data_26613 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 26613 _Entry.Title ; Periplasmic chaperone Skp from E. coli in 8 m Urea ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2015-07-15 _Entry.Accession_date 2015-07-15 _Entry.Last_release_date 2015-07-15 _Entry.Original_release_date 2015-07-15 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.6.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 Bjoern Burmann . M. . . 26613 2 Sebastian Hiller . . . . 26613 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 26613 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 417 26613 '15N chemical shifts' 141 26613 '1H chemical shifts' 141 26613 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 . . 2020-12-17 2015-07-15 update BMRB 'update entry citation' 26613 1 . . 2020-08-30 2015-07-15 original author 'original release' 26613 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 26612 tOmpA 26613 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 26613 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 33087350 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; Regulation of chaperone function by coupled folding and oligomerization ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Sci. Adv.' _Citation.Journal_name_full 'Science advances' _Citation.Journal_volume 6 _Citation.Journal_issue 43 _Citation.Journal_ASTM . _Citation.Journal_ISSN 2375-2548 _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first eabc5822 _Citation.Page_last eabc5822 _Citation.Year 2020 _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 Guillaume Mas G. . . . 26613 1 2 Bjorn Burmann B. M. . . 26613 1 3 Timothy Sharpe T. . . . 26613 1 4 Beatrice Claudi B. . . . 26613 1 5 Dirk Bumann D. . . . 26613 1 6 Sebastian Hiller S. . . . 26613 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 26613 _Assembly.ID 1 _Assembly.Name Skp _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass 18000 _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 Skp 1 $Skp A . yes denatured no no . . . 26613 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_Skp _Entity.Sf_category entity _Entity.Sf_framecode Skp _Entity.Entry_ID 26613 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name Skp _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MGSSHHHHHHSSGLVPRGSH MADKIAIVNMGSLFQQVAQK TGVSNTLENEFKGRASELQR METDLQAKMKKLQSMKAGSD RTKLEKDVMAQRQTFAQKAQ AFEQDRARRSNEERGKLVTR IQTAVKSVANSQDIDLVVDA NAVAYNSSDVKDITADVLKQ VK ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details 'His-tag including thrombin-cleavage site (residues -20 - 0) followed by mature Skp (residues 1 - 141)' _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 162 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 -20 MET . 26613 1 2 -19 GLY . 26613 1 3 -18 SER . 26613 1 4 -17 SER . 26613 1 5 -16 HIS . 26613 1 6 -15 HIS . 26613 1 7 -14 HIS . 26613 1 8 -13 HIS . 26613 1 9 -12 HIS . 26613 1 10 -11 HIS . 26613 1 11 -10 SER . 26613 1 12 -9 SER . 26613 1 13 -8 GLY . 26613 1 14 -7 LEU . 26613 1 15 -6 VAL . 26613 1 16 -5 PRO . 26613 1 17 -4 ARG . 26613 1 18 -3 GLY . 26613 1 19 -2 SER . 26613 1 20 -1 HIS . 26613 1 21 0 MET . 26613 1 22 1 ALA . 26613 1 23 2 ASP . 26613 1 24 3 LYS . 26613 1 25 4 ILE . 26613 1 26 5 ALA . 26613 1 27 6 ILE . 26613 1 28 7 VAL . 26613 1 29 8 ASN . 26613 1 30 9 MET . 26613 1 31 10 GLY . 26613 1 32 11 SER . 26613 1 33 12 LEU . 26613 1 34 13 PHE . 26613 1 35 14 GLN . 26613 1 36 15 GLN . 26613 1 37 16 VAL . 26613 1 38 17 ALA . 26613 1 39 18 GLN . 26613 1 40 19 LYS . 26613 1 41 20 THR . 26613 1 42 21 GLY . 26613 1 43 22 VAL . 26613 1 44 23 SER . 26613 1 45 24 ASN . 26613 1 46 25 THR . 26613 1 47 26 LEU . 26613 1 48 27 GLU . 26613 1 49 28 ASN . 26613 1 50 29 GLU . 26613 1 51 30 PHE . 26613 1 52 31 LYS . 26613 1 53 32 GLY . 26613 1 54 33 ARG . 26613 1 55 34 ALA . 26613 1 56 35 SER . 26613 1 57 36 GLU . 26613 1 58 37 LEU . 26613 1 59 38 GLN . 26613 1 60 39 ARG . 26613 1 61 40 MET . 26613 1 62 41 GLU . 26613 1 63 42 THR . 26613 1 64 43 ASP . 26613 1 65 44 LEU . 26613 1 66 45 GLN . 26613 1 67 46 ALA . 26613 1 68 47 LYS . 26613 1 69 48 MET . 26613 1 70 49 LYS . 26613 1 71 50 LYS . 26613 1 72 51 LEU . 26613 1 73 52 GLN . 26613 1 74 53 SER . 26613 1 75 54 MET . 26613 1 76 55 LYS . 26613 1 77 56 ALA . 26613 1 78 57 GLY . 26613 1 79 58 SER . 26613 1 80 59 ASP . 26613 1 81 60 ARG . 26613 1 82 61 THR . 26613 1 83 62 LYS . 26613 1 84 63 LEU . 26613 1 85 64 GLU . 26613 1 86 65 LYS . 26613 1 87 66 ASP . 26613 1 88 67 VAL . 26613 1 89 68 MET . 26613 1 90 69 ALA . 26613 1 91 70 GLN . 26613 1 92 71 ARG . 26613 1 93 72 GLN . 26613 1 94 73 THR . 26613 1 95 74 PHE . 26613 1 96 75 ALA . 26613 1 97 76 GLN . 26613 1 98 77 LYS . 26613 1 99 78 ALA . 26613 1 100 79 GLN . 26613 1 101 80 ALA . 26613 1 102 81 PHE . 26613 1 103 82 GLU . 26613 1 104 83 GLN . 26613 1 105 84 ASP . 26613 1 106 85 ARG . 26613 1 107 86 ALA . 26613 1 108 87 ARG . 26613 1 109 88 ARG . 26613 1 110 89 SER . 26613 1 111 90 ASN . 26613 1 112 91 GLU . 26613 1 113 92 GLU . 26613 1 114 93 ARG . 26613 1 115 94 GLY . 26613 1 116 95 LYS . 26613 1 117 96 LEU . 26613 1 118 97 VAL . 26613 1 119 98 THR . 26613 1 120 99 ARG . 26613 1 121 100 ILE . 26613 1 122 101 GLN . 26613 1 123 102 THR . 26613 1 124 103 ALA . 26613 1 125 104 VAL . 26613 1 126 105 LYS . 26613 1 127 106 SER . 26613 1 128 107 VAL . 26613 1 129 108 ALA . 26613 1 130 109 ASN . 26613 1 131 110 SER . 26613 1 132 111 GLN . 26613 1 133 112 ASP . 26613 1 134 113 ILE . 26613 1 135 114 ASP . 26613 1 136 115 LEU . 26613 1 137 116 VAL . 26613 1 138 117 VAL . 26613 1 139 118 ASP . 26613 1 140 119 ALA . 26613 1 141 120 ASN . 26613 1 142 121 ALA . 26613 1 143 122 VAL . 26613 1 144 123 ALA . 26613 1 145 124 TYR . 26613 1 146 125 ASN . 26613 1 147 126 SER . 26613 1 148 127 SER . 26613 1 149 128 ASP . 26613 1 150 129 VAL . 26613 1 151 130 LYS . 26613 1 152 131 ASP . 26613 1 153 132 ILE . 26613 1 154 133 THR . 26613 1 155 134 ALA . 26613 1 156 135 ASP . 26613 1 157 136 VAL . 26613 1 158 137 LEU . 26613 1 159 138 LYS . 26613 1 160 139 GLN . 26613 1 161 140 VAL . 26613 1 162 141 LYS . 26613 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 26613 1 . GLY 2 2 26613 1 . SER 3 3 26613 1 . SER 4 4 26613 1 . HIS 5 5 26613 1 . HIS 6 6 26613 1 . HIS 7 7 26613 1 . HIS 8 8 26613 1 . HIS 9 9 26613 1 . HIS 10 10 26613 1 . SER 11 11 26613 1 . SER 12 12 26613 1 . GLY 13 13 26613 1 . LEU 14 14 26613 1 . VAL 15 15 26613 1 . PRO 16 16 26613 1 . ARG 17 17 26613 1 . GLY 18 18 26613 1 . SER 19 19 26613 1 . HIS 20 20 26613 1 . MET 21 21 26613 1 . ALA 22 22 26613 1 . ASP 23 23 26613 1 . LYS 24 24 26613 1 . ILE 25 25 26613 1 . ALA 26 26 26613 1 . ILE 27 27 26613 1 . VAL 28 28 26613 1 . ASN 29 29 26613 1 . MET 30 30 26613 1 . GLY 31 31 26613 1 . SER 32 32 26613 1 . LEU 33 33 26613 1 . PHE 34 34 26613 1 . GLN 35 35 26613 1 . GLN 36 36 26613 1 . VAL 37 37 26613 1 . ALA 38 38 26613 1 . GLN 39 39 26613 1 . LYS 40 40 26613 1 . THR 41 41 26613 1 . GLY 42 42 26613 1 . VAL 43 43 26613 1 . SER 44 44 26613 1 . ASN 45 45 26613 1 . THR 46 46 26613 1 . LEU 47 47 26613 1 . GLU 48 48 26613 1 . ASN 49 49 26613 1 . GLU 50 50 26613 1 . PHE 51 51 26613 1 . LYS 52 52 26613 1 . GLY 53 53 26613 1 . ARG 54 54 26613 1 . ALA 55 55 26613 1 . SER 56 56 26613 1 . GLU 57 57 26613 1 . LEU 58 58 26613 1 . GLN 59 59 26613 1 . ARG 60 60 26613 1 . MET 61 61 26613 1 . GLU 62 62 26613 1 . THR 63 63 26613 1 . ASP 64 64 26613 1 . LEU 65 65 26613 1 . GLN 66 66 26613 1 . ALA 67 67 26613 1 . LYS 68 68 26613 1 . MET 69 69 26613 1 . LYS 70 70 26613 1 . LYS 71 71 26613 1 . LEU 72 72 26613 1 . GLN 73 73 26613 1 . SER 74 74 26613 1 . MET 75 75 26613 1 . LYS 76 76 26613 1 . ALA 77 77 26613 1 . GLY 78 78 26613 1 . SER 79 79 26613 1 . ASP 80 80 26613 1 . ARG 81 81 26613 1 . THR 82 82 26613 1 . LYS 83 83 26613 1 . LEU 84 84 26613 1 . GLU 85 85 26613 1 . LYS 86 86 26613 1 . ASP 87 87 26613 1 . VAL 88 88 26613 1 . MET 89 89 26613 1 . ALA 90 90 26613 1 . GLN 91 91 26613 1 . ARG 92 92 26613 1 . GLN 93 93 26613 1 . THR 94 94 26613 1 . PHE 95 95 26613 1 . ALA 96 96 26613 1 . GLN 97 97 26613 1 . LYS 98 98 26613 1 . ALA 99 99 26613 1 . GLN 100 100 26613 1 . ALA 101 101 26613 1 . PHE 102 102 26613 1 . GLU 103 103 26613 1 . GLN 104 104 26613 1 . ASP 105 105 26613 1 . ARG 106 106 26613 1 . ALA 107 107 26613 1 . ARG 108 108 26613 1 . ARG 109 109 26613 1 . SER 110 110 26613 1 . ASN 111 111 26613 1 . GLU 112 112 26613 1 . GLU 113 113 26613 1 . ARG 114 114 26613 1 . GLY 115 115 26613 1 . LYS 116 116 26613 1 . LEU 117 117 26613 1 . VAL 118 118 26613 1 . THR 119 119 26613 1 . ARG 120 120 26613 1 . ILE 121 121 26613 1 . GLN 122 122 26613 1 . THR 123 123 26613 1 . ALA 124 124 26613 1 . VAL 125 125 26613 1 . LYS 126 126 26613 1 . SER 127 127 26613 1 . VAL 128 128 26613 1 . ALA 129 129 26613 1 . ASN 130 130 26613 1 . SER 131 131 26613 1 . GLN 132 132 26613 1 . ASP 133 133 26613 1 . ILE 134 134 26613 1 . ASP 135 135 26613 1 . LEU 136 136 26613 1 . VAL 137 137 26613 1 . VAL 138 138 26613 1 . ASP 139 139 26613 1 . ALA 140 140 26613 1 . ASN 141 141 26613 1 . ALA 142 142 26613 1 . VAL 143 143 26613 1 . ALA 144 144 26613 1 . TYR 145 145 26613 1 . ASN 146 146 26613 1 . SER 147 147 26613 1 . SER 148 148 26613 1 . ASP 149 149 26613 1 . VAL 150 150 26613 1 . LYS 151 151 26613 1 . ASP 152 152 26613 1 . ILE 153 153 26613 1 . THR 154 154 26613 1 . ALA 155 155 26613 1 . ASP 156 156 26613 1 . VAL 157 157 26613 1 . LEU 158 158 26613 1 . LYS 159 159 26613 1 . GLN 160 160 26613 1 . VAL 161 161 26613 1 . LYS 162 162 26613 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 26613 _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 $Skp . 562 organism . 'Escherichia coli' 'E. coli' . . Bacteria . Escherichia coli . . . . . . . . . . . . . 26613 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 26613 _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 $Skp . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . pET28b . . . 26613 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 26613 _Sample.ID 1 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 Skp '[U-13C; U-15N; U-2H]' . . 1 $Skp . . 0.6 . . mM . . . . 26613 1 2 D2O 'natural abundance' . . . . . . 10 . . % . . . . 26613 1 3 DSS 'natural abundance' . . . . . . 50 . . uM . . . . 26613 1 4 MES 'natural abundance' . . . . . . 25 . . mM . . . . 26613 1 5 NaCl 'natural abundance' . . . . . . 150 . . mM . . . . 26613 1 6 urea 'natural abundance' . . . . . . 8 . . M . . . . 26613 1 7 H2O 'natural abundance' . . . . . . 90 . . % . . . . 26613 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 26613 _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 26613 1 pH 6.5 . pH 26613 1 pressure 1 . atm 26613 1 temperature 288.15 . K 26613 1 stop_ save_ ############################ # Computer software used # ############################ save_TOPSPIN _Software.Sf_category software _Software.Sf_framecode TOPSPIN _Software.Entry_ID 26613 _Software.ID 1 _Software.Type . _Software.Name TOPSPIN _Software.Version 3.0 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 26613 1 Guntert . . 26613 1 'Herrmann and Wuthrich' . . 26613 1 'Keller and Wuthrich' . . 26613 1 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . 'chemical shift assignment' 26613 1 . collection 26613 1 . processing 26613 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 26613 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Ascend _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 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 26613 _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 spectrometer_1 Bruker Ascend . 700 . . . 26613 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 26613 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26613 1 2 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26613 1 3 '5D APSY HNCOCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26613 1 4 '4D APSY HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26613 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 26613 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name . _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . 26613 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . 26613 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . 26613 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_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 26613 _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 $chemical_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' . . . 26613 1 2 '3D HNCACB' . . . 26613 1 3 '5D APSY HNCOCACB' . . . 26613 1 4 '4D APSY HNCACB' . . . 26613 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 22 22 ALA H H 1 8.39 0.02 . 1 . . . . . 1 ALA H . 26613 1 2 . 1 . 1 22 22 ALA C C 13 177.4 0.3 . 1 . . . . . 1 ALA C . 26613 1 3 . 1 . 1 22 22 ALA CA C 13 51.8 0.3 . 1 . . . . . 1 ALA CA . 26613 1 4 . 1 . 1 22 22 ALA CB C 13 18.2 0.3 . 1 . . . . . 1 ALA CB . 26613 1 5 . 1 . 1 22 22 ALA N N 15 124.7 0.3 . 1 . . . . . 1 ALA N . 26613 1 6 . 1 . 1 23 23 ASP H H 1 8.29 0.02 . 1 . . . . . 2 ASP H . 26613 1 7 . 1 . 1 23 23 ASP C C 13 176.2 0.3 . 1 . . . . . 2 ASP C . 26613 1 8 . 1 . 1 23 23 ASP CA C 13 54.0 0.3 . 1 . . . . . 2 ASP CA . 26613 1 9 . 1 . 1 23 23 ASP CB C 13 40.5 0.3 . 1 . . . . . 2 ASP CB . 26613 1 10 . 1 . 1 23 23 ASP N N 15 119.6 0.3 . 1 . . . . . 2 ASP N . 26613 1 11 . 1 . 1 24 24 LYS H H 1 8.26 0.02 . 1 . . . . . 3 LYS H . 26613 1 12 . 1 . 1 24 24 LYS C C 13 176.4 0.3 . 1 . . . . . 3 LYS C . 26613 1 13 . 1 . 1 24 24 LYS CA C 13 55.9 0.3 . 1 . . . . . 3 LYS CA . 26613 1 14 . 1 . 1 24 24 LYS CB C 13 32.0 0.3 . 1 . . . . . 3 LYS CB . 26613 1 15 . 1 . 1 24 24 LYS N N 15 121.1 0.3 . 1 . . . . . 3 LYS N . 26613 1 16 . 1 . 1 25 25 ILE H H 1 8.21 0.02 . 1 . . . . . 4 ILE H . 26613 1 17 . 1 . 1 25 25 ILE C C 13 175.8 0.3 . 1 . . . . . 4 ILE C . 26613 1 18 . 1 . 1 25 25 ILE CA C 13 60.2 0.3 . 1 . . . . . 4 ILE CA . 26613 1 19 . 1 . 1 25 25 ILE CB C 13 37.6 0.3 . 1 . . . . . 4 ILE CB . 26613 1 20 . 1 . 1 25 25 ILE N N 15 122.2 0.3 . 1 . . . . . 4 ILE N . 26613 1 21 . 1 . 1 26 26 ALA H H 1 8.38 0.02 . 1 . . . . . 5 ALA H . 26613 1 22 . 1 . 1 26 26 ALA C C 13 177.3 0.3 . 1 . . . . . 5 ALA C . 26613 1 23 . 1 . 1 26 26 ALA CA C 13 51.6 0.3 . 1 . . . . . 5 ALA CA . 26613 1 24 . 1 . 1 26 26 ALA CB C 13 18.2 0.3 . 1 . . . . . 5 ALA CB . 26613 1 25 . 1 . 1 26 26 ALA N N 15 128.2 0.3 . 1 . . . . . 5 ALA N . 26613 1 26 . 1 . 1 27 27 ILE H H 1 8.20 0.02 . 1 . . . . . 6 ILE H . 26613 1 27 . 1 . 1 27 27 ILE C C 13 176.3 0.3 . 1 . . . . . 6 ILE C . 26613 1 28 . 1 . 1 27 27 ILE CA C 13 60.4 0.3 . 1 . . . . . 6 ILE CA . 26613 1 29 . 1 . 1 27 27 ILE CB C 13 37.4 0.3 . 1 . . . . . 6 ILE CB . 26613 1 30 . 1 . 1 27 27 ILE N N 15 121.4 0.3 . 1 . . . . . 6 ILE N . 26613 1 31 . 1 . 1 28 28 VAL H H 1 8.26 0.02 . 1 . . . . . 7 VAL H . 26613 1 32 . 1 . 1 28 28 VAL C C 13 175.6 0.3 . 1 . . . . . 7 VAL C . 26613 1 33 . 1 . 1 28 28 VAL CA C 13 61.5 0.3 . 1 . . . . . 7 VAL CA . 26613 1 34 . 1 . 1 28 28 VAL CB C 13 31.9 0.3 . 1 . . . . . 7 VAL CB . 26613 1 35 . 1 . 1 28 28 VAL N N 15 124.4 0.3 . 1 . . . . . 7 VAL N . 26613 1 36 . 1 . 1 29 29 ASN H H 1 8.58 0.02 . 1 . . . . . 8 ASN H . 26613 1 37 . 1 . 1 29 29 ASN C C 13 175.3 0.3 . 1 . . . . . 8 ASN C . 26613 1 38 . 1 . 1 29 29 ASN CA C 13 52.6 0.3 . 1 . . . . . 8 ASN CA . 26613 1 39 . 1 . 1 29 29 ASN CB C 13 38.1 0.3 . 1 . . . . . 8 ASN CB . 26613 1 40 . 1 . 1 29 29 ASN N N 15 122.7 0.3 . 1 . . . . . 8 ASN N . 26613 1 41 . 1 . 1 30 30 MET H H 1 8.56 0.02 . 1 . . . . . 9 MET H . 26613 1 42 . 1 . 1 30 30 MET C C 13 176.7 0.3 . 1 . . . . . 9 MET C . 26613 1 43 . 1 . 1 30 30 MET CA C 13 55.0 0.3 . 1 . . . . . 9 MET CA . 26613 1 44 . 1 . 1 30 30 MET CB C 13 31.5 0.3 . 1 . . . . . 9 MET CB . 26613 1 45 . 1 . 1 30 30 MET N N 15 122.1 0.3 . 1 . . . . . 9 MET N . 26613 1 46 . 1 . 1 31 31 GLY H H 1 8.40 0.02 . 1 . . . . . 10 GLY H . 26613 1 47 . 1 . 1 31 31 GLY C C 13 173.9 0.3 . 1 . . . . . 10 GLY C . 26613 1 48 . 1 . 1 31 31 GLY CA C 13 44.7 0.3 . 1 . . . . . 10 GLY CA . 26613 1 49 . 1 . 1 31 31 GLY N N 15 109.1 0.3 . 1 . . . . . 10 GLY N . 26613 1 50 . 1 . 1 32 32 SER H H 1 8.22 0.02 . 1 . . . . . 11 SER H . 26613 1 51 . 1 . 1 32 32 SER C C 13 174.7 0.3 . 1 . . . . . 11 SER C . 26613 1 52 . 1 . 1 32 32 SER CA C 13 57.9 0.3 . 1 . . . . . 11 SER CA . 26613 1 53 . 1 . 1 32 32 SER CB C 13 63.2 0.3 . 1 . . . . . 11 SER CB . 26613 1 54 . 1 . 1 32 32 SER N N 15 115.4 0.3 . 1 . . . . . 11 SER N . 26613 1 55 . 1 . 1 33 33 LEU H H 1 8.26 0.02 . 1 . . . . . 12 LEU H . 26613 1 56 . 1 . 1 33 33 LEU C C 13 177.1 0.3 . 1 . . . . . 12 LEU C . 26613 1 57 . 1 . 1 33 33 LEU CA C 13 54.8 0.3 . 1 . . . . . 12 LEU CA . 26613 1 58 . 1 . 1 33 33 LEU CB C 13 41.1 0.3 . 1 . . . . . 12 LEU CB . 26613 1 59 . 1 . 1 33 33 LEU N N 15 123.7 0.3 . 1 . . . . . 12 LEU N . 26613 1 60 . 1 . 1 34 34 PHE H H 1 8.21 0.02 . 1 . . . . . 13 PHE H . 26613 1 61 . 1 . 1 34 34 PHE C C 13 175.6 0.3 . 1 . . . . . 13 PHE C . 26613 1 62 . 1 . 1 34 34 PHE CA C 13 57.3 0.3 . 1 . . . . . 13 PHE CA . 26613 1 63 . 1 . 1 34 34 PHE CB C 13 38.6 0.3 . 1 . . . . . 13 PHE CB . 26613 1 64 . 1 . 1 34 34 PHE N N 15 120.1 0.3 . 1 . . . . . 13 PHE N . 26613 1 65 . 1 . 1 35 35 GLN H H 1 8.26 0.02 . 1 . . . . . 14 GLN H . 26613 1 66 . 1 . 1 35 35 GLN C C 13 175.5 0.3 . 1 . . . . . 14 GLN C . 26613 1 67 . 1 . 1 35 35 GLN CA C 13 55.0 0.3 . 1 . . . . . 14 GLN CA . 26613 1 68 . 1 . 1 35 35 GLN CB C 13 28.8 0.3 . 1 . . . . . 14 GLN CB . 26613 1 69 . 1 . 1 35 35 GLN N N 15 121.9 0.3 . 1 . . . . . 14 GLN N . 26613 1 70 . 1 . 1 36 36 GLN H H 1 8.41 0.02 . 1 . . . . . 15 GLN H . 26613 1 71 . 1 . 1 36 36 GLN C C 13 175.5 0.3 . 1 . . . . . 15 GLN C . 26613 1 72 . 1 . 1 36 36 GLN CA C 13 56.0 0.3 . 1 . . . . . 15 GLN CA . 26613 1 73 . 1 . 1 36 36 GLN CB C 13 29.5 0.3 . 1 . . . . . 15 GLN CB . 26613 1 74 . 1 . 1 36 36 GLN N N 15 122.0 0.3 . 1 . . . . . 15 GLN N . 26613 1 75 . 1 . 1 37 37 VAL H H 1 8.27 0.02 . 1 . . . . . 16 VAL H . 26613 1 76 . 1 . 1 37 37 VAL C C 13 175.8 0.3 . 1 . . . . . 16 VAL C . 26613 1 77 . 1 . 1 37 37 VAL CA C 13 61.5 0.3 . 1 . . . . . 16 VAL CA . 26613 1 78 . 1 . 1 37 37 VAL CB C 13 31.9 0.3 . 1 . . . . . 16 VAL CB . 26613 1 79 . 1 . 1 37 37 VAL N N 15 121.5 0.3 . 1 . . . . . 16 VAL N . 26613 1 80 . 1 . 1 38 38 ALA H H 1 8.40 0.02 . 1 . . . . . 17 ALA H . 26613 1 81 . 1 . 1 38 38 ALA C C 13 177.6 0.3 . 1 . . . . . 17 ALA C . 26613 1 82 . 1 . 1 38 38 ALA CA C 13 51.8 0.3 . 1 . . . . . 17 ALA CA . 26613 1 83 . 1 . 1 38 38 ALA CB C 13 18.1 0.3 . 1 . . . . . 17 ALA CB . 26613 1 84 . 1 . 1 38 38 ALA N N 15 127.5 0.3 . 1 . . . . . 17 ALA N . 26613 1 85 . 1 . 1 39 39 GLN H H 1 8.41 0.02 . 1 . . . . . 18 GLN H . 26613 1 86 . 1 . 1 39 39 GLN C C 13 176.0 0.3 . 1 . . . . . 18 GLN C . 26613 1 87 . 1 . 1 39 39 GLN CA C 13 55.1 0.3 . 1 . . . . . 18 GLN CA . 26613 1 88 . 1 . 1 39 39 GLN CB C 13 28.7 0.3 . 1 . . . . . 18 GLN CB . 26613 1 89 . 1 . 1 39 39 GLN N N 15 120.3 0.3 . 1 . . . . . 18 GLN N . 26613 1 90 . 1 . 1 40 40 LYS H H 1 8.54 0.02 . 1 . . . . . 19 LYS H . 26613 1 91 . 1 . 1 40 40 LYS C C 13 176.7 0.3 . 1 . . . . . 19 LYS C . 26613 1 92 . 1 . 1 40 40 LYS CA C 13 55.9 0.3 . 1 . . . . . 19 LYS CA . 26613 1 93 . 1 . 1 40 40 LYS CB C 13 32.1 0.3 . 1 . . . . . 19 LYS CB . 26613 1 94 . 1 . 1 40 40 LYS N N 15 123.2 0.3 . 1 . . . . . 19 LYS N . 26613 1 95 . 1 . 1 41 41 THR H H 1 8.30 0.02 . 1 . . . . . 20 THR H . 26613 1 96 . 1 . 1 41 41 THR C C 13 175.1 0.3 . 1 . . . . . 20 THR C . 26613 1 97 . 1 . 1 41 41 THR CA C 13 61.4 0.3 . 1 . . . . . 20 THR CA . 26613 1 98 . 1 . 1 41 41 THR CB C 13 69.6 0.3 . 1 . . . . . 20 THR CB . 26613 1 99 . 1 . 1 41 41 THR N N 15 115.0 0.3 . 1 . . . . . 20 THR N . 26613 1 100 . 1 . 1 42 42 GLY H H 1 8.45 0.02 . 1 . . . . . 21 GLY H . 26613 1 101 . 1 . 1 42 42 GLY C C 13 174.0 0.3 . 1 . . . . . 21 GLY C . 26613 1 102 . 1 . 1 42 42 GLY CA C 13 44.6 0.3 . 1 . . . . . 21 GLY CA . 26613 1 103 . 1 . 1 42 42 GLY N N 15 110.8 0.3 . 1 . . . . . 21 GLY N . 26613 1 104 . 1 . 1 43 43 VAL H H 1 8.04 0.02 . 1 . . . . . 22 VAL H . 26613 1 105 . 1 . 1 43 43 VAL C C 13 176.3 0.3 . 1 . . . . . 22 VAL C . 26613 1 106 . 1 . 1 43 43 VAL CA C 13 61.5 0.3 . 1 . . . . . 22 VAL CA . 26613 1 107 . 1 . 1 43 43 VAL CB C 13 32.0 0.3 . 1 . . . . . 22 VAL CB . 26613 1 108 . 1 . 1 43 43 VAL N N 15 118.6 0.3 . 1 . . . . . 22 VAL N . 26613 1 109 . 1 . 1 44 44 SER H H 1 8.47 0.02 . 1 . . . . . 23 SER H . 26613 1 110 . 1 . 1 44 44 SER C C 13 174.4 0.3 . 1 . . . . . 23 SER C . 26613 1 111 . 1 . 1 44 44 SER CA C 13 57.8 0.3 . 1 . . . . . 23 SER CA . 26613 1 112 . 1 . 1 44 44 SER CB C 13 63.2 0.3 . 1 . . . . . 23 SER CB . 26613 1 113 . 1 . 1 44 44 SER N N 15 119.0 0.3 . 1 . . . . . 23 SER N . 26613 1 114 . 1 . 1 45 45 ASN H H 1 8.58 0.02 . 1 . . . . . 24 ASN H . 26613 1 115 . 1 . 1 45 45 ASN C C 13 175.4 0.3 . 1 . . . . . 24 ASN C . 26613 1 116 . 1 . 1 45 45 ASN CA C 13 52.9 0.3 . 1 . . . . . 24 ASN CA . 26613 1 117 . 1 . 1 45 45 ASN CB C 13 38.0 0.3 . 1 . . . . . 24 ASN CB . 26613 1 118 . 1 . 1 45 45 ASN N N 15 121.3 0.3 . 1 . . . . . 24 ASN N . 26613 1 119 . 1 . 1 46 46 THR H H 1 8.21 0.02 . 1 . . . . . 25 THR H . 26613 1 120 . 1 . 1 46 46 THR C C 13 174.6 0.3 . 1 . . . . . 25 THR C . 26613 1 121 . 1 . 1 46 46 THR CA C 13 61.5 0.3 . 1 . . . . . 25 THR CA . 26613 1 122 . 1 . 1 46 46 THR CB C 13 69.3 0.3 . 1 . . . . . 25 THR CB . 26613 1 123 . 1 . 1 46 46 THR N N 15 114.2 0.3 . 1 . . . . . 25 THR N . 26613 1 124 . 1 . 1 47 47 LEU H H 1 8.31 0.02 . 1 . . . . . 26 LEU H . 26613 1 125 . 1 . 1 47 47 LEU C C 13 177.5 0.3 . 1 . . . . . 26 LEU C . 26613 1 126 . 1 . 1 47 47 LEU CA C 13 54.7 0.3 . 1 . . . . . 26 LEU CA . 26613 1 127 . 1 . 1 47 47 LEU CB C 13 41.1 0.3 . 1 . . . . . 26 LEU CB . 26613 1 128 . 1 . 1 47 47 LEU N N 15 123.9 0.3 . 1 . . . . . 26 LEU N . 26613 1 129 . 1 . 1 48 48 GLU H H 1 8.43 0.02 . 1 . . . . . 27 GLU H . 26613 1 130 . 1 . 1 48 48 GLU C C 13 176.4 0.3 . 1 . . . . . 27 GLU C . 26613 1 131 . 1 . 1 48 48 GLU CA C 13 56.3 0.3 . 1 . . . . . 27 GLU CA . 26613 1 132 . 1 . 1 48 48 GLU CB C 13 29.3 0.3 . 1 . . . . . 27 GLU CB . 26613 1 133 . 1 . 1 48 48 GLU N N 15 121.1 0.3 . 1 . . . . . 27 GLU N . 26613 1 134 . 1 . 1 49 49 ASN H H 1 8.43 0.02 . 1 . . . . . 28 ASN H . 26613 1 135 . 1 . 1 49 49 ASN C C 13 175.2 0.3 . 1 . . . . . 28 ASN C . 26613 1 136 . 1 . 1 49 49 ASN CA C 13 52.9 0.3 . 1 . . . . . 28 ASN CA . 26613 1 137 . 1 . 1 49 49 ASN CB C 13 38.2 0.3 . 1 . . . . . 28 ASN CB . 26613 1 138 . 1 . 1 49 49 ASN N N 15 119.1 0.3 . 1 . . . . . 28 ASN N . 26613 1 139 . 1 . 1 50 50 GLU H H 1 8.36 0.02 . 1 . . . . . 29 GLU H . 26613 1 140 . 1 . 1 50 50 GLU C C 13 176.1 0.3 . 1 . . . . . 29 GLU C . 26613 1 141 . 1 . 1 50 50 GLU CA C 13 56.3 0.3 . 1 . . . . . 29 GLU CA . 26613 1 142 . 1 . 1 50 50 GLU CB C 13 29.3 0.3 . 1 . . . . . 29 GLU CB . 26613 1 143 . 1 . 1 50 50 GLU N N 15 121.2 0.3 . 1 . . . . . 29 GLU N . 26613 1 144 . 1 . 1 51 51 PHE H H 1 8.37 0.02 . 1 . . . . . 30 PHE H . 26613 1 145 . 1 . 1 51 51 PHE C C 13 175.8 0.3 . 1 . . . . . 30 PHE C . 26613 1 146 . 1 . 1 51 51 PHE CA C 13 57.5 0.3 . 1 . . . . . 30 PHE CA . 26613 1 147 . 1 . 1 51 51 PHE CB C 13 38.3 0.3 . 1 . . . . . 30 PHE CB . 26613 1 148 . 1 . 1 51 51 PHE N N 15 121.3 0.3 . 1 . . . . . 30 PHE N . 26613 1 149 . 1 . 1 52 52 LYS H H 1 8.25 0.02 . 1 . . . . . 31 LYS H . 26613 1 150 . 1 . 1 52 52 LYS C C 13 176.7 0.3 . 1 . . . . . 31 LYS C . 26613 1 151 . 1 . 1 52 52 LYS CA C 13 55.7 0.3 . 1 . . . . . 31 LYS CA . 26613 1 152 . 1 . 1 52 52 LYS CB C 13 32.0 0.3 . 1 . . . . . 31 LYS CB . 26613 1 153 . 1 . 1 52 52 LYS N N 15 123.8 0.3 . 1 . . . . . 31 LYS N . 26613 1 154 . 1 . 1 53 53 GLY H H 1 7.76 0.02 . 1 . . . . . 32 GLY H . 26613 1 155 . 1 . 1 53 53 GLY C C 13 173.8 0.3 . 1 . . . . . 32 GLY C . 26613 1 156 . 1 . 1 53 53 GLY CA C 13 44.4 0.3 . 1 . . . . . 32 GLY CA . 26613 1 157 . 1 . 1 53 53 GLY N N 15 108.8 0.3 . 1 . . . . . 32 GLY N . 26613 1 158 . 1 . 1 54 54 ARG H H 1 8.29 0.02 . 1 . . . . . 33 ARG H . 26613 1 159 . 1 . 1 54 54 ARG C C 13 176.3 0.3 . 1 . . . . . 33 ARG C . 26613 1 160 . 1 . 1 54 54 ARG CA C 13 55.5 0.3 . 1 . . . . . 33 ARG CA . 26613 1 161 . 1 . 1 54 54 ARG CB C 13 29.9 0.3 . 1 . . . . . 33 ARG CB . 26613 1 162 . 1 . 1 54 54 ARG N N 15 120.7 0.3 . 1 . . . . . 33 ARG N . 26613 1 163 . 1 . 1 55 55 ALA H H 1 8.52 0.02 . 1 . . . . . 34 ALA H . 26613 1 164 . 1 . 1 55 55 ALA C C 13 178.0 0.3 . 1 . . . . . 34 ALA C . 26613 1 165 . 1 . 1 55 55 ALA CA C 13 52.2 0.3 . 1 . . . . . 34 ALA CA . 26613 1 166 . 1 . 1 55 55 ALA CB C 13 18.0 0.3 . 1 . . . . . 34 ALA CB . 26613 1 167 . 1 . 1 55 55 ALA N N 15 125.5 0.3 . 1 . . . . . 34 ALA N . 26613 1 168 . 1 . 1 56 56 SER H H 1 8.34 0.02 . 1 . . . . . 35 SER H . 26613 1 169 . 1 . 1 56 56 SER C C 13 174.8 0.3 . 1 . . . . . 35 SER C . 26613 1 170 . 1 . 1 56 56 SER CA C 13 58.1 0.3 . 1 . . . . . 35 SER CA . 26613 1 171 . 1 . 1 56 56 SER CB C 13 63.1 0.3 . 1 . . . . . 35 SER CB . 26613 1 172 . 1 . 1 56 56 SER N N 15 115.0 0.3 . 1 . . . . . 35 SER N . 26613 1 173 . 1 . 1 57 57 GLU H H 1 8.46 0.02 . 1 . . . . . 36 GLU H . 26613 1 174 . 1 . 1 57 57 GLU C C 13 176.5 0.3 . 1 . . . . . 36 GLU C . 26613 1 175 . 1 . 1 57 57 GLU CA C 13 56.0 0.3 . 1 . . . . . 36 GLU CA . 26613 1 176 . 1 . 1 57 57 GLU CB C 13 29.2 0.3 . 1 . . . . . 36 GLU CB . 26613 1 177 . 1 . 1 57 57 GLU N N 15 122.6 0.3 . 1 . . . . . 36 GLU N . 26613 1 178 . 1 . 1 58 58 LEU H H 1 8.19 0.02 . 1 . . . . . 37 LEU H . 26613 1 179 . 1 . 1 58 58 LEU C C 13 177.4 0.3 . 1 . . . . . 37 LEU C . 26613 1 180 . 1 . 1 58 58 LEU CA C 13 54.7 0.3 . 1 . . . . . 37 LEU CA . 26613 1 181 . 1 . 1 58 58 LEU CB C 13 41.0 0.3 . 1 . . . . . 37 LEU CB . 26613 1 182 . 1 . 1 58 58 LEU N N 15 122.4 0.3 . 1 . . . . . 37 LEU N . 26613 1 183 . 1 . 1 59 59 GLN H H 1 8.42 0.02 . 1 . . . . . 38 GLN H . 26613 1 184 . 1 . 1 59 59 GLN C C 13 176.0 0.3 . 1 . . . . . 38 GLN C . 26613 1 185 . 1 . 1 59 59 GLN CA C 13 55.3 0.3 . 1 . . . . . 38 GLN CA . 26613 1 186 . 1 . 1 59 59 GLN CB C 13 28.5 0.3 . 1 . . . . . 38 GLN CB . 26613 1 187 . 1 . 1 59 59 GLN N N 15 121.3 0.3 . 1 . . . . . 38 GLN N . 26613 1 188 . 1 . 1 60 60 ARG H H 1 8.45 0.02 . 1 . . . . . 39 ARG H . 26613 1 189 . 1 . 1 60 60 ARG C C 13 176.2 0.3 . 1 . . . . . 39 ARG C . 26613 1 190 . 1 . 1 60 60 ARG CA C 13 55.9 0.3 . 1 . . . . . 39 ARG CA . 26613 1 191 . 1 . 1 60 60 ARG CB C 13 29.6 0.3 . 1 . . . . . 39 ARG CB . 26613 1 192 . 1 . 1 60 60 ARG N N 15 122.7 0.3 . 1 . . . . . 39 ARG N . 26613 1 193 . 1 . 1 61 61 MET H H 1 8.56 0.02 . 1 . . . . . 40 MET H . 26613 1 194 . 1 . 1 61 61 MET C C 13 176.3 0.3 . 1 . . . . . 40 MET C . 26613 1 195 . 1 . 1 61 61 MET CA C 13 54.9 0.3 . 1 . . . . . 40 MET CA . 26613 1 196 . 1 . 1 61 61 MET CB C 13 32.1 0.3 . 1 . . . . . 40 MET CB . 26613 1 197 . 1 . 1 61 61 MET N N 15 122.1 0.3 . 1 . . . . . 40 MET N . 26613 1 198 . 1 . 1 62 62 GLU H H 1 8.62 0.02 . 1 . . . . . 41 GLU H . 26613 1 199 . 1 . 1 62 62 GLU C C 13 176.7 0.3 . 1 . . . . . 41 GLU C . 26613 1 200 . 1 . 1 62 62 GLU CA C 13 56.2 0.3 . 1 . . . . . 41 GLU CA . 26613 1 201 . 1 . 1 62 62 GLU CB C 13 29.3 0.3 . 1 . . . . . 41 GLU CB . 26613 1 202 . 1 . 1 62 62 GLU N N 15 122.5 0.3 . 1 . . . . . 41 GLU N . 26613 1 203 . 1 . 1 63 63 THR H H 1 8.23 0.02 . 1 . . . . . 42 THR H . 26613 1 204 . 1 . 1 63 63 THR C C 13 174.4 0.3 . 1 . . . . . 42 THR C . 26613 1 205 . 1 . 1 63 63 THR CA C 13 61.6 0.3 . 1 . . . . . 42 THR CA . 26613 1 206 . 1 . 1 63 63 THR CB C 13 69.4 0.3 . 1 . . . . . 42 THR CB . 26613 1 207 . 1 . 1 63 63 THR N N 15 114.6 0.3 . 1 . . . . . 42 THR N . 26613 1 208 . 1 . 1 64 64 ASP H H 1 8.46 0.02 . 1 . . . . . 43 ASP H . 26613 1 209 . 1 . 1 64 64 ASP C C 13 176.6 0.3 . 1 . . . . . 43 ASP C . 26613 1 210 . 1 . 1 64 64 ASP CA C 13 54.0 0.3 . 1 . . . . . 43 ASP CA . 26613 1 211 . 1 . 1 64 64 ASP CB C 13 40.4 0.3 . 1 . . . . . 43 ASP CB . 26613 1 212 . 1 . 1 64 64 ASP N N 15 122.5 0.3 . 1 . . . . . 43 ASP N . 26613 1 213 . 1 . 1 65 65 LEU H H 1 8.25 0.02 . 1 . . . . . 44 LEU H . 26613 1 214 . 1 . 1 65 65 LEU C C 13 177.9 0.3 . 1 . . . . . 44 LEU C . 26613 1 215 . 1 . 1 65 65 LEU CA C 13 55.4 0.3 . 1 . . . . . 44 LEU CA . 26613 1 216 . 1 . 1 65 65 LEU CB C 13 40.9 0.3 . 1 . . . . . 44 LEU CB . 26613 1 217 . 1 . 1 65 65 LEU N N 15 122.6 0.3 . 1 . . . . . 44 LEU N . 26613 1 218 . 1 . 1 66 66 GLN H H 1 8.29 0.02 . 1 . . . . . 45 GLN H . 26613 1 219 . 1 . 1 66 66 GLN C C 13 176.5 0.3 . 1 . . . . . 45 GLN C . 26613 1 220 . 1 . 1 66 66 GLN CA C 13 55.9 0.3 . 1 . . . . . 45 GLN CA . 26613 1 221 . 1 . 1 66 66 GLN CB C 13 28.1 0.3 . 1 . . . . . 45 GLN CB . 26613 1 222 . 1 . 1 66 66 GLN N N 15 119.4 0.3 . 1 . . . . . 45 GLN N . 26613 1 223 . 1 . 1 67 67 ALA H H 1 8.11 0.02 . 1 . . . . . 46 ALA H . 26613 1 224 . 1 . 1 67 67 ALA C C 13 178.1 0.3 . 1 . . . . . 46 ALA C . 26613 1 225 . 1 . 1 67 67 ALA CA C 13 52.5 0.3 . 1 . . . . . 46 ALA CA . 26613 1 226 . 1 . 1 67 67 ALA CB C 13 17.9 0.3 . 1 . . . . . 46 ALA CB . 26613 1 227 . 1 . 1 67 67 ALA N N 15 123.8 0.3 . 1 . . . . . 46 ALA N . 26613 1 228 . 1 . 1 68 68 LYS H H 1 8.18 0.02 . 1 . . . . . 47 LYS H . 26613 1 229 . 1 . 1 68 68 LYS C C 13 177.0 0.3 . 1 . . . . . 47 LYS C . 26613 1 230 . 1 . 1 68 68 LYS CA C 13 56.2 0.3 . 1 . . . . . 47 LYS CA . 26613 1 231 . 1 . 1 68 68 LYS CB C 13 31.9 0.3 . 1 . . . . . 47 LYS CB . 26613 1 232 . 1 . 1 68 68 LYS N N 15 119.7 0.3 . 1 . . . . . 47 LYS N . 26613 1 233 . 1 . 1 69 69 MET H H 1 8.28 0.02 . 1 . . . . . 48 MET H . 26613 1 234 . 1 . 1 69 69 MET C C 13 176.4 0.3 . 1 . . . . . 48 MET C . 26613 1 235 . 1 . 1 69 69 MET CA C 13 55.2 0.3 . 1 . . . . . 48 MET CA . 26613 1 236 . 1 . 1 69 69 MET CB C 13 32.0 0.3 . 1 . . . . . 48 MET CB . 26613 1 237 . 1 . 1 69 69 MET N N 15 120.6 0.3 . 1 . . . . . 48 MET N . 26613 1 238 . 1 . 1 70 70 LYS H H 1 8.41 0.02 . 1 . . . . . 49 LYS H . 26613 1 239 . 1 . 1 70 70 LYS C C 13 176.0 0.3 . 1 . . . . . 49 LYS C . 26613 1 240 . 1 . 1 70 70 LYS CA C 13 55.9 0.3 . 1 . . . . . 49 LYS CA . 26613 1 241 . 1 . 1 70 70 LYS CB C 13 32.0 0.3 . 1 . . . . . 49 LYS CB . 26613 1 242 . 1 . 1 70 70 LYS N N 15 123.0 0.3 . 1 . . . . . 49 LYS N . 26613 1 243 . 1 . 1 71 71 LYS H H 1 8.39 0.02 . 1 . . . . . 50 LYS H . 26613 1 244 . 1 . 1 71 71 LYS C C 13 176.5 0.3 . 1 . . . . . 50 LYS C . 26613 1 245 . 1 . 1 71 71 LYS CA C 13 55.9 0.3 . 1 . . . . . 50 LYS CA . 26613 1 246 . 1 . 1 71 71 LYS CB C 13 32.1 0.3 . 1 . . . . . 50 LYS CB . 26613 1 247 . 1 . 1 71 71 LYS N N 15 122.9 0.3 . 1 . . . . . 50 LYS N . 26613 1 248 . 1 . 1 72 72 LEU H H 1 8.37 0.02 . 1 . . . . . 51 LEU H . 26613 1 249 . 1 . 1 72 72 LEU C C 13 177.5 0.3 . 1 . . . . . 51 LEU C . 26613 1 250 . 1 . 1 72 72 LEU CA C 13 54.6 0.3 . 1 . . . . . 51 LEU CA . 26613 1 251 . 1 . 1 72 72 LEU CB C 13 41.0 0.3 . 1 . . . . . 51 LEU CB . 26613 1 252 . 1 . 1 72 72 LEU N N 15 123.9 0.3 . 1 . . . . . 51 LEU N . 26613 1 253 . 1 . 1 73 73 GLN H H 1 8.56 0.02 . 1 . . . . . 52 GLN H . 26613 1 254 . 1 . 1 73 73 GLN C C 13 176.1 0.3 . 1 . . . . . 52 GLN C . 26613 1 255 . 1 . 1 73 73 GLN CA C 13 55.2 0.3 . 1 . . . . . 52 GLN CA . 26613 1 256 . 1 . 1 73 73 GLN CB C 13 28.8 0.3 . 1 . . . . . 52 GLN CB . 26613 1 257 . 1 . 1 73 73 GLN N N 15 121.5 0.3 . 1 . . . . . 52 GLN N . 26613 1 258 . 1 . 1 74 74 SER H H 1 8.42 0.02 . 1 . . . . . 53 SER H . 26613 1 259 . 1 . 1 74 74 SER C C 13 174.6 0.3 . 1 . . . . . 53 SER C . 26613 1 260 . 1 . 1 74 74 SER CA C 13 57.9 0.3 . 1 . . . . . 53 SER CA . 26613 1 261 . 1 . 1 74 74 SER CB C 13 63.2 0.3 . 1 . . . . . 53 SER CB . 26613 1 262 . 1 . 1 74 74 SER N N 15 117.1 0.3 . 1 . . . . . 53 SER N . 26613 1 263 . 1 . 1 75 75 MET H H 1 8.48 0.02 . 1 . . . . . 54 MET H . 26613 1 264 . 1 . 1 75 75 MET C C 13 176.3 0.3 . 1 . . . . . 54 MET C . 26613 1 265 . 1 . 1 75 75 MET CA C 13 54.9 0.3 . 1 . . . . . 54 MET CA . 26613 1 266 . 1 . 1 75 75 MET CB C 13 32.1 0.3 . 1 . . . . . 54 MET CB . 26613 1 267 . 1 . 1 75 75 MET N N 15 122.6 0.3 . 1 . . . . . 54 MET N . 26613 1 268 . 1 . 1 76 76 LYS H H 1 8.41 0.02 . 1 . . . . . 55 LYS H . 26613 1 269 . 1 . 1 76 76 LYS C C 13 176.4 0.3 . 1 . . . . . 55 LYS C . 26613 1 270 . 1 . 1 76 76 LYS CA C 13 55.9 0.3 . 1 . . . . . 55 LYS CA . 26613 1 271 . 1 . 1 76 76 LYS CB C 13 32.1 0.3 . 1 . . . . . 55 LYS CB . 26613 1 272 . 1 . 1 76 76 LYS N N 15 122.8 0.3 . 1 . . . . . 55 LYS N . 26613 1 273 . 1 . 1 77 77 ALA H H 1 8.46 0.02 . 1 . . . . . 56 ALA H . 26613 1 274 . 1 . 1 77 77 ALA C C 13 178.2 0.3 . 1 . . . . . 56 ALA C . 26613 1 275 . 1 . 1 77 77 ALA CA C 13 52.0 0.3 . 1 . . . . . 56 ALA CA . 26613 1 276 . 1 . 1 77 77 ALA CB C 13 18.3 0.3 . 1 . . . . . 56 ALA CB . 26613 1 277 . 1 . 1 77 77 ALA N N 15 125.9 0.3 . 1 . . . . . 56 ALA N . 26613 1 278 . 1 . 1 78 78 GLY H H 1 8.41 0.02 . 1 . . . . . 57 GLY H . 26613 1 279 . 1 . 1 78 78 GLY C C 13 174.2 0.3 . 1 . . . . . 57 GLY C . 26613 1 280 . 1 . 1 78 78 GLY CA C 13 44.5 0.3 . 1 . . . . . 57 GLY CA . 26613 1 281 . 1 . 1 78 78 GLY N N 15 108.4 0.3 . 1 . . . . . 57 GLY N . 26613 1 282 . 1 . 1 79 79 SER H H 1 8.23 0.02 . 1 . . . . . 58 SER H . 26613 1 283 . 1 . 1 79 79 SER C C 13 174.6 0.3 . 1 . . . . . 58 SER C . 26613 1 284 . 1 . 1 79 79 SER CA C 13 58.0 0.3 . 1 . . . . . 58 SER CA . 26613 1 285 . 1 . 1 79 79 SER CB C 13 63.3 0.3 . 1 . . . . . 58 SER CB . 26613 1 286 . 1 . 1 79 79 SER N N 15 115.1 0.3 . 1 . . . . . 58 SER N . 26613 1 287 . 1 . 1 80 80 ASP H H 1 8.61 0.02 . 1 . . . . . 59 ASP H . 26613 1 288 . 1 . 1 80 80 ASP C C 13 175.3 0.3 . 1 . . . . . 59 ASP C . 26613 1 289 . 1 . 1 80 80 ASP CA C 13 53.0 0.3 . 1 . . . . . 59 ASP CA . 26613 1 290 . 1 . 1 80 80 ASP CB C 13 38.0 0.3 . 1 . . . . . 59 ASP CB . 26613 1 291 . 1 . 1 80 80 ASP N N 15 120.7 0.3 . 1 . . . . . 59 ASP N . 26613 1 292 . 1 . 1 81 81 ARG H H 1 8.36 0.02 . 1 . . . . . 60 ARG H . 26613 1 293 . 1 . 1 81 81 ARG C C 13 176.7 0.3 . 1 . . . . . 60 ARG C . 26613 1 294 . 1 . 1 81 81 ARG CA C 13 56.1 0.3 . 1 . . . . . 60 ARG CA . 26613 1 295 . 1 . 1 81 81 ARG CB C 13 29.3 0.3 . 1 . . . . . 60 ARG CB . 26613 1 296 . 1 . 1 81 81 ARG N N 15 120.7 0.3 . 1 . . . . . 60 ARG N . 26613 1 297 . 1 . 1 82 82 THR H H 1 8.28 0.02 . 1 . . . . . 61 THR H . 26613 1 298 . 1 . 1 82 82 THR C C 13 174.6 0.3 . 1 . . . . . 61 THR C . 26613 1 299 . 1 . 1 82 82 THR CA C 13 61.7 0.3 . 1 . . . . . 61 THR CA . 26613 1 300 . 1 . 1 82 82 THR CB C 13 69.3 0.3 . 1 . . . . . 61 THR CB . 26613 1 301 . 1 . 1 82 82 THR N N 15 114.8 0.3 . 1 . . . . . 61 THR N . 26613 1 302 . 1 . 1 83 83 LYS H H 1 8.25 0.02 . 1 . . . . . 62 LYS H . 26613 1 303 . 1 . 1 83 83 LYS C C 13 176.2 0.3 . 1 . . . . . 62 LYS C . 26613 1 304 . 1 . 1 83 83 LYS CA C 13 55.8 0.3 . 1 . . . . . 62 LYS CA . 26613 1 305 . 1 . 1 83 83 LYS CB C 13 32.0 0.3 . 1 . . . . . 62 LYS CB . 26613 1 306 . 1 . 1 83 83 LYS N N 15 123.5 0.3 . 1 . . . . . 62 LYS N . 26613 1 307 . 1 . 1 84 84 LEU H H 1 8.31 0.02 . 1 . . . . . 63 LEU H . 26613 1 308 . 1 . 1 84 84 LEU C C 13 177.4 0.3 . 1 . . . . . 63 LEU C . 26613 1 309 . 1 . 1 84 84 LEU CA C 13 54.6 0.3 . 1 . . . . . 63 LEU CA . 26613 1 310 . 1 . 1 84 84 LEU CB C 13 41.0 0.3 . 1 . . . . . 63 LEU CB . 26613 1 311 . 1 . 1 84 84 LEU N N 15 123.7 0.3 . 1 . . . . . 63 LEU N . 26613 1 312 . 1 . 1 85 85 GLU H H 1 8.50 0.02 . 1 . . . . . 64 GLU H . 26613 1 313 . 1 . 1 85 85 GLU C C 13 176.5 0.3 . 1 . . . . . 64 GLU C . 26613 1 314 . 1 . 1 85 85 GLU CA C 13 56.0 0.3 . 1 . . . . . 64 GLU CA . 26613 1 315 . 1 . 1 85 85 GLU CB C 13 29.4 0.3 . 1 . . . . . 64 GLU CB . 26613 1 316 . 1 . 1 85 85 GLU N N 15 122.2 0.3 . 1 . . . . . 64 GLU N . 26613 1 317 . 1 . 1 86 86 LYS H H 1 8.38 0.02 . 1 . . . . . 65 LYS H . 26613 1 318 . 1 . 1 86 86 LYS C C 13 176.3 0.3 . 1 . . . . . 65 LYS C . 26613 1 319 . 1 . 1 86 86 LYS CA C 13 56.2 0.3 . 1 . . . . . 65 LYS CA . 26613 1 320 . 1 . 1 86 86 LYS CB C 13 32.2 0.3 . 1 . . . . . 65 LYS CB . 26613 1 321 . 1 . 1 86 86 LYS N N 15 121.6 0.3 . 1 . . . . . 65 LYS N . 26613 1 322 . 1 . 1 87 87 ASP H H 1 8.44 0.02 . 1 . . . . . 66 ASP H . 26613 1 323 . 1 . 1 87 87 ASP C C 13 176.5 0.3 . 1 . . . . . 66 ASP C . 26613 1 324 . 1 . 1 87 87 ASP CA C 13 53.9 0.3 . 1 . . . . . 66 ASP CA . 26613 1 325 . 1 . 1 87 87 ASP CB C 13 40.5 0.3 . 1 . . . . . 66 ASP CB . 26613 1 326 . 1 . 1 87 87 ASP N N 15 121.4 0.3 . 1 . . . . . 66 ASP N . 26613 1 327 . 1 . 1 88 88 VAL H H 1 8.14 0.02 . 1 . . . . . 67 VAL H . 26613 1 328 . 1 . 1 88 88 VAL C C 13 176.5 0.3 . 1 . . . . . 67 VAL C . 26613 1 329 . 1 . 1 88 88 VAL CA C 13 62.1 0.3 . 1 . . . . . 67 VAL CA . 26613 1 330 . 1 . 1 88 88 VAL CB C 13 31.5 0.3 . 1 . . . . . 67 VAL CB . 26613 1 331 . 1 . 1 88 88 VAL N N 15 120.3 0.3 . 1 . . . . . 67 VAL N . 26613 1 332 . 1 . 1 89 89 MET H H 1 8.40 0.02 . 1 . . . . . 68 MET H . 26613 1 333 . 1 . 1 89 89 MET C C 13 176.3 0.3 . 1 . . . . . 68 MET C . 26613 1 334 . 1 . 1 89 89 MET CA C 13 54.8 0.3 . 1 . . . . . 68 MET CA . 26613 1 335 . 1 . 1 89 89 MET CB C 13 31.7 0.3 . 1 . . . . . 68 MET CB . 26613 1 336 . 1 . 1 89 89 MET N N 15 122.6 0.3 . 1 . . . . . 68 MET N . 26613 1 337 . 1 . 1 90 90 ALA H H 1 8.20 0.02 . 1 . . . . . 69 ALA H . 26613 1 338 . 1 . 1 90 90 ALA C C 13 177.8 0.3 . 1 . . . . . 69 ALA C . 26613 1 339 . 1 . 1 90 90 ALA CA C 13 52.0 0.3 . 1 . . . . . 69 ALA CA . 26613 1 340 . 1 . 1 90 90 ALA CB C 13 18.1 0.3 . 1 . . . . . 69 ALA CB . 26613 1 341 . 1 . 1 90 90 ALA N N 15 124.7 0.3 . 1 . . . . . 69 ALA N . 26613 1 342 . 1 . 1 91 91 GLN H H 1 8.24 0.02 . 1 . . . . . 70 GLN H . 26613 1 343 . 1 . 1 91 91 GLN C C 13 175.7 0.3 . 1 . . . . . 70 GLN C . 26613 1 344 . 1 . 1 91 91 GLN CA C 13 55.7 0.3 . 1 . . . . . 70 GLN CA . 26613 1 345 . 1 . 1 91 91 GLN CB C 13 29.7 0.3 . 1 . . . . . 70 GLN CB . 26613 1 346 . 1 . 1 91 91 GLN N N 15 120.3 0.3 . 1 . . . . . 70 GLN N . 26613 1 347 . 1 . 1 92 92 ARG H H 1 8.41 0.02 . 1 . . . . . 71 ARG H . 26613 1 348 . 1 . 1 92 92 ARG C C 13 176.3 0.3 . 1 . . . . . 71 ARG C . 26613 1 349 . 1 . 1 92 92 ARG CA C 13 56.2 0.3 . 1 . . . . . 71 ARG CA . 26613 1 350 . 1 . 1 92 92 ARG CB C 13 28.8 0.3 . 1 . . . . . 71 ARG CB . 26613 1 351 . 1 . 1 92 92 ARG N N 15 122.1 0.3 . 1 . . . . . 71 ARG N . 26613 1 352 . 1 . 1 93 93 GLN H H 1 8.54 0.02 . 1 . . . . . 72 GLN H . 26613 1 353 . 1 . 1 93 93 GLN C C 13 176.0 0.3 . 1 . . . . . 72 GLN C . 26613 1 354 . 1 . 1 93 93 GLN CA C 13 55.2 0.3 . 1 . . . . . 72 GLN CA . 26613 1 355 . 1 . 1 93 93 GLN CB C 13 28.8 0.3 . 1 . . . . . 72 GLN CB . 26613 1 356 . 1 . 1 93 93 GLN N N 15 121.9 0.3 . 1 . . . . . 72 GLN N . 26613 1 357 . 1 . 1 94 94 THR H H 1 8.25 0.02 . 1 . . . . . 73 THR H . 26613 1 358 . 1 . 1 94 94 THR C C 13 174.1 0.3 . 1 . . . . . 73 THR C . 26613 1 359 . 1 . 1 94 94 THR CA C 13 61.3 0.3 . 1 . . . . . 73 THR CA . 26613 1 360 . 1 . 1 94 94 THR CB C 13 69.5 0.3 . 1 . . . . . 73 THR CB . 26613 1 361 . 1 . 1 94 94 THR N N 15 115.6 0.3 . 1 . . . . . 73 THR N . 26613 1 362 . 1 . 1 95 95 PHE H H 1 8.34 0.02 . 1 . . . . . 74 PHE H . 26613 1 363 . 1 . 1 95 95 PHE C C 13 175.4 0.3 . 1 . . . . . 74 PHE C . 26613 1 364 . 1 . 1 95 95 PHE CA C 13 56.9 0.3 . 1 . . . . . 74 PHE CA . 26613 1 365 . 1 . 1 95 95 PHE CB C 13 38.9 0.3 . 1 . . . . . 74 PHE CB . 26613 1 366 . 1 . 1 95 95 PHE N N 15 122.0 0.3 . 1 . . . . . 74 PHE N . 26613 1 367 . 1 . 1 96 96 ALA H H 1 8.34 0.02 . 1 . . . . . 75 ALA H . 26613 1 368 . 1 . 1 96 96 ALA C C 13 177.4 0.3 . 1 . . . . . 75 ALA C . 26613 1 369 . 1 . 1 96 96 ALA CA C 13 51.8 0.3 . 1 . . . . . 75 ALA CA . 26613 1 370 . 1 . 1 96 96 ALA CB C 13 18.2 0.3 . 1 . . . . . 75 ALA CB . 26613 1 371 . 1 . 1 96 96 ALA N N 15 125.1 0.3 . 1 . . . . . 75 ALA N . 26613 1 372 . 1 . 1 97 97 GLN H H 1 8.33 0.02 . 1 . . . . . 76 GLN H . 26613 1 373 . 1 . 1 97 97 GLN C C 13 176.1 0.3 . 1 . . . . . 76 GLN C . 26613 1 374 . 1 . 1 97 97 GLN CA C 13 55.2 0.3 . 1 . . . . . 76 GLN CA . 26613 1 375 . 1 . 1 97 97 GLN CB C 13 28.6 0.3 . 1 . . . . . 76 GLN CB . 26613 1 376 . 1 . 1 97 97 GLN N N 15 120.0 0.3 . 1 . . . . . 76 GLN N . 26613 1 377 . 1 . 1 98 98 LYS H H 1 8.44 0.02 . 1 . . . . . 77 LYS H . 26613 1 378 . 1 . 1 98 98 LYS C C 13 176.3 0.3 . 1 . . . . . 77 LYS C . 26613 1 379 . 1 . 1 98 98 LYS CA C 13 55.9 0.3 . 1 . . . . . 77 LYS CA . 26613 1 380 . 1 . 1 98 98 LYS CB C 13 32.2 0.3 . 1 . . . . . 77 LYS CB . 26613 1 381 . 1 . 1 98 98 LYS N N 15 123.0 0.3 . 1 . . . . . 77 LYS N . 26613 1 382 . 1 . 1 99 99 ALA H H 1 8.41 0.02 . 1 . . . . . 78 ALA H . 26613 1 383 . 1 . 1 99 99 ALA C C 13 177.7 0.3 . 1 . . . . . 78 ALA C . 26613 1 384 . 1 . 1 99 99 ALA CA C 13 51.9 0.3 . 1 . . . . . 78 ALA CA . 26613 1 385 . 1 . 1 99 99 ALA CB C 13 18.0 0.3 . 1 . . . . . 78 ALA CB . 26613 1 386 . 1 . 1 99 99 ALA N N 15 125.4 0.3 . 1 . . . . . 78 ALA N . 26613 1 387 . 1 . 1 100 100 GLN H H 1 8.40 0.02 . 1 . . . . . 79 GLN H . 26613 1 388 . 1 . 1 100 100 GLN C C 13 175.7 0.3 . 1 . . . . . 79 GLN C . 26613 1 389 . 1 . 1 100 100 GLN CA C 13 55.1 0.3 . 1 . . . . . 79 GLN CA . 26613 1 390 . 1 . 1 100 100 GLN CB C 13 28.7 0.3 . 1 . . . . . 79 GLN CB . 26613 1 391 . 1 . 1 100 100 GLN N N 15 119.9 0.3 . 1 . . . . . 79 GLN N . 26613 1 392 . 1 . 1 101 101 ALA H H 1 8.33 0.02 . 1 . . . . . 80 ALA H . 26613 1 393 . 1 . 1 101 101 ALA C C 13 177.4 0.3 . 1 . . . . . 80 ALA C . 26613 1 394 . 1 . 1 101 101 ALA CA C 13 51.8 0.3 . 1 . . . . . 80 ALA CA . 26613 1 395 . 1 . 1 101 101 ALA CB C 13 18.2 0.3 . 1 . . . . . 80 ALA CB . 26613 1 396 . 1 . 1 101 101 ALA N N 15 125.0 0.3 . 1 . . . . . 80 ALA N . 26613 1 397 . 1 . 1 102 102 PHE H H 1 8.22 0.02 . 1 . . . . . 81 PHE H . 26613 1 398 . 1 . 1 102 102 PHE C C 13 175.8 0.3 . 1 . . . . . 81 PHE C . 26613 1 399 . 1 . 1 102 102 PHE CA C 13 57.2 0.3 . 1 . . . . . 81 PHE CA . 26613 1 400 . 1 . 1 102 102 PHE CB C 13 38.7 0.3 . 1 . . . . . 81 PHE CB . 26613 1 401 . 1 . 1 102 102 PHE N N 15 119.3 0.3 . 1 . . . . . 81 PHE N . 26613 1 402 . 1 . 1 103 103 GLU H H 1 8.41 0.02 . 1 . . . . . 82 GLU H . 26613 1 403 . 1 . 1 103 103 GLU C C 13 176.4 0.3 . 1 . . . . . 82 GLU C . 26613 1 404 . 1 . 1 103 103 GLU CA C 13 55.9 0.3 . 1 . . . . . 82 GLU CA . 26613 1 405 . 1 . 1 103 103 GLU CB C 13 29.3 0.3 . 1 . . . . . 82 GLU CB . 26613 1 406 . 1 . 1 103 103 GLU N N 15 122.5 0.3 . 1 . . . . . 82 GLU N . 26613 1 407 . 1 . 1 104 104 GLN H H 1 8.38 0.02 . 1 . . . . . 83 GLN H . 26613 1 408 . 1 . 1 104 104 GLN C C 13 175.9 0.3 . 1 . . . . . 83 GLN C . 26613 1 409 . 1 . 1 104 104 GLN CA C 13 55.6 0.3 . 1 . . . . . 83 GLN CA . 26613 1 410 . 1 . 1 104 104 GLN CB C 13 28.6 0.3 . 1 . . . . . 83 GLN CB . 26613 1 411 . 1 . 1 104 104 GLN N N 15 121.1 0.3 . 1 . . . . . 83 GLN N . 26613 1 412 . 1 . 1 105 105 ASP H H 1 8.46 0.02 . 1 . . . . . 84 ASP H . 26613 1 413 . 1 . 1 105 105 ASP C C 13 176.5 0.3 . 1 . . . . . 84 ASP C . 26613 1 414 . 1 . 1 105 105 ASP CA C 13 54.1 0.3 . 1 . . . . . 84 ASP CA . 26613 1 415 . 1 . 1 105 105 ASP CB C 13 40.5 0.3 . 1 . . . . . 84 ASP CB . 26613 1 416 . 1 . 1 105 105 ASP N N 15 121.3 0.3 . 1 . . . . . 84 ASP N . 26613 1 417 . 1 . 1 106 106 ARG H H 1 8.27 0.02 . 1 . . . . . 85 ARG H . 26613 1 418 . 1 . 1 106 106 ARG C C 13 176.3 0.3 . 1 . . . . . 85 ARG C . 26613 1 419 . 1 . 1 106 106 ARG CA C 13 55.8 0.3 . 1 . . . . . 85 ARG CA . 26613 1 420 . 1 . 1 106 106 ARG CB C 13 29.5 0.3 . 1 . . . . . 85 ARG CB . 26613 1 421 . 1 . 1 106 106 ARG N N 15 121.5 0.3 . 1 . . . . . 85 ARG N . 26613 1 422 . 1 . 1 107 107 ALA H H 1 8.26 0.02 . 1 . . . . . 86 ALA H . 26613 1 423 . 1 . 1 107 107 ALA C C 13 177.7 0.3 . 1 . . . . . 86 ALA C . 26613 1 424 . 1 . 1 107 107 ALA CA C 13 52.1 0.3 . 1 . . . . . 86 ALA CA . 26613 1 425 . 1 . 1 107 107 ALA CB C 13 18.0 0.3 . 1 . . . . . 86 ALA CB . 26613 1 426 . 1 . 1 107 107 ALA N N 15 123.9 0.3 . 1 . . . . . 86 ALA N . 26613 1 427 . 1 . 1 108 108 ARG H H 1 8.32 0.02 . 1 . . . . . 87 ARG H . 26613 1 428 . 1 . 1 108 108 ARG C C 13 176.1 0.3 . 1 . . . . . 87 ARG C . 26613 1 429 . 1 . 1 108 108 ARG CA C 13 55.3 0.3 . 1 . . . . . 87 ARG CA . 26613 1 430 . 1 . 1 108 108 ARG CB C 13 28.5 0.3 . 1 . . . . . 87 ARG CB . 26613 1 431 . 1 . 1 108 108 ARG N N 15 119.4 0.3 . 1 . . . . . 87 ARG N . 26613 1 432 . 1 . 1 109 109 ARG H H 1 8.42 0.02 . 1 . . . . . 88 ARG H . 26613 1 433 . 1 . 1 109 109 ARG C C 13 176.4 0.3 . 1 . . . . . 88 ARG C . 26613 1 434 . 1 . 1 109 109 ARG CA C 13 55.5 0.3 . 1 . . . . . 88 ARG CA . 26613 1 435 . 1 . 1 109 109 ARG CB C 13 29.9 0.3 . 1 . . . . . 88 ARG CB . 26613 1 436 . 1 . 1 109 109 ARG N N 15 122.4 0.3 . 1 . . . . . 88 ARG N . 26613 1 437 . 1 . 1 110 110 SER H H 1 8.53 0.02 . 1 . . . . . 89 SER H . 26613 1 438 . 1 . 1 110 110 SER C C 13 174.6 0.3 . 1 . . . . . 89 SER C . 26613 1 439 . 1 . 1 110 110 SER CA C 13 57.9 0.3 . 1 . . . . . 89 SER CA . 26613 1 440 . 1 . 1 110 110 SER CB C 13 63.2 0.3 . 1 . . . . . 89 SER CB . 26613 1 441 . 1 . 1 110 110 SER N N 15 117.1 0.3 . 1 . . . . . 89 SER N . 26613 1 442 . 1 . 1 111 111 ASN H H 1 8.53 0.02 . 1 . . . . . 90 ASN H . 26613 1 443 . 1 . 1 111 111 ASN C C 13 176.5 0.3 . 1 . . . . . 90 ASN C . 26613 1 444 . 1 . 1 111 111 ASN CA C 13 53.8 0.3 . 1 . . . . . 90 ASN CA . 26613 1 445 . 1 . 1 111 111 ASN CB C 13 40.4 0.3 . 1 . . . . . 90 ASN CB . 26613 1 446 . 1 . 1 111 111 ASN N N 15 122.2 0.3 . 1 . . . . . 90 ASN N . 26613 1 447 . 1 . 1 112 112 GLU H H 1 8.40 0.02 . 1 . . . . . 91 GLU H . 26613 1 448 . 1 . 1 112 112 GLU C C 13 176.6 0.3 . 1 . . . . . 91 GLU C . 26613 1 449 . 1 . 1 112 112 GLU CA C 13 56.1 0.3 . 1 . . . . . 91 GLU CA . 26613 1 450 . 1 . 1 112 112 GLU CB C 13 29.4 0.3 . 1 . . . . . 91 GLU CB . 26613 1 451 . 1 . 1 112 112 GLU N N 15 121.7 0.3 . 1 . . . . . 91 GLU N . 26613 1 452 . 1 . 1 113 113 GLU H H 1 8.47 0.02 . 1 . . . . . 92 GLU H . 26613 1 453 . 1 . 1 113 113 GLU C C 13 176.9 0.3 . 1 . . . . . 92 GLU C . 26613 1 454 . 1 . 1 113 113 GLU CA C 13 55.5 0.3 . 1 . . . . . 92 GLU CA . 26613 1 455 . 1 . 1 113 113 GLU CB C 13 29.8 0.3 . 1 . . . . . 92 GLU CB . 26613 1 456 . 1 . 1 113 113 GLU N N 15 122.5 0.3 . 1 . . . . . 92 GLU N . 26613 1 457 . 1 . 1 114 114 ARG H H 1 8.53 0.02 . 1 . . . . . 93 ARG H . 26613 1 458 . 1 . 1 114 114 ARG C C 13 177.0 0.3 . 1 . . . . . 93 ARG C . 26613 1 459 . 1 . 1 114 114 ARG CA C 13 56.0 0.3 . 1 . . . . . 93 ARG CA . 26613 1 460 . 1 . 1 114 114 ARG CB C 13 29.7 0.3 . 1 . . . . . 93 ARG CB . 26613 1 461 . 1 . 1 114 114 ARG N N 15 122.1 0.3 . 1 . . . . . 93 ARG N . 26613 1 462 . 1 . 1 115 115 GLY H H 1 8.45 0.02 . 1 . . . . . 94 GLY H . 26613 1 463 . 1 . 1 115 115 GLY C C 13 173.9 0.3 . 1 . . . . . 94 GLY C . 26613 1 464 . 1 . 1 115 115 GLY CA C 13 44.5 0.3 . 1 . . . . . 94 GLY CA . 26613 1 465 . 1 . 1 115 115 GLY N N 15 109.5 0.3 . 1 . . . . . 94 GLY N . 26613 1 466 . 1 . 1 116 116 LYS H H 1 8.14 0.02 . 1 . . . . . 95 LYS H . 26613 1 467 . 1 . 1 116 116 LYS C C 13 176.7 0.3 . 1 . . . . . 95 LYS C . 26613 1 468 . 1 . 1 116 116 LYS CA C 13 55.7 0.3 . 1 . . . . . 95 LYS CA . 26613 1 469 . 1 . 1 116 116 LYS CB C 13 32.2 0.3 . 1 . . . . . 95 LYS CB . 26613 1 470 . 1 . 1 116 116 LYS N N 15 120.8 0.3 . 1 . . . . . 95 LYS N . 26613 1 471 . 1 . 1 117 117 LEU H H 1 8.40 0.02 . 1 . . . . . 96 LEU H . 26613 1 472 . 1 . 1 117 117 LEU C C 13 177.1 0.3 . 1 . . . . . 96 LEU C . 26613 1 473 . 1 . 1 117 117 LEU CA C 13 54.7 0.3 . 1 . . . . . 96 LEU CA . 26613 1 474 . 1 . 1 117 117 LEU CB C 13 41.1 0.3 . 1 . . . . . 96 LEU CB . 26613 1 475 . 1 . 1 117 117 LEU N N 15 124.0 0.3 . 1 . . . . . 96 LEU N . 26613 1 476 . 1 . 1 118 118 VAL H H 1 8.38 0.02 . 1 . . . . . 97 VAL H . 26613 1 477 . 1 . 1 118 118 VAL C C 13 176.3 0.3 . 1 . . . . . 97 VAL C . 26613 1 478 . 1 . 1 118 118 VAL CA C 13 61.6 0.3 . 1 . . . . . 97 VAL CA . 26613 1 479 . 1 . 1 118 118 VAL CB C 13 31.8 0.3 . 1 . . . . . 97 VAL CB . 26613 1 480 . 1 . 1 118 118 VAL N N 15 122.6 0.3 . 1 . . . . . 97 VAL N . 26613 1 481 . 1 . 1 119 119 THR H H 1 8.32 0.02 . 1 . . . . . 98 THR H . 26613 1 482 . 1 . 1 119 119 THR C C 13 174.2 0.3 . 1 . . . . . 98 THR C . 26613 1 483 . 1 . 1 119 119 THR CA C 13 61.3 0.3 . 1 . . . . . 98 THR CA . 26613 1 484 . 1 . 1 119 119 THR CB C 13 69.4 0.3 . 1 . . . . . 98 THR CB . 26613 1 485 . 1 . 1 119 119 THR N N 15 119.0 0.3 . 1 . . . . . 98 THR N . 26613 1 486 . 1 . 1 120 120 ARG H H 1 8.44 0.02 . 1 . . . . . 99 ARG H . 26613 1 487 . 1 . 1 120 120 ARG C C 13 176.0 0.3 . 1 . . . . . 99 ARG C . 26613 1 488 . 1 . 1 120 120 ARG CA C 13 55.4 0.3 . 1 . . . . . 99 ARG CA . 26613 1 489 . 1 . 1 120 120 ARG CB C 13 29.8 0.3 . 1 . . . . . 99 ARG CB . 26613 1 490 . 1 . 1 120 120 ARG N N 15 124.0 0.3 . 1 . . . . . 99 ARG N . 26613 1 491 . 1 . 1 121 121 ILE H H 1 8.37 0.02 . 1 . . . . . 100 ILE H . 26613 1 492 . 1 . 1 121 121 ILE C C 13 176.2 0.3 . 1 . . . . . 100 ILE C . 26613 1 493 . 1 . 1 121 121 ILE CA C 13 60.5 0.3 . 1 . . . . . 100 ILE CA . 26613 1 494 . 1 . 1 121 121 ILE CB C 13 37.6 0.3 . 1 . . . . . 100 ILE CB . 26613 1 495 . 1 . 1 121 121 ILE N N 15 123.1 0.3 . 1 . . . . . 100 ILE N . 26613 1 496 . 1 . 1 122 122 GLN H H 1 8.61 0.02 . 1 . . . . . 101 GLN H . 26613 1 497 . 1 . 1 122 122 GLN C C 13 175.9 0.3 . 1 . . . . . 101 GLN C . 26613 1 498 . 1 . 1 122 122 GLN CA C 13 55.0 0.3 . 1 . . . . . 101 GLN CA . 26613 1 499 . 1 . 1 122 122 GLN CB C 13 28.8 0.3 . 1 . . . . . 101 GLN CB . 26613 1 500 . 1 . 1 122 122 GLN N N 15 125.1 0.3 . 1 . . . . . 101 GLN N . 26613 1 501 . 1 . 1 123 123 THR H H 1 8.27 0.02 . 1 . . . . . 102 THR H . 26613 1 502 . 1 . 1 123 123 THR C C 13 174.1 0.3 . 1 . . . . . 102 THR C . 26613 1 503 . 1 . 1 123 123 THR CA C 13 61.3 0.3 . 1 . . . . . 102 THR CA . 26613 1 504 . 1 . 1 123 123 THR CB C 13 69.4 0.3 . 1 . . . . . 102 THR CB . 26613 1 505 . 1 . 1 123 123 THR N N 15 116.2 0.3 . 1 . . . . . 102 THR N . 26613 1 506 . 1 . 1 124 124 ALA H H 1 8.37 0.02 . 1 . . . . . 103 ALA H . 26613 1 507 . 1 . 1 124 124 ALA C C 13 177.5 0.3 . 1 . . . . . 103 ALA C . 26613 1 508 . 1 . 1 124 124 ALA CA C 13 51.7 0.3 . 1 . . . . . 103 ALA CA . 26613 1 509 . 1 . 1 124 124 ALA CB C 13 18.2 0.3 . 1 . . . . . 103 ALA CB . 26613 1 510 . 1 . 1 124 124 ALA N N 15 126.3 0.3 . 1 . . . . . 103 ALA N . 26613 1 511 . 1 . 1 125 125 VAL H H 1 8.17 0.02 . 1 . . . . . 104 VAL H . 26613 1 512 . 1 . 1 125 125 VAL C C 13 176.2 0.3 . 1 . . . . . 104 VAL C . 26613 1 513 . 1 . 1 125 125 VAL CA C 13 61.6 0.3 . 1 . . . . . 104 VAL CA . 26613 1 514 . 1 . 1 125 125 VAL CB C 13 31.8 0.3 . 1 . . . . . 104 VAL CB . 26613 1 515 . 1 . 1 125 125 VAL N N 15 120.0 0.3 . 1 . . . . . 104 VAL N . 26613 1 516 . 1 . 1 126 126 LYS H H 1 8.47 0.02 . 1 . . . . . 105 LYS H . 26613 1 517 . 1 . 1 126 126 LYS C C 13 176.4 0.3 . 1 . . . . . 105 LYS C . 26613 1 518 . 1 . 1 126 126 LYS CA C 13 55.7 0.3 . 1 . . . . . 105 LYS CA . 26613 1 519 . 1 . 1 126 126 LYS CB C 13 32.2 0.3 . 1 . . . . . 105 LYS CB . 26613 1 520 . 1 . 1 126 126 LYS N N 15 125.5 0.3 . 1 . . . . . 105 LYS N . 26613 1 521 . 1 . 1 127 127 SER H H 1 8.44 0.02 . 1 . . . . . 106 SER H . 26613 1 522 . 1 . 1 127 127 SER C C 13 174.5 0.3 . 1 . . . . . 106 SER C . 26613 1 523 . 1 . 1 127 127 SER CA C 13 57.6 0.3 . 1 . . . . . 106 SER CA . 26613 1 524 . 1 . 1 127 127 SER CB C 13 63.2 0.3 . 1 . . . . . 106 SER CB . 26613 1 525 . 1 . 1 127 127 SER N N 15 117.9 0.3 . 1 . . . . . 106 SER N . 26613 1 526 . 1 . 1 128 128 VAL H H 1 8.28 0.02 . 1 . . . . . 107 VAL H . 26613 1 527 . 1 . 1 128 128 VAL C C 13 175.8 0.3 . 1 . . . . . 107 VAL C . 26613 1 528 . 1 . 1 128 128 VAL CA C 13 61.5 0.3 . 1 . . . . . 107 VAL CA . 26613 1 529 . 1 . 1 128 128 VAL CB C 13 31.9 0.3 . 1 . . . . . 107 VAL CB . 26613 1 530 . 1 . 1 128 128 VAL N N 15 121.6 0.3 . 1 . . . . . 107 VAL N . 26613 1 531 . 1 . 1 129 129 ALA H H 1 8.36 0.02 . 1 . . . . . 108 ALA H . 26613 1 532 . 1 . 1 129 129 ALA C C 13 177.4 0.3 . 1 . . . . . 108 ALA C . 26613 1 533 . 1 . 1 129 129 ALA CA C 13 51.9 0.3 . 1 . . . . . 108 ALA CA . 26613 1 534 . 1 . 1 129 129 ALA CB C 13 18.2 0.3 . 1 . . . . . 108 ALA CB . 26613 1 535 . 1 . 1 129 129 ALA N N 15 126.8 0.3 . 1 . . . . . 108 ALA N . 26613 1 536 . 1 . 1 130 130 ASN H H 1 8.44 0.02 . 1 . . . . . 109 ASN H . 26613 1 537 . 1 . 1 130 130 ASN C C 13 175.4 0.3 . 1 . . . . . 109 ASN C . 26613 1 538 . 1 . 1 130 130 ASN CA C 13 52.7 0.3 . 1 . . . . . 109 ASN CA . 26613 1 539 . 1 . 1 130 130 ASN CB C 13 38.2 0.3 . 1 . . . . . 109 ASN CB . 26613 1 540 . 1 . 1 130 130 ASN N N 15 118.0 0.3 . 1 . . . . . 109 ASN N . 26613 1 541 . 1 . 1 131 131 SER H H 1 8.36 0.02 . 1 . . . . . 110 SER H . 26613 1 542 . 1 . 1 131 131 SER C C 13 174.6 0.3 . 1 . . . . . 110 SER C . 26613 1 543 . 1 . 1 131 131 SER CA C 13 58.2 0.3 . 1 . . . . . 110 SER CA . 26613 1 544 . 1 . 1 131 131 SER CB C 13 63.1 0.3 . 1 . . . . . 110 SER CB . 26613 1 545 . 1 . 1 131 131 SER N N 15 116.2 0.3 . 1 . . . . . 110 SER N . 26613 1 546 . 1 . 1 132 132 GLN H H 1 8.47 0.02 . 1 . . . . . 111 GLN H . 26613 1 547 . 1 . 1 132 132 GLN C C 13 175.6 0.3 . 1 . . . . . 111 GLN C . 26613 1 548 . 1 . 1 132 132 GLN CA C 13 55.4 0.3 . 1 . . . . . 111 GLN CA . 26613 1 549 . 1 . 1 132 132 GLN CB C 13 28.7 0.3 . 1 . . . . . 111 GLN CB . 26613 1 550 . 1 . 1 132 132 GLN N N 15 121.3 0.3 . 1 . . . . . 111 GLN N . 26613 1 551 . 1 . 1 133 133 ASP H H 1 8.33 0.02 . 1 . . . . . 112 ASP H . 26613 1 552 . 1 . 1 133 133 ASP C C 13 176.2 0.3 . 1 . . . . . 112 ASP C . 26613 1 553 . 1 . 1 133 133 ASP CA C 13 54.1 0.3 . 1 . . . . . 112 ASP CA . 26613 1 554 . 1 . 1 133 133 ASP CB C 13 40.4 0.3 . 1 . . . . . 112 ASP CB . 26613 1 555 . 1 . 1 133 133 ASP N N 15 121.2 0.3 . 1 . . . . . 112 ASP N . 26613 1 556 . 1 . 1 134 134 ILE H H 1 8.00 0.02 . 1 . . . . . 113 ILE H . 26613 1 557 . 1 . 1 134 134 ILE C C 13 175.7 0.3 . 1 . . . . . 113 ILE C . 26613 1 558 . 1 . 1 134 134 ILE CA C 13 60.8 0.3 . 1 . . . . . 113 ILE CA . 26613 1 559 . 1 . 1 134 134 ILE CB C 13 37.9 0.3 . 1 . . . . . 113 ILE CB . 26613 1 560 . 1 . 1 134 134 ILE N N 15 119.9 0.3 . 1 . . . . . 113 ILE N . 26613 1 561 . 1 . 1 135 135 ASP H H 1 8.38 0.02 . 1 . . . . . 114 ASP H . 26613 1 562 . 1 . 1 135 135 ASP C C 13 175.9 0.3 . 1 . . . . . 114 ASP C . 26613 1 563 . 1 . 1 135 135 ASP CA C 13 53.8 0.3 . 1 . . . . . 114 ASP CA . 26613 1 564 . 1 . 1 135 135 ASP CB C 13 40.5 0.3 . 1 . . . . . 114 ASP CB . 26613 1 565 . 1 . 1 135 135 ASP N N 15 123.2 0.3 . 1 . . . . . 114 ASP N . 26613 1 566 . 1 . 1 136 136 LEU H H 1 8.05 0.02 . 1 . . . . . 115 LEU H . 26613 1 567 . 1 . 1 136 136 LEU C C 13 177.0 0.3 . 1 . . . . . 115 LEU C . 26613 1 568 . 1 . 1 136 136 LEU CA C 13 54.6 0.3 . 1 . . . . . 115 LEU CA . 26613 1 569 . 1 . 1 136 136 LEU CB C 13 41.2 0.3 . 1 . . . . . 115 LEU CB . 26613 1 570 . 1 . 1 136 136 LEU N N 15 122.4 0.3 . 1 . . . . . 115 LEU N . 26613 1 571 . 1 . 1 137 137 VAL H H 1 8.25 0.02 . 1 . . . . . 116 VAL H . 26613 1 572 . 1 . 1 137 137 VAL C C 13 176.2 0.3 . 1 . . . . . 116 VAL C . 26613 1 573 . 1 . 1 137 137 VAL CA C 13 61.8 0.3 . 1 . . . . . 116 VAL CA . 26613 1 574 . 1 . 1 137 137 VAL CB C 13 31.5 0.3 . 1 . . . . . 116 VAL CB . 26613 1 575 . 1 . 1 137 137 VAL N N 15 122.5 0.3 . 1 . . . . . 116 VAL N . 26613 1 576 . 1 . 1 138 138 VAL H H 1 8.25 0.02 . 1 . . . . . 117 VAL H . 26613 1 577 . 1 . 1 138 138 VAL C C 13 175.7 0.3 . 1 . . . . . 117 VAL C . 26613 1 578 . 1 . 1 138 138 VAL CA C 13 61.5 0.3 . 1 . . . . . 117 VAL CA . 26613 1 579 . 1 . 1 138 138 VAL CB C 13 32.0 0.3 . 1 . . . . . 117 VAL CB . 26613 1 580 . 1 . 1 138 138 VAL N N 15 124.3 0.3 . 1 . . . . . 117 VAL N . 26613 1 581 . 1 . 1 139 139 ASP H H 1 8.40 0.02 . 1 . . . . . 118 ASP H . 26613 1 582 . 1 . 1 139 139 ASP C C 13 176.3 0.3 . 1 . . . . . 118 ASP C . 26613 1 583 . 1 . 1 139 139 ASP CA C 13 53.4 0.3 . 1 . . . . . 118 ASP CA . 26613 1 584 . 1 . 1 139 139 ASP CB C 13 40.8 0.3 . 1 . . . . . 118 ASP CB . 26613 1 585 . 1 . 1 139 139 ASP N N 15 124.1 0.3 . 1 . . . . . 118 ASP N . 26613 1 586 . 1 . 1 140 140 ALA H H 1 8.41 0.02 . 1 . . . . . 119 ALA H . 26613 1 587 . 1 . 1 140 140 ALA C C 13 177.8 0.3 . 1 . . . . . 119 ALA C . 26613 1 588 . 1 . 1 140 140 ALA CA C 13 52.8 0.3 . 1 . . . . . 119 ALA CA . 26613 1 589 . 1 . 1 140 140 ALA CB C 13 17.9 0.3 . 1 . . . . . 119 ALA CB . 26613 1 590 . 1 . 1 140 140 ALA N N 15 125.3 0.3 . 1 . . . . . 119 ALA N . 26613 1 591 . 1 . 1 141 141 ASN H H 1 8.42 0.02 . 1 . . . . . 120 ASN H . 26613 1 592 . 1 . 1 141 141 ASN C C 13 175.0 0.3 . 1 . . . . . 120 ASN C . 26613 1 593 . 1 . 1 141 141 ASN CA C 13 52.8 0.3 . 1 . . . . . 120 ASN CA . 26613 1 594 . 1 . 1 141 141 ASN CB C 13 38.1 0.3 . 1 . . . . . 120 ASN CB . 26613 1 595 . 1 . 1 141 141 ASN N N 15 116.0 0.3 . 1 . . . . . 120 ASN N . 26613 1 596 . 1 . 1 142 142 ALA H H 1 7.90 0.02 . 1 . . . . . 121 ALA H . 26613 1 597 . 1 . 1 142 142 ALA C C 13 177.4 0.3 . 1 . . . . . 121 ALA C . 26613 1 598 . 1 . 1 142 142 ALA CA C 13 52.0 0.3 . 1 . . . . . 121 ALA CA . 26613 1 599 . 1 . 1 142 142 ALA CB C 13 18.2 0.3 . 1 . . . . . 121 ALA CB . 26613 1 600 . 1 . 1 142 142 ALA N N 15 123.4 0.3 . 1 . . . . . 121 ALA N . 26613 1 601 . 1 . 1 143 143 VAL H H 1 7.97 0.02 . 1 . . . . . 122 VAL H . 26613 1 602 . 1 . 1 143 143 VAL C C 13 175.7 0.3 . 1 . . . . . 122 VAL C . 26613 1 603 . 1 . 1 143 143 VAL CA C 13 61.5 0.3 . 1 . . . . . 122 VAL CA . 26613 1 604 . 1 . 1 143 143 VAL CB C 13 31.8 0.3 . 1 . . . . . 122 VAL CB . 26613 1 605 . 1 . 1 143 143 VAL N N 15 118.9 0.3 . 1 . . . . . 122 VAL N . 26613 1 606 . 1 . 1 144 144 ALA H H 1 8.26 0.02 . 1 . . . . . 123 ALA H . 26613 1 607 . 1 . 1 144 144 ALA C C 13 177.2 0.3 . 1 . . . . . 123 ALA C . 26613 1 608 . 1 . 1 144 144 ALA CA C 13 51.5 0.3 . 1 . . . . . 123 ALA CA . 26613 1 609 . 1 . 1 144 144 ALA CB C 13 18.3 0.3 . 1 . . . . . 123 ALA CB . 26613 1 610 . 1 . 1 144 144 ALA N N 15 127.0 0.3 . 1 . . . . . 123 ALA N . 26613 1 611 . 1 . 1 145 145 TYR H H 1 8.20 0.02 . 1 . . . . . 124 TYR H . 26613 1 612 . 1 . 1 145 145 TYR C C 13 175.5 0.3 . 1 . . . . . 124 TYR C . 26613 1 613 . 1 . 1 145 145 TYR CA C 13 57.5 0.3 . 1 . . . . . 124 TYR CA . 26613 1 614 . 1 . 1 145 145 TYR CB C 13 38.0 0.3 . 1 . . . . . 124 TYR CB . 26613 1 615 . 1 . 1 145 145 TYR N N 15 120.1 0.3 . 1 . . . . . 124 TYR N . 26613 1 616 . 1 . 1 146 146 ASN H H 1 8.44 0.02 . 1 . . . . . 125 ASN H . 26613 1 617 . 1 . 1 146 146 ASN C C 13 175.1 0.3 . 1 . . . . . 125 ASN C . 26613 1 618 . 1 . 1 146 146 ASN CA C 13 52.4 0.3 . 1 . . . . . 125 ASN CA . 26613 1 619 . 1 . 1 146 146 ASN CB C 13 38.4 0.3 . 1 . . . . . 125 ASN CB . 26613 1 620 . 1 . 1 146 146 ASN N N 15 121.0 0.3 . 1 . . . . . 125 ASN N . 26613 1 621 . 1 . 1 147 147 SER H H 1 8.35 0.02 . 1 . . . . . 126 SER H . 26613 1 622 . 1 . 1 147 147 SER C C 13 174.7 0.3 . 1 . . . . . 126 SER C . 26613 1 623 . 1 . 1 147 147 SER CA C 13 58.1 0.3 . 1 . . . . . 126 SER CA . 26613 1 624 . 1 . 1 147 147 SER CB C 13 63.2 0.3 . 1 . . . . . 126 SER CB . 26613 1 625 . 1 . 1 147 147 SER N N 15 116.8 0.3 . 1 . . . . . 126 SER N . 26613 1 626 . 1 . 1 148 148 SER H H 1 8.39 0.02 . 1 . . . . . 127 SER H . 26613 1 627 . 1 . 1 148 148 SER C C 13 174.2 0.3 . 1 . . . . . 127 SER C . 26613 1 628 . 1 . 1 148 148 SER CA C 13 58.1 0.3 . 1 . . . . . 127 SER CA . 26613 1 629 . 1 . 1 148 148 SER CB C 13 63.1 0.3 . 1 . . . . . 127 SER CB . 26613 1 630 . 1 . 1 148 148 SER N N 15 117.2 0.3 . 1 . . . . . 127 SER N . 26613 1 631 . 1 . 1 149 149 ASP H H 1 8.31 0.02 . 1 . . . . . 128 ASP H . 26613 1 632 . 1 . 1 149 149 ASP C C 13 176.1 0.3 . 1 . . . . . 128 ASP C . 26613 1 633 . 1 . 1 149 149 ASP CA C 13 53.9 0.3 . 1 . . . . . 128 ASP CA . 26613 1 634 . 1 . 1 149 149 ASP CB C 13 40.6 0.3 . 1 . . . . . 128 ASP CB . 26613 1 635 . 1 . 1 149 149 ASP N N 15 122.2 0.3 . 1 . . . . . 128 ASP N . 26613 1 636 . 1 . 1 150 150 VAL H H 1 8.00 0.02 . 1 . . . . . 129 VAL H . 26613 1 637 . 1 . 1 150 150 VAL C C 13 176.1 0.3 . 1 . . . . . 129 VAL C . 26613 1 638 . 1 . 1 150 150 VAL CA C 13 61.7 0.3 . 1 . . . . . 129 VAL CA . 26613 1 639 . 1 . 1 150 150 VAL CB C 13 31.5 0.3 . 1 . . . . . 129 VAL CB . 26613 1 640 . 1 . 1 150 150 VAL N N 15 120.2 0.3 . 1 . . . . . 129 VAL N . 26613 1 641 . 1 . 1 151 151 LYS H H 1 8.41 0.02 . 1 . . . . . 130 LYS H . 26613 1 642 . 1 . 1 151 151 LYS C C 13 176.2 0.3 . 1 . . . . . 130 LYS C . 26613 1 643 . 1 . 1 151 151 LYS CA C 13 55.8 0.3 . 1 . . . . . 130 LYS CA . 26613 1 644 . 1 . 1 151 151 LYS CB C 13 32.2 0.3 . 1 . . . . . 130 LYS CB . 26613 1 645 . 1 . 1 151 151 LYS N N 15 124.9 0.3 . 1 . . . . . 130 LYS N . 26613 1 646 . 1 . 1 152 152 ASP H H 1 8.38 0.02 . 1 . . . . . 131 ASP H . 26613 1 647 . 1 . 1 152 152 ASP C C 13 176.4 0.3 . 1 . . . . . 131 ASP C . 26613 1 648 . 1 . 1 152 152 ASP CA C 13 53.6 0.3 . 1 . . . . . 131 ASP CA . 26613 1 649 . 1 . 1 152 152 ASP CB C 13 40.5 0.3 . 1 . . . . . 131 ASP CB . 26613 1 650 . 1 . 1 152 152 ASP N N 15 121.5 0.3 . 1 . . . . . 131 ASP N . 26613 1 651 . 1 . 1 153 153 ILE H H 1 8.21 0.02 . 1 . . . . . 132 ILE H . 26613 1 652 . 1 . 1 153 153 ILE C C 13 176.5 0.3 . 1 . . . . . 132 ILE C . 26613 1 653 . 1 . 1 153 153 ILE CA C 13 61.2 0.3 . 1 . . . . . 132 ILE CA . 26613 1 654 . 1 . 1 153 153 ILE CB C 13 37.6 0.3 . 1 . . . . . 132 ILE CB . 26613 1 655 . 1 . 1 153 153 ILE N N 15 121.1 0.3 . 1 . . . . . 132 ILE N . 26613 1 656 . 1 . 1 154 154 THR H H 1 8.23 0.02 . 1 . . . . . 133 THR H . 26613 1 657 . 1 . 1 154 154 THR C C 13 174.4 0.3 . 1 . . . . . 133 THR C . 26613 1 658 . 1 . 1 154 154 THR CA C 13 61.5 0.3 . 1 . . . . . 133 THR CA . 26613 1 659 . 1 . 1 154 154 THR CB C 13 69.3 0.3 . 1 . . . . . 133 THR CB . 26613 1 660 . 1 . 1 154 154 THR N N 15 116.8 0.3 . 1 . . . . . 133 THR N . 26613 1 661 . 1 . 1 155 155 ALA H H 1 8.14 0.02 . 1 . . . . . 134 ALA H . 26613 1 662 . 1 . 1 155 155 ALA C C 13 177.3 0.3 . 1 . . . . . 134 ALA C . 26613 1 663 . 1 . 1 155 155 ALA CA C 13 51.9 0.3 . 1 . . . . . 134 ALA CA . 26613 1 664 . 1 . 1 155 155 ALA CB C 13 18.3 0.3 . 1 . . . . . 134 ALA CB . 26613 1 665 . 1 . 1 155 155 ALA N N 15 125.4 0.3 . 1 . . . . . 134 ALA N . 26613 1 666 . 1 . 1 156 156 ASP H H 1 8.29 0.02 . 1 . . . . . 135 ASP H . 26613 1 667 . 1 . 1 156 156 ASP C C 13 176.4 0.3 . 1 . . . . . 135 ASP C . 26613 1 668 . 1 . 1 156 156 ASP CA C 13 53.8 0.3 . 1 . . . . . 135 ASP CA . 26613 1 669 . 1 . 1 156 156 ASP CB C 13 40.6 0.3 . 1 . . . . . 135 ASP CB . 26613 1 670 . 1 . 1 156 156 ASP N N 15 119.7 0.3 . 1 . . . . . 135 ASP N . 26613 1 671 . 1 . 1 157 157 VAL H H 1 8.01 0.02 . 1 . . . . . 136 VAL H . 26613 1 672 . 1 . 1 157 157 VAL C C 13 176.2 0.3 . 1 . . . . . 136 VAL C . 26613 1 673 . 1 . 1 157 157 VAL CA C 13 61.8 0.3 . 1 . . . . . 136 VAL CA . 26613 1 674 . 1 . 1 157 157 VAL CB C 13 31.5 0.3 . 1 . . . . . 136 VAL CB . 26613 1 675 . 1 . 1 157 157 VAL N N 15 119.7 0.3 . 1 . . . . . 136 VAL N . 26613 1 676 . 1 . 1 158 158 LEU H H 1 8.25 0.02 . 1 . . . . . 137 LEU H . 26613 1 677 . 1 . 1 158 158 LEU C C 13 177.3 0.3 . 1 . . . . . 137 LEU C . 26613 1 678 . 1 . 1 158 158 LEU CA C 13 54.6 0.3 . 1 . . . . . 137 LEU CA . 26613 1 679 . 1 . 1 158 158 LEU CB C 13 40.9 0.3 . 1 . . . . . 137 LEU CB . 26613 1 680 . 1 . 1 158 158 LEU N N 15 124.6 0.3 . 1 . . . . . 137 LEU N . 26613 1 681 . 1 . 1 159 159 LYS H H 1 8.31 0.02 . 1 . . . . . 138 LYS H . 26613 1 682 . 1 . 1 159 159 LYS C C 13 176.6 0.3 . 1 . . . . . 138 LYS C . 26613 1 683 . 1 . 1 159 159 LYS CA C 13 55.8 0.3 . 1 . . . . . 138 LYS CA . 26613 1 684 . 1 . 1 159 159 LYS CB C 13 32.0 0.3 . 1 . . . . . 138 LYS CB . 26613 1 685 . 1 . 1 159 159 LYS N N 15 122.5 0.3 . 1 . . . . . 138 LYS N . 26613 1 686 . 1 . 1 160 160 GLN H H 1 8.44 0.02 . 1 . . . . . 139 GLN H . 26613 1 687 . 1 . 1 160 160 GLN C C 13 175.8 0.3 . 1 . . . . . 139 GLN C . 26613 1 688 . 1 . 1 160 160 GLN CA C 13 55.2 0.3 . 1 . . . . . 139 GLN CA . 26613 1 689 . 1 . 1 160 160 GLN CB C 13 28.8 0.3 . 1 . . . . . 139 GLN CB . 26613 1 690 . 1 . 1 160 160 GLN N N 15 122.0 0.3 . 1 . . . . . 139 GLN N . 26613 1 691 . 1 . 1 161 161 VAL H H 1 8.31 0.02 . 1 . . . . . 140 VAL H . 26613 1 692 . 1 . 1 161 161 VAL C C 13 175.2 0.3 . 1 . . . . . 140 VAL C . 26613 1 693 . 1 . 1 161 161 VAL CA C 13 61.7 0.3 . 1 . . . . . 140 VAL CA . 26613 1 694 . 1 . 1 161 161 VAL CB C 13 31.9 0.3 . 1 . . . . . 140 VAL CB . 26613 1 695 . 1 . 1 161 161 VAL N N 15 122.3 0.3 . 1 . . . . . 140 VAL N . 26613 1 696 . 1 . 1 162 162 LYS H H 1 8.06 0.02 . 1 . . . . . 141 LYS H . 26613 1 697 . 1 . 1 162 162 LYS CA C 13 57.4 0.3 . 1 . . . . . 141 LYS CA . 26613 1 698 . 1 . 1 162 162 LYS CB C 13 32.7 0.3 . 1 . . . . . 141 LYS CB . 26613 1 699 . 1 . 1 162 162 LYS N N 15 130.0 0.3 . 1 . . . . . 141 LYS N . 26613 1 stop_ save_