1 . . . . . 522 VAL HG12 . 51542 1 643 . 1 . 1 62 62 VAL HG13 H 1 0.935 0.020 . 1 . . . . . 522 VAL HG13 . 51542 1 644 . 1 . 1 62 62 VAL HG21 H 1 0.935 0.020 . 1 . . . . . 522 VAL HG21 . 51542 1 645 . 1 . 1 62 62 VAL HG22 H 1 0.935 0.020 . 1 . . . . . 522 VAL HG22 . 51542 1 646 . 1 . 1 62 62 VAL HG23 H 1 0.935 0.020 . 1 . . . . . 522 VAL HG23 . 51542 1 647 . 1 . 1 62 62 VAL C C 13 176.013 0.003 . 1 . . . . . 522 VAL C . 51542 1 648 . 1 . 1 62 62 VAL CA C 13 63.800 0.046 . 1 . . . . . 522 VAL CA . 51542 1 649 . 1 . 1 62 62 VAL CB C 13 32.015 0.063 . 1 . . . . . 522 VAL CB . 51542 1 650 . 1 . 1 62 62 VAL N N 15 119.328 0.086 . 1 . . . . . 522 VAL N . 51542 1 651 . 1 . 1 63 63 ASP H H 1 8.435 0.004 . 1 . . . . . 523 ASP H . 51542 1 652 . 1 . 1 63 63 ASP HA H 1 4.487 0.010 . 1 . . . . . 523 ASP HA . 51542 1 653 . 1 . 1 63 63 ASP HB2 H 1 2.683 0.004 . 2 . . . . . 523 ASP HB2 . 51542 1 654 . 1 . 1 63 63 ASP HB3 H 1 2.728 0.003 . 2 . . . . . 523 ASP HB3 . 51542 1 655 . 1 . 1 63 63 ASP C C 13 175.447 0.041 . 1 . . . . . 523 ASP C . 51542 1 656 . 1 . 1 63 63 ASP CA C 13 54.525 0.074 . 1 . . . . . 523 ASP CA . 51542 1 657 . 1 . 1 63 63 ASP CB C 13 40.288 0.017 . 1 . . . . . 523 ASP CB . 51542 1 658 . 1 . 1 63 63 ASP N N 15 119.404 0.086 . 1 . . . . . 523 ASP N . 51542 1 659 . 1 . 1 64 64 GLU H H 1 7.773 0.002 . 1 . . . . . 524 GLU H . 51542 1 660 . 1 . 1 64 64 GLU HA H 1 4.382 0.007 . 1 . . . . . 524 GLU HA . 51542 1 661 . 1 . 1 64 64 GLU HB2 H 1 1.774 0.007 . 2 . . . . . 524 GLU HB2 . 51542 1 662 . 1 . 1 64 64 GLU HB3 H 1 1.884 0.007 . 2 . . . . . 524 GLU HB3 . 51542 1 663 . 1 . 1 64 64 GLU HG2 H 1 2.106 0.001 . 1 . . . . . 524 GLU HG2 . 51542 1 664 . 1 . 1 64 64 GLU HG3 H 1 2.106 0.001 . 1 . . . . . 524 GLU HG3 . 51542 1 665 . 1 . 1 64 64 GLU C C 13 175.959 0.015 . 1 . . . . . 524 GLU C . 51542 1 666 . 1 . 1 64 64 GLU CA C 13 55.621 0.029 . 1 . . . . . 524 GLU CA . 51542 1 667 . 1 . 1 64 64 GLU CB C 13 31.971 0.064 . 1 . . . . . 524 GLU CB . 51542 1 668 . 1 . 1 64 64 GLU CG C 13 36.360 0.006 . 1 . . . . . 524 GLU CG . 51542 1 669 . 1 . 1 64 64 GLU N N 15 119.564 0.059 . 1 . . . . . 524 GLU N . 51542 1 670 . 1 . 1 65 65 ILE H H 1 8.510 0.003 . 1 . . . . . 525 ILE H . 51542 1 671 . 1 . 1 65 65 ILE HA H 1 3.830 0.002 . 1 . . . . . 525 ILE HA . 51542 1 672 . 1 . 1 65 65 ILE HB H 1 1.519 0.006 . 1 . . . . . 525 ILE HB . 51542 1 673 . 1 . 1 65 65 ILE HG12 H 1 1.301 0.003 . 2 . . . . . 525 ILE HG12 . 51542 1 674 . 1 . 1 65 65 ILE HG13 H 1 0.940 0.001 . 2 . . . . . 525 ILE HG13 . 51542 1 675 . 1 . 1 65 65 ILE HG21 H 1 0.605 0.011 . 1 . . . . . 525 ILE HG21 . 51542 1 676 . 1 . 1 65 65 ILE HG22 H 1 0.605 0.011 . 1 . . . . . 525 ILE HG22 . 51542 1 677 . 1 . 1 65 65 ILE HG23 H 1 0.605 0.011 . 1 . . . . . 525 ILE HG23 . 51542 1 678 . 1 . 1 65 65 ILE HD11 H 1 0.586 0.003 . 1 . . . . . 525 ILE HD11 . 51542 1 679 . 1 . 1 65 65 ILE HD12 H 1 0.586 0.003 . 1 . . . . . 525 ILE HD12 . 51542 1 680 . 1 . 1 65 65 ILE HD13 H 1 0.586 0.003 . 1 . . . . . 525 ILE HD13 . 51542 1 681 . 1 . 1 65 65 ILE C C 13 174.995 0.003 . 1 . . . . . 525 ILE C . 51542 1 682 . 1 . 1 65 65 ILE CA C 13 63.126 0.036 . 1 . . . . . 525 ILE CA . 51542 1 683 . 1 . 1 65 65 ILE CB C 13 37.954 0.032 . 1 . . . . . 525 ILE CB . 51542 1 684 . 1 . 1 65 65 ILE CG1 C 13 27.326 0.038 . 1 . . . . . 525 ILE CG1 . 51542 1 685 . 1 . 1 65 65 ILE CG2 C 13 18.296 0.068 . 1 . . . . . 525 ILE CG2 . 51542 1 686 . 1 . 1 65 65 ILE CD1 C 13 13.582 0.062 . 1 . . . . . 525 ILE CD1 . 51542 1 687 . 1 . 1 65 65 ILE N N 15 121.617 0.059 . 1 . . . . . 525 ILE N . 51542 1 688 . 1 . 1 66 66 LEU H H 1 6.706 0.003 . 1 . . . . . 526 LEU H . 51542 1 689 . 1 . 1 66 66 LEU HA H 1 4.612 0.004 . 1 . . . . . 526 LEU HA . 51542 1 690 . 1 . 1 66 66 LEU HB2 H 1 1.286 0.004 . 2 . . . . . 526 LEU HB2 . 51542 1 691 . 1 . 1 66 66 LEU HB3 H 1 1.285 0.004 . 2 . . . . . 526 LEU HB3 . 51542 1 692 . 1 . 1 66 66 LEU HG H 1 1.429 0.012 . 1 . . . . . 526 LEU HG . 51542 1 693 . 1 . 1 66 66 LEU HD11 H 1 0.751 0.004 . 2 . . . . . 526 LEU HD11 . 51542 1 694 . 1 . 1 66 66 LEU HD12 H 1 0.751 0.004 . 2 . . . . . 526 LEU HD12 . 51542 1 695 . 1 . 1 66 66 LEU HD13 H 1 0.751 0.004 . 2 . . . . . 526 LEU HD13 . 51542 1 696 . 1 . 1 66 66 LEU HD21 H 1 0.752 0.002 . 2 . . . . . 526 LEU HD21 . 51542 1 697 . 1 . 1 66 66 LEU HD22 H 1 0.752 0.002 . 2 . . . . . 526 LEU HD22 . 51542 1 698 . 1 . 1 66 66 LEU HD23 H 1 0.752 0.002 . 2 . . . . . 526 LEU HD23 . 51542 1 699 . 1 . 1 66 66 LEU C C 13 173.853 0.200 . 1 . . . . . 526 LEU C . 51542 1 700 . 1 . 1 66 66 LEU CA C 13 51.819 0.056 . 1 . . . . . 526 LEU CA . 51542 1 701 . 1 . 1 66 66 LEU CB C 13 44.357 0.086 . 1 . . . . . 526 LEU CB . 51542 1 702 . 1 . 1 66 66 LEU CG C 13 26.261 0.200 . 1 . . . . . 526 LEU CG . 51542 1 703 . 1 . 1 66 66 LEU CD1 C 13 24.983 0.041 . 2 . . . . . 526 LEU CD1 . 51542 1 704 . 1 . 1 66 66 LEU CD2 C 13 25.670 0.200 . 2 . . . . . 526 LEU CD2 . 51542 1 705 . 1 . 1 66 66 LEU N N 15 116.527 0.038 . 1 . . . . . 526 LEU N . 51542 1 706 . 1 . 1 67 67 PRO C C 13 179.419 0.006 . 1 . . . . . 527 PRO C . 51542 1 707 . 1 . 1 67 67 PRO CA C 13 62.755 0.060 . 1 . . . . . 527 PRO CA . 51542 1 708 . 1 . 1 67 67 PRO CB C 13 31.716 0.200 . 1 . . . . . 527 PRO CB . 51542 1 709 . 1 . 1 68 68 LEU H H 1 9.026 0.003 . 1 . . . . . 528 LEU H . 51542 1 710 . 1 . 1 68 68 LEU HA H 1 4.040 0.001 . 1 . . . . . 528 LEU HA . 51542 1 711 . 1 . 1 68 68 LEU HB2 H 1 1.530 0.009 . 2 . . . . . 528 LEU HB2 . 51542 1 712 . 1 . 1 68 68 LEU HB3 H 1 1.670 0.002 . 2 . . . . . 528 LEU HB3 . 51542 1 713 . 1 . 1 68 68 LEU HG H 1 1.738 0.020 . 1 . . . . . 528 LEU HG . 51542 1 714 . 1 . 1 68 68 LEU HD11 H 1 0.895 0.003 . 1 . . . . . 528 LEU HD11 . 51542 1 715 . 1 . 1 68 68 LEU HD12 H 1 0.895 0.003 . 1 . . . . . 528 LEU HD12 . 51542 1 716 . 1 . 1 68 68 LEU HD13 H 1 0.895 0.003 . 1 . . . . . 528 LEU HD13 . 51542 1 717 . 1 . 1 68 68 LEU HD21 H 1 0.896 0.004 . 1 . . . . . 528 LEU HD21 . 51542 1 718 . 1 . 1 68 68 LEU HD22 H 1 0.896 0.004 . 1 . . . . . 528 LEU HD22 . 51542 1 719 . 1 . 1 68 68 LEU HD23 H 1 0.896 0.004 . 1 . . . . . 528 LEU HD23 . 51542 1 720 . 1 . 1 68 68 LEU C C 13 177.629 0.017 . 1 . . . . . 528 LEU C . 51542 1 721 . 1 . 1 68 68 LEU CA C 13 58.038 0.083 . 1 . . . . . 528 LEU CA . 51542 1 722 . 1 . 1 68 68 LEU CB C 13 41.872 0.091 . 1 . . . . . 528 LEU CB . 51542 1 723 . 1 . 1 68 68 LEU CG C 13 26.880 0.200 . 1 . . . . . 528 LEU CG . 51542 1 724 . 1 . 1 68 68 LEU CD1 C 13 24.050 0.200 . 1 . . . . . 528 LEU CD1 . 51542 1 725 . 1 . 1 68 68 LEU N N 15 127.067 0.060 . 1 . . . . . 528 LEU N . 51542 1 726 . 1 . 1 69 69 ASN H H 1 8.334 0.003 . 1 . . . . . 529 ASN H . 51542 1 727 . 1 . 1 69 69 ASN HA H 1 4.219 0.010 . 1 . . . . . 529 ASN HA . 51542 1 728 . 1 . 1 69 69 ASN HB2 H 1 2.143 0.004 . 2 . . . . . 529 ASN HB2 . 51542 1 729 . 1 . 1 69 69 ASN HB3 H 1 2.044 0.008 . 2 . . . . . 529 ASN HB3 . 51542 1 730 . 1 . 1 69 69 ASN HD21 H 1 6.479 0.001 . 1 . . . . . 529 ASN HD21 . 51542 1 731 . 1 . 1 69 69 ASN HD22 H 1 6.346 0.002 . 1 . . . . . 529 ASN HD22 . 51542 1 732 . 1 . 1 69 69 ASN C C 13 174.090 0.004 . 1 . . . . . 529 ASN C . 51542 1 733 . 1 . 1 69 69 ASN CA C 13 52.862 0.075 . 1 . . . . . 529 ASN CA . 51542 1 734 . 1 . 1 69 69 ASN CB C 13 36.354 0.071 . 1 . . . . . 529 ASN CB . 51542 1 735 . 1 . 1 69 69 ASN N N 15 112.320 0.080 . 1 . . . . . 529 ASN N . 51542 1 736 . 1 . 1 69 69 ASN ND2 N 15 109.739 0.035 . 1 . . . . . 529 ASN ND2 . 51542 1 737 . 1 . 1 70 70 THR H H 1 7.276 0.002 . 1 . . . . . 530 THR H . 51542 1 738 . 1 . 1 70 70 THR HA H 1 3.592 0.041 . 1 . . . . . 530 THR HA . 51542 1 739 . 1 . 1 70 70 THR HB H 1 3.649 0.033 . 1 . . . . . 530 THR HB . 51542 1 740 . 1 . 1 70 70 THR HG21 H 1 1.095 0.002 . 1 . . . . . 530 THR HG21 . 51542 1 741 . 1 . 1 70 70 THR HG22 H 1 1.095 0.002 . 1 . . . . . 530 THR HG22 . 51542 1 742 . 1 . 1 70 70 THR HG23 H 1 1.095 0.002 . 1 . . . . . 530 THR HG23 . 51542 1 743 . 1 . 1 70 70 THR C C 13 174.024 0.010 . 1 . . . . . 530 THR C . 51542 1 744 . 1 . 1 70 70 THR CA C 13 66.142 0.098 . 1 . . . . . 530 THR CA . 51542 1 745 . 1 . 1 70 70 THR CB C 13 70.144 0.074 . 1 . . . . . 530 THR CB . 51542 1 746 . 1 . 1 70 70 THR CG2 C 13 22.725 0.061 . 1 . . . . . 530 THR CG2 . 51542 1 747 . 1 . 1 70 70 THR N N 15 114.329 0.050 . 1 . . . . . 530 THR N . 51542 1 748 . 1 . 1 71 71 THR H H 1 9.836 0.006 . 1 . . . . . 531 THR H . 51542 1 749 . 1 . 1 71 71 THR HA H 1 4.712 0.002 . 1 . . . . . 531 THR HA . 51542 1 750 . 1 . 1 71 71 THR HB H 1 4.542 0.005 . 1 . . . . . 531 THR HB . 51542 1 751 . 1 . 1 71 71 THR HG21 H 1 1.469 0.003 . 1 . . . . . 531 THR HG21 . 51542 1 752 . 1 . 1 71 71 THR HG22 H 1 1.469 0.003 . 1 . . . . . 531 THR HG22 . 51542 1 753 . 1 . 1 71 71 THR HG23 H 1 1.469 0.003 . 1 . . . . . 531 THR HG23 . 51542 1 754 . 1 . 1 71 71 THR C C 13 174.923 0.200 . 1 . . . . . 531 THR C . 51542 1 755 . 1 . 1 71 71 THR CA C 13 62.356 0.200 . 1 . . . . . 531 THR CA . 51542 1 756 . 1 . 1 71 71 THR CB C 13 70.492 0.039 . 1 . . . . . 531 THR CB . 51542 1 757 . 1 . 1 71 71 THR CG2 C 13 21.662 0.033 . 1 . . . . . 531 THR CG2 . 51542 1 758 . 1 . 1 71 71 THR N N 15 116.348 0.080 . 1 . . . . . 531 THR N . 51542 1 759 . 1 . 1 72 72 HIS H H 1 7.988 0.004 . 1 . . . . . 532 HIS H . 51542 1 760 . 1 . 1 72 72 HIS HA H 1 5.255 0.002 . 1 . . . . . 532 HIS HA . 51542 1 761 . 1 . 1 72 72 HIS HB2 H 1 1.784 0.020 . 2 . . . . . 532 HIS HB2 . 51542 1 762 . 1 . 1 72 72 HIS HB3 H 1 2.158 0.008 . 2 . . . . . 532 HIS HB3 . 51542 1 763 . 1 . 1 72 72 HIS C C 13 172.801 0.026 . 1 . . . . . 532 HIS C . 51542 1 764 . 1 . 1 72 72 HIS CA C 13 55.915 0.069 . 1 . . . . . 532 HIS CA . 51542 1 765 . 1 . 1 72 72 HIS CB C 13 36.265 0.102 . 1 . . . . . 532 HIS CB . 51542 1 766 . 1 . 1 72 72 HIS N N 15 124.132 0.123 . 1 . . . . . 532 HIS N . 51542 1 767 . 1 . 1 73 73 ILE H H 1 9.559 0.003 . 1 . . . . . 533 ILE H . 51542 1 768 . 1 . 1 73 73 ILE HA H 1 4.743 0.009 . 1 . . . . . 533 ILE HA . 51542 1 769 . 1 . 1 73 73 ILE HB H 1 1.898 0.004 . 1 . . . . . 533 ILE HB . 51542 1 770 . 1 . 1 73 73 ILE HG12 H 1 1.284 0.003 . 2 . . . . . 533 ILE HG12 . 51542 1 771 . 1 . 1 73 73 ILE HG13 H 1 0.928 0.001 . 2 . . . . . 533 ILE HG13 . 51542 1 772 . 1 . 1 73 73 ILE HG21 H 1 0.651 0.005 . 1 . . . . . 533 ILE HG21 . 51542 1 773 . 1 . 1 73 73 ILE HG22 H 1 0.651 0.005 . 1 . . . . . 533 ILE HG22 . 51542 1 774 . 1 . 1 73 73 ILE HG23 H 1 0.651 0.005 . 1 . . . . . 533 ILE HG23 . 51542 1 775 . 1 . 1 73 73 ILE HD11 H 1 0.678 0.004 . 1 . . . . . 533 ILE HD11 . 51542 1 776 . 1 . 1 73 73 ILE HD12 H 1 0.678 0.004 . 1 . . . . . 533 ILE HD12 . 51542 1 777 . 1 . 1 73 73 ILE HD13 H 1 0.678 0.004 . 1 . . . . . 533 ILE HD13 . 51542 1 778 . 1 . 1 73 73 ILE C C 13 174.635 0.032 . 1 . . . . . 533 ILE C . 51542 1 779 . 1 . 1 73 73 ILE CA C 13 59.164 0.076 . 1 . . . . . 533 ILE CA . 51542 1 780 . 1 . 1 73 73 ILE CB C 13 40.074 0.092 . 1 . . . . . 533 ILE CB . 51542 1 781 . 1 . 1 73 73 ILE CG1 C 13 27.871 0.200 . 1 . . . . . 533 ILE CG1 . 51542 1 782 . 1 . 1 73 73 ILE CG2 C 13 18.559 0.008 . 1 . . . . . 533 ILE CG2 . 51542 1 783 . 1 . 1 73 73 ILE CD1 C 13 16.245 0.044 . 1 . . . . . 533 ILE CD1 . 51542 1 784 . 1 . 1 73 73 ILE N N 15 122.616 0.055 . 1 . . . . . 533 ILE N . 51542 1 785 . 1 . 1 74 74 VAL H H 1 9.059 0.003 . 1 . . . . . 534 VAL H . 51542 1 786 . 1 . 1 74 74 VAL HA H 1 5.252 0.004 . 1 . . . . . 534 VAL HA . 51542 1 787 . 1 . 1 74 74 VAL HB H 1 1.949 0.020 . 1 . . . . . 534 VAL HB . 51542 1 788 . 1 . 1 74 74 VAL HG11 H 1 0.838 0.008 . 2 . . . . . 534 VAL HG11 . 51542 1 789 . 1 . 1 74 74 VAL HG12 H 1 0.838 0.008 . 2 . . . . . 534 VAL HG12 . 51542 1 790 . 1 . 1 74 74 VAL HG13 H 1 0.838 0.008 . 2 . . . . . 534 VAL HG13 . 51542 1 791 . 1 . 1 74 74 VAL HG21 H 1 0.937 0.001 . 2 . . . . . 534 VAL HG21 . 51542 1 792 . 1 . 1 74 74 VAL HG22 H 1 0.937 0.001 . 2 . . . . . 534 VAL HG22 . 51542 1 793 . 1 . 1 74 74 VAL HG23 H 1 0.937 0.001 . 2 . . . . . 534 VAL HG23 . 51542 1 794 . 1 . 1 74 74 VAL C C 13 173.649 0.008 . 1 . . . . . 534 VAL C . 51542 1 795 . 1 . 1 74 74 VAL CA C 13 60.306 0.099 . 1 . . . . . 534 VAL CA . 51542 1 796 . 1 . 1 74 74 VAL CB C 13 31.957 0.200 . 1 . . . . . 534 VAL CB . 51542 1 797 . 1 . 1 74 74 VAL CG1 C 13 21.673 0.200 . 1 . . . . . 534 VAL CG1 . 51542 1 798 . 1 . 1 74 74 VAL N N 15 127.249 0.067 . 1 . . . . . 534 VAL N . 51542 1 799 . 1 . 1 75 75 LEU H H 1 8.884 0.003 . 1 . . . . . 535 LEU H . 51542 1 800 . 1 . 1 75 75 LEU HA H 1 5.359 0.003 . 1 . . . . . 535 LEU HA . 51542 1 801 . 1 . 1 75 75 LEU HB2 H 1 1.138 0.005 . 2 . . . . . 535 LEU HB2 . 51542 1 802 . 1 . 1 75 75 LEU HB3 H 1 1.715 0.001 . 2 . . . . . 535 LEU HB3 . 51542 1 803 . 1 . 1 75 75 LEU HG H 1 1.494 0.020 . 1 . . . . . 535 LEU HG . 51542 1 804 . 1 . 1 75 75 LEU HD11 H 1 0.618 0.007 . 2 . . . . . 535 LEU HD11 . 51542 1 805 . 1 . 1 75 75 LEU HD12 H 1 0.618 0.007 . 2 . . . . . 535 LEU HD12 . 51542 1 806 . 1 . 1 75 75 LEU HD13 H 1 0.618 0.007 . 2 . . . . . 535 LEU HD13 . 51542 1 807 . 1 . 1 75 75 LEU HD21 H 1 0.807 0.003 . 2 . . . . . 535 LEU HD21 . 51542 1 808 . 1 . 1 75 75 LEU HD22 H 1 0.807 0.003 . 2 . . . . . 535 LEU HD22 . 51542 1 809 . 1 . 1 75 75 LEU HD23 H 1 0.807 0.003 . 2 . . . . . 535 LEU HD23 . 51542 1 810 . 1 . 1 75 75 LEU C C 13 172.106 0.013 . 1 . . . . . 535 LEU C . 51542 1 811 . 1 . 1 75 75 LEU CA C 13 53.811 0.065 . 1 . . . . . 535 LEU CA . 51542 1 812 . 1 . 1 75 75 LEU CB C 13 45.891 0.059 . 1 . . . . . 535 LEU CB . 51542 1 813 . 1 . 1 75 75 LEU CD1 C 13 28.260 0.023 . 2 . . . . . 535 LEU CD1 . 51542 1 814 . 1 . 1 75 75 LEU CD2 C 13 25.560 0.200 . 2 . . . . . 535 LEU CD2 . 51542 1 815 . 1 . 1 75 75 LEU N N 15 128.557 0.068 . 1 . . . . . 535 LEU N . 51542 1 816 . 1 . 1 76 76 ARG H H 1 7.091 0.004 . 1 . . . . . 536 ARG H . 51542 1 817 . 1 . 1 76 76 ARG HA H 1 5.058 0.006 . 1 . . . . . 536 ARG HA . 51542 1 818 . 1 . 1 76 76 ARG HB2 H 1 1.933 0.006 . 2 . . . . . 536 ARG HB2 . 51542 1 819 . 1 . 1 76 76 ARG HB3 H 1 1.939 0.020 . 2 . . . . . 536 ARG HB3 . 51542 1 820 . 1 . 1 76 76 ARG C C 13 177.025 0.011 . 1 . . . . . 536 ARG C . 51542 1 821 . 1 . 1 76 76 ARG CA C 13 54.247 0.074 . 1 . . . . . 536 ARG CA . 51542 1 822 . 1 . 1 76 76 ARG CB C 13 31.735 0.049 . 1 . . . . . 536 ARG CB . 51542 1 823 . 1 . 1 76 76 ARG N N 15 117.362 0.067 . 1 . . . . . 536 ARG N . 51542 1 824 . 1 . 1 77 77 GLY H H 1 9.882 0.004 . 1 . . . . . 537 GLY H . 51542 1 825 . 1 . 1 77 77 GLY HA2 H 1 3.847 0.005 . 2 . . . . . 537 GLY HA2 . 51542 1 826 . 1 . 1 77 77 GLY HA3 H 1 4.502 0.020 . 2 . . . . . 537 GLY HA3 . 51542 1 827 . 1 . 1 77 77 GLY CA C 13 44.095 0.018 . 1 . . . . . 537 GLY CA . 51542 1 828 . 1 . 1 77 77 GLY N N 15 118.077 0.059 . 1 . . . . . 537 GLY N . 51542 1 829 . 1 . 1 79 79 PRO C C 13 175.908 0.200 . 1 . . . . . 539 PRO C . 51542 1 830 . 1 . 1 79 79 PRO CA C 13 63.554 0.200 . 1 . . . . . 539 PRO CA . 51542 1 831 . 1 . 1 80 80 ARG H H 1 8.219 0.005 . 1 . . . . . 540 ARG H . 51542 1 832 . 1 . 1 80 80 ARG HA H 1 4.383 0.004 . 1 . . . . . 540 ARG HA . 51542 1 833 . 1 . 1 80 80 ARG HB2 H 1 1.784 0.004 . 2 . . . . . 540 ARG HB2 . 51542 1 834 . 1 . 1 80 80 ARG HB3 H 1 1.717 0.006 . 2 . . . . . 540 ARG HB3 . 51542 1 835 . 1 . 1 80 80 ARG HD2 H 1 3.155 0.020 . 1 . . . . . 540 ARG HD2 . 51542 1 836 . 1 . 1 80 80 ARG HD3 H 1 3.155 0.020 . 1 . . . . . 540 ARG HD3 . 51542 1 837 . 1 . 1 80 80 ARG C C 13 175.468 0.200 . 1 . . . . . 540 ARG C . 51542 1 838 . 1 . 1 80 80 ARG CA C 13 56.763 0.049 . 1 . . . . . 540 ARG CA . 51542 1 839 . 1 . 1 80 80 ARG CB C 13 33.552 0.022 . 1 . . . . . 540 ARG CB . 51542 1 840 . 1 . 1 80 80 ARG CG C 13 26.920 0.200 . 1 . . . . . 540 ARG CG . 51542 1 841 . 1 . 1 80 80 ARG CD C 13 43.246 0.200 . 1 . . . . . 540 ARG CD . 51542 1 842 . 1 . 1 80 80 ARG N N 15 122.392 0.042 . 1 . . . . . 540 ARG N . 51542 1 843 . 1 . 1 81 81 SER H H 1 7.997 0.003 . 1 . . . . . 541 SER H . 51542 1 844 . 1 . 1 81 81 SER HA H 1 4.533 0.020 . 1 . . . . . 541 SER HA . 51542 1 845 . 1 . 1 81 81 SER C C 13 174.042 0.003 . 1 . . . . . 541 SER C . 51542 1 846 . 1 . 1 81 81 SER CA C 13 56.510 0.018 . 1 . . . . . 541 SER CA . 51542 1 847 . 1 . 1 81 81 SER CB C 13 65.447 0.050 . 1 . . . . . 541 SER CB . 51542 1 848 . 1 . 1 81 81 SER N N 15 115.694 0.066 . 1 . . . . . 541 SER N . 51542 1 849 . 1 . 1 82 82 VAL H H 1 8.872 0.004 . 1 . . . . . 542 VAL H . 51542 1 850 . 1 . 1 82 82 VAL HA H 1 3.551 0.009 . 1 . . . . . 542 VAL HA . 51542 1 851 . 1 . 1 82 82 VAL HB H 1 2.020 0.004 . 1 . . . . . 542 VAL HB . 51542 1 852 . 1 . 1 82 82 VAL HG11 H 1 0.830 0.009 . 2 . . . . . 542 VAL HG11 . 51542 1 853 . 1 . 1 82 82 VAL HG12 H 1 0.830 0.009 . 2 . . . . . 542 VAL HG12 . 51542 1 854 . 1 . 1 82 82 VAL HG13 H 1 0.830 0.009 . 2 . . . . . 542 VAL HG13 . 51542 1 855 . 1 . 1 82 82 VAL HG21 H 1 0.984 0.020 . 2 . . . . . 542 VAL HG21 . 51542 1 856 . 1 . 1 82 82 VAL HG22 H 1 0.984 0.020 . 2 . . . . . 542 VAL HG22 . 51542 1 857 . 1 . 1 82 82 VAL HG23 H 1 0.984 0.020 . 2 . . . . . 542 VAL HG23 . 51542 1 858 . 1 . 1 82 82 VAL C C 13 178.468 0.024 . 1 . . . . . 542 VAL C . 51542 1 859 . 1 . 1 82 82 VAL CA C 13 67.182 0.103 . 1 . . . . . 542 VAL CA . 51542 1 860 . 1 . 1 82 82 VAL CB C 13 31.490 0.200 . 1 . . . . . 542 VAL CB . 51542 1 861 . 1 . 1 82 82 VAL CG1 C 13 21.069 0.200 . 2 . . . . . 542 VAL CG1 . 51542 1 862 . 1 . 1 82 82 VAL CG2 C 13 23.055 0.200 . 2 . . . . . 542 VAL CG2 . 51542 1 863 . 1 . 1 82 82 VAL N N 15 121.619 0.050 . 1 . . . . . 542 VAL N . 51542 1 864 . 1 . 1 83 83 LYS H H 1 8.618 0.006 . 1 . . . . . 543 LYS H . 51542 1 865 . 1 . 1 83 83 LYS HA H 1 3.600 0.005 . 1 . . . . . 543 LYS HA . 51542 1 866 . 1 . 1 83 83 LYS HB2 H 1 1.704 0.020 . 2 . . . . . 543 LYS HB2 . 51542 1 867 . 1 . 1 83 83 LYS HB3 H 1 1.387 0.020 . 2 . . . . . 543 LYS HB3 . 51542 1 868 . 1 . 1 83 83 LYS C C 13 178.400 0.003 . 1 . . . . . 543 LYS C . 51542 1 869 . 1 . 1 83 83 LYS CA C 13 61.256 0.090 . 1 . . . . . 543 LYS CA . 51542 1 870 . 1 . 1 83 83 LYS CB C 13 33.473 0.085 . 1 . . . . . 543 LYS CB . 51542 1 871 . 1 . 1 83 83 LYS N N 15 119.443 0.051 . 1 . . . . . 543 LYS N . 51542 1 872 . 1 . 1 84 84 ALA H H 1 7.549 0.002 . 1 . . . . . 544 ALA H . 51542 1 873 . 1 . 1 84 84 ALA HA H 1 3.814 0.006 . 1 . . . . . 544 ALA HA . 51542 1 874 . 1 . 1 84 84 ALA HB1 H 1 1.385 0.003 . 1 . . . . . 544 ALA HB1 . 51542 1 875 . 1 . 1 84 84 ALA HB2 H 1 1.385 0.003 . 1 . . . . . 544 ALA HB2 . 51542 1 876 . 1 . 1 84 84 ALA HB3 H 1 1.385 0.003 . 1 . . . . . 544 ALA HB3 . 51542 1 877 . 1 . 1 84 84 ALA C C 13 179.347 0.006 . 1 . . . . . 544 ALA C . 51542 1 878 . 1 . 1 84 84 ALA CA C 13 55.514 0.073 . 1 . . . . . 544 ALA CA . 51542 1 879 . 1 . 1 84 84 ALA CB C 13 19.395 0.051 . 1 . . . . . 544 ALA CB . 51542 1 880 . 1 . 1 84 84 ALA N N 15 119.109 0.041 . 1 . . . . . 544 ALA N . 51542 1 881 . 1 . 1 85 85 LEU H H 1 8.716 0.002 . 1 . . . . . 545 LEU H . 51542 1 882 . 1 . 1 85 85 LEU HA H 1 3.743 0.005 . 1 . . . . . 545 LEU HA . 51542 1 883 . 1 . 1 85 85 LEU HB2 H 1 1.706 0.001 . 2 . . . . . 545 LEU HB2 . 51542 1 884 . 1 . 1 85 85 LEU HB3 H 1 1.493 0.020 . 2 . . . . . 545 LEU HB3 . 51542 1 885 . 1 . 1 85 85 LEU HD11 H 1 0.674 0.007 . 2 . . . . . 545 LEU HD11 . 51542 1 886 . 1 . 1 85 85 LEU HD12 H 1 0.674 0.007 . 2 . . . . . 545 LEU HD12 . 51542 1 887 . 1 . 1 85 85 LEU HD13 H 1 0.674 0.007 . 2 . . . . . 545 LEU HD13 . 51542 1 888 . 1 . 1 85 85 LEU HD21 H 1 0.667 0.020 . 2 . . . . . 545 LEU HD21 . 51542 1 889 . 1 . 1 85 85 LEU HD22 H 1 0.667 0.020 . 2 . . . . . 545 LEU HD22 . 51542 1 890 . 1 . 1 85 85 LEU HD23 H 1 0.667 0.020 . 2 . . . . . 545 LEU HD23 . 51542 1 891 . 1 . 1 85 85 LEU C C 13 179.089 0.023 . 1 . . . . . 545 LEU C . 51542 1 892 . 1 . 1 85 85 LEU CA C 13 58.223 0.098 . 1 . . . . . 545 LEU CA . 51542 1 893 . 1 . 1 85 85 LEU CB C 13 41.762 0.124 . 1 . . . . . 545 LEU CB . 51542 1 894 . 1 . 1 85 85 LEU CD1 C 13 24.065 0.200 . 1 . . . . . 545 LEU CD1 . 51542 1 895 . 1 . 1 85 85 LEU N N 15 118.895 0.047 . 1 . . . . . 545 LEU N . 51542 1 896 . 1 . 1 86 86 CYS H H 1 8.448 0.003 . 1 . . . . . 546 CYS H . 51542 1 897 . 1 . 1 86 86 CYS HA H 1 4.040 0.006 . 1 . . . . . 546 CYS HA . 51542 1 898 . 1 . 1 86 86 CYS HB2 H 1 2.761 0.010 . 2 . . . . . 546 CYS HB2 . 51542 1 899 . 1 . 1 86 86 CYS HB3 H 1 2.775 0.015 . 2 . . . . . 546 CYS HB3 . 51542 1 900 . 1 . 1 86 86 CYS C C 13 178.002 0.009 . 1 . . . . . 546 CYS C . 51542 1 901 . 1 . 1 86 86 CYS CA C 13 64.570 0.137 . 1 . . . . . 546 CYS CA . 51542 1 902 . 1 . 1 86 86 CYS CB C 13 26.782 0.082 . 1 . . . . . 546 CYS CB . 51542 1 903 . 1 . 1 86 86 CYS N N 15 116.217 0.052 . 1 . . . . . 546 CYS N . 51542 1 904 . 1 . 1 87 87 GLY H H 1 8.231 0.004 . 1 . . . . . 547 GLY H . 51542 1 905 . 1 . 1 87 87 GLY HA2 H 1 3.750 0.020 . 1 . . . . . 547 GLY HA2 . 51542 1 906 . 1 . 1 87 87 GLY HA3 H 1 3.750 0.020 . 1 . . . . . 547 GLY HA3 . 51542 1 907 . 1 . 1 87 87 GLY C C 13 174.680 0.027 . 1 . . . . . 547 GLY C . 51542 1 908 . 1 . 1 87 87 GLY CA C 13 47.333 0.019 . 1 . . . . . 547 GLY CA . 51542 1 909 . 1 . 1 87 87 GLY N N 15 109.669 0.060 . 1 . . . . . 547 GLY N . 51542 1 910 . 1 . 1 88 88 VAL H H 1 8.570 0.003 . 1 . . . . . 548 VAL H . 51542 1 911 . 1 . 1 88 88 VAL HA H 1 3.747 0.008 . 1 . . . . . 548 VAL HA . 51542 1 912 . 1 . 1 88 88 VAL HB H 1 2.401 0.008 . 1 . . . . . 548 VAL HB . 51542 1 913 . 1 . 1 88 88 VAL HG11 H 1 0.449 0.008 . 2 . . . . . 548 VAL HG11 . 51542 1 914 . 1 . 1 88 88 VAL HG12 H 1 0.449 0.008 . 2 . . . . . 548 VAL HG12 . 51542 1 915 . 1 . 1 88 88 VAL HG13 H 1 0.449 0.008 . 2 . . . . . 548 VAL HG13 . 51542 1 916 . 1 . 1 88 88 VAL HG21 H 1 0.966 0.013 . 2 . . . . . 548 VAL HG21 . 51542 1 917 . 1 . 1 88 88 VAL HG22 H 1 0.966 0.013 . 2 . . . . . 548 VAL HG22 . 51542 1 918 . 1 . 1 88 88 VAL HG23 H 1 0.966 0.013 . 2 . . . . . 548 VAL HG23 . 51542 1 919 . 1 . 1 88 88 VAL C C 13 178.478 0.026 . 1 . . . . . 548 VAL C . 51542 1 920 . 1 . 1 88 88 VAL CA C 13 66.857 0.071 . 1 . . . . . 548 VAL CA . 51542 1 921 . 1 . 1 88 88 VAL CB C 13 31.455 0.200 . 1 . . . . . 548 VAL CB . 51542 1 922 . 1 . 1 88 88 VAL CG1 C 13 20.678 0.043 . 2 . . . . . 548 VAL CG1 . 51542 1 923 . 1 . 1 88 88 VAL CG2 C 13 23.168 0.200 . 2 . . . . . 548 VAL CG2 . 51542 1 924 . 1 . 1 88 88 VAL N N 15 123.212 0.047 . 1 . . . . . 548 VAL N . 51542 1 925 . 1 . 1 89 89 VAL H H 1 7.617 0.003 . 1 . . . . . 549 VAL H . 51542 1 926 . 1 . 1 89 89 VAL HA H 1 4.080 0.007 . 1 . . . . . 549 VAL HA . 51542 1 927 . 1 . 1 89 89 VAL HB H 1 2.618 0.005 . 1 . . . . . 549 VAL HB . 51542 1 928 . 1 . 1 89 89 VAL HG11 H 1 0.849 0.009 . 2 . . . . . 549 VAL HG11 . 51542 1 929 . 1 . 1 89 89 VAL HG12 H 1 0.849 0.009 . 2 . . . . . 549 VAL HG12 . 51542 1 930 . 1 . 1 89 89 VAL HG13 H 1 0.849 0.009 . 2 . . . . . 549 VAL HG13 . 51542 1 931 . 1 . 1 89 89 VAL HG21 H 1 1.133 0.004 . 2 . . . . . 549 VAL HG21 . 51542 1 932 . 1 . 1 89 89 VAL HG22 H 1 1.133 0.004 . 2 . . . . . 549 VAL HG22 . 51542 1 933 . 1 . 1 89 89 VAL HG23 H 1 1.133 0.004 . 2 . . . . . 549 VAL HG23 . 51542 1 934 . 1 . 1 89 89 VAL C C 13 175.436 0.005 . 1 . . . . . 549 VAL C . 51542 1 935 . 1 . 1 89 89 VAL CA C 13 63.225 0.082 . 1 . . . . . 549 VAL CA . 51542 1 936 . 1 . 1 89 89 VAL CB C 13 31.213 0.098 . 1 . . . . . 549 VAL CB . 51542 1 937 . 1 . 1 89 89 VAL CG1 C 13 20.480 0.007 . 2 . . . . . 549 VAL CG1 . 51542 1 938 . 1 . 1 89 89 VAL CG2 C 13 18.262 0.033 . 2 . . . . . 549 VAL CG2 . 51542 1 939 . 1 . 1 89 89 VAL N N 15 105.481 0.066 . 1 . . . . . 549 VAL N . 51542 1 940 . 1 . 1 90 90 SER H H 1 7.625 0.003 . 1 . . . . . 550 SER H . 51542 1 941 . 1 . 1 90 90 SER HA H 1 4.958 0.004 . 1 . . . . . 550 SER HA . 51542 1 942 . 1 . 1 90 90 SER HB2 H 1 3.567 0.020 . 1 . . . . . 550 SER HB2 . 51542 1 943 . 1 . 1 90 90 SER C C 13 174.085 0.010 . 1 . . . . . 550 SER C . 51542 1 944 . 1 . 1 90 90 SER CA C 13 57.247 0.040 . 1 . . . . . 550 SER CA . 51542 1 945 . 1 . 1 90 90 SER CB C 13 64.259 0.009 . 1 . . . . . 550 SER CB . 51542 1 946 . 1 . 1 90 90 SER N N 15 114.237 0.067 . 1 . . . . . 550 SER N . 51542 1 947 . 1 . 1 91 91 SER H H 1 7.941 0.007 . 1 . . . . . 551 SER H . 51542 1 948 . 1 . 1 91 91 SER HA H 1 4.535 0.020 . 1 . . . . . 551 SER HA . 51542 1 949 . 1 . 1 91 91 SER HB2 H 1 4.114 0.020 . 1 . . . . . 551 SER HB2 . 51542 1 950 . 1 . 1 91 91 SER HB3 H 1 4.114 0.020 . 1 . . . . . 551 SER HB3 . 51542 1 951 . 1 . 1 91 91 SER C C 13 174.513 0.200 . 1 . . . . . 551 SER C . 51542 1 952 . 1 . 1 91 91 SER CA C 13 58.646 0.200 . 1 . . . . . 551 SER CA . 51542 1 953 . 1 . 1 91 91 SER CB C 13 60.678 0.001 . 1 . . . . . 551 SER CB . 51542 1 954 . 1 . 1 91 91 SER N N 15 111.715 0.032 . 1 . . . . . 551 SER N . 51542 1 955 . 1 . 1 92 92 LYS H H 1 7.756 0.002 . 1 . . . . . 552 LYS H . 51542 1 956 . 1 . 1 92 92 LYS HA H 1 4.283 0.004 . 1 . . . . . 552 LYS HA . 51542 1 957 . 1 . 1 92 92 LYS HB2 H 1 1.264 0.020 . 2 . . . . . 552 LYS HB2 . 51542 1 958 . 1 . 1 92 92 LYS HB3 H 1 1.458 0.020 . 2 . . . . . 552 LYS HB3 . 51542 1 959 . 1 . 1 92 92 LYS C C 13 176.455 0.033 . 1 . . . . . 552 LYS C . 51542 1 960 . 1 . 1 92 92 LYS CA C 13 53.290 0.085 . 1 . . . . . 552 LYS CA . 51542 1 961 . 1 . 1 92 92 LYS CB C 13 31.938 0.019 . 1 . . . . . 552 LYS CB . 51542 1 962 . 1 . 1 92 92 LYS N N 15 116.138 0.071 . 1 . . . . . 552 LYS N . 51542 1 963 . 1 . 1 93 93 TRP H H 1 7.351 0.003 . 1 . . . . . 553 TRP H . 51542 1 964 . 1 . 1 93 93 TRP HA H 1 4.549 0.020 . 1 . . . . . 553 TRP HA . 51542 1 965 . 1 . 1 93 93 TRP C C 13 175.941 0.001 . 1 . . . . . 553 TRP C . 51542 1 966 . 1 . 1 93 93 TRP CA C 13 57.869 0.017 . 1 . . . . . 553 TRP CA . 51542 1 967 . 1 . 1 93 93 TRP CB C 13 31.139 0.066 . 1 . . . . . 553 TRP CB . 51542 1 968 . 1 . 1 93 93 TRP N N 15 117.166 0.037 . 1 . . . . . 553 TRP N . 51542 1 969 . 1 . 1 94 94 LEU H H 1 9.714 0.003 . 1 . . . . . 554 LEU H . 51542 1 970 . 1 . 1 94 94 LEU HA H 1 5.279 0.008 . 1 . . . . . 554 LEU HA . 51542 1 971 . 1 . 1 94 94 LEU HB2 H 1 1.951 0.004 . 2 . . . . . 554 LEU HB2 . 51542 1 972 . 1 . 1 94 94 LEU HB3 H 1 1.522 0.007 . 2 . . . . . 554 LEU HB3 . 51542 1 973 . 1 . 1 94 94 LEU HG H 1 1.642 0.003 . 1 . . . . . 554 LEU HG . 51542 1 974 . 1 . 1 94 94 LEU HD11 H 1 0.886 0.003 . 2 . . . . . 554 LEU HD11 . 51542 1 975 . 1 . 1 94 94 LEU HD12 H 1 0.886 0.003 . 2 . . . . . 554 LEU HD12 . 51542 1 976 . 1 . 1 94 94 LEU HD13 H 1 0.886 0.003 . 2 . . . . . 554 LEU HD13 . 51542 1 977 . 1 . 1 94 94 LEU HD21 H 1 0.884 0.002 . 2 . . . . . 554 LEU HD21 . 51542 1 978 . 1 . 1 94 94 LEU HD22 H 1 0.884 0.002 . 2 . . . . . 554 LEU HD22 . 51542 1 979 . 1 . 1 94 94 LEU HD23 H 1 0.884 0.002 . 2 . . . . . 554 LEU HD23 . 51542 1 980 . 1 . 1 94 94 LEU C C 13 177.651 0.018 . 1 . . . . . 554 LEU C . 51542 1 981 . 1 . 1 94 94 LEU CA C 13 54.799 0.076 . 1 . . . . . 554 LEU CA . 51542 1 982 . 1 . 1 94 94 LEU CB C 13 41.486 0.065 . 1 . . . . . 554 LEU CB . 51542 1 983 . 1 . 1 94 94 LEU CG C 13 29.005 0.006 . 1 . . . . . 554 LEU CG . 51542 1 984 . 1 . 1 94 94 LEU CD1 C 13 25.737 0.200 . 1 . . . . . 554 LEU CD1 . 51542 1 985 . 1 . 1 94 94 LEU N N 15 125.742 0.061 . 1 . . . . . 554 LEU N . 51542 1 986 . 1 . 1 95 95 VAL H H 1 9.361 0.003 . 1 . . . . . 555 VAL H . 51542 1 987 . 1 . 1 95 95 VAL HA H 1 5.026 0.009 . 1 . . . . . 555 VAL HA . 51542 1 988 . 1 . 1 95 95 VAL HB H 1 2.332 0.004 . 1 . . . . . 555 VAL HB . 51542 1 989 . 1 . 1 95 95 VAL HG11 H 1 0.388 0.002 . 2 . . . . . 555 VAL HG11 . 51542 1 990 . 1 . 1 95 95 VAL HG12 H 1 0.388 0.002 . 2 . . . . . 555 VAL HG12 . 51542 1 991 . 1 . 1 95 95 VAL HG13 H 1 0.388 0.002 . 2 . . . . . 555 VAL HG13 . 51542 1 992 . 1 . 1 95 95 VAL HG21 H 1 0.968 0.007 . 2 . . . . . 555 VAL HG21 . 51542 1 993 . 1 . 1 95 95 VAL HG22 H 1 0.968 0.007 . 2 . . . . . 555 VAL HG22 . 51542 1 994 . 1 . 1 95 95 VAL HG23 H 1 0.968 0.007 . 2 . . . . . 555 VAL HG23 . 51542 1 995 . 1 . 1 95 95 VAL C C 13 173.401 0.010 . 1 . . . . . 555 VAL C . 51542 1 996 . 1 . 1 95 95 VAL CA C 13 57.838 0.047 . 1 . . . . . 555 VAL CA . 51542 1 997 . 1 . 1 95 95 VAL CB C 13 34.483 0.140 . 1 . . . . . 555 VAL CB . 51542 1 998 . 1 . 1 95 95 VAL CG1 C 13 21.180 0.067 . 2 . . . . . 555 VAL CG1 . 51542 1 999 . 1 . 1 95 95 VAL CG2 C 13 18.788 0.026 . 2 . . . . . 555 VAL CG2 . 51542 1 1000 . 1 . 1 95 95 VAL N N 15 118.523 0.061 . 1 . . . . . 555 VAL N . 51542 1 1001 . 1 . 1 96 96 GLN H H 1 8.817 0.004 . 1 . . . . . 556 GLN H . 51542 1 1002 . 1 . 1 96 96 GLN HA H 1 5.774 0.012 . 1 . . . . . 556 GLN HA . 51542 1 1003 . 1 . 1 96 96 GLN HB2 H 1 2.601 0.020 . 1 . . . . . 556 GLN HB2 . 51542 1 1004 . 1 . 1 96 96 GLN HE21 H 1 6.941 0.020 . 1 . . . . . 556 GLN HE21 . 51542 1 1005 . 1 . 1 96 96 GLN HE22 H 1 7.294 0.020 . 1 . . . . . 556 GLN HE22 . 51542 1 1006 . 1 . 1 96 96 GLN C C 13 176.867 0.200 . 1 . . . . . 556 GLN C . 51542 1 1007 . 1 . 1 96 96 GLN CA C 13 52.925 0.009 . 1 . . . . . 556 GLN CA . 51542 1 1008 . 1 . 1 96 96 GLN CB C 13 27.837 0.021 . 1 . . . . . 556 GLN CB . 51542 1 1009 . 1 . 1 96 96 GLN CG C 13 31.730 0.200 . 1 . . . . . 556 GLN CG . 51542 1 1010 . 1 . 1 96 96 GLN N N 15 119.170 0.028 . 1 . . . . . 556 GLN N . 51542 1 1011 . 1 . 1 96 96 GLN NE2 N 15 111.390 0.002 . 1 . . . . . 556 GLN NE2 . 51542 1 1012 . 1 . 1 97 97 PRO HA H 1 3.716 0.020 . 1 . . . . . 557 PRO HA . 51542 1 1013 . 1 . 1 97 97 PRO C C 13 177.006 0.010 . 1 . . . . . 557 PRO C . 51542 1 1014 . 1 . 1 97 97 PRO CA C 13 66.109 0.024 . 1 . . . . . 557 PRO CA . 51542 1 1015 . 1 . 1 97 97 PRO CB C 13 32.555 0.200 . 1 . . . . . 557 PRO CB . 51542 1 1016 . 1 . 1 98 98 SER H H 1 7.878 0.003 . 1 . . . . . 558 SER H . 51542 1 1017 . 1 . 1 98 98 SER HA H 1 4.150 0.014 . 1 . . . . . 558 SER HA . 51542 1 1018 . 1 . 1 98 98 SER HB2 H 1 4.006 0.001 . 1 . . . . . 558 SER HB2 . 51542 1 1019 . 1 . 1 98 98 SER HB3 H 1 4.006 0.001 . 1 . . . . . 558 SER HB3 . 51542 1 1020 . 1 . 1 98 98 SER C C 13 175.100 0.200 . 1 . . . . . 558 SER C . 51542 1 1021 . 1 . 1 98 98 SER CA C 13 60.958 0.017 . 1 . . . . . 558 SER CA . 51542 1 1022 . 1 . 1 98 98 SER CB C 13 61.821 0.081 . 1 . . . . . 558 SER CB . 51542 1 1023 . 1 . 1 98 98 SER N N 15 108.576 0.082 . 1 . . . . . 558 SER N . 51542 1 1024 . 1 . 1 99 99 TYR H H 1 7.984 0.004 . 1 . . . . . 559 TYR H . 51542 1 1025 . 1 . 1 99 99 TYR HA H 1 4.494 0.006 . 1 . . . . . 559 TYR HA . 51542 1 1026 . 1 . 1 99 99 TYR HB2 H 1 3.407 0.004 . 2 . . . . . 559 TYR HB2 . 51542 1 1027 . 1 . 1 99 99 TYR HB3 H 1 3.016 0.004 . 2 . . . . . 559 TYR HB3 . 51542 1 1028 . 1 . 1 99 99 TYR C C 13 179.268 0.200 . 1 . . . . . 559 TYR C . 51542 1 1029 . 1 . 1 99 99 TYR CA C 13 62.131 0.075 . 1 . . . . . 559 TYR CA . 51542 1 1030 . 1 . 1 99 99 TYR CB C 13 39.351 0.023 . 1 . . . . . 559 TYR CB . 51542 1 1031 . 1 . 1 99 99 TYR N N 15 123.205 0.041 . 1 . . . . . 559 TYR N . 51542 1 1032 . 1 . 1 100 100 VAL H H 1 7.134 0.009 . 1 . . . . . 560 VAL H . 51542 1 1033 . 1 . 1 100 100 VAL HA H 1 3.469 0.006 . 1 . . . . . 560 VAL HA . 51542 1 1034 . 1 . 1 100 100 VAL HB H 1 1.856 0.007 . 1 . . . . . 560 VAL HB . 51542 1 1035 . 1 . 1 100 100 VAL HG11 H 1 0.666 0.002 . 2 . . . . . 560 VAL HG11 . 51542 1 1036 . 1 . 1 100 100 VAL HG12 H 1 0.666 0.002 . 2 . . . . . 560 VAL HG12 . 51542 1 1037 . 1 . 1 100 100 VAL HG13 H 1 0.666 0.002 . 2 . . . . . 560 VAL HG13 . 51542 1 1038 . 1 . 1 100 100 VAL HG21 H 1 0.816 0.005 . 2 . . . . . 560 VAL HG21 . 51542 1 1039 . 1 . 1 100 100 VAL HG22 H 1 0.816 0.005 . 2 . . . . . 560 VAL HG22 . 51542 1 1040 . 1 . 1 100 100 VAL HG23 H 1 0.816 0.005 . 2 . . . . . 560 VAL HG23 . 51542 1 1041 . 1 . 1 100 100 VAL C C 13 177.117 0.200 . 1 . . . . . 560 VAL C . 51542 1 1042 . 1 . 1 100 100 VAL CA C 13 65.490 0.089 . 1 . . . . . 560 VAL CA . 51542 1 1043 . 1 . 1 100 100 VAL CB C 13 31.074 0.056 . 1 . . . . . 560 VAL CB . 51542 1 1044 . 1 . 1 100 100 VAL CG2 C 13 22.044 0.200 . 1 . . . . . 560 VAL CG2 . 51542 1 1045 . 1 . 1 100 100 VAL N N 15 118.894 0.072 . 1 . . . . . 560 VAL N . 51542 1 1046 . 1 . 1 101 101 PHE H H 1 7.713 0.004 . 1 . . . . . 561 PHE H . 51542 1 1047 . 1 . 1 101 101 PHE HA H 1 4.194 0.007 . 1 . . . . . 561 PHE HA . 51542 1 1048 . 1 . 1 101 101 PHE HB2 H 1 2.781 0.004 . 2 . . . . . 561 PHE HB2 . 51542 1 1049 . 1 . 1 101 101 PHE HB3 H 1 3.268 0.004 . 2 . . . . . 561 PHE HB3 . 51542 1 1050 . 1 . 1 101 101 PHE HD1 H 1 6.977 0.004 . 1 . . . . . 561 PHE HD1 . 51542 1 1051 . 1 . 1 101 101 PHE HD2 H 1 6.977 0.004 . 1 . . . . . 561 PHE HD2 . 51542 1 1052 . 1 . 1 101 101 PHE C C 13 179.254 0.007 . 1 . . . . . 561 PHE C . 51542 1 1053 . 1 . 1 101 101 PHE CA C 13 60.071 0.027 . 1 . . . . . 561 PHE CA . 51542 1 1054 . 1 . 1 101 101 PHE CB C 13 37.337 0.031 . 1 . . . . . 561 PHE CB . 51542 1 1055 . 1 . 1 101 101 PHE N N 15 118.671 0.041 . 1 . . . . . 561 PHE N . 51542 1 1056 . 1 . 1 102 102 ASP H H 1 9.646 0.002 . 1 . . . . . 562 ASP H . 51542 1 1057 . 1 . 1 102 102 ASP HA H 1 4.311 0.009 . 1 . . . . . 562 ASP HA . 51542 1 1058 . 1 . 1 102 102 ASP HB2 H 1 2.714 0.001 . 2 . . . . . 562 ASP HB2 . 51542 1 1059 . 1 . 1 102 102 ASP HB3 H 1 2.317 0.002 . 2 . . . . . 562 ASP HB3 . 51542 1 1060 . 1 . 1 102 102 ASP C C 13 179.714 0.009 . 1 . . . . . 562 ASP C . 51542 1 1061 . 1 . 1 102 102 ASP CA C 13 56.877 0.003 . 1 . . . . . 562 ASP CA . 51542 1 1062 . 1 . 1 102 102 ASP CB C 13 38.595 0.054 . 1 . . . . . 562 ASP CB . 51542 1 1063 . 1 . 1 102 102 ASP N N 15 122.124 0.059 . 1 . . . . . 562 ASP N . 51542 1 1064 . 1 . 1 103 103 SER H H 1 7.109 0.002 . 1 . . . . . 563 SER H . 51542 1 1065 . 1 . 1 103 103 SER HA H 1 3.984 0.020 . 1 . . . . . 563 SER HA . 51542 1 1066 . 1 . 1 103 103 SER CA C 13 62.477 0.200 . 1 . . . . . 563 SER CA . 51542 1 1067 . 1 . 1 103 103 SER N N 15 121.111 0.072 . 1 . . . . . 563 SER N . 51542 1 1068 . 1 . 1 104 104 LEU H H 1 7.748 0.003 . 1 . . . . . 564 LEU H . 51542 1 1069 . 1 . 1 104 104 LEU HA H 1 3.497 0.003 . 1 . . . . . 564 LEU HA . 51542 1 1070 . 1 . 1 104 104 LEU HB2 H 1 1.893 0.003 . 2 . . . . . 564 LEU HB2 . 51542 1 1071 . 1 . 1 104 104 LEU HB3 H 1 1.053 0.002 . 2 . . . . . 564 LEU HB3 . 51542 1 1072 . 1 . 1 104 104 LEU HD11 H 1 0.891 0.003 . 2 . . . . . 564 LEU HD11 . 51542 1 1073 . 1 . 1 104 104 LEU HD12 H 1 0.891 0.003 . 2 . . . . . 564 LEU HD12 . 51542 1 1074 . 1 . 1 104 104 LEU HD13 H 1 0.891 0.003 . 2 . . . . . 564 LEU HD13 . 51542 1 1075 . 1 . 1 104 104 LEU HD21 H 1 0.715 0.002 . 2 . . . . . 564 LEU HD21 . 51542 1 1076 . 1 . 1 104 104 LEU HD22 H 1 0.715 0.002 . 2 . . . . . 564 LEU HD22 . 51542 1 1077 . 1 . 1 104 104 LEU HD23 H 1 0.715 0.002 . 2 . . . . . 564 LEU HD23 . 51542 1 1078 . 1 . 1 104 104 LEU C C 13 179.088 0.024 . 1 . . . . . 564 LEU C . 51542 1 1079 . 1 . 1 104 104 LEU CA C 13 58.289 0.060 . 1 . . . . . 564 LEU CA . 51542 1 1080 . 1 . 1 104 104 LEU CB C 13 40.875 0.150 . 1 . . . . . 564 LEU CB . 51542 1 1081 . 1 . 1 104 104 LEU CD1 C 13 26.112 0.200 . 1 . . . . . 564 LEU CD1 . 51542 1 1082 . 1 . 1 104 104 LEU N N 15 122.785 0.049 . 1 . . . . . 564 LEU N . 51542 1 1083 . 1 . 1 105 105 GLY H H 1 7.916 0.002 . 1 . . . . . 565 GLY H . 51542 1 1084 . 1 . 1 105 105 GLY HA2 H 1 3.690 0.002 . 2 . . . . . 565 GLY HA2 . 51542 1 1085 . 1 . 1 105 105 GLY HA3 H 1 3.591 0.003 . 2 . . . . . 565 GLY HA3 . 51542 1 1086 . 1 . 1 105 105 GLY C C 13 175.012 0.010 . 1 . . . . . 565 GLY C . 51542 1 1087 . 1 . 1 105 105 GLY CA C 13 46.723 0.033 . 1 . . . . . 565 GLY CA . 51542 1 1088 . 1 . 1 105 105 GLY N N 15 104.715 0.042 . 1 . . . . . 565 GLY N . 51542 1 1089 . 1 . 1 106 106 ALA H H 1 7.560 0.002 . 1 . . . . . 566 ALA H . 51542 1 1090 . 1 . 1 106 106 ALA HA H 1 3.852 0.008 . 1 . . . . . 566 ALA HA . 51542 1 1091 . 1 . 1 106 106 ALA HB1 H 1 0.714 0.008 . 1 . . . . . 566 ALA HB1 . 51542 1 1092 . 1 . 1 106 106 ALA HB2 H 1 0.714 0.008 . 1 . . . . . 566 ALA HB2 . 51542 1 1093 . 1 . 1 106 106 ALA HB3 H 1 0.714 0.008 . 1 . . . . . 566 ALA HB3 . 51542 1 1094 . 1 . 1 106 106 ALA C C 13 177.466 0.007 . 1 . . . . . 566 ALA C . 51542 1 1095 . 1 . 1 106 106 ALA CA C 13 53.038 0.084 . 1 . . . . . 566 ALA CA . 51542 1 1096 . 1 . 1 106 106 ALA CB C 13 18.191 0.025 . 1 . . . . . 566 ALA CB . 51542 1 1097 . 1 . 1 106 106 ALA N N 15 122.252 0.053 . 1 . . . . . 566 ALA N . 51542 1 1098 . 1 . 1 107 107 GLY H H 1 7.612 0.002 . 1 . . . . . 567 GLY H . 51542 1 1099 . 1 . 1 107 107 GLY HA2 H 1 3.269 0.004 . 2 . . . . . 567 GLY HA2 . 51542 1 1100 . 1 . 1 107 107 GLY HA3 H 1 3.993 0.008 . 2 . . . . . 567 GLY HA3 . 51542 1 1101 . 1 . 1 107 107 GLY C C 13 173.528 0.065 . 1 . . . . . 567 GLY C . 51542 1 1102 . 1 . 1 107 107 GLY CA C 13 44.273 0.056 . 1 . . . . . 567 GLY CA . 51542 1 1103 . 1 . 1 107 107 GLY N N 15 103.415 0.065 . 1 . . . . . 567 GLY N . 51542 1 1104 . 1 . 1 108 108 PHE H H 1 7.205 0.003 . 1 . . . . . 568 PHE H . 51542 1 1105 . 1 . 1 108 108 PHE HA H 1 4.514 0.010 . 1 . . . . . 568 PHE HA . 51542 1 1106 . 1 . 1 108 108 PHE HB2 H 1 2.816 0.010 . 1 . . . . . 568 PHE HB2 . 51542 1 1107 . 1 . 1 108 108 PHE HD1 H 1 6.759 0.001 . 1 . . . . . 568 PHE HD1 . 51542 1 1108 . 1 . 1 108 108 PHE HD2 H 1 6.759 0.001 . 1 . . . . . 568 PHE HD2 . 51542 1 1109 . 1 . 1 108 108 PHE C C 13 172.405 0.015 . 1 . . . . . 568 PHE C . 51542 1 1110 . 1 . 1 108 108 PHE CA C 13 54.953 0.021 . 1 . . . . . 568 PHE CA . 51542 1 1111 . 1 . 1 108 108 PHE CB C 13 39.484 0.009 . 1 . . . . . 568 PHE CB . 51542 1 1112 . 1 . 1 108 108 PHE N N 15 116.247 0.077 . 1 . . . . . 568 PHE N . 51542 1 1113 . 1 . 1 109 109 TRP H H 1 7.027 0.003 . 1 . . . . . 569 TRP H . 51542 1 1114 . 1 . 1 109 109 TRP C C 13 178.534 0.011 . 1 . . . . . 569 TRP C . 51542 1 1115 . 1 . 1 109 109 TRP CA C 13 58.222 0.051 . 1 . . . . . 569 TRP CA . 51542 1 1116 . 1 . 1 109 109 TRP CB C 13 30.367 0.104 . 1 . . . . . 569 TRP CB . 51542 1 1117 . 1 . 1 109 109 TRP N N 15 115.024 0.039 . 1 . . . . . 569 TRP N . 51542 1 1118 . 1 . 1 110 110 LEU H H 1 7.823 0.027 . 1 . . . . . 570 LEU H . 51542 1 1119 . 1 . 1 110 110 LEU C C 13 176.091 0.200 . 1 . . . . . 570 LEU C . 51542 1 1120 . 1 . 1 110 110 LEU CA C 13 54.360 0.023 . 1 . . . . . 570 LEU CA . 51542 1 1121 . 1 . 1 110 110 LEU CB C 13 39.251 0.200 . 1 . . . . . 570 LEU CB . 51542 1 1122 . 1 . 1 110 110 LEU N N 15 126.505 0.085 . 1 . . . . . 570 LEU N . 51542 1 1123 . 1 . 1 111 111 ASP H H 1 8.858 0.004 . 1 . . . . . 571 ASP H . 51542 1 1124 . 1 . 1 111 111 ASP C C 13 174.928 0.006 . 1 . . . . . 571 ASP C . 51542 1 1125 . 1 . 1 111 111 ASP CA C 13 55.648 0.004 . 1 . . . . . 571 ASP CA . 51542 1 1126 . 1 . 1 111 111 ASP CB C 13 42.315 0.021 . 1 . . . . . 571 ASP CB . 51542 1 1127 . 1 . 1 111 111 ASP N N 15 123.840 0.030 . 1 . . . . . 571 ASP N . 51542 1 1128 . 1 . 1 112 112 GLU H H 1 10.281 0.004 . 1 . . . . . 572 GLU H . 51542 1 1129 . 1 . 1 112 112 GLU C C 13 177.366 0.033 . 1 . . . . . 572 GLU C . 51542 1 1130 . 1 . 1 112 112 GLU CA C 13 61.585 0.200 . 1 . . . . . 572 GLU CA . 51542 1 1131 . 1 . 1 112 112 GLU CB C 13 26.820 0.200 . 1 . . . . . 572 GLU CB . 51542 1 1132 . 1 . 1 112 112 GLU N N 15 129.341 0.057 . 1 . . . . . 572 GLU N . 51542 1 1133 . 1 . 1 113 113 GLU H H 1 7.848 0.002 . 1 . . . . . 573 GLU H . 51542 1 1134 . 1 . 1 113 113 GLU HA H 1 3.954 0.020 . 1 . . . . . 573 GLU HA . 51542 1 1135 . 1 . 1 113 113 GLU C C 13 180.925 0.019 . 1 . . . . . 573 GLU C . 51542 1 1136 . 1 . 1 113 113 GLU CA C 13 59.403 0.014 . 1 . . . . . 573 GLU CA . 51542 1 1137 . 1 . 1 113 113 GLU CB C 13 30.008 0.200 . 1 . . . . . 573 GLU CB . 51542 1 1138 . 1 . 1 113 113 GLU N N 15 117.973 0.064 . 1 . . . . . 573 GLU N . 51542 1 1139 . 1 . 1 114 114 VAL H H 1 8.346 0.005 . 1 . . . . . 574 VAL H . 51542 1 1140 . 1 . 1 114 114 VAL HA H 1 3.736 0.006 . 1 . . . . . 574 VAL HA . 51542 1 1141 . 1 . 1 114 114 VAL HB H 1 2.278 0.004 . 1 . . . . . 574 VAL HB . 51542 1 1142 . 1 . 1 114 114 VAL HG11 H 1 1.077 0.008 . 1 . . . . . 574 VAL HG11 . 51542 1 1143 . 1 . 1 114 114 VAL HG12 H 1 1.077 0.008 . 1 . . . . . 574 VAL HG12 . 51542 1 1144 . 1 . 1 114 114 VAL HG13 H 1 1.077 0.008 . 1 . . . . . 574 VAL HG13 . 51542 1 1145 . 1 . 1 114 114 VAL C C 13 178.240 0.007 . 1 . . . . . 574 VAL C . 51542 1 1146 . 1 . 1 114 114 VAL CA C 13 65.766 0.089 . 1 . . . . . 574 VAL CA . 51542 1 1147 . 1 . 1 114 114 VAL CB C 13 31.953 0.011 . 1 . . . . . 574 VAL CB . 51542 1 1148 . 1 . 1 114 114 VAL CG1 C 13 23.254 0.117 . 1 . . . . . 574 VAL CG1 . 51542 1 1149 . 1 . 1 114 114 VAL N N 15 122.740 0.031 . 1 . . . . . 574 VAL N . 51542 1 1150 . 1 . 1 115 115 GLU H H 1 7.734 0.004 . 1 . . . . . 575 GLU H . 51542 1 1151 . 1 . 1 115 115 GLU HA H 1 4.294 0.020 . 1 . . . . . 575 GLU HA . 51542 1 1152 . 1 . 1 115 115 GLU HB2 H 1 1.832 0.020 . 1 . . . . . 575 GLU HB2 . 51542 1 1153 . 1 . 1 115 115 GLU C C 13 176.220 0.044 . 1 . . . . . 575 GLU C . 51542 1 1154 . 1 . 1 115 115 GLU CA C 13 55.628 0.029 . 1 . . . . . 575 GLU CA . 51542 1 1155 . 1 . 1 115 115 GLU CB C 13 29.230 0.152 . 1 . . . . . 575 GLU CB . 51542 1 1156 . 1 . 1 115 115 GLU CG C 13 36.619 0.200 . 1 . . . . . 575 GLU CG . 51542 1 1157 . 1 . 1 115 115 GLU N N 15 115.482 0.054 . 1 . . . . . 575 GLU N . 51542 1 1158 . 1 . 1 116 116 GLY H H 1 7.699 0.003 . 1 . . . . . 576 GLY H . 51542 1 1159 . 1 . 1 116 116 GLY HA2 H 1 4.260 0.007 . 2 . . . . . 576 GLY HA2 . 51542 1 1160 . 1 . 1 116 116 GLY HA3 H 1 3.855 0.002 . 2 . . . . . 576 GLY HA3 . 51542 1 1161 . 1 . 1 116 116 GLY C C 13 176.159 0.001 . 1 . . . . . 576 GLY C . 51542 1 1162 . 1 . 1 116 116 GLY CA C 13 45.906 0.040 . 1 . . . . . 576 GLY CA . 51542 1 1163 . 1 . 1 116 116 GLY N N 15 106.274 0.041 . 1 . . . . . 576 GLY N . 51542 1 1164 . 1 . 1 117 117 GLY H H 1 8.816 0.002 . 1 . . . . . 577 GLY H . 51542 1 1165 . 1 . 1 117 117 GLY HA2 H 1 3.207 0.006 . 2 . . . . . 577 GLY HA2 . 51542 1 1166 . 1 . 1 117 117 GLY HA3 H 1 4.209 0.004 . 2 . . . . . 577 GLY HA3 . 51542 1 1167 . 1 . 1 117 117 GLY C C 13 171.873 0.008 . 1 . . . . . 577 GLY C . 51542 1 1168 . 1 . 1 117 117 GLY CA C 13 45.914 0.073 . 1 . . . . . 577 GLY CA . 51542 1 1169 . 1 . 1 117 117 GLY N N 15 109.379 0.050 . 1 . . . . . 577 GLY N . 51542 1 1170 . 1 . 1 118 118 LEU H H 1 8.656 0.003 . 1 . . . . . 578 LEU H . 51542 1 1171 . 1 . 1 118 118 LEU HA H 1 4.753 0.003 . 1 . . . . . 578 LEU HA . 51542 1 1172 . 1 . 1 118 118 LEU HB2 H 1 1.768 0.002 . 2 . . . . . 578 LEU HB2 . 51542 1 1173 . 1 . 1 118 118 LEU HB3 H 1 1.591 0.002 . 2 . . . . . 578 LEU HB3 . 51542 1 1174 . 1 . 1 118 118 LEU C C 13 174.622 0.032 . 1 . . . . . 578 LEU C . 51542 1 1175 . 1 . 1 118 118 LEU CA C 13 53.572 0.028 . 1 . . . . . 578 LEU CA . 51542 1 1176 . 1 . 1 118 118 LEU CB C 13 45.124 0.148 . 1 . . . . . 578 LEU CB . 51542 1 1177 . 1 . 1 118 118 LEU N N 15 123.332 0.034 . 1 . . . . . 578 LEU N . 51542 1 1178 . 1 . 1 119 119 ARG H H 1 7.583 0.002 . 1 . . . . . 579 ARG H . 51542 1 1179 . 1 . 1 119 119 ARG HA H 1 3.991 0.020 . 1 . . . . . 579 ARG HA . 51542 1 1180 . 1 . 1 119 119 ARG C C 13 173.883 0.052 . 1 . . . . . 579 ARG C . 51542 1 1181 . 1 . 1 119 119 ARG CA C 13 55.911 0.029 . 1 . . . . . 579 ARG CA . 51542 1 1182 . 1 . 1 119 119 ARG CB C 13 32.159 0.073 . 1 . . . . . 579 ARG CB . 51542 1 1183 . 1 . 1 119 119 ARG N N 15 120.643 0.045 . 1 . . . . . 579 ARG N . 51542 1 1184 . 1 . 1 120 120 TYR H H 1 9.187 0.003 . 1 . . . . . 580 TYR H . 51542 1 1185 . 1 . 1 120 120 TYR HA H 1 4.457 0.005 . 1 . . . . . 580 TYR HA . 51542 1 1186 . 1 . 1 120 120 TYR HB2 H 1 2.721 0.005 . 2 . . . . . 580 TYR HB2 . 51542 1 1187 . 1 . 1 120 120 TYR HB3 H 1 2.726 0.020 . 2 . . . . . 580 TYR HB3 . 51542 1 1188 . 1 . 1 120 120 TYR HD1 H 1 7.159 0.007 . 1 . . . . . 580 TYR HD1 . 51542 1 1189 . 1 . 1 120 120 TYR HD2 H 1 7.159 0.007 . 1 . . . . . 580 TYR HD2 . 51542 1 1190 . 1 . 1 120 120 TYR C C 13 173.810 0.200 . 1 . . . . . 580 TYR C . 51542 1 1191 . 1 . 1 120 120 TYR CA C 13 57.835 0.104 . 1 . . . . . 580 TYR CA . 51542 1 1192 . 1 . 1 120 120 TYR CB C 13 37.483 0.079 . 1 . . . . . 580 TYR CB . 51542 1 1193 . 1 . 1 120 120 TYR N N 15 127.983 0.033 . 1 . . . . . 580 TYR N . 51542 1 1194 . 1 . 1 121 121 PHE H H 1 8.337 0.003 . 1 . . . . . 581 PHE H . 51542 1 1195 . 1 . 1 121 121 PHE HA H 1 4.184 0.008 . 1 . . . . . 581 PHE HA . 51542 1 1196 . 1 . 1 121 121 PHE HB2 H 1 2.506 0.020 . 2 . . . . . 581 PHE HB2 . 51542 1 1197 . 1 . 1 121 121 PHE HB3 H 1 2.718 0.001 . 2 . . . . . 581 PHE HB3 . 51542 1 1198 . 1 . 1 121 121 PHE C C 13 176.172 0.200 . 1 . . . . . 581 PHE C . 51542 1 1199 . 1 . 1 121 121 PHE CA C 13 55.859 0.076 . 1 . . . . . 581 PHE CA . 51542 1 1200 . 1 . 1 121 121 PHE CB C 13 42.653 0.058 . 1 . . . . . 581 PHE CB . 51542 1 1201 . 1 . 1 121 121 PHE N N 15 125.737 0.074 . 1 . . . . . 581 PHE N . 51542 1 1202 . 1 . 1 124 124 PRO C C 13 177.296 0.003 . 1 . . . . . 584 PRO C . 51542 1 1203 . 1 . 1 124 124 PRO CA C 13 64.970 0.062 . 1 . . . . . 584 PRO CA . 51542 1 1204 . 1 . 1 124 124 PRO CB C 13 34.045 0.200 . 1 . . . . . 584 PRO CB . 51542 1 1205 . 1 . 1 125 125 LEU H H 1 9.983 0.002 . 1 . . . . . 585 LEU H . 51542 1 1206 . 1 . 1 125 125 LEU C C 13 176.211 0.003 . 1 . . . . . 585 LEU C . 51542 1 1207 . 1 . 1 125 125 LEU CA C 13 53.657 0.018 . 1 . . . . . 585 LEU CA . 51542 1 1208 . 1 . 1 125 125 LEU CB C 13 40.000 0.113 . 1 . . . . . 585 LEU CB . 51542 1 1209 . 1 . 1 125 125 LEU N N 15 116.566 0.039 . 1 . . . . . 585 LEU N . 51542 1 1210 . 1 . 1 126 126 ARG H H 1 6.733 0.003 . 1 . . . . . 586 ARG H . 51542 1 1211 . 1 . 1 126 126 ARG HA H 1 3.784 0.009 . 1 . . . . . 586 ARG HA . 51542 1 1212 . 1 . 1 126 126 ARG C C 13 177.045 0.012 . 1 . . . . . 586 ARG C . 51542 1 1213 . 1 . 1 126 126 ARG CA C 13 58.000 0.036 . 1 . . . . . 586 ARG CA . 51542 1 1214 . 1 . 1 126 126 ARG CB C 13 30.390 0.062 . 1 . . . . . 586 ARG CB . 51542 1 1215 . 1 . 1 126 126 ARG N N 15 117.009 0.049 . 1 . . . . . 586 ARG N . 51542 1 1216 . 1 . 1 127 127 CYS H H 1 8.594 0.003 . 1 . . . . . 587 CYS H . 51542 1 1217 . 1 . 1 127 127 CYS HA H 1 4.058 0.008 . 1 . . . . . 587 CYS HA . 51542 1 1218 . 1 . 1 127 127 CYS HB2 H 1 3.092 0.007 . 2 . . . . . 587 CYS HB2 . 51542 1 1219 . 1 . 1 127 127 CYS HB3 H 1 3.308 0.008 . 2 . . . . . 587 CYS HB3 . 51542 1 1220 . 1 . 1 127 127 CYS C C 13 173.478 0.002 . 1 . . . . . 587 CYS C . 51542 1 1221 . 1 . 1 127 127 CYS CA C 13 61.250 0.132 . 1 . . . . . 587 CYS CA . 51542 1 1222 . 1 . 1 127 127 CYS CB C 13 25.693 0.072 . 1 . . . . . 587 CYS CB . 51542 1 1223 . 1 . 1 127 127 CYS N N 15 116.005 0.055 . 1 . . . . . 587 CYS N . 51542 1 1224 . 1 . 1 128 128 GLN H H 1 7.828 0.004 . 1 . . . . . 588 GLN H . 51542 1 1225 . 1 . 1 128 128 GLN HA H 1 4.395 0.006 . 1 . . . . . 588 GLN HA . 51542 1 1226 . 1 . 1 128 128 GLN HB2 H 1 1.697 0.002 . 2 . . . . . 588 GLN HB2 . 51542 1 1227 . 1 . 1 128 128 GLN HB3 H 1 1.695 0.020 . 2 . . . . . 588 GLN HB3 . 51542 1 1228 . 1 . 1 128 128 GLN HG2 H 1 2.041 0.010 . 1 . . . . . 588 GLN HG2 . 51542 1 1229 . 1 . 1 128 128 GLN HG3 H 1 2.041 0.010 . 1 . . . . . 588 GLN HG3 . 51542 1 1230 . 1 . 1 128 128 GLN HE21 H 1 7.245 0.002 . 1 . . . . . 588 GLN HE21 . 51542 1 1231 . 1 . 1 128 128 GLN HE22 H 1 6.812 0.020 . 1 . . . . . 588 GLN HE22 . 51542 1 1232 . 1 . 1 128 128 GLN C C 13 173.798 0.045 . 1 . . . . . 588 GLN C . 51542 1 1233 . 1 . 1 128 128 GLN CA C 13 54.259 0.092 . 1 . . . . . 588 GLN CA . 51542 1 1234 . 1 . 1 128 128 GLN CB C 13 30.927 0.080 . 1 . . . . . 588 GLN CB . 51542 1 1235 . 1 . 1 128 128 GLN CG C 13 33.751 0.016 . 1 . . . . . 588 GLN CG . 51542 1 1236 . 1 . 1 128 128 GLN N N 15 118.190 0.038 . 1 . . . . . 588 GLN N . 51542 1 1237 . 1 . 1 128 128 GLN NE2 N 15 112.867 0.004 . 1 . . . . . 588 GLN NE2 . 51542 1 1238 . 1 . 1 129 129 ARG H H 1 8.312 0.006 . 1 . . . . . 589 ARG H . 51542 1 1239 . 1 . 1 129 129 ARG HA H 1 5.150 0.009 . 1 . . . . . 589 ARG HA . 51542 1 1240 . 1 . 1 129 129 ARG HB2 H 1 1.384 0.004 . 2 . . . . . 589 ARG HB2 . 51542 1 1241 . 1 . 1 129 129 ARG HB3 H 1 1.554 0.020 . 2 . . . . . 589 ARG HB3 . 51542 1 1242 . 1 . 1 129 129 ARG C C 13 174.724 0.009 . 1 . . . . . 589 ARG C . 51542 1 1243 . 1 . 1 129 129 ARG CA C 13 54.842 0.066 . 1 . . . . . 589 ARG CA . 51542 1 1244 . 1 . 1 129 129 ARG CB C 13 33.211 0.080 . 1 . . . . . 589 ARG CB . 51542 1 1245 . 1 . 1 129 129 ARG N N 15 121.717 0.108 . 1 . . . . . 589 ARG N . 51542 1 1246 . 1 . 1 130 130 PHE H H 1 8.976 0.003 . 1 . . . . . 590 PHE H . 51542 1 1247 . 1 . 1 130 130 PHE HA H 1 5.228 0.006 . 1 . . . . . 590 PHE HA . 51542 1 1248 . 1 . 1 130 130 PHE HB2 H 1 2.567 0.020 . 1 . . . . . 590 PHE HB2 . 51542 1 1249 . 1 . 1 130 130 PHE HB3 H 1 2.567 0.020 . 1 . . . . . 590 PHE HB3 . 51542 1 1250 . 1 . 1 130 130 PHE HD1 H 1 6.881 0.002 . 1 . . . . . 590 PHE HD1 . 51542 1 1251 . 1 . 1 130 130 PHE HD2 H 1 6.881 0.002 . 1 . . . . . 590 PHE HD2 . 51542 1 1252 . 1 . 1 130 130 PHE C C 13 173.498 0.009 . 1 . . . . . 590 PHE C . 51542 1 1253 . 1 . 1 130 130 PHE CA C 13 56.849 0.063 . 1 . . . . . 590 PHE CA . 51542 1 1254 . 1 . 1 130 130 PHE CB C 13 43.039 0.040 . 1 . . . . . 590 PHE CB . 51542 1 1255 . 1 . 1 130 130 PHE N N 15 118.766 0.059 . 1 . . . . . 590 PHE N . 51542 1 1256 . 1 . 1 131 131 LEU H H 1 8.841 0.004 . 1 . . . . . 591 LEU H . 51542 1 1257 . 1 . 1 131 131 LEU HA H 1 4.686 0.006 . 1 . . . . . 591 LEU HA . 51542 1 1258 . 1 . 1 131 131 LEU C C 13 174.385 0.010 . 1 . . . . . 591 LEU C . 51542 1 1259 . 1 . 1 131 131 LEU CA C 13 53.397 0.032 . 1 . . . . . 591 LEU CA . 51542 1 1260 . 1 . 1 131 131 LEU CB C 13 45.150 0.066 . 1 . . . . . 591 LEU CB . 51542 1 1261 . 1 . 1 131 131 LEU N N 15 125.652 0.061 . 1 . . . . . 591 LEU N . 51542 1 1262 . 1 . 1 132 132 LEU H H 1 8.811 0.004 . 1 . . . . . 592 LEU H . 51542 1 1263 . 1 . 1 132 132 LEU HA H 1 5.189 0.006 . 1 . . . . . 592 LEU HA . 51542 1 1264 . 1 . 1 132 132 LEU HB2 H 1 1.393 0.002 . 2 . . . . . 592 LEU HB2 . 51542 1 1265 . 1 . 1 132 132 LEU HB3 H 1 1.839 0.008 . 2 . . . . . 592 LEU HB3 . 51542 1 1266 . 1 . 1 132 132 LEU HG H 1 1.626 0.020 . 1 . . . . . 592 LEU HG . 51542 1 1267 . 1 . 1 132 132 LEU HD11 H 1 0.663 0.020 . 2 . . . . . 592 LEU HD11 . 51542 1 1268 . 1 . 1 132 132 LEU HD12 H 1 0.663 0.020 . 2 . . . . . 592 LEU HD12 . 51542 1 1269 . 1 . 1 132 132 LEU HD13 H 1 0.663 0.020 . 2 . . . . . 592 LEU HD13 . 51542 1 1270 . 1 . 1 132 132 LEU HD21 H 1 0.817 0.020 . 2 . . . . . 592 LEU HD21 . 51542 1 1271 . 1 . 1 132 132 LEU HD22 H 1 0.817 0.020 . 2 . . . . . 592 LEU HD22 . 51542 1 1272 . 1 . 1 132 132 LEU HD23 H 1 0.817 0.020 . 2 . . . . . 592 LEU HD23 . 51542 1 1273 . 1 . 1 132 132 LEU C C 13 177.406 0.005 . 1 . . . . . 592 LEU C . 51542 1 1274 . 1 . 1 132 132 LEU CA C 13 53.269 0.058 . 1 . . . . . 592 LEU CA . 51542 1 1275 . 1 . 1 132 132 LEU CB C 13 41.450 0.057 . 1 . . . . . 592 LEU CB . 51542 1 1276 . 1 . 1 132 132 LEU CG C 13 27.893 0.200 . 1 . . . . . 592 LEU CG . 51542 1 1277 . 1 . 1 132 132 LEU N N 15 128.029 0.057 . 1 . . . . . 592 LEU N . 51542 1 1278 . 1 . 1 133 133 THR H H 1 8.191 0.002 . 1 . . . . . 593 THR H . 51542 1 1279 . 1 . 1 133 133 THR HA H 1 4.331 0.005 . 1 . . . . . 593 THR HA . 51542 1 1280 . 1 . 1 133 133 THR HB H 1 4.277 0.017 . 1 . . . . . 593 THR HB . 51542 1 1281 . 1 . 1 133 133 THR HG21 H 1 0.987 0.003 . 1 . . . . . 593 THR HG21 . 51542 1 1282 . 1 . 1 133 133 THR HG22 H 1 0.987 0.003 . 1 . . . . . 593 THR HG22 . 51542 1 1283 . 1 . 1 133 133 THR HG23 H 1 0.987 0.003 . 1 . . . . . 593 THR HG23 . 51542 1 1284 . 1 . 1 133 133 THR C C 13 174.992 0.020 . 1 . . . . . 593 THR C . 51542 1 1285 . 1 . 1 133 133 THR CA C 13 60.472 0.105 . 1 . . . . . 593 THR CA . 51542 1 1286 . 1 . 1 133 133 THR CB C 13 68.202 0.058 . 1 . . . . . 593 THR CB . 51542 1 1287 . 1 . 1 133 133 THR CG2 C 13 22.163 0.030 . 1 . . . . . 593 THR CG2 . 51542 1 1288 . 1 . 1 133 133 THR N N 15 114.987 0.052 . 1 . . . . . 593 THR N . 51542 1 1289 . 1 . 1 134 134 MET H H 1 8.136 0.004 . 1 . . . . . 594 MET H . 51542 1 1290 . 1 . 1 134 134 MET HA H 1 4.843 0.002 . 1 . . . . . 594 MET HA . 51542 1 1291 . 1 . 1 134 134 MET HB2 H 1 2.225 0.006 . 2 . . . . . 594 MET HB2 . 51542 1 1292 . 1 . 1 134 134 MET HB3 H 1 2.055 0.001 . 2 . . . . . 594 MET HB3 . 51542 1 1293 . 1 . 1 134 134 MET HG2 H 1 2.413 0.001 . 1 . . . . . 594 MET HG2 . 51542 1 1294 . 1 . 1 134 134 MET HG3 H 1 2.413 0.001 . 1 . . . . . 594 MET HG3 . 51542 1 1295 . 1 . 1 134 134 MET HE1 H 1 1.757 0.002 . 1 . . . . . 594 MET HE1 . 51542 1 1296 . 1 . 1 134 134 MET HE2 H 1 1.757 0.002 . 1 . . . . . 594 MET HE2 . 51542 1 1297 . 1 . 1 134 134 MET HE3 H 1 1.757 0.002 . 1 . . . . . 594 MET HE3 . 51542 1 1298 . 1 . 1 134 134 MET C C 13 171.619 0.200 . 1 . . . . . 594 MET C . 51542 1 1299 . 1 . 1 134 134 MET CA C 13 54.741 0.089 . 1 . . . . . 594 MET CA . 51542 1 1300 . 1 . 1 134 134 MET CB C 13 29.124 0.200 . 1 . . . . . 594 MET CB . 51542 1 1301 . 1 . 1 134 134 MET CG C 13 30.910 0.020 . 1 . . . . . 594 MET CG . 51542 1 1302 . 1 . 1 134 134 MET CE C 13 15.945 0.021 . 1 . . . . . 594 MET CE . 51542 1 1303 . 1 . 1 134 134 MET N N 15 121.714 0.030 . 1 . . . . . 594 MET N . 51542 1 1304 . 1 . 1 135 135 PRO HA H 1 4.412 0.003 . 1 . . . . . 595 PRO HA . 51542 1 1305 . 1 . 1 135 135 PRO HB2 H 1 2.357 0.006 . 2 . . . . . 595 PRO HB2 . 51542 1 1306 . 1 . 1 135 135 PRO HB3 H 1 1.812 0.020 . 2 . . . . . 595 PRO HB3 . 51542 1 1307 . 1 . 1 135 135 PRO C C 13 175.685 0.200 . 1 . . . . . 595 PRO C . 51542 1 1308 . 1 . 1 135 135 PRO CA C 13 62.580 0.032 . 1 . . . . . 595 PRO CA . 51542 1 1309 . 1 . 1 135 135 PRO CB C 13 32.212 0.022 . 1 . . . . . 595 PRO CB . 51542 1 1310 . 1 . 1 135 135 PRO CG C 13 27.295 0.200 . 1 . . . . . 595 PRO CG . 51542 1 1311 . 1 . 1 136 136 GLU H H 1 8.278 0.004 . 1 . . . . . 596 GLU H . 51542 1 1312 . 1 . 1 136 136 GLU HA H 1 3.970 0.002 . 1 . . . . . 596 GLU HA . 51542 1 1313 . 1 . 1 136 136 GLU HB2 H 1 2.010 0.006 . 2 . . . . . 596 GLU HB2 . 51542 1 1314 . 1 . 1 136 136 GLU HB3 H 1 1.899 0.008 . 2 . . . . . 596 GLU HB3 . 51542 1 1315 . 1 . 1 136 136 GLU HG2 H 1 2.358 0.020 . 1 . . . . . 596 GLU HG2 . 51542 1 1316 . 1 . 1 136 136 GLU HG3 H 1 2.358 0.020 . 1 . . . . . 596 GLU HG3 . 51542 1 1317 . 1 . 1 136 136 GLU C C 13 171.127 0.200 . 1 . . . . . 596 GLU C . 51542 1 1318 . 1 . 1 136 136 GLU CA C 13 57.095 0.164 . 1 . . . . . 596 GLU CA . 51542 1 1319 . 1 . 1 136 136 GLU CB C 13 29.878 0.154 . 1 . . . . . 596 GLU CB . 51542 1 1320 . 1 . 1 136 136 GLU CG C 13 36.249 0.032 . 1 . . . . . 596 GLU CG . 51542 1 1321 . 1 . 1 136 136 GLU N N 15 119.049 0.074 . 1 . . . . . 596 GLU N . 51542 1 1322 . 1 . 1 137 137 GLY H H 1 8.601 0.003 . 1 . . . . . 597 GLY H . 51542 1 1323 . 1 . 1 137 137 GLY HA2 H 1 3.815 0.020 . 2 . . . . . 597 GLY HA2 . 51542 1 1324 . 1 . 1 137 137 GLY HA3 H 1 4.495 0.001 . 2 . . . . . 597 GLY HA3 . 51542 1 1325 . 1 . 1 137 137 GLY C C 13 173.389 0.025 . 1 . . . . . 597 GLY C . 51542 1 1326 . 1 . 1 137 137 GLY CA C 13 44.744 0.074 . 1 . . . . . 597 GLY CA . 51542 1 1327 . 1 . 1 137 137 GLY N N 15 111.341 0.064 . 1 . . . . . 597 GLY N . 51542 1 1328 . 1 . 1 138 138 VAL H H 1 8.364 0.006 . 1 . . . . . 598 VAL H . 51542 1 1329 . 1 . 1 138 138 VAL HA H 1 3.760 0.012 . 1 . . . . . 598 VAL HA . 51542 1 1330 . 1 . 1 138 138 VAL HB H 1 2.073 0.020 . 1 . . . . . 598 VAL HB . 51542 1 1331 . 1 . 1 138 138 VAL HG11 H 1 1.012 0.020 . 1 . . . . . 598 VAL HG11 . 51542 1 1332 . 1 . 1 138 138 VAL HG12 H 1 1.012 0.020 . 1 . . . . . 598 VAL HG12 . 51542 1 1333 . 1 . 1 138 138 VAL HG13 H 1 1.012 0.020 . 1 . . . . . 598 VAL HG13 . 51542 1 1334 . 1 . 1 138 138 VAL HG21 H 1 1.012 0.020 . 1 . . . . . 598 VAL HG21 . 51542 1 1335 . 1 . 1 138 138 VAL HG22 H 1 1.012 0.020 . 1 . . . . . 598 VAL HG22 . 51542 1 1336 . 1 . 1 138 138 VAL HG23 H 1 1.012 0.020 . 1 . . . . . 598 VAL HG23 . 51542 1 1337 . 1 . 1 138 138 VAL C C 13 178.342 0.021 . 1 . . . . . 598 VAL C . 51542 1 1338 . 1 . 1 138 138 VAL CA C 13 65.862 0.068 . 1 . . . . . 598 VAL CA . 51542 1 1339 . 1 . 1 138 138 VAL CB C 13 32.098 0.200 . 1 . . . . . 598 VAL CB . 51542 1 1340 . 1 . 1 138 138 VAL CG1 C 13 20.973 0.200 . 1 . . . . . 598 VAL CG1 . 51542 1 1341 . 1 . 1 138 138 VAL CG2 C 13 20.973 0.200 . 1 . . . . . 598 VAL CG2 . 51542 1 1342 . 1 . 1 138 138 VAL N N 15 118.174 0.075 . 1 . . . . . 598 VAL N . 51542 1 1343 . 1 . 1 139 139 VAL H H 1 7.984 0.003 . 1 . . . . . 599 VAL H . 51542 1 1344 . 1 . 1 139 139 VAL HA H 1 3.612 0.004 . 1 . . . . . 599 VAL HA . 51542 1 1345 . 1 . 1 139 139 VAL HB H 1 1.956 0.002 . 1 . . . . . 599 VAL HB . 51542 1 1346 . 1 . 1 139 139 VAL HG11 H 1 0.869 0.002 . 2 . . . . . 599 VAL HG11 . 51542 1 1347 . 1 . 1 139 139 VAL HG12 H 1 0.869 0.002 . 2 . . . . . 599 VAL HG12 . 51542 1 1348 . 1 . 1 139 139 VAL HG13 H 1 0.869 0.002 . 2 . . . . . 599 VAL HG13 . 51542 1 1349 . 1 . 1 139 139 VAL HG21 H 1 1.004 0.009 . 2 . . . . . 599 VAL HG21 . 51542 1 1350 . 1 . 1 139 139 VAL HG22 H 1 1.004 0.009 . 2 . . . . . 599 VAL HG22 . 51542 1 1351 . 1 . 1 139 139 VAL HG23 H 1 1.004 0.009 . 2 . . . . . 599 VAL HG23 . 51542 1 1352 . 1 . 1 139 139 VAL C C 13 177.322 0.009 . 1 . . . . . 599 VAL C . 51542 1 1353 . 1 . 1 139 139 VAL CA C 13 66.849 0.069 . 1 . . . . . 599 VAL CA . 51542 1 1354 . 1 . 1 139 139 VAL CB C 13 31.145 0.092 . 1 . . . . . 599 VAL CB . 51542 1 1355 . 1 . 1 139 139 VAL CG1 C 13 21.160 0.200 . 2 . . . . . 599 VAL CG1 . 51542 1 1356 . 1 . 1 139 139 VAL CG2 C 13 22.918 0.200 . 2 . . . . . 599 VAL CG2 . 51542 1 1357 . 1 . 1 139 139 VAL N N 15 121.395 0.077 . 1 . . . . . 599 VAL N . 51542 1 1358 . 1 . 1 140 140 LYS H H 1 8.059 0.005 . 1 . . . . . 600 LYS H . 51542 1 1359 . 1 . 1 140 140 LYS C C 13 178.485 0.016 . 1 . . . . . 600 LYS C . 51542 1 1360 . 1 . 1 140 140 LYS CA C 13 60.634 0.016 . 1 . . . . . 600 LYS CA . 51542 1 1361 . 1 . 1 140 140 LYS CB C 13 32.837 0.200 . 1 . . . . . 600 LYS CB . 51542 1 1362 . 1 . 1 140 140 LYS N N 15 122.244 0.040 . 1 . . . . . 600 LYS N . 51542 1 1363 . 1 . 1 141 141 THR H H 1 8.260 0.003 . 1 . . . . . 601 THR H . 51542 1 1364 . 1 . 1 141 141 THR HA H 1 3.843 0.002 . 1 . . . . . 601 THR HA . 51542 1 1365 . 1 . 1 141 141 THR HB H 1 4.116 0.010 . 1 . . . . . 601 THR HB . 51542 1 1366 . 1 . 1 141 141 THR HG21 H 1 1.172 0.015 . 1 . . . . . 601 THR HG21 . 51542 1 1367 . 1 . 1 141 141 THR HG22 H 1 1.172 0.015 . 1 . . . . . 601 THR HG22 . 51542 1 1368 . 1 . 1 141 141 THR HG23 H 1 1.172 0.015 . 1 . . . . . 601 THR HG23 . 51542 1 1369 . 1 . 1 141 141 THR C C 13 176.358 0.012 . 1 . . . . . 601 THR C . 51542 1 1370 . 1 . 1 141 141 THR CA C 13 66.805 0.075 . 1 . . . . . 601 THR CA . 51542 1 1371 . 1 . 1 141 141 THR CB C 13 68.976 0.095 . 1 . . . . . 601 THR CB . 51542 1 1372 . 1 . 1 141 141 THR CG2 C 13 21.626 0.038 . 1 . . . . . 601 THR CG2 . 51542 1 1373 . 1 . 1 141 141 THR N N 15 114.595 0.053 . 1 . . . . . 601 THR N . 51542 1 1374 . 1 . 1 142 142 MET H H 1 8.057 0.003 . 1 . . . . . 602 MET H . 51542 1 1375 . 1 . 1 142 142 MET HA H 1 4.101 0.020 . 1 . . . . . 602 MET HA . 51542 1 1376 . 1 . 1 142 142 MET HB2 H 1 2.107 0.020 . 2 . . . . . 602 MET HB2 . 51542 1 1377 . 1 . 1 142 142 MET HB3 H 1 2.198 0.020 . 2 . . . . . 602 MET HB3 . 51542 1 1378 . 1 . 1 142 142 MET HG2 H 1 2.486 0.005 . 2 . . . . . 602 MET HG2 . 51542 1 1379 . 1 . 1 142 142 MET HG3 H 1 2.631 0.020 . 2 . . . . . 602 MET HG3 . 51542 1 1380 . 1 . 1 142 142 MET HE1 H 1 1.978 0.003 . 1 . . . . . 602 MET HE1 . 51542 1 1381 . 1 . 1 142 142 MET HE2 H 1 1.978 0.003 . 1 . . . . . 602 MET HE2 . 51542 1 1382 . 1 . 1 142 142 MET HE3 H 1 1.978 0.003 . 1 . . . . . 602 MET HE3 . 51542 1 1383 . 1 . 1 142 142 MET C C 13 178.075 0.009 . 1 . . . . . 602 MET C . 51542 1 1384 . 1 . 1 142 142 MET CA C 13 58.594 0.028 . 1 . . . . . 602 MET CA . 51542 1 1385 . 1 . 1 142 142 MET CB C 13 31.107 0.200 . 1 . . . . . 602 MET CB . 51542 1 1386 . 1 . 1 142 142 MET CG C 13 32.198 0.044 . 1 . . . . . 602 MET CG . 51542 1 1387 . 1 . 1 142 142 MET CE C 13 16.970 0.018 . 1 . . . . . 602 MET CE . 51542 1 1388 . 1 . 1 142 142 MET N N 15 121.051 0.059 . 1 . . . . . 602 MET N . 51542 1 1389 . 1 . 1 143 143 LEU H H 1 8.578 0.004 . 1 . . . . . 603 LEU H . 51542 1 1390 . 1 . 1 143 143 LEU HA H 1 3.864 0.008 . 1 . . . . . 603 LEU HA . 51542 1 1391 . 1 . 1 143 143 LEU HB2 H 1 1.076 0.006 . 2 . . . . . 603 LEU HB2 . 51542 1 1392 . 1 . 1 143 143 LEU HB3 H 1 1.815 0.002 . 2 . . . . . 603 LEU HB3 . 51542 1 1393 . 1 . 1 143 143 LEU HD11 H 1 0.629 0.006 . 2 . . . . . 603 LEU HD11 . 51542 1 1394 . 1 . 1 143 143 LEU HD12 H 1 0.629 0.006 . 2 . . . . . 603 LEU HD12 . 51542 1 1395 . 1 . 1 143 143 LEU HD13 H 1 0.629 0.006 . 2 . . . . . 603 LEU HD13 . 51542 1 1396 . 1 . 1 143 143 LEU HD21 H 1 0.617 0.007 . 2 . . . . . 603 LEU HD21 . 51542 1 1397 . 1 . 1 143 143 LEU HD22 H 1 0.617 0.007 . 2 . . . . . 603 LEU HD22 . 51542 1 1398 . 1 . 1 143 143 LEU HD23 H 1 0.617 0.007 . 2 . . . . . 603 LEU HD23 . 51542 1 1399 . 1 . 1 143 143 LEU C C 13 179.020 0.027 . 1 . . . . . 603 LEU C . 51542 1 1400 . 1 . 1 143 143 LEU CA C 13 57.616 0.116 . 1 . . . . . 603 LEU CA . 51542 1 1401 . 1 . 1 143 143 LEU CB C 13 41.136 0.088 . 1 . . . . . 603 LEU CB . 51542 1 1402 . 1 . 1 143 143 LEU CD1 C 13 22.547 0.019 . 2 . . . . . 603 LEU CD1 . 51542 1 1403 . 1 . 1 143 143 LEU CD2 C 13 25.768 0.027 . 2 . . . . . 603 LEU CD2 . 51542 1 1404 . 1 . 1 143 143 LEU N N 15 119.196 0.040 . 1 . . . . . 603 LEU N . 51542 1 1405 . 1 . 1 144 144 GLN H H 1 8.453 0.004 . 1 . . . . . 604 GLN H . 51542 1 1406 . 1 . 1 144 144 GLN HA H 1 3.649 0.010 . 1 . . . . . 604 GLN HA . 51542 1 1407 . 1 . 1 144 144 GLN HB2 H 1 2.163 0.002 . 2 . . . . . 604 GLN HB2 . 51542 1 1408 . 1 . 1 144 144 GLN HB3 H 1 2.191 0.020 . 2 . . . . . 604 GLN HB3 . 51542 1 1409 . 1 . 1 144 144 GLN HG2 H 1 2.211 0.008 . 2 . . . . . 604 GLN HG2 . 51542 1 1410 . 1 . 1 144 144 GLN HG3 H 1 2.341 0.004 . 2 . . . . . 604 GLN HG3 . 51542 1 1411 . 1 . 1 144 144 GLN HE21 H 1 7.698 0.020 . 1 . . . . . 604 GLN HE21 . 51542 1 1412 . 1 . 1 144 144 GLN HE22 H 1 6.793 0.020 . 1 . . . . . 604 GLN HE22 . 51542 1 1413 . 1 . 1 144 144 GLN C C 13 177.556 0.003 . 1 . . . . . 604 GLN C . 51542 1 1414 . 1 . 1 144 144 GLN CA C 13 59.732 0.063 . 1 . . . . . 604 GLN CA . 51542 1 1415 . 1 . 1 144 144 GLN CB C 13 26.552 0.063 . 1 . . . . . 604 GLN CB . 51542 1 1416 . 1 . 1 144 144 GLN CG C 13 33.192 0.071 . 1 . . . . . 604 GLN CG . 51542 1 1417 . 1 . 1 144 144 GLN N N 15 119.786 0.062 . 1 . . . . . 604 GLN N . 51542 1 1418 . 1 . 1 144 144 GLN NE2 N 15 110.816 0.009 . 1 . . . . . 604 GLN NE2 . 51542 1 1419 . 1 . 1 145 145 ARG H H 1 7.660 0.003 . 1 . . . . . 605 ARG H . 51542 1 1420 . 1 . 1 145 145 ARG HA H 1 4.066 0.020 . 1 . . . . . 605 ARG HA . 51542 1 1421 . 1 . 1 145 145 ARG C C 13 179.908 0.006 . 1 . . . . . 605 ARG C . 51542 1 1422 . 1 . 1 145 145 ARG CA C 13 59.363 0.009 . 1 . . . . . 605 ARG CA . 51542 1 1423 . 1 . 1 145 145 ARG CB C 13 29.811 0.200 . 1 . . . . . 605 ARG CB . 51542 1 1424 . 1 . 1 145 145 ARG N N 15 117.722 0.073 . 1 . . . . . 605 ARG N . 51542 1 1425 . 1 . 1 146 146 VAL H H 1 8.126 0.004 . 1 . . . . . 606 VAL H . 51542 1 1426 . 1 . 1 146 146 VAL HA H 1 3.537 0.003 . 1 . . . . . 606 VAL HA . 51542 1 1427 . 1 . 1 146 146 VAL C C 13 177.173 0.027 . 1 . . . . . 606 VAL C . 51542 1 1428 . 1 . 1 146 146 VAL CA C 13 66.815 0.105 . 1 . . . . . 606 VAL CA . 51542 1 1429 . 1 . 1 146 146 VAL CB C 13 31.568 0.200 . 1 . . . . . 606 VAL CB . 51542 1 1430 . 1 . 1 146 146 VAL N N 15 122.000 0.197 . 1 . . . . . 606 VAL N . 51542 1 1431 . 1 . 1 147 147 VAL H H 1 8.195 0.003 . 1 . . . . . 607 VAL H . 51542 1 1432 . 1 . 1 147 147 VAL HA H 1 3.079 0.005 . 1 . . . . . 607 VAL HA . 51542 1 1433 . 1 . 1 147 147 VAL HB H 1 1.933 0.010 . 1 . . . . . 607 VAL HB . 51542 1 1434 . 1 . 1 147 147 VAL HG11 H 1 0.415 0.020 . 2 . . . . . 607 VAL HG11 . 51542 1 1435 . 1 . 1 147 147 VAL HG12 H 1 0.415 0.020 . 2 . . . . . 607 VAL HG12 . 51542 1 1436 . 1 . 1 147 147 VAL HG13 H 1 0.415 0.020 . 2 . . . . . 607 VAL HG13 . 51542 1 1437 . 1 . 1 147 147 VAL HG21 H 1 0.478 0.030 . 2 . . . . . 607 VAL HG21 . 51542 1 1438 . 1 . 1 147 147 VAL HG22 H 1 0.478 0.030 . 2 . . . . . 607 VAL HG22 . 51542 1 1439 . 1 . 1 147 147 VAL HG23 H 1 0.478 0.030 . 2 . . . . . 607 VAL HG23 . 51542 1 1440 . 1 . 1 147 147 VAL C C 13 178.867 0.019 . 1 . . . . . 607 VAL C . 51542 1 1441 . 1 . 1 147 147 VAL CA C 13 66.468 0.079 . 1 . . . . . 607 VAL CA . 51542 1 1442 . 1 . 1 147 147 VAL CB C 13 31.052 0.134 . 1 . . . . . 607 VAL CB . 51542 1 1443 . 1 . 1 147 147 VAL CG1 C 13 22.752 0.004 . 2 . . . . . 607 VAL CG1 . 51542 1 1444 . 1 . 1 147 147 VAL CG2 C 13 22.708 0.028 . 2 . . . . . 607 VAL CG2 . 51542 1 1445 . 1 . 1 147 147 VAL N N 15 119.105 0.045 . 1 . . . . . 607 VAL N . 51542 1 1446 . 1 . 1 148 148 GLU H H 1 8.161 0.002 . 1 . . . . . 608 GLU H . 51542 1 1447 . 1 . 1 148 148 GLU HA H 1 4.157 0.020 . 1 . . . . . 608 GLU HA . 51542 1 1448 . 1 . 1 148 148 GLU HG2 H 1 2.360 0.020 . 1 . . . . . 608 GLU HG2 . 51542 1 1449 . 1 . 1 148 148 GLU HG3 H 1 2.360 0.020 . 1 . . . . . 608 GLU HG3 . 51542 1 1450 . 1 . 1 148 148 GLU C C 13 181.186 0.018 . 1 . . . . . 608 GLU C . 51542 1 1451 . 1 . 1 148 148 GLU CA C 13 59.082 0.043 . 1 . . . . . 608 GLU CA . 51542 1 1452 . 1 . 1 148 148 GLU CB C 13 29.117 0.040 . 1 . . . . . 608 GLU CB . 51542 1 1453 . 1 . 1 148 148 GLU CG C 13 36.860 0.014 . 1 . . . . . 608 GLU CG . 51542 1 1454 . 1 . 1 148 148 GLU N N 15 117.841 0.061 . 1 . . . . . 608 GLU N . 51542 1 1455 . 1 . 1 149 149 PHE H H 1 8.683 0.002 . 1 . . . . . 609 PHE H . 51542 1 1456 . 1 . 1 149 149 PHE HA H 1 4.172 0.006 . 1 . . . . . 609 PHE HA . 51542 1 1457 . 1 . 1 149 149 PHE HB2 H 1 3.398 0.002 . 2 . . . . . 609 PHE HB2 . 51542 1 1458 . 1 . 1 149 149 PHE HB3 H 1 3.161 0.007 . 2 . . . . . 609 PHE HB3 . 51542 1 1459 . 1 . 1 149 149 PHE C C 13 177.562 0.021 . 1 . . . . . 609 PHE C . 51542 1 1460 . 1 . 1 149 149 PHE CA C 13 61.217 0.093 . 1 . . . . . 609 PHE CA . 51542 1 1461 . 1 . 1 149 149 PHE CB C 13 39.545 0.054 . 1 . . . . . 609 PHE CB . 51542 1 1462 . 1 . 1 149 149 PHE N N 15 125.263 0.070 . 1 . . . . . 609 PHE N . 51542 1 1463 . 1 . 1 150 150 GLY H H 1 7.977 0.002 . 1 . . . . . 610 GLY H . 51542 1 1464 . 1 . 1 150 150 GLY HA2 H 1 3.392 0.006 . 2 . . . . . 610 GLY HA2 . 51542 1 1465 . 1 . 1 150 150 GLY HA3 H 1 4.078 0.003 . 2 . . . . . 610 GLY HA3 . 51542 1 1466 . 1 . 1 150 150 GLY C C 13 174.355 0.200 . 1 . . . . . 610 GLY C . 51542 1 1467 . 1 . 1 150 150 GLY CA C 13 44.860 0.086 . 1 . . . . . 610 GLY CA . 51542 1 1468 . 1 . 1 150 150 GLY N N 15 102.251 0.039 . 1 . . . . . 610 GLY N . 51542 1 1469 . 1 . 1 151 151 GLY H H 1 8.046 0.001 . 1 . . . . . 611 GLY H . 51542 1 1470 . 1 . 1 151 151 GLY C C 13 175.513 0.008 . 1 . . . . . 611 GLY C . 51542 1 1471 . 1 . 1 151 151 GLY CA C 13 45.795 0.031 . 1 . . . . . 611 GLY CA . 51542 1 1472 . 1 . 1 151 151 GLY N N 15 108.331 0.026 . 1 . . . . . 611 GLY N . 51542 1 1473 . 1 . 1 152 152 GLY H H 1 8.423 0.002 . 1 . . . . . 612 GLY H . 51542 1 1474 . 1 . 1 152 152 GLY C C 13 171.485 0.001 . 1 . . . . . 612 GLY C . 51542 1 1475 . 1 . 1 152 152 GLY CA C 13 44.737 0.038 . 1 . . . . . 612 GLY CA . 51542 1 1476 . 1 . 1 152 152 GLY N N 15 110.600 0.088 . 1 . . . . . 612 GLY N . 51542 1 1477 . 1 . 1 153 153 GLU H H 1 8.486 0.006 . 1 . . . . . 613 GLU H . 51542 1 1478 . 1 . 1 153 153 GLU HA H 1 4.807 0.001 . 1 . . . . . 613 GLU HA . 51542 1 1479 . 1 . 1 153 153 GLU HB2 H 1 1.869 0.002 . 1 . . . . . 613 GLU HB2 . 51542 1 1480 . 1 . 1 153 153 GLU HB3 H 1 1.870 0.002 . 1 . . . . . 613 GLU HB3 . 51542 1 1481 . 1 . 1 153 153 GLU HG2 H 1 2.159 0.008 . 2 . . . . . 613 GLU HG2 . 51542 1 1482 . 1 . 1 153 153 GLU HG3 H 1 1.984 0.008 . 2 . . . . . 613 GLU HG3 . 51542 1 1483 . 1 . 1 153 153 GLU C C 13 174.946 0.010 . 1 . . . . . 613 GLU C . 51542 1 1484 . 1 . 1 153 153 GLU CA C 13 54.368 0.070 . 1 . . . . . 613 GLU CA . 51542 1 1485 . 1 . 1 153 153 GLU CB C 13 33.616 0.118 . 1 . . . . . 613 GLU CB . 51542 1 1486 . 1 . 1 153 153 GLU CG C 13 36.023 0.058 . 1 . . . . . 613 GLU CG . 51542 1 1487 . 1 . 1 153 153 GLU N N 15 118.657 0.056 . 1 . . . . . 613 GLU N . 51542 1 1488 . 1 . 1 154 154 VAL H H 1 9.225 0.002 . 1 . . . . . 614 VAL H . 51542 1 1489 . 1 . 1 154 154 VAL HA H 1 4.875 0.001 . 1 . . . . . 614 VAL HA . 51542 1 1490 . 1 . 1 154 154 VAL HB H 1 2.012 0.020 . 1 . . . . . 614 VAL HB . 51542 1 1491 . 1 . 1 154 154 VAL HG11 H 1 0.909 0.020 . 1 . . . . . 614 VAL HG11 . 51542 1 1492 . 1 . 1 154 154 VAL HG12 H 1 0.909 0.020 . 1 . . . . . 614 VAL HG12 . 51542 1 1493 . 1 . 1 154 154 VAL HG13 H 1 0.909 0.020 . 1 . . . . . 614 VAL HG13 . 51542 1 1494 . 1 . 1 154 154 VAL HG21 H 1 0.909 0.020 . 1 . . . . . 614 VAL HG21 . 51542 1 1495 . 1 . 1 154 154 VAL HG22 H 1 0.909 0.020 . 1 . . . . . 614 VAL HG22 . 51542 1 1496 . 1 . 1 154 154 VAL HG23 H 1 0.909 0.020 . 1 . . . . . 614 VAL HG23 . 51542 1 1497 . 1 . 1 154 154 VAL C C 13 176.576 0.006 . 1 . . . . . 614 VAL C . 51542 1 1498 . 1 . 1 154 154 VAL CA C 13 61.560 0.024 . 1 . . . . . 614 VAL CA . 51542 1 1499 . 1 . 1 154 154 VAL CB C 13 32.328 0.044 . 1 . . . . . 614 VAL CB . 51542 1 1500 . 1 . 1 154 154 VAL N N 15 125.795 0.053 . 1 . . . . . 614 VAL N . 51542 1 1501 . 1 . 1 155 155 VAL H H 1 8.913 0.004 . 1 . . . . . 615 VAL H . 51542 1 1502 . 1 . 1 155 155 VAL HA H 1 4.431 0.010 . 1 . . . . . 615 VAL HA . 51542 1 1503 . 1 . 1 155 155 VAL HB H 1 2.152 0.003 . 1 . . . . . 615 VAL HB . 51542 1 1504 . 1 . 1 155 155 VAL HG11 H 1 0.720 0.005 . 2 . . . . . 615 VAL HG11 . 51542 1 1505 . 1 . 1 155 155 VAL HG12 H 1 0.720 0.005 . 2 . . . . . 615 VAL HG12 . 51542 1 1506 . 1 . 1 155 155 VAL HG13 H 1 0.720 0.005 . 2 . . . . . 615 VAL HG13 . 51542 1 1507 . 1 . 1 155 155 VAL HG21 H 1 0.850 0.020 . 2 . . . . . 615 VAL HG21 . 51542 1 1508 . 1 . 1 155 155 VAL HG22 H 1 0.850 0.020 . 2 . . . . . 615 VAL HG22 . 51542 1 1509 . 1 . 1 155 155 VAL HG23 H 1 0.850 0.020 . 2 . . . . . 615 VAL HG23 . 51542 1 1510 . 1 . 1 155 155 VAL C C 13 175.516 0.016 . 1 . . . . . 615 VAL C . 51542 1 1511 . 1 . 1 155 155 VAL CA C 13 60.629 0.067 . 1 . . . . . 615 VAL CA . 51542 1 1512 . 1 . 1 155 155 VAL CB C 13 33.427 0.103 . 1 . . . . . 615 VAL CB . 51542 1 1513 . 1 . 1 155 155 VAL N N 15 124.400 0.034 . 1 . . . . . 615 VAL N . 51542 1 1514 . 1 . 1 156 156 GLY H H 1 8.507 0.002 . 1 . . . . . 616 GLY H . 51542 1 1515 . 1 . 1 156 156 GLY HA2 H 1 3.826 0.005 . 2 . . . . . 616 GLY HA2 . 51542 1 1516 . 1 . 1 156 156 GLY HA3 H 1 4.171 0.011 . 2 . . . . . 616 GLY HA3 . 51542 1 1517 . 1 . 1 156 156 GLY C C 13 174.305 0.019 . 1 . . . . . 616 GLY C . 51542 1 1518 . 1 . 1 156 156 GLY CA C 13 44.995 0.078 . 1 . . . . . 616 GLY CA . 51542 1 1519 . 1 . 1 156 156 GLY N N 15 109.254 0.060 . 1 . . . . . 616 GLY N . 51542 1 1520 . 1 . 1 157 157 THR H H 1 7.724 0.002 . 1 . . . . . 617 THR H . 51542 1 1521 . 1 . 1 157 157 THR HA H 1 4.266 0.004 . 1 . . . . . 617 THR HA . 51542 1 1522 . 1 . 1 157 157 THR HB H 1 4.134 0.015 . 1 . . . . . 617 THR HB . 51542 1 1523 . 1 . 1 157 157 THR HG21 H 1 1.114 0.005 . 1 . . . . . 617 THR HG21 . 51542 1 1524 . 1 . 1 157 157 THR HG22 H 1 1.114 0.005 . 1 . . . . . 617 THR HG22 . 51542 1 1525 . 1 . 1 157 157 THR HG23 H 1 1.114 0.005 . 1 . . . . . 617 THR HG23 . 51542 1 1526 . 1 . 1 157 157 THR C C 13 173.554 0.008 . 1 . . . . . 617 THR C . 51542 1 1527 . 1 . 1 157 157 THR CA C 13 61.426 0.096 . 1 . . . . . 617 THR CA . 51542 1 1528 . 1 . 1 157 157 THR CB C 13 70.268 0.037 . 1 . . . . . 617 THR CB . 51542 1 1529 . 1 . 1 157 157 THR CG2 C 13 21.348 0.076 . 1 . . . . . 617 THR CG2 . 51542 1 1530 . 1 . 1 157 157 THR N N 15 112.274 0.047 . 1 . . . . . 617 THR N . 51542 1 1531 . 1 . 1 158 158 LYS H H 1 8.335 0.003 . 1 . . . . . 618 LYS H . 51542 1 1532 . 1 . 1 158 158 LYS HA H 1 4.277 0.002 . 1 . . . . . 618 LYS HA . 51542 1 1533 . 1 . 1 158 158 LYS HB2 H 1 1.725 0.020 . 2 . . . . . 618 LYS HB2 . 51542 1 1534 . 1 . 1 158 158 LYS HB3 H 1 1.633 0.009 . 2 . . . . . 618 LYS HB3 . 51542 1 1535 . 1 . 1 158 158 LYS C C 13 175.988 0.008 . 1 . . . . . 618 LYS C . 51542 1 1536 . 1 . 1 158 158 LYS CA C 13 56.189 0.027 . 1 . . . . . 618 LYS CA . 51542 1 1537 . 1 . 1 158 158 LYS CB C 13 33.633 0.083 . 1 . . . . . 618 LYS CB . 51542 1 1538 . 1 . 1 158 158 LYS N N 15 122.829 0.051 . 1 . . . . . 618 LYS N . 51542 1 1539 . 1 . 1 159 159 ARG H H 1 8.779 0.003 . 1 . . . . . 619 ARG H . 51542 1 1540 . 1 . 1 159 159 ARG HA H 1 4.267 0.005 . 1 . . . . . 619 ARG HA . 51542 1 1541 . 1 . 1 159 159 ARG HB2 H 1 1.735 0.020 . 1 . . . . . 619 ARG HB2 . 51542 1 1542 . 1 . 1 159 159 ARG HB3 H 1 1.735 0.020 . 1 . . . . . 619 ARG HB3 . 51542 1 1543 . 1 . 1 159 159 ARG C C 13 176.089 0.010 . 1 . . . . . 619 ARG C . 51542 1 1544 . 1 . 1 159 159 ARG CA C 13 56.183 0.027 . 1 . . . . . 619 ARG CA . 51542 1 1545 . 1 . 1 159 159 ARG CB C 13 30.583 0.200 . 1 . . . . . 619 ARG CB . 51542 1 1546 . 1 . 1 159 159 ARG N N 15 123.921 0.052 . 1 . . . . . 619 ARG N . 51542 1 1547 . 1 . 1 160 160 ASN H H 1 8.595 0.003 . 1 . . . . . 620 ASN H . 51542 1 1548 . 1 . 1 160 160 ASN HA H 1 4.631 0.010 . 1 . . . . . 620 ASN HA . 51542 1 1549 . 1 . 1 160 160 ASN HB2 H 1 2.765 0.003 . 1 . . . . . 620 ASN HB2 . 51542 1 1550 . 1 . 1 160 160 ASN HB3 H 1 2.765 0.003 . 1 . . . . . 620 ASN HB3 . 51542 1 1551 . 1 . 1 160 160 ASN HD21 H 1 7.644 0.020 . 1 . . . . . 620 ASN HD21 . 51542 1 1552 . 1 . 1 160 160 ASN HD22 H 1 6.934 0.020 . 1 . . . . . 620 ASN HD22 . 51542 1 1553 . 1 . 1 160 160 ASN CA C 13 53.357 0.069 . 1 . . . . . 620 ASN CA . 51542 1 1554 . 1 . 1 160 160 ASN CB C 13 38.762 0.200 . 1 . . . . . 620 ASN CB . 51542 1 1555 . 1 . 1 160 160 ASN N N 15 121.097 0.022 . 1 . . . . . 620 ASN N . 51542 1 1556 . 1 . 1 160 160 ASN ND2 N 15 113.138 0.001 . 1 . . . . . 620 ASN ND2 . 51542 1 1557 . 1 . 1 161 161 GLY H H 1 8.539 0.002 . 1 . . . . . 621 GLY H . 51542 1 1558 . 1 . 1 161 161 GLY HA2 H 1 4.039 0.020 . 2 . . . . . 621 GLY HA2 . 51542 1 1559 . 1 . 1 161 161 GLY HA3 H 1 3.885 0.020 . 2 . . . . . 621 GLY HA3 . 51542 1 1560 . 1 . 1 161 161 GLY C C 13 174.306 0.057 . 1 . . . . . 621 GLY C . 51542 1 1561 . 1 . 1 161 161 GLY CA C 13 45.694 0.003 . 1 . . . . . 621 GLY CA . 51542 1 1562 . 1 . 1 161 161 GLY N N 15 110.251 0.007 . 1 . . . . . 621 GLY N . 51542 1 1563 . 1 . 1 162 162 SER H H 1 8.127 0.003 . 1 . . . . . 622 SER H . 51542 1 1564 . 1 . 1 162 162 SER HA H 1 4.494 0.020 . 1 . . . . . 622 SER HA . 51542 1 1565 . 1 . 1 162 162 SER C C 13 174.891 0.200 . 1 . . . . . 622 SER C . 51542 1 1566 . 1 . 1 162 162 SER CA C 13 58.063 0.017 . 1 . . . . . 622 SER CA . 51542 1 1567 . 1 . 1 162 162 SER CB C 13 64.194 0.009 . 1 . . . . . 622 SER CB . 51542 1 1568 . 1 . 1 162 162 SER N N 15 115.686 0.059 . 1 . . . . . 622 SER N . 51542 1 1569 . 1 . 1 164 164 ASN H H 1 8.374 0.002 . 1 . . . . . 624 ASN H . 51542 1 1570 . 1 . 1 164 164 ASN HA H 1 4.642 0.020 . 1 . . . . . 624 ASN HA . 51542 1 1571 . 1 . 1 164 164 ASN HB2 H 1 2.759 0.020 . 2 . . . . . 624 ASN HB2 . 51542 1 1572 . 1 . 1 164 164 ASN HB3 H 1 2.660 0.008 . 2 . . . . . 624 ASN HB3 . 51542 1 1573 . 1 . 1 164 164 ASN HD21 H 1 7.591 0.020 . 1 . . . . . 624 ASN HD21 . 51542 1 1574 . 1 . 1 164 164 ASN HD22 H 1 6.888 0.020 . 1 . . . . . 624 ASN HD22 . 51542 1 1575 . 1 . 1 164 164 ASN C C 13 175.001 0.016 . 1 . . . . . 624 ASN C . 51542 1 1576 . 1 . 1 164 164 ASN CA C 13 53.660 0.001 . 1 . . . . . 624 ASN CA . 51542 1 1577 . 1 . 1 164 164 ASN CB C 13 38.765 0.045 . 1 . . . . . 624 ASN CB . 51542 1 1578 . 1 . 1 164 164 ASN N N 15 120.005 0.030 . 1 . . . . . 624 ASN N . 51542 1 1579 . 1 . 1 164 164 ASN ND2 N 15 113.043 0.001 . 1 . . . . . 624 ASN ND2 . 51542 1 1580 . 1 . 1 165 165 ASP H H 1 8.129 0.003 . 1 . . . . . 625 ASP H . 51542 1 1581 . 1 . 1 165 165 ASP HA H 1 4.569 0.006 . 1 . . . . . 625 ASP HA . 51542 1 1582 . 1 . 1 165 165 ASP HB2 H 1 2.566 0.003 . 2 . . . . . 625 ASP HB2 . 51542 1 1583 . 1 . 1 165 165 ASP HB3 H 1 2.705 0.020 . 2 . . . . . 625 ASP HB3 . 51542 1 1584 . 1 . 1 165 165 ASP C C 13 176.648 0.007 . 1 . . . . . 625 ASP C . 51542 1 1585 . 1 . 1 165 165 ASP CA C 13 54.346 0.062 . 1 . . . . . 625 ASP CA . 51542 1 1586 . 1 . 1 165 165 ASP CB C 13 40.961 0.050 . 1 . . . . . 625 ASP CB . 51542 1 1587 . 1 . 1 165 165 ASP N N 15 120.114 0.046 . 1 . . . . . 625 ASP N . 51542 1 1588 . 1 . 1 166 166 GLN H H 1 8.167 0.002 . 1 . . . . . 626 GLN H . 51542 1 1589 . 1 . 1 166 166 GLN HA H 1 4.144 0.004 . 1 . . . . . 626 GLN HA . 51542 1 1590 . 1 . 1 166 166 GLN HB2 H 1 2.077 0.001 . 2 . . . . . 626 GLN HB2 . 51542 1 1591 . 1 . 1 166 166 GLN HB3 H 1 1.978 0.001 . 2 . . . . . 626 GLN HB3 . 51542 1 1592 . 1 . 1 166 166 GLN HG2 H 1 2.357 0.003 . 1 . . . . . 626 GLN HG2 . 51542 1 1593 . 1 . 1 166 166 GLN HG3 H 1 2.357 0.003 . 1 . . . . . 626 GLN HG3 . 51542 1 1594 . 1 . 1 166 166 GLN HE21 H 1 6.833 0.001 . 1 . . . . . 626 GLN HE21 . 51542 1 1595 . 1 . 1 166 166 GLN HE22 H 1 7.522 0.020 . 1 . . . . . 626 GLN HE22 . 51542 1 1596 . 1 . 1 166 166 GLN C C 13 175.701 0.027 . 1 . . . . . 626 GLN C . 51542 1 1597 . 1 . 1 166 166 GLN CA C 13 56.909 0.038 . 1 . . . . . 626 GLN CA . 51542 1 1598 . 1 . 1 166 166 GLN CB C 13 29.039 0.084 . 1 . . . . . 626 GLN CB . 51542 1 1599 . 1 . 1 166 166 GLN CG C 13 33.686 0.013 . 1 . . . . . 626 GLN CG . 51542 1 1600 . 1 . 1 166 166 GLN N N 15 119.804 0.044 . 1 . . . . . 626 GLN N . 51542 1 1601 . 1 . 1 166 166 GLN NE2 N 15 112.572 0.019 . 1 . . . . . 626 GLN NE2 . 51542 1 1602 . 1 . 1 167 167 ASP H H 1 8.481 0.002 . 1 . . . . . 627 ASP H . 51542 1 1603 . 1 . 1 167 167 ASP HA H 1 4.474 0.005 . 1 . . . . . 627 ASP HA . 51542 1 1604 . 1 . 1 167 167 ASP HB2 H 1 2.609 0.020 . 1 . . . . . 627 ASP HB2 . 51542 1 1605 . 1 . 1 167 167 ASP HB3 H 1 2.609 0.020 . 1 . . . . . 627 ASP HB3 . 51542 1 1606 . 1 . 1 167 167 ASP C C 13 175.653 0.015 . 1 . . . . . 627 ASP C . 51542 1 1607 . 1 . 1 167 167 ASP CA C 13 54.317 0.051 . 1 . . . . . 627 ASP CA . 51542 1 1608 . 1 . 1 167 167 ASP CB C 13 40.449 0.020 . 1 . . . . . 627 ASP CB . 51542 1 1609 . 1 . 1 167 167 ASP N N 15 118.702 0.038 . 1 . . . . . 627 ASP N . 51542 1 1610 . 1 . 1 168 168 VAL H H 1 7.392 0.002 . 1 . . . . . 628 VAL H . 51542 1 1611 . 1 . 1 168 168 VAL HA H 1 3.690 0.003 . 1 . . . . . 628 VAL HA . 51542 1 1612 . 1 . 1 168 168 VAL HB H 1 1.711 0.004 . 1 . . . . . 628 VAL HB . 51542 1 1613 . 1 . 1 168 168 VAL HG11 H 1 0.535 0.002 . 2 . . . . . 628 VAL HG11 . 51542 1 1614 . 1 . 1 168 168 VAL HG12 H 1 0.535 0.002 . 2 . . . . . 628 VAL HG12 . 51542 1 1615 . 1 . 1 168 168 VAL HG13 H 1 0.535 0.002 . 2 . . . . . 628 VAL HG13 . 51542 1 1616 . 1 . 1 168 168 VAL HG21 H 1 0.719 0.009 . 2 . . . . . 628 VAL HG21 . 51542 1 1617 . 1 . 1 168 168 VAL HG22 H 1 0.719 0.009 . 2 . . . . . 628 VAL HG22 . 51542 1 1618 . 1 . 1 168 168 VAL HG23 H 1 0.719 0.009 . 2 . . . . . 628 VAL HG23 . 51542 1 1619 . 1 . 1 168 168 VAL C C 13 174.805 0.011 . 1 . . . . . 628 VAL C . 51542 1 1620 . 1 . 1 168 168 VAL CA C 13 62.090 0.046 . 1 . . . . . 628 VAL CA . 51542 1 1621 . 1 . 1 168 168 VAL CB C 13 33.038 0.077 . 1 . . . . . 628 VAL CB . 51542 1 1622 . 1 . 1 168 168 VAL CG1 C 13 22.537 0.023 . 2 . . . . . 628 VAL CG1 . 51542 1 1623 . 1 . 1 168 168 VAL CG2 C 13 21.912 0.200 . 2 . . . . . 628 VAL CG2 . 51542 1 1624 . 1 . 1 168 168 VAL N N 15 120.046 0.050 . 1 . . . . . 628 VAL N . 51542 1 1625 . 1 . 1 169 169 VAL H H 1 8.419 0.003 . 1 . . . . . 629 VAL H . 51542 1 1626 . 1 . 1 169 169 VAL HA H 1 3.763 0.004 . 1 . . . . . 629 VAL HA . 51542 1 1627 . 1 . 1 169 169 VAL HB H 1 1.275 0.004 . 1 . . . . . 629 VAL HB . 51542 1 1628 . 1 . 1 169 169 VAL HG11 H 1 0.305 0.003 . 2 . . . . . 629 VAL HG11 . 51542 1 1629 . 1 . 1 169 169 VAL HG12 H 1 0.305 0.003 . 2 . . . . . 629 VAL HG12 . 51542 1 1630 . 1 . 1 169 169 VAL HG13 H 1 0.305 0.003 . 2 . . . . . 629 VAL HG13 . 51542 1 1631 . 1 . 1 169 169 VAL HG21 H 1 0.361 0.002 . 2 . . . . . 629 VAL HG21 . 51542 1 1632 . 1 . 1 169 169 VAL HG22 H 1 0.361 0.002 . 2 . . . . . 629 VAL HG22 . 51542 1 1633 . 1 . 1 169 169 VAL HG23 H 1 0.361 0.002 . 2 . . . . . 629 VAL HG23 . 51542 1 1634 . 1 . 1 169 169 VAL C C 13 175.075 0.029 . 1 . . . . . 629 VAL C . 51542 1 1635 . 1 . 1 169 169 VAL CA C 13 62.074 0.016 . 1 . . . . . 629 VAL CA . 51542 1 1636 . 1 . 1 169 169 VAL CB C 13 31.984 0.068 . 1 . . . . . 629 VAL CB . 51542 1 1637 . 1 . 1 169 169 VAL CG1 C 13 20.158 0.012 . 2 . . . . . 629 VAL CG1 . 51542 1 1638 . 1 . 1 169 169 VAL CG2 C 13 20.484 0.036 . 2 . . . . . 629 VAL CG2 . 51542 1 1639 . 1 . 1 169 169 VAL N N 15 130.459 0.033 . 1 . . . . . 629 VAL N . 51542 1 1640 . 1 . 1 170 170 VAL H H 1 8.543 0.002 . 1 . . . . . 630 VAL H . 51542 1 1641 . 1 . 1 170 170 VAL HA H 1 4.442 0.020 . 1 . . . . . 630 VAL HA . 51542 1 1642 . 1 . 1 170 170 VAL HB H 1 1.919 0.020 . 1 . . . . . 630 VAL HB . 51542 1 1643 . 1 . 1 170 170 VAL HG11 H 1 0.885 0.020 . 1 . . . . . 630 VAL HG11 . 51542 1 1644 . 1 . 1 170 170 VAL HG12 H 1 0.885 0.020 . 1 . . . . . 630 VAL HG12 . 51542 1 1645 . 1 . 1 170 170 VAL HG13 H 1 0.885 0.020 . 1 . . . . . 630 VAL HG13 . 51542 1 1646 . 1 . 1 170 170 VAL C C 13 176.201 0.019 . 1 . . . . . 630 VAL C . 51542 1 1647 . 1 . 1 170 170 VAL CA C 13 62.834 0.083 . 1 . . . . . 630 VAL CA . 51542 1 1648 . 1 . 1 170 170 VAL CB C 13 31.777 0.200 . 1 . . . . . 630 VAL CB . 51542 1 1649 . 1 . 1 170 170 VAL CG1 C 13 22.052 0.200 . 1 . . . . . 630 VAL CG1 . 51542 1 1650 . 1 . 1 170 170 VAL N N 15 129.572 0.065 . 1 . . . . . 630 VAL N . 51542 1 1651 . 1 . 1 171 171 VAL H H 1 9.034 0.002 . 1 . . . . . 631 VAL H . 51542 1 1652 . 1 . 1 171 171 VAL HA H 1 4.422 0.008 . 1 . . . . . 631 VAL HA . 51542 1 1653 . 1 . 1 171 171 VAL HB H 1 2.020 0.003 . 1 . . . . . 631 VAL HB . 51542 1 1654 . 1 . 1 171 171 VAL HG11 H 1 0.825 0.001 . 2 . . . . . 631 VAL HG11 . 51542 1 1655 . 1 . 1 171 171 VAL HG12 H 1 0.825 0.001 . 2 . . . . . 631 VAL HG12 . 51542 1 1656 . 1 . 1 171 171 VAL HG13 H 1 0.825 0.001 . 2 . . . . . 631 VAL HG13 . 51542 1 1657 . 1 . 1 171 171 VAL HG21 H 1 0.828 0.006 . 2 . . . . . 631 VAL HG21 . 51542 1 1658 . 1 . 1 171 171 VAL HG22 H 1 0.828 0.006 . 2 . . . . . 631 VAL HG22 . 51542 1 1659 . 1 . 1 171 171 VAL HG23 H 1 0.828 0.006 . 2 . . . . . 631 VAL HG23 . 51542 1 1660 . 1 . 1 171 171 VAL C C 13 174.743 0.015 . 1 . . . . . 631 VAL C . 51542 1 1661 . 1 . 1 171 171 VAL CA C 13 61.052 0.061 . 1 . . . . . 631 VAL CA . 51542 1 1662 . 1 . 1 171 171 VAL CB C 13 35.428 0.103 . 1 . . . . . 631 VAL CB . 51542 1 1663 . 1 . 1 171 171 VAL CG1 C 13 23.121 0.081 . 2 . . . . . 631 VAL CG1 . 51542 1 1664 . 1 . 1 171 171 VAL CG2 C 13 21.401 0.090 . 2 . . . . . 631 VAL CG2 . 51542 1 1665 . 1 . 1 171 171 VAL N N 15 125.889 0.031 . 1 . . . . . 631 VAL N . 51542 1 1666 . 1 . 1 172 172 SER H H 1 9.035 0.004 . 1 . . . . . 632 SER H . 51542 1 1667 . 1 . 1 172 172 SER C C 13 173.686 0.002 . 1 . . . . . 632 SER C . 51542 1 1668 . 1 . 1 172 172 SER CA C 13 57.995 0.001 . 1 . . . . . 632 SER CA . 51542 1 1669 . 1 . 1 172 172 SER CB C 13 64.973 0.014 . 1 . . . . . 632 SER CB . 51542 1 1670 . 1 . 1 172 172 SER N N 15 119.095 0.049 . 1 . . . . . 632 SER N . 51542 1 1671 . 1 . 1 173 173 SER H H 1 7.438 0.004 . 1 . . . . . 633 SER H . 51542 1 1672 . 1 . 1 173 173 SER HA H 1 4.451 0.002 . 1 . . . . . 633 SER HA . 51542 1 1673 . 1 . 1 173 173 SER C C 13 174.162 0.017 . 1 . . . . . 633 SER C . 51542 1 1674 . 1 . 1 173 173 SER CA C 13 57.007 0.040 . 1 . . . . . 633 SER CA . 51542 1 1675 . 1 . 1 173 173 SER CB C 13 65.994 0.200 . 1 . . . . . 633 SER CB . 51542 1 1676 . 1 . 1 173 173 SER N N 15 112.216 0.071 . 1 . . . . . 633 SER N . 51542 1 1677 . 1 . 1 174 174 GLY H H 1 9.492 0.004 . 1 . . . . . 634 GLY H . 51542 1 1678 . 1 . 1 174 174 GLY C C 13 175.326 0.200 . 1 . . . . . 634 GLY C . 51542 1 1679 . 1 . 1 174 174 GLY CA C 13 47.459 0.011 . 1 . . . . . 634 GLY CA . 51542 1 1680 . 1 . 1 174 174 GLY N N 15 109.562 0.073 . 1 . . . . . 634 GLY N . 51542 1 1681 . 1 . 1 175 175 ASP H H 1 8.216 0.004 . 1 . . . . . 635 ASP H . 51542 1 1682 . 1 . 1 175 175 ASP HA H 1 4.382 0.008 . 1 . . . . . 635 ASP HA . 51542 1 1683 . 1 . 1 175 175 ASP HB2 H 1 2.556 0.004 . 1 . . . . . 635 ASP HB2 . 51542 1 1684 . 1 . 1 175 175 ASP HB3 H 1 2.556 0.004 . 1 . . . . . 635 ASP HB3 . 51542 1 1685 . 1 . 1 175 175 ASP C C 13 178.780 0.010 . 1 . . . . . 635 ASP C . 51542 1 1686 . 1 . 1 175 175 ASP CA C 13 57.381 0.077 . 1 . . . . . 635 ASP CA . 51542 1 1687 . 1 . 1 175 175 ASP CB C 13 40.617 0.081 . 1 . . . . . 635 ASP CB . 51542 1 1688 . 1 . 1 175 175 ASP N N 15 120.751 0.043 . 1 . . . . . 635 ASP N . 51542 1 1689 . 1 . 1 176 176 GLU H H 1 7.809 0.004 . 1 . . . . . 636 GLU H . 51542 1 1690 . 1 . 1 176 176 GLU HA H 1 3.991 0.014 . 1 . . . . . 636 GLU HA . 51542 1 1691 . 1 . 1 176 176 GLU HG2 H 1 2.440 0.009 . 2 . . . . . 636 GLU HG2 . 51542 1 1692 . 1 . 1 176 176 GLU HG3 H 1 2.160 0.020 . 2 . . . . . 636 GLU HG3 . 51542 1 1693 . 1 . 1 176 176 GLU C C 13 179.203 0.200 . 1 . . . . . 636 GLU C . 51542 1 1694 . 1 . 1 176 176 GLU CA C 13 59.364 0.146 . 1 . . . . . 636 GLU CA . 51542 1 1695 . 1 . 1 176 176 GLU CB C 13 30.149 0.200 . 1 . . . . . 636 GLU CB . 51542 1 1696 . 1 . 1 176 176 GLU CG C 13 36.952 0.200 . 1 . . . . . 636 GLU CG . 51542 1 1697 . 1 . 1 176 176 GLU N N 15 119.278 0.056 . 1 . . . . . 636 GLU N . 51542 1 1698 . 1 . 1 177 177 LEU H H 1 7.549 0.002 . 1 . . . . . 637 LEU H . 51542 1 1699 . 1 . 1 177 177 LEU HA H 1 4.041 0.003 . 1 . . . . . 637 LEU HA . 51542 1 1700 . 1 . 1 177 177 LEU HB2 H 1 1.309 0.005 . 2 . . . . . 637 LEU HB2 . 51542 1 1701 . 1 . 1 177 177 LEU HB3 H 1 2.000 0.002 . 2 . . . . . 637 LEU HB3 . 51542 1 1702 . 1 . 1 177 177 LEU HG H 1 1.400 0.005 . 1 . . . . . 637 LEU HG . 51542 1 1703 . 1 . 1 177 177 LEU HD11 H 1 0.489 0.005 . 2 . . . . . 637 LEU HD11 . 51542 1 1704 . 1 . 1 177 177 LEU HD12 H 1 0.489 0.005 . 2 . . . . . 637 LEU HD12 . 51542 1 1705 . 1 . 1 177 177 LEU HD13 H 1 0.489 0.005 . 2 . . . . . 637 LEU HD13 . 51542 1 1706 . 1 . 1 177 177 LEU HD21 H 1 0.608 0.008 . 2 . . . . . 637 LEU HD21 . 51542 1 1707 . 1 . 1 177 177 LEU HD22 H 1 0.608 0.008 . 2 . . . . . 637 LEU HD22 . 51542 1 1708 . 1 . 1 177 177 LEU HD23 H 1 0.608 0.008 . 2 . . . . . 637 LEU HD23 . 51542 1 1709 . 1 . 1 177 177 LEU C C 13 177.633 0.200 . 1 . . . . . 637 LEU C . 51542 1 1710 . 1 . 1 177 177 LEU CA C 13 57.856 0.043 . 1 . . . . . 637 LEU CA . 51542 1 1711 . 1 . 1 177 177 LEU CB C 13 41.222 0.049 . 1 . . . . . 637 LEU CB . 51542 1 1712 . 1 . 1 177 177 LEU CD1 C 13 23.694 0.058 . 2 . . . . . 637 LEU CD1 . 51542 1 1713 . 1 . 1 177 177 LEU CD2 C 13 26.255 0.051 . 2 . . . . . 637 LEU CD2 . 51542 1 1714 . 1 . 1 177 177 LEU N N 15 121.867 0.071 . 1 . . . . . 637 LEU N . 51542 1 1715 . 1 . 1 178 178 LEU H H 1 8.187 0.003 . 1 . . . . . 638 LEU H . 51542 1 1716 . 1 . 1 178 178 LEU HA H 1 3.738 0.008 . 1 . . . . . 638 LEU HA . 51542 1 1717 . 1 . 1 178 178 LEU HB2 H 1 1.952 0.003 . 2 . . . . . 638 LEU HB2 . 51542 1 1718 . 1 . 1 178 178 LEU HB3 H 1 1.465 0.013 . 2 . . . . . 638 LEU HB3 . 51542 1 1719 . 1 . 1 178 178 LEU HD11 H 1 0.890 0.004 . 2 . . . . . 638 LEU HD11 . 51542 1 1720 . 1 . 1 178 178 LEU HD12 H 1 0.890 0.004 . 2 . . . . . 638 LEU HD12 . 51542 1 1721 . 1 . 1 178 178 LEU HD13 H 1 0.890 0.004 . 2 . . . . . 638 LEU HD13 . 51542 1 1722 . 1 . 1 178 178 LEU HD21 H 1 0.765 0.011 . 2 . . . . . 638 LEU HD21 . 51542 1 1723 . 1 . 1 178 178 LEU HD22 H 1 0.765 0.011 . 2 . . . . . 638 LEU HD22 . 51542 1 1724 . 1 . 1 178 178 LEU HD23 H 1 0.765 0.011 . 2 . . . . . 638 LEU HD23 . 51542 1 1725 . 1 . 1 178 178 LEU C C 13 177.384 0.012 . 1 . . . . . 638 LEU C . 51542 1 1726 . 1 . 1 178 178 LEU CA C 13 58.254 0.030 . 1 . . . . . 638 LEU CA . 51542 1 1727 . 1 . 1 178 178 LEU CB C 13 41.115 0.131 . 1 . . . . . 638 LEU CB . 51542 1 1728 . 1 . 1 178 178 LEU CD1 C 13 25.496 0.200 . 2 . . . . . 638 LEU CD1 . 51542 1 1729 . 1 . 1 178 178 LEU CD2 C 13 24.117 0.200 . 2 . . . . . 638 LEU CD2 . 51542 1 1730 . 1 . 1 178 178 LEU N N 15 119.595 0.028 . 1 . . . . . 638 LEU N . 51542 1 1731 . 1 . 1 179 179 ARG H H 1 8.033 0.001 . 1 . . . . . 639 ARG H . 51542 1 1732 . 1 . 1 179 179 ARG HA H 1 3.781 0.006 . 1 . . . . . 639 ARG HA . 51542 1 1733 . 1 . 1 179 179 ARG HB2 H 1 1.849 0.004 . 1 . . . . . 639 ARG HB2 . 51542 1 1734 . 1 . 1 179 179 ARG HB3 H 1 1.849 0.004 . 1 . . . . . 639 ARG HB3 . 51542 1 1735 . 1 . 1 179 179 ARG HG2 H 1 1.749 0.020 . 2 . . . . . 639 ARG HG2 . 51542 1 1736 . 1 . 1 179 179 ARG HG3 H 1 1.555 0.020 . 2 . . . . . 639 ARG HG3 . 51542 1 1737 . 1 . 1 179 179 ARG HD2 H 1 3.175 0.020 . 1 . . . . . 639 ARG HD2 . 51542 1 1738 . 1 . 1 179 179 ARG HD3 H 1 3.175 0.020 . 1 . . . . . 639 ARG HD3 . 51542 1 1739 . 1 . 1 179 179 ARG C C 13 179.049 0.024 . 1 . . . . . 639 ARG C . 51542 1 1740 . 1 . 1 179 179 ARG CA C 13 59.553 0.081 . 1 . . . . . 639 ARG CA . 51542 1 1741 . 1 . 1 179 179 ARG CB C 13 30.020 0.053 . 1 . . . . . 639 ARG CB . 51542 1 1742 . 1 . 1 179 179 ARG CG C 13 27.686 0.034 . 1 . . . . . 639 ARG CG . 51542 1 1743 . 1 . 1 179 179 ARG N N 15 116.154 0.049 . 1 . . . . . 639 ARG N . 51542 1 1744 . 1 . 1 180 180 PHE H H 1 7.853 0.004 . 1 . . . . . 640 PHE H . 51542 1 1745 . 1 . 1 180 180 PHE HA H 1 4.020 0.004 . 1 . . . . . 640 PHE HA . 51542 1 1746 . 1 . 1 180 180 PHE HB2 H 1 3.240 0.003 . 1 . . . . . 640 PHE HB2 . 51542 1 1747 . 1 . 1 180 180 PHE HB3 H 1 3.240 0.003 . 1 . . . . . 640 PHE HB3 . 51542 1 1748 . 1 . 1 180 180 PHE HD1 H 1 7.061 0.020 . 1 . . . . . 640 PHE HD1 . 51542 1 1749 . 1 . 1 180 180 PHE HD2 H 1 7.061 0.020 . 1 . . . . . 640 PHE HD2 . 51542 1 1750 . 1 . 1 180 180 PHE C C 13 177.279 0.005 . 1 . . . . . 640 PHE C . 51542 1 1751 . 1 . 1 180 180 PHE CA C 13 61.687 0.086 . 1 . . . . . 640 PHE CA . 51542 1 1752 . 1 . 1 180 180 PHE CB C 13 38.827 0.093 . 1 . . . . . 640 PHE CB . 51542 1 1753 . 1 . 1 180 180 PHE N N 15 119.458 0.030 . 1 . . . . . 640 PHE N . 51542 1 1754 . 1 . 1 181 181 ALA H H 1 8.340 0.002 . 1 . . . . . 641 ALA H . 51542 1 1755 . 1 . 1 181 181 ALA HA H 1 3.619 0.005 . 1 . . . . . 641 ALA HA . 51542 1 1756 . 1 . 1 181 181 ALA HB1 H 1 1.198 0.003 . 1 . . . . . 641 ALA HB1 . 51542 1 1757 . 1 . 1 181 181 ALA HB2 H 1 1.198 0.003 . 1 . . . . . 641 ALA HB2 . 51542 1 1758 . 1 . 1 181 181 ALA HB3 H 1 1.198 0.003 . 1 . . . . . 641 ALA HB3 . 51542 1 1759 . 1 . 1 181 181 ALA C C 13 177.617 0.015 . 1 . . . . . 641 ALA C . 51542 1 1760 . 1 . 1 181 181 ALA CA C 13 54.807 0.040 . 1 . . . . . 641 ALA CA . 51542 1 1761 . 1 . 1 181 181 ALA CB C 13 18.644 0.059 . 1 . . . . . 641 ALA CB . 51542 1 1762 . 1 . 1 181 181 ALA N N 15 120.841 0.056 . 1 . . . . . 641 ALA N . 51542 1 1763 . 1 . 1 182 182 ILE H H 1 7.646 0.002 . 1 . . . . . 642 ILE H . 51542 1 1764 . 1 . 1 182 182 ILE HA H 1 3.849 0.005 . 1 . . . . . 642 ILE HA . 51542 1 1765 . 1 . 1 182 182 ILE HB H 1 1.951 0.005 . 1 . . . . . 642 ILE HB . 51542 1 1766 . 1 . 1 182 182 ILE HG12 H 1 1.303 0.008 . 2 . . . . . 642 ILE HG12 . 51542 1 1767 . 1 . 1 182 182 ILE HG13 H 1 1.144 0.008 . 2 . . . . . 642 ILE HG13 . 51542 1 1768 . 1 . 1 182 182 ILE HG21 H 1 0.333 0.002 . 1 . . . . . 642 ILE HG21 . 51542 1 1769 . 1 . 1 182 182 ILE HG22 H 1 0.333 0.002 . 1 . . . . . 642 ILE HG22 . 51542 1 1770 . 1 . 1 182 182 ILE HG23 H 1 0.333 0.002 . 1 . . . . . 642 ILE HG23 . 51542 1 1771 . 1 . 1 182 182 ILE HD11 H 1 0.719 0.007 . 1 . . . . . 642 ILE HD11 . 51542 1 1772 . 1 . 1 182 182 ILE HD12 H 1 0.719 0.007 . 1 . . . . . 642 ILE HD12 . 51542 1 1773 . 1 . 1 182 182 ILE HD13 H 1 0.719 0.007 . 1 . . . . . 642 ILE HD13 . 51542 1 1774 . 1 . 1 182 182 ILE C C 13 176.870 0.003 . 1 . . . . . 642 ILE C . 51542 1 1775 . 1 . 1 182 182 ILE CA C 13 61.812 0.028 . 1 . . . . . 642 ILE CA . 51542 1 1776 . 1 . 1 182 182 ILE CB C 13 38.003 0.092 . 1 . . . . . 642 ILE CB . 51542 1 1777 . 1 . 1 182 182 ILE CG1 C 13 25.296 0.144 . 1 . . . . . 642 ILE CG1 . 51542 1 1778 . 1 . 1 182 182 ILE CG2 C 13 16.540 0.078 . 1 . . . . . 642 ILE CG2 . 51542 1 1779 . 1 . 1 182 182 ILE CD1 C 13 13.822 0.063 . 1 . . . . . 642 ILE CD1 . 51542 1 1780 . 1 . 1 182 182 ILE N N 15 107.363 0.032 . 1 . . . . . 642 ILE N . 51542 1 1781 . 1 . 1 183 183 SER H H 1 7.369 0.003 . 1 . . . . . 643 SER H . 51542 1 1782 . 1 . 1 183 183 SER HA H 1 4.576 0.011 . 1 . . . . . 643 SER HA . 51542 1 1783 . 1 . 1 183 183 SER HB2 H 1 3.978 0.010 . 2 . . . . . 643 SER HB2 . 51542 1 1784 . 1 . 1 183 183 SER HB3 H 1 3.783 0.003 . 2 . . . . . 643 SER HB3 . 51542 1 1785 . 1 . 1 183 183 SER C C 13 174.347 0.014 . 1 . . . . . 643 SER C . 51542 1 1786 . 1 . 1 183 183 SER CA C 13 58.036 0.057 . 1 . . . . . 643 SER CA . 51542 1 1787 . 1 . 1 183 183 SER CB C 13 63.997 0.089 . 1 . . . . . 643 SER CB . 51542 1 1788 . 1 . 1 183 183 SER N N 15 115.913 0.052 . 1 . . . . . 643 SER N . 51542 1 1789 . 1 . 1 184 184 ARG H H 1 7.821 0.002 . 1 . . . . . 644 ARG H . 51542 1 1790 . 1 . 1 184 184 ARG HA H 1 4.087 0.005 . 1 . . . . . 644 ARG HA . 51542 1 1791 . 1 . 1 184 184 ARG HB2 H 1 1.721 0.003 . 2 . . . . . 644 ARG HB2 . 51542 1 1792 . 1 . 1 184 184 ARG HB3 H 1 1.827 0.006 . 2 . . . . . 644 ARG HB3 . 51542 1 1793 . 1 . 1 184 184 ARG HG2 H 1 1.501 0.001 . 2 . . . . . 644 ARG HG2 . 51542 1 1794 . 1 . 1 184 184 ARG HG3 H 1 1.600 0.001 . 2 . . . . . 644 ARG HG3 . 51542 1 1795 . 1 . 1 184 184 ARG HD2 H 1 2.875 0.020 . 2 . . . . . 644 ARG HD2 . 51542 1 1796 . 1 . 1 184 184 ARG HD3 H 1 2.821 0.020 . 2 . . . . . 644 ARG HD3 . 51542 1 1797 . 1 . 1 184 184 ARG C C 13 175.538 0.009 . 1 . . . . . 644 ARG C . 51542 1 1798 . 1 . 1 184 184 ARG CA C 13 55.827 0.042 . 1 . . . . . 644 ARG CA . 51542 1 1799 . 1 . 1 184 184 ARG CB C 13 30.523 0.074 . 1 . . . . . 644 ARG CB . 51542 1 1800 . 1 . 1 184 184 ARG CG C 13 25.700 0.044 . 1 . . . . . 644 ARG CG . 51542 1 1801 . 1 . 1 184 184 ARG CD C 13 42.983 0.200 . 1 . . . . . 644 ARG CD . 51542 1 1802 . 1 . 1 184 184 ARG N N 15 122.451 0.088 . 1 . . . . . 644 ARG N . 51542 1 1803 . 1 . 1 185 185 ASP H H 1 7.938 0.002 . 1 . . . . . 645 ASP H . 51542 1 1804 . 1 . 1 185 185 ASP HA H 1 4.375 0.007 . 1 . . . . . 645 ASP HA . 51542 1 1805 . 1 . 1 185 185 ASP HB2 H 1 2.638 0.013 . 2 . . . . . 645 ASP HB2 . 51542 1 1806 . 1 . 1 185 185 ASP HB3 H 1 2.525 0.004 . 2 . . . . . 645 ASP HB3 . 51542 1 1807 . 1 . 1 185 185 ASP C C 13 180.873 0.200 . 1 . . . . . 645 ASP C . 51542 1 1808 . 1 . 1 185 185 ASP CA C 13 55.873 0.036 . 1 . . . . . 645 ASP CA . 51542 1 1809 . 1 . 1 185 185 ASP CB C 13 42.269 0.115 . 1 . . . . . 645 ASP CB . 51542 1 1810 . 1 . 1 185 185 ASP N N 15 126.317 0.064 . 1 . . . . . 645 ASP N . 51542 1 stop_ save_