data_16256 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 16256 _Entry.Title ; Drosha RNA Binding Domain ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2009-04-13 _Entry.Accession_date 2009-04-13 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.0.9.13 _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 Geoffrey Mueller . A. . 16256 2 Matthew Miller . . . 16256 3 Mahua Ghosh . . . 16256 4 Eugene DeRose . F. . 16256 5 Robert London . E. . 16256 6 Traci Hall . . . 16256 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 16256 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 244 16256 '15N chemical shifts' 68 16256 '1H chemical shifts' 473 16256 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 4 . . 2013-07-30 2009-04-13 update BMRB 'delete of shift 18 LEU C 0.000' 16256 3 . . 2010-11-03 2009-04-13 update BMRB 'correct residue number' 16256 2 . . 2010-05-28 2009-04-13 update BMRB 'edit entity/assembly name' 16256 1 . . 2010-04-01 2009-04-13 original author 'original release' 16256 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2KHX 'BMRB Entry Tracking System' 16256 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 16256 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 20226070 _Citation.Full_citation . _Citation.Title 'Solution structure of the Drosha double-stranded RNA-binding domain' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev Silence _Citation.Journal_name_full . _Citation.Journal_volume 1 _Citation.Journal_issue 2 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 2 _Citation.Page_last . _Citation.Year 2010 _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 Geoffrey Mueller . . . 16256 1 2 Matthew Miller . . . 16256 1 3 Eugene DeRose . . . 16256 1 4 Mahua Ghosh . . . 16256 1 5 Robert London . . . 16256 1 6 Traci Hall . . . 16256 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 16256 _Assembly.ID 1 _Assembly.Name Drosha _Assembly.BMRB_code . _Assembly.Number_of_components 1 _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 'binding domain' 1 $entity A . yes native no no . . . 16256 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity _Entity.Sf_category entity _Entity.Sf_framecode entity _Entity.Entry_ID 16256 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'binding domain' _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 ; GSPQFMLNQDWNDPKSQLQQ CCLTLRTEGKEPDIPLYKTL QTVGPSHARTYTVAVYFKGE RIGCGKGPSIQQAEMGAAMD ALEKYNFPQM ; _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 90 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state unknown _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 8761.069 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 2KHX . "Drosha Double-Stranded Rna Binding Motif" . . . . . 87.78 85 100.00 100.00 3.21e-51 . . . . 16256 1 2 no DBJ BAA91511 . "unnamed protein product [Homo sapiens]" . . . . . 96.67 769 97.70 100.00 1.42e-52 . . . . 16256 1 3 no DBJ BAB22917 . "unnamed protein product [Mus musculus]" . . . . . 96.67 134 97.70 100.00 6.18e-57 . . . . 16256 1 4 no DBJ BAE25729 . "unnamed protein product [Mus musculus]" . . . . . 96.67 1373 97.70 100.00 3.65e-51 . . . . 16256 1 5 no DBJ BAE28629 . "unnamed protein product [Mus musculus]" . . . . . 96.67 1373 97.70 100.00 3.65e-51 . . . . 16256 1 6 no DBJ BAO93839 . "ribonuclease, partial [Bubalus bubalis]" . . . . . 96.67 129 97.70 100.00 3.74e-57 . . . . 16256 1 7 no EMBL CAG32380 . "hypothetical protein RCJMB04_24a21 [Gallus gallus]" . . . . . 96.67 1336 97.70 100.00 1.59e-51 . . . . 16256 1 8 no EMBL CBN82191 . "Ribonuclease 3 [Dicentrarchus labrax]" . . . . . 72.22 1569 96.92 100.00 9.54e-36 . . . . 16256 1 9 no EMBL CDQ74551 . "unnamed protein product [Oncorhynchus mykiss]" . . . . . 90.00 323 97.53 100.00 1.16e-49 . . . . 16256 1 10 no GB AAD29637 . "putative ribonuclease III [Homo sapiens]" . . . . . 96.67 541 97.70 100.00 5.23e-55 . . . . 16256 1 11 no GB AAF80558 . "ribonuclease III [Homo sapiens]" . . . . . 96.67 1374 97.70 100.00 3.69e-51 . . . . 16256 1 12 no GB AAH41162 . "RNASEN protein, partial [Homo sapiens]" . . . . . 96.67 722 97.70 100.00 1.25e-52 . . . . 16256 1 13 no GB AAH50057 . "Rnasen protein, partial [Mus musculus]" . . . . . 96.67 705 97.70 100.00 8.98e-53 . . . . 16256 1 14 no GB AAH55696 . "Rnasen protein, partial [Mus musculus]" . . . . . 96.67 780 97.70 100.00 1.60e-52 . . . . 16256 1 15 no REF NP_001006379 . "ribonuclease 3 [Gallus gallus]" . . . . . 96.67 1336 97.70 100.00 1.59e-51 . . . . 16256 1 16 no REF NP_001093882 . "ribonuclease 3 isoform 2 [Homo sapiens]" . . . . . 96.67 1337 97.70 100.00 3.84e-51 . . . . 16256 1 17 no REF NP_001101125 . "ribonuclease 3 [Rattus norvegicus]" . . . . . 96.67 1373 97.70 100.00 4.06e-51 . . . . 16256 1 18 no REF NP_001103942 . "ribonuclease 3 [Danio rerio]" . . . . . 96.67 1289 97.70 100.00 2.94e-51 . . . . 16256 1 19 no REF NP_001107152 . "ribonuclease 3 [Xenopus (Silurana) tropicalis]" . . . . . 96.67 1325 97.70 100.00 2.34e-51 . . . . 16256 1 20 no SP Q5HZJ0 . "RecName: Full=Ribonuclease 3; AltName: Full=Protein Drosha; AltName: Full=Ribonuclease III; Short=RNase III" . . . . . 96.67 1373 97.70 100.00 3.65e-51 . . . . 16256 1 21 no SP Q9NRR4 . "RecName: Full=Ribonuclease 3; AltName: Full=Protein Drosha; AltName: Full=Ribonuclease III; Short=RNase III; AltName: Full=p241" . . . . . 96.67 1374 97.70 100.00 3.58e-51 . . . . 16256 1 22 no TPG DAA17862 . "TPA: ribonuclease III, nuclear-like isoform 1 [Bos taurus]" . . . . . 96.67 1367 97.70 100.00 4.23e-51 . . . . 16256 1 23 no TPG DAA17863 . "TPA: ribonuclease III, nuclear-like isoform 2 [Bos taurus]" . . . . . 96.67 1330 97.70 100.00 3.41e-51 . . . . 16256 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 1248 GLY . 16256 1 2 1249 SER . 16256 1 3 1250 PRO . 16256 1 4 1251 GLN . 16256 1 5 1252 PHE . 16256 1 6 1253 MET . 16256 1 7 1254 LEU . 16256 1 8 1255 ASN . 16256 1 9 1256 GLN . 16256 1 10 1257 ASP . 16256 1 11 1258 TRP . 16256 1 12 1259 ASN . 16256 1 13 1260 ASP . 16256 1 14 1261 PRO . 16256 1 15 1262 LYS . 16256 1 16 1263 SER . 16256 1 17 1264 GLN . 16256 1 18 1265 LEU . 16256 1 19 1266 GLN . 16256 1 20 1267 GLN . 16256 1 21 1268 CYS . 16256 1 22 1269 CYS . 16256 1 23 1270 LEU . 16256 1 24 1271 THR . 16256 1 25 1272 LEU . 16256 1 26 1273 ARG . 16256 1 27 1274 THR . 16256 1 28 1275 GLU . 16256 1 29 1276 GLY . 16256 1 30 1277 LYS . 16256 1 31 1278 GLU . 16256 1 32 1279 PRO . 16256 1 33 1280 ASP . 16256 1 34 1281 ILE . 16256 1 35 1282 PRO . 16256 1 36 1283 LEU . 16256 1 37 1284 TYR . 16256 1 38 1285 LYS . 16256 1 39 1286 THR . 16256 1 40 1287 LEU . 16256 1 41 1288 GLN . 16256 1 42 1289 THR . 16256 1 43 1290 VAL . 16256 1 44 1291 GLY . 16256 1 45 1292 PRO . 16256 1 46 1293 SER . 16256 1 47 1294 HIS . 16256 1 48 1295 ALA . 16256 1 49 1296 ARG . 16256 1 50 1297 THR . 16256 1 51 1298 TYR . 16256 1 52 1299 THR . 16256 1 53 1300 VAL . 16256 1 54 1301 ALA . 16256 1 55 1302 VAL . 16256 1 56 1303 TYR . 16256 1 57 1304 PHE . 16256 1 58 1305 LYS . 16256 1 59 1306 GLY . 16256 1 60 1307 GLU . 16256 1 61 1308 ARG . 16256 1 62 1309 ILE . 16256 1 63 1310 GLY . 16256 1 64 1311 CYS . 16256 1 65 1312 GLY . 16256 1 66 1313 LYS . 16256 1 67 1314 GLY . 16256 1 68 1315 PRO . 16256 1 69 1316 SER . 16256 1 70 1317 ILE . 16256 1 71 1318 GLN . 16256 1 72 1319 GLN . 16256 1 73 1320 ALA . 16256 1 74 1321 GLU . 16256 1 75 1322 MET . 16256 1 76 1323 GLY . 16256 1 77 1324 ALA . 16256 1 78 1325 ALA . 16256 1 79 1326 MET . 16256 1 80 1327 ASP . 16256 1 81 1328 ALA . 16256 1 82 1329 LEU . 16256 1 83 1330 GLU . 16256 1 84 1331 LYS . 16256 1 85 1332 TYR . 16256 1 86 1333 ASN . 16256 1 87 1334 PHE . 16256 1 88 1335 PRO . 16256 1 89 1336 GLN . 16256 1 90 1337 MET . 16256 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 16256 1 . SER 2 2 16256 1 . PRO 3 3 16256 1 . GLN 4 4 16256 1 . PHE 5 5 16256 1 . MET 6 6 16256 1 . LEU 7 7 16256 1 . ASN 8 8 16256 1 . GLN 9 9 16256 1 . ASP 10 10 16256 1 . TRP 11 11 16256 1 . ASN 12 12 16256 1 . ASP 13 13 16256 1 . PRO 14 14 16256 1 . LYS 15 15 16256 1 . SER 16 16 16256 1 . GLN 17 17 16256 1 . LEU 18 18 16256 1 . GLN 19 19 16256 1 . GLN 20 20 16256 1 . CYS 21 21 16256 1 . CYS 22 22 16256 1 . LEU 23 23 16256 1 . THR 24 24 16256 1 . LEU 25 25 16256 1 . ARG 26 26 16256 1 . THR 27 27 16256 1 . GLU 28 28 16256 1 . GLY 29 29 16256 1 . LYS 30 30 16256 1 . GLU 31 31 16256 1 . PRO 32 32 16256 1 . ASP 33 33 16256 1 . ILE 34 34 16256 1 . PRO 35 35 16256 1 . LEU 36 36 16256 1 . TYR 37 37 16256 1 . LYS 38 38 16256 1 . THR 39 39 16256 1 . LEU 40 40 16256 1 . GLN 41 41 16256 1 . THR 42 42 16256 1 . VAL 43 43 16256 1 . GLY 44 44 16256 1 . PRO 45 45 16256 1 . SER 46 46 16256 1 . HIS 47 47 16256 1 . ALA 48 48 16256 1 . ARG 49 49 16256 1 . THR 50 50 16256 1 . TYR 51 51 16256 1 . THR 52 52 16256 1 . VAL 53 53 16256 1 . ALA 54 54 16256 1 . VAL 55 55 16256 1 . TYR 56 56 16256 1 . PHE 57 57 16256 1 . LYS 58 58 16256 1 . GLY 59 59 16256 1 . GLU 60 60 16256 1 . ARG 61 61 16256 1 . ILE 62 62 16256 1 . GLY 63 63 16256 1 . CYS 64 64 16256 1 . GLY 65 65 16256 1 . LYS 66 66 16256 1 . GLY 67 67 16256 1 . PRO 68 68 16256 1 . SER 69 69 16256 1 . ILE 70 70 16256 1 . GLN 71 71 16256 1 . GLN 72 72 16256 1 . ALA 73 73 16256 1 . GLU 74 74 16256 1 . MET 75 75 16256 1 . GLY 76 76 16256 1 . ALA 77 77 16256 1 . ALA 78 78 16256 1 . MET 79 79 16256 1 . ASP 80 80 16256 1 . ALA 81 81 16256 1 . LEU 82 82 16256 1 . GLU 83 83 16256 1 . LYS 84 84 16256 1 . TYR 85 85 16256 1 . ASN 86 86 16256 1 . PHE 87 87 16256 1 . PRO 88 88 16256 1 . GLN 89 89 16256 1 . MET 90 90 16256 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 16256 _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 $entity . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 16256 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 16256 _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 $entity . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . . . . . . . . . . . pet21c . . . . . . 16256 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 16256 _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 entity '[U-99% 13C; U-99% 15N]' . . 1 $entity . . . 1 2 mM . . . . 16256 1 2 TRIS [U-2H] . . . . . . 25 . . mM . . . . 16256 1 3 'potassium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 16256 1 4 DTT [U-2H] . . . . . . 1 . . mM . . . . 16256 1 5 EDTA 'natural abundance' . . . . . . 1 . . mM . . . . 16256 1 6 DSS 'natural abundance' . . . . . . 10 . . uM . . . . 16256 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 16256 _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' 0.125 . M 16256 1 pH 7.0 . pH 16256 1 pressure 1.0 . atm 16256 1 temperature 298 . K 16256 1 stop_ save_ ############################ # Computer software used # ############################ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 16256 _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' . . 16256 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 16256 1 stop_ save_ save_NMRView _Software.Sf_category software _Software.Sf_framecode NMRView _Software.Entry_ID 16256 _Software.ID 2 _Software.Name NMRView _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Johnson, One Moon Scientific' . . 16256 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 16256 2 stop_ save_ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 16256 _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' . . 16256 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 16256 3 stop_ save_ save_X-PLOR_NIH _Software.Sf_category software _Software.Sf_framecode X-PLOR_NIH _Software.Entry_ID 16256 _Software.ID 4 _Software.Name 'X-PLOR NIH' _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Schwieters, Kuszewski, Tjandra and Clore' . . 16256 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 16256 4 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 16256 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 16256 _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 . 600 . . . 16256 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 16256 _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 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16256 1 2 '2D 1H-13C HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16256 1 3 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16256 1 4 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16256 1 5 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16256 1 6 '3D H(CCO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16256 1 7 '3D C(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16256 1 8 'CN-4D simultaneous NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16256 1 9 HB-HE/HD-aromatic no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16256 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 16256 _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 internal indirect 0.251449530 . . . . . . . . . 16256 1 H 1 DSS 'methyl protons' . . . . ppm 0 internal direct 1 . . . . . . . . . 16256 1 N 15 DSS 'methyl protons' . . . . ppm 0 internal indirect 0.101329118 . . . . . . . . . 16256 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 16256 _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' . . . 16256 1 2 '2D 1H-13C HSQC' . . . 16256 1 3 '3D HNCO' . . . 16256 1 4 '3D CBCA(CO)NH' . . . 16256 1 5 '3D HNCACB' . . . 16256 1 6 '3D H(CCO)NH' . . . 16256 1 7 '3D C(CO)NH' . . . 16256 1 8 'CN-4D simultaneous NOESY' . . . 16256 1 9 HB-HE/HD-aromatic . . . 16256 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 16 16 SER HA H 1 4.204 . . 1 . . . . 1263 SER HA . 16256 1 2 . 1 1 16 16 SER HB2 H 1 3.884 . . 1 . . . . 1263 SER HB2 . 16256 1 3 . 1 1 16 16 SER HB3 H 1 3.884 . . 1 . . . . 1263 SER HB3 . 16256 1 4 . 1 1 16 16 SER CA C 13 61.754 . . 1 . . . . 1263 SER CA . 16256 1 5 . 1 1 16 16 SER CB C 13 61.982 . . 1 . . . . 1263 SER CB . 16256 1 6 . 1 1 17 17 GLN H H 1 8.379 . . 1 . . . . 1264 GLN H . 16256 1 7 . 1 1 17 17 GLN HA H 1 4.014 . . 1 . . . . 1264 GLN HA . 16256 1 8 . 1 1 17 17 GLN HE21 H 1 7.216 . . 1 . . . . 1264 GLN HE21 . 16256 1 9 . 1 1 17 17 GLN HE22 H 1 7.422 . . 1 . . . . 1264 GLN HE22 . 16256 1 10 . 1 1 17 17 GLN HG2 H 1 2.306 . . 1 . . . . 1264 GLN HG2 . 16256 1 11 . 1 1 17 17 GLN HG3 H 1 2.306 . . 1 . . . . 1264 GLN HG3 . 16256 1 12 . 1 1 17 17 GLN CA C 13 59.068 . . 1 . . . . 1264 GLN CA . 16256 1 13 . 1 1 17 17 GLN CB C 13 28.906 . . 1 . . . . 1264 GLN CB . 16256 1 14 . 1 1 17 17 GLN CG C 13 33.679 . . 1 . . . . 1264 GLN CG . 16256 1 15 . 1 1 17 17 GLN N N 15 122.081 . . 1 . . . . 1264 GLN N . 16256 1 16 . 1 1 17 17 GLN NE2 N 15 111.310 . . 1 . . . . 1264 GLN NE2 . 16256 1 17 . 1 1 18 18 LEU H H 1 8.614 . . 1 . . . . 1265 LEU H . 16256 1 18 . 1 1 18 18 LEU HA H 1 3.944 . . 1 . . . . 1265 LEU HA . 16256 1 19 . 1 1 18 18 LEU HB2 H 1 2.006 . . 2 . . . . 1265 LEU HB2 . 16256 1 20 . 1 1 18 18 LEU HB3 H 1 1.450 . . 2 . . . . 1265 LEU HB3 . 16256 1 21 . 1 1 18 18 LEU HD11 H 1 0.772 . . 2 . . . . 1265 LEU HD11 . 16256 1 22 . 1 1 18 18 LEU HD12 H 1 0.772 . . 2 . . . . 1265 LEU HD12 . 16256 1 23 . 1 1 18 18 LEU HD13 H 1 0.772 . . 2 . . . . 1265 LEU HD13 . 16256 1 24 . 1 1 18 18 LEU HD21 H 1 0.909 . . 2 . . . . 1265 LEU HD21 . 16256 1 25 . 1 1 18 18 LEU HD22 H 1 0.909 . . 2 . . . . 1265 LEU HD22 . 16256 1 26 . 1 1 18 18 LEU HD23 H 1 0.909 . . 2 . . . . 1265 LEU HD23 . 16256 1 27 . 1 1 18 18 LEU HG H 1 1.429 . . 1 . . . . 1265 LEU HG . 16256 1 28 . 1 1 18 18 LEU CA C 13 58.313 . . 1 . . . . 1265 LEU CA . 16256 1 29 . 1 1 18 18 LEU CB C 13 41.196 . . 1 . . . . 1265 LEU CB . 16256 1 30 . 1 1 18 18 LEU CD1 C 13 23.790 . . 2 . . . . 1265 LEU CD1 . 16256 1 31 . 1 1 18 18 LEU CD2 C 13 26.883 . . 2 . . . . 1265 LEU CD2 . 16256 1 32 . 1 1 18 18 LEU CG C 13 27.293 . . 1 . . . . 1265 LEU CG . 16256 1 33 . 1 1 18 18 LEU N N 15 120.354 . . 1 . . . . 1265 LEU N . 16256 1 34 . 1 1 19 19 GLN H H 1 7.907 . . 1 . . . . 1266 GLN H . 16256 1 35 . 1 1 19 19 GLN HB2 H 1 2.148 . . 2 . . . . 1266 GLN HB2 . 16256 1 36 . 1 1 19 19 GLN HB3 H 1 2.262 . . 2 . . . . 1266 GLN HB3 . 16256 1 37 . 1 1 19 19 GLN CA C 13 60.725 . . 1 . . . . 1266 GLN CA . 16256 1 38 . 1 1 19 19 GLN CB C 13 28.125 . . 1 . . . . 1266 GLN CB . 16256 1 39 . 1 1 19 19 GLN N N 15 119.071 . . 1 . . . . 1266 GLN N . 16256 1 40 . 1 1 20 20 GLN HA H 1 3.983 . . 1 . . . . 1267 GLN HA . 16256 1 41 . 1 1 20 20 GLN HB2 H 1 2.160 . . 2 . . . . 1267 GLN HB2 . 16256 1 42 . 1 1 20 20 GLN HB3 H 1 2.140 . . 2 . . . . 1267 GLN HB3 . 16256 1 43 . 1 1 20 20 GLN HG2 H 1 2.410 . . 2 . . . . 1267 GLN HG2 . 16256 1 44 . 1 1 20 20 GLN HG3 H 1 2.450 . . 2 . . . . 1267 GLN HG3 . 16256 1 45 . 1 1 20 20 GLN CA C 13 59.043 . . 1 . . . . 1267 GLN CA . 16256 1 46 . 1 1 20 20 GLN CB C 13 28.390 . . 1 . . . . 1267 GLN CB . 16256 1 47 . 1 1 20 20 GLN CG C 13 33.747 . . 1 . . . . 1267 GLN CG . 16256 1 48 . 1 1 21 21 CYS H H 1 8.165 . . 1 . . . . 1268 CYS H . 16256 1 49 . 1 1 21 21 CYS HA H 1 3.910 . . 1 . . . . 1268 CYS HA . 16256 1 50 . 1 1 21 21 CYS HB2 H 1 1.830 . . 2 . . . . 1268 CYS HB2 . 16256 1 51 . 1 1 21 21 CYS HB3 H 1 2.406 . . 2 . . . . 1268 CYS HB3 . 16256 1 52 . 1 1 21 21 CYS CA C 13 63.270 . . 1 . . . . 1268 CYS CA . 16256 1 53 . 1 1 21 21 CYS CB C 13 26.042 . . 1 . . . . 1268 CYS CB . 16256 1 54 . 1 1 21 21 CYS N N 15 118.288 . . 1 . . . . 1268 CYS N . 16256 1 55 . 1 1 22 22 CYS H H 1 8.057 . . 1 . . . . 1269 CYS H . 16256 1 56 . 1 1 22 22 CYS HA H 1 3.822 . . 1 . . . . 1269 CYS HA . 16256 1 57 . 1 1 22 22 CYS HB2 H 1 2.448 . . 2 . . . . 1269 CYS HB2 . 16256 1 58 . 1 1 22 22 CYS HB3 H 1 2.700 . . 2 . . . . 1269 CYS HB3 . 16256 1 59 . 1 1 22 22 CYS CA C 13 64.012 . . 1 . . . . 1269 CYS CA . 16256 1 60 . 1 1 22 22 CYS CB C 13 27.328 . . 1 . . . . 1269 CYS CB . 16256 1 61 . 1 1 22 22 CYS N N 15 117.737 . . 1 . . . . 1269 CYS N . 16256 1 62 . 1 1 23 23 LEU H H 1 7.899 . . 1 . . . . 1270 LEU H . 16256 1 63 . 1 1 23 23 LEU HA H 1 4.265 . . 1 . . . . 1270 LEU HA . 16256 1 64 . 1 1 23 23 LEU HB2 H 1 1.878 . . 1 . . . . 1270 LEU HB2 . 16256 1 65 . 1 1 23 23 LEU HB3 H 1 1.878 . . 1 . . . . 1270 LEU HB3 . 16256 1 66 . 1 1 23 23 LEU HD11 H 1 0.930 . . 1 . . . . 1270 LEU HD11 . 16256 1 67 . 1 1 23 23 LEU HD12 H 1 0.930 . . 1 . . . . 1270 LEU HD12 . 16256 1 68 . 1 1 23 23 LEU HD13 H 1 0.930 . . 1 . . . . 1270 LEU HD13 . 16256 1 69 . 1 1 23 23 LEU HD21 H 1 0.930 . . 1 . . . . 1270 LEU HD21 . 16256 1 70 . 1 1 23 23 LEU HD22 H 1 0.930 . . 1 . . . . 1270 LEU HD22 . 16256 1 71 . 1 1 23 23 LEU HD23 H 1 0.930 . . 1 . . . . 1270 LEU HD23 . 16256 1 72 . 1 1 23 23 LEU HG H 1 1.680 . . 1 . . . . 1270 LEU HG . 16256 1 73 . 1 1 23 23 LEU CA C 13 57.448 . . 1 . . . . 1270 LEU CA . 16256 1 74 . 1 1 23 23 LEU CB C 13 41.984 . . 1 . . . . 1270 LEU CB . 16256 1 75 . 1 1 23 23 LEU CD1 C 13 23.528 . . 2 . . . . 1270 LEU CD1 . 16256 1 76 . 1 1 23 23 LEU CD2 C 13 25.208 . . 2 . . . . 1270 LEU CD2 . 16256 1 77 . 1 1 23 23 LEU CG C 13 27.275 . . 1 . . . . 1270 LEU CG . 16256 1 78 . 1 1 23 23 LEU N N 15 120.640 . . 1 . . . . 1270 LEU N . 16256 1 79 . 1 1 24 24 THR H H 1 7.537 . . 1 . . . . 1271 THR H . 16256 1 80 . 1 1 24 24 THR HA H 1 4.315 . . 1 . . . . 1271 THR HA . 16256 1 81 . 1 1 24 24 THR HB H 1 4.261 . . 1 . . . . 1271 THR HB . 16256 1 82 . 1 1 24 24 THR HG21 H 1 1.359 . . 1 . . . . 1271 THR HG21 . 16256 1 83 . 1 1 24 24 THR HG22 H 1 1.359 . . 1 . . . . 1271 THR HG22 . 16256 1 84 . 1 1 24 24 THR HG23 H 1 1.359 . . 1 . . . . 1271 THR HG23 . 16256 1 85 . 1 1 24 24 THR CA C 13 63.845 . . 1 . . . . 1271 THR CA . 16256 1 86 . 1 1 24 24 THR CB C 13 69.648 . . 1 . . . . 1271 THR CB . 16256 1 87 . 1 1 24 24 THR CG2 C 13 21.792 . . 1 . . . . 1271 THR CG2 . 16256 1 88 . 1 1 24 24 THR N N 15 110.288 . . 1 . . . . 1271 THR N . 16256 1 89 . 1 1 25 25 LEU H H 1 7.410 . . 1 . . . . 1272 LEU H . 16256 1 90 . 1 1 25 25 LEU HA H 1 4.515 . . 1 . . . . 1272 LEU HA . 16256 1 91 . 1 1 25 25 LEU HB2 H 1 1.902 . . 2 . . . . 1272 LEU HB2 . 16256 1 92 . 1 1 25 25 LEU HB3 H 1 2.017 . . 2 . . . . 1272 LEU HB3 . 16256 1 93 . 1 1 25 25 LEU HD11 H 1 0.907 . . 2 . . . . 1272 LEU HD11 . 16256 1 94 . 1 1 25 25 LEU HD12 H 1 0.907 . . 2 . . . . 1272 LEU HD12 . 16256 1 95 . 1 1 25 25 LEU HD13 H 1 0.907 . . 2 . . . . 1272 LEU HD13 . 16256 1 96 . 1 1 25 25 LEU HD21 H 1 1.103 . . 2 . . . . 1272 LEU HD21 . 16256 1 97 . 1 1 25 25 LEU HD22 H 1 1.103 . . 2 . . . . 1272 LEU HD22 . 16256 1 98 . 1 1 25 25 LEU HD23 H 1 1.103 . . 2 . . . . 1272 LEU HD23 . 16256 1 99 . 1 1 25 25 LEU HG H 1 1.850 . . 1 . . . . 1272 LEU HG . 16256 1 100 . 1 1 25 25 LEU CA C 13 54.734 . . 1 . . . . 1272 LEU CA . 16256 1 101 . 1 1 25 25 LEU CB C 13 41.691 . . 1 . . . . 1272 LEU CB . 16256 1 102 . 1 1 25 25 LEU CD1 C 13 23.590 . . 2 . . . . 1272 LEU CD1 . 16256 1 103 . 1 1 25 25 LEU CD2 C 13 26.169 . . 2 . . . . 1272 LEU CD2 . 16256 1 104 . 1 1 25 25 LEU CG C 13 27.107 . . 1 . . . . 1272 LEU CG . 16256 1 105 . 1 1 25 25 LEU N N 15 121.830 . . 1 . . . . 1272 LEU N . 16256 1 106 . 1 1 26 26 ARG H H 1 7.707 . . 1 . . . . 1273 ARG H . 16256 1 107 . 1 1 26 26 ARG HA H 1 4.511 . . 1 . . . . 1273 ARG HA . 16256 1 108 . 1 1 26 26 ARG HB2 H 1 1.950 . . 1 . . . . 1273 ARG HB2 . 16256 1 109 . 1 1 26 26 ARG HB3 H 1 1.950 . . 1 . . . . 1273 ARG HB3 . 16256 1 110 . 1 1 26 26 ARG HD2 H 1 3.214 . . 1 . . . . 1273 ARG HD2 . 16256 1 111 . 1 1 26 26 ARG HD3 H 1 3.214 . . 1 . . . . 1273 ARG HD3 . 16256 1 112 . 1 1 26 26 ARG HG2 H 1 1.643 . . 1 . . . . 1273 ARG HG2 . 16256 1 113 . 1 1 26 26 ARG HG3 H 1 1.643 . . 1 . . . . 1273 ARG HG3 . 16256 1 114 . 1 1 26 26 ARG CA C 13 56.368 . . 1 . . . . 1273 ARG CA . 16256 1 115 . 1 1 26 26 ARG CB C 13 31.019 . . 1 . . . . 1273 ARG CB . 16256 1 116 . 1 1 26 26 ARG CD C 13 43.665 . . 1 . . . . 1273 ARG CD . 16256 1 117 . 1 1 26 26 ARG CG C 13 26.632 . . 1 . . . . 1273 ARG CG . 16256 1 118 . 1 1 26 26 ARG N N 15 121.231 . . 1 . . . . 1273 ARG N . 16256 1 119 . 1 1 27 27 THR H H 1 8.783 . . 1 . . . . 1274 THR H . 16256 1 120 . 1 1 27 27 THR HA H 1 4.447 . . 1 . . . . 1274 THR HA . 16256 1 121 . 1 1 27 27 THR HB H 1 4.107 . . 1 . . . . 1274 THR HB . 16256 1 122 . 1 1 27 27 THR HG21 H 1 1.255 . . 1 . . . . 1274 THR HG21 . 16256 1 123 . 1 1 27 27 THR HG22 H 1 1.255 . . 1 . . . . 1274 THR HG22 . 16256 1 124 . 1 1 27 27 THR HG23 H 1 1.255 . . 1 . . . . 1274 THR HG23 . 16256 1 125 . 1 1 27 27 THR CA C 13 61.634 . . 1 . . . . 1274 THR CA . 16256 1 126 . 1 1 27 27 THR CB C 13 70.244 . . 1 . . . . 1274 THR CB . 16256 1 127 . 1 1 27 27 THR CG2 C 13 21.686 . . 1 . . . . 1274 THR CG2 . 16256 1 128 . 1 1 27 27 THR N N 15 119.448 . . 1 . . . . 1274 THR N . 16256 1 129 . 1 1 28 28 GLU H H 1 8.731 . . 1 . . . . 1275 GLU H . 16256 1 130 . 1 1 28 28 GLU HA H 1 4.156 . . 1 . . . . 1275 GLU HA . 16256 1 131 . 1 1 28 28 GLU HB2 H 1 2.020 . . 1 . . . . 1275 GLU HB2 . 16256 1 132 . 1 1 28 28 GLU HB3 H 1 2.020 . . 1 . . . . 1275 GLU HB3 . 16256 1 133 . 1 1 28 28 GLU HG2 H 1 2.287 . . 1 . . . . 1275 GLU HG2 . 16256 1 134 . 1 1 28 28 GLU HG3 H 1 2.287 . . 1 . . . . 1275 GLU HG3 . 16256 1 135 . 1 1 28 28 GLU CA C 13 57.713 . . 1 . . . . 1275 GLU CA . 16256 1 136 . 1 1 28 28 GLU CB C 13 29.718 . . 1 . . . . 1275 GLU CB . 16256 1 137 . 1 1 28 28 GLU CG C 13 36.083 . . 1 . . . . 1275 GLU CG . 16256 1 138 . 1 1 28 28 GLU N N 15 125.009 . . 1 . . . . 1275 GLU N . 16256 1 139 . 1 1 29 29 GLY H H 1 8.672 . . 1 . . . . 1276 GLY H . 16256 1 140 . 1 1 29 29 GLY HA2 H 1 3.807 . . 2 . . . . 1276 GLY HA2 . 16256 1 141 . 1 1 29 29 GLY HA3 H 1 4.151 . . 2 . . . . 1276 GLY HA3 . 16256 1 142 . 1 1 29 29 GLY CA C 13 45.476 . . 1 . . . . 1276 GLY CA . 16256 1 143 . 1 1 29 29 GLY N N 15 111.397 . . 1 . . . . 1276 GLY N . 16256 1 144 . 1 1 30 30 LYS H H 1 7.865 . . 1 . . . . 1277 LYS H . 16256 1 145 . 1 1 30 30 LYS HA H 1 4.572 . . 1 . . . . 1277 LYS HA . 16256 1 146 . 1 1 30 30 LYS HB2 H 1 1.891 . . 1 . . . . 1277 LYS HB2 . 16256 1 147 . 1 1 30 30 LYS HB3 H 1 1.891 . . 1 . . . . 1277 LYS HB3 . 16256 1 148 . 1 1 30 30 LYS HD2 H 1 1.694 . . 1 . . . . 1277 LYS HD2 . 16256 1 149 . 1 1 30 30 LYS HD3 H 1 1.694 . . 1 . . . . 1277 LYS HD3 . 16256 1 150 . 1 1 30 30 LYS HE2 H 1 3.013 . . 1 . . . . 1277 LYS HE2 . 16256 1 151 . 1 1 30 30 LYS HE3 H 1 3.013 . . 1 . . . . 1277 LYS HE3 . 16256 1 152 . 1 1 30 30 LYS HG2 H 1 1.390 . . 1 . . . . 1277 LYS HG2 . 16256 1 153 . 1 1 30 30 LYS HG3 H 1 1.390 . . 1 . . . . 1277 LYS HG3 . 16256 1 154 . 1 1 30 30 LYS CA C 13 54.942 . . 1 . . . . 1277 LYS CA . 16256 1 155 . 1 1 30 30 LYS CB C 13 34.473 . . 1 . . . . 1277 LYS CB . 16256 1 156 . 1 1 30 30 LYS CD C 13 28.778 . . 1 . . . . 1277 LYS CD . 16256 1 157 . 1 1 30 30 LYS CE C 13 42.170 . . 1 . . . . 1277 LYS CE . 16256 1 158 . 1 1 30 30 LYS CG C 13 24.600 . . 1 . . . . 1277 LYS CG . 16256 1 159 . 1 1 30 30 LYS N N 15 119.422 . . 1 . . . . 1277 LYS N . 16256 1 160 . 1 1 31 31 GLU H H 1 8.563 . . 1 . . . . 1278 GLU H . 16256 1 161 . 1 1 31 31 GLU HB2 H 1 1.857 . . 2 . . . . 1278 GLU HB2 . 16256 1 162 . 1 1 31 31 GLU HB3 H 1 1.737 . . 2 . . . . 1278 GLU HB3 . 16256 1 163 . 1 1 31 31 GLU CA C 13 54.813 . . 1 . . . . 1278 GLU CA . 16256 1 164 . 1 1 31 31 GLU CB C 13 34.460 . . 1 . . . . 1278 GLU CB . 16256 1 165 . 1 1 31 31 GLU N N 15 122.903 . . 1 . . . . 1278 GLU N . 16256 1 166 . 1 1 32 32 PRO HA H 1 4.494 . . 1 . . . . 1279 PRO HA . 16256 1 167 . 1 1 32 32 PRO HB2 H 1 2.311 . . 1 . . . . 1279 PRO HB2 . 16256 1 168 . 1 1 32 32 PRO HB3 H 1 2.311 . . 1 . . . . 1279 PRO HB3 . 16256 1 169 . 1 1 32 32 PRO HD2 H 1 4.014 . . 1 . . . . 1279 PRO HD2 . 16256 1 170 . 1 1 32 32 PRO HD3 H 1 4.014 . . 1 . . . . 1279 PRO HD3 . 16256 1 171 . 1 1 32 32 PRO HG2 H 1 2.028 . . 1 . . . . 1279 PRO HG2 . 16256 1 172 . 1 1 32 32 PRO HG3 H 1 2.028 . . 1 . . . . 1279 PRO HG3 . 16256 1 173 . 1 1 32 32 PRO CA C 13 63.277 . . 1 . . . . 1279 PRO CA . 16256 1 174 . 1 1 32 32 PRO CB C 13 32.288 . . 1 . . . . 1279 PRO CB . 16256 1 175 . 1 1 32 32 PRO CD C 13 50.607 . . 1 . . . . 1279 PRO CD . 16256 1 176 . 1 1 32 32 PRO CG C 13 27.406 . . 1 . . . . 1279 PRO CG . 16256 1 177 . 1 1 33 33 ASP H H 1 8.213 . . 1 . . . . 1280 ASP H . 16256 1 178 . 1 1 33 33 ASP HA H 1 4.789 . . 1 . . . . 1280 ASP HA . 16256 1 179 . 1 1 33 33 ASP HB2 H 1 2.449 . . 1 . . . . 1280 ASP HB2 . 16256 1 180 . 1 1 33 33 ASP HB3 H 1 2.449 . . 1 . . . . 1280 ASP HB3 . 16256 1 181 . 1 1 33 33 ASP CA C 13 54.735 . . 1 . . . . 1280 ASP CA . 16256 1 182 . 1 1 33 33 ASP CB C 13 43.419 . . 1 . . . . 1280 ASP CB . 16256 1 183 . 1 1 33 33 ASP N N 15 121.944 . . 1 . . . . 1280 ASP N . 16256 1 184 . 1 1 34 34 ILE H H 1 8.204 . . 1 . . . . 1281 ILE H . 16256 1 185 . 1 1 34 34 ILE HB H 1 1.979 . . 1 . . . . 1281 ILE HB . 16256 1 186 . 1 1 34 34 ILE HD11 H 1 0.905 . . 1 . . . . 1281 ILE HD11 . 16256 1 187 . 1 1 34 34 ILE HD12 H 1 0.905 . . 1 . . . . 1281 ILE HD12 . 16256 1 188 . 1 1 34 34 ILE HD13 H 1 0.905 . . 1 . . . . 1281 ILE HD13 . 16256 1 189 . 1 1 34 34 ILE HG12 H 1 1.460 . . 2 . . . . 1281 ILE HG12 . 16256 1 190 . 1 1 34 34 ILE HG13 H 1 1.180 . . 2 . . . . 1281 ILE HG13 . 16256 1 191 . 1 1 34 34 ILE HG21 H 1 0.996 . . 1 . . . . 1281 ILE HG21 . 16256 1 192 . 1 1 34 34 ILE HG22 H 1 0.996 . . 1 . . . . 1281 ILE HG22 . 16256 1 193 . 1 1 34 34 ILE HG23 H 1 0.996 . . 1 . . . . 1281 ILE HG23 . 16256 1 194 . 1 1 34 34 ILE CA C 13 58.379 . . 1 . . . . 1281 ILE CA . 16256 1 195 . 1 1 34 34 ILE CB C 13 39.996 . . 1 . . . . 1281 ILE CB . 16256 1 196 . 1 1 34 34 ILE CD1 C 13 13.445 . . 1 . . . . 1281 ILE CD1 . 16256 1 197 . 1 1 34 34 ILE CG1 C 13 25.710 . . 1 . . . . 1281 ILE CG1 . 16256 1 198 . 1 1 34 34 ILE CG2 C 13 17.990 . . 1 . . . . 1281 ILE CG2 . 16256 1 199 . 1 1 34 34 ILE N N 15 116.642 . . 1 . . . . 1281 ILE N . 16256 1 200 . 1 1 35 35 PRO HA H 1 4.977 . . 1 . . . . 1282 PRO HA . 16256 1 201 . 1 1 35 35 PRO HB2 H 1 2.027 . . 1 . . . . 1282 PRO HB2 . 16256 1 202 . 1 1 35 35 PRO HB3 H 1 2.027 . . 1 . . . . 1282 PRO HB3 . 16256 1 203 . 1 1 35 35 PRO HD2 H 1 3.768 . . 1 . . . . 1282 PRO HD2 . 16256 1 204 . 1 1 35 35 PRO HD3 H 1 3.768 . . 1 . . . . 1282 PRO HD3 . 16256 1 205 . 1 1 35 35 PRO HG2 H 1 1.813 . . 1 . . . . 1282 PRO HG2 . 16256 1 206 . 1 1 35 35 PRO HG3 H 1 1.813 . . 1 . . . . 1282 PRO HG3 . 16256 1 207 . 1 1 35 35 PRO CA C 13 63.211 . . 1 . . . . 1282 PRO CA . 16256 1 208 . 1 1 35 35 PRO CB C 13 32.059 . . 1 . . . . 1282 PRO CB . 16256 1 209 . 1 1 35 35 PRO CD C 13 50.616 . . 1 . . . . 1282 PRO CD . 16256 1 210 . 1 1 35 35 PRO CG C 13 28.270 . . 1 . . . . 1282 PRO CG . 16256 1 211 . 1 1 36 36 LEU H H 1 8.809 . . 1 . . . . 1283 LEU H . 16256 1 212 . 1 1 36 36 LEU HA H 1 4.776 . . 1 . . . . 1283 LEU HA . 16256 1 213 . 1 1 36 36 LEU HB2 H 1 1.645 . . 1 . . . . 1283 LEU HB2 . 16256 1 214 . 1 1 36 36 LEU HB3 H 1 1.645 . . 1 . . . . 1283 LEU HB3 . 16256 1 215 . 1 1 36 36 LEU HD11 H 1 0.849 . . 2 . . . . 1283 LEU HD11 . 16256 1 216 . 1 1 36 36 LEU HD12 H 1 0.849 . . 2 . . . . 1283 LEU HD12 . 16256 1 217 . 1 1 36 36 LEU HD13 H 1 0.849 . . 2 . . . . 1283 LEU HD13 . 16256 1 218 . 1 1 36 36 LEU HD21 H 1 0.937 . . 2 . . . . 1283 LEU HD21 . 16256 1 219 . 1 1 36 36 LEU HD22 H 1 0.937 . . 2 . . . . 1283 LEU HD22 . 16256 1 220 . 1 1 36 36 LEU HD23 H 1 0.937 . . 2 . . . . 1283 LEU HD23 . 16256 1 221 . 1 1 36 36 LEU CA C 13 53.760 . . 1 . . . . 1283 LEU CA . 16256 1 222 . 1 1 36 36 LEU CB C 13 45.498 . . 1 . . . . 1283 LEU CB . 16256 1 223 . 1 1 36 36 LEU CD1 C 13 24.852 . . 2 . . . . 1283 LEU CD1 . 16256 1 224 . 1 1 36 36 LEU CD2 C 13 25.074 . . 2 . . . . 1283 LEU CD2 . 16256 1 225 . 1 1 36 36 LEU CG C 13 26.861 . . 1 . . . . 1283 LEU CG . 16256 1 226 . 1 1 36 36 LEU N N 15 124.265 . . 1 . . . . 1283 LEU N . 16256 1 227 . 1 1 37 37 TYR H H 1 8.933 . . 1 . . . . 1284 TYR H . 16256 1 228 . 1 1 37 37 TYR HA H 1 5.173 . . 1 . . . . 1284 TYR HA . 16256 1 229 . 1 1 37 37 TYR HB2 H 1 2.717 . . 2 . . . . 1284 TYR HB2 . 16256 1 230 . 1 1 37 37 TYR HB3 H 1 2.920 . . 2 . . . . 1284 TYR HB3 . 16256 1 231 . 1 1 37 37 TYR HD1 H 1 6.911 . . 3 . . . . 1284 TYR HD1 . 16256 1 232 . 1 1 37 37 TYR HD2 H 1 6.911 . . 3 . . . . 1284 TYR HD2 . 16256 1 233 . 1 1 37 37 TYR HE1 H 1 6.650 . . 3 . . . . 1284 TYR HE1 . 16256 1 234 . 1 1 37 37 TYR HE2 H 1 6.650 . . 3 . . . . 1284 TYR HE2 . 16256 1 235 . 1 1 37 37 TYR CA C 13 57.938 . . 1 . . . . 1284 TYR CA . 16256 1 236 . 1 1 37 37 TYR CB C 13 39.851 . . 1 . . . . 1284 TYR CB . 16256 1 237 . 1 1 37 37 TYR CD1 C 13 132.766 . . 3 . . . . 1284 TYR CD1 . 16256 1 238 . 1 1 37 37 TYR CD2 C 13 132.766 . . 3 . . . . 1284 TYR CD2 . 16256 1 239 . 1 1 37 37 TYR CE1 C 13 117.746 . . 3 . . . . 1284 TYR CE1 . 16256 1 240 . 1 1 37 37 TYR CE2 C 13 117.746 . . 3 . . . . 1284 TYR CE2 . 16256 1 241 . 1 1 37 37 TYR N N 15 123.990 . . 1 . . . . 1284 TYR N . 16256 1 242 . 1 1 38 38 LYS H H 1 9.366 . . 1 . . . . 1285 LYS H . 16256 1 243 . 1 1 38 38 LYS HA H 1 4.824 . . 1 . . . . 1285 LYS HA . 16256 1 244 . 1 1 38 38 LYS HB2 H 1 1.810 . . 1 . . . . 1285 LYS HB2 . 16256 1 245 . 1 1 38 38 LYS HB3 H 1 1.810 . . 1 . . . . 1285 LYS HB3 . 16256 1 246 . 1 1 38 38 LYS HE2 H 1 2.661 . . 1 . . . . 1285 LYS HE2 . 16256 1 247 . 1 1 38 38 LYS HE3 H 1 2.661 . . 1 . . . . 1285 LYS HE3 . 16256 1 248 . 1 1 38 38 LYS HG2 H 1 1.400 . . 1 . . . . 1285 LYS HG2 . 16256 1 249 . 1 1 38 38 LYS HG3 H 1 1.400 . . 1 . . . . 1285 LYS HG3 . 16256 1 250 . 1 1 38 38 LYS CA C 13 55.136 . . 1 . . . . 1285 LYS CA . 16256 1 251 . 1 1 38 38 LYS CB C 13 37.007 . . 1 . . . . 1285 LYS CB . 16256 1 252 . 1 1 38 38 LYS CD C 13 29.131 . . 1 . . . . 1285 LYS CD . 16256 1 253 . 1 1 38 38 LYS CE C 13 41.886 . . 1 . . . . 1285 LYS CE . 16256 1 254 . 1 1 38 38 LYS CG C 13 24.838 . . 1 . . . . 1285 LYS CG . 16256 1 255 . 1 1 38 38 LYS N N 15 122.774 . . 1 . . . . 1285 LYS N . 16256 1 256 . 1 1 39 39 THR H H 1 8.983 . . 1 . . . . 1286 THR H . 16256 1 257 . 1 1 39 39 THR HA H 1 4.534 . . 1 . . . . 1286 THR HA . 16256 1 258 . 1 1 39 39 THR HB H 1 4.150 . . 1 . . . . 1286 THR HB . 16256 1 259 . 1 1 39 39 THR HG21 H 1 1.270 . . 1 . . . . 1286 THR HG21 . 16256 1 260 . 1 1 39 39 THR HG22 H 1 1.270 . . 1 . . . . 1286 THR HG22 . 16256 1 261 . 1 1 39 39 THR HG23 H 1 1.270 . . 1 . . . . 1286 THR HG23 . 16256 1 262 . 1 1 39 39 THR CA C 13 63.579 . . 1 . . . . 1286 THR CA . 16256 1 263 . 1 1 39 39 THR CB C 13 68.310 . . 1 . . . . 1286 THR CB . 16256 1 264 . 1 1 39 39 THR CG2 C 13 22.897 . . 1 . . . . 1286 THR CG2 . 16256 1 265 . 1 1 39 39 THR N N 15 122.902 . . 1 . . . . 1286 THR N . 16256 1 266 . 1 1 40 40 LEU H H 1 9.287 . . 1 . . . . 1287 LEU H . 16256 1 267 . 1 1 40 40 LEU HB2 H 1 1.620 . . 2 . . . . 1287 LEU HB2 . 16256 1 268 . 1 1 40 40 LEU HB3 H 1 1.560 . . 2 . . . . 1287 LEU HB3 . 16256 1 269 . 1 1 40 40 LEU HD11 H 1 0.901 . . 2 . . . . 1287 LEU HD11 . 16256 1 270 . 1 1 40 40 LEU HD12 H 1 0.901 . . 2 . . . . 1287 LEU HD12 . 16256 1 271 . 1 1 40 40 LEU HD13 H 1 0.901 . . 2 . . . . 1287 LEU HD13 . 16256 1 272 . 1 1 40 40 LEU HD21 H 1 0.985 . . 2 . . . . 1287 LEU HD21 . 16256 1 273 . 1 1 40 40 LEU HD22 H 1 0.985 . . 2 . . . . 1287 LEU HD22 . 16256 1 274 . 1 1 40 40 LEU HD23 H 1 0.985 . . 2 . . . . 1287 LEU HD23 . 16256 1 275 . 1 1 40 40 LEU HG H 1 1.770 . . 1 . . . . 1287 LEU HG . 16256 1 276 . 1 1 40 40 LEU CA C 13 55.611 . . 1 . . . . 1287 LEU CA . 16256 1 277 . 1 1 40 40 LEU CB C 13 43.381 . . 1 . . . . 1287 LEU CB . 16256 1 278 . 1 1 40 40 LEU CD1 C 13 22.266 . . 2 . . . . 1287 LEU CD1 . 16256 1 279 . 1 1 40 40 LEU CD2 C 13 26.220 . . 2 . . . . 1287 LEU CD2 . 16256 1 280 . 1 1 40 40 LEU CG C 13 26.880 . . 1 . . . . 1287 LEU CG . 16256 1 281 . 1 1 40 40 LEU N N 15 128.842 . . 1 . . . . 1287 LEU N . 16256 1 282 . 1 1 41 41 GLN H H 1 7.712 . . 1 . . . . 1288 GLN H . 16256 1 283 . 1 1 41 41 GLN HA H 1 4.621 . . 1 . . . . 1288 GLN HA . 16256 1 284 . 1 1 41 41 GLN HB2 H 1 2.070 . . 2 . . . . 1288 GLN HB2 . 16256 1 285 . 1 1 41 41 GLN HB3 H 1 1.944 . . 2 . . . . 1288 GLN HB3 . 16256 1 286 . 1 1 41 41 GLN HE21 H 1 6.836 . . 1 . . . . 1288 GLN HE21 . 16256 1 287 . 1 1 41 41 GLN HE22 H 1 7.373 . . 1 . . . . 1288 GLN HE22 . 16256 1 288 . 1 1 41 41 GLN HG2 H 1 2.292 . . 1 . . . . 1288 GLN HG2 . 16256 1 289 . 1 1 41 41 GLN HG3 H 1 2.292 . . 1 . . . . 1288 GLN HG3 . 16256 1 290 . 1 1 41 41 GLN CA C 13 55.764 . . 1 . . . . 1288 GLN CA . 16256 1 291 . 1 1 41 41 GLN CB C 13 32.277 . . 1 . . . . 1288 GLN CB . 16256 1 292 . 1 1 41 41 GLN CG C 13 33.774 . . 1 . . . . 1288 GLN CG . 16256 1 293 . 1 1 41 41 GLN N N 15 115.497 . . 1 . . . . 1288 GLN N . 16256 1 294 . 1 1 41 41 GLN NE2 N 15 111.666 . . 1 . . . . 1288 GLN NE2 . 16256 1 295 . 1 1 42 42 THR H H 1 8.409 . . 1 . . . . 1289 THR H . 16256 1 296 . 1 1 42 42 THR HA H 1 4.606 . . 1 . . . . 1289 THR HA . 16256 1 297 . 1 1 42 42 THR HB H 1 3.773 . . 1 . . . . 1289 THR HB . 16256 1 298 . 1 1 42 42 THR HG21 H 1 0.810 . . 1 . . . . 1289 THR HG21 . 16256 1 299 . 1 1 42 42 THR HG22 H 1 0.810 . . 1 . . . . 1289 THR HG22 . 16256 1 300 . 1 1 42 42 THR HG23 H 1 0.810 . . 1 . . . . 1289 THR HG23 . 16256 1 301 . 1 1 42 42 THR CA C 13 61.825 . . 1 . . . . 1289 THR CA . 16256 1 302 . 1 1 42 42 THR CB C 13 70.658 . . 1 . . . . 1289 THR CB . 16256 1 303 . 1 1 42 42 THR CG2 C 13 21.584 . . 1 . . . . 1289 THR CG2 . 16256 1 304 . 1 1 42 42 THR N N 15 119.082 . . 1 . . . . 1289 THR N . 16256 1 305 . 1 1 43 43 VAL H H 1 8.268 . . 1 . . . . 1290 VAL H . 16256 1 306 . 1 1 43 43 VAL HA H 1 4.533 . . 1 . . . . 1290 VAL HA . 16256 1 307 . 1 1 43 43 VAL HB H 1 2.018 . . 1 . . . . 1290 VAL HB . 16256 1 308 . 1 1 43 43 VAL HG11 H 1 0.852 . . 2 . . . . 1290 VAL HG11 . 16256 1 309 . 1 1 43 43 VAL HG12 H 1 0.852 . . 2 . . . . 1290 VAL HG12 . 16256 1 310 . 1 1 43 43 VAL HG13 H 1 0.852 . . 2 . . . . 1290 VAL HG13 . 16256 1 311 . 1 1 43 43 VAL HG21 H 1 0.836 . . 2 . . . . 1290 VAL HG21 . 16256 1 312 . 1 1 43 43 VAL HG22 H 1 0.836 . . 2 . . . . 1290 VAL HG22 . 16256 1 313 . 1 1 43 43 VAL HG23 H 1 0.836 . . 2 . . . . 1290 VAL HG23 . 16256 1 314 . 1 1 43 43 VAL CA C 13 60.487 . . 1 . . . . 1290 VAL CA . 16256 1 315 . 1 1 43 43 VAL CB C 13 35.681 . . 1 . . . . 1290 VAL CB . 16256 1 316 . 1 1 43 43 VAL CG1 C 13 21.181 . . 2 . . . . 1290 VAL CG1 . 16256 1 317 . 1 1 43 43 VAL CG2 C 13 20.121 . . 2 . . . . 1290 VAL CG2 . 16256 1 318 . 1 1 43 43 VAL N N 15 121.527 . . 1 . . . . 1290 VAL N . 16256 1 319 . 1 1 44 44 GLY H H 1 8.288 . . 1 . . . . 1291 GLY H . 16256 1 320 . 1 1 44 44 GLY HA2 H 1 3.855 . . 1 . . . . 1291 GLY HA2 . 16256 1 321 . 1 1 44 44 GLY HA3 H 1 3.855 . . 1 . . . . 1291 GLY HA3 . 16256 1 322 . 1 1 44 44 GLY CA C 13 43.906 . . 1 . . . . 1291 GLY CA . 16256 1 323 . 1 1 44 44 GLY N N 15 110.721 . . 1 . . . . 1291 GLY N . 16256 1 324 . 1 1 45 45 PRO HA H 1 4.601 . . 1 . . . . 1292 PRO HA . 16256 1 325 . 1 1 45 45 PRO HB2 H 1 1.969 . . 1 . . . . 1292 PRO HB2 . 16256 1 326 . 1 1 45 45 PRO HB3 H 1 1.969 . . 1 . . . . 1292 PRO HB3 . 16256 1 327 . 1 1 45 45 PRO HD2 H 1 3.550 . . 1 . . . . 1292 PRO HD2 . 16256 1 328 . 1 1 45 45 PRO HD3 H 1 3.550 . . 1 . . . . 1292 PRO HD3 . 16256 1 329 . 1 1 45 45 PRO HG2 H 1 1.251 . . 1 . . . . 1292 PRO HG2 . 16256 1 330 . 1 1 45 45 PRO HG3 H 1 1.251 . . 1 . . . . 1292 PRO HG3 . 16256 1 331 . 1 1 45 45 PRO CA C 13 62.244 . . 1 . . . . 1292 PRO CA . 16256 1 332 . 1 1 45 45 PRO CB C 13 32.562 . . 1 . . . . 1292 PRO CB . 16256 1 333 . 1 1 45 45 PRO CD C 13 48.767 . . 1 . . . . 1292 PRO CD . 16256 1 334 . 1 1 45 45 PRO CG C 13 26.824 . . 1 . . . . 1292 PRO CG . 16256 1 335 . 1 1 46 46 SER H H 1 8.807 . . 1 . . . . 1293 SER H . 16256 1 336 . 1 1 46 46 SER HA H 1 3.770 . . 1 . . . . 1293 SER HA . 16256 1 337 . 1 1 46 46 SER HB2 H 1 3.930 . . 1 . . . . 1293 SER HB2 . 16256 1 338 . 1 1 46 46 SER HB3 H 1 3.930 . . 1 . . . . 1293 SER HB3 . 16256 1 339 . 1 1 46 46 SER CA C 13 62.074 . . 1 . . . . 1293 SER CA . 16256 1 340 . 1 1 46 46 SER CB C 13 62.880 . . 1 . . . . 1293 SER CB . 16256 1 341 . 1 1 46 46 SER N N 15 114.401 . . 1 . . . . 1293 SER N . 16256 1 342 . 1 1 47 47 HIS H H 1 7.985 . . 1 . . . . 1294 HIS H . 16256 1 343 . 1 1 47 47 HIS HA H 1 4.693 . . 1 . . . . 1294 HIS HA . 16256 1 344 . 1 1 47 47 HIS HB2 H 1 2.974 . . 2 . . . . 1294 HIS HB2 . 16256 1 345 . 1 1 47 47 HIS HB3 H 1 3.388 . . 2 . . . . 1294 HIS HB3 . 16256 1 346 . 1 1 47 47 HIS CA C 13 56.231 . . 1 . . . . 1294 HIS CA . 16256 1 347 . 1 1 47 47 HIS CB C 13 30.481 . . 1 . . . . 1294 HIS CB . 16256 1 348 . 1 1 47 47 HIS N N 15 125.596 . . 1 . . . . 1294 HIS N . 16256 1 349 . 1 1 48 48 ALA H H 1 7.666 . . 1 . . . . 1295 ALA H . 16256 1 350 . 1 1 48 48 ALA HB1 H 1 0.984 . . 1 . . . . 1295 ALA HB1 . 16256 1 351 . 1 1 48 48 ALA HB2 H 1 0.984 . . 1 . . . . 1295 ALA HB2 . 16256 1 352 . 1 1 48 48 ALA HB3 H 1 0.984 . . 1 . . . . 1295 ALA HB3 . 16256 1 353 . 1 1 48 48 ALA CA C 13 51.764 . . 1 . . . . 1295 ALA CA . 16256 1 354 . 1 1 48 48 ALA CB C 13 18.281 . . 1 . . . . 1295 ALA CB . 16256 1 355 . 1 1 48 48 ALA N N 15 128.326 . . 1 . . . . 1295 ALA N . 16256 1 356 . 1 1 49 49 ARG H H 1 8.102 . . 1 . . . . 1296 ARG H . 16256 1 357 . 1 1 49 49 ARG HB2 H 1 3.097 . . 1 . . . . 1296 ARG HB2 . 16256 1 358 . 1 1 49 49 ARG HB3 H 1 3.097 . . 1 . . . . 1296 ARG HB3 . 16256 1 359 . 1 1 49 49 ARG HD2 H 1 2.729 . . 1 . . . . 1296 ARG HD2 . 16256 1 360 . 1 1 49 49 ARG HD3 H 1 2.729 . . 1 . . . . 1296 ARG HD3 . 16256 1 361 . 1 1 49 49 ARG HG2 H 1 1.296 . . 1 . . . . 1296 ARG HG2 . 16256 1 362 . 1 1 49 49 ARG HG3 H 1 1.296 . . 1 . . . . 1296 ARG HG3 . 16256 1 363 . 1 1 49 49 ARG CA C 13 55.461 . . 1 . . . . 1296 ARG CA . 16256 1 364 . 1 1 49 49 ARG CB C 13 32.370 . . 1 . . . . 1296 ARG CB . 16256 1 365 . 1 1 49 49 ARG CD C 13 43.460 . . 1 . . . . 1296 ARG CD . 16256 1 366 . 1 1 49 49 ARG CG C 13 26.403 . . 1 . . . . 1296 ARG CG . 16256 1 367 . 1 1 49 49 ARG N N 15 122.980 . . 1 . . . . 1296 ARG N . 16256 1 368 . 1 1 50 50 THR H H 1 8.618 . . 1 . . . . 1297 THR H . 16256 1 369 . 1 1 50 50 THR HA H 1 4.469 . . 1 . . . . 1297 THR HA . 16256 1 370 . 1 1 50 50 THR HB H 1 3.730 . . 1 . . . . 1297 THR HB . 16256 1 371 . 1 1 50 50 THR HG21 H 1 1.070 . . 1 . . . . 1297 THR HG21 . 16256 1 372 . 1 1 50 50 THR HG22 H 1 1.070 . . 1 . . . . 1297 THR HG22 . 16256 1 373 . 1 1 50 50 THR HG23 H 1 1.070 . . 1 . . . . 1297 THR HG23 . 16256 1 374 . 1 1 50 50 THR CA C 13 62.408 . . 1 . . . . 1297 THR CA . 16256 1 375 . 1 1 50 50 THR CB C 13 70.670 . . 1 . . . . 1297 THR CB . 16256 1 376 . 1 1 50 50 THR CG2 C 13 21.529 . . 1 . . . . 1297 THR CG2 . 16256 1 377 . 1 1 50 50 THR N N 15 116.246 . . 1 . . . . 1297 THR N . 16256 1 378 . 1 1 51 51 TYR H H 1 9.254 . . 1 . . . . 1298 TYR H . 16256 1 379 . 1 1 51 51 TYR HA H 1 4.926 . . 1 . . . . 1298 TYR HA . 16256 1 380 . 1 1 51 51 TYR HB2 H 1 2.635 . . 1 . . . . 1298 TYR HB2 . 16256 1 381 . 1 1 51 51 TYR HB3 H 1 2.635 . . 1 . . . . 1298 TYR HB3 . 16256 1 382 . 1 1 51 51 TYR HD1 H 1 6.897 . . 3 . . . . 1298 TYR HD1 . 16256 1 383 . 1 1 51 51 TYR HD2 H 1 6.897 . . 3 . . . . 1298 TYR HD2 . 16256 1 384 . 1 1 51 51 TYR HE1 H 1 6.767 . . 3 . . . . 1298 TYR HE1 . 16256 1 385 . 1 1 51 51 TYR HE2 H 1 6.767 . . 3 . . . . 1298 TYR HE2 . 16256 1 386 . 1 1 51 51 TYR CA C 13 57.483 . . 1 . . . . 1298 TYR CA . 16256 1 387 . 1 1 51 51 TYR CB C 13 40.886 . . 1 . . . . 1298 TYR CB . 16256 1 388 . 1 1 51 51 TYR CD1 C 13 133.731 . . 3 . . . . 1298 TYR CD1 . 16256 1 389 . 1 1 51 51 TYR CD2 C 13 133.731 . . 3 . . . . 1298 TYR CD2 . 16256 1 390 . 1 1 51 51 TYR CE1 C 13 118.145 . . 3 . . . . 1298 TYR CE1 . 16256 1 391 . 1 1 51 51 TYR CE2 C 13 118.145 . . 3 . . . . 1298 TYR CE2 . 16256 1 392 . 1 1 51 51 TYR N N 15 127.449 . . 1 . . . . 1298 TYR N . 16256 1 393 . 1 1 52 52 THR H H 1 8.772 . . 1 . . . . 1299 THR H . 16256 1 394 . 1 1 52 52 THR HA H 1 5.263 . . 1 . . . . 1299 THR HA . 16256 1 395 . 1 1 52 52 THR HB H 1 3.853 . . 1 . . . . 1299 THR HB . 16256 1 396 . 1 1 52 52 THR HG21 H 1 1.162 . . 1 . . . . 1299 THR HG21 . 16256 1 397 . 1 1 52 52 THR HG22 H 1 1.162 . . 1 . . . . 1299 THR HG22 . 16256 1 398 . 1 1 52 52 THR HG23 H 1 1.162 . . 1 . . . . 1299 THR HG23 . 16256 1 399 . 1 1 52 52 THR CA C 13 61.900 . . 1 . . . . 1299 THR CA . 16256 1 400 . 1 1 52 52 THR CB C 13 70.049 . . 1 . . . . 1299 THR CB . 16256 1 401 . 1 1 52 52 THR CG2 C 13 21.759 . . 1 . . . . 1299 THR CG2 . 16256 1 402 . 1 1 52 52 THR N N 15 117.282 . . 1 . . . . 1299 THR N . 16256 1 403 . 1 1 53 53 VAL H H 1 9.394 . . 1 . . . . 1300 VAL H . 16256 1 404 . 1 1 53 53 VAL HA H 1 4.981 . . 1 . . . . 1300 VAL HA . 16256 1 405 . 1 1 53 53 VAL HB H 1 1.680 . . 1 . . . . 1300 VAL HB . 16256 1 406 . 1 1 53 53 VAL HG11 H 1 1.007 . . 2 . . . . 1300 VAL HG11 . 16256 1 407 . 1 1 53 53 VAL HG12 H 1 1.007 . . 2 . . . . 1300 VAL HG12 . 16256 1 408 . 1 1 53 53 VAL HG13 H 1 1.007 . . 2 . . . . 1300 VAL HG13 . 16256 1 409 . 1 1 53 53 VAL HG21 H 1 1.088 . . 2 . . . . 1300 VAL HG21 . 16256 1 410 . 1 1 53 53 VAL HG22 H 1 1.088 . . 2 . . . . 1300 VAL HG22 . 16256 1 411 . 1 1 53 53 VAL HG23 H 1 1.088 . . 2 . . . . 1300 VAL HG23 . 16256 1 412 . 1 1 53 53 VAL CA C 13 60.141 . . 1 . . . . 1300 VAL CA . 16256 1 413 . 1 1 53 53 VAL CB C 13 36.171 . . 1 . . . . 1300 VAL CB . 16256 1 414 . 1 1 53 53 VAL CG1 C 13 22.960 . . 2 . . . . 1300 VAL CG1 . 16256 1 415 . 1 1 53 53 VAL CG2 C 13 22.968 . . 2 . . . . 1300 VAL CG2 . 16256 1 416 . 1 1 53 53 VAL N N 15 127.917 . . 1 . . . . 1300 VAL N . 16256 1 417 . 1 1 54 54 ALA H H 1 9.081 . . 1 . . . . 1301 ALA H . 16256 1 418 . 1 1 54 54 ALA HA H 1 5.360 . . 1 . . . . 1301 ALA HA . 16256 1 419 . 1 1 54 54 ALA HB1 H 1 1.403 . . 1 . . . . 1301 ALA HB1 . 16256 1 420 . 1 1 54 54 ALA HB2 H 1 1.403 . . 1 . . . . 1301 ALA HB2 . 16256 1 421 . 1 1 54 54 ALA HB3 H 1 1.403 . . 1 . . . . 1301 ALA HB3 . 16256 1 422 . 1 1 54 54 ALA CA C 13 49.841 . . 1 . . . . 1301 ALA CA . 16256 1 423 . 1 1 54 54 ALA CB C 13 23.690 . . 1 . . . . 1301 ALA CB . 16256 1 424 . 1 1 54 54 ALA N N 15 127.143 . . 1 . . . . 1301 ALA N . 16256 1 425 . 1 1 55 55 VAL H H 1 8.366 . . 1 . . . . 1302 VAL H . 16256 1 426 . 1 1 55 55 VAL HA H 1 5.103 . . 1 . . . . 1302 VAL HA . 16256 1 427 . 1 1 55 55 VAL HB H 1 1.336 . . 1 . . . . 1302 VAL HB . 16256 1 428 . 1 1 55 55 VAL HG11 H 1 0.476 . . 2 . . . . 1302 VAL HG11 . 16256 1 429 . 1 1 55 55 VAL HG12 H 1 0.476 . . 2 . . . . 1302 VAL HG12 . 16256 1 430 . 1 1 55 55 VAL HG13 H 1 0.476 . . 2 . . . . 1302 VAL HG13 . 16256 1 431 . 1 1 55 55 VAL HG21 H 1 0.058 . . 2 . . . . 1302 VAL HG21 . 16256 1 432 . 1 1 55 55 VAL HG22 H 1 0.058 . . 2 . . . . 1302 VAL HG22 . 16256 1 433 . 1 1 55 55 VAL HG23 H 1 0.058 . . 2 . . . . 1302 VAL HG23 . 16256 1 434 . 1 1 55 55 VAL CA C 13 57.798 . . 1 . . . . 1302 VAL CA . 16256 1 435 . 1 1 55 55 VAL CB C 13 34.997 . . 1 . . . . 1302 VAL CB . 16256 1 436 . 1 1 55 55 VAL CG1 C 13 19.603 . . 2 . . . . 1302 VAL CG1 . 16256 1 437 . 1 1 55 55 VAL CG2 C 13 22.552 . . 2 . . . . 1302 VAL CG2 . 16256 1 438 . 1 1 55 55 VAL N N 15 118.836 . . 1 . . . . 1302 VAL N . 16256 1 439 . 1 1 56 56 TYR H H 1 9.375 . . 1 . . . . 1303 TYR H . 16256 1 440 . 1 1 56 56 TYR HA H 1 5.283 . . 1 . . . . 1303 TYR HA . 16256 1 441 . 1 1 56 56 TYR HB2 H 1 2.699 . . 2 . . . . 1303 TYR HB2 . 16256 1 442 . 1 1 56 56 TYR HB3 H 1 2.592 . . 2 . . . . 1303 TYR HB3 . 16256 1 443 . 1 1 56 56 TYR HD1 H 1 6.779 . . 3 . . . . 1303 TYR HD1 . 16256 1 444 . 1 1 56 56 TYR HD2 H 1 6.779 . . 3 . . . . 1303 TYR HD2 . 16256 1 445 . 1 1 56 56 TYR HE1 H 1 6.688 . . 3 . . . . 1303 TYR HE1 . 16256 1 446 . 1 1 56 56 TYR HE2 H 1 6.688 . . 3 . . . . 1303 TYR HE2 . 16256 1 447 . 1 1 56 56 TYR CA C 13 56.154 . . 1 . . . . 1303 TYR CA . 16256 1 448 . 1 1 56 56 TYR CB C 13 42.587 . . 1 . . . . 1303 TYR CB . 16256 1 449 . 1 1 56 56 TYR CD1 C 13 132.730 . . 3 . . . . 1303 TYR CD1 . 16256 1 450 . 1 1 56 56 TYR CD2 C 13 132.730 . . 3 . . . . 1303 TYR CD2 . 16256 1 451 . 1 1 56 56 TYR CE1 C 13 118.574 . . 3 . . . . 1303 TYR CE1 . 16256 1 452 . 1 1 56 56 TYR CE2 C 13 118.574 . . 3 . . . . 1303 TYR CE2 . 16256 1 453 . 1 1 56 56 TYR N N 15 127.325 . . 1 . . . . 1303 TYR N . 16256 1 454 . 1 1 57 57 PHE H H 1 9.091 . . 1 . . . . 1304 PHE H . 16256 1 455 . 1 1 57 57 PHE HA H 1 4.900 . . 1 . . . . 1304 PHE HA . 16256 1 456 . 1 1 57 57 PHE HB2 H 1 2.708 . . 2 . . . . 1304 PHE HB2 . 16256 1 457 . 1 1 57 57 PHE HB3 H 1 2.740 . . 2 . . . . 1304 PHE HB3 . 16256 1 458 . 1 1 57 57 PHE HD1 H 1 6.947 . . 3 . . . . 1304 PHE HD1 . 16256 1 459 . 1 1 57 57 PHE HD2 H 1 6.947 . . 3 . . . . 1304 PHE HD2 . 16256 1 460 . 1 1 57 57 PHE HE1 H 1 7.289 . . 3 . . . . 1304 PHE HE1 . 16256 1 461 . 1 1 57 57 PHE HE2 H 1 7.289 . . 3 . . . . 1304 PHE HE2 . 16256 1 462 . 1 1 57 57 PHE HZ H 1 7.378 . . 1 . . . . 1304 PHE HZ . 16256 1 463 . 1 1 57 57 PHE CA C 13 56.674 . . 1 . . . . 1304 PHE CA . 16256 1 464 . 1 1 57 57 PHE CB C 13 43.169 . . 1 . . . . 1304 PHE CB . 16256 1 465 . 1 1 57 57 PHE CD1 C 13 131.647 . . 3 . . . . 1304 PHE CD1 . 16256 1 466 . 1 1 57 57 PHE CD2 C 13 131.647 . . 3 . . . . 1304 PHE CD2 . 16256 1 467 . 1 1 57 57 PHE CE1 C 13 131.832 . . 3 . . . . 1304 PHE CE1 . 16256 1 468 . 1 1 57 57 PHE CE2 C 13 131.832 . . 3 . . . . 1304 PHE CE2 . 16256 1 469 . 1 1 57 57 PHE CZ C 13 130.010 . . 1 . . . . 1304 PHE CZ . 16256 1 470 . 1 1 57 57 PHE N N 15 119.480 . . 1 . . . . 1304 PHE N . 16256 1 471 . 1 1 58 58 LYS H H 1 8.986 . . 1 . . . . 1305 LYS H . 16256 1 472 . 1 1 58 58 LYS HA H 1 3.529 . . 1 . . . . 1305 LYS HA . 16256 1 473 . 1 1 58 58 LYS HB2 H 1 1.737 . . 1 . . . . 1305 LYS HB2 . 16256 1 474 . 1 1 58 58 LYS HB3 H 1 1.737 . . 1 . . . . 1305 LYS HB3 . 16256 1 475 . 1 1 58 58 LYS HD2 H 1 1.365 . . 1 . . . . 1305 LYS HD2 . 16256 1 476 . 1 1 58 58 LYS HD3 H 1 1.365 . . 1 . . . . 1305 LYS HD3 . 16256 1 477 . 1 1 58 58 LYS HE2 H 1 2.824 . . 1 . . . . 1305 LYS HE2 . 16256 1 478 . 1 1 58 58 LYS HE3 H 1 2.824 . . 1 . . . . 1305 LYS HE3 . 16256 1 479 . 1 1 58 58 LYS HG2 H 1 -0.059 . . 2 . . . . 1305 LYS HG2 . 16256 1 480 . 1 1 58 58 LYS HG3 H 1 0.672 . . 2 . . . . 1305 LYS HG3 . 16256 1 481 . 1 1 58 58 LYS CA C 13 57.452 . . 1 . . . . 1305 LYS CA . 16256 1 482 . 1 1 58 58 LYS CB C 13 29.633 . . 1 . . . . 1305 LYS CB . 16256 1 483 . 1 1 58 58 LYS CD C 13 29.506 . . 1 . . . . 1305 LYS CD . 16256 1 484 . 1 1 58 58 LYS CE C 13 41.775 . . 1 . . . . 1305 LYS CE . 16256 1 485 . 1 1 58 58 LYS CG C 13 24.231 . . 1 . . . . 1305 LYS CG . 16256 1 486 . 1 1 58 58 LYS N N 15 127.296 . . 1 . . . . 1305 LYS N . 16256 1 487 . 1 1 59 59 GLY H H 1 9.026 . . 1 . . . . 1306 GLY H . 16256 1 488 . 1 1 59 59 GLY HA2 H 1 3.559 . . 2 . . . . 1306 GLY HA2 . 16256 1 489 . 1 1 59 59 GLY HA3 H 1 4.185 . . 2 . . . . 1306 GLY HA3 . 16256 1 490 . 1 1 59 59 GLY CA C 13 45.376 . . 1 . . . . 1306 GLY CA . 16256 1 491 . 1 1 59 59 GLY N N 15 104.195 . . 1 . . . . 1306 GLY N . 16256 1 492 . 1 1 60 60 GLU H H 1 7.669 . . 1 . . . . 1307 GLU H . 16256 1 493 . 1 1 60 60 GLU HA H 1 4.671 . . 1 . . . . 1307 GLU HA . 16256 1 494 . 1 1 60 60 GLU HB2 H 1 2.029 . . 2 . . . . 1307 GLU HB2 . 16256 1 495 . 1 1 60 60 GLU HB3 H 1 1.912 . . 2 . . . . 1307 GLU HB3 . 16256 1 496 . 1 1 60 60 GLU HG2 H 1 2.290 . . 2 . . . . 1307 GLU HG2 . 16256 1 497 . 1 1 60 60 GLU HG3 H 1 2.130 . . 2 . . . . 1307 GLU HG3 . 16256 1 498 . 1 1 60 60 GLU CA C 13 54.251 . . 1 . . . . 1307 GLU CA . 16256 1 499 . 1 1 60 60 GLU CB C 13 32.357 . . 1 . . . . 1307 GLU CB . 16256 1 500 . 1 1 60 60 GLU CG C 13 35.731 . . 1 . . . . 1307 GLU CG . 16256 1 501 . 1 1 60 60 GLU N N 15 120.691 . . 1 . . . . 1307 GLU N . 16256 1 502 . 1 1 61 61 ARG H H 1 8.948 . . 1 . . . . 1308 ARG H . 16256 1 503 . 1 1 61 61 ARG HA H 1 3.595 . . 1 . . . . 1308 ARG HA . 16256 1 504 . 1 1 61 61 ARG HB2 H 1 1.441 . . 1 . . . . 1308 ARG HB2 . 16256 1 505 . 1 1 61 61 ARG HB3 H 1 1.441 . . 1 . . . . 1308 ARG HB3 . 16256 1 506 . 1 1 61 61 ARG HD2 H 1 3.019 . . 1 . . . . 1308 ARG HD2 . 16256 1 507 . 1 1 61 61 ARG HD3 H 1 3.019 . . 1 . . . . 1308 ARG HD3 . 16256 1 508 . 1 1 61 61 ARG HG2 H 1 1.122 . . 1 . . . . 1308 ARG HG2 . 16256 1 509 . 1 1 61 61 ARG HG3 H 1 1.122 . . 1 . . . . 1308 ARG HG3 . 16256 1 510 . 1 1 61 61 ARG CA C 13 56.859 . . 1 . . . . 1308 ARG CA . 16256 1 511 . 1 1 61 61 ARG CB C 13 30.237 . . 1 . . . . 1308 ARG CB . 16256 1 512 . 1 1 61 61 ARG CD C 13 43.959 . . 1 . . . . 1308 ARG CD . 16256 1 513 . 1 1 61 61 ARG CG C 13 26.938 . . 1 . . . . 1308 ARG CG . 16256 1 514 . 1 1 61 61 ARG N N 15 126.247 . . 1 . . . . 1308 ARG N . 16256 1 515 . 1 1 62 62 ILE H H 1 8.914 . . 1 . . . . 1309 ILE H . 16256 1 516 . 1 1 62 62 ILE HA H 1 4.626 . . 1 . . . . 1309 ILE HA . 16256 1 517 . 1 1 62 62 ILE HB H 1 1.857 . . 1 . . . . 1309 ILE HB . 16256 1 518 . 1 1 62 62 ILE HD11 H 1 0.460 . . 1 . . . . 1309 ILE HD11 . 16256 1 519 . 1 1 62 62 ILE HD12 H 1 0.460 . . 1 . . . . 1309 ILE HD12 . 16256 1 520 . 1 1 62 62 ILE HD13 H 1 0.460 . . 1 . . . . 1309 ILE HD13 . 16256 1 521 . 1 1 62 62 ILE HG12 H 1 1.857 . . 1 . . . . 1309 ILE HG12 . 16256 1 522 . 1 1 62 62 ILE HG13 H 1 1.857 . . 1 . . . . 1309 ILE HG13 . 16256 1 523 . 1 1 62 62 ILE HG21 H 1 0.748 . . 1 . . . . 1309 ILE HG21 . 16256 1 524 . 1 1 62 62 ILE HG22 H 1 0.748 . . 1 . . . . 1309 ILE HG22 . 16256 1 525 . 1 1 62 62 ILE HG23 H 1 0.748 . . 1 . . . . 1309 ILE HG23 . 16256 1 526 . 1 1 62 62 ILE CA C 13 61.706 . . 1 . . . . 1309 ILE CA . 16256 1 527 . 1 1 62 62 ILE CB C 13 40.034 . . 1 . . . . 1309 ILE CB . 16256 1 528 . 1 1 62 62 ILE CD1 C 13 14.788 . . 1 . . . . 1309 ILE CD1 . 16256 1 529 . 1 1 62 62 ILE CG1 C 13 26.838 . . 1 . . . . 1309 ILE CG1 . 16256 1 530 . 1 1 62 62 ILE CG2 C 13 18.216 . . 1 . . . . 1309 ILE CG2 . 16256 1 531 . 1 1 62 62 ILE N N 15 122.118 . . 1 . . . . 1309 ILE N . 16256 1 532 . 1 1 63 63 GLY H H 1 7.290 . . 1 . . . . 1310 GLY H . 16256 1 533 . 1 1 63 63 GLY HA2 H 1 3.817 . . 1 . . . . 1310 GLY HA2 . 16256 1 534 . 1 1 63 63 GLY HA3 H 1 3.817 . . 1 . . . . 1310 GLY HA3 . 16256 1 535 . 1 1 63 63 GLY CA C 13 45.571 . . 1 . . . . 1310 GLY CA . 16256 1 536 . 1 1 63 63 GLY N N 15 106.793 . . 1 . . . . 1310 GLY N . 16256 1 537 . 1 1 66 66 LYS HA H 1 6.092 . . 1 . . . . 1313 LYS HA . 16256 1 538 . 1 1 66 66 LYS HB2 H 1 1.875 . . 2 . . . . 1313 LYS HB2 . 16256 1 539 . 1 1 66 66 LYS HB3 H 1 1.670 . . 2 . . . . 1313 LYS HB3 . 16256 1 540 . 1 1 66 66 LYS HD2 H 1 1.550 . . 1 . . . . 1313 LYS HD2 . 16256 1 541 . 1 1 66 66 LYS HD3 H 1 1.550 . . 1 . . . . 1313 LYS HD3 . 16256 1 542 . 1 1 66 66 LYS HG2 H 1 1.310 . . 2 . . . . 1313 LYS HG2 . 16256 1 543 . 1 1 66 66 LYS HG3 H 1 1.350 . . 2 . . . . 1313 LYS HG3 . 16256 1 544 . 1 1 66 66 LYS CA C 13 54.175 . . 1 . . . . 1313 LYS CA . 16256 1 545 . 1 1 66 66 LYS CB C 13 37.236 . . 1 . . . . 1313 LYS CB . 16256 1 546 . 1 1 66 66 LYS CD C 13 29.730 . . 1 . . . . 1313 LYS CD . 16256 1 547 . 1 1 66 66 LYS CG C 13 24.840 . . 1 . . . . 1313 LYS CG . 16256 1 548 . 1 1 67 67 GLY H H 1 8.592 . . 1 . . . . 1314 GLY H . 16256 1 549 . 1 1 67 67 GLY HA2 H 1 4.186 . . 2 . . . . 1314 GLY HA2 . 16256 1 550 . 1 1 67 67 GLY HA3 H 1 4.044 . . 2 . . . . 1314 GLY HA3 . 16256 1 551 . 1 1 67 67 GLY CA C 13 46.144 . . 1 . . . . 1314 GLY CA . 16256 1 552 . 1 1 67 67 GLY N N 15 105.704 . . 1 . . . . 1314 GLY N . 16256 1 553 . 1 1 68 68 PRO HB2 H 1 2.404 . . 2 . . . . 1315 PRO HB2 . 16256 1 554 . 1 1 68 68 PRO HB3 H 1 2.322 . . 2 . . . . 1315 PRO HB3 . 16256 1 555 . 1 1 68 68 PRO HD2 H 1 3.717 . . 2 . . . . 1315 PRO HD2 . 16256 1 556 . 1 1 68 68 PRO HD3 H 1 3.496 . . 2 . . . . 1315 PRO HD3 . 16256 1 557 . 1 1 68 68 PRO HG2 H 1 2.080 . . 2 . . . . 1315 PRO HG2 . 16256 1 558 . 1 1 68 68 PRO HG3 H 1 2.177 . . 2 . . . . 1315 PRO HG3 . 16256 1 559 . 1 1 68 68 PRO CB C 13 31.890 . . 1 . . . . 1315 PRO CB . 16256 1 560 . 1 1 68 68 PRO CD C 13 50.014 . . 1 . . . . 1315 PRO CD . 16256 1 561 . 1 1 68 68 PRO CG C 13 26.374 . . 1 . . . . 1315 PRO CG . 16256 1 562 . 1 1 69 69 SER H H 1 8.396 . . 1 . . . . 1316 SER H . 16256 1 563 . 1 1 69 69 SER HA H 1 4.598 . . 1 . . . . 1316 SER HA . 16256 1 564 . 1 1 69 69 SER HB2 H 1 4.080 . . 1 . . . . 1316 SER HB2 . 16256 1 565 . 1 1 69 69 SER HB3 H 1 4.080 . . 1 . . . . 1316 SER HB3 . 16256 1 566 . 1 1 69 69 SER CA C 13 56.338 . . 1 . . . . 1316 SER CA . 16256 1 567 . 1 1 69 69 SER CB C 13 66.562 . . 1 . . . . 1316 SER CB . 16256 1 568 . 1 1 69 69 SER N N 15 124.307 . . 1 . . . . 1316 SER N . 16256 1 569 . 1 1 70 70 ILE H H 1 8.527 . . 1 . . . . 1317 ILE H . 16256 1 570 . 1 1 70 70 ILE HA H 1 3.138 . . 1 . . . . 1317 ILE HA . 16256 1 571 . 1 1 70 70 ILE HB H 1 1.358 . . 1 . . . . 1317 ILE HB . 16256 1 572 . 1 1 70 70 ILE HD11 H 1 0.657 . . 1 . . . . 1317 ILE HD11 . 16256 1 573 . 1 1 70 70 ILE HD12 H 1 0.657 . . 1 . . . . 1317 ILE HD12 . 16256 1 574 . 1 1 70 70 ILE HD13 H 1 0.657 . . 1 . . . . 1317 ILE HD13 . 16256 1 575 . 1 1 70 70 ILE HG12 H 1 0.460 . . 2 . . . . 1317 ILE HG12 . 16256 1 576 . 1 1 70 70 ILE HG13 H 1 0.654 . . 2 . . . . 1317 ILE HG13 . 16256 1 577 . 1 1 70 70 ILE HG21 H 1 0.615 . . 1 . . . . 1317 ILE HG21 . 16256 1 578 . 1 1 70 70 ILE HG22 H 1 0.615 . . 1 . . . . 1317 ILE HG22 . 16256 1 579 . 1 1 70 70 ILE HG23 H 1 0.615 . . 1 . . . . 1317 ILE HG23 . 16256 1 580 . 1 1 70 70 ILE CA C 13 65.143 . . 1 . . . . 1317 ILE CA . 16256 1 581 . 1 1 70 70 ILE CB C 13 37.278 . . 1 . . . . 1317 ILE CB . 16256 1 582 . 1 1 70 70 ILE CD1 C 13 12.830 . . 1 . . . . 1317 ILE CD1 . 16256 1 583 . 1 1 70 70 ILE CG1 C 13 29.190 . . 1 . . . . 1317 ILE CG1 . 16256 1 584 . 1 1 70 70 ILE CG2 C 13 17.137 . . 1 . . . . 1317 ILE CG2 . 16256 1 585 . 1 1 70 70 ILE N N 15 124.291 . . 1 . . . . 1317 ILE N . 16256 1 586 . 1 1 71 71 GLN H H 1 8.439 . . 1 . . . . 1318 GLN H . 16256 1 587 . 1 1 71 71 GLN HA H 1 3.893 . . 1 . . . . 1318 GLN HA . 16256 1 588 . 1 1 71 71 GLN HB2 H 1 2.014 . . 2 . . . . 1318 GLN HB2 . 16256 1 589 . 1 1 71 71 GLN HB3 H 1 1.906 . . 2 . . . . 1318 GLN HB3 . 16256 1 590 . 1 1 71 71 GLN HE21 H 1 7.420 . . 1 . . . . 1318 GLN HE21 . 16256 1 591 . 1 1 71 71 GLN HG2 H 1 2.330 . . 1 . . . . 1318 GLN HG2 . 16256 1 592 . 1 1 71 71 GLN HG3 H 1 2.330 . . 1 . . . . 1318 GLN HG3 . 16256 1 593 . 1 1 71 71 GLN CA C 13 59.719 . . 1 . . . . 1318 GLN CA . 16256 1 594 . 1 1 71 71 GLN CB C 13 28.158 . . 1 . . . . 1318 GLN CB . 16256 1 595 . 1 1 71 71 GLN CG C 13 30.380 . . 1 . . . . 1318 GLN CG . 16256 1 596 . 1 1 71 71 GLN N N 15 118.095 . . 1 . . . . 1318 GLN N . 16256 1 597 . 1 1 71 71 GLN NE2 N 15 112.240 . . 1 . . . . 1318 GLN NE2 . 16256 1 598 . 1 1 72 72 GLN H H 1 7.813 . . 1 . . . . 1319 GLN H . 16256 1 599 . 1 1 72 72 GLN HA H 1 3.890 . . 1 . . . . 1319 GLN HA . 16256 1 600 . 1 1 72 72 GLN HB2 H 1 2.018 . . 2 . . . . 1319 GLN HB2 . 16256 1 601 . 1 1 72 72 GLN HB3 H 1 1.899 . . 2 . . . . 1319 GLN HB3 . 16256 1 602 . 1 1 72 72 GLN HG2 H 1 2.420 . . 2 . . . . 1319 GLN HG2 . 16256 1 603 . 1 1 72 72 GLN HG3 H 1 2.320 . . 2 . . . . 1319 GLN HG3 . 16256 1 604 . 1 1 72 72 GLN CA C 13 59.600 . . 1 . . . . 1319 GLN CA . 16256 1 605 . 1 1 72 72 GLN CB C 13 27.953 . . 1 . . . . 1319 GLN CB . 16256 1 606 . 1 1 72 72 GLN CG C 13 34.020 . . 1 . . . . 1319 GLN CG . 16256 1 607 . 1 1 72 72 GLN N N 15 116.836 . . 1 . . . . 1319 GLN N . 16256 1 608 . 1 1 73 73 ALA H H 1 8.127 . . 1 . . . . 1320 ALA H . 16256 1 609 . 1 1 73 73 ALA HA H 1 3.875 . . 1 . . . . 1320 ALA HA . 16256 1 610 . 1 1 73 73 ALA HB1 H 1 1.444 . . 1 . . . . 1320 ALA HB1 . 16256 1 611 . 1 1 73 73 ALA HB2 H 1 1.444 . . 1 . . . . 1320 ALA HB2 . 16256 1 612 . 1 1 73 73 ALA HB3 H 1 1.444 . . 1 . . . . 1320 ALA HB3 . 16256 1 613 . 1 1 73 73 ALA CA C 13 55.914 . . 1 . . . . 1320 ALA CA . 16256 1 614 . 1 1 73 73 ALA CB C 13 18.717 . . 1 . . . . 1320 ALA CB . 16256 1 615 . 1 1 73 73 ALA N N 15 124.208 . . 1 . . . . 1320 ALA N . 16256 1 616 . 1 1 74 74 GLU H H 1 8.792 . . 1 . . . . 1321 GLU H . 16256 1 617 . 1 1 74 74 GLU HA H 1 3.807 . . 1 . . . . 1321 GLU HA . 16256 1 618 . 1 1 74 74 GLU HB2 H 1 1.172 . . 2 . . . . 1321 GLU HB2 . 16256 1 619 . 1 1 74 74 GLU HB3 H 1 2.141 . . 2 . . . . 1321 GLU HB3 . 16256 1 620 . 1 1 74 74 GLU HG2 H 1 1.875 . . 2 . . . . 1321 GLU HG2 . 16256 1 621 . 1 1 74 74 GLU HG3 H 1 2.513 . . 2 . . . . 1321 GLU HG3 . 16256 1 622 . 1 1 74 74 GLU CA C 13 59.825 . . 1 . . . . 1321 GLU CA . 16256 1 623 . 1 1 74 74 GLU CB C 13 30.229 . . 1 . . . . 1321 GLU CB . 16256 1 624 . 1 1 74 74 GLU CG C 13 36.957 . . 1 . . . . 1321 GLU CG . 16256 1 625 . 1 1 74 74 GLU N N 15 117.744 . . 1 . . . . 1321 GLU N . 16256 1 626 . 1 1 75 75 MET H H 1 7.738 . . 1 . . . . 1322 MET H . 16256 1 627 . 1 1 75 75 MET HA H 1 4.083 . . 1 . . . . 1322 MET HA . 16256 1 628 . 1 1 75 75 MET HB2 H 1 2.283 . . 2 . . . . 1322 MET HB2 . 16256 1 629 . 1 1 75 75 MET HB3 H 1 2.427 . . 2 . . . . 1322 MET HB3 . 16256 1 630 . 1 1 75 75 MET HE1 H 1 2.155 . . 1 . . . . 1322 MET HE1 . 16256 1 631 . 1 1 75 75 MET HE2 H 1 2.155 . . 1 . . . . 1322 MET HE2 . 16256 1 632 . 1 1 75 75 MET HE3 H 1 2.155 . . 1 . . . . 1322 MET HE3 . 16256 1 633 . 1 1 75 75 MET HG2 H 1 2.779 . . 2 . . . . 1322 MET HG2 . 16256 1 634 . 1 1 75 75 MET HG3 H 1 2.631 . . 2 . . . . 1322 MET HG3 . 16256 1 635 . 1 1 75 75 MET CA C 13 58.897 . . 1 . . . . 1322 MET CA . 16256 1 636 . 1 1 75 75 MET CB C 13 32.328 . . 1 . . . . 1322 MET CB . 16256 1 637 . 1 1 75 75 MET CE C 13 17.764 . . 1 . . . . 1322 MET CE . 16256 1 638 . 1 1 75 75 MET CG C 13 32.580 . . 1 . . . . 1322 MET CG . 16256 1 639 . 1 1 75 75 MET N N 15 116.639 . . 1 . . . . 1322 MET N . 16256 1 640 . 1 1 76 76 GLY H H 1 8.226 . . 1 . . . . 1323 GLY H . 16256 1 641 . 1 1 76 76 GLY HA2 H 1 3.970 . . 1 . . . . 1323 GLY HA2 . 16256 1 642 . 1 1 76 76 GLY HA3 H 1 3.970 . . 1 . . . . 1323 GLY HA3 . 16256 1 643 . 1 1 76 76 GLY CA C 13 47.517 . . 1 . . . . 1323 GLY CA . 16256 1 644 . 1 1 76 76 GLY N N 15 106.218 . . 1 . . . . 1323 GLY N . 16256 1 645 . 1 1 77 77 ALA H H 1 8.657 . . 1 . . . . 1324 ALA H . 16256 1 646 . 1 1 77 77 ALA HA H 1 3.885 . . 1 . . . . 1324 ALA HA . 16256 1 647 . 1 1 77 77 ALA HB1 H 1 1.498 . . 1 . . . . 1324 ALA HB1 . 16256 1 648 . 1 1 77 77 ALA HB2 H 1 1.498 . . 1 . . . . 1324 ALA HB2 . 16256 1 649 . 1 1 77 77 ALA HB3 H 1 1.498 . . 1 . . . . 1324 ALA HB3 . 16256 1 650 . 1 1 77 77 ALA CA C 13 55.377 . . 1 . . . . 1324 ALA CA . 16256 1 651 . 1 1 77 77 ALA CB C 13 17.809 . . 1 . . . . 1324 ALA CB . 16256 1 652 . 1 1 77 77 ALA N N 15 127.613 . . 1 . . . . 1324 ALA N . 16256 1 653 . 1 1 78 78 ALA H H 1 8.392 . . 1 . . . . 1325 ALA H . 16256 1 654 . 1 1 78 78 ALA HA H 1 4.120 . . 1 . . . . 1325 ALA HA . 16256 1 655 . 1 1 78 78 ALA HB1 H 1 1.599 . . 1 . . . . 1325 ALA HB1 . 16256 1 656 . 1 1 78 78 ALA HB2 H 1 1.599 . . 1 . . . . 1325 ALA HB2 . 16256 1 657 . 1 1 78 78 ALA HB3 H 1 1.599 . . 1 . . . . 1325 ALA HB3 . 16256 1 658 . 1 1 78 78 ALA CA C 13 55.377 . . 1 . . . . 1325 ALA CA . 16256 1 659 . 1 1 78 78 ALA CB C 13 17.702 . . 1 . . . . 1325 ALA CB . 16256 1 660 . 1 1 78 78 ALA N N 15 119.784 . . 1 . . . . 1325 ALA N . 16256 1 661 . 1 1 80 80 ASP HA H 1 4.435 . . 1 . . . . 1327 ASP HA . 16256 1 662 . 1 1 80 80 ASP HB2 H 1 2.962 . . 1 . . . . 1327 ASP HB2 . 16256 1 663 . 1 1 80 80 ASP HB3 H 1 2.962 . . 1 . . . . 1327 ASP HB3 . 16256 1 664 . 1 1 80 80 ASP CA C 13 57.795 . . 1 . . . . 1327 ASP CA . 16256 1 665 . 1 1 80 80 ASP CB C 13 43.320 . . 1 . . . . 1327 ASP CB . 16256 1 666 . 1 1 81 81 ALA H H 1 8.140 . . 1 . . . . 1328 ALA H . 16256 1 667 . 1 1 81 81 ALA HA H 1 4.376 . . 1 . . . . 1328 ALA HA . 16256 1 668 . 1 1 81 81 ALA HB1 H 1 1.263 . . 1 . . . . 1328 ALA HB1 . 16256 1 669 . 1 1 81 81 ALA HB2 H 1 1.263 . . 1 . . . . 1328 ALA HB2 . 16256 1 670 . 1 1 81 81 ALA HB3 H 1 1.263 . . 1 . . . . 1328 ALA HB3 . 16256 1 671 . 1 1 81 81 ALA CA C 13 54.789 . . 1 . . . . 1328 ALA CA . 16256 1 672 . 1 1 81 81 ALA CB C 13 19.794 . . 1 . . . . 1328 ALA CB . 16256 1 673 . 1 1 81 81 ALA N N 15 119.778 . . 1 . . . . 1328 ALA N . 16256 1 674 . 1 1 82 82 LEU H H 1 8.405 . . 1 . . . . 1329 LEU H . 16256 1 675 . 1 1 82 82 LEU HA H 1 4.163 . . 1 . . . . 1329 LEU HA . 16256 1 676 . 1 1 82 82 LEU HB2 H 1 2.037 . . 1 . . . . 1329 LEU HB2 . 16256 1 677 . 1 1 82 82 LEU HB3 H 1 2.037 . . 1 . . . . 1329 LEU HB3 . 16256 1 678 . 1 1 82 82 LEU HD11 H 1 0.774 . . 2 . . . . 1329 LEU HD11 . 16256 1 679 . 1 1 82 82 LEU HD12 H 1 0.774 . . 2 . . . . 1329 LEU HD12 . 16256 1 680 . 1 1 82 82 LEU HD13 H 1 0.774 . . 2 . . . . 1329 LEU HD13 . 16256 1 681 . 1 1 82 82 LEU HD21 H 1 0.945 . . 2 . . . . 1329 LEU HD21 . 16256 1 682 . 1 1 82 82 LEU HD22 H 1 0.945 . . 2 . . . . 1329 LEU HD22 . 16256 1 683 . 1 1 82 82 LEU HD23 H 1 0.945 . . 2 . . . . 1329 LEU HD23 . 16256 1 684 . 1 1 82 82 LEU HG H 1 1.511 . . 1 . . . . 1329 LEU HG . 16256 1 685 . 1 1 82 82 LEU CA C 13 57.894 . . 1 . . . . 1329 LEU CA . 16256 1 686 . 1 1 82 82 LEU CB C 13 42.509 . . 1 . . . . 1329 LEU CB . 16256 1 687 . 1 1 82 82 LEU CD1 C 13 23.780 . . 2 . . . . 1329 LEU CD1 . 16256 1 688 . 1 1 82 82 LEU CD2 C 13 26.087 . . 2 . . . . 1329 LEU CD2 . 16256 1 689 . 1 1 82 82 LEU CG C 13 26.037 . . 1 . . . . 1329 LEU CG . 16256 1 690 . 1 1 82 82 LEU N N 15 116.681 . . 1 . . . . 1329 LEU N . 16256 1 691 . 1 1 83 83 GLU H H 1 7.847 . . 1 . . . . 1330 GLU H . 16256 1 692 . 1 1 83 83 GLU HA H 1 4.221 . . 1 . . . . 1330 GLU HA . 16256 1 693 . 1 1 83 83 GLU HB2 H 1 2.226 . . 2 . . . . 1330 GLU HB2 . 16256 1 694 . 1 1 83 83 GLU HB3 H 1 1.649 . . 2 . . . . 1330 GLU HB3 . 16256 1 695 . 1 1 83 83 GLU HG2 H 1 2.509 . . 2 . . . . 1330 GLU HG2 . 16256 1 696 . 1 1 83 83 GLU HG3 H 1 2.299 . . 2 . . . . 1330 GLU HG3 . 16256 1 697 . 1 1 83 83 GLU CA C 13 58.559 . . 1 . . . . 1330 GLU CA . 16256 1 698 . 1 1 83 83 GLU CB C 13 30.505 . . 1 . . . . 1330 GLU CB . 16256 1 699 . 1 1 83 83 GLU CG C 13 36.720 . . 1 . . . . 1330 GLU CG . 16256 1 700 . 1 1 83 83 GLU N N 15 117.788 . . 1 . . . . 1330 GLU N . 16256 1 701 . 1 1 84 84 LYS H H 1 7.920 . . 1 . . . . 1331 LYS H . 16256 1 702 . 1 1 84 84 LYS HA H 1 4.249 . . 1 . . . . 1331 LYS HA . 16256 1 703 . 1 1 84 84 LYS HB2 H 1 1.877 . . 1 . . . . 1331 LYS HB2 . 16256 1 704 . 1 1 84 84 LYS HB3 H 1 1.877 . . 1 . . . . 1331 LYS HB3 . 16256 1 705 . 1 1 84 84 LYS HD2 H 1 1.642 . . 1 . . . . 1331 LYS HD2 . 16256 1 706 . 1 1 84 84 LYS HD3 H 1 1.642 . . 1 . . . . 1331 LYS HD3 . 16256 1 707 . 1 1 84 84 LYS HE2 H 1 2.997 . . 1 . . . . 1331 LYS HE2 . 16256 1 708 . 1 1 84 84 LYS HE3 H 1 2.997 . . 1 . . . . 1331 LYS HE3 . 16256 1 709 . 1 1 84 84 LYS HG2 H 1 1.471 . . 1 . . . . 1331 LYS HG2 . 16256 1 710 . 1 1 84 84 LYS HG3 H 1 1.471 . . 1 . . . . 1331 LYS HG3 . 16256 1 711 . 1 1 84 84 LYS CA C 13 58.095 . . 1 . . . . 1331 LYS CA . 16256 1 712 . 1 1 84 84 LYS CB C 13 34.611 . . 1 . . . . 1331 LYS CB . 16256 1 713 . 1 1 84 84 LYS CD C 13 28.888 . . 1 . . . . 1331 LYS CD . 16256 1 714 . 1 1 84 84 LYS CE C 13 42.478 . . 1 . . . . 1331 LYS CE . 16256 1 715 . 1 1 84 84 LYS CG C 13 25.839 . . 1 . . . . 1331 LYS CG . 16256 1 716 . 1 1 84 84 LYS N N 15 117.419 . . 1 . . . . 1331 LYS N . 16256 1 717 . 1 1 85 85 TYR H H 1 8.496 . . 1 . . . . 1332 TYR H . 16256 1 718 . 1 1 85 85 TYR HA H 1 4.222 . . 1 . . . . 1332 TYR HA . 16256 1 719 . 1 1 85 85 TYR HB2 H 1 2.658 . . 2 . . . . 1332 TYR HB2 . 16256 1 720 . 1 1 85 85 TYR HB3 H 1 2.761 . . 2 . . . . 1332 TYR HB3 . 16256 1 721 . 1 1 85 85 TYR HD1 H 1 6.340 . . 3 . . . . 1332 TYR HD1 . 16256 1 722 . 1 1 85 85 TYR HD2 H 1 6.340 . . 3 . . . . 1332 TYR HD2 . 16256 1 723 . 1 1 85 85 TYR HE1 H 1 6.555 . . 3 . . . . 1332 TYR HE1 . 16256 1 724 . 1 1 85 85 TYR HE2 H 1 6.555 . . 3 . . . . 1332 TYR HE2 . 16256 1 725 . 1 1 85 85 TYR CA C 13 59.116 . . 1 . . . . 1332 TYR CA . 16256 1 726 . 1 1 85 85 TYR CB C 13 39.234 . . 1 . . . . 1332 TYR CB . 16256 1 727 . 1 1 85 85 TYR CD1 C 13 133.093 . . 3 . . . . 1332 TYR CD1 . 16256 1 728 . 1 1 85 85 TYR CD2 C 13 133.093 . . 3 . . . . 1332 TYR CD2 . 16256 1 729 . 1 1 85 85 TYR CE1 C 13 118.018 . . 3 . . . . 1332 TYR CE1 . 16256 1 730 . 1 1 85 85 TYR CE2 C 13 118.018 . . 3 . . . . 1332 TYR CE2 . 16256 1 731 . 1 1 85 85 TYR N N 15 121.294 . . 1 . . . . 1332 TYR N . 16256 1 732 . 1 1 86 86 ASN H H 1 7.566 . . 1 . . . . 1333 ASN H . 16256 1 733 . 1 1 86 86 ASN HA H 1 4.650 . . 1 . . . . 1333 ASN HA . 16256 1 734 . 1 1 86 86 ASN HB2 H 1 2.472 . . 2 . . . . 1333 ASN HB2 . 16256 1 735 . 1 1 86 86 ASN HB3 H 1 2.634 . . 2 . . . . 1333 ASN HB3 . 16256 1 736 . 1 1 86 86 ASN HD21 H 1 7.417 . . 1 . . . . 1333 ASN HD21 . 16256 1 737 . 1 1 86 86 ASN HD22 H 1 6.734 . . 1 . . . . 1333 ASN HD22 . 16256 1 738 . 1 1 86 86 ASN CA C 13 52.651 . . 1 . . . . 1333 ASN CA . 16256 1 739 . 1 1 86 86 ASN CB C 13 38.228 . . 1 . . . . 1333 ASN CB . 16256 1 740 . 1 1 86 86 ASN N N 15 121.137 . . 1 . . . . 1333 ASN N . 16256 1 741 . 1 1 86 86 ASN ND2 N 15 111.857 . . 1 . . . . 1333 ASN ND2 . 16256 1 742 . 1 1 87 87 PHE H H 1 8.061 . . 1 . . . . 1334 PHE H . 16256 1 743 . 1 1 87 87 PHE HB2 H 1 3.145 . . 2 . . . . 1334 PHE HB2 . 16256 1 744 . 1 1 87 87 PHE HB3 H 1 2.899 . . 2 . . . . 1334 PHE HB3 . 16256 1 745 . 1 1 87 87 PHE HD1 H 1 7.286 . . 3 . . . . 1334 PHE HD1 . 16256 1 746 . 1 1 87 87 PHE HD2 H 1 7.286 . . 3 . . . . 1334 PHE HD2 . 16256 1 747 . 1 1 87 87 PHE HE1 H 1 7.050 . . 3 . . . . 1334 PHE HE1 . 16256 1 748 . 1 1 87 87 PHE HE2 H 1 7.050 . . 3 . . . . 1334 PHE HE2 . 16256 1 749 . 1 1 87 87 PHE HZ H 1 6.720 . . 1 . . . . 1334 PHE HZ . 16256 1 750 . 1 1 87 87 PHE CA C 13 57.621 . . 1 . . . . 1334 PHE CA . 16256 1 751 . 1 1 87 87 PHE CB C 13 38.648 . . 1 . . . . 1334 PHE CB . 16256 1 752 . 1 1 87 87 PHE CD1 C 13 132.000 . . 3 . . . . 1334 PHE CD1 . 16256 1 753 . 1 1 87 87 PHE CD2 C 13 132.000 . . 3 . . . . 1334 PHE CD2 . 16256 1 754 . 1 1 87 87 PHE CE1 C 13 131.860 . . 3 . . . . 1334 PHE CE1 . 16256 1 755 . 1 1 87 87 PHE CE2 C 13 131.860 . . 3 . . . . 1334 PHE CE2 . 16256 1 756 . 1 1 87 87 PHE CZ C 13 129.928 . . 1 . . . . 1334 PHE CZ . 16256 1 757 . 1 1 87 87 PHE N N 15 122.039 . . 1 . . . . 1334 PHE N . 16256 1 758 . 1 1 88 88 PRO HA H 1 4.391 . . 1 . . . . 1335 PRO HA . 16256 1 759 . 1 1 88 88 PRO HB2 H 1 2.310 . . 1 . . . . 1335 PRO HB2 . 16256 1 760 . 1 1 88 88 PRO HB3 H 1 2.310 . . 1 . . . . 1335 PRO HB3 . 16256 1 761 . 1 1 88 88 PRO HD2 H 1 3.832 . . 1 . . . . 1335 PRO HD2 . 16256 1 762 . 1 1 88 88 PRO HD3 H 1 3.832 . . 1 . . . . 1335 PRO HD3 . 16256 1 763 . 1 1 88 88 PRO HG2 H 1 2.046 . . 1 . . . . 1335 PRO HG2 . 16256 1 764 . 1 1 88 88 PRO HG3 H 1 2.046 . . 1 . . . . 1335 PRO HG3 . 16256 1 765 . 1 1 88 88 PRO CA C 13 64.034 . . 1 . . . . 1335 PRO CA . 16256 1 766 . 1 1 88 88 PRO CB C 13 31.913 . . 1 . . . . 1335 PRO CB . 16256 1 767 . 1 1 88 88 PRO CD C 13 50.720 . . 1 . . . . 1335 PRO CD . 16256 1 768 . 1 1 88 88 PRO CG C 13 27.653 . . 1 . . . . 1335 PRO CG . 16256 1 769 . 1 1 89 89 GLN H H 1 8.455 . . 1 . . . . 1336 GLN H . 16256 1 770 . 1 1 89 89 GLN HA H 1 4.273 . . 1 . . . . 1336 GLN HA . 16256 1 771 . 1 1 89 89 GLN HB2 H 1 1.960 . . 1 . . . . 1336 GLN HB2 . 16256 1 772 . 1 1 89 89 GLN HB3 H 1 1.960 . . 1 . . . . 1336 GLN HB3 . 16256 1 773 . 1 1 89 89 GLN HE21 H 1 6.839 . . 1 . . . . 1336 GLN HE21 . 16256 1 774 . 1 1 89 89 GLN HE22 H 1 7.655 . . 1 . . . . 1336 GLN HE22 . 16256 1 775 . 1 1 89 89 GLN HG2 H 1 2.381 . . 2 . . . . 1336 GLN HG2 . 16256 1 776 . 1 1 89 89 GLN HG3 H 1 2.270 . . 2 . . . . 1336 GLN HG3 . 16256 1 777 . 1 1 89 89 GLN CA C 13 56.242 . . 1 . . . . 1336 GLN CA . 16256 1 778 . 1 1 89 89 GLN CB C 13 29.172 . . 1 . . . . 1336 GLN CB . 16256 1 779 . 1 1 89 89 GLN CG C 13 33.961 . . 1 . . . . 1336 GLN CG . 16256 1 780 . 1 1 89 89 GLN N N 15 118.313 . . 1 . . . . 1336 GLN N . 16256 1 781 . 1 1 89 89 GLN NE2 N 15 112.462 . . 1 . . . . 1336 GLN NE2 . 16256 1 782 . 1 1 90 90 MET H H 1 8.178 . . 1 . . . . 1337 MET H . 16256 1 783 . 1 1 90 90 MET CA C 13 55.755 . . 1 . . . . 1337 MET CA . 16256 1 784 . 1 1 90 90 MET CB C 13 32.973 . . 1 . . . . 1337 MET CB . 16256 1 785 . 1 1 90 90 MET N N 15 120.288 . . 1 . . . . 1337 MET N . 16256 1 stop_ save_