data_19087 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 19087 _Entry.Title ; The NMR chemical shift assignments for backbone 1H, 13C, and 15N of VirR (Rv0431) ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2013-03-13 _Entry.Accession_date 2013-03-13 _Entry.Last_release_date 2014-02-24 _Entry.Original_release_date 2014-02-24 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype SOLUTION _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.Entry_ID 1 Chengdong Huang . . . 19087 2 Tao Wang . . . 19087 3 Huilin Li . . . 19087 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID 1 'not applicable' 'not applicable' . 19087 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID PROTEIN . 19087 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 19087 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 351 19087 '15N chemical shifts' 88 19087 '1H chemical shifts' 471 19087 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 . . 2014-02-24 2013-03-13 original author . 19087 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 19087 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 24248369 _Citation.Full_citation . _Citation.Title 'Genetic regulation of vesiculogenesis and immunomodulation in Mycobacterium tuberculosis' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Proc. Natl. Acad. Sci. U. S. A.' _Citation.Journal_name_full . _Citation.Journal_volume 110 _Citation.Journal_issue 49 _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 E4790 _Citation.Page_last E4797 _Citation.Year 2013 _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.Entry_ID _Citation_author.Citation_ID 1 Poonam Rath . . . 19087 1 2 Chengdong Huang . . . 19087 1 3 Tao Wang . . . 19087 1 4 Tianzhi Wang . . . 19087 1 5 Huilin Li . . . 19087 1 6 Rafael Prados-Rosales . . . 19087 1 7 Olivier Elemento . . . 19087 1 8 Arturo Casadevall . . . 19087 1 9 Carl Nathan . F. . 19087 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 19087 _Assembly.ID 1 _Assembly.Name 'C-terminal RV0431' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _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 'C-terminal RV0431' 1 $entity A . yes native no no . . . 19087 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity _Entity.Sf_category entity _Entity.Sf_framecode entity _Entity.Entry_ID 19087 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GSSPNSEDDSSAISTMTTTT AAPTSTSVKPAAPRAEVRVY NISGTEGAAARTADRLKAAG FTVTDVGNLSLPDVAATTVY YTEVEGERATADAVGRTLGA AVELRLPELSDQPPGVIVVV TGGSSPNSEDDSSAISTMTT TTAAPTSTSVKPAAPRAEVR VYNISGTEGAAARTADRLKA AGFTVTDVGNLSLPDVAATT VYYTEVEGERATADAVGRTL GAAVELRLPELSDQPPGVIV VVTGGSSPNSEDDSSAISTM TTTTAAPTSTSVKPAAPRAE VRVYNISGTEGAAARTADRL KAAGFTVTDVGNLSLPDVAA TTVYYTEVEGERATADAVGR TLGAAVELRLPELSDQPPGV IVVVTG ; _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 366 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 37006.906 _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 . GLY . 19087 1 2 . SER . 19087 1 3 . SER . 19087 1 4 . PRO . 19087 1 5 . ASN . 19087 1 6 . SER . 19087 1 7 . GLU . 19087 1 8 . ASP . 19087 1 9 . ASP . 19087 1 10 . SER . 19087 1 11 . SER . 19087 1 12 . ALA . 19087 1 13 . ILE . 19087 1 14 . SER . 19087 1 15 . THR . 19087 1 16 . MET . 19087 1 17 . THR . 19087 1 18 . THR . 19087 1 19 . THR . 19087 1 20 . THR . 19087 1 21 . ALA . 19087 1 22 . ALA . 19087 1 23 . PRO . 19087 1 24 . THR . 19087 1 25 . SER . 19087 1 26 . THR . 19087 1 27 . SER . 19087 1 28 . VAL . 19087 1 29 . LYS . 19087 1 30 . PRO . 19087 1 31 . ALA . 19087 1 32 . ALA . 19087 1 33 . PRO . 19087 1 34 . ARG . 19087 1 35 . ALA . 19087 1 36 . GLU . 19087 1 37 . VAL . 19087 1 38 . ARG . 19087 1 39 . VAL . 19087 1 40 . TYR . 19087 1 41 . ASN . 19087 1 42 . ILE . 19087 1 43 . SER . 19087 1 44 . GLY . 19087 1 45 . THR . 19087 1 46 . GLU . 19087 1 47 . GLY . 19087 1 48 . ALA . 19087 1 49 . ALA . 19087 1 50 . ALA . 19087 1 51 . ARG . 19087 1 52 . THR . 19087 1 53 . ALA . 19087 1 54 . ASP . 19087 1 55 . ARG . 19087 1 56 . LEU . 19087 1 57 . LYS . 19087 1 58 . ALA . 19087 1 59 . ALA . 19087 1 60 . GLY . 19087 1 61 . PHE . 19087 1 62 . THR . 19087 1 63 . VAL . 19087 1 64 . THR . 19087 1 65 . ASP . 19087 1 66 . VAL . 19087 1 67 . GLY . 19087 1 68 . ASN . 19087 1 69 . LEU . 19087 1 70 . SER . 19087 1 71 . LEU . 19087 1 72 . PRO . 19087 1 73 . ASP . 19087 1 74 . VAL . 19087 1 75 . ALA . 19087 1 76 . ALA . 19087 1 77 . THR . 19087 1 78 . THR . 19087 1 79 . VAL . 19087 1 80 . TYR . 19087 1 81 . TYR . 19087 1 82 . THR . 19087 1 83 . GLU . 19087 1 84 . VAL . 19087 1 85 . GLU . 19087 1 86 . GLY . 19087 1 87 . GLU . 19087 1 88 . ARG . 19087 1 89 . ALA . 19087 1 90 . THR . 19087 1 91 . ALA . 19087 1 92 . ASP . 19087 1 93 . ALA . 19087 1 94 . VAL . 19087 1 95 . GLY . 19087 1 96 . ARG . 19087 1 97 . THR . 19087 1 98 . LEU . 19087 1 99 . GLY . 19087 1 100 . ALA . 19087 1 101 . ALA . 19087 1 102 . VAL . 19087 1 103 . GLU . 19087 1 104 . LEU . 19087 1 105 . ARG . 19087 1 106 . LEU . 19087 1 107 . PRO . 19087 1 108 . GLU . 19087 1 109 . LEU . 19087 1 110 . SER . 19087 1 111 . ASP . 19087 1 112 . GLN . 19087 1 113 . PRO . 19087 1 114 . PRO . 19087 1 115 . GLY . 19087 1 116 . VAL . 19087 1 117 . ILE . 19087 1 118 . VAL . 19087 1 119 . VAL . 19087 1 120 . VAL . 19087 1 121 . THR . 19087 1 122 . GLY . 19087 1 123 . GLY . 19087 1 124 . SER . 19087 1 125 . SER . 19087 1 126 . PRO . 19087 1 127 . ASN . 19087 1 128 . SER . 19087 1 129 . GLU . 19087 1 130 . ASP . 19087 1 131 . ASP . 19087 1 132 . SER . 19087 1 133 . SER . 19087 1 134 . ALA . 19087 1 135 . ILE . 19087 1 136 . SER . 19087 1 137 . THR . 19087 1 138 . MET . 19087 1 139 . THR . 19087 1 140 . THR . 19087 1 141 . THR . 19087 1 142 . THR . 19087 1 143 . ALA . 19087 1 144 . ALA . 19087 1 145 . PRO . 19087 1 146 . THR . 19087 1 147 . SER . 19087 1 148 . THR . 19087 1 149 . SER . 19087 1 150 . VAL . 19087 1 151 . LYS . 19087 1 152 . PRO . 19087 1 153 . ALA . 19087 1 154 . ALA . 19087 1 155 . PRO . 19087 1 156 . ARG . 19087 1 157 . ALA . 19087 1 158 . GLU . 19087 1 159 . VAL . 19087 1 160 . ARG . 19087 1 161 . VAL . 19087 1 162 . TYR . 19087 1 163 . ASN . 19087 1 164 . ILE . 19087 1 165 . SER . 19087 1 166 . GLY . 19087 1 167 . THR . 19087 1 168 . GLU . 19087 1 169 . GLY . 19087 1 170 . ALA . 19087 1 171 . ALA . 19087 1 172 . ALA . 19087 1 173 . ARG . 19087 1 174 . THR . 19087 1 175 . ALA . 19087 1 176 . ASP . 19087 1 177 . ARG . 19087 1 178 . LEU . 19087 1 179 . LYS . 19087 1 180 . ALA . 19087 1 181 . ALA . 19087 1 182 . GLY . 19087 1 183 . PHE . 19087 1 184 . THR . 19087 1 185 . VAL . 19087 1 186 . THR . 19087 1 187 . ASP . 19087 1 188 . VAL . 19087 1 189 . GLY . 19087 1 190 . ASN . 19087 1 191 . LEU . 19087 1 192 . SER . 19087 1 193 . LEU . 19087 1 194 . PRO . 19087 1 195 . ASP . 19087 1 196 . VAL . 19087 1 197 . ALA . 19087 1 198 . ALA . 19087 1 199 . THR . 19087 1 200 . THR . 19087 1 201 . VAL . 19087 1 202 . TYR . 19087 1 203 . TYR . 19087 1 204 . THR . 19087 1 205 . GLU . 19087 1 206 . VAL . 19087 1 207 . GLU . 19087 1 208 . GLY . 19087 1 209 . GLU . 19087 1 210 . ARG . 19087 1 211 . ALA . 19087 1 212 . THR . 19087 1 213 . ALA . 19087 1 214 . ASP . 19087 1 215 . ALA . 19087 1 216 . VAL . 19087 1 217 . GLY . 19087 1 218 . ARG . 19087 1 219 . THR . 19087 1 220 . LEU . 19087 1 221 . GLY . 19087 1 222 . ALA . 19087 1 223 . ALA . 19087 1 224 . VAL . 19087 1 225 . GLU . 19087 1 226 . LEU . 19087 1 227 . ARG . 19087 1 228 . LEU . 19087 1 229 . PRO . 19087 1 230 . GLU . 19087 1 231 . LEU . 19087 1 232 . SER . 19087 1 233 . ASP . 19087 1 234 . GLN . 19087 1 235 . PRO . 19087 1 236 . PRO . 19087 1 237 . GLY . 19087 1 238 . VAL . 19087 1 239 . ILE . 19087 1 240 . VAL . 19087 1 241 . VAL . 19087 1 242 . VAL . 19087 1 243 . THR . 19087 1 244 . GLY . 19087 1 245 . GLY . 19087 1 246 . SER . 19087 1 247 . SER . 19087 1 248 . PRO . 19087 1 249 . ASN . 19087 1 250 . SER . 19087 1 251 . GLU . 19087 1 252 . ASP . 19087 1 253 . ASP . 19087 1 254 . SER . 19087 1 255 . SER . 19087 1 256 . ALA . 19087 1 257 . ILE . 19087 1 258 . SER . 19087 1 259 . THR . 19087 1 260 . MET . 19087 1 261 . THR . 19087 1 262 . THR . 19087 1 263 . THR . 19087 1 264 . THR . 19087 1 265 . ALA . 19087 1 266 . ALA . 19087 1 267 . PRO . 19087 1 268 . THR . 19087 1 269 . SER . 19087 1 270 . THR . 19087 1 271 . SER . 19087 1 272 . VAL . 19087 1 273 . LYS . 19087 1 274 . PRO . 19087 1 275 . ALA . 19087 1 276 . ALA . 19087 1 277 . PRO . 19087 1 278 . ARG . 19087 1 279 . ALA . 19087 1 280 . GLU . 19087 1 281 . VAL . 19087 1 282 . ARG . 19087 1 283 . VAL . 19087 1 284 . TYR . 19087 1 285 . ASN . 19087 1 286 . ILE . 19087 1 287 . SER . 19087 1 288 . GLY . 19087 1 289 . THR . 19087 1 290 . GLU . 19087 1 291 . GLY . 19087 1 292 . ALA . 19087 1 293 . ALA . 19087 1 294 . ALA . 19087 1 295 . ARG . 19087 1 296 . THR . 19087 1 297 . ALA . 19087 1 298 . ASP . 19087 1 299 . ARG . 19087 1 300 . LEU . 19087 1 301 . LYS . 19087 1 302 . ALA . 19087 1 303 . ALA . 19087 1 304 . GLY . 19087 1 305 . PHE . 19087 1 306 . THR . 19087 1 307 . VAL . 19087 1 308 . THR . 19087 1 309 . ASP . 19087 1 310 . VAL . 19087 1 311 . GLY . 19087 1 312 . ASN . 19087 1 313 . LEU . 19087 1 314 . SER . 19087 1 315 . LEU . 19087 1 316 . PRO . 19087 1 317 . ASP . 19087 1 318 . VAL . 19087 1 319 . ALA . 19087 1 320 . ALA . 19087 1 321 . THR . 19087 1 322 . THR . 19087 1 323 . VAL . 19087 1 324 . TYR . 19087 1 325 . TYR . 19087 1 326 . THR . 19087 1 327 . GLU . 19087 1 328 . VAL . 19087 1 329 . GLU . 19087 1 330 . GLY . 19087 1 331 . GLU . 19087 1 332 . ARG . 19087 1 333 . ALA . 19087 1 334 . THR . 19087 1 335 . ALA . 19087 1 336 . ASP . 19087 1 337 . ALA . 19087 1 338 . VAL . 19087 1 339 . GLY . 19087 1 340 . ARG . 19087 1 341 . THR . 19087 1 342 . LEU . 19087 1 343 . GLY . 19087 1 344 . ALA . 19087 1 345 . ALA . 19087 1 346 . VAL . 19087 1 347 . GLU . 19087 1 348 . LEU . 19087 1 349 . ARG . 19087 1 350 . LEU . 19087 1 351 . PRO . 19087 1 352 . GLU . 19087 1 353 . LEU . 19087 1 354 . SER . 19087 1 355 . ASP . 19087 1 356 . GLN . 19087 1 357 . PRO . 19087 1 358 . PRO . 19087 1 359 . GLY . 19087 1 360 . VAL . 19087 1 361 . ILE . 19087 1 362 . VAL . 19087 1 363 . VAL . 19087 1 364 . VAL . 19087 1 365 . THR . 19087 1 366 . GLY . 19087 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 19087 1 . SER 2 2 19087 1 . SER 3 3 19087 1 . PRO 4 4 19087 1 . ASN 5 5 19087 1 . SER 6 6 19087 1 . GLU 7 7 19087 1 . ASP 8 8 19087 1 . ASP 9 9 19087 1 . SER 10 10 19087 1 . SER 11 11 19087 1 . ALA 12 12 19087 1 . ILE 13 13 19087 1 . SER 14 14 19087 1 . THR 15 15 19087 1 . MET 16 16 19087 1 . THR 17 17 19087 1 . THR 18 18 19087 1 . THR 19 19 19087 1 . THR 20 20 19087 1 . ALA 21 21 19087 1 . ALA 22 22 19087 1 . PRO 23 23 19087 1 . THR 24 24 19087 1 . SER 25 25 19087 1 . THR 26 26 19087 1 . SER 27 27 19087 1 . VAL 28 28 19087 1 . LYS 29 29 19087 1 . PRO 30 30 19087 1 . ALA 31 31 19087 1 . ALA 32 32 19087 1 . PRO 33 33 19087 1 . ARG 34 34 19087 1 . ALA 35 35 19087 1 . GLU 36 36 19087 1 . VAL 37 37 19087 1 . ARG 38 38 19087 1 . VAL 39 39 19087 1 . TYR 40 40 19087 1 . ASN 41 41 19087 1 . ILE 42 42 19087 1 . SER 43 43 19087 1 . GLY 44 44 19087 1 . THR 45 45 19087 1 . GLU 46 46 19087 1 . GLY 47 47 19087 1 . ALA 48 48 19087 1 . ALA 49 49 19087 1 . ALA 50 50 19087 1 . ARG 51 51 19087 1 . THR 52 52 19087 1 . ALA 53 53 19087 1 . ASP 54 54 19087 1 . ARG 55 55 19087 1 . LEU 56 56 19087 1 . LYS 57 57 19087 1 . ALA 58 58 19087 1 . ALA 59 59 19087 1 . GLY 60 60 19087 1 . PHE 61 61 19087 1 . THR 62 62 19087 1 . VAL 63 63 19087 1 . THR 64 64 19087 1 . ASP 65 65 19087 1 . VAL 66 66 19087 1 . GLY 67 67 19087 1 . ASN 68 68 19087 1 . LEU 69 69 19087 1 . SER 70 70 19087 1 . LEU 71 71 19087 1 . PRO 72 72 19087 1 . ASP 73 73 19087 1 . VAL 74 74 19087 1 . ALA 75 75 19087 1 . ALA 76 76 19087 1 . THR 77 77 19087 1 . THR 78 78 19087 1 . VAL 79 79 19087 1 . TYR 80 80 19087 1 . TYR 81 81 19087 1 . THR 82 82 19087 1 . GLU 83 83 19087 1 . VAL 84 84 19087 1 . GLU 85 85 19087 1 . GLY 86 86 19087 1 . GLU 87 87 19087 1 . ARG 88 88 19087 1 . ALA 89 89 19087 1 . THR 90 90 19087 1 . ALA 91 91 19087 1 . ASP 92 92 19087 1 . ALA 93 93 19087 1 . VAL 94 94 19087 1 . GLY 95 95 19087 1 . ARG 96 96 19087 1 . THR 97 97 19087 1 . LEU 98 98 19087 1 . GLY 99 99 19087 1 . ALA 100 100 19087 1 . ALA 101 101 19087 1 . VAL 102 102 19087 1 . GLU 103 103 19087 1 . LEU 104 104 19087 1 . ARG 105 105 19087 1 . LEU 106 106 19087 1 . PRO 107 107 19087 1 . GLU 108 108 19087 1 . LEU 109 109 19087 1 . SER 110 110 19087 1 . ASP 111 111 19087 1 . GLN 112 112 19087 1 . PRO 113 113 19087 1 . PRO 114 114 19087 1 . GLY 115 115 19087 1 . VAL 116 116 19087 1 . ILE 117 117 19087 1 . VAL 118 118 19087 1 . VAL 119 119 19087 1 . VAL 120 120 19087 1 . THR 121 121 19087 1 . GLY 122 122 19087 1 . GLY 123 123 19087 1 . SER 124 124 19087 1 . SER 125 125 19087 1 . PRO 126 126 19087 1 . ASN 127 127 19087 1 . SER 128 128 19087 1 . GLU 129 129 19087 1 . ASP 130 130 19087 1 . ASP 131 131 19087 1 . SER 132 132 19087 1 . SER 133 133 19087 1 . ALA 134 134 19087 1 . ILE 135 135 19087 1 . SER 136 136 19087 1 . THR 137 137 19087 1 . MET 138 138 19087 1 . THR 139 139 19087 1 . THR 140 140 19087 1 . THR 141 141 19087 1 . THR 142 142 19087 1 . ALA 143 143 19087 1 . ALA 144 144 19087 1 . PRO 145 145 19087 1 . THR 146 146 19087 1 . SER 147 147 19087 1 . THR 148 148 19087 1 . SER 149 149 19087 1 . VAL 150 150 19087 1 . LYS 151 151 19087 1 . PRO 152 152 19087 1 . ALA 153 153 19087 1 . ALA 154 154 19087 1 . PRO 155 155 19087 1 . ARG 156 156 19087 1 . ALA 157 157 19087 1 . GLU 158 158 19087 1 . VAL 159 159 19087 1 . ARG 160 160 19087 1 . VAL 161 161 19087 1 . TYR 162 162 19087 1 . ASN 163 163 19087 1 . ILE 164 164 19087 1 . SER 165 165 19087 1 . GLY 166 166 19087 1 . THR 167 167 19087 1 . GLU 168 168 19087 1 . GLY 169 169 19087 1 . ALA 170 170 19087 1 . ALA 171 171 19087 1 . ALA 172 172 19087 1 . ARG 173 173 19087 1 . THR 174 174 19087 1 . ALA 175 175 19087 1 . ASP 176 176 19087 1 . ARG 177 177 19087 1 . LEU 178 178 19087 1 . LYS 179 179 19087 1 . ALA 180 180 19087 1 . ALA 181 181 19087 1 . GLY 182 182 19087 1 . PHE 183 183 19087 1 . THR 184 184 19087 1 . VAL 185 185 19087 1 . THR 186 186 19087 1 . ASP 187 187 19087 1 . VAL 188 188 19087 1 . GLY 189 189 19087 1 . ASN 190 190 19087 1 . LEU 191 191 19087 1 . SER 192 192 19087 1 . LEU 193 193 19087 1 . PRO 194 194 19087 1 . ASP 195 195 19087 1 . VAL 196 196 19087 1 . ALA 197 197 19087 1 . ALA 198 198 19087 1 . THR 199 199 19087 1 . THR 200 200 19087 1 . VAL 201 201 19087 1 . TYR 202 202 19087 1 . TYR 203 203 19087 1 . THR 204 204 19087 1 . GLU 205 205 19087 1 . VAL 206 206 19087 1 . GLU 207 207 19087 1 . GLY 208 208 19087 1 . GLU 209 209 19087 1 . ARG 210 210 19087 1 . ALA 211 211 19087 1 . THR 212 212 19087 1 . ALA 213 213 19087 1 . ASP 214 214 19087 1 . ALA 215 215 19087 1 . VAL 216 216 19087 1 . GLY 217 217 19087 1 . ARG 218 218 19087 1 . THR 219 219 19087 1 . LEU 220 220 19087 1 . GLY 221 221 19087 1 . ALA 222 222 19087 1 . ALA 223 223 19087 1 . VAL 224 224 19087 1 . GLU 225 225 19087 1 . LEU 226 226 19087 1 . ARG 227 227 19087 1 . LEU 228 228 19087 1 . PRO 229 229 19087 1 . GLU 230 230 19087 1 . LEU 231 231 19087 1 . SER 232 232 19087 1 . ASP 233 233 19087 1 . GLN 234 234 19087 1 . PRO 235 235 19087 1 . PRO 236 236 19087 1 . GLY 237 237 19087 1 . VAL 238 238 19087 1 . ILE 239 239 19087 1 . VAL 240 240 19087 1 . VAL 241 241 19087 1 . VAL 242 242 19087 1 . THR 243 243 19087 1 . GLY 244 244 19087 1 . GLY 245 245 19087 1 . SER 246 246 19087 1 . SER 247 247 19087 1 . PRO 248 248 19087 1 . ASN 249 249 19087 1 . SER 250 250 19087 1 . GLU 251 251 19087 1 . ASP 252 252 19087 1 . ASP 253 253 19087 1 . SER 254 254 19087 1 . SER 255 255 19087 1 . ALA 256 256 19087 1 . ILE 257 257 19087 1 . SER 258 258 19087 1 . THR 259 259 19087 1 . MET 260 260 19087 1 . THR 261 261 19087 1 . THR 262 262 19087 1 . THR 263 263 19087 1 . THR 264 264 19087 1 . ALA 265 265 19087 1 . ALA 266 266 19087 1 . PRO 267 267 19087 1 . THR 268 268 19087 1 . SER 269 269 19087 1 . THR 270 270 19087 1 . SER 271 271 19087 1 . VAL 272 272 19087 1 . LYS 273 273 19087 1 . PRO 274 274 19087 1 . ALA 275 275 19087 1 . ALA 276 276 19087 1 . PRO 277 277 19087 1 . ARG 278 278 19087 1 . ALA 279 279 19087 1 . GLU 280 280 19087 1 . VAL 281 281 19087 1 . ARG 282 282 19087 1 . VAL 283 283 19087 1 . TYR 284 284 19087 1 . ASN 285 285 19087 1 . ILE 286 286 19087 1 . SER 287 287 19087 1 . GLY 288 288 19087 1 . THR 289 289 19087 1 . GLU 290 290 19087 1 . GLY 291 291 19087 1 . ALA 292 292 19087 1 . ALA 293 293 19087 1 . ALA 294 294 19087 1 . ARG 295 295 19087 1 . THR 296 296 19087 1 . ALA 297 297 19087 1 . ASP 298 298 19087 1 . ARG 299 299 19087 1 . LEU 300 300 19087 1 . LYS 301 301 19087 1 . ALA 302 302 19087 1 . ALA 303 303 19087 1 . GLY 304 304 19087 1 . PHE 305 305 19087 1 . THR 306 306 19087 1 . VAL 307 307 19087 1 . THR 308 308 19087 1 . ASP 309 309 19087 1 . VAL 310 310 19087 1 . GLY 311 311 19087 1 . ASN 312 312 19087 1 . LEU 313 313 19087 1 . SER 314 314 19087 1 . LEU 315 315 19087 1 . PRO 316 316 19087 1 . ASP 317 317 19087 1 . VAL 318 318 19087 1 . ALA 319 319 19087 1 . ALA 320 320 19087 1 . THR 321 321 19087 1 . THR 322 322 19087 1 . VAL 323 323 19087 1 . TYR 324 324 19087 1 . TYR 325 325 19087 1 . THR 326 326 19087 1 . GLU 327 327 19087 1 . VAL 328 328 19087 1 . GLU 329 329 19087 1 . GLY 330 330 19087 1 . GLU 331 331 19087 1 . ARG 332 332 19087 1 . ALA 333 333 19087 1 . THR 334 334 19087 1 . ALA 335 335 19087 1 . ASP 336 336 19087 1 . ALA 337 337 19087 1 . VAL 338 338 19087 1 . GLY 339 339 19087 1 . ARG 340 340 19087 1 . THR 341 341 19087 1 . LEU 342 342 19087 1 . GLY 343 343 19087 1 . ALA 344 344 19087 1 . ALA 345 345 19087 1 . VAL 346 346 19087 1 . GLU 347 347 19087 1 . LEU 348 348 19087 1 . ARG 349 349 19087 1 . LEU 350 350 19087 1 . PRO 351 351 19087 1 . GLU 352 352 19087 1 . LEU 353 353 19087 1 . SER 354 354 19087 1 . ASP 355 355 19087 1 . GLN 356 356 19087 1 . PRO 357 357 19087 1 . PRO 358 358 19087 1 . GLY 359 359 19087 1 . VAL 360 360 19087 1 . ILE 361 361 19087 1 . VAL 362 362 19087 1 . VAL 363 363 19087 1 . VAL 364 364 19087 1 . THR 365 365 19087 1 . GLY 366 366 19087 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 19087 _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.Subvariant _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.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity . 1773 organism . 'Mycobacterium tuberculosis' 'Bacillus tuberculosis' . . Bacteria . Mycobacterium tuberculosis . . . . . . . . . . . . . . . . . . . . . 19087 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source _Entity_experimental_src_list.Entry_ID 19087 _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_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _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.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . . . . . . . . . . . unknown . . . . . . 19087 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 19087 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'C-terminal RV0431' '[U-100% 13C; U-100% 15N]' . . 1 $entity . . . . . . . . . . 19087 1 2 'potassium phosphate' 'natural abundance' . . . . . . 0.5 . . mM . . . . 19087 1 3 H2O 'natural abundance' . . . . . . 90 . . % . . . . 19087 1 4 D2O 'natural abundance' . . . . . . 10 . . % . . . . 19087 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 19087 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0.5 . mM 19087 1 pH 7.0 . pH 19087 1 pressure 1 . atm 19087 1 temperature 303 . K 19087 1 stop_ save_ ############################ # Computer software used # ############################ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 19087 _Software.ID 1 _Software.Name CYANA _Software.Version 3.0 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . 19087 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 19087 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 19087 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 19087 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker Avance . 700 . . . 19087 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 19087 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19087 1 2 '3D CBCA(CO)NH' no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19087 1 3 '3D HNCO' no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19087 1 4 '3D HNCA' no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19087 1 5 '3D HNCACB' no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19087 1 6 '3D HCCH-TOCSY' no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19087 1 7 '3D 1H-15N TOCSY' no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19087 1 8 '3D 1H-13C NOESY' no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19087 1 9 '3D 1H-13C NOESY aliphatic' no 1 $NMR_spectrometer_expt . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19087 1 stop_ save_ save_NMR_spectrometer_expt _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spectrometer_expt _NMR_spec_expt.Entry_ID 19087 _NMR_spec_expt.ID 1 _NMR_spec_expt.Name . _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_1 _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID 1 _NMR_spec_expt.Software_label $CYANA _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 19087 _Chem_shift_reference.ID 1 _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.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . . . . . 19087 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 19087 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . . . . . 19087 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 19087 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 19087 1 3 '3D HNCO' . . . 19087 1 5 '3D HNCACB' . . . 19087 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.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 6 6 SER HB2 H 1 3.8984 . . 2 . . . A 6 SER HB2 . 19087 1 2 . 1 1 6 6 SER C C 13 174.6646 . . 1 . . . A 6 SER C . 19087 1 3 . 1 1 6 6 SER CA C 13 58.7445 . . 1 . . . A 6 SER CA . 19087 1 4 . 1 1 6 6 SER CB C 13 63.8704 . . 1 . . . A 6 SER CB . 19087 1 5 . 1 1 7 7 GLU H H 1 8.4746 . . 1 . . . A 7 GLU H . 19087 1 6 . 1 1 7 7 GLU HA H 1 4.7279 . . 1 . . . A 7 GLU HA . 19087 1 7 . 1 1 7 7 GLU HB3 H 1 1.9946 . . 2 . . . A 7 GLU HB3 . 19087 1 8 . 1 1 7 7 GLU HG2 H 1 2.2574 . . 2 . . . A 7 GLU HG2 . 19087 1 9 . 1 1 7 7 GLU C C 13 176.2791 . . 1 . . . A 7 GLU C . 19087 1 10 . 1 1 7 7 GLU CA C 13 56.8940 . . 1 . . . A 7 GLU CA . 19087 1 11 . 1 1 7 7 GLU CB C 13 30.2093 . . 1 . . . A 7 GLU CB . 19087 1 12 . 1 1 7 7 GLU CG C 13 36.5236 . . 1 . . . A 7 GLU CG . 19087 1 13 . 1 1 7 7 GLU N N 15 122.2781 . . 1 . . . A 7 GLU N . 19087 1 14 . 1 1 8 8 ASP H H 1 8.2063 . . 1 . . . A 8 ASP H . 19087 1 15 . 1 1 8 8 ASP HA H 1 4.7092 . . 1 . . . A 8 ASP HA . 19087 1 16 . 1 1 8 8 ASP HB2 H 1 2.6827 . . 2 . . . A 8 ASP HB2 . 19087 1 17 . 1 1 8 8 ASP C C 13 176.0700 . . 1 . . . A 8 ASP C . 19087 1 18 . 1 1 8 8 ASP CA C 13 54.3663 . . 1 . . . A 8 ASP CA . 19087 1 19 . 1 1 8 8 ASP CB C 13 41.4587 . . 1 . . . A 8 ASP CB . 19087 1 20 . 1 1 8 8 ASP N N 15 120.7527 . . 1 . . . A 8 ASP N . 19087 1 21 . 1 1 9 9 ASP H H 1 8.2564 . . 1 . . . A 9 ASP H . 19087 1 22 . 1 1 9 9 ASP HA H 1 4.7029 . . 1 . . . A 9 ASP HA . 19087 1 23 . 1 1 9 9 ASP HB2 H 1 2.7284 . . 2 . . . A 9 ASP HB2 . 19087 1 24 . 1 1 9 9 ASP CA C 13 54.4438 . . 1 . . . A 9 ASP CA . 19087 1 25 . 1 1 9 9 ASP CB C 13 41.2197 . . 1 . . . A 9 ASP CB . 19087 1 26 . 1 1 9 9 ASP N N 15 121.4298 . . 1 . . . A 9 ASP N . 19087 1 27 . 1 1 11 11 SER HB2 H 1 3.9192 . . 2 . . . A 11 SER HB2 . 19087 1 28 . 1 1 11 11 SER C C 13 174.5167 . . 1 . . . A 11 SER C . 19087 1 29 . 1 1 11 11 SER CA C 13 59.3636 . . 1 . . . A 11 SER CA . 19087 1 30 . 1 1 11 11 SER CB C 13 63.9895 . . 1 . . . A 11 SER CB . 19087 1 31 . 1 1 12 12 ALA H H 1 8.0870 . . 1 . . . A 12 ALA H . 19087 1 32 . 1 1 12 12 ALA HA H 1 4.3564 . . 1 . . . A 12 ALA HA . 19087 1 33 . 1 1 12 12 ALA HB1 H 1 1.4069 . . 1 . . . A 12 ALA HB1 . 19087 1 34 . 1 1 12 12 ALA HB2 H 1 1.4069 . . 1 . . . A 12 ALA HB2 . 19087 1 35 . 1 1 12 12 ALA HB3 H 1 1.4069 . . 1 . . . A 12 ALA HB3 . 19087 1 36 . 1 1 12 12 ALA C C 13 177.8112 . . 1 . . . A 12 ALA C . 19087 1 37 . 1 1 12 12 ALA CA C 13 52.8152 . . 1 . . . A 12 ALA CA . 19087 1 38 . 1 1 12 12 ALA CB C 13 19.2043 . . 1 . . . A 12 ALA CB . 19087 1 39 . 1 1 12 12 ALA N N 15 125.4998 . . 1 . . . A 12 ALA N . 19087 1 40 . 1 1 13 13 ILE H H 1 7.9378 . . 1 . . . A 13 ILE H . 19087 1 41 . 1 1 13 13 ILE HA H 1 4.1929 . . 1 . . . A 13 ILE HA . 19087 1 42 . 1 1 13 13 ILE HB H 1 0.9295 . . 1 . . . A 13 ILE HB . 19087 1 43 . 1 1 13 13 ILE CA C 13 61.1629 . . 1 . . . A 13 ILE CA . 19087 1 44 . 1 1 13 13 ILE CB C 13 38.7214 . . 1 . . . A 13 ILE CB . 19087 1 45 . 1 1 13 13 ILE N N 15 119.0453 . . 1 . . . A 13 ILE N . 19087 1 46 . 1 1 14 14 SER H H 1 8.3386 . . 1 . . . A 14 SER H . 19087 1 47 . 1 1 14 14 SER N N 15 119.6615 . . 1 . . . A 14 SER N . 19087 1 48 . 1 1 21 21 ALA HA H 1 4.2862 . . 1 . . . A 21 ALA HA . 19087 1 49 . 1 1 21 21 ALA HB1 H 1 1.3645 . . 1 . . . A 21 ALA HB1 . 19087 1 50 . 1 1 21 21 ALA HB2 H 1 1.3645 . . 1 . . . A 21 ALA HB2 . 19087 1 51 . 1 1 21 21 ALA HB3 H 1 1.3645 . . 1 . . . A 21 ALA HB3 . 19087 1 52 . 1 1 21 21 ALA C C 13 177.0127 . . 1 . . . A 21 ALA C . 19087 1 53 . 1 1 21 21 ALA CA C 13 51.5849 . . 1 . . . A 21 ALA CA . 19087 1 54 . 1 1 21 21 ALA CB C 13 19.3386 . . 1 . . . A 21 ALA CB . 19087 1 55 . 1 1 22 22 ALA H H 1 8.1820 . . 1 . . . A 22 ALA H . 19087 1 56 . 1 1 22 22 ALA HA H 1 4.7254 . . 1 . . . A 22 ALA HA . 19087 1 57 . 1 1 22 22 ALA HB1 H 1 1.3236 . . 1 . . . A 22 ALA HB1 . 19087 1 58 . 1 1 22 22 ALA HB2 H 1 1.3236 . . 1 . . . A 22 ALA HB2 . 19087 1 59 . 1 1 22 22 ALA HB3 H 1 1.3236 . . 1 . . . A 22 ALA HB3 . 19087 1 60 . 1 1 22 22 ALA CA C 13 50.3102 . . 1 . . . A 22 ALA CA . 19087 1 61 . 1 1 22 22 ALA CB C 13 18.2319 . . 1 . . . A 22 ALA CB . 19087 1 62 . 1 1 22 22 ALA N N 15 124.5793 . . 1 . . . A 22 ALA N . 19087 1 63 . 1 1 28 28 VAL HA H 1 4.1353 . . 1 . . . A 28 VAL HA . 19087 1 64 . 1 1 28 28 VAL HB H 1 2.0616 . . 1 . . . A 28 VAL HB . 19087 1 65 . 1 1 28 28 VAL HG11 H 1 0.9199 . . 2 . . . A 28 VAL HG11 . 19087 1 66 . 1 1 28 28 VAL HG12 H 1 0.9199 . . 2 . . . A 28 VAL HG12 . 19087 1 67 . 1 1 28 28 VAL HG13 H 1 0.9199 . . 2 . . . A 28 VAL HG13 . 19087 1 68 . 1 1 28 28 VAL C C 13 175.7789 . . 1 . . . A 28 VAL C . 19087 1 69 . 1 1 28 28 VAL CA C 13 62.1669 . . 1 . . . A 28 VAL CA . 19087 1 70 . 1 1 28 28 VAL CB C 13 32.6810 . . 1 . . . A 28 VAL CB . 19087 1 71 . 1 1 28 28 VAL CG1 C 13 20.8144 . . 2 . . . A 28 VAL CG1 . 19087 1 72 . 1 1 29 29 LYS H H 1 8.3462 . . 1 . . . A 29 LYS H . 19087 1 73 . 1 1 29 29 LYS HA H 1 4.7123 . . 1 . . . A 29 LYS HA . 19087 1 74 . 1 1 29 29 LYS HB2 H 1 1.7557 . . 2 . . . A 29 LYS HB2 . 19087 1 75 . 1 1 29 29 LYS CA C 13 54.1350 . . 1 . . . A 29 LYS CA . 19087 1 76 . 1 1 29 29 LYS CB C 13 32.6462 . . 1 . . . A 29 LYS CB . 19087 1 77 . 1 1 29 29 LYS N N 15 126.8584 . . 1 . . . A 29 LYS N . 19087 1 78 . 1 1 30 30 PRO HA H 1 4.4019 . . 1 . . . A 30 PRO HA . 19087 1 79 . 1 1 30 30 PRO HB3 H 1 2.2910 . . 2 . . . A 30 PRO HB3 . 19087 1 80 . 1 1 30 30 PRO HG2 H 1 1.9560 . . 2 . . . A 30 PRO HG2 . 19087 1 81 . 1 1 30 30 PRO C C 13 176.4349 . . 1 . . . A 30 PRO C . 19087 1 82 . 1 1 30 30 PRO CA C 13 62.7758 . . 1 . . . A 30 PRO CA . 19087 1 83 . 1 1 30 30 PRO CB C 13 32.1535 . . 1 . . . A 30 PRO CB . 19087 1 84 . 1 1 30 30 PRO CG C 13 27.0691 . . 1 . . . A 30 PRO CG . 19087 1 85 . 1 1 31 31 ALA H H 1 8.3236 . . 1 . . . A 31 ALA H . 19087 1 86 . 1 1 31 31 ALA HA H 1 4.3466 . . 1 . . . A 31 ALA HA . 19087 1 87 . 1 1 31 31 ALA HB1 H 1 1.3761 . . 1 . . . A 31 ALA HB1 . 19087 1 88 . 1 1 31 31 ALA HB2 H 1 1.3761 . . 1 . . . A 31 ALA HB2 . 19087 1 89 . 1 1 31 31 ALA HB3 H 1 1.3761 . . 1 . . . A 31 ALA HB3 . 19087 1 90 . 1 1 31 31 ALA C C 13 176.8599 . . 1 . . . A 31 ALA C . 19087 1 91 . 1 1 31 31 ALA CA C 13 52.3156 . . 1 . . . A 31 ALA CA . 19087 1 92 . 1 1 31 31 ALA CB C 13 19.3982 . . 1 . . . A 31 ALA CB . 19087 1 93 . 1 1 31 31 ALA N N 15 124.6797 . . 1 . . . A 31 ALA N . 19087 1 94 . 1 1 32 32 ALA H H 1 8.2457 . . 1 . . . A 32 ALA H . 19087 1 95 . 1 1 32 32 ALA HA H 1 4.7363 . . 1 . . . A 32 ALA HA . 19087 1 96 . 1 1 32 32 ALA CA C 13 50.4868 . . 1 . . . A 32 ALA CA . 19087 1 97 . 1 1 32 32 ALA CB C 13 18.2030 . . 1 . . . A 32 ALA CB . 19087 1 98 . 1 1 32 32 ALA N N 15 125.0106 . . 1 . . . A 32 ALA N . 19087 1 99 . 1 1 33 33 PRO HA H 1 4.4663 . . 1 . . . A 33 PRO HA . 19087 1 100 . 1 1 33 33 PRO HB3 H 1 2.2919 . . 2 . . . A 33 PRO HB3 . 19087 1 101 . 1 1 33 33 PRO HD3 H 1 2.9359 . . 2 . . . A 33 PRO HD3 . 19087 1 102 . 1 1 33 33 PRO C C 13 176.8339 . . 1 . . . A 33 PRO C . 19087 1 103 . 1 1 33 33 PRO CA C 13 62.8251 . . 1 . . . A 33 PRO CA . 19087 1 104 . 1 1 33 33 PRO CB C 13 31.9951 . . 1 . . . A 33 PRO CB . 19087 1 105 . 1 1 33 33 PRO CG C 13 27.2422 . . 1 . . . A 33 PRO CG . 19087 1 106 . 1 1 34 34 ARG H H 1 8.3489 . . 1 . . . A 34 ARG H . 19087 1 107 . 1 1 34 34 ARG HA H 1 4.3855 . . 1 . . . A 34 ARG HA . 19087 1 108 . 1 1 34 34 ARG HB2 H 1 1.9371 . . 2 . . . A 34 ARG HB2 . 19087 1 109 . 1 1 34 34 ARG HG3 H 1 1.7552 . . 2 . . . A 34 ARG HG3 . 19087 1 110 . 1 1 34 34 ARG HD3 H 1 3.1924 . . 2 . . . A 34 ARG HD3 . 19087 1 111 . 1 1 34 34 ARG C C 13 175.8528 . . 1 . . . A 34 ARG C . 19087 1 112 . 1 1 34 34 ARG CA C 13 55.9121 . . 1 . . . A 34 ARG CA . 19087 1 113 . 1 1 34 34 ARG CB C 13 31.6715 . . 1 . . . A 34 ARG CB . 19087 1 114 . 1 1 34 34 ARG CG C 13 27.1295 . . 1 . . . A 34 ARG CG . 19087 1 115 . 1 1 34 34 ARG CD C 13 43.4872 . . 1 . . . A 34 ARG CD . 19087 1 116 . 1 1 34 34 ARG N N 15 121.1700 . . 1 . . . A 34 ARG N . 19087 1 117 . 1 1 35 35 ALA H H 1 8.0085 . . 1 . . . A 35 ALA H . 19087 1 118 . 1 1 35 35 ALA HA H 1 4.6117 . . 1 . . . A 35 ALA HA . 19087 1 119 . 1 1 35 35 ALA HB1 H 1 1.4879 . . 1 . . . A 35 ALA HB1 . 19087 1 120 . 1 1 35 35 ALA HB2 H 1 1.4879 . . 1 . . . A 35 ALA HB2 . 19087 1 121 . 1 1 35 35 ALA HB3 H 1 1.4879 . . 1 . . . A 35 ALA HB3 . 19087 1 122 . 1 1 35 35 ALA C C 13 176.1700 . . 1 . . . A 35 ALA C . 19087 1 123 . 1 1 35 35 ALA CA C 13 51.5665 . . 1 . . . A 35 ALA CA . 19087 1 124 . 1 1 35 35 ALA CB C 13 20.7224 . . 1 . . . A 35 ALA CB . 19087 1 125 . 1 1 35 35 ALA N N 15 124.8778 . . 1 . . . A 35 ALA N . 19087 1 126 . 1 1 36 36 GLU H H 1 8.4946 . . 1 . . . A 36 GLU H . 19087 1 127 . 1 1 36 36 GLU HA H 1 4.4307 . . 1 . . . A 36 GLU HA . 19087 1 128 . 1 1 36 36 GLU HB2 H 1 2.0651 . . 2 . . . A 36 GLU HB2 . 19087 1 129 . 1 1 36 36 GLU HG2 H 1 2.3601 . . 2 . . . A 36 GLU HG2 . 19087 1 130 . 1 1 36 36 GLU C C 13 174.6178 . . 1 . . . A 36 GLU C . 19087 1 131 . 1 1 36 36 GLU CA C 13 56.4725 . . 1 . . . A 36 GLU CA . 19087 1 132 . 1 1 36 36 GLU CB C 13 31.1240 . . 1 . . . A 36 GLU CB . 19087 1 133 . 1 1 36 36 GLU CG C 13 37.0945 . . 1 . . . A 36 GLU CG . 19087 1 134 . 1 1 36 36 GLU N N 15 119.7760 . . 1 . . . A 36 GLU N . 19087 1 135 . 1 1 37 37 VAL H H 1 8.4944 . . 1 . . . A 37 VAL H . 19087 1 136 . 1 1 37 37 VAL HA H 1 4.9016 . . 1 . . . A 37 VAL HA . 19087 1 137 . 1 1 37 37 VAL HB H 1 1.8225 . . 1 . . . A 37 VAL HB . 19087 1 138 . 1 1 37 37 VAL HG11 H 1 0.6989 . . 2 . . . A 37 VAL HG11 . 19087 1 139 . 1 1 37 37 VAL HG12 H 1 0.6989 . . 2 . . . A 37 VAL HG12 . 19087 1 140 . 1 1 37 37 VAL HG13 H 1 0.6989 . . 2 . . . A 37 VAL HG13 . 19087 1 141 . 1 1 37 37 VAL C C 13 174.2846 . . 1 . . . A 37 VAL C . 19087 1 142 . 1 1 37 37 VAL CA C 13 60.6390 . . 1 . . . A 37 VAL CA . 19087 1 143 . 1 1 37 37 VAL CB C 13 34.6124 . . 1 . . . A 37 VAL CB . 19087 1 144 . 1 1 37 37 VAL CG1 C 13 22.5964 . . 2 . . . A 37 VAL CG1 . 19087 1 145 . 1 1 37 37 VAL N N 15 119.8077 . . 1 . . . A 37 VAL N . 19087 1 146 . 1 1 38 38 ARG H H 1 8.6524 . . 1 . . . A 38 ARG H . 19087 1 147 . 1 1 38 38 ARG HA H 1 4.9258 . . 1 . . . A 38 ARG HA . 19087 1 148 . 1 1 38 38 ARG HB2 H 1 1.4277 . . 2 . . . A 38 ARG HB2 . 19087 1 149 . 1 1 38 38 ARG C C 13 174.2394 . . 1 . . . A 38 ARG C . 19087 1 150 . 1 1 38 38 ARG CA C 13 55.0921 . . 1 . . . A 38 ARG CA . 19087 1 151 . 1 1 38 38 ARG CB C 13 34.1901 . . 1 . . . A 38 ARG CB . 19087 1 152 . 1 1 38 38 ARG CG C 13 27.8763 . . 1 . . . A 38 ARG CG . 19087 1 153 . 1 1 38 38 ARG CD C 13 45.3136 . . 1 . . . A 38 ARG CD . 19087 1 154 . 1 1 38 38 ARG N N 15 124.5341 . . 1 . . . A 38 ARG N . 19087 1 155 . 1 1 39 39 VAL H H 1 7.9340 . . 1 . . . A 39 VAL H . 19087 1 156 . 1 1 39 39 VAL HA H 1 4.7984 . . 1 . . . A 39 VAL HA . 19087 1 157 . 1 1 39 39 VAL HB H 1 1.8069 . . 1 . . . A 39 VAL HB . 19087 1 158 . 1 1 39 39 VAL HG11 H 1 0.8702 . . 2 . . . A 39 VAL HG11 . 19087 1 159 . 1 1 39 39 VAL HG12 H 1 0.8702 . . 2 . . . A 39 VAL HG12 . 19087 1 160 . 1 1 39 39 VAL HG13 H 1 0.8702 . . 2 . . . A 39 VAL HG13 . 19087 1 161 . 1 1 39 39 VAL HG21 H 1 0.6498 . . 2 . . . A 39 VAL HG21 . 19087 1 162 . 1 1 39 39 VAL HG22 H 1 0.6498 . . 2 . . . A 39 VAL HG22 . 19087 1 163 . 1 1 39 39 VAL HG23 H 1 0.6498 . . 2 . . . A 39 VAL HG23 . 19087 1 164 . 1 1 39 39 VAL C C 13 173.3569 . . 1 . . . A 39 VAL C . 19087 1 165 . 1 1 39 39 VAL CA C 13 60.6382 . . 1 . . . A 39 VAL CA . 19087 1 166 . 1 1 39 39 VAL CB C 13 34.2940 . . 1 . . . A 39 VAL CB . 19087 1 167 . 1 1 39 39 VAL CG1 C 13 22.1293 . . 2 . . . A 39 VAL CG1 . 19087 1 168 . 1 1 39 39 VAL N N 15 121.2310 . . 1 . . . A 39 VAL N . 19087 1 169 . 1 1 40 40 TYR H H 1 9.3434 . . 1 . . . A 40 TYR H . 19087 1 170 . 1 1 40 40 TYR HA H 1 5.1536 . . 1 . . . A 40 TYR HA . 19087 1 171 . 1 1 40 40 TYR HB2 H 1 2.5983 . . 2 . . . A 40 TYR HB2 . 19087 1 172 . 1 1 40 40 TYR C C 13 175.1237 . . 1 . . . A 40 TYR C . 19087 1 173 . 1 1 40 40 TYR CA C 13 55.5400 . . 1 . . . A 40 TYR CA . 19087 1 174 . 1 1 40 40 TYR CB C 13 42.2231 . . 1 . . . A 40 TYR CB . 19087 1 175 . 1 1 40 40 TYR N N 15 122.2622 . . 1 . . . A 40 TYR N . 19087 1 176 . 1 1 41 41 ASN H H 1 9.2865 . . 1 . . . A 41 ASN H . 19087 1 177 . 1 1 41 41 ASN HA H 1 5.0316 . . 1 . . . A 41 ASN HA . 19087 1 178 . 1 1 41 41 ASN HB2 H 1 3.4985 . . 2 . . . A 41 ASN HB2 . 19087 1 179 . 1 1 41 41 ASN HB3 H 1 2.7933 . . 2 . . . A 41 ASN HB3 . 19087 1 180 . 1 1 41 41 ASN C C 13 176.3009 . . 1 . . . A 41 ASN C . 19087 1 181 . 1 1 41 41 ASN CA C 13 52.6349 . . 1 . . . A 41 ASN CA . 19087 1 182 . 1 1 41 41 ASN CB C 13 39.8356 . . 1 . . . A 41 ASN CB . 19087 1 183 . 1 1 41 41 ASN N N 15 121.6843 . . 1 . . . A 41 ASN N . 19087 1 184 . 1 1 42 42 ILE H H 1 8.5409 . . 1 . . . A 42 ILE H . 19087 1 185 . 1 1 42 42 ILE HA H 1 5.4502 . . 1 . . . A 42 ILE HA . 19087 1 186 . 1 1 42 42 ILE HB H 1 2.2429 . . 1 . . . A 42 ILE HB . 19087 1 187 . 1 1 42 42 ILE HG21 H 1 1.2629 . . 1 . . . A 42 ILE HG21 . 19087 1 188 . 1 1 42 42 ILE HG22 H 1 1.2629 . . 1 . . . A 42 ILE HG22 . 19087 1 189 . 1 1 42 42 ILE HG23 H 1 1.2629 . . 1 . . . A 42 ILE HG23 . 19087 1 190 . 1 1 42 42 ILE HD11 H 1 0.9108 . . 1 . . . A 42 ILE HD11 . 19087 1 191 . 1 1 42 42 ILE HD12 H 1 0.9108 . . 1 . . . A 42 ILE HD12 . 19087 1 192 . 1 1 42 42 ILE HD13 H 1 0.9108 . . 1 . . . A 42 ILE HD13 . 19087 1 193 . 1 1 42 42 ILE C C 13 176.4504 . . 1 . . . A 42 ILE C . 19087 1 194 . 1 1 42 42 ILE CA C 13 60.5126 . . 1 . . . A 42 ILE CA . 19087 1 195 . 1 1 42 42 ILE CB C 13 38.5973 . . 1 . . . A 42 ILE CB . 19087 1 196 . 1 1 42 42 ILE CG1 C 13 26.2074 . . 1 . . . A 42 ILE CG1 . 19087 1 197 . 1 1 42 42 ILE CG2 C 13 18.4972 . . 1 . . . A 42 ILE CG2 . 19087 1 198 . 1 1 42 42 ILE CD1 C 13 14.9070 . . 1 . . . A 42 ILE CD1 . 19087 1 199 . 1 1 42 42 ILE N N 15 119.4615 . . 1 . . . A 42 ILE N . 19087 1 200 . 1 1 43 43 SER H H 1 8.1421 . . 1 . . . A 43 SER H . 19087 1 201 . 1 1 43 43 SER HA H 1 4.7285 . . 1 . . . A 43 SER HA . 19087 1 202 . 1 1 43 43 SER CA C 13 58.5979 . . 1 . . . A 43 SER CA . 19087 1 203 . 1 1 43 43 SER CB C 13 66.2618 . . 1 . . . A 43 SER CB . 19087 1 204 . 1 1 43 43 SER N N 15 118.2117 . . 1 . . . A 43 SER N . 19087 1 205 . 1 1 44 44 GLY HA2 H 1 4.0057 . . 2 . . . A 44 GLY HA2 . 19087 1 206 . 1 1 44 44 GLY C C 13 174.4138 . . 1 . . . A 44 GLY C . 19087 1 207 . 1 1 44 44 GLY CA C 13 45.3788 . . 1 . . . A 44 GLY CA . 19087 1 208 . 1 1 45 45 THR H H 1 8.2981 . . 1 . . . A 45 THR H . 19087 1 209 . 1 1 45 45 THR HA H 1 4.3843 . . 1 . . . A 45 THR HA . 19087 1 210 . 1 1 45 45 THR HB H 1 4.1674 . . 1 . . . A 45 THR HB . 19087 1 211 . 1 1 45 45 THR HG21 H 1 1.2276 . . 1 . . . A 45 THR HG21 . 19087 1 212 . 1 1 45 45 THR HG22 H 1 1.2276 . . 1 . . . A 45 THR HG22 . 19087 1 213 . 1 1 45 45 THR HG23 H 1 1.2276 . . 1 . . . A 45 THR HG23 . 19087 1 214 . 1 1 45 45 THR CA C 13 61.8140 . . 1 . . . A 45 THR CA . 19087 1 215 . 1 1 45 45 THR CB C 13 69.7868 . . 1 . . . A 45 THR CB . 19087 1 216 . 1 1 45 45 THR N N 15 116.3708 . . 1 . . . A 45 THR N . 19087 1 217 . 1 1 47 47 GLY HA2 H 1 4.1719 . . 2 . . . A 47 GLY HA2 . 19087 1 218 . 1 1 47 47 GLY HA3 H 1 3.9370 . . 2 . . . A 47 GLY HA3 . 19087 1 219 . 1 1 47 47 GLY C C 13 175.6906 . . 1 . . . A 47 GLY C . 19087 1 220 . 1 1 47 47 GLY CA C 13 46.1906 . . 1 . . . A 47 GLY CA . 19087 1 221 . 1 1 48 48 ALA H H 1 7.5112 . . 1 . . . A 48 ALA H . 19087 1 222 . 1 1 48 48 ALA HA H 1 4.0295 . . 1 . . . A 48 ALA HA . 19087 1 223 . 1 1 48 48 ALA HB1 H 1 1.3384 . . 1 . . . A 48 ALA HB1 . 19087 1 224 . 1 1 48 48 ALA HB2 H 1 1.3384 . . 1 . . . A 48 ALA HB2 . 19087 1 225 . 1 1 48 48 ALA HB3 H 1 1.3384 . . 1 . . . A 48 ALA HB3 . 19087 1 226 . 1 1 48 48 ALA CA C 13 55.4020 . . 1 . . . A 48 ALA CA . 19087 1 227 . 1 1 48 48 ALA CB C 13 18.4918 . . 1 . . . A 48 ALA CB . 19087 1 228 . 1 1 48 48 ALA N N 15 121.9574 . . 1 . . . A 48 ALA N . 19087 1 229 . 1 1 49 49 ALA HA H 1 3.9840 . . 1 . . . A 49 ALA HA . 19087 1 230 . 1 1 49 49 ALA HB1 H 1 1.3849 . . 1 . . . A 49 ALA HB1 . 19087 1 231 . 1 1 49 49 ALA HB2 H 1 1.3849 . . 1 . . . A 49 ALA HB2 . 19087 1 232 . 1 1 49 49 ALA HB3 H 1 1.3849 . . 1 . . . A 49 ALA HB3 . 19087 1 233 . 1 1 49 49 ALA C C 13 178.0733 . . 1 . . . A 49 ALA C . 19087 1 234 . 1 1 49 49 ALA CA C 13 54.8610 . . 1 . . . A 49 ALA CA . 19087 1 235 . 1 1 49 49 ALA CB C 13 18.6885 . . 1 . . . A 49 ALA CB . 19087 1 236 . 1 1 50 50 ALA H H 1 7.9654 . . 1 . . . A 50 ALA H . 19087 1 237 . 1 1 50 50 ALA HA H 1 3.9886 . . 1 . . . A 50 ALA HA . 19087 1 238 . 1 1 50 50 ALA HB1 H 1 1.4806 . . 1 . . . A 50 ALA HB1 . 19087 1 239 . 1 1 50 50 ALA HB2 H 1 1.4806 . . 1 . . . A 50 ALA HB2 . 19087 1 240 . 1 1 50 50 ALA HB3 H 1 1.4806 . . 1 . . . A 50 ALA HB3 . 19087 1 241 . 1 1 50 50 ALA C C 13 179.6418 . . 1 . . . A 50 ALA C . 19087 1 242 . 1 1 50 50 ALA CA C 13 55.8512 . . 1 . . . A 50 ALA CA . 19087 1 243 . 1 1 50 50 ALA CB C 13 17.7880 . . 1 . . . A 50 ALA CB . 19087 1 244 . 1 1 50 50 ALA N N 15 122.6536 . . 1 . . . A 50 ALA N . 19087 1 245 . 1 1 51 51 ARG H H 1 7.9818 . . 1 . . . A 51 ARG H . 19087 1 246 . 1 1 51 51 ARG HA H 1 4.1909 . . 1 . . . A 51 ARG HA . 19087 1 247 . 1 1 51 51 ARG HB2 H 1 1.8965 . . 2 . . . A 51 ARG HB2 . 19087 1 248 . 1 1 51 51 ARG HG2 H 1 1.6694 . . 2 . . . A 51 ARG HG2 . 19087 1 249 . 1 1 51 51 ARG HD3 H 1 3.2610 . . 2 . . . A 51 ARG HD3 . 19087 1 250 . 1 1 51 51 ARG C C 13 179.9308 . . 1 . . . A 51 ARG C . 19087 1 251 . 1 1 51 51 ARG CA C 13 59.5118 . . 1 . . . A 51 ARG CA . 19087 1 252 . 1 1 51 51 ARG CB C 13 30.4632 . . 1 . . . A 51 ARG CB . 19087 1 253 . 1 1 51 51 ARG CG C 13 27.5974 . . 1 . . . A 51 ARG CG . 19087 1 254 . 1 1 51 51 ARG CD C 13 43.1094 . . 1 . . . A 51 ARG CD . 19087 1 255 . 1 1 51 51 ARG N N 15 116.6587 . . 1 . . . A 51 ARG N . 19087 1 256 . 1 1 52 52 THR H H 1 7.6612 . . 1 . . . A 52 THR H . 19087 1 257 . 1 1 52 52 THR HA H 1 4.1622 . . 1 . . . A 52 THR HA . 19087 1 258 . 1 1 52 52 THR HB H 1 3.8591 . . 1 . . . A 52 THR HB . 19087 1 259 . 1 1 52 52 THR HG21 H 1 1.0933 . . 1 . . . A 52 THR HG21 . 19087 1 260 . 1 1 52 52 THR HG22 H 1 1.0933 . . 1 . . . A 52 THR HG22 . 19087 1 261 . 1 1 52 52 THR HG23 H 1 1.0933 . . 1 . . . A 52 THR HG23 . 19087 1 262 . 1 1 52 52 THR C C 13 175.6261 . . 1 . . . A 52 THR C . 19087 1 263 . 1 1 52 52 THR CA C 13 68.5651 . . 1 . . . A 52 THR CA . 19087 1 264 . 1 1 52 52 THR CB C 13 70.7873 . . 1 . . . A 52 THR CB . 19087 1 265 . 1 1 52 52 THR CG2 C 13 21.9823 . . 1 . . . A 52 THR CG2 . 19087 1 266 . 1 1 52 52 THR N N 15 117.7449 . . 1 . . . A 52 THR N . 19087 1 267 . 1 1 53 53 ALA H H 1 8.8054 . . 1 . . . A 53 ALA H . 19087 1 268 . 1 1 53 53 ALA HA H 1 3.8862 . . 1 . . . A 53 ALA HA . 19087 1 269 . 1 1 53 53 ALA HB1 H 1 1.4684 . . 1 . . . A 53 ALA HB1 . 19087 1 270 . 1 1 53 53 ALA HB2 H 1 1.4684 . . 1 . . . A 53 ALA HB2 . 19087 1 271 . 1 1 53 53 ALA HB3 H 1 1.4684 . . 1 . . . A 53 ALA HB3 . 19087 1 272 . 1 1 53 53 ALA C C 13 179.0134 . . 1 . . . A 53 ALA C . 19087 1 273 . 1 1 53 53 ALA CA C 13 56.1974 . . 1 . . . A 53 ALA CA . 19087 1 274 . 1 1 53 53 ALA CB C 13 18.7171 . . 1 . . . A 53 ALA CB . 19087 1 275 . 1 1 53 53 ALA N N 15 123.9388 . . 1 . . . A 53 ALA N . 19087 1 276 . 1 1 54 54 ASP H H 1 8.3267 . . 1 . . . A 54 ASP H . 19087 1 277 . 1 1 54 54 ASP HA H 1 4.4320 . . 1 . . . A 54 ASP HA . 19087 1 278 . 1 1 54 54 ASP HB2 H 1 2.8095 . . 2 . . . A 54 ASP HB2 . 19087 1 279 . 1 1 54 54 ASP C C 13 179.3765 . . 1 . . . A 54 ASP C . 19087 1 280 . 1 1 54 54 ASP CA C 13 58.0071 . . 1 . . . A 54 ASP CA . 19087 1 281 . 1 1 54 54 ASP CB C 13 40.2418 . . 1 . . . A 54 ASP CB . 19087 1 282 . 1 1 54 54 ASP N N 15 118.3507 . . 1 . . . A 54 ASP N . 19087 1 283 . 1 1 55 55 ARG H H 1 7.7229 . . 1 . . . A 55 ARG H . 19087 1 284 . 1 1 55 55 ARG HA H 1 4.1748 . . 1 . . . A 55 ARG HA . 19087 1 285 . 1 1 55 55 ARG HB2 H 1 1.9933 . . 2 . . . A 55 ARG HB2 . 19087 1 286 . 1 1 55 55 ARG HG2 H 1 1.6960 . . 2 . . . A 55 ARG HG2 . 19087 1 287 . 1 1 55 55 ARG HD3 H 1 3.2064 . . 2 . . . A 55 ARG HD3 . 19087 1 288 . 1 1 55 55 ARG C C 13 179.5497 . . 1 . . . A 55 ARG C . 19087 1 289 . 1 1 55 55 ARG CA C 13 59.2855 . . 1 . . . A 55 ARG CA . 19087 1 290 . 1 1 55 55 ARG CB C 13 30.3202 . . 1 . . . A 55 ARG CB . 19087 1 291 . 1 1 55 55 ARG CG C 13 27.0430 . . 1 . . . A 55 ARG CG . 19087 1 292 . 1 1 55 55 ARG CD C 13 42.6666 . . 1 . . . A 55 ARG CD . 19087 1 293 . 1 1 55 55 ARG N N 15 121.1200 . . 1 . . . A 55 ARG N . 19087 1 294 . 1 1 56 56 LEU H H 1 8.2151 . . 1 . . . A 56 LEU H . 19087 1 295 . 1 1 56 56 LEU HA H 1 4.3318 . . 1 . . . A 56 LEU HA . 19087 1 296 . 1 1 56 56 LEU HB2 H 1 2.0630 . . 2 . . . A 56 LEU HB2 . 19087 1 297 . 1 1 56 56 LEU HG H 1 1.2041 . . 1 . . . A 56 LEU HG . 19087 1 298 . 1 1 56 56 LEU HD11 H 1 0.6268 . . 2 . . . A 56 LEU HD11 . 19087 1 299 . 1 1 56 56 LEU HD12 H 1 0.6268 . . 2 . . . A 56 LEU HD12 . 19087 1 300 . 1 1 56 56 LEU HD13 H 1 0.6268 . . 2 . . . A 56 LEU HD13 . 19087 1 301 . 1 1 56 56 LEU C C 13 179.3054 . . 1 . . . A 56 LEU C . 19087 1 302 . 1 1 56 56 LEU CA C 13 57.4367 . . 1 . . . A 56 LEU CA . 19087 1 303 . 1 1 56 56 LEU CB C 13 41.2870 . . 1 . . . A 56 LEU CB . 19087 1 304 . 1 1 56 56 LEU CG C 13 26.7176 . . 1 . . . A 56 LEU CG . 19087 1 305 . 1 1 56 56 LEU CD1 C 13 22.8599 . . 2 . . . A 56 LEU CD1 . 19087 1 306 . 1 1 56 56 LEU N N 15 118.6590 . . 1 . . . A 56 LEU N . 19087 1 307 . 1 1 57 57 LYS H H 1 8.9142 . . 1 . . . A 57 LYS H . 19087 1 308 . 1 1 57 57 LYS HA H 1 4.5127 . . 1 . . . A 57 LYS HA . 19087 1 309 . 1 1 57 57 LYS HB2 H 1 1.9852 . . 2 . . . A 57 LYS HB2 . 19087 1 310 . 1 1 57 57 LYS HD3 H 1 1.5789 . . 2 . . . A 57 LYS HD3 . 19087 1 311 . 1 1 57 57 LYS C C 13 181.4363 . . 1 . . . A 57 LYS C . 19087 1 312 . 1 1 57 57 LYS CA C 13 60.0043 . . 1 . . . A 57 LYS CA . 19087 1 313 . 1 1 57 57 LYS CB C 13 32.4366 . . 1 . . . A 57 LYS CB . 19087 1 314 . 1 1 57 57 LYS CE C 13 37.5960 . . 1 . . . A 57 LYS CE . 19087 1 315 . 1 1 57 57 LYS N N 15 122.7131 . . 1 . . . A 57 LYS N . 19087 1 316 . 1 1 58 58 ALA H H 1 8.0257 . . 1 . . . A 58 ALA H . 19087 1 317 . 1 1 58 58 ALA HA H 1 4.2099 . . 1 . . . A 58 ALA HA . 19087 1 318 . 1 1 58 58 ALA HB1 H 1 1.5695 . . 1 . . . A 58 ALA HB1 . 19087 1 319 . 1 1 58 58 ALA HB2 H 1 1.5695 . . 1 . . . A 58 ALA HB2 . 19087 1 320 . 1 1 58 58 ALA HB3 H 1 1.5695 . . 1 . . . A 58 ALA HB3 . 19087 1 321 . 1 1 58 58 ALA C C 13 178.5164 . . 1 . . . A 58 ALA C . 19087 1 322 . 1 1 58 58 ALA CA C 13 55.0693 . . 1 . . . A 58 ALA CA . 19087 1 323 . 1 1 58 58 ALA CB C 13 17.9088 . . 1 . . . A 58 ALA CB . 19087 1 324 . 1 1 58 58 ALA N N 15 122.4232 . . 1 . . . A 58 ALA N . 19087 1 325 . 1 1 59 59 ALA H H 1 7.4135 . . 1 . . . A 59 ALA H . 19087 1 326 . 1 1 59 59 ALA HA H 1 4.4856 . . 1 . . . A 59 ALA HA . 19087 1 327 . 1 1 59 59 ALA HB1 H 1 1.7434 . . 1 . . . A 59 ALA HB1 . 19087 1 328 . 1 1 59 59 ALA HB2 H 1 1.7434 . . 1 . . . A 59 ALA HB2 . 19087 1 329 . 1 1 59 59 ALA HB3 H 1 1.7434 . . 1 . . . A 59 ALA HB3 . 19087 1 330 . 1 1 59 59 ALA C C 13 176.7968 . . 1 . . . A 59 ALA C . 19087 1 331 . 1 1 59 59 ALA CA C 13 51.7584 . . 1 . . . A 59 ALA CA . 19087 1 332 . 1 1 59 59 ALA CB C 13 19.3691 . . 1 . . . A 59 ALA CB . 19087 1 333 . 1 1 59 59 ALA N N 15 118.3475 . . 1 . . . A 59 ALA N . 19087 1 334 . 1 1 60 60 GLY H H 1 7.6940 . . 1 . . . A 60 GLY H . 19087 1 335 . 1 1 60 60 GLY HA2 H 1 4.0740 . . 2 . . . A 60 GLY HA2 . 19087 1 336 . 1 1 60 60 GLY HA3 H 1 3.6586 . . 2 . . . A 60 GLY HA3 . 19087 1 337 . 1 1 60 60 GLY C C 13 174.7413 . . 1 . . . A 60 GLY C . 19087 1 338 . 1 1 60 60 GLY CA C 13 45.2355 . . 1 . . . A 60 GLY CA . 19087 1 339 . 1 1 60 60 GLY N N 15 104.9185 . . 1 . . . A 60 GLY N . 19087 1 340 . 1 1 61 61 PHE H H 1 7.8788 . . 1 . . . A 61 PHE H . 19087 1 341 . 1 1 61 61 PHE HA H 1 4.4946 . . 1 . . . A 61 PHE HA . 19087 1 342 . 1 1 61 61 PHE HB2 H 1 2.9162 . . 2 . . . A 61 PHE HB2 . 19087 1 343 . 1 1 61 61 PHE HB3 H 1 2.4456 . . 2 . . . A 61 PHE HB3 . 19087 1 344 . 1 1 61 61 PHE C C 13 175.2042 . . 1 . . . A 61 PHE C . 19087 1 345 . 1 1 61 61 PHE CA C 13 58.4827 . . 1 . . . A 61 PHE CA . 19087 1 346 . 1 1 61 61 PHE CB C 13 39.1633 . . 1 . . . A 61 PHE CB . 19087 1 347 . 1 1 61 61 PHE N N 15 118.8621 . . 1 . . . A 61 PHE N . 19087 1 348 . 1 1 62 62 THR H H 1 9.4931 . . 1 . . . A 62 THR H . 19087 1 349 . 1 1 62 62 THR HA H 1 4.3033 . . 1 . . . A 62 THR HA . 19087 1 350 . 1 1 62 62 THR HB H 1 4.1837 . . 1 . . . A 62 THR HB . 19087 1 351 . 1 1 62 62 THR HG21 H 1 1.2088 . . 1 . . . A 62 THR HG21 . 19087 1 352 . 1 1 62 62 THR HG22 H 1 1.2088 . . 1 . . . A 62 THR HG22 . 19087 1 353 . 1 1 62 62 THR HG23 H 1 1.2088 . . 1 . . . A 62 THR HG23 . 19087 1 354 . 1 1 62 62 THR C C 13 173.0734 . . 1 . . . A 62 THR C . 19087 1 355 . 1 1 62 62 THR CA C 13 69.3886 . . 1 . . . A 62 THR CA . 19087 1 356 . 1 1 62 62 THR CB C 13 62.4782 . . 1 . . . A 62 THR CB . 19087 1 357 . 1 1 62 62 THR CG2 C 13 21.5404 . . 1 . . . A 62 THR CG2 . 19087 1 358 . 1 1 62 62 THR N N 15 121.3190 . . 1 . . . A 62 THR N . 19087 1 359 . 1 1 63 63 VAL H H 1 8.2931 . . 1 . . . A 63 VAL H . 19087 1 360 . 1 1 63 63 VAL HA H 1 4.6599 . . 1 . . . A 63 VAL HA . 19087 1 361 . 1 1 63 63 VAL HB H 1 1.8980 . . 1 . . . A 63 VAL HB . 19087 1 362 . 1 1 63 63 VAL HG11 H 1 0.8110 . . 2 . . . A 63 VAL HG11 . 19087 1 363 . 1 1 63 63 VAL HG12 H 1 0.8110 . . 2 . . . A 63 VAL HG12 . 19087 1 364 . 1 1 63 63 VAL HG13 H 1 0.8110 . . 2 . . . A 63 VAL HG13 . 19087 1 365 . 1 1 63 63 VAL C C 13 177.2667 . . 1 . . . A 63 VAL C . 19087 1 366 . 1 1 63 63 VAL CA C 13 60.0994 . . 1 . . . A 63 VAL CA . 19087 1 367 . 1 1 63 63 VAL CB C 13 32.5722 . . 1 . . . A 63 VAL CB . 19087 1 368 . 1 1 63 63 VAL CG1 C 13 21.6235 . . 2 . . . A 63 VAL CG1 . 19087 1 369 . 1 1 63 63 VAL N N 15 128.4065 . . 1 . . . A 63 VAL N . 19087 1 370 . 1 1 64 64 THR H H 1 8.7704 . . 1 . . . A 64 THR H . 19087 1 371 . 1 1 64 64 THR HA H 1 4.3503 . . 1 . . . A 64 THR HA . 19087 1 372 . 1 1 64 64 THR CA C 13 62.1824 . . 1 . . . A 64 THR CA . 19087 1 373 . 1 1 64 64 THR CB C 13 69.1430 . . 1 . . . A 64 THR CB . 19087 1 374 . 1 1 64 64 THR N N 15 118.4949 . . 1 . . . A 64 THR N . 19087 1 375 . 1 1 65 65 ASP HA H 1 4.3015 . . 1 . . . A 65 ASP HA . 19087 1 376 . 1 1 65 65 ASP HB2 H 1 1.2214 . . 2 . . . A 65 ASP HB2 . 19087 1 377 . 1 1 65 65 ASP C C 13 173.7782 . . 1 . . . A 65 ASP C . 19087 1 378 . 1 1 65 65 ASP CA C 13 54.2873 . . 1 . . . A 65 ASP CA . 19087 1 379 . 1 1 65 65 ASP CB C 13 44.0177 . . 1 . . . A 65 ASP CB . 19087 1 380 . 1 1 66 66 VAL H H 1 7.8495 . . 1 . . . A 66 VAL H . 19087 1 381 . 1 1 66 66 VAL HA H 1 4.8626 . . 1 . . . A 66 VAL HA . 19087 1 382 . 1 1 66 66 VAL HB H 1 1.7851 . . 1 . . . A 66 VAL HB . 19087 1 383 . 1 1 66 66 VAL HG11 H 1 0.6837 . . 2 . . . A 66 VAL HG11 . 19087 1 384 . 1 1 66 66 VAL HG12 H 1 0.6837 . . 2 . . . A 66 VAL HG12 . 19087 1 385 . 1 1 66 66 VAL HG13 H 1 0.6837 . . 2 . . . A 66 VAL HG13 . 19087 1 386 . 1 1 66 66 VAL C C 13 176.2344 . . 1 . . . A 66 VAL C . 19087 1 387 . 1 1 66 66 VAL CA C 13 60.5971 . . 1 . . . A 66 VAL CA . 19087 1 388 . 1 1 66 66 VAL CB C 13 34.1199 . . 1 . . . A 66 VAL CB . 19087 1 389 . 1 1 66 66 VAL CG1 C 13 21.5134 . . 2 . . . A 66 VAL CG1 . 19087 1 390 . 1 1 66 66 VAL N N 15 121.7052 . . 1 . . . A 66 VAL N . 19087 1 391 . 1 1 67 67 GLY H H 1 8.1514 . . 1 . . . A 67 GLY H . 19087 1 392 . 1 1 67 67 GLY CA C 13 45.6184 . . 1 . . . A 67 GLY CA . 19087 1 393 . 1 1 67 67 GLY N N 15 112.0501 . . 1 . . . A 67 GLY N . 19087 1 394 . 1 1 68 68 ASN HB2 H 1 2.7646 . . 2 . . . A 68 ASN HB2 . 19087 1 395 . 1 1 68 68 ASN C C 13 173.7706 . . 1 . . . A 68 ASN C . 19087 1 396 . 1 1 68 68 ASN CA C 13 53.0619 . . 1 . . . A 68 ASN CA . 19087 1 397 . 1 1 68 68 ASN CB C 13 39.8318 . . 1 . . . A 68 ASN CB . 19087 1 398 . 1 1 69 69 LEU H H 1 8.2763 . . 1 . . . A 69 LEU H . 19087 1 399 . 1 1 69 69 LEU HA H 1 4.5365 . . 1 . . . A 69 LEU HA . 19087 1 400 . 1 1 69 69 LEU HB2 H 1 1.2458 . . 2 . . . A 69 LEU HB2 . 19087 1 401 . 1 1 69 69 LEU HD11 H 1 0.4585 . . 2 . . . A 69 LEU HD11 . 19087 1 402 . 1 1 69 69 LEU HD12 H 1 0.4585 . . 2 . . . A 69 LEU HD12 . 19087 1 403 . 1 1 69 69 LEU HD13 H 1 0.4585 . . 2 . . . A 69 LEU HD13 . 19087 1 404 . 1 1 69 69 LEU HD21 H 1 0.2642 . . 2 . . . A 69 LEU HD21 . 19087 1 405 . 1 1 69 69 LEU HD22 H 1 0.2642 . . 2 . . . A 69 LEU HD22 . 19087 1 406 . 1 1 69 69 LEU HD23 H 1 0.2642 . . 2 . . . A 69 LEU HD23 . 19087 1 407 . 1 1 69 69 LEU C C 13 174.7512 . . 1 . . . A 69 LEU C . 19087 1 408 . 1 1 69 69 LEU CA C 13 53.9250 . . 1 . . . A 69 LEU CA . 19087 1 409 . 1 1 69 69 LEU CB C 13 47.3134 . . 1 . . . A 69 LEU CB . 19087 1 410 . 1 1 69 69 LEU CD1 C 13 23.5502 . . 2 . . . A 69 LEU CD1 . 19087 1 411 . 1 1 69 69 LEU CD2 C 13 24.2952 . . 2 . . . A 69 LEU CD2 . 19087 1 412 . 1 1 69 69 LEU N N 15 121.0028 . . 1 . . . A 69 LEU N . 19087 1 413 . 1 1 70 70 SER H H 1 8.1221 . . 1 . . . A 70 SER H . 19087 1 414 . 1 1 70 70 SER HB2 H 1 3.7291 . . 2 . . . A 70 SER HB2 . 19087 1 415 . 1 1 70 70 SER C C 13 173.7767 . . 1 . . . A 70 SER C . 19087 1 416 . 1 1 70 70 SER CA C 13 56.9232 . . 1 . . . A 70 SER CA . 19087 1 417 . 1 1 70 70 SER CB C 13 63.2193 . . 1 . . . A 70 SER CB . 19087 1 418 . 1 1 70 70 SER N N 15 116.2687 . . 1 . . . A 70 SER N . 19087 1 419 . 1 1 71 71 LEU H H 1 8.2932 . . 1 . . . A 71 LEU H . 19087 1 420 . 1 1 71 71 LEU HA H 1 4.7564 . . 1 . . . A 71 LEU HA . 19087 1 421 . 1 1 71 71 LEU HB2 H 1 1.6473 . . 2 . . . A 71 LEU HB2 . 19087 1 422 . 1 1 71 71 LEU HG H 1 1.3906 . . 1 . . . A 71 LEU HG . 19087 1 423 . 1 1 71 71 LEU CA C 13 52.1646 . . 1 . . . A 71 LEU CA . 19087 1 424 . 1 1 71 71 LEU CB C 13 44.1789 . . 1 . . . A 71 LEU CB . 19087 1 425 . 1 1 71 71 LEU N N 15 127.9994 . . 1 . . . A 71 LEU N . 19087 1 426 . 1 1 72 72 PRO HA H 1 4.3596 . . 1 . . . A 72 PRO HA . 19087 1 427 . 1 1 72 72 PRO HB3 H 1 2.2821 . . 2 . . . A 72 PRO HB3 . 19087 1 428 . 1 1 72 72 PRO HG2 H 1 1.9169 . . 2 . . . A 72 PRO HG2 . 19087 1 429 . 1 1 72 72 PRO HD3 H 1 3.5479 . . 2 . . . A 72 PRO HD3 . 19087 1 430 . 1 1 72 72 PRO C C 13 176.9223 . . 1 . . . A 72 PRO C . 19087 1 431 . 1 1 72 72 PRO CA C 13 64.2439 . . 1 . . . A 72 PRO CA . 19087 1 432 . 1 1 72 72 PRO CB C 13 32.4658 . . 1 . . . A 72 PRO CB . 19087 1 433 . 1 1 72 72 PRO CG C 13 26.9671 . . 1 . . . A 72 PRO CG . 19087 1 434 . 1 1 72 72 PRO CD C 13 50.3490 . . 1 . . . A 72 PRO CD . 19087 1 435 . 1 1 73 73 ASP H H 1 8.4309 . . 1 . . . A 73 ASP H . 19087 1 436 . 1 1 73 73 ASP HA H 1 4.5575 . . 1 . . . A 73 ASP HA . 19087 1 437 . 1 1 73 73 ASP HB2 H 1 2.8126 . . 2 . . . A 73 ASP HB2 . 19087 1 438 . 1 1 73 73 ASP HB3 H 1 2.5740 . . 2 . . . A 73 ASP HB3 . 19087 1 439 . 1 1 73 73 ASP C C 13 175.8086 . . 1 . . . A 73 ASP C . 19087 1 440 . 1 1 73 73 ASP CA C 13 55.1450 . . 1 . . . A 73 ASP CA . 19087 1 441 . 1 1 73 73 ASP CB C 13 40.7784 . . 1 . . . A 73 ASP CB . 19087 1 442 . 1 1 73 73 ASP N N 15 115.1063 . . 1 . . . A 73 ASP N . 19087 1 443 . 1 1 74 74 VAL H H 1 7.4678 . . 1 . . . A 74 VAL H . 19087 1 444 . 1 1 74 74 VAL HA H 1 3.9663 . . 1 . . . A 74 VAL HA . 19087 1 445 . 1 1 74 74 VAL HB H 1 1.9122 . . 1 . . . A 74 VAL HB . 19087 1 446 . 1 1 74 74 VAL HG11 H 1 0.9861 . . 2 . . . A 74 VAL HG11 . 19087 1 447 . 1 1 74 74 VAL HG12 H 1 0.9861 . . 2 . . . A 74 VAL HG12 . 19087 1 448 . 1 1 74 74 VAL HG13 H 1 0.9861 . . 2 . . . A 74 VAL HG13 . 19087 1 449 . 1 1 74 74 VAL C C 13 175.3386 . . 1 . . . A 74 VAL C . 19087 1 450 . 1 1 74 74 VAL CA C 13 63.8707 . . 1 . . . A 74 VAL CA . 19087 1 451 . 1 1 74 74 VAL CB C 13 32.0754 . . 1 . . . A 74 VAL CB . 19087 1 452 . 1 1 74 74 VAL CG1 C 13 21.9056 . . 2 . . . A 74 VAL CG1 . 19087 1 453 . 1 1 74 74 VAL N N 15 122.2180 . . 1 . . . A 74 VAL N . 19087 1 454 . 1 1 75 75 ALA H H 1 8.5808 . . 1 . . . A 75 ALA H . 19087 1 455 . 1 1 75 75 ALA HA H 1 4.4248 . . 1 . . . A 75 ALA HA . 19087 1 456 . 1 1 75 75 ALA HB1 H 1 1.4051 . . 1 . . . A 75 ALA HB1 . 19087 1 457 . 1 1 75 75 ALA HB2 H 1 1.4051 . . 1 . . . A 75 ALA HB2 . 19087 1 458 . 1 1 75 75 ALA HB3 H 1 1.4051 . . 1 . . . A 75 ALA HB3 . 19087 1 459 . 1 1 75 75 ALA C C 13 176.4039 . . 1 . . . A 75 ALA C . 19087 1 460 . 1 1 75 75 ALA CA C 13 52.4268 . . 1 . . . A 75 ALA CA . 19087 1 461 . 1 1 75 75 ALA CB C 13 20.4713 . . 1 . . . A 75 ALA CB . 19087 1 462 . 1 1 75 75 ALA N N 15 128.6295 . . 1 . . . A 75 ALA N . 19087 1 463 . 1 1 76 76 ALA H H 1 7.4384 . . 1 . . . A 76 ALA H . 19087 1 464 . 1 1 76 76 ALA HA H 1 4.6573 . . 1 . . . A 76 ALA HA . 19087 1 465 . 1 1 76 76 ALA HB1 H 1 1.3243 . . 1 . . . A 76 ALA HB1 . 19087 1 466 . 1 1 76 76 ALA HB2 H 1 1.3243 . . 1 . . . A 76 ALA HB2 . 19087 1 467 . 1 1 76 76 ALA HB3 H 1 1.3243 . . 1 . . . A 76 ALA HB3 . 19087 1 468 . 1 1 76 76 ALA C C 13 175.9252 . . 1 . . . A 76 ALA C . 19087 1 469 . 1 1 76 76 ALA CA C 13 50.9948 . . 1 . . . A 76 ALA CA . 19087 1 470 . 1 1 76 76 ALA CB C 13 22.3653 . . 1 . . . A 76 ALA CB . 19087 1 471 . 1 1 76 76 ALA N N 15 120.4815 . . 1 . . . A 76 ALA N . 19087 1 472 . 1 1 77 77 THR H H 1 8.3901 . . 1 . . . A 77 THR H . 19087 1 473 . 1 1 77 77 THR HA H 1 4.7335 . . 1 . . . A 77 THR HA . 19087 1 474 . 1 1 77 77 THR HB H 1 4.1104 . . 1 . . . A 77 THR HB . 19087 1 475 . 1 1 77 77 THR HG21 H 1 1.1946 . . 1 . . . A 77 THR HG21 . 19087 1 476 . 1 1 77 77 THR HG22 H 1 1.1946 . . 1 . . . A 77 THR HG22 . 19087 1 477 . 1 1 77 77 THR HG23 H 1 1.1946 . . 1 . . . A 77 THR HG23 . 19087 1 478 . 1 1 77 77 THR C C 13 174.1430 . . 1 . . . A 77 THR C . 19087 1 479 . 1 1 77 77 THR CA C 13 63.9142 . . 1 . . . A 77 THR CA . 19087 1 480 . 1 1 77 77 THR CB C 13 70.0703 . . 1 . . . A 77 THR CB . 19087 1 481 . 1 1 77 77 THR CG2 C 13 20.7980 . . 1 . . . A 77 THR CG2 . 19087 1 482 . 1 1 77 77 THR N N 15 121.4636 . . 1 . . . A 77 THR N . 19087 1 483 . 1 1 78 78 THR H H 1 8.3547 . . 1 . . . A 78 THR H . 19087 1 484 . 1 1 78 78 THR HA H 1 4.6444 . . 1 . . . A 78 THR HA . 19087 1 485 . 1 1 78 78 THR HB H 1 3.4838 . . 1 . . . A 78 THR HB . 19087 1 486 . 1 1 78 78 THR HG21 H 1 0.4610 . . 1 . . . A 78 THR HG21 . 19087 1 487 . 1 1 78 78 THR HG22 H 1 0.4610 . . 1 . . . A 78 THR HG22 . 19087 1 488 . 1 1 78 78 THR HG23 H 1 0.4610 . . 1 . . . A 78 THR HG23 . 19087 1 489 . 1 1 78 78 THR C C 13 181.6836 . . 1 . . . A 78 THR C . 19087 1 490 . 1 1 78 78 THR CA C 13 62.5106 . . 1 . . . A 78 THR CA . 19087 1 491 . 1 1 78 78 THR CB C 13 72.8463 . . 1 . . . A 78 THR CB . 19087 1 492 . 1 1 78 78 THR CG2 C 13 20.7533 . . 1 . . . A 78 THR CG2 . 19087 1 493 . 1 1 78 78 THR N N 15 123.5383 . . 1 . . . A 78 THR N . 19087 1 494 . 1 1 79 79 VAL H H 1 8.6847 . . 1 . . . A 79 VAL H . 19087 1 495 . 1 1 79 79 VAL HA H 1 4.5962 . . 1 . . . A 79 VAL HA . 19087 1 496 . 1 1 79 79 VAL HB H 1 2.0863 . . 1 . . . A 79 VAL HB . 19087 1 497 . 1 1 79 79 VAL HG11 H 1 0.9546 . . 2 . . . A 79 VAL HG11 . 19087 1 498 . 1 1 79 79 VAL HG12 H 1 0.9546 . . 2 . . . A 79 VAL HG12 . 19087 1 499 . 1 1 79 79 VAL HG13 H 1 0.9546 . . 2 . . . A 79 VAL HG13 . 19087 1 500 . 1 1 79 79 VAL HG21 H 1 0.6918 . . 2 . . . A 79 VAL HG21 . 19087 1 501 . 1 1 79 79 VAL HG22 H 1 0.6918 . . 2 . . . A 79 VAL HG22 . 19087 1 502 . 1 1 79 79 VAL HG23 H 1 0.6918 . . 2 . . . A 79 VAL HG23 . 19087 1 503 . 1 1 79 79 VAL C C 13 173.7016 . . 1 . . . A 79 VAL C . 19087 1 504 . 1 1 79 79 VAL CA C 13 60.3850 . . 1 . . . A 79 VAL CA . 19087 1 505 . 1 1 79 79 VAL CB C 13 33.0886 . . 1 . . . A 79 VAL CB . 19087 1 506 . 1 1 79 79 VAL CG1 C 13 21.7925 . . 2 . . . A 79 VAL CG1 . 19087 1 507 . 1 1 79 79 VAL N N 15 126.4548 . . 1 . . . A 79 VAL N . 19087 1 508 . 1 1 80 80 TYR H H 1 9.7016 . . 1 . . . A 80 TYR H . 19087 1 509 . 1 1 80 80 TYR HA H 1 6.3999 . . 1 . . . A 80 TYR HA . 19087 1 510 . 1 1 80 80 TYR HB2 H 1 2.7220 . . 2 . . . A 80 TYR HB2 . 19087 1 511 . 1 1 80 80 TYR C C 13 176.4103 . . 1 . . . A 80 TYR C . 19087 1 512 . 1 1 80 80 TYR CA C 13 56.6085 . . 1 . . . A 80 TYR CA . 19087 1 513 . 1 1 80 80 TYR CB C 13 42.5671 . . 1 . . . A 80 TYR CB . 19087 1 514 . 1 1 80 80 TYR N N 15 123.5738 . . 1 . . . A 80 TYR N . 19087 1 515 . 1 1 81 81 TYR H H 1 8.2212 . . 1 . . . A 81 TYR H . 19087 1 516 . 1 1 81 81 TYR HA H 1 5.4742 . . 1 . . . A 81 TYR HA . 19087 1 517 . 1 1 81 81 TYR HB2 H 1 3.0988 . . 2 . . . A 81 TYR HB2 . 19087 1 518 . 1 1 81 81 TYR HB3 H 1 2.6736 . . 2 . . . A 81 TYR HB3 . 19087 1 519 . 1 1 81 81 TYR C C 13 173.2373 . . 1 . . . A 81 TYR C . 19087 1 520 . 1 1 81 81 TYR CA C 13 55.4982 . . 1 . . . A 81 TYR CA . 19087 1 521 . 1 1 81 81 TYR CB C 13 42.2493 . . 1 . . . A 81 TYR CB . 19087 1 522 . 1 1 81 81 TYR N N 15 117.7543 . . 1 . . . A 81 TYR N . 19087 1 523 . 1 1 82 82 THR H H 1 8.2451 . . 1 . . . A 82 THR H . 19087 1 524 . 1 1 82 82 THR HA H 1 4.7242 . . 1 . . . A 82 THR HA . 19087 1 525 . 1 1 82 82 THR HB H 1 4.3760 . . 1 . . . A 82 THR HB . 19087 1 526 . 1 1 82 82 THR HG21 H 1 1.1775 . . 1 . . . A 82 THR HG21 . 19087 1 527 . 1 1 82 82 THR HG22 H 1 1.1775 . . 1 . . . A 82 THR HG22 . 19087 1 528 . 1 1 82 82 THR HG23 H 1 1.1775 . . 1 . . . A 82 THR HG23 . 19087 1 529 . 1 1 82 82 THR C C 13 174.5213 . . 1 . . . A 82 THR C . 19087 1 530 . 1 1 82 82 THR CA C 13 60.8958 . . 1 . . . A 82 THR CA . 19087 1 531 . 1 1 82 82 THR CB C 13 71.5064 . . 1 . . . A 82 THR CB . 19087 1 532 . 1 1 82 82 THR CG2 C 13 21.6350 . . 1 . . . A 82 THR CG2 . 19087 1 533 . 1 1 82 82 THR N N 15 111.0556 . . 1 . . . A 82 THR N . 19087 1 534 . 1 1 83 83 GLU H H 1 8.7722 . . 1 . . . A 83 GLU H . 19087 1 535 . 1 1 83 83 GLU HA H 1 4.4770 . . 1 . . . A 83 GLU HA . 19087 1 536 . 1 1 83 83 GLU HB2 H 1 1.9890 . . 2 . . . A 83 GLU HB2 . 19087 1 537 . 1 1 83 83 GLU HG2 H 1 2.3534 . . 2 . . . A 83 GLU HG2 . 19087 1 538 . 1 1 83 83 GLU C C 13 176.1518 . . 1 . . . A 83 GLU C . 19087 1 539 . 1 1 83 83 GLU CA C 13 57.1787 . . 1 . . . A 83 GLU CA . 19087 1 540 . 1 1 83 83 GLU CB C 13 28.7139 . . 1 . . . A 83 GLU CB . 19087 1 541 . 1 1 83 83 GLU CG C 13 36.5667 . . 1 . . . A 83 GLU CG . 19087 1 542 . 1 1 83 83 GLU N N 15 117.0584 . . 1 . . . A 83 GLU N . 19087 1 543 . 1 1 84 84 VAL H H 1 7.8180 . . 1 . . . A 84 VAL H . 19087 1 544 . 1 1 84 84 VAL HA H 1 3.8942 . . 1 . . . A 84 VAL HA . 19087 1 545 . 1 1 84 84 VAL HB H 1 1.8335 . . 1 . . . A 84 VAL HB . 19087 1 546 . 1 1 84 84 VAL HG11 H 1 1.0192 . . 2 . . . A 84 VAL HG11 . 19087 1 547 . 1 1 84 84 VAL HG12 H 1 1.0192 . . 2 . . . A 84 VAL HG12 . 19087 1 548 . 1 1 84 84 VAL HG13 H 1 1.0192 . . 2 . . . A 84 VAL HG13 . 19087 1 549 . 1 1 84 84 VAL C C 13 177.1702 . . 1 . . . A 84 VAL C . 19087 1 550 . 1 1 84 84 VAL CA C 13 63.6778 . . 1 . . . A 84 VAL CA . 19087 1 551 . 1 1 84 84 VAL CB C 13 32.4736 . . 1 . . . A 84 VAL CB . 19087 1 552 . 1 1 84 84 VAL CG1 C 13 22.3767 . . 2 . . . A 84 VAL CG1 . 19087 1 553 . 1 1 84 84 VAL CG2 C 13 21.3133 . . 2 . . . A 84 VAL CG2 . 19087 1 554 . 1 1 84 84 VAL N N 15 123.0392 . . 1 . . . A 84 VAL N . 19087 1 555 . 1 1 85 85 GLU H H 1 8.7963 . . 1 . . . A 85 GLU H . 19087 1 556 . 1 1 85 85 GLU HA H 1 3.8917 . . 1 . . . A 85 GLU HA . 19087 1 557 . 1 1 85 85 GLU CA C 13 59.0046 . . 1 . . . A 85 GLU CA . 19087 1 558 . 1 1 85 85 GLU CB C 13 29.5231 . . 1 . . . A 85 GLU CB . 19087 1 559 . 1 1 85 85 GLU N N 15 129.3514 . . 1 . . . A 85 GLU N . 19087 1 560 . 1 1 86 86 GLY HA2 H 1 4.4042 . . 2 . . . A 86 GLY HA2 . 19087 1 561 . 1 1 86 86 GLY HA3 H 1 3.8700 . . 2 . . . A 86 GLY HA3 . 19087 1 562 . 1 1 86 86 GLY C C 13 176.3209 . . 1 . . . A 86 GLY C . 19087 1 563 . 1 1 86 86 GLY CA C 13 45.8757 . . 1 . . . A 86 GLY CA . 19087 1 564 . 1 1 87 87 GLU H H 1 8.1326 . . 1 . . . A 87 GLU H . 19087 1 565 . 1 1 87 87 GLU HA H 1 3.9480 . . 1 . . . A 87 GLU HA . 19087 1 566 . 1 1 87 87 GLU HB2 H 1 2.0620 . . 2 . . . A 87 GLU HB2 . 19087 1 567 . 1 1 87 87 GLU HG2 H 1 2.2746 . . 2 . . . A 87 GLU HG2 . 19087 1 568 . 1 1 87 87 GLU HG3 H 1 2.5242 . . 2 . . . A 87 GLU HG3 . 19087 1 569 . 1 1 87 87 GLU C C 13 178.2756 . . 1 . . . A 87 GLU C . 19087 1 570 . 1 1 87 87 GLU CA C 13 61.7622 . . 1 . . . A 87 GLU CA . 19087 1 571 . 1 1 87 87 GLU CB C 13 30.0962 . . 1 . . . A 87 GLU CB . 19087 1 572 . 1 1 87 87 GLU CG C 13 36.1258 . . 1 . . . A 87 GLU CG . 19087 1 573 . 1 1 87 87 GLU N N 15 121.7731 . . 1 . . . A 87 GLU N . 19087 1 574 . 1 1 88 88 ARG H H 1 9.1315 . . 1 . . . A 88 ARG H . 19087 1 575 . 1 1 88 88 ARG HA H 1 3.3617 . . 1 . . . A 88 ARG HA . 19087 1 576 . 1 1 88 88 ARG HB2 H 1 1.6851 . . 2 . . . A 88 ARG HB2 . 19087 1 577 . 1 1 88 88 ARG HG2 H 1 1.4425 . . 2 . . . A 88 ARG HG2 . 19087 1 578 . 1 1 88 88 ARG HG3 H 1 0.7540 . . 2 . . . A 88 ARG HG3 . 19087 1 579 . 1 1 88 88 ARG HD3 H 1 2.4619 . . 2 . . . A 88 ARG HD3 . 19087 1 580 . 1 1 88 88 ARG C C 13 177.2294 . . 1 . . . A 88 ARG C . 19087 1 581 . 1 1 88 88 ARG CA C 13 59.4926 . . 1 . . . A 88 ARG CA . 19087 1 582 . 1 1 88 88 ARG CB C 13 29.0595 . . 1 . . . A 88 ARG CB . 19087 1 583 . 1 1 88 88 ARG CG C 13 26.1917 . . 1 . . . A 88 ARG CG . 19087 1 584 . 1 1 88 88 ARG CD C 13 41.3396 . . 1 . . . A 88 ARG CD . 19087 1 585 . 1 1 88 88 ARG N N 15 121.4659 . . 1 . . . A 88 ARG N . 19087 1 586 . 1 1 89 89 ALA H H 1 8.3882 . . 1 . . . A 89 ALA H . 19087 1 587 . 1 1 89 89 ALA HA H 1 4.1827 . . 1 . . . A 89 ALA HA . 19087 1 588 . 1 1 89 89 ALA HB1 H 1 1.4541 . . 1 . . . A 89 ALA HB1 . 19087 1 589 . 1 1 89 89 ALA HB2 H 1 1.4541 . . 1 . . . A 89 ALA HB2 . 19087 1 590 . 1 1 89 89 ALA HB3 H 1 1.4541 . . 1 . . . A 89 ALA HB3 . 19087 1 591 . 1 1 89 89 ALA C C 13 181.9491 . . 1 . . . A 89 ALA C . 19087 1 592 . 1 1 89 89 ALA CA C 13 55.2820 . . 1 . . . A 89 ALA CA . 19087 1 593 . 1 1 89 89 ALA CB C 13 18.1284 . . 1 . . . A 89 ALA CB . 19087 1 594 . 1 1 89 89 ALA N N 15 119.5273 . . 1 . . . A 89 ALA N . 19087 1 595 . 1 1 90 90 THR H H 1 7.6399 . . 1 . . . A 90 THR H . 19087 1 596 . 1 1 90 90 THR HA H 1 4.1465 . . 1 . . . A 90 THR HA . 19087 1 597 . 1 1 90 90 THR HB H 1 4.2857 . . 1 . . . A 90 THR HB . 19087 1 598 . 1 1 90 90 THR HG21 H 1 1.2964 . . 1 . . . A 90 THR HG21 . 19087 1 599 . 1 1 90 90 THR HG22 H 1 1.2964 . . 1 . . . A 90 THR HG22 . 19087 1 600 . 1 1 90 90 THR HG23 H 1 1.2964 . . 1 . . . A 90 THR HG23 . 19087 1 601 . 1 1 90 90 THR C C 13 175.1184 . . 1 . . . A 90 THR C . 19087 1 602 . 1 1 90 90 THR CA C 13 66.6066 . . 1 . . . A 90 THR CA . 19087 1 603 . 1 1 90 90 THR CB C 13 68.9710 . . 1 . . . A 90 THR CB . 19087 1 604 . 1 1 90 90 THR CG2 C 13 21.1173 . . 1 . . . A 90 THR CG2 . 19087 1 605 . 1 1 90 90 THR N N 15 115.2795 . . 1 . . . A 90 THR N . 19087 1 606 . 1 1 91 91 ALA H H 1 9.0945 . . 1 . . . A 91 ALA H . 19087 1 607 . 1 1 91 91 ALA HA H 1 3.7694 . . 1 . . . A 91 ALA HA . 19087 1 608 . 1 1 91 91 ALA HB1 H 1 1.4826 . . 1 . . . A 91 ALA HB1 . 19087 1 609 . 1 1 91 91 ALA HB2 H 1 1.4826 . . 1 . . . A 91 ALA HB2 . 19087 1 610 . 1 1 91 91 ALA HB3 H 1 1.4826 . . 1 . . . A 91 ALA HB3 . 19087 1 611 . 1 1 91 91 ALA C C 13 178.5458 . . 1 . . . A 91 ALA C . 19087 1 612 . 1 1 91 91 ALA CA C 13 55.5519 . . 1 . . . A 91 ALA CA . 19087 1 613 . 1 1 91 91 ALA CB C 13 19.2535 . . 1 . . . A 91 ALA CB . 19087 1 614 . 1 1 91 91 ALA N N 15 124.7837 . . 1 . . . A 91 ALA N . 19087 1 615 . 1 1 92 92 ASP H H 1 8.8976 . . 1 . . . A 92 ASP H . 19087 1 616 . 1 1 92 92 ASP HA H 1 4.4167 . . 1 . . . A 92 ASP HA . 19087 1 617 . 1 1 92 92 ASP HB2 H 1 2.6357 . . 2 . . . A 92 ASP HB2 . 19087 1 618 . 1 1 92 92 ASP C C 13 179.0534 . . 1 . . . A 92 ASP C . 19087 1 619 . 1 1 92 92 ASP CA C 13 57.6420 . . 1 . . . A 92 ASP CA . 19087 1 620 . 1 1 92 92 ASP CB C 13 40.4288 . . 1 . . . A 92 ASP CB . 19087 1 621 . 1 1 92 92 ASP N N 15 118.3103 . . 1 . . . A 92 ASP N . 19087 1 622 . 1 1 93 93 ALA H H 1 7.4240 . . 1 . . . A 93 ALA H . 19087 1 623 . 1 1 93 93 ALA HA H 1 4.2740 . . 1 . . . A 93 ALA HA . 19087 1 624 . 1 1 93 93 ALA HB1 H 1 1.8717 . . 1 . . . A 93 ALA HB1 . 19087 1 625 . 1 1 93 93 ALA HB2 H 1 1.8717 . . 1 . . . A 93 ALA HB2 . 19087 1 626 . 1 1 93 93 ALA HB3 H 1 1.8717 . . 1 . . . A 93 ALA HB3 . 19087 1 627 . 1 1 93 93 ALA C C 13 180.9329 . . 1 . . . A 93 ALA C . 19087 1 628 . 1 1 93 93 ALA CA C 13 55.5748 . . 1 . . . A 93 ALA CA . 19087 1 629 . 1 1 93 93 ALA CB C 13 18.1759 . . 1 . . . A 93 ALA CB . 19087 1 630 . 1 1 93 93 ALA N N 15 122.9801 . . 1 . . . A 93 ALA N . 19087 1 631 . 1 1 94 94 VAL H H 1 8.8078 . . 1 . . . A 94 VAL H . 19087 1 632 . 1 1 94 94 VAL HA H 1 2.9442 . . 1 . . . A 94 VAL HA . 19087 1 633 . 1 1 94 94 VAL HB H 1 1.9748 . . 1 . . . A 94 VAL HB . 19087 1 634 . 1 1 94 94 VAL HG11 H 1 0.5596 . . 2 . . . A 94 VAL HG11 . 19087 1 635 . 1 1 94 94 VAL HG12 H 1 0.5596 . . 2 . . . A 94 VAL HG12 . 19087 1 636 . 1 1 94 94 VAL HG13 H 1 0.5596 . . 2 . . . A 94 VAL HG13 . 19087 1 637 . 1 1 94 94 VAL HG21 H 1 0.0751 . . 2 . . . A 94 VAL HG21 . 19087 1 638 . 1 1 94 94 VAL HG22 H 1 0.0751 . . 2 . . . A 94 VAL HG22 . 19087 1 639 . 1 1 94 94 VAL HG23 H 1 0.0751 . . 2 . . . A 94 VAL HG23 . 19087 1 640 . 1 1 94 94 VAL C C 13 178.2689 . . 1 . . . A 94 VAL C . 19087 1 641 . 1 1 94 94 VAL CA C 13 66.3993 . . 1 . . . A 94 VAL CA . 19087 1 642 . 1 1 94 94 VAL CB C 13 30.7030 . . 1 . . . A 94 VAL CB . 19087 1 643 . 1 1 94 94 VAL CG1 C 13 22.8117 . . 2 . . . A 94 VAL CG1 . 19087 1 644 . 1 1 94 94 VAL N N 15 123.9676 . . 1 . . . A 94 VAL N . 19087 1 645 . 1 1 95 95 GLY H H 1 9.3549 . . 1 . . . A 95 GLY H . 19087 1 646 . 1 1 95 95 GLY HA2 H 1 3.7042 . . 2 . . . A 95 GLY HA2 . 19087 1 647 . 1 1 95 95 GLY HA3 H 1 3.5121 . . 2 . . . A 95 GLY HA3 . 19087 1 648 . 1 1 95 95 GLY C C 13 176.4403 . . 1 . . . A 95 GLY C . 19087 1 649 . 1 1 95 95 GLY CA C 13 47.9194 . . 1 . . . A 95 GLY CA . 19087 1 650 . 1 1 95 95 GLY N N 15 108.2816 . . 1 . . . A 95 GLY N . 19087 1 651 . 1 1 96 96 ARG H H 1 8.1124 . . 1 . . . A 96 ARG H . 19087 1 652 . 1 1 96 96 ARG HA H 1 4.2030 . . 1 . . . A 96 ARG HA . 19087 1 653 . 1 1 96 96 ARG HB2 H 1 1.9911 . . 2 . . . A 96 ARG HB2 . 19087 1 654 . 1 1 96 96 ARG HG2 H 1 1.6805 . . 2 . . . A 96 ARG HG2 . 19087 1 655 . 1 1 96 96 ARG HD3 H 1 3.2702 . . 2 . . . A 96 ARG HD3 . 19087 1 656 . 1 1 96 96 ARG C C 13 179.1011 . . 1 . . . A 96 ARG C . 19087 1 657 . 1 1 96 96 ARG CA C 13 59.2102 . . 1 . . . A 96 ARG CA . 19087 1 658 . 1 1 96 96 ARG CB C 13 30.5344 . . 1 . . . A 96 ARG CB . 19087 1 659 . 1 1 96 96 ARG CG C 13 27.9348 . . 1 . . . A 96 ARG CG . 19087 1 660 . 1 1 96 96 ARG CD C 13 43.4140 . . 1 . . . A 96 ARG CD . 19087 1 661 . 1 1 96 96 ARG N N 15 120.8522 . . 1 . . . A 96 ARG N . 19087 1 662 . 1 1 97 97 THR H H 1 7.8545 . . 1 . . . A 97 THR H . 19087 1 663 . 1 1 97 97 THR HA H 1 3.9863 . . 1 . . . A 97 THR HA . 19087 1 664 . 1 1 97 97 THR HB H 1 4.3461 . . 1 . . . A 97 THR HB . 19087 1 665 . 1 1 97 97 THR HG21 H 1 1.2200 . . 1 . . . A 97 THR HG21 . 19087 1 666 . 1 1 97 97 THR HG22 H 1 1.2200 . . 1 . . . A 97 THR HG22 . 19087 1 667 . 1 1 97 97 THR HG23 H 1 1.2200 . . 1 . . . A 97 THR HG23 . 19087 1 668 . 1 1 97 97 THR C C 13 175.4506 . . 1 . . . A 97 THR C . 19087 1 669 . 1 1 97 97 THR CA C 13 66.8674 . . 1 . . . A 97 THR CA . 19087 1 670 . 1 1 97 97 THR CB C 13 68.2051 . . 1 . . . A 97 THR CB . 19087 1 671 . 1 1 97 97 THR CG2 C 13 20.9422 . . 1 . . . A 97 THR CG2 . 19087 1 672 . 1 1 97 97 THR N N 15 117.1699 . . 1 . . . A 97 THR N . 19087 1 673 . 1 1 98 98 LEU H H 1 7.8548 . . 1 . . . A 98 LEU H . 19087 1 674 . 1 1 98 98 LEU HA H 1 4.3053 . . 1 . . . A 98 LEU HA . 19087 1 675 . 1 1 98 98 LEU HB2 H 1 1.5044 . . 2 . . . A 98 LEU HB2 . 19087 1 676 . 1 1 98 98 LEU HG H 1 1.7331 . . 1 . . . A 98 LEU HG . 19087 1 677 . 1 1 98 98 LEU HD11 H 1 0.7613 . . 2 . . . A 98 LEU HD11 . 19087 1 678 . 1 1 98 98 LEU HD12 H 1 0.7613 . . 2 . . . A 98 LEU HD12 . 19087 1 679 . 1 1 98 98 LEU HD13 H 1 0.7613 . . 2 . . . A 98 LEU HD13 . 19087 1 680 . 1 1 98 98 LEU HD21 H 1 0.5610 . . 2 . . . A 98 LEU HD21 . 19087 1 681 . 1 1 98 98 LEU HD22 H 1 0.5610 . . 2 . . . A 98 LEU HD22 . 19087 1 682 . 1 1 98 98 LEU HD23 H 1 0.5610 . . 2 . . . A 98 LEU HD23 . 19087 1 683 . 1 1 98 98 LEU C C 13 177.5371 . . 1 . . . A 98 LEU C . 19087 1 684 . 1 1 98 98 LEU CA C 13 54.5826 . . 1 . . . A 98 LEU CA . 19087 1 685 . 1 1 98 98 LEU CB C 13 43.3728 . . 1 . . . A 98 LEU CB . 19087 1 686 . 1 1 98 98 LEU CG C 13 26.2672 . . 1 . . . A 98 LEU CG . 19087 1 687 . 1 1 98 98 LEU CD1 C 13 21.3626 . . 2 . . . A 98 LEU CD1 . 19087 1 688 . 1 1 98 98 LEU N N 15 115.2938 . . 1 . . . A 98 LEU N . 19087 1 689 . 1 1 99 99 GLY H H 1 8.1015 . . 1 . . . A 99 GLY H . 19087 1 690 . 1 1 99 99 GLY HA2 H 1 3.9109 . . 2 . . . A 99 GLY HA2 . 19087 1 691 . 1 1 99 99 GLY C C 13 173.9968 . . 1 . . . A 99 GLY C . 19087 1 692 . 1 1 99 99 GLY CA C 13 46.9928 . . 1 . . . A 99 GLY CA . 19087 1 693 . 1 1 99 99 GLY N N 15 111.9311 . . 1 . . . A 99 GLY N . 19087 1 694 . 1 1 100 100 ALA H H 1 8.0333 . . 1 . . . A 100 ALA H . 19087 1 695 . 1 1 100 100 ALA HA H 1 4.7368 . . 1 . . . A 100 ALA HA . 19087 1 696 . 1 1 100 100 ALA HB1 H 1 1.1425 . . 1 . . . A 100 ALA HB1 . 19087 1 697 . 1 1 100 100 ALA HB2 H 1 1.1425 . . 1 . . . A 100 ALA HB2 . 19087 1 698 . 1 1 100 100 ALA HB3 H 1 1.1425 . . 1 . . . A 100 ALA HB3 . 19087 1 699 . 1 1 100 100 ALA C C 13 175.3509 . . 1 . . . A 100 ALA C . 19087 1 700 . 1 1 100 100 ALA CA C 13 50.4064 . . 1 . . . A 100 ALA CA . 19087 1 701 . 1 1 100 100 ALA CB C 13 23.9586 . . 1 . . . A 100 ALA CB . 19087 1 702 . 1 1 100 100 ALA N N 15 121.7390 . . 1 . . . A 100 ALA N . 19087 1 703 . 1 1 101 101 ALA H H 1 7.7817 . . 1 . . . A 101 ALA H . 19087 1 704 . 1 1 101 101 ALA HA H 1 4.2092 . . 1 . . . A 101 ALA HA . 19087 1 705 . 1 1 101 101 ALA HB1 H 1 1.4514 . . 1 . . . A 101 ALA HB1 . 19087 1 706 . 1 1 101 101 ALA HB2 H 1 1.4514 . . 1 . . . A 101 ALA HB2 . 19087 1 707 . 1 1 101 101 ALA HB3 H 1 1.4514 . . 1 . . . A 101 ALA HB3 . 19087 1 708 . 1 1 101 101 ALA C C 13 175.1795 . . 1 . . . A 101 ALA C . 19087 1 709 . 1 1 101 101 ALA CA C 13 52.7374 . . 1 . . . A 101 ALA CA . 19087 1 710 . 1 1 101 101 ALA CB C 13 19.8140 . . 1 . . . A 101 ALA CB . 19087 1 711 . 1 1 101 101 ALA N N 15 122.8946 . . 1 . . . A 101 ALA N . 19087 1 712 . 1 1 102 102 VAL H H 1 7.8715 . . 1 . . . A 102 VAL H . 19087 1 713 . 1 1 102 102 VAL HA H 1 5.0541 . . 1 . . . A 102 VAL HA . 19087 1 714 . 1 1 102 102 VAL HB H 1 1.9496 . . 1 . . . A 102 VAL HB . 19087 1 715 . 1 1 102 102 VAL HG11 H 1 0.9045 . . 2 . . . A 102 VAL HG11 . 19087 1 716 . 1 1 102 102 VAL HG12 H 1 0.9045 . . 2 . . . A 102 VAL HG12 . 19087 1 717 . 1 1 102 102 VAL HG13 H 1 0.9045 . . 2 . . . A 102 VAL HG13 . 19087 1 718 . 1 1 102 102 VAL C C 13 176.5872 . . 1 . . . A 102 VAL C . 19087 1 719 . 1 1 102 102 VAL CA C 13 60.9880 . . 1 . . . A 102 VAL CA . 19087 1 720 . 1 1 102 102 VAL CB C 13 33.7255 . . 1 . . . A 102 VAL CB . 19087 1 721 . 1 1 102 102 VAL CG1 C 13 21.9768 . . 2 . . . A 102 VAL CG1 . 19087 1 722 . 1 1 102 102 VAL N N 15 120.0349 . . 1 . . . A 102 VAL N . 19087 1 723 . 1 1 103 103 GLU H H 1 9.2150 . . 1 . . . A 103 GLU H . 19087 1 724 . 1 1 103 103 GLU HA H 1 4.8786 . . 1 . . . A 103 GLU HA . 19087 1 725 . 1 1 103 103 GLU HB2 H 1 1.5986 . . 2 . . . A 103 GLU HB2 . 19087 1 726 . 1 1 103 103 GLU HG2 H 1 2.1833 . . 2 . . . A 103 GLU HG2 . 19087 1 727 . 1 1 103 103 GLU C C 13 174.3432 . . 1 . . . A 103 GLU C . 19087 1 728 . 1 1 103 103 GLU CA C 13 54.3506 . . 1 . . . A 103 GLU CA . 19087 1 729 . 1 1 103 103 GLU CB C 13 35.5951 . . 1 . . . A 103 GLU CB . 19087 1 730 . 1 1 103 103 GLU CG C 13 37.2447 . . 1 . . . A 103 GLU CG . 19087 1 731 . 1 1 103 103 GLU N N 15 126.4685 . . 1 . . . A 103 GLU N . 19087 1 732 . 1 1 104 104 LEU H H 1 8.2731 . . 1 . . . A 104 LEU H . 19087 1 733 . 1 1 104 104 LEU HA H 1 3.5914 . . 1 . . . A 104 LEU HA . 19087 1 734 . 1 1 104 104 LEU HB2 H 1 1.4199 . . 2 . . . A 104 LEU HB2 . 19087 1 735 . 1 1 104 104 LEU HD11 H 1 0.7843 . . 2 . . . A 104 LEU HD11 . 19087 1 736 . 1 1 104 104 LEU HD12 H 1 0.7843 . . 2 . . . A 104 LEU HD12 . 19087 1 737 . 1 1 104 104 LEU HD13 H 1 0.7843 . . 2 . . . A 104 LEU HD13 . 19087 1 738 . 1 1 104 104 LEU C C 13 178.3785 . . 1 . . . A 104 LEU C . 19087 1 739 . 1 1 104 104 LEU CA C 13 54.9205 . . 1 . . . A 104 LEU CA . 19087 1 740 . 1 1 104 104 LEU CB C 13 42.9100 . . 1 . . . A 104 LEU CB . 19087 1 741 . 1 1 104 104 LEU CG C 13 26.8805 . . 1 . . . A 104 LEU CG . 19087 1 742 . 1 1 104 104 LEU CD1 C 13 24.9262 . . 2 . . . A 104 LEU CD1 . 19087 1 743 . 1 1 104 104 LEU N N 15 123.1088 . . 1 . . . A 104 LEU N . 19087 1 744 . 1 1 105 105 ARG H H 1 8.3001 . . 1 . . . A 105 ARG H . 19087 1 745 . 1 1 105 105 ARG HA H 1 4.2614 . . 1 . . . A 105 ARG HA . 19087 1 746 . 1 1 105 105 ARG C C 13 177.0435 . . 1 . . . A 105 ARG C . 19087 1 747 . 1 1 105 105 ARG CA C 13 59.3096 . . 1 . . . A 105 ARG CA . 19087 1 748 . 1 1 105 105 ARG CB C 13 32.0767 . . 1 . . . A 105 ARG CB . 19087 1 749 . 1 1 105 105 ARG N N 15 119.7896 . . 1 . . . A 105 ARG N . 19087 1 750 . 1 1 106 106 LEU H H 1 8.0260 . . 1 . . . A 106 LEU H . 19087 1 751 . 1 1 106 106 LEU HA H 1 4.3980 . . 1 . . . A 106 LEU HA . 19087 1 752 . 1 1 106 106 LEU HB2 H 1 2.0583 . . 2 . . . A 106 LEU HB2 . 19087 1 753 . 1 1 106 106 LEU HG H 1 1.5695 . . 1 . . . A 106 LEU HG . 19087 1 754 . 1 1 106 106 LEU HD11 H 1 0.9333 . . 2 . . . A 106 LEU HD11 . 19087 1 755 . 1 1 106 106 LEU HD12 H 1 0.9333 . . 2 . . . A 106 LEU HD12 . 19087 1 756 . 1 1 106 106 LEU HD13 H 1 0.9333 . . 2 . . . A 106 LEU HD13 . 19087 1 757 . 1 1 106 106 LEU CA C 13 54.7007 . . 1 . . . A 106 LEU CA . 19087 1 758 . 1 1 106 106 LEU CB C 13 42.4692 . . 1 . . . A 106 LEU CB . 19087 1 759 . 1 1 106 106 LEU N N 15 122.4314 . . 1 . . . A 106 LEU N . 19087 1 760 . 1 1 107 107 PRO HA H 1 4.2388 . . 1 . . . A 107 PRO HA . 19087 1 761 . 1 1 107 107 PRO HB3 H 1 2.3482 . . 2 . . . A 107 PRO HB3 . 19087 1 762 . 1 1 107 107 PRO HG2 H 1 2.1168 . . 2 . . . A 107 PRO HG2 . 19087 1 763 . 1 1 107 107 PRO HG3 H 1 1.9147 . . 2 . . . A 107 PRO HG3 . 19087 1 764 . 1 1 107 107 PRO C C 13 179.6272 . . 1 . . . A 107 PRO C . 19087 1 765 . 1 1 107 107 PRO CA C 13 65.8977 . . 1 . . . A 107 PRO CA . 19087 1 766 . 1 1 107 107 PRO CB C 13 31.5192 . . 1 . . . A 107 PRO CB . 19087 1 767 . 1 1 107 107 PRO CG C 13 27.7849 . . 1 . . . A 107 PRO CG . 19087 1 768 . 1 1 107 107 PRO CD C 13 37.0759 . . 1 . . . A 107 PRO CD . 19087 1 769 . 1 1 108 108 GLU H H 1 9.6049 . . 1 . . . A 108 GLU H . 19087 1 770 . 1 1 108 108 GLU HA H 1 4.0983 . . 1 . . . A 108 GLU HA . 19087 1 771 . 1 1 108 108 GLU HB2 H 1 1.8805 . . 2 . . . A 108 GLU HB2 . 19087 1 772 . 1 1 108 108 GLU HG2 H 1 2.2620 . . 2 . . . A 108 GLU HG2 . 19087 1 773 . 1 1 108 108 GLU C C 13 176.9566 . . 1 . . . A 108 GLU C . 19087 1 774 . 1 1 108 108 GLU CA C 13 59.5841 . . 1 . . . A 108 GLU CA . 19087 1 775 . 1 1 108 108 GLU CB C 13 29.1571 . . 1 . . . A 108 GLU CB . 19087 1 776 . 1 1 108 108 GLU CG C 13 35.7086 . . 1 . . . A 108 GLU CG . 19087 1 777 . 1 1 108 108 GLU N N 15 116.7443 . . 1 . . . A 108 GLU N . 19087 1 778 . 1 1 109 109 LEU H H 1 7.6301 . . 1 . . . A 109 LEU H . 19087 1 779 . 1 1 109 109 LEU HA H 1 4.5298 . . 1 . . . A 109 LEU HA . 19087 1 780 . 1 1 109 109 LEU HB2 H 1 1.3854 . . 2 . . . A 109 LEU HB2 . 19087 1 781 . 1 1 109 109 LEU HG H 1 1.1663 . . 1 . . . A 109 LEU HG . 19087 1 782 . 1 1 109 109 LEU HD11 H 1 0.2409 . . 2 . . . A 109 LEU HD11 . 19087 1 783 . 1 1 109 109 LEU HD12 H 1 0.2409 . . 2 . . . A 109 LEU HD12 . 19087 1 784 . 1 1 109 109 LEU HD13 H 1 0.2409 . . 2 . . . A 109 LEU HD13 . 19087 1 785 . 1 1 109 109 LEU HD21 H 1 0.6205 . . 2 . . . A 109 LEU HD21 . 19087 1 786 . 1 1 109 109 LEU HD22 H 1 0.6205 . . 2 . . . A 109 LEU HD22 . 19087 1 787 . 1 1 109 109 LEU HD23 H 1 0.6205 . . 2 . . . A 109 LEU HD23 . 19087 1 788 . 1 1 109 109 LEU C C 13 177.8943 . . 1 . . . A 109 LEU C . 19087 1 789 . 1 1 109 109 LEU CA C 13 53.4892 . . 1 . . . A 109 LEU CA . 19087 1 790 . 1 1 109 109 LEU CB C 13 42.2407 . . 1 . . . A 109 LEU CB . 19087 1 791 . 1 1 109 109 LEU CG C 13 26.3798 . . 1 . . . A 109 LEU CG . 19087 1 792 . 1 1 109 109 LEU CD1 C 13 22.6151 . . 2 . . . A 109 LEU CD1 . 19087 1 793 . 1 1 109 109 LEU N N 15 116.5746 . . 1 . . . A 109 LEU N . 19087 1 794 . 1 1 110 110 SER H H 1 7.7566 . . 1 . . . A 110 SER H . 19087 1 795 . 1 1 110 110 SER HA H 1 3.9430 . . 1 . . . A 110 SER HA . 19087 1 796 . 1 1 110 110 SER HB2 H 1 4.0051 . . 2 . . . A 110 SER HB2 . 19087 1 797 . 1 1 110 110 SER C C 13 174.2729 . . 1 . . . A 110 SER C . 19087 1 798 . 1 1 110 110 SER CA C 13 59.5428 . . 1 . . . A 110 SER CA . 19087 1 799 . 1 1 110 110 SER CB C 13 63.6089 . . 1 . . . A 110 SER CB . 19087 1 800 . 1 1 110 110 SER N N 15 117.0308 . . 1 . . . A 110 SER N . 19087 1 801 . 1 1 111 111 ASP H H 1 8.3146 . . 1 . . . A 111 ASP H . 19087 1 802 . 1 1 111 111 ASP HA H 1 4.5822 . . 1 . . . A 111 ASP HA . 19087 1 803 . 1 1 111 111 ASP HB2 H 1 2.6505 . . 2 . . . A 111 ASP HB2 . 19087 1 804 . 1 1 111 111 ASP C C 13 176.7604 . . 1 . . . A 111 ASP C . 19087 1 805 . 1 1 111 111 ASP CA C 13 53.9758 . . 1 . . . A 111 ASP CA . 19087 1 806 . 1 1 111 111 ASP CB C 13 40.1832 . . 1 . . . A 111 ASP CB . 19087 1 807 . 1 1 111 111 ASP N N 15 117.8041 . . 1 . . . A 111 ASP N . 19087 1 808 . 1 1 112 112 GLN H H 1 7.2120 . . 1 . . . A 112 GLN H . 19087 1 809 . 1 1 112 112 GLN HA H 1 4.2995 . . 1 . . . A 112 GLN HA . 19087 1 810 . 1 1 112 112 GLN HB2 H 1 1.9190 . . 2 . . . A 112 GLN HB2 . 19087 1 811 . 1 1 112 112 GLN HG2 H 1 2.1742 . . 2 . . . A 112 GLN HG2 . 19087 1 812 . 1 1 112 112 GLN CA C 13 55.0135 . . 1 . . . A 112 GLN CA . 19087 1 813 . 1 1 112 112 GLN CB C 13 26.5681 . . 1 . . . A 112 GLN CB . 19087 1 814 . 1 1 112 112 GLN N N 15 119.2998 . . 1 . . . A 112 GLN N . 19087 1 815 . 1 1 114 114 PRO HA H 1 4.5265 . . 1 . . . A 114 PRO HA . 19087 1 816 . 1 1 114 114 PRO HB3 H 1 2.4331 . . 2 . . . A 114 PRO HB3 . 19087 1 817 . 1 1 114 114 PRO HG2 H 1 2.1105 . . 2 . . . A 114 PRO HG2 . 19087 1 818 . 1 1 114 114 PRO HD3 H 1 1.8947 . . 2 . . . A 114 PRO HD3 . 19087 1 819 . 1 1 114 114 PRO C C 13 175.4643 . . 1 . . . A 114 PRO C . 19087 1 820 . 1 1 114 114 PRO CA C 13 64.0691 . . 1 . . . A 114 PRO CA . 19087 1 821 . 1 1 114 114 PRO CB C 13 32.4468 . . 1 . . . A 114 PRO CB . 19087 1 822 . 1 1 114 114 PRO CG C 13 27.6852 . . 1 . . . A 114 PRO CG . 19087 1 823 . 1 1 114 114 PRO CD C 13 50.9801 . . 1 . . . A 114 PRO CD . 19087 1 824 . 1 1 115 115 GLY H H 1 8.4429 . . 1 . . . A 115 GLY H . 19087 1 825 . 1 1 115 115 GLY HA2 H 1 4.3910 . . 2 . . . A 115 GLY HA2 . 19087 1 826 . 1 1 115 115 GLY HA3 H 1 3.7768 . . 2 . . . A 115 GLY HA3 . 19087 1 827 . 1 1 115 115 GLY C C 13 173.5524 . . 1 . . . A 115 GLY C . 19087 1 828 . 1 1 115 115 GLY CA C 13 43.9525 . . 1 . . . A 115 GLY CA . 19087 1 829 . 1 1 115 115 GLY N N 15 113.8174 . . 1 . . . A 115 GLY N . 19087 1 830 . 1 1 116 116 VAL H H 1 8.9567 . . 1 . . . A 116 VAL H . 19087 1 831 . 1 1 116 116 VAL HA H 1 4.1309 . . 1 . . . A 116 VAL HA . 19087 1 832 . 1 1 116 116 VAL HB H 1 2.0636 . . 1 . . . A 116 VAL HB . 19087 1 833 . 1 1 116 116 VAL HG11 H 1 1.1034 . . 2 . . . A 116 VAL HG11 . 19087 1 834 . 1 1 116 116 VAL HG12 H 1 1.1034 . . 2 . . . A 116 VAL HG12 . 19087 1 835 . 1 1 116 116 VAL HG13 H 1 1.1034 . . 2 . . . A 116 VAL HG13 . 19087 1 836 . 1 1 116 116 VAL HG21 H 1 0.8867 . . 2 . . . A 116 VAL HG21 . 19087 1 837 . 1 1 116 116 VAL HG22 H 1 0.8867 . . 2 . . . A 116 VAL HG22 . 19087 1 838 . 1 1 116 116 VAL HG23 H 1 0.8867 . . 2 . . . A 116 VAL HG23 . 19087 1 839 . 1 1 116 116 VAL C C 13 174.5328 . . 1 . . . A 116 VAL C . 19087 1 840 . 1 1 116 116 VAL CA C 13 63.9159 . . 1 . . . A 116 VAL CA . 19087 1 841 . 1 1 116 116 VAL CB C 13 32.3419 . . 1 . . . A 116 VAL CB . 19087 1 842 . 1 1 116 116 VAL CG1 C 13 24.3442 . . 2 . . . A 116 VAL CG1 . 19087 1 843 . 1 1 116 116 VAL CG2 C 13 22.1001 . . 2 . . . A 116 VAL CG2 . 19087 1 844 . 1 1 116 116 VAL N N 15 122.0489 . . 1 . . . A 116 VAL N . 19087 1 845 . 1 1 117 117 ILE H H 1 7.8634 . . 1 . . . A 117 ILE H . 19087 1 846 . 1 1 117 117 ILE HA H 1 4.9385 . . 1 . . . A 117 ILE HA . 19087 1 847 . 1 1 117 117 ILE HB H 1 1.8164 . . 1 . . . A 117 ILE HB . 19087 1 848 . 1 1 117 117 ILE HG21 H 1 0.7558 . . 1 . . . A 117 ILE HG21 . 19087 1 849 . 1 1 117 117 ILE HG22 H 1 1.0482 . . 1 . . . A 117 ILE HG22 . 19087 1 850 . 1 1 117 117 ILE HG23 H 1 1.0482 . . 1 . . . A 117 ILE HG23 . 19087 1 851 . 1 1 117 117 ILE C C 13 174.1808 . . 1 . . . A 117 ILE C . 19087 1 852 . 1 1 117 117 ILE CA C 13 60.0691 . . 1 . . . A 117 ILE CA . 19087 1 853 . 1 1 117 117 ILE CB C 13 42.3684 . . 1 . . . A 117 ILE CB . 19087 1 854 . 1 1 117 117 ILE CG1 C 13 27.7748 . . 1 . . . A 117 ILE CG1 . 19087 1 855 . 1 1 117 117 ILE CG2 C 13 17.9695 . . 1 . . . A 117 ILE CG2 . 19087 1 856 . 1 1 117 117 ILE CD1 C 13 14.4247 . . 1 . . . A 117 ILE CD1 . 19087 1 857 . 1 1 117 117 ILE N N 15 126.1018 . . 1 . . . A 117 ILE N . 19087 1 858 . 1 1 118 118 VAL H H 1 9.3476 . . 1 . . . A 118 VAL H . 19087 1 859 . 1 1 118 118 VAL HA H 1 4.9244 . . 1 . . . A 118 VAL HA . 19087 1 860 . 1 1 118 118 VAL HB H 1 1.9691 . . 1 . . . A 118 VAL HB . 19087 1 861 . 1 1 118 118 VAL HG11 H 1 0.7101 . . 2 . . . A 118 VAL HG11 . 19087 1 862 . 1 1 118 118 VAL HG12 H 1 0.7101 . . 2 . . . A 118 VAL HG12 . 19087 1 863 . 1 1 118 118 VAL HG13 H 1 0.7101 . . 2 . . . A 118 VAL HG13 . 19087 1 864 . 1 1 118 118 VAL C C 13 175.2239 . . 1 . . . A 118 VAL C . 19087 1 865 . 1 1 118 118 VAL CA C 13 60.5797 . . 1 . . . A 118 VAL CA . 19087 1 866 . 1 1 118 118 VAL CB C 13 33.9453 . . 1 . . . A 118 VAL CB . 19087 1 867 . 1 1 118 118 VAL CG1 C 13 22.6826 . . 2 . . . A 118 VAL CG1 . 19087 1 868 . 1 1 118 118 VAL CG2 C 13 21.1421 . . 2 . . . A 118 VAL CG2 . 19087 1 869 . 1 1 118 118 VAL N N 15 127.6655 . . 1 . . . A 118 VAL N . 19087 1 870 . 1 1 119 119 VAL H H 1 9.0963 . . 1 . . . A 119 VAL H . 19087 1 871 . 1 1 119 119 VAL HA H 1 5.5632 . . 1 . . . A 119 VAL HA . 19087 1 872 . 1 1 119 119 VAL HB H 1 2.2524 . . 1 . . . A 119 VAL HB . 19087 1 873 . 1 1 119 119 VAL HG11 H 1 1.2495 . . 2 . . . A 119 VAL HG11 . 19087 1 874 . 1 1 119 119 VAL HG12 H 1 1.2495 . . 2 . . . A 119 VAL HG12 . 19087 1 875 . 1 1 119 119 VAL HG13 H 1 1.2495 . . 2 . . . A 119 VAL HG13 . 19087 1 876 . 1 1 119 119 VAL HG21 H 1 1.0225 . . 2 . . . A 119 VAL HG21 . 19087 1 877 . 1 1 119 119 VAL HG22 H 1 1.0225 . . 2 . . . A 119 VAL HG22 . 19087 1 878 . 1 1 119 119 VAL HG23 H 1 1.0225 . . 2 . . . A 119 VAL HG23 . 19087 1 879 . 1 1 119 119 VAL C C 13 174.4255 . . 1 . . . A 119 VAL C . 19087 1 880 . 1 1 119 119 VAL CA C 13 58.6911 . . 1 . . . A 119 VAL CA . 19087 1 881 . 1 1 119 119 VAL CB C 13 32.8860 . . 1 . . . A 119 VAL CB . 19087 1 882 . 1 1 119 119 VAL CG1 C 13 22.1073 . . 2 . . . A 119 VAL CG1 . 19087 1 883 . 1 1 119 119 VAL CG2 C 13 21.1567 . . 2 . . . A 119 VAL CG2 . 19087 1 884 . 1 1 119 119 VAL N N 15 121.8281 . . 1 . . . A 119 VAL N . 19087 1 885 . 1 1 120 120 VAL H H 1 8.8095 . . 1 . . . A 120 VAL H . 19087 1 886 . 1 1 120 120 VAL HA H 1 4.8179 . . 1 . . . A 120 VAL HA . 19087 1 887 . 1 1 120 120 VAL HB H 1 2.0425 . . 1 . . . A 120 VAL HB . 19087 1 888 . 1 1 120 120 VAL HG11 H 1 0.8922 . . 2 . . . A 120 VAL HG11 . 19087 1 889 . 1 1 120 120 VAL HG12 H 1 0.8922 . . 2 . . . A 120 VAL HG12 . 19087 1 890 . 1 1 120 120 VAL HG13 H 1 0.8922 . . 2 . . . A 120 VAL HG13 . 19087 1 891 . 1 1 120 120 VAL C C 13 175.6486 . . 1 . . . A 120 VAL C . 19087 1 892 . 1 1 120 120 VAL CA C 13 60.6308 . . 1 . . . A 120 VAL CA . 19087 1 893 . 1 1 120 120 VAL CB C 13 34.5499 . . 1 . . . A 120 VAL CB . 19087 1 894 . 1 1 120 120 VAL CG1 C 13 21.8473 . . 2 . . . A 120 VAL CG1 . 19087 1 895 . 1 1 120 120 VAL N N 15 120.2605 . . 1 . . . A 120 VAL N . 19087 1 896 . 1 1 121 121 THR H H 1 7.8590 . . 1 . . . A 121 THR H . 19087 1 897 . 1 1 121 121 THR HA H 1 4.4276 . . 1 . . . A 121 THR HA . 19087 1 898 . 1 1 121 121 THR HB H 1 4.3356 . . 1 . . . A 121 THR HB . 19087 1 899 . 1 1 121 121 THR HG21 H 1 0.8118 . . 1 . . . A 121 THR HG21 . 19087 1 900 . 1 1 121 121 THR HG22 H 1 0.8118 . . 1 . . . A 121 THR HG22 . 19087 1 901 . 1 1 121 121 THR HG23 H 1 0.8118 . . 1 . . . A 121 THR HG23 . 19087 1 902 . 1 1 121 121 THR C C 13 173.8332 . . 1 . . . A 121 THR C . 19087 1 903 . 1 1 121 121 THR CA C 13 60.8340 . . 1 . . . A 121 THR CA . 19087 1 904 . 1 1 121 121 THR CB C 13 69.4132 . . 1 . . . A 121 THR CB . 19087 1 905 . 1 1 121 121 THR CG2 C 13 21.1694 . . 1 . . . A 121 THR CG2 . 19087 1 906 . 1 1 121 121 THR N N 15 114.5636 . . 1 . . . A 121 THR N . 19087 1 907 . 1 1 122 122 GLY H H 1 7.5080 . . 1 . . . A 122 GLY H . 19087 1 908 . 1 1 122 122 GLY HA2 H 1 3.7906 . . 2 . . . A 122 GLY HA2 . 19087 1 909 . 1 1 122 122 GLY CA C 13 46.4640 . . 1 . . . A 122 GLY CA . 19087 1 910 . 1 1 122 122 GLY N N 15 115.3693 . . 1 . . . A 122 GLY N . 19087 1 stop_ save_