data_30926 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 30926 _Entry.Title ; Solution NMR structure of peptidase domain from Clostridium thermocellum PCAT1 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2021-06-13 _Entry.Accession_date 2021-06-13 _Entry.Last_release_date 2021-06-18 _Entry.Original_release_date 2021-06-18 _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 NMR' _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 S. Bhattacharya S. . . . 30926 2 A. Palillo A. . . . 30926 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'C39 peptidase domain' . 30926 'PEPTIDE BINDING PROTEIN' . 30926 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 30926 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 622 30926 '15N chemical shifts' 151 30926 '1H chemical shifts' 1057 30926 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 2 . . 2022-04-11 2021-06-13 update BMRB 'update entry citation' 30926 1 . . 2021-12-31 2021-06-13 original author 'original release' 30926 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 7N87 'BMRB Entry Tracking System' 30926 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 30926 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 34865273 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; Structural and dynamic studies of the peptidase domain from Clostridium thermocellum PCAT1 ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Protein Sci.' _Citation.Journal_name_full . _Citation.Journal_volume 31 _Citation.Journal_issue 2 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD 0353 _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 498 _Citation.Page_last 512 _Citation.Year 2022 _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 S. Bhattacharya S. . . . 30926 1 2 A. Pallilo A. . . . 30926 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 30926 _Assembly.ID 1 _Assembly.Name 'ABC-type bacteriocin transporter' _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 unit_1 1 $entity_1 A A yes . . . . . . 30926 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 30926 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity_1 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; SNAMLRRLFKKKYVCVRQYD LTDAGAACLSSIAQYYGLKM SLAKIREMTGTDTQGTNAYG LIHAAKQLGFSAKGVKASKE DLLKDFRLPAIANVIVDNRL AHFVVIYSIKNRIITVADPG KGIVRYSMDDFCSIWTGGLV LLEPGEAFQKG ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer no _Entity.Nstd_chirality . _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 151 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state . _Entity.Src_method man _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation C24A _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 16635.389 _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 . SER . 30926 1 2 . ASN . 30926 1 3 . ALA . 30926 1 4 . MET . 30926 1 5 . LEU . 30926 1 6 . ARG . 30926 1 7 . ARG . 30926 1 8 . LEU . 30926 1 9 . PHE . 30926 1 10 . LYS . 30926 1 11 . LYS . 30926 1 12 . LYS . 30926 1 13 . TYR . 30926 1 14 . VAL . 30926 1 15 . CYS . 30926 1 16 . VAL . 30926 1 17 . ARG . 30926 1 18 . GLN . 30926 1 19 . TYR . 30926 1 20 . ASP . 30926 1 21 . LEU . 30926 1 22 . THR . 30926 1 23 . ASP . 30926 1 24 . ALA . 30926 1 25 . GLY . 30926 1 26 . ALA . 30926 1 27 . ALA . 30926 1 28 . CYS . 30926 1 29 . LEU . 30926 1 30 . SER . 30926 1 31 . SER . 30926 1 32 . ILE . 30926 1 33 . ALA . 30926 1 34 . GLN . 30926 1 35 . TYR . 30926 1 36 . TYR . 30926 1 37 . GLY . 30926 1 38 . LEU . 30926 1 39 . LYS . 30926 1 40 . MET . 30926 1 41 . SER . 30926 1 42 . LEU . 30926 1 43 . ALA . 30926 1 44 . LYS . 30926 1 45 . ILE . 30926 1 46 . ARG . 30926 1 47 . GLU . 30926 1 48 . MET . 30926 1 49 . THR . 30926 1 50 . GLY . 30926 1 51 . THR . 30926 1 52 . ASP . 30926 1 53 . THR . 30926 1 54 . GLN . 30926 1 55 . GLY . 30926 1 56 . THR . 30926 1 57 . ASN . 30926 1 58 . ALA . 30926 1 59 . TYR . 30926 1 60 . GLY . 30926 1 61 . LEU . 30926 1 62 . ILE . 30926 1 63 . HIS . 30926 1 64 . ALA . 30926 1 65 . ALA . 30926 1 66 . LYS . 30926 1 67 . GLN . 30926 1 68 . LEU . 30926 1 69 . GLY . 30926 1 70 . PHE . 30926 1 71 . SER . 30926 1 72 . ALA . 30926 1 73 . LYS . 30926 1 74 . GLY . 30926 1 75 . VAL . 30926 1 76 . LYS . 30926 1 77 . ALA . 30926 1 78 . SER . 30926 1 79 . LYS . 30926 1 80 . GLU . 30926 1 81 . ASP . 30926 1 82 . LEU . 30926 1 83 . LEU . 30926 1 84 . LYS . 30926 1 85 . ASP . 30926 1 86 . PHE . 30926 1 87 . ARG . 30926 1 88 . LEU . 30926 1 89 . PRO . 30926 1 90 . ALA . 30926 1 91 . ILE . 30926 1 92 . ALA . 30926 1 93 . ASN . 30926 1 94 . VAL . 30926 1 95 . ILE . 30926 1 96 . VAL . 30926 1 97 . ASP . 30926 1 98 . ASN . 30926 1 99 . ARG . 30926 1 100 . LEU . 30926 1 101 . ALA . 30926 1 102 . HIS . 30926 1 103 . PHE . 30926 1 104 . VAL . 30926 1 105 . VAL . 30926 1 106 . ILE . 30926 1 107 . TYR . 30926 1 108 . SER . 30926 1 109 . ILE . 30926 1 110 . LYS . 30926 1 111 . ASN . 30926 1 112 . ARG . 30926 1 113 . ILE . 30926 1 114 . ILE . 30926 1 115 . THR . 30926 1 116 . VAL . 30926 1 117 . ALA . 30926 1 118 . ASP . 30926 1 119 . PRO . 30926 1 120 . GLY . 30926 1 121 . LYS . 30926 1 122 . GLY . 30926 1 123 . ILE . 30926 1 124 . VAL . 30926 1 125 . ARG . 30926 1 126 . TYR . 30926 1 127 . SER . 30926 1 128 . MET . 30926 1 129 . ASP . 30926 1 130 . ASP . 30926 1 131 . PHE . 30926 1 132 . CYS . 30926 1 133 . SER . 30926 1 134 . ILE . 30926 1 135 . TRP . 30926 1 136 . THR . 30926 1 137 . GLY . 30926 1 138 . GLY . 30926 1 139 . LEU . 30926 1 140 . VAL . 30926 1 141 . LEU . 30926 1 142 . LEU . 30926 1 143 . GLU . 30926 1 144 . PRO . 30926 1 145 . GLY . 30926 1 146 . GLU . 30926 1 147 . ALA . 30926 1 148 . PHE . 30926 1 149 . GLN . 30926 1 150 . LYS . 30926 1 151 . GLY . 30926 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . SER 1 1 30926 1 . ASN 2 2 30926 1 . ALA 3 3 30926 1 . MET 4 4 30926 1 . LEU 5 5 30926 1 . ARG 6 6 30926 1 . ARG 7 7 30926 1 . LEU 8 8 30926 1 . PHE 9 9 30926 1 . LYS 10 10 30926 1 . LYS 11 11 30926 1 . LYS 12 12 30926 1 . TYR 13 13 30926 1 . VAL 14 14 30926 1 . CYS 15 15 30926 1 . VAL 16 16 30926 1 . ARG 17 17 30926 1 . GLN 18 18 30926 1 . TYR 19 19 30926 1 . ASP 20 20 30926 1 . LEU 21 21 30926 1 . THR 22 22 30926 1 . ASP 23 23 30926 1 . ALA 24 24 30926 1 . GLY 25 25 30926 1 . ALA 26 26 30926 1 . ALA 27 27 30926 1 . CYS 28 28 30926 1 . LEU 29 29 30926 1 . SER 30 30 30926 1 . SER 31 31 30926 1 . ILE 32 32 30926 1 . ALA 33 33 30926 1 . GLN 34 34 30926 1 . TYR 35 35 30926 1 . TYR 36 36 30926 1 . GLY 37 37 30926 1 . LEU 38 38 30926 1 . LYS 39 39 30926 1 . MET 40 40 30926 1 . SER 41 41 30926 1 . LEU 42 42 30926 1 . ALA 43 43 30926 1 . LYS 44 44 30926 1 . ILE 45 45 30926 1 . ARG 46 46 30926 1 . GLU 47 47 30926 1 . MET 48 48 30926 1 . THR 49 49 30926 1 . GLY 50 50 30926 1 . THR 51 51 30926 1 . ASP 52 52 30926 1 . THR 53 53 30926 1 . GLN 54 54 30926 1 . GLY 55 55 30926 1 . THR 56 56 30926 1 . ASN 57 57 30926 1 . ALA 58 58 30926 1 . TYR 59 59 30926 1 . GLY 60 60 30926 1 . LEU 61 61 30926 1 . ILE 62 62 30926 1 . HIS 63 63 30926 1 . ALA 64 64 30926 1 . ALA 65 65 30926 1 . LYS 66 66 30926 1 . GLN 67 67 30926 1 . LEU 68 68 30926 1 . GLY 69 69 30926 1 . PHE 70 70 30926 1 . SER 71 71 30926 1 . ALA 72 72 30926 1 . LYS 73 73 30926 1 . GLY 74 74 30926 1 . VAL 75 75 30926 1 . LYS 76 76 30926 1 . ALA 77 77 30926 1 . SER 78 78 30926 1 . LYS 79 79 30926 1 . GLU 80 80 30926 1 . ASP 81 81 30926 1 . LEU 82 82 30926 1 . LEU 83 83 30926 1 . LYS 84 84 30926 1 . ASP 85 85 30926 1 . PHE 86 86 30926 1 . ARG 87 87 30926 1 . LEU 88 88 30926 1 . PRO 89 89 30926 1 . ALA 90 90 30926 1 . ILE 91 91 30926 1 . ALA 92 92 30926 1 . ASN 93 93 30926 1 . VAL 94 94 30926 1 . ILE 95 95 30926 1 . VAL 96 96 30926 1 . ASP 97 97 30926 1 . ASN 98 98 30926 1 . ARG 99 99 30926 1 . LEU 100 100 30926 1 . ALA 101 101 30926 1 . HIS 102 102 30926 1 . PHE 103 103 30926 1 . VAL 104 104 30926 1 . VAL 105 105 30926 1 . ILE 106 106 30926 1 . TYR 107 107 30926 1 . SER 108 108 30926 1 . ILE 109 109 30926 1 . LYS 110 110 30926 1 . ASN 111 111 30926 1 . ARG 112 112 30926 1 . ILE 113 113 30926 1 . ILE 114 114 30926 1 . THR 115 115 30926 1 . VAL 116 116 30926 1 . ALA 117 117 30926 1 . ASP 118 118 30926 1 . PRO 119 119 30926 1 . GLY 120 120 30926 1 . LYS 121 121 30926 1 . GLY 122 122 30926 1 . ILE 123 123 30926 1 . VAL 124 124 30926 1 . ARG 125 125 30926 1 . TYR 126 126 30926 1 . SER 127 127 30926 1 . MET 128 128 30926 1 . ASP 129 129 30926 1 . ASP 130 130 30926 1 . PHE 131 131 30926 1 . CYS 132 132 30926 1 . SER 133 133 30926 1 . ILE 134 134 30926 1 . TRP 135 135 30926 1 . THR 136 136 30926 1 . GLY 137 137 30926 1 . GLY 138 138 30926 1 . LEU 139 139 30926 1 . VAL 140 140 30926 1 . LEU 141 141 30926 1 . LEU 142 142 30926 1 . GLU 143 143 30926 1 . PRO 144 144 30926 1 . GLY 145 145 30926 1 . GLU 146 146 30926 1 . ALA 147 147 30926 1 . PHE 148 148 30926 1 . GLN 149 149 30926 1 . LYS 150 150 30926 1 . GLY 151 151 30926 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 30926 _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 . 203119 organism . 'Hungateiclostridium thermocellum' 'Clostridium thermocellum' . . Bacteria . Clostridium thermocellum 'ATCC 27405 / DSM 1237 / JCM 9322 / NBRC 103400 / NCIMB 10682 / NRRL B-4536 / VPI 7372' . . . . . . . . . . Cthe_0534 '(strain ATCC 27405 / DSM 1237 / JCM 9322 / NBRC 103400 / NCIMB 10682 / NRRL B-4536 / VPI 7372)' 30926 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source _Entity_experimental_src_list.Entry_ID 30926 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'recombinant technology' 'Escherichia coli' . . 562 Escherichia coli 'BL21-CODONPLUS(DE3) RIL' . . PLASMID . . pMSCG20 . . . 30926 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 30926 _Sample.ID 1 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details ; 675 uM [U-100% 13C; U-100% 15N] C39 peptidase domain, 50 uM sodium phosphate, 150 uM sodium chloride, 5 mM DTT, 50 mM PBS buffer, 95% H2O/5% D2O ; _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'C39 peptidase domain' '[U-100% 13C; U-100% 15N]' . . 1 $entity_1 . . 675 . . uM . . . . 30926 1 2 'sodium phosphate' 'natural abundance' . . . . . . 50 . . uM . . . . 30926 1 3 'sodium chloride' 'natural abundance' . . . . . . 150 . . uM . . . . 30926 1 4 DTT 'natural abundance' . . . . . . 5 . . mM . . . . 30926 1 5 'PBS buffer' 'natural abundance' . . . . . . 50 . . mM . . . . 30926 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 30926 _Sample_condition_list.ID 1 _Sample_condition_list.Name . _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 150 . mM 30926 1 pH 7.0 . pH 30926 1 pressure 1 . atm 30926 1 temperature 288 . K 30926 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 30926 _Software.ID 1 _Software.Type . _Software.Name TopSpin _Software.Version '2.1, 3.5' _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 30926 1 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID collection . 30926 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 30926 _Software.ID 2 _Software.Type . _Software.Name TopSpin _Software.Version '2.1, 3.6' _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 30926 2 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID processing . 30926 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 30926 _Software.ID 3 _Software.Type . _Software.Name CARA _Software.Version 1.5 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Keller and Wuthrich' . . 30926 3 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 30926 3 'peak picking' . 30926 3 stop_ save_ save_software_4 _Software.Sf_category software _Software.Sf_framecode software_4 _Software.Entry_ID 30926 _Software.ID 4 _Software.Type . _Software.Name CYANA _Software.Version 2.1 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . 30926 4 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'structure calculation' . 30926 4 stop_ save_ save_software_5 _Software.Sf_category software _Software.Sf_framecode software_5 _Software.Entry_ID 30926 _Software.ID 5 _Software.Type . _Software.Name ARIA _Software.Version 2.3 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID "Linge, O'Donoghue and Nilges" . . 30926 5 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID refinement . 30926 5 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 30926 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name . _NMR_spectrometer.Details 'TCI CryoProbe' _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model AVANCE _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 900.03 save_ save_NMR_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_2 _NMR_spectrometer.Entry_ID 30926 _NMR_spectrometer.ID 2 _NMR_spectrometer.Name . _NMR_spectrometer.Details 'TCI CryoProbe' _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE III HD' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800.23 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 30926 _NMR_spectrometer_list.ID 1 _NMR_spectrometer_list.Name . loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 NMR_spectrometer_1 Bruker AVANCE . 900.03 . . . 30926 1 2 NMR_spectrometer_2 Bruker 'AVANCE III HD' . 800.23 . . . 30926 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 30926 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NUS_flag _Experiment.Interleaved_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Details _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 30926 1 2 '2D 1H-13C HSQC aliphatic' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 30926 1 3 '2D 1H-13C HSQC aromatic' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 30926 1 4 '3D HNCO' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 30926 1 5 '3D HNCA' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 30926 1 6 '3D HCCH-TOCSY' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 30926 1 7 '3D HBHA(CO)NH' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 30926 1 8 '3D HN(CO)CA' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 30926 1 9 '3D HNCACB' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 30926 1 10 '3D CBCA(CO)NH' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 30926 1 11 '3D H(CCO)NH' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 30926 1 12 '3D C(CO)NH' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 30926 1 13 '3D 1H-13C NOESY aromatic' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 30926 1 14 '3D 1H-13C NOESY aliphatic' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 30926 1 15 '3D 1H-15N NOESY' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 30926 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 30926 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name . _Chem_shift_reference.Details '1H, 13C, 15N indirectly referenced to DSS using IUPAC-IUB recommended ratios.' 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 na indirect 0.251449530 . . . . . 30926 1 H 1 DSS 'methyl protons' . . . . ppm 0 internal direct 1 . . . . . 30926 1 N 15 DSS 'methyl protons' . . . . ppm 0 na indirect 0.101329118 . . . . . 30926 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 30926 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 30926 1 2 '2D 1H-13C HSQC aliphatic' . . . 30926 1 3 '2D 1H-13C HSQC aromatic' . . . 30926 1 4 '3D HNCO' . . . 30926 1 5 '3D HNCA' . . . 30926 1 6 '3D HCCH-TOCSY' . . . 30926 1 7 '3D HBHA(CO)NH' . . . 30926 1 8 '3D HN(CO)CA' . . . 30926 1 9 '3D HNCACB' . . . 30926 1 10 '3D CBCA(CO)NH' . . . 30926 1 11 '3D H(CCO)NH' . . . 30926 1 12 '3D C(CO)NH' . . . 30926 1 13 '3D 1H-13C NOESY aromatic' . . . 30926 1 14 '3D 1H-13C NOESY aliphatic' . . . 30926 1 15 '3D 1H-15N NOESY' . . . 30926 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 2 2 ASN HA H 1 4.663 0.05 . 1 . . . . A 2 ASN HA . 30926 1 2 . 1 . 1 2 2 ASN HB2 H 1 2.797 0.05 . 2 . . . . A 2 ASN HB2 . 30926 1 3 . 1 . 1 2 2 ASN HB3 H 1 2.746 0.05 . 2 . . . . A 2 ASN HB3 . 30926 1 4 . 1 . 1 2 2 ASN HD21 H 1 6.935 0.05 . 2 . . . . A 2 ASN HD21 . 30926 1 5 . 1 . 1 2 2 ASN HD22 H 1 7.654 0.05 . 2 . . . . A 2 ASN HD22 . 30926 1 6 . 1 . 1 2 2 ASN C C 13 175.290 0.50 . 1 . . . . A 2 ASN C . 30926 1 7 . 1 . 1 2 2 ASN CA C 13 53.283 0.50 . 1 . . . . A 2 ASN CA . 30926 1 8 . 1 . 1 2 2 ASN CB C 13 38.788 0.50 . 1 . . . . A 2 ASN CB . 30926 1 9 . 1 . 1 2 2 ASN ND2 N 15 113.175 0.10 . 1 . . . . A 2 ASN ND2 . 30926 1 10 . 1 . 1 3 3 ALA H H 1 8.472 0.05 . 1 . . . . A 3 ALA H . 30926 1 11 . 1 . 1 3 3 ALA HA H 1 4.117 0.05 . 1 . . . . A 3 ALA HA . 30926 1 12 . 1 . 1 3 3 ALA HB1 H 1 1.317 0.05 . 1 . . . . A 3 ALA HB1 . 30926 1 13 . 1 . 1 3 3 ALA HB2 H 1 1.317 0.05 . 1 . . . . A 3 ALA HB2 . 30926 1 14 . 1 . 1 3 3 ALA HB3 H 1 1.317 0.05 . 1 . . . . A 3 ALA HB3 . 30926 1 15 . 1 . 1 3 3 ALA C C 13 178.224 0.50 . 1 . . . . A 3 ALA C . 30926 1 16 . 1 . 1 3 3 ALA CA C 13 53.487 0.50 . 1 . . . . A 3 ALA CA . 30926 1 17 . 1 . 1 3 3 ALA CB C 13 18.839 0.50 . 1 . . . . A 3 ALA CB . 30926 1 18 . 1 . 1 3 3 ALA N N 15 124.800 0.10 . 1 . . . . A 3 ALA N . 30926 1 19 . 1 . 1 4 4 MET H H 1 8.216 0.05 . 1 . . . . A 4 MET H . 30926 1 20 . 1 . 1 4 4 MET HA H 1 4.286 0.05 . 1 . . . . A 4 MET HA . 30926 1 21 . 1 . 1 4 4 MET HB2 H 1 1.996 0.05 . 2 . . . . A 4 MET HB2 . 30926 1 22 . 1 . 1 4 4 MET HB3 H 1 1.996 0.05 . 2 . . . . A 4 MET HB3 . 30926 1 23 . 1 . 1 4 4 MET HG2 H 1 2.446 0.05 . 2 . . . . A 4 MET HG2 . 30926 1 24 . 1 . 1 4 4 MET HG3 H 1 2.533 0.05 . 2 . . . . A 4 MET HG3 . 30926 1 25 . 1 . 1 4 4 MET CA C 13 56.055 0.50 . 1 . . . . A 4 MET CA . 30926 1 26 . 1 . 1 4 4 MET CB C 13 32.153 0.50 . 1 . . . . A 4 MET CB . 30926 1 27 . 1 . 1 4 4 MET CG C 13 32.079 0.50 . 1 . . . . A 4 MET CG . 30926 1 28 . 1 . 1 4 4 MET N N 15 118.436 0.10 . 1 . . . . A 4 MET N . 30926 1 29 . 1 . 1 5 5 LEU H H 1 7.990 0.05 . 1 . . . . A 5 LEU H . 30926 1 30 . 1 . 1 5 5 LEU HA H 1 4.175 0.05 . 1 . . . . A 5 LEU HA . 30926 1 31 . 1 . 1 5 5 LEU HB2 H 1 1.505 0.05 . 2 . . . . A 5 LEU HB2 . 30926 1 32 . 1 . 1 5 5 LEU HB3 H 1 1.604 0.05 . 2 . . . . A 5 LEU HB3 . 30926 1 33 . 1 . 1 5 5 LEU HG H 1 1.548 0.05 . 1 . . . . A 5 LEU HG . 30926 1 34 . 1 . 1 5 5 LEU HD11 H 1 0.856 0.05 . 2 . . . . A 5 LEU HD11 . 30926 1 35 . 1 . 1 5 5 LEU HD12 H 1 0.856 0.05 . 2 . . . . A 5 LEU HD12 . 30926 1 36 . 1 . 1 5 5 LEU HD13 H 1 0.856 0.05 . 2 . . . . A 5 LEU HD13 . 30926 1 37 . 1 . 1 5 5 LEU HD21 H 1 0.792 0.05 . 2 . . . . A 5 LEU HD21 . 30926 1 38 . 1 . 1 5 5 LEU HD22 H 1 0.792 0.05 . 2 . . . . A 5 LEU HD22 . 30926 1 39 . 1 . 1 5 5 LEU HD23 H 1 0.792 0.05 . 2 . . . . A 5 LEU HD23 . 30926 1 40 . 1 . 1 5 5 LEU C C 13 177.567 0.50 . 1 . . . . A 5 LEU C . 30926 1 41 . 1 . 1 5 5 LEU CA C 13 55.679 0.50 . 1 . . . . A 5 LEU CA . 30926 1 42 . 1 . 1 5 5 LEU CB C 13 41.957 0.50 . 1 . . . . A 5 LEU CB . 30926 1 43 . 1 . 1 5 5 LEU CG C 13 26.821 0.50 . 1 . . . . A 5 LEU CG . 30926 1 44 . 1 . 1 5 5 LEU CD1 C 13 24.924 0.50 . 2 . . . . A 5 LEU CD1 . 30926 1 45 . 1 . 1 5 5 LEU CD2 C 13 23.513 0.50 . 2 . . . . A 5 LEU CD2 . 30926 1 46 . 1 . 1 6 6 ARG H H 1 8.103 0.05 . 1 . . . . A 6 ARG H . 30926 1 47 . 1 . 1 6 6 ARG HA H 1 4.144 0.05 . 1 . . . . A 6 ARG HA . 30926 1 48 . 1 . 1 6 6 ARG HB2 H 1 1.699 0.05 . 2 . . . . A 6 ARG HB2 . 30926 1 49 . 1 . 1 6 6 ARG HB3 H 1 1.764 0.05 . 2 . . . . A 6 ARG HB3 . 30926 1 50 . 1 . 1 6 6 ARG HG2 H 1 1.466 0.05 . 2 . . . . A 6 ARG HG2 . 30926 1 51 . 1 . 1 6 6 ARG HG3 H 1 1.532 0.05 . 2 . . . . A 6 ARG HG3 . 30926 1 52 . 1 . 1 6 6 ARG HD2 H 1 3.098 0.05 . 2 . . . . A 6 ARG HD2 . 30926 1 53 . 1 . 1 6 6 ARG HD3 H 1 3.098 0.05 . 2 . . . . A 6 ARG HD3 . 30926 1 54 . 1 . 1 6 6 ARG C C 13 176.528 0.50 . 1 . . . . A 6 ARG C . 30926 1 55 . 1 . 1 6 6 ARG CA C 13 56.492 0.50 . 1 . . . . A 6 ARG CA . 30926 1 56 . 1 . 1 6 6 ARG CB C 13 30.362 0.50 . 1 . . . . A 6 ARG CB . 30926 1 57 . 1 . 1 6 6 ARG CG C 13 26.931 0.50 . 1 . . . . A 6 ARG CG . 30926 1 58 . 1 . 1 6 6 ARG CD C 13 43.239 0.50 . 1 . . . . A 6 ARG CD . 30926 1 59 . 1 . 1 6 6 ARG N N 15 120.896 0.10 . 1 . . . . A 6 ARG N . 30926 1 60 . 1 . 1 7 7 ARG H H 1 8.096 0.05 . 1 . . . . A 7 ARG H . 30926 1 61 . 1 . 1 7 7 ARG HA H 1 4.128 0.05 . 1 . . . . A 7 ARG HA . 30926 1 62 . 1 . 1 7 7 ARG HB2 H 1 1.671 0.05 . 2 . . . . A 7 ARG HB2 . 30926 1 63 . 1 . 1 7 7 ARG HB3 H 1 1.671 0.05 . 2 . . . . A 7 ARG HB3 . 30926 1 64 . 1 . 1 7 7 ARG HG2 H 1 1.531 0.05 . 2 . . . . A 7 ARG HG2 . 30926 1 65 . 1 . 1 7 7 ARG HG3 H 1 1.531 0.05 . 2 . . . . A 7 ARG HG3 . 30926 1 66 . 1 . 1 7 7 ARG HD2 H 1 3.088 0.05 . 2 . . . . A 7 ARG HD2 . 30926 1 67 . 1 . 1 7 7 ARG HD3 H 1 3.088 0.05 . 2 . . . . A 7 ARG HD3 . 30926 1 68 . 1 . 1 7 7 ARG CA C 13 56.650 0.50 . 1 . . . . A 7 ARG CA . 30926 1 69 . 1 . 1 7 7 ARG CB C 13 30.674 0.50 . 1 . . . . A 7 ARG CB . 30926 1 70 . 1 . 1 7 7 ARG CG C 13 27.389 0.50 . 1 . . . . A 7 ARG CG . 30926 1 71 . 1 . 1 7 7 ARG CD C 13 43.397 0.50 . 1 . . . . A 7 ARG CD . 30926 1 72 . 1 . 1 7 7 ARG N N 15 121.100 0.10 . 1 . . . . A 7 ARG N . 30926 1 73 . 1 . 1 8 8 LEU H H 1 8.037 0.05 . 1 . . . . A 8 LEU H . 30926 1 74 . 1 . 1 8 8 LEU HA H 1 4.179 0.05 . 1 . . . . A 8 LEU HA . 30926 1 75 . 1 . 1 8 8 LEU HB2 H 1 1.357 0.05 . 2 . . . . A 8 LEU HB2 . 30926 1 76 . 1 . 1 8 8 LEU HB3 H 1 1.501 0.05 . 2 . . . . A 8 LEU HB3 . 30926 1 77 . 1 . 1 8 8 LEU HG H 1 1.462 0.05 . 1 . . . . A 8 LEU HG . 30926 1 78 . 1 . 1 8 8 LEU HD11 H 1 0.704 0.05 . 2 . . . . A 8 LEU HD11 . 30926 1 79 . 1 . 1 8 8 LEU HD12 H 1 0.704 0.05 . 2 . . . . A 8 LEU HD12 . 30926 1 80 . 1 . 1 8 8 LEU HD13 H 1 0.704 0.05 . 2 . . . . A 8 LEU HD13 . 30926 1 81 . 1 . 1 8 8 LEU HD21 H 1 0.792 0.05 . 2 . . . . A 8 LEU HD21 . 30926 1 82 . 1 . 1 8 8 LEU HD22 H 1 0.792 0.05 . 2 . . . . A 8 LEU HD22 . 30926 1 83 . 1 . 1 8 8 LEU HD23 H 1 0.792 0.05 . 2 . . . . A 8 LEU HD23 . 30926 1 84 . 1 . 1 8 8 LEU C C 13 176.903 0.50 . 1 . . . . A 8 LEU C . 30926 1 85 . 1 . 1 8 8 LEU CA C 13 55.483 0.50 . 1 . . . . A 8 LEU CA . 30926 1 86 . 1 . 1 8 8 LEU CB C 13 42.144 0.50 . 1 . . . . A 8 LEU CB . 30926 1 87 . 1 . 1 8 8 LEU CG C 13 27.019 0.50 . 1 . . . . A 8 LEU CG . 30926 1 88 . 1 . 1 8 8 LEU CD1 C 13 23.317 0.50 . 2 . . . . A 8 LEU CD1 . 30926 1 89 . 1 . 1 8 8 LEU CD2 C 13 24.898 0.50 . 2 . . . . A 8 LEU CD2 . 30926 1 90 . 1 . 1 8 8 LEU N N 15 122.296 0.10 . 1 . . . . A 8 LEU N . 30926 1 91 . 1 . 1 9 9 PHE H H 1 8.007 0.05 . 1 . . . . A 9 PHE H . 30926 1 92 . 1 . 1 9 9 PHE HA H 1 4.488 0.05 . 1 . . . . A 9 PHE HA . 30926 1 93 . 1 . 1 9 9 PHE HB2 H 1 2.911 0.05 . 2 . . . . A 9 PHE HB2 . 30926 1 94 . 1 . 1 9 9 PHE HB3 H 1 3.001 0.05 . 2 . . . . A 9 PHE HB3 . 30926 1 95 . 1 . 1 9 9 PHE HD1 H 1 7.121 0.05 . 3 . . . . A 9 PHE HD1 . 30926 1 96 . 1 . 1 9 9 PHE HD2 H 1 7.121 0.05 . 3 . . . . A 9 PHE HD2 . 30926 1 97 . 1 . 1 9 9 PHE HE1 H 1 7.198 0.05 . 3 . . . . A 9 PHE HE1 . 30926 1 98 . 1 . 1 9 9 PHE HE2 H 1 7.198 0.05 . 3 . . . . A 9 PHE HE2 . 30926 1 99 . 1 . 1 9 9 PHE C C 13 175.388 0.50 . 1 . . . . A 9 PHE C . 30926 1 100 . 1 . 1 9 9 PHE CA C 13 57.461 0.50 . 1 . . . . A 9 PHE CA . 30926 1 101 . 1 . 1 9 9 PHE CB C 13 39.381 0.50 . 1 . . . . A 9 PHE CB . 30926 1 102 . 1 . 1 9 9 PHE CD1 C 13 131.583 0.50 . 3 . . . . A 9 PHE CD1 . 30926 1 103 . 1 . 1 9 9 PHE CE1 C 13 131.609 0.50 . 3 . . . . A 9 PHE CE1 . 30926 1 104 . 1 . 1 9 9 PHE N N 15 120.507 0.10 . 1 . . . . A 9 PHE N . 30926 1 105 . 1 . 1 10 10 LYS H H 1 8.028 0.05 . 1 . . . . A 10 LYS H . 30926 1 106 . 1 . 1 10 10 LYS HA H 1 4.058 0.05 . 1 . . . . A 10 LYS HA . 30926 1 107 . 1 . 1 10 10 LYS HB2 H 1 1.526 0.05 . 2 . . . . A 10 LYS HB2 . 30926 1 108 . 1 . 1 10 10 LYS HB3 H 1 1.632 0.05 . 2 . . . . A 10 LYS HB3 . 30926 1 109 . 1 . 1 10 10 LYS HG2 H 1 1.184 0.05 . 2 . . . . A 10 LYS HG2 . 30926 1 110 . 1 . 1 10 10 LYS HG3 H 1 1.232 0.05 . 2 . . . . A 10 LYS HG3 . 30926 1 111 . 1 . 1 10 10 LYS HD2 H 1 1.631 0.05 . 2 . . . . A 10 LYS HD2 . 30926 1 112 . 1 . 1 10 10 LYS HD3 H 1 1.626 0.05 . 2 . . . . A 10 LYS HD3 . 30926 1 113 . 1 . 1 10 10 LYS HE2 H 1 2.845 0.05 . 2 . . . . A 10 LYS HE2 . 30926 1 114 . 1 . 1 10 10 LYS HE3 H 1 2.845 0.05 . 2 . . . . A 10 LYS HE3 . 30926 1 115 . 1 . 1 10 10 LYS CA C 13 56.159 0.50 . 1 . . . . A 10 LYS CA . 30926 1 116 . 1 . 1 10 10 LYS CB C 13 32.764 0.50 . 1 . . . . A 10 LYS CB . 30926 1 117 . 1 . 1 10 10 LYS CG C 13 24.627 0.50 . 1 . . . . A 10 LYS CG . 30926 1 118 . 1 . 1 10 10 LYS CD C 13 29.099 0.50 . 1 . . . . A 10 LYS CD . 30926 1 119 . 1 . 1 10 10 LYS CE C 13 41.625 0.50 . 1 . . . . A 10 LYS CE . 30926 1 120 . 1 . 1 10 10 LYS N N 15 122.641 0.10 . 1 . . . . A 10 LYS N . 30926 1 121 . 1 . 1 11 11 LYS H H 1 8.055 0.05 . 1 . . . . A 11 LYS H . 30926 1 122 . 1 . 1 11 11 LYS HA H 1 4.008 0.05 . 1 . . . . A 11 LYS HA . 30926 1 123 . 1 . 1 11 11 LYS HB2 H 1 1.508 0.05 . 2 . . . . A 11 LYS HB2 . 30926 1 124 . 1 . 1 11 11 LYS HB3 H 1 1.508 0.05 . 2 . . . . A 11 LYS HB3 . 30926 1 125 . 1 . 1 11 11 LYS HG2 H 1 1.223 0.05 . 2 . . . . A 11 LYS HG2 . 30926 1 126 . 1 . 1 11 11 LYS HG3 H 1 1.294 0.05 . 2 . . . . A 11 LYS HG3 . 30926 1 127 . 1 . 1 11 11 LYS HD2 H 1 1.508 0.05 . 2 . . . . A 11 LYS HD2 . 30926 1 128 . 1 . 1 11 11 LYS HD3 H 1 1.508 0.05 . 2 . . . . A 11 LYS HD3 . 30926 1 129 . 1 . 1 11 11 LYS HE2 H 1 2.715 0.05 . 2 . . . . A 11 LYS HE2 . 30926 1 130 . 1 . 1 11 11 LYS HE3 H 1 2.746 0.05 . 2 . . . . A 11 LYS HE3 . 30926 1 131 . 1 . 1 11 11 LYS CA C 13 56.253 0.50 . 1 . . . . A 11 LYS CA . 30926 1 132 . 1 . 1 11 11 LYS CB C 13 32.710 0.50 . 1 . . . . A 11 LYS CB . 30926 1 133 . 1 . 1 11 11 LYS CG C 13 24.625 0.50 . 1 . . . . A 11 LYS CG . 30926 1 134 . 1 . 1 11 11 LYS CD C 13 29.056 0.50 . 1 . . . . A 11 LYS CD . 30926 1 135 . 1 . 1 11 11 LYS CE C 13 41.565 0.50 . 1 . . . . A 11 LYS CE . 30926 1 136 . 1 . 1 11 11 LYS N N 15 122.675 0.10 . 1 . . . . A 11 LYS N . 30926 1 137 . 1 . 1 12 12 LYS H H 1 7.955 0.05 . 1 . . . . A 12 LYS H . 30926 1 138 . 1 . 1 12 12 LYS HA H 1 3.933 0.05 . 1 . . . . A 12 LYS HA . 30926 1 139 . 1 . 1 12 12 LYS HB2 H 1 1.527 0.05 . 2 . . . . A 12 LYS HB2 . 30926 1 140 . 1 . 1 12 12 LYS HB3 H 1 1.524 0.05 . 2 . . . . A 12 LYS HB3 . 30926 1 141 . 1 . 1 12 12 LYS HG2 H 1 1.150 0.05 . 2 . . . . A 12 LYS HG2 . 30926 1 142 . 1 . 1 12 12 LYS HG3 H 1 1.209 0.05 . 2 . . . . A 12 LYS HG3 . 30926 1 143 . 1 . 1 12 12 LYS HD2 H 1 1.503 0.05 . 2 . . . . A 12 LYS HD2 . 30926 1 144 . 1 . 1 12 12 LYS HD3 H 1 1.503 0.05 . 2 . . . . A 12 LYS HD3 . 30926 1 145 . 1 . 1 12 12 LYS HE2 H 1 2.841 0.05 . 2 . . . . A 12 LYS HE2 . 30926 1 146 . 1 . 1 12 12 LYS HE3 H 1 2.841 0.05 . 2 . . . . A 12 LYS HE3 . 30926 1 147 . 1 . 1 12 12 LYS C C 13 176.023 0.50 . 1 . . . . A 12 LYS C . 30926 1 148 . 1 . 1 12 12 LYS CA C 13 55.754 0.50 . 1 . . . . A 12 LYS CA . 30926 1 149 . 1 . 1 12 12 LYS CB C 13 32.901 0.50 . 1 . . . . A 12 LYS CB . 30926 1 150 . 1 . 1 12 12 LYS CG C 13 24.627 0.50 . 1 . . . . A 12 LYS CG . 30926 1 151 . 1 . 1 12 12 LYS CD C 13 29.048 0.50 . 1 . . . . A 12 LYS CD . 30926 1 152 . 1 . 1 12 12 LYS CE C 13 42.106 0.50 . 1 . . . . A 12 LYS CE . 30926 1 153 . 1 . 1 12 12 LYS N N 15 122.345 0.10 . 1 . . . . A 12 LYS N . 30926 1 154 . 1 . 1 13 13 TYR H H 1 7.669 0.05 . 1 . . . . A 13 TYR H . 30926 1 155 . 1 . 1 13 13 TYR HA H 1 3.837 0.05 . 1 . . . . A 13 TYR HA . 30926 1 156 . 1 . 1 13 13 TYR HB2 H 1 2.302 0.05 . 2 . . . . A 13 TYR HB2 . 30926 1 157 . 1 . 1 13 13 TYR HB3 H 1 2.302 0.05 . 2 . . . . A 13 TYR HB3 . 30926 1 158 . 1 . 1 13 13 TYR HD1 H 1 6.364 0.05 . 3 . . . . A 13 TYR HD1 . 30926 1 159 . 1 . 1 13 13 TYR HD2 H 1 6.376 0.05 . 3 . . . . A 13 TYR HD2 . 30926 1 160 . 1 . 1 13 13 TYR HE1 H 1 6.623 0.05 . 3 . . . . A 13 TYR HE1 . 30926 1 161 . 1 . 1 13 13 TYR HE2 H 1 6.633 0.05 . 3 . . . . A 13 TYR HE2 . 30926 1 162 . 1 . 1 13 13 TYR CA C 13 54.869 0.50 . 1 . . . . A 13 TYR CA . 30926 1 163 . 1 . 1 13 13 TYR CB C 13 36.087 0.50 . 1 . . . . A 13 TYR CB . 30926 1 164 . 1 . 1 13 13 TYR CD1 C 13 131.893 0.50 . 3 . . . . A 13 TYR CD1 . 30926 1 165 . 1 . 1 13 13 TYR CE1 C 13 117.434 0.50 . 3 . . . . A 13 TYR CE1 . 30926 1 166 . 1 . 1 13 13 TYR N N 15 121.038 0.10 . 1 . . . . A 13 TYR N . 30926 1 167 . 1 . 1 14 14 VAL H H 1 6.707 0.05 . 1 . . . . A 14 VAL H . 30926 1 168 . 1 . 1 14 14 VAL HA H 1 3.953 0.05 . 1 . . . . A 14 VAL HA . 30926 1 169 . 1 . 1 14 14 VAL HB H 1 2.114 0.05 . 1 . . . . A 14 VAL HB . 30926 1 170 . 1 . 1 14 14 VAL HG11 H 1 0.975 0.05 . 2 . . . . A 14 VAL HG11 . 30926 1 171 . 1 . 1 14 14 VAL HG12 H 1 0.975 0.05 . 2 . . . . A 14 VAL HG12 . 30926 1 172 . 1 . 1 14 14 VAL HG13 H 1 0.975 0.05 . 2 . . . . A 14 VAL HG13 . 30926 1 173 . 1 . 1 14 14 VAL HG21 H 1 0.942 0.05 . 2 . . . . A 14 VAL HG21 . 30926 1 174 . 1 . 1 14 14 VAL HG22 H 1 0.942 0.05 . 2 . . . . A 14 VAL HG22 . 30926 1 175 . 1 . 1 14 14 VAL HG23 H 1 0.942 0.05 . 2 . . . . A 14 VAL HG23 . 30926 1 176 . 1 . 1 14 14 VAL CA C 13 62.092 0.50 . 1 . . . . A 14 VAL CA . 30926 1 177 . 1 . 1 14 14 VAL CB C 13 33.310 0.50 . 1 . . . . A 14 VAL CB . 30926 1 178 . 1 . 1 14 14 VAL CG1 C 13 21.018 0.50 . 2 . . . . A 14 VAL CG1 . 30926 1 179 . 1 . 1 14 14 VAL CG2 C 13 21.959 0.50 . 2 . . . . A 14 VAL CG2 . 30926 1 180 . 1 . 1 14 14 VAL N N 15 121.493 0.10 . 1 . . . . A 14 VAL N . 30926 1 181 . 1 . 1 15 15 CYS HA H 1 4.610 0.05 . 1 . . . . A 15 CYS HA . 30926 1 182 . 1 . 1 15 15 CYS CA C 13 56.788 0.50 . 1 . . . . A 15 CYS CA . 30926 1 183 . 1 . 1 16 16 VAL H H 1 8.366 0.05 . 1 . . . . A 16 VAL H . 30926 1 184 . 1 . 1 16 16 VAL HA H 1 3.801 0.05 . 1 . . . . A 16 VAL HA . 30926 1 185 . 1 . 1 16 16 VAL HB H 1 2.030 0.05 . 1 . . . . A 16 VAL HB . 30926 1 186 . 1 . 1 16 16 VAL HG11 H 1 0.841 0.05 . 2 . . . . A 16 VAL HG11 . 30926 1 187 . 1 . 1 16 16 VAL HG12 H 1 0.841 0.05 . 2 . . . . A 16 VAL HG12 . 30926 1 188 . 1 . 1 16 16 VAL HG13 H 1 0.841 0.05 . 2 . . . . A 16 VAL HG13 . 30926 1 189 . 1 . 1 16 16 VAL HG21 H 1 0.936 0.05 . 2 . . . . A 16 VAL HG21 . 30926 1 190 . 1 . 1 16 16 VAL HG22 H 1 0.936 0.05 . 2 . . . . A 16 VAL HG22 . 30926 1 191 . 1 . 1 16 16 VAL HG23 H 1 0.936 0.05 . 2 . . . . A 16 VAL HG23 . 30926 1 192 . 1 . 1 16 16 VAL C C 13 175.312 0.50 . 1 . . . . A 16 VAL C . 30926 1 193 . 1 . 1 16 16 VAL CA C 13 63.074 0.50 . 1 . . . . A 16 VAL CA . 30926 1 194 . 1 . 1 16 16 VAL CB C 13 31.241 0.50 . 1 . . . . A 16 VAL CB . 30926 1 195 . 1 . 1 16 16 VAL CG1 C 13 21.473 0.50 . 2 . . . . A 16 VAL CG1 . 30926 1 196 . 1 . 1 16 16 VAL CG2 C 13 21.497 0.50 . 2 . . . . A 16 VAL CG2 . 30926 1 197 . 1 . 1 16 16 VAL N N 15 131.496 0.10 . 1 . . . . A 16 VAL N . 30926 1 198 . 1 . 1 17 17 ARG H H 1 8.279 0.05 . 1 . . . . A 17 ARG H . 30926 1 199 . 1 . 1 17 17 ARG HA H 1 4.737 0.05 . 1 . . . . A 17 ARG HA . 30926 1 200 . 1 . 1 17 17 ARG HB2 H 1 1.660 0.05 . 2 . . . . A 17 ARG HB2 . 30926 1 201 . 1 . 1 17 17 ARG HB3 H 1 1.627 0.05 . 2 . . . . A 17 ARG HB3 . 30926 1 202 . 1 . 1 17 17 ARG HG2 H 1 1.495 0.05 . 2 . . . . A 17 ARG HG2 . 30926 1 203 . 1 . 1 17 17 ARG HG3 H 1 1.654 0.05 . 2 . . . . A 17 ARG HG3 . 30926 1 204 . 1 . 1 17 17 ARG HD2 H 1 2.945 0.05 . 2 . . . . A 17 ARG HD2 . 30926 1 205 . 1 . 1 17 17 ARG HD3 H 1 3.078 0.05 . 2 . . . . A 17 ARG HD3 . 30926 1 206 . 1 . 1 17 17 ARG C C 13 176.737 0.50 . 1 . . . . A 17 ARG C . 30926 1 207 . 1 . 1 17 17 ARG CA C 13 53.019 0.50 . 1 . . . . A 17 ARG CA . 30926 1 208 . 1 . 1 17 17 ARG CB C 13 29.203 0.50 . 1 . . . . A 17 ARG CB . 30926 1 209 . 1 . 1 17 17 ARG CG C 13 26.601 0.50 . 1 . . . . A 17 ARG CG . 30926 1 210 . 1 . 1 17 17 ARG CD C 13 41.003 0.50 . 1 . . . . A 17 ARG CD . 30926 1 211 . 1 . 1 17 17 ARG N N 15 124.825 0.10 . 1 . . . . A 17 ARG N . 30926 1 212 . 1 . 1 18 18 GLN H H 1 7.803 0.05 . 1 . . . . A 18 GLN H . 30926 1 213 . 1 . 1 18 18 GLN HA H 1 4.187 0.05 . 1 . . . . A 18 GLN HA . 30926 1 214 . 1 . 1 18 18 GLN HB2 H 1 1.866 0.05 . 2 . . . . A 18 GLN HB2 . 30926 1 215 . 1 . 1 18 18 GLN HB3 H 1 2.089 0.05 . 2 . . . . A 18 GLN HB3 . 30926 1 216 . 1 . 1 18 18 GLN HG2 H 1 2.278 0.05 . 2 . . . . A 18 GLN HG2 . 30926 1 217 . 1 . 1 18 18 GLN HG3 H 1 2.514 0.05 . 2 . . . . A 18 GLN HG3 . 30926 1 218 . 1 . 1 18 18 GLN HE21 H 1 6.432 0.05 . 2 . . . . A 18 GLN HE21 . 30926 1 219 . 1 . 1 18 18 GLN HE22 H 1 7.309 0.05 . 2 . . . . A 18 GLN HE22 . 30926 1 220 . 1 . 1 18 18 GLN CB C 13 32.491 0.50 . 1 . . . . A 18 GLN CB . 30926 1 221 . 1 . 1 18 18 GLN N N 15 118.188 0.10 . 1 . . . . A 18 GLN N . 30926 1 222 . 1 . 1 18 18 GLN NE2 N 15 106.676 0.10 . 1 . . . . A 18 GLN NE2 . 30926 1 223 . 1 . 1 22 22 THR H H 1 8.400 0.05 . 1 . . . . A 22 THR H . 30926 1 224 . 1 . 1 22 22 THR HA H 1 4.359 0.05 . 1 . . . . A 22 THR HA . 30926 1 225 . 1 . 1 22 22 THR HB H 1 4.397 0.05 . 1 . . . . A 22 THR HB . 30926 1 226 . 1 . 1 22 22 THR HG21 H 1 1.212 0.05 . 1 . . . . A 22 THR HG21 . 30926 1 227 . 1 . 1 22 22 THR HG22 H 1 1.212 0.05 . 1 . . . . A 22 THR HG22 . 30926 1 228 . 1 . 1 22 22 THR HG23 H 1 1.212 0.05 . 1 . . . . A 22 THR HG23 . 30926 1 229 . 1 . 1 22 22 THR CA C 13 63.039 0.50 . 1 . . . . A 22 THR CA . 30926 1 230 . 1 . 1 22 22 THR CB C 13 69.864 0.50 . 1 . . . . A 22 THR CB . 30926 1 231 . 1 . 1 22 22 THR CG2 C 13 21.959 0.50 . 1 . . . . A 22 THR CG2 . 30926 1 232 . 1 . 1 22 22 THR N N 15 109.499 0.10 . 1 . . . . A 22 THR N . 30926 1 233 . 1 . 1 23 23 ASP H H 1 8.377 0.05 . 1 . . . . A 23 ASP H . 30926 1 234 . 1 . 1 23 23 ASP HA H 1 4.629 0.05 . 1 . . . . A 23 ASP HA . 30926 1 235 . 1 . 1 23 23 ASP HB2 H 1 2.611 0.05 . 2 . . . . A 23 ASP HB2 . 30926 1 236 . 1 . 1 23 23 ASP HB3 H 1 2.782 0.05 . 2 . . . . A 23 ASP HB3 . 30926 1 237 . 1 . 1 23 23 ASP CA C 13 53.104 0.50 . 1 . . . . A 23 ASP CA . 30926 1 238 . 1 . 1 23 23 ASP CB C 13 42.306 0.50 . 1 . . . . A 23 ASP CB . 30926 1 239 . 1 . 1 23 23 ASP N N 15 119.813 0.10 . 1 . . . . A 23 ASP N . 30926 1 240 . 1 . 1 24 24 ALA H H 1 8.016 0.05 . 1 . . . . A 24 ALA H . 30926 1 241 . 1 . 1 24 24 ALA HA H 1 4.011 0.05 . 1 . . . . A 24 ALA HA . 30926 1 242 . 1 . 1 24 24 ALA HB1 H 1 1.904 0.05 . 1 . . . . A 24 ALA HB1 . 30926 1 243 . 1 . 1 24 24 ALA HB2 H 1 1.904 0.05 . 1 . . . . A 24 ALA HB2 . 30926 1 244 . 1 . 1 24 24 ALA HB3 H 1 1.904 0.05 . 1 . . . . A 24 ALA HB3 . 30926 1 245 . 1 . 1 24 24 ALA CA C 13 56.885 0.50 . 1 . . . . A 24 ALA CA . 30926 1 246 . 1 . 1 24 24 ALA CB C 13 20.367 0.50 . 1 . . . . A 24 ALA CB . 30926 1 247 . 1 . 1 25 25 GLY H H 1 9.455 0.05 . 1 . . . . A 25 GLY H . 30926 1 248 . 1 . 1 25 25 GLY HA2 H 1 3.005 0.05 . 2 . . . . A 25 GLY HA2 . 30926 1 249 . 1 . 1 25 25 GLY HA3 H 1 3.340 0.05 . 2 . . . . A 25 GLY HA3 . 30926 1 250 . 1 . 1 25 25 GLY CA C 13 48.309 0.50 . 1 . . . . A 25 GLY CA . 30926 1 251 . 1 . 1 25 25 GLY N N 15 107.659 0.10 . 1 . . . . A 25 GLY N . 30926 1 252 . 1 . 1 26 26 ALA H H 1 8.532 0.05 . 1 . . . . A 26 ALA H . 30926 1 253 . 1 . 1 26 26 ALA HA H 1 3.938 0.05 . 1 . . . . A 26 ALA HA . 30926 1 254 . 1 . 1 26 26 ALA HB1 H 1 1.294 0.05 . 1 . . . . A 26 ALA HB1 . 30926 1 255 . 1 . 1 26 26 ALA HB2 H 1 1.294 0.05 . 1 . . . . A 26 ALA HB2 . 30926 1 256 . 1 . 1 26 26 ALA HB3 H 1 1.294 0.05 . 1 . . . . A 26 ALA HB3 . 30926 1 257 . 1 . 1 26 26 ALA CA C 13 54.325 0.50 . 1 . . . . A 26 ALA CA . 30926 1 258 . 1 . 1 26 26 ALA CB C 13 17.899 0.50 . 1 . . . . A 26 ALA CB . 30926 1 259 . 1 . 1 26 26 ALA N N 15 124.640 0.10 . 1 . . . . A 26 ALA N . 30926 1 260 . 1 . 1 27 27 ALA H H 1 8.764 0.05 . 1 . . . . A 27 ALA H . 30926 1 261 . 1 . 1 27 27 ALA HA H 1 3.785 0.05 . 1 . . . . A 27 ALA HA . 30926 1 262 . 1 . 1 27 27 ALA HB1 H 1 1.406 0.05 . 1 . . . . A 27 ALA HB1 . 30926 1 263 . 1 . 1 27 27 ALA HB2 H 1 1.406 0.05 . 1 . . . . A 27 ALA HB2 . 30926 1 264 . 1 . 1 27 27 ALA HB3 H 1 1.406 0.05 . 1 . . . . A 27 ALA HB3 . 30926 1 265 . 1 . 1 27 27 ALA C C 13 181.153 0.50 . 1 . . . . A 27 ALA C . 30926 1 266 . 1 . 1 27 27 ALA CA C 13 55.522 0.50 . 1 . . . . A 27 ALA CA . 30926 1 267 . 1 . 1 27 27 ALA CB C 13 17.480 0.50 . 1 . . . . A 27 ALA CB . 30926 1 268 . 1 . 1 27 27 ALA N N 15 121.413 0.10 . 1 . . . . A 27 ALA N . 30926 1 269 . 1 . 1 28 28 CYS H H 1 8.356 0.05 . 1 . . . . A 28 CYS H . 30926 1 270 . 1 . 1 28 28 CYS HA H 1 3.822 0.05 . 1 . . . . A 28 CYS HA . 30926 1 271 . 1 . 1 28 28 CYS HB2 H 1 2.025 0.05 . 2 . . . . A 28 CYS HB2 . 30926 1 272 . 1 . 1 28 28 CYS HB3 H 1 3.156 0.05 . 2 . . . . A 28 CYS HB3 . 30926 1 273 . 1 . 1 28 28 CYS C C 13 176.597 0.50 . 1 . . . . A 28 CYS C . 30926 1 274 . 1 . 1 28 28 CYS CA C 13 64.802 0.50 . 1 . . . . A 28 CYS CA . 30926 1 275 . 1 . 1 28 28 CYS CB C 13 26.595 0.50 . 1 . . . . A 28 CYS CB . 30926 1 276 . 1 . 1 28 28 CYS N N 15 119.304 0.10 . 1 . . . . A 28 CYS N . 30926 1 277 . 1 . 1 29 29 LEU H H 1 8.050 0.05 . 1 . . . . A 29 LEU H . 30926 1 278 . 1 . 1 29 29 LEU HA H 1 3.780 0.05 . 1 . . . . A 29 LEU HA . 30926 1 279 . 1 . 1 29 29 LEU HB2 H 1 1.173 0.05 . 2 . . . . A 29 LEU HB2 . 30926 1 280 . 1 . 1 29 29 LEU HB3 H 1 1.524 0.05 . 2 . . . . A 29 LEU HB3 . 30926 1 281 . 1 . 1 29 29 LEU HG H 1 1.341 0.05 . 1 . . . . A 29 LEU HG . 30926 1 282 . 1 . 1 29 29 LEU HD11 H 1 0.542 0.05 . 2 . . . . A 29 LEU HD11 . 30926 1 283 . 1 . 1 29 29 LEU HD12 H 1 0.542 0.05 . 2 . . . . A 29 LEU HD12 . 30926 1 284 . 1 . 1 29 29 LEU HD13 H 1 0.542 0.05 . 2 . . . . A 29 LEU HD13 . 30926 1 285 . 1 . 1 29 29 LEU HD21 H 1 0.579 0.05 . 2 . . . . A 29 LEU HD21 . 30926 1 286 . 1 . 1 29 29 LEU HD22 H 1 0.579 0.05 . 2 . . . . A 29 LEU HD22 . 30926 1 287 . 1 . 1 29 29 LEU HD23 H 1 0.579 0.05 . 2 . . . . A 29 LEU HD23 . 30926 1 288 . 1 . 1 29 29 LEU C C 13 177.790 0.50 . 1 . . . . A 29 LEU C . 30926 1 289 . 1 . 1 29 29 LEU CA C 13 57.755 0.50 . 1 . . . . A 29 LEU CA . 30926 1 290 . 1 . 1 29 29 LEU CB C 13 41.062 0.50 . 1 . . . . A 29 LEU CB . 30926 1 291 . 1 . 1 29 29 LEU CG C 13 26.507 0.50 . 1 . . . . A 29 LEU CG . 30926 1 292 . 1 . 1 29 29 LEU CD1 C 13 23.755 0.50 . 2 . . . . A 29 LEU CD1 . 30926 1 293 . 1 . 1 29 29 LEU CD2 C 13 25.882 0.50 . 2 . . . . A 29 LEU CD2 . 30926 1 294 . 1 . 1 29 29 LEU N N 15 119.622 0.10 . 1 . . . . A 29 LEU N . 30926 1 295 . 1 . 1 30 30 SER H H 1 8.685 0.05 . 1 . . . . A 30 SER H . 30926 1 296 . 1 . 1 30 30 SER HA H 1 3.938 0.05 . 1 . . . . A 30 SER HA . 30926 1 297 . 1 . 1 30 30 SER HB2 H 1 3.865 0.05 . 2 . . . . A 30 SER HB2 . 30926 1 298 . 1 . 1 30 30 SER HB3 H 1 3.865 0.05 . 2 . . . . A 30 SER HB3 . 30926 1 299 . 1 . 1 30 30 SER C C 13 176.757 0.50 . 1 . . . . A 30 SER C . 30926 1 300 . 1 . 1 30 30 SER CA C 13 61.828 0.50 . 1 . . . . A 30 SER CA . 30926 1 301 . 1 . 1 30 30 SER CB C 13 63.383 0.50 . 1 . . . . A 30 SER CB . 30926 1 302 . 1 . 1 30 30 SER N N 15 113.874 0.10 . 1 . . . . A 30 SER N . 30926 1 303 . 1 . 1 31 31 SER H H 1 8.169 0.05 . 1 . . . . A 31 SER H . 30926 1 304 . 1 . 1 31 31 SER HA H 1 4.024 0.05 . 1 . . . . A 31 SER HA . 30926 1 305 . 1 . 1 31 31 SER C C 13 174.423 0.50 . 1 . . . . A 31 SER C . 30926 1 306 . 1 . 1 31 31 SER CA C 13 62.717 0.50 . 1 . . . . A 31 SER CA . 30926 1 307 . 1 . 1 31 31 SER CB C 13 62.759 0.50 . 1 . . . . A 31 SER CB . 30926 1 308 . 1 . 1 31 31 SER N N 15 116.101 0.10 . 1 . . . . A 31 SER N . 30926 1 309 . 1 . 1 32 32 ILE H H 1 7.550 0.05 . 1 . . . . A 32 ILE H . 30926 1 310 . 1 . 1 32 32 ILE HA H 1 3.583 0.05 . 1 . . . . A 32 ILE HA . 30926 1 311 . 1 . 1 32 32 ILE HB H 1 1.576 0.05 . 1 . . . . A 32 ILE HB . 30926 1 312 . 1 . 1 32 32 ILE HG12 H 1 0.399 0.05 . 2 . . . . A 32 ILE HG12 . 30926 1 313 . 1 . 1 32 32 ILE HG13 H 1 1.687 0.05 . 2 . . . . A 32 ILE HG13 . 30926 1 314 . 1 . 1 32 32 ILE HG21 H 1 0.853 0.05 . 1 . . . . A 32 ILE HG21 . 30926 1 315 . 1 . 1 32 32 ILE HG22 H 1 0.853 0.05 . 1 . . . . A 32 ILE HG22 . 30926 1 316 . 1 . 1 32 32 ILE HG23 H 1 0.853 0.05 . 1 . . . . A 32 ILE HG23 . 30926 1 317 . 1 . 1 32 32 ILE HD11 H 1 0.432 0.05 . 1 . . . . A 32 ILE HD11 . 30926 1 318 . 1 . 1 32 32 ILE HD12 H 1 0.432 0.05 . 1 . . . . A 32 ILE HD12 . 30926 1 319 . 1 . 1 32 32 ILE HD13 H 1 0.432 0.05 . 1 . . . . A 32 ILE HD13 . 30926 1 320 . 1 . 1 32 32 ILE C C 13 177.369 0.50 . 1 . . . . A 32 ILE C . 30926 1 321 . 1 . 1 32 32 ILE CA C 13 65.597 0.50 . 1 . . . . A 32 ILE CA . 30926 1 322 . 1 . 1 32 32 ILE CB C 13 38.035 0.50 . 1 . . . . A 32 ILE CB . 30926 1 323 . 1 . 1 32 32 ILE CG1 C 13 29.476 0.50 . 1 . . . . A 32 ILE CG1 . 30926 1 324 . 1 . 1 32 32 ILE CG2 C 13 17.695 0.50 . 1 . . . . A 32 ILE CG2 . 30926 1 325 . 1 . 1 32 32 ILE CD1 C 13 14.457 0.50 . 1 . . . . A 32 ILE CD1 . 30926 1 326 . 1 . 1 32 32 ILE N N 15 120.517 0.10 . 1 . . . . A 32 ILE N . 30926 1 327 . 1 . 1 33 33 ALA H H 1 9.022 0.05 . 1 . . . . A 33 ALA H . 30926 1 328 . 1 . 1 33 33 ALA HA H 1 4.298 0.05 . 1 . . . . A 33 ALA HA . 30926 1 329 . 1 . 1 33 33 ALA HB1 H 1 1.624 0.05 . 1 . . . . A 33 ALA HB1 . 30926 1 330 . 1 . 1 33 33 ALA HB2 H 1 1.624 0.05 . 1 . . . . A 33 ALA HB2 . 30926 1 331 . 1 . 1 33 33 ALA HB3 H 1 1.624 0.05 . 1 . . . . A 33 ALA HB3 . 30926 1 332 . 1 . 1 33 33 ALA C C 13 179.459 0.50 . 1 . . . . A 33 ALA C . 30926 1 333 . 1 . 1 33 33 ALA CA C 13 56.692 0.50 . 1 . . . . A 33 ALA CA . 30926 1 334 . 1 . 1 33 33 ALA CB C 13 17.266 0.50 . 1 . . . . A 33 ALA CB . 30926 1 335 . 1 . 1 33 33 ALA N N 15 122.271 0.10 . 1 . . . . A 33 ALA N . 30926 1 336 . 1 . 1 34 34 GLN H H 1 8.505 0.05 . 1 . . . . A 34 GLN H . 30926 1 337 . 1 . 1 34 34 GLN HA H 1 4.181 0.05 . 1 . . . . A 34 GLN HA . 30926 1 338 . 1 . 1 34 34 GLN HB2 H 1 2.153 0.05 . 2 . . . . A 34 GLN HB2 . 30926 1 339 . 1 . 1 34 34 GLN HB3 H 1 2.226 0.05 . 2 . . . . A 34 GLN HB3 . 30926 1 340 . 1 . 1 34 34 GLN HG2 H 1 2.340 0.05 . 2 . . . . A 34 GLN HG2 . 30926 1 341 . 1 . 1 34 34 GLN HG3 H 1 2.745 0.05 . 2 . . . . A 34 GLN HG3 . 30926 1 342 . 1 . 1 34 34 GLN HE21 H 1 6.715 0.05 . 2 . . . . A 34 GLN HE21 . 30926 1 343 . 1 . 1 34 34 GLN HE22 H 1 7.093 0.05 . 2 . . . . A 34 GLN HE22 . 30926 1 344 . 1 . 1 34 34 GLN C C 13 180.950 0.50 . 1 . . . . A 34 GLN C . 30926 1 345 . 1 . 1 34 34 GLN CA C 13 59.408 0.50 . 1 . . . . A 34 GLN CA . 30926 1 346 . 1 . 1 34 34 GLN CB C 13 28.767 0.50 . 1 . . . . A 34 GLN CB . 30926 1 347 . 1 . 1 34 34 GLN CG C 13 35.059 0.50 . 1 . . . . A 34 GLN CG . 30926 1 348 . 1 . 1 34 34 GLN N N 15 116.751 0.10 . 1 . . . . A 34 GLN N . 30926 1 349 . 1 . 1 34 34 GLN NE2 N 15 111.099 0.10 . 1 . . . . A 34 GLN NE2 . 30926 1 350 . 1 . 1 35 35 TYR H H 1 8.792 0.05 . 1 . . . . A 35 TYR H . 30926 1 351 . 1 . 1 35 35 TYR HA H 1 4.131 0.05 . 1 . . . . A 35 TYR HA . 30926 1 352 . 1 . 1 35 35 TYR HB2 H 1 3.429 0.05 . 2 . . . . A 35 TYR HB2 . 30926 1 353 . 1 . 1 35 35 TYR HB3 H 1 3.425 0.05 . 2 . . . . A 35 TYR HB3 . 30926 1 354 . 1 . 1 35 35 TYR HD1 H 1 6.616 0.05 . 3 . . . . A 35 TYR HD1 . 30926 1 355 . 1 . 1 35 35 TYR HD2 H 1 6.616 0.05 . 3 . . . . A 35 TYR HD2 . 30926 1 356 . 1 . 1 35 35 TYR HE1 H 1 6.452 0.05 . 3 . . . . A 35 TYR HE1 . 30926 1 357 . 1 . 1 35 35 TYR HE2 H 1 6.452 0.05 . 3 . . . . A 35 TYR HE2 . 30926 1 358 . 1 . 1 35 35 TYR C C 13 176.990 0.50 . 1 . . . . A 35 TYR C . 30926 1 359 . 1 . 1 35 35 TYR CA C 13 61.931 0.50 . 1 . . . . A 35 TYR CA . 30926 1 360 . 1 . 1 35 35 TYR CB C 13 38.175 0.50 . 1 . . . . A 35 TYR CB . 30926 1 361 . 1 . 1 35 35 TYR CE1 C 13 118.285 0.50 . 3 . . . . A 35 TYR CE1 . 30926 1 362 . 1 . 1 35 35 TYR N N 15 125.791 0.10 . 1 . . . . A 35 TYR N . 30926 1 363 . 1 . 1 36 36 TYR H H 1 7.859 0.05 . 1 . . . . A 36 TYR H . 30926 1 364 . 1 . 1 36 36 TYR HA H 1 4.398 0.05 . 1 . . . . A 36 TYR HA . 30926 1 365 . 1 . 1 36 36 TYR HB2 H 1 2.841 0.05 . 2 . . . . A 36 TYR HB2 . 30926 1 366 . 1 . 1 36 36 TYR HB3 H 1 3.488 0.05 . 2 . . . . A 36 TYR HB3 . 30926 1 367 . 1 . 1 36 36 TYR HD1 H 1 7.440 0.05 . 3 . . . . A 36 TYR HD1 . 30926 1 368 . 1 . 1 36 36 TYR HD2 H 1 7.448 0.05 . 3 . . . . A 36 TYR HD2 . 30926 1 369 . 1 . 1 36 36 TYR HE1 H 1 6.867 0.05 . 3 . . . . A 36 TYR HE1 . 30926 1 370 . 1 . 1 36 36 TYR HE2 H 1 6.882 0.05 . 3 . . . . A 36 TYR HE2 . 30926 1 371 . 1 . 1 36 36 TYR C C 13 175.316 0.50 . 1 . . . . A 36 TYR C . 30926 1 372 . 1 . 1 36 36 TYR CA C 13 60.017 0.50 . 1 . . . . A 36 TYR CA . 30926 1 373 . 1 . 1 36 36 TYR CB C 13 39.014 0.50 . 1 . . . . A 36 TYR CB . 30926 1 374 . 1 . 1 36 36 TYR CD1 C 13 133.852 0.50 . 3 . . . . A 36 TYR CD1 . 30926 1 375 . 1 . 1 36 36 TYR CE1 C 13 117.375 0.50 . 3 . . . . A 36 TYR CE1 . 30926 1 376 . 1 . 1 36 36 TYR N N 15 114.864 0.10 . 1 . . . . A 36 TYR N . 30926 1 377 . 1 . 1 37 37 GLY H H 1 7.971 0.05 . 1 . . . . A 37 GLY H . 30926 1 378 . 1 . 1 37 37 GLY HA2 H 1 3.688 0.05 . 2 . . . . A 37 GLY HA2 . 30926 1 379 . 1 . 1 37 37 GLY HA3 H 1 4.228 0.05 . 2 . . . . A 37 GLY HA3 . 30926 1 380 . 1 . 1 37 37 GLY C C 13 173.943 0.50 . 1 . . . . A 37 GLY C . 30926 1 381 . 1 . 1 37 37 GLY CA C 13 45.771 0.50 . 1 . . . . A 37 GLY CA . 30926 1 382 . 1 . 1 37 37 GLY N N 15 107.114 0.10 . 1 . . . . A 37 GLY N . 30926 1 383 . 1 . 1 38 38 LEU H H 1 8.577 0.05 . 1 . . . . A 38 LEU H . 30926 1 384 . 1 . 1 38 38 LEU HA H 1 4.426 0.05 . 1 . . . . A 38 LEU HA . 30926 1 385 . 1 . 1 38 38 LEU HB2 H 1 1.423 0.05 . 2 . . . . A 38 LEU HB2 . 30926 1 386 . 1 . 1 38 38 LEU HB3 H 1 1.494 0.05 . 2 . . . . A 38 LEU HB3 . 30926 1 387 . 1 . 1 38 38 LEU HG H 1 1.426 0.05 . 1 . . . . A 38 LEU HG . 30926 1 388 . 1 . 1 38 38 LEU HD11 H 1 0.631 0.05 . 2 . . . . A 38 LEU HD11 . 30926 1 389 . 1 . 1 38 38 LEU HD12 H 1 0.631 0.05 . 2 . . . . A 38 LEU HD12 . 30926 1 390 . 1 . 1 38 38 LEU HD13 H 1 0.631 0.05 . 2 . . . . A 38 LEU HD13 . 30926 1 391 . 1 . 1 38 38 LEU HD21 H 1 0.698 0.05 . 2 . . . . A 38 LEU HD21 . 30926 1 392 . 1 . 1 38 38 LEU HD22 H 1 0.698 0.05 . 2 . . . . A 38 LEU HD22 . 30926 1 393 . 1 . 1 38 38 LEU HD23 H 1 0.698 0.05 . 2 . . . . A 38 LEU HD23 . 30926 1 394 . 1 . 1 38 38 LEU C C 13 176.126 0.50 . 1 . . . . A 38 LEU C . 30926 1 395 . 1 . 1 38 38 LEU CA C 13 54.480 0.50 . 1 . . . . A 38 LEU CA . 30926 1 396 . 1 . 1 38 38 LEU CB C 13 42.691 0.50 . 1 . . . . A 38 LEU CB . 30926 1 397 . 1 . 1 38 38 LEU CG C 13 27.289 0.50 . 1 . . . . A 38 LEU CG . 30926 1 398 . 1 . 1 38 38 LEU CD1 C 13 24.128 0.50 . 2 . . . . A 38 LEU CD1 . 30926 1 399 . 1 . 1 38 38 LEU CD2 C 13 24.440 0.50 . 2 . . . . A 38 LEU CD2 . 30926 1 400 . 1 . 1 38 38 LEU N N 15 123.082 0.10 . 1 . . . . A 38 LEU N . 30926 1 401 . 1 . 1 39 39 LYS H H 1 8.582 0.05 . 1 . . . . A 39 LYS H . 30926 1 402 . 1 . 1 39 39 LYS HA H 1 4.297 0.05 . 1 . . . . A 39 LYS HA . 30926 1 403 . 1 . 1 39 39 LYS HB2 H 1 1.621 0.05 . 2 . . . . A 39 LYS HB2 . 30926 1 404 . 1 . 1 39 39 LYS HB3 H 1 1.754 0.05 . 2 . . . . A 39 LYS HB3 . 30926 1 405 . 1 . 1 39 39 LYS HG2 H 1 1.218 0.05 . 2 . . . . A 39 LYS HG2 . 30926 1 406 . 1 . 1 39 39 LYS HG3 H 1 1.310 0.05 . 2 . . . . A 39 LYS HG3 . 30926 1 407 . 1 . 1 39 39 LYS HD2 H 1 1.577 0.05 . 2 . . . . A 39 LYS HD2 . 30926 1 408 . 1 . 1 39 39 LYS HD3 H 1 1.577 0.05 . 2 . . . . A 39 LYS HD3 . 30926 1 409 . 1 . 1 39 39 LYS HE2 H 1 2.895 0.05 . 2 . . . . A 39 LYS HE2 . 30926 1 410 . 1 . 1 39 39 LYS HE3 H 1 2.895 0.05 . 2 . . . . A 39 LYS HE3 . 30926 1 411 . 1 . 1 39 39 LYS C C 13 175.530 0.50 . 1 . . . . A 39 LYS C . 30926 1 412 . 1 . 1 39 39 LYS CA C 13 55.418 0.50 . 1 . . . . A 39 LYS CA . 30926 1 413 . 1 . 1 39 39 LYS CB C 13 31.535 0.50 . 1 . . . . A 39 LYS CB . 30926 1 414 . 1 . 1 39 39 LYS CG C 13 24.606 0.50 . 1 . . . . A 39 LYS CG . 30926 1 415 . 1 . 1 39 39 LYS CD C 13 29.028 0.50 . 1 . . . . A 39 LYS CD . 30926 1 416 . 1 . 1 39 39 LYS CE C 13 42.184 0.50 . 1 . . . . A 39 LYS CE . 30926 1 417 . 1 . 1 39 39 LYS N N 15 125.288 0.10 . 1 . . . . A 39 LYS N . 30926 1 418 . 1 . 1 40 40 MET H H 1 7.872 0.05 . 1 . . . . A 40 MET H . 30926 1 419 . 1 . 1 40 40 MET HA H 1 4.657 0.05 . 1 . . . . A 40 MET HA . 30926 1 420 . 1 . 1 40 40 MET HB2 H 1 1.759 0.05 . 2 . . . . A 40 MET HB2 . 30926 1 421 . 1 . 1 40 40 MET HB3 H 1 1.755 0.05 . 2 . . . . A 40 MET HB3 . 30926 1 422 . 1 . 1 40 40 MET HG2 H 1 2.350 0.05 . 2 . . . . A 40 MET HG2 . 30926 1 423 . 1 . 1 40 40 MET HG3 H 1 2.380 0.05 . 2 . . . . A 40 MET HG3 . 30926 1 424 . 1 . 1 40 40 MET HE1 H 1 1.932 0.05 . 1 . . . . A 40 MET HE1 . 30926 1 425 . 1 . 1 40 40 MET HE2 H 1 1.932 0.05 . 1 . . . . A 40 MET HE2 . 30926 1 426 . 1 . 1 40 40 MET HE3 H 1 1.932 0.05 . 1 . . . . A 40 MET HE3 . 30926 1 427 . 1 . 1 40 40 MET C C 13 174.431 0.50 . 1 . . . . A 40 MET C . 30926 1 428 . 1 . 1 40 40 MET CA C 13 53.614 0.50 . 1 . . . . A 40 MET CA . 30926 1 429 . 1 . 1 40 40 MET CB C 13 34.443 0.50 . 1 . . . . A 40 MET CB . 30926 1 430 . 1 . 1 40 40 MET CG C 13 31.941 0.50 . 1 . . . . A 40 MET CG . 30926 1 431 . 1 . 1 40 40 MET CE C 13 17.076 0.50 . 1 . . . . A 40 MET CE . 30926 1 432 . 1 . 1 40 40 MET N N 15 123.684 0.10 . 1 . . . . A 40 MET N . 30926 1 433 . 1 . 1 41 41 SER H H 1 8.375 0.05 . 1 . . . . A 41 SER H . 30926 1 434 . 1 . 1 41 41 SER HA H 1 4.306 0.05 . 1 . . . . A 41 SER HA . 30926 1 435 . 1 . 1 41 41 SER HB2 H 1 3.915 0.05 . 2 . . . . A 41 SER HB2 . 30926 1 436 . 1 . 1 41 41 SER HB3 H 1 4.215 0.05 . 2 . . . . A 41 SER HB3 . 30926 1 437 . 1 . 1 41 41 SER C C 13 174.168 0.50 . 1 . . . . A 41 SER C . 30926 1 438 . 1 . 1 41 41 SER CA C 13 57.015 0.50 . 1 . . . . A 41 SER CA . 30926 1 439 . 1 . 1 41 41 SER CB C 13 64.851 0.50 . 1 . . . . A 41 SER CB . 30926 1 440 . 1 . 1 41 41 SER N N 15 119.977 0.10 . 1 . . . . A 41 SER N . 30926 1 441 . 1 . 1 42 42 LEU H H 1 8.667 0.05 . 1 . . . . A 42 LEU H . 30926 1 442 . 1 . 1 42 42 LEU HA H 1 3.947 0.05 . 1 . . . . A 42 LEU HA . 30926 1 443 . 1 . 1 42 42 LEU HB2 H 1 1.519 0.05 . 2 . . . . A 42 LEU HB2 . 30926 1 444 . 1 . 1 42 42 LEU HB3 H 1 1.684 0.05 . 2 . . . . A 42 LEU HB3 . 30926 1 445 . 1 . 1 42 42 LEU HG H 1 1.457 0.05 . 1 . . . . A 42 LEU HG . 30926 1 446 . 1 . 1 42 42 LEU HD11 H 1 0.789 0.05 . 2 . . . . A 42 LEU HD11 . 30926 1 447 . 1 . 1 42 42 LEU HD12 H 1 0.789 0.05 . 2 . . . . A 42 LEU HD12 . 30926 1 448 . 1 . 1 42 42 LEU HD13 H 1 0.789 0.05 . 2 . . . . A 42 LEU HD13 . 30926 1 449 . 1 . 1 42 42 LEU HD21 H 1 0.854 0.05 . 2 . . . . A 42 LEU HD21 . 30926 1 450 . 1 . 1 42 42 LEU HD22 H 1 0.854 0.05 . 2 . . . . A 42 LEU HD22 . 30926 1 451 . 1 . 1 42 42 LEU HD23 H 1 0.854 0.05 . 2 . . . . A 42 LEU HD23 . 30926 1 452 . 1 . 1 42 42 LEU C C 13 178.419 0.50 . 1 . . . . A 42 LEU C . 30926 1 453 . 1 . 1 42 42 LEU CA C 13 58.174 0.50 . 1 . . . . A 42 LEU CA . 30926 1 454 . 1 . 1 42 42 LEU CB C 13 41.431 0.50 . 1 . . . . A 42 LEU CB . 30926 1 455 . 1 . 1 42 42 LEU CG C 13 27.126 0.50 . 1 . . . . A 42 LEU CG . 30926 1 456 . 1 . 1 42 42 LEU CD1 C 13 23.532 0.50 . 2 . . . . A 42 LEU CD1 . 30926 1 457 . 1 . 1 42 42 LEU CD2 C 13 25.432 0.50 . 2 . . . . A 42 LEU CD2 . 30926 1 458 . 1 . 1 42 42 LEU N N 15 124.002 0.10 . 1 . . . . A 42 LEU N . 30926 1 459 . 1 . 1 43 43 ALA H H 1 8.323 0.05 . 1 . . . . A 43 ALA H . 30926 1 460 . 1 . 1 43 43 ALA HA H 1 3.880 0.05 . 1 . . . . A 43 ALA HA . 30926 1 461 . 1 . 1 43 43 ALA HB1 H 1 1.309 0.05 . 1 . . . . A 43 ALA HB1 . 30926 1 462 . 1 . 1 43 43 ALA HB2 H 1 1.309 0.05 . 1 . . . . A 43 ALA HB2 . 30926 1 463 . 1 . 1 43 43 ALA HB3 H 1 1.309 0.05 . 1 . . . . A 43 ALA HB3 . 30926 1 464 . 1 . 1 43 43 ALA C C 13 180.495 0.50 . 1 . . . . A 43 ALA C . 30926 1 465 . 1 . 1 43 43 ALA CA C 13 55.073 0.50 . 1 . . . . A 43 ALA CA . 30926 1 466 . 1 . 1 43 43 ALA CB C 13 18.048 0.50 . 1 . . . . A 43 ALA CB . 30926 1 467 . 1 . 1 43 43 ALA N N 15 119.248 0.10 . 1 . . . . A 43 ALA N . 30926 1 468 . 1 . 1 44 44 LYS H H 1 7.597 0.05 . 1 . . . . A 44 LYS H . 30926 1 469 . 1 . 1 44 44 LYS HA H 1 4.054 0.05 . 1 . . . . A 44 LYS HA . 30926 1 470 . 1 . 1 44 44 LYS HB2 H 1 1.840 0.05 . 2 . . . . A 44 LYS HB2 . 30926 1 471 . 1 . 1 44 44 LYS HB3 H 1 1.840 0.05 . 2 . . . . A 44 LYS HB3 . 30926 1 472 . 1 . 1 44 44 LYS HG2 H 1 1.410 0.05 . 2 . . . . A 44 LYS HG2 . 30926 1 473 . 1 . 1 44 44 LYS HG3 H 1 1.410 0.05 . 2 . . . . A 44 LYS HG3 . 30926 1 474 . 1 . 1 44 44 LYS HD2 H 1 1.645 0.05 . 2 . . . . A 44 LYS HD2 . 30926 1 475 . 1 . 1 44 44 LYS HD3 H 1 1.691 0.05 . 2 . . . . A 44 LYS HD3 . 30926 1 476 . 1 . 1 44 44 LYS HE2 H 1 2.881 0.05 . 2 . . . . A 44 LYS HE2 . 30926 1 477 . 1 . 1 44 44 LYS HE3 H 1 2.881 0.05 . 2 . . . . A 44 LYS HE3 . 30926 1 478 . 1 . 1 44 44 LYS C C 13 179.212 0.50 . 1 . . . . A 44 LYS C . 30926 1 479 . 1 . 1 44 44 LYS CA C 13 58.076 0.50 . 1 . . . . A 44 LYS CA . 30926 1 480 . 1 . 1 44 44 LYS CB C 13 31.888 0.50 . 1 . . . . A 44 LYS CB . 30926 1 481 . 1 . 1 44 44 LYS CG C 13 24.980 0.50 . 1 . . . . A 44 LYS CG . 30926 1 482 . 1 . 1 44 44 LYS CD C 13 28.352 0.50 . 1 . . . . A 44 LYS CD . 30926 1 483 . 1 . 1 44 44 LYS CE C 13 41.721 0.50 . 1 . . . . A 44 LYS CE . 30926 1 484 . 1 . 1 44 44 LYS N N 15 118.396 0.10 . 1 . . . . A 44 LYS N . 30926 1 485 . 1 . 1 45 45 ILE H H 1 7.913 0.05 . 1 . . . . A 45 ILE H . 30926 1 486 . 1 . 1 45 45 ILE HA H 1 3.700 0.05 . 1 . . . . A 45 ILE HA . 30926 1 487 . 1 . 1 45 45 ILE HB H 1 1.929 0.05 . 1 . . . . A 45 ILE HB . 30926 1 488 . 1 . 1 45 45 ILE HG12 H 1 1.152 0.05 . 2 . . . . A 45 ILE HG12 . 30926 1 489 . 1 . 1 45 45 ILE HG13 H 1 1.507 0.05 . 2 . . . . A 45 ILE HG13 . 30926 1 490 . 1 . 1 45 45 ILE HG21 H 1 0.840 0.05 . 1 . . . . A 45 ILE HG21 . 30926 1 491 . 1 . 1 45 45 ILE HG22 H 1 0.840 0.05 . 1 . . . . A 45 ILE HG22 . 30926 1 492 . 1 . 1 45 45 ILE HG23 H 1 0.840 0.05 . 1 . . . . A 45 ILE HG23 . 30926 1 493 . 1 . 1 45 45 ILE HD11 H 1 0.652 0.05 . 1 . . . . A 45 ILE HD11 . 30926 1 494 . 1 . 1 45 45 ILE HD12 H 1 0.652 0.05 . 1 . . . . A 45 ILE HD12 . 30926 1 495 . 1 . 1 45 45 ILE HD13 H 1 0.652 0.05 . 1 . . . . A 45 ILE HD13 . 30926 1 496 . 1 . 1 45 45 ILE C C 13 178.930 0.50 . 1 . . . . A 45 ILE C . 30926 1 497 . 1 . 1 45 45 ILE CA C 13 64.298 0.50 . 1 . . . . A 45 ILE CA . 30926 1 498 . 1 . 1 45 45 ILE CB C 13 36.485 0.50 . 1 . . . . A 45 ILE CB . 30926 1 499 . 1 . 1 45 45 ILE CG1 C 13 29.004 0.50 . 1 . . . . A 45 ILE CG1 . 30926 1 500 . 1 . 1 45 45 ILE CG2 C 13 18.549 0.50 . 1 . . . . A 45 ILE CG2 . 30926 1 501 . 1 . 1 45 45 ILE CD1 C 13 11.985 0.50 . 1 . . . . A 45 ILE CD1 . 30926 1 502 . 1 . 1 45 45 ILE N N 15 120.076 0.10 . 1 . . . . A 45 ILE N . 30926 1 503 . 1 . 1 46 46 ARG H H 1 8.952 0.05 . 1 . . . . A 46 ARG H . 30926 1 504 . 1 . 1 46 46 ARG HA H 1 3.899 0.05 . 1 . . . . A 46 ARG HA . 30926 1 505 . 1 . 1 46 46 ARG HB2 H 1 1.787 0.05 . 2 . . . . A 46 ARG HB2 . 30926 1 506 . 1 . 1 46 46 ARG HB3 H 1 1.787 0.05 . 2 . . . . A 46 ARG HB3 . 30926 1 507 . 1 . 1 46 46 ARG HG2 H 1 1.470 0.05 . 2 . . . . A 46 ARG HG2 . 30926 1 508 . 1 . 1 46 46 ARG HG3 H 1 1.568 0.05 . 2 . . . . A 46 ARG HG3 . 30926 1 509 . 1 . 1 46 46 ARG HD2 H 1 3.055 0.05 . 2 . . . . A 46 ARG HD2 . 30926 1 510 . 1 . 1 46 46 ARG HD3 H 1 3.055 0.05 . 2 . . . . A 46 ARG HD3 . 30926 1 511 . 1 . 1 46 46 ARG C C 13 178.691 0.50 . 1 . . . . A 46 ARG C . 30926 1 512 . 1 . 1 46 46 ARG CA C 13 59.592 0.50 . 1 . . . . A 46 ARG CA . 30926 1 513 . 1 . 1 46 46 ARG CB C 13 29.963 0.50 . 1 . . . . A 46 ARG CB . 30926 1 514 . 1 . 1 46 46 ARG CG C 13 27.812 0.50 . 1 . . . . A 46 ARG CG . 30926 1 515 . 1 . 1 46 46 ARG CD C 13 43.452 0.50 . 1 . . . . A 46 ARG CD . 30926 1 516 . 1 . 1 46 46 ARG N N 15 121.743 0.10 . 1 . . . . A 46 ARG N . 30926 1 517 . 1 . 1 47 47 GLU H H 1 7.428 0.05 . 1 . . . . A 47 GLU H . 30926 1 518 . 1 . 1 47 47 GLU HA H 1 4.029 0.05 . 1 . . . . A 47 GLU HA . 30926 1 519 . 1 . 1 47 47 GLU HB2 H 1 2.128 0.05 . 2 . . . . A 47 GLU HB2 . 30926 1 520 . 1 . 1 47 47 GLU HB3 H 1 2.125 0.05 . 2 . . . . A 47 GLU HB3 . 30926 1 521 . 1 . 1 47 47 GLU HG2 H 1 2.393 0.05 . 2 . . . . A 47 GLU HG2 . 30926 1 522 . 1 . 1 47 47 GLU HG3 H 1 2.390 0.05 . 2 . . . . A 47 GLU HG3 . 30926 1 523 . 1 . 1 47 47 GLU C C 13 178.891 0.50 . 1 . . . . A 47 GLU C . 30926 1 524 . 1 . 1 47 47 GLU CA C 13 58.911 0.50 . 1 . . . . A 47 GLU CA . 30926 1 525 . 1 . 1 47 47 GLU CB C 13 29.535 0.50 . 1 . . . . A 47 GLU CB . 30926 1 526 . 1 . 1 47 47 GLU CG C 13 36.032 0.50 . 1 . . . . A 47 GLU CG . 30926 1 527 . 1 . 1 47 47 GLU N N 15 118.491 0.10 . 1 . . . . A 47 GLU N . 30926 1 528 . 1 . 1 48 48 MET H H 1 7.925 0.05 . 1 . . . . A 48 MET H . 30926 1 529 . 1 . 1 48 48 MET HA H 1 4.235 0.05 . 1 . . . . A 48 MET HA . 30926 1 530 . 1 . 1 48 48 MET HB2 H 1 2.020 0.05 . 2 . . . . A 48 MET HB2 . 30926 1 531 . 1 . 1 48 48 MET HB3 H 1 2.151 0.05 . 2 . . . . A 48 MET HB3 . 30926 1 532 . 1 . 1 48 48 MET HG2 H 1 2.485 0.05 . 2 . . . . A 48 MET HG2 . 30926 1 533 . 1 . 1 48 48 MET HG3 H 1 2.764 0.05 . 2 . . . . A 48 MET HG3 . 30926 1 534 . 1 . 1 48 48 MET HE1 H 1 1.926 0.05 . 1 . . . . A 48 MET HE1 . 30926 1 535 . 1 . 1 48 48 MET HE2 H 1 1.926 0.05 . 1 . . . . A 48 MET HE2 . 30926 1 536 . 1 . 1 48 48 MET HE3 H 1 1.926 0.05 . 1 . . . . A 48 MET HE3 . 30926 1 537 . 1 . 1 48 48 MET C C 13 177.806 0.50 . 1 . . . . A 48 MET C . 30926 1 538 . 1 . 1 48 48 MET CA C 13 58.240 0.50 . 1 . . . . A 48 MET CA . 30926 1 539 . 1 . 1 48 48 MET CB C 13 34.634 0.50 . 1 . . . . A 48 MET CB . 30926 1 540 . 1 . 1 48 48 MET CG C 13 32.068 0.50 . 1 . . . . A 48 MET CG . 30926 1 541 . 1 . 1 48 48 MET CE C 13 17.204 0.50 . 1 . . . . A 48 MET CE . 30926 1 542 . 1 . 1 48 48 MET N N 15 117.391 0.10 . 1 . . . . A 48 MET N . 30926 1 543 . 1 . 1 49 49 THR H H 1 8.007 0.05 . 1 . . . . A 49 THR H . 30926 1 544 . 1 . 1 49 49 THR HA H 1 4.075 0.05 . 1 . . . . A 49 THR HA . 30926 1 545 . 1 . 1 49 49 THR HB H 1 4.173 0.05 . 1 . . . . A 49 THR HB . 30926 1 546 . 1 . 1 49 49 THR HG21 H 1 0.963 0.05 . 1 . . . . A 49 THR HG21 . 30926 1 547 . 1 . 1 49 49 THR HG22 H 1 0.963 0.05 . 1 . . . . A 49 THR HG22 . 30926 1 548 . 1 . 1 49 49 THR HG23 H 1 0.963 0.05 . 1 . . . . A 49 THR HG23 . 30926 1 549 . 1 . 1 49 49 THR C C 13 175.773 0.50 . 1 . . . . A 49 THR C . 30926 1 550 . 1 . 1 49 49 THR CA C 13 62.964 0.50 . 1 . . . . A 49 THR CA . 30926 1 551 . 1 . 1 49 49 THR CB C 13 69.615 0.50 . 1 . . . . A 49 THR CB . 30926 1 552 . 1 . 1 49 49 THR CG2 C 13 22.180 0.50 . 1 . . . . A 49 THR CG2 . 30926 1 553 . 1 . 1 49 49 THR N N 15 108.160 0.10 . 1 . . . . A 49 THR N . 30926 1 554 . 1 . 1 50 50 GLY H H 1 7.759 0.05 . 1 . . . . A 50 GLY H . 30926 1 555 . 1 . 1 50 50 GLY HA2 H 1 3.915 0.05 . 2 . . . . A 50 GLY HA2 . 30926 1 556 . 1 . 1 50 50 GLY HA3 H 1 4.081 0.05 . 2 . . . . A 50 GLY HA3 . 30926 1 557 . 1 . 1 50 50 GLY C C 13 174.506 0.50 . 1 . . . . A 50 GLY C . 30926 1 558 . 1 . 1 50 50 GLY CA C 13 45.668 0.50 . 1 . . . . A 50 GLY CA . 30926 1 559 . 1 . 1 50 50 GLY N N 15 109.683 0.10 . 1 . . . . A 50 GLY N . 30926 1 560 . 1 . 1 51 51 THR H H 1 8.127 0.05 . 1 . . . . A 51 THR H . 30926 1 561 . 1 . 1 51 51 THR HA H 1 4.247 0.05 . 1 . . . . A 51 THR HA . 30926 1 562 . 1 . 1 51 51 THR HB H 1 4.160 0.05 . 1 . . . . A 51 THR HB . 30926 1 563 . 1 . 1 51 51 THR HG21 H 1 1.137 0.05 . 1 . . . . A 51 THR HG21 . 30926 1 564 . 1 . 1 51 51 THR HG22 H 1 1.137 0.05 . 1 . . . . A 51 THR HG22 . 30926 1 565 . 1 . 1 51 51 THR HG23 H 1 1.137 0.05 . 1 . . . . A 51 THR HG23 . 30926 1 566 . 1 . 1 51 51 THR C C 13 174.579 0.50 . 1 . . . . A 51 THR C . 30926 1 567 . 1 . 1 51 51 THR CA C 13 62.599 0.50 . 1 . . . . A 51 THR CA . 30926 1 568 . 1 . 1 51 51 THR CB C 13 69.732 0.50 . 1 . . . . A 51 THR CB . 30926 1 569 . 1 . 1 51 51 THR CG2 C 13 21.517 0.50 . 1 . . . . A 51 THR CG2 . 30926 1 570 . 1 . 1 51 51 THR N N 15 113.132 0.10 . 1 . . . . A 51 THR N . 30926 1 571 . 1 . 1 52 52 ASP H H 1 8.530 0.05 . 1 . . . . A 52 ASP H . 30926 1 572 . 1 . 1 52 52 ASP HA H 1 4.720 0.05 . 1 . . . . A 52 ASP HA . 30926 1 573 . 1 . 1 52 52 ASP HB2 H 1 2.765 0.05 . 2 . . . . A 52 ASP HB2 . 30926 1 574 . 1 . 1 52 52 ASP HB3 H 1 2.766 0.05 . 2 . . . . A 52 ASP HB3 . 30926 1 575 . 1 . 1 52 52 ASP CA C 13 54.105 0.50 . 1 . . . . A 52 ASP CA . 30926 1 576 . 1 . 1 52 52 ASP CB C 13 41.127 0.50 . 1 . . . . A 52 ASP CB . 30926 1 577 . 1 . 1 52 52 ASP N N 15 124.828 0.10 . 1 . . . . A 52 ASP N . 30926 1 578 . 1 . 1 53 53 THR H H 1 8.127 0.05 . 1 . . . . A 53 THR H . 30926 1 579 . 1 . 1 53 53 THR HA H 1 4.248 0.05 . 1 . . . . A 53 THR HA . 30926 1 580 . 1 . 1 53 53 THR HB H 1 4.280 0.05 . 1 . . . . A 53 THR HB . 30926 1 581 . 1 . 1 53 53 THR HG21 H 1 1.178 0.05 . 1 . . . . A 53 THR HG21 . 30926 1 582 . 1 . 1 53 53 THR HG22 H 1 1.178 0.05 . 1 . . . . A 53 THR HG22 . 30926 1 583 . 1 . 1 53 53 THR HG23 H 1 1.178 0.05 . 1 . . . . A 53 THR HG23 . 30926 1 584 . 1 . 1 53 53 THR C C 13 175.146 0.50 . 1 . . . . A 53 THR C . 30926 1 585 . 1 . 1 53 53 THR CA C 13 62.665 0.50 . 1 . . . . A 53 THR CA . 30926 1 586 . 1 . 1 53 53 THR CB C 13 69.381 0.50 . 1 . . . . A 53 THR CB . 30926 1 587 . 1 . 1 53 53 THR CG2 C 13 21.838 0.50 . 1 . . . . A 53 THR CG2 . 30926 1 588 . 1 . 1 53 53 THR N N 15 112.807 0.10 . 1 . . . . A 53 THR N . 30926 1 589 . 1 . 1 54 54 GLN H H 1 8.456 0.05 . 1 . . . . A 54 GLN H . 30926 1 590 . 1 . 1 54 54 GLN HA H 1 4.384 0.05 . 1 . . . . A 54 GLN HA . 30926 1 591 . 1 . 1 54 54 GLN HB2 H 1 2.032 0.05 . 2 . . . . A 54 GLN HB2 . 30926 1 592 . 1 . 1 54 54 GLN HB3 H 1 2.182 0.05 . 2 . . . . A 54 GLN HB3 . 30926 1 593 . 1 . 1 54 54 GLN HG2 H 1 2.326 0.05 . 2 . . . . A 54 GLN HG2 . 30926 1 594 . 1 . 1 54 54 GLN HG3 H 1 2.326 0.05 . 2 . . . . A 54 GLN HG3 . 30926 1 595 . 1 . 1 54 54 GLN HE21 H 1 6.817 0.05 . 2 . . . . A 54 GLN HE21 . 30926 1 596 . 1 . 1 54 54 GLN HE22 H 1 7.575 0.05 . 2 . . . . A 54 GLN HE22 . 30926 1 597 . 1 . 1 54 54 GLN C C 13 176.455 0.50 . 1 . . . . A 54 GLN C . 30926 1 598 . 1 . 1 54 54 GLN CA C 13 55.880 0.50 . 1 . . . . A 54 GLN CA . 30926 1 599 . 1 . 1 54 54 GLN CB C 13 29.122 0.50 . 1 . . . . A 54 GLN CB . 30926 1 600 . 1 . 1 54 54 GLN CG C 13 34.055 0.50 . 1 . . . . A 54 GLN CG . 30926 1 601 . 1 . 1 54 54 GLN N N 15 120.300 0.10 . 1 . . . . A 54 GLN N . 30926 1 602 . 1 . 1 54 54 GLN NE2 N 15 112.824 0.10 . 1 . . . . A 54 GLN NE2 . 30926 1 603 . 1 . 1 55 55 GLY H H 1 8.243 0.05 . 1 . . . . A 55 GLY H . 30926 1 604 . 1 . 1 55 55 GLY HA2 H 1 3.913 0.05 . 2 . . . . A 55 GLY HA2 . 30926 1 605 . 1 . 1 55 55 GLY HA3 H 1 4.165 0.05 . 2 . . . . A 55 GLY HA3 . 30926 1 606 . 1 . 1 55 55 GLY C C 13 173.943 0.50 . 1 . . . . A 55 GLY C . 30926 1 607 . 1 . 1 55 55 GLY CA C 13 45.475 0.50 . 1 . . . . A 55 GLY CA . 30926 1 608 . 1 . 1 55 55 GLY N N 15 109.027 0.10 . 1 . . . . A 55 GLY N . 30926 1 609 . 1 . 1 56 56 THR H H 1 7.993 0.05 . 1 . . . . A 56 THR H . 30926 1 610 . 1 . 1 56 56 THR HA H 1 4.420 0.05 . 1 . . . . A 56 THR HA . 30926 1 611 . 1 . 1 56 56 THR HB H 1 4.167 0.05 . 1 . . . . A 56 THR HB . 30926 1 612 . 1 . 1 56 56 THR HG21 H 1 1.044 0.05 . 1 . . . . A 56 THR HG21 . 30926 1 613 . 1 . 1 56 56 THR HG22 H 1 1.044 0.05 . 1 . . . . A 56 THR HG22 . 30926 1 614 . 1 . 1 56 56 THR HG23 H 1 1.044 0.05 . 1 . . . . A 56 THR HG23 . 30926 1 615 . 1 . 1 56 56 THR C C 13 173.956 0.50 . 1 . . . . A 56 THR C . 30926 1 616 . 1 . 1 56 56 THR CA C 13 61.543 0.50 . 1 . . . . A 56 THR CA . 30926 1 617 . 1 . 1 56 56 THR CB C 13 69.638 0.50 . 1 . . . . A 56 THR CB . 30926 1 618 . 1 . 1 56 56 THR CG2 C 13 21.206 0.50 . 1 . . . . A 56 THR CG2 . 30926 1 619 . 1 . 1 56 56 THR N N 15 113.718 0.10 . 1 . . . . A 56 THR N . 30926 1 620 . 1 . 1 57 57 ASN H H 1 8.512 0.05 . 1 . . . . A 57 ASN H . 30926 1 621 . 1 . 1 57 57 ASN HA H 1 3.906 0.05 . 1 . . . . A 57 ASN HA . 30926 1 622 . 1 . 1 57 57 ASN HB2 H 1 2.875 0.05 . 2 . . . . A 57 ASN HB2 . 30926 1 623 . 1 . 1 57 57 ASN HB3 H 1 2.887 0.05 . 2 . . . . A 57 ASN HB3 . 30926 1 624 . 1 . 1 57 57 ASN HD21 H 1 6.935 0.05 . 2 . . . . A 57 ASN HD21 . 30926 1 625 . 1 . 1 57 57 ASN HD22 H 1 7.628 0.05 . 2 . . . . A 57 ASN HD22 . 30926 1 626 . 1 . 1 57 57 ASN C C 13 175.020 0.50 . 1 . . . . A 57 ASN C . 30926 1 627 . 1 . 1 57 57 ASN CA C 13 52.285 0.50 . 1 . . . . A 57 ASN CA . 30926 1 628 . 1 . 1 57 57 ASN CB C 13 39.404 0.50 . 1 . . . . A 57 ASN CB . 30926 1 629 . 1 . 1 57 57 ASN N N 15 119.784 0.10 . 1 . . . . A 57 ASN N . 30926 1 630 . 1 . 1 57 57 ASN ND2 N 15 113.259 0.10 . 1 . . . . A 57 ASN ND2 . 30926 1 631 . 1 . 1 58 58 ALA H H 1 8.727 0.05 . 1 . . . . A 58 ALA H . 30926 1 632 . 1 . 1 58 58 ALA HA H 1 3.674 0.05 . 1 . . . . A 58 ALA HA . 30926 1 633 . 1 . 1 58 58 ALA HB1 H 1 1.291 0.05 . 1 . . . . A 58 ALA HB1 . 30926 1 634 . 1 . 1 58 58 ALA HB2 H 1 1.291 0.05 . 1 . . . . A 58 ALA HB2 . 30926 1 635 . 1 . 1 58 58 ALA HB3 H 1 1.291 0.05 . 1 . . . . A 58 ALA HB3 . 30926 1 636 . 1 . 1 58 58 ALA C C 13 177.807 0.50 . 1 . . . . A 58 ALA C . 30926 1 637 . 1 . 1 58 58 ALA CA C 13 54.930 0.50 . 1 . . . . A 58 ALA CA . 30926 1 638 . 1 . 1 58 58 ALA CB C 13 17.831 0.50 . 1 . . . . A 58 ALA CB . 30926 1 639 . 1 . 1 58 58 ALA N N 15 122.518 0.10 . 1 . . . . A 58 ALA N . 30926 1 640 . 1 . 1 59 59 TYR H H 1 8.002 0.05 . 1 . . . . A 59 TYR H . 30926 1 641 . 1 . 1 59 59 TYR HA H 1 4.056 0.05 . 1 . . . . A 59 TYR HA . 30926 1 642 . 1 . 1 59 59 TYR HB2 H 1 2.961 0.05 . 2 . . . . A 59 TYR HB2 . 30926 1 643 . 1 . 1 59 59 TYR HB3 H 1 3.035 0.05 . 2 . . . . A 59 TYR HB3 . 30926 1 644 . 1 . 1 59 59 TYR HD1 H 1 7.047 0.05 . 3 . . . . A 59 TYR HD1 . 30926 1 645 . 1 . 1 59 59 TYR HD2 H 1 7.045 0.05 . 3 . . . . A 59 TYR HD2 . 30926 1 646 . 1 . 1 59 59 TYR HE1 H 1 6.726 0.05 . 3 . . . . A 59 TYR HE1 . 30926 1 647 . 1 . 1 59 59 TYR HE2 H 1 6.726 0.05 . 3 . . . . A 59 TYR HE2 . 30926 1 648 . 1 . 1 59 59 TYR C C 13 178.357 0.50 . 1 . . . . A 59 TYR C . 30926 1 649 . 1 . 1 59 59 TYR CA C 13 61.230 0.50 . 1 . . . . A 59 TYR CA . 30926 1 650 . 1 . 1 59 59 TYR CB C 13 37.623 0.50 . 1 . . . . A 59 TYR CB . 30926 1 651 . 1 . 1 59 59 TYR CD1 C 13 133.100 0.50 . 3 . . . . A 59 TYR CD1 . 30926 1 652 . 1 . 1 59 59 TYR CD2 C 13 133.100 0.50 . 3 . . . . A 59 TYR CD2 . 30926 1 653 . 1 . 1 59 59 TYR CE1 C 13 118.193 0.50 . 3 . . . . A 59 TYR CE1 . 30926 1 654 . 1 . 1 59 59 TYR CE2 C 13 118.194 0.50 . 3 . . . . A 59 TYR CE2 . 30926 1 655 . 1 . 1 59 59 TYR N N 15 116.901 0.10 . 1 . . . . A 59 TYR N . 30926 1 656 . 1 . 1 60 60 GLY H H 1 8.414 0.05 . 1 . . . . A 60 GLY H . 30926 1 657 . 1 . 1 60 60 GLY HA2 H 1 3.831 0.05 . 2 . . . . A 60 GLY HA2 . 30926 1 658 . 1 . 1 60 60 GLY HA3 H 1 4.022 0.05 . 2 . . . . A 60 GLY HA3 . 30926 1 659 . 1 . 1 60 60 GLY C C 13 176.320 0.50 . 1 . . . . A 60 GLY C . 30926 1 660 . 1 . 1 60 60 GLY CA C 13 46.821 0.50 . 1 . . . . A 60 GLY CA . 30926 1 661 . 1 . 1 60 60 GLY N N 15 108.633 0.10 . 1 . . . . A 60 GLY N . 30926 1 662 . 1 . 1 61 61 LEU H H 1 7.688 0.05 . 1 . . . . A 61 LEU H . 30926 1 663 . 1 . 1 61 61 LEU HA H 1 3.774 0.05 . 1 . . . . A 61 LEU HA . 30926 1 664 . 1 . 1 61 61 LEU HB2 H 1 1.017 0.05 . 2 . . . . A 61 LEU HB2 . 30926 1 665 . 1 . 1 61 61 LEU HB3 H 1 1.672 0.05 . 2 . . . . A 61 LEU HB3 . 30926 1 666 . 1 . 1 61 61 LEU HG H 1 1.343 0.05 . 1 . . . . A 61 LEU HG . 30926 1 667 . 1 . 1 61 61 LEU HD11 H 1 0.038 0.05 . 2 . . . . A 61 LEU HD11 . 30926 1 668 . 1 . 1 61 61 LEU HD12 H 1 0.038 0.05 . 2 . . . . A 61 LEU HD12 . 30926 1 669 . 1 . 1 61 61 LEU HD13 H 1 0.038 0.05 . 2 . . . . A 61 LEU HD13 . 30926 1 670 . 1 . 1 61 61 LEU HD21 H 1 0.250 0.05 . 2 . . . . A 61 LEU HD21 . 30926 1 671 . 1 . 1 61 61 LEU HD22 H 1 0.250 0.05 . 2 . . . . A 61 LEU HD22 . 30926 1 672 . 1 . 1 61 61 LEU HD23 H 1 0.250 0.05 . 2 . . . . A 61 LEU HD23 . 30926 1 673 . 1 . 1 61 61 LEU C C 13 178.291 0.50 . 1 . . . . A 61 LEU C . 30926 1 674 . 1 . 1 61 61 LEU CA C 13 57.766 0.50 . 1 . . . . A 61 LEU CA . 30926 1 675 . 1 . 1 61 61 LEU CB C 13 42.001 0.50 . 1 . . . . A 61 LEU CB . 30926 1 676 . 1 . 1 61 61 LEU CG C 13 26.347 0.50 . 1 . . . . A 61 LEU CG . 30926 1 677 . 1 . 1 61 61 LEU CD1 C 13 24.767 0.50 . 2 . . . . A 61 LEU CD1 . 30926 1 678 . 1 . 1 61 61 LEU CD2 C 13 23.206 0.50 . 2 . . . . A 61 LEU CD2 . 30926 1 679 . 1 . 1 61 61 LEU N N 15 121.108 0.10 . 1 . . . . A 61 LEU N . 30926 1 680 . 1 . 1 62 62 ILE H H 1 8.047 0.05 . 1 . . . . A 62 ILE H . 30926 1 681 . 1 . 1 62 62 ILE HA H 1 3.137 0.05 . 1 . . . . A 62 ILE HA . 30926 1 682 . 1 . 1 62 62 ILE HB H 1 1.710 0.05 . 1 . . . . A 62 ILE HB . 30926 1 683 . 1 . 1 62 62 ILE HG12 H 1 0.582 0.05 . 2 . . . . A 62 ILE HG12 . 30926 1 684 . 1 . 1 62 62 ILE HG13 H 1 1.593 0.05 . 2 . . . . A 62 ILE HG13 . 30926 1 685 . 1 . 1 62 62 ILE HG21 H 1 0.749 0.05 . 1 . . . . A 62 ILE HG21 . 30926 1 686 . 1 . 1 62 62 ILE HG22 H 1 0.749 0.05 . 1 . . . . A 62 ILE HG22 . 30926 1 687 . 1 . 1 62 62 ILE HG23 H 1 0.749 0.05 . 1 . . . . A 62 ILE HG23 . 30926 1 688 . 1 . 1 62 62 ILE HD11 H 1 0.723 0.05 . 1 . . . . A 62 ILE HD11 . 30926 1 689 . 1 . 1 62 62 ILE HD12 H 1 0.723 0.05 . 1 . . . . A 62 ILE HD12 . 30926 1 690 . 1 . 1 62 62 ILE HD13 H 1 0.723 0.05 . 1 . . . . A 62 ILE HD13 . 30926 1 691 . 1 . 1 62 62 ILE C C 13 177.212 0.50 . 1 . . . . A 62 ILE C . 30926 1 692 . 1 . 1 62 62 ILE CA C 13 65.492 0.50 . 1 . . . . A 62 ILE CA . 30926 1 693 . 1 . 1 62 62 ILE CB C 13 38.116 0.50 . 1 . . . . A 62 ILE CB . 30926 1 694 . 1 . 1 62 62 ILE CG1 C 13 30.895 0.50 . 1 . . . . A 62 ILE CG1 . 30926 1 695 . 1 . 1 62 62 ILE CG2 C 13 17.196 0.50 . 1 . . . . A 62 ILE CG2 . 30926 1 696 . 1 . 1 62 62 ILE CD1 C 13 13.609 0.50 . 1 . . . . A 62 ILE CD1 . 30926 1 697 . 1 . 1 62 62 ILE N N 15 119.480 0.10 . 1 . . . . A 62 ILE N . 30926 1 698 . 1 . 1 63 63 HIS H H 1 8.083 0.05 . 1 . . . . A 63 HIS H . 30926 1 699 . 1 . 1 63 63 HIS HA H 1 4.080 0.05 . 1 . . . . A 63 HIS HA . 30926 1 700 . 1 . 1 63 63 HIS HB2 H 1 2.905 0.05 . 2 . . . . A 63 HIS HB2 . 30926 1 701 . 1 . 1 63 63 HIS HB3 H 1 3.076 0.05 . 2 . . . . A 63 HIS HB3 . 30926 1 702 . 1 . 1 63 63 HIS HD2 H 1 7.035 0.05 . 1 . . . . A 63 HIS HD2 . 30926 1 703 . 1 . 1 63 63 HIS HE1 H 1 7.811 0.05 . 1 . . . . A 63 HIS HE1 . 30926 1 704 . 1 . 1 63 63 HIS C C 13 178.191 0.50 . 1 . . . . A 63 HIS C . 30926 1 705 . 1 . 1 63 63 HIS CA C 13 59.993 0.50 . 1 . . . . A 63 HIS CA . 30926 1 706 . 1 . 1 63 63 HIS CB C 13 29.948 0.50 . 1 . . . . A 63 HIS CB . 30926 1 707 . 1 . 1 63 63 HIS CD2 C 13 119.766 0.50 . 1 . . . . A 63 HIS CD2 . 30926 1 708 . 1 . 1 63 63 HIS CE1 C 13 138.156 0.50 . 1 . . . . A 63 HIS CE1 . 30926 1 709 . 1 . 1 63 63 HIS N N 15 118.396 0.10 . 1 . . . . A 63 HIS N . 30926 1 710 . 1 . 1 64 64 ALA H H 1 8.015 0.05 . 1 . . . . A 64 ALA H . 30926 1 711 . 1 . 1 64 64 ALA HA H 1 3.876 0.05 . 1 . . . . A 64 ALA HA . 30926 1 712 . 1 . 1 64 64 ALA HB1 H 1 1.164 0.05 . 1 . . . . A 64 ALA HB1 . 30926 1 713 . 1 . 1 64 64 ALA HB2 H 1 1.164 0.05 . 1 . . . . A 64 ALA HB2 . 30926 1 714 . 1 . 1 64 64 ALA HB3 H 1 1.164 0.05 . 1 . . . . A 64 ALA HB3 . 30926 1 715 . 1 . 1 64 64 ALA C C 13 178.580 0.50 . 1 . . . . A 64 ALA C . 30926 1 716 . 1 . 1 64 64 ALA CA C 13 54.793 0.50 . 1 . . . . A 64 ALA CA . 30926 1 717 . 1 . 1 64 64 ALA CB C 13 19.671 0.50 . 1 . . . . A 64 ALA CB . 30926 1 718 . 1 . 1 64 64 ALA N N 15 120.856 0.10 . 1 . . . . A 64 ALA N . 30926 1 719 . 1 . 1 65 65 ALA H H 1 8.383 0.05 . 1 . . . . A 65 ALA H . 30926 1 720 . 1 . 1 65 65 ALA HA H 1 3.797 0.05 . 1 . . . . A 65 ALA HA . 30926 1 721 . 1 . 1 65 65 ALA HB1 H 1 1.145 0.05 . 1 . . . . A 65 ALA HB1 . 30926 1 722 . 1 . 1 65 65 ALA HB2 H 1 1.145 0.05 . 1 . . . . A 65 ALA HB2 . 30926 1 723 . 1 . 1 65 65 ALA HB3 H 1 1.145 0.05 . 1 . . . . A 65 ALA HB3 . 30926 1 724 . 1 . 1 65 65 ALA C C 13 180.182 0.50 . 1 . . . . A 65 ALA C . 30926 1 725 . 1 . 1 65 65 ALA CA C 13 55.395 0.50 . 1 . . . . A 65 ALA CA . 30926 1 726 . 1 . 1 65 65 ALA CB C 13 17.902 0.50 . 1 . . . . A 65 ALA CB . 30926 1 727 . 1 . 1 65 65 ALA N N 15 118.913 0.10 . 1 . . . . A 65 ALA N . 30926 1 728 . 1 . 1 66 66 LYS H H 1 8.099 0.05 . 1 . . . . A 66 LYS H . 30926 1 729 . 1 . 1 66 66 LYS HA H 1 4.715 0.05 . 1 . . . . A 66 LYS HA . 30926 1 730 . 1 . 1 66 66 LYS HB2 H 1 1.866 0.05 . 2 . . . . A 66 LYS HB2 . 30926 1 731 . 1 . 1 66 66 LYS HB3 H 1 1.866 0.05 . 2 . . . . A 66 LYS HB3 . 30926 1 732 . 1 . 1 66 66 LYS HG2 H 1 1.502 0.05 . 2 . . . . A 66 LYS HG2 . 30926 1 733 . 1 . 1 66 66 LYS HG3 H 1 1.692 0.05 . 2 . . . . A 66 LYS HG3 . 30926 1 734 . 1 . 1 66 66 LYS HD2 H 1 1.685 0.05 . 2 . . . . A 66 LYS HD2 . 30926 1 735 . 1 . 1 66 66 LYS HD3 H 1 1.685 0.05 . 2 . . . . A 66 LYS HD3 . 30926 1 736 . 1 . 1 66 66 LYS HE2 H 1 2.907 0.05 . 2 . . . . A 66 LYS HE2 . 30926 1 737 . 1 . 1 66 66 LYS HE3 H 1 3.003 0.05 . 2 . . . . A 66 LYS HE3 . 30926 1 738 . 1 . 1 66 66 LYS C C 13 176.625 0.50 . 1 . . . . A 66 LYS C . 30926 1 739 . 1 . 1 66 66 LYS CA C 13 59.069 0.50 . 1 . . . . A 66 LYS CA . 30926 1 740 . 1 . 1 66 66 LYS CB C 13 31.719 0.50 . 1 . . . . A 66 LYS CB . 30926 1 741 . 1 . 1 66 66 LYS CG C 13 25.654 0.50 . 1 . . . . A 66 LYS CG . 30926 1 742 . 1 . 1 66 66 LYS CD C 13 29.604 0.50 . 1 . . . . A 66 LYS CD . 30926 1 743 . 1 . 1 66 66 LYS CE C 13 41.709 0.50 . 1 . . . . A 66 LYS CE . 30926 1 744 . 1 . 1 66 66 LYS N N 15 118.396 0.10 . 1 . . . . A 66 LYS N . 30926 1 745 . 1 . 1 67 67 GLN H H 1 7.678 0.05 . 1 . . . . A 67 GLN H . 30926 1 746 . 1 . 1 67 67 GLN HA H 1 3.947 0.05 . 1 . . . . A 67 GLN HA . 30926 1 747 . 1 . 1 67 67 GLN HB2 H 1 2.050 0.05 . 2 . . . . A 67 GLN HB2 . 30926 1 748 . 1 . 1 67 67 GLN HB3 H 1 2.197 0.05 . 2 . . . . A 67 GLN HB3 . 30926 1 749 . 1 . 1 67 67 GLN HG2 H 1 2.155 0.05 . 2 . . . . A 67 GLN HG2 . 30926 1 750 . 1 . 1 67 67 GLN HG3 H 1 2.241 0.05 . 2 . . . . A 67 GLN HG3 . 30926 1 751 . 1 . 1 67 67 GLN HE21 H 1 6.825 0.05 . 2 . . . . A 67 GLN HE21 . 30926 1 752 . 1 . 1 67 67 GLN HE22 H 1 6.872 0.05 . 2 . . . . A 67 GLN HE22 . 30926 1 753 . 1 . 1 67 67 GLN C C 13 178.029 0.50 . 1 . . . . A 67 GLN C . 30926 1 754 . 1 . 1 67 67 GLN CA C 13 58.370 0.50 . 1 . . . . A 67 GLN CA . 30926 1 755 . 1 . 1 67 67 GLN CB C 13 28.717 0.50 . 1 . . . . A 67 GLN CB . 30926 1 756 . 1 . 1 67 67 GLN CG C 13 34.065 0.50 . 1 . . . . A 67 GLN CG . 30926 1 757 . 1 . 1 67 67 GLN N N 15 120.380 0.10 . 1 . . . . A 67 GLN N . 30926 1 758 . 1 . 1 67 67 GLN NE2 N 15 112.008 0.10 . 1 . . . . A 67 GLN NE2 . 30926 1 759 . 1 . 1 68 68 LEU H H 1 7.600 0.05 . 1 . . . . A 68 LEU H . 30926 1 760 . 1 . 1 68 68 LEU HA H 1 4.162 0.05 . 1 . . . . A 68 LEU HA . 30926 1 761 . 1 . 1 68 68 LEU HB2 H 1 1.653 0.05 . 2 . . . . A 68 LEU HB2 . 30926 1 762 . 1 . 1 68 68 LEU HB3 H 1 2.105 0.05 . 2 . . . . A 68 LEU HB3 . 30926 1 763 . 1 . 1 68 68 LEU HG H 1 1.898 0.05 . 1 . . . . A 68 LEU HG . 30926 1 764 . 1 . 1 68 68 LEU HD11 H 1 0.782 0.05 . 2 . . . . A 68 LEU HD11 . 30926 1 765 . 1 . 1 68 68 LEU HD12 H 1 0.782 0.05 . 2 . . . . A 68 LEU HD12 . 30926 1 766 . 1 . 1 68 68 LEU HD13 H 1 0.782 0.05 . 2 . . . . A 68 LEU HD13 . 30926 1 767 . 1 . 1 68 68 LEU HD21 H 1 0.754 0.05 . 2 . . . . A 68 LEU HD21 . 30926 1 768 . 1 . 1 68 68 LEU HD22 H 1 0.754 0.05 . 2 . . . . A 68 LEU HD22 . 30926 1 769 . 1 . 1 68 68 LEU HD23 H 1 0.754 0.05 . 2 . . . . A 68 LEU HD23 . 30926 1 770 . 1 . 1 68 68 LEU C C 13 175.799 0.50 . 1 . . . . A 68 LEU C . 30926 1 771 . 1 . 1 68 68 LEU CA C 13 55.076 0.50 . 1 . . . . A 68 LEU CA . 30926 1 772 . 1 . 1 68 68 LEU CB C 13 42.634 0.50 . 1 . . . . A 68 LEU CB . 30926 1 773 . 1 . 1 68 68 LEU CG C 13 26.163 0.50 . 1 . . . . A 68 LEU CG . 30926 1 774 . 1 . 1 68 68 LEU CD1 C 13 23.129 0.50 . 2 . . . . A 68 LEU CD1 . 30926 1 775 . 1 . 1 68 68 LEU CD2 C 13 25.815 0.50 . 2 . . . . A 68 LEU CD2 . 30926 1 776 . 1 . 1 68 68 LEU N N 15 117.736 0.10 . 1 . . . . A 68 LEU N . 30926 1 777 . 1 . 1 69 69 GLY H H 1 7.583 0.05 . 1 . . . . A 69 GLY H . 30926 1 778 . 1 . 1 69 69 GLY HA2 H 1 3.578 0.05 . 2 . . . . A 69 GLY HA2 . 30926 1 779 . 1 . 1 69 69 GLY HA3 H 1 4.145 0.05 . 2 . . . . A 69 GLY HA3 . 30926 1 780 . 1 . 1 69 69 GLY C C 13 175.233 0.50 . 1 . . . . A 69 GLY C . 30926 1 781 . 1 . 1 69 69 GLY CA C 13 44.880 0.50 . 1 . . . . A 69 GLY CA . 30926 1 782 . 1 . 1 69 69 GLY N N 15 103.249 0.10 . 1 . . . . A 69 GLY N . 30926 1 783 . 1 . 1 70 70 PHE H H 1 8.048 0.05 . 1 . . . . A 70 PHE H . 30926 1 784 . 1 . 1 70 70 PHE HA H 1 4.491 0.05 . 1 . . . . A 70 PHE HA . 30926 1 785 . 1 . 1 70 70 PHE HB2 H 1 2.456 0.05 . 2 . . . . A 70 PHE HB2 . 30926 1 786 . 1 . 1 70 70 PHE HB3 H 1 2.627 0.05 . 2 . . . . A 70 PHE HB3 . 30926 1 787 . 1 . 1 70 70 PHE HD1 H 1 6.886 0.05 . 3 . . . . A 70 PHE HD1 . 30926 1 788 . 1 . 1 70 70 PHE HD2 H 1 6.897 0.05 . 3 . . . . A 70 PHE HD2 . 30926 1 789 . 1 . 1 70 70 PHE HE1 H 1 6.680 0.05 . 3 . . . . A 70 PHE HE1 . 30926 1 790 . 1 . 1 70 70 PHE HE2 H 1 6.689 0.05 . 3 . . . . A 70 PHE HE2 . 30926 1 791 . 1 . 1 70 70 PHE HZ H 1 6.913 0.05 . 1 . . . . A 70 PHE HZ . 30926 1 792 . 1 . 1 70 70 PHE C C 13 177.096 0.50 . 1 . . . . A 70 PHE C . 30926 1 793 . 1 . 1 70 70 PHE CA C 13 58.063 0.50 . 1 . . . . A 70 PHE CA . 30926 1 794 . 1 . 1 70 70 PHE CB C 13 39.125 0.50 . 1 . . . . A 70 PHE CB . 30926 1 795 . 1 . 1 70 70 PHE CD1 C 13 131.473 0.50 . 3 . . . . A 70 PHE CD1 . 30926 1 796 . 1 . 1 70 70 PHE CE1 C 13 130.605 0.50 . 3 . . . . A 70 PHE CE1 . 30926 1 797 . 1 . 1 70 70 PHE CZ C 13 129.085 0.50 . 1 . . . . A 70 PHE CZ . 30926 1 798 . 1 . 1 70 70 PHE N N 15 117.802 0.10 . 1 . . . . A 70 PHE N . 30926 1 799 . 1 . 1 71 71 SER H H 1 8.810 0.05 . 1 . . . . A 71 SER H . 30926 1 800 . 1 . 1 71 71 SER HA H 1 4.632 0.05 . 1 . . . . A 71 SER HA . 30926 1 801 . 1 . 1 71 71 SER HB2 H 1 3.784 0.05 . 2 . . . . A 71 SER HB2 . 30926 1 802 . 1 . 1 71 71 SER HB3 H 1 3.719 0.05 . 2 . . . . A 71 SER HB3 . 30926 1 803 . 1 . 1 71 71 SER C C 13 173.721 0.50 . 1 . . . . A 71 SER C . 30926 1 804 . 1 . 1 71 71 SER CA C 13 57.877 0.50 . 1 . . . . A 71 SER CA . 30926 1 805 . 1 . 1 71 71 SER CB C 13 62.978 0.50 . 1 . . . . A 71 SER CB . 30926 1 806 . 1 . 1 71 71 SER N N 15 116.275 0.10 . 1 . . . . A 71 SER N . 30926 1 807 . 1 . 1 72 72 ALA H H 1 8.117 0.05 . 1 . . . . A 72 ALA H . 30926 1 808 . 1 . 1 72 72 ALA HA H 1 5.617 0.05 . 1 . . . . A 72 ALA HA . 30926 1 809 . 1 . 1 72 72 ALA HB1 H 1 1.053 0.05 . 1 . . . . A 72 ALA HB1 . 30926 1 810 . 1 . 1 72 72 ALA HB2 H 1 1.053 0.05 . 1 . . . . A 72 ALA HB2 . 30926 1 811 . 1 . 1 72 72 ALA HB3 H 1 1.053 0.05 . 1 . . . . A 72 ALA HB3 . 30926 1 812 . 1 . 1 72 72 ALA C C 13 175.125 0.50 . 1 . . . . A 72 ALA C . 30926 1 813 . 1 . 1 72 72 ALA CA C 13 50.373 0.50 . 1 . . . . A 72 ALA CA . 30926 1 814 . 1 . 1 72 72 ALA CB C 13 24.405 0.50 . 1 . . . . A 72 ALA CB . 30926 1 815 . 1 . 1 72 72 ALA N N 15 128.894 0.10 . 1 . . . . A 72 ALA N . 30926 1 816 . 1 . 1 73 73 LYS H H 1 8.566 0.05 . 1 . . . . A 73 LYS H . 30926 1 817 . 1 . 1 73 73 LYS HA H 1 4.501 0.05 . 1 . . . . A 73 LYS HA . 30926 1 818 . 1 . 1 73 73 LYS HB2 H 1 1.753 0.05 . 2 . . . . A 73 LYS HB2 . 30926 1 819 . 1 . 1 73 73 LYS HB3 H 1 1.671 0.05 . 2 . . . . A 73 LYS HB3 . 30926 1 820 . 1 . 1 73 73 LYS HG2 H 1 1.137 0.05 . 2 . . . . A 73 LYS HG2 . 30926 1 821 . 1 . 1 73 73 LYS HG3 H 1 1.308 0.05 . 2 . . . . A 73 LYS HG3 . 30926 1 822 . 1 . 1 73 73 LYS HD2 H 1 1.521 0.05 . 2 . . . . A 73 LYS HD2 . 30926 1 823 . 1 . 1 73 73 LYS HD3 H 1 1.523 0.05 . 2 . . . . A 73 LYS HD3 . 30926 1 824 . 1 . 1 73 73 LYS HE2 H 1 2.781 0.05 . 2 . . . . A 73 LYS HE2 . 30926 1 825 . 1 . 1 73 73 LYS HE3 H 1 2.783 0.05 . 2 . . . . A 73 LYS HE3 . 30926 1 826 . 1 . 1 73 73 LYS C C 13 173.538 0.50 . 1 . . . . A 73 LYS C . 30926 1 827 . 1 . 1 73 73 LYS CA C 13 55.202 0.50 . 1 . . . . A 73 LYS CA . 30926 1 828 . 1 . 1 73 73 LYS CB C 13 35.839 0.50 . 1 . . . . A 73 LYS CB . 30926 1 829 . 1 . 1 73 73 LYS CG C 13 23.744 0.50 . 1 . . . . A 73 LYS CG . 30926 1 830 . 1 . 1 73 73 LYS CD C 13 29.237 0.50 . 1 . . . . A 73 LYS CD . 30926 1 831 . 1 . 1 73 73 LYS CE C 13 41.953 0.50 . 1 . . . . A 73 LYS CE . 30926 1 832 . 1 . 1 73 73 LYS N N 15 118.798 0.10 . 1 . . . . A 73 LYS N . 30926 1 833 . 1 . 1 74 74 GLY H H 1 8.881 0.05 . 1 . . . . A 74 GLY H . 30926 1 834 . 1 . 1 74 74 GLY HA2 H 1 3.506 0.05 . 2 . . . . A 74 GLY HA2 . 30926 1 835 . 1 . 1 74 74 GLY HA3 H 1 5.054 0.05 . 2 . . . . A 74 GLY HA3 . 30926 1 836 . 1 . 1 74 74 GLY C C 13 173.380 0.50 . 1 . . . . A 74 GLY C . 30926 1 837 . 1 . 1 74 74 GLY CA C 13 44.204 0.50 . 1 . . . . A 74 GLY CA . 30926 1 838 . 1 . 1 74 74 GLY N N 15 111.645 0.10 . 1 . . . . A 74 GLY N . 30926 1 839 . 1 . 1 75 75 VAL H H 1 8.812 0.05 . 1 . . . . A 75 VAL H . 30926 1 840 . 1 . 1 75 75 VAL HA H 1 4.548 0.05 . 1 . . . . A 75 VAL HA . 30926 1 841 . 1 . 1 75 75 VAL HB H 1 1.969 0.05 . 1 . . . . A 75 VAL HB . 30926 1 842 . 1 . 1 75 75 VAL HG11 H 1 0.692 0.05 . 2 . . . . A 75 VAL HG11 . 30926 1 843 . 1 . 1 75 75 VAL HG12 H 1 0.692 0.05 . 2 . . . . A 75 VAL HG12 . 30926 1 844 . 1 . 1 75 75 VAL HG13 H 1 0.692 0.05 . 2 . . . . A 75 VAL HG13 . 30926 1 845 . 1 . 1 75 75 VAL HG21 H 1 0.753 0.05 . 2 . . . . A 75 VAL HG21 . 30926 1 846 . 1 . 1 75 75 VAL HG22 H 1 0.753 0.05 . 2 . . . . A 75 VAL HG22 . 30926 1 847 . 1 . 1 75 75 VAL HG23 H 1 0.753 0.05 . 2 . . . . A 75 VAL HG23 . 30926 1 848 . 1 . 1 75 75 VAL C C 13 173.950 0.50 . 1 . . . . A 75 VAL C . 30926 1 849 . 1 . 1 75 75 VAL CA C 13 59.581 0.50 . 1 . . . . A 75 VAL CA . 30926 1 850 . 1 . 1 75 75 VAL CB C 13 36.324 0.50 . 1 . . . . A 75 VAL CB . 30926 1 851 . 1 . 1 75 75 VAL CG1 C 13 19.938 0.50 . 2 . . . . A 75 VAL CG1 . 30926 1 852 . 1 . 1 75 75 VAL CG2 C 13 21.183 0.50 . 2 . . . . A 75 VAL CG2 . 30926 1 853 . 1 . 1 75 75 VAL N N 15 119.419 0.10 . 1 . . . . A 75 VAL N . 30926 1 854 . 1 . 1 76 76 LYS H H 1 8.257 0.05 . 1 . . . . A 76 LYS H . 30926 1 855 . 1 . 1 76 76 LYS HA H 1 4.592 0.05 . 1 . . . . A 76 LYS HA . 30926 1 856 . 1 . 1 76 76 LYS HB2 H 1 1.504 0.05 . 2 . . . . A 76 LYS HB2 . 30926 1 857 . 1 . 1 76 76 LYS HB3 H 1 1.624 0.05 . 2 . . . . A 76 LYS HB3 . 30926 1 858 . 1 . 1 76 76 LYS HG2 H 1 1.160 0.05 . 2 . . . . A 76 LYS HG2 . 30926 1 859 . 1 . 1 76 76 LYS HG3 H 1 1.160 0.05 . 2 . . . . A 76 LYS HG3 . 30926 1 860 . 1 . 1 76 76 LYS HD2 H 1 1.470 0.05 . 2 . . . . A 76 LYS HD2 . 30926 1 861 . 1 . 1 76 76 LYS HD3 H 1 1.471 0.05 . 2 . . . . A 76 LYS HD3 . 30926 1 862 . 1 . 1 76 76 LYS HE2 H 1 2.821 0.05 . 2 . . . . A 76 LYS HE2 . 30926 1 863 . 1 . 1 76 76 LYS HE3 H 1 2.822 0.05 . 2 . . . . A 76 LYS HE3 . 30926 1 864 . 1 . 1 76 76 LYS C C 13 174.947 0.50 . 1 . . . . A 76 LYS C . 30926 1 865 . 1 . 1 76 76 LYS CA C 13 54.953 0.50 . 1 . . . . A 76 LYS CA . 30926 1 866 . 1 . 1 76 76 LYS CB C 13 32.631 0.50 . 1 . . . . A 76 LYS CB . 30926 1 867 . 1 . 1 76 76 LYS CG C 13 24.618 0.50 . 1 . . . . A 76 LYS CG . 30926 1 868 . 1 . 1 76 76 LYS CD C 13 28.759 0.50 . 1 . . . . A 76 LYS CD . 30926 1 869 . 1 . 1 76 76 LYS CE C 13 41.894 0.50 . 1 . . . . A 76 LYS CE . 30926 1 870 . 1 . 1 76 76 LYS N N 15 124.056 0.10 . 1 . . . . A 76 LYS N . 30926 1 871 . 1 . 1 77 77 ALA H H 1 9.051 0.05 . 1 . . . . A 77 ALA H . 30926 1 872 . 1 . 1 77 77 ALA HA H 1 4.699 0.05 . 1 . . . . A 77 ALA HA . 30926 1 873 . 1 . 1 77 77 ALA HB1 H 1 1.498 0.05 . 1 . . . . A 77 ALA HB1 . 30926 1 874 . 1 . 1 77 77 ALA HB2 H 1 1.498 0.05 . 1 . . . . A 77 ALA HB2 . 30926 1 875 . 1 . 1 77 77 ALA HB3 H 1 1.498 0.05 . 1 . . . . A 77 ALA HB3 . 30926 1 876 . 1 . 1 77 77 ALA C C 13 174.770 0.50 . 1 . . . . A 77 ALA C . 30926 1 877 . 1 . 1 77 77 ALA CA C 13 50.309 0.50 . 1 . . . . A 77 ALA CA . 30926 1 878 . 1 . 1 77 77 ALA CB C 13 22.592 0.50 . 1 . . . . A 77 ALA CB . 30926 1 879 . 1 . 1 77 77 ALA N N 15 130.845 0.10 . 1 . . . . A 77 ALA N . 30926 1 880 . 1 . 1 78 78 SER H H 1 9.163 0.05 . 1 . . . . A 78 SER H . 30926 1 881 . 1 . 1 78 78 SER HA H 1 4.604 0.05 . 1 . . . . A 78 SER HA . 30926 1 882 . 1 . 1 78 78 SER HB2 H 1 3.797 0.05 . 2 . . . . A 78 SER HB2 . 30926 1 883 . 1 . 1 78 78 SER HB3 H 1 4.078 0.05 . 2 . . . . A 78 SER HB3 . 30926 1 884 . 1 . 1 78 78 SER C C 13 175.510 0.50 . 1 . . . . A 78 SER C . 30926 1 885 . 1 . 1 78 78 SER CA C 13 56.460 0.50 . 1 . . . . A 78 SER CA . 30926 1 886 . 1 . 1 78 78 SER CB C 13 66.746 0.50 . 1 . . . . A 78 SER CB . 30926 1 887 . 1 . 1 78 78 SER N N 15 115.131 0.10 . 1 . . . . A 78 SER N . 30926 1 888 . 1 . 1 79 79 LYS H H 1 8.903 0.05 . 1 . . . . A 79 LYS H . 30926 1 889 . 1 . 1 79 79 LYS HA H 1 4.060 0.05 . 1 . . . . A 79 LYS HA . 30926 1 890 . 1 . 1 79 79 LYS HB2 H 1 1.867 0.05 . 2 . . . . A 79 LYS HB2 . 30926 1 891 . 1 . 1 79 79 LYS HB3 H 1 2.080 0.05 . 2 . . . . A 79 LYS HB3 . 30926 1 892 . 1 . 1 79 79 LYS HG2 H 1 1.376 0.05 . 2 . . . . A 79 LYS HG2 . 30926 1 893 . 1 . 1 79 79 LYS HG3 H 1 1.495 0.05 . 2 . . . . A 79 LYS HG3 . 30926 1 894 . 1 . 1 79 79 LYS HD2 H 1 1.702 0.05 . 2 . . . . A 79 LYS HD2 . 30926 1 895 . 1 . 1 79 79 LYS HD3 H 1 1.702 0.05 . 2 . . . . A 79 LYS HD3 . 30926 1 896 . 1 . 1 79 79 LYS HE2 H 1 2.908 0.05 . 2 . . . . A 79 LYS HE2 . 30926 1 897 . 1 . 1 79 79 LYS HE3 H 1 2.902 0.05 . 2 . . . . A 79 LYS HE3 . 30926 1 898 . 1 . 1 79 79 LYS C C 13 178.133 0.50 . 1 . . . . A 79 LYS C . 30926 1 899 . 1 . 1 79 79 LYS CA C 13 60.698 0.50 . 1 . . . . A 79 LYS CA . 30926 1 900 . 1 . 1 79 79 LYS CB C 13 32.304 0.50 . 1 . . . . A 79 LYS CB . 30926 1 901 . 1 . 1 79 79 LYS CG C 13 24.576 0.50 . 1 . . . . A 79 LYS CG . 30926 1 902 . 1 . 1 79 79 LYS CD C 13 29.682 0.50 . 1 . . . . A 79 LYS CD . 30926 1 903 . 1 . 1 79 79 LYS CE C 13 41.923 0.50 . 1 . . . . A 79 LYS CE . 30926 1 904 . 1 . 1 79 79 LYS N N 15 121.342 0.10 . 1 . . . . A 79 LYS N . 30926 1 905 . 1 . 1 80 80 GLU H H 1 8.463 0.05 . 1 . . . . A 80 GLU H . 30926 1 906 . 1 . 1 80 80 GLU HA H 1 3.898 0.05 . 1 . . . . A 80 GLU HA . 30926 1 907 . 1 . 1 80 80 GLU HB2 H 1 1.912 0.05 . 2 . . . . A 80 GLU HB2 . 30926 1 908 . 1 . 1 80 80 GLU HB3 H 1 1.912 0.05 . 2 . . . . A 80 GLU HB3 . 30926 1 909 . 1 . 1 80 80 GLU HG2 H 1 2.189 0.05 . 2 . . . . A 80 GLU HG2 . 30926 1 910 . 1 . 1 80 80 GLU HG3 H 1 2.323 0.05 . 2 . . . . A 80 GLU HG3 . 30926 1 911 . 1 . 1 80 80 GLU C C 13 179.437 0.50 . 1 . . . . A 80 GLU C . 30926 1 912 . 1 . 1 80 80 GLU CA C 13 59.581 0.50 . 1 . . . . A 80 GLU CA . 30926 1 913 . 1 . 1 80 80 GLU CB C 13 28.600 0.50 . 1 . . . . A 80 GLU CB . 30926 1 914 . 1 . 1 80 80 GLU CG C 13 36.879 0.50 . 1 . . . . A 80 GLU CG . 30926 1 915 . 1 . 1 80 80 GLU N N 15 115.944 0.10 . 1 . . . . A 80 GLU N . 30926 1 916 . 1 . 1 81 81 ASP H H 1 7.840 0.05 . 1 . . . . A 81 ASP H . 30926 1 917 . 1 . 1 81 81 ASP HA H 1 4.264 0.05 . 1 . . . . A 81 ASP HA . 30926 1 918 . 1 . 1 81 81 ASP HB2 H 1 2.596 0.05 . 2 . . . . A 81 ASP HB2 . 30926 1 919 . 1 . 1 81 81 ASP HB3 H 1 3.116 0.05 . 2 . . . . A 81 ASP HB3 . 30926 1 920 . 1 . 1 81 81 ASP C C 13 178.233 0.50 . 1 . . . . A 81 ASP C . 30926 1 921 . 1 . 1 81 81 ASP CA C 13 57.001 0.50 . 1 . . . . A 81 ASP CA . 30926 1 922 . 1 . 1 81 81 ASP CB C 13 40.714 0.50 . 1 . . . . A 81 ASP CB . 30926 1 923 . 1 . 1 81 81 ASP N N 15 119.442 0.10 . 1 . . . . A 81 ASP N . 30926 1 924 . 1 . 1 82 82 LEU H H 1 7.549 0.05 . 1 . . . . A 82 LEU H . 30926 1 925 . 1 . 1 82 82 LEU HA H 1 4.055 0.05 . 1 . . . . A 82 LEU HA . 30926 1 926 . 1 . 1 82 82 LEU HB2 H 1 1.353 0.05 . 2 . . . . A 82 LEU HB2 . 30926 1 927 . 1 . 1 82 82 LEU HB3 H 1 1.923 0.05 . 2 . . . . A 82 LEU HB3 . 30926 1 928 . 1 . 1 82 82 LEU HG H 1 1.676 0.05 . 1 . . . . A 82 LEU HG . 30926 1 929 . 1 . 1 82 82 LEU HD11 H 1 0.197 0.05 . 2 . . . . A 82 LEU HD11 . 30926 1 930 . 1 . 1 82 82 LEU HD12 H 1 0.197 0.05 . 2 . . . . A 82 LEU HD12 . 30926 1 931 . 1 . 1 82 82 LEU HD13 H 1 0.197 0.05 . 2 . . . . A 82 LEU HD13 . 30926 1 932 . 1 . 1 82 82 LEU HD21 H 1 0.398 0.05 . 2 . . . . A 82 LEU HD21 . 30926 1 933 . 1 . 1 82 82 LEU HD22 H 1 0.398 0.05 . 2 . . . . A 82 LEU HD22 . 30926 1 934 . 1 . 1 82 82 LEU HD23 H 1 0.398 0.05 . 2 . . . . A 82 LEU HD23 . 30926 1 935 . 1 . 1 82 82 LEU C C 13 176.284 0.50 . 1 . . . . A 82 LEU C . 30926 1 936 . 1 . 1 82 82 LEU CA C 13 56.181 0.50 . 1 . . . . A 82 LEU CA . 30926 1 937 . 1 . 1 82 82 LEU CB C 13 41.162 0.50 . 1 . . . . A 82 LEU CB . 30926 1 938 . 1 . 1 82 82 LEU CG C 13 25.880 0.50 . 1 . . . . A 82 LEU CG . 30926 1 939 . 1 . 1 82 82 LEU CD1 C 13 21.559 0.50 . 2 . . . . A 82 LEU CD1 . 30926 1 940 . 1 . 1 82 82 LEU CD2 C 13 25.484 0.50 . 2 . . . . A 82 LEU CD2 . 30926 1 941 . 1 . 1 82 82 LEU N N 15 116.548 0.10 . 1 . . . . A 82 LEU N . 30926 1 942 . 1 . 1 83 83 LEU H H 1 6.984 0.05 . 1 . . . . A 83 LEU H . 30926 1 943 . 1 . 1 83 83 LEU HA H 1 4.292 0.05 . 1 . . . . A 83 LEU HA . 30926 1 944 . 1 . 1 83 83 LEU HB2 H 1 1.673 0.05 . 2 . . . . A 83 LEU HB2 . 30926 1 945 . 1 . 1 83 83 LEU HB3 H 1 1.673 0.05 . 2 . . . . A 83 LEU HB3 . 30926 1 946 . 1 . 1 83 83 LEU HG H 1 1.584 0.05 . 1 . . . . A 83 LEU HG . 30926 1 947 . 1 . 1 83 83 LEU HD11 H 1 0.712 0.05 . 2 . . . . A 83 LEU HD11 . 30926 1 948 . 1 . 1 83 83 LEU HD12 H 1 0.712 0.05 . 2 . . . . A 83 LEU HD12 . 30926 1 949 . 1 . 1 83 83 LEU HD13 H 1 0.712 0.05 . 2 . . . . A 83 LEU HD13 . 30926 1 950 . 1 . 1 83 83 LEU HD21 H 1 0.857 0.05 . 2 . . . . A 83 LEU HD21 . 30926 1 951 . 1 . 1 83 83 LEU HD22 H 1 0.857 0.05 . 2 . . . . A 83 LEU HD22 . 30926 1 952 . 1 . 1 83 83 LEU HD23 H 1 0.857 0.05 . 2 . . . . A 83 LEU HD23 . 30926 1 953 . 1 . 1 83 83 LEU C C 13 177.475 0.50 . 1 . . . . A 83 LEU C . 30926 1 954 . 1 . 1 83 83 LEU CA C 13 54.139 0.50 . 1 . . . . A 83 LEU CA . 30926 1 955 . 1 . 1 83 83 LEU CB C 13 41.432 0.50 . 1 . . . . A 83 LEU CB . 30926 1 956 . 1 . 1 83 83 LEU CG C 13 26.778 0.50 . 1 . . . . A 83 LEU CG . 30926 1 957 . 1 . 1 83 83 LEU CD1 C 13 22.496 0.50 . 2 . . . . A 83 LEU CD1 . 30926 1 958 . 1 . 1 83 83 LEU CD2 C 13 25.326 0.50 . 2 . . . . A 83 LEU CD2 . 30926 1 959 . 1 . 1 83 83 LEU N N 15 114.202 0.10 . 1 . . . . A 83 LEU N . 30926 1 960 . 1 . 1 84 84 LYS H H 1 7.272 0.05 . 1 . . . . A 84 LYS H . 30926 1 961 . 1 . 1 84 84 LYS HA H 1 4.398 0.05 . 1 . . . . A 84 LYS HA . 30926 1 962 . 1 . 1 84 84 LYS HB2 H 1 1.845 0.05 . 2 . . . . A 84 LYS HB2 . 30926 1 963 . 1 . 1 84 84 LYS HB3 H 1 1.911 0.05 . 2 . . . . A 84 LYS HB3 . 30926 1 964 . 1 . 1 84 84 LYS HG2 H 1 1.539 0.05 . 2 . . . . A 84 LYS HG2 . 30926 1 965 . 1 . 1 84 84 LYS HG3 H 1 1.382 0.05 . 2 . . . . A 84 LYS HG3 . 30926 1 966 . 1 . 1 84 84 LYS HD2 H 1 1.667 0.05 . 2 . . . . A 84 LYS HD2 . 30926 1 967 . 1 . 1 84 84 LYS HD3 H 1 1.667 0.05 . 2 . . . . A 84 LYS HD3 . 30926 1 968 . 1 . 1 84 84 LYS HE2 H 1 2.906 0.05 . 2 . . . . A 84 LYS HE2 . 30926 1 969 . 1 . 1 84 84 LYS HE3 H 1 2.906 0.05 . 2 . . . . A 84 LYS HE3 . 30926 1 970 . 1 . 1 84 84 LYS C C 13 175.344 0.50 . 1 . . . . A 84 LYS C . 30926 1 971 . 1 . 1 84 84 LYS CA C 13 55.424 0.50 . 1 . . . . A 84 LYS CA . 30926 1 972 . 1 . 1 84 84 LYS CB C 13 33.651 0.50 . 1 . . . . A 84 LYS CB . 30926 1 973 . 1 . 1 84 84 LYS CG C 13 25.126 0.50 . 1 . . . . A 84 LYS CG . 30926 1 974 . 1 . 1 84 84 LYS CD C 13 29.238 0.50 . 1 . . . . A 84 LYS CD . 30926 1 975 . 1 . 1 84 84 LYS CE C 13 42.495 0.50 . 1 . . . . A 84 LYS CE . 30926 1 976 . 1 . 1 84 84 LYS N N 15 120.003 0.10 . 1 . . . . A 84 LYS N . 30926 1 977 . 1 . 1 85 85 ASP H H 1 8.309 0.05 . 1 . . . . A 85 ASP H . 30926 1 978 . 1 . 1 85 85 ASP HA H 1 4.429 0.05 . 1 . . . . A 85 ASP HA . 30926 1 979 . 1 . 1 85 85 ASP HB2 H 1 2.468 0.05 . 2 . . . . A 85 ASP HB2 . 30926 1 980 . 1 . 1 85 85 ASP HB3 H 1 2.585 0.05 . 2 . . . . A 85 ASP HB3 . 30926 1 981 . 1 . 1 85 85 ASP C C 13 175.741 0.50 . 1 . . . . A 85 ASP C . 30926 1 982 . 1 . 1 85 85 ASP CA C 13 55.027 0.50 . 1 . . . . A 85 ASP CA . 30926 1 983 . 1 . 1 85 85 ASP CB C 13 40.564 0.50 . 1 . . . . A 85 ASP CB . 30926 1 984 . 1 . 1 85 85 ASP N N 15 120.063 0.10 . 1 . . . . A 85 ASP N . 30926 1 985 . 1 . 1 86 86 PHE H H 1 7.528 0.05 . 1 . . . . A 86 PHE H . 30926 1 986 . 1 . 1 86 86 PHE HA H 1 4.612 0.05 . 1 . . . . A 86 PHE HA . 30926 1 987 . 1 . 1 86 86 PHE HB2 H 1 2.919 0.05 . 2 . . . . A 86 PHE HB2 . 30926 1 988 . 1 . 1 86 86 PHE HB3 H 1 2.961 0.05 . 2 . . . . A 86 PHE HB3 . 30926 1 989 . 1 . 1 86 86 PHE HD1 H 1 7.081 0.05 . 3 . . . . A 86 PHE HD1 . 30926 1 990 . 1 . 1 86 86 PHE HD2 H 1 7.081 0.05 . 3 . . . . A 86 PHE HD2 . 30926 1 991 . 1 . 1 86 86 PHE HE1 H 1 6.944 0.05 . 3 . . . . A 86 PHE HE1 . 30926 1 992 . 1 . 1 86 86 PHE HE2 H 1 6.944 0.05 . 3 . . . . A 86 PHE HE2 . 30926 1 993 . 1 . 1 86 86 PHE HZ H 1 6.657 0.05 . 1 . . . . A 86 PHE HZ . 30926 1 994 . 1 . 1 86 86 PHE C C 13 173.865 0.50 . 1 . . . . A 86 PHE C . 30926 1 995 . 1 . 1 86 86 PHE CA C 13 56.035 0.50 . 1 . . . . A 86 PHE CA . 30926 1 996 . 1 . 1 86 86 PHE CB C 13 39.264 0.50 . 1 . . . . A 86 PHE CB . 30926 1 997 . 1 . 1 86 86 PHE CD1 C 13 132.931 0.50 . 3 . . . . A 86 PHE CD1 . 30926 1 998 . 1 . 1 86 86 PHE CE1 C 13 130.716 0.50 . 3 . . . . A 86 PHE CE1 . 30926 1 999 . 1 . 1 86 86 PHE CZ C 13 128.124 0.50 . 1 . . . . A 86 PHE CZ . 30926 1 1000 . 1 . 1 86 86 PHE N N 15 120.431 0.10 . 1 . . . . A 86 PHE N . 30926 1 1001 . 1 . 1 87 87 ARG H H 1 8.506 0.05 . 1 . . . . A 87 ARG H . 30926 1 1002 . 1 . 1 87 87 ARG HA H 1 3.981 0.05 . 1 . . . . A 87 ARG HA . 30926 1 1003 . 1 . 1 87 87 ARG HB2 H 1 1.816 0.05 . 2 . . . . A 87 ARG HB2 . 30926 1 1004 . 1 . 1 87 87 ARG HB3 H 1 1.779 0.05 . 2 . . . . A 87 ARG HB3 . 30926 1 1005 . 1 . 1 87 87 ARG HG2 H 1 1.626 0.05 . 2 . . . . A 87 ARG HG2 . 30926 1 1006 . 1 . 1 87 87 ARG HG3 H 1 1.696 0.05 . 2 . . . . A 87 ARG HG3 . 30926 1 1007 . 1 . 1 87 87 ARG HD2 H 1 3.345 0.05 . 2 . . . . A 87 ARG HD2 . 30926 1 1008 . 1 . 1 87 87 ARG HD3 H 1 3.277 0.05 . 2 . . . . A 87 ARG HD3 . 30926 1 1009 . 1 . 1 87 87 ARG HE H 1 7.401 0.05 . 1 . . . . A 87 ARG HE . 30926 1 1010 . 1 . 1 87 87 ARG C C 13 174.022 0.50 . 1 . . . . A 87 ARG C . 30926 1 1011 . 1 . 1 87 87 ARG CA C 13 56.897 0.50 . 1 . . . . A 87 ARG CA . 30926 1 1012 . 1 . 1 87 87 ARG CB C 13 29.536 0.50 . 1 . . . . A 87 ARG CB . 30926 1 1013 . 1 . 1 87 87 ARG CG C 13 26.663 0.50 . 1 . . . . A 87 ARG CG . 30926 1 1014 . 1 . 1 87 87 ARG CD C 13 42.725 0.50 . 1 . . . . A 87 ARG CD . 30926 1 1015 . 1 . 1 87 87 ARG N N 15 122.250 0.10 . 1 . . . . A 87 ARG N . 30926 1 1016 . 1 . 1 87 87 ARG NE N 15 81.950 0.10 . 1 . . . . A 87 ARG NE . 30926 1 1017 . 1 . 1 88 88 LEU H H 1 8.082 0.05 . 1 . . . . A 88 LEU H . 30926 1 1018 . 1 . 1 88 88 LEU HA H 1 4.292 0.05 . 1 . . . . A 88 LEU HA . 30926 1 1019 . 1 . 1 88 88 LEU HB2 H 1 0.950 0.05 . 2 . . . . A 88 LEU HB2 . 30926 1 1020 . 1 . 1 88 88 LEU HB3 H 1 1.410 0.05 . 2 . . . . A 88 LEU HB3 . 30926 1 1021 . 1 . 1 88 88 LEU HG H 1 1.260 0.05 . 1 . . . . A 88 LEU HG . 30926 1 1022 . 1 . 1 88 88 LEU HD11 H 1 0.415 0.05 . 2 . . . . A 88 LEU HD11 . 30926 1 1023 . 1 . 1 88 88 LEU HD12 H 1 0.415 0.05 . 2 . . . . A 88 LEU HD12 . 30926 1 1024 . 1 . 1 88 88 LEU HD13 H 1 0.415 0.05 . 2 . . . . A 88 LEU HD13 . 30926 1 1025 . 1 . 1 88 88 LEU HD21 H 1 0.448 0.05 . 2 . . . . A 88 LEU HD21 . 30926 1 1026 . 1 . 1 88 88 LEU HD22 H 1 0.448 0.05 . 2 . . . . A 88 LEU HD22 . 30926 1 1027 . 1 . 1 88 88 LEU HD23 H 1 0.448 0.05 . 2 . . . . A 88 LEU HD23 . 30926 1 1028 . 1 . 1 88 88 LEU C C 13 175.217 0.50 . 1 . . . . A 88 LEU C . 30926 1 1029 . 1 . 1 88 88 LEU CA C 13 51.263 0.50 . 1 . . . . A 88 LEU CA . 30926 1 1030 . 1 . 1 88 88 LEU CB C 13 42.958 0.50 . 1 . . . . A 88 LEU CB . 30926 1 1031 . 1 . 1 88 88 LEU CG C 13 25.633 0.50 . 1 . . . . A 88 LEU CG . 30926 1 1032 . 1 . 1 88 88 LEU CD1 C 13 23.861 0.50 . 2 . . . . A 88 LEU CD1 . 30926 1 1033 . 1 . 1 88 88 LEU CD2 C 13 25.900 0.50 . 2 . . . . A 88 LEU CD2 . 30926 1 1034 . 1 . 1 88 88 LEU N N 15 126.156 0.10 . 1 . . . . A 88 LEU N . 30926 1 1035 . 1 . 1 89 89 PRO HA H 1 4.807 0.05 . 1 . . . . A 89 PRO HA . 30926 1 1036 . 1 . 1 89 89 PRO HB2 H 1 1.099 0.05 . 2 . . . . A 89 PRO HB2 . 30926 1 1037 . 1 . 1 89 89 PRO HB3 H 1 1.451 0.05 . 2 . . . . A 89 PRO HB3 . 30926 1 1038 . 1 . 1 89 89 PRO HG2 H 1 1.408 0.05 . 2 . . . . A 89 PRO HG2 . 30926 1 1039 . 1 . 1 89 89 PRO HG3 H 1 1.408 0.05 . 2 . . . . A 89 PRO HG3 . 30926 1 1040 . 1 . 1 89 89 PRO HD2 H 1 3.750 0.05 . 2 . . . . A 89 PRO HD2 . 30926 1 1041 . 1 . 1 89 89 PRO HD3 H 1 3.032 0.05 . 2 . . . . A 89 PRO HD3 . 30926 1 1042 . 1 . 1 89 89 PRO C C 13 176.078 0.50 . 1 . . . . A 89 PRO C . 30926 1 1043 . 1 . 1 89 89 PRO CA C 13 61.021 0.50 . 1 . . . . A 89 PRO CA . 30926 1 1044 . 1 . 1 89 89 PRO CB C 13 35.422 0.50 . 1 . . . . A 89 PRO CB . 30926 1 1045 . 1 . 1 89 89 PRO CG C 13 24.921 0.50 . 1 . . . . A 89 PRO CG . 30926 1 1046 . 1 . 1 89 89 PRO CD C 13 50.380 0.50 . 1 . . . . A 89 PRO CD . 30926 1 1047 . 1 . 1 90 90 ALA H H 1 7.917 0.05 . 1 . . . . A 90 ALA H . 30926 1 1048 . 1 . 1 90 90 ALA HA H 1 4.878 0.05 . 1 . . . . A 90 ALA HA . 30926 1 1049 . 1 . 1 90 90 ALA HB1 H 1 1.508 0.05 . 1 . . . . A 90 ALA HB1 . 30926 1 1050 . 1 . 1 90 90 ALA HB2 H 1 1.508 0.05 . 1 . . . . A 90 ALA HB2 . 30926 1 1051 . 1 . 1 90 90 ALA HB3 H 1 1.508 0.05 . 1 . . . . A 90 ALA HB3 . 30926 1 1052 . 1 . 1 90 90 ALA C C 13 175.155 0.50 . 1 . . . . A 90 ALA C . 30926 1 1053 . 1 . 1 90 90 ALA CA C 13 50.571 0.50 . 1 . . . . A 90 ALA CA . 30926 1 1054 . 1 . 1 90 90 ALA CB C 13 24.075 0.50 . 1 . . . . A 90 ALA CB . 30926 1 1055 . 1 . 1 90 90 ALA N N 15 122.975 0.10 . 1 . . . . A 90 ALA N . 30926 1 1056 . 1 . 1 91 91 ILE H H 1 8.467 0.05 . 1 . . . . A 91 ILE H . 30926 1 1057 . 1 . 1 91 91 ILE HA H 1 4.795 0.05 . 1 . . . . A 91 ILE HA . 30926 1 1058 . 1 . 1 91 91 ILE HB H 1 1.531 0.05 . 1 . . . . A 91 ILE HB . 30926 1 1059 . 1 . 1 91 91 ILE HG12 H 1 0.432 0.05 . 2 . . . . A 91 ILE HG12 . 30926 1 1060 . 1 . 1 91 91 ILE HG13 H 1 1.440 0.05 . 2 . . . . A 91 ILE HG13 . 30926 1 1061 . 1 . 1 91 91 ILE HG21 H 1 0.846 0.05 . 1 . . . . A 91 ILE HG21 . 30926 1 1062 . 1 . 1 91 91 ILE HG22 H 1 0.846 0.05 . 1 . . . . A 91 ILE HG22 . 30926 1 1063 . 1 . 1 91 91 ILE HG23 H 1 0.846 0.05 . 1 . . . . A 91 ILE HG23 . 30926 1 1064 . 1 . 1 91 91 ILE HD11 H 1 0.435 0.05 . 1 . . . . A 91 ILE HD11 . 30926 1 1065 . 1 . 1 91 91 ILE HD12 H 1 0.435 0.05 . 1 . . . . A 91 ILE HD12 . 30926 1 1066 . 1 . 1 91 91 ILE HD13 H 1 0.435 0.05 . 1 . . . . A 91 ILE HD13 . 30926 1 1067 . 1 . 1 91 91 ILE C C 13 173.739 0.50 . 1 . . . . A 91 ILE C . 30926 1 1068 . 1 . 1 91 91 ILE CA C 13 61.001 0.50 . 1 . . . . A 91 ILE CA . 30926 1 1069 . 1 . 1 91 91 ILE CB C 13 39.870 0.50 . 1 . . . . A 91 ILE CB . 30926 1 1070 . 1 . 1 91 91 ILE CG1 C 13 29.260 0.50 . 1 . . . . A 91 ILE CG1 . 30926 1 1071 . 1 . 1 91 91 ILE CG2 C 13 17.933 0.50 . 1 . . . . A 91 ILE CG2 . 30926 1 1072 . 1 . 1 91 91 ILE CD1 C 13 13.416 0.50 . 1 . . . . A 91 ILE CD1 . 30926 1 1073 . 1 . 1 91 91 ILE N N 15 119.777 0.10 . 1 . . . . A 91 ILE N . 30926 1 1074 . 1 . 1 92 92 ALA H H 1 9.592 0.05 . 1 . . . . A 92 ALA H . 30926 1 1075 . 1 . 1 92 92 ALA HA H 1 5.511 0.05 . 1 . . . . A 92 ALA HA . 30926 1 1076 . 1 . 1 92 92 ALA HB1 H 1 1.280 0.05 . 1 . . . . A 92 ALA HB1 . 30926 1 1077 . 1 . 1 92 92 ALA HB2 H 1 1.280 0.05 . 1 . . . . A 92 ALA HB2 . 30926 1 1078 . 1 . 1 92 92 ALA HB3 H 1 1.280 0.05 . 1 . . . . A 92 ALA HB3 . 30926 1 1079 . 1 . 1 92 92 ALA C C 13 175.087 0.50 . 1 . . . . A 92 ALA C . 30926 1 1080 . 1 . 1 92 92 ALA CA C 13 49.836 0.50 . 1 . . . . A 92 ALA CA . 30926 1 1081 . 1 . 1 92 92 ALA CB C 13 22.778 0.50 . 1 . . . . A 92 ALA CB . 30926 1 1082 . 1 . 1 92 92 ALA N N 15 128.556 0.10 . 1 . . . . A 92 ALA N . 30926 1 1083 . 1 . 1 93 93 ASN H H 1 7.834 0.05 . 1 . . . . A 93 ASN H . 30926 1 1084 . 1 . 1 93 93 ASN HA H 1 4.935 0.05 . 1 . . . . A 93 ASN HA . 30926 1 1085 . 1 . 1 93 93 ASN HB2 H 1 2.667 0.05 . 2 . . . . A 93 ASN HB2 . 30926 1 1086 . 1 . 1 93 93 ASN HB3 H 1 2.667 0.05 . 2 . . . . A 93 ASN HB3 . 30926 1 1087 . 1 . 1 93 93 ASN HD21 H 1 6.565 0.05 . 2 . . . . A 93 ASN HD21 . 30926 1 1088 . 1 . 1 93 93 ASN HD22 H 1 6.331 0.05 . 2 . . . . A 93 ASN HD22 . 30926 1 1089 . 1 . 1 93 93 ASN CA C 13 52.725 0.50 . 1 . . . . A 93 ASN CA . 30926 1 1090 . 1 . 1 93 93 ASN CB C 13 40.696 0.50 . 1 . . . . A 93 ASN CB . 30926 1 1091 . 1 . 1 93 93 ASN N N 15 120.757 0.10 . 1 . . . . A 93 ASN N . 30926 1 1092 . 1 . 1 93 93 ASN ND2 N 15 110.170 0.10 . 1 . . . . A 93 ASN ND2 . 30926 1 1093 . 1 . 1 94 94 VAL H H 1 8.279 0.05 . 1 . . . . A 94 VAL H . 30926 1 1094 . 1 . 1 94 94 VAL HA H 1 5.305 0.05 . 1 . . . . A 94 VAL HA . 30926 1 1095 . 1 . 1 94 94 VAL HB H 1 1.745 0.05 . 1 . . . . A 94 VAL HB . 30926 1 1096 . 1 . 1 94 94 VAL HG11 H 1 0.538 0.05 . 2 . . . . A 94 VAL HG11 . 30926 1 1097 . 1 . 1 94 94 VAL HG12 H 1 0.538 0.05 . 2 . . . . A 94 VAL HG12 . 30926 1 1098 . 1 . 1 94 94 VAL HG13 H 1 0.538 0.05 . 2 . . . . A 94 VAL HG13 . 30926 1 1099 . 1 . 1 94 94 VAL HG21 H 1 0.597 0.05 . 2 . . . . A 94 VAL HG21 . 30926 1 1100 . 1 . 1 94 94 VAL HG22 H 1 0.597 0.05 . 2 . . . . A 94 VAL HG22 . 30926 1 1101 . 1 . 1 94 94 VAL HG23 H 1 0.597 0.05 . 2 . . . . A 94 VAL HG23 . 30926 1 1102 . 1 . 1 94 94 VAL CA C 13 58.087 0.50 . 1 . . . . A 94 VAL CA . 30926 1 1103 . 1 . 1 94 94 VAL CB C 13 35.868 0.50 . 1 . . . . A 94 VAL CB . 30926 1 1104 . 1 . 1 94 94 VAL CG1 C 13 21.077 0.50 . 2 . . . . A 94 VAL CG1 . 30926 1 1105 . 1 . 1 94 94 VAL CG2 C 13 19.643 0.50 . 2 . . . . A 94 VAL CG2 . 30926 1 1106 . 1 . 1 94 94 VAL N N 15 118.667 0.10 . 1 . . . . A 94 VAL N . 30926 1 1107 . 1 . 1 95 95 ILE H H 1 8.568 0.05 . 1 . . . . A 95 ILE H . 30926 1 1108 . 1 . 1 95 95 ILE HA H 1 4.554 0.05 . 1 . . . . A 95 ILE HA . 30926 1 1109 . 1 . 1 95 95 ILE HB H 1 1.539 0.05 . 1 . . . . A 95 ILE HB . 30926 1 1110 . 1 . 1 95 95 ILE HG12 H 1 0.861 0.05 . 2 . . . . A 95 ILE HG12 . 30926 1 1111 . 1 . 1 95 95 ILE HG13 H 1 1.206 0.05 . 2 . . . . A 95 ILE HG13 . 30926 1 1112 . 1 . 1 95 95 ILE HG21 H 1 0.612 0.05 . 1 . . . . A 95 ILE HG21 . 30926 1 1113 . 1 . 1 95 95 ILE HG22 H 1 0.612 0.05 . 1 . . . . A 95 ILE HG22 . 30926 1 1114 . 1 . 1 95 95 ILE HG23 H 1 0.612 0.05 . 1 . . . . A 95 ILE HG23 . 30926 1 1115 . 1 . 1 95 95 ILE HD11 H 1 0.594 0.05 . 1 . . . . A 95 ILE HD11 . 30926 1 1116 . 1 . 1 95 95 ILE HD12 H 1 0.594 0.05 . 1 . . . . A 95 ILE HD12 . 30926 1 1117 . 1 . 1 95 95 ILE HD13 H 1 0.594 0.05 . 1 . . . . A 95 ILE HD13 . 30926 1 1118 . 1 . 1 95 95 ILE C C 13 176.084 0.50 . 1 . . . . A 95 ILE C . 30926 1 1119 . 1 . 1 95 95 ILE CA C 13 59.532 0.50 . 1 . . . . A 95 ILE CA . 30926 1 1120 . 1 . 1 95 95 ILE CB C 13 39.144 0.50 . 1 . . . . A 95 ILE CB . 30926 1 1121 . 1 . 1 95 95 ILE CG1 C 13 27.147 0.50 . 1 . . . . A 95 ILE CG1 . 30926 1 1122 . 1 . 1 95 95 ILE CG2 C 13 17.246 0.50 . 1 . . . . A 95 ILE CG2 . 30926 1 1123 . 1 . 1 95 95 ILE CD1 C 13 12.144 0.50 . 1 . . . . A 95 ILE CD1 . 30926 1 1124 . 1 . 1 95 95 ILE N N 15 121.056 0.10 . 1 . . . . A 95 ILE N . 30926 1 1125 . 1 . 1 96 96 VAL H H 1 8.768 0.05 . 1 . . . . A 96 VAL H . 30926 1 1126 . 1 . 1 96 96 VAL HA H 1 4.224 0.05 . 1 . . . . A 96 VAL HA . 30926 1 1127 . 1 . 1 96 96 VAL HB H 1 1.836 0.05 . 1 . . . . A 96 VAL HB . 30926 1 1128 . 1 . 1 96 96 VAL HG11 H 1 0.677 0.05 . 2 . . . . A 96 VAL HG11 . 30926 1 1129 . 1 . 1 96 96 VAL HG12 H 1 0.677 0.05 . 2 . . . . A 96 VAL HG12 . 30926 1 1130 . 1 . 1 96 96 VAL HG13 H 1 0.677 0.05 . 2 . . . . A 96 VAL HG13 . 30926 1 1131 . 1 . 1 96 96 VAL HG21 H 1 0.745 0.05 . 2 . . . . A 96 VAL HG21 . 30926 1 1132 . 1 . 1 96 96 VAL HG22 H 1 0.745 0.05 . 2 . . . . A 96 VAL HG22 . 30926 1 1133 . 1 . 1 96 96 VAL HG23 H 1 0.745 0.05 . 2 . . . . A 96 VAL HG23 . 30926 1 1134 . 1 . 1 96 96 VAL C C 13 175.822 0.50 . 1 . . . . A 96 VAL C . 30926 1 1135 . 1 . 1 96 96 VAL CA C 13 60.663 0.50 . 1 . . . . A 96 VAL CA . 30926 1 1136 . 1 . 1 96 96 VAL CB C 13 33.825 0.50 . 1 . . . . A 96 VAL CB . 30926 1 1137 . 1 . 1 96 96 VAL CG1 C 13 20.701 0.50 . 2 . . . . A 96 VAL CG1 . 30926 1 1138 . 1 . 1 96 96 VAL CG2 C 13 20.870 0.50 . 2 . . . . A 96 VAL CG2 . 30926 1 1139 . 1 . 1 96 96 VAL N N 15 125.379 0.10 . 1 . . . . A 96 VAL N . 30926 1 1140 . 1 . 1 97 97 ASP H H 1 8.886 0.05 . 1 . . . . A 97 ASP H . 30926 1 1141 . 1 . 1 97 97 ASP HA H 1 4.232 0.05 . 1 . . . . A 97 ASP HA . 30926 1 1142 . 1 . 1 97 97 ASP HB2 H 1 2.515 0.05 . 2 . . . . A 97 ASP HB2 . 30926 1 1143 . 1 . 1 97 97 ASP HB3 H 1 2.760 0.05 . 2 . . . . A 97 ASP HB3 . 30926 1 1144 . 1 . 1 97 97 ASP C C 13 174.987 0.50 . 1 . . . . A 97 ASP C . 30926 1 1145 . 1 . 1 97 97 ASP CA C 13 55.362 0.50 . 1 . . . . A 97 ASP CA . 30926 1 1146 . 1 . 1 97 97 ASP CB C 13 39.909 0.50 . 1 . . . . A 97 ASP CB . 30926 1 1147 . 1 . 1 97 97 ASP N N 15 125.316 0.10 . 1 . . . . A 97 ASP N . 30926 1 1148 . 1 . 1 98 98 ASN H H 1 8.672 0.05 . 1 . . . . A 98 ASN H . 30926 1 1149 . 1 . 1 98 98 ASN HA H 1 4.166 0.05 . 1 . . . . A 98 ASN HA . 30926 1 1150 . 1 . 1 98 98 ASN HB2 H 1 2.752 0.05 . 2 . . . . A 98 ASN HB2 . 30926 1 1151 . 1 . 1 98 98 ASN HB3 H 1 2.882 0.05 . 2 . . . . A 98 ASN HB3 . 30926 1 1152 . 1 . 1 98 98 ASN HD21 H 1 6.813 0.05 . 2 . . . . A 98 ASN HD21 . 30926 1 1153 . 1 . 1 98 98 ASN HD22 H 1 7.516 0.05 . 2 . . . . A 98 ASN HD22 . 30926 1 1154 . 1 . 1 98 98 ASN C C 13 174.524 0.50 . 1 . . . . A 98 ASN C . 30926 1 1155 . 1 . 1 98 98 ASN CA C 13 54.490 0.50 . 1 . . . . A 98 ASN CA . 30926 1 1156 . 1 . 1 98 98 ASN CB C 13 38.175 0.50 . 1 . . . . A 98 ASN CB . 30926 1 1157 . 1 . 1 98 98 ASN N N 15 112.561 0.10 . 1 . . . . A 98 ASN N . 30926 1 1158 . 1 . 1 98 98 ASN ND2 N 15 113.123 0.10 . 1 . . . . A 98 ASN ND2 . 30926 1 1159 . 1 . 1 99 99 ARG H H 1 7.975 0.05 . 1 . . . . A 99 ARG H . 30926 1 1160 . 1 . 1 99 99 ARG HA H 1 4.299 0.05 . 1 . . . . A 99 ARG HA . 30926 1 1161 . 1 . 1 99 99 ARG HB2 H 1 1.753 0.05 . 2 . . . . A 99 ARG HB2 . 30926 1 1162 . 1 . 1 99 99 ARG HB3 H 1 1.753 0.05 . 2 . . . . A 99 ARG HB3 . 30926 1 1163 . 1 . 1 99 99 ARG HG2 H 1 1.535 0.05 . 2 . . . . A 99 ARG HG2 . 30926 1 1164 . 1 . 1 99 99 ARG HG3 H 1 1.487 0.05 . 2 . . . . A 99 ARG HG3 . 30926 1 1165 . 1 . 1 99 99 ARG HD2 H 1 3.095 0.05 . 2 . . . . A 99 ARG HD2 . 30926 1 1166 . 1 . 1 99 99 ARG HD3 H 1 3.095 0.05 . 2 . . . . A 99 ARG HD3 . 30926 1 1167 . 1 . 1 99 99 ARG C C 13 175.094 0.50 . 1 . . . . A 99 ARG C . 30926 1 1168 . 1 . 1 99 99 ARG CA C 13 56.728 0.50 . 1 . . . . A 99 ARG CA . 30926 1 1169 . 1 . 1 99 99 ARG CB C 13 31.847 0.50 . 1 . . . . A 99 ARG CB . 30926 1 1170 . 1 . 1 99 99 ARG CG C 13 27.022 0.50 . 1 . . . . A 99 ARG CG . 30926 1 1171 . 1 . 1 99 99 ARG CD C 13 43.232 0.50 . 1 . . . . A 99 ARG CD . 30926 1 1172 . 1 . 1 99 99 ARG N N 15 116.835 0.10 . 1 . . . . A 99 ARG N . 30926 1 1173 . 1 . 1 100 100 LEU H H 1 8.090 0.05 . 1 . . . . A 100 LEU H . 30926 1 1174 . 1 . 1 100 100 LEU HA H 1 4.423 0.05 . 1 . . . . A 100 LEU HA . 30926 1 1175 . 1 . 1 100 100 LEU HB2 H 1 1.515 0.05 . 2 . . . . A 100 LEU HB2 . 30926 1 1176 . 1 . 1 100 100 LEU HB3 H 1 1.577 0.05 . 2 . . . . A 100 LEU HB3 . 30926 1 1177 . 1 . 1 100 100 LEU HD11 H 1 0.794 0.05 . 2 . . . . A 100 LEU HD11 . 30926 1 1178 . 1 . 1 100 100 LEU HD12 H 1 0.794 0.05 . 2 . . . . A 100 LEU HD12 . 30926 1 1179 . 1 . 1 100 100 LEU HD13 H 1 0.794 0.05 . 2 . . . . A 100 LEU HD13 . 30926 1 1180 . 1 . 1 100 100 LEU HD21 H 1 0.851 0.05 . 2 . . . . A 100 LEU HD21 . 30926 1 1181 . 1 . 1 100 100 LEU HD22 H 1 0.851 0.05 . 2 . . . . A 100 LEU HD22 . 30926 1 1182 . 1 . 1 100 100 LEU HD23 H 1 0.851 0.05 . 2 . . . . A 100 LEU HD23 . 30926 1 1183 . 1 . 1 100 100 LEU C C 13 175.807 0.50 . 1 . . . . A 100 LEU C . 30926 1 1184 . 1 . 1 100 100 LEU CA C 13 54.566 0.50 . 1 . . . . A 100 LEU CA . 30926 1 1185 . 1 . 1 100 100 LEU CB C 13 43.203 0.50 . 1 . . . . A 100 LEU CB . 30926 1 1186 . 1 . 1 100 100 LEU CG C 13 26.801 0.50 . 1 . . . . A 100 LEU CG . 30926 1 1187 . 1 . 1 100 100 LEU CD1 C 13 23.592 0.50 . 2 . . . . A 100 LEU CD1 . 30926 1 1188 . 1 . 1 100 100 LEU CD2 C 13 25.055 0.50 . 2 . . . . A 100 LEU CD2 . 30926 1 1189 . 1 . 1 100 100 LEU N N 15 121.850 0.10 . 1 . . . . A 100 LEU N . 30926 1 1190 . 1 . 1 101 101 ALA H H 1 8.354 0.05 . 1 . . . . A 101 ALA H . 30926 1 1191 . 1 . 1 101 101 ALA HA H 1 4.371 0.05 . 1 . . . . A 101 ALA HA . 30926 1 1192 . 1 . 1 101 101 ALA HB1 H 1 1.252 0.05 . 1 . . . . A 101 ALA HB1 . 30926 1 1193 . 1 . 1 101 101 ALA HB2 H 1 1.252 0.05 . 1 . . . . A 101 ALA HB2 . 30926 1 1194 . 1 . 1 101 101 ALA HB3 H 1 1.252 0.05 . 1 . . . . A 101 ALA HB3 . 30926 1 1195 . 1 . 1 101 101 ALA CA C 13 52.480 0.50 . 1 . . . . A 101 ALA CA . 30926 1 1196 . 1 . 1 101 101 ALA CB C 13 19.115 0.50 . 1 . . . . A 101 ALA CB . 30926 1 1197 . 1 . 1 101 101 ALA N N 15 125.863 0.10 . 1 . . . . A 101 ALA N . 30926 1 1198 . 1 . 1 102 102 HIS H H 1 8.528 0.05 . 1 . . . . A 102 HIS H . 30926 1 1199 . 1 . 1 102 102 HIS HA H 1 4.924 0.05 . 1 . . . . A 102 HIS HA . 30926 1 1200 . 1 . 1 102 102 HIS HB2 H 1 2.743 0.05 . 2 . . . . A 102 HIS HB2 . 30926 1 1201 . 1 . 1 102 102 HIS HB3 H 1 2.743 0.05 . 2 . . . . A 102 HIS HB3 . 30926 1 1202 . 1 . 1 102 102 HIS HD2 H 1 6.441 0.05 . 1 . . . . A 102 HIS HD2 . 30926 1 1203 . 1 . 1 102 102 HIS C C 13 172.621 0.50 . 1 . . . . A 102 HIS C . 30926 1 1204 . 1 . 1 102 102 HIS CA C 13 54.695 0.50 . 1 . . . . A 102 HIS CA . 30926 1 1205 . 1 . 1 102 102 HIS CB C 13 34.572 0.50 . 1 . . . . A 102 HIS CB . 30926 1 1206 . 1 . 1 102 102 HIS CD2 C 13 117.981 0.50 . 1 . . . . A 102 HIS CD2 . 30926 1 1207 . 1 . 1 103 103 PHE H H 1 6.042 0.05 . 1 . . . . A 103 PHE H . 30926 1 1208 . 1 . 1 103 103 PHE HA H 1 5.462 0.05 . 1 . . . . A 103 PHE HA . 30926 1 1209 . 1 . 1 103 103 PHE HB2 H 1 2.008 0.05 . 2 . . . . A 103 PHE HB2 . 30926 1 1210 . 1 . 1 103 103 PHE HB3 H 1 2.948 0.05 . 2 . . . . A 103 PHE HB3 . 30926 1 1211 . 1 . 1 103 103 PHE HD1 H 1 6.900 0.05 . 3 . . . . A 103 PHE HD1 . 30926 1 1212 . 1 . 1 103 103 PHE HD2 H 1 6.896 0.05 . 3 . . . . A 103 PHE HD2 . 30926 1 1213 . 1 . 1 103 103 PHE HE1 H 1 6.998 0.05 . 3 . . . . A 103 PHE HE1 . 30926 1 1214 . 1 . 1 103 103 PHE HE2 H 1 6.998 0.05 . 3 . . . . A 103 PHE HE2 . 30926 1 1215 . 1 . 1 103 103 PHE HZ H 1 7.108 0.05 . 1 . . . . A 103 PHE HZ . 30926 1 1216 . 1 . 1 103 103 PHE CA C 13 56.674 0.50 . 1 . . . . A 103 PHE CA . 30926 1 1217 . 1 . 1 103 103 PHE CB C 13 44.165 0.50 . 1 . . . . A 103 PHE CB . 30926 1 1218 . 1 . 1 103 103 PHE CD1 C 13 131.484 0.50 . 3 . . . . A 103 PHE CD1 . 30926 1 1219 . 1 . 1 103 103 PHE CE1 C 13 129.440 0.50 . 3 . . . . A 103 PHE CE1 . 30926 1 1220 . 1 . 1 103 103 PHE CZ C 13 130.384 0.50 . 1 . . . . A 103 PHE CZ . 30926 1 1221 . 1 . 1 103 103 PHE N N 15 122.021 0.10 . 1 . . . . A 103 PHE N . 30926 1 1222 . 1 . 1 104 104 VAL H H 1 8.405 0.05 . 1 . . . . A 104 VAL H . 30926 1 1223 . 1 . 1 104 104 VAL HA H 1 4.795 0.05 . 1 . . . . A 104 VAL HA . 30926 1 1224 . 1 . 1 104 104 VAL HB H 1 2.027 0.05 . 1 . . . . A 104 VAL HB . 30926 1 1225 . 1 . 1 104 104 VAL HG11 H 1 0.672 0.05 . 2 . . . . A 104 VAL HG11 . 30926 1 1226 . 1 . 1 104 104 VAL HG12 H 1 0.672 0.05 . 2 . . . . A 104 VAL HG12 . 30926 1 1227 . 1 . 1 104 104 VAL HG13 H 1 0.672 0.05 . 2 . . . . A 104 VAL HG13 . 30926 1 1228 . 1 . 1 104 104 VAL HG21 H 1 0.864 0.05 . 2 . . . . A 104 VAL HG21 . 30926 1 1229 . 1 . 1 104 104 VAL HG22 H 1 0.864 0.05 . 2 . . . . A 104 VAL HG22 . 30926 1 1230 . 1 . 1 104 104 VAL HG23 H 1 0.864 0.05 . 2 . . . . A 104 VAL HG23 . 30926 1 1231 . 1 . 1 104 104 VAL C C 13 174.290 0.50 . 1 . . . . A 104 VAL C . 30926 1 1232 . 1 . 1 104 104 VAL CA C 13 58.797 0.50 . 1 . . . . A 104 VAL CA . 30926 1 1233 . 1 . 1 104 104 VAL CB C 13 35.357 0.50 . 1 . . . . A 104 VAL CB . 30926 1 1234 . 1 . 1 104 104 VAL CG1 C 13 18.623 0.50 . 2 . . . . A 104 VAL CG1 . 30926 1 1235 . 1 . 1 104 104 VAL CG2 C 13 21.703 0.50 . 2 . . . . A 104 VAL CG2 . 30926 1 1236 . 1 . 1 104 104 VAL N N 15 107.209 0.10 . 1 . . . . A 104 VAL N . 30926 1 1237 . 1 . 1 105 105 VAL H H 1 8.665 0.05 . 1 . . . . A 105 VAL H . 30926 1 1238 . 1 . 1 105 105 VAL HA H 1 4.503 0.05 . 1 . . . . A 105 VAL HA . 30926 1 1239 . 1 . 1 105 105 VAL HB H 1 1.929 0.05 . 1 . . . . A 105 VAL HB . 30926 1 1240 . 1 . 1 105 105 VAL HG11 H 1 0.950 0.05 . 2 . . . . A 105 VAL HG11 . 30926 1 1241 . 1 . 1 105 105 VAL HG12 H 1 0.950 0.05 . 2 . . . . A 105 VAL HG12 . 30926 1 1242 . 1 . 1 105 105 VAL HG13 H 1 0.950 0.05 . 2 . . . . A 105 VAL HG13 . 30926 1 1243 . 1 . 1 105 105 VAL HG21 H 1 -0.165 0.05 . 2 . . . . A 105 VAL HG21 . 30926 1 1244 . 1 . 1 105 105 VAL HG22 H 1 -0.165 0.05 . 2 . . . . A 105 VAL HG22 . 30926 1 1245 . 1 . 1 105 105 VAL HG23 H 1 -0.165 0.05 . 2 . . . . A 105 VAL HG23 . 30926 1 1246 . 1 . 1 105 105 VAL C C 13 176.890 0.50 . 1 . . . . A 105 VAL C . 30926 1 1247 . 1 . 1 105 105 VAL CA C 13 60.742 0.50 . 1 . . . . A 105 VAL CA . 30926 1 1248 . 1 . 1 105 105 VAL CB C 13 34.243 0.50 . 1 . . . . A 105 VAL CB . 30926 1 1249 . 1 . 1 105 105 VAL CG1 C 13 21.976 0.50 . 2 . . . . A 105 VAL CG1 . 30926 1 1250 . 1 . 1 105 105 VAL CG2 C 13 21.024 0.50 . 2 . . . . A 105 VAL CG2 . 30926 1 1251 . 1 . 1 105 105 VAL N N 15 120.171 0.10 . 1 . . . . A 105 VAL N . 30926 1 1252 . 1 . 1 106 106 ILE H H 1 8.919 0.05 . 1 . . . . A 106 ILE H . 30926 1 1253 . 1 . 1 106 106 ILE HA H 1 3.868 0.05 . 1 . . . . A 106 ILE HA . 30926 1 1254 . 1 . 1 106 106 ILE HB H 1 1.322 0.05 . 1 . . . . A 106 ILE HB . 30926 1 1255 . 1 . 1 106 106 ILE HG12 H 1 0.165 0.05 . 2 . . . . A 106 ILE HG12 . 30926 1 1256 . 1 . 1 106 106 ILE HG13 H 1 1.257 0.05 . 2 . . . . A 106 ILE HG13 . 30926 1 1257 . 1 . 1 106 106 ILE HG21 H 1 0.402 0.05 . 1 . . . . A 106 ILE HG21 . 30926 1 1258 . 1 . 1 106 106 ILE HG22 H 1 0.402 0.05 . 1 . . . . A 106 ILE HG22 . 30926 1 1259 . 1 . 1 106 106 ILE HG23 H 1 0.402 0.05 . 1 . . . . A 106 ILE HG23 . 30926 1 1260 . 1 . 1 106 106 ILE HD11 H 1 0.247 0.05 . 1 . . . . A 106 ILE HD11 . 30926 1 1261 . 1 . 1 106 106 ILE HD12 H 1 0.247 0.05 . 1 . . . . A 106 ILE HD12 . 30926 1 1262 . 1 . 1 106 106 ILE HD13 H 1 0.247 0.05 . 1 . . . . A 106 ILE HD13 . 30926 1 1263 . 1 . 1 106 106 ILE C C 13 174.528 0.50 . 1 . . . . A 106 ILE C . 30926 1 1264 . 1 . 1 106 106 ILE CA C 13 61.540 0.50 . 1 . . . . A 106 ILE CA . 30926 1 1265 . 1 . 1 106 106 ILE CB C 13 38.731 0.50 . 1 . . . . A 106 ILE CB . 30926 1 1266 . 1 . 1 106 106 ILE CG1 C 13 25.605 0.50 . 1 . . . . A 106 ILE CG1 . 30926 1 1267 . 1 . 1 106 106 ILE CG2 C 13 18.269 0.50 . 1 . . . . A 106 ILE CG2 . 30926 1 1268 . 1 . 1 106 106 ILE CD1 C 13 13.740 0.50 . 1 . . . . A 106 ILE CD1 . 30926 1 1269 . 1 . 1 106 106 ILE N N 15 124.330 0.10 . 1 . . . . A 106 ILE N . 30926 1 1270 . 1 . 1 107 107 TYR H H 1 8.488 0.05 . 1 . . . . A 107 TYR H . 30926 1 1271 . 1 . 1 107 107 TYR HA H 1 4.152 0.05 . 1 . . . . A 107 TYR HA . 30926 1 1272 . 1 . 1 107 107 TYR HB2 H 1 1.384 0.05 . 2 . . . . A 107 TYR HB2 . 30926 1 1273 . 1 . 1 107 107 TYR HB3 H 1 1.768 0.05 . 2 . . . . A 107 TYR HB3 . 30926 1 1274 . 1 . 1 107 107 TYR HD1 H 1 6.361 0.05 . 3 . . . . A 107 TYR HD1 . 30926 1 1275 . 1 . 1 107 107 TYR HD2 H 1 6.379 0.05 . 3 . . . . A 107 TYR HD2 . 30926 1 1276 . 1 . 1 107 107 TYR HE1 H 1 6.003 0.05 . 3 . . . . A 107 TYR HE1 . 30926 1 1277 . 1 . 1 107 107 TYR HE2 H 1 6.003 0.05 . 3 . . . . A 107 TYR HE2 . 30926 1 1278 . 1 . 1 107 107 TYR C C 13 175.346 0.50 . 1 . . . . A 107 TYR C . 30926 1 1279 . 1 . 1 107 107 TYR CA C 13 60.739 0.50 . 1 . . . . A 107 TYR CA . 30926 1 1280 . 1 . 1 107 107 TYR CB C 13 41.158 0.50 . 1 . . . . A 107 TYR CB . 30926 1 1281 . 1 . 1 107 107 TYR CD1 C 13 131.893 0.50 . 3 . . . . A 107 TYR CD1 . 30926 1 1282 . 1 . 1 107 107 TYR CE1 C 13 117.312 0.50 . 3 . . . . A 107 TYR CE1 . 30926 1 1283 . 1 . 1 107 107 TYR N N 15 124.719 0.10 . 1 . . . . A 107 TYR N . 30926 1 1284 . 1 . 1 108 108 SER H H 1 7.173 0.05 . 1 . . . . A 108 SER H . 30926 1 1285 . 1 . 1 108 108 SER HA H 1 4.372 0.05 . 1 . . . . A 108 SER HA . 30926 1 1286 . 1 . 1 108 108 SER HB2 H 1 3.479 0.05 . 2 . . . . A 108 SER HB2 . 30926 1 1287 . 1 . 1 108 108 SER HB3 H 1 3.810 0.05 . 2 . . . . A 108 SER HB3 . 30926 1 1288 . 1 . 1 108 108 SER C C 13 172.024 0.50 . 1 . . . . A 108 SER C . 30926 1 1289 . 1 . 1 108 108 SER CA C 13 57.144 0.50 . 1 . . . . A 108 SER CA . 30926 1 1290 . 1 . 1 108 108 SER CB C 13 64.273 0.50 . 1 . . . . A 108 SER CB . 30926 1 1291 . 1 . 1 108 108 SER N N 15 110.157 0.10 . 1 . . . . A 108 SER N . 30926 1 1292 . 1 . 1 109 109 ILE H H 1 8.423 0.05 . 1 . . . . A 109 ILE H . 30926 1 1293 . 1 . 1 109 109 ILE HA H 1 4.417 0.05 . 1 . . . . A 109 ILE HA . 30926 1 1294 . 1 . 1 109 109 ILE HB H 1 1.521 0.05 . 1 . . . . A 109 ILE HB . 30926 1 1295 . 1 . 1 109 109 ILE HG12 H 1 0.640 0.05 . 2 . . . . A 109 ILE HG12 . 30926 1 1296 . 1 . 1 109 109 ILE HG13 H 1 1.159 0.05 . 2 . . . . A 109 ILE HG13 . 30926 1 1297 . 1 . 1 109 109 ILE HG21 H 1 0.531 0.05 . 1 . . . . A 109 ILE HG21 . 30926 1 1298 . 1 . 1 109 109 ILE HG22 H 1 0.531 0.05 . 1 . . . . A 109 ILE HG22 . 30926 1 1299 . 1 . 1 109 109 ILE HG23 H 1 0.531 0.05 . 1 . . . . A 109 ILE HG23 . 30926 1 1300 . 1 . 1 109 109 ILE HD11 H 1 0.716 0.05 . 1 . . . . A 109 ILE HD11 . 30926 1 1301 . 1 . 1 109 109 ILE HD12 H 1 0.716 0.05 . 1 . . . . A 109 ILE HD12 . 30926 1 1302 . 1 . 1 109 109 ILE HD13 H 1 0.716 0.05 . 1 . . . . A 109 ILE HD13 . 30926 1 1303 . 1 . 1 109 109 ILE C C 13 174.323 0.50 . 1 . . . . A 109 ILE C . 30926 1 1304 . 1 . 1 109 109 ILE CA C 13 61.735 0.50 . 1 . . . . A 109 ILE CA . 30926 1 1305 . 1 . 1 109 109 ILE CB C 13 39.899 0.50 . 1 . . . . A 109 ILE CB . 30926 1 1306 . 1 . 1 109 109 ILE CG1 C 13 27.384 0.50 . 1 . . . . A 109 ILE CG1 . 30926 1 1307 . 1 . 1 109 109 ILE CG2 C 13 16.246 0.50 . 1 . . . . A 109 ILE CG2 . 30926 1 1308 . 1 . 1 109 109 ILE CD1 C 13 14.544 0.50 . 1 . . . . A 109 ILE CD1 . 30926 1 1309 . 1 . 1 109 109 ILE N N 15 125.657 0.10 . 1 . . . . A 109 ILE N . 30926 1 1310 . 1 . 1 110 110 LYS H H 1 8.317 0.05 . 1 . . . . A 110 LYS H . 30926 1 1311 . 1 . 1 110 110 LYS HA H 1 4.429 0.05 . 1 . . . . A 110 LYS HA . 30926 1 1312 . 1 . 1 110 110 LYS HB2 H 1 1.611 0.05 . 2 . . . . A 110 LYS HB2 . 30926 1 1313 . 1 . 1 110 110 LYS HB3 H 1 1.611 0.05 . 2 . . . . A 110 LYS HB3 . 30926 1 1314 . 1 . 1 110 110 LYS HG2 H 1 1.208 0.05 . 2 . . . . A 110 LYS HG2 . 30926 1 1315 . 1 . 1 110 110 LYS HG3 H 1 1.299 0.05 . 2 . . . . A 110 LYS HG3 . 30926 1 1316 . 1 . 1 110 110 LYS HD2 H 1 1.619 0.05 . 2 . . . . A 110 LYS HD2 . 30926 1 1317 . 1 . 1 110 110 LYS HD3 H 1 1.619 0.05 . 2 . . . . A 110 LYS HD3 . 30926 1 1318 . 1 . 1 110 110 LYS HE2 H 1 2.883 0.05 . 2 . . . . A 110 LYS HE2 . 30926 1 1319 . 1 . 1 110 110 LYS HE3 H 1 2.883 0.05 . 2 . . . . A 110 LYS HE3 . 30926 1 1320 . 1 . 1 110 110 LYS C C 13 176.127 0.50 . 1 . . . . A 110 LYS C . 30926 1 1321 . 1 . 1 110 110 LYS CA C 13 55.288 0.50 . 1 . . . . A 110 LYS CA . 30926 1 1322 . 1 . 1 110 110 LYS CB C 13 34.827 0.50 . 1 . . . . A 110 LYS CB . 30926 1 1323 . 1 . 1 110 110 LYS CG C 13 24.467 0.50 . 1 . . . . A 110 LYS CG . 30926 1 1324 . 1 . 1 110 110 LYS CD C 13 29.065 0.50 . 1 . . . . A 110 LYS CD . 30926 1 1325 . 1 . 1 110 110 LYS CE C 13 41.607 0.50 . 1 . . . . A 110 LYS CE . 30926 1 1326 . 1 . 1 110 110 LYS N N 15 126.000 0.10 . 1 . . . . A 110 LYS N . 30926 1 1327 . 1 . 1 111 111 ASN H H 1 9.645 0.05 . 1 . . . . A 111 ASN H . 30926 1 1328 . 1 . 1 111 111 ASN HA H 1 4.270 0.05 . 1 . . . . A 111 ASN HA . 30926 1 1329 . 1 . 1 111 111 ASN HB2 H 1 2.659 0.05 . 2 . . . . A 111 ASN HB2 . 30926 1 1330 . 1 . 1 111 111 ASN HB3 H 1 2.912 0.05 . 2 . . . . A 111 ASN HB3 . 30926 1 1331 . 1 . 1 111 111 ASN HD21 H 1 6.930 0.05 . 2 . . . . A 111 ASN HD21 . 30926 1 1332 . 1 . 1 111 111 ASN HD22 H 1 7.591 0.05 . 2 . . . . A 111 ASN HD22 . 30926 1 1333 . 1 . 1 111 111 ASN C C 13 173.588 0.50 . 1 . . . . A 111 ASN C . 30926 1 1334 . 1 . 1 111 111 ASN CA C 13 54.325 0.50 . 1 . . . . A 111 ASN CA . 30926 1 1335 . 1 . 1 111 111 ASN CB C 13 37.133 0.50 . 1 . . . . A 111 ASN CB . 30926 1 1336 . 1 . 1 111 111 ASN N N 15 126.935 0.10 . 1 . . . . A 111 ASN N . 30926 1 1337 . 1 . 1 111 111 ASN ND2 N 15 113.220 0.10 . 1 . . . . A 111 ASN ND2 . 30926 1 1338 . 1 . 1 112 112 ARG H H 1 8.882 0.05 . 1 . . . . A 112 ARG H . 30926 1 1339 . 1 . 1 112 112 ARG HA H 1 3.303 0.05 . 1 . . . . A 112 ARG HA . 30926 1 1340 . 1 . 1 112 112 ARG HB2 H 1 2.089 0.05 . 2 . . . . A 112 ARG HB2 . 30926 1 1341 . 1 . 1 112 112 ARG HB3 H 1 2.045 0.05 . 2 . . . . A 112 ARG HB3 . 30926 1 1342 . 1 . 1 112 112 ARG HG2 H 1 1.374 0.05 . 2 . . . . A 112 ARG HG2 . 30926 1 1343 . 1 . 1 112 112 ARG HG3 H 1 1.541 0.05 . 2 . . . . A 112 ARG HG3 . 30926 1 1344 . 1 . 1 112 112 ARG HD2 H 1 3.196 0.05 . 2 . . . . A 112 ARG HD2 . 30926 1 1345 . 1 . 1 112 112 ARG HD3 H 1 3.126 0.05 . 2 . . . . A 112 ARG HD3 . 30926 1 1346 . 1 . 1 112 112 ARG C C 13 173.950 0.50 . 1 . . . . A 112 ARG C . 30926 1 1347 . 1 . 1 112 112 ARG CA C 13 58.258 0.50 . 1 . . . . A 112 ARG CA . 30926 1 1348 . 1 . 1 112 112 ARG CB C 13 27.427 0.50 . 1 . . . . A 112 ARG CB . 30926 1 1349 . 1 . 1 112 112 ARG CG C 13 28.337 0.50 . 1 . . . . A 112 ARG CG . 30926 1 1350 . 1 . 1 112 112 ARG CD C 13 43.360 0.50 . 1 . . . . A 112 ARG CD . 30926 1 1351 . 1 . 1 112 112 ARG N N 15 106.860 0.10 . 1 . . . . A 112 ARG N . 30926 1 1352 . 1 . 1 113 113 ILE H H 1 7.857 0.05 . 1 . . . . A 113 ILE H . 30926 1 1353 . 1 . 1 113 113 ILE HA H 1 4.580 0.05 . 1 . . . . A 113 ILE HA . 30926 1 1354 . 1 . 1 113 113 ILE HB H 1 1.962 0.05 . 1 . . . . A 113 ILE HB . 30926 1 1355 . 1 . 1 113 113 ILE HG12 H 1 1.172 0.05 . 2 . . . . A 113 ILE HG12 . 30926 1 1356 . 1 . 1 113 113 ILE HG13 H 1 1.392 0.05 . 2 . . . . A 113 ILE HG13 . 30926 1 1357 . 1 . 1 113 113 ILE HG21 H 1 0.612 0.05 . 1 . . . . A 113 ILE HG21 . 30926 1 1358 . 1 . 1 113 113 ILE HG22 H 1 0.612 0.05 . 1 . . . . A 113 ILE HG22 . 30926 1 1359 . 1 . 1 113 113 ILE HG23 H 1 0.612 0.05 . 1 . . . . A 113 ILE HG23 . 30926 1 1360 . 1 . 1 113 113 ILE HD11 H 1 0.693 0.05 . 1 . . . . A 113 ILE HD11 . 30926 1 1361 . 1 . 1 113 113 ILE HD12 H 1 0.693 0.05 . 1 . . . . A 113 ILE HD12 . 30926 1 1362 . 1 . 1 113 113 ILE HD13 H 1 0.693 0.05 . 1 . . . . A 113 ILE HD13 . 30926 1 1363 . 1 . 1 113 113 ILE C C 13 175.890 0.50 . 1 . . . . A 113 ILE C . 30926 1 1364 . 1 . 1 113 113 ILE CA C 13 59.320 0.50 . 1 . . . . A 113 ILE CA . 30926 1 1365 . 1 . 1 113 113 ILE CB C 13 38.064 0.50 . 1 . . . . A 113 ILE CB . 30926 1 1366 . 1 . 1 113 113 ILE CG1 C 13 26.489 0.50 . 1 . . . . A 113 ILE CG1 . 30926 1 1367 . 1 . 1 113 113 ILE CG2 C 13 17.041 0.50 . 1 . . . . A 113 ILE CG2 . 30926 1 1368 . 1 . 1 113 113 ILE CD1 C 13 10.952 0.50 . 1 . . . . A 113 ILE CD1 . 30926 1 1369 . 1 . 1 113 113 ILE N N 15 120.435 0.10 . 1 . . . . A 113 ILE N . 30926 1 1370 . 1 . 1 114 114 ILE H H 1 9.679 0.05 . 1 . . . . A 114 ILE H . 30926 1 1371 . 1 . 1 114 114 ILE HA H 1 4.562 0.05 . 1 . . . . A 114 ILE HA . 30926 1 1372 . 1 . 1 114 114 ILE HB H 1 1.529 0.05 . 1 . . . . A 114 ILE HB . 30926 1 1373 . 1 . 1 114 114 ILE HG12 H 1 0.765 0.05 . 2 . . . . A 114 ILE HG12 . 30926 1 1374 . 1 . 1 114 114 ILE HG13 H 1 1.078 0.05 . 2 . . . . A 114 ILE HG13 . 30926 1 1375 . 1 . 1 114 114 ILE HG21 H 1 0.004 0.05 . 1 . . . . A 114 ILE HG21 . 30926 1 1376 . 1 . 1 114 114 ILE HG22 H 1 0.004 0.05 . 1 . . . . A 114 ILE HG22 . 30926 1 1377 . 1 . 1 114 114 ILE HG23 H 1 0.004 0.05 . 1 . . . . A 114 ILE HG23 . 30926 1 1378 . 1 . 1 114 114 ILE HD11 H 1 0.324 0.05 . 1 . . . . A 114 ILE HD11 . 30926 1 1379 . 1 . 1 114 114 ILE HD12 H 1 0.324 0.05 . 1 . . . . A 114 ILE HD12 . 30926 1 1380 . 1 . 1 114 114 ILE HD13 H 1 0.324 0.05 . 1 . . . . A 114 ILE HD13 . 30926 1 1381 . 1 . 1 114 114 ILE C C 13 175.419 0.50 . 1 . . . . A 114 ILE C . 30926 1 1382 . 1 . 1 114 114 ILE CA C 13 59.315 0.50 . 1 . . . . A 114 ILE CA . 30926 1 1383 . 1 . 1 114 114 ILE CB C 13 38.770 0.50 . 1 . . . . A 114 ILE CB . 30926 1 1384 . 1 . 1 114 114 ILE CG1 C 13 27.501 0.50 . 1 . . . . A 114 ILE CG1 . 30926 1 1385 . 1 . 1 114 114 ILE CG2 C 13 17.370 0.50 . 1 . . . . A 114 ILE CG2 . 30926 1 1386 . 1 . 1 114 114 ILE CD1 C 13 13.224 0.50 . 1 . . . . A 114 ILE CD1 . 30926 1 1387 . 1 . 1 114 114 ILE N N 15 131.311 0.10 . 1 . . . . A 114 ILE N . 30926 1 1388 . 1 . 1 115 115 THR H H 1 8.900 0.05 . 1 . . . . A 115 THR H . 30926 1 1389 . 1 . 1 115 115 THR HA H 1 4.661 0.05 . 1 . . . . A 115 THR HA . 30926 1 1390 . 1 . 1 115 115 THR HB H 1 3.936 0.05 . 1 . . . . A 115 THR HB . 30926 1 1391 . 1 . 1 115 115 THR HG21 H 1 0.914 0.05 . 1 . . . . A 115 THR HG21 . 30926 1 1392 . 1 . 1 115 115 THR HG22 H 1 0.914 0.05 . 1 . . . . A 115 THR HG22 . 30926 1 1393 . 1 . 1 115 115 THR HG23 H 1 0.914 0.05 . 1 . . . . A 115 THR HG23 . 30926 1 1394 . 1 . 1 115 115 THR C C 13 174.006 0.50 . 1 . . . . A 115 THR C . 30926 1 1395 . 1 . 1 115 115 THR CA C 13 63.511 0.50 . 1 . . . . A 115 THR CA . 30926 1 1396 . 1 . 1 115 115 THR CB C 13 68.268 0.50 . 1 . . . . A 115 THR CB . 30926 1 1397 . 1 . 1 115 115 THR CG2 C 13 20.877 0.50 . 1 . . . . A 115 THR CG2 . 30926 1 1398 . 1 . 1 115 115 THR N N 15 124.768 0.10 . 1 . . . . A 115 THR N . 30926 1 1399 . 1 . 1 116 116 VAL H H 1 9.346 0.05 . 1 . . . . A 116 VAL H . 30926 1 1400 . 1 . 1 116 116 VAL HA H 1 5.449 0.05 . 1 . . . . A 116 VAL HA . 30926 1 1401 . 1 . 1 116 116 VAL HB H 1 1.999 0.05 . 1 . . . . A 116 VAL HB . 30926 1 1402 . 1 . 1 116 116 VAL HG11 H 1 0.706 0.05 . 2 . . . . A 116 VAL HG11 . 30926 1 1403 . 1 . 1 116 116 VAL HG12 H 1 0.706 0.05 . 2 . . . . A 116 VAL HG12 . 30926 1 1404 . 1 . 1 116 116 VAL HG13 H 1 0.706 0.05 . 2 . . . . A 116 VAL HG13 . 30926 1 1405 . 1 . 1 116 116 VAL HG21 H 1 0.891 0.05 . 2 . . . . A 116 VAL HG21 . 30926 1 1406 . 1 . 1 116 116 VAL HG22 H 1 0.891 0.05 . 2 . . . . A 116 VAL HG22 . 30926 1 1407 . 1 . 1 116 116 VAL HG23 H 1 0.891 0.05 . 2 . . . . A 116 VAL HG23 . 30926 1 1408 . 1 . 1 116 116 VAL C C 13 174.089 0.50 . 1 . . . . A 116 VAL C . 30926 1 1409 . 1 . 1 116 116 VAL CA C 13 57.706 0.50 . 1 . . . . A 116 VAL CA . 30926 1 1410 . 1 . 1 116 116 VAL CB C 13 34.930 0.50 . 1 . . . . A 116 VAL CB . 30926 1 1411 . 1 . 1 116 116 VAL CG1 C 13 21.887 0.50 . 2 . . . . A 116 VAL CG1 . 30926 1 1412 . 1 . 1 116 116 VAL CG2 C 13 21.104 0.50 . 2 . . . . A 116 VAL CG2 . 30926 1 1413 . 1 . 1 116 116 VAL N N 15 124.483 0.10 . 1 . . . . A 116 VAL N . 30926 1 1414 . 1 . 1 117 117 ALA H H 1 9.441 0.05 . 1 . . . . A 117 ALA H . 30926 1 1415 . 1 . 1 117 117 ALA HA H 1 4.728 0.05 . 1 . . . . A 117 ALA HA . 30926 1 1416 . 1 . 1 117 117 ALA HB1 H 1 1.396 0.05 . 1 . . . . A 117 ALA HB1 . 30926 1 1417 . 1 . 1 117 117 ALA HB2 H 1 1.396 0.05 . 1 . . . . A 117 ALA HB2 . 30926 1 1418 . 1 . 1 117 117 ALA HB3 H 1 1.396 0.05 . 1 . . . . A 117 ALA HB3 . 30926 1 1419 . 1 . 1 117 117 ALA C C 13 174.480 0.50 . 1 . . . . A 117 ALA C . 30926 1 1420 . 1 . 1 117 117 ALA CA C 13 50.567 0.50 . 1 . . . . A 117 ALA CA . 30926 1 1421 . 1 . 1 117 117 ALA CB C 13 21.014 0.50 . 1 . . . . A 117 ALA CB . 30926 1 1422 . 1 . 1 117 117 ALA N N 15 123.773 0.10 . 1 . . . . A 117 ALA N . 30926 1 1423 . 1 . 1 118 118 ASP H H 1 8.831 0.05 . 1 . . . . A 118 ASP H . 30926 1 1424 . 1 . 1 118 118 ASP HA H 1 5.263 0.05 . 1 . . . . A 118 ASP HA . 30926 1 1425 . 1 . 1 118 118 ASP HB2 H 1 2.442 0.05 . 2 . . . . A 118 ASP HB2 . 30926 1 1426 . 1 . 1 118 118 ASP HB3 H 1 3.223 0.05 . 2 . . . . A 118 ASP HB3 . 30926 1 1427 . 1 . 1 118 118 ASP CA C 13 49.398 0.50 . 1 . . . . A 118 ASP CA . 30926 1 1428 . 1 . 1 118 118 ASP CB C 13 43.032 0.50 . 1 . . . . A 118 ASP CB . 30926 1 1429 . 1 . 1 118 118 ASP N N 15 125.278 0.10 . 1 . . . . A 118 ASP N . 30926 1 1430 . 1 . 1 119 119 PRO HA H 1 4.362 0.05 . 1 . . . . A 119 PRO HA . 30926 1 1431 . 1 . 1 119 119 PRO HB2 H 1 2.148 0.05 . 2 . . . . A 119 PRO HB2 . 30926 1 1432 . 1 . 1 119 119 PRO HB3 H 1 2.533 0.05 . 2 . . . . A 119 PRO HB3 . 30926 1 1433 . 1 . 1 119 119 PRO HG2 H 1 2.158 0.05 . 2 . . . . A 119 PRO HG2 . 30926 1 1434 . 1 . 1 119 119 PRO HG3 H 1 2.305 0.05 . 2 . . . . A 119 PRO HG3 . 30926 1 1435 . 1 . 1 119 119 PRO HD2 H 1 2.935 0.05 . 2 . . . . A 119 PRO HD2 . 30926 1 1436 . 1 . 1 119 119 PRO HD3 H 1 3.082 0.05 . 2 . . . . A 119 PRO HD3 . 30926 1 1437 . 1 . 1 119 119 PRO CA C 13 65.007 0.50 . 1 . . . . A 119 PRO CA . 30926 1 1438 . 1 . 1 119 119 PRO CB C 13 32.761 0.50 . 1 . . . . A 119 PRO CB . 30926 1 1439 . 1 . 1 119 119 PRO CG C 13 27.928 0.50 . 1 . . . . A 119 PRO CG . 30926 1 1440 . 1 . 1 119 119 PRO CD C 13 52.192 0.50 . 1 . . . . A 119 PRO CD . 30926 1 1441 . 1 . 1 120 120 GLY H H 1 9.120 0.05 . 1 . . . . A 120 GLY H . 30926 1 1442 . 1 . 1 120 120 GLY HA2 H 1 3.683 0.05 . 2 . . . . A 120 GLY HA2 . 30926 1 1443 . 1 . 1 120 120 GLY HA3 H 1 4.408 0.05 . 2 . . . . A 120 GLY HA3 . 30926 1 1444 . 1 . 1 120 120 GLY C C 13 174.373 0.50 . 1 . . . . A 120 GLY C . 30926 1 1445 . 1 . 1 120 120 GLY CA C 13 45.245 0.50 . 1 . . . . A 120 GLY CA . 30926 1 1446 . 1 . 1 120 120 GLY N N 15 106.292 0.10 . 1 . . . . A 120 GLY N . 30926 1 1447 . 1 . 1 121 121 LYS H H 1 8.027 0.05 . 1 . . . . A 121 LYS H . 30926 1 1448 . 1 . 1 121 121 LYS HA H 1 4.496 0.05 . 1 . . . . A 121 LYS HA . 30926 1 1449 . 1 . 1 121 121 LYS HB2 H 1 1.475 0.05 . 2 . . . . A 121 LYS HB2 . 30926 1 1450 . 1 . 1 121 121 LYS HB3 H 1 1.692 0.05 . 2 . . . . A 121 LYS HB3 . 30926 1 1451 . 1 . 1 121 121 LYS HG2 H 1 1.169 0.05 . 2 . . . . A 121 LYS HG2 . 30926 1 1452 . 1 . 1 121 121 LYS HG3 H 1 1.236 0.05 . 2 . . . . A 121 LYS HG3 . 30926 1 1453 . 1 . 1 121 121 LYS HD2 H 1 1.555 0.05 . 2 . . . . A 121 LYS HD2 . 30926 1 1454 . 1 . 1 121 121 LYS HD3 H 1 1.555 0.05 . 2 . . . . A 121 LYS HD3 . 30926 1 1455 . 1 . 1 121 121 LYS HE2 H 1 2.865 0.05 . 2 . . . . A 121 LYS HE2 . 30926 1 1456 . 1 . 1 121 121 LYS HE3 H 1 2.865 0.05 . 2 . . . . A 121 LYS HE3 . 30926 1 1457 . 1 . 1 121 121 LYS C C 13 175.014 0.50 . 1 . . . . A 121 LYS C . 30926 1 1458 . 1 . 1 121 121 LYS CA C 13 57.438 0.50 . 1 . . . . A 121 LYS CA . 30926 1 1459 . 1 . 1 121 121 LYS CB C 13 37.974 0.50 . 1 . . . . A 121 LYS CB . 30926 1 1460 . 1 . 1 121 121 LYS CG C 13 24.593 0.50 . 1 . . . . A 121 LYS CG . 30926 1 1461 . 1 . 1 121 121 LYS CD C 13 28.889 0.50 . 1 . . . . A 121 LYS CD . 30926 1 1462 . 1 . 1 121 121 LYS CE C 13 41.757 0.50 . 1 . . . . A 121 LYS CE . 30926 1 1463 . 1 . 1 121 121 LYS N N 15 118.372 0.10 . 1 . . . . A 121 LYS N . 30926 1 1464 . 1 . 1 122 122 GLY H H 1 9.088 0.05 . 1 . . . . A 122 GLY H . 30926 1 1465 . 1 . 1 122 122 GLY HA2 H 1 3.887 0.05 . 2 . . . . A 122 GLY HA2 . 30926 1 1466 . 1 . 1 122 122 GLY HA3 H 1 4.520 0.05 . 2 . . . . A 122 GLY HA3 . 30926 1 1467 . 1 . 1 122 122 GLY C C 13 172.706 0.50 . 1 . . . . A 122 GLY C . 30926 1 1468 . 1 . 1 122 122 GLY CA C 13 44.507 0.50 . 1 . . . . A 122 GLY CA . 30926 1 1469 . 1 . 1 122 122 GLY N N 15 109.063 0.10 . 1 . . . . A 122 GLY N . 30926 1 1470 . 1 . 1 123 123 ILE H H 1 8.479 0.05 . 1 . . . . A 123 ILE H . 30926 1 1471 . 1 . 1 123 123 ILE HA H 1 5.002 0.05 . 1 . . . . A 123 ILE HA . 30926 1 1472 . 1 . 1 123 123 ILE HB H 1 1.867 0.05 . 1 . . . . A 123 ILE HB . 30926 1 1473 . 1 . 1 123 123 ILE HG12 H 1 1.286 0.05 . 2 . . . . A 123 ILE HG12 . 30926 1 1474 . 1 . 1 123 123 ILE HG13 H 1 1.492 0.05 . 2 . . . . A 123 ILE HG13 . 30926 1 1475 . 1 . 1 123 123 ILE HG21 H 1 0.675 0.05 . 1 . . . . A 123 ILE HG21 . 30926 1 1476 . 1 . 1 123 123 ILE HG22 H 1 0.675 0.05 . 1 . . . . A 123 ILE HG22 . 30926 1 1477 . 1 . 1 123 123 ILE HG23 H 1 0.675 0.05 . 1 . . . . A 123 ILE HG23 . 30926 1 1478 . 1 . 1 123 123 ILE HD11 H 1 0.615 0.05 . 1 . . . . A 123 ILE HD11 . 30926 1 1479 . 1 . 1 123 123 ILE HD12 H 1 0.615 0.05 . 1 . . . . A 123 ILE HD12 . 30926 1 1480 . 1 . 1 123 123 ILE HD13 H 1 0.615 0.05 . 1 . . . . A 123 ILE HD13 . 30926 1 1481 . 1 . 1 123 123 ILE C C 13 176.836 0.50 . 1 . . . . A 123 ILE C . 30926 1 1482 . 1 . 1 123 123 ILE CA C 13 59.400 0.50 . 1 . . . . A 123 ILE CA . 30926 1 1483 . 1 . 1 123 123 ILE CB C 13 35.395 0.50 . 1 . . . . A 123 ILE CB . 30926 1 1484 . 1 . 1 123 123 ILE CG1 C 13 27.085 0.50 . 1 . . . . A 123 ILE CG1 . 30926 1 1485 . 1 . 1 123 123 ILE CG2 C 13 16.874 0.50 . 1 . . . . A 123 ILE CG2 . 30926 1 1486 . 1 . 1 123 123 ILE CD1 C 13 10.568 0.50 . 1 . . . . A 123 ILE CD1 . 30926 1 1487 . 1 . 1 123 123 ILE N N 15 122.361 0.10 . 1 . . . . A 123 ILE N . 30926 1 1488 . 1 . 1 124 124 VAL H H 1 9.336 0.05 . 1 . . . . A 124 VAL H . 30926 1 1489 . 1 . 1 124 124 VAL HA H 1 4.252 0.05 . 1 . . . . A 124 VAL HA . 30926 1 1490 . 1 . 1 124 124 VAL HB H 1 1.723 0.05 . 1 . . . . A 124 VAL HB . 30926 1 1491 . 1 . 1 124 124 VAL HG11 H 1 0.457 0.05 . 2 . . . . A 124 VAL HG11 . 30926 1 1492 . 1 . 1 124 124 VAL HG12 H 1 0.457 0.05 . 2 . . . . A 124 VAL HG12 . 30926 1 1493 . 1 . 1 124 124 VAL HG13 H 1 0.457 0.05 . 2 . . . . A 124 VAL HG13 . 30926 1 1494 . 1 . 1 124 124 VAL HG21 H 1 0.736 0.05 . 2 . . . . A 124 VAL HG21 . 30926 1 1495 . 1 . 1 124 124 VAL HG22 H 1 0.736 0.05 . 2 . . . . A 124 VAL HG22 . 30926 1 1496 . 1 . 1 124 124 VAL HG23 H 1 0.736 0.05 . 2 . . . . A 124 VAL HG23 . 30926 1 1497 . 1 . 1 124 124 VAL C C 13 173.613 0.50 . 1 . . . . A 124 VAL C . 30926 1 1498 . 1 . 1 124 124 VAL CA C 13 60.685 0.50 . 1 . . . . A 124 VAL CA . 30926 1 1499 . 1 . 1 124 124 VAL CB C 13 35.968 0.50 . 1 . . . . A 124 VAL CB . 30926 1 1500 . 1 . 1 124 124 VAL CG1 C 13 21.236 0.50 . 2 . . . . A 124 VAL CG1 . 30926 1 1501 . 1 . 1 124 124 VAL CG2 C 13 20.159 0.50 . 2 . . . . A 124 VAL CG2 . 30926 1 1502 . 1 . 1 124 124 VAL N N 15 129.092 0.10 . 1 . . . . A 124 VAL N . 30926 1 1503 . 1 . 1 125 125 ARG H H 1 8.270 0.05 . 1 . . . . A 125 ARG H . 30926 1 1504 . 1 . 1 125 125 ARG HA H 1 5.088 0.05 . 1 . . . . A 125 ARG HA . 30926 1 1505 . 1 . 1 125 125 ARG HB2 H 1 1.401 0.05 . 2 . . . . A 125 ARG HB2 . 30926 1 1506 . 1 . 1 125 125 ARG HB3 H 1 1.517 0.05 . 2 . . . . A 125 ARG HB3 . 30926 1 1507 . 1 . 1 125 125 ARG HG2 H 1 1.468 0.05 . 2 . . . . A 125 ARG HG2 . 30926 1 1508 . 1 . 1 125 125 ARG HG3 H 1 1.562 0.05 . 2 . . . . A 125 ARG HG3 . 30926 1 1509 . 1 . 1 125 125 ARG HD2 H 1 3.023 0.05 . 2 . . . . A 125 ARG HD2 . 30926 1 1510 . 1 . 1 125 125 ARG HD3 H 1 3.023 0.05 . 2 . . . . A 125 ARG HD3 . 30926 1 1511 . 1 . 1 125 125 ARG C C 13 175.813 0.50 . 1 . . . . A 125 ARG C . 30926 1 1512 . 1 . 1 125 125 ARG CA C 13 54.613 0.50 . 1 . . . . A 125 ARG CA . 30926 1 1513 . 1 . 1 125 125 ARG CB C 13 31.723 0.50 . 1 . . . . A 125 ARG CB . 30926 1 1514 . 1 . 1 125 125 ARG CG C 13 27.864 0.50 . 1 . . . . A 125 ARG CG . 30926 1 1515 . 1 . 1 125 125 ARG CD C 13 43.468 0.50 . 1 . . . . A 125 ARG CD . 30926 1 1516 . 1 . 1 125 125 ARG N N 15 123.256 0.10 . 1 . . . . A 125 ARG N . 30926 1 1517 . 1 . 1 126 126 TYR H H 1 9.165 0.05 . 1 . . . . A 126 TYR H . 30926 1 1518 . 1 . 1 126 126 TYR HA H 1 4.952 0.05 . 1 . . . . A 126 TYR HA . 30926 1 1519 . 1 . 1 126 126 TYR HB2 H 1 2.612 0.05 . 2 . . . . A 126 TYR HB2 . 30926 1 1520 . 1 . 1 126 126 TYR HB3 H 1 3.391 0.05 . 2 . . . . A 126 TYR HB3 . 30926 1 1521 . 1 . 1 126 126 TYR HD1 H 1 6.962 0.05 . 3 . . . . A 126 TYR HD1 . 30926 1 1522 . 1 . 1 126 126 TYR HD2 H 1 6.962 0.05 . 3 . . . . A 126 TYR HD2 . 30926 1 1523 . 1 . 1 126 126 TYR HE1 H 1 6.685 0.05 . 3 . . . . A 126 TYR HE1 . 30926 1 1524 . 1 . 1 126 126 TYR HE2 H 1 6.694 0.05 . 3 . . . . A 126 TYR HE2 . 30926 1 1525 . 1 . 1 126 126 TYR C C 13 176.432 0.50 . 1 . . . . A 126 TYR C . 30926 1 1526 . 1 . 1 126 126 TYR CA C 13 56.545 0.50 . 1 . . . . A 126 TYR CA . 30926 1 1527 . 1 . 1 126 126 TYR CB C 13 43.549 0.50 . 1 . . . . A 126 TYR CB . 30926 1 1528 . 1 . 1 126 126 TYR CD1 C 13 132.136 0.50 . 3 . . . . A 126 TYR CD1 . 30926 1 1529 . 1 . 1 126 126 TYR CD2 C 13 132.136 0.50 . 3 . . . . A 126 TYR CD2 . 30926 1 1530 . 1 . 1 126 126 TYR CE1 C 13 118.197 0.50 . 3 . . . . A 126 TYR CE1 . 30926 1 1531 . 1 . 1 126 126 TYR CE2 C 13 118.197 0.50 . 3 . . . . A 126 TYR CE2 . 30926 1 1532 . 1 . 1 126 126 TYR N N 15 122.222 0.10 . 1 . . . . A 126 TYR N . 30926 1 1533 . 1 . 1 127 127 SER H H 1 9.461 0.05 . 1 . . . . A 127 SER H . 30926 1 1534 . 1 . 1 127 127 SER HA H 1 4.682 0.05 . 1 . . . . A 127 SER HA . 30926 1 1535 . 1 . 1 127 127 SER HB2 H 1 4.077 0.05 . 2 . . . . A 127 SER HB2 . 30926 1 1536 . 1 . 1 127 127 SER HB3 H 1 4.388 0.05 . 2 . . . . A 127 SER HB3 . 30926 1 1537 . 1 . 1 127 127 SER C C 13 175.678 0.50 . 1 . . . . A 127 SER C . 30926 1 1538 . 1 . 1 127 127 SER CA C 13 57.622 0.50 . 1 . . . . A 127 SER CA . 30926 1 1539 . 1 . 1 127 127 SER CB C 13 64.238 0.50 . 1 . . . . A 127 SER CB . 30926 1 1540 . 1 . 1 127 127 SER N N 15 117.529 0.10 . 1 . . . . A 127 SER N . 30926 1 1541 . 1 . 1 128 128 MET H H 1 8.368 0.05 . 1 . . . . A 128 MET H . 30926 1 1542 . 1 . 1 128 128 MET HA H 1 4.038 0.05 . 1 . . . . A 128 MET HA . 30926 1 1543 . 1 . 1 128 128 MET HB2 H 1 2.134 0.05 . 2 . . . . A 128 MET HB2 . 30926 1 1544 . 1 . 1 128 128 MET HB3 H 1 1.917 0.05 . 2 . . . . A 128 MET HB3 . 30926 1 1545 . 1 . 1 128 128 MET HG2 H 1 2.405 0.05 . 2 . . . . A 128 MET HG2 . 30926 1 1546 . 1 . 1 128 128 MET HG3 H 1 2.519 0.05 . 2 . . . . A 128 MET HG3 . 30926 1 1547 . 1 . 1 128 128 MET HE1 H 1 1.801 0.05 . 1 . . . . A 128 MET HE1 . 30926 1 1548 . 1 . 1 128 128 MET HE2 H 1 1.801 0.05 . 1 . . . . A 128 MET HE2 . 30926 1 1549 . 1 . 1 128 128 MET HE3 H 1 1.801 0.05 . 1 . . . . A 128 MET HE3 . 30926 1 1550 . 1 . 1 128 128 MET C C 13 177.890 0.50 . 1 . . . . A 128 MET C . 30926 1 1551 . 1 . 1 128 128 MET CA C 13 59.147 0.50 . 1 . . . . A 128 MET CA . 30926 1 1552 . 1 . 1 128 128 MET CB C 13 31.749 0.50 . 1 . . . . A 128 MET CB . 30926 1 1553 . 1 . 1 128 128 MET CG C 13 32.022 0.50 . 1 . . . . A 128 MET CG . 30926 1 1554 . 1 . 1 128 128 MET CE C 13 17.283 0.50 . 1 . . . . A 128 MET CE . 30926 1 1555 . 1 . 1 128 128 MET N N 15 122.303 0.10 . 1 . . . . A 128 MET N . 30926 1 1556 . 1 . 1 129 129 ASP H H 1 8.750 0.05 . 1 . . . . A 129 ASP H . 30926 1 1557 . 1 . 1 129 129 ASP HA H 1 4.300 0.05 . 1 . . . . A 129 ASP HA . 30926 1 1558 . 1 . 1 129 129 ASP HB2 H 1 2.483 0.05 . 2 . . . . A 129 ASP HB2 . 30926 1 1559 . 1 . 1 129 129 ASP HB3 H 1 2.649 0.05 . 2 . . . . A 129 ASP HB3 . 30926 1 1560 . 1 . 1 129 129 ASP C C 13 178.837 0.50 . 1 . . . . A 129 ASP C . 30926 1 1561 . 1 . 1 129 129 ASP CA C 13 57.574 0.50 . 1 . . . . A 129 ASP CA . 30926 1 1562 . 1 . 1 129 129 ASP CB C 13 39.913 0.50 . 1 . . . . A 129 ASP CB . 30926 1 1563 . 1 . 1 129 129 ASP N N 15 117.939 0.10 . 1 . . . . A 129 ASP N . 30926 1 1564 . 1 . 1 130 130 ASP H H 1 7.897 0.05 . 1 . . . . A 130 ASP H . 30926 1 1565 . 1 . 1 130 130 ASP HA H 1 4.433 0.05 . 1 . . . . A 130 ASP HA . 30926 1 1566 . 1 . 1 130 130 ASP HB2 H 1 2.792 0.05 . 2 . . . . A 130 ASP HB2 . 30926 1 1567 . 1 . 1 130 130 ASP HB3 H 1 3.033 0.05 . 2 . . . . A 130 ASP HB3 . 30926 1 1568 . 1 . 1 130 130 ASP C C 13 179.780 0.50 . 1 . . . . A 130 ASP C . 30926 1 1569 . 1 . 1 130 130 ASP CA C 13 57.183 0.50 . 1 . . . . A 130 ASP CA . 30926 1 1570 . 1 . 1 130 130 ASP CB C 13 39.513 0.50 . 1 . . . . A 130 ASP CB . 30926 1 1571 . 1 . 1 130 130 ASP N N 15 121.081 0.10 . 1 . . . . A 130 ASP N . 30926 1 1572 . 1 . 1 131 131 PHE H H 1 8.845 0.05 . 1 . . . . A 131 PHE H . 30926 1 1573 . 1 . 1 131 131 PHE HA H 1 3.589 0.05 . 1 . . . . A 131 PHE HA . 30926 1 1574 . 1 . 1 131 131 PHE HB2 H 1 2.779 0.05 . 2 . . . . A 131 PHE HB2 . 30926 1 1575 . 1 . 1 131 131 PHE HB3 H 1 2.876 0.05 . 2 . . . . A 131 PHE HB3 . 30926 1 1576 . 1 . 1 131 131 PHE HD1 H 1 6.402 0.05 . 3 . . . . A 131 PHE HD1 . 30926 1 1577 . 1 . 1 131 131 PHE HD2 H 1 6.402 0.05 . 3 . . . . A 131 PHE HD2 . 30926 1 1578 . 1 . 1 131 131 PHE HE1 H 1 5.969 0.05 . 3 . . . . A 131 PHE HE1 . 30926 1 1579 . 1 . 1 131 131 PHE HE2 H 1 5.969 0.05 . 3 . . . . A 131 PHE HE2 . 30926 1 1580 . 1 . 1 131 131 PHE HZ H 1 5.890 0.05 . 1 . . . . A 131 PHE HZ . 30926 1 1581 . 1 . 1 131 131 PHE C C 13 177.313 0.50 . 1 . . . . A 131 PHE C . 30926 1 1582 . 1 . 1 131 131 PHE CA C 13 61.589 0.50 . 1 . . . . A 131 PHE CA . 30926 1 1583 . 1 . 1 131 131 PHE CB C 13 39.657 0.50 . 1 . . . . A 131 PHE CB . 30926 1 1584 . 1 . 1 131 131 PHE CD1 C 13 131.307 0.50 . 3 . . . . A 131 PHE CD1 . 30926 1 1585 . 1 . 1 131 131 PHE CE1 C 13 129.876 0.50 . 3 . . . . A 131 PHE CE1 . 30926 1 1586 . 1 . 1 131 131 PHE CZ C 13 127.969 0.50 . 1 . . . . A 131 PHE CZ . 30926 1 1587 . 1 . 1 131 131 PHE N N 15 121.432 0.10 . 1 . . . . A 131 PHE N . 30926 1 1588 . 1 . 1 132 132 CYS H H 1 8.572 0.05 . 1 . . . . A 132 CYS H . 30926 1 1589 . 1 . 1 132 132 CYS HA H 1 4.240 0.05 . 1 . . . . A 132 CYS HA . 30926 1 1590 . 1 . 1 132 132 CYS HB2 H 1 3.133 0.05 . 2 . . . . A 132 CYS HB2 . 30926 1 1591 . 1 . 1 132 132 CYS HB3 H 1 3.074 0.05 . 2 . . . . A 132 CYS HB3 . 30926 1 1592 . 1 . 1 132 132 CYS C C 13 175.527 0.50 . 1 . . . . A 132 CYS C . 30926 1 1593 . 1 . 1 132 132 CYS CA C 13 64.829 0.50 . 1 . . . . A 132 CYS CA . 30926 1 1594 . 1 . 1 132 132 CYS CB C 13 26.831 0.50 . 1 . . . . A 132 CYS CB . 30926 1 1595 . 1 . 1 132 132 CYS N N 15 115.319 0.10 . 1 . . . . A 132 CYS N . 30926 1 1596 . 1 . 1 133 133 SER H H 1 7.462 0.05 . 1 . . . . A 133 SER H . 30926 1 1597 . 1 . 1 133 133 SER HA H 1 4.296 0.05 . 1 . . . . A 133 SER HA . 30926 1 1598 . 1 . 1 133 133 SER HB2 H 1 3.999 0.05 . 2 . . . . A 133 SER HB2 . 30926 1 1599 . 1 . 1 133 133 SER HB3 H 1 3.934 0.05 . 2 . . . . A 133 SER HB3 . 30926 1 1600 . 1 . 1 133 133 SER C C 13 174.847 0.50 . 1 . . . . A 133 SER C . 30926 1 1601 . 1 . 1 133 133 SER CA C 13 61.137 0.50 . 1 . . . . A 133 SER CA . 30926 1 1602 . 1 . 1 133 133 SER CB C 13 63.337 0.50 . 1 . . . . A 133 SER CB . 30926 1 1603 . 1 . 1 133 133 SER N N 15 113.230 0.10 . 1 . . . . A 133 SER N . 30926 1 1604 . 1 . 1 134 134 ILE H H 1 6.906 0.05 . 1 . . . . A 134 ILE H . 30926 1 1605 . 1 . 1 134 134 ILE HA H 1 4.534 0.05 . 1 . . . . A 134 ILE HA . 30926 1 1606 . 1 . 1 134 134 ILE HB H 1 2.071 0.05 . 1 . . . . A 134 ILE HB . 30926 1 1607 . 1 . 1 134 134 ILE HG12 H 1 0.848 0.05 . 2 . . . . A 134 ILE HG12 . 30926 1 1608 . 1 . 1 134 134 ILE HG13 H 1 0.979 0.05 . 2 . . . . A 134 ILE HG13 . 30926 1 1609 . 1 . 1 134 134 ILE HG21 H 1 0.845 0.05 . 1 . . . . A 134 ILE HG21 . 30926 1 1610 . 1 . 1 134 134 ILE HG22 H 1 0.845 0.05 . 1 . . . . A 134 ILE HG22 . 30926 1 1611 . 1 . 1 134 134 ILE HG23 H 1 0.845 0.05 . 1 . . . . A 134 ILE HG23 . 30926 1 1612 . 1 . 1 134 134 ILE HD11 H 1 0.464 0.05 . 1 . . . . A 134 ILE HD11 . 30926 1 1613 . 1 . 1 134 134 ILE HD12 H 1 0.464 0.05 . 1 . . . . A 134 ILE HD12 . 30926 1 1614 . 1 . 1 134 134 ILE HD13 H 1 0.464 0.05 . 1 . . . . A 134 ILE HD13 . 30926 1 1615 . 1 . 1 134 134 ILE C C 13 175.158 0.50 . 1 . . . . A 134 ILE C . 30926 1 1616 . 1 . 1 134 134 ILE CA C 13 61.511 0.50 . 1 . . . . A 134 ILE CA . 30926 1 1617 . 1 . 1 134 134 ILE CB C 13 39.154 0.50 . 1 . . . . A 134 ILE CB . 30926 1 1618 . 1 . 1 134 134 ILE CG1 C 13 25.642 0.50 . 1 . . . . A 134 ILE CG1 . 30926 1 1619 . 1 . 1 134 134 ILE CG2 C 13 18.186 0.50 . 1 . . . . A 134 ILE CG2 . 30926 1 1620 . 1 . 1 134 134 ILE CD1 C 13 13.439 0.50 . 1 . . . . A 134 ILE CD1 . 30926 1 1621 . 1 . 1 134 134 ILE N N 15 111.714 0.10 . 1 . . . . A 134 ILE N . 30926 1 1622 . 1 . 1 135 135 TRP H H 1 7.552 0.05 . 1 . . . . A 135 TRP H . 30926 1 1623 . 1 . 1 135 135 TRP HA H 1 4.817 0.05 . 1 . . . . A 135 TRP HA . 30926 1 1624 . 1 . 1 135 135 TRP HB2 H 1 2.876 0.05 . 2 . . . . A 135 TRP HB2 . 30926 1 1625 . 1 . 1 135 135 TRP HB3 H 1 2.876 0.05 . 2 . . . . A 135 TRP HB3 . 30926 1 1626 . 1 . 1 135 135 TRP HD1 H 1 8.044 0.05 . 1 . . . . A 135 TRP HD1 . 30926 1 1627 . 1 . 1 135 135 TRP HE1 H 1 9.677 0.05 . 1 . . . . A 135 TRP HE1 . 30926 1 1628 . 1 . 1 135 135 TRP HE3 H 1 7.590 0.05 . 1 . . . . A 135 TRP HE3 . 30926 1 1629 . 1 . 1 135 135 TRP HZ2 H 1 6.937 0.05 . 1 . . . . A 135 TRP HZ2 . 30926 1 1630 . 1 . 1 135 135 TRP HZ3 H 1 6.720 0.05 . 1 . . . . A 135 TRP HZ3 . 30926 1 1631 . 1 . 1 135 135 TRP HH2 H 1 6.811 0.05 . 1 . . . . A 135 TRP HH2 . 30926 1 1632 . 1 . 1 135 135 TRP C C 13 176.760 0.50 . 1 . . . . A 135 TRP C . 30926 1 1633 . 1 . 1 135 135 TRP CA C 13 55.174 0.50 . 1 . . . . A 135 TRP CA . 30926 1 1634 . 1 . 1 135 135 TRP CB C 13 29.845 0.50 . 1 . . . . A 135 TRP CB . 30926 1 1635 . 1 . 1 135 135 TRP CD1 C 13 125.542 0.50 . 1 . . . . A 135 TRP CD1 . 30926 1 1636 . 1 . 1 135 135 TRP CE3 C 13 121.278 0.50 . 1 . . . . A 135 TRP CE3 . 30926 1 1637 . 1 . 1 135 135 TRP CZ2 C 13 113.809 0.50 . 1 . . . . A 135 TRP CZ2 . 30926 1 1638 . 1 . 1 135 135 TRP CZ3 C 13 122.363 0.50 . 1 . . . . A 135 TRP CZ3 . 30926 1 1639 . 1 . 1 135 135 TRP CH2 C 13 125.843 0.50 . 1 . . . . A 135 TRP CH2 . 30926 1 1640 . 1 . 1 135 135 TRP N N 15 124.779 0.10 . 1 . . . . A 135 TRP N . 30926 1 1641 . 1 . 1 135 135 TRP NE1 N 15 127.608 0.10 . 1 . . . . A 135 TRP NE1 . 30926 1 1642 . 1 . 1 136 136 THR H H 1 8.139 0.05 . 1 . . . . A 136 THR H . 30926 1 1643 . 1 . 1 136 136 THR HA H 1 4.045 0.05 . 1 . . . . A 136 THR HA . 30926 1 1644 . 1 . 1 136 136 THR HB H 1 4.298 0.05 . 1 . . . . A 136 THR HB . 30926 1 1645 . 1 . 1 136 136 THR HG21 H 1 0.959 0.05 . 1 . . . . A 136 THR HG21 . 30926 1 1646 . 1 . 1 136 136 THR HG22 H 1 0.959 0.05 . 1 . . . . A 136 THR HG22 . 30926 1 1647 . 1 . 1 136 136 THR HG23 H 1 0.959 0.05 . 1 . . . . A 136 THR HG23 . 30926 1 1648 . 1 . 1 136 136 THR CA C 13 62.346 0.50 . 1 . . . . A 136 THR CA . 30926 1 1649 . 1 . 1 136 136 THR CB C 13 69.934 0.50 . 1 . . . . A 136 THR CB . 30926 1 1650 . 1 . 1 136 136 THR CG2 C 13 21.246 0.50 . 1 . . . . A 136 THR CG2 . 30926 1 1651 . 1 . 1 136 136 THR N N 15 118.011 0.10 . 1 . . . . A 136 THR N . 30926 1 1652 . 1 . 1 137 137 GLY H H 1 5.070 0.05 . 1 . . . . A 137 GLY H . 30926 1 1653 . 1 . 1 137 137 GLY HA2 H 1 1.153 0.05 . 2 . . . . A 137 GLY HA2 . 30926 1 1654 . 1 . 1 137 137 GLY HA3 H 1 3.725 0.05 . 2 . . . . A 137 GLY HA3 . 30926 1 1655 . 1 . 1 137 137 GLY C C 13 173.151 0.50 . 1 . . . . A 137 GLY C . 30926 1 1656 . 1 . 1 137 137 GLY CA C 13 44.283 0.50 . 1 . . . . A 137 GLY CA . 30926 1 1657 . 1 . 1 137 137 GLY N N 15 107.514 0.10 . 1 . . . . A 137 GLY N . 30926 1 1658 . 1 . 1 138 138 GLY H H 1 7.732 0.05 . 1 . . . . A 138 GLY H . 30926 1 1659 . 1 . 1 138 138 GLY HA2 H 1 3.647 0.05 . 2 . . . . A 138 GLY HA2 . 30926 1 1660 . 1 . 1 138 138 GLY HA3 H 1 4.383 0.05 . 2 . . . . A 138 GLY HA3 . 30926 1 1661 . 1 . 1 138 138 GLY C C 13 175.122 0.50 . 1 . . . . A 138 GLY C . 30926 1 1662 . 1 . 1 138 138 GLY CA C 13 46.693 0.50 . 1 . . . . A 138 GLY CA . 30926 1 1663 . 1 . 1 138 138 GLY N N 15 106.101 0.10 . 1 . . . . A 138 GLY N . 30926 1 1664 . 1 . 1 139 139 LEU H H 1 8.818 0.05 . 1 . . . . A 139 LEU H . 30926 1 1665 . 1 . 1 139 139 LEU HA H 1 5.646 0.05 . 1 . . . . A 139 LEU HA . 30926 1 1666 . 1 . 1 139 139 LEU HB2 H 1 1.278 0.05 . 2 . . . . A 139 LEU HB2 . 30926 1 1667 . 1 . 1 139 139 LEU HB3 H 1 1.571 0.05 . 2 . . . . A 139 LEU HB3 . 30926 1 1668 . 1 . 1 139 139 LEU HG H 1 1.727 0.05 . 1 . . . . A 139 LEU HG . 30926 1 1669 . 1 . 1 139 139 LEU HD11 H 1 0.436 0.05 . 2 . . . . A 139 LEU HD11 . 30926 1 1670 . 1 . 1 139 139 LEU HD12 H 1 0.436 0.05 . 2 . . . . A 139 LEU HD12 . 30926 1 1671 . 1 . 1 139 139 LEU HD13 H 1 0.436 0.05 . 2 . . . . A 139 LEU HD13 . 30926 1 1672 . 1 . 1 139 139 LEU HD21 H 1 0.792 0.05 . 2 . . . . A 139 LEU HD21 . 30926 1 1673 . 1 . 1 139 139 LEU HD22 H 1 0.792 0.05 . 2 . . . . A 139 LEU HD22 . 30926 1 1674 . 1 . 1 139 139 LEU HD23 H 1 0.792 0.05 . 2 . . . . A 139 LEU HD23 . 30926 1 1675 . 1 . 1 139 139 LEU C C 13 176.112 0.50 . 1 . . . . A 139 LEU C . 30926 1 1676 . 1 . 1 139 139 LEU CA C 13 53.801 0.50 . 1 . . . . A 139 LEU CA . 30926 1 1677 . 1 . 1 139 139 LEU CB C 13 47.461 0.50 . 1 . . . . A 139 LEU CB . 30926 1 1678 . 1 . 1 139 139 LEU CG C 13 26.677 0.50 . 1 . . . . A 139 LEU CG . 30926 1 1679 . 1 . 1 139 139 LEU CD1 C 13 25.309 0.50 . 2 . . . . A 139 LEU CD1 . 30926 1 1680 . 1 . 1 139 139 LEU CD2 C 13 23.737 0.50 . 2 . . . . A 139 LEU CD2 . 30926 1 1681 . 1 . 1 139 139 LEU N N 15 127.109 0.10 . 1 . . . . A 139 LEU N . 30926 1 1682 . 1 . 1 140 140 VAL H H 1 9.401 0.05 . 1 . . . . A 140 VAL H . 30926 1 1683 . 1 . 1 140 140 VAL HA H 1 4.596 0.05 . 1 . . . . A 140 VAL HA . 30926 1 1684 . 1 . 1 140 140 VAL HB H 1 1.742 0.05 . 1 . . . . A 140 VAL HB . 30926 1 1685 . 1 . 1 140 140 VAL HG11 H 1 0.519 0.05 . 2 . . . . A 140 VAL HG11 . 30926 1 1686 . 1 . 1 140 140 VAL HG12 H 1 0.519 0.05 . 2 . . . . A 140 VAL HG12 . 30926 1 1687 . 1 . 1 140 140 VAL HG13 H 1 0.519 0.05 . 2 . . . . A 140 VAL HG13 . 30926 1 1688 . 1 . 1 140 140 VAL HG21 H 1 0.768 0.05 . 2 . . . . A 140 VAL HG21 . 30926 1 1689 . 1 . 1 140 140 VAL HG22 H 1 0.768 0.05 . 2 . . . . A 140 VAL HG22 . 30926 1 1690 . 1 . 1 140 140 VAL HG23 H 1 0.768 0.05 . 2 . . . . A 140 VAL HG23 . 30926 1 1691 . 1 . 1 140 140 VAL C C 13 174.580 0.50 . 1 . . . . A 140 VAL C . 30926 1 1692 . 1 . 1 140 140 VAL CA C 13 62.323 0.50 . 1 . . . . A 140 VAL CA . 30926 1 1693 . 1 . 1 140 140 VAL CB C 13 33.502 0.50 . 1 . . . . A 140 VAL CB . 30926 1 1694 . 1 . 1 140 140 VAL CG1 C 13 20.829 0.50 . 2 . . . . A 140 VAL CG1 . 30926 1 1695 . 1 . 1 140 140 VAL CG2 C 13 20.637 0.50 . 2 . . . . A 140 VAL CG2 . 30926 1 1696 . 1 . 1 140 140 VAL N N 15 123.135 0.10 . 1 . . . . A 140 VAL N . 30926 1 1697 . 1 . 1 141 141 LEU H H 1 8.741 0.05 . 1 . . . . A 141 LEU H . 30926 1 1698 . 1 . 1 141 141 LEU HA H 1 5.040 0.05 . 1 . . . . A 141 LEU HA . 30926 1 1699 . 1 . 1 141 141 LEU HB2 H 1 1.631 0.05 . 2 . . . . A 141 LEU HB2 . 30926 1 1700 . 1 . 1 141 141 LEU HB3 H 1 1.407 0.05 . 2 . . . . A 141 LEU HB3 . 30926 1 1701 . 1 . 1 141 141 LEU HG H 1 1.503 0.05 . 1 . . . . A 141 LEU HG . 30926 1 1702 . 1 . 1 141 141 LEU HD11 H 1 0.800 0.05 . 2 . . . . A 141 LEU HD11 . 30926 1 1703 . 1 . 1 141 141 LEU HD12 H 1 0.800 0.05 . 2 . . . . A 141 LEU HD12 . 30926 1 1704 . 1 . 1 141 141 LEU HD13 H 1 0.800 0.05 . 2 . . . . A 141 LEU HD13 . 30926 1 1705 . 1 . 1 141 141 LEU HD21 H 1 0.760 0.05 . 2 . . . . A 141 LEU HD21 . 30926 1 1706 . 1 . 1 141 141 LEU HD22 H 1 0.760 0.05 . 2 . . . . A 141 LEU HD22 . 30926 1 1707 . 1 . 1 141 141 LEU HD23 H 1 0.760 0.05 . 2 . . . . A 141 LEU HD23 . 30926 1 1708 . 1 . 1 141 141 LEU C C 13 177.099 0.50 . 1 . . . . A 141 LEU C . 30926 1 1709 . 1 . 1 141 141 LEU CA C 13 52.871 0.50 . 1 . . . . A 141 LEU CA . 30926 1 1710 . 1 . 1 141 141 LEU CB C 13 42.431 0.50 . 1 . . . . A 141 LEU CB . 30926 1 1711 . 1 . 1 141 141 LEU CG C 13 27.010 0.50 . 1 . . . . A 141 LEU CG . 30926 1 1712 . 1 . 1 141 141 LEU CD1 C 13 23.630 0.50 . 2 . . . . A 141 LEU CD1 . 30926 1 1713 . 1 . 1 141 141 LEU CD2 C 13 25.994 0.50 . 2 . . . . A 141 LEU CD2 . 30926 1 1714 . 1 . 1 141 141 LEU N N 15 127.110 0.10 . 1 . . . . A 141 LEU N . 30926 1 1715 . 1 . 1 142 142 LEU H H 1 9.122 0.05 . 1 . . . . A 142 LEU H . 30926 1 1716 . 1 . 1 142 142 LEU HA H 1 5.115 0.05 . 1 . . . . A 142 LEU HA . 30926 1 1717 . 1 . 1 142 142 LEU HB2 H 1 0.919 0.05 . 2 . . . . A 142 LEU HB2 . 30926 1 1718 . 1 . 1 142 142 LEU HB3 H 1 1.297 0.05 . 2 . . . . A 142 LEU HB3 . 30926 1 1719 . 1 . 1 142 142 LEU HG H 1 1.208 0.05 . 1 . . . . A 142 LEU HG . 30926 1 1720 . 1 . 1 142 142 LEU HD11 H 1 0.318 0.05 . 2 . . . . A 142 LEU HD11 . 30926 1 1721 . 1 . 1 142 142 LEU HD12 H 1 0.318 0.05 . 2 . . . . A 142 LEU HD12 . 30926 1 1722 . 1 . 1 142 142 LEU HD13 H 1 0.318 0.05 . 2 . . . . A 142 LEU HD13 . 30926 1 1723 . 1 . 1 142 142 LEU HD21 H 1 0.217 0.05 . 2 . . . . A 142 LEU HD21 . 30926 1 1724 . 1 . 1 142 142 LEU HD22 H 1 0.217 0.05 . 2 . . . . A 142 LEU HD22 . 30926 1 1725 . 1 . 1 142 142 LEU HD23 H 1 0.217 0.05 . 2 . . . . A 142 LEU HD23 . 30926 1 1726 . 1 . 1 142 142 LEU C C 13 174.512 0.50 . 1 . . . . A 142 LEU C . 30926 1 1727 . 1 . 1 142 142 LEU CA C 13 54.017 0.50 . 1 . . . . A 142 LEU CA . 30926 1 1728 . 1 . 1 142 142 LEU CB C 13 44.828 0.50 . 1 . . . . A 142 LEU CB . 30926 1 1729 . 1 . 1 142 142 LEU CG C 13 27.028 0.50 . 1 . . . . A 142 LEU CG . 30926 1 1730 . 1 . 1 142 142 LEU CD1 C 13 25.471 0.50 . 2 . . . . A 142 LEU CD1 . 30926 1 1731 . 1 . 1 142 142 LEU CD2 C 13 26.521 0.50 . 2 . . . . A 142 LEU CD2 . 30926 1 1732 . 1 . 1 142 142 LEU N N 15 122.514 0.10 . 1 . . . . A 142 LEU N . 30926 1 1733 . 1 . 1 143 143 GLU H H 1 8.557 0.05 . 1 . . . . A 143 GLU H . 30926 1 1734 . 1 . 1 143 143 GLU HA H 1 4.705 0.05 . 1 . . . . A 143 GLU HA . 30926 1 1735 . 1 . 1 143 143 GLU HB2 H 1 1.868 0.05 . 2 . . . . A 143 GLU HB2 . 30926 1 1736 . 1 . 1 143 143 GLU HB3 H 1 2.031 0.05 . 2 . . . . A 143 GLU HB3 . 30926 1 1737 . 1 . 1 143 143 GLU HG2 H 1 2.134 0.05 . 2 . . . . A 143 GLU HG2 . 30926 1 1738 . 1 . 1 143 143 GLU HG3 H 1 2.020 0.05 . 2 . . . . A 143 GLU HG3 . 30926 1 1739 . 1 . 1 143 143 GLU C C 13 173.538 0.50 . 1 . . . . A 143 GLU C . 30926 1 1740 . 1 . 1 143 143 GLU CA C 13 52.769 0.50 . 1 . . . . A 143 GLU CA . 30926 1 1741 . 1 . 1 143 143 GLU CB C 13 30.986 0.50 . 1 . . . . A 143 GLU CB . 30926 1 1742 . 1 . 1 143 143 GLU CG C 13 34.643 0.50 . 1 . . . . A 143 GLU CG . 30926 1 1743 . 1 . 1 143 143 GLU N N 15 120.388 0.10 . 1 . . . . A 143 GLU N . 30926 1 1744 . 1 . 1 144 144 PRO HA H 1 3.367 0.05 . 1 . . . . A 144 PRO HA . 30926 1 1745 . 1 . 1 144 144 PRO HB2 H 1 0.995 0.05 . 2 . . . . A 144 PRO HB2 . 30926 1 1746 . 1 . 1 144 144 PRO HB3 H 1 1.470 0.05 . 2 . . . . A 144 PRO HB3 . 30926 1 1747 . 1 . 1 144 144 PRO HG2 H 1 0.900 0.05 . 2 . . . . A 144 PRO HG2 . 30926 1 1748 . 1 . 1 144 144 PRO HG3 H 1 1.648 0.05 . 2 . . . . A 144 PRO HG3 . 30926 1 1749 . 1 . 1 144 144 PRO HD2 H 1 3.015 0.05 . 2 . . . . A 144 PRO HD2 . 30926 1 1750 . 1 . 1 144 144 PRO HD3 H 1 3.440 0.05 . 2 . . . . A 144 PRO HD3 . 30926 1 1751 . 1 . 1 144 144 PRO C C 13 176.123 0.50 . 1 . . . . A 144 PRO C . 30926 1 1752 . 1 . 1 144 144 PRO CA C 13 63.777 0.50 . 1 . . . . A 144 PRO CA . 30926 1 1753 . 1 . 1 144 144 PRO CB C 13 31.717 0.50 . 1 . . . . A 144 PRO CB . 30926 1 1754 . 1 . 1 144 144 PRO CG C 13 27.206 0.50 . 1 . . . . A 144 PRO CG . 30926 1 1755 . 1 . 1 144 144 PRO CD C 13 50.192 0.50 . 1 . . . . A 144 PRO CD . 30926 1 1756 . 1 . 1 145 145 GLY H H 1 7.382 0.05 . 1 . . . . A 145 GLY H . 30926 1 1757 . 1 . 1 145 145 GLY HA2 H 1 3.665 0.05 . 2 . . . . A 145 GLY HA2 . 30926 1 1758 . 1 . 1 145 145 GLY HA3 H 1 4.203 0.05 . 2 . . . . A 145 GLY HA3 . 30926 1 1759 . 1 . 1 145 145 GLY C C 13 174.717 0.50 . 1 . . . . A 145 GLY C . 30926 1 1760 . 1 . 1 145 145 GLY CA C 13 44.203 0.50 . 1 . . . . A 145 GLY CA . 30926 1 1761 . 1 . 1 145 145 GLY N N 15 110.755 0.10 . 1 . . . . A 145 GLY N . 30926 1 1762 . 1 . 1 146 146 GLU H H 1 8.614 0.05 . 1 . . . . A 146 GLU H . 30926 1 1763 . 1 . 1 146 146 GLU HA H 1 3.946 0.05 . 1 . . . . A 146 GLU HA . 30926 1 1764 . 1 . 1 146 146 GLU HB2 H 1 1.932 0.05 . 2 . . . . A 146 GLU HB2 . 30926 1 1765 . 1 . 1 146 146 GLU HB3 H 1 1.932 0.05 . 2 . . . . A 146 GLU HB3 . 30926 1 1766 . 1 . 1 146 146 GLU HG2 H 1 2.204 0.05 . 2 . . . . A 146 GLU HG2 . 30926 1 1767 . 1 . 1 146 146 GLU HG3 H 1 2.204 0.05 . 2 . . . . A 146 GLU HG3 . 30926 1 1768 . 1 . 1 146 146 GLU C C 13 177.259 0.50 . 1 . . . . A 146 GLU C . 30926 1 1769 . 1 . 1 146 146 GLU CA C 13 58.530 0.50 . 1 . . . . A 146 GLU CA . 30926 1 1770 . 1 . 1 146 146 GLU CB C 13 29.472 0.50 . 1 . . . . A 146 GLU CB . 30926 1 1771 . 1 . 1 146 146 GLU CG C 13 36.006 0.50 . 1 . . . . A 146 GLU CG . 30926 1 1772 . 1 . 1 146 146 GLU N N 15 120.634 0.10 . 1 . . . . A 146 GLU N . 30926 1 1773 . 1 . 1 147 147 ALA H H 1 8.472 0.05 . 1 . . . . A 147 ALA H . 30926 1 1774 . 1 . 1 147 147 ALA HA H 1 4.225 0.05 . 1 . . . . A 147 ALA HA . 30926 1 1775 . 1 . 1 147 147 ALA HB1 H 1 1.193 0.05 . 1 . . . . A 147 ALA HB1 . 30926 1 1776 . 1 . 1 147 147 ALA HB2 H 1 1.193 0.05 . 1 . . . . A 147 ALA HB2 . 30926 1 1777 . 1 . 1 147 147 ALA HB3 H 1 1.193 0.05 . 1 . . . . A 147 ALA HB3 . 30926 1 1778 . 1 . 1 147 147 ALA C C 13 177.643 0.50 . 1 . . . . A 147 ALA C . 30926 1 1779 . 1 . 1 147 147 ALA CA C 13 52.334 0.50 . 1 . . . . A 147 ALA CA . 30926 1 1780 . 1 . 1 147 147 ALA CB C 13 18.428 0.50 . 1 . . . . A 147 ALA CB . 30926 1 1781 . 1 . 1 147 147 ALA N N 15 120.723 0.10 . 1 . . . . A 147 ALA N . 30926 1 1782 . 1 . 1 148 148 PHE H H 1 7.513 0.05 . 1 . . . . A 148 PHE H . 30926 1 1783 . 1 . 1 148 148 PHE HA H 1 4.252 0.05 . 1 . . . . A 148 PHE HA . 30926 1 1784 . 1 . 1 148 148 PHE HB2 H 1 2.915 0.05 . 2 . . . . A 148 PHE HB2 . 30926 1 1785 . 1 . 1 148 148 PHE HB3 H 1 2.962 0.05 . 2 . . . . A 148 PHE HB3 . 30926 1 1786 . 1 . 1 148 148 PHE HD1 H 1 6.886 0.05 . 3 . . . . A 148 PHE HD1 . 30926 1 1787 . 1 . 1 148 148 PHE HD2 H 1 6.886 0.05 . 3 . . . . A 148 PHE HD2 . 30926 1 1788 . 1 . 1 148 148 PHE HE1 H 1 6.693 0.05 . 3 . . . . A 148 PHE HE1 . 30926 1 1789 . 1 . 1 148 148 PHE HE2 H 1 6.693 0.05 . 3 . . . . A 148 PHE HE2 . 30926 1 1790 . 1 . 1 148 148 PHE C C 13 175.663 0.50 . 1 . . . . A 148 PHE C . 30926 1 1791 . 1 . 1 148 148 PHE CA C 13 58.517 0.50 . 1 . . . . A 148 PHE CA . 30926 1 1792 . 1 . 1 148 148 PHE CB C 13 39.205 0.50 . 1 . . . . A 148 PHE CB . 30926 1 1793 . 1 . 1 148 148 PHE CD1 C 13 131.511 0.50 . 3 . . . . A 148 PHE CD1 . 30926 1 1794 . 1 . 1 148 148 PHE CE1 C 13 131.169 0.50 . 3 . . . . A 148 PHE CE1 . 30926 1 1795 . 1 . 1 148 148 PHE N N 15 118.823 0.10 . 1 . . . . A 148 PHE N . 30926 1 1796 . 1 . 1 149 149 GLN H H 1 7.955 0.05 . 1 . . . . A 149 GLN H . 30926 1 1797 . 1 . 1 149 149 GLN HA H 1 4.173 0.05 . 1 . . . . A 149 GLN HA . 30926 1 1798 . 1 . 1 149 149 GLN HB2 H 1 1.819 0.05 . 2 . . . . A 149 GLN HB2 . 30926 1 1799 . 1 . 1 149 149 GLN HB3 H 1 1.965 0.05 . 2 . . . . A 149 GLN HB3 . 30926 1 1800 . 1 . 1 149 149 GLN HG2 H 1 2.176 0.05 . 2 . . . . A 149 GLN HG2 . 30926 1 1801 . 1 . 1 149 149 GLN HG3 H 1 2.176 0.05 . 2 . . . . A 149 GLN HG3 . 30926 1 1802 . 1 . 1 149 149 GLN HE21 H 1 6.769 0.05 . 2 . . . . A 149 GLN HE21 . 30926 1 1803 . 1 . 1 149 149 GLN HE22 H 1 7.390 0.05 . 2 . . . . A 149 GLN HE22 . 30926 1 1804 . 1 . 1 149 149 GLN C C 13 175.168 0.50 . 1 . . . . A 149 GLN C . 30926 1 1805 . 1 . 1 149 149 GLN CA C 13 55.592 0.50 . 1 . . . . A 149 GLN CA . 30926 1 1806 . 1 . 1 149 149 GLN CB C 13 29.315 0.50 . 1 . . . . A 149 GLN CB . 30926 1 1807 . 1 . 1 149 149 GLN CG C 13 33.577 0.50 . 1 . . . . A 149 GLN CG . 30926 1 1808 . 1 . 1 149 149 GLN N N 15 122.244 0.10 . 1 . . . . A 149 GLN N . 30926 1 1809 . 1 . 1 149 149 GLN NE2 N 15 112.463 0.10 . 1 . . . . A 149 GLN NE2 . 30926 1 1810 . 1 . 1 150 150 LYS H H 1 8.114 0.05 . 1 . . . . A 150 LYS H . 30926 1 1811 . 1 . 1 150 150 LYS HA H 1 4.198 0.05 . 1 . . . . A 150 LYS HA . 30926 1 1812 . 1 . 1 150 150 LYS HB2 H 1 1.691 0.05 . 2 . . . . A 150 LYS HB2 . 30926 1 1813 . 1 . 1 150 150 LYS HB3 H 1 1.824 0.05 . 2 . . . . A 150 LYS HB3 . 30926 1 1814 . 1 . 1 150 150 LYS HG2 H 1 1.408 0.05 . 2 . . . . A 150 LYS HG2 . 30926 1 1815 . 1 . 1 150 150 LYS HG3 H 1 1.408 0.05 . 2 . . . . A 150 LYS HG3 . 30926 1 1816 . 1 . 1 150 150 LYS HE2 H 1 2.942 0.05 . 2 . . . . A 150 LYS HE2 . 30926 1 1817 . 1 . 1 150 150 LYS HE3 H 1 2.942 0.05 . 2 . . . . A 150 LYS HE3 . 30926 1 1818 . 1 . 1 150 150 LYS C C 13 176.065 0.50 . 1 . . . . A 150 LYS C . 30926 1 1819 . 1 . 1 150 150 LYS CA C 13 56.156 0.50 . 1 . . . . A 150 LYS CA . 30926 1 1820 . 1 . 1 150 150 LYS CB C 13 33.156 0.50 . 1 . . . . A 150 LYS CB . 30926 1 1821 . 1 . 1 150 150 LYS CG C 13 24.578 0.50 . 1 . . . . A 150 LYS CG . 30926 1 1822 . 1 . 1 150 150 LYS CD C 13 29.203 0.50 . 1 . . . . A 150 LYS CD . 30926 1 1823 . 1 . 1 150 150 LYS CE C 13 41.989 0.50 . 1 . . . . A 150 LYS CE . 30926 1 1824 . 1 . 1 150 150 LYS N N 15 122.216 0.10 . 1 . . . . A 150 LYS N . 30926 1 1825 . 1 . 1 151 151 GLY H H 1 7.998 0.05 . 1 . . . . A 151 GLY H . 30926 1 1826 . 1 . 1 151 151 GLY HA2 H 1 3.680 0.05 . 2 . . . . A 151 GLY HA2 . 30926 1 1827 . 1 . 1 151 151 GLY HA3 H 1 3.663 0.05 . 2 . . . . A 151 GLY HA3 . 30926 1 1828 . 1 . 1 151 151 GLY C C 13 178.870 0.50 . 1 . . . . A 151 GLY C . 30926 1 1829 . 1 . 1 151 151 GLY CA C 13 46.111 0.50 . 1 . . . . A 151 GLY CA . 30926 1 1830 . 1 . 1 151 151 GLY N N 15 115.995 0.10 . 1 . . . . A 151 GLY N . 30926 1 stop_ save_