data_50913 ####################### # Entry information # ####################### save_entry_information_1 _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information_1 _Entry.ID 50913 _Entry.Title ; PTP1B 1-301 L204A ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2021-04-27 _Entry.Accession_date 2021-04-27 _Entry.Last_release_date 2021-04-27 _Entry.Original_release_date 2021-04-27 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.14.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details 'Backbone chemical shift assignments for Protein Tyrosine Phosphatase 1B residues 1-301 L204A variant' _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 Kristiane Torgeson . R. . . 50913 2 Rebecca Page . . . . 50913 3 Wolfgang Peti . . . . 50913 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 50913 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 510 50913 '15N chemical shifts' 239 50913 '1H chemical shifts' 239 50913 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 1 . . 2022-10-12 . original BMRB . 50913 stop_ save_ ############### # Citations # ############### save_citations_1 _Citation.Sf_category citations _Citation.Sf_framecode citations_1 _Citation.Entry_ID 50913 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 35921420 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; Conserved conformational dynamics determine enzyme activity ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Sci. Adv.' _Citation.Journal_name_full 'Science advances' _Citation.Journal_volume 8 _Citation.Journal_issue 31 _Citation.Journal_ASTM . _Citation.Journal_ISSN 2375-2548 _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 eabo5546 _Citation.Page_last eabo5546 _Citation.Year 2022 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Kristiane Torgeson K. R. . . 50913 1 2 Michael Clarkson M. W. . . 50913 1 3 Daniele Granata D. . . . 50913 1 4 Kresten Lindorff-Larsen K. . . . 50913 1 5 Rebecca Page R. . . . 50913 1 6 Wolfgang Peti W. . . . 50913 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly_1 _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly_1 _Assembly.Entry_ID 50913 _Assembly.ID 1 _Assembly.Name 'PTP1B L204A' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states no _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange no _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 'PTP1B L204A' 1 $entity_1 . . yes native no no . . . 50913 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 50913 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity_1 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GHMASMEMEKEFEQIDKSGS WAAIYQDIRHEASDFPCRVA KLPKNKNRNRYRDVSPFDHS RIKLHQEDNDYINASLIKME EAQRSYILTQGPLPNTCGHF WEMVWEQKSRGVVMLNRVME KGSLKCAQYWPQKEEKEMIF EDTNLKLTLISEDIKSYYTV RQLELENLTTQETREILHFH YTTWPDFGVPESPASFLNFL FKVRESGSASPEHGPVVVHC SAGIGRSGTFCLADTCLLLM DKRKDPSSVDIKKVLLEMRK FRMGLIQTADQLRFSYLAVI EGAKFIMGDSSVQDQWKELS HEDLEPHN ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 308 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation L204A _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID Phosphatase 50913 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 . 50913 1 2 . HIS . 50913 1 3 . MET . 50913 1 4 . ALA . 50913 1 5 . SER . 50913 1 6 . MET . 50913 1 7 . GLU . 50913 1 8 . MET . 50913 1 9 . GLU . 50913 1 10 . LYS . 50913 1 11 . GLU . 50913 1 12 . PHE . 50913 1 13 . GLU . 50913 1 14 . GLN . 50913 1 15 . ILE . 50913 1 16 . ASP . 50913 1 17 . LYS . 50913 1 18 . SER . 50913 1 19 . GLY . 50913 1 20 . SER . 50913 1 21 . TRP . 50913 1 22 . ALA . 50913 1 23 . ALA . 50913 1 24 . ILE . 50913 1 25 . TYR . 50913 1 26 . GLN . 50913 1 27 . ASP . 50913 1 28 . ILE . 50913 1 29 . ARG . 50913 1 30 . HIS . 50913 1 31 . GLU . 50913 1 32 . ALA . 50913 1 33 . SER . 50913 1 34 . ASP . 50913 1 35 . PHE . 50913 1 36 . PRO . 50913 1 37 . CYS . 50913 1 38 . ARG . 50913 1 39 . VAL . 50913 1 40 . ALA . 50913 1 41 . LYS . 50913 1 42 . LEU . 50913 1 43 . PRO . 50913 1 44 . LYS . 50913 1 45 . ASN . 50913 1 46 . LYS . 50913 1 47 . ASN . 50913 1 48 . ARG . 50913 1 49 . ASN . 50913 1 50 . ARG . 50913 1 51 . TYR . 50913 1 52 . ARG . 50913 1 53 . ASP . 50913 1 54 . VAL . 50913 1 55 . SER . 50913 1 56 . PRO . 50913 1 57 . PHE . 50913 1 58 . ASP . 50913 1 59 . HIS . 50913 1 60 . SER . 50913 1 61 . ARG . 50913 1 62 . ILE . 50913 1 63 . LYS . 50913 1 64 . LEU . 50913 1 65 . HIS . 50913 1 66 . GLN . 50913 1 67 . GLU . 50913 1 68 . ASP . 50913 1 69 . ASN . 50913 1 70 . ASP . 50913 1 71 . TYR . 50913 1 72 . ILE . 50913 1 73 . ASN . 50913 1 74 . ALA . 50913 1 75 . SER . 50913 1 76 . LEU . 50913 1 77 . ILE . 50913 1 78 . LYS . 50913 1 79 . MET . 50913 1 80 . GLU . 50913 1 81 . GLU . 50913 1 82 . ALA . 50913 1 83 . GLN . 50913 1 84 . ARG . 50913 1 85 . SER . 50913 1 86 . TYR . 50913 1 87 . ILE . 50913 1 88 . LEU . 50913 1 89 . THR . 50913 1 90 . GLN . 50913 1 91 . GLY . 50913 1 92 . PRO . 50913 1 93 . LEU . 50913 1 94 . PRO . 50913 1 95 . ASN . 50913 1 96 . THR . 50913 1 97 . CYS . 50913 1 98 . GLY . 50913 1 99 . HIS . 50913 1 100 . PHE . 50913 1 101 . TRP . 50913 1 102 . GLU . 50913 1 103 . MET . 50913 1 104 . VAL . 50913 1 105 . TRP . 50913 1 106 . GLU . 50913 1 107 . GLN . 50913 1 108 . LYS . 50913 1 109 . SER . 50913 1 110 . ARG . 50913 1 111 . GLY . 50913 1 112 . VAL . 50913 1 113 . VAL . 50913 1 114 . MET . 50913 1 115 . LEU . 50913 1 116 . ASN . 50913 1 117 . ARG . 50913 1 118 . VAL . 50913 1 119 . MET . 50913 1 120 . GLU . 50913 1 121 . LYS . 50913 1 122 . GLY . 50913 1 123 . SER . 50913 1 124 . LEU . 50913 1 125 . LYS . 50913 1 126 . CYS . 50913 1 127 . ALA . 50913 1 128 . GLN . 50913 1 129 . TYR . 50913 1 130 . TRP . 50913 1 131 . PRO . 50913 1 132 . GLN . 50913 1 133 . LYS . 50913 1 134 . GLU . 50913 1 135 . GLU . 50913 1 136 . LYS . 50913 1 137 . GLU . 50913 1 138 . MET . 50913 1 139 . ILE . 50913 1 140 . PHE . 50913 1 141 . GLU . 50913 1 142 . ASP . 50913 1 143 . THR . 50913 1 144 . ASN . 50913 1 145 . LEU . 50913 1 146 . LYS . 50913 1 147 . LEU . 50913 1 148 . THR . 50913 1 149 . LEU . 50913 1 150 . ILE . 50913 1 151 . SER . 50913 1 152 . GLU . 50913 1 153 . ASP . 50913 1 154 . ILE . 50913 1 155 . LYS . 50913 1 156 . SER . 50913 1 157 . TYR . 50913 1 158 . TYR . 50913 1 159 . THR . 50913 1 160 . VAL . 50913 1 161 . ARG . 50913 1 162 . GLN . 50913 1 163 . LEU . 50913 1 164 . GLU . 50913 1 165 . LEU . 50913 1 166 . GLU . 50913 1 167 . ASN . 50913 1 168 . LEU . 50913 1 169 . THR . 50913 1 170 . THR . 50913 1 171 . GLN . 50913 1 172 . GLU . 50913 1 173 . THR . 50913 1 174 . ARG . 50913 1 175 . GLU . 50913 1 176 . ILE . 50913 1 177 . LEU . 50913 1 178 . HIS . 50913 1 179 . PHE . 50913 1 180 . HIS . 50913 1 181 . TYR . 50913 1 182 . THR . 50913 1 183 . THR . 50913 1 184 . TRP . 50913 1 185 . PRO . 50913 1 186 . ASP . 50913 1 187 . PHE . 50913 1 188 . GLY . 50913 1 189 . VAL . 50913 1 190 . PRO . 50913 1 191 . GLU . 50913 1 192 . SER . 50913 1 193 . PRO . 50913 1 194 . ALA . 50913 1 195 . SER . 50913 1 196 . PHE . 50913 1 197 . LEU . 50913 1 198 . ASN . 50913 1 199 . PHE . 50913 1 200 . LEU . 50913 1 201 . PHE . 50913 1 202 . LYS . 50913 1 203 . VAL . 50913 1 204 . ARG . 50913 1 205 . GLU . 50913 1 206 . SER . 50913 1 207 . GLY . 50913 1 208 . SER . 50913 1 209 . ALA . 50913 1 210 . SER . 50913 1 211 . PRO . 50913 1 212 . GLU . 50913 1 213 . HIS . 50913 1 214 . GLY . 50913 1 215 . PRO . 50913 1 216 . VAL . 50913 1 217 . VAL . 50913 1 218 . VAL . 50913 1 219 . HIS . 50913 1 220 . CYS . 50913 1 221 . SER . 50913 1 222 . ALA . 50913 1 223 . GLY . 50913 1 224 . ILE . 50913 1 225 . GLY . 50913 1 226 . ARG . 50913 1 227 . SER . 50913 1 228 . GLY . 50913 1 229 . THR . 50913 1 230 . PHE . 50913 1 231 . CYS . 50913 1 232 . LEU . 50913 1 233 . ALA . 50913 1 234 . ASP . 50913 1 235 . THR . 50913 1 236 . CYS . 50913 1 237 . LEU . 50913 1 238 . LEU . 50913 1 239 . LEU . 50913 1 240 . MET . 50913 1 241 . ASP . 50913 1 242 . LYS . 50913 1 243 . ARG . 50913 1 244 . LYS . 50913 1 245 . ASP . 50913 1 246 . PRO . 50913 1 247 . SER . 50913 1 248 . SER . 50913 1 249 . VAL . 50913 1 250 . ASP . 50913 1 251 . ILE . 50913 1 252 . LYS . 50913 1 253 . LYS . 50913 1 254 . VAL . 50913 1 255 . LEU . 50913 1 256 . LEU . 50913 1 257 . GLU . 50913 1 258 . MET . 50913 1 259 . ARG . 50913 1 260 . LYS . 50913 1 261 . PHE . 50913 1 262 . ARG . 50913 1 263 . MET . 50913 1 264 . GLY . 50913 1 265 . LEU . 50913 1 266 . ILE . 50913 1 267 . GLN . 50913 1 268 . THR . 50913 1 269 . ALA . 50913 1 270 . ASP . 50913 1 271 . GLN . 50913 1 272 . LEU . 50913 1 273 . ARG . 50913 1 274 . PHE . 50913 1 275 . SER . 50913 1 276 . TYR . 50913 1 277 . LEU . 50913 1 278 . ALA . 50913 1 279 . VAL . 50913 1 280 . ILE . 50913 1 281 . GLU . 50913 1 282 . GLY . 50913 1 283 . ALA . 50913 1 284 . LYS . 50913 1 285 . PHE . 50913 1 286 . ILE . 50913 1 287 . MET . 50913 1 288 . GLY . 50913 1 289 . ASP . 50913 1 290 . SER . 50913 1 291 . SER . 50913 1 292 . VAL . 50913 1 293 . GLN . 50913 1 294 . ASP . 50913 1 295 . GLN . 50913 1 296 . TRP . 50913 1 297 . LYS . 50913 1 298 . GLU . 50913 1 299 . LEU . 50913 1 300 . SER . 50913 1 301 . HIS . 50913 1 302 . GLU . 50913 1 303 . ASP . 50913 1 304 . LEU . 50913 1 305 . GLU . 50913 1 306 . PRO . 50913 1 307 . HIS . 50913 1 308 . ASN . 50913 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 50913 1 . HIS 2 2 50913 1 . MET 3 3 50913 1 . ALA 4 4 50913 1 . SER 5 5 50913 1 . MET 6 6 50913 1 . GLU 7 7 50913 1 . MET 8 8 50913 1 . GLU 9 9 50913 1 . LYS 10 10 50913 1 . GLU 11 11 50913 1 . PHE 12 12 50913 1 . GLU 13 13 50913 1 . GLN 14 14 50913 1 . ILE 15 15 50913 1 . ASP 16 16 50913 1 . LYS 17 17 50913 1 . SER 18 18 50913 1 . GLY 19 19 50913 1 . SER 20 20 50913 1 . TRP 21 21 50913 1 . ALA 22 22 50913 1 . ALA 23 23 50913 1 . ILE 24 24 50913 1 . TYR 25 25 50913 1 . GLN 26 26 50913 1 . ASP 27 27 50913 1 . ILE 28 28 50913 1 . ARG 29 29 50913 1 . HIS 30 30 50913 1 . GLU 31 31 50913 1 . ALA 32 32 50913 1 . SER 33 33 50913 1 . ASP 34 34 50913 1 . PHE 35 35 50913 1 . PRO 36 36 50913 1 . CYS 37 37 50913 1 . ARG 38 38 50913 1 . VAL 39 39 50913 1 . ALA 40 40 50913 1 . LYS 41 41 50913 1 . LEU 42 42 50913 1 . PRO 43 43 50913 1 . LYS 44 44 50913 1 . ASN 45 45 50913 1 . LYS 46 46 50913 1 . ASN 47 47 50913 1 . ARG 48 48 50913 1 . ASN 49 49 50913 1 . ARG 50 50 50913 1 . TYR 51 51 50913 1 . ARG 52 52 50913 1 . ASP 53 53 50913 1 . VAL 54 54 50913 1 . SER 55 55 50913 1 . PRO 56 56 50913 1 . PHE 57 57 50913 1 . ASP 58 58 50913 1 . HIS 59 59 50913 1 . SER 60 60 50913 1 . ARG 61 61 50913 1 . ILE 62 62 50913 1 . LYS 63 63 50913 1 . LEU 64 64 50913 1 . HIS 65 65 50913 1 . GLN 66 66 50913 1 . GLU 67 67 50913 1 . ASP 68 68 50913 1 . ASN 69 69 50913 1 . ASP 70 70 50913 1 . TYR 71 71 50913 1 . ILE 72 72 50913 1 . ASN 73 73 50913 1 . ALA 74 74 50913 1 . SER 75 75 50913 1 . LEU 76 76 50913 1 . ILE 77 77 50913 1 . LYS 78 78 50913 1 . MET 79 79 50913 1 . GLU 80 80 50913 1 . GLU 81 81 50913 1 . ALA 82 82 50913 1 . GLN 83 83 50913 1 . ARG 84 84 50913 1 . SER 85 85 50913 1 . TYR 86 86 50913 1 . ILE 87 87 50913 1 . LEU 88 88 50913 1 . THR 89 89 50913 1 . GLN 90 90 50913 1 . GLY 91 91 50913 1 . PRO 92 92 50913 1 . LEU 93 93 50913 1 . PRO 94 94 50913 1 . ASN 95 95 50913 1 . THR 96 96 50913 1 . CYS 97 97 50913 1 . GLY 98 98 50913 1 . HIS 99 99 50913 1 . PHE 100 100 50913 1 . TRP 101 101 50913 1 . GLU 102 102 50913 1 . MET 103 103 50913 1 . VAL 104 104 50913 1 . TRP 105 105 50913 1 . GLU 106 106 50913 1 . GLN 107 107 50913 1 . LYS 108 108 50913 1 . SER 109 109 50913 1 . ARG 110 110 50913 1 . GLY 111 111 50913 1 . VAL 112 112 50913 1 . VAL 113 113 50913 1 . MET 114 114 50913 1 . LEU 115 115 50913 1 . ASN 116 116 50913 1 . ARG 117 117 50913 1 . VAL 118 118 50913 1 . MET 119 119 50913 1 . GLU 120 120 50913 1 . LYS 121 121 50913 1 . GLY 122 122 50913 1 . SER 123 123 50913 1 . LEU 124 124 50913 1 . LYS 125 125 50913 1 . CYS 126 126 50913 1 . ALA 127 127 50913 1 . GLN 128 128 50913 1 . TYR 129 129 50913 1 . TRP 130 130 50913 1 . PRO 131 131 50913 1 . GLN 132 132 50913 1 . LYS 133 133 50913 1 . GLU 134 134 50913 1 . GLU 135 135 50913 1 . LYS 136 136 50913 1 . GLU 137 137 50913 1 . MET 138 138 50913 1 . ILE 139 139 50913 1 . PHE 140 140 50913 1 . GLU 141 141 50913 1 . ASP 142 142 50913 1 . THR 143 143 50913 1 . ASN 144 144 50913 1 . LEU 145 145 50913 1 . LYS 146 146 50913 1 . LEU 147 147 50913 1 . THR 148 148 50913 1 . LEU 149 149 50913 1 . ILE 150 150 50913 1 . SER 151 151 50913 1 . GLU 152 152 50913 1 . ASP 153 153 50913 1 . ILE 154 154 50913 1 . LYS 155 155 50913 1 . SER 156 156 50913 1 . TYR 157 157 50913 1 . TYR 158 158 50913 1 . THR 159 159 50913 1 . VAL 160 160 50913 1 . ARG 161 161 50913 1 . GLN 162 162 50913 1 . LEU 163 163 50913 1 . GLU 164 164 50913 1 . LEU 165 165 50913 1 . GLU 166 166 50913 1 . ASN 167 167 50913 1 . LEU 168 168 50913 1 . THR 169 169 50913 1 . THR 170 170 50913 1 . GLN 171 171 50913 1 . GLU 172 172 50913 1 . THR 173 173 50913 1 . ARG 174 174 50913 1 . GLU 175 175 50913 1 . ILE 176 176 50913 1 . LEU 177 177 50913 1 . HIS 178 178 50913 1 . PHE 179 179 50913 1 . HIS 180 180 50913 1 . TYR 181 181 50913 1 . THR 182 182 50913 1 . THR 183 183 50913 1 . TRP 184 184 50913 1 . PRO 185 185 50913 1 . ASP 186 186 50913 1 . PHE 187 187 50913 1 . GLY 188 188 50913 1 . VAL 189 189 50913 1 . PRO 190 190 50913 1 . GLU 191 191 50913 1 . SER 192 192 50913 1 . PRO 193 193 50913 1 . ALA 194 194 50913 1 . SER 195 195 50913 1 . PHE 196 196 50913 1 . LEU 197 197 50913 1 . ASN 198 198 50913 1 . PHE 199 199 50913 1 . LEU 200 200 50913 1 . PHE 201 201 50913 1 . LYS 202 202 50913 1 . VAL 203 203 50913 1 . ARG 204 204 50913 1 . GLU 205 205 50913 1 . SER 206 206 50913 1 . GLY 207 207 50913 1 . SER 208 208 50913 1 . ALA 209 209 50913 1 . SER 210 210 50913 1 . PRO 211 211 50913 1 . GLU 212 212 50913 1 . HIS 213 213 50913 1 . GLY 214 214 50913 1 . PRO 215 215 50913 1 . VAL 216 216 50913 1 . VAL 217 217 50913 1 . VAL 218 218 50913 1 . HIS 219 219 50913 1 . CYS 220 220 50913 1 . SER 221 221 50913 1 . ALA 222 222 50913 1 . GLY 223 223 50913 1 . ILE 224 224 50913 1 . GLY 225 225 50913 1 . ARG 226 226 50913 1 . SER 227 227 50913 1 . GLY 228 228 50913 1 . THR 229 229 50913 1 . PHE 230 230 50913 1 . CYS 231 231 50913 1 . LEU 232 232 50913 1 . ALA 233 233 50913 1 . ASP 234 234 50913 1 . THR 235 235 50913 1 . CYS 236 236 50913 1 . LEU 237 237 50913 1 . LEU 238 238 50913 1 . LEU 239 239 50913 1 . MET 240 240 50913 1 . ASP 241 241 50913 1 . LYS 242 242 50913 1 . ARG 243 243 50913 1 . LYS 244 244 50913 1 . ASP 245 245 50913 1 . PRO 246 246 50913 1 . SER 247 247 50913 1 . SER 248 248 50913 1 . VAL 249 249 50913 1 . ASP 250 250 50913 1 . ILE 251 251 50913 1 . LYS 252 252 50913 1 . LYS 253 253 50913 1 . VAL 254 254 50913 1 . LEU 255 255 50913 1 . LEU 256 256 50913 1 . GLU 257 257 50913 1 . MET 258 258 50913 1 . ARG 259 259 50913 1 . LYS 260 260 50913 1 . PHE 261 261 50913 1 . ARG 262 262 50913 1 . MET 263 263 50913 1 . GLY 264 264 50913 1 . LEU 265 265 50913 1 . ILE 266 266 50913 1 . GLN 267 267 50913 1 . THR 268 268 50913 1 . ALA 269 269 50913 1 . ASP 270 270 50913 1 . GLN 271 271 50913 1 . LEU 272 272 50913 1 . ARG 273 273 50913 1 . PHE 274 274 50913 1 . SER 275 275 50913 1 . TYR 276 276 50913 1 . LEU 277 277 50913 1 . ALA 278 278 50913 1 . VAL 279 279 50913 1 . ILE 280 280 50913 1 . GLU 281 281 50913 1 . GLY 282 282 50913 1 . ALA 283 283 50913 1 . LYS 284 284 50913 1 . PHE 285 285 50913 1 . ILE 286 286 50913 1 . MET 287 287 50913 1 . GLY 288 288 50913 1 . ASP 289 289 50913 1 . SER 290 290 50913 1 . SER 291 291 50913 1 . VAL 292 292 50913 1 . GLN 293 293 50913 1 . ASP 294 294 50913 1 . GLN 295 295 50913 1 . TRP 296 296 50913 1 . LYS 297 297 50913 1 . GLU 298 298 50913 1 . LEU 299 299 50913 1 . SER 300 300 50913 1 . HIS 301 301 50913 1 . GLU 302 302 50913 1 . ASP 303 303 50913 1 . LEU 304 304 50913 1 . GLU 305 305 50913 1 . PRO 306 306 50913 1 . HIS 307 307 50913 1 . ASN 308 308 50913 1 stop_ save_ #################### # Natural source # #################### save_natural_source_1 _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source_1 _Entity_natural_src_list.Entry_ID 50913 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity_1 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . PTPN1 . 50913 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source_1 _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source_1 _Entity_experimental_src_list.Entry_ID 50913 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . plasmid . . pRP1B . . . 50913 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 50913 _Sample.ID 1 _Sample.Name 2H-15N-13C-PTP1B _Sample.Type solution _Sample.Sub_type . _Sample.Details 'Expressed in D20 minimal media' _Sample.Aggregate_sample_number 1 _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'PTP1B L204A' '[U-99% 13C; U-99% 15N; U-99% 2H]' . . 1 $entity_1 . . 360 . . uM . . . . 50913 1 2 D2O 'natural abundance' . . . . . . 10 . . % . . . . 50913 1 3 H2O 'natural abundance' . . . . . . 90 . . % . . . . 50913 1 4 HEPES 'natural abundance' . . . . . . 20 . . mM . . . . 50913 1 5 'sodium chloride' 'natural abundance' . . . . . . 150 . . mM . . . . 50913 1 6 TCEP 'natural abundance' . . . . . . 0.5 . . mM . . . . 50913 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 50913 _Sample_condition_list.ID 1 _Sample_condition_list.Name PTP1B_L204A _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 pH 7.4 . pH 50913 1 pressure 1 . atm 50913 1 temperature 298 . K 50913 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 50913 _Software.ID 1 _Software.Type . _Software.Name CARA _Software.Version 1.9.1.7 _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 50913 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 50913 _Software.ID 2 _Software.Type . _Software.Name TOPSPIN _Software.Version 4.1.1 _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID collection . 50913 2 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID 50913 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name 'Bruker Avance Neo 800 MHz' _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE NEO' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ ############################# # NMR applied experiments # ############################# save_experiment_list_1 _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list_1 _Experiment_list.Entry_ID 50913 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NUS_flag _Experiment.Interleaved_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Details _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N TROSY' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50913 1 2 '3D HN(CO)CA' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50913 1 3 '3D HNCACB' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50913 1 4 '3D HNCA' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50913 1 5 '3D HN(CO)CACB' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50913 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chem_shift_reference_1 _Chem_shift_reference.Entry_ID 50913 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name Chemical_shift_ref_1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0 external direct 0.12514495 . . . . . 50913 1 H 1 DSS 'methyl protons' . . . . ppm 0 external indirect 1 . . . . . 50913 1 N 15 DSS 'methyl protons' . . . . ppm 0 external indirect 0.1013291 . . . . . 50913 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 50913 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name PTP1B_L204A_shift_list _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 2 '3D HN(CO)CA' . . . 50913 1 3 '3D HNCACB' . . . 50913 1 4 '3D HNCA' . . . 50913 1 5 '3D HN(CO)CACB' . . . 50913 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $software_1 . . 50913 1 2 $software_2 . . 50913 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 4 4 ALA CA C 13 53.994 0.3 . 1 . . . . . 4 ALA CA . 50913 1 2 . 1 . 1 4 4 ALA CB C 13 17.979 0.3 . 1 . . . . . 4 ALA CB . 50913 1 3 . 1 . 1 5 5 SER H H 1 7.788 0.020 . 1 . . . . . 5 SER H . 50913 1 4 . 1 . 1 5 5 SER CA C 13 60.511 0.3 . 1 . . . . . 5 SER CA . 50913 1 5 . 1 . 1 5 5 SER CB C 13 62.243 0.3 . 1 . . . . . 5 SER CB . 50913 1 6 . 1 . 1 5 5 SER N N 15 113.972 0.3 . 1 . . . . . 5 SER N . 50913 1 7 . 1 . 1 6 6 MET H H 1 8.594 0.020 . 1 . . . . . 6 MET H . 50913 1 8 . 1 . 1 6 6 MET CA C 13 54.620 0.3 . 1 . . . . . 6 MET CA . 50913 1 9 . 1 . 1 6 6 MET CB C 13 40.315 0.3 . 1 . . . . . 6 MET CB . 50913 1 10 . 1 . 1 6 6 MET N N 15 119.165 0.3 . 1 . . . . . 6 MET N . 50913 1 11 . 1 . 1 7 7 GLU H H 1 7.878 0.020 . 1 . . . . . 7 GLU H . 50913 1 12 . 1 . 1 7 7 GLU CA C 13 59.201 0.3 . 1 . . . . . 7 GLU CA . 50913 1 13 . 1 . 1 7 7 GLU CB C 13 28.799 0.3 . 1 . . . . . 7 GLU CB . 50913 1 14 . 1 . 1 7 7 GLU N N 15 119.585 0.3 . 1 . . . . . 7 GLU N . 50913 1 15 . 1 . 1 8 8 MET H H 1 7.615 0.020 . 1 . . . . . 8 MET H . 50913 1 16 . 1 . 1 8 8 MET CA C 13 58.629 0.3 . 1 . . . . . 8 MET CA . 50913 1 17 . 1 . 1 8 8 MET CB C 13 30.951 0.3 . 1 . . . . . 8 MET CB . 50913 1 18 . 1 . 1 8 8 MET N N 15 120.726 0.3 . 1 . . . . . 8 MET N . 50913 1 19 . 1 . 1 9 9 GLU CB C 13 31.013 0.3 . 1 . . . . . 9 GLU CB . 50913 1 20 . 1 . 1 10 10 LYS H H 1 8.241 0.020 . 1 . . . . . 10 LYS H . 50913 1 21 . 1 . 1 10 10 LYS CA C 13 59.789 0.3 . 1 . . . . . 10 LYS CA . 50913 1 22 . 1 . 1 10 10 LYS CB C 13 29.107 0.3 . 1 . . . . . 10 LYS CB . 50913 1 23 . 1 . 1 10 10 LYS N N 15 119.780 0.3 . 1 . . . . . 10 LYS N . 50913 1 24 . 1 . 1 11 11 GLU H H 1 8.148 0.020 . 1 . . . . . 11 GLU H . 50913 1 25 . 1 . 1 11 11 GLU CA C 13 58.864 0.3 . 1 . . . . . 11 GLU CA . 50913 1 26 . 1 . 1 11 11 GLU CB C 13 28.768 0.3 . 1 . . . . . 11 GLU CB . 50913 1 27 . 1 . 1 11 11 GLU N N 15 121.591 0.3 . 1 . . . . . 11 GLU N . 50913 1 28 . 1 . 1 12 12 PHE H H 1 8.426 0.020 . 1 . . . . . 12 PHE H . 50913 1 29 . 1 . 1 12 12 PHE CA C 13 61.752 0.3 . 1 . . . . . 12 PHE CA . 50913 1 30 . 1 . 1 12 12 PHE CB C 13 38.820 0.3 . 1 . . . . . 12 PHE CB . 50913 1 31 . 1 . 1 12 12 PHE N N 15 119.595 0.3 . 1 . . . . . 12 PHE N . 50913 1 32 . 1 . 1 13 13 GLU H H 1 8.132 0.020 . 1 . . . . . 13 GLU H . 50913 1 33 . 1 . 1 13 13 GLU CA C 13 58.928 0.3 . 1 . . . . . 13 GLU CA . 50913 1 34 . 1 . 1 13 13 GLU CB C 13 28.615 0.3 . 1 . . . . . 13 GLU CB . 50913 1 35 . 1 . 1 13 13 GLU N N 15 117.706 0.3 . 1 . . . . . 13 GLU N . 50913 1 36 . 1 . 1 14 14 GLN H H 1 7.697 0.020 . 1 . . . . . 14 GLN H . 50913 1 37 . 1 . 1 14 14 GLN CA C 13 58.403 0.3 . 1 . . . . . 14 GLN CA . 50913 1 38 . 1 . 1 14 14 GLN CB C 13 27.315 0.3 . 1 . . . . . 14 GLN CB . 50913 1 39 . 1 . 1 14 14 GLN N N 15 119.182 0.3 . 1 . . . . . 14 GLN N . 50913 1 40 . 1 . 1 15 15 ILE H H 1 8.073 0.020 . 1 . . . . . 15 ILE H . 50913 1 41 . 1 . 1 15 15 ILE CA C 13 64.801 0.3 . 1 . . . . . 15 ILE CA . 50913 1 42 . 1 . 1 15 15 ILE CB C 13 37.327 0.3 . 1 . . . . . 15 ILE CB . 50913 1 43 . 1 . 1 15 15 ILE N N 15 123.052 0.3 . 1 . . . . . 15 ILE N . 50913 1 44 . 1 . 1 16 16 ASP H H 1 8.352 0.020 . 1 . . . . . 16 ASP H . 50913 1 45 . 1 . 1 16 16 ASP CA C 13 57.500 0.3 . 1 . . . . . 16 ASP CA . 50913 1 46 . 1 . 1 16 16 ASP CB C 13 40.665 0.3 . 1 . . . . . 16 ASP CB . 50913 1 47 . 1 . 1 16 16 ASP N N 15 119.654 0.3 . 1 . . . . . 16 ASP N . 50913 1 48 . 1 . 1 17 17 LYS H H 1 8.287 0.020 . 1 . . . . . 17 LYS H . 50913 1 49 . 1 . 1 17 17 LYS CA C 13 58.328 0.3 . 1 . . . . . 17 LYS CA . 50913 1 50 . 1 . 1 17 17 LYS CB C 13 30.816 0.3 . 1 . . . . . 17 LYS CB . 50913 1 51 . 1 . 1 17 17 LYS N N 15 118.093 0.3 . 1 . . . . . 17 LYS N . 50913 1 52 . 1 . 1 18 18 SER H H 1 7.442 0.020 . 1 . . . . . 18 SER H . 50913 1 53 . 1 . 1 18 18 SER CA C 13 57.984 0.3 . 1 . . . . . 18 SER CA . 50913 1 54 . 1 . 1 18 18 SER CB C 13 63.702 0.3 . 1 . . . . . 18 SER CB . 50913 1 55 . 1 . 1 18 18 SER N N 15 111.405 0.3 . 1 . . . . . 18 SER N . 50913 1 56 . 1 . 1 19 19 GLY H H 1 7.738 0.020 . 1 . . . . . 19 GLY H . 50913 1 57 . 1 . 1 19 19 GLY CA C 13 46.368 0.3 . 1 . . . . . 19 GLY CA . 50913 1 58 . 1 . 1 19 19 GLY N N 15 113.152 0.3 . 1 . . . . . 19 GLY N . 50913 1 59 . 1 . 1 20 20 SER H H 1 7.713 0.020 . 1 . . . . . 20 SER H . 50913 1 60 . 1 . 1 20 20 SER CA C 13 57.914 0.3 . 1 . . . . . 20 SER CA . 50913 1 61 . 1 . 1 20 20 SER CB C 13 62.858 0.3 . 1 . . . . . 20 SER CB . 50913 1 62 . 1 . 1 20 20 SER N N 15 111.525 0.3 . 1 . . . . . 20 SER N . 50913 1 63 . 1 . 1 21 21 TRP H H 1 7.053 0.020 . 1 . . . . . 21 TRP H . 50913 1 64 . 1 . 1 21 21 TRP CA C 13 60.074 0.3 . 1 . . . . . 21 TRP CA . 50913 1 65 . 1 . 1 21 21 TRP CB C 13 28.246 0.3 . 1 . . . . . 21 TRP CB . 50913 1 66 . 1 . 1 21 21 TRP N N 15 121.820 0.3 . 1 . . . . . 21 TRP N . 50913 1 67 . 1 . 1 22 22 ALA H H 1 8.606 0.020 . 1 . . . . . 22 ALA H . 50913 1 68 . 1 . 1 22 22 ALA CA C 13 55.251 0.3 . 1 . . . . . 22 ALA CA . 50913 1 69 . 1 . 1 22 22 ALA CB C 13 16.550 0.3 . 1 . . . . . 22 ALA CB . 50913 1 70 . 1 . 1 22 22 ALA N N 15 119.470 0.3 . 1 . . . . . 22 ALA N . 50913 1 71 . 1 . 1 23 23 ALA H H 1 7.557 0.020 . 1 . . . . . 23 ALA H . 50913 1 72 . 1 . 1 23 23 ALA CA C 13 54.555 0.3 . 1 . . . . . 23 ALA CA . 50913 1 73 . 1 . 1 23 23 ALA CB C 13 17.180 0.3 . 1 . . . . . 23 ALA CB . 50913 1 74 . 1 . 1 23 23 ALA N N 15 122.845 0.3 . 1 . . . . . 23 ALA N . 50913 1 75 . 1 . 1 24 24 ILE H H 1 7.831 0.020 . 1 . . . . . 24 ILE H . 50913 1 76 . 1 . 1 24 24 ILE CA C 13 62.795 0.3 . 1 . . . . . 24 ILE CA . 50913 1 77 . 1 . 1 24 24 ILE CB C 13 36.177 0.3 . 1 . . . . . 24 ILE CB . 50913 1 78 . 1 . 1 24 24 ILE N N 15 119.253 0.3 . 1 . . . . . 24 ILE N . 50913 1 79 . 1 . 1 25 25 TYR H H 1 8.447 0.020 . 1 . . . . . 25 TYR H . 50913 1 80 . 1 . 1 25 25 TYR CA C 13 61.720 0.3 . 1 . . . . . 25 TYR CA . 50913 1 81 . 1 . 1 25 25 TYR CB C 13 37.960 0.3 . 1 . . . . . 25 TYR CB . 50913 1 82 . 1 . 1 25 25 TYR N N 15 120.150 0.3 . 1 . . . . . 25 TYR N . 50913 1 83 . 1 . 1 26 26 GLN H H 1 8.044 0.020 . 1 . . . . . 26 GLN H . 50913 1 84 . 1 . 1 26 26 GLN CA C 13 58.089 0.3 . 1 . . . . . 26 GLN CA . 50913 1 85 . 1 . 1 26 26 GLN CB C 13 26.894 0.3 . 1 . . . . . 26 GLN CB . 50913 1 86 . 1 . 1 26 26 GLN N N 15 118.286 0.3 . 1 . . . . . 26 GLN N . 50913 1 87 . 1 . 1 27 27 ASP H H 1 7.693 0.020 . 1 . . . . . 27 ASP H . 50913 1 88 . 1 . 1 27 27 ASP CA C 13 57.500 0.3 . 1 . . . . . 27 ASP CA . 50913 1 89 . 1 . 1 27 27 ASP CB C 13 39.374 0.3 . 1 . . . . . 27 ASP CB . 50913 1 90 . 1 . 1 27 27 ASP N N 15 120.526 0.3 . 1 . . . . . 27 ASP N . 50913 1 91 . 1 . 1 28 28 ILE H H 1 7.534 0.020 . 1 . . . . . 28 ILE H . 50913 1 92 . 1 . 1 28 28 ILE CA C 13 64.825 0.3 . 1 . . . . . 28 ILE CA . 50913 1 93 . 1 . 1 28 28 ILE CB C 13 36.300 0.3 . 1 . . . . . 28 ILE CB . 50913 1 94 . 1 . 1 28 28 ILE N N 15 120.275 0.3 . 1 . . . . . 28 ILE N . 50913 1 95 . 1 . 1 29 29 ARG H H 1 7.573 0.020 . 1 . . . . . 29 ARG H . 50913 1 96 . 1 . 1 29 29 ARG CA C 13 59.100 0.3 . 1 . . . . . 29 ARG CA . 50913 1 97 . 1 . 1 29 29 ARG CB C 13 28.799 0.3 . 1 . . . . . 29 ARG CB . 50913 1 98 . 1 . 1 29 29 ARG N N 15 117.929 0.3 . 1 . . . . . 29 ARG N . 50913 1 99 . 1 . 1 30 30 HIS H H 1 8.024 0.020 . 1 . . . . . 30 HIS H . 50913 1 100 . 1 . 1 30 30 HIS CA C 13 57.809 0.3 . 1 . . . . . 30 HIS CA . 50913 1 101 . 1 . 1 30 30 HIS CB C 13 29.599 0.3 . 1 . . . . . 30 HIS CB . 50913 1 102 . 1 . 1 30 30 HIS N N 15 117.209 0.3 . 1 . . . . . 30 HIS N . 50913 1 103 . 1 . 1 31 31 GLU H H 1 7.683 0.020 . 1 . . . . . 31 GLU H . 50913 1 104 . 1 . 1 31 31 GLU CA C 13 55.994 0.3 . 1 . . . . . 31 GLU CA . 50913 1 105 . 1 . 1 31 31 GLU CB C 13 29.874 0.3 . 1 . . . . . 31 GLU CB . 50913 1 106 . 1 . 1 31 31 GLU N N 15 117.902 0.3 . 1 . . . . . 31 GLU N . 50913 1 107 . 1 . 1 32 32 ALA H H 1 7.330 0.020 . 1 . . . . . 32 ALA H . 50913 1 108 . 1 . 1 32 32 ALA CA C 13 52.414 0.3 . 1 . . . . . 32 ALA CA . 50913 1 109 . 1 . 1 32 32 ALA CB C 13 18.219 0.3 . 1 . . . . . 32 ALA CB . 50913 1 110 . 1 . 1 32 32 ALA N N 15 123.336 0.3 . 1 . . . . . 32 ALA N . 50913 1 111 . 1 . 1 33 33 SER H H 1 7.877 0.020 . 1 . . . . . 33 SER H . 50913 1 112 . 1 . 1 33 33 SER CA C 13 58.697 0.3 . 1 . . . . . 33 SER CA . 50913 1 113 . 1 . 1 33 33 SER CB C 13 63.702 0.3 . 1 . . . . . 33 SER CB . 50913 1 114 . 1 . 1 33 33 SER N N 15 117.152 0.3 . 1 . . . . . 33 SER N . 50913 1 115 . 1 . 1 34 34 ASP H H 1 7.940 0.020 . 1 . . . . . 34 ASP H . 50913 1 116 . 1 . 1 34 34 ASP CA C 13 53.059 0.3 . 1 . . . . . 34 ASP CA . 50913 1 117 . 1 . 1 34 34 ASP CB C 13 42.671 0.3 . 1 . . . . . 34 ASP CB . 50913 1 118 . 1 . 1 34 34 ASP N N 15 122.301 0.3 . 1 . . . . . 34 ASP N . 50913 1 119 . 1 . 1 35 35 PHE H H 1 6.675 0.020 . 1 . . . . . 35 PHE H . 50913 1 120 . 1 . 1 35 35 PHE CA C 13 54.743 0.3 . 1 . . . . . 35 PHE CA . 50913 1 121 . 1 . 1 35 35 PHE CB C 13 39.886 0.3 . 1 . . . . . 35 PHE CB . 50913 1 122 . 1 . 1 35 35 PHE N N 15 119.559 0.3 . 1 . . . . . 35 PHE N . 50913 1 123 . 1 . 1 36 36 PRO CA C 13 63.620 0.3 . 1 . . . . . 36 PRO CA . 50913 1 124 . 1 . 1 36 36 PRO CB C 13 33.513 0.3 . 1 . . . . . 36 PRO CB . 50913 1 125 . 1 . 1 37 37 CYS H H 1 9.061 0.020 . 1 . . . . . 37 CYS H . 50913 1 126 . 1 . 1 37 37 CYS CA C 13 55.693 0.3 . 1 . . . . . 37 CYS CA . 50913 1 127 . 1 . 1 37 37 CYS CB C 13 27.165 0.3 . 1 . . . . . 37 CYS CB . 50913 1 128 . 1 . 1 37 37 CYS N N 15 126.222 0.3 . 1 . . . . . 37 CYS N . 50913 1 129 . 1 . 1 38 38 ARG H H 1 9.398 0.020 . 1 . . . . . 38 ARG H . 50913 1 130 . 1 . 1 38 38 ARG CA C 13 59.231 0.3 . 1 . . . . . 38 ARG CA . 50913 1 131 . 1 . 1 38 38 ARG CB C 13 29.599 0.3 . 1 . . . . . 38 ARG CB . 50913 1 132 . 1 . 1 38 38 ARG N N 15 121.901 0.3 . 1 . . . . . 38 ARG N . 50913 1 133 . 1 . 1 39 39 VAL H H 1 9.432 0.020 . 1 . . . . . 39 VAL H . 50913 1 134 . 1 . 1 39 39 VAL CA C 13 66.450 0.3 . 1 . . . . . 39 VAL CA . 50913 1 135 . 1 . 1 39 39 VAL CB C 13 30.029 0.3 . 1 . . . . . 39 VAL CB . 50913 1 136 . 1 . 1 39 39 VAL N N 15 121.475 0.3 . 1 . . . . . 39 VAL N . 50913 1 137 . 1 . 1 40 40 ALA H H 1 8.417 0.020 . 1 . . . . . 40 ALA H . 50913 1 138 . 1 . 1 40 40 ALA CA C 13 54.170 0.3 . 1 . . . . . 40 ALA CA . 50913 1 139 . 1 . 1 40 40 ALA CB C 13 20.069 0.3 . 1 . . . . . 40 ALA CB . 50913 1 140 . 1 . 1 40 40 ALA N N 15 121.602 0.3 . 1 . . . . . 40 ALA N . 50913 1 141 . 1 . 1 41 41 LYS H H 1 6.692 0.020 . 1 . . . . . 41 LYS H . 50913 1 142 . 1 . 1 41 41 LYS CA C 13 54.867 0.3 . 1 . . . . . 41 LYS CA . 50913 1 143 . 1 . 1 41 41 LYS CB C 13 31.812 0.3 . 1 . . . . . 41 LYS CB . 50913 1 144 . 1 . 1 41 41 LYS N N 15 111.216 0.3 . 1 . . . . . 41 LYS N . 50913 1 145 . 1 . 1 42 42 LEU H H 1 7.372 0.020 . 1 . . . . . 42 LEU H . 50913 1 146 . 1 . 1 42 42 LEU CA C 13 53.523 0.3 . 1 . . . . . 42 LEU CA . 50913 1 147 . 1 . 1 42 42 LEU CB C 13 40.234 0.3 . 1 . . . . . 42 LEU CB . 50913 1 148 . 1 . 1 42 42 LEU N N 15 123.554 0.3 . 1 . . . . . 42 LEU N . 50913 1 149 . 1 . 1 43 43 PRO CA C 13 63.053 0.3 . 1 . . . . . 43 PRO CA . 50913 1 150 . 1 . 1 44 44 LYS H H 1 7.931 0.020 . 1 . . . . . 44 LYS H . 50913 1 151 . 1 . 1 44 44 LYS CA C 13 57.521 0.3 . 1 . . . . . 44 LYS CA . 50913 1 152 . 1 . 1 44 44 LYS CB C 13 29.992 0.3 . 1 . . . . . 44 LYS CB . 50913 1 153 . 1 . 1 44 44 LYS N N 15 114.057 0.3 . 1 . . . . . 44 LYS N . 50913 1 154 . 1 . 1 45 45 ASN H H 1 7.639 0.020 . 1 . . . . . 45 ASN H . 50913 1 155 . 1 . 1 45 45 ASN CA C 13 52.482 0.3 . 1 . . . . . 45 ASN CA . 50913 1 156 . 1 . 1 45 45 ASN CB C 13 38.759 0.3 . 1 . . . . . 45 ASN CB . 50913 1 157 . 1 . 1 45 45 ASN N N 15 116.904 0.3 . 1 . . . . . 45 ASN N . 50913 1 158 . 1 . 1 46 46 LYS H H 1 7.301 0.020 . 1 . . . . . 46 LYS H . 50913 1 159 . 1 . 1 46 46 LYS CA C 13 60.242 0.3 . 1 . . . . . 46 LYS CA . 50913 1 160 . 1 . 1 46 46 LYS CB C 13 31.627 0.3 . 1 . . . . . 46 LYS CB . 50913 1 161 . 1 . 1 46 46 LYS N N 15 123.522 0.3 . 1 . . . . . 46 LYS N . 50913 1 162 . 1 . 1 47 47 ASN CA C 13 52.740 0.3 . 1 . . . . . 47 ASN CA . 50913 1 163 . 1 . 1 47 47 ASN CB C 13 36.115 0.3 . 1 . . . . . 47 ASN CB . 50913 1 164 . 1 . 1 48 48 ARG H H 1 7.779 0.020 . 1 . . . . . 48 ARG H . 50913 1 165 . 1 . 1 48 48 ARG CA C 13 55.707 0.3 . 1 . . . . . 48 ARG CA . 50913 1 166 . 1 . 1 48 48 ARG CB C 13 30.459 0.3 . 1 . . . . . 48 ARG CB . 50913 1 167 . 1 . 1 48 48 ARG N N 15 115.157 0.3 . 1 . . . . . 48 ARG N . 50913 1 168 . 1 . 1 49 49 ASN H H 1 7.381 0.020 . 1 . . . . . 49 ASN H . 50913 1 169 . 1 . 1 49 49 ASN CA C 13 52.012 0.3 . 1 . . . . . 49 ASN CA . 50913 1 170 . 1 . 1 49 49 ASN CB C 13 40.207 0.3 . 1 . . . . . 49 ASN CB . 50913 1 171 . 1 . 1 49 49 ASN N N 15 119.886 0.3 . 1 . . . . . 49 ASN N . 50913 1 172 . 1 . 1 50 50 ARG H H 1 9.051 0.020 . 1 . . . . . 50 ARG H . 50913 1 173 . 1 . 1 50 50 ARG CA C 13 58.560 0.3 . 1 . . . . . 50 ARG CA . 50913 1 174 . 1 . 1 50 50 ARG CB C 13 30.079 0.3 . 1 . . . . . 50 ARG CB . 50913 1 175 . 1 . 1 50 50 ARG N N 15 126.211 0.3 . 1 . . . . . 50 ARG N . 50913 1 176 . 1 . 1 51 51 TYR H H 1 9.345 0.020 . 1 . . . . . 51 TYR H . 50913 1 177 . 1 . 1 51 51 TYR CA C 13 60.399 0.3 . 1 . . . . . 51 TYR CA . 50913 1 178 . 1 . 1 51 51 TYR CB C 13 39.312 0.3 . 1 . . . . . 51 TYR CB . 50913 1 179 . 1 . 1 51 51 TYR N N 15 117.403 0.3 . 1 . . . . . 51 TYR N . 50913 1 180 . 1 . 1 52 52 ARG CA C 13 57.694 0.3 . 1 . . . . . 52 ARG CA . 50913 1 181 . 1 . 1 52 52 ARG CB C 13 29.044 0.3 . 1 . . . . . 52 ARG CB . 50913 1 182 . 1 . 1 53 53 ASP H H 1 8.489 0.020 . 1 . . . . . 53 ASP H . 50913 1 183 . 1 . 1 53 53 ASP CA C 13 52.911 0.3 . 1 . . . . . 53 ASP CA . 50913 1 184 . 1 . 1 53 53 ASP CB C 13 39.695 0.3 . 1 . . . . . 53 ASP CB . 50913 1 185 . 1 . 1 53 53 ASP N N 15 113.156 0.3 . 1 . . . . . 53 ASP N . 50913 1 186 . 1 . 1 54 54 VAL H H 1 6.909 0.020 . 1 . . . . . 54 VAL H . 50913 1 187 . 1 . 1 54 54 VAL CA C 13 62.090 0.3 . 1 . . . . . 54 VAL CA . 50913 1 188 . 1 . 1 54 54 VAL CB C 13 31.566 0.3 . 1 . . . . . 54 VAL CB . 50913 1 189 . 1 . 1 54 54 VAL N N 15 119.536 0.3 . 1 . . . . . 54 VAL N . 50913 1 190 . 1 . 1 55 55 SER H H 1 7.818 0.020 . 1 . . . . . 55 SER H . 50913 1 191 . 1 . 1 55 55 SER CA C 13 55.115 0.3 . 1 . . . . . 55 SER CA . 50913 1 192 . 1 . 1 55 55 SER CB C 13 64.211 0.3 . 1 . . . . . 55 SER CB . 50913 1 193 . 1 . 1 55 55 SER N N 15 123.462 0.3 . 1 . . . . . 55 SER N . 50913 1 194 . 1 . 1 56 56 PRO CA C 13 61.586 0.3 . 1 . . . . . 56 PRO CA . 50913 1 195 . 1 . 1 56 56 PRO CB C 13 31.443 0.3 . 1 . . . . . 56 PRO CB . 50913 1 196 . 1 . 1 57 57 PHE H H 1 7.150 0.020 . 1 . . . . . 57 PHE H . 50913 1 197 . 1 . 1 57 57 PHE CA C 13 55.203 0.3 . 1 . . . . . 57 PHE CA . 50913 1 198 . 1 . 1 57 57 PHE CB C 13 38.390 0.3 . 1 . . . . . 57 PHE CB . 50913 1 199 . 1 . 1 57 57 PHE N N 15 124.395 0.3 . 1 . . . . . 57 PHE N . 50913 1 200 . 1 . 1 58 58 ASP H H 1 9.178 0.020 . 1 . . . . . 58 ASP H . 50913 1 201 . 1 . 1 58 58 ASP CA C 13 58.495 0.3 . 1 . . . . . 58 ASP CA . 50913 1 202 . 1 . 1 58 58 ASP CB C 13 39.558 0.3 . 1 . . . . . 58 ASP CB . 50913 1 203 . 1 . 1 58 58 ASP N N 15 124.533 0.3 . 1 . . . . . 58 ASP N . 50913 1 204 . 1 . 1 59 59 HIS H H 1 8.913 0.020 . 1 . . . . . 59 HIS H . 50913 1 205 . 1 . 1 59 59 HIS CA C 13 58.718 0.3 . 1 . . . . . 59 HIS CA . 50913 1 206 . 1 . 1 59 59 HIS CB C 13 29.783 0.3 . 1 . . . . . 59 HIS CB . 50913 1 207 . 1 . 1 59 59 HIS N N 15 115.465 0.3 . 1 . . . . . 59 HIS N . 50913 1 208 . 1 . 1 60 60 SER H H 1 6.261 0.020 . 1 . . . . . 60 SER H . 50913 1 209 . 1 . 1 60 60 SER CA C 13 55.115 0.3 . 1 . . . . . 60 SER CA . 50913 1 210 . 1 . 1 60 60 SER CB C 13 63.299 0.3 . 1 . . . . . 60 SER CB . 50913 1 211 . 1 . 1 60 60 SER N N 15 108.398 0.3 . 1 . . . . . 60 SER N . 50913 1 212 . 1 . 1 61 61 ARG H H 1 7.213 0.020 . 1 . . . . . 61 ARG H . 50913 1 213 . 1 . 1 61 61 ARG CA C 13 55.371 0.3 . 1 . . . . . 61 ARG CA . 50913 1 214 . 1 . 1 61 61 ARG CB C 13 27.754 0.3 . 1 . . . . . 61 ARG CB . 50913 1 215 . 1 . 1 61 61 ARG N N 15 123.158 0.3 . 1 . . . . . 61 ARG N . 50913 1 216 . 1 . 1 62 62 ILE H H 1 7.035 0.020 . 1 . . . . . 62 ILE H . 50913 1 217 . 1 . 1 62 62 ILE CA C 13 56.849 0.3 . 1 . . . . . 62 ILE CA . 50913 1 218 . 1 . 1 62 62 ILE CB C 13 35.193 0.3 . 1 . . . . . 62 ILE CB . 50913 1 219 . 1 . 1 62 62 ILE N N 15 122.157 0.3 . 1 . . . . . 62 ILE N . 50913 1 220 . 1 . 1 63 63 LYS H H 1 8.427 0.020 . 1 . . . . . 63 LYS H . 50913 1 221 . 1 . 1 63 63 LYS CA C 13 54.766 0.3 . 1 . . . . . 63 LYS CA . 50913 1 222 . 1 . 1 63 63 LYS CB C 13 31.996 0.3 . 1 . . . . . 63 LYS CB . 50913 1 223 . 1 . 1 63 63 LYS N N 15 127.718 0.3 . 1 . . . . . 63 LYS N . 50913 1 224 . 1 . 1 64 64 LEU H H 1 9.120 0.020 . 1 . . . . . 64 LEU H . 50913 1 225 . 1 . 1 64 64 LEU CA C 13 53.557 0.3 . 1 . . . . . 64 LEU CA . 50913 1 226 . 1 . 1 64 64 LEU CB C 13 41.464 0.3 . 1 . . . . . 64 LEU CB . 50913 1 227 . 1 . 1 64 64 LEU N N 15 125.391 0.3 . 1 . . . . . 64 LEU N . 50913 1 228 . 1 . 1 65 65 HIS H H 1 9.407 0.020 . 1 . . . . . 65 HIS H . 50913 1 229 . 1 . 1 65 65 HIS CA C 13 53.826 0.3 . 1 . . . . . 65 HIS CA . 50913 1 230 . 1 . 1 65 65 HIS CB C 13 27.139 0.3 . 1 . . . . . 65 HIS CB . 50913 1 231 . 1 . 1 65 65 HIS N N 15 124.330 0.3 . 1 . . . . . 65 HIS N . 50913 1 232 . 1 . 1 66 66 GLN H H 1 7.333 0.020 . 1 . . . . . 66 GLN H . 50913 1 233 . 1 . 1 66 66 GLN CA C 13 54.195 0.3 . 1 . . . . . 66 GLN CA . 50913 1 234 . 1 . 1 66 66 GLN CB C 13 30.398 0.3 . 1 . . . . . 66 GLN CB . 50913 1 235 . 1 . 1 66 66 GLN N N 15 119.548 0.3 . 1 . . . . . 66 GLN N . 50913 1 236 . 1 . 1 67 67 GLU H H 1 8.340 0.020 . 1 . . . . . 67 GLU H . 50913 1 237 . 1 . 1 67 67 GLU CA C 13 57.599 0.3 . 1 . . . . . 67 GLU CA . 50913 1 238 . 1 . 1 67 67 GLU CB C 13 29.662 0.3 . 1 . . . . . 67 GLU CB . 50913 1 239 . 1 . 1 67 67 GLU N N 15 121.215 0.3 . 1 . . . . . 67 GLU N . 50913 1 240 . 1 . 1 68 68 ASP H H 1 8.219 0.020 . 1 . . . . . 68 ASP H . 50913 1 241 . 1 . 1 68 68 ASP CA C 13 56.269 0.3 . 1 . . . . . 68 ASP CA . 50913 1 242 . 1 . 1 68 68 ASP CB C 13 40.419 0.3 . 1 . . . . . 68 ASP CB . 50913 1 243 . 1 . 1 68 68 ASP N N 15 118.655 0.3 . 1 . . . . . 68 ASP N . 50913 1 244 . 1 . 1 69 69 ASN H H 1 7.356 0.020 . 1 . . . . . 69 ASN H . 50913 1 245 . 1 . 1 69 69 ASN CA C 13 52.946 0.3 . 1 . . . . . 69 ASN CA . 50913 1 246 . 1 . 1 69 69 ASN CB C 13 37.468 0.3 . 1 . . . . . 69 ASN CB . 50913 1 247 . 1 . 1 69 69 ASN N N 15 114.155 0.3 . 1 . . . . . 69 ASN N . 50913 1 248 . 1 . 1 70 70 ASP H H 1 8.032 0.020 . 1 . . . . . 70 ASP H . 50913 1 249 . 1 . 1 70 70 ASP CA C 13 52.852 0.3 . 1 . . . . . 70 ASP CA . 50913 1 250 . 1 . 1 70 70 ASP CB C 13 40.726 0.3 . 1 . . . . . 70 ASP CB . 50913 1 251 . 1 . 1 70 70 ASP N N 15 126.080 0.3 . 1 . . . . . 70 ASP N . 50913 1 252 . 1 . 1 71 71 TYR H H 1 7.907 0.020 . 1 . . . . . 71 TYR H . 50913 1 253 . 1 . 1 71 71 TYR CA C 13 60.468 0.3 . 1 . . . . . 71 TYR CA . 50913 1 254 . 1 . 1 71 71 TYR CB C 13 38.451 0.3 . 1 . . . . . 71 TYR CB . 50913 1 255 . 1 . 1 71 71 TYR N N 15 118.719 0.3 . 1 . . . . . 71 TYR N . 50913 1 256 . 1 . 1 72 72 ILE H H 1 7.610 0.020 . 1 . . . . . 72 ILE H . 50913 1 257 . 1 . 1 72 72 ILE CA C 13 58.361 0.3 . 1 . . . . . 72 ILE CA . 50913 1 258 . 1 . 1 72 72 ILE CB C 13 41.218 0.3 . 1 . . . . . 72 ILE CB . 50913 1 259 . 1 . 1 72 72 ILE N N 15 125.282 0.3 . 1 . . . . . 72 ILE N . 50913 1 260 . 1 . 1 73 73 ASN H H 1 8.091 0.020 . 1 . . . . . 73 ASN H . 50913 1 261 . 1 . 1 73 73 ASN CA C 13 52.449 0.3 . 1 . . . . . 73 ASN CA . 50913 1 262 . 1 . 1 73 73 ASN CB C 13 35.500 0.3 . 1 . . . . . 73 ASN CB . 50913 1 263 . 1 . 1 73 73 ASN N N 15 125.602 0.3 . 1 . . . . . 73 ASN N . 50913 1 264 . 1 . 1 74 74 ALA H H 1 7.659 0.020 . 1 . . . . . 74 ALA H . 50913 1 265 . 1 . 1 74 74 ALA CA C 13 51.177 0.3 . 1 . . . . . 74 ALA CA . 50913 1 266 . 1 . 1 74 74 ALA CB C 13 22.193 0.3 . 1 . . . . . 74 ALA CB . 50913 1 267 . 1 . 1 74 74 ALA N N 15 128.979 0.3 . 1 . . . . . 74 ALA N . 50913 1 268 . 1 . 1 75 75 SER H H 1 8.861 0.020 . 1 . . . . . 75 SER H . 50913 1 269 . 1 . 1 75 75 SER CA C 13 57.039 0.3 . 1 . . . . . 75 SER CA . 50913 1 270 . 1 . 1 75 75 SER CB C 13 66.301 0.3 . 1 . . . . . 75 SER CB . 50913 1 271 . 1 . 1 75 75 SER N N 15 116.828 0.3 . 1 . . . . . 75 SER N . 50913 1 272 . 1 . 1 76 76 LEU H H 1 8.841 0.020 . 1 . . . . . 76 LEU H . 50913 1 273 . 1 . 1 76 76 LEU CA C 13 53.691 0.3 . 1 . . . . . 76 LEU CA . 50913 1 274 . 1 . 1 76 76 LEU CB C 13 41.341 0.3 . 1 . . . . . 76 LEU CB . 50913 1 275 . 1 . 1 76 76 LEU N N 15 127.343 0.3 . 1 . . . . . 76 LEU N . 50913 1 276 . 1 . 1 77 77 ILE H H 1 9.313 0.020 . 1 . . . . . 77 ILE H . 50913 1 277 . 1 . 1 77 77 ILE CA C 13 59.704 0.3 . 1 . . . . . 77 ILE CA . 50913 1 278 . 1 . 1 77 77 ILE CB C 13 36.484 0.3 . 1 . . . . . 77 ILE CB . 50913 1 279 . 1 . 1 77 77 ILE N N 15 127.918 0.3 . 1 . . . . . 77 ILE N . 50913 1 280 . 1 . 1 78 78 LYS CA C 13 54.415 0.3 . 1 . . . . . 78 LYS CA . 50913 1 281 . 1 . 1 78 78 LYS CB C 13 32.181 0.3 . 1 . . . . . 78 LYS CB . 50913 1 282 . 1 . 1 79 79 MET H H 1 8.036 0.020 . 1 . . . . . 79 MET H . 50913 1 283 . 1 . 1 79 79 MET CA C 13 51.756 0.3 . 1 . . . . . 79 MET CA . 50913 1 284 . 1 . 1 79 79 MET CB C 13 28.738 0.3 . 1 . . . . . 79 MET CB . 50913 1 285 . 1 . 1 79 79 MET N N 15 124.318 0.3 . 1 . . . . . 79 MET N . 50913 1 286 . 1 . 1 80 80 GLU H H 1 8.249 0.020 . 1 . . . . . 80 GLU H . 50913 1 287 . 1 . 1 80 80 GLU CA C 13 59.671 0.3 . 1 . . . . . 80 GLU CA . 50913 1 288 . 1 . 1 80 80 GLU CB C 13 28.337 0.3 . 1 . . . . . 80 GLU CB . 50913 1 289 . 1 . 1 80 80 GLU N N 15 125.961 0.3 . 1 . . . . . 80 GLU N . 50913 1 290 . 1 . 1 81 81 GLU H H 1 9.439 0.020 . 1 . . . . . 81 GLU H . 50913 1 291 . 1 . 1 81 81 GLU CA C 13 58.985 0.3 . 1 . . . . . 81 GLU CA . 50913 1 292 . 1 . 1 81 81 GLU CB C 13 28.430 0.3 . 1 . . . . . 81 GLU CB . 50913 1 293 . 1 . 1 81 81 GLU N N 15 121.012 0.3 . 1 . . . . . 81 GLU N . 50913 1 294 . 1 . 1 82 82 ALA H H 1 7.271 0.020 . 1 . . . . . 82 ALA H . 50913 1 295 . 1 . 1 82 82 ALA CA C 13 52.079 0.3 . 1 . . . . . 82 ALA CA . 50913 1 296 . 1 . 1 82 82 ALA CB C 13 18.164 0.3 . 1 . . . . . 82 ALA CB . 50913 1 297 . 1 . 1 82 82 ALA N N 15 117.468 0.3 . 1 . . . . . 82 ALA N . 50913 1 298 . 1 . 1 83 83 GLN H H 1 7.592 0.020 . 1 . . . . . 83 GLN H . 50913 1 299 . 1 . 1 83 83 GLN CA C 13 55.605 0.3 . 1 . . . . . 83 GLN CA . 50913 1 300 . 1 . 1 83 83 GLN CB C 13 25.480 0.3 . 1 . . . . . 83 GLN CB . 50913 1 301 . 1 . 1 83 83 GLN N N 15 111.967 0.3 . 1 . . . . . 83 GLN N . 50913 1 302 . 1 . 1 84 84 ARG H H 1 7.180 0.020 . 1 . . . . . 84 ARG H . 50913 1 303 . 1 . 1 84 84 ARG CA C 13 54.598 0.3 . 1 . . . . . 84 ARG CA . 50913 1 304 . 1 . 1 84 84 ARG CB C 13 33.472 0.3 . 1 . . . . . 84 ARG CB . 50913 1 305 . 1 . 1 84 84 ARG N N 15 118.154 0.3 . 1 . . . . . 84 ARG N . 50913 1 306 . 1 . 1 85 85 SER H H 1 7.730 0.020 . 1 . . . . . 85 SER H . 50913 1 307 . 1 . 1 85 85 SER CA C 13 56.060 0.3 . 1 . . . . . 85 SER CA . 50913 1 308 . 1 . 1 85 85 SER CB C 13 65.440 0.3 . 1 . . . . . 85 SER CB . 50913 1 309 . 1 . 1 85 85 SER N N 15 119.497 0.3 . 1 . . . . . 85 SER N . 50913 1 310 . 1 . 1 86 86 TYR H H 1 8.519 0.020 . 1 . . . . . 86 TYR H . 50913 1 311 . 1 . 1 86 86 TYR CA C 13 54.835 0.3 . 1 . . . . . 86 TYR CA . 50913 1 312 . 1 . 1 86 86 TYR CB C 13 42.447 0.3 . 1 . . . . . 86 TYR CB . 50913 1 313 . 1 . 1 86 86 TYR N N 15 117.599 0.3 . 1 . . . . . 86 TYR N . 50913 1 314 . 1 . 1 87 87 ILE H H 1 9.059 0.020 . 1 . . . . . 87 ILE H . 50913 1 315 . 1 . 1 87 87 ILE CA C 13 59.940 0.3 . 1 . . . . . 87 ILE CA . 50913 1 316 . 1 . 1 87 87 ILE CB C 13 38.943 0.3 . 1 . . . . . 87 ILE CB . 50913 1 317 . 1 . 1 87 87 ILE N N 15 122.284 0.3 . 1 . . . . . 87 ILE N . 50913 1 318 . 1 . 1 88 88 LEU H H 1 8.473 0.020 . 1 . . . . . 88 LEU H . 50913 1 319 . 1 . 1 88 88 LEU CA C 13 53.221 0.3 . 1 . . . . . 88 LEU CA . 50913 1 320 . 1 . 1 88 88 LEU CB C 13 42.878 0.3 . 1 . . . . . 88 LEU CB . 50913 1 321 . 1 . 1 88 88 LEU N N 15 128.689 0.3 . 1 . . . . . 88 LEU N . 50913 1 322 . 1 . 1 89 89 THR H H 1 8.248 0.020 . 1 . . . . . 89 THR H . 50913 1 323 . 1 . 1 89 89 THR CA C 13 57.319 0.3 . 1 . . . . . 89 THR CA . 50913 1 324 . 1 . 1 89 89 THR CB C 13 71.158 0.3 . 1 . . . . . 89 THR CB . 50913 1 325 . 1 . 1 89 89 THR N N 15 115.778 0.3 . 1 . . . . . 89 THR N . 50913 1 326 . 1 . 1 90 90 GLN H H 1 6.407 0.020 . 1 . . . . . 90 GLN H . 50913 1 327 . 1 . 1 90 90 GLN CA C 13 52.113 0.3 . 1 . . . . . 90 GLN CA . 50913 1 328 . 1 . 1 90 90 GLN CB C 13 27.816 0.3 . 1 . . . . . 90 GLN CB . 50913 1 329 . 1 . 1 90 90 GLN N N 15 116.848 0.3 . 1 . . . . . 90 GLN N . 50913 1 330 . 1 . 1 91 91 GLY H H 1 8.741 0.020 . 1 . . . . . 91 GLY H . 50913 1 331 . 1 . 1 91 91 GLY CA C 13 44.549 0.3 . 1 . . . . . 91 GLY CA . 50913 1 332 . 1 . 1 91 91 GLY N N 15 112.721 0.3 . 1 . . . . . 91 GLY N . 50913 1 333 . 1 . 1 92 92 PRO CA C 13 63.407 0.3 . 1 . . . . . 92 PRO CA . 50913 1 334 . 1 . 1 92 92 PRO CB C 13 31.197 0.3 . 1 . . . . . 92 PRO CB . 50913 1 335 . 1 . 1 93 93 LEU H H 1 7.929 0.020 . 1 . . . . . 93 LEU H . 50913 1 336 . 1 . 1 93 93 LEU CA C 13 52.876 0.3 . 1 . . . . . 93 LEU CA . 50913 1 337 . 1 . 1 93 93 LEU CB C 13 41.279 0.3 . 1 . . . . . 93 LEU CB . 50913 1 338 . 1 . 1 93 93 LEU N N 15 124.028 0.3 . 1 . . . . . 93 LEU N . 50913 1 339 . 1 . 1 94 94 PRO CA C 13 66.055 0.3 . 1 . . . . . 94 PRO CA . 50913 1 340 . 1 . 1 94 94 PRO CB C 13 30.644 0.3 . 1 . . . . . 94 PRO CB . 50913 1 341 . 1 . 1 95 95 ASN H H 1 8.514 0.020 . 1 . . . . . 95 ASN H . 50913 1 342 . 1 . 1 95 95 ASN CA C 13 53.636 0.3 . 1 . . . . . 95 ASN CA . 50913 1 343 . 1 . 1 95 95 ASN CB C 13 36.329 0.3 . 1 . . . . . 95 ASN CB . 50913 1 344 . 1 . 1 95 95 ASN N N 15 106.885 0.3 . 1 . . . . . 95 ASN N . 50913 1 345 . 1 . 1 96 96 THR H H 1 8.012 0.020 . 1 . . . . . 96 THR H . 50913 1 346 . 1 . 1 96 96 THR CA C 13 60.258 0.3 . 1 . . . . . 96 THR CA . 50913 1 347 . 1 . 1 96 96 THR CB C 13 69.006 0.3 . 1 . . . . . 96 THR CB . 50913 1 348 . 1 . 1 96 96 THR N N 15 111.722 0.3 . 1 . . . . . 96 THR N . 50913 1 349 . 1 . 1 97 97 CYS H H 1 7.505 0.020 . 1 . . . . . 97 CYS H . 50913 1 350 . 1 . 1 97 97 CYS CA C 13 63.652 0.3 . 1 . . . . . 97 CYS CA . 50913 1 351 . 1 . 1 97 97 CYS CB C 13 27.693 0.3 . 1 . . . . . 97 CYS CB . 50913 1 352 . 1 . 1 97 97 CYS N N 15 121.519 0.3 . 1 . . . . . 97 CYS N . 50913 1 353 . 1 . 1 98 98 GLY H H 1 8.198 0.020 . 1 . . . . . 98 GLY H . 50913 1 354 . 1 . 1 98 98 GLY CA C 13 47.138 0.3 . 1 . . . . . 98 GLY CA . 50913 1 355 . 1 . 1 98 98 GLY N N 15 108.689 0.3 . 1 . . . . . 98 GLY N . 50913 1 356 . 1 . 1 99 99 HIS H H 1 7.360 0.020 . 1 . . . . . 99 HIS H . 50913 1 357 . 1 . 1 99 99 HIS CA C 13 56.280 0.3 . 1 . . . . . 99 HIS CA . 50913 1 358 . 1 . 1 99 99 HIS CB C 13 31.443 0.3 . 1 . . . . . 99 HIS CB . 50913 1 359 . 1 . 1 99 99 HIS N N 15 123.656 0.3 . 1 . . . . . 99 HIS N . 50913 1 360 . 1 . 1 100 100 PHE H H 1 8.116 0.020 . 1 . . . . . 100 PHE H . 50913 1 361 . 1 . 1 100 100 PHE CA C 13 61.517 0.3 . 1 . . . . . 100 PHE CA . 50913 1 362 . 1 . 1 100 100 PHE CB C 13 37.468 0.3 . 1 . . . . . 100 PHE CB . 50913 1 363 . 1 . 1 100 100 PHE N N 15 119.412 0.3 . 1 . . . . . 100 PHE N . 50913 1 364 . 1 . 1 108 108 LYS CA C 13 57.202 0.3 . 1 . . . . . 108 LYS CA . 50913 1 365 . 1 . 1 109 109 SER H H 1 7.447 0.020 . 1 . . . . . 109 SER H . 50913 1 366 . 1 . 1 109 109 SER CA C 13 61.330 0.3 . 1 . . . . . 109 SER CA . 50913 1 367 . 1 . 1 109 109 SER CB C 13 62.981 0.3 . 1 . . . . . 109 SER CB . 50913 1 368 . 1 . 1 109 109 SER N N 15 118.769 0.3 . 1 . . . . . 109 SER N . 50913 1 369 . 1 . 1 110 110 ARG H H 1 9.571 0.020 . 1 . . . . . 110 ARG H . 50913 1 370 . 1 . 1 110 110 ARG CA C 13 54.415 0.3 . 1 . . . . . 110 ARG CA . 50913 1 371 . 1 . 1 110 110 ARG CB C 13 31.689 0.3 . 1 . . . . . 110 ARG CB . 50913 1 372 . 1 . 1 110 110 ARG N N 15 123.328 0.3 . 1 . . . . . 110 ARG N . 50913 1 373 . 1 . 1 111 111 GLY H H 1 7.303 0.020 . 1 . . . . . 111 GLY H . 50913 1 374 . 1 . 1 111 111 GLY CA C 13 43.554 0.3 . 1 . . . . . 111 GLY CA . 50913 1 375 . 1 . 1 111 111 GLY N N 15 103.816 0.3 . 1 . . . . . 111 GLY N . 50913 1 376 . 1 . 1 112 112 VAL H H 1 8.785 0.020 . 1 . . . . . 112 VAL H . 50913 1 377 . 1 . 1 112 112 VAL CA C 13 60.583 0.3 . 1 . . . . . 112 VAL CA . 50913 1 378 . 1 . 1 112 112 VAL CB C 13 32.181 0.3 . 1 . . . . . 112 VAL CB . 50913 1 379 . 1 . 1 112 112 VAL N N 15 121.837 0.3 . 1 . . . . . 112 VAL N . 50913 1 380 . 1 . 1 113 113 VAL H H 1 9.799 0.020 . 1 . . . . . 113 VAL H . 50913 1 381 . 1 . 1 113 113 VAL CA C 13 57.756 0.3 . 1 . . . . . 113 VAL CA . 50913 1 382 . 1 . 1 113 113 VAL CB C 13 32.243 0.3 . 1 . . . . . 113 VAL CB . 50913 1 383 . 1 . 1 113 113 VAL N N 15 129.171 0.3 . 1 . . . . . 113 VAL N . 50913 1 384 . 1 . 1 114 114 MET H H 1 7.564 0.020 . 1 . . . . . 114 MET H . 50913 1 385 . 1 . 1 114 114 MET CA C 13 53.698 0.3 . 1 . . . . . 114 MET CA . 50913 1 386 . 1 . 1 114 114 MET CB C 13 33.287 0.3 . 1 . . . . . 114 MET CB . 50913 1 387 . 1 . 1 114 114 MET N N 15 116.685 0.3 . 1 . . . . . 114 MET N . 50913 1 388 . 1 . 1 115 115 LEU H H 1 7.788 0.020 . 1 . . . . . 115 LEU H . 50913 1 389 . 1 . 1 115 115 LEU CA C 13 53.859 0.3 . 1 . . . . . 115 LEU CA . 50913 1 390 . 1 . 1 115 115 LEU CB C 13 41.956 0.3 . 1 . . . . . 115 LEU CB . 50913 1 391 . 1 . 1 115 115 LEU N N 15 124.712 0.3 . 1 . . . . . 115 LEU N . 50913 1 392 . 1 . 1 116 116 ASN H H 1 7.379 0.020 . 1 . . . . . 116 ASN H . 50913 1 393 . 1 . 1 116 116 ASN CA C 13 51.362 0.3 . 1 . . . . . 116 ASN CA . 50913 1 394 . 1 . 1 116 116 ASN CB C 13 40.911 0.3 . 1 . . . . . 116 ASN CB . 50913 1 395 . 1 . 1 116 116 ASN N N 15 114.580 0.3 . 1 . . . . . 116 ASN N . 50913 1 396 . 1 . 1 117 117 ARG CA C 13 54.928 0.3 . 1 . . . . . 117 ARG CA . 50913 1 397 . 1 . 1 117 117 ARG CB C 13 31.013 0.3 . 1 . . . . . 117 ARG CB . 50913 1 398 . 1 . 1 118 118 VAL H H 1 8.831 0.020 . 1 . . . . . 118 VAL H . 50913 1 399 . 1 . 1 118 118 VAL CA C 13 66.608 0.3 . 1 . . . . . 118 VAL CA . 50913 1 400 . 1 . 1 118 118 VAL CB C 13 31.504 0.3 . 1 . . . . . 118 VAL CB . 50913 1 401 . 1 . 1 118 118 VAL N N 15 121.457 0.3 . 1 . . . . . 118 VAL N . 50913 1 402 . 1 . 1 122 122 GLY H H 1 8.479 0.020 . 1 . . . . . 122 GLY H . 50913 1 403 . 1 . 1 122 122 GLY CA C 13 45.131 0.3 . 1 . . . . . 122 GLY CA . 50913 1 404 . 1 . 1 122 122 GLY N N 15 105.822 0.3 . 1 . . . . . 122 GLY N . 50913 1 405 . 1 . 1 123 123 SER H H 1 7.830 0.020 . 1 . . . . . 123 SER H . 50913 1 406 . 1 . 1 123 123 SER CA C 13 56.715 0.3 . 1 . . . . . 123 SER CA . 50913 1 407 . 1 . 1 123 123 SER CB C 13 64.518 0.3 . 1 . . . . . 123 SER CB . 50913 1 408 . 1 . 1 123 123 SER N N 15 116.232 0.3 . 1 . . . . . 123 SER N . 50913 1 409 . 1 . 1 124 124 LEU H H 1 8.460 0.020 . 1 . . . . . 124 LEU H . 50913 1 410 . 1 . 1 124 124 LEU CA C 13 55.163 0.3 . 1 . . . . . 124 LEU CA . 50913 1 411 . 1 . 1 124 124 LEU CB C 13 41.582 0.3 . 1 . . . . . 124 LEU CB . 50913 1 412 . 1 . 1 124 124 LEU N N 15 126.191 0.3 . 1 . . . . . 124 LEU N . 50913 1 413 . 1 . 1 126 126 CYS CA C 13 58.226 0.3 . 1 . . . . . 126 CYS CA . 50913 1 414 . 1 . 1 126 126 CYS CB C 13 28.185 0.3 . 1 . . . . . 126 CYS CB . 50913 1 415 . 1 . 1 127 127 ALA H H 1 7.750 0.020 . 1 . . . . . 127 ALA H . 50913 1 416 . 1 . 1 127 127 ALA CA C 13 51.138 0.3 . 1 . . . . . 127 ALA CA . 50913 1 417 . 1 . 1 127 127 ALA CB C 13 17.856 0.3 . 1 . . . . . 127 ALA CB . 50913 1 418 . 1 . 1 127 127 ALA N N 15 124.735 0.3 . 1 . . . . . 127 ALA N . 50913 1 419 . 1 . 1 128 128 GLN H H 1 8.421 0.020 . 1 . . . . . 128 GLN H . 50913 1 420 . 1 . 1 128 128 GLN CA C 13 54.765 0.3 . 1 . . . . . 128 GLN CA . 50913 1 421 . 1 . 1 128 128 GLN CB C 13 25.787 0.3 . 1 . . . . . 128 GLN CB . 50913 1 422 . 1 . 1 128 128 GLN N N 15 121.028 0.3 . 1 . . . . . 128 GLN N . 50913 1 423 . 1 . 1 129 129 TYR H H 1 6.554 0.020 . 1 . . . . . 129 TYR H . 50913 1 424 . 1 . 1 129 129 TYR CA C 13 55.707 0.3 . 1 . . . . . 129 TYR CA . 50913 1 425 . 1 . 1 129 129 TYR CB C 13 37.222 0.3 . 1 . . . . . 129 TYR CB . 50913 1 426 . 1 . 1 129 129 TYR N N 15 122.849 0.3 . 1 . . . . . 129 TYR N . 50913 1 427 . 1 . 1 130 130 TRP H H 1 6.534 0.020 . 1 . . . . . 130 TRP H . 50913 1 428 . 1 . 1 130 130 TRP CA C 13 54.901 0.3 . 1 . . . . . 130 TRP CA . 50913 1 429 . 1 . 1 130 130 TRP CB C 13 29.599 0.3 . 1 . . . . . 130 TRP CB . 50913 1 430 . 1 . 1 130 130 TRP N N 15 120.958 0.3 . 1 . . . . . 130 TRP N . 50913 1 431 . 1 . 1 137 137 GLU CA C 13 54.318 0.3 . 1 . . . . . 137 GLU CA . 50913 1 432 . 1 . 1 137 137 GLU CB C 13 31.201 0.3 . 1 . . . . . 137 GLU CB . 50913 1 433 . 1 . 1 138 138 MET H H 1 8.790 0.020 . 1 . . . . . 138 MET H . 50913 1 434 . 1 . 1 138 138 MET CA C 13 55.012 0.3 . 1 . . . . . 138 MET CA . 50913 1 435 . 1 . 1 138 138 MET CB C 13 37.443 0.3 . 1 . . . . . 138 MET CB . 50913 1 436 . 1 . 1 138 138 MET N N 15 121.341 0.3 . 1 . . . . . 138 MET N . 50913 1 437 . 1 . 1 139 139 ILE H H 1 8.081 0.020 . 1 . . . . . 139 ILE H . 50913 1 438 . 1 . 1 139 139 ILE CA C 13 59.488 0.3 . 1 . . . . . 139 ILE CA . 50913 1 439 . 1 . 1 139 139 ILE CB C 13 38.736 0.3 . 1 . . . . . 139 ILE CB . 50913 1 440 . 1 . 1 139 139 ILE N N 15 122.227 0.3 . 1 . . . . . 139 ILE N . 50913 1 441 . 1 . 1 140 140 PHE H H 1 8.827 0.020 . 1 . . . . . 140 PHE H . 50913 1 442 . 1 . 1 140 140 PHE CA C 13 56.144 0.3 . 1 . . . . . 140 PHE CA . 50913 1 443 . 1 . 1 140 140 PHE CB C 13 36.976 0.3 . 1 . . . . . 140 PHE CB . 50913 1 444 . 1 . 1 140 140 PHE N N 15 127.915 0.3 . 1 . . . . . 140 PHE N . 50913 1 445 . 1 . 1 141 141 GLU H H 1 8.897 0.020 . 1 . . . . . 141 GLU H . 50913 1 446 . 1 . 1 141 141 GLU CA C 13 58.562 0.3 . 1 . . . . . 141 GLU CA . 50913 1 447 . 1 . 1 141 141 GLU CB C 13 28.799 0.3 . 1 . . . . . 141 GLU CB . 50913 1 448 . 1 . 1 141 141 GLU N N 15 124.303 0.3 . 1 . . . . . 141 GLU N . 50913 1 449 . 1 . 1 142 142 ASP H H 1 9.013 0.020 . 1 . . . . . 142 ASP H . 50913 1 450 . 1 . 1 142 142 ASP CA C 13 55.220 0.3 . 1 . . . . . 142 ASP CA . 50913 1 451 . 1 . 1 142 142 ASP CB C 13 37.775 0.3 . 1 . . . . . 142 ASP CB . 50913 1 452 . 1 . 1 142 142 ASP N N 15 116.474 0.3 . 1 . . . . . 142 ASP N . 50913 1 453 . 1 . 1 143 143 THR H H 1 7.392 0.020 . 1 . . . . . 143 THR H . 50913 1 454 . 1 . 1 143 143 THR CA C 13 59.978 0.3 . 1 . . . . . 143 THR CA . 50913 1 455 . 1 . 1 143 143 THR CB C 13 68.237 0.3 . 1 . . . . . 143 THR CB . 50913 1 456 . 1 . 1 143 143 THR N N 15 108.225 0.3 . 1 . . . . . 143 THR N . 50913 1 457 . 1 . 1 144 144 ASN H H 1 7.899 0.020 . 1 . . . . . 144 ASN H . 50913 1 458 . 1 . 1 144 144 ASN CA C 13 53.296 0.3 . 1 . . . . . 144 ASN CA . 50913 1 459 . 1 . 1 144 144 ASN CB C 13 37.160 0.3 . 1 . . . . . 144 ASN CB . 50913 1 460 . 1 . 1 144 144 ASN N N 15 120.913 0.3 . 1 . . . . . 144 ASN N . 50913 1 461 . 1 . 1 145 145 LEU H H 1 7.360 0.020 . 1 . . . . . 145 LEU H . 50913 1 462 . 1 . 1 145 145 LEU CA C 13 53.087 0.3 . 1 . . . . . 145 LEU CA . 50913 1 463 . 1 . 1 145 145 LEU CB C 13 45.583 0.3 . 1 . . . . . 145 LEU CB . 50913 1 464 . 1 . 1 145 145 LEU N N 15 117.160 0.3 . 1 . . . . . 145 LEU N . 50913 1 465 . 1 . 1 146 146 LYS H H 1 8.934 0.020 . 1 . . . . . 146 LYS H . 50913 1 466 . 1 . 1 146 146 LYS CA C 13 53.736 0.3 . 1 . . . . . 146 LYS CA . 50913 1 467 . 1 . 1 146 146 LYS CB C 13 35.972 0.3 . 1 . . . . . 146 LYS CB . 50913 1 468 . 1 . 1 146 146 LYS N N 15 122.210 0.3 . 1 . . . . . 146 LYS N . 50913 1 469 . 1 . 1 147 147 LEU H H 1 9.072 0.020 . 1 . . . . . 147 LEU H . 50913 1 470 . 1 . 1 147 147 LEU CA C 13 52.113 0.3 . 1 . . . . . 147 LEU CA . 50913 1 471 . 1 . 1 147 147 LEU CB C 13 47.489 0.3 . 1 . . . . . 147 LEU CB . 50913 1 472 . 1 . 1 147 147 LEU N N 15 129.656 0.3 . 1 . . . . . 147 LEU N . 50913 1 473 . 1 . 1 148 148 THR CA C 13 61.015 0.3 . 1 . . . . . 148 THR CA . 50913 1 474 . 1 . 1 148 148 THR CB C 13 70.543 0.3 . 1 . . . . . 148 THR CB . 50913 1 475 . 1 . 1 149 149 LEU H H 1 8.893 0.020 . 1 . . . . . 149 LEU H . 50913 1 476 . 1 . 1 149 149 LEU CA C 13 54.834 0.3 . 1 . . . . . 149 LEU CA . 50913 1 477 . 1 . 1 149 149 LEU CB C 13 41.710 0.3 . 1 . . . . . 149 LEU CB . 50913 1 478 . 1 . 1 149 149 LEU N N 15 128.036 0.3 . 1 . . . . . 149 LEU N . 50913 1 479 . 1 . 1 150 150 ILE H H 1 8.803 0.020 . 1 . . . . . 150 ILE H . 50913 1 480 . 1 . 1 150 150 ILE CA C 13 60.712 0.3 . 1 . . . . . 150 ILE CA . 50913 1 481 . 1 . 1 150 150 ILE CB C 13 35.931 0.3 . 1 . . . . . 150 ILE CB . 50913 1 482 . 1 . 1 150 150 ILE N N 15 129.848 0.3 . 1 . . . . . 150 ILE N . 50913 1 483 . 1 . 1 151 151 SER H H 1 7.735 0.020 . 1 . . . . . 151 SER H . 50913 1 484 . 1 . 1 151 151 SER CA C 13 57.284 0.3 . 1 . . . . . 151 SER CA . 50913 1 485 . 1 . 1 151 151 SER CB C 13 64.764 0.3 . 1 . . . . . 151 SER CB . 50913 1 486 . 1 . 1 151 151 SER N N 15 111.105 0.3 . 1 . . . . . 151 SER N . 50913 1 487 . 1 . 1 152 152 GLU H H 1 8.550 0.020 . 1 . . . . . 152 GLU H . 50913 1 488 . 1 . 1 152 152 GLU CA C 13 55.360 0.3 . 1 . . . . . 152 GLU CA . 50913 1 489 . 1 . 1 152 152 GLU CB C 13 33.410 0.3 . 1 . . . . . 152 GLU CB . 50913 1 490 . 1 . 1 152 152 GLU N N 15 120.470 0.3 . 1 . . . . . 152 GLU N . 50913 1 491 . 1 . 1 153 153 ASP H H 1 8.777 0.020 . 1 . . . . . 153 ASP H . 50913 1 492 . 1 . 1 153 153 ASP CA C 13 52.617 0.3 . 1 . . . . . 153 ASP CA . 50913 1 493 . 1 . 1 153 153 ASP CB C 13 41.402 0.3 . 1 . . . . . 153 ASP CB . 50913 1 494 . 1 . 1 153 153 ASP N N 15 126.939 0.3 . 1 . . . . . 153 ASP N . 50913 1 495 . 1 . 1 154 154 ILE H H 1 8.445 0.020 . 1 . . . . . 154 ILE H . 50913 1 496 . 1 . 1 154 154 ILE CA C 13 61.821 0.3 . 1 . . . . . 154 ILE CA . 50913 1 497 . 1 . 1 154 154 ILE CB C 13 38.083 0.3 . 1 . . . . . 154 ILE CB . 50913 1 498 . 1 . 1 154 154 ILE N N 15 127.096 0.3 . 1 . . . . . 154 ILE N . 50913 1 499 . 1 . 1 155 155 LYS H H 1 8.070 0.020 . 1 . . . . . 155 LYS H . 50913 1 500 . 1 . 1 155 155 LYS CA C 13 53.322 0.3 . 1 . . . . . 155 LYS CA . 50913 1 501 . 1 . 1 155 155 LYS CB C 13 32.242 0.3 . 1 . . . . . 155 LYS CB . 50913 1 502 . 1 . 1 155 155 LYS N N 15 128.843 0.3 . 1 . . . . . 155 LYS N . 50913 1 503 . 1 . 1 157 157 TYR H H 1 7.038 0.020 . 1 . . . . . 157 TYR H . 50913 1 504 . 1 . 1 157 157 TYR CA C 13 54.961 0.3 . 1 . . . . . 157 TYR CA . 50913 1 505 . 1 . 1 157 157 TYR CB C 13 40.788 0.3 . 1 . . . . . 157 TYR CB . 50913 1 506 . 1 . 1 157 157 TYR N N 15 112.810 0.3 . 1 . . . . . 157 TYR N . 50913 1 507 . 1 . 1 158 158 TYR H H 1 6.497 0.020 . 1 . . . . . 158 TYR H . 50913 1 508 . 1 . 1 158 158 TYR CA C 13 55.405 0.3 . 1 . . . . . 158 TYR CA . 50913 1 509 . 1 . 1 158 158 TYR CB C 13 40.296 0.3 . 1 . . . . . 158 TYR CB . 50913 1 510 . 1 . 1 158 158 TYR N N 15 113.600 0.3 . 1 . . . . . 158 TYR N . 50913 1 511 . 1 . 1 159 159 THR H H 1 9.363 0.020 . 1 . . . . . 159 THR H . 50913 1 512 . 1 . 1 159 159 THR CA C 13 60.643 0.3 . 1 . . . . . 159 THR CA . 50913 1 513 . 1 . 1 159 159 THR CB C 13 73.064 0.3 . 1 . . . . . 159 THR CB . 50913 1 514 . 1 . 1 159 159 THR N N 15 117.569 0.3 . 1 . . . . . 159 THR N . 50913 1 515 . 1 . 1 160 160 VAL H H 1 8.644 0.020 . 1 . . . . . 160 VAL H . 50913 1 516 . 1 . 1 160 160 VAL CA C 13 59.671 0.3 . 1 . . . . . 160 VAL CA . 50913 1 517 . 1 . 1 160 160 VAL CB C 13 33.410 0.3 . 1 . . . . . 160 VAL CB . 50913 1 518 . 1 . 1 160 160 VAL N N 15 126.346 0.3 . 1 . . . . . 160 VAL N . 50913 1 519 . 1 . 1 166 166 GLU CA C 13 53.051 0.3 . 1 . . . . . 166 GLU CA . 50913 1 520 . 1 . 1 166 166 GLU CB C 13 32.680 0.3 . 1 . . . . . 166 GLU CB . 50913 1 521 . 1 . 1 167 167 ASN H H 1 8.133 0.020 . 1 . . . . . 167 ASN H . 50913 1 522 . 1 . 1 167 167 ASN CA C 13 51.336 0.3 . 1 . . . . . 167 ASN CA . 50913 1 523 . 1 . 1 167 167 ASN CB C 13 37.222 0.3 . 1 . . . . . 167 ASN CB . 50913 1 524 . 1 . 1 167 167 ASN N N 15 124.461 0.3 . 1 . . . . . 167 ASN N . 50913 1 525 . 1 . 1 168 168 LEU H H 1 8.193 0.020 . 1 . . . . . 168 LEU H . 50913 1 526 . 1 . 1 168 168 LEU CA C 13 56.312 0.3 . 1 . . . . . 168 LEU CA . 50913 1 527 . 1 . 1 168 168 LEU CB C 13 39.747 0.3 . 1 . . . . . 168 LEU CB . 50913 1 528 . 1 . 1 168 168 LEU N N 15 125.908 0.3 . 1 . . . . . 168 LEU N . 50913 1 529 . 1 . 1 169 169 THR H H 1 8.164 0.020 . 1 . . . . . 169 THR H . 50913 1 530 . 1 . 1 169 169 THR CA C 13 64.701 0.3 . 1 . . . . . 169 THR CA . 50913 1 531 . 1 . 1 169 169 THR CB C 13 67.899 0.3 . 1 . . . . . 169 THR CB . 50913 1 532 . 1 . 1 169 169 THR N N 15 114.989 0.3 . 1 . . . . . 169 THR N . 50913 1 533 . 1 . 1 170 170 THR H H 1 6.980 0.020 . 1 . . . . . 170 THR H . 50913 1 534 . 1 . 1 170 170 THR CA C 13 61.237 0.3 . 1 . . . . . 170 THR CA . 50913 1 535 . 1 . 1 170 170 THR CB C 13 69.614 0.3 . 1 . . . . . 170 THR CB . 50913 1 536 . 1 . 1 170 170 THR N N 15 109.440 0.3 . 1 . . . . . 170 THR N . 50913 1 537 . 1 . 1 171 171 GLN H H 1 8.306 0.020 . 1 . . . . . 171 GLN H . 50913 1 538 . 1 . 1 171 171 GLN CA C 13 57.494 0.3 . 1 . . . . . 171 GLN CA . 50913 1 539 . 1 . 1 171 171 GLN CB C 13 25.306 0.3 . 1 . . . . . 171 GLN CB . 50913 1 540 . 1 . 1 171 171 GLN N N 15 116.716 0.3 . 1 . . . . . 171 GLN N . 50913 1 541 . 1 . 1 172 172 GLU H H 1 7.375 0.020 . 1 . . . . . 172 GLU H . 50913 1 542 . 1 . 1 172 172 GLU CA C 13 55.774 0.3 . 1 . . . . . 172 GLU CA . 50913 1 543 . 1 . 1 172 172 GLU CB C 13 32.488 0.3 . 1 . . . . . 172 GLU CB . 50913 1 544 . 1 . 1 172 172 GLU N N 15 119.595 0.3 . 1 . . . . . 172 GLU N . 50913 1 545 . 1 . 1 173 173 THR H H 1 8.373 0.020 . 1 . . . . . 173 THR H . 50913 1 546 . 1 . 1 173 173 THR CA C 13 59.628 0.3 . 1 . . . . . 173 THR CA . 50913 1 547 . 1 . 1 173 173 THR CB C 13 71.527 0.3 . 1 . . . . . 173 THR CB . 50913 1 548 . 1 . 1 173 173 THR N N 15 113.563 0.3 . 1 . . . . . 173 THR N . 50913 1 549 . 1 . 1 174 174 ARG H H 1 9.243 0.020 . 1 . . . . . 174 ARG H . 50913 1 550 . 1 . 1 174 174 ARG CA C 13 54.763 0.3 . 1 . . . . . 174 ARG CA . 50913 1 551 . 1 . 1 174 174 ARG CB C 13 34.517 0.3 . 1 . . . . . 174 ARG CB . 50913 1 552 . 1 . 1 174 174 ARG N N 15 122.459 0.3 . 1 . . . . . 174 ARG N . 50913 1 553 . 1 . 1 175 175 GLU H H 1 8.362 0.020 . 1 . . . . . 175 GLU H . 50913 1 554 . 1 . 1 175 175 GLU CA C 13 55.207 0.3 . 1 . . . . . 175 GLU CA . 50913 1 555 . 1 . 1 175 175 GLU CB C 13 30.213 0.3 . 1 . . . . . 175 GLU CB . 50913 1 556 . 1 . 1 175 175 GLU N N 15 123.532 0.3 . 1 . . . . . 175 GLU N . 50913 1 557 . 1 . 1 177 177 LEU H H 1 8.724 0.020 . 1 . . . . . 177 LEU H . 50913 1 558 . 1 . 1 177 177 LEU CA C 13 56.488 0.3 . 1 . . . . . 177 LEU CA . 50913 1 559 . 1 . 1 177 177 LEU CB C 13 39.865 0.3 . 1 . . . . . 177 LEU CB . 50913 1 560 . 1 . 1 177 177 LEU N N 15 119.512 0.3 . 1 . . . . . 177 LEU N . 50913 1 561 . 1 . 1 178 178 HIS H H 1 8.074 0.020 . 1 . . . . . 178 HIS H . 50913 1 562 . 1 . 1 178 178 HIS CA C 13 58.110 0.3 . 1 . . . . . 178 HIS CA . 50913 1 563 . 1 . 1 178 178 HIS CB C 13 40.300 0.3 . 1 . . . . . 178 HIS CB . 50913 1 564 . 1 . 1 178 178 HIS N N 15 117.741 0.3 . 1 . . . . . 178 HIS N . 50913 1 565 . 1 . 1 179 179 PHE H H 1 8.646 0.020 . 1 . . . . . 179 PHE H . 50913 1 566 . 1 . 1 179 179 PHE CA C 13 60.645 0.3 . 1 . . . . . 179 PHE CA . 50913 1 567 . 1 . 1 179 179 PHE CB C 13 35.931 0.3 . 1 . . . . . 179 PHE CB . 50913 1 568 . 1 . 1 179 179 PHE N N 15 117.749 0.3 . 1 . . . . . 179 PHE N . 50913 1 569 . 1 . 1 180 180 HIS H H 1 7.833 0.020 . 1 . . . . . 180 HIS H . 50913 1 570 . 1 . 1 180 180 HIS CA C 13 58.025 0.3 . 1 . . . . . 180 HIS CA . 50913 1 571 . 1 . 1 180 180 HIS CB C 13 29.326 0.3 . 1 . . . . . 180 HIS CB . 50913 1 572 . 1 . 1 180 180 HIS N N 15 123.434 0.3 . 1 . . . . . 180 HIS N . 50913 1 573 . 1 . 1 181 181 TYR H H 1 8.923 0.020 . 1 . . . . . 181 TYR H . 50913 1 574 . 1 . 1 181 181 TYR CA C 13 58.122 0.3 . 1 . . . . . 181 TYR CA . 50913 1 575 . 1 . 1 181 181 TYR CB C 13 38.018 0.3 . 1 . . . . . 181 TYR CB . 50913 1 576 . 1 . 1 181 181 TYR N N 15 130.802 0.3 . 1 . . . . . 181 TYR N . 50913 1 577 . 1 . 1 182 182 THR H H 1 7.423 0.020 . 1 . . . . . 182 THR H . 50913 1 578 . 1 . 1 182 182 THR CA C 13 61.813 0.3 . 1 . . . . . 182 THR CA . 50913 1 579 . 1 . 1 182 182 THR CB C 13 68.266 0.3 . 1 . . . . . 182 THR CB . 50913 1 580 . 1 . 1 182 182 THR N N 15 115.661 0.3 . 1 . . . . . 182 THR N . 50913 1 581 . 1 . 1 183 183 THR H H 1 5.976 0.020 . 1 . . . . . 183 THR H . 50913 1 582 . 1 . 1 183 183 THR CA C 13 59.943 0.3 . 1 . . . . . 183 THR CA . 50913 1 583 . 1 . 1 183 183 THR CB C 13 67.961 0.3 . 1 . . . . . 183 THR CB . 50913 1 584 . 1 . 1 183 183 THR N N 15 107.292 0.3 . 1 . . . . . 183 THR N . 50913 1 585 . 1 . 1 184 184 TRP H H 1 8.847 0.020 . 1 . . . . . 184 TRP H . 50913 1 586 . 1 . 1 184 184 TRP CA C 13 55.841 0.3 . 1 . . . . . 184 TRP CA . 50913 1 587 . 1 . 1 184 184 TRP CB C 13 26.581 0.3 . 1 . . . . . 184 TRP CB . 50913 1 588 . 1 . 1 184 184 TRP N N 15 129.928 0.3 . 1 . . . . . 184 TRP N . 50913 1 589 . 1 . 1 186 186 ASP CA C 13 56.221 0.3 . 1 . . . . . 186 ASP CA . 50913 1 590 . 1 . 1 186 186 ASP CB C 13 39.833 0.3 . 1 . . . . . 186 ASP CB . 50913 1 591 . 1 . 1 187 187 PHE H H 1 7.531 0.020 . 1 . . . . . 187 PHE H . 50913 1 592 . 1 . 1 187 187 PHE CA C 13 56.911 0.3 . 1 . . . . . 187 PHE CA . 50913 1 593 . 1 . 1 187 187 PHE CB C 13 40.573 0.3 . 1 . . . . . 187 PHE CB . 50913 1 594 . 1 . 1 187 187 PHE N N 15 114.847 0.3 . 1 . . . . . 187 PHE N . 50913 1 595 . 1 . 1 188 188 GLY H H 1 8.254 0.020 . 1 . . . . . 188 GLY H . 50913 1 596 . 1 . 1 188 188 GLY CA C 13 44.560 0.3 . 1 . . . . . 188 GLY CA . 50913 1 597 . 1 . 1 188 188 GLY N N 15 109.950 0.3 . 1 . . . . . 188 GLY N . 50913 1 598 . 1 . 1 189 189 VAL H H 1 7.969 0.020 . 1 . . . . . 189 VAL H . 50913 1 599 . 1 . 1 189 189 VAL CA C 13 57.144 0.3 . 1 . . . . . 189 VAL CA . 50913 1 600 . 1 . 1 189 189 VAL CB C 13 30.213 0.3 . 1 . . . . . 189 VAL CB . 50913 1 601 . 1 . 1 189 189 VAL N N 15 114.036 0.3 . 1 . . . . . 189 VAL N . 50913 1 602 . 1 . 1 191 191 GLU CA C 13 58.129 0.3 . 1 . . . . . 191 GLU CA . 50913 1 603 . 1 . 1 192 192 SER H H 1 7.642 0.020 . 1 . . . . . 192 SER H . 50913 1 604 . 1 . 1 192 192 SER CA C 13 57.351 0.3 . 1 . . . . . 192 SER CA . 50913 1 605 . 1 . 1 192 192 SER CB C 13 64.029 0.3 . 1 . . . . . 192 SER CB . 50913 1 606 . 1 . 1 192 192 SER N N 15 110.941 0.3 . 1 . . . . . 192 SER N . 50913 1 607 . 1 . 1 193 193 PRO CA C 13 55.170 0.3 . 1 . . . . . 193 PRO CA . 50913 1 608 . 1 . 1 193 193 PRO CB C 13 31.566 0.3 . 1 . . . . . 193 PRO CB . 50913 1 609 . 1 . 1 194 194 ALA H H 1 8.489 0.020 . 1 . . . . . 194 ALA H . 50913 1 610 . 1 . 1 194 194 ALA CA C 13 52.617 0.3 . 1 . . . . . 194 ALA CA . 50913 1 611 . 1 . 1 194 194 ALA CB C 13 18.041 0.3 . 1 . . . . . 194 ALA CB . 50913 1 612 . 1 . 1 194 194 ALA N N 15 125.408 0.3 . 1 . . . . . 194 ALA N . 50913 1 613 . 1 . 1 195 195 SER H H 1 8.100 0.020 . 1 . . . . . 195 SER H . 50913 1 614 . 1 . 1 195 195 SER CA C 13 58.159 0.3 . 1 . . . . . 195 SER CA . 50913 1 615 . 1 . 1 195 195 SER CB C 13 62.797 0.3 . 1 . . . . . 195 SER CB . 50913 1 616 . 1 . 1 195 195 SER N N 15 114.228 0.3 . 1 . . . . . 195 SER N . 50913 1 617 . 1 . 1 201 201 PHE CA C 13 53.855 0.3 . 1 . . . . . 201 PHE CA . 50913 1 618 . 1 . 1 202 202 LYS H H 1 7.422 0.020 . 1 . . . . . 202 LYS H . 50913 1 619 . 1 . 1 202 202 LYS CA C 13 57.246 0.3 . 1 . . . . . 202 LYS CA . 50913 1 620 . 1 . 1 202 202 LYS CB C 13 28.049 0.3 . 1 . . . . . 202 LYS CB . 50913 1 621 . 1 . 1 202 202 LYS N N 15 113.025 0.3 . 1 . . . . . 202 LYS N . 50913 1 622 . 1 . 1 203 203 VAL H H 1 7.542 0.020 . 1 . . . . . 203 VAL H . 50913 1 623 . 1 . 1 203 203 VAL CA C 13 65.809 0.3 . 1 . . . . . 203 VAL CA . 50913 1 624 . 1 . 1 203 203 VAL CB C 13 29.329 0.3 . 1 . . . . . 203 VAL CB . 50913 1 625 . 1 . 1 203 203 VAL N N 15 121.116 0.3 . 1 . . . . . 203 VAL N . 50913 1 626 . 1 . 1 204 204 ARG H H 1 8.061 0.020 . 1 . . . . . 204 ARG H . 50913 1 627 . 1 . 1 204 204 ARG CA C 13 59.488 0.3 . 1 . . . . . 204 ARG CA . 50913 1 628 . 1 . 1 204 204 ARG CB C 13 29.922 0.3 . 1 . . . . . 204 ARG CB . 50913 1 629 . 1 . 1 204 204 ARG N N 15 120.635 0.3 . 1 . . . . . 204 ARG N . 50913 1 630 . 1 . 1 205 205 GLU H H 1 8.440 0.020 . 1 . . . . . 205 GLU H . 50913 1 631 . 1 . 1 205 205 GLU CA C 13 57.864 0.3 . 1 . . . . . 205 GLU CA . 50913 1 632 . 1 . 1 205 205 GLU CB C 13 29.052 0.3 . 1 . . . . . 205 GLU CB . 50913 1 633 . 1 . 1 205 205 GLU N N 15 120.134 0.3 . 1 . . . . . 205 GLU N . 50913 1 634 . 1 . 1 206 206 SER H H 1 7.364 0.020 . 1 . . . . . 206 SER H . 50913 1 635 . 1 . 1 206 206 SER CA C 13 59.803 0.3 . 1 . . . . . 206 SER CA . 50913 1 636 . 1 . 1 206 206 SER CB C 13 65.180 0.3 . 1 . . . . . 206 SER CB . 50913 1 637 . 1 . 1 206 206 SER N N 15 112.507 0.3 . 1 . . . . . 206 SER N . 50913 1 638 . 1 . 1 207 207 GLY H H 1 7.639 0.020 . 1 . . . . . 207 GLY H . 50913 1 639 . 1 . 1 207 207 GLY CA C 13 45.459 0.3 . 1 . . . . . 207 GLY CA . 50913 1 640 . 1 . 1 207 207 GLY N N 15 110.094 0.3 . 1 . . . . . 207 GLY N . 50913 1 641 . 1 . 1 208 208 SER H H 1 7.887 0.020 . 1 . . . . . 208 SER H . 50913 1 642 . 1 . 1 208 208 SER CA C 13 61.416 0.3 . 1 . . . . . 208 SER CA . 50913 1 643 . 1 . 1 208 208 SER CB C 13 63.411 0.3 . 1 . . . . . 208 SER CB . 50913 1 644 . 1 . 1 208 208 SER N N 15 114.903 0.3 . 1 . . . . . 208 SER N . 50913 1 645 . 1 . 1 209 209 ALA H H 1 8.321 0.020 . 1 . . . . . 209 ALA H . 50913 1 646 . 1 . 1 209 209 ALA CA C 13 49.622 0.3 . 1 . . . . . 209 ALA CA . 50913 1 647 . 1 . 1 209 209 ALA CB C 13 16.488 0.3 . 1 . . . . . 209 ALA CB . 50913 1 648 . 1 . 1 209 209 ALA N N 15 121.711 0.3 . 1 . . . . . 209 ALA N . 50913 1 649 . 1 . 1 210 210 SER H H 1 7.198 0.020 . 1 . . . . . 210 SER H . 50913 1 650 . 1 . 1 210 210 SER CA C 13 56.513 0.3 . 1 . . . . . 210 SER CA . 50913 1 651 . 1 . 1 210 210 SER CB C 13 62.920 0.3 . 1 . . . . . 210 SER CB . 50913 1 652 . 1 . 1 210 210 SER N N 15 116.395 0.3 . 1 . . . . . 210 SER N . 50913 1 653 . 1 . 1 211 211 PRO CA C 13 64.641 0.3 . 1 . . . . . 211 PRO CA . 50913 1 654 . 1 . 1 211 211 PRO CB C 13 30.512 0.3 . 1 . . . . . 211 PRO CB . 50913 1 655 . 1 . 1 212 212 GLU H H 1 8.139 0.020 . 1 . . . . . 212 GLU H . 50913 1 656 . 1 . 1 212 212 GLU CA C 13 56.864 0.3 . 1 . . . . . 212 GLU CA . 50913 1 657 . 1 . 1 212 212 GLU CB C 13 28.185 0.3 . 1 . . . . . 212 GLU CB . 50913 1 658 . 1 . 1 212 212 GLU N N 15 117.086 0.3 . 1 . . . . . 212 GLU N . 50913 1 659 . 1 . 1 213 213 HIS H H 1 7.445 0.020 . 1 . . . . . 213 HIS H . 50913 1 660 . 1 . 1 213 213 HIS CA C 13 53.658 0.3 . 1 . . . . . 213 HIS CA . 50913 1 661 . 1 . 1 213 213 HIS CB C 13 33.349 0.3 . 1 . . . . . 213 HIS CB . 50913 1 662 . 1 . 1 213 213 HIS N N 15 119.406 0.3 . 1 . . . . . 213 HIS N . 50913 1 663 . 1 . 1 214 214 GLY H H 1 7.274 0.020 . 1 . . . . . 214 GLY H . 50913 1 664 . 1 . 1 214 214 GLY CA C 13 45.515 0.3 . 1 . . . . . 214 GLY CA . 50913 1 665 . 1 . 1 214 214 GLY N N 15 104.483 0.3 . 1 . . . . . 214 GLY N . 50913 1 666 . 1 . 1 215 215 PRO CA C 13 62.322 0.3 . 1 . . . . . 215 PRO CA . 50913 1 667 . 1 . 1 215 215 PRO CB C 13 31.197 0.3 . 1 . . . . . 215 PRO CB . 50913 1 668 . 1 . 1 216 216 VAL H H 1 8.461 0.020 . 1 . . . . . 216 VAL H . 50913 1 669 . 1 . 1 216 216 VAL CA C 13 61.972 0.3 . 1 . . . . . 216 VAL CA . 50913 1 670 . 1 . 1 216 216 VAL CB C 13 31.627 0.3 . 1 . . . . . 216 VAL CB . 50913 1 671 . 1 . 1 216 216 VAL N N 15 124.549 0.3 . 1 . . . . . 216 VAL N . 50913 1 672 . 1 . 1 217 217 VAL H H 1 7.801 0.020 . 1 . . . . . 217 VAL H . 50913 1 673 . 1 . 1 217 217 VAL CA C 13 61.250 0.3 . 1 . . . . . 217 VAL CA . 50913 1 674 . 1 . 1 217 217 VAL CB C 13 31.689 0.3 . 1 . . . . . 217 VAL CB . 50913 1 675 . 1 . 1 217 217 VAL N N 15 127.790 0.3 . 1 . . . . . 217 VAL N . 50913 1 676 . 1 . 1 218 218 VAL H H 1 9.516 0.020 . 1 . . . . . 218 VAL H . 50913 1 677 . 1 . 1 218 218 VAL CA C 13 59.738 0.3 . 1 . . . . . 218 VAL CA . 50913 1 678 . 1 . 1 218 218 VAL CB C 13 33.287 0.3 . 1 . . . . . 218 VAL CB . 50913 1 679 . 1 . 1 218 218 VAL N N 15 128.971 0.3 . 1 . . . . . 218 VAL N . 50913 1 680 . 1 . 1 219 219 HIS H H 1 9.115 0.020 . 1 . . . . . 219 HIS H . 50913 1 681 . 1 . 1 219 219 HIS CA C 13 54.901 0.3 . 1 . . . . . 219 HIS CA . 50913 1 682 . 1 . 1 219 219 HIS CB C 13 34.271 0.3 . 1 . . . . . 219 HIS CB . 50913 1 683 . 1 . 1 219 219 HIS N N 15 121.937 0.3 . 1 . . . . . 219 HIS N . 50913 1 684 . 1 . 1 220 220 CYS H H 1 5.968 0.020 . 1 . . . . . 220 CYS H . 50913 1 685 . 1 . 1 220 220 CYS CA C 13 56.895 0.3 . 1 . . . . . 220 CYS CA . 50913 1 686 . 1 . 1 220 220 CYS CB C 13 28.369 0.3 . 1 . . . . . 220 CYS CB . 50913 1 687 . 1 . 1 220 220 CYS N N 15 120.021 0.3 . 1 . . . . . 220 CYS N . 50913 1 688 . 1 . 1 222 222 ALA CA C 13 51.848 0.3 . 1 . . . . . 222 ALA CA . 50913 1 689 . 1 . 1 222 222 ALA CB C 13 18.428 0.3 . 1 . . . . . 222 ALA CB . 50913 1 690 . 1 . 1 223 223 GLY H H 1 8.762 0.020 . 1 . . . . . 223 GLY H . 50913 1 691 . 1 . 1 223 223 GLY CA C 13 47.222 0.3 . 1 . . . . . 223 GLY CA . 50913 1 692 . 1 . 1 223 223 GLY N N 15 111.984 0.3 . 1 . . . . . 223 GLY N . 50913 1 693 . 1 . 1 224 224 ILE H H 1 7.192 0.020 . 1 . . . . . 224 ILE H . 50913 1 694 . 1 . 1 224 224 ILE CA C 13 61.237 0.3 . 1 . . . . . 224 ILE CA . 50913 1 695 . 1 . 1 224 224 ILE N N 15 108.037 0.3 . 1 . . . . . 224 ILE N . 50913 1 696 . 1 . 1 227 227 SER CA C 13 62.551 0.3 . 1 . . . . . 227 SER CA . 50913 1 697 . 1 . 1 227 227 SER CB C 13 60.768 0.3 . 1 . . . . . 227 SER CB . 50913 1 698 . 1 . 1 228 228 GLY H H 1 6.266 0.020 . 1 . . . . . 228 GLY H . 50913 1 699 . 1 . 1 228 228 GLY CA C 13 46.935 0.3 . 1 . . . . . 228 GLY CA . 50913 1 700 . 1 . 1 228 228 GLY N N 15 106.720 0.3 . 1 . . . . . 228 GLY N . 50913 1 701 . 1 . 1 229 229 THR H H 1 7.715 0.020 . 1 . . . . . 229 THR H . 50913 1 702 . 1 . 1 229 229 THR CA C 13 66.190 0.3 . 1 . . . . . 229 THR CA . 50913 1 703 . 1 . 1 229 229 THR CB C 13 68.274 0.3 . 1 . . . . . 229 THR CB . 50913 1 704 . 1 . 1 229 229 THR N N 15 117.909 0.3 . 1 . . . . . 229 THR N . 50913 1 705 . 1 . 1 230 230 PHE H H 1 7.599 0.020 . 1 . . . . . 230 PHE H . 50913 1 706 . 1 . 1 230 230 PHE CA C 13 61.887 0.3 . 1 . . . . . 230 PHE CA . 50913 1 707 . 1 . 1 230 230 PHE CB C 13 39.681 0.3 . 1 . . . . . 230 PHE CB . 50913 1 708 . 1 . 1 230 230 PHE N N 15 120.228 0.3 . 1 . . . . . 230 PHE N . 50913 1 709 . 1 . 1 231 231 CYS H H 1 7.533 0.020 . 1 . . . . . 231 CYS H . 50913 1 710 . 1 . 1 231 231 CYS CA C 13 62.366 0.3 . 1 . . . . . 231 CYS CA . 50913 1 711 . 1 . 1 231 231 CYS CB C 13 26.156 0.3 . 1 . . . . . 231 CYS CB . 50913 1 712 . 1 . 1 231 231 CYS N N 15 115.568 0.3 . 1 . . . . . 231 CYS N . 50913 1 713 . 1 . 1 232 232 LEU H H 1 8.497 0.020 . 1 . . . . . 232 LEU H . 50913 1 714 . 1 . 1 232 232 LEU CA C 13 57.914 0.3 . 1 . . . . . 232 LEU CA . 50913 1 715 . 1 . 1 232 232 LEU CB C 13 41.771 0.3 . 1 . . . . . 232 LEU CB . 50913 1 716 . 1 . 1 232 232 LEU N N 15 121.834 0.3 . 1 . . . . . 232 LEU N . 50913 1 717 . 1 . 1 233 233 ALA H H 1 7.993 0.020 . 1 . . . . . 233 ALA H . 50913 1 718 . 1 . 1 233 233 ALA CA C 13 55.258 0.3 . 1 . . . . . 233 ALA CA . 50913 1 719 . 1 . 1 233 233 ALA CB C 13 15.619 0.3 . 1 . . . . . 233 ALA CB . 50913 1 720 . 1 . 1 233 233 ALA N N 15 120.022 0.3 . 1 . . . . . 233 ALA N . 50913 1 721 . 1 . 1 234 234 ASP H H 1 7.584 0.020 . 1 . . . . . 234 ASP H . 50913 1 722 . 1 . 1 234 234 ASP CA C 13 57.875 0.3 . 1 . . . . . 234 ASP CA . 50913 1 723 . 1 . 1 234 234 ASP CB C 13 40.911 0.3 . 1 . . . . . 234 ASP CB . 50913 1 724 . 1 . 1 234 234 ASP N N 15 114.400 0.3 . 1 . . . . . 234 ASP N . 50913 1 725 . 1 . 1 235 235 THR H H 1 8.440 0.020 . 1 . . . . . 235 THR H . 50913 1 726 . 1 . 1 235 235 THR CA C 13 58.309 0.3 . 1 . . . . . 235 THR CA . 50913 1 727 . 1 . 1 235 235 THR CB C 13 67.449 0.3 . 1 . . . . . 235 THR CB . 50913 1 728 . 1 . 1 235 235 THR N N 15 114.588 0.3 . 1 . . . . . 235 THR N . 50913 1 729 . 1 . 1 236 236 CYS H H 1 8.283 0.020 . 1 . . . . . 236 CYS H . 50913 1 730 . 1 . 1 236 236 CYS CA C 13 65.704 0.3 . 1 . . . . . 236 CYS CA . 50913 1 731 . 1 . 1 236 236 CYS CB C 13 27.348 0.3 . 1 . . . . . 236 CYS CB . 50913 1 732 . 1 . 1 236 236 CYS N N 15 118.029 0.3 . 1 . . . . . 236 CYS N . 50913 1 733 . 1 . 1 237 237 LEU H H 1 7.777 0.020 . 1 . . . . . 237 LEU H . 50913 1 734 . 1 . 1 237 237 LEU CA C 13 57.571 0.3 . 1 . . . . . 237 LEU CA . 50913 1 735 . 1 . 1 237 237 LEU CB C 13 40.296 0.3 . 1 . . . . . 237 LEU CB . 50913 1 736 . 1 . 1 237 237 LEU N N 15 117.782 0.3 . 1 . . . . . 237 LEU N . 50913 1 737 . 1 . 1 238 238 LEU H H 1 8.200 0.020 . 1 . . . . . 238 LEU H . 50913 1 738 . 1 . 1 238 238 LEU CA C 13 57.362 0.3 . 1 . . . . . 238 LEU CA . 50913 1 739 . 1 . 1 238 238 LEU CB C 13 41.095 0.3 . 1 . . . . . 238 LEU CB . 50913 1 740 . 1 . 1 238 238 LEU N N 15 119.106 0.3 . 1 . . . . . 238 LEU N . 50913 1 741 . 1 . 1 239 239 LEU H H 1 7.723 0.020 . 1 . . . . . 239 LEU H . 50913 1 742 . 1 . 1 239 239 LEU CA C 13 57.878 0.3 . 1 . . . . . 239 LEU CA . 50913 1 743 . 1 . 1 239 239 LEU CB C 13 40.911 0.3 . 1 . . . . . 239 LEU CB . 50913 1 744 . 1 . 1 239 239 LEU N N 15 121.813 0.3 . 1 . . . . . 239 LEU N . 50913 1 745 . 1 . 1 240 240 MET H H 1 7.874 0.020 . 1 . . . . . 240 MET H . 50913 1 746 . 1 . 1 240 240 MET CA C 13 58.987 0.3 . 1 . . . . . 240 MET CA . 50913 1 747 . 1 . 1 240 240 MET CB C 13 32.417 0.3 . 1 . . . . . 240 MET CB . 50913 1 748 . 1 . 1 240 240 MET N N 15 117.590 0.3 . 1 . . . . . 240 MET N . 50913 1 749 . 1 . 1 241 241 ASP H H 1 7.137 0.020 . 1 . . . . . 241 ASP H . 50913 1 750 . 1 . 1 241 241 ASP CA C 13 55.967 0.3 . 1 . . . . . 241 ASP CA . 50913 1 751 . 1 . 1 241 241 ASP CB C 13 41.379 0.3 . 1 . . . . . 241 ASP CB . 50913 1 752 . 1 . 1 241 241 ASP N N 15 116.718 0.3 . 1 . . . . . 241 ASP N . 50913 1 753 . 1 . 1 242 242 LYS H H 1 7.921 0.020 . 1 . . . . . 242 LYS H . 50913 1 754 . 1 . 1 242 242 LYS CA C 13 57.975 0.3 . 1 . . . . . 242 LYS CA . 50913 1 755 . 1 . 1 242 242 LYS CB C 13 32.013 0.3 . 1 . . . . . 242 LYS CB . 50913 1 756 . 1 . 1 242 242 LYS N N 15 117.523 0.3 . 1 . . . . . 242 LYS N . 50913 1 757 . 1 . 1 243 243 ARG H H 1 7.880 0.020 . 1 . . . . . 243 ARG H . 50913 1 758 . 1 . 1 243 243 ARG CA C 13 55.841 0.3 . 1 . . . . . 243 ARG CA . 50913 1 759 . 1 . 1 243 243 ARG CB C 13 30.370 0.3 . 1 . . . . . 243 ARG CB . 50913 1 760 . 1 . 1 243 243 ARG N N 15 116.983 0.3 . 1 . . . . . 243 ARG N . 50913 1 761 . 1 . 1 244 244 LYS H H 1 7.728 0.020 . 1 . . . . . 244 LYS H . 50913 1 762 . 1 . 1 244 244 LYS CA C 13 56.350 0.3 . 1 . . . . . 244 LYS CA . 50913 1 763 . 1 . 1 244 244 LYS CB C 13 33.107 0.3 . 1 . . . . . 244 LYS CB . 50913 1 764 . 1 . 1 244 244 LYS N N 15 118.966 0.3 . 1 . . . . . 244 LYS N . 50913 1 765 . 1 . 1 246 246 PRO CA C 13 64.421 0.3 . 1 . . . . . 246 PRO CA . 50913 1 766 . 1 . 1 246 246 PRO CB C 13 31.675 0.3 . 1 . . . . . 246 PRO CB . 50913 1 767 . 1 . 1 247 247 SER H H 1 8.039 0.020 . 1 . . . . . 247 SER H . 50913 1 768 . 1 . 1 247 247 SER CA C 13 59.733 0.3 . 1 . . . . . 247 SER CA . 50913 1 769 . 1 . 1 247 247 SER CB C 13 62.797 0.3 . 1 . . . . . 247 SER CB . 50913 1 770 . 1 . 1 247 247 SER N N 15 112.854 0.3 . 1 . . . . . 247 SER N . 50913 1 771 . 1 . 1 248 248 SER H H 1 7.595 0.020 . 1 . . . . . 248 SER H . 50913 1 772 . 1 . 1 248 248 SER CA C 13 58.797 0.3 . 1 . . . . . 248 SER CA . 50913 1 773 . 1 . 1 248 248 SER CB C 13 63.783 0.3 . 1 . . . . . 248 SER CB . 50913 1 774 . 1 . 1 248 248 SER N N 15 115.246 0.3 . 1 . . . . . 248 SER N . 50913 1 775 . 1 . 1 249 249 VAL H H 1 7.146 0.020 . 1 . . . . . 249 VAL H . 50913 1 776 . 1 . 1 249 249 VAL CA C 13 62.829 0.3 . 1 . . . . . 249 VAL CA . 50913 1 777 . 1 . 1 249 249 VAL CB C 13 31.258 0.3 . 1 . . . . . 249 VAL CB . 50913 1 778 . 1 . 1 249 249 VAL N N 15 123.554 0.3 . 1 . . . . . 249 VAL N . 50913 1 779 . 1 . 1 250 250 ASP H H 1 8.330 0.020 . 1 . . . . . 250 ASP H . 50913 1 780 . 1 . 1 250 250 ASP CA C 13 51.239 0.3 . 1 . . . . . 250 ASP CA . 50913 1 781 . 1 . 1 250 250 ASP CB C 13 41.464 0.3 . 1 . . . . . 250 ASP CB . 50913 1 782 . 1 . 1 250 250 ASP N N 15 129.392 0.3 . 1 . . . . . 250 ASP N . 50913 1 783 . 1 . 1 251 251 ILE H H 1 8.362 0.020 . 1 . . . . . 251 ILE H . 50913 1 784 . 1 . 1 251 251 ILE CA C 13 65.012 0.3 . 1 . . . . . 251 ILE CA . 50913 1 785 . 1 . 1 251 251 ILE CB C 13 37.283 0.3 . 1 . . . . . 251 ILE CB . 50913 1 786 . 1 . 1 251 251 ILE N N 15 126.387 0.3 . 1 . . . . . 251 ILE N . 50913 1 787 . 1 . 1 252 252 LYS H H 1 7.774 0.020 . 1 . . . . . 252 LYS H . 50913 1 788 . 1 . 1 252 252 LYS CA C 13 59.671 0.3 . 1 . . . . . 252 LYS CA . 50913 1 789 . 1 . 1 252 252 LYS CB C 13 30.029 0.3 . 1 . . . . . 252 LYS CB . 50913 1 790 . 1 . 1 252 252 LYS N N 15 118.155 0.3 . 1 . . . . . 252 LYS N . 50913 1 791 . 1 . 1 253 253 LYS H H 1 7.099 0.020 . 1 . . . . . 253 LYS H . 50913 1 792 . 1 . 1 253 253 LYS CA C 13 58.865 0.3 . 1 . . . . . 253 LYS CA . 50913 1 793 . 1 . 1 253 253 LYS CB C 13 31.320 0.3 . 1 . . . . . 253 LYS CB . 50913 1 794 . 1 . 1 253 253 LYS N N 15 117.652 0.3 . 1 . . . . . 253 LYS N . 50913 1 795 . 1 . 1 254 254 VAL H H 1 8.019 0.020 . 1 . . . . . 254 VAL H . 50913 1 796 . 1 . 1 254 254 VAL CA C 13 65.932 0.3 . 1 . . . . . 254 VAL CA . 50913 1 797 . 1 . 1 254 254 VAL CB C 13 29.440 0.3 . 1 . . . . . 254 VAL CB . 50913 1 798 . 1 . 1 254 254 VAL N N 15 121.727 0.3 . 1 . . . . . 254 VAL N . 50913 1 799 . 1 . 1 255 255 LEU H H 1 8.282 0.020 . 1 . . . . . 255 LEU H . 50913 1 800 . 1 . 1 255 255 LEU CA C 13 57.633 0.3 . 1 . . . . . 255 LEU CA . 50913 1 801 . 1 . 1 255 255 LEU CB C 13 39.865 0.3 . 1 . . . . . 255 LEU CB . 50913 1 802 . 1 . 1 255 255 LEU N N 15 120.962 0.3 . 1 . . . . . 255 LEU N . 50913 1 803 . 1 . 1 256 256 LEU H H 1 8.105 0.020 . 1 . . . . . 256 LEU H . 50913 1 804 . 1 . 1 256 256 LEU CA C 13 58.202 0.3 . 1 . . . . . 256 LEU CA . 50913 1 805 . 1 . 1 256 256 LEU CB C 13 40.419 0.3 . 1 . . . . . 256 LEU CB . 50913 1 806 . 1 . 1 256 256 LEU N N 15 119.097 0.3 . 1 . . . . . 256 LEU N . 50913 1 807 . 1 . 1 258 258 MET H H 1 8.529 0.020 . 1 . . . . . 258 MET H . 50913 1 808 . 1 . 1 258 258 MET CA C 13 60.308 0.3 . 1 . . . . . 258 MET CA . 50913 1 809 . 1 . 1 258 258 MET CB C 13 32.918 0.3 . 1 . . . . . 258 MET CB . 50913 1 810 . 1 . 1 258 258 MET N N 15 119.171 0.3 . 1 . . . . . 258 MET N . 50913 1 811 . 1 . 1 259 259 ARG H H 1 8.466 0.020 . 1 . . . . . 259 ARG H . 50913 1 812 . 1 . 1 259 259 ARG CA C 13 57.634 0.3 . 1 . . . . . 259 ARG CA . 50913 1 813 . 1 . 1 259 259 ARG CB C 13 29.599 0.3 . 1 . . . . . 259 ARG CB . 50913 1 814 . 1 . 1 259 259 ARG N N 15 117.845 0.3 . 1 . . . . . 259 ARG N . 50913 1 815 . 1 . 1 260 260 LYS H H 1 7.550 0.020 . 1 . . . . . 260 LYS H . 50913 1 816 . 1 . 1 260 260 LYS CA C 13 58.063 0.3 . 1 . . . . . 260 LYS CA . 50913 1 817 . 1 . 1 260 260 LYS CB C 13 30.828 0.3 . 1 . . . . . 260 LYS CB . 50913 1 818 . 1 . 1 260 260 LYS N N 15 119.085 0.3 . 1 . . . . . 260 LYS N . 50913 1 819 . 1 . 1 261 261 PHE H H 1 8.088 0.020 . 1 . . . . . 261 PHE H . 50913 1 820 . 1 . 1 261 261 PHE CA C 13 58.993 0.3 . 1 . . . . . 261 PHE CA . 50913 1 821 . 1 . 1 261 261 PHE CB C 13 40.986 0.3 . 1 . . . . . 261 PHE CB . 50913 1 822 . 1 . 1 261 261 PHE N N 15 112.753 0.3 . 1 . . . . . 261 PHE N . 50913 1 823 . 1 . 1 262 262 ARG H H 1 7.408 0.020 . 1 . . . . . 262 ARG H . 50913 1 824 . 1 . 1 262 262 ARG CA C 13 56.177 0.3 . 1 . . . . . 262 ARG CA . 50913 1 825 . 1 . 1 262 262 ARG CB C 13 31.566 0.3 . 1 . . . . . 262 ARG CB . 50913 1 826 . 1 . 1 262 262 ARG N N 15 120.841 0.3 . 1 . . . . . 262 ARG N . 50913 1 827 . 1 . 1 263 263 MET H H 1 8.291 0.020 . 1 . . . . . 263 MET H . 50913 1 828 . 1 . 1 263 263 MET CA C 13 54.940 0.3 . 1 . . . . . 263 MET CA . 50913 1 829 . 1 . 1 263 263 MET CB C 13 31.679 0.3 . 1 . . . . . 263 MET CB . 50913 1 830 . 1 . 1 263 263 MET N N 15 122.465 0.3 . 1 . . . . . 263 MET N . 50913 1 831 . 1 . 1 264 264 GLY H H 1 8.716 0.020 . 1 . . . . . 264 GLY H . 50913 1 832 . 1 . 1 264 264 GLY CA C 13 47.412 0.3 . 1 . . . . . 264 GLY CA . 50913 1 833 . 1 . 1 264 264 GLY N N 15 101.916 0.3 . 1 . . . . . 264 GLY N . 50913 1 834 . 1 . 1 268 268 THR H H 1 6.611 0.020 . 1 . . . . . 268 THR H . 50913 1 835 . 1 . 1 268 268 THR CA C 13 57.319 0.3 . 1 . . . . . 268 THR CA . 50913 1 836 . 1 . 1 268 268 THR CB C 13 72.756 0.3 . 1 . . . . . 268 THR CB . 50913 1 837 . 1 . 1 268 268 THR N N 15 105.375 0.3 . 1 . . . . . 268 THR N . 50913 1 838 . 1 . 1 269 269 ALA H H 1 8.540 0.020 . 1 . . . . . 269 ALA H . 50913 1 839 . 1 . 1 269 269 ALA CA C 13 53.859 0.3 . 1 . . . . . 269 ALA CA . 50913 1 840 . 1 . 1 269 269 ALA CB C 13 16.565 0.3 . 1 . . . . . 269 ALA CB . 50913 1 841 . 1 . 1 269 269 ALA N N 15 123.543 0.3 . 1 . . . . . 269 ALA N . 50913 1 842 . 1 . 1 270 270 ASP H H 1 7.761 0.020 . 1 . . . . . 270 ASP H . 50913 1 843 . 1 . 1 270 270 ASP CA C 13 56.211 0.3 . 1 . . . . . 270 ASP CA . 50913 1 844 . 1 . 1 270 270 ASP CB C 13 39.251 0.3 . 1 . . . . . 270 ASP CB . 50913 1 845 . 1 . 1 270 270 ASP N N 15 116.283 0.3 . 1 . . . . . 270 ASP N . 50913 1 846 . 1 . 1 271 271 GLN H H 1 7.726 0.020 . 1 . . . . . 271 GLN H . 50913 1 847 . 1 . 1 271 271 GLN CA C 13 58.509 0.3 . 1 . . . . . 271 GLN CA . 50913 1 848 . 1 . 1 271 271 GLN CB C 13 27.631 0.3 . 1 . . . . . 271 GLN CB . 50913 1 849 . 1 . 1 271 271 GLN N N 15 119.981 0.3 . 1 . . . . . 271 GLN N . 50913 1 850 . 1 . 1 272 272 LEU H H 1 7.445 0.020 . 1 . . . . . 272 LEU H . 50913 1 851 . 1 . 1 272 272 LEU CA C 13 57.949 0.3 . 1 . . . . . 272 LEU CA . 50913 1 852 . 1 . 1 272 272 LEU CB C 13 39.808 0.3 . 1 . . . . . 272 LEU CB . 50913 1 853 . 1 . 1 272 272 LEU N N 15 123.923 0.3 . 1 . . . . . 272 LEU N . 50913 1 854 . 1 . 1 273 273 ARG H H 1 7.812 0.020 . 1 . . . . . 273 ARG H . 50913 1 855 . 1 . 1 273 273 ARG CA C 13 58.882 0.3 . 1 . . . . . 273 ARG CA . 50913 1 856 . 1 . 1 273 273 ARG CB C 13 27.745 0.3 . 1 . . . . . 273 ARG CB . 50913 1 857 . 1 . 1 273 273 ARG N N 15 121.278 0.3 . 1 . . . . . 273 ARG N . 50913 1 858 . 1 . 1 274 274 PHE H H 1 8.117 0.020 . 1 . . . . . 274 PHE H . 50913 1 859 . 1 . 1 274 274 PHE CA C 13 61.227 0.3 . 1 . . . . . 274 PHE CA . 50913 1 860 . 1 . 1 274 274 PHE CB C 13 39.174 0.3 . 1 . . . . . 274 PHE CB . 50913 1 861 . 1 . 1 274 274 PHE N N 15 117.721 0.3 . 1 . . . . . 274 PHE N . 50913 1 862 . 1 . 1 275 275 SER H H 1 7.906 0.020 . 1 . . . . . 275 SER H . 50913 1 863 . 1 . 1 275 275 SER CA C 13 63.255 0.3 . 1 . . . . . 275 SER CA . 50913 1 864 . 1 . 1 275 275 SER CB C 13 63.572 0.3 . 1 . . . . . 275 SER CB . 50913 1 865 . 1 . 1 275 275 SER N N 15 115.530 0.3 . 1 . . . . . 275 SER N . 50913 1 866 . 1 . 1 276 276 TYR H H 1 7.721 0.020 . 1 . . . . . 276 TYR H . 50913 1 867 . 1 . 1 276 276 TYR CA C 13 58.312 0.3 . 1 . . . . . 276 TYR CA . 50913 1 868 . 1 . 1 276 276 TYR CB C 13 40.948 0.3 . 1 . . . . . 276 TYR CB . 50913 1 869 . 1 . 1 276 276 TYR N N 15 121.165 0.3 . 1 . . . . . 276 TYR N . 50913 1 870 . 1 . 1 277 277 LEU H H 1 8.287 0.020 . 1 . . . . . 277 LEU H . 50913 1 871 . 1 . 1 277 277 LEU CA C 13 57.904 0.3 . 1 . . . . . 277 LEU CA . 50913 1 872 . 1 . 1 277 277 LEU CB C 13 41.648 0.3 . 1 . . . . . 277 LEU CB . 50913 1 873 . 1 . 1 277 277 LEU N N 15 119.154 0.3 . 1 . . . . . 277 LEU N . 50913 1 874 . 1 . 1 278 278 ALA H H 1 8.419 0.020 . 1 . . . . . 278 ALA H . 50913 1 875 . 1 . 1 278 278 ALA CA C 13 54.066 0.3 . 1 . . . . . 278 ALA CA . 50913 1 876 . 1 . 1 278 278 ALA CB C 13 16.012 0.3 . 1 . . . . . 278 ALA CB . 50913 1 877 . 1 . 1 278 278 ALA N N 15 119.536 0.3 . 1 . . . . . 278 ALA N . 50913 1 878 . 1 . 1 279 279 VAL H H 1 7.745 0.020 . 1 . . . . . 279 VAL H . 50913 1 879 . 1 . 1 279 279 VAL CA C 13 66.532 0.3 . 1 . . . . . 279 VAL CA . 50913 1 880 . 1 . 1 279 279 VAL CB C 13 30.401 0.3 . 1 . . . . . 279 VAL CB . 50913 1 881 . 1 . 1 279 279 VAL N N 15 118.523 0.3 . 1 . . . . . 279 VAL N . 50913 1 882 . 1 . 1 280 280 ILE H H 1 8.370 0.020 . 1 . . . . . 280 ILE H . 50913 1 883 . 1 . 1 280 280 ILE CA C 13 57.655 0.3 . 1 . . . . . 280 ILE CA . 50913 1 884 . 1 . 1 280 280 ILE CB C 13 40.185 0.3 . 1 . . . . . 280 ILE CB . 50913 1 885 . 1 . 1 280 280 ILE N N 15 120.098 0.3 . 1 . . . . . 280 ILE N . 50913 1 886 . 1 . 1 281 281 GLU H H 1 7.810 0.020 . 1 . . . . . 281 GLU H . 50913 1 887 . 1 . 1 281 281 GLU CA C 13 58.882 0.3 . 1 . . . . . 281 GLU CA . 50913 1 888 . 1 . 1 281 281 GLU CB C 13 28.147 0.3 . 1 . . . . . 281 GLU CB . 50913 1 889 . 1 . 1 281 281 GLU N N 15 120.835 0.3 . 1 . . . . . 281 GLU N . 50913 1 890 . 1 . 1 282 282 GLY H H 1 8.644 0.020 . 1 . . . . . 282 GLY H . 50913 1 891 . 1 . 1 282 282 GLY CA C 13 47.208 0.3 . 1 . . . . . 282 GLY CA . 50913 1 892 . 1 . 1 282 282 GLY N N 15 109.730 0.3 . 1 . . . . . 282 GLY N . 50913 1 893 . 1 . 1 283 283 ALA H H 1 8.514 0.020 . 1 . . . . . 283 ALA H . 50913 1 894 . 1 . 1 283 283 ALA CA C 13 54.363 0.3 . 1 . . . . . 283 ALA CA . 50913 1 895 . 1 . 1 283 283 ALA CB C 13 17.927 0.3 . 1 . . . . . 283 ALA CB . 50913 1 896 . 1 . 1 283 283 ALA N N 15 125.063 0.3 . 1 . . . . . 283 ALA N . 50913 1 897 . 1 . 1 284 284 LYS H H 1 7.405 0.020 . 1 . . . . . 284 LYS H . 50913 1 898 . 1 . 1 284 284 LYS CA C 13 58.801 0.3 . 1 . . . . . 284 LYS CA . 50913 1 899 . 1 . 1 284 284 LYS CB C 13 31.627 0.3 . 1 . . . . . 284 LYS CB . 50913 1 900 . 1 . 1 284 284 LYS N N 15 116.086 0.3 . 1 . . . . . 284 LYS N . 50913 1 901 . 1 . 1 285 285 PHE H H 1 7.505 0.020 . 1 . . . . . 285 PHE H . 50913 1 902 . 1 . 1 285 285 PHE CA C 13 59.268 0.3 . 1 . . . . . 285 PHE CA . 50913 1 903 . 1 . 1 285 285 PHE CB C 13 38.697 0.3 . 1 . . . . . 285 PHE CB . 50913 1 904 . 1 . 1 285 285 PHE N N 15 118.000 0.3 . 1 . . . . . 285 PHE N . 50913 1 905 . 1 . 1 286 286 ILE H H 1 7.869 0.020 . 1 . . . . . 286 ILE H . 50913 1 906 . 1 . 1 286 286 ILE CA C 13 62.957 0.3 . 1 . . . . . 286 ILE CA . 50913 1 907 . 1 . 1 286 286 ILE CB C 13 36.956 0.3 . 1 . . . . . 286 ILE CB . 50913 1 908 . 1 . 1 286 286 ILE N N 15 118.591 0.3 . 1 . . . . . 286 ILE N . 50913 1 909 . 1 . 1 287 287 MET H H 1 7.996 0.020 . 1 . . . . . 287 MET H . 50913 1 910 . 1 . 1 287 287 MET CA C 13 55.203 0.3 . 1 . . . . . 287 MET CA . 50913 1 911 . 1 . 1 287 287 MET CB C 13 31.443 0.3 . 1 . . . . . 287 MET CB . 50913 1 912 . 1 . 1 287 287 MET N N 15 118.211 0.3 . 1 . . . . . 287 MET N . 50913 1 913 . 1 . 1 288 288 GLY H H 1 7.507 0.020 . 1 . . . . . 288 GLY H . 50913 1 914 . 1 . 1 288 288 GLY CA C 13 45.153 0.3 . 1 . . . . . 288 GLY CA . 50913 1 915 . 1 . 1 288 288 GLY N N 15 107.966 0.3 . 1 . . . . . 288 GLY N . 50913 1 916 . 1 . 1 289 289 ASP H H 1 7.958 0.020 . 1 . . . . . 289 ASP H . 50913 1 917 . 1 . 1 289 289 ASP CA C 13 56.969 0.3 . 1 . . . . . 289 ASP CA . 50913 1 918 . 1 . 1 289 289 ASP CB C 13 40.480 0.3 . 1 . . . . . 289 ASP CB . 50913 1 919 . 1 . 1 289 289 ASP N N 15 120.849 0.3 . 1 . . . . . 289 ASP N . 50913 1 920 . 1 . 1 290 290 SER H H 1 8.228 0.020 . 1 . . . . . 290 SER H . 50913 1 921 . 1 . 1 290 290 SER CA C 13 58.928 0.3 . 1 . . . . . 290 SER CA . 50913 1 922 . 1 . 1 290 290 SER CB C 13 62.920 0.3 . 1 . . . . . 290 SER CB . 50913 1 923 . 1 . 1 290 290 SER N N 15 118.286 0.3 . 1 . . . . . 290 SER N . 50913 1 924 . 1 . 1 291 291 SER H H 1 8.324 0.020 . 1 . . . . . 291 SER H . 50913 1 925 . 1 . 1 291 291 SER CA C 13 59.138 0.3 . 1 . . . . . 291 SER CA . 50913 1 926 . 1 . 1 291 291 SER CB C 13 61.629 0.3 . 1 . . . . . 291 SER CB . 50913 1 927 . 1 . 1 291 291 SER N N 15 118.445 0.3 . 1 . . . . . 291 SER N . 50913 1 928 . 1 . 1 292 292 VAL H H 1 7.642 0.020 . 1 . . . . . 292 VAL H . 50913 1 929 . 1 . 1 292 292 VAL CA C 13 63.002 0.3 . 1 . . . . . 292 VAL CA . 50913 1 930 . 1 . 1 292 292 VAL CB C 13 30.582 0.3 . 1 . . . . . 292 VAL CB . 50913 1 931 . 1 . 1 292 292 VAL N N 15 121.459 0.3 . 1 . . . . . 292 VAL N . 50913 1 932 . 1 . 1 293 293 GLN H H 1 8.238 0.020 . 1 . . . . . 293 GLN H . 50913 1 933 . 1 . 1 293 293 GLN CA C 13 55.080 0.3 . 1 . . . . . 293 GLN CA . 50913 1 934 . 1 . 1 293 293 GLN CB C 13 29.288 0.3 . 1 . . . . . 293 GLN CB . 50913 1 935 . 1 . 1 293 293 GLN N N 15 120.242 0.3 . 1 . . . . . 293 GLN N . 50913 1 936 . 1 . 1 294 294 ASP H H 1 7.950 0.020 . 1 . . . . . 294 ASP H . 50913 1 937 . 1 . 1 294 294 ASP CA C 13 54.464 0.3 . 1 . . . . . 294 ASP CA . 50913 1 938 . 1 . 1 294 294 ASP CB C 13 39.804 0.3 . 1 . . . . . 294 ASP CB . 50913 1 939 . 1 . 1 294 294 ASP N N 15 125.634 0.3 . 1 . . . . . 294 ASP N . 50913 1 940 . 1 . 1 295 295 GLN H H 1 7.869 0.020 . 1 . . . . . 295 GLN H . 50913 1 941 . 1 . 1 295 295 GLN CA C 13 56.772 0.3 . 1 . . . . . 295 GLN CA . 50913 1 942 . 1 . 1 295 295 GLN CB C 13 28.553 0.3 . 1 . . . . . 295 GLN CB . 50913 1 943 . 1 . 1 295 295 GLN N N 15 119.914 0.3 . 1 . . . . . 295 GLN N . 50913 1 944 . 1 . 1 296 296 TRP H H 1 7.972 0.020 . 1 . . . . . 296 TRP H . 50913 1 945 . 1 . 1 296 296 TRP CA C 13 57.325 0.3 . 1 . . . . . 296 TRP CA . 50913 1 946 . 1 . 1 296 296 TRP CB C 13 27.877 0.3 . 1 . . . . . 296 TRP CB . 50913 1 947 . 1 . 1 296 296 TRP N N 15 120.781 0.3 . 1 . . . . . 296 TRP N . 50913 1 948 . 1 . 1 297 297 LYS H H 1 7.604 0.020 . 1 . . . . . 297 LYS H . 50913 1 949 . 1 . 1 297 297 LYS CA C 13 57.171 0.3 . 1 . . . . . 297 LYS CA . 50913 1 950 . 1 . 1 297 297 LYS CB C 13 31.627 0.3 . 1 . . . . . 297 LYS CB . 50913 1 951 . 1 . 1 297 297 LYS N N 15 121.958 0.3 . 1 . . . . . 297 LYS N . 50913 1 952 . 1 . 1 298 298 GLU H H 1 7.976 0.020 . 1 . . . . . 298 GLU H . 50913 1 953 . 1 . 1 298 298 GLU CA C 13 57.817 0.3 . 1 . . . . . 298 GLU CA . 50913 1 954 . 1 . 1 298 298 GLU CB C 13 28.676 0.3 . 1 . . . . . 298 GLU CB . 50913 1 955 . 1 . 1 298 298 GLU N N 15 121.166 0.3 . 1 . . . . . 298 GLU N . 50913 1 956 . 1 . 1 299 299 LEU H H 1 7.932 0.020 . 1 . . . . . 299 LEU H . 50913 1 957 . 1 . 1 299 299 LEU CA C 13 54.700 0.3 . 1 . . . . . 299 LEU CA . 50913 1 958 . 1 . 1 299 299 LEU CB C 13 41.202 0.3 . 1 . . . . . 299 LEU CB . 50913 1 959 . 1 . 1 299 299 LEU N N 15 122.218 0.3 . 1 . . . . . 299 LEU N . 50913 1 960 . 1 . 1 300 300 SER H H 1 8.065 0.020 . 1 . . . . . 300 SER H . 50913 1 961 . 1 . 1 300 300 SER CA C 13 57.756 0.3 . 1 . . . . . 300 SER CA . 50913 1 962 . 1 . 1 300 300 SER CB C 13 63.166 0.3 . 1 . . . . . 300 SER CB . 50913 1 963 . 1 . 1 300 300 SER N N 15 115.964 0.3 . 1 . . . . . 300 SER N . 50913 1 964 . 1 . 1 301 301 HIS H H 1 8.409 0.020 . 1 . . . . . 301 HIS H . 50913 1 965 . 1 . 1 301 301 HIS CA C 13 56.199 0.3 . 1 . . . . . 301 HIS CA . 50913 1 966 . 1 . 1 301 301 HIS CB C 13 32.918 0.3 . 1 . . . . . 301 HIS CB . 50913 1 967 . 1 . 1 301 301 HIS N N 15 122.656 0.3 . 1 . . . . . 301 HIS N . 50913 1 968 . 1 . 1 302 302 GLU H H 1 8.636 0.020 . 1 . . . . . 302 GLU H . 50913 1 969 . 1 . 1 302 302 GLU CA C 13 59.301 0.3 . 1 . . . . . 302 GLU CA . 50913 1 970 . 1 . 1 302 302 GLU CB C 13 28.000 0.3 . 1 . . . . . 302 GLU CB . 50913 1 971 . 1 . 1 302 302 GLU N N 15 124.107 0.3 . 1 . . . . . 302 GLU N . 50913 1 972 . 1 . 1 303 303 ASP H H 1 8.230 0.020 . 1 . . . . . 303 ASP H . 50913 1 973 . 1 . 1 303 303 ASP CA C 13 54.030 0.3 . 1 . . . . . 303 ASP CA . 50913 1 974 . 1 . 1 303 303 ASP CB C 13 40.726 0.3 . 1 . . . . . 303 ASP CB . 50913 1 975 . 1 . 1 303 303 ASP N N 15 120.900 0.3 . 1 . . . . . 303 ASP N . 50913 1 976 . 1 . 1 304 304 LEU H H 1 7.890 0.020 . 1 . . . . . 304 LEU H . 50913 1 977 . 1 . 1 304 304 LEU CA C 13 54.573 0.3 . 1 . . . . . 304 LEU CA . 50913 1 978 . 1 . 1 304 304 LEU CB C 13 41.519 0.3 . 1 . . . . . 304 LEU CB . 50913 1 979 . 1 . 1 304 304 LEU N N 15 122.597 0.3 . 1 . . . . . 304 LEU N . 50913 1 980 . 1 . 1 305 305 GLU H H 1 8.096 0.020 . 1 . . . . . 305 GLU H . 50913 1 981 . 1 . 1 305 305 GLU CA C 13 53.785 0.3 . 1 . . . . . 305 GLU CA . 50913 1 982 . 1 . 1 305 305 GLU CB C 13 28.799 0.3 . 1 . . . . . 305 GLU CB . 50913 1 983 . 1 . 1 305 305 GLU N N 15 122.782 0.3 . 1 . . . . . 305 GLU N . 50913 1 984 . 1 . 1 306 306 PRO CA C 13 65.512 0.3 . 1 . . . . . 306 PRO CA . 50913 1 985 . 1 . 1 307 307 HIS H H 1 7.918 0.020 . 1 . . . . . 307 HIS H . 50913 1 986 . 1 . 1 307 307 HIS CA C 13 60.399 0.3 . 1 . . . . . 307 HIS CA . 50913 1 987 . 1 . 1 307 307 HIS CB C 13 30.014 0.3 . 1 . . . . . 307 HIS CB . 50913 1 988 . 1 . 1 307 307 HIS N N 15 118.339 0.3 . 1 . . . . . 307 HIS N . 50913 1 stop_ save_