data_17468 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 17468 _Entry.Title ; Resonance assignment of a 179 residue fragment of hepatitis C virus non-structural protein 5A ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2011-02-14 _Entry.Accession_date 2011-02-14 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Sophie Feuerstein . . . 17468 2 Dieter Willbold . . . 17468 3 Bernhard Brutscher . . . 17468 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID . 'not applicable' 'not applicable' . 17468 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 17468 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 511 17468 '15N chemical shifts' 160 17468 '1H chemical shifts' 160 17468 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 . . 2012-03-09 2011-02-14 update BMRB 'update entry citation' 17468 1 . . 2011-05-03 2011-02-14 original author 'original release' 17468 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 17468 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 21516467 _Citation.Full_citation . _Citation.Title '1H, 13C, and 15N resonance assignment of a 179 residue fragment of hepatitis C virus non-structural protein 5A.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assignments' _Citation.Journal_name_full 'Biomolecular NMR assignments' _Citation.Journal_volume 5 _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 241 _Citation.Page_last 243 _Citation.Year 2011 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Sophie Feuerstein . . . 17468 1 2 Zsofia Solyom . . . 17468 1 3 Amine Alada . . . 17468 1 4 Silke Hoffmann . . . 17468 1 5 Dieter Willbold . . . 17468 1 6 Bernhard Brutscher . . . 17468 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'domain 2' 17468 1 HCV 17468 1 'heteronuclear NMR' 17468 1 'intrinsically disordered proteins' 17468 1 NS5A 17468 1 'resonance assignment' 17468 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 17468 _Assembly.ID 1 _Assembly.Name 'NS5A fragment (191-369) monomer' _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass 20400 _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 'NS5A fragment (191-369) monomer' 1 $NS5A_fragment_(191-369) A . yes native no no . . . 17468 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_NS5A_fragment_(191-369) _Entity.Sf_category entity _Entity.Sf_framecode NS5A_fragment_(191-369) _Entity.Entry_ID 17468 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name NS5A_fragment_(191-369) _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 ; GPLGSLRGGEPEPDVTVLTS MLTDPSHITAETAKRRLARG SPPSLASSSASQLSAPSLKA TCTTHHDSPDADLIEANLLW RQEMGGNITRVESENKVVIL DSFEPLHADGDEREISVAAE ILRKSRKFPSALPIWARPDY NPPLLESWKDPDYVPPVVHG CPLPPTKAPPIPPPRRKRTV VLTESNVS ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq ; 1 . . 9 191 192 . . 368 369 ; _Entity.Polymer_author_seq_details 'residue 1-9 non-native linker between protease cleavage site and NS5A residues 191-369' _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 188 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment 'domain 2 and adjacent LCS regions' _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 20400 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no BMRB 26549 . NS5A(191-447) . . . . . 98.40 268 100.00 100.00 1.15e-127 . . . . 17468 1 2 no DBJ BAA01583 . "polyprotein precursor [Hepatitis C virus]" . . . . . 95.21 3010 99.44 100.00 2.24e-111 . . . . 17468 1 3 no DBJ BAA02756 . "polyprotein precursor [Hepatitis C virus]" . . . . . 95.21 3010 99.44 100.00 2.51e-111 . . . . 17468 1 4 no GB AAC15722 . "polyprotein [Hepatitis C virus subtype 1b]" . . . . . 95.21 3010 99.44 100.00 1.76e-111 . . . . 17468 1 5 no GB AAC15723 . "polyprotein [Hepatitis C virus subtype 1b]" . . . . . 95.21 3010 99.44 100.00 2.26e-111 . . . . 17468 1 6 no GB AAC15724 . "polyprotein [Hepatitis C virus subtype 1b]" . . . . . 95.21 3010 99.44 100.00 2.47e-111 . . . . 17468 1 7 no GB AAC15725 . "polyprotein [Hepatitis C virus subtype 1b]" . . . . . 95.21 3010 99.44 99.44 5.51e-111 . . . . 17468 1 8 no GB AAC15726 . "polyprotein, partial [Hepatitis C virus]" . . . . . 95.21 2864 99.44 100.00 1.53e-111 . . . . 17468 1 9 no SP O92972 . "RecName: Full=Genome polyprotein; Contains: RecName: Full=Core protein p21; AltName: Full=Capsid protein C; AltName: Full=p21; " . . . . . 95.21 3010 99.44 100.00 1.97e-111 . . . . 17468 1 stop_ loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID 'viral RNA replication; signal transduction; virus persistence' 17468 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . GLY . 17468 1 2 . PRO . 17468 1 3 . LEU . 17468 1 4 . GLY . 17468 1 5 . SER . 17468 1 6 . LEU . 17468 1 7 . ARG . 17468 1 8 . GLY . 17468 1 9 . GLY . 17468 1 10 191 GLU . 17468 1 11 192 PRO . 17468 1 12 193 GLU . 17468 1 13 194 PRO . 17468 1 14 195 ASP . 17468 1 15 196 VAL . 17468 1 16 197 THR . 17468 1 17 198 VAL . 17468 1 18 199 LEU . 17468 1 19 200 THR . 17468 1 20 201 SER . 17468 1 21 202 MET . 17468 1 22 203 LEU . 17468 1 23 204 THR . 17468 1 24 205 ASP . 17468 1 25 206 PRO . 17468 1 26 207 SER . 17468 1 27 208 HIS . 17468 1 28 209 ILE . 17468 1 29 210 THR . 17468 1 30 211 ALA . 17468 1 31 212 GLU . 17468 1 32 213 THR . 17468 1 33 214 ALA . 17468 1 34 215 LYS . 17468 1 35 216 ARG . 17468 1 36 217 ARG . 17468 1 37 218 LEU . 17468 1 38 219 ALA . 17468 1 39 220 ARG . 17468 1 40 221 GLY . 17468 1 41 222 SER . 17468 1 42 223 PRO . 17468 1 43 224 PRO . 17468 1 44 225 SER . 17468 1 45 226 LEU . 17468 1 46 227 ALA . 17468 1 47 228 SER . 17468 1 48 229 SER . 17468 1 49 230 SER . 17468 1 50 231 ALA . 17468 1 51 232 SER . 17468 1 52 233 GLN . 17468 1 53 234 LEU . 17468 1 54 235 SER . 17468 1 55 236 ALA . 17468 1 56 237 PRO . 17468 1 57 238 SER . 17468 1 58 239 LEU . 17468 1 59 240 LYS . 17468 1 60 241 ALA . 17468 1 61 242 THR . 17468 1 62 243 CYS . 17468 1 63 244 THR . 17468 1 64 245 THR . 17468 1 65 246 HIS . 17468 1 66 247 HIS . 17468 1 67 248 ASP . 17468 1 68 249 SER . 17468 1 69 250 PRO . 17468 1 70 251 ASP . 17468 1 71 252 ALA . 17468 1 72 253 ASP . 17468 1 73 254 LEU . 17468 1 74 255 ILE . 17468 1 75 256 GLU . 17468 1 76 257 ALA . 17468 1 77 258 ASN . 17468 1 78 259 LEU . 17468 1 79 260 LEU . 17468 1 80 261 TRP . 17468 1 81 262 ARG . 17468 1 82 263 GLN . 17468 1 83 264 GLU . 17468 1 84 265 MET . 17468 1 85 266 GLY . 17468 1 86 267 GLY . 17468 1 87 268 ASN . 17468 1 88 269 ILE . 17468 1 89 270 THR . 17468 1 90 271 ARG . 17468 1 91 272 VAL . 17468 1 92 273 GLU . 17468 1 93 274 SER . 17468 1 94 275 GLU . 17468 1 95 276 ASN . 17468 1 96 277 LYS . 17468 1 97 278 VAL . 17468 1 98 279 VAL . 17468 1 99 280 ILE . 17468 1 100 281 LEU . 17468 1 101 282 ASP . 17468 1 102 283 SER . 17468 1 103 284 PHE . 17468 1 104 285 GLU . 17468 1 105 286 PRO . 17468 1 106 287 LEU . 17468 1 107 288 HIS . 17468 1 108 289 ALA . 17468 1 109 290 ASP . 17468 1 110 291 GLY . 17468 1 111 292 ASP . 17468 1 112 293 GLU . 17468 1 113 294 ARG . 17468 1 114 295 GLU . 17468 1 115 296 ILE . 17468 1 116 297 SER . 17468 1 117 298 VAL . 17468 1 118 299 ALA . 17468 1 119 300 ALA . 17468 1 120 301 GLU . 17468 1 121 302 ILE . 17468 1 122 303 LEU . 17468 1 123 304 ARG . 17468 1 124 305 LYS . 17468 1 125 306 SER . 17468 1 126 307 ARG . 17468 1 127 308 LYS . 17468 1 128 309 PHE . 17468 1 129 310 PRO . 17468 1 130 311 SER . 17468 1 131 312 ALA . 17468 1 132 313 LEU . 17468 1 133 314 PRO . 17468 1 134 315 ILE . 17468 1 135 316 TRP . 17468 1 136 317 ALA . 17468 1 137 318 ARG . 17468 1 138 319 PRO . 17468 1 139 320 ASP . 17468 1 140 321 TYR . 17468 1 141 322 ASN . 17468 1 142 323 PRO . 17468 1 143 324 PRO . 17468 1 144 325 LEU . 17468 1 145 326 LEU . 17468 1 146 327 GLU . 17468 1 147 328 SER . 17468 1 148 329 TRP . 17468 1 149 330 LYS . 17468 1 150 331 ASP . 17468 1 151 332 PRO . 17468 1 152 333 ASP . 17468 1 153 334 TYR . 17468 1 154 335 VAL . 17468 1 155 336 PRO . 17468 1 156 337 PRO . 17468 1 157 338 VAL . 17468 1 158 339 VAL . 17468 1 159 340 HIS . 17468 1 160 341 GLY . 17468 1 161 342 CYS . 17468 1 162 343 PRO . 17468 1 163 344 LEU . 17468 1 164 345 PRO . 17468 1 165 346 PRO . 17468 1 166 347 THR . 17468 1 167 348 LYS . 17468 1 168 349 ALA . 17468 1 169 350 PRO . 17468 1 170 351 PRO . 17468 1 171 352 ILE . 17468 1 172 353 PRO . 17468 1 173 354 PRO . 17468 1 174 355 PRO . 17468 1 175 356 ARG . 17468 1 176 357 ARG . 17468 1 177 358 LYS . 17468 1 178 359 ARG . 17468 1 179 360 THR . 17468 1 180 361 VAL . 17468 1 181 362 VAL . 17468 1 182 363 LEU . 17468 1 183 364 THR . 17468 1 184 365 GLU . 17468 1 185 366 SER . 17468 1 186 367 ASN . 17468 1 187 368 VAL . 17468 1 188 369 SER . 17468 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 17468 1 . PRO 2 2 17468 1 . LEU 3 3 17468 1 . GLY 4 4 17468 1 . SER 5 5 17468 1 . LEU 6 6 17468 1 . ARG 7 7 17468 1 . GLY 8 8 17468 1 . GLY 9 9 17468 1 . GLU 10 10 17468 1 . PRO 11 11 17468 1 . GLU 12 12 17468 1 . PRO 13 13 17468 1 . ASP 14 14 17468 1 . VAL 15 15 17468 1 . THR 16 16 17468 1 . VAL 17 17 17468 1 . LEU 18 18 17468 1 . THR 19 19 17468 1 . SER 20 20 17468 1 . MET 21 21 17468 1 . LEU 22 22 17468 1 . THR 23 23 17468 1 . ASP 24 24 17468 1 . PRO 25 25 17468 1 . SER 26 26 17468 1 . HIS 27 27 17468 1 . ILE 28 28 17468 1 . THR 29 29 17468 1 . ALA 30 30 17468 1 . GLU 31 31 17468 1 . THR 32 32 17468 1 . ALA 33 33 17468 1 . LYS 34 34 17468 1 . ARG 35 35 17468 1 . ARG 36 36 17468 1 . LEU 37 37 17468 1 . ALA 38 38 17468 1 . ARG 39 39 17468 1 . GLY 40 40 17468 1 . SER 41 41 17468 1 . PRO 42 42 17468 1 . PRO 43 43 17468 1 . SER 44 44 17468 1 . LEU 45 45 17468 1 . ALA 46 46 17468 1 . SER 47 47 17468 1 . SER 48 48 17468 1 . SER 49 49 17468 1 . ALA 50 50 17468 1 . SER 51 51 17468 1 . GLN 52 52 17468 1 . LEU 53 53 17468 1 . SER 54 54 17468 1 . ALA 55 55 17468 1 . PRO 56 56 17468 1 . SER 57 57 17468 1 . LEU 58 58 17468 1 . LYS 59 59 17468 1 . ALA 60 60 17468 1 . THR 61 61 17468 1 . CYS 62 62 17468 1 . THR 63 63 17468 1 . THR 64 64 17468 1 . HIS 65 65 17468 1 . HIS 66 66 17468 1 . ASP 67 67 17468 1 . SER 68 68 17468 1 . PRO 69 69 17468 1 . ASP 70 70 17468 1 . ALA 71 71 17468 1 . ASP 72 72 17468 1 . LEU 73 73 17468 1 . ILE 74 74 17468 1 . GLU 75 75 17468 1 . ALA 76 76 17468 1 . ASN 77 77 17468 1 . LEU 78 78 17468 1 . LEU 79 79 17468 1 . TRP 80 80 17468 1 . ARG 81 81 17468 1 . GLN 82 82 17468 1 . GLU 83 83 17468 1 . MET 84 84 17468 1 . GLY 85 85 17468 1 . GLY 86 86 17468 1 . ASN 87 87 17468 1 . ILE 88 88 17468 1 . THR 89 89 17468 1 . ARG 90 90 17468 1 . VAL 91 91 17468 1 . GLU 92 92 17468 1 . SER 93 93 17468 1 . GLU 94 94 17468 1 . ASN 95 95 17468 1 . LYS 96 96 17468 1 . VAL 97 97 17468 1 . VAL 98 98 17468 1 . ILE 99 99 17468 1 . LEU 100 100 17468 1 . ASP 101 101 17468 1 . SER 102 102 17468 1 . PHE 103 103 17468 1 . GLU 104 104 17468 1 . PRO 105 105 17468 1 . LEU 106 106 17468 1 . HIS 107 107 17468 1 . ALA 108 108 17468 1 . ASP 109 109 17468 1 . GLY 110 110 17468 1 . ASP 111 111 17468 1 . GLU 112 112 17468 1 . ARG 113 113 17468 1 . GLU 114 114 17468 1 . ILE 115 115 17468 1 . SER 116 116 17468 1 . VAL 117 117 17468 1 . ALA 118 118 17468 1 . ALA 119 119 17468 1 . GLU 120 120 17468 1 . ILE 121 121 17468 1 . LEU 122 122 17468 1 . ARG 123 123 17468 1 . LYS 124 124 17468 1 . SER 125 125 17468 1 . ARG 126 126 17468 1 . LYS 127 127 17468 1 . PHE 128 128 17468 1 . PRO 129 129 17468 1 . SER 130 130 17468 1 . ALA 131 131 17468 1 . LEU 132 132 17468 1 . PRO 133 133 17468 1 . ILE 134 134 17468 1 . TRP 135 135 17468 1 . ALA 136 136 17468 1 . ARG 137 137 17468 1 . PRO 138 138 17468 1 . ASP 139 139 17468 1 . TYR 140 140 17468 1 . ASN 141 141 17468 1 . PRO 142 142 17468 1 . PRO 143 143 17468 1 . LEU 144 144 17468 1 . LEU 145 145 17468 1 . GLU 146 146 17468 1 . SER 147 147 17468 1 . TRP 148 148 17468 1 . LYS 149 149 17468 1 . ASP 150 150 17468 1 . PRO 151 151 17468 1 . ASP 152 152 17468 1 . TYR 153 153 17468 1 . VAL 154 154 17468 1 . PRO 155 155 17468 1 . PRO 156 156 17468 1 . VAL 157 157 17468 1 . VAL 158 158 17468 1 . HIS 159 159 17468 1 . GLY 160 160 17468 1 . CYS 161 161 17468 1 . PRO 162 162 17468 1 . LEU 163 163 17468 1 . PRO 164 164 17468 1 . PRO 165 165 17468 1 . THR 166 166 17468 1 . LYS 167 167 17468 1 . ALA 168 168 17468 1 . PRO 169 169 17468 1 . PRO 170 170 17468 1 . ILE 171 171 17468 1 . PRO 172 172 17468 1 . PRO 173 173 17468 1 . PRO 174 174 17468 1 . ARG 175 175 17468 1 . ARG 176 176 17468 1 . LYS 177 177 17468 1 . ARG 178 178 17468 1 . THR 179 179 17468 1 . VAL 180 180 17468 1 . VAL 181 181 17468 1 . LEU 182 182 17468 1 . THR 183 183 17468 1 . GLU 184 184 17468 1 . SER 185 185 17468 1 . ASN 186 186 17468 1 . VAL 187 187 17468 1 . SER 188 188 17468 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 17468 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Subvariant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $NS5A_fragment_(191-369) . 31647 virus . 'Hepatitis C virus subtype 1b' 'Hepatitis C virus subtype 1b' . 00.026.0.03.001.01.002. virus . Hepacivirus 'Hepatitis C virus' HC-J4 . . . . . . . . . . . . . . . 'isolate HC-J4' . 'virus host homo sapiens' . . 17468 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source _Entity_experimental_src_list.Entry_ID 17468 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $NS5A_fragment_(191-369) . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli 'BL21 DE3' . . . . . . . . . . . . . . . pGEX-6P-2 . . . . . . 17468 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 17468 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _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 'NS5A fragment (191-369)' '[U-98% 13C; U-98% 15N]' . . 1 $NS5A_fragment_(191-369) . . 130 . . uM . . . . 17468 1 2 H2O 'natural abundance' . . . . . . 95 . . % . . . . 17468 1 3 D2O 'natural abundance' . . . . . . 5 . . % . . . . 17468 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 17468 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 20 . mM 17468 1 pH 6.5 . pH 17468 1 pressure 1 . atm 17468 1 temperature 278 . K 17468 1 stop_ save_ ############################ # Computer software used # ############################ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 17468 _Software.ID 1 _Software.Name NMRPipe _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 17468 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 17468 1 stop_ save_ save_NMRView _Software.Sf_category software _Software.Sf_framecode NMRView _Software.Entry_ID 17468 _Software.ID 2 _Software.Name NMRView _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Johnson, One Moon Scientific' . . 17468 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 17468 2 'data analysis' 17468 2 stop_ save_ save_VNMRJ _Software.Sf_category software _Software.Sf_framecode VNMRJ _Software.Entry_ID 17468 _Software.ID 3 _Software.Name VNMRJ _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Varian . . 17468 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 17468 3 stop_ save_ save_NMRDraw _Software.Sf_category software _Software.Sf_framecode NMRDraw _Software.Entry_ID 17468 _Software.ID 4 _Software.Name NMRDraw _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 17468 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 17468 4 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 17468 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model VNMRS _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 17468 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Varian VNMRS . 800 . . . 17468 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 17468 _Experiment_list.ID 1 _Experiment_list.Details 'sequential resonance assignment of a 179-residue fragment of NS5A, by using a set of sensitivity and resolution optimized 3D correlation experiments, as well as amino-acid-type editing in 1H-15N correlation spectra.' loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N BEST-TROSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17468 1 2 '2D HADAMAC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17468 1 3 '3D BEST-TROSY HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17468 1 4 '3D BEST-TROSY HNcoCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17468 1 5 '3D BEST-TROSY iHNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17468 1 6 '3D BEST-TROSY HNcoCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17468 1 7 '3D BEST-TROSY iHNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17468 1 8 '3D BEST-TROSY hNcocaNH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17468 1 9 '3D BEST-TROSY hnCOcaNH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17468 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 17468 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 . indirect 0.251449530 . . . . . . . . . 17468 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 17468 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 . indirect 0.101329118 . . . . . . . . . 17468 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 17468 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err 0.02 _Assigned_chem_shift_list.Chem_shift_13C_err 0.15 _Assigned_chem_shift_list.Chem_shift_15N_err 0.15 _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 BEST-TROSY' . . . 17468 1 2 '2D HADAMAC' . . . 17468 1 3 '3D BEST-TROSY HNCO' . . . 17468 1 4 '3D BEST-TROSY HNcoCA' . . . 17468 1 5 '3D BEST-TROSY iHNCA' . . . 17468 1 6 '3D BEST-TROSY HNcoCACB' . . . 17468 1 7 '3D BEST-TROSY iHNCACB' . . . 17468 1 8 '3D BEST-TROSY hNcocaNH' . . . 17468 1 9 '3D BEST-TROSY hnCOcaNH' . . . 17468 1 stop_ loop_ _Systematic_chem_shift_offset.Type _Systematic_chem_shift_offset.Atom_type _Systematic_chem_shift_offset.Atom_isotope_number _Systematic_chem_shift_offset.Val _Systematic_chem_shift_offset.Val_err _Systematic_chem_shift_offset.Entry_ID _Systematic_chem_shift_offset.Assigned_chem_shift_list_ID 'TROSY offset' 'amide protons' 1 +0.057 . 17468 1 'TROSY offset' 'amide nitrogens' 15 -0.575 . 17468 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 2 2 PRO C C 13 177.12 0.15 . 1 . . . . 2 PRO C . 17468 1 2 . 1 1 2 2 PRO CA C 13 62.99 0.15 . 1 . . . . 2 PRO CA . 17468 1 3 . 1 1 2 2 PRO CB C 13 32.40 0.15 . 1 . . . . 2 PRO CB . 17468 1 4 . 1 1 3 3 LEU H H 1 8.68 0.02 . 1 . . . . 3 LEU HN . 17468 1 5 . 1 1 3 3 LEU C C 13 178.09 0.15 . 1 . . . . 3 LEU C . 17468 1 6 . 1 1 3 3 LEU CA C 13 55.45 0.15 . 1 . . . . 3 LEU CA . 17468 1 7 . 1 1 3 3 LEU CB C 13 42.35 0.15 . 1 . . . . 3 LEU CB . 17468 1 8 . 1 1 3 3 LEU N N 15 122.75 0.15 . 1 . . . . 3 LEU N . 17468 1 9 . 1 1 4 4 GLY H H 1 8.53 0.02 . 1 . . . . 4 GLY HN . 17468 1 10 . 1 1 4 4 GLY C C 13 174.19 0.15 . 1 . . . . 4 GLY C . 17468 1 11 . 1 1 4 4 GLY CA C 13 45.34 0.15 . 1 . . . . 4 GLY CA . 17468 1 12 . 1 1 4 4 GLY N N 15 110.23 0.15 . 1 . . . . 4 GLY N . 17468 1 13 . 1 1 5 5 SER H H 1 8.28 0.02 . 1 . . . . 5 SER HN . 17468 1 14 . 1 1 5 5 SER C C 13 174.72 0.15 . 1 . . . . 5 SER C . 17468 1 15 . 1 1 5 5 SER CA C 13 58.32 0.15 . 1 . . . . 5 SER CA . 17468 1 16 . 1 1 5 5 SER CB C 13 64.07 0.15 . 1 . . . . 5 SER CB . 17468 1 17 . 1 1 5 5 SER N N 15 115.74 0.15 . 1 . . . . 5 SER N . 17468 1 18 . 1 1 6 6 LEU H H 1 8.45 0.02 . 1 . . . . 6 LEU HN . 17468 1 19 . 1 1 6 6 LEU C C 13 177.59 0.15 . 1 . . . . 6 LEU C . 17468 1 20 . 1 1 6 6 LEU CA C 13 55.31 0.15 . 1 . . . . 6 LEU CA . 17468 1 21 . 1 1 6 6 LEU CB C 13 42.30 0.15 . 1 . . . . 6 LEU CB . 17468 1 22 . 1 1 6 6 LEU N N 15 124.25 0.15 . 1 . . . . 6 LEU N . 17468 1 23 . 1 1 7 7 ARG H H 1 8.52 0.02 . 1 . . . . 7 ARG HN . 17468 1 24 . 1 1 7 7 ARG C C 13 176.91 0.15 . 1 . . . . 7 ARG C . 17468 1 25 . 1 1 7 7 ARG CA C 13 56.19 0.15 . 1 . . . . 7 ARG CA . 17468 1 26 . 1 1 7 7 ARG CB C 13 30.74 0.15 . 1 . . . . 7 ARG CB . 17468 1 27 . 1 1 7 7 ARG N N 15 121.97 0.15 . 1 . . . . 7 ARG N . 17468 1 28 . 1 1 8 8 GLY H H 1 8.55 0.02 . 1 . . . . 8 GLY HN . 17468 1 29 . 1 1 8 8 GLY C C 13 174.59 0.15 . 1 . . . . 8 GLY C . 17468 1 30 . 1 1 8 8 GLY CA C 13 45.37 0.15 . 1 . . . . 8 GLY CA . 17468 1 31 . 1 1 8 8 GLY N N 15 110.58 0.15 . 1 . . . . 8 GLY N . 17468 1 32 . 1 1 9 9 GLY H H 1 8.37 0.02 . 1 . . . . 9 GLY HN . 17468 1 33 . 1 1 9 9 GLY C C 13 173.91 0.15 . 1 . . . . 9 GLY C . 17468 1 34 . 1 1 9 9 GLY CA C 13 44.84 0.15 . 1 . . . . 9 GLY CA . 17468 1 35 . 1 1 9 9 GLY N N 15 108.91 0.15 . 1 . . . . 9 GLY N . 17468 1 36 . 1 1 10 10 GLU H H 1 8.34 0.02 . 1 . . . . 191 GLU HN . 17468 1 37 . 1 1 10 10 GLU CA C 13 54.41 0.15 . 1 . . . . 191 GLU CA . 17468 1 38 . 1 1 10 10 GLU CB C 13 29.64 0.15 . 1 . . . . 191 GLU CB . 17468 1 39 . 1 1 10 10 GLU N N 15 121.77 0.15 . 1 . . . . 191 GLU N . 17468 1 40 . 1 1 11 11 PRO C C 13 176.68 0.15 . 1 . . . . 192 PRO C . 17468 1 41 . 1 1 11 11 PRO CA C 13 62.77 0.15 . 1 . . . . 192 PRO CA . 17468 1 42 . 1 1 11 11 PRO CB C 13 32.14 0.15 . 1 . . . . 192 PRO CB . 17468 1 43 . 1 1 12 12 GLU H H 1 8.64 0.02 . 1 . . . . 193 GLU HN . 17468 1 44 . 1 1 12 12 GLU CA C 13 54.34 0.15 . 1 . . . . 193 GLU CA . 17468 1 45 . 1 1 12 12 GLU CB C 13 29.80 0.15 . 1 . . . . 193 GLU CB . 17468 1 46 . 1 1 12 12 GLU N N 15 123.00 0.15 . 1 . . . . 193 GLU N . 17468 1 47 . 1 1 13 13 PRO C C 13 176.38 0.15 . 1 . . . . 194 PRO C . 17468 1 48 . 1 1 13 13 PRO CA C 13 63.02 0.15 . 1 . . . . 194 PRO CA . 17468 1 49 . 1 1 13 13 PRO CB C 13 32.22 0.15 . 1 . . . . 194 PRO CB . 17468 1 50 . 1 1 14 14 ASP H H 1 8.55 0.02 . 1 . . . . 195 ASP HN . 17468 1 51 . 1 1 14 14 ASP C C 13 176.62 0.15 . 1 . . . . 195 ASP C . 17468 1 52 . 1 1 14 14 ASP CA C 13 54.14 0.15 . 1 . . . . 195 ASP CA . 17468 1 53 . 1 1 14 14 ASP CB C 13 41.18 0.15 . 1 . . . . 195 ASP CB . 17468 1 54 . 1 1 14 14 ASP N N 15 121.11 0.15 . 1 . . . . 195 ASP N . 17468 1 55 . 1 1 15 15 VAL H H 1 8.29 0.02 . 1 . . . . 196 VAL HN . 17468 1 56 . 1 1 15 15 VAL C C 13 176.57 0.15 . 1 . . . . 196 VAL C . 17468 1 57 . 1 1 15 15 VAL CA C 13 62.42 0.15 . 1 . . . . 196 VAL CA . 17468 1 58 . 1 1 15 15 VAL CB C 13 32.61 0.15 . 1 . . . . 196 VAL CB . 17468 1 59 . 1 1 15 15 VAL N N 15 120.91 0.15 . 1 . . . . 196 VAL N . 17468 1 60 . 1 1 16 16 THR H H 1 8.44 0.02 . 1 . . . . 197 THR HN . 17468 1 61 . 1 1 16 16 THR C C 13 174.76 0.15 . 1 . . . . 197 THR C . 17468 1 62 . 1 1 16 16 THR CA C 13 62.77 0.15 . 1 . . . . 197 THR CA . 17468 1 63 . 1 1 16 16 THR CB C 13 69.79 0.15 . 1 . . . . 197 THR CB . 17468 1 64 . 1 1 16 16 THR N N 15 118.77 0.15 . 1 . . . . 197 THR N . 17468 1 65 . 1 1 17 17 VAL H H 1 8.17 0.02 . 1 . . . . 198 VAL HN . 17468 1 66 . 1 1 17 17 VAL C C 13 176.30 0.15 . 1 . . . . 198 VAL C . 17468 1 67 . 1 1 17 17 VAL CA C 13 62.63 0.15 . 1 . . . . 198 VAL CA . 17468 1 68 . 1 1 17 17 VAL CB C 13 32.69 0.15 . 1 . . . . 198 VAL CB . 17468 1 69 . 1 1 17 17 VAL N N 15 123.63 0.15 . 1 . . . . 198 VAL N . 17468 1 70 . 1 1 18 18 LEU H H 1 8.38 0.02 . 1 . . . . 199 LEU HN . 17468 1 71 . 1 1 18 18 LEU C C 13 177.87 0.15 . 1 . . . . 199 LEU C . 17468 1 72 . 1 1 18 18 LEU CA C 13 55.37 0.15 . 1 . . . . 199 LEU CA . 17468 1 73 . 1 1 18 18 LEU CB C 13 42.34 0.15 . 1 . . . . 199 LEU CB . 17468 1 74 . 1 1 18 18 LEU N N 15 125.88 0.15 . 1 . . . . 199 LEU N . 17468 1 75 . 1 1 19 19 THR H H 1 8.19 0.02 . 1 . . . . 200 THR HN . 17468 1 76 . 1 1 19 19 THR C C 13 174.87 0.15 . 1 . . . . 200 THR C . 17468 1 77 . 1 1 19 19 THR CA C 13 62.39 0.15 . 1 . . . . 200 THR CA . 17468 1 78 . 1 1 19 19 THR CB C 13 69.77 0.15 . 1 . . . . 200 THR CB . 17468 1 79 . 1 1 19 19 THR N N 15 114.92 0.15 . 1 . . . . 200 THR N . 17468 1 80 . 1 1 20 20 SER H H 1 8.31 0.02 . 1 . . . . 201 SER HN . 17468 1 81 . 1 1 20 20 SER C C 13 174.67 0.15 . 1 . . . . 201 SER C . 17468 1 82 . 1 1 20 20 SER CA C 13 58.66 0.15 . 1 . . . . 201 SER CA . 17468 1 83 . 1 1 20 20 SER CB C 13 63.75 0.15 . 1 . . . . 201 SER CB . 17468 1 84 . 1 1 20 20 SER N N 15 117.83 0.15 . 1 . . . . 201 SER N . 17468 1 85 . 1 1 21 21 MET H H 1 8.37 0.02 . 1 . . . . 202 MET HN . 17468 1 86 . 1 1 21 21 MET C C 13 176.35 0.15 . 1 . . . . 202 MET C . 17468 1 87 . 1 1 21 21 MET CA C 13 55.79 0.15 . 1 . . . . 202 MET CA . 17468 1 88 . 1 1 21 21 MET CB C 13 32.81 0.15 . 1 . . . . 202 MET CB . 17468 1 89 . 1 1 21 21 MET N N 15 122.08 0.15 . 1 . . . . 202 MET N . 17468 1 90 . 1 1 22 22 LEU H H 1 8.19 0.02 . 1 . . . . 203 LEU HN . 17468 1 91 . 1 1 22 22 LEU C C 13 177.52 0.15 . 1 . . . . 203 LEU C . 17468 1 92 . 1 1 22 22 LEU CA C 13 55.41 0.15 . 1 . . . . 203 LEU CA . 17468 1 93 . 1 1 22 22 LEU CB C 13 42.31 0.15 . 1 . . . . 203 LEU CB . 17468 1 94 . 1 1 22 22 LEU N N 15 122.20 0.15 . 1 . . . . 203 LEU N . 17468 1 95 . 1 1 23 23 THR H H 1 8.03 0.02 . 1 . . . . 204 THR HN . 17468 1 96 . 1 1 23 23 THR C C 13 173.88 0.15 . 1 . . . . 204 THR C . 17468 1 97 . 1 1 23 23 THR CA C 13 61.59 0.15 . 1 . . . . 204 THR CA . 17468 1 98 . 1 1 23 23 THR CB C 13 69.94 0.15 . 1 . . . . 204 THR CB . 17468 1 99 . 1 1 23 23 THR N N 15 113.62 0.15 . 1 . . . . 204 THR N . 17468 1 100 . 1 1 24 24 ASP H H 1 8.32 0.02 . 1 . . . . 205 ASP HN . 17468 1 101 . 1 1 24 24 ASP CA C 13 52.05 0.15 . 1 . . . . 205 ASP CA . 17468 1 102 . 1 1 24 24 ASP CB C 13 41.50 0.15 . 1 . . . . 205 ASP CB . 17468 1 103 . 1 1 24 24 ASP N N 15 124.33 0.15 . 1 . . . . 205 ASP N . 17468 1 104 . 1 1 25 25 PRO C C 13 177.55 0.15 . 1 . . . . 206 PRO C . 17468 1 105 . 1 1 25 25 PRO CA C 13 64.05 0.15 . 1 . . . . 206 PRO CA . 17468 1 106 . 1 1 25 25 PRO CB C 13 32.13 0.15 . 1 . . . . 206 PRO CB . 17468 1 107 . 1 1 26 26 SER H H 1 8.53 0.02 . 1 . . . . 207 SER HN . 17468 1 108 . 1 1 26 26 SER C C 13 174.99 0.15 . 1 . . . . 207 SER C . 17468 1 109 . 1 1 26 26 SER CA C 13 59.57 0.15 . 1 . . . . 207 SER CA . 17468 1 110 . 1 1 26 26 SER CB C 13 63.53 0.15 . 1 . . . . 207 SER CB . 17468 1 111 . 1 1 26 26 SER N N 15 114.81 0.15 . 1 . . . . 207 SER N . 17468 1 112 . 1 1 27 27 HIS H H 1 8.15 0.02 . 1 . . . . 208 HIS HN . 17468 1 113 . 1 1 27 27 HIS C C 13 175.06 0.15 . 1 . . . . 208 HIS C . 17468 1 114 . 1 1 27 27 HIS CA C 13 56.46 0.15 . 1 . . . . 208 HIS CA . 17468 1 115 . 1 1 27 27 HIS CB C 13 29.76 0.15 . 1 . . . . 208 HIS CB . 17468 1 116 . 1 1 27 27 HIS N N 15 121.13 0.15 . 1 . . . . 208 HIS N . 17468 1 117 . 1 1 28 28 ILE H H 1 8.05 0.02 . 1 . . . . 209 ILE HN . 17468 1 118 . 1 1 28 28 ILE C C 13 176.98 0.15 . 1 . . . . 209 ILE C . 17468 1 119 . 1 1 28 28 ILE CA C 13 61.79 0.15 . 1 . . . . 209 ILE CA . 17468 1 120 . 1 1 28 28 ILE CB C 13 38.64 0.15 . 1 . . . . 209 ILE CB . 17468 1 121 . 1 1 28 28 ILE N N 15 122.33 0.15 . 1 . . . . 209 ILE N . 17468 1 122 . 1 1 29 29 THR H H 1 8.36 0.02 . 1 . . . . 210 THR HN . 17468 1 123 . 1 1 29 29 THR C C 13 175.06 0.15 . 1 . . . . 210 THR C . 17468 1 124 . 1 1 29 29 THR CA C 13 62.65 0.15 . 1 . . . . 210 THR CA . 17468 1 125 . 1 1 29 29 THR CB C 13 69.98 0.15 . 1 . . . . 210 THR CB . 17468 1 126 . 1 1 29 29 THR N N 15 118.66 0.15 . 1 . . . . 210 THR N . 17468 1 127 . 1 1 30 30 ALA H H 1 8.48 0.02 . 1 . . . . 211 ALA HN . 17468 1 128 . 1 1 30 30 ALA C C 13 179.16 0.15 . 1 . . . . 211 ALA C . 17468 1 129 . 1 1 30 30 ALA CA C 13 53.81 0.15 . 1 . . . . 211 ALA CA . 17468 1 130 . 1 1 30 30 ALA CB C 13 19.05 0.15 . 1 . . . . 211 ALA CB . 17468 1 131 . 1 1 30 30 ALA N N 15 125.80 0.15 . 1 . . . . 211 ALA N . 17468 1 132 . 1 1 31 31 GLU H H 1 8.46 0.02 . 1 . . . . 212 GLU HN . 17468 1 133 . 1 1 31 31 GLU C C 13 178.00 0.15 . 1 . . . . 212 GLU C . 17468 1 134 . 1 1 31 31 GLU CA C 13 57.97 0.15 . 1 . . . . 212 GLU CA . 17468 1 135 . 1 1 31 31 GLU CB C 13 29.93 0.15 . 1 . . . . 212 GLU CB . 17468 1 136 . 1 1 31 31 GLU N N 15 119.63 0.15 . 1 . . . . 212 GLU N . 17468 1 137 . 1 1 32 32 THR H H 1 8.17 0.02 . 1 . . . . 213 THR HN . 17468 1 138 . 1 1 32 32 THR C C 13 175.53 0.15 . 1 . . . . 213 THR C . 17468 1 139 . 1 1 32 32 THR CA C 13 64.14 0.15 . 1 . . . . 213 THR CA . 17468 1 140 . 1 1 32 32 THR CB C 13 69.29 0.15 . 1 . . . . 213 THR CB . 17468 1 141 . 1 1 32 32 THR N N 15 116.36 0.15 . 1 . . . . 213 THR N . 17468 1 142 . 1 1 33 33 ALA H H 1 8.24 0.02 . 1 . . . . 214 ALA HN . 17468 1 143 . 1 1 33 33 ALA C C 13 179.03 0.15 . 1 . . . . 214 ALA C . 17468 1 144 . 1 1 33 33 ALA CA C 13 54.09 0.15 . 1 . . . . 214 ALA CA . 17468 1 145 . 1 1 33 33 ALA CB C 13 18.85 0.15 . 1 . . . . 214 ALA CB . 17468 1 146 . 1 1 33 33 ALA N N 15 125.08 0.15 . 1 . . . . 214 ALA N . 17468 1 147 . 1 1 34 34 LYS H H 1 8.08 0.02 . 1 . . . . 215 LYS HN . 17468 1 148 . 1 1 34 34 LYS C C 13 178.03 0.15 . 1 . . . . 215 LYS C . 17468 1 149 . 1 1 34 34 LYS CA C 13 57.92 0.15 . 1 . . . . 215 LYS CA . 17468 1 150 . 1 1 34 34 LYS CB C 13 32.99 0.15 . 1 . . . . 215 LYS CB . 17468 1 151 . 1 1 34 34 LYS N N 15 119.23 0.15 . 1 . . . . 215 LYS N . 17468 1 152 . 1 1 35 35 ARG H H 1 8.10 0.02 . 1 . . . . 216 ARG HN . 17468 1 153 . 1 1 35 35 ARG C C 13 177.43 0.15 . 1 . . . . 216 ARG C . 17468 1 154 . 1 1 35 35 ARG CA C 13 57.46 0.15 . 1 . . . . 216 ARG CA . 17468 1 155 . 1 1 35 35 ARG CB C 13 30.65 0.15 . 1 . . . . 216 ARG CB . 17468 1 156 . 1 1 35 35 ARG N N 15 120.94 0.15 . 1 . . . . 216 ARG N . 17468 1 157 . 1 1 36 36 ARG H H 1 8.22 0.02 . 1 . . . . 217 ARG HN . 17468 1 158 . 1 1 36 36 ARG C C 13 177.34 0.15 . 1 . . . . 217 ARG C . 17468 1 159 . 1 1 36 36 ARG CA C 13 57.39 0.15 . 1 . . . . 217 ARG CA . 17468 1 160 . 1 1 36 36 ARG CB C 13 30.59 0.15 . 1 . . . . 217 ARG CB . 17468 1 161 . 1 1 36 36 ARG N N 15 121.05 0.15 . 1 . . . . 217 ARG N . 17468 1 162 . 1 1 37 37 LEU H H 1 8.12 0.02 . 1 . . . . 218 LEU HN . 17468 1 163 . 1 1 37 37 LEU C C 13 177.74 0.15 . 1 . . . . 218 LEU C . 17468 1 164 . 1 1 37 37 LEU CA C 13 55.67 0.15 . 1 . . . . 218 LEU CA . 17468 1 165 . 1 1 37 37 LEU CB C 13 42.38 0.15 . 1 . . . . 218 LEU CB . 17468 1 166 . 1 1 37 37 LEU N N 15 122.19 0.15 . 1 . . . . 218 LEU N . 17468 1 167 . 1 1 38 38 ALA H H 1 8.10 0.02 . 1 . . . . 219 ALA HN . 17468 1 168 . 1 1 38 38 ALA C C 13 178.03 0.15 . 1 . . . . 219 ALA C . 17468 1 169 . 1 1 38 38 ALA CA C 13 52.83 0.15 . 1 . . . . 219 ALA CA . 17468 1 170 . 1 1 38 38 ALA CB C 13 19.14 0.15 . 1 . . . . 219 ALA CB . 17468 1 171 . 1 1 38 38 ALA N N 15 123.77 0.15 . 1 . . . . 219 ALA N . 17468 1 172 . 1 1 39 39 ARG H H 1 8.20 0.02 . 1 . . . . 220 ARG HN . 17468 1 173 . 1 1 39 39 ARG C C 13 177.02 0.15 . 1 . . . . 220 ARG C . 17468 1 174 . 1 1 39 39 ARG CA C 13 56.54 0.15 . 1 . . . . 220 ARG CA . 17468 1 175 . 1 1 39 39 ARG CB C 13 30.88 0.15 . 1 . . . . 220 ARG CB . 17468 1 176 . 1 1 39 39 ARG N N 15 119.77 0.15 . 1 . . . . 220 ARG N . 17468 1 177 . 1 1 40 40 GLY H H 1 8.35 0.02 . 1 . . . . 221 GLY HN . 17468 1 178 . 1 1 40 40 GLY C C 13 173.76 0.15 . 1 . . . . 221 GLY C . 17468 1 179 . 1 1 40 40 GLY CA C 13 45.00 0.15 . 1 . . . . 221 GLY CA . 17468 1 180 . 1 1 40 40 GLY N N 15 109.55 0.15 . 1 . . . . 221 GLY N . 17468 1 181 . 1 1 41 41 SER H H 1 8.29 0.02 . 1 . . . . 222 SER HN . 17468 1 182 . 1 1 41 41 SER CA C 13 56.67 0.15 . 1 . . . . 222 SER CA . 17468 1 183 . 1 1 41 41 SER CB C 13 63.27 0.15 . 1 . . . . 222 SER CB . 17468 1 184 . 1 1 41 41 SER N N 15 117.20 0.15 . 1 . . . . 222 SER N . 17468 1 185 . 1 1 43 43 PRO C C 13 176.86 0.15 . 1 . . . . 224 PRO C . 17468 1 186 . 1 1 43 43 PRO CA C 13 63.04 0.15 . 1 . . . . 224 PRO CA . 17468 1 187 . 1 1 43 43 PRO CB C 13 32.08 0.15 . 1 . . . . 224 PRO CB . 17468 1 188 . 1 1 44 44 SER H H 1 8.50 0.02 . 1 . . . . 225 SER HN . 17468 1 189 . 1 1 44 44 SER C C 13 174.74 0.15 . 1 . . . . 225 SER C . 17468 1 190 . 1 1 44 44 SER CA C 13 58.09 0.15 . 1 . . . . 225 SER CA . 17468 1 191 . 1 1 44 44 SER CB C 13 63.90 0.15 . 1 . . . . 225 SER CB . 17468 1 192 . 1 1 44 44 SER N N 15 116.20 0.15 . 1 . . . . 225 SER N . 17468 1 193 . 1 1 45 45 LEU H H 1 8.46 0.02 . 1 . . . . 226 LEU HN . 17468 1 194 . 1 1 45 45 LEU C C 13 177.44 0.15 . 1 . . . . 226 LEU C . 17468 1 195 . 1 1 45 45 LEU CA C 13 55.16 0.15 . 1 . . . . 226 LEU CA . 17468 1 196 . 1 1 45 45 LEU CB C 13 42.44 0.15 . 1 . . . . 226 LEU CB . 17468 1 197 . 1 1 45 45 LEU N N 15 124.86 0.15 . 1 . . . . 226 LEU N . 17468 1 198 . 1 1 46 46 ALA H H 1 8.39 0.02 . 1 . . . . 227 ALA HN . 17468 1 199 . 1 1 46 46 ALA C C 13 178.03 0.15 . 1 . . . . 227 ALA C . 17468 1 200 . 1 1 46 46 ALA CA C 13 52.76 0.15 . 1 . . . . 227 ALA CA . 17468 1 201 . 1 1 46 46 ALA CB C 13 19.40 0.15 . 1 . . . . 227 ALA CB . 17468 1 202 . 1 1 46 46 ALA N N 15 124.97 0.15 . 1 . . . . 227 ALA N . 17468 1 203 . 1 1 47 47 SER H H 1 8.35 0.02 . 1 . . . . 228 SER HN . 17468 1 204 . 1 1 47 47 SER C C 13 174.94 0.15 . 1 . . . . 228 SER C . 17468 1 205 . 1 1 47 47 SER CA C 13 58.41 0.15 . 1 . . . . 228 SER CA . 17468 1 206 . 1 1 47 47 SER CB C 13 63.85 0.15 . 1 . . . . 228 SER CB . 17468 1 207 . 1 1 47 47 SER N N 15 115.13 0.15 . 1 . . . . 228 SER N . 17468 1 208 . 1 1 48 48 SER H H 1 8.45 0.02 . 1 . . . . 229 SER HN . 17468 1 209 . 1 1 48 48 SER C C 13 174.84 0.15 . 1 . . . . 229 SER C . 17468 1 210 . 1 1 48 48 SER CA C 13 58.52 0.15 . 1 . . . . 229 SER CA . 17468 1 211 . 1 1 48 48 SER CB C 13 63.93 0.15 . 1 . . . . 229 SER CB . 17468 1 212 . 1 1 48 48 SER N N 15 118.16 0.15 . 1 . . . . 229 SER N . 17468 1 213 . 1 1 49 49 SER H H 1 8.44 0.02 . 1 . . . . 230 SER HN . 17468 1 214 . 1 1 49 49 SER C C 13 174.64 0.15 . 1 . . . . 230 SER C . 17468 1 215 . 1 1 49 49 SER CA C 13 58.65 0.15 . 1 . . . . 230 SER CA . 17468 1 216 . 1 1 49 49 SER CB C 13 63.87 0.15 . 1 . . . . 230 SER CB . 17468 1 217 . 1 1 49 49 SER N N 15 118.08 0.15 . 1 . . . . 230 SER N . 17468 1 218 . 1 1 50 50 ALA H H 1 8.36 0.02 . 1 . . . . 231 ALA HN . 17468 1 219 . 1 1 50 50 ALA C C 13 178.22 0.15 . 1 . . . . 231 ALA C . 17468 1 220 . 1 1 50 50 ALA CA C 13 53.02 0.15 . 1 . . . . 231 ALA CA . 17468 1 221 . 1 1 50 50 ALA CB C 13 19.33 0.15 . 1 . . . . 231 ALA CB . 17468 1 222 . 1 1 50 50 ALA N N 15 125.83 0.15 . 1 . . . . 231 ALA N . 17468 1 223 . 1 1 51 51 SER H H 1 8.30 0.02 . 1 . . . . 232 SER HN . 17468 1 224 . 1 1 51 51 SER C C 13 174.80 0.15 . 1 . . . . 232 SER C . 17468 1 225 . 1 1 51 51 SER CA C 13 58.74 0.15 . 1 . . . . 232 SER CA . 17468 1 226 . 1 1 51 51 SER CB C 13 63.72 0.15 . 1 . . . . 232 SER CB . 17468 1 227 . 1 1 51 51 SER N N 15 114.81 0.15 . 1 . . . . 232 SER N . 17468 1 228 . 1 1 52 52 GLN H H 1 8.36 0.02 . 1 . . . . 233 GLN HN . 17468 1 229 . 1 1 52 52 GLN C C 13 176.05 0.15 . 1 . . . . 233 GLN C . 17468 1 230 . 1 1 52 52 GLN CA C 13 55.89 0.15 . 1 . . . . 233 GLN CA . 17468 1 231 . 1 1 52 52 GLN CB C 13 29.48 0.15 . 1 . . . . 233 GLN CB . 17468 1 232 . 1 1 52 52 GLN N N 15 122.16 0.15 . 1 . . . . 233 GLN N . 17468 1 233 . 1 1 53 53 LEU H H 1 8.26 0.02 . 1 . . . . 234 LEU HN . 17468 1 234 . 1 1 53 53 LEU C C 13 177.45 0.15 . 1 . . . . 234 LEU C . 17468 1 235 . 1 1 53 53 LEU CA C 13 55.26 0.15 . 1 . . . . 234 LEU CA . 17468 1 236 . 1 1 53 53 LEU CB C 13 42.46 0.15 . 1 . . . . 234 LEU CB . 17468 1 237 . 1 1 53 53 LEU N N 15 122.88 0.15 . 1 . . . . 234 LEU N . 17468 1 238 . 1 1 54 54 SER H H 1 8.28 0.02 . 1 . . . . 235 SER HN . 17468 1 239 . 1 1 54 54 SER C C 13 173.67 0.15 . 1 . . . . 235 SER C . 17468 1 240 . 1 1 54 54 SER CA C 13 58.05 0.15 . 1 . . . . 235 SER CA . 17468 1 241 . 1 1 54 54 SER CB C 13 64.02 0.15 . 1 . . . . 235 SER CB . 17468 1 242 . 1 1 54 54 SER N N 15 116.61 0.15 . 1 . . . . 235 SER N . 17468 1 243 . 1 1 55 55 ALA H H 1 8.34 0.02 . 1 . . . . 236 ALA HN . 17468 1 244 . 1 1 55 55 ALA CA C 13 50.76 0.15 . 1 . . . . 236 ALA CA . 17468 1 245 . 1 1 55 55 ALA CB C 13 18.49 0.15 . 1 . . . . 236 ALA CB . 17468 1 246 . 1 1 55 55 ALA N N 15 127.19 0.15 . 1 . . . . 236 ALA N . 17468 1 247 . 1 1 56 56 PRO C C 13 176.99 0.15 . 1 . . . . 237 PRO C . 17468 1 248 . 1 1 56 56 PRO CA C 13 63.17 0.15 . 1 . . . . 237 PRO CA . 17468 1 249 . 1 1 56 56 PRO CB C 13 32.09 0.15 . 1 . . . . 237 PRO CB . 17468 1 250 . 1 1 57 57 SER H H 1 8.48 0.02 . 1 . . . . 238 SER HN . 17468 1 251 . 1 1 57 57 SER C C 13 174.73 0.15 . 1 . . . . 238 SER C . 17468 1 252 . 1 1 57 57 SER CA C 13 58.21 0.15 . 1 . . . . 238 SER CA . 17468 1 253 . 1 1 57 57 SER CB C 13 63.79 0.15 . 1 . . . . 238 SER CB . 17468 1 254 . 1 1 57 57 SER N N 15 116.16 0.15 . 1 . . . . 238 SER N . 17468 1 255 . 1 1 58 58 LEU H H 1 8.42 0.02 . 1 . . . . 239 LEU HN . 17468 1 256 . 1 1 58 58 LEU C C 13 177.38 0.15 . 1 . . . . 239 LEU C . 17468 1 257 . 1 1 58 58 LEU CA C 13 55.18 0.15 . 1 . . . . 239 LEU CA . 17468 1 258 . 1 1 58 58 LEU CB C 13 42.39 0.15 . 1 . . . . 239 LEU CB . 17468 1 259 . 1 1 58 58 LEU N N 15 124.86 0.15 . 1 . . . . 239 LEU N . 17468 1 260 . 1 1 59 59 LYS H H 1 8.32 0.02 . 1 . . . . 240 LYS HN . 17468 1 261 . 1 1 59 59 LYS C C 13 176.32 0.15 . 1 . . . . 240 LYS C . 17468 1 262 . 1 1 59 59 LYS CA C 13 56.19 0.15 . 1 . . . . 240 LYS CA . 17468 1 263 . 1 1 59 59 LYS CB C 13 33.17 0.15 . 1 . . . . 240 LYS CB . 17468 1 264 . 1 1 59 59 LYS N N 15 122.52 0.15 . 1 . . . . 240 LYS N . 17468 1 265 . 1 1 60 60 ALA H H 1 8.43 0.02 . 1 . . . . 241 ALA HN . 17468 1 266 . 1 1 60 60 ALA C C 13 177.98 0.15 . 1 . . . . 241 ALA C . 17468 1 267 . 1 1 60 60 ALA CA C 13 52.53 0.15 . 1 . . . . 241 ALA CA . 17468 1 268 . 1 1 60 60 ALA CB C 13 19.63 0.15 . 1 . . . . 241 ALA CB . 17468 1 269 . 1 1 60 60 ALA N N 15 125.80 0.15 . 1 . . . . 241 ALA N . 17468 1 270 . 1 1 61 61 THR H H 1 8.30 0.02 . 1 . . . . 242 THR HN . 17468 1 271 . 1 1 61 61 THR C C 13 174.44 0.15 . 1 . . . . 242 THR C . 17468 1 272 . 1 1 61 61 THR CA C 13 61.88 0.15 . 1 . . . . 242 THR CA . 17468 1 273 . 1 1 61 61 THR CB C 13 70.02 0.15 . 1 . . . . 242 THR CB . 17468 1 274 . 1 1 61 61 THR N N 15 114.00 0.15 . 1 . . . . 242 THR N . 17468 1 275 . 1 1 62 62 CYS H H 1 8.51 0.02 . 1 . . . . 243 CYS HN . 17468 1 276 . 1 1 62 62 CYS C C 13 174.79 0.15 . 1 . . . . 243 CYS C . 17468 1 277 . 1 1 62 62 CYS CA C 13 58.37 0.15 . 1 . . . . 243 CYS CA . 17468 1 278 . 1 1 62 62 CYS CB C 13 28.30 0.15 . 1 . . . . 243 CYS CB . 17468 1 279 . 1 1 62 62 CYS N N 15 122.11 0.15 . 1 . . . . 243 CYS N . 17468 1 280 . 1 1 63 63 THR H H 1 8.51 0.02 . 1 . . . . 244 THR HN . 17468 1 281 . 1 1 63 63 THR C C 13 174.55 0.15 . 1 . . . . 244 THR C . 17468 1 282 . 1 1 63 63 THR CA C 13 61.88 0.15 . 1 . . . . 244 THR CA . 17468 1 283 . 1 1 63 63 THR CB C 13 69.83 0.15 . 1 . . . . 244 THR CB . 17468 1 284 . 1 1 63 63 THR N N 15 117.48 0.15 . 1 . . . . 244 THR N . 17468 1 285 . 1 1 64 64 THR H H 1 8.22 0.02 . 1 . . . . 245 THR HN . 17468 1 286 . 1 1 64 64 THR C C 13 174.02 0.15 . 1 . . . . 245 THR C . 17468 1 287 . 1 1 64 64 THR CA C 13 61.75 0.15 . 1 . . . . 245 THR CA . 17468 1 288 . 1 1 64 64 THR CB C 13 69.98 0.15 . 1 . . . . 245 THR CB . 17468 1 289 . 1 1 64 64 THR N N 15 116.66 0.15 . 1 . . . . 245 THR N . 17468 1 290 . 1 1 65 65 HIS H H 1 8.55 0.02 . 1 . . . . 246 HIS HN . 17468 1 291 . 1 1 65 65 HIS C C 13 174.46 0.15 . 1 . . . . 246 HIS C . 17468 1 292 . 1 1 65 65 HIS CA C 13 55.82 0.15 . 1 . . . . 246 HIS CA . 17468 1 293 . 1 1 65 65 HIS CB C 13 30.08 0.15 . 1 . . . . 246 HIS CB . 17468 1 294 . 1 1 65 65 HIS N N 15 121.72 0.15 . 1 . . . . 246 HIS N . 17468 1 295 . 1 1 66 66 HIS H H 1 8.57 0.02 . 1 . . . . 247 HIS HN . 17468 1 296 . 1 1 66 66 HIS C C 13 174.25 0.15 . 1 . . . . 247 HIS C . 17468 1 297 . 1 1 66 66 HIS CA C 13 55.63 0.15 . 1 . . . . 247 HIS CA . 17468 1 298 . 1 1 66 66 HIS CB C 13 30.08 0.15 . 1 . . . . 247 HIS CB . 17468 1 299 . 1 1 66 66 HIS N N 15 121.41 0.15 . 1 . . . . 247 HIS N . 17468 1 300 . 1 1 67 67 ASP H H 1 8.63 0.02 . 1 . . . . 248 ASP HN . 17468 1 301 . 1 1 67 67 ASP C C 13 175.80 0.15 . 1 . . . . 248 ASP C . 17468 1 302 . 1 1 67 67 ASP CA C 13 54.38 0.15 . 1 . . . . 248 ASP CA . 17468 1 303 . 1 1 67 67 ASP CB C 13 41.33 0.15 . 1 . . . . 248 ASP CB . 17468 1 304 . 1 1 67 67 ASP N N 15 121.89 0.15 . 1 . . . . 248 ASP N . 17468 1 305 . 1 1 68 68 SER H H 1 8.38 0.02 . 1 . . . . 249 SER HN . 17468 1 306 . 1 1 68 68 SER CA C 13 56.27 0.15 . 1 . . . . 249 SER CA . 17468 1 307 . 1 1 68 68 SER CB C 13 63.54 0.15 . 1 . . . . 249 SER CB . 17468 1 308 . 1 1 68 68 SER N N 15 116.97 0.15 . 1 . . . . 249 SER N . 17468 1 309 . 1 1 69 69 PRO C C 13 176.81 0.15 . 1 . . . . 250 PRO C . 17468 1 310 . 1 1 69 69 PRO CA C 13 63.49 0.15 . 1 . . . . 250 PRO CA . 17468 1 311 . 1 1 69 69 PRO CB C 13 32.02 0.15 . 1 . . . . 250 PRO CB . 17468 1 312 . 1 1 70 70 ASP H H 1 8.38 0.02 . 1 . . . . 251 ASP HN . 17468 1 313 . 1 1 70 70 ASP C C 13 176.45 0.15 . 1 . . . . 251 ASP C . 17468 1 314 . 1 1 70 70 ASP CA C 13 54.58 0.15 . 1 . . . . 251 ASP CA . 17468 1 315 . 1 1 70 70 ASP CB C 13 41.03 0.15 . 1 . . . . 251 ASP CB . 17468 1 316 . 1 1 70 70 ASP N N 15 120.09 0.15 . 1 . . . . 251 ASP N . 17468 1 317 . 1 1 71 71 ALA H H 1 8.24 0.02 . 1 . . . . 252 ALA HN . 17468 1 318 . 1 1 71 71 ALA C C 13 178.29 0.15 . 1 . . . . 252 ALA C . 17468 1 319 . 1 1 71 71 ALA CA C 13 53.63 0.15 . 1 . . . . 252 ALA CA . 17468 1 320 . 1 1 71 71 ALA CB C 13 19.40 0.15 . 1 . . . . 252 ALA CB . 17468 1 321 . 1 1 71 71 ALA N N 15 124.27 0.15 . 1 . . . . 252 ALA N . 17468 1 322 . 1 1 72 72 ASP H H 1 8.36 0.02 . 1 . . . . 253 ASP HN . 17468 1 323 . 1 1 72 72 ASP C C 13 176.94 0.15 . 1 . . . . 253 ASP C . 17468 1 324 . 1 1 72 72 ASP CA C 13 55.16 0.15 . 1 . . . . 253 ASP CA . 17468 1 325 . 1 1 72 72 ASP CB C 13 40.76 0.15 . 1 . . . . 253 ASP CB . 17468 1 326 . 1 1 72 72 ASP N N 15 118.48 0.15 . 1 . . . . 253 ASP N . 17468 1 327 . 1 1 73 73 LEU H H 1 7.98 0.02 . 1 . . . . 254 LEU HN . 17468 1 328 . 1 1 73 73 LEU C C 13 177.91 0.15 . 1 . . . . 254 LEU C . 17468 1 329 . 1 1 73 73 LEU CA C 13 55.92 0.15 . 1 . . . . 254 LEU CA . 17468 1 330 . 1 1 73 73 LEU CB C 13 42.14 0.15 . 1 . . . . 254 LEU CB . 17468 1 331 . 1 1 73 73 LEU N N 15 122.33 0.15 . 1 . . . . 254 LEU N . 17468 1 332 . 1 1 74 74 ILE H H 1 8.02 0.02 . 1 . . . . 255 ILE HN . 17468 1 333 . 1 1 74 74 ILE C C 13 177.42 0.15 . 1 . . . . 255 ILE C . 17468 1 334 . 1 1 74 74 ILE CA C 13 62.38 0.15 . 1 . . . . 255 ILE CA . 17468 1 335 . 1 1 74 74 ILE CB C 13 38.34 0.15 . 1 . . . . 255 ILE CB . 17468 1 336 . 1 1 74 74 ILE N N 15 121.69 0.15 . 1 . . . . 255 ILE N . 17468 1 337 . 1 1 75 75 GLU H H 1 8.37 0.02 . 1 . . . . 256 GLU HN . 17468 1 338 . 1 1 75 75 GLU C C 13 177.29 0.15 . 1 . . . . 256 GLU C . 17468 1 339 . 1 1 75 75 GLU CA C 13 57.84 0.15 . 1 . . . . 256 GLU CA . 17468 1 340 . 1 1 75 75 GLU CB C 13 29.86 0.15 . 1 . . . . 256 GLU CB . 17468 1 341 . 1 1 75 75 GLU N N 15 123.47 0.15 . 1 . . . . 256 GLU N . 17468 1 342 . 1 1 76 76 ALA H H 1 8.29 0.02 . 1 . . . . 257 ALA HN . 17468 1 343 . 1 1 76 76 ALA C C 13 178.69 0.15 . 1 . . . . 257 ALA C . 17468 1 344 . 1 1 76 76 ALA CA C 13 53.74 0.15 . 1 . . . . 257 ALA CA . 17468 1 345 . 1 1 76 76 ALA CB C 13 19.17 0.15 . 1 . . . . 257 ALA CB . 17468 1 346 . 1 1 76 76 ALA N N 15 123.47 0.15 . 1 . . . . 257 ALA N . 17468 1 347 . 1 1 77 77 ASN H H 1 8.29 0.02 . 1 . . . . 258 ASN HN . 17468 1 348 . 1 1 77 77 ASN C C 13 176.06 0.15 . 1 . . . . 258 ASN C . 17468 1 349 . 1 1 77 77 ASN CA C 13 54.13 0.15 . 1 . . . . 258 ASN CA . 17468 1 350 . 1 1 77 77 ASN CB C 13 38.70 0.15 . 1 . . . . 258 ASN CB . 17468 1 351 . 1 1 77 77 ASN N N 15 116.95 0.15 . 1 . . . . 258 ASN N . 17468 1 352 . 1 1 78 78 LEU H H 1 8.08 0.02 . 1 . . . . 259 LEU HN . 17468 1 353 . 1 1 78 78 LEU C C 13 178.35 0.15 . 1 . . . . 259 LEU C . 17468 1 354 . 1 1 78 78 LEU CA C 13 56.52 0.15 . 1 . . . . 259 LEU CA . 17468 1 355 . 1 1 78 78 LEU CB C 13 42.22 0.15 . 1 . . . . 259 LEU CB . 17468 1 356 . 1 1 78 78 LEU N N 15 121.86 0.15 . 1 . . . . 259 LEU N . 17468 1 357 . 1 1 79 79 LEU H H 1 8.07 0.02 . 1 . . . . 260 LEU HN . 17468 1 358 . 1 1 79 79 LEU C C 13 177.94 0.15 . 1 . . . . 260 LEU C . 17468 1 359 . 1 1 79 79 LEU CA C 13 56.25 0.15 . 1 . . . . 260 LEU CA . 17468 1 360 . 1 1 79 79 LEU CB C 13 41.94 0.15 . 1 . . . . 260 LEU CB . 17468 1 361 . 1 1 79 79 LEU N N 15 120.75 0.15 . 1 . . . . 260 LEU N . 17468 1 362 . 1 1 80 80 TRP H H 1 7.99 0.02 . 1 . . . . 261 TRP HN . 17468 1 363 . 1 1 80 80 TRP C C 13 176.78 0.15 . 1 . . . . 261 TRP C . 17468 1 364 . 1 1 80 80 TRP CA C 13 58.42 0.15 . 1 . . . . 261 TRP CA . 17468 1 365 . 1 1 80 80 TRP CB C 13 29.21 0.15 . 1 . . . . 261 TRP CB . 17468 1 366 . 1 1 80 80 TRP N N 15 120.56 0.15 . 1 . . . . 261 TRP N . 17468 1 367 . 1 1 81 81 ARG H H 1 7.90 0.02 . 1 . . . . 262 ARG HN . 17468 1 368 . 1 1 81 81 ARG C C 13 176.81 0.15 . 1 . . . . 262 ARG C . 17468 1 369 . 1 1 81 81 ARG CA C 13 56.93 0.15 . 1 . . . . 262 ARG CA . 17468 1 370 . 1 1 81 81 ARG CB C 13 30.84 0.15 . 1 . . . . 262 ARG CB . 17468 1 371 . 1 1 81 81 ARG N N 15 121.14 0.15 . 1 . . . . 262 ARG N . 17468 1 372 . 1 1 82 82 GLN H H 1 8.16 0.02 . 1 . . . . 263 GLN HN . 17468 1 373 . 1 1 82 82 GLN C C 13 176.80 0.15 . 1 . . . . 263 GLN C . 17468 1 374 . 1 1 82 82 GLN CA C 13 56.87 0.15 . 1 . . . . 263 GLN CA . 17468 1 375 . 1 1 82 82 GLN CB C 13 29.13 0.15 . 1 . . . . 263 GLN CB . 17468 1 376 . 1 1 82 82 GLN N N 15 120.49 0.15 . 1 . . . . 263 GLN N . 17468 1 377 . 1 1 83 83 GLU H H 1 8.44 0.02 . 1 . . . . 264 GLU HN . 17468 1 378 . 1 1 83 83 GLU C C 13 177.18 0.15 . 1 . . . . 264 GLU C . 17468 1 379 . 1 1 83 83 GLU CA C 13 57.11 0.15 . 1 . . . . 264 GLU CA . 17468 1 380 . 1 1 83 83 GLU CB C 13 30.06 0.15 . 1 . . . . 264 GLU CB . 17468 1 381 . 1 1 83 83 GLU N N 15 121.38 0.15 . 1 . . . . 264 GLU N . 17468 1 382 . 1 1 84 84 MET H H 1 8.32 0.02 . 1 . . . . 265 MET HN . 17468 1 383 . 1 1 84 84 MET C C 13 177.20 0.15 . 1 . . . . 265 MET C . 17468 1 384 . 1 1 84 84 MET CA C 13 55.66 0.15 . 1 . . . . 265 MET CA . 17468 1 385 . 1 1 84 84 MET CB C 13 32.50 0.15 . 1 . . . . 265 MET CB . 17468 1 386 . 1 1 84 84 MET N N 15 120.12 0.15 . 1 . . . . 265 MET N . 17468 1 387 . 1 1 85 85 GLY H H 1 8.30 0.02 . 1 . . . . 266 GLY HN . 17468 1 388 . 1 1 85 85 GLY C C 13 174.67 0.15 . 1 . . . . 266 GLY C . 17468 1 389 . 1 1 85 85 GLY CA C 13 45.47 0.15 . 1 . . . . 266 GLY CA . 17468 1 390 . 1 1 85 85 GLY N N 15 109.28 0.15 . 1 . . . . 266 GLY N . 17468 1 391 . 1 1 86 86 GLY H H 1 8.29 0.02 . 1 . . . . 267 GLY HN . 17468 1 392 . 1 1 86 86 GLY C C 13 173.87 0.15 . 1 . . . . 267 GLY C . 17468 1 393 . 1 1 86 86 GLY CA C 13 45.18 0.15 . 1 . . . . 267 GLY CA . 17468 1 394 . 1 1 86 86 GLY N N 15 108.38 0.15 . 1 . . . . 267 GLY N . 17468 1 395 . 1 1 87 87 ASN H H 1 8.41 0.02 . 1 . . . . 268 ASN HN . 17468 1 396 . 1 1 87 87 ASN C C 13 175.13 0.15 . 1 . . . . 268 ASN C . 17468 1 397 . 1 1 87 87 ASN CA C 13 53.23 0.15 . 1 . . . . 268 ASN CA . 17468 1 398 . 1 1 87 87 ASN CB C 13 38.97 0.15 . 1 . . . . 268 ASN CB . 17468 1 399 . 1 1 87 87 ASN N N 15 118.70 0.15 . 1 . . . . 268 ASN N . 17468 1 400 . 1 1 88 88 ILE H H 1 8.20 0.02 . 1 . . . . 269 ILE HN . 17468 1 401 . 1 1 88 88 ILE C C 13 176.41 0.15 . 1 . . . . 269 ILE C . 17468 1 402 . 1 1 88 88 ILE CA C 13 61.15 0.15 . 1 . . . . 269 ILE CA . 17468 1 403 . 1 1 88 88 ILE CB C 13 38.89 0.15 . 1 . . . . 269 ILE CB . 17468 1 404 . 1 1 88 88 ILE N N 15 121.22 0.15 . 1 . . . . 269 ILE N . 17468 1 405 . 1 1 89 89 THR H H 1 8.39 0.02 . 1 . . . . 270 THR HN . 17468 1 406 . 1 1 89 89 THR C C 13 174.15 0.15 . 1 . . . . 270 THR C . 17468 1 407 . 1 1 89 89 THR CA C 13 62.11 0.15 . 1 . . . . 270 THR CA . 17468 1 408 . 1 1 89 89 THR CB C 13 69.96 0.15 . 1 . . . . 270 THR CB . 17468 1 409 . 1 1 89 89 THR N N 15 119.66 0.15 . 1 . . . . 270 THR N . 17468 1 410 . 1 1 90 90 ARG H H 1 8.48 0.02 . 1 . . . . 271 ARG HN . 17468 1 411 . 1 1 90 90 ARG C C 13 176.05 0.15 . 1 . . . . 271 ARG C . 17468 1 412 . 1 1 90 90 ARG CA C 13 56.01 0.15 . 1 . . . . 271 ARG CA . 17468 1 413 . 1 1 90 90 ARG CB C 13 31.10 0.15 . 1 . . . . 271 ARG CB . 17468 1 414 . 1 1 90 90 ARG N N 15 124.97 0.15 . 1 . . . . 271 ARG N . 17468 1 415 . 1 1 91 91 VAL H H 1 8.39 0.02 . 1 . . . . 272 VAL HN . 17468 1 416 . 1 1 91 91 VAL C C 13 176.40 0.15 . 1 . . . . 272 VAL C . 17468 1 417 . 1 1 91 91 VAL CA C 13 62.43 0.15 . 1 . . . . 272 VAL CA . 17468 1 418 . 1 1 91 91 VAL CB C 13 32.84 0.15 . 1 . . . . 272 VAL CB . 17468 1 419 . 1 1 91 91 VAL N N 15 123.00 0.15 . 1 . . . . 272 VAL N . 17468 1 420 . 1 1 92 92 GLU H H 1 8.68 0.02 . 1 . . . . 273 GLU HN . 17468 1 421 . 1 1 92 92 GLU C C 13 176.65 0.15 . 1 . . . . 273 GLU C . 17468 1 422 . 1 1 92 92 GLU CA C 13 56.66 0.15 . 1 . . . . 273 GLU CA . 17468 1 423 . 1 1 92 92 GLU CB C 13 30.34 0.15 . 1 . . . . 273 GLU CB . 17468 1 424 . 1 1 92 92 GLU N N 15 125.38 0.15 . 1 . . . . 273 GLU N . 17468 1 425 . 1 1 93 93 SER H H 1 8.45 0.02 . 1 . . . . 274 SER HN . 17468 1 426 . 1 1 93 93 SER C C 13 174.65 0.15 . 1 . . . . 274 SER C . 17468 1 427 . 1 1 93 93 SER CA C 13 58.58 0.15 . 1 . . . . 274 SER CA . 17468 1 428 . 1 1 93 93 SER CB C 13 63.79 0.15 . 1 . . . . 274 SER CB . 17468 1 429 . 1 1 93 93 SER N N 15 116.91 0.15 . 1 . . . . 274 SER N . 17468 1 430 . 1 1 94 94 GLU H H 1 8.53 0.02 . 1 . . . . 275 GLU HN . 17468 1 431 . 1 1 94 94 GLU C C 13 176.17 0.15 . 1 . . . . 275 GLU C . 17468 1 432 . 1 1 94 94 GLU CA C 13 56.72 0.15 . 1 . . . . 275 GLU CA . 17468 1 433 . 1 1 94 94 GLU CB C 13 30.41 0.15 . 1 . . . . 275 GLU CB . 17468 1 434 . 1 1 94 94 GLU N N 15 122.72 0.15 . 1 . . . . 275 GLU N . 17468 1 435 . 1 1 95 95 ASN H H 1 8.48 0.02 . 1 . . . . 276 ASN HN . 17468 1 436 . 1 1 95 95 ASN C C 13 174.86 0.15 . 1 . . . . 276 ASN C . 17468 1 437 . 1 1 95 95 ASN CA C 13 53.17 0.15 . 1 . . . . 276 ASN CA . 17468 1 438 . 1 1 95 95 ASN CB C 13 38.87 0.15 . 1 . . . . 276 ASN CB . 17468 1 439 . 1 1 95 95 ASN N N 15 119.80 0.15 . 1 . . . . 276 ASN N . 17468 1 440 . 1 1 96 96 LYS H H 1 8.32 0.02 . 1 . . . . 277 LYS HN . 17468 1 441 . 1 1 96 96 LYS C C 13 176.27 0.15 . 1 . . . . 277 LYS C . 17468 1 442 . 1 1 96 96 LYS CA C 13 56.18 0.15 . 1 . . . . 277 LYS CA . 17468 1 443 . 1 1 96 96 LYS CB C 13 33.18 0.15 . 1 . . . . 277 LYS CB . 17468 1 444 . 1 1 96 96 LYS N N 15 122.42 0.15 . 1 . . . . 277 LYS N . 17468 1 445 . 1 1 97 97 VAL H H 1 8.28 0.02 . 1 . . . . 278 VAL HN . 17468 1 446 . 1 1 97 97 VAL C C 13 175.88 0.15 . 1 . . . . 278 VAL C . 17468 1 447 . 1 1 97 97 VAL CA C 13 62.46 0.15 . 1 . . . . 278 VAL CA . 17468 1 448 . 1 1 97 97 VAL CB C 13 32.76 0.15 . 1 . . . . 278 VAL CB . 17468 1 449 . 1 1 97 97 VAL N N 15 123.14 0.15 . 1 . . . . 278 VAL N . 17468 1 450 . 1 1 98 98 VAL H H 1 8.43 0.02 . 1 . . . . 279 VAL HN . 17468 1 451 . 1 1 98 98 VAL C C 13 175.64 0.15 . 1 . . . . 279 VAL C . 17468 1 452 . 1 1 98 98 VAL CA C 13 62.19 0.15 . 1 . . . . 279 VAL CA . 17468 1 453 . 1 1 98 98 VAL CB C 13 33.07 0.15 . 1 . . . . 279 VAL CB . 17468 1 454 . 1 1 98 98 VAL N N 15 126.77 0.15 . 1 . . . . 279 VAL N . 17468 1 455 . 1 1 99 99 ILE H H 1 8.51 0.02 . 1 . . . . 280 ILE HN . 17468 1 456 . 1 1 99 99 ILE C C 13 176.05 0.15 . 1 . . . . 280 ILE C . 17468 1 457 . 1 1 99 99 ILE CA C 13 60.48 0.15 . 1 . . . . 280 ILE CA . 17468 1 458 . 1 1 99 99 ILE CB C 13 38.41 0.15 . 1 . . . . 280 ILE CB . 17468 1 459 . 1 1 99 99 ILE N N 15 127.56 0.15 . 1 . . . . 280 ILE N . 17468 1 460 . 1 1 100 100 LEU H H 1 8.53 0.02 . 1 . . . . 281 LEU HN . 17468 1 461 . 1 1 100 100 LEU C C 13 176.88 0.15 . 1 . . . . 281 LEU C . 17468 1 462 . 1 1 100 100 LEU CA C 13 54.78 0.15 . 1 . . . . 281 LEU CA . 17468 1 463 . 1 1 100 100 LEU CB C 13 42.63 0.15 . 1 . . . . 281 LEU CB . 17468 1 464 . 1 1 100 100 LEU N N 15 128.19 0.15 . 1 . . . . 281 LEU N . 17468 1 465 . 1 1 101 101 ASP H H 1 8.42 0.02 . 1 . . . . 282 ASP HN . 17468 1 466 . 1 1 101 101 ASP C C 13 175.96 0.15 . 1 . . . . 282 ASP C . 17468 1 467 . 1 1 101 101 ASP CA C 13 54.31 0.15 . 1 . . . . 282 ASP CA . 17468 1 468 . 1 1 101 101 ASP CB C 13 41.38 0.15 . 1 . . . . 282 ASP CB . 17468 1 469 . 1 1 101 101 ASP N N 15 121.89 0.15 . 1 . . . . 282 ASP N . 17468 1 470 . 1 1 102 102 SER H H 1 8.21 0.02 . 1 . . . . 283 SER HN . 17468 1 471 . 1 1 102 102 SER C C 13 173.96 0.15 . 1 . . . . 283 SER C . 17468 1 472 . 1 1 102 102 SER CA C 13 58.09 0.15 . 1 . . . . 283 SER CA . 17468 1 473 . 1 1 102 102 SER CB C 13 63.91 0.15 . 1 . . . . 283 SER CB . 17468 1 474 . 1 1 102 102 SER N N 15 115.84 0.15 . 1 . . . . 283 SER N . 17468 1 475 . 1 1 103 103 PHE H H 1 8.33 0.02 . 1 . . . . 284 PHE HN . 17468 1 476 . 1 1 103 103 PHE C C 13 175.18 0.15 . 1 . . . . 284 PHE C . 17468 1 477 . 1 1 103 103 PHE CA C 13 57.57 0.15 . 1 . . . . 284 PHE CA . 17468 1 478 . 1 1 103 103 PHE CB C 13 39.77 0.15 . 1 . . . . 284 PHE CB . 17468 1 479 . 1 1 103 103 PHE N N 15 122.24 0.15 . 1 . . . . 284 PHE N . 17468 1 480 . 1 1 104 104 GLU H H 1 8.25 0.02 . 1 . . . . 285 GLU HN . 17468 1 481 . 1 1 104 104 GLU CA C 13 53.84 0.15 . 1 . . . . 285 GLU CA . 17468 1 482 . 1 1 104 104 GLU CB C 13 30.18 0.15 . 1 . . . . 285 GLU CB . 17468 1 483 . 1 1 104 104 GLU N N 15 124.77 0.15 . 1 . . . . 285 GLU N . 17468 1 484 . 1 1 105 105 PRO C C 13 176.67 0.15 . 1 . . . . 286 PRO C . 17468 1 485 . 1 1 105 105 PRO CA C 13 62.85 0.15 . 1 . . . . 286 PRO CA . 17468 1 486 . 1 1 105 105 PRO CB C 13 32.22 0.15 . 1 . . . . 286 PRO CB . 17468 1 487 . 1 1 106 106 LEU H H 1 8.44 0.02 . 1 . . . . 287 LEU HN . 17468 1 488 . 1 1 106 106 LEU C C 13 177.28 0.15 . 1 . . . . 287 LEU C . 17468 1 489 . 1 1 106 106 LEU CA C 13 55.17 0.15 . 1 . . . . 287 LEU CA . 17468 1 490 . 1 1 106 106 LEU CB C 13 42.38 0.15 . 1 . . . . 287 LEU CB . 17468 1 491 . 1 1 106 106 LEU N N 15 122.02 0.15 . 1 . . . . 287 LEU N . 17468 1 492 . 1 1 107 107 HIS H H 1 8.56 0.02 . 1 . . . . 288 HIS HN . 17468 1 493 . 1 1 107 107 HIS C C 13 174.21 0.15 . 1 . . . . 288 HIS C . 17468 1 494 . 1 1 107 107 HIS CA C 13 55.11 0.15 . 1 . . . . 288 HIS CA . 17468 1 495 . 1 1 107 107 HIS CB C 13 29.73 0.15 . 1 . . . . 288 HIS CB . 17468 1 496 . 1 1 107 107 HIS N N 15 119.98 0.15 . 1 . . . . 288 HIS N . 17468 1 497 . 1 1 108 108 ALA H H 1 8.57 0.02 . 1 . . . . 289 ALA HN . 17468 1 498 . 1 1 108 108 ALA C C 13 177.27 0.15 . 1 . . . . 289 ALA C . 17468 1 499 . 1 1 108 108 ALA CA C 13 52.27 0.15 . 1 . . . . 289 ALA CA . 17468 1 500 . 1 1 108 108 ALA CB C 13 19.80 0.15 . 1 . . . . 289 ALA CB . 17468 1 501 . 1 1 108 108 ALA N N 15 126.55 0.15 . 1 . . . . 289 ALA N . 17468 1 502 . 1 1 109 109 ASP H H 1 8.57 0.02 . 1 . . . . 290 ASP HN . 17468 1 503 . 1 1 109 109 ASP C C 13 176.82 0.15 . 1 . . . . 290 ASP C . 17468 1 504 . 1 1 109 109 ASP CA C 13 54.64 0.15 . 1 . . . . 290 ASP CA . 17468 1 505 . 1 1 109 109 ASP CB C 13 41.33 0.15 . 1 . . . . 290 ASP CB . 17468 1 506 . 1 1 109 109 ASP N N 15 120.31 0.15 . 1 . . . . 290 ASP N . 17468 1 507 . 1 1 110 110 GLY H H 1 8.47 0.02 . 1 . . . . 291 GLY HN . 17468 1 508 . 1 1 110 110 GLY C C 13 174.03 0.15 . 1 . . . . 291 GLY C . 17468 1 509 . 1 1 110 110 GLY CA C 13 45.35 0.15 . 1 . . . . 291 GLY CA . 17468 1 510 . 1 1 110 110 GLY N N 15 109.64 0.15 . 1 . . . . 291 GLY N . 17468 1 511 . 1 1 111 111 ASP H H 1 8.30 0.02 . 1 . . . . 292 ASP HN . 17468 1 512 . 1 1 111 111 ASP C C 13 176.60 0.15 . 1 . . . . 292 ASP C . 17468 1 513 . 1 1 111 111 ASP CA C 13 54.37 0.15 . 1 . . . . 292 ASP CA . 17468 1 514 . 1 1 111 111 ASP CB C 13 41.35 0.15 . 1 . . . . 292 ASP CB . 17468 1 515 . 1 1 111 111 ASP N N 15 120.83 0.15 . 1 . . . . 292 ASP N . 17468 1 516 . 1 1 112 112 GLU H H 1 8.64 0.02 . 1 . . . . 293 GLU HN . 17468 1 517 . 1 1 112 112 GLU C C 13 177.15 0.15 . 1 . . . . 293 GLU C . 17468 1 518 . 1 1 112 112 GLU CA C 13 57.44 0.15 . 1 . . . . 293 GLU CA . 17468 1 519 . 1 1 112 112 GLU CB C 13 29.84 0.15 . 1 . . . . 293 GLU CB . 17468 1 520 . 1 1 112 112 GLU N N 15 121.84 0.15 . 1 . . . . 293 GLU N . 17468 1 521 . 1 1 113 113 ARG H H 1 8.35 0.02 . 1 . . . . 294 ARG HN . 17468 1 522 . 1 1 113 113 ARG C C 13 176.90 0.15 . 1 . . . . 294 ARG C . 17468 1 523 . 1 1 113 113 ARG CA C 13 57.03 0.15 . 1 . . . . 294 ARG CA . 17468 1 524 . 1 1 113 113 ARG CB C 13 30.53 0.15 . 1 . . . . 294 ARG CB . 17468 1 525 . 1 1 113 113 ARG N N 15 121.38 0.15 . 1 . . . . 294 ARG N . 17468 1 526 . 1 1 114 114 GLU H H 1 8.38 0.02 . 1 . . . . 295 GLU HN . 17468 1 527 . 1 1 114 114 GLU C C 13 177.37 0.15 . 1 . . . . 295 GLU C . 17468 1 528 . 1 1 114 114 GLU CA C 13 57.30 0.15 . 1 . . . . 295 GLU CA . 17468 1 529 . 1 1 114 114 GLU CB C 13 30.12 0.15 . 1 . . . . 295 GLU CB . 17468 1 530 . 1 1 114 114 GLU N N 15 121.05 0.15 . 1 . . . . 295 GLU N . 17468 1 531 . 1 1 115 115 ILE H H 1 8.25 0.02 . 1 . . . . 296 ILE HN . 17468 1 532 . 1 1 115 115 ILE C C 13 177.01 0.15 . 1 . . . . 296 ILE C . 17468 1 533 . 1 1 115 115 ILE CA C 13 62.19 0.15 . 1 . . . . 296 ILE CA . 17468 1 534 . 1 1 115 115 ILE CB C 13 38.52 0.15 . 1 . . . . 296 ILE CB . 17468 1 535 . 1 1 115 115 ILE N N 15 121.80 0.15 . 1 . . . . 296 ILE N . 17468 1 536 . 1 1 116 116 SER H H 1 8.32 0.02 . 1 . . . . 297 SER HN . 17468 1 537 . 1 1 116 116 SER C C 13 175.53 0.15 . 1 . . . . 297 SER C . 17468 1 538 . 1 1 116 116 SER CA C 13 59.06 0.15 . 1 . . . . 297 SER CA . 17468 1 539 . 1 1 116 116 SER CB C 13 63.66 0.15 . 1 . . . . 297 SER CB . 17468 1 540 . 1 1 116 116 SER N N 15 119.36 0.15 . 1 . . . . 297 SER N . 17468 1 541 . 1 1 117 117 VAL H H 1 8.33 0.02 . 1 . . . . 298 VAL HN . 17468 1 542 . 1 1 117 117 VAL C C 13 177.47 0.15 . 1 . . . . 298 VAL C . 17468 1 543 . 1 1 117 117 VAL CA C 13 64.48 0.15 . 1 . . . . 298 VAL CA . 17468 1 544 . 1 1 117 117 VAL CB C 13 32.42 0.15 . 1 . . . . 298 VAL CB . 17468 1 545 . 1 1 117 117 VAL N N 15 123.47 0.15 . 1 . . . . 298 VAL N . 17468 1 546 . 1 1 118 118 ALA H H 1 8.26 0.02 . 1 . . . . 299 ALA HN . 17468 1 547 . 1 1 118 118 ALA C C 13 179.52 0.15 . 1 . . . . 299 ALA C . 17468 1 548 . 1 1 118 118 ALA CA C 13 54.21 0.15 . 1 . . . . 299 ALA CA . 17468 1 549 . 1 1 118 118 ALA CB C 13 18.64 0.15 . 1 . . . . 299 ALA CB . 17468 1 550 . 1 1 118 118 ALA N N 15 124.05 0.15 . 1 . . . . 299 ALA N . 17468 1 551 . 1 1 119 119 ALA H H 1 8.23 0.02 . 1 . . . . 300 ALA HN . 17468 1 552 . 1 1 119 119 ALA C C 13 179.73 0.15 . 1 . . . . 300 ALA C . 17468 1 553 . 1 1 119 119 ALA CA C 13 54.25 0.15 . 1 . . . . 300 ALA CA . 17468 1 554 . 1 1 119 119 ALA CB C 13 18.75 0.15 . 1 . . . . 300 ALA CB . 17468 1 555 . 1 1 119 119 ALA N N 15 121.75 0.15 . 1 . . . . 300 ALA N . 17468 1 556 . 1 1 120 120 GLU H H 1 8.20 0.02 . 1 . . . . 301 GLU HN . 17468 1 557 . 1 1 120 120 GLU C C 13 178.07 0.15 . 1 . . . . 301 GLU C . 17468 1 558 . 1 1 120 120 GLU CA C 13 58.16 0.15 . 1 . . . . 301 GLU CA . 17468 1 559 . 1 1 120 120 GLU CB C 13 29.54 0.15 . 1 . . . . 301 GLU CB . 17468 1 560 . 1 1 120 120 GLU N N 15 120.45 0.15 . 1 . . . . 301 GLU N . 17468 1 561 . 1 1 121 121 ILE H H 1 8.00 0.02 . 1 . . . . 302 ILE HN . 17468 1 562 . 1 1 121 121 ILE C C 13 178.52 0.15 . 1 . . . . 302 ILE C . 17468 1 563 . 1 1 121 121 ILE CA C 13 63.85 0.15 . 1 . . . . 302 ILE CA . 17468 1 564 . 1 1 121 121 ILE CB C 13 38.38 0.15 . 1 . . . . 302 ILE CB . 17468 1 565 . 1 1 121 121 ILE N N 15 120.97 0.15 . 1 . . . . 302 ILE N . 17468 1 566 . 1 1 122 122 LEU H H 1 7.88 0.02 . 1 . . . . 303 LEU HN . 17468 1 567 . 1 1 122 122 LEU CA C 13 56.87 0.15 . 1 . . . . 303 LEU CA . 17468 1 568 . 1 1 122 122 LEU N N 15 122.17 0.15 . 1 . . . . 303 LEU N . 17468 1 569 . 1 1 123 123 ARG C C 13 178.15 0.15 . 1 . . . . 304 ARG C . 17468 1 570 . 1 1 123 123 ARG CA C 13 58.45 0.15 . 1 . . . . 304 ARG CA . 17468 1 571 . 1 1 123 123 ARG CB C 13 30.68 0.15 . 1 . . . . 304 ARG CB . 17468 1 572 . 1 1 124 124 LYS H H 1 8.14 0.02 . 1 . . . . 305 LYS HN . 17468 1 573 . 1 1 124 124 LYS C C 13 177.48 0.15 . 1 . . . . 305 LYS C . 17468 1 574 . 1 1 124 124 LYS CA C 13 57.82 0.15 . 1 . . . . 305 LYS CA . 17468 1 575 . 1 1 124 124 LYS CB C 13 33.21 0.15 . 1 . . . . 305 LYS CB . 17468 1 576 . 1 1 124 124 LYS N N 15 119.44 0.15 . 1 . . . . 305 LYS N . 17468 1 577 . 1 1 125 125 SER H H 1 8.04 0.02 . 1 . . . . 306 SER HN . 17468 1 578 . 1 1 125 125 SER C C 13 174.70 0.15 . 1 . . . . 306 SER C . 17468 1 579 . 1 1 125 125 SER CA C 13 59.20 0.15 . 1 . . . . 306 SER CA . 17468 1 580 . 1 1 125 125 SER CB C 13 63.73 0.15 . 1 . . . . 306 SER CB . 17468 1 581 . 1 1 125 125 SER N N 15 115.27 0.15 . 1 . . . . 306 SER N . 17468 1 582 . 1 1 126 126 ARG H H 1 7.96 0.02 . 1 . . . . 307 ARG HN . 17468 1 583 . 1 1 126 126 ARG C C 13 175.99 0.15 . 1 . . . . 307 ARG C . 17468 1 584 . 1 1 126 126 ARG CA C 13 56.39 0.15 . 1 . . . . 307 ARG CA . 17468 1 585 . 1 1 126 126 ARG CB C 13 30.73 0.15 . 1 . . . . 307 ARG CB . 17468 1 586 . 1 1 126 126 ARG N N 15 122.05 0.15 . 1 . . . . 307 ARG N . 17468 1 587 . 1 1 127 127 LYS H H 1 8.09 0.02 . 1 . . . . 308 LYS HN . 17468 1 588 . 1 1 127 127 LYS C C 13 175.88 0.15 . 1 . . . . 308 LYS C . 17468 1 589 . 1 1 127 127 LYS CA C 13 56.12 0.15 . 1 . . . . 308 LYS CA . 17468 1 590 . 1 1 127 127 LYS CB C 13 33.10 0.15 . 1 . . . . 308 LYS CB . 17468 1 591 . 1 1 127 127 LYS N N 15 121.38 0.15 . 1 . . . . 308 LYS N . 17468 1 592 . 1 1 128 128 PHE H H 1 8.27 0.02 . 1 . . . . 309 PHE HN . 17468 1 593 . 1 1 128 128 PHE CA C 13 55.45 0.15 . 1 . . . . 309 PHE CA . 17468 1 594 . 1 1 128 128 PHE CB C 13 39.22 0.15 . 1 . . . . 309 PHE CB . 17468 1 595 . 1 1 128 128 PHE N N 15 121.50 0.15 . 1 . . . . 309 PHE N . 17468 1 596 . 1 1 129 129 PRO C C 13 176.92 0.15 . 1 . . . . 310 PRO C . 17468 1 597 . 1 1 129 129 PRO CA C 13 63.20 0.15 . 1 . . . . 310 PRO CA . 17468 1 598 . 1 1 129 129 PRO CB C 13 32.12 0.15 . 1 . . . . 310 PRO CB . 17468 1 599 . 1 1 130 130 SER H H 1 8.47 0.02 . 1 . . . . 311 SER HN . 17468 1 600 . 1 1 130 130 SER C C 13 174.21 0.15 . 1 . . . . 311 SER C . 17468 1 601 . 1 1 130 130 SER CA C 13 58.50 0.15 . 1 . . . . 311 SER CA . 17468 1 602 . 1 1 130 130 SER CB C 13 63.96 0.15 . 1 . . . . 311 SER CB . 17468 1 603 . 1 1 130 130 SER N N 15 116.55 0.15 . 1 . . . . 311 SER N . 17468 1 604 . 1 1 131 131 ALA H H 1 8.41 0.02 . 1 . . . . 312 ALA HN . 17468 1 605 . 1 1 131 131 ALA C C 13 177.38 0.15 . 1 . . . . 312 ALA C . 17468 1 606 . 1 1 131 131 ALA CA C 13 52.10 0.15 . 1 . . . . 312 ALA CA . 17468 1 607 . 1 1 131 131 ALA CB C 13 19.71 0.15 . 1 . . . . 312 ALA CB . 17468 1 608 . 1 1 131 131 ALA N N 15 125.75 0.15 . 1 . . . . 312 ALA N . 17468 1 609 . 1 1 132 132 LEU H H 1 8.17 0.02 . 1 . . . . 313 LEU HN . 17468 1 610 . 1 1 132 132 LEU CA C 13 52.81 0.15 . 1 . . . . 313 LEU CA . 17468 1 611 . 1 1 132 132 LEU CB C 13 41.93 0.15 . 1 . . . . 313 LEU CB . 17468 1 612 . 1 1 132 132 LEU N N 15 123.00 0.15 . 1 . . . . 313 LEU N . 17468 1 613 . 1 1 133 133 PRO C C 13 177.28 0.15 . 1 . . . . 314 PRO C . 17468 1 614 . 1 1 133 133 PRO CA C 13 62.40 0.15 . 1 . . . . 314 PRO CA . 17468 1 615 . 1 1 133 133 PRO CB C 13 31.82 0.15 . 1 . . . . 314 PRO CB . 17468 1 616 . 1 1 134 134 ILE H H 1 8.32 0.02 . 1 . . . . 315 ILE HN . 17468 1 617 . 1 1 134 134 ILE CA C 13 62.76 0.15 . 1 . . . . 315 ILE CA . 17468 1 618 . 1 1 134 134 ILE CB C 13 38.68 0.15 . 1 . . . . 315 ILE CB . 17468 1 619 . 1 1 134 134 ILE N N 15 120.45 0.15 . 1 . . . . 315 ILE N . 17468 1 620 . 1 1 135 135 TRP C C 13 175.70 0.15 . 1 . . . . 316 TRP C . 17468 1 621 . 1 1 135 135 TRP CA C 13 56.26 0.15 . 1 . . . . 316 TRP CA . 17468 1 622 . 1 1 135 135 TRP CB C 13 29.15 0.15 . 1 . . . . 316 TRP CB . 17468 1 623 . 1 1 136 136 ALA H H 1 7.57 0.02 . 1 . . . . 317 ALA HN . 17468 1 624 . 1 1 136 136 ALA C C 13 176.59 0.15 . 1 . . . . 317 ALA C . 17468 1 625 . 1 1 136 136 ALA CA C 13 51.56 0.15 . 1 . . . . 317 ALA CA . 17468 1 626 . 1 1 136 136 ALA CB C 13 19.85 0.15 . 1 . . . . 317 ALA CB . 17468 1 627 . 1 1 136 136 ALA N N 15 125.09 0.15 . 1 . . . . 317 ALA N . 17468 1 628 . 1 1 137 137 ARG H H 1 7.74 0.02 . 1 . . . . 318 ARG HN . 17468 1 629 . 1 1 137 137 ARG CA C 13 54.42 0.15 . 1 . . . . 318 ARG CA . 17468 1 630 . 1 1 137 137 ARG CB C 13 31.49 0.15 . 1 . . . . 318 ARG CB . 17468 1 631 . 1 1 137 137 ARG N N 15 120.86 0.15 . 1 . . . . 318 ARG N . 17468 1 632 . 1 1 138 138 PRO C C 13 176.42 0.15 . 1 . . . . 319 PRO C . 17468 1 633 . 1 1 138 138 PRO CA C 13 63.73 0.15 . 1 . . . . 319 PRO CA . 17468 1 634 . 1 1 138 138 PRO CB C 13 32.09 0.15 . 1 . . . . 319 PRO CB . 17468 1 635 . 1 1 139 139 ASP H H 1 8.35 0.02 . 1 . . . . 320 ASP HN . 17468 1 636 . 1 1 139 139 ASP C C 13 175.52 0.15 . 1 . . . . 320 ASP C . 17468 1 637 . 1 1 139 139 ASP CA C 13 53.77 0.15 . 1 . . . . 320 ASP CA . 17468 1 638 . 1 1 139 139 ASP CB C 13 40.55 0.15 . 1 . . . . 320 ASP CB . 17468 1 639 . 1 1 139 139 ASP N N 15 117.91 0.15 . 1 . . . . 320 ASP N . 17468 1 640 . 1 1 140 140 TYR H H 1 7.87 0.02 . 1 . . . . 321 TYR HN . 17468 1 641 . 1 1 140 140 TYR C C 13 174.81 0.15 . 1 . . . . 321 TYR C . 17468 1 642 . 1 1 140 140 TYR CA C 13 58.06 0.15 . 1 . . . . 321 TYR CA . 17468 1 643 . 1 1 140 140 TYR CB C 13 39.08 0.15 . 1 . . . . 321 TYR CB . 17468 1 644 . 1 1 140 140 TYR N N 15 120.97 0.15 . 1 . . . . 321 TYR N . 17468 1 645 . 1 1 141 141 ASN H H 1 8.27 0.02 . 1 . . . . 322 ASN HN . 17468 1 646 . 1 1 141 141 ASN CA C 13 50.55 0.15 . 1 . . . . 322 ASN CA . 17468 1 647 . 1 1 141 141 ASN CB C 13 39.57 0.15 . 1 . . . . 322 ASN CB . 17468 1 648 . 1 1 141 141 ASN N N 15 124.52 0.15 . 1 . . . . 322 ASN N . 17468 1 649 . 1 1 143 143 PRO C C 13 176.67 0.15 . 1 . . . . 324 PRO C . 17468 1 650 . 1 1 143 143 PRO CA C 13 62.69 0.15 . 1 . . . . 324 PRO CA . 17468 1 651 . 1 1 143 143 PRO CB C 13 32.15 0.15 . 1 . . . . 324 PRO CB . 17468 1 652 . 1 1 144 144 LEU H H 1 8.37 0.02 . 1 . . . . 325 LEU HN . 17468 1 653 . 1 1 144 144 LEU C C 13 177.32 0.15 . 1 . . . . 325 LEU C . 17468 1 654 . 1 1 144 144 LEU CA C 13 55.08 0.15 . 1 . . . . 325 LEU CA . 17468 1 655 . 1 1 144 144 LEU CB C 13 42.40 0.15 . 1 . . . . 325 LEU CB . 17468 1 656 . 1 1 144 144 LEU N N 15 122.61 0.15 . 1 . . . . 325 LEU N . 17468 1 657 . 1 1 145 145 LEU H H 1 8.30 0.02 . 1 . . . . 326 LEU HN . 17468 1 658 . 1 1 145 145 LEU C C 13 177.28 0.15 . 1 . . . . 326 LEU C . 17468 1 659 . 1 1 145 145 LEU CA C 13 54.98 0.15 . 1 . . . . 326 LEU CA . 17468 1 660 . 1 1 145 145 LEU CB C 13 42.51 0.15 . 1 . . . . 326 LEU CB . 17468 1 661 . 1 1 145 145 LEU N N 15 123.66 0.15 . 1 . . . . 326 LEU N . 17468 1 662 . 1 1 146 146 GLU H H 1 8.52 0.02 . 1 . . . . 327 GLU HN . 17468 1 663 . 1 1 146 146 GLU C C 13 176.71 0.15 . 1 . . . . 327 GLU C . 17468 1 664 . 1 1 146 146 GLU CA C 13 56.42 0.15 . 1 . . . . 327 GLU CA . 17468 1 665 . 1 1 146 146 GLU CB C 13 30.07 0.15 . 1 . . . . 327 GLU CB . 17468 1 666 . 1 1 146 146 GLU N N 15 122.09 0.15 . 1 . . . . 327 GLU N . 17468 1 667 . 1 1 147 147 SER H H 1 8.31 0.02 . 1 . . . . 328 SER HN . 17468 1 668 . 1 1 147 147 SER C C 13 174.24 0.15 . 1 . . . . 328 SER C . 17468 1 669 . 1 1 147 147 SER CA C 13 58.92 0.15 . 1 . . . . 328 SER CA . 17468 1 670 . 1 1 147 147 SER CB C 13 63.52 0.15 . 1 . . . . 328 SER CB . 17468 1 671 . 1 1 147 147 SER N N 15 117.17 0.15 . 1 . . . . 328 SER N . 17468 1 672 . 1 1 148 148 TRP H H 1 7.93 0.02 . 1 . . . . 329 TRP HN . 17468 1 673 . 1 1 148 148 TRP C C 13 175.72 0.15 . 1 . . . . 329 TRP C . 17468 1 674 . 1 1 148 148 TRP CA C 13 57.62 0.15 . 1 . . . . 329 TRP CA . 17468 1 675 . 1 1 148 148 TRP CB C 13 29.06 0.15 . 1 . . . . 329 TRP CB . 17468 1 676 . 1 1 148 148 TRP N N 15 121.97 0.15 . 1 . . . . 329 TRP N . 17468 1 677 . 1 1 149 149 LYS H H 1 7.55 0.02 . 1 . . . . 330 LYS HN . 17468 1 678 . 1 1 149 149 LYS C C 13 175.04 0.15 . 1 . . . . 330 LYS C . 17468 1 679 . 1 1 149 149 LYS CA C 13 55.37 0.15 . 1 . . . . 330 LYS CA . 17468 1 680 . 1 1 149 149 LYS CB C 13 33.53 0.15 . 1 . . . . 330 LYS CB . 17468 1 681 . 1 1 149 149 LYS N N 15 123.38 0.15 . 1 . . . . 330 LYS N . 17468 1 682 . 1 1 150 150 ASP H H 1 8.00 0.02 . 1 . . . . 331 ASP HN . 17468 1 683 . 1 1 150 150 ASP CA C 13 52.10 0.15 . 1 . . . . 331 ASP CA . 17468 1 684 . 1 1 150 150 ASP CB C 13 41.40 0.15 . 1 . . . . 331 ASP CB . 17468 1 685 . 1 1 150 150 ASP N N 15 123.27 0.15 . 1 . . . . 331 ASP N . 17468 1 686 . 1 1 151 151 PRO C C 13 176.87 0.15 . 1 . . . . 332 PRO C . 17468 1 687 . 1 1 151 151 PRO CA C 13 63.84 0.15 . 1 . . . . 332 PRO CA . 17468 1 688 . 1 1 151 151 PRO CB C 13 32.15 0.15 . 1 . . . . 332 PRO CB . 17468 1 689 . 1 1 152 152 ASP H H 1 8.41 0.02 . 1 . . . . 333 ASP HN . 17468 1 690 . 1 1 152 152 ASP C C 13 175.69 0.15 . 1 . . . . 333 ASP C . 17468 1 691 . 1 1 152 152 ASP CA C 13 54.14 0.15 . 1 . . . . 333 ASP CA . 17468 1 692 . 1 1 152 152 ASP CB C 13 41.07 0.15 . 1 . . . . 333 ASP CB . 17468 1 693 . 1 1 152 152 ASP N N 15 118.27 0.15 . 1 . . . . 333 ASP N . 17468 1 694 . 1 1 153 153 TYR H H 1 7.74 0.02 . 1 . . . . 334 TYR HN . 17468 1 695 . 1 1 153 153 TYR C C 13 174.84 0.15 . 1 . . . . 334 TYR C . 17468 1 696 . 1 1 153 153 TYR CA C 13 58.72 0.15 . 1 . . . . 334 TYR CA . 17468 1 697 . 1 1 153 153 TYR CB C 13 39.07 0.15 . 1 . . . . 334 TYR CB . 17468 1 698 . 1 1 153 153 TYR N N 15 121.58 0.15 . 1 . . . . 334 TYR N . 17468 1 699 . 1 1 154 154 VAL H H 1 7.80 0.02 . 1 . . . . 335 VAL HN . 17468 1 700 . 1 1 154 154 VAL CA C 13 58.79 0.15 . 1 . . . . 335 VAL CA . 17468 1 701 . 1 1 154 154 VAL CB C 13 33.87 0.15 . 1 . . . . 335 VAL CB . 17468 1 702 . 1 1 154 154 VAL N N 15 129.52 0.15 . 1 . . . . 335 VAL N . 17468 1 703 . 1 1 156 156 PRO C C 13 176.65 0.15 . 1 . . . . 337 PRO C . 17468 1 704 . 1 1 156 156 PRO CA C 13 62.56 0.15 . 1 . . . . 337 PRO CA . 17468 1 705 . 1 1 156 156 PRO CB C 13 32.16 0.15 . 1 . . . . 337 PRO CB . 17468 1 706 . 1 1 157 157 VAL H H 1 8.30 0.02 . 1 . . . . 338 VAL HN . 17468 1 707 . 1 1 157 157 VAL C C 13 176.06 0.15 . 1 . . . . 338 VAL C . 17468 1 708 . 1 1 157 157 VAL CA C 13 62.29 0.15 . 1 . . . . 338 VAL CA . 17468 1 709 . 1 1 157 157 VAL CB C 13 32.91 0.15 . 1 . . . . 338 VAL CB . 17468 1 710 . 1 1 157 157 VAL N N 15 121.58 0.15 . 1 . . . . 338 VAL N . 17468 1 711 . 1 1 158 158 VAL H H 1 8.39 0.02 . 1 . . . . 339 VAL HN . 17468 1 712 . 1 1 158 158 VAL C C 13 175.78 0.15 . 1 . . . . 339 VAL C . 17468 1 713 . 1 1 158 158 VAL CA C 13 61.95 0.15 . 1 . . . . 339 VAL CA . 17468 1 714 . 1 1 158 158 VAL CB C 13 33.02 0.15 . 1 . . . . 339 VAL CB . 17468 1 715 . 1 1 158 158 VAL N N 15 125.88 0.15 . 1 . . . . 339 VAL N . 17468 1 716 . 1 1 159 159 HIS H H 1 8.70 0.02 . 1 . . . . 340 HIS HN . 17468 1 717 . 1 1 159 159 HIS C C 13 175.43 0.15 . 1 . . . . 340 HIS C . 17468 1 718 . 1 1 159 159 HIS CA C 13 55.92 0.15 . 1 . . . . 340 HIS CA . 17468 1 719 . 1 1 159 159 HIS CB C 13 30.34 0.15 . 1 . . . . 340 HIS CB . 17468 1 720 . 1 1 159 159 HIS N N 15 124.69 0.15 . 1 . . . . 340 HIS N . 17468 1 721 . 1 1 160 160 GLY H H 1 8.63 0.02 . 1 . . . . 341 GLY HN . 17468 1 722 . 1 1 160 160 GLY C C 13 173.49 0.15 . 1 . . . . 341 GLY C . 17468 1 723 . 1 1 160 160 GLY CA C 13 44.98 0.15 . 1 . . . . 341 GLY CA . 17468 1 724 . 1 1 160 160 GLY N N 15 110.97 0.15 . 1 . . . . 341 GLY N . 17468 1 725 . 1 1 161 161 CYS H H 1 8.32 0.02 . 1 . . . . 342 CYS HN . 17468 1 726 . 1 1 161 161 CYS CA C 13 56.46 0.15 . 1 . . . . 342 CYS CA . 17468 1 727 . 1 1 161 161 CYS CB C 13 27.75 0.15 . 1 . . . . 342 CYS CB . 17468 1 728 . 1 1 161 161 CYS N N 15 120.74 0.15 . 1 . . . . 342 CYS N . 17468 1 729 . 1 1 162 162 PRO C C 13 176.53 0.15 . 1 . . . . 343 PRO C . 17468 1 730 . 1 1 162 162 PRO CA C 13 62.97 0.15 . 1 . . . . 343 PRO CA . 17468 1 731 . 1 1 162 162 PRO CB C 13 32.15 0.15 . 1 . . . . 343 PRO CB . 17468 1 732 . 1 1 163 163 LEU H H 1 8.45 0.02 . 1 . . . . 344 LEU HN . 17468 1 733 . 1 1 163 163 LEU CA C 13 52.95 0.15 . 1 . . . . 344 LEU CA . 17468 1 734 . 1 1 163 163 LEU CB C 13 41.63 0.15 . 1 . . . . 344 LEU CB . 17468 1 735 . 1 1 163 163 LEU N N 15 124.16 0.15 . 1 . . . . 344 LEU N . 17468 1 736 . 1 1 165 165 PRO C C 13 177.10 0.15 . 1 . . . . 346 PRO C . 17468 1 737 . 1 1 165 165 PRO CA C 13 62.80 0.15 . 1 . . . . 346 PRO CA . 17468 1 738 . 1 1 165 165 PRO CB C 13 32.06 0.15 . 1 . . . . 346 PRO CB . 17468 1 739 . 1 1 166 166 THR H H 1 8.36 0.02 . 1 . . . . 347 THR HN . 17468 1 740 . 1 1 166 166 THR C C 13 174.37 0.15 . 1 . . . . 347 THR C . 17468 1 741 . 1 1 166 166 THR CA C 13 61.95 0.15 . 1 . . . . 347 THR CA . 17468 1 742 . 1 1 166 166 THR CB C 13 70.06 0.15 . 1 . . . . 347 THR CB . 17468 1 743 . 1 1 166 166 THR N N 15 115.55 0.15 . 1 . . . . 347 THR N . 17468 1 744 . 1 1 167 167 LYS H H 1 8.43 0.02 . 1 . . . . 348 LYS HN . 17468 1 745 . 1 1 167 167 LYS C C 13 175.71 0.15 . 1 . . . . 348 LYS C . 17468 1 746 . 1 1 167 167 LYS CA C 13 55.87 0.15 . 1 . . . . 348 LYS CA . 17468 1 747 . 1 1 167 167 LYS CB C 13 33.40 0.15 . 1 . . . . 348 LYS CB . 17468 1 748 . 1 1 167 167 LYS N N 15 124.61 0.15 . 1 . . . . 348 LYS N . 17468 1 749 . 1 1 168 168 ALA H H 1 8.48 0.02 . 1 . . . . 349 ALA HN . 17468 1 750 . 1 1 168 168 ALA CA C 13 50.45 0.15 . 1 . . . . 349 ALA CA . 17468 1 751 . 1 1 168 168 ALA CB C 13 19.27 0.15 . 1 . . . . 349 ALA CB . 17468 1 752 . 1 1 168 168 ALA N N 15 127.87 0.15 . 1 . . . . 349 ALA N . 17468 1 753 . 1 1 170 170 PRO C C 13 176.61 0.15 . 1 . . . . 351 PRO C . 17468 1 754 . 1 1 170 170 PRO CA C 13 62.59 0.15 . 1 . . . . 351 PRO CA . 17468 1 755 . 1 1 170 170 PRO CB C 13 32.04 0.15 . 1 . . . . 351 PRO CB . 17468 1 756 . 1 1 171 171 ILE H H 1 8.37 0.02 . 1 . . . . 352 ILE HN . 17468 1 757 . 1 1 171 171 ILE CA C 13 58.57 0.15 . 1 . . . . 352 ILE CA . 17468 1 758 . 1 1 171 171 ILE CB C 13 38.82 0.15 . 1 . . . . 352 ILE CB . 17468 1 759 . 1 1 171 171 ILE N N 15 123.12 0.15 . 1 . . . . 352 ILE N . 17468 1 760 . 1 1 174 174 PRO C C 13 176.82 0.15 . 1 . . . . 355 PRO C . 17468 1 761 . 1 1 174 174 PRO CA C 13 62.71 0.15 . 1 . . . . 355 PRO CA . 17468 1 762 . 1 1 174 174 PRO CB C 13 32.13 0.15 . 1 . . . . 355 PRO CB . 17468 1 763 . 1 1 175 175 ARG H H 1 8.55 0.02 . 1 . . . . 356 ARG HN . 17468 1 764 . 1 1 175 175 ARG C C 13 176.41 0.15 . 1 . . . . 356 ARG C . 17468 1 765 . 1 1 175 175 ARG CA C 13 55.98 0.15 . 1 . . . . 356 ARG CA . 17468 1 766 . 1 1 175 175 ARG CB C 13 31.06 0.15 . 1 . . . . 356 ARG CB . 17468 1 767 . 1 1 175 175 ARG N N 15 121.99 0.15 . 1 . . . . 356 ARG N . 17468 1 768 . 1 1 176 176 ARG H H 1 8.57 0.02 . 1 . . . . 357 ARG HN . 17468 1 769 . 1 1 176 176 ARG C C 13 176.18 0.15 . 1 . . . . 357 ARG C . 17468 1 770 . 1 1 176 176 ARG CA C 13 55.91 0.15 . 1 . . . . 357 ARG CA . 17468 1 771 . 1 1 176 176 ARG CB C 13 31.16 0.15 . 1 . . . . 357 ARG CB . 17468 1 772 . 1 1 176 176 ARG N N 15 123.52 0.15 . 1 . . . . 357 ARG N . 17468 1 773 . 1 1 177 177 LYS H H 1 8.60 0.02 . 1 . . . . 358 LYS HN . 17468 1 774 . 1 1 177 177 LYS C C 13 176.47 0.15 . 1 . . . . 358 LYS C . 17468 1 775 . 1 1 177 177 LYS CA C 13 56.29 0.15 . 1 . . . . 358 LYS CA . 17468 1 776 . 1 1 177 177 LYS CB C 13 33.30 0.15 . 1 . . . . 358 LYS CB . 17468 1 777 . 1 1 177 177 LYS N N 15 124.31 0.15 . 1 . . . . 358 LYS N . 17468 1 778 . 1 1 178 178 ARG H H 1 8.66 0.02 . 1 . . . . 359 ARG HN . 17468 1 779 . 1 1 178 178 ARG C C 13 176.39 0.15 . 1 . . . . 359 ARG C . 17468 1 780 . 1 1 178 178 ARG CA C 13 56.04 0.15 . 1 . . . . 359 ARG CA . 17468 1 781 . 1 1 178 178 ARG CB C 13 31.10 0.15 . 1 . . . . 359 ARG CB . 17468 1 782 . 1 1 178 178 ARG N N 15 123.91 0.15 . 1 . . . . 359 ARG N . 17468 1 783 . 1 1 179 179 THR H H 1 8.48 0.02 . 1 . . . . 360 THR HN . 17468 1 784 . 1 1 179 179 THR C C 13 174.20 0.15 . 1 . . . . 360 THR C . 17468 1 785 . 1 1 179 179 THR CA C 13 62.18 0.15 . 1 . . . . 360 THR CA . 17468 1 786 . 1 1 179 179 THR CB C 13 69.89 0.15 . 1 . . . . 360 THR CB . 17468 1 787 . 1 1 179 179 THR N N 15 118.23 0.15 . 1 . . . . 360 THR N . 17468 1 788 . 1 1 180 180 VAL H H 1 8.38 0.02 . 1 . . . . 361 VAL HN . 17468 1 789 . 1 1 180 180 VAL C C 13 175.65 0.15 . 1 . . . . 361 VAL C . 17468 1 790 . 1 1 180 180 VAL CA C 13 62.23 0.15 . 1 . . . . 361 VAL CA . 17468 1 791 . 1 1 180 180 VAL CB C 13 33.09 0.15 . 1 . . . . 361 VAL CB . 17468 1 792 . 1 1 180 180 VAL N N 15 124.63 0.15 . 1 . . . . 361 VAL N . 17468 1 793 . 1 1 181 181 VAL H H 1 8.45 0.02 . 1 . . . . 362 VAL HN . 17468 1 794 . 1 1 181 181 VAL C C 13 176.01 0.15 . 1 . . . . 362 VAL C . 17468 1 795 . 1 1 181 181 VAL CA C 13 62.18 0.15 . 1 . . . . 362 VAL CA . 17468 1 796 . 1 1 181 181 VAL CB C 13 32.85 0.15 . 1 . . . . 362 VAL CB . 17468 1 797 . 1 1 181 181 VAL N N 15 126.30 0.15 . 1 . . . . 362 VAL N . 17468 1 798 . 1 1 182 182 LEU H H 1 8.61 0.02 . 1 . . . . 363 LEU HN . 17468 1 799 . 1 1 182 182 LEU C C 13 177.35 0.15 . 1 . . . . 363 LEU C . 17468 1 800 . 1 1 182 182 LEU CA C 13 55.03 0.15 . 1 . . . . 363 LEU CA . 17468 1 801 . 1 1 182 182 LEU CB C 13 42.44 0.15 . 1 . . . . 363 LEU CB . 17468 1 802 . 1 1 182 182 LEU N N 15 127.74 0.15 . 1 . . . . 363 LEU N . 17468 1 803 . 1 1 183 183 THR H H 1 8.23 0.02 . 1 . . . . 364 THR HN . 17468 1 804 . 1 1 183 183 THR C C 13 174.44 0.15 . 1 . . . . 364 THR C . 17468 1 805 . 1 1 183 183 THR CA C 13 61.71 0.15 . 1 . . . . 364 THR CA . 17468 1 806 . 1 1 183 183 THR CB C 13 69.95 0.15 . 1 . . . . 364 THR CB . 17468 1 807 . 1 1 183 183 THR N N 15 115.55 0.15 . 1 . . . . 364 THR N . 17468 1 808 . 1 1 184 184 GLU H H 1 8.53 0.02 . 1 . . . . 365 GLU HN . 17468 1 809 . 1 1 184 184 GLU C C 13 176.33 0.15 . 1 . . . . 365 GLU C . 17468 1 810 . 1 1 184 184 GLU CA C 13 56.48 0.15 . 1 . . . . 365 GLU CA . 17468 1 811 . 1 1 184 184 GLU CB C 13 30.53 0.15 . 1 . . . . 365 GLU CB . 17468 1 812 . 1 1 184 184 GLU N N 15 123.47 0.15 . 1 . . . . 365 GLU N . 17468 1 813 . 1 1 185 185 SER H H 1 8.47 0.02 . 1 . . . . 366 SER HN . 17468 1 814 . 1 1 185 185 SER C C 13 174.14 0.15 . 1 . . . . 366 SER C . 17468 1 815 . 1 1 185 185 SER CA C 13 58.28 0.15 . 1 . . . . 366 SER CA . 17468 1 816 . 1 1 185 185 SER CB C 13 63.96 0.15 . 1 . . . . 366 SER CB . 17468 1 817 . 1 1 185 185 SER N N 15 116.98 0.15 . 1 . . . . 366 SER N . 17468 1 818 . 1 1 186 186 ASN H H 1 8.60 0.02 . 1 . . . . 367 ASN HN . 17468 1 819 . 1 1 186 186 ASN C C 13 174.96 0.15 . 1 . . . . 367 ASN C . 17468 1 820 . 1 1 186 186 ASN CA C 13 53.29 0.15 . 1 . . . . 367 ASN CA . 17468 1 821 . 1 1 186 186 ASN CB C 13 39.03 0.15 . 1 . . . . 367 ASN CB . 17468 1 822 . 1 1 186 186 ASN N N 15 121.30 0.15 . 1 . . . . 367 ASN N . 17468 1 823 . 1 1 187 187 VAL H H 1 8.18 0.02 . 1 . . . . 368 VAL HN . 17468 1 824 . 1 1 187 187 VAL C C 13 175.47 0.15 . 1 . . . . 368 VAL C . 17468 1 825 . 1 1 187 187 VAL CA C 13 62.19 0.15 . 1 . . . . 368 VAL CA . 17468 1 826 . 1 1 187 187 VAL CB C 13 33.05 0.15 . 1 . . . . 368 VAL CB . 17468 1 827 . 1 1 187 187 VAL N N 15 120.24 0.15 . 1 . . . . 368 VAL N . 17468 1 828 . 1 1 188 188 SER H H 1 8.09 0.02 . 1 . . . . 369 SER HN . 17468 1 829 . 1 1 188 188 SER CA C 13 60.05 0.15 . 1 . . . . 369 SER CA . 17468 1 830 . 1 1 188 188 SER CB C 13 64.95 0.15 . 1 . . . . 369 SER CB . 17468 1 831 . 1 1 188 188 SER N N 15 125.39 0.15 . 1 . . . . 369 SER N . 17468 1 stop_ save_