data_17782 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 17782 _Entry.Title ; lsm57 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2011-07-15 _Entry.Accession_date 2011-07-15 _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 . . . 17782 2 Markus Mund . . . 17782 3 Ancilla N. . . . 17782 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 17782 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 274 17782 '15N chemical shifts' 133 17782 '1H chemical shifts' 133 17782 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 2011-07-15 update BMRB 'update entry citation' 17782 1 . . 2011-10-25 2011-07-15 original author 'original release' 17782 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 17881 'lsm567 hexamer' 17782 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 17782 _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 . . . 17782 1 2 Ancilla Neu . . . 17782 1 3 Janina Ullmann . . . 17782 1 4 Ursula Neu . . . 17782 1 5 Remco Sprangers . . . 17782 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 17782 _Assembly.ID 1 _Assembly.Name lsm57 _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 lsm57 1 $lsm57 A . yes native no no . . . 17782 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_lsm57 _Entity.Sf_category entity _Entity.Sf_framecode lsm57 _Entity.Entry_ID 17782 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name lsm57 _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 ; MSMTILPLELIDKCIGSNLW VIMKSEREFAGTLVGFDDYV NIVLKDVTEYDTVTGVTEKH SEMLLNGNGMCMLIPGGKPE MSSLQKRPGPGNSSQPTERP RKESILDLSRYQDQRIQATF TGGRQITGILKGFDQLMNLV LDDVEEQLRNPEDGKLTGAI RKLGLVVVRGTTLVLIAPMD GSEEIPNPFVQAE ; _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 193 _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 2015-11-25 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 3SWN . "Structure Of The Lsm657 Complex: An Assembly Intermediate Of The Lsm1 7 And Lsm2 8 Rings" . . . . . 58.55 117 100.00 100.00 1.13e-72 . . . . 17782 1 2 no PDB 4EMK . "Crystal Structure Of Splsm567" . . . . . 58.03 113 98.21 98.21 9.63e-70 . . . . 17782 1 3 no EMBL CAA20851 . "U6 snRNP-associated protein Lsm7 (predicted) [Schizosaccharomyces pombe]" . . . . . 58.55 113 100.00 100.00 1.32e-72 . . . . 17782 1 4 no REF NP_588340 . "U6 snRNP-associated protein Lsm7 (predicted) [Schizosaccharomyces pombe 972h-]" . . . . . 58.55 113 100.00 100.00 1.32e-72 . . . . 17782 1 5 no SP O74499 . "RecName: Full=U6 snRNA-associated Sm-like protein LSm7" . . . . . 58.55 113 100.00 100.00 1.32e-72 . . . . 17782 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 801 MET . 17782 1 2 802 SER . 17782 1 3 803 MET . 17782 1 4 804 THR . 17782 1 5 805 ILE . 17782 1 6 806 LEU . 17782 1 7 807 PRO . 17782 1 8 808 LEU . 17782 1 9 809 GLU . 17782 1 10 810 LEU . 17782 1 11 811 ILE . 17782 1 12 812 ASP . 17782 1 13 813 LYS . 17782 1 14 814 CYS . 17782 1 15 815 ILE . 17782 1 16 816 GLY . 17782 1 17 817 SER . 17782 1 18 818 ASN . 17782 1 19 819 LEU . 17782 1 20 820 TRP . 17782 1 21 821 VAL . 17782 1 22 822 ILE . 17782 1 23 823 MET . 17782 1 24 824 LYS . 17782 1 25 825 SER . 17782 1 26 826 GLU . 17782 1 27 827 ARG . 17782 1 28 828 GLU . 17782 1 29 829 PHE . 17782 1 30 830 ALA . 17782 1 31 831 GLY . 17782 1 32 832 THR . 17782 1 33 833 LEU . 17782 1 34 834 VAL . 17782 1 35 835 GLY . 17782 1 36 836 PHE . 17782 1 37 837 ASP . 17782 1 38 838 ASP . 17782 1 39 839 TYR . 17782 1 40 840 VAL . 17782 1 41 841 ASN . 17782 1 42 842 ILE . 17782 1 43 843 VAL . 17782 1 44 844 LEU . 17782 1 45 845 LYS . 17782 1 46 846 ASP . 17782 1 47 847 VAL . 17782 1 48 848 THR . 17782 1 49 849 GLU . 17782 1 50 850 TYR . 17782 1 51 851 ASP . 17782 1 52 852 THR . 17782 1 53 853 VAL . 17782 1 54 854 THR . 17782 1 55 855 GLY . 17782 1 56 856 VAL . 17782 1 57 857 THR . 17782 1 58 858 GLU . 17782 1 59 859 LYS . 17782 1 60 860 HIS . 17782 1 61 861 SER . 17782 1 62 862 GLU . 17782 1 63 863 MET . 17782 1 64 864 LEU . 17782 1 65 865 LEU . 17782 1 66 866 ASN . 17782 1 67 867 GLY . 17782 1 68 868 ASN . 17782 1 69 869 GLY . 17782 1 70 870 MET . 17782 1 71 871 CYS . 17782 1 72 872 MET . 17782 1 73 873 LEU . 17782 1 74 874 ILE . 17782 1 75 875 PRO . 17782 1 76 876 GLY . 17782 1 77 877 GLY . 17782 1 78 878 LYS . 17782 1 79 879 PRO . 17782 1 80 880 GLU . 17782 1 81 1201 MET . 17782 1 82 1202 SER . 17782 1 83 1203 SER . 17782 1 84 1204 LEU . 17782 1 85 1205 GLN . 17782 1 86 1206 LYS . 17782 1 87 1207 ARG . 17782 1 88 1208 PRO . 17782 1 89 1209 GLY . 17782 1 90 1210 PRO . 17782 1 91 1211 GLY . 17782 1 92 1212 ASN . 17782 1 93 1213 SER . 17782 1 94 1214 SER . 17782 1 95 1215 GLN . 17782 1 96 1216 PRO . 17782 1 97 1217 THR . 17782 1 98 1218 GLU . 17782 1 99 1219 ARG . 17782 1 100 1220 PRO . 17782 1 101 1221 ARG . 17782 1 102 1222 LYS . 17782 1 103 1223 GLU . 17782 1 104 1224 SER . 17782 1 105 1225 ILE . 17782 1 106 1226 LEU . 17782 1 107 1227 ASP . 17782 1 108 1228 LEU . 17782 1 109 1229 SER . 17782 1 110 1230 ARG . 17782 1 111 1231 TYR . 17782 1 112 1232 GLN . 17782 1 113 1233 ASP . 17782 1 114 1234 GLN . 17782 1 115 1235 ARG . 17782 1 116 1236 ILE . 17782 1 117 1237 GLN . 17782 1 118 1238 ALA . 17782 1 119 1239 THR . 17782 1 120 1240 PHE . 17782 1 121 1241 THR . 17782 1 122 1242 GLY . 17782 1 123 1243 GLY . 17782 1 124 1244 ARG . 17782 1 125 1245 GLN . 17782 1 126 1246 ILE . 17782 1 127 1247 THR . 17782 1 128 1248 GLY . 17782 1 129 1249 ILE . 17782 1 130 1250 LEU . 17782 1 131 1251 LYS . 17782 1 132 1252 GLY . 17782 1 133 1253 PHE . 17782 1 134 1254 ASP . 17782 1 135 1255 GLN . 17782 1 136 1256 LEU . 17782 1 137 1257 MET . 17782 1 138 1258 ASN . 17782 1 139 1259 LEU . 17782 1 140 1260 VAL . 17782 1 141 1261 LEU . 17782 1 142 1262 ASP . 17782 1 143 1263 ASP . 17782 1 144 1264 VAL . 17782 1 145 1265 GLU . 17782 1 146 1266 GLU . 17782 1 147 1267 GLN . 17782 1 148 1268 LEU . 17782 1 149 1269 ARG . 17782 1 150 1270 ASN . 17782 1 151 1271 PRO . 17782 1 152 1272 GLU . 17782 1 153 1273 ASP . 17782 1 154 1274 GLY . 17782 1 155 1275 LYS . 17782 1 156 1276 LEU . 17782 1 157 1277 THR . 17782 1 158 1278 GLY . 17782 1 159 1279 ALA . 17782 1 160 1280 ILE . 17782 1 161 1281 ARG . 17782 1 162 1282 LYS . 17782 1 163 1283 LEU . 17782 1 164 1284 GLY . 17782 1 165 1285 LEU . 17782 1 166 1286 VAL . 17782 1 167 1287 VAL . 17782 1 168 1288 VAL . 17782 1 169 1289 ARG . 17782 1 170 1290 GLY . 17782 1 171 1291 THR . 17782 1 172 1292 THR . 17782 1 173 1293 LEU . 17782 1 174 1294 VAL . 17782 1 175 1295 LEU . 17782 1 176 1296 ILE . 17782 1 177 1297 ALA . 17782 1 178 1298 PRO . 17782 1 179 1299 MET . 17782 1 180 1300 ASP . 17782 1 181 1301 GLY . 17782 1 182 1302 SER . 17782 1 183 1303 GLU . 17782 1 184 1304 GLU . 17782 1 185 1305 ILE . 17782 1 186 1306 PRO . 17782 1 187 1307 ASN . 17782 1 188 1308 PRO . 17782 1 189 1309 PHE . 17782 1 190 1310 VAL . 17782 1 191 1311 GLN . 17782 1 192 1312 ALA . 17782 1 193 1313 GLU . 17782 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 17782 1 . SER 2 2 17782 1 . MET 3 3 17782 1 . THR 4 4 17782 1 . ILE 5 5 17782 1 . LEU 6 6 17782 1 . PRO 7 7 17782 1 . LEU 8 8 17782 1 . GLU 9 9 17782 1 . LEU 10 10 17782 1 . ILE 11 11 17782 1 . ASP 12 12 17782 1 . LYS 13 13 17782 1 . CYS 14 14 17782 1 . ILE 15 15 17782 1 . GLY 16 16 17782 1 . SER 17 17 17782 1 . ASN 18 18 17782 1 . LEU 19 19 17782 1 . TRP 20 20 17782 1 . VAL 21 21 17782 1 . ILE 22 22 17782 1 . MET 23 23 17782 1 . LYS 24 24 17782 1 . SER 25 25 17782 1 . GLU 26 26 17782 1 . ARG 27 27 17782 1 . GLU 28 28 17782 1 . PHE 29 29 17782 1 . ALA 30 30 17782 1 . GLY 31 31 17782 1 . THR 32 32 17782 1 . LEU 33 33 17782 1 . VAL 34 34 17782 1 . GLY 35 35 17782 1 . PHE 36 36 17782 1 . ASP 37 37 17782 1 . ASP 38 38 17782 1 . TYR 39 39 17782 1 . VAL 40 40 17782 1 . ASN 41 41 17782 1 . ILE 42 42 17782 1 . VAL 43 43 17782 1 . LEU 44 44 17782 1 . LYS 45 45 17782 1 . ASP 46 46 17782 1 . VAL 47 47 17782 1 . THR 48 48 17782 1 . GLU 49 49 17782 1 . TYR 50 50 17782 1 . ASP 51 51 17782 1 . THR 52 52 17782 1 . VAL 53 53 17782 1 . THR 54 54 17782 1 . GLY 55 55 17782 1 . VAL 56 56 17782 1 . THR 57 57 17782 1 . GLU 58 58 17782 1 . LYS 59 59 17782 1 . HIS 60 60 17782 1 . SER 61 61 17782 1 . GLU 62 62 17782 1 . MET 63 63 17782 1 . LEU 64 64 17782 1 . LEU 65 65 17782 1 . ASN 66 66 17782 1 . GLY 67 67 17782 1 . ASN 68 68 17782 1 . GLY 69 69 17782 1 . MET 70 70 17782 1 . CYS 71 71 17782 1 . MET 72 72 17782 1 . LEU 73 73 17782 1 . ILE 74 74 17782 1 . PRO 75 75 17782 1 . GLY 76 76 17782 1 . GLY 77 77 17782 1 . LYS 78 78 17782 1 . PRO 79 79 17782 1 . GLU 80 80 17782 1 . MET 81 81 17782 1 . SER 82 82 17782 1 . SER 83 83 17782 1 . LEU 84 84 17782 1 . GLN 85 85 17782 1 . LYS 86 86 17782 1 . ARG 87 87 17782 1 . PRO 88 88 17782 1 . GLY 89 89 17782 1 . PRO 90 90 17782 1 . GLY 91 91 17782 1 . ASN 92 92 17782 1 . SER 93 93 17782 1 . SER 94 94 17782 1 . GLN 95 95 17782 1 . PRO 96 96 17782 1 . THR 97 97 17782 1 . GLU 98 98 17782 1 . ARG 99 99 17782 1 . PRO 100 100 17782 1 . ARG 101 101 17782 1 . LYS 102 102 17782 1 . GLU 103 103 17782 1 . SER 104 104 17782 1 . ILE 105 105 17782 1 . LEU 106 106 17782 1 . ASP 107 107 17782 1 . LEU 108 108 17782 1 . SER 109 109 17782 1 . ARG 110 110 17782 1 . TYR 111 111 17782 1 . GLN 112 112 17782 1 . ASP 113 113 17782 1 . GLN 114 114 17782 1 . ARG 115 115 17782 1 . ILE 116 116 17782 1 . GLN 117 117 17782 1 . ALA 118 118 17782 1 . THR 119 119 17782 1 . PHE 120 120 17782 1 . THR 121 121 17782 1 . GLY 122 122 17782 1 . GLY 123 123 17782 1 . ARG 124 124 17782 1 . GLN 125 125 17782 1 . ILE 126 126 17782 1 . THR 127 127 17782 1 . GLY 128 128 17782 1 . ILE 129 129 17782 1 . LEU 130 130 17782 1 . LYS 131 131 17782 1 . GLY 132 132 17782 1 . PHE 133 133 17782 1 . ASP 134 134 17782 1 . GLN 135 135 17782 1 . LEU 136 136 17782 1 . MET 137 137 17782 1 . ASN 138 138 17782 1 . LEU 139 139 17782 1 . VAL 140 140 17782 1 . LEU 141 141 17782 1 . ASP 142 142 17782 1 . ASP 143 143 17782 1 . VAL 144 144 17782 1 . GLU 145 145 17782 1 . GLU 146 146 17782 1 . GLN 147 147 17782 1 . LEU 148 148 17782 1 . ARG 149 149 17782 1 . ASN 150 150 17782 1 . PRO 151 151 17782 1 . GLU 152 152 17782 1 . ASP 153 153 17782 1 . GLY 154 154 17782 1 . LYS 155 155 17782 1 . LEU 156 156 17782 1 . THR 157 157 17782 1 . GLY 158 158 17782 1 . ALA 159 159 17782 1 . ILE 160 160 17782 1 . ARG 161 161 17782 1 . LYS 162 162 17782 1 . LEU 163 163 17782 1 . GLY 164 164 17782 1 . LEU 165 165 17782 1 . VAL 166 166 17782 1 . VAL 167 167 17782 1 . VAL 168 168 17782 1 . ARG 169 169 17782 1 . GLY 170 170 17782 1 . THR 171 171 17782 1 . THR 172 172 17782 1 . LEU 173 173 17782 1 . VAL 174 174 17782 1 . LEU 175 175 17782 1 . ILE 176 176 17782 1 . ALA 177 177 17782 1 . PRO 178 178 17782 1 . MET 179 179 17782 1 . ASP 180 180 17782 1 . GLY 181 181 17782 1 . SER 182 182 17782 1 . GLU 183 183 17782 1 . GLU 184 184 17782 1 . ILE 185 185 17782 1 . PRO 186 186 17782 1 . ASN 187 187 17782 1 . PRO 188 188 17782 1 . PHE 189 189 17782 1 . VAL 190 190 17782 1 . GLN 191 191 17782 1 . ALA 192 192 17782 1 . GLU 193 193 17782 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 17782 _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 $lsm57 . 4896 organism . 'Schizosaccharomyces pombe' 'fission yeast' . . Eukaryota Fungi Schizosaccharomyces pombe . . . . . . . . . . . . . . . . . . . . . 17782 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 17782 _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 $lsm57 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . . . . . . . . . . . pet . . . . . . 17782 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 17782 _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 lsm57 '[U-100% 13C; U-100% 15N; U-80% 2H]' . . 1 $lsm57 . . 1 . . mM . . . . 17782 1 2 H2O 'natural abundance' . . . . . . 95 . . % . . . . 17782 1 3 D2O 'natural abundance' . . . . . . 5 . . % . . . . 17782 1 4 'NaPO4 pH 7.5' 'natural abundance' . . . . . . 50 . . mM . . . . 17782 1 5 NaCl 'natural abundance' . . . . . . 150 . . mM . . . . 17782 1 6 DTT 'natural abundance' . . . . . . 1 . . mM . . . . 17782 1 7 NaN3 'natural abundance' . . . . . . 0.3 . . % . . . . 17782 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 17782 _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' 0.15 . M 17782 1 pH 7.5 . pH 17782 1 pressure 1 . atm 17782 1 temperature 318 . K 17782 1 stop_ save_ ############################ # Computer software used # ############################ save_TOPSPIN _Software.Sf_category software _Software.Sf_framecode TOPSPIN _Software.Entry_ID 17782 _Software.ID 1 _Software.Name TOPSPIN _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 17782 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 17782 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 17782 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DRX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 17782 _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 . 800 . . . 17782 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 17782 _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 HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17782 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 17782 _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 0 na indirect 0 . . . . . . . . . 17782 1 H 1 water protons . . . . ppm 0 na direct 0 . . . . . . . . . 17782 1 N 15 water protons . . . . ppm 0 na indirect 0 . . . . . . . . . 17782 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 17782 _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 1 '3D HNCACB' . . . 17782 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 4 4 THR CA C 13 59.531 0.05 . 1 . . . . 804 THR CA . 17782 1 2 . 1 1 4 4 THR CB C 13 66.759 0.05 . 1 . . . . 804 THR CB . 17782 1 3 . 1 1 5 5 ILE H H 1 8.021 0.02 . 1 . . . . 805 ILE HN . 17782 1 4 . 1 1 5 5 ILE CA C 13 57.264 0.030 . 1 . . . . 805 ILE CA . 17782 1 5 . 1 1 5 5 ILE CB C 13 36.110 0.006 . 1 . . . . 805 ILE CB . 17782 1 6 . 1 1 5 5 ILE N N 15 125.316 0.03 . 1 . . . . 805 ILE N . 17782 1 7 . 1 1 6 6 LEU H H 1 8.362 0.02 . 1 . . . . 806 LEU HN . 17782 1 8 . 1 1 6 6 LEU CA C 13 48.894 0.05 . 1 . . . . 806 LEU CA . 17782 1 9 . 1 1 6 6 LEU CB C 13 37.595 0.05 . 1 . . . . 806 LEU CB . 17782 1 10 . 1 1 6 6 LEU N N 15 126.956 0.03 . 1 . . . . 806 LEU N . 17782 1 11 . 1 1 7 7 PRO CA C 13 63.003 0.05 . 1 . . . . 807 PRO CA . 17782 1 12 . 1 1 7 7 PRO CB C 13 29.338 0.05 . 1 . . . . 807 PRO CB . 17782 1 13 . 1 1 8 8 LEU H H 1 9.588 0.02 . 1 . . . . 808 LEU HN . 17782 1 14 . 1 1 8 8 LEU CA C 13 54.526 0.132 . 1 . . . . 808 LEU CA . 17782 1 15 . 1 1 8 8 LEU CB C 13 36.282 0.05 . 1 . . . . 808 LEU CB . 17782 1 16 . 1 1 8 8 LEU N N 15 114.489 0.03 . 1 . . . . 808 LEU N . 17782 1 17 . 1 1 9 9 GLU H H 1 7.090 0.02 . 1 . . . . 809 GLU HN . 17782 1 18 . 1 1 9 9 GLU CA C 13 55.951 0.133 . 1 . . . . 809 GLU CA . 17782 1 19 . 1 1 9 9 GLU CB C 13 26.040 0.030 . 1 . . . . 809 GLU CB . 17782 1 20 . 1 1 9 9 GLU N N 15 119.629 0.03 . 1 . . . . 809 GLU N . 17782 1 21 . 1 1 10 10 LEU H H 1 7.480 0.02 . 1 . . . . 810 LEU HN . 17782 1 22 . 1 1 10 10 LEU CA C 13 54.689 0.118 . 1 . . . . 810 LEU CA . 17782 1 23 . 1 1 10 10 LEU CB C 13 37.832 0.184 . 1 . . . . 810 LEU CB . 17782 1 24 . 1 1 10 10 LEU N N 15 120.395 0.03 . 1 . . . . 810 LEU N . 17782 1 25 . 1 1 11 11 ILE H H 1 7.342 0.02 . 1 . . . . 811 ILE HN . 17782 1 26 . 1 1 11 11 ILE CA C 13 60.587 0.019 . 1 . . . . 811 ILE CA . 17782 1 27 . 1 1 11 11 ILE CB C 13 31.918 0.030 . 1 . . . . 811 ILE CB . 17782 1 28 . 1 1 11 11 ILE N N 15 117.004 0.03 . 1 . . . . 811 ILE N . 17782 1 29 . 1 1 12 12 ASP H H 1 7.742 0.02 . 1 . . . . 812 ASP HN . 17782 1 30 . 1 1 12 12 ASP CA C 13 55.046 0.119 . 1 . . . . 812 ASP CA . 17782 1 31 . 1 1 12 12 ASP CB C 13 39.495 0.125 . 1 . . . . 812 ASP CB . 17782 1 32 . 1 1 12 12 ASP N N 15 120.504 0.03 . 1 . . . . 812 ASP N . 17782 1 33 . 1 1 13 13 LYS H H 1 7.498 0.02 . 1 . . . . 813 LYS HN . 17782 1 34 . 1 1 13 13 LYS CA C 13 55.238 0.164 . 1 . . . . 813 LYS CA . 17782 1 35 . 1 1 13 13 LYS CB C 13 28.771 0.149 . 1 . . . . 813 LYS CB . 17782 1 36 . 1 1 13 13 LYS N N 15 116.239 0.03 . 1 . . . . 813 LYS N . 17782 1 37 . 1 1 14 14 CYS H H 1 7.736 0.02 . 1 . . . . 814 CYS HN . 17782 1 38 . 1 1 14 14 CYS CA C 13 56.114 0.059 . 1 . . . . 814 CYS CA . 17782 1 39 . 1 1 14 14 CYS CB C 13 24.941 0.177 . 1 . . . . 814 CYS CB . 17782 1 40 . 1 1 14 14 CYS N N 15 116.895 0.03 . 1 . . . . 814 CYS N . 17782 1 41 . 1 1 15 15 ILE H H 1 7.450 0.02 . 1 . . . . 815 ILE HN . 17782 1 42 . 1 1 15 15 ILE CA C 13 61.773 0.136 . 1 . . . . 815 ILE CA . 17782 1 43 . 1 1 15 15 ILE CB C 13 33.136 0.119 . 1 . . . . 815 ILE CB . 17782 1 44 . 1 1 15 15 ILE N N 15 123.019 0.03 . 1 . . . . 815 ILE N . 17782 1 45 . 1 1 16 16 GLY H H 1 9.553 0.02 . 1 . . . . 816 GLY HN . 17782 1 46 . 1 1 16 16 GLY CA C 13 42.199 0.215 . 1 . . . . 816 GLY CA . 17782 1 47 . 1 1 16 16 GLY N N 15 117.879 0.03 . 1 . . . . 816 GLY N . 17782 1 48 . 1 1 17 17 SER H H 1 8.784 0.02 . 1 . . . . 817 SER HN . 17782 1 49 . 1 1 17 17 SER CA C 13 54.050 0.05 . 1 . . . . 817 SER CA . 17782 1 50 . 1 1 17 17 SER CB C 13 61.846 0.05 . 1 . . . . 817 SER CB . 17782 1 51 . 1 1 17 17 SER N N 15 118.098 0.03 . 1 . . . . 817 SER N . 17782 1 52 . 1 1 18 18 ASN H H 1 8.328 0.02 . 1 . . . . 818 ASN HN . 17782 1 53 . 1 1 18 18 ASN CA C 13 51.224 0.05 . 1 . . . . 818 ASN CA . 17782 1 54 . 1 1 18 18 ASN CB C 13 36.589 0.05 . 1 . . . . 818 ASN CB . 17782 1 55 . 1 1 18 18 ASN N N 15 119.551 0.03 . 1 . . . . 818 ASN N . 17782 1 56 . 1 1 19 19 LEU H H 1 9.204 0.02 . 1 . . . . 819 LEU HN . 17782 1 57 . 1 1 19 19 LEU CA C 13 51.535 0.091 . 1 . . . . 819 LEU CA . 17782 1 58 . 1 1 19 19 LEU CB C 13 43.825 0.014 . 1 . . . . 819 LEU CB . 17782 1 59 . 1 1 19 19 LEU N N 15 123.457 0.03 . 1 . . . . 819 LEU N . 17782 1 60 . 1 1 20 20 TRP H H 1 8.214 0.02 . 1 . . . . 820 TRP HN . 17782 1 61 . 1 1 20 20 TRP CA C 13 50.228 0.033 . 1 . . . . 820 TRP CA . 17782 1 62 . 1 1 20 20 TRP CB C 13 28.850 0.132 . 1 . . . . 820 TRP CB . 17782 1 63 . 1 1 20 20 TRP N N 15 128.488 0.03 . 1 . . . . 820 TRP N . 17782 1 64 . 1 1 21 21 VAL H H 1 10.144 0.02 . 1 . . . . 821 VAL HN . 17782 1 65 . 1 1 21 21 VAL CA C 13 58.143 0.05 . 1 . . . . 821 VAL CA . 17782 1 66 . 1 1 21 21 VAL CB C 13 31.639 0.077 . 1 . . . . 821 VAL CB . 17782 1 67 . 1 1 21 21 VAL N N 15 127.722 0.03 . 1 . . . . 821 VAL N . 17782 1 68 . 1 1 22 22 ILE H H 1 8.722 0.02 . 1 . . . . 822 ILE HN . 17782 1 69 . 1 1 22 22 ILE CA C 13 57.833 0.040 . 1 . . . . 822 ILE CA . 17782 1 70 . 1 1 22 22 ILE CB C 13 36.211 0.05 . 1 . . . . 822 ILE CB . 17782 1 71 . 1 1 22 22 ILE N N 15 126.300 0.03 . 1 . . . . 822 ILE N . 17782 1 72 . 1 1 23 23 MET H H 1 7.883 0.02 . 1 . . . . 823 MET HN . 17782 1 73 . 1 1 23 23 MET CA C 13 50.993 0.030 . 1 . . . . 823 MET CA . 17782 1 74 . 1 1 23 23 MET CB C 13 28.130 0.05 . 1 . . . . 823 MET CB . 17782 1 75 . 1 1 23 23 MET N N 15 125.457 0.03 . 1 . . . . 823 MET N . 17782 1 76 . 1 1 24 24 LYS H H 1 8.307 0.02 . 1 . . . . 824 LYS HN . 17782 1 77 . 1 1 24 24 LYS CA C 13 56.028 0.035 . 1 . . . . 824 LYS CA . 17782 1 78 . 1 1 24 24 LYS CB C 13 29.169 0.026 . 1 . . . . 824 LYS CB . 17782 1 79 . 1 1 24 24 LYS N N 15 117.223 0.03 . 1 . . . . 824 LYS N . 17782 1 80 . 1 1 25 25 SER H H 1 7.271 0.02 . 1 . . . . 825 SER HN . 17782 1 81 . 1 1 25 25 SER CA C 13 53.868 0.05 . 1 . . . . 825 SER CA . 17782 1 82 . 1 1 25 25 SER CB C 13 60.742 0.05 . 1 . . . . 825 SER CB . 17782 1 83 . 1 1 25 25 SER N N 15 114.082 0.03 . 1 . . . . 825 SER N . 17782 1 84 . 1 1 26 26 GLU CA C 13 53.455 0.05 . 1 . . . . 826 GLU CA . 17782 1 85 . 1 1 26 26 GLU CB C 13 27.079 0.05 . 1 . . . . 826 GLU CB . 17782 1 86 . 1 1 27 27 ARG H H 1 8.224 0.02 . 1 . . . . 827 ARG HN . 17782 1 87 . 1 1 27 27 ARG CA C 13 51.826 0.148 . 1 . . . . 827 ARG CA . 17782 1 88 . 1 1 27 27 ARG CB C 13 30.035 0.020 . 1 . . . . 827 ARG CB . 17782 1 89 . 1 1 27 27 ARG N N 15 124.363 0.03 . 1 . . . . 827 ARG N . 17782 1 90 . 1 1 28 28 GLU H H 1 8.433 0.02 . 1 . . . . 828 GLU HN . 17782 1 91 . 1 1 28 28 GLU CA C 13 50.292 0.024 . 1 . . . . 828 GLU CA . 17782 1 92 . 1 1 28 28 GLU CB C 13 31.111 0.070 . 1 . . . . 828 GLU CB . 17782 1 93 . 1 1 28 28 GLU N N 15 119.629 0.03 . 1 . . . . 828 GLU N . 17782 1 94 . 1 1 29 29 PHE H H 1 9.364 0.02 . 1 . . . . 829 PHE HN . 17782 1 95 . 1 1 29 29 PHE CA C 13 53.544 0.030 . 1 . . . . 829 PHE CA . 17782 1 96 . 1 1 29 29 PHE CB C 13 41.480 0.05 . 1 . . . . 829 PHE CB . 17782 1 97 . 1 1 29 29 PHE N N 15 116.895 0.03 . 1 . . . . 829 PHE N . 17782 1 98 . 1 1 30 30 ALA H H 1 9.419 0.02 . 1 . . . . 830 ALA HN . 17782 1 99 . 1 1 30 30 ALA CA C 13 48.373 0.038 . 1 . . . . 830 ALA CA . 17782 1 100 . 1 1 30 30 ALA CB C 13 19.550 0.041 . 1 . . . . 830 ALA CB . 17782 1 101 . 1 1 30 30 ALA N N 15 123.676 0.03 . 1 . . . . 830 ALA N . 17782 1 102 . 1 1 31 31 GLY H H 1 8.569 0.02 . 1 . . . . 831 GLY HN . 17782 1 103 . 1 1 31 31 GLY CA C 13 43.363 0.026 . 1 . . . . 831 GLY CA . 17782 1 104 . 1 1 31 31 GLY N N 15 108.365 0.03 . 1 . . . . 831 GLY N . 17782 1 105 . 1 1 32 32 THR H H 1 9.152 0.02 . 1 . . . . 832 THR HN . 17782 1 106 . 1 1 32 32 THR CA C 13 59.384 0.029 . 1 . . . . 832 THR CA . 17782 1 107 . 1 1 32 32 THR CB C 13 66.414 0.130 . 1 . . . . 832 THR CB . 17782 1 108 . 1 1 32 32 THR N N 15 119.520 0.03 . 1 . . . . 832 THR N . 17782 1 109 . 1 1 33 33 LEU H H 1 8.846 0.02 . 1 . . . . 833 LEU HN . 17782 1 110 . 1 1 33 33 LEU CA C 13 53.066 0.05 . 1 . . . . 833 LEU CA . 17782 1 111 . 1 1 33 33 LEU CB C 13 37.518 0.05 . 1 . . . . 833 LEU CB . 17782 1 112 . 1 1 33 33 LEU N N 15 129.144 0.03 . 1 . . . . 833 LEU N . 17782 1 113 . 1 1 35 35 GLY CA C 13 42.551 0.05 . 1 . . . . 835 GLY CA . 17782 1 114 . 1 1 36 36 PHE H H 1 8.165 0.02 . 1 . . . . 836 PHE HN . 17782 1 115 . 1 1 36 36 PHE CA C 13 53.183 0.089 . 1 . . . . 836 PHE CA . 17782 1 116 . 1 1 36 36 PHE CB C 13 38.866 0.029 . 1 . . . . 836 PHE CB . 17782 1 117 . 1 1 36 36 PHE N N 15 116.488 0.03 . 1 . . . . 836 PHE N . 17782 1 118 . 1 1 37 37 ASP H H 1 7.999 0.02 . 1 . . . . 837 ASP HN . 17782 1 119 . 1 1 37 37 ASP CA C 13 48.864 0.030 . 1 . . . . 837 ASP CA . 17782 1 120 . 1 1 37 37 ASP CB C 13 40.228 0.030 . 1 . . . . 837 ASP CB . 17782 1 121 . 1 1 37 37 ASP N N 15 120.941 0.03 . 1 . . . . 837 ASP N . 17782 1 122 . 1 1 38 38 ASP H H 1 7.854 0.02 . 1 . . . . 838 ASP HN . 17782 1 123 . 1 1 38 38 ASP CA C 13 53.449 0.05 . 1 . . . . 838 ASP CA . 17782 1 124 . 1 1 38 38 ASP CB C 13 37.416 0.05 . 1 . . . . 838 ASP CB . 17782 1 125 . 1 1 38 38 ASP N N 15 115.364 0.03 . 1 . . . . 838 ASP N . 17782 1 126 . 1 1 39 39 TYR CA C 13 54.123 0.05 . 1 . . . . 839 TYR CA . 17782 1 127 . 1 1 39 39 TYR CB C 13 34.374 0.05 . 1 . . . . 839 TYR CB . 17782 1 128 . 1 1 40 40 VAL H H 1 8.448 0.02 . 1 . . . . 840 VAL HN . 17782 1 129 . 1 1 40 40 VAL CA C 13 60.972 0.114 . 1 . . . . 840 VAL CA . 17782 1 130 . 1 1 40 40 VAL CB C 13 26.549 0.064 . 1 . . . . 840 VAL CB . 17782 1 131 . 1 1 40 40 VAL N N 15 117.801 0.03 . 1 . . . . 840 VAL N . 17782 1 132 . 1 1 41 41 ASN H H 1 8.321 0.02 . 1 . . . . 841 ASN HN . 17782 1 133 . 1 1 41 41 ASN CA C 13 50.854 0.067 . 1 . . . . 841 ASN CA . 17782 1 134 . 1 1 41 41 ASN CB C 13 34.484 0.032 . 1 . . . . 841 ASN CB . 17782 1 135 . 1 1 41 41 ASN N N 15 116.488 0.03 . 1 . . . . 841 ASN N . 17782 1 136 . 1 1 42 42 ILE H H 1 8.260 0.02 . 1 . . . . 842 ILE HN . 17782 1 137 . 1 1 42 42 ILE CA C 13 56.400 0.007 . 1 . . . . 842 ILE CA . 17782 1 138 . 1 1 42 42 ILE CB C 13 37.713 0.05 . 1 . . . . 842 ILE CB . 17782 1 139 . 1 1 42 42 ILE N N 15 120.395 0.03 . 1 . . . . 842 ILE N . 17782 1 140 . 1 1 43 43 VAL H H 1 8.275 0.02 . 1 . . . . 843 VAL HN . 17782 1 141 . 1 1 43 43 VAL CA C 13 58.543 0.006 . 1 . . . . 843 VAL CA . 17782 1 142 . 1 1 43 43 VAL CB C 13 29.973 0.050 . 1 . . . . 843 VAL CB . 17782 1 143 . 1 1 43 43 VAL N N 15 124.363 0.03 . 1 . . . . 843 VAL N . 17782 1 144 . 1 1 44 44 LEU H H 1 8.662 0.02 . 1 . . . . 844 LEU HN . 17782 1 145 . 1 1 44 44 LEU CA C 13 49.257 0.029 . 1 . . . . 844 LEU CA . 17782 1 146 . 1 1 44 44 LEU CB C 13 44.396 0.097 . 1 . . . . 844 LEU CB . 17782 1 147 . 1 1 44 44 LEU N N 15 126.191 0.03 . 1 . . . . 844 LEU N . 17782 1 148 . 1 1 45 45 LYS H H 1 9.197 0.02 . 1 . . . . 845 LYS HN . 17782 1 149 . 1 1 45 45 LYS CA C 13 51.364 0.059 . 1 . . . . 845 LYS CA . 17782 1 150 . 1 1 45 45 LYS CB C 13 33.165 0.030 . 1 . . . . 845 LYS CB . 17782 1 151 . 1 1 45 45 LYS N N 15 120.067 0.03 . 1 . . . . 845 LYS N . 17782 1 152 . 1 1 46 46 ASP H H 1 8.701 0.02 . 1 . . . . 846 ASP HN . 17782 1 153 . 1 1 46 46 ASP CA C 13 53.621 0.059 . 1 . . . . 846 ASP CA . 17782 1 154 . 1 1 46 46 ASP CB C 13 35.511 0.119 . 1 . . . . 846 ASP CB . 17782 1 155 . 1 1 46 46 ASP N N 15 123.051 0.03 . 1 . . . . 846 ASP N . 17782 1 156 . 1 1 47 47 VAL H H 1 8.402 0.02 . 1 . . . . 847 VAL HN . 17782 1 157 . 1 1 47 47 VAL CA C 13 58.179 0.163 . 1 . . . . 847 VAL CA . 17782 1 158 . 1 1 47 47 VAL CB C 13 32.366 0.122 . 1 . . . . 847 VAL CB . 17782 1 159 . 1 1 47 47 VAL N N 15 120.863 0.03 . 1 . . . . 847 VAL N . 17782 1 160 . 1 1 48 48 THR H H 1 9.551 0.02 . 1 . . . . 848 THR HN . 17782 1 161 . 1 1 48 48 THR CA C 13 59.736 0.060 . 1 . . . . 848 THR CA . 17782 1 162 . 1 1 48 48 THR CB C 13 66.792 0.168 . 1 . . . . 848 THR CB . 17782 1 163 . 1 1 48 48 THR N N 15 124.332 0.03 . 1 . . . . 848 THR N . 17782 1 164 . 1 1 49 49 GLU H H 1 9.476 0.02 . 1 . . . . 849 GLU HN . 17782 1 165 . 1 1 49 49 GLU CA C 13 50.949 0.059 . 1 . . . . 849 GLU CA . 17782 1 166 . 1 1 49 49 GLU CB C 13 29.396 0.121 . 1 . . . . 849 GLU CB . 17782 1 167 . 1 1 49 49 GLU N N 15 130.128 0.03 . 1 . . . . 849 GLU N . 17782 1 168 . 1 1 50 50 TYR H H 1 9.163 0.02 . 1 . . . . 850 TYR HN . 17782 1 169 . 1 1 50 50 TYR CA C 13 53.799 0.059 . 1 . . . . 850 TYR CA . 17782 1 170 . 1 1 50 50 TYR CB C 13 36.466 0.064 . 1 . . . . 850 TYR CB . 17782 1 171 . 1 1 50 50 TYR N N 15 124.769 0.03 . 1 . . . . 850 TYR N . 17782 1 172 . 1 1 51 51 ASP H H 1 8.077 0.02 . 1 . . . . 851 ASP HN . 17782 1 173 . 1 1 51 51 ASP CA C 13 50.207 0.030 . 1 . . . . 851 ASP CA . 17782 1 174 . 1 1 51 51 ASP CB C 13 38.658 0.05 . 1 . . . . 851 ASP CB . 17782 1 175 . 1 1 51 51 ASP N N 15 123.457 0.03 . 1 . . . . 851 ASP N . 17782 1 176 . 1 1 52 52 THR H H 1 7.833 0.02 . 1 . . . . 852 THR HN . 17782 1 177 . 1 1 52 52 THR CA C 13 60.954 0.030 . 1 . . . . 852 THR CA . 17782 1 178 . 1 1 52 52 THR CB C 13 64.458 0.030 . 1 . . . . 852 THR CB . 17782 1 179 . 1 1 52 52 THR N N 15 116.676 0.03 . 1 . . . . 852 THR N . 17782 1 180 . 1 1 53 53 VAL H H 1 8.705 0.02 . 1 . . . . 853 VAL HN . 17782 1 181 . 1 1 53 53 VAL CA C 13 62.379 0.089 . 1 . . . . 853 VAL CA . 17782 1 182 . 1 1 53 53 VAL CB C 13 28.802 0.061 . 1 . . . . 853 VAL CB . 17782 1 183 . 1 1 53 53 VAL N N 15 123.051 0.03 . 1 . . . . 853 VAL N . 17782 1 184 . 1 1 54 54 THR H H 1 7.981 0.02 . 1 . . . . 854 THR HN . 17782 1 185 . 1 1 54 54 THR CA C 13 59.470 0.089 . 1 . . . . 854 THR CA . 17782 1 186 . 1 1 54 54 THR CB C 13 67.178 0.139 . 1 . . . . 854 THR CB . 17782 1 187 . 1 1 54 54 THR N N 15 109.239 0.03 . 1 . . . . 854 THR N . 17782 1 188 . 1 1 55 55 GLY H H 1 8.180 0.02 . 1 . . . . 855 GLY HN . 17782 1 189 . 1 1 55 55 GLY CA C 13 43.000 0.127 . 1 . . . . 855 GLY CA . 17782 1 190 . 1 1 55 55 GLY N N 15 111.427 0.03 . 1 . . . . 855 GLY N . 17782 1 191 . 1 1 56 56 VAL H H 1 7.553 0.02 . 1 . . . . 856 VAL HN . 17782 1 192 . 1 1 56 56 VAL CA C 13 60.332 0.05 . 1 . . . . 856 VAL CA . 17782 1 193 . 1 1 56 56 VAL CB C 13 29.575 0.061 . 1 . . . . 856 VAL CB . 17782 1 194 . 1 1 56 56 VAL N N 15 121.160 0.03 . 1 . . . . 856 VAL N . 17782 1 195 . 1 1 57 57 THR H H 1 8.035 0.02 . 1 . . . . 857 THR HN . 17782 1 196 . 1 1 57 57 THR CA C 13 56.082 0.05 . 1 . . . . 857 THR CA . 17782 1 197 . 1 1 57 57 THR CB C 13 68.726 0.05 . 1 . . . . 857 THR CB . 17782 1 198 . 1 1 57 57 THR N N 15 117.223 0.03 . 1 . . . . 857 THR N . 17782 1 199 . 1 1 58 58 GLU H H 1 8.459 0.02 . 1 . . . . 858 GLU HN . 17782 1 200 . 1 1 58 58 GLU CA C 13 51.752 0.019 . 1 . . . . 858 GLU CA . 17782 1 201 . 1 1 58 58 GLU CB C 13 30.690 0.015 . 1 . . . . 858 GLU CB . 17782 1 202 . 1 1 58 58 GLU N N 15 121.598 0.03 . 1 . . . . 858 GLU N . 17782 1 203 . 1 1 59 59 LYS H H 1 8.410 0.02 . 1 . . . . 859 LYS HN . 17782 1 204 . 1 1 59 59 LYS CA C 13 51.415 0.05 . 1 . . . . 859 LYS CA . 17782 1 205 . 1 1 59 59 LYS CB C 13 30.898 0.074 . 1 . . . . 859 LYS CB . 17782 1 206 . 1 1 59 59 LYS N N 15 122.582 0.03 . 1 . . . . 859 LYS N . 17782 1 207 . 1 1 60 60 HIS H H 1 8.802 0.02 . 1 . . . . 860 HIS HN . 17782 1 208 . 1 1 60 60 HIS CA C 13 51.697 0.05 . 1 . . . . 860 HIS CA . 17782 1 209 . 1 1 60 60 HIS CB C 13 32.012 0.05 . 1 . . . . 860 HIS CB . 17782 1 210 . 1 1 60 60 HIS N N 15 119.410 0.03 . 1 . . . . 860 HIS N . 17782 1 211 . 1 1 61 61 SER CA C 13 57.153 0.05 . 1 . . . . 861 SER CA . 17782 1 212 . 1 1 61 61 SER CB C 13 60.074 0.05 . 1 . . . . 861 SER CB . 17782 1 213 . 1 1 62 62 GLU H H 1 7.748 0.02 . 1 . . . . 862 GLU HN . 17782 1 214 . 1 1 62 62 GLU CA C 13 52.916 0.05 . 1 . . . . 862 GLU CA . 17782 1 215 . 1 1 62 62 GLU CB C 13 30.453 0.134 . 1 . . . . 862 GLU CB . 17782 1 216 . 1 1 62 62 GLU N N 15 119.082 0.03 . 1 . . . . 862 GLU N . 17782 1 217 . 1 1 63 63 MET H H 1 8.825 0.02 . 1 . . . . 863 MET HN . 17782 1 218 . 1 1 63 63 MET CA C 13 51.999 0.030 . 1 . . . . 863 MET CA . 17782 1 219 . 1 1 63 63 MET CB C 13 33.328 0.052 . 1 . . . . 863 MET CB . 17782 1 220 . 1 1 63 63 MET N N 15 121.488 0.03 . 1 . . . . 863 MET N . 17782 1 221 . 1 1 64 64 LEU H H 1 8.107 0.02 . 1 . . . . 864 LEU HN . 17782 1 222 . 1 1 64 64 LEU CA C 13 51.171 0.030 . 1 . . . . 864 LEU CA . 17782 1 223 . 1 1 64 64 LEU CB C 13 39.080 0.065 . 1 . . . . 864 LEU CB . 17782 1 224 . 1 1 64 64 LEU N N 15 128.597 0.03 . 1 . . . . 864 LEU N . 17782 1 225 . 1 1 65 65 LEU H H 1 9.149 0.02 . 1 . . . . 865 LEU HN . 17782 1 226 . 1 1 65 65 LEU CA C 13 49.999 0.018 . 1 . . . . 865 LEU CA . 17782 1 227 . 1 1 65 65 LEU CB C 13 40.637 0.024 . 1 . . . . 865 LEU CB . 17782 1 228 . 1 1 65 65 LEU N N 15 127.066 0.03 . 1 . . . . 865 LEU N . 17782 1 229 . 1 1 66 66 ASN H H 1 7.573 0.02 . 1 . . . . 866 ASN HN . 17782 1 230 . 1 1 66 66 ASN CA C 13 50.957 0.05 . 1 . . . . 866 ASN CA . 17782 1 231 . 1 1 66 66 ASN CB C 13 37.409 0.05 . 1 . . . . 866 ASN CB . 17782 1 232 . 1 1 66 66 ASN N N 15 121.301 0.03 . 1 . . . . 866 ASN N . 17782 1 233 . 1 1 69 69 GLY H H 1 7.363 0.02 . 1 . . . . 869 GLY HN . 17782 1 234 . 1 1 69 69 GLY CA C 13 42.227 0.068 . 1 . . . . 869 GLY CA . 17782 1 235 . 1 1 69 69 GLY N N 15 104.865 0.03 . 1 . . . . 869 GLY N . 17782 1 236 . 1 1 70 70 MET H H 1 7.243 0.02 . 1 . . . . 870 MET HN . 17782 1 237 . 1 1 70 70 MET CA C 13 52.938 0.05 . 1 . . . . 870 MET CA . 17782 1 238 . 1 1 70 70 MET CB C 13 31.858 0.036 . 1 . . . . 870 MET CB . 17782 1 239 . 1 1 70 70 MET N N 15 119.848 0.03 . 1 . . . . 870 MET N . 17782 1 240 . 1 1 71 71 CYS H H 1 8.600 0.02 . 1 . . . . 871 CYS HN . 17782 1 241 . 1 1 71 71 CYS CA C 13 57.178 0.154 . 1 . . . . 871 CYS CA . 17782 1 242 . 1 1 71 71 CYS CB C 13 25.306 0.043 . 1 . . . . 871 CYS CB . 17782 1 243 . 1 1 71 71 CYS N N 15 118.645 0.03 . 1 . . . . 871 CYS N . 17782 1 244 . 1 1 72 72 MET H H 1 7.350 0.02 . 1 . . . . 872 MET HN . 17782 1 245 . 1 1 72 72 MET CA C 13 50.871 0.05 . 1 . . . . 872 MET CA . 17782 1 246 . 1 1 72 72 MET CB C 13 37.641 0.077 . 1 . . . . 872 MET CB . 17782 1 247 . 1 1 72 72 MET N N 15 113.942 0.03 . 1 . . . . 872 MET N . 17782 1 248 . 1 1 73 73 LEU H H 1 9.250 0.02 . 1 . . . . 873 LEU HN . 17782 1 249 . 1 1 73 73 LEU CA C 13 51.852 0.055 . 1 . . . . 873 LEU CA . 17782 1 250 . 1 1 73 73 LEU CB C 13 40.509 0.05 . 1 . . . . 873 LEU CB . 17782 1 251 . 1 1 73 73 LEU N N 15 122.035 0.03 . 1 . . . . 873 LEU N . 17782 1 252 . 1 1 74 74 ILE H H 1 9.738 0.02 . 1 . . . . 874 ILE HN . 17782 1 253 . 1 1 74 74 ILE CA C 13 56.815 0.05 . 1 . . . . 874 ILE CA . 17782 1 254 . 1 1 74 74 ILE CB C 13 35.765 0.05 . 1 . . . . 874 ILE CB . 17782 1 255 . 1 1 74 74 ILE N N 15 124.441 0.03 . 1 . . . . 874 ILE N . 17782 1 256 . 1 1 75 75 PRO CA C 13 60.797 0.05 . 1 . . . . 875 PRO CA . 17782 1 257 . 1 1 75 75 PRO CB C 13 29.398 0.05 . 1 . . . . 875 PRO CB . 17782 1 258 . 1 1 76 76 GLY H H 1 8.627 0.02 . 1 . . . . 876 GLY HN . 17782 1 259 . 1 1 76 76 GLY CA C 13 42.572 0.021 . 1 . . . . 876 GLY CA . 17782 1 260 . 1 1 76 76 GLY N N 15 113.177 0.03 . 1 . . . . 876 GLY N . 17782 1 261 . 1 1 77 77 GLY H H 1 7.430 0.02 . 1 . . . . 877 GLY HN . 17782 1 262 . 1 1 77 77 GLY CA C 13 41.788 0.091 . 1 . . . . 877 GLY CA . 17782 1 263 . 1 1 77 77 GLY N N 15 105.084 0.03 . 1 . . . . 877 GLY N . 17782 1 264 . 1 1 78 78 LYS H H 1 7.991 0.02 . 1 . . . . 878 LYS HN . 17782 1 265 . 1 1 78 78 LYS CA C 13 50.353 0.05 . 1 . . . . 878 LYS CA . 17782 1 266 . 1 1 78 78 LYS CB C 13 30.296 0.05 . 1 . . . . 878 LYS CB . 17782 1 267 . 1 1 78 78 LYS N N 15 121.926 0.03 . 1 . . . . 878 LYS N . 17782 1 268 . 1 1 109 109 SER CA C 13 59.423 0.05 . 1 . . . . 1229 SER CA . 17782 1 269 . 1 1 109 109 SER CB C 13 59.897 0.05 . 1 . . . . 1229 SER CB . 17782 1 270 . 1 1 110 110 ARG H H 1 7.842 0.02 . 1 . . . . 1230 ARG HN . 17782 1 271 . 1 1 110 110 ARG CA C 13 54.645 0.013 . 1 . . . . 1230 ARG CA . 17782 1 272 . 1 1 110 110 ARG CB C 13 25.882 0.05 . 1 . . . . 1230 ARG CB . 17782 1 273 . 1 1 110 110 ARG N N 15 120.832 0.03 . 1 . . . . 1230 ARG N . 17782 1 274 . 1 1 111 111 TYR H H 1 7.673 0.02 . 1 . . . . 1231 TYR HN . 17782 1 275 . 1 1 111 111 TYR CA C 13 54.156 0.05 . 1 . . . . 1231 TYR CA . 17782 1 276 . 1 1 111 111 TYR CB C 13 35.253 0.024 . 1 . . . . 1231 TYR CB . 17782 1 277 . 1 1 111 111 TYR N N 15 117.332 0.03 . 1 . . . . 1231 TYR N . 17782 1 278 . 1 1 112 112 GLN H H 1 7.324 0.02 . 1 . . . . 1232 GLN HN . 17782 1 279 . 1 1 112 112 GLN CA C 13 55.181 0.016 . 1 . . . . 1232 GLN CA . 17782 1 280 . 1 1 112 112 GLN CB C 13 25.218 0.138 . 1 . . . . 1232 GLN CB . 17782 1 281 . 1 1 112 112 GLN N N 15 121.051 0.03 . 1 . . . . 1232 GLN N . 17782 1 282 . 1 1 113 113 ASP H H 1 9.766 0.02 . 1 . . . . 1233 ASP HN . 17782 1 283 . 1 1 113 113 ASP CA C 13 54.482 0.149 . 1 . . . . 1233 ASP CA . 17782 1 284 . 1 1 113 113 ASP CB C 13 36.347 0.243 . 1 . . . . 1233 ASP CB . 17782 1 285 . 1 1 113 113 ASP N N 15 121.270 0.03 . 1 . . . . 1233 ASP N . 17782 1 286 . 1 1 114 114 GLN H H 1 8.416 0.02 . 1 . . . . 1234 GLN HN . 17782 1 287 . 1 1 114 114 GLN CA C 13 51.068 0.059 . 1 . . . . 1234 GLN CA . 17782 1 288 . 1 1 114 114 GLN CB C 13 27.466 0.090 . 1 . . . . 1234 GLN CB . 17782 1 289 . 1 1 114 114 GLN N N 15 117.879 0.03 . 1 . . . . 1234 GLN N . 17782 1 290 . 1 1 115 115 ARG H H 1 8.721 0.02 . 1 . . . . 1235 ARG HN . 17782 1 291 . 1 1 115 115 ARG CA C 13 53.604 0.222 . 1 . . . . 1235 ARG CA . 17782 1 292 . 1 1 115 115 ARG CB C 13 26.900 0.059 . 1 . . . . 1235 ARG CB . 17782 1 293 . 1 1 115 115 ARG N N 15 122.473 0.03 . 1 . . . . 1235 ARG N . 17782 1 294 . 1 1 116 116 ILE H H 1 9.235 0.02 . 1 . . . . 1236 ILE HN . 17782 1 295 . 1 1 116 116 ILE CA C 13 55.847 0.029 . 1 . . . . 1236 ILE CA . 17782 1 296 . 1 1 116 116 ILE CB C 13 39.258 0.066 . 1 . . . . 1236 ILE CB . 17782 1 297 . 1 1 116 116 ILE N N 15 120.613 0.03 . 1 . . . . 1236 ILE N . 17782 1 298 . 1 1 117 117 GLN H H 1 8.773 0.02 . 1 . . . . 1237 GLN HN . 17782 1 299 . 1 1 117 117 GLN CA C 13 50.860 0.089 . 1 . . . . 1237 GLN CA . 17782 1 300 . 1 1 117 117 GLN CB C 13 28.862 0.061 . 1 . . . . 1237 GLN CB . 17782 1 301 . 1 1 117 117 GLN N N 15 120.067 0.03 . 1 . . . . 1237 GLN N . 17782 1 302 . 1 1 118 118 ALA H H 1 9.079 0.02 . 1 . . . . 1238 ALA HN . 17782 1 303 . 1 1 118 118 ALA CA C 13 47.575 0.069 . 1 . . . . 1238 ALA CA . 17782 1 304 . 1 1 118 118 ALA CB C 13 17.786 0.030 . 1 . . . . 1238 ALA CB . 17782 1 305 . 1 1 118 118 ALA N N 15 128.159 0.03 . 1 . . . . 1238 ALA N . 17782 1 306 . 1 1 119 119 THR H H 1 7.865 0.02 . 1 . . . . 1239 THR HN . 17782 1 307 . 1 1 119 119 THR CA C 13 58.208 0.134 . 1 . . . . 1239 THR CA . 17782 1 308 . 1 1 119 119 THR CB C 13 67.931 0.05 . 1 . . . . 1239 THR CB . 17782 1 309 . 1 1 119 119 THR N N 15 115.911 0.03 . 1 . . . . 1239 THR N . 17782 1 310 . 1 1 120 120 PHE H H 1 8.893 0.02 . 1 . . . . 1240 PHE HN . 17782 1 311 . 1 1 120 120 PHE CA C 13 54.452 0.05 . 1 . . . . 1240 PHE CA . 17782 1 312 . 1 1 120 120 PHE CB C 13 39.851 0.184 . 1 . . . . 1240 PHE CB . 17782 1 313 . 1 1 120 120 PHE N N 15 123.785 0.03 . 1 . . . . 1240 PHE N . 17782 1 314 . 1 1 121 121 THR H H 1 9.548 0.02 . 1 . . . . 1241 THR HN . 17782 1 315 . 1 1 121 121 THR CA C 13 60.746 0.05 . 1 . . . . 1241 THR CA . 17782 1 316 . 1 1 121 121 THR CB C 13 65.734 0.05 . 1 . . . . 1241 THR CB . 17782 1 317 . 1 1 121 121 THR N N 15 121.160 0.03 . 1 . . . . 1241 THR N . 17782 1 318 . 1 1 123 123 GLY H H 1 8.199 0.02 . 1 . . . . 1243 GLY HN . 17782 1 319 . 1 1 123 123 GLY CA C 13 42.989 0.019 . 1 . . . . 1243 GLY CA . 17782 1 320 . 1 1 123 123 GLY N N 15 107.599 0.03 . 1 . . . . 1243 GLY N . 17782 1 321 . 1 1 124 124 ARG H H 1 8.410 0.02 . 1 . . . . 1244 ARG HN . 17782 1 322 . 1 1 124 124 ARG CA C 13 55.491 0.030 . 1 . . . . 1244 ARG CA . 17782 1 323 . 1 1 124 124 ARG CB C 13 27.971 0.120 . 1 . . . . 1244 ARG CB . 17782 1 324 . 1 1 124 124 ARG N N 15 121.707 0.03 . 1 . . . . 1244 ARG N . 17782 1 325 . 1 1 125 125 GLN H H 1 8.751 0.02 . 1 . . . . 1245 GLN HN . 17782 1 326 . 1 1 125 125 GLN CA C 13 52.255 0.05 . 1 . . . . 1245 GLN CA . 17782 1 327 . 1 1 125 125 GLN CB C 13 30.230 0.005 . 1 . . . . 1245 GLN CB . 17782 1 328 . 1 1 125 125 GLN N N 15 120.941 0.03 . 1 . . . . 1245 GLN N . 17782 1 329 . 1 1 126 126 ILE H H 1 8.807 0.02 . 1 . . . . 1246 ILE HN . 17782 1 330 . 1 1 126 126 ILE CA C 13 55.640 0.05 . 1 . . . . 1246 ILE CA . 17782 1 331 . 1 1 126 126 ILE CB C 13 39.376 0.125 . 1 . . . . 1246 ILE CB . 17782 1 332 . 1 1 126 126 ILE N N 15 114.926 0.03 . 1 . . . . 1246 ILE N . 17782 1 333 . 1 1 127 127 THR H H 1 9.090 0.02 . 1 . . . . 1247 THR HN . 17782 1 334 . 1 1 127 127 THR CA C 13 56.590 0.05 . 1 . . . . 1247 THR CA . 17782 1 335 . 1 1 127 127 THR CB C 13 69.228 0.229 . 1 . . . . 1247 THR CB . 17782 1 336 . 1 1 127 127 THR N N 15 110.552 0.03 . 1 . . . . 1247 THR N . 17782 1 337 . 1 1 128 128 GLY H H 1 8.743 0.02 . 1 . . . . 1248 GLY HN . 17782 1 338 . 1 1 128 128 GLY CA C 13 43.506 0.216 . 1 . . . . 1248 GLY CA . 17782 1 339 . 1 1 128 128 GLY N N 15 104.865 0.03 . 1 . . . . 1248 GLY N . 17782 1 340 . 1 1 129 129 ILE H H 1 9.658 0.02 . 1 . . . . 1249 ILE HN . 17782 1 341 . 1 1 129 129 ILE CA C 13 56.872 0.281 . 1 . . . . 1249 ILE CA . 17782 1 342 . 1 1 129 129 ILE CB C 13 35.392 0.05 . 1 . . . . 1249 ILE CB . 17782 1 343 . 1 1 129 129 ILE N N 15 122.035 0.03 . 1 . . . . 1249 ILE N . 17782 1 344 . 1 1 130 130 LEU H H 1 8.506 0.02 . 1 . . . . 1250 LEU HN . 17782 1 345 . 1 1 130 130 LEU CA C 13 54.067 0.030 . 1 . . . . 1250 LEU CA . 17782 1 346 . 1 1 130 130 LEU CB C 13 37.773 0.184 . 1 . . . . 1250 LEU CB . 17782 1 347 . 1 1 130 130 LEU N N 15 129.581 0.03 . 1 . . . . 1250 LEU N . 17782 1 348 . 1 1 131 131 LYS H H 1 9.126 0.02 . 1 . . . . 1251 LYS HN . 17782 1 349 . 1 1 131 131 LYS CA C 13 50.800 0.029 . 1 . . . . 1251 LYS CA . 17782 1 350 . 1 1 131 131 LYS CB C 13 29.753 0.061 . 1 . . . . 1251 LYS CB . 17782 1 351 . 1 1 131 131 LYS N N 15 126.300 0.03 . 1 . . . . 1251 LYS N . 17782 1 352 . 1 1 132 132 GLY H H 1 7.793 0.02 . 1 . . . . 1252 GLY HN . 17782 1 353 . 1 1 132 132 GLY CA C 13 43.030 0.097 . 1 . . . . 1252 GLY CA . 17782 1 354 . 1 1 132 132 GLY N N 15 106.177 0.03 . 1 . . . . 1252 GLY N . 17782 1 355 . 1 1 133 133 PHE H H 1 7.530 0.02 . 1 . . . . 1253 PHE HN . 17782 1 356 . 1 1 133 133 PHE CA C 13 53.235 0.030 . 1 . . . . 1253 PHE CA . 17782 1 357 . 1 1 133 133 PHE CB C 13 38.159 0.154 . 1 . . . . 1253 PHE CB . 17782 1 358 . 1 1 133 133 PHE N N 15 114.817 0.03 . 1 . . . . 1253 PHE N . 17782 1 359 . 1 1 134 134 ASP H H 1 8.222 0.02 . 1 . . . . 1254 ASP HN . 17782 1 360 . 1 1 134 134 ASP CA C 13 48.901 0.030 . 1 . . . . 1254 ASP CA . 17782 1 361 . 1 1 134 134 ASP CB C 13 40.202 0.060 . 1 . . . . 1254 ASP CB . 17782 1 362 . 1 1 134 134 ASP N N 15 118.645 0.03 . 1 . . . . 1254 ASP N . 17782 1 363 . 1 1 135 135 GLN H H 1 8.300 0.02 . 1 . . . . 1255 GLN HN . 17782 1 364 . 1 1 135 135 GLN CA C 13 54.125 0.029 . 1 . . . . 1255 GLN CA . 17782 1 365 . 1 1 135 135 GLN CB C 13 24.911 0.148 . 1 . . . . 1255 GLN CB . 17782 1 366 . 1 1 135 135 GLN N N 15 114.598 0.03 . 1 . . . . 1255 GLN N . 17782 1 367 . 1 1 136 136 LEU H H 1 8.081 0.02 . 1 . . . . 1256 LEU HN . 17782 1 368 . 1 1 136 136 LEU CA C 13 51.288 0.101 . 1 . . . . 1256 LEU CA . 17782 1 369 . 1 1 136 136 LEU CB C 13 37.411 0.059 . 1 . . . . 1256 LEU CB . 17782 1 370 . 1 1 136 136 LEU N N 15 121.816 0.03 . 1 . . . . 1256 LEU N . 17782 1 371 . 1 1 137 137 MET H H 1 7.964 0.02 . 1 . . . . 1257 MET HN . 17782 1 372 . 1 1 137 137 MET CA C 13 54.423 0.029 . 1 . . . . 1257 MET CA . 17782 1 373 . 1 1 137 137 MET CB C 13 26.931 0.208 . 1 . . . . 1257 MET CB . 17782 1 374 . 1 1 137 137 MET N N 15 112.302 0.03 . 1 . . . . 1257 MET N . 17782 1 375 . 1 1 138 138 ASN H H 1 7.976 0.02 . 1 . . . . 1258 ASN HN . 17782 1 376 . 1 1 138 138 ASN CA C 13 50.812 0.101 . 1 . . . . 1258 ASN CA . 17782 1 377 . 1 1 138 138 ASN CB C 13 34.891 0.153 . 1 . . . . 1258 ASN CB . 17782 1 378 . 1 1 138 138 ASN N N 15 111.208 0.03 . 1 . . . . 1258 ASN N . 17782 1 379 . 1 1 139 139 LEU H H 1 8.700 0.02 . 1 . . . . 1259 LEU HN . 17782 1 380 . 1 1 139 139 LEU CA C 13 50.099 0.101 . 1 . . . . 1259 LEU CA . 17782 1 381 . 1 1 139 139 LEU CB C 13 43.030 0.038 . 1 . . . . 1259 LEU CB . 17782 1 382 . 1 1 139 139 LEU N N 15 117.879 0.03 . 1 . . . . 1259 LEU N . 17782 1 383 . 1 1 140 140 VAL H H 1 8.395 0.02 . 1 . . . . 1260 VAL HN . 17782 1 384 . 1 1 140 140 VAL CA C 13 59.381 0.05 . 1 . . . . 1260 VAL CA . 17782 1 385 . 1 1 140 140 VAL CB C 13 30.020 0.091 . 1 . . . . 1260 VAL CB . 17782 1 386 . 1 1 140 140 VAL N N 15 120.941 0.03 . 1 . . . . 1260 VAL N . 17782 1 387 . 1 1 141 141 LEU H H 1 9.044 0.02 . 1 . . . . 1261 LEU HN . 17782 1 388 . 1 1 141 141 LEU CA C 13 49.475 0.129 . 1 . . . . 1261 LEU CA . 17782 1 389 . 1 1 141 141 LEU CB C 13 43.200 0.030 . 1 . . . . 1261 LEU CB . 17782 1 390 . 1 1 141 141 LEU N N 15 127.503 0.03 . 1 . . . . 1261 LEU N . 17782 1 391 . 1 1 142 142 ASP H H 1 9.282 0.02 . 1 . . . . 1262 ASP HN . 17782 1 392 . 1 1 142 142 ASP CA C 13 47.653 0.148 . 1 . . . . 1262 ASP CA . 17782 1 393 . 1 1 142 142 ASP CB C 13 41.990 0.127 . 1 . . . . 1262 ASP CB . 17782 1 394 . 1 1 142 142 ASP N N 15 119.629 0.03 . 1 . . . . 1262 ASP N . 17782 1 395 . 1 1 143 143 ASP H H 1 8.823 0.02 . 1 . . . . 1263 ASP HN . 17782 1 396 . 1 1 143 143 ASP CA C 13 52.077 0.119 . 1 . . . . 1263 ASP CA . 17782 1 397 . 1 1 143 143 ASP CB C 13 37.446 0.035 . 1 . . . . 1263 ASP CB . 17782 1 398 . 1 1 143 143 ASP N N 15 122.363 0.03 . 1 . . . . 1263 ASP N . 17782 1 399 . 1 1 144 144 VAL H H 1 9.102 0.02 . 1 . . . . 1264 VAL HN . 17782 1 400 . 1 1 144 144 VAL CA C 13 60.063 0.089 . 1 . . . . 1264 VAL CA . 17782 1 401 . 1 1 144 144 VAL CB C 13 27.882 0.149 . 1 . . . . 1264 VAL CB . 17782 1 402 . 1 1 144 144 VAL N N 15 118.317 0.03 . 1 . . . . 1264 VAL N . 17782 1 403 . 1 1 145 145 GLU H H 1 8.920 0.02 . 1 . . . . 1265 GLU HN . 17782 1 404 . 1 1 145 145 GLU CA C 13 51.519 0.036 . 1 . . . . 1265 GLU CA . 17782 1 405 . 1 1 145 145 GLU CB C 13 29.320 0.348 . 1 . . . . 1265 GLU CB . 17782 1 406 . 1 1 145 145 GLU N N 15 128.378 0.03 . 1 . . . . 1265 GLU N . 17782 1 407 . 1 1 146 146 GLU H H 1 9.333 0.02 . 1 . . . . 1266 GLU HN . 17782 1 408 . 1 1 146 146 GLU CA C 13 51.213 0.071 . 1 . . . . 1266 GLU CA . 17782 1 409 . 1 1 146 146 GLU CB C 13 28.906 0.066 . 1 . . . . 1266 GLU CB . 17782 1 410 . 1 1 146 146 GLU N N 15 125.019 0.03 . 1 . . . . 1266 GLU N . 17782 1 411 . 1 1 147 147 GLN H H 1 8.271 0.02 . 1 . . . . 1267 GLN HN . 17782 1 412 . 1 1 147 147 GLN CA C 13 52.879 0.101 . 1 . . . . 1267 GLN CA . 17782 1 413 . 1 1 147 147 GLN CB C 13 25.319 0.023 . 1 . . . . 1267 GLN CB . 17782 1 414 . 1 1 147 147 GLN N N 15 126.738 0.03 . 1 . . . . 1267 GLN N . 17782 1 415 . 1 1 148 148 LEU H H 1 7.880 0.003 . 1 . . . . 1268 LEU HN . 17782 1 416 . 1 1 148 148 LEU CA C 13 52.771 0.017 . 1 . . . . 1268 LEU CA . 17782 1 417 . 1 1 148 148 LEU CB C 13 38.559 0.009 . 1 . . . . 1268 LEU CB . 17782 1 418 . 1 1 148 148 LEU N N 15 125.457 0.03 . 1 . . . . 1268 LEU N . 17782 1 419 . 1 1 149 149 ARG H H 1 8.654 0.02 . 1 . . . . 1269 ARG HN . 17782 1 420 . 1 1 149 149 ARG CA C 13 51.496 0.005 . 1 . . . . 1269 ARG CA . 17782 1 421 . 1 1 149 149 ARG CB C 13 29.676 0.138 . 1 . . . . 1269 ARG CB . 17782 1 422 . 1 1 149 149 ARG N N 15 120.504 0.03 . 1 . . . . 1269 ARG N . 17782 1 423 . 1 1 150 150 ASN H H 1 8.985 0.02 . 1 . . . . 1270 ASN HN . 17782 1 424 . 1 1 150 150 ASN CA C 13 47.580 0.05 . 1 . . . . 1270 ASN CA . 17782 1 425 . 1 1 150 150 ASN CB C 13 35.927 0.05 . 1 . . . . 1270 ASN CB . 17782 1 426 . 1 1 150 150 ASN N N 15 124.769 0.03 . 1 . . . . 1270 ASN N . 17782 1 427 . 1 1 151 151 PRO CA C 13 61.257 0.05 . 1 . . . . 1271 PRO CA . 17782 1 428 . 1 1 151 151 PRO CB C 13 29.219 0.05 . 1 . . . . 1271 PRO CB . 17782 1 429 . 1 1 152 152 GLU H H 1 8.195 0.02 . 1 . . . . 1272 GLU HN . 17782 1 430 . 1 1 152 152 GLU CA C 13 55.608 0.030 . 1 . . . . 1272 GLU CA . 17782 1 431 . 1 1 152 152 GLU CB C 13 26.836 0.066 . 1 . . . . 1272 GLU CB . 17782 1 432 . 1 1 152 152 GLU N N 15 116.457 0.03 . 1 . . . . 1272 GLU N . 17782 1 433 . 1 1 153 153 ASP H H 1 7.177 0.02 . 1 . . . . 1273 ASP HN . 17782 1 434 . 1 1 153 153 ASP CA C 13 50.136 0.05 . 1 . . . . 1273 ASP CA . 17782 1 435 . 1 1 153 153 ASP CB C 13 39.139 0.006 . 1 . . . . 1273 ASP CB . 17782 1 436 . 1 1 153 153 ASP N N 15 114.051 0.03 . 1 . . . . 1273 ASP N . 17782 1 437 . 1 1 154 154 GLY H H 1 8.512 0.02 . 1 . . . . 1274 GLY HN . 17782 1 438 . 1 1 154 154 GLY CA C 13 43.085 0.071 . 1 . . . . 1274 GLY CA . 17782 1 439 . 1 1 154 154 GLY N N 15 110.552 0.03 . 1 . . . . 1274 GLY N . 17782 1 440 . 1 1 155 155 LYS H H 1 8.385 0.02 . 1 . . . . 1275 LYS HN . 17782 1 441 . 1 1 155 155 LYS CA C 13 53.328 0.140 . 1 . . . . 1275 LYS CA . 17782 1 442 . 1 1 155 155 LYS CB C 13 29.561 0.034 . 1 . . . . 1275 LYS CB . 17782 1 443 . 1 1 155 155 LYS N N 15 121.738 0.03 . 1 . . . . 1275 LYS N . 17782 1 444 . 1 1 156 156 LEU H H 1 8.579 0.02 . 1 . . . . 1276 LEU HN . 17782 1 445 . 1 1 156 156 LEU CA C 13 52.738 0.05 . 1 . . . . 1276 LEU CA . 17782 1 446 . 1 1 156 156 LEU CB C 13 38.072 0.046 . 1 . . . . 1276 LEU CB . 17782 1 447 . 1 1 156 156 LEU N N 15 123.019 0.03 . 1 . . . . 1276 LEU N . 17782 1 448 . 1 1 157 157 THR H H 1 8.173 0.02 . 1 . . . . 1277 THR HN . 17782 1 449 . 1 1 157 157 THR CA C 13 58.891 0.05 . 1 . . . . 1277 THR CA . 17782 1 450 . 1 1 157 157 THR CB C 13 67.164 0.05 . 1 . . . . 1277 THR CB . 17782 1 451 . 1 1 157 157 THR N N 15 112.411 0.03 . 1 . . . . 1277 THR N . 17782 1 452 . 1 1 158 158 GLY CA C 13 41.864 0.05 . 1 . . . . 1278 GLY CA . 17782 1 453 . 1 1 159 159 ALA H H 1 7.909 0.02 . 1 . . . . 1279 ALA HN . 17782 1 454 . 1 1 159 159 ALA CA C 13 48.703 0.070 . 1 . . . . 1279 ALA CA . 17782 1 455 . 1 1 159 159 ALA CB C 13 17.341 0.059 . 1 . . . . 1279 ALA CB . 17782 1 456 . 1 1 159 159 ALA N N 15 124.113 0.03 . 1 . . . . 1279 ALA N . 17782 1 457 . 1 1 160 160 ILE H H 1 8.423 0.02 . 1 . . . . 1280 ILE HN . 17782 1 458 . 1 1 160 160 ILE CA C 13 55.704 0.005 . 1 . . . . 1280 ILE CA . 17782 1 459 . 1 1 160 160 ILE CB C 13 39.964 0.05 . 1 . . . . 1280 ILE CB . 17782 1 460 . 1 1 160 160 ILE N N 15 116.676 0.03 . 1 . . . . 1280 ILE N . 17782 1 461 . 1 1 161 161 ARG H H 1 8.627 0.02 . 1 . . . . 1281 ARG HN . 17782 1 462 . 1 1 161 161 ARG CA C 13 51.364 0.059 . 1 . . . . 1281 ARG CA . 17782 1 463 . 1 1 161 161 ARG CB C 13 30.020 0.091 . 1 . . . . 1281 ARG CB . 17782 1 464 . 1 1 161 161 ARG N N 15 117.801 0.03 . 1 . . . . 1281 ARG N . 17782 1 465 . 1 1 162 162 LYS H H 1 8.966 0.02 . 1 . . . . 1282 LYS HN . 17782 1 466 . 1 1 162 162 LYS CA C 13 53.396 0.072 . 1 . . . . 1282 LYS CA . 17782 1 467 . 1 1 162 162 LYS CB C 13 29.008 0.030 . 1 . . . . 1282 LYS CB . 17782 1 468 . 1 1 162 162 LYS N N 15 125.425 0.03 . 1 . . . . 1282 LYS N . 17782 1 469 . 1 1 163 163 LEU H H 1 8.378 0.02 . 1 . . . . 1283 LEU HN . 17782 1 470 . 1 1 163 163 LEU CA C 13 51.851 0.191 . 1 . . . . 1283 LEU CA . 17782 1 471 . 1 1 163 163 LEU CB C 13 40.557 0.059 . 1 . . . . 1283 LEU CB . 17782 1 472 . 1 1 163 163 LEU N N 15 123.566 0.03 . 1 . . . . 1283 LEU N . 17782 1 473 . 1 1 164 164 GLY H H 1 7.626 0.02 . 1 . . . . 1284 GLY HN . 17782 1 474 . 1 1 164 164 GLY CA C 13 43.891 0.247 . 1 . . . . 1284 GLY CA . 17782 1 475 . 1 1 164 164 GLY N N 15 106.833 0.03 . 1 . . . . 1284 GLY N . 17782 1 476 . 1 1 165 165 LEU H H 1 7.712 0.02 . 1 . . . . 1285 LEU HN . 17782 1 477 . 1 1 165 165 LEU CA C 13 52.090 0.071 . 1 . . . . 1285 LEU CA . 17782 1 478 . 1 1 165 165 LEU CB C 13 38.836 0.05 . 1 . . . . 1285 LEU CB . 17782 1 479 . 1 1 165 165 LEU N N 15 129.472 0.03 . 1 . . . . 1285 LEU N . 17782 1 480 . 1 1 166 166 VAL H H 1 9.184 0.02 . 1 . . . . 1286 VAL HN . 17782 1 481 . 1 1 166 166 VAL CA C 13 56.264 0.029 . 1 . . . . 1286 VAL CA . 17782 1 482 . 1 1 166 166 VAL CB C 13 33.198 0.003 . 1 . . . . 1286 VAL CB . 17782 1 483 . 1 1 166 166 VAL N N 15 122.035 0.03 . 1 . . . . 1286 VAL N . 17782 1 484 . 1 1 167 167 VAL H H 1 8.947 0.02 . 1 . . . . 1287 VAL HN . 17782 1 485 . 1 1 167 167 VAL CA C 13 58.312 0.05 . 1 . . . . 1287 VAL CA . 17782 1 486 . 1 1 167 167 VAL CB C 13 29.264 0.047 . 1 . . . . 1287 VAL CB . 17782 1 487 . 1 1 167 167 VAL N N 15 122.035 0.03 . 1 . . . . 1287 VAL N . 17782 1 488 . 1 1 168 168 VAL H H 1 9.341 0.02 . 1 . . . . 1288 VAL HN . 17782 1 489 . 1 1 168 168 VAL CA C 13 57.889 0.007 . 1 . . . . 1288 VAL CA . 17782 1 490 . 1 1 168 168 VAL CB C 13 30.849 0.030 . 1 . . . . 1288 VAL CB . 17782 1 491 . 1 1 168 168 VAL N N 15 129.691 0.03 . 1 . . . . 1288 VAL N . 17782 1 492 . 1 1 169 169 ARG H H 1 7.895 0.02 . 1 . . . . 1289 ARG HN . 17782 1 493 . 1 1 169 169 ARG CA C 13 50.413 0.204 . 1 . . . . 1289 ARG CA . 17782 1 494 . 1 1 169 169 ARG CB C 13 26.252 0.123 . 1 . . . . 1289 ARG CB . 17782 1 495 . 1 1 169 169 ARG N N 15 125.457 0.03 . 1 . . . . 1289 ARG N . 17782 1 496 . 1 1 170 170 GLY H H 1 8.949 0.02 . 1 . . . . 1290 GLY HN . 17782 1 497 . 1 1 170 170 GLY CA C 13 44.068 0.007 . 1 . . . . 1290 GLY CA . 17782 1 498 . 1 1 170 170 GLY N N 15 112.192 0.03 . 1 . . . . 1290 GLY N . 17782 1 499 . 1 1 171 171 THR H H 1 7.131 0.02 . 1 . . . . 1291 THR HN . 17782 1 500 . 1 1 171 171 THR CA C 13 60.509 0.059 . 1 . . . . 1291 THR CA . 17782 1 501 . 1 1 171 171 THR CB C 13 65.902 0.167 . 1 . . . . 1291 THR CB . 17782 1 502 . 1 1 171 171 THR N N 15 106.615 0.03 . 1 . . . . 1291 THR N . 17782 1 503 . 1 1 172 172 THR H H 1 7.347 0.02 . 1 . . . . 1292 THR HN . 17782 1 504 . 1 1 172 172 THR CA C 13 58.104 0.089 . 1 . . . . 1292 THR CA . 17782 1 505 . 1 1 172 172 THR CB C 13 66.644 0.019 . 1 . . . . 1292 THR CB . 17782 1 506 . 1 1 172 172 THR N N 15 108.255 0.03 . 1 . . . . 1292 THR N . 17782 1 507 . 1 1 173 173 LEU H H 1 7.245 0.02 . 1 . . . . 1293 LEU HN . 17782 1 508 . 1 1 173 173 LEU CA C 13 52.345 0.030 . 1 . . . . 1293 LEU CA . 17782 1 509 . 1 1 173 173 LEU CB C 13 40.171 0.030 . 1 . . . . 1293 LEU CB . 17782 1 510 . 1 1 173 173 LEU N N 15 126.082 0.03 . 1 . . . . 1293 LEU N . 17782 1 511 . 1 1 174 174 VAL H H 1 9.236 0.02 . 1 . . . . 1294 VAL HN . 17782 1 512 . 1 1 174 174 VAL CA C 13 61.162 0.059 . 1 . . . . 1294 VAL CA . 17782 1 513 . 1 1 174 174 VAL CB C 13 29.990 0.121 . 1 . . . . 1294 VAL CB . 17782 1 514 . 1 1 174 174 VAL N N 15 125.535 0.03 . 1 . . . . 1294 VAL N . 17782 1 515 . 1 1 175 175 LEU H H 1 7.337 0.02 . 1 . . . . 1295 LEU HN . 17782 1 516 . 1 1 175 175 LEU CA C 13 51.941 0.101 . 1 . . . . 1295 LEU CA . 17782 1 517 . 1 1 175 175 LEU CB C 13 42.102 0.05 . 1 . . . . 1295 LEU CB . 17782 1 518 . 1 1 175 175 LEU N N 15 118.535 0.03 . 1 . . . . 1295 LEU N . 17782 1 519 . 1 1 176 176 ILE H H 1 8.157 0.02 . 1 . . . . 1296 ILE HN . 17782 1 520 . 1 1 176 176 ILE CA C 13 56.441 0.089 . 1 . . . . 1296 ILE CA . 17782 1 521 . 1 1 176 176 ILE CB C 13 38.188 0.125 . 1 . . . . 1296 ILE CB . 17782 1 522 . 1 1 176 176 ILE N N 15 117.770 0.03 . 1 . . . . 1296 ILE N . 17782 1 523 . 1 1 177 177 ALA H H 1 8.935 0.02 . 1 . . . . 1297 ALA HN . 17782 1 524 . 1 1 177 177 ALA CA C 13 46.317 0.05 . 1 . . . . 1297 ALA CA . 17782 1 525 . 1 1 177 177 ALA CB C 13 18.350 0.05 . 1 . . . . 1297 ALA CB . 17782 1 526 . 1 1 177 177 ALA N N 15 126.300 0.03 . 1 . . . . 1297 ALA N . 17782 1 527 . 1 1 188 188 PRO CA C 13 60.839 0.05 . 1 . . . . 1308 PRO CA . 17782 1 528 . 1 1 188 188 PRO CB C 13 28.549 0.05 . 1 . . . . 1308 PRO CB . 17782 1 529 . 1 1 189 189 PHE H H 1 7.868 0.02 . 1 . . . . 1309 PHE HN . 17782 1 530 . 1 1 189 189 PHE CA C 13 54.490 0.086 . 1 . . . . 1309 PHE CA . 17782 1 531 . 1 1 189 189 PHE CB C 13 35.257 0.144 . 1 . . . . 1309 PHE CB . 17782 1 532 . 1 1 189 189 PHE N N 15 117.770 0.03 . 1 . . . . 1309 PHE N . 17782 1 533 . 1 1 190 190 VAL H H 1 6.863 0.02 . 1 . . . . 1310 VAL HN . 17782 1 534 . 1 1 190 190 VAL CA C 13 59.220 0.192 . 1 . . . . 1310 VAL CA . 17782 1 535 . 1 1 190 190 VAL CB C 13 28.977 0.029 . 1 . . . . 1310 VAL CB . 17782 1 536 . 1 1 190 190 VAL N N 15 121.598 0.03 . 1 . . . . 1310 VAL N . 17782 1 537 . 1 1 191 191 GLN H H 1 8.501 0.02 . 1 . . . . 1311 GLN HN . 17782 1 538 . 1 1 191 191 GLN CA C 13 52.235 0.05 . 1 . . . . 1311 GLN CA . 17782 1 539 . 1 1 191 191 GLN CB C 13 26.209 0.05 . 1 . . . . 1311 GLN CB . 17782 1 540 . 1 1 191 191 GLN N N 15 126.410 0.03 . 1 . . . . 1311 GLN N . 17782 1 stop_ save_