data_50915 ####################### # Entry information # ####################### save_entry_information_1 _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information_1 _Entry.ID 50915 _Entry.Title ; WT nsp1 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2021-04-28 _Entry.Accession_date 2021-04-28 _Entry.Last_release_date 2021-04-28 _Entry.Original_release_date 2021-04-28 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.14.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID 1 _Entry.Generated_software_label $software_1 _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 Tatiana Agback . . . . 50915 2 Francisco Dominguez . . . . 50915 3 Ilya Frolov . . . . 50915 4 Elena Frolova . I. . . 50915 5 Peter Agback . . . 0000-0003-2226-0746 50915 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 2 50915 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 909 50915 '15N chemical shifts' 322 50915 '1H chemical shifts' 619 50915 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 2 . . 2022-01-14 2021-04-28 update BMRB 'update entry citation' 50915 1 . . 2021-11-04 2021-04-28 original author 'original release' 50915 stop_ save_ ############### # Citations # ############### save_citations_1 _Citation.Sf_category citations _Citation.Sf_framecode citations_1 _Citation.Entry_ID 50915 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 34874953 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; 1H, 13C and 15N resonance assignment of the SARS-CoV-2 full-length nsp1 protein and its mutants reveals its unique secondary structure features in solution ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'PLoS One' _Citation.Journal_name_full 'PloS one' _Citation.Journal_volume 16 _Citation.Journal_issue 12 _Citation.Journal_ASTM . _Citation.Journal_ISSN 1932-6203 _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 e0251834 _Citation.Page_last e0251834 _Citation.Year 2021 _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 Tatiana Agback . . . . 50915 1 2 Francisco Dominguez . . . . 50915 1 3 Ilya Frolov . . . . 50915 1 4 Elena Frolova . I. . . 50915 1 5 Peter Agback . . . . 50915 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'NMR assignment, corona, nsp1' 50915 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly_1 _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly_1 _Assembly.Entry_ID 50915 _Assembly.ID 1 _Assembly.Name nsp1 _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states no _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange no _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _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 nsp1 1 $entity_1 . . yes native no no . . . 50915 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 50915 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity_1 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MESLVPGFNEKTHVQLSLPV LQVRDVLVRGFGDSVEEVLS EARQHLKDGTCGLVEVEKGV LPQLEQPYVFIKRSDARTAP HGHVMVELVAELEGIQYGRS GETLGVLVPHVGEIPVAYRK VLLRKNGNKGAGGHSYGADL KSFDLGDELGTDPYEDFQEN WNTKHSSGVTRELMRELNGG ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states yes _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 180 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . MET . 50915 1 2 . GLU . 50915 1 3 . SER . 50915 1 4 . LEU . 50915 1 5 . VAL . 50915 1 6 . PRO . 50915 1 7 . GLY . 50915 1 8 . PHE . 50915 1 9 . ASN . 50915 1 10 . GLU . 50915 1 11 . LYS . 50915 1 12 . THR . 50915 1 13 . HIS . 50915 1 14 . VAL . 50915 1 15 . GLN . 50915 1 16 . LEU . 50915 1 17 . SER . 50915 1 18 . LEU . 50915 1 19 . PRO . 50915 1 20 . VAL . 50915 1 21 . LEU . 50915 1 22 . GLN . 50915 1 23 . VAL . 50915 1 24 . ARG . 50915 1 25 . ASP . 50915 1 26 . VAL . 50915 1 27 . LEU . 50915 1 28 . VAL . 50915 1 29 . ARG . 50915 1 30 . GLY . 50915 1 31 . PHE . 50915 1 32 . GLY . 50915 1 33 . ASP . 50915 1 34 . SER . 50915 1 35 . VAL . 50915 1 36 . GLU . 50915 1 37 . GLU . 50915 1 38 . VAL . 50915 1 39 . LEU . 50915 1 40 . SER . 50915 1 41 . GLU . 50915 1 42 . ALA . 50915 1 43 . ARG . 50915 1 44 . GLN . 50915 1 45 . HIS . 50915 1 46 . LEU . 50915 1 47 . LYS . 50915 1 48 . ASP . 50915 1 49 . GLY . 50915 1 50 . THR . 50915 1 51 . CYS . 50915 1 52 . GLY . 50915 1 53 . LEU . 50915 1 54 . VAL . 50915 1 55 . GLU . 50915 1 56 . VAL . 50915 1 57 . GLU . 50915 1 58 . LYS . 50915 1 59 . GLY . 50915 1 60 . VAL . 50915 1 61 . LEU . 50915 1 62 . PRO . 50915 1 63 . GLN . 50915 1 64 . LEU . 50915 1 65 . GLU . 50915 1 66 . GLN . 50915 1 67 . PRO . 50915 1 68 . TYR . 50915 1 69 . VAL . 50915 1 70 . PHE . 50915 1 71 . ILE . 50915 1 72 . LYS . 50915 1 73 . ARG . 50915 1 74 . SER . 50915 1 75 . ASP . 50915 1 76 . ALA . 50915 1 77 . ARG . 50915 1 78 . THR . 50915 1 79 . ALA . 50915 1 80 . PRO . 50915 1 81 . HIS . 50915 1 82 . GLY . 50915 1 83 . HIS . 50915 1 84 . VAL . 50915 1 85 . MET . 50915 1 86 . VAL . 50915 1 87 . GLU . 50915 1 88 . LEU . 50915 1 89 . VAL . 50915 1 90 . ALA . 50915 1 91 . GLU . 50915 1 92 . LEU . 50915 1 93 . GLU . 50915 1 94 . GLY . 50915 1 95 . ILE . 50915 1 96 . GLN . 50915 1 97 . TYR . 50915 1 98 . GLY . 50915 1 99 . ARG . 50915 1 100 . SER . 50915 1 101 . GLY . 50915 1 102 . GLU . 50915 1 103 . THR . 50915 1 104 . LEU . 50915 1 105 . GLY . 50915 1 106 . VAL . 50915 1 107 . LEU . 50915 1 108 . VAL . 50915 1 109 . PRO . 50915 1 110 . HIS . 50915 1 111 . VAL . 50915 1 112 . GLY . 50915 1 113 . GLU . 50915 1 114 . ILE . 50915 1 115 . PRO . 50915 1 116 . VAL . 50915 1 117 . ALA . 50915 1 118 . TYR . 50915 1 119 . ARG . 50915 1 120 . LYS . 50915 1 121 . VAL . 50915 1 122 . LEU . 50915 1 123 . LEU . 50915 1 124 . ARG . 50915 1 125 . LYS . 50915 1 126 . ASN . 50915 1 127 . GLY . 50915 1 128 . ASN . 50915 1 129 . LYS . 50915 1 130 . GLY . 50915 1 131 . ALA . 50915 1 132 . GLY . 50915 1 133 . GLY . 50915 1 134 . HIS . 50915 1 135 . SER . 50915 1 136 . TYR . 50915 1 137 . GLY . 50915 1 138 . ALA . 50915 1 139 . ASP . 50915 1 140 . LEU . 50915 1 141 . LYS . 50915 1 142 . SER . 50915 1 143 . PHE . 50915 1 144 . ASP . 50915 1 145 . LEU . 50915 1 146 . GLY . 50915 1 147 . ASP . 50915 1 148 . GLU . 50915 1 149 . LEU . 50915 1 150 . GLY . 50915 1 151 . THR . 50915 1 152 . ASP . 50915 1 153 . PRO . 50915 1 154 . TYR . 50915 1 155 . GLU . 50915 1 156 . ASP . 50915 1 157 . PHE . 50915 1 158 . GLN . 50915 1 159 . GLU . 50915 1 160 . ASN . 50915 1 161 . TRP . 50915 1 162 . ASN . 50915 1 163 . THR . 50915 1 164 . LYS . 50915 1 165 . HIS . 50915 1 166 . SER . 50915 1 167 . SER . 50915 1 168 . GLY . 50915 1 169 . VAL . 50915 1 170 . THR . 50915 1 171 . ARG . 50915 1 172 . GLU . 50915 1 173 . LEU . 50915 1 174 . MET . 50915 1 175 . ARG . 50915 1 176 . GLU . 50915 1 177 . LEU . 50915 1 178 . ASN . 50915 1 179 . GLY . 50915 1 180 . GLY . 50915 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 50915 1 . GLU 2 2 50915 1 . SER 3 3 50915 1 . LEU 4 4 50915 1 . VAL 5 5 50915 1 . PRO 6 6 50915 1 . GLY 7 7 50915 1 . PHE 8 8 50915 1 . ASN 9 9 50915 1 . GLU 10 10 50915 1 . LYS 11 11 50915 1 . THR 12 12 50915 1 . HIS 13 13 50915 1 . VAL 14 14 50915 1 . GLN 15 15 50915 1 . LEU 16 16 50915 1 . SER 17 17 50915 1 . LEU 18 18 50915 1 . PRO 19 19 50915 1 . VAL 20 20 50915 1 . LEU 21 21 50915 1 . GLN 22 22 50915 1 . VAL 23 23 50915 1 . ARG 24 24 50915 1 . ASP 25 25 50915 1 . VAL 26 26 50915 1 . LEU 27 27 50915 1 . VAL 28 28 50915 1 . ARG 29 29 50915 1 . GLY 30 30 50915 1 . PHE 31 31 50915 1 . GLY 32 32 50915 1 . ASP 33 33 50915 1 . SER 34 34 50915 1 . VAL 35 35 50915 1 . GLU 36 36 50915 1 . GLU 37 37 50915 1 . VAL 38 38 50915 1 . LEU 39 39 50915 1 . SER 40 40 50915 1 . GLU 41 41 50915 1 . ALA 42 42 50915 1 . ARG 43 43 50915 1 . GLN 44 44 50915 1 . HIS 45 45 50915 1 . LEU 46 46 50915 1 . LYS 47 47 50915 1 . ASP 48 48 50915 1 . GLY 49 49 50915 1 . THR 50 50 50915 1 . CYS 51 51 50915 1 . GLY 52 52 50915 1 . LEU 53 53 50915 1 . VAL 54 54 50915 1 . GLU 55 55 50915 1 . VAL 56 56 50915 1 . GLU 57 57 50915 1 . LYS 58 58 50915 1 . GLY 59 59 50915 1 . VAL 60 60 50915 1 . LEU 61 61 50915 1 . PRO 62 62 50915 1 . GLN 63 63 50915 1 . LEU 64 64 50915 1 . GLU 65 65 50915 1 . GLN 66 66 50915 1 . PRO 67 67 50915 1 . TYR 68 68 50915 1 . VAL 69 69 50915 1 . PHE 70 70 50915 1 . ILE 71 71 50915 1 . LYS 72 72 50915 1 . ARG 73 73 50915 1 . SER 74 74 50915 1 . ASP 75 75 50915 1 . ALA 76 76 50915 1 . ARG 77 77 50915 1 . THR 78 78 50915 1 . ALA 79 79 50915 1 . PRO 80 80 50915 1 . HIS 81 81 50915 1 . GLY 82 82 50915 1 . HIS 83 83 50915 1 . VAL 84 84 50915 1 . MET 85 85 50915 1 . VAL 86 86 50915 1 . GLU 87 87 50915 1 . LEU 88 88 50915 1 . VAL 89 89 50915 1 . ALA 90 90 50915 1 . GLU 91 91 50915 1 . LEU 92 92 50915 1 . GLU 93 93 50915 1 . GLY 94 94 50915 1 . ILE 95 95 50915 1 . GLN 96 96 50915 1 . TYR 97 97 50915 1 . GLY 98 98 50915 1 . ARG 99 99 50915 1 . SER 100 100 50915 1 . GLY 101 101 50915 1 . GLU 102 102 50915 1 . THR 103 103 50915 1 . LEU 104 104 50915 1 . GLY 105 105 50915 1 . VAL 106 106 50915 1 . LEU 107 107 50915 1 . VAL 108 108 50915 1 . PRO 109 109 50915 1 . HIS 110 110 50915 1 . VAL 111 111 50915 1 . GLY 112 112 50915 1 . GLU 113 113 50915 1 . ILE 114 114 50915 1 . PRO 115 115 50915 1 . VAL 116 116 50915 1 . ALA 117 117 50915 1 . TYR 118 118 50915 1 . ARG 119 119 50915 1 . LYS 120 120 50915 1 . VAL 121 121 50915 1 . LEU 122 122 50915 1 . LEU 123 123 50915 1 . ARG 124 124 50915 1 . LYS 125 125 50915 1 . ASN 126 126 50915 1 . GLY 127 127 50915 1 . ASN 128 128 50915 1 . LYS 129 129 50915 1 . GLY 130 130 50915 1 . ALA 131 131 50915 1 . GLY 132 132 50915 1 . GLY 133 133 50915 1 . HIS 134 134 50915 1 . SER 135 135 50915 1 . TYR 136 136 50915 1 . GLY 137 137 50915 1 . ALA 138 138 50915 1 . ASP 139 139 50915 1 . LEU 140 140 50915 1 . LYS 141 141 50915 1 . SER 142 142 50915 1 . PHE 143 143 50915 1 . ASP 144 144 50915 1 . LEU 145 145 50915 1 . GLY 146 146 50915 1 . ASP 147 147 50915 1 . GLU 148 148 50915 1 . LEU 149 149 50915 1 . GLY 150 150 50915 1 . THR 151 151 50915 1 . ASP 152 152 50915 1 . PRO 153 153 50915 1 . TYR 154 154 50915 1 . GLU 155 155 50915 1 . ASP 156 156 50915 1 . PHE 157 157 50915 1 . GLN 158 158 50915 1 . GLU 159 159 50915 1 . ASN 160 160 50915 1 . TRP 161 161 50915 1 . ASN 162 162 50915 1 . THR 163 163 50915 1 . LYS 164 164 50915 1 . HIS 165 165 50915 1 . SER 166 166 50915 1 . SER 167 167 50915 1 . GLY 168 168 50915 1 . VAL 169 169 50915 1 . THR 170 170 50915 1 . ARG 171 171 50915 1 . GLU 172 172 50915 1 . LEU 173 173 50915 1 . MET 174 174 50915 1 . ARG 175 175 50915 1 . GLU 176 176 50915 1 . LEU 177 177 50915 1 . ASN 178 178 50915 1 . GLY 179 179 50915 1 . GLY 180 180 50915 1 stop_ save_ #################### # Natural source # #################### save_natural_source_1 _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source_1 _Entity_natural_src_list.Entry_ID 50915 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity_1 . 2697049 organism . 'SARS coronavirus 2' SARS-CoV-2 . . Viruses . Betacoronavirus HCoV-SARS Wuhan-Hu-1 . . . . . . . . . . . . 50915 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source_1 _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source_1 _Entity_experimental_src_list.Entry_ID 50915 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli Rosetta2 . . plasmid . . pE-SUMOpro-3 . . . 50915 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 50915 _Sample.ID 1 _Sample.Name s1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number 1 _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'wt nsp1' '[U-100% 13C; U-100% 15N]' . . 1 $entity_1 . . 0.4 . . mM . . . . 50915 1 2 KCl 'natural abundance' . . . . . . 100 . . mM . . . . 50915 1 3 NaN3 'natural abundance' . . . . . . 1 . . mM . . . . 50915 1 4 DSS 'natural abundance' . . . . . . 0.1 . . mM . . . . 50915 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 50915 _Sample_condition_list.ID 1 _Sample_condition_list.Name 308K _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0.101 . M 50915 1 pH 7.5 . pH 50915 1 pressure 1 . atm 50915 1 temperature 308 . K 50915 1 stop_ save_ save_sample_conditions_2 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_2 _Sample_condition_list.Entry_ID 50915 _Sample_condition_list.ID 2 _Sample_condition_list.Name 298K _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0.101 . M 50915 2 pH 7.5 . pH 50915 2 pressure 1 . atm 50915 2 temperature 298 . K 50915 2 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 50915 _Software.ID 1 _Software.Type . _Software.Name TOPSPIN _Software.Version 3.5 _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID collection . 50915 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID 50915 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name cryo _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE III' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ ############################# # NMR applied experiments # ############################# save_experiment_list_1 _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list_1 _Experiment_list.Entry_ID 50915 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NUS_flag _Experiment.Interleaved_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Details _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50915 1 2 '3D HNCO' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50915 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chem_shift_reference_1 _Chem_shift_reference.Entry_ID 50915 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name DSS _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0 internal indirect . . . . . . 50915 1 H 1 DSS 'methyl protons' . . . . ppm 0 internal direct 1 . . . . . 50915 1 N 15 DSS 'methyl protons' . . . . ppm 0 internal indirect . . . . . . 50915 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 50915 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name 'wt nsp1' _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 50915 1 2 '3D HNCO' . . . 50915 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 $software_1 . . 50915 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 2 2 GLU C C 13 176.50 0.000 . 1 . . . . . 2 GLU C . 50915 1 2 . 1 . 1 3 3 SER H H 1 8.234 0.000 . 1 . . . . . 3 SER H . 50915 1 3 . 1 . 1 3 3 SER C C 13 174.218 0.016 . 1 . . . . . 3 SER C . 50915 1 4 . 1 . 1 3 3 SER CA C 13 58.531 0.025 . 1 . . . . . 3 SER CA . 50915 1 5 . 1 . 1 3 3 SER CB C 13 63.843 0.000 . 1 . . . . . 3 SER CB . 50915 1 6 . 1 . 1 3 3 SER N N 15 116.315 0.000 . 1 . . . . . 3 SER N . 50915 1 7 . 1 . 1 4 4 LEU H H 1 8.172 0.005 . 1 . . . . . 4 LEU H . 50915 1 8 . 1 . 1 4 4 LEU HA H 1 4.428 0.008 . 1 . . . . . 4 LEU HA . 50915 1 9 . 1 . 1 4 4 LEU C C 13 176.970 0.008 . 1 . . . . . 4 LEU C . 50915 1 10 . 1 . 1 4 4 LEU CA C 13 55.345 0.044 . 1 . . . . . 4 LEU CA . 50915 1 11 . 1 . 1 4 4 LEU CB C 13 42.633 0.000 . 1 . . . . . 4 LEU CB . 50915 1 12 . 1 . 1 4 4 LEU N N 15 124.048 0.049 . 1 . . . . . 4 LEU N . 50915 1 13 . 1 . 1 5 5 VAL H H 1 8.090 0.005 . 1 . . . . . 5 VAL H . 50915 1 14 . 1 . 1 5 5 VAL HA H 1 4.430 0.007 . 1 . . . . . 5 VAL HA . 50915 1 15 . 1 . 1 5 5 VAL C C 13 174.317 0.009 . 1 . . . . . 5 VAL C . 50915 1 16 . 1 . 1 5 5 VAL CA C 13 59.980 0.035 . 1 . . . . . 5 VAL CA . 50915 1 17 . 1 . 1 5 5 VAL CB C 13 32.741 0.000 . 1 . . . . . 5 VAL CB . 50915 1 18 . 1 . 1 5 5 VAL N N 15 122.031 0.085 . 1 . . . . . 5 VAL N . 50915 1 19 . 1 . 1 6 6 PRO C C 13 177.41 0.000 . 1 . . . . . 6 PRO C . 50915 1 20 . 1 . 1 6 6 PRO CA C 13 63.551 0.000 . 1 . . . . . 6 PRO CA . 50915 1 21 . 1 . 1 6 6 PRO CB C 13 32.155 0.000 . 1 . . . . . 6 PRO CB . 50915 1 22 . 1 . 1 6 6 PRO N N 15 139.476 0.000 . 1 . . . . . 6 PRO N . 50915 1 23 . 1 . 1 7 7 GLY H H 1 8.457 0.008 . 1 . . . . . 7 GLY H . 50915 1 24 . 1 . 1 7 7 GLY HA2 H 1 4.005 0.007 . 1 . . . . . 7 GLY HA2 . 50915 1 25 . 1 . 1 7 7 GLY C C 13 173.610 0.000 . 1 . . . . . 7 GLY C . 50915 1 26 . 1 . 1 7 7 GLY CA C 13 45.391 0.042 . 1 . . . . . 7 GLY CA . 50915 1 27 . 1 . 1 7 7 GLY N N 15 109.080 0.003 . 1 . . . . . 7 GLY N . 50915 1 28 . 1 . 1 8 8 PHE H H 1 7.845 0.006 . 1 . . . . . 8 PHE H . 50915 1 29 . 1 . 1 8 8 PHE CA C 13 57.254 0.000 . 1 . . . . . 8 PHE CA . 50915 1 30 . 1 . 1 8 8 PHE CB C 13 40.181 0.000 . 1 . . . . . 8 PHE CB . 50915 1 31 . 1 . 1 8 8 PHE N N 15 118.667 0.048 . 1 . . . . . 8 PHE N . 50915 1 32 . 1 . 1 9 9 ASN H H 1 8.634 0.006 . 1 . . . . . 9 ASN H . 50915 1 33 . 1 . 1 9 9 ASN C C 13 175.093 0.000 . 1 . . . . . 9 ASN C . 50915 1 34 . 1 . 1 9 9 ASN N N 15 121.448 0.000 . 1 . . . . . 9 ASN N . 50915 1 35 . 1 . 1 10 10 GLU H H 1 8.635 0.005 . 1 . . . . . 10 GLU H . 50915 1 36 . 1 . 1 10 10 GLU C C 13 176.918 0.000 . 1 . . . . . 10 GLU C . 50915 1 37 . 1 . 1 10 10 GLU CA C 13 57.706 0.008 . 1 . . . . . 10 GLU CA . 50915 1 38 . 1 . 1 10 10 GLU N N 15 123.355 0.000 . 1 . . . . . 10 GLU N . 50915 1 39 . 1 . 1 11 11 LYS H H 1 8.449 0.004 . 1 . . . . . 11 LYS H . 50915 1 40 . 1 . 1 11 11 LYS N N 15 118.160 0.000 . 1 . . . . . 11 LYS N . 50915 1 41 . 1 . 1 12 12 THR C C 13 174.646 0.044 . 1 . . . . . 12 THR C . 50915 1 42 . 1 . 1 12 12 THR CA C 13 62.621 0.025 . 1 . . . . . 12 THR CA . 50915 1 43 . 1 . 1 12 12 THR CB C 13 69.954 0.000 . 1 . . . . . 12 THR CB . 50915 1 44 . 1 . 1 13 13 HIS H H 1 8.261 0.002 . 1 . . . . . 13 HIS H . 50915 1 45 . 1 . 1 13 13 HIS HA H 1 4.374 0.007 . 1 . . . . . 13 HIS HA . 50915 1 46 . 1 . 1 13 13 HIS C C 13 173.598 0.030 . 1 . . . . . 13 HIS C . 50915 1 47 . 1 . 1 13 13 HIS CA C 13 56.478 0.063 . 1 . . . . . 13 HIS CA . 50915 1 48 . 1 . 1 13 13 HIS CB C 13 35.110 0.000 . 1 . . . . . 13 HIS CB . 50915 1 49 . 1 . 1 13 13 HIS N N 15 122.177 0.000 . 1 . . . . . 13 HIS N . 50915 1 50 . 1 . 1 14 14 VAL H H 1 8.985 0.005 . 1 . . . . . 14 VAL H . 50915 1 51 . 1 . 1 14 14 VAL HA H 1 4.602 0.002 . 1 . . . . . 14 VAL HA . 50915 1 52 . 1 . 1 14 14 VAL C C 13 173.779 0.000 . 1 . . . . . 14 VAL C . 50915 1 53 . 1 . 1 14 14 VAL CA C 13 60.009 0.038 . 1 . . . . . 14 VAL CA . 50915 1 54 . 1 . 1 14 14 VAL CB C 13 35.299 0.029 . 1 . . . . . 14 VAL CB . 50915 1 55 . 1 . 1 14 14 VAL N N 15 117.034 0.040 . 1 . . . . . 14 VAL N . 50915 1 56 . 1 . 1 15 15 GLN H H 1 8.626 0.005 . 1 . . . . . 15 GLN H . 50915 1 57 . 1 . 1 15 15 GLN HA H 1 4.876 0.006 . 1 . . . . . 15 GLN HA . 50915 1 58 . 1 . 1 15 15 GLN C C 13 174.822 0.014 . 1 . . . . . 15 GLN C . 50915 1 59 . 1 . 1 15 15 GLN CA C 13 55.395 0.048 . 1 . . . . . 15 GLN CA . 50915 1 60 . 1 . 1 15 15 GLN CB C 13 29.950 0.032 . 1 . . . . . 15 GLN CB . 50915 1 61 . 1 . 1 15 15 GLN N N 15 126.048 0.049 . 1 . . . . . 15 GLN N . 50915 1 62 . 1 . 1 16 16 LEU H H 1 8.977 0.006 . 1 . . . . . 16 LEU H . 50915 1 63 . 1 . 1 16 16 LEU HA H 1 4.912 0.015 . 1 . . . . . 16 LEU HA . 50915 1 64 . 1 . 1 16 16 LEU C C 13 175.666 0.022 . 1 . . . . . 16 LEU C . 50915 1 65 . 1 . 1 16 16 LEU CA C 13 53.913 0.067 . 1 . . . . . 16 LEU CA . 50915 1 66 . 1 . 1 16 16 LEU CB C 13 45.951 0.063 . 1 . . . . . 16 LEU CB . 50915 1 67 . 1 . 1 16 16 LEU N N 15 125.589 0.050 . 1 . . . . . 16 LEU N . 50915 1 68 . 1 . 1 17 17 SER H H 1 8.635 0.005 . 1 . . . . . 17 SER H . 50915 1 69 . 1 . 1 17 17 SER HA H 1 5.108 0.005 . 1 . . . . . 17 SER HA . 50915 1 70 . 1 . 1 17 17 SER C C 13 174.272 0.094 . 1 . . . . . 17 SER C . 50915 1 71 . 1 . 1 17 17 SER CA C 13 56.857 0.053 . 1 . . . . . 17 SER CA . 50915 1 72 . 1 . 1 17 17 SER CB C 13 63.366 0.065 . 1 . . . . . 17 SER CB . 50915 1 73 . 1 . 1 17 17 SER N N 15 117.119 0.049 . 1 . . . . . 17 SER N . 50915 1 74 . 1 . 1 18 18 LEU H H 1 9.188 0.007 . 1 . . . . . 18 LEU H . 50915 1 75 . 1 . 1 18 18 LEU CA C 13 51.632 0.050 . 1 . . . . . 18 LEU CA . 50915 1 76 . 1 . 1 18 18 LEU CB C 13 43.902 0.000 . 1 . . . . . 18 LEU CB . 50915 1 77 . 1 . 1 18 18 LEU N N 15 126.800 0.068 . 1 . . . . . 18 LEU N . 50915 1 78 . 1 . 1 19 19 PRO HA H 1 4.093 0.009 . 1 . . . . . 19 PRO HA . 50915 1 79 . 1 . 1 19 19 PRO C C 13 174.388 0.009 . 1 . . . . . 19 PRO C . 50915 1 80 . 1 . 1 19 19 PRO CA C 13 62.333 0.035 . 1 . . . . . 19 PRO CA . 50915 1 81 . 1 . 1 19 19 PRO CB C 13 32.222 0.000 . 1 . . . . . 19 PRO CB . 50915 1 82 . 1 . 1 20 20 VAL H H 1 8.441 0.006 . 1 . . . . . 20 VAL H . 50915 1 83 . 1 . 1 20 20 VAL HA H 1 4.733 0.008 . 1 . . . . . 20 VAL HA . 50915 1 84 . 1 . 1 20 20 VAL C C 13 174.961 0.014 . 1 . . . . . 20 VAL C . 50915 1 85 . 1 . 1 20 20 VAL CA C 13 61.171 0.041 . 1 . . . . . 20 VAL CA . 50915 1 86 . 1 . 1 20 20 VAL CB C 13 31.758 0.015 . 1 . . . . . 20 VAL CB . 50915 1 87 . 1 . 1 20 20 VAL N N 15 124.724 0.050 . 1 . . . . . 20 VAL N . 50915 1 88 . 1 . 1 21 21 LEU H H 1 8.901 0.005 . 1 . . . . . 21 LEU H . 50915 1 89 . 1 . 1 21 21 LEU HA H 1 4.721 0.009 . 1 . . . . . 21 LEU HA . 50915 1 90 . 1 . 1 21 21 LEU C C 13 176.742 0.013 . 1 . . . . . 21 LEU C . 50915 1 91 . 1 . 1 21 21 LEU CA C 13 51.989 0.030 . 1 . . . . . 21 LEU CA . 50915 1 92 . 1 . 1 21 21 LEU CB C 13 43.263 0.078 . 1 . . . . . 21 LEU CB . 50915 1 93 . 1 . 1 21 21 LEU N N 15 126.211 0.048 . 1 . . . . . 21 LEU N . 50915 1 94 . 1 . 1 22 22 GLN H H 1 9.133 0.005 . 1 . . . . . 22 GLN H . 50915 1 95 . 1 . 1 22 22 GLN HA H 1 4.508 0.009 . 1 . . . . . 22 GLN HA . 50915 1 96 . 1 . 1 22 22 GLN C C 13 178.546 0.013 . 1 . . . . . 22 GLN C . 50915 1 97 . 1 . 1 22 22 GLN CA C 13 55.479 0.059 . 1 . . . . . 22 GLN CA . 50915 1 98 . 1 . 1 22 22 GLN CB C 13 29.270 0.019 . 1 . . . . . 22 GLN CB . 50915 1 99 . 1 . 1 22 22 GLN N N 15 121.053 0.049 . 1 . . . . . 22 GLN N . 50915 1 100 . 1 . 1 23 23 VAL H H 1 9.075 0.006 . 1 . . . . . 23 VAL H . 50915 1 101 . 1 . 1 23 23 VAL HA H 1 3.786 0.008 . 1 . . . . . 23 VAL HA . 50915 1 102 . 1 . 1 23 23 VAL C C 13 175.938 0.004 . 1 . . . . . 23 VAL C . 50915 1 103 . 1 . 1 23 23 VAL CA C 13 65.909 0.054 . 1 . . . . . 23 VAL CA . 50915 1 104 . 1 . 1 23 23 VAL CB C 13 31.282 0.033 . 1 . . . . . 23 VAL CB . 50915 1 105 . 1 . 1 23 23 VAL N N 15 125.682 0.051 . 1 . . . . . 23 VAL N . 50915 1 106 . 1 . 1 24 24 ARG H H 1 8.065 0.005 . 1 . . . . . 24 ARG H . 50915 1 107 . 1 . 1 24 24 ARG HA H 1 4.231 0.012 . 1 . . . . . 24 ARG HA . 50915 1 108 . 1 . 1 24 24 ARG C C 13 176.754 0.005 . 1 . . . . . 24 ARG C . 50915 1 109 . 1 . 1 24 24 ARG CA C 13 58.057 0.048 . 1 . . . . . 24 ARG CA . 50915 1 110 . 1 . 1 24 24 ARG CB C 13 29.821 0.012 . 1 . . . . . 24 ARG CB . 50915 1 111 . 1 . 1 24 24 ARG N N 15 117.723 0.048 . 1 . . . . . 24 ARG N . 50915 1 112 . 1 . 1 25 25 ASP H H 1 7.720 0.008 . 1 . . . . . 25 ASP H . 50915 1 113 . 1 . 1 25 25 ASP HA H 1 4.606 0.006 . 1 . . . . . 25 ASP HA . 50915 1 114 . 1 . 1 25 25 ASP C C 13 176.357 0.020 . 1 . . . . . 25 ASP C . 50915 1 115 . 1 . 1 25 25 ASP CA C 13 54.983 0.085 . 1 . . . . . 25 ASP CA . 50915 1 116 . 1 . 1 25 25 ASP CB C 13 42.384 0.034 . 1 . . . . . 25 ASP CB . 50915 1 117 . 1 . 1 25 25 ASP N N 15 117.139 0.049 . 1 . . . . . 25 ASP N . 50915 1 118 . 1 . 1 26 26 VAL H H 1 6.909 0.008 . 1 . . . . . 26 VAL H . 50915 1 119 . 1 . 1 26 26 VAL HA H 1 3.977 0.010 . 1 . . . . . 26 VAL HA . 50915 1 120 . 1 . 1 26 26 VAL C C 13 177.212 0.031 . 1 . . . . . 26 VAL C . 50915 1 121 . 1 . 1 26 26 VAL CA C 13 64.155 0.068 . 1 . . . . . 26 VAL CA . 50915 1 122 . 1 . 1 26 26 VAL CB C 13 32.117 0.000 . 1 . . . . . 26 VAL CB . 50915 1 123 . 1 . 1 26 26 VAL N N 15 118.221 0.048 . 1 . . . . . 26 VAL N . 50915 1 124 . 1 . 1 27 27 LEU H H 1 9.394 0.009 . 1 . . . . . 27 LEU H . 50915 1 125 . 1 . 1 27 27 LEU HA H 1 4.282 0.005 . 1 . . . . . 27 LEU HA . 50915 1 126 . 1 . 1 27 27 LEU C C 13 177.838 0.000 . 1 . . . . . 27 LEU C . 50915 1 127 . 1 . 1 27 27 LEU CA C 13 57.390 0.056 . 1 . . . . . 27 LEU CA . 50915 1 128 . 1 . 1 27 27 LEU CB C 13 43.118 0.000 . 1 . . . . . 27 LEU CB . 50915 1 129 . 1 . 1 27 27 LEU N N 15 131.739 0.048 . 1 . . . . . 27 LEU N . 50915 1 130 . 1 . 1 28 28 VAL H H 1 10.056 0.009 . 1 . . . . . 28 VAL H . 50915 1 131 . 1 . 1 28 28 VAL HA H 1 4.076 0.017 . 1 . . . . . 28 VAL HA . 50915 1 132 . 1 . 1 28 28 VAL C C 13 174.887 0.009 . 1 . . . . . 28 VAL C . 50915 1 133 . 1 . 1 28 28 VAL CA C 13 62.944 0.056 . 1 . . . . . 28 VAL CA . 50915 1 134 . 1 . 1 28 28 VAL CB C 13 31.814 0.000 . 1 . . . . . 28 VAL CB . 50915 1 135 . 1 . 1 28 28 VAL N N 15 126.705 0.049 . 1 . . . . . 28 VAL N . 50915 1 136 . 1 . 1 29 29 ARG H H 1 8.035 0.006 . 1 . . . . . 29 ARG H . 50915 1 137 . 1 . 1 29 29 ARG HA H 1 3.885 0.000 . 1 . . . . . 29 ARG HA . 50915 1 138 . 1 . 1 29 29 ARG C C 13 175.271 0.015 . 1 . . . . . 29 ARG C . 50915 1 139 . 1 . 1 29 29 ARG CA C 13 57.266 0.060 . 1 . . . . . 29 ARG CA . 50915 1 140 . 1 . 1 29 29 ARG CB C 13 30.158 0.042 . 1 . . . . . 29 ARG CB . 50915 1 141 . 1 . 1 29 29 ARG N N 15 119.808 0.021 . 1 . . . . . 29 ARG N . 50915 1 142 . 1 . 1 30 30 GLY H H 1 7.277 0.008 . 1 . . . . . 30 GLY H . 50915 1 143 . 1 . 1 30 30 GLY HA2 H 1 4.437 0.005 . 2 . . . . . 30 GLY HA2 . 50915 1 144 . 1 . 1 30 30 GLY HA3 H 1 4.076 0.000 . 2 . . . . . 30 GLY HA3 . 50915 1 145 . 1 . 1 30 30 GLY C C 13 172.143 0.026 . 1 . . . . . 30 GLY C . 50915 1 146 . 1 . 1 30 30 GLY CA C 13 45.470 0.038 . 1 . . . . . 30 GLY CA . 50915 1 147 . 1 . 1 30 30 GLY N N 15 106.001 0.040 . 1 . . . . . 30 GLY N . 50915 1 148 . 1 . 1 31 31 PHE H H 1 9.697 0.006 . 1 . . . . . 31 PHE H . 50915 1 149 . 1 . 1 31 31 PHE HA H 1 4.607 0.012 . 1 . . . . . 31 PHE HA . 50915 1 150 . 1 . 1 31 31 PHE C C 13 175.516 0.030 . 1 . . . . . 31 PHE C . 50915 1 151 . 1 . 1 31 31 PHE CA C 13 59.632 0.028 . 1 . . . . . 31 PHE CA . 50915 1 152 . 1 . 1 31 31 PHE CB C 13 41.242 0.054 . 1 . . . . . 31 PHE CB . 50915 1 153 . 1 . 1 31 31 PHE N N 15 115.678 0.039 . 1 . . . . . 31 PHE N . 50915 1 154 . 1 . 1 32 32 GLY H H 1 7.542 0.008 . 1 . . . . . 32 GLY H . 50915 1 155 . 1 . 1 32 32 GLY HA2 H 1 3.882 0.000 . 2 . . . . . 32 GLY HA2 . 50915 1 156 . 1 . 1 32 32 GLY HA3 H 1 4.249 0.003 . 2 . . . . . 32 GLY HA3 . 50915 1 157 . 1 . 1 32 32 GLY C C 13 172.556 0.001 . 1 . . . . . 32 GLY C . 50915 1 158 . 1 . 1 32 32 GLY CA C 13 45.787 0.058 . 1 . . . . . 32 GLY CA . 50915 1 159 . 1 . 1 32 32 GLY N N 15 106.783 0.044 . 1 . . . . . 32 GLY N . 50915 1 160 . 1 . 1 33 33 ASP H H 1 8.481 0.006 . 1 . . . . . 33 ASP H . 50915 1 161 . 1 . 1 33 33 ASP HA H 1 4.969 0.015 . 1 . . . . . 33 ASP HA . 50915 1 162 . 1 . 1 33 33 ASP C C 13 175.714 0.030 . 1 . . . . . 33 ASP C . 50915 1 163 . 1 . 1 33 33 ASP CA C 13 55.370 0.076 . 1 . . . . . 33 ASP CA . 50915 1 164 . 1 . 1 33 33 ASP CB C 13 43.093 0.046 . 1 . . . . . 33 ASP CB . 50915 1 165 . 1 . 1 33 33 ASP N N 15 115.747 0.046 . 1 . . . . . 33 ASP N . 50915 1 166 . 1 . 1 34 34 SER H H 1 7.559 0.007 . 1 . . . . . 34 SER H . 50915 1 167 . 1 . 1 34 34 SER HA H 1 4.775 0.006 . 1 . . . . . 34 SER HA . 50915 1 168 . 1 . 1 34 34 SER C C 13 174.456 0.000 . 1 . . . . . 34 SER C . 50915 1 169 . 1 . 1 34 34 SER CA C 13 56.413 0.027 . 1 . . . . . 34 SER CA . 50915 1 170 . 1 . 1 34 34 SER CB C 13 66.201 0.000 . 1 . . . . . 34 SER CB . 50915 1 171 . 1 . 1 34 34 SER N N 15 112.216 0.050 . 1 . . . . . 34 SER N . 50915 1 172 . 1 . 1 35 35 VAL H H 1 9.145 0.001 . 1 . . . . . 35 VAL H . 50915 1 173 . 1 . 1 35 35 VAL C C 13 176.157 0.019 . 1 . . . . . 35 VAL C . 50915 1 174 . 1 . 1 35 35 VAL CA C 13 67.452 0.005 . 1 . . . . . 35 VAL CA . 50915 1 175 . 1 . 1 35 35 VAL CB C 13 31.678 0.000 . 1 . . . . . 35 VAL CB . 50915 1 176 . 1 . 1 35 35 VAL N N 15 124.089 0.000 . 1 . . . . . 35 VAL N . 50915 1 177 . 1 . 1 36 36 GLU H H 1 8.728 0.005 . 1 . . . . . 36 GLU H . 50915 1 178 . 1 . 1 36 36 GLU HA H 1 4.167 0.009 . 1 . . . . . 36 GLU HA . 50915 1 179 . 1 . 1 36 36 GLU C C 13 179.424 0.012 . 1 . . . . . 36 GLU C . 50915 1 180 . 1 . 1 36 36 GLU CA C 13 60.054 0.050 . 1 . . . . . 36 GLU CA . 50915 1 181 . 1 . 1 36 36 GLU CB C 13 29.346 0.024 . 1 . . . . . 36 GLU CB . 50915 1 182 . 1 . 1 36 36 GLU N N 15 117.040 0.048 . 1 . . . . . 36 GLU N . 50915 1 183 . 1 . 1 37 37 GLU H H 1 7.576 0.008 . 1 . . . . . 37 GLU H . 50915 1 184 . 1 . 1 37 37 GLU HA H 1 4.019 0.003 . 1 . . . . . 37 GLU HA . 50915 1 185 . 1 . 1 37 37 GLU C C 13 178.721 0.003 . 1 . . . . . 37 GLU C . 50915 1 186 . 1 . 1 37 37 GLU CA C 13 59.185 0.038 . 1 . . . . . 37 GLU CA . 50915 1 187 . 1 . 1 37 37 GLU CB C 13 31.214 0.087 . 1 . . . . . 37 GLU CB . 50915 1 188 . 1 . 1 37 37 GLU N N 15 119.096 0.041 . 1 . . . . . 37 GLU N . 50915 1 189 . 1 . 1 38 38 VAL H H 1 8.507 0.005 . 1 . . . . . 38 VAL H . 50915 1 190 . 1 . 1 38 38 VAL HA H 1 4.220 0.010 . 1 . . . . . 38 VAL HA . 50915 1 191 . 1 . 1 38 38 VAL C C 13 177.913 0.014 . 1 . . . . . 38 VAL C . 50915 1 192 . 1 . 1 38 38 VAL CA C 13 65.854 0.039 . 1 . . . . . 38 VAL CA . 50915 1 193 . 1 . 1 38 38 VAL CB C 13 30.463 0.025 . 1 . . . . . 38 VAL CB . 50915 1 194 . 1 . 1 38 38 VAL N N 15 112.416 0.047 . 1 . . . . . 38 VAL N . 50915 1 195 . 1 . 1 39 39 LEU H H 1 7.604 0.007 . 1 . . . . . 39 LEU H . 50915 1 196 . 1 . 1 39 39 LEU HA H 1 3.949 0.007 . 1 . . . . . 39 LEU HA . 50915 1 197 . 1 . 1 39 39 LEU C C 13 178.665 0.010 . 1 . . . . . 39 LEU C . 50915 1 198 . 1 . 1 39 39 LEU CA C 13 58.333 0.043 . 1 . . . . . 39 LEU CA . 50915 1 199 . 1 . 1 39 39 LEU CB C 13 42.067 0.056 . 1 . . . . . 39 LEU CB . 50915 1 200 . 1 . 1 39 39 LEU N N 15 120.659 0.056 . 1 . . . . . 39 LEU N . 50915 1 201 . 1 . 1 40 40 SER H H 1 7.501 0.006 . 1 . . . . . 40 SER H . 50915 1 202 . 1 . 1 40 40 SER HA H 1 4.070 0.011 . 1 . . . . . 40 SER HA . 50915 1 203 . 1 . 1 40 40 SER C C 13 178.341 0.000 . 1 . . . . . 40 SER C . 50915 1 204 . 1 . 1 40 40 SER CA C 13 61.765 0.075 . 1 . . . . . 40 SER CA . 50915 1 205 . 1 . 1 40 40 SER CB C 13 62.523 0.070 . 1 . . . . . 40 SER CB . 50915 1 206 . 1 . 1 40 40 SER N N 15 113.741 0.041 . 1 . . . . . 40 SER N . 50915 1 207 . 1 . 1 41 41 GLU H H 1 8.676 0.007 . 1 . . . . . 41 GLU H . 50915 1 208 . 1 . 1 41 41 GLU HA H 1 4.092 0.004 . 1 . . . . . 41 GLU HA . 50915 1 209 . 1 . 1 41 41 GLU C C 13 179.355 0.020 . 1 . . . . . 41 GLU C . 50915 1 210 . 1 . 1 41 41 GLU CA C 13 58.860 0.048 . 1 . . . . . 41 GLU CA . 50915 1 211 . 1 . 1 41 41 GLU CB C 13 30.892 0.002 . 1 . . . . . 41 GLU CB . 50915 1 212 . 1 . 1 41 41 GLU N N 15 121.399 0.044 . 1 . . . . . 41 GLU N . 50915 1 213 . 1 . 1 42 42 ALA H H 1 8.431 0.007 . 1 . . . . . 42 ALA H . 50915 1 214 . 1 . 1 42 42 ALA HA H 1 4.201 0.006 . 1 . . . . . 42 ALA HA . 50915 1 215 . 1 . 1 42 42 ALA C C 13 179.310 0.012 . 1 . . . . . 42 ALA C . 50915 1 216 . 1 . 1 42 42 ALA CA C 13 55.901 0.042 . 1 . . . . . 42 ALA CA . 50915 1 217 . 1 . 1 42 42 ALA CB C 13 18.529 0.043 . 1 . . . . . 42 ALA CB . 50915 1 218 . 1 . 1 42 42 ALA N N 15 123.555 0.050 . 1 . . . . . 42 ALA N . 50915 1 219 . 1 . 1 43 43 ARG H H 1 7.731 0.006 . 1 . . . . . 43 ARG H . 50915 1 220 . 1 . 1 43 43 ARG HA H 1 4.145 0.005 . 1 . . . . . 43 ARG HA . 50915 1 221 . 1 . 1 43 43 ARG C C 13 178.844 0.010 . 1 . . . . . 43 ARG C . 50915 1 222 . 1 . 1 43 43 ARG CA C 13 60.599 0.036 . 1 . . . . . 43 ARG CA . 50915 1 223 . 1 . 1 43 43 ARG CB C 13 30.265 0.011 . 1 . . . . . 43 ARG CB . 50915 1 224 . 1 . 1 43 43 ARG N N 15 114.693 0.089 . 1 . . . . . 43 ARG N . 50915 1 225 . 1 . 1 44 44 GLN H H 1 7.676 0.006 . 1 . . . . . 44 GLN H . 50915 1 226 . 1 . 1 44 44 GLN HA H 1 3.957 0.001 . 1 . . . . . 44 GLN HA . 50915 1 227 . 1 . 1 44 44 GLN C C 13 177.839 0.019 . 1 . . . . . 44 GLN C . 50915 1 228 . 1 . 1 44 44 GLN CA C 13 58.941 0.062 . 1 . . . . . 44 GLN CA . 50915 1 229 . 1 . 1 44 44 GLN CB C 13 28.472 0.058 . 1 . . . . . 44 GLN CB . 50915 1 230 . 1 . 1 44 44 GLN N N 15 119.736 0.044 . 1 . . . . . 44 GLN N . 50915 1 231 . 1 . 1 45 45 HIS H H 1 8.399 0.005 . 1 . . . . . 45 HIS H . 50915 1 232 . 1 . 1 45 45 HIS HA H 1 4.425 0.005 . 1 . . . . . 45 HIS HA . 50915 1 233 . 1 . 1 45 45 HIS C C 13 178.602 0.014 . 1 . . . . . 45 HIS C . 50915 1 234 . 1 . 1 45 45 HIS CA C 13 60.002 0.081 . 1 . . . . . 45 HIS CA . 50915 1 235 . 1 . 1 45 45 HIS CB C 13 29.658 0.012 . 1 . . . . . 45 HIS CB . 50915 1 236 . 1 . 1 45 45 HIS N N 15 117.355 0.050 . 1 . . . . . 45 HIS N . 50915 1 237 . 1 . 1 46 46 LEU H H 1 8.762 0.005 . 1 . . . . . 46 LEU H . 50915 1 238 . 1 . 1 46 46 LEU HA H 1 4.095 0.006 . 1 . . . . . 46 LEU HA . 50915 1 239 . 1 . 1 46 46 LEU C C 13 179.535 0.000 . 1 . . . . . 46 LEU C . 50915 1 240 . 1 . 1 46 46 LEU CA C 13 58.471 0.043 . 1 . . . . . 46 LEU CA . 50915 1 241 . 1 . 1 46 46 LEU CB C 13 42.064 0.081 . 1 . . . . . 46 LEU CB . 50915 1 242 . 1 . 1 46 46 LEU N N 15 121.627 0.043 . 1 . . . . . 46 LEU N . 50915 1 243 . 1 . 1 47 47 LYS H H 1 7.658 0.007 . 1 . . . . . 47 LYS H . 50915 1 244 . 1 . 1 47 47 LYS HA H 1 4.033 0.006 . 1 . . . . . 47 LYS HA . 50915 1 245 . 1 . 1 47 47 LYS C C 13 178.273 0.032 . 1 . . . . . 47 LYS C . 50915 1 246 . 1 . 1 47 47 LYS CA C 13 59.462 0.047 . 1 . . . . . 47 LYS CA . 50915 1 247 . 1 . 1 47 47 LYS CB C 13 32.242 0.002 . 1 . . . . . 47 LYS CB . 50915 1 248 . 1 . 1 47 47 LYS N N 15 120.131 0.047 . 1 . . . . . 47 LYS N . 50915 1 249 . 1 . 1 48 48 ASP H H 1 8.007 0.005 . 1 . . . . . 48 ASP H . 50915 1 250 . 1 . 1 48 48 ASP HA H 1 4.355 0.004 . 1 . . . . . 48 ASP HA . 50915 1 251 . 1 . 1 48 48 ASP C C 13 176.935 0.013 . 1 . . . . . 48 ASP C . 50915 1 252 . 1 . 1 48 48 ASP CA C 13 55.209 0.070 . 1 . . . . . 48 ASP CA . 50915 1 253 . 1 . 1 48 48 ASP CB C 13 41.736 0.000 . 1 . . . . . 48 ASP CB . 50915 1 254 . 1 . 1 48 48 ASP N N 15 117.026 0.071 . 1 . . . . . 48 ASP N . 50915 1 255 . 1 . 1 49 49 GLY H H 1 7.934 0.009 . 1 . . . . . 49 GLY H . 50915 1 256 . 1 . 1 49 49 GLY HA2 H 1 4.339 0.000 . 1 . . . . . 49 GLY HA2 . 50915 1 257 . 1 . 1 49 49 GLY C C 13 176.189 0.010 . 1 . . . . . 49 GLY C . 50915 1 258 . 1 . 1 49 49 GLY CA C 13 47.041 0.038 . 1 . . . . . 49 GLY CA . 50915 1 259 . 1 . 1 49 49 GLY N N 15 108.929 0.054 . 1 . . . . . 49 GLY N . 50915 1 260 . 1 . 1 50 50 THR H H 1 8.905 0.005 . 1 . . . . . 50 THR H . 50915 1 261 . 1 . 1 50 50 THR HA H 1 4.927 0.008 . 1 . . . . . 50 THR HA . 50915 1 262 . 1 . 1 50 50 THR C C 13 174.198 0.045 . 1 . . . . . 50 THR C . 50915 1 263 . 1 . 1 50 50 THR CA C 13 60.402 0.057 . 1 . . . . . 50 THR CA . 50915 1 264 . 1 . 1 50 50 THR CB C 13 67.454 0.032 . 1 . . . . . 50 THR CB . 50915 1 265 . 1 . 1 50 50 THR N N 15 110.617 0.057 . 1 . . . . . 50 THR N . 50915 1 266 . 1 . 1 51 51 CYS H H 1 8.430 0.005 . 1 . . . . . 51 CYS H . 50915 1 267 . 1 . 1 51 51 CYS HA H 1 5.419 0.014 . 1 . . . . . 51 CYS HA . 50915 1 268 . 1 . 1 51 51 CYS C C 13 172.965 0.026 . 1 . . . . . 51 CYS C . 50915 1 269 . 1 . 1 51 51 CYS CA C 13 57.681 0.040 . 1 . . . . . 51 CYS CA . 50915 1 270 . 1 . 1 51 51 CYS CB C 13 30.988 0.021 . 1 . . . . . 51 CYS CB . 50915 1 271 . 1 . 1 51 51 CYS N N 15 121.242 0.059 . 1 . . . . . 51 CYS N . 50915 1 272 . 1 . 1 52 52 GLY H H 1 9.785 0.010 . 1 . . . . . 52 GLY H . 50915 1 273 . 1 . 1 52 52 GLY HA2 H 1 3.235 0.014 . 2 . . . . . 52 GLY HA2 . 50915 1 274 . 1 . 1 52 52 GLY HA3 H 1 3.243 0.002 . 2 . . . . . 52 GLY HA3 . 50915 1 275 . 1 . 1 52 52 GLY C C 13 169.993 0.000 . 1 . . . . . 52 GLY C . 50915 1 276 . 1 . 1 52 52 GLY CA C 13 43.807 0.032 . 1 . . . . . 52 GLY CA . 50915 1 277 . 1 . 1 52 52 GLY N N 15 112.995 0.050 . 1 . . . . . 52 GLY N . 50915 1 278 . 1 . 1 53 53 LEU H H 1 8.815 0.006 . 1 . . . . . 53 LEU H . 50915 1 279 . 1 . 1 53 53 LEU HA H 1 5.178 0.012 . 1 . . . . . 53 LEU HA . 50915 1 280 . 1 . 1 53 53 LEU C C 13 174.189 0.012 . 1 . . . . . 53 LEU C . 50915 1 281 . 1 . 1 53 53 LEU CA C 13 53.529 0.048 . 1 . . . . . 53 LEU CA . 50915 1 282 . 1 . 1 53 53 LEU CB C 13 47.215 0.023 . 1 . . . . . 53 LEU CB . 50915 1 283 . 1 . 1 53 53 LEU N N 15 120.177 0.047 . 1 . . . . . 53 LEU N . 50915 1 284 . 1 . 1 54 54 VAL H H 1 9.464 0.005 . 1 . . . . . 54 VAL H . 50915 1 285 . 1 . 1 54 54 VAL HA H 1 5.168 0.000 . 1 . . . . . 54 VAL HA . 50915 1 286 . 1 . 1 54 54 VAL C C 13 176.403 0.011 . 1 . . . . . 54 VAL C . 50915 1 287 . 1 . 1 54 54 VAL CA C 13 60.142 0.040 . 1 . . . . . 54 VAL CA . 50915 1 288 . 1 . 1 54 54 VAL CB C 13 33.768 0.028 . 1 . . . . . 54 VAL CB . 50915 1 289 . 1 . 1 54 54 VAL N N 15 125.198 0.047 . 1 . . . . . 54 VAL N . 50915 1 290 . 1 . 1 55 55 GLU H H 1 9.008 0.006 . 1 . . . . . 55 GLU H . 50915 1 291 . 1 . 1 55 55 GLU HA H 1 4.823 0.000 . 1 . . . . . 55 GLU HA . 50915 1 292 . 1 . 1 55 55 GLU C C 13 176.869 0.020 . 1 . . . . . 55 GLU C . 50915 1 293 . 1 . 1 55 55 GLU CA C 13 57.795 0.039 . 1 . . . . . 55 GLU CA . 50915 1 294 . 1 . 1 55 55 GLU CB C 13 29.825 0.003 . 1 . . . . . 55 GLU CB . 50915 1 295 . 1 . 1 55 55 GLU N N 15 126.715 0.049 . 1 . . . . . 55 GLU N . 50915 1 296 . 1 . 1 56 56 VAL H H 1 8.564 0.005 . 1 . . . . . 56 VAL H . 50915 1 297 . 1 . 1 56 56 VAL HA H 1 3.795 0.012 . 1 . . . . . 56 VAL HA . 50915 1 298 . 1 . 1 56 56 VAL C C 13 174.834 0.029 . 1 . . . . . 56 VAL C . 50915 1 299 . 1 . 1 56 56 VAL CA C 13 64.281 0.058 . 1 . . . . . 56 VAL CA . 50915 1 300 . 1 . 1 56 56 VAL N N 15 121.692 0.045 . 1 . . . . . 56 VAL N . 50915 1 301 . 1 . 1 57 57 GLU H H 1 7.005 0.014 . 1 . . . . . 57 GLU H . 50915 1 302 . 1 . 1 57 57 GLU HA H 1 4.592 0.003 . 1 . . . . . 57 GLU HA . 50915 1 303 . 1 . 1 57 57 GLU C C 13 175.938 0.002 . 1 . . . . . 57 GLU C . 50915 1 304 . 1 . 1 57 57 GLU CA C 13 54.447 0.059 . 1 . . . . . 57 GLU CA . 50915 1 305 . 1 . 1 57 57 GLU CB C 13 33.238 0.000 . 1 . . . . . 57 GLU CB . 50915 1 306 . 1 . 1 57 57 GLU N N 15 124.312 0.042 . 1 . . . . . 57 GLU N . 50915 1 307 . 1 . 1 58 58 LYS H H 1 8.279 0.002 . 1 . . . . . 58 LYS H . 50915 1 308 . 1 . 1 58 58 LYS C C 13 177.945 0.000 . 1 . . . . . 58 LYS C . 50915 1 309 . 1 . 1 58 58 LYS CA C 13 53.706 0.000 . 1 . . . . . 58 LYS CA . 50915 1 310 . 1 . 1 58 58 LYS N N 15 122.388 0.000 . 1 . . . . . 58 LYS N . 50915 1 311 . 1 . 1 59 59 GLY H H 1 8.388 0.001 . 1 . . . . . 59 GLY H . 50915 1 312 . 1 . 1 59 59 GLY HA2 H 1 3.990 0.005 . 1 . . . . . 59 GLY HA2 . 50915 1 313 . 1 . 1 59 59 GLY C C 13 175.538 0.008 . 1 . . . . . 59 GLY C . 50915 1 314 . 1 . 1 59 59 GLY CA C 13 45.624 0.032 . 1 . . . . . 59 GLY CA . 50915 1 315 . 1 . 1 59 59 GLY N N 15 113.631 0.000 . 1 . . . . . 59 GLY N . 50915 1 316 . 1 . 1 60 60 VAL H H 1 7.942 0.007 . 1 . . . . . 60 VAL H . 50915 1 317 . 1 . 1 60 60 VAL HA H 1 3.894 0.001 . 1 . . . . . 60 VAL HA . 50915 1 318 . 1 . 1 60 60 VAL C C 13 176.322 0.013 . 1 . . . . . 60 VAL C . 50915 1 319 . 1 . 1 60 60 VAL CA C 13 66.440 0.072 . 1 . . . . . 60 VAL CA . 50915 1 320 . 1 . 1 60 60 VAL CB C 13 33.518 0.000 . 1 . . . . . 60 VAL CB . 50915 1 321 . 1 . 1 60 60 VAL N N 15 121.756 0.050 . 1 . . . . . 60 VAL N . 50915 1 322 . 1 . 1 61 61 LEU H H 1 8.684 0.007 . 1 . . . . . 61 LEU H . 50915 1 323 . 1 . 1 61 61 LEU C C 13 174.565 0.000 . 1 . . . . . 61 LEU C . 50915 1 324 . 1 . 1 61 61 LEU N N 15 119.602 0.040 . 1 . . . . . 61 LEU N . 50915 1 325 . 1 . 1 62 62 PRO C C 13 177.054 0.018 . 1 . . . . . 62 PRO C . 50915 1 326 . 1 . 1 62 62 PRO CA C 13 65.088 0.000 . 1 . . . . . 62 PRO CA . 50915 1 327 . 1 . 1 63 63 GLN H H 1 7.712 0.007 . 1 . . . . . 63 GLN H . 50915 1 328 . 1 . 1 63 63 GLN HA H 1 4.592 0.000 . 1 . . . . . 63 GLN HA . 50915 1 329 . 1 . 1 63 63 GLN C C 13 175.448 0.015 . 1 . . . . . 63 GLN C . 50915 1 330 . 1 . 1 63 63 GLN CA C 13 56.300 0.019 . 1 . . . . . 63 GLN CA . 50915 1 331 . 1 . 1 63 63 GLN CB C 13 30.192 0.000 . 1 . . . . . 63 GLN CB . 50915 1 332 . 1 . 1 63 63 GLN N N 15 113.589 0.045 . 1 . . . . . 63 GLN N . 50915 1 333 . 1 . 1 64 64 LEU H H 1 7.980 0.006 . 1 . . . . . 64 LEU H . 50915 1 334 . 1 . 1 64 64 LEU C C 13 174.984 0.007 . 1 . . . . . 64 LEU C . 50915 1 335 . 1 . 1 64 64 LEU CA C 13 53.636 0.027 . 1 . . . . . 64 LEU CA . 50915 1 336 . 1 . 1 64 64 LEU CB C 13 43.747 0.021 . 1 . . . . . 64 LEU CB . 50915 1 337 . 1 . 1 64 64 LEU N N 15 121.795 0.007 . 1 . . . . . 64 LEU N . 50915 1 338 . 1 . 1 65 65 GLU H H 1 7.344 0.007 . 1 . . . . . 65 GLU H . 50915 1 339 . 1 . 1 65 65 GLU HA H 1 4.449 0.004 . 1 . . . . . 65 GLU HA . 50915 1 340 . 1 . 1 65 65 GLU C C 13 174.994 0.015 . 1 . . . . . 65 GLU C . 50915 1 341 . 1 . 1 65 65 GLU CA C 13 55.771 0.055 . 1 . . . . . 65 GLU CA . 50915 1 342 . 1 . 1 65 65 GLU CB C 13 31.285 0.025 . 1 . . . . . 65 GLU CB . 50915 1 343 . 1 . 1 65 65 GLU N N 15 118.101 0.048 . 1 . . . . . 65 GLU N . 50915 1 344 . 1 . 1 66 66 GLN H H 1 8.221 0.002 . 1 . . . . . 66 GLN H . 50915 1 345 . 1 . 1 66 66 GLN HA H 1 4.606 0.004 . 1 . . . . . 66 GLN HA . 50915 1 346 . 1 . 1 66 66 GLN C C 13 174.231 0.010 . 1 . . . . . 66 GLN C . 50915 1 347 . 1 . 1 66 66 GLN CA C 13 53.704 0.004 . 1 . . . . . 66 GLN CA . 50915 1 348 . 1 . 1 66 66 GLN CB C 13 28.604 0.000 . 1 . . . . . 66 GLN CB . 50915 1 349 . 1 . 1 66 66 GLN N N 15 121.379 0.033 . 1 . . . . . 66 GLN N . 50915 1 350 . 1 . 1 67 67 PRO HA H 1 4.437 0.000 . 1 . . . . . 67 PRO HA . 50915 1 351 . 1 . 1 67 67 PRO C C 13 173.633 0.019 . 1 . . . . . 67 PRO C . 50915 1 352 . 1 . 1 67 67 PRO CA C 13 61.657 0.035 . 1 . . . . . 67 PRO CA . 50915 1 353 . 1 . 1 67 67 PRO CB C 13 35.196 0.000 . 1 . . . . . 67 PRO CB . 50915 1 354 . 1 . 1 67 67 PRO N N 15 139.674 0.000 . 1 . . . . . 67 PRO N . 50915 1 355 . 1 . 1 68 68 TYR H H 1 8.065 0.005 . 1 . . . . . 68 TYR H . 50915 1 356 . 1 . 1 68 68 TYR HA H 1 4.652 0.007 . 1 . . . . . 68 TYR HA . 50915 1 357 . 1 . 1 68 68 TYR C C 13 175.599 0.005 . 1 . . . . . 68 TYR C . 50915 1 358 . 1 . 1 68 68 TYR CA C 13 56.131 0.070 . 1 . . . . . 68 TYR CA . 50915 1 359 . 1 . 1 68 68 TYR CB C 13 41.455 0.012 . 1 . . . . . 68 TYR CB . 50915 1 360 . 1 . 1 68 68 TYR N N 15 119.598 0.049 . 1 . . . . . 68 TYR N . 50915 1 361 . 1 . 1 69 69 VAL H H 1 9.080 0.008 . 1 . . . . . 69 VAL H . 50915 1 362 . 1 . 1 69 69 VAL HA H 1 4.580 0.012 . 1 . . . . . 69 VAL HA . 50915 1 363 . 1 . 1 69 69 VAL C C 13 174.455 0.026 . 1 . . . . . 69 VAL C . 50915 1 364 . 1 . 1 69 69 VAL CA C 13 62.050 0.049 . 1 . . . . . 69 VAL CA . 50915 1 365 . 1 . 1 69 69 VAL CB C 13 32.703 0.037 . 1 . . . . . 69 VAL CB . 50915 1 366 . 1 . 1 69 69 VAL N N 15 120.594 0.050 . 1 . . . . . 69 VAL N . 50915 1 367 . 1 . 1 70 70 PHE H H 1 9.307 0.006 . 1 . . . . . 70 PHE H . 50915 1 368 . 1 . 1 70 70 PHE HA H 1 4.340 0.003 . 1 . . . . . 70 PHE HA . 50915 1 369 . 1 . 1 70 70 PHE C C 13 176.251 0.011 . 1 . . . . . 70 PHE C . 50915 1 370 . 1 . 1 70 70 PHE CA C 13 56.480 0.059 . 1 . . . . . 70 PHE CA . 50915 1 371 . 1 . 1 70 70 PHE CB C 13 41.796 0.057 . 1 . . . . . 70 PHE CB . 50915 1 372 . 1 . 1 70 70 PHE N N 15 123.314 0.050 . 1 . . . . . 70 PHE N . 50915 1 373 . 1 . 1 71 71 ILE H H 1 8.087 0.009 . 1 . . . . . 71 ILE H . 50915 1 374 . 1 . 1 71 71 ILE HA H 1 5.159 0.003 . 1 . . . . . 71 ILE HA . 50915 1 375 . 1 . 1 71 71 ILE C C 13 174.951 0.001 . 1 . . . . . 71 ILE C . 50915 1 376 . 1 . 1 71 71 ILE CA C 13 58.928 0.068 . 1 . . . . . 71 ILE CA . 50915 1 377 . 1 . 1 71 71 ILE CB C 13 39.856 0.042 . 1 . . . . . 71 ILE CB . 50915 1 378 . 1 . 1 71 71 ILE N N 15 113.093 0.050 . 1 . . . . . 71 ILE N . 50915 1 379 . 1 . 1 72 72 LYS H H 1 9.008 0.007 . 1 . . . . . 72 LYS H . 50915 1 380 . 1 . 1 72 72 LYS HA H 1 5.173 0.004 . 1 . . . . . 72 LYS HA . 50915 1 381 . 1 . 1 72 72 LYS C C 13 175.143 0.020 . 1 . . . . . 72 LYS C . 50915 1 382 . 1 . 1 72 72 LYS CA C 13 53.998 0.028 . 1 . . . . . 72 LYS CA . 50915 1 383 . 1 . 1 72 72 LYS CB C 13 36.327 0.015 . 1 . . . . . 72 LYS CB . 50915 1 384 . 1 . 1 72 72 LYS N N 15 125.618 0.062 . 1 . . . . . 72 LYS N . 50915 1 385 . 1 . 1 73 73 ARG H H 1 8.983 0.006 . 1 . . . . . 73 ARG H . 50915 1 386 . 1 . 1 73 73 ARG HA H 1 4.340 0.006 . 1 . . . . . 73 ARG HA . 50915 1 387 . 1 . 1 73 73 ARG C C 13 176.552 0.047 . 1 . . . . . 73 ARG C . 50915 1 388 . 1 . 1 73 73 ARG CA C 13 57.540 0.078 . 1 . . . . . 73 ARG CA . 50915 1 389 . 1 . 1 73 73 ARG CB C 13 31.415 0.012 . 1 . . . . . 73 ARG CB . 50915 1 390 . 1 . 1 73 73 ARG N N 15 123.208 0.049 . 1 . . . . . 73 ARG N . 50915 1 391 . 1 . 1 74 74 SER H H 1 8.790 0.006 . 1 . . . . . 74 SER H . 50915 1 392 . 1 . 1 74 74 SER HA H 1 4.540 0.008 . 1 . . . . . 74 SER HA . 50915 1 393 . 1 . 1 74 74 SER CA C 13 58.721 0.036 . 1 . . . . . 74 SER CA . 50915 1 394 . 1 . 1 74 74 SER CB C 13 64.449 0.000 . 1 . . . . . 74 SER CB . 50915 1 395 . 1 . 1 74 74 SER N N 15 120.886 0.050 . 1 . . . . . 74 SER N . 50915 1 396 . 1 . 1 75 75 ASP H H 1 8.266 0.000 . 1 . . . . . 75 ASP H . 50915 1 397 . 1 . 1 75 75 ASP C C 13 175.72 0.000 . 1 . . . . . 75 ASP C . 50915 1 398 . 1 . 1 75 75 ASP CB C 13 41.752 0.015 . 1 . . . . . 75 ASP CB . 50915 1 399 . 1 . 1 75 75 ASP N N 15 122.327 0.000 . 1 . . . . . 75 ASP N . 50915 1 400 . 1 . 1 76 76 ALA H H 1 8.437 0.002 . 1 . . . . . 76 ALA H . 50915 1 401 . 1 . 1 76 76 ALA C C 13 177.368 0.000 . 1 . . . . . 76 ALA C . 50915 1 402 . 1 . 1 76 76 ALA CB C 13 18.310 0.000 . 1 . . . . . 76 ALA CB . 50915 1 403 . 1 . 1 76 76 ALA N N 15 124.776 0.000 . 1 . . . . . 76 ALA N . 50915 1 404 . 1 . 1 77 77 ARG H H 1 8.349 0.001 . 1 . . . . . 77 ARG H . 50915 1 405 . 1 . 1 77 77 ARG C C 13 176.62 0.000 . 1 . . . . . 77 ARG C . 50915 1 406 . 1 . 1 77 77 ARG N N 15 118.699 0.000 . 1 . . . . . 77 ARG N . 50915 1 407 . 1 . 1 78 78 THR H H 1 8.043 0.000 . 1 . . . . . 78 THR H . 50915 1 408 . 1 . 1 78 78 THR HA H 1 4.372 0.006 . 1 . . . . . 78 THR HA . 50915 1 409 . 1 . 1 78 78 THR C C 13 173.660 0.000 . 1 . . . . . 78 THR C . 50915 1 410 . 1 . 1 78 78 THR CA C 13 61.878 0.010 . 1 . . . . . 78 THR CA . 50915 1 411 . 1 . 1 78 78 THR CB C 13 70.226 0.000 . 1 . . . . . 78 THR CB . 50915 1 412 . 1 . 1 78 78 THR N N 15 114.049 0.000 . 1 . . . . . 78 THR N . 50915 1 413 . 1 . 1 79 79 ALA H H 1 8.274 0.004 . 1 . . . . . 79 ALA H . 50915 1 414 . 1 . 1 79 79 ALA HA H 1 4.374 0.004 . 1 . . . . . 79 ALA HA . 50915 1 415 . 1 . 1 79 79 ALA C C 13 176.922 0.002 . 1 . . . . . 79 ALA C . 50915 1 416 . 1 . 1 79 79 ALA CA C 13 52.641 0.082 . 1 . . . . . 79 ALA CA . 50915 1 417 . 1 . 1 79 79 ALA N N 15 127.760 0.048 . 1 . . . . . 79 ALA N . 50915 1 418 . 1 . 1 82 82 GLY C C 13 173.874 0.000 . 1 . . . . . 82 GLY C . 50915 1 419 . 1 . 1 82 82 GLY CA C 13 45.645 0.030 . 1 . . . . . 82 GLY CA . 50915 1 420 . 1 . 1 83 83 HIS H H 1 8.154 0.005 . 1 . . . . . 83 HIS H . 50915 1 421 . 1 . 1 83 83 HIS C C 13 174.365 0.032 . 1 . . . . . 83 HIS C . 50915 1 422 . 1 . 1 83 83 HIS CA C 13 56.172 0.062 . 1 . . . . . 83 HIS CA . 50915 1 423 . 1 . 1 83 83 HIS CB C 13 31.845 0.000 . 1 . . . . . 83 HIS CB . 50915 1 424 . 1 . 1 83 83 HIS N N 15 119.595 0.033 . 1 . . . . . 83 HIS N . 50915 1 425 . 1 . 1 84 84 VAL H H 1 8.090 0.002 . 1 . . . . . 84 VAL H . 50915 1 426 . 1 . 1 84 84 VAL HA H 1 4.219 0.006 . 1 . . . . . 84 VAL HA . 50915 1 427 . 1 . 1 84 84 VAL C C 13 175.011 0.011 . 1 . . . . . 84 VAL C . 50915 1 428 . 1 . 1 84 84 VAL CA C 13 61.857 0.062 . 1 . . . . . 84 VAL CA . 50915 1 429 . 1 . 1 84 84 VAL CB C 13 33.246 0.039 . 1 . . . . . 84 VAL CB . 50915 1 430 . 1 . 1 84 84 VAL N N 15 121.529 0.001 . 1 . . . . . 84 VAL N . 50915 1 431 . 1 . 1 85 85 MET H H 1 8.783 0.006 . 1 . . . . . 85 MET H . 50915 1 432 . 1 . 1 85 85 MET HA H 1 5.200 0.005 . 1 . . . . . 85 MET HA . 50915 1 433 . 1 . 1 85 85 MET C C 13 176.629 0.019 . 1 . . . . . 85 MET C . 50915 1 434 . 1 . 1 85 85 MET CA C 13 55.966 0.059 . 1 . . . . . 85 MET CA . 50915 1 435 . 1 . 1 85 85 MET CB C 13 33.501 0.012 . 1 . . . . . 85 MET CB . 50915 1 436 . 1 . 1 85 85 MET N N 15 127.869 0.048 . 1 . . . . . 85 MET N . 50915 1 437 . 1 . 1 86 86 VAL H H 1 8.849 0.005 . 1 . . . . . 86 VAL H . 50915 1 438 . 1 . 1 86 86 VAL HA H 1 5.630 0.007 . 1 . . . . . 86 VAL HA . 50915 1 439 . 1 . 1 86 86 VAL C C 13 174.269 0.034 . 1 . . . . . 86 VAL C . 50915 1 440 . 1 . 1 86 86 VAL CA C 13 58.779 0.038 . 1 . . . . . 86 VAL CA . 50915 1 441 . 1 . 1 86 86 VAL CB C 13 37.001 0.022 . 1 . . . . . 86 VAL CB . 50915 1 442 . 1 . 1 86 86 VAL N N 15 117.261 0.048 . 1 . . . . . 86 VAL N . 50915 1 443 . 1 . 1 87 87 GLU H H 1 8.983 0.007 . 1 . . . . . 87 GLU H . 50915 1 444 . 1 . 1 87 87 GLU HA H 1 4.670 0.002 . 1 . . . . . 87 GLU HA . 50915 1 445 . 1 . 1 87 87 GLU C C 13 174.272 0.014 . 1 . . . . . 87 GLU C . 50915 1 446 . 1 . 1 87 87 GLU CA C 13 54.148 0.051 . 1 . . . . . 87 GLU CA . 50915 1 447 . 1 . 1 87 87 GLU CB C 13 34.023 0.015 . 1 . . . . . 87 GLU CB . 50915 1 448 . 1 . 1 87 87 GLU N N 15 117.022 0.046 . 1 . . . . . 87 GLU N . 50915 1 449 . 1 . 1 88 88 LEU H H 1 8.556 0.005 . 1 . . . . . 88 LEU H . 50915 1 450 . 1 . 1 88 88 LEU HA H 1 5.139 0.004 . 1 . . . . . 88 LEU HA . 50915 1 451 . 1 . 1 88 88 LEU C C 13 177.137 0.021 . 1 . . . . . 88 LEU C . 50915 1 452 . 1 . 1 88 88 LEU CA C 13 54.869 0.050 . 1 . . . . . 88 LEU CA . 50915 1 453 . 1 . 1 88 88 LEU CB C 13 44.126 0.020 . 1 . . . . . 88 LEU CB . 50915 1 454 . 1 . 1 88 88 LEU N N 15 121.708 0.042 . 1 . . . . . 88 LEU N . 50915 1 455 . 1 . 1 89 89 VAL H H 1 8.761 0.007 . 1 . . . . . 89 VAL H . 50915 1 456 . 1 . 1 89 89 VAL HA H 1 4.570 0.000 . 1 . . . . . 89 VAL HA . 50915 1 457 . 1 . 1 89 89 VAL C C 13 173.357 0.011 . 1 . . . . . 89 VAL C . 50915 1 458 . 1 . 1 89 89 VAL CA C 13 60.855 0.042 . 1 . . . . . 89 VAL CA . 50915 1 459 . 1 . 1 89 89 VAL CB C 13 36.395 0.040 . 1 . . . . . 89 VAL CB . 50915 1 460 . 1 . 1 89 89 VAL N N 15 119.965 0.050 . 1 . . . . . 89 VAL N . 50915 1 461 . 1 . 1 90 90 ALA H H 1 8.697 0.006 . 1 . . . . . 90 ALA H . 50915 1 462 . 1 . 1 90 90 ALA HA H 1 5.872 0.008 . 1 . . . . . 90 ALA HA . 50915 1 463 . 1 . 1 90 90 ALA C C 13 176.648 0.010 . 1 . . . . . 90 ALA C . 50915 1 464 . 1 . 1 90 90 ALA CA C 13 50.628 0.043 . 1 . . . . . 90 ALA CA . 50915 1 465 . 1 . 1 90 90 ALA CB C 13 22.936 0.048 . 1 . . . . . 90 ALA CB . 50915 1 466 . 1 . 1 90 90 ALA N N 15 125.998 0.050 . 1 . . . . . 90 ALA N . 50915 1 467 . 1 . 1 91 91 GLU H H 1 8.873 0.007 . 1 . . . . . 91 GLU H . 50915 1 468 . 1 . 1 91 91 GLU HA H 1 4.958 0.003 . 1 . . . . . 91 GLU HA . 50915 1 469 . 1 . 1 91 91 GLU C C 13 175.049 0.047 . 1 . . . . . 91 GLU C . 50915 1 470 . 1 . 1 91 91 GLU CA C 13 55.655 0.051 . 1 . . . . . 91 GLU CA . 50915 1 471 . 1 . 1 91 91 GLU CB C 13 34.763 0.040 . 1 . . . . . 91 GLU CB . 50915 1 472 . 1 . 1 91 91 GLU N N 15 118.510 0.050 . 1 . . . . . 91 GLU N . 50915 1 473 . 1 . 1 92 92 LEU H H 1 8.855 0.005 . 1 . . . . . 92 LEU H . 50915 1 474 . 1 . 1 92 92 LEU HA H 1 4.316 0.008 . 1 . . . . . 92 LEU HA . 50915 1 475 . 1 . 1 92 92 LEU CA C 13 57.337 0.039 . 1 . . . . . 92 LEU CA . 50915 1 476 . 1 . 1 92 92 LEU CB C 13 43.349 0.000 . 1 . . . . . 92 LEU CB . 50915 1 477 . 1 . 1 92 92 LEU N N 15 123.859 0.050 . 1 . . . . . 92 LEU N . 50915 1 478 . 1 . 1 93 93 GLU HA H 1 4.509 0.003 . 1 . . . . . 93 GLU HA . 50915 1 479 . 1 . 1 93 93 GLU C C 13 177.457 0.028 . 1 . . . . . 93 GLU C . 50915 1 480 . 1 . 1 93 93 GLU CA C 13 57.382 0.036 . 1 . . . . . 93 GLU CA . 50915 1 481 . 1 . 1 94 94 GLY H H 1 8.219 0.008 . 1 . . . . . 94 GLY H . 50915 1 482 . 1 . 1 94 94 GLY HA2 H 1 4.057 0.007 . 1 . . . . . 94 GLY HA2 . 50915 1 483 . 1 . 1 94 94 GLY C C 13 174.074 0.008 . 1 . . . . . 94 GLY C . 50915 1 484 . 1 . 1 94 94 GLY CA C 13 46.379 0.040 . 1 . . . . . 94 GLY CA . 50915 1 485 . 1 . 1 94 94 GLY N N 15 106.379 0.000 . 1 . . . . . 94 GLY N . 50915 1 486 . 1 . 1 95 95 ILE H H 1 7.589 0.004 . 1 . . . . . 95 ILE H . 50915 1 487 . 1 . 1 95 95 ILE HA H 1 3.984 0.003 . 1 . . . . . 95 ILE HA . 50915 1 488 . 1 . 1 95 95 ILE C C 13 176.308 0.008 . 1 . . . . . 95 ILE C . 50915 1 489 . 1 . 1 95 95 ILE CA C 13 62.256 0.090 . 1 . . . . . 95 ILE CA . 50915 1 490 . 1 . 1 95 95 ILE CB C 13 38.679 0.000 . 1 . . . . . 95 ILE CB . 50915 1 491 . 1 . 1 95 95 ILE N N 15 119.401 0.050 . 1 . . . . . 95 ILE N . 50915 1 492 . 1 . 1 96 96 GLN C C 13 177.143 0.000 . 1 . . . . . 96 GLN C . 50915 1 493 . 1 . 1 96 96 GLN CA C 13 56.293 0.000 . 1 . . . . . 96 GLN CA . 50915 1 494 . 1 . 1 97 97 TYR H H 1 8.881 0.004 . 1 . . . . . 97 TYR H . 50915 1 495 . 1 . 1 97 97 TYR C C 13 174.917 0.000 . 1 . . . . . 97 TYR C . 50915 1 496 . 1 . 1 97 97 TYR CA C 13 58.849 0.000 . 1 . . . . . 97 TYR CA . 50915 1 497 . 1 . 1 97 97 TYR N N 15 120.286 0.000 . 1 . . . . . 97 TYR N . 50915 1 498 . 1 . 1 98 98 GLY H H 1 7.934 0.003 . 1 . . . . . 98 GLY H . 50915 1 499 . 1 . 1 98 98 GLY C C 13 173.70 0.000 . 1 . . . . . 98 GLY C . 50915 1 500 . 1 . 1 98 98 GLY CA C 13 46.152 0.000 . 1 . . . . . 98 GLY CA . 50915 1 501 . 1 . 1 98 98 GLY N N 15 108.994 0.000 . 1 . . . . . 98 GLY N . 50915 1 502 . 1 . 1 99 99 ARG H H 1 7.826 0.001 . 1 . . . . . 99 ARG H . 50915 1 503 . 1 . 1 99 99 ARG C C 13 176.18 0.000 . 1 . . . . . 99 ARG C . 50915 1 504 . 1 . 1 99 99 ARG CA C 13 55.795 0.000 . 1 . . . . . 99 ARG CA . 50915 1 505 . 1 . 1 99 99 ARG N N 15 118.720 0.000 . 1 . . . . . 99 ARG N . 50915 1 506 . 1 . 1 100 100 SER N N 15 115.52 0.000 . 1 . . . . . 100 SER N . 50915 1 507 . 1 . 1 101 101 GLY H H 1 8.684 0.000 . 1 . . . . . 101 GLY H . 50915 1 508 . 1 . 1 101 101 GLY HA2 H 1 4.371 0.000 . 2 . . . . . 101 GLY HA2 . 50915 1 509 . 1 . 1 101 101 GLY HA3 H 1 4.157 0.000 . 2 . . . . . 101 GLY HA3 . 50915 1 510 . 1 . 1 101 101 GLY C C 13 174.208 0.000 . 1 . . . . . 101 GLY C . 50915 1 511 . 1 . 1 101 101 GLY CA C 13 45.871 0.035 . 1 . . . . . 101 GLY CA . 50915 1 512 . 1 . 1 101 101 GLY N N 15 112.902 0.000 . 1 . . . . . 101 GLY N . 50915 1 513 . 1 . 1 102 102 GLU H H 1 8.367 0.007 . 1 . . . . . 102 GLU H . 50915 1 514 . 1 . 1 102 102 GLU HA H 1 4.735 0.000 . 1 . . . . . 102 GLU HA . 50915 1 515 . 1 . 1 102 102 GLU C C 13 176.164 0.000 . 1 . . . . . 102 GLU C . 50915 1 516 . 1 . 1 102 102 GLU CA C 13 57.055 0.000 . 1 . . . . . 102 GLU CA . 50915 1 517 . 1 . 1 102 102 GLU CB C 13 30.714 0.000 . 1 . . . . . 102 GLU CB . 50915 1 518 . 1 . 1 102 102 GLU N N 15 119.022 0.049 . 1 . . . . . 102 GLU N . 50915 1 519 . 1 . 1 103 103 THR H H 1 8.295 0.000 . 1 . . . . . 103 THR H . 50915 1 520 . 1 . 1 103 103 THR HA H 1 4.368 0.000 . 1 . . . . . 103 THR HA . 50915 1 521 . 1 . 1 103 103 THR C C 13 174.247 0.035 . 1 . . . . . 103 THR C . 50915 1 522 . 1 . 1 103 103 THR CA C 13 63.244 0.025 . 1 . . . . . 103 THR CA . 50915 1 523 . 1 . 1 103 103 THR CB C 13 74.890 0.000 . 1 . . . . . 103 THR CB . 50915 1 524 . 1 . 1 103 103 THR N N 15 117.708 0.000 . 1 . . . . . 103 THR N . 50915 1 525 . 1 . 1 104 104 LEU H H 1 9.036 0.012 . 1 . . . . . 104 LEU H . 50915 1 526 . 1 . 1 104 104 LEU HA H 1 5.173 0.000 . 1 . . . . . 104 LEU HA . 50915 1 527 . 1 . 1 104 104 LEU C C 13 177.245 0.032 . 1 . . . . . 104 LEU C . 50915 1 528 . 1 . 1 104 104 LEU CA C 13 56.500 0.040 . 1 . . . . . 104 LEU CA . 50915 1 529 . 1 . 1 104 104 LEU CB C 13 43.204 0.025 . 1 . . . . . 104 LEU CB . 50915 1 530 . 1 . 1 104 104 LEU N N 15 126.730 0.032 . 1 . . . . . 104 LEU N . 50915 1 531 . 1 . 1 105 105 GLY H H 1 7.486 0.011 . 1 . . . . . 105 GLY H . 50915 1 532 . 1 . 1 105 105 GLY HA2 H 1 4.194 0.007 . 2 . . . . . 105 GLY HA2 . 50915 1 533 . 1 . 1 105 105 GLY HA3 H 1 4.348 0.005 . 2 . . . . . 105 GLY HA3 . 50915 1 534 . 1 . 1 105 105 GLY C C 13 170.124 0.023 . 1 . . . . . 105 GLY C . 50915 1 535 . 1 . 1 105 105 GLY CA C 13 45.651 0.049 . 1 . . . . . 105 GLY CA . 50915 1 536 . 1 . 1 105 105 GLY N N 15 103.851 0.067 . 1 . . . . . 105 GLY N . 50915 1 537 . 1 . 1 106 106 VAL H H 1 9.190 0.007 . 1 . . . . . 106 VAL H . 50915 1 538 . 1 . 1 106 106 VAL HA H 1 4.566 0.001 . 1 . . . . . 106 VAL HA . 50915 1 539 . 1 . 1 106 106 VAL C C 13 174.727 0.012 . 1 . . . . . 106 VAL C . 50915 1 540 . 1 . 1 106 106 VAL CA C 13 60.270 0.096 . 1 . . . . . 106 VAL CA . 50915 1 541 . 1 . 1 106 106 VAL CB C 13 34.906 0.089 . 1 . . . . . 106 VAL CB . 50915 1 542 . 1 . 1 106 106 VAL N N 15 121.126 0.049 . 1 . . . . . 106 VAL N . 50915 1 543 . 1 . 1 107 107 LEU H H 1 9.007 0.004 . 1 . . . . . 107 LEU H . 50915 1 544 . 1 . 1 107 107 LEU HA H 1 5.360 0.004 . 1 . . . . . 107 LEU HA . 50915 1 545 . 1 . 1 107 107 LEU C C 13 174.973 0.013 . 1 . . . . . 107 LEU C . 50915 1 546 . 1 . 1 107 107 LEU CA C 13 53.701 0.033 . 1 . . . . . 107 LEU CA . 50915 1 547 . 1 . 1 107 107 LEU CB C 13 43.763 0.041 . 1 . . . . . 107 LEU CB . 50915 1 548 . 1 . 1 107 107 LEU N N 15 126.703 0.026 . 1 . . . . . 107 LEU N . 50915 1 549 . 1 . 1 108 108 VAL H H 1 8.403 0.006 . 1 . . . . . 108 VAL H . 50915 1 550 . 1 . 1 108 108 VAL HA H 1 4.469 0.004 . 1 . . . . . 108 VAL HA . 50915 1 551 . 1 . 1 108 108 VAL C C 13 172.499 0.001 . 1 . . . . . 108 VAL C . 50915 1 552 . 1 . 1 108 108 VAL CA C 13 58.314 0.075 . 1 . . . . . 108 VAL CA . 50915 1 553 . 1 . 1 108 108 VAL CB C 13 33.598 0.000 . 1 . . . . . 108 VAL CB . 50915 1 554 . 1 . 1 108 108 VAL N N 15 113.588 0.050 . 1 . . . . . 108 VAL N . 50915 1 555 . 1 . 1 109 109 PRO HA H 1 4.769 0.000 . 1 . . . . . 109 PRO HA . 50915 1 556 . 1 . 1 109 109 PRO C C 13 173.340 0.000 . 1 . . . . . 109 PRO C . 50915 1 557 . 1 . 1 109 109 PRO CA C 13 63.643 0.035 . 1 . . . . . 109 PRO CA . 50915 1 558 . 1 . 1 109 109 PRO CB C 13 31.906 0.000 . 1 . . . . . 109 PRO CB . 50915 1 559 . 1 . 1 110 110 HIS H H 1 8.086 0.009 . 1 . . . . . 110 HIS H . 50915 1 560 . 1 . 1 110 110 HIS HA H 1 5.158 0.004 . 1 . . . . . 110 HIS HA . 50915 1 561 . 1 . 1 110 110 HIS C C 13 175.828 0.000 . 1 . . . . . 110 HIS C . 50915 1 562 . 1 . 1 110 110 HIS CA C 13 53.499 0.004 . 1 . . . . . 110 HIS CA . 50915 1 563 . 1 . 1 110 110 HIS N N 15 120.935 0.048 . 1 . . . . . 110 HIS N . 50915 1 564 . 1 . 1 111 111 VAL H H 1 10.348 0.006 . 1 . . . . . 111 VAL H . 50915 1 565 . 1 . 1 111 111 VAL HA H 1 4.412 0.007 . 1 . . . . . 111 VAL HA . 50915 1 566 . 1 . 1 111 111 VAL C C 13 175.520 0.027 . 1 . . . . . 111 VAL C . 50915 1 567 . 1 . 1 111 111 VAL CA C 13 60.576 0.071 . 1 . . . . . 111 VAL CA . 50915 1 568 . 1 . 1 111 111 VAL CB C 13 31.925 0.000 . 1 . . . . . 111 VAL CB . 50915 1 569 . 1 . 1 111 111 VAL N N 15 130.009 0.000 . 1 . . . . . 111 VAL N . 50915 1 570 . 1 . 1 112 112 GLY H H 1 6.619 0.011 . 1 . . . . . 112 GLY H . 50915 1 571 . 1 . 1 112 112 GLY HA2 H 1 3.945 0.000 . 1 . . . . . 112 GLY HA2 . 50915 1 572 . 1 . 1 112 112 GLY C C 13 174.798 0.000 . 1 . . . . . 112 GLY C . 50915 1 573 . 1 . 1 112 112 GLY CA C 13 45.323 0.035 . 1 . . . . . 112 GLY CA . 50915 1 574 . 1 . 1 112 112 GLY N N 15 107.299 0.042 . 1 . . . . . 112 GLY N . 50915 1 575 . 1 . 1 113 113 GLU H H 1 10.669 0.007 . 1 . . . . . 113 GLU H . 50915 1 576 . 1 . 1 113 113 GLU C C 13 177.208 0.006 . 1 . . . . . 113 GLU C . 50915 1 577 . 1 . 1 113 113 GLU CA C 13 59.059 0.020 . 1 . . . . . 113 GLU CA . 50915 1 578 . 1 . 1 113 113 GLU CB C 13 29.991 0.000 . 1 . . . . . 113 GLU CB . 50915 1 579 . 1 . 1 113 113 GLU N N 15 124.740 0.000 . 1 . . . . . 113 GLU N . 50915 1 580 . 1 . 1 114 114 ILE H H 1 9.017 0.004 . 1 . . . . . 114 ILE H . 50915 1 581 . 1 . 1 114 114 ILE CA C 13 58.808 0.000 . 1 . . . . . 114 ILE CA . 50915 1 582 . 1 . 1 114 114 ILE CB C 13 37.311 0.000 . 1 . . . . . 114 ILE CB . 50915 1 583 . 1 . 1 114 114 ILE N N 15 125.658 0.049 . 1 . . . . . 114 ILE N . 50915 1 584 . 1 . 1 115 115 PRO HA H 1 4.643 0.000 . 1 . . . . . 115 PRO HA . 50915 1 585 . 1 . 1 115 115 PRO C C 13 177.397 0.015 . 1 . . . . . 115 PRO C . 50915 1 586 . 1 . 1 115 115 PRO CA C 13 62.449 0.035 . 1 . . . . . 115 PRO CA . 50915 1 587 . 1 . 1 115 115 PRO CB C 13 33.115 0.000 . 1 . . . . . 115 PRO CB . 50915 1 588 . 1 . 1 116 116 VAL H H 1 8.864 0.007 . 1 . . . . . 116 VAL H . 50915 1 589 . 1 . 1 116 116 VAL HA H 1 4.370 0.010 . 1 . . . . . 116 VAL HA . 50915 1 590 . 1 . 1 116 116 VAL C C 13 175.684 0.015 . 1 . . . . . 116 VAL C . 50915 1 591 . 1 . 1 116 116 VAL CA C 13 61.562 0.077 . 1 . . . . . 116 VAL CA . 50915 1 592 . 1 . 1 116 116 VAL CB C 13 32.906 0.006 . 1 . . . . . 116 VAL CB . 50915 1 593 . 1 . 1 116 116 VAL N N 15 114.430 0.056 . 1 . . . . . 116 VAL N . 50915 1 594 . 1 . 1 117 117 ALA H H 1 7.755 0.007 . 1 . . . . . 117 ALA H . 50915 1 595 . 1 . 1 117 117 ALA HA H 1 4.458 0.004 . 1 . . . . . 117 ALA HA . 50915 1 596 . 1 . 1 117 117 ALA C C 13 174.043 0.042 . 1 . . . . . 117 ALA C . 50915 1 597 . 1 . 1 117 117 ALA CA C 13 51.325 0.070 . 1 . . . . . 117 ALA CA . 50915 1 598 . 1 . 1 117 117 ALA CB C 13 21.049 0.015 . 1 . . . . . 117 ALA CB . 50915 1 599 . 1 . 1 117 117 ALA N N 15 120.587 0.049 . 1 . . . . . 117 ALA N . 50915 1 600 . 1 . 1 118 118 TYR H H 1 8.440 0.006 . 1 . . . . . 118 TYR H . 50915 1 601 . 1 . 1 118 118 TYR HA H 1 5.307 0.002 . 1 . . . . . 118 TYR HA . 50915 1 602 . 1 . 1 118 118 TYR C C 13 175.795 0.041 . 1 . . . . . 118 TYR C . 50915 1 603 . 1 . 1 118 118 TYR CA C 13 57.903 0.045 . 1 . . . . . 118 TYR CA . 50915 1 604 . 1 . 1 118 118 TYR CB C 13 42.316 0.082 . 1 . . . . . 118 TYR CB . 50915 1 605 . 1 . 1 118 118 TYR N N 15 115.994 0.064 . 1 . . . . . 118 TYR N . 50915 1 606 . 1 . 1 119 119 ARG H H 1 9.402 0.007 . 1 . . . . . 119 ARG H . 50915 1 607 . 1 . 1 119 119 ARG HA H 1 4.783 0.005 . 1 . . . . . 119 ARG HA . 50915 1 608 . 1 . 1 119 119 ARG C C 13 174.763 0.057 . 1 . . . . . 119 ARG C . 50915 1 609 . 1 . 1 119 119 ARG CA C 13 53.459 0.053 . 1 . . . . . 119 ARG CA . 50915 1 610 . 1 . 1 119 119 ARG CB C 13 32.155 0.007 . 1 . . . . . 119 ARG CB . 50915 1 611 . 1 . 1 119 119 ARG N N 15 122.273 0.050 . 1 . . . . . 119 ARG N . 50915 1 612 . 1 . 1 120 120 LYS H H 1 8.600 0.005 . 1 . . . . . 120 LYS H . 50915 1 613 . 1 . 1 120 120 LYS HA H 1 5.140 0.005 . 1 . . . . . 120 LYS HA . 50915 1 614 . 1 . 1 120 120 LYS C C 13 176.812 0.024 . 1 . . . . . 120 LYS C . 50915 1 615 . 1 . 1 120 120 LYS CA C 13 56.327 0.040 . 1 . . . . . 120 LYS CA . 50915 1 616 . 1 . 1 120 120 LYS CB C 13 35.332 0.000 . 1 . . . . . 120 LYS CB . 50915 1 617 . 1 . 1 120 120 LYS N N 15 126.561 0.049 . 1 . . . . . 120 LYS N . 50915 1 618 . 1 . 1 121 121 VAL H H 1 8.986 0.001 . 1 . . . . . 121 VAL H . 50915 1 619 . 1 . 1 121 121 VAL HA H 1 5.262 0.000 . 1 . . . . . 121 VAL HA . 50915 1 620 . 1 . 1 121 121 VAL C C 13 173.515 0.000 . 1 . . . . . 121 VAL C . 50915 1 621 . 1 . 1 121 121 VAL CA C 13 58.918 0.035 . 1 . . . . . 121 VAL CA . 50915 1 622 . 1 . 1 121 121 VAL CB C 13 36.194 0.000 . 1 . . . . . 121 VAL CB . 50915 1 623 . 1 . 1 121 121 VAL N N 15 117.139 0.000 . 1 . . . . . 121 VAL N . 50915 1 624 . 1 . 1 122 122 LEU H H 1 8.776 0.005 . 1 . . . . . 122 LEU H . 50915 1 625 . 1 . 1 122 122 LEU HA H 1 5.187 0.003 . 1 . . . . . 122 LEU HA . 50915 1 626 . 1 . 1 122 122 LEU C C 13 174.888 0.000 . 1 . . . . . 122 LEU C . 50915 1 627 . 1 . 1 122 122 LEU CA C 13 53.355 0.118 . 1 . . . . . 122 LEU CA . 50915 1 628 . 1 . 1 122 122 LEU CB C 13 44.901 0.012 . 1 . . . . . 122 LEU CB . 50915 1 629 . 1 . 1 122 122 LEU N N 15 123.330 0.058 . 1 . . . . . 122 LEU N . 50915 1 630 . 1 . 1 123 123 LEU H H 1 8.928 0.010 . 1 . . . . . 123 LEU H . 50915 1 631 . 1 . 1 123 123 LEU HA H 1 4.842 0.000 . 1 . . . . . 123 LEU HA . 50915 1 632 . 1 . 1 123 123 LEU C C 13 176.094 0.015 . 1 . . . . . 123 LEU C . 50915 1 633 . 1 . 1 123 123 LEU CA C 13 53.805 0.034 . 1 . . . . . 123 LEU CA . 50915 1 634 . 1 . 1 123 123 LEU CB C 13 45.834 0.082 . 1 . . . . . 123 LEU CB . 50915 1 635 . 1 . 1 123 123 LEU N N 15 125.100 0.102 . 1 . . . . . 123 LEU N . 50915 1 636 . 1 . 1 124 124 ARG H H 1 8.766 0.011 . 1 . . . . . 124 ARG H . 50915 1 637 . 1 . 1 124 124 ARG HA H 1 4.164 0.004 . 1 . . . . . 124 ARG HA . 50915 1 638 . 1 . 1 124 124 ARG C C 13 176.468 0.003 . 1 . . . . . 124 ARG C . 50915 1 639 . 1 . 1 124 124 ARG CA C 13 57.048 0.018 . 1 . . . . . 124 ARG CA . 50915 1 640 . 1 . 1 124 124 ARG CB C 13 30.688 0.021 . 1 . . . . . 124 ARG CB . 50915 1 641 . 1 . 1 124 124 ARG N N 15 126.283 0.112 . 1 . . . . . 124 ARG N . 50915 1 642 . 1 . 1 125 125 LYS H H 1 8.442 0.010 . 1 . . . . . 125 LYS H . 50915 1 643 . 1 . 1 125 125 LYS HA H 1 4.666 0.001 . 1 . . . . . 125 LYS HA . 50915 1 644 . 1 . 1 125 125 LYS C C 13 175.241 0.026 . 1 . . . . . 125 LYS C . 50915 1 645 . 1 . 1 125 125 LYS CA C 13 57.854 0.048 . 1 . . . . . 125 LYS CA . 50915 1 646 . 1 . 1 125 125 LYS CB C 13 33.633 0.022 . 1 . . . . . 125 LYS CB . 50915 1 647 . 1 . 1 126 126 ASN H H 1 7.904 0.005 . 1 . . . . . 126 ASN H . 50915 1 648 . 1 . 1 126 126 ASN HA H 1 4.506 0.005 . 1 . . . . . 126 ASN HA . 50915 1 649 . 1 . 1 126 126 ASN C C 13 178.906 0.028 . 1 . . . . . 126 ASN C . 50915 1 650 . 1 . 1 126 126 ASN CA C 13 54.908 0.032 . 1 . . . . . 126 ASN CA . 50915 1 651 . 1 . 1 126 126 ASN CB C 13 41.379 0.000 . 1 . . . . . 126 ASN CB . 50915 1 652 . 1 . 1 126 126 ASN N N 15 124.315 0.049 . 1 . . . . . 126 ASN N . 50915 1 653 . 1 . 1 128 128 ASN HA H 1 4.316 0.003 . 1 . . . . . 128 ASN HA . 50915 1 654 . 1 . 1 128 128 ASN C C 13 176.019 0.008 . 1 . . . . . 128 ASN C . 50915 1 655 . 1 . 1 128 128 ASN CA C 13 55.509 0.047 . 1 . . . . . 128 ASN CA . 50915 1 656 . 1 . 1 128 128 ASN CB C 13 42.700 0.000 . 1 . . . . . 128 ASN CB . 50915 1 657 . 1 . 1 129 129 LYS H H 1 7.833 0.005 . 1 . . . . . 129 LYS H . 50915 1 658 . 1 . 1 129 129 LYS HA H 1 4.302 0.005 . 1 . . . . . 129 LYS HA . 50915 1 659 . 1 . 1 129 129 LYS C C 13 177.070 0.000 . 1 . . . . . 129 LYS C . 50915 1 660 . 1 . 1 129 129 LYS CA C 13 59.266 0.055 . 1 . . . . . 129 LYS CA . 50915 1 661 . 1 . 1 129 129 LYS CB C 13 34.515 0.000 . 1 . . . . . 129 LYS CB . 50915 1 662 . 1 . 1 129 129 LYS N N 15 119.692 0.057 . 1 . . . . . 129 LYS N . 50915 1 663 . 1 . 1 130 130 GLY C C 13 173.96 0.000 . 1 . . . . . 130 GLY C . 50915 1 664 . 1 . 1 130 130 GLY N N 15 109.67 0.000 . 1 . . . . . 130 GLY N . 50915 1 665 . 1 . 1 131 131 ALA H H 1 8.272 0.000 . 1 . . . . . 131 ALA H . 50915 1 666 . 1 . 1 131 131 ALA C C 13 178.25 0.000 . 1 . . . . . 131 ALA C . 50915 1 667 . 1 . 1 131 131 ALA N N 15 123.630 0.000 . 1 . . . . . 131 ALA N . 50915 1 668 . 1 . 1 132 132 GLY C C 13 174.66 0.000 . 1 . . . . . 132 GLY C . 50915 1 669 . 1 . 1 132 132 GLY N N 15 108.17 0.000 . 1 . . . . . 132 GLY N . 50915 1 670 . 1 . 1 133 133 GLY N N 15 114.445 0.049 . 1 . . . . . 133 GLY N . 50915 1 671 . 1 . 1 134 134 HIS H H 1 8.223 0.000 . 1 . . . . . 134 HIS H . 50915 1 672 . 1 . 1 134 134 HIS C C 13 174.70 0.000 . 1 . . . . . 134 HIS C . 50915 1 673 . 1 . 1 134 134 HIS N N 15 118.964 0.000 . 1 . . . . . 134 HIS N . 50915 1 674 . 1 . 1 135 135 SER H H 1 8.265 0.000 . 1 . . . . . 135 SER H . 50915 1 675 . 1 . 1 135 135 SER N N 15 117.56 0.000 . 1 . . . . . 135 SER N . 50915 1 676 . 1 . 1 136 136 TYR H H 1 8.311 0.000 . 1 . . . . . 136 TYR H . 50915 1 677 . 1 . 1 136 136 TYR C C 13 176.300 0.000 . 1 . . . . . 136 TYR C . 50915 1 678 . 1 . 1 136 136 TYR N N 15 122.208 0.000 . 1 . . . . . 136 TYR N . 50915 1 679 . 1 . 1 137 137 GLY H H 1 8.343 0.000 . 1 . . . . . 137 GLY H . 50915 1 680 . 1 . 1 137 137 GLY HA2 H 1 3.861 0.000 . 2 . . . . . 137 GLY HA2 . 50915 1 681 . 1 . 1 137 137 GLY C C 13 174.015 0.000 . 1 . . . . . 137 GLY C . 50915 1 682 . 1 . 1 137 137 GLY CA C 13 45.684 0.000 . 1 . . . . . 137 GLY CA . 50915 1 683 . 1 . 1 137 137 GLY N N 15 110.491 0.000 . 1 . . . . . 137 GLY N . 50915 1 684 . 1 . 1 138 138 ALA H H 1 8.098 0.013 . 1 . . . . . 138 ALA H . 50915 1 685 . 1 . 1 138 138 ALA HA H 1 4.329 0.005 . 1 . . . . . 138 ALA HA . 50915 1 686 . 1 . 1 138 138 ALA C C 13 177.373 0.017 . 1 . . . . . 138 ALA C . 50915 1 687 . 1 . 1 138 138 ALA CA C 13 52.863 0.040 . 1 . . . . . 138 ALA CA . 50915 1 688 . 1 . 1 138 138 ALA CB C 13 19.637 0.000 . 1 . . . . . 138 ALA CB . 50915 1 689 . 1 . 1 138 138 ALA N N 15 123.653 0.034 . 1 . . . . . 138 ALA N . 50915 1 690 . 1 . 1 139 139 ASP H H 1 8.361 0.005 . 1 . . . . . 139 ASP H . 50915 1 691 . 1 . 1 139 139 ASP HA H 1 4.610 0.005 . 1 . . . . . 139 ASP HA . 50915 1 692 . 1 . 1 139 139 ASP C C 13 176.202 0.012 . 1 . . . . . 139 ASP C . 50915 1 693 . 1 . 1 139 139 ASP CA C 13 54.406 0.058 . 1 . . . . . 139 ASP CA . 50915 1 694 . 1 . 1 139 139 ASP CB C 13 41.165 0.038 . 1 . . . . . 139 ASP CB . 50915 1 695 . 1 . 1 139 139 ASP N N 15 118.670 0.049 . 1 . . . . . 139 ASP N . 50915 1 696 . 1 . 1 140 140 LEU H H 1 8.047 0.005 . 1 . . . . . 140 LEU H . 50915 1 697 . 1 . 1 140 140 LEU HA H 1 4.355 0.001 . 1 . . . . . 140 LEU HA . 50915 1 698 . 1 . 1 140 140 LEU C C 13 177.365 0.027 . 1 . . . . . 140 LEU C . 50915 1 699 . 1 . 1 140 140 LEU CA C 13 55.598 0.056 . 1 . . . . . 140 LEU CA . 50915 1 700 . 1 . 1 140 140 LEU CB C 13 42.420 0.044 . 1 . . . . . 140 LEU CB . 50915 1 701 . 1 . 1 140 140 LEU N N 15 122.219 0.051 . 1 . . . . . 140 LEU N . 50915 1 702 . 1 . 1 141 141 LYS H H 1 8.244 0.002 . 1 . . . . . 141 LYS H . 50915 1 703 . 1 . 1 141 141 LYS HA H 1 4.340 0.002 . 1 . . . . . 141 LYS HA . 50915 1 704 . 1 . 1 141 141 LYS C C 13 176.497 0.021 . 1 . . . . . 141 LYS C . 50915 1 705 . 1 . 1 141 141 LYS CA C 13 56.521 0.024 . 1 . . . . . 141 LYS CA . 50915 1 706 . 1 . 1 141 141 LYS CB C 13 32.959 0.000 . 1 . . . . . 141 LYS CB . 50915 1 707 . 1 . 1 141 141 LYS N N 15 121.376 0.015 . 1 . . . . . 141 LYS N . 50915 1 708 . 1 . 1 142 142 SER H H 1 8.122 0.001 . 1 . . . . . 142 SER H . 50915 1 709 . 1 . 1 142 142 SER HA H 1 4.426 0.002 . 1 . . . . . 142 SER HA . 50915 1 710 . 1 . 1 142 142 SER C C 13 174.170 0.016 . 1 . . . . . 142 SER C . 50915 1 711 . 1 . 1 142 142 SER CA C 13 58.349 0.021 . 1 . . . . . 142 SER CA . 50915 1 712 . 1 . 1 142 142 SER CB C 13 63.813 0.006 . 1 . . . . . 142 SER CB . 50915 1 713 . 1 . 1 142 142 SER N N 15 116.097 0.000 . 1 . . . . . 142 SER N . 50915 1 714 . 1 . 1 143 143 PHE H H 1 8.141 0.003 . 1 . . . . . 143 PHE H . 50915 1 715 . 1 . 1 143 143 PHE HA H 1 4.667 0.002 . 1 . . . . . 143 PHE HA . 50915 1 716 . 1 . 1 143 143 PHE C C 13 175.128 0.018 . 1 . . . . . 143 PHE C . 50915 1 717 . 1 . 1 143 143 PHE CA C 13 57.817 0.029 . 1 . . . . . 143 PHE CA . 50915 1 718 . 1 . 1 143 143 PHE CB C 13 39.810 0.001 . 1 . . . . . 143 PHE CB . 50915 1 719 . 1 . 1 143 143 PHE N N 15 121.569 0.064 . 1 . . . . . 143 PHE N . 50915 1 720 . 1 . 1 144 144 ASP H H 1 8.292 0.005 . 1 . . . . . 144 ASP H . 50915 1 721 . 1 . 1 144 144 ASP HA H 1 4.664 0.002 . 1 . . . . . 144 ASP HA . 50915 1 722 . 1 . 1 144 144 ASP C C 13 176.003 0.021 . 1 . . . . . 144 ASP C . 50915 1 723 . 1 . 1 144 144 ASP CA C 13 54.399 0.044 . 1 . . . . . 144 ASP CA . 50915 1 724 . 1 . 1 144 144 ASP CB C 13 41.675 0.012 . 1 . . . . . 144 ASP CB . 50915 1 725 . 1 . 1 144 144 ASP N N 15 121.747 0.049 . 1 . . . . . 144 ASP N . 50915 1 726 . 1 . 1 145 145 LEU H H 1 8.198 0.005 . 1 . . . . . 145 LEU H . 50915 1 727 . 1 . 1 145 145 LEU HA H 1 4.359 0.004 . 1 . . . . . 145 LEU HA . 50915 1 728 . 1 . 1 145 145 LEU C C 13 177.945 0.018 . 1 . . . . . 145 LEU C . 50915 1 729 . 1 . 1 145 145 LEU CA C 13 55.616 0.062 . 1 . . . . . 145 LEU CA . 50915 1 730 . 1 . 1 145 145 LEU CB C 13 42.530 0.022 . 1 . . . . . 145 LEU CB . 50915 1 731 . 1 . 1 145 145 LEU N N 15 122.673 0.048 . 1 . . . . . 145 LEU N . 50915 1 732 . 1 . 1 146 146 GLY H H 1 8.432 0.005 . 1 . . . . . 146 GLY H . 50915 1 733 . 1 . 1 146 146 GLY HA2 H 1 4.003 0.002 . 2 . . . . . 146 GLY HA2 . 50915 1 734 . 1 . 1 146 146 GLY HA3 H 1 4.020 0.001 . 2 . . . . . 146 GLY HA3 . 50915 1 735 . 1 . 1 146 146 GLY C C 13 174.118 0.012 . 1 . . . . . 146 GLY C . 50915 1 736 . 1 . 1 146 146 GLY CA C 13 45.700 0.036 . 1 . . . . . 146 GLY CA . 50915 1 737 . 1 . 1 146 146 GLY N N 15 109.059 0.048 . 1 . . . . . 146 GLY N . 50915 1 738 . 1 . 1 147 147 ASP H H 1 8.214 0.005 . 1 . . . . . 147 ASP H . 50915 1 739 . 1 . 1 147 147 ASP HA H 1 4.670 0.009 . 1 . . . . . 147 ASP HA . 50915 1 740 . 1 . 1 147 147 ASP C C 13 176.517 0.039 . 1 . . . . . 147 ASP C . 50915 1 741 . 1 . 1 147 147 ASP CA C 13 54.584 0.044 . 1 . . . . . 147 ASP CA . 50915 1 742 . 1 . 1 147 147 ASP CB C 13 41.575 0.030 . 1 . . . . . 147 ASP CB . 50915 1 743 . 1 . 1 147 147 ASP N N 15 120.457 0.047 . 1 . . . . . 147 ASP N . 50915 1 744 . 1 . 1 148 148 GLU H H 1 8.469 0.006 . 1 . . . . . 148 GLU H . 50915 1 745 . 1 . 1 148 148 GLU HA H 1 4.308 0.003 . 1 . . . . . 148 GLU HA . 50915 1 746 . 1 . 1 148 148 GLU C C 13 176.630 0.011 . 1 . . . . . 148 GLU C . 50915 1 747 . 1 . 1 148 148 GLU CA C 13 57.065 0.050 . 1 . . . . . 148 GLU CA . 50915 1 748 . 1 . 1 148 148 GLU CB C 13 30.234 0.052 . 1 . . . . . 148 GLU CB . 50915 1 749 . 1 . 1 148 148 GLU CG C 13 36.754 0.000 . 1 . . . . . 148 GLU CG . 50915 1 750 . 1 . 1 148 148 GLU N N 15 120.824 0.048 . 1 . . . . . 148 GLU N . 50915 1 751 . 1 . 1 149 149 LEU H H 1 8.262 0.004 . 1 . . . . . 149 LEU H . 50915 1 752 . 1 . 1 149 149 LEU HA H 1 4.385 0.004 . 1 . . . . . 149 LEU HA . 50915 1 753 . 1 . 1 149 149 LEU C C 13 177.961 0.011 . 1 . . . . . 149 LEU C . 50915 1 754 . 1 . 1 149 149 LEU CA C 13 55.571 0.044 . 1 . . . . . 149 LEU CA . 50915 1 755 . 1 . 1 149 149 LEU CB C 13 42.633 0.039 . 1 . . . . . 149 LEU CB . 50915 1 756 . 1 . 1 149 149 LEU N N 15 122.386 0.047 . 1 . . . . . 149 LEU N . 50915 1 757 . 1 . 1 150 150 GLY H H 1 8.366 0.004 . 1 . . . . . 150 GLY H . 50915 1 758 . 1 . 1 150 150 GLY HA2 H 1 4.026 0.009 . 2 . . . . . 150 GLY HA2 . 50915 1 759 . 1 . 1 150 150 GLY HA3 H 1 4.036 0.002 . 2 . . . . . 150 GLY HA3 . 50915 1 760 . 1 . 1 150 150 GLY C C 13 174.201 0.030 . 1 . . . . . 150 GLY C . 50915 1 761 . 1 . 1 150 150 GLY CA C 13 45.602 0.036 . 1 . . . . . 150 GLY CA . 50915 1 762 . 1 . 1 150 150 GLY N N 15 109.211 0.049 . 1 . . . . . 150 GLY N . 50915 1 763 . 1 . 1 151 151 THR H H 1 7.984 0.004 . 1 . . . . . 151 THR H . 50915 1 764 . 1 . 1 151 151 THR HA H 1 4.378 0.008 . 1 . . . . . 151 THR HA . 50915 1 765 . 1 . 1 151 151 THR C C 13 174.088 0.050 . 1 . . . . . 151 THR C . 50915 1 766 . 1 . 1 151 151 THR CA C 13 61.706 0.045 . 1 . . . . . 151 THR CA . 50915 1 767 . 1 . 1 151 151 THR CB C 13 70.233 0.037 . 1 . . . . . 151 THR CB . 50915 1 768 . 1 . 1 151 151 THR N N 15 113.096 0.048 . 1 . . . . . 151 THR N . 50915 1 769 . 1 . 1 152 152 ASP H H 1 8.470 0.006 . 1 . . . . . 152 ASP H . 50915 1 770 . 1 . 1 152 152 ASP HA H 1 4.924 0.003 . 1 . . . . . 152 ASP HA . 50915 1 771 . 1 . 1 152 152 ASP C C 13 174.862 0.018 . 1 . . . . . 152 ASP C . 50915 1 772 . 1 . 1 152 152 ASP CA C 13 52.560 0.032 . 1 . . . . . 152 ASP CA . 50915 1 773 . 1 . 1 152 152 ASP CB C 13 41.581 0.000 . 1 . . . . . 152 ASP CB . 50915 1 774 . 1 . 1 152 152 ASP N N 15 124.405 0.048 . 1 . . . . . 152 ASP N . 50915 1 775 . 1 . 1 153 153 PRO HA H 1 4.402 0.008 . 1 . . . . . 153 PRO HA . 50915 1 776 . 1 . 1 153 153 PRO C C 13 176.808 0.008 . 1 . . . . . 153 PRO C . 50915 1 777 . 1 . 1 153 153 PRO CA C 13 63.702 0.029 . 1 . . . . . 153 PRO CA . 50915 1 778 . 1 . 1 153 153 PRO CB C 13 32.062 0.008 . 1 . . . . . 153 PRO CB . 50915 1 779 . 1 . 1 153 153 PRO N N 15 136.647 0.000 . 1 . . . . . 153 PRO N . 50915 1 780 . 1 . 1 154 154 TYR H H 1 8.238 0.006 . 1 . . . . . 154 TYR H . 50915 1 781 . 1 . 1 154 154 TYR HA H 1 4.554 0.006 . 1 . . . . . 154 TYR HA . 50915 1 782 . 1 . 1 154 154 TYR C C 13 176.021 0.005 . 1 . . . . . 154 TYR C . 50915 1 783 . 1 . 1 154 154 TYR CA C 13 58.173 0.044 . 1 . . . . . 154 TYR CA . 50915 1 784 . 1 . 1 154 154 TYR CB C 13 38.516 0.008 . 1 . . . . . 154 TYR CB . 50915 1 785 . 1 . 1 154 154 TYR N N 15 119.310 0.045 . 1 . . . . . 154 TYR N . 50915 1 786 . 1 . 1 155 155 GLU H H 1 7.970 0.007 . 1 . . . . . 155 GLU H . 50915 1 787 . 1 . 1 155 155 GLU HA H 1 4.217 0.005 . 1 . . . . . 155 GLU HA . 50915 1 788 . 1 . 1 155 155 GLU C C 13 175.874 0.006 . 1 . . . . . 155 GLU C . 50915 1 789 . 1 . 1 155 155 GLU CA C 13 56.974 0.049 . 1 . . . . . 155 GLU CA . 50915 1 790 . 1 . 1 155 155 GLU CB C 13 30.794 0.060 . 1 . . . . . 155 GLU CB . 50915 1 791 . 1 . 1 155 155 GLU N N 15 121.910 0.046 . 1 . . . . . 155 GLU N . 50915 1 792 . 1 . 1 156 156 ASP H H 1 8.229 0.004 . 1 . . . . . 156 ASP H . 50915 1 793 . 1 . 1 156 156 ASP HA H 1 4.596 0.007 . 1 . . . . . 156 ASP HA . 50915 1 794 . 1 . 1 156 156 ASP C C 13 176.084 0.009 . 1 . . . . . 156 ASP C . 50915 1 795 . 1 . 1 156 156 ASP CA C 13 54.517 0.056 . 1 . . . . . 156 ASP CA . 50915 1 796 . 1 . 1 156 156 ASP CB C 13 41.441 0.005 . 1 . . . . . 156 ASP CB . 50915 1 797 . 1 . 1 156 156 ASP N N 15 121.056 0.043 . 1 . . . . . 156 ASP N . 50915 1 798 . 1 . 1 157 157 PHE H H 1 8.122 0.005 . 1 . . . . . 157 PHE H . 50915 1 799 . 1 . 1 157 157 PHE HA H 1 4.564 0.005 . 1 . . . . . 157 PHE HA . 50915 1 800 . 1 . 1 157 157 PHE C C 13 175.873 0.005 . 1 . . . . . 157 PHE C . 50915 1 801 . 1 . 1 157 157 PHE CA C 13 58.355 0.061 . 1 . . . . . 157 PHE CA . 50915 1 802 . 1 . 1 157 157 PHE CB C 13 39.412 0.011 . 1 . . . . . 157 PHE CB . 50915 1 803 . 1 . 1 157 157 PHE N N 15 120.674 0.048 . 1 . . . . . 157 PHE N . 50915 1 804 . 1 . 1 158 158 GLN H H 1 8.116 0.004 . 1 . . . . . 158 GLN H . 50915 1 805 . 1 . 1 158 158 GLN HA H 1 4.197 0.005 . 1 . . . . . 158 GLN HA . 50915 1 806 . 1 . 1 158 158 GLN C C 13 175.957 0.013 . 1 . . . . . 158 GLN C . 50915 1 807 . 1 . 1 158 158 GLN CA C 13 56.232 0.046 . 1 . . . . . 158 GLN CA . 50915 1 808 . 1 . 1 158 158 GLN CB C 13 29.590 0.009 . 1 . . . . . 158 GLN CB . 50915 1 809 . 1 . 1 158 158 GLN N N 15 121.261 0.031 . 1 . . . . . 158 GLN N . 50915 1 810 . 1 . 1 159 159 GLU H H 1 8.291 0.008 . 1 . . . . . 159 GLU H . 50915 1 811 . 1 . 1 159 159 GLU HA H 1 4.164 0.002 . 1 . . . . . 159 GLU HA . 50915 1 812 . 1 . 1 159 159 GLU C C 13 176.500 0.013 . 1 . . . . . 159 GLU C . 50915 1 813 . 1 . 1 159 159 GLU CA C 13 56.951 0.001 . 1 . . . . . 159 GLU CA . 50915 1 814 . 1 . 1 159 159 GLU CB C 13 30.048 0.000 . 1 . . . . . 159 GLU CB . 50915 1 815 . 1 . 1 159 159 GLU N N 15 121.044 0.145 . 1 . . . . . 159 GLU N . 50915 1 816 . 1 . 1 160 160 ASN H H 1 8.357 0.001 . 1 . . . . . 160 ASN H . 50915 1 817 . 1 . 1 160 160 ASN HA H 1 4.348 0.017 . 1 . . . . . 160 ASN HA . 50915 1 818 . 1 . 1 160 160 ASN C C 13 175.448 0.000 . 1 . . . . . 160 ASN C . 50915 1 819 . 1 . 1 160 160 ASN CA C 13 54.292 0.001 . 1 . . . . . 160 ASN CA . 50915 1 820 . 1 . 1 160 160 ASN CB C 13 41.475 0.004 . 1 . . . . . 160 ASN CB . 50915 1 821 . 1 . 1 160 160 ASN N N 15 118.710 0.000 . 1 . . . . . 160 ASN N . 50915 1 822 . 1 . 1 161 161 TRP H H 1 8.140 0.011 . 1 . . . . . 161 TRP H . 50915 1 823 . 1 . 1 161 161 TRP HA H 1 4.181 0.000 . 1 . . . . . 161 TRP HA . 50915 1 824 . 1 . 1 161 161 TRP C C 13 176.741 0.000 . 1 . . . . . 161 TRP C . 50915 1 825 . 1 . 1 161 161 TRP CA C 13 57.805 0.000 . 1 . . . . . 161 TRP CA . 50915 1 826 . 1 . 1 161 161 TRP CB C 13 29.304 0.000 . 1 . . . . . 161 TRP CB . 50915 1 827 . 1 . 1 161 161 TRP N N 15 121.292 0.006 . 1 . . . . . 161 TRP N . 50915 1 828 . 1 . 1 162 162 ASN HA H 1 4.682 0.002 . 1 . . . . . 162 ASN HA . 50915 1 829 . 1 . 1 162 162 ASN CA C 13 53.787 0.010 . 1 . . . . . 162 ASN CA . 50915 1 830 . 1 . 1 162 162 ASN CB C 13 41.625 0.000 . 1 . . . . . 162 ASN CB . 50915 1 831 . 1 . 1 163 163 THR H H 1 7.944 0.002 . 1 . . . . . 163 THR H . 50915 1 832 . 1 . 1 163 163 THR HA H 1 4.380 0.005 . 1 . . . . . 163 THR HA . 50915 1 833 . 1 . 1 163 163 THR C C 13 174.850 0.000 . 1 . . . . . 163 THR C . 50915 1 834 . 1 . 1 163 163 THR CA C 13 62.800 0.042 . 1 . . . . . 163 THR CA . 50915 1 835 . 1 . 1 163 163 THR CB C 13 70.329 0.014 . 1 . . . . . 163 THR CB . 50915 1 836 . 1 . 1 163 163 THR N N 15 113.652 0.004 . 1 . . . . . 163 THR N . 50915 1 837 . 1 . 1 164 164 LYS H H 1 8.107 0.003 . 1 . . . . . 164 LYS H . 50915 1 838 . 1 . 1 164 164 LYS C C 13 174.391 0.000 . 1 . . . . . 164 LYS C . 50915 1 839 . 1 . 1 164 164 LYS CA C 13 56.991 0.000 . 1 . . . . . 164 LYS CA . 50915 1 840 . 1 . 1 164 164 LYS CB C 13 32.751 0.000 . 1 . . . . . 164 LYS CB . 50915 1 841 . 1 . 1 164 164 LYS N N 15 122.664 0.000 . 1 . . . . . 164 LYS N . 50915 1 842 . 1 . 1 165 165 HIS C C 13 174.68 0.000 . 1 . . . . . 165 HIS C . 50915 1 843 . 1 . 1 166 166 SER H H 1 8.212 0.000 . 1 . . . . . 166 SER H . 50915 1 844 . 1 . 1 166 166 SER N N 15 117.669 0.000 . 1 . . . . . 166 SER N . 50915 1 845 . 1 . 1 167 167 SER C C 13 175.05 0.000 . 1 . . . . . 167 SER C . 50915 1 846 . 1 . 1 168 168 GLY HA2 H 1 4.063 0.000 . 2 . . . . . 168 GLY HA2 . 50915 1 847 . 1 . 1 168 168 GLY HA3 H 1 3.951 0.005 . 2 . . . . . 168 GLY HA3 . 50915 1 848 . 1 . 1 168 168 GLY C C 13 174.176 0.019 . 1 . . . . . 168 GLY C . 50915 1 849 . 1 . 1 168 168 GLY CA C 13 45.657 0.054 . 1 . . . . . 168 GLY CA . 50915 1 850 . 1 . 1 168 168 GLY N N 15 110.61 0.000 . 1 . . . . . 168 GLY N . 50915 1 851 . 1 . 1 169 169 VAL H H 1 7.959 0.005 . 1 . . . . . 169 VAL H . 50915 1 852 . 1 . 1 169 169 VAL HA H 1 4.226 0.006 . 1 . . . . . 169 VAL HA . 50915 1 853 . 1 . 1 169 169 VAL C C 13 176.426 0.026 . 1 . . . . . 169 VAL C . 50915 1 854 . 1 . 1 169 169 VAL CA C 13 62.704 0.045 . 1 . . . . . 169 VAL CA . 50915 1 855 . 1 . 1 169 169 VAL CB C 13 32.773 0.007 . 1 . . . . . 169 VAL CB . 50915 1 856 . 1 . 1 169 169 VAL N N 15 119.254 0.047 . 1 . . . . . 169 VAL N . 50915 1 857 . 1 . 1 170 170 THR H H 1 8.102 0.006 . 1 . . . . . 170 THR H . 50915 1 858 . 1 . 1 170 170 THR HA H 1 4.378 0.006 . 1 . . . . . 170 THR HA . 50915 1 859 . 1 . 1 170 170 THR CA C 13 62.270 0.000 . 1 . . . . . 170 THR CA . 50915 1 860 . 1 . 1 170 170 THR CB C 13 69.860 0.000 . 1 . . . . . 170 THR CB . 50915 1 861 . 1 . 1 170 170 THR N N 15 117.796 0.000 . 1 . . . . . 170 THR N . 50915 1 862 . 1 . 1 171 171 ARG H H 1 8.365 0.001 . 1 . . . . . 171 ARG H . 50915 1 863 . 1 . 1 171 171 ARG HA H 1 4.308 0.001 . 1 . . . . . 171 ARG HA . 50915 1 864 . 1 . 1 171 171 ARG C C 13 176.112 0.012 . 1 . . . . . 171 ARG C . 50915 1 865 . 1 . 1 171 171 ARG CA C 13 56.468 0.015 . 1 . . . . . 171 ARG CA . 50915 1 866 . 1 . 1 171 171 ARG CB C 13 31.113 0.023 . 1 . . . . . 171 ARG CB . 50915 1 867 . 1 . 1 171 171 ARG N N 15 123.557 0.000 . 1 . . . . . 171 ARG N . 50915 1 868 . 1 . 1 172 172 GLU H H 1 8.451 0.007 . 1 . . . . . 172 GLU H . 50915 1 869 . 1 . 1 172 172 GLU HA H 1 4.339 0.001 . 1 . . . . . 172 GLU HA . 50915 1 870 . 1 . 1 172 172 GLU C C 13 176.752 0.000 . 1 . . . . . 172 GLU C . 50915 1 871 . 1 . 1 172 172 GLU CA C 13 57.360 0.000 . 1 . . . . . 172 GLU CA . 50915 1 872 . 1 . 1 172 172 GLU CB C 13 30.252 0.011 . 1 . . . . . 172 GLU CB . 50915 1 873 . 1 . 1 172 172 GLU N N 15 121.794 0.027 . 1 . . . . . 172 GLU N . 50915 1 874 . 1 . 1 173 173 LEU H H 1 8.143 0.002 . 1 . . . . . 173 LEU H . 50915 1 875 . 1 . 1 173 173 LEU HA H 1 4.364 0.000 . 1 . . . . . 173 LEU HA . 50915 1 876 . 1 . 1 173 173 LEU C C 13 177.584 0.060 . 1 . . . . . 173 LEU C . 50915 1 877 . 1 . 1 173 173 LEU CA C 13 55.828 0.022 . 1 . . . . . 173 LEU CA . 50915 1 878 . 1 . 1 173 173 LEU CB C 13 42.456 0.026 . 1 . . . . . 173 LEU CB . 50915 1 879 . 1 . 1 173 173 LEU N N 15 122.561 0.000 . 1 . . . . . 173 LEU N . 50915 1 880 . 1 . 1 174 174 MET H H 1 8.255 0.004 . 1 . . . . . 174 MET H . 50915 1 881 . 1 . 1 174 174 MET HA H 1 4.492 0.011 . 1 . . . . . 174 MET HA . 50915 1 882 . 1 . 1 174 174 MET C C 13 176.487 0.005 . 1 . . . . . 174 MET C . 50915 1 883 . 1 . 1 174 174 MET CA C 13 56.072 0.023 . 1 . . . . . 174 MET CA . 50915 1 884 . 1 . 1 174 174 MET CB C 13 32.689 0.000 . 1 . . . . . 174 MET CB . 50915 1 885 . 1 . 1 174 174 MET N N 15 120.277 0.048 . 1 . . . . . 174 MET N . 50915 1 886 . 1 . 1 175 175 ARG H H 1 8.184 0.015 . 1 . . . . . 175 ARG H . 50915 1 887 . 1 . 1 175 175 ARG HA H 1 4.381 0.012 . 1 . . . . . 175 ARG HA . 50915 1 888 . 1 . 1 175 175 ARG C C 13 176.619 0.024 . 1 . . . . . 175 ARG C . 50915 1 889 . 1 . 1 175 175 ARG CA C 13 56.738 0.022 . 1 . . . . . 175 ARG CA . 50915 1 890 . 1 . 1 175 175 ARG CB C 13 30.985 0.000 . 1 . . . . . 175 ARG CB . 50915 1 891 . 1 . 1 175 175 ARG N N 15 121.790 0.134 . 1 . . . . . 175 ARG N . 50915 1 892 . 1 . 1 176 176 GLU H H 1 8.396 0.014 . 1 . . . . . 176 GLU H . 50915 1 893 . 1 . 1 176 176 GLU HA H 1 4.341 0.002 . 1 . . . . . 176 GLU HA . 50915 1 894 . 1 . 1 176 176 GLU C C 13 176.849 0.000 . 1 . . . . . 176 GLU C . 50915 1 895 . 1 . 1 176 176 GLU CB C 13 30.327 0.046 . 1 . . . . . 176 GLU CB . 50915 1 896 . 1 . 1 176 176 GLU N N 15 121.271 0.001 . 1 . . . . . 176 GLU N . 50915 1 897 . 1 . 1 177 177 LEU H H 1 8.244 0.002 . 1 . . . . . 177 LEU H . 50915 1 898 . 1 . 1 177 177 LEU C C 13 177.371 0.013 . 1 . . . . . 177 LEU C . 50915 1 899 . 1 . 1 177 177 LEU CA C 13 55.629 0.000 . 1 . . . . . 177 LEU CA . 50915 1 900 . 1 . 1 177 177 LEU CB C 13 42.511 0.000 . 1 . . . . . 177 LEU CB . 50915 1 901 . 1 . 1 177 177 LEU N N 15 122.425 0.045 . 1 . . . . . 177 LEU N . 50915 1 902 . 1 . 1 178 178 ASN H H 1 8.377 0.001 . 1 . . . . . 178 ASN H . 50915 1 903 . 1 . 1 178 178 ASN HA H 1 4.681 0.002 . 1 . . . . . 178 ASN HA . 50915 1 904 . 1 . 1 178 178 ASN C C 13 175.353 0.000 . 1 . . . . . 178 ASN C . 50915 1 905 . 1 . 1 178 178 ASN CA C 13 53.884 0.000 . 1 . . . . . 178 ASN CA . 50915 1 906 . 1 . 1 178 178 ASN CB C 13 38.920 0.000 . 1 . . . . . 178 ASN CB . 50915 1 907 . 1 . 1 178 178 ASN N N 15 118.695 0.000 . 1 . . . . . 178 ASN N . 50915 1 908 . 1 . 1 179 179 GLY H H 1 8.295 0.002 . 1 . . . . . 179 GLY H . 50915 1 909 . 1 . 1 179 179 GLY HA2 H 1 4.002 0.006 . 2 . . . . . 179 GLY HA2 . 50915 1 910 . 1 . 1 179 179 GLY HA3 H 1 4.005 0.001 . 2 . . . . . 179 GLY HA3 . 50915 1 911 . 1 . 1 179 179 GLY C C 13 173.749 0.009 . 1 . . . . . 179 GLY C . 50915 1 912 . 1 . 1 179 179 GLY CA C 13 45.629 0.046 . 1 . . . . . 179 GLY CA . 50915 1 913 . 1 . 1 179 179 GLY N N 15 109.789 0.000 . 1 . . . . . 179 GLY N . 50915 1 914 . 1 . 1 180 180 GLY H H 1 7.969 0.005 . 1 . . . . . 180 GLY H . 50915 1 915 . 1 . 1 180 180 GLY C C 13 179.020 0.000 . 1 . . . . . 180 GLY C . 50915 1 916 . 1 . 1 180 180 GLY CA C 13 46.274 0.043 . 1 . . . . . 180 GLY CA . 50915 1 917 . 1 . 1 180 180 GLY N N 15 115.104 0.059 . 1 . . . . . 180 GLY N . 50915 1 stop_ save_ save_assigned_chemical_shifts_2 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_2 _Assigned_chem_shift_list.Entry_ID 50915 _Assigned_chem_shift_list.ID 2 _Assigned_chem_shift_list.Name 'wt nsp1' _Assigned_chem_shift_list.Sample_condition_list_ID 2 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_2 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 50915 2 2 '3D HNCO' . . . 50915 2 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 $software_1 . . 50915 2 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 1 1 MET C C 13 176.36 0.000 . 1 . . . . . 1 MET C . 50915 2 2 . 1 . 1 1 1 MET CA C 13 56.11 0.000 . 1 . . . . . 1 MET CA . 50915 2 3 . 1 . 1 2 2 GLU H H 1 8.81 0.010 . 1 . . . . . 2 GLU H . 50915 2 4 . 1 . 1 2 2 GLU C C 13 176.46 0.000 . 1 . . . . . 2 GLU C . 50915 2 5 . 1 . 1 2 2 GLU CA C 13 57.31 0.000 . 1 . . . . . 2 GLU CA . 50915 2 6 . 1 . 1 2 2 GLU CB C 13 30.04 0.042 . 1 . . . . . 2 GLU CB . 50915 2 7 . 1 . 1 2 2 GLU N N 15 122.13 0.000 . 1 . . . . . 2 GLU N . 50915 2 8 . 1 . 1 3 3 SER H H 1 8.23 0.000 . 1 . . . . . 3 SER H . 50915 2 9 . 1 . 1 3 3 SER HA H 1 4.31 0.005 . 1 . . . . . 3 SER HA . 50915 2 10 . 1 . 1 3 3 SER C C 13 174.19 0.016 . 1 . . . . . 3 SER C . 50915 2 11 . 1 . 1 3 3 SER CA C 13 58.45 0.020 . 1 . . . . . 3 SER CA . 50915 2 12 . 1 . 1 3 3 SER CB C 13 63.88 0.010 . 1 . . . . . 3 SER CB . 50915 2 13 . 1 . 1 3 3 SER N N 15 116.38 0.000 . 1 . . . . . 3 SER N . 50915 2 14 . 1 . 1 4 4 LEU H H 1 8.180 0.005 . 1 . . . . . 4 LEU H . 50915 2 15 . 1 . 1 4 4 LEU HA H 1 4.36 0.010 . 1 . . . . . 4 LEU HA . 50915 2 16 . 1 . 1 4 4 LEU C C 13 176.940 0.010 . 1 . . . . . 4 LEU C . 50915 2 17 . 1 . 1 4 4 LEU CA C 13 55.380 0.010 . 1 . . . . . 4 LEU CA . 50915 2 18 . 1 . 1 4 4 LEU CB C 13 42.510 0.000 . 1 . . . . . 4 LEU CB . 50915 2 19 . 1 . 1 4 4 LEU N N 15 124.160 0.040 . 1 . . . . . 4 LEU N . 50915 2 20 . 1 . 1 5 5 VAL H H 1 8.100 0.005 . 1 . . . . . 5 VAL H . 50915 2 21 . 1 . 1 5 5 VAL HA H 1 4.440 0.010 . 1 . . . . . 5 VAL HA . 50915 2 22 . 1 . 1 5 5 VAL C C 13 174.360 0.015 . 1 . . . . . 5 VAL C . 50915 2 23 . 1 . 1 5 5 VAL CA C 13 59.930 0.010 . 1 . . . . . 5 VAL CA . 50915 2 24 . 1 . 1 5 5 VAL CB C 13 32.650 0.010 . 1 . . . . . 5 VAL CB . 50915 2 25 . 1 . 1 5 5 VAL N N 15 122.24 0.032 . 1 . . . . . 5 VAL N . 50915 2 26 . 1 . 1 6 6 PRO HA H 1 4.36 0.000 . 1 . . . . . 6 PRO HA . 50915 2 27 . 1 . 1 6 6 PRO C C 13 177.33 0.000 . 1 . . . . . 6 PRO C . 50915 2 28 . 1 . 1 6 6 PRO CA C 13 63.690 0.000 . 1 . . . . . 6 PRO CA . 50915 2 29 . 1 . 1 6 6 PRO CB C 13 32.070 0.000 . 1 . . . . . 6 PRO CB . 50915 2 30 . 1 . 1 6 6 PRO N N 15 139.476 0.000 . 1 . . . . . 6 PRO N . 50915 2 31 . 1 . 1 7 7 GLY H H 1 8.480 0.005 . 1 . . . . . 7 GLY H . 50915 2 32 . 1 . 1 7 7 GLY HA2 H 1 3.920 0.005 . 1 . . . . . 7 GLY HA2 . 50915 2 33 . 1 . 1 7 7 GLY C C 13 173.490 0.010 . 1 . . . . . 7 GLY C . 50915 2 34 . 1 . 1 7 7 GLY CA C 13 45.310 0.023 . 1 . . . . . 7 GLY CA . 50915 2 35 . 1 . 1 7 7 GLY N N 15 109.120 0.012 . 1 . . . . . 7 GLY N . 50915 2 36 . 1 . 1 8 8 PHE H H 1 7.800 0.005 . 1 . . . . . 8 PHE H . 50915 2 37 . 1 . 1 8 8 PHE C C 13 174.050 0.020 . 1 . . . . . 8 PHE C . 50915 2 38 . 1 . 1 8 8 PHE CA C 13 57.090 0.010 . 1 . . . . . 8 PHE CA . 50915 2 39 . 1 . 1 8 8 PHE CB C 13 40.040 0.010 . 1 . . . . . 8 PHE CB . 50915 2 40 . 1 . 1 8 8 PHE N N 15 118.520 0.048 . 1 . . . . . 8 PHE N . 50915 2 41 . 1 . 1 9 9 ASN H H 1 8.634 0.006 . 1 . . . . . 9 ASN H . 50915 2 42 . 1 . 1 9 9 ASN HA H 1 4.570 0.005 . 1 . . . . . 9 ASN HA . 50915 2 43 . 1 . 1 9 9 ASN C C 13 175.000 0.000 . 1 . . . . . 9 ASN C . 50915 2 44 . 1 . 1 9 9 ASN CA C 13 52.950 0.011 . 1 . . . . . 9 ASN CA . 50915 2 45 . 1 . 1 9 9 ASN CB C 13 39.470 0.000 . 1 . . . . . 9 ASN CB . 50915 2 46 . 1 . 1 9 9 ASN N N 15 121.380 0.000 . 1 . . . . . 9 ASN N . 50915 2 47 . 1 . 1 10 10 GLU H H 1 8.610 0.005 . 1 . . . . . 10 GLU H . 50915 2 48 . 1 . 1 10 10 GLU HA H 1 4.410 0.005 . 1 . . . . . 10 GLU HA . 50915 2 49 . 1 . 1 10 10 GLU C C 13 176.870 0.000 . 1 . . . . . 10 GLU C . 50915 2 50 . 1 . 1 10 10 GLU CA C 13 57.720 0.008 . 1 . . . . . 10 GLU CA . 50915 2 51 . 1 . 1 10 10 GLU CB C 13 29.57 0.012 . 1 . . . . . 10 GLU CB . 50915 2 52 . 1 . 1 10 10 GLU N N 15 123.520 0.000 . 1 . . . . . 10 GLU N . 50915 2 53 . 1 . 1 11 11 LYS H H 1 8.430 0.004 . 1 . . . . . 11 LYS H . 50915 2 54 . 1 . 1 11 11 LYS HA H 1 4.30 0.005 . 1 . . . . . 11 LYS HA . 50915 2 55 . 1 . 1 11 11 LYS C C 13 178.140 0.000 . 1 . . . . . 11 LYS C . 50915 2 56 . 1 . 1 11 11 LYS CA C 13 57.670 0.005 . 1 . . . . . 11 LYS CA . 50915 2 57 . 1 . 1 11 11 LYS CB C 13 32.650 0.000 . 1 . . . . . 11 LYS CB . 50915 2 58 . 1 . 1 11 11 LYS N N 15 117.980 0.000 . 1 . . . . . 11 LYS N . 50915 2 59 . 1 . 1 12 12 THR H H 1 7.690 0.005 . 1 . . . . . 12 THR H . 50915 2 60 . 1 . 1 12 12 THR HA H 1 4.250 0.005 . 1 . . . . . 12 THR HA . 50915 2 61 . 1 . 1 12 12 THR C C 13 174.550 0.020 . 1 . . . . . 12 THR C . 50915 2 62 . 1 . 1 12 12 THR CA C 13 62.470 0.010 . 1 . . . . . 12 THR CA . 50915 2 63 . 1 . 1 12 12 THR CB C 13 69.820 0.010 . 1 . . . . . 12 THR CB . 50915 2 64 . 1 . 1 13 13 HIS H H 1 8.260 0.005 . 1 . . . . . 13 HIS H . 50915 2 65 . 1 . 1 13 13 HIS HA H 1 4.370 0.005 . 1 . . . . . 13 HIS HA . 50915 2 66 . 1 . 1 13 13 HIS C C 13 173.450 0.020 . 1 . . . . . 13 HIS C . 50915 2 67 . 1 . 1 13 13 HIS CA C 13 56.720 0.057 . 1 . . . . . 13 HIS CA . 50915 2 68 . 1 . 1 13 13 HIS CB C 13 35.120 0.010 . 1 . . . . . 13 HIS CB . 50915 2 69 . 1 . 1 13 13 HIS N N 15 122.330 0.000 . 1 . . . . . 13 HIS N . 50915 2 70 . 1 . 1 14 14 VAL H H 1 8.960 0.005 . 1 . . . . . 14 VAL H . 50915 2 71 . 1 . 1 14 14 VAL HA H 1 4.600 0.005 . 1 . . . . . 14 VAL HA . 50915 2 72 . 1 . 1 14 14 VAL C C 13 173.660 0.000 . 1 . . . . . 14 VAL C . 50915 2 73 . 1 . 1 14 14 VAL CA C 13 59.890 0.025 . 1 . . . . . 14 VAL CA . 50915 2 74 . 1 . 1 14 14 VAL CB C 13 35.120 0.020 . 1 . . . . . 14 VAL CB . 50915 2 75 . 1 . 1 14 14 VAL N N 15 117.034 0.040 . 1 . . . . . 14 VAL N . 50915 2 76 . 1 . 1 15 15 GLN H H 1 8.610 0.005 . 1 . . . . . 15 GLN H . 50915 2 77 . 1 . 1 15 15 GLN HA H 1 4.880 0.005 . 1 . . . . . 15 GLN HA . 50915 2 78 . 1 . 1 15 15 GLN C C 13 174.690 0.010 . 1 . . . . . 15 GLN C . 50915 2 79 . 1 . 1 15 15 GLN CA C 13 55.290 0.037 . 1 . . . . . 15 GLN CA . 50915 2 80 . 1 . 1 15 15 GLN CB C 13 29.660 0.020 . 1 . . . . . 15 GLN CB . 50915 2 81 . 1 . 1 15 15 GLN N N 15 125.990 0.049 . 1 . . . . . 15 GLN N . 50915 2 82 . 1 . 1 16 16 LEU H H 1 8.940 0.005 . 1 . . . . . 16 LEU H . 50915 2 83 . 1 . 1 16 16 LEU HA H 1 4.910 0.005 . 1 . . . . . 16 LEU HA . 50915 2 84 . 1 . 1 16 16 LEU C C 13 175.610 0.020 . 1 . . . . . 16 LEU C . 50915 2 85 . 1 . 1 16 16 LEU CA C 13 53.850 0.063 . 1 . . . . . 16 LEU CA . 50915 2 86 . 1 . 1 16 16 LEU CB C 13 45.820 0.057 . 1 . . . . . 16 LEU CB . 50915 2 87 . 1 . 1 16 16 LEU N N 15 125.600 0.040 . 1 . . . . . 16 LEU N . 50915 2 88 . 1 . 1 17 17 SER H H 1 8.630 0.005 . 1 . . . . . 17 SER H . 50915 2 89 . 1 . 1 17 17 SER HA H 1 5.110 0.005 . 1 . . . . . 17 SER HA . 50915 2 90 . 1 . 1 17 17 SER C C 13 174.100 0.079 . 1 . . . . . 17 SER C . 50915 2 91 . 1 . 1 17 17 SER CA C 13 56.730 0.043 . 1 . . . . . 17 SER CA . 50915 2 92 . 1 . 1 17 17 SER CB C 13 63.400 0.058 . 1 . . . . . 17 SER CB . 50915 2 93 . 1 . 1 17 17 SER N N 15 117.090 0.032 . 1 . . . . . 17 SER N . 50915 2 94 . 1 . 1 18 18 LEU H H 1 9.160 0.005 . 1 . . . . . 18 LEU H . 50915 2 95 . 1 . 1 18 18 LEU CA C 13 51.620 0.030 . 1 . . . . . 18 LEU CA . 50915 2 96 . 1 . 1 18 18 LEU CB C 13 43.590 0.043 . 1 . . . . . 18 LEU CB . 50915 2 97 . 1 . 1 18 18 LEU N N 15 126.810 0.044 . 1 . . . . . 18 LEU N . 50915 2 98 . 1 . 1 19 19 PRO HA H 1 4.091 0.005 . 1 . . . . . 19 PRO HA . 50915 2 99 . 1 . 1 19 19 PRO C C 13 174.270 0.011 . 1 . . . . . 19 PRO C . 50915 2 100 . 1 . 1 19 19 PRO CA C 13 62.390 0.020 . 1 . . . . . 19 PRO CA . 50915 2 101 . 1 . 1 19 19 PRO CB C 13 32.080 0.000 . 1 . . . . . 19 PRO CB . 50915 2 102 . 1 . 1 20 20 VAL H H 1 8.410 0.005 . 1 . . . . . 20 VAL H . 50915 2 103 . 1 . 1 20 20 VAL HA H 1 4.730 0.005 . 1 . . . . . 20 VAL HA . 50915 2 104 . 1 . 1 20 20 VAL C C 13 174.940 0.018 . 1 . . . . . 20 VAL C . 50915 2 105 . 1 . 1 20 20 VAL CA C 13 61.170 0.032 . 1 . . . . . 20 VAL CA . 50915 2 106 . 1 . 1 20 20 VAL CB C 13 31.750 0.020 . 1 . . . . . 20 VAL CB . 50915 2 107 . 1 . 1 20 20 VAL N N 15 124.724 0.050 . 1 . . . . . 20 VAL N . 50915 2 108 . 1 . 1 21 21 LEU H H 1 8.860 0.005 . 1 . . . . . 21 LEU H . 50915 2 109 . 1 . 1 21 21 LEU HA H 1 4.720 0.005 . 1 . . . . . 21 LEU HA . 50915 2 110 . 1 . 1 21 21 LEU C C 13 176.670 0.021 . 1 . . . . . 21 LEU C . 50915 2 111 . 1 . 1 21 21 LEU CA C 13 52.000 0.020 . 1 . . . . . 21 LEU CA . 50915 2 112 . 1 . 1 21 21 LEU CB C 13 43.190 0.056 . 1 . . . . . 21 LEU CB . 50915 2 113 . 1 . 1 21 21 LEU N N 15 126.110 0.031 . 1 . . . . . 21 LEU N . 50915 2 114 . 1 . 1 22 22 GLN H H 1 9.120 0.005 . 1 . . . . . 22 GLN H . 50915 2 115 . 1 . 1 22 22 GLN HA H 1 4.510 0.005 . 1 . . . . . 22 GLN HA . 50915 2 116 . 1 . 1 22 22 GLN C C 13 178.450 0.017 . 1 . . . . . 22 GLN C . 50915 2 117 . 1 . 1 22 22 GLN CA C 13 55.530 0.062 . 1 . . . . . 22 GLN CA . 50915 2 118 . 1 . 1 22 22 GLN CB C 13 29.470 0.012 . 1 . . . . . 22 GLN CB . 50915 2 119 . 1 . 1 22 22 GLN N N 15 121.080 0.030 . 1 . . . . . 22 GLN N . 50915 2 120 . 1 . 1 23 23 VAL H H 1 9.060 0.005 . 1 . . . . . 23 VAL H . 50915 2 121 . 1 . 1 23 23 VAL HA H 1 3.790 0.005 . 1 . . . . . 23 VAL HA . 50915 2 122 . 1 . 1 23 23 VAL C C 13 175.880 0.004 . 1 . . . . . 23 VAL C . 50915 2 123 . 1 . 1 23 23 VAL CA C 13 65.900 0.048 . 1 . . . . . 23 VAL CA . 50915 2 124 . 1 . 1 23 23 VAL CB C 13 31.310 0.026 . 1 . . . . . 23 VAL CB . 50915 2 125 . 1 . 1 23 23 VAL N N 15 125.740 0.044 . 1 . . . . . 23 VAL N . 50915 2 126 . 1 . 1 24 24 ARG H H 1 8.070 0.005 . 1 . . . . . 24 ARG H . 50915 2 127 . 1 . 1 24 24 ARG HA H 1 4.230 0.005 . 1 . . . . . 24 ARG HA . 50915 2 128 . 1 . 1 24 24 ARG C C 13 176.750 0.008 . 1 . . . . . 24 ARG C . 50915 2 129 . 1 . 1 24 24 ARG CA C 13 58.080 0.042 . 1 . . . . . 24 ARG CA . 50915 2 130 . 1 . 1 24 24 ARG CB C 13 29.990 0.009 . 1 . . . . . 24 ARG CB . 50915 2 131 . 1 . 1 24 24 ARG N N 15 117.790 0.032 . 1 . . . . . 24 ARG N . 50915 2 132 . 1 . 1 25 25 ASP H H 1 7.680 0.005 . 1 . . . . . 25 ASP H . 50915 2 133 . 1 . 1 25 25 ASP HA H 1 4.600 0.005 . 1 . . . . . 25 ASP HA . 50915 2 134 . 1 . 1 25 25 ASP C C 13 176.230 0.030 . 1 . . . . . 25 ASP C . 50915 2 135 . 1 . 1 25 25 ASP CA C 13 54.950 0.086 . 1 . . . . . 25 ASP CA . 50915 2 136 . 1 . 1 25 25 ASP CB C 13 42.360 0.030 . 1 . . . . . 25 ASP CB . 50915 2 137 . 1 . 1 25 25 ASP N N 15 117.100 0.034 . 1 . . . . . 25 ASP N . 50915 2 138 . 1 . 1 26 26 VAL H H 1 6.860 0.005 . 1 . . . . . 26 VAL H . 50915 2 139 . 1 . 1 26 26 VAL HA H 1 3.980 0.005 . 1 . . . . . 26 VAL HA . 50915 2 140 . 1 . 1 26 26 VAL C C 13 177.060 0.020 . 1 . . . . . 26 VAL C . 50915 2 141 . 1 . 1 26 26 VAL CA C 13 64.200 0.057 . 1 . . . . . 26 VAL CA . 50915 2 142 . 1 . 1 26 26 VAL CB C 13 31.610 0.004 . 1 . . . . . 26 VAL CB . 50915 2 143 . 1 . 1 26 26 VAL N N 15 118.240 0.030 . 1 . . . . . 26 VAL N . 50915 2 144 . 1 . 1 27 27 LEU H H 1 9.350 0.005 . 1 . . . . . 27 LEU H . 50915 2 145 . 1 . 1 27 27 LEU HA H 1 4.282 0.005 . 1 . . . . . 27 LEU HA . 50915 2 146 . 1 . 1 27 27 LEU C C 13 177.780 0.023 . 1 . . . . . 27 LEU C . 50915 2 147 . 1 . 1 27 27 LEU CA C 13 57.390 0.045 . 1 . . . . . 27 LEU CA . 50915 2 148 . 1 . 1 27 27 LEU CB C 13 42.920 0.010 . 1 . . . . . 27 LEU CB . 50915 2 149 . 1 . 1 27 27 LEU N N 15 131.750 0.053 . 1 . . . . . 27 LEU N . 50915 2 150 . 1 . 1 28 28 VAL H H 1 10.050 0.005 . 1 . . . . . 28 VAL H . 50915 2 151 . 1 . 1 28 28 VAL HA H 1 4.080 0.005 . 1 . . . . . 28 VAL HA . 50915 2 152 . 1 . 1 28 28 VAL C C 13 174.840 0.010 . 1 . . . . . 28 VAL C . 50915 2 153 . 1 . 1 28 28 VAL CA C 13 62.890 0.048 . 1 . . . . . 28 VAL CA . 50915 2 154 . 1 . 1 28 28 VAL CB C 13 32.310 0.000 . 1 . . . . . 28 VAL CB . 50915 2 155 . 1 . 1 28 28 VAL N N 15 126.780 0.039 . 1 . . . . . 28 VAL N . 50915 2 156 . 1 . 1 29 29 ARG H H 1 8.040 0.005 . 1 . . . . . 29 ARG H . 50915 2 157 . 1 . 1 29 29 ARG HA H 1 3.880 0.005 . 1 . . . . . 29 ARG HA . 50915 2 158 . 1 . 1 29 29 ARG C C 13 175.230 0.021 . 1 . . . . . 29 ARG C . 50915 2 159 . 1 . 1 29 29 ARG CA C 13 57.250 0.057 . 1 . . . . . 29 ARG CA . 50915 2 160 . 1 . 1 29 29 ARG CB C 13 30.670 0.034 . 1 . . . . . 29 ARG CB . 50915 2 161 . 1 . 1 29 29 ARG N N 15 119.770 0.017 . 1 . . . . . 29 ARG N . 50915 2 162 . 1 . 1 30 30 GLY H H 1 7.230 0.007 . 1 . . . . . 30 GLY H . 50915 2 163 . 1 . 1 30 30 GLY HA2 H 1 4.440 0.005 . 2 . . . . . 30 GLY HA2 . 50915 2 164 . 1 . 1 30 30 GLY HA3 H 1 3.900 0.005 . 2 . . . . . 30 GLY HA3 . 50915 2 165 . 1 . 1 30 30 GLY C C 13 172.010 0.021 . 1 . . . . . 30 GLY C . 50915 2 166 . 1 . 1 30 30 GLY CA C 13 45.500 0.045 . 1 . . . . . 30 GLY CA . 50915 2 167 . 1 . 1 30 30 GLY N N 15 106.010 0.036 . 1 . . . . . 30 GLY N . 50915 2 168 . 1 . 1 31 31 PHE H H 1 9.670 0.005 . 1 . . . . . 31 PHE H . 50915 2 169 . 1 . 1 31 31 PHE HA H 1 4.610 0.005 . 1 . . . . . 31 PHE HA . 50915 2 170 . 1 . 1 31 31 PHE C C 13 175.460 0.028 . 1 . . . . . 31 PHE C . 50915 2 171 . 1 . 1 31 31 PHE CA C 13 59.540 0.023 . 1 . . . . . 31 PHE CA . 50915 2 172 . 1 . 1 31 31 PHE CB C 13 41.410 0.044 . 1 . . . . . 31 PHE CB . 50915 2 173 . 1 . 1 31 31 PHE N N 15 115.600 0.024 . 1 . . . . . 31 PHE N . 50915 2 174 . 1 . 1 32 32 GLY H H 1 7.490 0.005 . 1 . . . . . 32 GLY H . 50915 2 175 . 1 . 1 32 32 GLY HA2 H 1 3.880 0.005 . 2 . . . . . 32 GLY HA2 . 50915 2 176 . 1 . 1 32 32 GLY HA3 H 1 4.250 0.005 . 2 . . . . . 32 GLY HA3 . 50915 2 177 . 1 . 1 32 32 GLY C C 13 172.500 0.008 . 1 . . . . . 32 GLY C . 50915 2 178 . 1 . 1 32 32 GLY CA C 13 45.740 0.034 . 1 . . . . . 32 GLY CA . 50915 2 179 . 1 . 1 32 32 GLY N N 15 106.810 0.047 . 1 . . . . . 32 GLY N . 50915 2 180 . 1 . 1 33 33 ASP H H 1 8.450 0.005 . 1 . . . . . 33 ASP H . 50915 2 181 . 1 . 1 33 33 ASP HA H 1 4.960 0.005 . 1 . . . . . 33 ASP HA . 50915 2 182 . 1 . 1 33 33 ASP C C 13 175.650 0.027 . 1 . . . . . 33 ASP C . 50915 2 183 . 1 . 1 33 33 ASP CA C 13 55.250 0.068 . 1 . . . . . 33 ASP CA . 50915 2 184 . 1 . 1 33 33 ASP CB C 13 43.220 0.054 . 1 . . . . . 33 ASP CB . 50915 2 185 . 1 . 1 33 33 ASP N N 15 115.620 0.048 . 1 . . . . . 33 ASP N . 50915 2 186 . 1 . 1 34 34 SER H H 1 7.510 0.005 . 1 . . . . . 34 SER H . 50915 2 187 . 1 . 1 34 34 SER HA H 1 4.770 0.005 . 1 . . . . . 34 SER HA . 50915 2 188 . 1 . 1 34 34 SER C C 13 174.300 0.000 . 1 . . . . . 34 SER C . 50915 2 189 . 1 . 1 34 34 SER CA C 13 56.360 0.032 . 1 . . . . . 34 SER CA . 50915 2 190 . 1 . 1 34 34 SER CB C 13 66.330 0.006 . 1 . . . . . 34 SER CB . 50915 2 191 . 1 . 1 34 34 SER N N 15 112.150 0.045 . 1 . . . . . 34 SER N . 50915 2 192 . 1 . 1 35 35 VAL H H 1 9.110 0.005 . 1 . . . . . 35 VAL H . 50915 2 193 . 1 . 1 35 35 VAL HA H 1 3.460 0.005 . 1 . . . . . 35 VAL HA . 50915 2 194 . 1 . 1 35 35 VAL C C 13 176.090 0.021 . 1 . . . . . 35 VAL C . 50915 2 195 . 1 . 1 35 35 VAL CA C 13 67.470 0.003 . 1 . . . . . 35 VAL CA . 50915 2 196 . 1 . 1 35 35 VAL CB C 13 31.900 0.007 . 1 . . . . . 35 VAL CB . 50915 2 197 . 1 . 1 35 35 VAL N N 15 124.040 0.008 . 1 . . . . . 35 VAL N . 50915 2 198 . 1 . 1 36 36 GLU H H 1 8.700 0.005 . 1 . . . . . 36 GLU H . 50915 2 199 . 1 . 1 36 36 GLU HA H 1 4.167 0.005 . 1 . . . . . 36 GLU HA . 50915 2 200 . 1 . 1 36 36 GLU C C 13 179.390 0.019 . 1 . . . . . 36 GLU C . 50915 2 201 . 1 . 1 36 36 GLU CA C 13 60.110 0.048 . 1 . . . . . 36 GLU CA . 50915 2 202 . 1 . 1 36 36 GLU CB C 13 29.170 0.020 . 1 . . . . . 36 GLU CB . 50915 2 203 . 1 . 1 36 36 GLU N N 15 116.940 0.034 . 1 . . . . . 36 GLU N . 50915 2 204 . 1 . 1 37 37 GLU H H 1 7.530 0.005 . 1 . . . . . 37 GLU H . 50915 2 205 . 1 . 1 37 37 GLU HA H 1 4.170 0.005 . 1 . . . . . 37 GLU HA . 50915 2 206 . 1 . 1 37 37 GLU C C 13 178.660 0.003 . 1 . . . . . 37 GLU C . 50915 2 207 . 1 . 1 37 37 GLU CA C 13 59.170 0.034 . 1 . . . . . 37 GLU CA . 50915 2 208 . 1 . 1 37 37 GLU CB C 13 30.970 0.076 . 1 . . . . . 37 GLU CB . 50915 2 209 . 1 . 1 37 37 GLU N N 15 119.050 0.045 . 1 . . . . . 37 GLU N . 50915 2 210 . 1 . 1 38 38 VAL H H 1 8.480 0.005 . 1 . . . . . 38 VAL H . 50915 2 211 . 1 . 1 38 38 VAL HA H 1 3.850 0.005 . 1 . . . . . 38 VAL HA . 50915 2 212 . 1 . 1 38 38 VAL C C 13 177.890 0.012 . 1 . . . . . 38 VAL C . 50915 2 213 . 1 . 1 38 38 VAL CA C 13 65.850 0.034 . 1 . . . . . 38 VAL CA . 50915 2 214 . 1 . 1 38 38 VAL CB C 13 30.140 0.029 . 1 . . . . . 38 VAL CB . 50915 2 215 . 1 . 1 38 38 VAL N N 15 112.340 0.041 . 1 . . . . . 38 VAL N . 50915 2 216 . 1 . 1 39 39 LEU H H 1 7.550 0.005 . 1 . . . . . 39 LEU H . 50915 2 217 . 1 . 1 39 39 LEU HA H 1 3.949 0.005 . 1 . . . . . 39 LEU HA . 50915 2 218 . 1 . 1 39 39 LEU C C 13 178.640 0.013 . 1 . . . . . 39 LEU C . 50915 2 219 . 1 . 1 39 39 LEU CA C 13 58.260 0.037 . 1 . . . . . 39 LEU CA . 50915 2 220 . 1 . 1 39 39 LEU CB C 13 42.110 0.048 . 1 . . . . . 39 LEU CB . 50915 2 221 . 1 . 1 39 39 LEU N N 15 120.680 0.057 . 1 . . . . . 39 LEU N . 50915 2 222 . 1 . 1 40 40 SER H H 1 7.470 0.005 . 1 . . . . . 40 SER H . 50915 2 223 . 1 . 1 40 40 SER HA H 1 4.100 0.005 . 1 . . . . . 40 SER HA . 50915 2 224 . 1 . 1 40 40 SER C C 13 178.390 0.007 . 1 . . . . . 40 SER C . 50915 2 225 . 1 . 1 40 40 SER CA C 13 61.730 0.078 . 1 . . . . . 40 SER CA . 50915 2 226 . 1 . 1 40 40 SER CB C 13 62.610 0.066 . 1 . . . . . 40 SER CB . 50915 2 227 . 1 . 1 40 40 SER N N 15 113.810 0.036 . 1 . . . . . 40 SER N . 50915 2 228 . 1 . 1 41 41 GLU H H 1 8.660 0.005 . 1 . . . . . 41 GLU H . 50915 2 229 . 1 . 1 41 41 GLU HA H 1 4.170 0.005 . 1 . . . . . 41 GLU HA . 50915 2 230 . 1 . 1 41 41 GLU C C 13 179.440 0.023 . 1 . . . . . 41 GLU C . 50915 2 231 . 1 . 1 41 41 GLU CA C 13 58.780 0.042 . 1 . . . . . 41 GLU CA . 50915 2 232 . 1 . 1 41 41 GLU CB C 13 30.670 0.005 . 1 . . . . . 41 GLU CB . 50915 2 233 . 1 . 1 41 41 GLU N N 15 121.370 0.045 . 1 . . . . . 41 GLU N . 50915 2 234 . 1 . 1 42 42 ALA H H 1 8.410 0.005 . 1 . . . . . 42 ALA H . 50915 2 235 . 1 . 1 42 42 ALA HA H 1 3.880 0.005 . 1 . . . . . 42 ALA HA . 50915 2 236 . 1 . 1 42 42 ALA C C 13 179.240 0.007 . 1 . . . . . 42 ALA C . 50915 2 237 . 1 . 1 42 42 ALA CA C 13 55.850 0.045 . 1 . . . . . 42 ALA CA . 50915 2 238 . 1 . 1 42 42 ALA CB C 13 18.250 0.034 . 1 . . . . . 42 ALA CB . 50915 2 239 . 1 . 1 42 42 ALA N N 15 123.780 0.053 . 1 . . . . . 42 ALA N . 50915 2 240 . 1 . 1 43 43 ARG H H 1 7.700 0.005 . 1 . . . . . 43 ARG H . 50915 2 241 . 1 . 1 43 43 ARG HA H 1 4.145 0.005 . 1 . . . . . 43 ARG HA . 50915 2 242 . 1 . 1 43 43 ARG C C 13 178.760 0.012 . 1 . . . . . 43 ARG C . 50915 2 243 . 1 . 1 43 43 ARG CA C 13 60.590 0.048 . 1 . . . . . 43 ARG CA . 50915 2 244 . 1 . 1 43 43 ARG CB C 13 29.740 0.023 . 1 . . . . . 43 ARG CB . 50915 2 245 . 1 . 1 43 43 ARG N N 15 114.780 0.076 . 1 . . . . . 43 ARG N . 50915 2 246 . 1 . 1 44 44 GLN H H 1 7.650 0.005 . 1 . . . . . 44 GLN H . 50915 2 247 . 1 . 1 44 44 GLN HA H 1 3.870 0.005 . 1 . . . . . 44 GLN HA . 50915 2 248 . 1 . 1 44 44 GLN C C 13 177.760 0.005 . 1 . . . . . 44 GLN C . 50915 2 249 . 1 . 1 44 44 GLN CA C 13 58.840 0.068 . 1 . . . . . 44 GLN CA . 50915 2 250 . 1 . 1 44 44 GLN CB C 13 28.660 0.043 . 1 . . . . . 44 GLN CB . 50915 2 251 . 1 . 1 44 44 GLN N N 15 119.750 0.041 . 1 . . . . . 44 GLN N . 50915 2 252 . 1 . 1 45 45 HIS H H 1 8.340 0.005 . 1 . . . . . 45 HIS H . 50915 2 253 . 1 . 1 45 45 HIS HA H 1 4.400 0.005 . 1 . . . . . 45 HIS HA . 50915 2 254 . 1 . 1 45 45 HIS C C 13 178.400 0.012 . 1 . . . . . 45 HIS C . 50915 2 255 . 1 . 1 45 45 HIS CA C 13 59.780 0.075 . 1 . . . . . 45 HIS CA . 50915 2 256 . 1 . 1 45 45 HIS CB C 13 29.540 0.021 . 1 . . . . . 45 HIS CB . 50915 2 257 . 1 . 1 45 45 HIS N N 15 117.040 0.042 . 1 . . . . . 45 HIS N . 50915 2 258 . 1 . 1 46 46 LEU H H 1 8.740 0.005 . 1 . . . . . 46 LEU H . 50915 2 259 . 1 . 1 46 46 LEU HA H 1 4.020 0.005 . 1 . . . . . 46 LEU HA . 50915 2 260 . 1 . 1 46 46 LEU C C 13 179.550 0.002 . 1 . . . . . 46 LEU C . 50915 2 261 . 1 . 1 46 46 LEU CA C 13 58.440 0.032 . 1 . . . . . 46 LEU CA . 50915 2 262 . 1 . 1 46 46 LEU CB C 13 42.240 0.062 . 1 . . . . . 46 LEU CB . 50915 2 263 . 1 . 1 46 46 LEU N N 15 121.700 0.031 . 1 . . . . . 46 LEU N . 50915 2 264 . 1 . 1 47 47 LYS H H 1 7.630 0.005 . 1 . . . . . 47 LYS H . 50915 2 265 . 1 . 1 47 47 LYS HA H 1 3.930 0.005 . 1 . . . . . 47 LYS HA . 50915 2 266 . 1 . 1 47 47 LYS C C 13 178.220 0.011 . 1 . . . . . 47 LYS C . 50915 2 267 . 1 . 1 47 47 LYS CA C 13 59.470 0.032 . 1 . . . . . 47 LYS CA . 50915 2 268 . 1 . 1 47 47 LYS CB C 13 32.630 0.021 . 1 . . . . . 47 LYS CB . 50915 2 269 . 1 . 1 47 47 LYS N N 15 120.280 0.042 . 1 . . . . . 47 LYS N . 50915 2 270 . 1 . 1 48 48 ASP H H 1 7.970 0.005 . 1 . . . . . 48 ASP H . 50915 2 271 . 1 . 1 48 48 ASP HA H 1 4.320 0.005 . 1 . . . . . 48 ASP HA . 50915 2 272 . 1 . 1 48 48 ASP C C 13 176.880 0.023 . 1 . . . . . 48 ASP C . 50915 2 273 . 1 . 1 48 48 ASP CA C 13 55.140 0.066 . 1 . . . . . 48 ASP CA . 50915 2 274 . 1 . 1 48 48 ASP CB C 13 41.500 0.000 . 1 . . . . . 48 ASP CB . 50915 2 275 . 1 . 1 48 48 ASP N N 15 116.890 0.054 . 1 . . . . . 48 ASP N . 50915 2 276 . 1 . 1 49 49 GLY H H 1 7.870 0.012 . 1 . . . . . 49 GLY H . 50915 2 277 . 1 . 1 49 49 GLY HA2 H 1 4.230 0.005 . 1 . . . . . 49 GLY HA2 . 50915 2 278 . 1 . 1 49 49 GLY C C 13 176.130 0.010 . 1 . . . . . 49 GLY C . 50915 2 279 . 1 . 1 49 49 GLY CA C 13 47.040 0.031 . 1 . . . . . 49 GLY CA . 50915 2 280 . 1 . 1 49 49 GLY N N 15 108.930 0.043 . 1 . . . . . 49 GLY N . 50915 2 281 . 1 . 1 50 50 THR H H 1 8.890 0.005 . 1 . . . . . 50 THR H . 50915 2 282 . 1 . 1 50 50 THR HA H 1 4.860 0.005 . 1 . . . . . 50 THR HA . 50915 2 283 . 1 . 1 50 50 THR C C 13 174.150 0.021 . 1 . . . . . 50 THR C . 50915 2 284 . 1 . 1 50 50 THR CA C 13 60.350 0.046 . 1 . . . . . 50 THR CA . 50915 2 285 . 1 . 1 50 50 THR CB C 13 67.280 0.028 . 1 . . . . . 50 THR CB . 50915 2 286 . 1 . 1 50 50 THR N N 15 110.560 0.051 . 1 . . . . . 50 THR N . 50915 2 287 . 1 . 1 51 51 CYS H H 1 8.450 0.005 . 1 . . . . . 51 CYS H . 50915 2 288 . 1 . 1 51 51 CYS HA H 1 5.340 0.005 . 1 . . . . . 51 CYS HA . 50915 2 289 . 1 . 1 51 51 CYS C C 13 172.910 0.018 . 1 . . . . . 51 CYS C . 50915 2 290 . 1 . 1 51 51 CYS CA C 13 57.690 0.033 . 1 . . . . . 51 CYS CA . 50915 2 291 . 1 . 1 51 51 CYS CB C 13 30.820 0.017 . 1 . . . . . 51 CYS CB . 50915 2 292 . 1 . 1 51 51 CYS N N 15 121.380 0.063 . 1 . . . . . 51 CYS N . 50915 2 293 . 1 . 1 52 52 GLY H H 1 9.780 0.019 . 1 . . . . . 52 GLY H . 50915 2 294 . 1 . 1 52 52 GLY HA2 H 1 4.180 0.005 . 2 . . . . . 52 GLY HA2 . 50915 2 295 . 1 . 1 52 52 GLY HA3 H 1 4.240 0.005 . 2 . . . . . 52 GLY HA3 . 50915 2 296 . 1 . 1 52 52 GLY C C 13 169.900 0.004 . 1 . . . . . 52 GLY C . 50915 2 297 . 1 . 1 52 52 GLY CA C 13 43.840 0.024 . 1 . . . . . 52 GLY CA . 50915 2 298 . 1 . 1 52 52 GLY N N 15 113.450 0.053 . 1 . . . . . 52 GLY N . 50915 2 299 . 1 . 1 53 53 LEU H H 1 8.750 0.005 . 1 . . . . . 53 LEU H . 50915 2 300 . 1 . 1 53 53 LEU HA H 1 5.180 0.005 . 1 . . . . . 53 LEU HA . 50915 2 301 . 1 . 1 53 53 LEU C C 13 174.050 0.011 . 1 . . . . . 53 LEU C . 50915 2 302 . 1 . 1 53 53 LEU CA C 13 53.620 0.054 . 1 . . . . . 53 LEU CA . 50915 2 303 . 1 . 1 53 53 LEU CB C 13 47.090 0.028 . 1 . . . . . 53 LEU CB . 50915 2 304 . 1 . 1 53 53 LEU N N 15 120.150 0.047 . 1 . . . . . 53 LEU N . 50915 2 305 . 1 . 1 54 54 VAL H H 1 9.450 0.005 . 1 . . . . . 54 VAL H . 50915 2 306 . 1 . 1 54 54 VAL HA H 1 5.170 0.005 . 1 . . . . . 54 VAL HA . 50915 2 307 . 1 . 1 54 54 VAL C C 13 176.330 0.018 . 1 . . . . . 54 VAL C . 50915 2 308 . 1 . 1 54 54 VAL CA C 13 60.430 0.037 . 1 . . . . . 54 VAL CA . 50915 2 309 . 1 . 1 54 54 VAL CB C 13 33.750 0.021 . 1 . . . . . 54 VAL CB . 50915 2 310 . 1 . 1 54 54 VAL N N 15 125.320 0.033 . 1 . . . . . 54 VAL N . 50915 2 311 . 1 . 1 55 55 GLU H H 1 8.970 0.005 . 1 . . . . . 55 GLU H . 50915 2 312 . 1 . 1 55 55 GLU HA H 1 4.820 0.005 . 1 . . . . . 55 GLU HA . 50915 2 313 . 1 . 1 55 55 GLU C C 13 176.740 0.026 . 1 . . . . . 55 GLU C . 50915 2 314 . 1 . 1 55 55 GLU CA C 13 57.790 0.028 . 1 . . . . . 55 GLU CA . 50915 2 315 . 1 . 1 55 55 GLU CB C 13 29.730 0.008 . 1 . . . . . 55 GLU CB . 50915 2 316 . 1 . 1 55 55 GLU N N 15 126.660 0.032 . 1 . . . . . 55 GLU N . 50915 2 317 . 1 . 1 56 56 VAL H H 1 8.600 0.005 . 1 . . . . . 56 VAL H . 50915 2 318 . 1 . 1 56 56 VAL HA H 1 3.790 0.005 . 1 . . . . . 56 VAL HA . 50915 2 319 . 1 . 1 56 56 VAL C C 13 174.834 0.039 . 1 . . . . . 56 VAL C . 50915 2 320 . 1 . 1 56 56 VAL CA C 13 64.300 0.046 . 1 . . . . . 56 VAL CA . 50915 2 321 . 1 . 1 56 56 VAL N N 15 121.900 0.043 . 1 . . . . . 56 VAL N . 50915 2 322 . 1 . 1 57 57 GLU HA H 1 4.590 0.005 . 1 . . . . . 57 GLU HA . 50915 2 323 . 1 . 1 58 58 LYS H H 1 8.280 0.005 . 1 . . . . . 58 LYS H . 50915 2 324 . 1 . 1 58 58 LYS N N 15 122.390 0.000 . 1 . . . . . 58 LYS N . 50915 2 325 . 1 . 1 59 59 GLY H H 1 8.360 0.005 . 1 . . . . . 59 GLY H . 50915 2 326 . 1 . 1 59 59 GLY HA2 H 1 3.990 0.005 . 1 . . . . . 59 GLY HA2 . 50915 2 327 . 1 . 1 59 59 GLY C C 13 175.450 0.012 . 1 . . . . . 59 GLY C . 50915 2 328 . 1 . 1 59 59 GLY CA C 13 45.610 0.027 . 1 . . . . . 59 GLY CA . 50915 2 329 . 1 . 1 59 59 GLY N N 15 113.430 0.000 . 1 . . . . . 59 GLY N . 50915 2 330 . 1 . 1 60 60 VAL H H 1 7.900 0.005 . 1 . . . . . 60 VAL H . 50915 2 331 . 1 . 1 60 60 VAL HA H 1 3.890 0.005 . 1 . . . . . 60 VAL HA . 50915 2 332 . 1 . 1 60 60 VAL CA C 13 66.450 0.067 . 1 . . . . . 60 VAL CA . 50915 2 333 . 1 . 1 60 60 VAL N N 15 121.870 0.048 . 1 . . . . . 60 VAL N . 50915 2 334 . 1 . 1 61 61 LEU H H 1 8.710 0.005 . 1 . . . . . 61 LEU H . 50915 2 335 . 1 . 1 61 61 LEU N N 15 120.110 0.032 . 1 . . . . . 61 LEU N . 50915 2 336 . 1 . 1 62 62 PRO HA H 1 4.730 0.005 . 1 . . . . . 62 PRO HA . 50915 2 337 . 1 . 1 62 62 PRO C C 13 176.880 0.010 . 1 . . . . . 62 PRO C . 50915 2 338 . 1 . 1 63 63 GLN H H 1 7.680 0.005 . 1 . . . . . 63 GLN H . 50915 2 339 . 1 . 1 63 63 GLN HA H 1 4.370 0.005 . 1 . . . . . 63 GLN HA . 50915 2 340 . 1 . 1 63 63 GLN C C 13 175.320 0.019 . 1 . . . . . 63 GLN C . 50915 2 341 . 1 . 1 63 63 GLN CA C 13 56.300 0.028 . 1 . . . . . 63 GLN CA . 50915 2 342 . 1 . 1 63 63 GLN CB C 13 30.680 0.000 . 1 . . . . . 63 GLN CB . 50915 2 343 . 1 . 1 63 63 GLN N N 15 113.390 0.041 . 1 . . . . . 63 GLN N . 50915 2 344 . 1 . 1 64 64 LEU H H 1 7.960 0.005 . 1 . . . . . 64 LEU H . 50915 2 345 . 1 . 1 64 64 LEU C C 13 174.910 0.002 . 1 . . . . . 64 LEU C . 50915 2 346 . 1 . 1 64 64 LEU CA C 13 53.570 0.034 . 1 . . . . . 64 LEU CA . 50915 2 347 . 1 . 1 64 64 LEU CB C 13 43.630 0.016 . 1 . . . . . 64 LEU CB . 50915 2 348 . 1 . 1 64 64 LEU N N 15 121.770 0.009 . 1 . . . . . 64 LEU N . 50915 2 349 . 1 . 1 65 65 GLU H H 1 7.300 0.005 . 1 . . . . . 65 GLU H . 50915 2 350 . 1 . 1 65 65 GLU HA H 1 4.440 0.005 . 1 . . . . . 65 GLU HA . 50915 2 351 . 1 . 1 65 65 GLU C C 13 174.970 0.011 . 1 . . . . . 65 GLU C . 50915 2 352 . 1 . 1 65 65 GLU CA C 13 55.610 0.043 . 1 . . . . . 65 GLU CA . 50915 2 353 . 1 . 1 65 65 GLU CB C 13 30.860 0.018 . 1 . . . . . 65 GLU CB . 50915 2 354 . 1 . 1 65 65 GLU N N 15 118.060 0.032 . 1 . . . . . 65 GLU N . 50915 2 355 . 1 . 1 66 66 GLN H H 1 8.230 0.006 . 1 . . . . . 66 GLN H . 50915 2 356 . 1 . 1 66 66 GLN HA H 1 4.610 0.005 . 1 . . . . . 66 GLN HA . 50915 2 357 . 1 . 1 66 66 GLN CA C 13 53.710 0.006 . 1 . . . . . 66 GLN CA . 50915 2 358 . 1 . 1 66 66 GLN CB C 13 28.190 0.000 . 1 . . . . . 66 GLN CB . 50915 2 359 . 1 . 1 66 66 GLN N N 15 121.420 0.035 . 1 . . . . . 66 GLN N . 50915 2 360 . 1 . 1 67 67 PRO HA H 1 4.440 0.005 . 1 . . . . . 67 PRO HA . 50915 2 361 . 1 . 1 67 67 PRO C C 13 174.720 0.010 . 1 . . . . . 67 PRO C . 50915 2 362 . 1 . 1 67 67 PRO CA C 13 61.620 0.032 . 1 . . . . . 67 PRO CA . 50915 2 363 . 1 . 1 67 67 PRO CB C 13 35.320 0.000 . 1 . . . . . 67 PRO CB . 50915 2 364 . 1 . 1 68 68 TYR H H 1 8.050 0.005 . 1 . . . . . 68 TYR H . 50915 2 365 . 1 . 1 68 68 TYR HA H 1 4.650 0.005 . 1 . . . . . 68 TYR HA . 50915 2 366 . 1 . 1 68 68 TYR CA C 13 56.080 0.069 . 1 . . . . . 68 TYR CA . 50915 2 367 . 1 . 1 68 68 TYR CB C 13 41.420 0.014 . 1 . . . . . 68 TYR CB . 50915 2 368 . 1 . 1 68 68 TYR N N 15 119.640 0.051 . 1 . . . . . 68 TYR N . 50915 2 369 . 1 . 1 69 69 VAL H H 1 9.060 0.005 . 1 . . . . . 69 VAL H . 50915 2 370 . 1 . 1 69 69 VAL HA H 1 4.580 0.005 . 1 . . . . . 69 VAL HA . 50915 2 371 . 1 . 1 69 69 VAL C C 13 174.290 0.020 . 1 . . . . . 69 VAL C . 50915 2 372 . 1 . 1 69 69 VAL CA C 13 62.060 0.044 . 1 . . . . . 69 VAL CA . 50915 2 373 . 1 . 1 69 69 VAL CB C 13 32.760 0.032 . 1 . . . . . 69 VAL CB . 50915 2 374 . 1 . 1 69 69 VAL N N 15 120.580 0.042 . 1 . . . . . 69 VAL N . 50915 2 375 . 1 . 1 70 70 PHE H H 1 9.270 0.005 . 1 . . . . . 70 PHE H . 50915 2 376 . 1 . 1 70 70 PHE HA H 1 4.340 0.005 . 1 . . . . . 70 PHE HA . 50915 2 377 . 1 . 1 70 70 PHE C C 13 176.280 0.010 . 1 . . . . . 70 PHE C . 50915 2 378 . 1 . 1 70 70 PHE CA C 13 56.420 0.062 . 1 . . . . . 70 PHE CA . 50915 2 379 . 1 . 1 70 70 PHE CB C 13 41.750 0.051 . 1 . . . . . 70 PHE CB . 50915 2 380 . 1 . 1 70 70 PHE N N 15 123.280 0.053 . 1 . . . . . 70 PHE N . 50915 2 381 . 1 . 1 71 71 ILE H H 1 8.030 0.005 . 1 . . . . . 71 ILE H . 50915 2 382 . 1 . 1 71 71 ILE HA H 1 5.160 0.005 . 1 . . . . . 71 ILE HA . 50915 2 383 . 1 . 1 71 71 ILE C C 13 174.810 0.007 . 1 . . . . . 71 ILE C . 50915 2 384 . 1 . 1 71 71 ILE CA C 13 58.890 0.066 . 1 . . . . . 71 ILE CA . 50915 2 385 . 1 . 1 71 71 ILE N N 15 112.840 0.043 . 1 . . . . . 71 ILE N . 50915 2 386 . 1 . 1 72 72 LYS H H 1 8.950 0.005 . 1 . . . . . 72 LYS H . 50915 2 387 . 1 . 1 72 72 LYS HA H 1 5.170 0.005 . 1 . . . . . 72 LYS HA . 50915 2 388 . 1 . 1 72 72 LYS C C 13 175.160 0.020 . 1 . . . . . 72 LYS C . 50915 2 389 . 1 . 1 72 72 LYS CA C 13 53.980 0.033 . 1 . . . . . 72 LYS CA . 50915 2 390 . 1 . 1 72 72 LYS CB C 13 36.360 0.014 . 1 . . . . . 72 LYS CB . 50915 2 391 . 1 . 1 72 72 LYS N N 15 125.380 0.059 . 1 . . . . . 72 LYS N . 50915 2 392 . 1 . 1 73 73 ARG H H 1 8.960 0.005 . 1 . . . . . 73 ARG H . 50915 2 393 . 1 . 1 73 73 ARG HA H 1 4.340 0.005 . 1 . . . . . 73 ARG HA . 50915 2 394 . 1 . 1 73 73 ARG C C 13 176.520 0.038 . 1 . . . . . 73 ARG C . 50915 2 395 . 1 . 1 73 73 ARG CA C 13 57.500 0.065 . 1 . . . . . 73 ARG CA . 50915 2 396 . 1 . 1 73 73 ARG CB C 13 31.000 0.013 . 1 . . . . . 73 ARG CB . 50915 2 397 . 1 . 1 73 73 ARG N N 15 123.080 0.046 . 1 . . . . . 73 ARG N . 50915 2 398 . 1 . 1 74 74 SER H H 1 8.740 0.005 . 1 . . . . . 74 SER H . 50915 2 399 . 1 . 1 74 74 SER HA H 1 4.540 0.005 . 1 . . . . . 74 SER HA . 50915 2 400 . 1 . 1 74 74 SER C C 13 173.940 0.010 . 1 . . . . . 74 SER C . 50915 2 401 . 1 . 1 74 74 SER CA C 13 58.660 0.042 . 1 . . . . . 74 SER CA . 50915 2 402 . 1 . 1 74 74 SER CB C 13 64.430 0.000 . 1 . . . . . 74 SER CB . 50915 2 403 . 1 . 1 74 74 SER N N 15 120.880 0.040 . 1 . . . . . 74 SER N . 50915 2 404 . 1 . 1 75 75 ASP H H 1 8.270 0.005 . 1 . . . . . 75 ASP H . 50915 2 405 . 1 . 1 75 75 ASP C C 13 175.630 0.000 . 1 . . . . . 75 ASP C . 50915 2 406 . 1 . 1 75 75 ASP CA C 13 54.310 0.023 . 1 . . . . . 75 ASP CA . 50915 2 407 . 1 . 1 75 75 ASP CB C 13 41.420 0.015 . 1 . . . . . 75 ASP CB . 50915 2 408 . 1 . 1 75 75 ASP N N 15 122.320 0.000 . 1 . . . . . 75 ASP N . 50915 2 409 . 1 . 1 76 76 ALA H H 1 8.360 0.005 . 1 . . . . . 76 ALA H . 50915 2 410 . 1 . 1 76 76 ALA C C 13 177.870 0.000 . 1 . . . . . 76 ALA C . 50915 2 411 . 1 . 1 76 76 ALA CA C 13 52.920 0.012 . 1 . . . . . 76 ALA CA . 50915 2 412 . 1 . 1 76 76 ALA CB C 13 18.310 0.000 . 1 . . . . . 76 ALA CB . 50915 2 413 . 1 . 1 76 76 ALA N N 15 124.820 0.000 . 1 . . . . . 76 ALA N . 50915 2 414 . 1 . 1 77 77 ARG H H 1 8.340 0.005 . 1 . . . . . 77 ARG H . 50915 2 415 . 1 . 1 77 77 ARG C C 13 176.590 0.000 . 1 . . . . . 77 ARG C . 50915 2 416 . 1 . 1 77 77 ARG CA C 13 56.700 0.000 . 1 . . . . . 77 ARG CA . 50915 2 417 . 1 . 1 77 77 ARG N N 15 118.800 0.000 . 1 . . . . . 77 ARG N . 50915 2 418 . 1 . 1 78 78 THR H H 1 8.040 0.005 . 1 . . . . . 78 THR H . 50915 2 419 . 1 . 1 78 78 THR HA H 1 4.370 0.005 . 1 . . . . . 78 THR HA . 50915 2 420 . 1 . 1 78 78 THR C C 13 173.660 0.010 . 1 . . . . . 78 THR C . 50915 2 421 . 1 . 1 78 78 THR CA C 13 61.860 0.015 . 1 . . . . . 78 THR CA . 50915 2 422 . 1 . 1 78 78 THR CB C 13 69.750 0.000 . 1 . . . . . 78 THR CB . 50915 2 423 . 1 . 1 78 78 THR N N 15 114.050 0.010 . 1 . . . . . 78 THR N . 50915 2 424 . 1 . 1 79 79 ALA H H 1 8.270 0.005 . 1 . . . . . 79 ALA H . 50915 2 425 . 1 . 1 79 79 ALA HA H 1 4.374 0.005 . 1 . . . . . 79 ALA HA . 50915 2 426 . 1 . 1 79 79 ALA C C 13 175.460 0.004 . 1 . . . . . 79 ALA C . 50915 2 427 . 1 . 1 79 79 ALA CA C 13 50.650 0.077 . 1 . . . . . 79 ALA CA . 50915 2 428 . 1 . 1 79 79 ALA CB C 13 18.340 0.023 . 1 . . . . . 79 ALA CB . 50915 2 429 . 1 . 1 79 79 ALA N N 15 127.800 0.044 . 1 . . . . . 79 ALA N . 50915 2 430 . 1 . 1 82 82 GLY H H 1 8.270 0.005 . 1 . . . . . 82 GLY H . 50915 2 431 . 1 . 1 82 82 GLY C C 13 173.780 0.020 . 1 . . . . . 82 GLY C . 50915 2 432 . 1 . 1 82 82 GLY CA C 13 45.530 0.020 . 1 . . . . . 82 GLY CA . 50915 2 433 . 1 . 1 82 82 GLY N N 15 108.830 0.010 . 1 . . . . . 82 GLY N . 50915 2 434 . 1 . 1 83 83 HIS H H 1 8.140 0.005 . 1 . . . . . 83 HIS H . 50915 2 435 . 1 . 1 83 83 HIS C C 13 174.430 0.035 . 1 . . . . . 83 HIS C . 50915 2 436 . 1 . 1 83 83 HIS CA C 13 56.080 0.053 . 1 . . . . . 83 HIS CA . 50915 2 437 . 1 . 1 83 83 HIS N N 15 119.550 0.023 . 1 . . . . . 83 HIS N . 50915 2 438 . 1 . 1 84 84 VAL H H 1 8.090 0.005 . 1 . . . . . 84 VAL H . 50915 2 439 . 1 . 1 84 84 VAL HA H 1 4.220 0.005 . 1 . . . . . 84 VAL HA . 50915 2 440 . 1 . 1 84 84 VAL C C 13 174.980 0.009 . 1 . . . . . 84 VAL C . 50915 2 441 . 1 . 1 84 84 VAL CA C 13 61.840 0.056 . 1 . . . . . 84 VAL CA . 50915 2 442 . 1 . 1 84 84 VAL CB C 13 33.590 0.027 . 1 . . . . . 84 VAL CB . 50915 2 443 . 1 . 1 84 84 VAL N N 15 121.690 0.006 . 1 . . . . . 84 VAL N . 50915 2 444 . 1 . 1 85 85 MET H H 1 8.760 0.005 . 1 . . . . . 85 MET H . 50915 2 445 . 1 . 1 85 85 MET HA H 1 5.200 0.005 . 1 . . . . . 85 MET HA . 50915 2 446 . 1 . 1 85 85 MET C C 13 176.590 0.013 . 1 . . . . . 85 MET C . 50915 2 447 . 1 . 1 85 85 MET CA C 13 55.900 0.061 . 1 . . . . . 85 MET CA . 50915 2 448 . 1 . 1 85 85 MET CB C 13 33.340 0.008 . 1 . . . . . 85 MET CB . 50915 2 449 . 1 . 1 85 85 MET N N 15 127.930 0.043 . 1 . . . . . 85 MET N . 50915 2 450 . 1 . 1 86 86 VAL H H 1 8.810 0.005 . 1 . . . . . 86 VAL H . 50915 2 451 . 1 . 1 86 86 VAL HA H 1 5.630 0.005 . 1 . . . . . 86 VAL HA . 50915 2 452 . 1 . 1 86 86 VAL C C 13 174.140 0.038 . 1 . . . . . 86 VAL C . 50915 2 453 . 1 . 1 86 86 VAL CA C 13 58.700 0.028 . 1 . . . . . 86 VAL CA . 50915 2 454 . 1 . 1 86 86 VAL CB C 13 37.010 0.022 . 1 . . . . . 86 VAL CB . 50915 2 455 . 1 . 1 86 86 VAL N N 15 117.300 0.043 . 1 . . . . . 86 VAL N . 50915 2 456 . 1 . 1 87 87 GLU H H 1 8.930 0.005 . 1 . . . . . 87 GLU H . 50915 2 457 . 1 . 1 87 87 GLU HA H 1 4.670 0.005 . 1 . . . . . 87 GLU HA . 50915 2 458 . 1 . 1 87 87 GLU C C 13 174.190 0.007 . 1 . . . . . 87 GLU C . 50915 2 459 . 1 . 1 87 87 GLU CA C 13 54.180 0.047 . 1 . . . . . 87 GLU CA . 50915 2 460 . 1 . 1 87 87 GLU CB C 13 34.080 0.014 . 1 . . . . . 87 GLU CB . 50915 2 461 . 1 . 1 87 87 GLU N N 15 117.030 0.048 . 1 . . . . . 87 GLU N . 50915 2 462 . 1 . 1 88 88 LEU H H 1 8.530 0.005 . 1 . . . . . 88 LEU H . 50915 2 463 . 1 . 1 88 88 LEU HA H 1 5.140 0.005 . 1 . . . . . 88 LEU HA . 50915 2 464 . 1 . 1 88 88 LEU C C 13 177.090 0.023 . 1 . . . . . 88 LEU C . 50915 2 465 . 1 . 1 88 88 LEU CA C 13 54.770 0.045 . 1 . . . . . 88 LEU CA . 50915 2 466 . 1 . 1 88 88 LEU CB C 13 43.590 0.023 . 1 . . . . . 88 LEU CB . 50915 2 467 . 1 . 1 88 88 LEU N N 15 121.670 0.048 . 1 . . . . . 88 LEU N . 50915 2 468 . 1 . 1 89 89 VAL H H 1 8.740 0.005 . 1 . . . . . 89 VAL H . 50915 2 469 . 1 . 1 89 89 VAL HA H 1 4.570 0.005 . 1 . . . . . 89 VAL HA . 50915 2 470 . 1 . 1 89 89 VAL C C 13 173.300 0.017 . 1 . . . . . 89 VAL C . 50915 2 471 . 1 . 1 89 89 VAL CA C 13 60.840 0.043 . 1 . . . . . 89 VAL CA . 50915 2 472 . 1 . 1 89 89 VAL CB C 13 36.460 0.037 . 1 . . . . . 89 VAL CB . 50915 2 473 . 1 . 1 89 89 VAL N N 15 120.160 0.051 . 1 . . . . . 89 VAL N . 50915 2 474 . 1 . 1 90 90 ALA H H 1 8.680 0.005 . 1 . . . . . 90 ALA H . 50915 2 475 . 1 . 1 90 90 ALA HA H 1 5.870 0.005 . 1 . . . . . 90 ALA HA . 50915 2 476 . 1 . 1 90 90 ALA C C 13 176.600 0.014 . 1 . . . . . 90 ALA C . 50915 2 477 . 1 . 1 90 90 ALA CA C 13 50.580 0.054 . 1 . . . . . 90 ALA CA . 50915 2 478 . 1 . 1 90 90 ALA CB C 13 22.750 0.043 . 1 . . . . . 90 ALA CB . 50915 2 479 . 1 . 1 90 90 ALA N N 15 126.040 0.047 . 1 . . . . . 90 ALA N . 50915 2 480 . 1 . 1 91 91 GLU H H 1 8.850 0.005 . 1 . . . . . 91 GLU H . 50915 2 481 . 1 . 1 91 91 GLU HA H 1 4.960 0.005 . 1 . . . . . 91 GLU HA . 50915 2 482 . 1 . 1 91 91 GLU C C 13 174.900 0.032 . 1 . . . . . 91 GLU C . 50915 2 483 . 1 . 1 91 91 GLU CA C 13 55.600 0.047 . 1 . . . . . 91 GLU CA . 50915 2 484 . 1 . 1 91 91 GLU CB C 13 34.960 0.038 . 1 . . . . . 91 GLU CB . 50915 2 485 . 1 . 1 91 91 GLU N N 15 118.540 0.041 . 1 . . . . . 91 GLU N . 50915 2 486 . 1 . 1 92 92 LEU H H 1 8.820 0.005 . 1 . . . . . 92 LEU H . 50915 2 487 . 1 . 1 92 92 LEU HA H 1 4.320 0.005 . 1 . . . . . 92 LEU HA . 50915 2 488 . 1 . 1 92 92 LEU CA C 13 57.070 0.028 . 1 . . . . . 92 LEU CA . 50915 2 489 . 1 . 1 92 92 LEU CB C 13 45.200 0.000 . 1 . . . . . 92 LEU CB . 50915 2 490 . 1 . 1 92 92 LEU N N 15 123.880 0.020 . 1 . . . . . 92 LEU N . 50915 2 491 . 1 . 1 93 93 GLU HA H 1 4.510 0.005 . 1 . . . . . 93 GLU HA . 50915 2 492 . 1 . 1 93 93 GLU C C 13 177.320 0.024 . 1 . . . . . 93 GLU C . 50915 2 493 . 1 . 1 93 93 GLU CA C 13 57.370 0.029 . 1 . . . . . 93 GLU CA . 50915 2 494 . 1 . 1 94 94 GLY H H 1 8.220 0.005 . 1 . . . . . 94 GLY H . 50915 2 495 . 1 . 1 94 94 GLY HA2 H 1 4.060 0.005 . 1 . . . . . 94 GLY HA2 . 50915 2 496 . 1 . 1 94 94 GLY C C 13 173.990 0.009 . 1 . . . . . 94 GLY C . 50915 2 497 . 1 . 1 94 94 GLY CA C 13 46.270 0.032 . 1 . . . . . 94 GLY CA . 50915 2 498 . 1 . 1 94 94 GLY N N 15 106.320 0.000 . 1 . . . . . 94 GLY N . 50915 2 499 . 1 . 1 95 95 ILE H H 1 7.580 0.005 . 1 . . . . . 95 ILE H . 50915 2 500 . 1 . 1 95 95 ILE HA H 1 3.980 0.005 . 1 . . . . . 95 ILE HA . 50915 2 501 . 1 . 1 95 95 ILE CA C 13 62.080 0.085 . 1 . . . . . 95 ILE CA . 50915 2 502 . 1 . 1 95 95 ILE CB C 13 38.650 0.000 . 1 . . . . . 95 ILE CB . 50915 2 503 . 1 . 1 95 95 ILE N N 15 119.740 0.053 . 1 . . . . . 95 ILE N . 50915 2 504 . 1 . 1 96 96 GLN C C 13 176.930 0.000 . 1 . . . . . 96 GLN C . 50915 2 505 . 1 . 1 96 96 GLN CA C 13 56.730 0.000 . 1 . . . . . 96 GLN CA . 50915 2 506 . 1 . 1 97 97 TYR H H 1 8.890 0.005 . 1 . . . . . 97 TYR H . 50915 2 507 . 1 . 1 97 97 TYR C C 13 176.690 0.000 . 1 . . . . . 97 TYR C . 50915 2 508 . 1 . 1 97 97 TYR CA C 13 58.660 0.000 . 1 . . . . . 97 TYR CA . 50915 2 509 . 1 . 1 97 97 TYR N N 15 120.600 0.000 . 1 . . . . . 97 TYR N . 50915 2 510 . 1 . 1 98 98 GLY H H 1 7.940 0.005 . 1 . . . . . 98 GLY H . 50915 2 511 . 1 . 1 98 98 GLY CA C 13 46.110 0.000 . 1 . . . . . 98 GLY CA . 50915 2 512 . 1 . 1 98 98 GLY N N 15 109.020 0.000 . 1 . . . . . 98 GLY N . 50915 2 513 . 1 . 1 99 99 ARG H H 1 7.810 0.005 . 1 . . . . . 99 ARG H . 50915 2 514 . 1 . 1 99 99 ARG CA C 13 55.800 0.000 . 1 . . . . . 99 ARG CA . 50915 2 515 . 1 . 1 99 99 ARG N N 15 118.560 0.000 . 1 . . . . . 99 ARG N . 50915 2 516 . 1 . 1 101 101 GLY H H 1 8.690 0.000 . 1 . . . . . 101 GLY H . 50915 2 517 . 1 . 1 101 101 GLY HA2 H 1 4.370 0.005 . 2 . . . . . 101 GLY HA2 . 50915 2 518 . 1 . 1 101 101 GLY HA3 H 1 4.160 0.005 . 2 . . . . . 101 GLY HA3 . 50915 2 519 . 1 . 1 101 101 GLY C C 13 174.010 0.010 . 1 . . . . . 101 GLY C . 50915 2 520 . 1 . 1 101 101 GLY CA C 13 45.820 0.035 . 1 . . . . . 101 GLY CA . 50915 2 521 . 1 . 1 101 101 GLY N N 15 112.900 0.010 . 1 . . . . . 101 GLY N . 50915 2 522 . 1 . 1 102 102 GLU H H 1 8.340 0.005 . 1 . . . . . 102 GLU H . 50915 2 523 . 1 . 1 102 102 GLU HA H 1 4.730 0.005 . 1 . . . . . 102 GLU HA . 50915 2 524 . 1 . 1 102 102 GLU CB C 13 30.640 0.010 . 1 . . . . . 102 GLU CB . 50915 2 525 . 1 . 1 102 102 GLU N N 15 119.150 0.039 . 1 . . . . . 102 GLU N . 50915 2 526 . 1 . 1 103 103 THR H H 1 8.290 0.005 . 1 . . . . . 103 THR H . 50915 2 527 . 1 . 1 103 103 THR HA H 1 4.370 0.005 . 1 . . . . . 103 THR HA . 50915 2 528 . 1 . 1 103 103 THR C C 13 174.220 0.032 . 1 . . . . . 103 THR C . 50915 2 529 . 1 . 1 103 103 THR CA C 13 63.280 0.029 . 1 . . . . . 103 THR CA . 50915 2 530 . 1 . 1 103 103 THR CB C 13 74.290 0.000 . 1 . . . . . 103 THR CB . 50915 2 531 . 1 . 1 103 103 THR N N 15 117.690 0.010 . 1 . . . . . 103 THR N . 50915 2 532 . 1 . 1 104 104 LEU H H 1 9.010 0.005 . 1 . . . . . 104 LEU H . 50915 2 533 . 1 . 1 104 104 LEU HA H 1 5.170 0.005 . 1 . . . . . 104 LEU HA . 50915 2 534 . 1 . 1 104 104 LEU C C 13 177.090 0.026 . 1 . . . . . 104 LEU C . 50915 2 535 . 1 . 1 104 104 LEU CA C 13 56.300 0.033 . 1 . . . . . 104 LEU CA . 50915 2 536 . 1 . 1 104 104 LEU CB C 13 43.480 0.027 . 1 . . . . . 104 LEU CB . 50915 2 537 . 1 . 1 104 104 LEU N N 15 126.750 0.034 . 1 . . . . . 104 LEU N . 50915 2 538 . 1 . 1 105 105 GLY H H 1 7.430 0.005 . 1 . . . . . 105 GLY H . 50915 2 539 . 1 . 1 105 105 GLY HA2 H 1 4.190 0.005 . 2 . . . . . 105 GLY HA2 . 50915 2 540 . 1 . 1 105 105 GLY HA3 H 1 4.350 0.005 . 2 . . . . . 105 GLY HA3 . 50915 2 541 . 1 . 1 105 105 GLY C C 13 169.980 0.021 . 1 . . . . . 105 GLY C . 50915 2 542 . 1 . 1 105 105 GLY CA C 13 45.600 0.043 . 1 . . . . . 105 GLY CA . 50915 2 543 . 1 . 1 105 105 GLY N N 15 103.980 0.056 . 1 . . . . . 105 GLY N . 50915 2 544 . 1 . 1 106 106 VAL H H 1 9.150 0.005 . 1 . . . . . 106 VAL H . 50915 2 545 . 1 . 1 106 106 VAL HA H 1 4.570 0.005 . 1 . . . . . 106 VAL HA . 50915 2 546 . 1 . 1 106 106 VAL C C 13 174.550 0.012 . 1 . . . . . 106 VAL C . 50915 2 547 . 1 . 1 106 106 VAL CA C 13 60.090 0.088 . 1 . . . . . 106 VAL CA . 50915 2 548 . 1 . 1 106 106 VAL CB C 13 34.990 0.075 . 1 . . . . . 106 VAL CB . 50915 2 549 . 1 . 1 106 106 VAL N N 15 121.070 0.039 . 1 . . . . . 106 VAL N . 50915 2 550 . 1 . 1 107 107 LEU H H 1 8.990 0.005 . 1 . . . . . 107 LEU H . 50915 2 551 . 1 . 1 107 107 LEU HA H 1 5.360 0.005 . 1 . . . . . 107 LEU HA . 50915 2 552 . 1 . 1 107 107 LEU C C 13 174.850 0.012 . 1 . . . . . 107 LEU C . 50915 2 553 . 1 . 1 107 107 LEU CA C 13 53.650 0.030 . 1 . . . . . 107 LEU CA . 50915 2 554 . 1 . 1 107 107 LEU CB C 13 43.560 0.037 . 1 . . . . . 107 LEU CB . 50915 2 555 . 1 . 1 107 107 LEU N N 15 126.570 0.016 . 1 . . . . . 107 LEU N . 50915 2 556 . 1 . 1 108 108 VAL H H 1 8.330 0.005 . 1 . . . . . 108 VAL H . 50915 2 557 . 1 . 1 108 108 VAL HA H 1 4.469 0.005 . 1 . . . . . 108 VAL HA . 50915 2 558 . 1 . 1 108 108 VAL CA C 13 58.250 0.054 . 1 . . . . . 108 VAL CA . 50915 2 559 . 1 . 1 108 108 VAL CB C 13 33.370 0.000 . 1 . . . . . 108 VAL CB . 50915 2 560 . 1 . 1 108 108 VAL N N 15 113.380 0.047 . 1 . . . . . 108 VAL N . 50915 2 561 . 1 . 1 109 109 PRO HA H 1 4.770 0.005 . 1 . . . . . 109 PRO HA . 50915 2 562 . 1 . 1 109 109 PRO C C 13 173.300 0.005 . 1 . . . . . 109 PRO C . 50915 2 563 . 1 . 1 109 109 PRO CA C 13 63.710 0.025 . 1 . . . . . 109 PRO CA . 50915 2 564 . 1 . 1 109 109 PRO CB C 13 33.080 0.000 . 1 . . . . . 109 PRO CB . 50915 2 565 . 1 . 1 110 110 HIS H H 1 8.050 0.005 . 1 . . . . . 110 HIS H . 50915 2 566 . 1 . 1 110 110 HIS HA H 1 5.160 0.005 . 1 . . . . . 110 HIS HA . 50915 2 567 . 1 . 1 110 110 HIS C C 13 175.680 0.000 . 1 . . . . . 110 HIS C . 50915 2 568 . 1 . 1 110 110 HIS CA C 13 53.360 0.009 . 1 . . . . . 110 HIS CA . 50915 2 569 . 1 . 1 110 110 HIS N N 15 120.870 0.049 . 1 . . . . . 110 HIS N . 50915 2 570 . 1 . 1 111 111 VAL H H 1 10.350 0.008 . 1 . . . . . 111 VAL H . 50915 2 571 . 1 . 1 111 111 VAL HA H 1 4.410 0.005 . 1 . . . . . 111 VAL HA . 50915 2 572 . 1 . 1 111 111 VAL C C 13 175.450 0.022 . 1 . . . . . 111 VAL C . 50915 2 573 . 1 . 1 111 111 VAL CA C 13 60.700 0.067 . 1 . . . . . 111 VAL CA . 50915 2 574 . 1 . 1 111 111 VAL N N 15 130.310 0.000 . 1 . . . . . 111 VAL N . 50915 2 575 . 1 . 1 112 112 GLY H H 1 6.620 0.005 . 1 . . . . . 112 GLY H . 50915 2 576 . 1 . 1 112 112 GLY HA2 H 1 3.940 0.005 . 1 . . . . . 112 GLY HA2 . 50915 2 577 . 1 . 1 112 112 GLY C C 13 174.800 0.010 . 1 . . . . . 112 GLY C . 50915 2 578 . 1 . 1 112 112 GLY CA C 13 45.270 0.024 . 1 . . . . . 112 GLY CA . 50915 2 579 . 1 . 1 112 112 GLY N N 15 107.360 0.038 . 1 . . . . . 112 GLY N . 50915 2 580 . 1 . 1 113 113 GLU H H 1 10.610 0.005 . 1 . . . . . 113 GLU H . 50915 2 581 . 1 . 1 113 113 GLU C C 13 177.120 0.011 . 1 . . . . . 113 GLU C . 50915 2 582 . 1 . 1 113 113 GLU CA C 13 59.110 0.023 . 1 . . . . . 113 GLU CA . 50915 2 583 . 1 . 1 113 113 GLU CB C 13 29.840 0.000 . 1 . . . . . 113 GLU CB . 50915 2 584 . 1 . 1 113 113 GLU N N 15 124.600 0.000 . 1 . . . . . 113 GLU N . 50915 2 585 . 1 . 1 114 114 ILE H H 1 9.020 0.005 . 1 . . . . . 114 ILE H . 50915 2 586 . 1 . 1 114 114 ILE CA C 13 58.600 0.000 . 1 . . . . . 114 ILE CA . 50915 2 587 . 1 . 1 114 114 ILE CB C 13 37.120 0.000 . 1 . . . . . 114 ILE CB . 50915 2 588 . 1 . 1 114 114 ILE N N 15 125.740 0.042 . 1 . . . . . 114 ILE N . 50915 2 589 . 1 . 1 115 115 PRO HA H 1 4.640 0.005 . 1 . . . . . 115 PRO HA . 50915 2 590 . 1 . 1 115 115 PRO C C 13 177.350 0.010 . 1 . . . . . 115 PRO C . 50915 2 591 . 1 . 1 115 115 PRO CA C 13 62.440 0.042 . 1 . . . . . 115 PRO CA . 50915 2 592 . 1 . 1 115 115 PRO CB C 13 33.510 0.000 . 1 . . . . . 115 PRO CB . 50915 2 593 . 1 . 1 116 116 VAL H H 1 8.840 0.005 . 1 . . . . . 116 VAL H . 50915 2 594 . 1 . 1 116 116 VAL HA H 1 4.370 0.005 . 1 . . . . . 116 VAL HA . 50915 2 595 . 1 . 1 116 116 VAL C C 13 175.650 0.012 . 1 . . . . . 116 VAL C . 50915 2 596 . 1 . 1 116 116 VAL CA C 13 61.480 0.056 . 1 . . . . . 116 VAL CA . 50915 2 597 . 1 . 1 116 116 VAL CB C 13 32.940 0.002 . 1 . . . . . 116 VAL CB . 50915 2 598 . 1 . 1 116 116 VAL N N 15 114.300 0.035 . 1 . . . . . 116 VAL N . 50915 2 599 . 1 . 1 117 117 ALA H H 1 7.710 0.005 . 1 . . . . . 117 ALA H . 50915 2 600 . 1 . 1 117 117 ALA HA H 1 4.460 0.005 . 1 . . . . . 117 ALA HA . 50915 2 601 . 1 . 1 117 117 ALA C C 13 173.920 0.053 . 1 . . . . . 117 ALA C . 50915 2 602 . 1 . 1 117 117 ALA CA C 13 51.320 0.068 . 1 . . . . . 117 ALA CA . 50915 2 603 . 1 . 1 117 117 ALA CB C 13 20.880 0.017 . 1 . . . . . 117 ALA CB . 50915 2 604 . 1 . 1 117 117 ALA N N 15 120.650 0.043 . 1 . . . . . 117 ALA N . 50915 2 605 . 1 . 1 118 118 TYR H H 1 8.440 0.005 . 1 . . . . . 118 TYR H . 50915 2 606 . 1 . 1 118 118 TYR HA H 1 5.310 0.005 . 1 . . . . . 118 TYR HA . 50915 2 607 . 1 . 1 118 118 TYR C C 13 175.760 0.032 . 1 . . . . . 118 TYR C . 50915 2 608 . 1 . 1 118 118 TYR CA C 13 57.900 0.054 . 1 . . . . . 118 TYR CA . 50915 2 609 . 1 . 1 118 118 TYR CB C 13 42.440 0.067 . 1 . . . . . 118 TYR CB . 50915 2 610 . 1 . 1 118 118 TYR N N 15 115.990 0.047 . 1 . . . . . 118 TYR N . 50915 2 611 . 1 . 1 119 119 ARG H H 1 9.370 0.005 . 1 . . . . . 119 ARG H . 50915 2 612 . 1 . 1 119 119 ARG HA H 1 4.780 0.005 . 1 . . . . . 119 ARG HA . 50915 2 613 . 1 . 1 119 119 ARG C C 13 174.700 0.055 . 1 . . . . . 119 ARG C . 50915 2 614 . 1 . 1 119 119 ARG CA C 13 53.360 0.048 . 1 . . . . . 119 ARG CA . 50915 2 615 . 1 . 1 119 119 ARG CB C 13 32.010 0.004 . 1 . . . . . 119 ARG CB . 50915 2 616 . 1 . 1 119 119 ARG N N 15 122.340 0.043 . 1 . . . . . 119 ARG N . 50915 2 617 . 1 . 1 120 120 LYS H H 1 8.590 0.005 . 1 . . . . . 120 LYS H . 50915 2 618 . 1 . 1 120 120 LYS HA H 1 5.140 0.005 . 1 . . . . . 120 LYS HA . 50915 2 619 . 1 . 1 120 120 LYS C C 13 176.800 0.016 . 1 . . . . . 120 LYS C . 50915 2 620 . 1 . 1 120 120 LYS CA C 13 56.280 0.033 . 1 . . . . . 120 LYS CA . 50915 2 621 . 1 . 1 120 120 LYS CB C 13 35.330 0.000 . 1 . . . . . 120 LYS CB . 50915 2 622 . 1 . 1 120 120 LYS N N 15 126.580 0.042 . 1 . . . . . 120 LYS N . 50915 2 623 . 1 . 1 121 121 VAL H H 1 8.950 0.005 . 1 . . . . . 121 VAL H . 50915 2 624 . 1 . 1 121 121 VAL HA H 1 5.260 0.005 . 1 . . . . . 121 VAL HA . 50915 2 625 . 1 . 1 121 121 VAL C C 13 173.420 0.000 . 1 . . . . . 121 VAL C . 50915 2 626 . 1 . 1 121 121 VAL CA C 13 58.930 0.024 . 1 . . . . . 121 VAL CA . 50915 2 627 . 1 . 1 121 121 VAL CB C 13 35.990 0.000 . 1 . . . . . 121 VAL CB . 50915 2 628 . 1 . 1 121 121 VAL N N 15 117.040 0.000 . 1 . . . . . 121 VAL N . 50915 2 629 . 1 . 1 122 122 LEU H H 1 8.740 0.005 . 1 . . . . . 122 LEU H . 50915 2 630 . 1 . 1 122 122 LEU HA H 1 5.190 0.005 . 1 . . . . . 122 LEU HA . 50915 2 631 . 1 . 1 122 122 LEU C C 13 174.810 0.010 . 1 . . . . . 122 LEU C . 50915 2 632 . 1 . 1 122 122 LEU CA C 13 53.360 0.095 . 1 . . . . . 122 LEU CA . 50915 2 633 . 1 . 1 122 122 LEU CB C 13 44.470 0.011 . 1 . . . . . 122 LEU CB . 50915 2 634 . 1 . 1 122 122 LEU N N 15 123.130 0.046 . 1 . . . . . 122 LEU N . 50915 2 635 . 1 . 1 123 123 LEU H H 1 8.880 0.005 . 1 . . . . . 123 LEU H . 50915 2 636 . 1 . 1 123 123 LEU HA H 1 4.840 0.005 . 1 . . . . . 123 LEU HA . 50915 2 637 . 1 . 1 123 123 LEU C C 13 175.980 0.012 . 1 . . . . . 123 LEU C . 50915 2 638 . 1 . 1 123 123 LEU CA C 13 53.800 0.029 . 1 . . . . . 123 LEU CA . 50915 2 639 . 1 . 1 123 123 LEU CB C 13 45.470 0.076 . 1 . . . . . 123 LEU CB . 50915 2 640 . 1 . 1 123 123 LEU N N 15 125.070 0.054 . 1 . . . . . 123 LEU N . 50915 2 641 . 1 . 1 124 124 ARG H H 1 8.750 0.005 . 1 . . . . . 124 ARG H . 50915 2 642 . 1 . 1 124 124 ARG HA H 1 4.160 0.005 . 1 . . . . . 124 ARG HA . 50915 2 643 . 1 . 1 124 124 ARG C C 13 176.440 0.009 . 1 . . . . . 124 ARG C . 50915 2 644 . 1 . 1 124 124 ARG CA C 13 57.060 0.026 . 1 . . . . . 124 ARG CA . 50915 2 645 . 1 . 1 124 124 ARG CB C 13 30.820 0.011 . 1 . . . . . 124 ARG CB . 50915 2 646 . 1 . 1 124 124 ARG N N 15 126.250 0.103 . 1 . . . . . 124 ARG N . 50915 2 647 . 1 . 1 125 125 LYS H H 1 8.420 0.005 . 1 . . . . . 125 LYS H . 50915 2 648 . 1 . 1 125 125 LYS HA H 1 4.666 0.005 . 1 . . . . . 125 LYS HA . 50915 2 649 . 1 . 1 125 125 LYS C C 13 175.230 0.016 . 1 . . . . . 125 LYS C . 50915 2 650 . 1 . 1 125 125 LYS CA C 13 57.940 0.033 . 1 . . . . . 125 LYS CA . 50915 2 651 . 1 . 1 125 125 LYS CB C 13 33.500 0.019 . 1 . . . . . 125 LYS CB . 50915 2 652 . 1 . 1 125 125 LYS N N 15 126.120 0.023 . 1 . . . . . 125 LYS N . 50915 2 653 . 1 . 1 126 126 ASN H H 1 7.890 0.005 . 1 . . . . . 126 ASN H . 50915 2 654 . 1 . 1 126 126 ASN HA H 1 4.510 0.005 . 1 . . . . . 126 ASN HA . 50915 2 655 . 1 . 1 126 126 ASN CA C 13 54.870 0.023 . 1 . . . . . 126 ASN CA . 50915 2 656 . 1 . 1 126 126 ASN CB C 13 41.540 0.010 . 1 . . . . . 126 ASN CB . 50915 2 657 . 1 . 1 126 126 ASN N N 15 124.230 0.042 . 1 . . . . . 126 ASN N . 50915 2 658 . 1 . 1 127 127 GLY C C 13 176.580 0.000 . 1 . . . . . 127 GLY C . 50915 2 659 . 1 . 1 128 128 ASN H H 1 8.440 0.005 . 1 . . . . . 128 ASN H . 50915 2 660 . 1 . 1 128 128 ASN N N 15 118.900 0.010 . 1 . . . . . 128 ASN N . 50915 2 661 . 1 . 1 129 129 LYS C C 13 177.010 0.000 . 1 . . . . . 129 LYS C . 50915 2 662 . 1 . 1 130 130 GLY H H 1 8.390 0.005 . 1 . . . . . 130 GLY H . 50915 2 663 . 1 . 1 130 130 GLY HA2 H 1 3.930 0.005 . 2 . . . . . 130 GLY HA2 . 50915 2 664 . 1 . 1 130 130 GLY HA3 H 1 3.960 0.005 . 2 . . . . . 130 GLY HA3 . 50915 2 665 . 1 . 1 130 130 GLY C C 13 173.92 0.000 . 1 . . . . . 130 GLY C . 50915 2 666 . 1 . 1 130 130 GLY CA C 13 45.330 0.000 . 1 . . . . . 130 GLY CA . 50915 2 667 . 1 . 1 130 130 GLY N N 15 109.750 0.000 . 1 . . . . . 130 GLY N . 50915 2 668 . 1 . 1 131 131 ALA H H 1 8.240 0.005 . 1 . . . . . 131 ALA H . 50915 2 669 . 1 . 1 131 131 ALA HA H 1 4.310 0.005 . 1 . . . . . 131 ALA HA . 50915 2 670 . 1 . 1 131 131 ALA C C 13 178.15 0.010 . 1 . . . . . 131 ALA C . 50915 2 671 . 1 . 1 131 131 ALA CA C 13 52.890 0.007 . 1 . . . . . 131 ALA CA . 50915 2 672 . 1 . 1 131 131 ALA CB C 13 19.120 0.000 . 1 . . . . . 131 ALA CB . 50915 2 673 . 1 . 1 131 131 ALA N N 15 123.810 0.000 . 1 . . . . . 131 ALA N . 50915 2 674 . 1 . 1 132 132 GLY H H 1 8.430 0.005 . 1 . . . . . 132 GLY H . 50915 2 675 . 1 . 1 132 132 GLY CA C 13 45.390 0.010 . 1 . . . . . 132 GLY CA . 50915 2 676 . 1 . 1 132 132 GLY N N 15 108.420 0.020 . 1 . . . . . 132 GLY N . 50915 2 677 . 1 . 1 133 133 GLY H H 1 8.210 0.005 . 1 . . . . . 133 GLY H . 50915 2 678 . 1 . 1 133 133 GLY CA C 13 45.620 0.034 . 1 . . . . . 133 GLY CA . 50915 2 679 . 1 . 1 133 133 GLY N N 15 108.420 0.032 . 1 . . . . . 133 GLY N . 50915 2 680 . 1 . 1 134 134 HIS H H 1 8.220 0.005 . 1 . . . . . 134 HIS H . 50915 2 681 . 1 . 1 134 134 HIS CA C 13 56.740 0.000 . 1 . . . . . 134 HIS CA . 50915 2 682 . 1 . 1 134 134 HIS CB C 13 26.94 0.000 . 1 . . . . . 134 HIS CB . 50915 2 683 . 1 . 1 134 134 HIS N N 15 118.950 0.000 . 1 . . . . . 134 HIS N . 50915 2 684 . 1 . 1 135 135 SER HA H 1 4.420 0.005 . 1 . . . . . 135 SER HA . 50915 2 685 . 1 . 1 135 135 SER C C 13 174.020 0.000 . 1 . . . . . 135 SER C . 50915 2 686 . 1 . 1 135 135 SER CA C 13 58.180 0.000 . 1 . . . . . 135 SER CA . 50915 2 687 . 1 . 1 135 135 SER CB C 13 63.86 0.000 . 1 . . . . . 135 SER CB . 50915 2 688 . 1 . 1 136 136 TYR H H 1 8.320 0.005 . 1 . . . . . 136 TYR H . 50915 2 689 . 1 . 1 136 136 TYR HA H 1 4.530 0.005 . 1 . . . . . 136 TYR HA . 50915 2 690 . 1 . 1 136 136 TYR C C 13 176.260 0.000 . 1 . . . . . 136 TYR C . 50915 2 691 . 1 . 1 136 136 TYR CA C 13 58.330 0.000 . 1 . . . . . 136 TYR CA . 50915 2 692 . 1 . 1 136 136 TYR CB C 13 38.930 0.000 . 1 . . . . . 136 TYR CB . 50915 2 693 . 1 . 1 136 136 TYR N N 15 122.230 0.000 . 1 . . . . . 136 TYR N . 50915 2 694 . 1 . 1 137 137 GLY H H 1 8.340 0.005 . 1 . . . . . 137 GLY H . 50915 2 695 . 1 . 1 137 137 GLY HA2 H 1 3.910 0.005 . 2 . . . . . 137 GLY HA2 . 50915 2 696 . 1 . 1 137 137 GLY HA3 H 1 3.860 0.005 . 1 . . . . . 137 GLY HA3 . 50915 2 697 . 1 . 1 137 137 GLY C C 13 173.970 0.032 . 1 . . . . . 137 GLY C . 50915 2 698 . 1 . 1 137 137 GLY CA C 13 45.520 0.027 . 1 . . . . . 137 GLY CA . 50915 2 699 . 1 . 1 137 137 GLY N N 15 110.490 0.000 . 1 . . . . . 137 GLY N . 50915 2 700 . 1 . 1 138 138 ALA H H 1 8.110 0.005 . 1 . . . . . 138 ALA H . 50915 2 701 . 1 . 1 138 138 ALA HA H 1 4.330 0.005 . 1 . . . . . 138 ALA HA . 50915 2 702 . 1 . 1 138 138 ALA C C 13 177.330 0.012 . 1 . . . . . 138 ALA C . 50915 2 703 . 1 . 1 138 138 ALA CA C 13 52.910 0.021 . 1 . . . . . 138 ALA CA . 50915 2 704 . 1 . 1 138 138 ALA CB C 13 19.360 0.000 . 1 . . . . . 138 ALA CB . 50915 2 705 . 1 . 1 138 138 ALA N N 15 123.610 0.027 . 1 . . . . . 138 ALA N . 50915 2 706 . 1 . 1 139 139 ASP H H 1 8.340 0.005 . 1 . . . . . 139 ASP H . 50915 2 707 . 1 . 1 139 139 ASP HA H 1 4.610 0.005 . 1 . . . . . 139 ASP HA . 50915 2 708 . 1 . 1 139 139 ASP C C 13 176.130 0.016 . 1 . . . . . 139 ASP C . 50915 2 709 . 1 . 1 139 139 ASP CA C 13 54.360 0.037 . 1 . . . . . 139 ASP CA . 50915 2 710 . 1 . 1 139 139 ASP CB C 13 41.040 0.024 . 1 . . . . . 139 ASP CB . 50915 2 711 . 1 . 1 139 139 ASP N N 15 118.590 0.044 . 1 . . . . . 139 ASP N . 50915 2 712 . 1 . 1 140 140 LEU H H 1 8.040 0.005 . 1 . . . . . 140 LEU H . 50915 2 713 . 1 . 1 140 140 LEU HA H 1 4.355 0.005 . 1 . . . . . 140 LEU HA . 50915 2 714 . 1 . 1 140 140 LEU C C 13 177.350 0.013 . 1 . . . . . 140 LEU C . 50915 2 715 . 1 . 1 140 140 LEU CA C 13 55.610 0.027 . 1 . . . . . 140 LEU CA . 50915 2 716 . 1 . 1 140 140 LEU CB C 13 42.220 0.043 . 1 . . . . . 140 LEU CB . 50915 2 717 . 1 . 1 140 140 LEU N N 15 122.180 0.038 . 1 . . . . . 140 LEU N . 50915 2 718 . 1 . 1 141 141 LYS H H 1 8.250 0.005 . 1 . . . . . 141 LYS H . 50915 2 719 . 1 . 1 141 141 LYS HA H 1 4.340 0.005 . 1 . . . . . 141 LYS HA . 50915 2 720 . 1 . 1 141 141 LYS C C 13 176.530 0.034 . 1 . . . . . 141 LYS C . 50915 2 721 . 1 . 1 141 141 LYS CA C 13 56.520 0.020 . 1 . . . . . 141 LYS CA . 50915 2 722 . 1 . 1 141 141 LYS CB C 13 33.000 0.000 . 1 . . . . . 141 LYS CB . 50915 2 723 . 1 . 1 141 141 LYS N N 15 121.420 0.017 . 1 . . . . . 141 LYS N . 50915 2 724 . 1 . 1 142 142 SER H H 1 8.110 0.005 . 1 . . . . . 142 SER H . 50915 2 725 . 1 . 1 142 142 SER HA H 1 4.430 0.005 . 1 . . . . . 142 SER HA . 50915 2 726 . 1 . 1 142 142 SER C C 13 174.080 0.017 . 1 . . . . . 142 SER C . 50915 2 727 . 1 . 1 142 142 SER CA C 13 58.390 0.019 . 1 . . . . . 142 SER CA . 50915 2 728 . 1 . 1 142 142 SER CB C 13 63.810 0.011 . 1 . . . . . 142 SER CB . 50915 2 729 . 1 . 1 142 142 SER N N 15 116.090 0.000 . 1 . . . . . 142 SER N . 50915 2 730 . 1 . 1 143 143 PHE H H 1 8.140 0.005 . 1 . . . . . 143 PHE H . 50915 2 731 . 1 . 1 143 143 PHE HA H 1 4.667 0.005 . 1 . . . . . 143 PHE HA . 50915 2 732 . 1 . 1 143 143 PHE C C 13 175.050 0.025 . 1 . . . . . 143 PHE C . 50915 2 733 . 1 . 1 143 143 PHE CA C 13 57.850 0.034 . 1 . . . . . 143 PHE CA . 50915 2 734 . 1 . 1 143 143 PHE CB C 13 39.770 0.012 . 1 . . . . . 143 PHE CB . 50915 2 735 . 1 . 1 143 143 PHE N N 15 121.650 0.068 . 1 . . . . . 143 PHE N . 50915 2 736 . 1 . 1 144 144 ASP H H 1 8.280 0.005 . 1 . . . . . 144 ASP H . 50915 2 737 . 1 . 1 144 144 ASP HA H 1 4.664 0.005 . 1 . . . . . 144 ASP HA . 50915 2 738 . 1 . 1 144 144 ASP C C 13 175.960 0.018 . 1 . . . . . 144 ASP C . 50915 2 739 . 1 . 1 144 144 ASP CA C 13 54.350 0.038 . 1 . . . . . 144 ASP CA . 50915 2 740 . 1 . 1 144 144 ASP CB C 13 41.600 0.017 . 1 . . . . . 144 ASP CB . 50915 2 741 . 1 . 1 144 144 ASP N N 15 121.730 0.037 . 1 . . . . . 144 ASP N . 50915 2 742 . 1 . 1 145 145 LEU H H 1 8.210 0.005 . 1 . . . . . 145 LEU H . 50915 2 743 . 1 . 1 145 145 LEU HA H 1 4.360 0.005 . 1 . . . . . 145 LEU HA . 50915 2 744 . 1 . 1 145 145 LEU C C 13 177.930 0.027 . 1 . . . . . 145 LEU C . 50915 2 745 . 1 . 1 145 145 LEU CA C 13 55.670 0.053 . 1 . . . . . 145 LEU CA . 50915 2 746 . 1 . 1 145 145 LEU CB C 13 42.490 0.018 . 1 . . . . . 145 LEU CB . 50915 2 747 . 1 . 1 145 145 LEU N N 15 122.680 0.046 . 1 . . . . . 145 LEU N . 50915 2 748 . 1 . 1 146 146 GLY H H 1 8.420 0.005 . 1 . . . . . 146 GLY H . 50915 2 749 . 1 . 1 146 146 GLY HA2 H 1 4.000 0.005 . 2 . . . . . 146 GLY HA2 . 50915 2 750 . 1 . 1 146 146 GLY HA3 H 1 4.000 0.005 . 2 . . . . . 146 GLY HA3 . 50915 2 751 . 1 . 1 146 146 GLY C C 13 174.010 0.009 . 1 . . . . . 146 GLY C . 50915 2 752 . 1 . 1 146 146 GLY CA C 13 45.650 0.034 . 1 . . . . . 146 GLY CA . 50915 2 753 . 1 . 1 146 146 GLY N N 15 109.070 0.033 . 1 . . . . . 146 GLY N . 50915 2 754 . 1 . 1 147 147 ASP H H 1 8.200 0.005 . 1 . . . . . 147 ASP H . 50915 2 755 . 1 . 1 147 147 ASP HA H 1 4.670 0.005 . 1 . . . . . 147 ASP HA . 50915 2 756 . 1 . 1 147 147 ASP C C 13 176.430 0.035 . 1 . . . . . 147 ASP C . 50915 2 757 . 1 . 1 147 147 ASP CA C 13 54.580 0.039 . 1 . . . . . 147 ASP CA . 50915 2 758 . 1 . 1 147 147 ASP CB C 13 41.470 0.023 . 1 . . . . . 147 ASP CB . 50915 2 759 . 1 . 1 147 147 ASP N N 15 120.420 0.044 . 1 . . . . . 147 ASP N . 50915 2 760 . 1 . 1 148 148 GLU H H 1 8.460 0.005 . 1 . . . . . 148 GLU H . 50915 2 761 . 1 . 1 148 148 GLU HA H 1 4.310 0.005 . 1 . . . . . 148 GLU HA . 50915 2 762 . 1 . 1 148 148 GLU C C 13 176.580 0.017 . 1 . . . . . 148 GLU C . 50915 2 763 . 1 . 1 148 148 GLU CA C 13 57.030 0.047 . 1 . . . . . 148 GLU CA . 50915 2 764 . 1 . 1 148 148 GLU CB C 13 30.040 0.041 . 1 . . . . . 148 GLU CB . 50915 2 765 . 1 . 1 148 148 GLU CG C 13 36.754 0.010 . 1 . . . . . 148 GLU CG . 50915 2 766 . 1 . 1 148 148 GLU N N 15 120.840 0.032 . 1 . . . . . 148 GLU N . 50915 2 767 . 1 . 1 149 149 LEU H H 1 8.260 0.005 . 1 . . . . . 149 LEU H . 50915 2 768 . 1 . 1 149 149 LEU HA H 1 4.380 0.005 . 1 . . . . . 149 LEU HA . 50915 2 769 . 1 . 1 149 149 LEU C C 13 177.930 0.015 . 1 . . . . . 149 LEU C . 50915 2 770 . 1 . 1 149 149 LEU CA C 13 55.520 0.038 . 1 . . . . . 149 LEU CA . 50915 2 771 . 1 . 1 149 149 LEU CB C 13 42.520 0.031 . 1 . . . . . 149 LEU CB . 50915 2 772 . 1 . 1 149 149 LEU N N 15 122.410 0.046 . 1 . . . . . 149 LEU N . 50915 2 773 . 1 . 1 150 150 GLY H H 1 8.360 0.005 . 1 . . . . . 150 GLY H . 50915 2 774 . 1 . 1 150 150 GLY HA2 H 1 4.030 0.005 . 2 . . . . . 150 GLY HA2 . 50915 2 775 . 1 . 1 150 150 GLY HA3 H 1 4.030 0.005 . 2 . . . . . 150 GLY HA3 . 50915 2 776 . 1 . 1 150 150 GLY C C 13 174.110 0.020 . 1 . . . . . 150 GLY C . 50915 2 777 . 1 . 1 150 150 GLY CA C 13 45.560 0.028 . 1 . . . . . 150 GLY CA . 50915 2 778 . 1 . 1 150 150 GLY N N 15 109.260 0.039 . 1 . . . . . 150 GLY N . 50915 2 779 . 1 . 1 151 151 THR H H 1 7.980 0.005 . 1 . . . . . 151 THR H . 50915 2 780 . 1 . 1 151 151 THR HA H 1 4.380 0.005 . 1 . . . . . 151 THR HA . 50915 2 781 . 1 . 1 151 151 THR C C 13 174.070 0.043 . 1 . . . . . 151 THR C . 50915 2 782 . 1 . 1 151 151 THR CA C 13 61.730 0.038 . 1 . . . . . 151 THR CA . 50915 2 783 . 1 . 1 151 151 THR CB C 13 70.280 0.025 . 1 . . . . . 151 THR CB . 50915 2 784 . 1 . 1 151 151 THR N N 15 113.100 0.043 . 1 . . . . . 151 THR N . 50915 2 785 . 1 . 1 152 152 ASP H H 1 8.480 0.005 . 1 . . . . . 152 ASP H . 50915 2 786 . 1 . 1 152 152 ASP HA H 1 4.920 0.005 . 1 . . . . . 152 ASP HA . 50915 2 787 . 1 . 1 152 152 ASP CA C 13 52.540 0.025 . 1 . . . . . 152 ASP CA . 50915 2 788 . 1 . 1 152 152 ASP CB C 13 41.500 0.000 . 1 . . . . . 152 ASP CB . 50915 2 789 . 1 . 1 152 152 ASP N N 15 124.450 0.043 . 1 . . . . . 152 ASP N . 50915 2 790 . 1 . 1 153 153 PRO HA H 1 4.400 0.005 . 1 . . . . . 153 PRO HA . 50915 2 791 . 1 . 1 153 153 PRO C C 13 176.740 0.006 . 1 . . . . . 153 PRO C . 50915 2 792 . 1 . 1 153 153 PRO CA C 13 63.650 0.024 . 1 . . . . . 153 PRO CA . 50915 2 793 . 1 . 1 153 153 PRO CB C 13 32.210 0.009 . 1 . . . . . 153 PRO CB . 50915 2 794 . 1 . 1 154 154 TYR H H 1 8.230 0.005 . 1 . . . . . 154 TYR H . 50915 2 795 . 1 . 1 154 154 TYR HA H 1 4.550 0.005 . 1 . . . . . 154 TYR HA . 50915 2 796 . 1 . 1 154 154 TYR C C 13 175.910 0.008 . 1 . . . . . 154 TYR C . 50915 2 797 . 1 . 1 154 154 TYR CA C 13 58.150 0.037 . 1 . . . . . 154 TYR CA . 50915 2 798 . 1 . 1 154 154 TYR CB C 13 38.480 0.012 . 1 . . . . . 154 TYR CB . 50915 2 799 . 1 . 1 154 154 TYR N N 15 119.340 0.047 . 1 . . . . . 154 TYR N . 50915 2 800 . 1 . 1 155 155 GLU H H 1 7.930 0.005 . 1 . . . . . 155 GLU H . 50915 2 801 . 1 . 1 155 155 GLU HA H 1 4.220 0.005 . 1 . . . . . 155 GLU HA . 50915 2 802 . 1 . 1 155 155 GLU C C 13 175.760 0.005 . 1 . . . . . 155 GLU C . 50915 2 803 . 1 . 1 155 155 GLU CA C 13 56.890 0.046 . 1 . . . . . 155 GLU CA . 50915 2 804 . 1 . 1 155 155 GLU CB C 13 30.750 0.053 . 1 . . . . . 155 GLU CB . 50915 2 805 . 1 . 1 155 155 GLU N N 15 121.960 0.042 . 1 . . . . . 155 GLU N . 50915 2 806 . 1 . 1 156 156 ASP H H 1 8.230 0.005 . 1 . . . . . 156 ASP H . 50915 2 807 . 1 . 1 156 156 ASP HA H 1 4.600 0.005 . 1 . . . . . 156 ASP HA . 50915 2 808 . 1 . 1 156 156 ASP C C 13 176.040 0.010 . 1 . . . . . 156 ASP C . 50915 2 809 . 1 . 1 156 156 ASP CA C 13 54.470 0.046 . 1 . . . . . 156 ASP CA . 50915 2 810 . 1 . 1 156 156 ASP CB C 13 41.350 0.007 . 1 . . . . . 156 ASP CB . 50915 2 811 . 1 . 1 156 156 ASP N N 15 121.130 0.038 . 1 . . . . . 156 ASP N . 50915 2 812 . 1 . 1 157 157 PHE H H 1 8.120 0.005 . 1 . . . . . 157 PHE H . 50915 2 813 . 1 . 1 157 157 PHE HA H 1 4.560 0.005 . 1 . . . . . 157 PHE HA . 50915 2 814 . 1 . 1 157 157 PHE C C 13 175.820 0.003 . 1 . . . . . 157 PHE C . 50915 2 815 . 1 . 1 157 157 PHE CA C 13 58.340 0.056 . 1 . . . . . 157 PHE CA . 50915 2 816 . 1 . 1 157 157 PHE CB C 13 39.310 0.010 . 1 . . . . . 157 PHE CB . 50915 2 817 . 1 . 1 157 157 PHE N N 15 120.760 0.041 . 1 . . . . . 157 PHE N . 50915 2 818 . 1 . 1 158 158 GLN H H 1 8.110 0.005 . 1 . . . . . 158 GLN H . 50915 2 819 . 1 . 1 158 158 GLN HA H 1 4.190 0.005 . 1 . . . . . 158 GLN HA . 50915 2 820 . 1 . 1 158 158 GLN C C 13 175.880 0.027 . 1 . . . . . 158 GLN C . 50915 2 821 . 1 . 1 158 158 GLN CA C 13 56.180 0.034 . 1 . . . . . 158 GLN CA . 50915 2 822 . 1 . 1 158 158 GLN CB C 13 29.560 0.013 . 1 . . . . . 158 GLN CB . 50915 2 823 . 1 . 1 158 158 GLN N N 15 121.230 0.028 . 1 . . . . . 158 GLN N . 50915 2 824 . 1 . 1 159 159 GLU H H 1 8.300 0.005 . 1 . . . . . 159 GLU H . 50915 2 825 . 1 . 1 159 159 GLU HA H 1 4.160 0.005 . 1 . . . . . 159 GLU HA . 50915 2 826 . 1 . 1 159 159 GLU C C 13 176.410 0.015 . 1 . . . . . 159 GLU C . 50915 2 827 . 1 . 1 159 159 GLU CA C 13 57.090 0.003 . 1 . . . . . 159 GLU CA . 50915 2 828 . 1 . 1 159 159 GLU CB C 13 30.470 0.000 . 1 . . . . . 159 GLU CB . 50915 2 829 . 1 . 1 159 159 GLU N N 15 121.150 0.102 . 1 . . . . . 159 GLU N . 50915 2 830 . 1 . 1 160 160 ASN H H 1 8.330 0.005 . 1 . . . . . 160 ASN H . 50915 2 831 . 1 . 1 160 160 ASN HA H 1 4.350 0.005 . 1 . . . . . 160 ASN HA . 50915 2 832 . 1 . 1 160 160 ASN C C 13 175.410 0.000 . 1 . . . . . 160 ASN C . 50915 2 833 . 1 . 1 160 160 ASN CA C 13 53.680 0.003 . 1 . . . . . 160 ASN CA . 50915 2 834 . 1 . 1 160 160 ASN CB C 13 41.090 0.012 . 1 . . . . . 160 ASN CB . 50915 2 835 . 1 . 1 160 160 ASN N N 15 118.800 0.000 . 1 . . . . . 160 ASN N . 50915 2 836 . 1 . 1 161 161 TRP H H 1 8.120 0.005 . 1 . . . . . 161 TRP H . 50915 2 837 . 1 . 1 161 161 TRP HA H 1 4.180 0.005 . 1 . . . . . 161 TRP HA . 50915 2 838 . 1 . 1 161 161 TRP C C 13 176.740 0.000 . 1 . . . . . 161 TRP C . 50915 2 839 . 1 . 1 161 161 TRP CA C 13 58.180 0.000 . 1 . . . . . 161 TRP CA . 50915 2 840 . 1 . 1 161 161 TRP CB C 13 29.360 0.000 . 1 . . . . . 161 TRP CB . 50915 2 841 . 1 . 1 161 161 TRP N N 15 121.240 0.008 . 1 . . . . . 161 TRP N . 50915 2 842 . 1 . 1 162 162 ASN H H 1 8.220 0.005 . 1 . . . . . 162 ASN H . 50915 2 843 . 1 . 1 162 162 ASN HA H 1 4.680 0.005 . 1 . . . . . 162 ASN HA . 50915 2 844 . 1 . 1 162 162 ASN C C 13 175.710 0.012 . 1 . . . . . 162 ASN C . 50915 2 845 . 1 . 1 162 162 ASN CA C 13 53.820 0.010 . 1 . . . . . 162 ASN CA . 50915 2 846 . 1 . 1 162 162 ASN CB C 13 38.440 0.000 . 1 . . . . . 162 ASN CB . 50915 2 847 . 1 . 1 162 162 ASN N N 15 118.970 0.010 . 1 . . . . . 162 ASN N . 50915 2 848 . 1 . 1 163 163 THR H H 1 7.940 0.005 . 1 . . . . . 163 THR H . 50915 2 849 . 1 . 1 163 163 THR HA H 1 4.380 0.005 . 1 . . . . . 163 THR HA . 50915 2 850 . 1 . 1 163 163 THR C C 13 174.870 0.000 . 1 . . . . . 163 THR C . 50915 2 851 . 1 . 1 163 163 THR CA C 13 62.680 0.032 . 1 . . . . . 163 THR CA . 50915 2 852 . 1 . 1 163 163 THR CB C 13 69.820 0.012 . 1 . . . . . 163 THR CB . 50915 2 853 . 1 . 1 163 163 THR N N 15 113.660 0.007 . 1 . . . . . 163 THR N . 50915 2 854 . 1 . 1 164 164 LYS H H 1 8.110 0.005 . 1 . . . . . 164 LYS H . 50915 2 855 . 1 . 1 164 164 LYS C C 13 175.290 0.000 . 1 . . . . . 164 LYS C . 50915 2 856 . 1 . 1 164 164 LYS CA C 13 56.960 0.000 . 1 . . . . . 164 LYS CA . 50915 2 857 . 1 . 1 164 164 LYS CB C 13 32.650 0.000 . 1 . . . . . 164 LYS CB . 50915 2 858 . 1 . 1 164 164 LYS N N 15 122.650 0.000 . 1 . . . . . 164 LYS N . 50915 2 859 . 1 . 1 168 168 GLY H H 1 8.400 0.005 . 1 . . . . . 168 GLY H . 50915 2 860 . 1 . 1 168 168 GLY HA2 H 1 3.950 0.005 . 2 . . . . . 168 GLY HA2 . 50915 2 861 . 1 . 1 168 168 GLY HA3 H 1 3.950 0.005 . 2 . . . . . 168 GLY HA3 . 50915 2 862 . 1 . 1 168 168 GLY C C 13 174.140 0.016 . 1 . . . . . 168 GLY C . 50915 2 863 . 1 . 1 168 168 GLY CA C 13 45.630 0.046 . 1 . . . . . 168 GLY CA . 50915 2 864 . 1 . 1 168 168 GLY N N 15 110.68 0.000 . 1 . . . . . 168 GLY N . 50915 2 865 . 1 . 1 169 169 VAL H H 1 7.940 0.005 . 1 . . . . . 169 VAL H . 50915 2 866 . 1 . 1 169 169 VAL HA H 1 4.230 0.005 . 1 . . . . . 169 VAL HA . 50915 2 867 . 1 . 1 169 169 VAL C C 13 176.430 0.035 . 1 . . . . . 169 VAL C . 50915 2 868 . 1 . 1 169 169 VAL CA C 13 62.720 0.046 . 1 . . . . . 169 VAL CA . 50915 2 869 . 1 . 1 169 169 VAL CB C 13 32.820 0.013 . 1 . . . . . 169 VAL CB . 50915 2 870 . 1 . 1 169 169 VAL N N 15 119.410 0.034 . 1 . . . . . 169 VAL N . 50915 2 871 . 1 . 1 170 170 THR H H 1 8.110 0.005 . 1 . . . . . 170 THR H . 50915 2 872 . 1 . 1 170 170 THR HA H 1 4.380 0.005 . 1 . . . . . 170 THR HA . 50915 2 873 . 1 . 1 170 170 THR C C 13 174.640 0.000 . 1 . . . . . 170 THR C . 50915 2 874 . 1 . 1 170 170 THR CA C 13 62.310 0.000 . 1 . . . . . 170 THR CA . 50915 2 875 . 1 . 1 170 170 THR CB C 13 69.610 0.000 . 1 . . . . . 170 THR CB . 50915 2 876 . 1 . 1 170 170 THR N N 15 117.900 0.000 . 1 . . . . . 170 THR N . 50915 2 877 . 1 . 1 171 171 ARG H H 1 8.390 0.005 . 1 . . . . . 171 ARG H . 50915 2 878 . 1 . 1 171 171 ARG HA H 1 4.310 0.005 . 1 . . . . . 171 ARG HA . 50915 2 879 . 1 . 1 171 171 ARG C C 13 176.040 0.018 . 1 . . . . . 171 ARG C . 50915 2 880 . 1 . 1 171 171 ARG CA C 13 56.920 0.012 . 1 . . . . . 171 ARG CA . 50915 2 881 . 1 . 1 171 171 ARG CB C 13 30.870 0.026 . 1 . . . . . 171 ARG CB . 50915 2 882 . 1 . 1 171 171 ARG N N 15 123.310 0.000 . 1 . . . . . 171 ARG N . 50915 2 883 . 1 . 1 172 172 GLU H H 1 8.450 0.005 . 1 . . . . . 172 GLU H . 50915 2 884 . 1 . 1 172 172 GLU HA H 1 4.340 0.005 . 1 . . . . . 172 GLU HA . 50915 2 885 . 1 . 1 172 172 GLU C C 13 176.740 0.000 . 1 . . . . . 172 GLU C . 50915 2 886 . 1 . 1 172 172 GLU CA C 13 57.440 0.000 . 1 . . . . . 172 GLU CA . 50915 2 887 . 1 . 1 172 172 GLU CB C 13 30.100 0.019 . 1 . . . . . 172 GLU CB . 50915 2 888 . 1 . 1 172 172 GLU N N 15 121.670 0.026 . 1 . . . . . 172 GLU N . 50915 2 889 . 1 . 1 173 173 LEU H H 1 8.150 0.005 . 1 . . . . . 173 LEU H . 50915 2 890 . 1 . 1 173 173 LEU HA H 1 4.360 0.005 . 1 . . . . . 173 LEU HA . 50915 2 891 . 1 . 1 173 173 LEU C C 13 177.600 0.049 . 1 . . . . . 173 LEU C . 50915 2 892 . 1 . 1 173 173 LEU CA C 13 55.850 0.012 . 1 . . . . . 173 LEU CA . 50915 2 893 . 1 . 1 173 173 LEU CB C 13 42.430 0.022 . 1 . . . . . 173 LEU CB . 50915 2 894 . 1 . 1 173 173 LEU N N 15 122.650 0.000 . 1 . . . . . 173 LEU N . 50915 2 895 . 1 . 1 174 174 MET H H 1 8.250 0.005 . 1 . . . . . 174 MET H . 50915 2 896 . 1 . 1 174 174 MET HA H 1 4.490 0.005 . 1 . . . . . 174 MET HA . 50915 2 897 . 1 . 1 174 174 MET C C 13 176.450 0.002 . 1 . . . . . 174 MET C . 50915 2 898 . 1 . 1 174 174 MET CA C 13 56.090 0.021 . 1 . . . . . 174 MET CA . 50915 2 899 . 1 . 1 174 174 MET CB C 13 32.670 0.000 . 1 . . . . . 174 MET CB . 50915 2 900 . 1 . 1 174 174 MET N N 15 120.320 0.043 . 1 . . . . . 174 MET N . 50915 2 901 . 1 . 1 175 175 ARG H H 1 8.170 0.013 . 1 . . . . . 175 ARG H . 50915 2 902 . 1 . 1 175 175 ARG HA H 1 4.380 0.011 . 1 . . . . . 175 ARG HA . 50915 2 903 . 1 . 1 175 175 ARG C C 13 176.610 0.020 . 1 . . . . . 175 ARG C . 50915 2 904 . 1 . 1 175 175 ARG CA C 13 56.940 0.037 . 1 . . . . . 175 ARG CA . 50915 2 905 . 1 . 1 175 175 ARG CB C 13 31.090 0.000 . 1 . . . . . 175 ARG CB . 50915 2 906 . 1 . 1 175 175 ARG N N 15 121.700 0.124 . 1 . . . . . 175 ARG N . 50915 2 907 . 1 . 1 176 176 GLU H H 1 8.380 0.005 . 1 . . . . . 176 GLU H . 50915 2 908 . 1 . 1 176 176 GLU HA H 1 4.340 0.005 . 1 . . . . . 176 GLU HA . 50915 2 909 . 1 . 1 176 176 GLU C C 13 176.860 0.000 . 1 . . . . . 176 GLU C . 50915 2 910 . 1 . 1 176 176 GLU CA C 13 57.020 0.019 . 1 . . . . . 176 GLU CA . 50915 2 911 . 1 . 1 176 176 GLU CB C 13 30.310 0.023 . 1 . . . . . 176 GLU CB . 50915 2 912 . 1 . 1 176 176 GLU N N 15 121.340 0.008 . 1 . . . . . 176 GLU N . 50915 2 913 . 1 . 1 177 177 LEU H H 1 8.250 0.005 . 1 . . . . . 177 LEU H . 50915 2 914 . 1 . 1 177 177 LEU C C 13 177.400 0.018 . 1 . . . . . 177 LEU C . 50915 2 915 . 1 . 1 177 177 LEU CA C 13 55.600 0.000 . 1 . . . . . 177 LEU CA . 50915 2 916 . 1 . 1 177 177 LEU CB C 13 42.410 0.000 . 1 . . . . . 177 LEU CB . 50915 2 917 . 1 . 1 177 177 LEU N N 15 122.460 0.032 . 1 . . . . . 177 LEU N . 50915 2 918 . 1 . 1 178 178 ASN H H 1 8.380 0.005 . 1 . . . . . 178 ASN H . 50915 2 919 . 1 . 1 178 178 ASN HA H 1 4.680 0.005 . 1 . . . . . 178 ASN HA . 50915 2 920 . 1 . 1 178 178 ASN C C 13 175.570 0.000 . 1 . . . . . 178 ASN C . 50915 2 921 . 1 . 1 178 178 ASN CA C 13 53.600 0.000 . 1 . . . . . 178 ASN CA . 50915 2 922 . 1 . 1 178 178 ASN CB C 13 38.910 0.000 . 1 . . . . . 178 ASN CB . 50915 2 923 . 1 . 1 178 178 ASN N N 15 118.690 0.000 . 1 . . . . . 178 ASN N . 50915 2 924 . 1 . 1 179 179 GLY H H 1 8.300 0.005 . 1 . . . . . 179 GLY H . 50915 2 925 . 1 . 1 179 179 GLY HA2 H 1 4.000 0.005 . 2 . . . . . 179 GLY HA2 . 50915 2 926 . 1 . 1 179 179 GLY HA3 H 1 4.000 0.005 . 2 . . . . . 179 GLY HA3 . 50915 2 927 . 1 . 1 179 179 GLY C C 13 173.730 0.013 . 1 . . . . . 179 GLY C . 50915 2 928 . 1 . 1 179 179 GLY CA C 13 45.650 0.032 . 1 . . . . . 179 GLY CA . 50915 2 929 . 1 . 1 179 179 GLY N N 15 109.600 0.000 . 1 . . . . . 179 GLY N . 50915 2 930 . 1 . 1 180 180 GLY H H 1 7.970 0.005 . 1 . . . . . 180 GLY H . 50915 2 931 . 1 . 1 180 180 GLY C C 13 179.080 0.000 . 1 . . . . . 180 GLY C . 50915 2 932 . 1 . 1 180 180 GLY CA C 13 46.190 0.035 . 1 . . . . . 180 GLY CA . 50915 2 933 . 1 . 1 180 180 GLY N N 15 115.110 0.023 . 1 . . . . . 180 GLY N . 50915 2 stop_ save_