data_26012 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 26012 _Entry.Title ; Structural Model for the N-terminal Domain of Human Cdc37 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2016-03-23 _Entry.Accession_date 2016-05-05 _Entry.Last_release_date 2016-05-09 _Entry.Original_release_date 2016-05-09 _Entry.Origination author _Entry.NMR_STAR_version 3.1.2.6 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype 'NMR, 20 STRUCTURES' _Entry.Details 'N-terminal Domain of Human Cdc37' _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 Ziming Zhang . . . . 26012 2 Dimitra Keramisanou . . . . 26012 3 Ioannis Gelis . . . . 26012 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' . 26012 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID Cdc37 . 26012 Hsp90 . 26012 'N-terminal domain' . 26012 chaperone . 26012 cochaperone . 26012 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 26012 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 501 26012 '15N chemical shifts' 117 26012 '1H chemical shifts' 781 26012 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 3 . . 2016-06-29 2016-03-23 update author 'update assignments and sequence with full protein' 26012 2 . . 2016-06-24 2016-03-23 update author 'update assignments' 26012 1 . . 2016-05-09 2016-03-23 original author 'original release' 26012 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 1US7 'Two-domain fragment of Cdc37' 26012 PDB 2K5B 'Human Cdc37-Hsp90 docking model' 26012 PDB 2N5X 'C-terminal Domain of Cdc37' 26012 PDB 2NCA 'BMRB Entry Tracking System' 26012 stop_ save_ ############### # Citations # ############### save_citations _Citation.Sf_category citations _Citation.Sf_framecode citations _Citation.Entry_ID 26012 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 27105117 _Citation.Full_citation . _Citation.Title ; Molecular Mechanism of Protein Kinase Recognition and Sorting by the Hsp90 Kinome-Specific Cochaperone Cdc37. ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Mol. Cell' _Citation.Journal_name_full 'Molecular cell' _Citation.Journal_volume 62 _Citation.Journal_issue 2 _Citation.Journal_ASTM MOCEFL _Citation.Journal_ISSN 1097-2765 _Citation.Journal_CSD 2168 _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 260 _Citation.Page_last 271 _Citation.Year 2016 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Dimitra Keramisanou D K . . 26012 1 2 Adam Aboalroub A A . . 26012 1 3 Ziming Zhang Z Z . . 26012 1 4 Wenjun Liu W L . . 26012 1 5 Devon Marshall D M . . 26012 1 6 Andrea Diviney A D . . 26012 1 7 Randy Larsen R L W . 26012 1 8 Ralf Landgraf R L . . 26012 1 9 Ioannis Gelis I G . . 26012 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 26012 _Assembly.ID 1 _Assembly.Name 'N-terminal Domain of Human Cdc37' _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 entity 1 $N-Cdc37 A . yes native no no . . . 26012 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_N-Cdc37 _Entity.Sf_category entity _Entity.Sf_framecode N-Cdc37 _Entity.Entry_ID 26012 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name N-Cdc37 _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 ; GHMVDYSVWDHIEVSDDEDE THPNIDTASLFRWRHQARVE RMEQFQKEKEELDRGCRECK RKVAECQRKLKELEVAEGGK AELERLQAEAQQLRKEERSW EQKLEEMRKKEKSMPWNVDT LSKDGFSKSMVNTKPEKTEE DSEEVREQKHKTFVEKYEKQ IKHFGMLRRWDDSQKYLSDN VHLVCEETANYLVIWCIDLE VEEKCALMEQVAHQTIVMQF ILELAKSLKVDPRACFRQFF TKIKTADRQYMEGFNDELEA FKERVRGRAKLRIEKAMKEY EEEERKKRLGPGGLDPVEVY ESLPEELQKCFDVKDVQMLQ DAISKMDPTDAKYHMQRCID SGLWVPNSKASEAKEGEEAG PGDPLLEAVPKTGDEKDVSV ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq '3 M' _Entity.Polymer_author_seq_details 'Residues 1-2 represent a non-native residues after Tag removal' _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 380 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method man _Entity.Parent_entity_ID 1 _Entity.Fragment 'N-terminal Domain of Cdc37' _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 15212.184 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 yes UNP Q16543 . CDC37 . . . . . . . . . . . . . . 26012 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 -1 GLY . 26012 1 2 0 HIS . 26012 1 3 1 MET . 26012 1 4 2 VAL . 26012 1 5 3 ASP . 26012 1 6 4 TYR . 26012 1 7 5 SER . 26012 1 8 6 VAL . 26012 1 9 7 TRP . 26012 1 10 8 ASP . 26012 1 11 9 HIS . 26012 1 12 10 ILE . 26012 1 13 11 GLU . 26012 1 14 12 VAL . 26012 1 15 13 SER . 26012 1 16 14 ASP . 26012 1 17 15 ASP . 26012 1 18 16 GLU . 26012 1 19 17 ASP . 26012 1 20 18 GLU . 26012 1 21 19 THR . 26012 1 22 20 HIS . 26012 1 23 21 PRO . 26012 1 24 22 ASN . 26012 1 25 23 ILE . 26012 1 26 24 ASP . 26012 1 27 25 THR . 26012 1 28 26 ALA . 26012 1 29 27 SER . 26012 1 30 28 LEU . 26012 1 31 29 PHE . 26012 1 32 30 ARG . 26012 1 33 31 TRP . 26012 1 34 32 ARG . 26012 1 35 33 HIS . 26012 1 36 34 GLN . 26012 1 37 35 ALA . 26012 1 38 36 ARG . 26012 1 39 37 VAL . 26012 1 40 38 GLU . 26012 1 41 39 ARG . 26012 1 42 40 MET . 26012 1 43 41 GLU . 26012 1 44 42 GLN . 26012 1 45 43 PHE . 26012 1 46 44 GLN . 26012 1 47 45 LYS . 26012 1 48 46 GLU . 26012 1 49 47 LYS . 26012 1 50 48 GLU . 26012 1 51 49 GLU . 26012 1 52 50 LEU . 26012 1 53 51 ASP . 26012 1 54 52 ARG . 26012 1 55 53 GLY . 26012 1 56 54 CYS . 26012 1 57 55 ARG . 26012 1 58 56 GLU . 26012 1 59 57 CYS . 26012 1 60 58 LYS . 26012 1 61 59 ARG . 26012 1 62 60 LYS . 26012 1 63 61 VAL . 26012 1 64 62 ALA . 26012 1 65 63 GLU . 26012 1 66 64 CYS . 26012 1 67 65 GLN . 26012 1 68 66 ARG . 26012 1 69 67 LYS . 26012 1 70 68 LEU . 26012 1 71 69 LYS . 26012 1 72 70 GLU . 26012 1 73 71 LEU . 26012 1 74 72 GLU . 26012 1 75 73 VAL . 26012 1 76 74 ALA . 26012 1 77 75 GLU . 26012 1 78 76 GLY . 26012 1 79 77 GLY . 26012 1 80 78 LYS . 26012 1 81 79 ALA . 26012 1 82 80 GLU . 26012 1 83 81 LEU . 26012 1 84 82 GLU . 26012 1 85 83 ARG . 26012 1 86 84 LEU . 26012 1 87 85 GLN . 26012 1 88 86 ALA . 26012 1 89 87 GLU . 26012 1 90 88 ALA . 26012 1 91 89 GLN . 26012 1 92 90 GLN . 26012 1 93 91 LEU . 26012 1 94 92 ARG . 26012 1 95 93 LYS . 26012 1 96 94 GLU . 26012 1 97 95 GLU . 26012 1 98 96 ARG . 26012 1 99 97 SER . 26012 1 100 98 TRP . 26012 1 101 99 GLU . 26012 1 102 100 GLN . 26012 1 103 101 LYS . 26012 1 104 102 LEU . 26012 1 105 103 GLU . 26012 1 106 104 GLU . 26012 1 107 105 MET . 26012 1 108 106 ARG . 26012 1 109 107 LYS . 26012 1 110 108 LYS . 26012 1 111 109 GLU . 26012 1 112 110 LYS . 26012 1 113 111 SER . 26012 1 114 112 MET . 26012 1 115 113 PRO . 26012 1 116 114 TRP . 26012 1 117 115 ASN . 26012 1 118 116 VAL . 26012 1 119 117 ASP . 26012 1 120 118 THR . 26012 1 121 119 LEU . 26012 1 122 120 SER . 26012 1 123 121 LYS . 26012 1 124 122 ASP . 26012 1 125 123 GLY . 26012 1 126 124 PHE . 26012 1 127 125 SER . 26012 1 128 126 LYS . 26012 1 129 127 SER . 26012 1 130 128 MET . 26012 1 131 129 VAL . 26012 1 132 130 ASN . 26012 1 133 131 THR . 26012 1 134 132 LYS . 26012 1 135 133 PRO . 26012 1 136 134 GLU . 26012 1 137 135 LYS . 26012 1 138 136 THR . 26012 1 139 137 GLU . 26012 1 140 138 GLU . 26012 1 141 139 ASP . 26012 1 142 140 SER . 26012 1 143 141 GLU . 26012 1 144 142 GLU . 26012 1 145 143 VAL . 26012 1 146 144 ARG . 26012 1 147 145 GLU . 26012 1 148 146 GLN . 26012 1 149 147 LYS . 26012 1 150 148 HIS . 26012 1 151 149 LYS . 26012 1 152 150 THR . 26012 1 153 151 PHE . 26012 1 154 152 VAL . 26012 1 155 153 GLU . 26012 1 156 154 LYS . 26012 1 157 155 TYR . 26012 1 158 156 GLU . 26012 1 159 157 LYS . 26012 1 160 158 GLN . 26012 1 161 159 ILE . 26012 1 162 160 LYS . 26012 1 163 161 HIS . 26012 1 164 162 PHE . 26012 1 165 163 GLY . 26012 1 166 164 MET . 26012 1 167 165 LEU . 26012 1 168 166 ARG . 26012 1 169 167 ARG . 26012 1 170 168 TRP . 26012 1 171 169 ASP . 26012 1 172 170 ASP . 26012 1 173 171 SER . 26012 1 174 172 GLN . 26012 1 175 173 LYS . 26012 1 176 174 TYR . 26012 1 177 175 LEU . 26012 1 178 176 SER . 26012 1 179 177 ASP . 26012 1 180 178 ASN . 26012 1 181 179 VAL . 26012 1 182 180 HIS . 26012 1 183 181 LEU . 26012 1 184 182 VAL . 26012 1 185 183 CYS . 26012 1 186 184 GLU . 26012 1 187 185 GLU . 26012 1 188 186 THR . 26012 1 189 187 ALA . 26012 1 190 188 ASN . 26012 1 191 189 TYR . 26012 1 192 190 LEU . 26012 1 193 191 VAL . 26012 1 194 192 ILE . 26012 1 195 193 TRP . 26012 1 196 194 CYS . 26012 1 197 195 ILE . 26012 1 198 196 ASP . 26012 1 199 197 LEU . 26012 1 200 198 GLU . 26012 1 201 199 VAL . 26012 1 202 200 GLU . 26012 1 203 201 GLU . 26012 1 204 202 LYS . 26012 1 205 203 CYS . 26012 1 206 204 ALA . 26012 1 207 205 LEU . 26012 1 208 206 MET . 26012 1 209 207 GLU . 26012 1 210 208 GLN . 26012 1 211 209 VAL . 26012 1 212 210 ALA . 26012 1 213 211 HIS . 26012 1 214 212 GLN . 26012 1 215 213 THR . 26012 1 216 214 ILE . 26012 1 217 215 VAL . 26012 1 218 216 MET . 26012 1 219 217 GLN . 26012 1 220 218 PHE . 26012 1 221 219 ILE . 26012 1 222 220 LEU . 26012 1 223 221 GLU . 26012 1 224 222 LEU . 26012 1 225 223 ALA . 26012 1 226 224 LYS . 26012 1 227 225 SER . 26012 1 228 226 LEU . 26012 1 229 227 LYS . 26012 1 230 228 VAL . 26012 1 231 229 ASP . 26012 1 232 230 PRO . 26012 1 233 231 ARG . 26012 1 234 232 ALA . 26012 1 235 233 CYS . 26012 1 236 234 PHE . 26012 1 237 235 ARG . 26012 1 238 236 GLN . 26012 1 239 237 PHE . 26012 1 240 238 PHE . 26012 1 241 239 THR . 26012 1 242 240 LYS . 26012 1 243 241 ILE . 26012 1 244 242 LYS . 26012 1 245 243 THR . 26012 1 246 244 ALA . 26012 1 247 245 ASP . 26012 1 248 246 ARG . 26012 1 249 247 GLN . 26012 1 250 248 TYR . 26012 1 251 249 MET . 26012 1 252 250 GLU . 26012 1 253 251 GLY . 26012 1 254 252 PHE . 26012 1 255 253 ASN . 26012 1 256 254 ASP . 26012 1 257 255 GLU . 26012 1 258 256 LEU . 26012 1 259 257 GLU . 26012 1 260 258 ALA . 26012 1 261 259 PHE . 26012 1 262 260 LYS . 26012 1 263 261 GLU . 26012 1 264 262 ARG . 26012 1 265 263 VAL . 26012 1 266 264 ARG . 26012 1 267 265 GLY . 26012 1 268 266 ARG . 26012 1 269 267 ALA . 26012 1 270 268 LYS . 26012 1 271 269 LEU . 26012 1 272 270 ARG . 26012 1 273 271 ILE . 26012 1 274 272 GLU . 26012 1 275 273 LYS . 26012 1 276 274 ALA . 26012 1 277 275 MET . 26012 1 278 276 LYS . 26012 1 279 277 GLU . 26012 1 280 278 TYR . 26012 1 281 279 GLU . 26012 1 282 280 GLU . 26012 1 283 281 GLU . 26012 1 284 282 GLU . 26012 1 285 283 ARG . 26012 1 286 284 LYS . 26012 1 287 285 LYS . 26012 1 288 286 ARG . 26012 1 289 287 LEU . 26012 1 290 288 GLY . 26012 1 291 289 PRO . 26012 1 292 290 GLY . 26012 1 293 291 GLY . 26012 1 294 292 LEU . 26012 1 295 293 ASP . 26012 1 296 294 PRO . 26012 1 297 295 VAL . 26012 1 298 296 GLU . 26012 1 299 297 VAL . 26012 1 300 298 TYR . 26012 1 301 299 GLU . 26012 1 302 300 SER . 26012 1 303 301 LEU . 26012 1 304 302 PRO . 26012 1 305 303 GLU . 26012 1 306 304 GLU . 26012 1 307 305 LEU . 26012 1 308 306 GLN . 26012 1 309 307 LYS . 26012 1 310 308 CYS . 26012 1 311 309 PHE . 26012 1 312 310 ASP . 26012 1 313 311 VAL . 26012 1 314 312 LYS . 26012 1 315 313 ASP . 26012 1 316 314 VAL . 26012 1 317 315 GLN . 26012 1 318 316 MET . 26012 1 319 317 LEU . 26012 1 320 318 GLN . 26012 1 321 319 ASP . 26012 1 322 320 ALA . 26012 1 323 321 ILE . 26012 1 324 322 SER . 26012 1 325 323 LYS . 26012 1 326 324 MET . 26012 1 327 325 ASP . 26012 1 328 326 PRO . 26012 1 329 327 THR . 26012 1 330 328 ASP . 26012 1 331 329 ALA . 26012 1 332 330 LYS . 26012 1 333 331 TYR . 26012 1 334 332 HIS . 26012 1 335 333 MET . 26012 1 336 334 GLN . 26012 1 337 335 ARG . 26012 1 338 336 CYS . 26012 1 339 337 ILE . 26012 1 340 338 ASP . 26012 1 341 339 SER . 26012 1 342 340 GLY . 26012 1 343 341 LEU . 26012 1 344 342 TRP . 26012 1 345 343 VAL . 26012 1 346 344 PRO . 26012 1 347 345 ASN . 26012 1 348 346 SER . 26012 1 349 347 LYS . 26012 1 350 348 ALA . 26012 1 351 349 SER . 26012 1 352 350 GLU . 26012 1 353 351 ALA . 26012 1 354 352 LYS . 26012 1 355 353 GLU . 26012 1 356 354 GLY . 26012 1 357 355 GLU . 26012 1 358 356 GLU . 26012 1 359 357 ALA . 26012 1 360 358 GLY . 26012 1 361 359 PRO . 26012 1 362 360 GLY . 26012 1 363 361 ASP . 26012 1 364 362 PRO . 26012 1 365 363 LEU . 26012 1 366 364 LEU . 26012 1 367 365 GLU . 26012 1 368 366 ALA . 26012 1 369 367 VAL . 26012 1 370 368 PRO . 26012 1 371 369 LYS . 26012 1 372 370 THR . 26012 1 373 371 GLY . 26012 1 374 372 ASP . 26012 1 375 373 GLU . 26012 1 376 374 LYS . 26012 1 377 375 ASP . 26012 1 378 376 VAL . 26012 1 379 377 SER . 26012 1 380 378 VAL . 26012 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 26012 1 . HIS 2 2 26012 1 . MET 3 3 26012 1 . VAL 4 4 26012 1 . ASP 5 5 26012 1 . TYR 6 6 26012 1 . SER 7 7 26012 1 . VAL 8 8 26012 1 . TRP 9 9 26012 1 . ASP 10 10 26012 1 . HIS 11 11 26012 1 . ILE 12 12 26012 1 . GLU 13 13 26012 1 . VAL 14 14 26012 1 . SER 15 15 26012 1 . ASP 16 16 26012 1 . ASP 17 17 26012 1 . GLU 18 18 26012 1 . ASP 19 19 26012 1 . GLU 20 20 26012 1 . THR 21 21 26012 1 . HIS 22 22 26012 1 . PRO 23 23 26012 1 . ASN 24 24 26012 1 . ILE 25 25 26012 1 . ASP 26 26 26012 1 . THR 27 27 26012 1 . ALA 28 28 26012 1 . SER 29 29 26012 1 . LEU 30 30 26012 1 . PHE 31 31 26012 1 . ARG 32 32 26012 1 . TRP 33 33 26012 1 . ARG 34 34 26012 1 . HIS 35 35 26012 1 . GLN 36 36 26012 1 . ALA 37 37 26012 1 . ARG 38 38 26012 1 . VAL 39 39 26012 1 . GLU 40 40 26012 1 . ARG 41 41 26012 1 . MET 42 42 26012 1 . GLU 43 43 26012 1 . GLN 44 44 26012 1 . PHE 45 45 26012 1 . GLN 46 46 26012 1 . LYS 47 47 26012 1 . GLU 48 48 26012 1 . LYS 49 49 26012 1 . GLU 50 50 26012 1 . GLU 51 51 26012 1 . LEU 52 52 26012 1 . ASP 53 53 26012 1 . ARG 54 54 26012 1 . GLY 55 55 26012 1 . CYS 56 56 26012 1 . ARG 57 57 26012 1 . GLU 58 58 26012 1 . CYS 59 59 26012 1 . LYS 60 60 26012 1 . ARG 61 61 26012 1 . LYS 62 62 26012 1 . VAL 63 63 26012 1 . ALA 64 64 26012 1 . GLU 65 65 26012 1 . CYS 66 66 26012 1 . GLN 67 67 26012 1 . ARG 68 68 26012 1 . LYS 69 69 26012 1 . LEU 70 70 26012 1 . LYS 71 71 26012 1 . GLU 72 72 26012 1 . LEU 73 73 26012 1 . GLU 74 74 26012 1 . VAL 75 75 26012 1 . ALA 76 76 26012 1 . GLU 77 77 26012 1 . GLY 78 78 26012 1 . GLY 79 79 26012 1 . LYS 80 80 26012 1 . ALA 81 81 26012 1 . GLU 82 82 26012 1 . LEU 83 83 26012 1 . GLU 84 84 26012 1 . ARG 85 85 26012 1 . LEU 86 86 26012 1 . GLN 87 87 26012 1 . ALA 88 88 26012 1 . GLU 89 89 26012 1 . ALA 90 90 26012 1 . GLN 91 91 26012 1 . GLN 92 92 26012 1 . LEU 93 93 26012 1 . ARG 94 94 26012 1 . LYS 95 95 26012 1 . GLU 96 96 26012 1 . GLU 97 97 26012 1 . ARG 98 98 26012 1 . SER 99 99 26012 1 . TRP 100 100 26012 1 . GLU 101 101 26012 1 . GLN 102 102 26012 1 . LYS 103 103 26012 1 . LEU 104 104 26012 1 . GLU 105 105 26012 1 . GLU 106 106 26012 1 . MET 107 107 26012 1 . ARG 108 108 26012 1 . LYS 109 109 26012 1 . LYS 110 110 26012 1 . GLU 111 111 26012 1 . LYS 112 112 26012 1 . SER 113 113 26012 1 . MET 114 114 26012 1 . PRO 115 115 26012 1 . TRP 116 116 26012 1 . ASN 117 117 26012 1 . VAL 118 118 26012 1 . ASP 119 119 26012 1 . THR 120 120 26012 1 . LEU 121 121 26012 1 . SER 122 122 26012 1 . LYS 123 123 26012 1 . ASP 124 124 26012 1 . GLY 125 125 26012 1 . PHE 126 126 26012 1 . SER 127 127 26012 1 . LYS 128 128 26012 1 . SER 129 129 26012 1 . MET 130 130 26012 1 . VAL 131 131 26012 1 . ASN 132 132 26012 1 . THR 133 133 26012 1 . LYS 134 134 26012 1 . PRO 135 135 26012 1 . GLU 136 136 26012 1 . LYS 137 137 26012 1 . THR 138 138 26012 1 . GLU 139 139 26012 1 . GLU 140 140 26012 1 . ASP 141 141 26012 1 . SER 142 142 26012 1 . GLU 143 143 26012 1 . GLU 144 144 26012 1 . VAL 145 145 26012 1 . ARG 146 146 26012 1 . GLU 147 147 26012 1 . GLN 148 148 26012 1 . LYS 149 149 26012 1 . HIS 150 150 26012 1 . LYS 151 151 26012 1 . THR 152 152 26012 1 . PHE 153 153 26012 1 . VAL 154 154 26012 1 . GLU 155 155 26012 1 . LYS 156 156 26012 1 . TYR 157 157 26012 1 . GLU 158 158 26012 1 . LYS 159 159 26012 1 . GLN 160 160 26012 1 . ILE 161 161 26012 1 . LYS 162 162 26012 1 . HIS 163 163 26012 1 . PHE 164 164 26012 1 . GLY 165 165 26012 1 . MET 166 166 26012 1 . LEU 167 167 26012 1 . ARG 168 168 26012 1 . ARG 169 169 26012 1 . TRP 170 170 26012 1 . ASP 171 171 26012 1 . ASP 172 172 26012 1 . SER 173 173 26012 1 . GLN 174 174 26012 1 . LYS 175 175 26012 1 . TYR 176 176 26012 1 . LEU 177 177 26012 1 . SER 178 178 26012 1 . ASP 179 179 26012 1 . ASN 180 180 26012 1 . VAL 181 181 26012 1 . HIS 182 182 26012 1 . LEU 183 183 26012 1 . VAL 184 184 26012 1 . CYS 185 185 26012 1 . GLU 186 186 26012 1 . GLU 187 187 26012 1 . THR 188 188 26012 1 . ALA 189 189 26012 1 . ASN 190 190 26012 1 . TYR 191 191 26012 1 . LEU 192 192 26012 1 . VAL 193 193 26012 1 . ILE 194 194 26012 1 . TRP 195 195 26012 1 . CYS 196 196 26012 1 . ILE 197 197 26012 1 . ASP 198 198 26012 1 . LEU 199 199 26012 1 . GLU 200 200 26012 1 . VAL 201 201 26012 1 . GLU 202 202 26012 1 . GLU 203 203 26012 1 . LYS 204 204 26012 1 . CYS 205 205 26012 1 . ALA 206 206 26012 1 . LEU 207 207 26012 1 . MET 208 208 26012 1 . GLU 209 209 26012 1 . GLN 210 210 26012 1 . VAL 211 211 26012 1 . ALA 212 212 26012 1 . HIS 213 213 26012 1 . GLN 214 214 26012 1 . THR 215 215 26012 1 . ILE 216 216 26012 1 . VAL 217 217 26012 1 . MET 218 218 26012 1 . GLN 219 219 26012 1 . PHE 220 220 26012 1 . ILE 221 221 26012 1 . LEU 222 222 26012 1 . GLU 223 223 26012 1 . LEU 224 224 26012 1 . ALA 225 225 26012 1 . LYS 226 226 26012 1 . SER 227 227 26012 1 . LEU 228 228 26012 1 . LYS 229 229 26012 1 . VAL 230 230 26012 1 . ASP 231 231 26012 1 . PRO 232 232 26012 1 . ARG 233 233 26012 1 . ALA 234 234 26012 1 . CYS 235 235 26012 1 . PHE 236 236 26012 1 . ARG 237 237 26012 1 . GLN 238 238 26012 1 . PHE 239 239 26012 1 . PHE 240 240 26012 1 . THR 241 241 26012 1 . LYS 242 242 26012 1 . ILE 243 243 26012 1 . LYS 244 244 26012 1 . THR 245 245 26012 1 . ALA 246 246 26012 1 . ASP 247 247 26012 1 . ARG 248 248 26012 1 . GLN 249 249 26012 1 . TYR 250 250 26012 1 . MET 251 251 26012 1 . GLU 252 252 26012 1 . GLY 253 253 26012 1 . PHE 254 254 26012 1 . ASN 255 255 26012 1 . ASP 256 256 26012 1 . GLU 257 257 26012 1 . LEU 258 258 26012 1 . GLU 259 259 26012 1 . ALA 260 260 26012 1 . PHE 261 261 26012 1 . LYS 262 262 26012 1 . GLU 263 263 26012 1 . ARG 264 264 26012 1 . VAL 265 265 26012 1 . ARG 266 266 26012 1 . GLY 267 267 26012 1 . ARG 268 268 26012 1 . ALA 269 269 26012 1 . LYS 270 270 26012 1 . LEU 271 271 26012 1 . ARG 272 272 26012 1 . ILE 273 273 26012 1 . GLU 274 274 26012 1 . LYS 275 275 26012 1 . ALA 276 276 26012 1 . MET 277 277 26012 1 . LYS 278 278 26012 1 . GLU 279 279 26012 1 . TYR 280 280 26012 1 . GLU 281 281 26012 1 . GLU 282 282 26012 1 . GLU 283 283 26012 1 . GLU 284 284 26012 1 . ARG 285 285 26012 1 . LYS 286 286 26012 1 . LYS 287 287 26012 1 . ARG 288 288 26012 1 . LEU 289 289 26012 1 . GLY 290 290 26012 1 . PRO 291 291 26012 1 . GLY 292 292 26012 1 . GLY 293 293 26012 1 . LEU 294 294 26012 1 . ASP 295 295 26012 1 . PRO 296 296 26012 1 . VAL 297 297 26012 1 . GLU 298 298 26012 1 . VAL 299 299 26012 1 . TYR 300 300 26012 1 . GLU 301 301 26012 1 . SER 302 302 26012 1 . LEU 303 303 26012 1 . PRO 304 304 26012 1 . GLU 305 305 26012 1 . GLU 306 306 26012 1 . LEU 307 307 26012 1 . GLN 308 308 26012 1 . LYS 309 309 26012 1 . CYS 310 310 26012 1 . PHE 311 311 26012 1 . ASP 312 312 26012 1 . VAL 313 313 26012 1 . LYS 314 314 26012 1 . ASP 315 315 26012 1 . VAL 316 316 26012 1 . GLN 317 317 26012 1 . MET 318 318 26012 1 . LEU 319 319 26012 1 . GLN 320 320 26012 1 . ASP 321 321 26012 1 . ALA 322 322 26012 1 . ILE 323 323 26012 1 . SER 324 324 26012 1 . LYS 325 325 26012 1 . MET 326 326 26012 1 . ASP 327 327 26012 1 . PRO 328 328 26012 1 . THR 329 329 26012 1 . ASP 330 330 26012 1 . ALA 331 331 26012 1 . LYS 332 332 26012 1 . TYR 333 333 26012 1 . HIS 334 334 26012 1 . MET 335 335 26012 1 . GLN 336 336 26012 1 . ARG 337 337 26012 1 . CYS 338 338 26012 1 . ILE 339 339 26012 1 . ASP 340 340 26012 1 . SER 341 341 26012 1 . GLY 342 342 26012 1 . LEU 343 343 26012 1 . TRP 344 344 26012 1 . VAL 345 345 26012 1 . PRO 346 346 26012 1 . ASN 347 347 26012 1 . SER 348 348 26012 1 . LYS 349 349 26012 1 . ALA 350 350 26012 1 . SER 351 351 26012 1 . GLU 352 352 26012 1 . ALA 353 353 26012 1 . LYS 354 354 26012 1 . GLU 355 355 26012 1 . GLY 356 356 26012 1 . GLU 357 357 26012 1 . GLU 358 358 26012 1 . ALA 359 359 26012 1 . GLY 360 360 26012 1 . PRO 361 361 26012 1 . GLY 362 362 26012 1 . ASP 363 363 26012 1 . PRO 364 364 26012 1 . LEU 365 365 26012 1 . LEU 366 366 26012 1 . GLU 367 367 26012 1 . ALA 368 368 26012 1 . VAL 369 369 26012 1 . PRO 370 370 26012 1 . LYS 371 371 26012 1 . THR 372 372 26012 1 . GLY 373 373 26012 1 . ASP 374 374 26012 1 . GLU 375 375 26012 1 . LYS 376 376 26012 1 . ASP 377 377 26012 1 . VAL 378 378 26012 1 . SER 379 379 26012 1 . VAL 380 380 26012 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 26012 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $N-Cdc37 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . 26012 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 26012 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $N-Cdc37 . 'recombinant technology' 'Escherichia coli' . . 469008 Escherichia coli BL21DE3 . . . . . pdbHis.MBP . . . 26012 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_15N_labeled _Sample.Sf_category sample _Sample.Sf_framecode 15N_labeled _Sample.Entry_ID 26012 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details 'N15 labeled sample' _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 N-Cdc37 '[U-100% 15N]' . . 1 $N-Cdc37 . protein 0.5 . . mM . . . . 26012 1 2 NaCl 'natural abundance' . . . . . salt 100 . . mM . . . . 26012 1 3 H2O 'natural abundance' . . . . . solvent 90 . . % . . . . 26012 1 4 D2O [U-2H] . . . . . solvent 10 . . % . . . . 26012 1 stop_ save_ save_methyl_labeled _Sample.Sf_category sample _Sample.Sf_framecode methyl_labeled _Sample.Entry_ID 26012 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% 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 N-Cdc37 'U-2H; VILMA methyl 1H/13C' . . 1 $N-Cdc37 . protein 0.5 . . mM . . . . 26012 2 2 NaCl 'natural abundance' . . . . . salt 100 . . mM . . . . 26012 2 3 D2O [U-2H] . . . . . solvent 100 . . % . . . . 26012 2 stop_ save_ save_13C_15N_labeled _Sample.Sf_category sample _Sample.Sf_framecode 13C_15N_labeled _Sample.Entry_ID 26012 _Sample.ID 3 _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 N-Cdc37 '[U-100% 13C; U-100% 15N]' . . 1 $N-Cdc37 . protein 0.5 . . mM . . . . 26012 3 2 H2O 'natural abundance' . . . . . solvent 90 . . % . . . . 26012 3 3 D2O [U-2H] . . . . . solvent 10 . . % . . . . 26012 3 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 26012 _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' 0.1 . M 26012 1 pH 7.5 . pH 26012 1 pressure 1 . atm 26012 1 temperature 303 . K 26012 1 stop_ save_ ############################ # Computer software used # ############################ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 26012 _Software.ID 1 _Software.Name NMRPipe _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 26012 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 26012 1 stop_ save_ save_SPARKY _Software.Sf_category software _Software.Sf_framecode SPARKY _Software.Entry_ID 26012 _Software.ID 2 _Software.Name SPARKY _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . 26012 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 26012 2 stop_ save_ save_TALOS _Software.Sf_category software _Software.Sf_framecode TALOS _Software.Entry_ID 26012 _Software.ID 3 _Software.Name TALOS _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Cornilescu, Delaglio and Bax' . . 26012 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 26012 3 stop_ save_ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 26012 _Software.ID 4 _Software.Name CYANA _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . 26012 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 26012 4 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 26012 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model 'Uniform NMR System' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 26012 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model 'Uniform NMR System' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 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 26012 _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 Varian 'Uniform NMR System' . 600 . . . 26012 1 2 spectrometer_2 Varian 'Uniform NMR System' . 800 . . . 26012 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 26012 _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 $15N_labeled isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 26012 1 2 '2D 1H-13C HMQC' no . . . . . . . . . . 2 $methyl_labeled isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 26012 1 3 '3D HNCA' no . . . . . . . . . . 3 $13C_15N_labeled isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 26012 1 4 '3D HN(CO)CA' no . . . . . . . . . . 3 $13C_15N_labeled isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 26012 1 5 '3D HNCACB' no . . . . . . . . . . 3 $13C_15N_labeled isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 26012 1 6 '3D CBCA(CO)NH' no . . . . . . . . . . 3 $13C_15N_labeled isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 26012 1 7 '3D HNCO' no . . . . . . . . . . 3 $13C_15N_labeled isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 26012 1 8 '3D HCACO' no . . . . . . . . . . 3 $13C_15N_labeled isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 26012 1 9 '3D H(CCO)NH' no . . . . . . . . . . 3 $13C_15N_labeled isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 26012 1 10 '3D HCCH-TOCSY' no . . . . . . . . . . 3 $13C_15N_labeled isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 26012 1 11 '3D C(CO)NH' no . . . . . . . . . . 3 $13C_15N_labeled isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 26012 1 12 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $15N_labeled isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 26012 1 13 '3D 1H-13C NOESY' no . . . . . . . . . . 3 $13C_15N_labeled isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 26012 1 14 HMQC-NOESY-HMQC no . . . . . . . . . . 2 $methyl_labeled isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 26012 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 26012 _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.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 water protons . . . . ppm 4.725 na indirect 0.251449530 . . . . . 26012 1 H 1 water protons . . . . ppm 4.725 internal direct 1 . . . . . 26012 1 N 15 water protons . . . . ppm 4.725 na indirect 0.101329118 . . . . . 26012 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 26012 _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' 1 $15N_labeled isotropic 26012 1 2 '2D 1H-13C HMQC' 2 $methyl_labeled isotropic 26012 1 3 '3D HNCA' 3 $13C_15N_labeled isotropic 26012 1 4 '3D HN(CO)CA' 3 $13C_15N_labeled isotropic 26012 1 5 '3D HNCACB' 3 $13C_15N_labeled isotropic 26012 1 6 '3D CBCA(CO)NH' 3 $13C_15N_labeled isotropic 26012 1 7 '3D HNCO' 3 $13C_15N_labeled isotropic 26012 1 8 '3D HCACO' 3 $13C_15N_labeled isotropic 26012 1 9 '3D H(CCO)NH' 3 $13C_15N_labeled isotropic 26012 1 10 '3D HCCH-TOCSY' 3 $13C_15N_labeled isotropic 26012 1 11 '3D C(CO)NH' 3 $13C_15N_labeled isotropic 26012 1 14 HMQC-NOESY-HMQC 2 $methyl_labeled isotropic 26012 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 3 3 MET HE1 H 1 3.158 . . . . . . . 1 MET HE1 . 26012 1 2 . 1 1 3 3 MET HE2 H 1 3.158 . . . . . . . 1 MET HE2 . 26012 1 3 . 1 1 3 3 MET HE3 H 1 3.158 . . . . . . . 1 MET HE3 . 26012 1 4 . 1 1 3 3 MET CE C 13 17.091 . . . . . . . 1 MET CE . 26012 1 5 . 1 1 4 4 VAL H H 1 8.100 . . . . . . . 2 VAL H . 26012 1 6 . 1 1 4 4 VAL HA H 1 3.998 . . . . . . . 2 VAL HA . 26012 1 7 . 1 1 4 4 VAL HB H 1 1.890 . . . . . . . 2 VAL HB . 26012 1 8 . 1 1 4 4 VAL HG11 H 1 0.684 . . . . . . . 2 VAL HG11 . 26012 1 9 . 1 1 4 4 VAL HG12 H 1 0.684 . . . . . . . 2 VAL HG12 . 26012 1 10 . 1 1 4 4 VAL HG13 H 1 0.684 . . . . . . . 2 VAL HG13 . 26012 1 11 . 1 1 4 4 VAL HG21 H 1 0.791 . . . . . . . 2 VAL HG21 . 26012 1 12 . 1 1 4 4 VAL HG22 H 1 0.791 . . . . . . . 2 VAL HG22 . 26012 1 13 . 1 1 4 4 VAL HG23 H 1 0.791 . . . . . . . 2 VAL HG23 . 26012 1 14 . 1 1 4 4 VAL C C 13 175.117 . . . . . . . 2 VAL C . 26012 1 15 . 1 1 4 4 VAL CA C 13 62.288 . . . . . . . 2 VAL CA . 26012 1 16 . 1 1 4 4 VAL CB C 13 33.055 . . . . . . . 2 VAL CB . 26012 1 17 . 1 1 4 4 VAL CG1 C 13 21.045 . . . . . . . 2 VAL CG1 . 26012 1 18 . 1 1 4 4 VAL CG2 C 13 20.580 . . . . . . . 2 VAL CG2 . 26012 1 19 . 1 1 4 4 VAL N N 15 121.341 . . . . . . . 2 VAL N . 26012 1 20 . 1 1 5 5 ASP H H 1 8.213 . . . . . . . 3 ASP H . 26012 1 21 . 1 1 5 5 ASP HA H 1 4.603 . . . . . . . 3 ASP HA . 26012 1 22 . 1 1 5 5 ASP HB2 H 1 2.694 . . . . . . . 3 ASP HB2 . 26012 1 23 . 1 1 5 5 ASP HB3 H 1 2.558 . . . . . . . 3 ASP HB3 . 26012 1 24 . 1 1 5 5 ASP C C 13 175.851 . . . . . . . 3 ASP C . 26012 1 25 . 1 1 5 5 ASP CA C 13 53.802 . . . . . . . 3 ASP CA . 26012 1 26 . 1 1 5 5 ASP CB C 13 41.327 . . . . . . . 3 ASP CB . 26012 1 27 . 1 1 5 5 ASP N N 15 123.519 . . . . . . . 3 ASP N . 26012 1 28 . 1 1 6 6 TYR H H 1 8.092 . . . . . . . 4 TYR H . 26012 1 29 . 1 1 6 6 TYR HA H 1 4.469 . . . . . . . 4 TYR HA . 26012 1 30 . 1 1 6 6 TYR HB2 H 1 3.079 . . . . . . . 4 TYR HB2 . 26012 1 31 . 1 1 6 6 TYR HB3 H 1 2.851 . . . . . . . 4 TYR HB3 . 26012 1 32 . 1 1 6 6 TYR C C 13 175.906 . . . . . . . 4 TYR C . 26012 1 33 . 1 1 6 6 TYR CA C 13 58.494 . . . . . . . 4 TYR CA . 26012 1 34 . 1 1 6 6 TYR CB C 13 38.598 . . . . . . . 4 TYR CB . 26012 1 35 . 1 1 6 6 TYR N N 15 121.521 . . . . . . . 4 TYR N . 26012 1 36 . 1 1 7 7 SER H H 1 8.366 . . . . . . . 5 SER H . 26012 1 37 . 1 1 7 7 SER HA H 1 4.366 . . . . . . . 5 SER HA . 26012 1 38 . 1 1 7 7 SER HB2 H 1 3.831 . . . . . . . 5 SER HB2 . 26012 1 39 . 1 1 7 7 SER HB3 H 1 3.773 . . . . . . . 5 SER HB3 . 26012 1 40 . 1 1 7 7 SER C C 13 174.841 . . . . . . . 5 SER C . 26012 1 41 . 1 1 7 7 SER CA C 13 59.106 . . . . . . . 5 SER CA . 26012 1 42 . 1 1 7 7 SER CB C 13 63.874 . . . . . . . 5 SER CB . 26012 1 43 . 1 1 7 7 SER N N 15 117.292 . . . . . . . 5 SER N . 26012 1 44 . 1 1 8 8 VAL H H 1 7.724 . . . . . . . 6 VAL H . 26012 1 45 . 1 1 8 8 VAL HA H 1 4.019 . . . . . . . 6 VAL HA . 26012 1 46 . 1 1 8 8 VAL HB H 1 1.938 . . . . . . . 6 VAL HB . 26012 1 47 . 1 1 8 8 VAL HG11 H 1 0.684 . . . . . . . 6 VAL HG11 . 26012 1 48 . 1 1 8 8 VAL HG12 H 1 0.684 . . . . . . . 6 VAL HG12 . 26012 1 49 . 1 1 8 8 VAL HG13 H 1 0.684 . . . . . . . 6 VAL HG13 . 26012 1 50 . 1 1 8 8 VAL HG21 H 1 0.687 . . . . . . . 6 VAL HG21 . 26012 1 51 . 1 1 8 8 VAL HG22 H 1 0.687 . . . . . . . 6 VAL HG22 . 26012 1 52 . 1 1 8 8 VAL HG23 H 1 0.687 . . . . . . . 6 VAL HG23 . 26012 1 53 . 1 1 8 8 VAL C C 13 175.914 . . . . . . . 6 VAL C . 26012 1 54 . 1 1 8 8 VAL CA C 13 62.817 . . . . . . . 6 VAL CA . 26012 1 55 . 1 1 8 8 VAL CB C 13 32.406 . . . . . . . 6 VAL CB . 26012 1 56 . 1 1 8 8 VAL CG1 C 13 20.946 . . . . . . . 6 VAL CG1 . 26012 1 57 . 1 1 8 8 VAL CG2 C 13 20.112 . . . . . . . 6 VAL CG2 . 26012 1 58 . 1 1 8 8 VAL N N 15 120.079 . . . . . . . 6 VAL N . 26012 1 59 . 1 1 9 9 TRP H H 1 7.841 . . . . . . . 7 TRP H . 26012 1 60 . 1 1 9 9 TRP HA H 1 4.734 . . . . . . . 7 TRP HA . 26012 1 61 . 1 1 9 9 TRP HB2 H 1 3.327 . . . . . . . 7 TRP HB2 . 26012 1 62 . 1 1 9 9 TRP HB3 H 1 3.105 . . . . . . . 7 TRP HB3 . 26012 1 63 . 1 1 9 9 TRP HE1 H 1 10.100 . . . . . . . 7 TRP HE1 . 26012 1 64 . 1 1 9 9 TRP C C 13 175.924 . . . . . . . 7 TRP C . 26012 1 65 . 1 1 9 9 TRP CA C 13 57.163 . . . . . . . 7 TRP CA . 26012 1 66 . 1 1 9 9 TRP CB C 13 29.689 . . . . . . . 7 TRP CB . 26012 1 67 . 1 1 9 9 TRP N N 15 122.170 . . . . . . . 7 TRP N . 26012 1 68 . 1 1 9 9 TRP NE1 N 15 129.258 . . . . . . . 7 TRP NE1 . 26012 1 69 . 1 1 10 10 ASP H H 1 7.978 . . . . . . . 8 ASP H . 26012 1 70 . 1 1 10 10 ASP HA H 1 4.533 . . . . . . . 8 ASP HA . 26012 1 71 . 1 1 10 10 ASP HB2 H 1 2.521 . . . . . . . 8 ASP HB2 . 26012 1 72 . 1 1 10 10 ASP HB3 H 1 2.521 . . . . . . . 8 ASP HB3 . 26012 1 73 . 1 1 10 10 ASP C C 13 175.725 . . . . . . . 8 ASP C . 26012 1 74 . 1 1 10 10 ASP CA C 13 55.002 . . . . . . . 8 ASP CA . 26012 1 75 . 1 1 10 10 ASP CB C 13 41.197 . . . . . . . 8 ASP CB . 26012 1 76 . 1 1 10 10 ASP N N 15 120.791 . . . . . . . 8 ASP N . 26012 1 77 . 1 1 11 11 HIS H H 1 7.948 . . . . . . . 9 HIS H . 26012 1 78 . 1 1 11 11 HIS HA H 1 4.368 . . . . . . . 9 HIS HA . 26012 1 79 . 1 1 11 11 HIS HB2 H 1 3.057 . . . . . . . 9 HIS HB2 . 26012 1 80 . 1 1 11 11 HIS HB3 H 1 2.993 . . . . . . . 9 HIS HB3 . 26012 1 81 . 1 1 11 11 HIS C C 13 174.765 . . . . . . . 9 HIS C . 26012 1 82 . 1 1 11 11 HIS CA C 13 56.337 . . . . . . . 9 HIS CA . 26012 1 83 . 1 1 11 11 HIS CB C 13 30.586 . . . . . . . 9 HIS CB . 26012 1 84 . 1 1 11 11 HIS N N 15 118.450 . . . . . . . 9 HIS N . 26012 1 85 . 1 1 12 12 ILE H H 1 7.816 . . . . . . . 10 ILE H . 26012 1 86 . 1 1 12 12 ILE HA H 1 4.109 . . . . . . . 10 ILE HA . 26012 1 87 . 1 1 12 12 ILE HB H 1 1.779 . . . . . . . 10 ILE HB . 26012 1 88 . 1 1 12 12 ILE HG12 H 1 1.363 . . . . . . . 10 ILE HG12 . 26012 1 89 . 1 1 12 12 ILE HG13 H 1 1.060 . . . . . . . 10 ILE HG13 . 26012 1 90 . 1 1 12 12 ILE HG21 H 1 0.820 . . . . . . . 10 ILE HG21 . 26012 1 91 . 1 1 12 12 ILE HG22 H 1 0.820 . . . . . . . 10 ILE HG22 . 26012 1 92 . 1 1 12 12 ILE HG23 H 1 0.820 . . . . . . . 10 ILE HG23 . 26012 1 93 . 1 1 12 12 ILE HD11 H 1 0.745 . . . . . . . 10 ILE HD11 . 26012 1 94 . 1 1 12 12 ILE HD12 H 1 0.745 . . . . . . . 10 ILE HD12 . 26012 1 95 . 1 1 12 12 ILE HD13 H 1 0.745 . . . . . . . 10 ILE HD13 . 26012 1 96 . 1 1 12 12 ILE C C 13 175.602 . . . . . . . 10 ILE C . 26012 1 97 . 1 1 12 12 ILE CA C 13 61.034 . . . . . . . 10 ILE CA . 26012 1 98 . 1 1 12 12 ILE CB C 13 39.080 . . . . . . . 10 ILE CB . 26012 1 99 . 1 1 12 12 ILE CG1 C 13 27.417 . . . . . . . 10 ILE CG1 . 26012 1 100 . 1 1 12 12 ILE CG2 C 13 17.731 . . . . . . . 10 ILE CG2 . 26012 1 101 . 1 1 12 12 ILE CD1 C 13 13.001 . . . . . . . 10 ILE CD1 . 26012 1 102 . 1 1 12 12 ILE N N 15 122.128 . . . . . . . 10 ILE N . 26012 1 103 . 1 1 13 13 GLU H H 1 8.404 . . . . . . . 11 GLU H . 26012 1 104 . 1 1 13 13 GLU HA H 1 4.339 . . . . . . . 11 GLU HA . 26012 1 105 . 1 1 13 13 GLU HB2 H 1 1.946 . . . . . . . 11 GLU HB2 . 26012 1 106 . 1 1 13 13 GLU HB3 H 1 1.910 . . . . . . . 11 GLU HB3 . 26012 1 107 . 1 1 13 13 GLU HG2 H 1 2.249 . . . . . . . 11 GLU HG2 . 26012 1 108 . 1 1 13 13 GLU HG3 H 1 2.215 . . . . . . . 11 GLU HG3 . 26012 1 109 . 1 1 13 13 GLU C C 13 176.038 . . . . . . . 11 GLU C . 26012 1 110 . 1 1 13 13 GLU CA C 13 56.336 . . . . . . . 11 GLU CA . 26012 1 111 . 1 1 13 13 GLU CB C 13 30.524 . . . . . . . 11 GLU CB . 26012 1 112 . 1 1 13 13 GLU N N 15 125.239 . . . . . . . 11 GLU N . 26012 1 113 . 1 1 14 14 VAL H H 1 8.194 . . . . . . . 12 VAL H . 26012 1 114 . 1 1 14 14 VAL HA H 1 4.186 . . . . . . . 12 VAL HA . 26012 1 115 . 1 1 14 14 VAL HB H 1 2.059 . . . . . . . 12 VAL HB . 26012 1 116 . 1 1 14 14 VAL HG11 H 1 0.889 . . . . . . . 12 VAL HG11 . 26012 1 117 . 1 1 14 14 VAL HG12 H 1 0.889 . . . . . . . 12 VAL HG12 . 26012 1 118 . 1 1 14 14 VAL HG13 H 1 0.889 . . . . . . . 12 VAL HG13 . 26012 1 119 . 1 1 14 14 VAL HG21 H 1 0.881 . . . . . . . 12 VAL HG21 . 26012 1 120 . 1 1 14 14 VAL HG22 H 1 0.881 . . . . . . . 12 VAL HG22 . 26012 1 121 . 1 1 14 14 VAL HG23 H 1 0.881 . . . . . . . 12 VAL HG23 . 26012 1 122 . 1 1 14 14 VAL C C 13 175.859 . . . . . . . 12 VAL C . 26012 1 123 . 1 1 14 14 VAL CA C 13 62.001 . . . . . . . 12 VAL CA . 26012 1 124 . 1 1 14 14 VAL CB C 13 33.254 . . . . . . . 12 VAL CB . 26012 1 125 . 1 1 14 14 VAL CG1 C 13 21.304 . . . . . . . 12 VAL CG1 . 26012 1 126 . 1 1 14 14 VAL CG2 C 13 20.450 . . . . . . . 12 VAL CG2 . 26012 1 127 . 1 1 14 14 VAL N N 15 121.648 . . . . . . . 12 VAL N . 26012 1 128 . 1 1 15 15 SER H H 1 8.436 . . . . . . . 13 SER H . 26012 1 129 . 1 1 15 15 SER HA H 1 4.522 . . . . . . . 13 SER HA . 26012 1 130 . 1 1 15 15 SER HB2 H 1 3.877 . . . . . . . 13 SER HB2 . 26012 1 131 . 1 1 15 15 SER HB3 H 1 3.841 . . . . . . . 13 SER HB3 . 26012 1 132 . 1 1 15 15 SER C C 13 174.249 . . . . . . . 13 SER C . 26012 1 133 . 1 1 15 15 SER CA C 13 58.010 . . . . . . . 13 SER CA . 26012 1 134 . 1 1 15 15 SER CB C 13 64.257 . . . . . . . 13 SER CB . 26012 1 135 . 1 1 15 15 SER N N 15 119.947 . . . . . . . 13 SER N . 26012 1 136 . 1 1 16 16 ASP H H 1 8.437 . . . . . . . 14 ASP H . 26012 1 137 . 1 1 16 16 ASP HA H 1 4.636 . . . . . . . 14 ASP HA . 26012 1 138 . 1 1 16 16 ASP HB2 H 1 2.694 . . . . . . . 14 ASP HB2 . 26012 1 139 . 1 1 16 16 ASP HB3 H 1 2.630 . . . . . . . 14 ASP HB3 . 26012 1 140 . 1 1 16 16 ASP C C 13 175.956 . . . . . . . 14 ASP C . 26012 1 141 . 1 1 16 16 ASP CA C 13 54.624 . . . . . . . 14 ASP CA . 26012 1 142 . 1 1 16 16 ASP CB C 13 41.413 . . . . . . . 14 ASP CB . 26012 1 143 . 1 1 16 16 ASP N N 15 122.922 . . . . . . . 14 ASP N . 26012 1 144 . 1 1 17 17 ASP H H 1 8.272 . . . . . . . 15 ASP H . 26012 1 145 . 1 1 17 17 ASP HA H 1 4.502 . . . . . . . 15 ASP HA . 26012 1 146 . 1 1 17 17 ASP HB2 H 1 2.699 . . . . . . . 15 ASP HB2 . 26012 1 147 . 1 1 17 17 ASP HB3 H 1 2.602 . . . . . . . 15 ASP HB3 . 26012 1 148 . 1 1 17 17 ASP C C 13 176.364 . . . . . . . 15 ASP C . 26012 1 149 . 1 1 17 17 ASP CA C 13 54.590 . . . . . . . 15 ASP CA . 26012 1 150 . 1 1 17 17 ASP CB C 13 41.439 . . . . . . . 15 ASP CB . 26012 1 151 . 1 1 17 17 ASP N N 15 120.193 . . . . . . . 15 ASP N . 26012 1 152 . 1 1 18 18 GLU H H 1 8.300 . . . . . . . 16 GLU H . 26012 1 153 . 1 1 18 18 GLU HA H 1 4.258 . . . . . . . 16 GLU HA . 26012 1 154 . 1 1 18 18 GLU HB2 H 1 2.004 . . . . . . . 16 GLU HB2 . 26012 1 155 . 1 1 18 18 GLU HB3 H 1 1.948 . . . . . . . 16 GLU HB3 . 26012 1 156 . 1 1 18 18 GLU HG2 H 1 2.281 . . . . . . . 16 GLU HG2 . 26012 1 157 . 1 1 18 18 GLU HG3 H 1 2.226 . . . . . . . 16 GLU HG3 . 26012 1 158 . 1 1 18 18 GLU C C 13 176.327 . . . . . . . 16 GLU C . 26012 1 159 . 1 1 18 18 GLU CA C 13 56.877 . . . . . . . 16 GLU CA . 26012 1 160 . 1 1 18 18 GLU CB C 13 30.417 . . . . . . . 16 GLU CB . 26012 1 161 . 1 1 18 18 GLU N N 15 121.005 . . . . . . . 16 GLU N . 26012 1 162 . 1 1 19 19 ASP H H 1 8.300 . . . . . . . 17 ASP H . 26012 1 163 . 1 1 19 19 ASP HA H 1 4.591 . . . . . . . 17 ASP HA . 26012 1 164 . 1 1 19 19 ASP HB2 H 1 2.687 . . . . . . . 17 ASP HB2 . 26012 1 165 . 1 1 19 19 ASP HB3 H 1 2.633 . . . . . . . 17 ASP HB3 . 26012 1 166 . 1 1 19 19 ASP C C 13 176.433 . . . . . . . 17 ASP C . 26012 1 167 . 1 1 19 19 ASP CA C 13 54.573 . . . . . . . 17 ASP CA . 26012 1 168 . 1 1 19 19 ASP CB C 13 41.491 . . . . . . . 17 ASP CB . 26012 1 169 . 1 1 19 19 ASP N N 15 121.016 . . . . . . . 17 ASP N . 26012 1 170 . 1 1 20 20 GLU H H 1 8.384 . . . . . . . 18 GLU H . 26012 1 171 . 1 1 20 20 GLU HA H 1 4.285 . . . . . . . 18 GLU HA . 26012 1 172 . 1 1 20 20 GLU HB2 H 1 2.065 . . . . . . . 18 GLU HB2 . 26012 1 173 . 1 1 20 20 GLU HB3 H 1 1.952 . . . . . . . 18 GLU HB3 . 26012 1 174 . 1 1 20 20 GLU HG2 H 1 2.260 . . . . . . . 18 GLU HG2 . 26012 1 175 . 1 1 20 20 GLU HG3 H 1 2.232 . . . . . . . 18 GLU HG3 . 26012 1 176 . 1 1 20 20 GLU C C 13 176.572 . . . . . . . 18 GLU C . 26012 1 177 . 1 1 20 20 GLU CA C 13 56.937 . . . . . . . 18 GLU CA . 26012 1 178 . 1 1 20 20 GLU CB C 13 30.306 . . . . . . . 18 GLU CB . 26012 1 179 . 1 1 20 20 GLU N N 15 121.426 . . . . . . . 18 GLU N . 26012 1 180 . 1 1 21 21 THR H H 1 8.206 . . . . . . . 19 THR H . 26012 1 181 . 1 1 21 21 THR HA H 1 4.229 . . . . . . . 19 THR HA . 26012 1 182 . 1 1 21 21 THR HG21 H 1 1.135 . . . . . . . 19 THR HG21 . 26012 1 183 . 1 1 21 21 THR HG22 H 1 1.135 . . . . . . . 19 THR HG22 . 26012 1 184 . 1 1 21 21 THR HG23 H 1 1.135 . . . . . . . 19 THR HG23 . 26012 1 185 . 1 1 21 21 THR C C 13 174.136 . . . . . . . 19 THR C . 26012 1 186 . 1 1 21 21 THR CA C 13 62.348 . . . . . . . 19 THR CA . 26012 1 187 . 1 1 21 21 THR CB C 13 69.785 . . . . . . . 19 THR CB . 26012 1 188 . 1 1 21 21 THR N N 15 114.276 . . . . . . . 19 THR N . 26012 1 189 . 1 1 22 22 HIS H H 1 8.212 . . . . . . . 20 HIS H . 26012 1 190 . 1 1 22 22 HIS HB2 H 1 3.051 . . . . . . . 20 HIS HB2 . 26012 1 191 . 1 1 22 22 HIS HB3 H 1 3.034 . . . . . . . 20 HIS HB3 . 26012 1 192 . 1 1 22 22 HIS C C 13 173.282 . . . . . . . 20 HIS C . 26012 1 193 . 1 1 22 22 HIS CA C 13 54.407 . . . . . . . 20 HIS CA . 26012 1 194 . 1 1 22 22 HIS CB C 13 30.324 . . . . . . . 20 HIS CB . 26012 1 195 . 1 1 22 22 HIS N N 15 122.388 . . . . . . . 20 HIS N . 26012 1 196 . 1 1 23 23 PRO HA H 1 4.412 . . . . . . . 21 PRO HA . 26012 1 197 . 1 1 23 23 PRO HB2 H 1 2.228 . . . . . . . 21 PRO HB2 . 26012 1 198 . 1 1 23 23 PRO HB3 H 1 1.866 . . . . . . . 21 PRO HB3 . 26012 1 199 . 1 1 23 23 PRO HD2 H 1 3.622 . . . . . . . 21 PRO HD2 . 26012 1 200 . 1 1 23 23 PRO HD3 H 1 3.388 . . . . . . . 21 PRO HD3 . 26012 1 201 . 1 1 23 23 PRO C C 13 176.735 . . . . . . . 21 PRO C . 26012 1 202 . 1 1 23 23 PRO CA C 13 63.557 . . . . . . . 21 PRO CA . 26012 1 203 . 1 1 23 23 PRO CB C 13 32.318 . . . . . . . 21 PRO CB . 26012 1 204 . 1 1 23 23 PRO CG C 13 27.487 . . . . . . . 21 PRO CG . 26012 1 205 . 1 1 23 23 PRO CD C 13 50.789 . . . . . . . 21 PRO CD . 26012 1 206 . 1 1 24 24 ASN H H 1 8.800 . . . . . . . 22 ASN H . 26012 1 207 . 1 1 24 24 ASN HA H 1 4.730 . . . . . . . 22 ASN HA . 26012 1 208 . 1 1 24 24 ASN C C 13 175.060 . . . . . . . 22 ASN C . 26012 1 209 . 1 1 24 24 ASN CA C 13 53.424 . . . . . . . 22 ASN CA . 26012 1 210 . 1 1 24 24 ASN CB C 13 38.861 . . . . . . . 22 ASN CB . 26012 1 211 . 1 1 24 24 ASN N N 15 118.622 . . . . . . . 22 ASN N . 26012 1 212 . 1 1 25 25 ILE H H 1 7.952 . . . . . . . 23 ILE H . 26012 1 213 . 1 1 25 25 ILE HA H 1 4.189 . . . . . . . 23 ILE HA . 26012 1 214 . 1 1 25 25 ILE HB H 1 1.841 . . . . . . . 23 ILE HB . 26012 1 215 . 1 1 25 25 ILE HG12 H 1 1.389 . . . . . . . 23 ILE HG12 . 26012 1 216 . 1 1 25 25 ILE HG13 H 1 1.128 . . . . . . . 23 ILE HG13 . 26012 1 217 . 1 1 25 25 ILE HG21 H 1 0.849 . . . . . . . 23 ILE HG21 . 26012 1 218 . 1 1 25 25 ILE HG22 H 1 0.849 . . . . . . . 23 ILE HG22 . 26012 1 219 . 1 1 25 25 ILE HG23 H 1 0.849 . . . . . . . 23 ILE HG23 . 26012 1 220 . 1 1 25 25 ILE HD11 H 1 0.764 . . . . . . . 23 ILE HD11 . 26012 1 221 . 1 1 25 25 ILE HD12 H 1 0.764 . . . . . . . 23 ILE HD12 . 26012 1 222 . 1 1 25 25 ILE HD13 H 1 0.764 . . . . . . . 23 ILE HD13 . 26012 1 223 . 1 1 25 25 ILE C C 13 175.523 . . . . . . . 23 ILE C . 26012 1 224 . 1 1 25 25 ILE CA C 13 61.207 . . . . . . . 23 ILE CA . 26012 1 225 . 1 1 25 25 ILE CB C 13 39.309 . . . . . . . 23 ILE CB . 26012 1 226 . 1 1 25 25 ILE CG1 C 13 27.446 . . . . . . . 23 ILE CG1 . 26012 1 227 . 1 1 25 25 ILE CG2 C 13 17.785 . . . . . . . 23 ILE CG2 . 26012 1 228 . 1 1 25 25 ILE CD1 C 13 13.140 . . . . . . . 23 ILE CD1 . 26012 1 229 . 1 1 25 25 ILE N N 15 120.351 . . . . . . . 23 ILE N . 26012 1 230 . 1 1 26 26 ASP H H 1 8.342 . . . . . . . 24 ASP H . 26012 1 231 . 1 1 26 26 ASP HA H 1 4.690 . . . . . . . 24 ASP HA . 26012 1 232 . 1 1 26 26 ASP HB2 H 1 2.762 . . . . . . . 24 ASP HB2 . 26012 1 233 . 1 1 26 26 ASP HB3 H 1 2.741 . . . . . . . 24 ASP HB3 . 26012 1 234 . 1 1 26 26 ASP C C 13 176.860 . . . . . . . 24 ASP C . 26012 1 235 . 1 1 26 26 ASP CA C 13 54.204 . . . . . . . 24 ASP CA . 26012 1 236 . 1 1 26 26 ASP CB C 13 41.271 . . . . . . . 24 ASP CB . 26012 1 237 . 1 1 26 26 ASP N N 15 123.743 . . . . . . . 24 ASP N . 26012 1 238 . 1 1 27 27 THR H H 1 8.202 . . . . . . . 25 THR H . 26012 1 239 . 1 1 27 27 THR HA H 1 4.062 . . . . . . . 25 THR HA . 26012 1 240 . 1 1 27 27 THR HB H 1 4.412 . . . . . . . 25 THR HB . 26012 1 241 . 1 1 27 27 THR HG21 H 1 1.219 . . . . . . . 25 THR HG21 . 26012 1 242 . 1 1 27 27 THR HG22 H 1 1.219 . . . . . . . 25 THR HG22 . 26012 1 243 . 1 1 27 27 THR HG23 H 1 1.219 . . . . . . . 25 THR HG23 . 26012 1 244 . 1 1 27 27 THR C C 13 175.535 . . . . . . . 25 THR C . 26012 1 245 . 1 1 27 27 THR CA C 13 64.061 . . . . . . . 25 THR CA . 26012 1 246 . 1 1 27 27 THR CB C 13 69.163 . . . . . . . 25 THR CB . 26012 1 247 . 1 1 27 27 THR CG2 C 13 22.255 . . . . . . . 25 THR CG2 . 26012 1 248 . 1 1 27 27 THR N N 15 115.954 . . . . . . . 25 THR N . 26012 1 249 . 1 1 28 28 ALA H H 1 8.300 . . . . . . . 26 ALA H . 26012 1 250 . 1 1 28 28 ALA HA H 1 4.239 . . . . . . . 26 ALA HA . 26012 1 251 . 1 1 28 28 ALA HB1 H 1 1.449 . . . . . . . 26 ALA HB1 . 26012 1 252 . 1 1 28 28 ALA HB2 H 1 1.449 . . . . . . . 26 ALA HB2 . 26012 1 253 . 1 1 28 28 ALA HB3 H 1 1.449 . . . . . . . 26 ALA HB3 . 26012 1 254 . 1 1 28 28 ALA C C 13 179.405 . . . . . . . 26 ALA C . 26012 1 255 . 1 1 28 28 ALA CA C 13 54.511 . . . . . . . 26 ALA CA . 26012 1 256 . 1 1 28 28 ALA CB C 13 18.597 . . . . . . . 26 ALA CB . 26012 1 257 . 1 1 28 28 ALA N N 15 124.701 . . . . . . . 26 ALA N . 26012 1 258 . 1 1 29 29 SER H H 1 8.033 . . . . . . . 27 SER H . 26012 1 259 . 1 1 29 29 SER HA H 1 4.261 . . . . . . . 27 SER HA . 26012 1 260 . 1 1 29 29 SER HB2 H 1 3.886 . . . . . . . 27 SER HB2 . 26012 1 261 . 1 1 29 29 SER HB3 H 1 3.768 . . . . . . . 27 SER HB3 . 26012 1 262 . 1 1 29 29 SER C C 13 175.488 . . . . . . . 27 SER C . 26012 1 263 . 1 1 29 29 SER CA C 13 60.192 . . . . . . . 27 SER CA . 26012 1 264 . 1 1 29 29 SER CB C 13 63.210 . . . . . . . 27 SER CB . 26012 1 265 . 1 1 29 29 SER N N 15 114.050 . . . . . . . 27 SER N . 26012 1 266 . 1 1 30 30 LEU H H 1 7.904 . . . . . . . 28 LEU H . 26012 1 267 . 1 1 30 30 LEU HG H 1 1.542 . . . . . . . 28 LEU HG . 26012 1 268 . 1 1 30 30 LEU HD11 H 1 0.832 . . . . . . . 28 LEU HD11 . 26012 1 269 . 1 1 30 30 LEU HD12 H 1 0.832 . . . . . . . 28 LEU HD12 . 26012 1 270 . 1 1 30 30 LEU HD13 H 1 0.832 . . . . . . . 28 LEU HD13 . 26012 1 271 . 1 1 30 30 LEU HD21 H 1 0.765 . . . . . . . 28 LEU HD21 . 26012 1 272 . 1 1 30 30 LEU HD22 H 1 0.765 . . . . . . . 28 LEU HD22 . 26012 1 273 . 1 1 30 30 LEU HD23 H 1 0.765 . . . . . . . 28 LEU HD23 . 26012 1 274 . 1 1 30 30 LEU C C 13 177.993 . . . . . . . 28 LEU C . 26012 1 275 . 1 1 30 30 LEU CA C 13 57.052 . . . . . . . 28 LEU CA . 26012 1 276 . 1 1 30 30 LEU CB C 13 42.064 . . . . . . . 28 LEU CB . 26012 1 277 . 1 1 30 30 LEU CG C 13 27.240 . . . . . . . 28 LEU CG . 26012 1 278 . 1 1 30 30 LEU CD1 C 13 24.642 . . . . . . . 28 LEU CD1 . 26012 1 279 . 1 1 30 30 LEU CD2 C 13 23.961 . . . . . . . 28 LEU CD2 . 26012 1 280 . 1 1 30 30 LEU N N 15 123.087 . . . . . . . 28 LEU N . 26012 1 281 . 1 1 31 31 PHE H H 1 8.109 . . . . . . . 29 PHE H . 26012 1 282 . 1 1 31 31 PHE HA H 1 4.378 . . . . . . . 29 PHE HA . 26012 1 283 . 1 1 31 31 PHE C C 13 177.102 . . . . . . . 29 PHE C . 26012 1 284 . 1 1 31 31 PHE CA C 13 59.591 . . . . . . . 29 PHE CA . 26012 1 285 . 1 1 31 31 PHE CB C 13 38.949 . . . . . . . 29 PHE CB . 26012 1 286 . 1 1 31 31 PHE N N 15 118.617 . . . . . . . 29 PHE N . 26012 1 287 . 1 1 33 33 TRP HE1 H 1 10.168 . . . . . . . 31 TRP HE1 . 26012 1 288 . 1 1 33 33 TRP NE1 N 15 129.334 . . . . . . . 31 TRP NE1 . 26012 1 289 . 1 1 35 35 HIS C C 13 176.529 . . . . . . . 33 HIS C . 26012 1 290 . 1 1 35 35 HIS CA C 13 58.839 . . . . . . . 33 HIS CA . 26012 1 291 . 1 1 35 35 HIS CB C 13 30.951 . . . . . . . 33 HIS CB . 26012 1 292 . 1 1 36 36 GLN H H 1 8.149 . . . . . . . 34 GLN H . 26012 1 293 . 1 1 36 36 GLN HA H 1 4.093 . . . . . . . 34 GLN HA . 26012 1 294 . 1 1 36 36 GLN C C 13 176.989 . . . . . . . 34 GLN C . 26012 1 295 . 1 1 36 36 GLN CA C 13 57.879 . . . . . . . 34 GLN CA . 26012 1 296 . 1 1 36 36 GLN CB C 13 28.798 . . . . . . . 34 GLN CB . 26012 1 297 . 1 1 36 36 GLN N N 15 119.485 . . . . . . . 34 GLN N . 26012 1 298 . 1 1 37 37 ALA H H 1 8.129 . . . . . . . 35 ALA H . 26012 1 299 . 1 1 37 37 ALA HA H 1 4.171 . . . . . . . 35 ALA HA . 26012 1 300 . 1 1 37 37 ALA HB1 H 1 1.315 . . . . . . . 35 ALA HB1 . 26012 1 301 . 1 1 37 37 ALA HB2 H 1 1.315 . . . . . . . 35 ALA HB2 . 26012 1 302 . 1 1 37 37 ALA HB3 H 1 1.315 . . . . . . . 35 ALA HB3 . 26012 1 303 . 1 1 37 37 ALA C C 13 179.354 . . . . . . . 35 ALA C . 26012 1 304 . 1 1 37 37 ALA CA C 13 54.146 . . . . . . . 35 ALA CA . 26012 1 305 . 1 1 37 37 ALA CB C 13 18.527 . . . . . . . 35 ALA CB . 26012 1 306 . 1 1 37 37 ALA N N 15 122.219 . . . . . . . 35 ALA N . 26012 1 307 . 1 1 38 38 ARG H H 1 7.868 . . . . . . . 36 ARG H . 26012 1 308 . 1 1 38 38 ARG C C 13 177.785 . . . . . . . 36 ARG C . 26012 1 309 . 1 1 38 38 ARG CA C 13 58.766 . . . . . . . 36 ARG CA . 26012 1 310 . 1 1 38 38 ARG CB C 13 32.623 . . . . . . . 36 ARG CB . 26012 1 311 . 1 1 38 38 ARG N N 15 119.364 . . . . . . . 36 ARG N . 26012 1 312 . 1 1 39 39 VAL H H 1 7.995 . . . . . . . 37 VAL H . 26012 1 313 . 1 1 39 39 VAL HA H 1 3.702 . . . . . . . 37 VAL HA . 26012 1 314 . 1 1 39 39 VAL HB H 1 2.003 . . . . . . . 37 VAL HB . 26012 1 315 . 1 1 39 39 VAL HG11 H 1 0.846 . . . . . . . 37 VAL HG11 . 26012 1 316 . 1 1 39 39 VAL HG12 H 1 0.846 . . . . . . . 37 VAL HG12 . 26012 1 317 . 1 1 39 39 VAL HG13 H 1 0.846 . . . . . . . 37 VAL HG13 . 26012 1 318 . 1 1 39 39 VAL HG21 H 1 0.883 . . . . . . . 37 VAL HG21 . 26012 1 319 . 1 1 39 39 VAL HG22 H 1 0.883 . . . . . . . 37 VAL HG22 . 26012 1 320 . 1 1 39 39 VAL HG23 H 1 0.883 . . . . . . . 37 VAL HG23 . 26012 1 321 . 1 1 39 39 VAL C C 13 177.878 . . . . . . . 37 VAL C . 26012 1 322 . 1 1 39 39 VAL CA C 13 65.604 . . . . . . . 37 VAL CA . 26012 1 323 . 1 1 39 39 VAL CB C 13 32.062 . . . . . . . 37 VAL CB . 26012 1 324 . 1 1 39 39 VAL CG1 C 13 21.949 . . . . . . . 37 VAL CG1 . 26012 1 325 . 1 1 39 39 VAL CG2 C 13 21.226 . . . . . . . 37 VAL CG2 . 26012 1 326 . 1 1 39 39 VAL N N 15 120.033 . . . . . . . 37 VAL N . 26012 1 327 . 1 1 40 40 GLU H H 1 8.258 . . . . . . . 38 GLU H . 26012 1 328 . 1 1 40 40 GLU C C 13 178.976 . . . . . . . 38 GLU C . 26012 1 329 . 1 1 40 40 GLU CA C 13 59.169 . . . . . . . 38 GLU CA . 26012 1 330 . 1 1 40 40 GLU N N 15 120.868 . . . . . . . 38 GLU N . 26012 1 331 . 1 1 42 42 MET HE1 H 1 1.799 . . . . . . . 40 MET HE1 . 26012 1 332 . 1 1 42 42 MET HE2 H 1 1.799 . . . . . . . 40 MET HE2 . 26012 1 333 . 1 1 42 42 MET HE3 H 1 1.799 . . . . . . . 40 MET HE3 . 26012 1 334 . 1 1 42 42 MET C C 13 178.330 . . . . . . . 40 MET C . 26012 1 335 . 1 1 42 42 MET CA C 13 58.811 . . . . . . . 40 MET CA . 26012 1 336 . 1 1 42 42 MET CB C 13 32.619 . . . . . . . 40 MET CB . 26012 1 337 . 1 1 42 42 MET CE C 13 17.505 . . . . . . . 40 MET CE . 26012 1 338 . 1 1 43 43 GLU H H 1 8.472 . . . . . . . 41 GLU H . 26012 1 339 . 1 1 43 43 GLU HA H 1 4.107 . . . . . . . 41 GLU HA . 26012 1 340 . 1 1 43 43 GLU C C 13 179.297 . . . . . . . 41 GLU C . 26012 1 341 . 1 1 43 43 GLU CA C 13 59.602 . . . . . . . 41 GLU CA . 26012 1 342 . 1 1 43 43 GLU CB C 13 29.568 . . . . . . . 41 GLU CB . 26012 1 343 . 1 1 43 43 GLU CG C 13 36.653 . . . . . . . 41 GLU CG . 26012 1 344 . 1 1 43 43 GLU N N 15 120.484 . . . . . . . 41 GLU N . 26012 1 345 . 1 1 44 44 GLN H H 1 8.108 . . . . . . . 42 GLN H . 26012 1 346 . 1 1 44 44 GLN C C 13 178.216 . . . . . . . 42 GLN C . 26012 1 347 . 1 1 44 44 GLN CA C 13 58.796 . . . . . . . 42 GLN CA . 26012 1 348 . 1 1 44 44 GLN CB C 13 28.132 . . . . . . . 42 GLN CB . 26012 1 349 . 1 1 44 44 GLN N N 15 119.633 . . . . . . . 42 GLN N . 26012 1 350 . 1 1 45 45 PHE H H 1 8.204 . . . . . . . 43 PHE H . 26012 1 351 . 1 1 45 45 PHE HA H 1 3.833 . . . . . . . 43 PHE HA . 26012 1 352 . 1 1 45 45 PHE C C 13 176.437 . . . . . . . 43 PHE C . 26012 1 353 . 1 1 45 45 PHE CA C 13 61.280 . . . . . . . 43 PHE CA . 26012 1 354 . 1 1 45 45 PHE N N 15 120.949 . . . . . . . 43 PHE N . 26012 1 355 . 1 1 46 46 GLN H H 1 8.351 . . . . . . . 44 GLN H . 26012 1 356 . 1 1 46 46 GLN HA H 1 3.972 . . . . . . . 44 GLN HA . 26012 1 357 . 1 1 46 46 GLN CA C 13 59.037 . . . . . . . 44 GLN CA . 26012 1 358 . 1 1 46 46 GLN N N 15 117.946 . . . . . . . 44 GLN N . 26012 1 359 . 1 1 47 47 LYS H H 1 8.083 . . . . . . . 45 LYS H . 26012 1 360 . 1 1 48 48 GLU C C 13 179.336 . . . . . . . 46 GLU C . 26012 1 361 . 1 1 48 48 GLU CA C 13 59.587 . . . . . . . 46 GLU CA . 26012 1 362 . 1 1 48 48 GLU CB C 13 29.487 . . . . . . . 46 GLU CB . 26012 1 363 . 1 1 49 49 LYS H H 1 8.378 . . . . . . . 47 LYS H . 26012 1 364 . 1 1 49 49 LYS HA H 1 3.819 . . . . . . . 47 LYS HA . 26012 1 365 . 1 1 49 49 LYS HB2 H 1 1.740 . . . . . . . 47 LYS HB2 . 26012 1 366 . 1 1 49 49 LYS HB3 H 1 1.612 . . . . . . . 47 LYS HB3 . 26012 1 367 . 1 1 49 49 LYS HG2 H 1 1.442 . . . . . . . 47 LYS HG2 . 26012 1 368 . 1 1 49 49 LYS HG3 H 1 1.385 . . . . . . . 47 LYS HG3 . 26012 1 369 . 1 1 49 49 LYS HE2 H 1 2.968 . . . . . . . 47 LYS HE2 . 26012 1 370 . 1 1 49 49 LYS HE3 H 1 2.968 . . . . . . . 47 LYS HE3 . 26012 1 371 . 1 1 49 49 LYS C C 13 178.244 . . . . . . . 47 LYS C . 26012 1 372 . 1 1 49 49 LYS CA C 13 60.449 . . . . . . . 47 LYS CA . 26012 1 373 . 1 1 49 49 LYS CB C 13 32.127 . . . . . . . 47 LYS CB . 26012 1 374 . 1 1 49 49 LYS N N 15 120.542 . . . . . . . 47 LYS N . 26012 1 375 . 1 1 50 50 GLU H H 1 8.189 . . . . . . . 48 GLU H . 26012 1 376 . 1 1 50 50 GLU HA H 1 4.110 . . . . . . . 48 GLU HA . 26012 1 377 . 1 1 50 50 GLU C C 13 179.349 . . . . . . . 48 GLU C . 26012 1 378 . 1 1 50 50 GLU CA C 13 59.509 . . . . . . . 48 GLU CA . 26012 1 379 . 1 1 50 50 GLU CB C 13 29.297 . . . . . . . 48 GLU CB . 26012 1 380 . 1 1 50 50 GLU N N 15 119.143 . . . . . . . 48 GLU N . 26012 1 381 . 1 1 51 51 GLU H H 1 7.972 . . . . . . . 49 GLU H . 26012 1 382 . 1 1 51 51 GLU HA H 1 4.095 . . . . . . . 49 GLU HA . 26012 1 383 . 1 1 51 51 GLU HB2 H 1 2.217 . . . . . . . 49 GLU HB2 . 26012 1 384 . 1 1 51 51 GLU HB3 H 1 2.148 . . . . . . . 49 GLU HB3 . 26012 1 385 . 1 1 51 51 GLU C C 13 179.739 . . . . . . . 49 GLU C . 26012 1 386 . 1 1 51 51 GLU CA C 13 59.538 . . . . . . . 49 GLU CA . 26012 1 387 . 1 1 51 51 GLU CB C 13 29.366 . . . . . . . 49 GLU CB . 26012 1 388 . 1 1 51 51 GLU N N 15 119.922 . . . . . . . 49 GLU N . 26012 1 389 . 1 1 52 52 LEU H H 1 8.081 . . . . . . . 50 LEU H . 26012 1 390 . 1 1 52 52 LEU HA H 1 4.158 . . . . . . . 50 LEU HA . 26012 1 391 . 1 1 52 52 LEU HD11 H 1 1.026 . . . . . . . 50 LEU HD11 . 26012 1 392 . 1 1 52 52 LEU HD12 H 1 1.026 . . . . . . . 50 LEU HD12 . 26012 1 393 . 1 1 52 52 LEU HD13 H 1 1.026 . . . . . . . 50 LEU HD13 . 26012 1 394 . 1 1 52 52 LEU HD21 H 1 1.152 . . . . . . . 50 LEU HD21 . 26012 1 395 . 1 1 52 52 LEU HD22 H 1 1.152 . . . . . . . 50 LEU HD22 . 26012 1 396 . 1 1 52 52 LEU HD23 H 1 1.152 . . . . . . . 50 LEU HD23 . 26012 1 397 . 1 1 52 52 LEU C C 13 178.552 . . . . . . . 50 LEU C . 26012 1 398 . 1 1 52 52 LEU CA C 13 58.009 . . . . . . . 50 LEU CA . 26012 1 399 . 1 1 52 52 LEU CB C 13 42.719 . . . . . . . 50 LEU CB . 26012 1 400 . 1 1 52 52 LEU CD1 C 13 26.582 . . . . . . . 50 LEU CD1 . 26012 1 401 . 1 1 52 52 LEU CD2 C 13 24.440 . . . . . . . 50 LEU CD2 . 26012 1 402 . 1 1 52 52 LEU N N 15 121.590 . . . . . . . 50 LEU N . 26012 1 403 . 1 1 53 53 ASP H H 1 8.482 . . . . . . . 51 ASP H . 26012 1 404 . 1 1 53 53 ASP HA H 1 4.318 . . . . . . . 51 ASP HA . 26012 1 405 . 1 1 53 53 ASP HB2 H 1 2.765 . . . . . . . 51 ASP HB2 . 26012 1 406 . 1 1 53 53 ASP HB3 H 1 2.723 . . . . . . . 51 ASP HB3 . 26012 1 407 . 1 1 53 53 ASP C C 13 178.623 . . . . . . . 51 ASP C . 26012 1 408 . 1 1 53 53 ASP CA C 13 57.860 . . . . . . . 51 ASP CA . 26012 1 409 . 1 1 53 53 ASP CB C 13 41.733 . . . . . . . 51 ASP CB . 26012 1 410 . 1 1 53 53 ASP N N 15 120.016 . . . . . . . 51 ASP N . 26012 1 411 . 1 1 54 54 ARG H H 1 8.200 . . . . . . . 52 ARG H . 26012 1 412 . 1 1 54 54 ARG HA H 1 3.957 . . . . . . . 52 ARG HA . 26012 1 413 . 1 1 54 54 ARG HB2 H 1 1.883 . . . . . . . 52 ARG HB2 . 26012 1 414 . 1 1 54 54 ARG HB3 H 1 1.796 . . . . . . . 52 ARG HB3 . 26012 1 415 . 1 1 54 54 ARG C C 13 179.144 . . . . . . . 52 ARG C . 26012 1 416 . 1 1 54 54 ARG CA C 13 59.860 . . . . . . . 52 ARG CA . 26012 1 417 . 1 1 54 54 ARG CB C 13 30.087 . . . . . . . 52 ARG CB . 26012 1 418 . 1 1 54 54 ARG N N 15 118.945 . . . . . . . 52 ARG N . 26012 1 419 . 1 1 55 55 GLY H H 1 7.941 . . . . . . . 53 GLY H . 26012 1 420 . 1 1 55 55 GLY HA2 H 1 4.130 . . . . . . . 53 GLY HA2 . 26012 1 421 . 1 1 55 55 GLY C C 13 175.561 . . . . . . . 53 GLY C . 26012 1 422 . 1 1 55 55 GLY CA C 13 46.146 . . . . . . . 53 GLY CA . 26012 1 423 . 1 1 55 55 GLY N N 15 107.823 . . . . . . . 53 GLY N . 26012 1 424 . 1 1 56 56 CYS H H 1 8.009 . . . . . . . 54 CYS H . 26012 1 425 . 1 1 56 56 CYS HB2 H 1 3.125 . . . . . . . 54 CYS HB2 . 26012 1 426 . 1 1 56 56 CYS HB3 H 1 2.869 . . . . . . . 54 CYS HB3 . 26012 1 427 . 1 1 56 56 CYS C C 13 176.470 . . . . . . . 54 CYS C . 26012 1 428 . 1 1 56 56 CYS CA C 13 62.233 . . . . . . . 54 CYS CA . 26012 1 429 . 1 1 56 56 CYS CB C 13 30.083 . . . . . . . 54 CYS CB . 26012 1 430 . 1 1 56 56 CYS N N 15 121.863 . . . . . . . 54 CYS N . 26012 1 431 . 1 1 57 57 ARG H H 1 8.199 . . . . . . . 55 ARG H . 26012 1 432 . 1 1 57 57 ARG C C 13 179.378 . . . . . . . 55 ARG C . 26012 1 433 . 1 1 57 57 ARG CA C 13 60.024 . . . . . . . 55 ARG CA . 26012 1 434 . 1 1 57 57 ARG CB C 13 30.082 . . . . . . . 55 ARG CB . 26012 1 435 . 1 1 57 57 ARG N N 15 118.569 . . . . . . . 55 ARG N . 26012 1 436 . 1 1 58 58 GLU H H 1 8.080 . . . . . . . 56 GLU H . 26012 1 437 . 1 1 58 58 GLU C C 13 178.151 . . . . . . . 56 GLU C . 26012 1 438 . 1 1 58 58 GLU CA C 13 58.756 . . . . . . . 56 GLU CA . 26012 1 439 . 1 1 58 58 GLU CB C 13 29.332 . . . . . . . 56 GLU CB . 26012 1 440 . 1 1 58 58 GLU N N 15 120.941 . . . . . . . 56 GLU N . 26012 1 441 . 1 1 59 59 CYS H H 1 7.695 . . . . . . . 57 CYS H . 26012 1 442 . 1 1 59 59 CYS HA H 1 4.107 . . . . . . . 57 CYS HA . 26012 1 443 . 1 1 59 59 CYS HB2 H 1 3.074 . . . . . . . 57 CYS HB2 . 26012 1 444 . 1 1 59 59 CYS HB3 H 1 2.859 . . . . . . . 57 CYS HB3 . 26012 1 445 . 1 1 59 59 CYS C C 13 176.907 . . . . . . . 57 CYS C . 26012 1 446 . 1 1 59 59 CYS CA C 13 63.203 . . . . . . . 57 CYS CA . 26012 1 447 . 1 1 59 59 CYS CB C 13 27.142 . . . . . . . 57 CYS CB . 26012 1 448 . 1 1 59 59 CYS N N 15 120.510 . . . . . . . 57 CYS N . 26012 1 449 . 1 1 60 60 LYS H H 1 8.398 . . . . . . . 58 LYS H . 26012 1 450 . 1 1 60 60 LYS HA H 1 3.890 . . . . . . . 58 LYS HA . 26012 1 451 . 1 1 60 60 LYS C C 13 179.723 . . . . . . . 58 LYS C . 26012 1 452 . 1 1 60 60 LYS CA C 13 60.593 . . . . . . . 58 LYS CA . 26012 1 453 . 1 1 60 60 LYS CB C 13 32.202 . . . . . . . 58 LYS CB . 26012 1 454 . 1 1 60 60 LYS N N 15 117.951 . . . . . . . 58 LYS N . 26012 1 455 . 1 1 61 61 ARG H H 1 8.011 . . . . . . . 59 ARG H . 26012 1 456 . 1 1 61 61 ARG C C 13 179.069 . . . . . . . 59 ARG C . 26012 1 457 . 1 1 61 61 ARG CA C 13 59.680 . . . . . . . 59 ARG CA . 26012 1 458 . 1 1 61 61 ARG CB C 13 32.880 . . . . . . . 59 ARG CB . 26012 1 459 . 1 1 61 61 ARG N N 15 121.774 . . . . . . . 59 ARG N . 26012 1 460 . 1 1 62 62 LYS H H 1 7.974 . . . . . . . 60 LYS H . 26012 1 461 . 1 1 62 62 LYS HA H 1 4.072 . . . . . . . 60 LYS HA . 26012 1 462 . 1 1 62 62 LYS C C 13 180.444 . . . . . . . 60 LYS C . 26012 1 463 . 1 1 62 62 LYS CA C 13 60.393 . . . . . . . 60 LYS CA . 26012 1 464 . 1 1 62 62 LYS CB C 13 30.427 . . . . . . . 60 LYS CB . 26012 1 465 . 1 1 62 62 LYS N N 15 120.800 . . . . . . . 60 LYS N . 26012 1 466 . 1 1 63 63 VAL H H 1 8.888 . . . . . . . 61 VAL H . 26012 1 467 . 1 1 63 63 VAL HA H 1 3.578 . . . . . . . 61 VAL HA . 26012 1 468 . 1 1 63 63 VAL HB H 1 2.241 . . . . . . . 61 VAL HB . 26012 1 469 . 1 1 63 63 VAL HG11 H 1 1.103 . . . . . . . 61 VAL HG11 . 26012 1 470 . 1 1 63 63 VAL HG12 H 1 1.103 . . . . . . . 61 VAL HG12 . 26012 1 471 . 1 1 63 63 VAL HG13 H 1 1.103 . . . . . . . 61 VAL HG13 . 26012 1 472 . 1 1 63 63 VAL HG21 H 1 0.961 . . . . . . . 61 VAL HG21 . 26012 1 473 . 1 1 63 63 VAL HG22 H 1 0.961 . . . . . . . 61 VAL HG22 . 26012 1 474 . 1 1 63 63 VAL HG23 H 1 0.961 . . . . . . . 61 VAL HG23 . 26012 1 475 . 1 1 63 63 VAL C C 13 177.897 . . . . . . . 61 VAL C . 26012 1 476 . 1 1 63 63 VAL CA C 13 67.240 . . . . . . . 61 VAL CA . 26012 1 477 . 1 1 63 63 VAL CB C 13 32.408 . . . . . . . 61 VAL CB . 26012 1 478 . 1 1 63 63 VAL CG1 C 13 24.071 . . . . . . . 61 VAL CG1 . 26012 1 479 . 1 1 63 63 VAL CG2 C 13 21.119 . . . . . . . 61 VAL CG2 . 26012 1 480 . 1 1 63 63 VAL N N 15 122.334 . . . . . . . 61 VAL N . 26012 1 481 . 1 1 64 64 ALA H H 1 7.897 . . . . . . . 62 ALA H . 26012 1 482 . 1 1 64 64 ALA HA H 1 4.171 . . . . . . . 62 ALA HA . 26012 1 483 . 1 1 64 64 ALA HB1 H 1 1.560 . . . . . . . 62 ALA HB1 . 26012 1 484 . 1 1 64 64 ALA HB2 H 1 1.560 . . . . . . . 62 ALA HB2 . 26012 1 485 . 1 1 64 64 ALA HB3 H 1 1.560 . . . . . . . 62 ALA HB3 . 26012 1 486 . 1 1 64 64 ALA C C 13 181.008 . . . . . . . 62 ALA C . 26012 1 487 . 1 1 64 64 ALA CA C 13 55.246 . . . . . . . 62 ALA CA . 26012 1 488 . 1 1 64 64 ALA CB C 13 17.897 . . . . . . . 62 ALA CB . 26012 1 489 . 1 1 64 64 ALA N N 15 121.972 . . . . . . . 62 ALA N . 26012 1 490 . 1 1 65 65 GLU H H 1 8.186 . . . . . . . 63 GLU H . 26012 1 491 . 1 1 65 65 GLU HA H 1 4.115 . . . . . . . 63 GLU HA . 26012 1 492 . 1 1 65 65 GLU HG2 H 1 2.392 . . . . . . . 63 GLU HG2 . 26012 1 493 . 1 1 65 65 GLU HG3 H 1 2.209 . . . . . . . 63 GLU HG3 . 26012 1 494 . 1 1 65 65 GLU C C 13 178.076 . . . . . . . 63 GLU C . 26012 1 495 . 1 1 65 65 GLU CA C 13 59.055 . . . . . . . 63 GLU CA . 26012 1 496 . 1 1 65 65 GLU CB C 13 29.652 . . . . . . . 63 GLU CB . 26012 1 497 . 1 1 65 65 GLU N N 15 119.606 . . . . . . . 63 GLU N . 26012 1 498 . 1 1 66 66 CYS H H 1 8.187 . . . . . . . 64 CYS H . 26012 1 499 . 1 1 66 66 CYS HA H 1 4.104 . . . . . . . 64 CYS HA . 26012 1 500 . 1 1 66 66 CYS HB2 H 1 3.018 . . . . . . . 64 CYS HB2 . 26012 1 501 . 1 1 66 66 CYS HB3 H 1 2.944 . . . . . . . 64 CYS HB3 . 26012 1 502 . 1 1 66 66 CYS C C 13 176.589 . . . . . . . 64 CYS C . 26012 1 503 . 1 1 66 66 CYS CA C 13 63.177 . . . . . . . 64 CYS CA . 26012 1 504 . 1 1 66 66 CYS CB C 13 26.890 . . . . . . . 64 CYS CB . 26012 1 505 . 1 1 66 66 CYS N N 15 120.668 . . . . . . . 64 CYS N . 26012 1 506 . 1 1 67 67 GLN H H 1 8.392 . . . . . . . 65 GLN H . 26012 1 507 . 1 1 67 67 GLN HA H 1 4.071 . . . . . . . 65 GLN HA . 26012 1 508 . 1 1 67 67 GLN HB2 H 1 2.251 . . . . . . . 65 GLN HB2 . 26012 1 509 . 1 1 67 67 GLN HB3 H 1 2.121 . . . . . . . 65 GLN HB3 . 26012 1 510 . 1 1 67 67 GLN HG2 H 1 2.539 . . . . . . . 65 GLN HG2 . 26012 1 511 . 1 1 67 67 GLN HG3 H 1 2.458 . . . . . . . 65 GLN HG3 . 26012 1 512 . 1 1 67 67 GLN C C 13 178.649 . . . . . . . 65 GLN C . 26012 1 513 . 1 1 67 67 GLN CA C 13 59.115 . . . . . . . 65 GLN CA . 26012 1 514 . 1 1 67 67 GLN CB C 13 28.456 . . . . . . . 65 GLN CB . 26012 1 515 . 1 1 67 67 GLN N N 15 116.498 . . . . . . . 65 GLN N . 26012 1 516 . 1 1 68 68 ARG H H 1 8.043 . . . . . . . 66 ARG H . 26012 1 517 . 1 1 68 68 ARG HA H 1 4.156 . . . . . . . 66 ARG HA . 26012 1 518 . 1 1 68 68 ARG C C 13 178.853 . . . . . . . 66 ARG C . 26012 1 519 . 1 1 68 68 ARG CA C 13 59.786 . . . . . . . 66 ARG CA . 26012 1 520 . 1 1 68 68 ARG CB C 13 30.019 . . . . . . . 66 ARG CB . 26012 1 521 . 1 1 68 68 ARG N N 15 120.449 . . . . . . . 66 ARG N . 26012 1 522 . 1 1 69 69 LYS H H 1 7.978 . . . . . . . 67 LYS H . 26012 1 523 . 1 1 69 69 LYS HA H 1 4.085 . . . . . . . 67 LYS HA . 26012 1 524 . 1 1 69 69 LYS HB2 H 1 1.731 . . . . . . . 67 LYS HB2 . 26012 1 525 . 1 1 69 69 LYS HB3 H 1 1.731 . . . . . . . 67 LYS HB3 . 26012 1 526 . 1 1 69 69 LYS C C 13 179.375 . . . . . . . 67 LYS C . 26012 1 527 . 1 1 69 69 LYS CA C 13 59.548 . . . . . . . 67 LYS CA . 26012 1 528 . 1 1 69 69 LYS CB C 13 32.749 . . . . . . . 67 LYS CB . 26012 1 529 . 1 1 69 69 LYS N N 15 119.840 . . . . . . . 67 LYS N . 26012 1 530 . 1 1 70 70 LEU H H 1 8.486 . . . . . . . 68 LEU H . 26012 1 531 . 1 1 70 70 LEU HA H 1 3.965 . . . . . . . 68 LEU HA . 26012 1 532 . 1 1 70 70 LEU HD11 H 1 0.887 . . . . . . . 68 LEU HD11 . 26012 1 533 . 1 1 70 70 LEU HD12 H 1 0.887 . . . . . . . 68 LEU HD12 . 26012 1 534 . 1 1 70 70 LEU HD13 H 1 0.887 . . . . . . . 68 LEU HD13 . 26012 1 535 . 1 1 70 70 LEU HD21 H 1 0.894 . . . . . . . 68 LEU HD21 . 26012 1 536 . 1 1 70 70 LEU HD22 H 1 0.894 . . . . . . . 68 LEU HD22 . 26012 1 537 . 1 1 70 70 LEU HD23 H 1 0.894 . . . . . . . 68 LEU HD23 . 26012 1 538 . 1 1 70 70 LEU C C 13 178.784 . . . . . . . 68 LEU C . 26012 1 539 . 1 1 70 70 LEU CA C 13 58.656 . . . . . . . 68 LEU CA . 26012 1 540 . 1 1 70 70 LEU CB C 13 42.341 . . . . . . . 68 LEU CB . 26012 1 541 . 1 1 70 70 LEU CD1 C 13 25.598 . . . . . . . 68 LEU CD1 . 26012 1 542 . 1 1 70 70 LEU CD2 C 13 24.831 . . . . . . . 68 LEU CD2 . 26012 1 543 . 1 1 70 70 LEU N N 15 120.558 . . . . . . . 68 LEU N . 26012 1 544 . 1 1 71 71 LYS H H 1 7.793 . . . . . . . 69 LYS H . 26012 1 545 . 1 1 71 71 LYS HA H 1 4.138 . . . . . . . 69 LYS HA . 26012 1 546 . 1 1 71 71 LYS C C 13 179.295 . . . . . . . 69 LYS C . 26012 1 547 . 1 1 71 71 LYS CA C 13 58.619 . . . . . . . 69 LYS CA . 26012 1 548 . 1 1 71 71 LYS CB C 13 31.863 . . . . . . . 69 LYS CB . 26012 1 549 . 1 1 71 71 LYS N N 15 118.521 . . . . . . . 69 LYS N . 26012 1 550 . 1 1 72 72 GLU H H 1 7.817 . . . . . . . 70 GLU H . 26012 1 551 . 1 1 72 72 GLU HA H 1 4.070 . . . . . . . 70 GLU HA . 26012 1 552 . 1 1 72 72 GLU HB2 H 1 2.242 . . . . . . . 70 GLU HB2 . 26012 1 553 . 1 1 72 72 GLU HB3 H 1 2.121 . . . . . . . 70 GLU HB3 . 26012 1 554 . 1 1 72 72 GLU C C 13 178.852 . . . . . . . 70 GLU C . 26012 1 555 . 1 1 72 72 GLU CA C 13 58.744 . . . . . . . 70 GLU CA . 26012 1 556 . 1 1 72 72 GLU CB C 13 29.848 . . . . . . . 70 GLU CB . 26012 1 557 . 1 1 72 72 GLU N N 15 117.931 . . . . . . . 70 GLU N . 26012 1 558 . 1 1 73 73 LEU H H 1 7.911 . . . . . . . 71 LEU H . 26012 1 559 . 1 1 73 73 LEU HA H 1 4.201 . . . . . . . 71 LEU HA . 26012 1 560 . 1 1 73 73 LEU HD11 H 1 0.887 . . . . . . . 71 LEU HD11 . 26012 1 561 . 1 1 73 73 LEU HD12 H 1 0.887 . . . . . . . 71 LEU HD12 . 26012 1 562 . 1 1 73 73 LEU HD13 H 1 0.887 . . . . . . . 71 LEU HD13 . 26012 1 563 . 1 1 73 73 LEU HD21 H 1 0.873 . . . . . . . 71 LEU HD21 . 26012 1 564 . 1 1 73 73 LEU HD22 H 1 0.873 . . . . . . . 71 LEU HD22 . 26012 1 565 . 1 1 73 73 LEU HD23 H 1 0.873 . . . . . . . 71 LEU HD23 . 26012 1 566 . 1 1 73 73 LEU C C 13 178.737 . . . . . . . 71 LEU C . 26012 1 567 . 1 1 73 73 LEU CA C 13 56.831 . . . . . . . 71 LEU CA . 26012 1 568 . 1 1 73 73 LEU CB C 13 42.508 . . . . . . . 71 LEU CB . 26012 1 569 . 1 1 73 73 LEU CD1 C 13 25.633 . . . . . . . 71 LEU CD1 . 26012 1 570 . 1 1 73 73 LEU CD2 C 13 24.039 . . . . . . . 71 LEU CD2 . 26012 1 571 . 1 1 73 73 LEU N N 15 119.763 . . . . . . . 71 LEU N . 26012 1 572 . 1 1 74 74 GLU H H 1 8.143 . . . . . . . 72 GLU H . 26012 1 573 . 1 1 74 74 GLU HA H 1 4.074 . . . . . . . 72 GLU HA . 26012 1 574 . 1 1 74 74 GLU HB2 H 1 2.238 . . . . . . . 72 GLU HB2 . 26012 1 575 . 1 1 74 74 GLU HB3 H 1 2.113 . . . . . . . 72 GLU HB3 . 26012 1 576 . 1 1 74 74 GLU HG2 H 1 2.231 . . . . . . . 72 GLU HG2 . 26012 1 577 . 1 1 74 74 GLU HG3 H 1 2.105 . . . . . . . 72 GLU HG3 . 26012 1 578 . 1 1 74 74 GLU C C 13 178.393 . . . . . . . 72 GLU C . 26012 1 579 . 1 1 74 74 GLU CA C 13 58.973 . . . . . . . 72 GLU CA . 26012 1 580 . 1 1 74 74 GLU CB C 13 30.173 . . . . . . . 72 GLU CB . 26012 1 581 . 1 1 74 74 GLU N N 15 119.863 . . . . . . . 72 GLU N . 26012 1 582 . 1 1 75 75 VAL H H 1 7.515 . . . . . . . 73 VAL H . 26012 1 583 . 1 1 75 75 VAL HA H 1 4.199 . . . . . . . 73 VAL HA . 26012 1 584 . 1 1 75 75 VAL HB H 1 2.308 . . . . . . . 73 VAL HB . 26012 1 585 . 1 1 75 75 VAL HG11 H 1 0.966 . . . . . . . 73 VAL HG11 . 26012 1 586 . 1 1 75 75 VAL HG12 H 1 0.966 . . . . . . . 73 VAL HG12 . 26012 1 587 . 1 1 75 75 VAL HG13 H 1 0.966 . . . . . . . 73 VAL HG13 . 26012 1 588 . 1 1 75 75 VAL HG21 H 1 1.000 . . . . . . . 73 VAL HG21 . 26012 1 589 . 1 1 75 75 VAL HG22 H 1 1.000 . . . . . . . 73 VAL HG22 . 26012 1 590 . 1 1 75 75 VAL HG23 H 1 1.000 . . . . . . . 73 VAL HG23 . 26012 1 591 . 1 1 75 75 VAL C C 13 176.212 . . . . . . . 73 VAL C . 26012 1 592 . 1 1 75 75 VAL CA C 13 62.666 . . . . . . . 73 VAL CA . 26012 1 593 . 1 1 75 75 VAL CB C 13 32.051 . . . . . . . 73 VAL CB . 26012 1 594 . 1 1 75 75 VAL CG1 C 13 21.381 . . . . . . . 73 VAL CG1 . 26012 1 595 . 1 1 75 75 VAL CG2 C 13 20.333 . . . . . . . 73 VAL CG2 . 26012 1 596 . 1 1 75 75 VAL N N 15 113.991 . . . . . . . 73 VAL N . 26012 1 597 . 1 1 76 76 ALA H H 1 7.631 . . . . . . . 74 ALA H . 26012 1 598 . 1 1 76 76 ALA HA H 1 4.452 . . . . . . . 74 ALA HA . 26012 1 599 . 1 1 76 76 ALA HB1 H 1 1.462 . . . . . . . 74 ALA HB1 . 26012 1 600 . 1 1 76 76 ALA HB2 H 1 1.462 . . . . . . . 74 ALA HB2 . 26012 1 601 . 1 1 76 76 ALA HB3 H 1 1.462 . . . . . . . 74 ALA HB3 . 26012 1 602 . 1 1 76 76 ALA C C 13 177.269 . . . . . . . 74 ALA C . 26012 1 603 . 1 1 76 76 ALA CA C 13 52.181 . . . . . . . 74 ALA CA . 26012 1 604 . 1 1 76 76 ALA CB C 13 19.573 . . . . . . . 74 ALA CB . 26012 1 605 . 1 1 76 76 ALA N N 15 124.271 . . . . . . . 74 ALA N . 26012 1 606 . 1 1 77 77 GLU H H 1 8.364 . . . . . . . 75 GLU H . 26012 1 607 . 1 1 77 77 GLU HA H 1 4.199 . . . . . . . 75 GLU HA . 26012 1 608 . 1 1 77 77 GLU C C 13 177.330 . . . . . . . 75 GLU C . 26012 1 609 . 1 1 77 77 GLU CA C 13 57.358 . . . . . . . 75 GLU CA . 26012 1 610 . 1 1 77 77 GLU CB C 13 29.033 . . . . . . . 75 GLU CB . 26012 1 611 . 1 1 77 77 GLU N N 15 119.816 . . . . . . . 75 GLU N . 26012 1 612 . 1 1 78 78 GLY H H 1 8.450 . . . . . . . 76 GLY H . 26012 1 613 . 1 1 78 78 GLY C C 13 174.693 . . . . . . . 76 GLY C . 26012 1 614 . 1 1 78 78 GLY CA C 13 45.646 . . . . . . . 76 GLY CA . 26012 1 615 . 1 1 78 78 GLY N N 15 108.497 . . . . . . . 76 GLY N . 26012 1 616 . 1 1 79 79 GLY H H 1 8.307 . . . . . . . 77 GLY H . 26012 1 617 . 1 1 79 79 GLY HA2 H 1 4.141 . . . . . . . 77 GLY HA2 . 26012 1 618 . 1 1 79 79 GLY HA3 H 1 3.950 . . . . . . . 77 GLY HA3 . 26012 1 619 . 1 1 79 79 GLY C C 13 174.672 . . . . . . . 77 GLY C . 26012 1 620 . 1 1 79 79 GLY CA C 13 45.972 . . . . . . . 77 GLY CA . 26012 1 621 . 1 1 79 79 GLY N N 15 108.017 . . . . . . . 77 GLY N . 26012 1 622 . 1 1 80 80 LYS H H 1 8.182 . . . . . . . 78 LYS H . 26012 1 623 . 1 1 80 80 LYS C C 13 178.058 . . . . . . . 78 LYS C . 26012 1 624 . 1 1 80 80 LYS CA C 13 59.245 . . . . . . . 78 LYS CA . 26012 1 625 . 1 1 80 80 LYS CB C 13 32.552 . . . . . . . 78 LYS CB . 26012 1 626 . 1 1 80 80 LYS N N 15 120.914 . . . . . . . 78 LYS N . 26012 1 627 . 1 1 81 81 ALA H H 1 8.468 . . . . . . . 79 ALA H . 26012 1 628 . 1 1 81 81 ALA HB1 H 1 1.456 . . . . . . . 79 ALA HB1 . 26012 1 629 . 1 1 81 81 ALA HB2 H 1 1.456 . . . . . . . 79 ALA HB2 . 26012 1 630 . 1 1 81 81 ALA HB3 H 1 1.456 . . . . . . . 79 ALA HB3 . 26012 1 631 . 1 1 81 81 ALA C C 13 180.554 . . . . . . . 79 ALA C . 26012 1 632 . 1 1 81 81 ALA CA C 13 55.243 . . . . . . . 79 ALA CA . 26012 1 633 . 1 1 81 81 ALA CB C 13 18.068 . . . . . . . 79 ALA CB . 26012 1 634 . 1 1 81 81 ALA N N 15 121.104 . . . . . . . 79 ALA N . 26012 1 635 . 1 1 82 82 GLU H H 1 8.077 . . . . . . . 80 GLU H . 26012 1 636 . 1 1 82 82 GLU HA H 1 4.223 . . . . . . . 80 GLU HA . 26012 1 637 . 1 1 82 82 GLU HB2 H 1 2.084 . . . . . . . 80 GLU HB2 . 26012 1 638 . 1 1 82 82 GLU HB3 H 1 2.014 . . . . . . . 80 GLU HB3 . 26012 1 639 . 1 1 82 82 GLU C C 13 178.300 . . . . . . . 80 GLU C . 26012 1 640 . 1 1 82 82 GLU CA C 13 58.714 . . . . . . . 80 GLU CA . 26012 1 641 . 1 1 82 82 GLU CB C 13 29.447 . . . . . . . 80 GLU CB . 26012 1 642 . 1 1 82 82 GLU N N 15 119.323 . . . . . . . 80 GLU N . 26012 1 643 . 1 1 83 83 LEU H H 1 8.078 . . . . . . . 81 LEU H . 26012 1 644 . 1 1 83 83 LEU HA H 1 3.965 . . . . . . . 81 LEU HA . 26012 1 645 . 1 1 83 83 LEU HD11 H 1 0.887 . . . . . . . 81 LEU HD11 . 26012 1 646 . 1 1 83 83 LEU HD12 H 1 0.887 . . . . . . . 81 LEU HD12 . 26012 1 647 . 1 1 83 83 LEU HD13 H 1 0.887 . . . . . . . 81 LEU HD13 . 26012 1 648 . 1 1 83 83 LEU HD21 H 1 0.859 . . . . . . . 81 LEU HD21 . 26012 1 649 . 1 1 83 83 LEU HD22 H 1 0.859 . . . . . . . 81 LEU HD22 . 26012 1 650 . 1 1 83 83 LEU HD23 H 1 0.859 . . . . . . . 81 LEU HD23 . 26012 1 651 . 1 1 83 83 LEU C C 13 178.651 . . . . . . . 81 LEU C . 26012 1 652 . 1 1 83 83 LEU CA C 13 58.676 . . . . . . . 81 LEU CA . 26012 1 653 . 1 1 83 83 LEU CB C 13 42.068 . . . . . . . 81 LEU CB . 26012 1 654 . 1 1 83 83 LEU CD1 C 13 25.522 . . . . . . . 81 LEU CD1 . 26012 1 655 . 1 1 83 83 LEU CD2 C 13 25.483 . . . . . . . 81 LEU CD2 . 26012 1 656 . 1 1 83 83 LEU N N 15 121.187 . . . . . . . 81 LEU N . 26012 1 657 . 1 1 84 84 GLU H H 1 8.308 . . . . . . . 82 GLU H . 26012 1 658 . 1 1 84 84 GLU HA H 1 4.041 . . . . . . . 82 GLU HA . 26012 1 659 . 1 1 84 84 GLU C C 13 179.915 . . . . . . . 82 GLU C . 26012 1 660 . 1 1 84 84 GLU CA C 13 59.783 . . . . . . . 82 GLU CA . 26012 1 661 . 1 1 84 84 GLU CB C 13 29.361 . . . . . . . 82 GLU CB . 26012 1 662 . 1 1 84 84 GLU N N 15 117.704 . . . . . . . 82 GLU N . 26012 1 663 . 1 1 85 85 ARG H H 1 7.846 . . . . . . . 83 ARG H . 26012 1 664 . 1 1 85 85 ARG HA H 1 4.149 . . . . . . . 83 ARG HA . 26012 1 665 . 1 1 85 85 ARG HB2 H 1 1.782 . . . . . . . 83 ARG HB2 . 26012 1 666 . 1 1 85 85 ARG HB3 H 1 1.610 . . . . . . . 83 ARG HB3 . 26012 1 667 . 1 1 85 85 ARG HD2 H 1 3.317 . . . . . . . 83 ARG HD2 . 26012 1 668 . 1 1 85 85 ARG HD3 H 1 3.202 . . . . . . . 83 ARG HD3 . 26012 1 669 . 1 1 85 85 ARG C C 13 179.518 . . . . . . . 83 ARG C . 26012 1 670 . 1 1 85 85 ARG CA C 13 59.665 . . . . . . . 83 ARG CA . 26012 1 671 . 1 1 85 85 ARG CB C 13 30.314 . . . . . . . 83 ARG CB . 26012 1 672 . 1 1 85 85 ARG N N 15 120.691 . . . . . . . 83 ARG N . 26012 1 673 . 1 1 86 86 LEU H H 1 8.251 . . . . . . . 84 LEU H . 26012 1 674 . 1 1 86 86 LEU HA H 1 4.202 . . . . . . . 84 LEU HA . 26012 1 675 . 1 1 86 86 LEU HB2 H 1 1.541 . . . . . . . 84 LEU HB2 . 26012 1 676 . 1 1 86 86 LEU HB3 H 1 1.498 . . . . . . . 84 LEU HB3 . 26012 1 677 . 1 1 86 86 LEU HD11 H 1 0.907 . . . . . . . 84 LEU HD11 . 26012 1 678 . 1 1 86 86 LEU HD12 H 1 0.907 . . . . . . . 84 LEU HD12 . 26012 1 679 . 1 1 86 86 LEU HD13 H 1 0.907 . . . . . . . 84 LEU HD13 . 26012 1 680 . 1 1 86 86 LEU HD21 H 1 0.961 . . . . . . . 84 LEU HD21 . 26012 1 681 . 1 1 86 86 LEU HD22 H 1 0.961 . . . . . . . 84 LEU HD22 . 26012 1 682 . 1 1 86 86 LEU HD23 H 1 0.961 . . . . . . . 84 LEU HD23 . 26012 1 683 . 1 1 86 86 LEU C C 13 179.172 . . . . . . . 84 LEU C . 26012 1 684 . 1 1 86 86 LEU CA C 13 57.695 . . . . . . . 84 LEU CA . 26012 1 685 . 1 1 86 86 LEU CB C 13 42.442 . . . . . . . 84 LEU CB . 26012 1 686 . 1 1 86 86 LEU CD1 C 13 26.238 . . . . . . . 84 LEU CD1 . 26012 1 687 . 1 1 86 86 LEU CD2 C 13 24.243 . . . . . . . 84 LEU CD2 . 26012 1 688 . 1 1 86 86 LEU N N 15 121.629 . . . . . . . 84 LEU N . 26012 1 689 . 1 1 87 87 GLN H H 1 8.753 . . . . . . . 85 GLN H . 26012 1 690 . 1 1 87 87 GLN HA H 1 4.080 . . . . . . . 85 GLN HA . 26012 1 691 . 1 1 87 87 GLN HG2 H 1 2.383 . . . . . . . 85 GLN HG2 . 26012 1 692 . 1 1 87 87 GLN HG3 H 1 2.272 . . . . . . . 85 GLN HG3 . 26012 1 693 . 1 1 87 87 GLN C C 13 179.317 . . . . . . . 85 GLN C . 26012 1 694 . 1 1 87 87 GLN CA C 13 59.282 . . . . . . . 85 GLN CA . 26012 1 695 . 1 1 87 87 GLN CB C 13 28.248 . . . . . . . 85 GLN CB . 26012 1 696 . 1 1 87 87 GLN N N 15 119.114 . . . . . . . 85 GLN N . 26012 1 697 . 1 1 88 88 ALA H H 1 7.815 . . . . . . . 86 ALA H . 26012 1 698 . 1 1 88 88 ALA HA H 1 4.246 . . . . . . . 86 ALA HA . 26012 1 699 . 1 1 88 88 ALA HB1 H 1 1.576 . . . . . . . 86 ALA HB1 . 26012 1 700 . 1 1 88 88 ALA HB2 H 1 1.576 . . . . . . . 86 ALA HB2 . 26012 1 701 . 1 1 88 88 ALA HB3 H 1 1.576 . . . . . . . 86 ALA HB3 . 26012 1 702 . 1 1 88 88 ALA C C 13 180.882 . . . . . . . 86 ALA C . 26012 1 703 . 1 1 88 88 ALA CA C 13 55.180 . . . . . . . 86 ALA CA . 26012 1 704 . 1 1 88 88 ALA CB C 13 17.764 . . . . . . . 86 ALA CB . 26012 1 705 . 1 1 88 88 ALA N N 15 122.472 . . . . . . . 86 ALA N . 26012 1 706 . 1 1 89 89 GLU H H 1 8.132 . . . . . . . 87 GLU H . 26012 1 707 . 1 1 89 89 GLU HA H 1 4.099 . . . . . . . 87 GLU HA . 26012 1 708 . 1 1 89 89 GLU C C 13 178.690 . . . . . . . 87 GLU C . 26012 1 709 . 1 1 89 89 GLU CA C 13 59.755 . . . . . . . 87 GLU CA . 26012 1 710 . 1 1 89 89 GLU CB C 13 29.666 . . . . . . . 87 GLU CB . 26012 1 711 . 1 1 89 89 GLU N N 15 122.240 . . . . . . . 87 GLU N . 26012 1 712 . 1 1 90 90 ALA H H 1 8.815 . . . . . . . 88 ALA H . 26012 1 713 . 1 1 90 90 ALA HA H 1 4.104 . . . . . . . 88 ALA HA . 26012 1 714 . 1 1 90 90 ALA HB1 H 1 1.568 . . . . . . . 88 ALA HB1 . 26012 1 715 . 1 1 90 90 ALA HB2 H 1 1.568 . . . . . . . 88 ALA HB2 . 26012 1 716 . 1 1 90 90 ALA HB3 H 1 1.568 . . . . . . . 88 ALA HB3 . 26012 1 717 . 1 1 90 90 ALA C C 13 180.443 . . . . . . . 88 ALA C . 26012 1 718 . 1 1 90 90 ALA CA C 13 55.775 . . . . . . . 88 ALA CA . 26012 1 719 . 1 1 90 90 ALA CB C 13 18.070 . . . . . . . 88 ALA CB . 26012 1 720 . 1 1 90 90 ALA N N 15 122.229 . . . . . . . 88 ALA N . 26012 1 721 . 1 1 91 91 GLN H H 1 7.852 . . . . . . . 89 GLN H . 26012 1 722 . 1 1 91 91 GLN HA H 1 4.111 . . . . . . . 89 GLN HA . 26012 1 723 . 1 1 91 91 GLN C C 13 179.127 . . . . . . . 89 GLN C . 26012 1 724 . 1 1 91 91 GLN CA C 13 59.032 . . . . . . . 89 GLN CA . 26012 1 725 . 1 1 91 91 GLN CB C 13 28.554 . . . . . . . 89 GLN CB . 26012 1 726 . 1 1 91 91 GLN N N 15 116.663 . . . . . . . 89 GLN N . 26012 1 727 . 1 1 92 92 GLN H H 1 7.885 . . . . . . . 90 GLN H . 26012 1 728 . 1 1 92 92 GLN HA H 1 4.135 . . . . . . . 90 GLN HA . 26012 1 729 . 1 1 92 92 GLN C C 13 179.227 . . . . . . . 90 GLN C . 26012 1 730 . 1 1 92 92 GLN CA C 13 58.941 . . . . . . . 90 GLN CA . 26012 1 731 . 1 1 92 92 GLN CB C 13 28.052 . . . . . . . 90 GLN CB . 26012 1 732 . 1 1 92 92 GLN N N 15 120.967 . . . . . . . 90 GLN N . 26012 1 733 . 1 1 93 93 LEU H H 1 8.827 . . . . . . . 91 LEU H . 26012 1 734 . 1 1 93 93 LEU HD11 H 1 0.886 . . . . . . . 91 LEU HD11 . 26012 1 735 . 1 1 93 93 LEU HD12 H 1 0.886 . . . . . . . 91 LEU HD12 . 26012 1 736 . 1 1 93 93 LEU HD13 H 1 0.886 . . . . . . . 91 LEU HD13 . 26012 1 737 . 1 1 93 93 LEU HD21 H 1 1.012 . . . . . . . 91 LEU HD21 . 26012 1 738 . 1 1 93 93 LEU HD22 H 1 1.012 . . . . . . . 91 LEU HD22 . 26012 1 739 . 1 1 93 93 LEU HD23 H 1 1.012 . . . . . . . 91 LEU HD23 . 26012 1 740 . 1 1 93 93 LEU C C 13 179.020 . . . . . . . 91 LEU C . 26012 1 741 . 1 1 93 93 LEU CA C 13 57.845 . . . . . . . 91 LEU CA . 26012 1 742 . 1 1 93 93 LEU CB C 13 42.705 . . . . . . . 91 LEU CB . 26012 1 743 . 1 1 93 93 LEU CD1 C 13 26.487 . . . . . . . 91 LEU CD1 . 26012 1 744 . 1 1 93 93 LEU CD2 C 13 23.388 . . . . . . . 91 LEU CD2 . 26012 1 745 . 1 1 93 93 LEU N N 15 121.325 . . . . . . . 91 LEU N . 26012 1 746 . 1 1 94 94 ARG H H 1 8.244 . . . . . . . 92 ARG H . 26012 1 747 . 1 1 94 94 ARG HA H 1 4.290 . . . . . . . 92 ARG HA . 26012 1 748 . 1 1 94 94 ARG HD2 H 1 3.275 . . . . . . . 92 ARG HD2 . 26012 1 749 . 1 1 94 94 ARG HD3 H 1 2.996 . . . . . . . 92 ARG HD3 . 26012 1 750 . 1 1 94 94 ARG C C 13 179.445 . . . . . . . 92 ARG C . 26012 1 751 . 1 1 94 94 ARG CA C 13 59.115 . . . . . . . 92 ARG CA . 26012 1 752 . 1 1 94 94 ARG CB C 13 29.964 . . . . . . . 92 ARG CB . 26012 1 753 . 1 1 94 94 ARG N N 15 119.022 . . . . . . . 92 ARG N . 26012 1 754 . 1 1 95 95 LYS H H 1 7.570 . . . . . . . 93 LYS H . 26012 1 755 . 1 1 95 95 LYS HA H 1 4.091 . . . . . . . 93 LYS HA . 26012 1 756 . 1 1 95 95 LYS C C 13 179.632 . . . . . . . 93 LYS C . 26012 1 757 . 1 1 95 95 LYS CA C 13 59.896 . . . . . . . 93 LYS CA . 26012 1 758 . 1 1 95 95 LYS CB C 13 32.237 . . . . . . . 93 LYS CB . 26012 1 759 . 1 1 95 95 LYS N N 15 120.631 . . . . . . . 93 LYS N . 26012 1 760 . 1 1 96 96 GLU H H 1 8.114 . . . . . . . 94 GLU H . 26012 1 761 . 1 1 96 96 GLU HA H 1 3.991 . . . . . . . 94 GLU HA . 26012 1 762 . 1 1 96 96 GLU C C 13 178.650 . . . . . . . 94 GLU C . 26012 1 763 . 1 1 96 96 GLU CA C 13 59.644 . . . . . . . 94 GLU CA . 26012 1 764 . 1 1 96 96 GLU CB C 13 29.360 . . . . . . . 94 GLU CB . 26012 1 765 . 1 1 96 96 GLU N N 15 122.377 . . . . . . . 94 GLU N . 26012 1 766 . 1 1 97 97 GLU H H 1 9.157 . . . . . . . 95 GLU H . 26012 1 767 . 1 1 97 97 GLU C C 13 178.454 . . . . . . . 95 GLU C . 26012 1 768 . 1 1 97 97 GLU CA C 13 60.876 . . . . . . . 95 GLU CA . 26012 1 769 . 1 1 97 97 GLU CB C 13 30.465 . . . . . . . 95 GLU CB . 26012 1 770 . 1 1 97 97 GLU N N 15 123.279 . . . . . . . 95 GLU N . 26012 1 771 . 1 1 98 98 ARG H H 1 7.865 . . . . . . . 96 ARG H . 26012 1 772 . 1 1 98 98 ARG C C 13 178.875 . . . . . . . 96 ARG C . 26012 1 773 . 1 1 98 98 ARG CA C 13 58.812 . . . . . . . 96 ARG CA . 26012 1 774 . 1 1 98 98 ARG CB C 13 29.963 . . . . . . . 96 ARG CB . 26012 1 775 . 1 1 98 98 ARG N N 15 117.676 . . . . . . . 96 ARG N . 26012 1 776 . 1 1 99 99 SER H H 1 7.795 . . . . . . . 97 SER H . 26012 1 777 . 1 1 99 99 SER HA H 1 4.332 . . . . . . . 97 SER HA . 26012 1 778 . 1 1 99 99 SER C C 13 177.662 . . . . . . . 97 SER C . 26012 1 779 . 1 1 99 99 SER CA C 13 61.708 . . . . . . . 97 SER CA . 26012 1 780 . 1 1 99 99 SER CB C 13 62.245 . . . . . . . 97 SER CB . 26012 1 781 . 1 1 99 99 SER N N 15 115.933 . . . . . . . 97 SER N . 26012 1 782 . 1 1 100 100 TRP H H 1 8.444 . . . . . . . 98 TRP H . 26012 1 783 . 1 1 100 100 TRP HA H 1 4.197 . . . . . . . 98 TRP HA . 26012 1 784 . 1 1 100 100 TRP HB2 H 1 3.589 . . . . . . . 98 TRP HB2 . 26012 1 785 . 1 1 100 100 TRP HB3 H 1 3.386 . . . . . . . 98 TRP HB3 . 26012 1 786 . 1 1 100 100 TRP HE1 H 1 11.109 . . . . . . . 98 TRP HE1 . 26012 1 787 . 1 1 100 100 TRP C C 13 178.574 . . . . . . . 98 TRP C . 26012 1 788 . 1 1 100 100 TRP CA C 13 61.488 . . . . . . . 98 TRP CA . 26012 1 789 . 1 1 100 100 TRP CB C 13 29.743 . . . . . . . 98 TRP CB . 26012 1 790 . 1 1 100 100 TRP N N 15 121.766 . . . . . . . 98 TRP N . 26012 1 791 . 1 1 100 100 TRP NE1 N 15 131.035 . . . . . . . 98 TRP NE1 . 26012 1 792 . 1 1 101 101 GLU H H 1 8.513 . . . . . . . 99 GLU H . 26012 1 793 . 1 1 101 101 GLU C C 13 180.081 . . . . . . . 99 GLU C . 26012 1 794 . 1 1 101 101 GLU CA C 13 60.068 . . . . . . . 99 GLU CA . 26012 1 795 . 1 1 101 101 GLU CB C 13 29.727 . . . . . . . 99 GLU CB . 26012 1 796 . 1 1 101 101 GLU N N 15 117.960 . . . . . . . 99 GLU N . 26012 1 797 . 1 1 102 102 GLN H H 1 8.470 . . . . . . . 100 GLN H . 26012 1 798 . 1 1 102 102 GLN HA H 1 4.163 . . . . . . . 100 GLN HA . 26012 1 799 . 1 1 102 102 GLN C C 13 178.889 . . . . . . . 100 GLN C . 26012 1 800 . 1 1 102 102 GLN CA C 13 59.231 . . . . . . . 100 GLN CA . 26012 1 801 . 1 1 102 102 GLN CB C 13 28.352 . . . . . . . 100 GLN CB . 26012 1 802 . 1 1 102 102 GLN N N 15 120.134 . . . . . . . 100 GLN N . 26012 1 803 . 1 1 103 103 LYS H H 1 8.126 . . . . . . . 101 LYS H . 26012 1 804 . 1 1 103 103 LYS HA H 1 4.107 . . . . . . . 101 LYS HA . 26012 1 805 . 1 1 103 103 LYS C C 13 180.270 . . . . . . . 101 LYS C . 26012 1 806 . 1 1 103 103 LYS CA C 13 59.959 . . . . . . . 101 LYS CA . 26012 1 807 . 1 1 103 103 LYS N N 15 120.525 . . . . . . . 101 LYS N . 26012 1 808 . 1 1 104 104 LEU H H 1 8.499 . . . . . . . 102 LEU H . 26012 1 809 . 1 1 104 104 LEU HA H 1 4.157 . . . . . . . 102 LEU HA . 26012 1 810 . 1 1 104 104 LEU HD11 H 1 1.046 . . . . . . . 102 LEU HD11 . 26012 1 811 . 1 1 104 104 LEU HD12 H 1 1.046 . . . . . . . 102 LEU HD12 . 26012 1 812 . 1 1 104 104 LEU HD13 H 1 1.046 . . . . . . . 102 LEU HD13 . 26012 1 813 . 1 1 104 104 LEU HD21 H 1 1.005 . . . . . . . 102 LEU HD21 . 26012 1 814 . 1 1 104 104 LEU HD22 H 1 1.005 . . . . . . . 102 LEU HD22 . 26012 1 815 . 1 1 104 104 LEU HD23 H 1 1.005 . . . . . . . 102 LEU HD23 . 26012 1 816 . 1 1 104 104 LEU C C 13 179.110 . . . . . . . 102 LEU C . 26012 1 817 . 1 1 104 104 LEU CA C 13 58.536 . . . . . . . 102 LEU CA . 26012 1 818 . 1 1 104 104 LEU CB C 13 42.093 . . . . . . . 102 LEU CB . 26012 1 819 . 1 1 104 104 LEU CD1 C 13 25.169 . . . . . . . 102 LEU CD1 . 26012 1 820 . 1 1 104 104 LEU CD2 C 13 25.096 . . . . . . . 102 LEU CD2 . 26012 1 821 . 1 1 104 104 LEU N N 15 121.857 . . . . . . . 102 LEU N . 26012 1 822 . 1 1 105 105 GLU H H 1 8.248 . . . . . . . 103 GLU H . 26012 1 823 . 1 1 105 105 GLU HA H 1 4.173 . . . . . . . 103 GLU HA . 26012 1 824 . 1 1 105 105 GLU C C 13 179.425 . . . . . . . 103 GLU C . 26012 1 825 . 1 1 105 105 GLU CA C 13 59.431 . . . . . . . 103 GLU CA . 26012 1 826 . 1 1 105 105 GLU CB C 13 29.272 . . . . . . . 103 GLU CB . 26012 1 827 . 1 1 105 105 GLU N N 15 121.001 . . . . . . . 103 GLU N . 26012 1 828 . 1 1 106 106 GLU H H 1 8.234 . . . . . . . 104 GLU H . 26012 1 829 . 1 1 106 106 GLU HA H 1 4.097 . . . . . . . 104 GLU HA . 26012 1 830 . 1 1 106 106 GLU C C 13 179.490 . . . . . . . 104 GLU C . 26012 1 831 . 1 1 106 106 GLU CA C 13 59.440 . . . . . . . 104 GLU CA . 26012 1 832 . 1 1 106 106 GLU CB C 13 29.428 . . . . . . . 104 GLU CB . 26012 1 833 . 1 1 106 106 GLU N N 15 119.440 . . . . . . . 104 GLU N . 26012 1 834 . 1 1 107 107 MET H H 1 8.055 . . . . . . . 105 MET H . 26012 1 835 . 1 1 107 107 MET HE1 H 1 1.780 . . . . . . . 105 MET HE1 . 26012 1 836 . 1 1 107 107 MET HE2 H 1 1.780 . . . . . . . 105 MET HE2 . 26012 1 837 . 1 1 107 107 MET HE3 H 1 1.780 . . . . . . . 105 MET HE3 . 26012 1 838 . 1 1 107 107 MET C C 13 178.274 . . . . . . . 105 MET C . 26012 1 839 . 1 1 107 107 MET CA C 13 58.552 . . . . . . . 105 MET CA . 26012 1 840 . 1 1 107 107 MET CB C 13 32.168 . . . . . . . 105 MET CB . 26012 1 841 . 1 1 107 107 MET CE C 13 17.690 . . . . . . . 105 MET CE . 26012 1 842 . 1 1 107 107 MET N N 15 120.047 . . . . . . . 105 MET N . 26012 1 843 . 1 1 108 108 ARG H H 1 8.358 . . . . . . . 106 ARG H . 26012 1 844 . 1 1 108 108 ARG HA H 1 4.214 . . . . . . . 106 ARG HA . 26012 1 845 . 1 1 108 108 ARG C C 13 179.465 . . . . . . . 106 ARG C . 26012 1 846 . 1 1 108 108 ARG CA C 13 59.686 . . . . . . . 106 ARG CA . 26012 1 847 . 1 1 108 108 ARG CB C 13 30.309 . . . . . . . 106 ARG CB . 26012 1 848 . 1 1 108 108 ARG N N 15 120.041 . . . . . . . 106 ARG N . 26012 1 849 . 1 1 109 109 LYS H H 1 7.895 . . . . . . . 107 LYS H . 26012 1 850 . 1 1 109 109 LYS HA H 1 4.064 . . . . . . . 107 LYS HA . 26012 1 851 . 1 1 109 109 LYS C C 13 179.490 . . . . . . . 107 LYS C . 26012 1 852 . 1 1 109 109 LYS CA C 13 59.614 . . . . . . . 107 LYS CA . 26012 1 853 . 1 1 109 109 LYS CB C 13 32.465 . . . . . . . 107 LYS CB . 26012 1 854 . 1 1 109 109 LYS N N 15 119.054 . . . . . . . 107 LYS N . 26012 1 855 . 1 1 110 110 LYS H H 1 8.075 . . . . . . . 108 LYS H . 26012 1 856 . 1 1 110 110 LYS C C 13 179.145 . . . . . . . 108 LYS C . 26012 1 857 . 1 1 110 110 LYS CA C 13 59.067 . . . . . . . 108 LYS CA . 26012 1 858 . 1 1 110 110 LYS CB C 13 32.613 . . . . . . . 108 LYS CB . 26012 1 859 . 1 1 110 110 LYS N N 15 120.469 . . . . . . . 108 LYS N . 26012 1 860 . 1 1 111 111 GLU H H 1 8.435 . . . . . . . 109 GLU H . 26012 1 861 . 1 1 111 111 GLU C C 13 178.310 . . . . . . . 109 GLU C . 26012 1 862 . 1 1 111 111 GLU CA C 13 59.527 . . . . . . . 109 GLU CA . 26012 1 863 . 1 1 111 111 GLU CB C 13 30.063 . . . . . . . 109 GLU CB . 26012 1 864 . 1 1 111 111 GLU N N 15 119.946 . . . . . . . 109 GLU N . 26012 1 865 . 1 1 112 112 LYS H H 1 7.509 . . . . . . . 110 LYS H . 26012 1 866 . 1 1 112 112 LYS C C 13 176.811 . . . . . . . 110 LYS C . 26012 1 867 . 1 1 112 112 LYS CA C 13 57.877 . . . . . . . 110 LYS CA . 26012 1 868 . 1 1 112 112 LYS CB C 13 32.419 . . . . . . . 110 LYS CB . 26012 1 869 . 1 1 112 112 LYS N N 15 116.343 . . . . . . . 110 LYS N . 26012 1 870 . 1 1 113 113 SER H H 1 7.572 . . . . . . . 111 SER H . 26012 1 871 . 1 1 113 113 SER HA H 1 4.454 . . . . . . . 111 SER HA . 26012 1 872 . 1 1 113 113 SER HB2 H 1 3.909 . . . . . . . 111 SER HB2 . 26012 1 873 . 1 1 113 113 SER HB3 H 1 3.909 . . . . . . . 111 SER HB3 . 26012 1 874 . 1 1 113 113 SER C C 13 174.014 . . . . . . . 111 SER C . 26012 1 875 . 1 1 113 113 SER CA C 13 58.351 . . . . . . . 111 SER CA . 26012 1 876 . 1 1 113 113 SER CB C 13 64.163 . . . . . . . 111 SER CB . 26012 1 877 . 1 1 113 113 SER N N 15 112.260 . . . . . . . 111 SER N . 26012 1 878 . 1 1 114 114 MET H H 1 7.316 . . . . . . . 112 MET H . 26012 1 879 . 1 1 114 114 MET HA H 1 4.179 . . . . . . . 112 MET HA . 26012 1 880 . 1 1 114 114 MET HE1 H 1 1.858 . . . . . . . 112 MET HE1 . 26012 1 881 . 1 1 114 114 MET HE2 H 1 1.858 . . . . . . . 112 MET HE2 . 26012 1 882 . 1 1 114 114 MET HE3 H 1 1.858 . . . . . . . 112 MET HE3 . 26012 1 883 . 1 1 114 114 MET C C 13 175.317 . . . . . . . 112 MET C . 26012 1 884 . 1 1 114 114 MET CA C 13 53.212 . . . . . . . 112 MET CA . 26012 1 885 . 1 1 114 114 MET CB C 13 30.680 . . . . . . . 112 MET CB . 26012 1 886 . 1 1 114 114 MET CE C 13 18.139 . . . . . . . 112 MET CE . 26012 1 887 . 1 1 114 114 MET N N 15 121.046 . . . . . . . 112 MET N . 26012 1 888 . 1 1 115 115 PRO HA H 1 4.242 . . . . . . . 113 PRO HA . 26012 1 889 . 1 1 115 115 PRO C C 13 176.375 . . . . . . . 113 PRO C . 26012 1 890 . 1 1 115 115 PRO CA C 13 64.366 . . . . . . . 113 PRO CA . 26012 1 891 . 1 1 115 115 PRO CB C 13 31.605 . . . . . . . 113 PRO CB . 26012 1 892 . 1 1 116 116 TRP H H 1 6.821 . . . . . . . 114 TRP H . 26012 1 893 . 1 1 116 116 TRP HA H 1 4.625 . . . . . . . 114 TRP HA . 26012 1 894 . 1 1 116 116 TRP HB2 H 1 3.317 . . . . . . . 114 TRP HB2 . 26012 1 895 . 1 1 116 116 TRP HB3 H 1 3.151 . . . . . . . 114 TRP HB3 . 26012 1 896 . 1 1 116 116 TRP HE1 H 1 10.436 . . . . . . . 114 TRP HE1 . 26012 1 897 . 1 1 116 116 TRP C C 13 175.579 . . . . . . . 114 TRP C . 26012 1 898 . 1 1 116 116 TRP CA C 13 57.306 . . . . . . . 114 TRP CA . 26012 1 899 . 1 1 116 116 TRP CB C 13 28.355 . . . . . . . 114 TRP CB . 26012 1 900 . 1 1 116 116 TRP N N 15 114.607 . . . . . . . 114 TRP N . 26012 1 901 . 1 1 116 116 TRP NE1 N 15 131.916 . . . . . . . 114 TRP NE1 . 26012 1 902 . 1 1 117 117 ASN H H 1 7.731 . . . . . . . 115 ASN H . 26012 1 903 . 1 1 117 117 ASN HB2 H 1 2.769 . . . . . . . 115 ASN HB2 . 26012 1 904 . 1 1 117 117 ASN HB3 H 1 2.474 . . . . . . . 115 ASN HB3 . 26012 1 905 . 1 1 117 117 ASN C C 13 175.071 . . . . . . . 115 ASN C . 26012 1 906 . 1 1 117 117 ASN CA C 13 53.276 . . . . . . . 115 ASN CA . 26012 1 907 . 1 1 117 117 ASN CB C 13 39.510 . . . . . . . 115 ASN CB . 26012 1 908 . 1 1 117 117 ASN N N 15 119.741 . . . . . . . 115 ASN N . 26012 1 909 . 1 1 118 118 VAL H H 1 7.694 . . . . . . . 116 VAL H . 26012 1 910 . 1 1 118 118 VAL HA H 1 4.096 . . . . . . . 116 VAL HA . 26012 1 911 . 1 1 118 118 VAL HB H 1 2.086 . . . . . . . 116 VAL HB . 26012 1 912 . 1 1 118 118 VAL HG11 H 1 0.892 . . . . . . . 116 VAL HG11 . 26012 1 913 . 1 1 118 118 VAL HG12 H 1 0.892 . . . . . . . 116 VAL HG12 . 26012 1 914 . 1 1 118 118 VAL HG13 H 1 0.892 . . . . . . . 116 VAL HG13 . 26012 1 915 . 1 1 118 118 VAL HG21 H 1 0.882 . . . . . . . 116 VAL HG21 . 26012 1 916 . 1 1 118 118 VAL HG22 H 1 0.882 . . . . . . . 116 VAL HG22 . 26012 1 917 . 1 1 118 118 VAL HG23 H 1 0.882 . . . . . . . 116 VAL HG23 . 26012 1 918 . 1 1 118 118 VAL C C 13 175.770 . . . . . . . 116 VAL C . 26012 1 919 . 1 1 118 118 VAL CA C 13 62.743 . . . . . . . 116 VAL CA . 26012 1 920 . 1 1 118 118 VAL CB C 13 32.895 . . . . . . . 116 VAL CB . 26012 1 921 . 1 1 118 118 VAL CG1 C 13 21.183 . . . . . . . 116 VAL CG1 . 26012 1 922 . 1 1 118 118 VAL CG2 C 13 20.516 . . . . . . . 116 VAL CG2 . 26012 1 923 . 1 1 118 118 VAL N N 15 119.425 . . . . . . . 116 VAL N . 26012 1 924 . 1 1 119 119 ASP H H 1 8.367 . . . . . . . 117 ASP H . 26012 1 925 . 1 1 119 119 ASP HB2 H 1 2.733 . . . . . . . 117 ASP HB2 . 26012 1 926 . 1 1 119 119 ASP HB3 H 1 2.658 . . . . . . . 117 ASP HB3 . 26012 1 927 . 1 1 119 119 ASP C C 13 176.751 . . . . . . . 117 ASP C . 26012 1 928 . 1 1 119 119 ASP CA C 13 54.759 . . . . . . . 117 ASP CA . 26012 1 929 . 1 1 119 119 ASP CB C 13 41.299 . . . . . . . 117 ASP CB . 26012 1 930 . 1 1 119 119 ASP N N 15 123.144 . . . . . . . 117 ASP N . 26012 1 931 . 1 1 120 120 THR H H 1 8.028 . . . . . . . 118 THR H . 26012 1 932 . 1 1 120 120 THR HA H 1 4.284 . . . . . . . 118 THR HA . 26012 1 933 . 1 1 120 120 THR HG21 H 1 1.197 . . . . . . . 118 THR HG21 . 26012 1 934 . 1 1 120 120 THR HG22 H 1 1.197 . . . . . . . 118 THR HG22 . 26012 1 935 . 1 1 120 120 THR HG23 H 1 1.197 . . . . . . . 118 THR HG23 . 26012 1 936 . 1 1 120 120 THR C C 13 174.798 . . . . . . . 118 THR C . 26012 1 937 . 1 1 120 120 THR CA C 13 62.399 . . . . . . . 118 THR CA . 26012 1 938 . 1 1 120 120 THR CB C 13 69.558 . . . . . . . 118 THR CB . 26012 1 939 . 1 1 120 120 THR N N 15 113.985 . . . . . . . 118 THR N . 26012 1 940 . 1 1 121 121 LEU H H 1 8.135 . . . . . . . 119 LEU H . 26012 1 941 . 1 1 121 121 LEU HA H 1 4.358 . . . . . . . 119 LEU HA . 26012 1 942 . 1 1 121 121 LEU HB2 H 1 1.678 . . . . . . . 119 LEU HB2 . 26012 1 943 . 1 1 121 121 LEU HB3 H 1 1.624 . . . . . . . 119 LEU HB3 . 26012 1 944 . 1 1 121 121 LEU HD11 H 1 0.876 . . . . . . . 119 LEU HD11 . 26012 1 945 . 1 1 121 121 LEU HD12 H 1 0.876 . . . . . . . 119 LEU HD12 . 26012 1 946 . 1 1 121 121 LEU HD13 H 1 0.876 . . . . . . . 119 LEU HD13 . 26012 1 947 . 1 1 121 121 LEU HD21 H 1 0.818 . . . . . . . 119 LEU HD21 . 26012 1 948 . 1 1 121 121 LEU HD22 H 1 0.818 . . . . . . . 119 LEU HD22 . 26012 1 949 . 1 1 121 121 LEU HD23 H 1 0.818 . . . . . . . 119 LEU HD23 . 26012 1 950 . 1 1 121 121 LEU C C 13 177.515 . . . . . . . 119 LEU C . 26012 1 951 . 1 1 121 121 LEU CA C 13 55.614 . . . . . . . 119 LEU CA . 26012 1 952 . 1 1 121 121 LEU CB C 13 42.303 . . . . . . . 119 LEU CB . 26012 1 953 . 1 1 121 121 LEU CD1 C 13 25.005 . . . . . . . 119 LEU CD1 . 26012 1 954 . 1 1 121 121 LEU CD2 C 13 23.487 . . . . . . . 119 LEU CD2 . 26012 1 955 . 1 1 121 121 LEU N N 15 123.480 . . . . . . . 119 LEU N . 26012 1 956 . 1 1 122 122 SER H H 1 8.174 . . . . . . . 120 SER H . 26012 1 957 . 1 1 122 122 SER HA H 1 4.420 . . . . . . . 120 SER HA . 26012 1 958 . 1 1 122 122 SER C C 13 174.899 . . . . . . . 120 SER C . 26012 1 959 . 1 1 122 122 SER CA C 13 58.470 . . . . . . . 120 SER CA . 26012 1 960 . 1 1 122 122 SER CB C 13 63.782 . . . . . . . 120 SER CB . 26012 1 961 . 1 1 122 122 SER N N 15 116.033 . . . . . . . 120 SER N . 26012 1 962 . 1 1 123 123 LYS C C 13 176.462 . . . . . . . 121 LYS C . 26012 1 963 . 1 1 123 123 LYS CA C 13 56.754 . . . . . . . 121 LYS CA . 26012 1 964 . 1 1 123 123 LYS CB C 13 32.875 . . . . . . . 121 LYS CB . 26012 1 965 . 1 1 124 124 ASP H H 1 8.223 . . . . . . . 122 ASP H . 26012 1 966 . 1 1 124 124 ASP C C 13 176.604 . . . . . . . 122 ASP C . 26012 1 967 . 1 1 124 124 ASP CA C 13 54.709 . . . . . . . 122 ASP CA . 26012 1 968 . 1 1 124 124 ASP CB C 13 41.381 . . . . . . . 122 ASP CB . 26012 1 969 . 1 1 124 124 ASP N N 15 120.331 . . . . . . . 122 ASP N . 26012 1 970 . 1 1 125 125 GLY H H 1 8.180 . . . . . . . 123 GLY H . 26012 1 971 . 1 1 125 125 GLY C C 13 173.961 . . . . . . . 123 GLY C . 26012 1 972 . 1 1 125 125 GLY CA C 13 45.565 . . . . . . . 123 GLY CA . 26012 1 973 . 1 1 125 125 GLY N N 15 108.529 . . . . . . . 123 GLY N . 26012 1 974 . 1 1 126 126 PHE H H 1 8.065 . . . . . . . 124 PHE H . 26012 1 975 . 1 1 126 126 PHE HB2 H 1 3.218 . . . . . . . 124 PHE HB2 . 26012 1 976 . 1 1 126 126 PHE HB3 H 1 3.017 . . . . . . . 124 PHE HB3 . 26012 1 977 . 1 1 126 126 PHE C C 13 175.713 . . . . . . . 124 PHE C . 26012 1 978 . 1 1 126 126 PHE CA C 13 57.827 . . . . . . . 124 PHE CA . 26012 1 979 . 1 1 126 126 PHE CB C 13 39.789 . . . . . . . 124 PHE CB . 26012 1 980 . 1 1 126 126 PHE N N 15 119.571 . . . . . . . 124 PHE N . 26012 1 981 . 1 1 127 127 SER C C 13 173.280 . . . . . . . 125 SER C . 26012 1 982 . 1 1 127 127 SER CA C 13 58.457 . . . . . . . 125 SER CA . 26012 1 983 . 1 1 127 127 SER CB C 13 64.099 . . . . . . . 125 SER CB . 26012 1 984 . 1 1 128 128 LYS H H 1 7.911 . . . . . . . 126 LYS H . 26012 1 985 . 1 1 128 128 LYS HA H 1 4.146 . . . . . . . 126 LYS HA . 26012 1 986 . 1 1 128 128 LYS C C 13 167.184 . . . . . . . 126 LYS C . 26012 1 987 . 1 1 128 128 LYS CA C 13 57.895 . . . . . . . 126 LYS CA . 26012 1 988 . 1 1 128 128 LYS CB C 13 33.759 . . . . . . . 126 LYS CB . 26012 1 989 . 1 1 128 128 LYS N N 15 128.164 . . . . . . . 126 LYS N . 26012 1 990 . 1 1 130 130 MET HE1 H 1 2.029 . . . . . . . 128 MET HE . 26012 1 991 . 1 1 130 130 MET HE2 H 1 2.029 . . . . . . . 128 MET HE . 26012 1 992 . 1 1 130 130 MET HE3 H 1 2.029 . . . . . . . 128 MET HE . 26012 1 993 . 1 1 130 130 MET CE C 13 17.002 . . . . . . . 128 MET CE . 26012 1 994 . 1 1 154 154 VAL HG11 H 1 1.031 . . . . . . . 152 VAL HG1 . 26012 1 995 . 1 1 154 154 VAL HG12 H 1 1.031 . . . . . . . 152 VAL HG1 . 26012 1 996 . 1 1 154 154 VAL HG13 H 1 1.031 . . . . . . . 152 VAL HG1 . 26012 1 997 . 1 1 154 154 VAL HG21 H 1 0.871 . . . . . . . 152 VAL HG2 . 26012 1 998 . 1 1 154 154 VAL HG22 H 1 0.871 . . . . . . . 152 VAL HG2 . 26012 1 999 . 1 1 154 154 VAL HG23 H 1 0.871 . . . . . . . 152 VAL HG2 . 26012 1 1000 . 1 1 154 154 VAL CG1 C 13 12.071 . . . . . . . 152 VAL CG1 . 26012 1 1001 . 1 1 154 154 VAL CG2 C 13 11.489 . . . . . . . 152 VAL CG2 . 26012 1 1002 . 1 1 161 161 ILE HD11 H 1 0.611 . . . . . . . 159 ILE HD . 26012 1 1003 . 1 1 161 161 ILE HD12 H 1 0.611 . . . . . . . 159 ILE HD . 26012 1 1004 . 1 1 161 161 ILE HD13 H 1 0.611 . . . . . . . 159 ILE HD . 26012 1 1005 . 1 1 161 161 ILE CD1 C 13 13.730 . . . . . . . 159 ILE CD . 26012 1 1006 . 1 1 166 166 MET HE1 H 1 1.982 . . . . . . . 164 MET HE . 26012 1 1007 . 1 1 166 166 MET HE2 H 1 1.982 . . . . . . . 164 MET HE . 26012 1 1008 . 1 1 166 166 MET HE3 H 1 1.982 . . . . . . . 164 MET HE . 26012 1 1009 . 1 1 166 166 MET CE C 13 17.013 . . . . . . . 164 MET CE . 26012 1 1010 . 1 1 167 167 LEU HD11 H 1 0.688 . . . . . . . 165 LEU HD1 . 26012 1 1011 . 1 1 167 167 LEU HD12 H 1 0.688 . . . . . . . 165 LEU HD1 . 26012 1 1012 . 1 1 167 167 LEU HD13 H 1 0.688 . . . . . . . 165 LEU HD1 . 26012 1 1013 . 1 1 167 167 LEU HD21 H 1 0.567 . . . . . . . 165 LEU HD2 . 26012 1 1014 . 1 1 167 167 LEU HD22 H 1 0.567 . . . . . . . 165 LEU HD2 . 26012 1 1015 . 1 1 167 167 LEU HD23 H 1 0.567 . . . . . . . 165 LEU HD2 . 26012 1 1016 . 1 1 167 167 LEU CD1 C 13 26.550 . . . . . . . 165 LEU CD1 . 26012 1 1017 . 1 1 167 167 LEU CD2 C 13 21.696 . . . . . . . 165 LEU CD2 . 26012 1 1018 . 1 1 177 177 LEU HD11 H 1 0.736 . . . . . . . 175 LEU HD1 . 26012 1 1019 . 1 1 177 177 LEU HD12 H 1 0.736 . . . . . . . 175 LEU HD1 . 26012 1 1020 . 1 1 177 177 LEU HD13 H 1 0.736 . . . . . . . 175 LEU HD1 . 26012 1 1021 . 1 1 177 177 LEU HD21 H 1 -0.014 . . . . . . . 175 LEU HD2 . 26012 1 1022 . 1 1 177 177 LEU HD22 H 1 -0.014 . . . . . . . 175 LEU HD2 . 26012 1 1023 . 1 1 177 177 LEU HD23 H 1 -0.014 . . . . . . . 175 LEU HD2 . 26012 1 1024 . 1 1 177 177 LEU CD1 C 13 24.816 . . . . . . . 175 LEU CD1 . 26012 1 1025 . 1 1 177 177 LEU CD2 C 13 10.193 . . . . . . . 175 LEU CD2 . 26012 1 1026 . 1 1 181 181 VAL HG11 H 1 1.067 . . . . . . . 179 VAL HG1 . 26012 1 1027 . 1 1 181 181 VAL HG12 H 1 1.067 . . . . . . . 179 VAL HG1 . 26012 1 1028 . 1 1 181 181 VAL HG13 H 1 1.067 . . . . . . . 179 VAL HG1 . 26012 1 1029 . 1 1 181 181 VAL HG21 H 1 1.068 . . . . . . . 179 VAL HG2 . 26012 1 1030 . 1 1 181 181 VAL HG22 H 1 1.068 . . . . . . . 179 VAL HG2 . 26012 1 1031 . 1 1 181 181 VAL HG23 H 1 1.068 . . . . . . . 179 VAL HG2 . 26012 1 1032 . 1 1 181 181 VAL CG1 C 13 21.907 . . . . . . . 179 VAL CG1 . 26012 1 1033 . 1 1 181 181 VAL CG2 C 13 20.703 . . . . . . . 179 VAL CG2 . 26012 1 1034 . 1 1 183 183 LEU HD11 H 1 0.631 . . . . . . . 181 LEU HD1 . 26012 1 1035 . 1 1 183 183 LEU HD12 H 1 0.631 . . . . . . . 181 LEU HD1 . 26012 1 1036 . 1 1 183 183 LEU HD13 H 1 0.631 . . . . . . . 181 LEU HD1 . 26012 1 1037 . 1 1 183 183 LEU HD21 H 1 0.541 . . . . . . . 181 LEU HD2 . 26012 1 1038 . 1 1 183 183 LEU HD22 H 1 0.541 . . . . . . . 181 LEU HD2 . 26012 1 1039 . 1 1 183 183 LEU HD23 H 1 0.541 . . . . . . . 181 LEU HD2 . 26012 1 1040 . 1 1 183 183 LEU CD1 C 13 27.007 . . . . . . . 181 LEU CD1 . 26012 1 1041 . 1 1 183 183 LEU CD2 C 13 21.669 . . . . . . . 181 LEU CD2 . 26012 1 1042 . 1 1 184 184 VAL HG11 H 1 0.704 . . . . . . . 182 VAL HG1 . 26012 1 1043 . 1 1 184 184 VAL HG12 H 1 0.704 . . . . . . . 182 VAL HG1 . 26012 1 1044 . 1 1 184 184 VAL HG13 H 1 0.704 . . . . . . . 182 VAL HG1 . 26012 1 1045 . 1 1 184 184 VAL HG21 H 1 0.321 . . . . . . . 182 VAL HG2 . 26012 1 1046 . 1 1 184 184 VAL HG22 H 1 0.321 . . . . . . . 182 VAL HG2 . 26012 1 1047 . 1 1 184 184 VAL HG23 H 1 0.321 . . . . . . . 182 VAL HG2 . 26012 1 1048 . 1 1 184 184 VAL CG1 C 13 23.736 . . . . . . . 182 VAL CG1 . 26012 1 1049 . 1 1 184 184 VAL CG2 C 13 21.843 . . . . . . . 182 VAL CG2 . 26012 1 1050 . 1 1 189 189 ALA HB1 H 1 1.458 . . . . . . . 187 ALA HB . 26012 1 1051 . 1 1 189 189 ALA HB2 H 1 1.458 . . . . . . . 187 ALA HB . 26012 1 1052 . 1 1 189 189 ALA HB3 H 1 1.458 . . . . . . . 187 ALA HB . 26012 1 1053 . 1 1 189 189 ALA CB C 13 17.775 . . . . . . . 187 ALA CB . 26012 1 1054 . 1 1 192 192 LEU HD11 H 1 1.110 . . . . . . . 190 LEU HD1 . 26012 1 1055 . 1 1 192 192 LEU HD12 H 1 1.110 . . . . . . . 190 LEU HD1 . 26012 1 1056 . 1 1 192 192 LEU HD13 H 1 1.110 . . . . . . . 190 LEU HD1 . 26012 1 1057 . 1 1 192 192 LEU HD21 H 1 1.409 . . . . . . . 190 LEU HD2 . 26012 1 1058 . 1 1 192 192 LEU HD22 H 1 1.409 . . . . . . . 190 LEU HD2 . 26012 1 1059 . 1 1 192 192 LEU HD23 H 1 1.409 . . . . . . . 190 LEU HD2 . 26012 1 1060 . 1 1 192 192 LEU CD1 C 13 26.668 . . . . . . . 190 LEU CD1 . 26012 1 1061 . 1 1 192 192 LEU CD2 C 13 23.421 . . . . . . . 190 LEU CD2 . 26012 1 1062 . 1 1 193 193 VAL HG11 H 1 1.210 . . . . . . . 191 VAL HG1 . 26012 1 1063 . 1 1 193 193 VAL HG12 H 1 1.210 . . . . . . . 191 VAL HG1 . 26012 1 1064 . 1 1 193 193 VAL HG13 H 1 1.210 . . . . . . . 191 VAL HG1 . 26012 1 1065 . 1 1 193 193 VAL HG21 H 1 1.045 . . . . . . . 191 VAL HG2 . 26012 1 1066 . 1 1 193 193 VAL HG22 H 1 1.045 . . . . . . . 191 VAL HG2 . 26012 1 1067 . 1 1 193 193 VAL HG23 H 1 1.045 . . . . . . . 191 VAL HG2 . 26012 1 1068 . 1 1 193 193 VAL CG1 C 13 22.762 . . . . . . . 191 VAL CG1 . 26012 1 1069 . 1 1 193 193 VAL CG2 C 13 20.979 . . . . . . . 191 VAL CG2 . 26012 1 1070 . 1 1 194 194 ILE HD11 H 1 0.792 . . . . . . . 192 ILE HD . 26012 1 1071 . 1 1 194 194 ILE HD12 H 1 0.792 . . . . . . . 192 ILE HD . 26012 1 1072 . 1 1 194 194 ILE HD13 H 1 0.792 . . . . . . . 192 ILE HD . 26012 1 1073 . 1 1 194 194 ILE CD1 C 13 11.865 . . . . . . . 192 ILE CD . 26012 1 1074 . 1 1 197 197 ILE HD11 H 1 0.812 . . . . . . . 195 ILE HD . 26012 1 1075 . 1 1 197 197 ILE HD12 H 1 0.812 . . . . . . . 195 ILE HD . 26012 1 1076 . 1 1 197 197 ILE HD13 H 1 0.812 . . . . . . . 195 ILE HD . 26012 1 1077 . 1 1 197 197 ILE CD1 C 13 14.374 . . . . . . . 195 ILE CD . 26012 1 1078 . 1 1 199 199 LEU HD11 H 1 -0.327 . . . . . . . 197 LEU HD1 . 26012 1 1079 . 1 1 199 199 LEU HD12 H 1 -0.327 . . . . . . . 197 LEU HD1 . 26012 1 1080 . 1 1 199 199 LEU HD13 H 1 -0.327 . . . . . . . 197 LEU HD1 . 26012 1 1081 . 1 1 199 199 LEU HD21 H 1 0.813 . . . . . . . 197 LEU HD2 . 26012 1 1082 . 1 1 199 199 LEU HD22 H 1 0.813 . . . . . . . 197 LEU HD2 . 26012 1 1083 . 1 1 199 199 LEU HD23 H 1 0.813 . . . . . . . 197 LEU HD2 . 26012 1 1084 . 1 1 199 199 LEU CD1 C 13 12.174 . . . . . . . 197 LEU CD1 . 26012 1 1085 . 1 1 199 199 LEU CD2 C 13 23.441 . . . . . . . 197 LEU CD2 . 26012 1 1086 . 1 1 201 201 VAL HG11 H 1 1.137 . . . . . . . 199 VAL HG1 . 26012 1 1087 . 1 1 201 201 VAL HG12 H 1 1.137 . . . . . . . 199 VAL HG1 . 26012 1 1088 . 1 1 201 201 VAL HG13 H 1 1.137 . . . . . . . 199 VAL HG1 . 26012 1 1089 . 1 1 201 201 VAL HG21 H 1 0.930 . . . . . . . 199 VAL HG2 . 26012 1 1090 . 1 1 201 201 VAL HG22 H 1 0.930 . . . . . . . 199 VAL HG2 . 26012 1 1091 . 1 1 201 201 VAL HG23 H 1 0.930 . . . . . . . 199 VAL HG2 . 26012 1 1092 . 1 1 201 201 VAL CG1 C 13 24.232 . . . . . . . 199 VAL CG1 . 26012 1 1093 . 1 1 201 201 VAL CG2 C 13 21.311 . . . . . . . 199 VAL CG2 . 26012 1 1094 . 1 1 206 206 ALA HB1 H 1 1.373 . . . . . . . 204 ALA HB . 26012 1 1095 . 1 1 206 206 ALA HB2 H 1 1.373 . . . . . . . 204 ALA HB . 26012 1 1096 . 1 1 206 206 ALA HB3 H 1 1.373 . . . . . . . 204 ALA HB . 26012 1 1097 . 1 1 206 206 ALA CB C 13 17.426 . . . . . . . 204 ALA CB . 26012 1 1098 . 1 1 207 207 LEU HD11 H 1 0.809 . . . . . . . 205 LEU HD1 . 26012 1 1099 . 1 1 207 207 LEU HD12 H 1 0.809 . . . . . . . 205 LEU HD1 . 26012 1 1100 . 1 1 207 207 LEU HD13 H 1 0.809 . . . . . . . 205 LEU HD1 . 26012 1 1101 . 1 1 207 207 LEU HD21 H 1 0.856 . . . . . . . 205 LEU HD2 . 26012 1 1102 . 1 1 207 207 LEU HD22 H 1 0.856 . . . . . . . 205 LEU HD2 . 26012 1 1103 . 1 1 207 207 LEU HD23 H 1 0.856 . . . . . . . 205 LEU HD2 . 26012 1 1104 . 1 1 207 207 LEU CD1 C 13 24.242 . . . . . . . 205 LEU CD1 . 26012 1 1105 . 1 1 207 207 LEU CD2 C 13 24.087 . . . . . . . 205 LEU CD2 . 26012 1 1106 . 1 1 208 208 MET HE1 H 1 1.937 . . . . . . . 206 MET HE . 26012 1 1107 . 1 1 208 208 MET HE2 H 1 1.937 . . . . . . . 206 MET HE . 26012 1 1108 . 1 1 208 208 MET HE3 H 1 1.937 . . . . . . . 206 MET HE . 26012 1 1109 . 1 1 208 208 MET CE C 13 18.389 . . . . . . . 206 MET CE . 26012 1 1110 . 1 1 211 211 VAL HG11 H 1 0.814 . . . . . . . 209 VAL HG1 . 26012 1 1111 . 1 1 211 211 VAL HG12 H 1 0.814 . . . . . . . 209 VAL HG1 . 26012 1 1112 . 1 1 211 211 VAL HG13 H 1 0.814 . . . . . . . 209 VAL HG1 . 26012 1 1113 . 1 1 211 211 VAL HG21 H 1 0.012 . . . . . . . 209 VAL HG2 . 26012 1 1114 . 1 1 211 211 VAL HG22 H 1 0.012 . . . . . . . 209 VAL HG2 . 26012 1 1115 . 1 1 211 211 VAL HG23 H 1 0.012 . . . . . . . 209 VAL HG2 . 26012 1 1116 . 1 1 211 211 VAL CG1 C 13 24.389 . . . . . . . 209 VAL CG1 . 26012 1 1117 . 1 1 211 211 VAL CG2 C 13 21.757 . . . . . . . 209 VAL CG2 . 26012 1 1118 . 1 1 212 212 ALA HB1 H 1 1.650 . . . . . . . 210 ALA HB . 26012 1 1119 . 1 1 212 212 ALA HB2 H 1 1.650 . . . . . . . 210 ALA HB . 26012 1 1120 . 1 1 212 212 ALA HB3 H 1 1.650 . . . . . . . 210 ALA HB . 26012 1 1121 . 1 1 212 212 ALA CB C 13 18.522 . . . . . . . 210 ALA CB . 26012 1 1122 . 1 1 216 216 ILE HD11 H 1 0.153 . . . . . . . 214 ILE HD . 26012 1 1123 . 1 1 216 216 ILE HD12 H 1 0.153 . . . . . . . 214 ILE HD . 26012 1 1124 . 1 1 216 216 ILE HD13 H 1 0.153 . . . . . . . 214 ILE HD . 26012 1 1125 . 1 1 216 216 ILE CD1 C 13 7.424 . . . . . . . 214 ILE CD . 26012 1 1126 . 1 1 217 217 VAL HG11 H 1 1.421 . . . . . . . 215 VAL HG1 . 26012 1 1127 . 1 1 217 217 VAL HG12 H 1 1.421 . . . . . . . 215 VAL HG1 . 26012 1 1128 . 1 1 217 217 VAL HG13 H 1 1.421 . . . . . . . 215 VAL HG1 . 26012 1 1129 . 1 1 217 217 VAL HG21 H 1 1.129 . . . . . . . 215 VAL HG2 . 26012 1 1130 . 1 1 217 217 VAL HG22 H 1 1.129 . . . . . . . 215 VAL HG2 . 26012 1 1131 . 1 1 217 217 VAL HG23 H 1 1.129 . . . . . . . 215 VAL HG2 . 26012 1 1132 . 1 1 217 217 VAL CG1 C 13 24.244 . . . . . . . 215 VAL CG1 . 26012 1 1133 . 1 1 217 217 VAL CG2 C 13 11.375 . . . . . . . 215 VAL CG2 . 26012 1 1134 . 1 1 218 218 MET HE1 H 1 1.607 . . . . . . . 216 MET HE . 26012 1 1135 . 1 1 218 218 MET HE2 H 1 1.607 . . . . . . . 216 MET HE . 26012 1 1136 . 1 1 218 218 MET HE3 H 1 1.607 . . . . . . . 216 MET HE . 26012 1 1137 . 1 1 218 218 MET CE C 13 15.552 . . . . . . . 216 MET CE . 26012 1 1138 . 1 1 221 221 ILE HD11 H 1 0.815 . . . . . . . 219 ILE HD . 26012 1 1139 . 1 1 221 221 ILE HD12 H 1 0.815 . . . . . . . 219 ILE HD . 26012 1 1140 . 1 1 221 221 ILE HD13 H 1 0.815 . . . . . . . 219 ILE HD . 26012 1 1141 . 1 1 221 221 ILE CD1 C 13 14.569 . . . . . . . 219 ILE CD . 26012 1 1142 . 1 1 222 222 LEU HD11 H 1 0.698 . . . . . . . 220 LEU HD1 . 26012 1 1143 . 1 1 222 222 LEU HD12 H 1 0.698 . . . . . . . 220 LEU HD1 . 26012 1 1144 . 1 1 222 222 LEU HD13 H 1 0.698 . . . . . . . 220 LEU HD1 . 26012 1 1145 . 1 1 222 222 LEU HD21 H 1 0.597 . . . . . . . 220 LEU HD2 . 26012 1 1146 . 1 1 222 222 LEU HD22 H 1 0.597 . . . . . . . 220 LEU HD2 . 26012 1 1147 . 1 1 222 222 LEU HD23 H 1 0.597 . . . . . . . 220 LEU HD2 . 26012 1 1148 . 1 1 222 222 LEU CD1 C 13 25.898 . . . . . . . 220 LEU CD1 . 26012 1 1149 . 1 1 222 222 LEU CD2 C 13 21.279 . . . . . . . 220 LEU CD2 . 26012 1 1150 . 1 1 224 224 LEU HD11 H 1 0.877 . . . . . . . 222 LEU HD1 . 26012 1 1151 . 1 1 224 224 LEU HD12 H 1 0.877 . . . . . . . 222 LEU HD1 . 26012 1 1152 . 1 1 224 224 LEU HD13 H 1 0.877 . . . . . . . 222 LEU HD1 . 26012 1 1153 . 1 1 224 224 LEU HD21 H 1 0.915 . . . . . . . 222 LEU HD2 . 26012 1 1154 . 1 1 224 224 LEU HD22 H 1 0.915 . . . . . . . 222 LEU HD2 . 26012 1 1155 . 1 1 224 224 LEU HD23 H 1 0.915 . . . . . . . 222 LEU HD2 . 26012 1 1156 . 1 1 224 224 LEU CD1 C 13 26.175 . . . . . . . 222 LEU CD1 . 26012 1 1157 . 1 1 224 224 LEU CD2 C 13 23.127 . . . . . . . 222 LEU CD2 . 26012 1 1158 . 1 1 225 225 ALA HB1 H 1 1.492 . . . . . . . 223 ALA HB . 26012 1 1159 . 1 1 225 225 ALA HB2 H 1 1.492 . . . . . . . 223 ALA HB . 26012 1 1160 . 1 1 225 225 ALA HB3 H 1 1.492 . . . . . . . 223 ALA HB . 26012 1 1161 . 1 1 225 225 ALA CB C 13 18.429 . . . . . . . 223 ALA CB . 26012 1 1162 . 1 1 228 228 LEU HD11 H 1 0.770 . . . . . . . 226 LEU HD1 . 26012 1 1163 . 1 1 228 228 LEU HD12 H 1 0.770 . . . . . . . 226 LEU HD1 . 26012 1 1164 . 1 1 228 228 LEU HD13 H 1 0.770 . . . . . . . 226 LEU HD1 . 26012 1 1165 . 1 1 228 228 LEU HD21 H 1 0.800 . . . . . . . 226 LEU HD2 . 26012 1 1166 . 1 1 228 228 LEU HD22 H 1 0.800 . . . . . . . 226 LEU HD2 . 26012 1 1167 . 1 1 228 228 LEU HD23 H 1 0.800 . . . . . . . 226 LEU HD2 . 26012 1 1168 . 1 1 228 228 LEU CD1 C 13 25.160 . . . . . . . 226 LEU CD1 . 26012 1 1169 . 1 1 228 228 LEU CD2 C 13 21.740 . . . . . . . 226 LEU CD2 . 26012 1 1170 . 1 1 230 230 VAL HG11 H 1 0.884 . . . . . . . 228 VAL HG1 . 26012 1 1171 . 1 1 230 230 VAL HG12 H 1 0.884 . . . . . . . 228 VAL HG1 . 26012 1 1172 . 1 1 230 230 VAL HG13 H 1 0.884 . . . . . . . 228 VAL HG1 . 26012 1 1173 . 1 1 230 230 VAL HG21 H 1 0.772 . . . . . . . 228 VAL HG2 . 26012 1 1174 . 1 1 230 230 VAL HG22 H 1 0.772 . . . . . . . 228 VAL HG2 . 26012 1 1175 . 1 1 230 230 VAL HG23 H 1 0.772 . . . . . . . 228 VAL HG2 . 26012 1 1176 . 1 1 230 230 VAL CG1 C 13 21.285 . . . . . . . 228 VAL CG1 . 26012 1 1177 . 1 1 230 230 VAL CG2 C 13 19.468 . . . . . . . 228 VAL CG2 . 26012 1 1178 . 1 1 234 234 ALA HB1 H 1 1.545 . . . . . . . 232 ALA HB . 26012 1 1179 . 1 1 234 234 ALA HB2 H 1 1.545 . . . . . . . 232 ALA HB . 26012 1 1180 . 1 1 234 234 ALA HB3 H 1 1.545 . . . . . . . 232 ALA HB . 26012 1 1181 . 1 1 234 234 ALA CB C 13 19.500 . . . . . . . 232 ALA CB . 26012 1 1182 . 1 1 243 243 ILE HD11 H 1 -0.050 . . . . . . . 241 ILE HD . 26012 1 1183 . 1 1 243 243 ILE HD12 H 1 -0.050 . . . . . . . 241 ILE HD . 26012 1 1184 . 1 1 243 243 ILE HD13 H 1 -0.050 . . . . . . . 241 ILE HD . 26012 1 1185 . 1 1 243 243 ILE CD1 C 13 12.239 . . . . . . . 241 ILE CD . 26012 1 1186 . 1 1 246 246 ALA HB1 H 1 1.393 . . . . . . . 244 ALA HB . 26012 1 1187 . 1 1 246 246 ALA HB2 H 1 1.393 . . . . . . . 244 ALA HB . 26012 1 1188 . 1 1 246 246 ALA HB3 H 1 1.393 . . . . . . . 244 ALA HB . 26012 1 1189 . 1 1 246 246 ALA CB C 13 18.658 . . . . . . . 244 ALA CB . 26012 1 1190 . 1 1 251 251 MET HE1 H 1 2.077 . . . . . . . 249 MET HE . 26012 1 1191 . 1 1 251 251 MET HE2 H 1 2.077 . . . . . . . 249 MET HE . 26012 1 1192 . 1 1 251 251 MET HE3 H 1 2.077 . . . . . . . 249 MET HE . 26012 1 1193 . 1 1 251 251 MET CE C 13 16.640 . . . . . . . 249 MET CE . 26012 1 1194 . 1 1 258 258 LEU HD11 H 1 1.182 . . . . . . . 256 LEU HD1 . 26012 1 1195 . 1 1 258 258 LEU HD12 H 1 1.182 . . . . . . . 256 LEU HD1 . 26012 1 1196 . 1 1 258 258 LEU HD13 H 1 1.182 . . . . . . . 256 LEU HD1 . 26012 1 1197 . 1 1 258 258 LEU HD21 H 1 0.952 . . . . . . . 256 LEU HD2 . 26012 1 1198 . 1 1 258 258 LEU HD22 H 1 0.952 . . . . . . . 256 LEU HD2 . 26012 1 1199 . 1 1 258 258 LEU HD23 H 1 0.952 . . . . . . . 256 LEU HD2 . 26012 1 1200 . 1 1 258 258 LEU CD1 C 13 26.432 . . . . . . . 256 LEU CD1 . 26012 1 1201 . 1 1 258 258 LEU CD2 C 13 22.553 . . . . . . . 256 LEU CD2 . 26012 1 1202 . 1 1 260 260 ALA HB1 H 1 1.500 . . . . . . . 258 ALA HB . 26012 1 1203 . 1 1 260 260 ALA HB2 H 1 1.500 . . . . . . . 258 ALA HB . 26012 1 1204 . 1 1 260 260 ALA HB3 H 1 1.500 . . . . . . . 258 ALA HB . 26012 1 1205 . 1 1 260 260 ALA CB C 13 17.925 . . . . . . . 258 ALA CB . 26012 1 1206 . 1 1 265 265 VAL HG11 H 1 0.206 . . . . . . . 263 VAL HG1 . 26012 1 1207 . 1 1 265 265 VAL HG12 H 1 0.206 . . . . . . . 263 VAL HG1 . 26012 1 1208 . 1 1 265 265 VAL HG13 H 1 0.206 . . . . . . . 263 VAL HG1 . 26012 1 1209 . 1 1 265 265 VAL HG21 H 1 0.629 . . . . . . . 263 VAL HG2 . 26012 1 1210 . 1 1 265 265 VAL HG22 H 1 0.629 . . . . . . . 263 VAL HG2 . 26012 1 1211 . 1 1 265 265 VAL HG23 H 1 0.629 . . . . . . . 263 VAL HG2 . 26012 1 1212 . 1 1 265 265 VAL CG1 C 13 23.253 . . . . . . . 263 VAL CG1 . 26012 1 1213 . 1 1 265 265 VAL CG2 C 13 21.164 . . . . . . . 263 VAL CG2 . 26012 1 1214 . 1 1 269 269 ALA HB1 H 1 1.476 . . . . . . . 267 ALA HB . 26012 1 1215 . 1 1 269 269 ALA HB2 H 1 1.476 . . . . . . . 267 ALA HB . 26012 1 1216 . 1 1 269 269 ALA HB3 H 1 1.476 . . . . . . . 267 ALA HB . 26012 1 1217 . 1 1 269 269 ALA CB C 13 19.269 . . . . . . . 267 ALA CB . 26012 1 1218 . 1 1 271 271 LEU HD11 H 1 0.913 . . . . . . . 269 LEU HD1 . 26012 1 1219 . 1 1 271 271 LEU HD12 H 1 0.913 . . . . . . . 269 LEU HD1 . 26012 1 1220 . 1 1 271 271 LEU HD13 H 1 0.913 . . . . . . . 269 LEU HD1 . 26012 1 1221 . 1 1 271 271 LEU HD21 H 1 0.877 . . . . . . . 269 LEU HD2 . 26012 1 1222 . 1 1 271 271 LEU HD22 H 1 0.877 . . . . . . . 269 LEU HD2 . 26012 1 1223 . 1 1 271 271 LEU HD23 H 1 0.877 . . . . . . . 269 LEU HD2 . 26012 1 1224 . 1 1 271 271 LEU CD1 C 13 24.966 . . . . . . . 269 LEU CD1 . 26012 1 1225 . 1 1 271 271 LEU CD2 C 13 23.296 . . . . . . . 269 LEU CD2 . 26012 1 1226 . 1 1 273 273 ILE HD11 H 1 0.919 . . . . . . . 271 ILE HD . 26012 1 1227 . 1 1 273 273 ILE HD12 H 1 0.919 . . . . . . . 271 ILE HD . 26012 1 1228 . 1 1 273 273 ILE HD13 H 1 0.919 . . . . . . . 271 ILE HD . 26012 1 1229 . 1 1 273 273 ILE CD1 C 13 13.281 . . . . . . . 271 ILE CD . 26012 1 1230 . 1 1 276 276 ALA HB1 H 1 1.504 . . . . . . . 274 ALA HB . 26012 1 1231 . 1 1 276 276 ALA HB2 H 1 1.504 . . . . . . . 274 ALA HB . 26012 1 1232 . 1 1 276 276 ALA HB3 H 1 1.504 . . . . . . . 274 ALA HB . 26012 1 1233 . 1 1 276 276 ALA CB C 13 18.006 . . . . . . . 274 ALA CB . 26012 1 1234 . 1 1 277 277 MET HE1 H 1 2.065 . . . . . . . 275 MET HE . 26012 1 1235 . 1 1 277 277 MET HE2 H 1 2.065 . . . . . . . 275 MET HE . 26012 1 1236 . 1 1 277 277 MET HE3 H 1 2.065 . . . . . . . 275 MET HE . 26012 1 1237 . 1 1 277 277 MET CE C 13 16.886 . . . . . . . 275 MET CE . 26012 1 1238 . 1 1 289 289 LEU HD21 H 1 0.808 . . . . . . . 287 LEU HD2 . 26012 1 1239 . 1 1 289 289 LEU HD22 H 1 0.808 . . . . . . . 287 LEU HD2 . 26012 1 1240 . 1 1 289 289 LEU HD23 H 1 0.808 . . . . . . . 287 LEU HD2 . 26012 1 1241 . 1 1 289 289 LEU CD2 C 13 22.581 . . . . . . . 287 LEU CD2 . 26012 1 1242 . 1 1 294 294 LEU HD11 H 1 0.910 . . . . . . . 292 LEU HD1 . 26012 1 1243 . 1 1 294 294 LEU HD12 H 1 0.910 . . . . . . . 292 LEU HD1 . 26012 1 1244 . 1 1 294 294 LEU HD13 H 1 0.910 . . . . . . . 292 LEU HD1 . 26012 1 1245 . 1 1 294 294 LEU HD21 H 1 0.822 . . . . . . . 292 LEU HD2 . 26012 1 1246 . 1 1 294 294 LEU HD22 H 1 0.822 . . . . . . . 292 LEU HD2 . 26012 1 1247 . 1 1 294 294 LEU HD23 H 1 0.822 . . . . . . . 292 LEU HD2 . 26012 1 1248 . 1 1 294 294 LEU CD1 C 13 26.297 . . . . . . . 292 LEU CD1 . 26012 1 1249 . 1 1 294 294 LEU CD2 C 13 23.224 . . . . . . . 292 LEU CD2 . 26012 1 1250 . 1 1 297 297 VAL HG11 H 1 0.909 . . . . . . . 295 VAL HG1 . 26012 1 1251 . 1 1 297 297 VAL HG12 H 1 0.909 . . . . . . . 295 VAL HG1 . 26012 1 1252 . 1 1 297 297 VAL HG13 H 1 0.909 . . . . . . . 295 VAL HG1 . 26012 1 1253 . 1 1 297 297 VAL HG21 H 1 0.900 . . . . . . . 295 VAL HG2 . 26012 1 1254 . 1 1 297 297 VAL HG22 H 1 0.900 . . . . . . . 295 VAL HG2 . 26012 1 1255 . 1 1 297 297 VAL HG23 H 1 0.900 . . . . . . . 295 VAL HG2 . 26012 1 1256 . 1 1 297 297 VAL CG1 C 13 22.496 . . . . . . . 295 VAL CG1 . 26012 1 1257 . 1 1 297 297 VAL CG2 C 13 20.794 . . . . . . . 295 VAL CG2 . 26012 1 1258 . 1 1 299 299 VAL HG11 H 1 0.944 . . . . . . . 297 VAL HG1 . 26012 1 1259 . 1 1 299 299 VAL HG12 H 1 0.944 . . . . . . . 297 VAL HG1 . 26012 1 1260 . 1 1 299 299 VAL HG13 H 1 0.944 . . . . . . . 297 VAL HG1 . 26012 1 1261 . 1 1 299 299 VAL HG21 H 1 0.669 . . . . . . . 297 VAL HG2 . 26012 1 1262 . 1 1 299 299 VAL HG22 H 1 0.669 . . . . . . . 297 VAL HG2 . 26012 1 1263 . 1 1 299 299 VAL HG23 H 1 0.669 . . . . . . . 297 VAL HG2 . 26012 1 1264 . 1 1 299 299 VAL CG1 C 13 23.777 . . . . . . . 297 VAL CG1 . 26012 1 1265 . 1 1 299 299 VAL CG2 C 13 22.023 . . . . . . . 297 VAL CG2 . 26012 1 1266 . 1 1 303 303 LEU HD11 H 1 0.580 . . . . . . . 301 LEU HD1 . 26012 1 1267 . 1 1 303 303 LEU HD12 H 1 0.580 . . . . . . . 301 LEU HD1 . 26012 1 1268 . 1 1 303 303 LEU HD13 H 1 0.580 . . . . . . . 301 LEU HD1 . 26012 1 1269 . 1 1 303 303 LEU HD21 H 1 0.684 . . . . . . . 301 LEU HD2 . 26012 1 1270 . 1 1 303 303 LEU HD22 H 1 0.684 . . . . . . . 301 LEU HD2 . 26012 1 1271 . 1 1 303 303 LEU HD23 H 1 0.684 . . . . . . . 301 LEU HD2 . 26012 1 1272 . 1 1 303 303 LEU CD1 C 13 26.341 . . . . . . . 301 LEU CD1 . 26012 1 1273 . 1 1 303 303 LEU CD2 C 13 22.221 . . . . . . . 301 LEU CD2 . 26012 1 1274 . 1 1 307 307 LEU HD11 H 1 0.714 . . . . . . . 305 LEU HD1 . 26012 1 1275 . 1 1 307 307 LEU HD12 H 1 0.714 . . . . . . . 305 LEU HD1 . 26012 1 1276 . 1 1 307 307 LEU HD13 H 1 0.714 . . . . . . . 305 LEU HD1 . 26012 1 1277 . 1 1 307 307 LEU HD21 H 1 0.705 . . . . . . . 305 LEU HD2 . 26012 1 1278 . 1 1 307 307 LEU HD22 H 1 0.705 . . . . . . . 305 LEU HD2 . 26012 1 1279 . 1 1 307 307 LEU HD23 H 1 0.705 . . . . . . . 305 LEU HD2 . 26012 1 1280 . 1 1 307 307 LEU CD1 C 13 25.068 . . . . . . . 305 LEU CD1 . 26012 1 1281 . 1 1 307 307 LEU CD2 C 13 23.312 . . . . . . . 305 LEU CD2 . 26012 1 1282 . 1 1 313 313 VAL HG11 H 1 0.962 . . . . . . . 311 VAL HG1 . 26012 1 1283 . 1 1 313 313 VAL HG12 H 1 0.962 . . . . . . . 311 VAL HG1 . 26012 1 1284 . 1 1 313 313 VAL HG13 H 1 0.962 . . . . . . . 311 VAL HG1 . 26012 1 1285 . 1 1 313 313 VAL HG21 H 1 1.018 . . . . . . . 311 VAL HG2 . 26012 1 1286 . 1 1 313 313 VAL HG22 H 1 1.018 . . . . . . . 311 VAL HG2 . 26012 1 1287 . 1 1 313 313 VAL HG23 H 1 1.018 . . . . . . . 311 VAL HG2 . 26012 1 1288 . 1 1 313 313 VAL CG1 C 13 21.478 . . . . . . . 311 VAL CG1 . 26012 1 1289 . 1 1 313 313 VAL CG2 C 13 19.757 . . . . . . . 311 VAL CG2 . 26012 1 1290 . 1 1 316 316 VAL HG11 H 1 1.103 . . . . . . . 314 VAL HG1 . 26012 1 1291 . 1 1 316 316 VAL HG12 H 1 1.103 . . . . . . . 314 VAL HG1 . 26012 1 1292 . 1 1 316 316 VAL HG13 H 1 1.103 . . . . . . . 314 VAL HG1 . 26012 1 1293 . 1 1 316 316 VAL HG21 H 1 1.027 . . . . . . . 314 VAL HG2 . 26012 1 1294 . 1 1 316 316 VAL HG22 H 1 1.027 . . . . . . . 314 VAL HG2 . 26012 1 1295 . 1 1 316 316 VAL HG23 H 1 1.027 . . . . . . . 314 VAL HG2 . 26012 1 1296 . 1 1 316 316 VAL CG1 C 13 21.542 . . . . . . . 314 VAL CG1 . 26012 1 1297 . 1 1 316 316 VAL CG2 C 13 21.215 . . . . . . . 314 VAL CG2 . 26012 1 1298 . 1 1 318 318 MET HE1 H 1 2.047 . . . . . . . 316 MET HE . 26012 1 1299 . 1 1 318 318 MET HE2 H 1 2.047 . . . . . . . 316 MET HE . 26012 1 1300 . 1 1 318 318 MET HE3 H 1 2.047 . . . . . . . 316 MET HE . 26012 1 1301 . 1 1 318 318 MET CE C 13 16.774 . . . . . . . 316 MET CE . 26012 1 1302 . 1 1 319 319 LEU HD11 H 1 0.014 . . . . . . . 317 LEU HD1 . 26012 1 1303 . 1 1 319 319 LEU HD12 H 1 0.014 . . . . . . . 317 LEU HD1 . 26012 1 1304 . 1 1 319 319 LEU HD13 H 1 0.014 . . . . . . . 317 LEU HD1 . 26012 1 1305 . 1 1 319 319 LEU HD21 H 1 0.449 . . . . . . . 317 LEU HD2 . 26012 1 1306 . 1 1 319 319 LEU HD22 H 1 0.449 . . . . . . . 317 LEU HD2 . 26012 1 1307 . 1 1 319 319 LEU HD23 H 1 0.449 . . . . . . . 317 LEU HD2 . 26012 1 1308 . 1 1 319 319 LEU CD1 C 13 25.124 . . . . . . . 317 LEU CD1 . 26012 1 1309 . 1 1 319 319 LEU CD2 C 13 23.553 . . . . . . . 317 LEU CD2 . 26012 1 1310 . 1 1 322 322 ALA HB1 H 1 1.285 . . . . . . . 320 ALA HB . 26012 1 1311 . 1 1 322 322 ALA HB2 H 1 1.285 . . . . . . . 320 ALA HB . 26012 1 1312 . 1 1 322 322 ALA HB3 H 1 1.285 . . . . . . . 320 ALA HB . 26012 1 1313 . 1 1 322 322 ALA CB C 13 18.304 . . . . . . . 320 ALA CB . 26012 1 1314 . 1 1 323 323 ILE HD11 H 1 0.742 . . . . . . . 321 ILE HD . 26012 1 1315 . 1 1 323 323 ILE HD12 H 1 0.742 . . . . . . . 321 ILE HD . 26012 1 1316 . 1 1 323 323 ILE HD13 H 1 0.742 . . . . . . . 321 ILE HD . 26012 1 1317 . 1 1 323 323 ILE CD1 C 13 12.229 . . . . . . . 321 ILE CD . 26012 1 1318 . 1 1 326 326 MET HE1 H 1 2.065 . . . . . . . 324 MET HE . 26012 1 1319 . 1 1 326 326 MET HE2 H 1 2.065 . . . . . . . 324 MET HE . 26012 1 1320 . 1 1 326 326 MET HE3 H 1 2.065 . . . . . . . 324 MET HE . 26012 1 1321 . 1 1 326 326 MET CE C 13 16.886 . . . . . . . 324 MET CE . 26012 1 1322 . 1 1 331 331 ALA HB1 H 1 1.519 . . . . . . . 329 ALA HB . 26012 1 1323 . 1 1 331 331 ALA HB2 H 1 1.519 . . . . . . . 329 ALA HB . 26012 1 1324 . 1 1 331 331 ALA HB3 H 1 1.519 . . . . . . . 329 ALA HB . 26012 1 1325 . 1 1 331 331 ALA CB C 13 19.287 . . . . . . . 329 ALA CB . 26012 1 1326 . 1 1 339 339 ILE HD11 H 1 0.815 . . . . . . . 337 ILE HD . 26012 1 1327 . 1 1 339 339 ILE HD12 H 1 0.815 . . . . . . . 337 ILE HD . 26012 1 1328 . 1 1 339 339 ILE HD13 H 1 0.815 . . . . . . . 337 ILE HD . 26012 1 1329 . 1 1 339 339 ILE CD1 C 13 13.250 . . . . . . . 337 ILE CD . 26012 1 1330 . 1 1 343 343 LEU HD11 H 1 0.694 . . . . . . . 341 LEU HD1 . 26012 1 1331 . 1 1 343 343 LEU HD12 H 1 0.694 . . . . . . . 341 LEU HD1 . 26012 1 1332 . 1 1 343 343 LEU HD13 H 1 0.694 . . . . . . . 341 LEU HD1 . 26012 1 1333 . 1 1 343 343 LEU HD21 H 1 0.643 . . . . . . . 341 LEU HD2 . 26012 1 1334 . 1 1 343 343 LEU HD22 H 1 0.643 . . . . . . . 341 LEU HD2 . 26012 1 1335 . 1 1 343 343 LEU HD23 H 1 0.643 . . . . . . . 341 LEU HD2 . 26012 1 1336 . 1 1 343 343 LEU CD1 C 13 24.891 . . . . . . . 341 LEU CD1 . 26012 1 1337 . 1 1 343 343 LEU CD2 C 13 24.171 . . . . . . . 341 LEU CD2 . 26012 1 1338 . 1 1 345 345 VAL HG11 H 1 0.783 . . . . . . . 343 VAL HG1 . 26012 1 1339 . 1 1 345 345 VAL HG12 H 1 0.783 . . . . . . . 343 VAL HG1 . 26012 1 1340 . 1 1 345 345 VAL HG13 H 1 0.783 . . . . . . . 343 VAL HG1 . 26012 1 1341 . 1 1 345 345 VAL HG21 H 1 0.790 . . . . . . . 343 VAL HG2 . 26012 1 1342 . 1 1 345 345 VAL HG22 H 1 0.790 . . . . . . . 343 VAL HG2 . 26012 1 1343 . 1 1 345 345 VAL HG23 H 1 0.790 . . . . . . . 343 VAL HG2 . 26012 1 1344 . 1 1 345 345 VAL CG1 C 13 21.046 . . . . . . . 343 VAL CG1 . 26012 1 1345 . 1 1 345 345 VAL CG2 C 13 20.096 . . . . . . . 343 VAL CG2 . 26012 1 1346 . 1 1 350 350 ALA HB1 H 1 1.374 . . . . . . . 348 ALA HB . 26012 1 1347 . 1 1 350 350 ALA HB2 H 1 1.374 . . . . . . . 348 ALA HB . 26012 1 1348 . 1 1 350 350 ALA HB3 H 1 1.374 . . . . . . . 348 ALA HB . 26012 1 1349 . 1 1 350 350 ALA CB C 13 19.010 . . . . . . . 348 ALA CB . 26012 1 1350 . 1 1 353 353 ALA HB1 H 1 1.342 . . . . . . . 351 ALA HB . 26012 1 1351 . 1 1 353 353 ALA HB2 H 1 1.342 . . . . . . . 351 ALA HB . 26012 1 1352 . 1 1 353 353 ALA HB3 H 1 1.342 . . . . . . . 351 ALA HB . 26012 1 1353 . 1 1 353 353 ALA CB C 13 19.086 . . . . . . . 351 ALA CB . 26012 1 1354 . 1 1 359 359 ALA HA H 1 1.374 . . . . . . . 357 ALA HA . 26012 1 1355 . 1 1 359 359 ALA CB C 13 19.397 . . . . . . . 357 ALA CB . 26012 1 1356 . 1 1 365 365 LEU HD11 H 1 0.901 . . . . . . . 363 LEU HD1 . 26012 1 1357 . 1 1 365 365 LEU HD12 H 1 0.901 . . . . . . . 363 LEU HD1 . 26012 1 1358 . 1 1 365 365 LEU HD13 H 1 0.901 . . . . . . . 363 LEU HD1 . 26012 1 1359 . 1 1 365 365 LEU HD21 H 1 0.826 . . . . . . . 363 LEU HD2 . 26012 1 1360 . 1 1 365 365 LEU HD22 H 1 0.826 . . . . . . . 363 LEU HD2 . 26012 1 1361 . 1 1 365 365 LEU HD23 H 1 0.826 . . . . . . . 363 LEU HD2 . 26012 1 1362 . 1 1 365 365 LEU CD1 C 13 24.799 . . . . . . . 363 LEU CD1 . 26012 1 1363 . 1 1 365 365 LEU CD2 C 13 23.215 . . . . . . . 363 LEU CD2 . 26012 1 1364 . 1 1 366 366 LEU HD11 H 1 0.901 . . . . . . . 364 LEU HD1 . 26012 1 1365 . 1 1 366 366 LEU HD12 H 1 0.901 . . . . . . . 364 LEU HD1 . 26012 1 1366 . 1 1 366 366 LEU HD13 H 1 0.901 . . . . . . . 364 LEU HD1 . 26012 1 1367 . 1 1 366 366 LEU HD21 H 1 0.826 . . . . . . . 364 LEU HD2 . 26012 1 1368 . 1 1 366 366 LEU HD22 H 1 0.826 . . . . . . . 364 LEU HD2 . 26012 1 1369 . 1 1 366 366 LEU HD23 H 1 0.826 . . . . . . . 364 LEU HD2 . 26012 1 1370 . 1 1 366 366 LEU CD1 C 13 24.797 . . . . . . . 364 LEU CD1 . 26012 1 1371 . 1 1 366 366 LEU CD2 C 13 23.215 . . . . . . . 364 LEU CD2 . 26012 1 1372 . 1 1 368 368 ALA HB1 H 1 1.327 . . . . . . . 366 ALA HB . 26012 1 1373 . 1 1 368 368 ALA HB2 H 1 1.327 . . . . . . . 366 ALA HB . 26012 1 1374 . 1 1 368 368 ALA HB3 H 1 1.327 . . . . . . . 366 ALA HB . 26012 1 1375 . 1 1 368 368 ALA CB C 13 19.129 . . . . . . . 366 ALA CB . 26012 1 1376 . 1 1 369 369 VAL HG11 H 1 0.907 . . . . . . . 367 VAL HG1 . 26012 1 1377 . 1 1 369 369 VAL HG12 H 1 0.907 . . . . . . . 367 VAL HG1 . 26012 1 1378 . 1 1 369 369 VAL HG13 H 1 0.907 . . . . . . . 367 VAL HG1 . 26012 1 1379 . 1 1 369 369 VAL HG21 H 1 0.927 . . . . . . . 367 VAL HG2 . 26012 1 1380 . 1 1 369 369 VAL HG22 H 1 0.927 . . . . . . . 367 VAL HG2 . 26012 1 1381 . 1 1 369 369 VAL HG23 H 1 0.927 . . . . . . . 367 VAL HG2 . 26012 1 1382 . 1 1 369 369 VAL CG1 C 13 21.108 . . . . . . . 367 VAL CG1 . 26012 1 1383 . 1 1 369 369 VAL CG2 C 13 20.284 . . . . . . . 367 VAL CG2 . 26012 1 1384 . 1 1 378 378 VAL HG11 H 1 0.956 . . . . . . . 376 VAL HG1 . 26012 1 1385 . 1 1 378 378 VAL HG12 H 1 0.956 . . . . . . . 376 VAL HG1 . 26012 1 1386 . 1 1 378 378 VAL HG13 H 1 0.956 . . . . . . . 376 VAL HG1 . 26012 1 1387 . 1 1 378 378 VAL HG21 H 1 0.895 . . . . . . . 376 VAL HG2 . 26012 1 1388 . 1 1 378 378 VAL HG22 H 1 0.895 . . . . . . . 376 VAL HG2 . 26012 1 1389 . 1 1 378 378 VAL HG23 H 1 0.895 . . . . . . . 376 VAL HG2 . 26012 1 1390 . 1 1 378 378 VAL CG1 C 13 20.879 . . . . . . . 376 VAL CG1 . 26012 1 1391 . 1 1 378 378 VAL CG2 C 13 19.908 . . . . . . . 376 VAL CG2 . 26012 1 1392 . 1 1 380 380 VAL HG11 H 1 0.877 . . . . . . . 378 VAL HG1 . 26012 1 1393 . 1 1 380 380 VAL HG12 H 1 0.877 . . . . . . . 378 VAL HG1 . 26012 1 1394 . 1 1 380 380 VAL HG13 H 1 0.877 . . . . . . . 378 VAL HG1 . 26012 1 1395 . 1 1 380 380 VAL HG21 H 1 0.853 . . . . . . . 378 VAL HG2 . 26012 1 1396 . 1 1 380 380 VAL HG22 H 1 0.853 . . . . . . . 378 VAL HG2 . 26012 1 1397 . 1 1 380 380 VAL HG23 H 1 0.853 . . . . . . . 378 VAL HG2 . 26012 1 1398 . 1 1 380 380 VAL CG1 C 13 21.446 . . . . . . . 378 VAL CG1 . 26012 1 1399 . 1 1 380 380 VAL CG2 C 13 19.870 . . . . . . . 378 VAL CG2 . 26012 1 stop_ save_