data_52770 ####################### # Entry information # ####################### save_entry_information_1 _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information_1 _Entry.ID 52770 _Entry.Title ; Cora10501_Q3OR ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2024-12-20 _Entry.Accession_date 2024-12-20 _Entry.Last_release_date 2024-12-20 _Entry.Original_release_date 2024-12-20 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.14.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 Julian Hendrich . . . . 52770 2 Kristian Schweimer . . . . 52770 3 Birgitta Woehrl . . . . 52770 4 Hatice Kara . . . . 52770 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 52770 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 371 52770 '15N chemical shifts' 137 52770 '1H chemical shifts' 779 52770 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 . . 2025-11-18 . original BMRB . 52770 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 52769 Cora10401_3CS 52770 BMRB 52771 Cora10501_Q3OGlc 52770 BMRB 52772 Cora10501 52770 stop_ save_ ############### # Citations # ############### save_citations_1 _Citation.Sf_category citations _Citation.Sf_framecode citations_1 _Citation.Entry_ID 52770 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 40686861 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; Identification of glycosylated flavonoids as new physiological ligands of the hazel allergen Cor a 1: Complex structures reveal different binding orientation and specificity of mono- and disaccharide derivatives ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Food Chem. X' _Citation.Journal_name_full 'Food chemistry: X' _Citation.Journal_volume 29 _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN 2590-1575 _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 102711 _Citation.Page_last 102711 _Citation.Year 2025 _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 Julian Hendrich . . . . 52770 1 2 Hatice Kara . . . . 52770 1 3 Kristian Schweimer . . . . 52770 1 4 Thessa Jacob . . . . 52770 1 5 Maike Schneider . . . . 52770 1 6 Susanne Baldermann . . . . 52770 1 7 Birgitta Woehrl . . . . 52770 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly_1 _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly_1 _Assembly.Entry_ID 52770 _Assembly.ID 1 _Assembly.Name Cora10501_Q3OR _Assembly.BMRB_code . _Assembly.Number_of_components 2 _Assembly.Organic_ligands 1 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states no _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange no _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details 'Quercetin-3-O-rhamnoside; C21H20O11; MW: 448.10.' _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 'Cor A 1.0501' 1 $entity_1 . . yes native no no . . . 52770 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 52770 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity_1 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MGVHTLSDEFTSPIPAPKLF KALILDADNLLPKLLPQAIK SIETIEGDGGPGTIKKITIA EGTHIKHLKHRIDAVEEEKL TYSYTLIEGDDLLDKFESIS YEIKFESSPDGGAKCTNLSK YHPKPGVQINEEEIKASKEK GMAVYRAVEAFLLANPEAYA ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 160 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _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 . 52770 1 2 . GLY . 52770 1 3 . VAL . 52770 1 4 . HIS . 52770 1 5 . THR . 52770 1 6 . LEU . 52770 1 7 . SER . 52770 1 8 . ASP . 52770 1 9 . GLU . 52770 1 10 . PHE . 52770 1 11 . THR . 52770 1 12 . SER . 52770 1 13 . PRO . 52770 1 14 . ILE . 52770 1 15 . PRO . 52770 1 16 . ALA . 52770 1 17 . PRO . 52770 1 18 . LYS . 52770 1 19 . LEU . 52770 1 20 . PHE . 52770 1 21 . LYS . 52770 1 22 . ALA . 52770 1 23 . LEU . 52770 1 24 . ILE . 52770 1 25 . LEU . 52770 1 26 . ASP . 52770 1 27 . ALA . 52770 1 28 . ASP . 52770 1 29 . ASN . 52770 1 30 . LEU . 52770 1 31 . LEU . 52770 1 32 . PRO . 52770 1 33 . LYS . 52770 1 34 . LEU . 52770 1 35 . LEU . 52770 1 36 . PRO . 52770 1 37 . GLN . 52770 1 38 . ALA . 52770 1 39 . ILE . 52770 1 40 . LYS . 52770 1 41 . SER . 52770 1 42 . ILE . 52770 1 43 . GLU . 52770 1 44 . THR . 52770 1 45 . ILE . 52770 1 46 . GLU . 52770 1 47 . GLY . 52770 1 48 . ASP . 52770 1 49 . GLY . 52770 1 50 . GLY . 52770 1 51 . PRO . 52770 1 52 . GLY . 52770 1 53 . THR . 52770 1 54 . ILE . 52770 1 55 . LYS . 52770 1 56 . LYS . 52770 1 57 . ILE . 52770 1 58 . THR . 52770 1 59 . ILE . 52770 1 60 . ALA . 52770 1 61 . GLU . 52770 1 62 . GLY . 52770 1 63 . THR . 52770 1 64 . HIS . 52770 1 65 . ILE . 52770 1 66 . LYS . 52770 1 67 . HIS . 52770 1 68 . LEU . 52770 1 69 . LYS . 52770 1 70 . HIS . 52770 1 71 . ARG . 52770 1 72 . ILE . 52770 1 73 . ASP . 52770 1 74 . ALA . 52770 1 75 . VAL . 52770 1 76 . GLU . 52770 1 77 . GLU . 52770 1 78 . GLU . 52770 1 79 . LYS . 52770 1 80 . LEU . 52770 1 81 . THR . 52770 1 82 . TYR . 52770 1 83 . SER . 52770 1 84 . TYR . 52770 1 85 . THR . 52770 1 86 . LEU . 52770 1 87 . ILE . 52770 1 88 . GLU . 52770 1 89 . GLY . 52770 1 90 . ASP . 52770 1 91 . ASP . 52770 1 92 . LEU . 52770 1 93 . LEU . 52770 1 94 . ASP . 52770 1 95 . LYS . 52770 1 96 . PHE . 52770 1 97 . GLU . 52770 1 98 . SER . 52770 1 99 . ILE . 52770 1 100 . SER . 52770 1 101 . TYR . 52770 1 102 . GLU . 52770 1 103 . ILE . 52770 1 104 . LYS . 52770 1 105 . PHE . 52770 1 106 . GLU . 52770 1 107 . SER . 52770 1 108 . SER . 52770 1 109 . PRO . 52770 1 110 . ASP . 52770 1 111 . GLY . 52770 1 112 . GLY . 52770 1 113 . ALA . 52770 1 114 . LYS . 52770 1 115 . CYS . 52770 1 116 . THR . 52770 1 117 . ASN . 52770 1 118 . LEU . 52770 1 119 . SER . 52770 1 120 . LYS . 52770 1 121 . TYR . 52770 1 122 . HIS . 52770 1 123 . PRO . 52770 1 124 . LYS . 52770 1 125 . PRO . 52770 1 126 . GLY . 52770 1 127 . VAL . 52770 1 128 . GLN . 52770 1 129 . ILE . 52770 1 130 . ASN . 52770 1 131 . GLU . 52770 1 132 . GLU . 52770 1 133 . GLU . 52770 1 134 . ILE . 52770 1 135 . LYS . 52770 1 136 . ALA . 52770 1 137 . SER . 52770 1 138 . LYS . 52770 1 139 . GLU . 52770 1 140 . LYS . 52770 1 141 . GLY . 52770 1 142 . MET . 52770 1 143 . ALA . 52770 1 144 . VAL . 52770 1 145 . TYR . 52770 1 146 . ARG . 52770 1 147 . ALA . 52770 1 148 . VAL . 52770 1 149 . GLU . 52770 1 150 . ALA . 52770 1 151 . PHE . 52770 1 152 . LEU . 52770 1 153 . LEU . 52770 1 154 . ALA . 52770 1 155 . ASN . 52770 1 156 . PRO . 52770 1 157 . GLU . 52770 1 158 . ALA . 52770 1 159 . TYR . 52770 1 160 . ALA . 52770 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 52770 1 . GLY 2 2 52770 1 . VAL 3 3 52770 1 . HIS 4 4 52770 1 . THR 5 5 52770 1 . LEU 6 6 52770 1 . SER 7 7 52770 1 . ASP 8 8 52770 1 . GLU 9 9 52770 1 . PHE 10 10 52770 1 . THR 11 11 52770 1 . SER 12 12 52770 1 . PRO 13 13 52770 1 . ILE 14 14 52770 1 . PRO 15 15 52770 1 . ALA 16 16 52770 1 . PRO 17 17 52770 1 . LYS 18 18 52770 1 . LEU 19 19 52770 1 . PHE 20 20 52770 1 . LYS 21 21 52770 1 . ALA 22 22 52770 1 . LEU 23 23 52770 1 . ILE 24 24 52770 1 . LEU 25 25 52770 1 . ASP 26 26 52770 1 . ALA 27 27 52770 1 . ASP 28 28 52770 1 . ASN 29 29 52770 1 . LEU 30 30 52770 1 . LEU 31 31 52770 1 . PRO 32 32 52770 1 . LYS 33 33 52770 1 . LEU 34 34 52770 1 . LEU 35 35 52770 1 . PRO 36 36 52770 1 . GLN 37 37 52770 1 . ALA 38 38 52770 1 . ILE 39 39 52770 1 . LYS 40 40 52770 1 . SER 41 41 52770 1 . ILE 42 42 52770 1 . GLU 43 43 52770 1 . THR 44 44 52770 1 . ILE 45 45 52770 1 . GLU 46 46 52770 1 . GLY 47 47 52770 1 . ASP 48 48 52770 1 . GLY 49 49 52770 1 . GLY 50 50 52770 1 . PRO 51 51 52770 1 . GLY 52 52 52770 1 . THR 53 53 52770 1 . ILE 54 54 52770 1 . LYS 55 55 52770 1 . LYS 56 56 52770 1 . ILE 57 57 52770 1 . THR 58 58 52770 1 . ILE 59 59 52770 1 . ALA 60 60 52770 1 . GLU 61 61 52770 1 . GLY 62 62 52770 1 . THR 63 63 52770 1 . HIS 64 64 52770 1 . ILE 65 65 52770 1 . LYS 66 66 52770 1 . HIS 67 67 52770 1 . LEU 68 68 52770 1 . LYS 69 69 52770 1 . HIS 70 70 52770 1 . ARG 71 71 52770 1 . ILE 72 72 52770 1 . ASP 73 73 52770 1 . ALA 74 74 52770 1 . VAL 75 75 52770 1 . GLU 76 76 52770 1 . GLU 77 77 52770 1 . GLU 78 78 52770 1 . LYS 79 79 52770 1 . LEU 80 80 52770 1 . THR 81 81 52770 1 . TYR 82 82 52770 1 . SER 83 83 52770 1 . TYR 84 84 52770 1 . THR 85 85 52770 1 . LEU 86 86 52770 1 . ILE 87 87 52770 1 . GLU 88 88 52770 1 . GLY 89 89 52770 1 . ASP 90 90 52770 1 . ASP 91 91 52770 1 . LEU 92 92 52770 1 . LEU 93 93 52770 1 . ASP 94 94 52770 1 . LYS 95 95 52770 1 . PHE 96 96 52770 1 . GLU 97 97 52770 1 . SER 98 98 52770 1 . ILE 99 99 52770 1 . SER 100 100 52770 1 . TYR 101 101 52770 1 . GLU 102 102 52770 1 . ILE 103 103 52770 1 . LYS 104 104 52770 1 . PHE 105 105 52770 1 . GLU 106 106 52770 1 . SER 107 107 52770 1 . SER 108 108 52770 1 . PRO 109 109 52770 1 . ASP 110 110 52770 1 . GLY 111 111 52770 1 . GLY 112 112 52770 1 . ALA 113 113 52770 1 . LYS 114 114 52770 1 . CYS 115 115 52770 1 . THR 116 116 52770 1 . ASN 117 117 52770 1 . LEU 118 118 52770 1 . SER 119 119 52770 1 . LYS 120 120 52770 1 . TYR 121 121 52770 1 . HIS 122 122 52770 1 . PRO 123 123 52770 1 . LYS 124 124 52770 1 . PRO 125 125 52770 1 . GLY 126 126 52770 1 . VAL 127 127 52770 1 . GLN 128 128 52770 1 . ILE 129 129 52770 1 . ASN 130 130 52770 1 . GLU 131 131 52770 1 . GLU 132 132 52770 1 . GLU 133 133 52770 1 . ILE 134 134 52770 1 . LYS 135 135 52770 1 . ALA 136 136 52770 1 . SER 137 137 52770 1 . LYS 138 138 52770 1 . GLU 139 139 52770 1 . LYS 140 140 52770 1 . GLY 141 141 52770 1 . MET 142 142 52770 1 . ALA 143 143 52770 1 . VAL 144 144 52770 1 . TYR 145 145 52770 1 . ARG 146 146 52770 1 . ALA 147 147 52770 1 . VAL 148 148 52770 1 . GLU 149 149 52770 1 . ALA 150 150 52770 1 . PHE 151 151 52770 1 . LEU 152 152 52770 1 . LEU 153 153 52770 1 . ALA 154 154 52770 1 . ASN 155 155 52770 1 . PRO 156 156 52770 1 . GLU 157 157 52770 1 . ALA 158 158 52770 1 . TYR 159 159 52770 1 . ALA 160 160 52770 1 stop_ save_ #################### # Natural source # #################### save_natural_source_1 _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source_1 _Entity_natural_src_list.Entry_ID 52770 _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 . 13451 organism . 'Corylus avellana' 'European hazelnut' . . Eukaryota Viridiplantae Corylus avellana . . . . . . . . . . . . . 52770 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source_1 _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source_1 _Entity_experimental_src_list.Entry_ID 52770 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . plasmid . . pET-GB1a . . . 52770 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 52770 _Sample.ID 1 _Sample.Name 'sample 1' _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number 1 _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'sodium chloride' 'natural abundance' . . . . . . 50 . . mM . . . . 52770 1 2 'sodium phosphate' 'natural abundance' . . . . . . 10 . . mM . . . . 52770 1 3 Cora10501_Q3OR '[U-99% 13C; U-99% 15N]' . . 1 $entity_1 . . 300 . . uM . . . . 52770 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 52770 _Sample_condition_list.ID 1 _Sample_condition_list.Name 'condition 1' _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 7.5 . pH 52770 1 pressure 1 . atm 52770 1 temperature 308 . K 52770 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 52770 _Software.ID 1 _Software.Type . _Software.Name TOPSPIN _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID collection . 52770 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 52770 _Software.ID 2 _Software.Type . _Software.Name NMRViewJ _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 52770 2 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 52770 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name AV700 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE III' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 save_ save_NMR_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_2 _NMR_spectrometer.Entry_ID 52770 _NMR_spectrometer.ID 2 _NMR_spectrometer.Name AV900 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE III' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 900 save_ ############################# # NMR applied experiments # ############################# save_experiment_list_1 _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list_1 _Experiment_list.Entry_ID 52770 _Experiment_list.ID 1 _Experiment_list.Details ; The residues affected by ligand binding showed intermediate or fast exchange in titration experiments. This allowed the peaks of Cor a 10501_Q3OR to be assigned by titration based on the assigned free Cor a 10501. ; loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NUS_flag _Experiment.Interleaved_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Details _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 52770 1 2 '2D 1H-13C HSQC' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 52770 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 52770 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name 'reference 1' _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.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 0.00 na indirect 0.251449530 . . . . . 52770 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . 52770 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . 52770 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 52770 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name 'chemical shift list' _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 52770 1 2 '2D 1H-13C HSQC' . . . 52770 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 2 $software_2 . . 52770 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 3 3 VAL H H 1 7.86 0.03 . 1 . . . . . 3 VAL H . 52770 1 2 . 1 . 1 3 3 VAL HB H 1 1.89 0.03 . 1 . . . . . 3 VAL HB . 52770 1 3 . 1 . 1 3 3 VAL HG11 H 1 0.75 0.03 . 2 . . . . . 3 VAL MG1 . 52770 1 4 . 1 . 1 3 3 VAL HG12 H 1 0.75 0.03 . 2 . . . . . 3 VAL MG1 . 52770 1 5 . 1 . 1 3 3 VAL HG13 H 1 0.75 0.03 . 2 . . . . . 3 VAL MG1 . 52770 1 6 . 1 . 1 3 3 VAL HG21 H 1 0.75 0.03 . 2 . . . . . 3 VAL MG2 . 52770 1 7 . 1 . 1 3 3 VAL HG22 H 1 0.75 0.03 . 2 . . . . . 3 VAL MG2 . 52770 1 8 . 1 . 1 3 3 VAL HG23 H 1 0.75 0.03 . 2 . . . . . 3 VAL MG2 . 52770 1 9 . 1 . 1 3 3 VAL CB C 13 33.31 0.20 . 1 . . . . . 3 VAL CB . 52770 1 10 . 1 . 1 3 3 VAL CG1 C 13 20.52 0.20 . 2 . . . . . 3 VAL CG1 . 52770 1 11 . 1 . 1 3 3 VAL CG2 C 13 20.52 0.20 . 2 . . . . . 3 VAL CG2 . 52770 1 12 . 1 . 1 3 3 VAL N N 15 119.08 0.20 . 1 . . . . . 3 VAL N . 52770 1 13 . 1 . 1 4 4 HIS H H 1 8.60 0.03 . 1 . . . . . 4 HIS H . 52770 1 14 . 1 . 1 4 4 HIS HA H 1 4.89 0.03 . 1 . . . . . 4 HIS HA . 52770 1 15 . 1 . 1 4 4 HIS HB2 H 1 3.00 0.03 . 2 . . . . . 4 HIS HB2 . 52770 1 16 . 1 . 1 4 4 HIS HB3 H 1 3.08 0.03 . 2 . . . . . 4 HIS HB3 . 52770 1 17 . 1 . 1 4 4 HIS CA C 13 55.67 0.20 . 1 . . . . . 4 HIS CA . 52770 1 18 . 1 . 1 4 4 HIS CB C 13 33.16 0.20 . 1 . . . . . 4 HIS CB . 52770 1 19 . 1 . 1 4 4 HIS N N 15 127.72 0.20 . 1 . . . . . 4 HIS N . 52770 1 20 . 1 . 1 5 5 THR H H 1 8.21 0.03 . 1 . . . . . 5 THR H . 52770 1 21 . 1 . 1 5 5 THR HA H 1 5.35 0.03 . 1 . . . . . 5 THR HA . 52770 1 22 . 1 . 1 5 5 THR HB H 1 3.91 0.03 . 1 . . . . . 5 THR HB . 52770 1 23 . 1 . 1 5 5 THR HG21 H 1 1.04 0.03 . 1 . . . . . 5 THR MG . 52770 1 24 . 1 . 1 5 5 THR HG22 H 1 1.04 0.03 . 1 . . . . . 5 THR MG . 52770 1 25 . 1 . 1 5 5 THR HG23 H 1 1.04 0.03 . 1 . . . . . 5 THR MG . 52770 1 26 . 1 . 1 5 5 THR CA C 13 60.97 0.20 . 1 . . . . . 5 THR CA . 52770 1 27 . 1 . 1 5 5 THR CB C 13 70.63 0.20 . 1 . . . . . 5 THR CB . 52770 1 28 . 1 . 1 5 5 THR CG2 C 13 21.67 0.20 . 1 . . . . . 5 THR CG2 . 52770 1 29 . 1 . 1 5 5 THR N N 15 120.60 0.20 . 1 . . . . . 5 THR N . 52770 1 30 . 1 . 1 6 6 LEU H H 1 9.11 0.03 . 1 . . . . . 6 LEU H . 52770 1 31 . 1 . 1 6 6 LEU HA H 1 5.05 0.03 . 1 . . . . . 6 LEU HA . 52770 1 32 . 1 . 1 6 6 LEU HB3 H 1 1.73 0.03 . 2 . . . . . 6 LEU HB3 . 52770 1 33 . 1 . 1 6 6 LEU HD11 H 1 0.89 0.03 . 2 . . . . . 6 LEU MD1 . 52770 1 34 . 1 . 1 6 6 LEU HD12 H 1 0.89 0.03 . 2 . . . . . 6 LEU MD1 . 52770 1 35 . 1 . 1 6 6 LEU HD13 H 1 0.89 0.03 . 2 . . . . . 6 LEU MD1 . 52770 1 36 . 1 . 1 6 6 LEU HD21 H 1 0.93 0.03 . 2 . . . . . 6 LEU MD2 . 52770 1 37 . 1 . 1 6 6 LEU HD22 H 1 0.93 0.03 . 2 . . . . . 6 LEU MD2 . 52770 1 38 . 1 . 1 6 6 LEU HD23 H 1 0.93 0.03 . 2 . . . . . 6 LEU MD2 . 52770 1 39 . 1 . 1 6 6 LEU CA C 13 54.01 0.20 . 1 . . . . . 6 LEU CA . 52770 1 40 . 1 . 1 6 6 LEU CB C 13 45.12 0.20 . 1 . . . . . 6 LEU CB . 52770 1 41 . 1 . 1 6 6 LEU CD1 C 13 24.53 0.20 . 2 . . . . . 6 LEU CD1 . 52770 1 42 . 1 . 1 6 6 LEU CD2 C 13 24.63 0.20 . 2 . . . . . 6 LEU CD2 . 52770 1 43 . 1 . 1 6 6 LEU N N 15 125.88 0.20 . 1 . . . . . 6 LEU N . 52770 1 44 . 1 . 1 7 7 SER H H 1 8.70 0.03 . 1 . . . . . 7 SER H . 52770 1 45 . 1 . 1 7 7 SER HA H 1 5.13 0.03 . 1 . . . . . 7 SER HA . 52770 1 46 . 1 . 1 7 7 SER HB2 H 1 3.57 0.03 . 2 . . . . . 7 SER HB2 . 52770 1 47 . 1 . 1 7 7 SER HB3 H 1 3.76 0.03 . 2 . . . . . 7 SER HB3 . 52770 1 48 . 1 . 1 7 7 SER CA C 13 56.91 0.20 . 1 . . . . . 7 SER CA . 52770 1 49 . 1 . 1 7 7 SER CB C 13 64.43 0.20 . 1 . . . . . 7 SER CB . 52770 1 50 . 1 . 1 7 7 SER N N 15 118.96 0.20 . 1 . . . . . 7 SER N . 52770 1 51 . 1 . 1 8 8 ASP H H 1 8.31 0.03 . 1 . . . . . 8 ASP H . 52770 1 52 . 1 . 1 8 8 ASP HA H 1 5.12 0.03 . 1 . . . . . 8 ASP HA . 52770 1 53 . 1 . 1 8 8 ASP HB2 H 1 2.58 0.03 . 2 . . . . . 8 ASP HB2 . 52770 1 54 . 1 . 1 8 8 ASP HB3 H 1 2.71 0.03 . 2 . . . . . 8 ASP HB3 . 52770 1 55 . 1 . 1 8 8 ASP CA C 13 53.62 0.20 . 1 . . . . . 8 ASP CA . 52770 1 56 . 1 . 1 8 8 ASP CB C 13 45.62 0.20 . 1 . . . . . 8 ASP CB . 52770 1 57 . 1 . 1 8 8 ASP N N 15 125.64 0.20 . 1 . . . . . 8 ASP N . 52770 1 58 . 1 . 1 9 9 GLU H H 1 8.53 0.03 . 1 . . . . . 9 GLU H . 52770 1 59 . 1 . 1 9 9 GLU HA H 1 5.55 0.03 . 1 . . . . . 9 GLU HA . 52770 1 60 . 1 . 1 9 9 GLU HB2 H 1 1.89 0.03 . 2 . . . . . 9 GLU HB2 . 52770 1 61 . 1 . 1 9 9 GLU HB3 H 1 1.89 0.03 . 2 . . . . . 9 GLU HB3 . 52770 1 62 . 1 . 1 9 9 GLU CA C 13 54.38 0.20 . 1 . . . . . 9 GLU CA . 52770 1 63 . 1 . 1 9 9 GLU CB C 13 33.74 0.20 . 1 . . . . . 9 GLU CB . 52770 1 64 . 1 . 1 9 9 GLU N N 15 120.70 0.20 . 1 . . . . . 9 GLU N . 52770 1 65 . 1 . 1 10 10 PHE H H 1 8.66 0.03 . 1 . . . . . 10 PHE H . 52770 1 66 . 1 . 1 10 10 PHE HA H 1 5.03 0.03 . 1 . . . . . 10 PHE HA . 52770 1 67 . 1 . 1 10 10 PHE HB2 H 1 3.08 0.03 . 2 . . . . . 10 PHE HB2 . 52770 1 68 . 1 . 1 10 10 PHE CA C 13 56.20 0.20 . 1 . . . . . 10 PHE CA . 52770 1 69 . 1 . 1 10 10 PHE N N 15 119.73 0.20 . 1 . . . . . 10 PHE N . 52770 1 70 . 1 . 1 11 11 THR H H 1 8.56 0.03 . 1 . . . . . 11 THR H . 52770 1 71 . 1 . 1 11 11 THR HA H 1 5.28 0.03 . 1 . . . . . 11 THR HA . 52770 1 72 . 1 . 1 11 11 THR HB H 1 4.27 0.03 . 1 . . . . . 11 THR HB . 52770 1 73 . 1 . 1 11 11 THR HG21 H 1 1.19 0.03 . 1 . . . . . 11 THR MG . 52770 1 74 . 1 . 1 11 11 THR HG22 H 1 1.19 0.03 . 1 . . . . . 11 THR MG . 52770 1 75 . 1 . 1 11 11 THR HG23 H 1 1.19 0.03 . 1 . . . . . 11 THR MG . 52770 1 76 . 1 . 1 11 11 THR CA C 13 60.17 0.20 . 1 . . . . . 11 THR CA . 52770 1 77 . 1 . 1 11 11 THR CB C 13 71.13 0.20 . 1 . . . . . 11 THR CB . 52770 1 78 . 1 . 1 11 11 THR CG2 C 13 21.69 0.20 . 1 . . . . . 11 THR CG2 . 52770 1 79 . 1 . 1 11 11 THR N N 15 113.07 0.20 . 1 . . . . . 11 THR N . 52770 1 80 . 1 . 1 12 12 SER H H 1 9.10 0.03 . 1 . . . . . 12 SER H . 52770 1 81 . 1 . 1 12 12 SER HA H 1 5.29 0.03 . 1 . . . . . 12 SER HA . 52770 1 82 . 1 . 1 12 12 SER HB2 H 1 3.62 0.03 . 2 . . . . . 12 SER HB2 . 52770 1 83 . 1 . 1 12 12 SER HB3 H 1 3.99 0.03 . 2 . . . . . 12 SER HB3 . 52770 1 84 . 1 . 1 12 12 SER CA C 13 54.40 0.20 . 1 . . . . . 12 SER CA . 52770 1 85 . 1 . 1 12 12 SER CB C 13 67.17 0.20 . 1 . . . . . 12 SER CB . 52770 1 86 . 1 . 1 12 12 SER N N 15 116.26 0.20 . 1 . . . . . 12 SER N . 52770 1 87 . 1 . 1 13 13 PRO HA H 1 4.74 0.03 . 1 . . . . . 13 PRO HA . 52770 1 88 . 1 . 1 13 13 PRO HB2 H 1 2.05 0.03 . 2 . . . . . 13 PRO HB2 . 52770 1 89 . 1 . 1 13 13 PRO HG3 H 1 2.15 0.03 . 2 . . . . . 13 PRO HG3 . 52770 1 90 . 1 . 1 13 13 PRO CA C 13 63.25 0.20 . 1 . . . . . 13 PRO CA . 52770 1 91 . 1 . 1 13 13 PRO CG C 13 26.79 0.20 . 1 . . . . . 13 PRO CG . 52770 1 92 . 1 . 1 14 14 ILE H H 1 8.16 0.03 . 1 . . . . . 14 ILE H . 52770 1 93 . 1 . 1 14 14 ILE HG13 H 1 1.28 0.03 . 2 . . . . . 14 ILE HG13 . 52770 1 94 . 1 . 1 14 14 ILE HG21 H 1 1.06 0.03 . 1 . . . . . 14 ILE MG . 52770 1 95 . 1 . 1 14 14 ILE HG22 H 1 1.06 0.03 . 1 . . . . . 14 ILE MG . 52770 1 96 . 1 . 1 14 14 ILE HG23 H 1 1.06 0.03 . 1 . . . . . 14 ILE MG . 52770 1 97 . 1 . 1 14 14 ILE HD11 H 1 0.81 0.03 . 1 . . . . . 14 ILE MD . 52770 1 98 . 1 . 1 14 14 ILE HD12 H 1 0.81 0.03 . 1 . . . . . 14 ILE MD . 52770 1 99 . 1 . 1 14 14 ILE HD13 H 1 0.81 0.03 . 1 . . . . . 14 ILE MD . 52770 1 100 . 1 . 1 14 14 ILE CG1 C 13 27.59 0.20 . 1 . . . . . 14 ILE CG1 . 52770 1 101 . 1 . 1 14 14 ILE CG2 C 13 17.56 0.20 . 1 . . . . . 14 ILE CG2 . 52770 1 102 . 1 . 1 14 14 ILE CD1 C 13 10.39 0.20 . 1 . . . . . 14 ILE CD1 . 52770 1 103 . 1 . 1 14 14 ILE N N 15 123.07 0.20 . 1 . . . . . 14 ILE N . 52770 1 104 . 1 . 1 15 15 PRO HA H 1 4.38 0.03 . 1 . . . . . 15 PRO HA . 52770 1 105 . 1 . 1 15 15 PRO HB2 H 1 1.89 0.03 . 2 . . . . . 15 PRO HB2 . 52770 1 106 . 1 . 1 15 15 PRO HB3 H 1 2.28 0.03 . 2 . . . . . 15 PRO HB3 . 52770 1 107 . 1 . 1 15 15 PRO CA C 13 62.97 0.20 . 1 . . . . . 15 PRO CA . 52770 1 108 . 1 . 1 15 15 PRO CB C 13 32.11 0.20 . 1 . . . . . 15 PRO CB . 52770 1 109 . 1 . 1 16 16 ALA H H 1 8.31 0.03 . 1 . . . . . 16 ALA H . 52770 1 110 . 1 . 1 16 16 ALA N N 15 125.65 0.20 . 1 . . . . . 16 ALA N . 52770 1 111 . 1 . 1 17 17 PRO HA H 1 4.24 0.03 . 1 . . . . . 17 PRO HA . 52770 1 112 . 1 . 1 17 17 PRO HB3 H 1 2.43 0.03 . 2 . . . . . 17 PRO HB3 . 52770 1 113 . 1 . 1 17 17 PRO HG2 H 1 1.99 0.03 . 2 . . . . . 17 PRO HG2 . 52770 1 114 . 1 . 1 17 17 PRO HD3 H 1 3.75 0.03 . 2 . . . . . 17 PRO HD3 . 52770 1 115 . 1 . 1 17 17 PRO CA C 13 66.16 0.20 . 1 . . . . . 17 PRO CA . 52770 1 116 . 1 . 1 17 17 PRO CB C 13 30.86 0.20 . 1 . . . . . 17 PRO CB . 52770 1 117 . 1 . 1 17 17 PRO CD C 13 50.27 0.20 . 1 . . . . . 17 PRO CD . 52770 1 118 . 1 . 1 18 18 LYS H H 1 6.66 0.03 . 1 . . . . . 18 LYS H . 52770 1 119 . 1 . 1 18 18 LYS HA H 1 4.04 0.03 . 1 . . . . . 18 LYS HA . 52770 1 120 . 1 . 1 18 18 LYS HB2 H 1 1.68 0.03 . 2 . . . . . 18 LYS HB2 . 52770 1 121 . 1 . 1 18 18 LYS HB3 H 1 1.91 0.03 . 2 . . . . . 18 LYS HB3 . 52770 1 122 . 1 . 1 18 18 LYS HG2 H 1 1.35 0.03 . 2 . . . . . 18 LYS HG2 . 52770 1 123 . 1 . 1 18 18 LYS HG3 H 1 1.35 0.03 . 2 . . . . . 18 LYS HG3 . 52770 1 124 . 1 . 1 18 18 LYS CA C 13 59.58 0.20 . 1 . . . . . 18 LYS CA . 52770 1 125 . 1 . 1 18 18 LYS CB C 13 32.94 0.20 . 1 . . . . . 18 LYS CB . 52770 1 126 . 1 . 1 18 18 LYS CG C 13 25.31 0.20 . 1 . . . . . 18 LYS CG . 52770 1 127 . 1 . 1 18 18 LYS N N 15 116.53 0.20 . 1 . . . . . 18 LYS N . 52770 1 128 . 1 . 1 19 19 LEU H H 1 7.68 0.03 . 1 . . . . . 19 LEU H . 52770 1 129 . 1 . 1 19 19 LEU HA H 1 3.65 0.03 . 1 . . . . . 19 LEU HA . 52770 1 130 . 1 . 1 19 19 LEU HB2 H 1 1.23 0.03 . 2 . . . . . 19 LEU HB2 . 52770 1 131 . 1 . 1 19 19 LEU HB3 H 1 1.23 0.03 . 2 . . . . . 19 LEU HB3 . 52770 1 132 . 1 . 1 19 19 LEU HG H 1 1.39 0.03 . 1 . . . . . 19 LEU HG . 52770 1 133 . 1 . 1 19 19 LEU HD21 H 1 0.80 0.03 . 2 . . . . . 19 LEU MD2 . 52770 1 134 . 1 . 1 19 19 LEU HD22 H 1 0.80 0.03 . 2 . . . . . 19 LEU MD2 . 52770 1 135 . 1 . 1 19 19 LEU HD23 H 1 0.80 0.03 . 2 . . . . . 19 LEU MD2 . 52770 1 136 . 1 . 1 19 19 LEU CA C 13 57.71 0.20 . 1 . . . . . 19 LEU CA . 52770 1 137 . 1 . 1 19 19 LEU CB C 13 41.99 0.20 . 1 . . . . . 19 LEU CB . 52770 1 138 . 1 . 1 19 19 LEU CG C 13 26.42 0.20 . 1 . . . . . 19 LEU CG . 52770 1 139 . 1 . 1 19 19 LEU CD2 C 13 24.45 0.20 . 2 . . . . . 19 LEU CD2 . 52770 1 140 . 1 . 1 19 19 LEU N N 15 118.28 0.20 . 1 . . . . . 19 LEU N . 52770 1 141 . 1 . 1 20 20 PHE H H 1 7.94 0.03 . 1 . . . . . 20 PHE H . 52770 1 142 . 1 . 1 20 20 PHE HA H 1 3.53 0.03 . 1 . . . . . 20 PHE HA . 52770 1 143 . 1 . 1 20 20 PHE CA C 13 61.93 0.20 . 1 . . . . . 20 PHE CA . 52770 1 144 . 1 . 1 20 20 PHE N N 15 116.82 0.20 . 1 . . . . . 20 PHE N . 52770 1 145 . 1 . 1 21 21 LYS H H 1 7.83 0.03 . 1 . . . . . 21 LYS H . 52770 1 146 . 1 . 1 21 21 LYS HA H 1 3.62 0.03 . 1 . . . . . 21 LYS HA . 52770 1 147 . 1 . 1 21 21 LYS HG2 H 1 1.54 0.03 . 2 . . . . . 21 LYS HG2 . 52770 1 148 . 1 . 1 21 21 LYS HG3 H 1 1.73 0.03 . 2 . . . . . 21 LYS HG3 . 52770 1 149 . 1 . 1 21 21 LYS HE2 H 1 2.96 0.03 . 2 . . . . . 21 LYS HE2 . 52770 1 150 . 1 . 1 21 21 LYS HE3 H 1 2.96 0.03 . 2 . . . . . 21 LYS HE3 . 52770 1 151 . 1 . 1 21 21 LYS CA C 13 60.04 0.20 . 1 . . . . . 21 LYS CA . 52770 1 152 . 1 . 1 21 21 LYS CG C 13 26.09 0.20 . 1 . . . . . 21 LYS CG . 52770 1 153 . 1 . 1 21 21 LYS CE C 13 41.95 0.20 . 1 . . . . . 21 LYS CE . 52770 1 154 . 1 . 1 21 21 LYS N N 15 118.58 0.20 . 1 . . . . . 21 LYS N . 52770 1 155 . 1 . 1 22 22 ALA H H 1 7.42 0.03 . 1 . . . . . 22 ALA H . 52770 1 156 . 1 . 1 22 22 ALA HA H 1 3.30 0.03 . 1 . . . . . 22 ALA HA . 52770 1 157 . 1 . 1 22 22 ALA CA C 13 54.66 0.20 . 1 . . . . . 22 ALA CA . 52770 1 158 . 1 . 1 22 22 ALA N N 15 118.85 0.20 . 1 . . . . . 22 ALA N . 52770 1 159 . 1 . 1 23 23 LEU H H 1 7.77 0.03 . 1 . . . . . 23 LEU H . 52770 1 160 . 1 . 1 23 23 LEU HA H 1 3.76 0.03 . 1 . . . . . 23 LEU HA . 52770 1 161 . 1 . 1 23 23 LEU HB3 H 1 1.70 0.03 . 2 . . . . . 23 LEU HB3 . 52770 1 162 . 1 . 1 23 23 LEU HG H 1 1.30 0.03 . 1 . . . . . 23 LEU HG . 52770 1 163 . 1 . 1 23 23 LEU HD11 H 1 0.93 0.03 . 2 . . . . . 23 LEU MD1 . 52770 1 164 . 1 . 1 23 23 LEU HD12 H 1 0.93 0.03 . 2 . . . . . 23 LEU MD1 . 52770 1 165 . 1 . 1 23 23 LEU HD13 H 1 0.93 0.03 . 2 . . . . . 23 LEU MD1 . 52770 1 166 . 1 . 1 23 23 LEU HD21 H 1 0.93 0.03 . 2 . . . . . 23 LEU MD2 . 52770 1 167 . 1 . 1 23 23 LEU HD22 H 1 0.93 0.03 . 2 . . . . . 23 LEU MD2 . 52770 1 168 . 1 . 1 23 23 LEU HD23 H 1 0.93 0.03 . 2 . . . . . 23 LEU MD2 . 52770 1 169 . 1 . 1 23 23 LEU CA C 13 56.53 0.20 . 1 . . . . . 23 LEU CA . 52770 1 170 . 1 . 1 23 23 LEU CB C 13 43.35 0.20 . 1 . . . . . 23 LEU CB . 52770 1 171 . 1 . 1 23 23 LEU CG C 13 26.30 0.20 . 1 . . . . . 23 LEU CG . 52770 1 172 . 1 . 1 23 23 LEU CD1 C 13 24.64 0.20 . 2 . . . . . 23 LEU CD1 . 52770 1 173 . 1 . 1 23 23 LEU CD2 C 13 24.63 0.20 . 2 . . . . . 23 LEU CD2 . 52770 1 174 . 1 . 1 23 23 LEU N N 15 110.08 0.20 . 1 . . . . . 23 LEU N . 52770 1 175 . 1 . 1 24 24 ILE H H 1 6.70 0.03 . 1 . . . . . 24 ILE H . 52770 1 176 . 1 . 1 24 24 ILE HA H 1 3.73 0.03 . 1 . . . . . 24 ILE HA . 52770 1 177 . 1 . 1 24 24 ILE HB H 1 1.10 0.03 . 1 . . . . . 24 ILE HB . 52770 1 178 . 1 . 1 24 24 ILE HG12 H 1 0.99 0.03 . 2 . . . . . 24 ILE HG12 . 52770 1 179 . 1 . 1 24 24 ILE HG13 H 1 0.78 0.03 . 2 . . . . . 24 ILE HG13 . 52770 1 180 . 1 . 1 24 24 ILE HG21 H 1 -0.30 0.03 . 1 . . . . . 24 ILE MG . 52770 1 181 . 1 . 1 24 24 ILE HG22 H 1 -0.30 0.03 . 1 . . . . . 24 ILE MG . 52770 1 182 . 1 . 1 24 24 ILE HG23 H 1 -0.30 0.03 . 1 . . . . . 24 ILE MG . 52770 1 183 . 1 . 1 24 24 ILE HD11 H 1 0.37 0.03 . 1 . . . . . 24 ILE MD . 52770 1 184 . 1 . 1 24 24 ILE HD12 H 1 0.37 0.03 . 1 . . . . . 24 ILE MD . 52770 1 185 . 1 . 1 24 24 ILE HD13 H 1 0.37 0.03 . 1 . . . . . 24 ILE MD . 52770 1 186 . 1 . 1 24 24 ILE CA C 13 59.52 0.20 . 1 . . . . . 24 ILE CA . 52770 1 187 . 1 . 1 24 24 ILE CB C 13 34.94 0.20 . 1 . . . . . 24 ILE CB . 52770 1 188 . 1 . 1 24 24 ILE CG1 C 13 27.21 0.20 . 1 . . . . . 24 ILE CG1 . 52770 1 189 . 1 . 1 24 24 ILE CG2 C 13 16.85 0.20 . 1 . . . . . 24 ILE CG2 . 52770 1 190 . 1 . 1 24 24 ILE CD1 C 13 10.24 0.20 . 1 . . . . . 24 ILE CD1 . 52770 1 191 . 1 . 1 24 24 ILE N N 15 108.22 0.20 . 1 . . . . . 24 ILE N . 52770 1 192 . 1 . 1 25 25 LEU H H 1 7.32 0.03 . 1 . . . . . 25 LEU H . 52770 1 193 . 1 . 1 25 25 LEU HA H 1 3.90 0.03 . 1 . . . . . 25 LEU HA . 52770 1 194 . 1 . 1 25 25 LEU HB2 H 1 1.49 0.03 . 2 . . . . . 25 LEU HB2 . 52770 1 195 . 1 . 1 25 25 LEU HG H 1 1.23 0.03 . 1 . . . . . 25 LEU HG . 52770 1 196 . 1 . 1 25 25 LEU HD11 H 1 0.77 0.03 . 2 . . . . . 25 LEU MD1 . 52770 1 197 . 1 . 1 25 25 LEU HD12 H 1 0.77 0.03 . 2 . . . . . 25 LEU MD1 . 52770 1 198 . 1 . 1 25 25 LEU HD13 H 1 0.77 0.03 . 2 . . . . . 25 LEU MD1 . 52770 1 199 . 1 . 1 25 25 LEU HD21 H 1 0.77 0.03 . 2 . . . . . 25 LEU MD2 . 52770 1 200 . 1 . 1 25 25 LEU HD22 H 1 0.77 0.03 . 2 . . . . . 25 LEU MD2 . 52770 1 201 . 1 . 1 25 25 LEU HD23 H 1 0.77 0.03 . 2 . . . . . 25 LEU MD2 . 52770 1 202 . 1 . 1 25 25 LEU CA C 13 57.70 0.20 . 1 . . . . . 25 LEU CA . 52770 1 203 . 1 . 1 25 25 LEU CG C 13 26.10 0.20 . 1 . . . . . 25 LEU CG . 52770 1 204 . 1 . 1 25 25 LEU CD1 C 13 21.74 0.20 . 2 . . . . . 25 LEU CD1 . 52770 1 205 . 1 . 1 25 25 LEU CD2 C 13 21.75 0.20 . 2 . . . . . 25 LEU CD2 . 52770 1 206 . 1 . 1 25 25 LEU N N 15 115.91 0.20 . 1 . . . . . 25 LEU N . 52770 1 207 . 1 . 1 26 26 ASP H H 1 7.58 0.03 . 1 . . . . . 26 ASP H . 52770 1 208 . 1 . 1 26 26 ASP HA H 1 5.41 0.03 . 1 . . . . . 26 ASP HA . 52770 1 209 . 1 . 1 26 26 ASP HB2 H 1 2.51 0.03 . 2 . . . . . 26 ASP HB2 . 52770 1 210 . 1 . 1 26 26 ASP HB3 H 1 2.94 0.03 . 2 . . . . . 26 ASP HB3 . 52770 1 211 . 1 . 1 26 26 ASP CA C 13 52.67 0.20 . 1 . . . . . 26 ASP CA . 52770 1 212 . 1 . 1 26 26 ASP CB C 13 42.75 0.20 . 1 . . . . . 26 ASP CB . 52770 1 213 . 1 . 1 26 26 ASP N N 15 117.31 0.20 . 1 . . . . . 26 ASP N . 52770 1 214 . 1 . 1 27 27 ALA H H 1 6.58 0.03 . 1 . . . . . 27 ALA H . 52770 1 215 . 1 . 1 27 27 ALA HA H 1 3.72 0.03 . 1 . . . . . 27 ALA HA . 52770 1 216 . 1 . 1 27 27 ALA CA C 13 56.23 0.20 . 1 . . . . . 27 ALA CA . 52770 1 217 . 1 . 1 27 27 ALA N N 15 122.86 0.20 . 1 . . . . . 27 ALA N . 52770 1 218 . 1 . 1 28 28 ASP H H 1 8.28 0.03 . 1 . . . . . 28 ASP H . 52770 1 219 . 1 . 1 28 28 ASP HA H 1 3.97 0.03 . 1 . . . . . 28 ASP HA . 52770 1 220 . 1 . 1 28 28 ASP HB2 H 1 2.44 0.03 . 2 . . . . . 28 ASP HB2 . 52770 1 221 . 1 . 1 28 28 ASP HB3 H 1 2.52 0.03 . 2 . . . . . 28 ASP HB3 . 52770 1 222 . 1 . 1 28 28 ASP CA C 13 56.65 0.20 . 1 . . . . . 28 ASP CA . 52770 1 223 . 1 . 1 28 28 ASP CB C 13 39.23 0.20 . 1 . . . . . 28 ASP CB . 52770 1 224 . 1 . 1 28 28 ASP N N 15 112.82 0.20 . 1 . . . . . 28 ASP N . 52770 1 225 . 1 . 1 29 29 ASN H H 1 7.29 0.03 . 1 . . . . . 29 ASN H . 52770 1 226 . 1 . 1 29 29 ASN N N 15 112.48 0.20 . 1 . . . . . 29 ASN N . 52770 1 227 . 1 . 1 30 30 LEU H H 1 8.44 0.03 . 1 . . . . . 30 LEU H . 52770 1 228 . 1 . 1 30 30 LEU HA H 1 4.03 0.03 . 1 . . . . . 30 LEU HA . 52770 1 229 . 1 . 1 30 30 LEU HB2 H 1 1.46 0.03 . 2 . . . . . 30 LEU HB2 . 52770 1 230 . 1 . 1 30 30 LEU HB3 H 1 1.59 0.03 . 2 . . . . . 30 LEU HB3 . 52770 1 231 . 1 . 1 30 30 LEU HG H 1 0.72 0.03 . 1 . . . . . 30 LEU HG . 52770 1 232 . 1 . 1 30 30 LEU HD11 H 1 0.47 0.03 . 2 . . . . . 30 LEU MD1 . 52770 1 233 . 1 . 1 30 30 LEU HD12 H 1 0.47 0.03 . 2 . . . . . 30 LEU MD1 . 52770 1 234 . 1 . 1 30 30 LEU HD13 H 1 0.47 0.03 . 2 . . . . . 30 LEU MD1 . 52770 1 235 . 1 . 1 30 30 LEU HD21 H 1 0.47 0.03 . 2 . . . . . 30 LEU MD2 . 52770 1 236 . 1 . 1 30 30 LEU HD22 H 1 0.47 0.03 . 2 . . . . . 30 LEU MD2 . 52770 1 237 . 1 . 1 30 30 LEU HD23 H 1 0.47 0.03 . 2 . . . . . 30 LEU MD2 . 52770 1 238 . 1 . 1 30 30 LEU CA C 13 57.50 0.20 . 1 . . . . . 30 LEU CA . 52770 1 239 . 1 . 1 30 30 LEU CB C 13 42.99 0.20 . 1 . . . . . 30 LEU CB . 52770 1 240 . 1 . 1 30 30 LEU CG C 13 25.89 0.20 . 1 . . . . . 30 LEU CG . 52770 1 241 . 1 . 1 30 30 LEU CD1 C 13 22.06 0.20 . 2 . . . . . 30 LEU CD1 . 52770 1 242 . 1 . 1 30 30 LEU CD2 C 13 22.06 0.20 . 2 . . . . . 30 LEU CD2 . 52770 1 243 . 1 . 1 30 30 LEU N N 15 120.32 0.20 . 1 . . . . . 30 LEU N . 52770 1 244 . 1 . 1 31 31 LEU H H 1 8.46 0.03 . 1 . . . . . 31 LEU H . 52770 1 245 . 1 . 1 31 31 LEU N N 15 116.02 0.20 . 1 . . . . . 31 LEU N . 52770 1 246 . 1 . 1 32 32 PRO HA H 1 4.41 0.03 . 1 . . . . . 32 PRO HA . 52770 1 247 . 1 . 1 32 32 PRO HB2 H 1 1.69 0.03 . 2 . . . . . 32 PRO HB2 . 52770 1 248 . 1 . 1 32 32 PRO HB3 H 1 2.26 0.03 . 2 . . . . . 32 PRO HB3 . 52770 1 249 . 1 . 1 32 32 PRO HG2 H 1 1.39 0.03 . 2 . . . . . 32 PRO HG2 . 52770 1 250 . 1 . 1 32 32 PRO HG3 H 1 2.19 0.03 . 2 . . . . . 32 PRO HG3 . 52770 1 251 . 1 . 1 32 32 PRO HD2 H 1 3.21 0.03 . 2 . . . . . 32 PRO HD2 . 52770 1 252 . 1 . 1 32 32 PRO CA C 13 64.74 0.20 . 1 . . . . . 32 PRO CA . 52770 1 253 . 1 . 1 32 32 PRO CB C 13 31.19 0.20 . 1 . . . . . 32 PRO CB . 52770 1 254 . 1 . 1 32 32 PRO CG C 13 28.62 0.20 . 1 . . . . . 32 PRO CG . 52770 1 255 . 1 . 1 33 33 LYS H H 1 6.61 0.03 . 1 . . . . . 33 LYS H . 52770 1 256 . 1 . 1 33 33 LYS HA H 1 4.13 0.03 . 1 . . . . . 33 LYS HA . 52770 1 257 . 1 . 1 33 33 LYS HB2 H 1 1.86 0.03 . 2 . . . . . 33 LYS HB2 . 52770 1 258 . 1 . 1 33 33 LYS HB3 H 1 1.79 0.03 . 2 . . . . . 33 LYS HB3 . 52770 1 259 . 1 . 1 33 33 LYS HG2 H 1 1.33 0.03 . 2 . . . . . 33 LYS HG2 . 52770 1 260 . 1 . 1 33 33 LYS HG3 H 1 1.57 0.03 . 2 . . . . . 33 LYS HG3 . 52770 1 261 . 1 . 1 33 33 LYS HD2 H 1 1.59 0.03 . 2 . . . . . 33 LYS HD2 . 52770 1 262 . 1 . 1 33 33 LYS HD3 H 1 1.59 0.03 . 2 . . . . . 33 LYS HD3 . 52770 1 263 . 1 . 1 33 33 LYS HE3 H 1 2.96 0.03 . 2 . . . . . 33 LYS HE3 . 52770 1 264 . 1 . 1 33 33 LYS CA C 13 57.63 0.20 . 1 . . . . . 33 LYS CA . 52770 1 265 . 1 . 1 33 33 LYS CB C 13 32.85 0.20 . 1 . . . . . 33 LYS CB . 52770 1 266 . 1 . 1 33 33 LYS CG C 13 25.29 0.20 . 1 . . . . . 33 LYS CG . 52770 1 267 . 1 . 1 33 33 LYS CD C 13 29.44 0.20 . 1 . . . . . 33 LYS CD . 52770 1 268 . 1 . 1 33 33 LYS CE C 13 41.96 0.20 . 1 . . . . . 33 LYS CE . 52770 1 269 . 1 . 1 33 33 LYS N N 15 112.30 0.20 . 1 . . . . . 33 LYS N . 52770 1 270 . 1 . 1 34 34 LEU H H 1 7.81 0.03 . 1 . . . . . 34 LEU H . 52770 1 271 . 1 . 1 34 34 LEU HB2 H 1 1.38 0.03 . 2 . . . . . 34 LEU HB2 . 52770 1 272 . 1 . 1 34 34 LEU HB3 H 1 1.57 0.03 . 2 . . . . . 34 LEU HB3 . 52770 1 273 . 1 . 1 34 34 LEU HG H 1 0.57 0.03 . 1 . . . . . 34 LEU HG . 52770 1 274 . 1 . 1 34 34 LEU HD11 H 1 0.47 0.03 . 2 . . . . . 34 LEU MD1 . 52770 1 275 . 1 . 1 34 34 LEU HD12 H 1 0.47 0.03 . 2 . . . . . 34 LEU MD1 . 52770 1 276 . 1 . 1 34 34 LEU HD13 H 1 0.47 0.03 . 2 . . . . . 34 LEU MD1 . 52770 1 277 . 1 . 1 34 34 LEU HD21 H 1 0.47 0.03 . 2 . . . . . 34 LEU MD2 . 52770 1 278 . 1 . 1 34 34 LEU HD22 H 1 0.47 0.03 . 2 . . . . . 34 LEU MD2 . 52770 1 279 . 1 . 1 34 34 LEU HD23 H 1 0.47 0.03 . 2 . . . . . 34 LEU MD2 . 52770 1 280 . 1 . 1 34 34 LEU CB C 13 43.40 0.20 . 1 . . . . . 34 LEU CB . 52770 1 281 . 1 . 1 34 34 LEU CG C 13 25.85 0.20 . 1 . . . . . 34 LEU CG . 52770 1 282 . 1 . 1 34 34 LEU CD1 C 13 22.06 0.20 . 2 . . . . . 34 LEU CD1 . 52770 1 283 . 1 . 1 34 34 LEU CD2 C 13 22.04 0.20 . 2 . . . . . 34 LEU CD2 . 52770 1 284 . 1 . 1 34 34 LEU N N 15 117.29 0.20 . 1 . . . . . 34 LEU N . 52770 1 285 . 1 . 1 35 35 LEU H H 1 7.99 0.03 . 1 . . . . . 35 LEU H . 52770 1 286 . 1 . 1 35 35 LEU HA H 1 5.06 0.03 . 1 . . . . . 35 LEU HA . 52770 1 287 . 1 . 1 35 35 LEU HB2 H 1 1.63 0.03 . 2 . . . . . 35 LEU HB2 . 52770 1 288 . 1 . 1 35 35 LEU HB3 H 1 1.68 0.03 . 2 . . . . . 35 LEU HB3 . 52770 1 289 . 1 . 1 35 35 LEU CA C 13 52.31 0.20 . 1 . . . . . 35 LEU CA . 52770 1 290 . 1 . 1 35 35 LEU CB C 13 42.60 0.20 . 1 . . . . . 35 LEU CB . 52770 1 291 . 1 . 1 35 35 LEU N N 15 118.17 0.20 . 1 . . . . . 35 LEU N . 52770 1 292 . 1 . 1 36 36 PRO HA H 1 4.64 0.03 . 1 . . . . . 36 PRO HA . 52770 1 293 . 1 . 1 36 36 PRO HG3 H 1 1.88 0.03 . 2 . . . . . 36 PRO HG3 . 52770 1 294 . 1 . 1 36 36 PRO HD2 H 1 3.28 0.03 . 2 . . . . . 36 PRO HD2 . 52770 1 295 . 1 . 1 36 36 PRO HD3 H 1 3.58 0.03 . 2 . . . . . 36 PRO HD3 . 52770 1 296 . 1 . 1 36 36 PRO CA C 13 65.11 0.20 . 1 . . . . . 36 PRO CA . 52770 1 297 . 1 . 1 36 36 PRO CG C 13 27.37 0.20 . 1 . . . . . 36 PRO CG . 52770 1 298 . 1 . 1 36 36 PRO CD C 13 50.30 0.20 . 1 . . . . . 36 PRO CD . 52770 1 299 . 1 . 1 37 37 GLN H H 1 8.79 0.03 . 1 . . . . . 37 GLN H . 52770 1 300 . 1 . 1 37 37 GLN HA H 1 4.17 0.03 . 1 . . . . . 37 GLN HA . 52770 1 301 . 1 . 1 37 37 GLN HB2 H 1 2.04 0.03 . 2 . . . . . 37 GLN HB2 . 52770 1 302 . 1 . 1 37 37 GLN HB3 H 1 2.13 0.03 . 2 . . . . . 37 GLN HB3 . 52770 1 303 . 1 . 1 37 37 GLN HG3 H 1 2.49 0.03 . 2 . . . . . 37 GLN HG3 . 52770 1 304 . 1 . 1 37 37 GLN CA C 13 56.74 0.20 . 1 . . . . . 37 GLN CA . 52770 1 305 . 1 . 1 37 37 GLN CB C 13 27.80 0.20 . 1 . . . . . 37 GLN CB . 52770 1 306 . 1 . 1 37 37 GLN CG C 13 33.71 0.20 . 1 . . . . . 37 GLN CG . 52770 1 307 . 1 . 1 37 37 GLN N N 15 116.89 0.20 . 1 . . . . . 37 GLN N . 52770 1 308 . 1 . 1 38 38 ALA H H 1 7.57 0.03 . 1 . . . . . 38 ALA H . 52770 1 309 . 1 . 1 38 38 ALA HA H 1 5.12 0.03 . 1 . . . . . 38 ALA HA . 52770 1 310 . 1 . 1 38 38 ALA HB1 H 1 1.46 0.03 . 1 . . . . . 38 ALA MB . 52770 1 311 . 1 . 1 38 38 ALA HB2 H 1 1.46 0.03 . 1 . . . . . 38 ALA MB . 52770 1 312 . 1 . 1 38 38 ALA HB3 H 1 1.46 0.03 . 1 . . . . . 38 ALA MB . 52770 1 313 . 1 . 1 38 38 ALA CA C 13 52.91 0.20 . 1 . . . . . 38 ALA CA . 52770 1 314 . 1 . 1 38 38 ALA CB C 13 22.53 0.20 . 1 . . . . . 38 ALA CB . 52770 1 315 . 1 . 1 38 38 ALA N N 15 120.98 0.20 . 1 . . . . . 38 ALA N . 52770 1 316 . 1 . 1 39 39 ILE H H 1 8.59 0.03 . 1 . . . . . 39 ILE H . 52770 1 317 . 1 . 1 39 39 ILE HA H 1 4.20 0.03 . 1 . . . . . 39 ILE HA . 52770 1 318 . 1 . 1 39 39 ILE HB H 1 1.75 0.03 . 1 . . . . . 39 ILE HB . 52770 1 319 . 1 . 1 39 39 ILE HG13 H 1 0.99 0.03 . 2 . . . . . 39 ILE HG13 . 52770 1 320 . 1 . 1 39 39 ILE HG21 H 1 0.61 0.03 . 1 . . . . . 39 ILE MG . 52770 1 321 . 1 . 1 39 39 ILE HG22 H 1 0.61 0.03 . 1 . . . . . 39 ILE MG . 52770 1 322 . 1 . 1 39 39 ILE HG23 H 1 0.61 0.03 . 1 . . . . . 39 ILE MG . 52770 1 323 . 1 . 1 39 39 ILE HD11 H 1 0.76 0.03 . 1 . . . . . 39 ILE MD . 52770 1 324 . 1 . 1 39 39 ILE HD12 H 1 0.76 0.03 . 1 . . . . . 39 ILE MD . 52770 1 325 . 1 . 1 39 39 ILE HD13 H 1 0.76 0.03 . 1 . . . . . 39 ILE MD . 52770 1 326 . 1 . 1 39 39 ILE CA C 13 60.43 0.20 . 1 . . . . . 39 ILE CA . 52770 1 327 . 1 . 1 39 39 ILE CB C 13 37.01 0.20 . 1 . . . . . 39 ILE CB . 52770 1 328 . 1 . 1 39 39 ILE CG1 C 13 27.23 0.20 . 1 . . . . . 39 ILE CG1 . 52770 1 329 . 1 . 1 39 39 ILE CG2 C 13 17.54 0.20 . 1 . . . . . 39 ILE CG2 . 52770 1 330 . 1 . 1 39 39 ILE CD1 C 13 13.91 0.20 . 1 . . . . . 39 ILE CD1 . 52770 1 331 . 1 . 1 39 39 ILE N N 15 118.17 0.20 . 1 . . . . . 39 ILE N . 52770 1 332 . 1 . 1 40 40 LYS H H 1 8.48 0.03 . 1 . . . . . 40 LYS H . 52770 1 333 . 1 . 1 40 40 LYS HA H 1 4.24 0.03 . 1 . . . . . 40 LYS HA . 52770 1 334 . 1 . 1 40 40 LYS HB2 H 1 1.80 0.03 . 2 . . . . . 40 LYS HB2 . 52770 1 335 . 1 . 1 40 40 LYS HB3 H 1 1.51 0.03 . 2 . . . . . 40 LYS HB3 . 52770 1 336 . 1 . 1 40 40 LYS HG2 H 1 1.30 0.03 . 2 . . . . . 40 LYS HG2 . 52770 1 337 . 1 . 1 40 40 LYS HG3 H 1 1.36 0.03 . 2 . . . . . 40 LYS HG3 . 52770 1 338 . 1 . 1 40 40 LYS HD2 H 1 1.50 0.03 . 2 . . . . . 40 LYS HD2 . 52770 1 339 . 1 . 1 40 40 LYS HD3 H 1 1.53 0.03 . 2 . . . . . 40 LYS HD3 . 52770 1 340 . 1 . 1 40 40 LYS CA C 13 55.80 0.20 . 1 . . . . . 40 LYS CA . 52770 1 341 . 1 . 1 40 40 LYS CB C 13 31.59 0.20 . 1 . . . . . 40 LYS CB . 52770 1 342 . 1 . 1 40 40 LYS CG C 13 23.42 0.20 . 1 . . . . . 40 LYS CG . 52770 1 343 . 1 . 1 40 40 LYS CD C 13 26.91 0.20 . 1 . . . . . 40 LYS CD . 52770 1 344 . 1 . 1 40 40 LYS N N 15 123.28 0.20 . 1 . . . . . 40 LYS N . 52770 1 345 . 1 . 1 41 41 SER H H 1 7.44 0.03 . 1 . . . . . 41 SER H . 52770 1 346 . 1 . 1 41 41 SER HA H 1 4.48 0.03 . 1 . . . . . 41 SER HA . 52770 1 347 . 1 . 1 41 41 SER HB2 H 1 3.79 0.03 . 2 . . . . . 41 SER HB2 . 52770 1 348 . 1 . 1 41 41 SER HB3 H 1 3.86 0.03 . 2 . . . . . 41 SER HB3 . 52770 1 349 . 1 . 1 41 41 SER CA C 13 57.94 0.20 . 1 . . . . . 41 SER CA . 52770 1 350 . 1 . 1 41 41 SER CB C 13 64.50 0.20 . 1 . . . . . 41 SER CB . 52770 1 351 . 1 . 1 41 41 SER N N 15 107.71 0.20 . 1 . . . . . 41 SER N . 52770 1 352 . 1 . 1 42 42 ILE H H 1 8.55 0.03 . 1 . . . . . 42 ILE H . 52770 1 353 . 1 . 1 42 42 ILE HA H 1 4.57 0.03 . 1 . . . . . 42 ILE HA . 52770 1 354 . 1 . 1 42 42 ILE HB H 1 1.66 0.03 . 1 . . . . . 42 ILE HB . 52770 1 355 . 1 . 1 42 42 ILE HG12 H 1 1.41 0.03 . 2 . . . . . 42 ILE HG12 . 52770 1 356 . 1 . 1 42 42 ILE HG13 H 1 1.00 0.03 . 2 . . . . . 42 ILE HG13 . 52770 1 357 . 1 . 1 42 42 ILE HG21 H 1 0.70 0.03 . 1 . . . . . 42 ILE MG . 52770 1 358 . 1 . 1 42 42 ILE HG22 H 1 0.70 0.03 . 1 . . . . . 42 ILE MG . 52770 1 359 . 1 . 1 42 42 ILE HG23 H 1 0.70 0.03 . 1 . . . . . 42 ILE MG . 52770 1 360 . 1 . 1 42 42 ILE HD11 H 1 0.80 0.03 . 1 . . . . . 42 ILE MD . 52770 1 361 . 1 . 1 42 42 ILE HD12 H 1 0.80 0.03 . 1 . . . . . 42 ILE MD . 52770 1 362 . 1 . 1 42 42 ILE HD13 H 1 0.80 0.03 . 1 . . . . . 42 ILE MD . 52770 1 363 . 1 . 1 42 42 ILE CA C 13 62.21 0.20 . 1 . . . . . 42 ILE CA . 52770 1 364 . 1 . 1 42 42 ILE CB C 13 40.85 0.20 . 1 . . . . . 42 ILE CB . 52770 1 365 . 1 . 1 42 42 ILE CG1 C 13 28.40 0.20 . 1 . . . . . 42 ILE CG1 . 52770 1 366 . 1 . 1 42 42 ILE CG2 C 13 17.29 0.20 . 1 . . . . . 42 ILE CG2 . 52770 1 367 . 1 . 1 42 42 ILE CD1 C 13 14.06 0.20 . 1 . . . . . 42 ILE CD1 . 52770 1 368 . 1 . 1 42 42 ILE N N 15 122.86 0.20 . 1 . . . . . 42 ILE N . 52770 1 369 . 1 . 1 43 43 GLU H H 1 8.75 0.03 . 1 . . . . . 43 GLU H . 52770 1 370 . 1 . 1 43 43 GLU HA H 1 4.78 0.03 . 1 . . . . . 43 GLU HA . 52770 1 371 . 1 . 1 43 43 GLU HB2 H 1 1.97 0.03 . 2 . . . . . 43 GLU HB2 . 52770 1 372 . 1 . 1 43 43 GLU HB3 H 1 1.84 0.03 . 2 . . . . . 43 GLU HB3 . 52770 1 373 . 1 . 1 43 43 GLU CA C 13 54.10 0.20 . 1 . . . . . 43 GLU CA . 52770 1 374 . 1 . 1 43 43 GLU CB C 13 34.53 0.20 . 1 . . . . . 43 GLU CB . 52770 1 375 . 1 . 1 43 43 GLU N N 15 125.68 0.20 . 1 . . . . . 43 GLU N . 52770 1 376 . 1 . 1 44 44 THR H H 1 9.24 0.03 . 1 . . . . . 44 THR H . 52770 1 377 . 1 . 1 44 44 THR HA H 1 4.42 0.03 . 1 . . . . . 44 THR HA . 52770 1 378 . 1 . 1 44 44 THR HB H 1 4.06 0.03 . 1 . . . . . 44 THR HB . 52770 1 379 . 1 . 1 44 44 THR HG21 H 1 1.04 0.03 . 1 . . . . . 44 THR MG . 52770 1 380 . 1 . 1 44 44 THR HG22 H 1 1.04 0.03 . 1 . . . . . 44 THR MG . 52770 1 381 . 1 . 1 44 44 THR HG23 H 1 1.04 0.03 . 1 . . . . . 44 THR MG . 52770 1 382 . 1 . 1 44 44 THR CA C 13 64.06 0.20 . 1 . . . . . 44 THR CA . 52770 1 383 . 1 . 1 44 44 THR CB C 13 68.55 0.20 . 1 . . . . . 44 THR CB . 52770 1 384 . 1 . 1 44 44 THR CG2 C 13 22.44 0.20 . 1 . . . . . 44 THR CG2 . 52770 1 385 . 1 . 1 44 44 THR N N 15 122.90 0.20 . 1 . . . . . 44 THR N . 52770 1 386 . 1 . 1 45 45 ILE H H 1 8.92 0.03 . 1 . . . . . 45 ILE H . 52770 1 387 . 1 . 1 45 45 ILE HA H 1 4.36 0.03 . 1 . . . . . 45 ILE HA . 52770 1 388 . 1 . 1 45 45 ILE HB H 1 1.94 0.03 . 1 . . . . . 45 ILE HB . 52770 1 389 . 1 . 1 45 45 ILE HG12 H 1 1.35 0.03 . 2 . . . . . 45 ILE HG12 . 52770 1 390 . 1 . 1 45 45 ILE HG13 H 1 1.13 0.03 . 2 . . . . . 45 ILE HG13 . 52770 1 391 . 1 . 1 45 45 ILE HG21 H 1 0.93 0.03 . 1 . . . . . 45 ILE MG . 52770 1 392 . 1 . 1 45 45 ILE HG22 H 1 0.93 0.03 . 1 . . . . . 45 ILE MG . 52770 1 393 . 1 . 1 45 45 ILE HG23 H 1 0.93 0.03 . 1 . . . . . 45 ILE MG . 52770 1 394 . 1 . 1 45 45 ILE HD11 H 1 0.80 0.03 . 1 . . . . . 45 ILE MD . 52770 1 395 . 1 . 1 45 45 ILE HD12 H 1 0.80 0.03 . 1 . . . . . 45 ILE MD . 52770 1 396 . 1 . 1 45 45 ILE HD13 H 1 0.80 0.03 . 1 . . . . . 45 ILE MD . 52770 1 397 . 1 . 1 45 45 ILE CA C 13 61.54 0.20 . 1 . . . . . 45 ILE CA . 52770 1 398 . 1 . 1 45 45 ILE CB C 13 38.47 0.20 . 1 . . . . . 45 ILE CB . 52770 1 399 . 1 . 1 45 45 ILE CG1 C 13 26.99 0.20 . 1 . . . . . 45 ILE CG1 . 52770 1 400 . 1 . 1 45 45 ILE CG2 C 13 17.93 0.20 . 1 . . . . . 45 ILE CG2 . 52770 1 401 . 1 . 1 45 45 ILE CD1 C 13 12.70 0.20 . 1 . . . . . 45 ILE CD1 . 52770 1 402 . 1 . 1 45 45 ILE N N 15 125.24 0.20 . 1 . . . . . 45 ILE N . 52770 1 403 . 1 . 1 46 46 GLU H H 1 7.69 0.03 . 1 . . . . . 46 GLU H . 52770 1 404 . 1 . 1 46 46 GLU HA H 1 4.60 0.03 . 1 . . . . . 46 GLU HA . 52770 1 405 . 1 . 1 46 46 GLU CA C 13 56.15 0.20 . 1 . . . . . 46 GLU CA . 52770 1 406 . 1 . 1 46 46 GLU N N 15 119.01 0.20 . 1 . . . . . 46 GLU N . 52770 1 407 . 1 . 1 47 47 GLY H H 1 8.60 0.03 . 1 . . . . . 47 GLY H . 52770 1 408 . 1 . 1 47 47 GLY HA2 H 1 3.84 0.03 . 2 . . . . . 47 GLY HA2 . 52770 1 409 . 1 . 1 47 47 GLY HA3 H 1 4.70 0.03 . 2 . . . . . 47 GLY HA3 . 52770 1 410 . 1 . 1 47 47 GLY CA C 13 44.57 0.20 . 1 . . . . . 47 GLY CA . 52770 1 411 . 1 . 1 47 47 GLY N N 15 110.42 0.20 . 1 . . . . . 47 GLY N . 52770 1 412 . 1 . 1 48 48 ASP H H 1 7.99 0.03 . 1 . . . . . 48 ASP H . 52770 1 413 . 1 . 1 48 48 ASP HA H 1 4.74 0.03 . 1 . . . . . 48 ASP HA . 52770 1 414 . 1 . 1 48 48 ASP HB2 H 1 2.60 0.03 . 2 . . . . . 48 ASP HB2 . 52770 1 415 . 1 . 1 48 48 ASP HB3 H 1 3.01 0.03 . 2 . . . . . 48 ASP HB3 . 52770 1 416 . 1 . 1 48 48 ASP CA C 13 53.33 0.20 . 1 . . . . . 48 ASP CA . 52770 1 417 . 1 . 1 48 48 ASP CB C 13 41.79 0.20 . 1 . . . . . 48 ASP CB . 52770 1 418 . 1 . 1 48 48 ASP N N 15 115.75 0.20 . 1 . . . . . 48 ASP N . 52770 1 419 . 1 . 1 49 49 GLY H H 1 8.74 0.03 . 1 . . . . . 49 GLY H . 52770 1 420 . 1 . 1 49 49 GLY HA3 H 1 3.58 0.03 . 2 . . . . . 49 GLY HA3 . 52770 1 421 . 1 . 1 49 49 GLY CA C 13 45.13 0.20 . 1 . . . . . 49 GLY CA . 52770 1 422 . 1 . 1 49 49 GLY N N 15 110.72 0.20 . 1 . . . . . 49 GLY N . 52770 1 423 . 1 . 1 50 50 GLY H H 1 8.30 0.03 . 1 . . . . . 50 GLY H . 52770 1 424 . 1 . 1 50 50 GLY HA2 H 1 4.03 0.03 . 2 . . . . . 50 GLY HA2 . 52770 1 425 . 1 . 1 50 50 GLY HA3 H 1 4.52 0.03 . 2 . . . . . 50 GLY HA3 . 52770 1 426 . 1 . 1 50 50 GLY CA C 13 43.57 0.20 . 1 . . . . . 50 GLY CA . 52770 1 427 . 1 . 1 50 50 GLY N N 15 106.86 0.20 . 1 . . . . . 50 GLY N . 52770 1 428 . 1 . 1 51 51 PRO HA H 1 4.03 0.03 . 1 . . . . . 51 PRO HA . 52770 1 429 . 1 . 1 51 51 PRO HB2 H 1 2.36 0.03 . 2 . . . . . 51 PRO HB2 . 52770 1 430 . 1 . 1 51 51 PRO HB3 H 1 1.96 0.03 . 2 . . . . . 51 PRO HB3 . 52770 1 431 . 1 . 1 51 51 PRO HG2 H 1 1.96 0.03 . 2 . . . . . 51 PRO HG2 . 52770 1 432 . 1 . 1 51 51 PRO HG3 H 1 2.39 0.03 . 2 . . . . . 51 PRO HG3 . 52770 1 433 . 1 . 1 51 51 PRO HD2 H 1 3.75 0.03 . 2 . . . . . 51 PRO HD2 . 52770 1 434 . 1 . 1 51 51 PRO HD3 H 1 3.75 0.03 . 2 . . . . . 51 PRO HD3 . 52770 1 435 . 1 . 1 51 51 PRO CA C 13 64.56 0.20 . 1 . . . . . 51 PRO CA . 52770 1 436 . 1 . 1 51 51 PRO CB C 13 31.52 0.20 . 1 . . . . . 51 PRO CB . 52770 1 437 . 1 . 1 51 51 PRO CG C 13 28.77 0.20 . 1 . . . . . 51 PRO CG . 52770 1 438 . 1 . 1 51 51 PRO CD C 13 49.96 0.20 . 1 . . . . . 51 PRO CD . 52770 1 439 . 1 . 1 52 52 GLY H H 1 9.58 0.03 . 1 . . . . . 52 GLY H . 52770 1 440 . 1 . 1 52 52 GLY HA2 H 1 3.96 0.03 . 2 . . . . . 52 GLY HA2 . 52770 1 441 . 1 . 1 52 52 GLY HA3 H 1 4.00 0.03 . 2 . . . . . 52 GLY HA3 . 52770 1 442 . 1 . 1 52 52 GLY CA C 13 45.12 0.20 . 1 . . . . . 52 GLY CA . 52770 1 443 . 1 . 1 52 52 GLY N N 15 114.36 0.20 . 1 . . . . . 52 GLY N . 52770 1 444 . 1 . 1 53 53 THR H H 1 7.99 0.03 . 1 . . . . . 53 THR H . 52770 1 445 . 1 . 1 53 53 THR HA H 1 4.62 0.03 . 1 . . . . . 53 THR HA . 52770 1 446 . 1 . 1 53 53 THR HB H 1 4.10 0.03 . 1 . . . . . 53 THR HB . 52770 1 447 . 1 . 1 53 53 THR HG21 H 1 1.35 0.03 . 1 . . . . . 53 THR MG . 52770 1 448 . 1 . 1 53 53 THR HG22 H 1 1.35 0.03 . 1 . . . . . 53 THR MG . 52770 1 449 . 1 . 1 53 53 THR HG23 H 1 1.35 0.03 . 1 . . . . . 53 THR MG . 52770 1 450 . 1 . 1 53 53 THR CA C 13 64.50 0.20 . 1 . . . . . 53 THR CA . 52770 1 451 . 1 . 1 53 53 THR CB C 13 69.56 0.20 . 1 . . . . . 53 THR CB . 52770 1 452 . 1 . 1 53 53 THR CG2 C 13 21.12 0.20 . 1 . . . . . 53 THR CG2 . 52770 1 453 . 1 . 1 53 53 THR N N 15 119.51 0.20 . 1 . . . . . 53 THR N . 52770 1 454 . 1 . 1 54 54 ILE H H 1 8.72 0.03 . 1 . . . . . 54 ILE H . 52770 1 455 . 1 . 1 54 54 ILE HA H 1 5.33 0.03 . 1 . . . . . 54 ILE HA . 52770 1 456 . 1 . 1 54 54 ILE HB H 1 1.79 0.03 . 1 . . . . . 54 ILE HB . 52770 1 457 . 1 . 1 54 54 ILE HG12 H 1 1.71 0.03 . 2 . . . . . 54 ILE HG12 . 52770 1 458 . 1 . 1 54 54 ILE HG21 H 1 0.88 0.03 . 1 . . . . . 54 ILE MG . 52770 1 459 . 1 . 1 54 54 ILE HG22 H 1 0.88 0.03 . 1 . . . . . 54 ILE MG . 52770 1 460 . 1 . 1 54 54 ILE HG23 H 1 0.88 0.03 . 1 . . . . . 54 ILE MG . 52770 1 461 . 1 . 1 54 54 ILE CA C 13 58.99 0.20 . 1 . . . . . 54 ILE CA . 52770 1 462 . 1 . 1 54 54 ILE CB C 13 39.85 0.20 . 1 . . . . . 54 ILE CB . 52770 1 463 . 1 . 1 54 54 ILE CG2 C 13 17.69 0.20 . 1 . . . . . 54 ILE CG2 . 52770 1 464 . 1 . 1 54 54 ILE N N 15 125.29 0.20 . 1 . . . . . 54 ILE N . 52770 1 465 . 1 . 1 55 55 LYS H H 1 9.42 0.03 . 1 . . . . . 55 LYS H . 52770 1 466 . 1 . 1 55 55 LYS HA H 1 5.27 0.03 . 1 . . . . . 55 LYS HA . 52770 1 467 . 1 . 1 55 55 LYS HB2 H 1 1.49 0.03 . 2 . . . . . 55 LYS HB2 . 52770 1 468 . 1 . 1 55 55 LYS HB3 H 1 1.57 0.03 . 2 . . . . . 55 LYS HB3 . 52770 1 469 . 1 . 1 55 55 LYS HG2 H 1 1.38 0.03 . 2 . . . . . 55 LYS HG2 . 52770 1 470 . 1 . 1 55 55 LYS HG3 H 1 1.38 0.03 . 2 . . . . . 55 LYS HG3 . 52770 1 471 . 1 . 1 55 55 LYS HD3 H 1 1.52 0.03 . 2 . . . . . 55 LYS HD3 . 52770 1 472 . 1 . 1 55 55 LYS HE2 H 1 2.80 0.03 . 2 . . . . . 55 LYS HE2 . 52770 1 473 . 1 . 1 55 55 LYS HE3 H 1 2.75 0.03 . 2 . . . . . 55 LYS HE3 . 52770 1 474 . 1 . 1 55 55 LYS CA C 13 53.90 0.20 . 1 . . . . . 55 LYS CA . 52770 1 475 . 1 . 1 55 55 LYS CB C 13 35.69 0.20 . 1 . . . . . 55 LYS CB . 52770 1 476 . 1 . 1 55 55 LYS CG C 13 25.65 0.20 . 1 . . . . . 55 LYS CG . 52770 1 477 . 1 . 1 55 55 LYS CD C 13 29.09 0.20 . 1 . . . . . 55 LYS CD . 52770 1 478 . 1 . 1 55 55 LYS CE C 13 41.66 0.20 . 1 . . . . . 55 LYS CE . 52770 1 479 . 1 . 1 55 55 LYS N N 15 126.10 0.20 . 1 . . . . . 55 LYS N . 52770 1 480 . 1 . 1 56 56 LYS H H 1 9.40 0.03 . 1 . . . . . 56 LYS H . 52770 1 481 . 1 . 1 56 56 LYS HA H 1 5.23 0.03 . 1 . . . . . 56 LYS HA . 52770 1 482 . 1 . 1 56 56 LYS HB2 H 1 1.41 0.03 . 2 . . . . . 56 LYS HB2 . 52770 1 483 . 1 . 1 56 56 LYS HB3 H 1 1.79 0.03 . 2 . . . . . 56 LYS HB3 . 52770 1 484 . 1 . 1 56 56 LYS HG2 H 1 1.12 0.03 . 2 . . . . . 56 LYS HG2 . 52770 1 485 . 1 . 1 56 56 LYS HG3 H 1 1.25 0.03 . 2 . . . . . 56 LYS HG3 . 52770 1 486 . 1 . 1 56 56 LYS HD2 H 1 1.50 0.03 . 2 . . . . . 56 LYS HD2 . 52770 1 487 . 1 . 1 56 56 LYS HE2 H 1 2.50 0.03 . 2 . . . . . 56 LYS HE2 . 52770 1 488 . 1 . 1 56 56 LYS HE3 H 1 2.57 0.03 . 2 . . . . . 56 LYS HE3 . 52770 1 489 . 1 . 1 56 56 LYS CA C 13 54.52 0.20 . 1 . . . . . 56 LYS CA . 52770 1 490 . 1 . 1 56 56 LYS CB C 13 36.22 0.20 . 1 . . . . . 56 LYS CB . 52770 1 491 . 1 . 1 56 56 LYS CG C 13 24.85 0.20 . 1 . . . . . 56 LYS CG . 52770 1 492 . 1 . 1 56 56 LYS CE C 13 41.33 0.20 . 1 . . . . . 56 LYS CE . 52770 1 493 . 1 . 1 56 56 LYS N N 15 122.74 0.20 . 1 . . . . . 56 LYS N . 52770 1 494 . 1 . 1 57 57 ILE H H 1 9.60 0.03 . 1 . . . . . 57 ILE H . 52770 1 495 . 1 . 1 57 57 ILE HA H 1 4.82 0.03 . 1 . . . . . 57 ILE HA . 52770 1 496 . 1 . 1 57 57 ILE HB H 1 1.66 0.03 . 1 . . . . . 57 ILE HB . 52770 1 497 . 1 . 1 57 57 ILE HG12 H 1 1.19 0.03 . 2 . . . . . 57 ILE HG12 . 52770 1 498 . 1 . 1 57 57 ILE HG13 H 1 0.92 0.03 . 2 . . . . . 57 ILE HG13 . 52770 1 499 . 1 . 1 57 57 ILE HG21 H 1 0.81 0.03 . 1 . . . . . 57 ILE MG . 52770 1 500 . 1 . 1 57 57 ILE HG22 H 1 0.81 0.03 . 1 . . . . . 57 ILE MG . 52770 1 501 . 1 . 1 57 57 ILE HG23 H 1 0.81 0.03 . 1 . . . . . 57 ILE MG . 52770 1 502 . 1 . 1 57 57 ILE CA C 13 59.80 0.20 . 1 . . . . . 57 ILE CA . 52770 1 503 . 1 . 1 57 57 ILE CB C 13 40.13 0.20 . 1 . . . . . 57 ILE CB . 52770 1 504 . 1 . 1 57 57 ILE CG1 C 13 29.13 0.20 . 1 . . . . . 57 ILE CG1 . 52770 1 505 . 1 . 1 57 57 ILE CG2 C 13 18.60 0.20 . 1 . . . . . 57 ILE CG2 . 52770 1 506 . 1 . 1 57 57 ILE N N 15 132.69 0.20 . 1 . . . . . 57 ILE N . 52770 1 507 . 1 . 1 58 58 THR H H 1 8.78 0.03 . 1 . . . . . 58 THR H . 52770 1 508 . 1 . 1 58 58 THR HA H 1 4.93 0.03 . 1 . . . . . 58 THR HA . 52770 1 509 . 1 . 1 58 58 THR HB H 1 4.03 0.03 . 1 . . . . . 58 THR HB . 52770 1 510 . 1 . 1 58 58 THR HG21 H 1 1.05 0.03 . 1 . . . . . 58 THR MG . 52770 1 511 . 1 . 1 58 58 THR HG22 H 1 1.05 0.03 . 1 . . . . . 58 THR MG . 52770 1 512 . 1 . 1 58 58 THR HG23 H 1 1.05 0.03 . 1 . . . . . 58 THR MG . 52770 1 513 . 1 . 1 58 58 THR CA C 13 62.82 0.20 . 1 . . . . . 58 THR CA . 52770 1 514 . 1 . 1 58 58 THR CB C 13 69.18 0.20 . 1 . . . . . 58 THR CB . 52770 1 515 . 1 . 1 58 58 THR CG2 C 13 21.55 0.20 . 1 . . . . . 58 THR CG2 . 52770 1 516 . 1 . 1 58 58 THR N N 15 124.64 0.20 . 1 . . . . . 58 THR N . 52770 1 517 . 1 . 1 59 59 ILE HA H 1 5.23 0.03 . 1 . . . . . 59 ILE HA . 52770 1 518 . 1 . 1 59 59 ILE HB H 1 1.69 0.03 . 1 . . . . . 59 ILE HB . 52770 1 519 . 1 . 1 59 59 ILE HG21 H 1 0.83 0.03 . 1 . . . . . 59 ILE MG . 52770 1 520 . 1 . 1 59 59 ILE HG22 H 1 0.83 0.03 . 1 . . . . . 59 ILE MG . 52770 1 521 . 1 . 1 59 59 ILE HG23 H 1 0.83 0.03 . 1 . . . . . 59 ILE MG . 52770 1 522 . 1 . 1 59 59 ILE HD11 H 1 0.76 0.03 . 1 . . . . . 59 ILE MD . 52770 1 523 . 1 . 1 59 59 ILE HD12 H 1 0.76 0.03 . 1 . . . . . 59 ILE MD . 52770 1 524 . 1 . 1 59 59 ILE HD13 H 1 0.76 0.03 . 1 . . . . . 59 ILE MD . 52770 1 525 . 1 . 1 59 59 ILE CA C 13 57.92 0.20 . 1 . . . . . 59 ILE CA . 52770 1 526 . 1 . 1 59 59 ILE CB C 13 41.73 0.20 . 1 . . . . . 59 ILE CB . 52770 1 527 . 1 . 1 59 59 ILE CG2 C 13 17.98 0.20 . 1 . . . . . 59 ILE CG2 . 52770 1 528 . 1 . 1 59 59 ILE CD1 C 13 13.91 0.20 . 1 . . . . . 59 ILE CD1 . 52770 1 529 . 1 . 1 60 60 ALA H H 1 9.00 0.03 . 1 . . . . . 60 ALA H . 52770 1 530 . 1 . 1 60 60 ALA HA H 1 5.07 0.03 . 1 . . . . . 60 ALA HA . 52770 1 531 . 1 . 1 60 60 ALA HB1 H 1 1.30 0.03 . 1 . . . . . 60 ALA MB . 52770 1 532 . 1 . 1 60 60 ALA HB2 H 1 1.30 0.03 . 1 . . . . . 60 ALA MB . 52770 1 533 . 1 . 1 60 60 ALA HB3 H 1 1.30 0.03 . 1 . . . . . 60 ALA MB . 52770 1 534 . 1 . 1 60 60 ALA CA C 13 50.44 0.20 . 1 . . . . . 60 ALA CA . 52770 1 535 . 1 . 1 60 60 ALA CB C 13 21.29 0.20 . 1 . . . . . 60 ALA CB . 52770 1 536 . 1 . 1 60 60 ALA N N 15 126.35 0.20 . 1 . . . . . 60 ALA N . 52770 1 537 . 1 . 1 61 61 GLU H H 1 8.55 0.03 . 1 . . . . . 61 GLU H . 52770 1 538 . 1 . 1 61 61 GLU HA H 1 4.52 0.03 . 1 . . . . . 61 GLU HA . 52770 1 539 . 1 . 1 61 61 GLU HB2 H 1 2.00 0.03 . 2 . . . . . 61 GLU HB2 . 52770 1 540 . 1 . 1 61 61 GLU HB3 H 1 1.87 0.03 . 2 . . . . . 61 GLU HB3 . 52770 1 541 . 1 . 1 61 61 GLU CA C 13 54.81 0.20 . 1 . . . . . 61 GLU CA . 52770 1 542 . 1 . 1 61 61 GLU CB C 13 30.94 0.20 . 1 . . . . . 61 GLU CB . 52770 1 543 . 1 . 1 61 61 GLU N N 15 124.11 0.20 . 1 . . . . . 61 GLU N . 52770 1 544 . 1 . 1 62 62 GLY H H 1 8.88 0.03 . 1 . . . . . 62 GLY H . 52770 1 545 . 1 . 1 62 62 GLY N N 15 115.96 0.20 . 1 . . . . . 62 GLY N . 52770 1 546 . 1 . 1 63 63 THR HA H 1 4.23 0.03 . 1 . . . . . 63 THR HA . 52770 1 547 . 1 . 1 63 63 THR HB H 1 4.44 0.03 . 1 . . . . . 63 THR HB . 52770 1 548 . 1 . 1 63 63 THR HG21 H 1 1.19 0.03 . 1 . . . . . 63 THR MG . 52770 1 549 . 1 . 1 63 63 THR HG22 H 1 1.19 0.03 . 1 . . . . . 63 THR MG . 52770 1 550 . 1 . 1 63 63 THR HG23 H 1 1.19 0.03 . 1 . . . . . 63 THR MG . 52770 1 551 . 1 . 1 63 63 THR CA C 13 61.92 0.20 . 1 . . . . . 63 THR CA . 52770 1 552 . 1 . 1 63 63 THR CB C 13 68.79 0.20 . 1 . . . . . 63 THR CB . 52770 1 553 . 1 . 1 63 63 THR CG2 C 13 21.72 0.20 . 1 . . . . . 63 THR CG2 . 52770 1 554 . 1 . 1 64 64 HIS H H 1 8.05 0.03 . 1 . . . . . 64 HIS H . 52770 1 555 . 1 . 1 64 64 HIS HA H 1 4.60 0.03 . 1 . . . . . 64 HIS HA . 52770 1 556 . 1 . 1 64 64 HIS HB2 H 1 2.60 0.03 . 2 . . . . . 64 HIS HB2 . 52770 1 557 . 1 . 1 64 64 HIS HB3 H 1 2.66 0.03 . 2 . . . . . 64 HIS HB3 . 52770 1 558 . 1 . 1 64 64 HIS CA C 13 55.37 0.20 . 1 . . . . . 64 HIS CA . 52770 1 559 . 1 . 1 64 64 HIS CB C 13 32.13 0.20 . 1 . . . . . 64 HIS CB . 52770 1 560 . 1 . 1 64 64 HIS N N 15 122.74 0.20 . 1 . . . . . 64 HIS N . 52770 1 561 . 1 . 1 65 65 ILE H H 1 8.19 0.03 . 1 . . . . . 65 ILE H . 52770 1 562 . 1 . 1 65 65 ILE HA H 1 4.84 0.03 . 1 . . . . . 65 ILE HA . 52770 1 563 . 1 . 1 65 65 ILE HB H 1 1.73 0.03 . 1 . . . . . 65 ILE HB . 52770 1 564 . 1 . 1 65 65 ILE HG12 H 1 1.39 0.03 . 2 . . . . . 65 ILE HG12 . 52770 1 565 . 1 . 1 65 65 ILE HG21 H 1 0.62 0.03 . 1 . . . . . 65 ILE MG . 52770 1 566 . 1 . 1 65 65 ILE HG22 H 1 0.62 0.03 . 1 . . . . . 65 ILE MG . 52770 1 567 . 1 . 1 65 65 ILE HG23 H 1 0.62 0.03 . 1 . . . . . 65 ILE MG . 52770 1 568 . 1 . 1 65 65 ILE CA C 13 58.95 0.20 . 1 . . . . . 65 ILE CA . 52770 1 569 . 1 . 1 65 65 ILE CB C 13 38.35 0.20 . 1 . . . . . 65 ILE CB . 52770 1 570 . 1 . 1 65 65 ILE CG2 C 13 17.86 0.20 . 1 . . . . . 65 ILE CG2 . 52770 1 571 . 1 . 1 65 65 ILE N N 15 125.34 0.20 . 1 . . . . . 65 ILE N . 52770 1 572 . 1 . 1 66 66 LYS H H 1 9.10 0.03 . 1 . . . . . 66 LYS H . 52770 1 573 . 1 . 1 66 66 LYS HA H 1 4.60 0.03 . 1 . . . . . 66 LYS HA . 52770 1 574 . 1 . 1 66 66 LYS HB2 H 1 1.71 0.03 . 2 . . . . . 66 LYS HB2 . 52770 1 575 . 1 . 1 66 66 LYS HB3 H 1 1.60 0.03 . 2 . . . . . 66 LYS HB3 . 52770 1 576 . 1 . 1 66 66 LYS HG2 H 1 1.18 0.03 . 2 . . . . . 66 LYS HG2 . 52770 1 577 . 1 . 1 66 66 LYS CA C 13 54.27 0.20 . 1 . . . . . 66 LYS CA . 52770 1 578 . 1 . 1 66 66 LYS CB C 13 36.11 0.20 . 1 . . . . . 66 LYS CB . 52770 1 579 . 1 . 1 66 66 LYS N N 15 126.41 0.20 . 1 . . . . . 66 LYS N . 52770 1 580 . 1 . 1 67 67 HIS H H 1 8.41 0.03 . 1 . . . . . 67 HIS H . 52770 1 581 . 1 . 1 67 67 HIS HA H 1 5.65 0.03 . 1 . . . . . 67 HIS HA . 52770 1 582 . 1 . 1 67 67 HIS CA C 13 54.76 0.20 . 1 . . . . . 67 HIS CA . 52770 1 583 . 1 . 1 67 67 HIS N N 15 118.03 0.20 . 1 . . . . . 67 HIS N . 52770 1 584 . 1 . 1 68 68 LEU H H 1 9.18 0.03 . 1 . . . . . 68 LEU H . 52770 1 585 . 1 . 1 68 68 LEU HA H 1 5.05 0.03 . 1 . . . . . 68 LEU HA . 52770 1 586 . 1 . 1 68 68 LEU HB2 H 1 1.73 0.03 . 2 . . . . . 68 LEU HB2 . 52770 1 587 . 1 . 1 68 68 LEU HB3 H 1 1.73 0.03 . 2 . . . . . 68 LEU HB3 . 52770 1 588 . 1 . 1 68 68 LEU HG H 1 1.68 0.03 . 1 . . . . . 68 LEU HG . 52770 1 589 . 1 . 1 68 68 LEU HD11 H 1 0.90 0.03 . 2 . . . . . 68 LEU MD1 . 52770 1 590 . 1 . 1 68 68 LEU HD12 H 1 0.90 0.03 . 2 . . . . . 68 LEU MD1 . 52770 1 591 . 1 . 1 68 68 LEU HD13 H 1 0.90 0.03 . 2 . . . . . 68 LEU MD1 . 52770 1 592 . 1 . 1 68 68 LEU CA C 13 54.01 0.20 . 1 . . . . . 68 LEU CA . 52770 1 593 . 1 . 1 68 68 LEU CB C 13 45.16 0.20 . 1 . . . . . 68 LEU CB . 52770 1 594 . 1 . 1 68 68 LEU CG C 13 27.49 0.20 . 1 . . . . . 68 LEU CG . 52770 1 595 . 1 . 1 68 68 LEU CD1 C 13 26.21 0.20 . 2 . . . . . 68 LEU CD1 . 52770 1 596 . 1 . 1 68 68 LEU N N 15 122.63 0.20 . 1 . . . . . 68 LEU N . 52770 1 597 . 1 . 1 69 69 LYS H H 1 8.62 0.03 . 1 . . . . . 69 LYS H . 52770 1 598 . 1 . 1 69 69 LYS HA H 1 5.61 0.03 . 1 . . . . . 69 LYS HA . 52770 1 599 . 1 . 1 69 69 LYS HB2 H 1 1.72 0.03 . 2 . . . . . 69 LYS HB2 . 52770 1 600 . 1 . 1 69 69 LYS HB3 H 1 1.72 0.03 . 2 . . . . . 69 LYS HB3 . 52770 1 601 . 1 . 1 69 69 LYS HG2 H 1 1.17 0.03 . 2 . . . . . 69 LYS HG2 . 52770 1 602 . 1 . 1 69 69 LYS HG3 H 1 1.45 0.03 . 2 . . . . . 69 LYS HG3 . 52770 1 603 . 1 . 1 69 69 LYS HE2 H 1 2.69 0.03 . 2 . . . . . 69 LYS HE2 . 52770 1 604 . 1 . 1 69 69 LYS HE3 H 1 2.87 0.03 . 2 . . . . . 69 LYS HE3 . 52770 1 605 . 1 . 1 69 69 LYS CA C 13 55.41 0.20 . 1 . . . . . 69 LYS CA . 52770 1 606 . 1 . 1 69 69 LYS CB C 13 36.61 0.20 . 1 . . . . . 69 LYS CB . 52770 1 607 . 1 . 1 69 69 LYS CG C 13 26.15 0.20 . 1 . . . . . 69 LYS CG . 52770 1 608 . 1 . 1 69 69 LYS CE C 13 41.85 0.20 . 1 . . . . . 69 LYS CE . 52770 1 609 . 1 . 1 69 69 LYS N N 15 118.71 0.20 . 1 . . . . . 69 LYS N . 52770 1 610 . 1 . 1 70 70 HIS H H 1 9.06 0.03 . 1 . . . . . 70 HIS H . 52770 1 611 . 1 . 1 70 70 HIS N N 15 123.54 0.20 . 1 . . . . . 70 HIS N . 52770 1 612 . 1 . 1 71 71 ARG H H 1 9.67 0.03 . 1 . . . . . 71 ARG H . 52770 1 613 . 1 . 1 71 71 ARG HA H 1 5.48 0.03 . 1 . . . . . 71 ARG HA . 52770 1 614 . 1 . 1 71 71 ARG HB2 H 1 1.89 0.03 . 2 . . . . . 71 ARG HB2 . 52770 1 615 . 1 . 1 71 71 ARG HB3 H 1 1.89 0.03 . 2 . . . . . 71 ARG HB3 . 52770 1 616 . 1 . 1 71 71 ARG HD2 H 1 3.14 0.03 . 2 . . . . . 71 ARG HD2 . 52770 1 617 . 1 . 1 71 71 ARG HD3 H 1 3.30 0.03 . 2 . . . . . 71 ARG HD3 . 52770 1 618 . 1 . 1 71 71 ARG CA C 13 53.51 0.20 . 1 . . . . . 71 ARG CA . 52770 1 619 . 1 . 1 71 71 ARG CB C 13 33.74 0.20 . 1 . . . . . 71 ARG CB . 52770 1 620 . 1 . 1 71 71 ARG CD C 13 43.42 0.20 . 1 . . . . . 71 ARG CD . 52770 1 621 . 1 . 1 71 71 ARG N N 15 123.20 0.20 . 1 . . . . . 71 ARG N . 52770 1 622 . 1 . 1 72 72 ILE H H 1 9.39 0.03 . 1 . . . . . 72 ILE H . 52770 1 623 . 1 . 1 72 72 ILE HA H 1 3.85 0.03 . 1 . . . . . 72 ILE HA . 52770 1 624 . 1 . 1 72 72 ILE HB H 1 2.00 0.03 . 1 . . . . . 72 ILE HB . 52770 1 625 . 1 . 1 72 72 ILE HG12 H 1 1.57 0.03 . 2 . . . . . 72 ILE HG12 . 52770 1 626 . 1 . 1 72 72 ILE HG13 H 1 1.51 0.03 . 2 . . . . . 72 ILE HG13 . 52770 1 627 . 1 . 1 72 72 ILE HG21 H 1 0.79 0.03 . 1 . . . . . 72 ILE MG . 52770 1 628 . 1 . 1 72 72 ILE HG22 H 1 0.79 0.03 . 1 . . . . . 72 ILE MG . 52770 1 629 . 1 . 1 72 72 ILE HG23 H 1 0.79 0.03 . 1 . . . . . 72 ILE MG . 52770 1 630 . 1 . 1 72 72 ILE CA C 13 62.74 0.20 . 1 . . . . . 72 ILE CA . 52770 1 631 . 1 . 1 72 72 ILE CB C 13 37.41 0.20 . 1 . . . . . 72 ILE CB . 52770 1 632 . 1 . 1 72 72 ILE CG1 C 13 28.10 0.20 . 1 . . . . . 72 ILE CG1 . 52770 1 633 . 1 . 1 72 72 ILE CG2 C 13 17.73 0.20 . 1 . . . . . 72 ILE CG2 . 52770 1 634 . 1 . 1 72 72 ILE N N 15 127.61 0.20 . 1 . . . . . 72 ILE N . 52770 1 635 . 1 . 1 73 73 ASP H H 1 9.13 0.03 . 1 . . . . . 73 ASP H . 52770 1 636 . 1 . 1 73 73 ASP HA H 1 4.99 0.03 . 1 . . . . . 73 ASP HA . 52770 1 637 . 1 . 1 73 73 ASP HB2 H 1 2.16 0.03 . 2 . . . . . 73 ASP HB2 . 52770 1 638 . 1 . 1 73 73 ASP HB3 H 1 2.59 0.03 . 2 . . . . . 73 ASP HB3 . 52770 1 639 . 1 . 1 73 73 ASP CA C 13 55.82 0.20 . 1 . . . . . 73 ASP CA . 52770 1 640 . 1 . 1 73 73 ASP CB C 13 42.72 0.20 . 1 . . . . . 73 ASP CB . 52770 1 641 . 1 . 1 73 73 ASP N N 15 130.08 0.20 . 1 . . . . . 73 ASP N . 52770 1 642 . 1 . 1 74 74 ALA H H 1 8.08 0.03 . 1 . . . . . 74 ALA H . 52770 1 643 . 1 . 1 74 74 ALA HA H 1 4.49 0.03 . 1 . . . . . 74 ALA HA . 52770 1 644 . 1 . 1 74 74 ALA HB1 H 1 1.40 0.03 . 1 . . . . . 74 ALA MB . 52770 1 645 . 1 . 1 74 74 ALA HB2 H 1 1.40 0.03 . 1 . . . . . 74 ALA MB . 52770 1 646 . 1 . 1 74 74 ALA HB3 H 1 1.40 0.03 . 1 . . . . . 74 ALA MB . 52770 1 647 . 1 . 1 74 74 ALA CA C 13 53.07 0.20 . 1 . . . . . 74 ALA CA . 52770 1 648 . 1 . 1 74 74 ALA CB C 13 21.87 0.20 . 1 . . . . . 74 ALA CB . 52770 1 649 . 1 . 1 74 74 ALA N N 15 120.39 0.20 . 1 . . . . . 74 ALA N . 52770 1 650 . 1 . 1 75 75 VAL H H 1 8.81 0.03 . 1 . . . . . 75 VAL H . 52770 1 651 . 1 . 1 75 75 VAL HA H 1 4.72 0.03 . 1 . . . . . 75 VAL HA . 52770 1 652 . 1 . 1 75 75 VAL HB H 1 2.43 0.03 . 1 . . . . . 75 VAL HB . 52770 1 653 . 1 . 1 75 75 VAL HG11 H 1 1.25 0.03 . 2 . . . . . 75 VAL MG1 . 52770 1 654 . 1 . 1 75 75 VAL HG12 H 1 1.25 0.03 . 2 . . . . . 75 VAL MG1 . 52770 1 655 . 1 . 1 75 75 VAL HG13 H 1 1.25 0.03 . 2 . . . . . 75 VAL MG1 . 52770 1 656 . 1 . 1 75 75 VAL HG21 H 1 1.19 0.03 . 2 . . . . . 75 VAL MG2 . 52770 1 657 . 1 . 1 75 75 VAL HG22 H 1 1.19 0.03 . 2 . . . . . 75 VAL MG2 . 52770 1 658 . 1 . 1 75 75 VAL HG23 H 1 1.19 0.03 . 2 . . . . . 75 VAL MG2 . 52770 1 659 . 1 . 1 75 75 VAL CA C 13 62.35 0.20 . 1 . . . . . 75 VAL CA . 52770 1 660 . 1 . 1 75 75 VAL CB C 13 33.67 0.20 . 1 . . . . . 75 VAL CB . 52770 1 661 . 1 . 1 75 75 VAL CG1 C 13 20.83 0.20 . 2 . . . . . 75 VAL CG1 . 52770 1 662 . 1 . 1 75 75 VAL CG2 C 13 20.84 0.20 . 2 . . . . . 75 VAL CG2 . 52770 1 663 . 1 . 1 75 75 VAL N N 15 120.40 0.20 . 1 . . . . . 75 VAL N . 52770 1 664 . 1 . 1 76 76 GLU H H 1 8.72 0.03 . 1 . . . . . 76 GLU H . 52770 1 665 . 1 . 1 76 76 GLU HA H 1 4.96 0.03 . 1 . . . . . 76 GLU HA . 52770 1 666 . 1 . 1 76 76 GLU CA C 13 54.26 0.20 . 1 . . . . . 76 GLU CA . 52770 1 667 . 1 . 1 76 76 GLU N N 15 127.71 0.20 . 1 . . . . . 76 GLU N . 52770 1 668 . 1 . 1 77 77 GLU H H 1 9.47 0.03 . 1 . . . . . 77 GLU H . 52770 1 669 . 1 . 1 77 77 GLU HA H 1 3.82 0.03 . 1 . . . . . 77 GLU HA . 52770 1 670 . 1 . 1 77 77 GLU CA C 13 60.52 0.20 . 1 . . . . . 77 GLU CA . 52770 1 671 . 1 . 1 77 77 GLU N N 15 126.57 0.20 . 1 . . . . . 77 GLU N . 52770 1 672 . 1 . 1 78 78 GLU H H 1 9.22 0.03 . 1 . . . . . 78 GLU H . 52770 1 673 . 1 . 1 78 78 GLU HA H 1 4.12 0.03 . 1 . . . . . 78 GLU HA . 52770 1 674 . 1 . 1 78 78 GLU HB3 H 1 2.14 0.03 . 2 . . . . . 78 GLU HB3 . 52770 1 675 . 1 . 1 78 78 GLU CA C 13 58.81 0.20 . 1 . . . . . 78 GLU CA . 52770 1 676 . 1 . 1 78 78 GLU CB C 13 29.39 0.20 . 1 . . . . . 78 GLU CB . 52770 1 677 . 1 . 1 78 78 GLU N N 15 117.99 0.20 . 1 . . . . . 78 GLU N . 52770 1 678 . 1 . 1 79 79 LYS H H 1 7.00 0.03 . 1 . . . . . 79 LYS H . 52770 1 679 . 1 . 1 79 79 LYS HA H 1 4.39 0.03 . 1 . . . . . 79 LYS HA . 52770 1 680 . 1 . 1 79 79 LYS HB2 H 1 1.53 0.03 . 2 . . . . . 79 LYS HB2 . 52770 1 681 . 1 . 1 79 79 LYS HG2 H 1 1.35 0.03 . 2 . . . . . 79 LYS HG2 . 52770 1 682 . 1 . 1 79 79 LYS HG3 H 1 1.43 0.03 . 2 . . . . . 79 LYS HG3 . 52770 1 683 . 1 . 1 79 79 LYS HD2 H 1 1.59 0.03 . 2 . . . . . 79 LYS HD2 . 52770 1 684 . 1 . 1 79 79 LYS HD3 H 1 1.68 0.03 . 2 . . . . . 79 LYS HD3 . 52770 1 685 . 1 . 1 79 79 LYS CA C 13 54.98 0.20 . 1 . . . . . 79 LYS CA . 52770 1 686 . 1 . 1 79 79 LYS CG C 13 25.32 0.20 . 1 . . . . . 79 LYS CG . 52770 1 687 . 1 . 1 79 79 LYS CD C 13 28.90 0.20 . 1 . . . . . 79 LYS CD . 52770 1 688 . 1 . 1 79 79 LYS N N 15 114.91 0.20 . 1 . . . . . 79 LYS N . 52770 1 689 . 1 . 1 80 80 LEU H H 1 7.59 0.03 . 1 . . . . . 80 LEU H . 52770 1 690 . 1 . 1 80 80 LEU HA H 1 2.37 0.03 . 1 . . . . . 80 LEU HA . 52770 1 691 . 1 . 1 80 80 LEU HB2 H 1 0.98 0.03 . 2 . . . . . 80 LEU HB2 . 52770 1 692 . 1 . 1 80 80 LEU HB3 H 1 2.61 0.03 . 2 . . . . . 80 LEU HB3 . 52770 1 693 . 1 . 1 80 80 LEU HG H 1 0.72 0.03 . 1 . . . . . 80 LEU HG . 52770 1 694 . 1 . 1 80 80 LEU HD11 H 1 0.51 0.03 . 2 . . . . . 80 LEU MD1 . 52770 1 695 . 1 . 1 80 80 LEU HD12 H 1 0.51 0.03 . 2 . . . . . 80 LEU MD1 . 52770 1 696 . 1 . 1 80 80 LEU HD13 H 1 0.51 0.03 . 2 . . . . . 80 LEU MD1 . 52770 1 697 . 1 . 1 80 80 LEU HD21 H 1 0.52 0.03 . 2 . . . . . 80 LEU MD2 . 52770 1 698 . 1 . 1 80 80 LEU HD22 H 1 0.52 0.03 . 2 . . . . . 80 LEU MD2 . 52770 1 699 . 1 . 1 80 80 LEU HD23 H 1 0.52 0.03 . 2 . . . . . 80 LEU MD2 . 52770 1 700 . 1 . 1 80 80 LEU CA C 13 54.96 0.20 . 1 . . . . . 80 LEU CA . 52770 1 701 . 1 . 1 80 80 LEU CB C 13 39.43 0.20 . 1 . . . . . 80 LEU CB . 52770 1 702 . 1 . 1 80 80 LEU CG C 13 26.75 0.20 . 1 . . . . . 80 LEU CG . 52770 1 703 . 1 . 1 80 80 LEU CD1 C 13 23.39 0.20 . 2 . . . . . 80 LEU CD1 . 52770 1 704 . 1 . 1 80 80 LEU CD2 C 13 23.40 0.20 . 2 . . . . . 80 LEU CD2 . 52770 1 705 . 1 . 1 80 80 LEU N N 15 118.88 0.20 . 1 . . . . . 80 LEU N . 52770 1 706 . 1 . 1 81 81 THR H H 1 7.48 0.03 . 1 . . . . . 81 THR H . 52770 1 707 . 1 . 1 81 81 THR HA H 1 5.67 0.03 . 1 . . . . . 81 THR HA . 52770 1 708 . 1 . 1 81 81 THR HB H 1 4.02 0.03 . 1 . . . . . 81 THR HB . 52770 1 709 . 1 . 1 81 81 THR HG21 H 1 1.19 0.03 . 1 . . . . . 81 THR MG . 52770 1 710 . 1 . 1 81 81 THR HG22 H 1 1.19 0.03 . 1 . . . . . 81 THR MG . 52770 1 711 . 1 . 1 81 81 THR HG23 H 1 1.19 0.03 . 1 . . . . . 81 THR MG . 52770 1 712 . 1 . 1 81 81 THR CA C 13 60.84 0.20 . 1 . . . . . 81 THR CA . 52770 1 713 . 1 . 1 81 81 THR CB C 13 72.07 0.20 . 1 . . . . . 81 THR CB . 52770 1 714 . 1 . 1 81 81 THR CG2 C 13 20.82 0.20 . 1 . . . . . 81 THR CG2 . 52770 1 715 . 1 . 1 81 81 THR N N 15 108.77 0.20 . 1 . . . . . 81 THR N . 52770 1 716 . 1 . 1 82 82 TYR H H 1 9.34 0.03 . 1 . . . . . 82 TYR H . 52770 1 717 . 1 . 1 82 82 TYR HA H 1 5.32 0.03 . 1 . . . . . 82 TYR HA . 52770 1 718 . 1 . 1 82 82 TYR CA C 13 56.63 0.20 . 1 . . . . . 82 TYR CA . 52770 1 719 . 1 . 1 82 82 TYR N N 15 127.43 0.20 . 1 . . . . . 82 TYR N . 52770 1 720 . 1 . 1 83 83 SER H H 1 8.95 0.03 . 1 . . . . . 83 SER H . 52770 1 721 . 1 . 1 83 83 SER HA H 1 5.71 0.03 . 1 . . . . . 83 SER HA . 52770 1 722 . 1 . 1 83 83 SER HB2 H 1 3.82 0.03 . 2 . . . . . 83 SER HB2 . 52770 1 723 . 1 . 1 83 83 SER HB3 H 1 4.10 0.03 . 2 . . . . . 83 SER HB3 . 52770 1 724 . 1 . 1 83 83 SER CA C 13 56.55 0.20 . 1 . . . . . 83 SER CA . 52770 1 725 . 1 . 1 83 83 SER CB C 13 65.45 0.20 . 1 . . . . . 83 SER CB . 52770 1 726 . 1 . 1 83 83 SER N N 15 122.11 0.20 . 1 . . . . . 83 SER N . 52770 1 727 . 1 . 1 84 84 TYR H H 1 8.75 0.03 . 1 . . . . . 84 TYR H . 52770 1 728 . 1 . 1 84 84 TYR HA H 1 5.25 0.03 . 1 . . . . . 84 TYR HA . 52770 1 729 . 1 . 1 84 84 TYR CA C 13 56.72 0.20 . 1 . . . . . 84 TYR CA . 52770 1 730 . 1 . 1 84 84 TYR N N 15 122.72 0.20 . 1 . . . . . 84 TYR N . 52770 1 731 . 1 . 1 85 85 THR H H 1 9.46 0.03 . 1 . . . . . 85 THR H . 52770 1 732 . 1 . 1 85 85 THR HA H 1 5.06 0.03 . 1 . . . . . 85 THR HA . 52770 1 733 . 1 . 1 85 85 THR HB H 1 3.84 0.03 . 1 . . . . . 85 THR HB . 52770 1 734 . 1 . 1 85 85 THR HG21 H 1 1.04 0.03 . 1 . . . . . 85 THR MG . 52770 1 735 . 1 . 1 85 85 THR HG22 H 1 1.04 0.03 . 1 . . . . . 85 THR MG . 52770 1 736 . 1 . 1 85 85 THR HG23 H 1 1.04 0.03 . 1 . . . . . 85 THR MG . 52770 1 737 . 1 . 1 85 85 THR CA C 13 61.92 0.20 . 1 . . . . . 85 THR CA . 52770 1 738 . 1 . 1 85 85 THR CB C 13 72.50 0.20 . 1 . . . . . 85 THR CB . 52770 1 739 . 1 . 1 85 85 THR CG2 C 13 21.64 0.20 . 1 . . . . . 85 THR CG2 . 52770 1 740 . 1 . 1 85 85 THR N N 15 116.93 0.20 . 1 . . . . . 85 THR N . 52770 1 741 . 1 . 1 86 86 LEU H H 1 9.38 0.03 . 1 . . . . . 86 LEU H . 52770 1 742 . 1 . 1 86 86 LEU HA H 1 4.25 0.03 . 1 . . . . . 86 LEU HA . 52770 1 743 . 1 . 1 86 86 LEU CA C 13 55.82 0.20 . 1 . . . . . 86 LEU CA . 52770 1 744 . 1 . 1 86 86 LEU N N 15 129.87 0.20 . 1 . . . . . 86 LEU N . 52770 1 745 . 1 . 1 87 87 ILE H H 1 8.29 0.03 . 1 . . . . . 87 ILE H . 52770 1 746 . 1 . 1 87 87 ILE HA H 1 4.73 0.03 . 1 . . . . . 87 ILE HA . 52770 1 747 . 1 . 1 87 87 ILE HB H 1 2.11 0.03 . 1 . . . . . 87 ILE HB . 52770 1 748 . 1 . 1 87 87 ILE HG12 H 1 1.03 0.03 . 2 . . . . . 87 ILE HG12 . 52770 1 749 . 1 . 1 87 87 ILE HG13 H 1 1.37 0.03 . 2 . . . . . 87 ILE HG13 . 52770 1 750 . 1 . 1 87 87 ILE HG21 H 1 0.97 0.03 . 1 . . . . . 87 ILE MG . 52770 1 751 . 1 . 1 87 87 ILE HG22 H 1 0.97 0.03 . 1 . . . . . 87 ILE MG . 52770 1 752 . 1 . 1 87 87 ILE HG23 H 1 0.97 0.03 . 1 . . . . . 87 ILE MG . 52770 1 753 . 1 . 1 87 87 ILE HD11 H 1 0.92 0.03 . 1 . . . . . 87 ILE MD . 52770 1 754 . 1 . 1 87 87 ILE HD12 H 1 0.92 0.03 . 1 . . . . . 87 ILE MD . 52770 1 755 . 1 . 1 87 87 ILE HD13 H 1 0.92 0.03 . 1 . . . . . 87 ILE MD . 52770 1 756 . 1 . 1 87 87 ILE CA C 13 61.20 0.20 . 1 . . . . . 87 ILE CA . 52770 1 757 . 1 . 1 87 87 ILE CB C 13 39.79 0.20 . 1 . . . . . 87 ILE CB . 52770 1 758 . 1 . 1 87 87 ILE CG1 C 13 26.62 0.20 . 1 . . . . . 87 ILE CG1 . 52770 1 759 . 1 . 1 87 87 ILE CG2 C 13 18.56 0.20 . 1 . . . . . 87 ILE CG2 . 52770 1 760 . 1 . 1 87 87 ILE CD1 C 13 13.89 0.20 . 1 . . . . . 87 ILE CD1 . 52770 1 761 . 1 . 1 87 87 ILE N N 15 118.84 0.20 . 1 . . . . . 87 ILE N . 52770 1 762 . 1 . 1 88 88 GLU H H 1 7.67 0.03 . 1 . . . . . 88 GLU H . 52770 1 763 . 1 . 1 88 88 GLU HA H 1 4.50 0.03 . 1 . . . . . 88 GLU HA . 52770 1 764 . 1 . 1 88 88 GLU HB2 H 1 1.95 0.03 . 2 . . . . . 88 GLU HB2 . 52770 1 765 . 1 . 1 88 88 GLU HB3 H 1 2.16 0.03 . 2 . . . . . 88 GLU HB3 . 52770 1 766 . 1 . 1 88 88 GLU HG2 H 1 2.29 0.03 . 2 . . . . . 88 GLU HG2 . 52770 1 767 . 1 . 1 88 88 GLU HG3 H 1 2.39 0.03 . 2 . . . . . 88 GLU HG3 . 52770 1 768 . 1 . 1 88 88 GLU CA C 13 57.18 0.20 . 1 . . . . . 88 GLU CA . 52770 1 769 . 1 . 1 88 88 GLU CB C 13 34.71 0.20 . 1 . . . . . 88 GLU CB . 52770 1 770 . 1 . 1 88 88 GLU CG C 13 37.27 0.20 . 1 . . . . . 88 GLU CG . 52770 1 771 . 1 . 1 88 88 GLU N N 15 120.01 0.20 . 1 . . . . . 88 GLU N . 52770 1 772 . 1 . 1 89 89 GLY H H 1 8.85 0.03 . 1 . . . . . 89 GLY H . 52770 1 773 . 1 . 1 89 89 GLY HA3 H 1 4.90 0.03 . 2 . . . . . 89 GLY HA3 . 52770 1 774 . 1 . 1 89 89 GLY CA C 13 45.98 0.20 . 1 . . . . . 89 GLY CA . 52770 1 775 . 1 . 1 89 89 GLY N N 15 111.19 0.20 . 1 . . . . . 89 GLY N . 52770 1 776 . 1 . 1 92 92 LEU H H 1 8.08 0.03 . 1 . . . . . 92 LEU H . 52770 1 777 . 1 . 1 92 92 LEU N N 15 116.66 0.20 . 1 . . . . . 92 LEU N . 52770 1 778 . 1 . 1 93 93 LEU H H 1 8.29 0.03 . 1 . . . . . 93 LEU H . 52770 1 779 . 1 . 1 93 93 LEU N N 15 117.57 0.20 . 1 . . . . . 93 LEU N . 52770 1 780 . 1 . 1 94 94 ASP HA H 1 3.64 0.03 . 1 . . . . . 94 ASP HA . 52770 1 781 . 1 . 1 94 94 ASP HB2 H 1 2.80 0.03 . 2 . . . . . 94 ASP HB2 . 52770 1 782 . 1 . 1 94 94 ASP HB3 H 1 2.80 0.03 . 2 . . . . . 94 ASP HB3 . 52770 1 783 . 1 . 1 94 94 ASP CA C 13 57.70 0.20 . 1 . . . . . 94 ASP CA . 52770 1 784 . 1 . 1 94 94 ASP CB C 13 40.67 0.20 . 1 . . . . . 94 ASP CB . 52770 1 785 . 1 . 1 95 95 LYS H H 1 7.95 0.03 . 1 . . . . . 95 LYS H . 52770 1 786 . 1 . 1 95 95 LYS HA H 1 4.29 0.03 . 1 . . . . . 95 LYS HA . 52770 1 787 . 1 . 1 95 95 LYS HG3 H 1 1.12 0.03 . 2 . . . . . 95 LYS HG3 . 52770 1 788 . 1 . 1 95 95 LYS CA C 13 57.21 0.20 . 1 . . . . . 95 LYS CA . 52770 1 789 . 1 . 1 95 95 LYS CG C 13 24.83 0.20 . 1 . . . . . 95 LYS CG . 52770 1 790 . 1 . 1 95 95 LYS N N 15 116.84 0.20 . 1 . . . . . 95 LYS N . 52770 1 791 . 1 . 1 96 96 PHE H H 1 7.99 0.03 . 1 . . . . . 96 PHE H . 52770 1 792 . 1 . 1 96 96 PHE HA H 1 5.20 0.03 . 1 . . . . . 96 PHE HA . 52770 1 793 . 1 . 1 96 96 PHE HB3 H 1 3.22 0.03 . 2 . . . . . 96 PHE HB3 . 52770 1 794 . 1 . 1 96 96 PHE CA C 13 56.62 0.20 . 1 . . . . . 96 PHE CA . 52770 1 795 . 1 . 1 96 96 PHE CB C 13 40.95 0.20 . 1 . . . . . 96 PHE CB . 52770 1 796 . 1 . 1 96 96 PHE N N 15 115.72 0.20 . 1 . . . . . 96 PHE N . 52770 1 797 . 1 . 1 97 97 GLU H H 1 9.40 0.03 . 1 . . . . . 97 GLU H . 52770 1 798 . 1 . 1 97 97 GLU HA H 1 4.27 0.03 . 1 . . . . . 97 GLU HA . 52770 1 799 . 1 . 1 97 97 GLU HG2 H 1 2.16 0.03 . 2 . . . . . 97 GLU HG2 . 52770 1 800 . 1 . 1 97 97 GLU HG3 H 1 2.15 0.03 . 2 . . . . . 97 GLU HG3 . 52770 1 801 . 1 . 1 97 97 GLU CA C 13 58.00 0.20 . 1 . . . . . 97 GLU CA . 52770 1 802 . 1 . 1 97 97 GLU CG C 13 36.33 0.20 . 1 . . . . . 97 GLU CG . 52770 1 803 . 1 . 1 97 97 GLU N N 15 122.73 0.20 . 1 . . . . . 97 GLU N . 52770 1 804 . 1 . 1 98 98 SER H H 1 7.62 0.03 . 1 . . . . . 98 SER H . 52770 1 805 . 1 . 1 98 98 SER HA H 1 4.66 0.03 . 1 . . . . . 98 SER HA . 52770 1 806 . 1 . 1 98 98 SER HB2 H 1 3.62 0.03 . 2 . . . . . 98 SER HB2 . 52770 1 807 . 1 . 1 98 98 SER HB3 H 1 4.01 0.03 . 2 . . . . . 98 SER HB3 . 52770 1 808 . 1 . 1 98 98 SER CA C 13 57.93 0.20 . 1 . . . . . 98 SER CA . 52770 1 809 . 1 . 1 98 98 SER CB C 13 64.27 0.20 . 1 . . . . . 98 SER CB . 52770 1 810 . 1 . 1 98 98 SER N N 15 105.83 0.20 . 1 . . . . . 98 SER N . 52770 1 811 . 1 . 1 99 99 ILE H H 1 7.33 0.03 . 1 . . . . . 99 ILE H . 52770 1 812 . 1 . 1 99 99 ILE HA H 1 4.52 0.03 . 1 . . . . . 99 ILE HA . 52770 1 813 . 1 . 1 99 99 ILE HB H 1 1.35 0.03 . 1 . . . . . 99 ILE HB . 52770 1 814 . 1 . 1 99 99 ILE HG13 H 1 0.42 0.03 . 2 . . . . . 99 ILE HG13 . 52770 1 815 . 1 . 1 99 99 ILE HG21 H 1 -0.29 0.03 . 1 . . . . . 99 ILE MG . 52770 1 816 . 1 . 1 99 99 ILE HG22 H 1 -0.29 0.03 . 1 . . . . . 99 ILE MG . 52770 1 817 . 1 . 1 99 99 ILE HG23 H 1 -0.29 0.03 . 1 . . . . . 99 ILE MG . 52770 1 818 . 1 . 1 99 99 ILE HD11 H 1 0.74 0.03 . 1 . . . . . 99 ILE MD . 52770 1 819 . 1 . 1 99 99 ILE HD12 H 1 0.74 0.03 . 1 . . . . . 99 ILE MD . 52770 1 820 . 1 . 1 99 99 ILE HD13 H 1 0.74 0.03 . 1 . . . . . 99 ILE MD . 52770 1 821 . 1 . 1 99 99 ILE CA C 13 61.09 0.20 . 1 . . . . . 99 ILE CA . 52770 1 822 . 1 . 1 99 99 ILE CB C 13 42.29 0.20 . 1 . . . . . 99 ILE CB . 52770 1 823 . 1 . 1 99 99 ILE CG1 C 13 27.24 0.20 . 1 . . . . . 99 ILE CG1 . 52770 1 824 . 1 . 1 99 99 ILE CG2 C 13 15.94 0.20 . 1 . . . . . 99 ILE CG2 . 52770 1 825 . 1 . 1 99 99 ILE CD1 C 13 14.81 0.20 . 1 . . . . . 99 ILE CD1 . 52770 1 826 . 1 . 1 99 99 ILE N N 15 119.94 0.20 . 1 . . . . . 99 ILE N . 52770 1 827 . 1 . 1 100 100 SER H H 1 8.72 0.03 . 1 . . . . . 100 SER H . 52770 1 828 . 1 . 1 100 100 SER HA H 1 5.09 0.03 . 1 . . . . . 100 SER HA . 52770 1 829 . 1 . 1 100 100 SER HB2 H 1 3.53 0.03 . 2 . . . . . 100 SER HB2 . 52770 1 830 . 1 . 1 100 100 SER HB3 H 1 3.87 0.03 . 2 . . . . . 100 SER HB3 . 52770 1 831 . 1 . 1 100 100 SER CA C 13 57.33 0.20 . 1 . . . . . 100 SER CA . 52770 1 832 . 1 . 1 100 100 SER CB C 13 65.92 0.20 . 1 . . . . . 100 SER CB . 52770 1 833 . 1 . 1 100 100 SER N N 15 122.07 0.20 . 1 . . . . . 100 SER N . 52770 1 834 . 1 . 1 101 101 TYR H H 1 9.12 0.03 . 1 . . . . . 101 TYR H . 52770 1 835 . 1 . 1 101 101 TYR HA H 1 5.20 0.03 . 1 . . . . . 101 TYR HA . 52770 1 836 . 1 . 1 101 101 TYR HB2 H 1 2.57 0.03 . 2 . . . . . 101 TYR HB2 . 52770 1 837 . 1 . 1 101 101 TYR HB3 H 1 2.57 0.03 . 2 . . . . . 101 TYR HB3 . 52770 1 838 . 1 . 1 101 101 TYR CA C 13 56.62 0.20 . 1 . . . . . 101 TYR CA . 52770 1 839 . 1 . 1 101 101 TYR CB C 13 41.33 0.20 . 1 . . . . . 101 TYR CB . 52770 1 840 . 1 . 1 101 101 TYR N N 15 120.79 0.20 . 1 . . . . . 101 TYR N . 52770 1 841 . 1 . 1 102 102 GLU H H 1 9.03 0.03 . 1 . . . . . 102 GLU H . 52770 1 842 . 1 . 1 102 102 GLU HG3 H 1 2.00 0.03 . 2 . . . . . 102 GLU HG3 . 52770 1 843 . 1 . 1 102 102 GLU CG C 13 36.55 0.20 . 1 . . . . . 102 GLU CG . 52770 1 844 . 1 . 1 102 102 GLU N N 15 122.98 0.20 . 1 . . . . . 102 GLU N . 52770 1 845 . 1 . 1 103 103 ILE H H 1 9.65 0.03 . 1 . . . . . 103 ILE H . 52770 1 846 . 1 . 1 103 103 ILE HA H 1 5.08 0.03 . 1 . . . . . 103 ILE HA . 52770 1 847 . 1 . 1 103 103 ILE HB H 1 2.18 0.03 . 1 . . . . . 103 ILE HB . 52770 1 848 . 1 . 1 103 103 ILE HG12 H 1 1.67 0.03 . 2 . . . . . 103 ILE HG12 . 52770 1 849 . 1 . 1 103 103 ILE HG13 H 1 1.28 0.03 . 2 . . . . . 103 ILE HG13 . 52770 1 850 . 1 . 1 103 103 ILE HG21 H 1 0.83 0.03 . 1 . . . . . 103 ILE MG . 52770 1 851 . 1 . 1 103 103 ILE HG22 H 1 0.83 0.03 . 1 . . . . . 103 ILE MG . 52770 1 852 . 1 . 1 103 103 ILE HG23 H 1 0.83 0.03 . 1 . . . . . 103 ILE MG . 52770 1 853 . 1 . 1 103 103 ILE HD11 H 1 1.04 0.03 . 1 . . . . . 103 ILE MD . 52770 1 854 . 1 . 1 103 103 ILE HD12 H 1 1.04 0.03 . 1 . . . . . 103 ILE MD . 52770 1 855 . 1 . 1 103 103 ILE HD13 H 1 1.04 0.03 . 1 . . . . . 103 ILE MD . 52770 1 856 . 1 . 1 103 103 ILE CA C 13 59.88 0.20 . 1 . . . . . 103 ILE CA . 52770 1 857 . 1 . 1 103 103 ILE CB C 13 40.36 0.20 . 1 . . . . . 103 ILE CB . 52770 1 858 . 1 . 1 103 103 ILE CG1 C 13 28.31 0.20 . 1 . . . . . 103 ILE CG1 . 52770 1 859 . 1 . 1 103 103 ILE CG2 C 13 18.90 0.20 . 1 . . . . . 103 ILE CG2 . 52770 1 860 . 1 . 1 103 103 ILE CD1 C 13 14.43 0.20 . 1 . . . . . 103 ILE CD1 . 52770 1 861 . 1 . 1 103 103 ILE N N 15 128.71 0.20 . 1 . . . . . 103 ILE N . 52770 1 862 . 1 . 1 104 104 LYS H H 1 8.57 0.03 . 1 . . . . . 104 LYS H . 52770 1 863 . 1 . 1 104 104 LYS HA H 1 5.39 0.03 . 1 . . . . . 104 LYS HA . 52770 1 864 . 1 . 1 104 104 LYS HB2 H 1 1.79 0.03 . 2 . . . . . 104 LYS HB2 . 52770 1 865 . 1 . 1 104 104 LYS HB3 H 1 1.72 0.03 . 2 . . . . . 104 LYS HB3 . 52770 1 866 . 1 . 1 104 104 LYS HG2 H 1 1.34 0.03 . 2 . . . . . 104 LYS HG2 . 52770 1 867 . 1 . 1 104 104 LYS HG3 H 1 1.42 0.03 . 2 . . . . . 104 LYS HG3 . 52770 1 868 . 1 . 1 104 104 LYS HD2 H 1 1.51 0.03 . 2 . . . . . 104 LYS HD2 . 52770 1 869 . 1 . 1 104 104 LYS HE2 H 1 2.87 0.03 . 2 . . . . . 104 LYS HE2 . 52770 1 870 . 1 . 1 104 104 LYS HE3 H 1 2.87 0.03 . 2 . . . . . 104 LYS HE3 . 52770 1 871 . 1 . 1 104 104 LYS CA C 13 54.72 0.20 . 1 . . . . . 104 LYS CA . 52770 1 872 . 1 . 1 104 104 LYS CB C 13 36.61 0.20 . 1 . . . . . 104 LYS CB . 52770 1 873 . 1 . 1 104 104 LYS CG C 13 24.76 0.20 . 1 . . . . . 104 LYS CG . 52770 1 874 . 1 . 1 104 104 LYS CE C 13 41.85 0.20 . 1 . . . . . 104 LYS CE . 52770 1 875 . 1 . 1 104 104 LYS N N 15 125.98 0.20 . 1 . . . . . 104 LYS N . 52770 1 876 . 1 . 1 105 105 PHE H H 1 8.31 0.03 . 1 . . . . . 105 PHE H . 52770 1 877 . 1 . 1 105 105 PHE HA H 1 5.55 0.03 . 1 . . . . . 105 PHE HA . 52770 1 878 . 1 . 1 105 105 PHE HB3 H 1 3.19 0.03 . 2 . . . . . 105 PHE HB3 . 52770 1 879 . 1 . 1 105 105 PHE CA C 13 55.31 0.20 . 1 . . . . . 105 PHE CA . 52770 1 880 . 1 . 1 105 105 PHE CB C 13 42.23 0.20 . 1 . . . . . 105 PHE CB . 52770 1 881 . 1 . 1 105 105 PHE N N 15 120.99 0.20 . 1 . . . . . 105 PHE N . 52770 1 882 . 1 . 1 106 106 GLU H H 1 8.91 0.03 . 1 . . . . . 106 GLU H . 52770 1 883 . 1 . 1 106 106 GLU HA H 1 4.72 0.03 . 1 . . . . . 106 GLU HA . 52770 1 884 . 1 . 1 106 106 GLU HB2 H 1 1.93 0.03 . 2 . . . . . 106 GLU HB2 . 52770 1 885 . 1 . 1 106 106 GLU HB3 H 1 2.09 0.03 . 2 . . . . . 106 GLU HB3 . 52770 1 886 . 1 . 1 106 106 GLU HG3 H 1 2.11 0.03 . 2 . . . . . 106 GLU HG3 . 52770 1 887 . 1 . 1 106 106 GLU CA C 13 54.13 0.20 . 1 . . . . . 106 GLU CA . 52770 1 888 . 1 . 1 106 106 GLU CB C 13 34.43 0.20 . 1 . . . . . 106 GLU CB . 52770 1 889 . 1 . 1 106 106 GLU CG C 13 36.88 0.20 . 1 . . . . . 106 GLU CG . 52770 1 890 . 1 . 1 106 106 GLU N N 15 119.34 0.20 . 1 . . . . . 106 GLU N . 52770 1 891 . 1 . 1 107 107 SER H H 1 9.11 0.03 . 1 . . . . . 107 SER H . 52770 1 892 . 1 . 1 107 107 SER HA H 1 4.82 0.03 . 1 . . . . . 107 SER HA . 52770 1 893 . 1 . 1 107 107 SER HB2 H 1 3.85 0.03 . 2 . . . . . 107 SER HB2 . 52770 1 894 . 1 . 1 107 107 SER HB3 H 1 3.99 0.03 . 2 . . . . . 107 SER HB3 . 52770 1 895 . 1 . 1 107 107 SER CA C 13 59.79 0.20 . 1 . . . . . 107 SER CA . 52770 1 896 . 1 . 1 107 107 SER CB C 13 63.52 0.20 . 1 . . . . . 107 SER CB . 52770 1 897 . 1 . 1 107 107 SER N N 15 119.66 0.20 . 1 . . . . . 107 SER N . 52770 1 898 . 1 . 1 108 108 SER H H 1 8.18 0.03 . 1 . . . . . 108 SER H . 52770 1 899 . 1 . 1 108 108 SER HA H 1 4.94 0.03 . 1 . . . . . 108 SER HA . 52770 1 900 . 1 . 1 108 108 SER HB2 H 1 3.60 0.03 . 2 . . . . . 108 SER HB2 . 52770 1 901 . 1 . 1 108 108 SER HB3 H 1 3.94 0.03 . 2 . . . . . 108 SER HB3 . 52770 1 902 . 1 . 1 108 108 SER CA C 13 55.46 0.20 . 1 . . . . . 108 SER CA . 52770 1 903 . 1 . 1 108 108 SER CB C 13 63.83 0.20 . 1 . . . . . 108 SER CB . 52770 1 904 . 1 . 1 108 108 SER N N 15 121.06 0.20 . 1 . . . . . 108 SER N . 52770 1 905 . 1 . 1 109 109 PRO HA H 1 4.39 0.03 . 1 . . . . . 109 PRO HA . 52770 1 906 . 1 . 1 109 109 PRO HB2 H 1 2.42 0.03 . 2 . . . . . 109 PRO HB2 . 52770 1 907 . 1 . 1 109 109 PRO HB3 H 1 1.98 0.03 . 2 . . . . . 109 PRO HB3 . 52770 1 908 . 1 . 1 109 109 PRO HD2 H 1 3.85 0.03 . 2 . . . . . 109 PRO HD2 . 52770 1 909 . 1 . 1 109 109 PRO HD3 H 1 3.86 0.03 . 2 . . . . . 109 PRO HD3 . 52770 1 910 . 1 . 1 109 109 PRO CA C 13 65.34 0.20 . 1 . . . . . 109 PRO CA . 52770 1 911 . 1 . 1 109 109 PRO CB C 13 31.83 0.20 . 1 . . . . . 109 PRO CB . 52770 1 912 . 1 . 1 109 109 PRO CD C 13 51.21 0.20 . 1 . . . . . 109 PRO CD . 52770 1 913 . 1 . 1 110 110 ASP H H 1 7.74 0.03 . 1 . . . . . 110 ASP H . 52770 1 914 . 1 . 1 110 110 ASP N N 15 114.08 0.20 . 1 . . . . . 110 ASP N . 52770 1 915 . 1 . 1 111 111 GLY H H 1 8.00 0.03 . 1 . . . . . 111 GLY H . 52770 1 916 . 1 . 1 111 111 GLY HA2 H 1 3.76 0.03 . 2 . . . . . 111 GLY HA2 . 52770 1 917 . 1 . 1 111 111 GLY HA3 H 1 4.42 0.03 . 2 . . . . . 111 GLY HA3 . 52770 1 918 . 1 . 1 111 111 GLY CA C 13 45.16 0.20 . 1 . . . . . 111 GLY CA . 52770 1 919 . 1 . 1 111 111 GLY N N 15 108.15 0.20 . 1 . . . . . 111 GLY N . 52770 1 920 . 1 . 1 112 112 GLY H H 1 7.74 0.03 . 1 . . . . . 112 GLY H . 52770 1 921 . 1 . 1 112 112 GLY HA3 H 1 3.94 0.03 . 2 . . . . . 112 GLY HA3 . 52770 1 922 . 1 . 1 112 112 GLY CA C 13 44.31 0.20 . 1 . . . . . 112 GLY CA . 52770 1 923 . 1 . 1 112 112 GLY N N 15 109.28 0.20 . 1 . . . . . 112 GLY N . 52770 1 924 . 1 . 1 113 113 ALA H H 1 9.00 0.03 . 1 . . . . . 113 ALA H . 52770 1 925 . 1 . 1 113 113 ALA HA H 1 5.46 0.03 . 1 . . . . . 113 ALA HA . 52770 1 926 . 1 . 1 113 113 ALA HB1 H 1 1.43 0.03 . 1 . . . . . 113 ALA MB . 52770 1 927 . 1 . 1 113 113 ALA HB2 H 1 1.43 0.03 . 1 . . . . . 113 ALA MB . 52770 1 928 . 1 . 1 113 113 ALA HB3 H 1 1.43 0.03 . 1 . . . . . 113 ALA MB . 52770 1 929 . 1 . 1 113 113 ALA CA C 13 50.93 0.20 . 1 . . . . . 113 ALA CA . 52770 1 930 . 1 . 1 113 113 ALA CB C 13 23.01 0.20 . 1 . . . . . 113 ALA CB . 52770 1 931 . 1 . 1 113 113 ALA N N 15 126.35 0.20 . 1 . . . . . 113 ALA N . 52770 1 932 . 1 . 1 114 114 LYS H H 1 9.25 0.03 . 1 . . . . . 114 LYS H . 52770 1 933 . 1 . 1 114 114 LYS HA H 1 4.70 0.03 . 1 . . . . . 114 LYS HA . 52770 1 934 . 1 . 1 114 114 LYS HB2 H 1 1.58 0.03 . 2 . . . . . 114 LYS HB2 . 52770 1 935 . 1 . 1 114 114 LYS HB3 H 1 1.64 0.03 . 2 . . . . . 114 LYS HB3 . 52770 1 936 . 1 . 1 114 114 LYS HG3 H 1 1.25 0.03 . 2 . . . . . 114 LYS HG3 . 52770 1 937 . 1 . 1 114 114 LYS HD2 H 1 1.53 0.03 . 2 . . . . . 114 LYS HD2 . 52770 1 938 . 1 . 1 114 114 LYS CA C 13 55.54 0.20 . 1 . . . . . 114 LYS CA . 52770 1 939 . 1 . 1 114 114 LYS CB C 13 34.31 0.20 . 1 . . . . . 114 LYS CB . 52770 1 940 . 1 . 1 114 114 LYS CG C 13 24.83 0.20 . 1 . . . . . 114 LYS CG . 52770 1 941 . 1 . 1 114 114 LYS N N 15 122.23 0.20 . 1 . . . . . 114 LYS N . 52770 1 942 . 1 . 1 115 115 CYS H H 1 9.05 0.03 . 1 . . . . . 115 CYS H . 52770 1 943 . 1 . 1 115 115 CYS N N 15 128.56 0.20 . 1 . . . . . 115 CYS N . 52770 1 944 . 1 . 1 116 116 THR H H 1 8.72 0.03 . 1 . . . . . 116 THR H . 52770 1 945 . 1 . 1 116 116 THR HA H 1 4.89 0.03 . 1 . . . . . 116 THR HA . 52770 1 946 . 1 . 1 116 116 THR HB H 1 3.91 0.03 . 1 . . . . . 116 THR HB . 52770 1 947 . 1 . 1 116 116 THR HG21 H 1 1.12 0.03 . 1 . . . . . 116 THR MG . 52770 1 948 . 1 . 1 116 116 THR HG22 H 1 1.12 0.03 . 1 . . . . . 116 THR MG . 52770 1 949 . 1 . 1 116 116 THR HG23 H 1 1.12 0.03 . 1 . . . . . 116 THR MG . 52770 1 950 . 1 . 1 116 116 THR CA C 13 61.68 0.20 . 1 . . . . . 116 THR CA . 52770 1 951 . 1 . 1 116 116 THR CB C 13 70.42 0.20 . 1 . . . . . 116 THR CB . 52770 1 952 . 1 . 1 116 116 THR CG2 C 13 21.14 0.20 . 1 . . . . . 116 THR CG2 . 52770 1 953 . 1 . 1 116 116 THR N N 15 120.93 0.20 . 1 . . . . . 116 THR N . 52770 1 954 . 1 . 1 117 117 ASN H H 1 9.04 0.03 . 1 . . . . . 117 ASN H . 52770 1 955 . 1 . 1 117 117 ASN HA H 1 5.41 0.03 . 1 . . . . . 117 ASN HA . 52770 1 956 . 1 . 1 117 117 ASN HB2 H 1 2.97 0.03 . 2 . . . . . 117 ASN HB2 . 52770 1 957 . 1 . 1 117 117 ASN HB3 H 1 2.49 0.03 . 2 . . . . . 117 ASN HB3 . 52770 1 958 . 1 . 1 117 117 ASN CA C 13 51.89 0.20 . 1 . . . . . 117 ASN CA . 52770 1 959 . 1 . 1 117 117 ASN CB C 13 40.85 0.20 . 1 . . . . . 117 ASN CB . 52770 1 960 . 1 . 1 117 117 ASN N N 15 124.01 0.20 . 1 . . . . . 117 ASN N . 52770 1 961 . 1 . 1 118 118 LEU H H 1 9.19 0.03 . 1 . . . . . 118 LEU H . 52770 1 962 . 1 . 1 118 118 LEU HA H 1 5.21 0.03 . 1 . . . . . 118 LEU HA . 52770 1 963 . 1 . 1 118 118 LEU HB2 H 1 1.62 0.03 . 2 . . . . . 118 LEU HB2 . 52770 1 964 . 1 . 1 118 118 LEU HB3 H 1 1.80 0.03 . 2 . . . . . 118 LEU HB3 . 52770 1 965 . 1 . 1 118 118 LEU HG H 1 1.44 0.03 . 1 . . . . . 118 LEU HG . 52770 1 966 . 1 . 1 118 118 LEU HD11 H 1 0.80 0.03 . 2 . . . . . 118 LEU MD1 . 52770 1 967 . 1 . 1 118 118 LEU HD12 H 1 0.80 0.03 . 2 . . . . . 118 LEU MD1 . 52770 1 968 . 1 . 1 118 118 LEU HD13 H 1 0.80 0.03 . 2 . . . . . 118 LEU MD1 . 52770 1 969 . 1 . 1 118 118 LEU HD21 H 1 0.80 0.03 . 2 . . . . . 118 LEU MD2 . 52770 1 970 . 1 . 1 118 118 LEU HD22 H 1 0.80 0.03 . 2 . . . . . 118 LEU MD2 . 52770 1 971 . 1 . 1 118 118 LEU HD23 H 1 0.80 0.03 . 2 . . . . . 118 LEU MD2 . 52770 1 972 . 1 . 1 118 118 LEU CA C 13 54.06 0.20 . 1 . . . . . 118 LEU CA . 52770 1 973 . 1 . 1 118 118 LEU CB C 13 44.35 0.20 . 1 . . . . . 118 LEU CB . 52770 1 974 . 1 . 1 118 118 LEU CG C 13 27.51 0.20 . 1 . . . . . 118 LEU CG . 52770 1 975 . 1 . 1 118 118 LEU CD1 C 13 25.34 0.20 . 2 . . . . . 118 LEU CD1 . 52770 1 976 . 1 . 1 118 118 LEU CD2 C 13 25.35 0.20 . 2 . . . . . 118 LEU CD2 . 52770 1 977 . 1 . 1 118 118 LEU N N 15 130.99 0.20 . 1 . . . . . 118 LEU N . 52770 1 978 . 1 . 1 119 119 SER H H 1 9.15 0.03 . 1 . . . . . 119 SER H . 52770 1 979 . 1 . 1 119 119 SER N N 15 119.97 0.20 . 1 . . . . . 119 SER N . 52770 1 980 . 1 . 1 120 120 LYS H H 1 8.74 0.03 . 1 . . . . . 120 LYS H . 52770 1 981 . 1 . 1 120 120 LYS HA H 1 4.85 0.03 . 1 . . . . . 120 LYS HA . 52770 1 982 . 1 . 1 120 120 LYS HB2 H 1 1.26 0.03 . 2 . . . . . 120 LYS HB2 . 52770 1 983 . 1 . 1 120 120 LYS HB3 H 1 1.49 0.03 . 2 . . . . . 120 LYS HB3 . 52770 1 984 . 1 . 1 120 120 LYS HD2 H 1 1.43 0.03 . 2 . . . . . 120 LYS HD2 . 52770 1 985 . 1 . 1 120 120 LYS HE2 H 1 2.69 0.03 . 2 . . . . . 120 LYS HE2 . 52770 1 986 . 1 . 1 120 120 LYS HE3 H 1 2.69 0.03 . 2 . . . . . 120 LYS HE3 . 52770 1 987 . 1 . 1 120 120 LYS CA C 13 54.68 0.20 . 1 . . . . . 120 LYS CA . 52770 1 988 . 1 . 1 120 120 LYS CB C 13 34.30 0.20 . 1 . . . . . 120 LYS CB . 52770 1 989 . 1 . 1 120 120 LYS CE C 13 41.81 0.20 . 1 . . . . . 120 LYS CE . 52770 1 990 . 1 . 1 120 120 LYS N N 15 122.69 0.20 . 1 . . . . . 120 LYS N . 52770 1 991 . 1 . 1 121 121 TYR H H 1 9.03 0.03 . 1 . . . . . 121 TYR H . 52770 1 992 . 1 . 1 121 121 TYR HA H 1 4.13 0.03 . 1 . . . . . 121 TYR HA . 52770 1 993 . 1 . 1 121 121 TYR CA C 13 57.64 0.20 . 1 . . . . . 121 TYR CA . 52770 1 994 . 1 . 1 121 121 TYR N N 15 123.01 0.20 . 1 . . . . . 121 TYR N . 52770 1 995 . 1 . 1 122 122 HIS H H 1 7.97 0.03 . 1 . . . . . 122 HIS H . 52770 1 996 . 1 . 1 122 122 HIS N N 15 122.91 0.20 . 1 . . . . . 122 HIS N . 52770 1 997 . 1 . 1 123 123 PRO HA H 1 4.95 0.03 . 1 . . . . . 123 PRO HA . 52770 1 998 . 1 . 1 123 123 PRO HB2 H 1 2.28 0.03 . 2 . . . . . 123 PRO HB2 . 52770 1 999 . 1 . 1 123 123 PRO HB3 H 1 2.26 0.03 . 2 . . . . . 123 PRO HB3 . 52770 1 1000 . 1 . 1 123 123 PRO HG3 H 1 2.10 0.03 . 2 . . . . . 123 PRO HG3 . 52770 1 1001 . 1 . 1 123 123 PRO HD2 H 1 4.08 0.03 . 2 . . . . . 123 PRO HD2 . 52770 1 1002 . 1 . 1 123 123 PRO HD3 H 1 4.23 0.03 . 2 . . . . . 123 PRO HD3 . 52770 1 1003 . 1 . 1 123 123 PRO CA C 13 63.13 0.20 . 1 . . . . . 123 PRO CA . 52770 1 1004 . 1 . 1 123 123 PRO CB C 13 32.10 0.20 . 1 . . . . . 123 PRO CB . 52770 1 1005 . 1 . 1 123 123 PRO CG C 13 27.58 0.20 . 1 . . . . . 123 PRO CG . 52770 1 1006 . 1 . 1 123 123 PRO CD C 13 51.97 0.20 . 1 . . . . . 123 PRO CD . 52770 1 1007 . 1 . 1 124 124 LYS H H 1 8.02 0.03 . 1 . . . . . 124 LYS H . 52770 1 1008 . 1 . 1 124 124 LYS N N 15 122.01 0.20 . 1 . . . . . 124 LYS N . 52770 1 1009 . 1 . 1 125 125 PRO HA H 1 4.35 0.03 . 1 . . . . . 125 PRO HA . 52770 1 1010 . 1 . 1 125 125 PRO HB2 H 1 1.88 0.03 . 2 . . . . . 125 PRO HB2 . 52770 1 1011 . 1 . 1 125 125 PRO HB3 H 1 2.32 0.03 . 2 . . . . . 125 PRO HB3 . 52770 1 1012 . 1 . 1 125 125 PRO HG2 H 1 2.05 0.03 . 2 . . . . . 125 PRO HG2 . 52770 1 1013 . 1 . 1 125 125 PRO HG3 H 1 2.16 0.03 . 2 . . . . . 125 PRO HG3 . 52770 1 1014 . 1 . 1 125 125 PRO HD2 H 1 3.57 0.03 . 2 . . . . . 125 PRO HD2 . 52770 1 1015 . 1 . 1 125 125 PRO HD3 H 1 3.95 0.03 . 2 . . . . . 125 PRO HD3 . 52770 1 1016 . 1 . 1 125 125 PRO CA C 13 64.17 0.20 . 1 . . . . . 125 PRO CA . 52770 1 1017 . 1 . 1 125 125 PRO CB C 13 31.62 0.20 . 1 . . . . . 125 PRO CB . 52770 1 1018 . 1 . 1 125 125 PRO CG C 13 28.11 0.20 . 1 . . . . . 125 PRO CG . 52770 1 1019 . 1 . 1 125 125 PRO CD C 13 50.26 0.20 . 1 . . . . . 125 PRO CD . 52770 1 1020 . 1 . 1 126 126 GLY HA2 H 1 3.71 0.03 . 2 . . . . . 126 GLY HA2 . 52770 1 1021 . 1 . 1 126 126 GLY HA3 H 1 4.13 0.03 . 2 . . . . . 126 GLY HA3 . 52770 1 1022 . 1 . 1 126 126 GLY CA C 13 45.69 0.20 . 1 . . . . . 126 GLY CA . 52770 1 1023 . 1 . 1 127 127 VAL H H 1 7.50 0.03 . 1 . . . . . 127 VAL H . 52770 1 1024 . 1 . 1 127 127 VAL HA H 1 4.05 0.03 . 1 . . . . . 127 VAL HA . 52770 1 1025 . 1 . 1 127 127 VAL HB H 1 2.12 0.03 . 1 . . . . . 127 VAL HB . 52770 1 1026 . 1 . 1 127 127 VAL HG11 H 1 0.79 0.03 . 2 . . . . . 127 VAL MG1 . 52770 1 1027 . 1 . 1 127 127 VAL HG12 H 1 0.79 0.03 . 2 . . . . . 127 VAL MG1 . 52770 1 1028 . 1 . 1 127 127 VAL HG13 H 1 0.79 0.03 . 2 . . . . . 127 VAL MG1 . 52770 1 1029 . 1 . 1 127 127 VAL HG21 H 1 0.91 0.03 . 2 . . . . . 127 VAL MG2 . 52770 1 1030 . 1 . 1 127 127 VAL HG22 H 1 0.91 0.03 . 2 . . . . . 127 VAL MG2 . 52770 1 1031 . 1 . 1 127 127 VAL HG23 H 1 0.91 0.03 . 2 . . . . . 127 VAL MG2 . 52770 1 1032 . 1 . 1 127 127 VAL CA C 13 62.45 0.20 . 1 . . . . . 127 VAL CA . 52770 1 1033 . 1 . 1 127 127 VAL CB C 13 32.81 0.20 . 1 . . . . . 127 VAL CB . 52770 1 1034 . 1 . 1 127 127 VAL CG1 C 13 20.91 0.20 . 2 . . . . . 127 VAL CG1 . 52770 1 1035 . 1 . 1 127 127 VAL CG2 C 13 21.42 0.20 . 2 . . . . . 127 VAL CG2 . 52770 1 1036 . 1 . 1 127 127 VAL N N 15 119.74 0.20 . 1 . . . . . 127 VAL N . 52770 1 1037 . 1 . 1 128 128 GLN H H 1 8.47 0.03 . 1 . . . . . 128 GLN H . 52770 1 1038 . 1 . 1 128 128 GLN HA H 1 4.50 0.03 . 1 . . . . . 128 GLN HA . 52770 1 1039 . 1 . 1 128 128 GLN HB2 H 1 1.92 0.03 . 2 . . . . . 128 GLN HB2 . 52770 1 1040 . 1 . 1 128 128 GLN HB3 H 1 2.01 0.03 . 2 . . . . . 128 GLN HB3 . 52770 1 1041 . 1 . 1 128 128 GLN CA C 13 54.24 0.20 . 1 . . . . . 128 GLN CA . 52770 1 1042 . 1 . 1 128 128 GLN CB C 13 29.78 0.20 . 1 . . . . . 128 GLN CB . 52770 1 1043 . 1 . 1 128 128 GLN N N 15 125.20 0.20 . 1 . . . . . 128 GLN N . 52770 1 1044 . 1 . 1 129 129 ILE H H 1 8.60 0.03 . 1 . . . . . 129 ILE H . 52770 1 1045 . 1 . 1 129 129 ILE HA H 1 3.93 0.03 . 1 . . . . . 129 ILE HA . 52770 1 1046 . 1 . 1 129 129 ILE HB H 1 1.68 0.03 . 1 . . . . . 129 ILE HB . 52770 1 1047 . 1 . 1 129 129 ILE HG12 H 1 1.10 0.03 . 2 . . . . . 129 ILE HG12 . 52770 1 1048 . 1 . 1 129 129 ILE HG13 H 1 1.39 0.03 . 2 . . . . . 129 ILE HG13 . 52770 1 1049 . 1 . 1 129 129 ILE HG21 H 1 0.51 0.03 . 1 . . . . . 129 ILE MG . 52770 1 1050 . 1 . 1 129 129 ILE HG22 H 1 0.51 0.03 . 1 . . . . . 129 ILE MG . 52770 1 1051 . 1 . 1 129 129 ILE HG23 H 1 0.51 0.03 . 1 . . . . . 129 ILE MG . 52770 1 1052 . 1 . 1 129 129 ILE HD11 H 1 0.63 0.03 . 1 . . . . . 129 ILE MD . 52770 1 1053 . 1 . 1 129 129 ILE HD12 H 1 0.63 0.03 . 1 . . . . . 129 ILE MD . 52770 1 1054 . 1 . 1 129 129 ILE HD13 H 1 0.63 0.03 . 1 . . . . . 129 ILE MD . 52770 1 1055 . 1 . 1 129 129 ILE CA C 13 60.92 0.20 . 1 . . . . . 129 ILE CA . 52770 1 1056 . 1 . 1 129 129 ILE CB C 13 38.24 0.20 . 1 . . . . . 129 ILE CB . 52770 1 1057 . 1 . 1 129 129 ILE CG1 C 13 27.73 0.20 . 1 . . . . . 129 ILE CG1 . 52770 1 1058 . 1 . 1 129 129 ILE CG2 C 13 17.27 0.20 . 1 . . . . . 129 ILE CG2 . 52770 1 1059 . 1 . 1 129 129 ILE CD1 C 13 12.81 0.20 . 1 . . . . . 129 ILE CD1 . 52770 1 1060 . 1 . 1 129 129 ILE N N 15 124.64 0.20 . 1 . . . . . 129 ILE N . 52770 1 1061 . 1 . 1 130 130 ASN HA H 1 4.94 0.03 . 1 . . . . . 130 ASN HA . 52770 1 1062 . 1 . 1 130 130 ASN HB2 H 1 2.74 0.03 . 2 . . . . . 130 ASN HB2 . 52770 1 1063 . 1 . 1 130 130 ASN HB3 H 1 3.05 0.03 . 2 . . . . . 130 ASN HB3 . 52770 1 1064 . 1 . 1 130 130 ASN CA C 13 51.66 0.20 . 1 . . . . . 130 ASN CA . 52770 1 1065 . 1 . 1 130 130 ASN CB C 13 39.45 0.20 . 1 . . . . . 130 ASN CB . 52770 1 1066 . 1 . 1 131 131 GLU H H 1 9.20 0.03 . 1 . . . . . 131 GLU H . 52770 1 1067 . 1 . 1 131 131 GLU HA H 1 3.76 0.03 . 1 . . . . . 131 GLU HA . 52770 1 1068 . 1 . 1 131 131 GLU HB2 H 1 2.07 0.03 . 2 . . . . . 131 GLU HB2 . 52770 1 1069 . 1 . 1 131 131 GLU HB3 H 1 2.05 0.03 . 2 . . . . . 131 GLU HB3 . 52770 1 1070 . 1 . 1 131 131 GLU CA C 13 59.94 0.20 . 1 . . . . . 131 GLU CA . 52770 1 1071 . 1 . 1 131 131 GLU CB C 13 29.82 0.20 . 1 . . . . . 131 GLU CB . 52770 1 1072 . 1 . 1 131 131 GLU N N 15 125.48 0.20 . 1 . . . . . 131 GLU N . 52770 1 1073 . 1 . 1 132 132 GLU H H 1 8.47 0.03 . 1 . . . . . 132 GLU H . 52770 1 1074 . 1 . 1 132 132 GLU HA H 1 4.03 0.03 . 1 . . . . . 132 GLU HA . 52770 1 1075 . 1 . 1 132 132 GLU CA C 13 59.58 0.20 . 1 . . . . . 132 GLU CA . 52770 1 1076 . 1 . 1 132 132 GLU N N 15 118.70 0.20 . 1 . . . . . 132 GLU N . 52770 1 1077 . 1 . 1 133 133 GLU H H 1 7.73 0.03 . 1 . . . . . 133 GLU H . 52770 1 1078 . 1 . 1 133 133 GLU HA H 1 4.15 0.03 . 1 . . . . . 133 GLU HA . 52770 1 1079 . 1 . 1 133 133 GLU HB2 H 1 2.15 0.03 . 2 . . . . . 133 GLU HB2 . 52770 1 1080 . 1 . 1 133 133 GLU HB3 H 1 2.15 0.03 . 2 . . . . . 133 GLU HB3 . 52770 1 1081 . 1 . 1 133 133 GLU CA C 13 58.75 0.20 . 1 . . . . . 133 GLU CA . 52770 1 1082 . 1 . 1 133 133 GLU CB C 13 29.99 0.20 . 1 . . . . . 133 GLU CB . 52770 1 1083 . 1 . 1 133 133 GLU N N 15 119.55 0.20 . 1 . . . . . 133 GLU N . 52770 1 1084 . 1 . 1 134 134 ILE H H 1 7.34 0.03 . 1 . . . . . 134 ILE H . 52770 1 1085 . 1 . 1 134 134 ILE HB H 1 1.63 0.03 . 1 . . . . . 134 ILE HB . 52770 1 1086 . 1 . 1 134 134 ILE HG12 H 1 0.91 0.03 . 2 . . . . . 134 ILE HG12 . 52770 1 1087 . 1 . 1 134 134 ILE HG13 H 1 1.37 0.03 . 2 . . . . . 134 ILE HG13 . 52770 1 1088 . 1 . 1 134 134 ILE HG21 H 1 0.57 0.03 . 1 . . . . . 134 ILE MG . 52770 1 1089 . 1 . 1 134 134 ILE HG22 H 1 0.57 0.03 . 1 . . . . . 134 ILE MG . 52770 1 1090 . 1 . 1 134 134 ILE HG23 H 1 0.57 0.03 . 1 . . . . . 134 ILE MG . 52770 1 1091 . 1 . 1 134 134 ILE HD11 H 1 0.25 0.03 . 1 . . . . . 134 ILE MD . 52770 1 1092 . 1 . 1 134 134 ILE HD12 H 1 0.25 0.03 . 1 . . . . . 134 ILE MD . 52770 1 1093 . 1 . 1 134 134 ILE HD13 H 1 0.25 0.03 . 1 . . . . . 134 ILE MD . 52770 1 1094 . 1 . 1 134 134 ILE CB C 13 37.17 0.20 . 1 . . . . . 134 ILE CB . 52770 1 1095 . 1 . 1 134 134 ILE CG1 C 13 27.40 0.20 . 1 . . . . . 134 ILE CG1 . 52770 1 1096 . 1 . 1 134 134 ILE CG2 C 13 18.38 0.20 . 1 . . . . . 134 ILE CG2 . 52770 1 1097 . 1 . 1 134 134 ILE CD1 C 13 12.57 0.20 . 1 . . . . . 134 ILE CD1 . 52770 1 1098 . 1 . 1 134 134 ILE N N 15 117.76 0.20 . 1 . . . . . 134 ILE N . 52770 1 1099 . 1 . 1 135 135 LYS H H 1 8.08 0.03 . 1 . . . . . 135 LYS H . 52770 1 1100 . 1 . 1 135 135 LYS HA H 1 3.92 0.03 . 1 . . . . . 135 LYS HA . 52770 1 1101 . 1 . 1 135 135 LYS HB2 H 1 1.89 0.03 . 2 . . . . . 135 LYS HB2 . 52770 1 1102 . 1 . 1 135 135 LYS HB3 H 1 1.93 0.03 . 2 . . . . . 135 LYS HB3 . 52770 1 1103 . 1 . 1 135 135 LYS HG2 H 1 1.47 0.03 . 2 . . . . . 135 LYS HG2 . 52770 1 1104 . 1 . 1 135 135 LYS HG3 H 1 1.62 0.03 . 2 . . . . . 135 LYS HG3 . 52770 1 1105 . 1 . 1 135 135 LYS CA C 13 59.88 0.20 . 1 . . . . . 135 LYS CA . 52770 1 1106 . 1 . 1 135 135 LYS CB C 13 32.36 0.20 . 1 . . . . . 135 LYS CB . 52770 1 1107 . 1 . 1 135 135 LYS CG C 13 25.66 0.20 . 1 . . . . . 135 LYS CG . 52770 1 1108 . 1 . 1 135 135 LYS N N 15 121.71 0.20 . 1 . . . . . 135 LYS N . 52770 1 1109 . 1 . 1 136 136 ALA H H 1 7.91 0.03 . 1 . . . . . 136 ALA H . 52770 1 1110 . 1 . 1 136 136 ALA N N 15 120.98 0.20 . 1 . . . . . 136 ALA N . 52770 1 1111 . 1 . 1 137 137 SER H H 1 7.81 0.03 . 1 . . . . . 137 SER H . 52770 1 1112 . 1 . 1 137 137 SER HA H 1 4.31 0.03 . 1 . . . . . 137 SER HA . 52770 1 1113 . 1 . 1 137 137 SER CA C 13 61.23 0.20 . 1 . . . . . 137 SER CA . 52770 1 1114 . 1 . 1 137 137 SER N N 15 113.91 0.20 . 1 . . . . . 137 SER N . 52770 1 1115 . 1 . 1 138 138 LYS H H 1 8.09 0.03 . 1 . . . . . 138 LYS H . 52770 1 1116 . 1 . 1 138 138 LYS HA H 1 4.19 0.03 . 1 . . . . . 138 LYS HA . 52770 1 1117 . 1 . 1 138 138 LYS HB2 H 1 2.00 0.03 . 2 . . . . . 138 LYS HB2 . 52770 1 1118 . 1 . 1 138 138 LYS HB3 H 1 2.00 0.03 . 2 . . . . . 138 LYS HB3 . 52770 1 1119 . 1 . 1 138 138 LYS HG2 H 1 1.61 0.03 . 2 . . . . . 138 LYS HG2 . 52770 1 1120 . 1 . 1 138 138 LYS HG3 H 1 1.54 0.03 . 2 . . . . . 138 LYS HG3 . 52770 1 1121 . 1 . 1 138 138 LYS HD2 H 1 1.75 0.03 . 2 . . . . . 138 LYS HD2 . 52770 1 1122 . 1 . 1 138 138 LYS HD3 H 1 1.75 0.03 . 2 . . . . . 138 LYS HD3 . 52770 1 1123 . 1 . 1 138 138 LYS CA C 13 58.99 0.20 . 1 . . . . . 138 LYS CA . 52770 1 1124 . 1 . 1 138 138 LYS CB C 13 32.34 0.20 . 1 . . . . . 138 LYS CB . 52770 1 1125 . 1 . 1 138 138 LYS CG C 13 24.91 0.20 . 1 . . . . . 138 LYS CG . 52770 1 1126 . 1 . 1 138 138 LYS CD C 13 29.32 0.20 . 1 . . . . . 138 LYS CD . 52770 1 1127 . 1 . 1 138 138 LYS N N 15 123.57 0.20 . 1 . . . . . 138 LYS N . 52770 1 1128 . 1 . 1 139 139 GLU H H 1 8.03 0.03 . 1 . . . . . 139 GLU H . 52770 1 1129 . 1 . 1 139 139 GLU HA H 1 4.02 0.03 . 1 . . . . . 139 GLU HA . 52770 1 1130 . 1 . 1 139 139 GLU CA C 13 59.64 0.20 . 1 . . . . . 139 GLU CA . 52770 1 1131 . 1 . 1 139 139 GLU N N 15 118.97 0.20 . 1 . . . . . 139 GLU N . 52770 1 1132 . 1 . 1 140 140 LYS HA H 1 4.15 0.03 . 1 . . . . . 140 LYS HA . 52770 1 1133 . 1 . 1 140 140 LYS HG2 H 1 1.67 0.03 . 2 . . . . . 140 LYS HG2 . 52770 1 1134 . 1 . 1 140 140 LYS HG3 H 1 1.51 0.03 . 2 . . . . . 140 LYS HG3 . 52770 1 1135 . 1 . 1 140 140 LYS HD3 H 1 1.75 0.03 . 2 . . . . . 140 LYS HD3 . 52770 1 1136 . 1 . 1 140 140 LYS HE2 H 1 2.96 0.03 . 2 . . . . . 140 LYS HE2 . 52770 1 1137 . 1 . 1 140 140 LYS HE3 H 1 2.96 0.03 . 2 . . . . . 140 LYS HE3 . 52770 1 1138 . 1 . 1 140 140 LYS CA C 13 59.76 0.20 . 1 . . . . . 140 LYS CA . 52770 1 1139 . 1 . 1 140 140 LYS CG C 13 25.47 0.20 . 1 . . . . . 140 LYS CG . 52770 1 1140 . 1 . 1 140 140 LYS CD C 13 29.32 0.20 . 1 . . . . . 140 LYS CD . 52770 1 1141 . 1 . 1 140 140 LYS CE C 13 41.94 0.20 . 1 . . . . . 140 LYS CE . 52770 1 1142 . 1 . 1 141 141 GLY H H 1 7.82 0.03 . 1 . . . . . 141 GLY H . 52770 1 1143 . 1 . 1 141 141 GLY HA2 H 1 3.82 0.03 . 2 . . . . . 141 GLY HA2 . 52770 1 1144 . 1 . 1 141 141 GLY HA3 H 1 4.01 0.03 . 2 . . . . . 141 GLY HA3 . 52770 1 1145 . 1 . 1 141 141 GLY CA C 13 46.99 0.20 . 1 . . . . . 141 GLY CA . 52770 1 1146 . 1 . 1 141 141 GLY N N 15 106.22 0.20 . 1 . . . . . 141 GLY N . 52770 1 1147 . 1 . 1 143 143 ALA H H 1 7.90 0.03 . 1 . . . . . 143 ALA H . 52770 1 1148 . 1 . 1 143 143 ALA HA H 1 4.05 0.03 . 1 . . . . . 143 ALA HA . 52770 1 1149 . 1 . 1 143 143 ALA HB1 H 1 1.54 0.03 . 1 . . . . . 143 ALA MB . 52770 1 1150 . 1 . 1 143 143 ALA HB2 H 1 1.54 0.03 . 1 . . . . . 143 ALA MB . 52770 1 1151 . 1 . 1 143 143 ALA HB3 H 1 1.54 0.03 . 1 . . . . . 143 ALA MB . 52770 1 1152 . 1 . 1 143 143 ALA CA C 13 55.21 0.20 . 1 . . . . . 143 ALA CA . 52770 1 1153 . 1 . 1 143 143 ALA CB C 13 18.06 0.20 . 1 . . . . . 143 ALA CB . 52770 1 1154 . 1 . 1 143 143 ALA N N 15 121.97 0.20 . 1 . . . . . 143 ALA N . 52770 1 1155 . 1 . 1 144 144 VAL H H 1 7.49 0.03 . 1 . . . . . 144 VAL H . 52770 1 1156 . 1 . 1 144 144 VAL HA H 1 3.60 0.03 . 1 . . . . . 144 VAL HA . 52770 1 1157 . 1 . 1 144 144 VAL HB H 1 2.40 0.03 . 1 . . . . . 144 VAL HB . 52770 1 1158 . 1 . 1 144 144 VAL HG11 H 1 0.87 0.03 . 2 . . . . . 144 VAL MG1 . 52770 1 1159 . 1 . 1 144 144 VAL HG12 H 1 0.87 0.03 . 2 . . . . . 144 VAL MG1 . 52770 1 1160 . 1 . 1 144 144 VAL HG13 H 1 0.87 0.03 . 2 . . . . . 144 VAL MG1 . 52770 1 1161 . 1 . 1 144 144 VAL HG21 H 1 1.04 0.03 . 2 . . . . . 144 VAL MG2 . 52770 1 1162 . 1 . 1 144 144 VAL HG22 H 1 1.04 0.03 . 2 . . . . . 144 VAL MG2 . 52770 1 1163 . 1 . 1 144 144 VAL HG23 H 1 1.04 0.03 . 2 . . . . . 144 VAL MG2 . 52770 1 1164 . 1 . 1 144 144 VAL CA C 13 66.41 0.20 . 1 . . . . . 144 VAL CA . 52770 1 1165 . 1 . 1 144 144 VAL CB C 13 31.21 0.20 . 1 . . . . . 144 VAL CB . 52770 1 1166 . 1 . 1 144 144 VAL CG1 C 13 22.58 0.20 . 2 . . . . . 144 VAL CG1 . 52770 1 1167 . 1 . 1 144 144 VAL CG2 C 13 22.44 0.20 . 2 . . . . . 144 VAL CG2 . 52770 1 1168 . 1 . 1 144 144 VAL N N 15 118.78 0.20 . 1 . . . . . 144 VAL N . 52770 1 1169 . 1 . 1 146 146 ARG HA H 1 4.15 0.03 . 1 . . . . . 146 ARG HA . 52770 1 1170 . 1 . 1 146 146 ARG HD2 H 1 2.96 0.03 . 2 . . . . . 146 ARG HD2 . 52770 1 1171 . 1 . 1 146 146 ARG HD3 H 1 2.96 0.03 . 2 . . . . . 146 ARG HD3 . 52770 1 1172 . 1 . 1 146 146 ARG CA C 13 59.76 0.20 . 1 . . . . . 146 ARG CA . 52770 1 1173 . 1 . 1 146 146 ARG CD C 13 41.97 0.20 . 1 . . . . . 146 ARG CD . 52770 1 1174 . 1 . 1 147 147 ALA H H 1 7.64 0.03 . 1 . . . . . 147 ALA H . 52770 1 1175 . 1 . 1 147 147 ALA N N 15 121.92 0.20 . 1 . . . . . 147 ALA N . 52770 1 1176 . 1 . 1 148 148 VAL H H 1 7.79 0.03 . 1 . . . . . 148 VAL H . 52770 1 1177 . 1 . 1 148 148 VAL HA H 1 3.50 0.03 . 1 . . . . . 148 VAL HA . 52770 1 1178 . 1 . 1 148 148 VAL HB H 1 2.03 0.03 . 1 . . . . . 148 VAL HB . 52770 1 1179 . 1 . 1 148 148 VAL HG11 H 1 0.74 0.03 . 2 . . . . . 148 VAL MG1 . 52770 1 1180 . 1 . 1 148 148 VAL HG12 H 1 0.74 0.03 . 2 . . . . . 148 VAL MG1 . 52770 1 1181 . 1 . 1 148 148 VAL HG13 H 1 0.74 0.03 . 2 . . . . . 148 VAL MG1 . 52770 1 1182 . 1 . 1 148 148 VAL HG21 H 1 0.85 0.03 . 2 . . . . . 148 VAL MG2 . 52770 1 1183 . 1 . 1 148 148 VAL HG22 H 1 0.85 0.03 . 2 . . . . . 148 VAL MG2 . 52770 1 1184 . 1 . 1 148 148 VAL HG23 H 1 0.85 0.03 . 2 . . . . . 148 VAL MG2 . 52770 1 1185 . 1 . 1 148 148 VAL CA C 13 66.75 0.20 . 1 . . . . . 148 VAL CA . 52770 1 1186 . 1 . 1 148 148 VAL CB C 13 31.24 0.20 . 1 . . . . . 148 VAL CB . 52770 1 1187 . 1 . 1 148 148 VAL CG1 C 13 21.75 0.20 . 2 . . . . . 148 VAL CG1 . 52770 1 1188 . 1 . 1 148 148 VAL CG2 C 13 23.71 0.20 . 2 . . . . . 148 VAL CG2 . 52770 1 1189 . 1 . 1 148 148 VAL N N 15 120.59 0.20 . 1 . . . . . 148 VAL N . 52770 1 1190 . 1 . 1 149 149 GLU H H 1 8.77 0.03 . 1 . . . . . 149 GLU H . 52770 1 1191 . 1 . 1 149 149 GLU HA H 1 3.53 0.03 . 1 . . . . . 149 GLU HA . 52770 1 1192 . 1 . 1 149 149 GLU CA C 13 60.51 0.20 . 1 . . . . . 149 GLU CA . 52770 1 1193 . 1 . 1 149 149 GLU N N 15 120.97 0.20 . 1 . . . . . 149 GLU N . 52770 1 1194 . 1 . 1 150 150 ALA H H 1 7.99 0.03 . 1 . . . . . 150 ALA H . 52770 1 1195 . 1 . 1 150 150 ALA N N 15 118.17 0.20 . 1 . . . . . 150 ALA N . 52770 1 1196 . 1 . 1 151 151 PHE H H 1 9.34 0.03 . 1 . . . . . 151 PHE H . 52770 1 1197 . 1 . 1 151 151 PHE HB2 H 1 3.25 0.03 . 2 . . . . . 151 PHE HB2 . 52770 1 1198 . 1 . 1 151 151 PHE HB3 H 1 3.36 0.03 . 2 . . . . . 151 PHE HB3 . 52770 1 1199 . 1 . 1 151 151 PHE CB C 13 39.78 0.20 . 1 . . . . . 151 PHE CB . 52770 1 1200 . 1 . 1 151 151 PHE N N 15 127.43 0.20 . 1 . . . . . 151 PHE N . 52770 1 1201 . 1 . 1 152 152 LEU H H 1 8.61 0.03 . 1 . . . . . 152 LEU H . 52770 1 1202 . 1 . 1 152 152 LEU HA H 1 3.87 0.03 . 1 . . . . . 152 LEU HA . 52770 1 1203 . 1 . 1 152 152 LEU HB2 H 1 1.45 0.03 . 2 . . . . . 152 LEU HB2 . 52770 1 1204 . 1 . 1 152 152 LEU HB3 H 1 1.86 0.03 . 2 . . . . . 152 LEU HB3 . 52770 1 1205 . 1 . 1 152 152 LEU HG H 1 2.09 0.03 . 1 . . . . . 152 LEU HG . 52770 1 1206 . 1 . 1 152 152 LEU HD11 H 1 0.99 0.03 . 2 . . . . . 152 LEU MD1 . 52770 1 1207 . 1 . 1 152 152 LEU HD12 H 1 0.99 0.03 . 2 . . . . . 152 LEU MD1 . 52770 1 1208 . 1 . 1 152 152 LEU HD13 H 1 0.99 0.03 . 2 . . . . . 152 LEU MD1 . 52770 1 1209 . 1 . 1 152 152 LEU HD21 H 1 0.99 0.03 . 2 . . . . . 152 LEU MD2 . 52770 1 1210 . 1 . 1 152 152 LEU HD22 H 1 0.99 0.03 . 2 . . . . . 152 LEU MD2 . 52770 1 1211 . 1 . 1 152 152 LEU HD23 H 1 0.99 0.03 . 2 . . . . . 152 LEU MD2 . 52770 1 1212 . 1 . 1 152 152 LEU CA C 13 57.33 0.20 . 1 . . . . . 152 LEU CA . 52770 1 1213 . 1 . 1 152 152 LEU CB C 13 41.21 0.20 . 1 . . . . . 152 LEU CB . 52770 1 1214 . 1 . 1 152 152 LEU CG C 13 26.96 0.20 . 1 . . . . . 152 LEU CG . 52770 1 1215 . 1 . 1 152 152 LEU CD1 C 13 22.93 0.20 . 2 . . . . . 152 LEU CD1 . 52770 1 1216 . 1 . 1 152 152 LEU CD2 C 13 22.94 0.20 . 2 . . . . . 152 LEU CD2 . 52770 1 1217 . 1 . 1 152 152 LEU N N 15 120.49 0.20 . 1 . . . . . 152 LEU N . 52770 1 1218 . 1 . 1 153 153 LEU H H 1 8.38 0.03 . 1 . . . . . 153 LEU H . 52770 1 1219 . 1 . 1 153 153 LEU HA H 1 4.02 0.03 . 1 . . . . . 153 LEU HA . 52770 1 1220 . 1 . 1 153 153 LEU HB2 H 1 1.43 0.03 . 2 . . . . . 153 LEU HB2 . 52770 1 1221 . 1 . 1 153 153 LEU HB3 H 1 1.84 0.03 . 2 . . . . . 153 LEU HB3 . 52770 1 1222 . 1 . 1 153 153 LEU HG H 1 0.87 0.03 . 1 . . . . . 153 LEU HG . 52770 1 1223 . 1 . 1 153 153 LEU HD11 H 1 0.83 0.03 . 2 . . . . . 153 LEU MD1 . 52770 1 1224 . 1 . 1 153 153 LEU HD12 H 1 0.83 0.03 . 2 . . . . . 153 LEU MD1 . 52770 1 1225 . 1 . 1 153 153 LEU HD13 H 1 0.83 0.03 . 2 . . . . . 153 LEU MD1 . 52770 1 1226 . 1 . 1 153 153 LEU HD21 H 1 0.83 0.03 . 2 . . . . . 153 LEU MD2 . 52770 1 1227 . 1 . 1 153 153 LEU HD22 H 1 0.83 0.03 . 2 . . . . . 153 LEU MD2 . 52770 1 1228 . 1 . 1 153 153 LEU HD23 H 1 0.83 0.03 . 2 . . . . . 153 LEU MD2 . 52770 1 1229 . 1 . 1 153 153 LEU CA C 13 57.14 0.20 . 1 . . . . . 153 LEU CA . 52770 1 1230 . 1 . 1 153 153 LEU CB C 13 42.15 0.20 . 1 . . . . . 153 LEU CB . 52770 1 1231 . 1 . 1 153 153 LEU CG C 13 25.82 0.20 . 1 . . . . . 153 LEU CG . 52770 1 1232 . 1 . 1 153 153 LEU CD1 C 13 23.15 0.20 . 2 . . . . . 153 LEU CD1 . 52770 1 1233 . 1 . 1 153 153 LEU CD2 C 13 23.16 0.20 . 2 . . . . . 153 LEU CD2 . 52770 1 1234 . 1 . 1 153 153 LEU N N 15 119.10 0.20 . 1 . . . . . 153 LEU N . 52770 1 1235 . 1 . 1 154 154 ALA H H 1 7.28 0.03 . 1 . . . . . 154 ALA H . 52770 1 1236 . 1 . 1 154 154 ALA HA H 1 4.25 0.03 . 1 . . . . . 154 ALA HA . 52770 1 1237 . 1 . 1 154 154 ALA HB1 H 1 1.42 0.03 . 1 . . . . . 154 ALA MB . 52770 1 1238 . 1 . 1 154 154 ALA HB2 H 1 1.42 0.03 . 1 . . . . . 154 ALA MB . 52770 1 1239 . 1 . 1 154 154 ALA HB3 H 1 1.42 0.03 . 1 . . . . . 154 ALA MB . 52770 1 1240 . 1 . 1 154 154 ALA CA C 13 52.76 0.20 . 1 . . . . . 154 ALA CA . 52770 1 1241 . 1 . 1 154 154 ALA CB C 13 19.39 0.20 . 1 . . . . . 154 ALA CB . 52770 1 1242 . 1 . 1 154 154 ALA N N 15 118.35 0.20 . 1 . . . . . 154 ALA N . 52770 1 1243 . 1 . 1 155 155 ASN H H 1 7.21 0.03 . 1 . . . . . 155 ASN H . 52770 1 1244 . 1 . 1 155 155 ASN HA H 1 5.04 0.03 . 1 . . . . . 155 ASN HA . 52770 1 1245 . 1 . 1 155 155 ASN HB2 H 1 2.01 0.03 . 2 . . . . . 155 ASN HB2 . 52770 1 1246 . 1 . 1 155 155 ASN HB3 H 1 2.12 0.03 . 2 . . . . . 155 ASN HB3 . 52770 1 1247 . 1 . 1 155 155 ASN CA C 13 50.94 0.20 . 1 . . . . . 155 ASN CA . 52770 1 1248 . 1 . 1 155 155 ASN CB C 13 39.47 0.20 . 1 . . . . . 155 ASN CB . 52770 1 1249 . 1 . 1 155 155 ASN N N 15 115.65 0.20 . 1 . . . . . 155 ASN N . 52770 1 1250 . 1 . 1 156 156 PRO HA H 1 4.48 0.03 . 1 . . . . . 156 PRO HA . 52770 1 1251 . 1 . 1 156 156 PRO HB2 H 1 1.96 0.03 . 2 . . . . . 156 PRO HB2 . 52770 1 1252 . 1 . 1 156 156 PRO HB3 H 1 1.96 0.03 . 2 . . . . . 156 PRO HB3 . 52770 1 1253 . 1 . 1 156 156 PRO HG2 H 1 2.33 0.03 . 2 . . . . . 156 PRO HG2 . 52770 1 1254 . 1 . 1 156 156 PRO HG3 H 1 1.98 0.03 . 2 . . . . . 156 PRO HG3 . 52770 1 1255 . 1 . 1 156 156 PRO HD2 H 1 3.32 0.03 . 2 . . . . . 156 PRO HD2 . 52770 1 1256 . 1 . 1 156 156 PRO HD3 H 1 3.64 0.03 . 2 . . . . . 156 PRO HD3 . 52770 1 1257 . 1 . 1 156 156 PRO CA C 13 64.88 0.20 . 1 . . . . . 156 PRO CA . 52770 1 1258 . 1 . 1 156 156 PRO CB C 13 27.24 0.20 . 1 . . . . . 156 PRO CB . 52770 1 1259 . 1 . 1 156 156 PRO CG C 13 32.11 0.20 . 1 . . . . . 156 PRO CG . 52770 1 1260 . 1 . 1 156 156 PRO CD C 13 50.34 0.20 . 1 . . . . . 156 PRO CD . 52770 1 1261 . 1 . 1 157 157 GLU H H 1 8.80 0.03 . 1 . . . . . 157 GLU H . 52770 1 1262 . 1 . 1 157 157 GLU HA H 1 4.26 0.03 . 1 . . . . . 157 GLU HA . 52770 1 1263 . 1 . 1 157 157 GLU HB2 H 1 2.09 0.03 . 2 . . . . . 157 GLU HB2 . 52770 1 1264 . 1 . 1 157 157 GLU HB3 H 1 1.88 0.03 . 2 . . . . . 157 GLU HB3 . 52770 1 1265 . 1 . 1 157 157 GLU CA C 13 56.55 0.20 . 1 . . . . . 157 GLU CA . 52770 1 1266 . 1 . 1 157 157 GLU CB C 13 28.98 0.20 . 1 . . . . . 157 GLU CB . 52770 1 1267 . 1 . 1 157 157 GLU N N 15 116.84 0.20 . 1 . . . . . 157 GLU N . 52770 1 1268 . 1 . 1 158 158 ALA H H 1 7.74 0.03 . 1 . . . . . 158 ALA H . 52770 1 1269 . 1 . 1 158 158 ALA HA H 1 4.00 0.03 . 1 . . . . . 158 ALA HA . 52770 1 1270 . 1 . 1 158 158 ALA HB1 H 1 1.36 0.03 . 1 . . . . . 158 ALA MB . 52770 1 1271 . 1 . 1 158 158 ALA HB2 H 1 1.36 0.03 . 1 . . . . . 158 ALA MB . 52770 1 1272 . 1 . 1 158 158 ALA HB3 H 1 1.36 0.03 . 1 . . . . . 158 ALA MB . 52770 1 1273 . 1 . 1 158 158 ALA CA C 13 53.23 0.20 . 1 . . . . . 158 ALA CA . 52770 1 1274 . 1 . 1 158 158 ALA CB C 13 18.81 0.20 . 1 . . . . . 158 ALA CB . 52770 1 1275 . 1 . 1 158 158 ALA N N 15 124.43 0.20 . 1 . . . . . 158 ALA N . 52770 1 1276 . 1 . 1 159 159 TYR H H 1 8.30 0.03 . 1 . . . . . 159 TYR H . 52770 1 1277 . 1 . 1 159 159 TYR HA H 1 3.95 0.03 . 1 . . . . . 159 TYR HA . 52770 1 1278 . 1 . 1 159 159 TYR CA C 13 59.94 0.20 . 1 . . . . . 159 TYR CA . 52770 1 1279 . 1 . 1 159 159 TYR N N 15 114.53 0.20 . 1 . . . . . 159 TYR N . 52770 1 1280 . 1 . 1 160 160 ALA H H 1 7.29 0.03 . 1 . . . . . 160 ALA H . 52770 1 1281 . 1 . 1 160 160 ALA HA H 1 4.03 0.03 . 1 . . . . . 160 ALA HA . 52770 1 1282 . 1 . 1 160 160 ALA HB1 H 1 1.34 0.03 . 1 . . . . . 160 ALA MB . 52770 1 1283 . 1 . 1 160 160 ALA HB2 H 1 1.34 0.03 . 1 . . . . . 160 ALA MB . 52770 1 1284 . 1 . 1 160 160 ALA HB3 H 1 1.34 0.03 . 1 . . . . . 160 ALA MB . 52770 1 1285 . 1 . 1 160 160 ALA CA C 13 53.98 0.20 . 1 . . . . . 160 ALA CA . 52770 1 1286 . 1 . 1 160 160 ALA CB C 13 20.09 0.20 . 1 . . . . . 160 ALA CB . 52770 1 1287 . 1 . 1 160 160 ALA N N 15 125.65 0.20 . 1 . . . . . 160 ALA N . 52770 1 stop_ save_