data_50707 ####################### # Entry information # ####################### save_entry_information_1 _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information_1 _Entry.ID 50707 _Entry.Title ; Backbone 1H, 13C and 15N chemical shift assignments of the N-terminal Bro1 domain of human ALIX. ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2021-01-13 _Entry.Accession_date 2021-01-13 _Entry.Last_release_date 2021-01-17 _Entry.Original_release_date 2021-01-17 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.14.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID 1 _Entry.Generated_software_label $software_1 _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 Ruben Elias . D. . 0000-0002-6702-052X 50707 2 Lalit Deshmukh . . . 0000-0001-6126-1560 50707 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 50707 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 904 50707 '15N chemical shifts' 302 50707 '1H chemical shifts' 302 50707 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 . . 2021-11-19 2021-01-13 update BMRB 'update entry citation' 50707 2 . . 2021-10-25 2021-01-13 update author 'update entry citation' 50707 1 . . 2021-10-06 2021-01-13 original author 'original release' 50707 stop_ save_ ############### # Citations # ############### save_citations_1 _Citation.Sf_category citations _Citation.Sf_framecode citations_1 _Citation.Entry_ID 50707 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 34688656 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; Mechanistic Roles of Tyrosine Phosphorylation in Reversible Amyloids, Autoinhibition, and Endosomal Membrane Association of ALIX ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biol. Chem.' _Citation.Journal_name_full . _Citation.Journal_volume 297 _Citation.Journal_issue 5 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 101328 _Citation.Page_last 101328 _Citation.Year 2021 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Ruben Elias . D. . . 50707 1 2 Bhargavi Ramaraju . . . . 50707 1 3 Lalit Deshmukh . . . . 50707 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'NMR, Intrinsically disordered protein, Post-translational modifications, Amyloids' 50707 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly_1 _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly_1 _Assembly.Entry_ID 50707 _Assembly.ID 1 _Assembly.Name 'Bro1 domain of human ALIX' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states no _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange no _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 'Bro1 domain of human ALIX' 1 $entity_1 . . yes native no no . . . 50707 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 50707 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity_1 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GHMATFISVQLKKTSEVDLA KPLVKFIQQTYPSGGEEQAQ YCRAAEELSKLRRAAVGRPL DKHEGALETLLRYYDQICSI EPKFPFSENQICLTFTWKDA FDKGSLFGGSVKLALASLGY EKSCVLFNCAALASQIAAEQ NLDNDEGLKIAAKHYQFASG AFLHIKETVLSALSREPTVD ISPDTVGTLSLIMLAQAQEV FFLKATRDKMKDAIIAKLAN QAADYFGDAFKQCQYKDTLP KEVFPVLAAKHCIMQANAEY HQSILAKQQKKFGEEIARLQ HAAELIKTVASRYDEYVNVK DFSDKINRALAAAKKDNDFI YHDRVPDLKDLDPIGKATLV KSTPVNVPISQKFTDLFEKM V ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 361 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details ; This construct has two additional residues at the N-terminus, GH. These are the residues that are needed for the TEV proteolytic cleavage of the fusion construct - 10xHis tag - TEV cutting site - GH - Bro1 (residue 1 - 359). ; _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 Q8WUM4 . 'Programmed cell death 6-interacting protein' . . . . . . . . . . . . . . 50707 1 stop_ loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID 'endosomal protein sorting; apoptosis; cell adhesion' 50707 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 . 50707 1 2 0 HIS . 50707 1 3 1 MET . 50707 1 4 2 ALA . 50707 1 5 3 THR . 50707 1 6 4 PHE . 50707 1 7 5 ILE . 50707 1 8 6 SER . 50707 1 9 7 VAL . 50707 1 10 8 GLN . 50707 1 11 9 LEU . 50707 1 12 10 LYS . 50707 1 13 11 LYS . 50707 1 14 12 THR . 50707 1 15 13 SER . 50707 1 16 14 GLU . 50707 1 17 15 VAL . 50707 1 18 16 ASP . 50707 1 19 17 LEU . 50707 1 20 18 ALA . 50707 1 21 19 LYS . 50707 1 22 20 PRO . 50707 1 23 21 LEU . 50707 1 24 22 VAL . 50707 1 25 23 LYS . 50707 1 26 24 PHE . 50707 1 27 25 ILE . 50707 1 28 26 GLN . 50707 1 29 27 GLN . 50707 1 30 28 THR . 50707 1 31 29 TYR . 50707 1 32 30 PRO . 50707 1 33 31 SER . 50707 1 34 32 GLY . 50707 1 35 33 GLY . 50707 1 36 34 GLU . 50707 1 37 35 GLU . 50707 1 38 36 GLN . 50707 1 39 37 ALA . 50707 1 40 38 GLN . 50707 1 41 39 TYR . 50707 1 42 40 CYS . 50707 1 43 41 ARG . 50707 1 44 42 ALA . 50707 1 45 43 ALA . 50707 1 46 44 GLU . 50707 1 47 45 GLU . 50707 1 48 46 LEU . 50707 1 49 47 SER . 50707 1 50 48 LYS . 50707 1 51 49 LEU . 50707 1 52 50 ARG . 50707 1 53 51 ARG . 50707 1 54 52 ALA . 50707 1 55 53 ALA . 50707 1 56 54 VAL . 50707 1 57 55 GLY . 50707 1 58 56 ARG . 50707 1 59 57 PRO . 50707 1 60 58 LEU . 50707 1 61 59 ASP . 50707 1 62 60 LYS . 50707 1 63 61 HIS . 50707 1 64 62 GLU . 50707 1 65 63 GLY . 50707 1 66 64 ALA . 50707 1 67 65 LEU . 50707 1 68 66 GLU . 50707 1 69 67 THR . 50707 1 70 68 LEU . 50707 1 71 69 LEU . 50707 1 72 70 ARG . 50707 1 73 71 TYR . 50707 1 74 72 TYR . 50707 1 75 73 ASP . 50707 1 76 74 GLN . 50707 1 77 75 ILE . 50707 1 78 76 CYS . 50707 1 79 77 SER . 50707 1 80 78 ILE . 50707 1 81 79 GLU . 50707 1 82 80 PRO . 50707 1 83 81 LYS . 50707 1 84 82 PHE . 50707 1 85 83 PRO . 50707 1 86 84 PHE . 50707 1 87 85 SER . 50707 1 88 86 GLU . 50707 1 89 87 ASN . 50707 1 90 88 GLN . 50707 1 91 89 ILE . 50707 1 92 90 CYS . 50707 1 93 91 LEU . 50707 1 94 92 THR . 50707 1 95 93 PHE . 50707 1 96 94 THR . 50707 1 97 95 TRP . 50707 1 98 96 LYS . 50707 1 99 97 ASP . 50707 1 100 98 ALA . 50707 1 101 99 PHE . 50707 1 102 100 ASP . 50707 1 103 101 LYS . 50707 1 104 102 GLY . 50707 1 105 103 SER . 50707 1 106 104 LEU . 50707 1 107 105 PHE . 50707 1 108 106 GLY . 50707 1 109 107 GLY . 50707 1 110 108 SER . 50707 1 111 109 VAL . 50707 1 112 110 LYS . 50707 1 113 111 LEU . 50707 1 114 112 ALA . 50707 1 115 113 LEU . 50707 1 116 114 ALA . 50707 1 117 115 SER . 50707 1 118 116 LEU . 50707 1 119 117 GLY . 50707 1 120 118 TYR . 50707 1 121 119 GLU . 50707 1 122 120 LYS . 50707 1 123 121 SER . 50707 1 124 122 CYS . 50707 1 125 123 VAL . 50707 1 126 124 LEU . 50707 1 127 125 PHE . 50707 1 128 126 ASN . 50707 1 129 127 CYS . 50707 1 130 128 ALA . 50707 1 131 129 ALA . 50707 1 132 130 LEU . 50707 1 133 131 ALA . 50707 1 134 132 SER . 50707 1 135 133 GLN . 50707 1 136 134 ILE . 50707 1 137 135 ALA . 50707 1 138 136 ALA . 50707 1 139 137 GLU . 50707 1 140 138 GLN . 50707 1 141 139 ASN . 50707 1 142 140 LEU . 50707 1 143 141 ASP . 50707 1 144 142 ASN . 50707 1 145 143 ASP . 50707 1 146 144 GLU . 50707 1 147 145 GLY . 50707 1 148 146 LEU . 50707 1 149 147 LYS . 50707 1 150 148 ILE . 50707 1 151 149 ALA . 50707 1 152 150 ALA . 50707 1 153 151 LYS . 50707 1 154 152 HIS . 50707 1 155 153 TYR . 50707 1 156 154 GLN . 50707 1 157 155 PHE . 50707 1 158 156 ALA . 50707 1 159 157 SER . 50707 1 160 158 GLY . 50707 1 161 159 ALA . 50707 1 162 160 PHE . 50707 1 163 161 LEU . 50707 1 164 162 HIS . 50707 1 165 163 ILE . 50707 1 166 164 LYS . 50707 1 167 165 GLU . 50707 1 168 166 THR . 50707 1 169 167 VAL . 50707 1 170 168 LEU . 50707 1 171 169 SER . 50707 1 172 170 ALA . 50707 1 173 171 LEU . 50707 1 174 172 SER . 50707 1 175 173 ARG . 50707 1 176 174 GLU . 50707 1 177 175 PRO . 50707 1 178 176 THR . 50707 1 179 177 VAL . 50707 1 180 178 ASP . 50707 1 181 179 ILE . 50707 1 182 180 SER . 50707 1 183 181 PRO . 50707 1 184 182 ASP . 50707 1 185 183 THR . 50707 1 186 184 VAL . 50707 1 187 185 GLY . 50707 1 188 186 THR . 50707 1 189 187 LEU . 50707 1 190 188 SER . 50707 1 191 189 LEU . 50707 1 192 190 ILE . 50707 1 193 191 MET . 50707 1 194 192 LEU . 50707 1 195 193 ALA . 50707 1 196 194 GLN . 50707 1 197 195 ALA . 50707 1 198 196 GLN . 50707 1 199 197 GLU . 50707 1 200 198 VAL . 50707 1 201 199 PHE . 50707 1 202 200 PHE . 50707 1 203 201 LEU . 50707 1 204 202 LYS . 50707 1 205 203 ALA . 50707 1 206 204 THR . 50707 1 207 205 ARG . 50707 1 208 206 ASP . 50707 1 209 207 LYS . 50707 1 210 208 MET . 50707 1 211 209 LYS . 50707 1 212 210 ASP . 50707 1 213 211 ALA . 50707 1 214 212 ILE . 50707 1 215 213 ILE . 50707 1 216 214 ALA . 50707 1 217 215 LYS . 50707 1 218 216 LEU . 50707 1 219 217 ALA . 50707 1 220 218 ASN . 50707 1 221 219 GLN . 50707 1 222 220 ALA . 50707 1 223 221 ALA . 50707 1 224 222 ASP . 50707 1 225 223 TYR . 50707 1 226 224 PHE . 50707 1 227 225 GLY . 50707 1 228 226 ASP . 50707 1 229 227 ALA . 50707 1 230 228 PHE . 50707 1 231 229 LYS . 50707 1 232 230 GLN . 50707 1 233 231 CYS . 50707 1 234 232 GLN . 50707 1 235 233 TYR . 50707 1 236 234 LYS . 50707 1 237 235 ASP . 50707 1 238 236 THR . 50707 1 239 237 LEU . 50707 1 240 238 PRO . 50707 1 241 239 LYS . 50707 1 242 240 GLU . 50707 1 243 241 VAL . 50707 1 244 242 PHE . 50707 1 245 243 PRO . 50707 1 246 244 VAL . 50707 1 247 245 LEU . 50707 1 248 246 ALA . 50707 1 249 247 ALA . 50707 1 250 248 LYS . 50707 1 251 249 HIS . 50707 1 252 250 CYS . 50707 1 253 251 ILE . 50707 1 254 252 MET . 50707 1 255 253 GLN . 50707 1 256 254 ALA . 50707 1 257 255 ASN . 50707 1 258 256 ALA . 50707 1 259 257 GLU . 50707 1 260 258 TYR . 50707 1 261 259 HIS . 50707 1 262 260 GLN . 50707 1 263 261 SER . 50707 1 264 262 ILE . 50707 1 265 263 LEU . 50707 1 266 264 ALA . 50707 1 267 265 LYS . 50707 1 268 266 GLN . 50707 1 269 267 GLN . 50707 1 270 268 LYS . 50707 1 271 269 LYS . 50707 1 272 270 PHE . 50707 1 273 271 GLY . 50707 1 274 272 GLU . 50707 1 275 273 GLU . 50707 1 276 274 ILE . 50707 1 277 275 ALA . 50707 1 278 276 ARG . 50707 1 279 277 LEU . 50707 1 280 278 GLN . 50707 1 281 279 HIS . 50707 1 282 280 ALA . 50707 1 283 281 ALA . 50707 1 284 282 GLU . 50707 1 285 283 LEU . 50707 1 286 284 ILE . 50707 1 287 285 LYS . 50707 1 288 286 THR . 50707 1 289 287 VAL . 50707 1 290 288 ALA . 50707 1 291 289 SER . 50707 1 292 290 ARG . 50707 1 293 291 TYR . 50707 1 294 292 ASP . 50707 1 295 293 GLU . 50707 1 296 294 TYR . 50707 1 297 295 VAL . 50707 1 298 296 ASN . 50707 1 299 297 VAL . 50707 1 300 298 LYS . 50707 1 301 299 ASP . 50707 1 302 300 PHE . 50707 1 303 301 SER . 50707 1 304 302 ASP . 50707 1 305 303 LYS . 50707 1 306 304 ILE . 50707 1 307 305 ASN . 50707 1 308 306 ARG . 50707 1 309 307 ALA . 50707 1 310 308 LEU . 50707 1 311 309 ALA . 50707 1 312 310 ALA . 50707 1 313 311 ALA . 50707 1 314 312 LYS . 50707 1 315 313 LYS . 50707 1 316 314 ASP . 50707 1 317 315 ASN . 50707 1 318 316 ASP . 50707 1 319 317 PHE . 50707 1 320 318 ILE . 50707 1 321 319 TYR . 50707 1 322 320 HIS . 50707 1 323 321 ASP . 50707 1 324 322 ARG . 50707 1 325 323 VAL . 50707 1 326 324 PRO . 50707 1 327 325 ASP . 50707 1 328 326 LEU . 50707 1 329 327 LYS . 50707 1 330 328 ASP . 50707 1 331 329 LEU . 50707 1 332 330 ASP . 50707 1 333 331 PRO . 50707 1 334 332 ILE . 50707 1 335 333 GLY . 50707 1 336 334 LYS . 50707 1 337 335 ALA . 50707 1 338 336 THR . 50707 1 339 337 LEU . 50707 1 340 338 VAL . 50707 1 341 339 LYS . 50707 1 342 340 SER . 50707 1 343 341 THR . 50707 1 344 342 PRO . 50707 1 345 343 VAL . 50707 1 346 344 ASN . 50707 1 347 345 VAL . 50707 1 348 346 PRO . 50707 1 349 347 ILE . 50707 1 350 348 SER . 50707 1 351 349 GLN . 50707 1 352 350 LYS . 50707 1 353 351 PHE . 50707 1 354 352 THR . 50707 1 355 353 ASP . 50707 1 356 354 LEU . 50707 1 357 355 PHE . 50707 1 358 356 GLU . 50707 1 359 357 LYS . 50707 1 360 358 MET . 50707 1 361 359 VAL . 50707 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 50707 1 . HIS 2 2 50707 1 . MET 3 3 50707 1 . ALA 4 4 50707 1 . THR 5 5 50707 1 . PHE 6 6 50707 1 . ILE 7 7 50707 1 . SER 8 8 50707 1 . VAL 9 9 50707 1 . GLN 10 10 50707 1 . LEU 11 11 50707 1 . LYS 12 12 50707 1 . LYS 13 13 50707 1 . THR 14 14 50707 1 . SER 15 15 50707 1 . GLU 16 16 50707 1 . VAL 17 17 50707 1 . ASP 18 18 50707 1 . LEU 19 19 50707 1 . ALA 20 20 50707 1 . LYS 21 21 50707 1 . PRO 22 22 50707 1 . LEU 23 23 50707 1 . VAL 24 24 50707 1 . LYS 25 25 50707 1 . PHE 26 26 50707 1 . ILE 27 27 50707 1 . GLN 28 28 50707 1 . GLN 29 29 50707 1 . THR 30 30 50707 1 . TYR 31 31 50707 1 . PRO 32 32 50707 1 . SER 33 33 50707 1 . GLY 34 34 50707 1 . GLY 35 35 50707 1 . GLU 36 36 50707 1 . GLU 37 37 50707 1 . GLN 38 38 50707 1 . ALA 39 39 50707 1 . GLN 40 40 50707 1 . TYR 41 41 50707 1 . CYS 42 42 50707 1 . ARG 43 43 50707 1 . ALA 44 44 50707 1 . ALA 45 45 50707 1 . GLU 46 46 50707 1 . GLU 47 47 50707 1 . LEU 48 48 50707 1 . SER 49 49 50707 1 . LYS 50 50 50707 1 . LEU 51 51 50707 1 . ARG 52 52 50707 1 . ARG 53 53 50707 1 . ALA 54 54 50707 1 . ALA 55 55 50707 1 . VAL 56 56 50707 1 . GLY 57 57 50707 1 . ARG 58 58 50707 1 . PRO 59 59 50707 1 . LEU 60 60 50707 1 . ASP 61 61 50707 1 . LYS 62 62 50707 1 . HIS 63 63 50707 1 . GLU 64 64 50707 1 . GLY 65 65 50707 1 . ALA 66 66 50707 1 . LEU 67 67 50707 1 . GLU 68 68 50707 1 . THR 69 69 50707 1 . LEU 70 70 50707 1 . LEU 71 71 50707 1 . ARG 72 72 50707 1 . TYR 73 73 50707 1 . TYR 74 74 50707 1 . ASP 75 75 50707 1 . GLN 76 76 50707 1 . ILE 77 77 50707 1 . CYS 78 78 50707 1 . SER 79 79 50707 1 . ILE 80 80 50707 1 . GLU 81 81 50707 1 . PRO 82 82 50707 1 . LYS 83 83 50707 1 . PHE 84 84 50707 1 . PRO 85 85 50707 1 . PHE 86 86 50707 1 . SER 87 87 50707 1 . GLU 88 88 50707 1 . ASN 89 89 50707 1 . GLN 90 90 50707 1 . ILE 91 91 50707 1 . CYS 92 92 50707 1 . LEU 93 93 50707 1 . THR 94 94 50707 1 . PHE 95 95 50707 1 . THR 96 96 50707 1 . TRP 97 97 50707 1 . LYS 98 98 50707 1 . ASP 99 99 50707 1 . ALA 100 100 50707 1 . PHE 101 101 50707 1 . ASP 102 102 50707 1 . LYS 103 103 50707 1 . GLY 104 104 50707 1 . SER 105 105 50707 1 . LEU 106 106 50707 1 . PHE 107 107 50707 1 . GLY 108 108 50707 1 . GLY 109 109 50707 1 . SER 110 110 50707 1 . VAL 111 111 50707 1 . LYS 112 112 50707 1 . LEU 113 113 50707 1 . ALA 114 114 50707 1 . LEU 115 115 50707 1 . ALA 116 116 50707 1 . SER 117 117 50707 1 . LEU 118 118 50707 1 . GLY 119 119 50707 1 . TYR 120 120 50707 1 . GLU 121 121 50707 1 . LYS 122 122 50707 1 . SER 123 123 50707 1 . CYS 124 124 50707 1 . VAL 125 125 50707 1 . LEU 126 126 50707 1 . PHE 127 127 50707 1 . ASN 128 128 50707 1 . CYS 129 129 50707 1 . ALA 130 130 50707 1 . ALA 131 131 50707 1 . LEU 132 132 50707 1 . ALA 133 133 50707 1 . SER 134 134 50707 1 . GLN 135 135 50707 1 . ILE 136 136 50707 1 . ALA 137 137 50707 1 . ALA 138 138 50707 1 . GLU 139 139 50707 1 . GLN 140 140 50707 1 . ASN 141 141 50707 1 . LEU 142 142 50707 1 . ASP 143 143 50707 1 . ASN 144 144 50707 1 . ASP 145 145 50707 1 . GLU 146 146 50707 1 . GLY 147 147 50707 1 . LEU 148 148 50707 1 . LYS 149 149 50707 1 . ILE 150 150 50707 1 . ALA 151 151 50707 1 . ALA 152 152 50707 1 . LYS 153 153 50707 1 . HIS 154 154 50707 1 . TYR 155 155 50707 1 . GLN 156 156 50707 1 . PHE 157 157 50707 1 . ALA 158 158 50707 1 . SER 159 159 50707 1 . GLY 160 160 50707 1 . ALA 161 161 50707 1 . PHE 162 162 50707 1 . LEU 163 163 50707 1 . HIS 164 164 50707 1 . ILE 165 165 50707 1 . LYS 166 166 50707 1 . GLU 167 167 50707 1 . THR 168 168 50707 1 . VAL 169 169 50707 1 . LEU 170 170 50707 1 . SER 171 171 50707 1 . ALA 172 172 50707 1 . LEU 173 173 50707 1 . SER 174 174 50707 1 . ARG 175 175 50707 1 . GLU 176 176 50707 1 . PRO 177 177 50707 1 . THR 178 178 50707 1 . VAL 179 179 50707 1 . ASP 180 180 50707 1 . ILE 181 181 50707 1 . SER 182 182 50707 1 . PRO 183 183 50707 1 . ASP 184 184 50707 1 . THR 185 185 50707 1 . VAL 186 186 50707 1 . GLY 187 187 50707 1 . THR 188 188 50707 1 . LEU 189 189 50707 1 . SER 190 190 50707 1 . LEU 191 191 50707 1 . ILE 192 192 50707 1 . MET 193 193 50707 1 . LEU 194 194 50707 1 . ALA 195 195 50707 1 . GLN 196 196 50707 1 . ALA 197 197 50707 1 . GLN 198 198 50707 1 . GLU 199 199 50707 1 . VAL 200 200 50707 1 . PHE 201 201 50707 1 . PHE 202 202 50707 1 . LEU 203 203 50707 1 . LYS 204 204 50707 1 . ALA 205 205 50707 1 . THR 206 206 50707 1 . ARG 207 207 50707 1 . ASP 208 208 50707 1 . LYS 209 209 50707 1 . MET 210 210 50707 1 . LYS 211 211 50707 1 . ASP 212 212 50707 1 . ALA 213 213 50707 1 . ILE 214 214 50707 1 . ILE 215 215 50707 1 . ALA 216 216 50707 1 . LYS 217 217 50707 1 . LEU 218 218 50707 1 . ALA 219 219 50707 1 . ASN 220 220 50707 1 . GLN 221 221 50707 1 . ALA 222 222 50707 1 . ALA 223 223 50707 1 . ASP 224 224 50707 1 . TYR 225 225 50707 1 . PHE 226 226 50707 1 . GLY 227 227 50707 1 . ASP 228 228 50707 1 . ALA 229 229 50707 1 . PHE 230 230 50707 1 . LYS 231 231 50707 1 . GLN 232 232 50707 1 . CYS 233 233 50707 1 . GLN 234 234 50707 1 . TYR 235 235 50707 1 . LYS 236 236 50707 1 . ASP 237 237 50707 1 . THR 238 238 50707 1 . LEU 239 239 50707 1 . PRO 240 240 50707 1 . LYS 241 241 50707 1 . GLU 242 242 50707 1 . VAL 243 243 50707 1 . PHE 244 244 50707 1 . PRO 245 245 50707 1 . VAL 246 246 50707 1 . LEU 247 247 50707 1 . ALA 248 248 50707 1 . ALA 249 249 50707 1 . LYS 250 250 50707 1 . HIS 251 251 50707 1 . CYS 252 252 50707 1 . ILE 253 253 50707 1 . MET 254 254 50707 1 . GLN 255 255 50707 1 . ALA 256 256 50707 1 . ASN 257 257 50707 1 . ALA 258 258 50707 1 . GLU 259 259 50707 1 . TYR 260 260 50707 1 . HIS 261 261 50707 1 . GLN 262 262 50707 1 . SER 263 263 50707 1 . ILE 264 264 50707 1 . LEU 265 265 50707 1 . ALA 266 266 50707 1 . LYS 267 267 50707 1 . GLN 268 268 50707 1 . GLN 269 269 50707 1 . LYS 270 270 50707 1 . LYS 271 271 50707 1 . PHE 272 272 50707 1 . GLY 273 273 50707 1 . GLU 274 274 50707 1 . GLU 275 275 50707 1 . ILE 276 276 50707 1 . ALA 277 277 50707 1 . ARG 278 278 50707 1 . LEU 279 279 50707 1 . GLN 280 280 50707 1 . HIS 281 281 50707 1 . ALA 282 282 50707 1 . ALA 283 283 50707 1 . GLU 284 284 50707 1 . LEU 285 285 50707 1 . ILE 286 286 50707 1 . LYS 287 287 50707 1 . THR 288 288 50707 1 . VAL 289 289 50707 1 . ALA 290 290 50707 1 . SER 291 291 50707 1 . ARG 292 292 50707 1 . TYR 293 293 50707 1 . ASP 294 294 50707 1 . GLU 295 295 50707 1 . TYR 296 296 50707 1 . VAL 297 297 50707 1 . ASN 298 298 50707 1 . VAL 299 299 50707 1 . LYS 300 300 50707 1 . ASP 301 301 50707 1 . PHE 302 302 50707 1 . SER 303 303 50707 1 . ASP 304 304 50707 1 . LYS 305 305 50707 1 . ILE 306 306 50707 1 . ASN 307 307 50707 1 . ARG 308 308 50707 1 . ALA 309 309 50707 1 . LEU 310 310 50707 1 . ALA 311 311 50707 1 . ALA 312 312 50707 1 . ALA 313 313 50707 1 . LYS 314 314 50707 1 . LYS 315 315 50707 1 . ASP 316 316 50707 1 . ASN 317 317 50707 1 . ASP 318 318 50707 1 . PHE 319 319 50707 1 . ILE 320 320 50707 1 . TYR 321 321 50707 1 . HIS 322 322 50707 1 . ASP 323 323 50707 1 . ARG 324 324 50707 1 . VAL 325 325 50707 1 . PRO 326 326 50707 1 . ASP 327 327 50707 1 . LEU 328 328 50707 1 . LYS 329 329 50707 1 . ASP 330 330 50707 1 . LEU 331 331 50707 1 . ASP 332 332 50707 1 . PRO 333 333 50707 1 . ILE 334 334 50707 1 . GLY 335 335 50707 1 . LYS 336 336 50707 1 . ALA 337 337 50707 1 . THR 338 338 50707 1 . LEU 339 339 50707 1 . VAL 340 340 50707 1 . LYS 341 341 50707 1 . SER 342 342 50707 1 . THR 343 343 50707 1 . PRO 344 344 50707 1 . VAL 345 345 50707 1 . ASN 346 346 50707 1 . VAL 347 347 50707 1 . PRO 348 348 50707 1 . ILE 349 349 50707 1 . SER 350 350 50707 1 . GLN 351 351 50707 1 . LYS 352 352 50707 1 . PHE 353 353 50707 1 . THR 354 354 50707 1 . ASP 355 355 50707 1 . LEU 356 356 50707 1 . PHE 357 357 50707 1 . GLU 358 358 50707 1 . LYS 359 359 50707 1 . MET 360 360 50707 1 . VAL 361 361 50707 1 stop_ save_ #################### # Natural source # #################### save_natural_source_1 _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source_1 _Entity_natural_src_list.Entry_ID 50707 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity_1 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . 50707 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source_1 _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source_1 _Entity_experimental_src_list.Entry_ID 50707 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . plasmid . . pet11a . . . 50707 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 50707 _Sample.ID 1 _Sample.Name 'Sample 1' _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number 1 _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'Bro1 domain of human ALIX' '[U-13C; U-15N; U-2H]' . . 1 $entity_1 . . 0.75 0.5 1 mM . . . . 50707 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 50707 _Sample_condition_list.ID 1 _Sample_condition_list.Name 'conditions 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' 50 . mM 50707 1 pH 6.5 . pH 50707 1 pressure 1 . atm 50707 1 temperature 303 . K 50707 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 50707 _Software.ID 1 _Software.Type . _Software.Name CcpNMR _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'data analysis' . 50707 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID 50707 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name 'Spectrometer 1' _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE NEO' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_NMR_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_2 _NMR_spectrometer.Entry_ID 50707 _NMR_spectrometer.ID 2 _NMR_spectrometer.Name 'Spectrometer 2' _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ ############################# # NMR applied experiments # ############################# save_experiment_list_1 _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list_1 _Experiment_list.Entry_ID 50707 _Experiment_list.ID 1 _Experiment_list.Details 'The experiments 3 to 6 are TROSY readout.' loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NUS_flag _Experiment.Interleaved_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Details _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N TROSY' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50707 1 2 '2D 1H-15N TROSY' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 50707 1 3 '3D HNCO' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 50707 1 4 '3D HNCACO' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 50707 1 5 '3D HNCA' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 50707 1 6 '3D HNCACB' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 50707 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chem_shift_reference_1 _Chem_shift_reference.Entry_ID 50707 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name 'Reference 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 4.7 internal indirect . . . . . . 50707 1 H 1 water protons . . . . ppm 4.7 internal direct 1 . . . . . 50707 1 N 15 water protons . . . . ppm 4.7 internal indirect . . . . . . 50707 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 50707 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name 'shift 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 $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 3 '3D HNCO' . . . 50707 1 4 '3D HNCACO' . . . 50707 1 5 '3D HNCA' . . . 50707 1 6 '3D HNCACB' . . . 50707 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $software_1 . . 50707 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 3 3 MET H H 1 8.393 0.000 . 1 . . . . . 1 MET H . 50707 1 2 . 1 . 1 3 3 MET C C 13 175.350 0.000 . 1 . . . . . 1 MET C . 50707 1 3 . 1 . 1 3 3 MET CA C 13 55.576 0.000 . 1 . . . . . 1 MET CA . 50707 1 4 . 1 . 1 3 3 MET CB C 13 32.357 0.000 . 1 . . . . . 1 MET CB . 50707 1 5 . 1 . 1 3 3 MET N N 15 122.526 0.000 . 1 . . . . . 1 MET N . 50707 1 6 . 1 . 1 4 4 ALA H H 1 8.129 0.000 . 1 . . . . . 2 ALA H . 50707 1 7 . 1 . 1 4 4 ALA C C 13 176.856 0.000 . 1 . . . . . 2 ALA C . 50707 1 8 . 1 . 1 4 4 ALA CA C 13 51.425 0.000 . 1 . . . . . 2 ALA CA . 50707 1 9 . 1 . 1 4 4 ALA CB C 13 19.120 0.000 . 1 . . . . . 2 ALA CB . 50707 1 10 . 1 . 1 4 4 ALA N N 15 124.547 0.000 . 1 . . . . . 2 ALA N . 50707 1 11 . 1 . 1 5 5 THR H H 1 7.972 0.000 . 1 . . . . . 3 THR H . 50707 1 12 . 1 . 1 5 5 THR C C 13 173.213 0.000 . 1 . . . . . 3 THR C . 50707 1 13 . 1 . 1 5 5 THR CA C 13 62.047 0.000 . 1 . . . . . 3 THR CA . 50707 1 14 . 1 . 1 5 5 THR CB C 13 69.216 0.000 . 1 . . . . . 3 THR CB . 50707 1 15 . 1 . 1 5 5 THR N N 15 114.783 0.000 . 1 . . . . . 3 THR N . 50707 1 16 . 1 . 1 6 6 PHE H H 1 8.118 0.000 . 1 . . . . . 4 PHE H . 50707 1 17 . 1 . 1 6 6 PHE C C 13 175.203 0.000 . 1 . . . . . 4 PHE C . 50707 1 18 . 1 . 1 6 6 PHE CA C 13 57.774 0.000 . 1 . . . . . 4 PHE CA . 50707 1 19 . 1 . 1 6 6 PHE CB C 13 40.539 0.000 . 1 . . . . . 4 PHE CB . 50707 1 20 . 1 . 1 6 6 PHE N N 15 121.412 0.000 . 1 . . . . . 4 PHE N . 50707 1 21 . 1 . 1 7 7 ILE H H 1 9.692 0.000 . 1 . . . . . 5 ILE H . 50707 1 22 . 1 . 1 7 7 ILE C C 13 175.525 0.000 . 1 . . . . . 5 ILE C . 50707 1 23 . 1 . 1 7 7 ILE CA C 13 60.460 0.000 . 1 . . . . . 5 ILE CA . 50707 1 24 . 1 . 1 7 7 ILE CB C 13 37.342 0.000 . 1 . . . . . 5 ILE CB . 50707 1 25 . 1 . 1 7 7 ILE N N 15 124.919 0.000 . 1 . . . . . 5 ILE N . 50707 1 26 . 1 . 1 8 8 SER H H 1 8.411 0.000 . 1 . . . . . 6 SER H . 50707 1 27 . 1 . 1 8 8 SER C C 13 171.855 0.000 . 1 . . . . . 6 SER C . 50707 1 28 . 1 . 1 8 8 SER CA C 13 55.698 0.000 . 1 . . . . . 6 SER CA . 50707 1 29 . 1 . 1 8 8 SER CB C 13 65.127 0.000 . 1 . . . . . 6 SER CB . 50707 1 30 . 1 . 1 8 8 SER N N 15 120.814 0.000 . 1 . . . . . 6 SER N . 50707 1 31 . 1 . 1 9 9 VAL H H 1 7.790 0.000 . 1 . . . . . 7 VAL H . 50707 1 32 . 1 . 1 9 9 VAL C C 13 174.450 0.000 . 1 . . . . . 7 VAL C . 50707 1 33 . 1 . 1 9 9 VAL CA C 13 60.704 0.000 . 1 . . . . . 7 VAL CA . 50707 1 34 . 1 . 1 9 9 VAL CB C 13 33.969 0.000 . 1 . . . . . 7 VAL CB . 50707 1 35 . 1 . 1 9 9 VAL N N 15 119.828 0.000 . 1 . . . . . 7 VAL N . 50707 1 36 . 1 . 1 10 10 GLN H H 1 8.371 0.000 . 1 . . . . . 8 GLN H . 50707 1 37 . 1 . 1 10 10 GLN C C 13 173.495 0.000 . 1 . . . . . 8 GLN C . 50707 1 38 . 1 . 1 10 10 GLN CA C 13 55.332 0.000 . 1 . . . . . 8 GLN CA . 50707 1 39 . 1 . 1 10 10 GLN CB C 13 29.033 0.000 . 1 . . . . . 8 GLN CB . 50707 1 40 . 1 . 1 10 10 GLN N N 15 125.042 0.000 . 1 . . . . . 8 GLN N . 50707 1 41 . 1 . 1 11 11 LEU H H 1 7.660 0.000 . 1 . . . . . 9 LEU H . 50707 1 42 . 1 . 1 11 11 LEU C C 13 179.316 0.000 . 1 . . . . . 9 LEU C . 50707 1 43 . 1 . 1 11 11 LEU CA C 13 55.576 0.000 . 1 . . . . . 9 LEU CA . 50707 1 44 . 1 . 1 11 11 LEU CB C 13 41.129 0.000 . 1 . . . . . 9 LEU CB . 50707 1 45 . 1 . 1 11 11 LEU N N 15 116.323 0.000 . 1 . . . . . 9 LEU N . 50707 1 46 . 1 . 1 12 12 LYS H H 1 9.837 0.000 . 1 . . . . . 10 LYS H . 50707 1 47 . 1 . 1 12 12 LYS C C 13 177.824 0.000 . 1 . . . . . 10 LYS C . 50707 1 48 . 1 . 1 12 12 LYS CA C 13 56.064 0.000 . 1 . . . . . 10 LYS CA . 50707 1 49 . 1 . 1 12 12 LYS CB C 13 31.715 0.000 . 1 . . . . . 10 LYS CB . 50707 1 50 . 1 . 1 12 12 LYS N N 15 122.042 0.000 . 1 . . . . . 10 LYS N . 50707 1 51 . 1 . 1 13 13 LYS H H 1 8.246 0.000 . 1 . . . . . 11 LYS H . 50707 1 52 . 1 . 1 13 13 LYS C C 13 174.544 0.000 . 1 . . . . . 11 LYS C . 50707 1 53 . 1 . 1 13 13 LYS CA C 13 54.965 0.000 . 1 . . . . . 11 LYS CA . 50707 1 54 . 1 . 1 13 13 LYS CB C 13 33.638 0.000 . 1 . . . . . 11 LYS CB . 50707 1 55 . 1 . 1 13 13 LYS N N 15 122.328 0.000 . 1 . . . . . 11 LYS N . 50707 1 56 . 1 . 1 14 14 THR H H 1 7.977 0.000 . 1 . . . . . 12 THR H . 50707 1 57 . 1 . 1 14 14 THR C C 13 173.087 0.000 . 1 . . . . . 12 THR C . 50707 1 58 . 1 . 1 14 14 THR CA C 13 56.675 0.000 . 1 . . . . . 12 THR CA . 50707 1 59 . 1 . 1 14 14 THR CB C 13 69.436 0.000 . 1 . . . . . 12 THR CB . 50707 1 60 . 1 . 1 14 14 THR N N 15 115.153 0.000 . 1 . . . . . 12 THR N . 50707 1 61 . 1 . 1 15 15 SER H H 1 7.346 0.000 . 1 . . . . . 13 SER H . 50707 1 62 . 1 . 1 15 15 SER C C 13 173.697 0.000 . 1 . . . . . 13 SER C . 50707 1 63 . 1 . 1 15 15 SER CA C 13 56.919 0.000 . 1 . . . . . 13 SER CA . 50707 1 64 . 1 . 1 15 15 SER CB C 13 63.734 0.000 . 1 . . . . . 13 SER CB . 50707 1 65 . 1 . 1 15 15 SER N N 15 121.282 0.000 . 1 . . . . . 13 SER N . 50707 1 66 . 1 . 1 16 16 GLU H H 1 8.536 0.000 . 1 . . . . . 14 GLU H . 50707 1 67 . 1 . 1 16 16 GLU C C 13 176.170 0.000 . 1 . . . . . 14 GLU C . 50707 1 68 . 1 . 1 16 16 GLU CA C 13 56.553 0.000 . 1 . . . . . 14 GLU CA . 50707 1 69 . 1 . 1 16 16 GLU CB C 13 29.070 0.000 . 1 . . . . . 14 GLU CB . 50707 1 70 . 1 . 1 16 16 GLU N N 15 125.535 0.000 . 1 . . . . . 14 GLU N . 50707 1 71 . 1 . 1 17 17 VAL H H 1 8.196 0.000 . 1 . . . . . 15 VAL H . 50707 1 72 . 1 . 1 17 17 VAL C C 13 173.697 0.000 . 1 . . . . . 15 VAL C . 50707 1 73 . 1 . 1 17 17 VAL CA C 13 59.727 0.000 . 1 . . . . . 15 VAL CA . 50707 1 74 . 1 . 1 17 17 VAL CB C 13 34.765 0.000 . 1 . . . . . 15 VAL CB . 50707 1 75 . 1 . 1 17 17 VAL N N 15 123.181 0.000 . 1 . . . . . 15 VAL N . 50707 1 76 . 1 . 1 18 18 ASP H H 1 8.440 0.000 . 1 . . . . . 16 ASP H . 50707 1 77 . 1 . 1 18 18 ASP C C 13 175.754 0.000 . 1 . . . . . 16 ASP C . 50707 1 78 . 1 . 1 18 18 ASP CA C 13 52.157 0.000 . 1 . . . . . 16 ASP CA . 50707 1 79 . 1 . 1 18 18 ASP CB C 13 39.053 0.000 . 1 . . . . . 16 ASP CB . 50707 1 80 . 1 . 1 18 18 ASP N N 15 125.556 0.000 . 1 . . . . . 16 ASP N . 50707 1 81 . 1 . 1 19 19 LEU H H 1 7.469 0.000 . 1 . . . . . 17 LEU H . 50707 1 82 . 1 . 1 19 19 LEU C C 13 176.251 0.000 . 1 . . . . . 17 LEU C . 50707 1 83 . 1 . 1 19 19 LEU CA C 13 55.332 0.000 . 1 . . . . . 17 LEU CA . 50707 1 84 . 1 . 1 19 19 LEU CB C 13 42.717 0.000 . 1 . . . . . 17 LEU CB . 50707 1 85 . 1 . 1 19 19 LEU N N 15 124.776 0.000 . 1 . . . . . 17 LEU N . 50707 1 86 . 1 . 1 20 20 ALA H H 1 7.837 0.000 . 1 . . . . . 18 ALA H . 50707 1 87 . 1 . 1 20 20 ALA C C 13 178.752 0.000 . 1 . . . . . 18 ALA C . 50707 1 88 . 1 . 1 20 20 ALA CA C 13 54.721 0.000 . 1 . . . . . 18 ALA CA . 50707 1 89 . 1 . 1 20 20 ALA CB C 13 17.727 0.000 . 1 . . . . . 18 ALA CB . 50707 1 90 . 1 . 1 20 20 ALA N N 15 117.227 0.000 . 1 . . . . . 18 ALA N . 50707 1 91 . 1 . 1 21 21 LYS H H 1 7.501 0.000 . 1 . . . . . 19 LYS H . 50707 1 92 . 1 . 1 21 21 LYS C C 13 176.412 0.000 . 1 . . . . . 19 LYS C . 50707 1 93 . 1 . 1 21 21 LYS CA C 13 61.192 0.000 . 1 . . . . . 19 LYS CA . 50707 1 94 . 1 . 1 21 21 LYS CB C 13 28.666 0.000 . 1 . . . . . 19 LYS CB . 50707 1 95 . 1 . 1 21 21 LYS N N 15 117.104 0.000 . 1 . . . . . 19 LYS N . 50707 1 96 . 1 . 1 22 22 PRO C C 13 179.603 0.000 . 1 . . . . . 20 PRO C . 50707 1 97 . 1 . 1 22 22 PRO CA C 13 64.646 0.000 . 1 . . . . . 20 PRO CA . 50707 1 98 . 1 . 1 22 22 PRO CB C 13 30.190 0.000 . 1 . . . . . 20 PRO CB . 50707 1 99 . 1 . 1 23 23 LEU H H 1 6.694 0.000 . 1 . . . . . 21 LEU H . 50707 1 100 . 1 . 1 23 23 LEU C C 13 178.644 0.000 . 1 . . . . . 21 LEU C . 50707 1 101 . 1 . 1 23 23 LEU CA C 13 57.896 0.000 . 1 . . . . . 21 LEU CA . 50707 1 102 . 1 . 1 23 23 LEU CB C 13 40.134 0.000 . 1 . . . . . 21 LEU CB . 50707 1 103 . 1 . 1 23 23 LEU N N 15 118.748 0.000 . 1 . . . . . 21 LEU N . 50707 1 104 . 1 . 1 24 24 VAL H H 1 9.053 0.000 . 1 . . . . . 22 VAL H . 50707 1 105 . 1 . 1 24 24 VAL C C 13 177.757 0.000 . 1 . . . . . 22 VAL C . 50707 1 106 . 1 . 1 24 24 VAL CA C 13 66.564 0.000 . 1 . . . . . 22 VAL CA . 50707 1 107 . 1 . 1 24 24 VAL CB C 13 30.588 0.000 . 1 . . . . . 22 VAL CB . 50707 1 108 . 1 . 1 24 24 VAL N N 15 120.979 0.000 . 1 . . . . . 22 VAL N . 50707 1 109 . 1 . 1 25 25 LYS H H 1 7.563 0.000 . 1 . . . . . 23 LYS H . 50707 1 110 . 1 . 1 25 25 LYS C C 13 178.792 0.000 . 1 . . . . . 23 LYS C . 50707 1 111 . 1 . 1 25 25 LYS CA C 13 59.061 0.000 . 1 . . . . . 23 LYS CA . 50707 1 112 . 1 . 1 25 25 LYS CB C 13 30.905 0.000 . 1 . . . . . 23 LYS CB . 50707 1 113 . 1 . 1 25 25 LYS N N 15 119.186 0.000 . 1 . . . . . 23 LYS N . 50707 1 114 . 1 . 1 26 26 PHE H H 1 7.287 0.000 . 1 . . . . . 24 PHE H . 50707 1 115 . 1 . 1 26 26 PHE C C 13 178.994 0.000 . 1 . . . . . 24 PHE C . 50707 1 116 . 1 . 1 26 26 PHE CA C 13 61.179 0.000 . 1 . . . . . 24 PHE CA . 50707 1 117 . 1 . 1 26 26 PHE CB C 13 38.610 0.000 . 1 . . . . . 24 PHE CB . 50707 1 118 . 1 . 1 26 26 PHE N N 15 119.267 0.000 . 1 . . . . . 24 PHE N . 50707 1 119 . 1 . 1 27 27 ILE H H 1 9.133 0.000 . 1 . . . . . 25 ILE H . 50707 1 120 . 1 . 1 27 27 ILE C C 13 178.268 0.000 . 1 . . . . . 25 ILE C . 50707 1 121 . 1 . 1 27 27 ILE CA C 13 65.099 0.000 . 1 . . . . . 25 ILE CA . 50707 1 122 . 1 . 1 27 27 ILE CB C 13 37.123 0.000 . 1 . . . . . 25 ILE CB . 50707 1 123 . 1 . 1 27 27 ILE N N 15 124.840 0.000 . 1 . . . . . 25 ILE N . 50707 1 124 . 1 . 1 28 28 GLN H H 1 8.746 0.000 . 1 . . . . . 26 GLN H . 50707 1 125 . 1 . 1 28 28 GLN C C 13 177.704 0.000 . 1 . . . . . 26 GLN C . 50707 1 126 . 1 . 1 28 28 GLN CA C 13 58.140 0.000 . 1 . . . . . 26 GLN CA . 50707 1 127 . 1 . 1 28 28 GLN CB C 13 26.743 0.000 . 1 . . . . . 26 GLN CB . 50707 1 128 . 1 . 1 28 28 GLN N N 15 117.896 0.000 . 1 . . . . . 26 GLN N . 50707 1 129 . 1 . 1 29 29 GLN H H 1 7.346 0.000 . 1 . . . . . 27 GLN H . 50707 1 130 . 1 . 1 29 29 GLN C C 13 177.085 0.000 . 1 . . . . . 27 GLN C . 50707 1 131 . 1 . 1 29 29 GLN CA C 13 56.553 0.000 . 1 . . . . . 27 GLN CA . 50707 1 132 . 1 . 1 29 29 GLN CB C 13 28.202 0.000 . 1 . . . . . 27 GLN CB . 50707 1 133 . 1 . 1 29 29 GLN N N 15 116.195 0.000 . 1 . . . . . 27 GLN N . 50707 1 134 . 1 . 1 30 30 THR H H 1 7.396 0.000 . 1 . . . . . 28 THR H . 50707 1 135 . 1 . 1 30 30 THR C C 13 173.529 0.000 . 1 . . . . . 28 THR C . 50707 1 136 . 1 . 1 30 30 THR CA C 13 64.234 0.000 . 1 . . . . . 28 THR CA . 50707 1 137 . 1 . 1 30 30 THR CB C 13 69.240 0.000 . 1 . . . . . 28 THR CB . 50707 1 138 . 1 . 1 30 30 THR N N 15 115.203 0.000 . 1 . . . . . 28 THR N . 50707 1 139 . 1 . 1 31 31 TYR H H 1 7.973 0.000 . 1 . . . . . 29 TYR H . 50707 1 140 . 1 . 1 31 31 TYR C C 13 174.006 0.000 . 1 . . . . . 29 TYR C . 50707 1 141 . 1 . 1 31 31 TYR CA C 13 55.820 0.000 . 1 . . . . . 29 TYR CA . 50707 1 142 . 1 . 1 31 31 TYR CB C 13 37.019 0.000 . 1 . . . . . 29 TYR CB . 50707 1 143 . 1 . 1 31 31 TYR N N 15 121.425 0.000 . 1 . . . . . 29 TYR N . 50707 1 144 . 1 . 1 32 32 PRO C C 13 178.233 0.000 . 1 . . . . . 30 PRO C . 50707 1 145 . 1 . 1 32 32 PRO CA C 13 63.390 0.000 . 1 . . . . . 30 PRO CA . 50707 1 146 . 1 . 1 32 32 PRO CB C 13 31.336 0.000 . 1 . . . . . 30 PRO CB . 50707 1 147 . 1 . 1 33 33 SER H H 1 8.531 0.000 . 1 . . . . . 31 SER H . 50707 1 148 . 1 . 1 33 33 SER C C 13 175.713 0.000 . 1 . . . . . 31 SER C . 50707 1 149 . 1 . 1 33 33 SER CA C 13 58.872 0.000 . 1 . . . . . 31 SER CA . 50707 1 150 . 1 . 1 33 33 SER CB C 13 62.342 0.000 . 1 . . . . . 31 SER CB . 50707 1 151 . 1 . 1 33 33 SER N N 15 118.162 0.000 . 1 . . . . . 31 SER N . 50707 1 152 . 1 . 1 34 34 GLY H H 1 8.277 0.000 . 1 . . . . . 32 GLY H . 50707 1 153 . 1 . 1 34 34 GLY C C 13 174.550 0.000 . 1 . . . . . 32 GLY C . 50707 1 154 . 1 . 1 34 34 GLY CA C 13 45.198 0.000 . 1 . . . . . 32 GLY CA . 50707 1 155 . 1 . 1 34 34 GLY N N 15 111.545 0.000 . 1 . . . . . 32 GLY N . 50707 1 156 . 1 . 1 35 35 GLY H H 1 7.809 0.000 . 1 . . . . . 33 GLY H . 50707 1 157 . 1 . 1 35 35 GLY C C 13 174.692 0.000 . 1 . . . . . 33 GLY C . 50707 1 158 . 1 . 1 35 35 GLY CA C 13 44.099 0.000 . 1 . . . . . 33 GLY CA . 50707 1 159 . 1 . 1 35 35 GLY N N 15 108.394 0.000 . 1 . . . . . 33 GLY N . 50707 1 160 . 1 . 1 36 36 GLU H H 1 8.636 0.000 . 1 . . . . . 34 GLU H . 50707 1 161 . 1 . 1 36 36 GLU C C 13 178.590 0.000 . 1 . . . . . 34 GLU C . 50707 1 162 . 1 . 1 36 36 GLU CA C 13 58.167 0.000 . 1 . . . . . 34 GLU CA . 50707 1 163 . 1 . 1 36 36 GLU CB C 13 28.798 0.000 . 1 . . . . . 34 GLU CB . 50707 1 164 . 1 . 1 36 36 GLU N N 15 121.086 0.000 . 1 . . . . . 34 GLU N . 50707 1 165 . 1 . 1 37 37 GLU H H 1 8.482 0.000 . 1 . . . . . 35 GLU H . 50707 1 166 . 1 . 1 37 37 GLU C C 13 177.192 0.000 . 1 . . . . . 35 GLU C . 50707 1 167 . 1 . 1 37 37 GLU CA C 13 59.483 0.000 . 1 . . . . . 35 GLU CA . 50707 1 168 . 1 . 1 37 37 GLU CB C 13 27.804 0.000 . 1 . . . . . 35 GLU CB . 50707 1 169 . 1 . 1 37 37 GLU N N 15 120.117 0.000 . 1 . . . . . 35 GLU N . 50707 1 170 . 1 . 1 38 38 GLN H H 1 8.099 0.000 . 1 . . . . . 36 GLN H . 50707 1 171 . 1 . 1 38 38 GLN C C 13 178.093 0.000 . 1 . . . . . 36 GLN C . 50707 1 172 . 1 . 1 38 38 GLN CA C 13 59.239 0.000 . 1 . . . . . 36 GLN CA . 50707 1 173 . 1 . 1 38 38 GLN CB C 13 27.671 0.000 . 1 . . . . . 36 GLN CB . 50707 1 174 . 1 . 1 38 38 GLN N N 15 117.102 0.000 . 1 . . . . . 36 GLN N . 50707 1 175 . 1 . 1 39 39 ALA H H 1 7.477 0.000 . 1 . . . . . 37 ALA H . 50707 1 176 . 1 . 1 39 39 ALA C C 13 180.661 0.000 . 1 . . . . . 37 ALA C . 50707 1 177 . 1 . 1 39 39 ALA CA C 13 54.721 0.000 . 1 . . . . . 37 ALA CA . 50707 1 178 . 1 . 1 39 39 ALA CB C 13 17.064 0.000 . 1 . . . . . 37 ALA CB . 50707 1 179 . 1 . 1 39 39 ALA N N 15 120.964 0.000 . 1 . . . . . 37 ALA N . 50707 1 180 . 1 . 1 40 40 GLN H H 1 7.914 0.000 . 1 . . . . . 38 GLN H . 50707 1 181 . 1 . 1 40 40 GLN C C 13 179.572 0.000 . 1 . . . . . 38 GLN C . 50707 1 182 . 1 . 1 40 40 GLN CA C 13 58.167 0.000 . 1 . . . . . 38 GLN CA . 50707 1 183 . 1 . 1 40 40 GLN CB C 13 26.644 0.000 . 1 . . . . . 38 GLN CB . 50707 1 184 . 1 . 1 40 40 GLN N N 15 118.815 0.000 . 1 . . . . . 38 GLN N . 50707 1 185 . 1 . 1 41 41 TYR H H 1 8.072 0.000 . 1 . . . . . 39 TYR H . 50707 1 186 . 1 . 1 41 41 TYR C C 13 178.483 0.000 . 1 . . . . . 39 TYR C . 50707 1 187 . 1 . 1 41 41 TYR CA C 13 58.140 0.000 . 1 . . . . . 39 TYR CA . 50707 1 188 . 1 . 1 41 41 TYR CB C 13 35.759 0.000 . 1 . . . . . 39 TYR CB . 50707 1 189 . 1 . 1 41 41 TYR N N 15 120.374 0.000 . 1 . . . . . 39 TYR N . 50707 1 190 . 1 . 1 42 42 CYS H H 1 8.336 0.000 . 1 . . . . . 40 CYS H . 50707 1 191 . 1 . 1 42 42 CYS C C 13 177.192 0.000 . 1 . . . . . 40 CYS C . 50707 1 192 . 1 . 1 42 42 CYS CA C 13 64.489 0.000 . 1 . . . . . 40 CYS CA . 50707 1 193 . 1 . 1 42 42 CYS CB C 13 25.484 0.000 . 1 . . . . . 40 CYS CB . 50707 1 194 . 1 . 1 42 42 CYS N N 15 119.430 0.000 . 1 . . . . . 40 CYS N . 50707 1 195 . 1 . 1 43 43 ARG H H 1 7.694 0.000 . 1 . . . . . 41 ARG H . 50707 1 196 . 1 . 1 43 43 ARG C C 13 179.101 0.000 . 1 . . . . . 41 ARG C . 50707 1 197 . 1 . 1 43 43 ARG CA C 13 59.007 0.000 . 1 . . . . . 41 ARG CA . 50707 1 198 . 1 . 1 43 43 ARG CB C 13 28.599 0.000 . 1 . . . . . 41 ARG CB . 50707 1 199 . 1 . 1 43 43 ARG N N 15 120.882 0.000 . 1 . . . . . 41 ARG N . 50707 1 200 . 1 . 1 44 44 ALA H H 1 7.777 0.000 . 1 . . . . . 42 ALA H . 50707 1 201 . 1 . 1 44 44 ALA C C 13 178.752 0.000 . 1 . . . . . 42 ALA C . 50707 1 202 . 1 . 1 44 44 ALA CA C 13 54.355 0.000 . 1 . . . . . 42 ALA CA . 50707 1 203 . 1 . 1 44 44 ALA CB C 13 16.783 0.000 . 1 . . . . . 42 ALA CB . 50707 1 204 . 1 . 1 44 44 ALA N N 15 123.173 0.000 . 1 . . . . . 42 ALA N . 50707 1 205 . 1 . 1 47 47 GLU C C 13 179.697 0.000 . 1 . . . . . 45 GLU C . 50707 1 206 . 1 . 1 47 47 GLU CA C 13 58.506 0.000 . 1 . . . . . 45 GLU CA . 50707 1 207 . 1 . 1 47 47 GLU CB C 13 28.069 0.000 . 1 . . . . . 45 GLU CB . 50707 1 208 . 1 . 1 48 48 LEU H H 1 8.816 0.000 . 1 . . . . . 46 LEU H . 50707 1 209 . 1 . 1 48 48 LEU C C 13 177.421 0.000 . 1 . . . . . 46 LEU C . 50707 1 210 . 1 . 1 48 48 LEU CA C 13 57.285 0.000 . 1 . . . . . 46 LEU CA . 50707 1 211 . 1 . 1 48 48 LEU CB C 13 40.399 0.000 . 1 . . . . . 46 LEU CB . 50707 1 212 . 1 . 1 48 48 LEU N N 15 123.437 0.000 . 1 . . . . . 46 LEU N . 50707 1 213 . 1 . 1 49 49 SER H H 1 7.771 0.000 . 1 . . . . . 47 SER H . 50707 1 214 . 1 . 1 49 49 SER C C 13 178.752 0.000 . 1 . . . . . 47 SER C . 50707 1 215 . 1 . 1 49 49 SER CA C 13 60.948 0.000 . 1 . . . . . 47 SER CA . 50707 1 216 . 1 . 1 49 49 SER CB C 13 63.072 0.000 . 1 . . . . . 47 SER CB . 50707 1 217 . 1 . 1 49 49 SER N N 15 113.268 0.000 . 1 . . . . . 47 SER N . 50707 1 218 . 1 . 1 50 50 LYS H H 1 7.864 0.000 . 1 . . . . . 48 LYS H . 50707 1 219 . 1 . 1 50 50 LYS C C 13 178.846 0.000 . 1 . . . . . 48 LYS C . 50707 1 220 . 1 . 1 50 50 LYS CA C 13 59.361 0.000 . 1 . . . . . 48 LYS CA . 50707 1 221 . 1 . 1 50 50 LYS CB C 13 31.450 0.000 . 1 . . . . . 48 LYS CB . 50707 1 222 . 1 . 1 50 50 LYS N N 15 119.841 0.000 . 1 . . . . . 48 LYS N . 50707 1 223 . 1 . 1 51 51 LEU H H 1 8.243 0.000 . 1 . . . . . 49 LEU H . 50707 1 224 . 1 . 1 51 51 LEU C C 13 177.569 0.000 . 1 . . . . . 49 LEU C . 50707 1 225 . 1 . 1 51 51 LEU CA C 13 57.041 0.000 . 1 . . . . . 49 LEU CA . 50707 1 226 . 1 . 1 51 51 LEU CB C 13 40.060 0.000 . 1 . . . . . 49 LEU CB . 50707 1 227 . 1 . 1 51 51 LEU N N 15 124.162 0.000 . 1 . . . . . 49 LEU N . 50707 1 228 . 1 . 1 52 52 ARG H H 1 7.864 0.000 . 1 . . . . . 50 ARG H . 50707 1 229 . 1 . 1 52 52 ARG C C 13 178.281 0.000 . 1 . . . . . 50 ARG C . 50707 1 230 . 1 . 1 52 52 ARG CA C 13 60.093 0.000 . 1 . . . . . 50 ARG CA . 50707 1 231 . 1 . 1 52 52 ARG CB C 13 28.069 0.000 . 1 . . . . . 50 ARG CB . 50707 1 232 . 1 . 1 52 52 ARG N N 15 119.495 0.000 . 1 . . . . . 50 ARG N . 50707 1 233 . 1 . 1 53 53 ARG H H 1 7.024 0.000 . 1 . . . . . 51 ARG H . 50707 1 234 . 1 . 1 53 53 ARG C C 13 178.927 0.000 . 1 . . . . . 51 ARG C . 50707 1 235 . 1 . 1 53 53 ARG CA C 13 59.117 0.000 . 1 . . . . . 51 ARG CA . 50707 1 236 . 1 . 1 53 53 ARG CB C 13 29.063 0.000 . 1 . . . . . 51 ARG CB . 50707 1 237 . 1 . 1 53 53 ARG N N 15 116.130 0.000 . 1 . . . . . 51 ARG N . 50707 1 238 . 1 . 1 54 54 ALA H H 1 7.675 0.000 . 1 . . . . . 52 ALA H . 50707 1 239 . 1 . 1 54 54 ALA C C 13 178.322 0.000 . 1 . . . . . 52 ALA C . 50707 1 240 . 1 . 1 54 54 ALA CA C 13 53.754 0.000 . 1 . . . . . 52 ALA CA . 50707 1 241 . 1 . 1 54 54 ALA CB C 13 17.661 0.000 . 1 . . . . . 52 ALA CB . 50707 1 242 . 1 . 1 54 54 ALA N N 15 120.614 0.000 . 1 . . . . . 52 ALA N . 50707 1 243 . 1 . 1 55 55 ALA H H 1 8.149 0.000 . 1 . . . . . 53 ALA H . 50707 1 244 . 1 . 1 55 55 ALA C C 13 178.227 0.000 . 1 . . . . . 53 ALA C . 50707 1 245 . 1 . 1 55 55 ALA CA C 13 53.866 0.000 . 1 . . . . . 53 ALA CA . 50707 1 246 . 1 . 1 55 55 ALA CB C 13 19.451 0.000 . 1 . . . . . 53 ALA CB . 50707 1 247 . 1 . 1 55 55 ALA N N 15 119.054 0.000 . 1 . . . . . 53 ALA N . 50707 1 248 . 1 . 1 56 56 VAL H H 1 8.111 0.000 . 1 . . . . . 54 VAL H . 50707 1 249 . 1 . 1 56 56 VAL C C 13 177.023 0.000 . 1 . . . . . 54 VAL C . 50707 1 250 . 1 . 1 56 56 VAL CA C 13 58.937 0.000 . 1 . . . . . 54 VAL CA . 50707 1 251 . 1 . 1 56 56 VAL CB C 13 32.312 0.000 . 1 . . . . . 54 VAL CB . 50707 1 252 . 1 . 1 56 56 VAL N N 15 104.351 0.000 . 1 . . . . . 54 VAL N . 50707 1 253 . 1 . 1 57 57 GLY H H 1 7.634 0.000 . 1 . . . . . 55 GLY H . 50707 1 254 . 1 . 1 57 57 GLY C C 13 173.656 0.000 . 1 . . . . . 55 GLY C . 50707 1 255 . 1 . 1 57 57 GLY CA C 13 45.808 0.000 . 1 . . . . . 55 GLY CA . 50707 1 256 . 1 . 1 57 57 GLY N N 15 110.926 0.000 . 1 . . . . . 55 GLY N . 50707 1 257 . 1 . 1 58 58 ARG H H 1 7.649 0.000 . 1 . . . . . 56 ARG H . 50707 1 258 . 1 . 1 58 58 ARG C C 13 173.226 0.000 . 1 . . . . . 56 ARG C . 50707 1 259 . 1 . 1 58 58 ARG CA C 13 52.768 0.000 . 1 . . . . . 56 ARG CA . 50707 1 260 . 1 . 1 58 58 ARG CB C 13 29.527 0.000 . 1 . . . . . 56 ARG CB . 50707 1 261 . 1 . 1 58 58 ARG N N 15 119.246 0.000 . 1 . . . . . 56 ARG N . 50707 1 262 . 1 . 1 59 59 PRO C C 13 176.722 0.000 . 1 . . . . . 57 PRO C . 50707 1 263 . 1 . 1 59 59 PRO CA C 13 62.657 0.000 . 1 . . . . . 57 PRO CA . 50707 1 264 . 1 . 1 59 59 PRO CB C 13 30.522 0.000 . 1 . . . . . 57 PRO CB . 50707 1 265 . 1 . 1 60 60 LEU H H 1 7.698 0.000 . 1 . . . . . 58 LEU H . 50707 1 266 . 1 . 1 60 60 LEU C C 13 176.720 0.000 . 1 . . . . . 58 LEU C . 50707 1 267 . 1 . 1 60 60 LEU CA C 13 53.744 0.000 . 1 . . . . . 58 LEU CA . 50707 1 268 . 1 . 1 60 60 LEU CB C 13 42.441 0.000 . 1 . . . . . 58 LEU CB . 50707 1 269 . 1 . 1 60 60 LEU N N 15 124.430 0.000 . 1 . . . . . 58 LEU N . 50707 1 270 . 1 . 1 61 61 ASP H H 1 7.957 0.000 . 1 . . . . . 59 ASP H . 50707 1 271 . 1 . 1 61 61 ASP C C 13 174.880 0.000 . 1 . . . . . 59 ASP C . 50707 1 272 . 1 . 1 61 61 ASP CA C 13 53.256 0.000 . 1 . . . . . 59 ASP CA . 50707 1 273 . 1 . 1 61 61 ASP CB C 13 41.062 0.000 . 1 . . . . . 59 ASP CB . 50707 1 274 . 1 . 1 61 61 ASP N N 15 121.622 0.000 . 1 . . . . . 59 ASP N . 50707 1 275 . 1 . 1 62 62 LYS H H 1 8.067 0.000 . 1 . . . . . 60 LYS H . 50707 1 276 . 1 . 1 62 62 LYS C C 13 175.458 0.000 . 1 . . . . . 60 LYS C . 50707 1 277 . 1 . 1 62 62 LYS CA C 13 54.477 0.000 . 1 . . . . . 60 LYS CA . 50707 1 278 . 1 . 1 62 62 LYS CB C 13 29.461 0.000 . 1 . . . . . 60 LYS CB . 50707 1 279 . 1 . 1 62 62 LYS N N 15 119.685 0.000 . 1 . . . . . 60 LYS N . 50707 1 280 . 1 . 1 63 63 HIS H H 1 7.804 0.000 . 1 . . . . . 61 HIS H . 50707 1 281 . 1 . 1 63 63 HIS C C 13 175.636 0.000 . 1 . . . . . 61 HIS C . 50707 1 282 . 1 . 1 63 63 HIS CA C 13 54.688 0.000 . 1 . . . . . 61 HIS CA . 50707 1 283 . 1 . 1 63 63 HIS CB C 13 32.245 0.000 . 1 . . . . . 61 HIS CB . 50707 1 284 . 1 . 1 63 63 HIS N N 15 119.391 0.000 . 1 . . . . . 61 HIS N . 50707 1 285 . 1 . 1 64 64 GLU H H 1 9.038 0.000 . 1 . . . . . 62 GLU H . 50707 1 286 . 1 . 1 64 64 GLU C C 13 178.227 0.000 . 1 . . . . . 62 GLU C . 50707 1 287 . 1 . 1 64 64 GLU CA C 13 59.239 0.000 . 1 . . . . . 62 GLU CA . 50707 1 288 . 1 . 1 64 64 GLU CB C 13 28.533 0.000 . 1 . . . . . 62 GLU CB . 50707 1 289 . 1 . 1 64 64 GLU N N 15 122.373 0.000 . 1 . . . . . 62 GLU N . 50707 1 290 . 1 . 1 65 65 GLY H H 1 9.075 0.000 . 1 . . . . . 63 GLY H . 50707 1 291 . 1 . 1 65 65 GLY C C 13 176.378 0.000 . 1 . . . . . 63 GLY C . 50707 1 292 . 1 . 1 65 65 GLY CA C 13 46.296 0.000 . 1 . . . . . 63 GLY CA . 50707 1 293 . 1 . 1 65 65 GLY N N 15 110.633 0.000 . 1 . . . . . 63 GLY N . 50707 1 294 . 1 . 1 66 66 ALA H H 1 7.532 0.000 . 1 . . . . . 64 ALA H . 50707 1 295 . 1 . 1 66 66 ALA C C 13 179.892 0.000 . 1 . . . . . 64 ALA C . 50707 1 296 . 1 . 1 66 66 ALA CA C 13 54.034 0.000 . 1 . . . . . 64 ALA CA . 50707 1 297 . 1 . 1 66 66 ALA CB C 13 18.286 0.000 . 1 . . . . . 64 ALA CB . 50707 1 298 . 1 . 1 66 66 ALA N N 15 126.291 0.000 . 1 . . . . . 64 ALA N . 50707 1 299 . 1 . 1 67 67 LEU H H 1 7.560 0.000 . 1 . . . . . 65 LEU H . 50707 1 300 . 1 . 1 67 67 LEU C C 13 177.757 0.000 . 1 . . . . . 65 LEU C . 50707 1 301 . 1 . 1 67 67 LEU CA C 13 57.326 0.000 . 1 . . . . . 65 LEU CA . 50707 1 302 . 1 . 1 67 67 LEU CB C 13 39.840 0.000 . 1 . . . . . 65 LEU CB . 50707 1 303 . 1 . 1 67 67 LEU N N 15 119.187 0.000 . 1 . . . . . 65 LEU N . 50707 1 304 . 1 . 1 68 68 GLU H H 1 8.168 0.000 . 1 . . . . . 66 GLU H . 50707 1 305 . 1 . 1 68 68 GLU C C 13 178.443 0.000 . 1 . . . . . 66 GLU C . 50707 1 306 . 1 . 1 68 68 GLU CA C 13 59.239 0.000 . 1 . . . . . 66 GLU CA . 50707 1 307 . 1 . 1 68 68 GLU CB C 13 28.135 0.000 . 1 . . . . . 66 GLU CB . 50707 1 308 . 1 . 1 68 68 GLU N N 15 117.880 0.000 . 1 . . . . . 66 GLU N . 50707 1 309 . 1 . 1 69 69 THR H H 1 7.452 0.000 . 1 . . . . . 67 THR H . 50707 1 310 . 1 . 1 69 69 THR C C 13 175.201 0.000 . 1 . . . . . 67 THR C . 50707 1 311 . 1 . 1 69 69 THR CA C 13 66.747 0.000 . 1 . . . . . 67 THR CA . 50707 1 312 . 1 . 1 69 69 THR CB C 13 68.117 0.000 . 1 . . . . . 67 THR CB . 50707 1 313 . 1 . 1 69 69 THR N N 15 116.696 0.000 . 1 . . . . . 67 THR N . 50707 1 314 . 1 . 1 70 70 LEU H H 1 7.240 0.000 . 1 . . . . . 68 LEU H . 50707 1 315 . 1 . 1 70 70 LEU C C 13 178.174 0.000 . 1 . . . . . 68 LEU C . 50707 1 316 . 1 . 1 70 70 LEU CA C 13 58.384 0.000 . 1 . . . . . 68 LEU CA . 50707 1 317 . 1 . 1 70 70 LEU CB C 13 41.740 0.000 . 1 . . . . . 68 LEU CB . 50707 1 318 . 1 . 1 70 70 LEU N N 15 124.872 0.000 . 1 . . . . . 68 LEU N . 50707 1 319 . 1 . 1 71 71 LEU H H 1 8.716 0.000 . 1 . . . . . 69 LEU H . 50707 1 320 . 1 . 1 71 71 LEU C C 13 178.151 0.000 . 1 . . . . . 69 LEU C . 50707 1 321 . 1 . 1 71 71 LEU CA C 13 57.256 0.000 . 1 . . . . . 69 LEU CA . 50707 1 322 . 1 . 1 71 71 LEU CB C 13 40.604 0.000 . 1 . . . . . 69 LEU CB . 50707 1 323 . 1 . 1 71 71 LEU N N 15 118.013 0.000 . 1 . . . . . 69 LEU N . 50707 1 324 . 1 . 1 72 72 ARG H H 1 8.384 0.000 . 1 . . . . . 70 ARG H . 50707 1 325 . 1 . 1 72 72 ARG C C 13 178.397 0.000 . 1 . . . . . 70 ARG C . 50707 1 326 . 1 . 1 72 72 ARG CA C 13 58.867 0.000 . 1 . . . . . 70 ARG CA . 50707 1 327 . 1 . 1 72 72 ARG CB C 13 28.865 0.000 . 1 . . . . . 70 ARG CB . 50707 1 328 . 1 . 1 72 72 ARG N N 15 119.698 0.000 . 1 . . . . . 70 ARG N . 50707 1 329 . 1 . 1 73 73 TYR H H 1 8.101 0.000 . 1 . . . . . 71 TYR H . 50707 1 330 . 1 . 1 73 73 TYR C C 13 176.372 0.000 . 1 . . . . . 71 TYR C . 50707 1 331 . 1 . 1 73 73 TYR CA C 13 61.389 0.000 . 1 . . . . . 71 TYR CA . 50707 1 332 . 1 . 1 73 73 TYR CB C 13 37.284 0.000 . 1 . . . . . 71 TYR CB . 50707 1 333 . 1 . 1 73 73 TYR N N 15 120.051 0.000 . 1 . . . . . 71 TYR N . 50707 1 334 . 1 . 1 74 74 TYR H H 1 8.211 0.000 . 1 . . . . . 72 TYR H . 50707 1 335 . 1 . 1 74 74 TYR C C 13 177.152 0.000 . 1 . . . . . 72 TYR C . 50707 1 336 . 1 . 1 74 74 TYR CA C 13 62.779 0.000 . 1 . . . . . 72 TYR CA . 50707 1 337 . 1 . 1 74 74 TYR CB C 13 36.687 0.000 . 1 . . . . . 72 TYR CB . 50707 1 338 . 1 . 1 74 74 TYR N N 15 119.944 0.000 . 1 . . . . . 72 TYR N . 50707 1 339 . 1 . 1 75 75 ASP H H 1 8.588 0.000 . 1 . . . . . 73 ASP H . 50707 1 340 . 1 . 1 75 75 ASP C C 13 179.948 0.000 . 1 . . . . . 73 ASP C . 50707 1 341 . 1 . 1 75 75 ASP CA C 13 56.797 0.000 . 1 . . . . . 73 ASP CA . 50707 1 342 . 1 . 1 75 75 ASP CB C 13 38.989 0.000 . 1 . . . . . 73 ASP CB . 50707 1 343 . 1 . 1 75 75 ASP N N 15 121.464 0.000 . 1 . . . . . 73 ASP N . 50707 1 344 . 1 . 1 76 76 GLN H H 1 8.851 0.000 . 1 . . . . . 74 GLN H . 50707 1 345 . 1 . 1 76 76 GLN C C 13 179.357 0.000 . 1 . . . . . 74 GLN C . 50707 1 346 . 1 . 1 76 76 GLN CA C 13 57.285 0.000 . 1 . . . . . 74 GLN CA . 50707 1 347 . 1 . 1 76 76 GLN CB C 13 28.545 0.000 . 1 . . . . . 74 GLN CB . 50707 1 348 . 1 . 1 76 76 GLN N N 15 121.404 0.000 . 1 . . . . . 74 GLN N . 50707 1 349 . 1 . 1 77 77 ILE H H 1 8.539 0.000 . 1 . . . . . 75 ILE H . 50707 1 350 . 1 . 1 77 77 ILE C C 13 177.945 0.000 . 1 . . . . . 75 ILE C . 50707 1 351 . 1 . 1 77 77 ILE CA C 13 62.779 0.000 . 1 . . . . . 75 ILE CA . 50707 1 352 . 1 . 1 77 77 ILE CB C 13 35.162 0.000 . 1 . . . . . 75 ILE CB . 50707 1 353 . 1 . 1 77 77 ILE N N 15 121.827 0.000 . 1 . . . . . 75 ILE N . 50707 1 354 . 1 . 1 78 78 CYS H H 1 7.762 0.000 . 1 . . . . . 76 CYS H . 50707 1 355 . 1 . 1 78 78 CYS C C 13 178.638 0.000 . 1 . . . . . 76 CYS C . 50707 1 356 . 1 . 1 78 78 CYS CA C 13 63.512 0.000 . 1 . . . . . 76 CYS CA . 50707 1 357 . 1 . 1 78 78 CYS CB C 13 25.603 0.000 . 1 . . . . . 76 CYS CB . 50707 1 358 . 1 . 1 78 78 CYS N N 15 118.235 0.000 . 1 . . . . . 76 CYS N . 50707 1 359 . 1 . 1 79 79 SER H H 1 7.685 0.000 . 1 . . . . . 77 SER H . 50707 1 360 . 1 . 1 79 79 SER CA C 13 61.436 0.000 . 1 . . . . . 77 SER CA . 50707 1 361 . 1 . 1 79 79 SER CB C 13 62.475 0.000 . 1 . . . . . 77 SER CB . 50707 1 362 . 1 . 1 79 79 SER N N 15 113.162 0.000 . 1 . . . . . 77 SER N . 50707 1 363 . 1 . 1 91 91 ILE C C 13 174.550 0.000 . 1 . . . . . 89 ILE C . 50707 1 364 . 1 . 1 91 91 ILE CA C 13 60.649 0.000 . 1 . . . . . 89 ILE CA . 50707 1 365 . 1 . 1 91 91 ILE CB C 13 36.087 0.000 . 1 . . . . . 89 ILE CB . 50707 1 366 . 1 . 1 92 92 CYS H H 1 8.288 0.000 . 1 . . . . . 90 CYS H . 50707 1 367 . 1 . 1 92 92 CYS C C 13 173.092 0.000 . 1 . . . . . 90 CYS C . 50707 1 368 . 1 . 1 92 92 CYS CA C 13 57.774 0.000 . 1 . . . . . 90 CYS CA . 50707 1 369 . 1 . 1 92 92 CYS CB C 13 25.890 0.000 . 1 . . . . . 90 CYS CB . 50707 1 370 . 1 . 1 92 92 CYS N N 15 127.988 0.000 . 1 . . . . . 90 CYS N . 50707 1 371 . 1 . 1 93 93 LEU H H 1 7.621 0.000 . 1 . . . . . 91 LEU H . 50707 1 372 . 1 . 1 93 93 LEU C C 13 173.831 0.000 . 1 . . . . . 91 LEU C . 50707 1 373 . 1 . 1 93 93 LEU CA C 13 53.456 0.000 . 1 . . . . . 91 LEU CA . 50707 1 374 . 1 . 1 93 93 LEU CB C 13 43.451 0.000 . 1 . . . . . 91 LEU CB . 50707 1 375 . 1 . 1 93 93 LEU N N 15 128.835 0.000 . 1 . . . . . 91 LEU N . 50707 1 376 . 1 . 1 94 94 THR H H 1 7.574 0.000 . 1 . . . . . 92 THR H . 50707 1 377 . 1 . 1 94 94 THR C C 13 172.904 0.000 . 1 . . . . . 92 THR C . 50707 1 378 . 1 . 1 94 94 THR CA C 13 61.925 0.000 . 1 . . . . . 92 THR CA . 50707 1 379 . 1 . 1 94 94 THR CB C 13 69.104 0.000 . 1 . . . . . 92 THR CB . 50707 1 380 . 1 . 1 94 94 THR N N 15 117.014 0.000 . 1 . . . . . 92 THR N . 50707 1 381 . 1 . 1 95 95 PHE H H 1 8.240 0.000 . 1 . . . . . 93 PHE H . 50707 1 382 . 1 . 1 95 95 PHE C C 13 175.068 0.000 . 1 . . . . . 93 PHE C . 50707 1 383 . 1 . 1 95 95 PHE CA C 13 56.362 0.000 . 1 . . . . . 93 PHE CA . 50707 1 384 . 1 . 1 95 95 PHE CB C 13 40.722 0.000 . 1 . . . . . 93 PHE CB . 50707 1 385 . 1 . 1 95 95 PHE N N 15 127.173 0.000 . 1 . . . . . 93 PHE N . 50707 1 386 . 1 . 1 96 96 THR H H 1 9.303 0.000 . 1 . . . . . 94 THR H . 50707 1 387 . 1 . 1 96 96 THR C C 13 174.060 0.000 . 1 . . . . . 94 THR C . 50707 1 388 . 1 . 1 96 96 THR CA C 13 62.657 0.000 . 1 . . . . . 94 THR CA . 50707 1 389 . 1 . 1 96 96 THR CB C 13 68.242 0.000 . 1 . . . . . 94 THR CB . 50707 1 390 . 1 . 1 96 96 THR N N 15 121.659 0.000 . 1 . . . . . 94 THR N . 50707 1 391 . 1 . 1 97 97 TRP H H 1 8.226 0.000 . 1 . . . . . 95 TRP H . 50707 1 392 . 1 . 1 97 97 TRP C C 13 173.791 0.000 . 1 . . . . . 95 TRP C . 50707 1 393 . 1 . 1 97 97 TRP CA C 13 55.699 0.000 . 1 . . . . . 95 TRP CA . 50707 1 394 . 1 . 1 97 97 TRP CB C 13 32.412 0.000 . 1 . . . . . 95 TRP CB . 50707 1 395 . 1 . 1 97 97 TRP N N 15 128.084 0.000 . 1 . . . . . 95 TRP N . 50707 1 396 . 1 . 1 98 98 LYS H H 1 8.485 0.000 . 1 . . . . . 96 LYS H . 50707 1 397 . 1 . 1 98 98 LYS C C 13 177.757 0.000 . 1 . . . . . 96 LYS C . 50707 1 398 . 1 . 1 98 98 LYS CA C 13 53.998 0.000 . 1 . . . . . 96 LYS CA . 50707 1 399 . 1 . 1 98 98 LYS CB C 13 34.035 0.000 . 1 . . . . . 96 LYS CB . 50707 1 400 . 1 . 1 98 98 LYS N N 15 120.051 0.000 . 1 . . . . . 96 LYS N . 50707 1 401 . 1 . 1 99 99 ASP H H 1 8.518 0.000 . 1 . . . . . 97 ASP H . 50707 1 402 . 1 . 1 99 99 ASP C C 13 177.905 0.000 . 1 . . . . . 97 ASP C . 50707 1 403 . 1 . 1 99 99 ASP CA C 13 54.237 0.000 . 1 . . . . . 97 ASP CA . 50707 1 404 . 1 . 1 99 99 ASP CB C 13 43.611 0.000 . 1 . . . . . 97 ASP CB . 50707 1 405 . 1 . 1 99 99 ASP N N 15 127.753 0.000 . 1 . . . . . 97 ASP N . 50707 1 406 . 1 . 1 100 100 ALA H H 1 9.528 0.000 . 1 . . . . . 98 ALA H . 50707 1 407 . 1 . 1 100 100 ALA C C 13 178.268 0.000 . 1 . . . . . 98 ALA C . 50707 1 408 . 1 . 1 100 100 ALA CA C 13 53.746 0.000 . 1 . . . . . 98 ALA CA . 50707 1 409 . 1 . 1 100 100 ALA CB C 13 18.185 0.000 . 1 . . . . . 98 ALA CB . 50707 1 410 . 1 . 1 100 100 ALA N N 15 131.086 0.000 . 1 . . . . . 98 ALA N . 50707 1 411 . 1 . 1 101 101 PHE H H 1 8.891 0.000 . 1 . . . . . 99 PHE H . 50707 1 412 . 1 . 1 101 101 PHE C C 13 175.848 0.000 . 1 . . . . . 99 PHE C . 50707 1 413 . 1 . 1 101 101 PHE CA C 13 55.454 0.000 . 1 . . . . . 99 PHE CA . 50707 1 414 . 1 . 1 101 101 PHE CB C 13 38.278 0.000 . 1 . . . . . 99 PHE CB . 50707 1 415 . 1 . 1 101 101 PHE N N 15 116.135 0.000 . 1 . . . . . 99 PHE N . 50707 1 416 . 1 . 1 102 102 ASP H H 1 7.982 0.000 . 1 . . . . . 100 ASP H . 50707 1 417 . 1 . 1 102 102 ASP C C 13 176.453 0.000 . 1 . . . . . 100 ASP C . 50707 1 418 . 1 . 1 102 102 ASP CA C 13 54.405 0.000 . 1 . . . . . 100 ASP CA . 50707 1 419 . 1 . 1 102 102 ASP CB C 13 41.062 0.000 . 1 . . . . . 100 ASP CB . 50707 1 420 . 1 . 1 102 102 ASP N N 15 121.348 0.000 . 1 . . . . . 100 ASP N . 50707 1 421 . 1 . 1 103 103 LYS H H 1 8.541 0.000 . 1 . . . . . 101 LYS H . 50707 1 422 . 1 . 1 103 103 LYS C C 13 177.407 0.000 . 1 . . . . . 101 LYS C . 50707 1 423 . 1 . 1 103 103 LYS CA C 13 55.820 0.000 . 1 . . . . . 101 LYS CA . 50707 1 424 . 1 . 1 103 103 LYS CB C 13 31.649 0.000 . 1 . . . . . 101 LYS CB . 50707 1 425 . 1 . 1 103 103 LYS N N 15 124.975 0.000 . 1 . . . . . 101 LYS N . 50707 1 426 . 1 . 1 104 104 GLY H H 1 8.517 0.000 . 1 . . . . . 102 GLY H . 50707 1 427 . 1 . 1 104 104 GLY C C 13 174.557 0.000 . 1 . . . . . 102 GLY C . 50707 1 428 . 1 . 1 104 104 GLY CA C 13 44.953 0.000 . 1 . . . . . 102 GLY CA . 50707 1 429 . 1 . 1 104 104 GLY N N 15 109.694 0.000 . 1 . . . . . 102 GLY N . 50707 1 430 . 1 . 1 105 105 SER H H 1 8.137 0.000 . 1 . . . . . 103 SER H . 50707 1 431 . 1 . 1 105 105 SER C C 13 175.350 0.000 . 1 . . . . . 103 SER C . 50707 1 432 . 1 . 1 105 105 SER CA C 13 58.140 0.000 . 1 . . . . . 103 SER CA . 50707 1 433 . 1 . 1 105 105 SER CB C 13 63.337 0.000 . 1 . . . . . 103 SER CB . 50707 1 434 . 1 . 1 105 105 SER N N 15 116.185 0.000 . 1 . . . . . 103 SER N . 50707 1 435 . 1 . 1 106 106 LEU H H 1 8.277 0.000 . 1 . . . . . 104 LEU H . 50707 1 436 . 1 . 1 106 106 LEU C C 13 177.528 0.000 . 1 . . . . . 104 LEU C . 50707 1 437 . 1 . 1 106 106 LEU CA C 13 55.698 0.000 . 1 . . . . . 104 LEU CA . 50707 1 438 . 1 . 1 106 106 LEU CB C 13 40.782 0.000 . 1 . . . . . 104 LEU CB . 50707 1 439 . 1 . 1 106 106 LEU N N 15 123.873 0.000 . 1 . . . . . 104 LEU N . 50707 1 440 . 1 . 1 107 107 PHE H H 1 8.027 0.000 . 1 . . . . . 105 PHE H . 50707 1 441 . 1 . 1 107 107 PHE C C 13 176.439 0.000 . 1 . . . . . 105 PHE C . 50707 1 442 . 1 . 1 107 107 PHE CA C 13 57.285 0.000 . 1 . . . . . 105 PHE CA . 50707 1 443 . 1 . 1 107 107 PHE CB C 13 38.145 0.000 . 1 . . . . . 105 PHE CB . 50707 1 444 . 1 . 1 107 107 PHE N N 15 118.643 0.000 . 1 . . . . . 105 PHE N . 50707 1 445 . 1 . 1 108 108 GLY H H 1 7.937 0.000 . 1 . . . . . 106 GLY H . 50707 1 446 . 1 . 1 108 108 GLY C C 13 174.638 0.000 . 1 . . . . . 106 GLY C . 50707 1 447 . 1 . 1 108 108 GLY CA C 13 44.953 0.000 . 1 . . . . . 106 GLY CA . 50707 1 448 . 1 . 1 108 108 GLY N N 15 110.139 0.000 . 1 . . . . . 106 GLY N . 50707 1 449 . 1 . 1 109 109 GLY H H 1 7.840 0.000 . 1 . . . . . 107 GLY H . 50707 1 450 . 1 . 1 109 109 GLY C C 13 173.831 0.000 . 1 . . . . . 107 GLY C . 50707 1 451 . 1 . 1 109 109 GLY CA C 13 44.587 0.000 . 1 . . . . . 107 GLY CA . 50707 1 452 . 1 . 1 109 109 GLY N N 15 109.114 0.000 . 1 . . . . . 107 GLY N . 50707 1 453 . 1 . 1 110 110 SER H H 1 8.171 0.000 . 1 . . . . . 108 SER H . 50707 1 454 . 1 . 1 110 110 SER C C 13 174.530 0.000 . 1 . . . . . 108 SER C . 50707 1 455 . 1 . 1 110 110 SER CA C 13 57.774 0.000 . 1 . . . . . 108 SER CA . 50707 1 456 . 1 . 1 110 110 SER CB C 13 63.602 0.000 . 1 . . . . . 108 SER CB . 50707 1 457 . 1 . 1 110 110 SER N N 15 116.169 0.000 . 1 . . . . . 108 SER N . 50707 1 458 . 1 . 1 111 111 VAL H H 1 8.321 0.000 . 1 . . . . . 109 VAL H . 50707 1 459 . 1 . 1 111 111 VAL C C 13 174.598 0.000 . 1 . . . . . 109 VAL C . 50707 1 460 . 1 . 1 111 111 VAL CA C 13 62.535 0.000 . 1 . . . . . 109 VAL CA . 50707 1 461 . 1 . 1 111 111 VAL CB C 13 31.384 0.000 . 1 . . . . . 109 VAL CB . 50707 1 462 . 1 . 1 111 111 VAL N N 15 123.309 0.000 . 1 . . . . . 109 VAL N . 50707 1 463 . 1 . 1 112 112 LYS H H 1 8.077 0.000 . 1 . . . . . 110 LYS H . 50707 1 464 . 1 . 1 112 112 LYS C C 13 174.450 0.000 . 1 . . . . . 110 LYS C . 50707 1 465 . 1 . 1 112 112 LYS CA C 13 54.233 0.000 . 1 . . . . . 110 LYS CA . 50707 1 466 . 1 . 1 112 112 LYS CB C 13 34.367 0.000 . 1 . . . . . 110 LYS CB . 50707 1 467 . 1 . 1 112 112 LYS N N 15 123.750 0.000 . 1 . . . . . 110 LYS N . 50707 1 468 . 1 . 1 113 113 LEU H H 1 8.499 0.000 . 1 . . . . . 111 LEU H . 50707 1 469 . 1 . 1 113 113 LEU C C 13 175.095 0.000 . 1 . . . . . 111 LEU C . 50707 1 470 . 1 . 1 113 113 LEU CA C 13 54.355 0.000 . 1 . . . . . 111 LEU CA . 50707 1 471 . 1 . 1 113 113 LEU CB C 13 43.222 0.000 . 1 . . . . . 111 LEU CB . 50707 1 472 . 1 . 1 113 113 LEU N N 15 123.426 0.000 . 1 . . . . . 111 LEU N . 50707 1 473 . 1 . 1 114 114 ALA H H 1 9.153 0.000 . 1 . . . . . 112 ALA H . 50707 1 474 . 1 . 1 114 114 ALA C C 13 175.902 0.000 . 1 . . . . . 112 ALA C . 50707 1 475 . 1 . 1 114 114 ALA CA C 13 49.937 0.000 . 1 . . . . . 112 ALA CA . 50707 1 476 . 1 . 1 114 114 ALA CB C 13 20.570 0.000 . 1 . . . . . 112 ALA CB . 50707 1 477 . 1 . 1 114 114 ALA N N 15 108.434 0.000 . 1 . . . . . 112 ALA N . 50707 1 478 . 1 . 1 115 115 LEU H H 1 8.611 0.000 . 1 . . . . . 113 LEU H . 50707 1 479 . 1 . 1 115 115 LEU C C 13 176.770 0.000 . 1 . . . . . 113 LEU C . 50707 1 480 . 1 . 1 115 115 LEU CA C 13 53.500 0.000 . 1 . . . . . 113 LEU CA . 50707 1 481 . 1 . 1 115 115 LEU CB C 13 45.703 0.000 . 1 . . . . . 113 LEU CB . 50707 1 482 . 1 . 1 115 115 LEU N N 15 120.911 0.000 . 1 . . . . . 113 LEU N . 50707 1 483 . 1 . 1 116 116 ALA H H 1 8.804 0.000 . 1 . . . . . 114 ALA H . 50707 1 484 . 1 . 1 116 116 ALA C C 13 176.722 0.000 . 1 . . . . . 114 ALA C . 50707 1 485 . 1 . 1 116 116 ALA CA C 13 50.082 0.000 . 1 . . . . . 114 ALA CA . 50707 1 486 . 1 . 1 116 116 ALA CB C 13 15.978 0.000 . 1 . . . . . 114 ALA CB . 50707 1 487 . 1 . 1 116 116 ALA N N 15 130.612 0.000 . 1 . . . . . 114 ALA N . 50707 1 488 . 1 . 1 117 117 SER H H 1 7.244 0.000 . 1 . . . . . 115 SER H . 50707 1 489 . 1 . 1 117 117 SER C C 13 175.418 0.000 . 1 . . . . . 115 SER C . 50707 1 490 . 1 . 1 117 117 SER CA C 13 55.942 0.000 . 1 . . . . . 115 SER CA . 50707 1 491 . 1 . 1 117 117 SER CB C 13 63.933 0.000 . 1 . . . . . 115 SER CB . 50707 1 492 . 1 . 1 117 117 SER N N 15 113.328 0.000 . 1 . . . . . 115 SER N . 50707 1 493 . 1 . 1 118 118 LEU H H 1 9.409 0.000 . 1 . . . . . 116 LEU H . 50707 1 494 . 1 . 1 118 118 LEU C C 13 178.617 0.000 . 1 . . . . . 116 LEU C . 50707 1 495 . 1 . 1 118 118 LEU CA C 13 56.089 0.000 . 1 . . . . . 116 LEU CA . 50707 1 496 . 1 . 1 118 118 LEU CB C 13 40.137 0.000 . 1 . . . . . 116 LEU CB . 50707 1 497 . 1 . 1 118 118 LEU N N 15 131.852 0.000 . 1 . . . . . 116 LEU N . 50707 1 498 . 1 . 1 119 119 GLY H H 1 8.398 0.000 . 1 . . . . . 117 GLY H . 50707 1 499 . 1 . 1 119 119 GLY C C 13 176.439 0.000 . 1 . . . . . 117 GLY C . 50707 1 500 . 1 . 1 119 119 GLY CA C 13 46.785 0.000 . 1 . . . . . 117 GLY CA . 50707 1 501 . 1 . 1 119 119 GLY N N 15 108.236 0.000 . 1 . . . . . 117 GLY N . 50707 1 502 . 1 . 1 120 120 TYR H H 1 7.781 0.000 . 1 . . . . . 118 TYR H . 50707 1 503 . 1 . 1 120 120 TYR C C 13 175.875 0.000 . 1 . . . . . 118 TYR C . 50707 1 504 . 1 . 1 120 120 TYR CA C 13 58.342 0.000 . 1 . . . . . 118 TYR CA . 50707 1 505 . 1 . 1 120 120 TYR CB C 13 37.814 0.000 . 1 . . . . . 118 TYR CB . 50707 1 506 . 1 . 1 120 120 TYR N N 15 124.421 0.000 . 1 . . . . . 118 TYR N . 50707 1 507 . 1 . 1 121 121 GLU H H 1 6.840 0.000 . 1 . . . . . 119 GLU H . 50707 1 508 . 1 . 1 121 121 GLU C C 13 177.811 0.000 . 1 . . . . . 119 GLU C . 50707 1 509 . 1 . 1 121 121 GLU CA C 13 58.872 0.000 . 1 . . . . . 119 GLU CA . 50707 1 510 . 1 . 1 121 121 GLU CB C 13 27.075 0.000 . 1 . . . . . 119 GLU CB . 50707 1 511 . 1 . 1 121 121 GLU N N 15 121.701 0.000 . 1 . . . . . 119 GLU N . 50707 1 512 . 1 . 1 122 122 LYS H H 1 8.548 0.000 . 1 . . . . . 120 LYS H . 50707 1 513 . 1 . 1 122 122 LYS C C 13 177.972 0.000 . 1 . . . . . 120 LYS C . 50707 1 514 . 1 . 1 122 122 LYS CA C 13 59.971 0.000 . 1 . . . . . 120 LYS CA . 50707 1 515 . 1 . 1 122 122 LYS CB C 13 31.052 0.000 . 1 . . . . . 120 LYS CB . 50707 1 516 . 1 . 1 122 122 LYS N N 15 116.146 0.000 . 1 . . . . . 120 LYS N . 50707 1 517 . 1 . 1 123 123 SER C C 13 174.503 0.000 . 1 . . . . . 121 SER C . 50707 1 518 . 1 . 1 124 124 CYS H H 1 7.280 0.000 . 1 . . . . . 122 CYS H . 50707 1 519 . 1 . 1 124 124 CYS C C 13 175.636 0.000 . 1 . . . . . 122 CYS C . 50707 1 520 . 1 . 1 124 124 CYS CA C 13 63.024 0.000 . 1 . . . . . 122 CYS CA . 50707 1 521 . 1 . 1 124 124 CYS CB C 13 23.561 0.000 . 1 . . . . . 122 CYS CB . 50707 1 522 . 1 . 1 124 124 CYS N N 15 120.545 0.000 . 1 . . . . . 122 CYS N . 50707 1 523 . 1 . 1 125 125 VAL H H 1 8.166 0.000 . 1 . . . . . 123 VAL H . 50707 1 524 . 1 . 1 125 125 VAL C C 13 178.738 0.000 . 1 . . . . . 123 VAL C . 50707 1 525 . 1 . 1 125 125 VAL CA C 13 66.320 0.000 . 1 . . . . . 123 VAL CA . 50707 1 526 . 1 . 1 125 125 VAL CB C 13 30.853 0.000 . 1 . . . . . 123 VAL CB . 50707 1 527 . 1 . 1 125 125 VAL N N 15 119.410 0.000 . 1 . . . . . 123 VAL N . 50707 1 528 . 1 . 1 126 126 LEU H H 1 8.212 0.000 . 1 . . . . . 124 LEU H . 50707 1 529 . 1 . 1 126 126 LEU C C 13 178.254 0.000 . 1 . . . . . 124 LEU C . 50707 1 530 . 1 . 1 126 126 LEU CA C 13 57.221 0.000 . 1 . . . . . 124 LEU CA . 50707 1 531 . 1 . 1 126 126 LEU CB C 13 38.650 0.000 . 1 . . . . . 124 LEU CB . 50707 1 532 . 1 . 1 126 126 LEU N N 15 121.798 0.000 . 1 . . . . . 124 LEU N . 50707 1 533 . 1 . 1 127 127 PHE H H 1 7.835 0.000 . 1 . . . . . 125 PHE H . 50707 1 534 . 1 . 1 127 127 PHE C C 13 176.580 0.000 . 1 . . . . . 125 PHE C . 50707 1 535 . 1 . 1 127 127 PHE CA C 13 61.459 0.000 . 1 . . . . . 125 PHE CA . 50707 1 536 . 1 . 1 127 127 PHE CB C 13 37.284 0.000 . 1 . . . . . 125 PHE CB . 50707 1 537 . 1 . 1 127 127 PHE N N 15 121.674 0.000 . 1 . . . . . 125 PHE N . 50707 1 538 . 1 . 1 128 128 ASN H H 1 7.883 0.000 . 1 . . . . . 126 ASN H . 50707 1 539 . 1 . 1 128 128 ASN C C 13 177.797 0.000 . 1 . . . . . 126 ASN C . 50707 1 540 . 1 . 1 128 128 ASN CA C 13 55.330 0.000 . 1 . . . . . 126 ASN CA . 50707 1 541 . 1 . 1 128 128 ASN CB C 13 36.222 0.000 . 1 . . . . . 126 ASN CB . 50707 1 542 . 1 . 1 128 128 ASN N N 15 121.289 0.000 . 1 . . . . . 126 ASN N . 50707 1 543 . 1 . 1 129 129 CYS H H 1 8.426 0.000 . 1 . . . . . 127 CYS H . 50707 1 544 . 1 . 1 129 129 CYS C C 13 175.922 0.000 . 1 . . . . . 127 CYS C . 50707 1 545 . 1 . 1 129 129 CYS CA C 13 63.512 0.000 . 1 . . . . . 127 CYS CA . 50707 1 546 . 1 . 1 129 129 CYS CB C 13 26.279 0.000 . 1 . . . . . 127 CYS CB . 50707 1 547 . 1 . 1 129 129 CYS N N 15 121.115 0.000 . 1 . . . . . 127 CYS N . 50707 1 548 . 1 . 1 130 130 ALA H H 1 7.653 0.000 . 1 . . . . . 128 ALA H . 50707 1 549 . 1 . 1 130 130 ALA C C 13 178.564 0.000 . 1 . . . . . 128 ALA C . 50707 1 550 . 1 . 1 130 130 ALA CA C 13 54.174 0.000 . 1 . . . . . 128 ALA CA . 50707 1 551 . 1 . 1 130 130 ALA CB C 13 16.136 0.000 . 1 . . . . . 128 ALA CB . 50707 1 552 . 1 . 1 130 130 ALA N N 15 123.116 0.000 . 1 . . . . . 128 ALA N . 50707 1 553 . 1 . 1 131 131 ALA H H 1 9.138 0.000 . 1 . . . . . 129 ALA H . 50707 1 554 . 1 . 1 131 131 ALA C C 13 181.562 0.000 . 1 . . . . . 129 ALA C . 50707 1 555 . 1 . 1 131 131 ALA CA C 13 54.660 0.000 . 1 . . . . . 129 ALA CA . 50707 1 556 . 1 . 1 131 131 ALA CB C 13 17.649 0.000 . 1 . . . . . 129 ALA CB . 50707 1 557 . 1 . 1 131 131 ALA N N 15 121.393 0.000 . 1 . . . . . 129 ALA N . 50707 1 558 . 1 . 1 132 132 LEU H H 1 9.072 0.000 . 1 . . . . . 130 LEU H . 50707 1 559 . 1 . 1 132 132 LEU C C 13 178.819 0.000 . 1 . . . . . 130 LEU C . 50707 1 560 . 1 . 1 132 132 LEU CA C 13 57.536 0.000 . 1 . . . . . 130 LEU CA . 50707 1 561 . 1 . 1 132 132 LEU CB C 13 39.604 0.000 . 1 . . . . . 130 LEU CB . 50707 1 562 . 1 . 1 132 132 LEU N N 15 122.413 0.000 . 1 . . . . . 130 LEU N . 50707 1 563 . 1 . 1 133 133 ALA H H 1 8.061 0.000 . 1 . . . . . 131 ALA H . 50707 1 564 . 1 . 1 133 133 ALA C C 13 179.504 0.000 . 1 . . . . . 131 ALA C . 50707 1 565 . 1 . 1 133 133 ALA CA C 13 55.332 0.000 . 1 . . . . . 131 ALA CA . 50707 1 566 . 1 . 1 133 133 ALA CB C 13 17.131 0.000 . 1 . . . . . 131 ALA CB . 50707 1 567 . 1 . 1 133 133 ALA N N 15 120.934 0.000 . 1 . . . . . 131 ALA N . 50707 1 568 . 1 . 1 134 134 SER H H 1 8.503 0.000 . 1 . . . . . 132 SER H . 50707 1 569 . 1 . 1 134 134 SER CA C 13 62.017 0.000 . 1 . . . . . 132 SER CA . 50707 1 570 . 1 . 1 134 134 SER CB C 13 63.791 0.000 . 1 . . . . . 132 SER CB . 50707 1 571 . 1 . 1 134 134 SER N N 15 115.413 0.000 . 1 . . . . . 132 SER N . 50707 1 572 . 1 . 1 135 135 GLN C C 13 179.094 0.000 . 1 . . . . . 133 GLN C . 50707 1 573 . 1 . 1 135 135 GLN CB C 13 27.605 0.000 . 1 . . . . . 133 GLN CB . 50707 1 574 . 1 . 1 136 136 ILE H H 1 8.199 0.000 . 1 . . . . . 134 ILE H . 50707 1 575 . 1 . 1 136 136 ILE C C 13 179.792 0.000 . 1 . . . . . 134 ILE C . 50707 1 576 . 1 . 1 136 136 ILE CA C 13 64.611 0.000 . 1 . . . . . 134 ILE CA . 50707 1 577 . 1 . 1 136 136 ILE CB C 13 37.284 0.000 . 1 . . . . . 134 ILE CB . 50707 1 578 . 1 . 1 136 136 ILE N N 15 120.673 0.000 . 1 . . . . . 134 ILE N . 50707 1 579 . 1 . 1 137 137 ALA H H 1 8.181 0.000 . 1 . . . . . 135 ALA H . 50707 1 580 . 1 . 1 137 137 ALA C C 13 179.792 0.000 . 1 . . . . . 135 ALA C . 50707 1 581 . 1 . 1 137 137 ALA CA C 13 55.087 0.000 . 1 . . . . . 135 ALA CA . 50707 1 582 . 1 . 1 137 137 ALA CB C 13 16.733 0.000 . 1 . . . . . 135 ALA CB . 50707 1 583 . 1 . 1 137 137 ALA N N 15 122.769 0.000 . 1 . . . . . 135 ALA N . 50707 1 584 . 1 . 1 138 138 ALA H H 1 7.601 0.000 . 1 . . . . . 136 ALA H . 50707 1 585 . 1 . 1 138 138 ALA C C 13 178.994 0.000 . 1 . . . . . 136 ALA C . 50707 1 586 . 1 . 1 138 138 ALA CA C 13 53.931 0.000 . 1 . . . . . 136 ALA CA . 50707 1 587 . 1 . 1 138 138 ALA CB C 13 17.064 0.000 . 1 . . . . . 136 ALA CB . 50707 1 588 . 1 . 1 138 138 ALA N N 15 118.616 0.000 . 1 . . . . . 136 ALA N . 50707 1 589 . 1 . 1 139 139 GLU H H 1 7.218 0.000 . 1 . . . . . 137 GLU H . 50707 1 590 . 1 . 1 139 139 GLU C C 13 177.125 0.000 . 1 . . . . . 137 GLU C . 50707 1 591 . 1 . 1 139 139 GLU CA C 13 55.087 0.000 . 1 . . . . . 137 GLU CA . 50707 1 592 . 1 . 1 139 139 GLU CB C 13 29.196 0.000 . 1 . . . . . 137 GLU CB . 50707 1 593 . 1 . 1 139 139 GLU N N 15 117.207 0.000 . 1 . . . . . 137 GLU N . 50707 1 594 . 1 . 1 140 140 GLN H H 1 7.099 0.000 . 1 . . . . . 138 GLN H . 50707 1 595 . 1 . 1 140 140 GLN C C 13 175.350 0.000 . 1 . . . . . 138 GLN C . 50707 1 596 . 1 . 1 140 140 GLN CA C 13 54.843 0.000 . 1 . . . . . 138 GLN CA . 50707 1 597 . 1 . 1 140 140 GLN CB C 13 28.467 0.000 . 1 . . . . . 138 GLN CB . 50707 1 598 . 1 . 1 140 140 GLN N N 15 116.885 0.000 . 1 . . . . . 138 GLN N . 50707 1 599 . 1 . 1 141 141 ASN H H 1 8.687 0.000 . 1 . . . . . 139 ASN H . 50707 1 600 . 1 . 1 141 141 ASN C C 13 175.270 0.000 . 1 . . . . . 139 ASN C . 50707 1 601 . 1 . 1 141 141 ASN CA C 13 51.913 0.000 . 1 . . . . . 139 ASN CA . 50707 1 602 . 1 . 1 141 141 ASN CB C 13 36.952 0.000 . 1 . . . . . 139 ASN CB . 50707 1 603 . 1 . 1 141 141 ASN N N 15 120.534 0.000 . 1 . . . . . 139 ASN N . 50707 1 604 . 1 . 1 142 142 LEU H H 1 8.338 0.000 . 1 . . . . . 140 LEU H . 50707 1 605 . 1 . 1 142 142 LEU C C 13 176.345 0.000 . 1 . . . . . 140 LEU C . 50707 1 606 . 1 . 1 142 142 LEU CA C 13 53.866 0.000 . 1 . . . . . 140 LEU CA . 50707 1 607 . 1 . 1 142 142 LEU CB C 13 38.014 0.000 . 1 . . . . . 140 LEU CB . 50707 1 608 . 1 . 1 142 142 LEU N N 15 123.825 0.000 . 1 . . . . . 140 LEU N . 50707 1 609 . 1 . 1 143 143 ASP H H 1 8.035 0.000 . 1 . . . . . 141 ASP H . 50707 1 610 . 1 . 1 143 143 ASP C C 13 174.772 0.000 . 1 . . . . . 141 ASP C . 50707 1 611 . 1 . 1 143 143 ASP CA C 13 53.134 0.000 . 1 . . . . . 141 ASP CA . 50707 1 612 . 1 . 1 143 143 ASP CB C 13 40.068 0.000 . 1 . . . . . 141 ASP CB . 50707 1 613 . 1 . 1 143 143 ASP N N 15 118.220 0.000 . 1 . . . . . 141 ASP N . 50707 1 614 . 1 . 1 144 144 ASN H H 1 7.084 0.000 . 1 . . . . . 142 ASN H . 50707 1 615 . 1 . 1 144 144 ASN C C 13 174.019 0.000 . 1 . . . . . 142 ASN C . 50707 1 616 . 1 . 1 144 144 ASN CA C 13 51.547 0.000 . 1 . . . . . 142 ASN CA . 50707 1 617 . 1 . 1 144 144 ASN CB C 13 41.062 0.000 . 1 . . . . . 142 ASN CB . 50707 1 618 . 1 . 1 144 144 ASN N N 15 115.931 0.000 . 1 . . . . . 142 ASN N . 50707 1 619 . 1 . 1 145 145 ASP H H 1 8.749 0.000 . 1 . . . . . 143 ASP H . 50707 1 620 . 1 . 1 145 145 ASP C C 13 177.851 0.000 . 1 . . . . . 143 ASP C . 50707 1 621 . 1 . 1 145 145 ASP CA C 13 57.774 0.000 . 1 . . . . . 143 ASP CA . 50707 1 622 . 1 . 1 145 145 ASP CB C 13 40.836 0.000 . 1 . . . . . 143 ASP CB . 50707 1 623 . 1 . 1 145 145 ASP N N 15 123.949 0.000 . 1 . . . . . 143 ASP N . 50707 1 624 . 1 . 1 146 146 GLU H H 1 8.251 0.000 . 1 . . . . . 144 GLU H . 50707 1 625 . 1 . 1 146 146 GLU C C 13 178.510 0.000 . 1 . . . . . 144 GLU C . 50707 1 626 . 1 . 1 146 146 GLU CA C 13 58.994 0.000 . 1 . . . . . 144 GLU CA . 50707 1 627 . 1 . 1 146 146 GLU CB C 13 27.998 0.000 . 1 . . . . . 144 GLU CB . 50707 1 628 . 1 . 1 146 146 GLU N N 15 119.056 0.000 . 1 . . . . . 144 GLU N . 50707 1 629 . 1 . 1 147 147 GLY H H 1 7.969 0.000 . 1 . . . . . 145 GLY H . 50707 1 630 . 1 . 1 147 147 GLY C C 13 176.184 0.000 . 1 . . . . . 145 GLY C . 50707 1 631 . 1 . 1 147 147 GLY CA C 13 46.541 0.000 . 1 . . . . . 145 GLY CA . 50707 1 632 . 1 . 1 147 147 GLY N N 15 108.198 0.000 . 1 . . . . . 145 GLY N . 50707 1 633 . 1 . 1 148 148 LEU H H 1 7.572 0.000 . 1 . . . . . 146 LEU H . 50707 1 634 . 1 . 1 148 148 LEU C C 13 178.523 0.000 . 1 . . . . . 146 LEU C . 50707 1 635 . 1 . 1 148 148 LEU CA C 13 57.857 0.000 . 1 . . . . . 146 LEU CA . 50707 1 636 . 1 . 1 148 148 LEU CB C 13 41.175 0.000 . 1 . . . . . 146 LEU CB . 50707 1 637 . 1 . 1 148 148 LEU N N 15 120.458 0.000 . 1 . . . . . 146 LEU N . 50707 1 638 . 1 . 1 149 149 LYS H H 1 7.570 0.000 . 1 . . . . . 147 LYS H . 50707 1 639 . 1 . 1 149 149 LYS C C 13 180.169 0.000 . 1 . . . . . 147 LYS C . 50707 1 640 . 1 . 1 149 149 LYS CA C 13 59.603 0.000 . 1 . . . . . 147 LYS CA . 50707 1 641 . 1 . 1 149 149 LYS CB C 13 31.185 0.000 . 1 . . . . . 147 LYS CB . 50707 1 642 . 1 . 1 149 149 LYS N N 15 118.810 0.000 . 1 . . . . . 147 LYS N . 50707 1 643 . 1 . 1 150 150 ILE H H 1 8.352 0.000 . 1 . . . . . 148 ILE H . 50707 1 644 . 1 . 1 150 150 ILE C C 13 178.415 0.000 . 1 . . . . . 148 ILE C . 50707 1 645 . 1 . 1 150 150 ILE CA C 13 64.123 0.000 . 1 . . . . . 148 ILE CA . 50707 1 646 . 1 . 1 150 150 ILE CB C 13 36.886 0.000 . 1 . . . . . 148 ILE CB . 50707 1 647 . 1 . 1 150 150 ILE N N 15 122.116 0.000 . 1 . . . . . 148 ILE N . 50707 1 648 . 1 . 1 151 151 ALA H H 1 8.420 0.000 . 1 . . . . . 149 ALA H . 50707 1 649 . 1 . 1 151 151 ALA C C 13 178.819 0.000 . 1 . . . . . 149 ALA C . 50707 1 650 . 1 . 1 151 151 ALA CA C 13 55.190 0.000 . 1 . . . . . 149 ALA CA . 50707 1 651 . 1 . 1 151 151 ALA N N 15 122.555 0.000 . 1 . . . . . 149 ALA N . 50707 1 652 . 1 . 1 153 153 LYS H H 1 7.796 0.000 . 1 . . . . . 151 LYS H . 50707 1 653 . 1 . 1 153 153 LYS N N 15 121.049 0.000 . 1 . . . . . 151 LYS N . 50707 1 654 . 1 . 1 154 154 HIS H H 1 8.211 0.000 . 1 . . . . . 152 HIS H . 50707 1 655 . 1 . 1 154 154 HIS C C 13 179.508 0.000 . 1 . . . . . 152 HIS C . 50707 1 656 . 1 . 1 154 154 HIS CA C 13 59.218 0.000 . 1 . . . . . 152 HIS CA . 50707 1 657 . 1 . 1 154 154 HIS N N 15 120.750 0.000 . 1 . . . . . 152 HIS N . 50707 1 658 . 1 . 1 155 155 TYR H H 1 9.018 0.000 . 1 . . . . . 153 TYR H . 50707 1 659 . 1 . 1 155 155 TYR C C 13 179.773 0.000 . 1 . . . . . 153 TYR C . 50707 1 660 . 1 . 1 155 155 TYR CA C 13 60.948 0.000 . 1 . . . . . 153 TYR CA . 50707 1 661 . 1 . 1 155 155 TYR CB C 13 37.217 0.000 . 1 . . . . . 153 TYR CB . 50707 1 662 . 1 . 1 155 155 TYR N N 15 120.327 0.000 . 1 . . . . . 153 TYR N . 50707 1 663 . 1 . 1 156 156 GLN H H 1 7.795 0.000 . 1 . . . . . 154 GLN H . 50707 1 664 . 1 . 1 156 156 GLN C C 13 179.007 0.000 . 1 . . . . . 154 GLN C . 50707 1 665 . 1 . 1 156 156 GLN CA C 13 60.948 0.000 . 1 . . . . . 154 GLN CA . 50707 1 666 . 1 . 1 156 156 GLN CB C 13 29.743 0.000 . 1 . . . . . 154 GLN CB . 50707 1 667 . 1 . 1 156 156 GLN N N 15 118.459 0.000 . 1 . . . . . 154 GLN N . 50707 1 668 . 1 . 1 157 157 PHE H H 1 8.346 0.000 . 1 . . . . . 155 PHE H . 50707 1 669 . 1 . 1 157 157 PHE C C 13 177.192 0.000 . 1 . . . . . 155 PHE C . 50707 1 670 . 1 . 1 157 157 PHE CA C 13 60.826 0.000 . 1 . . . . . 155 PHE CA . 50707 1 671 . 1 . 1 157 157 PHE CB C 13 38.079 0.000 . 1 . . . . . 155 PHE CB . 50707 1 672 . 1 . 1 157 157 PHE N N 15 123.205 0.000 . 1 . . . . . 155 PHE N . 50707 1 673 . 1 . 1 158 158 ALA H H 1 8.981 0.000 . 1 . . . . . 156 ALA H . 50707 1 674 . 1 . 1 158 158 ALA C C 13 178.254 0.000 . 1 . . . . . 156 ALA C . 50707 1 675 . 1 . 1 158 158 ALA CA C 13 54.355 0.000 . 1 . . . . . 156 ALA CA . 50707 1 676 . 1 . 1 158 158 ALA CB C 13 17.064 0.000 . 1 . . . . . 156 ALA CB . 50707 1 677 . 1 . 1 158 158 ALA N N 15 123.191 0.000 . 1 . . . . . 156 ALA N . 50707 1 678 . 1 . 1 159 159 SER H H 1 8.319 0.000 . 1 . . . . . 157 SER H . 50707 1 679 . 1 . 1 159 159 SER C C 13 178.989 0.000 . 1 . . . . . 157 SER C . 50707 1 680 . 1 . 1 159 159 SER CA C 13 61.559 0.000 . 1 . . . . . 157 SER CA . 50707 1 681 . 1 . 1 159 159 SER CB C 13 62.342 0.000 . 1 . . . . . 157 SER CB . 50707 1 682 . 1 . 1 159 159 SER N N 15 108.675 0.000 . 1 . . . . . 157 SER N . 50707 1 683 . 1 . 1 160 160 GLY H H 1 8.069 0.000 . 1 . . . . . 158 GLY H . 50707 1 684 . 1 . 1 160 160 GLY C C 13 175.539 0.000 . 1 . . . . . 158 GLY C . 50707 1 685 . 1 . 1 160 160 GLY CA C 13 46.663 0.000 . 1 . . . . . 158 GLY CA . 50707 1 686 . 1 . 1 160 160 GLY N N 15 107.551 0.000 . 1 . . . . . 158 GLY N . 50707 1 687 . 1 . 1 161 161 ALA H H 1 8.130 0.000 . 1 . . . . . 159 ALA H . 50707 1 688 . 1 . 1 161 161 ALA C C 13 178.873 0.000 . 1 . . . . . 159 ALA C . 50707 1 689 . 1 . 1 161 161 ALA CA C 13 54.131 0.000 . 1 . . . . . 159 ALA CA . 50707 1 690 . 1 . 1 161 161 ALA CB C 13 16.729 0.000 . 1 . . . . . 159 ALA CB . 50707 1 691 . 1 . 1 161 161 ALA N N 15 127.156 0.000 . 1 . . . . . 159 ALA N . 50707 1 692 . 1 . 1 162 162 PHE H H 1 8.125 0.000 . 1 . . . . . 160 PHE H . 50707 1 693 . 1 . 1 162 162 PHE C C 13 178.056 0.000 . 1 . . . . . 160 PHE C . 50707 1 694 . 1 . 1 162 162 PHE CA C 13 59.826 0.000 . 1 . . . . . 160 PHE CA . 50707 1 695 . 1 . 1 162 162 PHE CB C 13 37.125 0.000 . 1 . . . . . 160 PHE CB . 50707 1 696 . 1 . 1 162 162 PHE N N 15 115.898 0.000 . 1 . . . . . 160 PHE N . 50707 1 697 . 1 . 1 163 163 LEU H H 1 7.664 0.000 . 1 . . . . . 161 LEU H . 50707 1 698 . 1 . 1 163 163 LEU C C 13 177.407 0.000 . 1 . . . . . 161 LEU C . 50707 1 699 . 1 . 1 163 163 LEU CA C 13 57.041 0.000 . 1 . . . . . 161 LEU CA . 50707 1 700 . 1 . 1 163 163 LEU CB C 13 40.466 0.000 . 1 . . . . . 161 LEU CB . 50707 1 701 . 1 . 1 163 163 LEU N N 15 120.005 0.000 . 1 . . . . . 161 LEU N . 50707 1 702 . 1 . 1 164 164 HIS H H 1 8.039 0.000 . 1 . . . . . 162 HIS H . 50707 1 703 . 1 . 1 164 164 HIS C C 13 179.921 0.000 . 1 . . . . . 162 HIS C . 50707 1 704 . 1 . 1 164 164 HIS CA C 13 59.483 0.000 . 1 . . . . . 162 HIS CA . 50707 1 705 . 1 . 1 164 164 HIS CB C 13 30.323 0.000 . 1 . . . . . 162 HIS CB . 50707 1 706 . 1 . 1 164 164 HIS N N 15 119.896 0.000 . 1 . . . . . 162 HIS N . 50707 1 707 . 1 . 1 165 165 ILE H H 1 7.911 0.000 . 1 . . . . . 163 ILE H . 50707 1 708 . 1 . 1 165 165 ILE C C 13 177.152 0.000 . 1 . . . . . 163 ILE C . 50707 1 709 . 1 . 1 165 165 ILE CA C 13 65.346 0.000 . 1 . . . . . 163 ILE CA . 50707 1 710 . 1 . 1 165 165 ILE CB C 13 37.217 0.000 . 1 . . . . . 163 ILE CB . 50707 1 711 . 1 . 1 165 165 ILE N N 15 120.778 0.000 . 1 . . . . . 163 ILE N . 50707 1 712 . 1 . 1 166 166 LYS H H 1 7.858 0.000 . 1 . . . . . 164 LYS H . 50707 1 713 . 1 . 1 166 166 LYS C C 13 177.997 0.000 . 1 . . . . . 164 LYS C . 50707 1 714 . 1 . 1 166 166 LYS CA C 13 60.299 0.000 . 1 . . . . . 164 LYS CA . 50707 1 715 . 1 . 1 166 166 LYS CB C 13 31.216 0.000 . 1 . . . . . 164 LYS CB . 50707 1 716 . 1 . 1 166 166 LYS N N 15 122.253 0.000 . 1 . . . . . 164 LYS N . 50707 1 717 . 1 . 1 167 167 GLU H H 1 7.608 0.000 . 1 . . . . . 165 GLU H . 50707 1 718 . 1 . 1 167 167 GLU C C 13 177.934 0.000 . 1 . . . . . 165 GLU C . 50707 1 719 . 1 . 1 167 167 GLU CA C 13 57.163 0.000 . 1 . . . . . 165 GLU CA . 50707 1 720 . 1 . 1 167 167 GLU CB C 13 29.594 0.000 . 1 . . . . . 165 GLU CB . 50707 1 721 . 1 . 1 167 167 GLU N N 15 114.244 0.000 . 1 . . . . . 165 GLU N . 50707 1 722 . 1 . 1 170 170 LEU C C 13 180.311 0.000 . 1 . . . . . 168 LEU C . 50707 1 723 . 1 . 1 170 170 LEU CA C 13 56.993 0.000 . 1 . . . . . 168 LEU CA . 50707 1 724 . 1 . 1 170 170 LEU CB C 13 38.780 0.000 . 1 . . . . . 168 LEU CB . 50707 1 725 . 1 . 1 171 171 SER H H 1 7.881 0.000 . 1 . . . . . 169 SER H . 50707 1 726 . 1 . 1 171 171 SER C C 13 175.377 0.000 . 1 . . . . . 169 SER C . 50707 1 727 . 1 . 1 171 171 SER CA C 13 59.605 0.000 . 1 . . . . . 169 SER CA . 50707 1 728 . 1 . 1 171 171 SER CB C 13 62.475 0.000 . 1 . . . . . 169 SER CB . 50707 1 729 . 1 . 1 171 171 SER N N 15 114.146 0.000 . 1 . . . . . 169 SER N . 50707 1 730 . 1 . 1 172 172 ALA H H 1 7.795 0.000 . 1 . . . . . 170 ALA H . 50707 1 731 . 1 . 1 172 172 ALA C C 13 177.528 0.000 . 1 . . . . . 170 ALA C . 50707 1 732 . 1 . 1 172 172 ALA CA C 13 52.645 0.000 . 1 . . . . . 170 ALA CA . 50707 1 733 . 1 . 1 172 172 ALA CB C 13 17.860 0.000 . 1 . . . . . 170 ALA CB . 50707 1 734 . 1 . 1 172 172 ALA N N 15 123.540 0.000 . 1 . . . . . 170 ALA N . 50707 1 735 . 1 . 1 173 173 LEU H H 1 7.422 0.000 . 1 . . . . . 171 LEU H . 50707 1 736 . 1 . 1 173 173 LEU C C 13 177.152 0.000 . 1 . . . . . 171 LEU C . 50707 1 737 . 1 . 1 173 173 LEU CA C 13 55.210 0.000 . 1 . . . . . 171 LEU CA . 50707 1 738 . 1 . 1 173 173 LEU CB C 13 42.587 0.000 . 1 . . . . . 171 LEU CB . 50707 1 739 . 1 . 1 173 173 LEU N N 15 117.368 0.000 . 1 . . . . . 171 LEU N . 50707 1 740 . 1 . 1 174 174 SER H H 1 7.946 0.000 . 1 . . . . . 172 SER H . 50707 1 741 . 1 . 1 174 174 SER C C 13 173.468 0.000 . 1 . . . . . 172 SER C . 50707 1 742 . 1 . 1 174 174 SER CA C 13 58.262 0.000 . 1 . . . . . 172 SER CA . 50707 1 743 . 1 . 1 174 174 SER CB C 13 62.342 0.000 . 1 . . . . . 172 SER CB . 50707 1 744 . 1 . 1 174 174 SER N N 15 112.979 0.000 . 1 . . . . . 172 SER N . 50707 1 745 . 1 . 1 175 175 ARG H H 1 7.166 0.000 . 1 . . . . . 173 ARG H . 50707 1 746 . 1 . 1 175 175 ARG C C 13 174.033 0.000 . 1 . . . . . 173 ARG C . 50707 1 747 . 1 . 1 175 175 ARG CA C 13 53.622 0.000 . 1 . . . . . 173 ARG CA . 50707 1 748 . 1 . 1 175 175 ARG CB C 13 31.118 0.000 . 1 . . . . . 173 ARG CB . 50707 1 749 . 1 . 1 175 175 ARG N N 15 117.014 0.000 . 1 . . . . . 173 ARG N . 50707 1 750 . 1 . 1 176 176 GLU H H 1 8.239 0.000 . 1 . . . . . 174 GLU H . 50707 1 751 . 1 . 1 176 176 GLU C C 13 174.692 0.000 . 1 . . . . . 174 GLU C . 50707 1 752 . 1 . 1 176 176 GLU CA C 13 54.355 0.000 . 1 . . . . . 174 GLU CA . 50707 1 753 . 1 . 1 176 176 GLU CB C 13 28.464 0.000 . 1 . . . . . 174 GLU CB . 50707 1 754 . 1 . 1 176 176 GLU N N 15 120.273 0.000 . 1 . . . . . 174 GLU N . 50707 1 755 . 1 . 1 180 180 ASP H H 1 8.787 0.000 . 1 . . . . . 178 ASP H . 50707 1 756 . 1 . 1 180 180 ASP N N 15 123.868 0.000 . 1 . . . . . 178 ASP N . 50707 1 757 . 1 . 1 181 181 ILE H H 1 7.147 0.000 . 1 . . . . . 179 ILE H . 50707 1 758 . 1 . 1 181 181 ILE N N 15 107.563 0.000 . 1 . . . . . 179 ILE N . 50707 1 759 . 1 . 1 182 182 SER H H 1 7.451 0.000 . 1 . . . . . 180 SER H . 50707 1 760 . 1 . 1 182 182 SER N N 15 115.538 0.000 . 1 . . . . . 180 SER N . 50707 1 761 . 1 . 1 183 183 PRO C C 13 177.997 0.000 . 1 . . . . . 181 PRO C . 50707 1 762 . 1 . 1 183 183 PRO CA C 13 65.954 0.000 . 1 . . . . . 181 PRO CA . 50707 1 763 . 1 . 1 183 183 PRO CB C 13 31.450 0.000 . 1 . . . . . 181 PRO CB . 50707 1 764 . 1 . 1 184 184 ASP H H 1 8.576 0.000 . 1 . . . . . 182 ASP H . 50707 1 765 . 1 . 1 184 184 ASP C C 13 178.268 0.000 . 1 . . . . . 182 ASP C . 50707 1 766 . 1 . 1 184 184 ASP CA C 13 56.797 0.000 . 1 . . . . . 182 ASP CA . 50707 1 767 . 1 . 1 184 184 ASP CB C 13 40.267 0.000 . 1 . . . . . 182 ASP CB . 50707 1 768 . 1 . 1 184 184 ASP N N 15 115.450 0.000 . 1 . . . . . 182 ASP N . 50707 1 769 . 1 . 1 185 185 THR H H 1 7.488 0.000 . 1 . . . . . 183 THR H . 50707 1 770 . 1 . 1 185 185 THR C C 13 177.058 0.000 . 1 . . . . . 183 THR C . 50707 1 771 . 1 . 1 185 185 THR CA C 13 65.466 0.000 . 1 . . . . . 183 THR CA . 50707 1 772 . 1 . 1 185 185 THR CB C 13 68.043 0.000 . 1 . . . . . 183 THR CB . 50707 1 773 . 1 . 1 185 185 THR N N 15 118.041 0.000 . 1 . . . . . 183 THR N . 50707 1 774 . 1 . 1 186 186 VAL H H 1 8.133 0.000 . 1 . . . . . 184 VAL H . 50707 1 775 . 1 . 1 186 186 VAL C C 13 179.222 0.000 . 1 . . . . . 184 VAL C . 50707 1 776 . 1 . 1 186 186 VAL CA C 13 65.099 0.000 . 1 . . . . . 184 VAL CA . 50707 1 777 . 1 . 1 186 186 VAL CB C 13 29.594 0.000 . 1 . . . . . 184 VAL CB . 50707 1 778 . 1 . 1 186 186 VAL N N 15 114.573 0.000 . 1 . . . . . 184 VAL N . 50707 1 779 . 1 . 1 187 187 GLY H H 1 8.532 0.000 . 1 . . . . . 185 GLY H . 50707 1 780 . 1 . 1 187 187 GLY C C 13 176.480 0.000 . 1 . . . . . 185 GLY C . 50707 1 781 . 1 . 1 187 187 GLY CA C 13 47.029 0.000 . 1 . . . . . 185 GLY CA . 50707 1 782 . 1 . 1 187 187 GLY N N 15 111.141 0.000 . 1 . . . . . 185 GLY N . 50707 1 783 . 1 . 1 188 188 THR H H 1 7.417 0.000 . 1 . . . . . 186 THR H . 50707 1 784 . 1 . 1 188 188 THR C C 13 176.722 0.000 . 1 . . . . . 186 THR C . 50707 1 785 . 1 . 1 188 188 THR CA C 13 67.447 0.000 . 1 . . . . . 186 THR CA . 50707 1 786 . 1 . 1 188 188 THR CB C 13 67.447 0.000 . 1 . . . . . 186 THR CB . 50707 1 787 . 1 . 1 188 188 THR N N 15 122.052 0.000 . 1 . . . . . 186 THR N . 50707 1 788 . 1 . 1 189 189 LEU H H 1 8.178 0.000 . 1 . . . . . 187 LEU H . 50707 1 789 . 1 . 1 189 189 LEU C C 13 178.819 0.000 . 1 . . . . . 187 LEU C . 50707 1 790 . 1 . 1 189 189 LEU CA C 13 57.651 0.000 . 1 . . . . . 187 LEU CA . 50707 1 791 . 1 . 1 189 189 LEU CB C 13 39.405 0.000 . 1 . . . . . 187 LEU CB . 50707 1 792 . 1 . 1 189 189 LEU N N 15 120.524 0.000 . 1 . . . . . 187 LEU N . 50707 1 793 . 1 . 1 190 190 SER H H 1 8.301 0.000 . 1 . . . . . 188 SER H . 50707 1 794 . 1 . 1 190 190 SER C C 13 178.026 0.000 . 1 . . . . . 188 SER C . 50707 1 795 . 1 . 1 190 190 SER CA C 13 61.803 0.000 . 1 . . . . . 188 SER CA . 50707 1 796 . 1 . 1 190 190 SER N N 15 112.407 0.000 . 1 . . . . . 188 SER N . 50707 1 797 . 1 . 1 191 191 LEU H H 1 7.317 0.000 . 1 . . . . . 189 LEU H . 50707 1 798 . 1 . 1 191 191 LEU C C 13 178.214 0.000 . 1 . . . . . 189 LEU C . 50707 1 799 . 1 . 1 191 191 LEU CA C 13 56.919 0.000 . 1 . . . . . 189 LEU CA . 50707 1 800 . 1 . 1 191 191 LEU CB C 13 40.778 0.000 . 1 . . . . . 189 LEU CB . 50707 1 801 . 1 . 1 191 191 LEU N N 15 124.338 0.000 . 1 . . . . . 189 LEU N . 50707 1 802 . 1 . 1 194 194 LEU CB C 13 37.273 0.000 . 1 . . . . . 192 LEU CB . 50707 1 803 . 1 . 1 195 195 ALA H H 1 8.071 0.000 . 1 . . . . . 193 ALA H . 50707 1 804 . 1 . 1 195 195 ALA C C 13 178.962 0.000 . 1 . . . . . 193 ALA C . 50707 1 805 . 1 . 1 195 195 ALA CA C 13 54.544 0.000 . 1 . . . . . 193 ALA CA . 50707 1 806 . 1 . 1 195 195 ALA CB C 13 15.914 0.000 . 1 . . . . . 193 ALA CB . 50707 1 807 . 1 . 1 195 195 ALA N N 15 119.900 0.000 . 1 . . . . . 193 ALA N . 50707 1 808 . 1 . 1 196 196 GLN H H 1 7.524 0.000 . 1 . . . . . 194 GLN H . 50707 1 809 . 1 . 1 196 196 GLN C C 13 177.104 0.000 . 1 . . . . . 194 GLN C . 50707 1 810 . 1 . 1 196 196 GLN CA C 13 58.873 0.000 . 1 . . . . . 194 GLN CA . 50707 1 811 . 1 . 1 196 196 GLN CB C 13 24.874 0.000 . 1 . . . . . 194 GLN CB . 50707 1 812 . 1 . 1 196 196 GLN N N 15 114.687 0.000 . 1 . . . . . 194 GLN N . 50707 1 813 . 1 . 1 197 197 ALA H H 1 8.087 0.000 . 1 . . . . . 195 ALA H . 50707 1 814 . 1 . 1 197 197 ALA C C 13 177.851 0.000 . 1 . . . . . 195 ALA C . 50707 1 815 . 1 . 1 197 197 ALA CA C 13 55.210 0.000 . 1 . . . . . 195 ALA CA . 50707 1 816 . 1 . 1 197 197 ALA CB C 13 17.595 0.000 . 1 . . . . . 195 ALA CB . 50707 1 817 . 1 . 1 197 197 ALA N N 15 122.011 0.000 . 1 . . . . . 195 ALA N . 50707 1 818 . 1 . 1 198 198 GLN H H 1 8.260 0.000 . 1 . . . . . 196 GLN H . 50707 1 819 . 1 . 1 198 198 GLN C C 13 178.138 0.000 . 1 . . . . . 196 GLN C . 50707 1 820 . 1 . 1 198 198 GLN CA C 13 58.097 0.000 . 1 . . . . . 196 GLN CA . 50707 1 821 . 1 . 1 198 198 GLN CB C 13 24.423 0.000 . 1 . . . . . 196 GLN CB . 50707 1 822 . 1 . 1 198 198 GLN N N 15 119.875 0.000 . 1 . . . . . 196 GLN N . 50707 1 823 . 1 . 1 199 199 GLU H H 1 8.828 0.000 . 1 . . . . . 197 GLU H . 50707 1 824 . 1 . 1 199 199 GLU C C 13 178.445 0.000 . 1 . . . . . 197 GLU C . 50707 1 825 . 1 . 1 199 199 GLU CA C 13 59.965 0.000 . 1 . . . . . 197 GLU CA . 50707 1 826 . 1 . 1 199 199 GLU CB C 13 29.008 0.000 . 1 . . . . . 197 GLU CB . 50707 1 827 . 1 . 1 199 199 GLU N N 15 123.323 0.000 . 1 . . . . . 197 GLU N . 50707 1 828 . 1 . 1 202 202 PHE C C 13 176.477 0.000 . 1 . . . . . 200 PHE C . 50707 1 829 . 1 . 1 202 202 PHE CA C 13 60.683 0.000 . 1 . . . . . 200 PHE CA . 50707 1 830 . 1 . 1 202 202 PHE CB C 13 36.578 0.000 . 1 . . . . . 200 PHE CB . 50707 1 831 . 1 . 1 203 203 LEU H H 1 8.556 0.000 . 1 . . . . . 201 LEU H . 50707 1 832 . 1 . 1 203 203 LEU C C 13 180.729 0.000 . 1 . . . . . 201 LEU C . 50707 1 833 . 1 . 1 203 203 LEU CA C 13 57.326 0.000 . 1 . . . . . 201 LEU CA . 50707 1 834 . 1 . 1 203 203 LEU CB C 13 40.114 0.000 . 1 . . . . . 201 LEU CB . 50707 1 835 . 1 . 1 203 203 LEU N N 15 124.885 0.000 . 1 . . . . . 201 LEU N . 50707 1 836 . 1 . 1 204 204 LYS H H 1 8.627 0.000 . 1 . . . . . 202 LYS H . 50707 1 837 . 1 . 1 204 204 LYS C C 13 176.654 0.000 . 1 . . . . . 202 LYS C . 50707 1 838 . 1 . 1 204 204 LYS CA C 13 58.872 0.000 . 1 . . . . . 202 LYS CA . 50707 1 839 . 1 . 1 204 204 LYS CB C 13 31.781 0.000 . 1 . . . . . 202 LYS CB . 50707 1 840 . 1 . 1 204 204 LYS N N 15 122.881 0.000 . 1 . . . . . 202 LYS N . 50707 1 841 . 1 . 1 205 205 ALA H H 1 8.222 0.000 . 1 . . . . . 203 ALA H . 50707 1 842 . 1 . 1 205 205 ALA C C 13 179.599 0.000 . 1 . . . . . 203 ALA C . 50707 1 843 . 1 . 1 205 205 ALA CA C 13 54.735 0.000 . 1 . . . . . 203 ALA CA . 50707 1 844 . 1 . 1 205 205 ALA CB C 13 18.896 0.000 . 1 . . . . . 203 ALA CB . 50707 1 845 . 1 . 1 205 205 ALA N N 15 122.070 0.000 . 1 . . . . . 203 ALA N . 50707 1 846 . 1 . 1 206 206 THR H H 1 7.531 0.000 . 1 . . . . . 204 THR H . 50707 1 847 . 1 . 1 206 206 THR C C 13 178.322 0.000 . 1 . . . . . 204 THR C . 50707 1 848 . 1 . 1 206 206 THR CA C 13 65.221 0.000 . 1 . . . . . 204 THR CA . 50707 1 849 . 1 . 1 206 206 THR CB C 13 67.977 0.000 . 1 . . . . . 204 THR CB . 50707 1 850 . 1 . 1 206 206 THR N N 15 111.087 0.000 . 1 . . . . . 204 THR N . 50707 1 851 . 1 . 1 207 207 ARG H H 1 7.780 0.000 . 1 . . . . . 205 ARG H . 50707 1 852 . 1 . 1 207 207 ARG C C 13 177.945 0.000 . 1 . . . . . 205 ARG C . 50707 1 853 . 1 . 1 207 207 ARG CA C 13 58.861 0.000 . 1 . . . . . 205 ARG CA . 50707 1 854 . 1 . 1 207 207 ARG CB C 13 28.678 0.000 . 1 . . . . . 205 ARG CB . 50707 1 855 . 1 . 1 207 207 ARG N N 15 127.262 0.000 . 1 . . . . . 205 ARG N . 50707 1 856 . 1 . 1 208 208 ASP H H 1 8.436 0.000 . 1 . . . . . 206 ASP H . 50707 1 857 . 1 . 1 208 208 ASP C C 13 175.135 0.000 . 1 . . . . . 206 ASP C . 50707 1 858 . 1 . 1 208 208 ASP CA C 13 54.233 0.000 . 1 . . . . . 206 ASP CA . 50707 1 859 . 1 . 1 208 208 ASP CB C 13 39.471 0.000 . 1 . . . . . 206 ASP CB . 50707 1 860 . 1 . 1 208 208 ASP N N 15 118.349 0.000 . 1 . . . . . 206 ASP N . 50707 1 861 . 1 . 1 209 209 LYS H H 1 7.661 0.000 . 1 . . . . . 207 LYS H . 50707 1 862 . 1 . 1 209 209 LYS C C 13 176.722 0.000 . 1 . . . . . 207 LYS C . 50707 1 863 . 1 . 1 209 209 LYS CA C 13 56.430 0.000 . 1 . . . . . 207 LYS CA . 50707 1 864 . 1 . 1 209 209 LYS CB C 13 27.340 0.000 . 1 . . . . . 207 LYS CB . 50707 1 865 . 1 . 1 209 209 LYS N N 15 116.672 0.000 . 1 . . . . . 207 LYS N . 50707 1 866 . 1 . 1 210 210 MET H H 1 7.494 0.000 . 1 . . . . . 208 MET H . 50707 1 867 . 1 . 1 210 210 MET C C 13 174.571 0.000 . 1 . . . . . 208 MET C . 50707 1 868 . 1 . 1 210 210 MET CA C 13 55.820 0.000 . 1 . . . . . 208 MET CA . 50707 1 869 . 1 . 1 210 210 MET CB C 13 32.776 0.000 . 1 . . . . . 208 MET CB . 50707 1 870 . 1 . 1 210 210 MET N N 15 116.368 0.000 . 1 . . . . . 208 MET N . 50707 1 871 . 1 . 1 211 211 LYS H H 1 8.130 0.000 . 1 . . . . . 209 LYS H . 50707 1 872 . 1 . 1 211 211 LYS C C 13 178.469 0.000 . 1 . . . . . 209 LYS C . 50707 1 873 . 1 . 1 211 211 LYS CA C 13 56.553 0.000 . 1 . . . . . 209 LYS CA . 50707 1 874 . 1 . 1 211 211 LYS CB C 13 31.115 0.000 . 1 . . . . . 209 LYS CB . 50707 1 875 . 1 . 1 211 211 LYS N N 15 118.489 0.000 . 1 . . . . . 209 LYS N . 50707 1 876 . 1 . 1 212 212 ASP H H 1 7.949 0.000 . 1 . . . . . 210 ASP H . 50707 1 877 . 1 . 1 212 212 ASP C C 13 176.950 0.000 . 1 . . . . . 210 ASP C . 50707 1 878 . 1 . 1 212 212 ASP CA C 13 58.994 0.000 . 1 . . . . . 210 ASP CA . 50707 1 879 . 1 . 1 212 212 ASP CB C 13 41.394 0.000 . 1 . . . . . 210 ASP CB . 50707 1 880 . 1 . 1 212 212 ASP N N 15 122.736 0.000 . 1 . . . . . 210 ASP N . 50707 1 881 . 1 . 1 213 213 ALA H H 1 8.981 0.000 . 1 . . . . . 211 ALA H . 50707 1 882 . 1 . 1 213 213 ALA C C 13 180.163 0.000 . 1 . . . . . 211 ALA C . 50707 1 883 . 1 . 1 213 213 ALA CA C 13 54.477 0.000 . 1 . . . . . 211 ALA CA . 50707 1 884 . 1 . 1 213 213 ALA CB C 13 18.390 0.000 . 1 . . . . . 211 ALA CB . 50707 1 885 . 1 . 1 213 213 ALA N N 15 118.768 0.000 . 1 . . . . . 211 ALA N . 50707 1 886 . 1 . 1 214 214 ILE H H 1 6.960 0.000 . 1 . . . . . 212 ILE H . 50707 1 887 . 1 . 1 214 214 ILE C C 13 177.797 0.000 . 1 . . . . . 212 ILE C . 50707 1 888 . 1 . 1 214 214 ILE CA C 13 62.169 0.000 . 1 . . . . . 212 ILE CA . 50707 1 889 . 1 . 1 214 214 ILE CB C 13 36.753 0.000 . 1 . . . . . 212 ILE CB . 50707 1 890 . 1 . 1 214 214 ILE N N 15 115.841 0.000 . 1 . . . . . 212 ILE N . 50707 1 891 . 1 . 1 215 215 ILE H H 1 7.790 0.000 . 1 . . . . . 213 ILE H . 50707 1 892 . 1 . 1 215 215 ILE C C 13 178.281 0.000 . 1 . . . . . 213 ILE C . 50707 1 893 . 1 . 1 215 215 ILE CA C 13 66.442 0.000 . 1 . . . . . 213 ILE CA . 50707 1 894 . 1 . 1 215 215 ILE CB C 13 36.687 0.000 . 1 . . . . . 213 ILE CB . 50707 1 895 . 1 . 1 215 215 ILE N N 15 121.331 0.000 . 1 . . . . . 213 ILE N . 50707 1 896 . 1 . 1 216 216 ALA H H 1 8.475 0.000 . 1 . . . . . 214 ALA H . 50707 1 897 . 1 . 1 216 216 ALA C C 13 179.316 0.000 . 1 . . . . . 214 ALA C . 50707 1 898 . 1 . 1 216 216 ALA CA C 13 55.890 0.000 . 1 . . . . . 214 ALA CA . 50707 1 899 . 1 . 1 216 216 ALA CB C 13 18.125 0.000 . 1 . . . . . 214 ALA CB . 50707 1 900 . 1 . 1 216 216 ALA N N 15 119.722 0.000 . 1 . . . . . 214 ALA N . 50707 1 901 . 1 . 1 217 217 LYS H H 1 6.796 0.000 . 1 . . . . . 215 LYS H . 50707 1 902 . 1 . 1 217 217 LYS C C 13 180.876 0.000 . 1 . . . . . 215 LYS C . 50707 1 903 . 1 . 1 217 217 LYS CA C 13 58.506 0.000 . 1 . . . . . 215 LYS CA . 50707 1 904 . 1 . 1 217 217 LYS CB C 13 32.511 0.000 . 1 . . . . . 215 LYS CB . 50707 1 905 . 1 . 1 217 217 LYS N N 15 115.465 0.000 . 1 . . . . . 215 LYS N . 50707 1 906 . 1 . 1 218 218 LEU H H 1 8.442 0.000 . 1 . . . . . 216 LEU H . 50707 1 907 . 1 . 1 218 218 LEU C C 13 181.521 0.000 . 1 . . . . . 216 LEU C . 50707 1 908 . 1 . 1 218 218 LEU CA C 13 56.797 0.000 . 1 . . . . . 216 LEU CA . 50707 1 909 . 1 . 1 218 218 LEU CB C 13 41.725 0.000 . 1 . . . . . 216 LEU CB . 50707 1 910 . 1 . 1 218 218 LEU N N 15 122.635 0.000 . 1 . . . . . 216 LEU N . 50707 1 911 . 1 . 1 219 219 ALA H H 1 8.728 0.000 . 1 . . . . . 217 ALA H . 50707 1 912 . 1 . 1 219 219 ALA C C 13 179.088 0.000 . 1 . . . . . 217 ALA C . 50707 1 913 . 1 . 1 219 219 ALA CA C 13 53.989 0.000 . 1 . . . . . 217 ALA CA . 50707 1 914 . 1 . 1 219 219 ALA CB C 13 16.269 0.000 . 1 . . . . . 217 ALA CB . 50707 1 915 . 1 . 1 219 219 ALA N N 15 123.381 0.000 . 1 . . . . . 217 ALA N . 50707 1 916 . 1 . 1 220 220 ASN H H 1 8.481 0.000 . 1 . . . . . 218 ASN H . 50707 1 917 . 1 . 1 220 220 ASN C C 13 177.757 0.000 . 1 . . . . . 218 ASN C . 50707 1 918 . 1 . 1 220 220 ASN CA C 13 54.721 0.000 . 1 . . . . . 218 ASN CA . 50707 1 919 . 1 . 1 220 220 ASN CB C 13 37.350 0.000 . 1 . . . . . 218 ASN CB . 50707 1 920 . 1 . 1 220 220 ASN N N 15 117.932 0.000 . 1 . . . . . 218 ASN N . 50707 1 921 . 1 . 1 221 221 GLN H H 1 7.820 0.000 . 1 . . . . . 219 GLN H . 50707 1 922 . 1 . 1 221 221 GLN C C 13 178.133 0.000 . 1 . . . . . 219 GLN C . 50707 1 923 . 1 . 1 221 221 GLN CA C 13 57.041 0.000 . 1 . . . . . 219 GLN CA . 50707 1 924 . 1 . 1 221 221 GLN CB C 13 29.063 0.000 . 1 . . . . . 219 GLN CB . 50707 1 925 . 1 . 1 221 221 GLN N N 15 116.832 0.000 . 1 . . . . . 219 GLN N . 50707 1 926 . 1 . 1 222 222 ALA C C 13 178.470 0.000 . 1 . . . . . 220 ALA C . 50707 1 927 . 1 . 1 222 222 ALA CA C 13 55.120 0.000 . 1 . . . . . 220 ALA CA . 50707 1 928 . 1 . 1 223 223 ALA H H 1 8.067 0.000 . 1 . . . . . 221 ALA H . 50707 1 929 . 1 . 1 223 223 ALA C C 13 181.360 0.000 . 1 . . . . . 221 ALA C . 50707 1 930 . 1 . 1 223 223 ALA CA C 13 55.698 0.000 . 1 . . . . . 221 ALA CA . 50707 1 931 . 1 . 1 223 223 ALA CB C 13 16.998 0.000 . 1 . . . . . 221 ALA CB . 50707 1 932 . 1 . 1 223 223 ALA N N 15 117.970 0.000 . 1 . . . . . 221 ALA N . 50707 1 933 . 1 . 1 224 224 ASP H H 1 7.497 0.000 . 1 . . . . . 222 ASP H . 50707 1 934 . 1 . 1 224 224 ASP C C 13 178.429 0.000 . 1 . . . . . 222 ASP C . 50707 1 935 . 1 . 1 224 224 ASP CA C 13 56.919 0.000 . 1 . . . . . 222 ASP CA . 50707 1 936 . 1 . 1 224 224 ASP CB C 13 39.594 0.000 . 1 . . . . . 222 ASP CB . 50707 1 937 . 1 . 1 224 224 ASP N N 15 121.318 0.000 . 1 . . . . . 222 ASP N . 50707 1 938 . 1 . 1 225 225 TYR H H 1 7.542 0.000 . 1 . . . . . 223 TYR H . 50707 1 939 . 1 . 1 225 225 TYR C C 13 179.088 0.000 . 1 . . . . . 223 TYR C . 50707 1 940 . 1 . 1 225 225 TYR CA C 13 58.018 0.000 . 1 . . . . . 223 TYR CA . 50707 1 941 . 1 . 1 225 225 TYR CB C 13 37.019 0.000 . 1 . . . . . 223 TYR CB . 50707 1 942 . 1 . 1 225 225 TYR N N 15 117.917 0.000 . 1 . . . . . 223 TYR N . 50707 1 943 . 1 . 1 226 226 PHE H H 1 8.573 0.000 . 1 . . . . . 224 PHE H . 50707 1 944 . 1 . 1 226 226 PHE C C 13 178.120 0.000 . 1 . . . . . 224 PHE C . 50707 1 945 . 1 . 1 226 226 PHE CA C 13 63.390 0.000 . 1 . . . . . 224 PHE CA . 50707 1 946 . 1 . 1 226 226 PHE CB C 13 37.840 0.000 . 1 . . . . . 224 PHE CB . 50707 1 947 . 1 . 1 226 226 PHE N N 15 116.736 0.000 . 1 . . . . . 224 PHE N . 50707 1 948 . 1 . 1 227 227 GLY H H 1 8.767 0.000 . 1 . . . . . 225 GLY H . 50707 1 949 . 1 . 1 227 227 GLY C C 13 176.076 0.000 . 1 . . . . . 225 GLY C . 50707 1 950 . 1 . 1 227 227 GLY CA C 13 45.930 0.000 . 1 . . . . . 225 GLY CA . 50707 1 951 . 1 . 1 227 227 GLY N N 15 108.191 0.000 . 1 . . . . . 225 GLY N . 50707 1 952 . 1 . 1 228 228 ASP H H 1 8.310 0.000 . 1 . . . . . 226 ASP H . 50707 1 953 . 1 . 1 228 228 ASP C C 13 178.590 0.000 . 1 . . . . . 226 ASP C . 50707 1 954 . 1 . 1 228 228 ASP CA C 13 56.553 0.000 . 1 . . . . . 226 ASP CA . 50707 1 955 . 1 . 1 228 228 ASP CB C 13 39.538 0.000 . 1 . . . . . 226 ASP CB . 50707 1 956 . 1 . 1 228 228 ASP N N 15 123.864 0.000 . 1 . . . . . 226 ASP N . 50707 1 957 . 1 . 1 229 229 ALA H H 1 7.983 0.000 . 1 . . . . . 227 ALA H . 50707 1 958 . 1 . 1 229 229 ALA C C 13 178.698 0.000 . 1 . . . . . 227 ALA C . 50707 1 959 . 1 . 1 229 229 ALA CA C 13 55.015 0.000 . 1 . . . . . 227 ALA CA . 50707 1 960 . 1 . 1 229 229 ALA CB C 13 16.998 0.000 . 1 . . . . . 227 ALA CB . 50707 1 961 . 1 . 1 229 229 ALA N N 15 122.419 0.000 . 1 . . . . . 227 ALA N . 50707 1 962 . 1 . 1 230 230 PHE H H 1 8.435 0.000 . 1 . . . . . 228 PHE H . 50707 1 963 . 1 . 1 230 230 PHE C C 13 177.300 0.000 . 1 . . . . . 228 PHE C . 50707 1 964 . 1 . 1 230 230 PHE CA C 13 60.618 0.000 . 1 . . . . . 228 PHE CA . 50707 1 965 . 1 . 1 230 230 PHE CB C 13 37.350 0.000 . 1 . . . . . 228 PHE CB . 50707 1 966 . 1 . 1 230 230 PHE N N 15 118.236 0.000 . 1 . . . . . 228 PHE N . 50707 1 967 . 1 . 1 231 231 LYS H H 1 7.798 0.000 . 1 . . . . . 229 LYS H . 50707 1 968 . 1 . 1 231 231 LYS C C 13 179.343 0.000 . 1 . . . . . 229 LYS C . 50707 1 969 . 1 . 1 231 231 LYS CA C 13 58.872 0.000 . 1 . . . . . 229 LYS CA . 50707 1 970 . 1 . 1 231 231 LYS CB C 13 31.185 0.000 . 1 . . . . . 229 LYS CB . 50707 1 971 . 1 . 1 231 231 LYS N N 15 120.297 0.000 . 1 . . . . . 229 LYS N . 50707 1 972 . 1 . 1 232 232 GLN H H 1 7.658 0.000 . 1 . . . . . 230 GLN H . 50707 1 973 . 1 . 1 232 232 GLN C C 13 177.703 0.000 . 1 . . . . . 230 GLN C . 50707 1 974 . 1 . 1 232 232 GLN CA C 13 57.529 0.000 . 1 . . . . . 230 GLN CA . 50707 1 975 . 1 . 1 232 232 GLN N N 15 116.671 0.000 . 1 . . . . . 230 GLN N . 50707 1 976 . 1 . 1 234 234 GLN C C 13 176.109 0.000 . 1 . . . . . 232 GLN C . 50707 1 977 . 1 . 1 234 234 GLN CA C 13 57.677 0.000 . 1 . . . . . 232 GLN CA . 50707 1 978 . 1 . 1 234 234 GLN CB C 13 27.472 0.000 . 1 . . . . . 232 GLN CB . 50707 1 979 . 1 . 1 235 235 TYR H H 1 7.933 0.000 . 1 . . . . . 233 TYR H . 50707 1 980 . 1 . 1 235 235 TYR C C 13 175.794 0.000 . 1 . . . . . 233 TYR C . 50707 1 981 . 1 . 1 235 235 TYR CA C 13 57.285 0.000 . 1 . . . . . 233 TYR CA . 50707 1 982 . 1 . 1 235 235 TYR CB C 13 36.356 0.000 . 1 . . . . . 233 TYR CB . 50707 1 983 . 1 . 1 235 235 TYR N N 15 117.324 0.000 . 1 . . . . . 233 TYR N . 50707 1 984 . 1 . 1 236 236 LYS H H 1 7.432 0.000 . 1 . . . . . 234 LYS H . 50707 1 985 . 1 . 1 236 236 LYS C C 13 176.184 0.000 . 1 . . . . . 234 LYS C . 50707 1 986 . 1 . 1 236 236 LYS CA C 13 55.295 0.000 . 1 . . . . . 234 LYS CA . 50707 1 987 . 1 . 1 236 236 LYS CB C 13 32.776 0.000 . 1 . . . . . 234 LYS CB . 50707 1 988 . 1 . 1 236 236 LYS N N 15 119.788 0.000 . 1 . . . . . 234 LYS N . 50707 1 989 . 1 . 1 237 237 ASP H H 1 8.255 0.000 . 1 . . . . . 235 ASP H . 50707 1 990 . 1 . 1 237 237 ASP C C 13 176.211 0.000 . 1 . . . . . 235 ASP C . 50707 1 991 . 1 . 1 237 237 ASP CA C 13 53.866 0.000 . 1 . . . . . 235 ASP CA . 50707 1 992 . 1 . 1 237 237 ASP CB C 13 39.875 0.000 . 1 . . . . . 235 ASP CB . 50707 1 993 . 1 . 1 237 237 ASP N N 15 121.399 0.000 . 1 . . . . . 235 ASP N . 50707 1 994 . 1 . 1 238 238 THR H H 1 7.655 0.000 . 1 . . . . . 236 THR H . 50707 1 995 . 1 . 1 238 238 THR C C 13 174.449 0.000 . 1 . . . . . 236 THR C . 50707 1 996 . 1 . 1 238 238 THR CA C 13 62.169 0.000 . 1 . . . . . 236 THR CA . 50707 1 997 . 1 . 1 238 238 THR CB C 13 68.905 0.000 . 1 . . . . . 236 THR CB . 50707 1 998 . 1 . 1 238 238 THR N N 15 111.970 0.000 . 1 . . . . . 236 THR N . 50707 1 999 . 1 . 1 239 239 LEU H H 1 7.429 0.000 . 1 . . . . . 237 LEU H . 50707 1 1000 . 1 . 1 239 239 LEU C C 13 173.952 0.000 . 1 . . . . . 237 LEU C . 50707 1 1001 . 1 . 1 239 239 LEU CA C 13 52.279 0.000 . 1 . . . . . 237 LEU CA . 50707 1 1002 . 1 . 1 239 239 LEU CB C 13 39.604 0.000 . 1 . . . . . 237 LEU CB . 50707 1 1003 . 1 . 1 239 239 LEU N N 15 120.280 0.000 . 1 . . . . . 237 LEU N . 50707 1 1004 . 1 . 1 240 240 PRO C C 13 177.645 0.000 . 1 . . . . . 238 PRO C . 50707 1 1005 . 1 . 1 240 240 PRO CA C 13 63.024 0.000 . 1 . . . . . 238 PRO CA . 50707 1 1006 . 1 . 1 240 240 PRO CB C 13 30.981 0.000 . 1 . . . . . 238 PRO CB . 50707 1 1007 . 1 . 1 241 241 LYS H H 1 8.389 0.000 . 1 . . . . . 239 LYS H . 50707 1 1008 . 1 . 1 241 241 LYS C C 13 177.582 0.000 . 1 . . . . . 239 LYS C . 50707 1 1009 . 1 . 1 241 241 LYS CA C 13 58.384 0.000 . 1 . . . . . 239 LYS CA . 50707 1 1010 . 1 . 1 241 241 LYS CB C 13 31.344 0.000 . 1 . . . . . 239 LYS CB . 50707 1 1011 . 1 . 1 241 241 LYS N N 15 122.980 0.000 . 1 . . . . . 239 LYS N . 50707 1 1012 . 1 . 1 242 242 GLU H H 1 9.166 0.000 . 1 . . . . . 240 GLU H . 50707 1 1013 . 1 . 1 242 242 GLU C C 13 176.628 0.000 . 1 . . . . . 240 GLU C . 50707 1 1014 . 1 . 1 242 242 GLU CA C 13 57.782 0.000 . 1 . . . . . 240 GLU CA . 50707 1 1015 . 1 . 1 242 242 GLU CB C 13 27.472 0.000 . 1 . . . . . 240 GLU CB . 50707 1 1016 . 1 . 1 242 242 GLU N N 15 117.970 0.000 . 1 . . . . . 240 GLU N . 50707 1 1017 . 1 . 1 243 243 VAL H H 1 7.668 0.000 . 1 . . . . . 241 VAL H . 50707 1 1018 . 1 . 1 243 243 VAL C C 13 176.366 0.000 . 1 . . . . . 241 VAL C . 50707 1 1019 . 1 . 1 243 243 VAL CA C 13 65.832 0.000 . 1 . . . . . 241 VAL CA . 50707 1 1020 . 1 . 1 243 243 VAL CB C 13 29.991 0.000 . 1 . . . . . 241 VAL CB . 50707 1 1021 . 1 . 1 243 243 VAL N N 15 118.058 0.000 . 1 . . . . . 241 VAL N . 50707 1 1022 . 1 . 1 244 244 PHE H H 1 7.678 0.000 . 1 . . . . . 242 PHE H . 50707 1 1023 . 1 . 1 244 244 PHE C C 13 173.777 0.000 . 1 . . . . . 242 PHE C . 50707 1 1024 . 1 . 1 244 244 PHE CA C 13 62.535 0.000 . 1 . . . . . 242 PHE CA . 50707 1 1025 . 1 . 1 244 244 PHE CB C 13 35.162 0.000 . 1 . . . . . 242 PHE CB . 50707 1 1026 . 1 . 1 244 244 PHE N N 15 117.507 0.000 . 1 . . . . . 242 PHE N . 50707 1 1027 . 1 . 1 245 245 PRO C C 13 177.572 0.000 . 1 . . . . . 243 PRO C . 50707 1 1028 . 1 . 1 245 245 PRO CA C 13 64.611 0.000 . 1 . . . . . 243 PRO CA . 50707 1 1029 . 1 . 1 246 246 VAL H H 1 6.525 0.000 . 1 . . . . . 244 VAL H . 50707 1 1030 . 1 . 1 246 246 VAL C C 13 177.457 0.000 . 1 . . . . . 244 VAL C . 50707 1 1031 . 1 . 1 246 246 VAL CA C 13 66.493 0.000 . 1 . . . . . 244 VAL CA . 50707 1 1032 . 1 . 1 246 246 VAL CB C 13 30.257 0.000 . 1 . . . . . 244 VAL CB . 50707 1 1033 . 1 . 1 246 246 VAL N N 15 115.704 0.000 . 1 . . . . . 244 VAL N . 50707 1 1034 . 1 . 1 247 247 LEU H H 1 7.770 0.000 . 1 . . . . . 245 LEU H . 50707 1 1035 . 1 . 1 247 247 LEU C C 13 178.523 0.000 . 1 . . . . . 245 LEU C . 50707 1 1036 . 1 . 1 247 247 LEU CA C 13 57.285 0.000 . 1 . . . . . 245 LEU CA . 50707 1 1037 . 1 . 1 247 247 LEU CB C 13 41.261 0.000 . 1 . . . . . 245 LEU CB . 50707 1 1038 . 1 . 1 247 247 LEU N N 15 118.219 0.000 . 1 . . . . . 245 LEU N . 50707 1 1039 . 1 . 1 248 248 ALA H H 1 7.639 0.000 . 1 . . . . . 246 ALA H . 50707 1 1040 . 1 . 1 248 248 ALA C C 13 180.471 0.000 . 1 . . . . . 246 ALA C . 50707 1 1041 . 1 . 1 248 248 ALA CA C 13 54.111 0.000 . 1 . . . . . 246 ALA CA . 50707 1 1042 . 1 . 1 248 248 ALA CB C 13 16.600 0.000 . 1 . . . . . 246 ALA CB . 50707 1 1043 . 1 . 1 248 248 ALA N N 15 121.299 0.000 . 1 . . . . . 246 ALA N . 50707 1 1044 . 1 . 1 249 249 ALA H H 1 7.775 0.000 . 1 . . . . . 247 ALA H . 50707 1 1045 . 1 . 1 249 249 ALA C C 13 179.878 0.000 . 1 . . . . . 247 ALA C . 50707 1 1046 . 1 . 1 249 249 ALA CA C 13 54.355 0.000 . 1 . . . . . 247 ALA CA . 50707 1 1047 . 1 . 1 249 249 ALA CB C 13 16.932 0.000 . 1 . . . . . 247 ALA CB . 50707 1 1048 . 1 . 1 249 249 ALA N N 15 120.301 0.000 . 1 . . . . . 247 ALA N . 50707 1 1049 . 1 . 1 250 250 LYS H H 1 8.319 0.000 . 1 . . . . . 248 LYS H . 50707 1 1050 . 1 . 1 250 250 LYS C C 13 178.748 0.000 . 1 . . . . . 248 LYS C . 50707 1 1051 . 1 . 1 250 250 LYS CA C 13 58.994 0.000 . 1 . . . . . 248 LYS CA . 50707 1 1052 . 1 . 1 250 250 LYS CB C 13 29.196 0.000 . 1 . . . . . 248 LYS CB . 50707 1 1053 . 1 . 1 250 250 LYS N N 15 117.259 0.000 . 1 . . . . . 248 LYS N . 50707 1 1054 . 1 . 1 251 251 HIS H H 1 8.049 0.000 . 1 . . . . . 249 HIS H . 50707 1 1055 . 1 . 1 251 251 HIS C C 13 176.789 0.000 . 1 . . . . . 249 HIS C . 50707 1 1056 . 1 . 1 251 251 HIS CA C 13 60.093 0.000 . 1 . . . . . 249 HIS CA . 50707 1 1057 . 1 . 1 251 251 HIS CB C 13 28.931 0.000 . 1 . . . . . 249 HIS CB . 50707 1 1058 . 1 . 1 251 251 HIS N N 15 119.120 0.000 . 1 . . . . . 249 HIS N . 50707 1 1059 . 1 . 1 252 252 CYS H H 1 7.155 0.000 . 1 . . . . . 250 CYS H . 50707 1 1060 . 1 . 1 252 252 CYS C C 13 177.071 0.000 . 1 . . . . . 250 CYS C . 50707 1 1061 . 1 . 1 252 252 CYS CA C 13 62.902 0.000 . 1 . . . . . 250 CYS CA . 50707 1 1062 . 1 . 1 252 252 CYS CB C 13 27.075 0.000 . 1 . . . . . 250 CYS CB . 50707 1 1063 . 1 . 1 252 252 CYS N N 15 116.615 0.000 . 1 . . . . . 250 CYS N . 50707 1 1064 . 1 . 1 253 253 ILE H H 1 8.860 0.000 . 1 . . . . . 251 ILE H . 50707 1 1065 . 1 . 1 253 253 ILE N N 15 120.345 0.000 . 1 . . . . . 251 ILE N . 50707 1 1066 . 1 . 1 256 256 ALA H H 1 8.052 0.000 . 1 . . . . . 254 ALA H . 50707 1 1067 . 1 . 1 256 256 ALA N N 15 121.305 0.000 . 1 . . . . . 254 ALA N . 50707 1 1068 . 1 . 1 257 257 ASN H H 1 7.566 0.000 . 1 . . . . . 255 ASN H . 50707 1 1069 . 1 . 1 257 257 ASN N N 15 118.213 0.000 . 1 . . . . . 255 ASN N . 50707 1 1070 . 1 . 1 263 263 SER H H 1 8.751 0.000 . 1 . . . . . 261 SER H . 50707 1 1071 . 1 . 1 263 263 SER N N 15 119.074 0.000 . 1 . . . . . 261 SER N . 50707 1 1072 . 1 . 1 264 264 ILE H H 1 6.879 0.000 . 1 . . . . . 262 ILE H . 50707 1 1073 . 1 . 1 264 264 ILE N N 15 126.847 0.000 . 1 . . . . . 262 ILE N . 50707 1 1074 . 1 . 1 265 265 LEU H H 1 6.824 0.000 . 1 . . . . . 263 LEU H . 50707 1 1075 . 1 . 1 265 265 LEU N N 15 122.098 0.000 . 1 . . . . . 263 LEU N . 50707 1 1076 . 1 . 1 266 266 ALA H H 1 7.932 0.000 . 1 . . . . . 264 ALA H . 50707 1 1077 . 1 . 1 266 266 ALA N N 15 121.367 0.000 . 1 . . . . . 264 ALA N . 50707 1 1078 . 1 . 1 267 267 LYS H H 1 8.083 0.000 . 1 . . . . . 265 LYS H . 50707 1 1079 . 1 . 1 267 267 LYS N N 15 120.572 0.000 . 1 . . . . . 265 LYS N . 50707 1 1080 . 1 . 1 268 268 GLN C C 13 177.954 0.000 . 1 . . . . . 266 GLN C . 50707 1 1081 . 1 . 1 268 268 GLN CB C 13 27.192 0.000 . 1 . . . . . 266 GLN CB . 50707 1 1082 . 1 . 1 269 269 GLN H H 1 7.546 0.000 . 1 . . . . . 267 GLN H . 50707 1 1083 . 1 . 1 269 269 GLN C C 13 174.214 0.000 . 1 . . . . . 267 GLN C . 50707 1 1084 . 1 . 1 269 269 GLN CA C 13 54.843 0.000 . 1 . . . . . 267 GLN CA . 50707 1 1085 . 1 . 1 269 269 GLN CB C 13 27.870 0.000 . 1 . . . . . 267 GLN CB . 50707 1 1086 . 1 . 1 269 269 GLN N N 15 117.019 0.000 . 1 . . . . . 267 GLN N . 50707 1 1087 . 1 . 1 270 270 LYS H H 1 7.561 0.000 . 1 . . . . . 268 LYS H . 50707 1 1088 . 1 . 1 270 270 LYS C C 13 174.893 0.000 . 1 . . . . . 268 LYS C . 50707 1 1089 . 1 . 1 270 270 LYS CA C 13 56.186 0.000 . 1 . . . . . 268 LYS CA . 50707 1 1090 . 1 . 1 270 270 LYS CB C 13 28.732 0.000 . 1 . . . . . 268 LYS CB . 50707 1 1091 . 1 . 1 270 270 LYS N N 15 114.348 0.000 . 1 . . . . . 268 LYS N . 50707 1 1092 . 1 . 1 271 271 LYS H H 1 7.893 0.000 . 1 . . . . . 269 LYS H . 50707 1 1093 . 1 . 1 271 271 LYS C C 13 176.399 0.000 . 1 . . . . . 269 LYS C . 50707 1 1094 . 1 . 1 271 271 LYS CA C 13 53.012 0.000 . 1 . . . . . 269 LYS CA . 50707 1 1095 . 1 . 1 271 271 LYS CB C 13 28.732 0.000 . 1 . . . . . 269 LYS CB . 50707 1 1096 . 1 . 1 271 271 LYS N N 15 122.123 0.000 . 1 . . . . . 269 LYS N . 50707 1 1097 . 1 . 1 272 272 PHE H H 1 6.439 0.000 . 1 . . . . . 270 PHE H . 50707 1 1098 . 1 . 1 272 272 PHE C C 13 180.123 0.000 . 1 . . . . . 270 PHE C . 50707 1 1099 . 1 . 1 272 272 PHE CA C 13 60.948 0.000 . 1 . . . . . 270 PHE CA . 50707 1 1100 . 1 . 1 272 272 PHE CB C 13 37.350 0.000 . 1 . . . . . 270 PHE CB . 50707 1 1101 . 1 . 1 272 272 PHE N N 15 120.461 0.000 . 1 . . . . . 270 PHE N . 50707 1 1102 . 1 . 1 273 273 GLY H H 1 10.039 0.000 . 1 . . . . . 271 GLY H . 50707 1 1103 . 1 . 1 273 273 GLY C C 13 176.130 0.000 . 1 . . . . . 271 GLY C . 50707 1 1104 . 1 . 1 273 273 GLY CA C 13 46.663 0.000 . 1 . . . . . 271 GLY CA . 50707 1 1105 . 1 . 1 273 273 GLY N N 15 111.580 0.000 . 1 . . . . . 271 GLY N . 50707 1 1106 . 1 . 1 274 274 GLU H H 1 8.185 0.000 . 1 . . . . . 272 GLU H . 50707 1 1107 . 1 . 1 274 274 GLU C C 13 177.354 0.000 . 1 . . . . . 272 GLU C . 50707 1 1108 . 1 . 1 274 274 GLU CA C 13 59.358 0.000 . 1 . . . . . 272 GLU CA . 50707 1 1109 . 1 . 1 274 274 GLU CB C 13 26.743 0.000 . 1 . . . . . 272 GLU CB . 50707 1 1110 . 1 . 1 274 274 GLU N N 15 124.177 0.000 . 1 . . . . . 272 GLU N . 50707 1 1111 . 1 . 1 275 275 GLU H H 1 8.146 0.000 . 1 . . . . . 273 GLU H . 50707 1 1112 . 1 . 1 275 275 GLU C C 13 178.026 0.000 . 1 . . . . . 273 GLU C . 50707 1 1113 . 1 . 1 275 275 GLU CA C 13 60.163 0.000 . 1 . . . . . 273 GLU CA . 50707 1 1114 . 1 . 1 275 275 GLU CB C 13 27.472 0.000 . 1 . . . . . 273 GLU CB . 50707 1 1115 . 1 . 1 275 275 GLU N N 15 120.350 0.000 . 1 . . . . . 273 GLU N . 50707 1 1116 . 1 . 1 276 276 ILE H H 1 7.377 0.000 . 1 . . . . . 274 ILE H . 50707 1 1117 . 1 . 1 276 276 ILE CA C 13 65.588 0.000 . 1 . . . . . 274 ILE CA . 50707 1 1118 . 1 . 1 276 276 ILE CB C 13 37.151 0.000 . 1 . . . . . 274 ILE CB . 50707 1 1119 . 1 . 1 276 276 ILE N N 15 117.779 0.000 . 1 . . . . . 274 ILE N . 50707 1 1120 . 1 . 1 278 278 ARG C C 13 179.068 0.000 . 1 . . . . . 276 ARG C . 50707 1 1121 . 1 . 1 279 279 LEU H H 1 8.428 0.000 . 1 . . . . . 277 LEU H . 50707 1 1122 . 1 . 1 279 279 LEU C C 13 179.306 0.000 . 1 . . . . . 277 LEU C . 50707 1 1123 . 1 . 1 279 279 LEU CA C 13 57.476 0.000 . 1 . . . . . 277 LEU CA . 50707 1 1124 . 1 . 1 279 279 LEU CB C 13 43.225 0.000 . 1 . . . . . 277 LEU CB . 50707 1 1125 . 1 . 1 279 279 LEU N N 15 121.097 0.000 . 1 . . . . . 277 LEU N . 50707 1 1126 . 1 . 1 280 280 GLN H H 1 9.020 0.000 . 1 . . . . . 278 GLN H . 50707 1 1127 . 1 . 1 280 280 GLN C C 13 178.940 0.000 . 1 . . . . . 278 GLN C . 50707 1 1128 . 1 . 1 280 280 GLN CA C 13 58.506 0.000 . 1 . . . . . 278 GLN CA . 50707 1 1129 . 1 . 1 280 280 GLN CB C 13 27.207 0.000 . 1 . . . . . 278 GLN CB . 50707 1 1130 . 1 . 1 280 280 GLN N N 15 118.606 0.000 . 1 . . . . . 278 GLN N . 50707 1 1131 . 1 . 1 281 281 HIS H H 1 7.714 0.000 . 1 . . . . . 279 HIS H . 50707 1 1132 . 1 . 1 281 281 HIS C C 13 176.822 0.000 . 1 . . . . . 279 HIS C . 50707 1 1133 . 1 . 1 281 281 HIS CA C 13 56.553 0.000 . 1 . . . . . 279 HIS CA . 50707 1 1134 . 1 . 1 281 281 HIS CB C 13 28.798 0.000 . 1 . . . . . 279 HIS CB . 50707 1 1135 . 1 . 1 281 281 HIS N N 15 119.559 0.000 . 1 . . . . . 279 HIS N . 50707 1 1136 . 1 . 1 282 282 ALA H H 1 8.485 0.000 . 1 . . . . . 280 ALA H . 50707 1 1137 . 1 . 1 282 282 ALA C C 13 178.186 0.000 . 1 . . . . . 280 ALA C . 50707 1 1138 . 1 . 1 282 282 ALA CA C 13 55.210 0.000 . 1 . . . . . 280 ALA CA . 50707 1 1139 . 1 . 1 282 282 ALA CB C 13 16.335 0.000 . 1 . . . . . 280 ALA CB . 50707 1 1140 . 1 . 1 282 282 ALA N N 15 120.998 0.000 . 1 . . . . . 280 ALA N . 50707 1 1141 . 1 . 1 283 283 ALA H H 1 8.665 0.000 . 1 . . . . . 281 ALA H . 50707 1 1142 . 1 . 1 283 283 ALA C C 13 180.571 0.000 . 1 . . . . . 281 ALA C . 50707 1 1143 . 1 . 1 283 283 ALA CA C 13 54.477 0.000 . 1 . . . . . 281 ALA CA . 50707 1 1144 . 1 . 1 283 283 ALA CB C 13 16.534 0.000 . 1 . . . . . 281 ALA CB . 50707 1 1145 . 1 . 1 283 283 ALA N N 15 119.048 0.000 . 1 . . . . . 281 ALA N . 50707 1 1146 . 1 . 1 284 284 GLU H H 1 7.983 0.000 . 1 . . . . . 282 GLU H . 50707 1 1147 . 1 . 1 284 284 GLU C C 13 179.556 0.000 . 1 . . . . . 282 GLU C . 50707 1 1148 . 1 . 1 284 284 GLU CA C 13 58.797 0.000 . 1 . . . . . 282 GLU CA . 50707 1 1149 . 1 . 1 284 284 GLU CB C 13 28.533 0.000 . 1 . . . . . 282 GLU CB . 50707 1 1150 . 1 . 1 284 284 GLU N N 15 121.165 0.000 . 1 . . . . . 282 GLU N . 50707 1 1151 . 1 . 1 285 285 LEU H H 1 8.122 0.000 . 1 . . . . . 283 LEU H . 50707 1 1152 . 1 . 1 285 285 LEU C C 13 179.236 0.000 . 1 . . . . . 283 LEU C . 50707 1 1153 . 1 . 1 285 285 LEU CA C 13 57.517 0.000 . 1 . . . . . 283 LEU CA . 50707 1 1154 . 1 . 1 285 285 LEU CB C 13 41.924 0.000 . 1 . . . . . 283 LEU CB . 50707 1 1155 . 1 . 1 285 285 LEU N N 15 122.747 0.000 . 1 . . . . . 283 LEU N . 50707 1 1156 . 1 . 1 286 286 ILE H H 1 8.009 0.000 . 1 . . . . . 284 ILE H . 50707 1 1157 . 1 . 1 286 286 ILE C C 13 177.525 0.000 . 1 . . . . . 284 ILE C . 50707 1 1158 . 1 . 1 286 286 ILE CA C 13 60.899 0.000 . 1 . . . . . 284 ILE CA . 50707 1 1159 . 1 . 1 286 286 ILE CB C 13 40.797 0.000 . 1 . . . . . 284 ILE CB . 50707 1 1160 . 1 . 1 286 286 ILE N N 15 118.517 0.000 . 1 . . . . . 284 ILE N . 50707 1 1161 . 1 . 1 287 287 LYS H H 1 8.107 0.000 . 1 . . . . . 285 LYS H . 50707 1 1162 . 1 . 1 287 287 LYS C C 13 179.948 0.000 . 1 . . . . . 285 LYS C . 50707 1 1163 . 1 . 1 287 287 LYS CA C 13 59.042 0.000 . 1 . . . . . 285 LYS CA . 50707 1 1164 . 1 . 1 287 287 LYS CB C 13 30.920 0.000 . 1 . . . . . 285 LYS CB . 50707 1 1165 . 1 . 1 287 287 LYS N N 15 123.696 0.000 . 1 . . . . . 285 LYS N . 50707 1 1166 . 1 . 1 288 288 THR H H 1 7.852 0.000 . 1 . . . . . 286 THR H . 50707 1 1167 . 1 . 1 288 288 THR C C 13 175.928 0.000 . 1 . . . . . 286 THR C . 50707 1 1168 . 1 . 1 288 288 THR CA C 13 66.320 0.000 . 1 . . . . . 286 THR CA . 50707 1 1169 . 1 . 1 288 288 THR CB C 13 67.911 0.000 . 1 . . . . . 286 THR CB . 50707 1 1170 . 1 . 1 288 288 THR N N 15 117.540 0.000 . 1 . . . . . 286 THR N . 50707 1 1171 . 1 . 1 289 289 VAL H H 1 7.575 0.000 . 1 . . . . . 287 VAL H . 50707 1 1172 . 1 . 1 289 289 VAL C C 13 177.663 0.000 . 1 . . . . . 287 VAL C . 50707 1 1173 . 1 . 1 289 289 VAL CA C 13 65.710 0.000 . 1 . . . . . 287 VAL CA . 50707 1 1174 . 1 . 1 289 289 VAL CB C 13 30.323 0.000 . 1 . . . . . 287 VAL CB . 50707 1 1175 . 1 . 1 289 289 VAL N N 15 121.598 0.000 . 1 . . . . . 287 VAL N . 50707 1 1176 . 1 . 1 290 290 ALA H H 1 8.417 0.000 . 1 . . . . . 288 ALA H . 50707 1 1177 . 1 . 1 290 290 ALA C C 13 178.846 0.000 . 1 . . . . . 288 ALA C . 50707 1 1178 . 1 . 1 290 290 ALA CA C 13 53.859 0.000 . 1 . . . . . 288 ALA CA . 50707 1 1179 . 1 . 1 290 290 ALA CB C 13 17.263 0.000 . 1 . . . . . 288 ALA CB . 50707 1 1180 . 1 . 1 290 290 ALA N N 15 122.469 0.000 . 1 . . . . . 288 ALA N . 50707 1 1181 . 1 . 1 291 291 SER H H 1 7.643 0.000 . 1 . . . . . 289 SER H . 50707 1 1182 . 1 . 1 291 291 SER C C 13 175.928 0.000 . 1 . . . . . 289 SER C . 50707 1 1183 . 1 . 1 291 291 SER CA C 13 59.605 0.000 . 1 . . . . . 289 SER CA . 50707 1 1184 . 1 . 1 291 291 SER CB C 13 63.138 0.000 . 1 . . . . . 289 SER CB . 50707 1 1185 . 1 . 1 291 291 SER N N 15 109.709 0.000 . 1 . . . . . 289 SER N . 50707 1 1186 . 1 . 1 292 292 ARG H H 1 7.627 0.000 . 1 . . . . . 290 ARG H . 50707 1 1187 . 1 . 1 292 292 ARG C C 13 177.582 0.000 . 1 . . . . . 290 ARG C . 50707 1 1188 . 1 . 1 292 292 ARG CA C 13 56.919 0.000 . 1 . . . . . 290 ARG CA . 50707 1 1189 . 1 . 1 292 292 ARG CB C 13 30.389 0.000 . 1 . . . . . 290 ARG CB . 50707 1 1190 . 1 . 1 292 292 ARG N N 15 118.294 0.000 . 1 . . . . . 290 ARG N . 50707 1 1191 . 1 . 1 293 293 TYR H H 1 8.173 0.000 . 1 . . . . . 291 TYR H . 50707 1 1192 . 1 . 1 293 293 TYR C C 13 176.311 0.000 . 1 . . . . . 291 TYR C . 50707 1 1193 . 1 . 1 293 293 TYR CA C 13 55.210 0.000 . 1 . . . . . 291 TYR CA . 50707 1 1194 . 1 . 1 293 293 TYR CB C 13 38.212 0.000 . 1 . . . . . 291 TYR CB . 50707 1 1195 . 1 . 1 293 293 TYR N N 15 117.473 0.000 . 1 . . . . . 291 TYR N . 50707 1 1196 . 1 . 1 294 294 ASP H H 1 7.858 0.000 . 1 . . . . . 292 ASP H . 50707 1 1197 . 1 . 1 294 294 ASP C C 13 176.817 0.000 . 1 . . . . . 292 ASP C . 50707 1 1198 . 1 . 1 294 294 ASP CA C 13 56.675 0.000 . 1 . . . . . 292 ASP CA . 50707 1 1199 . 1 . 1 294 294 ASP CB C 13 40.797 0.000 . 1 . . . . . 292 ASP CB . 50707 1 1200 . 1 . 1 294 294 ASP N N 15 121.724 0.000 . 1 . . . . . 292 ASP N . 50707 1 1201 . 1 . 1 295 295 GLU H H 1 8.619 0.000 . 1 . . . . . 293 GLU H . 50707 1 1202 . 1 . 1 295 295 GLU C C 13 176.654 0.000 . 1 . . . . . 293 GLU C . 50707 1 1203 . 1 . 1 295 295 GLU CA C 13 57.285 0.000 . 1 . . . . . 293 GLU CA . 50707 1 1204 . 1 . 1 295 295 GLU CB C 13 28.322 0.000 . 1 . . . . . 293 GLU CB . 50707 1 1205 . 1 . 1 295 295 GLU N N 15 116.239 0.000 . 1 . . . . . 293 GLU N . 50707 1 1206 . 1 . 1 296 296 TYR H H 1 7.902 0.000 . 1 . . . . . 294 TYR H . 50707 1 1207 . 1 . 1 296 296 TYR C C 13 175.324 0.000 . 1 . . . . . 294 TYR C . 50707 1 1208 . 1 . 1 296 296 TYR CA C 13 58.628 0.000 . 1 . . . . . 294 TYR CA . 50707 1 1209 . 1 . 1 296 296 TYR CB C 13 40.068 0.000 . 1 . . . . . 294 TYR CB . 50707 1 1210 . 1 . 1 296 296 TYR N N 15 116.061 0.000 . 1 . . . . . 294 TYR N . 50707 1 1211 . 1 . 1 297 297 VAL H H 1 7.450 0.000 . 1 . . . . . 295 VAL H . 50707 1 1212 . 1 . 1 297 297 VAL C C 13 173.119 0.000 . 1 . . . . . 295 VAL C . 50707 1 1213 . 1 . 1 297 297 VAL CA C 13 59.239 0.000 . 1 . . . . . 295 VAL CA . 50707 1 1214 . 1 . 1 297 297 VAL CB C 13 34.102 0.000 . 1 . . . . . 295 VAL CB . 50707 1 1215 . 1 . 1 297 297 VAL N N 15 112.907 0.000 . 1 . . . . . 295 VAL N . 50707 1 1216 . 1 . 1 298 298 ASN H H 1 8.382 0.000 . 1 . . . . . 296 ASN H . 50707 1 1217 . 1 . 1 298 298 ASN C C 13 176.251 0.000 . 1 . . . . . 296 ASN C . 50707 1 1218 . 1 . 1 298 298 ASN CA C 13 51.791 0.000 . 1 . . . . . 296 ASN CA . 50707 1 1219 . 1 . 1 298 298 ASN CB C 13 38.610 0.000 . 1 . . . . . 296 ASN CB . 50707 1 1220 . 1 . 1 298 298 ASN N N 15 121.977 0.000 . 1 . . . . . 296 ASN N . 50707 1 1221 . 1 . 1 299 299 VAL H H 1 8.674 0.000 . 1 . . . . . 297 VAL H . 50707 1 1222 . 1 . 1 299 299 VAL C C 13 175.969 0.000 . 1 . . . . . 297 VAL C . 50707 1 1223 . 1 . 1 299 299 VAL CA C 13 59.483 0.000 . 1 . . . . . 297 VAL CA . 50707 1 1224 . 1 . 1 299 299 VAL CB C 13 31.251 0.000 . 1 . . . . . 297 VAL CB . 50707 1 1225 . 1 . 1 299 299 VAL N N 15 117.087 0.000 . 1 . . . . . 297 VAL N . 50707 1 1226 . 1 . 1 300 300 LYS H H 1 7.802 0.000 . 1 . . . . . 298 LYS H . 50707 1 1227 . 1 . 1 300 300 LYS C C 13 178.187 0.000 . 1 . . . . . 298 LYS C . 50707 1 1228 . 1 . 1 300 300 LYS CA C 13 59.971 0.000 . 1 . . . . . 298 LYS CA . 50707 1 1229 . 1 . 1 300 300 LYS CB C 13 31.317 0.000 . 1 . . . . . 298 LYS CB . 50707 1 1230 . 1 . 1 300 300 LYS N N 15 124.582 0.000 . 1 . . . . . 298 LYS N . 50707 1 1231 . 1 . 1 301 301 ASP H H 1 8.503 0.000 . 1 . . . . . 299 ASP H . 50707 1 1232 . 1 . 1 301 301 ASP C C 13 178.927 0.000 . 1 . . . . . 299 ASP C . 50707 1 1233 . 1 . 1 301 301 ASP CA C 13 57.041 0.000 . 1 . . . . . 299 ASP CA . 50707 1 1234 . 1 . 1 301 301 ASP CB C 13 39.206 0.000 . 1 . . . . . 299 ASP CB . 50707 1 1235 . 1 . 1 301 301 ASP N N 15 118.363 0.000 . 1 . . . . . 299 ASP N . 50707 1 1236 . 1 . 1 302 302 PHE H H 1 8.106 0.000 . 1 . . . . . 300 PHE H . 50707 1 1237 . 1 . 1 302 302 PHE C C 13 177.152 0.000 . 1 . . . . . 300 PHE C . 50707 1 1238 . 1 . 1 302 302 PHE CA C 13 57.651 0.000 . 1 . . . . . 300 PHE CA . 50707 1 1239 . 1 . 1 302 302 PHE CB C 13 37.880 0.000 . 1 . . . . . 300 PHE CB . 50707 1 1240 . 1 . 1 302 302 PHE N N 15 123.016 0.000 . 1 . . . . . 300 PHE N . 50707 1 1241 . 1 . 1 303 303 SER H H 1 8.603 0.000 . 1 . . . . . 301 SER H . 50707 1 1242 . 1 . 1 303 303 SER C C 13 177.380 0.000 . 1 . . . . . 301 SER C . 50707 1 1243 . 1 . 1 303 303 SER CA C 13 60.826 0.000 . 1 . . . . . 301 SER CA . 50707 1 1244 . 1 . 1 303 303 SER CB C 13 62.143 0.000 . 1 . . . . . 301 SER CB . 50707 1 1245 . 1 . 1 303 303 SER N N 15 113.166 0.000 . 1 . . . . . 301 SER N . 50707 1 1246 . 1 . 1 304 304 ASP H H 1 8.149 0.000 . 1 . . . . . 302 ASP H . 50707 1 1247 . 1 . 1 304 304 ASP C C 13 178.026 0.000 . 1 . . . . . 302 ASP C . 50707 1 1248 . 1 . 1 304 304 ASP CA C 13 57.163 0.000 . 1 . . . . . 302 ASP CA . 50707 1 1249 . 1 . 1 304 304 ASP CB C 13 39.670 0.000 . 1 . . . . . 302 ASP CB . 50707 1 1250 . 1 . 1 304 304 ASP N N 15 120.347 0.000 . 1 . . . . . 302 ASP N . 50707 1 1251 . 1 . 1 305 305 LYS H H 1 7.695 0.000 . 1 . . . . . 303 LYS H . 50707 1 1252 . 1 . 1 305 305 LYS C C 13 179.881 0.000 . 1 . . . . . 303 LYS C . 50707 1 1253 . 1 . 1 305 305 LYS CA C 13 59.483 0.000 . 1 . . . . . 303 LYS CA . 50707 1 1254 . 1 . 1 305 305 LYS CB C 13 31.251 0.000 . 1 . . . . . 303 LYS CB . 50707 1 1255 . 1 . 1 305 305 LYS N N 15 121.796 0.000 . 1 . . . . . 303 LYS N . 50707 1 1256 . 1 . 1 306 306 ILE H H 1 8.118 0.000 . 1 . . . . . 304 ILE H . 50707 1 1257 . 1 . 1 306 306 ILE C C 13 177.421 0.000 . 1 . . . . . 304 ILE C . 50707 1 1258 . 1 . 1 306 306 ILE CA C 13 64.016 0.000 . 1 . . . . . 304 ILE CA . 50707 1 1259 . 1 . 1 306 306 ILE CB C 13 36.356 0.000 . 1 . . . . . 304 ILE CB . 50707 1 1260 . 1 . 1 306 306 ILE N N 15 120.680 0.000 . 1 . . . . . 304 ILE N . 50707 1 1261 . 1 . 1 307 307 ASN H H 1 8.343 0.000 . 1 . . . . . 305 ASN H . 50707 1 1262 . 1 . 1 307 307 ASN C C 13 178.913 0.000 . 1 . . . . . 305 ASN C . 50707 1 1263 . 1 . 1 307 307 ASN CA C 13 56.308 0.000 . 1 . . . . . 305 ASN CA . 50707 1 1264 . 1 . 1 307 307 ASN CB C 13 37.271 0.000 . 1 . . . . . 305 ASN CB . 50707 1 1265 . 1 . 1 307 307 ASN N N 15 118.327 0.000 . 1 . . . . . 305 ASN N . 50707 1 1266 . 1 . 1 308 308 ARG H H 1 8.330 0.000 . 1 . . . . . 306 ARG H . 50707 1 1267 . 1 . 1 308 308 ARG C C 13 179.290 0.000 . 1 . . . . . 306 ARG C . 50707 1 1268 . 1 . 1 308 308 ARG CA C 13 59.182 0.000 . 1 . . . . . 306 ARG CA . 50707 1 1269 . 1 . 1 308 308 ARG CB C 13 29.164 0.000 . 1 . . . . . 306 ARG CB . 50707 1 1270 . 1 . 1 308 308 ARG N N 15 121.493 0.000 . 1 . . . . . 306 ARG N . 50707 1 1271 . 1 . 1 309 309 ALA H H 1 7.699 0.000 . 1 . . . . . 307 ALA H . 50707 1 1272 . 1 . 1 309 309 ALA C C 13 180.513 0.000 . 1 . . . . . 307 ALA C . 50707 1 1273 . 1 . 1 309 309 ALA CA C 13 54.560 0.000 . 1 . . . . . 307 ALA CA . 50707 1 1274 . 1 . 1 309 309 ALA CB C 13 17.379 0.000 . 1 . . . . . 307 ALA CB . 50707 1 1275 . 1 . 1 309 309 ALA N N 15 123.898 0.000 . 1 . . . . . 307 ALA N . 50707 1 1276 . 1 . 1 310 310 LEU H H 1 8.899 0.000 . 1 . . . . . 308 LEU H . 50707 1 1277 . 1 . 1 310 310 LEU C C 13 177.367 0.000 . 1 . . . . . 308 LEU C . 50707 1 1278 . 1 . 1 310 310 LEU CA C 13 57.285 0.000 . 1 . . . . . 308 LEU CA . 50707 1 1279 . 1 . 1 310 310 LEU CB C 13 40.930 0.000 . 1 . . . . . 308 LEU CB . 50707 1 1280 . 1 . 1 310 310 LEU N N 15 122.020 0.000 . 1 . . . . . 308 LEU N . 50707 1 1281 . 1 . 1 311 311 ALA H H 1 8.034 0.000 . 1 . . . . . 309 ALA H . 50707 1 1282 . 1 . 1 311 311 ALA C C 13 181.067 0.000 . 1 . . . . . 309 ALA C . 50707 1 1283 . 1 . 1 311 311 ALA CA C 13 54.560 0.000 . 1 . . . . . 309 ALA CA . 50707 1 1284 . 1 . 1 311 311 ALA CB C 13 16.976 0.000 . 1 . . . . . 309 ALA CB . 50707 1 1285 . 1 . 1 311 311 ALA N N 15 121.229 0.000 . 1 . . . . . 309 ALA N . 50707 1 1286 . 1 . 1 312 312 ALA H H 1 7.505 0.000 . 1 . . . . . 310 ALA H . 50707 1 1287 . 1 . 1 312 312 ALA C C 13 179.397 0.000 . 1 . . . . . 310 ALA C . 50707 1 1288 . 1 . 1 312 312 ALA CA C 13 54.355 0.000 . 1 . . . . . 310 ALA CA . 50707 1 1289 . 1 . 1 312 312 ALA CB C 13 17.197 0.000 . 1 . . . . . 310 ALA CB . 50707 1 1290 . 1 . 1 312 312 ALA N N 15 120.611 0.000 . 1 . . . . . 310 ALA N . 50707 1 1291 . 1 . 1 313 313 ALA H H 1 8.023 0.000 . 1 . . . . . 311 ALA H . 50707 1 1292 . 1 . 1 313 313 ALA C C 13 181.668 0.000 . 1 . . . . . 311 ALA C . 50707 1 1293 . 1 . 1 313 313 ALA CA C 13 54.299 0.000 . 1 . . . . . 311 ALA CA . 50707 1 1294 . 1 . 1 313 313 ALA CB C 13 17.263 0.000 . 1 . . . . . 311 ALA CB . 50707 1 1295 . 1 . 1 313 313 ALA N N 15 121.505 0.000 . 1 . . . . . 311 ALA N . 50707 1 1296 . 1 . 1 314 314 LYS H H 1 8.635 0.000 . 1 . . . . . 312 LYS H . 50707 1 1297 . 1 . 1 314 314 LYS C C 13 177.811 0.000 . 1 . . . . . 312 LYS C . 50707 1 1298 . 1 . 1 314 314 LYS CA C 13 59.743 0.000 . 1 . . . . . 312 LYS CA . 50707 1 1299 . 1 . 1 314 314 LYS CB C 13 31.185 0.000 . 1 . . . . . 312 LYS CB . 50707 1 1300 . 1 . 1 314 314 LYS N N 15 119.350 0.000 . 1 . . . . . 312 LYS N . 50707 1 1301 . 1 . 1 315 315 LYS H H 1 7.447 0.000 . 1 . . . . . 313 LYS H . 50707 1 1302 . 1 . 1 315 315 LYS C C 13 178.886 0.000 . 1 . . . . . 313 LYS C . 50707 1 1303 . 1 . 1 315 315 LYS CA C 13 59.361 0.000 . 1 . . . . . 313 LYS CA . 50707 1 1304 . 1 . 1 315 315 LYS CB C 13 30.920 0.000 . 1 . . . . . 313 LYS CB . 50707 1 1305 . 1 . 1 315 315 LYS N N 15 119.492 0.000 . 1 . . . . . 313 LYS N . 50707 1 1306 . 1 . 1 319 319 PHE C C 13 176.203 0.000 . 1 . . . . . 317 PHE C . 50707 1 1307 . 1 . 1 319 319 PHE CA C 13 58.482 0.000 . 1 . . . . . 317 PHE CA . 50707 1 1308 . 1 . 1 320 320 ILE H H 1 7.748 0.000 . 1 . . . . . 318 ILE H . 50707 1 1309 . 1 . 1 320 320 ILE C C 13 176.991 0.000 . 1 . . . . . 318 ILE C . 50707 1 1310 . 1 . 1 320 320 ILE CA C 13 62.657 0.000 . 1 . . . . . 318 ILE CA . 50707 1 1311 . 1 . 1 320 320 ILE CB C 13 39.074 0.000 . 1 . . . . . 318 ILE CB . 50707 1 1312 . 1 . 1 320 320 ILE N N 15 118.513 0.000 . 1 . . . . . 318 ILE N . 50707 1 1313 . 1 . 1 321 321 TYR H H 1 6.557 0.000 . 1 . . . . . 319 TYR H . 50707 1 1314 . 1 . 1 321 321 TYR C C 13 177.165 0.000 . 1 . . . . . 319 TYR C . 50707 1 1315 . 1 . 1 321 321 TYR CA C 13 60.215 0.000 . 1 . . . . . 319 TYR CA . 50707 1 1316 . 1 . 1 321 321 TYR CB C 13 36.753 0.000 . 1 . . . . . 319 TYR CB . 50707 1 1317 . 1 . 1 321 321 TYR N N 15 118.350 0.000 . 1 . . . . . 319 TYR N . 50707 1 1318 . 1 . 1 322 322 HIS H H 1 9.421 0.000 . 1 . . . . . 320 HIS H . 50707 1 1319 . 1 . 1 322 322 HIS C C 13 174.665 0.000 . 1 . . . . . 320 HIS C . 50707 1 1320 . 1 . 1 322 322 HIS CA C 13 54.477 0.000 . 1 . . . . . 320 HIS CA . 50707 1 1321 . 1 . 1 322 322 HIS CB C 13 25.086 0.000 . 1 . . . . . 320 HIS CB . 50707 1 1322 . 1 . 1 322 322 HIS N N 15 115.105 0.000 . 1 . . . . . 320 HIS N . 50707 1 1323 . 1 . 1 323 323 ASP H H 1 9.558 0.000 . 1 . . . . . 321 ASP H . 50707 1 1324 . 1 . 1 323 323 ASP C C 13 177.985 0.000 . 1 . . . . . 321 ASP C . 50707 1 1325 . 1 . 1 323 323 ASP CA C 13 53.744 0.000 . 1 . . . . . 321 ASP CA . 50707 1 1326 . 1 . 1 323 323 ASP CB C 13 41.460 0.000 . 1 . . . . . 321 ASP CB . 50707 1 1327 . 1 . 1 323 323 ASP N N 15 122.246 0.000 . 1 . . . . . 321 ASP N . 50707 1 1328 . 1 . 1 324 324 ARG H H 1 8.198 0.000 . 1 . . . . . 322 ARG H . 50707 1 1329 . 1 . 1 324 324 ARG C C 13 175.713 0.000 . 1 . . . . . 322 ARG C . 50707 1 1330 . 1 . 1 324 324 ARG CA C 13 55.576 0.000 . 1 . . . . . 322 ARG CA . 50707 1 1331 . 1 . 1 324 324 ARG CB C 13 29.498 0.000 . 1 . . . . . 322 ARG CB . 50707 1 1332 . 1 . 1 324 324 ARG N N 15 125.891 0.000 . 1 . . . . . 322 ARG N . 50707 1 1333 . 1 . 1 325 325 VAL H H 1 8.609 0.000 . 1 . . . . . 323 VAL H . 50707 1 1334 . 1 . 1 325 325 VAL C C 13 174.369 0.000 . 1 . . . . . 323 VAL C . 50707 1 1335 . 1 . 1 325 325 VAL CA C 13 59.582 0.000 . 1 . . . . . 323 VAL CA . 50707 1 1336 . 1 . 1 325 325 VAL CB C 13 30.889 0.000 . 1 . . . . . 323 VAL CB . 50707 1 1337 . 1 . 1 325 325 VAL N N 15 129.312 0.000 . 1 . . . . . 323 VAL N . 50707 1 1338 . 1 . 1 326 326 PRO C C 13 175.400 0.000 . 1 . . . . . 324 PRO C . 50707 1 1339 . 1 . 1 326 326 PRO CA C 13 61.559 0.000 . 1 . . . . . 324 PRO CA . 50707 1 1340 . 1 . 1 326 326 PRO CB C 13 31.185 0.000 . 1 . . . . . 324 PRO CB . 50707 1 1341 . 1 . 1 327 327 ASP H H 1 8.367 0.000 . 1 . . . . . 325 ASP H . 50707 1 1342 . 1 . 1 327 327 ASP C C 13 177.394 0.000 . 1 . . . . . 325 ASP C . 50707 1 1343 . 1 . 1 327 327 ASP CA C 13 53.622 0.000 . 1 . . . . . 325 ASP CA . 50707 1 1344 . 1 . 1 327 327 ASP CB C 13 41.394 0.000 . 1 . . . . . 325 ASP CB . 50707 1 1345 . 1 . 1 327 327 ASP N N 15 119.886 0.000 . 1 . . . . . 325 ASP N . 50707 1 1346 . 1 . 1 328 328 LEU H H 1 8.107 0.000 . 1 . . . . . 326 LEU H . 50707 1 1347 . 1 . 1 328 328 LEU C C 13 179.908 0.000 . 1 . . . . . 326 LEU C . 50707 1 1348 . 1 . 1 328 328 LEU CA C 13 57.651 0.000 . 1 . . . . . 326 LEU CA . 50707 1 1349 . 1 . 1 328 328 LEU CB C 13 40.190 0.000 . 1 . . . . . 326 LEU CB . 50707 1 1350 . 1 . 1 328 328 LEU N N 15 125.103 0.000 . 1 . . . . . 326 LEU N . 50707 1 1351 . 1 . 1 329 329 LYS H H 1 8.363 0.000 . 1 . . . . . 327 LYS H . 50707 1 1352 . 1 . 1 329 329 LYS C C 13 176.628 0.000 . 1 . . . . . 327 LYS C . 50707 1 1353 . 1 . 1 329 329 LYS CA C 13 57.407 0.000 . 1 . . . . . 327 LYS CA . 50707 1 1354 . 1 . 1 329 329 LYS CB C 13 30.257 0.000 . 1 . . . . . 327 LYS CB . 50707 1 1355 . 1 . 1 329 329 LYS N N 15 115.780 0.000 . 1 . . . . . 327 LYS N . 50707 1 1356 . 1 . 1 330 330 ASP H H 1 7.553 0.000 . 1 . . . . . 328 ASP H . 50707 1 1357 . 1 . 1 330 330 ASP C C 13 176.372 0.000 . 1 . . . . . 328 ASP C . 50707 1 1358 . 1 . 1 330 330 ASP CA C 13 54.111 0.000 . 1 . . . . . 328 ASP CA . 50707 1 1359 . 1 . 1 330 330 ASP CB C 13 40.863 0.000 . 1 . . . . . 328 ASP CB . 50707 1 1360 . 1 . 1 330 330 ASP N N 15 118.810 0.000 . 1 . . . . . 328 ASP N . 50707 1 1361 . 1 . 1 331 331 LEU H H 1 7.064 0.000 . 1 . . . . . 329 LEU H . 50707 1 1362 . 1 . 1 331 331 LEU C C 13 177.206 0.000 . 1 . . . . . 329 LEU C . 50707 1 1363 . 1 . 1 331 331 LEU CA C 13 53.378 0.000 . 1 . . . . . 329 LEU CA . 50707 1 1364 . 1 . 1 331 331 LEU CB C 13 41.328 0.000 . 1 . . . . . 329 LEU CB . 50707 1 1365 . 1 . 1 331 331 LEU N N 15 120.202 0.000 . 1 . . . . . 329 LEU N . 50707 1 1366 . 1 . 1 332 332 ASP H H 1 8.544 0.000 . 1 . . . . . 330 ASP H . 50707 1 1367 . 1 . 1 332 332 ASP C C 13 174.382 0.000 . 1 . . . . . 330 ASP C . 50707 1 1368 . 1 . 1 332 332 ASP CA C 13 52.523 0.000 . 1 . . . . . 330 ASP CA . 50707 1 1369 . 1 . 1 332 332 ASP CB C 13 38.808 0.000 . 1 . . . . . 330 ASP CB . 50707 1 1370 . 1 . 1 332 332 ASP N N 15 123.745 0.000 . 1 . . . . . 330 ASP N . 50707 1 1371 . 1 . 1 333 333 PRO C C 13 177.006 0.000 . 1 . . . . . 331 PRO C . 50707 1 1372 . 1 . 1 333 333 PRO CA C 13 62.464 0.000 . 1 . . . . . 331 PRO CA . 50707 1 1373 . 1 . 1 333 333 PRO CB C 13 30.787 0.000 . 1 . . . . . 331 PRO CB . 50707 1 1374 . 1 . 1 334 334 ILE H H 1 8.407 0.000 . 1 . . . . . 332 ILE H . 50707 1 1375 . 1 . 1 334 334 ILE C C 13 176.789 0.000 . 1 . . . . . 332 ILE C . 50707 1 1376 . 1 . 1 334 334 ILE CA C 13 62.161 0.000 . 1 . . . . . 332 ILE CA . 50707 1 1377 . 1 . 1 334 334 ILE CB C 13 37.748 0.000 . 1 . . . . . 332 ILE CB . 50707 1 1378 . 1 . 1 334 334 ILE N N 15 126.263 0.000 . 1 . . . . . 332 ILE N . 50707 1 1379 . 1 . 1 335 335 GLY H H 1 8.656 0.000 . 1 . . . . . 333 GLY H . 50707 1 1380 . 1 . 1 335 335 GLY C C 13 172.379 0.000 . 1 . . . . . 333 GLY C . 50707 1 1381 . 1 . 1 335 335 GLY CA C 13 43.977 0.000 . 1 . . . . . 333 GLY CA . 50707 1 1382 . 1 . 1 335 335 GLY N N 15 112.102 0.000 . 1 . . . . . 333 GLY N . 50707 1 1383 . 1 . 1 336 336 LYS H H 1 8.084 0.000 . 1 . . . . . 334 LYS H . 50707 1 1384 . 1 . 1 336 336 LYS C C 13 174.719 0.000 . 1 . . . . . 334 LYS C . 50707 1 1385 . 1 . 1 336 336 LYS CA C 13 55.332 0.000 . 1 . . . . . 334 LYS CA . 50707 1 1386 . 1 . 1 336 336 LYS CB C 13 35.494 0.000 . 1 . . . . . 334 LYS CB . 50707 1 1387 . 1 . 1 336 336 LYS N N 15 116.055 0.000 . 1 . . . . . 334 LYS N . 50707 1 1388 . 1 . 1 337 337 ALA H H 1 6.678 0.000 . 1 . . . . . 335 ALA H . 50707 1 1389 . 1 . 1 337 337 ALA C C 13 174.463 0.000 . 1 . . . . . 335 ALA C . 50707 1 1390 . 1 . 1 337 337 ALA CA C 13 50.814 0.000 . 1 . . . . . 335 ALA CA . 50707 1 1391 . 1 . 1 337 337 ALA CB C 13 20.445 0.000 . 1 . . . . . 335 ALA CB . 50707 1 1392 . 1 . 1 337 337 ALA N N 15 123.990 0.000 . 1 . . . . . 335 ALA N . 50707 1 1393 . 1 . 1 338 338 THR H H 1 8.402 0.000 . 1 . . . . . 336 THR H . 50707 1 1394 . 1 . 1 338 338 THR C C 13 173.455 0.000 . 1 . . . . . 336 THR C . 50707 1 1395 . 1 . 1 338 338 THR CA C 13 58.750 0.000 . 1 . . . . . 336 THR CA . 50707 1 1396 . 1 . 1 338 338 THR CB C 13 69.237 0.000 . 1 . . . . . 336 THR CB . 50707 1 1397 . 1 . 1 338 338 THR N N 15 116.260 0.000 . 1 . . . . . 336 THR N . 50707 1 1398 . 1 . 1 339 339 LEU H H 1 8.205 0.000 . 1 . . . . . 337 LEU H . 50707 1 1399 . 1 . 1 339 339 LEU C C 13 175.512 0.000 . 1 . . . . . 337 LEU C . 50707 1 1400 . 1 . 1 339 339 LEU CA C 13 53.080 0.000 . 1 . . . . . 337 LEU CA . 50707 1 1401 . 1 . 1 339 339 LEU CB C 13 43.003 0.000 . 1 . . . . . 337 LEU CB . 50707 1 1402 . 1 . 1 339 339 LEU N N 15 128.832 0.000 . 1 . . . . . 337 LEU N . 50707 1 1403 . 1 . 1 340 340 VAL H H 1 7.663 0.000 . 1 . . . . . 338 VAL H . 50707 1 1404 . 1 . 1 340 340 VAL C C 13 174.840 0.000 . 1 . . . . . 338 VAL C . 50707 1 1405 . 1 . 1 340 340 VAL CA C 13 58.628 0.000 . 1 . . . . . 338 VAL CA . 50707 1 1406 . 1 . 1 340 340 VAL CB C 13 35.030 0.000 . 1 . . . . . 338 VAL CB . 50707 1 1407 . 1 . 1 340 340 VAL N N 15 110.018 0.000 . 1 . . . . . 338 VAL N . 50707 1 1408 . 1 . 1 341 341 LYS H H 1 8.788 0.000 . 1 . . . . . 339 LYS H . 50707 1 1409 . 1 . 1 341 341 LYS C C 13 175.149 0.000 . 1 . . . . . 339 LYS C . 50707 1 1410 . 1 . 1 341 341 LYS CA C 13 54.355 0.000 . 1 . . . . . 339 LYS CA . 50707 1 1411 . 1 . 1 341 341 LYS CB C 13 34.831 0.000 . 1 . . . . . 339 LYS CB . 50707 1 1412 . 1 . 1 341 341 LYS N N 15 120.026 0.000 . 1 . . . . . 339 LYS N . 50707 1 1413 . 1 . 1 342 342 SER H H 1 8.486 0.000 . 1 . . . . . 340 SER H . 50707 1 1414 . 1 . 1 342 342 SER C C 13 174.154 0.000 . 1 . . . . . 340 SER C . 50707 1 1415 . 1 . 1 342 342 SER CA C 13 58.384 0.000 . 1 . . . . . 340 SER CA . 50707 1 1416 . 1 . 1 342 342 SER CB C 13 61.397 0.000 . 1 . . . . . 340 SER CB . 50707 1 1417 . 1 . 1 342 342 SER N N 15 119.433 0.000 . 1 . . . . . 340 SER N . 50707 1 1418 . 1 . 1 343 343 THR H H 1 7.425 0.000 . 1 . . . . . 341 THR H . 50707 1 1419 . 1 . 1 343 343 THR C C 13 171.223 0.000 . 1 . . . . . 341 THR C . 50707 1 1420 . 1 . 1 343 343 THR CA C 13 61.506 0.000 . 1 . . . . . 341 THR CA . 50707 1 1421 . 1 . 1 343 343 THR CB C 13 69.833 0.000 . 1 . . . . . 341 THR CB . 50707 1 1422 . 1 . 1 343 343 THR N N 15 126.967 0.000 . 1 . . . . . 341 THR N . 50707 1 1423 . 1 . 1 344 344 PRO C C 13 176.446 0.000 . 1 . . . . . 342 PRO C . 50707 1 1424 . 1 . 1 344 344 PRO CA C 13 62.291 0.000 . 1 . . . . . 342 PRO CA . 50707 1 1425 . 1 . 1 344 344 PRO CB C 13 31.085 0.000 . 1 . . . . . 342 PRO CB . 50707 1 1426 . 1 . 1 345 345 VAL H H 1 8.547 0.000 . 1 . . . . . 343 VAL H . 50707 1 1427 . 1 . 1 345 345 VAL C C 13 174.033 0.000 . 1 . . . . . 343 VAL C . 50707 1 1428 . 1 . 1 345 345 VAL CA C 13 61.559 0.000 . 1 . . . . . 343 VAL CA . 50707 1 1429 . 1 . 1 345 345 VAL CB C 13 29.724 0.000 . 1 . . . . . 343 VAL CB . 50707 1 1430 . 1 . 1 345 345 VAL N N 15 124.561 0.000 . 1 . . . . . 343 VAL N . 50707 1 1431 . 1 . 1 346 346 ASN H H 1 7.167 0.000 . 1 . . . . . 344 ASN H . 50707 1 1432 . 1 . 1 346 346 ASN C C 13 172.675 0.000 . 1 . . . . . 344 ASN C . 50707 1 1433 . 1 . 1 346 346 ASN CA C 13 51.189 0.000 . 1 . . . . . 344 ASN CA . 50707 1 1434 . 1 . 1 346 346 ASN CB C 13 39.339 0.000 . 1 . . . . . 344 ASN CB . 50707 1 1435 . 1 . 1 346 346 ASN N N 15 127.215 0.000 . 1 . . . . . 344 ASN N . 50707 1 1436 . 1 . 1 347 347 VAL H H 1 8.101 0.000 . 1 . . . . . 345 VAL H . 50707 1 1437 . 1 . 1 347 347 VAL C C 13 175.108 0.000 . 1 . . . . . 345 VAL C . 50707 1 1438 . 1 . 1 347 347 VAL CA C 13 60.582 0.000 . 1 . . . . . 345 VAL CA . 50707 1 1439 . 1 . 1 347 347 VAL CB C 13 31.649 0.000 . 1 . . . . . 345 VAL CB . 50707 1 1440 . 1 . 1 347 347 VAL N N 15 124.279 0.000 . 1 . . . . . 345 VAL N . 50707 1 1441 . 1 . 1 348 348 PRO C C 13 176.603 0.000 . 1 . . . . . 346 PRO C . 50707 1 1442 . 1 . 1 348 348 PRO CA C 13 61.925 0.000 . 1 . . . . . 346 PRO CA . 50707 1 1443 . 1 . 1 348 348 PRO CB C 13 33.174 0.000 . 1 . . . . . 346 PRO CB . 50707 1 1444 . 1 . 1 349 349 ILE H H 1 11.640 0.000 . 1 . . . . . 347 ILE H . 50707 1 1445 . 1 . 1 349 349 ILE C C 13 177.528 0.000 . 1 . . . . . 347 ILE C . 50707 1 1446 . 1 . 1 349 349 ILE CA C 13 61.634 0.000 . 1 . . . . . 347 ILE CA . 50707 1 1447 . 1 . 1 349 349 ILE CB C 13 38.013 0.000 . 1 . . . . . 347 ILE CB . 50707 1 1448 . 1 . 1 349 349 ILE N N 15 126.611 0.000 . 1 . . . . . 347 ILE N . 50707 1 1449 . 1 . 1 350 350 SER H H 1 10.849 0.000 . 1 . . . . . 348 SER H . 50707 1 1450 . 1 . 1 350 350 SER C C 13 174.267 0.000 . 1 . . . . . 348 SER C . 50707 1 1451 . 1 . 1 350 350 SER CA C 13 58.202 0.000 . 1 . . . . . 348 SER CA . 50707 1 1452 . 1 . 1 350 350 SER CB C 13 64.530 0.000 . 1 . . . . . 348 SER CB . 50707 1 1453 . 1 . 1 350 350 SER N N 15 125.100 0.000 . 1 . . . . . 348 SER N . 50707 1 1454 . 1 . 1 351 351 GLN H H 1 9.638 0.000 . 1 . . . . . 349 GLN H . 50707 1 1455 . 1 . 1 351 351 GLN C C 13 176.937 0.000 . 1 . . . . . 349 GLN C . 50707 1 1456 . 1 . 1 351 351 GLN CA C 13 55.698 0.000 . 1 . . . . . 349 GLN CA . 50707 1 1457 . 1 . 1 351 351 GLN CB C 13 28.616 0.000 . 1 . . . . . 349 GLN CB . 50707 1 1458 . 1 . 1 351 351 GLN N N 15 121.263 0.000 . 1 . . . . . 349 GLN N . 50707 1 1459 . 1 . 1 352 352 LYS H H 1 8.821 0.000 . 1 . . . . . 350 LYS H . 50707 1 1460 . 1 . 1 352 352 LYS C C 13 175.606 0.000 . 1 . . . . . 350 LYS C . 50707 1 1461 . 1 . 1 352 352 LYS CA C 13 55.576 0.000 . 1 . . . . . 350 LYS CA . 50707 1 1462 . 1 . 1 352 352 LYS CB C 13 28.871 0.000 . 1 . . . . . 350 LYS CB . 50707 1 1463 . 1 . 1 352 352 LYS N N 15 122.897 0.000 . 1 . . . . . 350 LYS N . 50707 1 1464 . 1 . 1 353 353 PHE H H 1 8.219 0.000 . 1 . . . . . 351 PHE H . 50707 1 1465 . 1 . 1 353 353 PHE C C 13 176.211 0.000 . 1 . . . . . 351 PHE C . 50707 1 1466 . 1 . 1 353 353 PHE CA C 13 58.628 0.000 . 1 . . . . . 351 PHE CA . 50707 1 1467 . 1 . 1 353 353 PHE CB C 13 38.610 0.000 . 1 . . . . . 351 PHE CB . 50707 1 1468 . 1 . 1 353 353 PHE N N 15 121.512 0.000 . 1 . . . . . 351 PHE N . 50707 1 1469 . 1 . 1 354 354 THR H H 1 7.802 0.000 . 1 . . . . . 352 THR H . 50707 1 1470 . 1 . 1 354 354 THR C C 13 171.667 0.000 . 1 . . . . . 352 THR C . 50707 1 1471 . 1 . 1 354 354 THR CA C 13 60.228 0.000 . 1 . . . . . 352 THR CA . 50707 1 1472 . 1 . 1 354 354 THR CB C 13 70.099 0.000 . 1 . . . . . 352 THR CB . 50707 1 1473 . 1 . 1 354 354 THR N N 15 126.004 0.000 . 1 . . . . . 352 THR N . 50707 1 1474 . 1 . 1 355 355 ASP H H 1 8.285 0.000 . 1 . . . . . 353 ASP H . 50707 1 1475 . 1 . 1 355 355 ASP C C 13 178.160 0.000 . 1 . . . . . 353 ASP C . 50707 1 1476 . 1 . 1 355 355 ASP CA C 13 52.900 0.000 . 1 . . . . . 353 ASP CA . 50707 1 1477 . 1 . 1 355 355 ASP CB C 13 40.134 0.000 . 1 . . . . . 353 ASP CB . 50707 1 1478 . 1 . 1 355 355 ASP N N 15 126.787 0.000 . 1 . . . . . 353 ASP N . 50707 1 1479 . 1 . 1 356 356 LEU H H 1 9.197 0.000 . 1 . . . . . 354 LEU H . 50707 1 1480 . 1 . 1 356 356 LEU C C 13 177.575 0.000 . 1 . . . . . 354 LEU C . 50707 1 1481 . 1 . 1 356 356 LEU CA C 13 56.798 0.000 . 1 . . . . . 354 LEU CA . 50707 1 1482 . 1 . 1 356 356 LEU CB C 13 42.919 0.000 . 1 . . . . . 354 LEU CB . 50707 1 1483 . 1 . 1 356 356 LEU N N 15 131.588 0.000 . 1 . . . . . 354 LEU N . 50707 1 1484 . 1 . 1 357 357 PHE H H 1 8.862 0.000 . 1 . . . . . 355 PHE H . 50707 1 1485 . 1 . 1 357 357 PHE C C 13 175.525 0.000 . 1 . . . . . 355 PHE C . 50707 1 1486 . 1 . 1 357 357 PHE CA C 13 56.797 0.000 . 1 . . . . . 355 PHE CA . 50707 1 1487 . 1 . 1 357 357 PHE CB C 13 37.549 0.000 . 1 . . . . . 355 PHE CB . 50707 1 1488 . 1 . 1 357 357 PHE N N 15 115.756 0.000 . 1 . . . . . 355 PHE N . 50707 1 1489 . 1 . 1 358 358 GLU H H 1 7.046 0.000 . 1 . . . . . 356 GLU H . 50707 1 1490 . 1 . 1 358 358 GLU C C 13 176.977 0.000 . 1 . . . . . 356 GLU C . 50707 1 1491 . 1 . 1 358 358 GLU CA C 13 58.587 0.000 . 1 . . . . . 356 GLU CA . 50707 1 1492 . 1 . 1 358 358 GLU CB C 13 29.262 0.000 . 1 . . . . . 356 GLU CB . 50707 1 1493 . 1 . 1 358 358 GLU N N 15 121.608 0.000 . 1 . . . . . 356 GLU N . 50707 1 1494 . 1 . 1 359 359 LYS H H 1 8.385 0.000 . 1 . . . . . 357 LYS H . 50707 1 1495 . 1 . 1 359 359 LYS C C 13 176.144 0.000 . 1 . . . . . 357 LYS C . 50707 1 1496 . 1 . 1 359 359 LYS CA C 13 56.064 0.000 . 1 . . . . . 357 LYS CA . 50707 1 1497 . 1 . 1 359 359 LYS CB C 13 31.052 0.000 . 1 . . . . . 357 LYS CB . 50707 1 1498 . 1 . 1 359 359 LYS N N 15 117.178 0.000 . 1 . . . . . 357 LYS N . 50707 1 1499 . 1 . 1 360 360 MET H H 1 7.633 0.000 . 1 . . . . . 358 MET H . 50707 1 1500 . 1 . 1 360 360 MET C C 13 174.772 0.000 . 1 . . . . . 358 MET C . 50707 1 1501 . 1 . 1 360 360 MET CA C 13 55.820 0.000 . 1 . . . . . 358 MET CA . 50707 1 1502 . 1 . 1 360 360 MET CB C 13 32.444 0.000 . 1 . . . . . 358 MET CB . 50707 1 1503 . 1 . 1 360 360 MET N N 15 123.121 0.000 . 1 . . . . . 358 MET N . 50707 1 1504 . 1 . 1 361 361 VAL H H 1 7.510 0.000 . 1 . . . . . 359 VAL H . 50707 1 1505 . 1 . 1 361 361 VAL C C 13 180.674 0.000 . 1 . . . . . 359 VAL C . 50707 1 1506 . 1 . 1 361 361 VAL CA C 13 63.075 0.000 . 1 . . . . . 359 VAL CA . 50707 1 1507 . 1 . 1 361 361 VAL CB C 13 32.275 0.000 . 1 . . . . . 359 VAL CB . 50707 1 1508 . 1 . 1 361 361 VAL N N 15 128.235 0.000 . 1 . . . . . 359 VAL N . 50707 1 stop_ save_