data_30677 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 30677 _Entry.Title ; Solution structure of an organic hydroperoxide resistance protein from Burkholderia pseudomallei. Seattle Structural Genomics Center for Infectious Disease target BupsA.00074.a. ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2019-09-29 _Entry.Accession_date 2019-09-29 _Entry.Last_release_date 2019-10-09 _Entry.Original_release_date 2019-10-09 _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' 30677 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 G. Buchko G. W. . . 30677 2 SSGCID 'Seattle Structural Genomics Center for Infectious Disease (SSGCID)' . . . . 30677 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID 1 'NIAID, National Institute of Allergy and Infectious Diseases' 'Seattle Structural Genomics Center for Infectious Disease' SSGCID 30677 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID Melioidosis . 30677 OXIDOREDUCTASE . 30677 SSGCID . 30677 'Seattle Structural Genomics Center for Infectious Disease' . 30677 'Structural Genomics' . 30677 'biological warfare agent' . 30677 detoxification . 30677 'infectious diseases' . 30677 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 30677 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 482 30677 '15N chemical shifts' 134 30677 '1H chemical shifts' 780 30677 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2019-10-14 . original BMRB . 30677 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 6UHW . 30677 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 30677 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI 10.1007/s12104-009-9165-5 _Citation.PubMed_ID 19888681 _Citation.Full_citation . _Citation.Title ; Backbone and side chain (1)H, (13)C, and (15)N NMR assignments for the organic hydroperoxide resistance protein (Ohr) from Burkholderia pseudomallei. ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assign.' _Citation.Journal_name_full . _Citation.Journal_volume 3 _Citation.Journal_issue 2 _Citation.Journal_ASTM . _Citation.Journal_ISSN 1874-270X _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 163 _Citation.Page_last 166 _Citation.Year 2009 _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 G. Buchko G. W. . . 30677 1 2 S. Hewitt S. N. . . 30677 1 3 A. Napuli A. J. . . 30677 1 4 W. 'Van Voorhis' W. C. . . 30677 1 5 P. Myler P. J. . . 30677 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 30677 _Assembly.ID 1 _Assembly.Name 'Organic hydroperoxide resistance protein' _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' 1 $entity_1 A A yes . . . . . . 30677 1 2 'entity_1, 2' 1 $entity_1 B B yes . . . . . . 30677 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 30677 _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,B _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MNILYKTAATSTGGRDGRAT SHDQKLDVKLSAPRELGGAG AEGTNPEQLFAAGYSACFLS AMKFVAGQNKQTLPADTTVT AEVGIGPNEEGGFALDVELR VALPGLDAAAAKTLVDRAHH VCPYSNATRNNVAVRLVVA ; _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 139 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state . _Entity.Src_method man _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 14413.182 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . MET . 30677 1 2 . ASN . 30677 1 3 . ILE . 30677 1 4 . LEU . 30677 1 5 . TYR . 30677 1 6 . LYS . 30677 1 7 . THR . 30677 1 8 . ALA . 30677 1 9 . ALA . 30677 1 10 . THR . 30677 1 11 . SER . 30677 1 12 . THR . 30677 1 13 . GLY . 30677 1 14 . GLY . 30677 1 15 . ARG . 30677 1 16 . ASP . 30677 1 17 . GLY . 30677 1 18 . ARG . 30677 1 19 . ALA . 30677 1 20 . THR . 30677 1 21 . SER . 30677 1 22 . HIS . 30677 1 23 . ASP . 30677 1 24 . GLN . 30677 1 25 . LYS . 30677 1 26 . LEU . 30677 1 27 . ASP . 30677 1 28 . VAL . 30677 1 29 . LYS . 30677 1 30 . LEU . 30677 1 31 . SER . 30677 1 32 . ALA . 30677 1 33 . PRO . 30677 1 34 . ARG . 30677 1 35 . GLU . 30677 1 36 . LEU . 30677 1 37 . GLY . 30677 1 38 . GLY . 30677 1 39 . ALA . 30677 1 40 . GLY . 30677 1 41 . ALA . 30677 1 42 . GLU . 30677 1 43 . GLY . 30677 1 44 . THR . 30677 1 45 . ASN . 30677 1 46 . PRO . 30677 1 47 . GLU . 30677 1 48 . GLN . 30677 1 49 . LEU . 30677 1 50 . PHE . 30677 1 51 . ALA . 30677 1 52 . ALA . 30677 1 53 . GLY . 30677 1 54 . TYR . 30677 1 55 . SER . 30677 1 56 . ALA . 30677 1 57 . CYS . 30677 1 58 . PHE . 30677 1 59 . LEU . 30677 1 60 . SER . 30677 1 61 . ALA . 30677 1 62 . MET . 30677 1 63 . LYS . 30677 1 64 . PHE . 30677 1 65 . VAL . 30677 1 66 . ALA . 30677 1 67 . GLY . 30677 1 68 . GLN . 30677 1 69 . ASN . 30677 1 70 . LYS . 30677 1 71 . GLN . 30677 1 72 . THR . 30677 1 73 . LEU . 30677 1 74 . PRO . 30677 1 75 . ALA . 30677 1 76 . ASP . 30677 1 77 . THR . 30677 1 78 . THR . 30677 1 79 . VAL . 30677 1 80 . THR . 30677 1 81 . ALA . 30677 1 82 . GLU . 30677 1 83 . VAL . 30677 1 84 . GLY . 30677 1 85 . ILE . 30677 1 86 . GLY . 30677 1 87 . PRO . 30677 1 88 . ASN . 30677 1 89 . GLU . 30677 1 90 . GLU . 30677 1 91 . GLY . 30677 1 92 . GLY . 30677 1 93 . PHE . 30677 1 94 . ALA . 30677 1 95 . LEU . 30677 1 96 . ASP . 30677 1 97 . VAL . 30677 1 98 . GLU . 30677 1 99 . LEU . 30677 1 100 . ARG . 30677 1 101 . VAL . 30677 1 102 . ALA . 30677 1 103 . LEU . 30677 1 104 . PRO . 30677 1 105 . GLY . 30677 1 106 . LEU . 30677 1 107 . ASP . 30677 1 108 . ALA . 30677 1 109 . ALA . 30677 1 110 . ALA . 30677 1 111 . ALA . 30677 1 112 . LYS . 30677 1 113 . THR . 30677 1 114 . LEU . 30677 1 115 . VAL . 30677 1 116 . ASP . 30677 1 117 . ARG . 30677 1 118 . ALA . 30677 1 119 . HIS . 30677 1 120 . HIS . 30677 1 121 . VAL . 30677 1 122 . CYS . 30677 1 123 . PRO . 30677 1 124 . TYR . 30677 1 125 . SER . 30677 1 126 . ASN . 30677 1 127 . ALA . 30677 1 128 . THR . 30677 1 129 . ARG . 30677 1 130 . ASN . 30677 1 131 . ASN . 30677 1 132 . VAL . 30677 1 133 . ALA . 30677 1 134 . VAL . 30677 1 135 . ARG . 30677 1 136 . LEU . 30677 1 137 . VAL . 30677 1 138 . VAL . 30677 1 139 . ALA . 30677 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 . MET 1 1 30677 1 . ASN 2 2 30677 1 . ILE 3 3 30677 1 . LEU 4 4 30677 1 . TYR 5 5 30677 1 . LYS 6 6 30677 1 . THR 7 7 30677 1 . ALA 8 8 30677 1 . ALA 9 9 30677 1 . THR 10 10 30677 1 . SER 11 11 30677 1 . THR 12 12 30677 1 . GLY 13 13 30677 1 . GLY 14 14 30677 1 . ARG 15 15 30677 1 . ASP 16 16 30677 1 . GLY 17 17 30677 1 . ARG 18 18 30677 1 . ALA 19 19 30677 1 . THR 20 20 30677 1 . SER 21 21 30677 1 . HIS 22 22 30677 1 . ASP 23 23 30677 1 . GLN 24 24 30677 1 . LYS 25 25 30677 1 . LEU 26 26 30677 1 . ASP 27 27 30677 1 . VAL 28 28 30677 1 . LYS 29 29 30677 1 . LEU 30 30 30677 1 . SER 31 31 30677 1 . ALA 32 32 30677 1 . PRO 33 33 30677 1 . ARG 34 34 30677 1 . GLU 35 35 30677 1 . LEU 36 36 30677 1 . GLY 37 37 30677 1 . GLY 38 38 30677 1 . ALA 39 39 30677 1 . GLY 40 40 30677 1 . ALA 41 41 30677 1 . GLU 42 42 30677 1 . GLY 43 43 30677 1 . THR 44 44 30677 1 . ASN 45 45 30677 1 . PRO 46 46 30677 1 . GLU 47 47 30677 1 . GLN 48 48 30677 1 . LEU 49 49 30677 1 . PHE 50 50 30677 1 . ALA 51 51 30677 1 . ALA 52 52 30677 1 . GLY 53 53 30677 1 . TYR 54 54 30677 1 . SER 55 55 30677 1 . ALA 56 56 30677 1 . CYS 57 57 30677 1 . PHE 58 58 30677 1 . LEU 59 59 30677 1 . SER 60 60 30677 1 . ALA 61 61 30677 1 . MET 62 62 30677 1 . LYS 63 63 30677 1 . PHE 64 64 30677 1 . VAL 65 65 30677 1 . ALA 66 66 30677 1 . GLY 67 67 30677 1 . GLN 68 68 30677 1 . ASN 69 69 30677 1 . LYS 70 70 30677 1 . GLN 71 71 30677 1 . THR 72 72 30677 1 . LEU 73 73 30677 1 . PRO 74 74 30677 1 . ALA 75 75 30677 1 . ASP 76 76 30677 1 . THR 77 77 30677 1 . THR 78 78 30677 1 . VAL 79 79 30677 1 . THR 80 80 30677 1 . ALA 81 81 30677 1 . GLU 82 82 30677 1 . VAL 83 83 30677 1 . GLY 84 84 30677 1 . ILE 85 85 30677 1 . GLY 86 86 30677 1 . PRO 87 87 30677 1 . ASN 88 88 30677 1 . GLU 89 89 30677 1 . GLU 90 90 30677 1 . GLY 91 91 30677 1 . GLY 92 92 30677 1 . PHE 93 93 30677 1 . ALA 94 94 30677 1 . LEU 95 95 30677 1 . ASP 96 96 30677 1 . VAL 97 97 30677 1 . GLU 98 98 30677 1 . LEU 99 99 30677 1 . ARG 100 100 30677 1 . VAL 101 101 30677 1 . ALA 102 102 30677 1 . LEU 103 103 30677 1 . PRO 104 104 30677 1 . GLY 105 105 30677 1 . LEU 106 106 30677 1 . ASP 107 107 30677 1 . ALA 108 108 30677 1 . ALA 109 109 30677 1 . ALA 110 110 30677 1 . ALA 111 111 30677 1 . LYS 112 112 30677 1 . THR 113 113 30677 1 . LEU 114 114 30677 1 . VAL 115 115 30677 1 . ASP 116 116 30677 1 . ARG 117 117 30677 1 . ALA 118 118 30677 1 . HIS 119 119 30677 1 . HIS 120 120 30677 1 . VAL 121 121 30677 1 . CYS 122 122 30677 1 . PRO 123 123 30677 1 . TYR 124 124 30677 1 . SER 125 125 30677 1 . ASN 126 126 30677 1 . ALA 127 127 30677 1 . THR 128 128 30677 1 . ARG 129 129 30677 1 . ASN 130 130 30677 1 . ASN 131 131 30677 1 . VAL 132 132 30677 1 . ALA 133 133 30677 1 . VAL 134 134 30677 1 . ARG 135 135 30677 1 . LEU 136 136 30677 1 . VAL 137 137 30677 1 . VAL 138 138 30677 1 . ALA 139 139 30677 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 30677 _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 . 320372 organism . 'Burkholderia pseudomallei (strain 1710b)' 'Burkholderia pseudomallei' . . Bacteria . Burkholderia pseudomallei 1710b . . . . . . . . . . 'ohr, BURPS1710b_A0863' . 30677 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 30677 _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' . . 562 Escherichia coli . . . . . . . . . . 30677 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 30677 _Sample.ID 1 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details '20 mM TRIS, 100 mM sodium chloride, 1 mM DTT, 1 mM [U-99% 13C; U-99% 15N] B74, 93% H2O/7% D2O' _Sample.Aggregate_sample_number . _Sample.Solvent_system '93% H2O/7% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 TRIS 'natural abundance' . . . . . . 20 . . mM . . . . 30677 1 2 'sodium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 30677 1 3 DTT 'natural abundance' . . . . . . 1 . . mM . . . . 30677 1 4 B74 '[U-99% 13C; U-99% 15N]' . . 1 $entity_1 . . 1 . . mM 0.2 . . . 30677 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 30677 _Sample.ID 2 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details '20 mM TRIS, 100 mM sodium chloride, 1 mM DTT, 1 mM 99% 13C; U-99% 15N; 50%-2H]] B74, 93% H2O/7% D2O' _Sample.Aggregate_sample_number . _Sample.Solvent_system '93% H2O/7% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 TRIS 'natural abundance' . . . . . . 20 . . mM . . . . 30677 2 2 'sodium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 30677 2 3 DTT 'natural abundance' . . . . . . 1 . . mM . . . . 30677 2 4 B74 '99% 13C; U-99% 15N; 50%-2H]]' . . 1 $entity_1 . . 1 . . mM 0.2 . . . 30677 2 stop_ save_ save_sample_3 _Sample.Sf_category sample _Sample.Sf_framecode sample_3 _Sample.Entry_ID 30677 _Sample.ID 3 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details '20 mM TRIS, 100 mM sodium chloride, 1 mM DTT, 1 mM 99% 13C; U-99% 15N] B74, 99% D2O' _Sample.Aggregate_sample_number . _Sample.Solvent_system '99% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 TRIS 'natural abundance' . . . . . . 20 . . mM . . . . 30677 3 2 'sodium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 30677 3 3 DTT 'natural abundance' . . . . . . 1 . . mM . . . . 30677 3 4 B74 '99% 13C; U-99% 15N]' . . 1 $entity_1 . . 1 . . mM 0.2 . . . 30677 3 stop_ save_ save_sample_4 _Sample.Sf_category sample _Sample.Sf_framecode sample_4 _Sample.Entry_ID 30677 _Sample.ID 4 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details '20 mM TRIS, 100 mM sodium chloride, 1 mM DTT, 1 mM [U-10% 13C; U-99% 15N] B74, 93% H2O/7% D2O' _Sample.Aggregate_sample_number . _Sample.Solvent_system '93% H2O/7% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 TRIS 'natural abundance' . . . . . . 20 . . mM . . . . 30677 4 2 'sodium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 30677 4 3 DTT 'natural abundance' . . . . . . 1 . . mM . . . . 30677 4 4 B74 '[U-10% 13C; U-99% 15N]' . . 1 $entity_1 . . 1 . . mM 0.2 . . . 30677 4 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 30677 _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' 0.12 . M 30677 1 pH 7 0.1 pH 30677 1 pressure 1 . atm 30677 1 temperature 298 0.2 K 30677 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 30677 _Software.ID 1 _Software.Type . _Software.Name Felix _Software.Version 2007 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Accelrys Software Inc.' . . 30677 1 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . processing 30677 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 30677 _Software.ID 2 _Software.Type . _Software.Name CYANA _Software.Version 2.1 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . 30677 2 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . refinement 30677 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 30677 _Software.ID 3 _Software.Type . _Software.Name Sparky _Software.Version 3.115 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . 30677 3 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . 'chemical shift assignment' 30677 3 . 'data analysis' 30677 3 . 'peak picking' 30677 3 stop_ save_ save_software_4 _Software.Sf_category software _Software.Sf_framecode software_4 _Software.Entry_ID 30677 _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' . . 30677 4 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . 'data analysis' 30677 4 stop_ save_ save_software_5 _Software.Sf_category software _Software.Sf_framecode software_5 _Software.Entry_ID 30677 _Software.ID 5 _Software.Type . _Software.Name PSVS _Software.Version 1.5 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bhattacharya and Montelione' . . 30677 5 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . 'data analysis' 30677 5 stop_ save_ save_software_6 _Software.Sf_category software _Software.Sf_framecode software_6 _Software.Entry_ID 30677 _Software.ID 6 _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' . . 30677 6 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . 'structure calculation' 30677 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 30677 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE II' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 750 save_ save_NMR_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_2 _NMR_spectrometer.Entry_ID 30677 _NMR_spectrometer.ID 2 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model VXRS _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 750 save_ save_NMR_spectrometer_3 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_3 _NMR_spectrometer.Entry_ID 30677 _NMR_spectrometer.ID 3 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model VXRS _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 30677 _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 'AVANCE II' . 750 . . . 30677 1 2 NMR_spectrometer_2 Varian VXRS . 750 . . . 30677 1 3 NMR_spectrometer_3 Varian VXRS . 600 . . . 30677 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 30677 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 30677 1 2 '2D 1H-13C HSQC aliphatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30677 1 3 '2D 1H-15N HSQC' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30677 1 4 '3D C(CO)NH' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 30677 1 5 '3D HNCACB' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 30677 1 6 '3D HNCA' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 3 $NMR_spectrometer_3 . . . . . . . . . . . . . . . . 30677 1 7 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 3 $NMR_spectrometer_3 . . . . . . . . . . . . . . . . 30677 1 8 '3D 1H-13C NOESY aliphatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 30677 1 9 '3D 1H-13C NOESY aliphatic' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30677 1 10 '3D 1H-13C NOESY aromatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 30677 1 11 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 30677 1 12 '3D HCCH-TOCSY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 3 $NMR_spectrometer_3 . . . . . . . . . . . . . . . . 30677 1 13 '2D 1H-15N HSQC' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30677 1 14 '3D H(CCO)NH' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 3 $NMR_spectrometer_3 . . . . . . . . . . . . . . . . 30677 1 15 '2D 1H-13C HSQC aliphatic' no . . . . . . . . . . 4 $sample_4 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30677 1 16 '2D 1H-13C HSQC aromatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 30677 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 30677 _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 . . . . . 30677 1 H 1 DSS 'methyl protons' . . . . ppm 0.000 internal direct 1.0 . . . . . 30677 1 N 15 DSS 'methyl protons' . . . . ppm 0.000 internal indirect 0.10132912 . . . . . 30677 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 30677 _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 0.02 _Assigned_chem_shift_list.Chem_shift_13C_err 0.1 _Assigned_chem_shift_list.Chem_shift_15N_err 0.1 _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 30677 1 2 '2D 1H-13C HSQC aliphatic' . . . 30677 1 3 '2D 1H-15N HSQC' . . . 30677 1 4 '3D C(CO)NH' . . . 30677 1 5 '3D HNCACB' . . . 30677 1 6 '3D HNCA' . . . 30677 1 7 '3D HNCO' . . . 30677 1 8 '3D 1H-13C NOESY aliphatic' . . . 30677 1 9 '3D 1H-13C NOESY aliphatic' . . . 30677 1 10 '3D 1H-13C NOESY aromatic' . . . 30677 1 11 '3D 1H-15N NOESY' . . . 30677 1 12 '3D HCCH-TOCSY' . . . 30677 1 13 '2D 1H-15N HSQC' . . . 30677 1 14 '3D H(CCO)NH' . . . 30677 1 15 '2D 1H-13C HSQC aliphatic' . . . 30677 1 16 '2D 1H-13C HSQC aromatic' . . . 30677 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 MET H H 1 8.27 0.02 . 1 . . . . A 1 MET H1 . 30677 1 2 . 1 1 1 1 MET HA H 1 4.44 0.02 . 1 . . . . A 1 MET HA . 30677 1 3 . 1 1 1 1 MET HB2 H 1 1.91 0.02 . 2 . . . . A 1 MET HB2 . 30677 1 4 . 1 1 1 1 MET HB3 H 1 1.91 0.02 . 2 . . . . A 1 MET HB3 . 30677 1 5 . 1 1 1 1 MET HG2 H 1 2.41 0.02 . 2 . . . . A 1 MET HG2 . 30677 1 6 . 1 1 1 1 MET HG3 H 1 2.33 0.02 . 2 . . . . A 1 MET HG3 . 30677 1 7 . 1 1 1 1 MET HE1 H 1 1.84 0.02 . 1 . . . . A 1 MET HE1 . 30677 1 8 . 1 1 1 1 MET HE2 H 1 1.84 0.02 . 1 . . . . A 1 MET HE2 . 30677 1 9 . 1 1 1 1 MET HE3 H 1 1.84 0.02 . 1 . . . . A 1 MET HE3 . 30677 1 10 . 1 1 1 1 MET C C 13 175.1 0.2 . 1 . . . . A 1 MET C . 30677 1 11 . 1 1 1 1 MET CA C 13 55.6 0.2 . 1 . . . . A 1 MET CA . 30677 1 12 . 1 1 1 1 MET CB C 13 33.7 0.2 . 1 . . . . A 1 MET CB . 30677 1 13 . 1 1 1 1 MET CG C 13 31.6 0.2 . 1 . . . . A 1 MET CG . 30677 1 14 . 1 1 1 1 MET CE C 13 17.0 0.2 . 1 . . . . A 1 MET CE . 30677 1 15 . 1 1 1 1 MET N N 15 121.6 0.2 . 1 . . . . A 1 MET N . 30677 1 16 . 1 1 2 2 ASN H H 1 8.54 0.02 . 1 . . . . A 2 ASN H . 30677 1 17 . 1 1 2 2 ASN HA H 1 4.68 0.02 . 1 . . . . A 2 ASN HA . 30677 1 18 . 1 1 2 2 ASN HB2 H 1 2.74 0.02 . 2 . . . . A 2 ASN HB2 . 30677 1 19 . 1 1 2 2 ASN HB3 H 1 2.63 0.02 . 2 . . . . A 2 ASN HB3 . 30677 1 20 . 1 1 2 2 ASN HD21 H 1 7.45 0.02 . 2 . . . . A 2 ASN HD21 . 30677 1 21 . 1 1 2 2 ASN HD22 H 1 6.84 0.02 . 2 . . . . A 2 ASN HD22 . 30677 1 22 . 1 1 2 2 ASN C C 13 173.5 0.2 . 1 . . . . A 2 ASN C . 30677 1 23 . 1 1 2 2 ASN CA C 13 52.5 0.2 . 1 . . . . A 2 ASN CA . 30677 1 24 . 1 1 2 2 ASN CB C 13 38.8 0.1 . 1 . . . . A 2 ASN CB . 30677 1 25 . 1 1 2 2 ASN N N 15 122.2 0.2 . 1 . . . . A 2 ASN N . 30677 1 26 . 1 1 2 2 ASN ND2 N 15 111.9 0.2 . 1 . . . . A 2 ASN ND2 . 30677 1 27 . 1 1 3 3 ILE H H 1 8.06 0.02 . 1 . . . . A 3 ILE H . 30677 1 28 . 1 1 3 3 ILE HA H 1 3.88 0.02 . 1 . . . . A 3 ILE HA . 30677 1 29 . 1 1 3 3 ILE HB H 1 1.85 0.02 . 1 . . . . A 3 ILE HB . 30677 1 30 . 1 1 3 3 ILE HG12 H 1 1.39 0.02 . 2 . . . . A 3 ILE HG12 . 30677 1 31 . 1 1 3 3 ILE HG13 H 1 1.15 0.02 . 2 . . . . A 3 ILE HG13 . 30677 1 32 . 1 1 3 3 ILE HG21 H 1 0.74 0.02 . 1 . . . . A 3 ILE HG21 . 30677 1 33 . 1 1 3 3 ILE HG22 H 1 0.74 0.02 . 1 . . . . A 3 ILE HG22 . 30677 1 34 . 1 1 3 3 ILE HG23 H 1 0.74 0.02 . 1 . . . . A 3 ILE HG23 . 30677 1 35 . 1 1 3 3 ILE HD11 H 1 0.61 0.02 . 1 . . . . A 3 ILE HD11 . 30677 1 36 . 1 1 3 3 ILE HD12 H 1 0.61 0.02 . 1 . . . . A 3 ILE HD12 . 30677 1 37 . 1 1 3 3 ILE HD13 H 1 0.61 0.02 . 1 . . . . A 3 ILE HD13 . 30677 1 38 . 1 1 3 3 ILE C C 13 176.4 0.2 . 1 . . . . A 3 ILE C . 30677 1 39 . 1 1 3 3 ILE CA C 13 60.2 0.2 . 1 . . . . A 3 ILE CA . 30677 1 40 . 1 1 3 3 ILE CB C 13 37.2 0.2 . 1 . . . . A 3 ILE CB . 30677 1 41 . 1 1 3 3 ILE CG1 C 13 27.2 0.2 . 1 . . . . A 3 ILE CG1 . 30677 1 42 . 1 1 3 3 ILE CG2 C 13 18.4 0.2 . 1 . . . . A 3 ILE CG2 . 30677 1 43 . 1 1 3 3 ILE CD1 C 13 11.4 0.2 . 1 . . . . A 3 ILE CD1 . 30677 1 44 . 1 1 3 3 ILE N N 15 122.4 0.2 . 1 . . . . A 3 ILE N . 30677 1 45 . 1 1 4 4 LEU H H 1 9.09 0.02 . 1 . . . . A 4 LEU H . 30677 1 46 . 1 1 4 4 LEU HA H 1 4.42 0.02 . 1 . . . . A 4 LEU HA . 30677 1 47 . 1 1 4 4 LEU HG H 1 1.90 0.02 . 1 . . . . A 4 LEU HG . 30677 1 48 . 1 1 4 4 LEU HD11 H 1 1.03 0.02 . 1 . . . . A 4 LEU HD11 . 30677 1 49 . 1 1 4 4 LEU HD12 H 1 1.03 0.02 . 1 . . . . A 4 LEU HD12 . 30677 1 50 . 1 1 4 4 LEU HD13 H 1 1.03 0.02 . 1 . . . . A 4 LEU HD13 . 30677 1 51 . 1 1 4 4 LEU HD21 H 1 0.95 0.02 . 1 . . . . A 4 LEU HD21 . 30677 1 52 . 1 1 4 4 LEU HD22 H 1 0.95 0.02 . 1 . . . . A 4 LEU HD22 . 30677 1 53 . 1 1 4 4 LEU HD23 H 1 0.95 0.02 . 1 . . . . A 4 LEU HD23 . 30677 1 54 . 1 1 4 4 LEU C C 13 176.5 0.2 . 1 . . . . A 4 LEU C . 30677 1 55 . 1 1 4 4 LEU CA C 13 55.7 0.2 . 1 . . . . A 4 LEU CA . 30677 1 56 . 1 1 4 4 LEU CB C 13 43.7 0.2 . 1 . . . . A 4 LEU CB . 30677 1 57 . 1 1 4 4 LEU CG C 13 27.3 0.2 . 1 . . . . A 4 LEU CG . 30677 1 58 . 1 1 4 4 LEU CD1 C 13 25.6 0.2 . 1 . . . . A 4 LEU CD1 . 30677 1 59 . 1 1 4 4 LEU CD2 C 13 22.3 0.2 . 1 . . . . A 4 LEU CD2 . 30677 1 60 . 1 1 4 4 LEU N N 15 127.7 0.2 . 1 . . . . A 4 LEU N . 30677 1 61 . 1 1 5 5 TYR H H 1 7.36 0.02 . 1 . . . . A 5 TYR H . 30677 1 62 . 1 1 5 5 TYR HA H 1 4.73 0.02 . 1 . . . . A 5 TYR HA . 30677 1 63 . 1 1 5 5 TYR HB2 H 1 2.88 0.02 . 2 . . . . A 5 TYR HB2 . 30677 1 64 . 1 1 5 5 TYR HB3 H 1 2.37 0.02 . 2 . . . . A 5 TYR HB3 . 30677 1 65 . 1 1 5 5 TYR HD1 H 1 6.91 0.02 . 3 . . . . A 5 TYR HD1 . 30677 1 66 . 1 1 5 5 TYR HD2 H 1 6.91 0.02 . 3 . . . . A 5 TYR HD2 . 30677 1 67 . 1 1 5 5 TYR C C 13 171.6 0.2 . 1 . . . . A 5 TYR C . 30677 1 68 . 1 1 5 5 TYR CA C 13 56.8 0.2 . 1 . . . . A 5 TYR CA . 30677 1 69 . 1 1 5 5 TYR CB C 13 41.9 0.2 . 1 . . . . A 5 TYR CB . 30677 1 70 . 1 1 5 5 TYR CD1 C 13 132.7 0.2 . 3 . . . . A 5 TYR CD1 . 30677 1 71 . 1 1 5 5 TYR CD2 C 13 132.7 0.2 . 3 . . . . A 5 TYR CD2 . 30677 1 72 . 1 1 5 5 TYR N N 15 116.9 0.2 . 1 . . . . A 5 TYR N . 30677 1 73 . 1 1 6 6 LYS H H 1 7.63 0.02 . 1 . . . . A 6 LYS H . 30677 1 74 . 1 1 6 6 LYS HA H 1 4.97 0.02 . 1 . . . . A 6 LYS HA . 30677 1 75 . 1 1 6 6 LYS HB2 H 1 1.46 0.02 . 2 . . . . A 6 LYS HB2 . 30677 1 76 . 1 1 6 6 LYS HB3 H 1 1.33 0.02 . 2 . . . . A 6 LYS HB3 . 30677 1 77 . 1 1 6 6 LYS HG2 H 1 1.13 0.02 . 2 . . . . A 6 LYS HG2 . 30677 1 78 . 1 1 6 6 LYS HG3 H 1 1.07 0.02 . 2 . . . . A 6 LYS HG3 . 30677 1 79 . 1 1 6 6 LYS HD2 H 1 1.42 0.02 . 2 . . . . A 6 LYS HD2 . 30677 1 80 . 1 1 6 6 LYS HD3 H 1 1.42 0.02 . 2 . . . . A 6 LYS HD3 . 30677 1 81 . 1 1 6 6 LYS HE2 H 1 2.74 0.02 . 2 . . . . A 6 LYS HE2 . 30677 1 82 . 1 1 6 6 LYS HE3 H 1 2.74 0.02 . 2 . . . . A 6 LYS HE3 . 30677 1 83 . 1 1 6 6 LYS C C 13 172.6 0.2 . 1 . . . . A 6 LYS C . 30677 1 84 . 1 1 6 6 LYS CA C 13 54.4 0.2 . 1 . . . . A 6 LYS CA . 30677 1 85 . 1 1 6 6 LYS CB C 13 36.2 0.2 . 1 . . . . A 6 LYS CB . 30677 1 86 . 1 1 6 6 LYS CG C 13 24.3 0.2 . 1 . . . . A 6 LYS CG . 30677 1 87 . 1 1 6 6 LYS CD C 13 29.6 0.2 . 1 . . . . A 6 LYS CD . 30677 1 88 . 1 1 6 6 LYS CE C 13 41.9 0.2 . 1 . . . . A 6 LYS CE . 30677 1 89 . 1 1 6 6 LYS N N 15 126.4 0.2 . 1 . . . . A 6 LYS N . 30677 1 90 . 1 1 7 7 THR H H 1 8.34 0.02 . 1 . . . . A 7 THR H . 30677 1 91 . 1 1 7 7 THR HA H 1 4.44 0.02 . 1 . . . . A 7 THR HA . 30677 1 92 . 1 1 7 7 THR HB H 1 4.10 0.02 . 1 . . . . A 7 THR HB . 30677 1 93 . 1 1 7 7 THR HG21 H 1 1.10 0.02 . 1 . . . . A 7 THR HG21 . 30677 1 94 . 1 1 7 7 THR HG22 H 1 1.10 0.02 . 1 . . . . A 7 THR HG22 . 30677 1 95 . 1 1 7 7 THR HG23 H 1 1.10 0.02 . 1 . . . . A 7 THR HG23 . 30677 1 96 . 1 1 7 7 THR C C 13 170.4 0.2 . 1 . . . . A 7 THR C . 30677 1 97 . 1 1 7 7 THR CA C 13 59.6 0.2 . 1 . . . . A 7 THR CA . 30677 1 98 . 1 1 7 7 THR CB C 13 69.3 0.2 . 1 . . . . A 7 THR CB . 30677 1 99 . 1 1 7 7 THR CG2 C 13 18.2 0.2 . 1 . . . . A 7 THR CG2 . 30677 1 100 . 1 1 7 7 THR N N 15 117.8 0.2 . 1 . . . . A 7 THR N . 30677 1 101 . 1 1 8 8 ALA H H 1 7.85 0.02 . 1 . . . . A 8 ALA H . 30677 1 102 . 1 1 8 8 ALA HA H 1 5.68 0.02 . 1 . . . . A 8 ALA HA . 30677 1 103 . 1 1 8 8 ALA HB1 H 1 0.78 0.02 . 1 . . . . A 8 ALA HB1 . 30677 1 104 . 1 1 8 8 ALA HB2 H 1 0.78 0.02 . 1 . . . . A 8 ALA HB2 . 30677 1 105 . 1 1 8 8 ALA HB3 H 1 0.78 0.02 . 1 . . . . A 8 ALA HB3 . 30677 1 106 . 1 1 8 8 ALA CA C 13 50.2 0.2 . 1 . . . . A 8 ALA CA . 30677 1 107 . 1 1 8 8 ALA CB C 13 22.7 0.2 . 1 . . . . A 8 ALA CB . 30677 1 108 . 1 1 8 8 ALA N N 15 123.7 0.2 . 1 . . . . A 8 ALA N . 30677 1 109 . 1 1 9 9 ALA H H 1 8.42 0.02 . 1 . . . . A 9 ALA H . 30677 1 110 . 1 1 9 9 ALA HA H 1 4.99 0.02 . 1 . . . . A 9 ALA HA . 30677 1 111 . 1 1 9 9 ALA HB1 H 1 0.97 0.02 . 1 . . . . A 9 ALA HB1 . 30677 1 112 . 1 1 9 9 ALA HB2 H 1 0.97 0.02 . 1 . . . . A 9 ALA HB2 . 30677 1 113 . 1 1 9 9 ALA HB3 H 1 0.97 0.02 . 1 . . . . A 9 ALA HB3 . 30677 1 114 . 1 1 9 9 ALA C C 13 174.4 0.2 . 1 . . . . A 9 ALA C . 30677 1 115 . 1 1 9 9 ALA CA C 13 51.3 0.2 . 1 . . . . A 9 ALA CA . 30677 1 116 . 1 1 9 9 ALA CB C 13 21.4 0.2 . 1 . . . . A 9 ALA CB . 30677 1 117 . 1 1 9 9 ALA N N 15 119.1 0.2 . 1 . . . . A 9 ALA N . 30677 1 118 . 1 1 10 10 THR H H 1 8.40 0.02 . 1 . . . . A 10 THR H . 30677 1 119 . 1 1 10 10 THR HA H 1 5.35 0.02 . 1 . . . . A 10 THR HA . 30677 1 120 . 1 1 10 10 THR HB H 1 3.95 0.02 . 1 . . . . A 10 THR HB . 30677 1 121 . 1 1 10 10 THR HG21 H 1 1.17 0.02 . 1 . . . . A 10 THR HG21 . 30677 1 122 . 1 1 10 10 THR HG22 H 1 1.17 0.02 . 1 . . . . A 10 THR HG22 . 30677 1 123 . 1 1 10 10 THR HG23 H 1 1.17 0.02 . 1 . . . . A 10 THR HG23 . 30677 1 124 . 1 1 10 10 THR C C 13 174.1 0.2 . 1 . . . . A 10 THR C . 30677 1 125 . 1 1 10 10 THR CA C 13 62.4 0.2 . 1 . . . . A 10 THR CA . 30677 1 126 . 1 1 10 10 THR CB C 13 71.9 0.2 . 1 . . . . A 10 THR CB . 30677 1 127 . 1 1 10 10 THR CG2 C 13 21.7 0.2 . 1 . . . . A 10 THR CG2 . 30677 1 128 . 1 1 10 10 THR N N 15 116.7 0.2 . 1 . . . . A 10 THR N . 30677 1 129 . 1 1 11 11 SER H H 1 9.28 0.02 . 1 . . . . A 11 SER H . 30677 1 130 . 1 1 11 11 SER HA H 1 5.60 0.02 . 1 . . . . A 11 SER HA . 30677 1 131 . 1 1 11 11 SER HB2 H 1 3.65 0.02 . 2 . . . . A 11 SER HB2 . 30677 1 132 . 1 1 11 11 SER HB3 H 1 3.56 0.02 . 2 . . . . A 11 SER HB3 . 30677 1 133 . 1 1 11 11 SER C C 13 173.4 0.2 . 1 . . . . A 11 SER C . 30677 1 134 . 1 1 11 11 SER CA C 13 58.0 0.2 . 1 . . . . A 11 SER CA . 30677 1 135 . 1 1 11 11 SER CB C 13 65.4 0.2 . 1 . . . . A 11 SER CB . 30677 1 136 . 1 1 11 11 SER N N 15 124.2 0.2 . 1 . . . . A 11 SER N . 30677 1 137 . 1 1 12 12 THR H H 1 8.37 0.02 . 1 . . . . A 12 THR H . 30677 1 138 . 1 1 12 12 THR HA H 1 4.54 0.02 . 1 . . . . A 12 THR HA . 30677 1 139 . 1 1 12 12 THR HB H 1 4.12 0.02 . 1 . . . . A 12 THR HB . 30677 1 140 . 1 1 12 12 THR HG21 H 1 1.24 0.02 . 1 . . . . A 12 THR HG21 . 30677 1 141 . 1 1 12 12 THR HG22 H 1 1.24 0.02 . 1 . . . . A 12 THR HG22 . 30677 1 142 . 1 1 12 12 THR HG23 H 1 1.24 0.02 . 1 . . . . A 12 THR HG23 . 30677 1 143 . 1 1 12 12 THR C C 13 175.9 0.2 . 1 . . . . A 12 THR C . 30677 1 144 . 1 1 12 12 THR CA C 13 60.3 0.2 . 1 . . . . A 12 THR CA . 30677 1 145 . 1 1 12 12 THR CB C 13 70.8 0.2 . 1 . . . . A 12 THR CB . 30677 1 146 . 1 1 12 12 THR CG2 C 13 21.5 0.2 . 1 . . . . A 12 THR CG2 . 30677 1 147 . 1 1 12 12 THR N N 15 115.6 0.2 . 1 . . . . A 12 THR N . 30677 1 148 . 1 1 13 13 GLY H H 1 9.33 0.02 . 1 . . . . A 13 GLY H . 30677 1 149 . 1 1 13 13 GLY HA2 H 1 3.58 0.02 . 2 . . . . A 13 GLY HA2 . 30677 1 150 . 1 1 13 13 GLY HA3 H 1 3.58 0.02 . 2 . . . . A 13 GLY HA3 . 30677 1 151 . 1 1 13 13 GLY C C 13 175.1 0.2 . 1 . . . . A 13 GLY C . 30677 1 152 . 1 1 13 13 GLY CA C 13 47.3 0.2 . 1 . . . . A 13 GLY CA . 30677 1 153 . 1 1 13 13 GLY N N 15 116.2 0.2 . 1 . . . . A 13 GLY N . 30677 1 154 . 1 1 14 14 GLY H H 1 7.78 0.02 . 1 . . . . A 14 GLY H . 30677 1 155 . 1 1 14 14 GLY C C 13 173.3 0.2 . 1 . . . . A 14 GLY C . 30677 1 156 . 1 1 14 14 GLY CA C 13 45.2 0.2 . 1 . . . . A 14 GLY CA . 30677 1 157 . 1 1 14 14 GLY N N 15 110.7 0.2 . 1 . . . . A 14 GLY N . 30677 1 158 . 1 1 15 15 ARG H H 1 8.95 0.02 . 1 . . . . A 15 ARG H . 30677 1 159 . 1 1 15 15 ARG C C 13 175.8 0.2 . 1 . . . . A 15 ARG C . 30677 1 160 . 1 1 15 15 ARG CA C 13 58.9 0.2 . 1 . . . . A 15 ARG CA . 30677 1 161 . 1 1 15 15 ARG CB C 13 28.9 0.2 . 1 . . . . A 15 ARG CB . 30677 1 162 . 1 1 15 15 ARG N N 15 122.9 0.2 . 1 . . . . A 15 ARG N . 30677 1 163 . 1 1 16 16 ASP H H 1 7.15 0.02 . 1 . . . . A 16 ASP H . 30677 1 164 . 1 1 16 16 ASP HA H 1 5.24 0.02 . 1 . . . . A 16 ASP HA . 30677 1 165 . 1 1 16 16 ASP HB2 H 1 2.58 0.02 . 2 . . . . A 16 ASP HB2 . 30677 1 166 . 1 1 16 16 ASP HB3 H 1 2.42 0.02 . 2 . . . . A 16 ASP HB3 . 30677 1 167 . 1 1 16 16 ASP C C 13 175.3 0.2 . 1 . . . . A 16 ASP C . 30677 1 168 . 1 1 16 16 ASP CA C 13 53.8 0.2 . 1 . . . . A 16 ASP CA . 30677 1 169 . 1 1 16 16 ASP CB C 13 42.4 0.2 . 1 . . . . A 16 ASP CB . 30677 1 170 . 1 1 16 16 ASP N N 15 116.3 0.2 . 1 . . . . A 16 ASP N . 30677 1 171 . 1 1 17 17 GLY H H 1 8.29 0.02 . 1 . . . . A 17 GLY H . 30677 1 172 . 1 1 17 17 GLY HA2 H 1 4.13 0.02 . 2 . . . . A 17 GLY HA2 . 30677 1 173 . 1 1 17 17 GLY HA3 H 1 4.05 0.02 . 2 . . . . A 17 GLY HA3 . 30677 1 174 . 1 1 17 17 GLY C C 13 172.5 0.2 . 1 . . . . A 17 GLY C . 30677 1 175 . 1 1 17 17 GLY CA C 13 44.6 0.2 . 1 . . . . A 17 GLY CA . 30677 1 176 . 1 1 17 17 GLY N N 15 110.3 0.2 . 1 . . . . A 17 GLY N . 30677 1 177 . 1 1 18 18 ARG H H 1 8.66 0.02 . 1 . . . . A 18 ARG H . 30677 1 178 . 1 1 18 18 ARG HA H 1 5.16 0.02 . 1 . . . . A 18 ARG HA . 30677 1 179 . 1 1 18 18 ARG HB2 H 1 1.72 0.02 . 2 . . . . A 18 ARG HB2 . 30677 1 180 . 1 1 18 18 ARG HB3 H 1 1.72 0.02 . 2 . . . . A 18 ARG HB3 . 30677 1 181 . 1 1 18 18 ARG HG2 H 1 1.58 0.02 . 2 . . . . A 18 ARG HG2 . 30677 1 182 . 1 1 18 18 ARG HG3 H 1 1.47 0.02 . 2 . . . . A 18 ARG HG3 . 30677 1 183 . 1 1 18 18 ARG HD2 H 1 3.14 0.02 . 2 . . . . A 18 ARG HD2 . 30677 1 184 . 1 1 18 18 ARG HD3 H 1 3.01 0.02 . 2 . . . . A 18 ARG HD3 . 30677 1 185 . 1 1 18 18 ARG C C 13 173.6 0.2 . 1 . . . . A 18 ARG C . 30677 1 186 . 1 1 18 18 ARG CA C 13 55.3 0.2 . 1 . . . . A 18 ARG CA . 30677 1 187 . 1 1 18 18 ARG CB C 13 34.6 0.2 . 1 . . . . A 18 ARG CB . 30677 1 188 . 1 1 18 18 ARG CG C 13 26.8 0.2 . 1 . . . . A 18 ARG CG . 30677 1 189 . 1 1 18 18 ARG CD C 13 43.7 0.2 . 1 . . . . A 18 ARG CD . 30677 1 190 . 1 1 18 18 ARG N N 15 127.3 0.2 . 1 . . . . A 18 ARG N . 30677 1 191 . 1 1 19 19 ALA H H 1 8.73 0.02 . 1 . . . . A 19 ALA H . 30677 1 192 . 1 1 19 19 ALA HA H 1 5.46 0.02 . 1 . . . . A 19 ALA HA . 30677 1 193 . 1 1 19 19 ALA HB1 H 1 1.16 0.02 . 1 . . . . A 19 ALA HB1 . 30677 1 194 . 1 1 19 19 ALA HB2 H 1 1.16 0.02 . 1 . . . . A 19 ALA HB2 . 30677 1 195 . 1 1 19 19 ALA HB3 H 1 1.16 0.02 . 1 . . . . A 19 ALA HB3 . 30677 1 196 . 1 1 19 19 ALA C C 13 176.0 0.2 . 1 . . . . A 19 ALA C . 30677 1 197 . 1 1 19 19 ALA CA C 13 51.5 0.2 . 1 . . . . A 19 ALA CA . 30677 1 198 . 1 1 19 19 ALA CB C 13 22.7 0.2 . 1 . . . . A 19 ALA CB . 30677 1 199 . 1 1 19 19 ALA N N 15 127.1 0.2 . 1 . . . . A 19 ALA N . 30677 1 200 . 1 1 20 20 THR H H 1 8.09 0.02 . 1 . . . . A 20 THR H . 30677 1 201 . 1 1 20 20 THR HA H 1 5.43 0.02 . 1 . . . . A 20 THR HA . 30677 1 202 . 1 1 20 20 THR HB H 1 3.77 0.02 . 1 . . . . A 20 THR HB . 30677 1 203 . 1 1 20 20 THR HG21 H 1 1.50 0.02 . 1 . . . . A 20 THR HG21 . 30677 1 204 . 1 1 20 20 THR HG22 H 1 1.50 0.02 . 1 . . . . A 20 THR HG22 . 30677 1 205 . 1 1 20 20 THR HG23 H 1 1.50 0.02 . 1 . . . . A 20 THR HG23 . 30677 1 206 . 1 1 20 20 THR C C 13 175.9 0.2 . 1 . . . . A 20 THR C . 30677 1 207 . 1 1 20 20 THR CA C 13 60.5 0.2 . 1 . . . . A 20 THR CA . 30677 1 208 . 1 1 20 20 THR CB C 13 72.5 0.2 . 1 . . . . A 20 THR CB . 30677 1 209 . 1 1 20 20 THR CG2 C 13 21.6 0.2 . 1 . . . . A 20 THR CG2 . 30677 1 210 . 1 1 20 20 THR N N 15 114.4 0.2 . 1 . . . . A 20 THR N . 30677 1 211 . 1 1 21 21 SER H H 1 10.01 0.02 . 1 . . . . A 21 SER H . 30677 1 212 . 1 1 21 21 SER HA H 1 5.18 0.02 . 1 . . . . A 21 SER HA . 30677 1 213 . 1 1 21 21 SER HB2 H 1 4.48 0.02 . 2 . . . . A 21 SER HB2 . 30677 1 214 . 1 1 21 21 SER HB3 H 1 3.84 0.02 . 2 . . . . A 21 SER HB3 . 30677 1 215 . 1 1 21 21 SER C C 13 177.0 0.2 . 1 . . . . A 21 SER C . 30677 1 216 . 1 1 21 21 SER CA C 13 58.6 0.2 . 1 . . . . A 21 SER CA . 30677 1 217 . 1 1 21 21 SER CB C 13 64.1 0.2 . 1 . . . . A 21 SER CB . 30677 1 218 . 1 1 21 21 SER N N 15 124.0 0.2 . 1 . . . . A 21 SER N . 30677 1 219 . 1 1 22 22 HIS H H 1 8.70 0.02 . 1 . . . . A 22 HIS H . 30677 1 220 . 1 1 22 22 HIS HA H 1 4.52 0.02 . 1 . . . . A 22 HIS HA . 30677 1 221 . 1 1 22 22 HIS HB2 H 1 3.22 0.02 . 2 . . . . A 22 HIS HB2 . 30677 1 222 . 1 1 22 22 HIS HB3 H 1 3.22 0.02 . 2 . . . . A 22 HIS HB3 . 30677 1 223 . 1 1 22 22 HIS C C 13 175.3 0.2 . 1 . . . . A 22 HIS C . 30677 1 224 . 1 1 22 22 HIS CA C 13 58.5 0.2 . 1 . . . . A 22 HIS CA . 30677 1 225 . 1 1 22 22 HIS CB C 13 29.6 0.2 . 1 . . . . A 22 HIS CB . 30677 1 226 . 1 1 22 22 HIS N N 15 122.7 0.2 . 1 . . . . A 22 HIS N . 30677 1 227 . 1 1 23 23 ASP H H 1 7.78 0.02 . 1 . . . . A 23 ASP H . 30677 1 228 . 1 1 23 23 ASP HA H 1 4.59 0.02 . 1 . . . . A 23 ASP HA . 30677 1 229 . 1 1 23 23 ASP HB2 H 1 3.18 0.02 . 2 . . . . A 23 ASP HB2 . 30677 1 230 . 1 1 23 23 ASP HB3 H 1 2.52 0.02 . 2 . . . . A 23 ASP HB3 . 30677 1 231 . 1 1 23 23 ASP C C 13 176.1 0.2 . 1 . . . . A 23 ASP C . 30677 1 232 . 1 1 23 23 ASP CA C 13 52.5 0.2 . 1 . . . . A 23 ASP CA . 30677 1 233 . 1 1 23 23 ASP CB C 13 40.9 0.2 . 1 . . . . A 23 ASP CB . 30677 1 234 . 1 1 23 23 ASP N N 15 116.6 0.2 . 1 . . . . A 23 ASP N . 30677 1 235 . 1 1 24 24 GLN H H 1 8.00 0.02 . 1 . . . . A 24 GLN H . 30677 1 236 . 1 1 24 24 GLN HA H 1 3.58 0.02 . 1 . . . . A 24 GLN HA . 30677 1 237 . 1 1 24 24 GLN HB2 H 1 2.39 0.02 . 2 . . . . A 24 GLN HB2 . 30677 1 238 . 1 1 24 24 GLN HB3 H 1 2.31 0.02 . 2 . . . . A 24 GLN HB3 . 30677 1 239 . 1 1 24 24 GLN HG2 H 1 2.29 0.02 . 2 . . . . A 24 GLN HG2 . 30677 1 240 . 1 1 24 24 GLN HG3 H 1 2.29 0.02 . 2 . . . . A 24 GLN HG3 . 30677 1 241 . 1 1 24 24 GLN HE21 H 1 7.42 0.02 . 2 . . . . A 24 GLN HE21 . 30677 1 242 . 1 1 24 24 GLN HE22 H 1 6.71 0.02 . 2 . . . . A 24 GLN HE22 . 30677 1 243 . 1 1 24 24 GLN C C 13 174.9 0.2 . 1 . . . . A 24 GLN C . 30677 1 244 . 1 1 24 24 GLN CA C 13 58.2 0.2 . 1 . . . . A 24 GLN CA . 30677 1 245 . 1 1 24 24 GLN CB C 13 26.6 0.2 . 1 . . . . A 24 GLN CB . 30677 1 246 . 1 1 24 24 GLN CG C 13 35.1 0.2 . 1 . . . . A 24 GLN CG . 30677 1 247 . 1 1 24 24 GLN N N 15 112.4 0.2 . 1 . . . . A 24 GLN N . 30677 1 248 . 1 1 24 24 GLN NE2 N 15 112.1 0.2 . 1 . . . . A 24 GLN NE2 . 30677 1 249 . 1 1 25 25 LYS H H 1 7.81 0.02 . 1 . . . . A 25 LYS H . 30677 1 250 . 1 1 25 25 LYS HA H 1 4.03 0.02 . 1 . . . . A 25 LYS HA . 30677 1 251 . 1 1 25 25 LYS HG2 H 1 1.31 0.02 . 2 . . . . A 25 LYS HG2 . 30677 1 252 . 1 1 25 25 LYS HG3 H 1 1.31 0.02 . 2 . . . . A 25 LYS HG3 . 30677 1 253 . 1 1 25 25 LYS HE2 H 1 3.04 0.02 . 2 . . . . A 25 LYS HE2 . 30677 1 254 . 1 1 25 25 LYS HE3 H 1 2.99 0.02 . 2 . . . . A 25 LYS HE3 . 30677 1 255 . 1 1 25 25 LYS C C 13 175.8 0.2 . 1 . . . . A 25 LYS C . 30677 1 256 . 1 1 25 25 LYS CA C 13 59.0 0.2 . 1 . . . . A 25 LYS CA . 30677 1 257 . 1 1 25 25 LYS CB C 13 32.0 0.2 . 1 . . . . A 25 LYS CB . 30677 1 258 . 1 1 25 25 LYS CG C 13 26.9 0.2 . 1 . . . . A 25 LYS CG . 30677 1 259 . 1 1 25 25 LYS CE C 13 43.1 0.2 . 1 . . . . A 25 LYS CE . 30677 1 260 . 1 1 25 25 LYS N N 15 118.6 0.2 . 1 . . . . A 25 LYS N . 30677 1 261 . 1 1 26 26 LEU H H 1 7.91 0.02 . 1 . . . . A 26 LEU H . 30677 1 262 . 1 1 26 26 LEU HA H 1 4.58 0.02 . 1 . . . . A 26 LEU HA . 30677 1 263 . 1 1 26 26 LEU HG H 1 1.39 0.02 . 1 . . . . A 26 LEU HG . 30677 1 264 . 1 1 26 26 LEU HD11 H 1 0.93 0.02 . 1 . . . . A 26 LEU HD11 . 30677 1 265 . 1 1 26 26 LEU HD12 H 1 0.93 0.02 . 1 . . . . A 26 LEU HD12 . 30677 1 266 . 1 1 26 26 LEU HD13 H 1 0.93 0.02 . 1 . . . . A 26 LEU HD13 . 30677 1 267 . 1 1 26 26 LEU HD21 H 1 0.75 0.02 . 1 . . . . A 26 LEU HD21 . 30677 1 268 . 1 1 26 26 LEU HD22 H 1 0.75 0.02 . 1 . . . . A 26 LEU HD22 . 30677 1 269 . 1 1 26 26 LEU HD23 H 1 0.75 0.02 . 1 . . . . A 26 LEU HD23 . 30677 1 270 . 1 1 26 26 LEU C C 13 174.4 0.2 . 1 . . . . A 26 LEU C . 30677 1 271 . 1 1 26 26 LEU CA C 13 53.5 0.2 . 1 . . . . A 26 LEU CA . 30677 1 272 . 1 1 26 26 LEU CB C 13 44.2 0.2 . 1 . . . . A 26 LEU CB . 30677 1 273 . 1 1 26 26 LEU CG C 13 27.7 0.2 . 1 . . . . A 26 LEU CG . 30677 1 274 . 1 1 26 26 LEU CD1 C 13 23.9 0.2 . 1 . . . . A 26 LEU CD1 . 30677 1 275 . 1 1 26 26 LEU CD2 C 13 27.9 0.2 . 1 . . . . A 26 LEU CD2 . 30677 1 276 . 1 1 26 26 LEU N N 15 120.1 0.2 . 1 . . . . A 26 LEU N . 30677 1 277 . 1 1 27 27 ASP H H 1 8.73 0.02 . 1 . . . . A 27 ASP H . 30677 1 278 . 1 1 27 27 ASP HA H 1 5.29 0.02 . 1 . . . . A 27 ASP HA . 30677 1 279 . 1 1 27 27 ASP HB2 H 1 2.82 0.02 . 2 . . . . A 27 ASP HB2 . 30677 1 280 . 1 1 27 27 ASP HB3 H 1 2.47 0.02 . 2 . . . . A 27 ASP HB3 . 30677 1 281 . 1 1 27 27 ASP C C 13 175.1 0.2 . 1 . . . . A 27 ASP C . 30677 1 282 . 1 1 27 27 ASP CA C 13 54.3 0.2 . 1 . . . . A 27 ASP CA . 30677 1 283 . 1 1 27 27 ASP CB C 13 41.7 0.2 . 1 . . . . A 27 ASP CB . 30677 1 284 . 1 1 27 27 ASP N N 15 128.3 0.2 . 1 . . . . A 27 ASP N . 30677 1 285 . 1 1 28 28 VAL H H 1 8.96 0.02 . 1 . . . . A 28 VAL H . 30677 1 286 . 1 1 28 28 VAL HA H 1 4.84 0.02 . 1 . . . . A 28 VAL HA . 30677 1 287 . 1 1 28 28 VAL HB H 1 2.07 0.02 . 1 . . . . A 28 VAL HB . 30677 1 288 . 1 1 28 28 VAL HG11 H 1 0.86 0.02 . 1 . . . . A 28 VAL HG11 . 30677 1 289 . 1 1 28 28 VAL HG12 H 1 0.86 0.02 . 1 . . . . A 28 VAL HG12 . 30677 1 290 . 1 1 28 28 VAL HG13 H 1 0.86 0.02 . 1 . . . . A 28 VAL HG13 . 30677 1 291 . 1 1 28 28 VAL HG21 H 1 0.78 0.02 . 1 . . . . A 28 VAL HG21 . 30677 1 292 . 1 1 28 28 VAL HG22 H 1 0.78 0.02 . 1 . . . . A 28 VAL HG22 . 30677 1 293 . 1 1 28 28 VAL HG23 H 1 0.78 0.02 . 1 . . . . A 28 VAL HG23 . 30677 1 294 . 1 1 28 28 VAL CA C 13 58.5 0.2 . 1 . . . . A 28 VAL CA . 30677 1 295 . 1 1 28 28 VAL CB C 13 35.3 0.2 . 1 . . . . A 28 VAL CB . 30677 1 296 . 1 1 28 28 VAL CG1 C 13 22.7 0.2 . 1 . . . . A 28 VAL CG1 . 30677 1 297 . 1 1 28 28 VAL CG2 C 13 18.3 0.2 . 1 . . . . A 28 VAL CG2 . 30677 1 298 . 1 1 28 28 VAL N N 15 115.7 0.2 . 1 . . . . A 28 VAL N . 30677 1 299 . 1 1 29 29 LYS H H 1 8.51 0.02 . 1 . . . . A 29 LYS H . 30677 1 300 . 1 1 29 29 LYS HA H 1 4.49 0.02 . 1 . . . . A 29 LYS HA . 30677 1 301 . 1 1 29 29 LYS HB2 H 1 1.87 0.02 . 2 . . . . A 29 LYS HB2 . 30677 1 302 . 1 1 29 29 LYS HB3 H 1 1.76 0.02 . 2 . . . . A 29 LYS HB3 . 30677 1 303 . 1 1 29 29 LYS HG2 H 1 1.52 0.02 . 2 . . . . A 29 LYS HG2 . 30677 1 304 . 1 1 29 29 LYS HG3 H 1 1.37 0.02 . 2 . . . . A 29 LYS HG3 . 30677 1 305 . 1 1 29 29 LYS HD2 H 1 1.70 0.02 . 2 . . . . A 29 LYS HD2 . 30677 1 306 . 1 1 29 29 LYS HD3 H 1 1.64 0.02 . 2 . . . . A 29 LYS HD3 . 30677 1 307 . 1 1 29 29 LYS HE2 H 1 3.01 0.02 . 2 . . . . A 29 LYS HE2 . 30677 1 308 . 1 1 29 29 LYS HE3 H 1 3.01 0.02 . 2 . . . . A 29 LYS HE3 . 30677 1 309 . 1 1 29 29 LYS C C 13 175.1 0.2 . 1 . . . . A 29 LYS C . 30677 1 310 . 1 1 29 29 LYS CA C 13 55.3 0.2 . 1 . . . . A 29 LYS CA . 30677 1 311 . 1 1 29 29 LYS CB C 13 33.7 0.2 . 1 . . . . A 29 LYS CB . 30677 1 312 . 1 1 29 29 LYS CG C 13 25.4 0.2 . 1 . . . . A 29 LYS CG . 30677 1 313 . 1 1 29 29 LYS CD C 13 29.0 0.2 . 1 . . . . A 29 LYS CD . 30677 1 314 . 1 1 29 29 LYS N N 15 123.1 0.2 . 1 . . . . A 29 LYS N . 30677 1 315 . 1 1 30 30 LEU H H 1 8.72 0.02 . 1 . . . . A 30 LEU H . 30677 1 316 . 1 1 30 30 LEU HA H 1 5.18 0.02 . 1 . . . . A 30 LEU HA . 30677 1 317 . 1 1 30 30 LEU HG H 1 1.30 0.02 . 1 . . . . A 30 LEU HG . 30677 1 318 . 1 1 30 30 LEU HD11 H 1 0.65 0.02 . 1 . . . . A 30 LEU HD11 . 30677 1 319 . 1 1 30 30 LEU HD12 H 1 0.65 0.02 . 1 . . . . A 30 LEU HD12 . 30677 1 320 . 1 1 30 30 LEU HD13 H 1 0.65 0.02 . 1 . . . . A 30 LEU HD13 . 30677 1 321 . 1 1 30 30 LEU HD21 H 1 0.49 0.02 . 1 . . . . A 30 LEU HD21 . 30677 1 322 . 1 1 30 30 LEU HD22 H 1 0.49 0.02 . 1 . . . . A 30 LEU HD22 . 30677 1 323 . 1 1 30 30 LEU HD23 H 1 0.49 0.02 . 1 . . . . A 30 LEU HD23 . 30677 1 324 . 1 1 30 30 LEU C C 13 176.3 0.2 . 1 . . . . A 30 LEU C . 30677 1 325 . 1 1 30 30 LEU CA C 13 52.5 0.2 . 1 . . . . A 30 LEU CA . 30677 1 326 . 1 1 30 30 LEU CG C 13 28.5 0.2 . 1 . . . . A 30 LEU CG . 30677 1 327 . 1 1 30 30 LEU CD1 C 13 27.1 0.2 . 1 . . . . A 30 LEU CD1 . 30677 1 328 . 1 1 30 30 LEU CD2 C 13 26.2 0.2 . 1 . . . . A 30 LEU CD2 . 30677 1 329 . 1 1 30 30 LEU N N 15 126.8 0.2 . 1 . . . . A 30 LEU N . 30677 1 330 . 1 1 31 31 SER H H 1 8.81 0.02 . 1 . . . . A 31 SER H . 30677 1 331 . 1 1 31 31 SER HA H 1 5.12 0.02 . 1 . . . . A 31 SER HA . 30677 1 332 . 1 1 31 31 SER HB2 H 1 3.66 0.02 . 2 . . . . A 31 SER HB2 . 30677 1 333 . 1 1 31 31 SER HB3 H 1 3.24 0.02 . 2 . . . . A 31 SER HB3 . 30677 1 334 . 1 1 31 31 SER C C 13 174.1 0.2 . 1 . . . . A 31 SER C . 30677 1 335 . 1 1 31 31 SER CA C 13 56.9 0.2 . 1 . . . . A 31 SER CA . 30677 1 336 . 1 1 31 31 SER CB C 13 66.2 0.2 . 1 . . . . A 31 SER CB . 30677 1 337 . 1 1 31 31 SER N N 15 116.9 0.2 . 1 . . . . A 31 SER N . 30677 1 338 . 1 1 32 32 ALA H H 1 8.93 0.02 . 1 . . . . A 32 ALA H . 30677 1 339 . 1 1 32 32 ALA HA H 1 4.70 0.02 . 1 . . . . A 32 ALA HA . 30677 1 340 . 1 1 32 32 ALA HB1 H 1 1.15 0.02 . 1 . . . . A 32 ALA HB1 . 30677 1 341 . 1 1 32 32 ALA HB2 H 1 1.15 0.02 . 1 . . . . A 32 ALA HB2 . 30677 1 342 . 1 1 32 32 ALA HB3 H 1 1.15 0.02 . 1 . . . . A 32 ALA HB3 . 30677 1 343 . 1 1 32 32 ALA CA C 13 50.1 0.2 . 1 . . . . A 32 ALA CA . 30677 1 344 . 1 1 32 32 ALA CB C 13 17.8 0.2 . 1 . . . . A 32 ALA CB . 30677 1 345 . 1 1 32 32 ALA N N 15 132.8 0.2 . 1 . . . . A 32 ALA N . 30677 1 346 . 1 1 34 34 ARG H H 1 9.23 0.02 . 1 . . . . A 34 ARG H . 30677 1 347 . 1 1 34 34 ARG HA H 1 4.21 0.02 . 1 . . . . A 34 ARG HA . 30677 1 348 . 1 1 34 34 ARG HB2 H 1 1.78 0.02 . 2 . . . . A 34 ARG HB2 . 30677 1 349 . 1 1 34 34 ARG HB3 H 1 1.74 0.02 . 2 . . . . A 34 ARG HB3 . 30677 1 350 . 1 1 34 34 ARG HG2 H 1 1.61 0.02 . 2 . . . . A 34 ARG HG2 . 30677 1 351 . 1 1 34 34 ARG HG3 H 1 1.61 0.02 . 2 . . . . A 34 ARG HG3 . 30677 1 352 . 1 1 34 34 ARG HD2 H 1 3.23 0.02 . 2 . . . . A 34 ARG HD2 . 30677 1 353 . 1 1 34 34 ARG HD3 H 1 3.23 0.02 . 2 . . . . A 34 ARG HD3 . 30677 1 354 . 1 1 34 34 ARG CA C 13 59.0 0.2 . 1 . . . . A 34 ARG CA . 30677 1 355 . 1 1 34 34 ARG CB C 13 29.5 0.2 . 1 . . . . A 34 ARG CB . 30677 1 356 . 1 1 34 34 ARG CG C 13 27.7 0.2 . 1 . . . . A 34 ARG CG . 30677 1 357 . 1 1 34 34 ARG CD C 13 43.2 0.2 . 1 . . . . A 34 ARG CD . 30677 1 358 . 1 1 34 34 ARG N N 15 125.3 0.2 . 1 . . . . A 34 ARG N . 30677 1 359 . 1 1 35 35 GLU H H 1 10.82 0.02 . 1 . . . . A 35 GLU H . 30677 1 360 . 1 1 35 35 GLU HA H 1 4.06 0.02 . 1 . . . . A 35 GLU HA . 30677 1 361 . 1 1 35 35 GLU HB2 H 1 2.36 0.02 . 2 . . . . A 35 GLU HB2 . 30677 1 362 . 1 1 35 35 GLU HB3 H 1 1.85 0.02 . 2 . . . . A 35 GLU HB3 . 30677 1 363 . 1 1 35 35 GLU HG2 H 1 3.07 0.02 . 2 . . . . A 35 GLU HG2 . 30677 1 364 . 1 1 35 35 GLU HG3 H 1 2.58 0.02 . 2 . . . . A 35 GLU HG3 . 30677 1 365 . 1 1 35 35 GLU C C 13 177.1 0.2 . 1 . . . . A 35 GLU C . 30677 1 366 . 1 1 35 35 GLU CA C 13 60.7 0.2 . 1 . . . . A 35 GLU CA . 30677 1 367 . 1 1 35 35 GLU CB C 13 30.2 0.2 . 1 . . . . A 35 GLU CB . 30677 1 368 . 1 1 35 35 GLU CG C 13 38.3 0.2 . 1 . . . . A 35 GLU CG . 30677 1 369 . 1 1 35 35 GLU N N 15 120.7 0.2 . 1 . . . . A 35 GLU N . 30677 1 370 . 1 1 36 36 LEU H H 1 7.14 0.02 . 1 . . . . A 36 LEU H . 30677 1 371 . 1 1 36 36 LEU HA H 1 4.58 0.02 . 1 . . . . A 36 LEU HA . 30677 1 372 . 1 1 36 36 LEU HB2 H 1 1.15 0.02 . 1 . . . . A 36 LEU HB2 . 30677 1 373 . 1 1 36 36 LEU HB3 H 1 1.15 0.02 . 1 . . . . A 36 LEU HB3 . 30677 1 374 . 1 1 36 36 LEU HG H 1 1.21 0.02 . 1 . . . . A 36 LEU HG . 30677 1 375 . 1 1 36 36 LEU HD11 H 1 0.66 0.02 . 1 . . . . A 36 LEU HD11 . 30677 1 376 . 1 1 36 36 LEU HD12 H 1 0.66 0.02 . 1 . . . . A 36 LEU HD12 . 30677 1 377 . 1 1 36 36 LEU HD13 H 1 0.66 0.02 . 1 . . . . A 36 LEU HD13 . 30677 1 378 . 1 1 36 36 LEU HD21 H 1 0.71 0.02 . 1 . . . . A 36 LEU HD21 . 30677 1 379 . 1 1 36 36 LEU HD22 H 1 0.71 0.02 . 1 . . . . A 36 LEU HD22 . 30677 1 380 . 1 1 36 36 LEU HD23 H 1 0.71 0.02 . 1 . . . . A 36 LEU HD23 . 30677 1 381 . 1 1 36 36 LEU C C 13 176.4 0.2 . 1 . . . . A 36 LEU C . 30677 1 382 . 1 1 36 36 LEU CA C 13 53.1 0.2 . 1 . . . . A 36 LEU CA . 30677 1 383 . 1 1 36 36 LEU CB C 13 41.6 0.2 . 1 . . . . A 36 LEU CB . 30677 1 384 . 1 1 36 36 LEU CG C 13 27.6 0.2 . 1 . . . . A 36 LEU CG . 30677 1 385 . 1 1 36 36 LEU CD1 C 13 25.7 0.2 . 2 . . . . A 36 LEU CD1 . 30677 1 386 . 1 1 36 36 LEU CD2 C 13 23.3 0.2 . 2 . . . . A 36 LEU CD2 . 30677 1 387 . 1 1 36 36 LEU N N 15 114.9 0.2 . 1 . . . . A 36 LEU N . 30677 1 388 . 1 1 37 37 GLY H H 1 7.95 0.02 . 1 . . . . A 37 GLY H . 30677 1 389 . 1 1 37 37 GLY HA2 H 1 4.23 0.02 . 2 . . . . A 37 GLY HA2 . 30677 1 390 . 1 1 37 37 GLY HA3 H 1 3.76 0.02 . 2 . . . . A 37 GLY HA3 . 30677 1 391 . 1 1 37 37 GLY C C 13 174.8 0.2 . 1 . . . . A 37 GLY C . 30677 1 392 . 1 1 37 37 GLY CA C 13 45.3 0.2 . 1 . . . . A 37 GLY CA . 30677 1 393 . 1 1 37 37 GLY N N 15 107.0 0.2 . 1 . . . . A 37 GLY N . 30677 1 394 . 1 1 38 38 GLY H H 1 7.62 0.02 . 1 . . . . A 38 GLY H . 30677 1 395 . 1 1 38 38 GLY HA2 H 1 4.33 0.02 . 2 . . . . A 38 GLY HA2 . 30677 1 396 . 1 1 38 38 GLY HA3 H 1 3.61 0.02 . 2 . . . . A 38 GLY HA3 . 30677 1 397 . 1 1 38 38 GLY CA C 13 44.1 0.2 . 1 . . . . A 38 GLY CA . 30677 1 398 . 1 1 38 38 GLY N N 15 107.8 0.2 . 1 . . . . A 38 GLY N . 30677 1 399 . 1 1 39 39 ALA H H 1 8.46 0.02 . 1 . . . . A 39 ALA H . 30677 1 400 . 1 1 39 39 ALA HA H 1 4.36 0.02 . 1 . . . . A 39 ALA HA . 30677 1 401 . 1 1 39 39 ALA HB1 H 1 1.42 0.02 . 1 . . . . A 39 ALA HB1 . 30677 1 402 . 1 1 39 39 ALA HB2 H 1 1.42 0.02 . 1 . . . . A 39 ALA HB2 . 30677 1 403 . 1 1 39 39 ALA HB3 H 1 1.42 0.02 . 1 . . . . A 39 ALA HB3 . 30677 1 404 . 1 1 39 39 ALA C C 13 178.9 0.2 . 1 . . . . A 39 ALA C . 30677 1 405 . 1 1 39 39 ALA CA C 13 52.4 0.2 . 1 . . . . A 39 ALA CA . 30677 1 406 . 1 1 39 39 ALA CB C 13 19.3 0.2 . 1 . . . . A 39 ALA CB . 30677 1 407 . 1 1 39 39 ALA N N 15 120.3 0.2 . 1 . . . . A 39 ALA N . 30677 1 408 . 1 1 40 40 GLY H H 1 8.32 0.02 . 1 . . . . A 40 GLY H . 30677 1 409 . 1 1 40 40 GLY HA2 H 1 3.94 0.02 . 2 . . . . A 40 GLY HA2 . 30677 1 410 . 1 1 40 40 GLY HA3 H 1 3.85 0.02 . 2 . . . . A 40 GLY HA3 . 30677 1 411 . 1 1 40 40 GLY C C 13 174.6 0.2 . 1 . . . . A 40 GLY C . 30677 1 412 . 1 1 40 40 GLY CA C 13 46.7 0.2 . 1 . . . . A 40 GLY CA . 30677 1 413 . 1 1 40 40 GLY N N 15 106.8 0.2 . 1 . . . . A 40 GLY N . 30677 1 414 . 1 1 41 41 ALA H H 1 8.18 0.02 . 1 . . . . A 41 ALA H . 30677 1 415 . 1 1 41 41 ALA HA H 1 4.40 0.02 . 1 . . . . A 41 ALA HA . 30677 1 416 . 1 1 41 41 ALA HB1 H 1 1.48 0.02 . 1 . . . . A 41 ALA HB1 . 30677 1 417 . 1 1 41 41 ALA HB2 H 1 1.48 0.02 . 1 . . . . A 41 ALA HB2 . 30677 1 418 . 1 1 41 41 ALA HB3 H 1 1.48 0.02 . 1 . . . . A 41 ALA HB3 . 30677 1 419 . 1 1 41 41 ALA C C 13 176.8 0.2 . 1 . . . . A 41 ALA C . 30677 1 420 . 1 1 41 41 ALA CA C 13 51.9 0.2 . 1 . . . . A 41 ALA CA . 30677 1 421 . 1 1 41 41 ALA CB C 13 18.8 0.2 . 1 . . . . A 41 ALA CB . 30677 1 422 . 1 1 41 41 ALA N N 15 123.0 0.2 . 1 . . . . A 41 ALA N . 30677 1 423 . 1 1 42 42 GLU H H 1 8.55 0.02 . 1 . . . . A 42 GLU H . 30677 1 424 . 1 1 42 42 GLU HA H 1 4.15 0.02 . 1 . . . . A 42 GLU HA . 30677 1 425 . 1 1 42 42 GLU HB2 H 1 2.02 0.02 . 2 . . . . A 42 GLU HB2 . 30677 1 426 . 1 1 42 42 GLU HB3 H 1 2.02 0.02 . 2 . . . . A 42 GLU HB3 . 30677 1 427 . 1 1 42 42 GLU HG2 H 1 2.33 0.02 . 2 . . . . A 42 GLU HG2 . 30677 1 428 . 1 1 42 42 GLU HG3 H 1 2.25 0.02 . 2 . . . . A 42 GLU HG3 . 30677 1 429 . 1 1 42 42 GLU C C 13 176.1 0.2 . 1 . . . . A 42 GLU C . 30677 1 430 . 1 1 42 42 GLU CA C 13 57.9 0.2 . 1 . . . . A 42 GLU CA . 30677 1 431 . 1 1 42 42 GLU CB C 13 29.9 0.2 . 1 . . . . A 42 GLU CB . 30677 1 432 . 1 1 42 42 GLU CG C 13 36.0 0.2 . 1 . . . . A 42 GLU CG . 30677 1 433 . 1 1 42 42 GLU N N 15 118.7 0.2 . 1 . . . . A 42 GLU N . 30677 1 434 . 1 1 43 43 GLY H H 1 8.06 0.02 . 1 . . . . A 43 GLY H . 30677 1 435 . 1 1 43 43 GLY HA2 H 1 3.97 0.02 . 2 . . . . A 43 GLY HA2 . 30677 1 436 . 1 1 43 43 GLY HA3 H 1 3.97 0.02 . 2 . . . . A 43 GLY HA3 . 30677 1 437 . 1 1 43 43 GLY C C 13 173.5 0.2 . 1 . . . . A 43 GLY C . 30677 1 438 . 1 1 43 43 GLY CA C 13 44.5 0.2 . 1 . . . . A 43 GLY CA . 30677 1 439 . 1 1 43 43 GLY N N 15 110.0 0.2 . 1 . . . . A 43 GLY N . 30677 1 440 . 1 1 44 44 THR H H 1 8.34 0.02 . 1 . . . . A 44 THR H . 30677 1 441 . 1 1 44 44 THR HB H 1 4.11 0.02 . 1 . . . . A 44 THR HB . 30677 1 442 . 1 1 44 44 THR HG21 H 1 1.17 0.02 . 1 . . . . A 44 THR HG21 . 30677 1 443 . 1 1 44 44 THR HG22 H 1 1.17 0.02 . 1 . . . . A 44 THR HG22 . 30677 1 444 . 1 1 44 44 THR HG23 H 1 1.17 0.02 . 1 . . . . A 44 THR HG23 . 30677 1 445 . 1 1 44 44 THR C C 13 172.5 0.2 . 1 . . . . A 44 THR C . 30677 1 446 . 1 1 44 44 THR CA C 13 58.4 0.2 . 1 . . . . A 44 THR CA . 30677 1 447 . 1 1 44 44 THR CB C 13 69.3 0.2 . 1 . . . . A 44 THR CB . 30677 1 448 . 1 1 44 44 THR CG2 C 13 18.8 0.2 . 1 . . . . A 44 THR CG2 . 30677 1 449 . 1 1 44 44 THR N N 15 113.4 0.2 . 1 . . . . A 44 THR N . 30677 1 450 . 1 1 45 45 ASN H H 1 9.42 0.02 . 1 . . . . A 45 ASN H . 30677 1 451 . 1 1 45 45 ASN CA C 13 52.5 0.2 . 1 . . . . A 45 ASN CA . 30677 1 452 . 1 1 45 45 ASN CB C 13 39.8 0.2 . 1 . . . . A 45 ASN CB . 30677 1 453 . 1 1 45 45 ASN N N 15 115.0 0.2 . 1 . . . . A 45 ASN N . 30677 1 454 . 1 1 46 46 PRO C C 13 175.2 0.2 . 1 . . . . A 46 PRO C . 30677 1 455 . 1 1 46 46 PRO CA C 13 65.9 0.2 . 1 . . . . A 46 PRO CA . 30677 1 456 . 1 1 46 46 PRO CB C 13 29.4 0.2 . 1 . . . . A 46 PRO CB . 30677 1 457 . 1 1 47 47 GLU H H 1 7.61 0.02 . 1 . . . . A 47 GLU H . 30677 1 458 . 1 1 47 47 GLU HA H 1 4.39 0.02 . 1 . . . . A 47 GLU HA . 30677 1 459 . 1 1 47 47 GLU C C 13 178.0 0.2 . 1 . . . . A 47 GLU C . 30677 1 460 . 1 1 47 47 GLU CA C 13 61.8 0.2 . 1 . . . . A 47 GLU CA . 30677 1 461 . 1 1 47 47 GLU CB C 13 29.4 0.2 . 1 . . . . A 47 GLU CB . 30677 1 462 . 1 1 47 47 GLU N N 15 117.2 0.2 . 1 . . . . A 47 GLU N . 30677 1 463 . 1 1 48 48 GLN H H 1 8.16 0.02 . 1 . . . . A 48 GLN H . 30677 1 464 . 1 1 48 48 GLN HA H 1 3.76 0.02 . 1 . . . . A 48 GLN HA . 30677 1 465 . 1 1 48 48 GLN HB2 H 1 2.26 0.02 . 2 . . . . A 48 GLN HB2 . 30677 1 466 . 1 1 48 48 GLN HB3 H 1 1.88 0.02 . 2 . . . . A 48 GLN HB3 . 30677 1 467 . 1 1 48 48 GLN HG2 H 1 3.02 0.02 . 2 . . . . A 48 GLN HG2 . 30677 1 468 . 1 1 48 48 GLN HG3 H 1 2.48 0.02 . 2 . . . . A 48 GLN HG3 . 30677 1 469 . 1 1 48 48 GLN CA C 13 60.4 0.2 . 1 . . . . A 48 GLN CA . 30677 1 470 . 1 1 48 48 GLN CB C 13 28.6 0.2 . 1 . . . . A 48 GLN CB . 30677 1 471 . 1 1 48 48 GLN CG C 13 36.2 0.2 . 1 . . . . A 48 GLN CG . 30677 1 472 . 1 1 48 48 GLN N N 15 120.5 0.2 . 1 . . . . A 48 GLN N . 30677 1 473 . 1 1 49 49 LEU H H 1 7.85 0.02 . 1 . . . . A 49 LEU H . 30677 1 474 . 1 1 49 49 LEU HD11 H 1 0.57 0.02 . 1 . . . . A 49 LEU HD11 . 30677 1 475 . 1 1 49 49 LEU HD12 H 1 0.57 0.02 . 1 . . . . A 49 LEU HD12 . 30677 1 476 . 1 1 49 49 LEU HD13 H 1 0.57 0.02 . 1 . . . . A 49 LEU HD13 . 30677 1 477 . 1 1 49 49 LEU HD21 H 1 0.90 0.02 . 1 . . . . A 49 LEU HD21 . 30677 1 478 . 1 1 49 49 LEU HD22 H 1 0.90 0.02 . 1 . . . . A 49 LEU HD22 . 30677 1 479 . 1 1 49 49 LEU HD23 H 1 0.90 0.02 . 1 . . . . A 49 LEU HD23 . 30677 1 480 . 1 1 49 49 LEU C C 13 178.0 0.2 . 1 . . . . A 49 LEU C . 30677 1 481 . 1 1 49 49 LEU CA C 13 58.5 0.2 . 1 . . . . A 49 LEU CA . 30677 1 482 . 1 1 49 49 LEU CD1 C 13 25.3 0.2 . 1 . . . . A 49 LEU CD1 . 30677 1 483 . 1 1 49 49 LEU CD2 C 13 25.3 0.2 . 1 . . . . A 49 LEU CD2 . 30677 1 484 . 1 1 49 49 LEU N N 15 119.3 0.2 . 1 . . . . A 49 LEU N . 30677 1 485 . 1 1 50 50 PHE H H 1 8.63 0.02 . 1 . . . . A 50 PHE H . 30677 1 486 . 1 1 50 50 PHE HA H 1 4.30 0.02 . 1 . . . . A 50 PHE HA . 30677 1 487 . 1 1 50 50 PHE HB2 H 1 3.51 0.02 . 2 . . . . A 50 PHE HB2 . 30677 1 488 . 1 1 50 50 PHE HB3 H 1 3.21 0.02 . 2 . . . . A 50 PHE HB3 . 30677 1 489 . 1 1 50 50 PHE HD1 H 1 7.28 0.02 . 3 . . . . A 50 PHE HD1 . 30677 1 490 . 1 1 50 50 PHE HD2 H 1 7.28 0.02 . 3 . . . . A 50 PHE HD2 . 30677 1 491 . 1 1 50 50 PHE HE1 H 1 6.94 0.02 . 3 . . . . A 50 PHE HE1 . 30677 1 492 . 1 1 50 50 PHE HE2 H 1 6.94 0.02 . 3 . . . . A 50 PHE HE2 . 30677 1 493 . 1 1 50 50 PHE C C 13 174.6 0.2 . 1 . . . . A 50 PHE C . 30677 1 494 . 1 1 50 50 PHE CA C 13 60.1 0.2 . 1 . . . . A 50 PHE CA . 30677 1 495 . 1 1 50 50 PHE CB C 13 39.5 0.2 . 1 . . . . A 50 PHE CB . 30677 1 496 . 1 1 50 50 PHE CD1 C 13 132.1 0.2 . 3 . . . . A 50 PHE CD1 . 30677 1 497 . 1 1 50 50 PHE CD2 C 13 132.1 0.2 . 3 . . . . A 50 PHE CD2 . 30677 1 498 . 1 1 50 50 PHE CE1 C 13 130.2 0.2 . 3 . . . . A 50 PHE CE1 . 30677 1 499 . 1 1 50 50 PHE CE2 C 13 130.2 0.2 . 3 . . . . A 50 PHE CE2 . 30677 1 500 . 1 1 50 50 PHE N N 15 118.3 0.2 . 1 . . . . A 50 PHE N . 30677 1 501 . 1 1 51 51 ALA H H 1 8.66 0.02 . 1 . . . . A 51 ALA H . 30677 1 502 . 1 1 51 51 ALA HA H 1 3.55 0.02 . 1 . . . . A 51 ALA HA . 30677 1 503 . 1 1 51 51 ALA HB1 H 1 1.54 0.02 . 1 . . . . A 51 ALA HB1 . 30677 1 504 . 1 1 51 51 ALA HB2 H 1 1.54 0.02 . 1 . . . . A 51 ALA HB2 . 30677 1 505 . 1 1 51 51 ALA HB3 H 1 1.54 0.02 . 1 . . . . A 51 ALA HB3 . 30677 1 506 . 1 1 51 51 ALA C C 13 180.2 0.2 . 1 . . . . A 51 ALA C . 30677 1 507 . 1 1 51 51 ALA CA C 13 55.0 0.2 . 1 . . . . A 51 ALA CA . 30677 1 508 . 1 1 51 51 ALA CB C 13 18.3 0.2 . 1 . . . . A 51 ALA CB . 30677 1 509 . 1 1 51 51 ALA N N 15 120.6 0.2 . 1 . . . . A 51 ALA N . 30677 1 510 . 1 1 52 52 ALA H H 1 8.47 0.02 . 1 . . . . A 52 ALA H . 30677 1 511 . 1 1 52 52 ALA HA H 1 3.44 0.02 . 1 . . . . A 52 ALA HA . 30677 1 512 . 1 1 52 52 ALA HB1 H 1 1.19 0.02 . 1 . . . . A 52 ALA HB1 . 30677 1 513 . 1 1 52 52 ALA HB2 H 1 1.19 0.02 . 1 . . . . A 52 ALA HB2 . 30677 1 514 . 1 1 52 52 ALA HB3 H 1 1.19 0.02 . 1 . . . . A 52 ALA HB3 . 30677 1 515 . 1 1 52 52 ALA C C 13 176.7 0.2 . 1 . . . . A 52 ALA C . 30677 1 516 . 1 1 52 52 ALA CA C 13 55.1 0.02 . 1 . . . . A 52 ALA CA . 30677 1 517 . 1 1 52 52 ALA CB C 13 19.0 0.2 . 1 . . . . A 52 ALA CB . 30677 1 518 . 1 1 52 52 ALA N N 15 121.3 0.2 . 1 . . . . A 52 ALA N . 30677 1 519 . 1 1 53 53 GLY H H 1 8.06 0.02 . 1 . . . . A 53 GLY H . 30677 1 520 . 1 1 53 53 GLY HA2 H 1 3.63 0.02 . 2 . . . . A 53 GLY HA2 . 30677 1 521 . 1 1 53 53 GLY HA3 H 1 3.21 0.02 . 2 . . . . A 53 GLY HA3 . 30677 1 522 . 1 1 53 53 GLY C C 13 173.9 0.2 . 1 . . . . A 53 GLY C . 30677 1 523 . 1 1 53 53 GLY CA C 13 48.2 0.2 . 1 . . . . A 53 GLY CA . 30677 1 524 . 1 1 53 53 GLY N N 15 103.2 0.2 . 1 . . . . A 53 GLY N . 30677 1 525 . 1 1 54 54 TYR H H 1 8.79 0.02 . 1 . . . . A 54 TYR H . 30677 1 526 . 1 1 54 54 TYR HA H 1 3.89 0.02 . 1 . . . . A 54 TYR HA . 30677 1 527 . 1 1 54 54 TYR HB2 H 1 2.38 0.02 . 2 . . . . A 54 TYR HB2 . 30677 1 528 . 1 1 54 54 TYR HB3 H 1 2.09 0.02 . 2 . . . . A 54 TYR HB3 . 30677 1 529 . 1 1 54 54 TYR HD1 H 1 6.93 0.02 . 3 . . . . A 54 TYR HD1 . 30677 1 530 . 1 1 54 54 TYR HD2 H 1 6.93 0.02 . 3 . . . . A 54 TYR HD2 . 30677 1 531 . 1 1 54 54 TYR HE1 H 1 6.87 0.02 . 3 . . . . A 54 TYR HE1 . 30677 1 532 . 1 1 54 54 TYR HE2 H 1 6.87 0.02 . 3 . . . . A 54 TYR HE2 . 30677 1 533 . 1 1 54 54 TYR C C 13 178.8 0.2 . 1 . . . . A 54 TYR C . 30677 1 534 . 1 1 54 54 TYR CA C 13 57.4 0.2 . 1 . . . . A 54 TYR CA . 30677 1 535 . 1 1 54 54 TYR CB C 13 36.9 0.2 . 1 . . . . A 54 TYR CB . 30677 1 536 . 1 1 54 54 TYR CD1 C 13 131.0 0.2 . 3 . . . . A 54 TYR CD1 . 30677 1 537 . 1 1 54 54 TYR CD2 C 13 131.0 0.2 . 3 . . . . A 54 TYR CD2 . 30677 1 538 . 1 1 54 54 TYR CE1 C 13 117.3 0.2 . 3 . . . . A 54 TYR CE1 . 30677 1 539 . 1 1 54 54 TYR CE2 C 13 117.3 0.2 . 3 . . . . A 54 TYR CE2 . 30677 1 540 . 1 1 54 54 TYR N N 15 120.9 0.2 . 1 . . . . A 54 TYR N . 30677 1 541 . 1 1 55 55 SER H H 1 7.82 0.02 . 1 . . . . A 55 SER H . 30677 1 542 . 1 1 55 55 SER HA H 1 3.53 0.02 . 1 . . . . A 55 SER HA . 30677 1 543 . 1 1 55 55 SER C C 13 175.6 0.2 . 1 . . . . A 55 SER C . 30677 1 544 . 1 1 55 55 SER CA C 13 62.6 0.2 . 1 . . . . A 55 SER CA . 30677 1 545 . 1 1 55 55 SER CB C 13 68.8 0.2 . 1 . . . . A 55 SER CB . 30677 1 546 . 1 1 55 55 SER N N 15 112.1 0.2 . 1 . . . . A 55 SER N . 30677 1 547 . 1 1 56 56 ALA H H 1 7.30 0.02 . 1 . . . . A 56 ALA H . 30677 1 548 . 1 1 56 56 ALA HB1 H 1 1.19 0.02 . 1 . . . . A 56 ALA HB1 . 30677 1 549 . 1 1 56 56 ALA HB2 H 1 1.19 0.02 . 1 . . . . A 56 ALA HB2 . 30677 1 550 . 1 1 56 56 ALA HB3 H 1 1.19 0.02 . 1 . . . . A 56 ALA HB3 . 30677 1 551 . 1 1 56 56 ALA CA C 13 54.8 0.2 . 1 . . . . A 56 ALA CA . 30677 1 552 . 1 1 56 56 ALA CB C 13 20.2 0.2 . 1 . . . . A 56 ALA CB . 30677 1 553 . 1 1 56 56 ALA N N 15 124.7 0.2 . 1 . . . . A 56 ALA N . 30677 1 554 . 1 1 57 57 CYS H H 1 8.35 0.02 . 1 . . . . A 57 CYS H . 30677 1 555 . 1 1 57 57 CYS CA C 13 64.7 0.2 . 1 . . . . A 57 CYS CA . 30677 1 556 . 1 1 57 57 CYS N N 15 120.6 0.2 . 1 . . . . A 57 CYS N . 30677 1 557 . 1 1 58 58 PHE H H 1 9.48 0.02 . 1 . . . . A 58 PHE H . 30677 1 558 . 1 1 58 58 PHE HA H 1 3.98 0.02 . 1 . . . . A 58 PHE HA . 30677 1 559 . 1 1 58 58 PHE HB2 H 1 3.33 0.02 . 2 . . . . A 58 PHE HB2 . 30677 1 560 . 1 1 58 58 PHE CA C 13 63.3 0.2 . 1 . . . . A 58 PHE CA . 30677 1 561 . 1 1 58 58 PHE N N 15 120.9 0.2 . 1 . . . . A 58 PHE N . 30677 1 562 . 1 1 60 60 SER C C 13 176.4 0.2 . 1 . . . . A 60 SER C . 30677 1 563 . 1 1 61 61 ALA H H 1 9.45 0.02 . 1 . . . . A 61 ALA H . 30677 1 564 . 1 1 61 61 ALA HA H 1 4.31 0.02 . 1 . . . . A 61 ALA HA . 30677 1 565 . 1 1 61 61 ALA HB1 H 1 1.53 0.02 . 1 . . . . A 61 ALA HB1 . 30677 1 566 . 1 1 61 61 ALA HB2 H 1 1.53 0.02 . 1 . . . . A 61 ALA HB2 . 30677 1 567 . 1 1 61 61 ALA HB3 H 1 1.53 0.02 . 1 . . . . A 61 ALA HB3 . 30677 1 568 . 1 1 61 61 ALA C C 13 179.3 0.2 . 1 . . . . A 61 ALA C . 30677 1 569 . 1 1 61 61 ALA CA C 13 55.3 0.2 . 1 . . . . A 61 ALA CA . 30677 1 570 . 1 1 61 61 ALA CB C 13 17.5 0.2 . 1 . . . . A 61 ALA CB . 30677 1 571 . 1 1 61 61 ALA N N 15 129.9 0.2 . 1 . . . . A 61 ALA N . 30677 1 572 . 1 1 62 62 MET H H 1 8.25 0.02 . 1 . . . . A 62 MET H . 30677 1 573 . 1 1 62 62 MET HA H 1 3.89 0.02 . 1 . . . . A 62 MET HA . 30677 1 574 . 1 1 62 62 MET HE1 H 1 1.99 0.02 . 1 . . . . A 62 MET HE1 . 30677 1 575 . 1 1 62 62 MET HE2 H 1 1.99 0.02 . 1 . . . . A 62 MET HE2 . 30677 1 576 . 1 1 62 62 MET HE3 H 1 1.99 0.02 . 1 . . . . A 62 MET HE3 . 30677 1 577 . 1 1 62 62 MET CA C 13 60.3 0.2 . 1 . . . . A 62 MET CA . 30677 1 578 . 1 1 62 62 MET CB C 13 33.6 0.2 . 1 . . . . A 62 MET CB . 30677 1 579 . 1 1 62 62 MET CE C 13 16.9 0.2 . 1 . . . . A 62 MET CE . 30677 1 580 . 1 1 62 62 MET N N 15 117.7 0.2 . 1 . . . . A 62 MET N . 30677 1 581 . 1 1 63 63 LYS H H 1 8.29 0.02 . 1 . . . . A 63 LYS H . 30677 1 582 . 1 1 63 63 LYS CB C 13 35.1 0.2 . 1 . . . . A 63 LYS CB . 30677 1 583 . 1 1 63 63 LYS N N 15 118.4 0.2 . 1 . . . . A 63 LYS N . 30677 1 584 . 1 1 64 64 PHE H H 1 8.52 0.02 . 1 . . . . A 64 PHE H . 30677 1 585 . 1 1 64 64 PHE HA H 1 4.36 0.02 . 1 . . . . A 64 PHE HA . 30677 1 586 . 1 1 64 64 PHE HB2 H 1 3.51 0.02 . 2 . . . . A 64 PHE HB2 . 30677 1 587 . 1 1 64 64 PHE HB3 H 1 3.37 0.02 . 2 . . . . A 64 PHE HB3 . 30677 1 588 . 1 1 64 64 PHE HD1 H 1 7.28 0.02 . 3 . . . . A 64 PHE HD1 . 30677 1 589 . 1 1 64 64 PHE HD2 H 1 7.28 0.02 . 3 . . . . A 64 PHE HD2 . 30677 1 590 . 1 1 64 64 PHE HE1 H 1 7.40 0.02 . 3 . . . . A 64 PHE HE1 . 30677 1 591 . 1 1 64 64 PHE HE2 H 1 7.40 0.02 . 3 . . . . A 64 PHE HE2 . 30677 1 592 . 1 1 64 64 PHE CA C 13 61.0 0.2 . 1 . . . . A 64 PHE CA . 30677 1 593 . 1 1 64 64 PHE CB C 13 39.0 0.2 . 1 . . . . A 64 PHE CB . 30677 1 594 . 1 1 64 64 PHE CD1 C 13 132.1 0.2 . 3 . . . . A 64 PHE CD1 . 30677 1 595 . 1 1 64 64 PHE CD2 C 13 132.1 0.2 . 3 . . . . A 64 PHE CD2 . 30677 1 596 . 1 1 64 64 PHE CE1 C 13 131.7 0.2 . 3 . . . . A 64 PHE CE1 . 30677 1 597 . 1 1 64 64 PHE CE2 C 13 131.7 0.2 . 3 . . . . A 64 PHE CE2 . 30677 1 598 . 1 1 64 64 PHE N N 15 123.1 0.2 . 1 . . . . A 64 PHE N . 30677 1 599 . 1 1 65 65 VAL H H 1 8.40 0.02 . 1 . . . . A 65 VAL H . 30677 1 600 . 1 1 65 65 VAL HA H 1 3.57 0.02 . 1 . . . . A 65 VAL HA . 30677 1 601 . 1 1 65 65 VAL HB H 1 2.15 0.02 . 1 . . . . A 65 VAL HB . 30677 1 602 . 1 1 65 65 VAL HG11 H 1 0.98 0.02 . 1 . . . . A 65 VAL HG11 . 30677 1 603 . 1 1 65 65 VAL HG12 H 1 0.98 0.02 . 1 . . . . A 65 VAL HG12 . 30677 1 604 . 1 1 65 65 VAL HG13 H 1 0.98 0.02 . 1 . . . . A 65 VAL HG13 . 30677 1 605 . 1 1 65 65 VAL HG21 H 1 1.17 0.02 . 1 . . . . A 65 VAL HG21 . 30677 1 606 . 1 1 65 65 VAL HG22 H 1 1.17 0.02 . 1 . . . . A 65 VAL HG22 . 30677 1 607 . 1 1 65 65 VAL HG23 H 1 1.17 0.02 . 1 . . . . A 65 VAL HG23 . 30677 1 608 . 1 1 65 65 VAL C C 13 179.0 0.2 . 1 . . . . A 65 VAL C . 30677 1 609 . 1 1 65 65 VAL CA C 13 66.1 0.2 . 1 . . . . A 65 VAL CA . 30677 1 610 . 1 1 65 65 VAL CB C 13 32.0 0.2 . 1 . . . . A 65 VAL CB . 30677 1 611 . 1 1 65 65 VAL CG1 C 13 22.1 0.2 . 1 . . . . A 65 VAL CG1 . 30677 1 612 . 1 1 65 65 VAL CG2 C 13 22.1 0.2 . 1 . . . . A 65 VAL CG2 . 30677 1 613 . 1 1 65 65 VAL N N 15 120.5 0.2 . 1 . . . . A 65 VAL N . 30677 1 614 . 1 1 66 66 ALA H H 1 8.77 0.02 . 1 . . . . A 66 ALA H . 30677 1 615 . 1 1 66 66 ALA HA H 1 4.13 0.02 . 1 . . . . A 66 ALA HA . 30677 1 616 . 1 1 66 66 ALA HB1 H 1 1.32 0.02 . 1 . . . . A 66 ALA HB1 . 30677 1 617 . 1 1 66 66 ALA HB2 H 1 1.32 0.02 . 1 . . . . A 66 ALA HB2 . 30677 1 618 . 1 1 66 66 ALA HB3 H 1 1.32 0.02 . 1 . . . . A 66 ALA HB3 . 30677 1 619 . 1 1 66 66 ALA C C 13 180.0 0.2 . 1 . . . . A 66 ALA C . 30677 1 620 . 1 1 66 66 ALA CA C 13 55.2 0.2 . 1 . . . . A 66 ALA CA . 30677 1 621 . 1 1 66 66 ALA CB C 13 17.4 0.2 . 1 . . . . A 66 ALA CB . 30677 1 622 . 1 1 66 66 ALA N N 15 123.4 0.2 . 1 . . . . A 66 ALA N . 30677 1 623 . 1 1 67 67 GLY H H 1 8.29 0.02 . 1 . . . . A 67 GLY H . 30677 1 624 . 1 1 67 67 GLY HA2 H 1 3.97 0.02 . 2 . . . . A 67 GLY HA2 . 30677 1 625 . 1 1 67 67 GLY HA3 H 1 3.97 0.02 . 2 . . . . A 67 GLY HA3 . 30677 1 626 . 1 1 67 67 GLY C C 13 177.8 0.2 . 1 . . . . A 67 GLY C . 30677 1 627 . 1 1 67 67 GLY CA C 13 47.0 0.2 . 1 . . . . A 67 GLY CA . 30677 1 628 . 1 1 67 67 GLY N N 15 105.9 0.2 . 1 . . . . A 67 GLY N . 30677 1 629 . 1 1 68 68 GLN H H 1 7.65 0.02 . 1 . . . . A 68 GLN H . 30677 1 630 . 1 1 68 68 GLN HA H 1 4.02 0.02 . 1 . . . . A 68 GLN HA . 30677 1 631 . 1 1 68 68 GLN HB2 H 1 2.12 0.02 . 2 . . . . A 68 GLN HB2 . 30677 1 632 . 1 1 68 68 GLN HB3 H 1 1.98 0.02 . 2 . . . . A 68 GLN HB3 . 30677 1 633 . 1 1 68 68 GLN HG2 H 1 2.15 0.02 . 2 . . . . A 68 GLN HG2 . 30677 1 634 . 1 1 68 68 GLN HG3 H 1 2.02 0.02 . 2 . . . . A 68 GLN HG3 . 30677 1 635 . 1 1 68 68 GLN HE21 H 1 6.80 0.02 . 2 . . . . A 68 GLN HE21 . 30677 1 636 . 1 1 68 68 GLN HE22 H 1 6.77 0.02 . 2 . . . . A 68 GLN HE22 . 30677 1 637 . 1 1 68 68 GLN C C 13 176.8 0.2 . 1 . . . . A 68 GLN C . 30677 1 638 . 1 1 68 68 GLN CA C 13 58.4 0.2 . 1 . . . . A 68 GLN CA . 30677 1 639 . 1 1 68 68 GLN CB C 13 28.5 0.2 . 1 . . . . A 68 GLN CB . 30677 1 640 . 1 1 68 68 GLN CG C 13 34.1 0.2 . 1 . . . . A 68 GLN CG . 30677 1 641 . 1 1 68 68 GLN N N 15 121.8 0.2 . 1 . . . . A 68 GLN N . 30677 1 642 . 1 1 68 68 GLN NE2 N 15 112.3 0.2 . 1 . . . . A 68 GLN NE2 . 30677 1 643 . 1 1 69 69 ASN H H 1 7.50 0.02 . 1 . . . . A 69 ASN H . 30677 1 644 . 1 1 69 69 ASN HA H 1 4.89 0.02 . 1 . . . . A 69 ASN HA . 30677 1 645 . 1 1 69 69 ASN HB2 H 1 2.99 0.02 . 2 . . . . A 69 ASN HB2 . 30677 1 646 . 1 1 69 69 ASN HB3 H 1 2.58 0.02 . 2 . . . . A 69 ASN HB3 . 30677 1 647 . 1 1 69 69 ASN HD21 H 1 7.46 0.02 . 2 . . . . A 69 ASN HD21 . 30677 1 648 . 1 1 69 69 ASN HD22 H 1 6.91 0.02 . 2 . . . . A 69 ASN HD22 . 30677 1 649 . 1 1 69 69 ASN C C 13 173.6 0.2 . 1 . . . . A 69 ASN C . 30677 1 650 . 1 1 69 69 ASN CA C 13 52.5 0.2 . 1 . . . . A 69 ASN CA . 30677 1 651 . 1 1 69 69 ASN CB C 13 39.7 0.2 . 1 . . . . A 69 ASN CB . 30677 1 652 . 1 1 69 69 ASN N N 15 116.2 0.2 . 1 . . . . A 69 ASN N . 30677 1 653 . 1 1 69 69 ASN ND2 N 15 113.1 0.2 . 1 . . . . A 69 ASN ND2 . 30677 1 654 . 1 1 70 70 LYS H H 1 7.88 0.02 . 1 . . . . A 70 LYS H . 30677 1 655 . 1 1 70 70 LYS HA H 1 3.93 0.02 . 1 . . . . A 70 LYS HA . 30677 1 656 . 1 1 70 70 LYS HB2 H 1 1.97 0.02 . 2 . . . . A 70 LYS HB2 . 30677 1 657 . 1 1 70 70 LYS HB3 H 1 1.97 0.02 . 2 . . . . A 70 LYS HB3 . 30677 1 658 . 1 1 70 70 LYS HG2 H 1 1.69 0.02 . 2 . . . . A 70 LYS HG2 . 30677 1 659 . 1 1 70 70 LYS HG3 H 1 1.69 0.02 . 2 . . . . A 70 LYS HG3 . 30677 1 660 . 1 1 70 70 LYS HD2 H 1 1.38 0.02 . 2 . . . . A 70 LYS HD2 . 30677 1 661 . 1 1 70 70 LYS HD3 H 1 1.35 0.02 . 2 . . . . A 70 LYS HD3 . 30677 1 662 . 1 1 70 70 LYS HE2 H 1 3.00 0.02 . 2 . . . . A 70 LYS HE2 . 30677 1 663 . 1 1 70 70 LYS HE3 H 1 3.00 0.02 . 2 . . . . A 70 LYS HE3 . 30677 1 664 . 1 1 70 70 LYS C C 13 175.1 0.2 . 1 . . . . A 70 LYS C . 30677 1 665 . 1 1 70 70 LYS CA C 13 57.4 0.2 . 1 . . . . A 70 LYS CA . 30677 1 666 . 1 1 70 70 LYS CB C 13 28.9 0.2 . 1 . . . . A 70 LYS CB . 30677 1 667 . 1 1 70 70 LYS CD C 13 25.2 0.2 . 1 . . . . A 70 LYS CD . 30677 1 668 . 1 1 70 70 LYS CE C 13 42.3 0.2 . 1 . . . . A 70 LYS CE . 30677 1 669 . 1 1 70 70 LYS N N 15 114.8 0.2 . 1 . . . . A 70 LYS N . 30677 1 670 . 1 1 71 71 GLN H H 1 8.13 0.02 . 1 . . . . A 71 GLN H . 30677 1 671 . 1 1 71 71 GLN HA H 1 4.64 0.02 . 1 . . . . A 71 GLN HA . 30677 1 672 . 1 1 71 71 GLN HB2 H 1 1.98 0.02 . 2 . . . . A 71 GLN HB2 . 30677 1 673 . 1 1 71 71 GLN HB3 H 1 1.87 0.02 . 2 . . . . A 71 GLN HB3 . 30677 1 674 . 1 1 71 71 GLN HG2 H 1 2.29 0.02 . 2 . . . . A 71 GLN HG2 . 30677 1 675 . 1 1 71 71 GLN HG3 H 1 2.24 0.02 . 2 . . . . A 71 GLN HG3 . 30677 1 676 . 1 1 71 71 GLN HE21 H 1 7.49 0.02 . 2 . . . . A 71 GLN HE21 . 30677 1 677 . 1 1 71 71 GLN HE22 H 1 6.54 0.02 . 2 . . . . A 71 GLN HE22 . 30677 1 678 . 1 1 71 71 GLN C C 13 175.2 0.2 . 1 . . . . A 71 GLN C . 30677 1 679 . 1 1 71 71 GLN CA C 13 54.2 0.2 . 1 . . . . A 71 GLN CA . 30677 1 680 . 1 1 71 71 GLN CB C 13 31.7 0.2 . 1 . . . . A 71 GLN CB . 30677 1 681 . 1 1 71 71 GLN CG C 13 33.8 0.2 . 1 . . . . A 71 GLN CG . 30677 1 682 . 1 1 71 71 GLN N N 15 118.0 0.2 . 1 . . . . A 71 GLN N . 30677 1 683 . 1 1 71 71 GLN NE2 N 15 110.3 0.2 . 1 . . . . A 71 GLN NE2 . 30677 1 684 . 1 1 72 72 THR H H 1 8.43 0.02 . 1 . . . . A 72 THR H . 30677 1 685 . 1 1 72 72 THR HA H 1 4.39 0.02 . 1 . . . . A 72 THR HA . 30677 1 686 . 1 1 72 72 THR HB H 1 4.02 0.02 . 1 . . . . A 72 THR HB . 30677 1 687 . 1 1 72 72 THR HG21 H 1 1.17 0.0 . 1 . . . . A 72 THR HG21 . 30677 1 688 . 1 1 72 72 THR HG22 H 1 1.17 0.0 . 1 . . . . A 72 THR HG22 . 30677 1 689 . 1 1 72 72 THR HG23 H 1 1.17 0.0 . 1 . . . . A 72 THR HG23 . 30677 1 690 . 1 1 72 72 THR C C 13 174.0 0.2 . 1 . . . . A 72 THR C . 30677 1 691 . 1 1 72 72 THR CA C 13 60.8 0.2 . 1 . . . . A 72 THR CA . 30677 1 692 . 1 1 72 72 THR CB C 13 70.7 0.2 . 1 . . . . A 72 THR CB . 30677 1 693 . 1 1 72 72 THR CG2 C 13 21.7 0.2 . 1 . . . . A 72 THR CG2 . 30677 1 694 . 1 1 72 72 THR N N 15 116.9 0.2 . 1 . . . . A 72 THR N . 30677 1 695 . 1 1 73 73 LEU H H 1 9.03 0.02 . 1 . . . . A 73 LEU H . 30677 1 696 . 1 1 73 73 LEU HA H 1 4.55 0.02 . 1 . . . . A 73 LEU HA . 30677 1 697 . 1 1 73 73 LEU HB2 H 1 1.56 0.02 . 2 . . . . A 73 LEU HB2 . 30677 1 698 . 1 1 73 73 LEU HB3 H 1 1.56 0.02 . 2 . . . . A 73 LEU HB3 . 30677 1 699 . 1 1 73 73 LEU HG H 1 0.86 0.02 . 1 . . . . A 73 LEU HG . 30677 1 700 . 1 1 73 73 LEU HD11 H 1 0.77 0.02 . 2 . . . . A 73 LEU HD11 . 30677 1 701 . 1 1 73 73 LEU HD12 H 1 0.77 0.02 . 2 . . . . A 73 LEU HD12 . 30677 1 702 . 1 1 73 73 LEU HD13 H 1 0.77 0.02 . 2 . . . . A 73 LEU HD13 . 30677 1 703 . 1 1 73 73 LEU HD21 H 1 0.77 0.02 . 2 . . . . A 73 LEU HD21 . 30677 1 704 . 1 1 73 73 LEU HD22 H 1 0.77 0.02 . 2 . . . . A 73 LEU HD22 . 30677 1 705 . 1 1 73 73 LEU HD23 H 1 0.77 0.02 . 2 . . . . A 73 LEU HD23 . 30677 1 706 . 1 1 73 73 LEU CA C 13 52.5 0.2 . 1 . . . . A 73 LEU CA . 30677 1 707 . 1 1 73 73 LEU CB C 13 40.7 0.2 . 1 . . . . A 73 LEU CB . 30677 1 708 . 1 1 73 73 LEU CG C 13 26.6 0.2 . 1 . . . . A 73 LEU CG . 30677 1 709 . 1 1 73 73 LEU CD1 C 13 23.6 0.2 . 2 . . . . A 73 LEU CD1 . 30677 1 710 . 1 1 73 73 LEU CD2 C 13 23.6 0.2 . 2 . . . . A 73 LEU CD2 . 30677 1 711 . 1 1 73 73 LEU N N 15 125.1 0.2 . 1 . . . . A 73 LEU N . 30677 1 712 . 1 1 74 74 PRO HB2 H 1 2.54 0.02 . 2 . . . . A 74 PRO HB2 . 30677 1 713 . 1 1 74 74 PRO HB3 H 1 1.94 0.02 . 2 . . . . A 74 PRO HB3 . 30677 1 714 . 1 1 74 74 PRO CB C 13 32.2 0.2 . 1 . . . . A 74 PRO CB . 30677 1 715 . 1 1 75 75 ALA HA H 1 4.17 0.02 . 1 . . . . A 75 ALA HA . 30677 1 716 . 1 1 75 75 ALA HB1 H 1 1.46 0.02 . 1 . . . . A 75 ALA HB1 . 30677 1 717 . 1 1 75 75 ALA HB2 H 1 1.46 0.02 . 1 . . . . A 75 ALA HB2 . 30677 1 718 . 1 1 75 75 ALA HB3 H 1 1.46 0.02 . 1 . . . . A 75 ALA HB3 . 30677 1 719 . 1 1 75 75 ALA C C 13 178.0 0.2 . 1 . . . . A 75 ALA C . 30677 1 720 . 1 1 75 75 ALA CA C 13 54.8 0.2 . 1 . . . . A 75 ALA CA . 30677 1 721 . 1 1 75 75 ALA CB C 13 18.5 0.2 . 1 . . . . A 75 ALA CB . 30677 1 722 . 1 1 76 76 ASP H H 1 8.86 0.02 . 1 . . . . A 76 ASP H . 30677 1 723 . 1 1 76 76 ASP HA H 1 4.64 0.02 . 1 . . . . A 76 ASP HA . 30677 1 724 . 1 1 76 76 ASP HB2 H 1 2.73 0.02 . 2 . . . . A 76 ASP HB2 . 30677 1 725 . 1 1 76 76 ASP HB3 H 1 2.73 0.02 . 2 . . . . A 76 ASP HB3 . 30677 1 726 . 1 1 76 76 ASP C C 13 174.8 0.2 . 1 . . . . A 76 ASP C . 30677 1 727 . 1 1 76 76 ASP CA C 13 53.4 0.2 . 1 . . . . A 76 ASP CA . 30677 1 728 . 1 1 76 76 ASP CB C 13 38.4 0.2 . 1 . . . . A 76 ASP CB . 30677 1 729 . 1 1 76 76 ASP N N 15 114.0 0.2 . 1 . . . . A 76 ASP N . 30677 1 730 . 1 1 77 77 THR H H 1 7.15 0.02 . 1 . . . . A 77 THR H . 30677 1 731 . 1 1 77 77 THR HA H 1 4.61 0.02 . 1 . . . . A 77 THR HA . 30677 1 732 . 1 1 77 77 THR HB H 1 3.96 0.02 . 1 . . . . A 77 THR HB . 30677 1 733 . 1 1 77 77 THR HG21 H 1 1.24 0.02 . 1 . . . . A 77 THR HG21 . 30677 1 734 . 1 1 77 77 THR HG22 H 1 1.24 0.02 . 1 . . . . A 77 THR HG22 . 30677 1 735 . 1 1 77 77 THR HG23 H 1 1.24 0.02 . 1 . . . . A 77 THR HG23 . 30677 1 736 . 1 1 77 77 THR C C 13 175.2 0.2 . 1 . . . . A 77 THR C . 30677 1 737 . 1 1 77 77 THR CA C 13 65.2 0.2 . 1 . . . . A 77 THR CA . 30677 1 738 . 1 1 77 77 THR CB C 13 70.0 0.2 . 1 . . . . A 77 THR CB . 30677 1 739 . 1 1 77 77 THR CG2 C 13 21.7 0.2 . 1 . . . . A 77 THR CG2 . 30677 1 740 . 1 1 77 77 THR N N 15 117.1 0.2 . 1 . . . . A 77 THR N . 30677 1 741 . 1 1 78 78 THR H H 1 8.63 0.02 . 1 . . . . A 78 THR H . 30677 1 742 . 1 1 78 78 THR HA H 1 5.17 0.02 . 1 . . . . A 78 THR HA . 30677 1 743 . 1 1 78 78 THR HB H 1 4.06 0.02 . 1 . . . . A 78 THR HB . 30677 1 744 . 1 1 78 78 THR HG21 H 1 1.15 0.02 . 1 . . . . A 78 THR HG21 . 30677 1 745 . 1 1 78 78 THR HG22 H 1 1.15 0.02 . 1 . . . . A 78 THR HG22 . 30677 1 746 . 1 1 78 78 THR HG23 H 1 1.15 0.02 . 1 . . . . A 78 THR HG23 . 30677 1 747 . 1 1 78 78 THR C C 13 173.5 0.2 . 1 . . . . A 78 THR C . 30677 1 748 . 1 1 78 78 THR CA C 13 60.2 0.2 . 1 . . . . A 78 THR CA . 30677 1 749 . 1 1 78 78 THR CB C 13 73.3 0.2 . 1 . . . . A 78 THR CB . 30677 1 750 . 1 1 78 78 THR CG2 C 13 21.5 0.2 . 1 . . . . A 78 THR CG2 . 30677 1 751 . 1 1 78 78 THR N N 15 116.8 0.2 . 1 . . . . A 78 THR N . 30677 1 752 . 1 1 79 79 VAL H H 1 7.82 0.02 . 1 . . . . A 79 VAL H . 30677 1 753 . 1 1 79 79 VAL HA H 1 4.62 0.02 . 1 . . . . A 79 VAL HA . 30677 1 754 . 1 1 79 79 VAL HB H 1 2.11 0.02 . 1 . . . . A 79 VAL HB . 30677 1 755 . 1 1 79 79 VAL HG11 H 1 0.71 0.02 . 1 . . . . A 79 VAL HG11 . 30677 1 756 . 1 1 79 79 VAL HG12 H 1 0.71 0.02 . 1 . . . . A 79 VAL HG12 . 30677 1 757 . 1 1 79 79 VAL HG13 H 1 0.71 0.02 . 1 . . . . A 79 VAL HG13 . 30677 1 758 . 1 1 79 79 VAL HG21 H 1 1.12 0.02 . 1 . . . . A 79 VAL HG21 . 30677 1 759 . 1 1 79 79 VAL HG22 H 1 1.12 0.02 . 1 . . . . A 79 VAL HG22 . 30677 1 760 . 1 1 79 79 VAL HG23 H 1 1.12 0.02 . 1 . . . . A 79 VAL HG23 . 30677 1 761 . 1 1 79 79 VAL C C 13 174.1 0.2 . 1 . . . . A 79 VAL C . 30677 1 762 . 1 1 79 79 VAL CA C 13 61.8 0.2 . 1 . . . . A 79 VAL CA . 30677 1 763 . 1 1 79 79 VAL CG1 C 13 22.4 0.2 . 1 . . . . A 79 VAL CG1 . 30677 1 764 . 1 1 79 79 VAL CG2 C 13 23.7 0.2 . 1 . . . . A 79 VAL CG2 . 30677 1 765 . 1 1 79 79 VAL N N 15 117.7 0.2 . 1 . . . . A 79 VAL N . 30677 1 766 . 1 1 80 80 THR H H 1 9.23 0.02 . 1 . . . . A 80 THR H . 30677 1 767 . 1 1 80 80 THR HA H 1 5.42 0.02 . 1 . . . . A 80 THR HA . 30677 1 768 . 1 1 80 80 THR HB H 1 3.94 0.02 . 1 . . . . A 80 THR HB . 30677 1 769 . 1 1 80 80 THR HG21 H 1 1.06 0.2 . 1 . . . . A 80 THR HG21 . 30677 1 770 . 1 1 80 80 THR HG22 H 1 1.06 0.2 . 1 . . . . A 80 THR HG22 . 30677 1 771 . 1 1 80 80 THR HG23 H 1 1.06 0.2 . 1 . . . . A 80 THR HG23 . 30677 1 772 . 1 1 80 80 THR C C 13 172.9 0.2 . 1 . . . . A 80 THR C . 30677 1 773 . 1 1 80 80 THR CA C 13 60.8 0.2 . 1 . . . . A 80 THR CA . 30677 1 774 . 1 1 80 80 THR CB C 13 71.3 0.2 . 1 . . . . A 80 THR CB . 30677 1 775 . 1 1 80 80 THR CG2 C 13 20.9 0.2 . 1 . . . . A 80 THR CG2 . 30677 1 776 . 1 1 80 80 THR N N 15 126.5 0.2 . 1 . . . . A 80 THR N . 30677 1 777 . 1 1 81 81 ALA H H 1 8.98 0.02 . 1 . . . . A 81 ALA H . 30677 1 778 . 1 1 81 81 ALA HA H 1 5.22 0.02 . 1 . . . . A 81 ALA HA . 30677 1 779 . 1 1 81 81 ALA HB1 H 1 1.03 0.02 . 1 . . . . A 81 ALA HB1 . 30677 1 780 . 1 1 81 81 ALA HB2 H 1 1.03 0.02 . 1 . . . . A 81 ALA HB2 . 30677 1 781 . 1 1 81 81 ALA HB3 H 1 1.03 0.02 . 1 . . . . A 81 ALA HB3 . 30677 1 782 . 1 1 81 81 ALA C C 13 174.5 0.2 . 1 . . . . A 81 ALA C . 30677 1 783 . 1 1 81 81 ALA CA C 13 49.9 0.2 . 1 . . . . A 81 ALA CA . 30677 1 784 . 1 1 81 81 ALA CB C 13 21.3 0.2 . 1 . . . . A 81 ALA CB . 30677 1 785 . 1 1 81 81 ALA N N 15 128.3 0.2 . 1 . . . . A 81 ALA N . 30677 1 786 . 1 1 82 82 GLU H H 1 9.45 0.02 . 1 . . . . A 82 GLU H . 30677 1 787 . 1 1 82 82 GLU HA H 1 5.08 0.02 . 1 . . . . A 82 GLU HA . 30677 1 788 . 1 1 82 82 GLU HB2 H 1 1.96 0.02 . 2 . . . . A 82 GLU HB2 . 30677 1 789 . 1 1 82 82 GLU HB3 H 1 1.60 0.02 . 2 . . . . A 82 GLU HB3 . 30677 1 790 . 1 1 82 82 GLU HG2 H 1 1.99 0.02 . 2 . . . . A 82 GLU HG2 . 30677 1 791 . 1 1 82 82 GLU HG3 H 1 1.89 0.02 . 2 . . . . A 82 GLU HG3 . 30677 1 792 . 1 1 82 82 GLU C C 13 175.4 0.2 . 1 . . . . A 82 GLU C . 30677 1 793 . 1 1 82 82 GLU CA C 13 54.7 0.2 . 1 . . . . A 82 GLU CA . 30677 1 794 . 1 1 82 82 GLU CB C 13 32.1 0.2 . 1 . . . . A 82 GLU CB . 30677 1 795 . 1 1 82 82 GLU CG C 13 36.8 0.2 . 1 . . . . A 82 GLU CG . 30677 1 796 . 1 1 82 82 GLU N N 15 125.1 0.2 . 1 . . . . A 82 GLU N . 30677 1 797 . 1 1 83 83 VAL H H 1 8.87 0.02 . 1 . . . . A 83 VAL H . 30677 1 798 . 1 1 83 83 VAL HA H 1 5.05 0.02 . 1 . . . . A 83 VAL HA . 30677 1 799 . 1 1 83 83 VAL HB H 1 1.87 0.02 . 1 . . . . A 83 VAL HB . 30677 1 800 . 1 1 83 83 VAL HG11 H 1 0.78 0.02 . 2 . . . . A 83 VAL HG11 . 30677 1 801 . 1 1 83 83 VAL HG12 H 1 0.78 0.02 . 2 . . . . A 83 VAL HG12 . 30677 1 802 . 1 1 83 83 VAL HG13 H 1 0.78 0.02 . 2 . . . . A 83 VAL HG13 . 30677 1 803 . 1 1 83 83 VAL HG21 H 1 0.78 0.02 . 2 . . . . A 83 VAL HG21 . 30677 1 804 . 1 1 83 83 VAL HG22 H 1 0.78 0.02 . 2 . . . . A 83 VAL HG22 . 30677 1 805 . 1 1 83 83 VAL HG23 H 1 0.78 0.02 . 2 . . . . A 83 VAL HG23 . 30677 1 806 . 1 1 83 83 VAL C C 13 173.8 0.2 . 1 . . . . A 83 VAL C . 30677 1 807 . 1 1 83 83 VAL CA C 13 60.8 0.2 . 1 . . . . A 83 VAL CA . 30677 1 808 . 1 1 83 83 VAL CB C 13 35.5 0.2 . 1 . . . . A 83 VAL CB . 30677 1 809 . 1 1 83 83 VAL CG1 C 13 22.7 0.2 . 2 . . . . A 83 VAL CG1 . 30677 1 810 . 1 1 83 83 VAL CG2 C 13 22.7 0.2 . 2 . . . . A 83 VAL CG2 . 30677 1 811 . 1 1 83 83 VAL N N 15 128.2 0.2 . 1 . . . . A 83 VAL N . 30677 1 812 . 1 1 84 84 GLY H H 1 9.69 0.02 . 1 . . . . A 84 GLY H . 30677 1 813 . 1 1 84 84 GLY HA2 H 1 5.60 0.02 . 2 . . . . A 84 GLY HA2 . 30677 1 814 . 1 1 84 84 GLY HA3 H 1 3.50 0.02 . 2 . . . . A 84 GLY HA3 . 30677 1 815 . 1 1 84 84 GLY C C 13 171.4 0.2 . 1 . . . . A 84 GLY C . 30677 1 816 . 1 1 84 84 GLY CA C 13 43.4 0.2 . 1 . . . . A 84 GLY CA . 30677 1 817 . 1 1 84 84 GLY N N 15 114.4 0.2 . 1 . . . . A 84 GLY N . 30677 1 818 . 1 1 85 85 ILE H H 1 8.58 0.02 . 1 . . . . A 85 ILE H . 30677 1 819 . 1 1 85 85 ILE HA H 1 5.58 0.02 . 1 . . . . A 85 ILE HA . 30677 1 820 . 1 1 85 85 ILE HB H 1 1.64 0.02 . 1 . . . . A 85 ILE HB . 30677 1 821 . 1 1 85 85 ILE HG12 H 1 1.58 0.02 . 2 . . . . A 85 ILE HG12 . 30677 1 822 . 1 1 85 85 ILE HG13 H 1 0.89 0.02 . 2 . . . . A 85 ILE HG13 . 30677 1 823 . 1 1 85 85 ILE HG21 H 1 1.09 0.02 . 1 . . . . A 85 ILE HG21 . 30677 1 824 . 1 1 85 85 ILE HG22 H 1 1.09 0.02 . 1 . . . . A 85 ILE HG22 . 30677 1 825 . 1 1 85 85 ILE HG23 H 1 1.09 0.02 . 1 . . . . A 85 ILE HG23 . 30677 1 826 . 1 1 85 85 ILE HD11 H 1 0.63 0.02 . 1 . . . . A 85 ILE HD11 . 30677 1 827 . 1 1 85 85 ILE HD12 H 1 0.63 0.02 . 1 . . . . A 85 ILE HD12 . 30677 1 828 . 1 1 85 85 ILE HD13 H 1 0.63 0.02 . 1 . . . . A 85 ILE HD13 . 30677 1 829 . 1 1 85 85 ILE C C 13 174.1 0.2 . 1 . . . . A 85 ILE C . 30677 1 830 . 1 1 85 85 ILE CA C 13 57.9 0.2 . 1 . . . . A 85 ILE CA . 30677 1 831 . 1 1 85 85 ILE CB C 13 42.3 0.2 . 1 . . . . A 85 ILE CB . 30677 1 832 . 1 1 85 85 ILE CG1 C 13 28.6 0.2 . 1 . . . . A 85 ILE CG1 . 30677 1 833 . 1 1 85 85 ILE CG2 C 13 16.5 0.2 . 1 . . . . A 85 ILE CG2 . 30677 1 834 . 1 1 85 85 ILE CD1 C 13 14.2 0.2 . 1 . . . . A 85 ILE CD1 . 30677 1 835 . 1 1 85 85 ILE N N 15 115.5 0.2 . 1 . . . . A 85 ILE N . 30677 1 836 . 1 1 86 86 GLY H H 1 8.58 0.02 . 1 . . . . A 86 GLY H . 30677 1 837 . 1 1 86 86 GLY N N 15 113.0 0.2 . 1 . . . . A 86 GLY N . 30677 1 838 . 1 1 87 87 PRO HA H 1 4.60 0.02 . 1 . . . . A 87 PRO HA . 30677 1 839 . 1 1 87 87 PRO HB2 H 1 2.07 0.02 . 2 . . . . A 87 PRO HB2 . 30677 1 840 . 1 1 87 87 PRO HB3 H 1 1.96 0.02 . 2 . . . . A 87 PRO HB3 . 30677 1 841 . 1 1 87 87 PRO C C 13 176.7 0.2 . 1 . . . . A 87 PRO C . 30677 1 842 . 1 1 87 87 PRO CA C 13 62.3 0.2 . 1 . . . . A 87 PRO CA . 30677 1 843 . 1 1 87 87 PRO CB C 13 32.5 0.2 . 1 . . . . A 87 PRO CB . 30677 1 844 . 1 1 88 88 ASN H H 1 7.85 0.02 . 1 . . . . A 88 ASN H . 30677 1 845 . 1 1 88 88 ASN HA H 1 4.92 0.02 . 1 . . . . A 88 ASN HA . 30677 1 846 . 1 1 88 88 ASN HB2 H 1 3.34 0.02 . 2 . . . . A 88 ASN HB2 . 30677 1 847 . 1 1 88 88 ASN HB3 H 1 2.40 0.02 . 2 . . . . A 88 ASN HB3 . 30677 1 848 . 1 1 88 88 ASN C C 13 176.3 0.2 . 1 . . . . A 88 ASN C . 30677 1 849 . 1 1 88 88 ASN CA C 13 50.4 0.2 . 1 . . . . A 88 ASN CA . 30677 1 850 . 1 1 88 88 ASN CB C 13 39.4 0.2 . 1 . . . . A 88 ASN CB . 30677 1 851 . 1 1 88 88 ASN N N 15 119.3 0.2 . 1 . . . . A 88 ASN N . 30677 1 852 . 1 1 89 89 GLU H H 1 8.56 0.02 . 1 . . . . A 89 GLU H . 30677 1 853 . 1 1 89 89 GLU HA H 1 4.25 0.02 . 1 . . . . A 89 GLU HA . 30677 1 854 . 1 1 89 89 GLU HB2 H 1 2.22 0.02 . 2 . . . . A 89 GLU HB2 . 30677 1 855 . 1 1 89 89 GLU HB3 H 1 1.98 0.02 . 2 . . . . A 89 GLU HB3 . 30677 1 856 . 1 1 89 89 GLU HG2 H 1 2.12 0.02 . 2 . . . . A 89 GLU HG2 . 30677 1 857 . 1 1 89 89 GLU HG3 H 1 2.12 0.02 . 2 . . . . A 89 GLU HG3 . 30677 1 858 . 1 1 89 89 GLU C C 13 176.8 0.2 . 1 . . . . A 89 GLU C . 30677 1 859 . 1 1 89 89 GLU CA C 13 57.9 0.2 . 1 . . . . A 89 GLU CA . 30677 1 860 . 1 1 89 89 GLU CB C 13 29.1 0.2 . 1 . . . . A 89 GLU CB . 30677 1 861 . 1 1 89 89 GLU CG C 13 36.3 0.2 . 1 . . . . A 89 GLU CG . 30677 1 862 . 1 1 89 89 GLU N N 15 117.3 0.2 . 1 . . . . A 89 GLU N . 30677 1 863 . 1 1 90 90 GLU H H 1 7.92 0.02 . 1 . . . . A 90 GLU H . 30677 1 864 . 1 1 90 90 GLU HA H 1 4.55 0.02 . 1 . . . . A 90 GLU HA . 30677 1 865 . 1 1 90 90 GLU HB2 H 1 2.22 0.02 . 2 . . . . A 90 GLU HB2 . 30677 1 866 . 1 1 90 90 GLU HB3 H 1 1.76 0.02 . 2 . . . . A 90 GLU HB3 . 30677 1 867 . 1 1 90 90 GLU HG2 H 1 2.12 0.02 . 2 . . . . A 90 GLU HG2 . 30677 1 868 . 1 1 90 90 GLU HG3 H 1 2.12 0.02 . 2 . . . . A 90 GLU HG3 . 30677 1 869 . 1 1 90 90 GLU C C 13 176.6 0.2 . 1 . . . . A 90 GLU C . 30677 1 870 . 1 1 90 90 GLU CA C 13 55.5 0.2 . 1 . . . . A 90 GLU CA . 30677 1 871 . 1 1 90 90 GLU CB C 13 30.4 0.2 . 1 . . . . A 90 GLU CB . 30677 1 872 . 1 1 90 90 GLU CG C 13 36.1 0.2 . 1 . . . . A 90 GLU CG . 30677 1 873 . 1 1 90 90 GLU N N 15 117.8 0.2 . 1 . . . . A 90 GLU N . 30677 1 874 . 1 1 91 91 GLY H H 1 8.05 0.02 . 1 . . . . A 91 GLY H . 30677 1 875 . 1 1 91 91 GLY HA2 H 1 4.26 0.02 . 2 . . . . A 91 GLY HA2 . 30677 1 876 . 1 1 91 91 GLY HA3 H 1 3.65 0.02 . 2 . . . . A 91 GLY HA3 . 30677 1 877 . 1 1 91 91 GLY C C 13 174.1 0.2 . 1 . . . . A 91 GLY C . 30677 1 878 . 1 1 91 91 GLY CA C 13 45.5 0.2 . 1 . . . . A 91 GLY CA . 30677 1 879 . 1 1 91 91 GLY N N 15 108.7 0.2 . 1 . . . . A 91 GLY N . 30677 1 880 . 1 1 92 92 GLY H H 1 8.04 0.02 . 1 . . . . A 92 GLY H . 30677 1 881 . 1 1 92 92 GLY HA2 H 1 4.33 0.02 . 2 . . . . A 92 GLY HA2 . 30677 1 882 . 1 1 92 92 GLY HA3 H 1 3.64 0.02 . 2 . . . . A 92 GLY HA3 . 30677 1 883 . 1 1 92 92 GLY C C 13 172.5 0.2 . 1 . . . . A 92 GLY C . 30677 1 884 . 1 1 92 92 GLY CA C 13 44.4 0.2 . 1 . . . . A 92 GLY CA . 30677 1 885 . 1 1 92 92 GLY N N 15 108.3 0.2 . 1 . . . . A 92 GLY N . 30677 1 886 . 1 1 93 93 PHE H H 1 7.84 0.02 . 1 . . . . A 93 PHE H . 30677 1 887 . 1 1 93 93 PHE HA H 1 5.14 0.02 . 1 . . . . A 93 PHE HA . 30677 1 888 . 1 1 93 93 PHE HD1 H 1 6.78 0.02 . 3 . . . . A 93 PHE HD1 . 30677 1 889 . 1 1 93 93 PHE HD2 H 1 6.78 0.02 . 3 . . . . A 93 PHE HD2 . 30677 1 890 . 1 1 93 93 PHE C C 13 173.2 0.2 . 1 . . . . A 93 PHE C . 30677 1 891 . 1 1 93 93 PHE CA C 13 56.5 0.2 . 1 . . . . A 93 PHE CA . 30677 1 892 . 1 1 93 93 PHE CD1 C 13 130.9 0.2 . 3 . . . . A 93 PHE CD1 . 30677 1 893 . 1 1 93 93 PHE CD2 C 13 130.9 0.2 . 3 . . . . A 93 PHE CD2 . 30677 1 894 . 1 1 93 93 PHE N N 15 118.6 0.2 . 1 . . . . A 93 PHE N . 30677 1 895 . 1 1 94 94 ALA H H 1 9.32 0.02 . 1 . . . . A 94 ALA H . 30677 1 896 . 1 1 94 94 ALA HA H 1 4.97 0.02 . 1 . . . . A 94 ALA HA . 30677 1 897 . 1 1 94 94 ALA HB1 H 1 1.39 0.02 . 1 . . . . A 94 ALA HB1 . 30677 1 898 . 1 1 94 94 ALA HB2 H 1 1.39 0.02 . 1 . . . . A 94 ALA HB2 . 30677 1 899 . 1 1 94 94 ALA HB3 H 1 1.39 0.02 . 1 . . . . A 94 ALA HB3 . 30677 1 900 . 1 1 94 94 ALA C C 13 175.4 0.2 . 1 . . . . A 94 ALA C . 30677 1 901 . 1 1 94 94 ALA CA C 13 50.4 0.2 . 1 . . . . A 94 ALA CA . 30677 1 902 . 1 1 94 94 ALA CB C 13 23.8 0.2 . 1 . . . . A 94 ALA CB . 30677 1 903 . 1 1 94 94 ALA N N 15 122.5 0.2 . 1 . . . . A 94 ALA N . 30677 1 904 . 1 1 95 95 LEU H H 1 8.39 0.02 . 1 . . . . A 95 LEU H . 30677 1 905 . 1 1 95 95 LEU HA H 1 5.31 0.02 . 1 . . . . A 95 LEU HA . 30677 1 906 . 1 1 95 95 LEU HB2 H 1 1.49 0.02 . 2 . . . . A 95 LEU HB2 . 30677 1 907 . 1 1 95 95 LEU HB3 H 1 1.49 0.02 . 2 . . . . A 95 LEU HB3 . 30677 1 908 . 1 1 95 95 LEU HD11 H 1 0.05 0.02 . 1 . . . . A 95 LEU HD11 . 30677 1 909 . 1 1 95 95 LEU HD12 H 1 0.05 0.02 . 1 . . . . A 95 LEU HD12 . 30677 1 910 . 1 1 95 95 LEU HD13 H 1 0.05 0.02 . 1 . . . . A 95 LEU HD13 . 30677 1 911 . 1 1 95 95 LEU HD21 H 1 0.48 0.02 . 1 . . . . A 95 LEU HD21 . 30677 1 912 . 1 1 95 95 LEU HD22 H 1 0.48 0.02 . 1 . . . . A 95 LEU HD22 . 30677 1 913 . 1 1 95 95 LEU HD23 H 1 0.48 0.02 . 1 . . . . A 95 LEU HD23 . 30677 1 914 . 1 1 95 95 LEU C C 13 175.3 0.2 . 1 . . . . A 95 LEU C . 30677 1 915 . 1 1 95 95 LEU CA C 13 53.0 0.2 . 1 . . . . A 95 LEU CA . 30677 1 916 . 1 1 95 95 LEU CB C 13 45.6 0.2 . 1 . . . . A 95 LEU CB . 30677 1 917 . 1 1 95 95 LEU CD1 C 13 25.2 0.2 . 1 . . . . A 95 LEU CD1 . 30677 1 918 . 1 1 95 95 LEU CD2 C 13 22.2 0.2 . 1 . . . . A 95 LEU CD2 . 30677 1 919 . 1 1 95 95 LEU N N 15 117.6 0.2 . 1 . . . . A 95 LEU N . 30677 1 920 . 1 1 96 96 ASP H H 1 8.54 0.02 . 1 . . . . A 96 ASP H . 30677 1 921 . 1 1 96 96 ASP HA H 1 4.87 0.02 . 1 . . . . A 96 ASP HA . 30677 1 922 . 1 1 96 96 ASP HB2 H 1 2.52 0.02 . 2 . . . . A 96 ASP HB2 . 30677 1 923 . 1 1 96 96 ASP HB3 H 1 2.24 0.02 . 2 . . . . A 96 ASP HB3 . 30677 1 924 . 1 1 96 96 ASP C C 13 174.8 0.2 . 1 . . . . A 96 ASP C . 30677 1 925 . 1 1 96 96 ASP CA C 13 53.2 0.2 . 1 . . . . A 96 ASP CA . 30677 1 926 . 1 1 96 96 ASP CB C 13 47.1 0.2 . 1 . . . . A 96 ASP CB . 30677 1 927 . 1 1 96 96 ASP N N 15 121.7 0.2 . 1 . . . . A 96 ASP N . 30677 1 928 . 1 1 97 97 VAL H H 1 9.00 0.02 . 1 . . . . A 97 VAL H . 30677 1 929 . 1 1 97 97 VAL HA H 1 5.15 0.02 . 1 . . . . A 97 VAL HA . 30677 1 930 . 1 1 97 97 VAL HB H 1 1.91 0.02 . 1 . . . . A 97 VAL HB . 30677 1 931 . 1 1 97 97 VAL HG11 H 1 0.77 0.02 . 2 . . . . A 97 VAL HG11 . 30677 1 932 . 1 1 97 97 VAL HG12 H 1 0.77 0.02 . 2 . . . . A 97 VAL HG12 . 30677 1 933 . 1 1 97 97 VAL HG13 H 1 0.77 0.02 . 2 . . . . A 97 VAL HG13 . 30677 1 934 . 1 1 97 97 VAL HG21 H 1 0.77 0.02 . 2 . . . . A 97 VAL HG21 . 30677 1 935 . 1 1 97 97 VAL HG22 H 1 0.77 0.02 . 2 . . . . A 97 VAL HG22 . 30677 1 936 . 1 1 97 97 VAL HG23 H 1 0.77 0.02 . 2 . . . . A 97 VAL HG23 . 30677 1 937 . 1 1 97 97 VAL C C 13 172.5 0.2 . 1 . . . . A 97 VAL C . 30677 1 938 . 1 1 97 97 VAL CA C 13 61.2 0.2 . 1 . . . . A 97 VAL CA . 30677 1 939 . 1 1 97 97 VAL CB C 13 35.2 0.2 . 1 . . . . A 97 VAL CB . 30677 1 940 . 1 1 97 97 VAL CG1 C 13 21.7 0.2 . 2 . . . . A 97 VAL CG1 . 30677 1 941 . 1 1 97 97 VAL CG2 C 13 21.7 0.2 . 2 . . . . A 97 VAL CG2 . 30677 1 942 . 1 1 97 97 VAL N N 15 124.5 0.2 . 1 . . . . A 97 VAL N . 30677 1 943 . 1 1 98 98 GLU H H 1 8.62 0.02 . 1 . . . . A 98 GLU H . 30677 1 944 . 1 1 98 98 GLU HA H 1 4.85 0.02 . 1 . . . . A 98 GLU HA . 30677 1 945 . 1 1 98 98 GLU C C 13 173.5 0.2 . 1 . . . . A 98 GLU C . 30677 1 946 . 1 1 98 98 GLU CA C 13 54.2 0.2 . 1 . . . . A 98 GLU CA . 30677 1 947 . 1 1 98 98 GLU N N 15 127.4 0.2 . 1 . . . . A 98 GLU N . 30677 1 948 . 1 1 99 99 LEU H H 1 8.99 0.02 . 1 . . . . A 99 LEU H . 30677 1 949 . 1 1 99 99 LEU HA H 1 4.92 0.02 . 1 . . . . A 99 LEU HA . 30677 1 950 . 1 1 99 99 LEU HB2 H 1 1.23 0.02 . 2 . . . . A 99 LEU HB2 . 30677 1 951 . 1 1 99 99 LEU HB3 H 1 0.25 0.02 . 2 . . . . A 99 LEU HB3 . 30677 1 952 . 1 1 99 99 LEU HG H 1 0.64 0.02 . 1 . . . . A 99 LEU HG . 30677 1 953 . 1 1 99 99 LEU HD11 H 1 -0.37 0.02 . 1 . . . . A 99 LEU HD11 . 30677 1 954 . 1 1 99 99 LEU HD12 H 1 -0.37 0.02 . 1 . . . . A 99 LEU HD12 . 30677 1 955 . 1 1 99 99 LEU HD13 H 1 -0.37 0.02 . 1 . . . . A 99 LEU HD13 . 30677 1 956 . 1 1 99 99 LEU HD21 H 1 -0.56 0.02 . 1 . . . . A 99 LEU HD21 . 30677 1 957 . 1 1 99 99 LEU HD22 H 1 -0.56 0.02 . 1 . . . . A 99 LEU HD22 . 30677 1 958 . 1 1 99 99 LEU HD23 H 1 -0.56 0.02 . 1 . . . . A 99 LEU HD23 . 30677 1 959 . 1 1 99 99 LEU C C 13 174.5 0.02 . 1 . . . . A 99 LEU C . 30677 1 960 . 1 1 99 99 LEU CA C 13 52.5 0.2 . 1 . . . . A 99 LEU CA . 30677 1 961 . 1 1 99 99 LEU CB C 13 43.1 0.2 . 1 . . . . A 99 LEU CB . 30677 1 962 . 1 1 99 99 LEU CG C 13 26.4 0.2 . 1 . . . . A 99 LEU CG . 30677 1 963 . 1 1 99 99 LEU CD1 C 13 22.7 0.2 . 1 . . . . A 99 LEU CD1 . 30677 1 964 . 1 1 99 99 LEU CD2 C 13 24.3 0.2 . 1 . . . . A 99 LEU CD2 . 30677 1 965 . 1 1 99 99 LEU N N 15 126.6 0.2 . 1 . . . . A 99 LEU N . 30677 1 966 . 1 1 100 100 ARG H H 1 9.21 0.02 . 1 . . . . A 100 ARG H . 30677 1 967 . 1 1 100 100 ARG HA H 1 5.19 0.02 . 1 . . . . A 100 ARG HA . 30677 1 968 . 1 1 100 100 ARG HB2 H 1 1.65 0.02 . 2 . . . . A 100 ARG HB2 . 30677 1 969 . 1 1 100 100 ARG HB3 H 1 1.57 0.02 . 2 . . . . A 100 ARG HB3 . 30677 1 970 . 1 1 100 100 ARG HG2 H 1 1.41 0.02 . 2 . . . . A 100 ARG HG2 . 30677 1 971 . 1 1 100 100 ARG HG3 H 1 1.24 0.02 . 2 . . . . A 100 ARG HG3 . 30677 1 972 . 1 1 100 100 ARG HD2 H 1 3.23 0.02 . 2 . . . . A 100 ARG HD2 . 30677 1 973 . 1 1 100 100 ARG HD3 H 1 3.02 0.02 . 2 . . . . A 100 ARG HD3 . 30677 1 974 . 1 1 100 100 ARG C C 13 176.0 0.2 . 1 . . . . A 100 ARG C . 30677 1 975 . 1 1 100 100 ARG CA C 13 54.5 0.2 . 1 . . . . A 100 ARG CA . 30677 1 976 . 1 1 100 100 ARG CB C 13 32.2 0.2 . 1 . . . . A 100 ARG CB . 30677 1 977 . 1 1 100 100 ARG CG C 13 28.6 0.2 . 1 . . . . A 100 ARG CG . 30677 1 978 . 1 1 100 100 ARG CD C 13 43.5 0.2 . 1 . . . . A 100 ARG CD . 30677 1 979 . 1 1 100 100 ARG N N 15 121.4 0.2 . 1 . . . . A 100 ARG N . 30677 1 980 . 1 1 101 101 VAL H H 1 9.33 0.02 . 1 . . . . A 101 VAL H . 30677 1 981 . 1 1 101 101 VAL HA H 1 4.54 0.02 . 1 . . . . A 101 VAL HA . 30677 1 982 . 1 1 101 101 VAL HB H 1 2.03 0.02 . 1 . . . . A 101 VAL HB . 30677 1 983 . 1 1 101 101 VAL HG11 H 1 0.98 0.02 . 1 . . . . A 101 VAL HG11 . 30677 1 984 . 1 1 101 101 VAL HG12 H 1 0.98 0.02 . 1 . . . . A 101 VAL HG12 . 30677 1 985 . 1 1 101 101 VAL HG13 H 1 0.98 0.02 . 1 . . . . A 101 VAL HG13 . 30677 1 986 . 1 1 101 101 VAL HG21 H 1 0.76 0.02 . 1 . . . . A 101 VAL HG21 . 30677 1 987 . 1 1 101 101 VAL HG22 H 1 0.76 0.02 . 1 . . . . A 101 VAL HG22 . 30677 1 988 . 1 1 101 101 VAL HG23 H 1 0.76 0.02 . 1 . . . . A 101 VAL HG23 . 30677 1 989 . 1 1 101 101 VAL C C 13 173.2 0.2 . 1 . . . . A 101 VAL C . 30677 1 990 . 1 1 101 101 VAL CA C 13 61.7 0.2 . 1 . . . . A 101 VAL CA . 30677 1 991 . 1 1 101 101 VAL CB C 13 34.4 0.2 . 1 . . . . A 101 VAL CB . 30677 1 992 . 1 1 101 101 VAL CG1 C 13 21.8 0.2 . 1 . . . . A 101 VAL CG1 . 30677 1 993 . 1 1 101 101 VAL CG2 C 13 24.3 0.2 . 1 . . . . A 101 VAL CG2 . 30677 1 994 . 1 1 101 101 VAL N N 15 128.8 0.2 . 1 . . . . A 101 VAL N . 30677 1 995 . 1 1 102 102 ALA H H 1 8.80 0.02 . 1 . . . . A 102 ALA H . 30677 1 996 . 1 1 102 102 ALA HA H 1 4.87 0.02 . 1 . . . . A 102 ALA HA . 30677 1 997 . 1 1 102 102 ALA HB1 H 1 1.37 0.02 . 1 . . . . A 102 ALA HB1 . 30677 1 998 . 1 1 102 102 ALA HB2 H 1 1.37 0.02 . 1 . . . . A 102 ALA HB2 . 30677 1 999 . 1 1 102 102 ALA HB3 H 1 1.37 0.02 . 1 . . . . A 102 ALA HB3 . 30677 1 1000 . 1 1 102 102 ALA C C 13 175.1 0.2 . 1 . . . . A 102 ALA C . 30677 1 1001 . 1 1 102 102 ALA CA C 13 50.9 0.2 . 1 . . . . A 102 ALA CA . 30677 1 1002 . 1 1 102 102 ALA CB C 13 20.4 0.2 . 1 . . . . A 102 ALA CB . 30677 1 1003 . 1 1 102 102 ALA N N 15 131.3 0.2 . 1 . . . . A 102 ALA N . 30677 1 1004 . 1 1 103 103 LEU H H 1 8.70 0.02 . 1 . . . . A 103 LEU H . 30677 1 1005 . 1 1 103 103 LEU HB2 H 1 1.37 0.02 . 2 . . . . A 103 LEU HB2 . 30677 1 1006 . 1 1 103 103 LEU HB3 H 1 1.37 0.02 . 2 . . . . A 103 LEU HB3 . 30677 1 1007 . 1 1 103 103 LEU HG H 1 0.95 0.02 . 1 . . . . A 103 LEU HG . 30677 1 1008 . 1 1 103 103 LEU HD11 H 1 1.00 0.02 . 2 . . . . A 103 LEU HD11 . 30677 1 1009 . 1 1 103 103 LEU HD12 H 1 1.00 0.02 . 2 . . . . A 103 LEU HD12 . 30677 1 1010 . 1 1 103 103 LEU HD13 H 1 1.00 0.02 . 2 . . . . A 103 LEU HD13 . 30677 1 1011 . 1 1 103 103 LEU HD21 H 1 1.00 0.02 . 2 . . . . A 103 LEU HD21 . 30677 1 1012 . 1 1 103 103 LEU HD22 H 1 1.00 0.02 . 2 . . . . A 103 LEU HD22 . 30677 1 1013 . 1 1 103 103 LEU HD23 H 1 1.00 0.02 . 2 . . . . A 103 LEU HD23 . 30677 1 1014 . 1 1 103 103 LEU CA C 13 51.1 0.2 . 1 . . . . A 103 LEU CA . 30677 1 1015 . 1 1 103 103 LEU CB C 13 44.3 0.2 . 1 . . . . A 103 LEU CB . 30677 1 1016 . 1 1 103 103 LEU CG C 13 27.9 0.2 . 1 . . . . A 103 LEU CG . 30677 1 1017 . 1 1 103 103 LEU CD1 C 13 26.3 0.2 . 2 . . . . A 103 LEU CD1 . 30677 1 1018 . 1 1 103 103 LEU CD2 C 13 26.3 0.2 . 2 . . . . A 103 LEU CD2 . 30677 1 1019 . 1 1 103 103 LEU N N 15 125.8 0.2 . 1 . . . . A 103 LEU N . 30677 1 1020 . 1 1 104 104 PRO HA H 1 4.23 0.02 . 1 . . . . A 104 PRO HA . 30677 1 1021 . 1 1 104 104 PRO HB2 H 1 2.19 0.02 . 2 . . . . A 104 PRO HB2 . 30677 1 1022 . 1 1 104 104 PRO HB3 H 1 1.95 0.02 . 2 . . . . A 104 PRO HB3 . 30677 1 1023 . 1 1 104 104 PRO HG2 H 1 1.94 0.02 . 2 . . . . A 104 PRO HG2 . 30677 1 1024 . 1 1 104 104 PRO HG3 H 1 1.79 0.02 . 2 . . . . A 104 PRO HG3 . 30677 1 1025 . 1 1 104 104 PRO HD2 H 1 3.53 0.02 . 2 . . . . A 104 PRO HD2 . 30677 1 1026 . 1 1 104 104 PRO HD3 H 1 3.31 0.02 . 2 . . . . A 104 PRO HD3 . 30677 1 1027 . 1 1 104 104 PRO C C 13 177.6 0.2 . 1 . . . . A 104 PRO C . 30677 1 1028 . 1 1 104 104 PRO CA C 13 64.2 0.2 . 1 . . . . A 104 PRO CA . 30677 1 1029 . 1 1 104 104 PRO CB C 13 31.6 0.2 . 1 . . . . A 104 PRO CB . 30677 1 1030 . 1 1 104 104 PRO CG C 13 27.9 0.2 . 1 . . . . A 104 PRO CG . 30677 1 1031 . 1 1 104 104 PRO CD C 13 50.4 0.2 . 1 . . . . A 104 PRO CD . 30677 1 1032 . 1 1 105 105 GLY H H 1 8.62 0.02 . 1 . . . . A 105 GLY H . 30677 1 1033 . 1 1 105 105 GLY HA2 H 1 4.18 0.02 . 2 . . . . A 105 GLY HA2 . 30677 1 1034 . 1 1 105 105 GLY HA3 H 1 3.65 0.02 . 2 . . . . A 105 GLY HA3 . 30677 1 1035 . 1 1 105 105 GLY C C 13 174.5 0.2 . 1 . . . . A 105 GLY C . 30677 1 1036 . 1 1 105 105 GLY CA C 13 45.4 0.2 . 1 . . . . A 105 GLY CA . 30677 1 1037 . 1 1 105 105 GLY N N 15 110.4 0.2 . 1 . . . . A 105 GLY N . 30677 1 1038 . 1 1 106 106 LEU H H 1 7.56 0.02 . 1 . . . . A 106 LEU H . 30677 1 1039 . 1 1 106 106 LEU HA H 1 4.52 0.02 . 1 . . . . A 106 LEU HA . 30677 1 1040 . 1 1 106 106 LEU HB2 H 1 1.71 0.02 . 2 . . . . A 106 LEU HB2 . 30677 1 1041 . 1 1 106 106 LEU HB3 H 1 1.42 0.02 . 2 . . . . A 106 LEU HB3 . 30677 1 1042 . 1 1 106 106 LEU HG H 1 1.74 0.02 . 1 . . . . A 106 LEU HG . 30677 1 1043 . 1 1 106 106 LEU HD11 H 1 0.86 0.02 . 1 . . . . A 106 LEU HD11 . 30677 1 1044 . 1 1 106 106 LEU HD12 H 1 0.86 0.02 . 1 . . . . A 106 LEU HD12 . 30677 1 1045 . 1 1 106 106 LEU HD13 H 1 0.86 0.02 . 1 . . . . A 106 LEU HD13 . 30677 1 1046 . 1 1 106 106 LEU HD21 H 1 0.81 0.02 . 1 . . . . A 106 LEU HD21 . 30677 1 1047 . 1 1 106 106 LEU HD22 H 1 0.81 0.02 . 1 . . . . A 106 LEU HD22 . 30677 1 1048 . 1 1 106 106 LEU HD23 H 1 0.81 0.02 . 1 . . . . A 106 LEU HD23 . 30677 1 1049 . 1 1 106 106 LEU C C 13 174.5 0.2 . 1 . . . . A 106 LEU C . 30677 1 1050 . 1 1 106 106 LEU CA C 13 54.6 0.2 . 1 . . . . A 106 LEU CA . 30677 1 1051 . 1 1 106 106 LEU CB C 13 43.2 0.2 . 1 . . . . A 106 LEU CB . 30677 1 1052 . 1 1 106 106 LEU CG C 13 28.3 0.2 . 1 . . . . A 106 LEU CG . 30677 1 1053 . 1 1 106 106 LEU CD1 C 13 24.5 0.2 . 1 . . . . A 106 LEU CD1 . 30677 1 1054 . 1 1 106 106 LEU CD2 C 13 25.1 0.2 . 1 . . . . A 106 LEU CD2 . 30677 1 1055 . 1 1 106 106 LEU N N 15 122.1 0.2 . 1 . . . . A 106 LEU N . 30677 1 1056 . 1 1 107 107 ASP H H 1 8.47 0.02 . 1 . . . . A 107 ASP H . 30677 1 1057 . 1 1 107 107 ASP HA H 1 4.48 0.02 . 1 . . . . A 107 ASP HA . 30677 1 1058 . 1 1 107 107 ASP HB2 H 1 2.89 0.02 . 2 . . . . A 107 ASP HB2 . 30677 1 1059 . 1 1 107 107 ASP HB3 H 1 2.66 0.02 . 2 . . . . A 107 ASP HB3 . 30677 1 1060 . 1 1 107 107 ASP C C 13 175.7 0.2 . 1 . . . . A 107 ASP C . 30677 1 1061 . 1 1 107 107 ASP CA C 13 54.4 0.2 . 1 . . . . A 107 ASP CA . 30677 1 1062 . 1 1 107 107 ASP CB C 13 42.5 0.2 . 1 . . . . A 107 ASP CB . 30677 1 1063 . 1 1 107 107 ASP N N 15 123.6 0.2 . 1 . . . . A 107 ASP N . 30677 1 1064 . 1 1 108 108 ALA H H 1 8.60 0.02 . 1 . . . . A 108 ALA H . 30677 1 1065 . 1 1 108 108 ALA HA H 1 4.04 0.02 . 1 . . . . A 108 ALA HA . 30677 1 1066 . 1 1 108 108 ALA HB1 H 1 1.48 0.02 . 1 . . . . A 108 ALA HB1 . 30677 1 1067 . 1 1 108 108 ALA HB2 H 1 1.48 0.02 . 1 . . . . A 108 ALA HB2 . 30677 1 1068 . 1 1 108 108 ALA HB3 H 1 1.48 0.02 . 1 . . . . A 108 ALA HB3 . 30677 1 1069 . 1 1 108 108 ALA CA C 13 55.8 0.2 . 1 . . . . A 108 ALA CA . 30677 1 1070 . 1 1 108 108 ALA CB C 13 18.6 0.2 . 1 . . . . A 108 ALA CB . 30677 1 1071 . 1 1 108 108 ALA N N 15 124.8 0.2 . 1 . . . . A 108 ALA N . 30677 1 1072 . 1 1 109 109 ALA H H 1 8.32 0.02 . 1 . . . . A 109 ALA H . 30677 1 1073 . 1 1 109 109 ALA HA H 1 4.20 0.02 . 1 . . . . A 109 ALA HA . 30677 1 1074 . 1 1 109 109 ALA HB1 H 1 1.48 0.02 . 1 . . . . A 109 ALA HB1 . 30677 1 1075 . 1 1 109 109 ALA HB2 H 1 1.48 0.02 . 1 . . . . A 109 ALA HB2 . 30677 1 1076 . 1 1 109 109 ALA HB3 H 1 1.48 0.02 . 1 . . . . A 109 ALA HB3 . 30677 1 1077 . 1 1 109 109 ALA C C 13 180.2 0.2 . 1 . . . . A 109 ALA C . 30677 1 1078 . 1 1 109 109 ALA CA C 13 54.9 0.2 . 1 . . . . A 109 ALA CA . 30677 1 1079 . 1 1 109 109 ALA CB C 13 18.0 0.2 . 1 . . . . A 109 ALA CB . 30677 1 1080 . 1 1 109 109 ALA N N 15 120.6 0.2 . 1 . . . . A 109 ALA N . 30677 1 1081 . 1 1 110 110 ALA H H 1 7.89 0.02 . 1 . . . . A 110 ALA H . 30677 1 1082 . 1 1 110 110 ALA HA H 1 4.12 0.02 . 1 . . . . A 110 ALA HA . 30677 1 1083 . 1 1 110 110 ALA HB1 H 1 1.53 0.02 . 1 . . . . A 110 ALA HB1 . 30677 1 1084 . 1 1 110 110 ALA HB2 H 1 1.53 0.02 . 1 . . . . A 110 ALA HB2 . 30677 1 1085 . 1 1 110 110 ALA HB3 H 1 1.53 0.02 . 1 . . . . A 110 ALA HB3 . 30677 1 1086 . 1 1 110 110 ALA C C 13 180.9 0.2 . 1 . . . . A 110 ALA C . 30677 1 1087 . 1 1 110 110 ALA CA C 13 54.8 0.2 . 1 . . . . A 110 ALA CA . 30677 1 1088 . 1 1 110 110 ALA CB C 13 18.5 0.2 . 1 . . . . A 110 ALA CB . 30677 1 1089 . 1 1 110 110 ALA N N 15 122.9 0.2 . 1 . . . . A 110 ALA N . 30677 1 1090 . 1 1 111 111 ALA H H 1 8.72 0.02 . 1 . . . . A 111 ALA H . 30677 1 1091 . 1 1 111 111 ALA HA H 1 3.93 0.02 . 1 . . . . A 111 ALA HA . 30677 1 1092 . 1 1 111 111 ALA HB1 H 1 1.48 0.02 . 1 . . . . A 111 ALA HB1 . 30677 1 1093 . 1 1 111 111 ALA HB2 H 1 1.48 0.02 . 1 . . . . A 111 ALA HB2 . 30677 1 1094 . 1 1 111 111 ALA HB3 H 1 1.48 0.02 . 1 . . . . A 111 ALA HB3 . 30677 1 1095 . 1 1 111 111 ALA C C 13 178.1 0.2 . 1 . . . . A 111 ALA C . 30677 1 1096 . 1 1 111 111 ALA CA C 13 55.3 0.2 . 1 . . . . A 111 ALA CA . 30677 1 1097 . 1 1 111 111 ALA CB C 13 19.5 0.2 . 1 . . . . A 111 ALA CB . 30677 1 1098 . 1 1 111 111 ALA N N 15 121.4 0.2 . 1 . . . . A 111 ALA N . 30677 1 1099 . 1 1 112 112 LYS H H 1 8.05 0.02 . 1 . . . . A 112 LYS H . 30677 1 1100 . 1 1 112 112 LYS HA H 1 3.84 0.02 . 1 . . . . A 112 LYS HA . 30677 1 1101 . 1 1 112 112 LYS HB2 H 1 2.00 0.02 . 2 . . . . A 112 LYS HB2 . 30677 1 1102 . 1 1 112 112 LYS HB3 H 1 2.00 0.02 . 2 . . . . A 112 LYS HB3 . 30677 1 1103 . 1 1 112 112 LYS HG2 H 1 1.54 0.02 . 2 . . . . A 112 LYS HG2 . 30677 1 1104 . 1 1 112 112 LYS HG3 H 1 1.45 0.02 . 2 . . . . A 112 LYS HG3 . 30677 1 1105 . 1 1 112 112 LYS HD2 H 1 1.76 0.02 . 2 . . . . A 112 LYS HD2 . 30677 1 1106 . 1 1 112 112 LYS HD3 H 1 1.64 0.02 . 2 . . . . A 112 LYS HD3 . 30677 1 1107 . 1 1 112 112 LYS HE2 H 1 3.04 0.02 . 2 . . . . A 112 LYS HE2 . 30677 1 1108 . 1 1 112 112 LYS HE3 H 1 3.04 0.02 . 2 . . . . A 112 LYS HE3 . 30677 1 1109 . 1 1 112 112 LYS C C 13 178.1 0.2 . 1 . . . . A 112 LYS C . 30677 1 1110 . 1 1 112 112 LYS CA C 13 59.7 0.2 . 1 . . . . A 112 LYS CA . 30677 1 1111 . 1 1 112 112 LYS CB C 13 32.4 0.2 . 1 . . . . A 112 LYS CB . 30677 1 1112 . 1 1 112 112 LYS CG C 13 25.2 0.2 . 1 . . . . A 112 LYS CG . 30677 1 1113 . 1 1 112 112 LYS CD C 13 28.9 0.2 . 1 . . . . A 112 LYS CD . 30677 1 1114 . 1 1 112 112 LYS N N 15 117.4 0.2 . 1 . . . . A 112 LYS N . 30677 1 1115 . 1 1 113 113 THR H H 1 7.83 0.02 . 1 . . . . A 113 THR H . 30677 1 1116 . 1 1 113 113 THR HA H 1 4.03 0.02 . 1 . . . . A 113 THR HA . 30677 1 1117 . 1 1 113 113 THR HB H 1 4.19 0.02 . 1 . . . . A 113 THR HB . 30677 1 1118 . 1 1 113 113 THR HG21 H 1 1.25 0.02 . 1 . . . . A 113 THR HG21 . 30677 1 1119 . 1 1 113 113 THR HG22 H 1 1.25 0.02 . 1 . . . . A 113 THR HG22 . 30677 1 1120 . 1 1 113 113 THR HG23 H 1 1.25 0.02 . 1 . . . . A 113 THR HG23 . 30677 1 1121 . 1 1 113 113 THR C C 13 175.9 0.2 . 1 . . . . A 113 THR C . 30677 1 1122 . 1 1 113 113 THR CA C 13 66.6 0.2 . 1 . . . . A 113 THR CA . 30677 1 1123 . 1 1 113 113 THR CB C 13 69.0 0.2 . 1 . . . . A 113 THR CB . 30677 1 1124 . 1 1 113 113 THR CG2 C 13 21.7 0.2 . 1 . . . . A 113 THR CG2 . 30677 1 1125 . 1 1 113 113 THR N N 15 114.8 0.2 . 1 . . . . A 113 THR N . 30677 1 1126 . 1 1 114 114 LEU H H 1 7.68 0.02 . 1 . . . . A 114 LEU H . 30677 1 1127 . 1 1 114 114 LEU HA H 1 4.06 0.02 . 1 . . . . A 114 LEU HA . 30677 1 1128 . 1 1 114 114 LEU HB2 H 1 1.77 0.02 . 2 . . . . A 114 LEU HB2 . 30677 1 1129 . 1 1 114 114 LEU HB3 H 1 1.77 0.02 . 2 . . . . A 114 LEU HB3 . 30677 1 1130 . 1 1 114 114 LEU HG H 1 0.88 0.02 . 1 . . . . A 114 LEU HG . 30677 1 1131 . 1 1 114 114 LEU HD11 H 1 0.95 0.02 . 2 . . . . A 114 LEU HD11 . 30677 1 1132 . 1 1 114 114 LEU HD12 H 1 0.95 0.02 . 2 . . . . A 114 LEU HD12 . 30677 1 1133 . 1 1 114 114 LEU HD13 H 1 0.95 0.02 . 2 . . . . A 114 LEU HD13 . 30677 1 1134 . 1 1 114 114 LEU HD21 H 1 0.95 0.02 . 2 . . . . A 114 LEU HD21 . 30677 1 1135 . 1 1 114 114 LEU HD22 H 1 0.95 0.02 . 2 . . . . A 114 LEU HD22 . 30677 1 1136 . 1 1 114 114 LEU HD23 H 1 0.95 0.02 . 2 . . . . A 114 LEU HD23 . 30677 1 1137 . 1 1 114 114 LEU C C 13 178.2 0.2 . 1 . . . . A 114 LEU C . 30677 1 1138 . 1 1 114 114 LEU CA C 13 58.8 0.2 . 1 . . . . A 114 LEU CA . 30677 1 1139 . 1 1 114 114 LEU CB C 13 42.5 0.2 . 1 . . . . A 114 LEU CB . 30677 1 1140 . 1 1 114 114 LEU CG C 13 26.3 0.2 . 1 . . . . A 114 LEU CG . 30677 1 1141 . 1 1 114 114 LEU CD1 C 13 24.2 0.2 . 2 . . . . A 114 LEU CD1 . 30677 1 1142 . 1 1 114 114 LEU CD2 C 13 24.2 0.2 . 2 . . . . A 114 LEU CD2 . 30677 1 1143 . 1 1 114 114 LEU N N 15 122.8 0.2 . 1 . . . . A 114 LEU N . 30677 1 1144 . 1 1 115 115 VAL H H 1 8.25 0.02 . 1 . . . . A 115 VAL H . 30677 1 1145 . 1 1 115 115 VAL HA H 1 3.71 0.02 . 1 . . . . A 115 VAL HA . 30677 1 1146 . 1 1 115 115 VAL HB H 1 2.27 0.02 . 1 . . . . A 115 VAL HB . 30677 1 1147 . 1 1 115 115 VAL HG11 H 1 1.08 0.02 . 1 . . . . A 115 VAL HG11 . 30677 1 1148 . 1 1 115 115 VAL HG12 H 1 1.08 0.02 . 1 . . . . A 115 VAL HG12 . 30677 1 1149 . 1 1 115 115 VAL HG13 H 1 1.08 0.02 . 1 . . . . A 115 VAL HG13 . 30677 1 1150 . 1 1 115 115 VAL HG21 H 1 1.21 0.02 . 1 . . . . A 115 VAL HG21 . 30677 1 1151 . 1 1 115 115 VAL HG22 H 1 1.21 0.02 . 1 . . . . A 115 VAL HG22 . 30677 1 1152 . 1 1 115 115 VAL HG23 H 1 1.21 0.02 . 1 . . . . A 115 VAL HG23 . 30677 1 1153 . 1 1 115 115 VAL CA C 13 67.2 0.2 . 1 . . . . A 115 VAL CA . 30677 1 1154 . 1 1 115 115 VAL CG1 C 13 22.7 0.2 . 1 . . . . A 115 VAL CG1 . 30677 1 1155 . 1 1 115 115 VAL CG2 C 13 24.1 0.2 . 1 . . . . A 115 VAL CG2 . 30677 1 1156 . 1 1 115 115 VAL N N 15 118.4 0.2 . 1 . . . . A 115 VAL N . 30677 1 1157 . 1 1 116 116 ASP H H 1 8.46 0.02 . 1 . . . . A 116 ASP H . 30677 1 1158 . 1 1 116 116 ASP HA H 1 4.49 0.02 . 1 . . . . A 116 ASP HA . 30677 1 1159 . 1 1 116 116 ASP HB2 H 1 2.89 0.02 . 2 . . . . A 116 ASP HB2 . 30677 1 1160 . 1 1 116 116 ASP HB3 H 1 2.70 0.02 . 2 . . . . A 116 ASP HB3 . 30677 1 1161 . 1 1 116 116 ASP C C 13 179.9 0.2 . 1 . . . . A 116 ASP C . 30677 1 1162 . 1 1 116 116 ASP CA C 13 57.9 0.2 . 1 . . . . A 116 ASP CA . 30677 1 1163 . 1 1 116 116 ASP CB C 13 40.7 0.2 . 1 . . . . A 116 ASP CB . 30677 1 1164 . 1 1 116 116 ASP N N 15 120.3 0.2 . 1 . . . . A 116 ASP N . 30677 1 1165 . 1 1 117 117 ARG H H 1 8.21 0.02 . 1 . . . . A 117 ARG H . 30677 1 1166 . 1 1 117 117 ARG HA H 1 4.21 0.02 . 1 . . . . A 117 ARG HA . 30677 1 1167 . 1 1 117 117 ARG HB2 H 1 2.08 0.02 . 2 . . . . A 117 ARG HB2 . 30677 1 1168 . 1 1 117 117 ARG HB3 H 1 1.98 0.02 . 2 . . . . A 117 ARG HB3 . 30677 1 1169 . 1 1 117 117 ARG HG2 H 1 1.97 0.02 . 2 . . . . A 117 ARG HG2 . 30677 1 1170 . 1 1 117 117 ARG HG3 H 1 1.82 0.02 . 2 . . . . A 117 ARG HG3 . 30677 1 1171 . 1 1 117 117 ARG HD2 H 1 3.21 0.02 . 2 . . . . A 117 ARG HD2 . 30677 1 1172 . 1 1 117 117 ARG HD3 H 1 3.13 0.02 . 2 . . . . A 117 ARG HD3 . 30677 1 1173 . 1 1 117 117 ARG C C 13 180.1 0.2 . 1 . . . . A 117 ARG C . 30677 1 1174 . 1 1 117 117 ARG CA C 13 59.0 0.2 . 1 . . . . A 117 ARG CA . 30677 1 1175 . 1 1 117 117 ARG CB C 13 30.4 0.2 . 1 . . . . A 117 ARG CB . 30677 1 1176 . 1 1 117 117 ARG CG C 13 27.7 0.2 . 1 . . . . A 117 ARG CG . 30677 1 1177 . 1 1 117 117 ARG CD C 13 43.2 0.2 . 1 . . . . A 117 ARG CD . 30677 1 1178 . 1 1 117 117 ARG N N 15 119.0 0.2 . 1 . . . . A 117 ARG N . 30677 1 1179 . 1 1 118 118 ALA H H 1 8.80 0.02 . 1 . . . . A 118 ALA H . 30677 1 1180 . 1 1 118 118 ALA HA H 1 3.79 0.02 . 1 . . . . A 118 ALA HA . 30677 1 1181 . 1 1 118 118 ALA HB1 H 1 0.95 0.02 . 1 . . . . A 118 ALA HB1 . 30677 1 1182 . 1 1 118 118 ALA HB2 H 1 0.95 0.02 . 1 . . . . A 118 ALA HB2 . 30677 1 1183 . 1 1 118 118 ALA HB3 H 1 0.95 0.02 . 1 . . . . A 118 ALA HB3 . 30677 1 1184 . 1 1 118 118 ALA C C 13 178.5 0.2 . 1 . . . . A 118 ALA C . 30677 1 1185 . 1 1 118 118 ALA CA C 13 55.3 0.2 . 1 . . . . A 118 ALA CA . 30677 1 1186 . 1 1 118 118 ALA CB C 13 18.4 0.2 . 1 . . . . A 118 ALA CB . 30677 1 1187 . 1 1 118 118 ALA N N 15 124.0 0.2 . 1 . . . . A 118 ALA N . 30677 1 1188 . 1 1 119 119 HIS H H 1 8.41 0.02 . 1 . . . . A 119 HIS H . 30677 1 1189 . 1 1 119 119 HIS HA H 1 4.98 0.02 . 1 . . . . A 119 HIS HA . 30677 1 1190 . 1 1 119 119 HIS HB2 H 1 3.56 0.02 . 2 . . . . A 119 HIS HB2 . 30677 1 1191 . 1 1 119 119 HIS HB3 H 1 3.38 0.02 . 2 . . . . A 119 HIS HB3 . 30677 1 1192 . 1 1 119 119 HIS HD2 H 1 7.13 0.02 . 1 . . . . A 119 HIS HD2 . 30677 1 1193 . 1 1 119 119 HIS C C 13 175.9 0.2 . 1 . . . . A 119 HIS C . 30677 1 1194 . 1 1 119 119 HIS CA C 13 56.7 0.2 . 1 . . . . A 119 HIS CA . 30677 1 1195 . 1 1 119 119 HIS CD2 C 13 118.5 0.2 . 1 . . . . A 119 HIS CD2 . 30677 1 1196 . 1 1 119 119 HIS N N 15 118.0 0.2 . 1 . . . . A 119 HIS N . 30677 1 1197 . 1 1 120 120 HIS H H 1 7.64 0.02 . 1 . . . . A 120 HIS H . 30677 1 1198 . 1 1 120 120 HIS HA H 1 4.43 0.02 . 1 . . . . A 120 HIS HA . 30677 1 1199 . 1 1 120 120 HIS HB2 H 1 3.46 0.02 . 2 . . . . A 120 HIS HB2 . 30677 1 1200 . 1 1 120 120 HIS HB3 H 1 3.14 0.02 . 2 . . . . A 120 HIS HB3 . 30677 1 1201 . 1 1 120 120 HIS HD2 H 1 7.18 0.02 . 1 . . . . A 120 HIS HD2 . 30677 1 1202 . 1 1 120 120 HIS C C 13 175.1 0.2 . 1 . . . . A 120 HIS C . 30677 1 1203 . 1 1 120 120 HIS CA C 13 58.1 0.2 . 1 . . . . A 120 HIS CA . 30677 1 1204 . 1 1 120 120 HIS CB C 13 30.7 0.2 . 1 . . . . A 120 HIS CB . 30677 1 1205 . 1 1 120 120 HIS CD2 C 13 120.4 0.2 . 1 . . . . A 120 HIS CD2 . 30677 1 1206 . 1 1 120 120 HIS N N 15 115.1 0.2 . 1 . . . . A 120 HIS N . 30677 1 1207 . 1 1 121 121 VAL H H 1 7.40 0.02 . 1 . . . . A 121 VAL H . 30677 1 1208 . 1 1 121 121 VAL HA H 1 4.06 0.02 . 1 . . . . A 121 VAL HA . 30677 1 1209 . 1 1 121 121 VAL HB H 1 2.17 0.02 . 1 . . . . A 121 VAL HB . 30677 1 1210 . 1 1 121 121 VAL HG11 H 1 1.07 0.02 . 1 . . . . A 121 VAL HG11 . 30677 1 1211 . 1 1 121 121 VAL HG12 H 1 1.07 0.02 . 1 . . . . A 121 VAL HG12 . 30677 1 1212 . 1 1 121 121 VAL HG13 H 1 1.07 0.02 . 1 . . . . A 121 VAL HG13 . 30677 1 1213 . 1 1 121 121 VAL HG21 H 1 1.18 0.02 . 1 . . . . A 121 VAL HG21 . 30677 1 1214 . 1 1 121 121 VAL HG22 H 1 1.18 0.02 . 1 . . . . A 121 VAL HG22 . 30677 1 1215 . 1 1 121 121 VAL HG23 H 1 1.18 0.02 . 1 . . . . A 121 VAL HG23 . 30677 1 1216 . 1 1 121 121 VAL CA C 13 63.7 0.2 . 1 . . . . A 121 VAL CA . 30677 1 1217 . 1 1 121 121 VAL CB C 13 34.5 0.2 . 1 . . . . A 121 VAL CB . 30677 1 1218 . 1 1 121 121 VAL CG1 C 13 21.8 0.2 . 1 . . . . A 121 VAL CG1 . 30677 1 1219 . 1 1 121 121 VAL N N 15 117.0 0.2 . 1 . . . . A 121 VAL N . 30677 1 1220 . 1 1 122 122 CYS H H 1 8.03 0.02 . 1 . . . . A 122 CYS H . 30677 1 1221 . 1 1 122 122 CYS CA C 13 55.8 0.2 . 1 . . . . A 122 CYS CA . 30677 1 1222 . 1 1 122 122 CYS CB C 13 31.0 0.2 . 1 . . . . A 122 CYS CB . 30677 1 1223 . 1 1 122 122 CYS N N 15 120.2 0.2 . 1 . . . . A 122 CYS N . 30677 1 1224 . 1 1 124 124 TYR HD1 H 1 6.73 0.02 . 3 . . . . A 124 TYR HD1 . 30677 1 1225 . 1 1 124 124 TYR HD2 H 1 6.73 0.02 . 3 . . . . A 124 TYR HD2 . 30677 1 1226 . 1 1 124 124 TYR HE1 H 1 6.13 0.02 . 3 . . . . A 124 TYR HE1 . 30677 1 1227 . 1 1 124 124 TYR HE2 H 1 6.13 0.02 . 3 . . . . A 124 TYR HE2 . 30677 1 1228 . 1 1 124 124 TYR CD1 C 13 132.2 0.2 . 3 . . . . A 124 TYR CD1 . 30677 1 1229 . 1 1 124 124 TYR CD2 C 13 132.2 0.2 . 3 . . . . A 124 TYR CD2 . 30677 1 1230 . 1 1 124 124 TYR CE1 C 13 118.5 0.2 . 3 . . . . A 124 TYR CE1 . 30677 1 1231 . 1 1 124 124 TYR CE2 C 13 118.5 0.2 . 3 . . . . A 124 TYR CE2 . 30677 1 1232 . 1 1 126 126 ASN H H 1 8.02 0.02 . 1 . . . . A 126 ASN H . 30677 1 1233 . 1 1 126 126 ASN HA H 1 4.39 0.02 . 1 . . . . A 126 ASN HA . 30677 1 1234 . 1 1 126 126 ASN HB2 H 1 2.81 0.02 . 2 . . . . A 126 ASN HB2 . 30677 1 1235 . 1 1 126 126 ASN HB3 H 1 2.64 0.02 . 2 . . . . A 126 ASN HB3 . 30677 1 1236 . 1 1 126 126 ASN C C 13 177.0 0.2 . 1 . . . . A 126 ASN C . 30677 1 1237 . 1 1 126 126 ASN CA C 13 56.5 0.2 . 1 . . . . A 126 ASN CA . 30677 1 1238 . 1 1 126 126 ASN CB C 13 37.7 0.2 . 1 . . . . A 126 ASN CB . 30677 1 1239 . 1 1 126 126 ASN N N 15 120.5 0.2 . 1 . . . . A 126 ASN N . 30677 1 1240 . 1 1 127 127 ALA H H 1 8.08 0.02 . 1 . . . . A 127 ALA H . 30677 1 1241 . 1 1 127 127 ALA HA H 1 4.01 0.02 . 1 . . . . A 127 ALA HA . 30677 1 1242 . 1 1 127 127 ALA HB1 H 1 1.32 0.02 . 1 . . . . A 127 ALA HB1 . 30677 1 1243 . 1 1 127 127 ALA HB2 H 1 1.32 0.02 . 1 . . . . A 127 ALA HB2 . 30677 1 1244 . 1 1 127 127 ALA HB3 H 1 1.32 0.02 . 1 . . . . A 127 ALA HB3 . 30677 1 1245 . 1 1 127 127 ALA C C 13 178.2 0.2 . 1 . . . . A 127 ALA C . 30677 1 1246 . 1 1 127 127 ALA CA C 13 54.8 0.2 . 1 . . . . A 127 ALA CA . 30677 1 1247 . 1 1 127 127 ALA CB C 13 19.0 0.2 . 1 . . . . A 127 ALA CB . 30677 1 1248 . 1 1 127 127 ALA N N 15 118.9 0.2 . 1 . . . . A 127 ALA N . 30677 1 1249 . 1 1 128 128 THR H H 1 6.91 0.02 . 1 . . . . A 128 THR H . 30677 1 1250 . 1 1 128 128 THR HA H 1 5.26 0.02 . 1 . . . . A 128 THR HA . 30677 1 1251 . 1 1 128 128 THR HB H 1 4.57 0.02 . 1 . . . . A 128 THR HB . 30677 1 1252 . 1 1 128 128 THR HG21 H 1 1.18 0.02 . 1 . . . . A 128 THR HG21 . 30677 1 1253 . 1 1 128 128 THR HG22 H 1 1.18 0.02 . 1 . . . . A 128 THR HG22 . 30677 1 1254 . 1 1 128 128 THR HG23 H 1 1.18 0.02 . 1 . . . . A 128 THR HG23 . 30677 1 1255 . 1 1 128 128 THR C C 13 174.2 0.2 . 1 . . . . A 128 THR C . 30677 1 1256 . 1 1 128 128 THR CA C 13 60.5 0.2 . 1 . . . . A 128 THR CA . 30677 1 1257 . 1 1 128 128 THR CB C 13 70.7 0.2 . 1 . . . . A 128 THR CB . 30677 1 1258 . 1 1 128 128 THR CG2 C 13 20.7 0.2 . 1 . . . . A 128 THR CG2 . 30677 1 1259 . 1 1 128 128 THR N N 15 102.1 0.2 . 1 . . . . A 128 THR N . 30677 1 1260 . 1 1 129 129 ARG H H 1 6.73 0.02 . 1 . . . . A 129 ARG H . 30677 1 1261 . 1 1 129 129 ARG HA H 1 4.02 0.02 . 1 . . . . A 129 ARG HA . 30677 1 1262 . 1 1 129 129 ARG HB2 H 1 1.94 0.02 . 2 . . . . A 129 ARG HB2 . 30677 1 1263 . 1 1 129 129 ARG HB3 H 1 1.82 0.02 . 2 . . . . A 129 ARG HB3 . 30677 1 1264 . 1 1 129 129 ARG HG2 H 1 1.78 0.02 . 2 . . . . A 129 ARG HG2 . 30677 1 1265 . 1 1 129 129 ARG HG3 H 1 1.69 0.02 . 2 . . . . A 129 ARG HG3 . 30677 1 1266 . 1 1 129 129 ARG HD2 H 1 3.24 0.02 . 2 . . . . A 129 ARG HD2 . 30677 1 1267 . 1 1 129 129 ARG HD3 H 1 3.18 0.02 . 2 . . . . A 129 ARG HD3 . 30677 1 1268 . 1 1 129 129 ARG C C 13 177.8 0.2 . 1 . . . . A 129 ARG C . 30677 1 1269 . 1 1 129 129 ARG CA C 13 57.5 0.2 . 1 . . . . A 129 ARG CA . 30677 1 1270 . 1 1 129 129 ARG CB C 13 29.6 0.2 . 1 . . . . A 129 ARG CB . 30677 1 1271 . 1 1 129 129 ARG CG C 13 25.8 0.2 . 1 . . . . A 129 ARG CG . 30677 1 1272 . 1 1 129 129 ARG CD C 13 42.6 0.2 . 1 . . . . A 129 ARG CD . 30677 1 1273 . 1 1 129 129 ARG N N 15 124.9 0.2 . 1 . . . . A 129 ARG N . 30677 1 1274 . 1 1 130 130 ASN H H 1 9.11 0.02 . 1 . . . . A 130 ASN H . 30677 1 1275 . 1 1 130 130 ASN HA H 1 4.21 0.02 . 1 . . . . A 130 ASN HA . 30677 1 1276 . 1 1 130 130 ASN HB2 H 1 3.60 0.02 . 2 . . . . A 130 ASN HB2 . 30677 1 1277 . 1 1 130 130 ASN HB3 H 1 2.79 0.02 . 2 . . . . A 130 ASN HB3 . 30677 1 1278 . 1 1 130 130 ASN HD21 H 1 8.18 0.02 . 2 . . . . A 130 ASN HD21 . 30677 1 1279 . 1 1 130 130 ASN HD22 H 1 7.10 0.02 . 2 . . . . A 130 ASN HD22 . 30677 1 1280 . 1 1 130 130 ASN C C 13 175.1 0.2 . 1 . . . . A 130 ASN C . 30677 1 1281 . 1 1 130 130 ASN CA C 13 57.8 0.2 . 1 . . . . A 130 ASN CA . 30677 1 1282 . 1 1 130 130 ASN CB C 13 37.8 0.2 . 1 . . . . A 130 ASN CB . 30677 1 1283 . 1 1 130 130 ASN N N 15 118.6 0.2 . 1 . . . . A 130 ASN N . 30677 1 1284 . 1 1 130 130 ASN ND2 N 15 116.9 0.2 . 1 . . . . A 130 ASN ND2 . 30677 1 1285 . 1 1 131 131 ASN H H 1 8.44 0.02 . 1 . . . . A 131 ASN H . 30677 1 1286 . 1 1 131 131 ASN HA H 1 4.01 0.02 . 1 . . . . A 131 ASN HA . 30677 1 1287 . 1 1 131 131 ASN HB2 H 1 3.06 0.02 . 2 . . . . A 131 ASN HB2 . 30677 1 1288 . 1 1 131 131 ASN HB3 H 1 2.97 0.02 . 2 . . . . A 131 ASN HB3 . 30677 1 1289 . 1 1 131 131 ASN C C 13 175.3 0.2 . 1 . . . . A 131 ASN C . 30677 1 1290 . 1 1 131 131 ASN CA C 13 54.5 0.2 . 1 . . . . A 131 ASN CA . 30677 1 1291 . 1 1 131 131 ASN CB C 13 40.2 0.2 . 1 . . . . A 131 ASN CB . 30677 1 1292 . 1 1 131 131 ASN N N 15 119.0 0.2 . 1 . . . . A 131 ASN N . 30677 1 1293 . 1 1 132 132 VAL H H 1 8.03 0.02 . 1 . . . . A 132 VAL H . 30677 1 1294 . 1 1 132 132 VAL HA H 1 4.32 0.02 . 1 . . . . A 132 VAL HA . 30677 1 1295 . 1 1 132 132 VAL HB H 1 2.15 0.02 . 1 . . . . A 132 VAL HB . 30677 1 1296 . 1 1 132 132 VAL HG11 H 1 1.04 0.02 . 2 . . . . A 132 VAL HG11 . 30677 1 1297 . 1 1 132 132 VAL HG12 H 1 1.04 0.02 . 2 . . . . A 132 VAL HG12 . 30677 1 1298 . 1 1 132 132 VAL HG13 H 1 1.04 0.02 . 2 . . . . A 132 VAL HG13 . 30677 1 1299 . 1 1 132 132 VAL HG21 H 1 1.04 0.02 . 2 . . . . A 132 VAL HG21 . 30677 1 1300 . 1 1 132 132 VAL HG22 H 1 1.04 0.02 . 2 . . . . A 132 VAL HG22 . 30677 1 1301 . 1 1 132 132 VAL HG23 H 1 1.04 0.02 . 2 . . . . A 132 VAL HG23 . 30677 1 1302 . 1 1 132 132 VAL C C 13 174.9 0.2 . 1 . . . . A 132 VAL C . 30677 1 1303 . 1 1 132 132 VAL CA C 13 60.6 0.2 . 1 . . . . A 132 VAL CA . 30677 1 1304 . 1 1 132 132 VAL CG1 C 13 21.7 0.2 . 2 . . . . A 132 VAL CG1 . 30677 1 1305 . 1 1 132 132 VAL CG2 C 13 21.7 0.2 . 2 . . . . A 132 VAL CG2 . 30677 1 1306 . 1 1 132 132 VAL N N 15 119.0 0.2 . 1 . . . . A 132 VAL N . 30677 1 1307 . 1 1 133 133 ALA H H 1 9.09 0.02 . 1 . . . . A 133 ALA H . 30677 1 1308 . 1 1 133 133 ALA HA H 1 4.62 0.02 . 1 . . . . A 133 ALA HA . 30677 1 1309 . 1 1 133 133 ALA HB1 H 1 1.33 0.02 . 1 . . . . A 133 ALA HB1 . 30677 1 1310 . 1 1 133 133 ALA HB2 H 1 1.33 0.02 . 1 . . . . A 133 ALA HB2 . 30677 1 1311 . 1 1 133 133 ALA HB3 H 1 1.33 0.02 . 1 . . . . A 133 ALA HB3 . 30677 1 1312 . 1 1 133 133 ALA C C 13 176.6 0.2 . 1 . . . . A 133 ALA C . 30677 1 1313 . 1 1 133 133 ALA CA C 13 50.5 0.2 . 1 . . . . A 133 ALA CA . 30677 1 1314 . 1 1 133 133 ALA CB C 13 16.3 0.2 . 1 . . . . A 133 ALA CB . 30677 1 1315 . 1 1 133 133 ALA N N 15 133.9 0.2 . 1 . . . . A 133 ALA N . 30677 1 1316 . 1 1 134 134 VAL H H 1 7.78 0.02 . 1 . . . . A 134 VAL H . 30677 1 1317 . 1 1 134 134 VAL HA H 1 3.99 0.02 . 1 . . . . A 134 VAL HA . 30677 1 1318 . 1 1 134 134 VAL HB H 1 1.98 0.02 . 1 . . . . A 134 VAL HB . 30677 1 1319 . 1 1 134 134 VAL HG11 H 1 0.63 0.02 . 1 . . . . A 134 VAL HG11 . 30677 1 1320 . 1 1 134 134 VAL HG12 H 1 0.63 0.02 . 1 . . . . A 134 VAL HG12 . 30677 1 1321 . 1 1 134 134 VAL HG13 H 1 0.63 0.02 . 1 . . . . A 134 VAL HG13 . 30677 1 1322 . 1 1 134 134 VAL HG21 H 1 1.16 0.2 . 1 . . . . A 134 VAL HG21 . 30677 1 1323 . 1 1 134 134 VAL HG22 H 1 1.16 0.2 . 1 . . . . A 134 VAL HG22 . 30677 1 1324 . 1 1 134 134 VAL HG23 H 1 1.16 0.2 . 1 . . . . A 134 VAL HG23 . 30677 1 1325 . 1 1 134 134 VAL C C 13 176.6 0.2 . 1 . . . . A 134 VAL C . 30677 1 1326 . 1 1 134 134 VAL CA C 13 63.9 0.2 . 1 . . . . A 134 VAL CA . 30677 1 1327 . 1 1 134 134 VAL CB C 13 32.7 0.2 . 1 . . . . A 134 VAL CB . 30677 1 1328 . 1 1 134 134 VAL CG1 C 13 20.4 0.2 . 1 . . . . A 134 VAL CG1 . 30677 1 1329 . 1 1 134 134 VAL CG2 C 13 21.6 0.2 . 1 . . . . A 134 VAL CG2 . 30677 1 1330 . 1 1 134 134 VAL N N 15 125.4 0.2 . 1 . . . . A 134 VAL N . 30677 1 1331 . 1 1 135 135 ARG H H 1 8.21 0.02 . 1 . . . . A 135 ARG H . 30677 1 1332 . 1 1 135 135 ARG HA H 1 4.45 0.02 . 1 . . . . A 135 ARG HA . 30677 1 1333 . 1 1 135 135 ARG HB2 H 1 2.26 0.02 . 2 . . . . A 135 ARG HB2 . 30677 1 1334 . 1 1 135 135 ARG HB3 H 1 1.96 0.02 . 2 . . . . A 135 ARG HB3 . 30677 1 1335 . 1 1 135 135 ARG HD2 H 1 3.64 0.02 . 2 . . . . A 135 ARG HD2 . 30677 1 1336 . 1 1 135 135 ARG HD3 H 1 3.64 0.02 . 2 . . . . A 135 ARG HD3 . 30677 1 1337 . 1 1 135 135 ARG C C 13 174.0 0.2 . 1 . . . . A 135 ARG C . 30677 1 1338 . 1 1 135 135 ARG CA C 13 55.6 0.2 . 1 . . . . A 135 ARG CA . 30677 1 1339 . 1 1 135 135 ARG CB C 13 32.1 0.2 . 1 . . . . A 135 ARG CB . 30677 1 1340 . 1 1 135 135 ARG N N 15 129.6 0.2 . 1 . . . . A 135 ARG N . 30677 1 1341 . 1 1 136 136 LEU H H 1 8.31 0.02 . 1 . . . . A 136 LEU H . 30677 1 1342 . 1 1 136 136 LEU HA H 1 4.71 0.02 . 1 . . . . A 136 LEU HA . 30677 1 1343 . 1 1 136 136 LEU HB2 H 1 1.56 0.02 . 2 . . . . A 136 LEU HB2 . 30677 1 1344 . 1 1 136 136 LEU HB3 H 1 0.95 0.02 . 2 . . . . A 136 LEU HB3 . 30677 1 1345 . 1 1 136 136 LEU HG H 1 1.13 0.02 . 1 . . . . A 136 LEU HG . 30677 1 1346 . 1 1 136 136 LEU HD11 H 1 0.46 0.02 . 2 . . . . A 136 LEU HD11 . 30677 1 1347 . 1 1 136 136 LEU HD12 H 1 0.46 0.02 . 2 . . . . A 136 LEU HD12 . 30677 1 1348 . 1 1 136 136 LEU HD13 H 1 0.46 0.02 . 2 . . . . A 136 LEU HD13 . 30677 1 1349 . 1 1 136 136 LEU HD21 H 1 0.15 0.02 . 2 . . . . A 136 LEU HD21 . 30677 1 1350 . 1 1 136 136 LEU HD22 H 1 0.15 0.02 . 2 . . . . A 136 LEU HD22 . 30677 1 1351 . 1 1 136 136 LEU HD23 H 1 0.15 0.02 . 2 . . . . A 136 LEU HD23 . 30677 1 1352 . 1 1 136 136 LEU C C 13 175.9 0.2 . 1 . . . . A 136 LEU C . 30677 1 1353 . 1 1 136 136 LEU CA C 13 53.8 0.2 . 1 . . . . A 136 LEU CA . 30677 1 1354 . 1 1 136 136 LEU CB C 13 43.1 0.2 . 1 . . . . A 136 LEU CB . 30677 1 1355 . 1 1 136 136 LEU CG C 13 26.6 0.2 . 1 . . . . A 136 LEU CG . 30677 1 1356 . 1 1 136 136 LEU CD1 C 13 24.9 0.2 . 2 . . . . A 136 LEU CD1 . 30677 1 1357 . 1 1 136 136 LEU CD2 C 13 24.5 0.2 . 2 . . . . A 136 LEU CD2 . 30677 1 1358 . 1 1 136 136 LEU N N 15 123.3 0.2 . 1 . . . . A 136 LEU N . 30677 1 1359 . 1 1 137 137 VAL H H 1 9.04 0.02 . 1 . . . . A 137 VAL H . 30677 1 1360 . 1 1 137 137 VAL HA H 1 4.19 0.02 . 1 . . . . A 137 VAL HA . 30677 1 1361 . 1 1 137 137 VAL HB H 1 1.91 0.02 . 1 . . . . A 137 VAL HB . 30677 1 1362 . 1 1 137 137 VAL HG11 H 1 0.71 0.02 . 2 . . . . A 137 VAL HG11 . 30677 1 1363 . 1 1 137 137 VAL HG12 H 1 0.71 0.02 . 2 . . . . A 137 VAL HG12 . 30677 1 1364 . 1 1 137 137 VAL HG13 H 1 0.71 0.02 . 2 . . . . A 137 VAL HG13 . 30677 1 1365 . 1 1 137 137 VAL HG21 H 1 0.79 0.02 . 2 . . . . A 137 VAL HG21 . 30677 1 1366 . 1 1 137 137 VAL HG22 H 1 0.79 0.02 . 2 . . . . A 137 VAL HG22 . 30677 1 1367 . 1 1 137 137 VAL HG23 H 1 0.79 0.02 . 2 . . . . A 137 VAL HG23 . 30677 1 1368 . 1 1 137 137 VAL C C 13 174.2 0.2 . 1 . . . . A 137 VAL C . 30677 1 1369 . 1 1 137 137 VAL CA C 13 61.5 0.2 . 1 . . . . A 137 VAL CA . 30677 1 1370 . 1 1 137 137 VAL CB C 13 35.2 0.2 . 1 . . . . A 137 VAL CB . 30677 1 1371 . 1 1 137 137 VAL CG1 C 13 20.2 0.2 . . . . . . A 137 VAL CG1 . 30677 1 1372 . 1 1 137 137 VAL CG2 C 13 20.6 0.2 . . . . . . A 137 VAL CG2 . 30677 1 1373 . 1 1 137 137 VAL N N 15 126.9 0.2 . 1 . . . . A 137 VAL N . 30677 1 1374 . 1 1 138 138 VAL H H 1 8.52 0.02 . 1 . . . . A 138 VAL H . 30677 1 1375 . 1 1 138 138 VAL HA H 1 4.55 0.02 . 1 . . . . A 138 VAL HA . 30677 1 1376 . 1 1 138 138 VAL HB H 1 2.00 0.02 . 1 . . . . A 138 VAL HB . 30677 1 1377 . 1 1 138 138 VAL HG11 H 1 0.97 0.02 . 2 . . . . A 138 VAL HG11 . 30677 1 1378 . 1 1 138 138 VAL HG12 H 1 0.97 0.02 . 2 . . . . A 138 VAL HG12 . 30677 1 1379 . 1 1 138 138 VAL HG13 H 1 0.97 0.02 . 2 . . . . A 138 VAL HG13 . 30677 1 1380 . 1 1 138 138 VAL HG21 H 1 0.84 0.02 . 2 . . . . A 138 VAL HG21 . 30677 1 1381 . 1 1 138 138 VAL HG22 H 1 0.84 0.02 . 2 . . . . A 138 VAL HG22 . 30677 1 1382 . 1 1 138 138 VAL HG23 H 1 0.84 0.02 . 2 . . . . A 138 VAL HG23 . 30677 1 1383 . 1 1 138 138 VAL C C 13 174.9 0.2 . 1 . . . . A 138 VAL C . 30677 1 1384 . 1 1 138 138 VAL CA C 13 61.8 0.2 . 1 . . . . A 138 VAL CA . 30677 1 1385 . 1 1 138 138 VAL CB C 13 32.5 0.2 . 1 . . . . A 138 VAL CB . 30677 1 1386 . 1 1 138 138 VAL CG1 C 13 21.8 0.2 . . . . . . A 138 VAL CG1 . 30677 1 1387 . 1 1 138 138 VAL CG2 C 13 21.5 0.2 . . . . . . A 138 VAL CG2 . 30677 1 1388 . 1 1 138 138 VAL N N 15 128.9 0.2 . 1 . . . . A 138 VAL N . 30677 1 1389 . 1 1 139 139 ALA H H 1 8.74 0.02 . 1 . . . . A 139 ALA H . 30677 1 1390 . 1 1 139 139 ALA HA H 1 4.08 0.02 . 1 . . . . A 139 ALA HA . 30677 1 1391 . 1 1 139 139 ALA HB1 H 1 1.22 0.02 . 1 . . . . A 139 ALA HB1 . 30677 1 1392 . 1 1 139 139 ALA HB2 H 1 1.22 0.02 . 1 . . . . A 139 ALA HB2 . 30677 1 1393 . 1 1 139 139 ALA HB3 H 1 1.22 0.02 . 1 . . . . A 139 ALA HB3 . 30677 1 1394 . 1 1 139 139 ALA CA C 13 53.8 0.2 . 1 . . . . A 139 ALA CA . 30677 1 1395 . 1 1 139 139 ALA CB C 13 20.3 0.2 . 1 . . . . A 139 ALA CB . 30677 1 1396 . 1 1 139 139 ALA N N 15 137.9 0.2 . 1 . . . . A 139 ALA N . 30677 1 stop_ save_