data_17781 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 17781 _Entry.Title ; structure of ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2011-07-14 _Entry.Accession_date 2011-07-14 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Remco Sprangers . . . 17781 2 Markus Mund . . . 17781 3 Ancilla Neu . . . 17781 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 17781 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 620 17781 '15N chemical shifts' 198 17781 '1H chemical shifts' 198 17781 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 2 . . 2012-02-15 2011-07-14 udpate BMRB 'update entry citation' 17781 1 . . 2011-10-25 2011-07-14 original author 'original release' 17781 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 17882 lsm57 17781 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 17781 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 22001694 _Citation.Full_citation . _Citation.Title 'Structure of the LSm657 complex: an assembly intermediate of the LSm1-7 and LSm2-8 rings.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Mol. Biol.' _Citation.Journal_name_full 'Journal of molecular biology' _Citation.Journal_volume 414 _Citation.Journal_issue 2 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 165 _Citation.Page_last 176 _Citation.Year 2011 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Markus Mund . . . 17781 1 2 Ancilla Neu . . . 17781 1 3 Janina Ullmann . . . 17781 1 4 Ursula Neu . . . 17781 1 5 Remco Sprangers . . . 17781 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 17781 _Assembly.ID 1 _Assembly.Name hexamer _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _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 lsm5 1 $lsm A . yes native no no . . . 17781 1 2 lsm6 1 $lsm B . yes native no no . . . 17781 1 3 lsm7 1 $lsm C . yes native no no . . . 17781 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_lsm _Entity.Sf_category entity _Entity.Sf_framecode lsm _Entity.Entry_ID 17781 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name lsm _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 ; GAMSMTILPLELIDKCIGSN LWVIMKSEREFAGTLVGFDD YVNIVLKDVTEYDTVTGVTE KHSEMLLNGNGMCMLIPGGK PEGAMDSSPNEFLNKVIGKK VLIRLSSGVDYKGILSCLDG YMNLALERTEEYVNGKKTNV YGDAFIRGNNVLYVSALDDG AMGMSSLQKRPGPGNSSQPT ERPRKESILDLSRYQDQRIQ ATFTGGRQITGILKGFDQLM NLVLDDVEEQLRNPEDGKLT GAIRKLGLVVVRGTTLVLIA PMDGSEEIPNPFVQAE ; _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 276 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . GLY . 17781 1 2 . ALA . 17781 1 3 801 MET . 17781 1 4 802 SER . 17781 1 5 803 MET . 17781 1 6 804 THR . 17781 1 7 805 ILE . 17781 1 8 806 LEU . 17781 1 9 807 PRO . 17781 1 10 808 LEU . 17781 1 11 809 GLU . 17781 1 12 810 LEU . 17781 1 13 811 ILE . 17781 1 14 812 ASP . 17781 1 15 813 LYS . 17781 1 16 814 CYS . 17781 1 17 815 ILE . 17781 1 18 816 GLY . 17781 1 19 817 SER . 17781 1 20 818 ASN . 17781 1 21 819 LEU . 17781 1 22 820 TRP . 17781 1 23 821 VAL . 17781 1 24 822 ILE . 17781 1 25 823 MET . 17781 1 26 824 LYS . 17781 1 27 825 SER . 17781 1 28 826 GLU . 17781 1 29 827 ARG . 17781 1 30 828 GLU . 17781 1 31 829 PHE . 17781 1 32 830 ALA . 17781 1 33 831 GLY . 17781 1 34 832 THR . 17781 1 35 833 LEU . 17781 1 36 834 VAL . 17781 1 37 835 GLY . 17781 1 38 836 PHE . 17781 1 39 837 ASP . 17781 1 40 838 ASP . 17781 1 41 839 TYR . 17781 1 42 840 VAL . 17781 1 43 841 ASN . 17781 1 44 842 ILE . 17781 1 45 843 VAL . 17781 1 46 844 LEU . 17781 1 47 845 LYS . 17781 1 48 846 ASP . 17781 1 49 847 VAL . 17781 1 50 848 THR . 17781 1 51 849 GLU . 17781 1 52 850 TYR . 17781 1 53 851 ASP . 17781 1 54 852 THR . 17781 1 55 853 VAL . 17781 1 56 854 THR . 17781 1 57 855 GLY . 17781 1 58 856 VAL . 17781 1 59 857 THR . 17781 1 60 858 GLU . 17781 1 61 859 LYS . 17781 1 62 860 HIS . 17781 1 63 861 SER . 17781 1 64 862 GLU . 17781 1 65 863 MET . 17781 1 66 864 LEU . 17781 1 67 865 LEU . 17781 1 68 866 ASN . 17781 1 69 867 GLY . 17781 1 70 868 ASN . 17781 1 71 869 GLY . 17781 1 72 870 MET . 17781 1 73 871 CYS . 17781 1 74 872 MET . 17781 1 75 873 LEU . 17781 1 76 874 ILE . 17781 1 77 875 PRO . 17781 1 78 876 GLY . 17781 1 79 877 GLY . 17781 1 80 878 LYS . 17781 1 81 . PRO . 17781 1 82 . GLU . 17781 1 83 . GLY . 17781 1 84 . ALA . 17781 1 85 1001 MET . 17781 1 86 1002 ASP . 17781 1 87 1003 SER . 17781 1 88 1004 SER . 17781 1 89 1005 PRO . 17781 1 90 1006 ASN . 17781 1 91 1007 GLU . 17781 1 92 1008 PHE . 17781 1 93 1009 LEU . 17781 1 94 1010 ASN . 17781 1 95 1011 LYS . 17781 1 96 1012 VAL . 17781 1 97 1013 ILE . 17781 1 98 1014 GLY . 17781 1 99 1015 LYS . 17781 1 100 1016 LYS . 17781 1 101 1017 VAL . 17781 1 102 1018 LEU . 17781 1 103 1019 ILE . 17781 1 104 1020 ARG . 17781 1 105 1021 LEU . 17781 1 106 1022 SER . 17781 1 107 1023 SER . 17781 1 108 1024 GLY . 17781 1 109 1025 VAL . 17781 1 110 1026 ASP . 17781 1 111 1027 TYR . 17781 1 112 1028 LYS . 17781 1 113 1029 GLY . 17781 1 114 1030 ILE . 17781 1 115 1031 LEU . 17781 1 116 1032 SER . 17781 1 117 1033 CYS . 17781 1 118 1034 LEU . 17781 1 119 1035 ASP . 17781 1 120 1036 GLY . 17781 1 121 1037 TYR . 17781 1 122 1038 MET . 17781 1 123 1039 ASN . 17781 1 124 1040 LEU . 17781 1 125 1041 ALA . 17781 1 126 1042 LEU . 17781 1 127 1043 GLU . 17781 1 128 1044 ARG . 17781 1 129 1045 THR . 17781 1 130 1046 GLU . 17781 1 131 1047 GLU . 17781 1 132 1048 TYR . 17781 1 133 1049 VAL . 17781 1 134 1050 ASN . 17781 1 135 1051 GLY . 17781 1 136 1052 LYS . 17781 1 137 1053 LYS . 17781 1 138 1054 THR . 17781 1 139 1055 ASN . 17781 1 140 1056 VAL . 17781 1 141 1057 TYR . 17781 1 142 1058 GLY . 17781 1 143 1059 ASP . 17781 1 144 1060 ALA . 17781 1 145 1061 PHE . 17781 1 146 1062 ILE . 17781 1 147 1063 ARG . 17781 1 148 1064 GLY . 17781 1 149 1065 ASN . 17781 1 150 1066 ASN . 17781 1 151 1067 VAL . 17781 1 152 1068 LEU . 17781 1 153 1069 TYR . 17781 1 154 1070 VAL . 17781 1 155 1071 SER . 17781 1 156 . ALA . 17781 1 157 . LEU . 17781 1 158 . ASP . 17781 1 159 . ASP . 17781 1 160 . GLY . 17781 1 161 . ALA . 17781 1 162 . MET . 17781 1 163 . GLY . 17781 1 164 1201 MET . 17781 1 165 1202 SER . 17781 1 166 1203 SER . 17781 1 167 1204 LEU . 17781 1 168 1205 GLN . 17781 1 169 1206 LYS . 17781 1 170 1207 ARG . 17781 1 171 1208 PRO . 17781 1 172 1209 GLY . 17781 1 173 1210 PRO . 17781 1 174 1211 GLY . 17781 1 175 1212 ASN . 17781 1 176 1213 SER . 17781 1 177 1214 SER . 17781 1 178 1215 GLN . 17781 1 179 1216 PRO . 17781 1 180 1217 THR . 17781 1 181 1218 GLU . 17781 1 182 1219 ARG . 17781 1 183 1220 PRO . 17781 1 184 1221 ARG . 17781 1 185 1222 LYS . 17781 1 186 1223 GLU . 17781 1 187 1224 SER . 17781 1 188 1225 ILE . 17781 1 189 1226 LEU . 17781 1 190 1227 ASP . 17781 1 191 1228 LEU . 17781 1 192 1229 SER . 17781 1 193 1230 ARG . 17781 1 194 1231 TYR . 17781 1 195 1232 GLN . 17781 1 196 1233 ASP . 17781 1 197 1234 GLN . 17781 1 198 1235 ARG . 17781 1 199 1236 ILE . 17781 1 200 1237 GLN . 17781 1 201 1238 ALA . 17781 1 202 1239 THR . 17781 1 203 1240 PHE . 17781 1 204 1241 THR . 17781 1 205 1242 GLY . 17781 1 206 1243 GLY . 17781 1 207 1244 ARG . 17781 1 208 1245 GLN . 17781 1 209 1246 ILE . 17781 1 210 1247 THR . 17781 1 211 1248 GLY . 17781 1 212 1249 ILE . 17781 1 213 1250 LEU . 17781 1 214 1251 LYS . 17781 1 215 1252 GLY . 17781 1 216 1253 PHE . 17781 1 217 1254 ASP . 17781 1 218 1255 GLN . 17781 1 219 1256 LEU . 17781 1 220 1257 MET . 17781 1 221 1258 ASN . 17781 1 222 1259 LEU . 17781 1 223 1260 VAL . 17781 1 224 1261 LEU . 17781 1 225 1262 ASP . 17781 1 226 1263 ASP . 17781 1 227 1264 VAL . 17781 1 228 1265 GLU . 17781 1 229 1266 GLU . 17781 1 230 1267 GLN . 17781 1 231 1268 LEU . 17781 1 232 1269 ARG . 17781 1 233 1270 ASN . 17781 1 234 1271 PRO . 17781 1 235 1272 GLU . 17781 1 236 1273 ASP . 17781 1 237 1274 GLY . 17781 1 238 1275 LYS . 17781 1 239 1276 LEU . 17781 1 240 1277 THR . 17781 1 241 1278 GLY . 17781 1 242 1279 ALA . 17781 1 243 1280 ILE . 17781 1 244 1281 ARG . 17781 1 245 1282 LYS . 17781 1 246 1283 LEU . 17781 1 247 1284 GLY . 17781 1 248 1285 LEU . 17781 1 249 1286 VAL . 17781 1 250 1287 VAL . 17781 1 251 1288 VAL . 17781 1 252 1289 ARG . 17781 1 253 1290 GLY . 17781 1 254 1291 THR . 17781 1 255 1292 THR . 17781 1 256 1293 LEU . 17781 1 257 1294 VAL . 17781 1 258 1295 LEU . 17781 1 259 1296 ILE . 17781 1 260 1297 ALA . 17781 1 261 1298 PRO . 17781 1 262 1299 MET . 17781 1 263 1300 ASP . 17781 1 264 1301 GLY . 17781 1 265 1302 SER . 17781 1 266 1303 GLU . 17781 1 267 1304 GLU . 17781 1 268 1305 ILE . 17781 1 269 1306 PRO . 17781 1 270 1307 ASN . 17781 1 271 1308 PRO . 17781 1 272 1309 PHE . 17781 1 273 1310 VAL . 17781 1 274 1311 GLN . 17781 1 275 1312 ALA . 17781 1 276 1313 GLU . 17781 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 17781 1 . ALA 2 2 17781 1 . MET 3 3 17781 1 . SER 4 4 17781 1 . MET 5 5 17781 1 . THR 6 6 17781 1 . ILE 7 7 17781 1 . LEU 8 8 17781 1 . PRO 9 9 17781 1 . LEU 10 10 17781 1 . GLU 11 11 17781 1 . LEU 12 12 17781 1 . ILE 13 13 17781 1 . ASP 14 14 17781 1 . LYS 15 15 17781 1 . CYS 16 16 17781 1 . ILE 17 17 17781 1 . GLY 18 18 17781 1 . SER 19 19 17781 1 . ASN 20 20 17781 1 . LEU 21 21 17781 1 . TRP 22 22 17781 1 . VAL 23 23 17781 1 . ILE 24 24 17781 1 . MET 25 25 17781 1 . LYS 26 26 17781 1 . SER 27 27 17781 1 . GLU 28 28 17781 1 . ARG 29 29 17781 1 . GLU 30 30 17781 1 . PHE 31 31 17781 1 . ALA 32 32 17781 1 . GLY 33 33 17781 1 . THR 34 34 17781 1 . LEU 35 35 17781 1 . VAL 36 36 17781 1 . GLY 37 37 17781 1 . PHE 38 38 17781 1 . ASP 39 39 17781 1 . ASP 40 40 17781 1 . TYR 41 41 17781 1 . VAL 42 42 17781 1 . ASN 43 43 17781 1 . ILE 44 44 17781 1 . VAL 45 45 17781 1 . LEU 46 46 17781 1 . LYS 47 47 17781 1 . ASP 48 48 17781 1 . VAL 49 49 17781 1 . THR 50 50 17781 1 . GLU 51 51 17781 1 . TYR 52 52 17781 1 . ASP 53 53 17781 1 . THR 54 54 17781 1 . VAL 55 55 17781 1 . THR 56 56 17781 1 . GLY 57 57 17781 1 . VAL 58 58 17781 1 . THR 59 59 17781 1 . GLU 60 60 17781 1 . LYS 61 61 17781 1 . HIS 62 62 17781 1 . SER 63 63 17781 1 . GLU 64 64 17781 1 . MET 65 65 17781 1 . LEU 66 66 17781 1 . LEU 67 67 17781 1 . ASN 68 68 17781 1 . GLY 69 69 17781 1 . ASN 70 70 17781 1 . GLY 71 71 17781 1 . MET 72 72 17781 1 . CYS 73 73 17781 1 . MET 74 74 17781 1 . LEU 75 75 17781 1 . ILE 76 76 17781 1 . PRO 77 77 17781 1 . GLY 78 78 17781 1 . GLY 79 79 17781 1 . LYS 80 80 17781 1 . PRO 81 81 17781 1 . GLU 82 82 17781 1 . GLY 83 83 17781 1 . ALA 84 84 17781 1 . MET 85 85 17781 1 . ASP 86 86 17781 1 . SER 87 87 17781 1 . SER 88 88 17781 1 . PRO 89 89 17781 1 . ASN 90 90 17781 1 . GLU 91 91 17781 1 . PHE 92 92 17781 1 . LEU 93 93 17781 1 . ASN 94 94 17781 1 . LYS 95 95 17781 1 . VAL 96 96 17781 1 . ILE 97 97 17781 1 . GLY 98 98 17781 1 . LYS 99 99 17781 1 . LYS 100 100 17781 1 . VAL 101 101 17781 1 . LEU 102 102 17781 1 . ILE 103 103 17781 1 . ARG 104 104 17781 1 . LEU 105 105 17781 1 . SER 106 106 17781 1 . SER 107 107 17781 1 . GLY 108 108 17781 1 . VAL 109 109 17781 1 . ASP 110 110 17781 1 . TYR 111 111 17781 1 . LYS 112 112 17781 1 . GLY 113 113 17781 1 . ILE 114 114 17781 1 . LEU 115 115 17781 1 . SER 116 116 17781 1 . CYS 117 117 17781 1 . LEU 118 118 17781 1 . ASP 119 119 17781 1 . GLY 120 120 17781 1 . TYR 121 121 17781 1 . MET 122 122 17781 1 . ASN 123 123 17781 1 . LEU 124 124 17781 1 . ALA 125 125 17781 1 . LEU 126 126 17781 1 . GLU 127 127 17781 1 . ARG 128 128 17781 1 . THR 129 129 17781 1 . GLU 130 130 17781 1 . GLU 131 131 17781 1 . TYR 132 132 17781 1 . VAL 133 133 17781 1 . ASN 134 134 17781 1 . GLY 135 135 17781 1 . LYS 136 136 17781 1 . LYS 137 137 17781 1 . THR 138 138 17781 1 . ASN 139 139 17781 1 . VAL 140 140 17781 1 . TYR 141 141 17781 1 . GLY 142 142 17781 1 . ASP 143 143 17781 1 . ALA 144 144 17781 1 . PHE 145 145 17781 1 . ILE 146 146 17781 1 . ARG 147 147 17781 1 . GLY 148 148 17781 1 . ASN 149 149 17781 1 . ASN 150 150 17781 1 . VAL 151 151 17781 1 . LEU 152 152 17781 1 . TYR 153 153 17781 1 . VAL 154 154 17781 1 . SER 155 155 17781 1 . ALA 156 156 17781 1 . LEU 157 157 17781 1 . ASP 158 158 17781 1 . ASP 159 159 17781 1 . GLY 160 160 17781 1 . ALA 161 161 17781 1 . MET 162 162 17781 1 . GLY 163 163 17781 1 . MET 164 164 17781 1 . SER 165 165 17781 1 . SER 166 166 17781 1 . LEU 167 167 17781 1 . GLN 168 168 17781 1 . LYS 169 169 17781 1 . ARG 170 170 17781 1 . PRO 171 171 17781 1 . GLY 172 172 17781 1 . PRO 173 173 17781 1 . GLY 174 174 17781 1 . ASN 175 175 17781 1 . SER 176 176 17781 1 . SER 177 177 17781 1 . GLN 178 178 17781 1 . PRO 179 179 17781 1 . THR 180 180 17781 1 . GLU 181 181 17781 1 . ARG 182 182 17781 1 . PRO 183 183 17781 1 . ARG 184 184 17781 1 . LYS 185 185 17781 1 . GLU 186 186 17781 1 . SER 187 187 17781 1 . ILE 188 188 17781 1 . LEU 189 189 17781 1 . ASP 190 190 17781 1 . LEU 191 191 17781 1 . SER 192 192 17781 1 . ARG 193 193 17781 1 . TYR 194 194 17781 1 . GLN 195 195 17781 1 . ASP 196 196 17781 1 . GLN 197 197 17781 1 . ARG 198 198 17781 1 . ILE 199 199 17781 1 . GLN 200 200 17781 1 . ALA 201 201 17781 1 . THR 202 202 17781 1 . PHE 203 203 17781 1 . THR 204 204 17781 1 . GLY 205 205 17781 1 . GLY 206 206 17781 1 . ARG 207 207 17781 1 . GLN 208 208 17781 1 . ILE 209 209 17781 1 . THR 210 210 17781 1 . GLY 211 211 17781 1 . ILE 212 212 17781 1 . LEU 213 213 17781 1 . LYS 214 214 17781 1 . GLY 215 215 17781 1 . PHE 216 216 17781 1 . ASP 217 217 17781 1 . GLN 218 218 17781 1 . LEU 219 219 17781 1 . MET 220 220 17781 1 . ASN 221 221 17781 1 . LEU 222 222 17781 1 . VAL 223 223 17781 1 . LEU 224 224 17781 1 . ASP 225 225 17781 1 . ASP 226 226 17781 1 . VAL 227 227 17781 1 . GLU 228 228 17781 1 . GLU 229 229 17781 1 . GLN 230 230 17781 1 . LEU 231 231 17781 1 . ARG 232 232 17781 1 . ASN 233 233 17781 1 . PRO 234 234 17781 1 . GLU 235 235 17781 1 . ASP 236 236 17781 1 . GLY 237 237 17781 1 . LYS 238 238 17781 1 . LEU 239 239 17781 1 . THR 240 240 17781 1 . GLY 241 241 17781 1 . ALA 242 242 17781 1 . ILE 243 243 17781 1 . ARG 244 244 17781 1 . LYS 245 245 17781 1 . LEU 246 246 17781 1 . GLY 247 247 17781 1 . LEU 248 248 17781 1 . VAL 249 249 17781 1 . VAL 250 250 17781 1 . VAL 251 251 17781 1 . ARG 252 252 17781 1 . GLY 253 253 17781 1 . THR 254 254 17781 1 . THR 255 255 17781 1 . LEU 256 256 17781 1 . VAL 257 257 17781 1 . LEU 258 258 17781 1 . ILE 259 259 17781 1 . ALA 260 260 17781 1 . PRO 261 261 17781 1 . MET 262 262 17781 1 . ASP 263 263 17781 1 . GLY 264 264 17781 1 . SER 265 265 17781 1 . GLU 266 266 17781 1 . GLU 267 267 17781 1 . ILE 268 268 17781 1 . PRO 269 269 17781 1 . ASN 270 270 17781 1 . PRO 271 271 17781 1 . PHE 272 272 17781 1 . VAL 273 273 17781 1 . GLN 274 274 17781 1 . ALA 275 275 17781 1 . GLU 276 276 17781 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 17781 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Subvariant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $lsm . 4896 organism . 'Schizosaccharomyces pombe' 'Schizosaccharomyces pombe' . . Eukaryota Fungi Schizosaccharomyces pombe . . . . . . . . . . . . . . . . . . . . . 17781 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source _Entity_experimental_src_list.Entry_ID 17781 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $lsm . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . . . . . . . . . . . pet . . . . . . 17781 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 17781 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 lsm567 '[U-100% 13C; U-100% 15N; U-80% 2H]' . . 1 $lsm . . 1 . . mM . . . . 17781 1 2 H2O 'natural abundance' . . . . . . 95 . . % . . . . 17781 1 3 D2O 'natural abundance' . . . . . . 5 . . % . . . . 17781 1 4 NaPO4 'natural abundance' . . . . . . 50 . . mM . . . . 17781 1 5 NaCl 'natural abundance' . . . . . . 150 . . mM . . . . 17781 1 6 DTT 'natural abundance' . . . . . . 1 . . mM . . . . 17781 1 7 NaN3 'natural abundance' . . . . . . 0.03 . . % . . . . 17781 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 17781 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 250 . mM 17781 1 pH 7.5 . pH 17781 1 pressure 1 . atm 17781 1 temperature 308 . K 17781 1 stop_ save_ ############################ # Computer software used # ############################ save_TOPSPIN _Software.Sf_category software _Software.Sf_framecode TOPSPIN _Software.Entry_ID 17781 _Software.ID 1 _Software.Name TOPSPIN _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bartels et al.' . . 17781 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 17781 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 17781 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DRX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 17781 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker DRX . 600 . . . 17781 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 17781 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17781 1 2 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17781 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 17781 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 water protons . . . . ppm 4.69 na indirect 0.251449530 . . . . . . . . . 17781 1 H 1 water protons . . . . ppm 4.69 na direct 1.000000000 . . . . . . . . . 17781 1 N 15 water protons . . . . ppm 4.69 na indirect 0.101329118 . . . . . . . . . 17781 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 17781 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _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 HNCO' . . . 17781 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 6 6 THR C C 13 180.798 0.05 . 1 . . . . 804 THR C . 17781 1 2 . 1 1 6 6 THR CA C 13 59.439 0.05 . 1 . . . . 804 THR CA . 17781 1 3 . 1 1 6 6 THR CB C 13 67.055 0.05 . 1 . . . . 804 THR CB . 17781 1 4 . 1 1 7 7 ILE H H 1 7.856 0.02 . 1 . . . . 805 ILE HN . 17781 1 5 . 1 1 7 7 ILE C C 13 180.695 0.001 . 1 . . . . 805 ILE C . 17781 1 6 . 1 1 7 7 ILE CA C 13 57.276 0.05 . 1 . . . . 805 ILE CA . 17781 1 7 . 1 1 7 7 ILE CB C 13 36.104 0.05 . 1 . . . . 805 ILE CB . 17781 1 8 . 1 1 7 7 ILE N N 15 125.108 0.03 . 1 . . . . 805 ILE N . 17781 1 9 . 1 1 8 8 LEU H H 1 8.225 0.02 . 1 . . . . 806 LEU HN . 17781 1 10 . 1 1 8 8 LEU C C 13 178.095 0.05 . 1 . . . . 806 LEU C . 17781 1 11 . 1 1 8 8 LEU CA C 13 48.985 0.05 . 1 . . . . 806 LEU CA . 17781 1 12 . 1 1 8 8 LEU CB C 13 37.732 0.05 . 1 . . . . 806 LEU CB . 17781 1 13 . 1 1 8 8 LEU N N 15 126.766 0.03 . 1 . . . . 806 LEU N . 17781 1 14 . 1 1 9 9 PRO C C 13 177.198 0.05 . 1 . . . . 807 PRO C . 17781 1 15 . 1 1 9 9 PRO CA C 13 62.867 0.05 . 1 . . . . 807 PRO CA . 17781 1 16 . 1 1 9 9 PRO CB C 13 28.868 0.05 . 1 . . . . 807 PRO CB . 17781 1 17 . 1 1 10 10 LEU H H 1 9.519 0.02 . 1 . . . . 808 LEU HN . 17781 1 18 . 1 1 10 10 LEU C C 13 174.521 0.05 . 1 . . . . 808 LEU C . 17781 1 19 . 1 1 10 10 LEU CA C 13 54.723 0.05 . 1 . . . . 808 LEU CA . 17781 1 20 . 1 1 10 10 LEU CB C 13 36.330 0.012 . 1 . . . . 808 LEU CB . 17781 1 21 . 1 1 10 10 LEU N N 15 115.155 0.03 . 1 . . . . 808 LEU N . 17781 1 22 . 1 1 11 11 GLU H H 1 7.070 0.02 . 1 . . . . 809 GLU HN . 17781 1 23 . 1 1 11 11 GLU C C 13 175.516 0.005 . 1 . . . . 809 GLU C . 17781 1 24 . 1 1 11 11 GLU CA C 13 55.925 0.05 . 1 . . . . 809 GLU CA . 17781 1 25 . 1 1 11 11 GLU CB C 13 25.972 0.012 . 1 . . . . 809 GLU CB . 17781 1 26 . 1 1 11 11 GLU N N 15 119.749 0.03 . 1 . . . . 809 GLU N . 17781 1 27 . 1 1 12 12 LEU H H 1 7.333 0.02 . 1 . . . . 810 LEU HN . 17781 1 28 . 1 1 12 12 LEU C C 13 175.671 0.05 . 1 . . . . 810 LEU C . 17781 1 29 . 1 1 12 12 LEU CA C 13 54.693 0.05 . 1 . . . . 810 LEU CA . 17781 1 30 . 1 1 12 12 LEU CB C 13 37.760 0.048 . 1 . . . . 810 LEU CB . 17781 1 31 . 1 1 12 12 LEU N N 15 120.405 0.03 . 1 . . . . 810 LEU N . 17781 1 32 . 1 1 13 13 ILE H H 1 7.221 0.02 . 1 . . . . 811 ILE HN . 17781 1 33 . 1 1 13 13 ILE C C 13 176.732 0.015 . 1 . . . . 811 ILE C . 17781 1 34 . 1 1 13 13 ILE CA C 13 60.731 0.05 . 1 . . . . 811 ILE CA . 17781 1 35 . 1 1 13 13 ILE CB C 13 32.293 0.012 . 1 . . . . 811 ILE CB . 17781 1 36 . 1 1 13 13 ILE N N 15 117.397 0.03 . 1 . . . . 811 ILE N . 17781 1 37 . 1 1 14 14 ASP H H 1 7.669 0.02 . 1 . . . . 812 ASP HN . 17781 1 38 . 1 1 14 14 ASP C C 13 175.620 0.004 . 1 . . . . 812 ASP C . 17781 1 39 . 1 1 14 14 ASP CA C 13 55.204 0.05 . 1 . . . . 812 ASP CA . 17781 1 40 . 1 1 14 14 ASP CB C 13 39.490 0.024 . 1 . . . . 812 ASP CB . 17781 1 41 . 1 1 14 14 ASP N N 15 120.514 0.03 . 1 . . . . 812 ASP N . 17781 1 42 . 1 1 15 15 LYS H H 1 7.321 0.02 . 1 . . . . 813 LYS HN . 17781 1 43 . 1 1 15 15 LYS C C 13 177.292 0.019 . 1 . . . . 813 LYS C . 17781 1 44 . 1 1 15 15 LYS CA C 13 54.633 0.05 . 1 . . . . 813 LYS CA . 17781 1 45 . 1 1 15 15 LYS CB C 13 28.904 0.012 . 1 . . . . 813 LYS CB . 17781 1 46 . 1 1 15 15 LYS N N 15 115.921 0.03 . 1 . . . . 813 LYS N . 17781 1 47 . 1 1 16 16 CYS H H 1 7.666 0.02 . 1 . . . . 814 CYS HN . 17781 1 48 . 1 1 16 16 CYS C C 13 179.724 0.05 . 1 . . . . 814 CYS C . 17781 1 49 . 1 1 16 16 CYS CA C 13 56.225 0.05 . 1 . . . . 814 CYS CA . 17781 1 50 . 1 1 16 16 CYS CB C 13 24.807 0.05 . 1 . . . . 814 CYS CB . 17781 1 51 . 1 1 16 16 CYS N N 15 116.905 0.03 . 1 . . . . 814 CYS N . 17781 1 52 . 1 1 17 17 ILE H H 1 7.343 0.02 . 1 . . . . 815 ILE HN . 17781 1 53 . 1 1 17 17 ILE C C 13 176.703 0.004 . 1 . . . . 815 ILE C . 17781 1 54 . 1 1 17 17 ILE CA C 13 61.240 0.05 . 1 . . . . 815 ILE CA . 17781 1 55 . 1 1 17 17 ILE CB C 13 33.158 0.012 . 1 . . . . 815 ILE CB . 17781 1 56 . 1 1 17 17 ILE N N 15 122.921 0.03 . 1 . . . . 815 ILE N . 17781 1 57 . 1 1 18 18 GLY H H 1 9.471 0.02 . 1 . . . . 816 GLY HN . 17781 1 58 . 1 1 18 18 GLY C C 13 180.727 0.005 . 1 . . . . 816 GLY C . 17781 1 59 . 1 1 18 18 GLY CA C 13 42.317 0.05 . 1 . . . . 816 GLY CA . 17781 1 60 . 1 1 18 18 GLY N N 15 117.767 0.03 . 1 . . . . 816 GLY N . 17781 1 61 . 1 1 19 19 SER H H 1 8.650 0.02 . 1 . . . . 817 SER HN . 17781 1 62 . 1 1 19 19 SER C C 13 172.198 0.005 . 1 . . . . 817 SER C . 17781 1 63 . 1 1 19 19 SER CA C 13 54.302 0.05 . 1 . . . . 817 SER CA . 17781 1 64 . 1 1 19 19 SER CB C 13 62.236 0.061 . 1 . . . . 817 SER CB . 17781 1 65 . 1 1 19 19 SER N N 15 117.944 0.03 . 1 . . . . 817 SER N . 17781 1 66 . 1 1 20 20 ASN H H 1 8.192 0.02 . 1 . . . . 818 ASN HN . 17781 1 67 . 1 1 20 20 ASN C C 13 180.280 0.009 . 1 . . . . 818 ASN C . 17781 1 68 . 1 1 20 20 ASN CA C 13 51.178 0.05 . 1 . . . . 818 ASN CA . 17781 1 69 . 1 1 20 20 ASN CB C 13 36.534 0.024 . 1 . . . . 818 ASN CB . 17781 1 70 . 1 1 20 20 ASN N N 15 119.272 0.03 . 1 . . . . 818 ASN N . 17781 1 71 . 1 1 21 21 LEU H H 1 9.039 0.02 . 1 . . . . 819 LEU HN . 17781 1 72 . 1 1 21 21 LEU C C 13 171.034 0.05 . 1 . . . . 819 LEU C . 17781 1 73 . 1 1 21 21 LEU CA C 13 51.809 0.05 . 1 . . . . 819 LEU CA . 17781 1 74 . 1 1 21 21 LEU CB C 13 43.852 0.060 . 1 . . . . 819 LEU CB . 17781 1 75 . 1 1 21 21 LEU N N 15 123.413 0.03 . 1 . . . . 819 LEU N . 17781 1 76 . 1 1 22 22 TRP H H 1 7.974 0.02 . 1 . . . . 820 TRP HN . 17781 1 77 . 1 1 22 22 TRP C C 13 180.699 0.015 . 1 . . . . 820 TRP C . 17781 1 78 . 1 1 22 22 TRP CA C 13 50.217 0.05 . 1 . . . . 820 TRP CA . 17781 1 79 . 1 1 22 22 TRP CB C 13 28.736 0.012 . 1 . . . . 820 TRP CB . 17781 1 80 . 1 1 22 22 TRP N N 15 128.280 0.03 . 1 . . . . 820 TRP N . 17781 1 81 . 1 1 23 23 VAL H H 1 10.004 0.02 . 1 . . . . 821 VAL HN . 17781 1 82 . 1 1 23 23 VAL C C 13 180.077 0.014 . 1 . . . . 821 VAL C . 17781 1 83 . 1 1 23 23 VAL CA C 13 58.208 0.05 . 1 . . . . 821 VAL CA . 17781 1 84 . 1 1 23 23 VAL CB C 13 31.560 0.024 . 1 . . . . 821 VAL CB . 17781 1 85 . 1 1 23 23 VAL N N 15 127.952 0.03 . 1 . . . . 821 VAL N . 17781 1 86 . 1 1 24 24 ILE H H 1 8.818 0.02 . 1 . . . . 822 ILE HN . 17781 1 87 . 1 1 24 24 ILE C C 13 178.065 0.009 . 1 . . . . 822 ILE C . 17781 1 88 . 1 1 24 24 ILE CA C 13 58.027 0.05 . 1 . . . . 822 ILE CA . 17781 1 89 . 1 1 24 24 ILE CB C 13 36.654 0.024 . 1 . . . . 822 ILE CB . 17781 1 90 . 1 1 24 24 ILE N N 15 127.022 0.03 . 1 . . . . 822 ILE N . 17781 1 91 . 1 1 25 25 MET H H 1 7.723 0.02 . 1 . . . . 823 MET HN . 17781 1 92 . 1 1 25 25 MET C C 13 179.436 0.015 . 1 . . . . 823 MET C . 17781 1 93 . 1 1 25 25 MET CA C 13 51.118 0.05 . 1 . . . . 823 MET CA . 17781 1 94 . 1 1 25 25 MET CB C 13 27.655 0.060 . 1 . . . . 823 MET CB . 17781 1 95 . 1 1 25 25 MET N N 15 125.053 0.03 . 1 . . . . 823 MET N . 17781 1 96 . 1 1 26 26 LYS H H 1 8.225 0.02 . 1 . . . . 824 LYS HN . 17781 1 97 . 1 1 26 26 LYS C C 13 176.915 0.003 . 1 . . . . 824 LYS C . 17781 1 98 . 1 1 26 26 LYS CA C 13 56.255 0.05 . 1 . . . . 824 LYS CA . 17781 1 99 . 1 1 26 26 LYS CB C 13 28.754 0.05 . 1 . . . . 824 LYS CB . 17781 1 100 . 1 1 26 26 LYS N N 15 117.342 0.03 . 1 . . . . 824 LYS N . 17781 1 101 . 1 1 27 27 SER H H 1 7.259 0.02 . 1 . . . . 825 SER HN . 17781 1 102 . 1 1 27 27 SER C C 13 180.132 0.05 . 1 . . . . 825 SER C . 17781 1 103 . 1 1 27 27 SER CA C 13 53.702 0.05 . 1 . . . . 825 SER CA . 17781 1 104 . 1 1 27 27 SER CB C 13 61.147 0.05 . 1 . . . . 825 SER CB . 17781 1 105 . 1 1 27 27 SER N N 15 114.089 0.03 . 1 . . . . 825 SER N . 17781 1 106 . 1 1 28 28 GLU C C 13 178.414 0.05 . 1 . . . . 826 GLU C . 17781 1 107 . 1 1 28 28 GLU CA C 13 53.309 0.05 . 1 . . . . 826 GLU CA . 17781 1 108 . 1 1 28 28 GLU CB C 13 23.917 0.05 . 1 . . . . 826 GLU CB . 17781 1 109 . 1 1 29 29 ARG H H 1 8.296 0.02 . 1 . . . . 827 ARG HN . 17781 1 110 . 1 1 29 29 ARG C C 13 180.301 0.05 . 1 . . . . 827 ARG C . 17781 1 111 . 1 1 29 29 ARG CA C 13 52.233 0.05 . 1 . . . . 827 ARG CA . 17781 1 112 . 1 1 29 29 ARG CB C 13 30.645 0.05 . 1 . . . . 827 ARG CB . 17781 1 113 . 1 1 29 29 ARG N N 15 125.108 0.03 . 1 . . . . 827 ARG N . 17781 1 114 . 1 1 30 30 GLU H H 1 8.483 0.02 . 1 . . . . 828 GLU HN . 17781 1 115 . 1 1 30 30 GLU C C 13 180.377 0.05 . 1 . . . . 828 GLU C . 17781 1 116 . 1 1 30 30 GLU CA C 13 50.578 0.05 . 1 . . . . 828 GLU CA . 17781 1 117 . 1 1 30 30 GLU CB C 13 31.124 0.05 . 1 . . . . 828 GLU CB . 17781 1 118 . 1 1 30 30 GLU N N 15 120.301 0.03 . 1 . . . . 828 GLU N . 17781 1 119 . 1 1 31 31 PHE H H 1 9.345 0.02 . 1 . . . . 829 PHE HN . 17781 1 120 . 1 1 31 31 PHE C C 13 179.916 0.05 . 1 . . . . 829 PHE C . 17781 1 121 . 1 1 31 31 PHE CA C 13 54.002 0.05 . 1 . . . . 829 PHE CA . 17781 1 122 . 1 1 31 31 PHE CB C 13 40.892 0.05 . 1 . . . . 829 PHE CB . 17781 1 123 . 1 1 31 31 PHE N N 15 117.178 0.03 . 1 . . . . 829 PHE N . 17781 1 124 . 1 1 32 32 ALA H H 1 9.153 0.02 . 1 . . . . 830 ALA HN . 17781 1 125 . 1 1 32 32 ALA C C 13 178.311 0.05 . 1 . . . . 830 ALA C . 17781 1 126 . 1 1 32 32 ALA CA C 13 48.264 0.05 . 1 . . . . 830 ALA CA . 17781 1 127 . 1 1 32 32 ALA CB C 13 19.057 0.05 . 1 . . . . 830 ALA CB . 17781 1 128 . 1 1 32 32 ALA N N 15 124.288 0.03 . 1 . . . . 830 ALA N . 17781 1 129 . 1 1 33 33 GLY H H 1 8.385 0.02 . 1 . . . . 831 GLY HN . 17781 1 130 . 1 1 33 33 GLY C C 13 173.870 0.05 . 1 . . . . 831 GLY C . 17781 1 131 . 1 1 33 33 GLY CA C 13 43.278 0.05 . 1 . . . . 831 GLY CA . 17781 1 132 . 1 1 33 33 GLY N N 15 108.811 0.03 . 1 . . . . 831 GLY N . 17781 1 133 . 1 1 34 34 THR H H 1 8.999 0.02 . 1 . . . . 832 THR HN . 17781 1 134 . 1 1 34 34 THR C C 13 179.982 0.05 . 1 . . . . 832 THR C . 17781 1 135 . 1 1 34 34 THR CA C 13 59.589 0.05 . 1 . . . . 832 THR CA . 17781 1 136 . 1 1 34 34 THR CB C 13 66.390 0.05 . 1 . . . . 832 THR CB . 17781 1 137 . 1 1 34 34 THR N N 15 119.202 0.03 . 1 . . . . 832 THR N . 17781 1 138 . 1 1 35 35 LEU H H 1 8.602 0.02 . 1 . . . . 833 LEU HN . 17781 1 139 . 1 1 35 35 LEU C C 13 178.846 0.05 . 1 . . . . 833 LEU C . 17781 1 140 . 1 1 35 35 LEU CA C 13 53.311 0.05 . 1 . . . . 833 LEU CA . 17781 1 141 . 1 1 35 35 LEU CB C 13 37.732 0.05 . 1 . . . . 833 LEU CB . 17781 1 142 . 1 1 35 35 LEU N N 15 129.155 0.03 . 1 . . . . 833 LEU N . 17781 1 143 . 1 1 36 36 VAL C C 13 178.433 0.05 . 1 . . . . 834 VAL C . 17781 1 144 . 1 1 36 36 VAL CA C 13 59.882 0.05 . 1 . . . . 834 VAL CA . 17781 1 145 . 1 1 36 36 VAL CB C 13 29.637 0.05 . 1 . . . . 834 VAL CB . 17781 1 146 . 1 1 37 37 GLY H H 1 7.269 0.02 . 1 . . . . 835 GLY HN . 17781 1 147 . 1 1 37 37 GLY C C 13 173.982 0.05 . 1 . . . . 835 GLY C . 17781 1 148 . 1 1 37 37 GLY CA C 13 43.008 0.05 . 1 . . . . 835 GLY CA . 17781 1 149 . 1 1 37 37 GLY N N 15 103.999 0.03 . 1 . . . . 835 GLY N . 17781 1 150 . 1 1 38 38 PHE H H 1 8.256 0.02 . 1 . . . . 836 PHE HN . 17781 1 151 . 1 1 38 38 PHE C C 13 171.757 0.05 . 1 . . . . 836 PHE C . 17781 1 152 . 1 1 38 38 PHE CA C 13 53.401 0.05 . 1 . . . . 836 PHE CA . 17781 1 153 . 1 1 38 38 PHE CB C 13 38.761 0.05 . 1 . . . . 836 PHE CB . 17781 1 154 . 1 1 38 38 PHE N N 15 115.647 0.03 . 1 . . . . 836 PHE N . 17781 1 155 . 1 1 39 39 ASP H H 1 7.924 0.02 . 1 . . . . 837 ASP HN . 17781 1 156 . 1 1 39 39 ASP C C 13 176.809 0.05 . 1 . . . . 837 ASP C . 17781 1 157 . 1 1 39 39 ASP CA C 13 49.136 0.05 . 1 . . . . 837 ASP CA . 17781 1 158 . 1 1 39 39 ASP CB C 13 40.389 0.05 . 1 . . . . 837 ASP CB . 17781 1 159 . 1 1 39 39 ASP N N 15 119.967 0.03 . 1 . . . . 837 ASP N . 17781 1 160 . 1 1 40 40 ASP H H 1 8.096 0.02 . 1 . . . . 838 ASP HN . 17781 1 161 . 1 1 40 40 ASP C C 13 178.123 0.05 . 1 . . . . 838 ASP C . 17781 1 162 . 1 1 40 40 ASP CA C 13 53.521 0.05 . 1 . . . . 838 ASP CA . 17781 1 163 . 1 1 40 40 ASP CB C 13 36.989 0.05 . 1 . . . . 838 ASP CB . 17781 1 164 . 1 1 40 40 ASP N N 15 115.811 0.03 . 1 . . . . 838 ASP N . 17781 1 165 . 1 1 41 41 TYR H H 1 7.848 0.02 . 1 . . . . 839 TYR HN . 17781 1 166 . 1 1 41 41 TYR C C 13 180.029 0.05 . 1 . . . . 839 TYR C . 17781 1 167 . 1 1 41 41 TYR CA C 13 54.002 0.05 . 1 . . . . 839 TYR CA . 17781 1 168 . 1 1 41 41 TYR CB C 13 34.404 0.05 . 1 . . . . 839 TYR CB . 17781 1 169 . 1 1 41 41 TYR N N 15 119.749 0.03 . 1 . . . . 839 TYR N . 17781 1 170 . 1 1 42 42 VAL H H 1 8.471 0.02 . 1 . . . . 840 VAL HN . 17781 1 171 . 1 1 42 42 VAL C C 13 178.555 0.05 . 1 . . . . 840 VAL C . 17781 1 172 . 1 1 42 42 VAL CA C 13 61.332 0.05 . 1 . . . . 840 VAL CA . 17781 1 173 . 1 1 42 42 VAL CB C 13 26.192 0.05 . 1 . . . . 840 VAL CB . 17781 1 174 . 1 1 42 42 VAL N N 15 117.671 0.03 . 1 . . . . 840 VAL N . 17781 1 175 . 1 1 43 43 ASN H H 1 8.226 0.02 . 1 . . . . 841 ASN HN . 17781 1 176 . 1 1 43 43 ASN C C 13 178.018 0.05 . 1 . . . . 841 ASN C . 17781 1 177 . 1 1 43 43 ASN CA C 13 51.268 0.05 . 1 . . . . 841 ASN CA . 17781 1 178 . 1 1 43 43 ASN CB C 13 34.739 0.05 . 1 . . . . 841 ASN CB . 17781 1 179 . 1 1 43 43 ASN N N 15 115.046 0.03 . 1 . . . . 841 ASN N . 17781 1 180 . 1 1 44 44 ILE H H 1 8.059 0.02 . 1 . . . . 842 ILE HN . 17781 1 181 . 1 1 44 44 ILE C C 13 171.147 0.05 . 1 . . . . 842 ILE C . 17781 1 182 . 1 1 44 44 ILE CA C 13 56.165 0.05 . 1 . . . . 842 ILE CA . 17781 1 183 . 1 1 44 44 ILE CB C 13 37.420 0.05 . 1 . . . . 842 ILE CB . 17781 1 184 . 1 1 44 44 ILE N N 15 116.052 0.03 . 1 . . . . 842 ILE N . 17781 1 185 . 1 1 45 45 VAL H H 1 8.307 0.02 . 1 . . . . 843 VAL HN . 17781 1 186 . 1 1 45 45 VAL C C 13 179.269 0.05 . 1 . . . . 843 VAL C . 17781 1 187 . 1 1 45 45 VAL CA C 13 57.787 0.05 . 1 . . . . 843 VAL CA . 17781 1 188 . 1 1 45 45 VAL CB C 13 29.184 0.05 . 1 . . . . 843 VAL CB . 17781 1 189 . 1 1 45 45 VAL N N 15 123.741 0.03 . 1 . . . . 843 VAL N . 17781 1 190 . 1 1 46 46 LEU H H 1 8.567 0.02 . 1 . . . . 844 LEU HN . 17781 1 191 . 1 1 46 46 LEU C C 13 180.280 0.05 . 1 . . . . 844 LEU C . 17781 1 192 . 1 1 46 46 LEU CA C 13 49.406 0.05 . 1 . . . . 844 LEU CA . 17781 1 193 . 1 1 46 46 LEU CB C 13 45.154 0.05 . 1 . . . . 844 LEU CB . 17781 1 194 . 1 1 46 46 LEU N N 15 127.569 0.03 . 1 . . . . 844 LEU N . 17781 1 195 . 1 1 47 47 LYS H H 1 8.914 0.02 . 1 . . . . 845 LYS HN . 17781 1 196 . 1 1 47 47 LYS C C 13 178.837 0.05 . 1 . . . . 845 LYS C . 17781 1 197 . 1 1 47 47 LYS CA C 13 51.188 0.05 . 1 . . . . 845 LYS CA . 17781 1 198 . 1 1 47 47 LYS CB C 13 33.518 0.05 . 1 . . . . 845 LYS CB . 17781 1 199 . 1 1 47 47 LYS N N 15 120.132 0.03 . 1 . . . . 845 LYS N . 17781 1 200 . 1 1 48 48 ASP H H 1 8.700 0.02 . 1 . . . . 846 ASP HN . 17781 1 201 . 1 1 48 48 ASP C C 13 179.278 0.05 . 1 . . . . 846 ASP C . 17781 1 202 . 1 1 48 48 ASP CA C 13 53.585 0.05 . 1 . . . . 846 ASP CA . 17781 1 203 . 1 1 48 48 ASP CB C 13 35.649 0.05 . 1 . . . . 846 ASP CB . 17781 1 204 . 1 1 48 48 ASP N N 15 122.866 0.03 . 1 . . . . 846 ASP N . 17781 1 205 . 1 1 49 49 VAL H H 1 8.301 0.02 . 1 . . . . 847 VAL HN . 17781 1 206 . 1 1 49 49 VAL C C 13 177.316 0.05 . 1 . . . . 847 VAL C . 17781 1 207 . 1 1 49 49 VAL CA C 13 57.847 0.05 . 1 . . . . 847 VAL CA . 17781 1 208 . 1 1 49 49 VAL CB C 13 32.728 0.05 . 1 . . . . 847 VAL CB . 17781 1 209 . 1 1 49 49 VAL N N 15 121.034 0.03 . 1 . . . . 847 VAL N . 17781 1 210 . 1 1 50 50 THR H H 1 9.282 0.02 . 1 . . . . 848 THR HN . 17781 1 211 . 1 1 50 50 THR C C 13 172.903 0.05 . 1 . . . . 848 THR C . 17781 1 212 . 1 1 50 50 THR CA C 13 59.920 0.05 . 1 . . . . 848 THR CA . 17781 1 213 . 1 1 50 50 THR CB C 13 66.726 0.05 . 1 . . . . 848 THR CB . 17781 1 214 . 1 1 50 50 THR N N 15 123.686 0.03 . 1 . . . . 848 THR N . 17781 1 215 . 1 1 51 51 GLU H H 1 9.314 0.02 . 1 . . . . 849 GLU HN . 17781 1 216 . 1 1 51 51 GLU C C 13 180.921 0.05 . 1 . . . . 849 GLU C . 17781 1 217 . 1 1 51 51 GLU CA C 13 50.848 0.05 . 1 . . . . 849 GLU CA . 17781 1 218 . 1 1 51 51 GLU CB C 13 28.801 0.05 . 1 . . . . 849 GLU CB . 17781 1 219 . 1 1 51 51 GLU N N 15 130.686 0.03 . 1 . . . . 849 GLU N . 17781 1 220 . 1 1 52 52 TYR H H 1 9.053 0.02 . 1 . . . . 850 TYR HN . 17781 1 221 . 1 1 52 52 TYR C C 13 179.916 0.05 . 1 . . . . 850 TYR C . 17781 1 222 . 1 1 52 52 TYR CA C 13 53.792 0.05 . 1 . . . . 850 TYR CA . 17781 1 223 . 1 1 52 52 TYR CB C 13 36.008 0.05 . 1 . . . . 850 TYR CB . 17781 1 224 . 1 1 52 52 TYR N N 15 124.616 0.03 . 1 . . . . 850 TYR N . 17781 1 225 . 1 1 53 53 ASP H H 1 7.961 0.02 . 1 . . . . 851 ASP HN . 17781 1 226 . 1 1 53 53 ASP C C 13 176.076 0.05 . 1 . . . . 851 ASP C . 17781 1 227 . 1 1 53 53 ASP CA C 13 50.277 0.05 . 1 . . . . 851 ASP CA . 17781 1 228 . 1 1 53 53 ASP CB C 13 38.354 0.05 . 1 . . . . 851 ASP CB . 17781 1 229 . 1 1 53 53 ASP N N 15 123.686 0.03 . 1 . . . . 851 ASP N . 17781 1 230 . 1 1 54 54 THR H H 1 7.737 0.02 . 1 . . . . 852 THR HN . 17781 1 231 . 1 1 54 54 THR C C 13 179.015 0.05 . 1 . . . . 852 THR C . 17781 1 232 . 1 1 54 54 THR CA C 13 60.611 0.05 . 1 . . . . 852 THR CA . 17781 1 233 . 1 1 54 54 THR CB C 13 64.188 0.05 . 1 . . . . 852 THR CB . 17781 1 234 . 1 1 54 54 THR N N 15 116.413 0.03 . 1 . . . . 852 THR N . 17781 1 235 . 1 1 55 55 VAL H H 1 8.640 0.02 . 1 . . . . 853 VAL HN . 17781 1 236 . 1 1 55 55 VAL C C 13 176.536 0.05 . 1 . . . . 853 VAL C . 17781 1 237 . 1 1 55 55 VAL CA C 13 62.533 0.05 . 1 . . . . 853 VAL CA . 17781 1 238 . 1 1 55 55 VAL CB C 13 28.514 0.05 . 1 . . . . 853 VAL CB . 17781 1 239 . 1 1 55 55 VAL N N 15 123.019 0.03 . 1 . . . . 853 VAL N . 17781 1 240 . 1 1 56 56 THR H H 1 7.845 0.02 . 1 . . . . 854 THR HN . 17781 1 241 . 1 1 56 56 THR C C 13 177.776 0.05 . 1 . . . . 854 THR C . 17781 1 242 . 1 1 56 56 THR CA C 13 59.469 0.05 . 1 . . . . 854 THR CA . 17781 1 243 . 1 1 56 56 THR CB C 13 67.300 0.05 . 1 . . . . 854 THR CB . 17781 1 244 . 1 1 56 56 THR N N 15 109.139 0.03 . 1 . . . . 854 THR N . 17781 1 245 . 1 1 57 57 GLY H H 1 8.056 0.02 . 1 . . . . 855 GLY HN . 17781 1 246 . 1 1 57 57 GLY C C 13 180.367 0.05 . 1 . . . . 855 GLY C . 17781 1 247 . 1 1 57 57 GLY CA C 13 42.887 0.05 . 1 . . . . 855 GLY CA . 17781 1 248 . 1 1 57 57 GLY N N 15 111.491 0.03 . 1 . . . . 855 GLY N . 17781 1 249 . 1 1 58 58 VAL H H 1 7.449 0.02 . 1 . . . . 856 VAL HN . 17781 1 250 . 1 1 58 58 VAL C C 13 178.884 0.05 . 1 . . . . 856 VAL C . 17781 1 251 . 1 1 58 58 VAL CA C 13 60.581 0.05 . 1 . . . . 856 VAL CA . 17781 1 252 . 1 1 58 58 VAL CB C 13 29.424 0.05 . 1 . . . . 856 VAL CB . 17781 1 253 . 1 1 58 58 VAL N N 15 121.663 0.03 . 1 . . . . 856 VAL N . 17781 1 254 . 1 1 59 59 THR H H 1 7.896 0.02 . 1 . . . . 857 THR HN . 17781 1 255 . 1 1 59 59 THR C C 13 180.386 0.05 . 1 . . . . 857 THR C . 17781 1 256 . 1 1 59 59 THR CA C 13 55.925 0.05 . 1 . . . . 857 THR CA . 17781 1 257 . 1 1 59 59 THR CB C 13 68.976 0.05 . 1 . . . . 857 THR CB . 17781 1 258 . 1 1 59 59 THR N N 15 117.288 0.03 . 1 . . . . 857 THR N . 17781 1 259 . 1 1 60 60 GLU H H 1 8.577 0.02 . 1 . . . . 858 GLU HN . 17781 1 260 . 1 1 60 60 GLU C C 13 180.546 0.05 . 1 . . . . 858 GLU C . 17781 1 261 . 1 1 60 60 GLU CA C 13 52.079 0.05 . 1 . . . . 858 GLU CA . 17781 1 262 . 1 1 60 60 GLU CB C 13 30.884 0.05 . 1 . . . . 858 GLU CB . 17781 1 263 . 1 1 60 60 GLU N N 15 121.034 0.03 . 1 . . . . 858 GLU N . 17781 1 264 . 1 1 61 61 LYS H H 1 8.237 0.02 . 1 . . . . 859 LYS HN . 17781 1 265 . 1 1 61 61 LYS C C 13 178.395 0.05 . 1 . . . . 859 LYS C . 17781 1 266 . 1 1 61 61 LYS CA C 13 51.359 0.05 . 1 . . . . 859 LYS CA . 17781 1 267 . 1 1 61 61 LYS CB C 13 31.124 0.05 . 1 . . . . 859 LYS CB . 17781 1 268 . 1 1 61 61 LYS N N 15 122.210 0.03 . 1 . . . . 859 LYS N . 17781 1 269 . 1 1 62 62 HIS H H 1 8.628 0.02 . 1 . . . . 860 HIS HN . 17781 1 270 . 1 1 62 62 HIS C C 13 179.128 0.05 . 1 . . . . 860 HIS C . 17781 1 271 . 1 1 62 62 HIS CA C 13 52.170 0.05 . 1 . . . . 860 HIS CA . 17781 1 272 . 1 1 62 62 HIS CB C 13 31.746 0.05 . 1 . . . . 860 HIS CB . 17781 1 273 . 1 1 62 62 HIS N N 15 119.113 0.03 . 1 . . . . 860 HIS N . 17781 1 274 . 1 1 63 63 SER C C 13 178.046 0.05 . 1 . . . . 861 SER C . 17781 1 275 . 1 1 63 63 SER CA C 13 57.922 0.05 . 1 . . . . 861 SER CA . 17781 1 276 . 1 1 63 63 SER CB C 13 59.701 0.05 . 1 . . . . 861 SER CB . 17781 1 277 . 1 1 64 64 GLU H H 1 8.328 0.02 . 1 . . . . 862 GLU HN . 17781 1 278 . 1 1 64 64 GLU C C 13 171.501 0.014 . 1 . . . . 862 GLU C . 17781 1 279 . 1 1 64 64 GLU CA C 13 54.182 0.05 . 1 . . . . 862 GLU CA . 17781 1 280 . 1 1 64 64 GLU CB C 13 29.855 0.05 . 1 . . . . 862 GLU CB . 17781 1 281 . 1 1 64 64 GLU N N 15 123.440 0.03 . 1 . . . . 862 GLU N . 17781 1 282 . 1 1 65 65 MET H H 1 8.520 0.02 . 1 . . . . 863 MET HN . 17781 1 283 . 1 1 65 65 MET C C 13 173.738 0.05 . 1 . . . . 863 MET C . 17781 1 284 . 1 1 65 65 MET CA C 13 51.238 0.05 . 1 . . . . 863 MET CA . 17781 1 285 . 1 1 65 65 MET CB C 13 34.236 0.05 . 1 . . . . 863 MET CB . 17781 1 286 . 1 1 65 65 MET N N 15 120.596 0.03 . 1 . . . . 863 MET N . 17781 1 287 . 1 1 66 66 LEU H H 1 8.379 0.02 . 1 . . . . 864 LEU HN . 17781 1 288 . 1 1 66 66 LEU C C 13 180.508 0.05 . 1 . . . . 864 LEU C . 17781 1 289 . 1 1 66 66 LEU CA C 13 49.947 0.05 . 1 . . . . 864 LEU CA . 17781 1 290 . 1 1 66 66 LEU CB C 13 41.419 0.05 . 1 . . . . 864 LEU CB . 17781 1 291 . 1 1 66 66 LEU N N 15 123.877 0.03 . 1 . . . . 864 LEU N . 17781 1 292 . 1 1 67 67 LEU H H 1 9.147 0.02 . 1 . . . . 865 LEU HN . 17781 1 293 . 1 1 67 67 LEU C C 13 179.663 0.05 . 1 . . . . 865 LEU C . 17781 1 294 . 1 1 67 67 LEU CA C 13 50.427 0.05 . 1 . . . . 865 LEU CA . 17781 1 295 . 1 1 67 67 LEU CB C 13 41.036 0.05 . 1 . . . . 865 LEU CB . 17781 1 296 . 1 1 67 67 LEU N N 15 128.936 0.03 . 1 . . . . 865 LEU N . 17781 1 297 . 1 1 68 68 ASN H H 1 7.509 0.02 . 1 . . . . 866 ASN HN . 17781 1 298 . 1 1 68 68 ASN C C 13 176.931 0.05 . 1 . . . . 866 ASN C . 17781 1 299 . 1 1 68 68 ASN CA C 13 51.268 0.05 . 1 . . . . 866 ASN CA . 17781 1 300 . 1 1 68 68 ASN CB C 13 36.511 0.05 . 1 . . . . 866 ASN CB . 17781 1 301 . 1 1 68 68 ASN N N 15 123.850 0.03 . 1 . . . . 866 ASN N . 17781 1 302 . 1 1 69 69 GLY H H 1 9.699 0.02 . 1 . . . . 867 GLY HN . 17781 1 303 . 1 1 69 69 GLY C C 13 177.372 0.05 . 1 . . . . 867 GLY C . 17781 1 304 . 1 1 69 69 GLY CA C 13 44.359 0.05 . 1 . . . . 867 GLY CA . 17781 1 305 . 1 1 69 69 GLY N N 15 114.936 0.03 . 1 . . . . 867 GLY N . 17781 1 306 . 1 1 70 70 ASN H H 1 8.527 0.02 . 1 . . . . 868 ASN HN . 17781 1 307 . 1 1 70 70 ASN C C 13 178.264 0.05 . 1 . . . . 868 ASN C . 17781 1 308 . 1 1 70 70 ASN CA C 13 53.011 0.05 . 1 . . . . 868 ASN CA . 17781 1 309 . 1 1 70 70 ASN CB C 13 35.529 0.05 . 1 . . . . 868 ASN CB . 17781 1 310 . 1 1 70 70 ASN N N 15 118.874 0.03 . 1 . . . . 868 ASN N . 17781 1 311 . 1 1 71 71 GLY H H 1 7.751 0.02 . 1 . . . . 869 GLY HN . 17781 1 312 . 1 1 71 71 GLY C C 13 171.184 0.05 . 1 . . . . 869 GLY C . 17781 1 313 . 1 1 71 71 GLY CA C 13 41.986 0.05 . 1 . . . . 869 GLY CA . 17781 1 314 . 1 1 71 71 GLY N N 15 104.928 0.03 . 1 . . . . 869 GLY N . 17781 1 315 . 1 1 72 72 MET H H 1 6.995 0.02 . 1 . . . . 870 MET HN . 17781 1 316 . 1 1 72 72 MET C C 13 179.682 0.05 . 1 . . . . 870 MET C . 17781 1 317 . 1 1 72 72 MET CA C 13 53.642 0.05 . 1 . . . . 870 MET CA . 17781 1 318 . 1 1 72 72 MET CB C 13 31.962 0.05 . 1 . . . . 870 MET CB . 17781 1 319 . 1 1 72 72 MET N N 15 120.296 0.03 . 1 . . . . 870 MET N . 17781 1 320 . 1 1 73 73 CYS H H 1 8.530 0.02 . 1 . . . . 871 CYS HN . 17781 1 321 . 1 1 73 73 CYS C C 13 180.808 0.05 . 1 . . . . 871 CYS C . 17781 1 322 . 1 1 73 73 CYS CA C 13 57.547 0.05 . 1 . . . . 871 CYS CA . 17781 1 323 . 1 1 73 73 CYS CB C 13 24.899 0.05 . 1 . . . . 871 CYS CB . 17781 1 324 . 1 1 73 73 CYS N N 15 117.096 0.03 . 1 . . . . 871 CYS N . 17781 1 325 . 1 1 74 74 MET H H 1 7.411 0.02 . 1 . . . . 872 MET HN . 17781 1 326 . 1 1 74 74 MET C C 13 171.428 0.05 . 1 . . . . 872 MET C . 17781 1 327 . 1 1 74 74 MET CA C 13 51.088 0.05 . 1 . . . . 872 MET CA . 17781 1 328 . 1 1 74 74 MET CB C 13 37.516 0.05 . 1 . . . . 872 MET CB . 17781 1 329 . 1 1 74 74 MET N N 15 114.061 0.03 . 1 . . . . 872 MET N . 17781 1 330 . 1 1 75 75 LEU H H 1 9.225 0.02 . 1 . . . . 873 LEU HN . 17781 1 331 . 1 1 75 75 LEU C C 13 179.663 0.05 . 1 . . . . 873 LEU C . 17781 1 332 . 1 1 75 75 LEU CA C 13 52.500 0.05 . 1 . . . . 873 LEU CA . 17781 1 333 . 1 1 75 75 LEU CB C 13 40.509 0.05 . 1 . . . . 873 LEU CB . 17781 1 334 . 1 1 75 75 LEU N N 15 122.374 0.03 . 1 . . . . 873 LEU N . 17781 1 335 . 1 1 76 76 ILE H H 1 9.608 0.02 . 1 . . . . 874 ILE HN . 17781 1 336 . 1 1 76 76 ILE CA C 13 56.886 0.05 . 1 . . . . 874 ILE CA . 17781 1 337 . 1 1 76 76 ILE CB C 13 35.765 0.05 . 1 . . . . 874 ILE CB . 17781 1 338 . 1 1 76 76 ILE N N 15 124.561 0.03 . 1 . . . . 874 ILE N . 17781 1 339 . 1 1 77 77 PRO C C 13 177.550 0.05 . 1 . . . . 875 PRO C . 17781 1 340 . 1 1 77 77 PRO CA C 13 60.881 0.05 . 1 . . . . 875 PRO CA . 17781 1 341 . 1 1 77 77 PRO CB C 13 29.325 0.05 . 1 . . . . 875 PRO CB . 17781 1 342 . 1 1 78 78 GLY H H 1 8.499 0.02 . 1 . . . . 876 GLY HN . 17781 1 343 . 1 1 78 78 GLY C C 13 173.129 0.05 . 1 . . . . 876 GLY C . 17781 1 344 . 1 1 78 78 GLY CA C 13 42.437 0.05 . 1 . . . . 876 GLY CA . 17781 1 345 . 1 1 78 78 GLY N N 15 113.132 0.03 . 1 . . . . 876 GLY N . 17781 1 346 . 1 1 79 79 GLY H H 1 7.371 0.02 . 1 . . . . 877 GLY HN . 17781 1 347 . 1 1 79 79 GLY C C 13 173.129 0.05 . 1 . . . . 877 GLY C . 17781 1 348 . 1 1 79 79 GLY CA C 13 41.536 0.05 . 1 . . . . 877 GLY CA . 17781 1 349 . 1 1 79 79 GLY N N 15 105.257 0.03 . 1 . . . . 877 GLY N . 17781 1 350 . 1 1 80 80 LYS H H 1 7.861 0.02 . 1 . . . . 878 LYS HN . 17781 1 351 . 1 1 80 80 LYS C C 13 180.330 0.05 . 1 . . . . 878 LYS C . 17781 1 352 . 1 1 80 80 LYS CA C 13 50.788 0.05 . 1 . . . . 878 LYS CA . 17781 1 353 . 1 1 80 80 LYS CB C 13 30.453 0.05 . 1 . . . . 878 LYS CB . 17781 1 354 . 1 1 80 80 LYS N N 15 121.882 0.03 . 1 . . . . 878 LYS N . 17781 1 355 . 1 1 93 93 LEU C C 13 176.687 0.05 . 1 . . . . 1009 LEU C . 17781 1 356 . 1 1 93 93 LEU CA C 13 53.702 0.05 . 1 . . . . 1009 LEU CA . 17781 1 357 . 1 1 93 93 LEU CB C 13 38.306 0.05 . 1 . . . . 1009 LEU CB . 17781 1 358 . 1 1 94 94 ASN H H 1 7.669 0.02 . 1 . . . . 1010 ASN HN . 17781 1 359 . 1 1 94 94 ASN C C 13 176.621 0.05 . 1 . . . . 1010 ASN C . 17781 1 360 . 1 1 94 94 ASN CA C 13 53.251 0.05 . 1 . . . . 1010 ASN CA . 17781 1 361 . 1 1 94 94 ASN CB C 13 35.936 0.05 . 1 . . . . 1010 ASN CB . 17781 1 362 . 1 1 94 94 ASN N N 15 113.842 0.03 . 1 . . . . 1010 ASN N . 17781 1 363 . 1 1 95 95 LYS H H 1 7.603 0.02 . 1 . . . . 1011 LYS HN . 17781 1 364 . 1 1 95 95 LYS C C 13 176.640 0.05 . 1 . . . . 1011 LYS C . 17781 1 365 . 1 1 95 95 LYS CA C 13 55.534 0.05 . 1 . . . . 1011 LYS CA . 17781 1 366 . 1 1 95 95 LYS CB C 13 28.490 0.05 . 1 . . . . 1011 LYS CB . 17781 1 367 . 1 1 95 95 LYS N N 15 119.530 0.03 . 1 . . . . 1011 LYS N . 17781 1 368 . 1 1 96 96 VAL H H 1 7.011 0.02 . 1 . . . . 1012 VAL HN . 17781 1 369 . 1 1 96 96 VAL C C 13 179.860 0.05 . 1 . . . . 1012 VAL C . 17781 1 370 . 1 1 96 96 VAL CA C 13 57.907 0.05 . 1 . . . . 1012 VAL CA . 17781 1 371 . 1 1 96 96 VAL CB C 13 27.317 0.05 . 1 . . . . 1012 VAL CB . 17781 1 372 . 1 1 96 96 VAL N N 15 111.600 0.03 . 1 . . . . 1012 VAL N . 17781 1 373 . 1 1 97 97 ILE H H 1 6.697 0.02 . 1 . . . . 1013 ILE HN . 17781 1 374 . 1 1 97 97 ILE C C 13 176.442 0.05 . 1 . . . . 1013 ILE C . 17781 1 375 . 1 1 97 97 ILE CA C 13 61.001 0.05 . 1 . . . . 1013 ILE CA . 17781 1 376 . 1 1 97 97 ILE CB C 13 33.518 0.05 . 1 . . . . 1013 ILE CB . 17781 1 377 . 1 1 97 97 ILE N N 15 122.046 0.03 . 1 . . . . 1013 ILE N . 17781 1 378 . 1 1 98 98 GLY H H 1 9.619 0.02 . 1 . . . . 1014 GLY HN . 17781 1 379 . 1 1 98 98 GLY C C 13 180.865 0.05 . 1 . . . . 1014 GLY C . 17781 1 380 . 1 1 98 98 GLY CA C 13 42.166 0.05 . 1 . . . . 1014 GLY CA . 17781 1 381 . 1 1 98 98 GLY N N 15 117.342 0.03 . 1 . . . . 1014 GLY N . 17781 1 382 . 1 1 99 99 LYS H H 1 8.418 0.02 . 1 . . . . 1015 LYS HN . 17781 1 383 . 1 1 99 99 LYS C C 13 180.170 0.05 . 1 . . . . 1015 LYS C . 17781 1 384 . 1 1 99 99 LYS CA C 13 51.058 0.05 . 1 . . . . 1015 LYS CA . 17781 1 385 . 1 1 99 99 LYS CB C 13 30.429 0.05 . 1 . . . . 1015 LYS CB . 17781 1 386 . 1 1 99 99 LYS N N 15 121.541 0.03 . 1 . . . . 1015 LYS N . 17781 1 387 . 1 1 100 100 LYS H H 1 8.229 0.02 . 1 . . . . 1016 LYS HN . 17781 1 388 . 1 1 100 100 LYS C C 13 178.320 0.05 . 1 . . . . 1016 LYS C . 17781 1 389 . 1 1 100 100 LYS CA C 13 53.642 0.05 . 1 . . . . 1016 LYS CA . 17781 1 390 . 1 1 100 100 LYS CB C 13 29.855 0.05 . 1 . . . . 1016 LYS CB . 17781 1 391 . 1 1 100 100 LYS N N 15 120.186 0.03 . 1 . . . . 1016 LYS N . 17781 1 392 . 1 1 101 101 VAL H H 1 8.913 0.02 . 1 . . . . 1017 VAL HN . 17781 1 393 . 1 1 101 101 VAL C C 13 171.513 0.05 . 1 . . . . 1017 VAL C . 17781 1 394 . 1 1 101 101 VAL CA C 13 56.075 0.05 . 1 . . . . 1017 VAL CA . 17781 1 395 . 1 1 101 101 VAL CB C 13 32.632 0.05 . 1 . . . . 1017 VAL CB . 17781 1 396 . 1 1 101 101 VAL N N 15 116.850 0.03 . 1 . . . . 1017 VAL N . 17781 1 397 . 1 1 102 102 LEU H H 1 8.807 0.02 . 1 . . . . 1018 LEU HN . 17781 1 398 . 1 1 102 102 LEU C C 13 179.719 0.05 . 1 . . . . 1018 LEU C . 17781 1 399 . 1 1 102 102 LEU CA C 13 50.578 0.05 . 1 . . . . 1018 LEU CA . 17781 1 400 . 1 1 102 102 LEU CB C 13 41.993 0.05 . 1 . . . . 1018 LEU CB . 17781 1 401 . 1 1 102 102 LEU N N 15 122.264 0.03 . 1 . . . . 1018 LEU N . 17781 1 402 . 1 1 103 103 ILE H H 1 9.694 0.02 . 1 . . . . 1019 ILE HN . 17781 1 403 . 1 1 103 103 ILE C C 13 171.016 0.009 . 1 . . . . 1019 ILE C . 17781 1 404 . 1 1 103 103 ILE CA C 13 56.826 0.05 . 1 . . . . 1019 ILE CA . 17781 1 405 . 1 1 103 103 ILE CB C 13 37.013 0.05 . 1 . . . . 1019 ILE CB . 17781 1 406 . 1 1 103 103 ILE N N 15 129.046 0.03 . 1 . . . . 1019 ILE N . 17781 1 407 . 1 1 104 104 ARG H H 1 7.090 0.02 . 1 . . . . 1020 ARG HN . 17781 1 408 . 1 1 104 104 ARG C C 13 178.546 0.05 . 1 . . . . 1020 ARG C . 17781 1 409 . 1 1 104 104 ARG CA C 13 51.869 0.05 . 1 . . . . 1020 ARG CA . 17781 1 410 . 1 1 104 104 ARG CB C 13 28.083 0.05 . 1 . . . . 1020 ARG CB . 17781 1 411 . 1 1 104 104 ARG N N 15 127.350 0.03 . 1 . . . . 1020 ARG N . 17781 1 412 . 1 1 105 105 LEU H H 1 8.872 0.02 . 1 . . . . 1021 LEU HN . 17781 1 413 . 1 1 105 105 LEU C C 13 175.795 0.05 . 1 . . . . 1021 LEU C . 17781 1 414 . 1 1 105 105 LEU CA C 13 47.934 0.05 . 1 . . . . 1021 LEU CA . 17781 1 415 . 1 1 105 105 LEU CB C 13 39.479 0.05 . 1 . . . . 1021 LEU CB . 17781 1 416 . 1 1 105 105 LEU N N 15 124.708 0.03 . 1 . . . . 1021 LEU N . 17781 1 417 . 1 1 107 107 SER C C 13 179.177 0.05 . 1 . . . . 1023 SER C . 17781 1 418 . 1 1 107 107 SER CA C 13 55.148 0.05 . 1 . . . . 1023 SER CA . 17781 1 419 . 1 1 107 107 SER CB C 13 60.662 0.05 . 1 . . . . 1023 SER CB . 17781 1 420 . 1 1 108 108 GLY H H 1 8.023 0.02 . 1 . . . . 1024 GLY HN . 17781 1 421 . 1 1 108 108 GLY C C 13 171.275 0.005 . 1 . . . . 1024 GLY C . 17781 1 422 . 1 1 108 108 GLY CA C 13 42.587 0.05 . 1 . . . . 1024 GLY CA . 17781 1 423 . 1 1 108 108 GLY N N 15 110.507 0.03 . 1 . . . . 1024 GLY N . 17781 1 424 . 1 1 109 109 VAL H H 1 6.759 0.02 . 1 . . . . 1025 VAL HN . 17781 1 425 . 1 1 109 109 VAL C C 13 171.765 0.014 . 1 . . . . 1025 VAL C . 17781 1 426 . 1 1 109 109 VAL CA C 13 60.100 0.05 . 1 . . . . 1025 VAL CA . 17781 1 427 . 1 1 109 109 VAL CB C 13 30.154 0.036 . 1 . . . . 1025 VAL CB . 17781 1 428 . 1 1 109 109 VAL N N 15 123.249 0.03 . 1 . . . . 1025 VAL N . 17781 1 429 . 1 1 110 110 ASP H H 1 8.383 0.02 . 1 . . . . 1026 ASP HN . 17781 1 430 . 1 1 110 110 ASP C C 13 179.419 0.05 . 1 . . . . 1026 ASP C . 17781 1 431 . 1 1 110 110 ASP CA C 13 49.766 0.05 . 1 . . . . 1026 ASP CA . 17781 1 432 . 1 1 110 110 ASP CB C 13 42.353 0.05 . 1 . . . . 1026 ASP CB . 17781 1 433 . 1 1 110 110 ASP N N 15 124.999 0.03 . 1 . . . . 1026 ASP N . 17781 1 434 . 1 1 111 111 TYR H H 1 9.473 0.02 . 1 . . . . 1027 TYR HN . 17781 1 435 . 1 1 111 111 TYR C C 13 178.884 0.05 . 1 . . . . 1027 TYR C . 17781 1 436 . 1 1 111 111 TYR CA C 13 53.491 0.05 . 1 . . . . 1027 TYR CA . 17781 1 437 . 1 1 111 111 TYR CB C 13 38.067 0.05 . 1 . . . . 1027 TYR CB . 17781 1 438 . 1 1 111 111 TYR N N 15 117.780 0.03 . 1 . . . . 1027 TYR N . 17781 1 439 . 1 1 112 112 LYS H H 1 9.096 0.02 . 1 . . . . 1028 LYS HN . 17781 1 440 . 1 1 112 112 LYS C C 13 178.409 0.005 . 1 . . . . 1028 LYS C . 17781 1 441 . 1 1 112 112 LYS CA C 13 51.599 0.05 . 1 . . . . 1028 LYS CA . 17781 1 442 . 1 1 112 112 LYS CB C 13 33.326 0.05 . 1 . . . . 1028 LYS CB . 17781 1 443 . 1 1 112 112 LYS N N 15 120.624 0.03 . 1 . . . . 1028 LYS N . 17781 1 444 . 1 1 113 113 GLY H H 1 8.131 0.02 . 1 . . . . 1029 GLY HN . 17781 1 445 . 1 1 113 113 GLY C C 13 173.973 0.05 . 1 . . . . 1029 GLY C . 17781 1 446 . 1 1 113 113 GLY CA C 13 42.617 0.05 . 1 . . . . 1029 GLY CA . 17781 1 447 . 1 1 113 113 GLY N N 15 108.428 0.03 . 1 . . . . 1029 GLY N . 17781 1 448 . 1 1 114 114 ILE H H 1 8.694 0.02 . 1 . . . . 1030 ILE HN . 17781 1 449 . 1 1 114 114 ILE C C 13 177.973 0.05 . 1 . . . . 1030 ILE C . 17781 1 450 . 1 1 114 114 ILE CA C 13 56.345 0.05 . 1 . . . . 1030 ILE CA . 17781 1 451 . 1 1 114 114 ILE CB C 13 35.218 0.05 . 1 . . . . 1030 ILE CB . 17781 1 452 . 1 1 114 114 ILE N N 15 120.670 0.03 . 1 . . . . 1030 ILE N . 17781 1 453 . 1 1 115 115 LEU H H 1 8.156 0.02 . 1 . . . . 1031 LEU HN . 17781 1 454 . 1 1 115 115 LEU C C 13 179.347 0.019 . 1 . . . . 1031 LEU C . 17781 1 455 . 1 1 115 115 LEU CA C 13 53.191 0.05 . 1 . . . . 1031 LEU CA . 17781 1 456 . 1 1 115 115 LEU CB C 13 37.851 0.05 . 1 . . . . 1031 LEU CB . 17781 1 457 . 1 1 115 115 LEU N N 15 129.155 0.03 . 1 . . . . 1031 LEU N . 17781 1 458 . 1 1 116 116 SER H H 1 9.422 0.02 . 1 . . . . 1032 SER HN . 17781 1 459 . 1 1 116 116 SER C C 13 179.592 0.014 . 1 . . . . 1032 SER C . 17781 1 460 . 1 1 116 116 SER CA C 13 56.676 0.05 . 1 . . . . 1032 SER CA . 17781 1 461 . 1 1 116 116 SER CB C 13 61.483 0.096 . 1 . . . . 1032 SER CB . 17781 1 462 . 1 1 116 116 SER N N 15 125.764 0.03 . 1 . . . . 1032 SER N . 17781 1 463 . 1 1 117 117 CYS H H 1 7.819 0.02 . 1 . . . . 1033 CYS HN . 17781 1 464 . 1 1 117 117 CYS C C 13 174.195 0.003 . 1 . . . . 1033 CYS C . 17781 1 465 . 1 1 117 117 CYS CA C 13 54.813 0.05 . 1 . . . . 1033 CYS CA . 17781 1 466 . 1 1 117 117 CYS CB C 13 26.484 0.077 . 1 . . . . 1033 CYS CB . 17781 1 467 . 1 1 117 117 CYS N N 15 114.225 0.03 . 1 . . . . 1033 CYS N . 17781 1 468 . 1 1 118 118 LEU H H 1 8.191 0.02 . 1 . . . . 1034 LEU HN . 17781 1 469 . 1 1 118 118 LEU C C 13 179.134 0.006 . 1 . . . . 1034 LEU C . 17781 1 470 . 1 1 118 118 LEU CA C 13 51.959 0.05 . 1 . . . . 1034 LEU CA . 17781 1 471 . 1 1 118 118 LEU CB C 13 42.076 0.035 . 1 . . . . 1034 LEU CB . 17781 1 472 . 1 1 118 118 LEU N N 15 119.803 0.03 . 1 . . . . 1034 LEU N . 17781 1 473 . 1 1 119 119 ASP H H 1 7.957 0.02 . 1 . . . . 1035 ASP HN . 17781 1 474 . 1 1 119 119 ASP C C 13 176.283 0.05 . 1 . . . . 1035 ASP C . 17781 1 475 . 1 1 119 119 ASP CA C 13 49.076 0.05 . 1 . . . . 1035 ASP CA . 17781 1 476 . 1 1 119 119 ASP CB C 13 40.222 0.05 . 1 . . . . 1035 ASP CB . 17781 1 477 . 1 1 119 119 ASP N N 15 120.624 0.03 . 1 . . . . 1035 ASP N . 17781 1 478 . 1 1 120 120 GLY C C 13 180.082 0.05 . 1 . . . . 1036 GLY C . 17781 1 479 . 1 1 120 120 GLY CA C 13 42.887 0.05 . 1 . . . . 1036 GLY CA . 17781 1 480 . 1 1 121 121 TYR H H 1 8.448 0.02 . 1 . . . . 1037 TYR HN . 17781 1 481 . 1 1 121 121 TYR C C 13 179.297 0.05 . 1 . . . . 1037 TYR C . 17781 1 482 . 1 1 121 121 TYR CA C 13 54.212 0.05 . 1 . . . . 1037 TYR CA . 17781 1 483 . 1 1 121 121 TYR CB C 13 34.763 0.05 . 1 . . . . 1037 TYR CB . 17781 1 484 . 1 1 121 121 TYR N N 15 121.280 0.03 . 1 . . . . 1037 TYR N . 17781 1 485 . 1 1 122 122 MET H H 1 8.027 0.02 . 1 . . . . 1038 MET HN . 17781 1 486 . 1 1 122 122 MET C C 13 179.334 0.05 . 1 . . . . 1038 MET C . 17781 1 487 . 1 1 122 122 MET CA C 13 54.843 0.05 . 1 . . . . 1038 MET CA . 17781 1 488 . 1 1 122 122 MET CB C 13 27.979 0.024 . 1 . . . . 1038 MET CB . 17781 1 489 . 1 1 122 122 MET N N 15 114.772 0.03 . 1 . . . . 1038 MET N . 17781 1 490 . 1 1 123 123 ASN H H 1 8.570 0.02 . 1 . . . . 1039 ASN HN . 17781 1 491 . 1 1 123 123 ASN C C 13 180.855 0.05 . 1 . . . . 1039 ASN C . 17781 1 492 . 1 1 123 123 ASN CA C 13 51.419 0.05 . 1 . . . . 1039 ASN CA . 17781 1 493 . 1 1 123 123 ASN CB C 13 34.924 0.05 . 1 . . . . 1039 ASN CB . 17781 1 494 . 1 1 123 123 ASN N N 15 117.944 0.03 . 1 . . . . 1039 ASN N . 17781 1 495 . 1 1 124 124 LEU H H 1 9.074 0.02 . 1 . . . . 1040 LEU HN . 17781 1 496 . 1 1 124 124 LEU C C 13 179.625 0.05 . 1 . . . . 1040 LEU C . 17781 1 497 . 1 1 124 124 LEU CA C 13 50.517 0.05 . 1 . . . . 1040 LEU CA . 17781 1 498 . 1 1 124 124 LEU CB C 13 40.341 0.05 . 1 . . . . 1040 LEU CB . 17781 1 499 . 1 1 124 124 LEU N N 15 121.252 0.03 . 1 . . . . 1040 LEU N . 17781 1 500 . 1 1 125 125 ALA H H 1 8.376 0.02 . 1 . . . . 1041 ALA HN . 17781 1 501 . 1 1 125 125 ALA C C 13 179.024 0.05 . 1 . . . . 1041 ALA C . 17781 1 502 . 1 1 125 125 ALA CA C 13 47.664 0.05 . 1 . . . . 1041 ALA CA . 17781 1 503 . 1 1 125 125 ALA CB C 13 17.788 0.05 . 1 . . . . 1041 ALA CB . 17781 1 504 . 1 1 125 125 ALA N N 15 124.178 0.03 . 1 . . . . 1041 ALA N . 17781 1 505 . 1 1 126 126 LEU H H 1 8.938 0.02 . 1 . . . . 1042 LEU HN . 17781 1 506 . 1 1 126 126 LEU C C 13 177.635 0.05 . 1 . . . . 1042 LEU C . 17781 1 507 . 1 1 126 126 LEU CA C 13 50.818 0.05 . 1 . . . . 1042 LEU CA . 17781 1 508 . 1 1 126 126 LEU CB C 13 42.137 0.05 . 1 . . . . 1042 LEU CB . 17781 1 509 . 1 1 126 126 LEU N N 15 125.655 0.03 . 1 . . . . 1042 LEU N . 17781 1 510 . 1 1 127 127 GLU H H 1 8.917 0.02 . 1 . . . . 1043 GLU HN . 17781 1 511 . 1 1 127 127 GLU C C 13 178.909 0.004 . 1 . . . . 1043 GLU C . 17781 1 512 . 1 1 127 127 GLU CA C 13 51.749 0.05 . 1 . . . . 1043 GLU CA . 17781 1 513 . 1 1 127 127 GLU CB C 13 29.520 0.05 . 1 . . . . 1043 GLU CB . 17781 1 514 . 1 1 127 127 GLU N N 15 120.733 0.03 . 1 . . . . 1043 GLU N . 17781 1 515 . 1 1 128 128 ARG H H 1 8.767 0.02 . 1 . . . . 1044 ARG HN . 17781 1 516 . 1 1 128 128 ARG C C 13 178.560 0.005 . 1 . . . . 1044 ARG C . 17781 1 517 . 1 1 128 128 ARG CA C 13 54.242 0.05 . 1 . . . . 1044 ARG CA . 17781 1 518 . 1 1 128 128 ARG CB C 13 24.386 0.012 . 1 . . . . 1044 ARG CB . 17781 1 519 . 1 1 128 128 ARG N N 15 118.874 0.03 . 1 . . . . 1044 ARG N . 17781 1 520 . 1 1 129 129 THR H H 1 8.797 0.02 . 1 . . . . 1045 THR HN . 17781 1 521 . 1 1 129 129 THR C C 13 179.428 0.023 . 1 . . . . 1045 THR C . 17781 1 522 . 1 1 129 129 THR CA C 13 61.422 0.05 . 1 . . . . 1045 THR CA . 17781 1 523 . 1 1 129 129 THR CB C 13 66.154 0.012 . 1 . . . . 1045 THR CB . 17781 1 524 . 1 1 129 129 THR N N 15 116.249 0.03 . 1 . . . . 1045 THR N . 17781 1 525 . 1 1 130 130 GLU H H 1 9.438 0.02 . 1 . . . . 1046 GLU HN . 17781 1 526 . 1 1 130 130 GLU C C 13 171.213 0.019 . 1 . . . . 1046 GLU C . 17781 1 527 . 1 1 130 130 GLU CA C 13 52.049 0.05 . 1 . . . . 1046 GLU CA . 17781 1 528 . 1 1 130 130 GLU CB C 13 31.127 0.024 . 1 . . . . 1046 GLU CB . 17781 1 529 . 1 1 130 130 GLU N N 15 128.171 0.03 . 1 . . . . 1046 GLU N . 17781 1 530 . 1 1 131 131 GLU H H 1 8.415 0.02 . 1 . . . . 1047 GLU HN . 17781 1 531 . 1 1 131 131 GLU C C 13 180.727 0.005 . 1 . . . . 1047 GLU C . 17781 1 532 . 1 1 131 131 GLU CA C 13 51.479 0.05 . 1 . . . . 1047 GLU CA . 17781 1 533 . 1 1 131 131 GLU CB C 13 31.848 0.024 . 1 . . . . 1047 GLU CB . 17781 1 534 . 1 1 131 131 GLU N N 15 125.436 0.03 . 1 . . . . 1047 GLU N . 17781 1 535 . 1 1 132 132 TYR H H 1 9.357 0.02 . 1 . . . . 1048 TYR HN . 17781 1 536 . 1 1 132 132 TYR C C 13 179.497 0.009 . 1 . . . . 1048 TYR C . 17781 1 537 . 1 1 132 132 TYR CA C 13 53.732 0.05 . 1 . . . . 1048 TYR CA . 17781 1 538 . 1 1 132 132 TYR CB C 13 39.094 0.060 . 1 . . . . 1048 TYR CB . 17781 1 539 . 1 1 132 132 TYR N N 15 125.436 0.03 . 1 . . . . 1048 TYR N . 17781 1 540 . 1 1 133 133 VAL H H 1 8.577 0.02 . 1 . . . . 1049 VAL HN . 17781 1 541 . 1 1 133 133 VAL C C 13 177.283 0.05 . 1 . . . . 1049 VAL C . 17781 1 542 . 1 1 133 133 VAL CA C 13 58.898 0.05 . 1 . . . . 1049 VAL CA . 17781 1 543 . 1 1 133 133 VAL CB C 13 30.358 0.05 . 1 . . . . 1049 VAL CB . 17781 1 544 . 1 1 133 133 VAL N N 15 121.389 0.03 . 1 . . . . 1049 VAL N . 17781 1 545 . 1 1 134 134 ASN C C 13 178.923 0.05 . 1 . . . . 1050 ASN C . 17781 1 546 . 1 1 134 134 ASN CA C 13 51.539 0.05 . 1 . . . . 1050 ASN CA . 17781 1 547 . 1 1 134 134 ASN CB C 13 34.476 0.05 . 1 . . . . 1050 ASN CB . 17781 1 548 . 1 1 135 135 GLY H H 1 8.820 0.02 . 1 . . . . 1051 GLY HN . 17781 1 549 . 1 1 135 135 GLY C C 13 180.893 0.05 . 1 . . . . 1051 GLY C . 17781 1 550 . 1 1 135 135 GLY CA C 13 42.677 0.05 . 1 . . . . 1051 GLY CA . 17781 1 551 . 1 1 135 135 GLY N N 15 103.616 0.03 . 1 . . . . 1051 GLY N . 17781 1 552 . 1 1 136 136 LYS H H 1 7.735 0.02 . 1 . . . . 1052 LYS HN . 17781 1 553 . 1 1 136 136 LYS C C 13 179.710 0.05 . 1 . . . . 1052 LYS C . 17781 1 554 . 1 1 136 136 LYS CA C 13 51.599 0.05 . 1 . . . . 1052 LYS CA . 17781 1 555 . 1 1 136 136 LYS CB C 13 30.860 0.05 . 1 . . . . 1052 LYS CB . 17781 1 556 . 1 1 136 136 LYS N N 15 122.319 0.03 . 1 . . . . 1052 LYS N . 17781 1 557 . 1 1 137 137 LYS C C 13 177.179 0.05 . 1 . . . . 1053 LYS C . 17781 1 558 . 1 1 137 137 LYS CA C 13 53.852 0.05 . 1 . . . . 1053 LYS CA . 17781 1 559 . 1 1 137 137 LYS CB C 13 28.227 0.05 . 1 . . . . 1053 LYS CB . 17781 1 560 . 1 1 138 138 THR H H 1 9.059 0.02 . 1 . . . . 1054 THR HN . 17781 1 561 . 1 1 138 138 THR C C 13 179.168 0.009 . 1 . . . . 1054 THR C . 17781 1 562 . 1 1 138 138 THR CA C 13 59.701 0.05 . 1 . . . . 1054 THR CA . 17781 1 563 . 1 1 138 138 THR CB C 13 66.246 0.05 . 1 . . . . 1054 THR CB . 17781 1 564 . 1 1 138 138 THR N N 15 121.444 0.03 . 1 . . . . 1054 THR N . 17781 1 565 . 1 1 139 139 ASN H H 1 7.420 0.02 . 1 . . . . 1055 ASN HN . 17781 1 566 . 1 1 139 139 ASN C C 13 171.444 0.005 . 1 . . . . 1055 ASN C . 17781 1 567 . 1 1 139 139 ASN CA C 13 50.007 0.05 . 1 . . . . 1055 ASN CA . 17781 1 568 . 1 1 139 139 ASN CB C 13 40.006 0.05 . 1 . . . . 1055 ASN CB . 17781 1 569 . 1 1 139 139 ASN N N 15 119.202 0.03 . 1 . . . . 1055 ASN N . 17781 1 570 . 1 1 140 140 VAL H H 1 8.040 0.02 . 1 . . . . 1056 VAL HN . 17781 1 571 . 1 1 140 140 VAL C C 13 180.096 0.014 . 1 . . . . 1056 VAL C . 17781 1 572 . 1 1 140 140 VAL CA C 13 58.748 0.05 . 1 . . . . 1056 VAL CA . 17781 1 573 . 1 1 140 140 VAL CB C 13 30.669 0.05 . 1 . . . . 1056 VAL CB . 17781 1 574 . 1 1 140 140 VAL N N 15 119.366 0.03 . 1 . . . . 1056 VAL N . 17781 1 575 . 1 1 141 141 TYR H H 1 8.565 0.02 . 1 . . . . 1057 TYR HN . 17781 1 576 . 1 1 141 141 TYR C C 13 178.225 0.009 . 1 . . . . 1057 TYR C . 17781 1 577 . 1 1 141 141 TYR CA C 13 54.573 0.05 . 1 . . . . 1057 TYR CA . 17781 1 578 . 1 1 141 141 TYR CB C 13 37.421 0.047 . 1 . . . . 1057 TYR CB . 17781 1 579 . 1 1 141 141 TYR N N 15 124.288 0.03 . 1 . . . . 1057 TYR N . 17781 1 580 . 1 1 142 142 GLY H H 1 8.308 0.02 . 1 . . . . 1058 GLY HN . 17781 1 581 . 1 1 142 142 GLY C C 13 180.775 0.033 . 1 . . . . 1058 GLY C . 17781 1 582 . 1 1 142 142 GLY CA C 13 44.299 0.05 . 1 . . . . 1058 GLY CA . 17781 1 583 . 1 1 142 142 GLY N N 15 110.261 0.03 . 1 . . . . 1058 GLY N . 17781 1 584 . 1 1 143 143 ASP H H 1 8.097 0.02 . 1 . . . . 1059 ASP HN . 17781 1 585 . 1 1 143 143 ASP C C 13 180.874 0.009 . 1 . . . . 1059 ASP C . 17781 1 586 . 1 1 143 143 ASP CA C 13 51.599 0.05 . 1 . . . . 1059 ASP CA . 17781 1 587 . 1 1 143 143 ASP CB C 13 38.833 0.05 . 1 . . . . 1059 ASP CB . 17781 1 588 . 1 1 143 143 ASP N N 15 126.475 0.03 . 1 . . . . 1059 ASP N . 17781 1 589 . 1 1 144 144 ALA H H 1 8.027 0.02 . 1 . . . . 1060 ALA HN . 17781 1 590 . 1 1 144 144 ALA C C 13 179.772 0.010 . 1 . . . . 1060 ALA C . 17781 1 591 . 1 1 144 144 ALA CA C 13 48.565 0.05 . 1 . . . . 1060 ALA CA . 17781 1 592 . 1 1 144 144 ALA CB C 13 18.482 0.05 . 1 . . . . 1060 ALA CB . 17781 1 593 . 1 1 144 144 ALA N N 15 120.788 0.03 . 1 . . . . 1060 ALA N . 17781 1 594 . 1 1 145 145 PHE H H 1 8.701 0.02 . 1 . . . . 1061 PHE HN . 17781 1 595 . 1 1 145 145 PHE C C 13 180.148 0.010 . 1 . . . . 1061 PHE C . 17781 1 596 . 1 1 145 145 PHE CA C 13 52.230 0.05 . 1 . . . . 1061 PHE CA . 17781 1 597 . 1 1 145 145 PHE CB C 13 37.373 0.05 . 1 . . . . 1061 PHE CB . 17781 1 598 . 1 1 145 145 PHE N N 15 121.116 0.03 . 1 . . . . 1061 PHE N . 17781 1 599 . 1 1 146 146 ILE H H 1 9.141 0.02 . 1 . . . . 1062 ILE HN . 17781 1 600 . 1 1 146 146 ILE C C 13 178.659 0.019 . 1 . . . . 1062 ILE C . 17781 1 601 . 1 1 146 146 ILE CA C 13 55.174 0.05 . 1 . . . . 1062 ILE CA . 17781 1 602 . 1 1 146 146 ILE CB C 13 38.163 0.05 . 1 . . . . 1062 ILE CB . 17781 1 603 . 1 1 146 146 ILE N N 15 123.741 0.03 . 1 . . . . 1062 ILE N . 17781 1 604 . 1 1 147 147 ARG H H 1 8.537 0.02 . 1 . . . . 1063 ARG HN . 17781 1 605 . 1 1 147 147 ARG C C 13 178.777 0.005 . 1 . . . . 1063 ARG C . 17781 1 606 . 1 1 147 147 ARG CA C 13 53.161 0.05 . 1 . . . . 1063 ARG CA . 17781 1 607 . 1 1 147 147 ARG CB C 13 23.965 0.05 . 1 . . . . 1063 ARG CB . 17781 1 608 . 1 1 147 147 ARG N N 15 126.639 0.03 . 1 . . . . 1063 ARG N . 17781 1 609 . 1 1 148 148 GLY H H 1 8.141 0.02 . 1 . . . . 1064 GLY HN . 17781 1 610 . 1 1 148 148 GLY C C 13 180.407 0.014 . 1 . . . . 1064 GLY C . 17781 1 611 . 1 1 148 148 GLY CA C 13 44.059 0.05 . 1 . . . . 1064 GLY CA . 17781 1 612 . 1 1 148 148 GLY N N 15 117.999 0.03 . 1 . . . . 1064 GLY N . 17781 1 613 . 1 1 149 149 ASN H H 1 8.460 0.02 . 1 . . . . 1065 ASN HN . 17781 1 614 . 1 1 149 149 ASN C C 13 178.579 0.014 . 1 . . . . 1065 ASN C . 17781 1 615 . 1 1 149 149 ASN CA C 13 52.350 0.05 . 1 . . . . 1065 ASN CA . 17781 1 616 . 1 1 149 149 ASN CB C 13 35.505 0.05 . 1 . . . . 1065 ASN CB . 17781 1 617 . 1 1 149 149 ASN N N 15 115.483 0.03 . 1 . . . . 1065 ASN N . 17781 1 618 . 1 1 150 150 ASN H H 1 7.920 0.02 . 1 . . . . 1066 ASN HN . 17781 1 619 . 1 1 150 150 ASN C C 13 180.031 0.005 . 1 . . . . 1066 ASN C . 17781 1 620 . 1 1 150 150 ASN CA C 13 49.406 0.05 . 1 . . . . 1066 ASN CA . 17781 1 621 . 1 1 150 150 ASN CB C 13 36.942 0.05 . 1 . . . . 1066 ASN CB . 17781 1 622 . 1 1 150 150 ASN N N 15 115.975 0.03 . 1 . . . . 1066 ASN N . 17781 1 623 . 1 1 151 151 VAL H H 1 6.835 0.02 . 1 . . . . 1067 VAL HN . 17781 1 624 . 1 1 151 151 VAL C C 13 179.753 0.029 . 1 . . . . 1067 VAL C . 17781 1 625 . 1 1 151 151 VAL CA C 13 56.736 0.05 . 1 . . . . 1067 VAL CA . 17781 1 626 . 1 1 151 151 VAL CB C 13 29.113 0.05 . 1 . . . . 1067 VAL CB . 17781 1 627 . 1 1 151 151 VAL N N 15 112.311 0.03 . 1 . . . . 1067 VAL N . 17781 1 628 . 1 1 152 152 LEU H H 1 8.985 0.02 . 1 . . . . 1068 LEU HN . 17781 1 629 . 1 1 152 152 LEU C C 13 178.305 0.005 . 1 . . . . 1068 LEU C . 17781 1 630 . 1 1 152 152 LEU CA C 13 54.753 0.05 . 1 . . . . 1068 LEU CA . 17781 1 631 . 1 1 152 152 LEU CB C 13 40.102 0.05 . 1 . . . . 1068 LEU CB . 17781 1 632 . 1 1 152 152 LEU N N 15 122.483 0.03 . 1 . . . . 1068 LEU N . 17781 1 633 . 1 1 153 153 TYR H H 1 7.174 0.02 . 1 . . . . 1069 TYR HN . 17781 1 634 . 1 1 153 153 TYR C C 13 180.855 0.009 . 1 . . . . 1069 TYR C . 17781 1 635 . 1 1 153 153 TYR CA C 13 52.440 0.05 . 1 . . . . 1069 TYR CA . 17781 1 636 . 1 1 153 153 TYR CB C 13 38.498 0.05 . 1 . . . . 1069 TYR CB . 17781 1 637 . 1 1 153 153 TYR N N 15 108.866 0.03 . 1 . . . . 1069 TYR N . 17781 1 638 . 1 1 154 154 VAL H H 1 8.545 0.02 . 1 . . . . 1070 VAL HN . 17781 1 639 . 1 1 154 154 VAL C C 13 180.077 0.005 . 1 . . . . 1070 VAL C . 17781 1 640 . 1 1 154 154 VAL CA C 13 58.688 0.05 . 1 . . . . 1070 VAL CA . 17781 1 641 . 1 1 154 154 VAL CB C 13 31.115 0.012 . 1 . . . . 1070 VAL CB . 17781 1 642 . 1 1 154 154 VAL N N 15 117.397 0.03 . 1 . . . . 1070 VAL N . 17781 1 643 . 1 1 155 155 SER H H 1 10.153 0.02 . 1 . . . . 1071 SER HN . 17781 1 644 . 1 1 155 155 SER C C 13 180.142 0.05 . 1 . . . . 1071 SER C . 17781 1 645 . 1 1 155 155 SER CA C 13 53.191 0.05 . 1 . . . . 1071 SER CA . 17781 1 646 . 1 1 155 155 SER CB C 13 62.369 0.05 . 1 . . . . 1071 SER CB . 17781 1 647 . 1 1 155 155 SER N N 15 123.030 0.03 . 1 . . . . 1071 SER N . 17781 1 648 . 1 1 156 156 ALA H H 1 8.374 0.02 . 1 . . . . 1072 ALA HN . 17781 1 649 . 1 1 156 156 ALA C C 13 177.522 0.05 . 1 . . . . 1072 ALA C . 17781 1 650 . 1 1 156 156 ALA CA C 13 50.127 0.05 . 1 . . . . 1072 ALA CA . 17781 1 651 . 1 1 156 156 ALA CB C 13 16.251 0.05 . 1 . . . . 1072 ALA CB . 17781 1 652 . 1 1 156 156 ALA N N 15 129.046 0.03 . 1 . . . . 1072 ALA N . 17781 1 653 . 1 1 157 157 LEU H H 1 8.084 0.02 . 1 . . . . 1073 LEU HN . 17781 1 654 . 1 1 157 157 LEU C C 13 177.702 0.005 . 1 . . . . 1073 LEU C . 17781 1 655 . 1 1 157 157 LEU CA C 13 51.659 0.05 . 1 . . . . 1073 LEU CA . 17781 1 656 . 1 1 157 157 LEU CB C 13 39.502 0.036 . 1 . . . . 1073 LEU CB . 17781 1 657 . 1 1 157 157 LEU N N 15 125.382 0.03 . 1 . . . . 1073 LEU N . 17781 1 658 . 1 1 158 158 ASP H H 1 8.365 0.02 . 1 . . . . 1074 ASP HN . 17781 1 659 . 1 1 158 158 ASP C C 13 179.447 0.05 . 1 . . . . 1074 ASP C . 17781 1 660 . 1 1 158 158 ASP CA C 13 51.809 0.05 . 1 . . . . 1074 ASP CA . 17781 1 661 . 1 1 158 158 ASP CB C 13 38.781 0.012 . 1 . . . . 1074 ASP CB . 17781 1 662 . 1 1 158 158 ASP N N 15 122.428 0.03 . 1 . . . . 1074 ASP N . 17781 1 663 . 1 1 159 159 ASP H H 1 7.828 0.02 . 1 . . . . 1075 ASP HN . 17781 1 664 . 1 1 159 159 ASP C C 13 173.777 0.05 . 1 . . . . 1075 ASP C . 17781 1 665 . 1 1 159 159 ASP CA C 13 53.221 0.05 . 1 . . . . 1075 ASP CA . 17781 1 666 . 1 1 159 159 ASP CB C 13 39.370 0.05 . 1 . . . . 1075 ASP CB . 17781 1 667 . 1 1 159 159 ASP N N 15 125.869 0.03 . 1 . . . . 1075 ASP N . 17781 1 668 . 1 1 187 187 SER C C 13 180.092 0.05 . 1 . . . . 1224 SER C . 17781 1 669 . 1 1 187 187 SER CA C 13 55.864 0.05 . 1 . . . . 1224 SER CA . 17781 1 670 . 1 1 187 187 SER CB C 13 60.975 0.05 . 1 . . . . 1224 SER CB . 17781 1 671 . 1 1 188 188 ILE H H 1 7.977 0.02 . 1 . . . . 1225 ILE HN . 17781 1 672 . 1 1 188 188 ILE C C 13 178.937 0.005 . 1 . . . . 1225 ILE C . 17781 1 673 . 1 1 188 188 ILE CA C 13 58.057 0.05 . 1 . . . . 1225 ILE CA . 17781 1 674 . 1 1 188 188 ILE CB C 13 36.715 0.012 . 1 . . . . 1225 ILE CB . 17781 1 675 . 1 1 188 188 ILE N N 15 121.772 0.03 . 1 . . . . 1225 ILE N . 17781 1 676 . 1 1 189 189 LEU H H 1 8.423 0.02 . 1 . . . . 1226 LEU HN . 17781 1 677 . 1 1 189 189 LEU C C 13 178.786 0.005 . 1 . . . . 1226 LEU C . 17781 1 678 . 1 1 189 189 LEU CA C 13 52.500 0.05 . 1 . . . . 1226 LEU CA . 17781 1 679 . 1 1 189 189 LEU CB C 13 38.132 0.036 . 1 . . . . 1226 LEU CB . 17781 1 680 . 1 1 189 189 LEU N N 15 124.096 0.03 . 1 . . . . 1226 LEU N . 17781 1 681 . 1 1 190 190 ASP H H 1 7.715 0.02 . 1 . . . . 1227 ASP HN . 17781 1 682 . 1 1 190 190 ASP C C 13 178.193 0.004 . 1 . . . . 1227 ASP C . 17781 1 683 . 1 1 190 190 ASP CA C 13 50.307 0.05 . 1 . . . . 1227 ASP CA . 17781 1 684 . 1 1 190 190 ASP CB C 13 37.923 0.05 . 1 . . . . 1227 ASP CB . 17781 1 685 . 1 1 190 190 ASP N N 15 121.007 0.03 . 1 . . . . 1227 ASP N . 17781 1 686 . 1 1 191 191 LEU H H 1 7.404 0.02 . 1 . . . . 1228 LEU HN . 17781 1 687 . 1 1 191 191 LEU C C 13 177.222 0.05 . 1 . . . . 1228 LEU C . 17781 1 688 . 1 1 191 191 LEU CA C 13 52.861 0.05 . 1 . . . . 1228 LEU CA . 17781 1 689 . 1 1 191 191 LEU CB C 13 36.942 0.05 . 1 . . . . 1228 LEU CB . 17781 1 690 . 1 1 191 191 LEU N N 15 125.327 0.03 . 1 . . . . 1228 LEU N . 17781 1 691 . 1 1 192 192 SER H H 1 8.200 0.02 . 1 . . . . 1229 SER HN . 17781 1 692 . 1 1 192 192 SER C C 13 177.915 0.001 . 1 . . . . 1229 SER C . 17781 1 693 . 1 1 192 192 SER CA C 13 59.319 0.05 . 1 . . . . 1229 SER CA . 17781 1 694 . 1 1 192 192 SER CB C 13 68.521 0.05 . 1 . . . . 1229 SER CB . 17781 1 695 . 1 1 192 192 SER N N 15 115.757 0.03 . 1 . . . . 1229 SER N . 17781 1 696 . 1 1 193 193 ARG H H 1 7.312 0.02 . 1 . . . . 1230 ARG HN . 17781 1 697 . 1 1 193 193 ARG C C 13 178.103 0.009 . 1 . . . . 1230 ARG C . 17781 1 698 . 1 1 193 193 ARG CA C 13 54.783 0.05 . 1 . . . . 1230 ARG CA . 17781 1 699 . 1 1 193 193 ARG CB C 13 26.057 0.05 . 1 . . . . 1230 ARG CB . 17781 1 700 . 1 1 193 193 ARG N N 15 121.171 0.03 . 1 . . . . 1230 ARG N . 17781 1 701 . 1 1 194 194 TYR H H 1 7.471 0.02 . 1 . . . . 1231 TYR HN . 17781 1 702 . 1 1 194 194 TYR C C 13 180.233 0.019 . 1 . . . . 1231 TYR C . 17781 1 703 . 1 1 194 194 TYR CA C 13 53.071 0.05 . 1 . . . . 1231 TYR CA . 17781 1 704 . 1 1 194 194 TYR CB C 13 35.002 0.05 . 1 . . . . 1231 TYR CB . 17781 1 705 . 1 1 194 194 TYR N N 15 117.507 0.03 . 1 . . . . 1231 TYR N . 17781 1 706 . 1 1 195 195 GLN H H 1 7.206 0.02 . 1 . . . . 1232 GLN HN . 17781 1 707 . 1 1 195 195 GLN C C 13 177.933 0.05 . 1 . . . . 1232 GLN C . 17781 1 708 . 1 1 195 195 GLN CA C 13 55.294 0.05 . 1 . . . . 1232 GLN CA . 17781 1 709 . 1 1 195 195 GLN CB C 13 25.179 0.012 . 1 . . . . 1232 GLN CB . 17781 1 710 . 1 1 195 195 GLN N N 15 121.007 0.03 . 1 . . . . 1232 GLN N . 17781 1 711 . 1 1 196 196 ASP H H 1 9.644 0.02 . 1 . . . . 1233 ASP HN . 17781 1 712 . 1 1 196 196 ASP C C 13 180.026 0.05 . 1 . . . . 1233 ASP C . 17781 1 713 . 1 1 196 196 ASP CA C 13 54.603 0.05 . 1 . . . . 1233 ASP CA . 17781 1 714 . 1 1 196 196 ASP CB C 13 36.319 0.05 . 1 . . . . 1233 ASP CB . 17781 1 715 . 1 1 196 196 ASP N N 15 121.608 0.03 . 1 . . . . 1233 ASP N . 17781 1 716 . 1 1 197 197 GLN H H 1 8.265 0.02 . 1 . . . . 1234 GLN HN . 17781 1 717 . 1 1 197 197 GLN C C 13 180.049 0.014 . 1 . . . . 1234 GLN C . 17781 1 718 . 1 1 197 197 GLN CA C 13 51.178 0.05 . 1 . . . . 1234 GLN CA . 17781 1 719 . 1 1 197 197 GLN CB C 13 27.221 0.05 . 1 . . . . 1234 GLN CB . 17781 1 720 . 1 1 197 197 GLN N N 15 118.108 0.03 . 1 . . . . 1234 GLN N . 17781 1 721 . 1 1 198 198 ARG H H 1 8.612 0.02 . 1 . . . . 1235 ARG HN . 17781 1 722 . 1 1 198 198 ARG C C 13 178.749 0.015 . 1 . . . . 1235 ARG C . 17781 1 723 . 1 1 198 198 ARG CA C 13 53.642 0.05 . 1 . . . . 1235 ARG CA . 17781 1 724 . 1 1 198 198 ARG CB C 13 26.838 0.108 . 1 . . . . 1235 ARG CB . 17781 1 725 . 1 1 198 198 ARG N N 15 122.264 0.03 . 1 . . . . 1235 ARG N . 17781 1 726 . 1 1 199 199 ILE H H 1 9.180 0.02 . 1 . . . . 1236 ILE HN . 17781 1 727 . 1 1 199 199 ILE C C 13 180.916 0.014 . 1 . . . . 1236 ILE C . 17781 1 728 . 1 1 199 199 ILE CA C 13 55.774 0.05 . 1 . . . . 1236 ILE CA . 17781 1 729 . 1 1 199 199 ILE CB C 13 38.709 0.012 . 1 . . . . 1236 ILE CB . 17781 1 730 . 1 1 199 199 ILE N N 15 121.061 0.03 . 1 . . . . 1236 ILE N . 17781 1 731 . 1 1 200 200 GLN H H 1 8.889 0.02 . 1 . . . . 1237 GLN HN . 17781 1 732 . 1 1 200 200 GLN C C 13 180.945 0.005 . 1 . . . . 1237 GLN C . 17781 1 733 . 1 1 200 200 GLN CA C 13 50.878 0.05 . 1 . . . . 1237 GLN CA . 17781 1 734 . 1 1 200 200 GLN CB C 13 28.892 0.024 . 1 . . . . 1237 GLN CB . 17781 1 735 . 1 1 200 200 GLN N N 15 119.940 0.03 . 1 . . . . 1237 GLN N . 17781 1 736 . 1 1 201 201 ALA H H 1 8.754 0.02 . 1 . . . . 1238 ALA HN . 17781 1 737 . 1 1 201 201 ALA C C 13 179.022 0.005 . 1 . . . . 1238 ALA C . 17781 1 738 . 1 1 201 201 ALA CA C 13 47.123 0.05 . 1 . . . . 1238 ALA CA . 17781 1 739 . 1 1 201 201 ALA CB C 13 17.573 0.05 . 1 . . . . 1238 ALA CB . 17781 1 740 . 1 1 201 201 ALA N N 15 126.202 0.03 . 1 . . . . 1238 ALA N . 17781 1 741 . 1 1 202 202 THR H H 1 8.418 0.02 . 1 . . . . 1239 THR HN . 17781 1 742 . 1 1 202 202 THR C C 13 180.954 0.005 . 1 . . . . 1239 THR C . 17781 1 743 . 1 1 202 202 THR CA C 13 57.727 0.05 . 1 . . . . 1239 THR CA . 17781 1 744 . 1 1 202 202 THR CB C 13 68.305 0.024 . 1 . . . . 1239 THR CB . 17781 1 745 . 1 1 202 202 THR N N 15 115.419 0.03 . 1 . . . . 1239 THR N . 17781 1 746 . 1 1 203 203 PHE H H 1 8.680 0.02 . 1 . . . . 1240 PHE HN . 17781 1 747 . 1 1 203 203 PHE C C 13 176.199 0.05 . 1 . . . . 1240 PHE C . 17781 1 748 . 1 1 203 203 PHE CA C 13 54.182 0.05 . 1 . . . . 1240 PHE CA . 17781 1 749 . 1 1 203 203 PHE CB C 13 39.875 0.048 . 1 . . . . 1240 PHE CB . 17781 1 750 . 1 1 203 203 PHE N N 15 122.565 0.03 . 1 . . . . 1240 PHE N . 17781 1 751 . 1 1 204 204 THR H H 1 9.567 0.02 . 1 . . . . 1241 THR HN . 17781 1 752 . 1 1 204 204 THR C C 13 178.895 0.05 . 1 . . . . 1241 THR C . 17781 1 753 . 1 1 204 204 THR CA C 13 60.611 0.05 . 1 . . . . 1241 THR CA . 17781 1 754 . 1 1 204 204 THR CB C 13 65.950 0.05 . 1 . . . . 1241 THR CB . 17781 1 755 . 1 1 204 204 THR N N 15 118.983 0.03 . 1 . . . . 1241 THR N . 17781 1 756 . 1 1 205 205 GLY C C 13 179.055 0.05 . 1 . . . . 1242 GLY C . 17781 1 757 . 1 1 205 205 GLY CA C 13 42.423 0.05 . 1 . . . . 1242 GLY CA . 17781 1 758 . 1 1 206 206 GLY H H 1 8.079 0.02 . 1 . . . . 1243 GLY HN . 17781 1 759 . 1 1 206 206 GLY C C 13 179.858 0.007 . 1 . . . . 1243 GLY C . 17781 1 760 . 1 1 206 206 GLY CA C 13 43.008 0.05 . 1 . . . . 1243 GLY CA . 17781 1 761 . 1 1 206 206 GLY N N 15 107.717 0.03 . 1 . . . . 1243 GLY N . 17781 1 762 . 1 1 207 207 ARG H H 1 8.284 0.02 . 1 . . . . 1244 ARG HN . 17781 1 763 . 1 1 207 207 ARG C C 13 178.617 0.005 . 1 . . . . 1244 ARG C . 17781 1 764 . 1 1 207 207 ARG CA C 13 55.504 0.05 . 1 . . . . 1244 ARG CA . 17781 1 765 . 1 1 207 207 ARG CB C 13 27.871 0.012 . 1 . . . . 1244 ARG CB . 17781 1 766 . 1 1 207 207 ARG N N 15 121.541 0.03 . 1 . . . . 1244 ARG N . 17781 1 767 . 1 1 208 208 GLN H H 1 8.606 0.02 . 1 . . . . 1245 GLN HN . 17781 1 768 . 1 1 208 208 GLN C C 13 180.068 0.005 . 1 . . . . 1245 GLN C . 17781 1 769 . 1 1 208 208 GLN CA C 13 52.560 0.05 . 1 . . . . 1245 GLN CA . 17781 1 770 . 1 1 208 208 GLN CB C 13 30.010 0.012 . 1 . . . . 1245 GLN CB . 17781 1 771 . 1 1 208 208 GLN N N 15 120.460 0.03 . 1 . . . . 1245 GLN N . 17781 1 772 . 1 1 209 209 ILE H H 1 8.864 0.02 . 1 . . . . 1246 ILE HN . 17781 1 773 . 1 1 209 209 ILE C C 13 178.777 0.005 . 1 . . . . 1246 ILE C . 17781 1 774 . 1 1 209 209 ILE CA C 13 55.744 0.05 . 1 . . . . 1246 ILE CA . 17781 1 775 . 1 1 209 209 ILE CB C 13 39.538 0.05 . 1 . . . . 1246 ILE CB . 17781 1 776 . 1 1 209 209 ILE N N 15 115.374 0.03 . 1 . . . . 1246 ILE N . 17781 1 777 . 1 1 210 210 THR H H 1 8.889 0.02 . 1 . . . . 1247 THR HN . 17781 1 778 . 1 1 210 210 THR C C 13 180.129 0.019 . 1 . . . . 1247 THR C . 17781 1 779 . 1 1 210 210 THR CA C 13 56.676 0.05 . 1 . . . . 1247 THR CA . 17781 1 780 . 1 1 210 210 THR CB C 13 69.639 0.012 . 1 . . . . 1247 THR CB . 17781 1 781 . 1 1 210 210 THR N N 15 110.452 0.03 . 1 . . . . 1247 THR N . 17781 1 782 . 1 1 211 211 GLY H H 1 8.517 0.02 . 1 . . . . 1248 GLY HN . 17781 1 783 . 1 1 211 211 GLY C C 13 174.300 0.005 . 1 . . . . 1248 GLY C . 17781 1 784 . 1 1 211 211 GLY CA C 13 43.308 0.05 . 1 . . . . 1248 GLY CA . 17781 1 785 . 1 1 211 211 GLY N N 15 104.710 0.03 . 1 . . . . 1248 GLY N . 17781 1 786 . 1 1 212 212 ILE H H 1 9.467 0.02 . 1 . . . . 1249 ILE HN . 17781 1 787 . 1 1 212 212 ILE C C 13 177.650 0.05 . 1 . . . . 1249 ILE C . 17781 1 788 . 1 1 212 212 ILE CA C 13 56.766 0.05 . 1 . . . . 1249 ILE CA . 17781 1 789 . 1 1 212 212 ILE CB C 13 35.561 0.012 . 1 . . . . 1249 ILE CB . 17781 1 790 . 1 1 212 212 ILE N N 15 121.882 0.03 . 1 . . . . 1249 ILE N . 17781 1 791 . 1 1 213 213 LEU H H 1 8.319 0.02 . 1 . . . . 1250 LEU HN . 17781 1 792 . 1 1 213 213 LEU C C 13 178.814 0.014 . 1 . . . . 1250 LEU C . 17781 1 793 . 1 1 213 213 LEU CA C 13 53.972 0.05 . 1 . . . . 1250 LEU CA . 17781 1 794 . 1 1 213 213 LEU CB C 13 37.748 0.036 . 1 . . . . 1250 LEU CB . 17781 1 795 . 1 1 213 213 LEU N N 15 129.428 0.03 . 1 . . . . 1250 LEU N . 17781 1 796 . 1 1 214 214 LYS H H 1 9.024 0.02 . 1 . . . . 1251 LYS HN . 17781 1 797 . 1 1 214 214 LYS C C 13 177.453 0.05 . 1 . . . . 1251 LYS C . 17781 1 798 . 1 1 214 214 LYS CA C 13 50.908 0.05 . 1 . . . . 1251 LYS CA . 17781 1 799 . 1 1 214 214 LYS CB C 13 29.385 0.060 . 1 . . . . 1251 LYS CB . 17781 1 800 . 1 1 214 214 LYS N N 15 126.530 0.03 . 1 . . . . 1251 LYS N . 17781 1 801 . 1 1 215 215 GLY H H 1 7.662 0.02 . 1 . . . . 1252 GLY HN . 17781 1 802 . 1 1 215 215 GLY C C 13 173.169 0.014 . 1 . . . . 1252 GLY C . 17781 1 803 . 1 1 215 215 GLY CA C 13 42.857 0.05 . 1 . . . . 1252 GLY CA . 17781 1 804 . 1 1 215 215 GLY N N 15 105.967 0.03 . 1 . . . . 1252 GLY N . 17781 1 805 . 1 1 216 216 PHE H H 1 7.388 0.02 . 1 . . . . 1253 PHE HN . 17781 1 806 . 1 1 216 216 PHE C C 13 172.094 0.005 . 1 . . . . 1253 PHE C . 17781 1 807 . 1 1 216 216 PHE CA C 13 53.491 0.05 . 1 . . . . 1253 PHE CA . 17781 1 808 . 1 1 216 216 PHE CB C 13 37.772 0.012 . 1 . . . . 1253 PHE CB . 17781 1 809 . 1 1 216 216 PHE N N 15 114.936 0.03 . 1 . . . . 1253 PHE N . 17781 1 810 . 1 1 217 217 ASP H H 1 8.073 0.02 . 1 . . . . 1254 ASP HN . 17781 1 811 . 1 1 217 217 ASP C C 13 176.614 0.05 . 1 . . . . 1254 ASP C . 17781 1 812 . 1 1 217 217 ASP CA C 13 49.178 0.05 . 1 . . . . 1254 ASP CA . 17781 1 813 . 1 1 217 217 ASP CB C 13 40.355 0.05 . 1 . . . . 1254 ASP CB . 17781 1 814 . 1 1 217 217 ASP N N 15 118.272 0.03 . 1 . . . . 1254 ASP N . 17781 1 815 . 1 1 218 218 GLN C C 13 178.876 0.05 . 1 . . . . 1255 GLN C . 17781 1 816 . 1 1 218 218 GLN CA C 13 54.423 0.05 . 1 . . . . 1255 GLN CA . 17781 1 817 . 1 1 218 218 GLN CB C 13 24.855 0.05 . 1 . . . . 1255 GLN CB . 17781 1 818 . 1 1 219 219 LEU H H 1 7.844 0.02 . 1 . . . . 1256 LEU HN . 17781 1 819 . 1 1 219 219 LEU C C 13 178.654 0.005 . 1 . . . . 1256 LEU C . 17781 1 820 . 1 1 219 219 LEU CA C 13 51.268 0.05 . 1 . . . . 1256 LEU CA . 17781 1 821 . 1 1 219 219 LEU CB C 13 36.895 0.05 . 1 . . . . 1256 LEU CB . 17781 1 822 . 1 1 219 219 LEU N N 15 121.116 0.03 . 1 . . . . 1256 LEU N . 17781 1 823 . 1 1 220 220 MET H H 1 7.958 0.02 . 1 . . . . 1257 MET HN . 17781 1 824 . 1 1 220 220 MET C C 13 179.356 0.05 . 1 . . . . 1257 MET C . 17781 1 825 . 1 1 220 220 MET CA C 13 54.573 0.05 . 1 . . . . 1257 MET CA . 17781 1 826 . 1 1 220 220 MET CB C 13 25.552 0.048 . 1 . . . . 1257 MET CB . 17781 1 827 . 1 1 220 220 MET N N 15 112.147 0.03 . 1 . . . . 1257 MET N . 17781 1 828 . 1 1 221 221 ASN H H 1 7.919 0.02 . 1 . . . . 1258 ASN HN . 17781 1 829 . 1 1 221 221 ASN C C 13 178.564 0.010 . 1 . . . . 1258 ASN C . 17781 1 830 . 1 1 221 221 ASN CA C 13 50.728 0.05 . 1 . . . . 1258 ASN CA . 17781 1 831 . 1 1 221 221 ASN CB C 13 34.684 0.048 . 1 . . . . 1258 ASN CB . 17781 1 832 . 1 1 221 221 ASN N N 15 111.272 0.03 . 1 . . . . 1258 ASN N . 17781 1 833 . 1 1 222 222 LEU H H 1 8.706 0.02 . 1 . . . . 1259 LEU HN . 17781 1 834 . 1 1 222 222 LEU C C 13 177.641 0.05 . 1 . . . . 1259 LEU C . 17781 1 835 . 1 1 222 222 LEU CA C 13 49.616 0.05 . 1 . . . . 1259 LEU CA . 17781 1 836 . 1 1 222 222 LEU CB C 13 42.506 0.012 . 1 . . . . 1259 LEU CB . 17781 1 837 . 1 1 222 222 LEU N N 15 118.108 0.03 . 1 . . . . 1259 LEU N . 17781 1 838 . 1 1 223 223 VAL H H 1 8.331 0.02 . 1 . . . . 1260 VAL HN . 17781 1 839 . 1 1 223 223 VAL C C 13 179.587 0.014 . 1 . . . . 1260 VAL C . 17781 1 840 . 1 1 223 223 VAL CA C 13 59.409 0.05 . 1 . . . . 1260 VAL CA . 17781 1 841 . 1 1 223 223 VAL CB C 13 29.685 0.05 . 1 . . . . 1260 VAL CB . 17781 1 842 . 1 1 223 223 VAL N N 15 121.040 0.03 . 1 . . . . 1260 VAL N . 17781 1 843 . 1 1 224 224 LEU H H 1 8.833 0.02 . 1 . . . . 1261 LEU HN . 17781 1 844 . 1 1 224 224 LEU C C 13 180.926 0.004 . 1 . . . . 1261 LEU C . 17781 1 845 . 1 1 224 224 LEU CA C 13 49.586 0.05 . 1 . . . . 1261 LEU CA . 17781 1 846 . 1 1 224 224 LEU CB C 13 43.299 0.012 . 1 . . . . 1261 LEU CB . 17781 1 847 . 1 1 224 224 LEU N N 15 127.678 0.03 . 1 . . . . 1261 LEU N . 17781 1 848 . 1 1 225 225 ASP H H 1 9.065 0.02 . 1 . . . . 1262 ASP HN . 17781 1 849 . 1 1 225 225 ASP C C 13 178.546 0.009 . 1 . . . . 1262 ASP C . 17781 1 850 . 1 1 225 225 ASP CA C 13 47.904 0.05 . 1 . . . . 1262 ASP CA . 17781 1 851 . 1 1 225 225 ASP CB C 13 41.874 0.05 . 1 . . . . 1262 ASP CB . 17781 1 852 . 1 1 225 225 ASP N N 15 119.475 0.03 . 1 . . . . 1262 ASP N . 17781 1 853 . 1 1 226 226 ASP H H 1 8.707 0.02 . 1 . . . . 1263 ASP HN . 17781 1 854 . 1 1 226 226 ASP C C 13 178.721 0.005 . 1 . . . . 1263 ASP C . 17781 1 855 . 1 1 226 226 ASP CA C 13 52.079 0.05 . 1 . . . . 1263 ASP CA . 17781 1 856 . 1 1 226 226 ASP CB C 13 37.109 0.05 . 1 . . . . 1263 ASP CB . 17781 1 857 . 1 1 226 226 ASP N N 15 122.254 0.03 . 1 . . . . 1263 ASP N . 17781 1 858 . 1 1 227 227 VAL H H 1 8.948 0.02 . 1 . . . . 1264 VAL HN . 17781 1 859 . 1 1 227 227 VAL C C 13 176.415 0.009 . 1 . . . . 1264 VAL C . 17781 1 860 . 1 1 227 227 VAL CA C 13 60.370 0.05 . 1 . . . . 1264 VAL CA . 17781 1 861 . 1 1 227 227 VAL CB C 13 27.823 0.036 . 1 . . . . 1264 VAL CB . 17781 1 862 . 1 1 227 227 VAL N N 15 118.491 0.03 . 1 . . . . 1264 VAL N . 17781 1 863 . 1 1 228 228 GLU H H 1 8.769 0.02 . 1 . . . . 1265 GLU HN . 17781 1 864 . 1 1 228 228 GLU C C 13 179.880 0.005 . 1 . . . . 1265 GLU C . 17781 1 865 . 1 1 228 228 GLU CA C 13 51.569 0.05 . 1 . . . . 1265 GLU CA . 17781 1 866 . 1 1 228 228 GLU CB C 13 29.493 0.024 . 1 . . . . 1265 GLU CB . 17781 1 867 . 1 1 228 228 GLU N N 15 128.218 0.03 . 1 . . . . 1265 GLU N . 17781 1 868 . 1 1 229 229 GLU H H 1 9.184 0.02 . 1 . . . . 1266 GLU HN . 17781 1 869 . 1 1 229 229 GLU C C 13 178.744 0.05 . 1 . . . . 1266 GLU C . 17781 1 870 . 1 1 229 229 GLU CA C 13 51.298 0.05 . 1 . . . . 1266 GLU CA . 17781 1 871 . 1 1 229 229 GLU CB C 13 28.897 0.05 . 1 . . . . 1266 GLU CB . 17781 1 872 . 1 1 229 229 GLU N N 15 125.217 0.03 . 1 . . . . 1266 GLU N . 17781 1 873 . 1 1 230 230 GLN H H 1 8.194 0.02 . 1 . . . . 1267 GLN HN . 17781 1 874 . 1 1 230 230 GLN C C 13 179.997 0.019 . 1 . . . . 1267 GLN C . 17781 1 875 . 1 1 230 230 GLN CA C 13 52.470 0.05 . 1 . . . . 1267 GLN CA . 17781 1 876 . 1 1 230 230 GLN CB C 13 25.186 0.05 . 1 . . . . 1267 GLN CB . 17781 1 877 . 1 1 230 230 GLN N N 15 126.858 0.03 . 1 . . . . 1267 GLN N . 17781 1 878 . 1 1 231 231 LEU H H 1 7.864 0.02 . 1 . . . . 1268 LEU HN . 17781 1 879 . 1 1 231 231 LEU C C 13 177.231 0.005 . 1 . . . . 1268 LEU C . 17781 1 880 . 1 1 231 231 LEU CA C 13 52.826 0.05 . 1 . . . . 1268 LEU CA . 17781 1 881 . 1 1 231 231 LEU CB C 13 38.234 0.05 . 1 . . . . 1268 LEU CB . 17781 1 882 . 1 1 231 231 LEU N N 15 125.655 0.03 . 1 . . . . 1268 LEU N . 17781 1 883 . 1 1 232 232 ARG H H 1 8.509 0.02 . 1 . . . . 1269 ARG HN . 17781 1 884 . 1 1 232 232 ARG C C 13 178.414 0.019 . 1 . . . . 1269 ARG C . 17781 1 885 . 1 1 232 232 ARG CA C 13 51.599 0.05 . 1 . . . . 1269 ARG CA . 17781 1 886 . 1 1 232 232 ARG CB C 13 29.496 0.05 . 1 . . . . 1269 ARG CB . 17781 1 887 . 1 1 232 232 ARG N N 15 120.842 0.03 . 1 . . . . 1269 ARG N . 17781 1 888 . 1 1 233 233 ASN H H 1 8.871 0.02 . 1 . . . . 1270 ASN HN . 17781 1 889 . 1 1 233 233 ASN CA C 13 47.934 0.05 . 1 . . . . 1270 ASN CA . 17781 1 890 . 1 1 233 233 ASN CB C 13 35.840 0.05 . 1 . . . . 1270 ASN CB . 17781 1 891 . 1 1 233 233 ASN N N 15 124.889 0.03 . 1 . . . . 1270 ASN N . 17781 1 892 . 1 1 234 234 PRO C C 13 176.793 0.05 . 1 . . . . 1271 PRO C . 17781 1 893 . 1 1 234 234 PRO CA C 13 61.359 0.05 . 1 . . . . 1271 PRO CA . 17781 1 894 . 1 1 234 234 PRO CB C 13 28.940 0.05 . 1 . . . . 1271 PRO CB . 17781 1 895 . 1 1 235 235 GLU H H 1 8.097 0.02 . 1 . . . . 1272 GLU HN . 17781 1 896 . 1 1 235 235 GLU C C 13 177.344 0.005 . 1 . . . . 1272 GLU C . 17781 1 897 . 1 1 235 235 GLU CA C 13 55.564 0.05 . 1 . . . . 1272 GLU CA . 17781 1 898 . 1 1 235 235 GLU CB C 13 26.694 0.05 . 1 . . . . 1272 GLU CB . 17781 1 899 . 1 1 235 235 GLU N N 15 116.522 0.03 . 1 . . . . 1272 GLU N . 17781 1 900 . 1 1 236 236 ASP H H 1 7.116 0.02 . 1 . . . . 1273 ASP HN . 17781 1 901 . 1 1 236 236 ASP C C 13 177.118 0.005 . 1 . . . . 1273 ASP C . 17781 1 902 . 1 1 236 236 ASP CA C 13 50.247 0.05 . 1 . . . . 1273 ASP CA . 17781 1 903 . 1 1 236 236 ASP CB C 13 39.001 0.05 . 1 . . . . 1273 ASP CB . 17781 1 904 . 1 1 236 236 ASP N N 15 114.171 0.03 . 1 . . . . 1273 ASP N . 17781 1 905 . 1 1 237 237 GLY H H 1 8.432 0.02 . 1 . . . . 1274 GLY HN . 17781 1 906 . 1 1 237 237 GLY C C 13 180.210 0.005 . 1 . . . . 1274 GLY C . 17781 1 907 . 1 1 237 237 GLY CA C 13 43.308 0.05 . 1 . . . . 1274 GLY CA . 17781 1 908 . 1 1 237 237 GLY N N 15 110.507 0.03 . 1 . . . . 1274 GLY N . 17781 1 909 . 1 1 238 238 LYS H H 1 8.285 0.02 . 1 . . . . 1275 LYS HN . 17781 1 910 . 1 1 238 238 LYS C C 13 177.170 0.019 . 1 . . . . 1275 LYS C . 17781 1 911 . 1 1 238 238 LYS CA C 13 53.612 0.05 . 1 . . . . 1275 LYS CA . 17781 1 912 . 1 1 238 238 LYS CB C 13 29.529 0.012 . 1 . . . . 1275 LYS CB . 17781 1 913 . 1 1 238 238 LYS N N 15 121.937 0.03 . 1 . . . . 1275 LYS N . 17781 1 914 . 1 1 239 239 LEU H H 1 8.463 0.02 . 1 . . . . 1276 LEU HN . 17781 1 915 . 1 1 239 239 LEU C C 13 175.587 0.001 . 1 . . . . 1276 LEU C . 17781 1 916 . 1 1 239 239 LEU CA C 13 52.770 0.05 . 1 . . . . 1276 LEU CA . 17781 1 917 . 1 1 239 239 LEU CB C 13 38.058 0.010 . 1 . . . . 1276 LEU CB . 17781 1 918 . 1 1 239 239 LEU N N 15 123.194 0.03 . 1 . . . . 1276 LEU N . 17781 1 919 . 1 1 240 240 THR H H 1 8.086 0.02 . 1 . . . . 1277 THR HN . 17781 1 920 . 1 1 240 240 THR C C 13 178.424 0.05 . 1 . . . . 1277 THR C . 17781 1 921 . 1 1 240 240 THR CA C 13 59.049 0.05 . 1 . . . . 1277 THR CA . 17781 1 922 . 1 1 240 240 THR CB C 13 67.372 0.05 . 1 . . . . 1277 THR CB . 17781 1 923 . 1 1 240 240 THR N N 15 112.569 0.03 . 1 . . . . 1277 THR N . 17781 1 924 . 1 1 241 241 GLY C C 13 171.279 0.05 . 1 . . . . 1278 GLY C . 17781 1 925 . 1 1 241 241 GLY CA C 13 41.926 0.05 . 1 . . . . 1278 GLY CA . 17781 1 926 . 1 1 242 242 ALA H H 1 7.844 0.02 . 1 . . . . 1279 ALA HN . 17781 1 927 . 1 1 242 242 ALA C C 13 177.429 0.014 . 1 . . . . 1279 ALA C . 17781 1 928 . 1 1 242 242 ALA CA C 13 48.685 0.05 . 1 . . . . 1279 ALA CA . 17781 1 929 . 1 1 242 242 ALA CB C 13 17.237 0.024 . 1 . . . . 1279 ALA CB . 17781 1 930 . 1 1 242 242 ALA N N 15 124.233 0.03 . 1 . . . . 1279 ALA N . 17781 1 931 . 1 1 243 243 ILE H H 1 8.261 0.02 . 1 . . . . 1280 ILE HN . 17781 1 932 . 1 1 243 243 ILE C C 13 177.884 0.007 . 1 . . . . 1280 ILE C . 17781 1 933 . 1 1 243 243 ILE CA C 13 55.714 0.05 . 1 . . . . 1280 ILE CA . 17781 1 934 . 1 1 243 243 ILE CB C 13 39.815 0.036 . 1 . . . . 1280 ILE CB . 17781 1 935 . 1 1 243 243 ILE N N 15 116.850 0.03 . 1 . . . . 1280 ILE N . 17781 1 936 . 1 1 244 244 ARG H H 1 8.570 0.02 . 1 . . . . 1281 ARG HN . 17781 1 937 . 1 1 244 244 ARG C C 13 180.120 0.010 . 1 . . . . 1281 ARG C . 17781 1 938 . 1 1 244 244 ARG CA C 13 51.148 0.05 . 1 . . . . 1281 ARG CA . 17781 1 939 . 1 1 244 244 ARG CB C 13 29.946 0.05 . 1 . . . . 1281 ARG CB . 17781 1 940 . 1 1 244 244 ARG N N 15 117.971 0.03 . 1 . . . . 1281 ARG N . 17781 1 941 . 1 1 245 245 LYS H H 1 8.840 0.02 . 1 . . . . 1282 LYS HN . 17781 1 942 . 1 1 245 245 LYS C C 13 178.164 0.05 . 1 . . . . 1282 LYS C . 17781 1 943 . 1 1 245 245 LYS CA C 13 53.461 0.05 . 1 . . . . 1282 LYS CA . 17781 1 944 . 1 1 245 245 LYS CB C 13 28.841 0.003 . 1 . . . . 1282 LYS CB . 17781 1 945 . 1 1 245 245 LYS N N 15 125.682 0.03 . 1 . . . . 1282 LYS N . 17781 1 946 . 1 1 246 246 LEU H H 1 8.300 0.02 . 1 . . . . 1283 LEU HN . 17781 1 947 . 1 1 246 246 LEU C C 13 178.214 0.007 . 1 . . . . 1283 LEU C . 17781 1 948 . 1 1 246 246 LEU CA C 13 51.629 0.05 . 1 . . . . 1283 LEU CA . 17781 1 949 . 1 1 246 246 LEU CB C 13 40.716 0.072 . 1 . . . . 1283 LEU CB . 17781 1 950 . 1 1 246 246 LEU N N 15 124.048 0.03 . 1 . . . . 1283 LEU N . 17781 1 951 . 1 1 247 247 GLY H H 1 7.572 0.02 . 1 . . . . 1284 GLY HN . 17781 1 952 . 1 1 247 247 GLY C C 13 172.509 0.004 . 1 . . . . 1284 GLY C . 17781 1 953 . 1 1 247 247 GLY CA C 13 43.909 0.05 . 1 . . . . 1284 GLY CA . 17781 1 954 . 1 1 247 247 GLY N N 15 107.171 0.03 . 1 . . . . 1284 GLY N . 17781 1 955 . 1 1 248 248 LEU H H 1 7.609 0.02 . 1 . . . . 1285 LEU HN . 17781 1 956 . 1 1 248 248 LEU C C 13 178.315 0.024 . 1 . . . . 1285 LEU C . 17781 1 957 . 1 1 248 248 LEU CA C 13 52.170 0.05 . 1 . . . . 1285 LEU CA . 17781 1 958 . 1 1 248 248 LEU CB C 13 38.901 0.012 . 1 . . . . 1285 LEU CB . 17781 1 959 . 1 1 248 248 LEU N N 15 129.592 0.03 . 1 . . . . 1285 LEU N . 17781 1 960 . 1 1 249 249 VAL H H 1 8.993 0.02 . 1 . . . . 1286 VAL HN . 17781 1 961 . 1 1 249 249 VAL C C 13 180.313 0.005 . 1 . . . . 1286 VAL C . 17781 1 962 . 1 1 249 249 VAL CA C 13 56.135 0.05 . 1 . . . . 1286 VAL CA . 17781 1 963 . 1 1 249 249 VAL CB C 13 33.026 0.024 . 1 . . . . 1286 VAL CB . 17781 1 964 . 1 1 249 249 VAL N N 15 121.663 0.03 . 1 . . . . 1286 VAL N . 17781 1 965 . 1 1 250 250 VAL H H 1 8.773 0.02 . 1 . . . . 1287 VAL HN . 17781 1 966 . 1 1 250 250 VAL C C 13 179.107 0.004 . 1 . . . . 1287 VAL C . 17781 1 967 . 1 1 250 250 VAL CA C 13 58.508 0.05 . 1 . . . . 1287 VAL CA . 17781 1 968 . 1 1 250 250 VAL CB C 13 29.253 0.05 . 1 . . . . 1287 VAL CB . 17781 1 969 . 1 1 250 250 VAL N N 15 121.608 0.03 . 1 . . . . 1287 VAL N . 17781 1 970 . 1 1 251 251 VAL H H 1 9.334 0.02 . 1 . . . . 1288 VAL HN . 17781 1 971 . 1 1 251 251 VAL C C 13 178.871 0.005 . 1 . . . . 1288 VAL C . 17781 1 972 . 1 1 251 251 VAL CA C 13 57.847 0.05 . 1 . . . . 1288 VAL CA . 17781 1 973 . 1 1 251 251 VAL CB C 13 30.706 0.012 . 1 . . . . 1288 VAL CB . 17781 1 974 . 1 1 251 251 VAL N N 15 129.757 0.03 . 1 . . . . 1288 VAL N . 17781 1 975 . 1 1 252 252 ARG H H 1 7.859 0.02 . 1 . . . . 1289 ARG HN . 17781 1 976 . 1 1 252 252 ARG C C 13 178.042 0.005 . 1 . . . . 1289 ARG C . 17781 1 977 . 1 1 252 252 ARG CA C 13 50.067 0.05 . 1 . . . . 1289 ARG CA . 17781 1 978 . 1 1 252 252 ARG CB C 13 25.852 0.012 . 1 . . . . 1289 ARG CB . 17781 1 979 . 1 1 252 252 ARG N N 15 126.107 0.03 . 1 . . . . 1289 ARG N . 17781 1 980 . 1 1 253 253 GLY H H 1 8.562 0.02 . 1 . . . . 1290 GLY HN . 17781 1 981 . 1 1 253 253 GLY C C 13 177.471 0.05 . 1 . . . . 1290 GLY C . 17781 1 982 . 1 1 253 253 GLY CA C 13 44.630 0.05 . 1 . . . . 1290 GLY CA . 17781 1 983 . 1 1 253 253 GLY N N 15 110.780 0.03 . 1 . . . . 1290 GLY N . 17781 1 984 . 1 1 254 254 THR C C 13 178.499 0.05 . 1 . . . . 1291 THR C . 17781 1 985 . 1 1 254 254 THR CA C 13 60.726 0.05 . 1 . . . . 1291 THR CA . 17781 1 986 . 1 1 254 254 THR CB C 13 65.637 0.05 . 1 . . . . 1291 THR CB . 17781 1 987 . 1 1 255 255 THR H H 1 7.207 0.02 . 1 . . . . 1292 THR HN . 17781 1 988 . 1 1 255 255 THR C C 13 179.969 0.009 . 1 . . . . 1292 THR C . 17781 1 989 . 1 1 255 255 THR CA C 13 57.757 0.05 . 1 . . . . 1292 THR CA . 17781 1 990 . 1 1 255 255 THR CB C 13 66.370 0.012 . 1 . . . . 1292 THR CB . 17781 1 991 . 1 1 255 255 THR N N 15 107.991 0.03 . 1 . . . . 1292 THR N . 17781 1 992 . 1 1 256 256 LEU H H 1 7.068 0.02 . 1 . . . . 1293 LEU HN . 17781 1 993 . 1 1 256 256 LEU C C 13 178.796 0.005 . 1 . . . . 1293 LEU C . 17781 1 994 . 1 1 256 256 LEU CA C 13 53.401 0.05 . 1 . . . . 1293 LEU CA . 17781 1 995 . 1 1 256 256 LEU CB C 13 41.076 0.048 . 1 . . . . 1293 LEU CB . 17781 1 996 . 1 1 256 256 LEU N N 15 125.600 0.03 . 1 . . . . 1293 LEU N . 17781 1 997 . 1 1 257 257 VAL H H 1 8.872 0.02 . 1 . . . . 1294 VAL HN . 17781 1 998 . 1 1 257 257 VAL C C 13 172.019 0.005 . 1 . . . . 1294 VAL C . 17781 1 999 . 1 1 257 257 VAL CA C 13 61.151 0.05 . 1 . . . . 1294 VAL CA . 17781 1 1000 . 1 1 257 257 VAL CB C 13 30.406 0.05 . 1 . . . . 1294 VAL CB . 17781 1 1001 . 1 1 257 257 VAL N N 15 123.358 0.03 . 1 . . . . 1294 VAL N . 17781 1 1002 . 1 1 258 258 LEU H H 1 7.025 0.02 . 1 . . . . 1295 LEU HN . 17781 1 1003 . 1 1 258 258 LEU C C 13 179.545 0.019 . 1 . . . . 1295 LEU C . 17781 1 1004 . 1 1 258 258 LEU CA C 13 51.118 0.05 . 1 . . . . 1295 LEU CA . 17781 1 1005 . 1 1 258 258 LEU CB C 13 42.446 0.024 . 1 . . . . 1295 LEU CB . 17781 1 1006 . 1 1 258 258 LEU N N 15 121.280 0.03 . 1 . . . . 1295 LEU N . 17781 1 1007 . 1 1 259 259 ILE H H 1 8.757 0.02 . 1 . . . . 1296 ILE HN . 17781 1 1008 . 1 1 259 259 ILE C C 13 180.436 0.005 . 1 . . . . 1296 ILE C . 17781 1 1009 . 1 1 259 259 ILE CA C 13 57.366 0.05 . 1 . . . . 1296 ILE CA . 17781 1 1010 . 1 1 259 259 ILE CB C 13 38.457 0.024 . 1 . . . . 1296 ILE CB . 17781 1 1011 . 1 1 259 259 ILE N N 15 122.702 0.03 . 1 . . . . 1296 ILE N . 17781 1 1012 . 1 1 260 260 ALA H H 1 8.622 0.02 . 1 . . . . 1297 ALA HN . 17781 1 1013 . 1 1 260 260 ALA C C 13 180.637 0.05 . 1 . . . . 1297 ALA C . 17781 1 1014 . 1 1 260 260 ALA CA C 13 46.253 0.05 . 1 . . . . 1297 ALA CA . 17781 1 1015 . 1 1 260 260 ALA CB C 13 17.958 0.05 . 1 . . . . 1297 ALA CB . 17781 1 1016 . 1 1 260 260 ALA N N 15 126.858 0.03 . 1 . . . . 1297 ALA N . 17781 1 stop_ save_