data_50715 ####################### # Entry information # ####################### save_entry_information_1 _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information_1 _Entry.ID 50715 _Entry.Title ; Solution NMR backbone assignments of the N-terminal Za-linker-Zb segment from Homo Sapiens ADAR1p150. ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2021-01-16 _Entry.Accession_date 2021-01-16 _Entry.Last_release_date 2021-01-17 _Entry.Original_release_date 2021-01-17 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.14.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details 'HN, CA, CB, and CO chemical shifts for the Za-linker-Zb segment at 35C.' _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 Parker Nichols . J. . 0000-0003-1930-6408 50715 2 Morkos Henen . A. . 0000-0003-4835-5583 50715 3 Quentin Vicens . . . 0000-0003-3751-530X 50715 4 Beat Vogeli . . . 0000-0003-1176-3137 50715 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 50715 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 643 50715 '15N chemical shifts' 211 50715 '1H chemical shifts' 211 50715 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 . . 2021-11-19 2021-01-16 update BMRB 'update entry citation' 50715 1 . . 2021-03-21 2021-01-16 original author 'original release' 50715 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 50713 'N-terminal Zb domain from Homo Sapiens ADAR1p150' 50715 BMRB 50714 'N-terminal Za domain from Homo Sapiens ADAR1p150' 50715 stop_ save_ ############### # Citations # ############### save_citations_1 _Citation.Sf_category citations _Citation.Sf_framecode citations_1 _Citation.Entry_ID 50715 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 33742389 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; Solution NMR backbone assignments of the N-terminal Zalpha-linker-Zbeta segment from Homo sapiens ADAR1p150 ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assign.' _Citation.Journal_name_full . _Citation.Journal_volume 15 _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 273 _Citation.Page_last 279 _Citation.Year 2021 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Parker Nichols . J. . . 50715 1 2 Morkos Henen . A. . . 50715 1 3 Quentin Vicens . . . . 50715 1 4 Beat Vogeli . . . . 50715 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'ADAR1, editing, Z-RNA, protein structure & dynamics, protein domains, backbone chemical shift assignment.' 50715 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly_1 _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly_1 _Assembly.Entry_ID 50715 _Assembly.ID 1 _Assembly.Name Za-Zb _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states no _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange no _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 Za-Zb 1 $entity_1 . . yes native no no . . . 50715 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 50715 _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 ; MEQRILKFLEELGEGKATTA HDLSGKLGTPKKEINRVLYS LAKKGKLQKEAGTPPLWKIA VSTQAWNQHSGVVRPDGHSQ GAPNSDPSLEPEDRNSSVSE DLLEPFIAVSAQAWNQHSGV VRPDSHSQGSPNSDPGLEPE DSNSTSALEDPLEFLDMAEI KEKICDYLFNVSDSSALNLA KNIGLTKARDINAVLIDMER QGDVYRQGTTPPIWHLTDKK RERMQIK ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq 139-365 _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 227 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 139 MET . 50715 1 2 140 GLU . 50715 1 3 141 GLN . 50715 1 4 142 ARG . 50715 1 5 143 ILE . 50715 1 6 144 LEU . 50715 1 7 145 LYS . 50715 1 8 146 PHE . 50715 1 9 147 LEU . 50715 1 10 148 GLU . 50715 1 11 149 GLU . 50715 1 12 150 LEU . 50715 1 13 151 GLY . 50715 1 14 152 GLU . 50715 1 15 153 GLY . 50715 1 16 154 LYS . 50715 1 17 155 ALA . 50715 1 18 156 THR . 50715 1 19 157 THR . 50715 1 20 158 ALA . 50715 1 21 159 HIS . 50715 1 22 160 ASP . 50715 1 23 161 LEU . 50715 1 24 162 SER . 50715 1 25 163 GLY . 50715 1 26 164 LYS . 50715 1 27 165 LEU . 50715 1 28 166 GLY . 50715 1 29 167 THR . 50715 1 30 168 PRO . 50715 1 31 169 LYS . 50715 1 32 170 LYS . 50715 1 33 171 GLU . 50715 1 34 172 ILE . 50715 1 35 173 ASN . 50715 1 36 174 ARG . 50715 1 37 175 VAL . 50715 1 38 176 LEU . 50715 1 39 177 TYR . 50715 1 40 178 SER . 50715 1 41 179 LEU . 50715 1 42 180 ALA . 50715 1 43 181 LYS . 50715 1 44 182 LYS . 50715 1 45 183 GLY . 50715 1 46 184 LYS . 50715 1 47 185 LEU . 50715 1 48 186 GLN . 50715 1 49 187 LYS . 50715 1 50 188 GLU . 50715 1 51 189 ALA . 50715 1 52 190 GLY . 50715 1 53 191 THR . 50715 1 54 192 PRO . 50715 1 55 193 PRO . 50715 1 56 194 LEU . 50715 1 57 195 TRP . 50715 1 58 196 LYS . 50715 1 59 197 ILE . 50715 1 60 198 ALA . 50715 1 61 199 VAL . 50715 1 62 200 SER . 50715 1 63 201 THR . 50715 1 64 202 GLN . 50715 1 65 203 ALA . 50715 1 66 204 TRP . 50715 1 67 205 ASN . 50715 1 68 206 GLN . 50715 1 69 207 HIS . 50715 1 70 208 SER . 50715 1 71 209 GLY . 50715 1 72 210 VAL . 50715 1 73 211 VAL . 50715 1 74 212 ARG . 50715 1 75 213 PRO . 50715 1 76 214 ASP . 50715 1 77 215 GLY . 50715 1 78 216 HIS . 50715 1 79 217 SER . 50715 1 80 218 GLN . 50715 1 81 219 GLY . 50715 1 82 220 ALA . 50715 1 83 221 PRO . 50715 1 84 222 ASN . 50715 1 85 223 SER . 50715 1 86 224 ASP . 50715 1 87 225 PRO . 50715 1 88 226 SER . 50715 1 89 227 LEU . 50715 1 90 228 GLU . 50715 1 91 229 PRO . 50715 1 92 230 GLU . 50715 1 93 231 ASP . 50715 1 94 232 ARG . 50715 1 95 233 ASN . 50715 1 96 234 SER . 50715 1 97 235 SER . 50715 1 98 236 VAL . 50715 1 99 237 SER . 50715 1 100 238 GLU . 50715 1 101 239 ASP . 50715 1 102 240 LEU . 50715 1 103 241 LEU . 50715 1 104 242 GLU . 50715 1 105 243 PRO . 50715 1 106 244 PHE . 50715 1 107 245 ILE . 50715 1 108 246 ALA . 50715 1 109 247 VAL . 50715 1 110 248 SER . 50715 1 111 249 ALA . 50715 1 112 250 GLN . 50715 1 113 251 ALA . 50715 1 114 252 TRP . 50715 1 115 253 ASN . 50715 1 116 254 GLN . 50715 1 117 255 HIS . 50715 1 118 256 SER . 50715 1 119 257 GLY . 50715 1 120 258 VAL . 50715 1 121 259 VAL . 50715 1 122 260 ARG . 50715 1 123 261 PRO . 50715 1 124 262 ASP . 50715 1 125 263 SER . 50715 1 126 264 HIS . 50715 1 127 265 SER . 50715 1 128 266 GLN . 50715 1 129 267 GLY . 50715 1 130 268 SER . 50715 1 131 269 PRO . 50715 1 132 270 ASN . 50715 1 133 271 SER . 50715 1 134 272 ASP . 50715 1 135 273 PRO . 50715 1 136 274 GLY . 50715 1 137 275 LEU . 50715 1 138 276 GLU . 50715 1 139 277 PRO . 50715 1 140 278 GLU . 50715 1 141 279 ASP . 50715 1 142 280 SER . 50715 1 143 281 ASN . 50715 1 144 282 SER . 50715 1 145 283 THR . 50715 1 146 284 SER . 50715 1 147 285 ALA . 50715 1 148 286 LEU . 50715 1 149 287 GLU . 50715 1 150 288 ASP . 50715 1 151 289 PRO . 50715 1 152 290 LEU . 50715 1 153 291 GLU . 50715 1 154 292 PHE . 50715 1 155 293 LEU . 50715 1 156 294 ASP . 50715 1 157 295 MET . 50715 1 158 296 ALA . 50715 1 159 297 GLU . 50715 1 160 298 ILE . 50715 1 161 299 LYS . 50715 1 162 300 GLU . 50715 1 163 301 LYS . 50715 1 164 302 ILE . 50715 1 165 303 CYS . 50715 1 166 304 ASP . 50715 1 167 305 TYR . 50715 1 168 306 LEU . 50715 1 169 307 PHE . 50715 1 170 308 ASN . 50715 1 171 309 VAL . 50715 1 172 310 SER . 50715 1 173 311 ASP . 50715 1 174 312 SER . 50715 1 175 313 SER . 50715 1 176 314 ALA . 50715 1 177 315 LEU . 50715 1 178 316 ASN . 50715 1 179 317 LEU . 50715 1 180 318 ALA . 50715 1 181 319 LYS . 50715 1 182 320 ASN . 50715 1 183 321 ILE . 50715 1 184 322 GLY . 50715 1 185 323 LEU . 50715 1 186 324 THR . 50715 1 187 325 LYS . 50715 1 188 326 ALA . 50715 1 189 327 ARG . 50715 1 190 328 ASP . 50715 1 191 329 ILE . 50715 1 192 330 ASN . 50715 1 193 331 ALA . 50715 1 194 332 VAL . 50715 1 195 333 LEU . 50715 1 196 334 ILE . 50715 1 197 335 ASP . 50715 1 198 336 MET . 50715 1 199 337 GLU . 50715 1 200 338 ARG . 50715 1 201 339 GLN . 50715 1 202 340 GLY . 50715 1 203 341 ASP . 50715 1 204 342 VAL . 50715 1 205 343 TYR . 50715 1 206 344 ARG . 50715 1 207 345 GLN . 50715 1 208 346 GLY . 50715 1 209 347 THR . 50715 1 210 348 THR . 50715 1 211 349 PRO . 50715 1 212 350 PRO . 50715 1 213 351 ILE . 50715 1 214 352 TRP . 50715 1 215 353 HIS . 50715 1 216 354 LEU . 50715 1 217 355 THR . 50715 1 218 356 ASP . 50715 1 219 357 LYS . 50715 1 220 358 LYS . 50715 1 221 359 ARG . 50715 1 222 360 GLU . 50715 1 223 361 ARG . 50715 1 224 362 MET . 50715 1 225 363 GLN . 50715 1 226 364 ILE . 50715 1 227 365 LYS . 50715 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 . MET 1 1 50715 1 . GLU 2 2 50715 1 . GLN 3 3 50715 1 . ARG 4 4 50715 1 . ILE 5 5 50715 1 . LEU 6 6 50715 1 . LYS 7 7 50715 1 . PHE 8 8 50715 1 . LEU 9 9 50715 1 . GLU 10 10 50715 1 . GLU 11 11 50715 1 . LEU 12 12 50715 1 . GLY 13 13 50715 1 . GLU 14 14 50715 1 . GLY 15 15 50715 1 . LYS 16 16 50715 1 . ALA 17 17 50715 1 . THR 18 18 50715 1 . THR 19 19 50715 1 . ALA 20 20 50715 1 . HIS 21 21 50715 1 . ASP 22 22 50715 1 . LEU 23 23 50715 1 . SER 24 24 50715 1 . GLY 25 25 50715 1 . LYS 26 26 50715 1 . LEU 27 27 50715 1 . GLY 28 28 50715 1 . THR 29 29 50715 1 . PRO 30 30 50715 1 . LYS 31 31 50715 1 . LYS 32 32 50715 1 . GLU 33 33 50715 1 . ILE 34 34 50715 1 . ASN 35 35 50715 1 . ARG 36 36 50715 1 . VAL 37 37 50715 1 . LEU 38 38 50715 1 . TYR 39 39 50715 1 . SER 40 40 50715 1 . LEU 41 41 50715 1 . ALA 42 42 50715 1 . LYS 43 43 50715 1 . LYS 44 44 50715 1 . GLY 45 45 50715 1 . LYS 46 46 50715 1 . LEU 47 47 50715 1 . GLN 48 48 50715 1 . LYS 49 49 50715 1 . GLU 50 50 50715 1 . ALA 51 51 50715 1 . GLY 52 52 50715 1 . THR 53 53 50715 1 . PRO 54 54 50715 1 . PRO 55 55 50715 1 . LEU 56 56 50715 1 . TRP 57 57 50715 1 . LYS 58 58 50715 1 . ILE 59 59 50715 1 . ALA 60 60 50715 1 . VAL 61 61 50715 1 . SER 62 62 50715 1 . THR 63 63 50715 1 . GLN 64 64 50715 1 . ALA 65 65 50715 1 . TRP 66 66 50715 1 . ASN 67 67 50715 1 . GLN 68 68 50715 1 . HIS 69 69 50715 1 . SER 70 70 50715 1 . GLY 71 71 50715 1 . VAL 72 72 50715 1 . VAL 73 73 50715 1 . ARG 74 74 50715 1 . PRO 75 75 50715 1 . ASP 76 76 50715 1 . GLY 77 77 50715 1 . HIS 78 78 50715 1 . SER 79 79 50715 1 . GLN 80 80 50715 1 . GLY 81 81 50715 1 . ALA 82 82 50715 1 . PRO 83 83 50715 1 . ASN 84 84 50715 1 . SER 85 85 50715 1 . ASP 86 86 50715 1 . PRO 87 87 50715 1 . SER 88 88 50715 1 . LEU 89 89 50715 1 . GLU 90 90 50715 1 . PRO 91 91 50715 1 . GLU 92 92 50715 1 . ASP 93 93 50715 1 . ARG 94 94 50715 1 . ASN 95 95 50715 1 . SER 96 96 50715 1 . SER 97 97 50715 1 . VAL 98 98 50715 1 . SER 99 99 50715 1 . GLU 100 100 50715 1 . ASP 101 101 50715 1 . LEU 102 102 50715 1 . LEU 103 103 50715 1 . GLU 104 104 50715 1 . PRO 105 105 50715 1 . PHE 106 106 50715 1 . ILE 107 107 50715 1 . ALA 108 108 50715 1 . VAL 109 109 50715 1 . SER 110 110 50715 1 . ALA 111 111 50715 1 . GLN 112 112 50715 1 . ALA 113 113 50715 1 . TRP 114 114 50715 1 . ASN 115 115 50715 1 . GLN 116 116 50715 1 . HIS 117 117 50715 1 . SER 118 118 50715 1 . GLY 119 119 50715 1 . VAL 120 120 50715 1 . VAL 121 121 50715 1 . ARG 122 122 50715 1 . PRO 123 123 50715 1 . ASP 124 124 50715 1 . SER 125 125 50715 1 . HIS 126 126 50715 1 . SER 127 127 50715 1 . GLN 128 128 50715 1 . GLY 129 129 50715 1 . SER 130 130 50715 1 . PRO 131 131 50715 1 . ASN 132 132 50715 1 . SER 133 133 50715 1 . ASP 134 134 50715 1 . PRO 135 135 50715 1 . GLY 136 136 50715 1 . LEU 137 137 50715 1 . GLU 138 138 50715 1 . PRO 139 139 50715 1 . GLU 140 140 50715 1 . ASP 141 141 50715 1 . SER 142 142 50715 1 . ASN 143 143 50715 1 . SER 144 144 50715 1 . THR 145 145 50715 1 . SER 146 146 50715 1 . ALA 147 147 50715 1 . LEU 148 148 50715 1 . GLU 149 149 50715 1 . ASP 150 150 50715 1 . PRO 151 151 50715 1 . LEU 152 152 50715 1 . GLU 153 153 50715 1 . PHE 154 154 50715 1 . LEU 155 155 50715 1 . ASP 156 156 50715 1 . MET 157 157 50715 1 . ALA 158 158 50715 1 . GLU 159 159 50715 1 . ILE 160 160 50715 1 . LYS 161 161 50715 1 . GLU 162 162 50715 1 . LYS 163 163 50715 1 . ILE 164 164 50715 1 . CYS 165 165 50715 1 . ASP 166 166 50715 1 . TYR 167 167 50715 1 . LEU 168 168 50715 1 . PHE 169 169 50715 1 . ASN 170 170 50715 1 . VAL 171 171 50715 1 . SER 172 172 50715 1 . ASP 173 173 50715 1 . SER 174 174 50715 1 . SER 175 175 50715 1 . ALA 176 176 50715 1 . LEU 177 177 50715 1 . ASN 178 178 50715 1 . LEU 179 179 50715 1 . ALA 180 180 50715 1 . LYS 181 181 50715 1 . ASN 182 182 50715 1 . ILE 183 183 50715 1 . GLY 184 184 50715 1 . LEU 185 185 50715 1 . THR 186 186 50715 1 . LYS 187 187 50715 1 . ALA 188 188 50715 1 . ARG 189 189 50715 1 . ASP 190 190 50715 1 . ILE 191 191 50715 1 . ASN 192 192 50715 1 . ALA 193 193 50715 1 . VAL 194 194 50715 1 . LEU 195 195 50715 1 . ILE 196 196 50715 1 . ASP 197 197 50715 1 . MET 198 198 50715 1 . GLU 199 199 50715 1 . ARG 200 200 50715 1 . GLN 201 201 50715 1 . GLY 202 202 50715 1 . ASP 203 203 50715 1 . VAL 204 204 50715 1 . TYR 205 205 50715 1 . ARG 206 206 50715 1 . GLN 207 207 50715 1 . GLY 208 208 50715 1 . THR 209 209 50715 1 . THR 210 210 50715 1 . PRO 211 211 50715 1 . PRO 212 212 50715 1 . ILE 213 213 50715 1 . TRP 214 214 50715 1 . HIS 215 215 50715 1 . LEU 216 216 50715 1 . THR 217 217 50715 1 . ASP 218 218 50715 1 . LYS 219 219 50715 1 . LYS 220 220 50715 1 . ARG 221 221 50715 1 . GLU 222 222 50715 1 . ARG 223 223 50715 1 . MET 224 224 50715 1 . GLN 225 225 50715 1 . ILE 226 226 50715 1 . LYS 227 227 50715 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 50715 _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 . . . . . . . . . . . . . 50715 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 50715 _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(DE3) . . plasmid . . pet-28a(+) . . . 50715 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 50715 _Sample.ID 1 _Sample.Name Za-ZB _Sample.Type solution _Sample.Sub_type . _Sample.Details '680 micromolar protein, 20 mM potassium phosphate (pH 6.4), 100 mM NaCl' _Sample.Aggregate_sample_number 1 _Sample.Solvent_system '95% H2O/5% 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 Za-Zb '[U-13C; U-15N; U-2H]' . . 1 $entity_1 . . 680 . . uM . . . . 50715 1 2 'potassium phosphate' 'natural abundance' . . . . . . 20 . . mM . . . . 50715 1 3 NaCl 'natural abundance' . . . . . . 100 . . mM . . . . 50715 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 50715 _Sample_condition_list.ID 1 _Sample_condition_list.Name 'Za-ZB sample conditions' _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 100 . mM 50715 1 pH 6.4 . pH 50715 1 pressure 1 . atm 50715 1 temperature 308 . K 50715 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 50715 _Software.ID 1 _Software.Type . _Software.Name NMRDraw _Software.Version 10.9 _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID processing . 50715 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 50715 _Software.ID 2 _Software.Type . _Software.Name CcpNMR _Software.Version 2.4.2 _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 50715 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 50715 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name 'Varian 900 MHz spectrometer' _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 900 save_ save_NMR_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_2 _NMR_spectrometer.Entry_ID 50715 _NMR_spectrometer.ID 2 _NMR_spectrometer.Name 'Bruker 600 MHz spectrometer' _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Ultrashield _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ ############################# # NMR applied experiments # ############################# save_experiment_list_1 _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list_1 _Experiment_list.Entry_ID 50715 _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 . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50715 1 2 '3D TROSY HNCACB' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 50715 1 3 '3D TROSY HN(CO)CACB' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 50715 1 4 '3D TROSY HN(CA)CO' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 50715 1 5 '3D TROSY HNCO' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 50715 1 6 '3D HNN' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50715 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 50715 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name Za-Zb _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 na 'methyl carbon' . . . . ppm 50 na indirect 1 . . . . . 50715 1 H 1 DSS 'methyl protons' . . . . ppm 0 external direct 1 . . . . . 50715 1 N 15 na nitrogen . . . . ppm 150 na indirect 1 . . . . . 50715 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 50715 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name 'HN, CA, CB, and CO chemical shifts for Za-Zb at 35C' _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' . . . 50715 1 2 '3D TROSY HNCACB' . . . 50715 1 3 '3D TROSY HN(CO)CACB' . . . 50715 1 4 '3D TROSY HN(CA)CO' . . . 50715 1 5 '3D TROSY HNCO' . . . 50715 1 6 '3D HNN' . . . 50715 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $software_1 . . 50715 1 2 $software_2 . . 50715 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 1 1 MET C C 13 178.268 0.000 . 1 . . . . . 139 MET C . 50715 1 2 . 1 . 1 1 1 MET CA C 13 57.246 0.000 . 1 . . . . . 139 MET CA . 50715 1 3 . 1 . 1 2 2 GLU H H 1 8.353 0.006 . 1 . . . . . 140 GLU HN . 50715 1 4 . 1 . 1 2 2 GLU C C 13 177.899 0.014 . 1 . . . . . 140 GLU C . 50715 1 5 . 1 . 1 2 2 GLU CA C 13 60.297 0.036 . 1 . . . . . 140 GLU CA . 50715 1 6 . 1 . 1 2 2 GLU CB C 13 28.704 0.010 . 1 . . . . . 140 GLU CB . 50715 1 7 . 1 . 1 2 2 GLU N N 15 118.248 0.018 . 1 . . . . . 140 GLU N . 50715 1 8 . 1 . 1 3 3 GLN H H 1 7.744 0.002 . 1 . . . . . 141 GLN HN . 50715 1 9 . 1 . 1 3 3 GLN C C 13 178.764 0.023 . 1 . . . . . 141 GLN C . 50715 1 10 . 1 . 1 3 3 GLN CA C 13 58.484 0.002 . 1 . . . . . 141 GLN CA . 50715 1 11 . 1 . 1 3 3 GLN CB C 13 27.534 0.036 . 1 . . . . . 141 GLN CB . 50715 1 12 . 1 . 1 3 3 GLN N N 15 115.621 0.035 . 1 . . . . . 141 GLN N . 50715 1 13 . 1 . 1 4 4 ARG H H 1 7.973 0.004 . 1 . . . . . 142 ARG HN . 50715 1 14 . 1 . 1 4 4 ARG C C 13 179.566 0.019 . 1 . . . . . 142 ARG C . 50715 1 15 . 1 . 1 4 4 ARG CA C 13 58.920 0.046 . 1 . . . . . 142 ARG CA . 50715 1 16 . 1 . 1 4 4 ARG CB C 13 29.641 0.010 . 1 . . . . . 142 ARG CB . 50715 1 17 . 1 . 1 4 4 ARG N N 15 118.692 0.018 . 1 . . . . . 142 ARG N . 50715 1 18 . 1 . 1 5 5 ILE H H 1 8.060 0.001 . 1 . . . . . 143 ILE HN . 50715 1 19 . 1 . 1 5 5 ILE C C 13 177.062 0.046 . 1 . . . . . 143 ILE C . 50715 1 20 . 1 . 1 5 5 ILE CA C 13 65.421 0.004 . 1 . . . . . 143 ILE CA . 50715 1 21 . 1 . 1 5 5 ILE CB C 13 36.855 0.008 . 1 . . . . . 143 ILE CB . 50715 1 22 . 1 . 1 5 5 ILE N N 15 119.756 0.021 . 1 . . . . . 143 ILE N . 50715 1 23 . 1 . 1 6 6 LEU H H 1 8.082 0.003 . 1 . . . . . 144 LEU HN . 50715 1 24 . 1 . 1 6 6 LEU C C 13 178.910 0.034 . 1 . . . . . 144 LEU C . 50715 1 25 . 1 . 1 6 6 LEU CA C 13 58.183 0.005 . 1 . . . . . 144 LEU CA . 50715 1 26 . 1 . 1 6 6 LEU CB C 13 40.052 0.003 . 1 . . . . . 144 LEU CB . 50715 1 27 . 1 . 1 6 6 LEU N N 15 118.760 0.028 . 1 . . . . . 144 LEU N . 50715 1 28 . 1 . 1 7 7 LYS H H 1 8.134 0.005 . 1 . . . . . 145 LYS HN . 50715 1 29 . 1 . 1 7 7 LYS C C 13 178.339 0.001 . 1 . . . . . 145 LYS C . 50715 1 30 . 1 . 1 7 7 LYS CA C 13 58.366 0.033 . 1 . . . . . 145 LYS CA . 50715 1 31 . 1 . 1 7 7 LYS CB C 13 31.127 0.075 . 1 . . . . . 145 LYS CB . 50715 1 32 . 1 . 1 7 7 LYS N N 15 118.107 0.014 . 1 . . . . . 145 LYS N . 50715 1 33 . 1 . 1 8 8 PHE H H 1 7.715 0.003 . 1 . . . . . 146 PHE HN . 50715 1 34 . 1 . 1 8 8 PHE C C 13 178.593 0.000 . 1 . . . . . 146 PHE C . 50715 1 35 . 1 . 1 8 8 PHE CA C 13 60.968 0.009 . 1 . . . . . 146 PHE CA . 50715 1 36 . 1 . 1 8 8 PHE CB C 13 38.391 0.086 . 1 . . . . . 146 PHE CB . 50715 1 37 . 1 . 1 8 8 PHE N N 15 118.674 0.024 . 1 . . . . . 146 PHE N . 50715 1 38 . 1 . 1 9 9 LEU H H 1 8.287 0.002 . 1 . . . . . 147 LEU HN . 50715 1 39 . 1 . 1 9 9 LEU C C 13 180.240 0.042 . 1 . . . . . 147 LEU C . 50715 1 40 . 1 . 1 9 9 LEU CA C 13 57.245 0.026 . 1 . . . . . 147 LEU CA . 50715 1 41 . 1 . 1 9 9 LEU CB C 13 40.696 0.032 . 1 . . . . . 147 LEU CB . 50715 1 42 . 1 . 1 9 9 LEU N N 15 117.963 0.018 . 1 . . . . . 147 LEU N . 50715 1 43 . 1 . 1 10 10 GLU H H 1 8.643 0.004 . 1 . . . . . 148 GLU HN . 50715 1 44 . 1 . 1 10 10 GLU C C 13 179.392 0.000 . 1 . . . . . 148 GLU C . 50715 1 45 . 1 . 1 10 10 GLU CA C 13 59.302 0.095 . 1 . . . . . 148 GLU CA . 50715 1 46 . 1 . 1 10 10 GLU CB C 13 28.879 0.002 . 1 . . . . . 148 GLU CB . 50715 1 47 . 1 . 1 10 10 GLU N N 15 121.758 0.013 . 1 . . . . . 148 GLU N . 50715 1 48 . 1 . 1 11 11 GLU H H 1 7.799 0.002 . 1 . . . . . 149 GLU HN . 50715 1 49 . 1 . 1 11 11 GLU C C 13 177.964 0.004 . 1 . . . . . 149 GLU C . 50715 1 50 . 1 . 1 11 11 GLU CA C 13 57.540 0.000 . 1 . . . . . 149 GLU CA . 50715 1 51 . 1 . 1 11 11 GLU CB C 13 28.639 0.000 . 1 . . . . . 149 GLU CB . 50715 1 52 . 1 . 1 11 11 GLU N N 15 117.797 0.022 . 1 . . . . . 149 GLU N . 50715 1 53 . 1 . 1 12 12 LEU H H 1 7.404 0.002 . 1 . . . . . 150 LEU HN . 50715 1 54 . 1 . 1 12 12 LEU C C 13 178.147 0.000 . 1 . . . . . 150 LEU C . 50715 1 55 . 1 . 1 12 12 LEU CA C 13 56.563 0.029 . 1 . . . . . 150 LEU CA . 50715 1 56 . 1 . 1 12 12 LEU CB C 13 41.807 0.103 . 1 . . . . . 150 LEU CB . 50715 1 57 . 1 . 1 12 12 LEU N N 15 119.577 0.018 . 1 . . . . . 150 LEU N . 50715 1 58 . 1 . 1 13 13 GLY H H 1 7.205 0.002 . 1 . . . . . 151 GLY HN . 50715 1 59 . 1 . 1 13 13 GLY C C 13 174.110 0.030 . 1 . . . . . 151 GLY C . 50715 1 60 . 1 . 1 13 13 GLY CA C 13 43.278 0.004 . 1 . . . . . 151 GLY CA . 50715 1 61 . 1 . 1 13 13 GLY N N 15 103.460 0.041 . 1 . . . . . 151 GLY N . 50715 1 62 . 1 . 1 14 14 GLU H H 1 8.461 0.001 . 1 . . . . . 152 GLU HN . 50715 1 63 . 1 . 1 14 14 GLU C C 13 178.089 0.001 . 1 . . . . . 152 GLU C . 50715 1 64 . 1 . 1 14 14 GLU CA C 13 57.607 0.031 . 1 . . . . . 152 GLU CA . 50715 1 65 . 1 . 1 14 14 GLU CB C 13 28.774 0.019 . 1 . . . . . 152 GLU CB . 50715 1 66 . 1 . 1 14 14 GLU N N 15 121.119 0.018 . 1 . . . . . 152 GLU N . 50715 1 67 . 1 . 1 15 15 GLY H H 1 8.937 0.002 . 1 . . . . . 153 GLY HN . 50715 1 68 . 1 . 1 15 15 GLY C C 13 173.995 0.001 . 1 . . . . . 153 GLY C . 50715 1 69 . 1 . 1 15 15 GLY CA C 13 45.327 0.019 . 1 . . . . . 153 GLY CA . 50715 1 70 . 1 . 1 15 15 GLY N N 15 112.084 0.010 . 1 . . . . . 153 GLY N . 50715 1 71 . 1 . 1 16 16 LYS H H 1 7.276 0.001 . 1 . . . . . 154 LYS HN . 50715 1 72 . 1 . 1 16 16 LYS C C 13 173.937 0.003 . 1 . . . . . 154 LYS C . 50715 1 73 . 1 . 1 16 16 LYS CA C 13 54.937 0.000 . 1 . . . . . 154 LYS CA . 50715 1 74 . 1 . 1 16 16 LYS CB C 13 33.059 0.019 . 1 . . . . . 154 LYS CB . 50715 1 75 . 1 . 1 16 16 LYS N N 15 119.478 0.017 . 1 . . . . . 154 LYS N . 50715 1 76 . 1 . 1 17 17 ALA H H 1 8.079 0.001 . 1 . . . . . 155 ALA HN . 50715 1 77 . 1 . 1 17 17 ALA C C 13 176.770 0.000 . 1 . . . . . 155 ALA C . 50715 1 78 . 1 . 1 17 17 ALA CA C 13 49.805 0.021 . 1 . . . . . 155 ALA CA . 50715 1 79 . 1 . 1 17 17 ALA CB C 13 23.536 0.017 . 1 . . . . . 155 ALA CB . 50715 1 80 . 1 . 1 17 17 ALA N N 15 121.347 0.016 . 1 . . . . . 155 ALA N . 50715 1 81 . 1 . 1 18 18 THR H H 1 8.757 0.002 . 1 . . . . . 156 THR HN . 50715 1 82 . 1 . 1 18 18 THR C C 13 172.994 0.002 . 1 . . . . . 156 THR C . 50715 1 83 . 1 . 1 18 18 THR CA C 13 59.467 0.000 . 1 . . . . . 156 THR CA . 50715 1 84 . 1 . 1 18 18 THR CB C 13 69.850 0.089 . 1 . . . . . 156 THR CB . 50715 1 85 . 1 . 1 18 18 THR N N 15 112.647 0.012 . 1 . . . . . 156 THR N . 50715 1 86 . 1 . 1 19 19 THR H H 1 8.486 0.002 . 1 . . . . . 157 THR HN . 50715 1 87 . 1 . 1 19 19 THR C C 13 175.499 0.002 . 1 . . . . . 157 THR C . 50715 1 88 . 1 . 1 19 19 THR CA C 13 59.377 0.008 . 1 . . . . . 157 THR CA . 50715 1 89 . 1 . 1 19 19 THR CB C 13 72.239 0.028 . 1 . . . . . 157 THR CB . 50715 1 90 . 1 . 1 19 19 THR N N 15 110.884 0.014 . 1 . . . . . 157 THR N . 50715 1 91 . 1 . 1 20 20 ALA H H 1 9.774 0.004 . 1 . . . . . 158 ALA HN . 50715 1 92 . 1 . 1 20 20 ALA C C 13 179.750 0.029 . 1 . . . . . 158 ALA C . 50715 1 93 . 1 . 1 20 20 ALA CA C 13 55.010 0.020 . 1 . . . . . 158 ALA CA . 50715 1 94 . 1 . 1 20 20 ALA CB C 13 17.446 0.000 . 1 . . . . . 158 ALA CB . 50715 1 95 . 1 . 1 20 20 ALA N N 15 123.366 0.024 . 1 . . . . . 158 ALA N . 50715 1 96 . 1 . 1 21 21 HIS H H 1 8.708 0.003 . 1 . . . . . 159 HIS HN . 50715 1 97 . 1 . 1 21 21 HIS CA C 13 59.839 0.076 . 1 . . . . . 159 HIS CA . 50715 1 98 . 1 . 1 21 21 HIS CB C 13 30.223 0.000 . 1 . . . . . 159 HIS CB . 50715 1 99 . 1 . 1 21 21 HIS N N 15 117.116 0.026 . 1 . . . . . 159 HIS N . 50715 1 100 . 1 . 1 22 22 ASP H H 1 8.076 0.003 . 1 . . . . . 160 ASP HN . 50715 1 101 . 1 . 1 22 22 ASP C C 13 178.919 0.013 . 1 . . . . . 160 ASP C . 50715 1 102 . 1 . 1 22 22 ASP CA C 13 57.048 0.000 . 1 . . . . . 160 ASP CA . 50715 1 103 . 1 . 1 22 22 ASP CB C 13 40.308 0.000 . 1 . . . . . 160 ASP CB . 50715 1 104 . 1 . 1 22 22 ASP N N 15 121.482 0.029 . 1 . . . . . 160 ASP N . 50715 1 105 . 1 . 1 23 23 LEU H H 1 7.794 0.002 . 1 . . . . . 161 LEU HN . 50715 1 106 . 1 . 1 23 23 LEU C C 13 178.014 0.039 . 1 . . . . . 161 LEU C . 50715 1 107 . 1 . 1 23 23 LEU CA C 13 57.403 0.063 . 1 . . . . . 161 LEU CA . 50715 1 108 . 1 . 1 23 23 LEU CB C 13 41.952 0.006 . 1 . . . . . 161 LEU CB . 50715 1 109 . 1 . 1 23 23 LEU N N 15 118.473 0.027 . 1 . . . . . 161 LEU N . 50715 1 110 . 1 . 1 24 24 SER H H 1 8.278 0.003 . 1 . . . . . 162 SER HN . 50715 1 111 . 1 . 1 24 24 SER C C 13 177.652 0.004 . 1 . . . . . 162 SER C . 50715 1 112 . 1 . 1 24 24 SER CA C 13 60.621 0.020 . 1 . . . . . 162 SER CA . 50715 1 113 . 1 . 1 24 24 SER CB C 13 62.593 0.014 . 1 . . . . . 162 SER CB . 50715 1 114 . 1 . 1 24 24 SER N N 15 112.890 0.016 . 1 . . . . . 162 SER N . 50715 1 115 . 1 . 1 25 25 GLY H H 1 7.542 0.001 . 1 . . . . . 163 GLY HN . 50715 1 116 . 1 . 1 25 25 GLY C C 13 176.335 0.001 . 1 . . . . . 163 GLY C . 50715 1 117 . 1 . 1 25 25 GLY CA C 13 46.343 0.010 . 1 . . . . . 163 GLY CA . 50715 1 118 . 1 . 1 25 25 GLY N N 15 106.238 0.054 . 1 . . . . . 163 GLY N . 50715 1 119 . 1 . 1 26 26 LYS H H 1 7.751 0.002 . 1 . . . . . 164 LYS HN . 50715 1 120 . 1 . 1 26 26 LYS C C 13 178.507 0.017 . 1 . . . . . 164 LYS C . 50715 1 121 . 1 . 1 26 26 LYS CA C 13 57.270 0.027 . 1 . . . . . 164 LYS CA . 50715 1 122 . 1 . 1 26 26 LYS CB C 13 31.701 0.022 . 1 . . . . . 164 LYS CB . 50715 1 123 . 1 . 1 26 26 LYS N N 15 119.910 0.024 . 1 . . . . . 164 LYS N . 50715 1 124 . 1 . 1 27 27 LEU H H 1 8.201 0.002 . 1 . . . . . 165 LEU HN . 50715 1 125 . 1 . 1 27 27 LEU C C 13 178.349 0.003 . 1 . . . . . 165 LEU C . 50715 1 126 . 1 . 1 27 27 LEU CA C 13 54.574 0.000 . 1 . . . . . 165 LEU CA . 50715 1 127 . 1 . 1 27 27 LEU CB C 13 40.360 0.000 . 1 . . . . . 165 LEU CB . 50715 1 128 . 1 . 1 27 27 LEU N N 15 115.348 0.026 . 1 . . . . . 165 LEU N . 50715 1 129 . 1 . 1 28 28 GLY H H 1 7.711 0.002 . 1 . . . . . 166 GLY HN . 50715 1 130 . 1 . 1 28 28 GLY C C 13 174.117 0.007 . 1 . . . . . 166 GLY C . 50715 1 131 . 1 . 1 28 28 GLY CA C 13 46.764 0.015 . 1 . . . . . 166 GLY CA . 50715 1 132 . 1 . 1 28 28 GLY N N 15 110.605 0.016 . 1 . . . . . 166 GLY N . 50715 1 133 . 1 . 1 29 29 THR H H 1 7.413 0.002 . 1 . . . . . 167 THR HN . 50715 1 134 . 1 . 1 29 29 THR C C 13 171.200 0.000 . 1 . . . . . 167 THR C . 50715 1 135 . 1 . 1 29 29 THR CA C 13 59.258 0.000 . 1 . . . . . 167 THR CA . 50715 1 136 . 1 . 1 29 29 THR CB C 13 72.795 0.000 . 1 . . . . . 167 THR CB . 50715 1 137 . 1 . 1 29 29 THR N N 15 115.069 0.012 . 1 . . . . . 167 THR N . 50715 1 138 . 1 . 1 30 30 PRO C C 13 177.341 0.000 . 1 . . . . . 168 PRO C . 50715 1 139 . 1 . 1 30 30 PRO CA C 13 62.888 0.000 . 1 . . . . . 168 PRO CA . 50715 1 140 . 1 . 1 30 30 PRO CB C 13 32.125 0.000 . 1 . . . . . 168 PRO CB . 50715 1 141 . 1 . 1 31 31 LYS H H 1 8.878 0.004 . 1 . . . . . 169 LYS HN . 50715 1 142 . 1 . 1 31 31 LYS C C 13 177.640 0.004 . 1 . . . . . 169 LYS C . 50715 1 143 . 1 . 1 31 31 LYS CA C 13 60.343 0.000 . 1 . . . . . 169 LYS CA . 50715 1 144 . 1 . 1 31 31 LYS CB C 13 31.173 0.000 . 1 . . . . . 169 LYS CB . 50715 1 145 . 1 . 1 31 31 LYS N N 15 125.621 0.027 . 1 . . . . . 169 LYS N . 50715 1 146 . 1 . 1 32 32 LYS H H 1 8.803 0.003 . 1 . . . . . 170 LYS HN . 50715 1 147 . 1 . 1 32 32 LYS C C 13 178.887 0.048 . 1 . . . . . 170 LYS C . 50715 1 148 . 1 . 1 32 32 LYS CA C 13 59.424 0.014 . 1 . . . . . 170 LYS CA . 50715 1 149 . 1 . 1 32 32 LYS CB C 13 31.414 0.115 . 1 . . . . . 170 LYS CB . 50715 1 150 . 1 . 1 32 32 LYS N N 15 117.176 0.013 . 1 . . . . . 170 LYS N . 50715 1 151 . 1 . 1 33 33 GLU H H 1 7.008 0.002 . 1 . . . . . 171 GLU HN . 50715 1 152 . 1 . 1 33 33 GLU C C 13 178.530 0.010 . 1 . . . . . 171 GLU C . 50715 1 153 . 1 . 1 33 33 GLU CA C 13 57.561 0.024 . 1 . . . . . 171 GLU CA . 50715 1 154 . 1 . 1 33 33 GLU CB C 13 28.607 0.081 . 1 . . . . . 171 GLU CB . 50715 1 155 . 1 . 1 33 33 GLU N N 15 118.099 0.011 . 1 . . . . . 171 GLU N . 50715 1 156 . 1 . 1 34 34 ILE H H 1 7.548 0.002 . 1 . . . . . 172 ILE HN . 50715 1 157 . 1 . 1 34 34 ILE C C 13 177.695 0.012 . 1 . . . . . 172 ILE C . 50715 1 158 . 1 . 1 34 34 ILE CA C 13 61.954 0.025 . 1 . . . . . 172 ILE CA . 50715 1 159 . 1 . 1 34 34 ILE CB C 13 34.956 0.029 . 1 . . . . . 172 ILE CB . 50715 1 160 . 1 . 1 34 34 ILE N N 15 118.659 0.014 . 1 . . . . . 172 ILE N . 50715 1 161 . 1 . 1 35 35 ASN H H 1 8.646 0.001 . 1 . . . . . 173 ASN HN . 50715 1 162 . 1 . 1 35 35 ASN C C 13 177.074 0.019 . 1 . . . . . 173 ASN C . 50715 1 163 . 1 . 1 35 35 ASN CA C 13 55.704 0.054 . 1 . . . . . 173 ASN CA . 50715 1 164 . 1 . 1 35 35 ASN CB C 13 37.538 0.010 . 1 . . . . . 173 ASN CB . 50715 1 165 . 1 . 1 35 35 ASN N N 15 116.775 0.039 . 1 . . . . . 173 ASN N . 50715 1 166 . 1 . 1 36 36 ARG H H 1 7.303 0.002 . 1 . . . . . 174 ARG HN . 50715 1 167 . 1 . 1 36 36 ARG C C 13 179.268 0.037 . 1 . . . . . 174 ARG C . 50715 1 168 . 1 . 1 36 36 ARG CA C 13 59.447 0.031 . 1 . . . . . 174 ARG CA . 50715 1 169 . 1 . 1 36 36 ARG CB C 13 29.107 0.024 . 1 . . . . . 174 ARG CB . 50715 1 170 . 1 . 1 36 36 ARG N N 15 118.150 0.046 . 1 . . . . . 174 ARG N . 50715 1 171 . 1 . 1 37 37 VAL H H 1 7.487 0.003 . 1 . . . . . 175 VAL HN . 50715 1 172 . 1 . 1 37 37 VAL C C 13 178.069 0.011 . 1 . . . . . 175 VAL C . 50715 1 173 . 1 . 1 37 37 VAL CA C 13 65.423 0.003 . 1 . . . . . 175 VAL CA . 50715 1 174 . 1 . 1 37 37 VAL CB C 13 30.469 0.000 . 1 . . . . . 175 VAL CB . 50715 1 175 . 1 . 1 37 37 VAL N N 15 119.817 0.034 . 1 . . . . . 175 VAL N . 50715 1 176 . 1 . 1 38 38 LEU H H 1 8.484 0.001 . 1 . . . . . 176 LEU HN . 50715 1 177 . 1 . 1 38 38 LEU C C 13 178.603 0.043 . 1 . . . . . 176 LEU C . 50715 1 178 . 1 . 1 38 38 LEU CA C 13 57.712 0.074 . 1 . . . . . 176 LEU CA . 50715 1 179 . 1 . 1 38 38 LEU CB C 13 37.855 0.031 . 1 . . . . . 176 LEU CB . 50715 1 180 . 1 . 1 38 38 LEU N N 15 121.259 0.010 . 1 . . . . . 176 LEU N . 50715 1 181 . 1 . 1 39 39 TYR H H 1 7.995 0.001 . 1 . . . . . 177 TYR HN . 50715 1 182 . 1 . 1 39 39 TYR C C 13 179.341 0.000 . 1 . . . . . 177 TYR C . 50715 1 183 . 1 . 1 39 39 TYR CA C 13 62.149 0.000 . 1 . . . . . 177 TYR CA . 50715 1 184 . 1 . 1 39 39 TYR CB C 13 36.671 0.006 . 1 . . . . . 177 TYR CB . 50715 1 185 . 1 . 1 39 39 TYR N N 15 115.172 0.026 . 1 . . . . . 177 TYR N . 50715 1 186 . 1 . 1 40 40 SER H H 1 7.672 0.001 . 1 . . . . . 178 SER HN . 50715 1 187 . 1 . 1 40 40 SER C C 13 177.474 0.011 . 1 . . . . . 178 SER C . 50715 1 188 . 1 . 1 40 40 SER CA C 13 60.993 0.000 . 1 . . . . . 178 SER CA . 50715 1 189 . 1 . 1 40 40 SER CB C 13 62.227 0.002 . 1 . . . . . 178 SER CB . 50715 1 190 . 1 . 1 40 40 SER N N 15 115.627 0.035 . 1 . . . . . 178 SER N . 50715 1 191 . 1 . 1 41 41 LEU H H 1 8.552 0.001 . 1 . . . . . 179 LEU HN . 50715 1 192 . 1 . 1 41 41 LEU C C 13 180.140 0.015 . 1 . . . . . 179 LEU C . 50715 1 193 . 1 . 1 41 41 LEU CA C 13 57.185 0.003 . 1 . . . . . 179 LEU CA . 50715 1 194 . 1 . 1 41 41 LEU CB C 13 41.536 0.026 . 1 . . . . . 179 LEU CB . 50715 1 195 . 1 . 1 41 41 LEU N N 15 120.719 0.025 . 1 . . . . . 179 LEU N . 50715 1 196 . 1 . 1 42 42 ALA H H 1 8.732 0.002 . 1 . . . . . 180 ALA HN . 50715 1 197 . 1 . 1 42 42 ALA C C 13 181.795 0.003 . 1 . . . . . 180 ALA C . 50715 1 198 . 1 . 1 42 42 ALA CA C 13 54.697 0.013 . 1 . . . . . 180 ALA CA . 50715 1 199 . 1 . 1 42 42 ALA CB C 13 17.138 0.033 . 1 . . . . . 180 ALA CB . 50715 1 200 . 1 . 1 42 42 ALA N N 15 123.477 0.031 . 1 . . . . . 180 ALA N . 50715 1 201 . 1 . 1 43 43 LYS H H 1 8.144 0.004 . 1 . . . . . 181 LYS HN . 50715 1 202 . 1 . 1 43 43 LYS C C 13 178.673 0.026 . 1 . . . . . 181 LYS C . 50715 1 203 . 1 . 1 43 43 LYS CA C 13 58.820 0.019 . 1 . . . . . 181 LYS CA . 50715 1 204 . 1 . 1 43 43 LYS CB C 13 31.044 0.000 . 1 . . . . . 181 LYS CB . 50715 1 205 . 1 . 1 43 43 LYS N N 15 121.696 0.034 . 1 . . . . . 181 LYS N . 50715 1 206 . 1 . 1 44 44 LYS H H 1 7.493 0.002 . 1 . . . . . 182 LYS HN . 50715 1 207 . 1 . 1 44 44 LYS C C 13 176.630 0.009 . 1 . . . . . 182 LYS C . 50715 1 208 . 1 . 1 44 44 LYS CA C 13 56.463 0.055 . 1 . . . . . 182 LYS CA . 50715 1 209 . 1 . 1 44 44 LYS CB C 13 32.627 0.025 . 1 . . . . . 182 LYS CB . 50715 1 210 . 1 . 1 44 44 LYS N N 15 115.214 0.031 . 1 . . . . . 182 LYS N . 50715 1 211 . 1 . 1 45 45 GLY H H 1 7.927 0.002 . 1 . . . . . 183 GLY HN . 50715 1 212 . 1 . 1 45 45 GLY C C 13 174.556 0.005 . 1 . . . . . 183 GLY C . 50715 1 213 . 1 . 1 45 45 GLY CA C 13 45.247 0.004 . 1 . . . . . 183 GLY CA . 50715 1 214 . 1 . 1 45 45 GLY N N 15 107.059 0.015 . 1 . . . . . 183 GLY N . 50715 1 215 . 1 . 1 46 46 LYS H H 1 7.950 0.001 . 1 . . . . . 184 LYS HN . 50715 1 216 . 1 . 1 46 46 LYS C C 13 176.882 0.025 . 1 . . . . . 184 LYS C . 50715 1 217 . 1 . 1 46 46 LYS CA C 13 55.975 0.017 . 1 . . . . . 184 LYS CA . 50715 1 218 . 1 . 1 46 46 LYS CB C 13 32.612 0.000 . 1 . . . . . 184 LYS CB . 50715 1 219 . 1 . 1 46 46 LYS N N 15 115.367 0.018 . 1 . . . . . 184 LYS N . 50715 1 220 . 1 . 1 47 47 LEU H H 1 6.877 0.003 . 1 . . . . . 185 LEU HN . 50715 1 221 . 1 . 1 47 47 LEU C C 13 175.261 0.033 . 1 . . . . . 185 LEU C . 50715 1 222 . 1 . 1 47 47 LEU CA C 13 52.172 0.023 . 1 . . . . . 185 LEU CA . 50715 1 223 . 1 . 1 47 47 LEU CB C 13 45.736 0.025 . 1 . . . . . 185 LEU CB . 50715 1 224 . 1 . 1 47 47 LEU N N 15 113.820 0.041 . 1 . . . . . 185 LEU N . 50715 1 225 . 1 . 1 48 48 GLN H H 1 9.237 0.002 . 1 . . . . . 186 GLN HN . 50715 1 226 . 1 . 1 48 48 GLN C C 13 172.709 0.013 . 1 . . . . . 186 GLN C . 50715 1 227 . 1 . 1 48 48 GLN CA C 13 53.940 0.001 . 1 . . . . . 186 GLN CA . 50715 1 228 . 1 . 1 48 48 GLN CB C 13 31.647 0.015 . 1 . . . . . 186 GLN CB . 50715 1 229 . 1 . 1 48 48 GLN N N 15 118.784 0.009 . 1 . . . . . 186 GLN N . 50715 1 230 . 1 . 1 49 49 LYS H H 1 8.237 0.002 . 1 . . . . . 187 LYS HN . 50715 1 231 . 1 . 1 49 49 LYS C C 13 176.250 0.005 . 1 . . . . . 187 LYS C . 50715 1 232 . 1 . 1 49 49 LYS CA C 13 53.862 0.000 . 1 . . . . . 187 LYS CA . 50715 1 233 . 1 . 1 49 49 LYS CB C 13 32.960 0.085 . 1 . . . . . 187 LYS CB . 50715 1 234 . 1 . 1 49 49 LYS N N 15 123.958 0.017 . 1 . . . . . 187 LYS N . 50715 1 235 . 1 . 1 50 50 GLU H H 1 8.998 0.002 . 1 . . . . . 188 GLU HN . 50715 1 236 . 1 . 1 50 50 GLU C C 13 175.359 0.005 . 1 . . . . . 188 GLU C . 50715 1 237 . 1 . 1 50 50 GLU CA C 13 54.047 0.066 . 1 . . . . . 188 GLU CA . 50715 1 238 . 1 . 1 50 50 GLU CB C 13 30.671 0.005 . 1 . . . . . 188 GLU CB . 50715 1 239 . 1 . 1 50 50 GLU N N 15 127.809 0.038 . 1 . . . . . 188 GLU N . 50715 1 240 . 1 . 1 51 51 ALA H H 1 8.226 0.002 . 1 . . . . . 189 ALA HN . 50715 1 241 . 1 . 1 51 51 ALA C C 13 177.165 0.001 . 1 . . . . . 189 ALA C . 50715 1 242 . 1 . 1 51 51 ALA CA C 13 52.462 0.047 . 1 . . . . . 189 ALA CA . 50715 1 243 . 1 . 1 51 51 ALA CB C 13 18.240 0.026 . 1 . . . . . 189 ALA CB . 50715 1 244 . 1 . 1 51 51 ALA N N 15 124.911 0.052 . 1 . . . . . 189 ALA N . 50715 1 245 . 1 . 1 52 52 GLY H H 1 7.662 0.002 . 1 . . . . . 190 GLY HN . 50715 1 246 . 1 . 1 52 52 GLY C C 13 172.059 0.010 . 1 . . . . . 190 GLY C . 50715 1 247 . 1 . 1 52 52 GLY CA C 13 44.245 0.001 . 1 . . . . . 190 GLY CA . 50715 1 248 . 1 . 1 52 52 GLY N N 15 107.017 0.010 . 1 . . . . . 190 GLY N . 50715 1 249 . 1 . 1 53 53 THR H H 1 8.175 0.002 . 1 . . . . . 191 THR HN . 50715 1 250 . 1 . 1 53 53 THR C C 13 172.936 0.000 . 1 . . . . . 191 THR C . 50715 1 251 . 1 . 1 53 53 THR CA C 13 57.242 0.000 . 1 . . . . . 191 THR CA . 50715 1 252 . 1 . 1 53 53 THR CB C 13 69.960 0.000 . 1 . . . . . 191 THR CB . 50715 1 253 . 1 . 1 53 53 THR N N 15 113.551 0.021 . 1 . . . . . 191 THR N . 50715 1 254 . 1 . 1 55 55 PRO C C 13 175.187 0.000 . 1 . . . . . 193 PRO C . 50715 1 255 . 1 . 1 55 55 PRO CA C 13 62.822 0.000 . 1 . . . . . 193 PRO CA . 50715 1 256 . 1 . 1 55 55 PRO CB C 13 31.281 0.000 . 1 . . . . . 193 PRO CB . 50715 1 257 . 1 . 1 56 56 LEU H H 1 7.361 0.002 . 1 . . . . . 194 LEU HN . 50715 1 258 . 1 . 1 56 56 LEU C C 13 175.574 0.040 . 1 . . . . . 194 LEU C . 50715 1 259 . 1 . 1 56 56 LEU CA C 13 52.741 0.054 . 1 . . . . . 194 LEU CA . 50715 1 260 . 1 . 1 56 56 LEU CB C 13 44.083 0.020 . 1 . . . . . 194 LEU CB . 50715 1 261 . 1 . 1 56 56 LEU N N 15 119.640 0.010 . 1 . . . . . 194 LEU N . 50715 1 262 . 1 . 1 57 57 TRP H H 1 8.953 0.002 . 1 . . . . . 195 TRP HN . 50715 1 263 . 1 . 1 57 57 TRP HE1 H 1 9.803 0.000 . 1 . . . . . 195 TRP HE1 . 50715 1 264 . 1 . 1 57 57 TRP C C 13 175.025 0.005 . 1 . . . . . 195 TRP C . 50715 1 265 . 1 . 1 57 57 TRP CA C 13 55.691 0.021 . 1 . . . . . 195 TRP CA . 50715 1 266 . 1 . 1 57 57 TRP CB C 13 31.286 0.014 . 1 . . . . . 195 TRP CB . 50715 1 267 . 1 . 1 57 57 TRP N N 15 119.968 0.020 . 1 . . . . . 195 TRP N . 50715 1 268 . 1 . 1 57 57 TRP NE1 N 15 127.612 0.000 . 1 . . . . . 195 TRP NE1 . 50715 1 269 . 1 . 1 58 58 LYS H H 1 8.597 0.001 . 1 . . . . . 196 LYS HN . 50715 1 270 . 1 . 1 58 58 LYS C C 13 175.210 0.001 . 1 . . . . . 196 LYS C . 50715 1 271 . 1 . 1 58 58 LYS CA C 13 53.711 0.055 . 1 . . . . . 196 LYS CA . 50715 1 272 . 1 . 1 58 58 LYS CB C 13 36.021 0.000 . 1 . . . . . 196 LYS CB . 50715 1 273 . 1 . 1 58 58 LYS N N 15 116.367 0.029 . 1 . . . . . 196 LYS N . 50715 1 274 . 1 . 1 59 59 ILE H H 1 8.819 0.001 . 1 . . . . . 197 ILE HN . 50715 1 275 . 1 . 1 59 59 ILE C C 13 175.809 0.000 . 1 . . . . . 197 ILE C . 50715 1 276 . 1 . 1 59 59 ILE CA C 13 61.377 0.023 . 1 . . . . . 197 ILE CA . 50715 1 277 . 1 . 1 59 59 ILE CB C 13 37.114 0.004 . 1 . . . . . 197 ILE CB . 50715 1 278 . 1 . 1 59 59 ILE N N 15 121.474 0.019 . 1 . . . . . 197 ILE N . 50715 1 279 . 1 . 1 60 60 ALA H H 1 7.731 0.001 . 1 . . . . . 198 ALA HN . 50715 1 280 . 1 . 1 60 60 ALA C C 13 176.982 0.022 . 1 . . . . . 198 ALA C . 50715 1 281 . 1 . 1 60 60 ALA CA C 13 51.836 0.057 . 1 . . . . . 198 ALA CA . 50715 1 282 . 1 . 1 60 60 ALA CB C 13 18.428 0.008 . 1 . . . . . 198 ALA CB . 50715 1 283 . 1 . 1 60 60 ALA N N 15 128.354 0.010 . 1 . . . . . 198 ALA N . 50715 1 284 . 1 . 1 61 61 VAL H H 1 8.003 0.003 . 1 . . . . . 199 VAL HN . 50715 1 285 . 1 . 1 61 61 VAL C C 13 176.266 0.013 . 1 . . . . . 199 VAL C . 50715 1 286 . 1 . 1 61 61 VAL CA C 13 61.621 0.023 . 1 . . . . . 199 VAL CA . 50715 1 287 . 1 . 1 61 61 VAL CB C 13 32.177 0.009 . 1 . . . . . 199 VAL CB . 50715 1 288 . 1 . 1 61 61 VAL N N 15 120.081 0.041 . 1 . . . . . 199 VAL N . 50715 1 289 . 1 . 1 62 62 SER H H 1 8.404 0.001 . 1 . . . . . 200 SER HN . 50715 1 290 . 1 . 1 62 62 SER C C 13 174.983 0.000 . 1 . . . . . 200 SER C . 50715 1 291 . 1 . 1 62 62 SER CA C 13 57.764 0.003 . 1 . . . . . 200 SER CA . 50715 1 292 . 1 . 1 62 62 SER CB C 13 63.167 0.002 . 1 . . . . . 200 SER CB . 50715 1 293 . 1 . 1 62 62 SER N N 15 119.122 0.047 . 1 . . . . . 200 SER N . 50715 1 294 . 1 . 1 63 63 THR H H 1 8.168 0.000 . 1 . . . . . 201 THR HN . 50715 1 295 . 1 . 1 63 63 THR C C 13 176.373 0.000 . 1 . . . . . 201 THR C . 50715 1 296 . 1 . 1 63 63 THR CA C 13 61.680 0.002 . 1 . . . . . 201 THR CA . 50715 1 297 . 1 . 1 63 63 THR CB C 13 68.986 0.002 . 1 . . . . . 201 THR CB . 50715 1 298 . 1 . 1 63 63 THR N N 15 115.804 0.053 . 1 . . . . . 201 THR N . 50715 1 299 . 1 . 1 64 64 GLN H H 1 8.211 0.001 . 1 . . . . . 202 GLN HN . 50715 1 300 . 1 . 1 64 64 GLN C C 13 175.885 0.006 . 1 . . . . . 202 GLN C . 50715 1 301 . 1 . 1 64 64 GLN CA C 13 55.575 0.057 . 1 . . . . . 202 GLN CA . 50715 1 302 . 1 . 1 64 64 GLN CB C 13 28.495 0.007 . 1 . . . . . 202 GLN CB . 50715 1 303 . 1 . 1 64 64 GLN N N 15 121.747 0.066 . 1 . . . . . 202 GLN N . 50715 1 304 . 1 . 1 65 65 ALA H H 1 8.168 0.002 . 1 . . . . . 203 ALA HN . 50715 1 305 . 1 . 1 65 65 ALA C C 13 177.747 0.019 . 1 . . . . . 203 ALA C . 50715 1 306 . 1 . 1 65 65 ALA CA C 13 52.398 0.017 . 1 . . . . . 203 ALA CA . 50715 1 307 . 1 . 1 65 65 ALA CB C 13 18.292 0.002 . 1 . . . . . 203 ALA CB . 50715 1 308 . 1 . 1 65 65 ALA N N 15 124.324 0.056 . 1 . . . . . 203 ALA N . 50715 1 309 . 1 . 1 66 66 TRP H H 1 7.919 0.002 . 1 . . . . . 204 TRP HN . 50715 1 310 . 1 . 1 66 66 TRP C C 13 176.141 0.008 . 1 . . . . . 204 TRP C . 50715 1 311 . 1 . 1 66 66 TRP CA C 13 57.078 0.024 . 1 . . . . . 204 TRP CA . 50715 1 312 . 1 . 1 66 66 TRP CB C 13 28.713 0.011 . 1 . . . . . 204 TRP CB . 50715 1 313 . 1 . 1 66 66 TRP N N 15 119.163 0.034 . 1 . . . . . 204 TRP N . 50715 1 314 . 1 . 1 67 67 ASN H H 1 7.979 0.002 . 1 . . . . . 205 ASN HN . 50715 1 315 . 1 . 1 67 67 ASN C C 13 175.004 0.012 . 1 . . . . . 205 ASN C . 50715 1 316 . 1 . 1 67 67 ASN CA C 13 52.700 0.012 . 1 . . . . . 205 ASN CA . 50715 1 317 . 1 . 1 67 67 ASN CB C 13 38.133 0.008 . 1 . . . . . 205 ASN CB . 50715 1 318 . 1 . 1 67 67 ASN N N 15 119.729 0.018 . 1 . . . . . 205 ASN N . 50715 1 319 . 1 . 1 68 68 GLN H H 1 7.992 0.004 . 1 . . . . . 206 GLN HN . 50715 1 320 . 1 . 1 68 68 GLN C C 13 175.946 0.000 . 1 . . . . . 206 GLN C . 50715 1 321 . 1 . 1 68 68 GLN CA C 13 55.864 0.000 . 1 . . . . . 206 GLN CA . 50715 1 322 . 1 . 1 68 68 GLN CB C 13 28.424 0.000 . 1 . . . . . 206 GLN CB . 50715 1 323 . 1 . 1 68 68 GLN N N 15 119.746 0.036 . 1 . . . . . 206 GLN N . 50715 1 324 . 1 . 1 69 69 HIS H H 1 8.290 0.000 . 1 . . . . . 207 HIS HN . 50715 1 325 . 1 . 1 69 69 HIS N N 15 119.207 0.000 . 1 . . . . . 207 HIS N . 50715 1 326 . 1 . 1 70 70 SER H H 1 8.157 0.001 . 1 . . . . . 208 SER HN . 50715 1 327 . 1 . 1 70 70 SER C C 13 174.923 0.000 . 1 . . . . . 208 SER C . 50715 1 328 . 1 . 1 70 70 SER CA C 13 58.235 0.002 . 1 . . . . . 208 SER CA . 50715 1 329 . 1 . 1 70 70 SER CB C 13 63.148 0.004 . 1 . . . . . 208 SER CB . 50715 1 330 . 1 . 1 70 70 SER N N 15 116.332 0.043 . 1 . . . . . 208 SER N . 50715 1 331 . 1 . 1 71 71 GLY H H 1 8.374 0.003 . 1 . . . . . 209 GLY HN . 50715 1 332 . 1 . 1 71 71 GLY C C 13 173.909 0.015 . 1 . . . . . 209 GLY C . 50715 1 333 . 1 . 1 71 71 GLY CA C 13 44.930 0.001 . 1 . . . . . 209 GLY CA . 50715 1 334 . 1 . 1 71 71 GLY N N 15 110.690 0.052 . 1 . . . . . 209 GLY N . 50715 1 335 . 1 . 1 72 72 VAL H H 1 7.854 0.004 . 1 . . . . . 210 VAL HN . 50715 1 336 . 1 . 1 72 72 VAL C C 13 176.038 0.003 . 1 . . . . . 210 VAL C . 50715 1 337 . 1 . 1 72 72 VAL CA C 13 61.753 0.000 . 1 . . . . . 210 VAL CA . 50715 1 338 . 1 . 1 72 72 VAL CB C 13 31.939 0.000 . 1 . . . . . 210 VAL CB . 50715 1 339 . 1 . 1 72 72 VAL N N 15 119.243 0.046 . 1 . . . . . 210 VAL N . 50715 1 340 . 1 . 1 73 73 VAL H H 1 8.160 0.004 . 1 . . . . . 211 VAL HN . 50715 1 341 . 1 . 1 73 73 VAL C C 13 175.771 0.020 . 1 . . . . . 211 VAL C . 50715 1 342 . 1 . 1 73 73 VAL CA C 13 61.716 0.010 . 1 . . . . . 211 VAL CA . 50715 1 343 . 1 . 1 73 73 VAL CB C 13 31.814 0.025 . 1 . . . . . 211 VAL CB . 50715 1 344 . 1 . 1 73 73 VAL N N 15 124.400 0.037 . 1 . . . . . 211 VAL N . 50715 1 345 . 1 . 1 74 74 ARG H H 1 8.374 0.002 . 1 . . . . . 212 ARG HN . 50715 1 346 . 1 . 1 74 74 ARG C C 13 174.480 0.000 . 1 . . . . . 212 ARG C . 50715 1 347 . 1 . 1 74 74 ARG CA C 13 53.284 0.014 . 1 . . . . . 212 ARG CA . 50715 1 348 . 1 . 1 74 74 ARG CB C 13 29.516 0.000 . 1 . . . . . 212 ARG CB . 50715 1 349 . 1 . 1 74 74 ARG N N 15 126.011 0.048 . 1 . . . . . 212 ARG N . 50715 1 350 . 1 . 1 75 75 PRO C C 13 176.679 0.000 . 1 . . . . . 213 PRO C . 50715 1 351 . 1 . 1 75 75 PRO CA C 13 62.981 0.000 . 1 . . . . . 213 PRO CA . 50715 1 352 . 1 . 1 75 75 PRO CB C 13 31.100 0.000 . 1 . . . . . 213 PRO CB . 50715 1 353 . 1 . 1 76 76 ASP H H 1 8.264 0.001 . 1 . . . . . 214 ASP HN . 50715 1 354 . 1 . 1 76 76 ASP C C 13 176.847 0.041 . 1 . . . . . 214 ASP C . 50715 1 355 . 1 . 1 76 76 ASP CA C 13 53.764 0.007 . 1 . . . . . 214 ASP CA . 50715 1 356 . 1 . 1 76 76 ASP CB C 13 40.616 0.002 . 1 . . . . . 214 ASP CB . 50715 1 357 . 1 . 1 76 76 ASP N N 15 119.374 0.046 . 1 . . . . . 214 ASP N . 50715 1 358 . 1 . 1 77 77 GLY H H 1 8.236 0.002 . 1 . . . . . 215 GLY HN . 50715 1 359 . 1 . 1 77 77 GLY C C 13 174.347 0.012 . 1 . . . . . 215 GLY C . 50715 1 360 . 1 . 1 77 77 GLY CA C 13 45.174 0.009 . 1 . . . . . 215 GLY CA . 50715 1 361 . 1 . 1 77 77 GLY N N 15 108.638 0.057 . 1 . . . . . 215 GLY N . 50715 1 362 . 1 . 1 78 78 HIS H H 1 8.260 0.001 . 1 . . . . . 216 HIS HN . 50715 1 363 . 1 . 1 78 78 HIS CA C 13 55.649 0.005 . 1 . . . . . 216 HIS CA . 50715 1 364 . 1 . 1 78 78 HIS CB C 13 29.282 0.006 . 1 . . . . . 216 HIS CB . 50715 1 365 . 1 . 1 78 78 HIS N N 15 118.659 0.054 . 1 . . . . . 216 HIS N . 50715 1 366 . 1 . 1 79 79 SER H H 1 8.321 0.002 . 1 . . . . . 217 SER HN . 50715 1 367 . 1 . 1 79 79 SER C C 13 174.512 0.000 . 1 . . . . . 217 SER C . 50715 1 368 . 1 . 1 79 79 SER CA C 13 58.102 0.007 . 1 . . . . . 217 SER CA . 50715 1 369 . 1 . 1 79 79 SER CB C 13 63.085 0.020 . 1 . . . . . 217 SER CB . 50715 1 370 . 1 . 1 79 79 SER N N 15 116.882 0.041 . 1 . . . . . 217 SER N . 50715 1 371 . 1 . 1 80 80 GLN H H 1 8.425 0.002 . 1 . . . . . 218 GLN HN . 50715 1 372 . 1 . 1 80 80 GLN C C 13 176.326 0.009 . 1 . . . . . 218 GLN C . 50715 1 373 . 1 . 1 80 80 GLN CA C 13 55.674 0.010 . 1 . . . . . 218 GLN CA . 50715 1 374 . 1 . 1 80 80 GLN CB C 13 28.698 0.001 . 1 . . . . . 218 GLN CB . 50715 1 375 . 1 . 1 80 80 GLN N N 15 121.939 0.021 . 1 . . . . . 218 GLN N . 50715 1 376 . 1 . 1 81 81 GLY H H 1 8.325 0.001 . 1 . . . . . 219 GLY HN . 50715 1 377 . 1 . 1 81 81 GLY C C 13 173.325 0.023 . 1 . . . . . 219 GLY C . 50715 1 378 . 1 . 1 81 81 GLY CA C 13 44.654 0.016 . 1 . . . . . 219 GLY CA . 50715 1 379 . 1 . 1 81 81 GLY N N 15 109.774 0.024 . 1 . . . . . 219 GLY N . 50715 1 380 . 1 . 1 82 82 ALA H H 1 8.078 0.002 . 1 . . . . . 220 ALA HN . 50715 1 381 . 1 . 1 82 82 ALA C C 13 175.753 0.000 . 1 . . . . . 220 ALA C . 50715 1 382 . 1 . 1 82 82 ALA CA C 13 50.027 0.000 . 1 . . . . . 220 ALA CA . 50715 1 383 . 1 . 1 82 82 ALA CB C 13 17.550 0.000 . 1 . . . . . 220 ALA CB . 50715 1 384 . 1 . 1 82 82 ALA N N 15 124.581 0.051 . 1 . . . . . 220 ALA N . 50715 1 385 . 1 . 1 83 83 PRO C C 13 176.802 0.000 . 1 . . . . . 221 PRO C . 50715 1 386 . 1 . 1 83 83 PRO CA C 13 62.838 0.000 . 1 . . . . . 221 PRO CA . 50715 1 387 . 1 . 1 83 83 PRO CB C 13 31.109 0.000 . 1 . . . . . 221 PRO CB . 50715 1 388 . 1 . 1 84 84 ASN H H 1 8.426 0.002 . 1 . . . . . 222 ASN HN . 50715 1 389 . 1 . 1 84 84 ASN C C 13 175.100 0.001 . 1 . . . . . 222 ASN C . 50715 1 390 . 1 . 1 84 84 ASN CA C 13 53.029 0.001 . 1 . . . . . 222 ASN CA . 50715 1 391 . 1 . 1 84 84 ASN CB C 13 38.380 0.001 . 1 . . . . . 222 ASN CB . 50715 1 392 . 1 . 1 84 84 ASN N N 15 118.113 0.046 . 1 . . . . . 222 ASN N . 50715 1 393 . 1 . 1 85 85 SER H H 1 8.138 0.002 . 1 . . . . . 223 SER HN . 50715 1 394 . 1 . 1 85 85 SER C C 13 173.816 0.006 . 1 . . . . . 223 SER C . 50715 1 395 . 1 . 1 85 85 SER CA C 13 57.717 0.001 . 1 . . . . . 223 SER CA . 50715 1 396 . 1 . 1 85 85 SER CB C 13 63.319 0.002 . 1 . . . . . 223 SER CB . 50715 1 397 . 1 . 1 85 85 SER N N 15 115.687 0.062 . 1 . . . . . 223 SER N . 50715 1 398 . 1 . 1 86 86 ASP H H 1 8.263 0.001 . 1 . . . . . 224 ASP HN . 50715 1 399 . 1 . 1 86 86 ASP C C 13 174.894 0.000 . 1 . . . . . 224 ASP C . 50715 1 400 . 1 . 1 86 86 ASP CA C 13 51.934 0.000 . 1 . . . . . 224 ASP CA . 50715 1 401 . 1 . 1 86 86 ASP CB C 13 40.802 0.000 . 1 . . . . . 224 ASP CB . 50715 1 402 . 1 . 1 86 86 ASP N N 15 123.215 0.052 . 1 . . . . . 224 ASP N . 50715 1 403 . 1 . 1 87 87 PRO C C 13 177.295 0.000 . 1 . . . . . 225 PRO C . 50715 1 404 . 1 . 1 87 87 PRO CA C 13 63.253 0.000 . 1 . . . . . 225 PRO CA . 50715 1 405 . 1 . 1 87 87 PRO CB C 13 31.248 0.000 . 1 . . . . . 225 PRO CB . 50715 1 406 . 1 . 1 88 88 SER H H 1 8.443 0.002 . 1 . . . . . 226 SER HN . 50715 1 407 . 1 . 1 88 88 SER C C 13 174.586 0.001 . 1 . . . . . 226 SER C . 50715 1 408 . 1 . 1 88 88 SER CA C 13 58.625 0.001 . 1 . . . . . 226 SER CA . 50715 1 409 . 1 . 1 88 88 SER CB C 13 62.993 0.003 . 1 . . . . . 226 SER CB . 50715 1 410 . 1 . 1 88 88 SER N N 15 115.272 0.038 . 1 . . . . . 226 SER N . 50715 1 411 . 1 . 1 89 89 LEU H H 1 7.862 0.005 . 1 . . . . . 227 LEU HN . 50715 1 412 . 1 . 1 89 89 LEU C C 13 177.059 0.005 . 1 . . . . . 227 LEU C . 50715 1 413 . 1 . 1 89 89 LEU CA C 13 54.503 0.002 . 1 . . . . . 227 LEU CA . 50715 1 414 . 1 . 1 89 89 LEU CB C 13 41.471 0.009 . 1 . . . . . 227 LEU CB . 50715 1 415 . 1 . 1 89 89 LEU N N 15 123.034 0.049 . 1 . . . . . 227 LEU N . 50715 1 416 . 1 . 1 90 90 GLU H H 1 8.108 0.001 . 1 . . . . . 228 GLU HN . 50715 1 417 . 1 . 1 90 90 GLU C C 13 174.548 0.000 . 1 . . . . . 228 GLU C . 50715 1 418 . 1 . 1 90 90 GLU CA C 13 54.040 0.000 . 1 . . . . . 228 GLU CA . 50715 1 419 . 1 . 1 90 90 GLU CB C 13 28.850 0.000 . 1 . . . . . 228 GLU CB . 50715 1 420 . 1 . 1 90 90 GLU N N 15 122.248 0.062 . 1 . . . . . 228 GLU N . 50715 1 421 . 1 . 1 91 91 PRO C C 13 177.260 0.000 . 1 . . . . . 229 PRO C . 50715 1 422 . 1 . 1 91 91 PRO CA C 13 62.906 0.000 . 1 . . . . . 229 PRO CA . 50715 1 423 . 1 . 1 91 91 PRO CB C 13 31.287 0.000 . 1 . . . . . 229 PRO CB . 50715 1 424 . 1 . 1 92 92 GLU H H 1 8.472 0.001 . 1 . . . . . 230 GLU HN . 50715 1 425 . 1 . 1 92 92 GLU C C 13 176.389 0.000 . 1 . . . . . 230 GLU C . 50715 1 426 . 1 . 1 92 92 GLU CA C 13 56.454 0.006 . 1 . . . . . 230 GLU CA . 50715 1 427 . 1 . 1 92 92 GLU CB C 13 29.529 0.002 . 1 . . . . . 230 GLU CB . 50715 1 428 . 1 . 1 92 92 GLU N N 15 120.470 0.029 . 1 . . . . . 230 GLU N . 50715 1 429 . 1 . 1 93 93 ASP H H 1 8.284 0.003 . 1 . . . . . 231 ASP HN . 50715 1 430 . 1 . 1 93 93 ASP C C 13 176.423 0.000 . 1 . . . . . 231 ASP C . 50715 1 431 . 1 . 1 93 93 ASP CA C 13 53.818 0.002 . 1 . . . . . 231 ASP CA . 50715 1 432 . 1 . 1 93 93 ASP CB C 13 40.616 0.002 . 1 . . . . . 231 ASP CB . 50715 1 433 . 1 . 1 93 93 ASP N N 15 120.771 0.043 . 1 . . . . . 231 ASP N . 50715 1 434 . 1 . 1 94 94 ARG H H 1 8.202 0.002 . 1 . . . . . 232 ARG HN . 50715 1 435 . 1 . 1 94 94 ARG C C 13 176.391 0.008 . 1 . . . . . 232 ARG C . 50715 1 436 . 1 . 1 94 94 ARG CA C 13 55.959 0.002 . 1 . . . . . 232 ARG CA . 50715 1 437 . 1 . 1 94 94 ARG CB C 13 29.610 0.002 . 1 . . . . . 232 ARG CB . 50715 1 438 . 1 . 1 94 94 ARG N N 15 121.526 0.022 . 1 . . . . . 232 ARG N . 50715 1 439 . 1 . 1 95 95 ASN H H 1 8.424 0.002 . 1 . . . . . 233 ASN HN . 50715 1 440 . 1 . 1 95 95 ASN C C 13 175.438 0.003 . 1 . . . . . 233 ASN C . 50715 1 441 . 1 . 1 95 95 ASN CA C 13 53.227 0.000 . 1 . . . . . 233 ASN CA . 50715 1 442 . 1 . 1 95 95 ASN CB C 13 38.449 0.000 . 1 . . . . . 233 ASN CB . 50715 1 443 . 1 . 1 95 95 ASN N N 15 119.001 0.036 . 1 . . . . . 233 ASN N . 50715 1 444 . 1 . 1 96 96 SER H H 1 8.166 0.002 . 1 . . . . . 234 SER HN . 50715 1 445 . 1 . 1 96 96 SER C C 13 174.616 0.002 . 1 . . . . . 234 SER C . 50715 1 446 . 1 . 1 96 96 SER CA C 13 58.207 0.000 . 1 . . . . . 234 SER CA . 50715 1 447 . 1 . 1 96 96 SER CB C 13 63.121 0.000 . 1 . . . . . 234 SER CB . 50715 1 448 . 1 . 1 96 96 SER N N 15 115.801 0.037 . 1 . . . . . 234 SER N . 50715 1 449 . 1 . 1 97 97 SER H H 1 8.274 0.002 . 1 . . . . . 235 SER HN . 50715 1 450 . 1 . 1 97 97 SER C C 13 174.477 0.002 . 1 . . . . . 235 SER C . 50715 1 451 . 1 . 1 97 97 SER CA C 13 58.091 0.018 . 1 . . . . . 235 SER CA . 50715 1 452 . 1 . 1 97 97 SER CB C 13 63.162 0.004 . 1 . . . . . 235 SER CB . 50715 1 453 . 1 . 1 97 97 SER N N 15 117.527 0.067 . 1 . . . . . 235 SER N . 50715 1 454 . 1 . 1 98 98 VAL H H 1 8.014 0.004 . 1 . . . . . 236 VAL HN . 50715 1 455 . 1 . 1 98 98 VAL C C 13 176.101 0.026 . 1 . . . . . 236 VAL C . 50715 1 456 . 1 . 1 98 98 VAL CA C 13 61.740 0.001 . 1 . . . . . 236 VAL CA . 50715 1 457 . 1 . 1 98 98 VAL CB C 13 31.918 0.002 . 1 . . . . . 236 VAL CB . 50715 1 458 . 1 . 1 98 98 VAL N N 15 120.860 0.031 . 1 . . . . . 236 VAL N . 50715 1 459 . 1 . 1 99 99 SER H H 1 8.215 0.004 . 1 . . . . . 237 SER HN . 50715 1 460 . 1 . 1 99 99 SER C C 13 174.813 0.010 . 1 . . . . . 237 SER C . 50715 1 461 . 1 . 1 99 99 SER CA C 13 57.922 0.006 . 1 . . . . . 237 SER CA . 50715 1 462 . 1 . 1 99 99 SER CB C 13 63.192 0.008 . 1 . . . . . 237 SER CB . 50715 1 463 . 1 . 1 99 99 SER N N 15 118.690 0.037 . 1 . . . . . 237 SER N . 50715 1 464 . 1 . 1 100 100 GLU H H 1 8.438 0.002 . 1 . . . . . 238 GLU HN . 50715 1 465 . 1 . 1 100 100 GLU C C 13 176.248 0.001 . 1 . . . . . 238 GLU C . 50715 1 466 . 1 . 1 100 100 GLU CA C 13 56.609 0.008 . 1 . . . . . 238 GLU CA . 50715 1 467 . 1 . 1 100 100 GLU CB C 13 29.475 0.001 . 1 . . . . . 238 GLU CB . 50715 1 468 . 1 . 1 100 100 GLU N N 15 122.839 0.042 . 1 . . . . . 238 GLU N . 50715 1 469 . 1 . 1 101 101 ASP H H 1 8.269 0.002 . 1 . . . . . 239 ASP HN . 50715 1 470 . 1 . 1 101 101 ASP C C 13 176.121 0.000 . 1 . . . . . 239 ASP C . 50715 1 471 . 1 . 1 101 101 ASP CA C 13 54.234 0.016 . 1 . . . . . 239 ASP CA . 50715 1 472 . 1 . 1 101 101 ASP CB C 13 40.473 0.018 . 1 . . . . . 239 ASP CB . 50715 1 473 . 1 . 1 101 101 ASP N N 15 120.293 0.047 . 1 . . . . . 239 ASP N . 50715 1 474 . 1 . 1 102 102 LEU H H 1 7.975 0.001 . 1 . . . . . 240 LEU HN . 50715 1 475 . 1 . 1 102 102 LEU C C 13 177.042 0.000 . 1 . . . . . 240 LEU C . 50715 1 476 . 1 . 1 102 102 LEU CA C 13 54.718 0.000 . 1 . . . . . 240 LEU CA . 50715 1 477 . 1 . 1 102 102 LEU CB C 13 41.262 0.000 . 1 . . . . . 240 LEU CB . 50715 1 478 . 1 . 1 102 102 LEU N N 15 121.498 0.051 . 1 . . . . . 240 LEU N . 50715 1 479 . 1 . 1 103 103 LEU H H 1 8.006 0.003 . 1 . . . . . 241 LEU HN . 50715 1 480 . 1 . 1 103 103 LEU C C 13 177.058 0.012 . 1 . . . . . 241 LEU C . 50715 1 481 . 1 . 1 103 103 LEU CA C 13 54.685 0.000 . 1 . . . . . 241 LEU CA . 50715 1 482 . 1 . 1 103 103 LEU CB C 13 41.434 0.031 . 1 . . . . . 241 LEU CB . 50715 1 483 . 1 . 1 103 103 LEU N N 15 121.895 0.047 . 1 . . . . . 241 LEU N . 50715 1 484 . 1 . 1 104 104 GLU H H 1 8.115 0.002 . 1 . . . . . 242 GLU HN . 50715 1 485 . 1 . 1 104 104 GLU C C 13 174.606 0.000 . 1 . . . . . 242 GLU C . 50715 1 486 . 1 . 1 104 104 GLU CA C 13 53.983 0.000 . 1 . . . . . 242 GLU CA . 50715 1 487 . 1 . 1 104 104 GLU CB C 13 28.941 0.000 . 1 . . . . . 242 GLU CB . 50715 1 488 . 1 . 1 104 104 GLU N N 15 122.300 0.039 . 1 . . . . . 242 GLU N . 50715 1 489 . 1 . 1 105 105 PRO C C 13 176.681 0.000 . 1 . . . . . 243 PRO C . 50715 1 490 . 1 . 1 105 105 PRO CA C 13 63.043 0.000 . 1 . . . . . 243 PRO CA . 50715 1 491 . 1 . 1 105 105 PRO CB C 13 31.083 0.000 . 1 . . . . . 243 PRO CB . 50715 1 492 . 1 . 1 106 106 PHE H H 1 8.075 0.003 . 1 . . . . . 244 PHE HN . 50715 1 493 . 1 . 1 106 106 PHE C C 13 175.562 0.000 . 1 . . . . . 244 PHE C . 50715 1 494 . 1 . 1 106 106 PHE CA C 13 57.388 0.038 . 1 . . . . . 244 PHE CA . 50715 1 495 . 1 . 1 106 106 PHE CB C 13 38.630 0.057 . 1 . . . . . 244 PHE CB . 50715 1 496 . 1 . 1 106 106 PHE N N 15 119.122 0.014 . 1 . . . . . 244 PHE N . 50715 1 497 . 1 . 1 107 107 ILE H H 1 7.819 0.005 . 1 . . . . . 245 ILE HN . 50715 1 498 . 1 . 1 107 107 ILE C C 13 175.414 0.038 . 1 . . . . . 245 ILE C . 50715 1 499 . 1 . 1 107 107 ILE CA C 13 60.337 0.005 . 1 . . . . . 245 ILE CA . 50715 1 500 . 1 . 1 107 107 ILE CB C 13 37.909 0.016 . 1 . . . . . 245 ILE CB . 50715 1 501 . 1 . 1 107 107 ILE N N 15 122.986 0.073 . 1 . . . . . 245 ILE N . 50715 1 502 . 1 . 1 108 108 ALA H H 1 8.138 0.002 . 1 . . . . . 246 ALA HN . 50715 1 503 . 1 . 1 108 108 ALA C C 13 177.816 0.009 . 1 . . . . . 246 ALA C . 50715 1 504 . 1 . 1 108 108 ALA CA C 13 52.026 0.003 . 1 . . . . . 246 ALA CA . 50715 1 505 . 1 . 1 108 108 ALA CB C 13 18.473 0.008 . 1 . . . . . 246 ALA CB . 50715 1 506 . 1 . 1 108 108 ALA N N 15 127.403 0.049 . 1 . . . . . 246 ALA N . 50715 1 507 . 1 . 1 109 109 VAL H H 1 8.002 0.001 . 1 . . . . . 247 VAL HN . 50715 1 508 . 1 . 1 109 109 VAL C C 13 176.397 0.003 . 1 . . . . . 247 VAL C . 50715 1 509 . 1 . 1 109 109 VAL CA C 13 61.984 0.008 . 1 . . . . . 247 VAL CA . 50715 1 510 . 1 . 1 109 109 VAL CB C 13 31.931 0.022 . 1 . . . . . 247 VAL CB . 50715 1 511 . 1 . 1 109 109 VAL N N 15 118.785 0.027 . 1 . . . . . 247 VAL N . 50715 1 512 . 1 . 1 110 110 SER H H 1 8.184 0.002 . 1 . . . . . 248 SER HN . 50715 1 513 . 1 . 1 110 110 SER C C 13 174.532 0.000 . 1 . . . . . 248 SER C . 50715 1 514 . 1 . 1 110 110 SER CA C 13 57.884 0.000 . 1 . . . . . 248 SER CA . 50715 1 515 . 1 . 1 110 110 SER CB C 13 63.151 0.000 . 1 . . . . . 248 SER CB . 50715 1 516 . 1 . 1 110 110 SER N N 15 118.103 0.053 . 1 . . . . . 248 SER N . 50715 1 517 . 1 . 1 111 111 ALA H H 1 8.258 0.000 . 1 . . . . . 249 ALA HN . 50715 1 518 . 1 . 1 111 111 ALA C C 13 177.822 0.000 . 1 . . . . . 249 ALA C . 50715 1 519 . 1 . 1 111 111 ALA CA C 13 52.475 0.000 . 1 . . . . . 249 ALA CA . 50715 1 520 . 1 . 1 111 111 ALA CB C 13 18.322 0.000 . 1 . . . . . 249 ALA CB . 50715 1 521 . 1 . 1 111 111 ALA N N 15 125.602 0.000 . 1 . . . . . 249 ALA N . 50715 1 522 . 1 . 1 112 112 GLN H H 1 8.090 0.002 . 1 . . . . . 250 GLN HN . 50715 1 523 . 1 . 1 112 112 GLN C C 13 176.067 0.009 . 1 . . . . . 250 GLN C . 50715 1 524 . 1 . 1 112 112 GLN CA C 13 55.609 0.000 . 1 . . . . . 250 GLN CA . 50715 1 525 . 1 . 1 112 112 GLN CB C 13 28.409 0.005 . 1 . . . . . 250 GLN CB . 50715 1 526 . 1 . 1 112 112 GLN N N 15 118.197 0.050 . 1 . . . . . 250 GLN N . 50715 1 527 . 1 . 1 113 113 ALA H H 1 8.071 0.004 . 1 . . . . . 251 ALA HN . 50715 1 528 . 1 . 1 113 113 ALA C C 13 177.750 0.020 . 1 . . . . . 251 ALA C . 50715 1 529 . 1 . 1 113 113 ALA CA C 13 52.411 0.003 . 1 . . . . . 251 ALA CA . 50715 1 530 . 1 . 1 113 113 ALA CB C 13 18.298 0.006 . 1 . . . . . 251 ALA CB . 50715 1 531 . 1 . 1 113 113 ALA N N 15 123.888 0.037 . 1 . . . . . 251 ALA N . 50715 1 532 . 1 . 1 114 114 TRP H H 1 7.957 0.002 . 1 . . . . . 252 TRP HN . 50715 1 533 . 1 . 1 114 114 TRP HE1 H 1 10.088 0.000 . 1 . . . . . 252 TRP HE1 . 50715 1 534 . 1 . 1 114 114 TRP C C 13 176.118 0.040 . 1 . . . . . 252 TRP C . 50715 1 535 . 1 . 1 114 114 TRP CA C 13 57.052 0.001 . 1 . . . . . 252 TRP CA . 50715 1 536 . 1 . 1 114 114 TRP CB C 13 28.705 0.003 . 1 . . . . . 252 TRP CB . 50715 1 537 . 1 . 1 114 114 TRP N N 15 119.365 0.021 . 1 . . . . . 252 TRP N . 50715 1 538 . 1 . 1 114 114 TRP NE1 N 15 129.192 0.000 . 1 . . . . . 252 TRP NE1 . 50715 1 539 . 1 . 1 115 115 ASN H H 1 7.979 0.002 . 1 . . . . . 253 ASN HN . 50715 1 540 . 1 . 1 115 115 ASN C C 13 175.004 0.012 . 1 . . . . . 253 ASN C . 50715 1 541 . 1 . 1 115 115 ASN CA C 13 52.700 0.012 . 1 . . . . . 253 ASN CA . 50715 1 542 . 1 . 1 115 115 ASN CB C 13 38.133 0.008 . 1 . . . . . 253 ASN CB . 50715 1 543 . 1 . 1 115 115 ASN N N 15 119.729 0.018 . 1 . . . . . 253 ASN N . 50715 1 544 . 1 . 1 116 116 GLN H H 1 7.992 0.004 . 1 . . . . . 254 GLN HN . 50715 1 545 . 1 . 1 116 116 GLN C C 13 175.946 0.000 . 1 . . . . . 254 GLN C . 50715 1 546 . 1 . 1 116 116 GLN CA C 13 55.864 0.000 . 1 . . . . . 254 GLN CA . 50715 1 547 . 1 . 1 116 116 GLN CB C 13 28.424 0.000 . 1 . . . . . 254 GLN CB . 50715 1 548 . 1 . 1 116 116 GLN N N 15 119.746 0.036 . 1 . . . . . 254 GLN N . 50715 1 549 . 1 . 1 117 117 HIS H H 1 8.290 0.000 . 1 . . . . . 255 HIS HN . 50715 1 550 . 1 . 1 117 117 HIS N N 15 119.207 0.000 . 1 . . . . . 255 HIS N . 50715 1 551 . 1 . 1 118 118 SER H H 1 8.157 0.001 . 1 . . . . . 256 SER HN . 50715 1 552 . 1 . 1 118 118 SER C C 13 174.923 0.000 . 1 . . . . . 256 SER C . 50715 1 553 . 1 . 1 118 118 SER CA C 13 58.235 0.002 . 1 . . . . . 256 SER CA . 50715 1 554 . 1 . 1 118 118 SER CB C 13 63.148 0.004 . 1 . . . . . 256 SER CB . 50715 1 555 . 1 . 1 118 118 SER N N 15 116.332 0.043 . 1 . . . . . 256 SER N . 50715 1 556 . 1 . 1 119 119 GLY H H 1 8.374 0.003 . 1 . . . . . 257 GLY HN . 50715 1 557 . 1 . 1 119 119 GLY C C 13 173.909 0.015 . 1 . . . . . 257 GLY C . 50715 1 558 . 1 . 1 119 119 GLY CA C 13 44.930 0.001 . 1 . . . . . 257 GLY CA . 50715 1 559 . 1 . 1 119 119 GLY N N 15 110.690 0.052 . 1 . . . . . 257 GLY N . 50715 1 560 . 1 . 1 120 120 VAL H H 1 7.854 0.004 . 1 . . . . . 258 VAL HN . 50715 1 561 . 1 . 1 120 120 VAL C C 13 176.038 0.003 . 1 . . . . . 258 VAL C . 50715 1 562 . 1 . 1 120 120 VAL CA C 13 61.753 0.000 . 1 . . . . . 258 VAL CA . 50715 1 563 . 1 . 1 120 120 VAL CB C 13 31.939 0.000 . 1 . . . . . 258 VAL CB . 50715 1 564 . 1 . 1 120 120 VAL N N 15 119.243 0.046 . 1 . . . . . 258 VAL N . 50715 1 565 . 1 . 1 121 121 VAL H H 1 8.160 0.004 . 1 . . . . . 259 VAL HN . 50715 1 566 . 1 . 1 121 121 VAL C C 13 175.771 0.020 . 1 . . . . . 259 VAL C . 50715 1 567 . 1 . 1 121 121 VAL CA C 13 61.716 0.010 . 1 . . . . . 259 VAL CA . 50715 1 568 . 1 . 1 121 121 VAL CB C 13 31.814 0.025 . 1 . . . . . 259 VAL CB . 50715 1 569 . 1 . 1 121 121 VAL N N 15 124.400 0.037 . 1 . . . . . 259 VAL N . 50715 1 570 . 1 . 1 122 122 ARG H H 1 8.374 0.002 . 1 . . . . . 260 ARG HN . 50715 1 571 . 1 . 1 122 122 ARG C C 13 174.480 0.000 . 1 . . . . . 260 ARG C . 50715 1 572 . 1 . 1 122 122 ARG CA C 13 53.284 0.014 . 1 . . . . . 260 ARG CA . 50715 1 573 . 1 . 1 122 122 ARG CB C 13 29.516 0.000 . 1 . . . . . 260 ARG CB . 50715 1 574 . 1 . 1 122 122 ARG N N 15 126.011 0.048 . 1 . . . . . 260 ARG N . 50715 1 575 . 1 . 1 123 123 PRO C C 13 176.639 0.000 . 1 . . . . . 261 PRO C . 50715 1 576 . 1 . 1 123 123 PRO CA C 13 62.932 0.042 . 1 . . . . . 261 PRO CA . 50715 1 577 . 1 . 1 123 123 PRO CB C 13 31.145 0.038 . 1 . . . . . 261 PRO CB . 50715 1 578 . 1 . 1 124 124 ASP H H 1 8.332 0.001 . 1 . . . . . 262 ASP HN . 50715 1 579 . 1 . 1 124 124 ASP C C 13 176.531 0.004 . 1 . . . . . 262 ASP C . 50715 1 580 . 1 . 1 124 124 ASP CA C 13 53.750 0.025 . 1 . . . . . 262 ASP CA . 50715 1 581 . 1 . 1 124 124 ASP CB C 13 40.598 0.035 . 1 . . . . . 262 ASP CB . 50715 1 582 . 1 . 1 124 124 ASP N N 15 119.507 0.059 . 1 . . . . . 262 ASP N . 50715 1 583 . 1 . 1 125 125 SER H H 1 8.139 0.002 . 1 . . . . . 263 SER HN . 50715 1 584 . 1 . 1 125 125 SER C C 13 174.728 0.000 . 1 . . . . . 263 SER C . 50715 1 585 . 1 . 1 125 125 SER CA C 13 57.790 0.008 . 1 . . . . . 263 SER CA . 50715 1 586 . 1 . 1 125 125 SER CB C 13 63.266 0.016 . 1 . . . . . 263 SER CB . 50715 1 587 . 1 . 1 125 125 SER N N 15 115.817 0.073 . 1 . . . . . 263 SER N . 50715 1 588 . 1 . 1 126 126 HIS H H 1 8.233 0.001 . 1 . . . . . 264 HIS HN . 50715 1 589 . 1 . 1 126 126 HIS CA C 13 55.651 0.040 . 1 . . . . . 264 HIS CA . 50715 1 590 . 1 . 1 126 126 HIS CB C 13 29.374 0.007 . 1 . . . . . 264 HIS CB . 50715 1 591 . 1 . 1 126 126 HIS N N 15 119.090 0.035 . 1 . . . . . 264 HIS N . 50715 1 592 . 1 . 1 127 127 SER H H 1 8.181 0.001 . 1 . . . . . 265 SER HN . 50715 1 593 . 1 . 1 127 127 SER C C 13 174.567 0.000 . 1 . . . . . 265 SER C . 50715 1 594 . 1 . 1 127 127 SER CA C 13 58.125 0.022 . 1 . . . . . 265 SER CA . 50715 1 595 . 1 . 1 127 127 SER CB C 13 63.097 0.008 . 1 . . . . . 265 SER CB . 50715 1 596 . 1 . 1 127 127 SER N N 15 116.328 0.035 . 1 . . . . . 265 SER N . 50715 1 597 . 1 . 1 128 128 GLN H H 1 8.392 0.003 . 1 . . . . . 266 GLN HN . 50715 1 598 . 1 . 1 128 128 GLN C C 13 176.341 0.020 . 1 . . . . . 266 GLN C . 50715 1 599 . 1 . 1 128 128 GLN CA C 13 55.664 0.007 . 1 . . . . . 266 GLN CA . 50715 1 600 . 1 . 1 128 128 GLN CB C 13 28.639 0.055 . 1 . . . . . 266 GLN CB . 50715 1 601 . 1 . 1 128 128 GLN N N 15 121.843 0.047 . 1 . . . . . 266 GLN N . 50715 1 602 . 1 . 1 129 129 GLY H H 1 8.327 0.005 . 1 . . . . . 267 GLY HN . 50715 1 603 . 1 . 1 129 129 GLY C C 13 173.833 0.047 . 1 . . . . . 267 GLY C . 50715 1 604 . 1 . 1 129 129 GLY CA C 13 44.687 0.037 . 1 . . . . . 267 GLY CA . 50715 1 605 . 1 . 1 129 129 GLY N N 15 109.691 0.080 . 1 . . . . . 267 GLY N . 50715 1 606 . 1 . 1 130 130 SER H H 1 8.151 0.002 . 1 . . . . . 268 SER HN . 50715 1 607 . 1 . 1 130 130 SER C C 13 173.019 0.000 . 1 . . . . . 268 SER C . 50715 1 608 . 1 . 1 130 130 SER CA C 13 60.271 0.097 . 1 . . . . . 268 SER CA . 50715 1 609 . 1 . 1 130 130 SER CB C 13 62.814 0.014 . 1 . . . . . 268 SER CB . 50715 1 610 . 1 . 1 130 130 SER N N 15 116.588 0.064 . 1 . . . . . 268 SER N . 50715 1 611 . 1 . 1 131 131 PRO C C 13 176.785 0.000 . 1 . . . . . 269 PRO C . 50715 1 612 . 1 . 1 131 131 PRO CA C 13 63.124 0.032 . 1 . . . . . 269 PRO CA . 50715 1 613 . 1 . 1 131 131 PRO CB C 13 31.158 0.008 . 1 . . . . . 269 PRO CB . 50715 1 614 . 1 . 1 132 132 ASN H H 1 8.378 0.022 . 1 . . . . . 270 ASN HN . 50715 1 615 . 1 . 1 132 132 ASN C C 13 175.069 0.023 . 1 . . . . . 270 ASN C . 50715 1 616 . 1 . 1 132 132 ASN CA C 13 53.064 0.074 . 1 . . . . . 270 ASN CA . 50715 1 617 . 1 . 1 132 132 ASN CB C 13 38.449 0.020 . 1 . . . . . 270 ASN CB . 50715 1 618 . 1 . 1 132 132 ASN N N 15 117.992 0.053 . 1 . . . . . 270 ASN N . 50715 1 619 . 1 . 1 133 133 SER H H 1 8.111 0.004 . 1 . . . . . 271 SER HN . 50715 1 620 . 1 . 1 133 133 SER C C 13 173.810 0.019 . 1 . . . . . 271 SER C . 50715 1 621 . 1 . 1 133 133 SER CA C 13 57.834 0.051 . 1 . . . . . 271 SER CA . 50715 1 622 . 1 . 1 133 133 SER CB C 13 63.355 0.029 . 1 . . . . . 271 SER CB . 50715 1 623 . 1 . 1 133 133 SER N N 15 115.658 0.049 . 1 . . . . . 271 SER N . 50715 1 624 . 1 . 1 134 134 ASP H H 1 8.241 0.003 . 1 . . . . . 272 ASP HN . 50715 1 625 . 1 . 1 134 134 ASP C C 13 174.877 0.000 . 1 . . . . . 272 ASP C . 50715 1 626 . 1 . 1 134 134 ASP CA C 13 51.900 0.001 . 1 . . . . . 272 ASP CA . 50715 1 627 . 1 . 1 134 134 ASP CB C 13 40.795 0.043 . 1 . . . . . 272 ASP CB . 50715 1 628 . 1 . 1 134 134 ASP N N 15 123.201 0.047 . 1 . . . . . 272 ASP N . 50715 1 629 . 1 . 1 135 135 PRO C C 13 177.623 0.000 . 1 . . . . . 273 PRO C . 50715 1 630 . 1 . 1 135 135 PRO CA C 13 63.402 0.000 . 1 . . . . . 273 PRO CA . 50715 1 631 . 1 . 1 135 135 PRO CB C 13 31.275 0.000 . 1 . . . . . 273 PRO CB . 50715 1 632 . 1 . 1 136 136 GLY H H 1 8.473 0.003 . 1 . . . . . 274 GLY HN . 50715 1 633 . 1 . 1 136 136 GLY C C 13 174.019 0.002 . 1 . . . . . 274 GLY C . 50715 1 634 . 1 . 1 136 136 GLY CA C 13 45.000 0.007 . 1 . . . . . 274 GLY CA . 50715 1 635 . 1 . 1 136 136 GLY N N 15 108.160 0.037 . 1 . . . . . 274 GLY N . 50715 1 636 . 1 . 1 137 137 LEU H H 1 7.840 0.003 . 1 . . . . . 275 LEU HN . 50715 1 637 . 1 . 1 137 137 LEU C C 13 177.184 0.022 . 1 . . . . . 275 LEU C . 50715 1 638 . 1 . 1 137 137 LEU CA C 13 54.598 0.002 . 1 . . . . . 275 LEU CA . 50715 1 639 . 1 . 1 137 137 LEU CB C 13 41.606 0.013 . 1 . . . . . 275 LEU CB . 50715 1 640 . 1 . 1 137 137 LEU N N 15 121.002 0.018 . 1 . . . . . 275 LEU N . 50715 1 641 . 1 . 1 138 138 GLU H H 1 8.284 0.002 . 1 . . . . . 276 GLU HN . 50715 1 642 . 1 . 1 138 138 GLU C C 13 174.625 0.000 . 1 . . . . . 276 GLU C . 50715 1 643 . 1 . 1 138 138 GLU CA C 13 54.084 0.000 . 1 . . . . . 276 GLU CA . 50715 1 644 . 1 . 1 138 138 GLU CB C 13 28.822 0.000 . 1 . . . . . 276 GLU CB . 50715 1 645 . 1 . 1 138 138 GLU N N 15 122.672 0.028 . 1 . . . . . 276 GLU N . 50715 1 646 . 1 . 1 139 139 PRO C C 13 177.210 0.000 . 1 . . . . . 277 PRO C . 50715 1 647 . 1 . 1 139 139 PRO CA C 13 62.745 0.000 . 1 . . . . . 277 PRO CA . 50715 1 648 . 1 . 1 139 139 PRO CB C 13 31.341 0.000 . 1 . . . . . 277 PRO CB . 50715 1 649 . 1 . 1 140 140 GLU H H 1 8.490 0.002 . 1 . . . . . 278 GLU HN . 50715 1 650 . 1 . 1 140 140 GLU C C 13 176.397 0.008 . 1 . . . . . 278 GLU C . 50715 1 651 . 1 . 1 140 140 GLU CA C 13 56.427 0.066 . 1 . . . . . 278 GLU CA . 50715 1 652 . 1 . 1 140 140 GLU CB C 13 29.507 0.023 . 1 . . . . . 278 GLU CB . 50715 1 653 . 1 . 1 140 140 GLU N N 15 120.698 0.016 . 1 . . . . . 278 GLU N . 50715 1 654 . 1 . 1 141 141 ASP H H 1 8.317 0.003 . 1 . . . . . 279 ASP HN . 50715 1 655 . 1 . 1 141 141 ASP C C 13 176.504 0.026 . 1 . . . . . 279 ASP C . 50715 1 656 . 1 . 1 141 141 ASP CA C 13 53.803 0.014 . 1 . . . . . 279 ASP CA . 50715 1 657 . 1 . 1 141 141 ASP CB C 13 40.708 0.010 . 1 . . . . . 279 ASP CB . 50715 1 658 . 1 . 1 141 141 ASP N N 15 120.967 0.022 . 1 . . . . . 279 ASP N . 50715 1 659 . 1 . 1 142 142 SER H H 1 8.255 0.003 . 1 . . . . . 280 SER HN . 50715 1 660 . 1 . 1 142 142 SER C C 13 174.658 0.000 . 1 . . . . . 280 SER C . 50715 1 661 . 1 . 1 142 142 SER CA C 13 58.502 0.072 . 1 . . . . . 280 SER CA . 50715 1 662 . 1 . 1 142 142 SER CB C 13 63.038 0.032 . 1 . . . . . 280 SER CB . 50715 1 663 . 1 . 1 142 142 SER N N 15 116.465 0.034 . 1 . . . . . 280 SER N . 50715 1 664 . 1 . 1 143 143 ASN H H 1 8.453 0.003 . 1 . . . . . 281 ASN HN . 50715 1 665 . 1 . 1 143 143 ASN C C 13 175.548 0.014 . 1 . . . . . 281 ASN C . 50715 1 666 . 1 . 1 143 143 ASN CA C 13 53.194 0.032 . 1 . . . . . 281 ASN CA . 50715 1 667 . 1 . 1 143 143 ASN CB C 13 38.459 0.017 . 1 . . . . . 281 ASN CB . 50715 1 668 . 1 . 1 143 143 ASN N N 15 120.184 0.047 . 1 . . . . . 281 ASN N . 50715 1 669 . 1 . 1 144 144 SER H H 1 8.168 0.005 . 1 . . . . . 282 SER HN . 50715 1 670 . 1 . 1 144 144 SER C C 13 175.056 0.009 . 1 . . . . . 282 SER C . 50715 1 671 . 1 . 1 144 144 SER CA C 13 58.280 0.056 . 1 . . . . . 282 SER CA . 50715 1 672 . 1 . 1 144 144 SER CB C 13 63.154 0.023 . 1 . . . . . 282 SER CB . 50715 1 673 . 1 . 1 144 144 SER N N 15 115.734 0.054 . 1 . . . . . 282 SER N . 50715 1 674 . 1 . 1 145 145 THR H H 1 8.143 0.003 . 1 . . . . . 283 THR HN . 50715 1 675 . 1 . 1 145 145 THR C C 13 174.811 0.037 . 1 . . . . . 283 THR C . 50715 1 676 . 1 . 1 145 145 THR CA C 13 61.719 0.080 . 1 . . . . . 283 THR CA . 50715 1 677 . 1 . 1 145 145 THR CB C 13 69.109 0.040 . 1 . . . . . 283 THR CB . 50715 1 678 . 1 . 1 145 145 THR N N 15 115.291 0.051 . 1 . . . . . 283 THR N . 50715 1 679 . 1 . 1 146 146 SER H H 1 8.212 0.003 . 1 . . . . . 284 SER HN . 50715 1 680 . 1 . 1 146 146 SER C C 13 174.276 0.017 . 1 . . . . . 284 SER C . 50715 1 681 . 1 . 1 146 146 SER CA C 13 58.145 0.045 . 1 . . . . . 284 SER CA . 50715 1 682 . 1 . 1 146 146 SER CB C 13 63.171 0.020 . 1 . . . . . 284 SER CB . 50715 1 683 . 1 . 1 146 146 SER N N 15 117.842 0.046 . 1 . . . . . 284 SER N . 50715 1 684 . 1 . 1 147 147 ALA H H 1 8.226 0.004 . 1 . . . . . 285 ALA HN . 50715 1 685 . 1 . 1 147 147 ALA C C 13 177.466 0.021 . 1 . . . . . 285 ALA C . 50715 1 686 . 1 . 1 147 147 ALA CA C 13 52.208 0.009 . 1 . . . . . 285 ALA CA . 50715 1 687 . 1 . 1 147 147 ALA CB C 13 18.444 0.012 . 1 . . . . . 285 ALA CB . 50715 1 688 . 1 . 1 147 147 ALA N N 15 125.583 0.039 . 1 . . . . . 285 ALA N . 50715 1 689 . 1 . 1 148 148 LEU H H 1 8.024 0.006 . 1 . . . . . 286 LEU HN . 50715 1 690 . 1 . 1 148 148 LEU C C 13 177.259 0.016 . 1 . . . . . 286 LEU C . 50715 1 691 . 1 . 1 148 148 LEU CA C 13 54.863 0.072 . 1 . . . . . 286 LEU CA . 50715 1 692 . 1 . 1 148 148 LEU CB C 13 41.313 0.004 . 1 . . . . . 286 LEU CB . 50715 1 693 . 1 . 1 148 148 LEU N N 15 120.485 0.041 . 1 . . . . . 286 LEU N . 50715 1 694 . 1 . 1 149 149 GLU H H 1 8.160 0.004 . 1 . . . . . 287 GLU HN . 50715 1 695 . 1 . 1 149 149 GLU C C 13 175.797 0.001 . 1 . . . . . 287 GLU C . 50715 1 696 . 1 . 1 149 149 GLU CA C 13 55.912 0.010 . 1 . . . . . 287 GLU CA . 50715 1 697 . 1 . 1 149 149 GLU CB C 13 29.745 0.011 . 1 . . . . . 287 GLU CB . 50715 1 698 . 1 . 1 149 149 GLU N N 15 120.837 0.020 . 1 . . . . . 287 GLU N . 50715 1 699 . 1 . 1 150 150 ASP H H 1 8.270 0.003 . 1 . . . . . 288 ASP HN . 50715 1 700 . 1 . 1 150 150 ASP C C 13 174.765 0.000 . 1 . . . . . 288 ASP C . 50715 1 701 . 1 . 1 150 150 ASP CA C 13 51.887 0.000 . 1 . . . . . 288 ASP CA . 50715 1 702 . 1 . 1 150 150 ASP CB C 13 40.721 0.000 . 1 . . . . . 288 ASP CB . 50715 1 703 . 1 . 1 150 150 ASP N N 15 122.399 0.027 . 1 . . . . . 288 ASP N . 50715 1 704 . 1 . 1 151 151 PRO C C 13 177.245 0.000 . 1 . . . . . 289 PRO C . 50715 1 705 . 1 . 1 151 151 PRO CA C 13 63.064 0.000 . 1 . . . . . 289 PRO CA . 50715 1 706 . 1 . 1 151 151 PRO CB C 13 31.319 0.000 . 1 . . . . . 289 PRO CB . 50715 1 707 . 1 . 1 152 152 LEU H H 1 8.242 0.003 . 1 . . . . . 290 LEU HN . 50715 1 708 . 1 . 1 152 152 LEU C C 13 177.700 0.010 . 1 . . . . . 290 LEU C . 50715 1 709 . 1 . 1 152 152 LEU CA C 13 55.045 0.026 . 1 . . . . . 290 LEU CA . 50715 1 710 . 1 . 1 152 152 LEU CB C 13 40.635 0.010 . 1 . . . . . 290 LEU CB . 50715 1 711 . 1 . 1 152 152 LEU N N 15 120.124 0.028 . 1 . . . . . 290 LEU N . 50715 1 712 . 1 . 1 153 153 GLU H H 1 7.979 0.002 . 1 . . . . . 291 GLU HN . 50715 1 713 . 1 . 1 153 153 GLU C C 13 176.211 0.004 . 1 . . . . . 291 GLU C . 50715 1 714 . 1 . 1 153 153 GLU CA C 13 56.618 0.000 . 1 . . . . . 291 GLU CA . 50715 1 715 . 1 . 1 153 153 GLU CB C 13 29.448 0.000 . 1 . . . . . 291 GLU CB . 50715 1 716 . 1 . 1 153 153 GLU N N 15 119.938 0.042 . 1 . . . . . 291 GLU N . 50715 1 717 . 1 . 1 154 154 PHE H H 1 7.991 0.001 . 1 . . . . . 292 PHE HN . 50715 1 718 . 1 . 1 154 154 PHE C C 13 175.738 0.003 . 1 . . . . . 292 PHE C . 50715 1 719 . 1 . 1 154 154 PHE CA C 13 57.218 0.001 . 1 . . . . . 292 PHE CA . 50715 1 720 . 1 . 1 154 154 PHE CB C 13 38.537 0.042 . 1 . . . . . 292 PHE CB . 50715 1 721 . 1 . 1 154 154 PHE N N 15 119.124 0.027 . 1 . . . . . 292 PHE N . 50715 1 722 . 1 . 1 155 155 LEU H H 1 7.927 0.004 . 1 . . . . . 293 LEU HN . 50715 1 723 . 1 . 1 155 155 LEU C C 13 176.662 0.006 . 1 . . . . . 293 LEU C . 50715 1 724 . 1 . 1 155 155 LEU CA C 13 55.041 0.022 . 1 . . . . . 293 LEU CA . 50715 1 725 . 1 . 1 155 155 LEU CB C 13 41.916 0.011 . 1 . . . . . 293 LEU CB . 50715 1 726 . 1 . 1 155 155 LEU N N 15 122.755 0.025 . 1 . . . . . 293 LEU N . 50715 1 727 . 1 . 1 156 156 ASP H H 1 8.387 0.007 . 1 . . . . . 294 ASP HN . 50715 1 728 . 1 . 1 156 156 ASP C C 13 176.820 0.022 . 1 . . . . . 294 ASP C . 50715 1 729 . 1 . 1 156 156 ASP CA C 13 53.465 0.005 . 1 . . . . . 294 ASP CA . 50715 1 730 . 1 . 1 156 156 ASP CB C 13 40.614 0.033 . 1 . . . . . 294 ASP CB . 50715 1 731 . 1 . 1 156 156 ASP N N 15 120.851 0.029 . 1 . . . . . 294 ASP N . 50715 1 732 . 1 . 1 157 157 MET H H 1 8.320 0.005 . 1 . . . . . 295 MET HN . 50715 1 733 . 1 . 1 157 157 MET C C 13 177.494 0.021 . 1 . . . . . 295 MET C . 50715 1 734 . 1 . 1 157 157 MET CA C 13 57.316 0.003 . 1 . . . . . 295 MET CA . 50715 1 735 . 1 . 1 157 157 MET CB C 13 31.602 0.000 . 1 . . . . . 295 MET CB . 50715 1 736 . 1 . 1 157 157 MET N N 15 121.391 0.027 . 1 . . . . . 295 MET N . 50715 1 737 . 1 . 1 158 158 ALA H H 1 8.273 0.002 . 1 . . . . . 296 ALA HN . 50715 1 738 . 1 . 1 158 158 ALA C C 13 180.547 0.005 . 1 . . . . . 296 ALA C . 50715 1 739 . 1 . 1 158 158 ALA CA C 13 55.274 0.059 . 1 . . . . . 296 ALA CA . 50715 1 740 . 1 . 1 158 158 ALA CB C 13 17.229 0.015 . 1 . . . . . 296 ALA CB . 50715 1 741 . 1 . 1 158 158 ALA N N 15 121.223 0.023 . 1 . . . . . 296 ALA N . 50715 1 742 . 1 . 1 159 159 GLU H H 1 7.893 0.002 . 1 . . . . . 297 GLU HN . 50715 1 743 . 1 . 1 159 159 GLU C C 13 179.045 0.024 . 1 . . . . . 297 GLU C . 50715 1 744 . 1 . 1 159 159 GLU CA C 13 58.497 0.037 . 1 . . . . . 297 GLU CA . 50715 1 745 . 1 . 1 159 159 GLU CB C 13 28.888 0.000 . 1 . . . . . 297 GLU CB . 50715 1 746 . 1 . 1 159 159 GLU N N 15 118.420 0.013 . 1 . . . . . 297 GLU N . 50715 1 747 . 1 . 1 160 160 ILE H H 1 7.826 0.002 . 1 . . . . . 298 ILE HN . 50715 1 748 . 1 . 1 160 160 ILE C C 13 177.720 0.005 . 1 . . . . . 298 ILE C . 50715 1 749 . 1 . 1 160 160 ILE CA C 13 64.437 0.046 . 1 . . . . . 298 ILE CA . 50715 1 750 . 1 . 1 160 160 ILE CB C 13 36.290 0.002 . 1 . . . . . 298 ILE CB . 50715 1 751 . 1 . 1 160 160 ILE N N 15 119.346 0.021 . 1 . . . . . 298 ILE N . 50715 1 752 . 1 . 1 161 161 LYS H H 1 8.181 0.002 . 1 . . . . . 299 LYS HN . 50715 1 753 . 1 . 1 161 161 LYS C C 13 179.016 0.004 . 1 . . . . . 299 LYS C . 50715 1 754 . 1 . 1 161 161 LYS CA C 13 60.423 0.004 . 1 . . . . . 299 LYS CA . 50715 1 755 . 1 . 1 161 161 LYS CB C 13 31.843 0.000 . 1 . . . . . 299 LYS CB . 50715 1 756 . 1 . 1 161 161 LYS N N 15 118.758 0.009 . 1 . . . . . 299 LYS N . 50715 1 757 . 1 . 1 162 162 GLU H H 1 7.675 0.003 . 1 . . . . . 300 GLU HN . 50715 1 758 . 1 . 1 162 162 GLU C C 13 179.144 0.002 . 1 . . . . . 300 GLU C . 50715 1 759 . 1 . 1 162 162 GLU CA C 13 59.144 0.000 . 1 . . . . . 300 GLU CA . 50715 1 760 . 1 . 1 162 162 GLU CB C 13 28.485 0.040 . 1 . . . . . 300 GLU CB . 50715 1 761 . 1 . 1 162 162 GLU N N 15 118.298 0.018 . 1 . . . . . 300 GLU N . 50715 1 762 . 1 . 1 163 163 LYS H H 1 8.005 0.002 . 1 . . . . . 301 LYS HN . 50715 1 763 . 1 . 1 163 163 LYS C C 13 180.488 0.004 . 1 . . . . . 301 LYS C . 50715 1 764 . 1 . 1 163 163 LYS CA C 13 59.125 0.000 . 1 . . . . . 301 LYS CA . 50715 1 765 . 1 . 1 163 163 LYS CB C 13 31.899 0.014 . 1 . . . . . 301 LYS CB . 50715 1 766 . 1 . 1 163 163 LYS N N 15 118.922 0.017 . 1 . . . . . 301 LYS N . 50715 1 767 . 1 . 1 164 164 ILE H H 1 8.474 0.004 . 1 . . . . . 302 ILE HN . 50715 1 768 . 1 . 1 164 164 ILE C C 13 177.659 0.022 . 1 . . . . . 302 ILE C . 50715 1 769 . 1 . 1 164 164 ILE CA C 13 66.001 0.016 . 1 . . . . . 302 ILE CA . 50715 1 770 . 1 . 1 164 164 ILE CB C 13 37.232 0.032 . 1 . . . . . 302 ILE CB . 50715 1 771 . 1 . 1 164 164 ILE N N 15 120.720 0.018 . 1 . . . . . 302 ILE N . 50715 1 772 . 1 . 1 165 165 CYS H H 1 8.173 0.004 . 1 . . . . . 303 CYS HN . 50715 1 773 . 1 . 1 165 165 CYS C C 13 176.343 0.010 . 1 . . . . . 303 CYS C . 50715 1 774 . 1 . 1 165 165 CYS CA C 13 64.497 0.078 . 1 . . . . . 303 CYS CA . 50715 1 775 . 1 . 1 165 165 CYS CB C 13 25.612 0.026 . 1 . . . . . 303 CYS CB . 50715 1 776 . 1 . 1 165 165 CYS N N 15 116.837 0.033 . 1 . . . . . 303 CYS N . 50715 1 777 . 1 . 1 166 166 ASP H H 1 8.331 0.002 . 1 . . . . . 304 ASP HN . 50715 1 778 . 1 . 1 166 166 ASP C C 13 178.107 0.004 . 1 . . . . . 304 ASP C . 50715 1 779 . 1 . 1 166 166 ASP CA C 13 57.365 0.044 . 1 . . . . . 304 ASP CA . 50715 1 780 . 1 . 1 166 166 ASP CB C 13 40.745 0.072 . 1 . . . . . 304 ASP CB . 50715 1 781 . 1 . 1 166 166 ASP N N 15 118.959 0.023 . 1 . . . . . 304 ASP N . 50715 1 782 . 1 . 1 167 167 TYR H H 1 7.915 0.001 . 1 . . . . . 305 TYR HN . 50715 1 783 . 1 . 1 167 167 TYR C C 13 178.304 0.027 . 1 . . . . . 305 TYR C . 50715 1 784 . 1 . 1 167 167 TYR CA C 13 62.091 0.016 . 1 . . . . . 305 TYR CA . 50715 1 785 . 1 . 1 167 167 TYR CB C 13 37.889 0.074 . 1 . . . . . 305 TYR CB . 50715 1 786 . 1 . 1 167 167 TYR N N 15 120.593 0.014 . 1 . . . . . 305 TYR N . 50715 1 787 . 1 . 1 168 168 LEU H H 1 8.539 0.002 . 1 . . . . . 306 LEU HN . 50715 1 788 . 1 . 1 168 168 LEU C C 13 179.035 0.003 . 1 . . . . . 306 LEU C . 50715 1 789 . 1 . 1 168 168 LEU CA C 13 56.072 0.083 . 1 . . . . . 306 LEU CA . 50715 1 790 . 1 . 1 168 168 LEU CB C 13 41.300 0.000 . 1 . . . . . 306 LEU CB . 50715 1 791 . 1 . 1 168 168 LEU N N 15 116.448 0.020 . 1 . . . . . 306 LEU N . 50715 1 792 . 1 . 1 169 169 PHE H H 1 8.507 0.001 . 1 . . . . . 307 PHE HN . 50715 1 793 . 1 . 1 169 169 PHE C C 13 176.889 0.013 . 1 . . . . . 307 PHE C . 50715 1 794 . 1 . 1 169 169 PHE CA C 13 60.666 0.092 . 1 . . . . . 307 PHE CA . 50715 1 795 . 1 . 1 169 169 PHE CB C 13 39.167 0.007 . 1 . . . . . 307 PHE CB . 50715 1 796 . 1 . 1 169 169 PHE N N 15 119.378 0.027 . 1 . . . . . 307 PHE N . 50715 1 797 . 1 . 1 170 170 ASN H H 1 7.720 0.002 . 1 . . . . . 308 ASN HN . 50715 1 798 . 1 . 1 170 170 ASN C C 13 175.836 0.037 . 1 . . . . . 308 ASN C . 50715 1 799 . 1 . 1 170 170 ASN CA C 13 55.017 0.037 . 1 . . . . . 308 ASN CA . 50715 1 800 . 1 . 1 170 170 ASN CB C 13 39.969 0.002 . 1 . . . . . 308 ASN CB . 50715 1 801 . 1 . 1 170 170 ASN N N 15 114.019 0.025 . 1 . . . . . 308 ASN N . 50715 1 802 . 1 . 1 171 171 VAL H H 1 8.118 0.001 . 1 . . . . . 309 VAL HN . 50715 1 803 . 1 . 1 171 171 VAL C C 13 175.801 0.000 . 1 . . . . . 309 VAL C . 50715 1 804 . 1 . 1 171 171 VAL CA C 13 62.571 0.000 . 1 . . . . . 309 VAL CA . 50715 1 805 . 1 . 1 171 171 VAL CB C 13 31.283 0.002 . 1 . . . . . 309 VAL CB . 50715 1 806 . 1 . 1 171 171 VAL N N 15 118.103 0.033 . 1 . . . . . 309 VAL N . 50715 1 807 . 1 . 1 172 172 SER H H 1 7.747 0.001 . 1 . . . . . 310 SER HN . 50715 1 808 . 1 . 1 172 172 SER C C 13 174.140 0.000 . 1 . . . . . 310 SER C . 50715 1 809 . 1 . 1 172 172 SER CA C 13 60.665 0.000 . 1 . . . . . 310 SER CA . 50715 1 810 . 1 . 1 172 172 SER CB C 13 63.089 0.000 . 1 . . . . . 310 SER CB . 50715 1 811 . 1 . 1 172 172 SER N N 15 113.835 0.018 . 1 . . . . . 310 SER N . 50715 1 812 . 1 . 1 173 173 ASP H H 1 7.880 0.001 . 1 . . . . . 311 ASP HN . 50715 1 813 . 1 . 1 173 173 ASP C C 13 176.015 0.000 . 1 . . . . . 311 ASP C . 50715 1 814 . 1 . 1 173 173 ASP CA C 13 53.441 0.024 . 1 . . . . . 311 ASP CA . 50715 1 815 . 1 . 1 173 173 ASP CB C 13 41.659 0.010 . 1 . . . . . 311 ASP CB . 50715 1 816 . 1 . 1 173 173 ASP N N 15 118.391 0.004 . 1 . . . . . 311 ASP N . 50715 1 817 . 1 . 1 174 174 SER H H 1 8.244 0.001 . 1 . . . . . 312 SER HN . 50715 1 818 . 1 . 1 174 174 SER C C 13 174.577 0.000 . 1 . . . . . 312 SER C . 50715 1 819 . 1 . 1 174 174 SER CA C 13 58.086 0.010 . 1 . . . . . 312 SER CA . 50715 1 820 . 1 . 1 174 174 SER CB C 13 65.409 0.028 . 1 . . . . . 312 SER CB . 50715 1 821 . 1 . 1 174 174 SER N N 15 110.908 0.014 . 1 . . . . . 312 SER N . 50715 1 822 . 1 . 1 175 175 SER H H 1 9.344 0.003 . 1 . . . . . 313 SER HN . 50715 1 823 . 1 . 1 175 175 SER C C 13 176.266 0.005 . 1 . . . . . 313 SER C . 50715 1 824 . 1 . 1 175 175 SER CA C 13 57.708 0.096 . 1 . . . . . 313 SER CA . 50715 1 825 . 1 . 1 175 175 SER CB C 13 63.767 0.007 . 1 . . . . . 313 SER CB . 50715 1 826 . 1 . 1 175 175 SER N N 15 124.151 0.011 . 1 . . . . . 313 SER N . 50715 1 827 . 1 . 1 176 176 ALA H H 1 10.381 0.004 . 1 . . . . . 314 ALA HN . 50715 1 828 . 1 . 1 176 176 ALA C C 13 179.034 0.001 . 1 . . . . . 314 ALA C . 50715 1 829 . 1 . 1 176 176 ALA CA C 13 55.578 0.073 . 1 . . . . . 314 ALA CA . 50715 1 830 . 1 . 1 176 176 ALA CB C 13 17.872 0.008 . 1 . . . . . 314 ALA CB . 50715 1 831 . 1 . 1 176 176 ALA N N 15 126.705 0.012 . 1 . . . . . 314 ALA N . 50715 1 832 . 1 . 1 177 177 LEU H H 1 8.481 0.003 . 1 . . . . . 315 LEU HN . 50715 1 833 . 1 . 1 177 177 LEU C C 13 179.007 0.006 . 1 . . . . . 315 LEU C . 50715 1 834 . 1 . 1 177 177 LEU CA C 13 57.808 0.022 . 1 . . . . . 315 LEU CA . 50715 1 835 . 1 . 1 177 177 LEU CB C 13 40.589 0.011 . 1 . . . . . 315 LEU CB . 50715 1 836 . 1 . 1 177 177 LEU N N 15 118.380 0.033 . 1 . . . . . 315 LEU N . 50715 1 837 . 1 . 1 178 178 ASN H H 1 7.581 0.002 . 1 . . . . . 316 ASN HN . 50715 1 838 . 1 . 1 178 178 ASN C C 13 177.960 0.014 . 1 . . . . . 316 ASN C . 50715 1 839 . 1 . 1 178 178 ASN CA C 13 56.058 0.026 . 1 . . . . . 316 ASN CA . 50715 1 840 . 1 . 1 178 178 ASN CB C 13 38.406 0.036 . 1 . . . . . 316 ASN CB . 50715 1 841 . 1 . 1 178 178 ASN N N 15 116.006 0.058 . 1 . . . . . 316 ASN N . 50715 1 842 . 1 . 1 179 179 LEU H H 1 7.643 0.002 . 1 . . . . . 317 LEU HN . 50715 1 843 . 1 . 1 179 179 LEU C C 13 177.749 0.045 . 1 . . . . . 317 LEU C . 50715 1 844 . 1 . 1 179 179 LEU CA C 13 58.145 0.025 . 1 . . . . . 317 LEU CA . 50715 1 845 . 1 . 1 179 179 LEU CB C 13 41.811 0.005 . 1 . . . . . 317 LEU CB . 50715 1 846 . 1 . 1 179 179 LEU N N 15 121.937 0.013 . 1 . . . . . 317 LEU N . 50715 1 847 . 1 . 1 180 180 ALA H H 1 8.156 0.003 . 1 . . . . . 318 ALA HN . 50715 1 848 . 1 . 1 180 180 ALA C C 13 179.400 0.029 . 1 . . . . . 318 ALA C . 50715 1 849 . 1 . 1 180 180 ALA CA C 13 55.031 0.002 . 1 . . . . . 318 ALA CA . 50715 1 850 . 1 . 1 180 180 ALA CB C 13 16.973 0.008 . 1 . . . . . 318 ALA CB . 50715 1 851 . 1 . 1 180 180 ALA N N 15 119.362 0.014 . 1 . . . . . 318 ALA N . 50715 1 852 . 1 . 1 181 181 LYS H H 1 7.664 0.005 . 1 . . . . . 319 LYS HN . 50715 1 853 . 1 . 1 181 181 LYS C C 13 178.964 0.004 . 1 . . . . . 319 LYS C . 50715 1 854 . 1 . 1 181 181 LYS CA C 13 58.363 0.010 . 1 . . . . . 319 LYS CA . 50715 1 855 . 1 . 1 181 181 LYS CB C 13 31.527 0.001 . 1 . . . . . 319 LYS CB . 50715 1 856 . 1 . 1 181 181 LYS N N 15 115.120 0.037 . 1 . . . . . 319 LYS N . 50715 1 857 . 1 . 1 182 182 ASN H H 1 7.499 0.002 . 1 . . . . . 320 ASN HN . 50715 1 858 . 1 . 1 182 182 ASN C C 13 176.271 0.018 . 1 . . . . . 320 ASN C . 50715 1 859 . 1 . 1 182 182 ASN CA C 13 55.797 0.010 . 1 . . . . . 320 ASN CA . 50715 1 860 . 1 . 1 182 182 ASN CB C 13 39.701 0.015 . 1 . . . . . 320 ASN CB . 50715 1 861 . 1 . 1 182 182 ASN N N 15 115.813 0.018 . 1 . . . . . 320 ASN N . 50715 1 862 . 1 . 1 183 183 ILE H H 1 7.788 0.002 . 1 . . . . . 321 ILE HN . 50715 1 863 . 1 . 1 183 183 ILE C C 13 175.897 0.007 . 1 . . . . . 321 ILE C . 50715 1 864 . 1 . 1 183 183 ILE CA C 13 61.424 0.060 . 1 . . . . . 321 ILE CA . 50715 1 865 . 1 . 1 183 183 ILE CB C 13 37.519 0.072 . 1 . . . . . 321 ILE CB . 50715 1 866 . 1 . 1 183 183 ILE N N 15 113.610 0.015 . 1 . . . . . 321 ILE N . 50715 1 867 . 1 . 1 184 184 GLY H H 1 7.595 0.003 . 1 . . . . . 322 GLY HN . 50715 1 868 . 1 . 1 184 184 GLY C C 13 174.689 0.006 . 1 . . . . . 322 GLY C . 50715 1 869 . 1 . 1 184 184 GLY CA C 13 45.693 0.015 . 1 . . . . . 322 GLY CA . 50715 1 870 . 1 . 1 184 184 GLY N N 15 108.782 0.051 . 1 . . . . . 322 GLY N . 50715 1 871 . 1 . 1 185 185 LEU H H 1 7.969 0.009 . 1 . . . . . 323 LEU HN . 50715 1 872 . 1 . 1 185 185 LEU C C 13 177.138 0.017 . 1 . . . . . 323 LEU C . 50715 1 873 . 1 . 1 185 185 LEU CA C 13 54.741 0.001 . 1 . . . . . 323 LEU CA . 50715 1 874 . 1 . 1 185 185 LEU CB C 13 41.289 0.020 . 1 . . . . . 323 LEU CB . 50715 1 875 . 1 . 1 185 185 LEU N N 15 121.428 0.058 . 1 . . . . . 323 LEU N . 50715 1 876 . 1 . 1 186 186 THR H H 1 8.194 0.002 . 1 . . . . . 324 THR HN . 50715 1 877 . 1 . 1 186 186 THR C C 13 174.985 0.000 . 1 . . . . . 324 THR C . 50715 1 878 . 1 . 1 186 186 THR CA C 13 62.565 0.000 . 1 . . . . . 324 THR CA . 50715 1 879 . 1 . 1 186 186 THR CB C 13 69.154 0.000 . 1 . . . . . 324 THR CB . 50715 1 880 . 1 . 1 186 186 THR N N 15 113.555 0.010 . 1 . . . . . 324 THR N . 50715 1 881 . 1 . 1 187 187 LYS C C 13 176.439 0.000 . 1 . . . . . 325 LYS C . 50715 1 882 . 1 . 1 187 187 LYS CA C 13 53.884 0.000 . 1 . . . . . 325 LYS CA . 50715 1 883 . 1 . 1 187 187 LYS CB C 13 31.913 0.000 . 1 . . . . . 325 LYS CB . 50715 1 884 . 1 . 1 188 188 ALA H H 1 8.244 0.004 . 1 . . . . . 326 ALA HN . 50715 1 885 . 1 . 1 188 188 ALA C C 13 178.475 0.011 . 1 . . . . . 326 ALA C . 50715 1 886 . 1 . 1 188 188 ALA CA C 13 53.765 0.000 . 1 . . . . . 326 ALA CA . 50715 1 887 . 1 . 1 188 188 ALA CB C 13 17.817 0.000 . 1 . . . . . 326 ALA CB . 50715 1 888 . 1 . 1 188 188 ALA N N 15 123.719 0.019 . 1 . . . . . 326 ALA N . 50715 1 889 . 1 . 1 189 189 ARG H H 1 8.133 0.012 . 1 . . . . . 327 ARG HN . 50715 1 890 . 1 . 1 189 189 ARG C C 13 176.689 0.028 . 1 . . . . . 327 ARG C . 50715 1 891 . 1 . 1 189 189 ARG CA C 13 56.902 0.022 . 1 . . . . . 327 ARG CA . 50715 1 892 . 1 . 1 189 189 ARG CB C 13 29.307 0.006 . 1 . . . . . 327 ARG CB . 50715 1 893 . 1 . 1 189 189 ARG N N 15 116.502 0.020 . 1 . . . . . 327 ARG N . 50715 1 894 . 1 . 1 190 190 ASP H H 1 7.839 0.007 . 1 . . . . . 328 ASP HN . 50715 1 895 . 1 . 1 190 190 ASP C C 13 177.244 0.027 . 1 . . . . . 328 ASP C . 50715 1 896 . 1 . 1 190 190 ASP CA C 13 55.019 0.013 . 1 . . . . . 328 ASP CA . 50715 1 897 . 1 . 1 190 190 ASP CB C 13 40.369 0.018 . 1 . . . . . 328 ASP CB . 50715 1 898 . 1 . 1 190 190 ASP N N 15 119.759 0.034 . 1 . . . . . 328 ASP N . 50715 1 899 . 1 . 1 191 191 ILE H H 1 7.925 0.005 . 1 . . . . . 329 ILE HN . 50715 1 900 . 1 . 1 191 191 ILE C C 13 176.416 0.011 . 1 . . . . . 329 ILE C . 50715 1 901 . 1 . 1 191 191 ILE CA C 13 61.881 0.024 . 1 . . . . . 329 ILE CA . 50715 1 902 . 1 . 1 191 191 ILE CB C 13 37.295 0.003 . 1 . . . . . 329 ILE CB . 50715 1 903 . 1 . 1 191 191 ILE N N 15 119.305 0.088 . 1 . . . . . 329 ILE N . 50715 1 904 . 1 . 1 192 192 ASN H H 1 7.998 0.008 . 1 . . . . . 330 ASN HN . 50715 1 905 . 1 . 1 192 192 ASN C C 13 176.635 0.041 . 1 . . . . . 330 ASN C . 50715 1 906 . 1 . 1 192 192 ASN CA C 13 56.695 0.097 . 1 . . . . . 330 ASN CA . 50715 1 907 . 1 . 1 192 192 ASN CB C 13 37.698 0.085 . 1 . . . . . 330 ASN CB . 50715 1 908 . 1 . 1 192 192 ASN N N 15 120.470 0.022 . 1 . . . . . 330 ASN N . 50715 1 909 . 1 . 1 193 193 ALA H H 1 7.765 0.006 . 1 . . . . . 331 ALA HN . 50715 1 910 . 1 . 1 193 193 ALA C C 13 180.434 0.005 . 1 . . . . . 331 ALA C . 50715 1 911 . 1 . 1 193 193 ALA CA C 13 54.680 0.015 . 1 . . . . . 331 ALA CA . 50715 1 912 . 1 . 1 193 193 ALA CB C 13 17.327 0.032 . 1 . . . . . 331 ALA CB . 50715 1 913 . 1 . 1 193 193 ALA N N 15 119.465 0.015 . 1 . . . . . 331 ALA N . 50715 1 914 . 1 . 1 194 194 VAL H H 1 7.245 0.002 . 1 . . . . . 332 VAL HN . 50715 1 915 . 1 . 1 194 194 VAL C C 13 177.916 0.017 . 1 . . . . . 332 VAL C . 50715 1 916 . 1 . 1 194 194 VAL CA C 13 65.242 0.030 . 1 . . . . . 332 VAL CA . 50715 1 917 . 1 . 1 194 194 VAL CB C 13 30.706 0.039 . 1 . . . . . 332 VAL CB . 50715 1 918 . 1 . 1 194 194 VAL N N 15 117.691 0.014 . 1 . . . . . 332 VAL N . 50715 1 919 . 1 . 1 195 195 LEU H H 1 7.761 0.002 . 1 . . . . . 333 LEU HN . 50715 1 920 . 1 . 1 195 195 LEU C C 13 178.329 0.004 . 1 . . . . . 333 LEU C . 50715 1 921 . 1 . 1 195 195 LEU CA C 13 57.701 0.082 . 1 . . . . . 333 LEU CA . 50715 1 922 . 1 . 1 195 195 LEU CB C 13 39.129 0.013 . 1 . . . . . 333 LEU CB . 50715 1 923 . 1 . 1 195 195 LEU N N 15 120.936 0.027 . 1 . . . . . 333 LEU N . 50715 1 924 . 1 . 1 196 196 ILE H H 1 7.851 0.003 . 1 . . . . . 334 ILE HN . 50715 1 925 . 1 . 1 196 196 ILE C C 13 179.197 0.004 . 1 . . . . . 334 ILE C . 50715 1 926 . 1 . 1 196 196 ILE CA C 13 64.184 0.001 . 1 . . . . . 334 ILE CA . 50715 1 927 . 1 . 1 196 196 ILE CB C 13 36.646 0.047 . 1 . . . . . 334 ILE CB . 50715 1 928 . 1 . 1 196 196 ILE N N 15 117.560 0.017 . 1 . . . . . 334 ILE N . 50715 1 929 . 1 . 1 197 197 ASP H H 1 7.389 0.002 . 1 . . . . . 335 ASP HN . 50715 1 930 . 1 . 1 197 197 ASP C C 13 178.698 0.009 . 1 . . . . . 335 ASP C . 50715 1 931 . 1 . 1 197 197 ASP CA C 13 57.519 0.060 . 1 . . . . . 335 ASP CA . 50715 1 932 . 1 . 1 197 197 ASP CB C 13 41.293 0.023 . 1 . . . . . 335 ASP CB . 50715 1 933 . 1 . 1 197 197 ASP N N 15 121.848 0.025 . 1 . . . . . 335 ASP N . 50715 1 934 . 1 . 1 198 198 MET H H 1 8.400 0.001 . 1 . . . . . 336 MET HN . 50715 1 935 . 1 . 1 198 198 MET C C 13 178.820 0.009 . 1 . . . . . 336 MET C . 50715 1 936 . 1 . 1 198 198 MET CA C 13 59.086 0.001 . 1 . . . . . 336 MET CA . 50715 1 937 . 1 . 1 198 198 MET CB C 13 34.675 0.010 . 1 . . . . . 336 MET CB . 50715 1 938 . 1 . 1 198 198 MET N N 15 117.975 0.021 . 1 . . . . . 336 MET N . 50715 1 939 . 1 . 1 199 199 GLU H H 1 8.989 0.004 . 1 . . . . . 337 GLU HN . 50715 1 940 . 1 . 1 199 199 GLU C C 13 180.886 0.033 . 1 . . . . . 337 GLU C . 50715 1 941 . 1 . 1 199 199 GLU CA C 13 58.435 0.012 . 1 . . . . . 337 GLU CA . 50715 1 942 . 1 . 1 199 199 GLU CB C 13 29.743 0.002 . 1 . . . . . 337 GLU CB . 50715 1 943 . 1 . 1 199 199 GLU N N 15 124.896 0.022 . 1 . . . . . 337 GLU N . 50715 1 944 . 1 . 1 200 200 ARG H H 1 8.204 0.001 . 1 . . . . . 338 ARG HN . 50715 1 945 . 1 . 1 200 200 ARG C C 13 178.696 0.041 . 1 . . . . . 338 ARG C . 50715 1 946 . 1 . 1 200 200 ARG CA C 13 59.062 0.032 . 1 . . . . . 338 ARG CA . 50715 1 947 . 1 . 1 200 200 ARG CB C 13 28.988 0.000 . 1 . . . . . 338 ARG CB . 50715 1 948 . 1 . 1 200 200 ARG N N 15 122.766 0.023 . 1 . . . . . 338 ARG N . 50715 1 949 . 1 . 1 201 201 GLN H H 1 7.809 0.003 . 1 . . . . . 339 GLN HN . 50715 1 950 . 1 . 1 201 201 GLN C C 13 176.391 0.014 . 1 . . . . . 339 GLN C . 50715 1 951 . 1 . 1 201 201 GLN CA C 13 55.985 0.012 . 1 . . . . . 339 GLN CA . 50715 1 952 . 1 . 1 201 201 GLN CB C 13 28.408 0.012 . 1 . . . . . 339 GLN CB . 50715 1 953 . 1 . 1 201 201 GLN N N 15 114.515 0.033 . 1 . . . . . 339 GLN N . 50715 1 954 . 1 . 1 202 202 GLY H H 1 7.831 0.002 . 1 . . . . . 340 GLY HN . 50715 1 955 . 1 . 1 202 202 GLY C C 13 175.243 0.025 . 1 . . . . . 340 GLY C . 50715 1 956 . 1 . 1 202 202 GLY CA C 13 45.389 0.016 . 1 . . . . . 340 GLY CA . 50715 1 957 . 1 . 1 202 202 GLY N N 15 105.863 0.025 . 1 . . . . . 340 GLY N . 50715 1 958 . 1 . 1 203 203 ASP H H 1 8.412 0.002 . 1 . . . . . 341 ASP HN . 50715 1 959 . 1 . 1 203 203 ASP C C 13 175.955 0.004 . 1 . . . . . 341 ASP C . 50715 1 960 . 1 . 1 203 203 ASP CA C 13 56.602 0.004 . 1 . . . . . 341 ASP CA . 50715 1 961 . 1 . 1 203 203 ASP CB C 13 42.480 0.011 . 1 . . . . . 341 ASP CB . 50715 1 962 . 1 . 1 203 203 ASP N N 15 120.812 0.012 . 1 . . . . . 341 ASP N . 50715 1 963 . 1 . 1 204 204 VAL H H 1 6.940 0.001 . 1 . . . . . 342 VAL HN . 50715 1 964 . 1 . 1 204 204 VAL C C 13 174.672 0.013 . 1 . . . . . 342 VAL C . 50715 1 965 . 1 . 1 204 204 VAL CA C 13 57.841 0.009 . 1 . . . . . 342 VAL CA . 50715 1 966 . 1 . 1 204 204 VAL CB C 13 36.349 0.050 . 1 . . . . . 342 VAL CB . 50715 1 967 . 1 . 1 204 204 VAL N N 15 106.442 0.024 . 1 . . . . . 342 VAL N . 50715 1 968 . 1 . 1 205 205 TYR H H 1 9.366 0.002 . 1 . . . . . 343 TYR HN . 50715 1 969 . 1 . 1 205 205 TYR C C 13 172.160 0.018 . 1 . . . . . 343 TYR C . 50715 1 970 . 1 . 1 205 205 TYR CA C 13 55.953 0.006 . 1 . . . . . 343 TYR CA . 50715 1 971 . 1 . 1 205 205 TYR CB C 13 40.552 0.087 . 1 . . . . . 343 TYR CB . 50715 1 972 . 1 . 1 205 205 TYR N N 15 117.707 0.015 . 1 . . . . . 343 TYR N . 50715 1 973 . 1 . 1 206 206 ARG H H 1 8.538 0.002 . 1 . . . . . 344 ARG HN . 50715 1 974 . 1 . 1 206 206 ARG C C 13 175.627 0.015 . 1 . . . . . 344 ARG C . 50715 1 975 . 1 . 1 206 206 ARG CA C 13 52.536 0.008 . 1 . . . . . 344 ARG CA . 50715 1 976 . 1 . 1 206 206 ARG CB C 13 31.013 0.002 . 1 . . . . . 344 ARG CB . 50715 1 977 . 1 . 1 206 206 ARG N N 15 118.392 0.012 . 1 . . . . . 344 ARG N . 50715 1 978 . 1 . 1 207 207 GLN H H 1 8.607 0.002 . 1 . . . . . 345 GLN HN . 50715 1 979 . 1 . 1 207 207 GLN C C 13 175.942 0.027 . 1 . . . . . 345 GLN C . 50715 1 980 . 1 . 1 207 207 GLN CA C 13 54.652 0.016 . 1 . . . . . 345 GLN CA . 50715 1 981 . 1 . 1 207 207 GLN CB C 13 31.549 0.057 . 1 . . . . . 345 GLN CB . 50715 1 982 . 1 . 1 207 207 GLN N N 15 120.619 0.024 . 1 . . . . . 345 GLN N . 50715 1 983 . 1 . 1 208 208 GLY H H 1 8.567 0.002 . 1 . . . . . 346 GLY HN . 50715 1 984 . 1 . 1 208 208 GLY C C 13 173.844 0.003 . 1 . . . . . 346 GLY C . 50715 1 985 . 1 . 1 208 208 GLY CA C 13 44.358 0.009 . 1 . . . . . 346 GLY CA . 50715 1 986 . 1 . 1 208 208 GLY N N 15 111.952 0.012 . 1 . . . . . 346 GLY N . 50715 1 987 . 1 . 1 209 209 THR H H 1 8.050 0.002 . 1 . . . . . 347 THR HN . 50715 1 988 . 1 . 1 209 209 THR C C 13 174.768 0.000 . 1 . . . . . 347 THR C . 50715 1 989 . 1 . 1 209 209 THR CA C 13 61.233 0.000 . 1 . . . . . 347 THR CA . 50715 1 990 . 1 . 1 209 209 THR CB C 13 70.564 0.000 . 1 . . . . . 347 THR CB . 50715 1 991 . 1 . 1 209 209 THR N N 15 107.306 0.026 . 1 . . . . . 347 THR N . 50715 1 992 . 1 . 1 213 213 ILE C C 13 175.000 0.000 . 1 . . . . . 351 ILE C . 50715 1 993 . 1 . 1 213 213 ILE CA C 13 58.160 0.000 . 1 . . . . . 351 ILE CA . 50715 1 994 . 1 . 1 213 213 ILE CB C 13 36.833 0.000 . 1 . . . . . 351 ILE CB . 50715 1 995 . 1 . 1 214 214 TRP H H 1 8.478 0.005 . 1 . . . . . 352 TRP HN . 50715 1 996 . 1 . 1 214 214 TRP HE1 H 1 9.783 0.000 . 1 . . . . . 352 TRP HE1 . 50715 1 997 . 1 . 1 214 214 TRP C C 13 174.754 0.029 . 1 . . . . . 352 TRP C . 50715 1 998 . 1 . 1 214 214 TRP CA C 13 56.712 0.006 . 1 . . . . . 352 TRP CA . 50715 1 999 . 1 . 1 214 214 TRP CB C 13 29.636 0.008 . 1 . . . . . 352 TRP CB . 50715 1 1000 . 1 . 1 214 214 TRP N N 15 128.346 0.029 . 1 . . . . . 352 TRP N . 50715 1 1001 . 1 . 1 214 214 TRP NE1 N 15 127.181 0.000 . 1 . . . . . 352 TRP NE1 . 50715 1 1002 . 1 . 1 215 215 HIS H H 1 8.599 0.003 . 1 . . . . . 353 HIS HN . 50715 1 1003 . 1 . 1 215 215 HIS CA C 13 52.901 0.014 . 1 . . . . . 353 HIS CA . 50715 1 1004 . 1 . 1 215 215 HIS CB C 13 32.408 0.079 . 1 . . . . . 353 HIS CB . 50715 1 1005 . 1 . 1 215 215 HIS N N 15 116.049 0.035 . 1 . . . . . 353 HIS N . 50715 1 1006 . 1 . 1 216 216 LEU H H 1 8.905 0.002 . 1 . . . . . 354 LEU HN . 50715 1 1007 . 1 . 1 216 216 LEU C C 13 179.185 0.004 . 1 . . . . . 354 LEU C . 50715 1 1008 . 1 . 1 216 216 LEU CA C 13 55.178 0.053 . 1 . . . . . 354 LEU CA . 50715 1 1009 . 1 . 1 216 216 LEU CB C 13 42.784 0.036 . 1 . . . . . 354 LEU CB . 50715 1 1010 . 1 . 1 216 216 LEU N N 15 121.695 0.016 . 1 . . . . . 354 LEU N . 50715 1 1011 . 1 . 1 217 217 THR H H 1 8.016 0.003 . 1 . . . . . 355 THR HN . 50715 1 1012 . 1 . 1 217 217 THR C C 13 175.523 0.014 . 1 . . . . . 355 THR C . 50715 1 1013 . 1 . 1 217 217 THR CA C 13 61.004 0.014 . 1 . . . . . 355 THR CA . 50715 1 1014 . 1 . 1 217 217 THR CB C 13 69.955 0.000 . 1 . . . . . 355 THR CB . 50715 1 1015 . 1 . 1 217 217 THR N N 15 113.122 0.020 . 1 . . . . . 355 THR N . 50715 1 1016 . 1 . 1 218 218 ASP H H 1 8.964 0.002 . 1 . . . . . 356 ASP HN . 50715 1 1017 . 1 . 1 218 218 ASP C C 13 178.955 0.004 . 1 . . . . . 356 ASP C . 50715 1 1018 . 1 . 1 218 218 ASP CA C 13 57.259 0.004 . 1 . . . . . 356 ASP CA . 50715 1 1019 . 1 . 1 218 218 ASP CB C 13 39.123 0.018 . 1 . . . . . 356 ASP CB . 50715 1 1020 . 1 . 1 218 218 ASP N N 15 121.920 0.015 . 1 . . . . . 356 ASP N . 50715 1 1021 . 1 . 1 219 219 LYS H H 1 8.262 0.002 . 1 . . . . . 357 LYS HN . 50715 1 1022 . 1 . 1 219 219 LYS C C 13 178.616 0.001 . 1 . . . . . 357 LYS C . 50715 1 1023 . 1 . 1 219 219 LYS CA C 13 58.497 0.014 . 1 . . . . . 357 LYS CA . 50715 1 1024 . 1 . 1 219 219 LYS CB C 13 31.273 0.009 . 1 . . . . . 357 LYS CB . 50715 1 1025 . 1 . 1 219 219 LYS N N 15 117.896 0.023 . 1 . . . . . 357 LYS N . 50715 1 1026 . 1 . 1 220 220 LYS H H 1 7.523 0.002 . 1 . . . . . 358 LYS HN . 50715 1 1027 . 1 . 1 220 220 LYS C C 13 178.196 0.001 . 1 . . . . . 358 LYS C . 50715 1 1028 . 1 . 1 220 220 LYS CA C 13 56.979 0.000 . 1 . . . . . 358 LYS CA . 50715 1 1029 . 1 . 1 220 220 LYS CB C 13 31.644 0.000 . 1 . . . . . 358 LYS CB . 50715 1 1030 . 1 . 1 220 220 LYS N N 15 120.537 0.020 . 1 . . . . . 358 LYS N . 50715 1 1031 . 1 . 1 221 221 ARG H H 1 8.625 0.002 . 1 . . . . . 359 ARG HN . 50715 1 1032 . 1 . 1 221 221 ARG C C 13 178.689 0.005 . 1 . . . . . 359 ARG C . 50715 1 1033 . 1 . 1 221 221 ARG CA C 13 60.351 0.000 . 1 . . . . . 359 ARG CA . 50715 1 1034 . 1 . 1 221 221 ARG CB C 13 29.306 0.000 . 1 . . . . . 359 ARG CB . 50715 1 1035 . 1 . 1 221 221 ARG N N 15 119.303 0.017 . 1 . . . . . 359 ARG N . 50715 1 1036 . 1 . 1 222 222 GLU H H 1 8.149 0.001 . 1 . . . . . 360 GLU HN . 50715 1 1037 . 1 . 1 222 222 GLU C C 13 179.233 0.008 . 1 . . . . . 360 GLU C . 50715 1 1038 . 1 . 1 222 222 GLU CA C 13 58.771 0.037 . 1 . . . . . 360 GLU CA . 50715 1 1039 . 1 . 1 222 222 GLU CB C 13 28.884 0.060 . 1 . . . . . 360 GLU CB . 50715 1 1040 . 1 . 1 222 222 GLU N N 15 116.643 0.062 . 1 . . . . . 360 GLU N . 50715 1 1041 . 1 . 1 223 223 ARG H H 1 7.598 0.002 . 1 . . . . . 361 ARG HN . 50715 1 1042 . 1 . 1 223 223 ARG C C 13 178.429 0.005 . 1 . . . . . 361 ARG C . 50715 1 1043 . 1 . 1 223 223 ARG CA C 13 57.450 0.002 . 1 . . . . . 361 ARG CA . 50715 1 1044 . 1 . 1 223 223 ARG CB C 13 29.265 0.025 . 1 . . . . . 361 ARG CB . 50715 1 1045 . 1 . 1 223 223 ARG N N 15 117.709 0.012 . 1 . . . . . 361 ARG N . 50715 1 1046 . 1 . 1 224 224 MET H H 1 7.825 0.003 . 1 . . . . . 362 MET HN . 50715 1 1047 . 1 . 1 224 224 MET C C 13 176.406 0.000 . 1 . . . . . 362 MET C . 50715 1 1048 . 1 . 1 224 224 MET CA C 13 56.952 0.001 . 1 . . . . . 362 MET CA . 50715 1 1049 . 1 . 1 224 224 MET CB C 13 32.309 0.038 . 1 . . . . . 362 MET CB . 50715 1 1050 . 1 . 1 224 224 MET N N 15 117.727 0.033 . 1 . . . . . 362 MET N . 50715 1 1051 . 1 . 1 225 225 GLN H H 1 7.564 0.002 . 1 . . . . . 363 GLN HN . 50715 1 1052 . 1 . 1 225 225 GLN C C 13 175.801 0.044 . 1 . . . . . 363 GLN C . 50715 1 1053 . 1 . 1 225 225 GLN CA C 13 55.989 0.014 . 1 . . . . . 363 GLN CA . 50715 1 1054 . 1 . 1 225 225 GLN CB C 13 28.821 0.005 . 1 . . . . . 363 GLN CB . 50715 1 1055 . 1 . 1 225 225 GLN N N 15 117.144 0.009 . 1 . . . . . 363 GLN N . 50715 1 1056 . 1 . 1 226 226 ILE H H 1 7.681 0.002 . 1 . . . . . 364 ILE HN . 50715 1 1057 . 1 . 1 226 226 ILE C C 13 175.243 0.021 . 1 . . . . . 364 ILE C . 50715 1 1058 . 1 . 1 226 226 ILE CA C 13 61.075 0.068 . 1 . . . . . 364 ILE CA . 50715 1 1059 . 1 . 1 226 226 ILE CB C 13 37.365 0.035 . 1 . . . . . 364 ILE CB . 50715 1 1060 . 1 . 1 226 226 ILE N N 15 120.724 0.018 . 1 . . . . . 364 ILE N . 50715 1 1061 . 1 . 1 227 227 LYS H H 1 7.783 0.002 . 1 . . . . . 365 LYS HN . 50715 1 1062 . 1 . 1 227 227 LYS C C 13 181.243 0.000 . 1 . . . . . 365 LYS C . 50715 1 1063 . 1 . 1 227 227 LYS CA C 13 57.251 0.000 . 1 . . . . . 365 LYS CA . 50715 1 1064 . 1 . 1 227 227 LYS CB C 13 32.801 0.000 . 1 . . . . . 365 LYS CB . 50715 1 1065 . 1 . 1 227 227 LYS N N 15 130.303 0.007 . 1 . . . . . 365 LYS N . 50715 1 stop_ save_