data_17364 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 17364 _Entry.Title ; The solution structure of the PTB Domain of TENC1 in complex with the peptide of DLC1 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2010-12-14 _Entry.Accession_date 2010-12-14 _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 Changdong Liu . . . 17364 2 Lihong Chen . . . 17364 3 Rui Feng . . . 17364 4 Guang Zhu . . . 17364 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID 1 'not applicable' 'not applicable' . 17364 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID DLC1 . 17364 NMR . 17364 PTB . 17364 TENC1 . 17364 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 17364 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 484 17364 '15N chemical shifts' 133 17364 '1H chemical shifts' 992 17364 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 . . 2013-04-26 2010-12-14 update BMRB 'update entry citation' 17364 1 . . 2012-06-04 2010-12-14 original author 'original release' 17364 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 17364 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 22645138 _Citation.Full_citation . _Citation.Title 'Solution structure of the phosphotyrosine binding (PTB) domain of human tensin2 protein in complex with deleted in liver cancer 1 (DLC1) peptide reveals a novel peptide binding mode.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biol. Chem.' _Citation.Journal_name_full 'The Journal of biological chemistry' _Citation.Journal_volume 287 _Citation.Journal_issue 31 _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 26104 _Citation.Page_last 26114 _Citation.Year 2012 _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 Lihong Chen . . . 17364 1 2 Changdong Liu . . . 17364 1 3 'Frankie Chi Fat' Ko . . . 17364 1 4 Naining Xu . . . 17364 1 5 'Irene Oi-Lin' Ng . . . 17364 1 6 'Judy Wai Ping' Yam . . . 17364 1 7 Guang Zhu . . . 17364 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 17364 _Assembly.ID 1 _Assembly.Name 'PTB Domain of TENC1 in complex with the peptide of DLC1' _Assembly.BMRB_code . _Assembly.Number_of_components 2 _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 'PTB domian' 1 $PTB_domian A . yes native no no . . . 17364 1 2 'DLC1 peptide' 2 $DLC1_peptide B . no native no no . . . 17364 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_PTB_domian _Entity.Sf_category entity _Entity.Sf_framecode PTB_domian _Entity.Entry_ID 17364 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name PTB_domian _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MSTAADLLRQGAACSVLYLT SVETESLTGPQAVARASSAA LSCSPRPTPAVVHFKVSAQG ITLTDNQRKLFFRRHYPVNS ITFSSTDPQDRRWTNPDGTT SKIFGFVAKKPGSPWENVCH LFAELDPDQPAGAIVTFITK VLLGQRK ; _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 147 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not reported' _Entity.Src_method man _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 15983.273 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no BMRB 10318 . "PTB domain" . . . . . 100.00 160 100.00 100.00 3.84e-103 . . . . 17364 1 2 no PDB 2DKQ . "Solution Structure Of The Ptb Domain Of Kiaa1075 Protein From Human" . . . . . 100.00 160 100.00 100.00 3.84e-103 . . . . 17364 1 3 no PDB 2LOZ . "The Novel Binding Mode Of Dlc1 And Tensin2 Ptb Domain" . . . . . 100.00 147 100.00 100.00 6.00e-103 . . . . 17364 1 4 no PDB 3HQC . "Crystal Structure Of Phosphotyrosine-binding Domain From The Human Tensin-like C1 Domain-containing Phosphatase (tenc1)" . . . . . 100.00 157 98.64 99.32 2.49e-101 . . . . 17364 1 5 no DBJ BAA83027 . "KIAA1075 protein [Homo sapiens]" . . . . . 100.00 1409 100.00 100.00 1.98e-92 . . . . 17364 1 6 no DBJ BAG09960 . "tensin-like C1 domain-containing phosphatase [synthetic construct]" . . . . . 100.00 1409 100.00 100.00 1.98e-92 . . . . 17364 1 7 no DBJ BAG54765 . "unnamed protein product [Homo sapiens]" . . . . . 76.87 781 100.00 100.00 1.03e-70 . . . . 17364 1 8 no EMBL CAB70815 . "hypothetical protein [Homo sapiens]" . . . . . 100.00 649 98.64 98.64 1.02e-93 . . . . 17364 1 9 no EMBL CAH56176 . "hypothetical protein [Homo sapiens]" . . . . . 100.00 1398 100.00 100.00 2.33e-92 . . . . 17364 1 10 no GB AAH54099 . "TENC1 protein, partial [Homo sapiens]" . . . . . 100.00 949 100.00 100.00 5.20e-94 . . . . 17364 1 11 no GB AAI10855 . "TENC1 protein, partial [Homo sapiens]" . . . . . 100.00 1291 100.00 100.00 1.21e-92 . . . . 17364 1 12 no GB AAI29829 . "TENC1 protein [Homo sapiens]" . . . . . 100.00 1285 100.00 100.00 1.31e-92 . . . . 17364 1 13 no GB AAI29830 . "TENC1 protein [Homo sapiens]" . . . . . 100.00 1285 100.00 100.00 1.22e-92 . . . . 17364 1 14 no GB AAI31504 . "TENC1 protein, partial [Homo sapiens]" . . . . . 100.00 183 100.00 100.00 1.78e-102 . . . . 17364 1 15 no REF NP_056134 . "tensin-2 isoform 1 [Homo sapiens]" . . . . . 100.00 1419 100.00 100.00 2.37e-92 . . . . 17364 1 16 no REF NP_736610 . "tensin-2 isoform 2 [Homo sapiens]" . . . . . 100.00 1409 100.00 100.00 2.04e-92 . . . . 17364 1 17 no REF NP_938072 . "tensin-2 isoform 3 [Homo sapiens]" . . . . . 100.00 1285 100.00 100.00 1.31e-92 . . . . 17364 1 18 no REF XP_001102202 . "PREDICTED: tensin-like C1 domain-containing phosphatase isoform 3 [Macaca mulatta]" . . . . . 100.00 1398 100.00 100.00 1.83e-92 . . . . 17364 1 19 no REF XP_001790253 . "PREDICTED: tensin-like C1 domain-containing phosphatase isoform X5 [Bos taurus]" . . . . . 100.00 1409 99.32 99.32 5.06e-91 . . . . 17364 1 20 no SP Q63HR2 . "RecName: Full=Tensin-2; AltName: Full=C1 domain-containing phosphatase and tensin homolog; Short=C1-TEN; AltName: Full=Tensin-l" . . . . . 100.00 1409 100.00 100.00 2.04e-92 . . . . 17364 1 21 no TPG DAA29990 . "TPA: C1 domain-containing phosphatase and tensin-like protein splice-like [Bos taurus]" . . . . . 100.00 1409 99.32 99.32 5.06e-91 . . . . 17364 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 1263 MET . 17364 1 2 1264 SER . 17364 1 3 1265 THR . 17364 1 4 1266 ALA . 17364 1 5 1267 ALA . 17364 1 6 1268 ASP . 17364 1 7 1269 LEU . 17364 1 8 1270 LEU . 17364 1 9 1271 ARG . 17364 1 10 1272 GLN . 17364 1 11 1273 GLY . 17364 1 12 1274 ALA . 17364 1 13 1275 ALA . 17364 1 14 1276 CYS . 17364 1 15 1277 SER . 17364 1 16 1278 VAL . 17364 1 17 1279 LEU . 17364 1 18 1280 TYR . 17364 1 19 1281 LEU . 17364 1 20 1282 THR . 17364 1 21 1283 SER . 17364 1 22 1284 VAL . 17364 1 23 1285 GLU . 17364 1 24 1286 THR . 17364 1 25 1287 GLU . 17364 1 26 1288 SER . 17364 1 27 1289 LEU . 17364 1 28 1290 THR . 17364 1 29 1291 GLY . 17364 1 30 1292 PRO . 17364 1 31 1293 GLN . 17364 1 32 1294 ALA . 17364 1 33 1295 VAL . 17364 1 34 1296 ALA . 17364 1 35 1297 ARG . 17364 1 36 1298 ALA . 17364 1 37 1299 SER . 17364 1 38 1300 SER . 17364 1 39 1301 ALA . 17364 1 40 1302 ALA . 17364 1 41 1303 LEU . 17364 1 42 1304 SER . 17364 1 43 1305 CYS . 17364 1 44 1306 SER . 17364 1 45 1307 PRO . 17364 1 46 1308 ARG . 17364 1 47 1309 PRO . 17364 1 48 1310 THR . 17364 1 49 1311 PRO . 17364 1 50 1312 ALA . 17364 1 51 1313 VAL . 17364 1 52 1314 VAL . 17364 1 53 1315 HIS . 17364 1 54 1316 PHE . 17364 1 55 1317 LYS . 17364 1 56 1318 VAL . 17364 1 57 1319 SER . 17364 1 58 1320 ALA . 17364 1 59 1321 GLN . 17364 1 60 1322 GLY . 17364 1 61 1323 ILE . 17364 1 62 1324 THR . 17364 1 63 1325 LEU . 17364 1 64 1326 THR . 17364 1 65 1327 ASP . 17364 1 66 1328 ASN . 17364 1 67 1329 GLN . 17364 1 68 1330 ARG . 17364 1 69 1331 LYS . 17364 1 70 1332 LEU . 17364 1 71 1333 PHE . 17364 1 72 1334 PHE . 17364 1 73 1335 ARG . 17364 1 74 1336 ARG . 17364 1 75 1337 HIS . 17364 1 76 1338 TYR . 17364 1 77 1339 PRO . 17364 1 78 1340 VAL . 17364 1 79 1341 ASN . 17364 1 80 1342 SER . 17364 1 81 1343 ILE . 17364 1 82 1344 THR . 17364 1 83 1345 PHE . 17364 1 84 1346 SER . 17364 1 85 1347 SER . 17364 1 86 1348 THR . 17364 1 87 1349 ASP . 17364 1 88 1350 PRO . 17364 1 89 1351 GLN . 17364 1 90 1352 ASP . 17364 1 91 1353 ARG . 17364 1 92 1354 ARG . 17364 1 93 1355 TRP . 17364 1 94 1356 THR . 17364 1 95 1357 ASN . 17364 1 96 1358 PRO . 17364 1 97 1359 ASP . 17364 1 98 1360 GLY . 17364 1 99 1361 THR . 17364 1 100 1362 THR . 17364 1 101 1363 SER . 17364 1 102 1364 LYS . 17364 1 103 1365 ILE . 17364 1 104 1366 PHE . 17364 1 105 1367 GLY . 17364 1 106 1368 PHE . 17364 1 107 1369 VAL . 17364 1 108 1370 ALA . 17364 1 109 1371 LYS . 17364 1 110 1372 LYS . 17364 1 111 1373 PRO . 17364 1 112 1374 GLY . 17364 1 113 1375 SER . 17364 1 114 1376 PRO . 17364 1 115 1377 TRP . 17364 1 116 1378 GLU . 17364 1 117 1379 ASN . 17364 1 118 1380 VAL . 17364 1 119 1381 CYS . 17364 1 120 1382 HIS . 17364 1 121 1383 LEU . 17364 1 122 1384 PHE . 17364 1 123 1385 ALA . 17364 1 124 1386 GLU . 17364 1 125 1387 LEU . 17364 1 126 1388 ASP . 17364 1 127 1389 PRO . 17364 1 128 1390 ASP . 17364 1 129 1391 GLN . 17364 1 130 1392 PRO . 17364 1 131 1393 ALA . 17364 1 132 1394 GLY . 17364 1 133 1395 ALA . 17364 1 134 1396 ILE . 17364 1 135 1397 VAL . 17364 1 136 1398 THR . 17364 1 137 1399 PHE . 17364 1 138 1400 ILE . 17364 1 139 1401 THR . 17364 1 140 1402 LYS . 17364 1 141 1403 VAL . 17364 1 142 1404 LEU . 17364 1 143 1405 LEU . 17364 1 144 1406 GLY . 17364 1 145 1407 GLN . 17364 1 146 1408 ARG . 17364 1 147 1409 LYS . 17364 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 17364 1 . SER 2 2 17364 1 . THR 3 3 17364 1 . ALA 4 4 17364 1 . ALA 5 5 17364 1 . ASP 6 6 17364 1 . LEU 7 7 17364 1 . LEU 8 8 17364 1 . ARG 9 9 17364 1 . GLN 10 10 17364 1 . GLY 11 11 17364 1 . ALA 12 12 17364 1 . ALA 13 13 17364 1 . CYS 14 14 17364 1 . SER 15 15 17364 1 . VAL 16 16 17364 1 . LEU 17 17 17364 1 . TYR 18 18 17364 1 . LEU 19 19 17364 1 . THR 20 20 17364 1 . SER 21 21 17364 1 . VAL 22 22 17364 1 . GLU 23 23 17364 1 . THR 24 24 17364 1 . GLU 25 25 17364 1 . SER 26 26 17364 1 . LEU 27 27 17364 1 . THR 28 28 17364 1 . GLY 29 29 17364 1 . PRO 30 30 17364 1 . GLN 31 31 17364 1 . ALA 32 32 17364 1 . VAL 33 33 17364 1 . ALA 34 34 17364 1 . ARG 35 35 17364 1 . ALA 36 36 17364 1 . SER 37 37 17364 1 . SER 38 38 17364 1 . ALA 39 39 17364 1 . ALA 40 40 17364 1 . LEU 41 41 17364 1 . SER 42 42 17364 1 . CYS 43 43 17364 1 . SER 44 44 17364 1 . PRO 45 45 17364 1 . ARG 46 46 17364 1 . PRO 47 47 17364 1 . THR 48 48 17364 1 . PRO 49 49 17364 1 . ALA 50 50 17364 1 . VAL 51 51 17364 1 . VAL 52 52 17364 1 . HIS 53 53 17364 1 . PHE 54 54 17364 1 . LYS 55 55 17364 1 . VAL 56 56 17364 1 . SER 57 57 17364 1 . ALA 58 58 17364 1 . GLN 59 59 17364 1 . GLY 60 60 17364 1 . ILE 61 61 17364 1 . THR 62 62 17364 1 . LEU 63 63 17364 1 . THR 64 64 17364 1 . ASP 65 65 17364 1 . ASN 66 66 17364 1 . GLN 67 67 17364 1 . ARG 68 68 17364 1 . LYS 69 69 17364 1 . LEU 70 70 17364 1 . PHE 71 71 17364 1 . PHE 72 72 17364 1 . ARG 73 73 17364 1 . ARG 74 74 17364 1 . HIS 75 75 17364 1 . TYR 76 76 17364 1 . PRO 77 77 17364 1 . VAL 78 78 17364 1 . ASN 79 79 17364 1 . SER 80 80 17364 1 . ILE 81 81 17364 1 . THR 82 82 17364 1 . PHE 83 83 17364 1 . SER 84 84 17364 1 . SER 85 85 17364 1 . THR 86 86 17364 1 . ASP 87 87 17364 1 . PRO 88 88 17364 1 . GLN 89 89 17364 1 . ASP 90 90 17364 1 . ARG 91 91 17364 1 . ARG 92 92 17364 1 . TRP 93 93 17364 1 . THR 94 94 17364 1 . ASN 95 95 17364 1 . PRO 96 96 17364 1 . ASP 97 97 17364 1 . GLY 98 98 17364 1 . THR 99 99 17364 1 . THR 100 100 17364 1 . SER 101 101 17364 1 . LYS 102 102 17364 1 . ILE 103 103 17364 1 . PHE 104 104 17364 1 . GLY 105 105 17364 1 . PHE 106 106 17364 1 . VAL 107 107 17364 1 . ALA 108 108 17364 1 . LYS 109 109 17364 1 . LYS 110 110 17364 1 . PRO 111 111 17364 1 . GLY 112 112 17364 1 . SER 113 113 17364 1 . PRO 114 114 17364 1 . TRP 115 115 17364 1 . GLU 116 116 17364 1 . ASN 117 117 17364 1 . VAL 118 118 17364 1 . CYS 119 119 17364 1 . HIS 120 120 17364 1 . LEU 121 121 17364 1 . PHE 122 122 17364 1 . ALA 123 123 17364 1 . GLU 124 124 17364 1 . LEU 125 125 17364 1 . ASP 126 126 17364 1 . PRO 127 127 17364 1 . ASP 128 128 17364 1 . GLN 129 129 17364 1 . PRO 130 130 17364 1 . ALA 131 131 17364 1 . GLY 132 132 17364 1 . ALA 133 133 17364 1 . ILE 134 134 17364 1 . VAL 135 135 17364 1 . THR 136 136 17364 1 . PHE 137 137 17364 1 . ILE 138 138 17364 1 . THR 139 139 17364 1 . LYS 140 140 17364 1 . VAL 141 141 17364 1 . LEU 142 142 17364 1 . LEU 143 143 17364 1 . GLY 144 144 17364 1 . GLN 145 145 17364 1 . ARG 146 146 17364 1 . LYS 147 147 17364 1 stop_ save_ save_DLC1_peptide _Entity.Sf_category entity _Entity.Sf_framecode DLC1_peptide _Entity.Entry_ID 17364 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name DLC1_peptide _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID B _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; IPEDHKPGTFPKALTNGSFS P ; _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 21 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method man _Entity.Parent_entity_ID 2 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 2243.518 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-01-30 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 2LOZ . "The Novel Binding Mode Of Dlc1 And Tensin2 Ptb Domain" . . . . . 66.67 14 100.00 100.00 2.77e+00 . . . . 17364 2 2 no DBJ BAB21814 . "KIAA1723 protein [Homo sapiens]" . . . . . 100.00 1554 100.00 100.00 1.61e-04 . . . . 17364 2 3 no DBJ BAF82423 . "unnamed protein product [Homo sapiens]" . . . . . 100.00 1091 100.00 100.00 1.79e-04 . . . . 17364 2 4 no DBJ BAF84371 . "unnamed protein product [Homo sapiens]" . . . . . 100.00 1528 100.00 100.00 1.89e-04 . . . . 17364 2 5 no DBJ BAG10131 . "Rho GTPase-activating protein 7 [synthetic construct]" . . . . . 100.00 1528 100.00 100.00 1.89e-04 . . . . 17364 2 6 no DBJ BAG61122 . "unnamed protein product [Homo sapiens]" . . . . . 100.00 1017 100.00 100.00 2.86e-04 . . . . 17364 2 7 no GB AAB81637 . "HP protein [Homo sapiens]" . . . . . 100.00 1083 100.00 100.00 1.79e-04 . . . . 17364 2 8 no GB AAB87700 . "deleted in liver cancer-1 [Homo sapiens]" . . . . . 100.00 1091 100.00 100.00 1.58e-04 . . . . 17364 2 9 no GB AAH54511 . "Deleted in liver cancer 1 [Homo sapiens]" . . . . . 100.00 1528 100.00 100.00 1.89e-04 . . . . 17364 2 10 no GB AAK97501 . "deleted in liver cancer 1 [Homo sapiens]" . . . . . 100.00 1091 100.00 100.00 1.79e-04 . . . . 17364 2 11 no GB ACE86794 . "deleted in liver cancer 1 protein [synthetic construct]" . . . . . 100.00 1528 100.00 100.00 1.89e-04 . . . . 17364 2 12 no PIR G59435 . "DLC-1 (deleted in liver cancer), p122 [imported] - human" . . . . . 100.00 1091 100.00 100.00 1.58e-04 . . . . 17364 2 13 no REF NP_001157743 . "rho GTPase-activating protein 7 isoform 4 [Homo sapiens]" . . . . . 100.00 1017 100.00 100.00 2.86e-04 . . . . 17364 2 14 no REF NP_006085 . "rho GTPase-activating protein 7 isoform 2 [Homo sapiens]" . . . . . 100.00 1091 100.00 100.00 1.79e-04 . . . . 17364 2 15 no REF NP_872584 . "rho GTPase-activating protein 7 isoform 1 [Homo sapiens]" . . . . . 100.00 1528 100.00 100.00 1.93e-04 . . . . 17364 2 16 no REF XP_001092830 . "PREDICTED: rho GTPase-activating protein 7 isoform 6 [Macaca mulatta]" . . . . . 100.00 1528 100.00 100.00 1.86e-04 . . . . 17364 2 17 no REF XP_003256738 . "PREDICTED: rho GTPase-activating protein 7 isoform 1 [Nomascus leucogenys]" . . . . . 100.00 1091 100.00 100.00 2.00e-04 . . . . 17364 2 18 no SP Q96QB1 . "RecName: Full=Rho GTPase-activating protein 7; AltName: Full=Deleted in liver cancer 1 protein; Short=DLC-1; AltName: Full=HP p" . . . . . 100.00 1528 100.00 100.00 1.93e-04 . . . . 17364 2 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 . ILE . 17364 2 2 . PRO . 17364 2 3 . GLU . 17364 2 4 . ASP . 17364 2 5 . HIS . 17364 2 6 . LYS . 17364 2 7 . PRO . 17364 2 8 . GLY . 17364 2 9 . THR . 17364 2 10 . PHE . 17364 2 11 . PRO . 17364 2 12 . LYS . 17364 2 13 . ALA . 17364 2 14 . LEU . 17364 2 15 . THR . 17364 2 16 . ASN . 17364 2 17 . GLY . 17364 2 18 . SER . 17364 2 19 . PHE . 17364 2 20 . SER . 17364 2 21 . PRO . 17364 2 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 . ILE 1 1 17364 2 . PRO 2 2 17364 2 . GLU 3 3 17364 2 . ASP 4 4 17364 2 . HIS 5 5 17364 2 . LYS 6 6 17364 2 . PRO 7 7 17364 2 . GLY 8 8 17364 2 . THR 9 9 17364 2 . PHE 10 10 17364 2 . PRO 11 11 17364 2 . LYS 12 12 17364 2 . ALA 13 13 17364 2 . LEU 14 14 17364 2 . THR 15 15 17364 2 . ASN 16 16 17364 2 . GLY 17 17 17364 2 . SER 18 18 17364 2 . PHE 19 19 17364 2 . SER 20 20 17364 2 . PRO 21 21 17364 2 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 17364 _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 $PTB_domian . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 17364 1 2 2 $DLC1_peptide . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 17364 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 17364 _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 $PTB_domian . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . . . . . . . . . . . PET . . . . . . 17364 1 2 2 $DLC1_peptide . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . . . . . . . . . . . PET . . . . . . 17364 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 17364 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'PTB domian' '[U-100% 13C; U-100% 15N]' . . 1 $PTB_domian . . 0.6-0.8 . . mM . . . . 17364 1 2 'potassium phosphate' 'natural abundance' . . . . . . 100 . . mM . . . . 17364 1 3 'sodium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 17364 1 4 EDTA 'natural abundance' . . . . . . 1 . . mM . . . . 17364 1 5 'DLC1 peptide' 'natural abundance' . . 2 $DLC1_peptide . . 1.2-1.4 . . mM . . . . 17364 1 6 H2O 'natural abundance' . . . . . . 90 . . mM . . . . 17364 1 7 D2O 'natural abundance' . . . . . . 10 . . mM . . . . 17364 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 17364 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% 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 'PTB domian' '[U-100% 13C; U-100% 15N]' . . 1 $PTB_domian . . 0.6-0.8 . . mM . . . . 17364 2 2 'DLC1 peptide' 'natural abundance' . . 2 $DLC1_peptide . . 1.2-1.4 . . mM . . . . 17364 2 3 'potassium phosphate' 'natural abundance' . . . . . . 100 . . mM . . . . 17364 2 4 'sodium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 17364 2 5 EDTA 'natural abundance' . . . . . . 1 . . mM . . . . 17364 2 6 D2O 'natural abundance' . . . . . . 100 . . mM . . . . 17364 2 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 17364 _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' 0.2 . M 17364 1 pH 7.0 . pH 17364 1 pressure 1 . atm 17364 1 temperature 298 . K 17364 1 stop_ save_ ############################ # Computer software used # ############################ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 17364 _Software.ID 1 _Software.Name NMRPipe _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 17364 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 17364 1 processing 17364 1 stop_ save_ save_SPARKY _Software.Sf_category software _Software.Sf_framecode SPARKY _Software.Entry_ID 17364 _Software.ID 2 _Software.Name SPARKY _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . 17364 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 17364 2 'data analysis' 17364 2 'peak picking' 17364 2 stop_ save_ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 17364 _Software.ID 3 _Software.Name CYANA _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . 17364 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 17364 3 stop_ save_ save_CNS _Software.Sf_category software _Software.Sf_framecode CNS _Software.Entry_ID 17364 _Software.ID 4 _Software.Name CNS _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Brunger, Adams, Clore, Gros, Nilges and Read' . . 17364 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 17364 4 stop_ save_ save_HADDOCK _Software.Sf_category software _Software.Sf_framecode HADDOCK _Software.Entry_ID 17364 _Software.ID 5 _Software.Name HADDOCK _Software.Version 1.3 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Alexandre Bonvin' ; Bijvoet Center for Biomolecular Research Padualaan 8, 3584 CH Utrecht, the Netherlands ; . 17364 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 17364 5 stop_ save_ save_ProcheckNMR _Software.Sf_category software _Software.Sf_framecode ProcheckNMR _Software.Entry_ID 17364 _Software.ID 6 _Software.Name ProcheckNMR _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Laskowski and MacArthur' . . 17364 6 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'geometry optimization' 17364 6 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 17364 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 500 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 17364 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 750 save_ save_spectrometer_3 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_3 _NMR_spectrometer.Entry_ID 17364 _NMR_spectrometer.ID 3 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _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 17364 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Varian INOVA . 500 . . . 17364 1 2 spectrometer_2 Varian INOVA . 750 . . . 17364 1 3 spectrometer_3 Varian INOVA . 800 . . . 17364 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 17364 _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 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17364 1 2 '2D 1H-13C HSQC' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17364 1 3 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17364 1 4 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17364 1 5 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17364 1 6 '3D H(CCO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17364 1 7 '3D C(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17364 1 8 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17364 1 9 '3D HCCH-COSY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17364 1 10 '3D HCCH-TOCSY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17364 1 11 '3D 1H-13C NOESY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17364 1 12 '3D 13C/15N filtered-13C edited NOESY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17364 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 17364 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 . indirect 0.251449530 . . . . . . . . . 17364 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 17364 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 . indirect 0.101329118 . . . . . . . . . 17364 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 17364 _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 '2D 1H-15N HSQC' . . . 17364 1 2 '2D 1H-13C HSQC' . . . 17364 1 5 '3D HNCACB' . . . 17364 1 8 '3D 1H-15N NOESY' . . . 17364 1 9 '3D HCCH-COSY' . . . 17364 1 10 '3D HCCH-TOCSY' . . . 17364 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 1 1 MET HA H 1 4.537 0.020 . 1 . . . . 1263 MET HA . 17364 1 2 . 1 1 1 1 MET HB2 H 1 2.087 0.020 . 2 . . . . 1263 MET QB . 17364 1 3 . 1 1 1 1 MET HB3 H 1 2.087 0.020 . 2 . . . . 1263 MET QB . 17364 1 4 . 1 1 1 1 MET HE1 H 1 2.058 0.020 . 1 . . . . 1263 MET HE . 17364 1 5 . 1 1 1 1 MET HE2 H 1 2.058 0.020 . 1 . . . . 1263 MET HE . 17364 1 6 . 1 1 1 1 MET HE3 H 1 2.058 0.020 . 1 . . . . 1263 MET HE . 17364 1 7 . 1 1 1 1 MET CA C 13 55.536 0.400 . 1 . . . . 1263 MET CA . 17364 1 8 . 1 1 1 1 MET CB C 13 33.020 0.400 . 1 . . . . 1263 MET CB . 17364 1 9 . 1 1 1 1 MET CE C 13 17.028 0.400 . 1 . . . . 1263 MET CE . 17364 1 10 . 1 1 2 2 SER H H 1 8.374 0.020 . 1 . . . . 1264 SER H . 17364 1 11 . 1 1 2 2 SER HA H 1 4.506 0.020 . 1 . . . . 1264 SER HA . 17364 1 12 . 1 1 2 2 SER HB2 H 1 3.895 0.020 . 2 . . . . 1264 SER QB . 17364 1 13 . 1 1 2 2 SER HB3 H 1 3.895 0.020 . 2 . . . . 1264 SER QB . 17364 1 14 . 1 1 2 2 SER CA C 13 58.974 0.400 . 1 . . . . 1264 SER CA . 17364 1 15 . 1 1 2 2 SER CB C 13 63.987 0.400 . 1 . . . . 1264 SER CB . 17364 1 16 . 1 1 2 2 SER N N 15 117.258 0.400 . 1 . . . . 1264 SER N . 17364 1 17 . 1 1 3 3 THR H H 1 8.355 0.020 . 1 . . . . 1265 THR H . 17364 1 18 . 1 1 3 3 THR HA H 1 4.391 0.020 . 1 . . . . 1265 THR HA . 17364 1 19 . 1 1 3 3 THR HB H 1 4.413 0.020 . 1 . . . . 1265 THR HB . 17364 1 20 . 1 1 3 3 THR HG21 H 1 1.246 0.020 . 1 . . . . 1265 THR QG2 . 17364 1 21 . 1 1 3 3 THR HG22 H 1 1.246 0.020 . 1 . . . . 1265 THR QG2 . 17364 1 22 . 1 1 3 3 THR HG23 H 1 1.246 0.020 . 1 . . . . 1265 THR QG2 . 17364 1 23 . 1 1 3 3 THR CA C 13 61.991 0.400 . 1 . . . . 1265 THR CA . 17364 1 24 . 1 1 3 3 THR CB C 13 70.086 0.400 . 1 . . . . 1265 THR CB . 17364 1 25 . 1 1 3 3 THR CG2 C 13 21.735 0.400 . 1 . . . . 1265 THR CG2 . 17364 1 26 . 1 1 3 3 THR N N 15 115.391 0.400 . 1 . . . . 1265 THR N . 17364 1 27 . 1 1 4 4 ALA HA H 1 4.133 0.020 . 1 . . . . 1266 ALA HA . 17364 1 28 . 1 1 4 4 ALA HB1 H 1 1.435 0.020 . 1 . . . . 1266 ALA HB . 17364 1 29 . 1 1 4 4 ALA HB2 H 1 1.435 0.020 . 1 . . . . 1266 ALA HB . 17364 1 30 . 1 1 4 4 ALA HB3 H 1 1.435 0.020 . 1 . . . . 1266 ALA HB . 17364 1 31 . 1 1 4 4 ALA CA C 13 54.264 0.400 . 1 . . . . 1266 ALA CA . 17364 1 32 . 1 1 4 4 ALA CB C 13 18.742 0.400 . 1 . . . . 1266 ALA CB . 17364 1 33 . 1 1 5 5 ALA H H 1 8.149 0.020 . 1 . . . . 1267 ALA H . 17364 1 34 . 1 1 5 5 ALA HA H 1 4.080 0.020 . 1 . . . . 1267 ALA HA . 17364 1 35 . 1 1 5 5 ALA HB1 H 1 1.413 0.020 . 1 . . . . 1267 ALA HB . 17364 1 36 . 1 1 5 5 ALA HB2 H 1 1.413 0.020 . 1 . . . . 1267 ALA HB . 17364 1 37 . 1 1 5 5 ALA HB3 H 1 1.413 0.020 . 1 . . . . 1267 ALA HB . 17364 1 38 . 1 1 5 5 ALA CA C 13 54.289 0.400 . 1 . . . . 1267 ALA CA . 17364 1 39 . 1 1 5 5 ALA CB C 13 18.584 0.400 . 1 . . . . 1267 ALA CB . 17364 1 40 . 1 1 5 5 ALA N N 15 119.941 0.400 . 1 . . . . 1267 ALA N . 17364 1 41 . 1 1 6 6 ASP H H 1 7.934 0.020 . 1 . . . . 1268 ASP H . 17364 1 42 . 1 1 6 6 ASP HA H 1 4.473 0.020 . 1 . . . . 1268 ASP HA . 17364 1 43 . 1 1 6 6 ASP HB2 H 1 2.737 0.020 . 2 . . . . 1268 ASP HB2 . 17364 1 44 . 1 1 6 6 ASP HB3 H 1 2.737 0.020 . 2 . . . . 1268 ASP HB3 . 17364 1 45 . 1 1 6 6 ASP CA C 13 56.125 0.400 . 1 . . . . 1268 ASP CA . 17364 1 46 . 1 1 6 6 ASP CB C 13 40.789 0.400 . 1 . . . . 1268 ASP CB . 17364 1 47 . 1 1 6 6 ASP N N 15 118.878 0.400 . 1 . . . . 1268 ASP N . 17364 1 48 . 1 1 7 7 LEU H H 1 8.039 0.020 . 1 . . . . 1269 LEU H . 17364 1 49 . 1 1 7 7 LEU HA H 1 4.138 0.020 . 1 . . . . 1269 LEU HA . 17364 1 50 . 1 1 7 7 LEU HB2 H 1 1.809 0.020 . 2 . . . . 1269 LEU HB2 . 17364 1 51 . 1 1 7 7 LEU HB3 H 1 1.536 0.020 . 2 . . . . 1269 LEU HB3 . 17364 1 52 . 1 1 7 7 LEU HG H 1 1.686 0.020 . 1 . . . . 1269 LEU HG . 17364 1 53 . 1 1 7 7 LEU HD11 H 1 0.877 0.020 . 2 . . . . 1269 LEU QD1 . 17364 1 54 . 1 1 7 7 LEU HD12 H 1 0.877 0.020 . 2 . . . . 1269 LEU QD1 . 17364 1 55 . 1 1 7 7 LEU HD13 H 1 0.877 0.020 . 2 . . . . 1269 LEU QD1 . 17364 1 56 . 1 1 7 7 LEU HD21 H 1 0.854 0.020 . 2 . . . . 1269 LEU QD2 . 17364 1 57 . 1 1 7 7 LEU HD22 H 1 0.854 0.020 . 2 . . . . 1269 LEU QD2 . 17364 1 58 . 1 1 7 7 LEU HD23 H 1 0.854 0.020 . 2 . . . . 1269 LEU QD2 . 17364 1 59 . 1 1 7 7 LEU CA C 13 57.213 0.400 . 1 . . . . 1269 LEU CA . 17364 1 60 . 1 1 7 7 LEU CB C 13 42.024 0.400 . 1 . . . . 1269 LEU CB . 17364 1 61 . 1 1 7 7 LEU CG C 13 26.961 0.400 . 1 . . . . 1269 LEU CG . 17364 1 62 . 1 1 7 7 LEU CD1 C 13 25.231 0.400 . 2 . . . . 1269 LEU CD1 . 17364 1 63 . 1 1 7 7 LEU CD2 C 13 23.346 0.400 . 2 . . . . 1269 LEU CD2 . 17364 1 64 . 1 1 7 7 LEU N N 15 121.026 0.400 . 1 . . . . 1269 LEU N . 17364 1 65 . 1 1 8 8 LEU H H 1 8.080 0.020 . 1 . . . . 1270 LEU H . 17364 1 66 . 1 1 8 8 LEU HA H 1 4.102 0.020 . 1 . . . . 1270 LEU HA . 17364 1 67 . 1 1 8 8 LEU HB2 H 1 1.519 0.020 . 2 . . . . 1270 LEU QB . 17364 1 68 . 1 1 8 8 LEU HB3 H 1 1.519 0.020 . 2 . . . . 1270 LEU QB . 17364 1 69 . 1 1 8 8 LEU HG H 1 1.575 0.020 . 1 . . . . 1270 LEU HG . 17364 1 70 . 1 1 8 8 LEU HD11 H 1 0.790 0.020 . 2 . . . . 1270 LEU QD1 . 17364 1 71 . 1 1 8 8 LEU HD12 H 1 0.790 0.020 . 2 . . . . 1270 LEU QD1 . 17364 1 72 . 1 1 8 8 LEU HD13 H 1 0.790 0.020 . 2 . . . . 1270 LEU QD1 . 17364 1 73 . 1 1 8 8 LEU CA C 13 56.920 0.400 . 1 . . . . 1270 LEU CA . 17364 1 74 . 1 1 8 8 LEU CB C 13 41.369 0.400 . 1 . . . . 1270 LEU CB . 17364 1 75 . 1 1 8 8 LEU CG C 13 27.088 0.400 . 1 . . . . 1270 LEU CG . 17364 1 76 . 1 1 8 8 LEU CD1 C 13 24.060 0.400 . 2 . . . . 1270 LEU CD1 . 17364 1 77 . 1 1 8 8 LEU N N 15 118.858 0.400 . 1 . . . . 1270 LEU N . 17364 1 78 . 1 1 9 9 ARG H H 1 7.685 0.020 . 1 . . . . 1271 ARG H . 17364 1 79 . 1 1 9 9 ARG HA H 1 4.118 0.020 . 1 . . . . 1271 ARG HA . 17364 1 80 . 1 1 9 9 ARG HB2 H 1 1.937 0.020 . 2 . . . . 1271 ARG QB . 17364 1 81 . 1 1 9 9 ARG HB3 H 1 1.937 0.020 . 2 . . . . 1271 ARG QB . 17364 1 82 . 1 1 9 9 ARG HG2 H 1 1.737 0.020 . 2 . . . . 1271 ARG HG2 . 17364 1 83 . 1 1 9 9 ARG HG3 H 1 1.628 0.020 . 2 . . . . 1271 ARG HG3 . 17364 1 84 . 1 1 9 9 ARG HD2 H 1 3.241 0.020 . 2 . . . . 1271 ARG HD2 . 17364 1 85 . 1 1 9 9 ARG HD3 H 1 3.235 0.020 . 2 . . . . 1271 ARG HD3 . 17364 1 86 . 1 1 9 9 ARG CA C 13 58.282 0.400 . 1 . . . . 1271 ARG CA . 17364 1 87 . 1 1 9 9 ARG CB C 13 30.335 0.400 . 1 . . . . 1271 ARG CB . 17364 1 88 . 1 1 9 9 ARG CG C 13 27.663 0.400 . 1 . . . . 1271 ARG CG . 17364 1 89 . 1 1 9 9 ARG CD C 13 43.144 0.400 . 1 . . . . 1271 ARG CD . 17364 1 90 . 1 1 9 9 ARG N N 15 118.196 0.400 . 1 . . . . 1271 ARG N . 17364 1 91 . 1 1 10 10 GLN H H 1 7.929 0.020 . 1 . . . . 1272 GLN H . 17364 1 92 . 1 1 10 10 GLN HA H 1 4.252 0.020 . 1 . . . . 1272 GLN HA . 17364 1 93 . 1 1 10 10 GLN HB2 H 1 2.215 0.020 . 2 . . . . 1272 GLN HB2 . 17364 1 94 . 1 1 10 10 GLN HB3 H 1 2.148 0.020 . 2 . . . . 1272 GLN HB3 . 17364 1 95 . 1 1 10 10 GLN HG2 H 1 2.470 0.020 . 2 . . . . 1272 GLN HG2 . 17364 1 96 . 1 1 10 10 GLN HG3 H 1 2.469 0.020 . 2 . . . . 1272 GLN HG3 . 17364 1 97 . 1 1 10 10 GLN CA C 13 57.088 0.400 . 1 . . . . 1272 GLN CA . 17364 1 98 . 1 1 10 10 GLN CB C 13 29.513 0.400 . 1 . . . . 1272 GLN CB . 17364 1 99 . 1 1 10 10 GLN CG C 13 33.969 0.400 . 1 . . . . 1272 GLN CG . 17364 1 100 . 1 1 10 10 GLN N N 15 117.086 0.400 . 1 . . . . 1272 GLN N . 17364 1 101 . 1 1 11 11 GLY H H 1 7.937 0.020 . 1 . . . . 1273 GLY H . 17364 1 102 . 1 1 11 11 GLY HA2 H 1 4.168 0.020 . 2 . . . . 1273 GLY HA2 . 17364 1 103 . 1 1 11 11 GLY HA3 H 1 3.840 0.020 . 2 . . . . 1273 GLY HA3 . 17364 1 104 . 1 1 11 11 GLY CA C 13 44.524 0.400 . 1 . . . . 1273 GLY CA . 17364 1 105 . 1 1 11 11 GLY N N 15 107.486 0.400 . 1 . . . . 1273 GLY N . 17364 1 106 . 1 1 12 12 ALA HA H 1 4.327 0.020 . 1 . . . . 1274 ALA HA . 17364 1 107 . 1 1 12 12 ALA HB1 H 1 0.695 0.020 . 1 . . . . 1274 ALA HB . 17364 1 108 . 1 1 12 12 ALA HB2 H 1 0.695 0.020 . 1 . . . . 1274 ALA HB . 17364 1 109 . 1 1 12 12 ALA HB3 H 1 0.695 0.020 . 1 . . . . 1274 ALA HB . 17364 1 110 . 1 1 12 12 ALA CA C 13 51.271 0.400 . 1 . . . . 1274 ALA CA . 17364 1 111 . 1 1 12 12 ALA CB C 13 21.526 0.400 . 1 . . . . 1274 ALA CB . 17364 1 112 . 1 1 13 13 ALA H H 1 8.383 0.020 . 1 . . . . 1275 ALA H . 17364 1 113 . 1 1 13 13 ALA HA H 1 5.687 0.020 . 1 . . . . 1275 ALA HA . 17364 1 114 . 1 1 13 13 ALA HB1 H 1 1.242 0.020 . 1 . . . . 1275 ALA HB . 17364 1 115 . 1 1 13 13 ALA HB2 H 1 1.242 0.020 . 1 . . . . 1275 ALA HB . 17364 1 116 . 1 1 13 13 ALA HB3 H 1 1.242 0.020 . 1 . . . . 1275 ALA HB . 17364 1 117 . 1 1 13 13 ALA CA C 13 50.988 0.400 . 1 . . . . 1275 ALA CA . 17364 1 118 . 1 1 13 13 ALA CB C 13 22.237 0.400 . 1 . . . . 1275 ALA CB . 17364 1 119 . 1 1 13 13 ALA N N 15 121.760 0.400 . 1 . . . . 1275 ALA N . 17364 1 120 . 1 1 14 14 CYS H H 1 8.646 0.020 . 1 . . . . 1276 CYS H . 17364 1 121 . 1 1 14 14 CYS HA H 1 4.872 0.020 . 1 . . . . 1276 CYS HA . 17364 1 122 . 1 1 14 14 CYS HB2 H 1 3.070 0.020 . 2 . . . . 1276 CYS QB . 17364 1 123 . 1 1 14 14 CYS HB3 H 1 3.070 0.020 . 2 . . . . 1276 CYS QB . 17364 1 124 . 1 1 14 14 CYS CA C 13 56.335 0.400 . 1 . . . . 1276 CYS CA . 17364 1 125 . 1 1 14 14 CYS CB C 13 30.069 0.400 . 1 . . . . 1276 CYS CB . 17364 1 126 . 1 1 14 14 CYS N N 15 114.432 0.400 . 1 . . . . 1276 CYS N . 17364 1 127 . 1 1 15 15 SER H H 1 8.778 0.020 . 1 . . . . 1277 SER H . 17364 1 128 . 1 1 15 15 SER HA H 1 5.727 0.020 . 1 . . . . 1277 SER HA . 17364 1 129 . 1 1 15 15 SER HB2 H 1 3.815 0.020 . 2 . . . . 1277 SER HB2 . 17364 1 130 . 1 1 15 15 SER HB3 H 1 3.745 0.020 . 2 . . . . 1277 SER HB3 . 17364 1 131 . 1 1 15 15 SER CA C 13 58.450 0.400 . 1 . . . . 1277 SER CA . 17364 1 132 . 1 1 15 15 SER CB C 13 64.190 0.400 . 1 . . . . 1277 SER CB . 17364 1 133 . 1 1 15 15 SER N N 15 116.292 0.400 . 1 . . . . 1277 SER N . 17364 1 134 . 1 1 16 16 VAL H H 1 8.910 0.020 . 1 . . . . 1278 VAL H . 17364 1 135 . 1 1 16 16 VAL HA H 1 4.822 0.020 . 1 . . . . 1278 VAL HA . 17364 1 136 . 1 1 16 16 VAL HB H 1 2.428 0.020 . 1 . . . . 1278 VAL HB . 17364 1 137 . 1 1 16 16 VAL HG11 H 1 0.877 0.020 . 2 . . . . 1278 VAL QG1 . 17364 1 138 . 1 1 16 16 VAL HG12 H 1 0.877 0.020 . 2 . . . . 1278 VAL QG1 . 17364 1 139 . 1 1 16 16 VAL HG13 H 1 0.877 0.020 . 2 . . . . 1278 VAL QG1 . 17364 1 140 . 1 1 16 16 VAL HG21 H 1 0.871 0.020 . 2 . . . . 1278 VAL QG2 . 17364 1 141 . 1 1 16 16 VAL HG22 H 1 0.871 0.020 . 2 . . . . 1278 VAL QG2 . 17364 1 142 . 1 1 16 16 VAL HG23 H 1 0.871 0.020 . 2 . . . . 1278 VAL QG2 . 17364 1 143 . 1 1 16 16 VAL CA C 13 59.506 0.400 . 1 . . . . 1278 VAL CA . 17364 1 144 . 1 1 16 16 VAL CB C 13 36.629 0.400 . 1 . . . . 1278 VAL CB . 17364 1 145 . 1 1 16 16 VAL CG1 C 13 22.830 0.400 . 2 . . . . 1278 VAL CG1 . 17364 1 146 . 1 1 16 16 VAL CG2 C 13 21.003 0.400 . 2 . . . . 1278 VAL CG2 . 17364 1 147 . 1 1 16 16 VAL N N 15 115.707 0.400 . 1 . . . . 1278 VAL N . 17364 1 148 . 1 1 17 17 LEU H H 1 8.625 0.020 . 1 . . . . 1279 LEU H . 17364 1 149 . 1 1 17 17 LEU HA H 1 5.008 0.020 . 1 . . . . 1279 LEU HA . 17364 1 150 . 1 1 17 17 LEU HB2 H 1 1.516 0.020 . 2 . . . . 1279 LEU HB2 . 17364 1 151 . 1 1 17 17 LEU HB3 H 1 1.222 0.020 . 2 . . . . 1279 LEU HB3 . 17364 1 152 . 1 1 17 17 LEU HG H 1 1.387 0.020 . 1 . . . . 1279 LEU HG . 17364 1 153 . 1 1 17 17 LEU HD11 H 1 0.839 0.020 . 2 . . . . 1279 LEU QD1 . 17364 1 154 . 1 1 17 17 LEU HD12 H 1 0.839 0.020 . 2 . . . . 1279 LEU QD1 . 17364 1 155 . 1 1 17 17 LEU HD13 H 1 0.839 0.020 . 2 . . . . 1279 LEU QD1 . 17364 1 156 . 1 1 17 17 LEU HD21 H 1 0.751 0.020 . 2 . . . . 1279 LEU QD2 . 17364 1 157 . 1 1 17 17 LEU HD22 H 1 0.751 0.020 . 2 . . . . 1279 LEU QD2 . 17364 1 158 . 1 1 17 17 LEU HD23 H 1 0.751 0.020 . 2 . . . . 1279 LEU QD2 . 17364 1 159 . 1 1 17 17 LEU CA C 13 53.540 0.400 . 1 . . . . 1279 LEU CA . 17364 1 160 . 1 1 17 17 LEU CB C 13 43.481 0.400 . 1 . . . . 1279 LEU CB . 17364 1 161 . 1 1 17 17 LEU CG C 13 26.546 0.400 . 1 . . . . 1279 LEU CG . 17364 1 162 . 1 1 17 17 LEU CD1 C 13 25.088 0.400 . 2 . . . . 1279 LEU CD1 . 17364 1 163 . 1 1 17 17 LEU CD2 C 13 24.640 0.400 . 2 . . . . 1279 LEU CD2 . 17364 1 164 . 1 1 17 17 LEU N N 15 119.225 0.400 . 1 . . . . 1279 LEU N . 17364 1 165 . 1 1 18 18 TYR H H 1 9.662 0.020 . 1 . . . . 1280 TYR H . 17364 1 166 . 1 1 18 18 TYR HA H 1 4.457 0.020 . 1 . . . . 1280 TYR HA . 17364 1 167 . 1 1 18 18 TYR HB2 H 1 3.069 0.020 . 2 . . . . 1280 TYR HB2 . 17364 1 168 . 1 1 18 18 TYR HB3 H 1 3.025 0.020 . 2 . . . . 1280 TYR HB3 . 17364 1 169 . 1 1 18 18 TYR HD1 H 1 6.626 0.020 . 3 . . . . 1280 TYR QD . 17364 1 170 . 1 1 18 18 TYR HD2 H 1 6.626 0.020 . 3 . . . . 1280 TYR QD . 17364 1 171 . 1 1 18 18 TYR HE1 H 1 6.486 0.020 . 3 . . . . 1280 TYR QE . 17364 1 172 . 1 1 18 18 TYR HE2 H 1 6.486 0.020 . 3 . . . . 1280 TYR QE . 17364 1 173 . 1 1 18 18 TYR CA C 13 57.870 0.400 . 1 . . . . 1280 TYR CA . 17364 1 174 . 1 1 18 18 TYR CB C 13 39.475 0.400 . 1 . . . . 1280 TYR CB . 17364 1 175 . 1 1 18 18 TYR CD2 C 13 133.008 0.400 . 3 . . . . 1280 TYR CD2 . 17364 1 176 . 1 1 18 18 TYR CE2 C 13 117.021 0.400 . 3 . . . . 1280 TYR CE2 . 17364 1 177 . 1 1 18 18 TYR N N 15 125.445 0.400 . 1 . . . . 1280 TYR N . 17364 1 178 . 1 1 19 19 LEU H H 1 7.961 0.020 . 1 . . . . 1281 LEU H . 17364 1 179 . 1 1 19 19 LEU HA H 1 3.635 0.020 . 1 . . . . 1281 LEU HA . 17364 1 180 . 1 1 19 19 LEU HB2 H 1 0.103 0.020 . 2 . . . . 1281 LEU QB . 17364 1 181 . 1 1 19 19 LEU HB3 H 1 0.103 0.020 . 2 . . . . 1281 LEU QB . 17364 1 182 . 1 1 19 19 LEU HG H 1 0.777 0.020 . 1 . . . . 1281 LEU HG . 17364 1 183 . 1 1 19 19 LEU HD11 H 1 0.025 0.020 . 2 . . . . 1281 LEU QD1 . 17364 1 184 . 1 1 19 19 LEU HD12 H 1 0.025 0.020 . 2 . . . . 1281 LEU QD1 . 17364 1 185 . 1 1 19 19 LEU HD13 H 1 0.025 0.020 . 2 . . . . 1281 LEU QD1 . 17364 1 186 . 1 1 19 19 LEU HD21 H 1 -0.924 0.020 . 2 . . . . 1281 LEU QD2 . 17364 1 187 . 1 1 19 19 LEU HD22 H 1 -0.924 0.020 . 2 . . . . 1281 LEU QD2 . 17364 1 188 . 1 1 19 19 LEU HD23 H 1 -0.924 0.020 . 2 . . . . 1281 LEU QD2 . 17364 1 189 . 1 1 19 19 LEU CA C 13 55.375 0.400 . 1 . . . . 1281 LEU CA . 17364 1 190 . 1 1 19 19 LEU CB C 13 42.865 0.400 . 1 . . . . 1281 LEU CB . 17364 1 191 . 1 1 19 19 LEU CG C 13 25.467 0.400 . 1 . . . . 1281 LEU CG . 17364 1 192 . 1 1 19 19 LEU CD1 C 13 24.664 0.400 . 2 . . . . 1281 LEU CD1 . 17364 1 193 . 1 1 19 19 LEU CD2 C 13 19.713 0.400 . 2 . . . . 1281 LEU CD2 . 17364 1 194 . 1 1 19 19 LEU N N 15 125.114 0.400 . 1 . . . . 1281 LEU N . 17364 1 195 . 1 1 20 20 THR H H 1 6.331 0.020 . 1 . . . . 1282 THR H . 17364 1 196 . 1 1 20 20 THR HA H 1 3.921 0.020 . 1 . . . . 1282 THR HA . 17364 1 197 . 1 1 20 20 THR HB H 1 4.136 0.020 . 1 . . . . 1282 THR HB . 17364 1 198 . 1 1 20 20 THR HG21 H 1 0.617 0.020 . 1 . . . . 1282 THR QG2 . 17364 1 199 . 1 1 20 20 THR HG22 H 1 0.617 0.020 . 1 . . . . 1282 THR QG2 . 17364 1 200 . 1 1 20 20 THR HG23 H 1 0.617 0.020 . 1 . . . . 1282 THR QG2 . 17364 1 201 . 1 1 20 20 THR CA C 13 60.214 0.400 . 1 . . . . 1282 THR CA . 17364 1 202 . 1 1 20 20 THR CB C 13 65.856 0.400 . 1 . . . . 1282 THR CB . 17364 1 203 . 1 1 20 20 THR CG2 C 13 18.269 0.400 . 1 . . . . 1282 THR CG2 . 17364 1 204 . 1 1 20 20 THR N N 15 106.945 0.400 . 1 . . . . 1282 THR N . 17364 1 205 . 1 1 21 21 SER H H 1 7.777 0.020 . 1 . . . . 1283 SER H . 17364 1 206 . 1 1 21 21 SER HA H 1 5.328 0.020 . 1 . . . . 1283 SER HA . 17364 1 207 . 1 1 21 21 SER HB2 H 1 3.487 0.020 . 2 . . . . 1283 SER QB . 17364 1 208 . 1 1 21 21 SER HB3 H 1 3.487 0.020 . 2 . . . . 1283 SER QB . 17364 1 209 . 1 1 21 21 SER CA C 13 57.937 0.400 . 1 . . . . 1283 SER CA . 17364 1 210 . 1 1 21 21 SER CB C 13 63.827 0.400 . 1 . . . . 1283 SER CB . 17364 1 211 . 1 1 21 21 SER N N 15 118.338 0.400 . 1 . . . . 1283 SER N . 17364 1 212 . 1 1 22 22 VAL H H 1 8.830 0.020 . 1 . . . . 1284 VAL H . 17364 1 213 . 1 1 22 22 VAL HA H 1 4.250 0.020 . 1 . . . . 1284 VAL HA . 17364 1 214 . 1 1 22 22 VAL HB H 1 1.622 0.020 . 1 . . . . 1284 VAL HB . 17364 1 215 . 1 1 22 22 VAL HG11 H 1 0.815 0.020 . 2 . . . . 1284 VAL QG1 . 17364 1 216 . 1 1 22 22 VAL HG12 H 1 0.815 0.020 . 2 . . . . 1284 VAL QG1 . 17364 1 217 . 1 1 22 22 VAL HG13 H 1 0.815 0.020 . 2 . . . . 1284 VAL QG1 . 17364 1 218 . 1 1 22 22 VAL HG21 H 1 0.845 0.020 . 2 . . . . 1284 VAL QG2 . 17364 1 219 . 1 1 22 22 VAL HG22 H 1 0.845 0.020 . 2 . . . . 1284 VAL QG2 . 17364 1 220 . 1 1 22 22 VAL HG23 H 1 0.845 0.020 . 2 . . . . 1284 VAL QG2 . 17364 1 221 . 1 1 22 22 VAL CA C 13 60.406 0.400 . 1 . . . . 1284 VAL CA . 17364 1 222 . 1 1 22 22 VAL CB C 13 36.089 0.400 . 1 . . . . 1284 VAL CB . 17364 1 223 . 1 1 22 22 VAL CG1 C 13 20.432 0.400 . 2 . . . . 1284 VAL CG1 . 17364 1 224 . 1 1 22 22 VAL CG2 C 13 20.895 0.400 . 2 . . . . 1284 VAL CG2 . 17364 1 225 . 1 1 22 22 VAL N N 15 124.635 0.400 . 1 . . . . 1284 VAL N . 17364 1 226 . 1 1 23 23 GLU H H 1 9.012 0.020 . 1 . . . . 1285 GLU H . 17364 1 227 . 1 1 23 23 GLU HA H 1 4.336 0.020 . 1 . . . . 1285 GLU HA . 17364 1 228 . 1 1 23 23 GLU HB2 H 1 2.466 0.020 . 2 . . . . 1285 GLU HB2 . 17364 1 229 . 1 1 23 23 GLU HB3 H 1 2.006 0.020 . 2 . . . . 1285 GLU HB3 . 17364 1 230 . 1 1 23 23 GLU HG2 H 1 2.452 0.020 . 2 . . . . 1285 GLU HG2 . 17364 1 231 . 1 1 23 23 GLU HG3 H 1 2.178 0.020 . 2 . . . . 1285 GLU HG3 . 17364 1 232 . 1 1 23 23 GLU CA C 13 58.100 0.400 . 1 . . . . 1285 GLU CA . 17364 1 233 . 1 1 23 23 GLU CB C 13 29.095 0.400 . 1 . . . . 1285 GLU CB . 17364 1 234 . 1 1 23 23 GLU CG C 13 37.119 0.400 . 1 . . . . 1285 GLU CG . 17364 1 235 . 1 1 23 23 GLU N N 15 128.453 0.400 . 1 . . . . 1285 GLU N . 17364 1 236 . 1 1 24 24 THR H H 1 8.329 0.020 . 1 . . . . 1286 THR H . 17364 1 237 . 1 1 24 24 THR HA H 1 4.452 0.020 . 1 . . . . 1286 THR HA . 17364 1 238 . 1 1 24 24 THR HB H 1 4.466 0.020 . 1 . . . . 1286 THR HB . 17364 1 239 . 1 1 24 24 THR HG21 H 1 0.934 0.020 . 1 . . . . 1286 THR HG2 . 17364 1 240 . 1 1 24 24 THR HG22 H 1 0.934 0.020 . 1 . . . . 1286 THR HG2 . 17364 1 241 . 1 1 24 24 THR HG23 H 1 0.934 0.020 . 1 . . . . 1286 THR HG2 . 17364 1 242 . 1 1 24 24 THR CA C 13 61.242 0.400 . 1 . . . . 1286 THR CA . 17364 1 243 . 1 1 24 24 THR CB C 13 67.602 0.400 . 1 . . . . 1286 THR CB . 17364 1 244 . 1 1 24 24 THR CG2 C 13 21.332 0.400 . 1 . . . . 1286 THR CG2 . 17364 1 245 . 1 1 24 24 THR N N 15 112.999 0.400 . 1 . . . . 1286 THR N . 17364 1 246 . 1 1 25 25 GLU H H 1 8.775 0.020 . 1 . . . . 1287 GLU H . 17364 1 247 . 1 1 25 25 GLU HA H 1 3.992 0.020 . 1 . . . . 1287 GLU HA . 17364 1 248 . 1 1 25 25 GLU HB2 H 1 2.443 0.020 . 2 . . . . 1287 GLU HB2 . 17364 1 249 . 1 1 25 25 GLU HB3 H 1 2.279 0.020 . 2 . . . . 1287 GLU HB3 . 17364 1 250 . 1 1 25 25 GLU HG2 H 1 2.306 0.020 . 2 . . . . 1287 GLU HG2 . 17364 1 251 . 1 1 25 25 GLU HG3 H 1 2.217 0.020 . 2 . . . . 1287 GLU HG3 . 17364 1 252 . 1 1 25 25 GLU CA C 13 58.460 0.400 . 1 . . . . 1287 GLU CA . 17364 1 253 . 1 1 25 25 GLU CB C 13 27.575 0.400 . 1 . . . . 1287 GLU CB . 17364 1 254 . 1 1 25 25 GLU CG C 13 37.243 0.400 . 1 . . . . 1287 GLU CG . 17364 1 255 . 1 1 25 25 GLU N N 15 121.522 0.400 . 1 . . . . 1287 GLU N . 17364 1 256 . 1 1 26 26 SER H H 1 8.308 0.020 . 1 . . . . 1288 SER H . 17364 1 257 . 1 1 26 26 SER HA H 1 4.575 0.020 . 1 . . . . 1288 SER HA . 17364 1 258 . 1 1 26 26 SER HB2 H 1 4.107 0.020 . 2 . . . . 1288 SER HB2 . 17364 1 259 . 1 1 26 26 SER HB3 H 1 4.053 0.020 . 2 . . . . 1288 SER HB3 . 17364 1 260 . 1 1 26 26 SER CA C 13 58.868 0.400 . 1 . . . . 1288 SER CA . 17364 1 261 . 1 1 26 26 SER CB C 13 63.572 0.400 . 1 . . . . 1288 SER CB . 17364 1 262 . 1 1 26 26 SER N N 15 116.610 0.400 . 1 . . . . 1288 SER N . 17364 1 263 . 1 1 27 27 LEU H H 1 8.286 0.020 . 1 . . . . 1289 LEU H . 17364 1 264 . 1 1 27 27 LEU HA H 1 4.318 0.020 . 1 . . . . 1289 LEU HA . 17364 1 265 . 1 1 27 27 LEU HB2 H 1 1.770 0.020 . 2 . . . . 1289 LEU HB2 . 17364 1 266 . 1 1 27 27 LEU HB3 H 1 1.463 0.020 . 2 . . . . 1289 LEU HB3 . 17364 1 267 . 1 1 27 27 LEU HG H 1 1.716 0.020 . 1 . . . . 1289 LEU HG . 17364 1 268 . 1 1 27 27 LEU HD11 H 1 0.875 0.020 . 2 . . . . 1289 LEU QD1 . 17364 1 269 . 1 1 27 27 LEU HD12 H 1 0.875 0.020 . 2 . . . . 1289 LEU QD1 . 17364 1 270 . 1 1 27 27 LEU HD13 H 1 0.875 0.020 . 2 . . . . 1289 LEU QD1 . 17364 1 271 . 1 1 27 27 LEU HD21 H 1 0.793 0.020 . 2 . . . . 1289 LEU QD2 . 17364 1 272 . 1 1 27 27 LEU HD22 H 1 0.793 0.020 . 2 . . . . 1289 LEU QD2 . 17364 1 273 . 1 1 27 27 LEU HD23 H 1 0.793 0.020 . 2 . . . . 1289 LEU QD2 . 17364 1 274 . 1 1 27 27 LEU CA C 13 55.642 0.400 . 1 . . . . 1289 LEU CA . 17364 1 275 . 1 1 27 27 LEU CB C 13 43.031 0.400 . 1 . . . . 1289 LEU CB . 17364 1 276 . 1 1 27 27 LEU CG C 13 26.941 0.400 . 1 . . . . 1289 LEU CG . 17364 1 277 . 1 1 27 27 LEU CD1 C 13 24.837 0.400 . 2 . . . . 1289 LEU CD1 . 17364 1 278 . 1 1 27 27 LEU CD2 C 13 23.929 0.400 . 2 . . . . 1289 LEU CD2 . 17364 1 279 . 1 1 27 27 LEU N N 15 123.913 0.400 . 1 . . . . 1289 LEU N . 17364 1 280 . 1 1 28 28 THR H H 1 8.089 0.020 . 1 . . . . 1290 THR H . 17364 1 281 . 1 1 28 28 THR HA H 1 4.305 0.020 . 1 . . . . 1290 THR HA . 17364 1 282 . 1 1 28 28 THR HB H 1 3.987 0.020 . 1 . . . . 1290 THR HB . 17364 1 283 . 1 1 28 28 THR HG21 H 1 1.126 0.020 . 1 . . . . 1290 THR QG2 . 17364 1 284 . 1 1 28 28 THR HG22 H 1 1.126 0.020 . 1 . . . . 1290 THR QG2 . 17364 1 285 . 1 1 28 28 THR HG23 H 1 1.126 0.020 . 1 . . . . 1290 THR QG2 . 17364 1 286 . 1 1 28 28 THR CA C 13 59.013 0.400 . 1 . . . . 1290 THR CA . 17364 1 287 . 1 1 28 28 THR CB C 13 70.599 0.400 . 1 . . . . 1290 THR CB . 17364 1 288 . 1 1 28 28 THR CG2 C 13 20.308 0.400 . 1 . . . . 1290 THR CG2 . 17364 1 289 . 1 1 28 28 THR N N 15 115.378 0.400 . 1 . . . . 1290 THR N . 17364 1 290 . 1 1 29 29 GLY H H 1 7.711 0.020 . 1 . . . . 1291 GLY H . 17364 1 291 . 1 1 29 29 GLY HA2 H 1 2.004 0.020 . 2 . . . . 1291 GLY HA2 . 17364 1 292 . 1 1 29 29 GLY HA3 H 1 3.504 0.020 . 2 . . . . 1291 GLY HA3 . 17364 1 293 . 1 1 29 29 GLY CA C 13 44.875 0.400 . 1 . . . . 1291 GLY CA . 17364 1 294 . 1 1 29 29 GLY N N 15 107.017 0.400 . 1 . . . . 1291 GLY N . 17364 1 295 . 1 1 30 30 PRO HA H 1 4.065 0.020 . 1 . . . . 1292 PRO HA . 17364 1 296 . 1 1 30 30 PRO HB2 H 1 1.946 0.020 . 2 . . . . 1292 PRO HB2 . 17364 1 297 . 1 1 30 30 PRO HB3 H 1 2.445 0.020 . 2 . . . . 1292 PRO HB3 . 17364 1 298 . 1 1 30 30 PRO HG2 H 1 2.116 0.020 . 2 . . . . 1292 PRO HG2 . 17364 1 299 . 1 1 30 30 PRO HG3 H 1 2.076 0.020 . 2 . . . . 1292 PRO HG3 . 17364 1 300 . 1 1 30 30 PRO HD2 H 1 2.854 0.020 . 2 . . . . 1292 PRO HD2 . 17364 1 301 . 1 1 30 30 PRO HD3 H 1 3.616 0.020 . 2 . . . . 1292 PRO HD3 . 17364 1 302 . 1 1 30 30 PRO CA C 13 65.480 0.400 . 1 . . . . 1292 PRO CA . 17364 1 303 . 1 1 30 30 PRO CB C 13 31.810 0.400 . 1 . . . . 1292 PRO CB . 17364 1 304 . 1 1 30 30 PRO CG C 13 27.511 0.400 . 1 . . . . 1292 PRO CG . 17364 1 305 . 1 1 30 30 PRO CD C 13 49.832 0.400 . 1 . . . . 1292 PRO CD . 17364 1 306 . 1 1 31 31 GLN H H 1 8.297 0.020 . 1 . . . . 1293 GLN H . 17364 1 307 . 1 1 31 31 GLN HA H 1 4.039 0.020 . 1 . . . . 1293 GLN HA . 17364 1 308 . 1 1 31 31 GLN HB2 H 1 2.175 0.020 . 2 . . . . 1293 GLN HB2 . 17364 1 309 . 1 1 31 31 GLN HB3 H 1 2.018 0.020 . 2 . . . . 1293 GLN HB3 . 17364 1 310 . 1 1 31 31 GLN HG2 H 1 2.447 0.020 . 2 . . . . 1293 GLN HG2 . 17364 1 311 . 1 1 31 31 GLN HG3 H 1 2.447 0.020 . 2 . . . . 1293 GLN HG3 . 17364 1 312 . 1 1 31 31 GLN HE21 H 1 7.548 0.020 . 2 . . . . 1293 GLN HE21 . 17364 1 313 . 1 1 31 31 GLN HE22 H 1 6.880 0.020 . 2 . . . . 1293 GLN HE22 . 17364 1 314 . 1 1 31 31 GLN CA C 13 58.761 0.400 . 1 . . . . 1293 GLN CA . 17364 1 315 . 1 1 31 31 GLN CB C 13 28.421 0.400 . 1 . . . . 1293 GLN CB . 17364 1 316 . 1 1 31 31 GLN CG C 13 34.311 0.400 . 1 . . . . 1293 GLN CG . 17364 1 317 . 1 1 31 31 GLN N N 15 114.387 0.400 . 1 . . . . 1293 GLN N . 17364 1 318 . 1 1 31 31 GLN NE2 N 15 112.214 0.400 . 1 . . . . 1293 GLN NE2 . 17364 1 319 . 1 1 32 32 ALA H H 1 7.526 0.020 . 1 . . . . 1294 ALA H . 17364 1 320 . 1 1 32 32 ALA HA H 1 3.845 0.020 . 1 . . . . 1294 ALA HA . 17364 1 321 . 1 1 32 32 ALA HB1 H 1 1.257 0.020 . 1 . . . . 1294 ALA HB . 17364 1 322 . 1 1 32 32 ALA HB2 H 1 1.257 0.020 . 1 . . . . 1294 ALA HB . 17364 1 323 . 1 1 32 32 ALA HB3 H 1 1.257 0.020 . 1 . . . . 1294 ALA HB . 17364 1 324 . 1 1 32 32 ALA CA C 13 55.169 0.400 . 1 . . . . 1294 ALA CA . 17364 1 325 . 1 1 32 32 ALA CB C 13 18.215 0.400 . 1 . . . . 1294 ALA CB . 17364 1 326 . 1 1 32 32 ALA N N 15 122.661 0.400 . 1 . . . . 1294 ALA N . 17364 1 327 . 1 1 33 33 VAL H H 1 7.187 0.020 . 1 . . . . 1295 VAL H . 17364 1 328 . 1 1 33 33 VAL HA H 1 3.968 0.020 . 1 . . . . 1295 VAL HA . 17364 1 329 . 1 1 33 33 VAL HB H 1 2.036 0.020 . 1 . . . . 1295 VAL HB . 17364 1 330 . 1 1 33 33 VAL HG11 H 1 1.063 0.020 . 2 . . . . 1295 VAL QG1 . 17364 1 331 . 1 1 33 33 VAL HG12 H 1 1.063 0.020 . 2 . . . . 1295 VAL QG1 . 17364 1 332 . 1 1 33 33 VAL HG13 H 1 1.063 0.020 . 2 . . . . 1295 VAL QG1 . 17364 1 333 . 1 1 33 33 VAL HG21 H 1 0.791 0.020 . 2 . . . . 1295 VAL QG2 . 17364 1 334 . 1 1 33 33 VAL HG22 H 1 0.791 0.020 . 2 . . . . 1295 VAL QG2 . 17364 1 335 . 1 1 33 33 VAL HG23 H 1 0.791 0.020 . 2 . . . . 1295 VAL QG2 . 17364 1 336 . 1 1 33 33 VAL CA C 13 65.825 0.400 . 1 . . . . 1295 VAL CA . 17364 1 337 . 1 1 33 33 VAL CB C 13 31.706 0.400 . 1 . . . . 1295 VAL CB . 17364 1 338 . 1 1 33 33 VAL CG1 C 13 21.602 0.400 . 2 . . . . 1295 VAL CG1 . 17364 1 339 . 1 1 33 33 VAL CG2 C 13 20.958 0.400 . 2 . . . . 1295 VAL CG2 . 17364 1 340 . 1 1 33 33 VAL N N 15 117.054 0.400 . 1 . . . . 1295 VAL N . 17364 1 341 . 1 1 34 34 ALA H H 1 8.582 0.020 . 1 . . . . 1296 ALA H . 17364 1 342 . 1 1 34 34 ALA HA H 1 4.050 0.020 . 1 . . . . 1296 ALA HA . 17364 1 343 . 1 1 34 34 ALA HB1 H 1 1.476 0.020 . 1 . . . . 1296 ALA HB . 17364 1 344 . 1 1 34 34 ALA HB2 H 1 1.476 0.020 . 1 . . . . 1296 ALA HB . 17364 1 345 . 1 1 34 34 ALA HB3 H 1 1.476 0.020 . 1 . . . . 1296 ALA HB . 17364 1 346 . 1 1 34 34 ALA CA C 13 54.936 0.400 . 1 . . . . 1296 ALA CA . 17364 1 347 . 1 1 34 34 ALA CB C 13 18.053 0.400 . 1 . . . . 1296 ALA CB . 17364 1 348 . 1 1 34 34 ALA N N 15 122.324 0.400 . 1 . . . . 1296 ALA N . 17364 1 349 . 1 1 35 35 ARG H H 1 8.021 0.020 . 1 . . . . 1297 ARG H . 17364 1 350 . 1 1 35 35 ARG HA H 1 4.089 0.020 . 1 . . . . 1297 ARG HA . 17364 1 351 . 1 1 35 35 ARG HB2 H 1 1.945 0.020 . 2 . . . . 1297 ARG HB2 . 17364 1 352 . 1 1 35 35 ARG HB3 H 1 1.833 0.020 . 2 . . . . 1297 ARG HB3 . 17364 1 353 . 1 1 35 35 ARG HG2 H 1 1.623 0.020 . 2 . . . . 1297 ARG HG2 . 17364 1 354 . 1 1 35 35 ARG HG3 H 1 1.525 0.020 . 2 . . . . 1297 ARG HG3 . 17364 1 355 . 1 1 35 35 ARG HD2 H 1 3.145 0.020 . 2 . . . . 1297 ARG HD2 . 17364 1 356 . 1 1 35 35 ARG HD3 H 1 3.026 0.020 . 2 . . . . 1297 ARG HD3 . 17364 1 357 . 1 1 35 35 ARG CA C 13 58.598 0.400 . 1 . . . . 1297 ARG CA . 17364 1 358 . 1 1 35 35 ARG CB C 13 29.637 0.400 . 1 . . . . 1297 ARG CB . 17364 1 359 . 1 1 35 35 ARG CG C 13 27.051 0.400 . 1 . . . . 1297 ARG CG . 17364 1 360 . 1 1 35 35 ARG CD C 13 43.331 0.400 . 1 . . . . 1297 ARG CD . 17364 1 361 . 1 1 35 35 ARG N N 15 118.929 0.400 . 1 . . . . 1297 ARG N . 17364 1 362 . 1 1 36 36 ALA H H 1 8.164 0.020 . 1 . . . . 1298 ALA H . 17364 1 363 . 1 1 36 36 ALA HA H 1 3.904 0.020 . 1 . . . . 1298 ALA HA . 17364 1 364 . 1 1 36 36 ALA HB1 H 1 1.359 0.020 . 1 . . . . 1298 ALA HB . 17364 1 365 . 1 1 36 36 ALA HB2 H 1 1.359 0.020 . 1 . . . . 1298 ALA HB . 17364 1 366 . 1 1 36 36 ALA HB3 H 1 1.359 0.020 . 1 . . . . 1298 ALA HB . 17364 1 367 . 1 1 36 36 ALA CA C 13 55.081 0.400 . 1 . . . . 1298 ALA CA . 17364 1 368 . 1 1 36 36 ALA CB C 13 19.190 0.400 . 1 . . . . 1298 ALA CB . 17364 1 369 . 1 1 36 36 ALA N N 15 122.284 0.400 . 1 . . . . 1298 ALA N . 17364 1 370 . 1 1 37 37 SER H H 1 8.496 0.020 . 1 . . . . 1299 SER H . 17364 1 371 . 1 1 37 37 SER HA H 1 3.472 0.020 . 1 . . . . 1299 SER HA . 17364 1 372 . 1 1 37 37 SER HB2 H 1 4.046 0.020 . 2 . . . . 1299 SER HB2 . 17364 1 373 . 1 1 37 37 SER HB3 H 1 3.978 0.020 . 2 . . . . 1299 SER HB3 . 17364 1 374 . 1 1 37 37 SER CA C 13 62.721 0.400 . 1 . . . . 1299 SER CA . 17364 1 375 . 1 1 37 37 SER CB C 13 62.751 0.400 . 1 . . . . 1299 SER CB . 17364 1 376 . 1 1 37 37 SER N N 15 115.444 0.400 . 1 . . . . 1299 SER N . 17364 1 377 . 1 1 38 38 SER H H 1 8.299 0.020 . 1 . . . . 1300 SER H . 17364 1 378 . 1 1 38 38 SER HA H 1 4.086 0.020 . 1 . . . . 1300 SER HA . 17364 1 379 . 1 1 38 38 SER HB2 H 1 4.118 0.020 . 2 . . . . 1300 SER HB2 . 17364 1 380 . 1 1 38 38 SER HB3 H 1 3.935 0.020 . 2 . . . . 1300 SER HB3 . 17364 1 381 . 1 1 38 38 SER CA C 13 61.705 0.400 . 1 . . . . 1300 SER CA . 17364 1 382 . 1 1 38 38 SER CB C 13 62.718 0.400 . 1 . . . . 1300 SER CB . 17364 1 383 . 1 1 38 38 SER N N 15 116.303 0.400 . 1 . . . . 1300 SER N . 17364 1 384 . 1 1 39 39 ALA H H 1 7.957 0.020 . 1 . . . . 1301 ALA H . 17364 1 385 . 1 1 39 39 ALA HA H 1 4.068 0.020 . 1 . . . . 1301 ALA HA . 17364 1 386 . 1 1 39 39 ALA HB1 H 1 1.502 0.020 . 1 . . . . 1301 ALA HB . 17364 1 387 . 1 1 39 39 ALA HB2 H 1 1.502 0.020 . 1 . . . . 1301 ALA HB . 17364 1 388 . 1 1 39 39 ALA HB3 H 1 1.502 0.020 . 1 . . . . 1301 ALA HB . 17364 1 389 . 1 1 39 39 ALA CA C 13 55.170 0.400 . 1 . . . . 1301 ALA CA . 17364 1 390 . 1 1 39 39 ALA CB C 13 17.963 0.400 . 1 . . . . 1301 ALA CB . 17364 1 391 . 1 1 39 39 ALA N N 15 124.926 0.400 . 1 . . . . 1301 ALA N . 17364 1 392 . 1 1 40 40 ALA H H 1 8.336 0.020 . 1 . . . . 1302 ALA H . 17364 1 393 . 1 1 40 40 ALA HA H 1 4.007 0.020 . 1 . . . . 1302 ALA HA . 17364 1 394 . 1 1 40 40 ALA HB1 H 1 1.249 0.020 . 1 . . . . 1302 ALA HB . 17364 1 395 . 1 1 40 40 ALA HB2 H 1 1.249 0.020 . 1 . . . . 1302 ALA HB . 17364 1 396 . 1 1 40 40 ALA HB3 H 1 1.249 0.020 . 1 . . . . 1302 ALA HB . 17364 1 397 . 1 1 40 40 ALA CA C 13 54.911 0.400 . 1 . . . . 1302 ALA CA . 17364 1 398 . 1 1 40 40 ALA CB C 13 18.565 0.400 . 1 . . . . 1302 ALA CB . 17364 1 399 . 1 1 40 40 ALA N N 15 120.143 0.400 . 1 . . . . 1302 ALA N . 17364 1 400 . 1 1 41 41 LEU H H 1 7.896 0.020 . 1 . . . . 1303 LEU H . 17364 1 401 . 1 1 41 41 LEU HA H 1 4.301 0.020 . 1 . . . . 1303 LEU HA . 17364 1 402 . 1 1 41 41 LEU HB2 H 1 1.654 0.020 . 2 . . . . 1303 LEU HB2 . 17364 1 403 . 1 1 41 41 LEU HB3 H 1 1.601 0.020 . 2 . . . . 1303 LEU HB3 . 17364 1 404 . 1 1 41 41 LEU HG H 1 1.866 0.020 . 1 . . . . 1303 LEU HG . 17364 1 405 . 1 1 41 41 LEU HD11 H 1 0.979 0.020 . 2 . . . . 1303 LEU HD1 . 17364 1 406 . 1 1 41 41 LEU HD12 H 1 0.979 0.020 . 2 . . . . 1303 LEU HD1 . 17364 1 407 . 1 1 41 41 LEU HD13 H 1 0.979 0.020 . 2 . . . . 1303 LEU HD1 . 17364 1 408 . 1 1 41 41 LEU HD21 H 1 0.781 0.020 . 2 . . . . 1303 LEU QD2 . 17364 1 409 . 1 1 41 41 LEU HD22 H 1 0.781 0.020 . 2 . . . . 1303 LEU QD2 . 17364 1 410 . 1 1 41 41 LEU HD23 H 1 0.781 0.020 . 2 . . . . 1303 LEU QD2 . 17364 1 411 . 1 1 41 41 LEU CA C 13 55.999 0.400 . 1 . . . . 1303 LEU CA . 17364 1 412 . 1 1 41 41 LEU CB C 13 42.095 0.400 . 1 . . . . 1303 LEU CB . 17364 1 413 . 1 1 41 41 LEU CG C 13 27.561 0.400 . 1 . . . . 1303 LEU CG . 17364 1 414 . 1 1 41 41 LEU CD1 C 13 23.247 0.400 . 2 . . . . 1303 LEU CD1 . 17364 1 415 . 1 1 41 41 LEU CD2 C 13 25.929 0.400 . 2 . . . . 1303 LEU CD2 . 17364 1 416 . 1 1 41 41 LEU N N 15 112.843 0.400 . 1 . . . . 1303 LEU N . 17364 1 417 . 1 1 42 42 SER H H 1 7.716 0.020 . 1 . . . . 1304 SER H . 17364 1 418 . 1 1 42 42 SER HA H 1 4.631 0.020 . 1 . . . . 1304 SER HA . 17364 1 419 . 1 1 42 42 SER HB2 H 1 3.961 0.020 . 2 . . . . 1304 SER HB2 . 17364 1 420 . 1 1 42 42 SER HB3 H 1 3.888 0.020 . 2 . . . . 1304 SER HB3 . 17364 1 421 . 1 1 42 42 SER CA C 13 58.685 0.400 . 1 . . . . 1304 SER CA . 17364 1 422 . 1 1 42 42 SER CB C 13 64.875 0.400 . 1 . . . . 1304 SER CB . 17364 1 423 . 1 1 42 42 SER N N 15 112.241 0.400 . 1 . . . . 1304 SER N . 17364 1 424 . 1 1 43 43 CYS H H 1 7.609 0.020 . 1 . . . . 1305 CYS H . 17364 1 425 . 1 1 43 43 CYS HA H 1 4.402 0.020 . 1 . . . . 1305 CYS HA . 17364 1 426 . 1 1 43 43 CYS HB2 H 1 3.079 0.020 . 2 . . . . 1305 CYS HB2 . 17364 1 427 . 1 1 43 43 CYS HB3 H 1 3.003 0.020 . 2 . . . . 1305 CYS HB3 . 17364 1 428 . 1 1 43 43 CYS CA C 13 59.029 0.400 . 1 . . . . 1305 CYS CA . 17364 1 429 . 1 1 43 43 CYS CB C 13 28.186 0.400 . 1 . . . . 1305 CYS CB . 17364 1 430 . 1 1 43 43 CYS N N 15 120.786 0.400 . 1 . . . . 1305 CYS N . 17364 1 431 . 1 1 44 44 SER H H 1 8.331 0.020 . 1 . . . . 1306 SER H . 17364 1 432 . 1 1 44 44 SER HA H 1 4.690 0.020 . 1 . . . . 1306 SER HA . 17364 1 433 . 1 1 44 44 SER HB2 H 1 3.753 0.020 . 2 . . . . 1306 SER HB2 . 17364 1 434 . 1 1 44 44 SER HB3 H 1 3.646 0.020 . 2 . . . . 1306 SER HB3 . 17364 1 435 . 1 1 44 44 SER CA C 13 58.660 0.400 . 1 . . . . 1306 SER CA . 17364 1 436 . 1 1 44 44 SER CB C 13 64.434 0.400 . 1 . . . . 1306 SER CB . 17364 1 437 . 1 1 44 44 SER N N 15 117.020 0.400 . 1 . . . . 1306 SER N . 17364 1 438 . 1 1 45 45 PRO HA H 1 4.818 0.020 . 1 . . . . 1307 PRO HA . 17364 1 439 . 1 1 45 45 PRO HB2 H 1 2.414 0.020 . 2 . . . . 1307 PRO HB2 . 17364 1 440 . 1 1 45 45 PRO HB3 H 1 2.073 0.020 . 2 . . . . 1307 PRO HB3 . 17364 1 441 . 1 1 45 45 PRO HG2 H 1 1.841 0.020 . 2 . . . . 1307 PRO HG2 . 17364 1 442 . 1 1 45 45 PRO HG3 H 1 1.947 0.020 . 2 . . . . 1307 PRO HG3 . 17364 1 443 . 1 1 45 45 PRO HD2 H 1 3.576 0.020 . 2 . . . . 1307 PRO HD2 . 17364 1 444 . 1 1 45 45 PRO HD3 H 1 3.525 0.020 . 2 . . . . 1307 PRO HD3 . 17364 1 445 . 1 1 45 45 PRO CA C 13 62.886 0.400 . 1 . . . . 1307 PRO CA . 17364 1 446 . 1 1 45 45 PRO CB C 13 34.311 0.400 . 1 . . . . 1307 PRO CB . 17364 1 447 . 1 1 45 45 PRO CG C 13 24.983 0.400 . 1 . . . . 1307 PRO CG . 17364 1 448 . 1 1 45 45 PRO CD C 13 50.174 0.400 . 1 . . . . 1307 PRO CD . 17364 1 449 . 1 1 46 46 ARG H H 1 8.656 0.020 . 1 . . . . 1308 ARG H . 17364 1 450 . 1 1 46 46 ARG HA H 1 4.513 0.020 . 1 . . . . 1308 ARG HA . 17364 1 451 . 1 1 46 46 ARG HB2 H 1 1.918 0.020 . 2 . . . . 1308 ARG HB2 . 17364 1 452 . 1 1 46 46 ARG HB3 H 1 1.818 0.020 . 2 . . . . 1308 ARG HB3 . 17364 1 453 . 1 1 46 46 ARG HG2 H 1 2.016 0.020 . 2 . . . . 1308 ARG HG2 . 17364 1 454 . 1 1 46 46 ARG HG3 H 1 1.918 0.020 . 2 . . . . 1308 ARG HG3 . 17364 1 455 . 1 1 46 46 ARG HD2 H 1 3.148 0.020 . 2 . . . . 1308 ARG HD2 . 17364 1 456 . 1 1 46 46 ARG HD3 H 1 3.148 0.020 . 2 . . . . 1308 ARG HD3 . 17364 1 457 . 1 1 46 46 ARG CA C 13 54.954 0.400 . 1 . . . . 1308 ARG CA . 17364 1 458 . 1 1 46 46 ARG CB C 13 29.591 0.400 . 1 . . . . 1308 ARG CB . 17364 1 459 . 1 1 46 46 ARG CG C 13 27.251 0.400 . 1 . . . . 1308 ARG CG . 17364 1 460 . 1 1 46 46 ARG CD C 13 43.223 0.400 . 1 . . . . 1308 ARG CD . 17364 1 461 . 1 1 46 46 ARG N N 15 122.446 0.400 . 1 . . . . 1308 ARG N . 17364 1 462 . 1 1 47 47 PRO HA H 1 4.434 0.020 . 1 . . . . 1309 PRO HA . 17364 1 463 . 1 1 47 47 PRO HB2 H 1 2.258 0.020 . 2 . . . . 1309 PRO HB2 . 17364 1 464 . 1 1 47 47 PRO HB3 H 1 1.700 0.020 . 2 . . . . 1309 PRO HB3 . 17364 1 465 . 1 1 47 47 PRO HG2 H 1 1.887 0.020 . 2 . . . . 1309 PRO HG2 . 17364 1 466 . 1 1 47 47 PRO HG3 H 1 1.887 0.020 . 2 . . . . 1309 PRO HG3 . 17364 1 467 . 1 1 47 47 PRO HD2 H 1 4.055 0.020 . 2 . . . . 1309 PRO HD2 . 17364 1 468 . 1 1 47 47 PRO HD3 H 1 3.948 0.020 . 2 . . . . 1309 PRO HD3 . 17364 1 469 . 1 1 47 47 PRO CA C 13 63.147 0.400 . 1 . . . . 1309 PRO CA . 17364 1 470 . 1 1 47 47 PRO CB C 13 32.183 0.400 . 1 . . . . 1309 PRO CB . 17364 1 471 . 1 1 47 47 PRO CG C 13 27.307 0.400 . 1 . . . . 1309 PRO CG . 17364 1 472 . 1 1 47 47 PRO CD C 13 51.194 0.400 . 1 . . . . 1309 PRO CD . 17364 1 473 . 1 1 48 48 THR H H 1 8.597 0.020 . 1 . . . . 1310 THR H . 17364 1 474 . 1 1 48 48 THR HA H 1 4.684 0.020 . 1 . . . . 1310 THR HA . 17364 1 475 . 1 1 48 48 THR HB H 1 4.173 0.020 . 1 . . . . 1310 THR HB . 17364 1 476 . 1 1 48 48 THR HG21 H 1 1.301 0.020 . 1 . . . . 1310 THR QG2 . 17364 1 477 . 1 1 48 48 THR HG22 H 1 1.301 0.020 . 1 . . . . 1310 THR QG2 . 17364 1 478 . 1 1 48 48 THR HG23 H 1 1.301 0.020 . 1 . . . . 1310 THR QG2 . 17364 1 479 . 1 1 48 48 THR CA C 13 59.003 0.400 . 1 . . . . 1310 THR CA . 17364 1 480 . 1 1 48 48 THR CB C 13 69.887 0.400 . 1 . . . . 1310 THR CB . 17364 1 481 . 1 1 48 48 THR CG2 C 13 21.086 0.400 . 1 . . . . 1310 THR CG2 . 17364 1 482 . 1 1 48 48 THR N N 15 118.766 0.400 . 1 . . . . 1310 THR N . 17364 1 483 . 1 1 49 49 PRO HA H 1 4.745 0.020 . 1 . . . . 1311 PRO HA . 17364 1 484 . 1 1 49 49 PRO HB2 H 1 1.895 0.020 . 2 . . . . 1311 PRO HB2 . 17364 1 485 . 1 1 49 49 PRO HB3 H 1 1.740 0.020 . 2 . . . . 1311 PRO HB3 . 17364 1 486 . 1 1 49 49 PRO HG2 H 1 1.698 0.020 . 2 . . . . 1311 PRO HG2 . 17364 1 487 . 1 1 49 49 PRO HG3 H 1 2.157 0.020 . 2 . . . . 1311 PRO HG3 . 17364 1 488 . 1 1 49 49 PRO HD2 H 1 3.826 0.020 . 2 . . . . 1311 PRO HD2 . 17364 1 489 . 1 1 49 49 PRO HD3 H 1 4.318 0.020 . 2 . . . . 1311 PRO HD3 . 17364 1 490 . 1 1 49 49 PRO CA C 13 62.406 0.400 . 1 . . . . 1311 PRO CA . 17364 1 491 . 1 1 49 49 PRO CB C 13 34.288 0.400 . 1 . . . . 1311 PRO CB . 17364 1 492 . 1 1 49 49 PRO CG C 13 27.399 0.400 . 1 . . . . 1311 PRO CG . 17364 1 493 . 1 1 49 49 PRO CD C 13 51.320 0.400 . 1 . . . . 1311 PRO CD . 17364 1 494 . 1 1 50 50 ALA H H 1 8.448 0.020 . 1 . . . . 1312 ALA H . 17364 1 495 . 1 1 50 50 ALA HA H 1 4.771 0.020 . 1 . . . . 1312 ALA HA . 17364 1 496 . 1 1 50 50 ALA HB1 H 1 1.366 0.020 . 1 . . . . 1312 ALA HB . 17364 1 497 . 1 1 50 50 ALA HB2 H 1 1.366 0.020 . 1 . . . . 1312 ALA HB . 17364 1 498 . 1 1 50 50 ALA HB3 H 1 1.366 0.020 . 1 . . . . 1312 ALA HB . 17364 1 499 . 1 1 50 50 ALA CA C 13 50.740 0.400 . 1 . . . . 1312 ALA CA . 17364 1 500 . 1 1 50 50 ALA CB C 13 22.191 0.400 . 1 . . . . 1312 ALA CB . 17364 1 501 . 1 1 50 50 ALA N N 15 122.147 0.400 . 1 . . . . 1312 ALA N . 17364 1 502 . 1 1 51 51 VAL H H 1 8.654 0.020 . 1 . . . . 1313 VAL H . 17364 1 503 . 1 1 51 51 VAL HA H 1 4.441 0.020 . 1 . . . . 1313 VAL HA . 17364 1 504 . 1 1 51 51 VAL HB H 1 1.985 0.020 . 1 . . . . 1313 VAL HB . 17364 1 505 . 1 1 51 51 VAL HG11 H 1 1.033 0.020 . 2 . . . . 1313 VAL QG1 . 17364 1 506 . 1 1 51 51 VAL HG12 H 1 1.033 0.020 . 2 . . . . 1313 VAL QG1 . 17364 1 507 . 1 1 51 51 VAL HG13 H 1 1.033 0.020 . 2 . . . . 1313 VAL QG1 . 17364 1 508 . 1 1 51 51 VAL HG21 H 1 0.932 0.020 . 2 . . . . 1313 VAL QG2 . 17364 1 509 . 1 1 51 51 VAL HG22 H 1 0.932 0.020 . 2 . . . . 1313 VAL QG2 . 17364 1 510 . 1 1 51 51 VAL HG23 H 1 0.932 0.020 . 2 . . . . 1313 VAL QG2 . 17364 1 511 . 1 1 51 51 VAL CA C 13 63.922 0.400 . 1 . . . . 1313 VAL CA . 17364 1 512 . 1 1 51 51 VAL CB C 13 31.682 0.400 . 1 . . . . 1313 VAL CB . 17364 1 513 . 1 1 51 51 VAL CG1 C 13 21.984 0.400 . 2 . . . . 1313 VAL CG1 . 17364 1 514 . 1 1 51 51 VAL CG2 C 13 21.149 0.400 . 2 . . . . 1313 VAL CG2 . 17364 1 515 . 1 1 51 51 VAL N N 15 124.676 0.400 . 1 . . . . 1313 VAL N . 17364 1 516 . 1 1 52 52 VAL H H 1 9.359 0.020 . 1 . . . . 1314 VAL H . 17364 1 517 . 1 1 52 52 VAL HA H 1 5.177 0.020 . 1 . . . . 1314 VAL HA . 17364 1 518 . 1 1 52 52 VAL HB H 1 2.196 0.020 . 1 . . . . 1314 VAL HB . 17364 1 519 . 1 1 52 52 VAL HG11 H 1 0.989 0.020 . 2 . . . . 1314 VAL QG1 . 17364 1 520 . 1 1 52 52 VAL HG12 H 1 0.989 0.020 . 2 . . . . 1314 VAL QG1 . 17364 1 521 . 1 1 52 52 VAL HG13 H 1 0.989 0.020 . 2 . . . . 1314 VAL QG1 . 17364 1 522 . 1 1 52 52 VAL HG21 H 1 1.153 0.020 . 2 . . . . 1314 VAL QG2 . 17364 1 523 . 1 1 52 52 VAL HG22 H 1 1.153 0.020 . 2 . . . . 1314 VAL QG2 . 17364 1 524 . 1 1 52 52 VAL HG23 H 1 1.153 0.020 . 2 . . . . 1314 VAL QG2 . 17364 1 525 . 1 1 52 52 VAL CA C 13 58.709 0.400 . 1 . . . . 1314 VAL CA . 17364 1 526 . 1 1 52 52 VAL CB C 13 35.825 0.400 . 1 . . . . 1314 VAL CB . 17364 1 527 . 1 1 52 52 VAL CG1 C 13 22.391 0.400 . 2 . . . . 1314 VAL CG1 . 17364 1 528 . 1 1 52 52 VAL CG2 C 13 21.019 0.400 . 2 . . . . 1314 VAL CG2 . 17364 1 529 . 1 1 52 52 VAL N N 15 121.509 0.400 . 1 . . . . 1314 VAL N . 17364 1 530 . 1 1 53 53 HIS H H 1 9.217 0.020 . 1 . . . . 1315 HIS H . 17364 1 531 . 1 1 53 53 HIS HA H 1 4.907 0.020 . 1 . . . . 1315 HIS HA . 17364 1 532 . 1 1 53 53 HIS HB2 H 1 3.147 0.020 . 2 . . . . 1315 HIS HB2 . 17364 1 533 . 1 1 53 53 HIS HB3 H 1 3.255 0.020 . 2 . . . . 1315 HIS HB3 . 17364 1 534 . 1 1 53 53 HIS HD2 H 1 7.064 0.020 . 1 . . . . 1315 HIS HD2 . 17364 1 535 . 1 1 53 53 HIS HE1 H 1 7.608 0.020 . 1 . . . . 1315 HIS HE1 . 17364 1 536 . 1 1 53 53 HIS CA C 13 57.382 0.400 . 1 . . . . 1315 HIS CA . 17364 1 537 . 1 1 53 53 HIS CB C 13 31.952 0.400 . 1 . . . . 1315 HIS CB . 17364 1 538 . 1 1 53 53 HIS CD2 C 13 118.546 0.400 . 1 . . . . 1315 HIS CD2 . 17364 1 539 . 1 1 53 53 HIS CE1 C 13 137.475 0.400 . 1 . . . . 1315 HIS CE1 . 17364 1 540 . 1 1 53 53 HIS N N 15 123.432 0.400 . 1 . . . . 1315 HIS N . 17364 1 541 . 1 1 54 54 PHE H H 1 9.300 0.020 . 1 . . . . 1316 PHE H . 17364 1 542 . 1 1 54 54 PHE HA H 1 4.650 0.020 . 1 . . . . 1316 PHE HA . 17364 1 543 . 1 1 54 54 PHE HB2 H 1 3.635 0.020 . 2 . . . . 1316 PHE HB2 . 17364 1 544 . 1 1 54 54 PHE HB3 H 1 2.413 0.020 . 2 . . . . 1316 PHE HB3 . 17364 1 545 . 1 1 54 54 PHE HD1 H 1 6.672 0.020 . 3 . . . . 1316 PHE QD . 17364 1 546 . 1 1 54 54 PHE HD2 H 1 6.672 0.020 . 3 . . . . 1316 PHE QD . 17364 1 547 . 1 1 54 54 PHE HE1 H 1 6.211 0.020 . 3 . . . . 1316 PHE QE . 17364 1 548 . 1 1 54 54 PHE HE2 H 1 6.211 0.020 . 3 . . . . 1316 PHE QE . 17364 1 549 . 1 1 54 54 PHE HZ H 1 6.690 0.020 . 1 . . . . 1316 PHE HZ . 17364 1 550 . 1 1 54 54 PHE CA C 13 56.734 0.400 . 1 . . . . 1316 PHE CA . 17364 1 551 . 1 1 54 54 PHE CB C 13 42.782 0.400 . 1 . . . . 1316 PHE CB . 17364 1 552 . 1 1 54 54 PHE CD1 C 13 131.668 0.400 . 3 . . . . 1316 PHE CD1 . 17364 1 553 . 1 1 54 54 PHE CE2 C 13 130.297 0.400 . 3 . . . . 1316 PHE CE2 . 17364 1 554 . 1 1 54 54 PHE CZ C 13 127.630 0.400 . 1 . . . . 1316 PHE CZ . 17364 1 555 . 1 1 54 54 PHE N N 15 133.248 0.400 . 1 . . . . 1316 PHE N . 17364 1 556 . 1 1 55 55 LYS H H 1 8.496 0.020 . 1 . . . . 1317 LYS H . 17364 1 557 . 1 1 55 55 LYS HA H 1 5.309 0.020 . 1 . . . . 1317 LYS HA . 17364 1 558 . 1 1 55 55 LYS HB2 H 1 1.919 0.020 . 2 . . . . 1317 LYS HB2 . 17364 1 559 . 1 1 55 55 LYS HB3 H 1 1.526 0.020 . 2 . . . . 1317 LYS HB3 . 17364 1 560 . 1 1 55 55 LYS HG2 H 1 1.337 0.020 . 2 . . . . 1317 LYS HG2 . 17364 1 561 . 1 1 55 55 LYS HG3 H 1 1.264 0.020 . 2 . . . . 1317 LYS HG3 . 17364 1 562 . 1 1 55 55 LYS HD2 H 1 1.641 0.020 . 2 . . . . 1317 LYS QD . 17364 1 563 . 1 1 55 55 LYS HD3 H 1 1.641 0.020 . 2 . . . . 1317 LYS QD . 17364 1 564 . 1 1 55 55 LYS HE2 H 1 2.879 0.020 . 2 . . . . 1317 LYS HE2 . 17364 1 565 . 1 1 55 55 LYS HE3 H 1 2.879 0.020 . 2 . . . . 1317 LYS HE3 . 17364 1 566 . 1 1 55 55 LYS CA C 13 54.300 0.400 . 1 . . . . 1317 LYS CA . 17364 1 567 . 1 1 55 55 LYS CB C 13 36.353 0.400 . 1 . . . . 1317 LYS CB . 17364 1 568 . 1 1 55 55 LYS CG C 13 25.375 0.400 . 1 . . . . 1317 LYS CG . 17364 1 569 . 1 1 55 55 LYS CD C 13 29.677 0.400 . 1 . . . . 1317 LYS CD . 17364 1 570 . 1 1 55 55 LYS CE C 13 42.111 0.400 . 1 . . . . 1317 LYS CE . 17364 1 571 . 1 1 55 55 LYS N N 15 127.252 0.400 . 1 . . . . 1317 LYS N . 17364 1 572 . 1 1 56 56 VAL HA H 1 4.708 0.020 . 1 . . . . 1318 VAL HA . 17364 1 573 . 1 1 56 56 VAL HB H 1 1.974 0.020 . 1 . . . . 1318 VAL HB . 17364 1 574 . 1 1 56 56 VAL HG11 H 1 0.947 0.020 . 2 . . . . 1318 VAL QQG . 17364 1 575 . 1 1 56 56 VAL HG12 H 1 0.947 0.020 . 2 . . . . 1318 VAL QQG . 17364 1 576 . 1 1 56 56 VAL HG13 H 1 0.947 0.020 . 2 . . . . 1318 VAL QQG . 17364 1 577 . 1 1 56 56 VAL HG21 H 1 0.947 0.020 . 2 . . . . 1318 VAL QQG . 17364 1 578 . 1 1 56 56 VAL HG22 H 1 0.947 0.020 . 2 . . . . 1318 VAL QQG . 17364 1 579 . 1 1 56 56 VAL HG23 H 1 0.947 0.020 . 2 . . . . 1318 VAL QQG . 17364 1 580 . 1 1 56 56 VAL CA C 13 60.522 0.400 . 1 . . . . 1318 VAL CA . 17364 1 581 . 1 1 56 56 VAL CB C 13 33.291 0.400 . 1 . . . . 1318 VAL CB . 17364 1 582 . 1 1 56 56 VAL CG1 C 13 21.939 0.400 . 2 . . . . 1318 VAL CG1 . 17364 1 583 . 1 1 57 57 SER H H 1 9.077 0.020 . 1 . . . . 1319 SER H . 17364 1 584 . 1 1 57 57 SER HA H 1 4.939 0.020 . 1 . . . . 1319 SER HA . 17364 1 585 . 1 1 57 57 SER HB2 H 1 3.780 0.020 . 2 . . . . 1319 SER HB2 . 17364 1 586 . 1 1 57 57 SER HB3 H 1 4.340 0.020 . 2 . . . . 1319 SER HB3 . 17364 1 587 . 1 1 57 57 SER CA C 13 56.628 0.400 . 1 . . . . 1319 SER CA . 17364 1 588 . 1 1 57 57 SER CB C 13 67.507 0.400 . 1 . . . . 1319 SER CB . 17364 1 589 . 1 1 57 57 SER N N 15 122.037 0.400 . 1 . . . . 1319 SER N . 17364 1 590 . 1 1 58 58 ALA HA H 1 4.016 0.020 . 1 . . . . 1320 ALA HA . 17364 1 591 . 1 1 58 58 ALA HB1 H 1 1.445 0.020 . 1 . . . . 1320 ALA HB . 17364 1 592 . 1 1 58 58 ALA HB2 H 1 1.445 0.020 . 1 . . . . 1320 ALA HB . 17364 1 593 . 1 1 58 58 ALA HB3 H 1 1.445 0.020 . 1 . . . . 1320 ALA HB . 17364 1 594 . 1 1 58 58 ALA CA C 13 54.640 0.400 . 1 . . . . 1320 ALA CA . 17364 1 595 . 1 1 58 58 ALA CB C 13 18.331 0.400 . 1 . . . . 1320 ALA CB . 17364 1 596 . 1 1 59 59 GLN H H 1 7.749 0.020 . 1 . . . . 1321 GLN H . 17364 1 597 . 1 1 59 59 GLN HA H 1 4.335 0.020 . 1 . . . . 1321 GLN HA . 17364 1 598 . 1 1 59 59 GLN HB2 H 1 2.242 0.020 . 2 . . . . 1321 GLN HB2 . 17364 1 599 . 1 1 59 59 GLN HB3 H 1 1.821 0.020 . 2 . . . . 1321 GLN HB3 . 17364 1 600 . 1 1 59 59 GLN HG2 H 1 2.388 0.020 . 2 . . . . 1321 GLN HG2 . 17364 1 601 . 1 1 59 59 GLN HG3 H 1 2.348 0.020 . 2 . . . . 1321 GLN HG3 . 17364 1 602 . 1 1 59 59 GLN HE21 H 1 7.544 0.020 . 2 . . . . 1321 GLN HE21 . 17364 1 603 . 1 1 59 59 GLN HE22 H 1 6.846 0.020 . 2 . . . . 1321 GLN HE22 . 17364 1 604 . 1 1 59 59 GLN CA C 13 56.692 0.400 . 1 . . . . 1321 GLN CA . 17364 1 605 . 1 1 59 59 GLN CB C 13 29.468 0.400 . 1 . . . . 1321 GLN CB . 17364 1 606 . 1 1 59 59 GLN CG C 13 34.625 0.400 . 1 . . . . 1321 GLN CG . 17364 1 607 . 1 1 59 59 GLN N N 15 110.521 0.400 . 1 . . . . 1321 GLN N . 17364 1 608 . 1 1 59 59 GLN NE2 N 15 112.816 0.400 . 1 . . . . 1321 GLN NE2 . 17364 1 609 . 1 1 60 60 GLY H H 1 8.044 0.020 . 1 . . . . 1322 GLY H . 17364 1 610 . 1 1 60 60 GLY HA2 H 1 5.104 0.020 . 2 . . . . 1322 GLY HA2 . 17364 1 611 . 1 1 60 60 GLY HA3 H 1 3.221 0.020 . 2 . . . . 1322 GLY HA3 . 17364 1 612 . 1 1 60 60 GLY CA C 13 44.178 0.400 . 1 . . . . 1322 GLY CA . 17364 1 613 . 1 1 60 60 GLY N N 15 108.192 0.400 . 1 . . . . 1322 GLY N . 17364 1 614 . 1 1 61 61 ILE H H 1 8.222 0.020 . 1 . . . . 1323 ILE H . 17364 1 615 . 1 1 61 61 ILE HA H 1 4.963 0.020 . 1 . . . . 1323 ILE HA . 17364 1 616 . 1 1 61 61 ILE HB H 1 0.985 0.020 . 1 . . . . 1323 ILE HB . 17364 1 617 . 1 1 61 61 ILE HG12 H 1 0.513 0.020 . 2 . . . . 1323 ILE HG12 . 17364 1 618 . 1 1 61 61 ILE HG13 H 1 1.153 0.020 . 2 . . . . 1323 ILE HG13 . 17364 1 619 . 1 1 61 61 ILE HG21 H 1 -0.109 0.020 . 1 . . . . 1323 ILE QG2 . 17364 1 620 . 1 1 61 61 ILE HG22 H 1 -0.109 0.020 . 1 . . . . 1323 ILE QG2 . 17364 1 621 . 1 1 61 61 ILE HG23 H 1 -0.109 0.020 . 1 . . . . 1323 ILE QG2 . 17364 1 622 . 1 1 61 61 ILE HD11 H 1 -0.252 0.020 . 1 . . . . 1323 ILE QD1 . 17364 1 623 . 1 1 61 61 ILE HD12 H 1 -0.252 0.020 . 1 . . . . 1323 ILE QD1 . 17364 1 624 . 1 1 61 61 ILE HD13 H 1 -0.252 0.020 . 1 . . . . 1323 ILE QD1 . 17364 1 625 . 1 1 61 61 ILE CA C 13 59.967 0.400 . 1 . . . . 1323 ILE CA . 17364 1 626 . 1 1 61 61 ILE CB C 13 40.721 0.400 . 1 . . . . 1323 ILE CB . 17364 1 627 . 1 1 61 61 ILE CG1 C 13 27.951 0.400 . 1 . . . . 1323 ILE CG1 . 17364 1 628 . 1 1 61 61 ILE CG2 C 13 16.105 0.400 . 1 . . . . 1323 ILE CG2 . 17364 1 629 . 1 1 61 61 ILE CD1 C 13 12.249 0.400 . 1 . . . . 1323 ILE CD1 . 17364 1 630 . 1 1 61 61 ILE N N 15 122.421 0.400 . 1 . . . . 1323 ILE N . 17364 1 631 . 1 1 62 62 THR H H 1 9.224 0.020 . 1 . . . . 1324 THR H . 17364 1 632 . 1 1 62 62 THR HA H 1 5.181 0.020 . 1 . . . . 1324 THR HA . 17364 1 633 . 1 1 62 62 THR HB H 1 3.743 0.020 . 1 . . . . 1324 THR HB . 17364 1 634 . 1 1 62 62 THR HG21 H 1 1.090 0.020 . 1 . . . . 1324 THR HG2 . 17364 1 635 . 1 1 62 62 THR HG22 H 1 1.090 0.020 . 1 . . . . 1324 THR HG2 . 17364 1 636 . 1 1 62 62 THR HG23 H 1 1.090 0.020 . 1 . . . . 1324 THR HG2 . 17364 1 637 . 1 1 62 62 THR CA C 13 61.395 0.400 . 1 . . . . 1324 THR CA . 17364 1 638 . 1 1 62 62 THR CB C 13 71.072 0.400 . 1 . . . . 1324 THR CB . 17364 1 639 . 1 1 62 62 THR CG2 C 13 22.342 0.400 . 1 . . . . 1324 THR CG2 . 17364 1 640 . 1 1 62 62 THR N N 15 123.711 0.400 . 1 . . . . 1324 THR N . 17364 1 641 . 1 1 63 63 LEU H H 1 9.535 0.020 . 1 . . . . 1325 LEU H . 17364 1 642 . 1 1 63 63 LEU HA H 1 5.682 0.020 . 1 . . . . 1325 LEU HA . 17364 1 643 . 1 1 63 63 LEU HB2 H 1 1.954 0.020 . 2 . . . . 1325 LEU HB2 . 17364 1 644 . 1 1 63 63 LEU HB3 H 1 1.345 0.020 . 2 . . . . 1325 LEU HB3 . 17364 1 645 . 1 1 63 63 LEU HG H 1 1.676 0.020 . 1 . . . . 1325 LEU HG . 17364 1 646 . 1 1 63 63 LEU HD11 H 1 0.960 0.020 . 2 . . . . 1325 LEU HD1 . 17364 1 647 . 1 1 63 63 LEU HD12 H 1 0.960 0.020 . 2 . . . . 1325 LEU HD1 . 17364 1 648 . 1 1 63 63 LEU HD13 H 1 0.960 0.020 . 2 . . . . 1325 LEU HD1 . 17364 1 649 . 1 1 63 63 LEU HD21 H 1 0.634 0.020 . 2 . . . . 1325 LEU HD2 . 17364 1 650 . 1 1 63 63 LEU HD22 H 1 0.634 0.020 . 2 . . . . 1325 LEU HD2 . 17364 1 651 . 1 1 63 63 LEU HD23 H 1 0.634 0.020 . 2 . . . . 1325 LEU HD2 . 17364 1 652 . 1 1 63 63 LEU CA C 13 52.393 0.400 . 1 . . . . 1325 LEU CA . 17364 1 653 . 1 1 63 63 LEU CB C 13 44.812 0.400 . 1 . . . . 1325 LEU CB . 17364 1 654 . 1 1 63 63 LEU CG C 13 27.215 0.400 . 1 . . . . 1325 LEU CG . 17364 1 655 . 1 1 63 63 LEU CD1 C 13 26.701 0.400 . 2 . . . . 1325 LEU CD1 . 17364 1 656 . 1 1 63 63 LEU CD2 C 13 24.926 0.400 . 2 . . . . 1325 LEU CD2 . 17364 1 657 . 1 1 63 63 LEU N N 15 127.874 0.400 . 1 . . . . 1325 LEU N . 17364 1 658 . 1 1 64 64 THR H H 1 9.132 0.020 . 1 . . . . 1326 THR H . 17364 1 659 . 1 1 64 64 THR HA H 1 5.270 0.020 . 1 . . . . 1326 THR HA . 17364 1 660 . 1 1 64 64 THR HB H 1 4.103 0.020 . 1 . . . . 1326 THR HB . 17364 1 661 . 1 1 64 64 THR HG21 H 1 0.998 0.020 . 1 . . . . 1326 THR HG2 . 17364 1 662 . 1 1 64 64 THR HG22 H 1 0.998 0.020 . 1 . . . . 1326 THR HG2 . 17364 1 663 . 1 1 64 64 THR HG23 H 1 0.998 0.020 . 1 . . . . 1326 THR HG2 . 17364 1 664 . 1 1 64 64 THR CA C 13 61.531 0.400 . 1 . . . . 1326 THR CA . 17364 1 665 . 1 1 64 64 THR CB C 13 71.402 0.400 . 1 . . . . 1326 THR CB . 17364 1 666 . 1 1 64 64 THR CG2 C 13 21.462 0.400 . 1 . . . . 1326 THR CG2 . 17364 1 667 . 1 1 64 64 THR N N 15 117.696 0.400 . 1 . . . . 1326 THR N . 17364 1 668 . 1 1 65 65 ASP HA H 1 4.939 0.020 . 1 . . . . 1327 ASP HA . 17364 1 669 . 1 1 65 65 ASP HB2 H 1 3.138 0.020 . 2 . . . . 1327 ASP HB2 . 17364 1 670 . 1 1 65 65 ASP HB3 H 1 3.138 0.020 . 2 . . . . 1327 ASP HB3 . 17364 1 671 . 1 1 65 65 ASP CA C 13 52.425 0.400 . 1 . . . . 1327 ASP CA . 17364 1 672 . 1 1 65 65 ASP CB C 13 40.555 0.400 . 1 . . . . 1327 ASP CB . 17364 1 673 . 1 1 66 66 ASN H H 1 8.830 0.020 . 1 . . . . 1328 ASN H . 17364 1 674 . 1 1 66 66 ASN HA H 1 4.597 0.020 . 1 . . . . 1328 ASN HA . 17364 1 675 . 1 1 66 66 ASN HB2 H 1 2.808 0.020 . 2 . . . . 1328 ASN HB2 . 17364 1 676 . 1 1 66 66 ASN HB3 H 1 2.851 0.020 . 2 . . . . 1328 ASN HB3 . 17364 1 677 . 1 1 66 66 ASN CA C 13 55.947 0.400 . 1 . . . . 1328 ASN CA . 17364 1 678 . 1 1 66 66 ASN CB C 13 38.610 0.400 . 1 . . . . 1328 ASN CB . 17364 1 679 . 1 1 66 66 ASN N N 15 123.333 0.400 . 1 . . . . 1328 ASN N . 17364 1 680 . 1 1 67 67 GLN H H 1 8.599 0.020 . 1 . . . . 1329 GLN H . 17364 1 681 . 1 1 67 67 GLN HA H 1 4.318 0.020 . 1 . . . . 1329 GLN HA . 17364 1 682 . 1 1 67 67 GLN HB2 H 1 2.209 0.020 . 2 . . . . 1329 GLN QB . 17364 1 683 . 1 1 67 67 GLN HB3 H 1 2.209 0.020 . 2 . . . . 1329 GLN QB . 17364 1 684 . 1 1 67 67 GLN HG2 H 1 2.466 0.020 . 2 . . . . 1329 GLN HG2 . 17364 1 685 . 1 1 67 67 GLN HG3 H 1 2.376 0.020 . 2 . . . . 1329 GLN HG3 . 17364 1 686 . 1 1 67 67 GLN HE21 H 1 7.692 0.020 . 2 . . . . 1329 GLN HE21 . 17364 1 687 . 1 1 67 67 GLN HE22 H 1 6.896 0.020 . 2 . . . . 1329 GLN HE22 . 17364 1 688 . 1 1 67 67 GLN CA C 13 56.004 0.400 . 1 . . . . 1329 GLN CA . 17364 1 689 . 1 1 67 67 GLN CB C 13 29.066 0.400 . 1 . . . . 1329 GLN CB . 17364 1 690 . 1 1 67 67 GLN CG C 13 34.581 0.400 . 1 . . . . 1329 GLN CG . 17364 1 691 . 1 1 67 67 GLN N N 15 116.553 0.400 . 1 . . . . 1329 GLN N . 17364 1 692 . 1 1 67 67 GLN NE2 N 15 112.620 0.400 . 1 . . . . 1329 GLN NE2 . 17364 1 693 . 1 1 68 68 ARG H H 1 7.989 0.020 . 1 . . . . 1330 ARG H . 17364 1 694 . 1 1 68 68 ARG HA H 1 4.178 0.020 . 1 . . . . 1330 ARG HA . 17364 1 695 . 1 1 68 68 ARG HB2 H 1 1.768 0.020 . 2 . . . . 1330 ARG HB2 . 17364 1 696 . 1 1 68 68 ARG HB3 H 1 1.768 0.020 . 2 . . . . 1330 ARG HB3 . 17364 1 697 . 1 1 68 68 ARG HG2 H 1 1.495 0.020 . 2 . . . . 1330 ARG QG . 17364 1 698 . 1 1 68 68 ARG HG3 H 1 1.495 0.020 . 2 . . . . 1330 ARG QG . 17364 1 699 . 1 1 68 68 ARG HD2 H 1 3.024 0.020 . 2 . . . . 1330 ARG HD2 . 17364 1 700 . 1 1 68 68 ARG HD3 H 1 2.966 0.020 . 2 . . . . 1330 ARG HD3 . 17364 1 701 . 1 1 68 68 ARG CA C 13 56.025 0.400 . 1 . . . . 1330 ARG CA . 17364 1 702 . 1 1 68 68 ARG CB C 13 27.581 0.400 . 1 . . . . 1330 ARG CB . 17364 1 703 . 1 1 68 68 ARG CG C 13 28.189 0.400 . 1 . . . . 1330 ARG CG . 17364 1 704 . 1 1 68 68 ARG CD C 13 43.575 0.400 . 1 . . . . 1330 ARG CD . 17364 1 705 . 1 1 68 68 ARG N N 15 117.613 0.400 . 1 . . . . 1330 ARG N . 17364 1 706 . 1 1 69 69 LYS H H 1 8.300 0.020 . 1 . . . . 1331 LYS H . 17364 1 707 . 1 1 69 69 LYS HA H 1 4.013 0.020 . 1 . . . . 1331 LYS HA . 17364 1 708 . 1 1 69 69 LYS HB2 H 1 1.778 0.020 . 2 . . . . 1331 LYS QB . 17364 1 709 . 1 1 69 69 LYS HB3 H 1 1.778 0.020 . 2 . . . . 1331 LYS QB . 17364 1 710 . 1 1 69 69 LYS HG2 H 1 1.456 0.020 . 2 . . . . 1331 LYS HG2 . 17364 1 711 . 1 1 69 69 LYS HG3 H 1 1.356 0.020 . 2 . . . . 1331 LYS HG3 . 17364 1 712 . 1 1 69 69 LYS HD2 H 1 1.695 0.020 . 2 . . . . 1331 LYS QD . 17364 1 713 . 1 1 69 69 LYS HD3 H 1 1.695 0.020 . 2 . . . . 1331 LYS QD . 17364 1 714 . 1 1 69 69 LYS HE2 H 1 2.979 0.020 . 2 . . . . 1331 LYS HE2 . 17364 1 715 . 1 1 69 69 LYS HE3 H 1 2.980 0.020 . 2 . . . . 1331 LYS HE3 . 17364 1 716 . 1 1 69 69 LYS CA C 13 59.184 0.400 . 1 . . . . 1331 LYS CA . 17364 1 717 . 1 1 69 69 LYS CB C 13 32.323 0.400 . 1 . . . . 1331 LYS CB . 17364 1 718 . 1 1 69 69 LYS CG C 13 24.915 0.400 . 1 . . . . 1331 LYS CG . 17364 1 719 . 1 1 69 69 LYS CD C 13 28.831 0.400 . 1 . . . . 1331 LYS CD . 17364 1 720 . 1 1 69 69 LYS CE C 13 41.825 0.400 . 1 . . . . 1331 LYS CE . 17364 1 721 . 1 1 69 69 LYS N N 15 120.451 0.400 . 1 . . . . 1331 LYS N . 17364 1 722 . 1 1 70 70 LEU HA H 1 4.446 0.020 . 1 . . . . 1332 LEU HA . 17364 1 723 . 1 1 70 70 LEU HB2 H 1 1.577 0.020 . 2 . . . . 1332 LEU QB . 17364 1 724 . 1 1 70 70 LEU HB3 H 1 1.577 0.020 . 2 . . . . 1332 LEU QB . 17364 1 725 . 1 1 70 70 LEU HG H 1 1.504 0.020 . 1 . . . . 1332 LEU HG . 17364 1 726 . 1 1 70 70 LEU HD11 H 1 1.055 0.020 . 2 . . . . 1332 LEU HD1 . 17364 1 727 . 1 1 70 70 LEU HD12 H 1 1.055 0.020 . 2 . . . . 1332 LEU HD1 . 17364 1 728 . 1 1 70 70 LEU HD13 H 1 1.055 0.020 . 2 . . . . 1332 LEU HD1 . 17364 1 729 . 1 1 70 70 LEU HD21 H 1 0.967 0.020 . 2 . . . . 1332 LEU QD2 . 17364 1 730 . 1 1 70 70 LEU HD22 H 1 0.967 0.020 . 2 . . . . 1332 LEU QD2 . 17364 1 731 . 1 1 70 70 LEU HD23 H 1 0.967 0.020 . 2 . . . . 1332 LEU QD2 . 17364 1 732 . 1 1 70 70 LEU CA C 13 55.297 0.400 . 1 . . . . 1332 LEU CA . 17364 1 733 . 1 1 70 70 LEU CB C 13 44.577 0.400 . 1 . . . . 1332 LEU CB . 17364 1 734 . 1 1 70 70 LEU CG C 13 27.215 0.400 . 1 . . . . 1332 LEU CG . 17364 1 735 . 1 1 70 70 LEU CD1 C 13 25.674 0.400 . 2 . . . . 1332 LEU CD1 . 17364 1 736 . 1 1 70 70 LEU CD2 C 13 23.155 0.400 . 2 . . . . 1332 LEU CD2 . 17364 1 737 . 1 1 71 71 PHE H H 1 7.835 0.020 . 1 . . . . 1333 PHE H . 17364 1 738 . 1 1 71 71 PHE HA H 1 4.635 0.020 . 1 . . . . 1333 PHE HA . 17364 1 739 . 1 1 71 71 PHE HB2 H 1 3.266 0.020 . 2 . . . . 1333 PHE HB2 . 17364 1 740 . 1 1 71 71 PHE HB3 H 1 3.007 0.020 . 2 . . . . 1333 PHE HB3 . 17364 1 741 . 1 1 71 71 PHE HD1 H 1 6.768 0.020 . 3 . . . . 1333 PHE QD . 17364 1 742 . 1 1 71 71 PHE HD2 H 1 6.768 0.020 . 3 . . . . 1333 PHE QD . 17364 1 743 . 1 1 71 71 PHE HE1 H 1 6.704 0.020 . 3 . . . . 1333 PHE QE . 17364 1 744 . 1 1 71 71 PHE HE2 H 1 6.704 0.020 . 3 . . . . 1333 PHE QE . 17364 1 745 . 1 1 71 71 PHE HZ H 1 6.626 0.020 . 1 . . . . 1333 PHE HZ . 17364 1 746 . 1 1 71 71 PHE CA C 13 55.871 0.400 . 1 . . . . 1333 PHE CA . 17364 1 747 . 1 1 71 71 PHE CB C 13 38.927 0.400 . 1 . . . . 1333 PHE CB . 17364 1 748 . 1 1 71 71 PHE CD2 C 13 132.953 0.400 . 3 . . . . 1333 PHE CD2 . 17364 1 749 . 1 1 71 71 PHE CE2 C 13 130.205 0.400 . 3 . . . . 1333 PHE CE2 . 17364 1 750 . 1 1 71 71 PHE CZ C 13 128.701 0.400 . 1 . . . . 1333 PHE CZ . 17364 1 751 . 1 1 71 71 PHE N N 15 115.910 0.400 . 1 . . . . 1333 PHE N . 17364 1 752 . 1 1 72 72 PHE HA H 1 5.529 0.020 . 1 . . . . 1334 PHE HA . 17364 1 753 . 1 1 72 72 PHE HB2 H 1 3.176 0.020 . 2 . . . . 1334 PHE HB2 . 17364 1 754 . 1 1 72 72 PHE HB3 H 1 3.176 0.020 . 2 . . . . 1334 PHE HB3 . 17364 1 755 . 1 1 72 72 PHE HD1 H 1 7.351 0.020 . 3 . . . . 1334 PHE QD . 17364 1 756 . 1 1 72 72 PHE HD2 H 1 7.351 0.020 . 3 . . . . 1334 PHE QD . 17364 1 757 . 1 1 72 72 PHE HE1 H 1 7.285 0.020 . 3 . . . . 1334 PHE QE . 17364 1 758 . 1 1 72 72 PHE HE2 H 1 7.285 0.020 . 3 . . . . 1334 PHE QE . 17364 1 759 . 1 1 72 72 PHE HZ H 1 7.213 0.020 . 1 . . . . 1334 PHE HZ . 17364 1 760 . 1 1 72 72 PHE CA C 13 57.046 0.400 . 1 . . . . 1334 PHE CA . 17364 1 761 . 1 1 72 72 PHE CB C 13 38.981 0.400 . 1 . . . . 1334 PHE CB . 17364 1 762 . 1 1 72 72 PHE CD2 C 13 131.392 0.400 . 3 . . . . 1334 PHE CD2 . 17364 1 763 . 1 1 72 72 PHE CE1 C 13 131.318 0.400 . 3 . . . . 1334 PHE CE1 . 17364 1 764 . 1 1 72 72 PHE CZ C 13 129.724 0.400 . 1 . . . . 1334 PHE CZ . 17364 1 765 . 1 1 73 73 ARG H H 1 7.882 0.020 . 1 . . . . 1335 ARG H . 17364 1 766 . 1 1 73 73 ARG HA H 1 5.516 0.020 . 1 . . . . 1335 ARG HA . 17364 1 767 . 1 1 73 73 ARG HB2 H 1 1.165 0.020 . 2 . . . . 1335 ARG HB2 . 17364 1 768 . 1 1 73 73 ARG HB3 H 1 1.355 0.020 . 2 . . . . 1335 ARG HB3 . 17364 1 769 . 1 1 73 73 ARG HG2 H 1 0.964 0.020 . 2 . . . . 1335 ARG HG2 . 17364 1 770 . 1 1 73 73 ARG HG3 H 1 1.167 0.020 . 2 . . . . 1335 ARG HG3 . 17364 1 771 . 1 1 73 73 ARG HD2 H 1 2.837 0.020 . 2 . . . . 1335 ARG HD2 . 17364 1 772 . 1 1 73 73 ARG HD3 H 1 2.837 0.020 . 2 . . . . 1335 ARG HD3 . 17364 1 773 . 1 1 73 73 ARG CA C 13 54.463 0.400 . 1 . . . . 1335 ARG CA . 17364 1 774 . 1 1 73 73 ARG CB C 13 33.528 0.400 . 1 . . . . 1335 ARG CB . 17364 1 775 . 1 1 73 73 ARG CG C 13 27.123 0.400 . 1 . . . . 1335 ARG CG . 17364 1 776 . 1 1 73 73 ARG CD C 13 43.636 0.400 . 1 . . . . 1335 ARG CD . 17364 1 777 . 1 1 73 73 ARG N N 15 118.824 0.400 . 1 . . . . 1335 ARG N . 17364 1 778 . 1 1 74 74 ARG H H 1 8.859 0.020 . 1 . . . . 1336 ARG H . 17364 1 779 . 1 1 74 74 ARG HB2 H 1 1.331 0.020 . 2 . . . . 1336 ARG QB . 17364 1 780 . 1 1 74 74 ARG HB3 H 1 1.331 0.020 . 2 . . . . 1336 ARG QB . 17364 1 781 . 1 1 74 74 ARG HG2 H 1 1.157 0.020 . 2 . . . . 1336 ARG HG2 . 17364 1 782 . 1 1 74 74 ARG HG3 H 1 0.798 0.020 . 2 . . . . 1336 ARG HG3 . 17364 1 783 . 1 1 74 74 ARG HD2 H 1 2.613 0.020 . 2 . . . . 1336 ARG HD2 . 17364 1 784 . 1 1 74 74 ARG HD3 H 1 2.613 0.020 . 2 . . . . 1336 ARG HD3 . 17364 1 785 . 1 1 74 74 ARG CB C 13 34.853 0.400 . 1 . . . . 1336 ARG CB . 17364 1 786 . 1 1 74 74 ARG CG C 13 27.123 0.400 . 1 . . . . 1336 ARG CG . 17364 1 787 . 1 1 74 74 ARG CD C 13 43.499 0.400 . 1 . . . . 1336 ARG CD . 17364 1 788 . 1 1 74 74 ARG N N 15 124.626 0.400 . 1 . . . . 1336 ARG N . 17364 1 789 . 1 1 75 75 HIS H H 1 8.306 0.020 . 1 . . . . 1337 HIS H . 17364 1 790 . 1 1 75 75 HIS HA H 1 5.208 0.020 . 1 . . . . 1337 HIS HA . 17364 1 791 . 1 1 75 75 HIS HB2 H 1 2.762 0.020 . 2 . . . . 1337 HIS HB2 . 17364 1 792 . 1 1 75 75 HIS HB3 H 1 2.582 0.020 . 2 . . . . 1337 HIS HB3 . 17364 1 793 . 1 1 75 75 HIS HE1 H 1 6.943 0.020 . 1 . . . . 1337 HIS HE1 . 17364 1 794 . 1 1 75 75 HIS CA C 13 54.754 0.400 . 1 . . . . 1337 HIS CA . 17364 1 795 . 1 1 75 75 HIS CB C 13 32.998 0.400 . 1 . . . . 1337 HIS CB . 17364 1 796 . 1 1 75 75 HIS CE1 C 13 136.898 0.400 . 1 . . . . 1337 HIS CE1 . 17364 1 797 . 1 1 75 75 HIS N N 15 121.978 0.400 . 1 . . . . 1337 HIS N . 17364 1 798 . 1 1 76 76 TYR H H 1 8.588 0.020 . 1 . . . . 1338 TYR H . 17364 1 799 . 1 1 76 76 TYR HA H 1 4.523 0.020 . 1 . . . . 1338 TYR HA . 17364 1 800 . 1 1 76 76 TYR HB2 H 1 2.558 0.020 . 2 . . . . 1338 TYR HB2 . 17364 1 801 . 1 1 76 76 TYR HB3 H 1 2.558 0.020 . 2 . . . . 1338 TYR HB3 . 17364 1 802 . 1 1 76 76 TYR HD1 H 1 6.909 0.020 . 3 . . . . 1338 TYR QD . 17364 1 803 . 1 1 76 76 TYR HD2 H 1 6.909 0.020 . 3 . . . . 1338 TYR QD . 17364 1 804 . 1 1 76 76 TYR HE1 H 1 6.309 0.020 . 3 . . . . 1338 TYR QE . 17364 1 805 . 1 1 76 76 TYR HE2 H 1 6.309 0.020 . 3 . . . . 1338 TYR QE . 17364 1 806 . 1 1 76 76 TYR CA C 13 54.264 0.400 . 1 . . . . 1338 TYR CA . 17364 1 807 . 1 1 76 76 TYR CB C 13 38.800 0.400 . 1 . . . . 1338 TYR CB . 17364 1 808 . 1 1 76 76 TYR CD1 C 13 133.178 0.400 . 3 . . . . 1338 TYR CD1 . 17364 1 809 . 1 1 76 76 TYR CE1 C 13 117.312 0.400 . 3 . . . . 1338 TYR CE1 . 17364 1 810 . 1 1 76 76 TYR N N 15 126.460 0.400 . 1 . . . . 1338 TYR N . 17364 1 811 . 1 1 77 77 PRO HA H 1 4.659 0.020 . 1 . . . . 1339 PRO HA . 17364 1 812 . 1 1 77 77 PRO HB2 H 1 2.586 0.020 . 2 . . . . 1339 PRO HB2 . 17364 1 813 . 1 1 77 77 PRO HB3 H 1 2.091 0.020 . 2 . . . . 1339 PRO HB3 . 17364 1 814 . 1 1 77 77 PRO HG2 H 1 2.118 0.020 . 2 . . . . 1339 PRO HG2 . 17364 1 815 . 1 1 77 77 PRO HG3 H 1 2.076 0.020 . 2 . . . . 1339 PRO HG3 . 17364 1 816 . 1 1 77 77 PRO HD2 H 1 3.702 0.020 . 2 . . . . 1339 PRO HD2 . 17364 1 817 . 1 1 77 77 PRO HD3 H 1 3.597 0.020 . 2 . . . . 1339 PRO HD3 . 17364 1 818 . 1 1 77 77 PRO CA C 13 62.024 0.400 . 1 . . . . 1339 PRO CA . 17364 1 819 . 1 1 77 77 PRO CB C 13 32.471 0.400 . 1 . . . . 1339 PRO CB . 17364 1 820 . 1 1 77 77 PRO CG C 13 27.583 0.400 . 1 . . . . 1339 PRO CG . 17364 1 821 . 1 1 77 77 PRO CD C 13 51.410 0.400 . 1 . . . . 1339 PRO CD . 17364 1 822 . 1 1 78 78 VAL H H 1 8.286 0.020 . 1 . . . . 1340 VAL H . 17364 1 823 . 1 1 78 78 VAL HA H 1 3.730 0.020 . 1 . . . . 1340 VAL HA . 17364 1 824 . 1 1 78 78 VAL HB H 1 1.811 0.020 . 1 . . . . 1340 VAL HB . 17364 1 825 . 1 1 78 78 VAL HG11 H 1 1.054 0.020 . 2 . . . . 1340 VAL HG1 . 17364 1 826 . 1 1 78 78 VAL HG12 H 1 1.054 0.020 . 2 . . . . 1340 VAL HG1 . 17364 1 827 . 1 1 78 78 VAL HG13 H 1 1.054 0.020 . 2 . . . . 1340 VAL HG1 . 17364 1 828 . 1 1 78 78 VAL HG21 H 1 0.958 0.020 . 2 . . . . 1340 VAL QG2 . 17364 1 829 . 1 1 78 78 VAL HG22 H 1 0.958 0.020 . 2 . . . . 1340 VAL QG2 . 17364 1 830 . 1 1 78 78 VAL HG23 H 1 0.958 0.020 . 2 . . . . 1340 VAL QG2 . 17364 1 831 . 1 1 78 78 VAL CA C 13 65.971 0.400 . 1 . . . . 1340 VAL CA . 17364 1 832 . 1 1 78 78 VAL CB C 13 31.740 0.400 . 1 . . . . 1340 VAL CB . 17364 1 833 . 1 1 78 78 VAL CG1 C 13 19.197 0.400 . 2 . . . . 1340 VAL CG1 . 17364 1 834 . 1 1 78 78 VAL CG2 C 13 22.753 0.400 . 2 . . . . 1340 VAL CG2 . 17364 1 835 . 1 1 78 78 VAL N N 15 123.527 0.400 . 1 . . . . 1340 VAL N . 17364 1 836 . 1 1 79 79 ASN H H 1 8.409 0.020 . 1 . . . . 1341 ASN H . 17364 1 837 . 1 1 79 79 ASN HA H 1 4.569 0.020 . 1 . . . . 1341 ASN HA . 17364 1 838 . 1 1 79 79 ASN HB2 H 1 2.949 0.020 . 2 . . . . 1341 ASN HB2 . 17364 1 839 . 1 1 79 79 ASN HB3 H 1 2.849 0.020 . 2 . . . . 1341 ASN HB3 . 17364 1 840 . 1 1 79 79 ASN HD21 H 1 7.647 0.020 . 2 . . . . 1341 ASN HD21 . 17364 1 841 . 1 1 79 79 ASN HD22 H 1 6.869 0.020 . 2 . . . . 1341 ASN HD22 . 17364 1 842 . 1 1 79 79 ASN CA C 13 54.997 0.400 . 1 . . . . 1341 ASN CA . 17364 1 843 . 1 1 79 79 ASN CB C 13 37.435 0.400 . 1 . . . . 1341 ASN CB . 17364 1 844 . 1 1 79 79 ASN N N 15 116.368 0.400 . 1 . . . . 1341 ASN N . 17364 1 845 . 1 1 79 79 ASN ND2 N 15 111.769 0.400 . 1 . . . . 1341 ASN ND2 . 17364 1 846 . 1 1 80 80 SER H H 1 8.336 0.020 . 1 . . . . 1342 SER H . 17364 1 847 . 1 1 80 80 SER HA H 1 4.547 0.020 . 1 . . . . 1342 SER HA . 17364 1 848 . 1 1 80 80 SER HB2 H 1 4.247 0.020 . 2 . . . . 1342 SER HB2 . 17364 1 849 . 1 1 80 80 SER HB3 H 1 4.071 0.020 . 2 . . . . 1342 SER HB3 . 17364 1 850 . 1 1 80 80 SER CA C 13 59.111 0.400 . 1 . . . . 1342 SER CA . 17364 1 851 . 1 1 80 80 SER CB C 13 65.793 0.400 . 1 . . . . 1342 SER CB . 17364 1 852 . 1 1 80 80 SER N N 15 114.101 0.400 . 1 . . . . 1342 SER N . 17364 1 853 . 1 1 81 81 ILE H H 1 7.468 0.020 . 1 . . . . 1343 ILE H . 17364 1 854 . 1 1 81 81 ILE HA H 1 4.659 0.020 . 1 . . . . 1343 ILE HA . 17364 1 855 . 1 1 81 81 ILE HB H 1 1.884 0.020 . 1 . . . . 1343 ILE HB . 17364 1 856 . 1 1 81 81 ILE HG12 H 1 0.829 0.020 . 2 . . . . 1343 ILE HG12 . 17364 1 857 . 1 1 81 81 ILE HG13 H 1 1.826 0.020 . 2 . . . . 1343 ILE HG13 . 17364 1 858 . 1 1 81 81 ILE HG21 H 1 0.941 0.020 . 1 . . . . 1343 ILE QG2 . 17364 1 859 . 1 1 81 81 ILE HG22 H 1 0.941 0.020 . 1 . . . . 1343 ILE QG2 . 17364 1 860 . 1 1 81 81 ILE HG23 H 1 0.941 0.020 . 1 . . . . 1343 ILE QG2 . 17364 1 861 . 1 1 81 81 ILE HD11 H 1 0.562 0.020 . 1 . . . . 1343 ILE QD1 . 17364 1 862 . 1 1 81 81 ILE HD12 H 1 0.562 0.020 . 1 . . . . 1343 ILE QD1 . 17364 1 863 . 1 1 81 81 ILE HD13 H 1 0.562 0.020 . 1 . . . . 1343 ILE QD1 . 17364 1 864 . 1 1 81 81 ILE CA C 13 61.638 0.400 . 1 . . . . 1343 ILE CA . 17364 1 865 . 1 1 81 81 ILE CB C 13 38.941 0.400 . 1 . . . . 1343 ILE CB . 17364 1 866 . 1 1 81 81 ILE CG1 C 13 27.433 0.400 . 1 . . . . 1343 ILE CG1 . 17364 1 867 . 1 1 81 81 ILE CG2 C 13 17.502 0.400 . 1 . . . . 1343 ILE CG2 . 17364 1 868 . 1 1 81 81 ILE CD1 C 13 14.505 0.400 . 1 . . . . 1343 ILE CD1 . 17364 1 869 . 1 1 81 81 ILE N N 15 123.801 0.400 . 1 . . . . 1343 ILE N . 17364 1 870 . 1 1 82 82 THR H H 1 8.868 0.020 . 1 . . . . 1344 THR H . 17364 1 871 . 1 1 82 82 THR HA H 1 4.730 0.020 . 1 . . . . 1344 THR HA . 17364 1 872 . 1 1 82 82 THR HB H 1 4.331 0.020 . 1 . . . . 1344 THR HB . 17364 1 873 . 1 1 82 82 THR HG21 H 1 1.195 0.020 . 1 . . . . 1344 THR HG2 . 17364 1 874 . 1 1 82 82 THR HG22 H 1 1.195 0.020 . 1 . . . . 1344 THR HG2 . 17364 1 875 . 1 1 82 82 THR HG23 H 1 1.195 0.020 . 1 . . . . 1344 THR HG2 . 17364 1 876 . 1 1 82 82 THR CA C 13 61.616 0.400 . 1 . . . . 1344 THR CA . 17364 1 877 . 1 1 82 82 THR CB C 13 70.707 0.400 . 1 . . . . 1344 THR CB . 17364 1 878 . 1 1 82 82 THR CG2 C 13 22.072 0.400 . 1 . . . . 1344 THR CG2 . 17364 1 879 . 1 1 82 82 THR N N 15 113.360 0.400 . 1 . . . . 1344 THR N . 17364 1 880 . 1 1 83 83 PHE H H 1 7.435 0.020 . 1 . . . . 1345 PHE H . 17364 1 881 . 1 1 83 83 PHE HA H 1 4.611 0.020 . 1 . . . . 1345 PHE HA . 17364 1 882 . 1 1 83 83 PHE HB2 H 1 2.328 0.020 . 2 . . . . 1345 PHE HB2 . 17364 1 883 . 1 1 83 83 PHE HB3 H 1 3.727 0.020 . 2 . . . . 1345 PHE HB3 . 17364 1 884 . 1 1 83 83 PHE HD1 H 1 7.104 0.020 . 3 . . . . 1345 PHE QD . 17364 1 885 . 1 1 83 83 PHE HD2 H 1 7.104 0.020 . 3 . . . . 1345 PHE QD . 17364 1 886 . 1 1 83 83 PHE HE1 H 1 7.470 0.020 . 3 . . . . 1345 PHE QE . 17364 1 887 . 1 1 83 83 PHE HE2 H 1 7.470 0.020 . 3 . . . . 1345 PHE QE . 17364 1 888 . 1 1 83 83 PHE HZ H 1 7.416 0.020 . 1 . . . . 1345 PHE HZ . 17364 1 889 . 1 1 83 83 PHE CA C 13 59.464 0.400 . 1 . . . . 1345 PHE CA . 17364 1 890 . 1 1 83 83 PHE CB C 13 43.189 0.400 . 1 . . . . 1345 PHE CB . 17364 1 891 . 1 1 83 83 PHE CD1 C 13 131.409 0.400 . 3 . . . . 1345 PHE CD1 . 17364 1 892 . 1 1 83 83 PHE CE2 C 13 131.874 0.400 . 3 . . . . 1345 PHE CE2 . 17364 1 893 . 1 1 83 83 PHE CZ C 13 130.733 0.400 . 1 . . . . 1345 PHE CZ . 17364 1 894 . 1 1 83 83 PHE N N 15 119.766 0.400 . 1 . . . . 1345 PHE N . 17364 1 895 . 1 1 84 84 SER H H 1 7.366 0.020 . 1 . . . . 1346 SER H . 17364 1 896 . 1 1 84 84 SER HA H 1 4.914 0.020 . 1 . . . . 1346 SER HA . 17364 1 897 . 1 1 84 84 SER HB2 H 1 3.264 0.020 . 2 . . . . 1346 SER HB2 . 17364 1 898 . 1 1 84 84 SER HB3 H 1 3.825 0.020 . 2 . . . . 1346 SER HB3 . 17364 1 899 . 1 1 84 84 SER CA C 13 57.900 0.400 . 1 . . . . 1346 SER CA . 17364 1 900 . 1 1 84 84 SER CB C 13 66.161 0.400 . 1 . . . . 1346 SER CB . 17364 1 901 . 1 1 84 84 SER N N 15 120.019 0.400 . 1 . . . . 1346 SER N . 17364 1 902 . 1 1 85 85 SER H H 1 8.012 0.020 . 1 . . . . 1347 SER H . 17364 1 903 . 1 1 85 85 SER HA H 1 4.603 0.020 . 1 . . . . 1347 SER HA . 17364 1 904 . 1 1 85 85 SER HB2 H 1 4.288 0.020 . 2 . . . . 1347 SER HB2 . 17364 1 905 . 1 1 85 85 SER HB3 H 1 3.947 0.020 . 2 . . . . 1347 SER HB3 . 17364 1 906 . 1 1 85 85 SER CA C 13 59.302 0.400 . 1 . . . . 1347 SER CA . 17364 1 907 . 1 1 85 85 SER CB C 13 66.072 0.400 . 1 . . . . 1347 SER CB . 17364 1 908 . 1 1 85 85 SER N N 15 115.193 0.400 . 1 . . . . 1347 SER N . 17364 1 909 . 1 1 86 86 THR H H 1 8.432 0.020 . 1 . . . . 1348 THR H . 17364 1 910 . 1 1 86 86 THR HA H 1 4.974 0.020 . 1 . . . . 1348 THR HA . 17364 1 911 . 1 1 86 86 THR HB H 1 4.700 0.020 . 1 . . . . 1348 THR HB . 17364 1 912 . 1 1 86 86 THR HG21 H 1 1.223 0.020 . 1 . . . . 1348 THR HG2 . 17364 1 913 . 1 1 86 86 THR HG22 H 1 1.223 0.020 . 1 . . . . 1348 THR HG2 . 17364 1 914 . 1 1 86 86 THR HG23 H 1 1.223 0.020 . 1 . . . . 1348 THR HG2 . 17364 1 915 . 1 1 86 86 THR CA C 13 62.002 0.400 . 1 . . . . 1348 THR CA . 17364 1 916 . 1 1 86 86 THR CB C 13 69.485 0.400 . 1 . . . . 1348 THR CB . 17364 1 917 . 1 1 86 86 THR CG2 C 13 22.745 0.400 . 1 . . . . 1348 THR CG2 . 17364 1 918 . 1 1 86 86 THR N N 15 109.934 0.400 . 1 . . . . 1348 THR N . 17364 1 919 . 1 1 87 87 ASP H H 1 7.950 0.020 . 1 . . . . 1349 ASP H . 17364 1 920 . 1 1 87 87 ASP HA H 1 4.509 0.020 . 1 . . . . 1349 ASP HA . 17364 1 921 . 1 1 87 87 ASP HB2 H 1 2.818 0.020 . 2 . . . . 1349 ASP HB2 . 17364 1 922 . 1 1 87 87 ASP HB3 H 1 2.672 0.020 . 2 . . . . 1349 ASP HB3 . 17364 1 923 . 1 1 87 87 ASP CA C 13 53.617 0.400 . 1 . . . . 1349 ASP CA . 17364 1 924 . 1 1 87 87 ASP CB C 13 42.688 0.400 . 1 . . . . 1349 ASP CB . 17364 1 925 . 1 1 87 87 ASP N N 15 122.456 0.400 . 1 . . . . 1349 ASP N . 17364 1 926 . 1 1 88 88 PRO HA H 1 4.510 0.020 . 1 . . . . 1350 PRO HA . 17364 1 927 . 1 1 88 88 PRO HB2 H 1 2.461 0.020 . 2 . . . . 1350 PRO HB2 . 17364 1 928 . 1 1 88 88 PRO HB3 H 1 1.952 0.020 . 2 . . . . 1350 PRO HB3 . 17364 1 929 . 1 1 88 88 PRO HG2 H 1 2.186 0.020 . 2 . . . . 1350 PRO HG2 . 17364 1 930 . 1 1 88 88 PRO HG3 H 1 2.116 0.020 . 2 . . . . 1350 PRO HG3 . 17364 1 931 . 1 1 88 88 PRO HD2 H 1 4.018 0.020 . 2 . . . . 1350 PRO HD2 . 17364 1 932 . 1 1 88 88 PRO HD3 H 1 3.831 0.020 . 2 . . . . 1350 PRO HD3 . 17364 1 933 . 1 1 88 88 PRO CA C 13 64.946 0.400 . 1 . . . . 1350 PRO CA . 17364 1 934 . 1 1 88 88 PRO CB C 13 32.267 0.400 . 1 . . . . 1350 PRO CB . 17364 1 935 . 1 1 88 88 PRO CG C 13 27.894 0.400 . 1 . . . . 1350 PRO CG . 17364 1 936 . 1 1 88 88 PRO CD C 13 51.786 0.400 . 1 . . . . 1350 PRO CD . 17364 1 937 . 1 1 89 89 GLN H H 1 7.422 0.020 . 1 . . . . 1351 GLN H . 17364 1 938 . 1 1 89 89 GLN HA H 1 4.392 0.020 . 1 . . . . 1351 GLN HA . 17364 1 939 . 1 1 89 89 GLN HB2 H 1 2.376 0.020 . 2 . . . . 1351 GLN HB2 . 17364 1 940 . 1 1 89 89 GLN HB3 H 1 1.917 0.020 . 2 . . . . 1351 GLN HB3 . 17364 1 941 . 1 1 89 89 GLN HG2 H 1 2.389 0.020 . 2 . . . . 1351 GLN HG2 . 17364 1 942 . 1 1 89 89 GLN HG3 H 1 2.194 0.020 . 2 . . . . 1351 GLN HG3 . 17364 1 943 . 1 1 89 89 GLN HE21 H 1 6.689 0.020 . 2 . . . . 1351 GLN HE21 . 17364 1 944 . 1 1 89 89 GLN HE22 H 1 7.395 0.020 . 2 . . . . 1351 GLN HE22 . 17364 1 945 . 1 1 89 89 GLN CA C 13 55.478 0.400 . 1 . . . . 1351 GLN CA . 17364 1 946 . 1 1 89 89 GLN CB C 13 28.658 0.400 . 1 . . . . 1351 GLN CB . 17364 1 947 . 1 1 89 89 GLN CG C 13 34.869 0.400 . 1 . . . . 1351 GLN CG . 17364 1 948 . 1 1 89 89 GLN N N 15 114.480 0.400 . 1 . . . . 1351 GLN N . 17364 1 949 . 1 1 89 89 GLN NE2 N 15 110.170 0.400 . 1 . . . . 1351 GLN NE2 . 17364 1 950 . 1 1 90 90 ASP H H 1 8.334 0.020 . 1 . . . . 1352 ASP H . 17364 1 951 . 1 1 90 90 ASP HA H 1 4.504 0.020 . 1 . . . . 1352 ASP HA . 17364 1 952 . 1 1 90 90 ASP HB2 H 1 3.105 0.020 . 2 . . . . 1352 ASP HB2 . 17364 1 953 . 1 1 90 90 ASP HB3 H 1 2.429 0.020 . 2 . . . . 1352 ASP HB3 . 17364 1 954 . 1 1 90 90 ASP CA C 13 55.225 0.400 . 1 . . . . 1352 ASP CA . 17364 1 955 . 1 1 90 90 ASP CB C 13 40.041 0.400 . 1 . . . . 1352 ASP CB . 17364 1 956 . 1 1 90 90 ASP N N 15 117.947 0.400 . 1 . . . . 1352 ASP N . 17364 1 957 . 1 1 91 91 ARG H H 1 8.737 0.020 . 1 . . . . 1353 ARG H . 17364 1 958 . 1 1 91 91 ARG HA H 1 4.243 0.020 . 1 . . . . 1353 ARG HA . 17364 1 959 . 1 1 91 91 ARG HB2 H 1 1.770 0.020 . 2 . . . . 1353 ARG QB . 17364 1 960 . 1 1 91 91 ARG HB3 H 1 1.770 0.020 . 2 . . . . 1353 ARG QB . 17364 1 961 . 1 1 91 91 ARG HG2 H 1 1.498 0.020 . 2 . . . . 1353 ARG HG2 . 17364 1 962 . 1 1 91 91 ARG HG3 H 1 1.499 0.020 . 2 . . . . 1353 ARG HG3 . 17364 1 963 . 1 1 91 91 ARG HD2 H 1 2.886 0.020 . 2 . . . . 1353 ARG HD2 . 17364 1 964 . 1 1 91 91 ARG HD3 H 1 3.135 0.020 . 2 . . . . 1353 ARG HD3 . 17364 1 965 . 1 1 91 91 ARG CA C 13 57.058 0.400 . 1 . . . . 1353 ARG CA . 17364 1 966 . 1 1 91 91 ARG CB C 13 30.400 0.400 . 1 . . . . 1353 ARG CB . 17364 1 967 . 1 1 91 91 ARG CG C 13 27.404 0.400 . 1 . . . . 1353 ARG CG . 17364 1 968 . 1 1 91 91 ARG CD C 13 43.261 0.400 . 1 . . . . 1353 ARG CD . 17364 1 969 . 1 1 91 91 ARG N N 15 117.662 0.400 . 1 . . . . 1353 ARG N . 17364 1 970 . 1 1 92 92 ARG H H 1 8.299 0.020 . 1 . . . . 1354 ARG H . 17364 1 971 . 1 1 92 92 ARG HA H 1 5.009 0.020 . 1 . . . . 1354 ARG HA . 17364 1 972 . 1 1 92 92 ARG HB2 H 1 1.571 0.020 . 2 . . . . 1354 ARG HB2 . 17364 1 973 . 1 1 92 92 ARG HB3 H 1 1.726 0.020 . 2 . . . . 1354 ARG HB3 . 17364 1 974 . 1 1 92 92 ARG HG2 H 1 1.447 0.020 . 2 . . . . 1354 ARG HG2 . 17364 1 975 . 1 1 92 92 ARG HG3 H 1 1.677 0.020 . 2 . . . . 1354 ARG HG3 . 17364 1 976 . 1 1 92 92 ARG HD2 H 1 3.066 0.020 . 2 . . . . 1354 ARG HD2 . 17364 1 977 . 1 1 92 92 ARG HD3 H 1 3.066 0.020 . 2 . . . . 1354 ARG HD3 . 17364 1 978 . 1 1 92 92 ARG CA C 13 53.516 0.400 . 1 . . . . 1354 ARG CA . 17364 1 979 . 1 1 92 92 ARG CB C 13 33.544 0.400 . 1 . . . . 1354 ARG CB . 17364 1 980 . 1 1 92 92 ARG CG C 13 27.498 0.400 . 1 . . . . 1354 ARG CG . 17364 1 981 . 1 1 92 92 ARG CD C 13 43.061 0.400 . 1 . . . . 1354 ARG CD . 17364 1 982 . 1 1 92 92 ARG N N 15 117.046 0.400 . 1 . . . . 1354 ARG N . 17364 1 983 . 1 1 93 93 TRP H H 1 9.427 0.020 . 1 . . . . 1355 TRP H . 17364 1 984 . 1 1 93 93 TRP HA H 1 4.480 0.020 . 1 . . . . 1355 TRP HA . 17364 1 985 . 1 1 93 93 TRP HB2 H 1 2.908 0.020 . 2 . . . . 1355 TRP HB2 . 17364 1 986 . 1 1 93 93 TRP HB3 H 1 2.952 0.020 . 2 . . . . 1355 TRP HB3 . 17364 1 987 . 1 1 93 93 TRP HD1 H 1 6.977 0.020 . 1 . . . . 1355 TRP HD1 . 17364 1 988 . 1 1 93 93 TRP HE1 H 1 10.050 0.020 . 1 . . . . 1355 TRP HE1 . 17364 1 989 . 1 1 93 93 TRP HE3 H 1 7.257 0.020 . 1 . . . . 1355 TRP HE3 . 17364 1 990 . 1 1 93 93 TRP HZ2 H 1 7.391 0.020 . 1 . . . . 1355 TRP HZ2 . 17364 1 991 . 1 1 93 93 TRP HZ3 H 1 6.783 0.020 . 1 . . . . 1355 TRP HZ3 . 17364 1 992 . 1 1 93 93 TRP HH2 H 1 7.124 0.020 . 1 . . . . 1355 TRP HH2 . 17364 1 993 . 1 1 93 93 TRP CA C 13 55.914 0.400 . 1 . . . . 1355 TRP CA . 17364 1 994 . 1 1 93 93 TRP CB C 13 31.445 0.400 . 1 . . . . 1355 TRP CB . 17364 1 995 . 1 1 93 93 TRP CD1 C 13 128.044 0.400 . 1 . . . . 1355 TRP CD1 . 17364 1 996 . 1 1 93 93 TRP CE3 C 13 120.089 0.400 . 1 . . . . 1355 TRP CE3 . 17364 1 997 . 1 1 93 93 TRP CZ2 C 13 114.842 0.400 . 1 . . . . 1355 TRP CZ2 . 17364 1 998 . 1 1 93 93 TRP CZ3 C 13 120.057 0.400 . 1 . . . . 1355 TRP CZ3 . 17364 1 999 . 1 1 93 93 TRP CH2 C 13 123.829 0.400 . 1 . . . . 1355 TRP CH2 . 17364 1 1000 . 1 1 93 93 TRP N N 15 122.907 0.400 . 1 . . . . 1355 TRP N . 17364 1 1001 . 1 1 93 93 TRP NE1 N 15 130.648 0.400 . 1 . . . . 1355 TRP NE1 . 17364 1 1002 . 1 1 94 94 THR H H 1 7.045 0.020 . 1 . . . . 1356 THR H . 17364 1 1003 . 1 1 94 94 THR HA H 1 4.366 0.020 . 1 . . . . 1356 THR HA . 17364 1 1004 . 1 1 94 94 THR HB H 1 3.542 0.020 . 1 . . . . 1356 THR HB . 17364 1 1005 . 1 1 94 94 THR HG21 H 1 1.078 0.020 . 1 . . . . 1356 THR HG2 . 17364 1 1006 . 1 1 94 94 THR HG22 H 1 1.078 0.020 . 1 . . . . 1356 THR HG2 . 17364 1 1007 . 1 1 94 94 THR HG23 H 1 1.078 0.020 . 1 . . . . 1356 THR HG2 . 17364 1 1008 . 1 1 94 94 THR CA C 13 62.632 0.400 . 1 . . . . 1356 THR CA . 17364 1 1009 . 1 1 94 94 THR CB C 13 68.540 0.400 . 1 . . . . 1356 THR CB . 17364 1 1010 . 1 1 94 94 THR CG2 C 13 21.120 0.400 . 1 . . . . 1356 THR CG2 . 17364 1 1011 . 1 1 94 94 THR N N 15 122.939 0.400 . 1 . . . . 1356 THR N . 17364 1 1012 . 1 1 95 95 ASN H H 1 8.890 0.020 . 1 . . . . 1357 ASN H . 17364 1 1013 . 1 1 95 95 ASN HA H 1 5.003 0.020 . 1 . . . . 1357 ASN HA . 17364 1 1014 . 1 1 95 95 ASN HB2 H 1 2.825 0.020 . 2 . . . . 1357 ASN HB2 . 17364 1 1015 . 1 1 95 95 ASN HB3 H 1 2.717 0.020 . 2 . . . . 1357 ASN HB3 . 17364 1 1016 . 1 1 95 95 ASN CA C 13 52.741 0.400 . 1 . . . . 1357 ASN CA . 17364 1 1017 . 1 1 95 95 ASN CB C 13 38.182 0.400 . 1 . . . . 1357 ASN CB . 17364 1 1018 . 1 1 95 95 ASN N N 15 125.948 0.400 . 1 . . . . 1357 ASN N . 17364 1 1019 . 1 1 96 96 PRO HA H 1 4.329 0.020 . 1 . . . . 1358 PRO HA . 17364 1 1020 . 1 1 96 96 PRO HB2 H 1 2.428 0.020 . 2 . . . . 1358 PRO HB2 . 17364 1 1021 . 1 1 96 96 PRO HB3 H 1 1.943 0.020 . 2 . . . . 1358 PRO HB3 . 17364 1 1022 . 1 1 96 96 PRO HG2 H 1 2.177 0.020 . 2 . . . . 1358 PRO HG2 . 17364 1 1023 . 1 1 96 96 PRO HG3 H 1 2.057 0.020 . 2 . . . . 1358 PRO HG3 . 17364 1 1024 . 1 1 96 96 PRO HD2 H 1 3.848 0.020 . 2 . . . . 1358 PRO HD2 . 17364 1 1025 . 1 1 96 96 PRO HD3 H 1 4.149 0.020 . 2 . . . . 1358 PRO HD3 . 17364 1 1026 . 1 1 96 96 PRO CA C 13 65.501 0.400 . 1 . . . . 1358 PRO CA . 17364 1 1027 . 1 1 96 96 PRO CB C 13 31.775 0.400 . 1 . . . . 1358 PRO CB . 17364 1 1028 . 1 1 96 96 PRO CG C 13 27.859 0.400 . 1 . . . . 1358 PRO CG . 17364 1 1029 . 1 1 96 96 PRO CD C 13 50.907 0.400 . 1 . . . . 1358 PRO CD . 17364 1 1030 . 1 1 97 97 ASP H H 1 7.506 0.020 . 1 . . . . 1359 ASP H . 17364 1 1031 . 1 1 97 97 ASP HA H 1 4.511 0.020 . 1 . . . . 1359 ASP HA . 17364 1 1032 . 1 1 97 97 ASP HB2 H 1 3.099 0.020 . 2 . . . . 1359 ASP HB2 . 17364 1 1033 . 1 1 97 97 ASP HB3 H 1 2.633 0.020 . 2 . . . . 1359 ASP HB3 . 17364 1 1034 . 1 1 97 97 ASP CA C 13 53.029 0.400 . 1 . . . . 1359 ASP CA . 17364 1 1035 . 1 1 97 97 ASP CB C 13 40.040 0.400 . 1 . . . . 1359 ASP CB . 17364 1 1036 . 1 1 97 97 ASP N N 15 113.378 0.400 . 1 . . . . 1359 ASP N . 17364 1 1037 . 1 1 98 98 GLY H H 1 8.265 0.020 . 1 . . . . 1360 GLY H . 17364 1 1038 . 1 1 98 98 GLY HA2 H 1 4.336 0.020 . 2 . . . . 1360 GLY HA2 . 17364 1 1039 . 1 1 98 98 GLY HA3 H 1 3.535 0.020 . 2 . . . . 1360 GLY HA3 . 17364 1 1040 . 1 1 98 98 GLY CA C 13 45.332 0.400 . 1 . . . . 1360 GLY CA . 17364 1 1041 . 1 1 98 98 GLY N N 15 108.668 0.400 . 1 . . . . 1360 GLY N . 17364 1 1042 . 1 1 99 99 THR H H 1 8.028 0.020 . 1 . . . . 1361 THR H . 17364 1 1043 . 1 1 99 99 THR HA H 1 4.469 0.020 . 1 . . . . 1361 THR HA . 17364 1 1044 . 1 1 99 99 THR HB H 1 4.479 0.020 . 1 . . . . 1361 THR HB . 17364 1 1045 . 1 1 99 99 THR HG21 H 1 1.257 0.020 . 1 . . . . 1361 THR HG2 . 17364 1 1046 . 1 1 99 99 THR HG22 H 1 1.257 0.020 . 1 . . . . 1361 THR HG2 . 17364 1 1047 . 1 1 99 99 THR HG23 H 1 1.257 0.020 . 1 . . . . 1361 THR HG2 . 17364 1 1048 . 1 1 99 99 THR CA C 13 62.281 0.400 . 1 . . . . 1361 THR CA . 17364 1 1049 . 1 1 99 99 THR CB C 13 71.606 0.400 . 1 . . . . 1361 THR CB . 17364 1 1050 . 1 1 99 99 THR CG2 C 13 21.661 0.400 . 1 . . . . 1361 THR CG2 . 17364 1 1051 . 1 1 99 99 THR N N 15 112.646 0.400 . 1 . . . . 1361 THR N . 17364 1 1052 . 1 1 100 100 THR H H 1 8.389 0.020 . 1 . . . . 1362 THR H . 17364 1 1053 . 1 1 100 100 THR HA H 1 5.661 0.020 . 1 . . . . 1362 THR HA . 17364 1 1054 . 1 1 100 100 THR HB H 1 4.017 0.020 . 1 . . . . 1362 THR HB . 17364 1 1055 . 1 1 100 100 THR HG21 H 1 1.126 0.020 . 1 . . . . 1362 THR HG2 . 17364 1 1056 . 1 1 100 100 THR HG22 H 1 1.126 0.020 . 1 . . . . 1362 THR HG2 . 17364 1 1057 . 1 1 100 100 THR HG23 H 1 1.126 0.020 . 1 . . . . 1362 THR HG2 . 17364 1 1058 . 1 1 100 100 THR CA C 13 59.291 0.400 . 1 . . . . 1362 THR CA . 17364 1 1059 . 1 1 100 100 THR CB C 13 72.277 0.400 . 1 . . . . 1362 THR CB . 17364 1 1060 . 1 1 100 100 THR CG2 C 13 21.579 0.400 . 1 . . . . 1362 THR CG2 . 17364 1 1061 . 1 1 100 100 THR N N 15 108.550 0.400 . 1 . . . . 1362 THR N . 17364 1 1062 . 1 1 101 101 SER H H 1 9.162 0.020 . 1 . . . . 1363 SER H . 17364 1 1063 . 1 1 101 101 SER HA H 1 5.067 0.020 . 1 . . . . 1363 SER HA . 17364 1 1064 . 1 1 101 101 SER HB2 H 1 3.806 0.020 . 2 . . . . 1363 SER HB2 . 17364 1 1065 . 1 1 101 101 SER HB3 H 1 4.494 0.020 . 2 . . . . 1363 SER HB3 . 17364 1 1066 . 1 1 101 101 SER CA C 13 57.869 0.400 . 1 . . . . 1363 SER CA . 17364 1 1067 . 1 1 101 101 SER CB C 13 68.040 0.400 . 1 . . . . 1363 SER CB . 17364 1 1068 . 1 1 101 101 SER N N 15 117.866 0.400 . 1 . . . . 1363 SER N . 17364 1 1069 . 1 1 102 102 LYS H H 1 9.045 0.020 . 1 . . . . 1364 LYS H . 17364 1 1070 . 1 1 102 102 LYS HA H 1 4.238 0.020 . 1 . . . . 1364 LYS HA . 17364 1 1071 . 1 1 102 102 LYS HG2 H 1 1.426 0.020 . 2 . . . . 1364 LYS HG2 . 17364 1 1072 . 1 1 102 102 LYS HG3 H 1 1.713 0.020 . 2 . . . . 1364 LYS HG3 . 17364 1 1073 . 1 1 102 102 LYS HD2 H 1 1.756 0.020 . 2 . . . . 1364 LYS QD . 17364 1 1074 . 1 1 102 102 LYS HD3 H 1 1.756 0.020 . 2 . . . . 1364 LYS QD . 17364 1 1075 . 1 1 102 102 LYS HE2 H 1 3.061 0.020 . 2 . . . . 1364 LYS HE2 . 17364 1 1076 . 1 1 102 102 LYS HE3 H 1 3.061 0.020 . 2 . . . . 1364 LYS HE3 . 17364 1 1077 . 1 1 102 102 LYS CA C 13 58.530 0.400 . 1 . . . . 1364 LYS CA . 17364 1 1078 . 1 1 102 102 LYS CG C 13 25.852 0.400 . 1 . . . . 1364 LYS CG . 17364 1 1079 . 1 1 102 102 LYS CD C 13 29.681 0.400 . 1 . . . . 1364 LYS CD . 17364 1 1080 . 1 1 102 102 LYS CE C 13 41.810 0.400 . 1 . . . . 1364 LYS CE . 17364 1 1081 . 1 1 102 102 LYS N N 15 124.337 0.400 . 1 . . . . 1364 LYS N . 17364 1 1082 . 1 1 103 103 ILE H H 1 8.259 0.020 . 1 . . . . 1365 ILE H . 17364 1 1083 . 1 1 103 103 ILE HA H 1 5.017 0.020 . 1 . . . . 1365 ILE HA . 17364 1 1084 . 1 1 103 103 ILE HB H 1 1.603 0.020 . 1 . . . . 1365 ILE HB . 17364 1 1085 . 1 1 103 103 ILE HG12 H 1 2.004 0.020 . 2 . . . . 1365 ILE QG1 . 17364 1 1086 . 1 1 103 103 ILE HG13 H 1 2.004 0.020 . 2 . . . . 1365 ILE QG1 . 17364 1 1087 . 1 1 103 103 ILE HG21 H 1 0.891 0.020 . 1 . . . . 1365 ILE QG2 . 17364 1 1088 . 1 1 103 103 ILE HG22 H 1 0.891 0.020 . 1 . . . . 1365 ILE QG2 . 17364 1 1089 . 1 1 103 103 ILE HG23 H 1 0.891 0.020 . 1 . . . . 1365 ILE QG2 . 17364 1 1090 . 1 1 103 103 ILE HD11 H 1 0.816 0.020 . 1 . . . . 1365 ILE QD1 . 17364 1 1091 . 1 1 103 103 ILE HD12 H 1 0.816 0.020 . 1 . . . . 1365 ILE QD1 . 17364 1 1092 . 1 1 103 103 ILE HD13 H 1 0.816 0.020 . 1 . . . . 1365 ILE QD1 . 17364 1 1093 . 1 1 103 103 ILE CA C 13 60.557 0.400 . 1 . . . . 1365 ILE CA . 17364 1 1094 . 1 1 103 103 ILE CB C 13 41.091 0.400 . 1 . . . . 1365 ILE CB . 17364 1 1095 . 1 1 103 103 ILE CG1 C 13 29.258 0.400 . 1 . . . . 1365 ILE CG1 . 17364 1 1096 . 1 1 103 103 ILE CG2 C 13 18.009 0.400 . 1 . . . . 1365 ILE CG2 . 17364 1 1097 . 1 1 103 103 ILE CD1 C 13 13.796 0.400 . 1 . . . . 1365 ILE CD1 . 17364 1 1098 . 1 1 103 103 ILE N N 15 122.010 0.400 . 1 . . . . 1365 ILE N . 17364 1 1099 . 1 1 104 104 PHE H H 1 9.133 0.020 . 1 . . . . 1366 PHE H . 17364 1 1100 . 1 1 104 104 PHE HA H 1 5.113 0.020 . 1 . . . . 1366 PHE HA . 17364 1 1101 . 1 1 104 104 PHE HB2 H 1 2.704 0.020 . 2 . . . . 1366 PHE HB2 . 17364 1 1102 . 1 1 104 104 PHE HB3 H 1 2.776 0.020 . 2 . . . . 1366 PHE HB3 . 17364 1 1103 . 1 1 104 104 PHE HD1 H 1 6.768 0.020 . 3 . . . . 1366 PHE QD . 17364 1 1104 . 1 1 104 104 PHE HD2 H 1 6.768 0.020 . 3 . . . . 1366 PHE QD . 17364 1 1105 . 1 1 104 104 PHE HE1 H 1 6.470 0.020 . 3 . . . . 1366 PHE QE . 17364 1 1106 . 1 1 104 104 PHE HE2 H 1 6.470 0.020 . 3 . . . . 1366 PHE QE . 17364 1 1107 . 1 1 104 104 PHE HZ H 1 6.156 0.020 . 1 . . . . 1366 PHE HZ . 17364 1 1108 . 1 1 104 104 PHE CA C 13 55.411 0.400 . 1 . . . . 1366 PHE CA . 17364 1 1109 . 1 1 104 104 PHE CB C 13 42.681 0.400 . 1 . . . . 1366 PHE CB . 17364 1 1110 . 1 1 104 104 PHE CD1 C 13 131.751 0.400 . 3 . . . . 1366 PHE CD1 . 17364 1 1111 . 1 1 104 104 PHE CE1 C 13 130.046 0.400 . 3 . . . . 1366 PHE CE1 . 17364 1 1112 . 1 1 104 104 PHE CZ C 13 129.827 0.400 . 1 . . . . 1366 PHE CZ . 17364 1 1113 . 1 1 104 104 PHE N N 15 122.484 0.400 . 1 . . . . 1366 PHE N . 17364 1 1114 . 1 1 105 105 GLY H H 1 8.771 0.020 . 1 . . . . 1367 GLY H . 17364 1 1115 . 1 1 105 105 GLY HA2 H 1 5.599 0.020 . 2 . . . . 1367 GLY HA2 . 17364 1 1116 . 1 1 105 105 GLY HA3 H 1 3.716 0.020 . 2 . . . . 1367 GLY HA3 . 17364 1 1117 . 1 1 105 105 GLY CA C 13 45.680 0.400 . 1 . . . . 1367 GLY CA . 17364 1 1118 . 1 1 105 105 GLY N N 15 104.133 0.400 . 1 . . . . 1367 GLY N . 17364 1 1119 . 1 1 106 106 PHE H H 1 8.939 0.020 . 1 . . . . 1368 PHE H . 17364 1 1120 . 1 1 106 106 PHE HA H 1 5.778 0.020 . 1 . . . . 1368 PHE HA . 17364 1 1121 . 1 1 106 106 PHE HB2 H 1 3.429 0.020 . 2 . . . . 1368 PHE HB2 . 17364 1 1122 . 1 1 106 106 PHE HB3 H 1 2.958 0.020 . 2 . . . . 1368 PHE HB3 . 17364 1 1123 . 1 1 106 106 PHE HD1 H 1 7.042 0.020 . 3 . . . . 1368 PHE QD . 17364 1 1124 . 1 1 106 106 PHE HD2 H 1 7.042 0.020 . 3 . . . . 1368 PHE QD . 17364 1 1125 . 1 1 106 106 PHE HE1 H 1 6.727 0.020 . 3 . . . . 1368 PHE QE . 17364 1 1126 . 1 1 106 106 PHE HE2 H 1 6.727 0.020 . 3 . . . . 1368 PHE QE . 17364 1 1127 . 1 1 106 106 PHE HZ H 1 6.048 0.020 . 1 . . . . 1368 PHE HZ . 17364 1 1128 . 1 1 106 106 PHE CA C 13 56.568 0.400 . 1 . . . . 1368 PHE CA . 17364 1 1129 . 1 1 106 106 PHE CB C 13 42.577 0.400 . 1 . . . . 1368 PHE CB . 17364 1 1130 . 1 1 106 106 PHE CD2 C 13 131.513 0.400 . 3 . . . . 1368 PHE CD2 . 17364 1 1131 . 1 1 106 106 PHE CE1 C 13 131.681 0.400 . 3 . . . . 1368 PHE CE1 . 17364 1 1132 . 1 1 106 106 PHE CZ C 13 129.965 0.400 . 1 . . . . 1368 PHE CZ . 17364 1 1133 . 1 1 106 106 PHE N N 15 115.664 0.400 . 1 . . . . 1368 PHE N . 17364 1 1134 . 1 1 107 107 VAL H H 1 9.253 0.020 . 1 . . . . 1369 VAL H . 17364 1 1135 . 1 1 107 107 VAL HA H 1 4.795 0.020 . 1 . . . . 1369 VAL HA . 17364 1 1136 . 1 1 107 107 VAL HB H 1 2.171 0.020 . 1 . . . . 1369 VAL HB . 17364 1 1137 . 1 1 107 107 VAL HG11 H 1 0.882 0.020 . 2 . . . . 1369 VAL QG1 . 17364 1 1138 . 1 1 107 107 VAL HG12 H 1 0.882 0.020 . 2 . . . . 1369 VAL QG1 . 17364 1 1139 . 1 1 107 107 VAL HG13 H 1 0.882 0.020 . 2 . . . . 1369 VAL QG1 . 17364 1 1140 . 1 1 107 107 VAL HG21 H 1 0.839 0.020 . 2 . . . . 1369 VAL QG2 . 17364 1 1141 . 1 1 107 107 VAL HG22 H 1 0.839 0.020 . 2 . . . . 1369 VAL QG2 . 17364 1 1142 . 1 1 107 107 VAL HG23 H 1 0.839 0.020 . 2 . . . . 1369 VAL QG2 . 17364 1 1143 . 1 1 107 107 VAL CA C 13 61.021 0.400 . 1 . . . . 1369 VAL CA . 17364 1 1144 . 1 1 107 107 VAL CB C 13 32.860 0.400 . 1 . . . . 1369 VAL CB . 17364 1 1145 . 1 1 107 107 VAL CG1 C 13 22.231 0.400 . 2 . . . . 1369 VAL CG1 . 17364 1 1146 . 1 1 107 107 VAL CG2 C 13 22.090 0.400 . 2 . . . . 1369 VAL CG2 . 17364 1 1147 . 1 1 107 107 VAL N N 15 123.865 0.400 . 1 . . . . 1369 VAL N . 17364 1 1148 . 1 1 108 108 ALA H H 1 9.363 0.020 . 1 . . . . 1370 ALA H . 17364 1 1149 . 1 1 108 108 ALA HA H 1 5.845 0.020 . 1 . . . . 1370 ALA HA . 17364 1 1150 . 1 1 108 108 ALA HB1 H 1 1.571 0.020 . 1 . . . . 1370 ALA HB . 17364 1 1151 . 1 1 108 108 ALA HB2 H 1 1.571 0.020 . 1 . . . . 1370 ALA HB . 17364 1 1152 . 1 1 108 108 ALA HB3 H 1 1.571 0.020 . 1 . . . . 1370 ALA HB . 17364 1 1153 . 1 1 108 108 ALA CA C 13 49.664 0.400 . 1 . . . . 1370 ALA CA . 17364 1 1154 . 1 1 108 108 ALA CB C 13 23.526 0.400 . 1 . . . . 1370 ALA CB . 17364 1 1155 . 1 1 108 108 ALA N N 15 129.175 0.400 . 1 . . . . 1370 ALA N . 17364 1 1156 . 1 1 109 109 LYS H H 1 8.860 0.020 . 1 . . . . 1371 LYS H . 17364 1 1157 . 1 1 109 109 LYS HA H 1 4.641 0.020 . 1 . . . . 1371 LYS HA . 17364 1 1158 . 1 1 109 109 LYS HB2 H 1 1.666 0.020 . 2 . . . . 1371 LYS HB2 . 17364 1 1159 . 1 1 109 109 LYS HB3 H 1 1.896 0.020 . 2 . . . . 1371 LYS HB3 . 17364 1 1160 . 1 1 109 109 LYS HG2 H 1 1.636 0.020 . 2 . . . . 1371 LYS HG2 . 17364 1 1161 . 1 1 109 109 LYS HG3 H 1 1.636 0.020 . 2 . . . . 1371 LYS HG3 . 17364 1 1162 . 1 1 109 109 LYS HD2 H 1 1.786 0.020 . 2 . . . . 1371 LYS HD2 . 17364 1 1163 . 1 1 109 109 LYS HD3 H 1 1.656 0.020 . 2 . . . . 1371 LYS HD3 . 17364 1 1164 . 1 1 109 109 LYS HE2 H 1 2.990 0.020 . 2 . . . . 1371 LYS HE2 . 17364 1 1165 . 1 1 109 109 LYS HE3 H 1 2.936 0.020 . 2 . . . . 1371 LYS HE3 . 17364 1 1166 . 1 1 109 109 LYS CA C 13 56.151 0.400 . 1 . . . . 1371 LYS CA . 17364 1 1167 . 1 1 109 109 LYS CB C 13 33.611 0.400 . 1 . . . . 1371 LYS CB . 17364 1 1168 . 1 1 109 109 LYS CG C 13 25.390 0.400 . 1 . . . . 1371 LYS CG . 17364 1 1169 . 1 1 109 109 LYS CD C 13 29.141 0.400 . 1 . . . . 1371 LYS CD . 17364 1 1170 . 1 1 109 109 LYS CE C 13 42.245 0.400 . 1 . . . . 1371 LYS CE . 17364 1 1171 . 1 1 109 109 LYS N N 15 121.061 0.400 . 1 . . . . 1371 LYS N . 17364 1 1172 . 1 1 110 110 LYS H H 1 8.415 0.020 . 1 . . . . 1372 LYS H . 17364 1 1173 . 1 1 110 110 LYS HA H 1 4.327 0.020 . 1 . . . . 1372 LYS HA . 17364 1 1174 . 1 1 110 110 LYS HB3 H 1 1.326 0.020 . 2 . . . . 1372 LYS HB3 . 17364 1 1175 . 1 1 110 110 LYS HG2 H 1 1.305 0.020 . 2 . . . . 1372 LYS HG2 . 17364 1 1176 . 1 1 110 110 LYS HG3 H 1 1.248 0.020 . 2 . . . . 1372 LYS HG3 . 17364 1 1177 . 1 1 110 110 LYS HD2 H 1 1.467 0.020 . 2 . . . . 1372 LYS HD2 . 17364 1 1178 . 1 1 110 110 LYS HD3 H 1 1.541 0.020 . 2 . . . . 1372 LYS HD3 . 17364 1 1179 . 1 1 110 110 LYS HE2 H 1 2.782 0.020 . 2 . . . . 1372 LYS HE2 . 17364 1 1180 . 1 1 110 110 LYS HE3 H 1 2.864 0.020 . 2 . . . . 1372 LYS HE3 . 17364 1 1181 . 1 1 110 110 LYS CA C 13 54.742 0.400 . 1 . . . . 1372 LYS CA . 17364 1 1182 . 1 1 110 110 LYS CB C 13 33.691 0.400 . 1 . . . . 1372 LYS CB . 17364 1 1183 . 1 1 110 110 LYS CG C 13 24.913 0.400 . 1 . . . . 1372 LYS CG . 17364 1 1184 . 1 1 110 110 LYS CD C 13 29.944 0.400 . 1 . . . . 1372 LYS CD . 17364 1 1185 . 1 1 110 110 LYS CE C 13 41.841 0.400 . 1 . . . . 1372 LYS CE . 17364 1 1186 . 1 1 110 110 LYS N N 15 126.317 0.400 . 1 . . . . 1372 LYS N . 17364 1 1187 . 1 1 111 111 PRO HA H 1 4.273 0.020 . 1 . . . . 1373 PRO HA . 17364 1 1188 . 1 1 111 111 PRO HB2 H 1 2.295 0.020 . 2 . . . . 1373 PRO HB2 . 17364 1 1189 . 1 1 111 111 PRO HB3 H 1 1.892 0.020 . 2 . . . . 1373 PRO HB3 . 17364 1 1190 . 1 1 111 111 PRO HG2 H 1 2.158 0.020 . 2 . . . . 1373 PRO HG2 . 17364 1 1191 . 1 1 111 111 PRO HG3 H 1 2.053 0.020 . 2 . . . . 1373 PRO HG3 . 17364 1 1192 . 1 1 111 111 PRO HD2 H 1 3.683 0.020 . 2 . . . . 1373 PRO HD2 . 17364 1 1193 . 1 1 111 111 PRO HD3 H 1 4.159 0.020 . 2 . . . . 1373 PRO HD3 . 17364 1 1194 . 1 1 111 111 PRO CA C 13 64.354 0.400 . 1 . . . . 1373 PRO CA . 17364 1 1195 . 1 1 111 111 PRO CB C 13 31.355 0.400 . 1 . . . . 1373 PRO CB . 17364 1 1196 . 1 1 111 111 PRO CG C 13 27.811 0.400 . 1 . . . . 1373 PRO CG . 17364 1 1197 . 1 1 111 111 PRO CD C 13 51.183 0.400 . 1 . . . . 1373 PRO CD . 17364 1 1198 . 1 1 112 112 GLY HA2 H 1 4.127 0.020 . 2 . . . . 1374 GLY HA2 . 17364 1 1199 . 1 1 112 112 GLY HA3 H 1 3.752 0.020 . 2 . . . . 1374 GLY HA3 . 17364 1 1200 . 1 1 112 112 GLY CA C 13 45.579 0.400 . 1 . . . . 1374 GLY CA . 17364 1 1201 . 1 1 113 113 SER H H 1 7.512 0.020 . 1 . . . . 1375 SER H . 17364 1 1202 . 1 1 113 113 SER HA H 1 4.290 0.020 . 1 . . . . 1375 SER HA . 17364 1 1203 . 1 1 113 113 SER HB2 H 1 3.205 0.020 . 2 . . . . 1375 SER HB2 . 17364 1 1204 . 1 1 113 113 SER HB3 H 1 3.279 0.020 . 2 . . . . 1375 SER HB3 . 17364 1 1205 . 1 1 113 113 SER CA C 13 54.074 0.400 . 1 . . . . 1375 SER CA . 17364 1 1206 . 1 1 113 113 SER CB C 13 63.791 0.400 . 1 . . . . 1375 SER CB . 17364 1 1207 . 1 1 113 113 SER N N 15 113.724 0.400 . 1 . . . . 1375 SER N . 17364 1 1208 . 1 1 114 114 PRO HA H 1 4.359 0.020 . 1 . . . . 1376 PRO HA . 17364 1 1209 . 1 1 114 114 PRO HB2 H 1 2.193 0.020 . 2 . . . . 1376 PRO HB2 . 17364 1 1210 . 1 1 114 114 PRO HB3 H 1 1.838 0.020 . 2 . . . . 1376 PRO HB3 . 17364 1 1211 . 1 1 114 114 PRO HG2 H 1 1.938 0.020 . 2 . . . . 1376 PRO HG2 . 17364 1 1212 . 1 1 114 114 PRO HG3 H 1 1.860 0.020 . 2 . . . . 1376 PRO HG3 . 17364 1 1213 . 1 1 114 114 PRO HD2 H 1 3.531 0.020 . 2 . . . . 1376 PRO HD2 . 17364 1 1214 . 1 1 114 114 PRO HD3 H 1 3.405 0.020 . 2 . . . . 1376 PRO HD3 . 17364 1 1215 . 1 1 114 114 PRO CA C 13 64.545 0.400 . 1 . . . . 1376 PRO CA . 17364 1 1216 . 1 1 114 114 PRO CB C 13 31.814 0.400 . 1 . . . . 1376 PRO CB . 17364 1 1217 . 1 1 114 114 PRO CG C 13 26.993 0.400 . 1 . . . . 1376 PRO CG . 17364 1 1218 . 1 1 114 114 PRO CD C 13 50.438 0.400 . 1 . . . . 1376 PRO CD . 17364 1 1219 . 1 1 115 115 TRP H H 1 7.189 0.020 . 1 . . . . 1377 TRP H . 17364 1 1220 . 1 1 115 115 TRP HA H 1 4.752 0.020 . 1 . . . . 1377 TRP HA . 17364 1 1221 . 1 1 115 115 TRP HB2 H 1 3.329 0.020 . 2 . . . . 1377 TRP HB2 . 17364 1 1222 . 1 1 115 115 TRP HB3 H 1 3.329 0.020 . 2 . . . . 1377 TRP HB3 . 17364 1 1223 . 1 1 115 115 TRP HD1 H 1 7.185 0.020 . 1 . . . . 1377 TRP HD1 . 17364 1 1224 . 1 1 115 115 TRP HE1 H 1 10.343 0.020 . 1 . . . . 1377 TRP HE1 . 17364 1 1225 . 1 1 115 115 TRP HE3 H 1 7.642 0.020 . 1 . . . . 1377 TRP HE3 . 17364 1 1226 . 1 1 115 115 TRP HZ2 H 1 7.556 0.020 . 1 . . . . 1377 TRP HZ2 . 17364 1 1227 . 1 1 115 115 TRP HZ3 H 1 7.224 0.020 . 1 . . . . 1377 TRP HZ3 . 17364 1 1228 . 1 1 115 115 TRP HH2 H 1 7.331 0.020 . 1 . . . . 1377 TRP HH2 . 17364 1 1229 . 1 1 115 115 TRP CA C 13 57.206 0.400 . 1 . . . . 1377 TRP CA . 17364 1 1230 . 1 1 115 115 TRP CB C 13 28.591 0.400 . 1 . . . . 1377 TRP CB . 17364 1 1231 . 1 1 115 115 TRP CD1 C 13 127.276 0.400 . 1 . . . . 1377 TRP CD1 . 17364 1 1232 . 1 1 115 115 TRP CE3 C 13 120.379 0.400 . 1 . . . . 1377 TRP CE3 . 17364 1 1233 . 1 1 115 115 TRP CZ2 C 13 115.123 0.400 . 1 . . . . 1377 TRP CZ2 . 17364 1 1234 . 1 1 115 115 TRP CZ3 C 13 122.323 0.400 . 1 . . . . 1377 TRP CZ3 . 17364 1 1235 . 1 1 115 115 TRP CH2 C 13 125.012 0.400 . 1 . . . . 1377 TRP CH2 . 17364 1 1236 . 1 1 115 115 TRP N N 15 115.699 0.400 . 1 . . . . 1377 TRP N . 17364 1 1237 . 1 1 115 115 TRP NE1 N 15 130.880 0.400 . 1 . . . . 1377 TRP NE1 . 17364 1 1238 . 1 1 116 116 GLU H H 1 7.935 0.020 . 1 . . . . 1378 GLU H . 17364 1 1239 . 1 1 116 116 GLU HA H 1 4.280 0.020 . 1 . . . . 1378 GLU HA . 17364 1 1240 . 1 1 116 116 GLU HB2 H 1 1.880 0.020 . 2 . . . . 1378 GLU HB2 . 17364 1 1241 . 1 1 116 116 GLU HB3 H 1 1.733 0.020 . 2 . . . . 1378 GLU HB3 . 17364 1 1242 . 1 1 116 116 GLU HG2 H 1 1.745 0.020 . 2 . . . . 1378 GLU HG2 . 17364 1 1243 . 1 1 116 116 GLU HG3 H 1 1.643 0.020 . 2 . . . . 1378 GLU HG3 . 17364 1 1244 . 1 1 116 116 GLU CA C 13 55.814 0.400 . 1 . . . . 1378 GLU CA . 17364 1 1245 . 1 1 116 116 GLU CB C 13 32.018 0.400 . 1 . . . . 1378 GLU CB . 17364 1 1246 . 1 1 116 116 GLU CG C 13 36.667 0.400 . 1 . . . . 1378 GLU CG . 17364 1 1247 . 1 1 116 116 GLU N N 15 122.421 0.400 . 1 . . . . 1378 GLU N . 17364 1 1248 . 1 1 117 117 ASN H H 1 8.334 0.020 . 1 . . . . 1379 ASN H . 17364 1 1249 . 1 1 117 117 ASN HA H 1 5.213 0.020 . 1 . . . . 1379 ASN HA . 17364 1 1250 . 1 1 117 117 ASN HB2 H 1 2.585 0.020 . 2 . . . . 1379 ASN HB2 . 17364 1 1251 . 1 1 117 117 ASN HB3 H 1 2.108 0.020 . 2 . . . . 1379 ASN HB3 . 17364 1 1252 . 1 1 117 117 ASN HD21 H 1 6.905 0.020 . 2 . . . . 1379 ASN HD21 . 17364 1 1253 . 1 1 117 117 ASN HD22 H 1 6.675 0.020 . 2 . . . . 1379 ASN HD22 . 17364 1 1254 . 1 1 117 117 ASN CA C 13 52.728 0.400 . 1 . . . . 1379 ASN CA . 17364 1 1255 . 1 1 117 117 ASN CB C 13 42.686 0.400 . 1 . . . . 1379 ASN CB . 17364 1 1256 . 1 1 117 117 ASN N N 15 118.708 0.400 . 1 . . . . 1379 ASN N . 17364 1 1257 . 1 1 117 117 ASN ND2 N 15 113.719 0.400 . 1 . . . . 1379 ASN ND2 . 17364 1 1258 . 1 1 118 118 VAL H H 1 9.049 0.020 . 1 . . . . 1380 VAL H . 17364 1 1259 . 1 1 118 118 VAL HA H 1 4.304 0.020 . 1 . . . . 1380 VAL HA . 17364 1 1260 . 1 1 118 118 VAL HB H 1 1.820 0.020 . 1 . . . . 1380 VAL HB . 17364 1 1261 . 1 1 118 118 VAL HG11 H 1 0.821 0.020 . 2 . . . . 1380 VAL QG1 . 17364 1 1262 . 1 1 118 118 VAL HG12 H 1 0.821 0.020 . 2 . . . . 1380 VAL QG1 . 17364 1 1263 . 1 1 118 118 VAL HG13 H 1 0.821 0.020 . 2 . . . . 1380 VAL QG1 . 17364 1 1264 . 1 1 118 118 VAL HG21 H 1 0.303 0.020 . 2 . . . . 1380 VAL QG2 . 17364 1 1265 . 1 1 118 118 VAL HG22 H 1 0.303 0.020 . 2 . . . . 1380 VAL QG2 . 17364 1 1266 . 1 1 118 118 VAL HG23 H 1 0.303 0.020 . 2 . . . . 1380 VAL QG2 . 17364 1 1267 . 1 1 118 118 VAL CA C 13 60.902 0.400 . 1 . . . . 1380 VAL CA . 17364 1 1268 . 1 1 118 118 VAL CB C 13 35.051 0.400 . 1 . . . . 1380 VAL CB . 17364 1 1269 . 1 1 118 118 VAL CG1 C 13 21.200 0.400 . 2 . . . . 1380 VAL CG1 . 17364 1 1270 . 1 1 118 118 VAL CG2 C 13 21.511 0.400 . 2 . . . . 1380 VAL CG2 . 17364 1 1271 . 1 1 118 118 VAL N N 15 120.861 0.400 . 1 . . . . 1380 VAL N . 17364 1 1272 . 1 1 119 119 CYS H H 1 8.990 0.020 . 1 . . . . 1381 CYS H . 17364 1 1273 . 1 1 119 119 CYS HA H 1 4.860 0.020 . 1 . . . . 1381 CYS HA . 17364 1 1274 . 1 1 119 119 CYS HB2 H 1 2.539 0.020 . 2 . . . . 1381 CYS HB2 . 17364 1 1275 . 1 1 119 119 CYS HB3 H 1 2.244 0.020 . 2 . . . . 1381 CYS HB3 . 17364 1 1276 . 1 1 119 119 CYS CA C 13 56.320 0.400 . 1 . . . . 1381 CYS CA . 17364 1 1277 . 1 1 119 119 CYS CB C 13 28.983 0.400 . 1 . . . . 1381 CYS CB . 17364 1 1278 . 1 1 119 119 CYS N N 15 124.912 0.400 . 1 . . . . 1381 CYS N . 17364 1 1279 . 1 1 120 120 HIS H H 1 8.558 0.020 . 1 . . . . 1382 HIS H . 17364 1 1280 . 1 1 120 120 HIS HA H 1 4.479 0.020 . 1 . . . . 1382 HIS HA . 17364 1 1281 . 1 1 120 120 HIS HB2 H 1 1.636 0.020 . 2 . . . . 1382 HIS HB2 . 17364 1 1282 . 1 1 120 120 HIS HB3 H 1 2.281 0.020 . 2 . . . . 1382 HIS HB3 . 17364 1 1283 . 1 1 120 120 HIS HD2 H 1 5.865 0.020 . 1 . . . . 1382 HIS HD2 . 17364 1 1284 . 1 1 120 120 HIS HE1 H 1 7.716 0.020 . 1 . . . . 1382 HIS HE1 . 17364 1 1285 . 1 1 120 120 HIS CA C 13 55.771 0.400 . 1 . . . . 1382 HIS CA . 17364 1 1286 . 1 1 120 120 HIS CB C 13 31.487 0.400 . 1 . . . . 1382 HIS CB . 17364 1 1287 . 1 1 120 120 HIS CD2 C 13 118.484 0.400 . 1 . . . . 1382 HIS CD2 . 17364 1 1288 . 1 1 120 120 HIS CE1 C 13 139.263 0.400 . 1 . . . . 1382 HIS CE1 . 17364 1 1289 . 1 1 120 120 HIS N N 15 132.581 0.400 . 1 . . . . 1382 HIS N . 17364 1 1290 . 1 1 121 121 LEU H H 1 8.599 0.020 . 1 . . . . 1383 LEU H . 17364 1 1291 . 1 1 121 121 LEU HA H 1 4.664 0.020 . 1 . . . . 1383 LEU HA . 17364 1 1292 . 1 1 121 121 LEU HB2 H 1 1.329 0.020 . 2 . . . . 1383 LEU HB2 . 17364 1 1293 . 1 1 121 121 LEU HB3 H 1 0.924 0.020 . 2 . . . . 1383 LEU HB3 . 17364 1 1294 . 1 1 121 121 LEU HG H 1 1.406 0.020 . 1 . . . . 1383 LEU HG . 17364 1 1295 . 1 1 121 121 LEU HD11 H 1 0.606 0.020 . 2 . . . . 1383 LEU QD1 . 17364 1 1296 . 1 1 121 121 LEU HD12 H 1 0.606 0.020 . 2 . . . . 1383 LEU QD1 . 17364 1 1297 . 1 1 121 121 LEU HD13 H 1 0.606 0.020 . 2 . . . . 1383 LEU QD1 . 17364 1 1298 . 1 1 121 121 LEU HD21 H 1 0.535 0.020 . 2 . . . . 1383 LEU QD2 . 17364 1 1299 . 1 1 121 121 LEU HD22 H 1 0.535 0.020 . 2 . . . . 1383 LEU QD2 . 17364 1 1300 . 1 1 121 121 LEU HD23 H 1 0.535 0.020 . 2 . . . . 1383 LEU QD2 . 17364 1 1301 . 1 1 121 121 LEU CA C 13 54.026 0.400 . 1 . . . . 1383 LEU CA . 17364 1 1302 . 1 1 121 121 LEU CB C 13 47.855 0.400 . 1 . . . . 1383 LEU CB . 17364 1 1303 . 1 1 121 121 LEU CG C 13 26.295 0.400 . 1 . . . . 1383 LEU CG . 17364 1 1304 . 1 1 121 121 LEU CD1 C 13 24.227 0.400 . 2 . . . . 1383 LEU CD1 . 17364 1 1305 . 1 1 121 121 LEU CD2 C 13 25.753 0.400 . 2 . . . . 1383 LEU CD2 . 17364 1 1306 . 1 1 121 121 LEU N N 15 126.999 0.400 . 1 . . . . 1383 LEU N . 17364 1 1307 . 1 1 122 122 PHE H H 1 8.819 0.020 . 1 . . . . 1384 PHE H . 17364 1 1308 . 1 1 122 122 PHE HA H 1 5.041 0.020 . 1 . . . . 1384 PHE HA . 17364 1 1309 . 1 1 122 122 PHE HB2 H 1 2.445 0.020 . 2 . . . . 1384 PHE QB . 17364 1 1310 . 1 1 122 122 PHE HB3 H 1 2.445 0.020 . 2 . . . . 1384 PHE QB . 17364 1 1311 . 1 1 122 122 PHE HD1 H 1 6.951 0.020 . 3 . . . . 1384 PHE QD . 17364 1 1312 . 1 1 122 122 PHE HD2 H 1 6.951 0.020 . 3 . . . . 1384 PHE QD . 17364 1 1313 . 1 1 122 122 PHE HE1 H 1 7.267 0.020 . 3 . . . . 1384 PHE QE . 17364 1 1314 . 1 1 122 122 PHE HE2 H 1 7.267 0.020 . 3 . . . . 1384 PHE QE . 17364 1 1315 . 1 1 122 122 PHE HZ H 1 7.167 0.020 . 1 . . . . 1384 PHE HZ . 17364 1 1316 . 1 1 122 122 PHE CA C 13 55.945 0.400 . 1 . . . . 1384 PHE CA . 17364 1 1317 . 1 1 122 122 PHE CB C 13 44.491 0.400 . 1 . . . . 1384 PHE CB . 17364 1 1318 . 1 1 122 122 PHE CD1 C 13 132.988 0.400 . 3 . . . . 1384 PHE CD1 . 17364 1 1319 . 1 1 122 122 PHE CE2 C 13 131.094 0.400 . 3 . . . . 1384 PHE CE2 . 17364 1 1320 . 1 1 122 122 PHE CZ C 13 128.246 0.400 . 1 . . . . 1384 PHE CZ . 17364 1 1321 . 1 1 122 122 PHE N N 15 121.505 0.400 . 1 . . . . 1384 PHE N . 17364 1 1322 . 1 1 123 123 ALA H H 1 9.235 0.020 . 1 . . . . 1385 ALA H . 17364 1 1323 . 1 1 123 123 ALA HA H 1 5.526 0.020 . 1 . . . . 1385 ALA HA . 17364 1 1324 . 1 1 123 123 ALA HB1 H 1 1.191 0.020 . 1 . . . . 1385 ALA HB . 17364 1 1325 . 1 1 123 123 ALA HB2 H 1 1.191 0.020 . 1 . . . . 1385 ALA HB . 17364 1 1326 . 1 1 123 123 ALA HB3 H 1 1.191 0.020 . 1 . . . . 1385 ALA HB . 17364 1 1327 . 1 1 123 123 ALA CA C 13 49.759 0.400 . 1 . . . . 1385 ALA CA . 17364 1 1328 . 1 1 123 123 ALA CB C 13 22.542 0.400 . 1 . . . . 1385 ALA CB . 17364 1 1329 . 1 1 123 123 ALA N N 15 118.994 0.400 . 1 . . . . 1385 ALA N . 17364 1 1330 . 1 1 124 124 GLU H H 1 8.073 0.020 . 1 . . . . 1386 GLU H . 17364 1 1331 . 1 1 124 124 GLU HA H 1 4.276 0.020 . 1 . . . . 1386 GLU HA . 17364 1 1332 . 1 1 124 124 GLU HB2 H 1 2.250 0.020 . 2 . . . . 1386 GLU HB2 . 17364 1 1333 . 1 1 124 124 GLU HB3 H 1 2.117 0.020 . 2 . . . . 1386 GLU HB3 . 17364 1 1334 . 1 1 124 124 GLU HG2 H 1 2.445 0.020 . 2 . . . . 1386 GLU HG2 . 17364 1 1335 . 1 1 124 124 GLU HG3 H 1 2.386 0.020 . 2 . . . . 1386 GLU HG3 . 17364 1 1336 . 1 1 124 124 GLU CA C 13 56.991 0.400 . 1 . . . . 1386 GLU CA . 17364 1 1337 . 1 1 124 124 GLU CB C 13 31.433 0.400 . 1 . . . . 1386 GLU CB . 17364 1 1338 . 1 1 124 124 GLU CG C 13 36.983 0.400 . 1 . . . . 1386 GLU CG . 17364 1 1339 . 1 1 124 124 GLU N N 15 118.239 0.400 . 1 . . . . 1386 GLU N . 17364 1 1340 . 1 1 125 125 LEU HA H 1 4.551 0.020 . 1 . . . . 1387 LEU HA . 17364 1 1341 . 1 1 125 125 LEU HB2 H 1 1.392 0.020 . 2 . . . . 1387 LEU HB2 . 17364 1 1342 . 1 1 125 125 LEU HB3 H 1 1.724 0.020 . 2 . . . . 1387 LEU HB3 . 17364 1 1343 . 1 1 125 125 LEU HG H 1 1.559 0.020 . 1 . . . . 1387 LEU HG . 17364 1 1344 . 1 1 125 125 LEU HD11 H 1 0.863 0.020 . 2 . . . . 1387 LEU HD1 . 17364 1 1345 . 1 1 125 125 LEU HD12 H 1 0.863 0.020 . 2 . . . . 1387 LEU HD1 . 17364 1 1346 . 1 1 125 125 LEU HD13 H 1 0.863 0.020 . 2 . . . . 1387 LEU HD1 . 17364 1 1347 . 1 1 125 125 LEU HD21 H 1 0.905 0.020 . 2 . . . . 1387 LEU HD2 . 17364 1 1348 . 1 1 125 125 LEU HD22 H 1 0.905 0.020 . 2 . . . . 1387 LEU HD2 . 17364 1 1349 . 1 1 125 125 LEU HD23 H 1 0.905 0.020 . 2 . . . . 1387 LEU HD2 . 17364 1 1350 . 1 1 125 125 LEU CA C 13 56.001 0.400 . 1 . . . . 1387 LEU CA . 17364 1 1351 . 1 1 125 125 LEU CB C 13 47.014 0.400 . 1 . . . . 1387 LEU CB . 17364 1 1352 . 1 1 125 125 LEU CG C 13 27.323 0.400 . 1 . . . . 1387 LEU CG . 17364 1 1353 . 1 1 125 125 LEU CD1 C 13 26.257 0.400 . 2 . . . . 1387 LEU CD1 . 17364 1 1354 . 1 1 125 125 LEU CD2 C 13 24.214 0.400 . 2 . . . . 1387 LEU CD2 . 17364 1 1355 . 1 1 126 126 ASP HA H 1 4.993 0.020 . 1 . . . . 1388 ASP HA . 17364 1 1356 . 1 1 126 126 ASP HB2 H 1 2.878 0.020 . 2 . . . . 1388 ASP HB2 . 17364 1 1357 . 1 1 126 126 ASP HB3 H 1 2.652 0.020 . 2 . . . . 1388 ASP HB3 . 17364 1 1358 . 1 1 126 126 ASP CA C 13 51.058 0.400 . 1 . . . . 1388 ASP CA . 17364 1 1359 . 1 1 126 126 ASP CB C 13 43.019 0.400 . 1 . . . . 1388 ASP CB . 17364 1 1360 . 1 1 127 127 PRO HA H 1 4.336 0.020 . 1 . . . . 1389 PRO HA . 17364 1 1361 . 1 1 127 127 PRO HB2 H 1 2.386 0.020 . 2 . . . . 1389 PRO HB2 . 17364 1 1362 . 1 1 127 127 PRO HB3 H 1 2.004 0.020 . 2 . . . . 1389 PRO HB3 . 17364 1 1363 . 1 1 127 127 PRO HG2 H 1 2.036 0.020 . 2 . . . . 1389 PRO HG2 . 17364 1 1364 . 1 1 127 127 PRO HG3 H 1 2.036 0.020 . 2 . . . . 1389 PRO HG3 . 17364 1 1365 . 1 1 127 127 PRO HD2 H 1 3.916 0.020 . 2 . . . . 1389 PRO HD2 . 17364 1 1366 . 1 1 127 127 PRO HD3 H 1 3.916 0.020 . 2 . . . . 1389 PRO HD3 . 17364 1 1367 . 1 1 127 127 PRO CA C 13 64.225 0.400 . 1 . . . . 1389 PRO CA . 17364 1 1368 . 1 1 127 127 PRO CB C 13 32.032 0.400 . 1 . . . . 1389 PRO CB . 17364 1 1369 . 1 1 127 127 PRO CG C 13 27.291 0.400 . 1 . . . . 1389 PRO CG . 17364 1 1370 . 1 1 127 127 PRO CD C 13 51.177 0.400 . 1 . . . . 1389 PRO CD . 17364 1 1371 . 1 1 128 128 ASP H H 1 8.578 0.020 . 1 . . . . 1390 ASP H . 17364 1 1372 . 1 1 128 128 ASP HA H 1 4.693 0.020 . 1 . . . . 1390 ASP HA . 17364 1 1373 . 1 1 128 128 ASP HB2 H 1 2.707 0.020 . 2 . . . . 1390 ASP HB2 . 17364 1 1374 . 1 1 128 128 ASP HB3 H 1 2.779 0.020 . 2 . . . . 1390 ASP HB3 . 17364 1 1375 . 1 1 128 128 ASP CA C 13 54.714 0.400 . 1 . . . . 1390 ASP CA . 17364 1 1376 . 1 1 128 128 ASP CB C 13 40.848 0.400 . 1 . . . . 1390 ASP CB . 17364 1 1377 . 1 1 128 128 ASP N N 15 116.120 0.400 . 1 . . . . 1390 ASP N . 17364 1 1378 . 1 1 129 129 GLN H H 1 7.984 0.020 . 1 . . . . 1391 GLN H . 17364 1 1379 . 1 1 129 129 GLN HA H 1 4.333 0.020 . 1 . . . . 1391 GLN HA . 17364 1 1380 . 1 1 129 129 GLN HB2 H 1 2.001 0.020 . 2 . . . . 1391 GLN QB . 17364 1 1381 . 1 1 129 129 GLN HB3 H 1 2.001 0.020 . 2 . . . . 1391 GLN QB . 17364 1 1382 . 1 1 129 129 GLN HG2 H 1 2.170 0.020 . 2 . . . . 1391 GLN HG2 . 17364 1 1383 . 1 1 129 129 GLN HG3 H 1 2.259 0.020 . 2 . . . . 1391 GLN HG3 . 17364 1 1384 . 1 1 129 129 GLN HE21 H 1 7.648 0.020 . 2 . . . . 1391 GLN HE21 . 17364 1 1385 . 1 1 129 129 GLN CA C 13 53.037 0.400 . 1 . . . . 1391 GLN CA . 17364 1 1386 . 1 1 129 129 GLN CB C 13 29.472 0.400 . 1 . . . . 1391 GLN CB . 17364 1 1387 . 1 1 129 129 GLN CG C 13 33.358 0.400 . 1 . . . . 1391 GLN CG . 17364 1 1388 . 1 1 129 129 GLN N N 15 120.734 0.400 . 1 . . . . 1391 GLN N . 17364 1 1389 . 1 1 129 129 GLN NE2 N 15 111.332 0.400 . 1 . . . . 1391 GLN NE2 . 17364 1 1390 . 1 1 130 130 PRO HA H 1 4.468 0.020 . 1 . . . . 1392 PRO HA . 17364 1 1391 . 1 1 130 130 PRO HB2 H 1 2.315 0.020 . 2 . . . . 1392 PRO QB . 17364 1 1392 . 1 1 130 130 PRO HB3 H 1 2.315 0.020 . 2 . . . . 1392 PRO QB . 17364 1 1393 . 1 1 130 130 PRO HG2 H 1 2.006 0.020 . 2 . . . . 1392 PRO HG2 . 17364 1 1394 . 1 1 130 130 PRO HG3 H 1 1.863 0.020 . 2 . . . . 1392 PRO HG3 . 17364 1 1395 . 1 1 130 130 PRO HD2 H 1 3.354 0.020 . 2 . . . . 1392 PRO HD2 . 17364 1 1396 . 1 1 130 130 PRO HD3 H 1 3.413 0.020 . 2 . . . . 1392 PRO HD3 . 17364 1 1397 . 1 1 130 130 PRO CA C 13 62.320 0.400 . 1 . . . . 1392 PRO CA . 17364 1 1398 . 1 1 130 130 PRO CB C 13 32.843 0.400 . 1 . . . . 1392 PRO CB . 17364 1 1399 . 1 1 130 130 PRO CG C 13 27.307 0.400 . 1 . . . . 1392 PRO CG . 17364 1 1400 . 1 1 130 130 PRO CD C 13 50.143 0.400 . 1 . . . . 1392 PRO CD . 17364 1 1401 . 1 1 131 131 ALA H H 1 9.997 0.020 . 1 . . . . 1393 ALA H . 17364 1 1402 . 1 1 131 131 ALA HA H 1 3.140 0.020 . 1 . . . . 1393 ALA HA . 17364 1 1403 . 1 1 131 131 ALA HB1 H 1 1.064 0.020 . 1 . . . . 1393 ALA HB . 17364 1 1404 . 1 1 131 131 ALA HB2 H 1 1.064 0.020 . 1 . . . . 1393 ALA HB . 17364 1 1405 . 1 1 131 131 ALA HB3 H 1 1.064 0.020 . 1 . . . . 1393 ALA HB . 17364 1 1406 . 1 1 131 131 ALA CA C 13 54.578 0.400 . 1 . . . . 1393 ALA CA . 17364 1 1407 . 1 1 131 131 ALA CB C 13 19.754 0.400 . 1 . . . . 1393 ALA CB . 17364 1 1408 . 1 1 131 131 ALA N N 15 122.518 0.400 . 1 . . . . 1393 ALA N . 17364 1 1409 . 1 1 132 132 GLY H H 1 8.834 0.020 . 1 . . . . 1394 GLY H . 17364 1 1410 . 1 1 132 132 GLY HA2 H 1 3.777 0.020 . 2 . . . . 1394 GLY HA2 . 17364 1 1411 . 1 1 132 132 GLY HA3 H 1 3.507 0.020 . 2 . . . . 1394 GLY HA3 . 17364 1 1412 . 1 1 132 132 GLY CA C 13 46.925 0.400 . 1 . . . . 1394 GLY CA . 17364 1 1413 . 1 1 132 132 GLY N N 15 101.558 0.400 . 1 . . . . 1394 GLY N . 17364 1 1414 . 1 1 133 133 ALA H H 1 7.054 0.020 . 1 . . . . 1395 ALA H . 17364 1 1415 . 1 1 133 133 ALA HA H 1 4.109 0.020 . 1 . . . . 1395 ALA HA . 17364 1 1416 . 1 1 133 133 ALA HB1 H 1 1.371 0.020 . 1 . . . . 1395 ALA HB . 17364 1 1417 . 1 1 133 133 ALA HB2 H 1 1.371 0.020 . 1 . . . . 1395 ALA HB . 17364 1 1418 . 1 1 133 133 ALA HB3 H 1 1.371 0.020 . 1 . . . . 1395 ALA HB . 17364 1 1419 . 1 1 133 133 ALA CA C 13 54.571 0.400 . 1 . . . . 1395 ALA CA . 17364 1 1420 . 1 1 133 133 ALA CB C 13 18.443 0.400 . 1 . . . . 1395 ALA CB . 17364 1 1421 . 1 1 133 133 ALA N N 15 123.593 0.400 . 1 . . . . 1395 ALA N . 17364 1 1422 . 1 1 134 134 ILE H H 1 7.113 0.020 . 1 . . . . 1396 ILE H . 17364 1 1423 . 1 1 134 134 ILE HA H 1 3.389 0.020 . 1 . . . . 1396 ILE HA . 17364 1 1424 . 1 1 134 134 ILE HB H 1 1.084 0.020 . 1 . . . . 1396 ILE HB . 17364 1 1425 . 1 1 134 134 ILE HG12 H 1 0.597 0.020 . 2 . . . . 1396 ILE HG12 . 17364 1 1426 . 1 1 134 134 ILE HG13 H 1 1.137 0.020 . 2 . . . . 1396 ILE HG13 . 17364 1 1427 . 1 1 134 134 ILE HG21 H 1 -0.140 0.020 . 1 . . . . 1396 ILE QG2 . 17364 1 1428 . 1 1 134 134 ILE HG22 H 1 -0.140 0.020 . 1 . . . . 1396 ILE QG2 . 17364 1 1429 . 1 1 134 134 ILE HG23 H 1 -0.140 0.020 . 1 . . . . 1396 ILE QG2 . 17364 1 1430 . 1 1 134 134 ILE HD11 H 1 -0.029 0.020 . 1 . . . . 1396 ILE QD1 . 17364 1 1431 . 1 1 134 134 ILE HD12 H 1 -0.029 0.020 . 1 . . . . 1396 ILE QD1 . 17364 1 1432 . 1 1 134 134 ILE HD13 H 1 -0.029 0.020 . 1 . . . . 1396 ILE QD1 . 17364 1 1433 . 1 1 134 134 ILE CA C 13 64.337 0.400 . 1 . . . . 1396 ILE CA . 17364 1 1434 . 1 1 134 134 ILE CB C 13 37.603 0.400 . 1 . . . . 1396 ILE CB . 17364 1 1435 . 1 1 134 134 ILE CG1 C 13 28.094 0.400 . 1 . . . . 1396 ILE CG1 . 17364 1 1436 . 1 1 134 134 ILE CG2 C 13 17.632 0.400 . 1 . . . . 1396 ILE CG2 . 17364 1 1437 . 1 1 134 134 ILE CD1 C 13 14.188 0.400 . 1 . . . . 1396 ILE CD1 . 17364 1 1438 . 1 1 134 134 ILE N N 15 120.125 0.400 . 1 . . . . 1396 ILE N . 17364 1 1439 . 1 1 135 135 VAL H H 1 7.813 0.020 . 1 . . . . 1397 VAL H . 17364 1 1440 . 1 1 135 135 VAL HA H 1 3.483 0.020 . 1 . . . . 1397 VAL HA . 17364 1 1441 . 1 1 135 135 VAL HB H 1 1.895 0.020 . 1 . . . . 1397 VAL HB . 17364 1 1442 . 1 1 135 135 VAL HG11 H 1 0.766 0.020 . 2 . . . . 1397 VAL QG1 . 17364 1 1443 . 1 1 135 135 VAL HG12 H 1 0.766 0.020 . 2 . . . . 1397 VAL QG1 . 17364 1 1444 . 1 1 135 135 VAL HG13 H 1 0.766 0.020 . 2 . . . . 1397 VAL QG1 . 17364 1 1445 . 1 1 135 135 VAL HG21 H 1 0.794 0.020 . 2 . . . . 1397 VAL QG2 . 17364 1 1446 . 1 1 135 135 VAL HG22 H 1 0.794 0.020 . 2 . . . . 1397 VAL QG2 . 17364 1 1447 . 1 1 135 135 VAL HG23 H 1 0.794 0.020 . 2 . . . . 1397 VAL QG2 . 17364 1 1448 . 1 1 135 135 VAL CA C 13 66.219 0.400 . 1 . . . . 1397 VAL CA . 17364 1 1449 . 1 1 135 135 VAL CB C 13 31.626 0.400 . 1 . . . . 1397 VAL CB . 17364 1 1450 . 1 1 135 135 VAL CG1 C 13 21.822 0.400 . 2 . . . . 1397 VAL CG1 . 17364 1 1451 . 1 1 135 135 VAL CG2 C 13 21.691 0.400 . 2 . . . . 1397 VAL CG2 . 17364 1 1452 . 1 1 135 135 VAL N N 15 116.882 0.400 . 1 . . . . 1397 VAL N . 17364 1 1453 . 1 1 136 136 THR H H 1 7.982 0.020 . 1 . . . . 1398 THR H . 17364 1 1454 . 1 1 136 136 THR HA H 1 3.852 0.020 . 1 . . . . 1398 THR HA . 17364 1 1455 . 1 1 136 136 THR HB H 1 4.132 0.020 . 1 . . . . 1398 THR HB . 17364 1 1456 . 1 1 136 136 THR HG21 H 1 1.164 0.020 . 1 . . . . 1398 THR HG2 . 17364 1 1457 . 1 1 136 136 THR HG22 H 1 1.164 0.020 . 1 . . . . 1398 THR HG2 . 17364 1 1458 . 1 1 136 136 THR HG23 H 1 1.164 0.020 . 1 . . . . 1398 THR HG2 . 17364 1 1459 . 1 1 136 136 THR CA C 13 66.799 0.400 . 1 . . . . 1398 THR CA . 17364 1 1460 . 1 1 136 136 THR CB C 13 68.336 0.400 . 1 . . . . 1398 THR CB . 17364 1 1461 . 1 1 136 136 THR CG2 C 13 21.661 0.400 . 1 . . . . 1398 THR CG2 . 17364 1 1462 . 1 1 136 136 THR N N 15 117.613 0.400 . 1 . . . . 1398 THR N . 17364 1 1463 . 1 1 137 137 PHE H H 1 7.758 0.020 . 1 . . . . 1399 PHE H . 17364 1 1464 . 1 1 137 137 PHE HA H 1 4.003 0.020 . 1 . . . . 1399 PHE HA . 17364 1 1465 . 1 1 137 137 PHE HB2 H 1 3.143 0.020 . 2 . . . . 1399 PHE HB2 . 17364 1 1466 . 1 1 137 137 PHE HB3 H 1 3.057 0.020 . 2 . . . . 1399 PHE HB3 . 17364 1 1467 . 1 1 137 137 PHE HD1 H 1 7.059 0.020 . 3 . . . . 1399 PHE QD . 17364 1 1468 . 1 1 137 137 PHE HD2 H 1 7.059 0.020 . 3 . . . . 1399 PHE QD . 17364 1 1469 . 1 1 137 137 PHE HE1 H 1 7.080 0.020 . 3 . . . . 1399 PHE QE . 17364 1 1470 . 1 1 137 137 PHE HE2 H 1 7.080 0.020 . 3 . . . . 1399 PHE QE . 17364 1 1471 . 1 1 137 137 PHE HZ H 1 6.948 0.020 . 1 . . . . 1399 PHE HZ . 17364 1 1472 . 1 1 137 137 PHE CA C 13 62.145 0.400 . 1 . . . . 1399 PHE CA . 17364 1 1473 . 1 1 137 137 PHE CB C 13 39.158 0.400 . 1 . . . . 1399 PHE CB . 17364 1 1474 . 1 1 137 137 PHE CD2 C 13 131.354 0.400 . 3 . . . . 1399 PHE CD2 . 17364 1 1475 . 1 1 137 137 PHE CE1 C 13 130.960 0.400 . 3 . . . . 1399 PHE CE1 . 17364 1 1476 . 1 1 137 137 PHE CZ C 13 129.675 0.400 . 1 . . . . 1399 PHE CZ . 17364 1 1477 . 1 1 137 137 PHE N N 15 123.074 0.400 . 1 . . . . 1399 PHE N . 17364 1 1478 . 1 1 138 138 ILE H H 1 8.461 0.020 . 1 . . . . 1400 ILE H . 17364 1 1479 . 1 1 138 138 ILE HA H 1 3.400 0.020 . 1 . . . . 1400 ILE HA . 17364 1 1480 . 1 1 138 138 ILE HB H 1 1.999 0.020 . 1 . . . . 1400 ILE HB . 17364 1 1481 . 1 1 138 138 ILE HG12 H 1 2.119 0.020 . 2 . . . . 1400 ILE HG12 . 17364 1 1482 . 1 1 138 138 ILE HG13 H 1 0.729 0.020 . 2 . . . . 1400 ILE HG13 . 17364 1 1483 . 1 1 138 138 ILE HG21 H 1 0.780 0.020 . 1 . . . . 1400 ILE QG2 . 17364 1 1484 . 1 1 138 138 ILE HG22 H 1 0.780 0.020 . 1 . . . . 1400 ILE QG2 . 17364 1 1485 . 1 1 138 138 ILE HG23 H 1 0.780 0.020 . 1 . . . . 1400 ILE QG2 . 17364 1 1486 . 1 1 138 138 ILE HD11 H 1 0.891 0.020 . 1 . . . . 1400 ILE QD1 . 17364 1 1487 . 1 1 138 138 ILE HD12 H 1 0.891 0.020 . 1 . . . . 1400 ILE QD1 . 17364 1 1488 . 1 1 138 138 ILE HD13 H 1 0.891 0.020 . 1 . . . . 1400 ILE QD1 . 17364 1 1489 . 1 1 138 138 ILE CA C 13 66.110 0.400 . 1 . . . . 1400 ILE CA . 17364 1 1490 . 1 1 138 138 ILE CB C 13 38.593 0.400 . 1 . . . . 1400 ILE CB . 17364 1 1491 . 1 1 138 138 ILE CG1 C 13 29.636 0.400 . 1 . . . . 1400 ILE CG1 . 17364 1 1492 . 1 1 138 138 ILE CG2 C 13 17.185 0.400 . 1 . . . . 1400 ILE CG2 . 17364 1 1493 . 1 1 138 138 ILE CD1 C 13 13.987 0.400 . 1 . . . . 1400 ILE CD1 . 17364 1 1494 . 1 1 138 138 ILE N N 15 118.106 0.400 . 1 . . . . 1400 ILE N . 17364 1 1495 . 1 1 139 139 THR H H 1 8.557 0.020 . 1 . . . . 1401 THR H . 17364 1 1496 . 1 1 139 139 THR HA H 1 3.685 0.020 . 1 . . . . 1401 THR HA . 17364 1 1497 . 1 1 139 139 THR HB H 1 4.197 0.020 . 1 . . . . 1401 THR HB . 17364 1 1498 . 1 1 139 139 THR HG21 H 1 1.195 0.020 . 1 . . . . 1401 THR HG2 . 17364 1 1499 . 1 1 139 139 THR HG22 H 1 1.195 0.020 . 1 . . . . 1401 THR HG2 . 17364 1 1500 . 1 1 139 139 THR HG23 H 1 1.195 0.020 . 1 . . . . 1401 THR HG2 . 17364 1 1501 . 1 1 139 139 THR CA C 13 66.896 0.400 . 1 . . . . 1401 THR CA . 17364 1 1502 . 1 1 139 139 THR CB C 13 69.031 0.400 . 1 . . . . 1401 THR CB . 17364 1 1503 . 1 1 139 139 THR CG2 C 13 21.744 0.400 . 1 . . . . 1401 THR CG2 . 17364 1 1504 . 1 1 139 139 THR N N 15 112.810 0.400 . 1 . . . . 1401 THR N . 17364 1 1505 . 1 1 140 140 LYS H H 1 8.557 0.020 . 1 . . . . 1402 LYS H . 17364 1 1506 . 1 1 140 140 LYS HA H 1 4.132 0.020 . 1 . . . . 1402 LYS HA . 17364 1 1507 . 1 1 140 140 LYS HB2 H 1 1.830 0.020 . 2 . . . . 1402 LYS HB2 . 17364 1 1508 . 1 1 140 140 LYS HB3 H 1 1.711 0.020 . 2 . . . . 1402 LYS HB3 . 17364 1 1509 . 1 1 140 140 LYS HG2 H 1 1.326 0.020 . 2 . . . . 1402 LYS HG2 . 17364 1 1510 . 1 1 140 140 LYS HG3 H 1 1.527 0.020 . 2 . . . . 1402 LYS HG3 . 17364 1 1511 . 1 1 140 140 LYS HD2 H 1 1.555 0.020 . 2 . . . . 1402 LYS QD . 17364 1 1512 . 1 1 140 140 LYS HD3 H 1 1.555 0.020 . 2 . . . . 1402 LYS QD . 17364 1 1513 . 1 1 140 140 LYS HE2 H 1 2.894 0.020 . 2 . . . . 1402 LYS HE2 . 17364 1 1514 . 1 1 140 140 LYS HE3 H 1 2.892 0.020 . 2 . . . . 1402 LYS HE3 . 17364 1 1515 . 1 1 140 140 LYS CA C 13 58.393 0.400 . 1 . . . . 1402 LYS CA . 17364 1 1516 . 1 1 140 140 LYS CB C 13 32.830 0.400 . 1 . . . . 1402 LYS CB . 17364 1 1517 . 1 1 140 140 LYS CG C 13 25.331 0.400 . 1 . . . . 1402 LYS CG . 17364 1 1518 . 1 1 140 140 LYS CD C 13 29.001 0.400 . 1 . . . . 1402 LYS CD . 17364 1 1519 . 1 1 140 140 LYS CE C 13 41.665 0.400 . 1 . . . . 1402 LYS CE . 17364 1 1520 . 1 1 140 140 LYS N N 15 117.736 0.400 . 1 . . . . 1402 LYS N . 17364 1 1521 . 1 1 141 141 VAL H H 1 7.483 0.020 . 1 . . . . 1403 VAL H . 17364 1 1522 . 1 1 141 141 VAL HA H 1 3.747 0.020 . 1 . . . . 1403 VAL HA . 17364 1 1523 . 1 1 141 141 VAL HB H 1 1.454 0.020 . 1 . . . . 1403 VAL HB . 17364 1 1524 . 1 1 141 141 VAL HG11 H 1 0.448 0.020 . 2 . . . . 1403 VAL QQG . 17364 1 1525 . 1 1 141 141 VAL HG12 H 1 0.448 0.020 . 2 . . . . 1403 VAL QQG . 17364 1 1526 . 1 1 141 141 VAL HG13 H 1 0.448 0.020 . 2 . . . . 1403 VAL QQG . 17364 1 1527 . 1 1 141 141 VAL HG21 H 1 0.448 0.020 . 2 . . . . 1403 VAL QQG . 17364 1 1528 . 1 1 141 141 VAL HG22 H 1 0.448 0.020 . 2 . . . . 1403 VAL QQG . 17364 1 1529 . 1 1 141 141 VAL HG23 H 1 0.448 0.020 . 2 . . . . 1403 VAL QQG . 17364 1 1530 . 1 1 141 141 VAL CA C 13 64.826 0.400 . 1 . . . . 1403 VAL CA . 17364 1 1531 . 1 1 141 141 VAL CB C 13 31.047 0.400 . 1 . . . . 1403 VAL CB . 17364 1 1532 . 1 1 141 141 VAL CG1 C 13 21.900 0.400 . 2 . . . . 1403 VAL CG1 . 17364 1 1533 . 1 1 141 141 VAL N N 15 117.207 0.400 . 1 . . . . 1403 VAL N . 17364 1 1534 . 1 1 142 142 LEU H H 1 7.584 0.020 . 1 . . . . 1404 LEU H . 17364 1 1535 . 1 1 142 142 LEU HA H 1 4.061 0.020 . 1 . . . . 1404 LEU HA . 17364 1 1536 . 1 1 142 142 LEU HB2 H 1 2.059 0.020 . 2 . . . . 1404 LEU HB2 . 17364 1 1537 . 1 1 142 142 LEU HB3 H 1 1.563 0.020 . 2 . . . . 1404 LEU HB3 . 17364 1 1538 . 1 1 142 142 LEU HG H 1 1.618 0.020 . 1 . . . . 1404 LEU HG . 17364 1 1539 . 1 1 142 142 LEU HD11 H 1 0.854 0.020 . 2 . . . . 1404 LEU QD1 . 17364 1 1540 . 1 1 142 142 LEU HD12 H 1 0.854 0.020 . 2 . . . . 1404 LEU QD1 . 17364 1 1541 . 1 1 142 142 LEU HD13 H 1 0.854 0.020 . 2 . . . . 1404 LEU QD1 . 17364 1 1542 . 1 1 142 142 LEU HD21 H 1 0.795 0.020 . 2 . . . . 1404 LEU QD2 . 17364 1 1543 . 1 1 142 142 LEU HD22 H 1 0.795 0.020 . 2 . . . . 1404 LEU QD2 . 17364 1 1544 . 1 1 142 142 LEU HD23 H 1 0.795 0.020 . 2 . . . . 1404 LEU QD2 . 17364 1 1545 . 1 1 142 142 LEU CA C 13 57.987 0.400 . 1 . . . . 1404 LEU CA . 17364 1 1546 . 1 1 142 142 LEU CB C 13 41.257 0.400 . 1 . . . . 1404 LEU CB . 17364 1 1547 . 1 1 142 142 LEU CG C 13 26.903 0.400 . 1 . . . . 1404 LEU CG . 17364 1 1548 . 1 1 142 142 LEU CD1 C 13 25.224 0.400 . 2 . . . . 1404 LEU CD1 . 17364 1 1549 . 1 1 142 142 LEU CD2 C 13 24.609 0.400 . 2 . . . . 1404 LEU CD2 . 17364 1 1550 . 1 1 142 142 LEU N N 15 118.762 0.400 . 1 . . . . 1404 LEU N . 17364 1 1551 . 1 1 143 143 LEU H H 1 7.997 0.020 . 1 . . . . 1405 LEU H . 17364 1 1552 . 1 1 143 143 LEU HA H 1 4.321 0.020 . 1 . . . . 1405 LEU HA . 17364 1 1553 . 1 1 143 143 LEU HB2 H 1 2.068 0.020 . 2 . . . . 1405 LEU HB2 . 17364 1 1554 . 1 1 143 143 LEU HB3 H 1 1.626 0.020 . 2 . . . . 1405 LEU HB3 . 17364 1 1555 . 1 1 143 143 LEU HG H 1 1.641 0.020 . 1 . . . . 1405 LEU HG . 17364 1 1556 . 1 1 143 143 LEU HD11 H 1 0.764 0.020 . 2 . . . . 1405 LEU QD1 . 17364 1 1557 . 1 1 143 143 LEU HD12 H 1 0.764 0.020 . 2 . . . . 1405 LEU QD1 . 17364 1 1558 . 1 1 143 143 LEU HD13 H 1 0.764 0.020 . 2 . . . . 1405 LEU QD1 . 17364 1 1559 . 1 1 143 143 LEU HD21 H 1 0.755 0.020 . 2 . . . . 1405 LEU QD2 . 17364 1 1560 . 1 1 143 143 LEU HD22 H 1 0.755 0.020 . 2 . . . . 1405 LEU QD2 . 17364 1 1561 . 1 1 143 143 LEU HD23 H 1 0.755 0.020 . 2 . . . . 1405 LEU QD2 . 17364 1 1562 . 1 1 143 143 LEU CA C 13 55.310 0.400 . 1 . . . . 1405 LEU CA . 17364 1 1563 . 1 1 143 143 LEU CB C 13 40.832 0.400 . 1 . . . . 1405 LEU CB . 17364 1 1564 . 1 1 143 143 LEU CG C 13 26.939 0.400 . 1 . . . . 1405 LEU CG . 17364 1 1565 . 1 1 143 143 LEU CD1 C 13 22.234 0.400 . 2 . . . . 1405 LEU CD1 . 17364 1 1566 . 1 1 143 143 LEU CD2 C 13 25.066 0.400 . 2 . . . . 1405 LEU CD2 . 17364 1 1567 . 1 1 143 143 LEU N N 15 115.202 0.400 . 1 . . . . 1405 LEU N . 17364 1 1568 . 1 1 144 144 GLY HA2 H 1 3.989 0.020 . 2 . . . . 1406 GLY HA2 . 17364 1 1569 . 1 1 144 144 GLY HA3 H 1 3.759 0.020 . 2 . . . . 1406 GLY HA3 . 17364 1 1570 . 1 1 144 144 GLY CA C 13 46.099 0.400 . 1 . . . . 1406 GLY CA . 17364 1 1571 . 1 1 145 145 GLN H H 1 7.902 0.020 . 1 . . . . 1407 GLN H . 17364 1 1572 . 1 1 145 145 GLN HA H 1 4.309 0.020 . 1 . . . . 1407 GLN HA . 17364 1 1573 . 1 1 145 145 GLN HB2 H 1 2.145 0.020 . 2 . . . . 1407 GLN HB2 . 17364 1 1574 . 1 1 145 145 GLN HB3 H 1 1.986 0.020 . 2 . . . . 1407 GLN HB3 . 17364 1 1575 . 1 1 145 145 GLN HG2 H 1 2.372 0.020 . 2 . . . . 1407 GLN HG2 . 17364 1 1576 . 1 1 145 145 GLN HG3 H 1 2.371 0.020 . 2 . . . . 1407 GLN HG3 . 17364 1 1577 . 1 1 145 145 GLN CA C 13 55.694 0.400 . 1 . . . . 1407 GLN CA . 17364 1 1578 . 1 1 145 145 GLN CB C 13 29.248 0.400 . 1 . . . . 1407 GLN CB . 17364 1 1579 . 1 1 145 145 GLN CG C 13 33.983 0.400 . 1 . . . . 1407 GLN CG . 17364 1 1580 . 1 1 145 145 GLN N N 15 118.288 0.400 . 1 . . . . 1407 GLN N . 17364 1 1581 . 1 1 146 146 ARG H H 1 8.113 0.020 . 1 . . . . 1408 ARG H . 17364 1 1582 . 1 1 146 146 ARG HA H 1 4.341 0.020 . 1 . . . . 1408 ARG HA . 17364 1 1583 . 1 1 146 146 ARG HB2 H 1 1.917 0.020 . 2 . . . . 1408 ARG HB2 . 17364 1 1584 . 1 1 146 146 ARG HB3 H 1 1.808 0.020 . 2 . . . . 1408 ARG HB3 . 17364 1 1585 . 1 1 146 146 ARG HG2 H 1 1.633 0.020 . 2 . . . . 1408 ARG HG2 . 17364 1 1586 . 1 1 146 146 ARG HG3 H 1 1.685 0.020 . 2 . . . . 1408 ARG HG3 . 17364 1 1587 . 1 1 146 146 ARG HD2 H 1 3.236 0.020 . 2 . . . . 1408 ARG HD2 . 17364 1 1588 . 1 1 146 146 ARG HD3 H 1 3.233 0.020 . 2 . . . . 1408 ARG HD3 . 17364 1 1589 . 1 1 146 146 ARG CA C 13 56.115 0.400 . 1 . . . . 1408 ARG CA . 17364 1 1590 . 1 1 146 146 ARG CB C 13 30.736 0.400 . 1 . . . . 1408 ARG CB . 17364 1 1591 . 1 1 146 146 ARG CG C 13 27.123 0.400 . 1 . . . . 1408 ARG CG . 17364 1 1592 . 1 1 146 146 ARG CD C 13 43.413 0.400 . 1 . . . . 1408 ARG CD . 17364 1 1593 . 1 1 146 146 ARG N N 15 121.987 0.400 . 1 . . . . 1408 ARG N . 17364 1 1594 . 1 1 147 147 LYS H H 1 7.966 0.020 . 1 . . . . 1409 LYS H . 17364 1 1595 . 1 1 147 147 LYS HA H 1 4.175 0.020 . 1 . . . . 1409 LYS HA . 17364 1 1596 . 1 1 147 147 LYS HB2 H 1 1.843 0.020 . 2 . . . . 1409 LYS HB2 . 17364 1 1597 . 1 1 147 147 LYS HB3 H 1 1.724 0.020 . 2 . . . . 1409 LYS HB3 . 17364 1 1598 . 1 1 147 147 LYS HG2 H 1 1.476 0.020 . 2 . . . . 1409 LYS HG2 . 17364 1 1599 . 1 1 147 147 LYS HG3 H 1 1.437 0.020 . 2 . . . . 1409 LYS HG3 . 17364 1 1600 . 1 1 147 147 LYS HD2 H 1 1.694 0.020 . 2 . . . . 1409 LYS QD . 17364 1 1601 . 1 1 147 147 LYS HD3 H 1 1.694 0.020 . 2 . . . . 1409 LYS QD . 17364 1 1602 . 1 1 147 147 LYS HE2 H 1 3.000 0.020 . 2 . . . . 1409 LYS HE2 . 17364 1 1603 . 1 1 147 147 LYS HE3 H 1 2.998 0.020 . 2 . . . . 1409 LYS HE3 . 17364 1 1604 . 1 1 147 147 LYS CA C 13 57.606 0.400 . 1 . . . . 1409 LYS CA . 17364 1 1605 . 1 1 147 147 LYS CB C 13 33.763 0.400 . 1 . . . . 1409 LYS CB . 17364 1 1606 . 1 1 147 147 LYS CG C 13 24.822 0.400 . 1 . . . . 1409 LYS CG . 17364 1 1607 . 1 1 147 147 LYS CD C 13 29.147 0.400 . 1 . . . . 1409 LYS CD . 17364 1 1608 . 1 1 147 147 LYS CE C 13 41.823 0.400 . 1 . . . . 1409 LYS CE . 17364 1 1609 . 1 1 147 147 LYS N N 15 127.662 0.400 . 1 . . . . 1409 LYS N . 17364 1 stop_ save_