data_51058 ####################### # Entry information # ####################### save_entry_information_1 _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information_1 _Entry.ID 51058 _Entry.Title ; RBM5 RRM1-ZnF1-RRM2 (C191G) ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2021-08-12 _Entry.Accession_date 2021-08-12 _Entry.Last_release_date 2021-08-12 _Entry.Original_release_date 2021-08-12 _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 Komal Soni . . . . 51058 2 'Pravin Kumar Ankush' Jagtap . . . . 51058 3 Michael Sattler . . . . 51058 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 51058 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '15N chemical shifts' 186 51058 '1H chemical shifts' 186 51058 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 . . 2023-09-06 2021-08-12 update BMRB 'update entry citation' 51058 1 . . 2023-06-01 2021-08-12 original author 'original release' 51058 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 50187 'RBM5 RRM1-Zf1, wild type' 51058 BMRB 50191 'RBM5 RRM1-ZnF1 (C191G)' 51058 BMRB 51057 'RBM5 RRM1' 51058 stop_ save_ ############### # Citations # ############### save_citations_1 _Citation.Sf_category citations _Citation.Sf_framecode citations_1 _Citation.Entry_ID 51058 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 37454201 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; Structural basis for specific RNA recognition by the alternative splicing factor RBM5 ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Nat. Commun.' _Citation.Journal_name_full 'Nature communications' _Citation.Journal_volume 14 _Citation.Journal_issue 1 _Citation.Journal_ASTM . _Citation.Journal_ISSN 2041-1723 _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 4233 _Citation.Page_last 4233 _Citation.Year 2023 _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 Komal Soni K. . . . 51058 1 2 'Pravin Kumar Ankush' Jagtap . . . . 51058 1 3 Santiago Martinez-Lumbreras S. . . . 51058 1 4 Sophie Bonnal S. . . . 51058 1 5 Arie Geerlof A. . . . 51058 1 6 Ralf Stehle R. . . . 51058 1 7 Bernd Simon B. . . . 51058 1 8 Juan Valcarcel J. . . . 51058 1 9 Michael Sattler M. . . . 51058 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly_1 _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly_1 _Assembly.Entry_ID 51058 _Assembly.ID 1 _Assembly.Name 'RBM5 RRM1-ZnF1-RRM2 (C191G)' _Assembly.BMRB_code . _Assembly.Number_of_components 2 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 1 _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 'RRM1-ZnF1-RRM2 (C191G)' 1 $entity_1 . . yes native no no . . . 51058 1 2 Zn2+ 2 $entity_ZN . . no native no no . . . 51058 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 51058 _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 ; GAMGERESKTIMLRGLPTTI TESDIREMMESFEGPQPADV RLMKRKTGVSRGFAFVEFYH LQDATSWMEANQKKLVIQGK HIAMHYSNPRPKFEDWLCNK CGLNNFRKRLKCFRCGADKF DSEQEVPPGTTESVQSVDYY CDTIILRNIAPHTVVDSIMT ALSPYASLAVNNIRLIKDKQ TQQNRGFAFVQLSSAMDASQ LLQILQSLHPPLKIDGKTIG VDFAKS ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq ; 90,GLY 91,ALA 92,MET ...... 313,ALA 314,LYS 315,SER ; _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 226 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'free and other bound' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation ; Ile107 is mutated to Thr107 Cys191 is mutated to Gly191 ; _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_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 yes UNP P52756 . RBM5 . . . . . . . . . . . . . . 51058 1 stop_ 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 90 GLY . 51058 1 2 91 ALA . 51058 1 3 92 MET . 51058 1 4 93 GLY . 51058 1 5 94 GLU . 51058 1 6 95 ARG . 51058 1 7 96 GLU . 51058 1 8 97 SER . 51058 1 9 98 LYS . 51058 1 10 99 THR . 51058 1 11 100 ILE . 51058 1 12 101 MET . 51058 1 13 102 LEU . 51058 1 14 103 ARG . 51058 1 15 104 GLY . 51058 1 16 105 LEU . 51058 1 17 106 PRO . 51058 1 18 107 THR . 51058 1 19 108 THR . 51058 1 20 109 ILE . 51058 1 21 110 THR . 51058 1 22 111 GLU . 51058 1 23 112 SER . 51058 1 24 113 ASP . 51058 1 25 114 ILE . 51058 1 26 115 ARG . 51058 1 27 116 GLU . 51058 1 28 117 MET . 51058 1 29 118 MET . 51058 1 30 119 GLU . 51058 1 31 120 SER . 51058 1 32 121 PHE . 51058 1 33 122 GLU . 51058 1 34 123 GLY . 51058 1 35 124 PRO . 51058 1 36 125 GLN . 51058 1 37 126 PRO . 51058 1 38 127 ALA . 51058 1 39 128 ASP . 51058 1 40 129 VAL . 51058 1 41 130 ARG . 51058 1 42 131 LEU . 51058 1 43 132 MET . 51058 1 44 133 LYS . 51058 1 45 134 ARG . 51058 1 46 135 LYS . 51058 1 47 136 THR . 51058 1 48 137 GLY . 51058 1 49 138 VAL . 51058 1 50 139 SER . 51058 1 51 140 ARG . 51058 1 52 141 GLY . 51058 1 53 142 PHE . 51058 1 54 143 ALA . 51058 1 55 144 PHE . 51058 1 56 145 VAL . 51058 1 57 146 GLU . 51058 1 58 147 PHE . 51058 1 59 148 TYR . 51058 1 60 149 HIS . 51058 1 61 150 LEU . 51058 1 62 151 GLN . 51058 1 63 152 ASP . 51058 1 64 153 ALA . 51058 1 65 154 THR . 51058 1 66 155 SER . 51058 1 67 156 TRP . 51058 1 68 157 MET . 51058 1 69 158 GLU . 51058 1 70 159 ALA . 51058 1 71 160 ASN . 51058 1 72 161 GLN . 51058 1 73 162 LYS . 51058 1 74 163 LYS . 51058 1 75 164 LEU . 51058 1 76 165 VAL . 51058 1 77 166 ILE . 51058 1 78 167 GLN . 51058 1 79 168 GLY . 51058 1 80 169 LYS . 51058 1 81 170 HIS . 51058 1 82 171 ILE . 51058 1 83 172 ALA . 51058 1 84 173 MET . 51058 1 85 174 HIS . 51058 1 86 175 TYR . 51058 1 87 176 SER . 51058 1 88 177 ASN . 51058 1 89 178 PRO . 51058 1 90 179 ARG . 51058 1 91 180 PRO . 51058 1 92 181 LYS . 51058 1 93 182 PHE . 51058 1 94 183 GLU . 51058 1 95 184 ASP . 51058 1 96 185 TRP . 51058 1 97 186 LEU . 51058 1 98 187 CYS . 51058 1 99 188 ASN . 51058 1 100 189 LYS . 51058 1 101 190 CYS . 51058 1 102 191 GLY . 51058 1 103 192 LEU . 51058 1 104 193 ASN . 51058 1 105 194 ASN . 51058 1 106 195 PHE . 51058 1 107 196 ARG . 51058 1 108 197 LYS . 51058 1 109 198 ARG . 51058 1 110 199 LEU . 51058 1 111 200 LYS . 51058 1 112 201 CYS . 51058 1 113 202 PHE . 51058 1 114 203 ARG . 51058 1 115 204 CYS . 51058 1 116 205 GLY . 51058 1 117 206 ALA . 51058 1 118 207 ASP . 51058 1 119 208 LYS . 51058 1 120 209 PHE . 51058 1 121 210 ASP . 51058 1 122 211 SER . 51058 1 123 212 GLU . 51058 1 124 213 GLN . 51058 1 125 214 GLU . 51058 1 126 215 VAL . 51058 1 127 216 PRO . 51058 1 128 217 PRO . 51058 1 129 218 GLY . 51058 1 130 219 THR . 51058 1 131 220 THR . 51058 1 132 221 GLU . 51058 1 133 222 SER . 51058 1 134 223 VAL . 51058 1 135 224 GLN . 51058 1 136 225 SER . 51058 1 137 226 VAL . 51058 1 138 227 ASP . 51058 1 139 228 TYR . 51058 1 140 229 TYR . 51058 1 141 230 CYS . 51058 1 142 231 ASP . 51058 1 143 232 THR . 51058 1 144 233 ILE . 51058 1 145 234 ILE . 51058 1 146 235 LEU . 51058 1 147 236 ARG . 51058 1 148 237 ASN . 51058 1 149 238 ILE . 51058 1 150 239 ALA . 51058 1 151 240 PRO . 51058 1 152 241 HIS . 51058 1 153 242 THR . 51058 1 154 243 VAL . 51058 1 155 244 VAL . 51058 1 156 245 ASP . 51058 1 157 246 SER . 51058 1 158 247 ILE . 51058 1 159 248 MET . 51058 1 160 249 THR . 51058 1 161 250 ALA . 51058 1 162 251 LEU . 51058 1 163 252 SER . 51058 1 164 253 PRO . 51058 1 165 254 TYR . 51058 1 166 255 ALA . 51058 1 167 256 SER . 51058 1 168 257 LEU . 51058 1 169 258 ALA . 51058 1 170 259 VAL . 51058 1 171 260 ASN . 51058 1 172 261 ASN . 51058 1 173 262 ILE . 51058 1 174 263 ARG . 51058 1 175 264 LEU . 51058 1 176 265 ILE . 51058 1 177 266 LYS . 51058 1 178 267 ASP . 51058 1 179 268 LYS . 51058 1 180 269 GLN . 51058 1 181 270 THR . 51058 1 182 271 GLN . 51058 1 183 272 GLN . 51058 1 184 273 ASN . 51058 1 185 274 ARG . 51058 1 186 275 GLY . 51058 1 187 276 PHE . 51058 1 188 277 ALA . 51058 1 189 278 PHE . 51058 1 190 279 VAL . 51058 1 191 280 GLN . 51058 1 192 281 LEU . 51058 1 193 282 SER . 51058 1 194 283 SER . 51058 1 195 284 ALA . 51058 1 196 285 MET . 51058 1 197 286 ASP . 51058 1 198 287 ALA . 51058 1 199 288 SER . 51058 1 200 289 GLN . 51058 1 201 290 LEU . 51058 1 202 291 LEU . 51058 1 203 292 GLN . 51058 1 204 293 ILE . 51058 1 205 294 LEU . 51058 1 206 295 GLN . 51058 1 207 296 SER . 51058 1 208 297 LEU . 51058 1 209 298 HIS . 51058 1 210 299 PRO . 51058 1 211 300 PRO . 51058 1 212 301 LEU . 51058 1 213 302 LYS . 51058 1 214 303 ILE . 51058 1 215 304 ASP . 51058 1 216 305 GLY . 51058 1 217 306 LYS . 51058 1 218 307 THR . 51058 1 219 308 ILE . 51058 1 220 309 GLY . 51058 1 221 310 VAL . 51058 1 222 311 ASP . 51058 1 223 312 PHE . 51058 1 224 313 ALA . 51058 1 225 314 LYS . 51058 1 226 315 SER . 51058 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 . GLY 1 1 51058 1 . ALA 2 2 51058 1 . MET 3 3 51058 1 . GLY 4 4 51058 1 . GLU 5 5 51058 1 . ARG 6 6 51058 1 . GLU 7 7 51058 1 . SER 8 8 51058 1 . LYS 9 9 51058 1 . THR 10 10 51058 1 . ILE 11 11 51058 1 . MET 12 12 51058 1 . LEU 13 13 51058 1 . ARG 14 14 51058 1 . GLY 15 15 51058 1 . LEU 16 16 51058 1 . PRO 17 17 51058 1 . THR 18 18 51058 1 . THR 19 19 51058 1 . ILE 20 20 51058 1 . THR 21 21 51058 1 . GLU 22 22 51058 1 . SER 23 23 51058 1 . ASP 24 24 51058 1 . ILE 25 25 51058 1 . ARG 26 26 51058 1 . GLU 27 27 51058 1 . MET 28 28 51058 1 . MET 29 29 51058 1 . GLU 30 30 51058 1 . SER 31 31 51058 1 . PHE 32 32 51058 1 . GLU 33 33 51058 1 . GLY 34 34 51058 1 . PRO 35 35 51058 1 . GLN 36 36 51058 1 . PRO 37 37 51058 1 . ALA 38 38 51058 1 . ASP 39 39 51058 1 . VAL 40 40 51058 1 . ARG 41 41 51058 1 . LEU 42 42 51058 1 . MET 43 43 51058 1 . LYS 44 44 51058 1 . ARG 45 45 51058 1 . LYS 46 46 51058 1 . THR 47 47 51058 1 . GLY 48 48 51058 1 . VAL 49 49 51058 1 . SER 50 50 51058 1 . ARG 51 51 51058 1 . GLY 52 52 51058 1 . PHE 53 53 51058 1 . ALA 54 54 51058 1 . PHE 55 55 51058 1 . VAL 56 56 51058 1 . GLU 57 57 51058 1 . PHE 58 58 51058 1 . TYR 59 59 51058 1 . HIS 60 60 51058 1 . LEU 61 61 51058 1 . GLN 62 62 51058 1 . ASP 63 63 51058 1 . ALA 64 64 51058 1 . THR 65 65 51058 1 . SER 66 66 51058 1 . TRP 67 67 51058 1 . MET 68 68 51058 1 . GLU 69 69 51058 1 . ALA 70 70 51058 1 . ASN 71 71 51058 1 . GLN 72 72 51058 1 . LYS 73 73 51058 1 . LYS 74 74 51058 1 . LEU 75 75 51058 1 . VAL 76 76 51058 1 . ILE 77 77 51058 1 . GLN 78 78 51058 1 . GLY 79 79 51058 1 . LYS 80 80 51058 1 . HIS 81 81 51058 1 . ILE 82 82 51058 1 . ALA 83 83 51058 1 . MET 84 84 51058 1 . HIS 85 85 51058 1 . TYR 86 86 51058 1 . SER 87 87 51058 1 . ASN 88 88 51058 1 . PRO 89 89 51058 1 . ARG 90 90 51058 1 . PRO 91 91 51058 1 . LYS 92 92 51058 1 . PHE 93 93 51058 1 . GLU 94 94 51058 1 . ASP 95 95 51058 1 . TRP 96 96 51058 1 . LEU 97 97 51058 1 . CYS 98 98 51058 1 . ASN 99 99 51058 1 . LYS 100 100 51058 1 . CYS 101 101 51058 1 . GLY 102 102 51058 1 . LEU 103 103 51058 1 . ASN 104 104 51058 1 . ASN 105 105 51058 1 . PHE 106 106 51058 1 . ARG 107 107 51058 1 . LYS 108 108 51058 1 . ARG 109 109 51058 1 . LEU 110 110 51058 1 . LYS 111 111 51058 1 . CYS 112 112 51058 1 . PHE 113 113 51058 1 . ARG 114 114 51058 1 . CYS 115 115 51058 1 . GLY 116 116 51058 1 . ALA 117 117 51058 1 . ASP 118 118 51058 1 . LYS 119 119 51058 1 . PHE 120 120 51058 1 . ASP 121 121 51058 1 . SER 122 122 51058 1 . GLU 123 123 51058 1 . GLN 124 124 51058 1 . GLU 125 125 51058 1 . VAL 126 126 51058 1 . PRO 127 127 51058 1 . PRO 128 128 51058 1 . GLY 129 129 51058 1 . THR 130 130 51058 1 . THR 131 131 51058 1 . GLU 132 132 51058 1 . SER 133 133 51058 1 . VAL 134 134 51058 1 . GLN 135 135 51058 1 . SER 136 136 51058 1 . VAL 137 137 51058 1 . ASP 138 138 51058 1 . TYR 139 139 51058 1 . TYR 140 140 51058 1 . CYS 141 141 51058 1 . ASP 142 142 51058 1 . THR 143 143 51058 1 . ILE 144 144 51058 1 . ILE 145 145 51058 1 . LEU 146 146 51058 1 . ARG 147 147 51058 1 . ASN 148 148 51058 1 . ILE 149 149 51058 1 . ALA 150 150 51058 1 . PRO 151 151 51058 1 . HIS 152 152 51058 1 . THR 153 153 51058 1 . VAL 154 154 51058 1 . VAL 155 155 51058 1 . ASP 156 156 51058 1 . SER 157 157 51058 1 . ILE 158 158 51058 1 . MET 159 159 51058 1 . THR 160 160 51058 1 . ALA 161 161 51058 1 . LEU 162 162 51058 1 . SER 163 163 51058 1 . PRO 164 164 51058 1 . TYR 165 165 51058 1 . ALA 166 166 51058 1 . SER 167 167 51058 1 . LEU 168 168 51058 1 . ALA 169 169 51058 1 . VAL 170 170 51058 1 . ASN 171 171 51058 1 . ASN 172 172 51058 1 . ILE 173 173 51058 1 . ARG 174 174 51058 1 . LEU 175 175 51058 1 . ILE 176 176 51058 1 . LYS 177 177 51058 1 . ASP 178 178 51058 1 . LYS 179 179 51058 1 . GLN 180 180 51058 1 . THR 181 181 51058 1 . GLN 182 182 51058 1 . GLN 183 183 51058 1 . ASN 184 184 51058 1 . ARG 185 185 51058 1 . GLY 186 186 51058 1 . PHE 187 187 51058 1 . ALA 188 188 51058 1 . PHE 189 189 51058 1 . VAL 190 190 51058 1 . GLN 191 191 51058 1 . LEU 192 192 51058 1 . SER 193 193 51058 1 . SER 194 194 51058 1 . ALA 195 195 51058 1 . MET 196 196 51058 1 . ASP 197 197 51058 1 . ALA 198 198 51058 1 . SER 199 199 51058 1 . GLN 200 200 51058 1 . LEU 201 201 51058 1 . LEU 202 202 51058 1 . GLN 203 203 51058 1 . ILE 204 204 51058 1 . LEU 205 205 51058 1 . GLN 206 206 51058 1 . SER 207 207 51058 1 . LEU 208 208 51058 1 . HIS 209 209 51058 1 . PRO 210 210 51058 1 . PRO 211 211 51058 1 . LEU 212 212 51058 1 . LYS 213 213 51058 1 . ILE 214 214 51058 1 . ASP 215 215 51058 1 . GLY 216 216 51058 1 . LYS 217 217 51058 1 . THR 218 218 51058 1 . ILE 219 219 51058 1 . GLY 220 220 51058 1 . VAL 221 221 51058 1 . ASP 222 222 51058 1 . PHE 223 223 51058 1 . ALA 224 224 51058 1 . LYS 225 225 51058 1 . SER 226 226 51058 1 stop_ save_ save_entity_ZN _Entity.Sf_category entity _Entity.Sf_framecode entity_ZN _Entity.Entry_ID 51058 _Entity.ID 2 _Entity.BMRB_code ZN _Entity.Name entity_ZN _Entity.Type non-polymer _Entity.Polymer_common_type . _Entity.Polymer_type . _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code . _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer . _Entity.Nstd_chirality . _Entity.Nstd_linkage . _Entity.Nonpolymer_comp_ID ZN _Entity.Nonpolymer_comp_label $chem_comp_ZN _Entity.Number_of_monomers . _Entity.Number_of_nonpolymer_components 1 _Entity.Paramagnetic . _Entity.Thiol_state . _Entity.Src_method . _Entity.Parent_entity_ID 2 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 65.409 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'ZINC ION' BMRB 51058 2 stop_ loop_ _Entity_systematic_name.Name _Entity_systematic_name.Naming_system _Entity_systematic_name.Entry_ID _Entity_systematic_name.Entity_ID 'ZINC ION' BMRB 51058 2 ZN 'Three letter code' 51058 2 stop_ 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 1 ZN $chem_comp_ZN 51058 2 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 51058 _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 . . . . . . . . . . . . . 51058 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 51058 _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 BL21 . . plasmid . . 'Modified petM11' . . 'petM11 vector was modified to contain N-His-Thioredoxin-TEV site' 51058 1 stop_ save_ ################################# # Polymer residues and ligands # ################################# save_chem_comp_ZN _Chem_comp.Sf_category chem_comp _Chem_comp.Sf_framecode chem_comp_ZN _Chem_comp.Entry_ID 51058 _Chem_comp.ID ZN _Chem_comp.Provenance PDB _Chem_comp.Name 'ZINC ION' _Chem_comp.Type NON-POLYMER _Chem_comp.BMRB_code ZN _Chem_comp.PDB_code ZN _Chem_comp.Ambiguous_flag no _Chem_comp.Initial_date 2020-07-10 _Chem_comp.Modified_date 2020-07-10 _Chem_comp.Release_status REL _Chem_comp.Replaced_by . _Chem_comp.Replaces . _Chem_comp.One_letter_code . _Chem_comp.Three_letter_code ZN _Chem_comp.Number_atoms_all 1 _Chem_comp.Number_atoms_nh 1 _Chem_comp.Atom_nomenclature_source . _Chem_comp.PubChem_code . _Chem_comp.Subcomponent_list . _Chem_comp.InChI_code InChI=1S/Zn/q+2 _Chem_comp.Mon_nstd_flag no _Chem_comp.Mon_nstd_class . _Chem_comp.Mon_nstd_details . _Chem_comp.Mon_nstd_parent . _Chem_comp.Mon_nstd_parent_comp_ID . _Chem_comp.Std_deriv_one_letter_code . _Chem_comp.Std_deriv_three_letter_code . _Chem_comp.Std_deriv_BMRB_code . _Chem_comp.Std_deriv_PDB_code . _Chem_comp.Std_deriv_chem_comp_name . _Chem_comp.Synonyms . _Chem_comp.Formal_charge 2 _Chem_comp.Paramagnetic . _Chem_comp.Aromatic no _Chem_comp.Formula Zn _Chem_comp.Formula_weight 65.409 _Chem_comp.Formula_mono_iso_wt_nat . _Chem_comp.Formula_mono_iso_wt_13C . _Chem_comp.Formula_mono_iso_wt_15N . _Chem_comp.Formula_mono_iso_wt_13C_15N . _Chem_comp.Image_file_name . _Chem_comp.Image_file_format . _Chem_comp.Topo_file_name . _Chem_comp.Topo_file_format . _Chem_comp.Struct_file_name . _Chem_comp.Struct_file_format . _Chem_comp.Stereochem_param_file_name . _Chem_comp.Stereochem_param_file_format . _Chem_comp.Model_details . _Chem_comp.Model_erf . _Chem_comp.Model_source . _Chem_comp.Model_coordinates_details . _Chem_comp.Model_coordinates_missing_flag no _Chem_comp.Ideal_coordinates_details . _Chem_comp.Ideal_coordinates_missing_flag no _Chem_comp.Model_coordinates_db_code . _Chem_comp.Processing_site RCSB _Chem_comp.Vendor . _Chem_comp.Vendor_product_code . _Chem_comp.Details . _Chem_comp.DB_query_date . _Chem_comp.DB_last_query_revised_last_date . loop_ _Chem_comp_descriptor.Descriptor _Chem_comp_descriptor.Type _Chem_comp_descriptor.Program _Chem_comp_descriptor.Program_version _Chem_comp_descriptor.Entry_ID _Chem_comp_descriptor.Comp_ID InChI=1S/Zn/q+2 InChI InChI 1.03 51058 ZN PTFCDOFLOPIGGS-UHFFFAOYSA-N InChIKey InChI 1.03 51058 ZN [Zn++] SMILES CACTVS 3.341 51058 ZN [Zn++] SMILES_CANONICAL CACTVS 3.341 51058 ZN [Zn+2] SMILES ACDLabs 10.04 51058 ZN [Zn+2] SMILES 'OpenEye OEToolkits' 1.5.0 51058 ZN [Zn+2] SMILES_CANONICAL 'OpenEye OEToolkits' 1.5.0 51058 ZN stop_ loop_ _Chem_comp_identifier.Identifier _Chem_comp_identifier.Type _Chem_comp_identifier.Program _Chem_comp_identifier.Program_version _Chem_comp_identifier.Entry_ID _Chem_comp_identifier.Comp_ID zinc 'SYSTEMATIC NAME' ACDLabs 10.04 51058 ZN 'zinc(+2) cation' 'SYSTEMATIC NAME' 'OpenEye OEToolkits' 1.5.0 51058 ZN stop_ loop_ _Chem_comp_atom.Atom_ID _Chem_comp_atom.BMRB_code _Chem_comp_atom.PDB_atom_ID _Chem_comp_atom.Alt_atom_ID _Chem_comp_atom.Auth_atom_ID _Chem_comp_atom.Type_symbol _Chem_comp_atom.Isotope_number _Chem_comp_atom.Chirality _Chem_comp_atom.Stereo_config _Chem_comp_atom.Charge _Chem_comp_atom.Partial_charge _Chem_comp_atom.Oxidation_number _Chem_comp_atom.Unpaired_electron_number _Chem_comp_atom.Align _Chem_comp_atom.Aromatic_flag _Chem_comp_atom.Leaving_atom_flag _Chem_comp_atom.Substruct_code _Chem_comp_atom.Ionizable _Chem_comp_atom.Drawing_2D_coord_x _Chem_comp_atom.Drawing_2D_coord_y _Chem_comp_atom.Model_Cartn_x _Chem_comp_atom.Model_Cartn_x_esd _Chem_comp_atom.Model_Cartn_y _Chem_comp_atom.Model_Cartn_y_esd _Chem_comp_atom.Model_Cartn_z _Chem_comp_atom.Model_Cartn_z_esd _Chem_comp_atom.Model_Cartn_x_ideal _Chem_comp_atom.Model_Cartn_y_ideal _Chem_comp_atom.Model_Cartn_z_ideal _Chem_comp_atom.PDBX_ordinal _Chem_comp_atom.Details _Chem_comp_atom.Entry_ID _Chem_comp_atom.Comp_ID ZN ZN ZN ZN . ZN . . N 2 . . . 0 N N . . . . 0.000 . 0.000 . 0.000 . 0.000 0.000 0.000 1 . 51058 ZN stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 51058 _Sample.ID 1 _Sample.Name 'RBM5 RRM1-ZnF1-RRM2 (C191G)' _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 'RBM5 RRM1-ZnF1-RRM2 (C191G)' '[U-100% 13C; U-100% 15N]' . . 1 $entity_1 . . 0.43 . . mM . . . . 51058 1 2 D2O 'natural abundance' . . . . . . 10 . . % . . . . 51058 1 3 'sodium chloride' 'natural abundance' . . . . . . 400 . . mM . . . . 51058 1 4 MES 'natural abundance' . . . . . . 20 . . mM . . . . 51058 1 5 DTT 'natural abundance' . . . . . . 1 . . mM . . . . 51058 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 51058 _Sample_condition_list.ID 1 _Sample_condition_list.Name 'Normal conditions' _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' 0.4 . M 51058 1 pH 6.5 . pH 51058 1 temperature 298 . K 51058 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 51058 _Software.ID 1 _Software.Type . _Software.Name TOPSPIN _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID collection . 51058 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 51058 _Software.ID 2 _Software.Type . _Software.Name NMRPipe _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID processing . 51058 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 51058 _Software.ID 3 _Software.Type . _Software.Name CcpNMR _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 51058 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 51058 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name 'Bruker 950' _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE III' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 950 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 51058 _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 '1D 1H' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51058 1 2 '2D 1H-15N HSQC' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51058 1 3 '3D CBCACONH' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51058 1 4 '3D HNCACB' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51058 1 5 '3D HNCA' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51058 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 51058 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name 'RBM5 RRM1-ZnF1-RRM2 (C191G)' _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 H 1 water protons . . . . ppm 4.704 internal direct 1 . . . . . 51058 1 N 15 water protons . . . . ppm 4.704 internal indirect . . . . . . 51058 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 51058 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name Tripledomains-shiftlist _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 'Assignment was aided by other RBM5 BMRB entries 51057 (RRM1), 50191 (RRM1-ZnF1 C191G) and 18017 (RRM2).' _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 2 '2D 1H-15N HSQC' . . . 51058 1 3 '3D CBCACONH' . . . 51058 1 4 '3D HNCACB' . . . 51058 1 5 '3D HNCA' . . . 51058 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 3 $software_3 . . 51058 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 ALA H H 1 8.120 0.000 . . . . . . . 91 ALA HN . 51058 1 2 . 1 . 1 2 2 ALA N N 15 123.634 0.000 . . . . . . . 91 ALA N . 51058 1 3 . 1 . 1 3 3 MET H H 1 8.544 0.000 . . . . . . . 92 MET HN . 51058 1 4 . 1 . 1 3 3 MET N N 15 119.577 0.000 . . . . . . . 92 MET N . 51058 1 5 . 1 . 1 4 4 GLY H H 1 8.366 0.000 . . . . . . . 93 GLY HN . 51058 1 6 . 1 . 1 4 4 GLY N N 15 110.063 0.000 . . . . . . . 93 GLY N . 51058 1 7 . 1 . 1 5 5 GLU H H 1 8.202 0.000 . . . . . . . 94 GLU HN . 51058 1 8 . 1 . 1 5 5 GLU N N 15 120.773 0.000 . . . . . . . 94 GLU N . 51058 1 9 . 1 . 1 6 6 ARG H H 1 8.261 0.000 . . . . . . . 95 ARG HN . 51058 1 10 . 1 . 1 6 6 ARG N N 15 122.634 0.000 . . . . . . . 95 ARG N . 51058 1 11 . 1 . 1 7 7 GLU H H 1 8.183 0.000 . . . . . . . 96 GLU HN . 51058 1 12 . 1 . 1 7 7 GLU N N 15 120.750 0.000 . . . . . . . 96 GLU N . 51058 1 13 . 1 . 1 8 8 SER H H 1 6.504 0.000 . . . . . . . 97 SER HN . 51058 1 14 . 1 . 1 8 8 SER N N 15 115.751 0.000 . . . . . . . 97 SER N . 51058 1 15 . 1 . 1 9 9 LYS H H 1 8.030 0.000 . . . . . . . 98 LYS HN . 51058 1 16 . 1 . 1 9 9 LYS N N 15 116.559 0.000 . . . . . . . 98 LYS N . 51058 1 17 . 1 . 1 10 10 THR H H 1 8.378 0.000 . . . . . . . 99 THR HN . 51058 1 18 . 1 . 1 10 10 THR N N 15 115.801 0.000 . . . . . . . 99 THR N . 51058 1 19 . 1 . 1 11 11 ILE H H 1 9.369 0.000 . . . . . . . 100 ILE HN . 51058 1 20 . 1 . 1 11 11 ILE N N 15 126.221 0.000 . . . . . . . 100 ILE N . 51058 1 21 . 1 . 1 12 12 MET H H 1 9.380 0.000 . . . . . . . 101 MET HN . 51058 1 22 . 1 . 1 12 12 MET N N 15 126.238 0.000 . . . . . . . 101 MET N . 51058 1 23 . 1 . 1 13 13 LEU H H 1 8.936 0.000 . . . . . . . 102 LEU HN . 51058 1 24 . 1 . 1 13 13 LEU N N 15 125.498 0.000 . . . . . . . 102 LEU N . 51058 1 25 . 1 . 1 15 15 GLY H H 1 8.200 0.000 . . . . . . . 104 GLY HN . 51058 1 26 . 1 . 1 15 15 GLY N N 15 109.403 0.000 . . . . . . . 104 GLY N . 51058 1 27 . 1 . 1 16 16 LEU H H 1 8.095 0.000 . . . . . . . 105 LEU HN . 51058 1 28 . 1 . 1 16 16 LEU N N 15 119.262 0.000 . . . . . . . 105 LEU N . 51058 1 29 . 1 . 1 18 18 THR H H 1 8.889 0.000 . . . . . . . 107 THR HN . 51058 1 30 . 1 . 1 18 18 THR N N 15 116.072 0.000 . . . . . . . 107 THR N . 51058 1 31 . 1 . 1 19 19 THR H H 1 7.079 0.000 . . . . . . . 108 THR HN . 51058 1 32 . 1 . 1 19 19 THR N N 15 106.792 0.000 . . . . . . . 108 THR N . 51058 1 33 . 1 . 1 20 20 ILE H H 1 6.929 0.000 . . . . . . . 109 ILE HN . 51058 1 34 . 1 . 1 20 20 ILE N N 15 121.231 0.000 . . . . . . . 109 ILE N . 51058 1 35 . 1 . 1 21 21 THR H H 1 9.079 0.000 . . . . . . . 110 THR HN . 51058 1 36 . 1 . 1 21 21 THR N N 15 118.864 0.000 . . . . . . . 110 THR N . 51058 1 37 . 1 . 1 22 22 GLU H H 1 9.301 0.000 . . . . . . . 111 GLU HN . 51058 1 38 . 1 . 1 22 22 GLU N N 15 120.988 0.000 . . . . . . . 111 GLU N . 51058 1 39 . 1 . 1 23 23 SER H H 1 8.268 0.000 . . . . . . . 112 SER HN . 51058 1 40 . 1 . 1 23 23 SER N N 15 113.675 0.000 . . . . . . . 112 SER N . 51058 1 41 . 1 . 1 24 24 ASP H H 1 7.617 0.000 . . . . . . . 113 ASP HN . 51058 1 42 . 1 . 1 24 24 ASP N N 15 121.976 0.000 . . . . . . . 113 ASP N . 51058 1 43 . 1 . 1 25 25 ILE H H 1 7.655 0.000 . . . . . . . 114 ILE HN . 51058 1 44 . 1 . 1 25 25 ILE N N 15 119.383 0.000 . . . . . . . 114 ILE N . 51058 1 45 . 1 . 1 26 26 ARG H H 1 8.161 0.000 . . . . . . . 115 ARG HN . 51058 1 46 . 1 . 1 26 26 ARG N N 15 119.851 0.000 . . . . . . . 115 ARG N . 51058 1 47 . 1 . 1 27 27 GLU H H 1 8.162 0.000 . . . . . . . 116 GLU HN . 51058 1 48 . 1 . 1 27 27 GLU N N 15 118.669 0.000 . . . . . . . 116 GLU N . 51058 1 49 . 1 . 1 28 28 MET H H 1 7.846 0.000 . . . . . . . 117 MET HN . 51058 1 50 . 1 . 1 28 28 MET N N 15 119.284 0.000 . . . . . . . 117 MET N . 51058 1 51 . 1 . 1 29 29 MET H H 1 7.992 0.000 . . . . . . . 118 MET HN . 51058 1 52 . 1 . 1 29 29 MET N N 15 117.163 0.000 . . . . . . . 118 MET N . 51058 1 53 . 1 . 1 30 30 GLU H H 1 7.766 0.000 . . . . . . . 119 GLU HN . 51058 1 54 . 1 . 1 30 30 GLU N N 15 118.849 0.000 . . . . . . . 119 GLU N . 51058 1 55 . 1 . 1 31 31 SER H H 1 7.644 0.000 . . . . . . . 120 SER HN . 51058 1 56 . 1 . 1 31 31 SER N N 15 112.926 0.000 . . . . . . . 120 SER N . 51058 1 57 . 1 . 1 32 32 PHE H H 1 7.493 0.000 . . . . . . . 121 PHE HN . 51058 1 58 . 1 . 1 32 32 PHE N N 15 122.162 0.000 . . . . . . . 121 PHE N . 51058 1 59 . 1 . 1 33 33 GLU H H 1 8.433 0.000 . . . . . . . 122 GLU HN . 51058 1 60 . 1 . 1 33 33 GLU N N 15 121.321 0.000 . . . . . . . 122 GLU N . 51058 1 61 . 1 . 1 34 34 GLY H H 1 8.015 0.000 . . . . . . . 123 GLY HN . 51058 1 62 . 1 . 1 34 34 GLY N N 15 108.649 0.000 . . . . . . . 123 GLY N . 51058 1 63 . 1 . 1 36 36 GLN H H 1 8.404 0.000 . . . . . . . 125 GLN HN . 51058 1 64 . 1 . 1 36 36 GLN N N 15 120.048 0.000 . . . . . . . 125 GLN N . 51058 1 65 . 1 . 1 38 38 ALA H H 1 8.514 0.000 . . . . . . . 127 ALA HN . 51058 1 66 . 1 . 1 38 38 ALA N N 15 123.515 0.000 . . . . . . . 127 ALA N . 51058 1 67 . 1 . 1 39 39 ASP H H 1 7.426 0.000 . . . . . . . 128 ASP HN . 51058 1 68 . 1 . 1 39 39 ASP N N 15 113.212 0.000 . . . . . . . 128 ASP N . 51058 1 69 . 1 . 1 40 40 VAL H H 1 7.783 0.000 . . . . . . . 129 VAL HN . 51058 1 70 . 1 . 1 40 40 VAL N N 15 122.045 0.000 . . . . . . . 129 VAL N . 51058 1 71 . 1 . 1 41 41 ARG H H 1 8.919 0.000 . . . . . . . 130 ARG HN . 51058 1 72 . 1 . 1 41 41 ARG N N 15 124.916 0.000 . . . . . . . 130 ARG N . 51058 1 73 . 1 . 1 42 42 LEU H H 1 9.427 0.000 . . . . . . . 131 LEU HN . 51058 1 74 . 1 . 1 42 42 LEU N N 15 127.225 0.000 . . . . . . . 131 LEU N . 51058 1 75 . 1 . 1 43 43 MET H H 1 8.085 0.000 . . . . . . . 132 MET HN . 51058 1 76 . 1 . 1 43 43 MET N N 15 125.059 0.000 . . . . . . . 132 MET N . 51058 1 77 . 1 . 1 44 44 LYS H H 1 8.515 0.000 . . . . . . . 133 LYS HN . 51058 1 78 . 1 . 1 44 44 LYS N N 15 122.060 0.000 . . . . . . . 133 LYS N . 51058 1 79 . 1 . 1 45 45 ARG H H 1 8.724 0.000 . . . . . . . 134 ARG HN . 51058 1 80 . 1 . 1 45 45 ARG N N 15 120.290 0.000 . . . . . . . 134 ARG N . 51058 1 81 . 1 . 1 47 47 THR H H 1 7.205 0.000 . . . . . . . 136 THR HN . 51058 1 82 . 1 . 1 47 47 THR N N 15 106.649 0.000 . . . . . . . 136 THR N . 51058 1 83 . 1 . 1 48 48 GLY H H 1 8.167 0.000 . . . . . . . 137 GLY HN . 51058 1 84 . 1 . 1 48 48 GLY N N 15 109.556 0.000 . . . . . . . 137 GLY N . 51058 1 85 . 1 . 1 49 49 VAL H H 1 7.090 0.000 . . . . . . . 138 VAL HN . 51058 1 86 . 1 . 1 49 49 VAL N N 15 118.847 0.000 . . . . . . . 138 VAL N . 51058 1 87 . 1 . 1 50 50 SER H H 1 8.660 0.000 . . . . . . . 139 SER HN . 51058 1 88 . 1 . 1 50 50 SER N N 15 119.662 0.000 . . . . . . . 139 SER N . 51058 1 89 . 1 . 1 52 52 GLY H H 1 8.993 0.000 . . . . . . . 141 GLY HN . 51058 1 90 . 1 . 1 52 52 GLY N N 15 106.823 0.000 . . . . . . . 141 GLY N . 51058 1 91 . 1 . 1 54 54 ALA H H 1 8.527 0.000 . . . . . . . 143 ALA HN . 51058 1 92 . 1 . 1 54 54 ALA N N 15 120.338 0.000 . . . . . . . 143 ALA N . 51058 1 93 . 1 . 1 55 55 PHE H H 1 8.988 0.000 . . . . . . . 144 PHE HN . 51058 1 94 . 1 . 1 55 55 PHE N N 15 117.801 0.000 . . . . . . . 144 PHE N . 51058 1 95 . 1 . 1 56 56 VAL H H 1 9.496 0.000 . . . . . . . 145 VAL HN . 51058 1 96 . 1 . 1 56 56 VAL N N 15 123.789 0.000 . . . . . . . 145 VAL N . 51058 1 97 . 1 . 1 57 57 GLU H H 1 8.330 0.000 . . . . . . . 146 GLU HN . 51058 1 98 . 1 . 1 57 57 GLU N N 15 126.574 0.000 . . . . . . . 146 GLU N . 51058 1 99 . 1 . 1 59 59 TYR H H 1 9.746 0.000 . . . . . . . 148 TYR HN . 51058 1 100 . 1 . 1 59 59 TYR N N 15 118.485 0.000 . . . . . . . 148 TYR N . 51058 1 101 . 1 . 1 62 62 GLN H H 1 9.228 0.000 . . . . . . . 151 GLN HN . 51058 1 102 . 1 . 1 62 62 GLN N N 15 116.011 0.000 . . . . . . . 151 GLN N . 51058 1 103 . 1 . 1 63 63 ASP H H 1 7.235 0.000 . . . . . . . 152 ASP HN . 51058 1 104 . 1 . 1 63 63 ASP N N 15 119.586 0.000 . . . . . . . 152 ASP N . 51058 1 105 . 1 . 1 64 64 ALA H H 1 6.903 0.000 . . . . . . . 153 ALA HN . 51058 1 106 . 1 . 1 64 64 ALA N N 15 122.144 0.000 . . . . . . . 153 ALA N . 51058 1 107 . 1 . 1 65 65 THR H H 1 8.500 0.000 . . . . . . . 154 THR HN . 51058 1 108 . 1 . 1 65 65 THR N N 15 109.735 0.000 . . . . . . . 154 THR N . 51058 1 109 . 1 . 1 66 66 SER H H 1 7.866 0.000 . . . . . . . 155 SER HN . 51058 1 110 . 1 . 1 66 66 SER N N 15 118.665 0.000 . . . . . . . 155 SER N . 51058 1 111 . 1 . 1 67 67 TRP H H 1 8.145 0.000 . . . . . . . 156 TRP HN . 51058 1 112 . 1 . 1 67 67 TRP N N 15 124.884 0.000 . . . . . . . 156 TRP N . 51058 1 113 . 1 . 1 69 69 GLU H H 1 8.175 0.000 . . . . . . . 158 GLU HN . 51058 1 114 . 1 . 1 69 69 GLU N N 15 117.556 0.000 . . . . . . . 158 GLU N . 51058 1 115 . 1 . 1 70 70 ALA H H 1 7.589 0.000 . . . . . . . 159 ALA HN . 51058 1 116 . 1 . 1 70 70 ALA N N 15 118.516 0.000 . . . . . . . 159 ALA N . 51058 1 117 . 1 . 1 74 74 LYS H H 1 7.603 0.000 . . . . . . . 163 LYS HN . 51058 1 118 . 1 . 1 74 74 LYS N N 15 117.823 0.000 . . . . . . . 163 LYS N . 51058 1 119 . 1 . 1 75 75 LEU H H 1 7.972 0.000 . . . . . . . 164 LEU HN . 51058 1 120 . 1 . 1 75 75 LEU N N 15 121.882 0.000 . . . . . . . 164 LEU N . 51058 1 121 . 1 . 1 76 76 VAL H H 1 8.086 0.000 . . . . . . . 165 VAL HN . 51058 1 122 . 1 . 1 76 76 VAL N N 15 127.652 0.000 . . . . . . . 165 VAL N . 51058 1 123 . 1 . 1 77 77 ILE H H 1 8.472 0.000 . . . . . . . 166 ILE HN . 51058 1 124 . 1 . 1 77 77 ILE N N 15 124.904 0.000 . . . . . . . 166 ILE N . 51058 1 125 . 1 . 1 78 78 GLN H H 1 9.435 0.000 . . . . . . . 167 GLN HN . 51058 1 126 . 1 . 1 78 78 GLN N N 15 126.916 0.000 . . . . . . . 167 GLN N . 51058 1 127 . 1 . 1 79 79 GLY H H 1 8.239 0.000 . . . . . . . 168 GLY HN . 51058 1 128 . 1 . 1 79 79 GLY N N 15 102.693 0.000 . . . . . . . 168 GLY N . 51058 1 129 . 1 . 1 80 80 LYS H H 1 7.858 0.000 . . . . . . . 169 LYS HN . 51058 1 130 . 1 . 1 80 80 LYS N N 15 121.435 0.000 . . . . . . . 169 LYS N . 51058 1 131 . 1 . 1 81 81 HIS H H 1 8.836 0.000 . . . . . . . 170 HIS HN . 51058 1 132 . 1 . 1 81 81 HIS N N 15 122.934 0.000 . . . . . . . 170 HIS N . 51058 1 133 . 1 . 1 82 82 ILE H H 1 8.239 0.000 . . . . . . . 171 ILE HN . 51058 1 134 . 1 . 1 82 82 ILE N N 15 127.011 0.000 . . . . . . . 171 ILE N . 51058 1 135 . 1 . 1 83 83 ALA H H 1 8.142 0.000 . . . . . . . 172 ALA HN . 51058 1 136 . 1 . 1 83 83 ALA N N 15 130.171 0.000 . . . . . . . 172 ALA N . 51058 1 137 . 1 . 1 84 84 MET H H 1 8.035 0.000 . . . . . . . 173 MET HN . 51058 1 138 . 1 . 1 84 84 MET N N 15 117.610 0.000 . . . . . . . 173 MET N . 51058 1 139 . 1 . 1 85 85 HIS H H 1 8.327 0.000 . . . . . . . 174 HIS HN . 51058 1 140 . 1 . 1 85 85 HIS N N 15 117.207 0.000 . . . . . . . 174 HIS N . 51058 1 141 . 1 . 1 87 87 SER H H 1 8.723 0.000 . . . . . . . 176 SER HN . 51058 1 142 . 1 . 1 87 87 SER N N 15 115.708 0.000 . . . . . . . 176 SER N . 51058 1 143 . 1 . 1 98 98 CYS H H 1 8.638 0.000 . . . . . . . 187 CYS HN . 51058 1 144 . 1 . 1 98 98 CYS N N 15 128.948 0.000 . . . . . . . 187 CYS N . 51058 1 145 . 1 . 1 99 99 ASN H H 1 9.179 0.000 . . . . . . . 188 ASN HN . 51058 1 146 . 1 . 1 99 99 ASN N N 15 128.717 0.000 . . . . . . . 188 ASN N . 51058 1 147 . 1 . 1 100 100 LYS H H 1 9.239 0.000 . . . . . . . 189 LYS HN . 51058 1 148 . 1 . 1 100 100 LYS N N 15 122.405 0.000 . . . . . . . 189 LYS N . 51058 1 149 . 1 . 1 101 101 CYS H H 1 8.841 0.000 . . . . . . . 190 CYS HN . 51058 1 150 . 1 . 1 101 101 CYS N N 15 119.060 0.000 . . . . . . . 190 CYS N . 51058 1 151 . 1 . 1 104 104 ASN H H 1 8.376 0.000 . . . . . . . 193 ASN HN . 51058 1 152 . 1 . 1 104 104 ASN N N 15 124.105 0.000 . . . . . . . 193 ASN N . 51058 1 153 . 1 . 1 105 105 ASN H H 1 9.085 0.000 . . . . . . . 194 ASN HN . 51058 1 154 . 1 . 1 105 105 ASN N N 15 124.889 0.000 . . . . . . . 194 ASN N . 51058 1 155 . 1 . 1 109 109 ARG H H 1 8.345 0.000 . . . . . . . 198 ARG HN . 51058 1 156 . 1 . 1 109 109 ARG N N 15 119.196 0.000 . . . . . . . 198 ARG N . 51058 1 157 . 1 . 1 111 111 LYS H H 1 7.683 0.000 . . . . . . . 200 LYS HN . 51058 1 158 . 1 . 1 111 111 LYS N N 15 117.851 0.000 . . . . . . . 200 LYS N . 51058 1 159 . 1 . 1 112 112 CYS H H 1 9.663 0.000 . . . . . . . 201 CYS HN . 51058 1 160 . 1 . 1 112 112 CYS N N 15 126.084 0.000 . . . . . . . 201 CYS N . 51058 1 161 . 1 . 1 113 113 PHE H H 1 9.136 0.000 . . . . . . . 202 PHE HN . 51058 1 162 . 1 . 1 113 113 PHE N N 15 131.474 0.000 . . . . . . . 202 PHE N . 51058 1 163 . 1 . 1 114 114 ARG H H 1 8.857 0.000 . . . . . . . 203 ARG HN . 51058 1 164 . 1 . 1 114 114 ARG N N 15 120.592 0.000 . . . . . . . 203 ARG N . 51058 1 165 . 1 . 1 115 115 CYS H H 1 8.369 0.000 . . . . . . . 204 CYS HN . 51058 1 166 . 1 . 1 115 115 CYS N N 15 118.293 0.000 . . . . . . . 204 CYS N . 51058 1 167 . 1 . 1 116 116 GLY H H 1 7.646 0.000 . . . . . . . 205 GLY HN . 51058 1 168 . 1 . 1 116 116 GLY N N 15 112.284 0.000 . . . . . . . 205 GLY N . 51058 1 169 . 1 . 1 117 117 ALA H H 1 8.834 0.000 . . . . . . . 206 ALA HN . 51058 1 170 . 1 . 1 117 117 ALA N N 15 125.694 0.000 . . . . . . . 206 ALA N . 51058 1 171 . 1 . 1 118 118 ASP H H 1 8.609 0.000 . . . . . . . 207 ASP HN . 51058 1 172 . 1 . 1 118 118 ASP N N 15 121.137 0.000 . . . . . . . 207 ASP N . 51058 1 173 . 1 . 1 119 119 LYS H H 1 7.696 0.000 . . . . . . . 208 LYS HN . 51058 1 174 . 1 . 1 119 119 LYS N N 15 124.587 0.000 . . . . . . . 208 LYS N . 51058 1 175 . 1 . 1 121 121 ASP H H 1 7.811 0.000 . . . . . . . 210 ASP HN . 51058 1 176 . 1 . 1 121 121 ASP N N 15 120.467 0.000 . . . . . . . 210 ASP N . 51058 1 177 . 1 . 1 122 122 SER H H 1 8.126 0.000 . . . . . . . 211 SER HN . 51058 1 178 . 1 . 1 122 122 SER N N 15 115.855 0.000 . . . . . . . 211 SER N . 51058 1 179 . 1 . 1 123 123 GLU H H 1 8.344 0.000 . . . . . . . 212 GLU HN . 51058 1 180 . 1 . 1 123 123 GLU N N 15 121.702 0.000 . . . . . . . 212 GLU N . 51058 1 181 . 1 . 1 124 124 GLN H H 1 8.186 0.000 . . . . . . . 213 GLN HN . 51058 1 182 . 1 . 1 124 124 GLN N N 15 120.312 0.000 . . . . . . . 213 GLN N . 51058 1 183 . 1 . 1 125 125 GLU H H 1 8.330 0.000 . . . . . . . 214 GLU HN . 51058 1 184 . 1 . 1 125 125 GLU N N 15 122.701 0.000 . . . . . . . 214 GLU N . 51058 1 185 . 1 . 1 126 126 VAL H H 1 8.169 0.000 . . . . . . . 215 VAL HN . 51058 1 186 . 1 . 1 126 126 VAL N N 15 122.753 0.000 . . . . . . . 215 VAL N . 51058 1 187 . 1 . 1 129 129 GLY H H 1 8.458 0.000 . . . . . . . 218 GLY HN . 51058 1 188 . 1 . 1 129 129 GLY N N 15 109.212 0.000 . . . . . . . 218 GLY N . 51058 1 189 . 1 . 1 130 130 THR H H 1 7.952 0.000 . . . . . . . 219 THR HN . 51058 1 190 . 1 . 1 130 130 THR N N 15 113.612 0.000 . . . . . . . 219 THR N . 51058 1 191 . 1 . 1 131 131 THR H H 1 8.190 0.000 . . . . . . . 220 THR HN . 51058 1 192 . 1 . 1 131 131 THR N N 15 116.169 0.000 . . . . . . . 220 THR N . 51058 1 193 . 1 . 1 132 132 GLU H H 1 8.384 0.000 . . . . . . . 221 GLU HN . 51058 1 194 . 1 . 1 132 132 GLU N N 15 123.071 0.000 . . . . . . . 221 GLU N . 51058 1 195 . 1 . 1 133 133 SER H H 1 8.276 0.000 . . . . . . . 222 SER HN . 51058 1 196 . 1 . 1 133 133 SER N N 15 116.983 0.000 . . . . . . . 222 SER N . 51058 1 197 . 1 . 1 134 134 VAL H H 1 8.099 0.000 . . . . . . . 223 VAL HN . 51058 1 198 . 1 . 1 134 134 VAL N N 15 121.717 0.000 . . . . . . . 223 VAL N . 51058 1 199 . 1 . 1 135 135 GLN H H 1 8.363 0.000 . . . . . . . 224 GLN HN . 51058 1 200 . 1 . 1 135 135 GLN N N 15 123.685 0.000 . . . . . . . 224 GLN N . 51058 1 201 . 1 . 1 136 136 SER H H 1 8.274 0.000 . . . . . . . 225 SER HN . 51058 1 202 . 1 . 1 136 136 SER N N 15 117.508 0.000 . . . . . . . 225 SER N . 51058 1 203 . 1 . 1 137 137 VAL H H 1 8.018 0.000 . . . . . . . 226 VAL HN . 51058 1 204 . 1 . 1 137 137 VAL N N 15 120.724 0.000 . . . . . . . 226 VAL N . 51058 1 205 . 1 . 1 138 138 ASP H H 1 8.119 0.000 . . . . . . . 227 ASP HN . 51058 1 206 . 1 . 1 138 138 ASP N N 15 122.862 0.000 . . . . . . . 227 ASP N . 51058 1 207 . 1 . 1 139 139 TYR H H 1 7.730 0.000 . . . . . . . 228 TYR HN . 51058 1 208 . 1 . 1 139 139 TYR N N 15 119.804 0.000 . . . . . . . 228 TYR N . 51058 1 209 . 1 . 1 140 140 TYR H H 1 7.822 0.000 . . . . . . . 229 TYR HN . 51058 1 210 . 1 . 1 140 140 TYR N N 15 120.795 0.000 . . . . . . . 229 TYR N . 51058 1 211 . 1 . 1 141 141 CYS H H 1 7.507 0.000 . . . . . . . 230 CYS HN . 51058 1 212 . 1 . 1 141 141 CYS N N 15 120.963 0.000 . . . . . . . 230 CYS N . 51058 1 213 . 1 . 1 142 142 ASP H H 1 8.096 0.000 . . . . . . . 231 ASP HN . 51058 1 214 . 1 . 1 142 142 ASP N N 15 121.460 0.000 . . . . . . . 231 ASP N . 51058 1 215 . 1 . 1 143 143 THR H H 1 7.943 0.000 . . . . . . . 232 THR HN . 51058 1 216 . 1 . 1 143 143 THR N N 15 116.092 0.000 . . . . . . . 232 THR N . 51058 1 217 . 1 . 1 144 144 ILE H H 1 9.045 0.000 . . . . . . . 233 ILE HN . 51058 1 218 . 1 . 1 144 144 ILE N N 15 122.929 0.000 . . . . . . . 233 ILE N . 51058 1 219 . 1 . 1 145 145 ILE H H 1 9.223 0.000 . . . . . . . 234 ILE HN . 51058 1 220 . 1 . 1 145 145 ILE N N 15 123.171 0.000 . . . . . . . 234 ILE N . 51058 1 221 . 1 . 1 146 146 LEU H H 1 8.791 0.000 . . . . . . . 235 LEU HN . 51058 1 222 . 1 . 1 146 146 LEU N N 15 125.707 0.000 . . . . . . . 235 LEU N . 51058 1 223 . 1 . 1 147 147 ARG H H 1 9.030 0.000 . . . . . . . 236 ARG HN . 51058 1 224 . 1 . 1 147 147 ARG N N 15 120.200 0.000 . . . . . . . 236 ARG N . 51058 1 225 . 1 . 1 148 148 ASN H H 1 8.208 0.000 . . . . . . . 237 ASN HN . 51058 1 226 . 1 . 1 148 148 ASN N N 15 115.611 0.000 . . . . . . . 237 ASN N . 51058 1 227 . 1 . 1 149 149 ILE H H 1 7.637 0.000 . . . . . . . 238 ILE HN . 51058 1 228 . 1 . 1 149 149 ILE N N 15 116.143 0.000 . . . . . . . 238 ILE N . 51058 1 229 . 1 . 1 150 150 ALA H H 1 9.150 0.000 . . . . . . . 239 ALA HN . 51058 1 230 . 1 . 1 150 150 ALA N N 15 131.474 0.000 . . . . . . . 239 ALA N . 51058 1 231 . 1 . 1 152 152 HIS H H 1 7.957 0.000 . . . . . . . 241 HIS HN . 51058 1 232 . 1 . 1 152 152 HIS N N 15 109.821 0.000 . . . . . . . 241 HIS N . 51058 1 233 . 1 . 1 153 153 THR H H 1 6.795 0.000 . . . . . . . 242 THR HN . 51058 1 234 . 1 . 1 153 153 THR N N 15 121.023 0.000 . . . . . . . 242 THR N . 51058 1 235 . 1 . 1 154 154 VAL H H 1 8.238 0.000 . . . . . . . 243 VAL HN . 51058 1 236 . 1 . 1 154 154 VAL N N 15 119.337 0.000 . . . . . . . 243 VAL N . 51058 1 237 . 1 . 1 155 155 VAL H H 1 8.789 0.000 . . . . . . . 244 VAL HN . 51058 1 238 . 1 . 1 155 155 VAL N N 15 122.478 0.000 . . . . . . . 244 VAL N . 51058 1 239 . 1 . 1 156 156 ASP H H 1 8.746 0.000 . . . . . . . 245 ASP HN . 51058 1 240 . 1 . 1 156 156 ASP N N 15 118.898 0.000 . . . . . . . 245 ASP N . 51058 1 241 . 1 . 1 157 157 SER H H 1 7.490 0.000 . . . . . . . 246 SER HN . 51058 1 242 . 1 . 1 157 157 SER N N 15 113.737 0.000 . . . . . . . 246 SER N . 51058 1 243 . 1 . 1 158 158 ILE H H 1 7.316 0.000 . . . . . . . 247 ILE HN . 51058 1 244 . 1 . 1 158 158 ILE N N 15 122.444 0.000 . . . . . . . 247 ILE N . 51058 1 245 . 1 . 1 159 159 MET H H 1 8.037 0.000 . . . . . . . 248 MET HN . 51058 1 246 . 1 . 1 159 159 MET N N 15 118.193 0.000 . . . . . . . 248 MET N . 51058 1 247 . 1 . 1 160 160 THR H H 1 8.454 0.000 . . . . . . . 249 THR HN . 51058 1 248 . 1 . 1 160 160 THR N N 15 115.616 0.000 . . . . . . . 249 THR N . 51058 1 249 . 1 . 1 161 161 ALA H H 1 7.468 0.000 . . . . . . . 250 ALA HN . 51058 1 250 . 1 . 1 161 161 ALA N N 15 122.774 0.000 . . . . . . . 250 ALA N . 51058 1 251 . 1 . 1 162 162 LEU H H 1 7.586 0.000 . . . . . . . 251 LEU HN . 51058 1 252 . 1 . 1 162 162 LEU N N 15 111.571 0.000 . . . . . . . 251 LEU N . 51058 1 253 . 1 . 1 163 163 SER H H 1 7.912 0.000 . . . . . . . 252 SER HN . 51058 1 254 . 1 . 1 163 163 SER N N 15 117.760 0.000 . . . . . . . 252 SER N . 51058 1 255 . 1 . 1 165 165 TYR H H 1 7.706 0.000 . . . . . . . 254 TYR HN . 51058 1 256 . 1 . 1 165 165 TYR N N 15 113.008 0.000 . . . . . . . 254 TYR N . 51058 1 257 . 1 . 1 166 166 ALA H H 1 7.840 0.000 . . . . . . . 255 ALA HN . 51058 1 258 . 1 . 1 166 166 ALA N N 15 120.012 0.000 . . . . . . . 255 ALA N . 51058 1 259 . 1 . 1 167 167 SER H H 1 8.463 0.000 . . . . . . . 256 SER HN . 51058 1 260 . 1 . 1 167 167 SER N N 15 115.984 0.000 . . . . . . . 256 SER N . 51058 1 261 . 1 . 1 168 168 LEU H H 1 8.024 0.000 . . . . . . . 257 LEU HN . 51058 1 262 . 1 . 1 168 168 LEU N N 15 125.969 0.000 . . . . . . . 257 LEU N . 51058 1 263 . 1 . 1 169 169 ALA H H 1 8.255 0.000 . . . . . . . 258 ALA HN . 51058 1 264 . 1 . 1 169 169 ALA N N 15 122.927 0.000 . . . . . . . 258 ALA N . 51058 1 265 . 1 . 1 170 170 VAL H H 1 8.589 0.000 . . . . . . . 259 VAL HN . 51058 1 266 . 1 . 1 170 170 VAL N N 15 120.319 0.000 . . . . . . . 259 VAL N . 51058 1 267 . 1 . 1 172 172 ASN H H 1 8.084 0.000 . . . . . . . 261 ASN HN . 51058 1 268 . 1 . 1 172 172 ASN N N 15 116.194 0.000 . . . . . . . 261 ASN N . 51058 1 269 . 1 . 1 173 173 ILE H H 1 7.645 0.000 . . . . . . . 262 ILE HN . 51058 1 270 . 1 . 1 173 173 ILE N N 15 119.651 0.000 . . . . . . . 262 ILE N . 51058 1 271 . 1 . 1 174 174 ARG H H 1 9.176 0.000 . . . . . . . 263 ARG HN . 51058 1 272 . 1 . 1 174 174 ARG N N 15 126.567 0.000 . . . . . . . 263 ARG N . 51058 1 273 . 1 . 1 175 175 LEU H H 1 8.854 0.000 . . . . . . . 264 LEU HN . 51058 1 274 . 1 . 1 175 175 LEU N N 15 127.803 0.000 . . . . . . . 264 LEU N . 51058 1 275 . 1 . 1 176 176 ILE H H 1 6.799 0.000 . . . . . . . 265 ILE HN . 51058 1 276 . 1 . 1 176 176 ILE N N 15 124.306 0.000 . . . . . . . 265 ILE N . 51058 1 277 . 1 . 1 177 177 LYS H H 1 8.974 0.000 . . . . . . . 266 LYS HN . 51058 1 278 . 1 . 1 177 177 LYS N N 15 129.554 0.000 . . . . . . . 266 LYS N . 51058 1 279 . 1 . 1 178 178 ASP H H 1 8.596 0.000 . . . . . . . 267 ASP HN . 51058 1 280 . 1 . 1 178 178 ASP N N 15 122.952 0.000 . . . . . . . 267 ASP N . 51058 1 281 . 1 . 1 179 179 LYS H H 1 8.844 0.000 . . . . . . . 268 LYS HN . 51058 1 282 . 1 . 1 179 179 LYS N N 15 126.964 0.000 . . . . . . . 268 LYS N . 51058 1 283 . 1 . 1 180 180 GLN H H 1 8.566 0.000 . . . . . . . 269 GLN HN . 51058 1 284 . 1 . 1 180 180 GLN N N 15 116.725 0.000 . . . . . . . 269 GLN N . 51058 1 285 . 1 . 1 181 181 THR H H 1 8.069 0.000 . . . . . . . 270 THR HN . 51058 1 286 . 1 . 1 181 181 THR N N 15 107.981 0.000 . . . . . . . 270 THR N . 51058 1 287 . 1 . 1 182 182 GLN H H 1 8.229 0.000 . . . . . . . 271 GLN HN . 51058 1 288 . 1 . 1 182 182 GLN N N 15 114.531 0.000 . . . . . . . 271 GLN N . 51058 1 289 . 1 . 1 183 183 GLN H H 1 7.706 0.000 . . . . . . . 272 GLN HN . 51058 1 290 . 1 . 1 183 183 GLN N N 15 116.531 0.000 . . . . . . . 272 GLN N . 51058 1 291 . 1 . 1 184 184 ASN H H 1 8.781 0.000 . . . . . . . 273 ASN HN . 51058 1 292 . 1 . 1 184 184 ASN N N 15 119.443 0.000 . . . . . . . 273 ASN N . 51058 1 293 . 1 . 1 185 185 ARG H H 1 8.363 0.000 . . . . . . . 274 ARG HN . 51058 1 294 . 1 . 1 185 185 ARG N N 15 121.709 0.000 . . . . . . . 274 ARG N . 51058 1 295 . 1 . 1 186 186 GLY H H 1 8.664 0.000 . . . . . . . 275 GLY HN . 51058 1 296 . 1 . 1 186 186 GLY N N 15 104.020 0.000 . . . . . . . 275 GLY N . 51058 1 297 . 1 . 1 187 187 PHE H H 1 6.649 0.000 . . . . . . . 276 PHE HN . 51058 1 298 . 1 . 1 187 187 PHE N N 15 114.550 0.000 . . . . . . . 276 PHE N . 51058 1 299 . 1 . 1 188 188 ALA H H 1 8.933 0.000 . . . . . . . 277 ALA HN . 51058 1 300 . 1 . 1 188 188 ALA N N 15 122.106 0.000 . . . . . . . 277 ALA N . 51058 1 301 . 1 . 1 189 189 PHE H H 1 8.741 0.000 . . . . . . . 278 PHE HN . 51058 1 302 . 1 . 1 189 189 PHE N N 15 118.619 0.000 . . . . . . . 278 PHE N . 51058 1 303 . 1 . 1 190 190 VAL H H 1 9.299 0.000 . . . . . . . 279 VAL HN . 51058 1 304 . 1 . 1 190 190 VAL N N 15 122.964 0.000 . . . . . . . 279 VAL N . 51058 1 305 . 1 . 1 191 191 GLN H H 1 8.864 0.000 . . . . . . . 280 GLN HN . 51058 1 306 . 1 . 1 191 191 GLN N N 15 129.357 0.000 . . . . . . . 280 GLN N . 51058 1 307 . 1 . 1 192 192 LEU H H 1 8.759 0.000 . . . . . . . 281 LEU HN . 51058 1 308 . 1 . 1 192 192 LEU N N 15 127.767 0.000 . . . . . . . 281 LEU N . 51058 1 309 . 1 . 1 193 193 SER H H 1 8.694 0.000 . . . . . . . 282 SER HN . 51058 1 310 . 1 . 1 193 193 SER N N 15 112.372 0.000 . . . . . . . 282 SER N . 51058 1 311 . 1 . 1 194 194 SER H H 1 7.480 0.000 . . . . . . . 283 SER HN . 51058 1 312 . 1 . 1 194 194 SER N N 15 109.831 0.000 . . . . . . . 283 SER N . 51058 1 313 . 1 . 1 195 195 ALA H H 1 8.906 0.000 . . . . . . . 284 ALA HN . 51058 1 314 . 1 . 1 195 195 ALA N N 15 125.091 0.000 . . . . . . . 284 ALA N . 51058 1 315 . 1 . 1 196 196 MET H H 1 8.339 0.000 . . . . . . . 285 MET HN . 51058 1 316 . 1 . 1 196 196 MET N N 15 119.118 0.000 . . . . . . . 285 MET N . 51058 1 317 . 1 . 1 197 197 ASP H H 1 7.913 0.000 . . . . . . . 286 ASP HN . 51058 1 318 . 1 . 1 197 197 ASP N N 15 120.099 0.000 . . . . . . . 286 ASP N . 51058 1 319 . 1 . 1 198 198 ALA H H 1 7.922 0.000 . . . . . . . 287 ALA HN . 51058 1 320 . 1 . 1 198 198 ALA N N 15 122.842 0.000 . . . . . . . 287 ALA N . 51058 1 321 . 1 . 1 199 199 SER H H 1 8.539 0.000 . . . . . . . 288 SER HN . 51058 1 322 . 1 . 1 199 199 SER N N 15 112.746 0.000 . . . . . . . 288 SER N . 51058 1 323 . 1 . 1 200 200 GLN H H 1 8.128 0.000 . . . . . . . 289 GLN HN . 51058 1 324 . 1 . 1 200 200 GLN N N 15 120.139 0.000 . . . . . . . 289 GLN N . 51058 1 325 . 1 . 1 201 201 LEU H H 1 7.867 0.000 . . . . . . . 290 LEU HN . 51058 1 326 . 1 . 1 201 201 LEU N N 15 119.480 0.000 . . . . . . . 290 LEU N . 51058 1 327 . 1 . 1 202 202 LEU H H 1 8.401 0.000 . . . . . . . 291 LEU HN . 51058 1 328 . 1 . 1 202 202 LEU N N 15 119.773 0.000 . . . . . . . 291 LEU N . 51058 1 329 . 1 . 1 203 203 GLN H H 1 7.768 0.000 . . . . . . . 292 GLN HN . 51058 1 330 . 1 . 1 203 203 GLN N N 15 116.116 0.000 . . . . . . . 292 GLN N . 51058 1 331 . 1 . 1 204 204 ILE H H 1 7.757 0.000 . . . . . . . 293 ILE HN . 51058 1 332 . 1 . 1 204 204 ILE N N 15 120.381 0.000 . . . . . . . 293 ILE N . 51058 1 333 . 1 . 1 205 205 LEU H H 1 8.510 0.000 . . . . . . . 294 LEU HN . 51058 1 334 . 1 . 1 205 205 LEU N N 15 117.964 0.000 . . . . . . . 294 LEU N . 51058 1 335 . 1 . 1 206 206 GLN H H 1 8.485 0.000 . . . . . . . 295 GLN HN . 51058 1 336 . 1 . 1 206 206 GLN N N 15 115.722 0.000 . . . . . . . 295 GLN N . 51058 1 337 . 1 . 1 207 207 SER H H 1 7.391 0.000 . . . . . . . 296 SER HN . 51058 1 338 . 1 . 1 207 207 SER N N 15 113.085 0.000 . . . . . . . 296 SER N . 51058 1 339 . 1 . 1 208 208 LEU H H 1 6.743 0.000 . . . . . . . 297 LEU HN . 51058 1 340 . 1 . 1 208 208 LEU N N 15 122.927 0.000 . . . . . . . 297 LEU N . 51058 1 341 . 1 . 1 209 209 HIS H H 1 8.262 0.000 . . . . . . . 298 HIS HN . 51058 1 342 . 1 . 1 209 209 HIS N N 15 120.647 0.000 . . . . . . . 298 HIS N . 51058 1 343 . 1 . 1 212 212 LEU H H 1 8.338 0.000 . . . . . . . 301 LEU HN . 51058 1 344 . 1 . 1 212 212 LEU N N 15 121.504 0.000 . . . . . . . 301 LEU N . 51058 1 345 . 1 . 1 213 213 LYS H H 1 7.973 0.000 . . . . . . . 302 LYS HN . 51058 1 346 . 1 . 1 213 213 LYS N N 15 126.165 0.000 . . . . . . . 302 LYS N . 51058 1 347 . 1 . 1 214 214 ILE H H 1 8.181 0.000 . . . . . . . 303 ILE HN . 51058 1 348 . 1 . 1 214 214 ILE N N 15 119.796 0.000 . . . . . . . 303 ILE N . 51058 1 349 . 1 . 1 215 215 ASP H H 1 9.645 0.000 . . . . . . . 304 ASP HN . 51058 1 350 . 1 . 1 215 215 ASP N N 15 130.573 0.000 . . . . . . . 304 ASP N . 51058 1 351 . 1 . 1 216 216 GLY H H 1 8.535 0.000 . . . . . . . 305 GLY HN . 51058 1 352 . 1 . 1 216 216 GLY N N 15 101.565 0.000 . . . . . . . 305 GLY N . 51058 1 353 . 1 . 1 217 217 LYS H H 1 7.522 0.000 . . . . . . . 306 LYS HN . 51058 1 354 . 1 . 1 217 217 LYS N N 15 120.691 0.000 . . . . . . . 306 LYS N . 51058 1 355 . 1 . 1 218 218 THR H H 1 8.669 0.000 . . . . . . . 307 THR HN . 51058 1 356 . 1 . 1 218 218 THR N N 15 119.598 0.000 . . . . . . . 307 THR N . 51058 1 357 . 1 . 1 219 219 ILE H H 1 8.329 0.000 . . . . . . . 308 ILE HN . 51058 1 358 . 1 . 1 219 219 ILE N N 15 131.959 0.000 . . . . . . . 308 ILE N . 51058 1 359 . 1 . 1 220 220 GLY H H 1 7.984 0.000 . . . . . . . 309 GLY HN . 51058 1 360 . 1 . 1 220 220 GLY N N 15 114.171 0.000 . . . . . . . 309 GLY N . 51058 1 361 . 1 . 1 221 221 VAL H H 1 8.363 0.000 . . . . . . . 310 VAL HN . 51058 1 362 . 1 . 1 221 221 VAL N N 15 118.979 0.000 . . . . . . . 310 VAL N . 51058 1 363 . 1 . 1 222 222 ASP H H 1 8.313 0.000 . . . . . . . 311 ASP HN . 51058 1 364 . 1 . 1 222 222 ASP N N 15 123.247 0.000 . . . . . . . 311 ASP N . 51058 1 365 . 1 . 1 223 223 PHE H H 1 9.152 0.000 . . . . . . . 312 PHE HN . 51058 1 366 . 1 . 1 223 223 PHE N N 15 119.751 0.000 . . . . . . . 312 PHE N . 51058 1 367 . 1 . 1 224 224 ALA H H 1 8.425 0.000 . . . . . . . 313 ALA HN . 51058 1 368 . 1 . 1 224 224 ALA N N 15 123.822 0.000 . . . . . . . 313 ALA N . 51058 1 369 . 1 . 1 225 225 LYS H H 1 8.126 0.000 . . . . . . . 314 LYS HN . 51058 1 370 . 1 . 1 225 225 LYS N N 15 121.068 0.000 . . . . . . . 314 LYS N . 51058 1 371 . 1 . 1 226 226 SER H H 1 7.883 0.000 . . . . . . . 315 SER HN . 51058 1 372 . 1 . 1 226 226 SER N N 15 122.876 0.000 . . . . . . . 315 SER N . 51058 1 stop_ save_