data_34329 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 34329 _Entry.Title ; NMR structure of the third TPR domain of the human SPAG1 protein ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2018-11-13 _Entry.Accession_date 2018-11-13 _Entry.Last_release_date 2019-05-28 _Entry.Original_release_date 2019-05-28 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.1.32 _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_experimental_methods.ID _Entry_experimental_methods.Method _Entry_experimental_methods.Subtype _Entry_experimental_methods.Entry_ID 1 'SOLUTION NMR' 'SOLUTION NMR' 34329 stop_ 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 M. Chagot M. E. . . 34329 2 M. Quinternet M. . . . 34329 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID ATPase . 34329 CHAPERONE . 34329 EEVD . 34329 GTPase . 34329 HSP70 . 34329 HSP90 . 34329 'MD simulation' . 34329 R2SP . 34329 R2TP . 34329 RUVBL . 34329 'assembly factor' . 34329 cilia . 34329 dynein . 34329 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 34329 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 555 34329 '15N chemical shifts' 143 34329 '1H chemical shifts' 940 34329 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 2 . . 2019-07-31 2018-11-13 update BMRB 'update entry citation' 34329 1 . . 2019-05-31 2018-11-13 original author 'original release' 34329 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 6I57 . 34329 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 34329 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI 10.1042/BCJ20190198 _Citation.PubMed_ID 31118266 _Citation.Full_citation . _Citation.Title ; Binding properties of the quaternary assembly protein SPAG1. ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biochem. J.' _Citation.Journal_name_full . _Citation.Journal_volume 476 _Citation.Journal_issue 11 _Citation.Journal_ASTM BIJOAK _Citation.Journal_ISSN 1470-8728 _Citation.Journal_CSD 0043 _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 1679 _Citation.Page_last 1694 _Citation.Year 2019 _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 M. Chagot M. E. . . 34329 1 2 R. 'Dos Santos Morais' R. . . . 34329 1 3 S. Dermouche S. . . . 34329 1 4 D. Lefebvre D. . . . 34329 1 5 X. Manival X. . . . 34329 1 6 C. Chipot C. . . . 34329 1 7 F. Dehez F. . . . 34329 1 8 M. Quinternet M. . . . 34329 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 34329 _Assembly.ID 1 _Assembly.Name 'Sperm-associated antigen 1' _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 entity_1 1 $entity_1 A A yes . . . . . . 34329 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 34329 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity_1 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GPHMTFKALKEEGNQCVNDK NYKDALSKYSECLKINNKEC AIYTNRALCYLKLCQFEEAK QDCDQALQLADGNVKAFYRR ALAHKGLKNYQKSLIDLNKV ILLDPSIIEAKMELEEVTRL LNLKD ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer no _Entity.Nstd_chirality . _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 125 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method man _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 14381.639 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID HSD-3.8 na 34329 1 'Infertility-related sperm protein Spag-1' na 34329 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 1 618 GLY . 34329 1 2 619 PRO . 34329 1 3 620 HIS . 34329 1 4 621 MET . 34329 1 5 622 THR . 34329 1 6 623 PHE . 34329 1 7 624 LYS . 34329 1 8 625 ALA . 34329 1 9 626 LEU . 34329 1 10 627 LYS . 34329 1 11 628 GLU . 34329 1 12 629 GLU . 34329 1 13 630 GLY . 34329 1 14 631 ASN . 34329 1 15 632 GLN . 34329 1 16 633 CYS . 34329 1 17 634 VAL . 34329 1 18 635 ASN . 34329 1 19 636 ASP . 34329 1 20 637 LYS . 34329 1 21 638 ASN . 34329 1 22 639 TYR . 34329 1 23 640 LYS . 34329 1 24 641 ASP . 34329 1 25 642 ALA . 34329 1 26 643 LEU . 34329 1 27 644 SER . 34329 1 28 645 LYS . 34329 1 29 646 TYR . 34329 1 30 647 SER . 34329 1 31 648 GLU . 34329 1 32 649 CYS . 34329 1 33 650 LEU . 34329 1 34 651 LYS . 34329 1 35 652 ILE . 34329 1 36 653 ASN . 34329 1 37 654 ASN . 34329 1 38 655 LYS . 34329 1 39 656 GLU . 34329 1 40 657 CYS . 34329 1 41 658 ALA . 34329 1 42 659 ILE . 34329 1 43 660 TYR . 34329 1 44 661 THR . 34329 1 45 662 ASN . 34329 1 46 663 ARG . 34329 1 47 664 ALA . 34329 1 48 665 LEU . 34329 1 49 666 CYS . 34329 1 50 667 TYR . 34329 1 51 668 LEU . 34329 1 52 669 LYS . 34329 1 53 670 LEU . 34329 1 54 671 CYS . 34329 1 55 672 GLN . 34329 1 56 673 PHE . 34329 1 57 674 GLU . 34329 1 58 675 GLU . 34329 1 59 676 ALA . 34329 1 60 677 LYS . 34329 1 61 678 GLN . 34329 1 62 679 ASP . 34329 1 63 680 CYS . 34329 1 64 681 ASP . 34329 1 65 682 GLN . 34329 1 66 683 ALA . 34329 1 67 684 LEU . 34329 1 68 685 GLN . 34329 1 69 686 LEU . 34329 1 70 687 ALA . 34329 1 71 688 ASP . 34329 1 72 689 GLY . 34329 1 73 690 ASN . 34329 1 74 691 VAL . 34329 1 75 692 LYS . 34329 1 76 693 ALA . 34329 1 77 694 PHE . 34329 1 78 695 TYR . 34329 1 79 696 ARG . 34329 1 80 697 ARG . 34329 1 81 698 ALA . 34329 1 82 699 LEU . 34329 1 83 700 ALA . 34329 1 84 701 HIS . 34329 1 85 702 LYS . 34329 1 86 703 GLY . 34329 1 87 704 LEU . 34329 1 88 705 LYS . 34329 1 89 706 ASN . 34329 1 90 707 TYR . 34329 1 91 708 GLN . 34329 1 92 709 LYS . 34329 1 93 710 SER . 34329 1 94 711 LEU . 34329 1 95 712 ILE . 34329 1 96 713 ASP . 34329 1 97 714 LEU . 34329 1 98 715 ASN . 34329 1 99 716 LYS . 34329 1 100 717 VAL . 34329 1 101 718 ILE . 34329 1 102 719 LEU . 34329 1 103 720 LEU . 34329 1 104 721 ASP . 34329 1 105 722 PRO . 34329 1 106 723 SER . 34329 1 107 724 ILE . 34329 1 108 725 ILE . 34329 1 109 726 GLU . 34329 1 110 727 ALA . 34329 1 111 728 LYS . 34329 1 112 729 MET . 34329 1 113 730 GLU . 34329 1 114 731 LEU . 34329 1 115 732 GLU . 34329 1 116 733 GLU . 34329 1 117 734 VAL . 34329 1 118 735 THR . 34329 1 119 736 ARG . 34329 1 120 737 LEU . 34329 1 121 738 LEU . 34329 1 122 739 ASN . 34329 1 123 740 LEU . 34329 1 124 741 LYS . 34329 1 125 742 ASP . 34329 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 34329 1 . PRO 2 2 34329 1 . HIS 3 3 34329 1 . MET 4 4 34329 1 . THR 5 5 34329 1 . PHE 6 6 34329 1 . LYS 7 7 34329 1 . ALA 8 8 34329 1 . LEU 9 9 34329 1 . LYS 10 10 34329 1 . GLU 11 11 34329 1 . GLU 12 12 34329 1 . GLY 13 13 34329 1 . ASN 14 14 34329 1 . GLN 15 15 34329 1 . CYS 16 16 34329 1 . VAL 17 17 34329 1 . ASN 18 18 34329 1 . ASP 19 19 34329 1 . LYS 20 20 34329 1 . ASN 21 21 34329 1 . TYR 22 22 34329 1 . LYS 23 23 34329 1 . ASP 24 24 34329 1 . ALA 25 25 34329 1 . LEU 26 26 34329 1 . SER 27 27 34329 1 . LYS 28 28 34329 1 . TYR 29 29 34329 1 . SER 30 30 34329 1 . GLU 31 31 34329 1 . CYS 32 32 34329 1 . LEU 33 33 34329 1 . LYS 34 34 34329 1 . ILE 35 35 34329 1 . ASN 36 36 34329 1 . ASN 37 37 34329 1 . LYS 38 38 34329 1 . GLU 39 39 34329 1 . CYS 40 40 34329 1 . ALA 41 41 34329 1 . ILE 42 42 34329 1 . TYR 43 43 34329 1 . THR 44 44 34329 1 . ASN 45 45 34329 1 . ARG 46 46 34329 1 . ALA 47 47 34329 1 . LEU 48 48 34329 1 . CYS 49 49 34329 1 . TYR 50 50 34329 1 . LEU 51 51 34329 1 . LYS 52 52 34329 1 . LEU 53 53 34329 1 . CYS 54 54 34329 1 . GLN 55 55 34329 1 . PHE 56 56 34329 1 . GLU 57 57 34329 1 . GLU 58 58 34329 1 . ALA 59 59 34329 1 . LYS 60 60 34329 1 . GLN 61 61 34329 1 . ASP 62 62 34329 1 . CYS 63 63 34329 1 . ASP 64 64 34329 1 . GLN 65 65 34329 1 . ALA 66 66 34329 1 . LEU 67 67 34329 1 . GLN 68 68 34329 1 . LEU 69 69 34329 1 . ALA 70 70 34329 1 . ASP 71 71 34329 1 . GLY 72 72 34329 1 . ASN 73 73 34329 1 . VAL 74 74 34329 1 . LYS 75 75 34329 1 . ALA 76 76 34329 1 . PHE 77 77 34329 1 . TYR 78 78 34329 1 . ARG 79 79 34329 1 . ARG 80 80 34329 1 . ALA 81 81 34329 1 . LEU 82 82 34329 1 . ALA 83 83 34329 1 . HIS 84 84 34329 1 . LYS 85 85 34329 1 . GLY 86 86 34329 1 . LEU 87 87 34329 1 . LYS 88 88 34329 1 . ASN 89 89 34329 1 . TYR 90 90 34329 1 . GLN 91 91 34329 1 . LYS 92 92 34329 1 . SER 93 93 34329 1 . LEU 94 94 34329 1 . ILE 95 95 34329 1 . ASP 96 96 34329 1 . LEU 97 97 34329 1 . ASN 98 98 34329 1 . LYS 99 99 34329 1 . VAL 100 100 34329 1 . ILE 101 101 34329 1 . LEU 102 102 34329 1 . LEU 103 103 34329 1 . ASP 104 104 34329 1 . PRO 105 105 34329 1 . SER 106 106 34329 1 . ILE 107 107 34329 1 . ILE 108 108 34329 1 . GLU 109 109 34329 1 . ALA 110 110 34329 1 . LYS 111 111 34329 1 . MET 112 112 34329 1 . GLU 113 113 34329 1 . LEU 114 114 34329 1 . GLU 115 115 34329 1 . GLU 116 116 34329 1 . VAL 117 117 34329 1 . THR 118 118 34329 1 . ARG 119 119 34329 1 . LEU 120 120 34329 1 . LEU 121 121 34329 1 . ASN 122 122 34329 1 . LEU 123 123 34329 1 . LYS 124 124 34329 1 . ASP 125 125 34329 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 34329 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity_1 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . SPAG1 . 34329 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source _Entity_experimental_src_list.Entry_ID 34329 _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 BL21(DE3)' . . 469008 . . . . . . . . . . . . 34329 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 34329 _Sample.ID 1 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details '1 mM [U-13C; U-15N] SPAG1-TPR3, 150 mM sodium chloride, 10 mM sodium phosphate, 0.5 mM TCEP, 95% H2O/5% D2O' _Sample.Aggregate_sample_number . _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 SPAG1-TPR3 '[U-13C; U-15N]' . . 1 $entity_1 . . 1 . . mM . . . . 34329 1 2 'sodium chloride' 'natural abundance' . . . . . . 150 . . mM . . . . 34329 1 3 'sodium phosphate' 'natural abundance' . . . . . . 10 . . mM . . . . 34329 1 4 TCEP 'natural abundance' . . . . . . 0.5 . . mM . . . . 34329 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 34329 _Sample_condition_list.ID 1 _Sample_condition_list.Name . _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' 150 . mM 34329 1 pH 6.4 . pH 34329 1 pressure 1 . atm 34329 1 temperature 293 . K 34329 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 34329 _Software.ID 1 _Software.Type . _Software.Name TopSpin _Software.Version 3.2 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 34329 1 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . collection 34329 1 . processing 34329 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 34329 _Software.ID 2 _Software.Type . _Software.Name CARA _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Keller and Wuthrich' . . 34329 2 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . 'chemical shift assignment' 34329 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 34329 _Software.ID 3 _Software.Type . _Software.Name CYANA _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . 34329 3 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . 'structure calculation' 34329 3 stop_ save_ save_software_4 _Software.Sf_category software _Software.Sf_framecode software_4 _Software.Entry_ID 34329 _Software.ID 4 _Software.Type . _Software.Name TALOS _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Cornilescu, Delaglio and Bax' . . 34329 4 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . 'structure calculation' 34329 4 stop_ save_ save_software_5 _Software.Sf_category software _Software.Sf_framecode software_5 _Software.Entry_ID 34329 _Software.ID 5 _Software.Type . _Software.Name PREDITOR _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Berjanskii MV, Neal S, Wishart DS.' . . 34329 5 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . 'structure calculation' 34329 5 stop_ save_ save_software_6 _Software.Sf_category software _Software.Sf_framecode software_6 _Software.Entry_ID 34329 _Software.ID 6 _Software.Type . _Software.Name CNS _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Brunger, Adams, Clore, Gros, Nilges and Read' . . 34329 6 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . refinement 34329 6 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 34329 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model AvanceIII _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 34329 _NMR_spectrometer_list.ID 1 _NMR_spectrometer_list.Name . loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 NMR_spectrometer_1 Bruker AvanceIII . 600 . . . 34329 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 34329 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34329 1 2 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34329 1 3 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34329 1 4 '3D HBHA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34329 1 5 '3D H(CCO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34329 1 6 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34329 1 7 '3D HNHA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34329 1 8 '3D HCCH-TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34329 1 9 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34329 1 10 '2D 1H-1H NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34329 1 11 '2D 1H-13C HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34329 1 12 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34329 1 13 '3D 1H-13C NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34329 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 34329 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name . _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.000 internal indirect 0.25144953 . . . . . 34329 1 H 1 DSS 'methyl protons' . . . . ppm 0.000 internal direct 1.0 . . . . . 34329 1 N 15 DSS 'methyl protons' . . . . ppm 0.000 internal indirect 0.10132912 . . . . . 34329 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 34329 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '3D CBCA(CO)NH' . . . 34329 1 2 '3D HNCA' . . . 34329 1 3 '3D HNCACB' . . . 34329 1 4 '3D HBHA(CO)NH' . . . 34329 1 5 '3D H(CCO)NH' . . . 34329 1 6 '3D 1H-15N NOESY' . . . 34329 1 7 '3D HNHA' . . . 34329 1 8 '3D HCCH-TOCSY' . . . 34329 1 9 '3D HNCO' . . . 34329 1 10 '2D 1H-1H NOESY' . . . 34329 1 11 '2D 1H-13C HSQC' . . . 34329 1 12 '2D 1H-15N HSQC' . . . 34329 1 13 '3D 1H-13C NOESY' . . . 34329 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 GLY HA2 H 1 3.836 0.020 . 2 . . . . A 618 GLY HA2 . 34329 1 2 . 1 1 1 1 GLY HA3 H 1 3.836 0.020 . 2 . . . . A 618 GLY HA3 . 34329 1 3 . 1 1 1 1 GLY CA C 13 40.408 0.300 . 1 . . . . A 618 GLY CA . 34329 1 4 . 1 1 2 2 PRO HA H 1 4.290 0.020 . 1 . . . . A 619 PRO HA . 34329 1 5 . 1 1 2 2 PRO HB2 H 1 1.696 0.020 . 1 . . . . A 619 PRO HB2 . 34329 1 6 . 1 1 2 2 PRO HB3 H 1 2.129 0.020 . 1 . . . . A 619 PRO HB3 . 34329 1 7 . 1 1 2 2 PRO HG2 H 1 1.794 0.020 . 1 . . . . A 619 PRO HG2 . 34329 1 8 . 1 1 2 2 PRO HG3 H 1 1.849 0.020 . 1 . . . . A 619 PRO HG3 . 34329 1 9 . 1 1 2 2 PRO HD2 H 1 3.401 0.020 . 1 . . . . A 619 PRO HD2 . 34329 1 10 . 1 1 2 2 PRO HD3 H 1 3.439 0.020 . 1 . . . . A 619 PRO HD3 . 34329 1 11 . 1 1 2 2 PRO C C 13 173.843 0.300 . 1 . . . . A 619 PRO C . 34329 1 12 . 1 1 2 2 PRO CA C 13 60.341 0.300 . 1 . . . . A 619 PRO CA . 34329 1 13 . 1 1 2 2 PRO CB C 13 29.366 0.300 . 1 . . . . A 619 PRO CB . 34329 1 14 . 1 1 2 2 PRO CG C 13 24.085 0.300 . 1 . . . . A 619 PRO CG . 34329 1 15 . 1 1 2 2 PRO CD C 13 46.626 0.300 . 1 . . . . A 619 PRO CD . 34329 1 16 . 1 1 3 3 HIS H H 1 8.503 0.020 . 1 . . . . A 620 HIS H . 34329 1 17 . 1 1 3 3 HIS HA H 1 4.481 0.020 . 1 . . . . A 620 HIS HA . 34329 1 18 . 1 1 3 3 HIS HB2 H 1 3.040 0.020 . 2 . . . . A 620 HIS HB2 . 34329 1 19 . 1 1 3 3 HIS HB3 H 1 3.040 0.020 . 2 . . . . A 620 HIS HB3 . 34329 1 20 . 1 1 3 3 HIS HD2 H 1 7.028 0.020 . 1 . . . . A 620 HIS HD2 . 34329 1 21 . 1 1 3 3 HIS HE1 H 1 8.071 0.020 . 1 . . . . A 620 HIS HE1 . 34329 1 22 . 1 1 3 3 HIS C C 13 172.592 0.300 . 1 . . . . A 620 HIS C . 34329 1 23 . 1 1 3 3 HIS CA C 13 53.479 0.300 . 1 . . . . A 620 HIS CA . 34329 1 24 . 1 1 3 3 HIS CB C 13 26.692 0.300 . 1 . . . . A 620 HIS CB . 34329 1 25 . 1 1 3 3 HIS CD2 C 13 129.289 0.300 . 1 . . . . A 620 HIS CD2 . 34329 1 26 . 1 1 3 3 HIS CE1 C 13 134.884 0.300 . 1 . . . . A 620 HIS CE1 . 34329 1 27 . 1 1 3 3 HIS N N 15 119.205 0.300 . 1 . . . . A 620 HIS N . 34329 1 28 . 1 1 3 3 HIS ND1 N 15 199.195 0.300 . 1 . . . . A 620 HIS ND1 . 34329 1 29 . 1 1 3 3 HIS NE2 N 15 176.490 0.300 . 1 . . . . A 620 HIS NE2 . 34329 1 30 . 1 1 4 4 MET H H 1 8.262 0.020 . 1 . . . . A 621 MET H . 34329 1 31 . 1 1 4 4 MET HA H 1 4.432 0.020 . 1 . . . . A 621 MET HA . 34329 1 32 . 1 1 4 4 MET HB2 H 1 1.866 0.020 . 2 . . . . A 621 MET HB2 . 34329 1 33 . 1 1 4 4 MET HB3 H 1 1.866 0.020 . 2 . . . . A 621 MET HB3 . 34329 1 34 . 1 1 4 4 MET HG2 H 1 2.359 0.020 . 1 . . . . A 621 MET HG2 . 34329 1 35 . 1 1 4 4 MET HG3 H 1 2.460 0.020 . 1 . . . . A 621 MET HG3 . 34329 1 36 . 1 1 4 4 MET HE1 H 1 1.878 0.020 . 1 . . . . A 621 MET HE1 . 34329 1 37 . 1 1 4 4 MET HE2 H 1 1.878 0.020 . 1 . . . . A 621 MET HE2 . 34329 1 38 . 1 1 4 4 MET HE3 H 1 1.878 0.020 . 1 . . . . A 621 MET HE3 . 34329 1 39 . 1 1 4 4 MET C C 13 173.701 0.300 . 1 . . . . A 621 MET C . 34329 1 40 . 1 1 4 4 MET CA C 13 52.539 0.300 . 1 . . . . A 621 MET CA . 34329 1 41 . 1 1 4 4 MET CB C 13 29.327 0.300 . 1 . . . . A 621 MET CB . 34329 1 42 . 1 1 4 4 MET CG C 13 29.264 0.300 . 1 . . . . A 621 MET CG . 34329 1 43 . 1 1 4 4 MET CE C 13 13.964 0.300 . 1 . . . . A 621 MET CE . 34329 1 44 . 1 1 4 4 MET N N 15 121.967 0.300 . 1 . . . . A 621 MET N . 34329 1 45 . 1 1 5 5 THR H H 1 7.754 0.020 . 1 . . . . A 622 THR H . 34329 1 46 . 1 1 5 5 THR HA H 1 4.224 0.020 . 1 . . . . A 622 THR HA . 34329 1 47 . 1 1 5 5 THR HB H 1 4.466 0.020 . 1 . . . . A 622 THR HB . 34329 1 48 . 1 1 5 5 THR HG21 H 1 1.181 0.020 . 1 . . . . A 622 THR HG21 . 34329 1 49 . 1 1 5 5 THR HG22 H 1 1.181 0.020 . 1 . . . . A 622 THR HG22 . 34329 1 50 . 1 1 5 5 THR HG23 H 1 1.181 0.020 . 1 . . . . A 622 THR HG23 . 34329 1 51 . 1 1 5 5 THR C C 13 171.542 0.300 . 1 . . . . A 622 THR C . 34329 1 52 . 1 1 5 5 THR CA C 13 58.627 0.300 . 1 . . . . A 622 THR CA . 34329 1 53 . 1 1 5 5 THR CB C 13 67.846 0.300 . 1 . . . . A 622 THR CB . 34329 1 54 . 1 1 5 5 THR CG2 C 13 19.197 0.300 . 1 . . . . A 622 THR CG2 . 34329 1 55 . 1 1 5 5 THR N N 15 112.963 0.300 . 1 . . . . A 622 THR N . 34329 1 56 . 1 1 6 6 PHE H H 1 8.887 0.020 . 1 . . . . A 623 PHE H . 34329 1 57 . 1 1 6 6 PHE HA H 1 3.890 0.020 . 1 . . . . A 623 PHE HA . 34329 1 58 . 1 1 6 6 PHE HB2 H 1 3.114 0.020 . 2 . . . . A 623 PHE HB2 . 34329 1 59 . 1 1 6 6 PHE HB3 H 1 3.114 0.020 . 2 . . . . A 623 PHE HB3 . 34329 1 60 . 1 1 6 6 PHE HD1 H 1 7.186 0.020 . 3 . . . . A 623 PHE HD1 . 34329 1 61 . 1 1 6 6 PHE HD2 H 1 7.186 0.020 . 3 . . . . A 623 PHE HD2 . 34329 1 62 . 1 1 6 6 PHE HE1 H 1 7.367 0.020 . 3 . . . . A 623 PHE HE1 . 34329 1 63 . 1 1 6 6 PHE HE2 H 1 7.367 0.020 . 3 . . . . A 623 PHE HE2 . 34329 1 64 . 1 1 6 6 PHE HZ H 1 7.072 0.020 . 1 . . . . A 623 PHE HZ . 34329 1 65 . 1 1 6 6 PHE C C 13 173.143 0.300 . 1 . . . . A 623 PHE C . 34329 1 66 . 1 1 6 6 PHE CA C 13 59.408 0.300 . 1 . . . . A 623 PHE CA . 34329 1 67 . 1 1 6 6 PHE CB C 13 36.600 0.300 . 1 . . . . A 623 PHE CB . 34329 1 68 . 1 1 6 6 PHE CD1 C 13 129.545 0.300 . 1 . . . . A 623 PHE CD1 . 34329 1 69 . 1 1 6 6 PHE CE1 C 13 128.869 0.300 . 1 . . . . A 623 PHE CE1 . 34329 1 70 . 1 1 6 6 PHE CZ C 13 127.070 0.300 . 1 . . . . A 623 PHE CZ . 34329 1 71 . 1 1 6 6 PHE N N 15 121.667 0.300 . 1 . . . . A 623 PHE N . 34329 1 72 . 1 1 7 7 LYS H H 1 8.332 0.020 . 1 . . . . A 624 LYS H . 34329 1 73 . 1 1 7 7 LYS HA H 1 3.617 0.020 . 1 . . . . A 624 LYS HA . 34329 1 74 . 1 1 7 7 LYS HB2 H 1 1.652 0.020 . 1 . . . . A 624 LYS HB2 . 34329 1 75 . 1 1 7 7 LYS HB3 H 1 1.865 0.020 . 1 . . . . A 624 LYS HB3 . 34329 1 76 . 1 1 7 7 LYS HG2 H 1 1.253 0.020 . 1 . . . . A 624 LYS HG2 . 34329 1 77 . 1 1 7 7 LYS HG3 H 1 1.405 0.020 . 1 . . . . A 624 LYS HG3 . 34329 1 78 . 1 1 7 7 LYS HD2 H 1 1.574 0.020 . 2 . . . . A 624 LYS HD2 . 34329 1 79 . 1 1 7 7 LYS HD3 H 1 1.574 0.020 . 2 . . . . A 624 LYS HD3 . 34329 1 80 . 1 1 7 7 LYS HE2 H 1 2.880 0.020 . 2 . . . . A 624 LYS HE2 . 34329 1 81 . 1 1 7 7 LYS HE3 H 1 2.880 0.020 . 2 . . . . A 624 LYS HE3 . 34329 1 82 . 1 1 7 7 LYS C C 13 175.077 0.300 . 1 . . . . A 624 LYS C . 34329 1 83 . 1 1 7 7 LYS CA C 13 57.087 0.300 . 1 . . . . A 624 LYS CA . 34329 1 84 . 1 1 7 7 LYS CB C 13 30.024 0.300 . 1 . . . . A 624 LYS CB . 34329 1 85 . 1 1 7 7 LYS CG C 13 22.235 0.300 . 1 . . . . A 624 LYS CG . 34329 1 86 . 1 1 7 7 LYS CD C 13 27.152 0.300 . 1 . . . . A 624 LYS CD . 34329 1 87 . 1 1 7 7 LYS CE C 13 39.278 0.300 . 1 . . . . A 624 LYS CE . 34329 1 88 . 1 1 7 7 LYS N N 15 117.206 0.300 . 1 . . . . A 624 LYS N . 34329 1 89 . 1 1 8 8 ALA H H 1 7.572 0.020 . 1 . . . . A 625 ALA H . 34329 1 90 . 1 1 8 8 ALA HA H 1 3.960 0.020 . 1 . . . . A 625 ALA HA . 34329 1 91 . 1 1 8 8 ALA HB1 H 1 1.289 0.020 . 1 . . . . A 625 ALA HB1 . 34329 1 92 . 1 1 8 8 ALA HB2 H 1 1.289 0.020 . 1 . . . . A 625 ALA HB2 . 34329 1 93 . 1 1 8 8 ALA HB3 H 1 1.289 0.020 . 1 . . . . A 625 ALA HB3 . 34329 1 94 . 1 1 8 8 ALA C C 13 177.811 0.300 . 1 . . . . A 625 ALA C . 34329 1 95 . 1 1 8 8 ALA CA C 13 51.942 0.300 . 1 . . . . A 625 ALA CA . 34329 1 96 . 1 1 8 8 ALA CB C 13 15.807 0.300 . 1 . . . . A 625 ALA CB . 34329 1 97 . 1 1 8 8 ALA N N 15 120.493 0.300 . 1 . . . . A 625 ALA N . 34329 1 98 . 1 1 9 9 LEU H H 1 7.996 0.020 . 1 . . . . A 626 LEU H . 34329 1 99 . 1 1 9 9 LEU HA H 1 3.703 0.020 . 1 . . . . A 626 LEU HA . 34329 1 100 . 1 1 9 9 LEU HB2 H 1 1.191 0.020 . 1 . . . . A 626 LEU HB2 . 34329 1 101 . 1 1 9 9 LEU HB3 H 1 1.650 0.020 . 1 . . . . A 626 LEU HB3 . 34329 1 102 . 1 1 9 9 LEU HG H 1 1.472 0.020 . 1 . . . . A 626 LEU HG . 34329 1 103 . 1 1 9 9 LEU HD11 H 1 0.594 0.020 . 2 . . . . A 626 LEU HD11 . 34329 1 104 . 1 1 9 9 LEU HD12 H 1 0.594 0.020 . 2 . . . . A 626 LEU HD12 . 34329 1 105 . 1 1 9 9 LEU HD13 H 1 0.594 0.020 . 2 . . . . A 626 LEU HD13 . 34329 1 106 . 1 1 9 9 LEU HD21 H 1 0.707 0.020 . 2 . . . . A 626 LEU HD21 . 34329 1 107 . 1 1 9 9 LEU HD22 H 1 0.707 0.020 . 2 . . . . A 626 LEU HD22 . 34329 1 108 . 1 1 9 9 LEU HD23 H 1 0.707 0.020 . 2 . . . . A 626 LEU HD23 . 34329 1 109 . 1 1 9 9 LEU C C 13 175.731 0.300 . 1 . . . . A 626 LEU C . 34329 1 110 . 1 1 9 9 LEU CA C 13 54.984 0.300 . 1 . . . . A 626 LEU CA . 34329 1 111 . 1 1 9 9 LEU CB C 13 41.398 0.300 . 1 . . . . A 626 LEU CB . 34329 1 112 . 1 1 9 9 LEU CG C 13 24.123 0.300 . 1 . . . . A 626 LEU CG . 34329 1 113 . 1 1 9 9 LEU CD1 C 13 22.788 0.300 . 1 . . . . A 626 LEU CD1 . 34329 1 114 . 1 1 9 9 LEU CD2 C 13 20.670 0.300 . 1 . . . . A 626 LEU CD2 . 34329 1 115 . 1 1 9 9 LEU N N 15 120.196 0.300 . 1 . . . . A 626 LEU N . 34329 1 116 . 1 1 10 10 LYS H H 1 8.094 0.020 . 1 . . . . A 627 LYS H . 34329 1 117 . 1 1 10 10 LYS HA H 1 3.427 0.020 . 1 . . . . A 627 LYS HA . 34329 1 118 . 1 1 10 10 LYS HB2 H 1 1.155 0.020 . 1 . . . . A 627 LYS HB2 . 34329 1 119 . 1 1 10 10 LYS HB3 H 1 1.536 0.020 . 1 . . . . A 627 LYS HB3 . 34329 1 120 . 1 1 10 10 LYS HG2 H 1 1.045 0.020 . 1 . . . . A 627 LYS HG2 . 34329 1 121 . 1 1 10 10 LYS HG3 H 1 1.090 0.020 . 1 . . . . A 627 LYS HG3 . 34329 1 122 . 1 1 10 10 LYS HD2 H 1 1.453 0.020 . 2 . . . . A 627 LYS HD2 . 34329 1 123 . 1 1 10 10 LYS HD3 H 1 1.453 0.020 . 2 . . . . A 627 LYS HD3 . 34329 1 124 . 1 1 10 10 LYS HE2 H 1 2.652 0.020 . 1 . . . . A 627 LYS HE2 . 34329 1 125 . 1 1 10 10 LYS HE3 H 1 2.767 0.020 . 1 . . . . A 627 LYS HE3 . 34329 1 126 . 1 1 10 10 LYS C C 13 175.287 0.300 . 1 . . . . A 627 LYS C . 34329 1 127 . 1 1 10 10 LYS CA C 13 57.227 0.300 . 1 . . . . A 627 LYS CA . 34329 1 128 . 1 1 10 10 LYS CB C 13 28.962 0.300 . 1 . . . . A 627 LYS CB . 34329 1 129 . 1 1 10 10 LYS CG C 13 21.828 0.300 . 1 . . . . A 627 LYS CG . 34329 1 130 . 1 1 10 10 LYS CD C 13 27.258 0.300 . 1 . . . . A 627 LYS CD . 34329 1 131 . 1 1 10 10 LYS CE C 13 39.150 0.300 . 1 . . . . A 627 LYS CE . 34329 1 132 . 1 1 10 10 LYS N N 15 120.602 0.300 . 1 . . . . A 627 LYS N . 34329 1 133 . 1 1 11 11 GLU H H 1 7.791 0.020 . 1 . . . . A 628 GLU H . 34329 1 134 . 1 1 11 11 GLU HA H 1 3.855 0.020 . 1 . . . . A 628 GLU HA . 34329 1 135 . 1 1 11 11 GLU HB2 H 1 1.884 0.020 . 1 . . . . A 628 GLU HB2 . 34329 1 136 . 1 1 11 11 GLU HB3 H 1 1.961 0.020 . 1 . . . . A 628 GLU HB3 . 34329 1 137 . 1 1 11 11 GLU HG2 H 1 2.172 0.020 . 1 . . . . A 628 GLU HG2 . 34329 1 138 . 1 1 11 11 GLU HG3 H 1 2.328 0.020 . 1 . . . . A 628 GLU HG3 . 34329 1 139 . 1 1 11 11 GLU C C 13 177.064 0.300 . 1 . . . . A 628 GLU C . 34329 1 140 . 1 1 11 11 GLU CA C 13 56.322 0.300 . 1 . . . . A 628 GLU CA . 34329 1 141 . 1 1 11 11 GLU CB C 13 25.895 0.300 . 1 . . . . A 628 GLU CB . 34329 1 142 . 1 1 11 11 GLU CG C 13 33.368 0.300 . 1 . . . . A 628 GLU CG . 34329 1 143 . 1 1 11 11 GLU N N 15 117.803 0.300 . 1 . . . . A 628 GLU N . 34329 1 144 . 1 1 12 12 GLU H H 1 8.178 0.020 . 1 . . . . A 629 GLU H . 34329 1 145 . 1 1 12 12 GLU HA H 1 3.890 0.020 . 1 . . . . A 629 GLU HA . 34329 1 146 . 1 1 12 12 GLU HB2 H 1 1.654 0.020 . 1 . . . . A 629 GLU HB2 . 34329 1 147 . 1 1 12 12 GLU HB3 H 1 1.957 0.020 . 1 . . . . A 629 GLU HB3 . 34329 1 148 . 1 1 12 12 GLU HG2 H 1 1.946 0.020 . 1 . . . . A 629 GLU HG2 . 34329 1 149 . 1 1 12 12 GLU HG3 H 1 2.357 0.020 . 1 . . . . A 629 GLU HG3 . 34329 1 150 . 1 1 12 12 GLU C C 13 177.171 0.300 . 1 . . . . A 629 GLU C . 34329 1 151 . 1 1 12 12 GLU CA C 13 56.713 0.300 . 1 . . . . A 629 GLU CA . 34329 1 152 . 1 1 12 12 GLU CB C 13 26.616 0.300 . 1 . . . . A 629 GLU CB . 34329 1 153 . 1 1 12 12 GLU CG C 13 33.860 0.300 . 1 . . . . A 629 GLU CG . 34329 1 154 . 1 1 12 12 GLU N N 15 120.797 0.300 . 1 . . . . A 629 GLU N . 34329 1 155 . 1 1 13 13 GLY H H 1 8.591 0.020 . 1 . . . . A 630 GLY H . 34329 1 156 . 1 1 13 13 GLY HA2 H 1 2.692 0.020 . 1 . . . . A 630 GLY HA2 . 34329 1 157 . 1 1 13 13 GLY HA3 H 1 2.813 0.020 . 1 . . . . A 630 GLY HA3 . 34329 1 158 . 1 1 13 13 GLY C C 13 171.197 0.300 . 1 . . . . A 630 GLY C . 34329 1 159 . 1 1 13 13 GLY CA C 13 44.684 0.300 . 1 . . . . A 630 GLY CA . 34329 1 160 . 1 1 13 13 GLY N N 15 108.897 0.300 . 1 . . . . A 630 GLY N . 34329 1 161 . 1 1 14 14 ASN H H 1 8.479 0.020 . 1 . . . . A 631 ASN H . 34329 1 162 . 1 1 14 14 ASN HA H 1 4.153 0.020 . 1 . . . . A 631 ASN HA . 34329 1 163 . 1 1 14 14 ASN HB2 H 1 2.745 0.020 . 1 . . . . A 631 ASN HB2 . 34329 1 164 . 1 1 14 14 ASN HB3 H 1 2.909 0.020 . 1 . . . . A 631 ASN HB3 . 34329 1 165 . 1 1 14 14 ASN HD21 H 1 7.727 0.020 . 1 . . . . A 631 ASN HD21 . 34329 1 166 . 1 1 14 14 ASN HD22 H 1 6.416 0.020 . 1 . . . . A 631 ASN HD22 . 34329 1 167 . 1 1 14 14 ASN C C 13 175.180 0.300 . 1 . . . . A 631 ASN C . 34329 1 168 . 1 1 14 14 ASN CA C 13 52.514 0.300 . 1 . . . . A 631 ASN CA . 34329 1 169 . 1 1 14 14 ASN CB C 13 33.995 0.300 . 1 . . . . A 631 ASN CB . 34329 1 170 . 1 1 14 14 ASN N N 15 119.781 0.300 . 1 . . . . A 631 ASN N . 34329 1 171 . 1 1 14 14 ASN ND2 N 15 110.199 0.300 . 1 . . . . A 631 ASN ND2 . 34329 1 172 . 1 1 15 15 GLN H H 1 8.151 0.020 . 1 . . . . A 632 GLN H . 34329 1 173 . 1 1 15 15 GLN HA H 1 3.811 0.020 . 1 . . . . A 632 GLN HA . 34329 1 174 . 1 1 15 15 GLN HB2 H 1 2.053 0.020 . 2 . . . . A 632 GLN HB2 . 34329 1 175 . 1 1 15 15 GLN HB3 H 1 2.053 0.020 . 2 . . . . A 632 GLN HB3 . 34329 1 176 . 1 1 15 15 GLN HG2 H 1 2.248 0.020 . 1 . . . . A 632 GLN HG2 . 34329 1 177 . 1 1 15 15 GLN HG3 H 1 2.287 0.020 . 1 . . . . A 632 GLN HG3 . 34329 1 178 . 1 1 15 15 GLN HE21 H 1 7.673 0.020 . 1 . . . . A 632 GLN HE21 . 34329 1 179 . 1 1 15 15 GLN HE22 H 1 6.758 0.020 . 1 . . . . A 632 GLN HE22 . 34329 1 180 . 1 1 15 15 GLN C C 13 175.251 0.300 . 1 . . . . A 632 GLN C . 34329 1 181 . 1 1 15 15 GLN CA C 13 55.725 0.300 . 1 . . . . A 632 GLN CA . 34329 1 182 . 1 1 15 15 GLN CB C 13 24.740 0.300 . 1 . . . . A 632 GLN CB . 34329 1 183 . 1 1 15 15 GLN CG C 13 30.324 0.300 . 1 . . . . A 632 GLN CG . 34329 1 184 . 1 1 15 15 GLN N N 15 121.798 0.300 . 1 . . . . A 632 GLN N . 34329 1 185 . 1 1 15 15 GLN NE2 N 15 115.402 0.300 . 1 . . . . A 632 GLN NE2 . 34329 1 186 . 1 1 16 16 CYS H H 1 8.082 0.020 . 1 . . . . A 633 CYS H . 34329 1 187 . 1 1 16 16 CYS HA H 1 4.091 0.020 . 1 . . . . A 633 CYS HA . 34329 1 188 . 1 1 16 16 CYS HB2 H 1 2.767 0.020 . 1 . . . . A 633 CYS HB2 . 34329 1 189 . 1 1 16 16 CYS HB3 H 1 3.083 0.020 . 1 . . . . A 633 CYS HB3 . 34329 1 190 . 1 1 16 16 CYS C C 13 174.654 0.300 . 1 . . . . A 633 CYS C . 34329 1 191 . 1 1 16 16 CYS CA C 13 61.344 0.300 . 1 . . . . A 633 CYS CA . 34329 1 192 . 1 1 16 16 CYS CB C 13 23.107 0.300 . 1 . . . . A 633 CYS CB . 34329 1 193 . 1 1 16 16 CYS N N 15 118.015 0.300 . 1 . . . . A 633 CYS N . 34329 1 194 . 1 1 17 17 VAL H H 1 7.983 0.020 . 1 . . . . A 634 VAL H . 34329 1 195 . 1 1 17 17 VAL HA H 1 2.963 0.020 . 1 . . . . A 634 VAL HA . 34329 1 196 . 1 1 17 17 VAL HB H 1 2.109 0.020 . 1 . . . . A 634 VAL HB . 34329 1 197 . 1 1 17 17 VAL HG11 H 1 0.876 0.020 . 2 . . . . A 634 VAL HG11 . 34329 1 198 . 1 1 17 17 VAL HG12 H 1 0.876 0.020 . 2 . . . . A 634 VAL HG12 . 34329 1 199 . 1 1 17 17 VAL HG13 H 1 0.876 0.020 . 2 . . . . A 634 VAL HG13 . 34329 1 200 . 1 1 17 17 VAL HG21 H 1 1.002 0.020 . 2 . . . . A 634 VAL HG21 . 34329 1 201 . 1 1 17 17 VAL HG22 H 1 1.002 0.020 . 2 . . . . A 634 VAL HG22 . 34329 1 202 . 1 1 17 17 VAL HG23 H 1 1.002 0.020 . 2 . . . . A 634 VAL HG23 . 34329 1 203 . 1 1 17 17 VAL C C 13 177.202 0.300 . 1 . . . . A 634 VAL C . 34329 1 204 . 1 1 17 17 VAL CA C 13 64.910 0.300 . 1 . . . . A 634 VAL CA . 34329 1 205 . 1 1 17 17 VAL CB C 13 28.358 0.300 . 1 . . . . A 634 VAL CB . 34329 1 206 . 1 1 17 17 VAL CG1 C 13 19.192 0.300 . 1 . . . . A 634 VAL CG1 . 34329 1 207 . 1 1 17 17 VAL CG2 C 13 22.457 0.300 . 1 . . . . A 634 VAL CG2 . 34329 1 208 . 1 1 17 17 VAL N N 15 120.610 0.300 . 1 . . . . A 634 VAL N . 34329 1 209 . 1 1 18 18 ASN H H 1 7.835 0.020 . 1 . . . . A 635 ASN H . 34329 1 210 . 1 1 18 18 ASN HA H 1 4.193 0.020 . 1 . . . . A 635 ASN HA . 34329 1 211 . 1 1 18 18 ASN HB2 H 1 2.764 0.020 . 2 . . . . A 635 ASN HB2 . 34329 1 212 . 1 1 18 18 ASN HB3 H 1 2.764 0.020 . 2 . . . . A 635 ASN HB3 . 34329 1 213 . 1 1 18 18 ASN HD21 H 1 7.265 0.020 . 1 . . . . A 635 ASN HD21 . 34329 1 214 . 1 1 18 18 ASN HD22 H 1 6.750 0.020 . 1 . . . . A 635 ASN HD22 . 34329 1 215 . 1 1 18 18 ASN C C 13 173.576 0.300 . 1 . . . . A 635 ASN C . 34329 1 216 . 1 1 18 18 ASN CA C 13 53.471 0.300 . 1 . . . . A 635 ASN CA . 34329 1 217 . 1 1 18 18 ASN CB C 13 34.864 0.300 . 1 . . . . A 635 ASN CB . 34329 1 218 . 1 1 18 18 ASN N N 15 122.452 0.300 . 1 . . . . A 635 ASN N . 34329 1 219 . 1 1 18 18 ASN ND2 N 15 112.228 0.300 . 1 . . . . A 635 ASN ND2 . 34329 1 220 . 1 1 19 19 ASP H H 1 7.671 0.020 . 1 . . . . A 636 ASP H . 34329 1 221 . 1 1 19 19 ASP HA H 1 4.436 0.020 . 1 . . . . A 636 ASP HA . 34329 1 222 . 1 1 19 19 ASP HB2 H 1 2.444 0.020 . 1 . . . . A 636 ASP HB2 . 34329 1 223 . 1 1 19 19 ASP HB3 H 1 2.699 0.020 . 1 . . . . A 636 ASP HB3 . 34329 1 224 . 1 1 19 19 ASP C C 13 172.030 0.300 . 1 . . . . A 636 ASP C . 34329 1 225 . 1 1 19 19 ASP CA C 13 51.519 0.300 . 1 . . . . A 636 ASP CA . 34329 1 226 . 1 1 19 19 ASP CB C 13 37.919 0.300 . 1 . . . . A 636 ASP CB . 34329 1 227 . 1 1 19 19 ASP N N 15 118.435 0.300 . 1 . . . . A 636 ASP N . 34329 1 228 . 1 1 20 20 LYS H H 1 7.715 0.020 . 1 . . . . A 637 LYS H . 34329 1 229 . 1 1 20 20 LYS HA H 1 2.754 0.020 . 1 . . . . A 637 LYS HA . 34329 1 230 . 1 1 20 20 LYS HB2 H 1 1.740 0.020 . 1 . . . . A 637 LYS HB2 . 34329 1 231 . 1 1 20 20 LYS HB3 H 1 1.980 0.020 . 1 . . . . A 637 LYS HB3 . 34329 1 232 . 1 1 20 20 LYS HG2 H 1 1.188 0.020 . 1 . . . . A 637 LYS HG2 . 34329 1 233 . 1 1 20 20 LYS HG3 H 1 1.245 0.020 . 1 . . . . A 637 LYS HG3 . 34329 1 234 . 1 1 20 20 LYS HD2 H 1 1.678 0.020 . 2 . . . . A 637 LYS HD2 . 34329 1 235 . 1 1 20 20 LYS HD3 H 1 1.678 0.020 . 2 . . . . A 637 LYS HD3 . 34329 1 236 . 1 1 20 20 LYS HE2 H 1 2.932 0.020 . 2 . . . . A 637 LYS HE2 . 34329 1 237 . 1 1 20 20 LYS HE3 H 1 2.932 0.020 . 2 . . . . A 637 LYS HE3 . 34329 1 238 . 1 1 20 20 LYS C C 13 171.230 0.300 . 1 . . . . A 637 LYS C . 34329 1 239 . 1 1 20 20 LYS CA C 13 54.445 0.300 . 1 . . . . A 637 LYS CA . 34329 1 240 . 1 1 20 20 LYS CB C 13 25.755 0.300 . 1 . . . . A 637 LYS CB . 34329 1 241 . 1 1 20 20 LYS CG C 13 22.306 0.300 . 1 . . . . A 637 LYS CG . 34329 1 242 . 1 1 20 20 LYS CD C 13 26.339 0.300 . 1 . . . . A 637 LYS CD . 34329 1 243 . 1 1 20 20 LYS CE C 13 39.645 0.300 . 1 . . . . A 637 LYS CE . 34329 1 244 . 1 1 20 20 LYS N N 15 114.692 0.300 . 1 . . . . A 637 LYS N . 34329 1 245 . 1 1 21 21 ASN H H 1 8.154 0.020 . 1 . . . . A 638 ASN H . 34329 1 246 . 1 1 21 21 ASN HA H 1 4.713 0.020 . 1 . . . . A 638 ASN HA . 34329 1 247 . 1 1 21 21 ASN HB2 H 1 2.361 0.020 . 1 . . . . A 638 ASN HB2 . 34329 1 248 . 1 1 21 21 ASN HB3 H 1 2.758 0.020 . 1 . . . . A 638 ASN HB3 . 34329 1 249 . 1 1 21 21 ASN HD21 H 1 7.695 0.020 . 1 . . . . A 638 ASN HD21 . 34329 1 250 . 1 1 21 21 ASN HD22 H 1 7.401 0.020 . 1 . . . . A 638 ASN HD22 . 34329 1 251 . 1 1 21 21 ASN C C 13 172.713 0.300 . 1 . . . . A 638 ASN C . 34329 1 252 . 1 1 21 21 ASN CA C 13 46.915 0.300 . 1 . . . . A 638 ASN CA . 34329 1 253 . 1 1 21 21 ASN CB C 13 33.661 0.300 . 1 . . . . A 638 ASN CB . 34329 1 254 . 1 1 21 21 ASN N N 15 118.448 0.300 . 1 . . . . A 638 ASN N . 34329 1 255 . 1 1 21 21 ASN ND2 N 15 112.886 0.300 . 1 . . . . A 638 ASN ND2 . 34329 1 256 . 1 1 22 22 TYR H H 1 6.869 0.020 . 1 . . . . A 639 TYR H . 34329 1 257 . 1 1 22 22 TYR HA H 1 3.849 0.020 . 1 . . . . A 639 TYR HA . 34329 1 258 . 1 1 22 22 TYR HB2 H 1 2.511 0.020 . 1 . . . . A 639 TYR HB2 . 34329 1 259 . 1 1 22 22 TYR HB3 H 1 2.872 0.020 . 1 . . . . A 639 TYR HB3 . 34329 1 260 . 1 1 22 22 TYR HD1 H 1 7.105 0.020 . 3 . . . . A 639 TYR HD1 . 34329 1 261 . 1 1 22 22 TYR HD2 H 1 7.105 0.020 . 3 . . . . A 639 TYR HD2 . 34329 1 262 . 1 1 22 22 TYR HE1 H 1 6.736 0.020 . 3 . . . . A 639 TYR HE1 . 34329 1 263 . 1 1 22 22 TYR HE2 H 1 6.736 0.020 . 3 . . . . A 639 TYR HE2 . 34329 1 264 . 1 1 22 22 TYR C C 13 174.536 0.300 . 1 . . . . A 639 TYR C . 34329 1 265 . 1 1 22 22 TYR CA C 13 58.624 0.300 . 1 . . . . A 639 TYR CA . 34329 1 266 . 1 1 22 22 TYR CB C 13 34.926 0.300 . 1 . . . . A 639 TYR CB . 34329 1 267 . 1 1 22 22 TYR CD1 C 13 130.131 0.300 . 1 . . . . A 639 TYR CD1 . 34329 1 268 . 1 1 22 22 TYR CE1 C 13 115.709 0.300 . 1 . . . . A 639 TYR CE1 . 34329 1 269 . 1 1 22 22 TYR N N 15 119.728 0.300 . 1 . . . . A 639 TYR N . 34329 1 270 . 1 1 23 23 LYS H H 1 8.548 0.020 . 1 . . . . A 640 LYS H . 34329 1 271 . 1 1 23 23 LYS HA H 1 3.796 0.020 . 1 . . . . A 640 LYS HA . 34329 1 272 . 1 1 23 23 LYS HB2 H 1 1.740 0.020 . 2 . . . . A 640 LYS HB2 . 34329 1 273 . 1 1 23 23 LYS HB3 H 1 1.740 0.020 . 2 . . . . A 640 LYS HB3 . 34329 1 274 . 1 1 23 23 LYS HG2 H 1 1.289 0.020 . 1 . . . . A 640 LYS HG2 . 34329 1 275 . 1 1 23 23 LYS HG3 H 1 1.401 0.020 . 1 . . . . A 640 LYS HG3 . 34329 1 276 . 1 1 23 23 LYS HD2 H 1 1.577 0.020 . 2 . . . . A 640 LYS HD2 . 34329 1 277 . 1 1 23 23 LYS HD3 H 1 1.577 0.020 . 2 . . . . A 640 LYS HD3 . 34329 1 278 . 1 1 23 23 LYS HE2 H 1 2.868 0.020 . 2 . . . . A 640 LYS HE2 . 34329 1 279 . 1 1 23 23 LYS HE3 H 1 2.868 0.020 . 2 . . . . A 640 LYS HE3 . 34329 1 280 . 1 1 23 23 LYS C C 13 176.029 0.300 . 1 . . . . A 640 LYS C . 34329 1 281 . 1 1 23 23 LYS CA C 13 57.086 0.300 . 1 . . . . A 640 LYS CA . 34329 1 282 . 1 1 23 23 LYS CB C 13 29.316 0.300 . 1 . . . . A 640 LYS CB . 34329 1 283 . 1 1 23 23 LYS CG C 13 22.558 0.300 . 1 . . . . A 640 LYS CG . 34329 1 284 . 1 1 23 23 LYS CD C 13 26.560 0.300 . 1 . . . . A 640 LYS CD . 34329 1 285 . 1 1 23 23 LYS CE C 13 39.187 0.300 . 1 . . . . A 640 LYS CE . 34329 1 286 . 1 1 23 23 LYS N N 15 118.668 0.300 . 1 . . . . A 640 LYS N . 34329 1 287 . 1 1 24 24 ASP H H 1 7.186 0.020 . 1 . . . . A 641 ASP H . 34329 1 288 . 1 1 24 24 ASP HA H 1 4.378 0.020 . 1 . . . . A 641 ASP HA . 34329 1 289 . 1 1 24 24 ASP HB2 H 1 2.288 0.020 . 1 . . . . A 641 ASP HB2 . 34329 1 290 . 1 1 24 24 ASP HB3 H 1 2.432 0.020 . 1 . . . . A 641 ASP HB3 . 34329 1 291 . 1 1 24 24 ASP C C 13 175.994 0.300 . 1 . . . . A 641 ASP C . 34329 1 292 . 1 1 24 24 ASP CA C 13 53.800 0.300 . 1 . . . . A 641 ASP CA . 34329 1 293 . 1 1 24 24 ASP CB C 13 37.077 0.300 . 1 . . . . A 641 ASP CB . 34329 1 294 . 1 1 24 24 ASP N N 15 118.613 0.300 . 1 . . . . A 641 ASP N . 34329 1 295 . 1 1 25 25 ALA H H 1 7.523 0.020 . 1 . . . . A 642 ALA H . 34329 1 296 . 1 1 25 25 ALA HA H 1 3.321 0.020 . 1 . . . . A 642 ALA HA . 34329 1 297 . 1 1 25 25 ALA HB1 H 1 1.295 0.020 . 1 . . . . A 642 ALA HB1 . 34329 1 298 . 1 1 25 25 ALA HB2 H 1 1.295 0.020 . 1 . . . . A 642 ALA HB2 . 34329 1 299 . 1 1 25 25 ALA HB3 H 1 1.295 0.020 . 1 . . . . A 642 ALA HB3 . 34329 1 300 . 1 1 25 25 ALA C C 13 175.012 0.300 . 1 . . . . A 642 ALA C . 34329 1 301 . 1 1 25 25 ALA CA C 13 52.775 0.300 . 1 . . . . A 642 ALA CA . 34329 1 302 . 1 1 25 25 ALA CB C 13 17.549 0.300 . 1 . . . . A 642 ALA CB . 34329 1 303 . 1 1 25 25 ALA N N 15 121.598 0.300 . 1 . . . . A 642 ALA N . 34329 1 304 . 1 1 26 26 LEU H H 1 7.812 0.020 . 1 . . . . A 643 LEU H . 34329 1 305 . 1 1 26 26 LEU HA H 1 3.631 0.020 . 1 . . . . A 643 LEU HA . 34329 1 306 . 1 1 26 26 LEU HB2 H 1 1.478 0.020 . 1 . . . . A 643 LEU HB2 . 34329 1 307 . 1 1 26 26 LEU HB3 H 1 1.627 0.020 . 1 . . . . A 643 LEU HB3 . 34329 1 308 . 1 1 26 26 LEU HG H 1 1.346 0.020 . 1 . . . . A 643 LEU HG . 34329 1 309 . 1 1 26 26 LEU HD11 H 1 0.268 0.020 . 2 . . . . A 643 LEU HD11 . 34329 1 310 . 1 1 26 26 LEU HD12 H 1 0.268 0.020 . 2 . . . . A 643 LEU HD12 . 34329 1 311 . 1 1 26 26 LEU HD13 H 1 0.268 0.020 . 2 . . . . A 643 LEU HD13 . 34329 1 312 . 1 1 26 26 LEU HD21 H 1 0.362 0.020 . 2 . . . . A 643 LEU HD21 . 34329 1 313 . 1 1 26 26 LEU HD22 H 1 0.362 0.020 . 2 . . . . A 643 LEU HD22 . 34329 1 314 . 1 1 26 26 LEU HD23 H 1 0.362 0.020 . 2 . . . . A 643 LEU HD23 . 34329 1 315 . 1 1 26 26 LEU C C 13 176.714 0.300 . 1 . . . . A 643 LEU C . 34329 1 316 . 1 1 26 26 LEU CA C 13 56.148 0.300 . 1 . . . . A 643 LEU CA . 34329 1 317 . 1 1 26 26 LEU CB C 13 39.446 0.300 . 1 . . . . A 643 LEU CB . 34329 1 318 . 1 1 26 26 LEU CG C 13 23.802 0.300 . 1 . . . . A 643 LEU CG . 34329 1 319 . 1 1 26 26 LEU CD1 C 13 21.951 0.300 . 1 . . . . A 643 LEU CD1 . 34329 1 320 . 1 1 26 26 LEU CD2 C 13 22.091 0.300 . 1 . . . . A 643 LEU CD2 . 34329 1 321 . 1 1 26 26 LEU N N 15 116.789 0.300 . 1 . . . . A 643 LEU N . 34329 1 322 . 1 1 27 27 SER H H 1 7.104 0.020 . 1 . . . . A 644 SER H . 34329 1 323 . 1 1 27 27 SER HA H 1 4.052 0.020 . 1 . . . . A 644 SER HA . 34329 1 324 . 1 1 27 27 SER HB2 H 1 3.874 0.020 . 2 . . . . A 644 SER HB2 . 34329 1 325 . 1 1 27 27 SER HB3 H 1 3.874 0.020 . 2 . . . . A 644 SER HB3 . 34329 1 326 . 1 1 27 27 SER C C 13 177.394 0.300 . 1 . . . . A 644 SER C . 34329 1 327 . 1 1 27 27 SER CA C 13 58.562 0.300 . 1 . . . . A 644 SER CA . 34329 1 328 . 1 1 27 27 SER CB C 13 59.693 0.300 . 1 . . . . A 644 SER CB . 34329 1 329 . 1 1 27 27 SER N N 15 114.253 0.300 . 1 . . . . A 644 SER N . 34329 1 330 . 1 1 28 28 LYS H H 1 7.474 0.020 . 1 . . . . A 645 LYS H . 34329 1 331 . 1 1 28 28 LYS HA H 1 3.856 0.020 . 1 . . . . A 645 LYS HA . 34329 1 332 . 1 1 28 28 LYS HB2 H 1 1.319 0.020 . 1 . . . . A 645 LYS HB2 . 34329 1 333 . 1 1 28 28 LYS HB3 H 1 1.579 0.020 . 1 . . . . A 645 LYS HB3 . 34329 1 334 . 1 1 28 28 LYS HG2 H 1 0.896 0.020 . 1 . . . . A 645 LYS HG2 . 34329 1 335 . 1 1 28 28 LYS HG3 H 1 1.382 0.020 . 1 . . . . A 645 LYS HG3 . 34329 1 336 . 1 1 28 28 LYS HE2 H 1 2.551 0.020 . 2 . . . . A 645 LYS HE2 . 34329 1 337 . 1 1 28 28 LYS HE3 H 1 2.551 0.020 . 2 . . . . A 645 LYS HE3 . 34329 1 338 . 1 1 28 28 LYS C C 13 176.642 0.300 . 1 . . . . A 645 LYS C . 34329 1 339 . 1 1 28 28 LYS CA C 13 55.155 0.300 . 1 . . . . A 645 LYS CA . 34329 1 340 . 1 1 28 28 LYS CB C 13 27.901 0.300 . 1 . . . . A 645 LYS CB . 34329 1 341 . 1 1 28 28 LYS CG C 13 21.473 0.300 . 1 . . . . A 645 LYS CG . 34329 1 342 . 1 1 28 28 LYS CD C 13 24.846 0.300 . 1 . . . . A 645 LYS CD . 34329 1 343 . 1 1 28 28 LYS CE C 13 39.707 0.300 . 1 . . . . A 645 LYS CE . 34329 1 344 . 1 1 28 28 LYS N N 15 120.418 0.300 . 1 . . . . A 645 LYS N . 34329 1 345 . 1 1 29 29 TYR H H 1 8.592 0.020 . 1 . . . . A 646 TYR H . 34329 1 346 . 1 1 29 29 TYR HA H 1 4.274 0.020 . 1 . . . . A 646 TYR HA . 34329 1 347 . 1 1 29 29 TYR HB2 H 1 2.576 0.020 . 1 . . . . A 646 TYR HB2 . 34329 1 348 . 1 1 29 29 TYR HB3 H 1 2.764 0.020 . 1 . . . . A 646 TYR HB3 . 34329 1 349 . 1 1 29 29 TYR HD1 H 1 6.657 0.020 . 3 . . . . A 646 TYR HD1 . 34329 1 350 . 1 1 29 29 TYR HD2 H 1 6.657 0.020 . 3 . . . . A 646 TYR HD2 . 34329 1 351 . 1 1 29 29 TYR HE1 H 1 6.366 0.020 . 3 . . . . A 646 TYR HE1 . 34329 1 352 . 1 1 29 29 TYR HE2 H 1 6.366 0.020 . 3 . . . . A 646 TYR HE2 . 34329 1 353 . 1 1 29 29 TYR C C 13 175.846 0.300 . 1 . . . . A 646 TYR C . 34329 1 354 . 1 1 29 29 TYR CA C 13 56.067 0.300 . 1 . . . . A 646 TYR CA . 34329 1 355 . 1 1 29 29 TYR CB C 13 34.533 0.300 . 1 . . . . A 646 TYR CB . 34329 1 356 . 1 1 29 29 TYR CD1 C 13 128.552 0.300 . 1 . . . . A 646 TYR CD1 . 34329 1 357 . 1 1 29 29 TYR CE1 C 13 114.409 0.300 . 1 . . . . A 646 TYR CE1 . 34329 1 358 . 1 1 29 29 TYR N N 15 117.068 0.300 . 1 . . . . A 646 TYR N . 34329 1 359 . 1 1 30 30 SER H H 1 8.400 0.020 . 1 . . . . A 647 SER H . 34329 1 360 . 1 1 30 30 SER HA H 1 4.047 0.020 . 1 . . . . A 647 SER HA . 34329 1 361 . 1 1 30 30 SER HB2 H 1 3.744 0.020 . 1 . . . . A 647 SER HB2 . 34329 1 362 . 1 1 30 30 SER HB3 H 1 4.070 0.020 . 1 . . . . A 647 SER HB3 . 34329 1 363 . 1 1 30 30 SER C C 13 173.741 0.300 . 1 . . . . A 647 SER C . 34329 1 364 . 1 1 30 30 SER CA C 13 59.657 0.300 . 1 . . . . A 647 SER CA . 34329 1 365 . 1 1 30 30 SER CB C 13 59.693 0.300 . 1 . . . . A 647 SER CB . 34329 1 366 . 1 1 30 30 SER N N 15 115.673 0.300 . 1 . . . . A 647 SER N . 34329 1 367 . 1 1 31 31 GLU H H 1 7.722 0.020 . 1 . . . . A 648 GLU H . 34329 1 368 . 1 1 31 31 GLU HA H 1 3.893 0.020 . 1 . . . . A 648 GLU HA . 34329 1 369 . 1 1 31 31 GLU HB2 H 1 2.019 0.020 . 1 . . . . A 648 GLU HB2 . 34329 1 370 . 1 1 31 31 GLU HB3 H 1 2.131 0.020 . 1 . . . . A 648 GLU HB3 . 34329 1 371 . 1 1 31 31 GLU HG2 H 1 2.228 0.020 . 2 . . . . A 648 GLU HG2 . 34329 1 372 . 1 1 31 31 GLU HG3 H 1 2.228 0.020 . 2 . . . . A 648 GLU HG3 . 34329 1 373 . 1 1 31 31 GLU C C 13 177.386 0.300 . 1 . . . . A 648 GLU C . 34329 1 374 . 1 1 31 31 GLU CA C 13 56.521 0.300 . 1 . . . . A 648 GLU CA . 34329 1 375 . 1 1 31 31 GLU CB C 13 26.515 0.300 . 1 . . . . A 648 GLU CB . 34329 1 376 . 1 1 31 31 GLU CG C 13 32.961 0.300 . 1 . . . . A 648 GLU CG . 34329 1 377 . 1 1 31 31 GLU N N 15 122.532 0.300 . 1 . . . . A 648 GLU N . 34329 1 378 . 1 1 32 32 CYS H H 1 8.137 0.020 . 1 . . . . A 649 CYS H . 34329 1 379 . 1 1 32 32 CYS HA H 1 3.865 0.020 . 1 . . . . A 649 CYS HA . 34329 1 380 . 1 1 32 32 CYS HB2 H 1 2.672 0.020 . 1 . . . . A 649 CYS HB2 . 34329 1 381 . 1 1 32 32 CYS HB3 H 1 3.385 0.020 . 1 . . . . A 649 CYS HB3 . 34329 1 382 . 1 1 32 32 CYS HG H 1 1.876 0.020 . 1 . . . . A 649 CYS HG . 34329 1 383 . 1 1 32 32 CYS C C 13 174.143 0.300 . 1 . . . . A 649 CYS C . 34329 1 384 . 1 1 32 32 CYS CA C 13 62.600 0.300 . 1 . . . . A 649 CYS CA . 34329 1 385 . 1 1 32 32 CYS CB C 13 24.094 0.300 . 1 . . . . A 649 CYS CB . 34329 1 386 . 1 1 32 32 CYS N N 15 118.318 0.300 . 1 . . . . A 649 CYS N . 34329 1 387 . 1 1 33 33 LEU H H 1 7.478 0.020 . 1 . . . . A 650 LEU H . 34329 1 388 . 1 1 33 33 LEU HA H 1 4.077 0.020 . 1 . . . . A 650 LEU HA . 34329 1 389 . 1 1 33 33 LEU HB2 H 1 1.209 0.020 . 1 . . . . A 650 LEU HB2 . 34329 1 390 . 1 1 33 33 LEU HB3 H 1 1.692 0.020 . 1 . . . . A 650 LEU HB3 . 34329 1 391 . 1 1 33 33 LEU HG H 1 1.518 0.020 . 1 . . . . A 650 LEU HG . 34329 1 392 . 1 1 33 33 LEU HD11 H 1 0.153 0.020 . 2 . . . . A 650 LEU HD11 . 34329 1 393 . 1 1 33 33 LEU HD12 H 1 0.153 0.020 . 2 . . . . A 650 LEU HD12 . 34329 1 394 . 1 1 33 33 LEU HD13 H 1 0.153 0.020 . 2 . . . . A 650 LEU HD13 . 34329 1 395 . 1 1 33 33 LEU HD21 H 1 0.380 0.020 . 2 . . . . A 650 LEU HD21 . 34329 1 396 . 1 1 33 33 LEU HD22 H 1 0.380 0.020 . 2 . . . . A 650 LEU HD22 . 34329 1 397 . 1 1 33 33 LEU HD23 H 1 0.380 0.020 . 2 . . . . A 650 LEU HD23 . 34329 1 398 . 1 1 33 33 LEU C C 13 175.303 0.300 . 1 . . . . A 650 LEU C . 34329 1 399 . 1 1 33 33 LEU CA C 13 53.752 0.300 . 1 . . . . A 650 LEU CA . 34329 1 400 . 1 1 33 33 LEU CB C 13 39.140 0.300 . 1 . . . . A 650 LEU CB . 34329 1 401 . 1 1 33 33 LEU CG C 13 23.315 0.300 . 1 . . . . A 650 LEU CG . 34329 1 402 . 1 1 33 33 LEU CD1 C 13 19.375 0.300 . 1 . . . . A 650 LEU CD1 . 34329 1 403 . 1 1 33 33 LEU CD2 C 13 21.946 0.300 . 1 . . . . A 650 LEU CD2 . 34329 1 404 . 1 1 33 33 LEU N N 15 117.551 0.300 . 1 . . . . A 650 LEU N . 34329 1 405 . 1 1 34 34 LYS H H 1 7.028 0.020 . 1 . . . . A 651 LYS H . 34329 1 406 . 1 1 34 34 LYS HA H 1 3.925 0.020 . 1 . . . . A 651 LYS HA . 34329 1 407 . 1 1 34 34 LYS HB2 H 1 1.822 0.020 . 2 . . . . A 651 LYS HB2 . 34329 1 408 . 1 1 34 34 LYS HB3 H 1 1.822 0.020 . 2 . . . . A 651 LYS HB3 . 34329 1 409 . 1 1 34 34 LYS HG2 H 1 1.301 0.020 . 1 . . . . A 651 LYS HG2 . 34329 1 410 . 1 1 34 34 LYS HG3 H 1 1.556 0.020 . 1 . . . . A 651 LYS HG3 . 34329 1 411 . 1 1 34 34 LYS HD2 H 1 1.553 0.020 . 2 . . . . A 651 LYS HD2 . 34329 1 412 . 1 1 34 34 LYS HD3 H 1 1.553 0.020 . 2 . . . . A 651 LYS HD3 . 34329 1 413 . 1 1 34 34 LYS HE2 H 1 2.730 0.020 . 1 . . . . A 651 LYS HE2 . 34329 1 414 . 1 1 34 34 LYS HE3 H 1 2.816 0.020 . 1 . . . . A 651 LYS HE3 . 34329 1 415 . 1 1 34 34 LYS C C 13 174.768 0.300 . 1 . . . . A 651 LYS C . 34329 1 416 . 1 1 34 34 LYS CA C 13 55.401 0.300 . 1 . . . . A 651 LYS CA . 34329 1 417 . 1 1 34 34 LYS CB C 13 29.698 0.300 . 1 . . . . A 651 LYS CB . 34329 1 418 . 1 1 34 34 LYS CG C 13 22.745 0.300 . 1 . . . . A 651 LYS CG . 34329 1 419 . 1 1 34 34 LYS CD C 13 26.623 0.300 . 1 . . . . A 651 LYS CD . 34329 1 420 . 1 1 34 34 LYS CE C 13 39.172 0.300 . 1 . . . . A 651 LYS CE . 34329 1 421 . 1 1 34 34 LYS N N 15 116.428 0.300 . 1 . . . . A 651 LYS N . 34329 1 422 . 1 1 35 35 ILE H H 1 7.308 0.020 . 1 . . . . A 652 ILE H . 34329 1 423 . 1 1 35 35 ILE HA H 1 3.813 0.020 . 1 . . . . A 652 ILE HA . 34329 1 424 . 1 1 35 35 ILE HB H 1 1.959 0.020 . 1 . . . . A 652 ILE HB . 34329 1 425 . 1 1 35 35 ILE HG12 H 1 0.927 0.020 . 1 . . . . A 652 ILE HG12 . 34329 1 426 . 1 1 35 35 ILE HG13 H 1 1.620 0.020 . 1 . . . . A 652 ILE HG13 . 34329 1 427 . 1 1 35 35 ILE HG21 H 1 0.893 0.020 . 1 . . . . A 652 ILE HG21 . 34329 1 428 . 1 1 35 35 ILE HG22 H 1 0.893 0.020 . 1 . . . . A 652 ILE HG22 . 34329 1 429 . 1 1 35 35 ILE HG23 H 1 0.893 0.020 . 1 . . . . A 652 ILE HG23 . 34329 1 430 . 1 1 35 35 ILE HD11 H 1 0.817 0.020 . 1 . . . . A 652 ILE HD11 . 34329 1 431 . 1 1 35 35 ILE HD12 H 1 0.817 0.020 . 1 . . . . A 652 ILE HD12 . 34329 1 432 . 1 1 35 35 ILE HD13 H 1 0.817 0.020 . 1 . . . . A 652 ILE HD13 . 34329 1 433 . 1 1 35 35 ILE C C 13 173.273 0.300 . 1 . . . . A 652 ILE C . 34329 1 434 . 1 1 35 35 ILE CA C 13 60.340 0.300 . 1 . . . . A 652 ILE CA . 34329 1 435 . 1 1 35 35 ILE CB C 13 36.858 0.300 . 1 . . . . A 652 ILE CB . 34329 1 436 . 1 1 35 35 ILE CG1 C 13 25.072 0.300 . 1 . . . . A 652 ILE CG1 . 34329 1 437 . 1 1 35 35 ILE CG2 C 13 14.920 0.300 . 1 . . . . A 652 ILE CG2 . 34329 1 438 . 1 1 35 35 ILE CD1 C 13 11.362 0.300 . 1 . . . . A 652 ILE CD1 . 34329 1 439 . 1 1 35 35 ILE N N 15 118.582 0.300 . 1 . . . . A 652 ILE N . 34329 1 440 . 1 1 36 36 ASN H H 1 8.196 0.020 . 1 . . . . A 653 ASN H . 34329 1 441 . 1 1 36 36 ASN HA H 1 4.563 0.020 . 1 . . . . A 653 ASN HA . 34329 1 442 . 1 1 36 36 ASN HB2 H 1 2.128 0.020 . 1 . . . . A 653 ASN HB2 . 34329 1 443 . 1 1 36 36 ASN HB3 H 1 2.270 0.020 . 1 . . . . A 653 ASN HB3 . 34329 1 444 . 1 1 36 36 ASN HD21 H 1 6.238 0.020 . 1 . . . . A 653 ASN HD21 . 34329 1 445 . 1 1 36 36 ASN HD22 H 1 6.670 0.020 . 1 . . . . A 653 ASN HD22 . 34329 1 446 . 1 1 36 36 ASN C C 13 170.748 0.300 . 1 . . . . A 653 ASN C . 34329 1 447 . 1 1 36 36 ASN CA C 13 49.903 0.300 . 1 . . . . A 653 ASN CA . 34329 1 448 . 1 1 36 36 ASN CB C 13 36.616 0.300 . 1 . . . . A 653 ASN CB . 34329 1 449 . 1 1 36 36 ASN N N 15 116.950 0.300 . 1 . . . . A 653 ASN N . 34329 1 450 . 1 1 36 36 ASN ND2 N 15 110.413 0.300 . 1 . . . . A 653 ASN ND2 . 34329 1 451 . 1 1 37 37 ASN H H 1 8.186 0.020 . 1 . . . . A 654 ASN H . 34329 1 452 . 1 1 37 37 ASN HA H 1 4.752 0.020 . 1 . . . . A 654 ASN HA . 34329 1 453 . 1 1 37 37 ASN HB2 H 1 2.869 0.020 . 1 . . . . A 654 ASN HB2 . 34329 1 454 . 1 1 37 37 ASN HB3 H 1 3.324 0.020 . 1 . . . . A 654 ASN HB3 . 34329 1 455 . 1 1 37 37 ASN HD21 H 1 7.323 0.020 . 1 . . . . A 654 ASN HD21 . 34329 1 456 . 1 1 37 37 ASN HD22 H 1 6.650 0.020 . 1 . . . . A 654 ASN HD22 . 34329 1 457 . 1 1 37 37 ASN C C 13 174.181 0.300 . 1 . . . . A 654 ASN C . 34329 1 458 . 1 1 37 37 ASN CA C 13 49.130 0.300 . 1 . . . . A 654 ASN CA . 34329 1 459 . 1 1 37 37 ASN CB C 13 34.782 0.300 . 1 . . . . A 654 ASN CB . 34329 1 460 . 1 1 37 37 ASN N N 15 122.537 0.300 . 1 . . . . A 654 ASN N . 34329 1 461 . 1 1 37 37 ASN ND2 N 15 109.642 0.300 . 1 . . . . A 654 ASN ND2 . 34329 1 462 . 1 1 38 38 LYS H H 1 8.038 0.020 . 1 . . . . A 655 LYS H . 34329 1 463 . 1 1 38 38 LYS HA H 1 4.501 0.020 . 1 . . . . A 655 LYS HA . 34329 1 464 . 1 1 38 38 LYS HB2 H 1 1.732 0.020 . 1 . . . . A 655 LYS HB2 . 34329 1 465 . 1 1 38 38 LYS HB3 H 1 2.003 0.020 . 1 . . . . A 655 LYS HB3 . 34329 1 466 . 1 1 38 38 LYS HG2 H 1 1.313 0.020 . 1 . . . . A 655 LYS HG2 . 34329 1 467 . 1 1 38 38 LYS HG3 H 1 1.426 0.020 . 1 . . . . A 655 LYS HG3 . 34329 1 468 . 1 1 38 38 LYS HD2 H 1 1.471 0.020 . 1 . . . . A 655 LYS HD2 . 34329 1 469 . 1 1 38 38 LYS HD3 H 1 1.541 0.020 . 1 . . . . A 655 LYS HD3 . 34329 1 470 . 1 1 38 38 LYS HE2 H 1 2.884 0.020 . 2 . . . . A 655 LYS HE2 . 34329 1 471 . 1 1 38 38 LYS HE3 H 1 2.884 0.020 . 2 . . . . A 655 LYS HE3 . 34329 1 472 . 1 1 38 38 LYS C C 13 173.019 0.300 . 1 . . . . A 655 LYS C . 34329 1 473 . 1 1 38 38 LYS CA C 13 52.401 0.300 . 1 . . . . A 655 LYS CA . 34329 1 474 . 1 1 38 38 LYS CB C 13 29.502 0.300 . 1 . . . . A 655 LYS CB . 34329 1 475 . 1 1 38 38 LYS CG C 13 21.484 0.300 . 1 . . . . A 655 LYS CG . 34329 1 476 . 1 1 38 38 LYS CD C 13 25.774 0.300 . 1 . . . . A 655 LYS CD . 34329 1 477 . 1 1 38 38 LYS CE C 13 39.610 0.300 . 1 . . . . A 655 LYS CE . 34329 1 478 . 1 1 38 38 LYS N N 15 117.135 0.300 . 1 . . . . A 655 LYS N . 34329 1 479 . 1 1 39 39 GLU H H 1 7.839 0.020 . 1 . . . . A 656 GLU H . 34329 1 480 . 1 1 39 39 GLU HA H 1 4.515 0.020 . 1 . . . . A 656 GLU HA . 34329 1 481 . 1 1 39 39 GLU HB2 H 1 1.782 0.020 . 1 . . . . A 656 GLU HB2 . 34329 1 482 . 1 1 39 39 GLU HB3 H 1 2.105 0.020 . 1 . . . . A 656 GLU HB3 . 34329 1 483 . 1 1 39 39 GLU HG2 H 1 2.058 0.020 . 1 . . . . A 656 GLU HG2 . 34329 1 484 . 1 1 39 39 GLU HG3 H 1 2.145 0.020 . 1 . . . . A 656 GLU HG3 . 34329 1 485 . 1 1 39 39 GLU C C 13 173.531 0.300 . 1 . . . . A 656 GLU C . 34329 1 486 . 1 1 39 39 GLU CA C 13 52.564 0.300 . 1 . . . . A 656 GLU CA . 34329 1 487 . 1 1 39 39 GLU CB C 13 26.885 0.300 . 1 . . . . A 656 GLU CB . 34329 1 488 . 1 1 39 39 GLU CG C 13 33.639 0.300 . 1 . . . . A 656 GLU CG . 34329 1 489 . 1 1 39 39 GLU N N 15 121.569 0.300 . 1 . . . . A 656 GLU N . 34329 1 490 . 1 1 40 40 CYS H H 1 8.940 0.020 . 1 . . . . A 657 CYS H . 34329 1 491 . 1 1 40 40 CYS HA H 1 3.967 0.020 . 1 . . . . A 657 CYS HA . 34329 1 492 . 1 1 40 40 CYS HB2 H 1 2.861 0.020 . 2 . . . . A 657 CYS HB2 . 34329 1 493 . 1 1 40 40 CYS HB3 H 1 2.861 0.020 . 2 . . . . A 657 CYS HB3 . 34329 1 494 . 1 1 40 40 CYS C C 13 173.094 0.300 . 1 . . . . A 657 CYS C . 34329 1 495 . 1 1 40 40 CYS CA C 13 59.781 0.300 . 1 . . . . A 657 CYS CA . 34329 1 496 . 1 1 40 40 CYS CB C 13 24.100 0.300 . 1 . . . . A 657 CYS CB . 34329 1 497 . 1 1 40 40 CYS N N 15 126.858 0.300 . 1 . . . . A 657 CYS N . 34329 1 498 . 1 1 41 41 ALA H H 1 8.925 0.020 . 1 . . . . A 658 ALA H . 34329 1 499 . 1 1 41 41 ALA HA H 1 4.140 0.020 . 1 . . . . A 658 ALA HA . 34329 1 500 . 1 1 41 41 ALA HB1 H 1 1.294 0.020 . 1 . . . . A 658 ALA HB1 . 34329 1 501 . 1 1 41 41 ALA HB2 H 1 1.294 0.020 . 1 . . . . A 658 ALA HB2 . 34329 1 502 . 1 1 41 41 ALA HB3 H 1 1.294 0.020 . 1 . . . . A 658 ALA HB3 . 34329 1 503 . 1 1 41 41 ALA C C 13 176.623 0.300 . 1 . . . . A 658 ALA C . 34329 1 504 . 1 1 41 41 ALA CA C 13 51.755 0.300 . 1 . . . . A 658 ALA CA . 34329 1 505 . 1 1 41 41 ALA CB C 13 15.742 0.300 . 1 . . . . A 658 ALA CB . 34329 1 506 . 1 1 41 41 ALA N N 15 121.961 0.300 . 1 . . . . A 658 ALA N . 34329 1 507 . 1 1 42 42 ILE H H 1 7.223 0.020 . 1 . . . . A 659 ILE H . 34329 1 508 . 1 1 42 42 ILE HA H 1 3.182 0.020 . 1 . . . . A 659 ILE HA . 34329 1 509 . 1 1 42 42 ILE HB H 1 1.704 0.020 . 1 . . . . A 659 ILE HB . 34329 1 510 . 1 1 42 42 ILE HG12 H 1 1.352 0.020 . 1 . . . . A 659 ILE HG12 . 34329 1 511 . 1 1 42 42 ILE HG13 H 1 1.591 0.020 . 1 . . . . A 659 ILE HG13 . 34329 1 512 . 1 1 42 42 ILE HG21 H 1 0.510 0.020 . 1 . . . . A 659 ILE HG21 . 34329 1 513 . 1 1 42 42 ILE HG22 H 1 0.510 0.020 . 1 . . . . A 659 ILE HG22 . 34329 1 514 . 1 1 42 42 ILE HG23 H 1 0.510 0.020 . 1 . . . . A 659 ILE HG23 . 34329 1 515 . 1 1 42 42 ILE HD11 H 1 0.599 0.020 . 1 . . . . A 659 ILE HD11 . 34329 1 516 . 1 1 42 42 ILE HD12 H 1 0.599 0.020 . 1 . . . . A 659 ILE HD12 . 34329 1 517 . 1 1 42 42 ILE HD13 H 1 0.599 0.020 . 1 . . . . A 659 ILE HD13 . 34329 1 518 . 1 1 42 42 ILE C C 13 174.874 0.300 . 1 . . . . A 659 ILE C . 34329 1 519 . 1 1 42 42 ILE CA C 13 59.349 0.300 . 1 . . . . A 659 ILE CA . 34329 1 520 . 1 1 42 42 ILE CB C 13 32.260 0.300 . 1 . . . . A 659 ILE CB . 34329 1 521 . 1 1 42 42 ILE CG1 C 13 24.991 0.300 . 1 . . . . A 659 ILE CG1 . 34329 1 522 . 1 1 42 42 ILE CG2 C 13 15.935 0.300 . 1 . . . . A 659 ILE CG2 . 34329 1 523 . 1 1 42 42 ILE CD1 C 13 6.147 0.300 . 1 . . . . A 659 ILE CD1 . 34329 1 524 . 1 1 42 42 ILE N N 15 113.813 0.300 . 1 . . . . A 659 ILE N . 34329 1 525 . 1 1 43 43 TYR H H 1 6.673 0.020 . 1 . . . . A 660 TYR H . 34329 1 526 . 1 1 43 43 TYR HA H 1 3.864 0.020 . 1 . . . . A 660 TYR HA . 34329 1 527 . 1 1 43 43 TYR HB2 H 1 2.644 0.020 . 1 . . . . A 660 TYR HB2 . 34329 1 528 . 1 1 43 43 TYR HB3 H 1 3.277 0.020 . 1 . . . . A 660 TYR HB3 . 34329 1 529 . 1 1 43 43 TYR HD1 H 1 6.826 0.020 . 3 . . . . A 660 TYR HD1 . 34329 1 530 . 1 1 43 43 TYR HD2 H 1 6.826 0.020 . 3 . . . . A 660 TYR HD2 . 34329 1 531 . 1 1 43 43 TYR HE1 H 1 6.584 0.020 . 3 . . . . A 660 TYR HE1 . 34329 1 532 . 1 1 43 43 TYR HE2 H 1 6.584 0.020 . 3 . . . . A 660 TYR HE2 . 34329 1 533 . 1 1 43 43 TYR C C 13 175.664 0.300 . 1 . . . . A 660 TYR C . 34329 1 534 . 1 1 43 43 TYR CA C 13 60.155 0.300 . 1 . . . . A 660 TYR CA . 34329 1 535 . 1 1 43 43 TYR CB C 13 36.155 0.300 . 1 . . . . A 660 TYR CB . 34329 1 536 . 1 1 43 43 TYR CD1 C 13 129.478 0.300 . 1 . . . . A 660 TYR CD1 . 34329 1 537 . 1 1 43 43 TYR CE1 C 13 116.465 0.300 . 1 . . . . A 660 TYR CE1 . 34329 1 538 . 1 1 43 43 TYR N N 15 116.742 0.300 . 1 . . . . A 660 TYR N . 34329 1 539 . 1 1 44 44 THR H H 1 8.120 0.020 . 1 . . . . A 661 THR H . 34329 1 540 . 1 1 44 44 THR HA H 1 3.616 0.020 . 1 . . . . A 661 THR HA . 34329 1 541 . 1 1 44 44 THR HB H 1 3.928 0.020 . 1 . . . . A 661 THR HB . 34329 1 542 . 1 1 44 44 THR HG21 H 1 0.959 0.020 . 1 . . . . A 661 THR HG21 . 34329 1 543 . 1 1 44 44 THR HG22 H 1 0.959 0.020 . 1 . . . . A 661 THR HG22 . 34329 1 544 . 1 1 44 44 THR HG23 H 1 0.959 0.020 . 1 . . . . A 661 THR HG23 . 34329 1 545 . 1 1 44 44 THR C C 13 175.418 0.300 . 1 . . . . A 661 THR C . 34329 1 546 . 1 1 44 44 THR CA C 13 63.921 0.300 . 1 . . . . A 661 THR CA . 34329 1 547 . 1 1 44 44 THR CB C 13 64.603 0.300 . 1 . . . . A 661 THR CB . 34329 1 548 . 1 1 44 44 THR CG2 C 13 20.208 0.300 . 1 . . . . A 661 THR CG2 . 34329 1 549 . 1 1 44 44 THR N N 15 110.424 0.300 . 1 . . . . A 661 THR N . 34329 1 550 . 1 1 45 45 ASN H H 1 8.027 0.020 . 1 . . . . A 662 ASN H . 34329 1 551 . 1 1 45 45 ASN HA H 1 4.391 0.020 . 1 . . . . A 662 ASN HA . 34329 1 552 . 1 1 45 45 ASN HB2 H 1 2.062 0.020 . 1 . . . . A 662 ASN HB2 . 34329 1 553 . 1 1 45 45 ASN HB3 H 1 2.275 0.020 . 1 . . . . A 662 ASN HB3 . 34329 1 554 . 1 1 45 45 ASN HD21 H 1 6.610 0.020 . 1 . . . . A 662 ASN HD21 . 34329 1 555 . 1 1 45 45 ASN HD22 H 1 7.139 0.020 . 1 . . . . A 662 ASN HD22 . 34329 1 556 . 1 1 45 45 ASN C C 13 174.341 0.300 . 1 . . . . A 662 ASN C . 34329 1 557 . 1 1 45 45 ASN CA C 13 52.482 0.300 . 1 . . . . A 662 ASN CA . 34329 1 558 . 1 1 45 45 ASN CB C 13 33.896 0.300 . 1 . . . . A 662 ASN CB . 34329 1 559 . 1 1 45 45 ASN N N 15 123.930 0.300 . 1 . . . . A 662 ASN N . 34329 1 560 . 1 1 45 45 ASN ND2 N 15 111.329 0.300 . 1 . . . . A 662 ASN ND2 . 34329 1 561 . 1 1 46 46 ARG H H 1 8.618 0.020 . 1 . . . . A 663 ARG H . 34329 1 562 . 1 1 46 46 ARG HA H 1 3.690 0.020 . 1 . . . . A 663 ARG HA . 34329 1 563 . 1 1 46 46 ARG HB2 H 1 1.228 0.020 . 1 . . . . A 663 ARG HB2 . 34329 1 564 . 1 1 46 46 ARG HB3 H 1 1.650 0.020 . 1 . . . . A 663 ARG HB3 . 34329 1 565 . 1 1 46 46 ARG HG2 H 1 1.251 0.020 . 1 . . . . A 663 ARG HG2 . 34329 1 566 . 1 1 46 46 ARG HG3 H 1 2.417 0.020 . 1 . . . . A 663 ARG HG3 . 34329 1 567 . 1 1 46 46 ARG HD2 H 1 2.377 0.020 . 1 . . . . A 663 ARG HD2 . 34329 1 568 . 1 1 46 46 ARG HD3 H 1 2.989 0.020 . 1 . . . . A 663 ARG HD3 . 34329 1 569 . 1 1 46 46 ARG HE H 1 10.672 0.020 . 1 . . . . A 663 ARG HE . 34329 1 570 . 1 1 46 46 ARG C C 13 175.781 0.300 . 1 . . . . A 663 ARG C . 34329 1 571 . 1 1 46 46 ARG CA C 13 59.360 0.300 . 1 . . . . A 663 ARG CA . 34329 1 572 . 1 1 46 46 ARG CB C 13 26.523 0.300 . 1 . . . . A 663 ARG CB . 34329 1 573 . 1 1 46 46 ARG CG C 13 26.377 0.300 . 1 . . . . A 663 ARG CG . 34329 1 574 . 1 1 46 46 ARG CD C 13 40.697 0.300 . 1 . . . . A 663 ARG CD . 34329 1 575 . 1 1 46 46 ARG N N 15 124.890 0.300 . 1 . . . . A 663 ARG N . 34329 1 576 . 1 1 46 46 ARG NE N 15 80.771 0.300 . 1 . . . . A 663 ARG NE . 34329 1 577 . 1 1 47 47 ALA H H 1 8.510 0.020 . 1 . . . . A 664 ALA H . 34329 1 578 . 1 1 47 47 ALA HA H 1 4.115 0.020 . 1 . . . . A 664 ALA HA . 34329 1 579 . 1 1 47 47 ALA HB1 H 1 1.476 0.020 . 1 . . . . A 664 ALA HB1 . 34329 1 580 . 1 1 47 47 ALA HB2 H 1 1.476 0.020 . 1 . . . . A 664 ALA HB2 . 34329 1 581 . 1 1 47 47 ALA HB3 H 1 1.476 0.020 . 1 . . . . A 664 ALA HB3 . 34329 1 582 . 1 1 47 47 ALA C C 13 176.634 0.300 . 1 . . . . A 664 ALA C . 34329 1 583 . 1 1 47 47 ALA CA C 13 53.202 0.300 . 1 . . . . A 664 ALA CA . 34329 1 584 . 1 1 47 47 ALA CB C 13 16.896 0.300 . 1 . . . . A 664 ALA CB . 34329 1 585 . 1 1 47 47 ALA N N 15 119.839 0.300 . 1 . . . . A 664 ALA N . 34329 1 586 . 1 1 48 48 LEU H H 1 6.889 0.020 . 1 . . . . A 665 LEU H . 34329 1 587 . 1 1 48 48 LEU HA H 1 3.827 0.020 . 1 . . . . A 665 LEU HA . 34329 1 588 . 1 1 48 48 LEU HB2 H 1 1.191 0.020 . 1 . . . . A 665 LEU HB2 . 34329 1 589 . 1 1 48 48 LEU HB3 H 1 2.286 0.020 . 1 . . . . A 665 LEU HB3 . 34329 1 590 . 1 1 48 48 LEU HG H 1 1.385 0.020 . 1 . . . . A 665 LEU HG . 34329 1 591 . 1 1 48 48 LEU HD11 H 1 0.782 0.020 . 2 . . . . A 665 LEU HD11 . 34329 1 592 . 1 1 48 48 LEU HD12 H 1 0.782 0.020 . 2 . . . . A 665 LEU HD12 . 34329 1 593 . 1 1 48 48 LEU HD13 H 1 0.782 0.020 . 2 . . . . A 665 LEU HD13 . 34329 1 594 . 1 1 48 48 LEU HD21 H 1 0.887 0.020 . 2 . . . . A 665 LEU HD21 . 34329 1 595 . 1 1 48 48 LEU HD22 H 1 0.887 0.020 . 2 . . . . A 665 LEU HD22 . 34329 1 596 . 1 1 48 48 LEU HD23 H 1 0.887 0.020 . 2 . . . . A 665 LEU HD23 . 34329 1 597 . 1 1 48 48 LEU C C 13 174.576 0.300 . 1 . . . . A 665 LEU C . 34329 1 598 . 1 1 48 48 LEU CA C 13 55.103 0.300 . 1 . . . . A 665 LEU CA . 34329 1 599 . 1 1 48 48 LEU CB C 13 38.878 0.300 . 1 . . . . A 665 LEU CB . 34329 1 600 . 1 1 48 48 LEU CG C 13 24.109 0.300 . 1 . . . . A 665 LEU CG . 34329 1 601 . 1 1 48 48 LEU CD1 C 13 20.571 0.300 . 1 . . . . A 665 LEU CD1 . 34329 1 602 . 1 1 48 48 LEU CD2 C 13 22.786 0.300 . 1 . . . . A 665 LEU CD2 . 34329 1 603 . 1 1 48 48 LEU N N 15 115.811 0.300 . 1 . . . . A 665 LEU N . 34329 1 604 . 1 1 49 49 CYS H H 1 7.074 0.020 . 1 . . . . A 666 CYS H . 34329 1 605 . 1 1 49 49 CYS HA H 1 3.662 0.020 . 1 . . . . A 666 CYS HA . 34329 1 606 . 1 1 49 49 CYS HB2 H 1 2.424 0.020 . 1 . . . . A 666 CYS HB2 . 34329 1 607 . 1 1 49 49 CYS HB3 H 1 3.316 0.020 . 1 . . . . A 666 CYS HB3 . 34329 1 608 . 1 1 49 49 CYS HG H 1 2.855 0.020 . 1 . . . . A 666 CYS HG . 34329 1 609 . 1 1 49 49 CYS C C 13 173.360 0.300 . 1 . . . . A 666 CYS C . 34329 1 610 . 1 1 49 49 CYS CA C 13 60.661 0.300 . 1 . . . . A 666 CYS CA . 34329 1 611 . 1 1 49 49 CYS CB C 13 23.882 0.300 . 1 . . . . A 666 CYS CB . 34329 1 612 . 1 1 49 49 CYS N N 15 116.271 0.300 . 1 . . . . A 666 CYS N . 34329 1 613 . 1 1 50 50 TYR H H 1 8.092 0.020 . 1 . . . . A 667 TYR H . 34329 1 614 . 1 1 50 50 TYR HA H 1 4.085 0.020 . 1 . . . . A 667 TYR HA . 34329 1 615 . 1 1 50 50 TYR HB2 H 1 2.533 0.020 . 1 . . . . A 667 TYR HB2 . 34329 1 616 . 1 1 50 50 TYR HB3 H 1 3.529 0.020 . 1 . . . . A 667 TYR HB3 . 34329 1 617 . 1 1 50 50 TYR HD1 H 1 6.735 0.020 . 3 . . . . A 667 TYR HD1 . 34329 1 618 . 1 1 50 50 TYR HD2 H 1 6.735 0.020 . 3 . . . . A 667 TYR HD2 . 34329 1 619 . 1 1 50 50 TYR HE1 H 1 6.643 0.020 . 3 . . . . A 667 TYR HE1 . 34329 1 620 . 1 1 50 50 TYR HE2 H 1 6.643 0.020 . 3 . . . . A 667 TYR HE2 . 34329 1 621 . 1 1 50 50 TYR HH H 1 11.325 0.020 . 1 . . . . A 667 TYR HH . 34329 1 622 . 1 1 50 50 TYR C C 13 176.197 0.300 . 1 . . . . A 667 TYR C . 34329 1 623 . 1 1 50 50 TYR CA C 13 58.562 0.300 . 1 . . . . A 667 TYR CA . 34329 1 624 . 1 1 50 50 TYR CB C 13 34.203 0.300 . 1 . . . . A 667 TYR CB . 34329 1 625 . 1 1 50 50 TYR CD1 C 13 127.633 0.300 . 1 . . . . A 667 TYR CD1 . 34329 1 626 . 1 1 50 50 TYR CE1 C 13 113.196 0.300 . 1 . . . . A 667 TYR CE1 . 34329 1 627 . 1 1 50 50 TYR N N 15 116.738 0.300 . 1 . . . . A 667 TYR N . 34329 1 628 . 1 1 51 51 LEU H H 1 8.492 0.020 . 1 . . . . A 668 LEU H . 34329 1 629 . 1 1 51 51 LEU HA H 1 3.530 0.020 . 1 . . . . A 668 LEU HA . 34329 1 630 . 1 1 51 51 LEU HB2 H 1 1.404 0.020 . 1 . . . . A 668 LEU HB2 . 34329 1 631 . 1 1 51 51 LEU HB3 H 1 2.002 0.020 . 1 . . . . A 668 LEU HB3 . 34329 1 632 . 1 1 51 51 LEU HG H 1 1.760 0.020 . 1 . . . . A 668 LEU HG . 34329 1 633 . 1 1 51 51 LEU HD11 H 1 0.780 0.020 . 2 . . . . A 668 LEU HD11 . 34329 1 634 . 1 1 51 51 LEU HD12 H 1 0.780 0.020 . 2 . . . . A 668 LEU HD12 . 34329 1 635 . 1 1 51 51 LEU HD13 H 1 0.780 0.020 . 2 . . . . A 668 LEU HD13 . 34329 1 636 . 1 1 51 51 LEU HD21 H 1 0.823 0.020 . 2 . . . . A 668 LEU HD21 . 34329 1 637 . 1 1 51 51 LEU HD22 H 1 0.823 0.020 . 2 . . . . A 668 LEU HD22 . 34329 1 638 . 1 1 51 51 LEU HD23 H 1 0.823 0.020 . 2 . . . . A 668 LEU HD23 . 34329 1 639 . 1 1 51 51 LEU C C 13 178.361 0.300 . 1 . . . . A 668 LEU C . 34329 1 640 . 1 1 51 51 LEU CA C 13 55.769 0.300 . 1 . . . . A 668 LEU CA . 34329 1 641 . 1 1 51 51 LEU CB C 13 39.086 0.300 . 1 . . . . A 668 LEU CB . 34329 1 642 . 1 1 51 51 LEU CG C 13 23.759 0.300 . 1 . . . . A 668 LEU CG . 34329 1 643 . 1 1 51 51 LEU CD1 C 13 20.197 0.300 . 1 . . . . A 668 LEU CD1 . 34329 1 644 . 1 1 51 51 LEU CD2 C 13 22.438 0.300 . 1 . . . . A 668 LEU CD2 . 34329 1 645 . 1 1 51 51 LEU N N 15 119.891 0.300 . 1 . . . . A 668 LEU N . 34329 1 646 . 1 1 52 52 LYS H H 1 7.795 0.020 . 1 . . . . A 669 LYS H . 34329 1 647 . 1 1 52 52 LYS HA H 1 3.744 0.020 . 1 . . . . A 669 LYS HA . 34329 1 648 . 1 1 52 52 LYS HB2 H 1 1.004 0.020 . 1 . . . . A 669 LYS HB2 . 34329 1 649 . 1 1 52 52 LYS HB3 H 1 1.149 0.020 . 1 . . . . A 669 LYS HB3 . 34329 1 650 . 1 1 52 52 LYS HG2 H 1 -0.06 0.020 . 1 . . . . A 669 LYS HG2 . 34329 1 651 . 1 1 52 52 LYS HG3 H 1 1.025 0.020 . 1 . . . . A 669 LYS HG3 . 34329 1 652 . 1 1 52 52 LYS HD2 H 1 1.158 0.020 . 1 . . . . A 669 LYS HD2 . 34329 1 653 . 1 1 52 52 LYS HD3 H 1 1.395 0.020 . 1 . . . . A 669 LYS HD3 . 34329 1 654 . 1 1 52 52 LYS HE2 H 1 2.562 0.020 . 2 . . . . A 669 LYS HE2 . 34329 1 655 . 1 1 52 52 LYS HE3 H 1 2.562 0.020 . 2 . . . . A 669 LYS HE3 . 34329 1 656 . 1 1 52 52 LYS C C 13 175.546 0.300 . 1 . . . . A 669 LYS C . 34329 1 657 . 1 1 52 52 LYS CA C 13 53.806 0.300 . 1 . . . . A 669 LYS CA . 34329 1 658 . 1 1 52 52 LYS CB C 13 28.300 0.300 . 1 . . . . A 669 LYS CB . 34329 1 659 . 1 1 52 52 LYS CG C 13 20.660 0.300 . 1 . . . . A 669 LYS CG . 34329 1 660 . 1 1 52 52 LYS CD C 13 25.015 0.300 . 1 . . . . A 669 LYS CD . 34329 1 661 . 1 1 52 52 LYS CE C 13 39.499 0.300 . 1 . . . . A 669 LYS CE . 34329 1 662 . 1 1 52 52 LYS N N 15 119.228 0.300 . 1 . . . . A 669 LYS N . 34329 1 663 . 1 1 53 53 LEU H H 1 7.257 0.020 . 1 . . . . A 670 LEU H . 34329 1 664 . 1 1 53 53 LEU HA H 1 4.221 0.020 . 1 . . . . A 670 LEU HA . 34329 1 665 . 1 1 53 53 LEU HB2 H 1 1.557 0.020 . 1 . . . . A 670 LEU HB2 . 34329 1 666 . 1 1 53 53 LEU HB3 H 1 1.687 0.020 . 1 . . . . A 670 LEU HB3 . 34329 1 667 . 1 1 53 53 LEU HG H 1 1.578 0.020 . 1 . . . . A 670 LEU HG . 34329 1 668 . 1 1 53 53 LEU HD11 H 1 0.572 0.020 . 2 . . . . A 670 LEU HD11 . 34329 1 669 . 1 1 53 53 LEU HD12 H 1 0.572 0.020 . 2 . . . . A 670 LEU HD12 . 34329 1 670 . 1 1 53 53 LEU HD13 H 1 0.572 0.020 . 2 . . . . A 670 LEU HD13 . 34329 1 671 . 1 1 53 53 LEU HD21 H 1 0.760 0.020 . 2 . . . . A 670 LEU HD21 . 34329 1 672 . 1 1 53 53 LEU HD22 H 1 0.760 0.020 . 2 . . . . A 670 LEU HD22 . 34329 1 673 . 1 1 53 53 LEU HD23 H 1 0.760 0.020 . 2 . . . . A 670 LEU HD23 . 34329 1 674 . 1 1 53 53 LEU C C 13 172.582 0.300 . 1 . . . . A 670 LEU C . 34329 1 675 . 1 1 53 53 LEU CA C 13 51.345 0.300 . 1 . . . . A 670 LEU CA . 34329 1 676 . 1 1 53 53 LEU CB C 13 38.622 0.300 . 1 . . . . A 670 LEU CB . 34329 1 677 . 1 1 53 53 LEU CG C 13 23.883 0.300 . 1 . . . . A 670 LEU CG . 34329 1 678 . 1 1 53 53 LEU CD1 C 13 23.144 0.300 . 1 . . . . A 670 LEU CD1 . 34329 1 679 . 1 1 53 53 LEU CD2 C 13 19.613 0.300 . 1 . . . . A 670 LEU CD2 . 34329 1 680 . 1 1 53 53 LEU N N 15 118.805 0.300 . 1 . . . . A 670 LEU N . 34329 1 681 . 1 1 54 54 CYS H H 1 7.733 0.020 . 1 . . . . A 671 CYS H . 34329 1 682 . 1 1 54 54 CYS HA H 1 2.562 0.020 . 1 . . . . A 671 CYS HA . 34329 1 683 . 1 1 54 54 CYS HB2 H 1 2.702 0.020 . 1 . . . . A 671 CYS HB2 . 34329 1 684 . 1 1 54 54 CYS HB3 H 1 3.028 0.020 . 1 . . . . A 671 CYS HB3 . 34329 1 685 . 1 1 54 54 CYS C C 13 170.278 0.300 . 1 . . . . A 671 CYS C . 34329 1 686 . 1 1 54 54 CYS CA C 13 56.758 0.300 . 1 . . . . A 671 CYS CA . 34329 1 687 . 1 1 54 54 CYS CB C 13 21.459 0.300 . 1 . . . . A 671 CYS CB . 34329 1 688 . 1 1 54 54 CYS N N 15 112.934 0.300 . 1 . . . . A 671 CYS N . 34329 1 689 . 1 1 55 55 GLN H H 1 8.134 0.020 . 1 . . . . A 672 GLN H . 34329 1 690 . 1 1 55 55 GLN HA H 1 4.221 0.020 . 1 . . . . A 672 GLN HA . 34329 1 691 . 1 1 55 55 GLN HB2 H 1 1.692 0.020 . 1 . . . . A 672 GLN HB2 . 34329 1 692 . 1 1 55 55 GLN HB3 H 1 2.014 0.020 . 1 . . . . A 672 GLN HB3 . 34329 1 693 . 1 1 55 55 GLN HG2 H 1 1.928 0.020 . 1 . . . . A 672 GLN HG2 . 34329 1 694 . 1 1 55 55 GLN HG3 H 1 2.002 0.020 . 1 . . . . A 672 GLN HG3 . 34329 1 695 . 1 1 55 55 GLN HE21 H 1 6.903 0.020 . 1 . . . . A 672 GLN HE21 . 34329 1 696 . 1 1 55 55 GLN HE22 H 1 6.424 0.020 . 1 . . . . A 672 GLN HE22 . 34329 1 697 . 1 1 55 55 GLN C C 13 172.891 0.300 . 1 . . . . A 672 GLN C . 34329 1 698 . 1 1 55 55 GLN CA C 13 50.921 0.300 . 1 . . . . A 672 GLN CA . 34329 1 699 . 1 1 55 55 GLN CB C 13 25.040 0.300 . 1 . . . . A 672 GLN CB . 34329 1 700 . 1 1 55 55 GLN CG C 13 31.658 0.300 . 1 . . . . A 672 GLN CG . 34329 1 701 . 1 1 55 55 GLN N N 15 120.923 0.300 . 1 . . . . A 672 GLN N . 34329 1 702 . 1 1 55 55 GLN NE2 N 15 108.607 0.300 . 1 . . . . A 672 GLN NE2 . 34329 1 703 . 1 1 56 56 PHE H H 1 6.728 0.020 . 1 . . . . A 673 PHE H . 34329 1 704 . 1 1 56 56 PHE HA H 1 3.800 0.020 . 1 . . . . A 673 PHE HA . 34329 1 705 . 1 1 56 56 PHE HB2 H 1 2.551 0.020 . 1 . . . . A 673 PHE HB2 . 34329 1 706 . 1 1 56 56 PHE HB3 H 1 3.372 0.020 . 1 . . . . A 673 PHE HB3 . 34329 1 707 . 1 1 56 56 PHE HD1 H 1 7.040 0.020 . 3 . . . . A 673 PHE HD1 . 34329 1 708 . 1 1 56 56 PHE HD2 H 1 7.040 0.020 . 3 . . . . A 673 PHE HD2 . 34329 1 709 . 1 1 56 56 PHE HE1 H 1 7.351 0.020 . 3 . . . . A 673 PHE HE1 . 34329 1 710 . 1 1 56 56 PHE HE2 H 1 7.351 0.020 . 3 . . . . A 673 PHE HE2 . 34329 1 711 . 1 1 56 56 PHE HZ H 1 7.427 0.020 . 1 . . . . A 673 PHE HZ . 34329 1 712 . 1 1 56 56 PHE C C 13 174.832 0.300 . 1 . . . . A 673 PHE C . 34329 1 713 . 1 1 56 56 PHE CA C 13 59.341 0.300 . 1 . . . . A 673 PHE CA . 34329 1 714 . 1 1 56 56 PHE CB C 13 35.677 0.300 . 1 . . . . A 673 PHE CB . 34329 1 715 . 1 1 56 56 PHE CD1 C 13 128.192 0.300 . 1 . . . . A 673 PHE CD1 . 34329 1 716 . 1 1 56 56 PHE CE1 C 13 129.673 0.300 . 1 . . . . A 673 PHE CE1 . 34329 1 717 . 1 1 56 56 PHE CZ C 13 127.936 0.300 . 1 . . . . A 673 PHE CZ . 34329 1 718 . 1 1 56 56 PHE N N 15 118.874 0.300 . 1 . . . . A 673 PHE N . 34329 1 719 . 1 1 57 57 GLU H H 1 8.800 0.020 . 1 . . . . A 674 GLU H . 34329 1 720 . 1 1 57 57 GLU HA H 1 3.806 0.020 . 1 . . . . A 674 GLU HA . 34329 1 721 . 1 1 57 57 GLU HB2 H 1 1.616 0.020 . 1 . . . . A 674 GLU HB2 . 34329 1 722 . 1 1 57 57 GLU HB3 H 1 1.860 0.020 . 1 . . . . A 674 GLU HB3 . 34329 1 723 . 1 1 57 57 GLU HG2 H 1 1.997 0.020 . 1 . . . . A 674 GLU HG2 . 34329 1 724 . 1 1 57 57 GLU HG3 H 1 2.137 0.020 . 1 . . . . A 674 GLU HG3 . 34329 1 725 . 1 1 57 57 GLU C C 13 175.536 0.300 . 1 . . . . A 674 GLU C . 34329 1 726 . 1 1 57 57 GLU CA C 13 56.745 0.300 . 1 . . . . A 674 GLU CA . 34329 1 727 . 1 1 57 57 GLU CB C 13 25.719 0.300 . 1 . . . . A 674 GLU CB . 34329 1 728 . 1 1 57 57 GLU CG C 13 32.328 0.300 . 1 . . . . A 674 GLU CG . 34329 1 729 . 1 1 57 57 GLU N N 15 121.139 0.300 . 1 . . . . A 674 GLU N . 34329 1 730 . 1 1 58 58 GLU H H 1 9.082 0.020 . 1 . . . . A 675 GLU H . 34329 1 731 . 1 1 58 58 GLU HA H 1 3.274 0.020 . 1 . . . . A 675 GLU HA . 34329 1 732 . 1 1 58 58 GLU HB2 H 1 -0.12 0.020 . 1 . . . . A 675 GLU HB2 . 34329 1 733 . 1 1 58 58 GLU HB3 H 1 0.813 0.020 . 1 . . . . A 675 GLU HB3 . 34329 1 734 . 1 1 58 58 GLU HG2 H 1 1.682 0.020 . 1 . . . . A 675 GLU HG2 . 34329 1 735 . 1 1 58 58 GLU HG3 H 1 1.820 0.020 . 1 . . . . A 675 GLU HG3 . 34329 1 736 . 1 1 58 58 GLU C C 13 176.773 0.300 . 1 . . . . A 675 GLU C . 34329 1 737 . 1 1 58 58 GLU CA C 13 57.940 0.300 . 1 . . . . A 675 GLU CA . 34329 1 738 . 1 1 58 58 GLU CB C 13 21.984 0.300 . 1 . . . . A 675 GLU CB . 34329 1 739 . 1 1 58 58 GLU CG C 13 35.138 0.300 . 1 . . . . A 675 GLU CG . 34329 1 740 . 1 1 58 58 GLU N N 15 121.233 0.300 . 1 . . . . A 675 GLU N . 34329 1 741 . 1 1 59 59 ALA H H 1 7.548 0.020 . 1 . . . . A 676 ALA H . 34329 1 742 . 1 1 59 59 ALA HA H 1 3.921 0.020 . 1 . . . . A 676 ALA HA . 34329 1 743 . 1 1 59 59 ALA HB1 H 1 1.384 0.020 . 1 . . . . A 676 ALA HB1 . 34329 1 744 . 1 1 59 59 ALA HB2 H 1 1.384 0.020 . 1 . . . . A 676 ALA HB2 . 34329 1 745 . 1 1 59 59 ALA HB3 H 1 1.384 0.020 . 1 . . . . A 676 ALA HB3 . 34329 1 746 . 1 1 59 59 ALA C C 13 175.909 0.300 . 1 . . . . A 676 ALA C . 34329 1 747 . 1 1 59 59 ALA CA C 13 52.788 0.300 . 1 . . . . A 676 ALA CA . 34329 1 748 . 1 1 59 59 ALA CB C 13 16.242 0.300 . 1 . . . . A 676 ALA CB . 34329 1 749 . 1 1 59 59 ALA N N 15 119.979 0.300 . 1 . . . . A 676 ALA N . 34329 1 750 . 1 1 60 60 LYS H H 1 8.108 0.020 . 1 . . . . A 677 LYS H . 34329 1 751 . 1 1 60 60 LYS HA H 1 3.245 0.020 . 1 . . . . A 677 LYS HA . 34329 1 752 . 1 1 60 60 LYS HB2 H 1 1.407 0.020 . 1 . . . . A 677 LYS HB2 . 34329 1 753 . 1 1 60 60 LYS HB3 H 1 1.892 0.020 . 1 . . . . A 677 LYS HB3 . 34329 1 754 . 1 1 60 60 LYS HG2 H 1 0.771 0.020 . 1 . . . . A 677 LYS HG2 . 34329 1 755 . 1 1 60 60 LYS HG3 H 1 0.907 0.020 . 1 . . . . A 677 LYS HG3 . 34329 1 756 . 1 1 60 60 LYS HD2 H 1 1.203 0.020 . 1 . . . . A 677 LYS HD2 . 34329 1 757 . 1 1 60 60 LYS HD3 H 1 1.322 0.020 . 1 . . . . A 677 LYS HD3 . 34329 1 758 . 1 1 60 60 LYS HE2 H 1 2.698 0.020 . 1 . . . . A 677 LYS HE2 . 34329 1 759 . 1 1 60 60 LYS HE3 H 1 2.783 0.020 . 1 . . . . A 677 LYS HE3 . 34329 1 760 . 1 1 60 60 LYS C C 13 174.906 0.300 . 1 . . . . A 677 LYS C . 34329 1 761 . 1 1 60 60 LYS CA C 13 58.014 0.300 . 1 . . . . A 677 LYS CA . 34329 1 762 . 1 1 60 60 LYS CB C 13 28.577 0.300 . 1 . . . . A 677 LYS CB . 34329 1 763 . 1 1 60 60 LYS CG C 13 21.190 0.300 . 1 . . . . A 677 LYS CG . 34329 1 764 . 1 1 60 60 LYS CD C 13 26.053 0.300 . 1 . . . . A 677 LYS CD . 34329 1 765 . 1 1 60 60 LYS CE C 13 38.944 0.300 . 1 . . . . A 677 LYS CE . 34329 1 766 . 1 1 60 60 LYS N N 15 119.708 0.300 . 1 . . . . A 677 LYS N . 34329 1 767 . 1 1 61 61 GLN H H 1 7.961 0.020 . 1 . . . . A 678 GLN H . 34329 1 768 . 1 1 61 61 GLN HA H 1 3.857 0.020 . 1 . . . . A 678 GLN HA . 34329 1 769 . 1 1 61 61 GLN HB2 H 1 1.976 0.020 . 2 . . . . A 678 GLN HB2 . 34329 1 770 . 1 1 61 61 GLN HB3 H 1 1.976 0.020 . 2 . . . . A 678 GLN HB3 . 34329 1 771 . 1 1 61 61 GLN HG2 H 1 2.289 0.020 . 1 . . . . A 678 GLN HG2 . 34329 1 772 . 1 1 61 61 GLN HG3 H 1 2.412 0.020 . 1 . . . . A 678 GLN HG3 . 34329 1 773 . 1 1 61 61 GLN HE21 H 1 7.741 0.020 . 1 . . . . A 678 GLN HE21 . 34329 1 774 . 1 1 61 61 GLN HE22 H 1 6.657 0.020 . 1 . . . . A 678 GLN HE22 . 34329 1 775 . 1 1 61 61 GLN C C 13 176.431 0.300 . 1 . . . . A 678 GLN C . 34329 1 776 . 1 1 61 61 GLN CA C 13 56.123 0.300 . 1 . . . . A 678 GLN CA . 34329 1 777 . 1 1 61 61 GLN CB C 13 25.341 0.300 . 1 . . . . A 678 GLN CB . 34329 1 778 . 1 1 61 61 GLN CG C 13 31.011 0.300 . 1 . . . . A 678 GLN CG . 34329 1 779 . 1 1 61 61 GLN N N 15 117.111 0.300 . 1 . . . . A 678 GLN N . 34329 1 780 . 1 1 61 61 GLN NE2 N 15 111.905 0.300 . 1 . . . . A 678 GLN NE2 . 34329 1 781 . 1 1 62 62 ASP H H 1 7.620 0.020 . 1 . . . . A 679 ASP H . 34329 1 782 . 1 1 62 62 ASP HA H 1 4.458 0.020 . 1 . . . . A 679 ASP HA . 34329 1 783 . 1 1 62 62 ASP HB2 H 1 2.690 0.020 . 1 . . . . A 679 ASP HB2 . 34329 1 784 . 1 1 62 62 ASP HB3 H 1 3.110 0.020 . 1 . . . . A 679 ASP HB3 . 34329 1 785 . 1 1 62 62 ASP C C 13 176.517 0.300 . 1 . . . . A 679 ASP C . 34329 1 786 . 1 1 62 62 ASP CA C 13 54.869 0.300 . 1 . . . . A 679 ASP CA . 34329 1 787 . 1 1 62 62 ASP CB C 13 37.172 0.300 . 1 . . . . A 679 ASP CB . 34329 1 788 . 1 1 62 62 ASP N N 15 121.584 0.300 . 1 . . . . A 679 ASP N . 34329 1 789 . 1 1 63 63 CYS H H 1 7.791 0.020 . 1 . . . . A 680 CYS H . 34329 1 790 . 1 1 63 63 CYS HA H 1 3.723 0.020 . 1 . . . . A 680 CYS HA . 34329 1 791 . 1 1 63 63 CYS HB2 H 1 2.398 0.020 . 1 . . . . A 680 CYS HB2 . 34329 1 792 . 1 1 63 63 CYS HB3 H 1 2.831 0.020 . 1 . . . . A 680 CYS HB3 . 34329 1 793 . 1 1 63 63 CYS HG H 1 2.698 0.020 . 1 . . . . A 680 CYS HG . 34329 1 794 . 1 1 63 63 CYS C C 13 173.456 0.300 . 1 . . . . A 680 CYS C . 34329 1 795 . 1 1 63 63 CYS CA C 13 61.981 0.300 . 1 . . . . A 680 CYS CA . 34329 1 796 . 1 1 63 63 CYS CB C 13 24.124 0.300 . 1 . . . . A 680 CYS CB . 34329 1 797 . 1 1 63 63 CYS N N 15 119.118 0.300 . 1 . . . . A 680 CYS N . 34329 1 798 . 1 1 64 64 ASP H H 1 8.490 0.020 . 1 . . . . A 681 ASP H . 34329 1 799 . 1 1 64 64 ASP HA H 1 4.004 0.020 . 1 . . . . A 681 ASP HA . 34329 1 800 . 1 1 64 64 ASP HB2 H 1 2.309 0.020 . 1 . . . . A 681 ASP HB2 . 34329 1 801 . 1 1 64 64 ASP HB3 H 1 2.724 0.020 . 1 . . . . A 681 ASP HB3 . 34329 1 802 . 1 1 64 64 ASP C C 13 176.677 0.300 . 1 . . . . A 681 ASP C . 34329 1 803 . 1 1 64 64 ASP CA C 13 54.555 0.300 . 1 . . . . A 681 ASP CA . 34329 1 804 . 1 1 64 64 ASP CB C 13 36.862 0.300 . 1 . . . . A 681 ASP CB . 34329 1 805 . 1 1 64 64 ASP N N 15 120.188 0.300 . 1 . . . . A 681 ASP N . 34329 1 806 . 1 1 65 65 GLN H H 1 7.514 0.020 . 1 . . . . A 682 GLN H . 34329 1 807 . 1 1 65 65 GLN HA H 1 3.609 0.020 . 1 . . . . A 682 GLN HA . 34329 1 808 . 1 1 65 65 GLN HB2 H 1 0.949 0.020 . 1 . . . . A 682 GLN HB2 . 34329 1 809 . 1 1 65 65 GLN HB3 H 1 1.437 0.020 . 1 . . . . A 682 GLN HB3 . 34329 1 810 . 1 1 65 65 GLN HG2 H 1 1.682 0.020 . 1 . . . . A 682 GLN HG2 . 34329 1 811 . 1 1 65 65 GLN HG3 H 1 1.840 0.020 . 1 . . . . A 682 GLN HG3 . 34329 1 812 . 1 1 65 65 GLN HE21 H 1 6.872 0.020 . 1 . . . . A 682 GLN HE21 . 34329 1 813 . 1 1 65 65 GLN HE22 H 1 6.652 0.020 . 1 . . . . A 682 GLN HE22 . 34329 1 814 . 1 1 65 65 GLN C C 13 175.951 0.300 . 1 . . . . A 682 GLN C . 34329 1 815 . 1 1 65 65 GLN CA C 13 55.373 0.300 . 1 . . . . A 682 GLN CA . 34329 1 816 . 1 1 65 65 GLN CB C 13 24.407 0.300 . 1 . . . . A 682 GLN CB . 34329 1 817 . 1 1 65 65 GLN CG C 13 30.303 0.300 . 1 . . . . A 682 GLN CG . 34329 1 818 . 1 1 65 65 GLN N N 15 119.090 0.300 . 1 . . . . A 682 GLN N . 34329 1 819 . 1 1 65 65 GLN NE2 N 15 111.639 0.300 . 1 . . . . A 682 GLN NE2 . 34329 1 820 . 1 1 66 66 ALA H H 1 7.965 0.020 . 1 . . . . A 683 ALA H . 34329 1 821 . 1 1 66 66 ALA HA H 1 3.653 0.020 . 1 . . . . A 683 ALA HA . 34329 1 822 . 1 1 66 66 ALA HB1 H 1 1.303 0.020 . 1 . . . . A 683 ALA HB1 . 34329 1 823 . 1 1 66 66 ALA HB2 H 1 1.303 0.020 . 1 . . . . A 683 ALA HB2 . 34329 1 824 . 1 1 66 66 ALA HB3 H 1 1.303 0.020 . 1 . . . . A 683 ALA HB3 . 34329 1 825 . 1 1 66 66 ALA C C 13 176.709 0.300 . 1 . . . . A 683 ALA C . 34329 1 826 . 1 1 66 66 ALA CA C 13 52.782 0.300 . 1 . . . . A 683 ALA CA . 34329 1 827 . 1 1 66 66 ALA CB C 13 15.931 0.300 . 1 . . . . A 683 ALA CB . 34329 1 828 . 1 1 66 66 ALA N N 15 121.769 0.300 . 1 . . . . A 683 ALA N . 34329 1 829 . 1 1 67 67 LEU H H 1 7.733 0.020 . 1 . . . . A 684 LEU H . 34329 1 830 . 1 1 67 67 LEU HA H 1 3.977 0.020 . 1 . . . . A 684 LEU HA . 34329 1 831 . 1 1 67 67 LEU HB2 H 1 1.078 0.020 . 1 . . . . A 684 LEU HB2 . 34329 1 832 . 1 1 67 67 LEU HB3 H 1 1.457 0.020 . 1 . . . . A 684 LEU HB3 . 34329 1 833 . 1 1 67 67 LEU HG H 1 1.080 0.020 . 1 . . . . A 684 LEU HG . 34329 1 834 . 1 1 67 67 LEU HD11 H 1 0.039 0.020 . 2 . . . . A 684 LEU HD11 . 34329 1 835 . 1 1 67 67 LEU HD12 H 1 0.039 0.020 . 2 . . . . A 684 LEU HD12 . 34329 1 836 . 1 1 67 67 LEU HD13 H 1 0.039 0.020 . 2 . . . . A 684 LEU HD13 . 34329 1 837 . 1 1 67 67 LEU HD21 H 1 0.175 0.020 . 2 . . . . A 684 LEU HD21 . 34329 1 838 . 1 1 67 67 LEU HD22 H 1 0.175 0.020 . 2 . . . . A 684 LEU HD22 . 34329 1 839 . 1 1 67 67 LEU HD23 H 1 0.175 0.020 . 2 . . . . A 684 LEU HD23 . 34329 1 840 . 1 1 67 67 LEU C C 13 175.941 0.300 . 1 . . . . A 684 LEU C . 34329 1 841 . 1 1 67 67 LEU CA C 13 53.471 0.300 . 1 . . . . A 684 LEU CA . 34329 1 842 . 1 1 67 67 LEU CB C 13 38.752 0.300 . 1 . . . . A 684 LEU CB . 34329 1 843 . 1 1 67 67 LEU CG C 13 24.440 0.300 . 1 . . . . A 684 LEU CG . 34329 1 844 . 1 1 67 67 LEU CD1 C 13 21.487 0.300 . 1 . . . . A 684 LEU CD1 . 34329 1 845 . 1 1 67 67 LEU CD2 C 13 19.836 0.300 . 1 . . . . A 684 LEU CD2 . 34329 1 846 . 1 1 67 67 LEU N N 15 116.738 0.300 . 1 . . . . A 684 LEU N . 34329 1 847 . 1 1 68 68 GLN H H 1 7.262 0.020 . 1 . . . . A 685 GLN H . 34329 1 848 . 1 1 68 68 GLN HA H 1 3.879 0.020 . 1 . . . . A 685 GLN HA . 34329 1 849 . 1 1 68 68 GLN HB2 H 1 1.923 0.020 . 2 . . . . A 685 GLN HB2 . 34329 1 850 . 1 1 68 68 GLN HB3 H 1 1.923 0.020 . 2 . . . . A 685 GLN HB3 . 34329 1 851 . 1 1 68 68 GLN HG2 H 1 2.201 0.020 . 1 . . . . A 685 GLN HG2 . 34329 1 852 . 1 1 68 68 GLN HG3 H 1 2.255 0.020 . 1 . . . . A 685 GLN HG3 . 34329 1 853 . 1 1 68 68 GLN HE21 H 1 7.198 0.020 . 1 . . . . A 685 GLN HE21 . 34329 1 854 . 1 1 68 68 GLN HE22 H 1 6.628 0.020 . 1 . . . . A 685 GLN HE22 . 34329 1 855 . 1 1 68 68 GLN C C 13 175.162 0.300 . 1 . . . . A 685 GLN C . 34329 1 856 . 1 1 68 68 GLN CA C 13 54.754 0.300 . 1 . . . . A 685 GLN CA . 34329 1 857 . 1 1 68 68 GLN CB C 13 25.648 0.300 . 1 . . . . A 685 GLN CB . 34329 1 858 . 1 1 68 68 GLN CG C 13 31.274 0.300 . 1 . . . . A 685 GLN CG . 34329 1 859 . 1 1 68 68 GLN N N 15 118.042 0.300 . 1 . . . . A 685 GLN N . 34329 1 860 . 1 1 68 68 GLN NE2 N 15 111.755 0.300 . 1 . . . . A 685 GLN NE2 . 34329 1 861 . 1 1 69 69 LEU H H 1 7.067 0.020 . 1 . . . . A 686 LEU H . 34329 1 862 . 1 1 69 69 LEU HA H 1 4.049 0.020 . 1 . . . . A 686 LEU HA . 34329 1 863 . 1 1 69 69 LEU HB2 H 1 1.336 0.020 . 1 . . . . A 686 LEU HB2 . 34329 1 864 . 1 1 69 69 LEU HB3 H 1 1.836 0.020 . 1 . . . . A 686 LEU HB3 . 34329 1 865 . 1 1 69 69 LEU HG H 1 1.594 0.020 . 1 . . . . A 686 LEU HG . 34329 1 866 . 1 1 69 69 LEU HD11 H 1 0.716 0.020 . 2 . . . . A 686 LEU HD11 . 34329 1 867 . 1 1 69 69 LEU HD12 H 1 0.716 0.020 . 2 . . . . A 686 LEU HD12 . 34329 1 868 . 1 1 69 69 LEU HD13 H 1 0.716 0.020 . 2 . . . . A 686 LEU HD13 . 34329 1 869 . 1 1 69 69 LEU HD21 H 1 0.802 0.020 . 2 . . . . A 686 LEU HD21 . 34329 1 870 . 1 1 69 69 LEU HD22 H 1 0.802 0.020 . 2 . . . . A 686 LEU HD22 . 34329 1 871 . 1 1 69 69 LEU HD23 H 1 0.802 0.020 . 2 . . . . A 686 LEU HD23 . 34329 1 872 . 1 1 69 69 LEU C C 13 174.906 0.300 . 1 . . . . A 686 LEU C . 34329 1 873 . 1 1 69 69 LEU CA C 13 53.416 0.300 . 1 . . . . A 686 LEU CA . 34329 1 874 . 1 1 69 69 LEU CB C 13 40.026 0.300 . 1 . . . . A 686 LEU CB . 34329 1 875 . 1 1 69 69 LEU CG C 13 23.766 0.300 . 1 . . . . A 686 LEU CG . 34329 1 876 . 1 1 69 69 LEU CD1 C 13 22.862 0.300 . 1 . . . . A 686 LEU CD1 . 34329 1 877 . 1 1 69 69 LEU CD2 C 13 19.494 0.300 . 1 . . . . A 686 LEU CD2 . 34329 1 878 . 1 1 69 69 LEU N N 15 118.642 0.300 . 1 . . . . A 686 LEU N . 34329 1 879 . 1 1 70 70 ALA H H 1 7.854 0.020 . 1 . . . . A 687 ALA H . 34329 1 880 . 1 1 70 70 ALA HA H 1 4.342 0.020 . 1 . . . . A 687 ALA HA . 34329 1 881 . 1 1 70 70 ALA HB1 H 1 1.273 0.020 . 1 . . . . A 687 ALA HB1 . 34329 1 882 . 1 1 70 70 ALA HB2 H 1 1.273 0.020 . 1 . . . . A 687 ALA HB2 . 34329 1 883 . 1 1 70 70 ALA HB3 H 1 1.273 0.020 . 1 . . . . A 687 ALA HB3 . 34329 1 884 . 1 1 70 70 ALA C C 13 172.006 0.300 . 1 . . . . A 687 ALA C . 34329 1 885 . 1 1 70 70 ALA CA C 13 49.266 0.300 . 1 . . . . A 687 ALA CA . 34329 1 886 . 1 1 70 70 ALA CB C 13 17.538 0.300 . 1 . . . . A 687 ALA CB . 34329 1 887 . 1 1 70 70 ALA N N 15 123.528 0.300 . 1 . . . . A 687 ALA N . 34329 1 888 . 1 1 71 71 ASP H H 1 8.181 0.020 . 1 . . . . A 688 ASP H . 34329 1 889 . 1 1 71 71 ASP HA H 1 4.441 0.020 . 1 . . . . A 688 ASP HA . 34329 1 890 . 1 1 71 71 ASP HB2 H 1 2.522 0.020 . 1 . . . . A 688 ASP HB2 . 34329 1 891 . 1 1 71 71 ASP HB3 H 1 2.731 0.020 . 1 . . . . A 688 ASP HB3 . 34329 1 892 . 1 1 71 71 ASP C C 13 174.757 0.300 . 1 . . . . A 688 ASP C . 34329 1 893 . 1 1 71 71 ASP CA C 13 52.085 0.300 . 1 . . . . A 688 ASP CA . 34329 1 894 . 1 1 71 71 ASP CB C 13 37.823 0.300 . 1 . . . . A 688 ASP CB . 34329 1 895 . 1 1 71 71 ASP N N 15 121.832 0.300 . 1 . . . . A 688 ASP N . 34329 1 896 . 1 1 72 72 GLY H H 1 8.426 0.020 . 1 . . . . A 689 GLY H . 34329 1 897 . 1 1 72 72 GLY HA2 H 1 3.751 0.020 . 1 . . . . A 689 GLY HA2 . 34329 1 898 . 1 1 72 72 GLY HA3 H 1 4.020 0.020 . 1 . . . . A 689 GLY HA3 . 34329 1 899 . 1 1 72 72 GLY C C 13 170.801 0.300 . 1 . . . . A 689 GLY C . 34329 1 900 . 1 1 72 72 GLY CA C 13 42.684 0.300 . 1 . . . . A 689 GLY CA . 34329 1 901 . 1 1 72 72 GLY N N 15 108.221 0.300 . 1 . . . . A 689 GLY N . 34329 1 902 . 1 1 73 73 ASN H H 1 6.667 0.020 . 1 . . . . A 690 ASN H . 34329 1 903 . 1 1 73 73 ASN HA H 1 4.435 0.020 . 1 . . . . A 690 ASN HA . 34329 1 904 . 1 1 73 73 ASN HB2 H 1 2.601 0.020 . 2 . . . . A 690 ASN HB2 . 34329 1 905 . 1 1 73 73 ASN HB3 H 1 2.601 0.020 . 2 . . . . A 690 ASN HB3 . 34329 1 906 . 1 1 73 73 ASN HD21 H 1 7.123 0.020 . 1 . . . . A 690 ASN HD21 . 34329 1 907 . 1 1 73 73 ASN HD22 H 1 7.101 0.020 . 1 . . . . A 690 ASN HD22 . 34329 1 908 . 1 1 73 73 ASN C C 13 171.718 0.300 . 1 . . . . A 690 ASN C . 34329 1 909 . 1 1 73 73 ASN CA C 13 50.878 0.300 . 1 . . . . A 690 ASN CA . 34329 1 910 . 1 1 73 73 ASN CB C 13 35.661 0.300 . 1 . . . . A 690 ASN CB . 34329 1 911 . 1 1 73 73 ASN N N 15 117.045 0.300 . 1 . . . . A 690 ASN N . 34329 1 912 . 1 1 73 73 ASN ND2 N 15 112.639 0.300 . 1 . . . . A 690 ASN ND2 . 34329 1 913 . 1 1 74 74 VAL H H 1 8.419 0.020 . 1 . . . . A 691 VAL H . 34329 1 914 . 1 1 74 74 VAL HA H 1 3.713 0.020 . 1 . . . . A 691 VAL HA . 34329 1 915 . 1 1 74 74 VAL HB H 1 2.102 0.020 . 1 . . . . A 691 VAL HB . 34329 1 916 . 1 1 74 74 VAL HG11 H 1 1.023 0.020 . 2 . . . . A 691 VAL HG11 . 34329 1 917 . 1 1 74 74 VAL HG12 H 1 1.023 0.020 . 2 . . . . A 691 VAL HG12 . 34329 1 918 . 1 1 74 74 VAL HG13 H 1 1.023 0.020 . 2 . . . . A 691 VAL HG13 . 34329 1 919 . 1 1 74 74 VAL HG21 H 1 1.120 0.020 . 2 . . . . A 691 VAL HG21 . 34329 1 920 . 1 1 74 74 VAL HG22 H 1 1.120 0.020 . 2 . . . . A 691 VAL HG22 . 34329 1 921 . 1 1 74 74 VAL HG23 H 1 1.120 0.020 . 2 . . . . A 691 VAL HG23 . 34329 1 922 . 1 1 74 74 VAL C C 13 174.341 0.300 . 1 . . . . A 691 VAL C . 34329 1 923 . 1 1 74 74 VAL CA C 13 64.197 0.300 . 1 . . . . A 691 VAL CA . 34329 1 924 . 1 1 74 74 VAL CB C 13 29.309 0.300 . 1 . . . . A 691 VAL CB . 34329 1 925 . 1 1 74 74 VAL CG1 C 13 19.516 0.300 . 1 . . . . A 691 VAL CG1 . 34329 1 926 . 1 1 74 74 VAL CG2 C 13 20.895 0.300 . 1 . . . . A 691 VAL CG2 . 34329 1 927 . 1 1 74 74 VAL N N 15 127.320 0.300 . 1 . . . . A 691 VAL N . 34329 1 928 . 1 1 75 75 LYS H H 1 7.914 0.020 . 1 . . . . A 692 LYS H . 34329 1 929 . 1 1 75 75 LYS HA H 1 4.006 0.020 . 1 . . . . A 692 LYS HA . 34329 1 930 . 1 1 75 75 LYS HB2 H 1 1.408 0.020 . 1 . . . . A 692 LYS HB2 . 34329 1 931 . 1 1 75 75 LYS HB3 H 1 1.894 0.020 . 1 . . . . A 692 LYS HB3 . 34329 1 932 . 1 1 75 75 LYS HG2 H 1 1.316 0.020 . 1 . . . . A 692 LYS HG2 . 34329 1 933 . 1 1 75 75 LYS HG3 H 1 1.516 0.020 . 1 . . . . A 692 LYS HG3 . 34329 1 934 . 1 1 75 75 LYS HD2 H 1 1.565 0.020 . 2 . . . . A 692 LYS HD2 . 34329 1 935 . 1 1 75 75 LYS HD3 H 1 1.565 0.020 . 2 . . . . A 692 LYS HD3 . 34329 1 936 . 1 1 75 75 LYS HE2 H 1 2.862 0.020 . 2 . . . . A 692 LYS HE2 . 34329 1 937 . 1 1 75 75 LYS HE3 H 1 2.862 0.020 . 2 . . . . A 692 LYS HE3 . 34329 1 938 . 1 1 75 75 LYS C C 13 175.855 0.300 . 1 . . . . A 692 LYS C . 34329 1 939 . 1 1 75 75 LYS CA C 13 56.982 0.300 . 1 . . . . A 692 LYS CA . 34329 1 940 . 1 1 75 75 LYS CB C 13 29.611 0.300 . 1 . . . . A 692 LYS CB . 34329 1 941 . 1 1 75 75 LYS CG C 13 23.097 0.300 . 1 . . . . A 692 LYS CG . 34329 1 942 . 1 1 75 75 LYS CD C 13 26.565 0.300 . 1 . . . . A 692 LYS CD . 34329 1 943 . 1 1 75 75 LYS CE C 13 39.257 0.300 . 1 . . . . A 692 LYS CE . 34329 1 944 . 1 1 75 75 LYS N N 15 118.935 0.300 . 1 . . . . A 692 LYS N . 34329 1 945 . 1 1 76 76 ALA H H 1 7.756 0.020 . 1 . . . . A 693 ALA H . 34329 1 946 . 1 1 76 76 ALA HA H 1 3.891 0.020 . 1 . . . . A 693 ALA HA . 34329 1 947 . 1 1 76 76 ALA HB1 H 1 1.060 0.020 . 1 . . . . A 693 ALA HB1 . 34329 1 948 . 1 1 76 76 ALA HB2 H 1 1.060 0.020 . 1 . . . . A 693 ALA HB2 . 34329 1 949 . 1 1 76 76 ALA HB3 H 1 1.060 0.020 . 1 . . . . A 693 ALA HB3 . 34329 1 950 . 1 1 76 76 ALA C C 13 176.570 0.300 . 1 . . . . A 693 ALA C . 34329 1 951 . 1 1 76 76 ALA CA C 13 52.016 0.300 . 1 . . . . A 693 ALA CA . 34329 1 952 . 1 1 76 76 ALA CB C 13 14.619 0.300 . 1 . . . . A 693 ALA CB . 34329 1 953 . 1 1 76 76 ALA N N 15 120.525 0.300 . 1 . . . . A 693 ALA N . 34329 1 954 . 1 1 77 77 PHE H H 1 7.797 0.020 . 1 . . . . A 694 PHE H . 34329 1 955 . 1 1 77 77 PHE HA H 1 4.082 0.020 . 1 . . . . A 694 PHE HA . 34329 1 956 . 1 1 77 77 PHE HB2 H 1 2.764 0.020 . 1 . . . . A 694 PHE HB2 . 34329 1 957 . 1 1 77 77 PHE HB3 H 1 3.067 0.020 . 1 . . . . A 694 PHE HB3 . 34329 1 958 . 1 1 77 77 PHE HD1 H 1 6.952 0.020 . 3 . . . . A 694 PHE HD1 . 34329 1 959 . 1 1 77 77 PHE HD2 H 1 6.952 0.020 . 3 . . . . A 694 PHE HD2 . 34329 1 960 . 1 1 77 77 PHE HE1 H 1 7.096 0.020 . 3 . . . . A 694 PHE HE1 . 34329 1 961 . 1 1 77 77 PHE HE2 H 1 7.096 0.020 . 3 . . . . A 694 PHE HE2 . 34329 1 962 . 1 1 77 77 PHE HZ H 1 7.276 0.020 . 1 . . . . A 694 PHE HZ . 34329 1 963 . 1 1 77 77 PHE C C 13 174.992 0.300 . 1 . . . . A 694 PHE C . 34329 1 964 . 1 1 77 77 PHE CA C 13 59.931 0.300 . 1 . . . . A 694 PHE CA . 34329 1 965 . 1 1 77 77 PHE CB C 13 37.331 0.300 . 1 . . . . A 694 PHE CB . 34329 1 966 . 1 1 77 77 PHE CD1 C 13 128.811 0.300 . 1 . . . . A 694 PHE CD1 . 34329 1 967 . 1 1 77 77 PHE CE1 C 13 129.310 0.300 . 1 . . . . A 694 PHE CE1 . 34329 1 968 . 1 1 77 77 PHE CZ C 13 127.533 0.300 . 1 . . . . A 694 PHE CZ . 34329 1 969 . 1 1 77 77 PHE N N 15 116.149 0.300 . 1 . . . . A 694 PHE N . 34329 1 970 . 1 1 78 78 TYR H H 1 8.513 0.020 . 1 . . . . A 695 TYR H . 34329 1 971 . 1 1 78 78 TYR HA H 1 4.024 0.020 . 1 . . . . A 695 TYR HA . 34329 1 972 . 1 1 78 78 TYR HB2 H 1 2.938 0.020 . 1 . . . . A 695 TYR HB2 . 34329 1 973 . 1 1 78 78 TYR HB3 H 1 3.129 0.020 . 1 . . . . A 695 TYR HB3 . 34329 1 974 . 1 1 78 78 TYR HD1 H 1 6.871 0.020 . 3 . . . . A 695 TYR HD1 . 34329 1 975 . 1 1 78 78 TYR HD2 H 1 6.871 0.020 . 3 . . . . A 695 TYR HD2 . 34329 1 976 . 1 1 78 78 TYR HE1 H 1 6.450 0.020 . 3 . . . . A 695 TYR HE1 . 34329 1 977 . 1 1 78 78 TYR HE2 H 1 6.450 0.020 . 3 . . . . A 695 TYR HE2 . 34329 1 978 . 1 1 78 78 TYR HH H 1 10.202 0.020 . 1 . . . . A 695 TYR HH . 34329 1 979 . 1 1 78 78 TYR C C 13 173.915 0.300 . 1 . . . . A 695 TYR C . 34329 1 980 . 1 1 78 78 TYR CA C 13 58.363 0.300 . 1 . . . . A 695 TYR CA . 34329 1 981 . 1 1 78 78 TYR CB C 13 35.681 0.300 . 1 . . . . A 695 TYR CB . 34329 1 982 . 1 1 78 78 TYR CD1 C 13 129.174 0.300 . 1 . . . . A 695 TYR CD1 . 34329 1 983 . 1 1 78 78 TYR CE1 C 13 115.243 0.300 . 1 . . . . A 695 TYR CE1 . 34329 1 984 . 1 1 78 78 TYR N N 15 118.584 0.300 . 1 . . . . A 695 TYR N . 34329 1 985 . 1 1 79 79 ARG H H 1 8.428 0.020 . 1 . . . . A 696 ARG H . 34329 1 986 . 1 1 79 79 ARG HA H 1 3.580 0.020 . 1 . . . . A 696 ARG HA . 34329 1 987 . 1 1 79 79 ARG HB2 H 1 1.322 0.020 . 1 . . . . A 696 ARG HB2 . 34329 1 988 . 1 1 79 79 ARG HB3 H 1 1.831 0.020 . 1 . . . . A 696 ARG HB3 . 34329 1 989 . 1 1 79 79 ARG HG2 H 1 1.441 0.020 . 1 . . . . A 696 ARG HG2 . 34329 1 990 . 1 1 79 79 ARG HG3 H 1 2.018 0.020 . 1 . . . . A 696 ARG HG3 . 34329 1 991 . 1 1 79 79 ARG HD2 H 1 2.733 0.020 . 1 . . . . A 696 ARG HD2 . 34329 1 992 . 1 1 79 79 ARG HD3 H 1 2.800 0.020 . 1 . . . . A 696 ARG HD3 . 34329 1 993 . 1 1 79 79 ARG C C 13 174.693 0.300 . 1 . . . . A 696 ARG C . 34329 1 994 . 1 1 79 79 ARG CA C 13 57.218 0.300 . 1 . . . . A 696 ARG CA . 34329 1 995 . 1 1 79 79 ARG CB C 13 26.305 0.300 . 1 . . . . A 696 ARG CB . 34329 1 996 . 1 1 79 79 ARG CG C 13 27.829 0.300 . 1 . . . . A 696 ARG CG . 34329 1 997 . 1 1 79 79 ARG CD C 13 41.101 0.300 . 1 . . . . A 696 ARG CD . 34329 1 998 . 1 1 79 79 ARG N N 15 116.102 0.300 . 1 . . . . A 696 ARG N . 34329 1 999 . 1 1 80 80 ARG H H 1 8.396 0.020 . 1 . . . . A 697 ARG H . 34329 1 1000 . 1 1 80 80 ARG HA H 1 3.541 0.020 . 1 . . . . A 697 ARG HA . 34329 1 1001 . 1 1 80 80 ARG HB2 H 1 1.466 0.020 . 1 . . . . A 697 ARG HB2 . 34329 1 1002 . 1 1 80 80 ARG HB3 H 1 2.279 0.020 . 1 . . . . A 697 ARG HB3 . 34329 1 1003 . 1 1 80 80 ARG HG2 H 1 1.048 0.020 . 1 . . . . A 697 ARG HG2 . 34329 1 1004 . 1 1 80 80 ARG HG3 H 1 1.748 0.020 . 1 . . . . A 697 ARG HG3 . 34329 1 1005 . 1 1 80 80 ARG HD2 H 1 2.529 0.020 . 1 . . . . A 697 ARG HD2 . 34329 1 1006 . 1 1 80 80 ARG HD3 H 1 3.215 0.020 . 1 . . . . A 697 ARG HD3 . 34329 1 1007 . 1 1 80 80 ARG HE H 1 9.512 0.020 . 1 . . . . A 697 ARG HE . 34329 1 1008 . 1 1 80 80 ARG C C 13 175.354 0.300 . 1 . . . . A 697 ARG C . 34329 1 1009 . 1 1 80 80 ARG CA C 13 57.981 0.300 . 1 . . . . A 697 ARG CA . 34329 1 1010 . 1 1 80 80 ARG CB C 13 26.951 0.300 . 1 . . . . A 697 ARG CB . 34329 1 1011 . 1 1 80 80 ARG CG C 13 25.624 0.300 . 1 . . . . A 697 ARG CG . 34329 1 1012 . 1 1 80 80 ARG CD C 13 41.405 0.300 . 1 . . . . A 697 ARG CD . 34329 1 1013 . 1 1 80 80 ARG N N 15 124.156 0.300 . 1 . . . . A 697 ARG N . 34329 1 1014 . 1 1 80 80 ARG NE N 15 79.729 0.300 . 1 . . . . A 697 ARG NE . 34329 1 1015 . 1 1 81 81 ALA H H 1 8.446 0.020 . 1 . . . . A 698 ALA H . 34329 1 1016 . 1 1 81 81 ALA HA H 1 4.192 0.020 . 1 . . . . A 698 ALA HA . 34329 1 1017 . 1 1 81 81 ALA HB1 H 1 1.655 0.020 . 1 . . . . A 698 ALA HB1 . 34329 1 1018 . 1 1 81 81 ALA HB2 H 1 1.655 0.020 . 1 . . . . A 698 ALA HB2 . 34329 1 1019 . 1 1 81 81 ALA HB3 H 1 1.655 0.020 . 1 . . . . A 698 ALA HB3 . 34329 1 1020 . 1 1 81 81 ALA C C 13 180.292 0.300 . 1 . . . . A 698 ALA C . 34329 1 1021 . 1 1 81 81 ALA CA C 13 52.838 0.300 . 1 . . . . A 698 ALA CA . 34329 1 1022 . 1 1 81 81 ALA CB C 13 15.623 0.300 . 1 . . . . A 698 ALA CB . 34329 1 1023 . 1 1 81 81 ALA N N 15 122.259 0.300 . 1 . . . . A 698 ALA N . 34329 1 1024 . 1 1 82 82 LEU H H 1 7.765 0.020 . 1 . . . . A 699 LEU H . 34329 1 1025 . 1 1 82 82 LEU HA H 1 3.801 0.020 . 1 . . . . A 699 LEU HA . 34329 1 1026 . 1 1 82 82 LEU HB2 H 1 1.177 0.020 . 1 . . . . A 699 LEU HB2 . 34329 1 1027 . 1 1 82 82 LEU HB3 H 1 1.819 0.020 . 1 . . . . A 699 LEU HB3 . 34329 1 1028 . 1 1 82 82 LEU HG H 1 1.273 0.020 . 1 . . . . A 699 LEU HG . 34329 1 1029 . 1 1 82 82 LEU HD11 H 1 0.452 0.020 . 2 . . . . A 699 LEU HD11 . 34329 1 1030 . 1 1 82 82 LEU HD12 H 1 0.452 0.020 . 2 . . . . A 699 LEU HD12 . 34329 1 1031 . 1 1 82 82 LEU HD13 H 1 0.452 0.020 . 2 . . . . A 699 LEU HD13 . 34329 1 1032 . 1 1 82 82 LEU HD21 H 1 0.449 0.020 . 2 . . . . A 699 LEU HD21 . 34329 1 1033 . 1 1 82 82 LEU HD22 H 1 0.449 0.020 . 2 . . . . A 699 LEU HD22 . 34329 1 1034 . 1 1 82 82 LEU HD23 H 1 0.449 0.020 . 2 . . . . A 699 LEU HD23 . 34329 1 1035 . 1 1 82 82 LEU C C 13 176.933 0.300 . 1 . . . . A 699 LEU C . 34329 1 1036 . 1 1 82 82 LEU CA C 13 54.376 0.300 . 1 . . . . A 699 LEU CA . 34329 1 1037 . 1 1 82 82 LEU CB C 13 38.021 0.300 . 1 . . . . A 699 LEU CB . 34329 1 1038 . 1 1 82 82 LEU CG C 13 23.480 0.300 . 1 . . . . A 699 LEU CG . 34329 1 1039 . 1 1 82 82 LEU CD1 C 13 18.164 0.300 . 1 . . . . A 699 LEU CD1 . 34329 1 1040 . 1 1 82 82 LEU CD2 C 13 22.418 0.300 . 1 . . . . A 699 LEU CD2 . 34329 1 1041 . 1 1 82 82 LEU N N 15 119.923 0.300 . 1 . . . . A 699 LEU N . 34329 1 1042 . 1 1 83 83 ALA H H 1 8.284 0.020 . 1 . . . . A 700 ALA H . 34329 1 1043 . 1 1 83 83 ALA HA H 1 3.893 0.020 . 1 . . . . A 700 ALA HA . 34329 1 1044 . 1 1 83 83 ALA HB1 H 1 1.404 0.020 . 1 . . . . A 700 ALA HB1 . 34329 1 1045 . 1 1 83 83 ALA HB2 H 1 1.404 0.020 . 1 . . . . A 700 ALA HB2 . 34329 1 1046 . 1 1 83 83 ALA HB3 H 1 1.404 0.020 . 1 . . . . A 700 ALA HB3 . 34329 1 1047 . 1 1 83 83 ALA C C 13 176.261 0.300 . 1 . . . . A 700 ALA C . 34329 1 1048 . 1 1 83 83 ALA CA C 13 52.664 0.300 . 1 . . . . A 700 ALA CA . 34329 1 1049 . 1 1 83 83 ALA CB C 13 14.620 0.300 . 1 . . . . A 700 ALA CB . 34329 1 1050 . 1 1 83 83 ALA N N 15 127.659 0.300 . 1 . . . . A 700 ALA N . 34329 1 1051 . 1 1 84 84 HIS H H 1 8.947 0.020 . 1 . . . . A 701 HIS H . 34329 1 1052 . 1 1 84 84 HIS HA H 1 4.321 0.020 . 1 . . . . A 701 HIS HA . 34329 1 1053 . 1 1 84 84 HIS HB2 H 1 2.817 0.020 . 1 . . . . A 701 HIS HB2 . 34329 1 1054 . 1 1 84 84 HIS HB3 H 1 3.162 0.020 . 1 . . . . A 701 HIS HB3 . 34329 1 1055 . 1 1 84 84 HIS HD2 H 1 6.911 0.020 . 1 . . . . A 701 HIS HD2 . 34329 1 1056 . 1 1 84 84 HIS HE1 H 1 7.469 0.020 . 1 . . . . A 701 HIS HE1 . 34329 1 1057 . 1 1 84 84 HIS C C 13 175.802 0.300 . 1 . . . . A 701 HIS C . 34329 1 1058 . 1 1 84 84 HIS CA C 13 56.751 0.300 . 1 . . . . A 701 HIS CA . 34329 1 1059 . 1 1 84 84 HIS CB C 13 27.783 0.300 . 1 . . . . A 701 HIS CB . 34329 1 1060 . 1 1 84 84 HIS CE1 C 13 135.760 0.300 . 1 . . . . A 701 HIS CE1 . 34329 1 1061 . 1 1 84 84 HIS N N 15 116.231 0.300 . 1 . . . . A 701 HIS N . 34329 1 1062 . 1 1 85 85 LYS H H 1 8.022 0.020 . 1 . . . . A 702 LYS H . 34329 1 1063 . 1 1 85 85 LYS HA H 1 3.549 0.020 . 1 . . . . A 702 LYS HA . 34329 1 1064 . 1 1 85 85 LYS HB2 H 1 1.802 0.020 . 1 . . . . A 702 LYS HB2 . 34329 1 1065 . 1 1 85 85 LYS HB3 H 1 1.848 0.020 . 1 . . . . A 702 LYS HB3 . 34329 1 1066 . 1 1 85 85 LYS HG2 H 1 1.170 0.020 . 2 . . . . A 702 LYS HG2 . 34329 1 1067 . 1 1 85 85 LYS HG3 H 1 1.170 0.020 . 2 . . . . A 702 LYS HG3 . 34329 1 1068 . 1 1 85 85 LYS HD2 H 1 1.450 0.020 . 2 . . . . A 702 LYS HD2 . 34329 1 1069 . 1 1 85 85 LYS HD3 H 1 1.450 0.020 . 2 . . . . A 702 LYS HD3 . 34329 1 1070 . 1 1 85 85 LYS C C 13 177.220 0.300 . 1 . . . . A 702 LYS C . 34329 1 1071 . 1 1 85 85 LYS CA C 13 57.654 0.300 . 1 . . . . A 702 LYS CA . 34329 1 1072 . 1 1 85 85 LYS CB C 13 29.674 0.300 . 1 . . . . A 702 LYS CB . 34329 1 1073 . 1 1 85 85 LYS CG C 13 22.874 0.300 . 1 . . . . A 702 LYS CG . 34329 1 1074 . 1 1 85 85 LYS CD C 13 27.035 0.300 . 1 . . . . A 702 LYS CD . 34329 1 1075 . 1 1 85 85 LYS N N 15 120.159 0.300 . 1 . . . . A 702 LYS N . 34329 1 1076 . 1 1 86 86 GLY H H 1 7.612 0.020 . 1 . . . . A 703 GLY H . 34329 1 1077 . 1 1 86 86 GLY HA2 H 1 1.348 0.020 . 1 . . . . A 703 GLY HA2 . 34329 1 1078 . 1 1 86 86 GLY HA3 H 1 2.944 0.020 . 1 . . . . A 703 GLY HA3 . 34329 1 1079 . 1 1 86 86 GLY C C 13 172.475 0.300 . 1 . . . . A 703 GLY C . 34329 1 1080 . 1 1 86 86 GLY CA C 13 42.424 0.300 . 1 . . . . A 703 GLY CA . 34329 1 1081 . 1 1 86 86 GLY N N 15 109.365 0.300 . 1 . . . . A 703 GLY N . 34329 1 1082 . 1 1 87 87 LEU H H 1 7.247 0.020 . 1 . . . . A 704 LEU H . 34329 1 1083 . 1 1 87 87 LEU HA H 1 3.966 0.020 . 1 . . . . A 704 LEU HA . 34329 1 1084 . 1 1 87 87 LEU HB2 H 1 1.524 0.020 . 1 . . . . A 704 LEU HB2 . 34329 1 1085 . 1 1 87 87 LEU HB3 H 1 1.649 0.020 . 1 . . . . A 704 LEU HB3 . 34329 1 1086 . 1 1 87 87 LEU HG H 1 1.508 0.020 . 1 . . . . A 704 LEU HG . 34329 1 1087 . 1 1 87 87 LEU HD11 H 1 0.548 0.020 . 2 . . . . A 704 LEU HD11 . 34329 1 1088 . 1 1 87 87 LEU HD12 H 1 0.548 0.020 . 2 . . . . A 704 LEU HD12 . 34329 1 1089 . 1 1 87 87 LEU HD13 H 1 0.548 0.020 . 2 . . . . A 704 LEU HD13 . 34329 1 1090 . 1 1 87 87 LEU HD21 H 1 0.834 0.020 . 2 . . . . A 704 LEU HD21 . 34329 1 1091 . 1 1 87 87 LEU HD22 H 1 0.834 0.020 . 2 . . . . A 704 LEU HD22 . 34329 1 1092 . 1 1 87 87 LEU HD23 H 1 0.834 0.020 . 2 . . . . A 704 LEU HD23 . 34329 1 1093 . 1 1 87 87 LEU C C 13 172.571 0.300 . 1 . . . . A 704 LEU C . 34329 1 1094 . 1 1 87 87 LEU CA C 13 52.175 0.300 . 1 . . . . A 704 LEU CA . 34329 1 1095 . 1 1 87 87 LEU CB C 13 39.208 0.300 . 1 . . . . A 704 LEU CB . 34329 1 1096 . 1 1 87 87 LEU CG C 13 23.378 0.300 . 1 . . . . A 704 LEU CG . 34329 1 1097 . 1 1 87 87 LEU CD1 C 13 22.117 0.300 . 1 . . . . A 704 LEU CD1 . 34329 1 1098 . 1 1 87 87 LEU CD2 C 13 19.845 0.300 . 1 . . . . A 704 LEU CD2 . 34329 1 1099 . 1 1 87 87 LEU N N 15 119.735 0.300 . 1 . . . . A 704 LEU N . 34329 1 1100 . 1 1 88 88 LYS H H 1 7.417 0.020 . 1 . . . . A 705 LYS H . 34329 1 1101 . 1 1 88 88 LYS HA H 1 2.775 0.020 . 1 . . . . A 705 LYS HA . 34329 1 1102 . 1 1 88 88 LYS HB2 H 1 1.471 0.020 . 1 . . . . A 705 LYS HB2 . 34329 1 1103 . 1 1 88 88 LYS HB3 H 1 1.904 0.020 . 1 . . . . A 705 LYS HB3 . 34329 1 1104 . 1 1 88 88 LYS HG2 H 1 1.059 0.020 . 1 . . . . A 705 LYS HG2 . 34329 1 1105 . 1 1 88 88 LYS HG3 H 1 1.142 0.020 . 1 . . . . A 705 LYS HG3 . 34329 1 1106 . 1 1 88 88 LYS HD2 H 1 1.573 0.020 . 2 . . . . A 705 LYS HD2 . 34329 1 1107 . 1 1 88 88 LYS HD3 H 1 1.573 0.020 . 2 . . . . A 705 LYS HD3 . 34329 1 1108 . 1 1 88 88 LYS HE2 H 1 2.902 0.020 . 2 . . . . A 705 LYS HE2 . 34329 1 1109 . 1 1 88 88 LYS HE3 H 1 2.902 0.020 . 2 . . . . A 705 LYS HE3 . 34329 1 1110 . 1 1 88 88 LYS C C 13 172.241 0.300 . 1 . . . . A 705 LYS C . 34329 1 1111 . 1 1 88 88 LYS CA C 13 54.484 0.300 . 1 . . . . A 705 LYS CA . 34329 1 1112 . 1 1 88 88 LYS CB C 13 25.719 0.300 . 1 . . . . A 705 LYS CB . 34329 1 1113 . 1 1 88 88 LYS CG C 13 22.357 0.300 . 1 . . . . A 705 LYS CG . 34329 1 1114 . 1 1 88 88 LYS CD C 13 26.626 0.300 . 1 . . . . A 705 LYS CD . 34329 1 1115 . 1 1 88 88 LYS CE C 13 39.696 0.300 . 1 . . . . A 705 LYS CE . 34329 1 1116 . 1 1 88 88 LYS N N 15 112.917 0.300 . 1 . . . . A 705 LYS N . 34329 1 1117 . 1 1 89 89 ASN H H 1 8.172 0.020 . 1 . . . . A 706 ASN H . 34329 1 1118 . 1 1 89 89 ASN HA H 1 4.701 0.020 . 1 . . . . A 706 ASN HA . 34329 1 1119 . 1 1 89 89 ASN HB2 H 1 2.547 0.020 . 1 . . . . A 706 ASN HB2 . 34329 1 1120 . 1 1 89 89 ASN HB3 H 1 2.682 0.020 . 1 . . . . A 706 ASN HB3 . 34329 1 1121 . 1 1 89 89 ASN HD21 H 1 8.307 0.020 . 1 . . . . A 706 ASN HD21 . 34329 1 1122 . 1 1 89 89 ASN HD22 H 1 6.812 0.020 . 1 . . . . A 706 ASN HD22 . 34329 1 1123 . 1 1 89 89 ASN C C 13 173.350 0.300 . 1 . . . . A 706 ASN C . 34329 1 1124 . 1 1 89 89 ASN CA C 13 47.313 0.300 . 1 . . . . A 706 ASN CA . 34329 1 1125 . 1 1 89 89 ASN CB C 13 33.707 0.300 . 1 . . . . A 706 ASN CB . 34329 1 1126 . 1 1 89 89 ASN N N 15 119.282 0.300 . 1 . . . . A 706 ASN N . 34329 1 1127 . 1 1 89 89 ASN ND2 N 15 114.005 0.300 . 1 . . . . A 706 ASN ND2 . 34329 1 1128 . 1 1 90 90 TYR H H 1 6.974 0.020 . 1 . . . . A 707 TYR H . 34329 1 1129 . 1 1 90 90 TYR HA H 1 3.950 0.020 . 1 . . . . A 707 TYR HA . 34329 1 1130 . 1 1 90 90 TYR HB2 H 1 2.663 0.020 . 1 . . . . A 707 TYR HB2 . 34329 1 1131 . 1 1 90 90 TYR HB3 H 1 2.943 0.020 . 1 . . . . A 707 TYR HB3 . 34329 1 1132 . 1 1 90 90 TYR HD1 H 1 6.823 0.020 . 3 . . . . A 707 TYR HD1 . 34329 1 1133 . 1 1 90 90 TYR HD2 H 1 6.823 0.020 . 3 . . . . A 707 TYR HD2 . 34329 1 1134 . 1 1 90 90 TYR HE1 H 1 6.767 0.020 . 3 . . . . A 707 TYR HE1 . 34329 1 1135 . 1 1 90 90 TYR HE2 H 1 6.767 0.020 . 3 . . . . A 707 TYR HE2 . 34329 1 1136 . 1 1 90 90 TYR C C 13 174.384 0.300 . 1 . . . . A 707 TYR C . 34329 1 1137 . 1 1 90 90 TYR CA C 13 57.218 0.300 . 1 . . . . A 707 TYR CA . 34329 1 1138 . 1 1 90 90 TYR CB C 13 34.213 0.300 . 1 . . . . A 707 TYR CB . 34329 1 1139 . 1 1 90 90 TYR CD1 C 13 128.347 0.300 . 1 . . . . A 707 TYR CD1 . 34329 1 1140 . 1 1 90 90 TYR CE1 C 13 116.357 0.300 . 1 . . . . A 707 TYR CE1 . 34329 1 1141 . 1 1 90 90 TYR N N 15 119.917 0.300 . 1 . . . . A 707 TYR N . 34329 1 1142 . 1 1 91 91 GLN H H 1 8.739 0.020 . 1 . . . . A 708 GLN H . 34329 1 1143 . 1 1 91 91 GLN HA H 1 3.856 0.020 . 1 . . . . A 708 GLN HA . 34329 1 1144 . 1 1 91 91 GLN HB2 H 1 1.920 0.020 . 1 . . . . A 708 GLN HB2 . 34329 1 1145 . 1 1 91 91 GLN HB3 H 1 1.952 0.020 . 1 . . . . A 708 GLN HB3 . 34329 1 1146 . 1 1 91 91 GLN HG2 H 1 2.259 0.020 . 2 . . . . A 708 GLN HG2 . 34329 1 1147 . 1 1 91 91 GLN HG3 H 1 2.259 0.020 . 2 . . . . A 708 GLN HG3 . 34329 1 1148 . 1 1 91 91 GLN HE21 H 1 7.260 0.020 . 1 . . . . A 708 GLN HE21 . 34329 1 1149 . 1 1 91 91 GLN HE22 H 1 6.788 0.020 . 1 . . . . A 708 GLN HE22 . 34329 1 1150 . 1 1 91 91 GLN C C 13 176.079 0.300 . 1 . . . . A 708 GLN C . 34329 1 1151 . 1 1 91 91 GLN CA C 13 56.745 0.300 . 1 . . . . A 708 GLN CA . 34329 1 1152 . 1 1 91 91 GLN CB C 13 24.833 0.300 . 1 . . . . A 708 GLN CB . 34329 1 1153 . 1 1 91 91 GLN CG C 13 30.943 0.300 . 1 . . . . A 708 GLN CG . 34329 1 1154 . 1 1 91 91 GLN N N 15 118.208 0.300 . 1 . . . . A 708 GLN N . 34329 1 1155 . 1 1 91 91 GLN NE2 N 15 111.749 0.300 . 1 . . . . A 708 GLN NE2 . 34329 1 1156 . 1 1 92 92 LYS H H 1 7.121 0.020 . 1 . . . . A 709 LYS H . 34329 1 1157 . 1 1 92 92 LYS HA H 1 3.618 0.020 . 1 . . . . A 709 LYS HA . 34329 1 1158 . 1 1 92 92 LYS HB2 H 1 0.281 0.020 . 1 . . . . A 709 LYS HB2 . 34329 1 1159 . 1 1 92 92 LYS HB3 H 1 0.596 0.020 . 1 . . . . A 709 LYS HB3 . 34329 1 1160 . 1 1 92 92 LYS HG2 H 1 0.931 0.020 . 1 . . . . A 709 LYS HG2 . 34329 1 1161 . 1 1 92 92 LYS HG3 H 1 1.121 0.020 . 1 . . . . A 709 LYS HG3 . 34329 1 1162 . 1 1 92 92 LYS HD2 H 1 1.123 0.020 . 1 . . . . A 709 LYS HD2 . 34329 1 1163 . 1 1 92 92 LYS HD3 H 1 1.218 0.020 . 1 . . . . A 709 LYS HD3 . 34329 1 1164 . 1 1 92 92 LYS HE2 H 1 2.722 0.020 . 2 . . . . A 709 LYS HE2 . 34329 1 1165 . 1 1 92 92 LYS HE3 H 1 2.722 0.020 . 2 . . . . A 709 LYS HE3 . 34329 1 1166 . 1 1 92 92 LYS C C 13 176.367 0.300 . 1 . . . . A 709 LYS C . 34329 1 1167 . 1 1 92 92 LYS CA C 13 56.222 0.300 . 1 . . . . A 709 LYS CA . 34329 1 1168 . 1 1 92 92 LYS CB C 13 27.227 0.300 . 1 . . . . A 709 LYS CB . 34329 1 1169 . 1 1 92 92 LYS CG C 13 22.959 0.300 . 1 . . . . A 709 LYS CG . 34329 1 1170 . 1 1 92 92 LYS CD C 13 26.290 0.300 . 1 . . . . A 709 LYS CD . 34329 1 1171 . 1 1 92 92 LYS CE C 13 39.145 0.300 . 1 . . . . A 709 LYS CE . 34329 1 1172 . 1 1 92 92 LYS N N 15 116.907 0.300 . 1 . . . . A 709 LYS N . 34329 1 1173 . 1 1 93 93 SER H H 1 7.658 0.020 . 1 . . . . A 710 SER H . 34329 1 1174 . 1 1 93 93 SER HA H 1 3.972 0.020 . 1 . . . . A 710 SER HA . 34329 1 1175 . 1 1 93 93 SER HB2 H 1 3.811 0.020 . 1 . . . . A 710 SER HB2 . 34329 1 1176 . 1 1 93 93 SER HB3 H 1 4.067 0.020 . 1 . . . . A 710 SER HB3 . 34329 1 1177 . 1 1 93 93 SER HG H 1 4.049 0.020 . 1 . . . . A 710 SER HG . 34329 1 1178 . 1 1 93 93 SER C C 13 173.349 0.300 . 1 . . . . A 710 SER C . 34329 1 1179 . 1 1 93 93 SER CA C 13 60.301 0.300 . 1 . . . . A 710 SER CA . 34329 1 1180 . 1 1 93 93 SER CB C 13 60.750 0.300 . 1 . . . . A 710 SER CB . 34329 1 1181 . 1 1 93 93 SER N N 15 113.693 0.300 . 1 . . . . A 710 SER N . 34329 1 1182 . 1 1 94 94 LEU H H 1 7.956 0.020 . 1 . . . . A 711 LEU H . 34329 1 1183 . 1 1 94 94 LEU HA H 1 3.757 0.020 . 1 . . . . A 711 LEU HA . 34329 1 1184 . 1 1 94 94 LEU HB2 H 1 1.461 0.020 . 1 . . . . A 711 LEU HB2 . 34329 1 1185 . 1 1 94 94 LEU HB3 H 1 1.708 0.020 . 1 . . . . A 711 LEU HB3 . 34329 1 1186 . 1 1 94 94 LEU HG H 1 1.640 0.020 . 1 . . . . A 711 LEU HG . 34329 1 1187 . 1 1 94 94 LEU HD11 H 1 0.681 0.020 . 2 . . . . A 711 LEU HD11 . 34329 1 1188 . 1 1 94 94 LEU HD12 H 1 0.681 0.020 . 2 . . . . A 711 LEU HD12 . 34329 1 1189 . 1 1 94 94 LEU HD13 H 1 0.681 0.020 . 2 . . . . A 711 LEU HD13 . 34329 1 1190 . 1 1 94 94 LEU HD21 H 1 0.699 0.020 . 2 . . . . A 711 LEU HD21 . 34329 1 1191 . 1 1 94 94 LEU HD22 H 1 0.699 0.020 . 2 . . . . A 711 LEU HD22 . 34329 1 1192 . 1 1 94 94 LEU HD23 H 1 0.699 0.020 . 2 . . . . A 711 LEU HD23 . 34329 1 1193 . 1 1 94 94 LEU C C 13 176.079 0.300 . 1 . . . . A 711 LEU C . 34329 1 1194 . 1 1 94 94 LEU CA C 13 55.643 0.300 . 1 . . . . A 711 LEU CA . 34329 1 1195 . 1 1 94 94 LEU CB C 13 39.149 0.300 . 1 . . . . A 711 LEU CB . 34329 1 1196 . 1 1 94 94 LEU CG C 13 23.761 0.300 . 1 . . . . A 711 LEU CG . 34329 1 1197 . 1 1 94 94 LEU CD1 C 13 23.243 0.300 . 1 . . . . A 711 LEU CD1 . 34329 1 1198 . 1 1 94 94 LEU CD2 C 13 22.021 0.300 . 1 . . . . A 711 LEU CD2 . 34329 1 1199 . 1 1 94 94 LEU N N 15 117.414 0.300 . 1 . . . . A 711 LEU N . 34329 1 1200 . 1 1 95 95 ILE H H 1 7.294 0.020 . 1 . . . . A 712 ILE H . 34329 1 1201 . 1 1 95 95 ILE HA H 1 3.548 0.020 . 1 . . . . A 712 ILE HA . 34329 1 1202 . 1 1 95 95 ILE HB H 1 1.721 0.020 . 1 . . . . A 712 ILE HB . 34329 1 1203 . 1 1 95 95 ILE HG12 H 1 0.991 0.020 . 1 . . . . A 712 ILE HG12 . 34329 1 1204 . 1 1 95 95 ILE HG13 H 1 1.604 0.020 . 1 . . . . A 712 ILE HG13 . 34329 1 1205 . 1 1 95 95 ILE HG21 H 1 0.783 0.020 . 1 . . . . A 712 ILE HG21 . 34329 1 1206 . 1 1 95 95 ILE HG22 H 1 0.783 0.020 . 1 . . . . A 712 ILE HG22 . 34329 1 1207 . 1 1 95 95 ILE HG23 H 1 0.783 0.020 . 1 . . . . A 712 ILE HG23 . 34329 1 1208 . 1 1 95 95 ILE HD11 H 1 0.653 0.020 . 1 . . . . A 712 ILE HD11 . 34329 1 1209 . 1 1 95 95 ILE HD12 H 1 0.653 0.020 . 1 . . . . A 712 ILE HD12 . 34329 1 1210 . 1 1 95 95 ILE HD13 H 1 0.653 0.020 . 1 . . . . A 712 ILE HD13 . 34329 1 1211 . 1 1 95 95 ILE C C 13 176.453 0.300 . 1 . . . . A 712 ILE C . 34329 1 1212 . 1 1 95 95 ILE CA C 13 62.297 0.300 . 1 . . . . A 712 ILE CA . 34329 1 1213 . 1 1 95 95 ILE CB C 13 35.192 0.300 . 1 . . . . A 712 ILE CB . 34329 1 1214 . 1 1 95 95 ILE CG1 C 13 26.086 0.300 . 1 . . . . A 712 ILE CG1 . 34329 1 1215 . 1 1 95 95 ILE CG2 C 13 14.298 0.300 . 1 . . . . A 712 ILE CG2 . 34329 1 1216 . 1 1 95 95 ILE CD1 C 13 10.302 0.300 . 1 . . . . A 712 ILE CD1 . 34329 1 1217 . 1 1 95 95 ILE N N 15 119.045 0.300 . 1 . . . . A 712 ILE N . 34329 1 1218 . 1 1 96 96 ASP H H 1 7.185 0.020 . 1 . . . . A 713 ASP H . 34329 1 1219 . 1 1 96 96 ASP HA H 1 4.471 0.020 . 1 . . . . A 713 ASP HA . 34329 1 1220 . 1 1 96 96 ASP HB2 H 1 2.596 0.020 . 1 . . . . A 713 ASP HB2 . 34329 1 1221 . 1 1 96 96 ASP HB3 H 1 3.146 0.020 . 1 . . . . A 713 ASP HB3 . 34329 1 1222 . 1 1 96 96 ASP C C 13 176.026 0.300 . 1 . . . . A 713 ASP C . 34329 1 1223 . 1 1 96 96 ASP CA C 13 55.211 0.300 . 1 . . . . A 713 ASP CA . 34329 1 1224 . 1 1 96 96 ASP CB C 13 38.267 0.300 . 1 . . . . A 713 ASP CB . 34329 1 1225 . 1 1 96 96 ASP N N 15 121.645 0.300 . 1 . . . . A 713 ASP N . 34329 1 1226 . 1 1 97 97 LEU H H 1 8.655 0.020 . 1 . . . . A 714 LEU H . 34329 1 1227 . 1 1 97 97 LEU HA H 1 3.854 0.020 . 1 . . . . A 714 LEU HA . 34329 1 1228 . 1 1 97 97 LEU HB2 H 1 1.163 0.020 . 1 . . . . A 714 LEU HB2 . 34329 1 1229 . 1 1 97 97 LEU HB3 H 1 1.856 0.020 . 1 . . . . A 714 LEU HB3 . 34329 1 1230 . 1 1 97 97 LEU HG H 1 1.850 0.020 . 1 . . . . A 714 LEU HG . 34329 1 1231 . 1 1 97 97 LEU HD11 H 1 0.610 0.020 . 2 . . . . A 714 LEU HD11 . 34329 1 1232 . 1 1 97 97 LEU HD12 H 1 0.610 0.020 . 2 . . . . A 714 LEU HD12 . 34329 1 1233 . 1 1 97 97 LEU HD13 H 1 0.610 0.020 . 2 . . . . A 714 LEU HD13 . 34329 1 1234 . 1 1 97 97 LEU HD21 H 1 0.832 0.020 . 2 . . . . A 714 LEU HD21 . 34329 1 1235 . 1 1 97 97 LEU HD22 H 1 0.832 0.020 . 2 . . . . A 714 LEU HD22 . 34329 1 1236 . 1 1 97 97 LEU HD23 H 1 0.832 0.020 . 2 . . . . A 714 LEU HD23 . 34329 1 1237 . 1 1 97 97 LEU C C 13 175.930 0.300 . 1 . . . . A 714 LEU C . 34329 1 1238 . 1 1 97 97 LEU CA C 13 55.451 0.300 . 1 . . . . A 714 LEU CA . 34329 1 1239 . 1 1 97 97 LEU CB C 13 39.501 0.300 . 1 . . . . A 714 LEU CB . 34329 1 1240 . 1 1 97 97 LEU CG C 13 23.769 0.300 . 1 . . . . A 714 LEU CG . 34329 1 1241 . 1 1 97 97 LEU CD1 C 13 22.443 0.300 . 1 . . . . A 714 LEU CD1 . 34329 1 1242 . 1 1 97 97 LEU CD2 C 13 19.439 0.300 . 1 . . . . A 714 LEU CD2 . 34329 1 1243 . 1 1 97 97 LEU N N 15 120.706 0.300 . 1 . . . . A 714 LEU N . 34329 1 1244 . 1 1 98 98 ASN H H 1 8.367 0.020 . 1 . . . . A 715 ASN H . 34329 1 1245 . 1 1 98 98 ASN HA H 1 4.184 0.020 . 1 . . . . A 715 ASN HA . 34329 1 1246 . 1 1 98 98 ASN HB2 H 1 2.377 0.020 . 1 . . . . A 715 ASN HB2 . 34329 1 1247 . 1 1 98 98 ASN HB3 H 1 2.693 0.020 . 1 . . . . A 715 ASN HB3 . 34329 1 1248 . 1 1 98 98 ASN HD21 H 1 7.003 0.020 . 1 . . . . A 715 ASN HD21 . 34329 1 1249 . 1 1 98 98 ASN HD22 H 1 6.785 0.020 . 1 . . . . A 715 ASN HD22 . 34329 1 1250 . 1 1 98 98 ASN C C 13 175.258 0.300 . 1 . . . . A 715 ASN C . 34329 1 1251 . 1 1 98 98 ASN CA C 13 53.584 0.300 . 1 . . . . A 715 ASN CA . 34329 1 1252 . 1 1 98 98 ASN CB C 13 35.565 0.300 . 1 . . . . A 715 ASN CB . 34329 1 1253 . 1 1 98 98 ASN N N 15 116.196 0.300 . 1 . . . . A 715 ASN N . 34329 1 1254 . 1 1 98 98 ASN ND2 N 15 112.256 0.300 . 1 . . . . A 715 ASN ND2 . 34329 1 1255 . 1 1 99 99 LYS H H 1 7.261 0.020 . 1 . . . . A 716 LYS H . 34329 1 1256 . 1 1 99 99 LYS HA H 1 3.787 0.020 . 1 . . . . A 716 LYS HA . 34329 1 1257 . 1 1 99 99 LYS HB2 H 1 1.231 0.020 . 1 . . . . A 716 LYS HB2 . 34329 1 1258 . 1 1 99 99 LYS HB3 H 1 1.437 0.020 . 1 . . . . A 716 LYS HB3 . 34329 1 1259 . 1 1 99 99 LYS HG2 H 1 0.354 0.020 . 1 . . . . A 716 LYS HG2 . 34329 1 1260 . 1 1 99 99 LYS HG3 H 1 0.667 0.020 . 1 . . . . A 716 LYS HG3 . 34329 1 1261 . 1 1 99 99 LYS HD2 H 1 1.075 0.020 . 1 . . . . A 716 LYS HD2 . 34329 1 1262 . 1 1 99 99 LYS HD3 H 1 1.154 0.020 . 1 . . . . A 716 LYS HD3 . 34329 1 1263 . 1 1 99 99 LYS HE2 H 1 2.547 0.020 . 2 . . . . A 716 LYS HE2 . 34329 1 1264 . 1 1 99 99 LYS HE3 H 1 2.547 0.020 . 2 . . . . A 716 LYS HE3 . 34329 1 1265 . 1 1 99 99 LYS C C 13 174.981 0.300 . 1 . . . . A 716 LYS C . 34329 1 1266 . 1 1 99 99 LYS CA C 13 55.575 0.300 . 1 . . . . A 716 LYS CA . 34329 1 1267 . 1 1 99 99 LYS CB C 13 28.103 0.300 . 1 . . . . A 716 LYS CB . 34329 1 1268 . 1 1 99 99 LYS CG C 13 20.463 0.300 . 1 . . . . A 716 LYS CG . 34329 1 1269 . 1 1 99 99 LYS CD C 13 25.218 0.300 . 1 . . . . A 716 LYS CD . 34329 1 1270 . 1 1 99 99 LYS CE C 13 39.178 0.300 . 1 . . . . A 716 LYS CE . 34329 1 1271 . 1 1 99 99 LYS N N 15 120.578 0.300 . 1 . . . . A 716 LYS N . 34329 1 1272 . 1 1 100 100 VAL H H 1 7.692 0.020 . 1 . . . . A 717 VAL H . 34329 1 1273 . 1 1 100 100 VAL HA H 1 3.206 0.020 . 1 . . . . A 717 VAL HA . 34329 1 1274 . 1 1 100 100 VAL HB H 1 2.314 0.020 . 1 . . . . A 717 VAL HB . 34329 1 1275 . 1 1 100 100 VAL HG11 H 1 0.761 0.020 . 2 . . . . A 717 VAL HG11 . 34329 1 1276 . 1 1 100 100 VAL HG12 H 1 0.761 0.020 . 2 . . . . A 717 VAL HG12 . 34329 1 1277 . 1 1 100 100 VAL HG13 H 1 0.761 0.020 . 2 . . . . A 717 VAL HG13 . 34329 1 1278 . 1 1 100 100 VAL HG21 H 1 1.190 0.020 . 2 . . . . A 717 VAL HG21 . 34329 1 1279 . 1 1 100 100 VAL HG22 H 1 1.190 0.020 . 2 . . . . A 717 VAL HG22 . 34329 1 1280 . 1 1 100 100 VAL HG23 H 1 1.190 0.020 . 2 . . . . A 717 VAL HG23 . 34329 1 1281 . 1 1 100 100 VAL C C 13 173.264 0.300 . 1 . . . . A 717 VAL C . 34329 1 1282 . 1 1 100 100 VAL CA C 13 64.535 0.300 . 1 . . . . A 717 VAL CA . 34329 1 1283 . 1 1 100 100 VAL CB C 13 28.466 0.300 . 1 . . . . A 717 VAL CB . 34329 1 1284 . 1 1 100 100 VAL CG1 C 13 19.181 0.300 . 1 . . . . A 717 VAL CG1 . 34329 1 1285 . 1 1 100 100 VAL CG2 C 13 21.470 0.300 . 1 . . . . A 717 VAL CG2 . 34329 1 1286 . 1 1 100 100 VAL N N 15 119.037 0.300 . 1 . . . . A 717 VAL N . 34329 1 1287 . 1 1 101 101 ILE H H 1 7.594 0.020 . 1 . . . . A 718 ILE H . 34329 1 1288 . 1 1 101 101 ILE HA H 1 3.547 0.020 . 1 . . . . A 718 ILE HA . 34329 1 1289 . 1 1 101 101 ILE HB H 1 1.573 0.020 . 1 . . . . A 718 ILE HB . 34329 1 1290 . 1 1 101 101 ILE HG12 H 1 0.988 0.020 . 1 . . . . A 718 ILE HG12 . 34329 1 1291 . 1 1 101 101 ILE HG13 H 1 1.460 0.020 . 1 . . . . A 718 ILE HG13 . 34329 1 1292 . 1 1 101 101 ILE HG21 H 1 0.728 0.020 . 1 . . . . A 718 ILE HG21 . 34329 1 1293 . 1 1 101 101 ILE HG22 H 1 0.728 0.020 . 1 . . . . A 718 ILE HG22 . 34329 1 1294 . 1 1 101 101 ILE HG23 H 1 0.728 0.020 . 1 . . . . A 718 ILE HG23 . 34329 1 1295 . 1 1 101 101 ILE HD11 H 1 0.616 0.020 . 1 . . . . A 718 ILE HD11 . 34329 1 1296 . 1 1 101 101 ILE HD12 H 1 0.616 0.020 . 1 . . . . A 718 ILE HD12 . 34329 1 1297 . 1 1 101 101 ILE HD13 H 1 0.616 0.020 . 1 . . . . A 718 ILE HD13 . 34329 1 1298 . 1 1 101 101 ILE C C 13 174.832 0.300 . 1 . . . . A 718 ILE C . 34329 1 1299 . 1 1 101 101 ILE CA C 13 60.813 0.300 . 1 . . . . A 718 ILE CA . 34329 1 1300 . 1 1 101 101 ILE CB C 13 35.694 0.300 . 1 . . . . A 718 ILE CB . 34329 1 1301 . 1 1 101 101 ILE CG1 C 13 26.412 0.300 . 1 . . . . A 718 ILE CG1 . 34329 1 1302 . 1 1 101 101 ILE CG2 C 13 14.354 0.300 . 1 . . . . A 718 ILE CG2 . 34329 1 1303 . 1 1 101 101 ILE CD1 C 13 11.366 0.300 . 1 . . . . A 718 ILE CD1 . 34329 1 1304 . 1 1 101 101 ILE N N 15 116.090 0.300 . 1 . . . . A 718 ILE N . 34329 1 1305 . 1 1 102 102 LEU H H 1 7.172 0.020 . 1 . . . . A 719 LEU H . 34329 1 1306 . 1 1 102 102 LEU HA H 1 3.959 0.020 . 1 . . . . A 719 LEU HA . 34329 1 1307 . 1 1 102 102 LEU HB2 H 1 1.546 0.020 . 2 . . . . A 719 LEU HB2 . 34329 1 1308 . 1 1 102 102 LEU HB3 H 1 1.546 0.020 . 2 . . . . A 719 LEU HB3 . 34329 1 1309 . 1 1 102 102 LEU HG H 1 1.440 0.020 . 1 . . . . A 719 LEU HG . 34329 1 1310 . 1 1 102 102 LEU HD11 H 1 0.700 0.020 . 2 . . . . A 719 LEU HD11 . 34329 1 1311 . 1 1 102 102 LEU HD12 H 1 0.700 0.020 . 2 . . . . A 719 LEU HD12 . 34329 1 1312 . 1 1 102 102 LEU HD13 H 1 0.700 0.020 . 2 . . . . A 719 LEU HD13 . 34329 1 1313 . 1 1 102 102 LEU HD21 H 1 0.715 0.020 . 2 . . . . A 719 LEU HD21 . 34329 1 1314 . 1 1 102 102 LEU HD22 H 1 0.715 0.020 . 2 . . . . A 719 LEU HD22 . 34329 1 1315 . 1 1 102 102 LEU HD23 H 1 0.715 0.020 . 2 . . . . A 719 LEU HD23 . 34329 1 1316 . 1 1 102 102 LEU C C 13 176.421 0.300 . 1 . . . . A 719 LEU C . 34329 1 1317 . 1 1 102 102 LEU CA C 13 54.157 0.300 . 1 . . . . A 719 LEU CA . 34329 1 1318 . 1 1 102 102 LEU CB C 13 39.743 0.300 . 1 . . . . A 719 LEU CB . 34329 1 1319 . 1 1 102 102 LEU CG C 13 23.960 0.300 . 1 . . . . A 719 LEU CG . 34329 1 1320 . 1 1 102 102 LEU CD1 C 13 21.628 0.300 . 1 . . . . A 719 LEU CD1 . 34329 1 1321 . 1 1 102 102 LEU CD2 C 13 21.459 0.300 . 1 . . . . A 719 LEU CD2 . 34329 1 1322 . 1 1 102 102 LEU N N 15 118.610 0.300 . 1 . . . . A 719 LEU N . 34329 1 1323 . 1 1 103 103 LEU H H 1 7.841 0.020 . 1 . . . . A 720 LEU H . 34329 1 1324 . 1 1 103 103 LEU HA H 1 3.980 0.020 . 1 . . . . A 720 LEU HA . 34329 1 1325 . 1 1 103 103 LEU HB2 H 1 1.253 0.020 . 1 . . . . A 720 LEU HB2 . 34329 1 1326 . 1 1 103 103 LEU HB3 H 1 1.774 0.020 . 1 . . . . A 720 LEU HB3 . 34329 1 1327 . 1 1 103 103 LEU HG H 1 1.653 0.020 . 1 . . . . A 720 LEU HG . 34329 1 1328 . 1 1 103 103 LEU HD11 H 1 0.704 0.020 . 2 . . . . A 720 LEU HD11 . 34329 1 1329 . 1 1 103 103 LEU HD12 H 1 0.704 0.020 . 2 . . . . A 720 LEU HD12 . 34329 1 1330 . 1 1 103 103 LEU HD13 H 1 0.704 0.020 . 2 . . . . A 720 LEU HD13 . 34329 1 1331 . 1 1 103 103 LEU HD21 H 1 0.767 0.020 . 2 . . . . A 720 LEU HD21 . 34329 1 1332 . 1 1 103 103 LEU HD22 H 1 0.767 0.020 . 2 . . . . A 720 LEU HD22 . 34329 1 1333 . 1 1 103 103 LEU HD23 H 1 0.767 0.020 . 2 . . . . A 720 LEU HD23 . 34329 1 1334 . 1 1 103 103 LEU C C 13 176.133 0.300 . 1 . . . . A 720 LEU C . 34329 1 1335 . 1 1 103 103 LEU CA C 13 54.163 0.300 . 1 . . . . A 720 LEU CA . 34329 1 1336 . 1 1 103 103 LEU CB C 13 40.128 0.300 . 1 . . . . A 720 LEU CB . 34329 1 1337 . 1 1 103 103 LEU CG C 13 24.106 0.300 . 1 . . . . A 720 LEU CG . 34329 1 1338 . 1 1 103 103 LEU CD1 C 13 23.333 0.300 . 1 . . . . A 720 LEU CD1 . 34329 1 1339 . 1 1 103 103 LEU CD2 C 13 19.242 0.300 . 1 . . . . A 720 LEU CD2 . 34329 1 1340 . 1 1 103 103 LEU N N 15 118.866 0.300 . 1 . . . . A 720 LEU N . 34329 1 1341 . 1 1 104 104 ASP H H 1 8.791 0.020 . 1 . . . . A 721 ASP H . 34329 1 1342 . 1 1 104 104 ASP HA H 1 4.742 0.020 . 1 . . . . A 721 ASP HA . 34329 1 1343 . 1 1 104 104 ASP HB2 H 1 2.300 0.020 . 1 . . . . A 721 ASP HB2 . 34329 1 1344 . 1 1 104 104 ASP HB3 H 1 2.911 0.020 . 1 . . . . A 721 ASP HB3 . 34329 1 1345 . 1 1 104 104 ASP C C 13 169.895 0.300 . 1 . . . . A 721 ASP C . 34329 1 1346 . 1 1 104 104 ASP CA C 13 48.831 0.300 . 1 . . . . A 721 ASP CA . 34329 1 1347 . 1 1 104 104 ASP CB C 13 37.832 0.300 . 1 . . . . A 721 ASP CB . 34329 1 1348 . 1 1 104 104 ASP N N 15 115.383 0.300 . 1 . . . . A 721 ASP N . 34329 1 1349 . 1 1 105 105 PRO HA H 1 4.463 0.020 . 1 . . . . A 722 PRO HA . 34329 1 1350 . 1 1 105 105 PRO HB2 H 1 1.889 0.020 . 1 . . . . A 722 PRO HB2 . 34329 1 1351 . 1 1 105 105 PRO HB3 H 1 2.346 0.020 . 1 . . . . A 722 PRO HB3 . 34329 1 1352 . 1 1 105 105 PRO HG2 H 1 1.841 0.020 . 1 . . . . A 722 PRO HG2 . 34329 1 1353 . 1 1 105 105 PRO HG3 H 1 1.971 0.020 . 1 . . . . A 722 PRO HG3 . 34329 1 1354 . 1 1 105 105 PRO HD2 H 1 3.376 0.020 . 1 . . . . A 722 PRO HD2 . 34329 1 1355 . 1 1 105 105 PRO HD3 H 1 3.721 0.020 . 1 . . . . A 722 PRO HD3 . 34329 1 1356 . 1 1 105 105 PRO C C 13 174.128 0.300 . 1 . . . . A 722 PRO C . 34329 1 1357 . 1 1 105 105 PRO CA C 13 60.606 0.300 . 1 . . . . A 722 PRO CA . 34329 1 1358 . 1 1 105 105 PRO CB C 13 29.048 0.300 . 1 . . . . A 722 PRO CB . 34329 1 1359 . 1 1 105 105 PRO CG C 13 23.632 0.300 . 1 . . . . A 722 PRO CG . 34329 1 1360 . 1 1 105 105 PRO CD C 13 47.590 0.300 . 1 . . . . A 722 PRO CD . 34329 1 1361 . 1 1 106 106 SER H H 1 8.186 0.020 . 1 . . . . A 723 SER H . 34329 1 1362 . 1 1 106 106 SER HA H 1 4.221 0.020 . 1 . . . . A 723 SER HA . 34329 1 1363 . 1 1 106 106 SER HB2 H 1 3.708 0.020 . 1 . . . . A 723 SER HB2 . 34329 1 1364 . 1 1 106 106 SER HB3 H 1 3.913 0.020 . 1 . . . . A 723 SER HB3 . 34329 1 1365 . 1 1 106 106 SER C C 13 172.358 0.300 . 1 . . . . A 723 SER C . 34329 1 1366 . 1 1 106 106 SER CA C 13 56.870 0.300 . 1 . . . . A 723 SER CA . 34329 1 1367 . 1 1 106 106 SER CB C 13 60.809 0.300 . 1 . . . . A 723 SER CB . 34329 1 1368 . 1 1 106 106 SER N N 15 114.532 0.300 . 1 . . . . A 723 SER N . 34329 1 1369 . 1 1 107 107 ILE H H 1 6.998 0.020 . 1 . . . . A 724 ILE H . 34329 1 1370 . 1 1 107 107 ILE HA H 1 4.030 0.020 . 1 . . . . A 724 ILE HA . 34329 1 1371 . 1 1 107 107 ILE HB H 1 1.655 0.020 . 1 . . . . A 724 ILE HB . 34329 1 1372 . 1 1 107 107 ILE HG12 H 1 0.870 0.020 . 1 . . . . A 724 ILE HG12 . 34329 1 1373 . 1 1 107 107 ILE HG13 H 1 1.278 0.020 . 1 . . . . A 724 ILE HG13 . 34329 1 1374 . 1 1 107 107 ILE HG21 H 1 0.546 0.020 . 1 . . . . A 724 ILE HG21 . 34329 1 1375 . 1 1 107 107 ILE HG22 H 1 0.546 0.020 . 1 . . . . A 724 ILE HG22 . 34329 1 1376 . 1 1 107 107 ILE HG23 H 1 0.546 0.020 . 1 . . . . A 724 ILE HG23 . 34329 1 1377 . 1 1 107 107 ILE HD11 H 1 0.624 0.020 . 1 . . . . A 724 ILE HD11 . 34329 1 1378 . 1 1 107 107 ILE HD12 H 1 0.624 0.020 . 1 . . . . A 724 ILE HD12 . 34329 1 1379 . 1 1 107 107 ILE HD13 H 1 0.624 0.020 . 1 . . . . A 724 ILE HD13 . 34329 1 1380 . 1 1 107 107 ILE C C 13 174.017 0.300 . 1 . . . . A 724 ILE C . 34329 1 1381 . 1 1 107 107 ILE CA C 13 57.417 0.300 . 1 . . . . A 724 ILE CA . 34329 1 1382 . 1 1 107 107 ILE CB C 13 32.412 0.300 . 1 . . . . A 724 ILE CB . 34329 1 1383 . 1 1 107 107 ILE CG1 C 13 24.122 0.300 . 1 . . . . A 724 ILE CG1 . 34329 1 1384 . 1 1 107 107 ILE CG2 C 13 14.940 0.300 . 1 . . . . A 724 ILE CG2 . 34329 1 1385 . 1 1 107 107 ILE CD1 C 13 10.067 0.300 . 1 . . . . A 724 ILE CD1 . 34329 1 1386 . 1 1 107 107 ILE N N 15 122.561 0.300 . 1 . . . . A 724 ILE N . 34329 1 1387 . 1 1 108 108 ILE H H 1 8.089 0.020 . 1 . . . . A 725 ILE H . 34329 1 1388 . 1 1 108 108 ILE HA H 1 3.697 0.020 . 1 . . . . A 725 ILE HA . 34329 1 1389 . 1 1 108 108 ILE HB H 1 1.816 0.020 . 1 . . . . A 725 ILE HB . 34329 1 1390 . 1 1 108 108 ILE HG12 H 1 1.249 0.020 . 1 . . . . A 725 ILE HG12 . 34329 1 1391 . 1 1 108 108 ILE HG13 H 1 1.391 0.020 . 1 . . . . A 725 ILE HG13 . 34329 1 1392 . 1 1 108 108 ILE HG21 H 1 0.855 0.020 . 1 . . . . A 725 ILE HG21 . 34329 1 1393 . 1 1 108 108 ILE HG22 H 1 0.855 0.020 . 1 . . . . A 725 ILE HG22 . 34329 1 1394 . 1 1 108 108 ILE HG23 H 1 0.855 0.020 . 1 . . . . A 725 ILE HG23 . 34329 1 1395 . 1 1 108 108 ILE HD11 H 1 0.758 0.020 . 1 . . . . A 725 ILE HD11 . 34329 1 1396 . 1 1 108 108 ILE HD12 H 1 0.758 0.020 . 1 . . . . A 725 ILE HD12 . 34329 1 1397 . 1 1 108 108 ILE HD13 H 1 0.758 0.020 . 1 . . . . A 725 ILE HD13 . 34329 1 1398 . 1 1 108 108 ILE C C 13 175.685 0.300 . 1 . . . . A 725 ILE C . 34329 1 1399 . 1 1 108 108 ILE CA C 13 60.852 0.300 . 1 . . . . A 725 ILE CA . 34329 1 1400 . 1 1 108 108 ILE CB C 13 34.848 0.300 . 1 . . . . A 725 ILE CB . 34329 1 1401 . 1 1 108 108 ILE CG1 C 13 25.118 0.300 . 1 . . . . A 725 ILE CG1 . 34329 1 1402 . 1 1 108 108 ILE CG2 C 13 14.958 0.300 . 1 . . . . A 725 ILE CG2 . 34329 1 1403 . 1 1 108 108 ILE CD1 C 13 9.712 0.300 . 1 . . . . A 725 ILE CD1 . 34329 1 1404 . 1 1 108 108 ILE N N 15 130.896 0.300 . 1 . . . . A 725 ILE N . 34329 1 1405 . 1 1 109 109 GLU H H 1 9.752 0.020 . 1 . . . . A 726 GLU H . 34329 1 1406 . 1 1 109 109 GLU HA H 1 3.989 0.020 . 1 . . . . A 726 GLU HA . 34329 1 1407 . 1 1 109 109 GLU HB2 H 1 1.785 0.020 . 1 . . . . A 726 GLU HB2 . 34329 1 1408 . 1 1 109 109 GLU HB3 H 1 2.009 0.020 . 1 . . . . A 726 GLU HB3 . 34329 1 1409 . 1 1 109 109 GLU HG2 H 1 2.122 0.020 . 1 . . . . A 726 GLU HG2 . 34329 1 1410 . 1 1 109 109 GLU HG3 H 1 2.187 0.020 . 1 . . . . A 726 GLU HG3 . 34329 1 1411 . 1 1 109 109 GLU C C 13 175.749 0.300 . 1 . . . . A 726 GLU C . 34329 1 1412 . 1 1 109 109 GLU CA C 13 57.094 0.300 . 1 . . . . A 726 GLU CA . 34329 1 1413 . 1 1 109 109 GLU CB C 13 25.719 0.300 . 1 . . . . A 726 GLU CB . 34329 1 1414 . 1 1 109 109 GLU CG C 13 33.909 0.300 . 1 . . . . A 726 GLU CG . 34329 1 1415 . 1 1 109 109 GLU N N 15 121.494 0.300 . 1 . . . . A 726 GLU N . 34329 1 1416 . 1 1 110 110 ALA H H 1 7.095 0.020 . 1 . . . . A 727 ALA H . 34329 1 1417 . 1 1 110 110 ALA HA H 1 4.069 0.020 . 1 . . . . A 727 ALA HA . 34329 1 1418 . 1 1 110 110 ALA HB1 H 1 1.252 0.020 . 1 . . . . A 727 ALA HB1 . 34329 1 1419 . 1 1 110 110 ALA HB2 H 1 1.252 0.020 . 1 . . . . A 727 ALA HB2 . 34329 1 1420 . 1 1 110 110 ALA HB3 H 1 1.252 0.020 . 1 . . . . A 727 ALA HB3 . 34329 1 1421 . 1 1 110 110 ALA C C 13 175.715 0.300 . 1 . . . . A 727 ALA C . 34329 1 1422 . 1 1 110 110 ALA CA C 13 52.125 0.300 . 1 . . . . A 727 ALA CA . 34329 1 1423 . 1 1 110 110 ALA CB C 13 15.615 0.300 . 1 . . . . A 727 ALA CB . 34329 1 1424 . 1 1 110 110 ALA N N 15 118.667 0.300 . 1 . . . . A 727 ALA N . 34329 1 1425 . 1 1 111 111 LYS H H 1 7.047 0.020 . 1 . . . . A 728 LYS H . 34329 1 1426 . 1 1 111 111 LYS HA H 1 3.852 0.020 . 1 . . . . A 728 LYS HA . 34329 1 1427 . 1 1 111 111 LYS HB2 H 1 1.875 0.020 . 2 . . . . A 728 LYS HB2 . 34329 1 1428 . 1 1 111 111 LYS HB3 H 1 1.875 0.020 . 2 . . . . A 728 LYS HB3 . 34329 1 1429 . 1 1 111 111 LYS HG2 H 1 1.291 0.020 . 1 . . . . A 728 LYS HG2 . 34329 1 1430 . 1 1 111 111 LYS HG3 H 1 1.423 0.020 . 1 . . . . A 728 LYS HG3 . 34329 1 1431 . 1 1 111 111 LYS HD2 H 1 1.576 0.020 . 2 . . . . A 728 LYS HD2 . 34329 1 1432 . 1 1 111 111 LYS HD3 H 1 1.576 0.020 . 2 . . . . A 728 LYS HD3 . 34329 1 1433 . 1 1 111 111 LYS HE2 H 1 2.824 0.020 . 2 . . . . A 728 LYS HE2 . 34329 1 1434 . 1 1 111 111 LYS HE3 H 1 2.824 0.020 . 2 . . . . A 728 LYS HE3 . 34329 1 1435 . 1 1 111 111 LYS C C 13 176.478 0.300 . 1 . . . . A 728 LYS C . 34329 1 1436 . 1 1 111 111 LYS CA C 13 56.770 0.300 . 1 . . . . A 728 LYS CA . 34329 1 1437 . 1 1 111 111 LYS CB C 13 29.098 0.300 . 1 . . . . A 728 LYS CB . 34329 1 1438 . 1 1 111 111 LYS CG C 13 22.819 0.300 . 1 . . . . A 728 LYS CG . 34329 1 1439 . 1 1 111 111 LYS CD C 13 26.682 0.300 . 1 . . . . A 728 LYS CD . 34329 1 1440 . 1 1 111 111 LYS CE C 13 39.199 0.300 . 1 . . . . A 728 LYS CE . 34329 1 1441 . 1 1 111 111 LYS N N 15 117.673 0.300 . 1 . . . . A 728 LYS N . 34329 1 1442 . 1 1 112 112 MET H H 1 7.668 0.020 . 1 . . . . A 729 MET H . 34329 1 1443 . 1 1 112 112 MET HA H 1 4.107 0.020 . 1 . . . . A 729 MET HA . 34329 1 1444 . 1 1 112 112 MET HB2 H 1 2.077 0.020 . 1 . . . . A 729 MET HB2 . 34329 1 1445 . 1 1 112 112 MET HB3 H 1 2.456 0.020 . 1 . . . . A 729 MET HB3 . 34329 1 1446 . 1 1 112 112 MET HG2 H 1 2.443 0.020 . 1 . . . . A 729 MET HG2 . 34329 1 1447 . 1 1 112 112 MET HG3 H 1 2.575 0.020 . 1 . . . . A 729 MET HG3 . 34329 1 1448 . 1 1 112 112 MET HE1 H 1 1.955 0.020 . 1 . . . . A 729 MET HE1 . 34329 1 1449 . 1 1 112 112 MET HE2 H 1 1.955 0.020 . 1 . . . . A 729 MET HE2 . 34329 1 1450 . 1 1 112 112 MET HE3 H 1 1.955 0.020 . 1 . . . . A 729 MET HE3 . 34329 1 1451 . 1 1 112 112 MET C C 13 176.958 0.300 . 1 . . . . A 729 MET C . 34329 1 1452 . 1 1 112 112 MET CA C 13 55.551 0.300 . 1 . . . . A 729 MET CA . 34329 1 1453 . 1 1 112 112 MET CB C 13 29.040 0.300 . 1 . . . . A 729 MET CB . 34329 1 1454 . 1 1 112 112 MET CG C 13 28.929 0.300 . 1 . . . . A 729 MET CG . 34329 1 1455 . 1 1 112 112 MET CE C 13 13.977 0.300 . 1 . . . . A 729 MET CE . 34329 1 1456 . 1 1 112 112 MET N N 15 118.858 0.300 . 1 . . . . A 729 MET N . 34329 1 1457 . 1 1 113 113 GLU H H 1 8.120 0.020 . 1 . . . . A 730 GLU H . 34329 1 1458 . 1 1 113 113 GLU HA H 1 4.026 0.020 . 1 . . . . A 730 GLU HA . 34329 1 1459 . 1 1 113 113 GLU HB2 H 1 2.000 0.020 . 2 . . . . A 730 GLU HB2 . 34329 1 1460 . 1 1 113 113 GLU HB3 H 1 2.000 0.020 . 2 . . . . A 730 GLU HB3 . 34329 1 1461 . 1 1 113 113 GLU HG2 H 1 2.226 0.020 . 1 . . . . A 730 GLU HG2 . 34329 1 1462 . 1 1 113 113 GLU HG3 H 1 2.303 0.020 . 1 . . . . A 730 GLU HG3 . 34329 1 1463 . 1 1 113 113 GLU C C 13 175.073 0.300 . 1 . . . . A 730 GLU C . 34329 1 1464 . 1 1 113 113 GLU CA C 13 55.680 0.300 . 1 . . . . A 730 GLU CA . 34329 1 1465 . 1 1 113 113 GLU CB C 13 26.357 0.300 . 1 . . . . A 730 GLU CB . 34329 1 1466 . 1 1 113 113 GLU CG C 13 32.886 0.300 . 1 . . . . A 730 GLU CG . 34329 1 1467 . 1 1 113 113 GLU N N 15 120.846 0.300 . 1 . . . . A 730 GLU N . 34329 1 1468 . 1 1 114 114 LEU H H 1 8.176 0.020 . 1 . . . . A 731 LEU H . 34329 1 1469 . 1 1 114 114 LEU HA H 1 3.695 0.020 . 1 . . . . A 731 LEU HA . 34329 1 1470 . 1 1 114 114 LEU HB2 H 1 1.549 0.020 . 1 . . . . A 731 LEU HB2 . 34329 1 1471 . 1 1 114 114 LEU HB3 H 1 1.800 0.020 . 1 . . . . A 731 LEU HB3 . 34329 1 1472 . 1 1 114 114 LEU HD11 H 1 0.698 0.020 . 2 . . . . A 731 LEU HD11 . 34329 1 1473 . 1 1 114 114 LEU HD12 H 1 0.698 0.020 . 2 . . . . A 731 LEU HD12 . 34329 1 1474 . 1 1 114 114 LEU HD13 H 1 0.698 0.020 . 2 . . . . A 731 LEU HD13 . 34329 1 1475 . 1 1 114 114 LEU HD21 H 1 1.387 0.020 . 2 . . . . A 731 LEU HD21 . 34329 1 1476 . 1 1 114 114 LEU HD22 H 1 1.387 0.020 . 2 . . . . A 731 LEU HD22 . 34329 1 1477 . 1 1 114 114 LEU HD23 H 1 1.387 0.020 . 2 . . . . A 731 LEU HD23 . 34329 1 1478 . 1 1 114 114 LEU C C 13 177.402 0.300 . 1 . . . . A 731 LEU C . 34329 1 1479 . 1 1 114 114 LEU CA C 13 56.127 0.300 . 1 . . . . A 731 LEU CA . 34329 1 1480 . 1 1 114 114 LEU CB C 13 38.991 0.300 . 1 . . . . A 731 LEU CB . 34329 1 1481 . 1 1 114 114 LEU CD1 C 13 22.804 0.300 . 1 . . . . A 731 LEU CD1 . 34329 1 1482 . 1 1 114 114 LEU CD2 C 13 24.059 0.300 . 1 . . . . A 731 LEU CD2 . 34329 1 1483 . 1 1 114 114 LEU N N 15 121.142 0.300 . 1 . . . . A 731 LEU N . 34329 1 1484 . 1 1 115 115 GLU H H 1 7.473 0.020 . 1 . . . . A 732 GLU H . 34329 1 1485 . 1 1 115 115 GLU HA H 1 3.840 0.020 . 1 . . . . A 732 GLU HA . 34329 1 1486 . 1 1 115 115 GLU HB2 H 1 2.005 0.020 . 1 . . . . A 732 GLU HB2 . 34329 1 1487 . 1 1 115 115 GLU HB3 H 1 2.024 0.020 . 1 . . . . A 732 GLU HB3 . 34329 1 1488 . 1 1 115 115 GLU HG2 H 1 2.141 0.020 . 1 . . . . A 732 GLU HG2 . 34329 1 1489 . 1 1 115 115 GLU HG3 H 1 2.322 0.020 . 1 . . . . A 732 GLU HG3 . 34329 1 1490 . 1 1 115 115 GLU C C 13 175.909 0.300 . 1 . . . . A 732 GLU C . 34329 1 1491 . 1 1 115 115 GLU CA C 13 56.743 0.300 . 1 . . . . A 732 GLU CA . 34329 1 1492 . 1 1 115 115 GLU CB C 13 26.373 0.300 . 1 . . . . A 732 GLU CB . 34329 1 1493 . 1 1 115 115 GLU CG C 13 33.220 0.300 . 1 . . . . A 732 GLU CG . 34329 1 1494 . 1 1 115 115 GLU N N 15 120.498 0.300 . 1 . . . . A 732 GLU N . 34329 1 1495 . 1 1 116 116 GLU H H 1 7.585 0.020 . 1 . . . . A 733 GLU H . 34329 1 1496 . 1 1 116 116 GLU HA H 1 4.109 0.020 . 1 . . . . A 733 GLU HA . 34329 1 1497 . 1 1 116 116 GLU HB2 H 1 1.886 0.020 . 1 . . . . A 733 GLU HB2 . 34329 1 1498 . 1 1 116 116 GLU HB3 H 1 1.981 0.020 . 1 . . . . A 733 GLU HB3 . 34329 1 1499 . 1 1 116 116 GLU HG2 H 1 2.020 0.020 . 1 . . . . A 733 GLU HG2 . 34329 1 1500 . 1 1 116 116 GLU HG3 H 1 2.141 0.020 . 1 . . . . A 733 GLU HG3 . 34329 1 1501 . 1 1 116 116 GLU C C 13 175.518 0.300 . 1 . . . . A 733 GLU C . 34329 1 1502 . 1 1 116 116 GLU CA C 13 56.048 0.300 . 1 . . . . A 733 GLU CA . 34329 1 1503 . 1 1 116 116 GLU CB C 13 26.345 0.300 . 1 . . . . A 733 GLU CB . 34329 1 1504 . 1 1 116 116 GLU CG C 13 32.123 0.300 . 1 . . . . A 733 GLU CG . 34329 1 1505 . 1 1 116 116 GLU N N 15 121.315 0.300 . 1 . . . . A 733 GLU N . 34329 1 1506 . 1 1 117 117 VAL H H 1 9.139 0.020 . 1 . . . . A 734 VAL H . 34329 1 1507 . 1 1 117 117 VAL HA H 1 3.212 0.020 . 1 . . . . A 734 VAL HA . 34329 1 1508 . 1 1 117 117 VAL HB H 1 1.856 0.020 . 1 . . . . A 734 VAL HB . 34329 1 1509 . 1 1 117 117 VAL HG11 H 1 0.867 0.020 . 2 . . . . A 734 VAL HG11 . 34329 1 1510 . 1 1 117 117 VAL HG12 H 1 0.867 0.020 . 2 . . . . A 734 VAL HG12 . 34329 1 1511 . 1 1 117 117 VAL HG13 H 1 0.867 0.020 . 2 . . . . A 734 VAL HG13 . 34329 1 1512 . 1 1 117 117 VAL HG21 H 1 0.950 0.020 . 2 . . . . A 734 VAL HG21 . 34329 1 1513 . 1 1 117 117 VAL HG22 H 1 0.950 0.020 . 2 . . . . A 734 VAL HG22 . 34329 1 1514 . 1 1 117 117 VAL HG23 H 1 0.950 0.020 . 2 . . . . A 734 VAL HG23 . 34329 1 1515 . 1 1 117 117 VAL C C 13 174.486 0.300 . 1 . . . . A 734 VAL C . 34329 1 1516 . 1 1 117 117 VAL CA C 13 64.211 0.300 . 1 . . . . A 734 VAL CA . 34329 1 1517 . 1 1 117 117 VAL CB C 13 28.634 0.300 . 1 . . . . A 734 VAL CB . 34329 1 1518 . 1 1 117 117 VAL CG1 C 13 20.505 0.300 . 1 . . . . A 734 VAL CG1 . 34329 1 1519 . 1 1 117 117 VAL CG2 C 13 20.785 0.300 . 1 . . . . A 734 VAL CG2 . 34329 1 1520 . 1 1 117 117 VAL N N 15 119.259 0.300 . 1 . . . . A 734 VAL N . 34329 1 1521 . 1 1 118 118 THR H H 1 7.882 0.020 . 1 . . . . A 735 THR H . 34329 1 1522 . 1 1 118 118 THR HA H 1 3.535 0.020 . 1 . . . . A 735 THR HA . 34329 1 1523 . 1 1 118 118 THR HB H 1 4.107 0.020 . 1 . . . . A 735 THR HB . 34329 1 1524 . 1 1 118 118 THR HG1 H 1 4.979 0.020 . 1 . . . . A 735 THR HG1 . 34329 1 1525 . 1 1 118 118 THR HG21 H 1 1.019 0.020 . 1 . . . . A 735 THR HG21 . 34329 1 1526 . 1 1 118 118 THR HG22 H 1 1.019 0.020 . 1 . . . . A 735 THR HG22 . 34329 1 1527 . 1 1 118 118 THR HG23 H 1 1.019 0.020 . 1 . . . . A 735 THR HG23 . 34329 1 1528 . 1 1 118 118 THR C C 13 172.904 0.300 . 1 . . . . A 735 THR C . 34329 1 1529 . 1 1 118 118 THR CA C 13 65.248 0.300 . 1 . . . . A 735 THR CA . 34329 1 1530 . 1 1 118 118 THR CB C 13 65.540 0.300 . 1 . . . . A 735 THR CB . 34329 1 1531 . 1 1 118 118 THR CG2 C 13 17.902 0.300 . 1 . . . . A 735 THR CG2 . 34329 1 1532 . 1 1 118 118 THR N N 15 116.243 0.300 . 1 . . . . A 735 THR N . 34329 1 1533 . 1 1 119 119 ARG H H 1 7.395 0.020 . 1 . . . . A 736 ARG H . 34329 1 1534 . 1 1 119 119 ARG HA H 1 3.828 0.020 . 1 . . . . A 736 ARG HA . 34329 1 1535 . 1 1 119 119 ARG HB2 H 1 1.743 0.020 . 1 . . . . A 736 ARG HB2 . 34329 1 1536 . 1 1 119 119 ARG HB3 H 1 1.914 0.020 . 1 . . . . A 736 ARG HB3 . 34329 1 1537 . 1 1 119 119 ARG HG2 H 1 1.255 0.020 . 1 . . . . A 736 ARG HG2 . 34329 1 1538 . 1 1 119 119 ARG HG3 H 1 1.545 0.020 . 1 . . . . A 736 ARG HG3 . 34329 1 1539 . 1 1 119 119 ARG HD2 H 1 2.970 0.020 . 1 . . . . A 736 ARG HD2 . 34329 1 1540 . 1 1 119 119 ARG HD3 H 1 3.141 0.020 . 1 . . . . A 736 ARG HD3 . 34329 1 1541 . 1 1 119 119 ARG HE H 1 7.575 0.020 . 1 . . . . A 736 ARG HE . 34329 1 1542 . 1 1 119 119 ARG C C 13 176.513 0.300 . 1 . . . . A 736 ARG C . 34329 1 1543 . 1 1 119 119 ARG CA C 13 56.795 0.300 . 1 . . . . A 736 ARG CA . 34329 1 1544 . 1 1 119 119 ARG CB C 13 27.085 0.300 . 1 . . . . A 736 ARG CB . 34329 1 1545 . 1 1 119 119 ARG CG C 13 25.005 0.300 . 1 . . . . A 736 ARG CG . 34329 1 1546 . 1 1 119 119 ARG CD C 13 40.274 0.300 . 1 . . . . A 736 ARG CD . 34329 1 1547 . 1 1 119 119 ARG N N 15 121.966 0.300 . 1 . . . . A 736 ARG N . 34329 1 1548 . 1 1 119 119 ARG NE N 15 79.163 0.300 . 1 . . . . A 736 ARG NE . 34329 1 1549 . 1 1 120 120 LEU H H 1 7.725 0.020 . 1 . . . . A 737 LEU H . 34329 1 1550 . 1 1 120 120 LEU HA H 1 3.639 0.020 . 1 . . . . A 737 LEU HA . 34329 1 1551 . 1 1 120 120 LEU HB2 H 1 0.364 0.020 . 1 . . . . A 737 LEU HB2 . 34329 1 1552 . 1 1 120 120 LEU HB3 H 1 1.016 0.020 . 1 . . . . A 737 LEU HB3 . 34329 1 1553 . 1 1 120 120 LEU HG H 1 1.482 0.020 . 1 . . . . A 737 LEU HG . 34329 1 1554 . 1 1 120 120 LEU HD11 H 1 0.507 0.020 . 2 . . . . A 737 LEU HD11 . 34329 1 1555 . 1 1 120 120 LEU HD12 H 1 0.507 0.020 . 2 . . . . A 737 LEU HD12 . 34329 1 1556 . 1 1 120 120 LEU HD13 H 1 0.507 0.020 . 2 . . . . A 737 LEU HD13 . 34329 1 1557 . 1 1 120 120 LEU HD21 H 1 0.594 0.020 . 2 . . . . A 737 LEU HD21 . 34329 1 1558 . 1 1 120 120 LEU HD22 H 1 0.594 0.020 . 2 . . . . A 737 LEU HD22 . 34329 1 1559 . 1 1 120 120 LEU HD23 H 1 0.594 0.020 . 2 . . . . A 737 LEU HD23 . 34329 1 1560 . 1 1 120 120 LEU C C 13 176.495 0.300 . 1 . . . . A 737 LEU C . 34329 1 1561 . 1 1 120 120 LEU CA C 13 54.557 0.300 . 1 . . . . A 737 LEU CA . 34329 1 1562 . 1 1 120 120 LEU CB C 13 37.461 0.300 . 1 . . . . A 737 LEU CB . 34329 1 1563 . 1 1 120 120 LEU CG C 13 23.591 0.300 . 1 . . . . A 737 LEU CG . 34329 1 1564 . 1 1 120 120 LEU CD1 C 13 22.757 0.300 . 1 . . . . A 737 LEU CD1 . 34329 1 1565 . 1 1 120 120 LEU CD2 C 13 19.505 0.300 . 1 . . . . A 737 LEU CD2 . 34329 1 1566 . 1 1 120 120 LEU N N 15 119.553 0.300 . 1 . . . . A 737 LEU N . 34329 1 1567 . 1 1 121 121 LEU H H 1 7.877 0.020 . 1 . . . . A 738 LEU H . 34329 1 1568 . 1 1 121 121 LEU HA H 1 3.883 0.020 . 1 . . . . A 738 LEU HA . 34329 1 1569 . 1 1 121 121 LEU HB2 H 1 1.447 0.020 . 1 . . . . A 738 LEU HB2 . 34329 1 1570 . 1 1 121 121 LEU HB3 H 1 1.673 0.020 . 1 . . . . A 738 LEU HB3 . 34329 1 1571 . 1 1 121 121 LEU HG H 1 1.451 0.020 . 1 . . . . A 738 LEU HG . 34329 1 1572 . 1 1 121 121 LEU HD11 H 1 0.756 0.020 . 2 . . . . A 738 LEU HD11 . 34329 1 1573 . 1 1 121 121 LEU HD12 H 1 0.756 0.020 . 2 . . . . A 738 LEU HD12 . 34329 1 1574 . 1 1 121 121 LEU HD13 H 1 0.756 0.020 . 2 . . . . A 738 LEU HD13 . 34329 1 1575 . 1 1 121 121 LEU HD21 H 1 0.790 0.020 . 2 . . . . A 738 LEU HD21 . 34329 1 1576 . 1 1 121 121 LEU HD22 H 1 0.790 0.020 . 2 . . . . A 738 LEU HD22 . 34329 1 1577 . 1 1 121 121 LEU HD23 H 1 0.790 0.020 . 2 . . . . A 738 LEU HD23 . 34329 1 1578 . 1 1 121 121 LEU C C 13 174.920 0.300 . 1 . . . . A 738 LEU C . 34329 1 1579 . 1 1 121 121 LEU CA C 13 54.455 0.300 . 1 . . . . A 738 LEU CA . 34329 1 1580 . 1 1 121 121 LEU CB C 13 39.685 0.300 . 1 . . . . A 738 LEU CB . 34329 1 1581 . 1 1 121 121 LEU CG C 13 24.029 0.300 . 1 . . . . A 738 LEU CG . 34329 1 1582 . 1 1 121 121 LEU CD1 C 13 22.780 0.300 . 1 . . . . A 738 LEU CD1 . 34329 1 1583 . 1 1 121 121 LEU CD2 C 13 22.129 0.300 . 1 . . . . A 738 LEU CD2 . 34329 1 1584 . 1 1 121 121 LEU N N 15 119.671 0.300 . 1 . . . . A 738 LEU N . 34329 1 1585 . 1 1 122 122 ASN H H 1 7.436 0.020 . 1 . . . . A 739 ASN H . 34329 1 1586 . 1 1 122 122 ASN HA H 1 4.488 0.020 . 1 . . . . A 739 ASN HA . 34329 1 1587 . 1 1 122 122 ASN HB2 H 1 2.553 0.020 . 1 . . . . A 739 ASN HB2 . 34329 1 1588 . 1 1 122 122 ASN HB3 H 1 2.771 0.020 . 1 . . . . A 739 ASN HB3 . 34329 1 1589 . 1 1 122 122 ASN HD21 H 1 7.403 0.020 . 1 . . . . A 739 ASN HD21 . 34329 1 1590 . 1 1 122 122 ASN HD22 H 1 6.885 0.020 . 1 . . . . A 739 ASN HD22 . 34329 1 1591 . 1 1 122 122 ASN C C 13 172.300 0.300 . 1 . . . . A 739 ASN C . 34329 1 1592 . 1 1 122 122 ASN CA C 13 50.865 0.300 . 1 . . . . A 739 ASN CA . 34329 1 1593 . 1 1 122 122 ASN CB C 13 36.190 0.300 . 1 . . . . A 739 ASN CB . 34329 1 1594 . 1 1 122 122 ASN N N 15 115.060 0.300 . 1 . . . . A 739 ASN N . 34329 1 1595 . 1 1 122 122 ASN ND2 N 15 113.125 0.300 . 1 . . . . A 739 ASN ND2 . 34329 1 1596 . 1 1 123 123 LEU H H 1 7.369 0.020 . 1 . . . . A 740 LEU H . 34329 1 1597 . 1 1 123 123 LEU HA H 1 4.132 0.020 . 1 . . . . A 740 LEU HA . 34329 1 1598 . 1 1 123 123 LEU HB2 H 1 1.495 0.020 . 1 . . . . A 740 LEU HB2 . 34329 1 1599 . 1 1 123 123 LEU HB3 H 1 1.630 0.020 . 1 . . . . A 740 LEU HB3 . 34329 1 1600 . 1 1 123 123 LEU HG H 1 1.635 0.020 . 1 . . . . A 740 LEU HG . 34329 1 1601 . 1 1 123 123 LEU HD11 H 1 0.734 0.020 . 2 . . . . A 740 LEU HD11 . 34329 1 1602 . 1 1 123 123 LEU HD12 H 1 0.734 0.020 . 2 . . . . A 740 LEU HD12 . 34329 1 1603 . 1 1 123 123 LEU HD13 H 1 0.734 0.020 . 2 . . . . A 740 LEU HD13 . 34329 1 1604 . 1 1 123 123 LEU HD21 H 1 0.791 0.020 . 2 . . . . A 740 LEU HD21 . 34329 1 1605 . 1 1 123 123 LEU HD22 H 1 0.791 0.020 . 2 . . . . A 740 LEU HD22 . 34329 1 1606 . 1 1 123 123 LEU HD23 H 1 0.791 0.020 . 2 . . . . A 740 LEU HD23 . 34329 1 1607 . 1 1 123 123 LEU C C 13 174.326 0.300 . 1 . . . . A 740 LEU C . 34329 1 1608 . 1 1 123 123 LEU CA C 13 52.863 0.300 . 1 . . . . A 740 LEU CA . 34329 1 1609 . 1 1 123 123 LEU CB C 13 39.415 0.300 . 1 . . . . A 740 LEU CB . 34329 1 1610 . 1 1 123 123 LEU CG C 13 23.451 0.300 . 1 . . . . A 740 LEU CG . 34329 1 1611 . 1 1 123 123 LEU CD1 C 13 20.518 0.300 . 1 . . . . A 740 LEU CD1 . 34329 1 1612 . 1 1 123 123 LEU CD2 C 13 22.144 0.300 . 1 . . . . A 740 LEU CD2 . 34329 1 1613 . 1 1 123 123 LEU N N 15 121.211 0.300 . 1 . . . . A 740 LEU N . 34329 1 1614 . 1 1 124 124 LYS H H 1 8.065 0.020 . 1 . . . . A 741 LYS H . 34329 1 1615 . 1 1 124 124 LYS HA H 1 4.252 0.020 . 1 . . . . A 741 LYS HA . 34329 1 1616 . 1 1 124 124 LYS HB2 H 1 1.677 0.020 . 1 . . . . A 741 LYS HB2 . 34329 1 1617 . 1 1 124 124 LYS HB3 H 1 1.798 0.020 . 1 . . . . A 741 LYS HB3 . 34329 1 1618 . 1 1 124 124 LYS HG2 H 1 1.364 0.020 . 2 . . . . A 741 LYS HG2 . 34329 1 1619 . 1 1 124 124 LYS HG3 H 1 1.364 0.020 . 2 . . . . A 741 LYS HG3 . 34329 1 1620 . 1 1 124 124 LYS HD2 H 1 1.587 0.020 . 2 . . . . A 741 LYS HD2 . 34329 1 1621 . 1 1 124 124 LYS HD3 H 1 1.587 0.020 . 2 . . . . A 741 LYS HD3 . 34329 1 1622 . 1 1 124 124 LYS HE2 H 1 2.895 0.020 . 2 . . . . A 741 LYS HE2 . 34329 1 1623 . 1 1 124 124 LYS HE3 H 1 2.895 0.020 . 2 . . . . A 741 LYS HE3 . 34329 1 1624 . 1 1 124 124 LYS C C 13 172.513 0.300 . 1 . . . . A 741 LYS C . 34329 1 1625 . 1 1 124 124 LYS CA C 13 53.092 0.300 . 1 . . . . A 741 LYS CA . 34329 1 1626 . 1 1 124 124 LYS CB C 13 30.121 0.300 . 1 . . . . A 741 LYS CB . 34329 1 1627 . 1 1 124 124 LYS CG C 13 21.466 0.300 . 1 . . . . A 741 LYS CG . 34329 1 1628 . 1 1 124 124 LYS CD C 13 26.212 0.300 . 1 . . . . A 741 LYS CD . 34329 1 1629 . 1 1 124 124 LYS CE C 13 39.412 0.300 . 1 . . . . A 741 LYS CE . 34329 1 1630 . 1 1 124 124 LYS N N 15 122.412 0.300 . 1 . . . . A 741 LYS N . 34329 1 1631 . 1 1 125 125 ASP H H 1 7.839 0.020 . 1 . . . . A 742 ASP H . 34329 1 1632 . 1 1 125 125 ASP HA H 1 4.253 0.020 . 1 . . . . A 742 ASP HA . 34329 1 1633 . 1 1 125 125 ASP HB2 H 1 2.431 0.020 . 1 . . . . A 742 ASP HB2 . 34329 1 1634 . 1 1 125 125 ASP HB3 H 1 2.530 0.020 . 1 . . . . A 742 ASP HB3 . 34329 1 1635 . 1 1 125 125 ASP C C 13 178.078 0.300 . 1 . . . . A 742 ASP C . 34329 1 1636 . 1 1 125 125 ASP CA C 13 53.128 0.300 . 1 . . . . A 742 ASP CA . 34329 1 1637 . 1 1 125 125 ASP CB C 13 39.271 0.300 . 1 . . . . A 742 ASP CB . 34329 1 1638 . 1 1 125 125 ASP N N 15 126.878 0.300 . 1 . . . . A 742 ASP N . 34329 1 stop_ save_