data_53525 ####################### # Entry information # ####################### save_entry_information_1 _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information_1 _Entry.ID 53525 _Entry.Title ; Backbone assignment of TPPP/P25a full length ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2026-02-06 _Entry.Accession_date 2026-02-06 _Entry.Last_release_date 2026-02-06 _Entry.Original_release_date 2026-02-06 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.14.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 Shuyi Zeng . . . . 53525 2 Shenqing zhang . . . . 53525 3 shengnan zhang . . . . 53525 4 Yun Fan . . . . 53525 5 Wencheng Xia . . . . 53525 6 Feiyang Chen . . . . 53525 7 Cheng'an Huang . . . . 53525 8 Shiran Lv . . . . 53525 9 Jinxia Lu . . . . 53525 10 Yunpeng Sun . . . . 53525 11 Kai'en Liu . . . . 53525 12 Yunxia Li . . . . 53525 13 Yaoyang Zhang . . . . 53525 14 Jian Wang . . . . 53525 15 Cong Liu . . . . 53525 16 Dan Li . . . . 53525 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 53525 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 288 53525 '15N chemical shifts' 133 53525 '1H chemical shifts' 133 53525 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2026-05-21 . original BMRB . 53525 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 53524 'Backbone assignment of TPPP/P25a core domain' 53525 stop_ save_ ############### # Citations # ############### save_citations_1 _Citation.Sf_category citations _Citation.Sf_framecode citations_1 _Citation.Entry_ID 53525 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID . _Citation.DOI . _Citation.Full_citation . _Citation.Title ; TPPP/p25 amyloid seeding activity in cerebrospinal fluid as a specific diagnostic biomarker for multiple system atrophy ; _Citation.Status 'in preparation' _Citation.Type journal _Citation.Journal_abbrev Cell _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first . _Citation.Page_last . _Citation.Year . _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 Shuyi Zeng . . . . 53525 1 2 Shenqing Zhang . . . . 53525 1 3 Shengnan Zhang . . . . 53525 1 4 Yun Fan . . . . 53525 1 5 Wencheng Xia . . . . 53525 1 6 Feiyang Chen . . . . 53525 1 7 Cheng'an Huang . . . . 53525 1 8 Shiran Lv . . . . 53525 1 9 Jinxia Lu . . . . 53525 1 10 Yunpeng Sun . . . . 53525 1 11 Kai'en Liu . . . . 53525 1 12 Yunxia Li . . . . 53525 1 13 Yaoyang Zhang . . . . 53525 1 14 Jian Wang . . . . 53525 1 15 Cong Liu . . . . 53525 1 16 Dan Li . . . . 53525 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly_1 _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly_1 _Assembly.Entry_ID 53525 _Assembly.ID 1 _Assembly.Name 'TPPP/P25a full length' _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 'TPPP/P25a full length' 1 $entity_1 . . yes native no no . . . 53525 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 53525 _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 ; MADKAKPAKAANRTPPKSPG DPSKDRAAKRLSLESEGAGE GAAASPELSALEEAFRRFAV HGDARATGREMHGKNWSKLC KDCQVIDGRNVTVTDVDIVF SKIKGKSCRTITFEQFQEAL EELAKKRFKDKSSEEAVREV HRLIEGKAPIISGVTKAISS PTVSRLTDTTKFTGSHKERF DPSGKGKGKAGRVDLVDESG YVSGYKHAGTYDQKVQGGK ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 219 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not reported' _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 . 53525 1 2 . ALA . 53525 1 3 . ASP . 53525 1 4 . LYS . 53525 1 5 . ALA . 53525 1 6 . LYS . 53525 1 7 . PRO . 53525 1 8 . ALA . 53525 1 9 . LYS . 53525 1 10 . ALA . 53525 1 11 . ALA . 53525 1 12 . ASN . 53525 1 13 . ARG . 53525 1 14 . THR . 53525 1 15 . PRO . 53525 1 16 . PRO . 53525 1 17 . LYS . 53525 1 18 . SER . 53525 1 19 . PRO . 53525 1 20 . GLY . 53525 1 21 . ASP . 53525 1 22 . PRO . 53525 1 23 . SER . 53525 1 24 . LYS . 53525 1 25 . ASP . 53525 1 26 . ARG . 53525 1 27 . ALA . 53525 1 28 . ALA . 53525 1 29 . LYS . 53525 1 30 . ARG . 53525 1 31 . LEU . 53525 1 32 . SER . 53525 1 33 . LEU . 53525 1 34 . GLU . 53525 1 35 . SER . 53525 1 36 . GLU . 53525 1 37 . GLY . 53525 1 38 . ALA . 53525 1 39 . GLY . 53525 1 40 . GLU . 53525 1 41 . GLY . 53525 1 42 . ALA . 53525 1 43 . ALA . 53525 1 44 . ALA . 53525 1 45 . SER . 53525 1 46 . PRO . 53525 1 47 . GLU . 53525 1 48 . LEU . 53525 1 49 . SER . 53525 1 50 . ALA . 53525 1 51 . LEU . 53525 1 52 . GLU . 53525 1 53 . GLU . 53525 1 54 . ALA . 53525 1 55 . PHE . 53525 1 56 . ARG . 53525 1 57 . ARG . 53525 1 58 . PHE . 53525 1 59 . ALA . 53525 1 60 . VAL . 53525 1 61 . HIS . 53525 1 62 . GLY . 53525 1 63 . ASP . 53525 1 64 . ALA . 53525 1 65 . ARG . 53525 1 66 . ALA . 53525 1 67 . THR . 53525 1 68 . GLY . 53525 1 69 . ARG . 53525 1 70 . GLU . 53525 1 71 . MET . 53525 1 72 . HIS . 53525 1 73 . GLY . 53525 1 74 . LYS . 53525 1 75 . ASN . 53525 1 76 . TRP . 53525 1 77 . SER . 53525 1 78 . LYS . 53525 1 79 . LEU . 53525 1 80 . CYS . 53525 1 81 . LYS . 53525 1 82 . ASP . 53525 1 83 . CYS . 53525 1 84 . GLN . 53525 1 85 . VAL . 53525 1 86 . ILE . 53525 1 87 . ASP . 53525 1 88 . GLY . 53525 1 89 . ARG . 53525 1 90 . ASN . 53525 1 91 . VAL . 53525 1 92 . THR . 53525 1 93 . VAL . 53525 1 94 . THR . 53525 1 95 . ASP . 53525 1 96 . VAL . 53525 1 97 . ASP . 53525 1 98 . ILE . 53525 1 99 . VAL . 53525 1 100 . PHE . 53525 1 101 . SER . 53525 1 102 . LYS . 53525 1 103 . ILE . 53525 1 104 . LYS . 53525 1 105 . GLY . 53525 1 106 . LYS . 53525 1 107 . SER . 53525 1 108 . CYS . 53525 1 109 . ARG . 53525 1 110 . THR . 53525 1 111 . ILE . 53525 1 112 . THR . 53525 1 113 . PHE . 53525 1 114 . GLU . 53525 1 115 . GLN . 53525 1 116 . PHE . 53525 1 117 . GLN . 53525 1 118 . GLU . 53525 1 119 . ALA . 53525 1 120 . LEU . 53525 1 121 . GLU . 53525 1 122 . GLU . 53525 1 123 . LEU . 53525 1 124 . ALA . 53525 1 125 . LYS . 53525 1 126 . LYS . 53525 1 127 . ARG . 53525 1 128 . PHE . 53525 1 129 . LYS . 53525 1 130 . ASP . 53525 1 131 . LYS . 53525 1 132 . SER . 53525 1 133 . SER . 53525 1 134 . GLU . 53525 1 135 . GLU . 53525 1 136 . ALA . 53525 1 137 . VAL . 53525 1 138 . ARG . 53525 1 139 . GLU . 53525 1 140 . VAL . 53525 1 141 . HIS . 53525 1 142 . ARG . 53525 1 143 . LEU . 53525 1 144 . ILE . 53525 1 145 . GLU . 53525 1 146 . GLY . 53525 1 147 . LYS . 53525 1 148 . ALA . 53525 1 149 . PRO . 53525 1 150 . ILE . 53525 1 151 . ILE . 53525 1 152 . SER . 53525 1 153 . GLY . 53525 1 154 . VAL . 53525 1 155 . THR . 53525 1 156 . LYS . 53525 1 157 . ALA . 53525 1 158 . ILE . 53525 1 159 . SER . 53525 1 160 . SER . 53525 1 161 . PRO . 53525 1 162 . THR . 53525 1 163 . VAL . 53525 1 164 . SER . 53525 1 165 . ARG . 53525 1 166 . LEU . 53525 1 167 . THR . 53525 1 168 . ASP . 53525 1 169 . THR . 53525 1 170 . THR . 53525 1 171 . LYS . 53525 1 172 . PHE . 53525 1 173 . THR . 53525 1 174 . GLY . 53525 1 175 . SER . 53525 1 176 . HIS . 53525 1 177 . LYS . 53525 1 178 . GLU . 53525 1 179 . ARG . 53525 1 180 . PHE . 53525 1 181 . ASP . 53525 1 182 . PRO . 53525 1 183 . SER . 53525 1 184 . GLY . 53525 1 185 . LYS . 53525 1 186 . GLY . 53525 1 187 . LYS . 53525 1 188 . GLY . 53525 1 189 . LYS . 53525 1 190 . ALA . 53525 1 191 . GLY . 53525 1 192 . ARG . 53525 1 193 . VAL . 53525 1 194 . ASP . 53525 1 195 . LEU . 53525 1 196 . VAL . 53525 1 197 . ASP . 53525 1 198 . GLU . 53525 1 199 . SER . 53525 1 200 . GLY . 53525 1 201 . TYR . 53525 1 202 . VAL . 53525 1 203 . SER . 53525 1 204 . GLY . 53525 1 205 . TYR . 53525 1 206 . LYS . 53525 1 207 . HIS . 53525 1 208 . ALA . 53525 1 209 . GLY . 53525 1 210 . THR . 53525 1 211 . TYR . 53525 1 212 . ASP . 53525 1 213 . GLN . 53525 1 214 . LYS . 53525 1 215 . VAL . 53525 1 216 . GLN . 53525 1 217 . GLY . 53525 1 218 . GLY . 53525 1 219 . LYS . 53525 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 53525 1 . ALA 2 2 53525 1 . ASP 3 3 53525 1 . LYS 4 4 53525 1 . ALA 5 5 53525 1 . LYS 6 6 53525 1 . PRO 7 7 53525 1 . ALA 8 8 53525 1 . LYS 9 9 53525 1 . ALA 10 10 53525 1 . ALA 11 11 53525 1 . ASN 12 12 53525 1 . ARG 13 13 53525 1 . THR 14 14 53525 1 . PRO 15 15 53525 1 . PRO 16 16 53525 1 . LYS 17 17 53525 1 . SER 18 18 53525 1 . PRO 19 19 53525 1 . GLY 20 20 53525 1 . ASP 21 21 53525 1 . PRO 22 22 53525 1 . SER 23 23 53525 1 . LYS 24 24 53525 1 . ASP 25 25 53525 1 . ARG 26 26 53525 1 . ALA 27 27 53525 1 . ALA 28 28 53525 1 . LYS 29 29 53525 1 . ARG 30 30 53525 1 . LEU 31 31 53525 1 . SER 32 32 53525 1 . LEU 33 33 53525 1 . GLU 34 34 53525 1 . SER 35 35 53525 1 . GLU 36 36 53525 1 . GLY 37 37 53525 1 . ALA 38 38 53525 1 . GLY 39 39 53525 1 . GLU 40 40 53525 1 . GLY 41 41 53525 1 . ALA 42 42 53525 1 . ALA 43 43 53525 1 . ALA 44 44 53525 1 . SER 45 45 53525 1 . PRO 46 46 53525 1 . GLU 47 47 53525 1 . LEU 48 48 53525 1 . SER 49 49 53525 1 . ALA 50 50 53525 1 . LEU 51 51 53525 1 . GLU 52 52 53525 1 . GLU 53 53 53525 1 . ALA 54 54 53525 1 . PHE 55 55 53525 1 . ARG 56 56 53525 1 . ARG 57 57 53525 1 . PHE 58 58 53525 1 . ALA 59 59 53525 1 . VAL 60 60 53525 1 . HIS 61 61 53525 1 . GLY 62 62 53525 1 . ASP 63 63 53525 1 . ALA 64 64 53525 1 . ARG 65 65 53525 1 . ALA 66 66 53525 1 . THR 67 67 53525 1 . GLY 68 68 53525 1 . ARG 69 69 53525 1 . GLU 70 70 53525 1 . MET 71 71 53525 1 . HIS 72 72 53525 1 . GLY 73 73 53525 1 . LYS 74 74 53525 1 . ASN 75 75 53525 1 . TRP 76 76 53525 1 . SER 77 77 53525 1 . LYS 78 78 53525 1 . LEU 79 79 53525 1 . CYS 80 80 53525 1 . LYS 81 81 53525 1 . ASP 82 82 53525 1 . CYS 83 83 53525 1 . GLN 84 84 53525 1 . VAL 85 85 53525 1 . ILE 86 86 53525 1 . ASP 87 87 53525 1 . GLY 88 88 53525 1 . ARG 89 89 53525 1 . ASN 90 90 53525 1 . VAL 91 91 53525 1 . THR 92 92 53525 1 . VAL 93 93 53525 1 . THR 94 94 53525 1 . ASP 95 95 53525 1 . VAL 96 96 53525 1 . ASP 97 97 53525 1 . ILE 98 98 53525 1 . VAL 99 99 53525 1 . PHE 100 100 53525 1 . SER 101 101 53525 1 . LYS 102 102 53525 1 . ILE 103 103 53525 1 . LYS 104 104 53525 1 . GLY 105 105 53525 1 . LYS 106 106 53525 1 . SER 107 107 53525 1 . CYS 108 108 53525 1 . ARG 109 109 53525 1 . THR 110 110 53525 1 . ILE 111 111 53525 1 . THR 112 112 53525 1 . PHE 113 113 53525 1 . GLU 114 114 53525 1 . GLN 115 115 53525 1 . PHE 116 116 53525 1 . GLN 117 117 53525 1 . GLU 118 118 53525 1 . ALA 119 119 53525 1 . LEU 120 120 53525 1 . GLU 121 121 53525 1 . GLU 122 122 53525 1 . LEU 123 123 53525 1 . ALA 124 124 53525 1 . LYS 125 125 53525 1 . LYS 126 126 53525 1 . ARG 127 127 53525 1 . PHE 128 128 53525 1 . LYS 129 129 53525 1 . ASP 130 130 53525 1 . LYS 131 131 53525 1 . SER 132 132 53525 1 . SER 133 133 53525 1 . GLU 134 134 53525 1 . GLU 135 135 53525 1 . ALA 136 136 53525 1 . VAL 137 137 53525 1 . ARG 138 138 53525 1 . GLU 139 139 53525 1 . VAL 140 140 53525 1 . HIS 141 141 53525 1 . ARG 142 142 53525 1 . LEU 143 143 53525 1 . ILE 144 144 53525 1 . GLU 145 145 53525 1 . GLY 146 146 53525 1 . LYS 147 147 53525 1 . ALA 148 148 53525 1 . PRO 149 149 53525 1 . ILE 150 150 53525 1 . ILE 151 151 53525 1 . SER 152 152 53525 1 . GLY 153 153 53525 1 . VAL 154 154 53525 1 . THR 155 155 53525 1 . LYS 156 156 53525 1 . ALA 157 157 53525 1 . ILE 158 158 53525 1 . SER 159 159 53525 1 . SER 160 160 53525 1 . PRO 161 161 53525 1 . THR 162 162 53525 1 . VAL 163 163 53525 1 . SER 164 164 53525 1 . ARG 165 165 53525 1 . LEU 166 166 53525 1 . THR 167 167 53525 1 . ASP 168 168 53525 1 . THR 169 169 53525 1 . THR 170 170 53525 1 . LYS 171 171 53525 1 . PHE 172 172 53525 1 . THR 173 173 53525 1 . GLY 174 174 53525 1 . SER 175 175 53525 1 . HIS 176 176 53525 1 . LYS 177 177 53525 1 . GLU 178 178 53525 1 . ARG 179 179 53525 1 . PHE 180 180 53525 1 . ASP 181 181 53525 1 . PRO 182 182 53525 1 . SER 183 183 53525 1 . GLY 184 184 53525 1 . LYS 185 185 53525 1 . GLY 186 186 53525 1 . LYS 187 187 53525 1 . GLY 188 188 53525 1 . LYS 189 189 53525 1 . ALA 190 190 53525 1 . GLY 191 191 53525 1 . ARG 192 192 53525 1 . VAL 193 193 53525 1 . ASP 194 194 53525 1 . LEU 195 195 53525 1 . VAL 196 196 53525 1 . ASP 197 197 53525 1 . GLU 198 198 53525 1 . SER 199 199 53525 1 . GLY 200 200 53525 1 . TYR 201 201 53525 1 . VAL 202 202 53525 1 . SER 203 203 53525 1 . GLY 204 204 53525 1 . TYR 205 205 53525 1 . LYS 206 206 53525 1 . HIS 207 207 53525 1 . ALA 208 208 53525 1 . GLY 209 209 53525 1 . THR 210 210 53525 1 . TYR 211 211 53525 1 . ASP 212 212 53525 1 . GLN 213 213 53525 1 . LYS 214 214 53525 1 . VAL 215 215 53525 1 . GLN 216 216 53525 1 . GLY 217 217 53525 1 . GLY 218 218 53525 1 . LYS 219 219 53525 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 53525 _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 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . 53525 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 53525 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . plasmid . . pET-11d . . . 53525 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 53525 _Sample.ID 1 _Sample.Name '15N13C TPPP/P25a full length' _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 'TPPP/P25a full length' '[U-98% 13C; U-98% 15N]' . . 1 $entity_1 . . 450 . . uM . . . . 53525 1 2 'sodium phosphate' 'natural abundance' . . . . . . 50 . . mM . . . . 53525 1 3 'sodium chloride' 'natural abundance' . . . . . . 50 . . mM . . . . 53525 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 53525 _Sample_condition_list.ID 1 _Sample_condition_list.Name '15N13C TPPP/P25a full length' _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 7.0 . pH 53525 1 pressure 1 . atm 53525 1 temperature 298 . K 53525 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 53525 _Software.ID 1 _Software.Type . _Software.Name NMRPipe _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID processing . 53525 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 53525 _Software.ID 2 _Software.Type . _Software.Name TOPSPIN _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID collection . 53525 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 53525 _Software.ID 3 _Software.Type . _Software.Name NMRViewJ _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 53525 3 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 53525 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name 'Agilent 600 mHz' _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Agilent _NMR_spectrometer.Model DD2 _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 53525 _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 . . . . . . . . . . . . . . . . . 53525 1 2 '3D HNCACB' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 53525 1 3 '3D HNCA' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 53525 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 53525 _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 0.00 na indirect 0.251449530 . . . . . 53525 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . 53525 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . 53525 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 53525 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name 'backbone assignment of TPPP/P25a full length' _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' . . . 53525 1 2 '3D HNCACB' . . . 53525 1 3 '3D HNCA' . . . 53525 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 . . 53525 1 2 $software_2 . . 53525 1 3 $software_3 . . 53525 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 17 17 LYS CA C 13 57.0860 0.0000 . 1 . . . . . 17 LYS CA . 53525 1 2 . 1 . 1 17 17 LYS CB C 13 29.9180 0.0000 . 1 . . . . . 17 LYS CB . 53525 1 3 . 1 . 1 18 18 SER H H 1 8.1640 0.0000 . 1 . . . . . 18 SER H . 53525 1 4 . 1 . 1 18 18 SER CA C 13 58.7760 0.0000 . 1 . . . . . 18 SER CA . 53525 1 5 . 1 . 1 18 18 SER CB C 13 63.7250 0.0000 . 1 . . . . . 18 SER CB . 53525 1 6 . 1 . 1 18 18 SER N N 15 115.7550 0.0000 . 1 . . . . . 18 SER N . 53525 1 7 . 1 . 1 19 19 PRO CA C 13 63.5390 0.0000 . 1 . . . . . 19 PRO CA . 53525 1 8 . 1 . 1 19 19 PRO CB C 13 32.0490 0.0000 . 1 . . . . . 19 PRO CB . 53525 1 9 . 1 . 1 20 20 GLY H H 1 8.3260 0.0000 . 1 . . . . . 20 GLY H . 53525 1 10 . 1 . 1 20 20 GLY CA C 13 44.8900 0.0000 . 1 . . . . . 20 GLY CA . 53525 1 11 . 1 . 1 20 20 GLY N N 15 108.7430 0.0000 . 1 . . . . . 20 GLY N . 53525 1 12 . 1 . 1 21 21 ASP H H 1 8.1490 0.0000 . 1 . . . . . 21 ASP H . 53525 1 13 . 1 . 1 21 21 ASP CA C 13 56.4810 0.0000 . 1 . . . . . 21 ASP CA . 53525 1 14 . 1 . 1 21 21 ASP CB C 13 41.2670 0.0000 . 1 . . . . . 21 ASP CB . 53525 1 15 . 1 . 1 21 21 ASP N N 15 121.2910 0.0000 . 1 . . . . . 21 ASP N . 53525 1 16 . 1 . 1 22 22 PRO CA C 13 63.5390 0.0000 . 1 . . . . . 22 PRO CA . 53525 1 17 . 1 . 1 22 22 PRO CB C 13 32.0490 0.0000 . 1 . . . . . 22 PRO CB . 53525 1 18 . 1 . 1 23 23 SER H H 1 8.4150 0.0000 . 1 . . . . . 23 SER H . 53525 1 19 . 1 . 1 23 23 SER CA C 13 59.5470 0.0000 . 1 . . . . . 23 SER CA . 53525 1 20 . 1 . 1 23 23 SER CB C 13 63.5390 0.0000 . 1 . . . . . 23 SER CB . 53525 1 21 . 1 . 1 23 23 SER N N 15 115.3490 0.0000 . 1 . . . . . 23 SER N . 53525 1 22 . 1 . 1 29 29 LYS CA C 13 55.9900 0.0000 . 1 . . . . . 29 LYS CA . 53525 1 23 . 1 . 1 29 29 LYS CB C 13 30.9700 0.0000 . 1 . . . . . 29 LYS CB . 53525 1 24 . 1 . 1 30 30 ARG H H 1 8.3490 0.0000 . 1 . . . . . 30 ARG H . 53525 1 25 . 1 . 1 30 30 ARG CA C 13 56.9590 0.0000 . 1 . . . . . 30 ARG CA . 53525 1 26 . 1 . 1 30 30 ARG CB C 13 30.3220 0.0000 . 1 . . . . . 30 ARG CB . 53525 1 27 . 1 . 1 30 30 ARG N N 15 122.6910 0.0000 . 1 . . . . . 30 ARG N . 53525 1 28 . 1 . 1 31 31 LEU H H 1 8.2630 0.0000 . 1 . . . . . 31 LEU H . 53525 1 29 . 1 . 1 31 31 LEU CA C 13 55.1260 0.0000 . 1 . . . . . 31 LEU CA . 53525 1 30 . 1 . 1 31 31 LEU CB C 13 43.1550 0.0000 . 1 . . . . . 31 LEU CB . 53525 1 31 . 1 . 1 31 31 LEU N N 15 123.3260 0.0000 . 1 . . . . . 31 LEU N . 53525 1 32 . 1 . 1 32 32 SER H H 1 8.6470 0.0000 . 1 . . . . . 32 SER H . 53525 1 33 . 1 . 1 32 32 SER CA C 13 59.1160 0.0000 . 1 . . . . . 32 SER CA . 53525 1 34 . 1 . 1 32 32 SER CB C 13 64.2920 0.0000 . 1 . . . . . 32 SER CB . 53525 1 35 . 1 . 1 32 32 SER N N 15 118.1150 0.0000 . 1 . . . . . 32 SER N . 53525 1 36 . 1 . 1 36 36 GLU CA C 13 56.9600 0.0000 . 1 . . . . . 36 GLU CA . 53525 1 37 . 1 . 1 36 36 GLU CB C 13 30.1080 0.0000 . 1 . . . . . 36 GLU CB . 53525 1 38 . 1 . 1 37 37 GLY H H 1 8.3710 0.0000 . 1 . . . . . 37 GLY H . 53525 1 39 . 1 . 1 37 37 GLY CA C 13 45.5280 0.0000 . 1 . . . . . 37 GLY CA . 53525 1 40 . 1 . 1 37 37 GLY N N 15 109.8380 0.0000 . 1 . . . . . 37 GLY N . 53525 1 41 . 1 . 1 38 38 ALA H H 1 8.1600 0.0000 . 1 . . . . . 38 ALA H . 53525 1 42 . 1 . 1 38 38 ALA CA C 13 52.5380 0.0000 . 1 . . . . . 38 ALA CA . 53525 1 43 . 1 . 1 38 38 ALA CB C 13 19.6460 0.0000 . 1 . . . . . 38 ALA CB . 53525 1 44 . 1 . 1 38 38 ALA N N 15 123.7410 0.0000 . 1 . . . . . 38 ALA N . 53525 1 45 . 1 . 1 39 39 GLY H H 1 8.3690 0.0000 . 1 . . . . . 39 GLY H . 53525 1 46 . 1 . 1 39 39 GLY CA C 13 45.3120 0.0000 . 1 . . . . . 39 GLY CA . 53525 1 47 . 1 . 1 39 39 GLY N N 15 108.1180 0.0000 . 1 . . . . . 39 GLY N . 53525 1 48 . 1 . 1 40 40 GLU H H 1 8.3320 0.0000 . 1 . . . . . 40 GLU H . 53525 1 49 . 1 . 1 40 40 GLU CA C 13 56.7690 0.0000 . 1 . . . . . 40 GLU CA . 53525 1 50 . 1 . 1 40 40 GLU CB C 13 30.5380 0.0000 . 1 . . . . . 40 GLU CB . 53525 1 51 . 1 . 1 40 40 GLU N N 15 120.6830 0.0000 . 1 . . . . . 40 GLU N . 53525 1 52 . 1 . 1 41 41 GLY H H 1 8.4750 0.0000 . 1 . . . . . 41 GLY H . 53525 1 53 . 1 . 1 41 41 GLY CA C 13 45.3120 0.0000 . 1 . . . . . 41 GLY CA . 53525 1 54 . 1 . 1 41 41 GLY N N 15 110.0670 0.0000 . 1 . . . . . 41 GLY N . 53525 1 55 . 1 . 1 42 42 ALA H H 1 8.0700 0.0000 . 1 . . . . . 42 ALA H . 53525 1 56 . 1 . 1 42 42 ALA CA C 13 52.4300 0.0000 . 1 . . . . . 42 ALA CA . 53525 1 57 . 1 . 1 42 42 ALA CB C 13 19.4300 0.0000 . 1 . . . . . 42 ALA CB . 53525 1 58 . 1 . 1 42 42 ALA N N 15 123.8520 0.0000 . 1 . . . . . 42 ALA N . 53525 1 59 . 1 . 1 43 43 ALA H H 1 8.1990 0.0000 . 1 . . . . . 43 ALA H . 53525 1 60 . 1 . 1 43 43 ALA CA C 13 52.2140 0.0000 . 1 . . . . . 43 ALA CA . 53525 1 61 . 1 . 1 43 43 ALA CB C 13 19.3220 0.0000 . 1 . . . . . 43 ALA CB . 53525 1 62 . 1 . 1 43 43 ALA N N 15 123.3850 0.0000 . 1 . . . . . 43 ALA N . 53525 1 63 . 1 . 1 44 44 ALA H H 1 8.1990 0.0000 . 1 . . . . . 44 ALA H . 53525 1 64 . 1 . 1 44 44 ALA CA C 13 52.2140 0.0000 . 1 . . . . . 44 ALA CA . 53525 1 65 . 1 . 1 44 44 ALA CB C 13 19.3220 0.0000 . 1 . . . . . 44 ALA CB . 53525 1 66 . 1 . 1 44 44 ALA N N 15 123.3850 0.0000 . 1 . . . . . 44 ALA N . 53525 1 67 . 1 . 1 45 45 SER H H 1 8.2980 0.0000 . 1 . . . . . 45 SER H . 53525 1 68 . 1 . 1 45 45 SER CA C 13 56.2040 0.0000 . 1 . . . . . 45 SER CA . 53525 1 69 . 1 . 1 45 45 SER CB C 13 63.3220 0.0000 . 1 . . . . . 45 SER CB . 53525 1 70 . 1 . 1 45 45 SER N N 15 116.6490 0.0000 . 1 . . . . . 45 SER N . 53525 1 71 . 1 . 1 46 46 PRO CA C 13 63.5390 0.0000 . 1 . . . . . 46 PRO CA . 53525 1 72 . 1 . 1 46 46 PRO CB C 13 32.0490 0.0000 . 1 . . . . . 46 PRO CB . 53525 1 73 . 1 . 1 47 47 GLU H H 1 8.5510 0.0000 . 1 . . . . . 47 GLU H . 53525 1 74 . 1 . 1 47 47 GLU CA C 13 57.0670 0.0000 . 1 . . . . . 47 GLU CA . 53525 1 75 . 1 . 1 47 47 GLU CB C 13 30.1070 0.0000 . 1 . . . . . 47 GLU CB . 53525 1 76 . 1 . 1 47 47 GLU N N 15 121.2350 0.0000 . 1 . . . . . 47 GLU N . 53525 1 77 . 1 . 1 48 48 LEU H H 1 8.2230 0.0000 . 1 . . . . . 48 LEU H . 53525 1 78 . 1 . 1 48 48 LEU CA C 13 55.1260 0.0000 . 1 . . . . . 48 LEU CA . 53525 1 79 . 1 . 1 48 48 LEU CB C 13 42.9400 0.0000 . 1 . . . . . 48 LEU CB . 53525 1 80 . 1 . 1 48 48 LEU N N 15 123.3640 0.0000 . 1 . . . . . 48 LEU N . 53525 1 81 . 1 . 1 49 49 SER H H 1 8.6450 0.0000 . 1 . . . . . 49 SER H . 53525 1 82 . 1 . 1 49 49 SER CA C 13 59.0080 0.0000 . 1 . . . . . 49 SER CA . 53525 1 83 . 1 . 1 49 49 SER CB C 13 64.1850 0.0000 . 1 . . . . . 49 SER CB . 53525 1 84 . 1 . 1 49 49 SER N N 15 118.1050 0.0000 . 1 . . . . . 49 SER N . 53525 1 85 . 1 . 1 50 50 ALA H H 1 8.7680 0.0000 . 1 . . . . . 50 ALA H . 53525 1 86 . 1 . 1 50 50 ALA CA C 13 55.1260 0.0000 . 1 . . . . . 50 ALA CA . 53525 1 87 . 1 . 1 50 50 ALA CB C 13 18.2440 0.0000 . 1 . . . . . 50 ALA CB . 53525 1 88 . 1 . 1 50 50 ALA N N 15 124.3170 0.0000 . 1 . . . . . 50 ALA N . 53525 1 89 . 1 . 1 51 51 LEU H H 1 8.8850 0.0000 . 1 . . . . . 51 LEU H . 53525 1 90 . 1 . 1 51 51 LEU CA C 13 58.2530 0.0000 . 1 . . . . . 51 LEU CA . 53525 1 91 . 1 . 1 51 51 LEU CB C 13 41.9690 0.0000 . 1 . . . . . 51 LEU CB . 53525 1 92 . 1 . 1 51 51 LEU N N 15 121.9110 0.0000 . 1 . . . . . 51 LEU N . 53525 1 93 . 1 . 1 52 52 GLU CA C 13 59.7050 0.0000 . 1 . . . . . 52 GLU CA . 53525 1 94 . 1 . 1 52 52 GLU CB C 13 28.7960 0.0000 . 1 . . . . . 52 GLU CB . 53525 1 95 . 1 . 1 53 53 GLU H H 1 8.4710 0.0000 . 1 . . . . . 53 GLU H . 53525 1 96 . 1 . 1 53 53 GLU CA C 13 59.6550 0.0000 . 1 . . . . . 53 GLU CA . 53525 1 97 . 1 . 1 53 53 GLU CB C 13 29.5670 0.0000 . 1 . . . . . 53 GLU CB . 53525 1 98 . 1 . 1 53 53 GLU N N 15 119.0160 0.0000 . 1 . . . . . 53 GLU N . 53525 1 99 . 1 . 1 54 54 ALA H H 1 8.3600 0.0000 . 1 . . . . . 54 ALA H . 53525 1 100 . 1 . 1 54 54 ALA CA C 13 54.9100 0.0000 . 1 . . . . . 54 ALA CA . 53525 1 101 . 1 . 1 54 54 ALA CB C 13 18.3520 0.0000 . 1 . . . . . 54 ALA CB . 53525 1 102 . 1 . 1 54 54 ALA N N 15 123.5360 0.0000 . 1 . . . . . 54 ALA N . 53525 1 103 . 1 . 1 55 55 PHE H H 1 8.1180 0.0000 . 1 . . . . . 55 PHE H . 53525 1 104 . 1 . 1 55 55 PHE CA C 13 57.6060 0.0000 . 1 . . . . . 55 PHE CA . 53525 1 105 . 1 . 1 55 55 PHE CB C 13 41.8610 0.0000 . 1 . . . . . 55 PHE CB . 53525 1 106 . 1 . 1 55 55 PHE N N 15 115.5910 0.0000 . 1 . . . . . 55 PHE N . 53525 1 107 . 1 . 1 56 56 ARG H H 1 7.6980 0.0000 . 1 . . . . . 56 ARG H . 53525 1 108 . 1 . 1 56 56 ARG CA C 13 60.1940 0.0000 . 1 . . . . . 56 ARG CA . 53525 1 109 . 1 . 1 56 56 ARG CB C 13 28.9200 0.0000 . 1 . . . . . 56 ARG CB . 53525 1 110 . 1 . 1 56 56 ARG N N 15 119.1260 0.0000 . 1 . . . . . 56 ARG N . 53525 1 111 . 1 . 1 58 58 PHE H H 1 8.0200 0.0000 . 1 . . . . . 58 PHE H . 53525 1 112 . 1 . 1 58 58 PHE CA C 13 61.7040 0.0000 . 1 . . . . . 58 PHE CA . 53525 1 113 . 1 . 1 58 58 PHE CB C 13 40.2450 0.0000 . 1 . . . . . 58 PHE CB . 53525 1 114 . 1 . 1 58 58 PHE N N 15 114.6690 0.0000 . 1 . . . . . 58 PHE N . 53525 1 115 . 1 . 1 59 59 ALA H H 1 8.9870 0.0000 . 1 . . . . . 59 ALA H . 53525 1 116 . 1 . 1 59 59 ALA CA C 13 55.9890 0.0000 . 1 . . . . . 59 ALA CA . 53525 1 117 . 1 . 1 59 59 ALA CB C 13 18.0280 0.0000 . 1 . . . . . 59 ALA CB . 53525 1 118 . 1 . 1 59 59 ALA N N 15 122.5180 0.0000 . 1 . . . . . 59 ALA N . 53525 1 119 . 1 . 1 60 60 VAL H H 1 7.3940 0.0000 . 1 . . . . . 60 VAL H . 53525 1 120 . 1 . 1 60 60 VAL CA C 13 60.9490 0.0000 . 1 . . . . . 60 VAL CA . 53525 1 121 . 1 . 1 60 60 VAL CB C 13 31.2930 0.0000 . 1 . . . . . 60 VAL CB . 53525 1 122 . 1 . 1 60 60 VAL N N 15 106.1670 0.0000 . 1 . . . . . 60 VAL N . 53525 1 123 . 1 . 1 61 61 HIS H H 1 6.9890 0.0000 . 1 . . . . . 61 HIS H . 53525 1 124 . 1 . 1 61 61 HIS CA C 13 58.8810 0.0000 . 1 . . . . . 61 HIS CA . 53525 1 125 . 1 . 1 61 61 HIS CB C 13 30.1680 0.0000 . 1 . . . . . 61 HIS CB . 53525 1 126 . 1 . 1 61 61 HIS N N 15 122.2290 0.0000 . 1 . . . . . 61 HIS N . 53525 1 127 . 1 . 1 62 62 GLY CA C 13 45.4180 0.0000 . 1 . . . . . 62 GLY CA . 53525 1 128 . 1 . 1 63 63 ASP H H 1 7.6670 0.0000 . 1 . . . . . 63 ASP H . 53525 1 129 . 1 . 1 63 63 ASP CA C 13 53.1740 0.0000 . 1 . . . . . 63 ASP CA . 53525 1 130 . 1 . 1 63 63 ASP CB C 13 42.1140 0.0000 . 1 . . . . . 63 ASP CB . 53525 1 131 . 1 . 1 63 63 ASP N N 15 119.1790 0.0000 . 1 . . . . . 63 ASP N . 53525 1 132 . 1 . 1 64 64 ALA H H 1 8.6550 0.0000 . 1 . . . . . 64 ALA H . 53525 1 133 . 1 . 1 64 64 ALA CA C 13 54.0430 0.0000 . 1 . . . . . 64 ALA CA . 53525 1 134 . 1 . 1 64 64 ALA CB C 13 18.7040 0.0000 . 1 . . . . . 64 ALA CB . 53525 1 135 . 1 . 1 64 64 ALA N N 15 127.1140 0.0000 . 1 . . . . . 64 ALA N . 53525 1 136 . 1 . 1 65 65 ARG H H 1 8.2900 0.0000 . 1 . . . . . 65 ARG H . 53525 1 137 . 1 . 1 65 65 ARG CA C 13 55.3420 0.0000 . 1 . . . . . 65 ARG CA . 53525 1 138 . 1 . 1 65 65 ARG CB C 13 30.1860 0.0000 . 1 . . . . . 65 ARG CB . 53525 1 139 . 1 . 1 65 65 ARG N N 15 115.3210 0.0000 . 1 . . . . . 65 ARG N . 53525 1 140 . 1 . 1 66 66 ALA H H 1 7.4020 0.0000 . 1 . . . . . 66 ALA H . 53525 1 141 . 1 . 1 66 66 ALA CA C 13 52.5230 0.0000 . 1 . . . . . 66 ALA CA . 53525 1 142 . 1 . 1 66 66 ALA CB C 13 19.8850 0.0000 . 1 . . . . . 66 ALA CB . 53525 1 143 . 1 . 1 66 66 ALA N N 15 123.8250 0.0000 . 1 . . . . . 66 ALA N . 53525 1 144 . 1 . 1 67 67 THR H H 1 8.6030 0.0000 . 1 . . . . . 67 THR H . 53525 1 145 . 1 . 1 67 67 THR CA C 13 62.7720 0.0000 . 1 . . . . . 67 THR CA . 53525 1 146 . 1 . 1 67 67 THR CB C 13 70.5550 0.0000 . 1 . . . . . 67 THR CB . 53525 1 147 . 1 . 1 67 67 THR N N 15 110.3040 0.0000 . 1 . . . . . 67 THR N . 53525 1 148 . 1 . 1 68 68 GLY H H 1 8.6070 0.0000 . 1 . . . . . 68 GLY H . 53525 1 149 . 1 . 1 68 68 GLY CA C 13 45.7340 0.0000 . 1 . . . . . 68 GLY CA . 53525 1 150 . 1 . 1 68 68 GLY N N 15 110.3040 0.0000 . 1 . . . . . 68 GLY N . 53525 1 151 . 1 . 1 69 69 ARG H H 1 7.7980 0.0000 . 1 . . . . . 69 ARG H . 53525 1 152 . 1 . 1 69 69 ARG CA C 13 56.2510 0.0000 . 1 . . . . . 69 ARG CA . 53525 1 153 . 1 . 1 69 69 ARG CB C 13 31.4300 0.0000 . 1 . . . . . 69 ARG CB . 53525 1 154 . 1 . 1 69 69 ARG N N 15 114.3450 0.0000 . 1 . . . . . 69 ARG N . 53525 1 155 . 1 . 1 70 70 GLU H H 1 7.7400 0.0000 . 1 . . . . . 70 GLU H . 53525 1 156 . 1 . 1 70 70 GLU CA C 13 54.5690 0.0000 . 1 . . . . . 70 GLU CA . 53525 1 157 . 1 . 1 70 70 GLU CB C 13 33.1130 0.0000 . 1 . . . . . 70 GLU CB . 53525 1 158 . 1 . 1 70 70 GLU N N 15 115.3260 0.0000 . 1 . . . . . 70 GLU N . 53525 1 159 . 1 . 1 71 71 MET H H 1 9.4310 0.0000 . 1 . . . . . 71 MET H . 53525 1 160 . 1 . 1 71 71 MET CA C 13 54.1480 0.0000 . 1 . . . . . 71 MET CA . 53525 1 161 . 1 . 1 71 71 MET CB C 13 38.3720 0.0000 . 1 . . . . . 71 MET CB . 53525 1 162 . 1 . 1 71 71 MET N N 15 123.2230 0.0000 . 1 . . . . . 71 MET N . 53525 1 163 . 1 . 1 72 72 HIS H H 1 8.4420 0.0000 . 1 . . . . . 72 HIS H . 53525 1 164 . 1 . 1 72 72 HIS CA C 13 55.4440 0.0000 . 1 . . . . . 72 HIS CA . 53525 1 165 . 1 . 1 72 72 HIS CB C 13 32.0610 0.0000 . 1 . . . . . 72 HIS CB . 53525 1 166 . 1 . 1 72 72 HIS N N 15 124.4980 0.0000 . 1 . . . . . 72 HIS N . 53525 1 167 . 1 . 1 73 73 GLY H H 1 9.1340 0.0000 . 1 . . . . . 73 GLY H . 53525 1 168 . 1 . 1 73 73 GLY CA C 13 47.2060 0.0000 . 1 . . . . . 73 GLY CA . 53525 1 169 . 1 . 1 73 73 GLY N N 15 109.7160 0.0000 . 1 . . . . . 73 GLY N . 53525 1 170 . 1 . 1 74 74 LYS H H 1 8.6450 0.0000 . 1 . . . . . 74 LYS H . 53525 1 171 . 1 . 1 74 74 LYS CA C 13 59.1960 0.0000 . 1 . . . . . 74 LYS CA . 53525 1 172 . 1 . 1 74 74 LYS CB C 13 32.0610 0.0000 . 1 . . . . . 74 LYS CB . 53525 1 173 . 1 . 1 74 74 LYS N N 15 122.1920 0.0000 . 1 . . . . . 74 LYS N . 53525 1 174 . 1 . 1 75 75 ASN H H 1 8.0830 0.0000 . 1 . . . . . 75 ASN H . 53525 1 175 . 1 . 1 75 75 ASN CA C 13 55.2000 0.0000 . 1 . . . . . 75 ASN CA . 53525 1 176 . 1 . 1 75 75 ASN CB C 13 38.0560 0.0000 . 1 . . . . . 75 ASN CB . 53525 1 177 . 1 . 1 75 75 ASN N N 15 121.3100 0.0000 . 1 . . . . . 75 ASN N . 53525 1 178 . 1 . 1 76 76 TRP H H 1 8.1440 0.0000 . 1 . . . . . 76 TRP H . 53525 1 179 . 1 . 1 76 76 TRP CA C 13 59.8270 0.0000 . 1 . . . . . 76 TRP CA . 53525 1 180 . 1 . 1 76 76 TRP CB C 13 30.3790 0.0000 . 1 . . . . . 76 TRP CB . 53525 1 181 . 1 . 1 76 76 TRP N N 15 125.0470 0.0000 . 1 . . . . . 76 TRP N . 53525 1 182 . 1 . 1 77 77 SER H H 1 8.1190 0.0000 . 1 . . . . . 77 SER H . 53525 1 183 . 1 . 1 77 77 SER CA C 13 62.4570 0.0000 . 1 . . . . . 77 SER CA . 53525 1 184 . 1 . 1 77 77 SER N N 15 115.3730 0.0000 . 1 . . . . . 77 SER N . 53525 1 185 . 1 . 1 78 78 LYS H H 1 7.7990 0.0000 . 1 . . . . . 78 LYS H . 53525 1 186 . 1 . 1 78 78 LYS CA C 13 59.9330 0.0000 . 1 . . . . . 78 LYS CA . 53525 1 187 . 1 . 1 78 78 LYS CB C 13 32.5870 0.0000 . 1 . . . . . 78 LYS CB . 53525 1 188 . 1 . 1 78 78 LYS N N 15 120.8330 0.0000 . 1 . . . . . 78 LYS N . 53525 1 189 . 1 . 1 79 79 LEU H H 1 8.1060 0.0000 . 1 . . . . . 79 LEU H . 53525 1 190 . 1 . 1 79 79 LEU CA C 13 59.7220 0.0000 . 1 . . . . . 79 LEU CA . 53525 1 191 . 1 . 1 79 79 LEU CB C 13 40.7910 0.0000 . 1 . . . . . 79 LEU CB . 53525 1 192 . 1 . 1 79 79 LEU N N 15 120.8390 0.0000 . 1 . . . . . 79 LEU N . 53525 1 193 . 1 . 1 80 80 CYS H H 1 7.7900 0.0000 . 1 . . . . . 80 CYS H . 53525 1 194 . 1 . 1 80 80 CYS CA C 13 64.6650 0.0000 . 1 . . . . . 80 CYS CA . 53525 1 195 . 1 . 1 80 80 CYS CB C 13 26.6970 0.0000 . 1 . . . . . 80 CYS CB . 53525 1 196 . 1 . 1 80 80 CYS N N 15 116.2270 0.0000 . 1 . . . . . 80 CYS N . 53525 1 197 . 1 . 1 81 81 LYS H H 1 8.2690 0.0000 . 1 . . . . . 81 LYS H . 53525 1 198 . 1 . 1 81 81 LYS CA C 13 59.3010 0.0000 . 1 . . . . . 81 LYS CA . 53525 1 199 . 1 . 1 81 81 LYS CB C 13 33.1130 0.0000 . 1 . . . . . 81 LYS CB . 53525 1 200 . 1 . 1 81 81 LYS N N 15 122.3360 0.0000 . 1 . . . . . 81 LYS N . 53525 1 201 . 1 . 1 82 82 ASP H H 1 9.5250 0.0000 . 1 . . . . . 82 ASP H . 53525 1 202 . 1 . 1 82 82 ASP CA C 13 58.0390 0.0000 . 1 . . . . . 82 ASP CA . 53525 1 203 . 1 . 1 82 82 ASP CB C 13 40.6860 0.0000 . 1 . . . . . 82 ASP CB . 53525 1 204 . 1 . 1 82 82 ASP N N 15 123.4350 0.0000 . 1 . . . . . 82 ASP N . 53525 1 205 . 1 . 1 83 83 CYS H H 1 7.9960 0.0000 . 1 . . . . . 83 CYS H . 53525 1 206 . 1 . 1 83 83 CYS CA C 13 59.7220 0.0000 . 1 . . . . . 83 CYS CA . 53525 1 207 . 1 . 1 83 83 CYS CB C 13 27.7490 0.0000 . 1 . . . . . 83 CYS CB . 53525 1 208 . 1 . 1 83 83 CYS N N 15 112.8800 0.0000 . 1 . . . . . 83 CYS N . 53525 1 209 . 1 . 1 84 84 GLN H H 1 7.5030 0.0000 . 1 . . . . . 84 GLN H . 53525 1 210 . 1 . 1 84 84 GLN CA C 13 57.5140 0.0000 . 1 . . . . . 84 GLN CA . 53525 1 211 . 1 . 1 84 84 GLN CB C 13 25.2250 0.0000 . 1 . . . . . 84 GLN CB . 53525 1 212 . 1 . 1 84 84 GLN N N 15 109.3630 0.0000 . 1 . . . . . 84 GLN N . 53525 1 213 . 1 . 1 85 85 VAL H H 1 8.8810 0.0000 . 1 . . . . . 85 VAL H . 53525 1 214 . 1 . 1 85 85 VAL CA C 13 66.8740 0.0000 . 1 . . . . . 85 VAL CA . 53525 1 215 . 1 . 1 85 85 VAL CB C 13 31.5960 0.0000 . 1 . . . . . 85 VAL CB . 53525 1 216 . 1 . 1 85 85 VAL N N 15 118.9130 0.0000 . 1 . . . . . 85 VAL N . 53525 1 217 . 1 . 1 86 86 ILE H H 1 6.6050 0.0000 . 1 . . . . . 86 ILE H . 53525 1 218 . 1 . 1 86 86 ILE CA C 13 61.8260 0.0000 . 1 . . . . . 86 ILE CA . 53525 1 219 . 1 . 1 86 86 ILE CB C 13 39.8440 0.0000 . 1 . . . . . 86 ILE CB . 53525 1 220 . 1 . 1 86 86 ILE N N 15 114.3740 0.0000 . 1 . . . . . 86 ILE N . 53525 1 221 . 1 . 1 87 87 ASP H H 1 8.4130 0.0000 . 1 . . . . . 87 ASP H . 53525 1 222 . 1 . 1 87 87 ASP CA C 13 52.7810 0.0000 . 1 . . . . . 87 ASP CA . 53525 1 223 . 1 . 1 87 87 ASP CB C 13 41.5270 0.0000 . 1 . . . . . 87 ASP CB . 53525 1 224 . 1 . 1 87 87 ASP N N 15 125.9280 0.0000 . 1 . . . . . 87 ASP N . 53525 1 225 . 1 . 1 88 88 GLY H H 1 8.1460 0.0000 . 1 . . . . . 88 GLY H . 53525 1 226 . 1 . 1 88 88 GLY CA C 13 46.3650 0.0000 . 1 . . . . . 88 GLY CA . 53525 1 227 . 1 . 1 88 88 GLY N N 15 109.1990 0.0000 . 1 . . . . . 88 GLY N . 53525 1 228 . 1 . 1 89 89 ARG H H 1 7.9270 0.0000 . 1 . . . . . 89 ARG H . 53525 1 229 . 1 . 1 89 89 ARG CA C 13 57.5140 0.0000 . 1 . . . . . 89 ARG CA . 53525 1 230 . 1 . 1 89 89 ARG CB C 13 33.0080 0.0000 . 1 . . . . . 89 ARG CB . 53525 1 231 . 1 . 1 89 89 ARG N N 15 120.1010 0.0000 . 1 . . . . . 89 ARG N . 53525 1 232 . 1 . 1 90 90 ASN H H 1 9.7600 0.0000 . 1 . . . . . 90 ASN H . 53525 1 233 . 1 . 1 90 90 ASN CA C 13 55.6200 0.0000 . 1 . . . . . 90 ASN CA . 53525 1 234 . 1 . 1 90 90 ASN CB C 13 40.5800 0.0000 . 1 . . . . . 90 ASN CB . 53525 1 235 . 1 . 1 90 90 ASN N N 15 121.3380 0.0000 . 1 . . . . . 90 ASN N . 53525 1 236 . 1 . 1 91 91 VAL H H 1 8.4560 0.0000 . 1 . . . . . 91 VAL H . 53525 1 237 . 1 . 1 91 91 VAL CA C 13 61.3000 0.0000 . 1 . . . . . 91 VAL CA . 53525 1 238 . 1 . 1 91 91 VAL CB C 13 34.7960 0.0000 . 1 . . . . . 91 VAL CB . 53525 1 239 . 1 . 1 91 91 VAL N N 15 118.3270 0.0000 . 1 . . . . . 91 VAL N . 53525 1 240 . 1 . 1 92 92 THR H H 1 9.5150 0.0000 . 1 . . . . . 92 THR H . 53525 1 241 . 1 . 1 92 92 THR CA C 13 59.6170 0.0000 . 1 . . . . . 92 THR CA . 53525 1 242 . 1 . 1 92 92 THR CB C 13 72.7640 0.0000 . 1 . . . . . 92 THR CB . 53525 1 243 . 1 . 1 92 92 THR N N 15 119.2900 0.0000 . 1 . . . . . 92 THR N . 53525 1 244 . 1 . 1 93 93 VAL H H 1 8.8890 0.0000 . 1 . . . . . 93 VAL H . 53525 1 245 . 1 . 1 93 93 VAL CA C 13 66.0330 0.0000 . 1 . . . . . 93 VAL CA . 53525 1 246 . 1 . 1 93 93 VAL CB C 13 31.7460 0.0000 . 1 . . . . . 93 VAL CB . 53525 1 247 . 1 . 1 93 93 VAL N N 15 118.5590 0.0000 . 1 . . . . . 93 VAL N . 53525 1 248 . 1 . 1 94 94 THR H H 1 7.5150 0.0000 . 1 . . . . . 94 THR H . 53525 1 249 . 1 . 1 94 94 THR CA C 13 66.3480 0.0000 . 1 . . . . . 94 THR CA . 53525 1 250 . 1 . 1 94 94 THR CB C 13 68.6620 0.0000 . 1 . . . . . 94 THR CB . 53525 1 251 . 1 . 1 94 94 THR N N 15 115.3040 0.0000 . 1 . . . . . 94 THR N . 53525 1 252 . 1 . 1 95 95 ASP H H 1 7.4150 0.0000 . 1 . . . . . 95 ASP H . 53525 1 253 . 1 . 1 95 95 ASP CA C 13 58.2500 0.0000 . 1 . . . . . 95 ASP CA . 53525 1 254 . 1 . 1 95 95 ASP CB C 13 41.8430 0.0000 . 1 . . . . . 95 ASP CB . 53525 1 255 . 1 . 1 95 95 ASP N N 15 120.0440 0.0000 . 1 . . . . . 95 ASP N . 53525 1 256 . 1 . 1 96 96 VAL H H 1 7.4420 0.0000 . 1 . . . . . 96 VAL H . 53525 1 257 . 1 . 1 96 96 VAL CA C 13 66.2430 0.0000 . 1 . . . . . 96 VAL CA . 53525 1 258 . 1 . 1 96 96 VAL CB C 13 31.4300 0.0000 . 1 . . . . . 96 VAL CB . 53525 1 259 . 1 . 1 96 96 VAL N N 15 116.3170 0.0000 . 1 . . . . . 96 VAL N . 53525 1 260 . 1 . 1 97 97 ASP CA C 13 55.8310 0.0000 . 1 . . . . . 97 ASP CA . 53525 1 261 . 1 . 1 97 97 ASP CB C 13 40.3700 0.0000 . 1 . . . . . 97 ASP CB . 53525 1 262 . 1 . 1 98 98 ILE H H 1 8.4250 0.0000 . 1 . . . . . 98 ILE H . 53525 1 263 . 1 . 1 98 98 ILE CA C 13 65.0860 0.0000 . 1 . . . . . 98 ILE CA . 53525 1 264 . 1 . 1 98 98 ILE CB C 13 37.8460 0.0000 . 1 . . . . . 98 ILE CB . 53525 1 265 . 1 . 1 98 98 ILE N N 15 122.3810 0.0000 . 1 . . . . . 98 ILE N . 53525 1 266 . 1 . 1 99 99 VAL H H 1 8.0370 0.0000 . 1 . . . . . 99 VAL H . 53525 1 267 . 1 . 1 99 99 VAL CA C 13 66.5590 0.0000 . 1 . . . . . 99 VAL CA . 53525 1 268 . 1 . 1 99 99 VAL CB C 13 31.8510 0.0000 . 1 . . . . . 99 VAL CB . 53525 1 269 . 1 . 1 99 99 VAL N N 15 119.6280 0.0000 . 1 . . . . . 99 VAL N . 53525 1 270 . 1 . 1 100 100 PHE H H 1 7.6290 0.0000 . 1 . . . . . 100 PHE H . 53525 1 271 . 1 . 1 100 100 PHE CA C 13 62.6670 0.0000 . 1 . . . . . 100 PHE CA . 53525 1 272 . 1 . 1 100 100 PHE CB C 13 39.4240 0.0000 . 1 . . . . . 100 PHE CB . 53525 1 273 . 1 . 1 100 100 PHE N N 15 120.3610 0.0000 . 1 . . . . . 100 PHE N . 53525 1 274 . 1 . 1 101 101 SER H H 1 7.8360 0.0000 . 1 . . . . . 101 SER H . 53525 1 275 . 1 . 1 101 101 SER CA C 13 61.6150 0.0000 . 1 . . . . . 101 SER CA . 53525 1 276 . 1 . 1 101 101 SER CB C 13 63.6140 0.0000 . 1 . . . . . 101 SER CB . 53525 1 277 . 1 . 1 101 101 SER N N 15 110.7020 0.0000 . 1 . . . . . 101 SER N . 53525 1 278 . 1 . 1 102 102 LYS H H 1 7.8640 0.0000 . 1 . . . . . 102 LYS H . 53525 1 279 . 1 . 1 102 102 LYS CA C 13 58.5650 0.0000 . 1 . . . . . 102 LYS CA . 53525 1 280 . 1 . 1 102 102 LYS CB C 13 33.1130 0.0000 . 1 . . . . . 102 LYS CB . 53525 1 281 . 1 . 1 102 102 LYS N N 15 120.3150 0.0000 . 1 . . . . . 102 LYS N . 53525 1 282 . 1 . 1 103 103 ILE H H 1 7.5950 0.0000 . 1 . . . . . 103 ILE H . 53525 1 283 . 1 . 1 103 103 ILE CA C 13 61.1950 0.0000 . 1 . . . . . 103 ILE CA . 53525 1 284 . 1 . 1 103 103 ILE CB C 13 38.3720 0.0000 . 1 . . . . . 103 ILE CB . 53525 1 285 . 1 . 1 103 103 ILE N N 15 118.0430 0.0000 . 1 . . . . . 103 ILE N . 53525 1 286 . 1 . 1 104 104 LYS H H 1 7.4540 0.0000 . 1 . . . . . 104 LYS H . 53525 1 287 . 1 . 1 104 104 LYS CA C 13 56.7770 0.0000 . 1 . . . . . 104 LYS CA . 53525 1 288 . 1 . 1 104 104 LYS CB C 13 32.2720 0.0000 . 1 . . . . . 104 LYS CB . 53525 1 289 . 1 . 1 104 104 LYS N N 15 119.1080 0.0000 . 1 . . . . . 104 LYS N . 53525 1 290 . 1 . 1 105 105 GLY H H 1 8.1180 0.0000 . 1 . . . . . 105 GLY H . 53525 1 291 . 1 . 1 105 105 GLY CA C 13 45.4180 0.0000 . 1 . . . . . 105 GLY CA . 53525 1 292 . 1 . 1 105 105 GLY N N 15 107.5170 0.0000 . 1 . . . . . 105 GLY N . 53525 1 293 . 1 . 1 109 109 ARG CA C 13 56.5670 0.0000 . 1 . . . . . 109 ARG CA . 53525 1 294 . 1 . 1 109 109 ARG CB C 13 31.9560 0.0000 . 1 . . . . . 109 ARG CB . 53525 1 295 . 1 . 1 110 110 THR H H 1 7.4910 0.0000 . 1 . . . . . 110 THR H . 53525 1 296 . 1 . 1 110 110 THR CA C 13 58.8810 0.0000 . 1 . . . . . 110 THR CA . 53525 1 297 . 1 . 1 110 110 THR CB C 13 73.0790 0.0000 . 1 . . . . . 110 THR CB . 53525 1 298 . 1 . 1 110 110 THR N N 15 108.2280 0.0000 . 1 . . . . . 110 THR N . 53525 1 299 . 1 . 1 111 111 ILE H H 1 8.6850 0.0000 . 1 . . . . . 111 ILE H . 53525 1 300 . 1 . 1 111 111 ILE CA C 13 59.1960 0.0000 . 1 . . . . . 111 ILE CA . 53525 1 301 . 1 . 1 111 111 ILE CB C 13 41.7370 0.0000 . 1 . . . . . 111 ILE CB . 53525 1 302 . 1 . 1 111 111 ILE N N 15 109.5030 0.0000 . 1 . . . . . 111 ILE N . 53525 1 303 . 1 . 1 112 112 THR H H 1 8.2910 0.0000 . 1 . . . . . 112 THR H . 53525 1 304 . 1 . 1 112 112 THR CA C 13 60.0380 0.0000 . 1 . . . . . 112 THR CA . 53525 1 305 . 1 . 1 112 112 THR CB C 13 72.3430 0.0000 . 1 . . . . . 112 THR CB . 53525 1 306 . 1 . 1 112 112 THR N N 15 111.0540 0.0000 . 1 . . . . . 112 THR N . 53525 1 307 . 1 . 1 113 113 PHE H H 1 9.3930 0.0000 . 1 . . . . . 113 PHE H . 53525 1 308 . 1 . 1 113 113 PHE CA C 13 60.1430 0.0000 . 1 . . . . . 113 PHE CA . 53525 1 309 . 1 . 1 113 113 PHE CB C 13 38.8980 0.0000 . 1 . . . . . 113 PHE CB . 53525 1 310 . 1 . 1 113 113 PHE N N 15 121.4360 0.0000 . 1 . . . . . 113 PHE N . 53525 1 311 . 1 . 1 114 114 GLU H H 1 8.6920 0.0000 . 1 . . . . . 114 GLU H . 53525 1 312 . 1 . 1 114 114 GLU CA C 13 60.7740 0.0000 . 1 . . . . . 114 GLU CA . 53525 1 313 . 1 . 1 114 114 GLU CB C 13 29.0110 0.0000 . 1 . . . . . 114 GLU CB . 53525 1 314 . 1 . 1 114 114 GLU N N 15 119.4500 0.0000 . 1 . . . . . 114 GLU N . 53525 1 315 . 1 . 1 115 115 GLN H H 1 7.1910 0.0000 . 1 . . . . . 115 GLN H . 53525 1 316 . 1 . 1 115 115 GLN CA C 13 58.2500 0.0000 . 1 . . . . . 115 GLN CA . 53525 1 317 . 1 . 1 115 115 GLN CB C 13 29.5370 0.0000 . 1 . . . . . 115 GLN CB . 53525 1 318 . 1 . 1 115 115 GLN N N 15 119.7100 0.0000 . 1 . . . . . 115 GLN N . 53525 1 319 . 1 . 1 116 116 PHE H H 1 8.7030 0.0000 . 1 . . . . . 116 PHE H . 53525 1 320 . 1 . 1 116 116 PHE CA C 13 60.3530 0.0000 . 1 . . . . . 116 PHE CA . 53525 1 321 . 1 . 1 116 116 PHE CB C 13 39.5290 0.0000 . 1 . . . . . 116 PHE CB . 53525 1 322 . 1 . 1 116 116 PHE N N 15 121.7380 0.0000 . 1 . . . . . 116 PHE N . 53525 1 323 . 1 . 1 117 117 GLN H H 1 7.7250 0.0000 . 1 . . . . . 117 GLN H . 53525 1 324 . 1 . 1 117 117 GLN CA C 13 60.3530 0.0000 . 1 . . . . . 117 GLN CA . 53525 1 325 . 1 . 1 117 117 GLN CB C 13 30.0630 0.0000 . 1 . . . . . 117 GLN CB . 53525 1 326 . 1 . 1 117 117 GLN N N 15 117.0870 0.0000 . 1 . . . . . 117 GLN N . 53525 1 327 . 1 . 1 118 118 GLU H H 1 7.1560 0.0000 . 1 . . . . . 118 GLU H . 53525 1 328 . 1 . 1 118 118 GLU CA C 13 59.6170 0.0000 . 1 . . . . . 118 GLU CA . 53525 1 329 . 1 . 1 118 118 GLU CB C 13 29.6420 0.0000 . 1 . . . . . 118 GLU CB . 53525 1 330 . 1 . 1 118 118 GLU N N 15 120.6290 0.0000 . 1 . . . . . 118 GLU N . 53525 1 331 . 1 . 1 119 119 ALA H H 1 7.6400 0.0000 . 1 . . . . . 119 ALA H . 53525 1 332 . 1 . 1 119 119 ALA CA C 13 56.0410 0.0000 . 1 . . . . . 119 ALA CA . 53525 1 333 . 1 . 1 119 119 ALA CB C 13 19.5460 0.0000 . 1 . . . . . 119 ALA CB . 53525 1 334 . 1 . 1 119 119 ALA N N 15 121.1770 0.0000 . 1 . . . . . 119 ALA N . 53525 1 335 . 1 . 1 120 120 LEU H H 1 8.5300 0.0000 . 1 . . . . . 120 LEU H . 53525 1 336 . 1 . 1 120 120 LEU CA C 13 51.5680 0.0000 . 1 . . . . . 120 LEU CA . 53525 1 337 . 1 . 1 120 120 LEU CB C 13 39.1080 0.0000 . 1 . . . . . 120 LEU CB . 53525 1 338 . 1 . 1 120 120 LEU N N 15 118.3860 0.0000 . 1 . . . . . 120 LEU N . 53525 1 339 . 1 . 1 121 121 GLU CA C 13 60.3530 0.0000 . 1 . . . . . 121 GLU CA . 53525 1 340 . 1 . 1 121 121 GLU CB C 13 28.8010 0.0000 . 1 . . . . . 121 GLU CB . 53525 1 341 . 1 . 1 122 122 GLU H H 1 7.4580 0.0000 . 1 . . . . . 122 GLU H . 53525 1 342 . 1 . 1 122 122 GLU CA C 13 59.4070 0.0000 . 1 . . . . . 122 GLU CA . 53525 1 343 . 1 . 1 122 122 GLU CB C 13 29.4320 0.0000 . 1 . . . . . 122 GLU CB . 53525 1 344 . 1 . 1 122 122 GLU N N 15 117.7670 0.0000 . 1 . . . . . 122 GLU N . 53525 1 345 . 1 . 1 123 123 LEU H H 1 7.9270 0.0000 . 1 . . . . . 123 LEU H . 53525 1 346 . 1 . 1 123 123 LEU CA C 13 56.9880 0.0000 . 1 . . . . . 123 LEU CA . 53525 1 347 . 1 . 1 123 123 LEU CB C 13 42.4740 0.0000 . 1 . . . . . 123 LEU CB . 53525 1 348 . 1 . 1 123 123 LEU N N 15 116.6560 0.0000 . 1 . . . . . 123 LEU N . 53525 1 349 . 1 . 1 124 124 ALA H H 1 8.7740 0.0000 . 1 . . . . . 124 ALA H . 53525 1 350 . 1 . 1 124 124 ALA CA C 13 56.3570 0.0000 . 1 . . . . . 124 ALA CA . 53525 1 351 . 1 . 1 124 124 ALA CB C 13 18.7040 0.0000 . 1 . . . . . 124 ALA CB . 53525 1 352 . 1 . 1 124 124 ALA N N 15 122.8120 0.0000 . 1 . . . . . 124 ALA N . 53525 1 353 . 1 . 1 125 125 LYS H H 1 7.1930 0.0000 . 1 . . . . . 125 LYS H . 53525 1 354 . 1 . 1 125 125 LYS CA C 13 58.2500 0.0000 . 1 . . . . . 125 LYS CA . 53525 1 355 . 1 . 1 125 125 LYS CB C 13 32.4820 0.0000 . 1 . . . . . 125 LYS CB . 53525 1 356 . 1 . 1 125 125 LYS N N 15 113.0990 0.0000 . 1 . . . . . 125 LYS N . 53525 1 357 . 1 . 1 126 126 LYS H H 1 6.9290 0.0000 . 1 . . . . . 126 LYS H . 53525 1 358 . 1 . 1 126 126 LYS CA C 13 57.8290 0.0000 . 1 . . . . . 126 LYS CA . 53525 1 359 . 1 . 1 126 126 LYS CB C 13 34.0600 0.0000 . 1 . . . . . 126 LYS CB . 53525 1 360 . 1 . 1 126 126 LYS N N 15 115.6110 0.0000 . 1 . . . . . 126 LYS N . 53525 1 361 . 1 . 1 127 127 ARG H H 1 8.0940 0.0000 . 1 . . . . . 127 ARG H . 53525 1 362 . 1 . 1 127 127 ARG CA C 13 56.4620 0.0000 . 1 . . . . . 127 ARG CA . 53525 1 363 . 1 . 1 127 127 ARG CB C 13 30.9040 0.0000 . 1 . . . . . 127 ARG CB . 53525 1 364 . 1 . 1 127 127 ARG N N 15 117.5160 0.0000 . 1 . . . . . 127 ARG N . 53525 1 365 . 1 . 1 128 128 PHE H H 1 7.7140 0.0000 . 1 . . . . . 128 PHE H . 53525 1 366 . 1 . 1 128 128 PHE CA C 13 56.0410 0.0000 . 1 . . . . . 128 PHE CA . 53525 1 367 . 1 . 1 128 128 PHE CB C 13 39.1080 0.0000 . 1 . . . . . 128 PHE CB . 53525 1 368 . 1 . 1 128 128 PHE N N 15 117.4710 0.0000 . 1 . . . . . 128 PHE N . 53525 1 369 . 1 . 1 129 129 LYS H H 1 7.9200 0.0000 . 1 . . . . . 129 LYS H . 53525 1 370 . 1 . 1 129 129 LYS CA C 13 58.5650 0.0000 . 1 . . . . . 129 LYS CA . 53525 1 371 . 1 . 1 129 129 LYS CB C 13 32.6920 0.0000 . 1 . . . . . 129 LYS CB . 53525 1 372 . 1 . 1 129 129 LYS N N 15 120.0800 0.0000 . 1 . . . . . 129 LYS N . 53525 1 373 . 1 . 1 130 130 ASP H H 1 8.7650 0.0000 . 1 . . . . . 130 ASP H . 53525 1 374 . 1 . 1 130 130 ASP CA C 13 53.9380 0.0000 . 1 . . . . . 130 ASP CA . 53525 1 375 . 1 . 1 130 130 ASP CB C 13 40.2650 0.0000 . 1 . . . . . 130 ASP CB . 53525 1 376 . 1 . 1 130 130 ASP N N 15 115.6810 0.0000 . 1 . . . . . 130 ASP N . 53525 1 377 . 1 . 1 131 131 LYS H H 1 7.2680 0.0000 . 1 . . . . . 131 LYS H . 53525 1 378 . 1 . 1 131 131 LYS CA C 13 54.4630 0.0000 . 1 . . . . . 131 LYS CA . 53525 1 379 . 1 . 1 131 131 LYS CB C 13 35.5320 0.0000 . 1 . . . . . 131 LYS CB . 53525 1 380 . 1 . 1 131 131 LYS N N 15 118.5810 0.0000 . 1 . . . . . 131 LYS N . 53525 1 381 . 1 . 1 132 132 SER H H 1 8.7030 0.0000 . 1 . . . . . 132 SER H . 53525 1 382 . 1 . 1 132 132 SER CA C 13 58.0390 0.0000 . 1 . . . . . 132 SER CA . 53525 1 383 . 1 . 1 132 132 SER CB C 13 64.2450 0.0000 . 1 . . . . . 132 SER CB . 53525 1 384 . 1 . 1 132 132 SER N N 15 117.5260 0.0000 . 1 . . . . . 132 SER N . 53525 1 385 . 1 . 1 133 133 SER H H 1 8.9390 0.0000 . 1 . . . . . 133 SER H . 53525 1 386 . 1 . 1 133 133 SER CA C 13 62.5610 0.0000 . 1 . . . . . 133 SER CA . 53525 1 387 . 1 . 1 133 133 SER CB C 13 64.9290 0.0000 . 1 . . . . . 133 SER CB . 53525 1 388 . 1 . 1 133 133 SER N N 15 117.6330 0.0000 . 1 . . . . . 133 SER N . 53525 1 389 . 1 . 1 134 134 GLU H H 1 8.6210 0.0000 . 1 . . . . . 134 GLU H . 53525 1 390 . 1 . 1 134 134 GLU CA C 13 59.7270 0.0000 . 1 . . . . . 134 GLU CA . 53525 1 391 . 1 . 1 134 134 GLU CB C 13 29.4320 0.0000 . 1 . . . . . 134 GLU CB . 53525 1 392 . 1 . 1 134 134 GLU N N 15 118.7100 0.0000 . 1 . . . . . 134 GLU N . 53525 1 393 . 1 . 1 135 135 GLU H H 1 7.5070 0.0000 . 1 . . . . . 135 GLU H . 53525 1 394 . 1 . 1 135 135 GLU CA C 13 58.7760 0.0000 . 1 . . . . . 135 GLU CA . 53525 1 395 . 1 . 1 135 135 GLU CB C 13 30.3790 0.0000 . 1 . . . . . 135 GLU CB . 53525 1 396 . 1 . 1 135 135 GLU N N 15 119.8870 0.0000 . 1 . . . . . 135 GLU N . 53525 1 397 . 1 . 1 136 136 ALA H H 1 8.9470 0.0000 . 1 . . . . . 136 ALA H . 53525 1 398 . 1 . 1 136 136 ALA CA C 13 55.7260 0.0000 . 1 . . . . . 136 ALA CA . 53525 1 399 . 1 . 1 136 136 ALA CB C 13 18.8090 0.0000 . 1 . . . . . 136 ALA CB . 53525 1 400 . 1 . 1 136 136 ALA N N 15 122.8550 0.0000 . 1 . . . . . 136 ALA N . 53525 1 401 . 1 . 1 137 137 VAL H H 1 7.8400 0.0000 . 1 . . . . . 137 VAL H . 53525 1 402 . 1 . 1 137 137 VAL CA C 13 66.7690 0.0000 . 1 . . . . . 137 VAL CA . 53525 1 403 . 1 . 1 137 137 VAL CB C 13 31.3250 0.0000 . 1 . . . . . 137 VAL CB . 53525 1 404 . 1 . 1 137 137 VAL N N 15 116.8440 0.0000 . 1 . . . . . 137 VAL N . 53525 1 405 . 1 . 1 138 138 ARG H H 1 7.1530 0.0000 . 1 . . . . . 138 ARG H . 53525 1 406 . 1 . 1 138 138 ARG CA C 13 59.4070 0.0000 . 1 . . . . . 138 ARG CA . 53525 1 407 . 1 . 1 138 138 ARG CB C 13 29.7480 0.0000 . 1 . . . . . 138 ARG CB . 53525 1 408 . 1 . 1 138 138 ARG N N 15 118.4610 0.0000 . 1 . . . . . 138 ARG N . 53525 1 409 . 1 . 1 139 139 GLU H H 1 7.9550 0.0000 . 1 . . . . . 139 GLU H . 53525 1 410 . 1 . 1 139 139 GLU CA C 13 58.5650 0.0000 . 1 . . . . . 139 GLU CA . 53525 1 411 . 1 . 1 139 139 GLU CB C 13 27.8540 0.0000 . 1 . . . . . 139 GLU CB . 53525 1 412 . 1 . 1 139 139 GLU N N 15 117.6130 0.0000 . 1 . . . . . 139 GLU N . 53525 1 413 . 1 . 1 140 140 VAL H H 1 8.0340 0.0000 . 1 . . . . . 140 VAL H . 53525 1 414 . 1 . 1 140 140 VAL CA C 13 66.7690 0.0000 . 1 . . . . . 140 VAL CA . 53525 1 415 . 1 . 1 140 140 VAL CB C 13 31.3250 0.0000 . 1 . . . . . 140 VAL CB . 53525 1 416 . 1 . 1 140 140 VAL N N 15 120.7650 0.0000 . 1 . . . . . 140 VAL N . 53525 1 417 . 1 . 1 141 141 HIS H H 1 8.6440 0.0000 . 1 . . . . . 141 HIS H . 53525 1 418 . 1 . 1 141 141 HIS CA C 13 58.9860 0.0000 . 1 . . . . . 141 HIS CA . 53525 1 419 . 1 . 1 141 141 HIS CB C 13 30.3790 0.0000 . 1 . . . . . 141 HIS CB . 53525 1 420 . 1 . 1 141 141 HIS N N 15 119.7730 0.0000 . 1 . . . . . 141 HIS N . 53525 1 421 . 1 . 1 142 142 ARG H H 1 8.1260 0.0000 . 1 . . . . . 142 ARG H . 53525 1 422 . 1 . 1 142 142 ARG CA C 13 58.9860 0.0000 . 1 . . . . . 142 ARG CA . 53525 1 423 . 1 . 1 142 142 ARG CB C 13 30.3790 0.0000 . 1 . . . . . 142 ARG CB . 53525 1 424 . 1 . 1 142 142 ARG N N 15 118.2150 0.0000 . 1 . . . . . 142 ARG N . 53525 1 425 . 1 . 1 143 143 LEU H H 1 7.5370 0.0000 . 1 . . . . . 143 LEU H . 53525 1 426 . 1 . 1 143 143 LEU CA C 13 57.1980 0.0000 . 1 . . . . . 143 LEU CA . 53525 1 427 . 1 . 1 143 143 LEU CB C 13 41.1060 0.0000 . 1 . . . . . 143 LEU CB . 53525 1 428 . 1 . 1 143 143 LEU N N 15 117.7760 0.0000 . 1 . . . . . 143 LEU N . 53525 1 429 . 1 . 1 144 144 ILE H H 1 7.1870 0.0000 . 1 . . . . . 144 ILE H . 53525 1 430 . 1 . 1 144 144 ILE CA C 13 62.3520 0.0000 . 1 . . . . . 144 ILE CA . 53525 1 431 . 1 . 1 144 144 ILE CB C 13 41.5270 0.0000 . 1 . . . . . 144 ILE CB . 53525 1 432 . 1 . 1 144 144 ILE N N 15 117.2830 0.0000 . 1 . . . . . 144 ILE N . 53525 1 433 . 1 . 1 145 145 GLU H H 1 8.0700 0.0000 . 1 . . . . . 145 GLU H . 53525 1 434 . 1 . 1 145 145 GLU CA C 13 59.1960 0.0000 . 1 . . . . . 145 GLU CA . 53525 1 435 . 1 . 1 145 145 GLU CB C 13 29.8530 0.0000 . 1 . . . . . 145 GLU CB . 53525 1 436 . 1 . 1 145 145 GLU N N 15 117.4430 0.0000 . 1 . . . . . 145 GLU N . 53525 1 437 . 1 . 1 146 146 GLY H H 1 8.8860 0.0000 . 1 . . . . . 146 GLY H . 53525 1 438 . 1 . 1 146 146 GLY CA C 13 45.4180 0.0000 . 1 . . . . . 146 GLY CA . 53525 1 439 . 1 . 1 146 146 GLY N N 15 109.8170 0.0000 . 1 . . . . . 146 GLY N . 53525 1 440 . 1 . 1 147 147 LYS H H 1 7.9390 0.0000 . 1 . . . . . 147 LYS H . 53525 1 441 . 1 . 1 147 147 LYS CA C 13 55.3050 0.0000 . 1 . . . . . 147 LYS CA . 53525 1 442 . 1 . 1 147 147 LYS CB C 13 33.7440 0.0000 . 1 . . . . . 147 LYS CB . 53525 1 443 . 1 . 1 147 147 LYS N N 15 119.3000 0.0000 . 1 . . . . . 147 LYS N . 53525 1 444 . 1 . 1 148 148 ALA H H 1 7.9140 0.0000 . 1 . . . . . 148 ALA H . 53525 1 445 . 1 . 1 148 148 ALA CA C 13 49.7310 0.0000 . 1 . . . . . 148 ALA CA . 53525 1 446 . 1 . 1 148 148 ALA CB C 13 20.3870 0.0000 . 1 . . . . . 148 ALA CB . 53525 1 447 . 1 . 1 148 148 ALA N N 15 121.1650 0.0000 . 1 . . . . . 148 ALA N . 53525 1 448 . 1 . 1 149 149 PRO CA C 13 62.0360 0.0000 . 1 . . . . . 149 PRO CA . 53525 1 449 . 1 . 1 149 149 PRO CB C 13 31.1150 0.0000 . 1 . . . . . 149 PRO CB . 53525 1 450 . 1 . 1 150 150 ILE H H 1 8.5350 0.0000 . 1 . . . . . 150 ILE H . 53525 1 451 . 1 . 1 150 150 ILE CA C 13 61.4050 0.0000 . 1 . . . . . 150 ILE CA . 53525 1 452 . 1 . 1 150 150 ILE CB C 13 38.4770 0.0000 . 1 . . . . . 150 ILE CB . 53525 1 453 . 1 . 1 150 150 ILE N N 15 125.5170 0.0000 . 1 . . . . . 150 ILE N . 53525 1 454 . 1 . 1 151 151 ILE H H 1 8.5550 0.0000 . 1 . . . . . 151 ILE H . 53525 1 455 . 1 . 1 151 151 ILE CA C 13 60.5640 0.0000 . 1 . . . . . 151 ILE CA . 53525 1 456 . 1 . 1 151 151 ILE CB C 13 38.4770 0.0000 . 1 . . . . . 151 ILE CB . 53525 1 457 . 1 . 1 151 151 ILE N N 15 128.7000 0.0000 . 1 . . . . . 151 ILE N . 53525 1 458 . 1 . 1 153 153 GLY CA C 13 43.1050 0.0000 . 1 . . . . . 153 GLY CA . 53525 1 459 . 1 . 1 154 154 VAL H H 1 7.9910 0.0000 . 1 . . . . . 154 VAL H . 53525 1 460 . 1 . 1 154 154 VAL CA C 13 62.5620 0.0000 . 1 . . . . . 154 VAL CA . 53525 1 461 . 1 . 1 154 154 VAL CB C 13 32.9030 0.0000 . 1 . . . . . 154 VAL CB . 53525 1 462 . 1 . 1 154 154 VAL N N 15 119.2990 0.0000 . 1 . . . . . 154 VAL N . 53525 1 463 . 1 . 1 155 155 THR H H 1 8.2620 0.0000 . 1 . . . . . 155 THR H . 53525 1 464 . 1 . 1 155 155 THR CA C 13 62.0360 0.0000 . 1 . . . . . 155 THR CA . 53525 1 465 . 1 . 1 155 155 THR CB C 13 69.7140 0.0000 . 1 . . . . . 155 THR CB . 53525 1 466 . 1 . 1 155 155 THR N N 15 118.8950 0.0000 . 1 . . . . . 155 THR N . 53525 1 467 . 1 . 1 156 156 LYS CA C 13 56.2510 0.0000 . 1 . . . . . 156 LYS CA . 53525 1 468 . 1 . 1 156 156 LYS CB C 13 33.4290 0.0000 . 1 . . . . . 156 LYS CB . 53525 1 469 . 1 . 1 157 157 ALA H H 1 8.3030 0.0000 . 1 . . . . . 157 ALA H . 53525 1 470 . 1 . 1 157 157 ALA CA C 13 52.5700 0.0000 . 1 . . . . . 157 ALA CA . 53525 1 471 . 1 . 1 157 157 ALA CB C 13 19.3350 0.0000 . 1 . . . . . 157 ALA CB . 53525 1 472 . 1 . 1 157 157 ALA N N 15 125.9380 0.0000 . 1 . . . . . 157 ALA N . 53525 1 473 . 1 . 1 158 158 ILE H H 1 8.1390 0.0000 . 1 . . . . . 158 ILE H . 53525 1 474 . 1 . 1 158 158 ILE CA C 13 61.1950 0.0000 . 1 . . . . . 158 ILE CA . 53525 1 475 . 1 . 1 158 158 ILE CB C 13 39.1080 0.0000 . 1 . . . . . 158 ILE CB . 53525 1 476 . 1 . 1 158 158 ILE N N 15 120.4170 0.0000 . 1 . . . . . 158 ILE N . 53525 1 477 . 1 . 1 161 161 PRO CA C 13 63.2980 0.0000 . 1 . . . . . 161 PRO CA . 53525 1 478 . 1 . 1 161 161 PRO CB C 13 32.4820 0.0000 . 1 . . . . . 161 PRO CB . 53525 1 479 . 1 . 1 162 162 THR H H 1 8.2650 0.0000 . 1 . . . . . 162 THR H . 53525 1 480 . 1 . 1 162 162 THR CA C 13 62.0360 0.0000 . 1 . . . . . 162 THR CA . 53525 1 481 . 1 . 1 162 162 THR CB C 13 69.8190 0.0000 . 1 . . . . . 162 THR CB . 53525 1 482 . 1 . 1 162 162 THR N N 15 115.2650 0.0000 . 1 . . . . . 162 THR N . 53525 1 483 . 1 . 1 163 163 VAL H H 1 7.7090 0.0000 . 1 . . . . . 163 VAL H . 53525 1 484 . 1 . 1 163 163 VAL CA C 13 63.7190 0.0000 . 1 . . . . . 163 VAL CA . 53525 1 485 . 1 . 1 163 163 VAL CB C 13 33.4290 0.0000 . 1 . . . . . 163 VAL CB . 53525 1 486 . 1 . 1 163 163 VAL N N 15 126.4400 0.0000 . 1 . . . . . 163 VAL N . 53525 1 487 . 1 . 1 166 166 LEU CA C 13 56.4620 0.0000 . 1 . . . . . 166 LEU CA . 53525 1 488 . 1 . 1 166 166 LEU CB C 13 41.2120 0.0000 . 1 . . . . . 166 LEU CB . 53525 1 489 . 1 . 1 167 167 THR H H 1 8.2020 0.0000 . 1 . . . . . 167 THR H . 53525 1 490 . 1 . 1 167 167 THR CA C 13 62.0360 0.0000 . 1 . . . . . 167 THR CA . 53525 1 491 . 1 . 1 167 167 THR CB C 13 69.5030 0.0000 . 1 . . . . . 167 THR CB . 53525 1 492 . 1 . 1 167 167 THR N N 15 114.5160 0.0000 . 1 . . . . . 167 THR N . 53525 1 493 . 1 . 1 168 168 ASP CA C 13 54.8840 0.0000 . 1 . . . . . 168 ASP CA . 53525 1 494 . 1 . 1 168 168 ASP CB C 13 41.3170 0.0000 . 1 . . . . . 168 ASP CB . 53525 1 495 . 1 . 1 169 169 THR H H 1 8.1120 0.0000 . 1 . . . . . 169 THR H . 53525 1 496 . 1 . 1 169 169 THR CA C 13 61.8260 0.0000 . 1 . . . . . 169 THR CA . 53525 1 497 . 1 . 1 169 169 THR CB C 13 69.9240 0.0000 . 1 . . . . . 169 THR CB . 53525 1 498 . 1 . 1 169 169 THR N N 15 114.0230 0.0000 . 1 . . . . . 169 THR N . 53525 1 499 . 1 . 1 189 189 LYS CA C 13 56.3370 0.0000 . 1 . . . . . 189 LYS CA . 53525 1 500 . 1 . 1 189 189 LYS CB C 13 33.0030 0.0000 . 1 . . . . . 189 LYS CB . 53525 1 501 . 1 . 1 190 190 ALA H H 1 8.3070 0.0000 . 1 . . . . . 190 ALA H . 53525 1 502 . 1 . 1 190 190 ALA CA C 13 52.7540 0.0000 . 1 . . . . . 190 ALA CA . 53525 1 503 . 1 . 1 190 190 ALA CB C 13 19.0400 0.0000 . 1 . . . . . 190 ALA CB . 53525 1 504 . 1 . 1 190 190 ALA N N 15 125.0640 0.0000 . 1 . . . . . 190 ALA N . 53525 1 505 . 1 . 1 191 191 GLY H H 1 8.3690 0.0000 . 1 . . . . . 191 GLY H . 53525 1 506 . 1 . 1 191 191 GLY CA C 13 45.4050 0.0000 . 1 . . . . . 191 GLY CA . 53525 1 507 . 1 . 1 191 191 GLY N N 15 108.1180 0.0000 . 1 . . . . . 191 GLY N . 53525 1 508 . 1 . 1 192 192 ARG H H 1 8.0340 0.0000 . 1 . . . . . 192 ARG H . 53525 1 509 . 1 . 1 192 192 ARG CA C 13 56.1520 0.0000 . 1 . . . . . 192 ARG CA . 53525 1 510 . 1 . 1 192 192 ARG CB C 13 31.0730 0.0000 . 1 . . . . . 192 ARG CB . 53525 1 511 . 1 . 1 192 192 ARG N N 15 120.7610 0.0000 . 1 . . . . . 192 ARG N . 53525 1 512 . 1 . 1 193 193 VAL H H 1 7.9910 0.0000 . 1 . . . . . 193 VAL H . 53525 1 513 . 1 . 1 193 193 VAL CA C 13 62.1020 0.0000 . 1 . . . . . 193 VAL CA . 53525 1 514 . 1 . 1 193 193 VAL CB C 13 32.8500 0.0000 . 1 . . . . . 193 VAL CB . 53525 1 515 . 1 . 1 193 193 VAL N N 15 122.3770 0.0000 . 1 . . . . . 193 VAL N . 53525 1 516 . 1 . 1 194 194 ASP H H 1 8.3200 0.0000 . 1 . . . . . 194 ASP H . 53525 1 517 . 1 . 1 194 194 ASP CA C 13 53.9640 0.0000 . 1 . . . . . 194 ASP CA . 53525 1 518 . 1 . 1 194 194 ASP CB C 13 41.2080 0.0000 . 1 . . . . . 194 ASP CB . 53525 1 519 . 1 . 1 194 194 ASP N N 15 124.0300 0.0000 . 1 . . . . . 194 ASP N . 53525 1 520 . 1 . 1 195 195 LEU H H 1 8.0570 0.0000 . 1 . . . . . 195 LEU H . 53525 1 521 . 1 . 1 195 195 LEU CA C 13 55.1360 0.0000 . 1 . . . . . 195 LEU CA . 53525 1 522 . 1 . 1 195 195 LEU CB C 13 42.3070 0.0000 . 1 . . . . . 195 LEU CB . 53525 1 523 . 1 . 1 195 195 LEU N N 15 122.2910 0.0000 . 1 . . . . . 195 LEU N . 53525 1 524 . 1 . 1 196 196 VAL H H 1 8.0340 0.0000 . 1 . . . . . 196 VAL H . 53525 1 525 . 1 . 1 196 196 VAL CA C 13 62.1020 0.0000 . 1 . . . . . 196 VAL CA . 53525 1 526 . 1 . 1 196 196 VAL CB C 13 32.9230 0.0000 . 1 . . . . . 196 VAL CB . 53525 1 527 . 1 . 1 196 196 VAL N N 15 120.7680 0.0000 . 1 . . . . . 196 VAL N . 53525 1 528 . 1 . 1 197 197 ASP H H 1 8.4150 0.0000 . 1 . . . . . 197 ASP H . 53525 1 529 . 1 . 1 197 197 ASP CA C 13 54.1840 0.0000 . 1 . . . . . 197 ASP CA . 53525 1 530 . 1 . 1 197 197 ASP CB C 13 41.2080 0.0000 . 1 . . . . . 197 ASP CB . 53525 1 531 . 1 . 1 197 197 ASP N N 15 123.3650 0.0000 . 1 . . . . . 197 ASP N . 53525 1 532 . 1 . 1 198 198 GLU H H 1 8.5330 0.0000 . 1 . . . . . 198 GLU H . 53525 1 533 . 1 . 1 198 198 GLU CA C 13 56.9700 0.0000 . 1 . . . . . 198 GLU CA . 53525 1 534 . 1 . 1 198 198 GLU CB C 13 29.9910 0.0000 . 1 . . . . . 198 GLU CB . 53525 1 535 . 1 . 1 198 198 GLU N N 15 122.3930 0.0000 . 1 . . . . . 198 GLU N . 53525 1 536 . 1 . 1 199 199 SER H H 1 8.4100 0.0000 . 1 . . . . . 199 SER H . 53525 1 537 . 1 . 1 199 199 SER CA C 13 59.4610 0.0000 . 1 . . . . . 199 SER CA . 53525 1 538 . 1 . 1 199 199 SER CB C 13 63.8600 0.0000 . 1 . . . . . 199 SER CB . 53525 1 539 . 1 . 1 199 199 SER N N 15 116.3910 0.0000 . 1 . . . . . 199 SER N . 53525 1 540 . 1 . 1 200 200 GLY H H 1 8.2640 0.0000 . 1 . . . . . 200 GLY H . 53525 1 541 . 1 . 1 200 200 GLY CA C 13 45.3860 0.0000 . 1 . . . . . 200 GLY CA . 53525 1 542 . 1 . 1 200 200 GLY N N 15 110.1870 0.0000 . 1 . . . . . 200 GLY N . 53525 1 543 . 1 . 1 216 216 GLN CA C 13 56.7890 0.0000 . 1 . . . . . 216 GLN CA . 53525 1 544 . 1 . 1 216 216 GLN CB C 13 30.2520 0.0000 . 1 . . . . . 216 GLN CB . 53525 1 545 . 1 . 1 217 217 GLY H H 1 8.4750 0.0000 . 1 . . . . . 217 GLY H . 53525 1 546 . 1 . 1 217 217 GLY CA C 13 45.4320 0.0000 . 1 . . . . . 217 GLY CA . 53525 1 547 . 1 . 1 217 217 GLY N N 15 110.0610 0.0000 . 1 . . . . . 217 GLY N . 53525 1 548 . 1 . 1 218 218 GLY H H 1 8.2390 0.0000 . 1 . . . . . 218 GLY H . 53525 1 549 . 1 . 1 218 218 GLY CA C 13 45.3860 0.0000 . 1 . . . . . 218 GLY CA . 53525 1 550 . 1 . 1 218 218 GLY N N 15 109.0700 0.0000 . 1 . . . . . 218 GLY N . 53525 1 551 . 1 . 1 219 219 LYS H H 1 7.0900 0.0000 . 1 . . . . . 219 LYS H . 53525 1 552 . 1 . 1 219 219 LYS CA C 13 57.6290 0.0000 . 1 . . . . . 219 LYS CA . 53525 1 553 . 1 . 1 219 219 LYS CB C 13 33.8020 0.0000 . 1 . . . . . 219 LYS CB . 53525 1 554 . 1 . 1 219 219 LYS N N 15 125.7380 0.0000 . 1 . . . . . 219 LYS N . 53525 1 stop_ save_