data_50277 ####################### # Entry information # ####################### save_entry_information_1 _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information_1 _Entry.ID 50277 _Entry.Title ; Backbone assignments of Ca 2+ /calmodulin-dependent protein kinase 1D ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2020-05-16 _Entry.Accession_date 2020-05-16 _Entry.Last_release_date 2020-05-18 _Entry.Original_release_date 2020-05-18 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.14.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details 'Backbone assignments of Ca 2+ /calmodulin-dependent protein kinase 1D' _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 Michael Tong . . . . 50277 2 Mark Jeeves . . . . 50277 3 Sundaresan Rajesh . . . . 50277 4 Christian Ludwig . . . . 50277 5 Marc Lenoir . . . . 50277 6 Jitendra Kumar . . . . 50277 7 Darren McClelland . M. . . 50277 8 Fedor Berditchevski . . . . 50277 9 Julia Hubbard . A. . . 50277 10 Colin Kenyon . . . . 50277 11 Sam Butterworth . . . . 50277 12 Stefan Knapp . . . . 50277 13 Michael Overduin . . . . 50277 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . 'Structural Genomics Consortium' . 50277 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 50277 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 823 50277 '15N chemical shifts' 254 50277 '1H chemical shifts' 254 50277 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 2 . . 2021-06-23 2020-05-16 update BMRB 'update entry citation' 50277 1 . . 2020-08-25 2020-05-16 original author 'original release' 50277 stop_ save_ ############### # Citations # ############### save_citations_1 _Citation.Sf_category citations _Citation.Sf_framecode citations_1 _Citation.Entry_ID 50277 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 32535836 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; Backbone resonance assignments of the catalytic and regulatory domains of Ca 2+/calmodulin-dependent protein kinase 1D ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assignments' _Citation.Journal_name_full . _Citation.Journal_volume 14 _Citation.Journal_issue 2 _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 221 _Citation.Page_last 225 _Citation.Year 2020 _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 Michael Tong . . . . 50277 1 2 Mark Jeeves . . . . 50277 1 3 Sundaresan Rajesh . . . . 50277 1 4 Christian Ludwig . . . . 50277 1 5 Marc Lenoir . . . . 50277 1 6 Jitendra Kumar . . . . 50277 1 7 Darren McClelland . M. . . 50277 1 8 Fedor Berditchevski . . . . 50277 1 9 Julia Hubbard . A. . . 50277 1 10 Colin Kenyon . . . . 50277 1 11 Sam Butterworth . . . . 50277 1 12 Stefan Knapp . . . . 50277 1 13 Michael Overduin . . . . 50277 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'Protein resonance assignment, NMR, calcium/calmodulin dependent protein kinase, CaMK1D, CKLiK' 50277 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly_1 _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly_1 _Assembly.Entry_ID 50277 _Assembly.ID 1 _Assembly.Name 'Monomeric Ca 2+ /calmodulin-dependent protein kinase type 1D' _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 37837.11 _Assembly.Enzyme_commission_number . _Assembly.Details monomer _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 entity_1 1 $entity_1 . . yes native no no . . . 50277 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 50277 _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 ; SMARENGESSSSWKKQAEDI KKIFEFKETLGTGAFSEVVL AEEKATGKLFAVKCIPKKAL KGKESSIENEIAVLRKIKHE NIVALEDIYESPNHLYLVMQ LVSGGELFDRIVEKGFYTEK DASTLIRQVLDAVYYLHRMG IVHRDLKPENLLYYSQDEES KIMISDFGLSKMEGKGDVMS TACGTPGYVAPEVLAQKPYS KAVDCWSIGVIAYILLCGYP PFYDENDSKLFEQILKAEYE FDSPYWDDISDSAKDFIRNL MEKDPNKRYTCEQAARHPWI AGDTALNKNIHESVSAQIRK NFAKSKWRQAFNATAVVRHM RKLHLGSSLDSSNA ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq 0-333 _Entity.Polymer_author_seq_details 'sequence starts at Met' _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 334 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state unknown _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number 2.7.11.17 _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 yes UNP Q8IU85 . 'Calcium/calmodulin-dependent protein kinase type 1D' . . . . . . . . . . . . . . 50277 1 stop_ loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID ; Calcium/calmodulin-dependent protein kinase that operates in the calcium-triggered CaMKK-CaMK1 signaling cascade and, upon calcium influx, activates CREB-dependent gene transcription, regulates calcium-mediated granulocyte function and respiratory burst and promotes basal dendritic growth of hippocampal neurons. In neutrophil cells, required for cytokine-induced proliferative responses and activation of the respiratory burst. Activates the transcription factor CREB1 in hippocampal neuron nuclei. May play a role in apoptosis of erythroleukemia cells. ; 50277 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 0 SER . 50277 1 2 1 MET . 50277 1 3 2 ALA . 50277 1 4 3 ARG . 50277 1 5 4 GLU . 50277 1 6 5 ASN . 50277 1 7 6 GLY . 50277 1 8 7 GLU . 50277 1 9 8 SER . 50277 1 10 9 SER . 50277 1 11 10 SER . 50277 1 12 11 SER . 50277 1 13 12 TRP . 50277 1 14 13 LYS . 50277 1 15 14 LYS . 50277 1 16 15 GLN . 50277 1 17 16 ALA . 50277 1 18 17 GLU . 50277 1 19 18 ASP . 50277 1 20 19 ILE . 50277 1 21 20 LYS . 50277 1 22 21 LYS . 50277 1 23 22 ILE . 50277 1 24 23 PHE . 50277 1 25 24 GLU . 50277 1 26 25 PHE . 50277 1 27 26 LYS . 50277 1 28 27 GLU . 50277 1 29 28 THR . 50277 1 30 29 LEU . 50277 1 31 30 GLY . 50277 1 32 31 THR . 50277 1 33 32 GLY . 50277 1 34 33 ALA . 50277 1 35 34 PHE . 50277 1 36 35 SER . 50277 1 37 36 GLU . 50277 1 38 37 VAL . 50277 1 39 38 VAL . 50277 1 40 39 LEU . 50277 1 41 40 ALA . 50277 1 42 41 GLU . 50277 1 43 42 GLU . 50277 1 44 43 LYS . 50277 1 45 44 ALA . 50277 1 46 45 THR . 50277 1 47 46 GLY . 50277 1 48 47 LYS . 50277 1 49 48 LEU . 50277 1 50 49 PHE . 50277 1 51 50 ALA . 50277 1 52 51 VAL . 50277 1 53 52 LYS . 50277 1 54 53 CYS . 50277 1 55 54 ILE . 50277 1 56 55 PRO . 50277 1 57 56 LYS . 50277 1 58 57 LYS . 50277 1 59 58 ALA . 50277 1 60 59 LEU . 50277 1 61 60 LYS . 50277 1 62 61 GLY . 50277 1 63 62 LYS . 50277 1 64 63 GLU . 50277 1 65 64 SER . 50277 1 66 65 SER . 50277 1 67 66 ILE . 50277 1 68 67 GLU . 50277 1 69 68 ASN . 50277 1 70 69 GLU . 50277 1 71 70 ILE . 50277 1 72 71 ALA . 50277 1 73 72 VAL . 50277 1 74 73 LEU . 50277 1 75 74 ARG . 50277 1 76 75 LYS . 50277 1 77 76 ILE . 50277 1 78 77 LYS . 50277 1 79 78 HIS . 50277 1 80 79 GLU . 50277 1 81 80 ASN . 50277 1 82 81 ILE . 50277 1 83 82 VAL . 50277 1 84 83 ALA . 50277 1 85 84 LEU . 50277 1 86 85 GLU . 50277 1 87 86 ASP . 50277 1 88 87 ILE . 50277 1 89 88 TYR . 50277 1 90 89 GLU . 50277 1 91 90 SER . 50277 1 92 91 PRO . 50277 1 93 92 ASN . 50277 1 94 93 HIS . 50277 1 95 94 LEU . 50277 1 96 95 TYR . 50277 1 97 96 LEU . 50277 1 98 97 VAL . 50277 1 99 98 MET . 50277 1 100 99 GLN . 50277 1 101 100 LEU . 50277 1 102 101 VAL . 50277 1 103 102 SER . 50277 1 104 103 GLY . 50277 1 105 104 GLY . 50277 1 106 105 GLU . 50277 1 107 106 LEU . 50277 1 108 107 PHE . 50277 1 109 108 ASP . 50277 1 110 109 ARG . 50277 1 111 110 ILE . 50277 1 112 111 VAL . 50277 1 113 112 GLU . 50277 1 114 113 LYS . 50277 1 115 114 GLY . 50277 1 116 115 PHE . 50277 1 117 116 TYR . 50277 1 118 117 THR . 50277 1 119 118 GLU . 50277 1 120 119 LYS . 50277 1 121 120 ASP . 50277 1 122 121 ALA . 50277 1 123 122 SER . 50277 1 124 123 THR . 50277 1 125 124 LEU . 50277 1 126 125 ILE . 50277 1 127 126 ARG . 50277 1 128 127 GLN . 50277 1 129 128 VAL . 50277 1 130 129 LEU . 50277 1 131 130 ASP . 50277 1 132 131 ALA . 50277 1 133 132 VAL . 50277 1 134 133 TYR . 50277 1 135 134 TYR . 50277 1 136 135 LEU . 50277 1 137 136 HIS . 50277 1 138 137 ARG . 50277 1 139 138 MET . 50277 1 140 139 GLY . 50277 1 141 140 ILE . 50277 1 142 141 VAL . 50277 1 143 142 HIS . 50277 1 144 143 ARG . 50277 1 145 144 ASP . 50277 1 146 145 LEU . 50277 1 147 146 LYS . 50277 1 148 147 PRO . 50277 1 149 148 GLU . 50277 1 150 149 ASN . 50277 1 151 150 LEU . 50277 1 152 151 LEU . 50277 1 153 152 TYR . 50277 1 154 153 TYR . 50277 1 155 154 SER . 50277 1 156 155 GLN . 50277 1 157 156 ASP . 50277 1 158 157 GLU . 50277 1 159 158 GLU . 50277 1 160 159 SER . 50277 1 161 160 LYS . 50277 1 162 161 ILE . 50277 1 163 162 MET . 50277 1 164 163 ILE . 50277 1 165 164 SER . 50277 1 166 165 ASP . 50277 1 167 166 PHE . 50277 1 168 167 GLY . 50277 1 169 168 LEU . 50277 1 170 169 SER . 50277 1 171 170 LYS . 50277 1 172 171 MET . 50277 1 173 172 GLU . 50277 1 174 173 GLY . 50277 1 175 174 LYS . 50277 1 176 175 GLY . 50277 1 177 176 ASP . 50277 1 178 177 VAL . 50277 1 179 178 MET . 50277 1 180 179 SER . 50277 1 181 180 THR . 50277 1 182 181 ALA . 50277 1 183 182 CYS . 50277 1 184 183 GLY . 50277 1 185 184 THR . 50277 1 186 185 PRO . 50277 1 187 186 GLY . 50277 1 188 187 TYR . 50277 1 189 188 VAL . 50277 1 190 189 ALA . 50277 1 191 190 PRO . 50277 1 192 191 GLU . 50277 1 193 192 VAL . 50277 1 194 193 LEU . 50277 1 195 194 ALA . 50277 1 196 195 GLN . 50277 1 197 196 LYS . 50277 1 198 197 PRO . 50277 1 199 198 TYR . 50277 1 200 199 SER . 50277 1 201 200 LYS . 50277 1 202 201 ALA . 50277 1 203 202 VAL . 50277 1 204 203 ASP . 50277 1 205 204 CYS . 50277 1 206 205 TRP . 50277 1 207 206 SER . 50277 1 208 207 ILE . 50277 1 209 208 GLY . 50277 1 210 209 VAL . 50277 1 211 210 ILE . 50277 1 212 211 ALA . 50277 1 213 212 TYR . 50277 1 214 213 ILE . 50277 1 215 214 LEU . 50277 1 216 215 LEU . 50277 1 217 216 CYS . 50277 1 218 217 GLY . 50277 1 219 218 TYR . 50277 1 220 219 PRO . 50277 1 221 220 PRO . 50277 1 222 221 PHE . 50277 1 223 222 TYR . 50277 1 224 223 ASP . 50277 1 225 224 GLU . 50277 1 226 225 ASN . 50277 1 227 226 ASP . 50277 1 228 227 SER . 50277 1 229 228 LYS . 50277 1 230 229 LEU . 50277 1 231 230 PHE . 50277 1 232 231 GLU . 50277 1 233 232 GLN . 50277 1 234 233 ILE . 50277 1 235 234 LEU . 50277 1 236 235 LYS . 50277 1 237 236 ALA . 50277 1 238 237 GLU . 50277 1 239 238 TYR . 50277 1 240 239 GLU . 50277 1 241 240 PHE . 50277 1 242 241 ASP . 50277 1 243 242 SER . 50277 1 244 243 PRO . 50277 1 245 244 TYR . 50277 1 246 245 TRP . 50277 1 247 246 ASP . 50277 1 248 247 ASP . 50277 1 249 248 ILE . 50277 1 250 249 SER . 50277 1 251 250 ASP . 50277 1 252 251 SER . 50277 1 253 252 ALA . 50277 1 254 253 LYS . 50277 1 255 254 ASP . 50277 1 256 255 PHE . 50277 1 257 256 ILE . 50277 1 258 257 ARG . 50277 1 259 258 ASN . 50277 1 260 259 LEU . 50277 1 261 260 MET . 50277 1 262 261 GLU . 50277 1 263 262 LYS . 50277 1 264 263 ASP . 50277 1 265 264 PRO . 50277 1 266 265 ASN . 50277 1 267 266 LYS . 50277 1 268 267 ARG . 50277 1 269 268 TYR . 50277 1 270 269 THR . 50277 1 271 270 CYS . 50277 1 272 271 GLU . 50277 1 273 272 GLN . 50277 1 274 273 ALA . 50277 1 275 274 ALA . 50277 1 276 275 ARG . 50277 1 277 276 HIS . 50277 1 278 277 PRO . 50277 1 279 278 TRP . 50277 1 280 279 ILE . 50277 1 281 280 ALA . 50277 1 282 281 GLY . 50277 1 283 282 ASP . 50277 1 284 283 THR . 50277 1 285 284 ALA . 50277 1 286 285 LEU . 50277 1 287 286 ASN . 50277 1 288 287 LYS . 50277 1 289 288 ASN . 50277 1 290 289 ILE . 50277 1 291 290 HIS . 50277 1 292 291 GLU . 50277 1 293 292 SER . 50277 1 294 293 VAL . 50277 1 295 294 SER . 50277 1 296 295 ALA . 50277 1 297 296 GLN . 50277 1 298 297 ILE . 50277 1 299 298 ARG . 50277 1 300 299 LYS . 50277 1 301 300 ASN . 50277 1 302 301 PHE . 50277 1 303 302 ALA . 50277 1 304 303 LYS . 50277 1 305 304 SER . 50277 1 306 305 LYS . 50277 1 307 306 TRP . 50277 1 308 307 ARG . 50277 1 309 308 GLN . 50277 1 310 309 ALA . 50277 1 311 310 PHE . 50277 1 312 311 ASN . 50277 1 313 312 ALA . 50277 1 314 313 THR . 50277 1 315 314 ALA . 50277 1 316 315 VAL . 50277 1 317 316 VAL . 50277 1 318 317 ARG . 50277 1 319 318 HIS . 50277 1 320 319 MET . 50277 1 321 320 ARG . 50277 1 322 321 LYS . 50277 1 323 322 LEU . 50277 1 324 323 HIS . 50277 1 325 324 LEU . 50277 1 326 325 GLY . 50277 1 327 326 SER . 50277 1 328 327 SER . 50277 1 329 328 LEU . 50277 1 330 329 ASP . 50277 1 331 330 SER . 50277 1 332 331 SER . 50277 1 333 332 ASN . 50277 1 334 333 ALA . 50277 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 . SER 1 1 50277 1 . MET 2 2 50277 1 . ALA 3 3 50277 1 . ARG 4 4 50277 1 . GLU 5 5 50277 1 . ASN 6 6 50277 1 . GLY 7 7 50277 1 . GLU 8 8 50277 1 . SER 9 9 50277 1 . SER 10 10 50277 1 . SER 11 11 50277 1 . SER 12 12 50277 1 . TRP 13 13 50277 1 . LYS 14 14 50277 1 . LYS 15 15 50277 1 . GLN 16 16 50277 1 . ALA 17 17 50277 1 . GLU 18 18 50277 1 . ASP 19 19 50277 1 . ILE 20 20 50277 1 . LYS 21 21 50277 1 . LYS 22 22 50277 1 . ILE 23 23 50277 1 . PHE 24 24 50277 1 . GLU 25 25 50277 1 . PHE 26 26 50277 1 . LYS 27 27 50277 1 . GLU 28 28 50277 1 . THR 29 29 50277 1 . LEU 30 30 50277 1 . GLY 31 31 50277 1 . THR 32 32 50277 1 . GLY 33 33 50277 1 . ALA 34 34 50277 1 . PHE 35 35 50277 1 . SER 36 36 50277 1 . GLU 37 37 50277 1 . VAL 38 38 50277 1 . VAL 39 39 50277 1 . LEU 40 40 50277 1 . ALA 41 41 50277 1 . GLU 42 42 50277 1 . GLU 43 43 50277 1 . LYS 44 44 50277 1 . ALA 45 45 50277 1 . THR 46 46 50277 1 . GLY 47 47 50277 1 . LYS 48 48 50277 1 . LEU 49 49 50277 1 . PHE 50 50 50277 1 . ALA 51 51 50277 1 . VAL 52 52 50277 1 . LYS 53 53 50277 1 . CYS 54 54 50277 1 . ILE 55 55 50277 1 . PRO 56 56 50277 1 . LYS 57 57 50277 1 . LYS 58 58 50277 1 . ALA 59 59 50277 1 . LEU 60 60 50277 1 . LYS 61 61 50277 1 . GLY 62 62 50277 1 . LYS 63 63 50277 1 . GLU 64 64 50277 1 . SER 65 65 50277 1 . SER 66 66 50277 1 . ILE 67 67 50277 1 . GLU 68 68 50277 1 . ASN 69 69 50277 1 . GLU 70 70 50277 1 . ILE 71 71 50277 1 . ALA 72 72 50277 1 . VAL 73 73 50277 1 . LEU 74 74 50277 1 . ARG 75 75 50277 1 . LYS 76 76 50277 1 . ILE 77 77 50277 1 . LYS 78 78 50277 1 . HIS 79 79 50277 1 . GLU 80 80 50277 1 . ASN 81 81 50277 1 . ILE 82 82 50277 1 . VAL 83 83 50277 1 . ALA 84 84 50277 1 . LEU 85 85 50277 1 . GLU 86 86 50277 1 . ASP 87 87 50277 1 . ILE 88 88 50277 1 . TYR 89 89 50277 1 . GLU 90 90 50277 1 . SER 91 91 50277 1 . PRO 92 92 50277 1 . ASN 93 93 50277 1 . HIS 94 94 50277 1 . LEU 95 95 50277 1 . TYR 96 96 50277 1 . LEU 97 97 50277 1 . VAL 98 98 50277 1 . MET 99 99 50277 1 . GLN 100 100 50277 1 . LEU 101 101 50277 1 . VAL 102 102 50277 1 . SER 103 103 50277 1 . GLY 104 104 50277 1 . GLY 105 105 50277 1 . GLU 106 106 50277 1 . LEU 107 107 50277 1 . PHE 108 108 50277 1 . ASP 109 109 50277 1 . ARG 110 110 50277 1 . ILE 111 111 50277 1 . VAL 112 112 50277 1 . GLU 113 113 50277 1 . LYS 114 114 50277 1 . GLY 115 115 50277 1 . PHE 116 116 50277 1 . TYR 117 117 50277 1 . THR 118 118 50277 1 . GLU 119 119 50277 1 . LYS 120 120 50277 1 . ASP 121 121 50277 1 . ALA 122 122 50277 1 . SER 123 123 50277 1 . THR 124 124 50277 1 . LEU 125 125 50277 1 . ILE 126 126 50277 1 . ARG 127 127 50277 1 . GLN 128 128 50277 1 . VAL 129 129 50277 1 . LEU 130 130 50277 1 . ASP 131 131 50277 1 . ALA 132 132 50277 1 . VAL 133 133 50277 1 . TYR 134 134 50277 1 . TYR 135 135 50277 1 . LEU 136 136 50277 1 . HIS 137 137 50277 1 . ARG 138 138 50277 1 . MET 139 139 50277 1 . GLY 140 140 50277 1 . ILE 141 141 50277 1 . VAL 142 142 50277 1 . HIS 143 143 50277 1 . ARG 144 144 50277 1 . ASP 145 145 50277 1 . LEU 146 146 50277 1 . LYS 147 147 50277 1 . PRO 148 148 50277 1 . GLU 149 149 50277 1 . ASN 150 150 50277 1 . LEU 151 151 50277 1 . LEU 152 152 50277 1 . TYR 153 153 50277 1 . TYR 154 154 50277 1 . SER 155 155 50277 1 . GLN 156 156 50277 1 . ASP 157 157 50277 1 . GLU 158 158 50277 1 . GLU 159 159 50277 1 . SER 160 160 50277 1 . LYS 161 161 50277 1 . ILE 162 162 50277 1 . MET 163 163 50277 1 . ILE 164 164 50277 1 . SER 165 165 50277 1 . ASP 166 166 50277 1 . PHE 167 167 50277 1 . GLY 168 168 50277 1 . LEU 169 169 50277 1 . SER 170 170 50277 1 . LYS 171 171 50277 1 . MET 172 172 50277 1 . GLU 173 173 50277 1 . GLY 174 174 50277 1 . LYS 175 175 50277 1 . GLY 176 176 50277 1 . ASP 177 177 50277 1 . VAL 178 178 50277 1 . MET 179 179 50277 1 . SER 180 180 50277 1 . THR 181 181 50277 1 . ALA 182 182 50277 1 . CYS 183 183 50277 1 . GLY 184 184 50277 1 . THR 185 185 50277 1 . PRO 186 186 50277 1 . GLY 187 187 50277 1 . TYR 188 188 50277 1 . VAL 189 189 50277 1 . ALA 190 190 50277 1 . PRO 191 191 50277 1 . GLU 192 192 50277 1 . VAL 193 193 50277 1 . LEU 194 194 50277 1 . ALA 195 195 50277 1 . GLN 196 196 50277 1 . LYS 197 197 50277 1 . PRO 198 198 50277 1 . TYR 199 199 50277 1 . SER 200 200 50277 1 . LYS 201 201 50277 1 . ALA 202 202 50277 1 . VAL 203 203 50277 1 . ASP 204 204 50277 1 . CYS 205 205 50277 1 . TRP 206 206 50277 1 . SER 207 207 50277 1 . ILE 208 208 50277 1 . GLY 209 209 50277 1 . VAL 210 210 50277 1 . ILE 211 211 50277 1 . ALA 212 212 50277 1 . TYR 213 213 50277 1 . ILE 214 214 50277 1 . LEU 215 215 50277 1 . LEU 216 216 50277 1 . CYS 217 217 50277 1 . GLY 218 218 50277 1 . TYR 219 219 50277 1 . PRO 220 220 50277 1 . PRO 221 221 50277 1 . PHE 222 222 50277 1 . TYR 223 223 50277 1 . ASP 224 224 50277 1 . GLU 225 225 50277 1 . ASN 226 226 50277 1 . ASP 227 227 50277 1 . SER 228 228 50277 1 . LYS 229 229 50277 1 . LEU 230 230 50277 1 . PHE 231 231 50277 1 . GLU 232 232 50277 1 . GLN 233 233 50277 1 . ILE 234 234 50277 1 . LEU 235 235 50277 1 . LYS 236 236 50277 1 . ALA 237 237 50277 1 . GLU 238 238 50277 1 . TYR 239 239 50277 1 . GLU 240 240 50277 1 . PHE 241 241 50277 1 . ASP 242 242 50277 1 . SER 243 243 50277 1 . PRO 244 244 50277 1 . TYR 245 245 50277 1 . TRP 246 246 50277 1 . ASP 247 247 50277 1 . ASP 248 248 50277 1 . ILE 249 249 50277 1 . SER 250 250 50277 1 . ASP 251 251 50277 1 . SER 252 252 50277 1 . ALA 253 253 50277 1 . LYS 254 254 50277 1 . ASP 255 255 50277 1 . PHE 256 256 50277 1 . ILE 257 257 50277 1 . ARG 258 258 50277 1 . ASN 259 259 50277 1 . LEU 260 260 50277 1 . MET 261 261 50277 1 . GLU 262 262 50277 1 . LYS 263 263 50277 1 . ASP 264 264 50277 1 . PRO 265 265 50277 1 . ASN 266 266 50277 1 . LYS 267 267 50277 1 . ARG 268 268 50277 1 . TYR 269 269 50277 1 . THR 270 270 50277 1 . CYS 271 271 50277 1 . GLU 272 272 50277 1 . GLN 273 273 50277 1 . ALA 274 274 50277 1 . ALA 275 275 50277 1 . ARG 276 276 50277 1 . HIS 277 277 50277 1 . PRO 278 278 50277 1 . TRP 279 279 50277 1 . ILE 280 280 50277 1 . ALA 281 281 50277 1 . GLY 282 282 50277 1 . ASP 283 283 50277 1 . THR 284 284 50277 1 . ALA 285 285 50277 1 . LEU 286 286 50277 1 . ASN 287 287 50277 1 . LYS 288 288 50277 1 . ASN 289 289 50277 1 . ILE 290 290 50277 1 . HIS 291 291 50277 1 . GLU 292 292 50277 1 . SER 293 293 50277 1 . VAL 294 294 50277 1 . SER 295 295 50277 1 . ALA 296 296 50277 1 . GLN 297 297 50277 1 . ILE 298 298 50277 1 . ARG 299 299 50277 1 . LYS 300 300 50277 1 . ASN 301 301 50277 1 . PHE 302 302 50277 1 . ALA 303 303 50277 1 . LYS 304 304 50277 1 . SER 305 305 50277 1 . LYS 306 306 50277 1 . TRP 307 307 50277 1 . ARG 308 308 50277 1 . GLN 309 309 50277 1 . ALA 310 310 50277 1 . PHE 311 311 50277 1 . ASN 312 312 50277 1 . ALA 313 313 50277 1 . THR 314 314 50277 1 . ALA 315 315 50277 1 . VAL 316 316 50277 1 . VAL 317 317 50277 1 . ARG 318 318 50277 1 . HIS 319 319 50277 1 . MET 320 320 50277 1 . ARG 321 321 50277 1 . LYS 322 322 50277 1 . LEU 323 323 50277 1 . HIS 324 324 50277 1 . LEU 325 325 50277 1 . GLY 326 326 50277 1 . SER 327 327 50277 1 . SER 328 328 50277 1 . LEU 329 329 50277 1 . ASP 330 330 50277 1 . SER 331 331 50277 1 . SER 332 332 50277 1 . ASN 333 333 50277 1 . ALA 334 334 50277 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 50277 _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 . . . . . . . . . . . . . 50277 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 50277 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli 'BL21 (DE2), Rosetta (DE3)' . . plasmid . . pNIC28-Bsa4 . . . 50277 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 50277 _Sample.ID 1 _Sample.Name 'Ca 2+ /calmodulin-dependent protein kinase 1D' _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 'human calmodulin-dependent protein kinase 1D (CAMK1D)' '[U-100% 13C; U-100% 15N]' . . 1 $entity_1 . . 1.2 . . mM . . . . 50277 1 2 'sodium phosphate' 'natural abundance' . . . . . . 50 . . mM . . . . 50277 1 3 'sodium chloride' 'natural abundance' . . . . . . 75 . . mM . . . . 50277 1 4 TCEP 'natural abundance' . . . . . . 0.5 . . mM . . . . 50277 1 5 'sodium azide' 'natural abundance' . . . . . . 0.02 . . % . . . . 50277 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 50277 _Sample.ID 2 _Sample.Name 'Ca 2+ /calmodulin-dependent protein kinase 1D' _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 'human calmodulin-dependent protein kinase 1D (CAMK1D)' '[U-13C; U-15N; U-2H]' . . 1 $entity_1 . . 1.2 . . mM . . . . 50277 2 2 'sodium phosphate' 'natural abundance' . . . . . . 50 . . mM . . . . 50277 2 3 'sodium chloride' 'natural abundance' . . . . . . 75 . . mM . . . . 50277 2 4 TCEP 'natural abundance' . . . . . . 0.5 . . mM . . . . 50277 2 5 'sodium azide' 'natural abundance' . . . . . . 0.02 . . % . . . . 50277 2 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 50277 _Sample_condition_list.ID 1 _Sample_condition_list.Name 'condition 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' 125 . mM 50277 1 pH 7.0 . pH 50277 1 pressure 1 . atm 50277 1 temperature 298 . K 50277 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 50277 _Software.ID 1 _Software.Type . _Software.Name NMRPipe _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID processing . 50277 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 50277 _Software.ID 2 _Software.Type . _Software.Name 'CcpNmr Analysis' _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 50277 2 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 50277 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name '800 MHz' _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _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 50277 _NMR_spectrometer.ID 2 _NMR_spectrometer.Name '900 MHz' _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 900 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 50277 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NUS_flag _Experiment.Interleaved_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Details _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50277 1 2 '3D CBCA(CO)NH' no . . . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50277 1 3 '3D HNCO' no . . . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50277 1 4 '3D HNCA' no . . . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50277 1 5 '3D HNCACB' no . . . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50277 1 6 '3D HN(CO)CA' no . . . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50277 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 50277 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name 'internal DSS' _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 external indirect 0.251449530 . . . . . 50277 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . 50277 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 external indirect 0.101329118 . . . . . 50277 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 50277 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name Backbone_Assignments _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 50277 1 2 '3D CBCA(CO)NH' . . . 50277 1 3 '3D HNCO' . . . 50277 1 4 '3D HNCA' . . . 50277 1 5 '3D HNCACB' . . . 50277 1 6 '3D HN(CO)CA' . . . 50277 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 2 $software_2 . . 50277 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 2 2 MET C C 13 175.779 0.3 . 1 . . . . . 1 MET C . 50277 1 2 . 1 . 1 2 2 MET CA C 13 55.139 0.3 . 1 . . . . . 1 MET CA . 50277 1 3 . 1 . 1 2 2 MET CB C 13 32.266 0.3 . 1 . . . . . 1 MET CB . 50277 1 4 . 1 . 1 3 3 ALA H H 1 8.354 0.020 . 1 . . . . . 2 ALA H . 50277 1 5 . 1 . 1 3 3 ALA C C 13 177.349 0.3 . 1 . . . . . 2 ALA C . 50277 1 6 . 1 . 1 3 3 ALA CA C 13 52.042 0.3 . 1 . . . . . 2 ALA CA . 50277 1 7 . 1 . 1 3 3 ALA CB C 13 18.480 0.3 . 1 . . . . . 2 ALA CB . 50277 1 8 . 1 . 1 3 3 ALA N N 15 126.137 0.3 . 1 . . . . . 2 ALA N . 50277 1 9 . 1 . 1 4 4 ARG H H 1 8.232 0.020 . 1 . . . . . 3 ARG H . 50277 1 10 . 1 . 1 4 4 ARG C C 13 176.064 0.3 . 1 . . . . . 3 ARG C . 50277 1 11 . 1 . 1 4 4 ARG CA C 13 55.406 0.3 . 1 . . . . . 3 ARG CA . 50277 1 12 . 1 . 1 4 4 ARG CB C 13 30.176 0.3 . 1 . . . . . 3 ARG CB . 50277 1 13 . 1 . 1 4 4 ARG N N 15 120.940 0.3 . 1 . . . . . 3 ARG N . 50277 1 14 . 1 . 1 5 5 GLU H H 1 8.407 0.020 . 1 . . . . . 4 GLU H . 50277 1 15 . 1 . 1 5 5 GLU C C 13 175.329 0.3 . 1 . . . . . 4 GLU C . 50277 1 16 . 1 . 1 5 5 GLU CA C 13 55.974 0.3 . 1 . . . . . 4 GLU CA . 50277 1 17 . 1 . 1 5 5 GLU CB C 13 29.820 0.3 . 1 . . . . . 4 GLU CB . 50277 1 18 . 1 . 1 5 5 GLU N N 15 122.895 0.3 . 1 . . . . . 4 GLU N . 50277 1 19 . 1 . 1 6 6 ASN H H 1 8.003 0.020 . 1 . . . . . 5 ASN H . 50277 1 20 . 1 . 1 6 6 ASN C C 13 179.348 0.3 . 1 . . . . . 5 ASN C . 50277 1 21 . 1 . 1 6 6 ASN CA C 13 54.457 0.3 . 1 . . . . . 5 ASN CA . 50277 1 22 . 1 . 1 6 6 ASN CB C 13 40.284 0.3 . 1 . . . . . 5 ASN CB . 50277 1 23 . 1 . 1 6 6 ASN N N 15 124.987 0.3 . 1 . . . . . 5 ASN N . 50277 1 24 . 1 . 1 7 7 GLY C C 13 174.627 0.3 . 1 . . . . . 6 GLY C . 50277 1 25 . 1 . 1 8 8 GLU H H 1 8.435 0.020 . 1 . . . . . 7 GLU H . 50277 1 26 . 1 . 1 8 8 GLU C C 13 176.969 0.3 . 1 . . . . . 7 GLU C . 50277 1 27 . 1 . 1 8 8 GLU CA C 13 56.194 0.3 . 1 . . . . . 7 GLU CA . 50277 1 28 . 1 . 1 8 8 GLU CB C 13 29.489 0.3 . 1 . . . . . 7 GLU CB . 50277 1 29 . 1 . 1 8 8 GLU N N 15 121.165 0.3 . 1 . . . . . 7 GLU N . 50277 1 30 . 1 . 1 9 9 SER H H 1 8.387 0.020 . 1 . . . . . 8 SER H . 50277 1 31 . 1 . 1 9 9 SER C C 13 175.059 0.3 . 1 . . . . . 8 SER C . 50277 1 32 . 1 . 1 9 9 SER CA C 13 58.001 0.3 . 1 . . . . . 8 SER CA . 50277 1 33 . 1 . 1 9 9 SER CB C 13 63.411 0.3 . 1 . . . . . 8 SER CB . 50277 1 34 . 1 . 1 9 9 SER N N 15 117.251 0.3 . 1 . . . . . 8 SER N . 50277 1 35 . 1 . 1 10 10 SER CA C 13 58.413 0.3 . 1 . . . . . 9 SER CA . 50277 1 36 . 1 . 1 11 11 SER H H 1 8.199 0.020 . 1 . . . . . 10 SER H . 50277 1 37 . 1 . 1 11 11 SER C C 13 174.821 0.3 . 1 . . . . . 10 SER C . 50277 1 38 . 1 . 1 11 11 SER CA C 13 58.232 0.3 . 1 . . . . . 10 SER CA . 50277 1 39 . 1 . 1 11 11 SER CB C 13 63.034 0.3 . 1 . . . . . 10 SER CB . 50277 1 40 . 1 . 1 11 11 SER N N 15 117.563 0.3 . 1 . . . . . 10 SER N . 50277 1 41 . 1 . 1 12 12 SER H H 1 8.120 0.020 . 1 . . . . . 11 SER H . 50277 1 42 . 1 . 1 12 12 SER C C 13 174.428 0.3 . 1 . . . . . 11 SER C . 50277 1 43 . 1 . 1 12 12 SER CA C 13 58.488 0.3 . 1 . . . . . 11 SER CA . 50277 1 44 . 1 . 1 12 12 SER CB C 13 63.060 0.3 . 1 . . . . . 11 SER CB . 50277 1 45 . 1 . 1 12 12 SER N N 15 117.491 0.3 . 1 . . . . . 11 SER N . 50277 1 46 . 1 . 1 13 13 TRP H H 1 7.476 0.020 . 1 . . . . . 12 TRP H . 50277 1 47 . 1 . 1 13 13 TRP C C 13 175.387 0.3 . 1 . . . . . 12 TRP C . 50277 1 48 . 1 . 1 13 13 TRP CA C 13 56.037 0.3 . 1 . . . . . 12 TRP CA . 50277 1 49 . 1 . 1 13 13 TRP CB C 13 28.643 0.3 . 1 . . . . . 12 TRP CB . 50277 1 50 . 1 . 1 13 13 TRP N N 15 120.607 0.3 . 1 . . . . . 12 TRP N . 50277 1 51 . 1 . 1 14 14 LYS H H 1 7.349 0.020 . 1 . . . . . 13 LYS H . 50277 1 52 . 1 . 1 14 14 LYS C C 13 175.457 0.3 . 1 . . . . . 13 LYS C . 50277 1 53 . 1 . 1 14 14 LYS CA C 13 54.952 0.3 . 1 . . . . . 13 LYS CA . 50277 1 54 . 1 . 1 14 14 LYS CB C 13 32.153 0.3 . 1 . . . . . 13 LYS CB . 50277 1 55 . 1 . 1 14 14 LYS N N 15 121.091 0.3 . 1 . . . . . 13 LYS N . 50277 1 56 . 1 . 1 15 15 LYS H H 1 8.122 0.020 . 1 . . . . . 14 LYS H . 50277 1 57 . 1 . 1 15 15 LYS C C 13 175.958 0.3 . 1 . . . . . 14 LYS C . 50277 1 58 . 1 . 1 15 15 LYS CA C 13 55.932 0.3 . 1 . . . . . 14 LYS CA . 50277 1 59 . 1 . 1 15 15 LYS CB C 13 33.074 0.3 . 1 . . . . . 14 LYS CB . 50277 1 60 . 1 . 1 15 15 LYS N N 15 125.057 0.3 . 1 . . . . . 14 LYS N . 50277 1 61 . 1 . 1 16 16 GLN H H 1 8.516 0.020 . 1 . . . . . 15 GLN H . 50277 1 62 . 1 . 1 16 16 GLN C C 13 176.107 0.3 . 1 . . . . . 15 GLN C . 50277 1 63 . 1 . 1 16 16 GLN CA C 13 54.709 0.3 . 1 . . . . . 15 GLN CA . 50277 1 64 . 1 . 1 16 16 GLN CB C 13 29.030 0.3 . 1 . . . . . 15 GLN CB . 50277 1 65 . 1 . 1 16 16 GLN N N 15 121.575 0.3 . 1 . . . . . 15 GLN N . 50277 1 66 . 1 . 1 17 17 ALA H H 1 8.615 0.020 . 1 . . . . . 16 ALA H . 50277 1 67 . 1 . 1 17 17 ALA C C 13 175.622 0.3 . 1 . . . . . 16 ALA C . 50277 1 68 . 1 . 1 17 17 ALA CA C 13 50.663 0.3 . 1 . . . . . 16 ALA CA . 50277 1 69 . 1 . 1 17 17 ALA CB C 13 20.012 0.3 . 1 . . . . . 16 ALA CB . 50277 1 70 . 1 . 1 17 17 ALA N N 15 126.136 0.3 . 1 . . . . . 16 ALA N . 50277 1 71 . 1 . 1 18 18 GLU H H 1 8.493 0.020 . 1 . . . . . 17 GLU H . 50277 1 72 . 1 . 1 18 18 GLU C C 13 176.558 0.3 . 1 . . . . . 17 GLU C . 50277 1 73 . 1 . 1 18 18 GLU CA C 13 58.007 0.3 . 1 . . . . . 17 GLU CA . 50277 1 74 . 1 . 1 18 18 GLU CB C 13 29.134 0.3 . 1 . . . . . 17 GLU CB . 50277 1 75 . 1 . 1 18 18 GLU N N 15 122.678 0.3 . 1 . . . . . 17 GLU N . 50277 1 76 . 1 . 1 19 19 ASP H H 1 7.750 0.020 . 1 . . . . . 18 ASP H . 50277 1 77 . 1 . 1 19 19 ASP C C 13 177.837 0.3 . 1 . . . . . 18 ASP C . 50277 1 78 . 1 . 1 19 19 ASP CA C 13 52.745 0.3 . 1 . . . . . 18 ASP CA . 50277 1 79 . 1 . 1 19 19 ASP CB C 13 41.537 0.3 . 1 . . . . . 18 ASP CB . 50277 1 80 . 1 . 1 19 19 ASP N N 15 115.905 0.3 . 1 . . . . . 18 ASP N . 50277 1 81 . 1 . 1 20 20 ILE H H 1 9.256 0.020 . 1 . . . . . 19 ILE H . 50277 1 82 . 1 . 1 20 20 ILE C C 13 176.191 0.3 . 1 . . . . . 19 ILE C . 50277 1 83 . 1 . 1 20 20 ILE CA C 13 59.835 0.3 . 1 . . . . . 19 ILE CA . 50277 1 84 . 1 . 1 20 20 ILE CB C 13 38.303 0.3 . 1 . . . . . 19 ILE CB . 50277 1 85 . 1 . 1 20 20 ILE N N 15 129.928 0.3 . 1 . . . . . 19 ILE N . 50277 1 86 . 1 . 1 21 21 LYS H H 1 8.016 0.020 . 1 . . . . . 20 LYS H . 50277 1 87 . 1 . 1 21 21 LYS C C 13 177.579 0.3 . 1 . . . . . 20 LYS C . 50277 1 88 . 1 . 1 21 21 LYS CA C 13 56.827 0.3 . 1 . . . . . 20 LYS CA . 50277 1 89 . 1 . 1 21 21 LYS CB C 13 29.817 0.3 . 1 . . . . . 20 LYS CB . 50277 1 90 . 1 . 1 21 21 LYS N N 15 121.551 0.3 . 1 . . . . . 20 LYS N . 50277 1 91 . 1 . 1 22 22 LYS H H 1 7.404 0.020 . 1 . . . . . 21 LYS H . 50277 1 92 . 1 . 1 22 22 LYS C C 13 176.828 0.3 . 1 . . . . . 21 LYS C . 50277 1 93 . 1 . 1 22 22 LYS CA C 13 56.715 0.3 . 1 . . . . . 21 LYS CA . 50277 1 94 . 1 . 1 22 22 LYS CB C 13 31.716 0.3 . 1 . . . . . 21 LYS CB . 50277 1 95 . 1 . 1 22 22 LYS N N 15 115.869 0.3 . 1 . . . . . 21 LYS N . 50277 1 96 . 1 . 1 23 23 ILE H H 1 7.294 0.020 . 1 . . . . . 22 ILE H . 50277 1 97 . 1 . 1 23 23 ILE C C 13 176.227 0.3 . 1 . . . . . 22 ILE C . 50277 1 98 . 1 . 1 23 23 ILE CA C 13 60.787 0.3 . 1 . . . . . 22 ILE CA . 50277 1 99 . 1 . 1 23 23 ILE CB C 13 38.127 0.3 . 1 . . . . . 22 ILE CB . 50277 1 100 . 1 . 1 23 23 ILE N N 15 117.589 0.3 . 1 . . . . . 22 ILE N . 50277 1 101 . 1 . 1 24 24 PHE H H 1 7.983 0.020 . 1 . . . . . 23 PHE H . 50277 1 102 . 1 . 1 24 24 PHE C C 13 173.681 0.3 . 1 . . . . . 23 PHE C . 50277 1 103 . 1 . 1 24 24 PHE CA C 13 56.059 0.3 . 1 . . . . . 23 PHE CA . 50277 1 104 . 1 . 1 24 24 PHE CB C 13 43.051 0.3 . 1 . . . . . 23 PHE CB . 50277 1 105 . 1 . 1 24 24 PHE N N 15 118.392 0.3 . 1 . . . . . 23 PHE N . 50277 1 106 . 1 . 1 25 25 GLU H H 1 9.067 0.020 . 1 . . . . . 24 GLU H . 50277 1 107 . 1 . 1 25 25 GLU C C 13 176.320 0.3 . 1 . . . . . 24 GLU C . 50277 1 108 . 1 . 1 25 25 GLU CA C 13 53.996 0.3 . 1 . . . . . 24 GLU CA . 50277 1 109 . 1 . 1 25 25 GLU CB C 13 30.774 0.3 . 1 . . . . . 24 GLU CB . 50277 1 110 . 1 . 1 25 25 GLU N N 15 120.078 0.3 . 1 . . . . . 24 GLU N . 50277 1 111 . 1 . 1 26 26 PHE H H 1 9.015 0.020 . 1 . . . . . 25 PHE H . 50277 1 112 . 1 . 1 26 26 PHE C C 13 176.041 0.3 . 1 . . . . . 25 PHE C . 50277 1 113 . 1 . 1 26 26 PHE CA C 13 55.787 0.3 . 1 . . . . . 25 PHE CA . 50277 1 114 . 1 . 1 26 26 PHE CB C 13 36.617 0.3 . 1 . . . . . 25 PHE CB . 50277 1 115 . 1 . 1 26 26 PHE N N 15 128.879 0.3 . 1 . . . . . 25 PHE N . 50277 1 116 . 1 . 1 27 27 LYS H H 1 9.116 0.020 . 1 . . . . . 26 LYS H . 50277 1 117 . 1 . 1 27 27 LYS C C 13 175.781 0.3 . 1 . . . . . 26 LYS C . 50277 1 118 . 1 . 1 27 27 LYS CA C 13 55.752 0.3 . 1 . . . . . 26 LYS CA . 50277 1 119 . 1 . 1 27 27 LYS CB C 13 31.458 0.3 . 1 . . . . . 26 LYS CB . 50277 1 120 . 1 . 1 27 27 LYS N N 15 124.959 0.3 . 1 . . . . . 26 LYS N . 50277 1 121 . 1 . 1 28 28 GLU H H 1 7.767 0.020 . 1 . . . . . 27 GLU H . 50277 1 122 . 1 . 1 28 28 GLU C C 13 175.030 0.3 . 1 . . . . . 27 GLU C . 50277 1 123 . 1 . 1 28 28 GLU CA C 13 55.722 0.3 . 1 . . . . . 27 GLU CA . 50277 1 124 . 1 . 1 28 28 GLU CB C 13 30.953 0.3 . 1 . . . . . 27 GLU CB . 50277 1 125 . 1 . 1 28 28 GLU N N 15 117.485 0.3 . 1 . . . . . 27 GLU N . 50277 1 126 . 1 . 1 29 29 THR H H 1 8.788 0.020 . 1 . . . . . 28 THR H . 50277 1 127 . 1 . 1 29 29 THR C C 13 174.244 0.3 . 1 . . . . . 28 THR C . 50277 1 128 . 1 . 1 29 29 THR CA C 13 63.646 0.3 . 1 . . . . . 28 THR CA . 50277 1 129 . 1 . 1 29 29 THR CB C 13 68.674 0.3 . 1 . . . . . 28 THR CB . 50277 1 130 . 1 . 1 29 29 THR N N 15 119.300 0.3 . 1 . . . . . 28 THR N . 50277 1 131 . 1 . 1 30 30 LEU H H 1 9.215 0.020 . 1 . . . . . 29 LEU H . 50277 1 132 . 1 . 1 30 30 LEU C C 13 177.504 0.3 . 1 . . . . . 29 LEU C . 50277 1 133 . 1 . 1 30 30 LEU CA C 13 54.690 0.3 . 1 . . . . . 29 LEU CA . 50277 1 134 . 1 . 1 30 30 LEU CB C 13 41.800 0.3 . 1 . . . . . 29 LEU CB . 50277 1 135 . 1 . 1 30 30 LEU N N 15 128.565 0.3 . 1 . . . . . 29 LEU N . 50277 1 136 . 1 . 1 31 31 GLY H H 1 7.922 0.020 . 1 . . . . . 30 GLY H . 50277 1 137 . 1 . 1 31 31 GLY C C 13 171.962 0.3 . 1 . . . . . 30 GLY C . 50277 1 138 . 1 . 1 31 31 GLY CA C 13 45.106 0.3 . 1 . . . . . 30 GLY CA . 50277 1 139 . 1 . 1 31 31 GLY N N 15 107.977 0.3 . 1 . . . . . 30 GLY N . 50277 1 140 . 1 . 1 32 32 THR H H 1 8.280 0.020 . 1 . . . . . 31 THR H . 50277 1 141 . 1 . 1 32 32 THR C C 13 173.973 0.3 . 1 . . . . . 31 THR C . 50277 1 142 . 1 . 1 32 32 THR CA C 13 60.944 0.3 . 1 . . . . . 31 THR CA . 50277 1 143 . 1 . 1 32 32 THR CB C 13 70.526 0.3 . 1 . . . . . 31 THR CB . 50277 1 144 . 1 . 1 32 32 THR N N 15 114.339 0.3 . 1 . . . . . 31 THR N . 50277 1 145 . 1 . 1 33 33 GLY H H 1 8.249 0.020 . 1 . . . . . 32 GLY H . 50277 1 146 . 1 . 1 33 33 GLY C C 13 173.519 0.3 . 1 . . . . . 32 GLY C . 50277 1 147 . 1 . 1 33 33 GLY CA C 13 43.813 0.3 . 1 . . . . . 32 GLY CA . 50277 1 148 . 1 . 1 33 33 GLY N N 15 112.484 0.3 . 1 . . . . . 32 GLY N . 50277 1 149 . 1 . 1 34 34 ALA H H 1 8.453 0.020 . 1 . . . . . 33 ALA H . 50277 1 150 . 1 . 1 34 34 ALA CA C 13 53.864 0.3 . 1 . . . . . 33 ALA CA . 50277 1 151 . 1 . 1 34 34 ALA CB C 13 17.976 0.3 . 1 . . . . . 33 ALA CB . 50277 1 152 . 1 . 1 34 34 ALA N N 15 123.970 0.3 . 1 . . . . . 33 ALA N . 50277 1 153 . 1 . 1 36 36 SER C C 13 173.217 0.3 . 1 . . . . . 35 SER C . 50277 1 154 . 1 . 1 36 36 SER CA C 13 57.262 0.3 . 1 . . . . . 35 SER CA . 50277 1 155 . 1 . 1 36 36 SER CB C 13 65.398 0.3 . 1 . . . . . 35 SER CB . 50277 1 156 . 1 . 1 37 37 GLU H H 1 8.030 0.020 . 1 . . . . . 36 GLU H . 50277 1 157 . 1 . 1 37 37 GLU C C 13 174.418 0.3 . 1 . . . . . 36 GLU C . 50277 1 158 . 1 . 1 37 37 GLU CA C 13 55.090 0.3 . 1 . . . . . 36 GLU CA . 50277 1 159 . 1 . 1 37 37 GLU CB C 13 31.827 0.3 . 1 . . . . . 36 GLU CB . 50277 1 160 . 1 . 1 37 37 GLU N N 15 119.898 0.3 . 1 . . . . . 36 GLU N . 50277 1 161 . 1 . 1 38 38 VAL H H 1 8.768 0.020 . 1 . . . . . 37 VAL H . 50277 1 162 . 1 . 1 38 38 VAL C C 13 175.249 0.3 . 1 . . . . . 37 VAL C . 50277 1 163 . 1 . 1 38 38 VAL CA C 13 60.568 0.3 . 1 . . . . . 37 VAL CA . 50277 1 164 . 1 . 1 38 38 VAL CB C 13 32.185 0.3 . 1 . . . . . 37 VAL CB . 50277 1 165 . 1 . 1 38 38 VAL N N 15 124.815 0.3 . 1 . . . . . 37 VAL N . 50277 1 166 . 1 . 1 39 39 VAL H H 1 8.990 0.020 . 1 . . . . . 38 VAL H . 50277 1 167 . 1 . 1 39 39 VAL C C 13 174.208 0.3 . 1 . . . . . 38 VAL C . 50277 1 168 . 1 . 1 39 39 VAL CA C 13 58.829 0.3 . 1 . . . . . 38 VAL CA . 50277 1 169 . 1 . 1 39 39 VAL CB C 13 34.185 0.3 . 1 . . . . . 38 VAL CB . 50277 1 170 . 1 . 1 39 39 VAL N N 15 124.114 0.3 . 1 . . . . . 38 VAL N . 50277 1 171 . 1 . 1 40 40 LEU H H 1 8.648 0.020 . 1 . . . . . 39 LEU H . 50277 1 172 . 1 . 1 40 40 LEU C C 13 174.749 0.3 . 1 . . . . . 39 LEU C . 50277 1 173 . 1 . 1 40 40 LEU CA C 13 54.737 0.3 . 1 . . . . . 39 LEU CA . 50277 1 174 . 1 . 1 40 40 LEU CB C 13 41.905 0.3 . 1 . . . . . 39 LEU CB . 50277 1 175 . 1 . 1 40 40 LEU N N 15 126.710 0.3 . 1 . . . . . 39 LEU N . 50277 1 176 . 1 . 1 41 41 ALA H H 1 9.200 0.020 . 1 . . . . . 40 ALA H . 50277 1 177 . 1 . 1 41 41 ALA C C 13 174.282 0.3 . 1 . . . . . 40 ALA C . 50277 1 178 . 1 . 1 41 41 ALA CA C 13 49.729 0.3 . 1 . . . . . 40 ALA CA . 50277 1 179 . 1 . 1 41 41 ALA CB C 13 23.833 0.3 . 1 . . . . . 40 ALA CB . 50277 1 180 . 1 . 1 41 41 ALA N N 15 129.836 0.3 . 1 . . . . . 40 ALA N . 50277 1 181 . 1 . 1 42 42 GLU H H 1 8.910 0.020 . 1 . . . . . 41 GLU H . 50277 1 182 . 1 . 1 42 42 GLU C C 13 176.328 0.3 . 1 . . . . . 41 GLU C . 50277 1 183 . 1 . 1 42 42 GLU CA C 13 53.233 0.3 . 1 . . . . . 41 GLU CA . 50277 1 184 . 1 . 1 42 42 GLU CB C 13 33.137 0.3 . 1 . . . . . 41 GLU CB . 50277 1 185 . 1 . 1 42 42 GLU N N 15 121.906 0.3 . 1 . . . . . 41 GLU N . 50277 1 186 . 1 . 1 43 43 GLU H H 1 9.766 0.020 . 1 . . . . . 42 GLU H . 50277 1 187 . 1 . 1 43 43 GLU C C 13 176.584 0.3 . 1 . . . . . 42 GLU C . 50277 1 188 . 1 . 1 43 43 GLU CA C 13 55.924 0.3 . 1 . . . . . 42 GLU CA . 50277 1 189 . 1 . 1 43 43 GLU CB C 13 29.345 0.3 . 1 . . . . . 42 GLU CB . 50277 1 190 . 1 . 1 43 43 GLU N N 15 131.272 0.3 . 1 . . . . . 42 GLU N . 50277 1 191 . 1 . 1 44 44 LYS H H 1 8.296 0.020 . 1 . . . . . 43 LYS H . 50277 1 192 . 1 . 1 44 44 LYS C C 13 178.955 0.3 . 1 . . . . . 43 LYS C . 50277 1 193 . 1 . 1 44 44 LYS CA C 13 59.929 0.3 . 1 . . . . . 43 LYS CA . 50277 1 194 . 1 . 1 44 44 LYS CB C 13 30.658 0.3 . 1 . . . . . 43 LYS CB . 50277 1 195 . 1 . 1 44 44 LYS N N 15 132.543 0.3 . 1 . . . . . 43 LYS N . 50277 1 196 . 1 . 1 45 45 ALA H H 1 8.842 0.020 . 1 . . . . . 44 ALA H . 50277 1 197 . 1 . 1 45 45 ALA C C 13 178.436 0.3 . 1 . . . . . 44 ALA C . 50277 1 198 . 1 . 1 45 45 ALA CA C 13 53.928 0.3 . 1 . . . . . 44 ALA CA . 50277 1 199 . 1 . 1 45 45 ALA CB C 13 18.981 0.3 . 1 . . . . . 44 ALA CB . 50277 1 200 . 1 . 1 45 45 ALA N N 15 117.053 0.3 . 1 . . . . . 44 ALA N . 50277 1 201 . 1 . 1 46 46 THR H H 1 7.006 0.020 . 1 . . . . . 45 THR H . 50277 1 202 . 1 . 1 46 46 THR C C 13 176.212 0.3 . 1 . . . . . 45 THR C . 50277 1 203 . 1 . 1 46 46 THR CA C 13 60.893 0.3 . 1 . . . . . 45 THR CA . 50277 1 204 . 1 . 1 46 46 THR CB C 13 71.135 0.3 . 1 . . . . . 45 THR CB . 50277 1 205 . 1 . 1 46 46 THR N N 15 102.381 0.3 . 1 . . . . . 45 THR N . 50277 1 206 . 1 . 1 47 47 GLY H H 1 8.705 0.020 . 1 . . . . . 46 GLY H . 50277 1 207 . 1 . 1 47 47 GLY C C 13 173.750 0.3 . 1 . . . . . 46 GLY C . 50277 1 208 . 1 . 1 47 47 GLY CA C 13 44.965 0.3 . 1 . . . . . 46 GLY CA . 50277 1 209 . 1 . 1 47 47 GLY N N 15 112.957 0.3 . 1 . . . . . 46 GLY N . 50277 1 210 . 1 . 1 48 48 LYS H H 1 8.038 0.020 . 1 . . . . . 47 LYS H . 50277 1 211 . 1 . 1 48 48 LYS C C 13 174.789 0.3 . 1 . . . . . 47 LYS C . 50277 1 212 . 1 . 1 48 48 LYS CA C 13 56.742 0.3 . 1 . . . . . 47 LYS CA . 50277 1 213 . 1 . 1 48 48 LYS CB C 13 33.069 0.3 . 1 . . . . . 47 LYS CB . 50277 1 214 . 1 . 1 48 48 LYS N N 15 121.845 0.3 . 1 . . . . . 47 LYS N . 50277 1 215 . 1 . 1 49 49 LEU H H 1 7.688 0.020 . 1 . . . . . 48 LEU H . 50277 1 216 . 1 . 1 49 49 LEU C C 13 176.150 0.3 . 1 . . . . . 48 LEU C . 50277 1 217 . 1 . 1 49 49 LEU CA C 13 53.140 0.3 . 1 . . . . . 48 LEU CA . 50277 1 218 . 1 . 1 49 49 LEU CB C 13 43.199 0.3 . 1 . . . . . 48 LEU CB . 50277 1 219 . 1 . 1 49 49 LEU N N 15 120.914 0.3 . 1 . . . . . 48 LEU N . 50277 1 220 . 1 . 1 50 50 PHE H H 1 9.091 0.020 . 1 . . . . . 49 PHE H . 50277 1 221 . 1 . 1 50 50 PHE C C 13 173.401 0.3 . 1 . . . . . 49 PHE C . 50277 1 222 . 1 . 1 50 50 PHE CA C 13 57.154 0.3 . 1 . . . . . 49 PHE CA . 50277 1 223 . 1 . 1 50 50 PHE CB C 13 44.217 0.3 . 1 . . . . . 49 PHE CB . 50277 1 224 . 1 . 1 50 50 PHE N N 15 118.364 0.3 . 1 . . . . . 49 PHE N . 50277 1 225 . 1 . 1 51 51 ALA H H 1 8.312 0.020 . 1 . . . . . 50 ALA H . 50277 1 226 . 1 . 1 51 51 ALA C C 13 175.863 0.3 . 1 . . . . . 50 ALA C . 50277 1 227 . 1 . 1 51 51 ALA CA C 13 50.138 0.3 . 1 . . . . . 50 ALA CA . 50277 1 228 . 1 . 1 51 51 ALA CB C 13 19.374 0.3 . 1 . . . . . 50 ALA CB . 50277 1 229 . 1 . 1 51 51 ALA N N 15 123.700 0.3 . 1 . . . . . 50 ALA N . 50277 1 230 . 1 . 1 52 52 VAL H H 1 9.154 0.020 . 1 . . . . . 51 VAL H . 50277 1 231 . 1 . 1 52 52 VAL C C 13 174.900 0.3 . 1 . . . . . 51 VAL C . 50277 1 232 . 1 . 1 52 52 VAL CA C 13 60.235 0.3 . 1 . . . . . 51 VAL CA . 50277 1 233 . 1 . 1 52 52 VAL CB C 13 32.518 0.3 . 1 . . . . . 51 VAL CB . 50277 1 234 . 1 . 1 52 52 VAL N N 15 123.133 0.3 . 1 . . . . . 51 VAL N . 50277 1 235 . 1 . 1 53 53 LYS H H 1 9.375 0.020 . 1 . . . . . 52 LYS H . 50277 1 236 . 1 . 1 53 53 LYS C C 13 174.826 0.3 . 1 . . . . . 52 LYS C . 50277 1 237 . 1 . 1 53 53 LYS CA C 13 54.956 0.3 . 1 . . . . . 52 LYS CA . 50277 1 238 . 1 . 1 53 53 LYS CB C 13 32.980 0.3 . 1 . . . . . 52 LYS CB . 50277 1 239 . 1 . 1 53 53 LYS N N 15 130.181 0.3 . 1 . . . . . 52 LYS N . 50277 1 240 . 1 . 1 54 54 CYS H H 1 9.267 0.020 . 1 . . . . . 53 CYS H . 50277 1 241 . 1 . 1 54 54 CYS C C 13 174.733 0.3 . 1 . . . . . 53 CYS C . 50277 1 242 . 1 . 1 54 54 CYS CA C 13 56.790 0.3 . 1 . . . . . 53 CYS CA . 50277 1 243 . 1 . 1 54 54 CYS CB C 13 28.050 0.3 . 1 . . . . . 53 CYS CB . 50277 1 244 . 1 . 1 54 54 CYS N N 15 127.319 0.3 . 1 . . . . . 53 CYS N . 50277 1 245 . 1 . 1 55 55 ILE H H 1 9.172 0.020 . 1 . . . . . 54 ILE H . 50277 1 246 . 1 . 1 55 55 ILE C C 13 173.512 0.3 . 1 . . . . . 54 ILE C . 50277 1 247 . 1 . 1 55 55 ILE CA C 13 57.640 0.3 . 1 . . . . . 54 ILE CA . 50277 1 248 . 1 . 1 55 55 ILE CB C 13 40.691 0.3 . 1 . . . . . 54 ILE CB . 50277 1 249 . 1 . 1 55 55 ILE N N 15 127.443 0.3 . 1 . . . . . 54 ILE N . 50277 1 250 . 1 . 1 57 57 LYS C C 13 179.533 0.3 . 1 . . . . . 56 LYS C . 50277 1 251 . 1 . 1 57 57 LYS CA C 13 59.371 0.3 . 1 . . . . . 56 LYS CA . 50277 1 252 . 1 . 1 57 57 LYS CB C 13 31.430 0.3 . 1 . . . . . 56 LYS CB . 50277 1 253 . 1 . 1 58 58 LYS H H 1 8.460 0.020 . 1 . . . . . 57 LYS H . 50277 1 254 . 1 . 1 58 58 LYS C C 13 177.433 0.3 . 1 . . . . . 57 LYS C . 50277 1 255 . 1 . 1 58 58 LYS CA C 13 58.231 0.3 . 1 . . . . . 57 LYS CA . 50277 1 256 . 1 . 1 58 58 LYS CB C 13 31.170 0.3 . 1 . . . . . 57 LYS CB . 50277 1 257 . 1 . 1 58 58 LYS N N 15 119.283 0.3 . 1 . . . . . 57 LYS N . 50277 1 258 . 1 . 1 59 59 ALA H H 1 7.367 0.020 . 1 . . . . . 58 ALA H . 50277 1 259 . 1 . 1 59 59 ALA C C 13 177.529 0.3 . 1 . . . . . 58 ALA C . 50277 1 260 . 1 . 1 59 59 ALA CA C 13 52.520 0.3 . 1 . . . . . 58 ALA CA . 50277 1 261 . 1 . 1 59 59 ALA CB C 13 18.170 0.3 . 1 . . . . . 58 ALA CB . 50277 1 262 . 1 . 1 59 59 ALA N N 15 120.285 0.3 . 1 . . . . . 58 ALA N . 50277 1 263 . 1 . 1 60 60 LEU H H 1 7.332 0.020 . 1 . . . . . 59 LEU H . 50277 1 264 . 1 . 1 60 60 LEU C C 13 176.487 0.3 . 1 . . . . . 59 LEU C . 50277 1 265 . 1 . 1 60 60 LEU CA C 13 53.644 0.3 . 1 . . . . . 59 LEU CA . 50277 1 266 . 1 . 1 60 60 LEU CB C 13 41.043 0.3 . 1 . . . . . 59 LEU CB . 50277 1 267 . 1 . 1 60 60 LEU N N 15 116.792 0.3 . 1 . . . . . 59 LEU N . 50277 1 268 . 1 . 1 61 61 LYS H H 1 7.122 0.020 . 1 . . . . . 60 LYS H . 50277 1 269 . 1 . 1 61 61 LYS C C 13 177.665 0.3 . 1 . . . . . 60 LYS C . 50277 1 270 . 1 . 1 61 61 LYS CA C 13 57.129 0.3 . 1 . . . . . 60 LYS CA . 50277 1 271 . 1 . 1 61 61 LYS CB C 13 31.378 0.3 . 1 . . . . . 60 LYS CB . 50277 1 272 . 1 . 1 61 61 LYS N N 15 120.233 0.3 . 1 . . . . . 60 LYS N . 50277 1 273 . 1 . 1 62 62 GLY H H 1 8.786 0.020 . 1 . . . . . 61 GLY H . 50277 1 274 . 1 . 1 62 62 GLY C C 13 174.516 0.3 . 1 . . . . . 61 GLY C . 50277 1 275 . 1 . 1 62 62 GLY CA C 13 45.005 0.3 . 1 . . . . . 61 GLY CA . 50277 1 276 . 1 . 1 62 62 GLY N N 15 114.605 0.3 . 1 . . . . . 61 GLY N . 50277 1 277 . 1 . 1 63 63 LYS H H 1 7.743 0.020 . 1 . . . . . 62 LYS H . 50277 1 278 . 1 . 1 63 63 LYS CA C 13 56.879 0.3 . 1 . . . . . 62 LYS CA . 50277 1 279 . 1 . 1 63 63 LYS CB C 13 32.759 0.3 . 1 . . . . . 62 LYS CB . 50277 1 280 . 1 . 1 63 63 LYS N N 15 126.300 0.3 . 1 . . . . . 62 LYS N . 50277 1 281 . 1 . 1 67 67 ILE CA C 13 61.152 0.3 . 1 . . . . . 66 ILE CA . 50277 1 282 . 1 . 1 67 67 ILE CB C 13 37.729 0.3 . 1 . . . . . 66 ILE CB . 50277 1 283 . 1 . 1 68 68 GLU H H 1 7.814 0.020 . 1 . . . . . 67 GLU H . 50277 1 284 . 1 . 1 68 68 GLU CA C 13 59.063 0.3 . 1 . . . . . 67 GLU CA . 50277 1 285 . 1 . 1 68 68 GLU CB C 13 28.935 0.3 . 1 . . . . . 67 GLU CB . 50277 1 286 . 1 . 1 68 68 GLU N N 15 120.631 0.3 . 1 . . . . . 67 GLU N . 50277 1 287 . 1 . 1 71 71 ILE CA C 13 61.177 0.3 . 1 . . . . . 70 ILE CA . 50277 1 288 . 1 . 1 72 72 ALA H H 1 7.945 0.020 . 1 . . . . . 71 ALA H . 50277 1 289 . 1 . 1 72 72 ALA C C 13 179.396 0.3 . 1 . . . . . 71 ALA C . 50277 1 290 . 1 . 1 72 72 ALA CA C 13 54.424 0.3 . 1 . . . . . 71 ALA CA . 50277 1 291 . 1 . 1 72 72 ALA CB C 13 16.646 0.3 . 1 . . . . . 71 ALA CB . 50277 1 292 . 1 . 1 72 72 ALA N N 15 122.971 0.3 . 1 . . . . . 71 ALA N . 50277 1 293 . 1 . 1 73 73 VAL H H 1 6.866 0.020 . 1 . . . . . 72 VAL H . 50277 1 294 . 1 . 1 73 73 VAL C C 13 177.515 0.3 . 1 . . . . . 72 VAL C . 50277 1 295 . 1 . 1 73 73 VAL CA C 13 59.143 0.3 . 1 . . . . . 72 VAL CA . 50277 1 296 . 1 . 1 73 73 VAL CB C 13 31.221 0.3 . 1 . . . . . 72 VAL CB . 50277 1 297 . 1 . 1 73 73 VAL N N 15 115.034 0.3 . 1 . . . . . 72 VAL N . 50277 1 298 . 1 . 1 74 74 LEU H H 1 7.912 0.020 . 1 . . . . . 73 LEU H . 50277 1 299 . 1 . 1 74 74 LEU C C 13 177.404 0.3 . 1 . . . . . 73 LEU C . 50277 1 300 . 1 . 1 74 74 LEU CA C 13 57.315 0.3 . 1 . . . . . 73 LEU CA . 50277 1 301 . 1 . 1 74 74 LEU CB C 13 42.915 0.3 . 1 . . . . . 73 LEU CB . 50277 1 302 . 1 . 1 74 74 LEU N N 15 119.064 0.3 . 1 . . . . . 73 LEU N . 50277 1 303 . 1 . 1 78 78 LYS C C 13 172.981 0.3 . 1 . . . . . 77 LYS C . 50277 1 304 . 1 . 1 79 79 HIS H H 1 8.988 0.020 . 1 . . . . . 78 HIS H . 50277 1 305 . 1 . 1 79 79 HIS C C 13 175.213 0.3 . 1 . . . . . 78 HIS C . 50277 1 306 . 1 . 1 79 79 HIS CA C 13 57.293 0.3 . 1 . . . . . 78 HIS CA . 50277 1 307 . 1 . 1 79 79 HIS CB C 13 33.729 0.3 . 1 . . . . . 78 HIS CB . 50277 1 308 . 1 . 1 79 79 HIS N N 15 126.128 0.3 . 1 . . . . . 78 HIS N . 50277 1 309 . 1 . 1 80 80 GLU H H 1 7.911 0.020 . 1 . . . . . 79 GLU H . 50277 1 310 . 1 . 1 80 80 GLU C C 13 176.612 0.3 . 1 . . . . . 79 GLU C . 50277 1 311 . 1 . 1 80 80 GLU CA C 13 58.396 0.3 . 1 . . . . . 79 GLU CA . 50277 1 312 . 1 . 1 80 80 GLU CB C 13 29.403 0.3 . 1 . . . . . 79 GLU CB . 50277 1 313 . 1 . 1 80 80 GLU N N 15 126.583 0.3 . 1 . . . . . 79 GLU N . 50277 1 314 . 1 . 1 81 81 ASN H H 1 11.519 0.020 . 1 . . . . . 80 ASN H . 50277 1 315 . 1 . 1 81 81 ASN C C 13 173.722 0.3 . 1 . . . . . 80 ASN C . 50277 1 316 . 1 . 1 81 81 ASN CA C 13 53.852 0.3 . 1 . . . . . 80 ASN CA . 50277 1 317 . 1 . 1 81 81 ASN CB C 13 39.861 0.3 . 1 . . . . . 80 ASN CB . 50277 1 318 . 1 . 1 81 81 ASN N N 15 119.225 0.3 . 1 . . . . . 80 ASN N . 50277 1 319 . 1 . 1 82 82 ILE H H 1 7.709 0.020 . 1 . . . . . 81 ILE H . 50277 1 320 . 1 . 1 82 82 ILE C C 13 175.414 0.3 . 1 . . . . . 81 ILE C . 50277 1 321 . 1 . 1 82 82 ILE CA C 13 61.089 0.3 . 1 . . . . . 81 ILE CA . 50277 1 322 . 1 . 1 82 82 ILE CB C 13 40.500 0.3 . 1 . . . . . 81 ILE CB . 50277 1 323 . 1 . 1 82 82 ILE N N 15 118.802 0.3 . 1 . . . . . 81 ILE N . 50277 1 324 . 1 . 1 83 83 VAL CA C 13 61.793 0.3 . 1 . . . . . 82 VAL CA . 50277 1 325 . 1 . 1 83 83 VAL CB C 13 31.827 0.3 . 1 . . . . . 82 VAL CB . 50277 1 326 . 1 . 1 84 84 ALA H H 1 8.185 0.020 . 1 . . . . . 83 ALA H . 50277 1 327 . 1 . 1 84 84 ALA CA C 13 52.577 0.3 . 1 . . . . . 83 ALA CA . 50277 1 328 . 1 . 1 84 84 ALA CB C 13 18.304 0.3 . 1 . . . . . 83 ALA CB . 50277 1 329 . 1 . 1 84 84 ALA N N 15 125.802 0.3 . 1 . . . . . 83 ALA N . 50277 1 330 . 1 . 1 86 86 GLU C C 13 176.760 0.3 . 1 . . . . . 85 GLU C . 50277 1 331 . 1 . 1 86 86 GLU CA C 13 57.025 0.3 . 1 . . . . . 85 GLU CA . 50277 1 332 . 1 . 1 86 86 GLU CB C 13 29.678 0.3 . 1 . . . . . 85 GLU CB . 50277 1 333 . 1 . 1 87 87 ASP H H 1 8.015 0.020 . 1 . . . . . 86 ASP H . 50277 1 334 . 1 . 1 87 87 ASP C C 13 173.982 0.3 . 1 . . . . . 86 ASP C . 50277 1 335 . 1 . 1 87 87 ASP CA C 13 53.239 0.3 . 1 . . . . . 86 ASP CA . 50277 1 336 . 1 . 1 87 87 ASP CB C 13 45.639 0.3 . 1 . . . . . 86 ASP CB . 50277 1 337 . 1 . 1 87 87 ASP N N 15 116.869 0.3 . 1 . . . . . 86 ASP N . 50277 1 338 . 1 . 1 88 88 ILE H H 1 8.603 0.020 . 1 . . . . . 87 ILE H . 50277 1 339 . 1 . 1 88 88 ILE C C 13 174.198 0.3 . 1 . . . . . 87 ILE C . 50277 1 340 . 1 . 1 88 88 ILE CA C 13 60.390 0.3 . 1 . . . . . 87 ILE CA . 50277 1 341 . 1 . 1 88 88 ILE CB C 13 40.637 0.3 . 1 . . . . . 87 ILE CB . 50277 1 342 . 1 . 1 88 88 ILE N N 15 118.345 0.3 . 1 . . . . . 87 ILE N . 50277 1 343 . 1 . 1 89 89 TYR H H 1 9.104 0.020 . 1 . . . . . 88 TYR H . 50277 1 344 . 1 . 1 89 89 TYR C C 13 174.601 0.3 . 1 . . . . . 88 TYR C . 50277 1 345 . 1 . 1 89 89 TYR CA C 13 55.774 0.3 . 1 . . . . . 88 TYR CA . 50277 1 346 . 1 . 1 89 89 TYR CB C 13 43.116 0.3 . 1 . . . . . 88 TYR CB . 50277 1 347 . 1 . 1 89 89 TYR N N 15 123.689 0.3 . 1 . . . . . 88 TYR N . 50277 1 348 . 1 . 1 90 90 GLU H H 1 9.217 0.020 . 1 . . . . . 89 GLU H . 50277 1 349 . 1 . 1 90 90 GLU C C 13 174.217 0.3 . 1 . . . . . 89 GLU C . 50277 1 350 . 1 . 1 90 90 GLU CA C 13 54.737 0.3 . 1 . . . . . 89 GLU CA . 50277 1 351 . 1 . 1 90 90 GLU CB C 13 32.554 0.3 . 1 . . . . . 89 GLU CB . 50277 1 352 . 1 . 1 90 90 GLU N N 15 121.630 0.3 . 1 . . . . . 89 GLU N . 50277 1 353 . 1 . 1 91 91 SER H H 1 9.468 0.020 . 1 . . . . . 90 SER H . 50277 1 354 . 1 . 1 91 91 SER C C 13 173.767 0.3 . 1 . . . . . 90 SER C . 50277 1 355 . 1 . 1 91 91 SER CA C 13 56.171 0.3 . 1 . . . . . 90 SER CA . 50277 1 356 . 1 . 1 91 91 SER CB C 13 64.901 0.3 . 1 . . . . . 90 SER CB . 50277 1 357 . 1 . 1 91 91 SER N N 15 127.001 0.3 . 1 . . . . . 90 SER N . 50277 1 358 . 1 . 1 92 92 PRO C C 13 177.431 0.3 . 1 . . . . . 91 PRO C . 50277 1 359 . 1 . 1 93 93 ASN H H 1 8.201 0.020 . 1 . . . . . 92 ASN H . 50277 1 360 . 1 . 1 93 93 ASN C C 13 175.503 0.3 . 1 . . . . . 92 ASN C . 50277 1 361 . 1 . 1 93 93 ASN CA C 13 52.700 0.3 . 1 . . . . . 92 ASN CA . 50277 1 362 . 1 . 1 93 93 ASN CB C 13 40.695 0.3 . 1 . . . . . 92 ASN CB . 50277 1 363 . 1 . 1 93 93 ASN N N 15 108.322 0.3 . 1 . . . . . 92 ASN N . 50277 1 364 . 1 . 1 94 94 HIS H H 1 8.079 0.020 . 1 . . . . . 93 HIS H . 50277 1 365 . 1 . 1 94 94 HIS C C 13 172.268 0.3 . 1 . . . . . 93 HIS C . 50277 1 366 . 1 . 1 94 94 HIS CA C 13 57.243 0.3 . 1 . . . . . 93 HIS CA . 50277 1 367 . 1 . 1 94 94 HIS CB C 13 34.299 0.3 . 1 . . . . . 93 HIS CB . 50277 1 368 . 1 . 1 94 94 HIS N N 15 121.586 0.3 . 1 . . . . . 93 HIS N . 50277 1 369 . 1 . 1 95 95 LEU H H 1 8.869 0.020 . 1 . . . . . 94 LEU H . 50277 1 370 . 1 . 1 95 95 LEU C C 13 174.316 0.3 . 1 . . . . . 94 LEU C . 50277 1 371 . 1 . 1 95 95 LEU CA C 13 53.417 0.3 . 1 . . . . . 94 LEU CA . 50277 1 372 . 1 . 1 95 95 LEU CB C 13 45.029 0.3 . 1 . . . . . 94 LEU CB . 50277 1 373 . 1 . 1 95 95 LEU N N 15 120.928 0.3 . 1 . . . . . 94 LEU N . 50277 1 374 . 1 . 1 96 96 TYR H H 1 9.277 0.020 . 1 . . . . . 95 TYR H . 50277 1 375 . 1 . 1 96 96 TYR C C 13 174.787 0.3 . 1 . . . . . 95 TYR C . 50277 1 376 . 1 . 1 96 96 TYR CA C 13 56.024 0.3 . 1 . . . . . 95 TYR CA . 50277 1 377 . 1 . 1 96 96 TYR CB C 13 39.002 0.3 . 1 . . . . . 95 TYR CB . 50277 1 378 . 1 . 1 96 96 TYR N N 15 120.338 0.3 . 1 . . . . . 95 TYR N . 50277 1 379 . 1 . 1 97 97 LEU H H 1 9.192 0.020 . 1 . . . . . 96 LEU H . 50277 1 380 . 1 . 1 97 97 LEU C C 13 174.719 0.3 . 1 . . . . . 96 LEU C . 50277 1 381 . 1 . 1 97 97 LEU CA C 13 53.788 0.3 . 1 . . . . . 96 LEU CA . 50277 1 382 . 1 . 1 97 97 LEU CB C 13 40.718 0.3 . 1 . . . . . 96 LEU CB . 50277 1 383 . 1 . 1 97 97 LEU N N 15 124.497 0.3 . 1 . . . . . 96 LEU N . 50277 1 384 . 1 . 1 98 98 VAL H H 1 8.767 0.020 . 1 . . . . . 97 VAL H . 50277 1 385 . 1 . 1 98 98 VAL C C 13 173.931 0.3 . 1 . . . . . 97 VAL C . 50277 1 386 . 1 . 1 98 98 VAL CA C 13 62.554 0.3 . 1 . . . . . 97 VAL CA . 50277 1 387 . 1 . 1 98 98 VAL CB C 13 30.064 0.3 . 1 . . . . . 97 VAL CB . 50277 1 388 . 1 . 1 98 98 VAL N N 15 126.159 0.3 . 1 . . . . . 97 VAL N . 50277 1 389 . 1 . 1 99 99 MET H H 1 9.446 0.020 . 1 . . . . . 98 MET H . 50277 1 390 . 1 . 1 99 99 MET C C 13 173.767 0.3 . 1 . . . . . 98 MET C . 50277 1 391 . 1 . 1 99 99 MET CA C 13 53.217 0.3 . 1 . . . . . 98 MET CA . 50277 1 392 . 1 . 1 99 99 MET CB C 13 33.769 0.3 . 1 . . . . . 98 MET CB . 50277 1 393 . 1 . 1 99 99 MET N N 15 127.409 0.3 . 1 . . . . . 98 MET N . 50277 1 394 . 1 . 1 103 103 SER C C 13 175.019 0.3 . 1 . . . . . 102 SER C . 50277 1 395 . 1 . 1 103 103 SER CA C 13 57.956 0.3 . 1 . . . . . 102 SER CA . 50277 1 396 . 1 . 1 103 103 SER CB C 13 64.269 0.3 . 1 . . . . . 102 SER CB . 50277 1 397 . 1 . 1 104 104 GLY H H 1 7.608 0.020 . 1 . . . . . 103 GLY H . 50277 1 398 . 1 . 1 104 104 GLY C C 13 173.835 0.3 . 1 . . . . . 103 GLY C . 50277 1 399 . 1 . 1 104 104 GLY CA C 13 45.776 0.3 . 1 . . . . . 103 GLY CA . 50277 1 400 . 1 . 1 104 104 GLY N N 15 109.868 0.3 . 1 . . . . . 103 GLY N . 50277 1 401 . 1 . 1 105 105 GLY H H 1 8.189 0.020 . 1 . . . . . 104 GLY H . 50277 1 402 . 1 . 1 105 105 GLY C C 13 172.396 0.3 . 1 . . . . . 104 GLY C . 50277 1 403 . 1 . 1 105 105 GLY CA C 13 43.363 0.3 . 1 . . . . . 104 GLY CA . 50277 1 404 . 1 . 1 105 105 GLY N N 15 109.460 0.3 . 1 . . . . . 104 GLY N . 50277 1 405 . 1 . 1 106 106 GLU H H 1 8.561 0.020 . 1 . . . . . 105 GLU H . 50277 1 406 . 1 . 1 106 106 GLU C C 13 177.924 0.3 . 1 . . . . . 105 GLU C . 50277 1 407 . 1 . 1 106 106 GLU CA C 13 56.213 0.3 . 1 . . . . . 105 GLU CA . 50277 1 408 . 1 . 1 106 106 GLU CB C 13 30.070 0.3 . 1 . . . . . 105 GLU CB . 50277 1 409 . 1 . 1 106 106 GLU N N 15 117.915 0.3 . 1 . . . . . 105 GLU N . 50277 1 410 . 1 . 1 107 107 LEU H H 1 8.070 0.020 . 1 . . . . . 106 LEU H . 50277 1 411 . 1 . 1 107 107 LEU C C 13 178.455 0.3 . 1 . . . . . 106 LEU C . 50277 1 412 . 1 . 1 107 107 LEU CA C 13 58.335 0.3 . 1 . . . . . 106 LEU CA . 50277 1 413 . 1 . 1 107 107 LEU CB C 13 41.428 0.3 . 1 . . . . . 106 LEU CB . 50277 1 414 . 1 . 1 107 107 LEU N N 15 123.450 0.3 . 1 . . . . . 106 LEU N . 50277 1 415 . 1 . 1 108 108 PHE H H 1 8.798 0.020 . 1 . . . . . 107 PHE H . 50277 1 416 . 1 . 1 108 108 PHE C C 13 178.128 0.3 . 1 . . . . . 107 PHE C . 50277 1 417 . 1 . 1 108 108 PHE CA C 13 58.005 0.3 . 1 . . . . . 107 PHE CA . 50277 1 418 . 1 . 1 108 108 PHE CB C 13 36.321 0.3 . 1 . . . . . 107 PHE CB . 50277 1 419 . 1 . 1 108 108 PHE N N 15 114.970 0.3 . 1 . . . . . 107 PHE N . 50277 1 420 . 1 . 1 109 109 ASP H H 1 7.169 0.020 . 1 . . . . . 108 ASP H . 50277 1 421 . 1 . 1 109 109 ASP C C 13 178.048 0.3 . 1 . . . . . 108 ASP C . 50277 1 422 . 1 . 1 109 109 ASP CA C 13 57.147 0.3 . 1 . . . . . 108 ASP CA . 50277 1 423 . 1 . 1 109 109 ASP CB C 13 39.975 0.3 . 1 . . . . . 108 ASP CB . 50277 1 424 . 1 . 1 109 109 ASP N N 15 117.784 0.3 . 1 . . . . . 108 ASP N . 50277 1 425 . 1 . 1 110 110 ARG H H 1 7.432 0.020 . 1 . . . . . 109 ARG H . 50277 1 426 . 1 . 1 110 110 ARG C C 13 179.444 0.3 . 1 . . . . . 109 ARG C . 50277 1 427 . 1 . 1 110 110 ARG CA C 13 56.734 0.3 . 1 . . . . . 109 ARG CA . 50277 1 428 . 1 . 1 110 110 ARG CB C 13 28.339 0.3 . 1 . . . . . 109 ARG CB . 50277 1 429 . 1 . 1 110 110 ARG N N 15 118.027 0.3 . 1 . . . . . 109 ARG N . 50277 1 430 . 1 . 1 111 111 ILE H H 1 7.744 0.020 . 1 . . . . . 110 ILE H . 50277 1 431 . 1 . 1 111 111 ILE C C 13 178.533 0.3 . 1 . . . . . 110 ILE C . 50277 1 432 . 1 . 1 111 111 ILE CA C 13 64.852 0.3 . 1 . . . . . 110 ILE CA . 50277 1 433 . 1 . 1 111 111 ILE CB C 13 36.809 0.3 . 1 . . . . . 110 ILE CB . 50277 1 434 . 1 . 1 111 111 ILE N N 15 118.789 0.3 . 1 . . . . . 110 ILE N . 50277 1 435 . 1 . 1 112 112 VAL CA C 13 66.352 0.3 . 1 . . . . . 111 VAL CA . 50277 1 436 . 1 . 1 112 112 VAL CB C 13 30.813 0.3 . 1 . . . . . 111 VAL CB . 50277 1 437 . 1 . 1 113 113 GLU H H 1 7.503 0.020 . 1 . . . . . 112 GLU H . 50277 1 438 . 1 . 1 113 113 GLU CA C 13 56.710 0.3 . 1 . . . . . 112 GLU CA . 50277 1 439 . 1 . 1 113 113 GLU CB C 13 29.561 0.3 . 1 . . . . . 112 GLU CB . 50277 1 440 . 1 . 1 113 113 GLU N N 15 117.157 0.3 . 1 . . . . . 112 GLU N . 50277 1 441 . 1 . 1 114 114 LYS H H 1 7.387 0.020 . 1 . . . . . 113 LYS H . 50277 1 442 . 1 . 1 114 114 LYS C C 13 177.056 0.3 . 1 . . . . . 113 LYS C . 50277 1 443 . 1 . 1 114 114 LYS CA C 13 58.247 0.3 . 1 . . . . . 113 LYS CA . 50277 1 444 . 1 . 1 114 114 LYS CB C 13 33.057 0.3 . 1 . . . . . 113 LYS CB . 50277 1 445 . 1 . 1 114 114 LYS N N 15 120.316 0.3 . 1 . . . . . 113 LYS N . 50277 1 446 . 1 . 1 115 115 GLY H H 1 6.844 0.020 . 1 . . . . . 114 GLY H . 50277 1 447 . 1 . 1 115 115 GLY C C 13 172.530 0.3 . 1 . . . . . 114 GLY C . 50277 1 448 . 1 . 1 115 115 GLY CA C 13 45.133 0.3 . 1 . . . . . 114 GLY CA . 50277 1 449 . 1 . 1 115 115 GLY N N 15 104.228 0.3 . 1 . . . . . 114 GLY N . 50277 1 450 . 1 . 1 116 116 PHE H H 1 6.977 0.020 . 1 . . . . . 115 PHE H . 50277 1 451 . 1 . 1 116 116 PHE C C 13 173.693 0.3 . 1 . . . . . 115 PHE C . 50277 1 452 . 1 . 1 116 116 PHE CA C 13 56.835 0.3 . 1 . . . . . 115 PHE CA . 50277 1 453 . 1 . 1 116 116 PHE CB C 13 40.750 0.3 . 1 . . . . . 115 PHE CB . 50277 1 454 . 1 . 1 116 116 PHE N N 15 120.808 0.3 . 1 . . . . . 115 PHE N . 50277 1 455 . 1 . 1 117 117 TYR H H 1 8.055 0.020 . 1 . . . . . 116 TYR H . 50277 1 456 . 1 . 1 117 117 TYR C C 13 172.305 0.3 . 1 . . . . . 116 TYR C . 50277 1 457 . 1 . 1 117 117 TYR CA C 13 57.269 0.3 . 1 . . . . . 116 TYR CA . 50277 1 458 . 1 . 1 117 117 TYR CB C 13 41.784 0.3 . 1 . . . . . 116 TYR CB . 50277 1 459 . 1 . 1 117 117 TYR N N 15 129.204 0.3 . 1 . . . . . 116 TYR N . 50277 1 460 . 1 . 1 118 118 THR H H 1 8.533 0.020 . 1 . . . . . 117 THR H . 50277 1 461 . 1 . 1 118 118 THR C C 13 174.685 0.3 . 1 . . . . . 117 THR C . 50277 1 462 . 1 . 1 118 118 THR CA C 13 58.544 0.3 . 1 . . . . . 117 THR CA . 50277 1 463 . 1 . 1 118 118 THR CB C 13 73.374 0.3 . 1 . . . . . 117 THR CB . 50277 1 464 . 1 . 1 118 118 THR N N 15 118.063 0.3 . 1 . . . . . 117 THR N . 50277 1 465 . 1 . 1 119 119 GLU H H 1 9.711 0.020 . 1 . . . . . 118 GLU H . 50277 1 466 . 1 . 1 119 119 GLU C C 13 178.429 0.3 . 1 . . . . . 118 GLU C . 50277 1 467 . 1 . 1 119 119 GLU CA C 13 59.437 0.3 . 1 . . . . . 118 GLU CA . 50277 1 468 . 1 . 1 119 119 GLU CB C 13 30.037 0.3 . 1 . . . . . 118 GLU CB . 50277 1 469 . 1 . 1 119 119 GLU N N 15 119.972 0.3 . 1 . . . . . 118 GLU N . 50277 1 470 . 1 . 1 120 120 LYS H H 1 7.962 0.020 . 1 . . . . . 119 LYS H . 50277 1 471 . 1 . 1 120 120 LYS C C 13 179.175 0.3 . 1 . . . . . 119 LYS C . 50277 1 472 . 1 . 1 120 120 LYS CA C 13 58.832 0.3 . 1 . . . . . 119 LYS CA . 50277 1 473 . 1 . 1 120 120 LYS CB C 13 30.523 0.3 . 1 . . . . . 119 LYS CB . 50277 1 474 . 1 . 1 120 120 LYS N N 15 119.326 0.3 . 1 . . . . . 119 LYS N . 50277 1 475 . 1 . 1 121 121 ASP H H 1 7.471 0.020 . 1 . . . . . 120 ASP H . 50277 1 476 . 1 . 1 121 121 ASP C C 13 178.751 0.3 . 1 . . . . . 120 ASP C . 50277 1 477 . 1 . 1 121 121 ASP CA C 13 57.385 0.3 . 1 . . . . . 120 ASP CA . 50277 1 478 . 1 . 1 121 121 ASP CB C 13 40.753 0.3 . 1 . . . . . 120 ASP CB . 50277 1 479 . 1 . 1 121 121 ASP N N 15 121.375 0.3 . 1 . . . . . 120 ASP N . 50277 1 480 . 1 . 1 122 122 ALA H H 1 7.363 0.020 . 1 . . . . . 121 ALA H . 50277 1 481 . 1 . 1 122 122 ALA C C 13 178.454 0.3 . 1 . . . . . 121 ALA C . 50277 1 482 . 1 . 1 122 122 ALA CA C 13 55.305 0.3 . 1 . . . . . 121 ALA CA . 50277 1 483 . 1 . 1 122 122 ALA CB C 13 17.891 0.3 . 1 . . . . . 121 ALA CB . 50277 1 484 . 1 . 1 122 122 ALA N N 15 123.728 0.3 . 1 . . . . . 121 ALA N . 50277 1 485 . 1 . 1 123 123 SER H H 1 8.471 0.020 . 1 . . . . . 122 SER H . 50277 1 486 . 1 . 1 123 123 SER C C 13 176.160 0.3 . 1 . . . . . 122 SER C . 50277 1 487 . 1 . 1 123 123 SER CA C 13 60.179 0.3 . 1 . . . . . 122 SER CA . 50277 1 488 . 1 . 1 123 123 SER CB C 13 60.859 0.3 . 1 . . . . . 122 SER CB . 50277 1 489 . 1 . 1 123 123 SER N N 15 113.858 0.3 . 1 . . . . . 122 SER N . 50277 1 490 . 1 . 1 124 124 THR H H 1 7.825 0.020 . 1 . . . . . 123 THR H . 50277 1 491 . 1 . 1 124 124 THR C C 13 177.286 0.3 . 1 . . . . . 123 THR C . 50277 1 492 . 1 . 1 124 124 THR CA C 13 66.096 0.3 . 1 . . . . . 123 THR CA . 50277 1 493 . 1 . 1 124 124 THR CB C 13 68.483 0.3 . 1 . . . . . 123 THR CB . 50277 1 494 . 1 . 1 124 124 THR N N 15 116.940 0.3 . 1 . . . . . 123 THR N . 50277 1 495 . 1 . 1 125 125 LEU H H 1 7.457 0.020 . 1 . . . . . 124 LEU H . 50277 1 496 . 1 . 1 125 125 LEU C C 13 178.635 0.3 . 1 . . . . . 124 LEU C . 50277 1 497 . 1 . 1 125 125 LEU CA C 13 58.075 0.3 . 1 . . . . . 124 LEU CA . 50277 1 498 . 1 . 1 125 125 LEU CB C 13 41.617 0.3 . 1 . . . . . 124 LEU CB . 50277 1 499 . 1 . 1 125 125 LEU N N 15 123.300 0.3 . 1 . . . . . 124 LEU N . 50277 1 500 . 1 . 1 126 126 ILE H H 1 8.394 0.020 . 1 . . . . . 125 ILE H . 50277 1 501 . 1 . 1 126 126 ILE C C 13 177.594 0.3 . 1 . . . . . 125 ILE C . 50277 1 502 . 1 . 1 126 126 ILE CA C 13 61.351 0.3 . 1 . . . . . 125 ILE CA . 50277 1 503 . 1 . 1 126 126 ILE CB C 13 34.016 0.3 . 1 . . . . . 125 ILE CB . 50277 1 504 . 1 . 1 126 126 ILE N N 15 119.052 0.3 . 1 . . . . . 125 ILE N . 50277 1 505 . 1 . 1 127 127 ARG H H 1 9.112 0.020 . 1 . . . . . 126 ARG H . 50277 1 506 . 1 . 1 127 127 ARG C C 13 178.597 0.3 . 1 . . . . . 126 ARG C . 50277 1 507 . 1 . 1 127 127 ARG CA C 13 60.180 0.3 . 1 . . . . . 126 ARG CA . 50277 1 508 . 1 . 1 127 127 ARG CB C 13 28.985 0.3 . 1 . . . . . 126 ARG CB . 50277 1 509 . 1 . 1 127 127 ARG N N 15 122.190 0.3 . 1 . . . . . 126 ARG N . 50277 1 510 . 1 . 1 128 128 GLN H H 1 7.026 0.020 . 1 . . . . . 127 GLN H . 50277 1 511 . 1 . 1 128 128 GLN C C 13 177.578 0.3 . 1 . . . . . 127 GLN C . 50277 1 512 . 1 . 1 128 128 GLN CA C 13 58.832 0.3 . 1 . . . . . 127 GLN CA . 50277 1 513 . 1 . 1 128 128 GLN CB C 13 30.301 0.3 . 1 . . . . . 127 GLN CB . 50277 1 514 . 1 . 1 128 128 GLN N N 15 117.457 0.3 . 1 . . . . . 127 GLN N . 50277 1 515 . 1 . 1 129 129 VAL H H 1 7.490 0.020 . 1 . . . . . 128 VAL H . 50277 1 516 . 1 . 1 129 129 VAL C C 13 177.629 0.3 . 1 . . . . . 128 VAL C . 50277 1 517 . 1 . 1 129 129 VAL CA C 13 66.569 0.3 . 1 . . . . . 128 VAL CA . 50277 1 518 . 1 . 1 129 129 VAL CB C 13 30.675 0.3 . 1 . . . . . 128 VAL CB . 50277 1 519 . 1 . 1 129 129 VAL N N 15 118.829 0.3 . 1 . . . . . 128 VAL N . 50277 1 520 . 1 . 1 130 130 LEU H H 1 9.101 0.020 . 1 . . . . . 129 LEU H . 50277 1 521 . 1 . 1 130 130 LEU C C 13 178.445 0.3 . 1 . . . . . 129 LEU C . 50277 1 522 . 1 . 1 130 130 LEU CA C 13 57.608 0.3 . 1 . . . . . 129 LEU CA . 50277 1 523 . 1 . 1 130 130 LEU CB C 13 41.994 0.3 . 1 . . . . . 129 LEU CB . 50277 1 524 . 1 . 1 130 130 LEU N N 15 118.384 0.3 . 1 . . . . . 129 LEU N . 50277 1 525 . 1 . 1 131 131 ASP H H 1 7.859 0.020 . 1 . . . . . 130 ASP H . 50277 1 526 . 1 . 1 131 131 ASP C C 13 178.583 0.3 . 1 . . . . . 130 ASP C . 50277 1 527 . 1 . 1 131 131 ASP CA C 13 57.467 0.3 . 1 . . . . . 130 ASP CA . 50277 1 528 . 1 . 1 131 131 ASP CB C 13 41.373 0.3 . 1 . . . . . 130 ASP CB . 50277 1 529 . 1 . 1 131 131 ASP N N 15 120.032 0.3 . 1 . . . . . 130 ASP N . 50277 1 530 . 1 . 1 132 132 ALA H H 1 7.754 0.020 . 1 . . . . . 131 ALA H . 50277 1 531 . 1 . 1 132 132 ALA C C 13 178.634 0.3 . 1 . . . . . 131 ALA C . 50277 1 532 . 1 . 1 132 132 ALA CA C 13 54.081 0.3 . 1 . . . . . 131 ALA CA . 50277 1 533 . 1 . 1 132 132 ALA CB C 13 18.740 0.3 . 1 . . . . . 131 ALA CB . 50277 1 534 . 1 . 1 132 132 ALA N N 15 121.891 0.3 . 1 . . . . . 131 ALA N . 50277 1 535 . 1 . 1 133 133 VAL H H 1 8.658 0.020 . 1 . . . . . 132 VAL H . 50277 1 536 . 1 . 1 133 133 VAL C C 13 176.413 0.3 . 1 . . . . . 132 VAL C . 50277 1 537 . 1 . 1 133 133 VAL CA C 13 65.917 0.3 . 1 . . . . . 132 VAL CA . 50277 1 538 . 1 . 1 133 133 VAL CB C 13 29.402 0.3 . 1 . . . . . 132 VAL CB . 50277 1 539 . 1 . 1 133 133 VAL N N 15 117.882 0.3 . 1 . . . . . 132 VAL N . 50277 1 540 . 1 . 1 134 134 TYR H H 1 8.895 0.020 . 1 . . . . . 133 TYR H . 50277 1 541 . 1 . 1 134 134 TYR C C 13 177.573 0.3 . 1 . . . . . 133 TYR C . 50277 1 542 . 1 . 1 134 134 TYR CA C 13 58.999 0.3 . 1 . . . . . 133 TYR CA . 50277 1 543 . 1 . 1 134 134 TYR CB C 13 37.202 0.3 . 1 . . . . . 133 TYR CB . 50277 1 544 . 1 . 1 134 134 TYR N N 15 122.253 0.3 . 1 . . . . . 133 TYR N . 50277 1 545 . 1 . 1 135 135 TYR H H 1 7.484 0.020 . 1 . . . . . 134 TYR H . 50277 1 546 . 1 . 1 135 135 TYR C C 13 177.276 0.3 . 1 . . . . . 134 TYR C . 50277 1 547 . 1 . 1 135 135 TYR CA C 13 61.365 0.3 . 1 . . . . . 134 TYR CA . 50277 1 548 . 1 . 1 135 135 TYR CB C 13 37.078 0.3 . 1 . . . . . 134 TYR CB . 50277 1 549 . 1 . 1 135 135 TYR N N 15 119.700 0.3 . 1 . . . . . 134 TYR N . 50277 1 550 . 1 . 1 136 136 LEU H H 1 7.785 0.020 . 1 . . . . . 135 LEU H . 50277 1 551 . 1 . 1 136 136 LEU C C 13 179.489 0.3 . 1 . . . . . 135 LEU C . 50277 1 552 . 1 . 1 136 136 LEU CA C 13 57.777 0.3 . 1 . . . . . 135 LEU CA . 50277 1 553 . 1 . 1 136 136 LEU CB C 13 39.142 0.3 . 1 . . . . . 135 LEU CB . 50277 1 554 . 1 . 1 136 136 LEU N N 15 119.954 0.3 . 1 . . . . . 135 LEU N . 50277 1 555 . 1 . 1 137 137 HIS H H 1 9.407 0.020 . 1 . . . . . 136 HIS H . 50277 1 556 . 1 . 1 137 137 HIS C C 13 181.194 0.3 . 1 . . . . . 136 HIS C . 50277 1 557 . 1 . 1 137 137 HIS CA C 13 57.810 0.3 . 1 . . . . . 136 HIS CA . 50277 1 558 . 1 . 1 137 137 HIS CB C 13 30.768 0.3 . 1 . . . . . 136 HIS CB . 50277 1 559 . 1 . 1 137 137 HIS N N 15 121.229 0.3 . 1 . . . . . 136 HIS N . 50277 1 560 . 1 . 1 138 138 ARG H H 1 8.611 0.020 . 1 . . . . . 137 ARG H . 50277 1 561 . 1 . 1 138 138 ARG C C 13 178.444 0.3 . 1 . . . . . 137 ARG C . 50277 1 562 . 1 . 1 138 138 ARG CA C 13 58.874 0.3 . 1 . . . . . 137 ARG CA . 50277 1 563 . 1 . 1 138 138 ARG CB C 13 28.935 0.3 . 1 . . . . . 137 ARG CB . 50277 1 564 . 1 . 1 138 138 ARG N N 15 122.507 0.3 . 1 . . . . . 137 ARG N . 50277 1 565 . 1 . 1 139 139 MET H H 1 7.494 0.020 . 1 . . . . . 138 MET H . 50277 1 566 . 1 . 1 139 139 MET C C 13 176.078 0.3 . 1 . . . . . 138 MET C . 50277 1 567 . 1 . 1 139 139 MET CA C 13 54.574 0.3 . 1 . . . . . 138 MET CA . 50277 1 568 . 1 . 1 139 139 MET CB C 13 31.880 0.3 . 1 . . . . . 138 MET CB . 50277 1 569 . 1 . 1 139 139 MET N N 15 117.318 0.3 . 1 . . . . . 138 MET N . 50277 1 570 . 1 . 1 140 140 GLY H H 1 7.888 0.020 . 1 . . . . . 139 GLY H . 50277 1 571 . 1 . 1 140 140 GLY C C 13 173.779 0.3 . 1 . . . . . 139 GLY C . 50277 1 572 . 1 . 1 140 140 GLY CA C 13 45.365 0.3 . 1 . . . . . 139 GLY CA . 50277 1 573 . 1 . 1 140 140 GLY N N 15 108.330 0.3 . 1 . . . . . 139 GLY N . 50277 1 574 . 1 . 1 141 141 ILE H H 1 8.218 0.020 . 1 . . . . . 140 ILE H . 50277 1 575 . 1 . 1 141 141 ILE C C 13 173.316 0.3 . 1 . . . . . 140 ILE C . 50277 1 576 . 1 . 1 141 141 ILE CA C 13 59.830 0.3 . 1 . . . . . 140 ILE CA . 50277 1 577 . 1 . 1 141 141 ILE CB C 13 38.579 0.3 . 1 . . . . . 140 ILE CB . 50277 1 578 . 1 . 1 141 141 ILE N N 15 124.395 0.3 . 1 . . . . . 140 ILE N . 50277 1 579 . 1 . 1 142 142 VAL C C 13 177.955 0.3 . 1 . . . . . 141 VAL C . 50277 1 580 . 1 . 1 142 142 VAL CA C 13 61.636 0.3 . 1 . . . . . 141 VAL CA . 50277 1 581 . 1 . 1 142 142 VAL CB C 13 30.718 0.3 . 1 . . . . . 141 VAL CB . 50277 1 582 . 1 . 1 143 143 HIS H H 1 8.178 0.020 . 1 . . . . . 142 HIS H . 50277 1 583 . 1 . 1 143 143 HIS C C 13 179.558 0.3 . 1 . . . . . 142 HIS C . 50277 1 584 . 1 . 1 143 143 HIS CA C 13 59.492 0.3 . 1 . . . . . 142 HIS CA . 50277 1 585 . 1 . 1 143 143 HIS CB C 13 31.272 0.3 . 1 . . . . . 142 HIS CB . 50277 1 586 . 1 . 1 143 143 HIS N N 15 125.529 0.3 . 1 . . . . . 142 HIS N . 50277 1 587 . 1 . 1 145 145 ASP C C 13 175.437 0.3 . 1 . . . . . 144 ASP C . 50277 1 588 . 1 . 1 145 145 ASP CA C 13 52.859 0.3 . 1 . . . . . 144 ASP CA . 50277 1 589 . 1 . 1 145 145 ASP CB C 13 42.609 0.3 . 1 . . . . . 144 ASP CB . 50277 1 590 . 1 . 1 146 146 LEU H H 1 8.476 0.020 . 1 . . . . . 145 LEU H . 50277 1 591 . 1 . 1 146 146 LEU C C 13 175.209 0.3 . 1 . . . . . 145 LEU C . 50277 1 592 . 1 . 1 146 146 LEU CA C 13 55.833 0.3 . 1 . . . . . 145 LEU CA . 50277 1 593 . 1 . 1 146 146 LEU CB C 13 40.770 0.3 . 1 . . . . . 145 LEU CB . 50277 1 594 . 1 . 1 146 146 LEU N N 15 123.702 0.3 . 1 . . . . . 145 LEU N . 50277 1 595 . 1 . 1 148 148 PRO C C 13 176.963 0.3 . 1 . . . . . 147 PRO C . 50277 1 596 . 1 . 1 149 149 GLU H H 1 9.586 0.020 . 1 . . . . . 148 GLU H . 50277 1 597 . 1 . 1 149 149 GLU C C 13 176.262 0.3 . 1 . . . . . 148 GLU C . 50277 1 598 . 1 . 1 149 149 GLU CA C 13 58.635 0.3 . 1 . . . . . 148 GLU CA . 50277 1 599 . 1 . 1 149 149 GLU CB C 13 28.193 0.3 . 1 . . . . . 148 GLU CB . 50277 1 600 . 1 . 1 149 149 GLU N N 15 114.802 0.3 . 1 . . . . . 148 GLU N . 50277 1 601 . 1 . 1 150 150 ASN H H 1 7.338 0.020 . 1 . . . . . 149 ASN H . 50277 1 602 . 1 . 1 150 150 ASN C C 13 173.285 0.3 . 1 . . . . . 149 ASN C . 50277 1 603 . 1 . 1 150 150 ASN CA C 13 51.914 0.3 . 1 . . . . . 149 ASN CA . 50277 1 604 . 1 . 1 150 150 ASN CB C 13 38.440 0.3 . 1 . . . . . 149 ASN CB . 50277 1 605 . 1 . 1 150 150 ASN N N 15 114.986 0.3 . 1 . . . . . 149 ASN N . 50277 1 606 . 1 . 1 151 151 LEU H H 1 7.289 0.020 . 1 . . . . . 150 LEU H . 50277 1 607 . 1 . 1 151 151 LEU C C 13 173.585 0.3 . 1 . . . . . 150 LEU C . 50277 1 608 . 1 . 1 151 151 LEU CA C 13 53.144 0.3 . 1 . . . . . 150 LEU CA . 50277 1 609 . 1 . 1 151 151 LEU CB C 13 40.649 0.3 . 1 . . . . . 150 LEU CB . 50277 1 610 . 1 . 1 151 151 LEU N N 15 121.731 0.3 . 1 . . . . . 150 LEU N . 50277 1 611 . 1 . 1 152 152 LEU H H 1 8.286 0.020 . 1 . . . . . 151 LEU H . 50277 1 612 . 1 . 1 152 152 LEU C C 13 177.043 0.3 . 1 . . . . . 151 LEU C . 50277 1 613 . 1 . 1 152 152 LEU CA C 13 51.915 0.3 . 1 . . . . . 151 LEU CA . 50277 1 614 . 1 . 1 152 152 LEU CB C 13 45.572 0.3 . 1 . . . . . 151 LEU CB . 50277 1 615 . 1 . 1 152 152 LEU N N 15 121.399 0.3 . 1 . . . . . 151 LEU N . 50277 1 616 . 1 . 1 153 153 TYR H H 1 8.822 0.020 . 1 . . . . . 152 TYR H . 50277 1 617 . 1 . 1 153 153 TYR C C 13 176.174 0.3 . 1 . . . . . 152 TYR C . 50277 1 618 . 1 . 1 153 153 TYR CA C 13 58.998 0.3 . 1 . . . . . 152 TYR CA . 50277 1 619 . 1 . 1 153 153 TYR CB C 13 38.171 0.3 . 1 . . . . . 152 TYR CB . 50277 1 620 . 1 . 1 153 153 TYR N N 15 120.307 0.3 . 1 . . . . . 152 TYR N . 50277 1 621 . 1 . 1 154 154 TYR H H 1 7.954 0.020 . 1 . . . . . 153 TYR H . 50277 1 622 . 1 . 1 154 154 TYR C C 13 175.634 0.3 . 1 . . . . . 153 TYR C . 50277 1 623 . 1 . 1 154 154 TYR CA C 13 60.611 0.3 . 1 . . . . . 153 TYR CA . 50277 1 624 . 1 . 1 154 154 TYR CB C 13 39.038 0.3 . 1 . . . . . 153 TYR CB . 50277 1 625 . 1 . 1 154 154 TYR N N 15 121.624 0.3 . 1 . . . . . 153 TYR N . 50277 1 626 . 1 . 1 155 155 SER H H 1 9.348 0.020 . 1 . . . . . 154 SER H . 50277 1 627 . 1 . 1 155 155 SER C C 13 173.921 0.3 . 1 . . . . . 154 SER C . 50277 1 628 . 1 . 1 155 155 SER CA C 13 56.033 0.3 . 1 . . . . . 154 SER CA . 50277 1 629 . 1 . 1 155 155 SER CB C 13 66.171 0.3 . 1 . . . . . 154 SER CB . 50277 1 630 . 1 . 1 155 155 SER N N 15 113.812 0.3 . 1 . . . . . 154 SER N . 50277 1 631 . 1 . 1 156 156 GLN H H 1 8.621 0.020 . 1 . . . . . 155 GLN H . 50277 1 632 . 1 . 1 156 156 GLN C C 13 175.302 0.3 . 1 . . . . . 155 GLN C . 50277 1 633 . 1 . 1 156 156 GLN CA C 13 56.321 0.3 . 1 . . . . . 155 GLN CA . 50277 1 634 . 1 . 1 156 156 GLN CB C 13 27.802 0.3 . 1 . . . . . 155 GLN CB . 50277 1 635 . 1 . 1 156 156 GLN N N 15 118.015 0.3 . 1 . . . . . 155 GLN N . 50277 1 636 . 1 . 1 157 157 ASP H H 1 7.862 0.020 . 1 . . . . . 156 ASP H . 50277 1 637 . 1 . 1 157 157 ASP C C 13 177.625 0.3 . 1 . . . . . 156 ASP C . 50277 1 638 . 1 . 1 157 157 ASP CA C 13 54.510 0.3 . 1 . . . . . 156 ASP CA . 50277 1 639 . 1 . 1 157 157 ASP CB C 13 41.188 0.3 . 1 . . . . . 156 ASP CB . 50277 1 640 . 1 . 1 157 157 ASP N N 15 119.548 0.3 . 1 . . . . . 156 ASP N . 50277 1 641 . 1 . 1 158 158 GLU H H 1 8.947 0.020 . 1 . . . . . 157 GLU H . 50277 1 642 . 1 . 1 158 158 GLU C C 13 177.863 0.3 . 1 . . . . . 157 GLU C . 50277 1 643 . 1 . 1 158 158 GLU CA C 13 58.693 0.3 . 1 . . . . . 157 GLU CA . 50277 1 644 . 1 . 1 158 158 GLU CB C 13 28.872 0.3 . 1 . . . . . 157 GLU CB . 50277 1 645 . 1 . 1 158 158 GLU N N 15 125.785 0.3 . 1 . . . . . 157 GLU N . 50277 1 646 . 1 . 1 159 159 GLU H H 1 8.625 0.020 . 1 . . . . . 158 GLU H . 50277 1 647 . 1 . 1 159 159 GLU C C 13 175.745 0.3 . 1 . . . . . 158 GLU C . 50277 1 648 . 1 . 1 159 159 GLU CA C 13 55.190 0.3 . 1 . . . . . 158 GLU CA . 50277 1 649 . 1 . 1 159 159 GLU CB C 13 27.817 0.3 . 1 . . . . . 158 GLU CB . 50277 1 650 . 1 . 1 159 159 GLU N N 15 117.492 0.3 . 1 . . . . . 158 GLU N . 50277 1 651 . 1 . 1 160 160 SER H H 1 7.236 0.020 . 1 . . . . . 159 SER H . 50277 1 652 . 1 . 1 160 160 SER C C 13 175.366 0.3 . 1 . . . . . 159 SER C . 50277 1 653 . 1 . 1 160 160 SER CA C 13 58.151 0.3 . 1 . . . . . 159 SER CA . 50277 1 654 . 1 . 1 160 160 SER CB C 13 64.403 0.3 . 1 . . . . . 159 SER CB . 50277 1 655 . 1 . 1 160 160 SER N N 15 113.430 0.3 . 1 . . . . . 159 SER N . 50277 1 656 . 1 . 1 161 161 LYS H H 1 8.485 0.020 . 1 . . . . . 160 LYS H . 50277 1 657 . 1 . 1 161 161 LYS C C 13 175.787 0.3 . 1 . . . . . 160 LYS C . 50277 1 658 . 1 . 1 161 161 LYS CA C 13 55.818 0.3 . 1 . . . . . 160 LYS CA . 50277 1 659 . 1 . 1 161 161 LYS CB C 13 32.820 0.3 . 1 . . . . . 160 LYS CB . 50277 1 660 . 1 . 1 161 161 LYS N N 15 126.337 0.3 . 1 . . . . . 160 LYS N . 50277 1 661 . 1 . 1 162 162 ILE H H 1 8.271 0.020 . 1 . . . . . 161 ILE H . 50277 1 662 . 1 . 1 162 162 ILE C C 13 172.713 0.3 . 1 . . . . . 161 ILE C . 50277 1 663 . 1 . 1 162 162 ILE CA C 13 56.289 0.3 . 1 . . . . . 161 ILE CA . 50277 1 664 . 1 . 1 162 162 ILE CB C 13 40.379 0.3 . 1 . . . . . 161 ILE CB . 50277 1 665 . 1 . 1 162 162 ILE N N 15 122.157 0.3 . 1 . . . . . 161 ILE N . 50277 1 666 . 1 . 1 163 163 MET H H 1 8.765 0.020 . 1 . . . . . 162 MET H . 50277 1 667 . 1 . 1 163 163 MET C C 13 175.759 0.3 . 1 . . . . . 162 MET C . 50277 1 668 . 1 . 1 163 163 MET CA C 13 52.316 0.3 . 1 . . . . . 162 MET CA . 50277 1 669 . 1 . 1 163 163 MET CB C 13 34.877 0.3 . 1 . . . . . 162 MET CB . 50277 1 670 . 1 . 1 163 163 MET N N 15 120.235 0.3 . 1 . . . . . 162 MET N . 50277 1 671 . 1 . 1 164 164 ILE H H 1 8.713 0.020 . 1 . . . . . 163 ILE H . 50277 1 672 . 1 . 1 164 164 ILE C C 13 176.519 0.3 . 1 . . . . . 163 ILE C . 50277 1 673 . 1 . 1 164 164 ILE CA C 13 61.638 0.3 . 1 . . . . . 163 ILE CA . 50277 1 674 . 1 . 1 164 164 ILE CB C 13 37.431 0.3 . 1 . . . . . 163 ILE CB . 50277 1 675 . 1 . 1 164 164 ILE N N 15 121.189 0.3 . 1 . . . . . 163 ILE N . 50277 1 676 . 1 . 1 170 170 SER C C 13 179.850 0.3 . 1 . . . . . 169 SER C . 50277 1 677 . 1 . 1 170 170 SER CA C 13 61.571 0.3 . 1 . . . . . 169 SER CA . 50277 1 678 . 1 . 1 171 171 LYS H H 1 8.052 0.020 . 1 . . . . . 170 LYS H . 50277 1 679 . 1 . 1 171 171 LYS C C 13 176.796 0.3 . 1 . . . . . 170 LYS C . 50277 1 680 . 1 . 1 171 171 LYS CA C 13 57.744 0.3 . 1 . . . . . 170 LYS CA . 50277 1 681 . 1 . 1 171 171 LYS CB C 13 29.442 0.3 . 1 . . . . . 170 LYS CB . 50277 1 682 . 1 . 1 171 171 LYS N N 15 115.940 0.3 . 1 . . . . . 170 LYS N . 50277 1 683 . 1 . 1 172 172 MET H H 1 7.491 0.020 . 1 . . . . . 171 MET H . 50277 1 684 . 1 . 1 172 172 MET C C 13 177.342 0.3 . 1 . . . . . 171 MET C . 50277 1 685 . 1 . 1 172 172 MET CA C 13 55.889 0.3 . 1 . . . . . 171 MET CA . 50277 1 686 . 1 . 1 172 172 MET CB C 13 32.443 0.3 . 1 . . . . . 171 MET CB . 50277 1 687 . 1 . 1 172 172 MET N N 15 117.066 0.3 . 1 . . . . . 171 MET N . 50277 1 688 . 1 . 1 173 173 GLU C C 13 174.534 0.3 . 1 . . . . . 172 GLU C . 50277 1 689 . 1 . 1 173 173 GLU CA C 13 57.757 0.3 . 1 . . . . . 172 GLU CA . 50277 1 690 . 1 . 1 173 173 GLU CB C 13 28.147 0.3 . 1 . . . . . 172 GLU CB . 50277 1 691 . 1 . 1 174 174 GLY H H 1 8.212 0.020 . 1 . . . . . 173 GLY H . 50277 1 692 . 1 . 1 174 174 GLY C C 13 173.746 0.3 . 1 . . . . . 173 GLY C . 50277 1 693 . 1 . 1 174 174 GLY CA C 13 44.691 0.3 . 1 . . . . . 173 GLY CA . 50277 1 694 . 1 . 1 174 174 GLY N N 15 110.802 0.3 . 1 . . . . . 173 GLY N . 50277 1 695 . 1 . 1 175 175 LYS C C 13 177.081 0.3 . 1 . . . . . 174 LYS C . 50277 1 696 . 1 . 1 175 175 LYS CA C 13 55.858 0.3 . 1 . . . . . 174 LYS CA . 50277 1 697 . 1 . 1 175 175 LYS CB C 13 31.977 0.3 . 1 . . . . . 174 LYS CB . 50277 1 698 . 1 . 1 176 176 GLY H H 1 8.407 0.020 . 1 . . . . . 175 GLY H . 50277 1 699 . 1 . 1 176 176 GLY C C 13 173.769 0.3 . 1 . . . . . 175 GLY C . 50277 1 700 . 1 . 1 176 176 GLY CA C 13 44.942 0.3 . 1 . . . . . 175 GLY CA . 50277 1 701 . 1 . 1 176 176 GLY N N 15 110.252 0.3 . 1 . . . . . 175 GLY N . 50277 1 702 . 1 . 1 177 177 ASP H H 1 8.137 0.020 . 1 . . . . . 176 ASP H . 50277 1 703 . 1 . 1 177 177 ASP C C 13 176.356 0.3 . 1 . . . . . 176 ASP C . 50277 1 704 . 1 . 1 177 177 ASP CA C 13 53.825 0.3 . 1 . . . . . 176 ASP CA . 50277 1 705 . 1 . 1 177 177 ASP CB C 13 40.734 0.3 . 1 . . . . . 176 ASP CB . 50277 1 706 . 1 . 1 177 177 ASP N N 15 120.890 0.3 . 1 . . . . . 176 ASP N . 50277 1 707 . 1 . 1 178 178 VAL H H 1 8.054 0.020 . 1 . . . . . 177 VAL H . 50277 1 708 . 1 . 1 178 178 VAL CA C 13 62.032 0.3 . 1 . . . . . 177 VAL CA . 50277 1 709 . 1 . 1 178 178 VAL CB C 13 31.934 0.3 . 1 . . . . . 177 VAL CB . 50277 1 710 . 1 . 1 178 178 VAL N N 15 120.212 0.3 . 1 . . . . . 177 VAL N . 50277 1 711 . 1 . 1 183 183 CYS C C 13 177.119 0.3 . 1 . . . . . 182 CYS C . 50277 1 712 . 1 . 1 184 184 GLY H H 1 8.592 0.020 . 1 . . . . . 183 GLY H . 50277 1 713 . 1 . 1 184 184 GLY C C 13 174.289 0.3 . 1 . . . . . 183 GLY C . 50277 1 714 . 1 . 1 184 184 GLY CA C 13 44.916 0.3 . 1 . . . . . 183 GLY CA . 50277 1 715 . 1 . 1 184 184 GLY N N 15 109.781 0.3 . 1 . . . . . 183 GLY N . 50277 1 716 . 1 . 1 185 185 THR H H 1 8.792 0.020 . 1 . . . . . 184 THR H . 50277 1 717 . 1 . 1 185 185 THR C C 13 174.732 0.3 . 1 . . . . . 184 THR C . 50277 1 718 . 1 . 1 185 185 THR CA C 13 57.751 0.3 . 1 . . . . . 184 THR CA . 50277 1 719 . 1 . 1 185 185 THR CB C 13 65.427 0.3 . 1 . . . . . 184 THR CB . 50277 1 720 . 1 . 1 185 185 THR N N 15 118.044 0.3 . 1 . . . . . 184 THR N . 50277 1 721 . 1 . 1 188 188 TYR C C 13 175.311 0.3 . 1 . . . . . 187 TYR C . 50277 1 722 . 1 . 1 188 188 TYR CA C 13 56.872 0.3 . 1 . . . . . 187 TYR CA . 50277 1 723 . 1 . 1 188 188 TYR CB C 13 38.574 0.3 . 1 . . . . . 187 TYR CB . 50277 1 724 . 1 . 1 189 189 VAL H H 1 7.436 0.020 . 1 . . . . . 188 VAL H . 50277 1 725 . 1 . 1 189 189 VAL C C 13 173.428 0.3 . 1 . . . . . 188 VAL C . 50277 1 726 . 1 . 1 189 189 VAL CA C 13 61.249 0.3 . 1 . . . . . 188 VAL CA . 50277 1 727 . 1 . 1 189 189 VAL CB C 13 32.116 0.3 . 1 . . . . . 188 VAL CB . 50277 1 728 . 1 . 1 189 189 VAL N N 15 121.202 0.3 . 1 . . . . . 188 VAL N . 50277 1 729 . 1 . 1 190 190 ALA H H 1 7.597 0.020 . 1 . . . . . 189 ALA H . 50277 1 730 . 1 . 1 190 190 ALA C C 13 175.899 0.3 . 1 . . . . . 189 ALA C . 50277 1 731 . 1 . 1 190 190 ALA CA C 13 49.095 0.3 . 1 . . . . . 189 ALA CA . 50277 1 732 . 1 . 1 190 190 ALA CB C 13 17.539 0.3 . 1 . . . . . 189 ALA CB . 50277 1 733 . 1 . 1 190 190 ALA N N 15 125.163 0.3 . 1 . . . . . 189 ALA N . 50277 1 734 . 1 . 1 191 191 PRO C C 13 178.193 0.3 . 1 . . . . . 190 PRO C . 50277 1 735 . 1 . 1 191 191 PRO CA C 13 64.524 0.3 . 1 . . . . . 190 PRO CA . 50277 1 736 . 1 . 1 191 191 PRO CB C 13 30.560 0.3 . 1 . . . . . 190 PRO CB . 50277 1 737 . 1 . 1 192 192 GLU H H 1 9.808 0.020 . 1 . . . . . 191 GLU H . 50277 1 738 . 1 . 1 192 192 GLU C C 13 177.131 0.3 . 1 . . . . . 191 GLU C . 50277 1 739 . 1 . 1 192 192 GLU CA C 13 58.496 0.3 . 1 . . . . . 191 GLU CA . 50277 1 740 . 1 . 1 192 192 GLU CB C 13 25.544 0.3 . 1 . . . . . 191 GLU CB . 50277 1 741 . 1 . 1 192 192 GLU N N 15 115.450 0.3 . 1 . . . . . 191 GLU N . 50277 1 742 . 1 . 1 193 193 VAL H H 1 6.906 0.020 . 1 . . . . . 192 VAL H . 50277 1 743 . 1 . 1 193 193 VAL C C 13 180.729 0.3 . 1 . . . . . 192 VAL C . 50277 1 744 . 1 . 1 193 193 VAL CA C 13 64.434 0.3 . 1 . . . . . 192 VAL CA . 50277 1 745 . 1 . 1 193 193 VAL CB C 13 30.233 0.3 . 1 . . . . . 192 VAL CB . 50277 1 746 . 1 . 1 193 193 VAL N N 15 120.984 0.3 . 1 . . . . . 192 VAL N . 50277 1 747 . 1 . 1 194 194 LEU H H 1 6.843 0.020 . 1 . . . . . 193 LEU H . 50277 1 748 . 1 . 1 194 194 LEU C C 13 178.388 0.3 . 1 . . . . . 193 LEU C . 50277 1 749 . 1 . 1 194 194 LEU CA C 13 56.758 0.3 . 1 . . . . . 193 LEU CA . 50277 1 750 . 1 . 1 194 194 LEU CB C 13 39.166 0.3 . 1 . . . . . 193 LEU CB . 50277 1 751 . 1 . 1 194 194 LEU N N 15 121.679 0.3 . 1 . . . . . 193 LEU N . 50277 1 752 . 1 . 1 195 195 ALA H H 1 7.745 0.020 . 1 . . . . . 194 ALA H . 50277 1 753 . 1 . 1 195 195 ALA C C 13 175.713 0.3 . 1 . . . . . 194 ALA C . 50277 1 754 . 1 . 1 195 195 ALA CA C 13 51.543 0.3 . 1 . . . . . 194 ALA CA . 50277 1 755 . 1 . 1 195 195 ALA CB C 13 17.945 0.3 . 1 . . . . . 194 ALA CB . 50277 1 756 . 1 . 1 195 195 ALA N N 15 119.203 0.3 . 1 . . . . . 194 ALA N . 50277 1 757 . 1 . 1 196 196 GLN H H 1 7.699 0.020 . 1 . . . . . 195 GLN H . 50277 1 758 . 1 . 1 196 196 GLN C C 13 175.297 0.3 . 1 . . . . . 195 GLN C . 50277 1 759 . 1 . 1 196 196 GLN CA C 13 56.362 0.3 . 1 . . . . . 195 GLN CA . 50277 1 760 . 1 . 1 196 196 GLN CB C 13 24.729 0.3 . 1 . . . . . 195 GLN CB . 50277 1 761 . 1 . 1 196 196 GLN N N 15 112.920 0.3 . 1 . . . . . 195 GLN N . 50277 1 762 . 1 . 1 197 197 LYS H H 1 7.859 0.020 . 1 . . . . . 196 LYS H . 50277 1 763 . 1 . 1 197 197 LYS C C 13 173.996 0.3 . 1 . . . . . 196 LYS C . 50277 1 764 . 1 . 1 197 197 LYS CA C 13 53.227 0.3 . 1 . . . . . 196 LYS CA . 50277 1 765 . 1 . 1 197 197 LYS CB C 13 30.689 0.3 . 1 . . . . . 196 LYS CB . 50277 1 766 . 1 . 1 197 197 LYS N N 15 119.474 0.3 . 1 . . . . . 196 LYS N . 50277 1 767 . 1 . 1 198 198 PRO C C 13 176.455 0.3 . 1 . . . . . 197 PRO C . 50277 1 768 . 1 . 1 198 198 PRO CA C 13 62.574 0.3 . 1 . . . . . 197 PRO CA . 50277 1 769 . 1 . 1 198 198 PRO CB C 13 30.945 0.3 . 1 . . . . . 197 PRO CB . 50277 1 770 . 1 . 1 199 199 TYR H H 1 7.880 0.020 . 1 . . . . . 198 TYR H . 50277 1 771 . 1 . 1 199 199 TYR C C 13 174.228 0.3 . 1 . . . . . 198 TYR C . 50277 1 772 . 1 . 1 199 199 TYR CA C 13 56.803 0.3 . 1 . . . . . 198 TYR CA . 50277 1 773 . 1 . 1 199 199 TYR CB C 13 39.190 0.3 . 1 . . . . . 198 TYR CB . 50277 1 774 . 1 . 1 199 199 TYR N N 15 119.098 0.3 . 1 . . . . . 198 TYR N . 50277 1 775 . 1 . 1 201 201 LYS C C 13 175.744 0.3 . 1 . . . . . 200 LYS C . 50277 1 776 . 1 . 1 201 201 LYS CA C 13 58.835 0.3 . 1 . . . . . 200 LYS CA . 50277 1 777 . 1 . 1 201 201 LYS CB C 13 30.474 0.3 . 1 . . . . . 200 LYS CB . 50277 1 778 . 1 . 1 202 202 ALA H H 1 7.905 0.020 . 1 . . . . . 201 ALA H . 50277 1 779 . 1 . 1 202 202 ALA C C 13 182.667 0.3 . 1 . . . . . 201 ALA C . 50277 1 780 . 1 . 1 202 202 ALA CA C 13 54.293 0.3 . 1 . . . . . 201 ALA CA . 50277 1 781 . 1 . 1 202 202 ALA CB C 13 18.427 0.3 . 1 . . . . . 201 ALA CB . 50277 1 782 . 1 . 1 202 202 ALA N N 15 120.871 0.3 . 1 . . . . . 201 ALA N . 50277 1 783 . 1 . 1 203 203 VAL H H 1 8.370 0.020 . 1 . . . . . 202 VAL H . 50277 1 784 . 1 . 1 203 203 VAL C C 13 178.558 0.3 . 1 . . . . . 202 VAL C . 50277 1 785 . 1 . 1 203 203 VAL CA C 13 65.139 0.3 . 1 . . . . . 202 VAL CA . 50277 1 786 . 1 . 1 203 203 VAL CB C 13 33.249 0.3 . 1 . . . . . 202 VAL CB . 50277 1 787 . 1 . 1 203 203 VAL N N 15 118.324 0.3 . 1 . . . . . 202 VAL N . 50277 1 788 . 1 . 1 204 204 ASP H H 1 7.772 0.020 . 1 . . . . . 203 ASP H . 50277 1 789 . 1 . 1 204 204 ASP C C 13 178.123 0.3 . 1 . . . . . 203 ASP C . 50277 1 790 . 1 . 1 204 204 ASP CA C 13 56.485 0.3 . 1 . . . . . 203 ASP CA . 50277 1 791 . 1 . 1 204 204 ASP CB C 13 40.652 0.3 . 1 . . . . . 203 ASP CB . 50277 1 792 . 1 . 1 204 204 ASP N N 15 121.553 0.3 . 1 . . . . . 203 ASP N . 50277 1 793 . 1 . 1 205 205 CYS H H 1 7.209 0.020 . 1 . . . . . 204 CYS H . 50277 1 794 . 1 . 1 205 205 CYS C C 13 175.757 0.3 . 1 . . . . . 204 CYS C . 50277 1 795 . 1 . 1 205 205 CYS CA C 13 63.295 0.3 . 1 . . . . . 204 CYS CA . 50277 1 796 . 1 . 1 205 205 CYS CB C 13 26.545 0.3 . 1 . . . . . 204 CYS CB . 50277 1 797 . 1 . 1 205 205 CYS N N 15 119.245 0.3 . 1 . . . . . 204 CYS N . 50277 1 798 . 1 . 1 207 207 SER H H 1 7.857 0.020 . 1 . . . . . 206 SER H . 50277 1 799 . 1 . 1 207 207 SER C C 13 175.971 0.3 . 1 . . . . . 206 SER C . 50277 1 800 . 1 . 1 207 207 SER CA C 13 62.962 0.3 . 1 . . . . . 206 SER CA . 50277 1 801 . 1 . 1 207 207 SER CB C 13 66.611 0.3 . 1 . . . . . 206 SER CB . 50277 1 802 . 1 . 1 207 207 SER N N 15 113.580 0.3 . 1 . . . . . 206 SER N . 50277 1 803 . 1 . 1 208 208 ILE H H 1 7.951 0.020 . 1 . . . . . 207 ILE H . 50277 1 804 . 1 . 1 208 208 ILE C C 13 176.808 0.3 . 1 . . . . . 207 ILE C . 50277 1 805 . 1 . 1 208 208 ILE CA C 13 65.913 0.3 . 1 . . . . . 207 ILE CA . 50277 1 806 . 1 . 1 208 208 ILE CB C 13 36.749 0.3 . 1 . . . . . 207 ILE CB . 50277 1 807 . 1 . 1 208 208 ILE N N 15 120.456 0.3 . 1 . . . . . 207 ILE N . 50277 1 808 . 1 . 1 209 209 GLY H H 1 7.648 0.020 . 1 . . . . . 208 GLY H . 50277 1 809 . 1 . 1 209 209 GLY C C 13 173.185 0.3 . 1 . . . . . 208 GLY C . 50277 1 810 . 1 . 1 209 209 GLY CA C 13 48.149 0.3 . 1 . . . . . 208 GLY CA . 50277 1 811 . 1 . 1 209 209 GLY N N 15 108.906 0.3 . 1 . . . . . 208 GLY N . 50277 1 812 . 1 . 1 210 210 VAL H H 1 7.635 0.020 . 1 . . . . . 209 VAL H . 50277 1 813 . 1 . 1 210 210 VAL C C 13 178.236 0.3 . 1 . . . . . 209 VAL C . 50277 1 814 . 1 . 1 210 210 VAL CA C 13 65.920 0.3 . 1 . . . . . 209 VAL CA . 50277 1 815 . 1 . 1 210 210 VAL CB C 13 30.711 0.3 . 1 . . . . . 209 VAL CB . 50277 1 816 . 1 . 1 210 210 VAL N N 15 121.960 0.3 . 1 . . . . . 209 VAL N . 50277 1 817 . 1 . 1 211 211 ILE H H 1 8.098 0.020 . 1 . . . . . 210 ILE H . 50277 1 818 . 1 . 1 211 211 ILE C C 13 177.042 0.3 . 1 . . . . . 210 ILE C . 50277 1 819 . 1 . 1 211 211 ILE CA C 13 65.794 0.3 . 1 . . . . . 210 ILE CA . 50277 1 820 . 1 . 1 211 211 ILE CB C 13 37.123 0.3 . 1 . . . . . 210 ILE CB . 50277 1 821 . 1 . 1 211 211 ILE N N 15 118.814 0.3 . 1 . . . . . 210 ILE N . 50277 1 822 . 1 . 1 212 212 ALA H H 1 8.631 0.020 . 1 . . . . . 211 ALA H . 50277 1 823 . 1 . 1 212 212 ALA C C 13 176.959 0.3 . 1 . . . . . 211 ALA C . 50277 1 824 . 1 . 1 212 212 ALA CA C 13 55.693 0.3 . 1 . . . . . 211 ALA CA . 50277 1 825 . 1 . 1 212 212 ALA CB C 13 17.088 0.3 . 1 . . . . . 211 ALA CB . 50277 1 826 . 1 . 1 212 212 ALA N N 15 121.680 0.3 . 1 . . . . . 211 ALA N . 50277 1 827 . 1 . 1 214 214 ILE C C 13 179.222 0.3 . 1 . . . . . 213 ILE C . 50277 1 828 . 1 . 1 214 214 ILE CA C 13 64.857 0.3 . 1 . . . . . 213 ILE CA . 50277 1 829 . 1 . 1 214 214 ILE CB C 13 40.066 0.3 . 1 . . . . . 213 ILE CB . 50277 1 830 . 1 . 1 215 215 LEU H H 1 8.727 0.020 . 1 . . . . . 214 LEU H . 50277 1 831 . 1 . 1 215 215 LEU C C 13 177.874 0.3 . 1 . . . . . 214 LEU C . 50277 1 832 . 1 . 1 215 215 LEU CA C 13 56.553 0.3 . 1 . . . . . 214 LEU CA . 50277 1 833 . 1 . 1 215 215 LEU CB C 13 40.373 0.3 . 1 . . . . . 214 LEU CB . 50277 1 834 . 1 . 1 215 215 LEU N N 15 118.699 0.3 . 1 . . . . . 214 LEU N . 50277 1 835 . 1 . 1 216 216 LEU H H 1 7.100 0.020 . 1 . . . . . 215 LEU H . 50277 1 836 . 1 . 1 216 216 LEU C C 13 175.259 0.3 . 1 . . . . . 215 LEU C . 50277 1 837 . 1 . 1 216 216 LEU CA C 13 53.797 0.3 . 1 . . . . . 215 LEU CA . 50277 1 838 . 1 . 1 216 216 LEU CB C 13 41.651 0.3 . 1 . . . . . 215 LEU CB . 50277 1 839 . 1 . 1 216 216 LEU N N 15 115.379 0.3 . 1 . . . . . 215 LEU N . 50277 1 840 . 1 . 1 217 217 CYS C C 13 174.223 0.3 . 1 . . . . . 216 CYS C . 50277 1 841 . 1 . 1 218 218 GLY H H 1 9.433 0.020 . 1 . . . . . 217 GLY H . 50277 1 842 . 1 . 1 218 218 GLY C C 13 170.480 0.3 . 1 . . . . . 217 GLY C . 50277 1 843 . 1 . 1 218 218 GLY CA C 13 45.960 0.3 . 1 . . . . . 217 GLY CA . 50277 1 844 . 1 . 1 218 218 GLY N N 15 115.601 0.3 . 1 . . . . . 217 GLY N . 50277 1 845 . 1 . 1 219 219 TYR H H 1 7.796 0.020 . 1 . . . . . 218 TYR H . 50277 1 846 . 1 . 1 219 219 TYR C C 13 170.653 0.3 . 1 . . . . . 218 TYR C . 50277 1 847 . 1 . 1 219 219 TYR CA C 13 53.452 0.3 . 1 . . . . . 218 TYR CA . 50277 1 848 . 1 . 1 219 219 TYR CB C 13 37.968 0.3 . 1 . . . . . 218 TYR CB . 50277 1 849 . 1 . 1 219 219 TYR N N 15 116.754 0.3 . 1 . . . . . 218 TYR N . 50277 1 850 . 1 . 1 221 221 PRO C C 13 175.372 0.3 . 1 . . . . . 220 PRO C . 50277 1 851 . 1 . 1 221 221 PRO CA C 13 63.986 0.3 . 1 . . . . . 220 PRO CA . 50277 1 852 . 1 . 1 222 222 PHE H H 1 6.937 0.020 . 1 . . . . . 221 PHE H . 50277 1 853 . 1 . 1 222 222 PHE C C 13 174.961 0.3 . 1 . . . . . 221 PHE C . 50277 1 854 . 1 . 1 222 222 PHE CA C 13 54.713 0.3 . 1 . . . . . 221 PHE CA . 50277 1 855 . 1 . 1 222 222 PHE CB C 13 40.199 0.3 . 1 . . . . . 221 PHE CB . 50277 1 856 . 1 . 1 222 222 PHE N N 15 114.085 0.3 . 1 . . . . . 221 PHE N . 50277 1 857 . 1 . 1 223 223 TYR H H 1 8.857 0.020 . 1 . . . . . 222 TYR H . 50277 1 858 . 1 . 1 223 223 TYR C C 13 173.129 0.3 . 1 . . . . . 222 TYR C . 50277 1 859 . 1 . 1 223 223 TYR CA C 13 60.245 0.3 . 1 . . . . . 222 TYR CA . 50277 1 860 . 1 . 1 223 223 TYR CB C 13 39.909 0.3 . 1 . . . . . 222 TYR CB . 50277 1 861 . 1 . 1 223 223 TYR N N 15 123.049 0.3 . 1 . . . . . 222 TYR N . 50277 1 862 . 1 . 1 224 224 ASP H H 1 6.656 0.020 . 1 . . . . . 223 ASP H . 50277 1 863 . 1 . 1 224 224 ASP C C 13 173.822 0.3 . 1 . . . . . 223 ASP C . 50277 1 864 . 1 . 1 224 224 ASP CA C 13 54.233 0.3 . 1 . . . . . 223 ASP CA . 50277 1 865 . 1 . 1 224 224 ASP CB C 13 44.693 0.3 . 1 . . . . . 223 ASP CB . 50277 1 866 . 1 . 1 224 224 ASP N N 15 126.639 0.3 . 1 . . . . . 223 ASP N . 50277 1 867 . 1 . 1 225 225 GLU H H 1 8.485 0.020 . 1 . . . . . 224 GLU H . 50277 1 868 . 1 . 1 225 225 GLU C C 13 175.682 0.3 . 1 . . . . . 224 GLU C . 50277 1 869 . 1 . 1 225 225 GLU CA C 13 57.639 0.3 . 1 . . . . . 224 GLU CA . 50277 1 870 . 1 . 1 225 225 GLU CB C 13 28.884 0.3 . 1 . . . . . 224 GLU CB . 50277 1 871 . 1 . 1 225 225 GLU N N 15 124.081 0.3 . 1 . . . . . 224 GLU N . 50277 1 872 . 1 . 1 226 226 ASN H H 1 9.566 0.020 . 1 . . . . . 225 ASN H . 50277 1 873 . 1 . 1 226 226 ASN C C 13 175.104 0.3 . 1 . . . . . 225 ASN C . 50277 1 874 . 1 . 1 226 226 ASN CA C 13 51.894 0.3 . 1 . . . . . 225 ASN CA . 50277 1 875 . 1 . 1 226 226 ASN CB C 13 39.157 0.3 . 1 . . . . . 225 ASN CB . 50277 1 876 . 1 . 1 226 226 ASN N N 15 120.783 0.3 . 1 . . . . . 225 ASN N . 50277 1 877 . 1 . 1 227 227 ASP H H 1 8.675 0.020 . 1 . . . . . 226 ASP H . 50277 1 878 . 1 . 1 227 227 ASP C C 13 177.346 0.3 . 1 . . . . . 226 ASP C . 50277 1 879 . 1 . 1 227 227 ASP CA C 13 57.247 0.3 . 1 . . . . . 226 ASP CA . 50277 1 880 . 1 . 1 227 227 ASP CB C 13 39.800 0.3 . 1 . . . . . 226 ASP CB . 50277 1 881 . 1 . 1 227 227 ASP N N 15 126.762 0.3 . 1 . . . . . 226 ASP N . 50277 1 882 . 1 . 1 228 228 SER H H 1 8.053 0.020 . 1 . . . . . 227 SER H . 50277 1 883 . 1 . 1 228 228 SER C C 13 176.961 0.3 . 1 . . . . . 227 SER C . 50277 1 884 . 1 . 1 228 228 SER CA C 13 61.373 0.3 . 1 . . . . . 227 SER CA . 50277 1 885 . 1 . 1 228 228 SER N N 15 115.330 0.3 . 1 . . . . . 227 SER N . 50277 1 886 . 1 . 1 229 229 LYS H H 1 7.555 0.020 . 1 . . . . . 228 LYS H . 50277 1 887 . 1 . 1 229 229 LYS C C 13 178.856 0.3 . 1 . . . . . 228 LYS C . 50277 1 888 . 1 . 1 229 229 LYS CA C 13 57.771 0.3 . 1 . . . . . 228 LYS CA . 50277 1 889 . 1 . 1 229 229 LYS CB C 13 30.739 0.3 . 1 . . . . . 228 LYS CB . 50277 1 890 . 1 . 1 229 229 LYS N N 15 123.326 0.3 . 1 . . . . . 228 LYS N . 50277 1 891 . 1 . 1 230 230 LEU H H 1 7.969 0.020 . 1 . . . . . 229 LEU H . 50277 1 892 . 1 . 1 230 230 LEU C C 13 177.709 0.3 . 1 . . . . . 229 LEU C . 50277 1 893 . 1 . 1 230 230 LEU CA C 13 57.688 0.3 . 1 . . . . . 229 LEU CA . 50277 1 894 . 1 . 1 230 230 LEU CB C 13 40.312 0.3 . 1 . . . . . 229 LEU CB . 50277 1 895 . 1 . 1 230 230 LEU N N 15 122.527 0.3 . 1 . . . . . 229 LEU N . 50277 1 896 . 1 . 1 231 231 PHE H H 1 8.029 0.020 . 1 . . . . . 230 PHE H . 50277 1 897 . 1 . 1 231 231 PHE C C 13 177.039 0.3 . 1 . . . . . 230 PHE C . 50277 1 898 . 1 . 1 231 231 PHE CA C 13 60.062 0.3 . 1 . . . . . 230 PHE CA . 50277 1 899 . 1 . 1 231 231 PHE CB C 13 37.658 0.3 . 1 . . . . . 230 PHE CB . 50277 1 900 . 1 . 1 231 231 PHE N N 15 117.573 0.3 . 1 . . . . . 230 PHE N . 50277 1 901 . 1 . 1 232 232 GLU H H 1 7.430 0.020 . 1 . . . . . 231 GLU H . 50277 1 902 . 1 . 1 232 232 GLU C C 13 178.649 0.3 . 1 . . . . . 231 GLU C . 50277 1 903 . 1 . 1 232 232 GLU CA C 13 58.901 0.3 . 1 . . . . . 231 GLU CA . 50277 1 904 . 1 . 1 232 232 GLU CB C 13 28.949 0.3 . 1 . . . . . 231 GLU CB . 50277 1 905 . 1 . 1 232 232 GLU N N 15 116.634 0.3 . 1 . . . . . 231 GLU N . 50277 1 906 . 1 . 1 233 233 GLN H H 1 7.898 0.020 . 1 . . . . . 232 GLN H . 50277 1 907 . 1 . 1 233 233 GLN C C 13 178.791 0.3 . 1 . . . . . 232 GLN C . 50277 1 908 . 1 . 1 233 233 GLN CA C 13 58.705 0.3 . 1 . . . . . 232 GLN CA . 50277 1 909 . 1 . 1 233 233 GLN CB C 13 28.281 0.3 . 1 . . . . . 232 GLN CB . 50277 1 910 . 1 . 1 233 233 GLN N N 15 118.991 0.3 . 1 . . . . . 232 GLN N . 50277 1 911 . 1 . 1 234 234 ILE H H 1 7.725 0.020 . 1 . . . . . 233 ILE H . 50277 1 912 . 1 . 1 234 234 ILE C C 13 177.835 0.3 . 1 . . . . . 233 ILE C . 50277 1 913 . 1 . 1 234 234 ILE CA C 13 65.001 0.3 . 1 . . . . . 233 ILE CA . 50277 1 914 . 1 . 1 234 234 ILE CB C 13 36.758 0.3 . 1 . . . . . 233 ILE CB . 50277 1 915 . 1 . 1 234 234 ILE N N 15 121.068 0.3 . 1 . . . . . 233 ILE N . 50277 1 916 . 1 . 1 235 235 LEU H H 1 7.750 0.020 . 1 . . . . . 234 LEU H . 50277 1 917 . 1 . 1 235 235 LEU C C 13 179.350 0.3 . 1 . . . . . 234 LEU C . 50277 1 918 . 1 . 1 235 235 LEU CA C 13 57.422 0.3 . 1 . . . . . 234 LEU CA . 50277 1 919 . 1 . 1 235 235 LEU CB C 13 41.206 0.3 . 1 . . . . . 234 LEU CB . 50277 1 920 . 1 . 1 235 235 LEU N N 15 117.348 0.3 . 1 . . . . . 234 LEU N . 50277 1 921 . 1 . 1 236 236 LYS H H 1 7.314 0.020 . 1 . . . . . 235 LYS H . 50277 1 922 . 1 . 1 236 236 LYS C C 13 176.383 0.3 . 1 . . . . . 235 LYS C . 50277 1 923 . 1 . 1 236 236 LYS CA C 13 56.750 0.3 . 1 . . . . . 235 LYS CA . 50277 1 924 . 1 . 1 236 236 LYS CB C 13 32.292 0.3 . 1 . . . . . 235 LYS CB . 50277 1 925 . 1 . 1 236 236 LYS N N 15 114.898 0.3 . 1 . . . . . 235 LYS N . 50277 1 926 . 1 . 1 237 237 ALA H H 1 8.186 0.020 . 1 . . . . . 236 ALA H . 50277 1 927 . 1 . 1 237 237 ALA C C 13 175.089 0.3 . 1 . . . . . 236 ALA C . 50277 1 928 . 1 . 1 237 237 ALA CA C 13 53.020 0.3 . 1 . . . . . 236 ALA CA . 50277 1 929 . 1 . 1 237 237 ALA CB C 13 17.305 0.3 . 1 . . . . . 236 ALA CB . 50277 1 930 . 1 . 1 237 237 ALA N N 15 122.729 0.3 . 1 . . . . . 236 ALA N . 50277 1 931 . 1 . 1 238 238 GLU H H 1 8.274 0.020 . 1 . . . . . 237 GLU H . 50277 1 932 . 1 . 1 238 238 GLU C C 13 174.300 0.3 . 1 . . . . . 237 GLU C . 50277 1 933 . 1 . 1 238 238 GLU CA C 13 55.478 0.3 . 1 . . . . . 237 GLU CA . 50277 1 934 . 1 . 1 238 238 GLU CB C 13 29.422 0.3 . 1 . . . . . 237 GLU CB . 50277 1 935 . 1 . 1 238 238 GLU N N 15 119.830 0.3 . 1 . . . . . 237 GLU N . 50277 1 936 . 1 . 1 239 239 TYR H H 1 7.298 0.020 . 1 . . . . . 238 TYR H . 50277 1 937 . 1 . 1 239 239 TYR C C 13 172.674 0.3 . 1 . . . . . 238 TYR C . 50277 1 938 . 1 . 1 239 239 TYR CA C 13 55.042 0.3 . 1 . . . . . 238 TYR CA . 50277 1 939 . 1 . 1 239 239 TYR CB C 13 38.776 0.3 . 1 . . . . . 238 TYR CB . 50277 1 940 . 1 . 1 239 239 TYR N N 15 120.378 0.3 . 1 . . . . . 238 TYR N . 50277 1 941 . 1 . 1 240 240 GLU H H 1 8.311 0.020 . 1 . . . . . 239 GLU H . 50277 1 942 . 1 . 1 240 240 GLU C C 13 174.168 0.3 . 1 . . . . . 239 GLU C . 50277 1 943 . 1 . 1 240 240 GLU CA C 13 53.212 0.3 . 1 . . . . . 239 GLU CA . 50277 1 944 . 1 . 1 240 240 GLU CB C 13 33.152 0.3 . 1 . . . . . 239 GLU CB . 50277 1 945 . 1 . 1 240 240 GLU N N 15 118.288 0.3 . 1 . . . . . 239 GLU N . 50277 1 946 . 1 . 1 241 241 PHE H H 1 8.733 0.020 . 1 . . . . . 240 PHE H . 50277 1 947 . 1 . 1 241 241 PHE C C 13 175.003 0.3 . 1 . . . . . 240 PHE C . 50277 1 948 . 1 . 1 241 241 PHE CA C 13 54.280 0.3 . 1 . . . . . 240 PHE CA . 50277 1 949 . 1 . 1 241 241 PHE CB C 13 35.239 0.3 . 1 . . . . . 240 PHE CB . 50277 1 950 . 1 . 1 241 241 PHE N N 15 123.750 0.3 . 1 . . . . . 240 PHE N . 50277 1 951 . 1 . 1 242 242 ASP H H 1 7.542 0.020 . 1 . . . . . 241 ASP H . 50277 1 952 . 1 . 1 242 242 ASP C C 13 176.562 0.3 . 1 . . . . . 241 ASP C . 50277 1 953 . 1 . 1 242 242 ASP CA C 13 55.240 0.3 . 1 . . . . . 241 ASP CA . 50277 1 954 . 1 . 1 242 242 ASP CB C 13 40.627 0.3 . 1 . . . . . 241 ASP CB . 50277 1 955 . 1 . 1 242 242 ASP N N 15 119.104 0.3 . 1 . . . . . 241 ASP N . 50277 1 956 . 1 . 1 243 243 SER H H 1 8.917 0.020 . 1 . . . . . 242 SER H . 50277 1 957 . 1 . 1 243 243 SER C C 13 174.338 0.3 . 1 . . . . . 242 SER C . 50277 1 958 . 1 . 1 243 243 SER CA C 13 57.115 0.3 . 1 . . . . . 242 SER CA . 50277 1 959 . 1 . 1 243 243 SER CB C 13 62.706 0.3 . 1 . . . . . 242 SER CB . 50277 1 960 . 1 . 1 243 243 SER N N 15 119.678 0.3 . 1 . . . . . 242 SER N . 50277 1 961 . 1 . 1 244 244 PRO C C 13 177.630 0.3 . 1 . . . . . 243 PRO C . 50277 1 962 . 1 . 1 244 244 PRO CA C 13 62.818 0.3 . 1 . . . . . 243 PRO CA . 50277 1 963 . 1 . 1 244 244 PRO CB C 13 33.450 0.3 . 1 . . . . . 243 PRO CB . 50277 1 964 . 1 . 1 245 245 TYR H H 1 6.561 0.020 . 1 . . . . . 244 TYR H . 50277 1 965 . 1 . 1 245 245 TYR C C 13 177.588 0.3 . 1 . . . . . 244 TYR C . 50277 1 966 . 1 . 1 245 245 TYR CA C 13 59.447 0.3 . 1 . . . . . 244 TYR CA . 50277 1 967 . 1 . 1 245 245 TYR CB C 13 37.488 0.3 . 1 . . . . . 244 TYR CB . 50277 1 968 . 1 . 1 245 245 TYR N N 15 124.546 0.3 . 1 . . . . . 244 TYR N . 50277 1 969 . 1 . 1 246 246 TRP H H 1 8.372 0.020 . 1 . . . . . 245 TRP H . 50277 1 970 . 1 . 1 246 246 TRP C C 13 177.520 0.3 . 1 . . . . . 245 TRP C . 50277 1 971 . 1 . 1 246 246 TRP CA C 13 57.422 0.3 . 1 . . . . . 245 TRP CA . 50277 1 972 . 1 . 1 246 246 TRP CB C 13 28.662 0.3 . 1 . . . . . 245 TRP CB . 50277 1 973 . 1 . 1 246 246 TRP N N 15 114.680 0.3 . 1 . . . . . 245 TRP N . 50277 1 974 . 1 . 1 247 247 ASP H H 1 7.757 0.020 . 1 . . . . . 246 ASP H . 50277 1 975 . 1 . 1 247 247 ASP C C 13 177.350 0.3 . 1 . . . . . 246 ASP C . 50277 1 976 . 1 . 1 247 247 ASP CA C 13 57.320 0.3 . 1 . . . . . 246 ASP CA . 50277 1 977 . 1 . 1 247 247 ASP CB C 13 38.671 0.3 . 1 . . . . . 246 ASP CB . 50277 1 978 . 1 . 1 247 247 ASP N N 15 124.020 0.3 . 1 . . . . . 246 ASP N . 50277 1 979 . 1 . 1 248 248 ASP H H 1 8.568 0.020 . 1 . . . . . 247 ASP H . 50277 1 980 . 1 . 1 248 248 ASP C C 13 175.526 0.3 . 1 . . . . . 247 ASP C . 50277 1 981 . 1 . 1 248 248 ASP CA C 13 53.658 0.3 . 1 . . . . . 247 ASP CA . 50277 1 982 . 1 . 1 248 248 ASP CB C 13 40.607 0.3 . 1 . . . . . 247 ASP CB . 50277 1 983 . 1 . 1 248 248 ASP N N 15 116.625 0.3 . 1 . . . . . 247 ASP N . 50277 1 984 . 1 . 1 249 249 ILE H H 1 7.007 0.020 . 1 . . . . . 248 ILE H . 50277 1 985 . 1 . 1 249 249 ILE C C 13 176.487 0.3 . 1 . . . . . 248 ILE C . 50277 1 986 . 1 . 1 249 249 ILE CA C 13 57.277 0.3 . 1 . . . . . 248 ILE CA . 50277 1 987 . 1 . 1 249 249 ILE CB C 13 35.404 0.3 . 1 . . . . . 248 ILE CB . 50277 1 988 . 1 . 1 249 249 ILE N N 15 122.412 0.3 . 1 . . . . . 248 ILE N . 50277 1 989 . 1 . 1 250 250 SER H H 1 10.543 0.020 . 1 . . . . . 249 SER H . 50277 1 990 . 1 . 1 250 250 SER C C 13 174.813 0.3 . 1 . . . . . 249 SER C . 50277 1 991 . 1 . 1 250 250 SER CA C 13 59.357 0.3 . 1 . . . . . 249 SER CA . 50277 1 992 . 1 . 1 250 250 SER CB C 13 63.102 0.3 . 1 . . . . . 249 SER CB . 50277 1 993 . 1 . 1 250 250 SER N N 15 126.978 0.3 . 1 . . . . . 249 SER N . 50277 1 994 . 1 . 1 251 251 ASP H H 1 8.605 0.020 . 1 . . . . . 250 ASP H . 50277 1 995 . 1 . 1 251 251 ASP C C 13 179.538 0.3 . 1 . . . . . 250 ASP C . 50277 1 996 . 1 . 1 251 251 ASP CA C 13 56.630 0.3 . 1 . . . . . 250 ASP CA . 50277 1 997 . 1 . 1 251 251 ASP CB C 13 39.310 0.3 . 1 . . . . . 250 ASP CB . 50277 1 998 . 1 . 1 251 251 ASP N N 15 120.309 0.3 . 1 . . . . . 250 ASP N . 50277 1 999 . 1 . 1 255 255 ASP C C 13 177.531 0.3 . 1 . . . . . 254 ASP C . 50277 1 1000 . 1 . 1 255 255 ASP CA C 13 57.374 0.3 . 1 . . . . . 254 ASP CA . 50277 1 1001 . 1 . 1 255 255 ASP CB C 13 42.955 0.3 . 1 . . . . . 254 ASP CB . 50277 1 1002 . 1 . 1 256 256 PHE H H 1 8.070 0.020 . 1 . . . . . 255 PHE H . 50277 1 1003 . 1 . 1 256 256 PHE C C 13 176.029 0.3 . 1 . . . . . 255 PHE C . 50277 1 1004 . 1 . 1 256 256 PHE CA C 13 61.653 0.3 . 1 . . . . . 255 PHE CA . 50277 1 1005 . 1 . 1 256 256 PHE CB C 13 37.713 0.3 . 1 . . . . . 255 PHE CB . 50277 1 1006 . 1 . 1 256 256 PHE N N 15 121.599 0.3 . 1 . . . . . 255 PHE N . 50277 1 1007 . 1 . 1 257 257 ILE H H 1 7.706 0.020 . 1 . . . . . 256 ILE H . 50277 1 1008 . 1 . 1 257 257 ILE C C 13 178.294 0.3 . 1 . . . . . 256 ILE C . 50277 1 1009 . 1 . 1 257 257 ILE CA C 13 65.400 0.3 . 1 . . . . . 256 ILE CA . 50277 1 1010 . 1 . 1 257 257 ILE CB C 13 37.147 0.3 . 1 . . . . . 256 ILE CB . 50277 1 1011 . 1 . 1 257 257 ILE N N 15 116.817 0.3 . 1 . . . . . 256 ILE N . 50277 1 1012 . 1 . 1 258 258 ARG H H 1 8.514 0.020 . 1 . . . . . 257 ARG H . 50277 1 1013 . 1 . 1 258 258 ARG C C 13 178.006 0.3 . 1 . . . . . 257 ARG C . 50277 1 1014 . 1 . 1 258 258 ARG CA C 13 58.380 0.3 . 1 . . . . . 257 ARG CA . 50277 1 1015 . 1 . 1 258 258 ARG CB C 13 29.354 0.3 . 1 . . . . . 257 ARG CB . 50277 1 1016 . 1 . 1 258 258 ARG N N 15 119.338 0.3 . 1 . . . . . 257 ARG N . 50277 1 1017 . 1 . 1 259 259 ASN H H 1 6.962 0.020 . 1 . . . . . 258 ASN H . 50277 1 1018 . 1 . 1 259 259 ASN C C 13 175.211 0.3 . 1 . . . . . 258 ASN C . 50277 1 1019 . 1 . 1 259 259 ASN CA C 13 55.073 0.3 . 1 . . . . . 258 ASN CA . 50277 1 1020 . 1 . 1 259 259 ASN CB C 13 37.890 0.3 . 1 . . . . . 258 ASN CB . 50277 1 1021 . 1 . 1 259 259 ASN N N 15 113.435 0.3 . 1 . . . . . 258 ASN N . 50277 1 1022 . 1 . 1 260 260 LEU H H 1 6.912 0.020 . 1 . . . . . 259 LEU H . 50277 1 1023 . 1 . 1 260 260 LEU C C 13 177.936 0.3 . 1 . . . . . 259 LEU C . 50277 1 1024 . 1 . 1 260 260 LEU CA C 13 56.248 0.3 . 1 . . . . . 259 LEU CA . 50277 1 1025 . 1 . 1 260 260 LEU CB C 13 41.398 0.3 . 1 . . . . . 259 LEU CB . 50277 1 1026 . 1 . 1 260 260 LEU N N 15 121.249 0.3 . 1 . . . . . 259 LEU N . 50277 1 1027 . 1 . 1 261 261 MET C C 13 175.499 0.3 . 1 . . . . . 260 MET C . 50277 1 1028 . 1 . 1 261 261 MET CA C 13 54.891 0.3 . 1 . . . . . 260 MET CA . 50277 1 1029 . 1 . 1 261 261 MET CB C 13 28.794 0.3 . 1 . . . . . 260 MET CB . 50277 1 1030 . 1 . 1 262 262 GLU H H 1 7.036 0.020 . 1 . . . . . 261 GLU H . 50277 1 1031 . 1 . 1 262 262 GLU C C 13 176.417 0.3 . 1 . . . . . 261 GLU C . 50277 1 1032 . 1 . 1 262 262 GLU CA C 13 52.391 0.3 . 1 . . . . . 261 GLU CA . 50277 1 1033 . 1 . 1 262 262 GLU CB C 13 30.493 0.3 . 1 . . . . . 261 GLU CB . 50277 1 1034 . 1 . 1 262 262 GLU N N 15 122.527 0.3 . 1 . . . . . 261 GLU N . 50277 1 1035 . 1 . 1 263 263 LYS H H 1 9.257 0.020 . 1 . . . . . 262 LYS H . 50277 1 1036 . 1 . 1 263 263 LYS C C 13 174.955 0.3 . 1 . . . . . 262 LYS C . 50277 1 1037 . 1 . 1 263 263 LYS CA C 13 59.798 0.3 . 1 . . . . . 262 LYS CA . 50277 1 1038 . 1 . 1 263 263 LYS CB C 13 31.975 0.3 . 1 . . . . . 262 LYS CB . 50277 1 1039 . 1 . 1 263 263 LYS N N 15 131.328 0.3 . 1 . . . . . 262 LYS N . 50277 1 1040 . 1 . 1 264 264 ASP H H 1 9.619 0.020 . 1 . . . . . 263 ASP H . 50277 1 1041 . 1 . 1 264 264 ASP C C 13 176.199 0.3 . 1 . . . . . 263 ASP C . 50277 1 1042 . 1 . 1 264 264 ASP CA C 13 50.745 0.3 . 1 . . . . . 263 ASP CA . 50277 1 1043 . 1 . 1 264 264 ASP CB C 13 40.823 0.3 . 1 . . . . . 263 ASP CB . 50277 1 1044 . 1 . 1 264 264 ASP N N 15 121.545 0.3 . 1 . . . . . 263 ASP N . 50277 1 1045 . 1 . 1 265 265 PRO C C 13 177.091 0.3 . 1 . . . . . 264 PRO C . 50277 1 1046 . 1 . 1 265 265 PRO CA C 13 64.197 0.3 . 1 . . . . . 264 PRO CA . 50277 1 1047 . 1 . 1 265 265 PRO CB C 13 31.045 0.3 . 1 . . . . . 264 PRO CB . 50277 1 1048 . 1 . 1 266 266 ASN H H 1 8.481 0.020 . 1 . . . . . 265 ASN H . 50277 1 1049 . 1 . 1 266 266 ASN C C 13 176.051 0.3 . 1 . . . . . 265 ASN C . 50277 1 1050 . 1 . 1 266 266 ASN CA C 13 54.638 0.3 . 1 . . . . . 265 ASN CA . 50277 1 1051 . 1 . 1 266 266 ASN CB C 13 38.074 0.3 . 1 . . . . . 265 ASN CB . 50277 1 1052 . 1 . 1 266 266 ASN N N 15 115.620 0.3 . 1 . . . . . 265 ASN N . 50277 1 1053 . 1 . 1 267 267 LYS H H 1 7.409 0.020 . 1 . . . . . 266 LYS H . 50277 1 1054 . 1 . 1 267 267 LYS C C 13 176.121 0.3 . 1 . . . . . 266 LYS C . 50277 1 1055 . 1 . 1 267 267 LYS CA C 13 55.928 0.3 . 1 . . . . . 266 LYS CA . 50277 1 1056 . 1 . 1 267 267 LYS CB C 13 33.557 0.3 . 1 . . . . . 266 LYS CB . 50277 1 1057 . 1 . 1 267 267 LYS N N 15 119.134 0.3 . 1 . . . . . 266 LYS N . 50277 1 1058 . 1 . 1 268 268 ARG H H 1 7.338 0.020 . 1 . . . . . 267 ARG H . 50277 1 1059 . 1 . 1 268 268 ARG C C 13 175.702 0.3 . 1 . . . . . 267 ARG C . 50277 1 1060 . 1 . 1 268 268 ARG CA C 13 55.970 0.3 . 1 . . . . . 267 ARG CA . 50277 1 1061 . 1 . 1 268 268 ARG CB C 13 30.737 0.3 . 1 . . . . . 267 ARG CB . 50277 1 1062 . 1 . 1 268 268 ARG N N 15 123.110 0.3 . 1 . . . . . 267 ARG N . 50277 1 1063 . 1 . 1 269 269 TYR H H 1 8.415 0.020 . 1 . . . . . 268 TYR H . 50277 1 1064 . 1 . 1 269 269 TYR C C 13 177.782 0.3 . 1 . . . . . 268 TYR C . 50277 1 1065 . 1 . 1 269 269 TYR CA C 13 55.414 0.3 . 1 . . . . . 268 TYR CA . 50277 1 1066 . 1 . 1 269 269 TYR CB C 13 36.677 0.3 . 1 . . . . . 268 TYR CB . 50277 1 1067 . 1 . 1 269 269 TYR N N 15 127.747 0.3 . 1 . . . . . 268 TYR N . 50277 1 1068 . 1 . 1 270 270 THR H H 1 8.161 0.020 . 1 . . . . . 269 THR H . 50277 1 1069 . 1 . 1 270 270 THR C C 13 176.827 0.3 . 1 . . . . . 269 THR C . 50277 1 1070 . 1 . 1 270 270 THR CA C 13 60.177 0.3 . 1 . . . . . 269 THR CA . 50277 1 1071 . 1 . 1 270 270 THR CB C 13 71.107 0.3 . 1 . . . . . 269 THR CB . 50277 1 1072 . 1 . 1 270 270 THR N N 15 110.487 0.3 . 1 . . . . . 269 THR N . 50277 1 1073 . 1 . 1 271 271 CYS H H 1 9.142 0.020 . 1 . . . . . 270 CYS H . 50277 1 1074 . 1 . 1 271 271 CYS C C 13 176.258 0.3 . 1 . . . . . 270 CYS C . 50277 1 1075 . 1 . 1 271 271 CYS CA C 13 64.461 0.3 . 1 . . . . . 270 CYS CA . 50277 1 1076 . 1 . 1 271 271 CYS CB C 13 26.014 0.3 . 1 . . . . . 270 CYS CB . 50277 1 1077 . 1 . 1 271 271 CYS N N 15 119.024 0.3 . 1 . . . . . 270 CYS N . 50277 1 1078 . 1 . 1 272 272 GLU H H 1 8.267 0.020 . 1 . . . . . 271 GLU H . 50277 1 1079 . 1 . 1 272 272 GLU C C 13 178.432 0.3 . 1 . . . . . 271 GLU C . 50277 1 1080 . 1 . 1 272 272 GLU CA C 13 58.785 0.3 . 1 . . . . . 271 GLU CA . 50277 1 1081 . 1 . 1 272 272 GLU CB C 13 28.477 0.3 . 1 . . . . . 271 GLU CB . 50277 1 1082 . 1 . 1 272 272 GLU N N 15 118.160 0.3 . 1 . . . . . 271 GLU N . 50277 1 1083 . 1 . 1 273 273 GLN H H 1 7.131 0.020 . 1 . . . . . 272 GLN H . 50277 1 1084 . 1 . 1 273 273 GLN C C 13 179.448 0.3 . 1 . . . . . 272 GLN C . 50277 1 1085 . 1 . 1 273 273 GLN CA C 13 57.740 0.3 . 1 . . . . . 272 GLN CA . 50277 1 1086 . 1 . 1 273 273 GLN CB C 13 28.247 0.3 . 1 . . . . . 272 GLN CB . 50277 1 1087 . 1 . 1 273 273 GLN N N 15 117.472 0.3 . 1 . . . . . 272 GLN N . 50277 1 1088 . 1 . 1 274 274 ALA H H 1 8.471 0.020 . 1 . . . . . 273 ALA H . 50277 1 1089 . 1 . 1 274 274 ALA C C 13 178.375 0.3 . 1 . . . . . 273 ALA C . 50277 1 1090 . 1 . 1 274 274 ALA CA C 13 54.889 0.3 . 1 . . . . . 273 ALA CA . 50277 1 1091 . 1 . 1 274 274 ALA CB C 13 18.762 0.3 . 1 . . . . . 273 ALA CB . 50277 1 1092 . 1 . 1 274 274 ALA N N 15 122.386 0.3 . 1 . . . . . 273 ALA N . 50277 1 1093 . 1 . 1 275 275 ALA H H 1 8.141 0.020 . 1 . . . . . 274 ALA H . 50277 1 1094 . 1 . 1 275 275 ALA C C 13 177.505 0.3 . 1 . . . . . 274 ALA C . 50277 1 1095 . 1 . 1 275 275 ALA CA C 13 53.332 0.3 . 1 . . . . . 274 ALA CA . 50277 1 1096 . 1 . 1 275 275 ALA CB C 13 17.477 0.3 . 1 . . . . . 274 ALA CB . 50277 1 1097 . 1 . 1 275 275 ALA N N 15 116.622 0.3 . 1 . . . . . 274 ALA N . 50277 1 1098 . 1 . 1 276 276 ARG H H 1 6.936 0.020 . 1 . . . . . 275 ARG H . 50277 1 1099 . 1 . 1 276 276 ARG C C 13 176.080 0.3 . 1 . . . . . 275 ARG C . 50277 1 1100 . 1 . 1 276 276 ARG CA C 13 54.544 0.3 . 1 . . . . . 275 ARG CA . 50277 1 1101 . 1 . 1 276 276 ARG CB C 13 30.235 0.3 . 1 . . . . . 275 ARG CB . 50277 1 1102 . 1 . 1 276 276 ARG N N 15 112.798 0.3 . 1 . . . . . 275 ARG N . 50277 1 1103 . 1 . 1 277 277 HIS H H 1 7.724 0.020 . 1 . . . . . 276 HIS H . 50277 1 1104 . 1 . 1 277 277 HIS C C 13 175.376 0.3 . 1 . . . . . 276 HIS C . 50277 1 1105 . 1 . 1 277 277 HIS CA C 13 55.438 0.3 . 1 . . . . . 276 HIS CA . 50277 1 1106 . 1 . 1 277 277 HIS CB C 13 32.603 0.3 . 1 . . . . . 276 HIS CB . 50277 1 1107 . 1 . 1 277 277 HIS N N 15 126.359 0.3 . 1 . . . . . 276 HIS N . 50277 1 1108 . 1 . 1 278 278 PRO C C 13 176.938 0.3 . 1 . . . . . 277 PRO C . 50277 1 1109 . 1 . 1 278 278 PRO CA C 13 64.955 0.3 . 1 . . . . . 277 PRO CA . 50277 1 1110 . 1 . 1 279 279 TRP H H 1 11.225 0.020 . 1 . . . . . 278 TRP H . 50277 1 1111 . 1 . 1 279 279 TRP C C 13 178.489 0.3 . 1 . . . . . 278 TRP C . 50277 1 1112 . 1 . 1 279 279 TRP CA C 13 61.932 0.3 . 1 . . . . . 278 TRP CA . 50277 1 1113 . 1 . 1 279 279 TRP CB C 13 27.699 0.3 . 1 . . . . . 278 TRP CB . 50277 1 1114 . 1 . 1 279 279 TRP N N 15 123.062 0.3 . 1 . . . . . 278 TRP N . 50277 1 1115 . 1 . 1 280 280 ILE H H 1 7.628 0.020 . 1 . . . . . 279 ILE H . 50277 1 1116 . 1 . 1 280 280 ILE C C 13 177.273 0.3 . 1 . . . . . 279 ILE C . 50277 1 1117 . 1 . 1 280 280 ILE CA C 13 58.526 0.3 . 1 . . . . . 279 ILE CA . 50277 1 1118 . 1 . 1 280 280 ILE CB C 13 35.813 0.3 . 1 . . . . . 279 ILE CB . 50277 1 1119 . 1 . 1 280 280 ILE N N 15 116.368 0.3 . 1 . . . . . 279 ILE N . 50277 1 1120 . 1 . 1 281 281 ALA H H 1 8.411 0.020 . 1 . . . . . 280 ALA H . 50277 1 1121 . 1 . 1 281 281 ALA C C 13 178.052 0.3 . 1 . . . . . 280 ALA C . 50277 1 1122 . 1 . 1 281 281 ALA CA C 13 52.527 0.3 . 1 . . . . . 280 ALA CA . 50277 1 1123 . 1 . 1 281 281 ALA CB C 13 19.457 0.3 . 1 . . . . . 280 ALA CB . 50277 1 1124 . 1 . 1 281 281 ALA N N 15 120.826 0.3 . 1 . . . . . 280 ALA N . 50277 1 1125 . 1 . 1 282 282 GLY H H 1 7.976 0.020 . 1 . . . . . 281 GLY H . 50277 1 1126 . 1 . 1 282 282 GLY C C 13 175.413 0.3 . 1 . . . . . 281 GLY C . 50277 1 1127 . 1 . 1 282 282 GLY CA C 13 44.607 0.3 . 1 . . . . . 281 GLY CA . 50277 1 1128 . 1 . 1 282 282 GLY N N 15 109.977 0.3 . 1 . . . . . 281 GLY N . 50277 1 1129 . 1 . 1 283 283 ASP H H 1 8.469 0.020 . 1 . . . . . 282 ASP H . 50277 1 1130 . 1 . 1 283 283 ASP C C 13 176.585 0.3 . 1 . . . . . 282 ASP C . 50277 1 1131 . 1 . 1 283 283 ASP CA C 13 53.233 0.3 . 1 . . . . . 282 ASP CA . 50277 1 1132 . 1 . 1 283 283 ASP CB C 13 40.802 0.3 . 1 . . . . . 282 ASP CB . 50277 1 1133 . 1 . 1 283 283 ASP N N 15 122.272 0.3 . 1 . . . . . 282 ASP N . 50277 1 1134 . 1 . 1 284 284 THR H H 1 7.093 0.020 . 1 . . . . . 283 THR H . 50277 1 1135 . 1 . 1 284 284 THR C C 13 175.608 0.3 . 1 . . . . . 283 THR C . 50277 1 1136 . 1 . 1 284 284 THR CA C 13 61.851 0.3 . 1 . . . . . 283 THR CA . 50277 1 1137 . 1 . 1 284 284 THR CB C 13 68.641 0.3 . 1 . . . . . 283 THR CB . 50277 1 1138 . 1 . 1 284 284 THR N N 15 107.887 0.3 . 1 . . . . . 283 THR N . 50277 1 1139 . 1 . 1 285 285 ALA H H 1 8.136 0.020 . 1 . . . . . 284 ALA H . 50277 1 1140 . 1 . 1 285 285 ALA C C 13 178.170 0.3 . 1 . . . . . 284 ALA C . 50277 1 1141 . 1 . 1 285 285 ALA CA C 13 52.486 0.3 . 1 . . . . . 284 ALA CA . 50277 1 1142 . 1 . 1 285 285 ALA CB C 13 16.904 0.3 . 1 . . . . . 284 ALA CB . 50277 1 1143 . 1 . 1 285 285 ALA N N 15 123.486 0.3 . 1 . . . . . 284 ALA N . 50277 1 1144 . 1 . 1 286 286 LEU H H 1 6.993 0.020 . 1 . . . . . 285 LEU H . 50277 1 1145 . 1 . 1 286 286 LEU C C 13 173.854 0.3 . 1 . . . . . 285 LEU C . 50277 1 1146 . 1 . 1 286 286 LEU CA C 13 54.173 0.3 . 1 . . . . . 285 LEU CA . 50277 1 1147 . 1 . 1 286 286 LEU CB C 13 41.443 0.3 . 1 . . . . . 285 LEU CB . 50277 1 1148 . 1 . 1 286 286 LEU N N 15 123.494 0.3 . 1 . . . . . 285 LEU N . 50277 1 1149 . 1 . 1 287 287 ASN H H 1 8.017 0.020 . 1 . . . . . 286 ASN H . 50277 1 1150 . 1 . 1 287 287 ASN C C 13 174.895 0.3 . 1 . . . . . 286 ASN C . 50277 1 1151 . 1 . 1 287 287 ASN CA C 13 50.991 0.3 . 1 . . . . . 286 ASN CA . 50277 1 1152 . 1 . 1 287 287 ASN CB C 13 39.323 0.3 . 1 . . . . . 286 ASN CB . 50277 1 1153 . 1 . 1 287 287 ASN N N 15 115.080 0.3 . 1 . . . . . 286 ASN N . 50277 1 1154 . 1 . 1 288 288 LYS H H 1 7.310 0.020 . 1 . . . . . 287 LYS H . 50277 1 1155 . 1 . 1 288 288 LYS C C 13 176.812 0.3 . 1 . . . . . 287 LYS C . 50277 1 1156 . 1 . 1 288 288 LYS CA C 13 54.899 0.3 . 1 . . . . . 287 LYS CA . 50277 1 1157 . 1 . 1 288 288 LYS CB C 13 32.987 0.3 . 1 . . . . . 287 LYS CB . 50277 1 1158 . 1 . 1 288 288 LYS N N 15 121.129 0.3 . 1 . . . . . 287 LYS N . 50277 1 1159 . 1 . 1 289 289 ASN H H 1 9.025 0.020 . 1 . . . . . 288 ASN H . 50277 1 1160 . 1 . 1 289 289 ASN C C 13 176.454 0.3 . 1 . . . . . 288 ASN C . 50277 1 1161 . 1 . 1 289 289 ASN CA C 13 53.196 0.3 . 1 . . . . . 288 ASN CA . 50277 1 1162 . 1 . 1 289 289 ASN CB C 13 36.714 0.3 . 1 . . . . . 288 ASN CB . 50277 1 1163 . 1 . 1 289 289 ASN N N 15 123.539 0.3 . 1 . . . . . 288 ASN N . 50277 1 1164 . 1 . 1 290 290 ILE H H 1 9.304 0.020 . 1 . . . . . 289 ILE H . 50277 1 1165 . 1 . 1 290 290 ILE C C 13 175.264 0.3 . 1 . . . . . 289 ILE C . 50277 1 1166 . 1 . 1 290 290 ILE CA C 13 61.102 0.3 . 1 . . . . . 289 ILE CA . 50277 1 1167 . 1 . 1 290 290 ILE CB C 13 37.298 0.3 . 1 . . . . . 289 ILE CB . 50277 1 1168 . 1 . 1 290 290 ILE N N 15 126.705 0.3 . 1 . . . . . 289 ILE N . 50277 1 1169 . 1 . 1 291 291 HIS H H 1 8.064 0.020 . 1 . . . . . 290 HIS H . 50277 1 1170 . 1 . 1 291 291 HIS C C 13 177.522 0.3 . 1 . . . . . 290 HIS C . 50277 1 1171 . 1 . 1 291 291 HIS CA C 13 61.707 0.3 . 1 . . . . . 290 HIS CA . 50277 1 1172 . 1 . 1 291 291 HIS CB C 13 32.058 0.3 . 1 . . . . . 290 HIS CB . 50277 1 1173 . 1 . 1 291 291 HIS N N 15 120.296 0.3 . 1 . . . . . 290 HIS N . 50277 1 1174 . 1 . 1 292 292 GLU H H 1 9.010 0.020 . 1 . . . . . 291 GLU H . 50277 1 1175 . 1 . 1 292 292 GLU C C 13 178.439 0.3 . 1 . . . . . 291 GLU C . 50277 1 1176 . 1 . 1 292 292 GLU CA C 13 60.308 0.3 . 1 . . . . . 291 GLU CA . 50277 1 1177 . 1 . 1 292 292 GLU CB C 13 28.412 0.3 . 1 . . . . . 291 GLU CB . 50277 1 1178 . 1 . 1 292 292 GLU N N 15 120.299 0.3 . 1 . . . . . 291 GLU N . 50277 1 1179 . 1 . 1 293 293 SER H H 1 8.272 0.020 . 1 . . . . . 292 SER H . 50277 1 1180 . 1 . 1 293 293 SER C C 13 177.041 0.3 . 1 . . . . . 292 SER C . 50277 1 1181 . 1 . 1 293 293 SER CA C 13 60.309 0.3 . 1 . . . . . 292 SER CA . 50277 1 1182 . 1 . 1 293 293 SER CB C 13 62.941 0.3 . 1 . . . . . 292 SER CB . 50277 1 1183 . 1 . 1 293 293 SER N N 15 112.288 0.3 . 1 . . . . . 292 SER N . 50277 1 1184 . 1 . 1 294 294 VAL H H 1 7.531 0.020 . 1 . . . . . 293 VAL H . 50277 1 1185 . 1 . 1 294 294 VAL C C 13 178.552 0.3 . 1 . . . . . 293 VAL C . 50277 1 1186 . 1 . 1 294 294 VAL CA C 13 66.375 0.3 . 1 . . . . . 293 VAL CA . 50277 1 1187 . 1 . 1 294 294 VAL CB C 13 31.377 0.3 . 1 . . . . . 293 VAL CB . 50277 1 1188 . 1 . 1 294 294 VAL N N 15 117.726 0.3 . 1 . . . . . 293 VAL N . 50277 1 1189 . 1 . 1 295 295 SER H H 1 8.501 0.020 . 1 . . . . . 294 SER H . 50277 1 1190 . 1 . 1 295 295 SER C C 13 175.932 0.3 . 1 . . . . . 294 SER C . 50277 1 1191 . 1 . 1 295 295 SER CA C 13 61.563 0.3 . 1 . . . . . 294 SER CA . 50277 1 1192 . 1 . 1 295 295 SER CB C 13 62.336 0.3 . 1 . . . . . 294 SER CB . 50277 1 1193 . 1 . 1 295 295 SER N N 15 112.978 0.3 . 1 . . . . . 294 SER N . 50277 1 1194 . 1 . 1 296 296 ALA H H 1 7.159 0.020 . 1 . . . . . 295 ALA H . 50277 1 1195 . 1 . 1 296 296 ALA C C 13 181.242 0.3 . 1 . . . . . 295 ALA C . 50277 1 1196 . 1 . 1 296 296 ALA CA C 13 54.745 0.3 . 1 . . . . . 295 ALA CA . 50277 1 1197 . 1 . 1 296 296 ALA CB C 13 17.531 0.3 . 1 . . . . . 295 ALA CB . 50277 1 1198 . 1 . 1 296 296 ALA N N 15 124.171 0.3 . 1 . . . . . 295 ALA N . 50277 1 1199 . 1 . 1 297 297 GLN H H 1 7.884 0.020 . 1 . . . . . 296 GLN H . 50277 1 1200 . 1 . 1 297 297 GLN C C 13 179.273 0.3 . 1 . . . . . 296 GLN C . 50277 1 1201 . 1 . 1 297 297 GLN CA C 13 57.508 0.3 . 1 . . . . . 296 GLN CA . 50277 1 1202 . 1 . 1 297 297 GLN CB C 13 26.357 0.3 . 1 . . . . . 296 GLN CB . 50277 1 1203 . 1 . 1 297 297 GLN N N 15 117.173 0.3 . 1 . . . . . 296 GLN N . 50277 1 1204 . 1 . 1 298 298 ILE H H 1 8.885 0.020 . 1 . . . . . 297 ILE H . 50277 1 1205 . 1 . 1 298 298 ILE C C 13 178.866 0.3 . 1 . . . . . 297 ILE C . 50277 1 1206 . 1 . 1 298 298 ILE CA C 13 65.006 0.3 . 1 . . . . . 297 ILE CA . 50277 1 1207 . 1 . 1 298 298 ILE CB C 13 36.774 0.3 . 1 . . . . . 297 ILE CB . 50277 1 1208 . 1 . 1 298 298 ILE N N 15 124.588 0.3 . 1 . . . . . 297 ILE N . 50277 1 1209 . 1 . 1 299 299 ARG H H 1 7.905 0.020 . 1 . . . . . 298 ARG H . 50277 1 1210 . 1 . 1 299 299 ARG C C 13 178.171 0.3 . 1 . . . . . 298 ARG C . 50277 1 1211 . 1 . 1 299 299 ARG CA C 13 58.785 0.3 . 1 . . . . . 298 ARG CA . 50277 1 1212 . 1 . 1 299 299 ARG CB C 13 29.466 0.3 . 1 . . . . . 298 ARG CB . 50277 1 1213 . 1 . 1 299 299 ARG N N 15 116.951 0.3 . 1 . . . . . 298 ARG N . 50277 1 1214 . 1 . 1 300 300 LYS H H 1 7.199 0.020 . 1 . . . . . 299 LYS H . 50277 1 1215 . 1 . 1 300 300 LYS C C 13 177.864 0.3 . 1 . . . . . 299 LYS C . 50277 1 1216 . 1 . 1 300 300 LYS CA C 13 57.560 0.3 . 1 . . . . . 299 LYS CA . 50277 1 1217 . 1 . 1 300 300 LYS CB C 13 33.181 0.3 . 1 . . . . . 299 LYS CB . 50277 1 1218 . 1 . 1 300 300 LYS N N 15 116.395 0.3 . 1 . . . . . 299 LYS N . 50277 1 1219 . 1 . 1 301 301 ASN H H 1 8.094 0.020 . 1 . . . . . 300 ASN H . 50277 1 1220 . 1 . 1 301 301 ASN C C 13 174.694 0.3 . 1 . . . . . 300 ASN C . 50277 1 1221 . 1 . 1 301 301 ASN CA C 13 55.248 0.3 . 1 . . . . . 300 ASN CA . 50277 1 1222 . 1 . 1 301 301 ASN CB C 13 40.697 0.3 . 1 . . . . . 300 ASN CB . 50277 1 1223 . 1 . 1 301 301 ASN N N 15 114.786 0.3 . 1 . . . . . 300 ASN N . 50277 1 1224 . 1 . 1 302 302 PHE H H 1 8.395 0.020 . 1 . . . . . 301 PHE H . 50277 1 1225 . 1 . 1 302 302 PHE C C 13 175.039 0.3 . 1 . . . . . 301 PHE C . 50277 1 1226 . 1 . 1 302 302 PHE CA C 13 56.525 0.3 . 1 . . . . . 301 PHE CA . 50277 1 1227 . 1 . 1 302 302 PHE CB C 13 38.628 0.3 . 1 . . . . . 301 PHE CB . 50277 1 1228 . 1 . 1 302 302 PHE N N 15 119.653 0.3 . 1 . . . . . 301 PHE N . 50277 1 1229 . 1 . 1 303 303 ALA H H 1 7.782 0.020 . 1 . . . . . 302 ALA H . 50277 1 1230 . 1 . 1 303 303 ALA C C 13 177.895 0.3 . 1 . . . . . 302 ALA C . 50277 1 1231 . 1 . 1 303 303 ALA CA C 13 52.787 0.3 . 1 . . . . . 302 ALA CA . 50277 1 1232 . 1 . 1 303 303 ALA CB C 13 18.590 0.3 . 1 . . . . . 302 ALA CB . 50277 1 1233 . 1 . 1 303 303 ALA N N 15 123.728 0.3 . 1 . . . . . 302 ALA N . 50277 1 1234 . 1 . 1 306 306 LYS C C 13 176.713 0.3 . 1 . . . . . 305 LYS C . 50277 1 1235 . 1 . 1 306 306 LYS CA C 13 56.597 0.3 . 1 . . . . . 305 LYS CA . 50277 1 1236 . 1 . 1 306 306 LYS CB C 13 31.483 0.3 . 1 . . . . . 305 LYS CB . 50277 1 1237 . 1 . 1 307 307 TRP H H 1 7.900 0.020 . 1 . . . . . 306 TRP H . 50277 1 1238 . 1 . 1 307 307 TRP C C 13 176.490 0.3 . 1 . . . . . 306 TRP C . 50277 1 1239 . 1 . 1 307 307 TRP CA C 13 56.696 0.3 . 1 . . . . . 306 TRP CA . 50277 1 1240 . 1 . 1 307 307 TRP CB C 13 28.873 0.3 . 1 . . . . . 306 TRP CB . 50277 1 1241 . 1 . 1 307 307 TRP N N 15 121.222 0.3 . 1 . . . . . 306 TRP N . 50277 1 1242 . 1 . 1 308 308 ARG H H 1 7.953 0.020 . 1 . . . . . 307 ARG H . 50277 1 1243 . 1 . 1 308 308 ARG C C 13 176.176 0.3 . 1 . . . . . 307 ARG C . 50277 1 1244 . 1 . 1 308 308 ARG CA C 13 55.994 0.3 . 1 . . . . . 307 ARG CA . 50277 1 1245 . 1 . 1 308 308 ARG CB C 13 29.814 0.3 . 1 . . . . . 307 ARG CB . 50277 1 1246 . 1 . 1 308 308 ARG N N 15 122.213 0.3 . 1 . . . . . 307 ARG N . 50277 1 1247 . 1 . 1 309 309 GLN H H 1 8.143 0.020 . 1 . . . . . 308 GLN H . 50277 1 1248 . 1 . 1 309 309 GLN C C 13 175.732 0.3 . 1 . . . . . 308 GLN C . 50277 1 1249 . 1 . 1 309 309 GLN CA C 13 55.584 0.3 . 1 . . . . . 308 GLN CA . 50277 1 1250 . 1 . 1 309 309 GLN CB C 13 28.716 0.3 . 1 . . . . . 308 GLN CB . 50277 1 1251 . 1 . 1 309 309 GLN N N 15 121.209 0.3 . 1 . . . . . 308 GLN N . 50277 1 1252 . 1 . 1 310 310 ALA H H 1 8.153 0.020 . 1 . . . . . 309 ALA H . 50277 1 1253 . 1 . 1 310 310 ALA C C 13 177.394 0.3 . 1 . . . . . 309 ALA C . 50277 1 1254 . 1 . 1 310 310 ALA CA C 13 52.110 0.3 . 1 . . . . . 309 ALA CA . 50277 1 1255 . 1 . 1 310 310 ALA CB C 13 18.558 0.3 . 1 . . . . . 309 ALA CB . 50277 1 1256 . 1 . 1 310 310 ALA N N 15 124.791 0.3 . 1 . . . . . 309 ALA N . 50277 1 1257 . 1 . 1 311 311 PHE H H 1 8.070 0.020 . 1 . . . . . 310 PHE H . 50277 1 1258 . 1 . 1 311 311 PHE C C 13 175.329 0.3 . 1 . . . . . 310 PHE C . 50277 1 1259 . 1 . 1 311 311 PHE CA C 13 57.401 0.3 . 1 . . . . . 310 PHE CA . 50277 1 1260 . 1 . 1 311 311 PHE CB C 13 38.890 0.3 . 1 . . . . . 310 PHE CB . 50277 1 1261 . 1 . 1 311 311 PHE N N 15 119.399 0.3 . 1 . . . . . 310 PHE N . 50277 1 1262 . 1 . 1 312 312 ASN H H 1 8.186 0.020 . 1 . . . . . 311 ASN H . 50277 1 1263 . 1 . 1 312 312 ASN C C 13 174.513 0.3 . 1 . . . . . 311 ASN C . 50277 1 1264 . 1 . 1 312 312 ASN CA C 13 52.582 0.3 . 1 . . . . . 311 ASN CA . 50277 1 1265 . 1 . 1 312 312 ASN CB C 13 38.437 0.3 . 1 . . . . . 311 ASN CB . 50277 1 1266 . 1 . 1 312 312 ASN N N 15 120.978 0.3 . 1 . . . . . 311 ASN N . 50277 1 1267 . 1 . 1 313 313 ALA H H 1 8.117 0.020 . 1 . . . . . 312 ALA H . 50277 1 1268 . 1 . 1 313 313 ALA C C 13 177.747 0.3 . 1 . . . . . 312 ALA C . 50277 1 1269 . 1 . 1 313 313 ALA CA C 13 52.358 0.3 . 1 . . . . . 312 ALA CA . 50277 1 1270 . 1 . 1 313 313 ALA CB C 13 18.657 0.3 . 1 . . . . . 312 ALA CB . 50277 1 1271 . 1 . 1 313 313 ALA N N 15 125.059 0.3 . 1 . . . . . 312 ALA N . 50277 1 1272 . 1 . 1 314 314 THR H H 1 7.971 0.020 . 1 . . . . . 313 THR H . 50277 1 1273 . 1 . 1 314 314 THR C C 13 174.137 0.3 . 1 . . . . . 313 THR C . 50277 1 1274 . 1 . 1 314 314 THR CA C 13 61.527 0.3 . 1 . . . . . 313 THR CA . 50277 1 1275 . 1 . 1 314 314 THR CB C 13 69.160 0.3 . 1 . . . . . 313 THR CB . 50277 1 1276 . 1 . 1 314 314 THR N N 15 113.203 0.3 . 1 . . . . . 313 THR N . 50277 1 1277 . 1 . 1 315 315 ALA H H 1 8.062 0.020 . 1 . . . . . 314 ALA H . 50277 1 1278 . 1 . 1 315 315 ALA C C 13 177.310 0.3 . 1 . . . . . 314 ALA C . 50277 1 1279 . 1 . 1 315 315 ALA CA C 13 51.934 0.3 . 1 . . . . . 314 ALA CA . 50277 1 1280 . 1 . 1 315 315 ALA CB C 13 18.670 0.3 . 1 . . . . . 314 ALA CB . 50277 1 1281 . 1 . 1 315 315 ALA N N 15 126.949 0.3 . 1 . . . . . 314 ALA N . 50277 1 1282 . 1 . 1 316 316 VAL H H 1 8.053 0.020 . 1 . . . . . 315 VAL H . 50277 1 1283 . 1 . 1 316 316 VAL C C 13 175.362 0.3 . 1 . . . . . 315 VAL C . 50277 1 1284 . 1 . 1 316 316 VAL CA C 13 61.982 0.3 . 1 . . . . . 315 VAL CA . 50277 1 1285 . 1 . 1 316 316 VAL CB C 13 31.826 0.3 . 1 . . . . . 315 VAL CB . 50277 1 1286 . 1 . 1 316 316 VAL N N 15 120.902 0.3 . 1 . . . . . 315 VAL N . 50277 1 1287 . 1 . 1 317 317 VAL H H 1 7.635 0.020 . 1 . . . . . 316 VAL H . 50277 1 1288 . 1 . 1 317 317 VAL C C 13 180.921 0.3 . 1 . . . . . 316 VAL C . 50277 1 1289 . 1 . 1 317 317 VAL CA C 13 63.072 0.3 . 1 . . . . . 316 VAL CA . 50277 1 1290 . 1 . 1 317 317 VAL CB C 13 32.601 0.3 . 1 . . . . . 316 VAL CB . 50277 1 1291 . 1 . 1 317 317 VAL N N 15 128.406 0.3 . 1 . . . . . 316 VAL N . 50277 1 1292 . 1 . 1 326 326 GLY C C 13 174.244 0.3 . 1 . . . . . 325 GLY C . 50277 1 1293 . 1 . 1 326 326 GLY CA C 13 44.814 0.3 . 1 . . . . . 325 GLY CA . 50277 1 1294 . 1 . 1 327 327 SER H H 1 8.151 0.020 . 1 . . . . . 326 SER H . 50277 1 1295 . 1 . 1 327 327 SER C C 13 174.785 0.3 . 1 . . . . . 326 SER C . 50277 1 1296 . 1 . 1 327 327 SER CA C 13 57.912 0.3 . 1 . . . . . 326 SER CA . 50277 1 1297 . 1 . 1 327 327 SER CB C 13 63.274 0.3 . 1 . . . . . 326 SER CB . 50277 1 1298 . 1 . 1 327 327 SER N N 15 116.144 0.3 . 1 . . . . . 326 SER N . 50277 1 1299 . 1 . 1 328 328 SER C C 13 174.611 0.3 . 1 . . . . . 327 SER C . 50277 1 1300 . 1 . 1 328 328 SER CA C 13 58.213 0.3 . 1 . . . . . 327 SER CA . 50277 1 1301 . 1 . 1 328 328 SER CB C 13 63.514 0.3 . 1 . . . . . 327 SER CB . 50277 1 1302 . 1 . 1 329 329 LEU H H 1 8.195 0.020 . 1 . . . . . 328 LEU H . 50277 1 1303 . 1 . 1 329 329 LEU C C 13 177.259 0.3 . 1 . . . . . 328 LEU C . 50277 1 1304 . 1 . 1 329 329 LEU CA C 13 54.938 0.3 . 1 . . . . . 328 LEU CA . 50277 1 1305 . 1 . 1 329 329 LEU CB C 13 41.218 0.3 . 1 . . . . . 328 LEU CB . 50277 1 1306 . 1 . 1 329 329 LEU N N 15 124.036 0.3 . 1 . . . . . 328 LEU N . 50277 1 1307 . 1 . 1 330 330 ASP H H 1 8.230 0.020 . 1 . . . . . 329 ASP H . 50277 1 1308 . 1 . 1 330 330 ASP C C 13 176.432 0.3 . 1 . . . . . 329 ASP C . 50277 1 1309 . 1 . 1 330 330 ASP CA C 13 54.023 0.3 . 1 . . . . . 329 ASP CA . 50277 1 1310 . 1 . 1 330 330 ASP CB C 13 40.611 0.3 . 1 . . . . . 329 ASP CB . 50277 1 1311 . 1 . 1 330 330 ASP N N 15 121.436 0.3 . 1 . . . . . 329 ASP N . 50277 1 1312 . 1 . 1 331 331 SER H H 1 8.185 0.020 . 1 . . . . . 330 SER H . 50277 1 1313 . 1 . 1 331 331 SER C C 13 174.864 0.3 . 1 . . . . . 330 SER C . 50277 1 1314 . 1 . 1 331 331 SER CA C 13 58.190 0.3 . 1 . . . . . 330 SER CA . 50277 1 1315 . 1 . 1 331 331 SER CB C 13 63.398 0.3 . 1 . . . . . 330 SER CB . 50277 1 1316 . 1 . 1 331 331 SER N N 15 117.014 0.3 . 1 . . . . . 330 SER N . 50277 1 1317 . 1 . 1 332 332 SER H H 1 8.317 0.020 . 1 . . . . . 331 SER H . 50277 1 1318 . 1 . 1 332 332 SER C C 13 174.350 0.3 . 1 . . . . . 331 SER C . 50277 1 1319 . 1 . 1 332 332 SER CA C 13 58.630 0.3 . 1 . . . . . 331 SER CA . 50277 1 1320 . 1 . 1 332 332 SER CB C 13 63.234 0.3 . 1 . . . . . 331 SER CB . 50277 1 1321 . 1 . 1 332 332 SER N N 15 118.136 0.3 . 1 . . . . . 331 SER N . 50277 1 1322 . 1 . 1 333 333 ASN H H 1 8.242 0.020 . 1 . . . . . 332 ASN H . 50277 1 1323 . 1 . 1 333 333 ASN C C 13 173.764 0.3 . 1 . . . . . 332 ASN C . 50277 1 1324 . 1 . 1 333 333 ASN CA C 13 52.824 0.3 . 1 . . . . . 332 ASN CA . 50277 1 1325 . 1 . 1 333 333 ASN CB C 13 38.717 0.3 . 1 . . . . . 332 ASN CB . 50277 1 1326 . 1 . 1 333 333 ASN N N 15 121.197 0.3 . 1 . . . . . 332 ASN N . 50277 1 1327 . 1 . 1 334 334 ALA H H 1 7.745 0.020 . 1 . . . . . 333 ALA H . 50277 1 1328 . 1 . 1 334 334 ALA C C 13 182.491 0.3 . 1 . . . . . 333 ALA C . 50277 1 1329 . 1 . 1 334 334 ALA CA C 13 53.472 0.3 . 1 . . . . . 333 ALA CA . 50277 1 1330 . 1 . 1 334 334 ALA CB C 13 19.314 0.3 . 1 . . . . . 333 ALA CB . 50277 1 1331 . 1 . 1 334 334 ALA N N 15 129.850 0.3 . 1 . . . . . 333 ALA N . 50277 1 stop_ save_