data_11400 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 11400 _Entry.Title ; Solution Structure of the RNA recognition motif in Arginine/serine-rich splicing factor 10 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2010-09-09 _Entry.Accession_date 2010-09-09 _Entry.Last_release_date 2011-09-08 _Entry.Original_release_date 2011-09-08 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.0.9.14 _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 T. Someya . . . 11400 2 Y. Muto . . . 11400 3 M. Inoue . . . 11400 4 T. Kigawa . . . 11400 5 T. Terada . . . 11400 6 M. Shirouzu . . . 11400 7 S. Yokoyama . . . 11400 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 . 'Protein 3000' 'RIKEN Structural Genomics/Proteomics Initiative (RSGI)' . 11400 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 11400 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 365 11400 '15N chemical shifts' 84 11400 '1H chemical shifts' 564 11400 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2011-09-08 2010-09-09 original author . 11400 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 11400 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title ; Solution Structure of the RNA recognition motif in Arginine/serine-rich splicing factor 10 ; _Citation.Status 'in preparation' _Citation.Type journal _Citation.Journal_abbrev . _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _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 . _Citation.Page_last . _Citation.Year . _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 T. Someya . . . 11400 1 2 Y. Muto . . . 11400 1 3 M. Inoue . . . 11400 1 4 T. Kigawa . . . 11400 1 5 T. Terada . . . 11400 1 6 M. Shirouzu . . . 11400 1 7 S. Yokoyama . . . 11400 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 11400 _Assembly.ID 1 _Assembly.Name 'Arginine/serine-rich splicing factor 10' _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 'RNA recognition motif' 1 $entity_1 A . yes native no no . . . 11400 1 stop_ loop_ _Assembly_db_link.Author_supplied _Assembly_db_link.Database_code _Assembly_db_link.Accession_code _Assembly_db_link.Entry_mol_code _Assembly_db_link.Entry_mol_name _Assembly_db_link.Entry_experimental_method _Assembly_db_link.Entry_structure_resolution _Assembly_db_link.Entry_relation_type _Assembly_db_link.Entry_details _Assembly_db_link.Entry_ID _Assembly_db_link.Assembly_ID yes PDB 2cqc . . . . . . 11400 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 11400 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'RNA recognition motif' _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 ; GSSGSSGNRANPDPNCCLGV FGLSLYTTERDLREVFSKYG PIADVSIVYDQQSRRSRGFA FVYFENVDDAKEAKERANGM ELDGRRIRVSGPSSG ; _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 95 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-26 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 11409 . "RNA recognition motif" . . . . . 93.68 99 100.00 100.00 8.99e-57 . . . . 11400 1 2 no BMRB 11410 . "RNA recognition motif" . . . . . 93.68 99 100.00 100.00 8.99e-57 . . . . 11400 1 3 no BMRB 11411 . "RNA recognition motif" . . . . . 93.68 99 100.00 100.00 8.99e-57 . . . . 11400 1 4 no BMRB 11412 . "RNA recognition motif" . . . . . 93.68 99 100.00 100.00 8.99e-57 . . . . 11400 1 5 no BMRB 16920 . Tra2beta1 . . . . . 87.37 95 100.00 100.00 7.27e-53 . . . . 11400 1 6 no PDB 2CQC . "Solution Structure Of The Rna Recognition Motif In ArginineSERINE-Rich Splicing Factor 10" . . . . . 100.00 95 100.00 100.00 8.42e-61 . . . . 11400 1 7 no PDB 2KXN . "Nmr Structure Of Human Tra2beta1 Rrm In Complex With Aagaac Rna" . . . . . 87.37 129 100.00 100.00 9.00e-54 . . . . 11400 1 8 no PDB 2RRA . "Solution Structure Of Rna Binding Domain In Human Tra2 Beta Protein In Complex With Rna (Gaagaa)" . . . . . 93.68 99 100.00 100.00 8.99e-57 . . . . 11400 1 9 no DBJ BAA08556 . "RNA binding protein (transformer-2-like) [Rattus norvegicus]" . . . . . 87.37 288 100.00 100.00 1.05e-52 . . . . 11400 1 10 no DBJ BAC05256 . "unnamed protein product [Homo sapiens]" . . . . . 87.37 252 100.00 100.00 3.24e-52 . . . . 11400 1 11 no DBJ BAC33819 . "unnamed protein product [Mus musculus]" . . . . . 87.37 288 100.00 100.00 1.05e-52 . . . . 11400 1 12 no DBJ BAD92445 . "splicing factor, arginine/serine-rich 10 (transformer 2 homolog, Drosophila) variant [Homo sapiens]" . . . . . 87.37 278 100.00 100.00 1.17e-52 . . . . 11400 1 13 no DBJ BAE88784 . "unnamed protein product [Macaca fascicularis]" . . . . . 87.37 288 100.00 100.00 1.60e-52 . . . . 11400 1 14 no EMBL CAA56518 . "SIG41 [Mus musculus]" . . . . . 87.37 288 100.00 100.00 1.05e-52 . . . . 11400 1 15 no EMBL CAH18071 . "hypothetical protein [Homo sapiens]" . . . . . 87.37 276 100.00 100.00 9.01e-53 . . . . 11400 1 16 no EMBL CAH90742 . "hypothetical protein [Pongo abelii]" . . . . . 87.37 288 98.80 98.80 1.29e-51 . . . . 11400 1 17 no GB AAB08701 . "transformer-2 beta [Homo sapiens]" . . . . . 87.37 288 100.00 100.00 1.05e-52 . . . . 11400 1 18 no GB AAC28242 . "htra2-beta [Homo sapiens]" . . . . . 87.37 288 100.00 100.00 1.05e-52 . . . . 11400 1 19 no GB AAD19277 . "transformer-2-beta isoform 1 [Homo sapiens]" . . . . . 87.37 288 100.00 100.00 1.05e-52 . . . . 11400 1 20 no GB AAD19278 . "transformer-2-beta isoform 3 [Homo sapiens]" . . . . . 87.37 188 100.00 100.00 1.14e-51 . . . . 11400 1 21 no GB AAG35783 . "transformer-2 beta [Gallus gallus]" . . . . . 87.37 289 98.80 100.00 6.95e-52 . . . . 11400 1 22 no REF NP_001006878 . "transformer-2 protein homolog beta [Xenopus (Silurana) tropicalis]" . . . . . 87.37 293 97.59 100.00 7.23e-52 . . . . 11400 1 23 no REF NP_001029948 . "transformer-2 protein homolog beta [Bos taurus]" . . . . . 87.37 288 100.00 100.00 1.05e-52 . . . . 11400 1 24 no REF NP_001070689 . "transformer-2 protein homolog beta [Sus scrofa]" . . . . . 87.37 288 100.00 100.00 1.05e-52 . . . . 11400 1 25 no REF NP_001125414 . "transformer-2 protein homolog beta [Pongo abelii]" . . . . . 87.37 288 98.80 98.80 1.29e-51 . . . . 11400 1 26 no REF NP_001230808 . "transformer-2 protein homolog beta isoform 2 [Homo sapiens]" . . . . . 87.37 188 100.00 100.00 1.14e-51 . . . . 11400 1 27 no SP P62995 . "RecName: Full=Transformer-2 protein homolog beta; Short=TRA-2 beta; Short=TRA2-beta; Short=hTRA2-beta; AltName: Full=Splicing f" . . . . . 87.37 288 100.00 100.00 1.05e-52 . . . . 11400 1 28 no SP P62996 . "RecName: Full=Transformer-2 protein homolog beta; Short=TRA-2 beta; Short=TRA2-beta; AltName: Full=Silica-induced gene 41 prote" . . . . . 87.37 288 100.00 100.00 1.05e-52 . . . . 11400 1 29 no SP P62997 . "RecName: Full=Transformer-2 protein homolog beta; Short=TRA-2 beta; Short=TRA2-beta; AltName: Full=RA301; AltName: Full=Splicin" . . . . . 87.37 288 100.00 100.00 1.05e-52 . . . . 11400 1 30 no SP Q3ZBT6 . "RecName: Full=Transformer-2 protein homolog beta; Short=TRA-2 beta; Short=TRA2-beta; AltName: Full=Splicing factor, arginine/se" . . . . . 87.37 288 100.00 100.00 1.05e-52 . . . . 11400 1 31 no TPG DAA33375 . "TPA: transformer-2 protein homolog beta [Bos taurus]" . . . . . 87.37 288 100.00 100.00 1.05e-52 . . . . 11400 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'RNA recognition motif' . 11400 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . GLY . 11400 1 2 . SER . 11400 1 3 . SER . 11400 1 4 . GLY . 11400 1 5 . SER . 11400 1 6 . SER . 11400 1 7 . GLY . 11400 1 8 . ASN . 11400 1 9 . ARG . 11400 1 10 . ALA . 11400 1 11 . ASN . 11400 1 12 . PRO . 11400 1 13 . ASP . 11400 1 14 . PRO . 11400 1 15 . ASN . 11400 1 16 . CYS . 11400 1 17 . CYS . 11400 1 18 . LEU . 11400 1 19 . GLY . 11400 1 20 . VAL . 11400 1 21 . PHE . 11400 1 22 . GLY . 11400 1 23 . LEU . 11400 1 24 . SER . 11400 1 25 . LEU . 11400 1 26 . TYR . 11400 1 27 . THR . 11400 1 28 . THR . 11400 1 29 . GLU . 11400 1 30 . ARG . 11400 1 31 . ASP . 11400 1 32 . LEU . 11400 1 33 . ARG . 11400 1 34 . GLU . 11400 1 35 . VAL . 11400 1 36 . PHE . 11400 1 37 . SER . 11400 1 38 . LYS . 11400 1 39 . TYR . 11400 1 40 . GLY . 11400 1 41 . PRO . 11400 1 42 . ILE . 11400 1 43 . ALA . 11400 1 44 . ASP . 11400 1 45 . VAL . 11400 1 46 . SER . 11400 1 47 . ILE . 11400 1 48 . VAL . 11400 1 49 . TYR . 11400 1 50 . ASP . 11400 1 51 . GLN . 11400 1 52 . GLN . 11400 1 53 . SER . 11400 1 54 . ARG . 11400 1 55 . ARG . 11400 1 56 . SER . 11400 1 57 . ARG . 11400 1 58 . GLY . 11400 1 59 . PHE . 11400 1 60 . ALA . 11400 1 61 . PHE . 11400 1 62 . VAL . 11400 1 63 . TYR . 11400 1 64 . PHE . 11400 1 65 . GLU . 11400 1 66 . ASN . 11400 1 67 . VAL . 11400 1 68 . ASP . 11400 1 69 . ASP . 11400 1 70 . ALA . 11400 1 71 . LYS . 11400 1 72 . GLU . 11400 1 73 . ALA . 11400 1 74 . LYS . 11400 1 75 . GLU . 11400 1 76 . ARG . 11400 1 77 . ALA . 11400 1 78 . ASN . 11400 1 79 . GLY . 11400 1 80 . MET . 11400 1 81 . GLU . 11400 1 82 . LEU . 11400 1 83 . ASP . 11400 1 84 . GLY . 11400 1 85 . ARG . 11400 1 86 . ARG . 11400 1 87 . ILE . 11400 1 88 . ARG . 11400 1 89 . VAL . 11400 1 90 . SER . 11400 1 91 . GLY . 11400 1 92 . PRO . 11400 1 93 . SER . 11400 1 94 . SER . 11400 1 95 . GLY . 11400 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 11400 1 . SER 2 2 11400 1 . SER 3 3 11400 1 . GLY 4 4 11400 1 . SER 5 5 11400 1 . SER 6 6 11400 1 . GLY 7 7 11400 1 . ASN 8 8 11400 1 . ARG 9 9 11400 1 . ALA 10 10 11400 1 . ASN 11 11 11400 1 . PRO 12 12 11400 1 . ASP 13 13 11400 1 . PRO 14 14 11400 1 . ASN 15 15 11400 1 . CYS 16 16 11400 1 . CYS 17 17 11400 1 . LEU 18 18 11400 1 . GLY 19 19 11400 1 . VAL 20 20 11400 1 . PHE 21 21 11400 1 . GLY 22 22 11400 1 . LEU 23 23 11400 1 . SER 24 24 11400 1 . LEU 25 25 11400 1 . TYR 26 26 11400 1 . THR 27 27 11400 1 . THR 28 28 11400 1 . GLU 29 29 11400 1 . ARG 30 30 11400 1 . ASP 31 31 11400 1 . LEU 32 32 11400 1 . ARG 33 33 11400 1 . GLU 34 34 11400 1 . VAL 35 35 11400 1 . PHE 36 36 11400 1 . SER 37 37 11400 1 . LYS 38 38 11400 1 . TYR 39 39 11400 1 . GLY 40 40 11400 1 . PRO 41 41 11400 1 . ILE 42 42 11400 1 . ALA 43 43 11400 1 . ASP 44 44 11400 1 . VAL 45 45 11400 1 . SER 46 46 11400 1 . ILE 47 47 11400 1 . VAL 48 48 11400 1 . TYR 49 49 11400 1 . ASP 50 50 11400 1 . GLN 51 51 11400 1 . GLN 52 52 11400 1 . SER 53 53 11400 1 . ARG 54 54 11400 1 . ARG 55 55 11400 1 . SER 56 56 11400 1 . ARG 57 57 11400 1 . GLY 58 58 11400 1 . PHE 59 59 11400 1 . ALA 60 60 11400 1 . PHE 61 61 11400 1 . VAL 62 62 11400 1 . TYR 63 63 11400 1 . PHE 64 64 11400 1 . GLU 65 65 11400 1 . ASN 66 66 11400 1 . VAL 67 67 11400 1 . ASP 68 68 11400 1 . ASP 69 69 11400 1 . ALA 70 70 11400 1 . LYS 71 71 11400 1 . GLU 72 72 11400 1 . ALA 73 73 11400 1 . LYS 74 74 11400 1 . GLU 75 75 11400 1 . ARG 76 76 11400 1 . ALA 77 77 11400 1 . ASN 78 78 11400 1 . GLY 79 79 11400 1 . MET 80 80 11400 1 . GLU 81 81 11400 1 . LEU 82 82 11400 1 . ASP 83 83 11400 1 . GLY 84 84 11400 1 . ARG 85 85 11400 1 . ARG 86 86 11400 1 . ILE 87 87 11400 1 . ARG 88 88 11400 1 . VAL 89 89 11400 1 . SER 90 90 11400 1 . GLY 91 91 11400 1 . PRO 92 92 11400 1 . SER 93 93 11400 1 . SER 94 94 11400 1 . GLY 95 95 11400 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 11400 _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_1 . 9606 organism . 'Homo sapiens' human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 11400 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 11400 _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_1 . 'cell free synthesis' 'E. coli - cell free' 'E. coli' . 562 Escherichia coli . . . . . . . . . . . . . plasmid . . P040517-05 . . . . . . 11400 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 11400 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details ; 1.14mM PROTEIN {U-15N,13C;} 20mM {d-Tris-HCL(pH7.0);} 100mM {NaCl;} 1mM {d-DTT;} 0.02% {NaN3;} 10% D2O ; _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 'RNA recognition motif' '[U-13C; U-15N]' . . 1 $entity_1 . protein 1.14 . . mM . . . . 11400 1 2 d-Tris-HCl 'natural abundance' . . . . . buffer 20 . . mM . . . . 11400 1 3 NaCl 'natural abundance' . . . . . salt 100 . . mM . . . . 11400 1 4 d-DTT 'natural abundance' . . . . . salt 1 . . mM . . . . 11400 1 5 NaN3 'natural abundance' . . . . . salt 0.02 . . % . . . . 11400 1 6 H2O . . . . . . solvent 90 . . % . . . . 11400 1 7 D2O . . . . . . solvent 10 . . % . . . . 11400 1 stop_ save_ ####################### # Sample conditions # ####################### save_condition_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode condition_1 _Sample_condition_list.Entry_ID 11400 _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' 120 0.1 mM 11400 1 pH 7.0 0.05 pH 11400 1 pressure 1 0.001 atm 11400 1 temperature 298 0.1 K 11400 1 stop_ save_ ############################ # Computer software used # ############################ save_XWINNMR _Software.Sf_category software _Software.Sf_framecode XWINNMR _Software.Entry_ID 11400 _Software.ID 1 _Software.Name xwinnmr _Software.Version 3.5 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Bruker . . 11400 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 11400 1 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 11400 _Software.ID 2 _Software.Name NMRPipe _Software.Version 20030801 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, F.' . . 11400 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 11400 2 stop_ save_ save_NMRview _Software.Sf_category software _Software.Sf_framecode NMRview _Software.Entry_ID 11400 _Software.ID 3 _Software.Name NMRView _Software.Version 5.0.4 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Johnson, B.A.' . . 11400 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 11400 3 stop_ save_ save_Kujira _Software.Sf_category software _Software.Sf_framecode Kujira _Software.Entry_ID 11400 _Software.ID 4 _Software.Name Kujira _Software.Version 0.9295 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Kobayashi, N.' . . 11400 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 11400 4 stop_ save_ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 11400 _Software.ID 5 _Software.Name CYANA _Software.Version 2.0.17 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, P.' . . 11400 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 11400 5 'structure solution' 11400 5 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 11400 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model AVANCE _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 11400 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker AVANCE . 800 . . . 11400 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 11400 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '3D 15N-separated NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11400 1 2 '3D 13C-separated NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 11400 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode reference_1 _Chem_shift_reference.Entry_ID 11400 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details ; Chemical shift reference of 1H was based on the proton of water (4.784ppm at 298K) and then those of 15N and 13C were calculated based on their gyromagnetic ratios. ; 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 0.0 . indirect 0.251449530 . . . . . . . . . 11400 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 . indirect 1.0 . . . . . . . . . 11400 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . . . . . . . 11400 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_chemical_shift_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chemical_shift_1 _Assigned_chem_shift_list.Entry_ID 11400 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $condition_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '3D 15N-separated NOESY' 1 $sample_1 isotropic 11400 1 2 '3D 13C-separated NOESY' 1 $sample_1 isotropic 11400 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $XWINNMR . . 11400 1 2 $NMRPipe . . 11400 1 3 $NMRview . . 11400 1 4 $Kujira . . 11400 1 5 $CYANA . . 11400 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 8 8 ASN HA H 1 4.637 0.030 . 1 . . . . 8 ASN HA . 11400 1 2 . 1 1 8 8 ASN HB2 H 1 2.723 0.030 . 1 . . . . 8 ASN HB2 . 11400 1 3 . 1 1 8 8 ASN HB3 H 1 2.723 0.030 . 1 . . . . 8 ASN HB3 . 11400 1 4 . 1 1 8 8 ASN CA C 13 53.169 0.300 . 1 . . . . 8 ASN CA . 11400 1 5 . 1 1 8 8 ASN CB C 13 38.946 0.300 . 1 . . . . 8 ASN CB . 11400 1 6 . 1 1 9 9 ARG H H 1 8.261 0.030 . 1 . . . . 9 ARG H . 11400 1 7 . 1 1 9 9 ARG HA H 1 4.247 0.030 . 1 . . . . 9 ARG HA . 11400 1 8 . 1 1 9 9 ARG HB2 H 1 1.794 0.030 . 2 . . . . 9 ARG HB2 . 11400 1 9 . 1 1 9 9 ARG HB3 H 1 1.688 0.030 . 2 . . . . 9 ARG HB3 . 11400 1 10 . 1 1 9 9 ARG HD2 H 1 3.088 0.030 . 1 . . . . 9 ARG HD2 . 11400 1 11 . 1 1 9 9 ARG HD3 H 1 3.088 0.030 . 1 . . . . 9 ARG HD3 . 11400 1 12 . 1 1 9 9 ARG HG2 H 1 1.531 0.030 . 2 . . . . 9 ARG HG2 . 11400 1 13 . 1 1 9 9 ARG HG3 H 1 1.450 0.030 . 2 . . . . 9 ARG HG3 . 11400 1 14 . 1 1 9 9 ARG CA C 13 55.978 0.300 . 1 . . . . 9 ARG CA . 11400 1 15 . 1 1 9 9 ARG CB C 13 30.659 0.300 . 1 . . . . 9 ARG CB . 11400 1 16 . 1 1 9 9 ARG CD C 13 43.204 0.300 . 1 . . . . 9 ARG CD . 11400 1 17 . 1 1 9 9 ARG CG C 13 27.072 0.300 . 1 . . . . 9 ARG CG . 11400 1 18 . 1 1 9 9 ARG N N 15 121.416 0.300 . 1 . . . . 9 ARG N . 11400 1 19 . 1 1 10 10 ALA H H 1 8.194 0.030 . 1 . . . . 10 ALA H . 11400 1 20 . 1 1 10 10 ALA HA H 1 4.165 0.030 . 1 . . . . 10 ALA HA . 11400 1 21 . 1 1 10 10 ALA HB1 H 1 1.280 0.030 . 1 . . . . 10 ALA HB . 11400 1 22 . 1 1 10 10 ALA HB2 H 1 1.280 0.030 . 1 . . . . 10 ALA HB . 11400 1 23 . 1 1 10 10 ALA HB3 H 1 1.280 0.030 . 1 . . . . 10 ALA HB . 11400 1 24 . 1 1 10 10 ALA CA C 13 52.591 0.300 . 1 . . . . 10 ALA CA . 11400 1 25 . 1 1 10 10 ALA CB C 13 19.252 0.300 . 1 . . . . 10 ALA CB . 11400 1 26 . 1 1 10 10 ALA N N 15 124.609 0.300 . 1 . . . . 10 ALA N . 11400 1 27 . 1 1 11 11 ASN H H 1 8.267 0.030 . 1 . . . . 11 ASN H . 11400 1 28 . 1 1 11 11 ASN HA H 1 4.892 0.030 . 1 . . . . 11 ASN HA . 11400 1 29 . 1 1 11 11 ASN HB2 H 1 2.843 0.030 . 2 . . . . 11 ASN HB2 . 11400 1 30 . 1 1 11 11 ASN HB3 H 1 2.647 0.030 . 2 . . . . 11 ASN HB3 . 11400 1 31 . 1 1 11 11 ASN HD21 H 1 7.592 0.030 . 2 . . . . 11 ASN HD21 . 11400 1 32 . 1 1 11 11 ASN HD22 H 1 6.912 0.030 . 2 . . . . 11 ASN HD22 . 11400 1 33 . 1 1 11 11 ASN CA C 13 51.068 0.300 . 1 . . . . 11 ASN CA . 11400 1 34 . 1 1 11 11 ASN CB C 13 39.101 0.300 . 1 . . . . 11 ASN CB . 11400 1 35 . 1 1 11 11 ASN N N 15 118.510 0.300 . 1 . . . . 11 ASN N . 11400 1 36 . 1 1 11 11 ASN ND2 N 15 113.299 0.300 . 1 . . . . 11 ASN ND2 . 11400 1 37 . 1 1 12 12 PRO HA H 1 4.327 0.030 . 1 . . . . 12 PRO HA . 11400 1 38 . 1 1 12 12 PRO HB2 H 1 1.999 0.030 . 2 . . . . 12 PRO HB2 . 11400 1 39 . 1 1 12 12 PRO HB3 H 1 1.760 0.030 . 2 . . . . 12 PRO HB3 . 11400 1 40 . 1 1 12 12 PRO HD2 H 1 3.658 0.030 . 2 . . . . 12 PRO HD2 . 11400 1 41 . 1 1 12 12 PRO HD3 H 1 3.593 0.030 . 2 . . . . 12 PRO HD3 . 11400 1 42 . 1 1 12 12 PRO HG2 H 1 1.775 0.030 . 1 . . . . 12 PRO HG2 . 11400 1 43 . 1 1 12 12 PRO HG3 H 1 1.775 0.030 . 1 . . . . 12 PRO HG3 . 11400 1 44 . 1 1 12 12 PRO CA C 13 62.952 0.300 . 1 . . . . 12 PRO CA . 11400 1 45 . 1 1 12 12 PRO CB C 13 32.087 0.300 . 1 . . . . 12 PRO CB . 11400 1 46 . 1 1 12 12 PRO CD C 13 50.506 0.300 . 1 . . . . 12 PRO CD . 11400 1 47 . 1 1 12 12 PRO CG C 13 26.959 0.300 . 1 . . . . 12 PRO CG . 11400 1 48 . 1 1 13 13 ASP H H 1 8.435 0.030 . 1 . . . . 13 ASP H . 11400 1 49 . 1 1 13 13 ASP HB2 H 1 3.018 0.030 . 2 . . . . 13 ASP HB2 . 11400 1 50 . 1 1 13 13 ASP HB3 H 1 2.648 0.030 . 2 . . . . 13 ASP HB3 . 11400 1 51 . 1 1 13 13 ASP CB C 13 42.359 0.300 . 1 . . . . 13 ASP CB . 11400 1 52 . 1 1 13 13 ASP N N 15 123.487 0.300 . 1 . . . . 13 ASP N . 11400 1 53 . 1 1 14 14 PRO HA H 1 4.266 0.030 . 1 . . . . 14 PRO HA . 11400 1 54 . 1 1 14 14 PRO HD2 H 1 4.031 0.030 . 2 . . . . 14 PRO HD2 . 11400 1 55 . 1 1 14 14 PRO HD3 H 1 3.975 0.030 . 2 . . . . 14 PRO HD3 . 11400 1 56 . 1 1 14 14 PRO HG2 H 1 1.979 0.030 . 1 . . . . 14 PRO HG2 . 11400 1 57 . 1 1 14 14 PRO HG3 H 1 1.979 0.030 . 1 . . . . 14 PRO HG3 . 11400 1 58 . 1 1 14 14 PRO C C 13 178.450 0.300 . 1 . . . . 14 PRO C . 11400 1 59 . 1 1 14 14 PRO CA C 13 64.531 0.300 . 1 . . . . 14 PRO CA . 11400 1 60 . 1 1 14 14 PRO CB C 13 32.024 0.300 . 1 . . . . 14 PRO CB . 11400 1 61 . 1 1 14 14 PRO CD C 13 51.334 0.300 . 1 . . . . 14 PRO CD . 11400 1 62 . 1 1 14 14 PRO CG C 13 27.274 0.300 . 1 . . . . 14 PRO CG . 11400 1 63 . 1 1 15 15 ASN H H 1 8.806 0.030 . 1 . . . . 15 ASN H . 11400 1 64 . 1 1 15 15 ASN HA H 1 4.542 0.030 . 1 . . . . 15 ASN HA . 11400 1 65 . 1 1 15 15 ASN HB2 H 1 2.854 0.030 . 2 . . . . 15 ASN HB2 . 11400 1 66 . 1 1 15 15 ASN HB3 H 1 2.705 0.030 . 2 . . . . 15 ASN HB3 . 11400 1 67 . 1 1 15 15 ASN HD21 H 1 8.156 0.030 . 2 . . . . 15 ASN HD21 . 11400 1 68 . 1 1 15 15 ASN HD22 H 1 7.041 0.030 . 2 . . . . 15 ASN HD22 . 11400 1 69 . 1 1 15 15 ASN C C 13 175.846 0.300 . 1 . . . . 15 ASN C . 11400 1 70 . 1 1 15 15 ASN CA C 13 55.040 0.300 . 1 . . . . 15 ASN CA . 11400 1 71 . 1 1 15 15 ASN CB C 13 38.271 0.300 . 1 . . . . 15 ASN CB . 11400 1 72 . 1 1 15 15 ASN N N 15 114.640 0.300 . 1 . . . . 15 ASN N . 11400 1 73 . 1 1 15 15 ASN ND2 N 15 115.697 0.300 . 1 . . . . 15 ASN ND2 . 11400 1 74 . 1 1 16 16 CYS H H 1 7.989 0.030 . 1 . . . . 16 CYS H . 11400 1 75 . 1 1 16 16 CYS HA H 1 4.243 0.030 . 1 . . . . 16 CYS HA . 11400 1 76 . 1 1 16 16 CYS HB2 H 1 3.614 0.030 . 2 . . . . 16 CYS HB2 . 11400 1 77 . 1 1 16 16 CYS HB3 H 1 3.110 0.030 . 2 . . . . 16 CYS HB3 . 11400 1 78 . 1 1 16 16 CYS C C 13 172.399 0.300 . 1 . . . . 16 CYS C . 11400 1 79 . 1 1 16 16 CYS CA C 13 60.319 0.300 . 1 . . . . 16 CYS CA . 11400 1 80 . 1 1 16 16 CYS CB C 13 28.346 0.300 . 1 . . . . 16 CYS CB . 11400 1 81 . 1 1 16 16 CYS N N 15 115.921 0.300 . 1 . . . . 16 CYS N . 11400 1 82 . 1 1 17 17 CYS H H 1 7.311 0.030 . 1 . . . . 17 CYS H . 11400 1 83 . 1 1 17 17 CYS HA H 1 4.689 0.030 . 1 . . . . 17 CYS HA . 11400 1 84 . 1 1 17 17 CYS HB2 H 1 2.832 0.030 . 2 . . . . 17 CYS HB2 . 11400 1 85 . 1 1 17 17 CYS HB3 H 1 2.469 0.030 . 2 . . . . 17 CYS HB3 . 11400 1 86 . 1 1 17 17 CYS C C 13 173.476 0.300 . 1 . . . . 17 CYS C . 11400 1 87 . 1 1 17 17 CYS CA C 13 57.356 0.300 . 1 . . . . 17 CYS CA . 11400 1 88 . 1 1 17 17 CYS CB C 13 29.007 0.300 . 1 . . . . 17 CYS CB . 11400 1 89 . 1 1 17 17 CYS N N 15 119.775 0.300 . 1 . . . . 17 CYS N . 11400 1 90 . 1 1 18 18 LEU H H 1 9.269 0.030 . 1 . . . . 18 LEU H . 11400 1 91 . 1 1 18 18 LEU HA H 1 4.933 0.030 . 1 . . . . 18 LEU HA . 11400 1 92 . 1 1 18 18 LEU HB2 H 1 1.381 0.030 . 1 . . . . 18 LEU HB2 . 11400 1 93 . 1 1 18 18 LEU HB3 H 1 1.381 0.030 . 1 . . . . 18 LEU HB3 . 11400 1 94 . 1 1 18 18 LEU HD11 H 1 0.721 0.030 . 1 . . . . 18 LEU HD1 . 11400 1 95 . 1 1 18 18 LEU HD12 H 1 0.721 0.030 . 1 . . . . 18 LEU HD1 . 11400 1 96 . 1 1 18 18 LEU HD13 H 1 0.721 0.030 . 1 . . . . 18 LEU HD1 . 11400 1 97 . 1 1 18 18 LEU HD21 H 1 0.807 0.030 . 1 . . . . 18 LEU HD2 . 11400 1 98 . 1 1 18 18 LEU HD22 H 1 0.807 0.030 . 1 . . . . 18 LEU HD2 . 11400 1 99 . 1 1 18 18 LEU HD23 H 1 0.807 0.030 . 1 . . . . 18 LEU HD2 . 11400 1 100 . 1 1 18 18 LEU HG H 1 1.627 0.030 . 1 . . . . 18 LEU HG . 11400 1 101 . 1 1 18 18 LEU C C 13 176.267 0.300 . 1 . . . . 18 LEU C . 11400 1 102 . 1 1 18 18 LEU CA C 13 53.045 0.300 . 1 . . . . 18 LEU CA . 11400 1 103 . 1 1 18 18 LEU CB C 13 44.365 0.300 . 1 . . . . 18 LEU CB . 11400 1 104 . 1 1 18 18 LEU CD1 C 13 24.252 0.300 . 2 . . . . 18 LEU CD1 . 11400 1 105 . 1 1 18 18 LEU CD2 C 13 26.307 0.300 . 2 . . . . 18 LEU CD2 . 11400 1 106 . 1 1 18 18 LEU CG C 13 26.840 0.300 . 1 . . . . 18 LEU CG . 11400 1 107 . 1 1 18 18 LEU N N 15 129.051 0.300 . 1 . . . . 18 LEU N . 11400 1 108 . 1 1 19 19 GLY H H 1 8.770 0.030 . 1 . . . . 19 GLY H . 11400 1 109 . 1 1 19 19 GLY HA2 H 1 4.406 0.030 . 2 . . . . 19 GLY HA2 . 11400 1 110 . 1 1 19 19 GLY HA3 H 1 3.342 0.030 . 2 . . . . 19 GLY HA3 . 11400 1 111 . 1 1 19 19 GLY C C 13 171.836 0.300 . 1 . . . . 19 GLY C . 11400 1 112 . 1 1 19 19 GLY CA C 13 44.936 0.300 . 1 . . . . 19 GLY CA . 11400 1 113 . 1 1 19 19 GLY N N 15 110.734 0.300 . 1 . . . . 19 GLY N . 11400 1 114 . 1 1 20 20 VAL H H 1 8.278 0.030 . 1 . . . . 20 VAL H . 11400 1 115 . 1 1 20 20 VAL HA H 1 4.665 0.030 . 1 . . . . 20 VAL HA . 11400 1 116 . 1 1 20 20 VAL HB H 1 1.547 0.030 . 1 . . . . 20 VAL HB . 11400 1 117 . 1 1 20 20 VAL HG11 H 1 0.865 0.030 . 1 . . . . 20 VAL HG1 . 11400 1 118 . 1 1 20 20 VAL HG12 H 1 0.865 0.030 . 1 . . . . 20 VAL HG1 . 11400 1 119 . 1 1 20 20 VAL HG13 H 1 0.865 0.030 . 1 . . . . 20 VAL HG1 . 11400 1 120 . 1 1 20 20 VAL HG21 H 1 0.500 0.030 . 1 . . . . 20 VAL HG2 . 11400 1 121 . 1 1 20 20 VAL HG22 H 1 0.500 0.030 . 1 . . . . 20 VAL HG2 . 11400 1 122 . 1 1 20 20 VAL HG23 H 1 0.500 0.030 . 1 . . . . 20 VAL HG2 . 11400 1 123 . 1 1 20 20 VAL C C 13 173.770 0.300 . 1 . . . . 20 VAL C . 11400 1 124 . 1 1 20 20 VAL CA C 13 60.973 0.300 . 1 . . . . 20 VAL CA . 11400 1 125 . 1 1 20 20 VAL CB C 13 33.390 0.300 . 1 . . . . 20 VAL CB . 11400 1 126 . 1 1 20 20 VAL CG1 C 13 23.099 0.300 . 2 . . . . 20 VAL CG1 . 11400 1 127 . 1 1 20 20 VAL CG2 C 13 21.249 0.300 . 2 . . . . 20 VAL CG2 . 11400 1 128 . 1 1 20 20 VAL N N 15 124.388 0.300 . 1 . . . . 20 VAL N . 11400 1 129 . 1 1 21 21 PHE H H 1 9.410 0.030 . 1 . . . . 21 PHE H . 11400 1 130 . 1 1 21 21 PHE HA H 1 4.977 0.030 . 1 . . . . 21 PHE HA . 11400 1 131 . 1 1 21 21 PHE HB2 H 1 3.206 0.030 . 2 . . . . 21 PHE HB2 . 11400 1 132 . 1 1 21 21 PHE HB3 H 1 2.717 0.030 . 2 . . . . 21 PHE HB3 . 11400 1 133 . 1 1 21 21 PHE HD1 H 1 6.951 0.030 . 1 . . . . 21 PHE HD1 . 11400 1 134 . 1 1 21 21 PHE HD2 H 1 6.951 0.030 . 1 . . . . 21 PHE HD2 . 11400 1 135 . 1 1 21 21 PHE HE1 H 1 6.913 0.030 . 1 . . . . 21 PHE HE1 . 11400 1 136 . 1 1 21 21 PHE HE2 H 1 6.913 0.030 . 1 . . . . 21 PHE HE2 . 11400 1 137 . 1 1 21 21 PHE HZ H 1 7.117 0.030 . 1 . . . . 21 PHE HZ . 11400 1 138 . 1 1 21 21 PHE C C 13 175.618 0.300 . 1 . . . . 21 PHE C . 11400 1 139 . 1 1 21 21 PHE CA C 13 56.318 0.300 . 1 . . . . 21 PHE CA . 11400 1 140 . 1 1 21 21 PHE CB C 13 42.388 0.300 . 1 . . . . 21 PHE CB . 11400 1 141 . 1 1 21 21 PHE CD1 C 13 132.428 0.300 . 1 . . . . 21 PHE CD1 . 11400 1 142 . 1 1 21 21 PHE CD2 C 13 132.428 0.300 . 1 . . . . 21 PHE CD2 . 11400 1 143 . 1 1 21 21 PHE CE1 C 13 130.793 0.300 . 1 . . . . 21 PHE CE1 . 11400 1 144 . 1 1 21 21 PHE CE2 C 13 130.793 0.300 . 1 . . . . 21 PHE CE2 . 11400 1 145 . 1 1 21 21 PHE CZ C 13 129.265 0.300 . 1 . . . . 21 PHE CZ . 11400 1 146 . 1 1 21 21 PHE N N 15 122.987 0.300 . 1 . . . . 21 PHE N . 11400 1 147 . 1 1 22 22 GLY H H 1 8.668 0.030 . 1 . . . . 22 GLY H . 11400 1 148 . 1 1 22 22 GLY HA2 H 1 4.328 0.030 . 2 . . . . 22 GLY HA2 . 11400 1 149 . 1 1 22 22 GLY HA3 H 1 3.843 0.030 . 2 . . . . 22 GLY HA3 . 11400 1 150 . 1 1 22 22 GLY C C 13 175.279 0.300 . 1 . . . . 22 GLY C . 11400 1 151 . 1 1 22 22 GLY CA C 13 45.615 0.300 . 1 . . . . 22 GLY CA . 11400 1 152 . 1 1 22 22 GLY N N 15 108.821 0.300 . 1 . . . . 22 GLY N . 11400 1 153 . 1 1 23 23 LEU H H 1 7.821 0.030 . 1 . . . . 23 LEU H . 11400 1 154 . 1 1 23 23 LEU HA H 1 4.207 0.030 . 1 . . . . 23 LEU HA . 11400 1 155 . 1 1 23 23 LEU HB2 H 1 1.440 0.030 . 2 . . . . 23 LEU HB2 . 11400 1 156 . 1 1 23 23 LEU HB3 H 1 1.170 0.030 . 2 . . . . 23 LEU HB3 . 11400 1 157 . 1 1 23 23 LEU HD11 H 1 0.444 0.030 . 1 . . . . 23 LEU HD1 . 11400 1 158 . 1 1 23 23 LEU HD12 H 1 0.444 0.030 . 1 . . . . 23 LEU HD1 . 11400 1 159 . 1 1 23 23 LEU HD13 H 1 0.444 0.030 . 1 . . . . 23 LEU HD1 . 11400 1 160 . 1 1 23 23 LEU HD21 H 1 0.804 0.030 . 1 . . . . 23 LEU HD2 . 11400 1 161 . 1 1 23 23 LEU HD22 H 1 0.804 0.030 . 1 . . . . 23 LEU HD2 . 11400 1 162 . 1 1 23 23 LEU HD23 H 1 0.804 0.030 . 1 . . . . 23 LEU HD2 . 11400 1 163 . 1 1 23 23 LEU HG H 1 1.349 0.030 . 1 . . . . 23 LEU HG . 11400 1 164 . 1 1 23 23 LEU C C 13 178.906 0.300 . 1 . . . . 23 LEU C . 11400 1 165 . 1 1 23 23 LEU CA C 13 54.078 0.300 . 1 . . . . 23 LEU CA . 11400 1 166 . 1 1 23 23 LEU CB C 13 43.688 0.300 . 1 . . . . 23 LEU CB . 11400 1 167 . 1 1 23 23 LEU CD1 C 13 26.301 0.300 . 2 . . . . 23 LEU CD1 . 11400 1 168 . 1 1 23 23 LEU CD2 C 13 24.178 0.300 . 2 . . . . 23 LEU CD2 . 11400 1 169 . 1 1 23 23 LEU CG C 13 26.913 0.300 . 1 . . . . 23 LEU CG . 11400 1 170 . 1 1 23 23 LEU N N 15 116.329 0.300 . 1 . . . . 23 LEU N . 11400 1 171 . 1 1 24 24 SER H H 1 9.306 0.030 . 1 . . . . 24 SER H . 11400 1 172 . 1 1 24 24 SER HA H 1 4.320 0.030 . 1 . . . . 24 SER HA . 11400 1 173 . 1 1 24 24 SER HB2 H 1 4.150 0.030 . 1 . . . . 24 SER HB2 . 11400 1 174 . 1 1 24 24 SER HB3 H 1 4.150 0.030 . 1 . . . . 24 SER HB3 . 11400 1 175 . 1 1 24 24 SER C C 13 176.442 0.300 . 1 . . . . 24 SER C . 11400 1 176 . 1 1 24 24 SER CA C 13 57.606 0.300 . 1 . . . . 24 SER CA . 11400 1 177 . 1 1 24 24 SER CB C 13 63.753 0.300 . 1 . . . . 24 SER CB . 11400 1 178 . 1 1 24 24 SER N N 15 115.438 0.300 . 1 . . . . 24 SER N . 11400 1 179 . 1 1 25 25 LEU H H 1 8.880 0.030 . 1 . . . . 25 LEU H . 11400 1 180 . 1 1 25 25 LEU HA H 1 3.879 0.030 . 1 . . . . 25 LEU HA . 11400 1 181 . 1 1 25 25 LEU HB2 H 1 1.288 0.030 . 1 . . . . 25 LEU HB2 . 11400 1 182 . 1 1 25 25 LEU HB3 H 1 1.288 0.030 . 1 . . . . 25 LEU HB3 . 11400 1 183 . 1 1 25 25 LEU HD11 H 1 0.692 0.030 . 1 . . . . 25 LEU HD1 . 11400 1 184 . 1 1 25 25 LEU HD12 H 1 0.692 0.030 . 1 . . . . 25 LEU HD1 . 11400 1 185 . 1 1 25 25 LEU HD13 H 1 0.692 0.030 . 1 . . . . 25 LEU HD1 . 11400 1 186 . 1 1 25 25 LEU HD21 H 1 0.844 0.030 . 1 . . . . 25 LEU HD2 . 11400 1 187 . 1 1 25 25 LEU HD22 H 1 0.844 0.030 . 1 . . . . 25 LEU HD2 . 11400 1 188 . 1 1 25 25 LEU HD23 H 1 0.844 0.030 . 1 . . . . 25 LEU HD2 . 11400 1 189 . 1 1 25 25 LEU HG H 1 1.639 0.030 . 1 . . . . 25 LEU HG . 11400 1 190 . 1 1 25 25 LEU C C 13 176.543 0.300 . 1 . . . . 25 LEU C . 11400 1 191 . 1 1 25 25 LEU CA C 13 56.814 0.300 . 1 . . . . 25 LEU CA . 11400 1 192 . 1 1 25 25 LEU CB C 13 40.302 0.300 . 1 . . . . 25 LEU CB . 11400 1 193 . 1 1 25 25 LEU CD1 C 13 22.043 0.300 . 2 . . . . 25 LEU CD1 . 11400 1 194 . 1 1 25 25 LEU CD2 C 13 24.938 0.300 . 2 . . . . 25 LEU CD2 . 11400 1 195 . 1 1 25 25 LEU CG C 13 26.985 0.300 . 1 . . . . 25 LEU CG . 11400 1 196 . 1 1 25 25 LEU N N 15 125.243 0.300 . 1 . . . . 25 LEU N . 11400 1 197 . 1 1 26 26 TYR H H 1 7.739 0.030 . 1 . . . . 26 TYR H . 11400 1 198 . 1 1 26 26 TYR HA H 1 4.545 0.030 . 1 . . . . 26 TYR HA . 11400 1 199 . 1 1 26 26 TYR HB2 H 1 3.289 0.030 . 2 . . . . 26 TYR HB2 . 11400 1 200 . 1 1 26 26 TYR HB3 H 1 2.731 0.030 . 2 . . . . 26 TYR HB3 . 11400 1 201 . 1 1 26 26 TYR HD1 H 1 7.136 0.030 . 1 . . . . 26 TYR HD1 . 11400 1 202 . 1 1 26 26 TYR HD2 H 1 7.136 0.030 . 1 . . . . 26 TYR HD2 . 11400 1 203 . 1 1 26 26 TYR HE1 H 1 6.858 0.030 . 1 . . . . 26 TYR HE1 . 11400 1 204 . 1 1 26 26 TYR HE2 H 1 6.858 0.030 . 1 . . . . 26 TYR HE2 . 11400 1 205 . 1 1 26 26 TYR C C 13 176.093 0.300 . 1 . . . . 26 TYR C . 11400 1 206 . 1 1 26 26 TYR CA C 13 57.280 0.300 . 1 . . . . 26 TYR CA . 11400 1 207 . 1 1 26 26 TYR CB C 13 38.467 0.300 . 1 . . . . 26 TYR CB . 11400 1 208 . 1 1 26 26 TYR CD1 C 13 133.007 0.300 . 1 . . . . 26 TYR CD1 . 11400 1 209 . 1 1 26 26 TYR CD2 C 13 133.007 0.300 . 1 . . . . 26 TYR CD2 . 11400 1 210 . 1 1 26 26 TYR CE1 C 13 118.254 0.300 . 1 . . . . 26 TYR CE1 . 11400 1 211 . 1 1 26 26 TYR CE2 C 13 118.254 0.300 . 1 . . . . 26 TYR CE2 . 11400 1 212 . 1 1 26 26 TYR N N 15 114.731 0.300 . 1 . . . . 26 TYR N . 11400 1 213 . 1 1 27 27 THR H H 1 7.108 0.030 . 1 . . . . 27 THR H . 11400 1 214 . 1 1 27 27 THR HA H 1 4.332 0.030 . 1 . . . . 27 THR HA . 11400 1 215 . 1 1 27 27 THR HB H 1 3.873 0.030 . 1 . . . . 27 THR HB . 11400 1 216 . 1 1 27 27 THR HG21 H 1 1.306 0.030 . 1 . . . . 27 THR HG2 . 11400 1 217 . 1 1 27 27 THR HG22 H 1 1.306 0.030 . 1 . . . . 27 THR HG2 . 11400 1 218 . 1 1 27 27 THR HG23 H 1 1.306 0.030 . 1 . . . . 27 THR HG2 . 11400 1 219 . 1 1 27 27 THR C C 13 174.767 0.300 . 1 . . . . 27 THR C . 11400 1 220 . 1 1 27 27 THR CA C 13 64.660 0.300 . 1 . . . . 27 THR CA . 11400 1 221 . 1 1 27 27 THR CB C 13 69.173 0.300 . 1 . . . . 27 THR CB . 11400 1 222 . 1 1 27 27 THR CG2 C 13 23.202 0.300 . 1 . . . . 27 THR CG2 . 11400 1 223 . 1 1 27 27 THR N N 15 119.469 0.300 . 1 . . . . 27 THR N . 11400 1 224 . 1 1 28 28 THR H H 1 9.245 0.030 . 1 . . . . 28 THR H . 11400 1 225 . 1 1 28 28 THR HA H 1 4.606 0.030 . 1 . . . . 28 THR HA . 11400 1 226 . 1 1 28 28 THR HB H 1 4.714 0.030 . 1 . . . . 28 THR HB . 11400 1 227 . 1 1 28 28 THR HG21 H 1 1.392 0.030 . 1 . . . . 28 THR HG2 . 11400 1 228 . 1 1 28 28 THR HG22 H 1 1.392 0.030 . 1 . . . . 28 THR HG2 . 11400 1 229 . 1 1 28 28 THR HG23 H 1 1.392 0.030 . 1 . . . . 28 THR HG2 . 11400 1 230 . 1 1 28 28 THR C C 13 175.478 0.300 . 1 . . . . 28 THR C . 11400 1 231 . 1 1 28 28 THR CA C 13 60.546 0.300 . 1 . . . . 28 THR CA . 11400 1 232 . 1 1 28 28 THR CB C 13 72.971 0.300 . 1 . . . . 28 THR CB . 11400 1 233 . 1 1 28 28 THR CG2 C 13 21.735 0.300 . 1 . . . . 28 THR CG2 . 11400 1 234 . 1 1 28 28 THR N N 15 119.963 0.300 . 1 . . . . 28 THR N . 11400 1 235 . 1 1 29 29 GLU H H 1 9.491 0.030 . 1 . . . . 29 GLU H . 11400 1 236 . 1 1 29 29 GLU HA H 1 3.673 0.030 . 1 . . . . 29 GLU HA . 11400 1 237 . 1 1 29 29 GLU HB2 H 1 2.203 0.030 . 2 . . . . 29 GLU HB2 . 11400 1 238 . 1 1 29 29 GLU HB3 H 1 1.942 0.030 . 2 . . . . 29 GLU HB3 . 11400 1 239 . 1 1 29 29 GLU HG2 H 1 2.473 0.030 . 2 . . . . 29 GLU HG2 . 11400 1 240 . 1 1 29 29 GLU HG3 H 1 2.277 0.030 . 2 . . . . 29 GLU HG3 . 11400 1 241 . 1 1 29 29 GLU C C 13 178.439 0.300 . 1 . . . . 29 GLU C . 11400 1 242 . 1 1 29 29 GLU CA C 13 61.061 0.300 . 1 . . . . 29 GLU CA . 11400 1 243 . 1 1 29 29 GLU CB C 13 28.646 0.300 . 1 . . . . 29 GLU CB . 11400 1 244 . 1 1 29 29 GLU CG C 13 37.500 0.300 . 1 . . . . 29 GLU CG . 11400 1 245 . 1 1 29 29 GLU N N 15 121.032 0.300 . 1 . . . . 29 GLU N . 11400 1 246 . 1 1 30 30 ARG H H 1 8.166 0.030 . 1 . . . . 30 ARG H . 11400 1 247 . 1 1 30 30 ARG HA H 1 3.952 0.030 . 1 . . . . 30 ARG HA . 11400 1 248 . 1 1 30 30 ARG HB2 H 1 1.932 0.030 . 2 . . . . 30 ARG HB2 . 11400 1 249 . 1 1 30 30 ARG HB3 H 1 1.746 0.030 . 2 . . . . 30 ARG HB3 . 11400 1 250 . 1 1 30 30 ARG HD2 H 1 3.196 0.030 . 1 . . . . 30 ARG HD2 . 11400 1 251 . 1 1 30 30 ARG HD3 H 1 3.196 0.030 . 1 . . . . 30 ARG HD3 . 11400 1 252 . 1 1 30 30 ARG HG2 H 1 1.728 0.030 . 2 . . . . 30 ARG HG2 . 11400 1 253 . 1 1 30 30 ARG HG3 H 1 1.612 0.030 . 2 . . . . 30 ARG HG3 . 11400 1 254 . 1 1 30 30 ARG C C 13 178.442 0.300 . 1 . . . . 30 ARG C . 11400 1 255 . 1 1 30 30 ARG CA C 13 59.499 0.300 . 1 . . . . 30 ARG CA . 11400 1 256 . 1 1 30 30 ARG CB C 13 29.760 0.300 . 1 . . . . 30 ARG CB . 11400 1 257 . 1 1 30 30 ARG CD C 13 43.295 0.300 . 1 . . . . 30 ARG CD . 11400 1 258 . 1 1 30 30 ARG CG C 13 26.788 0.300 . 1 . . . . 30 ARG CG . 11400 1 259 . 1 1 30 30 ARG N N 15 119.414 0.300 . 1 . . . . 30 ARG N . 11400 1 260 . 1 1 31 31 ASP H H 1 7.505 0.030 . 1 . . . . 31 ASP H . 11400 1 261 . 1 1 31 31 ASP HA H 1 4.344 0.030 . 1 . . . . 31 ASP HA . 11400 1 262 . 1 1 31 31 ASP HB2 H 1 3.111 0.030 . 2 . . . . 31 ASP HB2 . 11400 1 263 . 1 1 31 31 ASP HB3 H 1 2.673 0.030 . 2 . . . . 31 ASP HB3 . 11400 1 264 . 1 1 31 31 ASP C C 13 178.897 0.300 . 1 . . . . 31 ASP C . 11400 1 265 . 1 1 31 31 ASP CA C 13 57.358 0.300 . 1 . . . . 31 ASP CA . 11400 1 266 . 1 1 31 31 ASP CB C 13 41.258 0.300 . 1 . . . . 31 ASP CB . 11400 1 267 . 1 1 31 31 ASP N N 15 119.612 0.300 . 1 . . . . 31 ASP N . 11400 1 268 . 1 1 32 32 LEU H H 1 7.713 0.030 . 1 . . . . 32 LEU H . 11400 1 269 . 1 1 32 32 LEU HA H 1 4.094 0.030 . 1 . . . . 32 LEU HA . 11400 1 270 . 1 1 32 32 LEU HB2 H 1 1.971 0.030 . 2 . . . . 32 LEU HB2 . 11400 1 271 . 1 1 32 32 LEU HB3 H 1 1.241 0.030 . 2 . . . . 32 LEU HB3 . 11400 1 272 . 1 1 32 32 LEU HD11 H 1 0.731 0.030 . 1 . . . . 32 LEU HD1 . 11400 1 273 . 1 1 32 32 LEU HD12 H 1 0.731 0.030 . 1 . . . . 32 LEU HD1 . 11400 1 274 . 1 1 32 32 LEU HD13 H 1 0.731 0.030 . 1 . . . . 32 LEU HD1 . 11400 1 275 . 1 1 32 32 LEU HD21 H 1 0.510 0.030 . 1 . . . . 32 LEU HD2 . 11400 1 276 . 1 1 32 32 LEU HD22 H 1 0.510 0.030 . 1 . . . . 32 LEU HD2 . 11400 1 277 . 1 1 32 32 LEU HD23 H 1 0.510 0.030 . 1 . . . . 32 LEU HD2 . 11400 1 278 . 1 1 32 32 LEU HG H 1 1.664 0.030 . 1 . . . . 32 LEU HG . 11400 1 279 . 1 1 32 32 LEU C C 13 178.947 0.300 . 1 . . . . 32 LEU C . 11400 1 280 . 1 1 32 32 LEU CA C 13 57.568 0.300 . 1 . . . . 32 LEU CA . 11400 1 281 . 1 1 32 32 LEU CB C 13 42.756 0.300 . 1 . . . . 32 LEU CB . 11400 1 282 . 1 1 32 32 LEU CD1 C 13 23.651 0.300 . 2 . . . . 32 LEU CD1 . 11400 1 283 . 1 1 32 32 LEU CD2 C 13 26.326 0.300 . 2 . . . . 32 LEU CD2 . 11400 1 284 . 1 1 32 32 LEU CG C 13 26.635 0.300 . 1 . . . . 32 LEU CG . 11400 1 285 . 1 1 32 32 LEU N N 15 117.444 0.300 . 1 . . . . 32 LEU N . 11400 1 286 . 1 1 33 33 ARG H H 1 8.685 0.030 . 1 . . . . 33 ARG H . 11400 1 287 . 1 1 33 33 ARG HA H 1 3.764 0.030 . 1 . . . . 33 ARG HA . 11400 1 288 . 1 1 33 33 ARG HB2 H 1 1.946 0.030 . 1 . . . . 33 ARG HB2 . 11400 1 289 . 1 1 33 33 ARG HB3 H 1 1.946 0.030 . 1 . . . . 33 ARG HB3 . 11400 1 290 . 1 1 33 33 ARG HD2 H 1 3.284 0.030 . 2 . . . . 33 ARG HD2 . 11400 1 291 . 1 1 33 33 ARG HD3 H 1 3.104 0.030 . 2 . . . . 33 ARG HD3 . 11400 1 292 . 1 1 33 33 ARG HG2 H 1 1.580 0.030 . 2 . . . . 33 ARG HG2 . 11400 1 293 . 1 1 33 33 ARG HG3 H 1 1.482 0.030 . 2 . . . . 33 ARG HG3 . 11400 1 294 . 1 1 33 33 ARG C C 13 178.658 0.300 . 1 . . . . 33 ARG C . 11400 1 295 . 1 1 33 33 ARG CA C 13 60.624 0.300 . 1 . . . . 33 ARG CA . 11400 1 296 . 1 1 33 33 ARG CB C 13 30.216 0.300 . 1 . . . . 33 ARG CB . 11400 1 297 . 1 1 33 33 ARG CD C 13 43.156 0.300 . 1 . . . . 33 ARG CD . 11400 1 298 . 1 1 33 33 ARG CG C 13 29.566 0.300 . 1 . . . . 33 ARG CG . 11400 1 299 . 1 1 33 33 ARG N N 15 119.924 0.300 . 1 . . . . 33 ARG N . 11400 1 300 . 1 1 34 34 GLU H H 1 8.156 0.030 . 1 . . . . 34 GLU H . 11400 1 301 . 1 1 34 34 GLU HA H 1 3.963 0.030 . 1 . . . . 34 GLU HA . 11400 1 302 . 1 1 34 34 GLU HB2 H 1 2.185 0.030 . 2 . . . . 34 GLU HB2 . 11400 1 303 . 1 1 34 34 GLU HB3 H 1 2.143 0.030 . 2 . . . . 34 GLU HB3 . 11400 1 304 . 1 1 34 34 GLU HG2 H 1 2.358 0.030 . 2 . . . . 34 GLU HG2 . 11400 1 305 . 1 1 34 34 GLU HG3 H 1 2.283 0.030 . 2 . . . . 34 GLU HG3 . 11400 1 306 . 1 1 34 34 GLU CA C 13 59.704 0.300 . 1 . . . . 34 GLU CA . 11400 1 307 . 1 1 34 34 GLU CB C 13 29.386 0.300 . 1 . . . . 34 GLU CB . 11400 1 308 . 1 1 34 34 GLU CG C 13 36.255 0.300 . 1 . . . . 34 GLU CG . 11400 1 309 . 1 1 34 34 GLU N N 15 119.624 0.300 . 1 . . . . 34 GLU N . 11400 1 310 . 1 1 35 35 VAL H H 1 7.618 0.030 . 1 . . . . 35 VAL H . 11400 1 311 . 1 1 35 35 VAL HA H 1 3.750 0.030 . 1 . . . . 35 VAL HA . 11400 1 312 . 1 1 35 35 VAL HB H 1 1.970 0.030 . 1 . . . . 35 VAL HB . 11400 1 313 . 1 1 35 35 VAL HG11 H 1 1.036 0.030 . 1 . . . . 35 VAL HG1 . 11400 1 314 . 1 1 35 35 VAL HG12 H 1 1.036 0.030 . 1 . . . . 35 VAL HG1 . 11400 1 315 . 1 1 35 35 VAL HG13 H 1 1.036 0.030 . 1 . . . . 35 VAL HG1 . 11400 1 316 . 1 1 35 35 VAL HG21 H 1 0.477 0.030 . 1 . . . . 35 VAL HG2 . 11400 1 317 . 1 1 35 35 VAL HG22 H 1 0.477 0.030 . 1 . . . . 35 VAL HG2 . 11400 1 318 . 1 1 35 35 VAL HG23 H 1 0.477 0.030 . 1 . . . . 35 VAL HG2 . 11400 1 319 . 1 1 35 35 VAL C C 13 178.343 0.300 . 1 . . . . 35 VAL C . 11400 1 320 . 1 1 35 35 VAL CA C 13 65.627 0.300 . 1 . . . . 35 VAL CA . 11400 1 321 . 1 1 35 35 VAL CB C 13 32.627 0.300 . 1 . . . . 35 VAL CB . 11400 1 322 . 1 1 35 35 VAL CG1 C 13 22.464 0.300 . 2 . . . . 35 VAL CG1 . 11400 1 323 . 1 1 35 35 VAL CG2 C 13 20.912 0.300 . 2 . . . . 35 VAL CG2 . 11400 1 324 . 1 1 35 35 VAL N N 15 116.368 0.300 . 1 . . . . 35 VAL N . 11400 1 325 . 1 1 36 36 PHE H H 1 8.466 0.030 . 1 . . . . 36 PHE H . 11400 1 326 . 1 1 36 36 PHE HA H 1 4.539 0.030 . 1 . . . . 36 PHE HA . 11400 1 327 . 1 1 36 36 PHE HB2 H 1 3.353 0.030 . 2 . . . . 36 PHE HB2 . 11400 1 328 . 1 1 36 36 PHE HB3 H 1 2.844 0.030 . 2 . . . . 36 PHE HB3 . 11400 1 329 . 1 1 36 36 PHE HD1 H 1 7.610 0.030 . 1 . . . . 36 PHE HD1 . 11400 1 330 . 1 1 36 36 PHE HD2 H 1 7.610 0.030 . 1 . . . . 36 PHE HD2 . 11400 1 331 . 1 1 36 36 PHE HE1 H 1 6.997 0.030 . 1 . . . . 36 PHE HE1 . 11400 1 332 . 1 1 36 36 PHE HE2 H 1 6.997 0.030 . 1 . . . . 36 PHE HE2 . 11400 1 333 . 1 1 36 36 PHE HZ H 1 6.976 0.030 . 1 . . . . 36 PHE HZ . 11400 1 334 . 1 1 36 36 PHE C C 13 177.379 0.300 . 1 . . . . 36 PHE C . 11400 1 335 . 1 1 36 36 PHE CA C 13 62.949 0.300 . 1 . . . . 36 PHE CA . 11400 1 336 . 1 1 36 36 PHE CB C 13 38.478 0.300 . 1 . . . . 36 PHE CB . 11400 1 337 . 1 1 36 36 PHE CD1 C 13 131.154 0.300 . 1 . . . . 36 PHE CD1 . 11400 1 338 . 1 1 36 36 PHE CD2 C 13 131.154 0.300 . 1 . . . . 36 PHE CD2 . 11400 1 339 . 1 1 36 36 PHE CE1 C 13 130.565 0.300 . 1 . . . . 36 PHE CE1 . 11400 1 340 . 1 1 36 36 PHE CE2 C 13 130.565 0.300 . 1 . . . . 36 PHE CE2 . 11400 1 341 . 1 1 36 36 PHE CZ C 13 129.336 0.300 . 1 . . . . 36 PHE CZ . 11400 1 342 . 1 1 36 36 PHE N N 15 114.877 0.300 . 1 . . . . 36 PHE N . 11400 1 343 . 1 1 37 37 SER H H 1 8.336 0.030 . 1 . . . . 37 SER H . 11400 1 344 . 1 1 37 37 SER HA H 1 4.878 0.030 . 1 . . . . 37 SER HA . 11400 1 345 . 1 1 37 37 SER HB2 H 1 4.081 0.030 . 2 . . . . 37 SER HB2 . 11400 1 346 . 1 1 37 37 SER HB3 H 1 4.011 0.030 . 2 . . . . 37 SER HB3 . 11400 1 347 . 1 1 37 37 SER C C 13 175.642 0.300 . 1 . . . . 37 SER C . 11400 1 348 . 1 1 37 37 SER CA C 13 61.027 0.300 . 1 . . . . 37 SER CA . 11400 1 349 . 1 1 37 37 SER CB C 13 62.982 0.300 . 1 . . . . 37 SER CB . 11400 1 350 . 1 1 37 37 SER N N 15 115.268 0.300 . 1 . . . . 37 SER N . 11400 1 351 . 1 1 38 38 LYS H H 1 6.955 0.030 . 1 . . . . 38 LYS H . 11400 1 352 . 1 1 38 38 LYS HA H 1 3.956 0.030 . 1 . . . . 38 LYS HA . 11400 1 353 . 1 1 38 38 LYS HB2 H 1 1.383 0.030 . 2 . . . . 38 LYS HB2 . 11400 1 354 . 1 1 38 38 LYS HB3 H 1 1.318 0.030 . 2 . . . . 38 LYS HB3 . 11400 1 355 . 1 1 38 38 LYS HD2 H 1 1.487 0.030 . 2 . . . . 38 LYS HD2 . 11400 1 356 . 1 1 38 38 LYS HD3 H 1 1.456 0.030 . 2 . . . . 38 LYS HD3 . 11400 1 357 . 1 1 38 38 LYS HE2 H 1 2.863 0.030 . 1 . . . . 38 LYS HE2 . 11400 1 358 . 1 1 38 38 LYS HE3 H 1 2.863 0.030 . 1 . . . . 38 LYS HE3 . 11400 1 359 . 1 1 38 38 LYS HG2 H 1 1.091 0.030 . 2 . . . . 38 LYS HG2 . 11400 1 360 . 1 1 38 38 LYS HG3 H 1 0.970 0.030 . 2 . . . . 38 LYS HG3 . 11400 1 361 . 1 1 38 38 LYS C C 13 177.490 0.300 . 1 . . . . 38 LYS C . 11400 1 362 . 1 1 38 38 LYS CA C 13 57.877 0.300 . 1 . . . . 38 LYS CA . 11400 1 363 . 1 1 38 38 LYS CB C 13 31.573 0.300 . 1 . . . . 38 LYS CB . 11400 1 364 . 1 1 38 38 LYS CD C 13 28.619 0.300 . 1 . . . . 38 LYS CD . 11400 1 365 . 1 1 38 38 LYS CE C 13 41.949 0.300 . 1 . . . . 38 LYS CE . 11400 1 366 . 1 1 38 38 LYS CG C 13 23.867 0.300 . 1 . . . . 38 LYS CG . 11400 1 367 . 1 1 38 38 LYS N N 15 119.595 0.300 . 1 . . . . 38 LYS N . 11400 1 368 . 1 1 39 39 TYR H H 1 7.658 0.030 . 1 . . . . 39 TYR H . 11400 1 369 . 1 1 39 39 TYR HA H 1 4.438 0.030 . 1 . . . . 39 TYR HA . 11400 1 370 . 1 1 39 39 TYR HB2 H 1 3.326 0.030 . 2 . . . . 39 TYR HB2 . 11400 1 371 . 1 1 39 39 TYR HB3 H 1 3.033 0.030 . 2 . . . . 39 TYR HB3 . 11400 1 372 . 1 1 39 39 TYR HD1 H 1 7.411 0.030 . 1 . . . . 39 TYR HD1 . 11400 1 373 . 1 1 39 39 TYR HD2 H 1 7.411 0.030 . 1 . . . . 39 TYR HD2 . 11400 1 374 . 1 1 39 39 TYR HE1 H 1 6.513 0.030 . 1 . . . . 39 TYR HE1 . 11400 1 375 . 1 1 39 39 TYR HE2 H 1 6.513 0.030 . 1 . . . . 39 TYR HE2 . 11400 1 376 . 1 1 39 39 TYR C C 13 174.579 0.300 . 1 . . . . 39 TYR C . 11400 1 377 . 1 1 39 39 TYR CA C 13 59.024 0.300 . 1 . . . . 39 TYR CA . 11400 1 378 . 1 1 39 39 TYR CB C 13 38.626 0.300 . 1 . . . . 39 TYR CB . 11400 1 379 . 1 1 39 39 TYR CD1 C 13 132.951 0.300 . 1 . . . . 39 TYR CD1 . 11400 1 380 . 1 1 39 39 TYR CD2 C 13 132.951 0.300 . 1 . . . . 39 TYR CD2 . 11400 1 381 . 1 1 39 39 TYR CE1 C 13 118.036 0.300 . 1 . . . . 39 TYR CE1 . 11400 1 382 . 1 1 39 39 TYR CE2 C 13 118.036 0.300 . 1 . . . . 39 TYR CE2 . 11400 1 383 . 1 1 39 39 TYR N N 15 116.457 0.300 . 1 . . . . 39 TYR N . 11400 1 384 . 1 1 40 40 GLY H H 1 7.336 0.030 . 1 . . . . 40 GLY H . 11400 1 385 . 1 1 40 40 GLY HA2 H 1 4.884 0.030 . 2 . . . . 40 GLY HA2 . 11400 1 386 . 1 1 40 40 GLY HA3 H 1 3.888 0.030 . 2 . . . . 40 GLY HA3 . 11400 1 387 . 1 1 40 40 GLY C C 13 177.735 0.300 . 1 . . . . 40 GLY C . 11400 1 388 . 1 1 40 40 GLY CA C 13 44.652 0.300 . 1 . . . . 40 GLY CA . 11400 1 389 . 1 1 40 40 GLY N N 15 106.600 0.300 . 1 . . . . 40 GLY N . 11400 1 390 . 1 1 41 41 PRO HA H 1 4.417 0.030 . 1 . . . . 41 PRO HA . 11400 1 391 . 1 1 41 41 PRO HB2 H 1 2.243 0.030 . 2 . . . . 41 PRO HB2 . 11400 1 392 . 1 1 41 41 PRO HB3 H 1 1.863 0.030 . 2 . . . . 41 PRO HB3 . 11400 1 393 . 1 1 41 41 PRO HD2 H 1 3.881 0.030 . 2 . . . . 41 PRO HD2 . 11400 1 394 . 1 1 41 41 PRO HD3 H 1 3.565 0.030 . 2 . . . . 41 PRO HD3 . 11400 1 395 . 1 1 41 41 PRO HG2 H 1 2.184 0.030 . 2 . . . . 41 PRO HG2 . 11400 1 396 . 1 1 41 41 PRO HG3 H 1 2.028 0.030 . 2 . . . . 41 PRO HG3 . 11400 1 397 . 1 1 41 41 PRO C C 13 177.530 0.300 . 1 . . . . 41 PRO C . 11400 1 398 . 1 1 41 41 PRO CA C 13 63.226 0.300 . 1 . . . . 41 PRO CA . 11400 1 399 . 1 1 41 41 PRO CB C 13 32.142 0.300 . 1 . . . . 41 PRO CB . 11400 1 400 . 1 1 41 41 PRO CD C 13 49.497 0.300 . 1 . . . . 41 PRO CD . 11400 1 401 . 1 1 41 41 PRO CG C 13 27.985 0.300 . 1 . . . . 41 PRO CG . 11400 1 402 . 1 1 42 42 ILE H H 1 8.551 0.030 . 1 . . . . 42 ILE H . 11400 1 403 . 1 1 42 42 ILE HA H 1 3.978 0.030 . 1 . . . . 42 ILE HA . 11400 1 404 . 1 1 42 42 ILE HB H 1 1.714 0.030 . 1 . . . . 42 ILE HB . 11400 1 405 . 1 1 42 42 ILE HD11 H 1 0.165 0.030 . 1 . . . . 42 ILE HD1 . 11400 1 406 . 1 1 42 42 ILE HD12 H 1 0.165 0.030 . 1 . . . . 42 ILE HD1 . 11400 1 407 . 1 1 42 42 ILE HD13 H 1 0.165 0.030 . 1 . . . . 42 ILE HD1 . 11400 1 408 . 1 1 42 42 ILE HG12 H 1 1.326 0.030 . 2 . . . . 42 ILE HG12 . 11400 1 409 . 1 1 42 42 ILE HG13 H 1 0.899 0.030 . 2 . . . . 42 ILE HG13 . 11400 1 410 . 1 1 42 42 ILE HG21 H 1 0.498 0.030 . 1 . . . . 42 ILE HG2 . 11400 1 411 . 1 1 42 42 ILE HG22 H 1 0.498 0.030 . 1 . . . . 42 ILE HG2 . 11400 1 412 . 1 1 42 42 ILE HG23 H 1 0.498 0.030 . 1 . . . . 42 ILE HG2 . 11400 1 413 . 1 1 42 42 ILE C C 13 176.205 0.300 . 1 . . . . 42 ILE C . 11400 1 414 . 1 1 42 42 ILE CA C 13 59.031 0.300 . 1 . . . . 42 ILE CA . 11400 1 415 . 1 1 42 42 ILE CB C 13 39.188 0.300 . 1 . . . . 42 ILE CB . 11400 1 416 . 1 1 42 42 ILE CD1 C 13 12.119 0.300 . 1 . . . . 42 ILE CD1 . 11400 1 417 . 1 1 42 42 ILE CG1 C 13 27.075 0.300 . 1 . . . . 42 ILE CG1 . 11400 1 418 . 1 1 42 42 ILE CG2 C 13 18.244 0.300 . 1 . . . . 42 ILE CG2 . 11400 1 419 . 1 1 42 42 ILE N N 15 124.580 0.300 . 1 . . . . 42 ILE N . 11400 1 420 . 1 1 43 43 ALA H H 1 9.109 0.030 . 1 . . . . 43 ALA H . 11400 1 421 . 1 1 43 43 ALA HA H 1 4.382 0.030 . 1 . . . . 43 ALA HA . 11400 1 422 . 1 1 43 43 ALA HB1 H 1 1.166 0.030 . 1 . . . . 43 ALA HB . 11400 1 423 . 1 1 43 43 ALA HB2 H 1 1.166 0.030 . 1 . . . . 43 ALA HB . 11400 1 424 . 1 1 43 43 ALA HB3 H 1 1.166 0.030 . 1 . . . . 43 ALA HB . 11400 1 425 . 1 1 43 43 ALA C C 13 177.402 0.300 . 1 . . . . 43 ALA C . 11400 1 426 . 1 1 43 43 ALA CA C 13 53.507 0.300 . 1 . . . . 43 ALA CA . 11400 1 427 . 1 1 43 43 ALA CB C 13 19.803 0.300 . 1 . . . . 43 ALA CB . 11400 1 428 . 1 1 43 43 ALA N N 15 131.361 0.300 . 1 . . . . 43 ALA N . 11400 1 429 . 1 1 44 44 ASP H H 1 7.711 0.030 . 1 . . . . 44 ASP H . 11400 1 430 . 1 1 44 44 ASP HA H 1 4.699 0.030 . 1 . . . . 44 ASP HA . 11400 1 431 . 1 1 44 44 ASP HB2 H 1 2.573 0.030 . 2 . . . . 44 ASP HB2 . 11400 1 432 . 1 1 44 44 ASP HB3 H 1 2.194 0.030 . 2 . . . . 44 ASP HB3 . 11400 1 433 . 1 1 44 44 ASP C C 13 173.580 0.300 . 1 . . . . 44 ASP C . 11400 1 434 . 1 1 44 44 ASP CA C 13 54.168 0.300 . 1 . . . . 44 ASP CA . 11400 1 435 . 1 1 44 44 ASP CB C 13 43.980 0.300 . 1 . . . . 44 ASP CB . 11400 1 436 . 1 1 44 44 ASP N N 15 114.373 0.300 . 1 . . . . 44 ASP N . 11400 1 437 . 1 1 45 45 VAL H H 1 8.241 0.030 . 1 . . . . 45 VAL H . 11400 1 438 . 1 1 45 45 VAL HA H 1 4.706 0.030 . 1 . . . . 45 VAL HA . 11400 1 439 . 1 1 45 45 VAL HB H 1 1.916 0.030 . 1 . . . . 45 VAL HB . 11400 1 440 . 1 1 45 45 VAL HG11 H 1 0.854 0.030 . 1 . . . . 45 VAL HG1 . 11400 1 441 . 1 1 45 45 VAL HG12 H 1 0.854 0.030 . 1 . . . . 45 VAL HG1 . 11400 1 442 . 1 1 45 45 VAL HG13 H 1 0.854 0.030 . 1 . . . . 45 VAL HG1 . 11400 1 443 . 1 1 45 45 VAL HG21 H 1 0.860 0.030 . 1 . . . . 45 VAL HG2 . 11400 1 444 . 1 1 45 45 VAL HG22 H 1 0.860 0.030 . 1 . . . . 45 VAL HG2 . 11400 1 445 . 1 1 45 45 VAL HG23 H 1 0.860 0.030 . 1 . . . . 45 VAL HG2 . 11400 1 446 . 1 1 45 45 VAL C C 13 173.888 0.300 . 1 . . . . 45 VAL C . 11400 1 447 . 1 1 45 45 VAL CA C 13 61.649 0.300 . 1 . . . . 45 VAL CA . 11400 1 448 . 1 1 45 45 VAL CB C 13 35.472 0.300 . 1 . . . . 45 VAL CB . 11400 1 449 . 1 1 45 45 VAL CG1 C 13 22.483 0.300 . 2 . . . . 45 VAL CG1 . 11400 1 450 . 1 1 45 45 VAL CG2 C 13 22.105 0.300 . 2 . . . . 45 VAL CG2 . 11400 1 451 . 1 1 45 45 VAL N N 15 120.476 0.300 . 1 . . . . 45 VAL N . 11400 1 452 . 1 1 46 46 SER H H 1 9.037 0.030 . 1 . . . . 46 SER H . 11400 1 453 . 1 1 46 46 SER HA H 1 5.008 0.030 . 1 . . . . 46 SER HA . 11400 1 454 . 1 1 46 46 SER HB2 H 1 3.921 0.030 . 2 . . . . 46 SER HB2 . 11400 1 455 . 1 1 46 46 SER HB3 H 1 3.790 0.030 . 2 . . . . 46 SER HB3 . 11400 1 456 . 1 1 46 46 SER C C 13 174.219 0.300 . 1 . . . . 46 SER C . 11400 1 457 . 1 1 46 46 SER CA C 13 56.556 0.300 . 1 . . . . 46 SER CA . 11400 1 458 . 1 1 46 46 SER CB C 13 65.461 0.300 . 1 . . . . 46 SER CB . 11400 1 459 . 1 1 46 46 SER N N 15 120.938 0.300 . 1 . . . . 46 SER N . 11400 1 460 . 1 1 47 47 ILE H H 1 8.928 0.030 . 1 . . . . 47 ILE H . 11400 1 461 . 1 1 47 47 ILE HA H 1 3.807 0.030 . 1 . . . . 47 ILE HA . 11400 1 462 . 1 1 47 47 ILE HB H 1 1.515 0.030 . 1 . . . . 47 ILE HB . 11400 1 463 . 1 1 47 47 ILE HD11 H 1 0.571 0.030 . 1 . . . . 47 ILE HD1 . 11400 1 464 . 1 1 47 47 ILE HD12 H 1 0.571 0.030 . 1 . . . . 47 ILE HD1 . 11400 1 465 . 1 1 47 47 ILE HD13 H 1 0.571 0.030 . 1 . . . . 47 ILE HD1 . 11400 1 466 . 1 1 47 47 ILE HG12 H 1 1.339 0.030 . 2 . . . . 47 ILE HG12 . 11400 1 467 . 1 1 47 47 ILE HG13 H 1 0.645 0.030 . 2 . . . . 47 ILE HG13 . 11400 1 468 . 1 1 47 47 ILE HG21 H 1 0.142 0.030 . 1 . . . . 47 ILE HG2 . 11400 1 469 . 1 1 47 47 ILE HG22 H 1 0.142 0.030 . 1 . . . . 47 ILE HG2 . 11400 1 470 . 1 1 47 47 ILE HG23 H 1 0.142 0.030 . 1 . . . . 47 ILE HG2 . 11400 1 471 . 1 1 47 47 ILE C C 13 174.512 0.300 . 1 . . . . 47 ILE C . 11400 1 472 . 1 1 47 47 ILE CA C 13 61.271 0.300 . 1 . . . . 47 ILE CA . 11400 1 473 . 1 1 47 47 ILE CB C 13 38.569 0.300 . 1 . . . . 47 ILE CB . 11400 1 474 . 1 1 47 47 ILE CD1 C 13 13.105 0.300 . 1 . . . . 47 ILE CD1 . 11400 1 475 . 1 1 47 47 ILE CG1 C 13 29.975 0.300 . 1 . . . . 47 ILE CG1 . 11400 1 476 . 1 1 47 47 ILE CG2 C 13 16.299 0.300 . 1 . . . . 47 ILE CG2 . 11400 1 477 . 1 1 47 47 ILE N N 15 128.275 0.300 . 1 . . . . 47 ILE N . 11400 1 478 . 1 1 48 48 VAL H H 1 7.523 0.030 . 1 . . . . 48 VAL H . 11400 1 479 . 1 1 48 48 VAL HA H 1 3.771 0.030 . 1 . . . . 48 VAL HA . 11400 1 480 . 1 1 48 48 VAL HB H 1 0.688 0.030 . 1 . . . . 48 VAL HB . 11400 1 481 . 1 1 48 48 VAL HG11 H 1 0.688 0.030 . 1 . . . . 48 VAL HG1 . 11400 1 482 . 1 1 48 48 VAL HG12 H 1 0.688 0.030 . 1 . . . . 48 VAL HG1 . 11400 1 483 . 1 1 48 48 VAL HG13 H 1 0.688 0.030 . 1 . . . . 48 VAL HG1 . 11400 1 484 . 1 1 48 48 VAL HG21 H 1 0.575 0.030 . 1 . . . . 48 VAL HG2 . 11400 1 485 . 1 1 48 48 VAL HG22 H 1 0.575 0.030 . 1 . . . . 48 VAL HG2 . 11400 1 486 . 1 1 48 48 VAL HG23 H 1 0.575 0.030 . 1 . . . . 48 VAL HG2 . 11400 1 487 . 1 1 48 48 VAL C C 13 173.820 0.300 . 1 . . . . 48 VAL C . 11400 1 488 . 1 1 48 48 VAL CA C 13 63.003 0.300 . 1 . . . . 48 VAL CA . 11400 1 489 . 1 1 48 48 VAL CB C 13 30.536 0.300 . 1 . . . . 48 VAL CB . 11400 1 490 . 1 1 48 48 VAL CG1 C 13 21.743 0.300 . 2 . . . . 48 VAL CG1 . 11400 1 491 . 1 1 48 48 VAL CG2 C 13 21.785 0.300 . 2 . . . . 48 VAL CG2 . 11400 1 492 . 1 1 48 48 VAL N N 15 127.261 0.300 . 1 . . . . 48 VAL N . 11400 1 493 . 1 1 49 49 TYR H H 1 8.355 0.030 . 1 . . . . 49 TYR H . 11400 1 494 . 1 1 49 49 TYR HA H 1 4.697 0.030 . 1 . . . . 49 TYR HA . 11400 1 495 . 1 1 49 49 TYR HB2 H 1 2.585 0.030 . 2 . . . . 49 TYR HB2 . 11400 1 496 . 1 1 49 49 TYR HB3 H 1 2.522 0.030 . 2 . . . . 49 TYR HB3 . 11400 1 497 . 1 1 49 49 TYR HD1 H 1 6.859 0.030 . 1 . . . . 49 TYR HD1 . 11400 1 498 . 1 1 49 49 TYR HD2 H 1 6.859 0.030 . 1 . . . . 49 TYR HD2 . 11400 1 499 . 1 1 49 49 TYR HE1 H 1 6.747 0.030 . 1 . . . . 49 TYR HE1 . 11400 1 500 . 1 1 49 49 TYR HE2 H 1 6.747 0.030 . 1 . . . . 49 TYR HE2 . 11400 1 501 . 1 1 49 49 TYR C C 13 176.489 0.300 . 1 . . . . 49 TYR C . 11400 1 502 . 1 1 49 49 TYR CA C 13 57.285 0.300 . 1 . . . . 49 TYR CA . 11400 1 503 . 1 1 49 49 TYR CB C 13 41.001 0.300 . 1 . . . . 49 TYR CB . 11400 1 504 . 1 1 49 49 TYR CD1 C 13 133.288 0.300 . 1 . . . . 49 TYR CD1 . 11400 1 505 . 1 1 49 49 TYR CD2 C 13 133.288 0.300 . 1 . . . . 49 TYR CD2 . 11400 1 506 . 1 1 49 49 TYR CE1 C 13 117.846 0.300 . 1 . . . . 49 TYR CE1 . 11400 1 507 . 1 1 49 49 TYR CE2 C 13 117.846 0.300 . 1 . . . . 49 TYR CE2 . 11400 1 508 . 1 1 49 49 TYR N N 15 125.493 0.300 . 1 . . . . 49 TYR N . 11400 1 509 . 1 1 50 50 ASP H H 1 8.856 0.030 . 1 . . . . 50 ASP H . 11400 1 510 . 1 1 50 50 ASP HA H 1 4.551 0.030 . 1 . . . . 50 ASP HA . 11400 1 511 . 1 1 50 50 ASP HB2 H 1 2.516 0.030 . 1 . . . . 50 ASP HB2 . 11400 1 512 . 1 1 50 50 ASP HB3 H 1 2.516 0.030 . 1 . . . . 50 ASP HB3 . 11400 1 513 . 1 1 50 50 ASP C C 13 177.267 0.300 . 1 . . . . 50 ASP C . 11400 1 514 . 1 1 50 50 ASP CA C 13 54.109 0.300 . 1 . . . . 50 ASP CA . 11400 1 515 . 1 1 50 50 ASP CB C 13 42.438 0.300 . 1 . . . . 50 ASP CB . 11400 1 516 . 1 1 50 50 ASP N N 15 122.932 0.300 . 1 . . . . 50 ASP N . 11400 1 517 . 1 1 51 51 GLN H H 1 9.026 0.030 . 1 . . . . 51 GLN H . 11400 1 518 . 1 1 51 51 GLN HA H 1 4.007 0.030 . 1 . . . . 51 GLN HA . 11400 1 519 . 1 1 51 51 GLN HB2 H 1 2.162 0.030 . 2 . . . . 51 GLN HB2 . 11400 1 520 . 1 1 51 51 GLN HB3 H 1 2.104 0.030 . 2 . . . . 51 GLN HB3 . 11400 1 521 . 1 1 51 51 GLN HG2 H 1 2.483 0.030 . 2 . . . . 51 GLN HG2 . 11400 1 522 . 1 1 51 51 GLN HG3 H 1 2.450 0.030 . 2 . . . . 51 GLN HG3 . 11400 1 523 . 1 1 51 51 GLN C C 13 176.773 0.300 . 1 . . . . 51 GLN C . 11400 1 524 . 1 1 51 51 GLN CA C 13 58.471 0.300 . 1 . . . . 51 GLN CA . 11400 1 525 . 1 1 51 51 GLN CB C 13 28.691 0.300 . 1 . . . . 51 GLN CB . 11400 1 526 . 1 1 51 51 GLN CG C 13 34.042 0.300 . 1 . . . . 51 GLN CG . 11400 1 527 . 1 1 51 51 GLN N N 15 126.005 0.300 . 1 . . . . 51 GLN N . 11400 1 528 . 1 1 52 52 GLN H H 1 8.482 0.030 . 1 . . . . 52 GLN H . 11400 1 529 . 1 1 52 52 GLN HA H 1 4.279 0.030 . 1 . . . . 52 GLN HA . 11400 1 530 . 1 1 52 52 GLN HB2 H 1 2.168 0.030 . 1 . . . . 52 GLN HB2 . 11400 1 531 . 1 1 52 52 GLN HB3 H 1 2.168 0.030 . 1 . . . . 52 GLN HB3 . 11400 1 532 . 1 1 52 52 GLN HG2 H 1 2.410 0.030 . 2 . . . . 52 GLN HG2 . 11400 1 533 . 1 1 52 52 GLN HG3 H 1 2.364 0.030 . 2 . . . . 52 GLN HG3 . 11400 1 534 . 1 1 52 52 GLN C C 13 177.111 0.300 . 1 . . . . 52 GLN C . 11400 1 535 . 1 1 52 52 GLN CA C 13 57.951 0.300 . 1 . . . . 52 GLN CA . 11400 1 536 . 1 1 52 52 GLN CB C 13 29.033 0.300 . 1 . . . . 52 GLN CB . 11400 1 537 . 1 1 52 52 GLN CG C 13 34.284 0.300 . 1 . . . . 52 GLN CG . 11400 1 538 . 1 1 52 52 GLN N N 15 117.072 0.300 . 1 . . . . 52 GLN N . 11400 1 539 . 1 1 53 53 SER H H 1 8.343 0.030 . 1 . . . . 53 SER H . 11400 1 540 . 1 1 53 53 SER HA H 1 4.370 0.030 . 1 . . . . 53 SER HA . 11400 1 541 . 1 1 53 53 SER HB2 H 1 3.952 0.030 . 2 . . . . 53 SER HB2 . 11400 1 542 . 1 1 53 53 SER HB3 H 1 3.837 0.030 . 2 . . . . 53 SER HB3 . 11400 1 543 . 1 1 53 53 SER C C 13 175.084 0.300 . 1 . . . . 53 SER C . 11400 1 544 . 1 1 53 53 SER CA C 13 58.831 0.300 . 1 . . . . 53 SER CA . 11400 1 545 . 1 1 53 53 SER CB C 13 64.774 0.300 . 1 . . . . 53 SER CB . 11400 1 546 . 1 1 53 53 SER N N 15 113.478 0.300 . 1 . . . . 53 SER N . 11400 1 547 . 1 1 54 54 ARG H H 1 8.066 0.030 . 1 . . . . 54 ARG H . 11400 1 548 . 1 1 54 54 ARG HA H 1 3.924 0.030 . 1 . . . . 54 ARG HA . 11400 1 549 . 1 1 54 54 ARG HB2 H 1 2.070 0.030 . 2 . . . . 54 ARG HB2 . 11400 1 550 . 1 1 54 54 ARG HB3 H 1 1.960 0.030 . 2 . . . . 54 ARG HB3 . 11400 1 551 . 1 1 54 54 ARG HD2 H 1 3.108 0.030 . 2 . . . . 54 ARG HD2 . 11400 1 552 . 1 1 54 54 ARG HD3 H 1 3.062 0.030 . 2 . . . . 54 ARG HD3 . 11400 1 553 . 1 1 54 54 ARG HG2 H 1 1.531 0.030 . 2 . . . . 54 ARG HG2 . 11400 1 554 . 1 1 54 54 ARG HG3 H 1 1.453 0.030 . 2 . . . . 54 ARG HG3 . 11400 1 555 . 1 1 54 54 ARG C C 13 174.866 0.300 . 1 . . . . 54 ARG C . 11400 1 556 . 1 1 54 54 ARG CA C 13 57.292 0.300 . 1 . . . . 54 ARG CA . 11400 1 557 . 1 1 54 54 ARG CB C 13 26.780 0.300 . 1 . . . . 54 ARG CB . 11400 1 558 . 1 1 54 54 ARG CD C 13 42.824 0.300 . 1 . . . . 54 ARG CD . 11400 1 559 . 1 1 54 54 ARG CG C 13 27.055 0.300 . 1 . . . . 54 ARG CG . 11400 1 560 . 1 1 54 54 ARG N N 15 116.627 0.300 . 1 . . . . 54 ARG N . 11400 1 561 . 1 1 55 55 ARG H H 1 7.749 0.030 . 1 . . . . 55 ARG H . 11400 1 562 . 1 1 55 55 ARG HA H 1 4.534 0.030 . 1 . . . . 55 ARG HA . 11400 1 563 . 1 1 55 55 ARG HB2 H 1 1.847 0.030 . 2 . . . . 55 ARG HB2 . 11400 1 564 . 1 1 55 55 ARG HB3 H 1 1.675 0.030 . 2 . . . . 55 ARG HB3 . 11400 1 565 . 1 1 55 55 ARG HD2 H 1 3.196 0.030 . 2 . . . . 55 ARG HD2 . 11400 1 566 . 1 1 55 55 ARG HD3 H 1 3.164 0.030 . 2 . . . . 55 ARG HD3 . 11400 1 567 . 1 1 55 55 ARG HG2 H 1 1.671 0.030 . 1 . . . . 55 ARG HG2 . 11400 1 568 . 1 1 55 55 ARG HG3 H 1 1.671 0.030 . 1 . . . . 55 ARG HG3 . 11400 1 569 . 1 1 55 55 ARG C C 13 176.212 0.300 . 1 . . . . 55 ARG C . 11400 1 570 . 1 1 55 55 ARG CA C 13 55.212 0.300 . 1 . . . . 55 ARG CA . 11400 1 571 . 1 1 55 55 ARG CB C 13 32.250 0.300 . 1 . . . . 55 ARG CB . 11400 1 572 . 1 1 55 55 ARG CD C 13 43.478 0.300 . 1 . . . . 55 ARG CD . 11400 1 573 . 1 1 55 55 ARG CG C 13 27.275 0.300 . 1 . . . . 55 ARG CG . 11400 1 574 . 1 1 55 55 ARG N N 15 117.928 0.300 . 1 . . . . 55 ARG N . 11400 1 575 . 1 1 56 56 SER H H 1 8.865 0.030 . 1 . . . . 56 SER H . 11400 1 576 . 1 1 56 56 SER HA H 1 3.874 0.030 . 1 . . . . 56 SER HA . 11400 1 577 . 1 1 56 56 SER HB2 H 1 3.876 0.030 . 2 . . . . 56 SER HB2 . 11400 1 578 . 1 1 56 56 SER HB3 H 1 3.749 0.030 . 2 . . . . 56 SER HB3 . 11400 1 579 . 1 1 56 56 SER C C 13 175.579 0.300 . 1 . . . . 56 SER C . 11400 1 580 . 1 1 56 56 SER CA C 13 58.203 0.300 . 1 . . . . 56 SER CA . 11400 1 581 . 1 1 56 56 SER CB C 13 64.166 0.300 . 1 . . . . 56 SER CB . 11400 1 582 . 1 1 56 56 SER N N 15 117.317 0.300 . 1 . . . . 56 SER N . 11400 1 583 . 1 1 57 57 ARG H H 1 8.922 0.030 . 1 . . . . 57 ARG H . 11400 1 584 . 1 1 57 57 ARG HA H 1 4.351 0.030 . 1 . . . . 57 ARG HA . 11400 1 585 . 1 1 57 57 ARG HB2 H 1 2.194 0.030 . 2 . . . . 57 ARG HB2 . 11400 1 586 . 1 1 57 57 ARG HB3 H 1 1.210 0.030 . 2 . . . . 57 ARG HB3 . 11400 1 587 . 1 1 57 57 ARG HD2 H 1 3.197 0.030 . 2 . . . . 57 ARG HD2 . 11400 1 588 . 1 1 57 57 ARG HD3 H 1 3.055 0.030 . 2 . . . . 57 ARG HD3 . 11400 1 589 . 1 1 57 57 ARG HG2 H 1 1.612 0.030 . 1 . . . . 57 ARG HG2 . 11400 1 590 . 1 1 57 57 ARG HG3 H 1 1.612 0.030 . 1 . . . . 57 ARG HG3 . 11400 1 591 . 1 1 57 57 ARG C C 13 177.894 0.300 . 1 . . . . 57 ARG C . 11400 1 592 . 1 1 57 57 ARG CA C 13 56.381 0.300 . 1 . . . . 57 ARG CA . 11400 1 593 . 1 1 57 57 ARG CB C 13 30.552 0.300 . 1 . . . . 57 ARG CB . 11400 1 594 . 1 1 57 57 ARG CD C 13 43.468 0.300 . 1 . . . . 57 ARG CD . 11400 1 595 . 1 1 57 57 ARG CG C 13 28.066 0.300 . 1 . . . . 57 ARG CG . 11400 1 596 . 1 1 57 57 ARG N N 15 122.565 0.300 . 1 . . . . 57 ARG N . 11400 1 597 . 1 1 58 58 GLY H H 1 9.163 0.030 . 1 . . . . 58 GLY H . 11400 1 598 . 1 1 58 58 GLY HA2 H 1 4.069 0.030 . 2 . . . . 58 GLY HA2 . 11400 1 599 . 1 1 58 58 GLY HA3 H 1 3.190 0.030 . 2 . . . . 58 GLY HA3 . 11400 1 600 . 1 1 58 58 GLY C C 13 171.690 0.300 . 1 . . . . 58 GLY C . 11400 1 601 . 1 1 58 58 GLY CA C 13 46.000 0.300 . 1 . . . . 58 GLY CA . 11400 1 602 . 1 1 58 58 GLY N N 15 107.701 0.300 . 1 . . . . 58 GLY N . 11400 1 603 . 1 1 59 59 PHE H H 1 6.979 0.030 . 1 . . . . 59 PHE H . 11400 1 604 . 1 1 59 59 PHE HA H 1 5.189 0.030 . 1 . . . . 59 PHE HA . 11400 1 605 . 1 1 59 59 PHE HB2 H 1 3.172 0.030 . 2 . . . . 59 PHE HB2 . 11400 1 606 . 1 1 59 59 PHE HB3 H 1 2.534 0.030 . 2 . . . . 59 PHE HB3 . 11400 1 607 . 1 1 59 59 PHE HD1 H 1 6.662 0.030 . 1 . . . . 59 PHE HD1 . 11400 1 608 . 1 1 59 59 PHE HD2 H 1 6.662 0.030 . 1 . . . . 59 PHE HD2 . 11400 1 609 . 1 1 59 59 PHE HE1 H 1 7.182 0.030 . 1 . . . . 59 PHE HE1 . 11400 1 610 . 1 1 59 59 PHE HE2 H 1 7.182 0.030 . 1 . . . . 59 PHE HE2 . 11400 1 611 . 1 1 59 59 PHE HZ H 1 7.248 0.030 . 1 . . . . 59 PHE HZ . 11400 1 612 . 1 1 59 59 PHE C C 13 171.696 0.300 . 1 . . . . 59 PHE C . 11400 1 613 . 1 1 59 59 PHE CA C 13 54.846 0.300 . 1 . . . . 59 PHE CA . 11400 1 614 . 1 1 59 59 PHE CB C 13 41.855 0.300 . 1 . . . . 59 PHE CB . 11400 1 615 . 1 1 59 59 PHE CD1 C 13 132.711 0.300 . 1 . . . . 59 PHE CD1 . 11400 1 616 . 1 1 59 59 PHE CD2 C 13 132.711 0.300 . 1 . . . . 59 PHE CD2 . 11400 1 617 . 1 1 59 59 PHE CE1 C 13 131.149 0.300 . 1 . . . . 59 PHE CE1 . 11400 1 618 . 1 1 59 59 PHE CE2 C 13 131.149 0.300 . 1 . . . . 59 PHE CE2 . 11400 1 619 . 1 1 59 59 PHE CZ C 13 129.450 0.300 . 1 . . . . 59 PHE CZ . 11400 1 620 . 1 1 59 59 PHE N N 15 112.713 0.300 . 1 . . . . 59 PHE N . 11400 1 621 . 1 1 60 60 ALA H H 1 8.511 0.030 . 1 . . . . 60 ALA H . 11400 1 622 . 1 1 60 60 ALA HA H 1 4.657 0.030 . 1 . . . . 60 ALA HA . 11400 1 623 . 1 1 60 60 ALA HB1 H 1 0.805 0.030 . 1 . . . . 60 ALA HB . 11400 1 624 . 1 1 60 60 ALA HB2 H 1 0.805 0.030 . 1 . . . . 60 ALA HB . 11400 1 625 . 1 1 60 60 ALA HB3 H 1 0.805 0.030 . 1 . . . . 60 ALA HB . 11400 1 626 . 1 1 60 60 ALA C C 13 173.445 0.300 . 1 . . . . 60 ALA C . 11400 1 627 . 1 1 60 60 ALA CA C 13 49.754 0.300 . 1 . . . . 60 ALA CA . 11400 1 628 . 1 1 60 60 ALA CB C 13 26.178 0.300 . 1 . . . . 60 ALA CB . 11400 1 629 . 1 1 60 60 ALA N N 15 119.981 0.300 . 1 . . . . 60 ALA N . 11400 1 630 . 1 1 61 61 PHE H H 1 8.380 0.030 . 1 . . . . 61 PHE H . 11400 1 631 . 1 1 61 61 PHE HA H 1 5.228 0.030 . 1 . . . . 61 PHE HA . 11400 1 632 . 1 1 61 61 PHE HB2 H 1 2.518 0.030 . 1 . . . . 61 PHE HB2 . 11400 1 633 . 1 1 61 61 PHE HB3 H 1 2.518 0.030 . 1 . . . . 61 PHE HB3 . 11400 1 634 . 1 1 61 61 PHE HD1 H 1 6.983 0.030 . 1 . . . . 61 PHE HD1 . 11400 1 635 . 1 1 61 61 PHE HD2 H 1 6.983 0.030 . 1 . . . . 61 PHE HD2 . 11400 1 636 . 1 1 61 61 PHE C C 13 174.466 0.300 . 1 . . . . 61 PHE C . 11400 1 637 . 1 1 61 61 PHE CA C 13 56.443 0.300 . 1 . . . . 61 PHE CA . 11400 1 638 . 1 1 61 61 PHE CB C 13 42.518 0.300 . 1 . . . . 61 PHE CB . 11400 1 639 . 1 1 61 61 PHE CD1 C 13 131.825 0.300 . 1 . . . . 61 PHE CD1 . 11400 1 640 . 1 1 61 61 PHE CD2 C 13 131.825 0.300 . 1 . . . . 61 PHE CD2 . 11400 1 641 . 1 1 61 61 PHE N N 15 115.591 0.300 . 1 . . . . 61 PHE N . 11400 1 642 . 1 1 62 62 VAL H H 1 8.930 0.030 . 1 . . . . 62 VAL H . 11400 1 643 . 1 1 62 62 VAL HA H 1 4.183 0.030 . 1 . . . . 62 VAL HA . 11400 1 644 . 1 1 62 62 VAL HB H 1 1.397 0.030 . 1 . . . . 62 VAL HB . 11400 1 645 . 1 1 62 62 VAL HG11 H 1 0.280 0.030 . 1 . . . . 62 VAL HG1 . 11400 1 646 . 1 1 62 62 VAL HG12 H 1 0.280 0.030 . 1 . . . . 62 VAL HG1 . 11400 1 647 . 1 1 62 62 VAL HG13 H 1 0.280 0.030 . 1 . . . . 62 VAL HG1 . 11400 1 648 . 1 1 62 62 VAL HG21 H 1 0.229 0.030 . 1 . . . . 62 VAL HG2 . 11400 1 649 . 1 1 62 62 VAL HG22 H 1 0.229 0.030 . 1 . . . . 62 VAL HG2 . 11400 1 650 . 1 1 62 62 VAL HG23 H 1 0.229 0.030 . 1 . . . . 62 VAL HG2 . 11400 1 651 . 1 1 62 62 VAL C C 13 173.186 0.300 . 1 . . . . 62 VAL C . 11400 1 652 . 1 1 62 62 VAL CA C 13 61.173 0.300 . 1 . . . . 62 VAL CA . 11400 1 653 . 1 1 62 62 VAL CB C 13 34.252 0.300 . 1 . . . . 62 VAL CB . 11400 1 654 . 1 1 62 62 VAL CG1 C 13 20.703 0.300 . 2 . . . . 62 VAL CG1 . 11400 1 655 . 1 1 62 62 VAL CG2 C 13 21.454 0.300 . 2 . . . . 62 VAL CG2 . 11400 1 656 . 1 1 62 62 VAL N N 15 122.963 0.300 . 1 . . . . 62 VAL N . 11400 1 657 . 1 1 63 63 TYR H H 1 8.795 0.030 . 1 . . . . 63 TYR H . 11400 1 658 . 1 1 63 63 TYR HA H 1 5.044 0.030 . 1 . . . . 63 TYR HA . 11400 1 659 . 1 1 63 63 TYR HB2 H 1 2.831 0.030 . 2 . . . . 63 TYR HB2 . 11400 1 660 . 1 1 63 63 TYR HB3 H 1 2.749 0.030 . 2 . . . . 63 TYR HB3 . 11400 1 661 . 1 1 63 63 TYR HD1 H 1 6.882 0.030 . 1 . . . . 63 TYR HD1 . 11400 1 662 . 1 1 63 63 TYR HD2 H 1 6.882 0.030 . 1 . . . . 63 TYR HD2 . 11400 1 663 . 1 1 63 63 TYR HE1 H 1 6.578 0.030 . 1 . . . . 63 TYR HE1 . 11400 1 664 . 1 1 63 63 TYR HE2 H 1 6.578 0.030 . 1 . . . . 63 TYR HE2 . 11400 1 665 . 1 1 63 63 TYR C C 13 175.947 0.300 . 1 . . . . 63 TYR C . 11400 1 666 . 1 1 63 63 TYR CA C 13 56.568 0.300 . 1 . . . . 63 TYR CA . 11400 1 667 . 1 1 63 63 TYR CB C 13 39.042 0.300 . 1 . . . . 63 TYR CB . 11400 1 668 . 1 1 63 63 TYR CD1 C 13 133.004 0.300 . 1 . . . . 63 TYR CD1 . 11400 1 669 . 1 1 63 63 TYR CD2 C 13 133.004 0.300 . 1 . . . . 63 TYR CD2 . 11400 1 670 . 1 1 63 63 TYR CE1 C 13 118.558 0.300 . 1 . . . . 63 TYR CE1 . 11400 1 671 . 1 1 63 63 TYR CE2 C 13 118.558 0.300 . 1 . . . . 63 TYR CE2 . 11400 1 672 . 1 1 63 63 TYR N N 15 124.344 0.300 . 1 . . . . 63 TYR N . 11400 1 673 . 1 1 64 64 PHE H H 1 8.932 0.030 . 1 . . . . 64 PHE H . 11400 1 674 . 1 1 64 64 PHE HA H 1 4.558 0.030 . 1 . . . . 64 PHE HA . 11400 1 675 . 1 1 64 64 PHE HB2 H 1 2.778 0.030 . 1 . . . . 64 PHE HB2 . 11400 1 676 . 1 1 64 64 PHE HB3 H 1 2.778 0.030 . 1 . . . . 64 PHE HB3 . 11400 1 677 . 1 1 64 64 PHE HD1 H 1 7.289 0.030 . 1 . . . . 64 PHE HD1 . 11400 1 678 . 1 1 64 64 PHE HD2 H 1 7.289 0.030 . 1 . . . . 64 PHE HD2 . 11400 1 679 . 1 1 64 64 PHE HE1 H 1 7.147 0.030 . 1 . . . . 64 PHE HE1 . 11400 1 680 . 1 1 64 64 PHE HE2 H 1 7.147 0.030 . 1 . . . . 64 PHE HE2 . 11400 1 681 . 1 1 64 64 PHE HZ H 1 7.385 0.030 . 1 . . . . 64 PHE HZ . 11400 1 682 . 1 1 64 64 PHE C C 13 175.567 0.300 . 1 . . . . 64 PHE C . 11400 1 683 . 1 1 64 64 PHE CA C 13 59.076 0.300 . 1 . . . . 64 PHE CA . 11400 1 684 . 1 1 64 64 PHE CB C 13 40.390 0.300 . 1 . . . . 64 PHE CB . 11400 1 685 . 1 1 64 64 PHE CD1 C 13 131.450 0.300 . 1 . . . . 64 PHE CD1 . 11400 1 686 . 1 1 64 64 PHE CD2 C 13 131.450 0.300 . 1 . . . . 64 PHE CD2 . 11400 1 687 . 1 1 64 64 PHE CE1 C 13 131.397 0.300 . 1 . . . . 64 PHE CE1 . 11400 1 688 . 1 1 64 64 PHE CE2 C 13 131.397 0.300 . 1 . . . . 64 PHE CE2 . 11400 1 689 . 1 1 64 64 PHE CZ C 13 129.166 0.300 . 1 . . . . 64 PHE CZ . 11400 1 690 . 1 1 64 64 PHE N N 15 124.505 0.300 . 1 . . . . 64 PHE N . 11400 1 691 . 1 1 65 65 GLU H H 1 7.960 0.030 . 1 . . . . 65 GLU H . 11400 1 692 . 1 1 65 65 GLU HA H 1 4.220 0.030 . 1 . . . . 65 GLU HA . 11400 1 693 . 1 1 65 65 GLU HB2 H 1 2.119 0.030 . 2 . . . . 65 GLU HB2 . 11400 1 694 . 1 1 65 65 GLU HB3 H 1 1.946 0.030 . 2 . . . . 65 GLU HB3 . 11400 1 695 . 1 1 65 65 GLU HG2 H 1 2.130 0.030 . 1 . . . . 65 GLU HG2 . 11400 1 696 . 1 1 65 65 GLU HG3 H 1 2.130 0.030 . 1 . . . . 65 GLU HG3 . 11400 1 697 . 1 1 65 65 GLU C C 13 176.908 0.300 . 1 . . . . 65 GLU C . 11400 1 698 . 1 1 65 65 GLU CA C 13 59.286 0.300 . 1 . . . . 65 GLU CA . 11400 1 699 . 1 1 65 65 GLU CB C 13 30.479 0.300 . 1 . . . . 65 GLU CB . 11400 1 700 . 1 1 65 65 GLU CG C 13 36.666 0.300 . 1 . . . . 65 GLU CG . 11400 1 701 . 1 1 65 65 GLU N N 15 117.920 0.300 . 1 . . . . 65 GLU N . 11400 1 702 . 1 1 66 66 ASN H H 1 9.172 0.030 . 1 . . . . 66 ASN H . 11400 1 703 . 1 1 66 66 ASN HA H 1 5.138 0.030 . 1 . . . . 66 ASN HA . 11400 1 704 . 1 1 66 66 ASN HB2 H 1 2.960 0.030 . 2 . . . . 66 ASN HB2 . 11400 1 705 . 1 1 66 66 ASN HB3 H 1 2.764 0.030 . 2 . . . . 66 ASN HB3 . 11400 1 706 . 1 1 66 66 ASN HD21 H 1 7.628 0.030 . 2 . . . . 66 ASN HD21 . 11400 1 707 . 1 1 66 66 ASN HD22 H 1 7.261 0.030 . 2 . . . . 66 ASN HD22 . 11400 1 708 . 1 1 66 66 ASN C C 13 175.822 0.300 . 1 . . . . 66 ASN C . 11400 1 709 . 1 1 66 66 ASN CA C 13 51.906 0.300 . 1 . . . . 66 ASN CA . 11400 1 710 . 1 1 66 66 ASN CB C 13 40.923 0.300 . 1 . . . . 66 ASN CB . 11400 1 711 . 1 1 66 66 ASN N N 15 116.139 0.300 . 1 . . . . 66 ASN N . 11400 1 712 . 1 1 66 66 ASN ND2 N 15 114.828 0.300 . 1 . . . . 66 ASN ND2 . 11400 1 713 . 1 1 67 67 VAL H H 1 8.781 0.030 . 1 . . . . 67 VAL H . 11400 1 714 . 1 1 67 67 VAL HA H 1 3.691 0.030 . 1 . . . . 67 VAL HA . 11400 1 715 . 1 1 67 67 VAL HB H 1 2.010 0.030 . 1 . . . . 67 VAL HB . 11400 1 716 . 1 1 67 67 VAL HG11 H 1 0.952 0.030 . 1 . . . . 67 VAL HG1 . 11400 1 717 . 1 1 67 67 VAL HG12 H 1 0.952 0.030 . 1 . . . . 67 VAL HG1 . 11400 1 718 . 1 1 67 67 VAL HG13 H 1 0.952 0.030 . 1 . . . . 67 VAL HG1 . 11400 1 719 . 1 1 67 67 VAL HG21 H 1 0.926 0.030 . 1 . . . . 67 VAL HG2 . 11400 1 720 . 1 1 67 67 VAL HG22 H 1 0.926 0.030 . 1 . . . . 67 VAL HG2 . 11400 1 721 . 1 1 67 67 VAL HG23 H 1 0.926 0.030 . 1 . . . . 67 VAL HG2 . 11400 1 722 . 1 1 67 67 VAL C C 13 176.984 0.300 . 1 . . . . 67 VAL C . 11400 1 723 . 1 1 67 67 VAL CA C 13 65.669 0.300 . 1 . . . . 67 VAL CA . 11400 1 724 . 1 1 67 67 VAL CB C 13 31.965 0.300 . 1 . . . . 67 VAL CB . 11400 1 725 . 1 1 67 67 VAL CG1 C 13 22.593 0.300 . 2 . . . . 67 VAL CG1 . 11400 1 726 . 1 1 67 67 VAL CG2 C 13 20.678 0.300 . 2 . . . . 67 VAL CG2 . 11400 1 727 . 1 1 67 67 VAL N N 15 125.560 0.300 . 1 . . . . 67 VAL N . 11400 1 728 . 1 1 68 68 ASP H H 1 8.426 0.030 . 1 . . . . 68 ASP H . 11400 1 729 . 1 1 68 68 ASP HA H 1 4.341 0.030 . 1 . . . . 68 ASP HA . 11400 1 730 . 1 1 68 68 ASP HB2 H 1 2.682 0.030 . 2 . . . . 68 ASP HB2 . 11400 1 731 . 1 1 68 68 ASP HB3 H 1 2.571 0.030 . 2 . . . . 68 ASP HB3 . 11400 1 732 . 1 1 68 68 ASP C C 13 178.657 0.300 . 1 . . . . 68 ASP C . 11400 1 733 . 1 1 68 68 ASP CA C 13 57.533 0.300 . 1 . . . . 68 ASP CA . 11400 1 734 . 1 1 68 68 ASP CB C 13 39.959 0.300 . 1 . . . . 68 ASP CB . 11400 1 735 . 1 1 68 68 ASP N N 15 120.512 0.300 . 1 . . . . 68 ASP N . 11400 1 736 . 1 1 69 69 ASP H H 1 7.241 0.030 . 1 . . . . 69 ASP H . 11400 1 737 . 1 1 69 69 ASP HA H 1 4.357 0.030 . 1 . . . . 69 ASP HA . 11400 1 738 . 1 1 69 69 ASP HB2 H 1 2.930 0.030 . 2 . . . . 69 ASP HB2 . 11400 1 739 . 1 1 69 69 ASP HB3 H 1 2.570 0.030 . 2 . . . . 69 ASP HB3 . 11400 1 740 . 1 1 69 69 ASP C C 13 176.590 0.300 . 1 . . . . 69 ASP C . 11400 1 741 . 1 1 69 69 ASP CA C 13 56.562 0.300 . 1 . . . . 69 ASP CA . 11400 1 742 . 1 1 69 69 ASP CB C 13 40.038 0.300 . 1 . . . . 69 ASP CB . 11400 1 743 . 1 1 69 69 ASP N N 15 122.123 0.300 . 1 . . . . 69 ASP N . 11400 1 744 . 1 1 70 70 ALA H H 1 6.878 0.030 . 1 . . . . 70 ALA H . 11400 1 745 . 1 1 70 70 ALA HA H 1 2.871 0.030 . 1 . . . . 70 ALA HA . 11400 1 746 . 1 1 70 70 ALA HB1 H 1 1.295 0.030 . 1 . . . . 70 ALA HB . 11400 1 747 . 1 1 70 70 ALA HB2 H 1 1.295 0.030 . 1 . . . . 70 ALA HB . 11400 1 748 . 1 1 70 70 ALA HB3 H 1 1.295 0.030 . 1 . . . . 70 ALA HB . 11400 1 749 . 1 1 70 70 ALA C C 13 179.021 0.300 . 1 . . . . 70 ALA C . 11400 1 750 . 1 1 70 70 ALA CA C 13 54.477 0.300 . 1 . . . . 70 ALA CA . 11400 1 751 . 1 1 70 70 ALA CB C 13 18.046 0.300 . 1 . . . . 70 ALA CB . 11400 1 752 . 1 1 70 70 ALA N N 15 121.112 0.300 . 1 . . . . 70 ALA N . 11400 1 753 . 1 1 71 71 LYS H H 1 7.799 0.030 . 1 . . . . 71 LYS H . 11400 1 754 . 1 1 71 71 LYS HA H 1 3.761 0.030 . 1 . . . . 71 LYS HA . 11400 1 755 . 1 1 71 71 LYS HB2 H 1 1.882 0.030 . 1 . . . . 71 LYS HB2 . 11400 1 756 . 1 1 71 71 LYS HB3 H 1 1.882 0.030 . 1 . . . . 71 LYS HB3 . 11400 1 757 . 1 1 71 71 LYS HD2 H 1 1.681 0.030 . 2 . . . . 71 LYS HD2 . 11400 1 758 . 1 1 71 71 LYS HD3 H 1 1.558 0.030 . 2 . . . . 71 LYS HD3 . 11400 1 759 . 1 1 71 71 LYS HG2 H 1 1.580 0.030 . 2 . . . . 71 LYS HG2 . 11400 1 760 . 1 1 71 71 LYS HG3 H 1 1.352 0.030 . 2 . . . . 71 LYS HG3 . 11400 1 761 . 1 1 71 71 LYS C C 13 178.827 0.300 . 1 . . . . 71 LYS C . 11400 1 762 . 1 1 71 71 LYS CA C 13 59.982 0.300 . 1 . . . . 71 LYS CA . 11400 1 763 . 1 1 71 71 LYS CB C 13 32.458 0.300 . 1 . . . . 71 LYS CB . 11400 1 764 . 1 1 71 71 LYS CD C 13 29.616 0.300 . 1 . . . . 71 LYS CD . 11400 1 765 . 1 1 71 71 LYS CE C 13 42.117 0.300 . 1 . . . . 71 LYS CE . 11400 1 766 . 1 1 71 71 LYS CG C 13 25.358 0.300 . 1 . . . . 71 LYS CG . 11400 1 767 . 1 1 71 71 LYS N N 15 116.932 0.300 . 1 . . . . 71 LYS N . 11400 1 768 . 1 1 72 72 GLU H H 1 7.330 0.030 . 1 . . . . 72 GLU H . 11400 1 769 . 1 1 72 72 GLU HA H 1 4.046 0.030 . 1 . . . . 72 GLU HA . 11400 1 770 . 1 1 72 72 GLU HB2 H 1 2.160 0.030 . 2 . . . . 72 GLU HB2 . 11400 1 771 . 1 1 72 72 GLU HB3 H 1 2.074 0.030 . 2 . . . . 72 GLU HB3 . 11400 1 772 . 1 1 72 72 GLU HG2 H 1 2.493 0.030 . 2 . . . . 72 GLU HG2 . 11400 1 773 . 1 1 72 72 GLU HG3 H 1 2.282 0.030 . 2 . . . . 72 GLU HG3 . 11400 1 774 . 1 1 72 72 GLU C C 13 177.935 0.300 . 1 . . . . 72 GLU C . 11400 1 775 . 1 1 72 72 GLU CA C 13 58.819 0.300 . 1 . . . . 72 GLU CA . 11400 1 776 . 1 1 72 72 GLU CB C 13 29.403 0.300 . 1 . . . . 72 GLU CB . 11400 1 777 . 1 1 72 72 GLU CG C 13 35.423 0.300 . 1 . . . . 72 GLU CG . 11400 1 778 . 1 1 72 72 GLU N N 15 120.060 0.300 . 1 . . . . 72 GLU N . 11400 1 779 . 1 1 73 73 ALA H H 1 7.950 0.030 . 1 . . . . 73 ALA H . 11400 1 780 . 1 1 73 73 ALA HA H 1 2.502 0.030 . 1 . . . . 73 ALA HA . 11400 1 781 . 1 1 73 73 ALA HB1 H 1 1.073 0.030 . 1 . . . . 73 ALA HB . 11400 1 782 . 1 1 73 73 ALA HB2 H 1 1.073 0.030 . 1 . . . . 73 ALA HB . 11400 1 783 . 1 1 73 73 ALA HB3 H 1 1.073 0.030 . 1 . . . . 73 ALA HB . 11400 1 784 . 1 1 73 73 ALA C C 13 178.917 0.300 . 1 . . . . 73 ALA C . 11400 1 785 . 1 1 73 73 ALA CA C 13 54.634 0.300 . 1 . . . . 73 ALA CA . 11400 1 786 . 1 1 73 73 ALA CB C 13 20.566 0.300 . 1 . . . . 73 ALA CB . 11400 1 787 . 1 1 73 73 ALA N N 15 120.591 0.300 . 1 . . . . 73 ALA N . 11400 1 788 . 1 1 74 74 LYS H H 1 8.008 0.030 . 1 . . . . 74 LYS H . 11400 1 789 . 1 1 74 74 LYS HA H 1 3.667 0.030 . 1 . . . . 74 LYS HA . 11400 1 790 . 1 1 74 74 LYS HB2 H 1 1.870 0.030 . 2 . . . . 74 LYS HB2 . 11400 1 791 . 1 1 74 74 LYS HB3 H 1 1.830 0.030 . 2 . . . . 74 LYS HB3 . 11400 1 792 . 1 1 74 74 LYS HD2 H 1 1.681 0.030 . 2 . . . . 74 LYS HD2 . 11400 1 793 . 1 1 74 74 LYS HD3 H 1 1.566 0.030 . 2 . . . . 74 LYS HD3 . 11400 1 794 . 1 1 74 74 LYS HE2 H 1 2.926 0.030 . 1 . . . . 74 LYS HE2 . 11400 1 795 . 1 1 74 74 LYS HE3 H 1 2.926 0.030 . 1 . . . . 74 LYS HE3 . 11400 1 796 . 1 1 74 74 LYS HG2 H 1 1.339 0.030 . 1 . . . . 74 LYS HG2 . 11400 1 797 . 1 1 74 74 LYS HG3 H 1 1.339 0.030 . 1 . . . . 74 LYS HG3 . 11400 1 798 . 1 1 74 74 LYS C C 13 177.893 0.300 . 1 . . . . 74 LYS C . 11400 1 799 . 1 1 74 74 LYS CA C 13 59.883 0.300 . 1 . . . . 74 LYS CA . 11400 1 800 . 1 1 74 74 LYS CB C 13 31.823 0.300 . 1 . . . . 74 LYS CB . 11400 1 801 . 1 1 74 74 LYS CD C 13 29.615 0.300 . 1 . . . . 74 LYS CD . 11400 1 802 . 1 1 74 74 LYS CE C 13 42.074 0.300 . 1 . . . . 74 LYS CE . 11400 1 803 . 1 1 74 74 LYS CG C 13 24.724 0.300 . 1 . . . . 74 LYS CG . 11400 1 804 . 1 1 74 74 LYS N N 15 116.682 0.300 . 1 . . . . 74 LYS N . 11400 1 805 . 1 1 75 75 GLU H H 1 7.304 0.030 . 1 . . . . 75 GLU H . 11400 1 806 . 1 1 75 75 GLU HA H 1 4.078 0.030 . 1 . . . . 75 GLU HA . 11400 1 807 . 1 1 75 75 GLU HB2 H 1 2.061 0.030 . 1 . . . . 75 GLU HB2 . 11400 1 808 . 1 1 75 75 GLU HB3 H 1 2.061 0.030 . 1 . . . . 75 GLU HB3 . 11400 1 809 . 1 1 75 75 GLU HG2 H 1 2.363 0.030 . 2 . . . . 75 GLU HG2 . 11400 1 810 . 1 1 75 75 GLU HG3 H 1 2.303 0.030 . 2 . . . . 75 GLU HG3 . 11400 1 811 . 1 1 75 75 GLU C C 13 179.044 0.300 . 1 . . . . 75 GLU C . 11400 1 812 . 1 1 75 75 GLU CA C 13 58.260 0.300 . 1 . . . . 75 GLU CA . 11400 1 813 . 1 1 75 75 GLU CB C 13 30.034 0.300 . 1 . . . . 75 GLU CB . 11400 1 814 . 1 1 75 75 GLU CG C 13 35.965 0.300 . 1 . . . . 75 GLU CG . 11400 1 815 . 1 1 75 75 GLU N N 15 115.457 0.300 . 1 . . . . 75 GLU N . 11400 1 816 . 1 1 76 76 ARG H H 1 8.107 0.030 . 1 . . . . 76 ARG H . 11400 1 817 . 1 1 76 76 ARG HA H 1 4.279 0.030 . 1 . . . . 76 ARG HA . 11400 1 818 . 1 1 76 76 ARG HB2 H 1 2.002 0.030 . 2 . . . . 76 ARG HB2 . 11400 1 819 . 1 1 76 76 ARG HB3 H 1 1.642 0.030 . 2 . . . . 76 ARG HB3 . 11400 1 820 . 1 1 76 76 ARG HD2 H 1 3.231 0.030 . 1 . . . . 76 ARG HD2 . 11400 1 821 . 1 1 76 76 ARG HD3 H 1 3.231 0.030 . 1 . . . . 76 ARG HD3 . 11400 1 822 . 1 1 76 76 ARG HG2 H 1 1.839 0.030 . 2 . . . . 76 ARG HG2 . 11400 1 823 . 1 1 76 76 ARG HG3 H 1 1.783 0.030 . 2 . . . . 76 ARG HG3 . 11400 1 824 . 1 1 76 76 ARG C C 13 178.027 0.300 . 1 . . . . 76 ARG C . 11400 1 825 . 1 1 76 76 ARG CA C 13 57.308 0.300 . 1 . . . . 76 ARG CA . 11400 1 826 . 1 1 76 76 ARG CB C 13 31.512 0.300 . 1 . . . . 76 ARG CB . 11400 1 827 . 1 1 76 76 ARG CD C 13 43.349 0.300 . 1 . . . . 76 ARG CD . 11400 1 828 . 1 1 76 76 ARG CG C 13 27.215 0.300 . 1 . . . . 76 ARG CG . 11400 1 829 . 1 1 76 76 ARG N N 15 115.464 0.300 . 1 . . . . 76 ARG N . 11400 1 830 . 1 1 77 77 ALA H H 1 8.714 0.030 . 1 . . . . 77 ALA H . 11400 1 831 . 1 1 77 77 ALA HA H 1 4.389 0.030 . 1 . . . . 77 ALA HA . 11400 1 832 . 1 1 77 77 ALA HB1 H 1 1.354 0.030 . 1 . . . . 77 ALA HB . 11400 1 833 . 1 1 77 77 ALA HB2 H 1 1.354 0.030 . 1 . . . . 77 ALA HB . 11400 1 834 . 1 1 77 77 ALA HB3 H 1 1.354 0.030 . 1 . . . . 77 ALA HB . 11400 1 835 . 1 1 77 77 ALA C C 13 177.567 0.300 . 1 . . . . 77 ALA C . 11400 1 836 . 1 1 77 77 ALA CA C 13 52.800 0.300 . 1 . . . . 77 ALA CA . 11400 1 837 . 1 1 77 77 ALA CB C 13 20.285 0.300 . 1 . . . . 77 ALA CB . 11400 1 838 . 1 1 77 77 ALA N N 15 119.280 0.300 . 1 . . . . 77 ALA N . 11400 1 839 . 1 1 78 78 ASN H H 1 6.851 0.030 . 1 . . . . 78 ASN H . 11400 1 840 . 1 1 78 78 ASN HA H 1 4.348 0.030 . 1 . . . . 78 ASN HA . 11400 1 841 . 1 1 78 78 ASN HB2 H 1 3.152 0.030 . 2 . . . . 78 ASN HB2 . 11400 1 842 . 1 1 78 78 ASN HB3 H 1 2.890 0.030 . 2 . . . . 78 ASN HB3 . 11400 1 843 . 1 1 78 78 ASN HD21 H 1 7.807 0.030 . 2 . . . . 78 ASN HD21 . 11400 1 844 . 1 1 78 78 ASN HD22 H 1 7.011 0.030 . 2 . . . . 78 ASN HD22 . 11400 1 845 . 1 1 78 78 ASN C C 13 176.406 0.300 . 1 . . . . 78 ASN C . 11400 1 846 . 1 1 78 78 ASN CA C 13 55.988 0.300 . 1 . . . . 78 ASN CA . 11400 1 847 . 1 1 78 78 ASN CB C 13 38.626 0.300 . 1 . . . . 78 ASN CB . 11400 1 848 . 1 1 78 78 ASN N N 15 113.688 0.300 . 1 . . . . 78 ASN N . 11400 1 849 . 1 1 78 78 ASN ND2 N 15 114.330 0.300 . 1 . . . . 78 ASN ND2 . 11400 1 850 . 1 1 79 79 GLY H H 1 8.561 0.030 . 1 . . . . 79 GLY H . 11400 1 851 . 1 1 79 79 GLY HA2 H 1 4.242 0.030 . 2 . . . . 79 GLY HA2 . 11400 1 852 . 1 1 79 79 GLY HA3 H 1 3.722 0.030 . 2 . . . . 79 GLY HA3 . 11400 1 853 . 1 1 79 79 GLY C C 13 173.744 0.300 . 1 . . . . 79 GLY C . 11400 1 854 . 1 1 79 79 GLY CA C 13 45.807 0.300 . 1 . . . . 79 GLY CA . 11400 1 855 . 1 1 79 79 GLY N N 15 116.583 0.300 . 1 . . . . 79 GLY N . 11400 1 856 . 1 1 80 80 MET H H 1 7.812 0.030 . 1 . . . . 80 MET H . 11400 1 857 . 1 1 80 80 MET HA H 1 4.258 0.030 . 1 . . . . 80 MET HA . 11400 1 858 . 1 1 80 80 MET HB2 H 1 2.242 0.030 . 2 . . . . 80 MET HB2 . 11400 1 859 . 1 1 80 80 MET HB3 H 1 1.963 0.030 . 2 . . . . 80 MET HB3 . 11400 1 860 . 1 1 80 80 MET HE1 H 1 1.953 0.030 . 1 . . . . 80 MET HE . 11400 1 861 . 1 1 80 80 MET HE2 H 1 1.953 0.030 . 1 . . . . 80 MET HE . 11400 1 862 . 1 1 80 80 MET HE3 H 1 1.953 0.030 . 1 . . . . 80 MET HE . 11400 1 863 . 1 1 80 80 MET HG2 H 1 2.745 0.030 . 2 . . . . 80 MET HG2 . 11400 1 864 . 1 1 80 80 MET HG3 H 1 2.222 0.030 . 2 . . . . 80 MET HG3 . 11400 1 865 . 1 1 80 80 MET C C 13 173.440 0.300 . 1 . . . . 80 MET C . 11400 1 866 . 1 1 80 80 MET CA C 13 56.232 0.300 . 1 . . . . 80 MET CA . 11400 1 867 . 1 1 80 80 MET CB C 13 33.294 0.300 . 1 . . . . 80 MET CB . 11400 1 868 . 1 1 80 80 MET CE C 13 16.900 0.300 . 1 . . . . 80 MET CE . 11400 1 869 . 1 1 80 80 MET CG C 13 31.375 0.300 . 1 . . . . 80 MET CG . 11400 1 870 . 1 1 80 80 MET N N 15 120.088 0.300 . 1 . . . . 80 MET N . 11400 1 871 . 1 1 81 81 GLU H H 1 8.386 0.030 . 1 . . . . 81 GLU H . 11400 1 872 . 1 1 81 81 GLU HA H 1 4.889 0.030 . 1 . . . . 81 GLU HA . 11400 1 873 . 1 1 81 81 GLU HB2 H 1 1.878 0.030 . 2 . . . . 81 GLU HB2 . 11400 1 874 . 1 1 81 81 GLU HB3 H 1 1.747 0.030 . 2 . . . . 81 GLU HB3 . 11400 1 875 . 1 1 81 81 GLU HG2 H 1 1.992 0.030 . 2 . . . . 81 GLU HG2 . 11400 1 876 . 1 1 81 81 GLU HG3 H 1 1.883 0.030 . 2 . . . . 81 GLU HG3 . 11400 1 877 . 1 1 81 81 GLU C C 13 175.516 0.300 . 1 . . . . 81 GLU C . 11400 1 878 . 1 1 81 81 GLU CA C 13 55.306 0.300 . 1 . . . . 81 GLU CA . 11400 1 879 . 1 1 81 81 GLU CB C 13 30.898 0.300 . 1 . . . . 81 GLU CB . 11400 1 880 . 1 1 81 81 GLU CG C 13 37.048 0.300 . 1 . . . . 81 GLU CG . 11400 1 881 . 1 1 81 81 GLU N N 15 121.872 0.300 . 1 . . . . 81 GLU N . 11400 1 882 . 1 1 82 82 LEU H H 1 9.144 0.030 . 1 . . . . 82 LEU H . 11400 1 883 . 1 1 82 82 LEU HA H 1 4.561 0.030 . 1 . . . . 82 LEU HA . 11400 1 884 . 1 1 82 82 LEU HB2 H 1 1.758 0.030 . 2 . . . . 82 LEU HB2 . 11400 1 885 . 1 1 82 82 LEU HB3 H 1 1.214 0.030 . 2 . . . . 82 LEU HB3 . 11400 1 886 . 1 1 82 82 LEU HD11 H 1 0.814 0.030 . 1 . . . . 82 LEU HD1 . 11400 1 887 . 1 1 82 82 LEU HD12 H 1 0.814 0.030 . 1 . . . . 82 LEU HD1 . 11400 1 888 . 1 1 82 82 LEU HD13 H 1 0.814 0.030 . 1 . . . . 82 LEU HD1 . 11400 1 889 . 1 1 82 82 LEU HD21 H 1 0.894 0.030 . 1 . . . . 82 LEU HD2 . 11400 1 890 . 1 1 82 82 LEU HD22 H 1 0.894 0.030 . 1 . . . . 82 LEU HD2 . 11400 1 891 . 1 1 82 82 LEU HD23 H 1 0.894 0.030 . 1 . . . . 82 LEU HD2 . 11400 1 892 . 1 1 82 82 LEU HG H 1 1.466 0.030 . 1 . . . . 82 LEU HG . 11400 1 893 . 1 1 82 82 LEU C C 13 176.451 0.300 . 1 . . . . 82 LEU C . 11400 1 894 . 1 1 82 82 LEU CA C 13 54.640 0.300 . 1 . . . . 82 LEU CA . 11400 1 895 . 1 1 82 82 LEU CB C 13 44.943 0.300 . 1 . . . . 82 LEU CB . 11400 1 896 . 1 1 82 82 LEU CD1 C 13 26.090 0.300 . 2 . . . . 82 LEU CD1 . 11400 1 897 . 1 1 82 82 LEU CD2 C 13 24.453 0.300 . 2 . . . . 82 LEU CD2 . 11400 1 898 . 1 1 82 82 LEU CG C 13 27.797 0.300 . 1 . . . . 82 LEU CG . 11400 1 899 . 1 1 82 82 LEU N N 15 127.885 0.300 . 1 . . . . 82 LEU N . 11400 1 900 . 1 1 83 83 ASP H H 1 9.632 0.030 . 1 . . . . 83 ASP H . 11400 1 901 . 1 1 83 83 ASP HA H 1 4.295 0.030 . 1 . . . . 83 ASP HA . 11400 1 902 . 1 1 83 83 ASP HB2 H 1 3.001 0.030 . 2 . . . . 83 ASP HB2 . 11400 1 903 . 1 1 83 83 ASP HB3 H 1 2.386 0.030 . 2 . . . . 83 ASP HB3 . 11400 1 904 . 1 1 83 83 ASP C C 13 175.812 0.300 . 1 . . . . 83 ASP C . 11400 1 905 . 1 1 83 83 ASP CA C 13 55.558 0.300 . 1 . . . . 83 ASP CA . 11400 1 906 . 1 1 83 83 ASP CB C 13 40.065 0.300 . 1 . . . . 83 ASP CB . 11400 1 907 . 1 1 83 83 ASP N N 15 129.926 0.300 . 1 . . . . 83 ASP N . 11400 1 908 . 1 1 84 84 GLY H H 1 8.663 0.030 . 1 . . . . 84 GLY H . 11400 1 909 . 1 1 84 84 GLY HA2 H 1 4.095 0.030 . 2 . . . . 84 GLY HA2 . 11400 1 910 . 1 1 84 84 GLY HA3 H 1 3.659 0.030 . 2 . . . . 84 GLY HA3 . 11400 1 911 . 1 1 84 84 GLY C C 13 173.964 0.300 . 1 . . . . 84 GLY C . 11400 1 912 . 1 1 84 84 GLY CA C 13 45.604 0.300 . 1 . . . . 84 GLY CA . 11400 1 913 . 1 1 84 84 GLY N N 15 102.230 0.300 . 1 . . . . 84 GLY N . 11400 1 914 . 1 1 85 85 ARG H H 1 7.558 0.030 . 1 . . . . 85 ARG H . 11400 1 915 . 1 1 85 85 ARG HA H 1 4.667 0.030 . 1 . . . . 85 ARG HA . 11400 1 916 . 1 1 85 85 ARG HB2 H 1 2.000 0.030 . 2 . . . . 85 ARG HB2 . 11400 1 917 . 1 1 85 85 ARG HB3 H 1 1.792 0.030 . 2 . . . . 85 ARG HB3 . 11400 1 918 . 1 1 85 85 ARG HD2 H 1 3.208 0.030 . 1 . . . . 85 ARG HD2 . 11400 1 919 . 1 1 85 85 ARG HD3 H 1 3.208 0.030 . 1 . . . . 85 ARG HD3 . 11400 1 920 . 1 1 85 85 ARG HG2 H 1 1.697 0.030 . 2 . . . . 85 ARG HG2 . 11400 1 921 . 1 1 85 85 ARG HG3 H 1 1.575 0.030 . 2 . . . . 85 ARG HG3 . 11400 1 922 . 1 1 85 85 ARG C C 13 174.481 0.300 . 1 . . . . 85 ARG C . 11400 1 923 . 1 1 85 85 ARG CA C 13 53.238 0.300 . 1 . . . . 85 ARG CA . 11400 1 924 . 1 1 85 85 ARG CB C 13 32.370 0.300 . 1 . . . . 85 ARG CB . 11400 1 925 . 1 1 85 85 ARG CD C 13 42.620 0.300 . 1 . . . . 85 ARG CD . 11400 1 926 . 1 1 85 85 ARG CG C 13 26.340 0.300 . 1 . . . . 85 ARG CG . 11400 1 927 . 1 1 85 85 ARG N N 15 119.444 0.300 . 1 . . . . 85 ARG N . 11400 1 928 . 1 1 86 86 ARG H H 1 8.503 0.030 . 1 . . . . 86 ARG H . 11400 1 929 . 1 1 86 86 ARG HA H 1 4.709 0.030 . 1 . . . . 86 ARG HA . 11400 1 930 . 1 1 86 86 ARG HB2 H 1 1.763 0.030 . 2 . . . . 86 ARG HB2 . 11400 1 931 . 1 1 86 86 ARG HB3 H 1 1.545 0.030 . 2 . . . . 86 ARG HB3 . 11400 1 932 . 1 1 86 86 ARG HD2 H 1 3.131 0.030 . 1 . . . . 86 ARG HD2 . 11400 1 933 . 1 1 86 86 ARG HD3 H 1 3.131 0.030 . 1 . . . . 86 ARG HD3 . 11400 1 934 . 1 1 86 86 ARG HG2 H 1 1.663 0.030 . 2 . . . . 86 ARG HG2 . 11400 1 935 . 1 1 86 86 ARG HG3 H 1 1.451 0.030 . 2 . . . . 86 ARG HG3 . 11400 1 936 . 1 1 86 86 ARG C C 13 176.833 0.300 . 1 . . . . 86 ARG C . 11400 1 937 . 1 1 86 86 ARG CA C 13 55.072 0.300 . 1 . . . . 86 ARG CA . 11400 1 938 . 1 1 86 86 ARG CB C 13 29.502 0.300 . 1 . . . . 86 ARG CB . 11400 1 939 . 1 1 86 86 ARG CD C 13 43.246 0.300 . 1 . . . . 86 ARG CD . 11400 1 940 . 1 1 86 86 ARG CG C 13 27.316 0.300 . 1 . . . . 86 ARG CG . 11400 1 941 . 1 1 86 86 ARG N N 15 121.298 0.300 . 1 . . . . 86 ARG N . 11400 1 942 . 1 1 87 87 ILE H H 1 8.501 0.030 . 1 . . . . 87 ILE H . 11400 1 943 . 1 1 87 87 ILE HA H 1 4.615 0.030 . 1 . . . . 87 ILE HA . 11400 1 944 . 1 1 87 87 ILE HB H 1 1.967 0.030 . 1 . . . . 87 ILE HB . 11400 1 945 . 1 1 87 87 ILE HD11 H 1 0.785 0.030 . 1 . . . . 87 ILE HD1 . 11400 1 946 . 1 1 87 87 ILE HD12 H 1 0.785 0.030 . 1 . . . . 87 ILE HD1 . 11400 1 947 . 1 1 87 87 ILE HD13 H 1 0.785 0.030 . 1 . . . . 87 ILE HD1 . 11400 1 948 . 1 1 87 87 ILE HG12 H 1 1.521 0.030 . 2 . . . . 87 ILE HG12 . 11400 1 949 . 1 1 87 87 ILE HG13 H 1 1.409 0.030 . 2 . . . . 87 ILE HG13 . 11400 1 950 . 1 1 87 87 ILE HG21 H 1 0.878 0.030 . 1 . . . . 87 ILE HG2 . 11400 1 951 . 1 1 87 87 ILE HG22 H 1 0.878 0.030 . 1 . . . . 87 ILE HG2 . 11400 1 952 . 1 1 87 87 ILE HG23 H 1 0.878 0.030 . 1 . . . . 87 ILE HG2 . 11400 1 953 . 1 1 87 87 ILE C C 13 175.155 0.300 . 1 . . . . 87 ILE C . 11400 1 954 . 1 1 87 87 ILE CA C 13 60.966 0.300 . 1 . . . . 87 ILE CA . 11400 1 955 . 1 1 87 87 ILE CB C 13 39.433 0.300 . 1 . . . . 87 ILE CB . 11400 1 956 . 1 1 87 87 ILE CD1 C 13 13.644 0.300 . 1 . . . . 87 ILE CD1 . 11400 1 957 . 1 1 87 87 ILE CG1 C 13 25.610 0.300 . 1 . . . . 87 ILE CG1 . 11400 1 958 . 1 1 87 87 ILE CG2 C 13 18.862 0.300 . 1 . . . . 87 ILE CG2 . 11400 1 959 . 1 1 87 87 ILE N N 15 122.213 0.300 . 1 . . . . 87 ILE N . 11400 1 960 . 1 1 88 88 ARG H H 1 8.550 0.030 . 1 . . . . 88 ARG H . 11400 1 961 . 1 1 88 88 ARG HA H 1 5.099 0.030 . 1 . . . . 88 ARG HA . 11400 1 962 . 1 1 88 88 ARG HB2 H 1 1.848 0.030 . 2 . . . . 88 ARG HB2 . 11400 1 963 . 1 1 88 88 ARG HB3 H 1 1.720 0.030 . 2 . . . . 88 ARG HB3 . 11400 1 964 . 1 1 88 88 ARG HD2 H 1 3.206 0.030 . 1 . . . . 88 ARG HD2 . 11400 1 965 . 1 1 88 88 ARG HD3 H 1 3.206 0.030 . 1 . . . . 88 ARG HD3 . 11400 1 966 . 1 1 88 88 ARG HG2 H 1 1.703 0.030 . 2 . . . . 88 ARG HG2 . 11400 1 967 . 1 1 88 88 ARG HG3 H 1 1.494 0.030 . 2 . . . . 88 ARG HG3 . 11400 1 968 . 1 1 88 88 ARG C C 13 174.885 0.300 . 1 . . . . 88 ARG C . 11400 1 969 . 1 1 88 88 ARG CA C 13 54.191 0.300 . 1 . . . . 88 ARG CA . 11400 1 970 . 1 1 88 88 ARG CB C 13 32.890 0.300 . 1 . . . . 88 ARG CB . 11400 1 971 . 1 1 88 88 ARG CD C 13 43.295 0.300 . 1 . . . . 88 ARG CD . 11400 1 972 . 1 1 88 88 ARG CG C 13 27.589 0.300 . 1 . . . . 88 ARG CG . 11400 1 973 . 1 1 88 88 ARG N N 15 123.177 0.300 . 1 . . . . 88 ARG N . 11400 1 974 . 1 1 89 89 VAL H H 1 8.609 0.030 . 1 . . . . 89 VAL H . 11400 1 975 . 1 1 89 89 VAL HA H 1 5.446 0.030 . 1 . . . . 89 VAL HA . 11400 1 976 . 1 1 89 89 VAL HB H 1 1.947 0.030 . 1 . . . . 89 VAL HB . 11400 1 977 . 1 1 89 89 VAL HG11 H 1 1.037 0.030 . 1 . . . . 89 VAL HG1 . 11400 1 978 . 1 1 89 89 VAL HG12 H 1 1.037 0.030 . 1 . . . . 89 VAL HG1 . 11400 1 979 . 1 1 89 89 VAL HG13 H 1 1.037 0.030 . 1 . . . . 89 VAL HG1 . 11400 1 980 . 1 1 89 89 VAL HG21 H 1 1.048 0.030 . 1 . . . . 89 VAL HG2 . 11400 1 981 . 1 1 89 89 VAL HG22 H 1 1.048 0.030 . 1 . . . . 89 VAL HG2 . 11400 1 982 . 1 1 89 89 VAL HG23 H 1 1.048 0.030 . 1 . . . . 89 VAL HG2 . 11400 1 983 . 1 1 89 89 VAL C C 13 175.136 0.300 . 1 . . . . 89 VAL C . 11400 1 984 . 1 1 89 89 VAL CA C 13 60.186 0.300 . 1 . . . . 89 VAL CA . 11400 1 985 . 1 1 89 89 VAL CB C 13 34.313 0.300 . 1 . . . . 89 VAL CB . 11400 1 986 . 1 1 89 89 VAL CG1 C 13 24.058 0.300 . 2 . . . . 89 VAL CG1 . 11400 1 987 . 1 1 89 89 VAL CG2 C 13 21.866 0.300 . 2 . . . . 89 VAL CG2 . 11400 1 988 . 1 1 89 89 VAL N N 15 123.118 0.300 . 1 . . . . 89 VAL N . 11400 1 989 . 1 1 90 90 SER H H 1 9.422 0.030 . 1 . . . . 90 SER H . 11400 1 990 . 1 1 90 90 SER HB2 H 1 3.899 0.030 . 2 . . . . 90 SER HB2 . 11400 1 991 . 1 1 90 90 SER HB3 H 1 3.851 0.030 . 2 . . . . 90 SER HB3 . 11400 1 992 . 1 1 90 90 SER C C 13 173.842 0.300 . 1 . . . . 90 SER C . 11400 1 993 . 1 1 90 90 SER CA C 13 56.770 0.300 . 1 . . . . 90 SER CA . 11400 1 994 . 1 1 90 90 SER CB C 13 66.010 0.300 . 1 . . . . 90 SER CB . 11400 1 995 . 1 1 90 90 SER N N 15 120.873 0.300 . 1 . . . . 90 SER N . 11400 1 996 . 1 1 91 91 GLY HA2 H 1 4.652 0.030 . 2 . . . . 91 GLY HA2 . 11400 1 997 . 1 1 91 91 GLY HA3 H 1 3.984 0.030 . 2 . . . . 91 GLY HA3 . 11400 1 998 . 1 1 91 91 GLY CA C 13 44.637 0.300 . 1 . . . . 91 GLY CA . 11400 1 999 . 1 1 92 92 PRO HA H 1 4.480 0.030 . 1 . . . . 92 PRO HA . 11400 1 1000 . 1 1 92 92 PRO HB2 H 1 2.250 0.030 . 2 . . . . 92 PRO HB2 . 11400 1 1001 . 1 1 92 92 PRO HB3 H 1 1.952 0.030 . 2 . . . . 92 PRO HB3 . 11400 1 1002 . 1 1 92 92 PRO HD2 H 1 3.752 0.030 . 2 . . . . 92 PRO HD2 . 11400 1 1003 . 1 1 92 92 PRO HD3 H 1 3.664 0.030 . 2 . . . . 92 PRO HD3 . 11400 1 1004 . 1 1 92 92 PRO HG2 H 1 1.959 0.030 . 1 . . . . 92 PRO HG2 . 11400 1 1005 . 1 1 92 92 PRO HG3 H 1 1.959 0.030 . 1 . . . . 92 PRO HG3 . 11400 1 1006 . 1 1 92 92 PRO CA C 13 63.605 0.300 . 1 . . . . 92 PRO CA . 11400 1 1007 . 1 1 92 92 PRO CB C 13 32.243 0.300 . 1 . . . . 92 PRO CB . 11400 1 1008 . 1 1 92 92 PRO CD C 13 49.817 0.300 . 1 . . . . 92 PRO CD . 11400 1 1009 . 1 1 92 92 PRO CG C 13 27.386 0.300 . 1 . . . . 92 PRO CG . 11400 1 1010 . 1 1 93 93 SER H H 1 8.420 0.030 . 1 . . . . 93 SER H . 11400 1 1011 . 1 1 93 93 SER CA C 13 58.075 0.300 . 1 . . . . 93 SER CA . 11400 1 1012 . 1 1 93 93 SER CB C 13 64.151 0.300 . 1 . . . . 93 SER CB . 11400 1 1013 . 1 1 93 93 SER N N 15 115.646 0.300 . 1 . . . . 93 SER N . 11400 1 stop_ save_