data_26967 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 26967 _Entry.Title ; Assignments of Dictyostelium GlcNAc-Skp1 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2016-12-07 _Entry.Accession_date 2016-12-07 _Entry.Last_release_date 2016-12-07 _Entry.Original_release_date 2016-12-07 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.0.16 _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 ; Assignemtns of HN,N,C,Ca,Cb,CD1/HD1 of ILE, and methyls in VAL and LEU of GlcNAc-Skp1 ; 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 Xianzhong Xu . . . . 26967 2 Alexander Eletsky . . . . 26967 3 'M. Osman' Sheikh . . . . 26967 4 James Prestegard . H. . . 26967 5 Christopher West . M. . . 26967 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . 'Department of Biochemistry and Molecular Biology, University of Georgia' . 26967 2 . 'Complex Carbohydrate Research Center,University of Georgia' . 26967 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 26967 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 476 26967 '15N chemical shifts' 136 26967 '1H chemical shifts' 273 26967 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2018-02-09 . original BMRB . 26967 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 26968 'Dictyostelium Skp1' 26967 stop_ save_ ############### # Citations # ############### save_1 _Citation.Sf_category citations _Citation.Sf_framecode 1 _Citation.Entry_ID 26967 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 29251491 _Citation.Full_citation . _Citation.Title ; Glycosylation Promotes the Random Coil to Helix Transition in a Region of a Protist Skp1 Associated with F-Box Binding.' ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev Biochemistry _Citation.Journal_name_full Biochemistry _Citation.Journal_volume 57 _Citation.Journal_issue 5 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _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 511 _Citation.Page_last 515 _Citation.Year 2018 _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 Xianzhong Xu . . . . 26967 1 2 Alexander Eletsky . . . . 26967 1 3 'M. Osman' Sheikh . . . . 26967 1 4 James Prestegard . H. . . 26967 1 5 Christopher West . M. . . 26967 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 26967 _Assembly.ID 1 _Assembly.Name GlcNAc-Skp1 _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 18794 _Assembly.Enzyme_commission_number . _Assembly.Details 'Proline-163 modified with O-GlcNAc' _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 GlcNAc-Skp1 1 $GlcNAc-Skp1 A . yes native no no . . . 26967 1 stop_ loop_ _Assembly_bio_function.Biological_function _Assembly_bio_function.Entry_ID _Assembly_bio_function.Assembly_ID ; Part of Skp1/Cullin-1/F-box protein(SCF) complex involved in ubiquitin degradation. ; 26967 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_GlcNAc-Skp1 _Entity.Sf_category entity _Entity.Sf_framecode GlcNAc-Skp1 _Entity.Entry_ID 26967 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name GlcNAc-Skp1 _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 ; SLVKLESSDEKVFEIEKEIA CMSVTIKNMIEDIGESDSPI PLPNVTSTILEKVLDYCRHH HQHPSPQGDDKKDEKRLDDI PPYDRDFCKVDQPTLFELIL AANYLDIKPLLDVTCKTVAN MIRGKTPEEIRKIFNIKNDF TPEEEEQIRKENEWCEDKGG N ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 161 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _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 ; First Methionine was cleaved. Pro163 was hydroxylated and modified with GlcNAc ; _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 2 SER . 26967 1 2 3 LEU . 26967 1 3 4 VAL . 26967 1 4 5 LYS . 26967 1 5 6 LEU . 26967 1 6 7 GLU . 26967 1 7 8 SER . 26967 1 8 9 SER . 26967 1 9 10 ASP . 26967 1 10 11 GLU . 26967 1 11 12 LYS . 26967 1 12 13 VAL . 26967 1 13 14 PHE . 26967 1 14 15 GLU . 26967 1 15 16 ILE . 26967 1 16 17 GLU . 26967 1 17 18 LYS . 26967 1 18 19 GLU . 26967 1 19 20 ILE . 26967 1 20 21 ALA . 26967 1 21 22 CYS . 26967 1 22 23 MET . 26967 1 23 24 SER . 26967 1 24 25 VAL . 26967 1 25 26 THR . 26967 1 26 27 ILE . 26967 1 27 28 LYS . 26967 1 28 29 ASN . 26967 1 29 30 MET . 26967 1 30 31 ILE . 26967 1 31 32 GLU . 26967 1 32 33 ASP . 26967 1 33 34 ILE . 26967 1 34 35 GLY . 26967 1 35 36 GLU . 26967 1 36 37 SER . 26967 1 37 38 ASP . 26967 1 38 39 SER . 26967 1 39 40 PRO . 26967 1 40 41 ILE . 26967 1 41 42 PRO . 26967 1 42 43 LEU . 26967 1 43 44 PRO . 26967 1 44 45 ASN . 26967 1 45 46 VAL . 26967 1 46 47 THR . 26967 1 47 48 SER . 26967 1 48 49 THR . 26967 1 49 50 ILE . 26967 1 50 51 LEU . 26967 1 51 52 GLU . 26967 1 52 53 LYS . 26967 1 53 54 VAL . 26967 1 54 55 LEU . 26967 1 55 56 ASP . 26967 1 56 57 TYR . 26967 1 57 58 CYS . 26967 1 58 59 ARG . 26967 1 59 60 HIS . 26967 1 60 61 HIS . 26967 1 61 62 HIS . 26967 1 62 63 GLN . 26967 1 63 64 HIS . 26967 1 64 65 PRO . 26967 1 65 66 SER . 26967 1 66 67 PRO . 26967 1 67 68 GLN . 26967 1 68 69 GLY . 26967 1 69 70 ASP . 26967 1 70 71 ASP . 26967 1 71 72 LYS . 26967 1 72 73 LYS . 26967 1 73 74 ASP . 26967 1 74 75 GLU . 26967 1 75 76 LYS . 26967 1 76 77 ARG . 26967 1 77 78 LEU . 26967 1 78 79 ASP . 26967 1 79 80 ASP . 26967 1 80 81 ILE . 26967 1 81 82 PRO . 26967 1 82 83 PRO . 26967 1 83 84 TYR . 26967 1 84 85 ASP . 26967 1 85 86 ARG . 26967 1 86 87 ASP . 26967 1 87 88 PHE . 26967 1 88 89 CYS . 26967 1 89 90 LYS . 26967 1 90 91 VAL . 26967 1 91 92 ASP . 26967 1 92 93 GLN . 26967 1 93 94 PRO . 26967 1 94 95 THR . 26967 1 95 96 LEU . 26967 1 96 97 PHE . 26967 1 97 98 GLU . 26967 1 98 99 LEU . 26967 1 99 100 ILE . 26967 1 100 101 LEU . 26967 1 101 102 ALA . 26967 1 102 103 ALA . 26967 1 103 104 ASN . 26967 1 104 105 TYR . 26967 1 105 106 LEU . 26967 1 106 107 ASP . 26967 1 107 108 ILE . 26967 1 108 109 LYS . 26967 1 109 110 PRO . 26967 1 110 111 LEU . 26967 1 111 112 LEU . 26967 1 112 113 ASP . 26967 1 113 114 VAL . 26967 1 114 115 THR . 26967 1 115 116 CYS . 26967 1 116 117 LYS . 26967 1 117 118 THR . 26967 1 118 119 VAL . 26967 1 119 120 ALA . 26967 1 120 121 ASN . 26967 1 121 122 MET . 26967 1 122 123 ILE . 26967 1 123 124 ARG . 26967 1 124 125 GLY . 26967 1 125 126 LYS . 26967 1 126 127 THR . 26967 1 127 128 PRO . 26967 1 128 129 GLU . 26967 1 129 130 GLU . 26967 1 130 131 ILE . 26967 1 131 132 ARG . 26967 1 132 133 LYS . 26967 1 133 134 ILE . 26967 1 134 135 PHE . 26967 1 135 136 ASN . 26967 1 136 137 ILE . 26967 1 137 138 LYS . 26967 1 138 139 ASN . 26967 1 139 140 ASP . 26967 1 140 141 PHE . 26967 1 141 142 THR . 26967 1 142 143 PRO . 26967 1 143 144 GLU . 26967 1 144 145 GLU . 26967 1 145 146 GLU . 26967 1 146 147 GLU . 26967 1 147 148 GLN . 26967 1 148 149 ILE . 26967 1 149 150 ARG . 26967 1 150 151 LYS . 26967 1 151 152 GLU . 26967 1 152 153 ASN . 26967 1 153 154 GLU . 26967 1 154 155 TRP . 26967 1 155 156 CYS . 26967 1 156 157 GLU . 26967 1 157 158 ASP . 26967 1 158 159 LYS . 26967 1 159 160 GLY . 26967 1 160 161 GLY . 26967 1 161 162 ASN . 26967 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 26967 1 . LEU 2 2 26967 1 . VAL 3 3 26967 1 . LYS 4 4 26967 1 . LEU 5 5 26967 1 . GLU 6 6 26967 1 . SER 7 7 26967 1 . SER 8 8 26967 1 . ASP 9 9 26967 1 . GLU 10 10 26967 1 . LYS 11 11 26967 1 . VAL 12 12 26967 1 . PHE 13 13 26967 1 . GLU 14 14 26967 1 . ILE 15 15 26967 1 . GLU 16 16 26967 1 . LYS 17 17 26967 1 . GLU 18 18 26967 1 . ILE 19 19 26967 1 . ALA 20 20 26967 1 . CYS 21 21 26967 1 . MET 22 22 26967 1 . SER 23 23 26967 1 . VAL 24 24 26967 1 . THR 25 25 26967 1 . ILE 26 26 26967 1 . LYS 27 27 26967 1 . ASN 28 28 26967 1 . MET 29 29 26967 1 . ILE 30 30 26967 1 . GLU 31 31 26967 1 . ASP 32 32 26967 1 . ILE 33 33 26967 1 . GLY 34 34 26967 1 . GLU 35 35 26967 1 . SER 36 36 26967 1 . ASP 37 37 26967 1 . SER 38 38 26967 1 . PRO 39 39 26967 1 . ILE 40 40 26967 1 . PRO 41 41 26967 1 . LEU 42 42 26967 1 . PRO 43 43 26967 1 . ASN 44 44 26967 1 . VAL 45 45 26967 1 . THR 46 46 26967 1 . SER 47 47 26967 1 . THR 48 48 26967 1 . ILE 49 49 26967 1 . LEU 50 50 26967 1 . GLU 51 51 26967 1 . LYS 52 52 26967 1 . VAL 53 53 26967 1 . LEU 54 54 26967 1 . ASP 55 55 26967 1 . TYR 56 56 26967 1 . CYS 57 57 26967 1 . ARG 58 58 26967 1 . HIS 59 59 26967 1 . HIS 60 60 26967 1 . HIS 61 61 26967 1 . GLN 62 62 26967 1 . HIS 63 63 26967 1 . PRO 64 64 26967 1 . SER 65 65 26967 1 . PRO 66 66 26967 1 . GLN 67 67 26967 1 . GLY 68 68 26967 1 . ASP 69 69 26967 1 . ASP 70 70 26967 1 . LYS 71 71 26967 1 . LYS 72 72 26967 1 . ASP 73 73 26967 1 . GLU 74 74 26967 1 . LYS 75 75 26967 1 . ARG 76 76 26967 1 . LEU 77 77 26967 1 . ASP 78 78 26967 1 . ASP 79 79 26967 1 . ILE 80 80 26967 1 . PRO 81 81 26967 1 . PRO 82 82 26967 1 . TYR 83 83 26967 1 . ASP 84 84 26967 1 . ARG 85 85 26967 1 . ASP 86 86 26967 1 . PHE 87 87 26967 1 . CYS 88 88 26967 1 . LYS 89 89 26967 1 . VAL 90 90 26967 1 . ASP 91 91 26967 1 . GLN 92 92 26967 1 . PRO 93 93 26967 1 . THR 94 94 26967 1 . LEU 95 95 26967 1 . PHE 96 96 26967 1 . GLU 97 97 26967 1 . LEU 98 98 26967 1 . ILE 99 99 26967 1 . LEU 100 100 26967 1 . ALA 101 101 26967 1 . ALA 102 102 26967 1 . ASN 103 103 26967 1 . TYR 104 104 26967 1 . LEU 105 105 26967 1 . ASP 106 106 26967 1 . ILE 107 107 26967 1 . LYS 108 108 26967 1 . PRO 109 109 26967 1 . LEU 110 110 26967 1 . LEU 111 111 26967 1 . ASP 112 112 26967 1 . VAL 113 113 26967 1 . THR 114 114 26967 1 . CYS 115 115 26967 1 . LYS 116 116 26967 1 . THR 117 117 26967 1 . VAL 118 118 26967 1 . ALA 119 119 26967 1 . ASN 120 120 26967 1 . MET 121 121 26967 1 . ILE 122 122 26967 1 . ARG 123 123 26967 1 . GLY 124 124 26967 1 . LYS 125 125 26967 1 . THR 126 126 26967 1 . PRO 127 127 26967 1 . GLU 128 128 26967 1 . GLU 129 129 26967 1 . ILE 130 130 26967 1 . ARG 131 131 26967 1 . LYS 132 132 26967 1 . ILE 133 133 26967 1 . PHE 134 134 26967 1 . ASN 135 135 26967 1 . ILE 136 136 26967 1 . LYS 137 137 26967 1 . ASN 138 138 26967 1 . ASP 139 139 26967 1 . PHE 140 140 26967 1 . THR 141 141 26967 1 . PRO 142 142 26967 1 . GLU 143 143 26967 1 . GLU 144 144 26967 1 . GLU 145 145 26967 1 . GLU 146 146 26967 1 . GLN 147 147 26967 1 . ILE 148 148 26967 1 . ARG 149 149 26967 1 . LYS 150 150 26967 1 . GLU 151 151 26967 1 . ASN 152 152 26967 1 . GLU 153 153 26967 1 . TRP 154 154 26967 1 . CYS 155 155 26967 1 . GLU 156 156 26967 1 . ASP 157 157 26967 1 . LYS 158 158 26967 1 . GLY 159 159 26967 1 . GLY 160 160 26967 1 . ASN 161 161 26967 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 26967 _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 $GlcNAc-Skp1 . 44689 organism . 'Dictyostelium discoideum' '"cellular slime molds' . . Eukaryota . Dictyostelium discoideum . . . . . . . . . . . . . 26967 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 26967 _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 $GlcNAc-Skp1 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . pET19b-Skp1-P4H1 . . . 26967 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_ILV_GlcNAc_Skp1 _Sample.Sf_category sample _Sample.Sf_framecode ILV_GlcNAc_Skp1 _Sample.Entry_ID 26967 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details 'Perdeuterated,and with methyl groups of Val,Leu, and Ile(CD1/HD1) protonated' _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 GlcNAc-Skp1 '[U-13C; U-15N; U-2H] and methyls of I(CD1/HD1)LV protonated' . . 1 $GlcNAc-Skp1 . . 1 . . mM . . . . 26967 1 2 'sodium phosphate' 'natural abundance' . . . . . . 20 . . mM . . . . 26967 1 3 'sodium chloride' 'natural abundance' . . . . . . 50 . . mM . . . . 26967 1 4 'sodium azide' 'natural abundance' . . . . . . 0.05% . . w/w . . . . 26967 1 5 DSS 'natural abundance' . . . . . . 50 . . uM . . . . 26967 1 6 'magnesium chloride' 'natural abundance' . . . . . . 1 . . mM . . . . 26967 1 7 TCEP 'natural abundance' . . . . . . 1 . . mM . . . . 26967 1 8 D2O '[U-100% 2H]' . . . . . . 10% . . v/v . . . . 26967 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 26967 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 7.0 . pH 26967 1 pressure 1 . atm 26967 1 temperature 308.2 . K 26967 1 stop_ save_ ############################ # Computer software used # ############################ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 26967 _Software.ID 2 _Software.Type . _Software.Name NMRPipe _Software.Version linux212_64 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 26967 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 26967 2 stop_ save_ save_CARA _Software.Sf_category software _Software.Sf_framecode CARA _Software.Entry_ID 26967 _Software.ID 3 _Software.Type . _Software.Name CARA _Software.Version cara1.2.4 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Keller and Wuthrich' . . 26967 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 26967 3 'data analysis' 26967 3 'peak picking' 26967 3 stop_ save_ save_SPARKY _Software.Sf_category software _Software.Sf_framecode SPARKY _Software.Entry_ID 26967 _Software.ID 4 _Software.Type . _Software.Name SPARKY _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'TD Goddard and DG Kneller' . . 26967 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 26967 4 stop_ save_ save_VNMRJ _Software.Sf_category software _Software.Sf_framecode VNMRJ _Software.Entry_ID 26967 _Software.ID 1 _Software.Type . _Software.Name VNMRJ _Software.Version 4.2 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Agilent . . 26967 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 26967 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 26967 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Agilent _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 900 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 26967 _NMR_spectrometer_list.ID 1 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 Agilent INOVA . 900 . . . 26967 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 26967 _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 $ILV_GlcNAc_Skp1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26967 1 2 '2D 1H-15N HSQC(TROSY)' no . . . . . . . . . . 1 $ILV_GlcNAc_Skp1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26967 1 3 '2D ct-1H-13C HSQC aliphatic' no . . . . . . . . . . 1 $ILV_GlcNAc_Skp1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26967 1 4 '3D TROSY-HNCA' no . . . . . . . . . . 1 $ILV_GlcNAc_Skp1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26967 1 5 '3D TROSY-HNCO' no . . . . . . . . . . 1 $ILV_GlcNAc_Skp1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26967 1 6 '3D TROSY-HNCACB' no . . . . . . . . . . 1 $ILV_GlcNAc_Skp1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26967 1 7 '3D TROSY-HN(CO)CA' no . . . . . . . . . . 1 $ILV_GlcNAc_Skp1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26967 1 8 '3D TROSY-HN(COCA)CB' no . . . . . . . . . . 1 $ILV_GlcNAc_Skp1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26967 1 9 '3D HMCM(CG)CBCA' no . . . . . . . . . . 1 $ILV_GlcNAc_Skp1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26967 1 10 '3D TROSY-HN(CA)CO' no . . . . . . . . . . 1 $ILV_GlcNAc_Skp1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26967 1 11 '3D 15N/13Cali/13Caro-resolved-1H-1H NOESY' no . . . . . . . . . . 1 $ILV_GlcNAc_Skp1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26967 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 26967 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details 'Used DSS as reference' 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 'In the sample' . . . . 26967 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 'In the sample' . . . . 26967 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 'in the sample' . . . . 26967 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 26967 _Assigned_chem_shift_list.ID 1 _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' . . . 26967 1 2 '2D 1H-15N HSQC(TROSY)' . . . 26967 1 3 '2D ct-1H-13C HSQC aliphatic' . . . 26967 1 4 '3D TROSY-HNCA' . . . 26967 1 5 '3D TROSY-HNCO' . . . 26967 1 6 '3D TROSY-HNCACB' . . . 26967 1 7 '3D TROSY-HN(CO)CA' . . . 26967 1 8 '3D TROSY-HN(COCA)CB' . . . 26967 1 9 '3D HMCM(CG)CBCA' . . . 26967 1 10 '3D TROSY-HN(CA)CO' . . . 26967 1 11 '3D 15N/13Cali/13Caro-resolved-1H-1H NOESY' . . . 26967 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $VNMRJ . . 26967 1 2 $NMRPipe . . 26967 1 3 $CARA . . 26967 1 4 $SPARKY . . 26967 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 2 2 LEU HD11 H 1 0.699 0.020 . 2 . . . . . 3 LEU HD1 . 26967 1 2 . 1 1 2 2 LEU HD12 H 1 0.699 0.020 . 2 . . . . . 3 LEU HD1 . 26967 1 3 . 1 1 2 2 LEU HD13 H 1 0.699 0.020 . 2 . . . . . 3 LEU HD1 . 26967 1 4 . 1 1 2 2 LEU HD21 H 1 0.806 0.020 . 2 . . . . . 3 LEU HD2 . 26967 1 5 . 1 1 2 2 LEU HD22 H 1 0.806 0.020 . 2 . . . . . 3 LEU HD2 . 26967 1 6 . 1 1 2 2 LEU HD23 H 1 0.806 0.020 . 2 . . . . . 3 LEU HD2 . 26967 1 7 . 1 1 2 2 LEU C C 13 176.921 0.1 . 1 . . . . . 3 LEU C . 26967 1 8 . 1 1 2 2 LEU CA C 13 54.196 0.1 . 1 . . . . . 3 LEU CA . 26967 1 9 . 1 1 2 2 LEU CB C 13 42.503 0.1 . 1 . . . . . 3 LEU CB . 26967 1 10 . 1 1 2 2 LEU CG C 13 26.239 0.1 . 1 . . . . . 3 LEU CG . 26967 1 11 . 1 1 2 2 LEU CD1 C 13 22.988 0.1 . 2 . . . . . 3 LEU CD1 . 26967 1 12 . 1 1 2 2 LEU CD2 C 13 25.165 0.1 . 2 . . . . . 3 LEU CD2 . 26967 1 13 . 1 1 3 3 VAL H H 1 9.062 0.020 . 1 . . . . . 4 VAL H . 26967 1 14 . 1 1 3 3 VAL HG11 H 1 0.819 0.020 . 2 . . . . . 4 VAL HG1 . 26967 1 15 . 1 1 3 3 VAL HG12 H 1 0.819 0.020 . 2 . . . . . 4 VAL HG1 . 26967 1 16 . 1 1 3 3 VAL HG13 H 1 0.819 0.020 . 2 . . . . . 4 VAL HG1 . 26967 1 17 . 1 1 3 3 VAL HG21 H 1 0.806 0.020 . 2 . . . . . 4 VAL HG2 . 26967 1 18 . 1 1 3 3 VAL HG22 H 1 0.806 0.020 . 2 . . . . . 4 VAL HG2 . 26967 1 19 . 1 1 3 3 VAL HG23 H 1 0.806 0.020 . 2 . . . . . 4 VAL HG2 . 26967 1 20 . 1 1 3 3 VAL C C 13 173.486 0.1 . 1 . . . . . 4 VAL C . 26967 1 21 . 1 1 3 3 VAL CA C 13 59.812 0.1 . 1 . . . . . 4 VAL CA . 26967 1 22 . 1 1 3 3 VAL CB C 13 33.823 0.1 . 1 . . . . . 4 VAL CB . 26967 1 23 . 1 1 3 3 VAL CG1 C 13 21.035 0.1 . 2 . . . . . 4 VAL CG1 . 26967 1 24 . 1 1 3 3 VAL CG2 C 13 20.325 0.1 . 2 . . . . . 4 VAL CG2 . 26967 1 25 . 1 1 3 3 VAL N N 15 119.682 0.1 . 1 . . . . . 4 VAL N . 26967 1 26 . 1 1 4 4 LYS H H 1 8.385 0.020 . 1 . . . . . 5 LYS H . 26967 1 27 . 1 1 4 4 LYS C C 13 175.162 0.1 . 1 . . . . . 5 LYS C . 26967 1 28 . 1 1 4 4 LYS CA C 13 54.310 0.1 . 1 . . . . . 5 LYS CA . 26967 1 29 . 1 1 4 4 LYS CB C 13 33.813 0.1 . 1 . . . . . 5 LYS CB . 26967 1 30 . 1 1 4 4 LYS N N 15 121.635 0.1 . 1 . . . . . 5 LYS N . 26967 1 31 . 1 1 5 5 LEU H H 1 9.124 0.020 . 1 . . . . . 6 LEU H . 26967 1 32 . 1 1 5 5 LEU HD11 H 1 0.826 0.020 . 2 . . . . . 6 LEU HD1 . 26967 1 33 . 1 1 5 5 LEU HD12 H 1 0.826 0.020 . 2 . . . . . 6 LEU HD1 . 26967 1 34 . 1 1 5 5 LEU HD13 H 1 0.826 0.020 . 2 . . . . . 6 LEU HD1 . 26967 1 35 . 1 1 5 5 LEU HD21 H 1 0.858 0.020 . 2 . . . . . 6 LEU HD2 . 26967 1 36 . 1 1 5 5 LEU HD22 H 1 0.858 0.020 . 2 . . . . . 6 LEU HD2 . 26967 1 37 . 1 1 5 5 LEU HD23 H 1 0.858 0.020 . 2 . . . . . 6 LEU HD2 . 26967 1 38 . 1 1 5 5 LEU C C 13 174.921 0.1 . 1 . . . . . 6 LEU C . 26967 1 39 . 1 1 5 5 LEU CA C 13 52.299 0.1 . 1 . . . . . 6 LEU CA . 26967 1 40 . 1 1 5 5 LEU CB C 13 44.153 0.1 . 1 . . . . . 6 LEU CB . 26967 1 41 . 1 1 5 5 LEU CD1 C 13 26.666 0.1 . 2 . . . . . 6 LEU CD1 . 26967 1 42 . 1 1 5 5 LEU CD2 C 13 23.443 0.1 . 2 . . . . . 6 LEU CD2 . 26967 1 43 . 1 1 5 5 LEU N N 15 122.141 0.1 . 1 . . . . . 6 LEU N . 26967 1 44 . 1 1 6 6 GLU H H 1 8.871 0.020 . 1 . . . . . 7 GLU H . 26967 1 45 . 1 1 6 6 GLU C C 13 175.157 0.1 . 1 . . . . . 7 GLU C . 26967 1 46 . 1 1 6 6 GLU CA C 13 53.553 0.1 . 1 . . . . . 7 GLU CA . 26967 1 47 . 1 1 6 6 GLU CB C 13 32.581 0.1 . 1 . . . . . 7 GLU CB . 26967 1 48 . 1 1 6 6 GLU N N 15 123.836 0.1 . 1 . . . . . 7 GLU N . 26967 1 49 . 1 1 7 7 SER H H 1 9.037 0.020 . 1 . . . . . 8 SER H . 26967 1 50 . 1 1 7 7 SER HG H 1 5.571 0.020 . 1 . . . . . 8 SER HG . 26967 1 51 . 1 1 7 7 SER C C 13 176.802 0.1 . 1 . . . . . 8 SER C . 26967 1 52 . 1 1 7 7 SER CA C 13 58.204 0.1 . 1 . . . . . 8 SER CA . 26967 1 53 . 1 1 7 7 SER CB C 13 64.536 0.1 . 1 . . . . . 8 SER CB . 26967 1 54 . 1 1 7 7 SER N N 15 119.631 0.1 . 1 . . . . . 8 SER N . 26967 1 55 . 1 1 8 8 SER H H 1 9.359 0.020 . 1 . . . . . 9 SER H . 26967 1 56 . 1 1 8 8 SER C C 13 174.947 0.1 . 1 . . . . . 9 SER C . 26967 1 57 . 1 1 8 8 SER CA C 13 61.193 0.1 . 1 . . . . . 9 SER CA . 26967 1 58 . 1 1 8 8 SER CB C 13 62.327 0.1 . 1 . . . . . 9 SER CB . 26967 1 59 . 1 1 8 8 SER N N 15 118.174 0.1 . 1 . . . . . 9 SER N . 26967 1 60 . 1 1 9 9 ASP H H 1 9.219 0.020 . 1 . . . . . 10 ASP H . 26967 1 61 . 1 1 9 9 ASP C C 13 174.249 0.1 . 1 . . . . . 10 ASP C . 26967 1 62 . 1 1 9 9 ASP CA C 13 52.177 0.1 . 1 . . . . . 10 ASP CA . 26967 1 63 . 1 1 9 9 ASP CB C 13 36.601 0.1 . 1 . . . . . 10 ASP CB . 26967 1 64 . 1 1 9 9 ASP N N 15 116.463 0.1 . 1 . . . . . 10 ASP N . 26967 1 65 . 1 1 10 10 GLU H H 1 8.009 0.020 . 1 . . . . . 11 GLU H . 26967 1 66 . 1 1 10 10 GLU C C 13 174.937 0.1 . 1 . . . . . 11 GLU C . 26967 1 67 . 1 1 10 10 GLU CA C 13 57.443 0.1 . 1 . . . . . 11 GLU CA . 26967 1 68 . 1 1 10 10 GLU CB C 13 25.416 0.1 . 1 . . . . . 11 GLU CB . 26967 1 69 . 1 1 10 10 GLU N N 15 112.337 0.1 . 1 . . . . . 11 GLU N . 26967 1 70 . 1 1 11 11 LYS H H 1 7.213 0.020 . 1 . . . . . 12 LYS H . 26967 1 71 . 1 1 11 11 LYS C C 13 174.787 0.1 . 1 . . . . . 12 LYS C . 26967 1 72 . 1 1 11 11 LYS CA C 13 54.519 0.1 . 1 . . . . . 12 LYS CA . 26967 1 73 . 1 1 11 11 LYS CB C 13 32.242 0.1 . 1 . . . . . 12 LYS CB . 26967 1 74 . 1 1 11 11 LYS N N 15 118.525 0.1 . 1 . . . . . 12 LYS N . 26967 1 75 . 1 1 12 12 VAL H H 1 8.102 0.020 . 1 . . . . . 13 VAL H . 26967 1 76 . 1 1 12 12 VAL HG11 H 1 0.846 0.020 . 2 . . . . . 13 VAL HG1 . 26967 1 77 . 1 1 12 12 VAL HG12 H 1 0.846 0.020 . 2 . . . . . 13 VAL HG1 . 26967 1 78 . 1 1 12 12 VAL HG13 H 1 0.846 0.020 . 2 . . . . . 13 VAL HG1 . 26967 1 79 . 1 1 12 12 VAL HG21 H 1 0.786 0.020 . 2 . . . . . 13 VAL HG2 . 26967 1 80 . 1 1 12 12 VAL HG22 H 1 0.786 0.020 . 2 . . . . . 13 VAL HG2 . 26967 1 81 . 1 1 12 12 VAL HG23 H 1 0.786 0.020 . 2 . . . . . 13 VAL HG2 . 26967 1 82 . 1 1 12 12 VAL C C 13 175.844 0.1 . 1 . . . . . 13 VAL C . 26967 1 83 . 1 1 12 12 VAL CA C 13 60.957 0.1 . 1 . . . . . 13 VAL CA . 26967 1 84 . 1 1 12 12 VAL CB C 13 32.429 0.1 . 1 . . . . . 13 VAL CB . 26967 1 85 . 1 1 12 12 VAL CG1 C 13 21.903 0.1 . 2 . . . . . 13 VAL CG1 . 26967 1 86 . 1 1 12 12 VAL CG2 C 13 21.493 0.1 . 2 . . . . . 13 VAL CG2 . 26967 1 87 . 1 1 12 12 VAL N N 15 122.141 0.1 . 1 . . . . . 13 VAL N . 26967 1 88 . 1 1 13 13 PHE H H 1 9.492 0.020 . 1 . . . . . 14 PHE H . 26967 1 89 . 1 1 13 13 PHE C C 13 174.257 0.1 . 1 . . . . . 14 PHE C . 26967 1 90 . 1 1 13 13 PHE CA C 13 56.168 0.1 . 1 . . . . . 14 PHE CA . 26967 1 91 . 1 1 13 13 PHE CB C 13 41.130 0.1 . 1 . . . . . 14 PHE CB . 26967 1 92 . 1 1 13 13 PHE N N 15 127.338 0.1 . 1 . . . . . 14 PHE N . 26967 1 93 . 1 1 14 14 GLU H H 1 8.624 0.020 . 1 . . . . . 15 GLU H . 26967 1 94 . 1 1 14 14 GLU C C 13 175.472 0.1 . 1 . . . . . 15 GLU C . 26967 1 95 . 1 1 14 14 GLU CA C 13 54.478 0.1 . 1 . . . . . 15 GLU CA . 26967 1 96 . 1 1 14 14 GLU CB C 13 30.994 0.1 . 1 . . . . . 15 GLU CB . 26967 1 97 . 1 1 14 14 GLU N N 15 121.934 0.1 . 1 . . . . . 15 GLU N . 26967 1 98 . 1 1 15 15 ILE H H 1 9.011 0.020 . 1 . . . . . 16 ILE H . 26967 1 99 . 1 1 15 15 ILE HD11 H 1 0.941 0.020 . 1 . . . . . 16 ILE HD1 . 26967 1 100 . 1 1 15 15 ILE HD12 H 1 0.941 0.020 . 1 . . . . . 16 ILE HD1 . 26967 1 101 . 1 1 15 15 ILE HD13 H 1 0.941 0.020 . 1 . . . . . 16 ILE HD1 . 26967 1 102 . 1 1 15 15 ILE C C 13 172.463 0.1 . 1 . . . . . 16 ILE C . 26967 1 103 . 1 1 15 15 ILE CA C 13 57.902 0.1 . 1 . . . . . 16 ILE CA . 26967 1 104 . 1 1 15 15 ILE CB C 13 41.794 0.1 . 1 . . . . . 16 ILE CB . 26967 1 105 . 1 1 15 15 ILE CG1 C 13 27.307 0.1 . 1 . . . . . 16 ILE CG1 . 26967 1 106 . 1 1 15 15 ILE CD1 C 13 15.004 0.1 . 1 . . . . . 16 ILE CD1 . 26967 1 107 . 1 1 15 15 ILE N N 15 122.742 0.1 . 1 . . . . . 16 ILE N . 26967 1 108 . 1 1 16 16 GLU H H 1 9.189 0.020 . 1 . . . . . 17 GLU H . 26967 1 109 . 1 1 16 16 GLU C C 13 178.298 0.1 . 1 . . . . . 17 GLU C . 26967 1 110 . 1 1 16 16 GLU CA C 13 57.984 0.1 . 1 . . . . . 17 GLU CA . 26967 1 111 . 1 1 16 16 GLU CB C 13 28.277 0.1 . 1 . . . . . 17 GLU CB . 26967 1 112 . 1 1 16 16 GLU N N 15 126.303 0.1 . 1 . . . . . 17 GLU N . 26967 1 113 . 1 1 17 17 LYS H H 1 8.915 0.020 . 1 . . . . . 18 LYS H . 26967 1 114 . 1 1 17 17 LYS C C 13 177.701 0.1 . 1 . . . . . 18 LYS C . 26967 1 115 . 1 1 17 17 LYS CA C 13 60.416 0.1 . 1 . . . . . 18 LYS CA . 26967 1 116 . 1 1 17 17 LYS CB C 13 31.736 0.1 . 1 . . . . . 18 LYS CB . 26967 1 117 . 1 1 17 17 LYS N N 15 125.890 0.1 . 1 . . . . . 18 LYS N . 26967 1 118 . 1 1 18 18 GLU H H 1 9.450 0.020 . 1 . . . . . 19 GLU H . 26967 1 119 . 1 1 18 18 GLU C C 13 177.792 0.1 . 1 . . . . . 19 GLU C . 26967 1 120 . 1 1 18 18 GLU CA C 13 59.159 0.1 . 1 . . . . . 19 GLU CA . 26967 1 121 . 1 1 18 18 GLU CB C 13 28.213 0.1 . 1 . . . . . 19 GLU CB . 26967 1 122 . 1 1 18 18 GLU N N 15 115.152 0.1 . 1 . . . . . 19 GLU N . 26967 1 123 . 1 1 19 19 ILE H H 1 6.749 0.020 . 1 . . . . . 20 ILE H . 26967 1 124 . 1 1 19 19 ILE HD11 H 1 0.729 0.020 . 1 . . . . . 20 ILE HD1 . 26967 1 125 . 1 1 19 19 ILE HD12 H 1 0.729 0.020 . 1 . . . . . 20 ILE HD1 . 26967 1 126 . 1 1 19 19 ILE HD13 H 1 0.729 0.020 . 1 . . . . . 20 ILE HD1 . 26967 1 127 . 1 1 19 19 ILE C C 13 177.261 0.1 . 1 . . . . . 20 ILE C . 26967 1 128 . 1 1 19 19 ILE CA C 13 63.369 0.1 . 1 . . . . . 20 ILE CA . 26967 1 129 . 1 1 19 19 ILE CB C 13 36.270 0.1 . 1 . . . . . 20 ILE CB . 26967 1 130 . 1 1 19 19 ILE CG1 C 13 27.145 0.1 . 1 . . . . . 20 ILE CG1 . 26967 1 131 . 1 1 19 19 ILE CG2 C 13 22.459 0.1 . 1 . . . . . 20 ILE CG2 . 26967 1 132 . 1 1 19 19 ILE CD1 C 13 12.754 0.1 . 1 . . . . . 20 ILE CD1 . 26967 1 133 . 1 1 19 19 ILE N N 15 116.012 0.1 . 1 . . . . . 20 ILE N . 26967 1 134 . 1 1 20 20 ALA H H 1 7.608 0.020 . 1 . . . . . 21 ALA H . 26967 1 135 . 1 1 20 20 ALA C C 13 178.427 0.1 . 1 . . . . . 21 ALA C . 26967 1 136 . 1 1 20 20 ALA CA C 13 54.470 0.1 . 1 . . . . . 21 ALA CA . 26967 1 137 . 1 1 20 20 ALA CB C 13 17.284 0.1 . 1 . . . . . 21 ALA CB . 26967 1 138 . 1 1 20 20 ALA N N 15 120.145 0.1 . 1 . . . . . 21 ALA N . 26967 1 139 . 1 1 21 21 CYS H H 1 7.734 0.020 . 1 . . . . . 22 CYS H . 26967 1 140 . 1 1 21 21 CYS C C 13 173.762 0.1 . 1 . . . . . 22 CYS C . 26967 1 141 . 1 1 21 21 CYS CA C 13 62.053 0.1 . 1 . . . . . 22 CYS CA . 26967 1 142 . 1 1 21 21 CYS CB C 13 26.316 0.1 . 1 . . . . . 22 CYS CB . 26967 1 143 . 1 1 21 21 CYS N N 15 107.270 0.1 . 1 . . . . . 22 CYS N . 26967 1 144 . 1 1 22 22 MET H H 1 7.569 0.020 . 1 . . . . . 23 MET H . 26967 1 145 . 1 1 22 22 MET C C 13 177.244 0.1 . 1 . . . . . 23 MET C . 26967 1 146 . 1 1 22 22 MET CA C 13 58.314 0.1 . 1 . . . . . 23 MET CA . 26967 1 147 . 1 1 22 22 MET CB C 13 31.974 0.1 . 1 . . . . . 23 MET CB . 26967 1 148 . 1 1 22 22 MET N N 15 118.762 0.1 . 1 . . . . . 23 MET N . 26967 1 149 . 1 1 23 23 SER H H 1 7.491 0.020 . 1 . . . . . 24 SER H . 26967 1 150 . 1 1 23 23 SER HG H 1 6.981 0.020 . 1 . . . . . 24 SER HG . 26967 1 151 . 1 1 23 23 SER C C 13 174.339 0.1 . 1 . . . . . 24 SER C . 26967 1 152 . 1 1 23 23 SER CA C 13 55.196 0.1 . 1 . . . . . 24 SER CA . 26967 1 153 . 1 1 23 23 SER CB C 13 61.927 0.1 . 1 . . . . . 24 SER CB . 26967 1 154 . 1 1 23 23 SER N N 15 109.835 0.1 . 1 . . . . . 24 SER N . 26967 1 155 . 1 1 24 24 VAL H H 1 7.992 0.020 . 1 . . . . . 25 VAL H . 26967 1 156 . 1 1 24 24 VAL HG11 H 1 0.998 0.020 . 2 . . . . . 25 VAL HG1 . 26967 1 157 . 1 1 24 24 VAL HG12 H 1 0.998 0.020 . 2 . . . . . 25 VAL HG1 . 26967 1 158 . 1 1 24 24 VAL HG13 H 1 0.998 0.020 . 2 . . . . . 25 VAL HG1 . 26967 1 159 . 1 1 24 24 VAL HG21 H 1 1.153 0.020 . 2 . . . . . 25 VAL HG2 . 26967 1 160 . 1 1 24 24 VAL HG22 H 1 1.153 0.020 . 2 . . . . . 25 VAL HG2 . 26967 1 161 . 1 1 24 24 VAL HG23 H 1 1.153 0.020 . 2 . . . . . 25 VAL HG2 . 26967 1 162 . 1 1 24 24 VAL C C 13 177.400 0.1 . 1 . . . . . 25 VAL C . 26967 1 163 . 1 1 24 24 VAL CA C 13 66.053 0.1 . 1 . . . . . 25 VAL CA . 26967 1 164 . 1 1 24 24 VAL CB C 13 31.085 0.1 . 1 . . . . . 25 VAL CB . 26967 1 165 . 1 1 24 24 VAL CG1 C 13 21.662 0.1 . 2 . . . . . 25 VAL CG1 . 26967 1 166 . 1 1 24 24 VAL CG2 C 13 23.082 0.1 . 2 . . . . . 25 VAL CG2 . 26967 1 167 . 1 1 24 24 VAL N N 15 131.173 0.1 . 1 . . . . . 25 VAL N . 26967 1 168 . 1 1 25 25 THR H H 1 7.219 0.020 . 1 . . . . . 26 THR H . 26967 1 169 . 1 1 25 25 THR C C 13 176.125 0.1 . 1 . . . . . 26 THR C . 26967 1 170 . 1 1 25 25 THR CA C 13 65.207 0.1 . 1 . . . . . 26 THR CA . 26967 1 171 . 1 1 25 25 THR CB C 13 69.020 0.1 . 1 . . . . . 26 THR CB . 26967 1 172 . 1 1 25 25 THR N N 15 113.993 0.1 . 1 . . . . . 26 THR N . 26967 1 173 . 1 1 26 26 ILE H H 1 8.195 0.020 . 1 . . . . . 27 ILE H . 26967 1 174 . 1 1 26 26 ILE HD11 H 1 0.866 0.020 . 1 . . . . . 27 ILE HD1 . 26967 1 175 . 1 1 26 26 ILE HD12 H 1 0.866 0.020 . 1 . . . . . 27 ILE HD1 . 26967 1 176 . 1 1 26 26 ILE HD13 H 1 0.866 0.020 . 1 . . . . . 27 ILE HD1 . 26967 1 177 . 1 1 26 26 ILE C C 13 176.938 0.1 . 1 . . . . . 27 ILE C . 26967 1 178 . 1 1 26 26 ILE CA C 13 65.241 0.1 . 1 . . . . . 27 ILE CA . 26967 1 179 . 1 1 26 26 ILE CB C 13 35.932 0.1 . 1 . . . . . 27 ILE CB . 26967 1 180 . 1 1 26 26 ILE CD1 C 13 12.447 0.1 . 1 . . . . . 27 ILE CD1 . 26967 1 181 . 1 1 26 26 ILE N N 15 121.601 0.1 . 1 . . . . . 27 ILE N . 26967 1 182 . 1 1 27 27 LYS H H 1 8.567 0.020 . 1 . . . . . 28 LYS H . 26967 1 183 . 1 1 27 27 LYS C C 13 178.863 0.1 . 1 . . . . . 28 LYS C . 26967 1 184 . 1 1 27 27 LYS CA C 13 60.026 0.1 . 1 . . . . . 28 LYS CA . 26967 1 185 . 1 1 27 27 LYS CB C 13 31.541 0.1 . 1 . . . . . 28 LYS CB . 26967 1 186 . 1 1 27 27 LYS N N 15 120.908 0.1 . 1 . . . . . 28 LYS N . 26967 1 187 . 1 1 28 28 ASN H H 1 8.328 0.020 . 1 . . . . . 29 ASN H . 26967 1 188 . 1 1 28 28 ASN HD21 H 1 6.783 0.020 . 2 . . . . . 29 ASN HD21 . 26967 1 189 . 1 1 28 28 ASN HD22 H 1 7.586 0.020 . 2 . . . . . 29 ASN HD22 . 26967 1 190 . 1 1 28 28 ASN C C 13 177.989 0.1 . 1 . . . . . 29 ASN C . 26967 1 191 . 1 1 28 28 ASN CA C 13 55.148 0.1 . 1 . . . . . 29 ASN CA . 26967 1 192 . 1 1 28 28 ASN CB C 13 37.021 0.1 . 1 . . . . . 29 ASN CB . 26967 1 193 . 1 1 28 28 ASN N N 15 115.509 0.1 . 1 . . . . . 29 ASN N . 26967 1 194 . 1 1 28 28 ASN ND2 N 15 111.297 0.1 . 1 . . . . . 29 ASN ND2 . 26967 1 195 . 1 1 29 29 MET H H 1 7.906 0.020 . 1 . . . . . 30 MET H . 26967 1 196 . 1 1 29 29 MET C C 13 178.600 0.1 . 1 . . . . . 30 MET C . 26967 1 197 . 1 1 29 29 MET CA C 13 59.123 0.1 . 1 . . . . . 30 MET CA . 26967 1 198 . 1 1 29 29 MET CB C 13 32.476 0.1 . 1 . . . . . 30 MET CB . 26967 1 199 . 1 1 29 29 MET N N 15 120.121 0.1 . 1 . . . . . 30 MET N . 26967 1 200 . 1 1 30 30 ILE H H 1 8.522 0.020 . 1 . . . . . 31 ILE H . 26967 1 201 . 1 1 30 30 ILE HD11 H 1 0.704 0.020 . 1 . . . . . 31 ILE HD1 . 26967 1 202 . 1 1 30 30 ILE HD12 H 1 0.704 0.020 . 1 . . . . . 31 ILE HD1 . 26967 1 203 . 1 1 30 30 ILE HD13 H 1 0.704 0.020 . 1 . . . . . 31 ILE HD1 . 26967 1 204 . 1 1 30 30 ILE C C 13 178.787 0.1 . 1 . . . . . 31 ILE C . 26967 1 205 . 1 1 30 30 ILE CA C 13 64.487 0.1 . 1 . . . . . 31 ILE CA . 26967 1 206 . 1 1 30 30 ILE CB C 13 37.059 0.1 . 1 . . . . . 31 ILE CB . 26967 1 207 . 1 1 30 30 ILE CG1 C 13 28.141 0.1 . 1 . . . . . 31 ILE CG1 . 26967 1 208 . 1 1 30 30 ILE CD1 C 13 15.063 0.1 . 1 . . . . . 31 ILE CD1 . 26967 1 209 . 1 1 30 30 ILE N N 15 118.387 0.1 . 1 . . . . . 31 ILE N . 26967 1 210 . 1 1 31 31 GLU H H 1 7.794 0.020 . 1 . . . . . 32 GLU H . 26967 1 211 . 1 1 31 31 GLU C C 13 177.971 0.1 . 1 . . . . . 32 GLU C . 26967 1 212 . 1 1 31 31 GLU CA C 13 58.454 0.1 . 1 . . . . . 32 GLU CA . 26967 1 213 . 1 1 31 31 GLU CB C 13 28.440 0.1 . 1 . . . . . 32 GLU CB . 26967 1 214 . 1 1 31 31 GLU N N 15 119.268 0.1 . 1 . . . . . 32 GLU N . 26967 1 215 . 1 1 32 32 ASP H H 1 7.721 0.020 . 1 . . . . . 33 ASP H . 26967 1 216 . 1 1 32 32 ASP C C 13 177.621 0.1 . 1 . . . . . 33 ASP C . 26967 1 217 . 1 1 32 32 ASP CA C 13 55.860 0.1 . 1 . . . . . 33 ASP CA . 26967 1 218 . 1 1 32 32 ASP CB C 13 41.159 0.1 . 1 . . . . . 33 ASP CB . 26967 1 219 . 1 1 32 32 ASP N N 15 117.520 0.1 . 1 . . . . . 33 ASP N . 26967 1 220 . 1 1 33 33 ILE H H 1 8.021 0.020 . 1 . . . . . 34 ILE H . 26967 1 221 . 1 1 33 33 ILE HD11 H 1 0.873 0.020 . 1 . . . . . 34 ILE HD1 . 26967 1 222 . 1 1 33 33 ILE HD12 H 1 0.873 0.020 . 1 . . . . . 34 ILE HD1 . 26967 1 223 . 1 1 33 33 ILE HD13 H 1 0.873 0.020 . 1 . . . . . 34 ILE HD1 . 26967 1 224 . 1 1 33 33 ILE C C 13 177.565 0.1 . 1 . . . . . 34 ILE C . 26967 1 225 . 1 1 33 33 ILE CA C 13 62.339 0.1 . 1 . . . . . 34 ILE CA . 26967 1 226 . 1 1 33 33 ILE CB C 13 38.415 0.1 . 1 . . . . . 34 ILE CB . 26967 1 227 . 1 1 33 33 ILE CD1 C 13 13.730 0.1 . 1 . . . . . 34 ILE CD1 . 26967 1 228 . 1 1 33 33 ILE N N 15 116.779 0.1 . 1 . . . . . 34 ILE N . 26967 1 229 . 1 1 34 34 GLY H H 1 7.949 0.020 . 1 . . . . . 35 GLY H . 26967 1 230 . 1 1 34 34 GLY C C 13 173.772 0.1 . 1 . . . . . 35 GLY C . 26967 1 231 . 1 1 34 34 GLY CA C 13 44.766 0.1 . 1 . . . . . 35 GLY CA . 26967 1 232 . 1 1 34 34 GLY N N 15 109.139 0.1 . 1 . . . . . 35 GLY N . 26967 1 233 . 1 1 35 35 GLU H H 1 8.281 0.020 . 1 . . . . . 36 GLU H . 26967 1 234 . 1 1 35 35 GLU C C 13 176.316 0.1 . 1 . . . . . 36 GLU C . 26967 1 235 . 1 1 35 35 GLU CA C 13 56.028 0.1 . 1 . . . . . 36 GLU CA . 26967 1 236 . 1 1 35 35 GLU CB C 13 28.817 0.1 . 1 . . . . . 36 GLU CB . 26967 1 237 . 1 1 35 35 GLU N N 15 121.012 0.1 . 1 . . . . . 36 GLU N . 26967 1 238 . 1 1 36 36 SER H H 1 8.180 0.020 . 1 . . . . . 37 SER H . 26967 1 239 . 1 1 36 36 SER C C 13 174.122 0.1 . 1 . . . . . 37 SER C . 26967 1 240 . 1 1 36 36 SER CA C 13 57.368 0.1 . 1 . . . . . 37 SER CA . 26967 1 241 . 1 1 36 36 SER CB C 13 63.868 0.1 . 1 . . . . . 37 SER CB . 26967 1 242 . 1 1 36 36 SER N N 15 117.317 0.1 . 1 . . . . . 37 SER N . 26967 1 243 . 1 1 37 37 ASP H H 1 8.542 0.020 . 1 . . . . . 38 ASP H . 26967 1 244 . 1 1 37 37 ASP C C 13 176.211 0.1 . 1 . . . . . 38 ASP C . 26967 1 245 . 1 1 37 37 ASP CA C 13 53.772 0.1 . 1 . . . . . 38 ASP CA . 26967 1 246 . 1 1 37 37 ASP CB C 13 40.441 0.1 . 1 . . . . . 38 ASP CB . 26967 1 247 . 1 1 37 37 ASP N N 15 122.886 0.1 . 1 . . . . . 38 ASP N . 26967 1 248 . 1 1 38 38 SER H H 1 8.054 0.020 . 1 . . . . . 39 SER H . 26967 1 249 . 1 1 38 38 SER C C 13 172.177 0.1 . 1 . . . . . 39 SER C . 26967 1 250 . 1 1 38 38 SER CA C 13 56.469 0.1 . 1 . . . . . 39 SER CA . 26967 1 251 . 1 1 38 38 SER CB C 13 62.506 0.1 . 1 . . . . . 39 SER CB . 26967 1 252 . 1 1 38 38 SER N N 15 116.140 0.1 . 1 . . . . . 39 SER N . 26967 1 253 . 1 1 39 39 PRO C C 13 176.105 0.1 . 1 . . . . . 40 PRO C . 26967 1 254 . 1 1 39 39 PRO CA C 13 61.882 0.1 . 1 . . . . . 40 PRO CA . 26967 1 255 . 1 1 39 39 PRO CB C 13 31.796 0.1 . 1 . . . . . 40 PRO CB . 26967 1 256 . 1 1 40 40 ILE H H 1 8.885 0.020 . 1 . . . . . 41 ILE H . 26967 1 257 . 1 1 40 40 ILE HD11 H 1 0.779 0.020 . 1 . . . . . 41 ILE HD1 . 26967 1 258 . 1 1 40 40 ILE HD12 H 1 0.779 0.020 . 1 . . . . . 41 ILE HD1 . 26967 1 259 . 1 1 40 40 ILE HD13 H 1 0.779 0.020 . 1 . . . . . 41 ILE HD1 . 26967 1 260 . 1 1 40 40 ILE C C 13 173.807 0.1 . 1 . . . . . 41 ILE C . 26967 1 261 . 1 1 40 40 ILE CA C 13 58.316 0.1 . 1 . . . . . 41 ILE CA . 26967 1 262 . 1 1 40 40 ILE CB C 13 38.055 0.1 . 1 . . . . . 41 ILE CB . 26967 1 263 . 1 1 40 40 ILE CD1 C 13 13.210 0.1 . 1 . . . . . 41 ILE CD1 . 26967 1 264 . 1 1 40 40 ILE N N 15 126.146 0.1 . 1 . . . . . 41 ILE N . 26967 1 265 . 1 1 41 41 PRO C C 13 176.326 0.1 . 1 . . . . . 42 PRO C . 26967 1 266 . 1 1 41 41 PRO CA C 13 62.330 0.1 . 1 . . . . . 42 PRO CA . 26967 1 267 . 1 1 41 41 PRO CB C 13 31.272 0.1 . 1 . . . . . 42 PRO CB . 26967 1 268 . 1 1 42 42 LEU H H 1 8.633 0.020 . 1 . . . . . 43 LEU H . 26967 1 269 . 1 1 42 42 LEU HD11 H 1 0.845 0.020 . 2 . . . . . 43 LEU HD1 . 26967 1 270 . 1 1 42 42 LEU HD12 H 1 0.845 0.020 . 2 . . . . . 43 LEU HD1 . 26967 1 271 . 1 1 42 42 LEU HD13 H 1 0.845 0.020 . 2 . . . . . 43 LEU HD1 . 26967 1 272 . 1 1 42 42 LEU HD21 H 1 0.777 0.020 . 2 . . . . . 43 LEU HD2 . 26967 1 273 . 1 1 42 42 LEU HD22 H 1 0.777 0.020 . 2 . . . . . 43 LEU HD2 . 26967 1 274 . 1 1 42 42 LEU HD23 H 1 0.777 0.020 . 2 . . . . . 43 LEU HD2 . 26967 1 275 . 1 1 42 42 LEU C C 13 174.385 0.1 . 1 . . . . . 43 LEU C . 26967 1 276 . 1 1 42 42 LEU CA C 13 50.518 0.1 . 1 . . . . . 43 LEU CA . 26967 1 277 . 1 1 42 42 LEU CB C 13 41.680 0.1 . 1 . . . . . 43 LEU CB . 26967 1 278 . 1 1 42 42 LEU CG C 13 25.160 0.1 . 1 . . . . . 43 LEU CG . 26967 1 279 . 1 1 42 42 LEU CD1 C 13 28.298 0.1 . 2 . . . . . 43 LEU CD1 . 26967 1 280 . 1 1 42 42 LEU CD2 C 13 23.238 0.1 . 2 . . . . . 43 LEU CD2 . 26967 1 281 . 1 1 42 42 LEU N N 15 121.793 0.1 . 1 . . . . . 43 LEU N . 26967 1 282 . 1 1 43 43 PRO C C 13 176.740 0.1 . 1 . . . . . 44 PRO C . 26967 1 283 . 1 1 43 43 PRO CA C 13 63.568 0.1 . 1 . . . . . 44 PRO CA . 26967 1 284 . 1 1 43 43 PRO CB C 13 31.029 0.1 . 1 . . . . . 44 PRO CB . 26967 1 285 . 1 1 44 44 ASN H H 1 6.817 0.020 . 1 . . . . . 45 ASN H . 26967 1 286 . 1 1 44 44 ASN C C 13 173.972 0.1 . 1 . . . . . 45 ASN C . 26967 1 287 . 1 1 44 44 ASN CA C 13 51.947 0.1 . 1 . . . . . 45 ASN CA . 26967 1 288 . 1 1 44 44 ASN CB C 13 37.036 0.1 . 1 . . . . . 45 ASN CB . 26967 1 289 . 1 1 44 44 ASN N N 15 111.548 0.1 . 1 . . . . . 45 ASN N . 26967 1 290 . 1 1 45 45 VAL H H 1 7.585 0.020 . 1 . . . . . 46 VAL H . 26967 1 291 . 1 1 45 45 VAL HG11 H 1 1.080 0.020 . 2 . . . . . 46 VAL HG1 . 26967 1 292 . 1 1 45 45 VAL HG12 H 1 1.080 0.020 . 2 . . . . . 46 VAL HG1 . 26967 1 293 . 1 1 45 45 VAL HG13 H 1 1.080 0.020 . 2 . . . . . 46 VAL HG1 . 26967 1 294 . 1 1 45 45 VAL HG21 H 1 1.056 0.020 . 2 . . . . . 46 VAL HG2 . 26967 1 295 . 1 1 45 45 VAL HG22 H 1 1.056 0.020 . 2 . . . . . 46 VAL HG2 . 26967 1 296 . 1 1 45 45 VAL HG23 H 1 1.056 0.020 . 2 . . . . . 46 VAL HG2 . 26967 1 297 . 1 1 45 45 VAL C C 13 173.468 0.1 . 1 . . . . . 46 VAL C . 26967 1 298 . 1 1 45 45 VAL CA C 13 59.929 0.1 . 1 . . . . . 46 VAL CA . 26967 1 299 . 1 1 45 45 VAL CB C 13 34.241 0.1 . 1 . . . . . 46 VAL CB . 26967 1 300 . 1 1 45 45 VAL CG1 C 13 22.275 0.1 . 2 . . . . . 46 VAL CG1 . 26967 1 301 . 1 1 45 45 VAL CG2 C 13 21.585 0.1 . 2 . . . . . 46 VAL CG2 . 26967 1 302 . 1 1 45 45 VAL N N 15 116.911 0.1 . 1 . . . . . 46 VAL N . 26967 1 303 . 1 1 46 46 THR H H 1 8.273 0.020 . 1 . . . . . 47 THR H . 26967 1 304 . 1 1 46 46 THR C C 13 176.418 0.1 . 1 . . . . . 47 THR C . 26967 1 305 . 1 1 46 46 THR CA C 13 60.980 0.1 . 1 . . . . . 47 THR CA . 26967 1 306 . 1 1 46 46 THR CB C 13 70.709 0.1 . 1 . . . . . 47 THR CB . 26967 1 307 . 1 1 46 46 THR N N 15 117.412 0.1 . 1 . . . . . 47 THR N . 26967 1 308 . 1 1 47 47 SER H H 1 9.815 0.020 . 1 . . . . . 48 SER H . 26967 1 309 . 1 1 47 47 SER C C 13 176.512 0.1 . 1 . . . . . 48 SER C . 26967 1 310 . 1 1 47 47 SER CA C 13 61.690 0.1 . 1 . . . . . 48 SER CA . 26967 1 311 . 1 1 47 47 SER CB C 13 60.493 0.1 . 1 . . . . . 48 SER CB . 26967 1 312 . 1 1 47 47 SER N N 15 117.770 0.1 . 1 . . . . . 48 SER N . 26967 1 313 . 1 1 48 48 THR H H 1 7.772 0.020 . 1 . . . . . 49 THR H . 26967 1 314 . 1 1 48 48 THR C C 13 176.384 0.1 . 1 . . . . . 49 THR C . 26967 1 315 . 1 1 48 48 THR CA C 13 65.190 0.1 . 1 . . . . . 49 THR CA . 26967 1 316 . 1 1 48 48 THR CB C 13 68.208 0.1 . 1 . . . . . 49 THR CB . 26967 1 317 . 1 1 48 48 THR N N 15 115.177 0.1 . 1 . . . . . 49 THR N . 26967 1 318 . 1 1 49 49 ILE H H 1 6.911 0.020 . 1 . . . . . 50 ILE H . 26967 1 319 . 1 1 49 49 ILE HD11 H 1 0.664 0.020 . 1 . . . . . 50 ILE HD1 . 26967 1 320 . 1 1 49 49 ILE HD12 H 1 0.664 0.020 . 1 . . . . . 50 ILE HD1 . 26967 1 321 . 1 1 49 49 ILE HD13 H 1 0.664 0.020 . 1 . . . . . 50 ILE HD1 . 26967 1 322 . 1 1 49 49 ILE C C 13 177.624 0.1 . 1 . . . . . 50 ILE C . 26967 1 323 . 1 1 49 49 ILE CA C 13 59.812 0.1 . 1 . . . . . 50 ILE CA . 26967 1 324 . 1 1 49 49 ILE CB C 13 34.244 0.1 . 1 . . . . . 50 ILE CB . 26967 1 325 . 1 1 49 49 ILE CG1 C 13 25.941 0.1 . 1 . . . . . 50 ILE CG1 . 26967 1 326 . 1 1 49 49 ILE CD1 C 13 8.665 0.1 . 1 . . . . . 50 ILE CD1 . 26967 1 327 . 1 1 49 49 ILE N N 15 119.905 0.1 . 1 . . . . . 50 ILE N . 26967 1 328 . 1 1 50 50 LEU H H 1 9.066 0.020 . 1 . . . . . 51 LEU H . 26967 1 329 . 1 1 50 50 LEU HD11 H 1 0.626 0.020 . 2 . . . . . 51 LEU HD1 . 26967 1 330 . 1 1 50 50 LEU HD12 H 1 0.626 0.020 . 2 . . . . . 51 LEU HD1 . 26967 1 331 . 1 1 50 50 LEU HD13 H 1 0.626 0.020 . 2 . . . . . 51 LEU HD1 . 26967 1 332 . 1 1 50 50 LEU HD21 H 1 0.488 0.020 . 2 . . . . . 51 LEU HD2 . 26967 1 333 . 1 1 50 50 LEU HD22 H 1 0.488 0.020 . 2 . . . . . 51 LEU HD2 . 26967 1 334 . 1 1 50 50 LEU HD23 H 1 0.488 0.020 . 2 . . . . . 51 LEU HD2 . 26967 1 335 . 1 1 50 50 LEU C C 13 177.514 0.1 . 1 . . . . . 51 LEU C . 26967 1 336 . 1 1 50 50 LEU CA C 13 57.191 0.1 . 1 . . . . . 51 LEU CA . 26967 1 337 . 1 1 50 50 LEU CB C 13 39.982 0.1 . 1 . . . . . 51 LEU CB . 26967 1 338 . 1 1 50 50 LEU CD1 C 13 21.480 0.1 . 2 . . . . . 51 LEU CD1 . 26967 1 339 . 1 1 50 50 LEU CD2 C 13 26.146 0.1 . 2 . . . . . 51 LEU CD2 . 26967 1 340 . 1 1 50 50 LEU N N 15 122.062 0.1 . 1 . . . . . 51 LEU N . 26967 1 341 . 1 1 51 51 GLU H H 1 8.430 0.020 . 1 . . . . . 52 GLU H . 26967 1 342 . 1 1 51 51 GLU C C 13 178.527 0.1 . 1 . . . . . 52 GLU C . 26967 1 343 . 1 1 51 51 GLU CA C 13 59.570 0.1 . 1 . . . . . 52 GLU CA . 26967 1 344 . 1 1 51 51 GLU CB C 13 28.985 0.1 . 1 . . . . . 52 GLU CB . 26967 1 345 . 1 1 51 51 GLU N N 15 116.639 0.1 . 1 . . . . . 52 GLU N . 26967 1 346 . 1 1 52 52 LYS H H 1 6.838 0.020 . 1 . . . . . 53 LYS H . 26967 1 347 . 1 1 52 52 LYS C C 13 178.861 0.1 . 1 . . . . . 53 LYS C . 26967 1 348 . 1 1 52 52 LYS CA C 13 58.590 0.1 . 1 . . . . . 53 LYS CA . 26967 1 349 . 1 1 52 52 LYS CB C 13 31.817 0.1 . 1 . . . . . 53 LYS CB . 26967 1 350 . 1 1 52 52 LYS N N 15 117.141 0.1 . 1 . . . . . 53 LYS N . 26967 1 351 . 1 1 53 53 VAL H H 1 8.454 0.020 . 1 . . . . . 54 VAL H . 26967 1 352 . 1 1 53 53 VAL HG11 H 1 0.711 0.020 . 2 . . . . . 54 VAL HG1 . 26967 1 353 . 1 1 53 53 VAL HG12 H 1 0.711 0.020 . 2 . . . . . 54 VAL HG1 . 26967 1 354 . 1 1 53 53 VAL HG13 H 1 0.711 0.020 . 2 . . . . . 54 VAL HG1 . 26967 1 355 . 1 1 53 53 VAL HG21 H 1 0.880 0.020 . 2 . . . . . 54 VAL HG2 . 26967 1 356 . 1 1 53 53 VAL HG22 H 1 0.880 0.020 . 2 . . . . . 54 VAL HG2 . 26967 1 357 . 1 1 53 53 VAL HG23 H 1 0.880 0.020 . 2 . . . . . 54 VAL HG2 . 26967 1 358 . 1 1 53 53 VAL C C 13 178.381 0.1 . 1 . . . . . 54 VAL C . 26967 1 359 . 1 1 53 53 VAL CA C 13 66.572 0.1 . 1 . . . . . 54 VAL CA . 26967 1 360 . 1 1 53 53 VAL CB C 13 31.029 0.1 . 1 . . . . . 54 VAL CB . 26967 1 361 . 1 1 53 53 VAL CG1 C 13 21.602 0.1 . 2 . . . . . 54 VAL CG1 . 26967 1 362 . 1 1 53 53 VAL CG2 C 13 22.750 0.1 . 2 . . . . . 54 VAL CG2 . 26967 1 363 . 1 1 53 53 VAL N N 15 118.747 0.1 . 1 . . . . . 54 VAL N . 26967 1 364 . 1 1 54 54 LEU H H 1 8.827 0.020 . 1 . . . . . 55 LEU H . 26967 1 365 . 1 1 54 54 LEU HD11 H 1 0.544 0.020 . 2 . . . . . 55 LEU HD1 . 26967 1 366 . 1 1 54 54 LEU HD12 H 1 0.544 0.020 . 2 . . . . . 55 LEU HD1 . 26967 1 367 . 1 1 54 54 LEU HD13 H 1 0.544 0.020 . 2 . . . . . 55 LEU HD1 . 26967 1 368 . 1 1 54 54 LEU HD21 H 1 0.597 0.020 . 2 . . . . . 55 LEU HD2 . 26967 1 369 . 1 1 54 54 LEU HD22 H 1 0.597 0.020 . 2 . . . . . 55 LEU HD2 . 26967 1 370 . 1 1 54 54 LEU HD23 H 1 0.597 0.020 . 2 . . . . . 55 LEU HD2 . 26967 1 371 . 1 1 54 54 LEU C C 13 178.988 0.1 . 1 . . . . . 55 LEU C . 26967 1 372 . 1 1 54 54 LEU CA C 13 57.704 0.1 . 1 . . . . . 55 LEU CA . 26967 1 373 . 1 1 54 54 LEU CB C 13 39.288 0.1 . 1 . . . . . 55 LEU CB . 26967 1 374 . 1 1 54 54 LEU CD1 C 13 25.426 0.1 . 2 . . . . . 55 LEU CD1 . 26967 1 375 . 1 1 54 54 LEU CD2 C 13 20.125 0.1 . 2 . . . . . 55 LEU CD2 . 26967 1 376 . 1 1 54 54 LEU N N 15 118.248 0.1 . 1 . . . . . 55 LEU N . 26967 1 377 . 1 1 55 55 ASP H H 1 8.016 0.020 . 1 . . . . . 56 ASP H . 26967 1 378 . 1 1 55 55 ASP C C 13 178.514 0.1 . 1 . . . . . 56 ASP C . 26967 1 379 . 1 1 55 55 ASP CA C 13 57.766 0.1 . 1 . . . . . 56 ASP CA . 26967 1 380 . 1 1 55 55 ASP CB C 13 40.468 0.1 . 1 . . . . . 56 ASP CB . 26967 1 381 . 1 1 55 55 ASP N N 15 120.859 0.1 . 1 . . . . . 56 ASP N . 26967 1 382 . 1 1 56 56 TYR H H 1 8.141 0.020 . 1 . . . . . 57 TYR H . 26967 1 383 . 1 1 56 56 TYR C C 13 178.402 0.1 . 1 . . . . . 57 TYR C . 26967 1 384 . 1 1 56 56 TYR CA C 13 61.602 0.1 . 1 . . . . . 57 TYR CA . 26967 1 385 . 1 1 56 56 TYR CB C 13 36.944 0.1 . 1 . . . . . 57 TYR CB . 26967 1 386 . 1 1 56 56 TYR N N 15 121.551 0.1 . 1 . . . . . 57 TYR N . 26967 1 387 . 1 1 57 57 CYS H H 1 8.481 0.020 . 1 . . . . . 58 CYS H . 26967 1 388 . 1 1 57 57 CYS HG H 1 2.841 0.020 . 1 . . . . . 58 CYS HG . 26967 1 389 . 1 1 57 57 CYS C C 13 176.377 0.1 . 1 . . . . . 58 CYS C . 26967 1 390 . 1 1 57 57 CYS CA C 13 63.743 0.1 . 1 . . . . . 58 CYS CA . 26967 1 391 . 1 1 57 57 CYS CB C 13 26.494 0.1 . 1 . . . . . 58 CYS CB . 26967 1 392 . 1 1 57 57 CYS N N 15 117.259 0.1 . 1 . . . . . 58 CYS N . 26967 1 393 . 1 1 58 58 ARG H H 1 8.718 0.020 . 1 . . . . . 59 ARG H . 26967 1 394 . 1 1 58 58 ARG C C 13 178.376 0.1 . 1 . . . . . 59 ARG C . 26967 1 395 . 1 1 58 58 ARG CA C 13 59.825 0.1 . 1 . . . . . 59 ARG CA . 26967 1 396 . 1 1 58 58 ARG CB C 13 29.111 0.1 . 1 . . . . . 59 ARG CB . 26967 1 397 . 1 1 58 58 ARG N N 15 119.135 0.1 . 1 . . . . . 59 ARG N . 26967 1 398 . 1 1 59 59 HIS H H 1 8.009 0.020 . 1 . . . . . 60 HIS H . 26967 1 399 . 1 1 59 59 HIS C C 13 177.368 0.1 . 1 . . . . . 60 HIS C . 26967 1 400 . 1 1 59 59 HIS CA C 13 59.885 0.1 . 1 . . . . . 60 HIS CA . 26967 1 401 . 1 1 59 59 HIS CB C 13 28.354 0.1 . 1 . . . . . 60 HIS CB . 26967 1 402 . 1 1 59 59 HIS N N 15 117.053 0.1 . 1 . . . . . 60 HIS N . 26967 1 403 . 1 1 60 60 HIS H H 1 7.957 0.020 . 1 . . . . . 61 HIS H . 26967 1 404 . 1 1 60 60 HIS C C 13 176.110 0.1 . 1 . . . . . 61 HIS C . 26967 1 405 . 1 1 60 60 HIS CA C 13 58.733 0.1 . 1 . . . . . 61 HIS CA . 26967 1 406 . 1 1 60 60 HIS CB C 13 28.610 0.1 . 1 . . . . . 61 HIS CB . 26967 1 407 . 1 1 60 60 HIS N N 15 115.623 0.1 . 1 . . . . . 61 HIS N . 26967 1 408 . 1 1 61 61 HIS H H 1 8.232 0.020 . 1 . . . . . 62 HIS H . 26967 1 409 . 1 1 61 61 HIS C C 13 176.057 0.1 . 1 . . . . . 62 HIS C . 26967 1 410 . 1 1 61 61 HIS CA C 13 58.715 0.1 . 1 . . . . . 62 HIS CA . 26967 1 411 . 1 1 61 61 HIS CB C 13 30.196 0.1 . 1 . . . . . 62 HIS CB . 26967 1 412 . 1 1 61 61 HIS N N 15 119.315 0.1 . 1 . . . . . 62 HIS N . 26967 1 413 . 1 1 62 62 GLN H H 1 7.493 0.020 . 1 . . . . . 63 GLN H . 26967 1 414 . 1 1 62 62 GLN C C 13 175.217 0.1 . 1 . . . . . 63 GLN C . 26967 1 415 . 1 1 62 62 GLN CA C 13 55.811 0.1 . 1 . . . . . 63 GLN CA . 26967 1 416 . 1 1 62 62 GLN CB C 13 28.445 0.1 . 1 . . . . . 63 GLN CB . 26967 1 417 . 1 1 62 62 GLN N N 15 115.494 0.1 . 1 . . . . . 63 GLN N . 26967 1 418 . 1 1 63 63 HIS H H 1 7.600 0.020 . 1 . . . . . 64 HIS H . 26967 1 419 . 1 1 63 63 HIS C C 13 171.971 0.1 . 1 . . . . . 64 HIS C . 26967 1 420 . 1 1 63 63 HIS CA C 13 52.997 0.1 . 1 . . . . . 64 HIS CA . 26967 1 421 . 1 1 63 63 HIS CB C 13 28.351 0.1 . 1 . . . . . 64 HIS CB . 26967 1 422 . 1 1 63 63 HIS N N 15 117.640 0.1 . 1 . . . . . 64 HIS N . 26967 1 423 . 1 1 64 64 PRO C C 13 177.091 0.1 . 1 . . . . . 65 PRO C . 26967 1 424 . 1 1 64 64 PRO CA C 13 62.824 0.1 . 1 . . . . . 65 PRO CA . 26967 1 425 . 1 1 65 65 SER H H 1 8.434 0.020 . 1 . . . . . 66 SER H . 26967 1 426 . 1 1 65 65 SER CA C 13 55.976 0.1 . 1 . . . . . 66 SER CA . 26967 1 427 . 1 1 65 65 SER CB C 13 62.611 0.1 . 1 . . . . . 66 SER CB . 26967 1 428 . 1 1 65 65 SER N N 15 117.019 0.1 . 1 . . . . . 66 SER N . 26967 1 429 . 1 1 66 66 PRO C C 13 176.950 0.1 . 1 . . . . . 67 PRO C . 26967 1 430 . 1 1 66 66 PRO CA C 13 62.894 0.1 . 1 . . . . . 67 PRO CA . 26967 1 431 . 1 1 67 67 GLN H H 1 8.440 0.020 . 1 . . . . . 68 GLN H . 26967 1 432 . 1 1 67 67 GLN C C 13 176.455 0.1 . 1 . . . . . 68 GLN C . 26967 1 433 . 1 1 67 67 GLN CA C 13 55.347 0.1 . 1 . . . . . 68 GLN CA . 26967 1 434 . 1 1 67 67 GLN CB C 13 28.828 0.1 . 1 . . . . . 68 GLN CB . 26967 1 435 . 1 1 67 67 GLN N N 15 120.007 0.1 . 1 . . . . . 68 GLN N . 26967 1 436 . 1 1 68 68 GLY H H 1 8.331 0.020 . 1 . . . . . 69 GLY H . 26967 1 437 . 1 1 68 68 GLY C C 13 173.943 0.1 . 1 . . . . . 69 GLY C . 26967 1 438 . 1 1 68 68 GLY CA C 13 44.964 0.1 . 1 . . . . . 69 GLY CA . 26967 1 439 . 1 1 68 68 GLY N N 15 109.516 0.1 . 1 . . . . . 69 GLY N . 26967 1 440 . 1 1 69 69 ASP H H 1 8.269 0.020 . 1 . . . . . 70 ASP H . 26967 1 441 . 1 1 69 69 ASP C C 13 176.059 0.1 . 1 . . . . . 70 ASP C . 26967 1 442 . 1 1 69 69 ASP CA C 13 54.051 0.1 . 1 . . . . . 70 ASP CA . 26967 1 443 . 1 1 69 69 ASP CB C 13 40.608 0.1 . 1 . . . . . 70 ASP CB . 26967 1 444 . 1 1 69 69 ASP N N 15 120.340 0.1 . 1 . . . . . 70 ASP N . 26967 1 445 . 1 1 70 70 ASP H H 1 8.316 0.020 . 1 . . . . . 71 ASP H . 26967 1 446 . 1 1 70 70 ASP C C 13 176.361 0.1 . 1 . . . . . 71 ASP C . 26967 1 447 . 1 1 70 70 ASP CA C 13 54.129 0.1 . 1 . . . . . 71 ASP CA . 26967 1 448 . 1 1 70 70 ASP CB C 13 40.223 0.1 . 1 . . . . . 71 ASP CB . 26967 1 449 . 1 1 70 70 ASP N N 15 119.761 0.1 . 1 . . . . . 71 ASP N . 26967 1 450 . 1 1 71 71 LYS H H 1 8.132 0.020 . 1 . . . . . 72 LYS H . 26967 1 451 . 1 1 71 71 LYS C C 13 176.775 0.1 . 1 . . . . . 72 LYS C . 26967 1 452 . 1 1 71 71 LYS CA C 13 55.832 0.1 . 1 . . . . . 72 LYS CA . 26967 1 453 . 1 1 71 71 LYS CB C 13 31.334 0.1 . 1 . . . . . 72 LYS CB . 26967 1 454 . 1 1 71 71 LYS N N 15 120.364 0.1 . 1 . . . . . 72 LYS N . 26967 1 455 . 1 1 72 72 LYS H H 1 8.148 0.020 . 1 . . . . . 73 LYS H . 26967 1 456 . 1 1 72 72 LYS C C 13 176.361 0.1 . 1 . . . . . 73 LYS C . 26967 1 457 . 1 1 72 72 LYS CA C 13 56.233 0.1 . 1 . . . . . 73 LYS CA . 26967 1 458 . 1 1 72 72 LYS CB C 13 31.707 0.1 . 1 . . . . . 73 LYS CB . 26967 1 459 . 1 1 72 72 LYS N N 15 121.021 0.1 . 1 . . . . . 73 LYS N . 26967 1 460 . 1 1 73 73 ASP H H 1 8.239 0.020 . 1 . . . . . 74 ASP H . 26967 1 461 . 1 1 73 73 ASP C C 13 176.260 0.1 . 1 . . . . . 74 ASP C . 26967 1 462 . 1 1 73 73 ASP CA C 13 53.961 0.1 . 1 . . . . . 74 ASP CA . 26967 1 463 . 1 1 73 73 ASP CB C 13 40.497 0.1 . 1 . . . . . 74 ASP CB . 26967 1 464 . 1 1 73 73 ASP N N 15 120.128 0.1 . 1 . . . . . 74 ASP N . 26967 1 465 . 1 1 74 74 GLU H H 1 8.261 0.020 . 1 . . . . . 75 GLU H . 26967 1 466 . 1 1 74 74 GLU C C 13 176.393 0.1 . 1 . . . . . 75 GLU C . 26967 1 467 . 1 1 74 74 GLU CA C 13 56.447 0.1 . 1 . . . . . 75 GLU CA . 26967 1 468 . 1 1 74 74 GLU CB C 13 29.353 0.1 . 1 . . . . . 75 GLU CB . 26967 1 469 . 1 1 74 74 GLU N N 15 121.006 0.1 . 1 . . . . . 75 GLU N . 26967 1 470 . 1 1 75 75 LYS H H 1 8.264 0.020 . 1 . . . . . 76 LYS H . 26967 1 471 . 1 1 75 75 LYS C C 13 176.518 0.1 . 1 . . . . . 76 LYS C . 26967 1 472 . 1 1 75 75 LYS CA C 13 55.848 0.1 . 1 . . . . . 76 LYS CA . 26967 1 473 . 1 1 75 75 LYS CB C 13 31.460 0.1 . 1 . . . . . 76 LYS CB . 26967 1 474 . 1 1 75 75 LYS N N 15 120.998 0.1 . 1 . . . . . 76 LYS N . 26967 1 475 . 1 1 76 76 ARG H H 1 8.189 0.020 . 1 . . . . . 77 ARG H . 26967 1 476 . 1 1 76 76 ARG C C 13 176.447 0.1 . 1 . . . . . 77 ARG C . 26967 1 477 . 1 1 76 76 ARG CA C 13 55.535 0.1 . 1 . . . . . 77 ARG CA . 26967 1 478 . 1 1 76 76 ARG CB C 13 29.768 0.1 . 1 . . . . . 77 ARG CB . 26967 1 479 . 1 1 76 76 ARG N N 15 121.222 0.1 . 1 . . . . . 77 ARG N . 26967 1 480 . 1 1 77 77 LEU H H 1 8.288 0.020 . 1 . . . . . 78 LEU H . 26967 1 481 . 1 1 77 77 LEU HD11 H 1 0.839 0.020 . 2 . . . . . 78 LEU HD1 . 26967 1 482 . 1 1 77 77 LEU HD12 H 1 0.839 0.020 . 2 . . . . . 78 LEU HD1 . 26967 1 483 . 1 1 77 77 LEU HD13 H 1 0.839 0.020 . 2 . . . . . 78 LEU HD1 . 26967 1 484 . 1 1 77 77 LEU HD21 H 1 0.896 0.020 . 2 . . . . . 78 LEU HD2 . 26967 1 485 . 1 1 77 77 LEU HD22 H 1 0.896 0.020 . 2 . . . . . 78 LEU HD2 . 26967 1 486 . 1 1 77 77 LEU HD23 H 1 0.896 0.020 . 2 . . . . . 78 LEU HD2 . 26967 1 487 . 1 1 77 77 LEU C C 13 177.100 0.1 . 1 . . . . . 78 LEU C . 26967 1 488 . 1 1 77 77 LEU CA C 13 55.217 0.1 . 1 . . . . . 78 LEU CA . 26967 1 489 . 1 1 77 77 LEU CB C 13 41.122 0.1 . 1 . . . . . 78 LEU CB . 26967 1 490 . 1 1 77 77 LEU CG C 13 26.449 0.1 . 1 . . . . . 78 LEU CG . 26967 1 491 . 1 1 77 77 LEU CD1 C 13 23.346 0.1 . 2 . . . . . 78 LEU CD1 . 26967 1 492 . 1 1 77 77 LEU CD2 C 13 24.817 0.1 . 2 . . . . . 78 LEU CD2 . 26967 1 493 . 1 1 77 77 LEU N N 15 122.554 0.1 . 1 . . . . . 78 LEU N . 26967 1 494 . 1 1 78 78 ASP H H 1 8.162 0.020 . 1 . . . . . 79 ASP H . 26967 1 495 . 1 1 78 78 ASP C C 13 175.666 0.1 . 1 . . . . . 79 ASP C . 26967 1 496 . 1 1 78 78 ASP CA C 13 53.865 0.1 . 1 . . . . . 79 ASP CA . 26967 1 497 . 1 1 78 78 ASP CB C 13 40.472 0.1 . 1 . . . . . 79 ASP CB . 26967 1 498 . 1 1 78 78 ASP N N 15 118.543 0.1 . 1 . . . . . 79 ASP N . 26967 1 499 . 1 1 79 79 ASP H H 1 7.964 0.020 . 1 . . . . . 80 ASP H . 26967 1 500 . 1 1 79 79 ASP C C 13 175.682 0.1 . 1 . . . . . 80 ASP C . 26967 1 501 . 1 1 79 79 ASP CA C 13 53.829 0.1 . 1 . . . . . 80 ASP CA . 26967 1 502 . 1 1 79 79 ASP CB C 13 40.692 0.1 . 1 . . . . . 80 ASP CB . 26967 1 503 . 1 1 79 79 ASP N N 15 119.503 0.1 . 1 . . . . . 80 ASP N . 26967 1 504 . 1 1 80 80 ILE H H 1 7.937 0.020 . 1 . . . . . 81 ILE H . 26967 1 505 . 1 1 80 80 ILE HD11 H 1 0.773 0.020 . 1 . . . . . 81 ILE HD1 . 26967 1 506 . 1 1 80 80 ILE HD12 H 1 0.773 0.020 . 1 . . . . . 81 ILE HD1 . 26967 1 507 . 1 1 80 80 ILE HD13 H 1 0.773 0.020 . 1 . . . . . 81 ILE HD1 . 26967 1 508 . 1 1 80 80 ILE C C 13 173.970 0.1 . 1 . . . . . 81 ILE C . 26967 1 509 . 1 1 80 80 ILE CA C 13 58.544 0.1 . 1 . . . . . 81 ILE CA . 26967 1 510 . 1 1 80 80 ILE CB C 13 38.248 0.1 . 1 . . . . . 81 ILE CB . 26967 1 511 . 1 1 80 80 ILE CD1 C 13 12.777 0.1 . 1 . . . . . 81 ILE CD1 . 26967 1 512 . 1 1 80 80 ILE N N 15 121.876 0.1 . 1 . . . . . 81 ILE N . 26967 1 513 . 1 1 82 82 PRO C C 13 178.031 0.1 . 1 . . . . . 83 PRO C . 26967 1 514 . 1 1 83 83 TYR H H 1 8.370 0.020 . 1 . . . . . 84 TYR H . 26967 1 515 . 1 1 83 83 TYR C C 13 177.233 0.1 . 1 . . . . . 84 TYR C . 26967 1 516 . 1 1 83 83 TYR CA C 13 60.915 0.1 . 1 . . . . . 84 TYR CA . 26967 1 517 . 1 1 83 83 TYR N N 15 117.059 0.1 . 1 . . . . . 84 TYR N . 26967 1 518 . 1 1 84 84 ASP H H 1 7.504 0.020 . 1 . . . . . 85 ASP H . 26967 1 519 . 1 1 84 84 ASP C C 13 177.495 0.1 . 1 . . . . . 85 ASP C . 26967 1 520 . 1 1 84 84 ASP CA C 13 56.280 0.1 . 1 . . . . . 85 ASP CA . 26967 1 521 . 1 1 84 84 ASP CB C 13 40.200 0.1 . 1 . . . . . 85 ASP CB . 26967 1 522 . 1 1 84 84 ASP N N 15 119.437 0.1 . 1 . . . . . 85 ASP N . 26967 1 523 . 1 1 85 85 ARG H H 1 7.992 0.020 . 1 . . . . . 86 ARG H . 26967 1 524 . 1 1 85 85 ARG C C 13 178.772 0.1 . 1 . . . . . 86 ARG C . 26967 1 525 . 1 1 85 85 ARG CA C 13 58.376 0.1 . 1 . . . . . 86 ARG CA . 26967 1 526 . 1 1 85 85 ARG CB C 13 29.008 0.1 . 1 . . . . . 86 ARG CB . 26967 1 527 . 1 1 85 85 ARG N N 15 119.523 0.1 . 1 . . . . . 86 ARG N . 26967 1 528 . 1 1 86 86 ASP H H 1 7.821 0.020 . 1 . . . . . 87 ASP H . 26967 1 529 . 1 1 86 86 ASP C C 13 178.708 0.1 . 1 . . . . . 87 ASP C . 26967 1 530 . 1 1 86 86 ASP CA C 13 56.239 0.1 . 1 . . . . . 87 ASP CA . 26967 1 531 . 1 1 86 86 ASP CB C 13 39.441 0.1 . 1 . . . . . 87 ASP CB . 26967 1 532 . 1 1 86 86 ASP N N 15 118.619 0.1 . 1 . . . . . 87 ASP N . 26967 1 533 . 1 1 87 87 PHE H H 1 8.418 0.020 . 1 . . . . . 88 PHE H . 26967 1 534 . 1 1 87 87 PHE C C 13 175.951 0.1 . 1 . . . . . 88 PHE C . 26967 1 535 . 1 1 87 87 PHE CA C 13 60.698 0.1 . 1 . . . . . 88 PHE CA . 26967 1 536 . 1 1 87 87 PHE CB C 13 38.624 0.1 . 1 . . . . . 88 PHE CB . 26967 1 537 . 1 1 87 87 PHE N N 15 122.457 0.1 . 1 . . . . . 88 PHE N . 26967 1 538 . 1 1 88 88 CYS H H 1 7.316 0.020 . 1 . . . . . 89 CYS H . 26967 1 539 . 1 1 88 88 CYS C C 13 173.984 0.1 . 1 . . . . . 89 CYS C . 26967 1 540 . 1 1 88 88 CYS CA C 13 60.053 0.1 . 1 . . . . . 89 CYS CA . 26967 1 541 . 1 1 88 88 CYS CB C 13 27.258 0.1 . 1 . . . . . 89 CYS CB . 26967 1 542 . 1 1 88 88 CYS N N 15 110.133 0.1 . 1 . . . . . 89 CYS N . 26967 1 543 . 1 1 89 89 LYS H H 1 7.288 0.020 . 1 . . . . . 90 LYS H . 26967 1 544 . 1 1 89 89 LYS C C 13 175.137 0.1 . 1 . . . . . 90 LYS C . 26967 1 545 . 1 1 89 89 LYS CA C 13 55.340 0.1 . 1 . . . . . 90 LYS CA . 26967 1 546 . 1 1 89 89 LYS CB C 13 29.196 0.1 . 1 . . . . . 90 LYS CB . 26967 1 547 . 1 1 89 89 LYS N N 15 122.973 0.1 . 1 . . . . . 90 LYS N . 26967 1 548 . 1 1 90 90 VAL H H 1 7.301 0.020 . 1 . . . . . 91 VAL H . 26967 1 549 . 1 1 90 90 VAL HG11 H 1 0.610 0.020 . 2 . . . . . 91 VAL HG1 . 26967 1 550 . 1 1 90 90 VAL HG12 H 1 0.610 0.020 . 2 . . . . . 91 VAL HG1 . 26967 1 551 . 1 1 90 90 VAL HG13 H 1 0.610 0.020 . 2 . . . . . 91 VAL HG1 . 26967 1 552 . 1 1 90 90 VAL HG21 H 1 0.701 0.020 . 2 . . . . . 91 VAL HG2 . 26967 1 553 . 1 1 90 90 VAL HG22 H 1 0.701 0.020 . 2 . . . . . 91 VAL HG2 . 26967 1 554 . 1 1 90 90 VAL HG23 H 1 0.701 0.020 . 2 . . . . . 91 VAL HG2 . 26967 1 555 . 1 1 90 90 VAL C C 13 174.477 0.1 . 1 . . . . . 91 VAL C . 26967 1 556 . 1 1 90 90 VAL CA C 13 58.636 0.1 . 1 . . . . . 91 VAL CA . 26967 1 557 . 1 1 90 90 VAL CB C 13 34.141 0.1 . 1 . . . . . 91 VAL CB . 26967 1 558 . 1 1 90 90 VAL CG1 C 13 18.423 0.1 . 2 . . . . . 91 VAL CG1 . 26967 1 559 . 1 1 90 90 VAL CG2 C 13 21.636 0.1 . 2 . . . . . 91 VAL CG2 . 26967 1 560 . 1 1 90 90 VAL N N 15 115.610 0.1 . 1 . . . . . 91 VAL N . 26967 1 561 . 1 1 91 91 ASP H H 1 8.067 0.020 . 1 . . . . . 92 ASP H . 26967 1 562 . 1 1 91 91 ASP C C 13 175.312 0.1 . 1 . . . . . 92 ASP C . 26967 1 563 . 1 1 91 91 ASP CA C 13 53.163 0.1 . 1 . . . . . 92 ASP CA . 26967 1 564 . 1 1 91 91 ASP CB C 13 40.470 0.1 . 1 . . . . . 92 ASP CB . 26967 1 565 . 1 1 91 91 ASP N N 15 118.579 0.1 . 1 . . . . . 92 ASP N . 26967 1 566 . 1 1 92 92 GLN H H 1 8.708 0.020 . 1 . . . . . 93 GLN H . 26967 1 567 . 1 1 92 92 GLN C C 13 175.308 0.1 . 1 . . . . . 93 GLN C . 26967 1 568 . 1 1 92 92 GLN CA C 13 60.672 0.1 . 1 . . . . . 93 GLN CA . 26967 1 569 . 1 1 92 92 GLN N N 15 117.437 0.1 . 1 . . . . . 93 GLN N . 26967 1 570 . 1 1 93 93 PRO C C 13 178.982 0.1 . 1 . . . . . 94 PRO C . 26967 1 571 . 1 1 93 93 PRO CA C 13 66.257 0.1 . 1 . . . . . 94 PRO CA . 26967 1 572 . 1 1 93 93 PRO CB C 13 29.805 0.1 . 1 . . . . . 94 PRO CB . 26967 1 573 . 1 1 94 94 THR H H 1 7.548 0.020 . 1 . . . . . 95 THR H . 26967 1 574 . 1 1 94 94 THR C C 13 175.676 0.1 . 1 . . . . . 95 THR C . 26967 1 575 . 1 1 94 94 THR CA C 13 66.356 0.1 . 1 . . . . . 95 THR CA . 26967 1 576 . 1 1 94 94 THR N N 15 113.754 0.1 . 1 . . . . . 95 THR N . 26967 1 577 . 1 1 95 95 LEU H H 1 8.197 0.020 . 1 . . . . . 96 LEU H . 26967 1 578 . 1 1 95 95 LEU C C 13 178.533 0.1 . 1 . . . . . 96 LEU C . 26967 1 579 . 1 1 95 95 LEU CA C 13 58.126 0.1 . 1 . . . . . 96 LEU CA . 26967 1 580 . 1 1 95 95 LEU CB C 13 40.156 0.1 . 1 . . . . . 96 LEU CB . 26967 1 581 . 1 1 95 95 LEU N N 15 122.959 0.1 . 1 . . . . . 96 LEU N . 26967 1 582 . 1 1 96 96 PHE H H 1 7.911 0.020 . 1 . . . . . 97 PHE H . 26967 1 583 . 1 1 96 96 PHE C C 13 178.193 0.1 . 1 . . . . . 97 PHE C . 26967 1 584 . 1 1 96 96 PHE CA C 13 61.503 0.1 . 1 . . . . . 97 PHE CA . 26967 1 585 . 1 1 96 96 PHE N N 15 114.479 0.1 . 1 . . . . . 97 PHE N . 26967 1 586 . 1 1 97 97 GLU H H 1 8.043 0.020 . 1 . . . . . 98 GLU H . 26967 1 587 . 1 1 97 97 GLU C C 13 180.731 0.1 . 1 . . . . . 98 GLU C . 26967 1 588 . 1 1 97 97 GLU CA C 13 59.257 0.1 . 1 . . . . . 98 GLU CA . 26967 1 589 . 1 1 97 97 GLU CB C 13 28.129 0.1 . 1 . . . . . 98 GLU CB . 26967 1 590 . 1 1 97 97 GLU N N 15 117.517 0.1 . 1 . . . . . 98 GLU N . 26967 1 591 . 1 1 98 98 LEU H H 1 8.660 0.020 . 1 . . . . . 99 LEU H . 26967 1 592 . 1 1 98 98 LEU HD11 H 1 0.716 0.020 . 2 . . . . . 99 LEU HD1 . 26967 1 593 . 1 1 98 98 LEU HD12 H 1 0.716 0.020 . 2 . . . . . 99 LEU HD1 . 26967 1 594 . 1 1 98 98 LEU HD13 H 1 0.716 0.020 . 2 . . . . . 99 LEU HD1 . 26967 1 595 . 1 1 98 98 LEU HD21 H 1 0.855 0.020 . 2 . . . . . 99 LEU HD2 . 26967 1 596 . 1 1 98 98 LEU HD22 H 1 0.855 0.020 . 2 . . . . . 99 LEU HD2 . 26967 1 597 . 1 1 98 98 LEU HD23 H 1 0.855 0.020 . 2 . . . . . 99 LEU HD2 . 26967 1 598 . 1 1 98 98 LEU C C 13 178.269 0.1 . 1 . . . . . 99 LEU C . 26967 1 599 . 1 1 98 98 LEU CA C 13 57.965 0.1 . 1 . . . . . 99 LEU CA . 26967 1 600 . 1 1 98 98 LEU CB C 13 41.731 0.1 . 1 . . . . . 99 LEU CB . 26967 1 601 . 1 1 98 98 LEU CD1 C 13 25.799 0.1 . 2 . . . . . 99 LEU CD1 . 26967 1 602 . 1 1 98 98 LEU CD2 C 13 23.939 0.1 . 2 . . . . . 99 LEU CD2 . 26967 1 603 . 1 1 98 98 LEU N N 15 122.388 0.1 . 1 . . . . . 99 LEU N . 26967 1 604 . 1 1 99 99 ILE H H 1 7.934 0.020 . 1 . . . . . 100 ILE H . 26967 1 605 . 1 1 99 99 ILE C C 13 178.054 0.1 . 1 . . . . . 100 ILE C . 26967 1 606 . 1 1 99 99 ILE CA C 13 65.853 0.1 . 1 . . . . . 100 ILE CA . 26967 1 607 . 1 1 99 99 ILE CB C 13 37.075 0.1 . 1 . . . . . 100 ILE CB . 26967 1 608 . 1 1 99 99 ILE N N 15 121.108 0.1 . 1 . . . . . 100 ILE N . 26967 1 609 . 1 1 100 100 LEU H H 1 7.837 0.020 . 1 . . . . . 101 LEU H . 26967 1 610 . 1 1 100 100 LEU C C 13 180.817 0.1 . 1 . . . . . 101 LEU C . 26967 1 611 . 1 1 100 100 LEU CA C 13 57.545 0.1 . 1 . . . . . 101 LEU CA . 26967 1 612 . 1 1 100 100 LEU CB C 13 40.082 0.1 . 1 . . . . . 101 LEU CB . 26967 1 613 . 1 1 100 100 LEU N N 15 116.662 0.1 . 1 . . . . . 101 LEU N . 26967 1 614 . 1 1 101 101 ALA H H 1 8.439 0.020 . 1 . . . . . 102 ALA H . 26967 1 615 . 1 1 101 101 ALA C C 13 179.312 0.1 . 1 . . . . . 102 ALA C . 26967 1 616 . 1 1 101 101 ALA CA C 13 54.502 0.1 . 1 . . . . . 102 ALA CA . 26967 1 617 . 1 1 101 101 ALA CB C 13 18.094 0.1 . 1 . . . . . 102 ALA CB . 26967 1 618 . 1 1 101 101 ALA N N 15 121.628 0.1 . 1 . . . . . 102 ALA N . 26967 1 619 . 1 1 102 102 ALA H H 1 8.949 0.020 . 1 . . . . . 103 ALA H . 26967 1 620 . 1 1 102 102 ALA C C 13 179.255 0.1 . 1 . . . . . 103 ALA C . 26967 1 621 . 1 1 102 102 ALA CA C 13 55.104 0.1 . 1 . . . . . 103 ALA CA . 26967 1 622 . 1 1 102 102 ALA CB C 13 16.786 0.1 . 1 . . . . . 103 ALA CB . 26967 1 623 . 1 1 102 102 ALA N N 15 120.910 0.1 . 1 . . . . . 103 ALA N . 26967 1 624 . 1 1 103 103 ASN H H 1 8.246 0.020 . 1 . . . . . 104 ASN H . 26967 1 625 . 1 1 103 103 ASN C C 13 177.401 0.1 . 1 . . . . . 104 ASN C . 26967 1 626 . 1 1 103 103 ASN CA C 13 55.926 0.1 . 1 . . . . . 104 ASN CA . 26967 1 627 . 1 1 103 103 ASN CB C 13 39.696 0.1 . 1 . . . . . 104 ASN CB . 26967 1 628 . 1 1 103 103 ASN N N 15 115.040 0.1 . 1 . . . . . 104 ASN N . 26967 1 629 . 1 1 104 104 TYR H H 1 8.405 0.020 . 1 . . . . . 105 TYR H . 26967 1 630 . 1 1 104 104 TYR C C 13 178.087 0.1 . 1 . . . . . 105 TYR C . 26967 1 631 . 1 1 104 104 TYR CA C 13 59.411 0.1 . 1 . . . . . 105 TYR CA . 26967 1 632 . 1 1 104 104 TYR CB C 13 37.725 0.1 . 1 . . . . . 105 TYR CB . 26967 1 633 . 1 1 104 104 TYR N N 15 120.990 0.1 . 1 . . . . . 105 TYR N . 26967 1 634 . 1 1 105 105 LEU H H 1 8.938 0.020 . 1 . . . . . 106 LEU H . 26967 1 635 . 1 1 105 105 LEU HD11 H 1 0.791 0.020 . 2 . . . . . 106 LEU HD1 . 26967 1 636 . 1 1 105 105 LEU HD12 H 1 0.791 0.020 . 2 . . . . . 106 LEU HD1 . 26967 1 637 . 1 1 105 105 LEU HD13 H 1 0.791 0.020 . 2 . . . . . 106 LEU HD1 . 26967 1 638 . 1 1 105 105 LEU HD21 H 1 0.605 0.020 . 2 . . . . . 106 LEU HD2 . 26967 1 639 . 1 1 105 105 LEU HD22 H 1 0.605 0.020 . 2 . . . . . 106 LEU HD2 . 26967 1 640 . 1 1 105 105 LEU HD23 H 1 0.605 0.020 . 2 . . . . . 106 LEU HD2 . 26967 1 641 . 1 1 105 105 LEU C C 13 176.466 0.1 . 1 . . . . . 106 LEU C . 26967 1 642 . 1 1 105 105 LEU CA C 13 54.111 0.1 . 1 . . . . . 106 LEU CA . 26967 1 643 . 1 1 105 105 LEU CB C 13 40.477 0.1 . 1 . . . . . 106 LEU CB . 26967 1 644 . 1 1 105 105 LEU CD1 C 13 26.037 0.1 . 2 . . . . . 106 LEU CD1 . 26967 1 645 . 1 1 105 105 LEU CD2 C 13 22.225 0.1 . 2 . . . . . 106 LEU CD2 . 26967 1 646 . 1 1 105 105 LEU N N 15 114.496 0.1 . 1 . . . . . 106 LEU N . 26967 1 647 . 1 1 106 106 ASP H H 1 7.790 0.020 . 1 . . . . . 107 ASP H . 26967 1 648 . 1 1 106 106 ASP C C 13 174.024 0.1 . 1 . . . . . 107 ASP C . 26967 1 649 . 1 1 106 106 ASP CA C 13 54.515 0.1 . 1 . . . . . 107 ASP CA . 26967 1 650 . 1 1 106 106 ASP CB C 13 38.504 0.1 . 1 . . . . . 107 ASP CB . 26967 1 651 . 1 1 106 106 ASP N N 15 125.439 0.1 . 1 . . . . . 107 ASP N . 26967 1 652 . 1 1 107 107 ILE H H 1 7.932 0.020 . 1 . . . . . 108 ILE H . 26967 1 653 . 1 1 107 107 ILE HD11 H 1 0.666 0.020 . 1 . . . . . 108 ILE HD1 . 26967 1 654 . 1 1 107 107 ILE HD12 H 1 0.666 0.020 . 1 . . . . . 108 ILE HD1 . 26967 1 655 . 1 1 107 107 ILE HD13 H 1 0.666 0.020 . 1 . . . . . 108 ILE HD1 . 26967 1 656 . 1 1 107 107 ILE C C 13 175.769 0.1 . 1 . . . . . 108 ILE C . 26967 1 657 . 1 1 107 107 ILE CA C 13 58.902 0.1 . 1 . . . . . 108 ILE CA . 26967 1 658 . 1 1 107 107 ILE CB C 13 37.283 0.1 . 1 . . . . . 108 ILE CB . 26967 1 659 . 1 1 107 107 ILE CD1 C 13 16.032 0.1 . 1 . . . . . 108 ILE CD1 . 26967 1 660 . 1 1 107 107 ILE N N 15 120.945 0.1 . 1 . . . . . 108 ILE N . 26967 1 661 . 1 1 108 108 LYS H H 1 9.157 0.020 . 1 . . . . . 109 LYS H . 26967 1 662 . 1 1 108 108 LYS C C 13 175.724 0.1 . 1 . . . . . 109 LYS C . 26967 1 663 . 1 1 108 108 LYS CA C 13 61.013 0.1 . 1 . . . . . 109 LYS CA . 26967 1 664 . 1 1 108 108 LYS CB C 13 28.843 0.1 . 1 . . . . . 109 LYS CB . 26967 1 665 . 1 1 108 108 LYS N N 15 127.712 0.1 . 1 . . . . . 109 LYS N . 26967 1 666 . 1 1 109 109 PRO C C 13 178.645 0.1 . 1 . . . . . 110 PRO C . 26967 1 667 . 1 1 109 109 PRO CA C 13 65.587 0.1 . 1 . . . . . 110 PRO CA . 26967 1 668 . 1 1 109 109 PRO CB C 13 29.306 0.1 . 1 . . . . . 110 PRO CB . 26967 1 669 . 1 1 110 110 LEU H H 1 6.388 0.020 . 1 . . . . . 111 LEU H . 26967 1 670 . 1 1 110 110 LEU HD11 H 1 0.114 0.020 . 2 . . . . . 111 LEU HD1 . 26967 1 671 . 1 1 110 110 LEU HD12 H 1 0.114 0.020 . 2 . . . . . 111 LEU HD1 . 26967 1 672 . 1 1 110 110 LEU HD13 H 1 0.114 0.020 . 2 . . . . . 111 LEU HD1 . 26967 1 673 . 1 1 110 110 LEU HD21 H 1 0.622 0.020 . 2 . . . . . 111 LEU HD2 . 26967 1 674 . 1 1 110 110 LEU HD22 H 1 0.622 0.020 . 2 . . . . . 111 LEU HD2 . 26967 1 675 . 1 1 110 110 LEU HD23 H 1 0.622 0.020 . 2 . . . . . 111 LEU HD2 . 26967 1 676 . 1 1 110 110 LEU C C 13 178.716 0.1 . 1 . . . . . 111 LEU C . 26967 1 677 . 1 1 110 110 LEU CA C 13 55.418 0.1 . 1 . . . . . 111 LEU CA . 26967 1 678 . 1 1 110 110 LEU CB C 13 39.888 0.1 . 1 . . . . . 111 LEU CB . 26967 1 679 . 1 1 110 110 LEU CG C 13 25.884 0.1 . 1 . . . . . 111 LEU CG . 26967 1 680 . 1 1 110 110 LEU CD1 C 13 22.189 0.1 . 2 . . . . . 111 LEU CD1 . 26967 1 681 . 1 1 110 110 LEU CD2 C 13 26.351 0.1 . 2 . . . . . 111 LEU CD2 . 26967 1 682 . 1 1 110 110 LEU N N 15 115.612 0.1 . 1 . . . . . 111 LEU N . 26967 1 683 . 1 1 111 111 LEU H H 1 7.827 0.020 . 1 . . . . . 112 LEU H . 26967 1 684 . 1 1 111 111 LEU HD11 H 1 0.901 0.020 . 2 . . . . . 112 LEU HD1 . 26967 1 685 . 1 1 111 111 LEU HD12 H 1 0.901 0.020 . 2 . . . . . 112 LEU HD1 . 26967 1 686 . 1 1 111 111 LEU HD13 H 1 0.901 0.020 . 2 . . . . . 112 LEU HD1 . 26967 1 687 . 1 1 111 111 LEU HD21 H 1 0.901 0.020 . 2 . . . . . 112 LEU HD2 . 26967 1 688 . 1 1 111 111 LEU HD22 H 1 0.901 0.020 . 2 . . . . . 112 LEU HD2 . 26967 1 689 . 1 1 111 111 LEU HD23 H 1 0.901 0.020 . 2 . . . . . 112 LEU HD2 . 26967 1 690 . 1 1 111 111 LEU C C 13 177.583 0.1 . 1 . . . . . 112 LEU C . 26967 1 691 . 1 1 111 111 LEU CA C 13 57.512 0.1 . 1 . . . . . 112 LEU CA . 26967 1 692 . 1 1 111 111 LEU CB C 13 40.868 0.1 . 1 . . . . . 112 LEU CB . 26967 1 693 . 1 1 111 111 LEU CD1 C 13 25.215 0.1 . 2 . . . . . 112 LEU CD1 . 26967 1 694 . 1 1 111 111 LEU CD2 C 13 25.215 0.1 . 2 . . . . . 112 LEU CD2 . 26967 1 695 . 1 1 111 111 LEU N N 15 123.755 0.1 . 1 . . . . . 112 LEU N . 26967 1 696 . 1 1 112 112 ASP H H 1 8.213 0.020 . 1 . . . . . 113 ASP H . 26967 1 697 . 1 1 112 112 ASP C C 13 178.792 0.1 . 1 . . . . . 113 ASP C . 26967 1 698 . 1 1 112 112 ASP CA C 13 57.442 0.1 . 1 . . . . . 113 ASP CA . 26967 1 699 . 1 1 112 112 ASP CB C 13 40.502 0.1 . 1 . . . . . 113 ASP CB . 26967 1 700 . 1 1 112 112 ASP N N 15 116.327 0.1 . 1 . . . . . 113 ASP N . 26967 1 701 . 1 1 113 113 VAL H H 1 7.687 0.020 . 1 . . . . . 114 VAL H . 26967 1 702 . 1 1 113 113 VAL HG11 H 1 1.105 0.020 . 2 . . . . . 114 VAL HG1 . 26967 1 703 . 1 1 113 113 VAL HG12 H 1 1.105 0.020 . 2 . . . . . 114 VAL HG1 . 26967 1 704 . 1 1 113 113 VAL HG13 H 1 1.105 0.020 . 2 . . . . . 114 VAL HG1 . 26967 1 705 . 1 1 113 113 VAL HG21 H 1 1.140 0.020 . 2 . . . . . 114 VAL HG2 . 26967 1 706 . 1 1 113 113 VAL HG22 H 1 1.140 0.020 . 2 . . . . . 114 VAL HG2 . 26967 1 707 . 1 1 113 113 VAL HG23 H 1 1.140 0.020 . 2 . . . . . 114 VAL HG2 . 26967 1 708 . 1 1 113 113 VAL C C 13 178.736 0.1 . 1 . . . . . 114 VAL C . 26967 1 709 . 1 1 113 113 VAL CA C 13 65.377 0.1 . 1 . . . . . 114 VAL CA . 26967 1 710 . 1 1 113 113 VAL CB C 13 30.928 0.1 . 1 . . . . . 114 VAL CB . 26967 1 711 . 1 1 113 113 VAL CG1 C 13 20.687 0.1 . 2 . . . . . 114 VAL CG1 . 26967 1 712 . 1 1 113 113 VAL CG2 C 13 22.087 0.1 . 2 . . . . . 114 VAL CG2 . 26967 1 713 . 1 1 113 113 VAL N N 15 114.872 0.1 . 1 . . . . . 114 VAL N . 26967 1 714 . 1 1 114 114 THR H H 1 7.899 0.020 . 1 . . . . . 115 THR H . 26967 1 715 . 1 1 114 114 THR HG1 H 1 4.031 0.020 . 1 . . . . . 115 THR HG1 . 26967 1 716 . 1 1 114 114 THR C C 13 177.664 0.1 . 1 . . . . . 115 THR C . 26967 1 717 . 1 1 114 114 THR CA C 13 65.456 0.1 . 1 . . . . . 115 THR CA . 26967 1 718 . 1 1 114 114 THR CB C 13 66.875 0.1 . 1 . . . . . 115 THR CB . 26967 1 719 . 1 1 114 114 THR N N 15 115.959 0.1 . 1 . . . . . 115 THR N . 26967 1 720 . 1 1 115 115 CYS H H 1 8.252 0.020 . 1 . . . . . 116 CYS H . 26967 1 721 . 1 1 115 115 CYS C C 13 177.249 0.1 . 1 . . . . . 116 CYS C . 26967 1 722 . 1 1 115 115 CYS CA C 13 64.773 0.1 . 1 . . . . . 116 CYS CA . 26967 1 723 . 1 1 115 115 CYS CB C 13 26.404 0.1 . 1 . . . . . 116 CYS CB . 26967 1 724 . 1 1 115 115 CYS N N 15 119.831 0.1 . 1 . . . . . 116 CYS N . 26967 1 725 . 1 1 116 116 LYS H H 1 8.333 0.020 . 1 . . . . . 117 LYS H . 26967 1 726 . 1 1 116 116 LYS C C 13 178.697 0.1 . 1 . . . . . 117 LYS C . 26967 1 727 . 1 1 116 116 LYS CA C 13 59.409 0.1 . 1 . . . . . 117 LYS CA . 26967 1 728 . 1 1 116 116 LYS CB C 13 31.446 0.1 . 1 . . . . . 117 LYS CB . 26967 1 729 . 1 1 116 116 LYS N N 15 119.455 0.1 . 1 . . . . . 117 LYS N . 26967 1 730 . 1 1 117 117 THR H H 1 7.696 0.020 . 1 . . . . . 118 THR H . 26967 1 731 . 1 1 117 117 THR C C 13 176.841 0.1 . 1 . . . . . 118 THR C . 26967 1 732 . 1 1 117 117 THR CA C 13 67.162 0.1 . 1 . . . . . 118 THR CA . 26967 1 733 . 1 1 117 117 THR N N 15 116.061 0.1 . 1 . . . . . 118 THR N . 26967 1 734 . 1 1 118 118 VAL H H 1 7.667 0.020 . 1 . . . . . 119 VAL H . 26967 1 735 . 1 1 118 118 VAL C C 13 177.447 0.1 . 1 . . . . . 119 VAL C . 26967 1 736 . 1 1 118 118 VAL CA C 13 66.352 0.1 . 1 . . . . . 119 VAL CA . 26967 1 737 . 1 1 118 118 VAL CB C 13 30.773 0.1 . 1 . . . . . 119 VAL CB . 26967 1 738 . 1 1 118 118 VAL N N 15 121.410 0.1 . 1 . . . . . 119 VAL N . 26967 1 739 . 1 1 119 119 ALA H H 1 8.480 0.020 . 1 . . . . . 120 ALA H . 26967 1 740 . 1 1 119 119 ALA C C 13 179.888 0.1 . 1 . . . . . 120 ALA C . 26967 1 741 . 1 1 119 119 ALA CA C 13 54.938 0.1 . 1 . . . . . 120 ALA CA . 26967 1 742 . 1 1 119 119 ALA CB C 13 17.205 0.1 . 1 . . . . . 120 ALA CB . 26967 1 743 . 1 1 119 119 ALA N N 15 121.152 0.1 . 1 . . . . . 120 ALA N . 26967 1 744 . 1 1 120 120 ASN H H 1 8.004 0.020 . 1 . . . . . 121 ASN H . 26967 1 745 . 1 1 120 120 ASN C C 13 177.350 0.1 . 1 . . . . . 121 ASN C . 26967 1 746 . 1 1 120 120 ASN CA C 13 54.909 0.1 . 1 . . . . . 121 ASN CA . 26967 1 747 . 1 1 120 120 ASN CB C 13 37.653 0.1 . 1 . . . . . 121 ASN CB . 26967 1 748 . 1 1 120 120 ASN N N 15 114.000 0.1 . 1 . . . . . 121 ASN N . 26967 1 749 . 1 1 121 121 MET H H 1 7.838 0.020 . 1 . . . . . 122 MET H . 26967 1 750 . 1 1 121 121 MET C C 13 177.478 0.1 . 1 . . . . . 122 MET C . 26967 1 751 . 1 1 121 121 MET CA C 13 57.989 0.1 . 1 . . . . . 122 MET CA . 26967 1 752 . 1 1 121 121 MET CB C 13 32.878 0.1 . 1 . . . . . 122 MET CB . 26967 1 753 . 1 1 121 121 MET N N 15 118.574 0.1 . 1 . . . . . 122 MET N . 26967 1 754 . 1 1 124 124 GLY C C 13 174.301 0.1 . 1 . . . . . 125 GLY C . 26967 1 755 . 1 1 124 124 GLY CA C 13 45.344 0.1 . 1 . . . . . 125 GLY CA . 26967 1 756 . 1 1 125 125 LYS H H 1 7.484 0.020 . 1 . . . . . 126 LYS H . 26967 1 757 . 1 1 125 125 LYS C C 13 176.937 0.1 . 1 . . . . . 126 LYS C . 26967 1 758 . 1 1 125 125 LYS CA C 13 53.852 0.1 . 1 . . . . . 126 LYS CA . 26967 1 759 . 1 1 125 125 LYS CB C 13 32.632 0.1 . 1 . . . . . 126 LYS CB . 26967 1 760 . 1 1 125 125 LYS N N 15 118.532 0.1 . 1 . . . . . 126 LYS N . 26967 1 761 . 1 1 126 126 THR H H 1 9.029 0.020 . 1 . . . . . 127 THR H . 26967 1 762 . 1 1 126 126 THR CA C 13 59.731 0.1 . 1 . . . . . 127 THR CA . 26967 1 763 . 1 1 126 126 THR CB C 13 67.841 0.1 . 1 . . . . . 127 THR CB . 26967 1 764 . 1 1 126 126 THR N N 15 113.388 0.1 . 1 . . . . . 127 THR N . 26967 1 765 . 1 1 138 138 ASN C C 13 174.371 0.1 . 1 . . . . . 139 ASN C . 26967 1 766 . 1 1 138 138 ASN CA C 13 52.653 0.1 . 1 . . . . . 139 ASN CA . 26967 1 767 . 1 1 138 138 ASN CB C 13 38.424 0.1 . 1 . . . . . 139 ASN CB . 26967 1 768 . 1 1 139 139 ASP H H 1 8.106 0.020 . 1 . . . . . 140 ASP H . 26967 1 769 . 1 1 139 139 ASP C C 13 175.528 0.1 . 1 . . . . . 140 ASP C . 26967 1 770 . 1 1 139 139 ASP CA C 13 53.687 0.1 . 1 . . . . . 140 ASP CA . 26967 1 771 . 1 1 139 139 ASP CB C 13 40.603 0.1 . 1 . . . . . 140 ASP CB . 26967 1 772 . 1 1 139 139 ASP N N 15 119.998 0.1 . 1 . . . . . 140 ASP N . 26967 1 773 . 1 1 140 140 PHE H H 1 8.095 0.020 . 1 . . . . . 141 PHE H . 26967 1 774 . 1 1 140 140 PHE C C 13 175.992 0.1 . 1 . . . . . 141 PHE C . 26967 1 775 . 1 1 140 140 PHE CA C 13 56.764 0.1 . 1 . . . . . 141 PHE CA . 26967 1 776 . 1 1 140 140 PHE CB C 13 39.032 0.1 . 1 . . . . . 141 PHE CB . 26967 1 777 . 1 1 140 140 PHE N N 15 119.274 0.1 . 1 . . . . . 141 PHE N . 26967 1 778 . 1 1 141 141 THR H H 1 8.410 0.020 . 1 . . . . . 142 THR H . 26967 1 779 . 1 1 141 141 THR C C 13 173.630 0.1 . 1 . . . . . 142 THR C . 26967 1 780 . 1 1 141 141 THR CA C 13 59.864 0.1 . 1 . . . . . 142 THR CA . 26967 1 781 . 1 1 141 141 THR CB C 13 68.701 0.1 . 1 . . . . . 142 THR CB . 26967 1 782 . 1 1 141 141 THR N N 15 115.656 0.1 . 1 . . . . . 142 THR N . 26967 1 783 . 1 1 142 142 PRO C C 13 177.292 0.1 . 1 . . . . . 143 PRO C . 26967 1 784 . 1 1 142 142 PRO CA C 13 62.858 0.1 . 1 . . . . . 143 PRO CA . 26967 1 785 . 1 1 142 142 PRO CB C 13 37.555 0.1 . 1 . . . . . 143 PRO CB . 26967 1 786 . 1 1 143 143 GLU H H 1 8.680 0.020 . 1 . . . . . 144 GLU H . 26967 1 787 . 1 1 143 143 GLU C C 13 177.817 0.1 . 1 . . . . . 144 GLU C . 26967 1 788 . 1 1 143 143 GLU CA C 13 57.853 0.1 . 1 . . . . . 144 GLU CA . 26967 1 789 . 1 1 143 143 GLU CB C 13 28.754 0.1 . 1 . . . . . 144 GLU CB . 26967 1 790 . 1 1 143 143 GLU N N 15 119.529 0.1 . 1 . . . . . 144 GLU N . 26967 1 791 . 1 1 144 144 GLU H H 1 8.103 0.020 . 1 . . . . . 145 GLU H . 26967 1 792 . 1 1 144 144 GLU C C 13 177.646 0.1 . 1 . . . . . 145 GLU C . 26967 1 793 . 1 1 144 144 GLU CA C 13 57.181 0.1 . 1 . . . . . 145 GLU CA . 26967 1 794 . 1 1 144 144 GLU CB C 13 29.389 0.1 . 1 . . . . . 145 GLU CB . 26967 1 795 . 1 1 144 144 GLU N N 15 120.782 0.1 . 1 . . . . . 145 GLU N . 26967 1 796 . 1 1 145 145 GLU H H 1 8.292 0.020 . 1 . . . . . 146 GLU H . 26967 1 797 . 1 1 145 145 GLU C C 13 177.558 0.1 . 1 . . . . . 146 GLU C . 26967 1 798 . 1 1 145 145 GLU CA C 13 57.563 0.1 . 1 . . . . . 146 GLU CA . 26967 1 799 . 1 1 145 145 GLU CB C 13 29.266 0.1 . 1 . . . . . 146 GLU CB . 26967 1 800 . 1 1 145 145 GLU N N 15 120.141 0.1 . 1 . . . . . 146 GLU N . 26967 1 801 . 1 1 146 146 GLU H H 1 8.137 0.020 . 1 . . . . . 147 GLU H . 26967 1 802 . 1 1 146 146 GLU C C 13 177.232 0.1 . 1 . . . . . 147 GLU C . 26967 1 803 . 1 1 146 146 GLU CA C 13 57.247 0.1 . 1 . . . . . 147 GLU CA . 26967 1 804 . 1 1 146 146 GLU CB C 13 28.939 0.1 . 1 . . . . . 147 GLU CB . 26967 1 805 . 1 1 146 146 GLU N N 15 119.951 0.1 . 1 . . . . . 147 GLU N . 26967 1 806 . 1 1 147 147 GLN H H 1 7.982 0.020 . 1 . . . . . 148 GLN H . 26967 1 807 . 1 1 147 147 GLN C C 13 176.902 0.1 . 1 . . . . . 148 GLN C . 26967 1 808 . 1 1 147 147 GLN CA C 13 56.474 0.1 . 1 . . . . . 148 GLN CA . 26967 1 809 . 1 1 147 147 GLN CB C 13 27.955 0.1 . 1 . . . . . 148 GLN CB . 26967 1 810 . 1 1 147 147 GLN N N 15 119.519 0.1 . 1 . . . . . 148 GLN N . 26967 1 811 . 1 1 148 148 ILE H H 1 7.918 0.020 . 1 . . . . . 149 ILE H . 26967 1 812 . 1 1 148 148 ILE HD11 H 1 0.682 0.020 . 1 . . . . . 149 ILE HD1 . 26967 1 813 . 1 1 148 148 ILE HD12 H 1 0.682 0.020 . 1 . . . . . 149 ILE HD1 . 26967 1 814 . 1 1 148 148 ILE HD13 H 1 0.682 0.020 . 1 . . . . . 149 ILE HD1 . 26967 1 815 . 1 1 148 148 ILE C C 13 176.997 0.1 . 1 . . . . . 149 ILE C . 26967 1 816 . 1 1 148 148 ILE CA C 13 61.899 0.1 . 1 . . . . . 149 ILE CA . 26967 1 817 . 1 1 148 148 ILE CB C 13 37.386 0.1 . 1 . . . . . 149 ILE CB . 26967 1 818 . 1 1 148 148 ILE CG1 C 13 26.745 0.1 . 1 . . . . . 149 ILE CG1 . 26967 1 819 . 1 1 148 148 ILE CD1 C 13 12.673 0.1 . 1 . . . . . 149 ILE CD1 . 26967 1 820 . 1 1 148 148 ILE N N 15 120.349 0.1 . 1 . . . . . 149 ILE N . 26967 1 821 . 1 1 149 149 ARG H H 1 8.075 0.020 . 1 . . . . . 150 ARG H . 26967 1 822 . 1 1 149 149 ARG C C 13 177.065 0.1 . 1 . . . . . 150 ARG C . 26967 1 823 . 1 1 149 149 ARG CA C 13 56.636 0.1 . 1 . . . . . 150 ARG CA . 26967 1 824 . 1 1 149 149 ARG CB C 13 29.453 0.1 . 1 . . . . . 150 ARG CB . 26967 1 825 . 1 1 149 149 ARG N N 15 122.767 0.1 . 1 . . . . . 150 ARG N . 26967 1 826 . 1 1 150 150 LYS H H 1 8.147 0.020 . 1 . . . . . 151 LYS H . 26967 1 827 . 1 1 150 150 LYS C C 13 177.343 0.1 . 1 . . . . . 151 LYS C . 26967 1 828 . 1 1 150 150 LYS CA C 13 56.521 0.1 . 1 . . . . . 151 LYS CA . 26967 1 829 . 1 1 150 150 LYS CB C 13 31.737 0.1 . 1 . . . . . 151 LYS CB . 26967 1 830 . 1 1 150 150 LYS N N 15 121.215 0.1 . 1 . . . . . 151 LYS N . 26967 1 831 . 1 1 151 151 GLU H H 1 8.242 0.020 . 1 . . . . . 152 GLU H . 26967 1 832 . 1 1 151 151 GLU C C 13 176.729 0.1 . 1 . . . . . 152 GLU C . 26967 1 833 . 1 1 151 151 GLU CA C 13 56.810 0.1 . 1 . . . . . 152 GLU CA . 26967 1 834 . 1 1 151 151 GLU CB C 13 29.071 0.1 . 1 . . . . . 152 GLU CB . 26967 1 835 . 1 1 151 151 GLU N N 15 120.153 0.1 . 1 . . . . . 152 GLU N . 26967 1 836 . 1 1 152 152 ASN H H 1 8.166 0.020 . 1 . . . . . 153 ASN H . 26967 1 837 . 1 1 152 152 ASN C C 13 175.263 0.1 . 1 . . . . . 153 ASN C . 26967 1 838 . 1 1 152 152 ASN CA C 13 53.224 0.1 . 1 . . . . . 153 ASN CA . 26967 1 839 . 1 1 152 152 ASN CB C 13 38.397 0.1 . 1 . . . . . 153 ASN CB . 26967 1 840 . 1 1 152 152 ASN N N 15 117.405 0.1 . 1 . . . . . 153 ASN N . 26967 1 841 . 1 1 153 153 GLU H H 1 8.100 0.020 . 1 . . . . . 154 GLU H . 26967 1 842 . 1 1 153 153 GLU C C 13 176.194 0.1 . 1 . . . . . 154 GLU C . 26967 1 843 . 1 1 153 153 GLU CA C 13 56.581 0.1 . 1 . . . . . 154 GLU CA . 26967 1 844 . 1 1 153 153 GLU CB C 13 29.233 0.1 . 1 . . . . . 154 GLU CB . 26967 1 845 . 1 1 153 153 GLU N N 15 120.139 0.1 . 1 . . . . . 154 GLU N . 26967 1 846 . 1 1 154 154 TRP H H 1 8.071 0.020 . 1 . . . . . 155 TRP H . 26967 1 847 . 1 1 154 154 TRP HE1 H 1 10.093 0.020 . 1 . . . . . 155 TRP HE1 . 26967 1 848 . 1 1 154 154 TRP C C 13 175.927 0.1 . 1 . . . . . 155 TRP C . 26967 1 849 . 1 1 154 154 TRP CA C 13 56.987 0.1 . 1 . . . . . 155 TRP CA . 26967 1 850 . 1 1 154 154 TRP CB C 13 28.704 0.1 . 1 . . . . . 155 TRP CB . 26967 1 851 . 1 1 154 154 TRP N N 15 121.012 0.1 . 1 . . . . . 155 TRP N . 26967 1 852 . 1 1 154 154 TRP NE1 N 15 129.039 0.1 . 1 . . . . . 155 TRP NE1 . 26967 1 853 . 1 1 155 155 CYS H H 1 7.809 0.020 . 1 . . . . . 156 CYS H . 26967 1 854 . 1 1 155 155 CYS C C 13 173.905 0.1 . 1 . . . . . 156 CYS C . 26967 1 855 . 1 1 155 155 CYS CA C 13 57.613 0.1 . 1 . . . . . 156 CYS CA . 26967 1 856 . 1 1 155 155 CYS CB C 13 27.657 0.1 . 1 . . . . . 156 CYS CB . 26967 1 857 . 1 1 155 155 CYS N N 15 120.800 0.1 . 1 . . . . . 156 CYS N . 26967 1 858 . 1 1 156 156 GLU H H 1 8.197 0.020 . 1 . . . . . 157 GLU H . 26967 1 859 . 1 1 156 156 GLU C C 13 176.002 0.1 . 1 . . . . . 157 GLU C . 26967 1 860 . 1 1 156 156 GLU CA C 13 56.345 0.1 . 1 . . . . . 157 GLU CA . 26967 1 861 . 1 1 156 156 GLU CB C 13 29.459 0.1 . 1 . . . . . 157 GLU CB . 26967 1 862 . 1 1 156 156 GLU N N 15 122.937 0.1 . 1 . . . . . 157 GLU N . 26967 1 863 . 1 1 157 157 ASP H H 1 8.261 0.020 . 1 . . . . . 158 ASP H . 26967 1 864 . 1 1 157 157 ASP C C 13 176.290 0.1 . 1 . . . . . 158 ASP C . 26967 1 865 . 1 1 157 157 ASP CA C 13 53.958 0.1 . 1 . . . . . 158 ASP CA . 26967 1 866 . 1 1 157 157 ASP CB C 13 40.466 0.1 . 1 . . . . . 158 ASP CB . 26967 1 867 . 1 1 157 157 ASP N N 15 121.075 0.1 . 1 . . . . . 158 ASP N . 26967 1 868 . 1 1 158 158 LYS H H 1 8.217 0.020 . 1 . . . . . 159 LYS H . 26967 1 869 . 1 1 158 158 LYS C C 13 177.295 0.1 . 1 . . . . . 159 LYS C . 26967 1 870 . 1 1 158 158 LYS CA C 13 55.805 0.1 . 1 . . . . . 159 LYS CA . 26967 1 871 . 1 1 158 158 LYS CB C 13 31.684 0.1 . 1 . . . . . 159 LYS CB . 26967 1 872 . 1 1 158 158 LYS N N 15 121.854 0.1 . 1 . . . . . 159 LYS N . 26967 1 873 . 1 1 159 159 GLY H H 1 8.353 0.020 . 1 . . . . . 160 GLY H . 26967 1 874 . 1 1 159 159 GLY C C 13 174.557 0.1 . 1 . . . . . 160 GLY C . 26967 1 875 . 1 1 159 159 GLY CA C 13 45.013 0.1 . 1 . . . . . 160 GLY CA . 26967 1 876 . 1 1 159 159 GLY N N 15 108.940 0.1 . 1 . . . . . 160 GLY N . 26967 1 877 . 1 1 160 160 GLY H H 1 8.171 0.020 . 1 . . . . . 161 GLY H . 26967 1 878 . 1 1 160 160 GLY C C 13 173.218 0.1 . 1 . . . . . 161 GLY C . 26967 1 879 . 1 1 160 160 GLY CA C 13 44.782 0.1 . 1 . . . . . 161 GLY CA . 26967 1 880 . 1 1 160 160 GLY N N 15 108.542 0.1 . 1 . . . . . 161 GLY N . 26967 1 881 . 1 1 161 161 ASN H H 1 7.897 0.020 . 1 . . . . . 162 ASN H . 26967 1 882 . 1 1 161 161 ASN C C 13 179.534 0.1 . 1 . . . . . 162 ASN C . 26967 1 883 . 1 1 161 161 ASN CA C 13 54.317 0.1 . 1 . . . . . 162 ASN CA . 26967 1 884 . 1 1 161 161 ASN CB C 13 39.778 0.1 . 1 . . . . . 162 ASN CB . 26967 1 885 . 1 1 161 161 ASN N N 15 123.433 0.1 . 1 . . . . . 162 ASN N . 26967 1 stop_ save_