data_25170 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 25170 _Entry.Title ; Assignment for last 50 residues from three different organisms ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2014-08-22 _Entry.Accession_date 2014-08-22 _Entry.Last_release_date 2014-08-22 _Entry.Original_release_date 2014-08-22 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.14.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _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.ORCID _Entry_author.Entry_ID 1 Pushpa Mishra . . . . 25170 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . 'Tata Institute of Fundamental Research' . 25170 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 3 25170 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 342 25170 '15N chemical shifts' 124 25170 '1H chemical shifts' 448 25170 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 . . 2022-05-12 . original BMRB . 25170 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 25170 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 25412900 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; The C-terminal domain of eukaryotic acidic ribosomal P2 proteins is intrinsically disordered with conserved structural propensities ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Protein Pept. Lett.' _Citation.Journal_name_full 'Protein and peptide letters' _Citation.Journal_volume 22 _Citation.Journal_issue 3 _Citation.Journal_ASTM . _Citation.Journal_ISSN 1875-5305 _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 212 _Citation.Page_last 218 _Citation.Year 2014 _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.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Pushpa Mishra P. . . . 25170 1 2 Sudarsan Rajagopal S. . . . 25170 1 3 Shobhona Sharma S. . . . 25170 1 4 Ramakrishna Hosur R. V. . . 25170 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 25170 _Assembly.ID 1 _Assembly.Name 'C terminals' _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 HUP2-CTER 1 $HUP2-CTER A . yes native no no . . . 25170 1 2 TgP2-CTER 2 $TgP2-CTER B . yes native no no . . . 25170 1 3 PfP2-CTER 3 $PfP2-CTER C . yes native no no . . . 25170 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_HUP2-CTER _Entity.Sf_category entity _Entity.Sf_framecode HUP2-CTER _Entity.Entry_ID 25170 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name HUP2-CTER _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; XAXGAVAVSAAXGSAAXAAG SAXAAAEEKKXEKKEESEES DDDXGFGLFD ; _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 50 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . X . 25170 1 2 . ALA . 25170 1 3 . X . 25170 1 4 . GLY . 25170 1 5 . ALA . 25170 1 6 . VAL . 25170 1 7 . ALA . 25170 1 8 . VAL . 25170 1 9 . SER . 25170 1 10 . ALA . 25170 1 11 . ALA . 25170 1 12 . X . 25170 1 13 . GLY . 25170 1 14 . SER . 25170 1 15 . ALA . 25170 1 16 . ALA . 25170 1 17 . X . 25170 1 18 . ALA . 25170 1 19 . ALA . 25170 1 20 . GLY . 25170 1 21 . SER . 25170 1 22 . ALA . 25170 1 23 . X . 25170 1 24 . ALA . 25170 1 25 . ALA . 25170 1 26 . ALA . 25170 1 27 . GLU . 25170 1 28 . GLU . 25170 1 29 . LYS . 25170 1 30 . LYS . 25170 1 31 . X . 25170 1 32 . GLU . 25170 1 33 . LYS . 25170 1 34 . LYS . 25170 1 35 . GLU . 25170 1 36 . GLU . 25170 1 37 . SER . 25170 1 38 . GLU . 25170 1 39 . GLU . 25170 1 40 . SER . 25170 1 41 . ASP . 25170 1 42 . ASP . 25170 1 43 . ASP . 25170 1 44 . X . 25170 1 45 . GLY . 25170 1 46 . PHE . 25170 1 47 . GLY . 25170 1 48 . LEU . 25170 1 49 . PHE . 25170 1 50 . ASP . 25170 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 . X 1 1 25170 1 . ALA 2 2 25170 1 . X 3 3 25170 1 . GLY 4 4 25170 1 . ALA 5 5 25170 1 . VAL 6 6 25170 1 . ALA 7 7 25170 1 . VAL 8 8 25170 1 . SER 9 9 25170 1 . ALA 10 10 25170 1 . ALA 11 11 25170 1 . X 12 12 25170 1 . GLY 13 13 25170 1 . SER 14 14 25170 1 . ALA 15 15 25170 1 . ALA 16 16 25170 1 . X 17 17 25170 1 . ALA 18 18 25170 1 . ALA 19 19 25170 1 . GLY 20 20 25170 1 . SER 21 21 25170 1 . ALA 22 22 25170 1 . X 23 23 25170 1 . ALA 24 24 25170 1 . ALA 25 25 25170 1 . ALA 26 26 25170 1 . GLU 27 27 25170 1 . GLU 28 28 25170 1 . LYS 29 29 25170 1 . LYS 30 30 25170 1 . X 31 31 25170 1 . GLU 32 32 25170 1 . LYS 33 33 25170 1 . LYS 34 34 25170 1 . GLU 35 35 25170 1 . GLU 36 36 25170 1 . SER 37 37 25170 1 . GLU 38 38 25170 1 . GLU 39 39 25170 1 . SER 40 40 25170 1 . ASP 41 41 25170 1 . ASP 42 42 25170 1 . ASP 43 43 25170 1 . X 44 44 25170 1 . GLY 45 45 25170 1 . PHE 46 46 25170 1 . GLY 47 47 25170 1 . LEU 48 48 25170 1 . PHE 49 49 25170 1 . ASP 50 50 25170 1 stop_ save_ save_TgP2-CTER _Entity.Sf_category entity _Entity.Sf_framecode TgP2-CTER _Entity.Entry_ID 25170 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name TgP2-CTER _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; LQXXXSGGVAAAAAXXXXAA DAGAGAAAKKEXXXKEEEEE EDDMXFSXFD ; _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 50 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . LEU . 25170 2 2 . GLN . 25170 2 3 . X . 25170 2 4 . X . 25170 2 5 . X . 25170 2 6 . SER . 25170 2 7 . GLY . 25170 2 8 . GLY . 25170 2 9 . VAL . 25170 2 10 . ALA . 25170 2 11 . ALA . 25170 2 12 . ALA . 25170 2 13 . ALA . 25170 2 14 . ALA . 25170 2 15 . X . 25170 2 16 . X . 25170 2 17 . X . 25170 2 18 . X . 25170 2 19 . ALA . 25170 2 20 . ALA . 25170 2 21 . ASP . 25170 2 22 . ALA . 25170 2 23 . GLY . 25170 2 24 . ALA . 25170 2 25 . GLY . 25170 2 26 . ALA . 25170 2 27 . ALA . 25170 2 28 . ALA . 25170 2 29 . LYS . 25170 2 30 . LYS . 25170 2 31 . GLU . 25170 2 32 . X . 25170 2 33 . X . 25170 2 34 . X . 25170 2 35 . LYS . 25170 2 36 . GLU . 25170 2 37 . GLU . 25170 2 38 . GLU . 25170 2 39 . GLU . 25170 2 40 . GLU . 25170 2 41 . GLU . 25170 2 42 . ASP . 25170 2 43 . ASP . 25170 2 44 . MET . 25170 2 45 . X . 25170 2 46 . PHE . 25170 2 47 . SER . 25170 2 48 . X . 25170 2 49 . PHE . 25170 2 50 . ASP . 25170 2 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . LEU 1 1 25170 2 . GLN 2 2 25170 2 . X 3 3 25170 2 . X 4 4 25170 2 . X 5 5 25170 2 . SER 6 6 25170 2 . GLY 7 7 25170 2 . GLY 8 8 25170 2 . VAL 9 9 25170 2 . ALA 10 10 25170 2 . ALA 11 11 25170 2 . ALA 12 12 25170 2 . ALA 13 13 25170 2 . ALA 14 14 25170 2 . X 15 15 25170 2 . X 16 16 25170 2 . X 17 17 25170 2 . X 18 18 25170 2 . ALA 19 19 25170 2 . ALA 20 20 25170 2 . ASP 21 21 25170 2 . ALA 22 22 25170 2 . GLY 23 23 25170 2 . ALA 24 24 25170 2 . GLY 25 25 25170 2 . ALA 26 26 25170 2 . ALA 27 27 25170 2 . ALA 28 28 25170 2 . LYS 29 29 25170 2 . LYS 30 30 25170 2 . GLU 31 31 25170 2 . X 32 32 25170 2 . X 33 33 25170 2 . X 34 34 25170 2 . LYS 35 35 25170 2 . GLU 36 36 25170 2 . GLU 37 37 25170 2 . GLU 38 38 25170 2 . GLU 39 39 25170 2 . GLU 40 40 25170 2 . GLU 41 41 25170 2 . ASP 42 42 25170 2 . ASP 43 43 25170 2 . MET 44 44 25170 2 . X 45 45 25170 2 . PHE 46 46 25170 2 . SER 47 47 25170 2 . X 48 48 25170 2 . PHE 49 49 25170 2 . ASP 50 50 25170 2 stop_ save_ save_PfP2-CTER _Entity.Sf_category entity _Entity.Sf_framecode PfP2-CTER _Entity.Entry_ID 25170 _Entity.ID 3 _Entity.BMRB_code . _Entity.Name PfP2-CTER _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; KLXXIGGGVAAAXAGAAXVE TAEAKKEXXKEEKKEEEEEX EDDLGFSLFG ; _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 50 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . LYS . 25170 3 2 . LEU . 25170 3 3 . X . 25170 3 4 . X . 25170 3 5 . ILE . 25170 3 6 . GLY . 25170 3 7 . GLY . 25170 3 8 . GLY . 25170 3 9 . VAL . 25170 3 10 . ALA . 25170 3 11 . ALA . 25170 3 12 . ALA . 25170 3 13 . X . 25170 3 14 . ALA . 25170 3 15 . GLY . 25170 3 16 . ALA . 25170 3 17 . ALA . 25170 3 18 . X . 25170 3 19 . VAL . 25170 3 20 . GLU . 25170 3 21 . THR . 25170 3 22 . ALA . 25170 3 23 . GLU . 25170 3 24 . ALA . 25170 3 25 . LYS . 25170 3 26 . LYS . 25170 3 27 . GLU . 25170 3 28 . X . 25170 3 29 . X . 25170 3 30 . LYS . 25170 3 31 . GLU . 25170 3 32 . GLU . 25170 3 33 . LYS . 25170 3 34 . LYS . 25170 3 35 . GLU . 25170 3 36 . GLU . 25170 3 37 . GLU . 25170 3 38 . GLU . 25170 3 39 . GLU . 25170 3 40 . X . 25170 3 41 . GLU . 25170 3 42 . ASP . 25170 3 43 . ASP . 25170 3 44 . LEU . 25170 3 45 . GLY . 25170 3 46 . PHE . 25170 3 47 . SER . 25170 3 48 . LEU . 25170 3 49 . PHE . 25170 3 50 . GLY . 25170 3 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 . LYS 1 1 25170 3 . LEU 2 2 25170 3 . X 3 3 25170 3 . X 4 4 25170 3 . ILE 5 5 25170 3 . GLY 6 6 25170 3 . GLY 7 7 25170 3 . GLY 8 8 25170 3 . VAL 9 9 25170 3 . ALA 10 10 25170 3 . ALA 11 11 25170 3 . ALA 12 12 25170 3 . X 13 13 25170 3 . ALA 14 14 25170 3 . GLY 15 15 25170 3 . ALA 16 16 25170 3 . ALA 17 17 25170 3 . X 18 18 25170 3 . VAL 19 19 25170 3 . GLU 20 20 25170 3 . THR 21 21 25170 3 . ALA 22 22 25170 3 . GLU 23 23 25170 3 . ALA 24 24 25170 3 . LYS 25 25 25170 3 . LYS 26 26 25170 3 . GLU 27 27 25170 3 . X 28 28 25170 3 . X 29 29 25170 3 . LYS 30 30 25170 3 . GLU 31 31 25170 3 . GLU 32 32 25170 3 . LYS 33 33 25170 3 . LYS 34 34 25170 3 . GLU 35 35 25170 3 . GLU 36 36 25170 3 . GLU 37 37 25170 3 . GLU 38 38 25170 3 . GLU 39 39 25170 3 . X 40 40 25170 3 . GLU 41 41 25170 3 . ASP 42 42 25170 3 . ASP 43 43 25170 3 . LEU 44 44 25170 3 . GLY 45 45 25170 3 . PHE 46 46 25170 3 . SER 47 47 25170 3 . LEU 48 48 25170 3 . PHE 49 49 25170 3 . GLY 50 50 25170 3 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 25170 _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.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.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $HUP2-CTER . . organism . . . . . Eukaryota . . . . . . . . . . . . . . . . 25170 1 2 2 $TgP2-CTER . . organism . . . . . Eukaryota . . . . . . . . . . . . . . . . 25170 1 3 3 $PfP2-CTER . 5833 organism . 'Plasmodium falciparum' 'malaria parasite' . . Eukaryota . Plasmodium falciparum . . . . . . . . . . . . . 25170 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 25170 _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_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.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $HUP2-CTER . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . PGEX4T3 . . . 25170 1 2 2 $TgP2-CTER . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . PGEX4T3 . . . 25170 1 3 3 $PfP2-CTER . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . PGEX4T3 . . . 25170 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 25170 _Sample.ID 1 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 HUP2-CTER '[U-98% 13C; U-98% 15N]' . . 1 $HUP2-CTER . . 1 . . mM . . . . 25170 1 2 H2O 'natural abundance' . . . . . . 90 . . % . . . . 25170 1 3 D2O 'natural abundance' . . . . . . 10 . . % . . . . 25170 1 4 TRIS 'natural abundance' . . . . . . 20 . . mM . . . . 25170 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 25170 _Sample.ID 2 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 TgP2-CTER '[U-98% 13C; U-98% 15N]' . . 2 $TgP2-CTER . . 1 . . mM . . . . 25170 2 2 H2O 'natural abundance' . . . . . . 90 . . % . . . . 25170 2 3 D2O 'natural abundance' . . . . . . 10 . . % . . . . 25170 2 4 TRIS 'natural abundance' . . . . . . 20 . . mM . . . . 25170 2 stop_ save_ save_sample_3 _Sample.Sf_category sample _Sample.Sf_framecode sample_3 _Sample.Entry_ID 25170 _Sample.ID 3 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details 'Plasmodium falciparum P2 60S acidic ribosomal P2 protein last 50 residues' _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 PfP2-CTER '[U-98% 13C; U-98% 15N]' . . 3 $PfP2-CTER . . 1 . . mM . . . . 25170 3 2 H2O 'natural abundance' . . . . . . 90 . . % . . . . 25170 3 3 D2O 'natural abundance' . . . . . . 10 . . % . . . . 25170 3 4 TRIS 'natural abundance' . . . . . . 20 . . mM . . . . 25170 3 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 25170 _Sample_condition_list.ID 1 _Sample_condition_list.Name . _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' 20 . mM 25170 1 pH 7.4 . pH 25170 1 pressure 1 . atm 25170 1 temperature 298 . K 25170 1 stop_ save_ save_sample_conditions_2 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_2 _Sample_condition_list.Entry_ID 25170 _Sample_condition_list.ID 2 _Sample_condition_list.Name . _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 pH 7.4 . pH 25170 2 temperature 298 . K 25170 2 stop_ save_ save_sample_conditions_3 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_3 _Sample_condition_list.Entry_ID 25170 _Sample_condition_list.ID 3 _Sample_condition_list.Name . _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 pH 7.4 . pH 25170 3 stop_ save_ ############################ # Computer software used # ############################ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 25170 _Software.ID 1 _Software.Type . _Software.Name NMRPipe _Software.Version . _Software.DOI . _Software.Details 'Processing software' loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 25170 1 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID processing . 25170 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 25170 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name . _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 25170 _NMR_spectrometer_list.ID 1 _NMR_spectrometer_list.Name . 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 . . . 25170 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 25170 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NUS_flag _Experiment.Interleaved_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.Details _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . . 25170 1 2 '3D CBCA(CO)NH' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . . 25170 1 3 '3D HNCACB' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . . 25170 1 4 '3D HNCO' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . . 25170 1 5 '3D HNCA' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . . 25170 1 6 '3D 1H-15N TOCSY' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . . 25170 1 7 HNN no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . . 25170 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_referenceing _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_referenceing _Chem_shift_reference.Entry_ID 25170 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name . _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS carbon . . . . ppm 0.2 internal indirect 0.25 . . . . . 25170 1 H 1 DSS protons . . . . ppm 0 internal direct 1 . . . . . 25170 1 N 15 DSS nitrogen . . . . ppm 0.3 internal indirect 0.1 . . . . . 25170 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 25170 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_referenceing _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 25170 1 2 '3D CBCA(CO)NH' . . . 25170 1 3 '3D HNCACB' . . . 25170 1 4 '3D HNCO' . . . 25170 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_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.Ambiguity_set_ID _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 2 2 ALA H H 1 8.492 0.020 . 1 . . . . . 2 ALA H . 25170 1 2 . 1 . 1 2 2 ALA HA H 1 4.725 0.020 . 1 . . . . . 2 ALA HA . 25170 1 3 . 1 . 1 2 2 ALA C C 13 174.772 0.3 . 1 . . . . . 2 ALA C . 25170 1 4 . 1 . 1 2 2 ALA CA C 13 49.679 0.3 . 1 . . . . . 2 ALA CA . 25170 1 5 . 1 . 1 2 2 ALA CB C 13 16.170 0.3 . 1 . . . . . 2 ALA CB . 25170 1 6 . 1 . 1 2 2 ALA N N 15 125.510 0.3 . 1 . . . . . 2 ALA N . 25170 1 7 . 1 . 1 4 4 GLY H H 1 8.143 0.020 . 1 . . . . . 4 GLY H . 25170 1 8 . 1 . 1 4 4 GLY HA2 H 1 3.902 0.020 . 1 . . . . . 4 GLY HA2 . 25170 1 9 . 1 . 1 4 4 GLY HA3 H 1 3.902 0.020 . 1 . . . . . 4 GLY HA3 . 25170 1 10 . 1 . 1 4 4 GLY C C 13 171.038 0.3 . 1 . . . . . 4 GLY C . 25170 1 11 . 1 . 1 4 4 GLY CA C 13 42.180 0.3 . 1 . . . . . 4 GLY CA . 25170 1 12 . 1 . 1 4 4 GLY N N 15 108.592 0.3 . 1 . . . . . 4 GLY N . 25170 1 13 . 1 . 1 5 5 ALA H H 1 8.117 0.020 . 1 . . . . . 5 ALA H . 25170 1 14 . 1 . 1 5 5 ALA HA H 1 4.281 0.020 . 1 . . . . . 5 ALA HA . 25170 1 15 . 1 . 1 5 5 ALA HB1 H 1 1.337 0.020 . 1 . . . . . 5 ALA HB . 25170 1 16 . 1 . 1 5 5 ALA HB2 H 1 1.337 0.020 . 1 . . . . . 5 ALA HB . 25170 1 17 . 1 . 1 5 5 ALA HB3 H 1 1.337 0.020 . 1 . . . . . 5 ALA HB . 25170 1 18 . 1 . 1 5 5 ALA C C 13 174.910 0.3 . 1 . . . . . 5 ALA C . 25170 1 19 . 1 . 1 5 5 ALA CA C 13 49.434 0.3 . 1 . . . . . 5 ALA CA . 25170 1 20 . 1 . 1 5 5 ALA CB C 13 16.265 0.3 . 1 . . . . . 5 ALA CB . 25170 1 21 . 1 . 1 5 5 ALA N N 15 123.691 0.3 . 1 . . . . . 5 ALA N . 25170 1 22 . 1 . 1 6 6 VAL H H 1 8.018 0.020 . 1 . . . . . 6 VAL H . 25170 1 23 . 1 . 1 6 6 VAL HA H 1 4.083 0.020 . 1 . . . . . 6 VAL HA . 25170 1 24 . 1 . 1 6 6 VAL HB H 1 2.044 0.020 . 1 . . . . . 6 VAL HB . 25170 1 25 . 1 . 1 6 6 VAL HG11 H 1 0.909 0.020 . 1 . . . . . 6 VAL HG1 . 25170 1 26 . 1 . 1 6 6 VAL HG12 H 1 0.909 0.020 . 1 . . . . . 6 VAL HG1 . 25170 1 27 . 1 . 1 6 6 VAL HG13 H 1 0.909 0.020 . 1 . . . . . 6 VAL HG1 . 25170 1 28 . 1 . 1 6 6 VAL HG21 H 1 0.909 0.020 . 1 . . . . . 6 VAL HG2 . 25170 1 29 . 1 . 1 6 6 VAL HG22 H 1 0.909 0.020 . 1 . . . . . 6 VAL HG2 . 25170 1 30 . 1 . 1 6 6 VAL HG23 H 1 0.909 0.020 . 1 . . . . . 6 VAL HG2 . 25170 1 31 . 1 . 1 6 6 VAL C C 13 173.051 0.3 . 1 . . . . . 6 VAL C . 25170 1 32 . 1 . 1 6 6 VAL CA C 13 59.077 0.3 . 1 . . . . . 6 VAL CA . 25170 1 33 . 1 . 1 6 6 VAL CB C 13 29.745 0.3 . 1 . . . . . 6 VAL CB . 25170 1 34 . 1 . 1 6 6 VAL N N 15 119.404 0.3 . 1 . . . . . 6 VAL N . 25170 1 35 . 1 . 1 7 7 ALA H H 1 8.303 0.020 . 1 . . . . . 7 ALA H . 25170 1 36 . 1 . 1 7 7 ALA HA H 1 4.379 0.020 . 1 . . . . . 7 ALA HA . 25170 1 37 . 1 . 1 7 7 ALA HB1 H 1 1.369 0.020 . 1 . . . . . 7 ALA HB . 25170 1 38 . 1 . 1 7 7 ALA HB2 H 1 1.369 0.020 . 1 . . . . . 7 ALA HB . 25170 1 39 . 1 . 1 7 7 ALA HB3 H 1 1.369 0.020 . 1 . . . . . 7 ALA HB . 25170 1 40 . 1 . 1 7 7 ALA C C 13 174.772 0.3 . 1 . . . . . 7 ALA C . 25170 1 41 . 1 . 1 7 7 ALA CA C 13 49.299 0.3 . 1 . . . . . 7 ALA CA . 25170 1 42 . 1 . 1 7 7 ALA CB C 13 16.075 0.3 . 1 . . . . . 7 ALA CB . 25170 1 43 . 1 . 1 7 7 ALA N N 15 128.081 0.3 . 1 . . . . . 7 ALA N . 25170 1 44 . 1 . 1 8 8 VAL H H 1 8.098 0.020 . 1 . . . . . 8 VAL H . 25170 1 45 . 1 . 1 8 8 VAL HA H 1 4.133 0.020 . 1 . . . . . 8 VAL HA . 25170 1 46 . 1 . 1 8 8 VAL HG11 H 1 0.925 0.020 . 1 . . . . . 8 VAL HG1 . 25170 1 47 . 1 . 1 8 8 VAL HG12 H 1 0.925 0.020 . 1 . . . . . 8 VAL HG1 . 25170 1 48 . 1 . 1 8 8 VAL HG13 H 1 0.925 0.020 . 1 . . . . . 8 VAL HG1 . 25170 1 49 . 1 . 1 8 8 VAL HG21 H 1 0.925 0.020 . 1 . . . . . 8 VAL HG2 . 25170 1 50 . 1 . 1 8 8 VAL HG22 H 1 0.925 0.020 . 1 . . . . . 8 VAL HG2 . 25170 1 51 . 1 . 1 8 8 VAL HG23 H 1 0.925 0.020 . 1 . . . . . 8 VAL HG2 . 25170 1 52 . 1 . 1 8 8 VAL C C 13 173.456 0.3 . 1 . . . . . 8 VAL C . 25170 1 53 . 1 . 1 8 8 VAL CA C 13 59.267 0.3 . 1 . . . . . 8 VAL CA . 25170 1 54 . 1 . 1 8 8 VAL CB C 13 29.681 0.3 . 1 . . . . . 8 VAL CB . 25170 1 55 . 1 . 1 8 8 VAL N N 15 119.825 0.3 . 1 . . . . . 8 VAL N . 25170 1 56 . 1 . 1 9 9 SER H H 1 8.284 0.020 . 1 . . . . . 9 SER H . 25170 1 57 . 1 . 1 9 9 SER HA H 1 4.692 0.020 . 1 . . . . . 9 SER HA . 25170 1 58 . 1 . 1 9 9 SER C C 13 171.153 0.3 . 1 . . . . . 9 SER C . 25170 1 59 . 1 . 1 9 9 SER CA C 13 55.185 0.3 . 1 . . . . . 9 SER CA . 25170 1 60 . 1 . 1 9 9 SER CB C 13 61.260 0.3 . 1 . . . . . 9 SER CB . 25170 1 61 . 1 . 1 9 9 SER N N 15 119.416 0.3 . 1 . . . . . 9 SER N . 25170 1 62 . 1 . 1 10 10 ALA H H 1 8.245 0.020 . 1 . . . . . 10 ALA H . 25170 1 63 . 1 . 1 10 10 ALA HA H 1 4.675 0.020 . 1 . . . . . 10 ALA HA . 25170 1 64 . 1 . 1 10 10 ALA HB1 H 1 1.353 0.020 . 1 . . . . . 10 ALA HB . 25170 1 65 . 1 . 1 10 10 ALA HB2 H 1 1.353 0.020 . 1 . . . . . 10 ALA HB . 25170 1 66 . 1 . 1 10 10 ALA HB3 H 1 1.353 0.020 . 1 . . . . . 10 ALA HB . 25170 1 67 . 1 . 1 10 10 ALA C C 13 174.216 0.3 . 1 . . . . . 10 ALA C . 25170 1 68 . 1 . 1 10 10 ALA CA C 13 49.110 0.3 . 1 . . . . . 10 ALA CA . 25170 1 69 . 1 . 1 10 10 ALA CB C 13 16.265 0.3 . 1 . . . . . 10 ALA CB . 25170 1 70 . 1 . 1 10 10 ALA N N 15 126.236 0.3 . 1 . . . . . 10 ALA N . 25170 1 71 . 1 . 1 11 11 ALA H H 1 8.177 0.020 . 1 . . . . . 11 ALA H . 25170 1 72 . 1 . 1 11 11 ALA HA H 1 4.626 0.020 . 1 . . . . . 11 ALA HA . 25170 1 73 . 1 . 1 11 11 ALA HB1 H 1 1.337 0.020 . 1 . . . . . 11 ALA HB . 25170 1 74 . 1 . 1 11 11 ALA HB2 H 1 1.337 0.020 . 1 . . . . . 11 ALA HB . 25170 1 75 . 1 . 1 11 11 ALA HB3 H 1 1.337 0.020 . 1 . . . . . 11 ALA HB . 25170 1 76 . 1 . 1 11 11 ALA C C 13 172.646 0.3 . 1 . . . . . 11 ALA C . 25170 1 77 . 1 . 1 11 11 ALA CA C 13 47.591 0.3 . 1 . . . . . 11 ALA CA . 25170 1 78 . 1 . 1 11 11 ALA CB C 13 15.221 0.3 . 1 . . . . . 11 ALA CB . 25170 1 79 . 1 . 1 11 11 ALA N N 15 124.878 0.3 . 1 . . . . . 11 ALA N . 25170 1 80 . 1 . 1 13 13 GLY H H 1 8.476 0.020 . 1 . . . . . 13 GLY H . 25170 1 81 . 1 . 1 13 13 GLY C C 13 171.507 0.3 . 1 . . . . . 13 GLY C . 25170 1 82 . 1 . 1 13 13 GLY CA C 13 42.491 0.3 . 1 . . . . . 13 GLY CA . 25170 1 83 . 1 . 1 13 13 GLY N N 15 109.636 0.3 . 1 . . . . . 13 GLY N . 25170 1 84 . 1 . 1 14 14 SER H H 1 8.062 0.020 . 1 . . . . . 14 SER H . 25170 1 85 . 1 . 1 14 14 SER HA H 1 4.675 0.020 . 1 . . . . . 14 SER HA . 25170 1 86 . 1 . 1 14 14 SER C C 13 171.229 0.3 . 1 . . . . . 14 SER C . 25170 1 87 . 1 . 1 14 14 SER CA C 13 55.308 0.3 . 1 . . . . . 14 SER CA . 25170 1 88 . 1 . 1 14 14 SER CB C 13 61.348 0.3 . 1 . . . . . 14 SER CB . 25170 1 89 . 1 . 1 14 14 SER N N 15 115.327 0.3 . 1 . . . . . 14 SER N . 25170 1 90 . 1 . 1 15 15 ALA H H 1 8.246 0.020 . 1 . . . . . 15 ALA H . 25170 1 91 . 1 . 1 15 15 ALA HA H 1 4.675 0.020 . 1 . . . . . 15 ALA HA . 25170 1 92 . 1 . 1 15 15 ALA HB1 H 1 1.287 0.020 . 1 . . . . . 15 ALA HB . 25170 1 93 . 1 . 1 15 15 ALA HB2 H 1 1.287 0.020 . 1 . . . . . 15 ALA HB . 25170 1 94 . 1 . 1 15 15 ALA HB3 H 1 1.287 0.020 . 1 . . . . . 15 ALA HB . 25170 1 95 . 1 . 1 15 15 ALA C C 13 174.216 0.3 . 1 . . . . . 15 ALA C . 25170 1 96 . 1 . 1 15 15 ALA CA C 13 49.110 0.3 . 1 . . . . . 15 ALA CA . 25170 1 97 . 1 . 1 15 15 ALA CB C 13 16.265 0.3 . 1 . . . . . 15 ALA CB . 25170 1 98 . 1 . 1 15 15 ALA N N 15 125.750 0.3 . 1 . . . . . 15 ALA N . 25170 1 99 . 1 . 1 16 16 ALA H H 1 8.218 0.020 . 1 . . . . . 16 ALA H . 25170 1 100 . 1 . 1 16 16 ALA HA H 1 4.231 0.020 . 1 . . . . . 16 ALA HA . 25170 1 101 . 1 . 1 16 16 ALA HB1 H 1 1.369 0.020 . 1 . . . . . 16 ALA HB . 25170 1 102 . 1 . 1 16 16 ALA HB2 H 1 1.369 0.020 . 1 . . . . . 16 ALA HB . 25170 1 103 . 1 . 1 16 16 ALA HB3 H 1 1.369 0.020 . 1 . . . . . 16 ALA HB . 25170 1 104 . 1 . 1 16 16 ALA C C 13 174.823 0.3 . 1 . . . . . 16 ALA C . 25170 1 105 . 1 . 1 16 16 ALA CA C 13 49.416 0.3 . 1 . . . . . 16 ALA CA . 25170 1 106 . 1 . 1 16 16 ALA CB C 13 16.207 0.3 . 1 . . . . . 16 ALA CB . 25170 1 107 . 1 . 1 16 16 ALA N N 15 123.577 0.3 . 1 . . . . . 16 ALA N . 25170 1 108 . 1 . 1 18 18 ALA H H 1 8.344 0.020 . 1 . . . . . 18 ALA H . 25170 1 109 . 1 . 1 18 18 ALA HA H 1 4.231 0.020 . 1 . . . . . 18 ALA HA . 25170 1 110 . 1 . 1 18 18 ALA HB1 H 1 1.419 0.020 . 1 . . . . . 18 ALA HB . 25170 1 111 . 1 . 1 18 18 ALA HB2 H 1 1.419 0.020 . 1 . . . . . 18 ALA HB . 25170 1 112 . 1 . 1 18 18 ALA HB3 H 1 1.419 0.020 . 1 . . . . . 18 ALA HB . 25170 1 113 . 1 . 1 18 18 ALA C C 13 174.924 0.3 . 1 . . . . . 18 ALA C . 25170 1 114 . 1 . 1 18 18 ALA CA C 13 49.489 0.3 . 1 . . . . . 18 ALA CA . 25170 1 115 . 1 . 1 18 18 ALA CB C 13 16.170 0.3 . 1 . . . . . 18 ALA CB . 25170 1 116 . 1 . 1 18 18 ALA N N 15 124.506 0.3 . 1 . . . . . 18 ALA N . 25170 1 117 . 1 . 1 19 19 ALA H H 1 8.298 0.020 . 1 . . . . . 19 ALA H . 25170 1 118 . 1 . 1 19 19 ALA HA H 1 4.264 0.020 . 1 . . . . . 19 ALA HA . 25170 1 119 . 1 . 1 19 19 ALA HB1 H 1 1.402 0.020 . 1 . . . . . 19 ALA HB . 25170 1 120 . 1 . 1 19 19 ALA HB2 H 1 1.402 0.020 . 1 . . . . . 19 ALA HB . 25170 1 121 . 1 . 1 19 19 ALA HB3 H 1 1.402 0.020 . 1 . . . . . 19 ALA HB . 25170 1 122 . 1 . 1 19 19 ALA C C 13 175.633 0.3 . 1 . . . . . 19 ALA C . 25170 1 123 . 1 . 1 19 19 ALA CA C 13 49.508 0.3 . 1 . . . . . 19 ALA CA . 25170 1 124 . 1 . 1 19 19 ALA CB C 13 16.168 0.3 . 1 . . . . . 19 ALA CB . 25170 1 125 . 1 . 1 19 19 ALA N N 15 123.720 0.3 . 1 . . . . . 19 ALA N . 25170 1 126 . 1 . 1 20 20 GLY H H 1 8.319 0.020 . 1 . . . . . 20 GLY H . 25170 1 127 . 1 . 1 20 20 GLY HA2 H 1 4.281 0.020 . 1 . . . . . 20 GLY HA2 . 25170 1 128 . 1 . 1 20 20 GLY HA3 H 1 4.281 0.020 . 1 . . . . . 20 GLY HA3 . 25170 1 129 . 1 . 1 20 20 GLY C C 13 171.988 0.3 . 1 . . . . . 20 GLY C . 25170 1 130 . 1 . 1 20 20 GLY CA C 13 42.465 0.3 . 1 . . . . . 20 GLY CA . 25170 1 131 . 1 . 1 20 20 GLY N N 15 108.342 0.3 . 1 . . . . . 20 GLY N . 25170 1 132 . 1 . 1 21 21 SER H H 1 8.039 0.020 . 1 . . . . . 21 SER H . 25170 1 133 . 1 . 1 21 21 SER HA H 1 4.675 0.020 . 1 . . . . . 21 SER HA . 25170 1 134 . 1 . 1 21 21 SER C C 13 171.330 0.3 . 1 . . . . . 21 SER C . 25170 1 135 . 1 . 1 21 21 SER CA C 13 55.280 0.3 . 1 . . . . . 21 SER CA . 25170 1 136 . 1 . 1 21 21 SER CB C 13 61.545 0.3 . 1 . . . . . 21 SER CB . 25170 1 137 . 1 . 1 21 21 SER N N 15 115.307 0.3 . 1 . . . . . 21 SER N . 25170 1 138 . 1 . 1 22 22 ALA H H 1 8.273 0.020 . 1 . . . . . 22 ALA H . 25170 1 139 . 1 . 1 22 22 ALA HA H 1 4.675 0.020 . 1 . . . . . 22 ALA HA . 25170 1 140 . 1 . 1 22 22 ALA HB1 H 1 1.402 0.020 . 1 . . . . . 22 ALA HB . 25170 1 141 . 1 . 1 22 22 ALA HB2 H 1 1.402 0.020 . 1 . . . . . 22 ALA HB . 25170 1 142 . 1 . 1 22 22 ALA HB3 H 1 1.402 0.020 . 1 . . . . . 22 ALA HB . 25170 1 143 . 1 . 1 22 22 ALA C C 13 172.596 0.3 . 1 . . . . . 22 ALA C . 25170 1 144 . 1 . 1 22 22 ALA CA C 13 47.686 0.3 . 1 . . . . . 22 ALA CA . 25170 1 145 . 1 . 1 22 22 ALA CB C 13 15.506 0.3 . 1 . . . . . 22 ALA CB . 25170 1 146 . 1 . 1 22 22 ALA N N 15 126.937 0.3 . 1 . . . . . 22 ALA N . 25170 1 147 . 1 . 1 24 24 ALA H H 1 8.318 0.020 . 1 . . . . . 24 ALA H . 25170 1 148 . 1 . 1 24 24 ALA HA H 1 4.231 0.020 . 1 . . . . . 24 ALA HA . 25170 1 149 . 1 . 1 24 24 ALA HB1 H 1 1.369 0.020 . 1 . . . . . 24 ALA HB . 25170 1 150 . 1 . 1 24 24 ALA HB2 H 1 1.369 0.020 . 1 . . . . . 24 ALA HB . 25170 1 151 . 1 . 1 24 24 ALA HB3 H 1 1.369 0.020 . 1 . . . . . 24 ALA HB . 25170 1 152 . 1 . 1 24 24 ALA C C 13 174.772 0.3 . 1 . . . . . 24 ALA C . 25170 1 153 . 1 . 1 24 24 ALA CA C 13 49.299 0.3 . 1 . . . . . 24 ALA CA . 25170 1 154 . 1 . 1 24 24 ALA CB C 13 16.075 0.3 . 1 . . . . . 24 ALA CB . 25170 1 155 . 1 . 1 24 24 ALA N N 15 124.420 0.3 . 1 . . . . . 24 ALA N . 25170 1 156 . 1 . 1 25 25 ALA H H 1 8.236 0.020 . 1 . . . . . 25 ALA H . 25170 1 157 . 1 . 1 25 25 ALA HA H 1 4.626 0.020 . 1 . . . . . 25 ALA HA . 25170 1 158 . 1 . 1 25 25 ALA HB1 H 1 1.304 0.020 . 1 . . . . . 25 ALA HB . 25170 1 159 . 1 . 1 25 25 ALA HB2 H 1 1.304 0.020 . 1 . . . . . 25 ALA HB . 25170 1 160 . 1 . 1 25 25 ALA HB3 H 1 1.304 0.020 . 1 . . . . . 25 ALA HB . 25170 1 161 . 1 . 1 25 25 ALA C C 13 172.950 0.3 . 1 . . . . . 25 ALA C . 25170 1 162 . 1 . 1 25 25 ALA CA C 13 47.496 0.3 . 1 . . . . . 25 ALA CA . 25170 1 163 . 1 . 1 25 25 ALA CB C 13 14.936 0.3 . 1 . . . . . 25 ALA CB . 25170 1 164 . 1 . 1 25 25 ALA N N 15 124.849 0.3 . 1 . . . . . 25 ALA N . 25170 1 165 . 1 . 1 26 26 ALA H H 1 8.213 0.020 . 1 . . . . . 26 ALA H . 25170 1 166 . 1 . 1 26 26 ALA HA H 1 4.231 0.020 . 1 . . . . . 26 ALA HA . 25170 1 167 . 1 . 1 26 26 ALA HB1 H 1 1.353 0.020 . 1 . . . . . 26 ALA HB . 25170 1 168 . 1 . 1 26 26 ALA HB2 H 1 1.353 0.020 . 1 . . . . . 26 ALA HB . 25170 1 169 . 1 . 1 26 26 ALA HB3 H 1 1.353 0.020 . 1 . . . . . 26 ALA HB . 25170 1 170 . 1 . 1 26 26 ALA C C 13 174.855 0.3 . 1 . . . . . 26 ALA C . 25170 1 171 . 1 . 1 26 26 ALA CA C 13 49.508 0.3 . 1 . . . . . 26 ALA CA . 25170 1 172 . 1 . 1 26 26 ALA CB C 13 16.180 0.3 . 1 . . . . . 26 ALA CB . 25170 1 173 . 1 . 1 26 26 ALA N N 15 123.348 0.3 . 1 . . . . . 26 ALA N . 25170 1 174 . 1 . 1 27 27 GLU H H 1 8.277 0.020 . 1 . . . . . 27 GLU H . 25170 1 175 . 1 . 1 27 27 GLU HA H 1 4.264 0.020 . 1 . . . . . 27 GLU HA . 25170 1 176 . 1 . 1 27 27 GLU HB2 H 1 1.994 0.020 . 1 . . . . . 27 GLU HB2 . 25170 1 177 . 1 . 1 27 27 GLU HB3 H 1 2.192 0.020 . 2 . . . . . 27 GLU HB3 . 25170 1 178 . 1 . 1 27 27 GLU C C 13 173.659 0.3 . 1 . . . . . 27 GLU C . 25170 1 179 . 1 . 1 27 27 GLU CA C 13 53.666 0.3 . 1 . . . . . 27 GLU CA . 25170 1 180 . 1 . 1 27 27 GLU CB C 13 27.372 0.3 . 1 . . . . . 27 GLU CB . 25170 1 181 . 1 . 1 27 27 GLU N N 15 120.045 0.3 . 1 . . . . . 27 GLU N . 25170 1 182 . 1 . 1 28 28 GLU H H 1 8.341 0.020 . 1 . . . . . 28 GLU H . 25170 1 183 . 1 . 1 28 28 GLU HA H 1 4.248 0.020 . 1 . . . . . 28 GLU HA . 25170 1 184 . 1 . 1 28 28 GLU HB2 H 1 2.225 0.020 . 1 . . . . . 28 GLU HB2 . 25170 1 185 . 1 . 1 28 28 GLU HB3 H 1 2.225 0.020 . 1 . . . . . 28 GLU HB3 . 25170 1 186 . 1 . 1 28 28 GLU CA C 13 53.553 0.3 . 1 . . . . . 28 GLU CA . 25170 1 187 . 1 . 1 28 28 GLU CB C 13 27.338 0.3 . 1 . . . . . 28 GLU CB . 25170 1 188 . 1 . 1 28 28 GLU N N 15 122.590 0.3 . 1 . . . . . 28 GLU N . 25170 1 189 . 1 . 1 29 29 LYS H H 1 8.370 0.020 . 1 . . . . . 29 LYS H . 25170 1 190 . 1 . 1 29 29 LYS HA H 1 4.313 0.020 . 1 . . . . . 29 LYS HA . 25170 1 191 . 1 . 1 29 29 LYS C C 13 173.538 0.3 . 1 . . . . . 29 LYS C . 25170 1 192 . 1 . 1 29 29 LYS CA C 13 53.287 0.3 . 1 . . . . . 29 LYS CA . 25170 1 193 . 1 . 1 29 29 LYS CB C 13 30.179 0.3 . 1 . . . . . 29 LYS CB . 25170 1 194 . 1 . 1 29 29 LYS N N 15 123.520 0.3 . 1 . . . . . 29 LYS N . 25170 1 195 . 1 . 1 30 30 LYS H H 1 8.351 0.020 . 1 . . . . . 30 LYS H . 25170 1 196 . 1 . 1 30 30 LYS HA H 1 4.313 0.020 . 1 . . . . . 30 LYS HA . 25170 1 197 . 1 . 1 30 30 LYS HB2 H 1 1.781 0.020 . 1 . . . . . 30 LYS HB2 . 25170 1 198 . 1 . 1 30 30 LYS HB3 H 1 1.781 0.020 . 1 . . . . . 30 LYS HB3 . 25170 1 199 . 1 . 1 30 30 LYS C C 13 173.608 0.3 . 1 . . . . . 30 LYS C . 25170 1 200 . 1 . 1 30 30 LYS CA C 13 53.381 0.3 . 1 . . . . . 30 LYS CA . 25170 1 201 . 1 . 1 30 30 LYS CB C 13 30.020 0.3 . 1 . . . . . 30 LYS CB . 25170 1 202 . 1 . 1 30 30 LYS N N 15 123.377 0.3 . 1 . . . . . 30 LYS N . 25170 1 203 . 1 . 1 32 32 GLU H H 1 8.267 0.020 . 1 . . . . . 32 GLU H . 25170 1 204 . 1 . 1 32 32 GLU HA H 1 4.248 0.020 . 1 . . . . . 32 GLU HA . 25170 1 205 . 1 . 1 32 32 GLU HB2 H 1 2.192 0.020 . 1 . . . . . 32 GLU HB2 . 25170 1 206 . 1 . 1 32 32 GLU HB3 H 1 2.192 0.020 . 1 . . . . . 32 GLU HB3 . 25170 1 207 . 1 . 1 32 32 GLU C C 13 173.482 0.3 . 1 . . . . . 32 GLU C . 25170 1 208 . 1 . 1 32 32 GLU CA C 13 53.714 0.3 . 1 . . . . . 32 GLU CA . 25170 1 209 . 1 . 1 32 32 GLU CB C 13 27.504 0.3 . 1 . . . . . 32 GLU CB . 25170 1 210 . 1 . 1 32 32 GLU N N 15 121.718 0.3 . 1 . . . . . 32 GLU N . 25170 1 211 . 1 . 1 33 33 LYS H H 1 8.316 0.020 . 1 . . . . . 33 LYS H . 25170 1 212 . 1 . 1 33 33 LYS HA H 1 4.281 0.020 . 1 . . . . . 33 LYS HA . 25170 1 213 . 1 . 1 33 33 LYS HB2 H 1 1.797 0.020 . 1 . . . . . 33 LYS HB2 . 25170 1 214 . 1 . 1 33 33 LYS HB3 H 1 1.797 0.020 . 1 . . . . . 33 LYS HB3 . 25170 1 215 . 1 . 1 33 33 LYS C C 13 173.538 0.3 . 1 . . . . . 33 LYS C . 25170 1 216 . 1 . 1 33 33 LYS CA C 13 53.318 0.3 . 1 . . . . . 33 LYS CA . 25170 1 217 . 1 . 1 33 33 LYS CB C 13 29.587 0.3 . 1 . . . . . 33 LYS CB . 25170 1 218 . 1 . 1 33 33 LYS N N 15 122.762 0.3 . 1 . . . . . 33 LYS N . 25170 1 219 . 1 . 1 34 34 LYS H H 1 8.331 0.020 . 1 . . . . . 34 LYS H . 25170 1 220 . 1 . 1 34 34 LYS HA H 1 4.297 0.020 . 1 . . . . . 34 LYS HA . 25170 1 221 . 1 . 1 34 34 LYS HB2 H 1 1.764 0.020 . 1 . . . . . 34 LYS HB2 . 25170 1 222 . 1 . 1 34 34 LYS HB3 H 1 1.764 0.020 . 1 . . . . . 34 LYS HB3 . 25170 1 223 . 1 . 1 34 34 LYS C C 13 173.708 0.3 . 1 . . . . . 34 LYS C . 25170 1 224 . 1 . 1 34 34 LYS CA C 13 53.211 0.3 . 1 . . . . . 34 LYS CA . 25170 1 225 . 1 . 1 34 34 LYS CB C 13 29.930 0.3 . 1 . . . . . 34 LYS CB . 25170 1 226 . 1 . 1 34 34 LYS N N 15 123.848 0.3 . 1 . . . . . 34 LYS N . 25170 1 227 . 1 . 1 35 35 GLU H H 1 8.498 0.020 . 1 . . . . . 35 GLU H . 25170 1 228 . 1 . 1 35 35 GLU HA H 1 4.248 0.020 . 1 . . . . . 35 GLU HA . 25170 1 229 . 1 . 1 35 35 GLU HB2 H 1 2.241 0.020 . 1 . . . . . 35 GLU HB2 . 25170 1 230 . 1 . 1 35 35 GLU HB3 H 1 2.241 0.020 . 1 . . . . . 35 GLU HB3 . 25170 1 231 . 1 . 1 35 35 GLU C C 13 173.755 0.3 . 1 . . . . . 35 GLU C . 25170 1 232 . 1 . 1 35 35 GLU CA C 13 53.571 0.3 . 1 . . . . . 35 GLU CA . 25170 1 233 . 1 . 1 35 35 GLU CB C 13 27.277 0.3 . 1 . . . . . 35 GLU CB . 25170 1 234 . 1 . 1 35 35 GLU N N 15 122.619 0.3 . 1 . . . . . 35 GLU N . 25170 1 235 . 1 . 1 36 36 GLU H H 1 8.437 0.020 . 1 . . . . . 36 GLU H . 25170 1 236 . 1 . 1 36 36 GLU HA H 1 4.313 0.020 . 1 . . . . . 36 GLU HA . 25170 1 237 . 1 . 1 36 36 GLU C C 13 173.644 0.3 . 1 . . . . . 36 GLU C . 25170 1 238 . 1 . 1 36 36 GLU CA C 13 53.643 0.3 . 1 . . . . . 36 GLU CA . 25170 1 239 . 1 . 1 36 36 GLU CB C 13 27.260 0.3 . 1 . . . . . 36 GLU CB . 25170 1 240 . 1 . 1 36 36 GLU N N 15 122.047 0.3 . 1 . . . . . 36 GLU N . 25170 1 241 . 1 . 1 37 37 SER H H 1 8.303 0.020 . 1 . . . . . 37 SER H . 25170 1 242 . 1 . 1 37 37 SER HA H 1 4.610 0.020 . 1 . . . . . 37 SER HA . 25170 1 243 . 1 . 1 37 37 SER HB2 H 1 3.837 0.020 . 1 . . . . . 37 SER HB2 . 25170 1 244 . 1 . 1 37 37 SER HB3 H 1 3.837 0.020 . 1 . . . . . 37 SER HB3 . 25170 1 245 . 1 . 1 37 37 SER C C 13 171.684 0.3 . 1 . . . . . 37 SER C . 25170 1 246 . 1 . 1 37 37 SER CA C 13 55.321 0.3 . 1 . . . . . 37 SER CA . 25170 1 247 . 1 . 1 37 37 SER CB C 13 61.450 0.3 . 1 . . . . . 37 SER CB . 25170 1 248 . 1 . 1 37 37 SER N N 15 116.591 0.3 . 1 . . . . . 37 SER N . 25170 1 249 . 1 . 1 38 38 GLU H H 1 8.434 0.020 . 1 . . . . . 38 GLU H . 25170 1 250 . 1 . 1 38 38 GLU HA H 1 4.330 0.020 . 1 . . . . . 38 GLU HA . 25170 1 251 . 1 . 1 38 38 GLU HB2 H 1 2.258 0.020 . 1 . . . . . 38 GLU HB2 . 25170 1 252 . 1 . 1 38 38 GLU HB3 H 1 2.258 0.020 . 1 . . . . . 38 GLU HB3 . 25170 1 253 . 1 . 1 38 38 GLU C C 13 173.612 0.3 . 1 . . . . . 38 GLU C . 25170 1 254 . 1 . 1 38 38 GLU CA C 13 53.571 0.3 . 1 . . . . . 38 GLU CA . 25170 1 255 . 1 . 1 38 38 GLU CB C 13 27.372 0.3 . 1 . . . . . 38 GLU CB . 25170 1 256 . 1 . 1 38 38 GLU N N 15 122.919 0.3 . 1 . . . . . 38 GLU N . 25170 1 257 . 1 . 1 39 39 GLU H H 1 8.368 0.020 . 1 . . . . . 39 GLU H . 25170 1 258 . 1 . 1 39 39 GLU HA H 1 4.313 0.020 . 1 . . . . . 39 GLU HA . 25170 1 259 . 1 . 1 39 39 GLU C C 13 173.534 0.3 . 1 . . . . . 39 GLU C . 25170 1 260 . 1 . 1 39 39 GLU CA C 13 53.553 0.3 . 1 . . . . . 39 GLU CA . 25170 1 261 . 1 . 1 39 39 GLU CB C 13 27.398 0.3 . 1 . . . . . 39 GLU CB . 25170 1 262 . 1 . 1 39 39 GLU N N 15 121.746 0.3 . 1 . . . . . 39 GLU N . 25170 1 263 . 1 . 1 40 40 SER H H 1 8.352 0.020 . 1 . . . . . 40 SER H . 25170 1 264 . 1 . 1 40 40 SER HA H 1 4.544 0.020 . 1 . . . . . 40 SER HA . 25170 1 265 . 1 . 1 40 40 SER HB2 H 1 3.837 0.020 . 1 . . . . . 40 SER HB2 . 25170 1 266 . 1 . 1 40 40 SER HB3 H 1 3.837 0.020 . 1 . . . . . 40 SER HB3 . 25170 1 267 . 1 . 1 40 40 SER C C 13 171.507 0.3 . 1 . . . . . 40 SER C . 25170 1 268 . 1 . 1 40 40 SER CA C 13 55.029 0.3 . 1 . . . . . 40 SER CA . 25170 1 269 . 1 . 1 40 40 SER CB C 13 61.217 0.3 . 1 . . . . . 40 SER CB . 25170 1 270 . 1 . 1 40 40 SER N N 15 117.087 0.3 . 1 . . . . . 40 SER N . 25170 1 271 . 1 . 1 41 41 ASP H H 1 8.394 0.020 . 1 . . . . . 41 ASP H . 25170 1 272 . 1 . 1 41 41 ASP HA H 1 4.642 0.020 . 1 . . . . . 41 ASP HA . 25170 1 273 . 1 . 1 41 41 ASP HB2 H 1 2.652 0.020 . 1 . . . . . 41 ASP HB2 . 25170 1 274 . 1 . 1 41 41 ASP HB3 H 1 2.652 0.020 . 1 . . . . . 41 ASP HB3 . 25170 1 275 . 1 . 1 41 41 ASP CA C 13 51.578 0.3 . 1 . . . . . 41 ASP CA . 25170 1 276 . 1 . 1 41 41 ASP CB C 13 38.383 0.3 . 1 . . . . . 41 ASP CB . 25170 1 277 . 1 . 1 41 41 ASP N N 15 122.991 0.3 . 1 . . . . . 41 ASP N . 25170 1 278 . 1 . 1 42 42 ASP H H 1 8.218 0.020 . 1 . . . . . 42 ASP H . 25170 1 279 . 1 . 1 42 42 ASP HA H 1 4.560 0.020 . 1 . . . . . 42 ASP HA . 25170 1 280 . 1 . 1 42 42 ASP HB2 H 1 2.603 0.020 . 1 . . . . . 42 ASP HB2 . 25170 1 281 . 1 . 1 42 42 ASP HB3 H 1 2.603 0.020 . 1 . . . . . 42 ASP HB3 . 25170 1 282 . 1 . 1 42 42 ASP CA C 13 51.768 0.3 . 1 . . . . . 42 ASP CA . 25170 1 283 . 1 . 1 42 42 ASP CB C 13 38.383 0.3 . 1 . . . . . 42 ASP CB . 25170 1 284 . 1 . 1 42 42 ASP N N 15 120.617 0.3 . 1 . . . . . 42 ASP N . 25170 1 285 . 1 . 1 43 43 ASP H H 1 8.240 0.020 . 1 . . . . . 43 ASP H . 25170 1 286 . 1 . 1 43 43 ASP HA H 1 4.577 0.020 . 1 . . . . . 43 ASP HA . 25170 1 287 . 1 . 1 43 43 ASP HB2 H 1 2.652 0.020 . 1 . . . . . 43 ASP HB2 . 25170 1 288 . 1 . 1 43 43 ASP HB3 H 1 2.652 0.020 . 1 . . . . . 43 ASP HB3 . 25170 1 289 . 1 . 1 43 43 ASP C C 13 174.216 0.3 . 1 . . . . . 43 ASP C . 25170 1 290 . 1 . 1 43 43 ASP CA C 13 51.768 0.3 . 1 . . . . . 43 ASP CA . 25170 1 291 . 1 . 1 43 43 ASP CB C 13 38.288 0.3 . 1 . . . . . 43 ASP CB . 25170 1 292 . 1 . 1 43 43 ASP N N 15 120.589 0.3 . 1 . . . . . 43 ASP N . 25170 1 293 . 1 . 1 45 45 GLY H H 1 8.298 0.020 . 1 . . . . . 45 GLY H . 25170 1 294 . 1 . 1 45 45 GLY HA2 H 1 3.837 0.020 . 1 . . . . . 45 GLY HA2 . 25170 1 295 . 1 . 1 45 45 GLY HA3 H 1 3.837 0.020 . 1 . . . . . 45 GLY HA3 . 25170 1 296 . 1 . 1 45 45 GLY C C 13 171.406 0.3 . 1 . . . . . 45 GLY C . 25170 1 297 . 1 . 1 45 45 GLY CA C 13 42.753 0.3 . 1 . . . . . 45 GLY CA . 25170 1 298 . 1 . 1 45 45 GLY N N 15 108.841 0.3 . 1 . . . . . 45 GLY N . 25170 1 299 . 1 . 1 46 46 PHE H H 1 8.008 0.020 . 1 . . . . . 46 PHE H . 25170 1 300 . 1 . 1 46 46 PHE HA H 1 4.626 0.020 . 1 . . . . . 46 PHE HA . 25170 1 301 . 1 . 1 46 46 PHE HB2 H 1 3.096 0.020 . 1 . . . . . 46 PHE HB2 . 25170 1 302 . 1 . 1 46 46 PHE HB3 H 1 3.096 0.020 . 1 . . . . . 46 PHE HB3 . 25170 1 303 . 1 . 1 46 46 PHE C C 13 173.633 0.3 . 1 . . . . . 46 PHE C . 25170 1 304 . 1 . 1 46 46 PHE CA C 13 54.900 0.3 . 1 . . . . . 46 PHE CA . 25170 1 305 . 1 . 1 46 46 PHE CB C 13 36.390 0.3 . 1 . . . . . 46 PHE CB . 25170 1 306 . 1 . 1 46 46 PHE N N 15 119.730 0.3 . 1 . . . . . 46 PHE N . 25170 1 307 . 1 . 1 47 47 GLY H H 1 8.339 0.020 . 1 . . . . . 47 GLY H . 25170 1 308 . 1 . 1 47 47 GLY HA2 H 1 3.820 0.020 . 1 . . . . . 47 GLY HA2 . 25170 1 309 . 1 . 1 47 47 GLY HA3 H 1 3.820 0.020 . 1 . . . . . 47 GLY HA3 . 25170 1 310 . 1 . 1 47 47 GLY C C 13 170.976 0.3 . 1 . . . . . 47 GLY C . 25170 1 311 . 1 . 1 47 47 GLY CA C 13 42.477 0.3 . 1 . . . . . 47 GLY CA . 25170 1 312 . 1 . 1 47 47 GLY N N 15 110.629 0.3 . 1 . . . . . 47 GLY N . 25170 1 313 . 1 . 1 48 48 LEU H H 1 7.770 0.020 . 1 . . . . . 48 LEU H . 25170 1 314 . 1 . 1 48 48 LEU HA H 1 4.231 0.020 . 1 . . . . . 48 LEU HA . 25170 1 315 . 1 . 1 48 48 LEU HB2 H 1 1.386 0.020 . 1 . . . . . 48 LEU HB2 . 25170 1 316 . 1 . 1 48 48 LEU HB3 H 1 1.386 0.020 . 1 . . . . . 48 LEU HB3 . 25170 1 317 . 1 . 1 48 48 LEU C C 13 174.165 0.3 . 1 . . . . . 48 LEU C . 25170 1 318 . 1 . 1 48 48 LEU CA C 13 52.269 0.3 . 1 . . . . . 48 LEU CA . 25170 1 319 . 1 . 1 48 48 LEU CB C 13 39.510 0.3 . 1 . . . . . 48 LEU CB . 25170 1 320 . 1 . 1 48 48 LEU N N 15 121.012 0.3 . 1 . . . . . 48 LEU N . 25170 1 321 . 1 . 1 49 49 PHE H H 1 8.131 0.020 . 1 . . . . . 49 PHE H . 25170 1 322 . 1 . 1 49 49 PHE HA H 1 4.708 0.020 . 1 . . . . . 49 PHE HA . 25170 1 323 . 1 . 1 49 49 PHE HB2 H 1 3.294 0.020 . 1 . . . . . 49 PHE HB2 . 25170 1 324 . 1 . 1 49 49 PHE HB3 H 1 3.294 0.020 . 2 . . . . . 49 PHE HB3 . 25170 1 325 . 1 . 1 49 49 PHE C C 13 171.938 0.3 . 1 . . . . . 49 PHE C . 25170 1 326 . 1 . 1 49 49 PHE CA C 13 53.687 0.3 . 1 . . . . . 49 PHE CA . 25170 1 327 . 1 . 1 49 49 PHE CB C 13 36.864 0.3 . 1 . . . . . 49 PHE CB . 25170 1 328 . 1 . 1 49 49 PHE N N 15 119.876 0.3 . 1 . . . . . 49 PHE N . 25170 1 329 . 1 . 1 50 50 ASP H H 1 7.799 0.020 . 1 . . . . . 50 ASP H . 25170 1 330 . 1 . 1 50 50 ASP HA H 1 4.363 0.020 . 1 . . . . . 50 ASP HA . 25170 1 331 . 1 . 1 50 50 ASP HB2 H 1 2.570 0.020 . 1 . . . . . 50 ASP HB2 . 25170 1 332 . 1 . 1 50 50 ASP HB3 H 1 2.570 0.020 . 1 . . . . . 50 ASP HB3 . 25170 1 333 . 1 . 1 50 50 ASP C C 13 178.113 0.3 . 1 . . . . . 50 ASP C . 25170 1 334 . 1 . 1 50 50 ASP CA C 13 52.052 0.3 . 1 . . . . . 50 ASP CA . 25170 1 335 . 1 . 1 50 50 ASP CB C 13 39.332 0.3 . 1 . . . . . 50 ASP CB . 25170 1 336 . 1 . 1 50 50 ASP N N 15 126.537 0.3 . 1 . . . . . 50 ASP N . 25170 1 stop_ save_ save_assigned_chem_shift_list _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list _Assigned_chem_shift_list.Entry_ID 25170 _Assigned_chem_shift_list.ID 2 _Assigned_chem_shift_list.Name . _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_referenceing _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 25170 2 2 '3D CBCA(CO)NH' . . . 25170 2 3 '3D HNCACB' . . . 25170 2 4 '3D HNCO' . . . 25170 2 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_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.Ambiguity_set_ID _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 . 2 . 2 1 1 LEU H H 1 8.327 0.020 . 1 . . . . . 1 LEU H . 25170 2 2 . 2 . 2 1 1 LEU CA C 13 51.513 0.3 . 1 . . . . . 1 LEU CA . 25170 2 3 . 2 . 2 1 1 LEU CB C 13 38.471 0.3 . 1 . . . . . 1 LEU CB . 25170 2 4 . 2 . 2 1 1 LEU N N 15 121.196 0.3 . 1 . . . . . 1 LEU N . 25170 2 5 . 2 . 2 2 2 GLN H H 1 7.944 0.020 . 1 . . . . . 2 GLN H . 25170 2 6 . 2 . 2 2 2 GLN HA H 1 4.259 0.020 . 1 . . . . . 2 GLN HA . 25170 2 7 . 2 . 2 2 2 GLN HB2 H 1 0.863 0.020 . 1 . . . . . 2 GLN HB2 . 25170 2 8 . 2 . 2 2 2 GLN HB3 H 1 0.863 0.020 . 1 . . . . . 2 GLN HB3 . 25170 2 9 . 2 . 2 2 2 GLN CA C 13 56.221 0.3 . 1 . . . . . 2 GLN CA . 25170 2 10 . 2 . 2 2 2 GLN CB C 13 31.457 0.3 . 1 . . . . . 2 GLN CB . 25170 2 11 . 2 . 2 2 2 GLN N N 15 121.035 0.3 . 1 . . . . . 2 GLN N . 25170 2 12 . 2 . 2 6 6 SER H H 1 8.394 0.020 . 1 . . . . . 6 SER H . 25170 2 13 . 2 . 2 6 6 SER CA C 13 55.747 0.3 . 1 . . . . . 6 SER CA . 25170 2 14 . 2 . 2 6 6 SER CB C 13 60.775 0.3 . 1 . . . . . 6 SER CB . 25170 2 15 . 2 . 2 6 6 SER N N 15 116.290 0.3 . 1 . . . . . 6 SER N . 25170 2 16 . 2 . 2 7 7 GLY H H 1 8.334 0.020 . 1 . . . . . 7 GLY H . 25170 2 17 . 2 . 2 7 7 GLY C C 13 171.137 0.3 . 1 . . . . . 7 GLY C . 25170 2 18 . 2 . 2 7 7 GLY CA C 13 42.440 0.3 . 1 . . . . . 7 GLY CA . 25170 2 19 . 2 . 2 7 7 GLY N N 15 108.741 0.3 . 1 . . . . . 7 GLY N . 25170 2 20 . 2 . 2 8 8 GLY H H 1 8.206 0.020 . 1 . . . . . 8 GLY H . 25170 2 21 . 2 . 2 8 8 GLY C C 13 171.137 0.3 . 1 . . . . . 8 GLY C . 25170 2 22 . 2 . 2 8 8 GLY CA C 13 42.273 0.3 . 1 . . . . . 8 GLY CA . 25170 2 23 . 2 . 2 8 8 GLY N N 15 108.568 0.3 . 1 . . . . . 8 GLY N . 25170 2 24 . 2 . 2 9 9 VAL H H 1 7.971 0.020 . 1 . . . . . 9 VAL H . 25170 2 25 . 2 . 2 9 9 VAL HA H 1 4.077 0.020 . 1 . . . . . 9 VAL HA . 25170 2 26 . 2 . 2 9 9 VAL HB H 1 0.912 0.020 . 1 . . . . . 9 VAL HB . 25170 2 27 . 2 . 2 9 9 VAL C C 13 173.250 0.3 . 1 . . . . . 9 VAL C . 25170 2 28 . 2 . 2 9 9 VAL CA C 13 59.257 0.3 . 1 . . . . . 9 VAL CA . 25170 2 29 . 2 . 2 9 9 VAL CB C 13 29.749 0.3 . 1 . . . . . 9 VAL CB . 25170 2 30 . 2 . 2 9 9 VAL N N 15 119.054 0.3 . 1 . . . . . 9 VAL N . 25170 2 31 . 2 . 2 10 10 ALA H H 1 8.333 0.020 . 1 . . . . . 10 ALA H . 25170 2 32 . 2 . 2 10 10 ALA HA H 1 4.677 0.020 . 1 . . . . . 10 ALA HA . 25170 2 33 . 2 . 2 10 10 ALA HB1 H 1 1.358 0.020 . 1 . . . . . 10 ALA HB . 25170 2 34 . 2 . 2 10 10 ALA HB2 H 1 1.358 0.020 . 1 . . . . . 10 ALA HB . 25170 2 35 . 2 . 2 10 10 ALA HB3 H 1 1.358 0.020 . 1 . . . . . 10 ALA HB . 25170 2 36 . 2 . 2 10 10 ALA C C 13 174.721 0.3 . 1 . . . . . 10 ALA C . 25170 2 37 . 2 . 2 10 10 ALA CA C 13 49.462 0.3 . 1 . . . . . 10 ALA CA . 25170 2 38 . 2 . 2 10 10 ALA CB C 13 16.276 0.3 . 1 . . . . . 10 ALA CB . 25170 2 39 . 2 . 2 10 10 ALA N N 15 124.420 0.3 . 1 . . . . . 10 ALA N . 25170 2 40 . 2 . 2 11 11 ALA H H 1 8.115 0.020 . 1 . . . . . 11 ALA H . 25170 2 41 . 2 . 2 11 11 ALA HA H 1 4.687 0.020 . 1 . . . . . 11 ALA HA . 25170 2 42 . 2 . 2 11 11 ALA HB1 H 1 1.341 0.020 . 1 . . . . . 11 ALA HB . 25170 2 43 . 2 . 2 11 11 ALA HB2 H 1 1.341 0.020 . 1 . . . . . 11 ALA HB . 25170 2 44 . 2 . 2 11 11 ALA HB3 H 1 1.341 0.020 . 1 . . . . . 11 ALA HB . 25170 2 45 . 2 . 2 11 11 ALA C C 13 174.188 0.3 . 1 . . . . . 11 ALA C . 25170 2 46 . 2 . 2 11 11 ALA CA C 13 49.390 0.3 . 1 . . . . . 11 ALA CA . 25170 2 47 . 2 . 2 11 11 ALA CB C 13 15.422 0.3 . 1 . . . . . 11 ALA CB . 25170 2 48 . 2 . 2 11 11 ALA N N 15 123.200 0.3 . 1 . . . . . 11 ALA N . 25170 2 49 . 2 . 2 12 12 ALA H H 1 8.159 0.020 . 1 . . . . . 12 ALA H . 25170 2 50 . 2 . 2 12 12 ALA HA H 1 4.682 0.020 . 1 . . . . . 12 ALA HA . 25170 2 51 . 2 . 2 12 12 ALA HB1 H 1 1.326 0.020 . 1 . . . . . 12 ALA HB . 25170 2 52 . 2 . 2 12 12 ALA HB2 H 1 1.326 0.020 . 1 . . . . . 12 ALA HB . 25170 2 53 . 2 . 2 12 12 ALA HB3 H 1 1.326 0.020 . 1 . . . . . 12 ALA HB . 25170 2 54 . 2 . 2 12 12 ALA C C 13 172.616 0.3 . 1 . . . . . 12 ALA C . 25170 2 55 . 2 . 2 12 12 ALA CA C 13 47.733 0.3 . 1 . . . . . 12 ALA CA . 25170 2 56 . 2 . 2 12 12 ALA CB C 13 15.222 0.3 . 1 . . . . . 12 ALA CB . 25170 2 57 . 2 . 2 12 12 ALA N N 15 124.674 0.3 . 1 . . . . . 12 ALA N . 25170 2 58 . 2 . 2 13 13 ALA H H 1 8.133 0.020 . 1 . . . . . 13 ALA H . 25170 2 59 . 2 . 2 13 13 ALA HA H 1 4.671 0.020 . 1 . . . . . 13 ALA HA . 25170 2 60 . 2 . 2 13 13 ALA HB1 H 1 0.929 0.020 . 1 . . . . . 13 ALA HB . 25170 2 61 . 2 . 2 13 13 ALA HB2 H 1 0.929 0.020 . 1 . . . . . 13 ALA HB . 25170 2 62 . 2 . 2 13 13 ALA HB3 H 1 0.929 0.020 . 1 . . . . . 13 ALA HB . 25170 2 63 . 2 . 2 13 13 ALA C C 13 171.677 0.3 . 1 . . . . . 13 ALA C . 25170 2 64 . 2 . 2 13 13 ALA CA C 13 49.959 0.3 . 1 . . . . . 13 ALA CA . 25170 2 65 . 2 . 2 13 13 ALA CB C 13 15.232 0.3 . 1 . . . . . 13 ALA CB . 25170 2 66 . 2 . 2 13 13 ALA N N 15 122.532 0.3 . 1 . . . . . 13 ALA N . 25170 2 67 . 2 . 2 14 14 ALA H H 1 8.135 0.020 . 1 . . . . . 14 ALA H . 25170 2 68 . 2 . 2 14 14 ALA HA H 1 4.671 0.020 . 1 . . . . . 14 ALA HA . 25170 2 69 . 2 . 2 14 14 ALA HB1 H 1 1.341 0.020 . 1 . . . . . 14 ALA HB . 25170 2 70 . 2 . 2 14 14 ALA HB2 H 1 1.341 0.020 . 1 . . . . . 14 ALA HB . 25170 2 71 . 2 . 2 14 14 ALA HB3 H 1 1.341 0.020 . 1 . . . . . 14 ALA HB . 25170 2 72 . 2 . 2 14 14 ALA CA C 13 49.390 0.3 . 1 . . . . . 14 ALA CA . 25170 2 73 . 2 . 2 14 14 ALA CB C 13 16.086 0.3 . 1 . . . . . 14 ALA CB . 25170 2 74 . 2 . 2 14 14 ALA N N 15 123.384 0.3 . 1 . . . . . 14 ALA N . 25170 2 75 . 2 . 2 19 19 ALA H H 1 8.262 0.020 . 1 . . . . . 19 ALA H . 25170 2 76 . 2 . 2 19 19 ALA HA H 1 4.687 0.020 . 1 . . . . . 19 ALA HA . 25170 2 77 . 2 . 2 19 19 ALA CA C 13 49.812 0.3 . 1 . . . . . 19 ALA CA . 25170 2 78 . 2 . 2 19 19 ALA CB C 13 16.086 0.3 . 1 . . . . . 19 ALA CB . 25170 2 79 . 2 . 2 19 19 ALA N N 15 123.315 0.3 . 1 . . . . . 19 ALA N . 25170 2 80 . 2 . 2 20 20 ALA H H 1 8.290 0.020 . 1 . . . . . 20 ALA H . 25170 2 81 . 2 . 2 20 20 ALA HA H 1 4.671 0.020 . 1 . . . . . 20 ALA HA . 25170 2 82 . 2 . 2 20 20 ALA HB1 H 1 1.703 0.020 . 1 . . . . . 20 ALA HB . 25170 2 83 . 2 . 2 20 20 ALA HB2 H 1 1.703 0.020 . 1 . . . . . 20 ALA HB . 25170 2 84 . 2 . 2 20 20 ALA HB3 H 1 1.703 0.020 . 1 . . . . . 20 ALA HB . 25170 2 85 . 2 . 2 20 20 ALA C C 13 173.427 0.3 . 1 . . . . . 20 ALA C . 25170 2 86 . 2 . 2 20 20 ALA CA C 13 49.812 0.3 . 1 . . . . . 20 ALA CA . 25170 2 87 . 2 . 2 20 20 ALA CB C 13 16.181 0.3 . 1 . . . . . 20 ALA CB . 25170 2 88 . 2 . 2 20 20 ALA N N 15 123.015 0.3 . 1 . . . . . 20 ALA N . 25170 2 89 . 2 . 2 21 21 ASP H H 1 8.145 0.020 . 1 . . . . . 21 ASP H . 25170 2 90 . 2 . 2 21 21 ASP HA H 1 4.671 0.020 . 1 . . . . . 21 ASP HA . 25170 2 91 . 2 . 2 21 21 ASP HB2 H 1 2.643 0.020 . 1 . . . . . 21 ASP HB2 . 25170 2 92 . 2 . 2 21 21 ASP HB3 H 1 2.643 0.020 . 1 . . . . . 21 ASP HB3 . 25170 2 93 . 2 . 2 21 21 ASP C C 13 174.766 0.3 . 1 . . . . . 21 ASP C . 25170 2 94 . 2 . 2 21 21 ASP CA C 13 51.356 0.3 . 1 . . . . . 21 ASP CA . 25170 2 95 . 2 . 2 21 21 ASP CB C 13 38.383 0.3 . 1 . . . . . 21 ASP CB . 25170 2 96 . 2 . 2 21 21 ASP N N 15 119.077 0.3 . 1 . . . . . 21 ASP N . 25170 2 97 . 2 . 2 22 22 ALA H H 1 8.210 0.020 . 1 . . . . . 22 ALA H . 25170 2 98 . 2 . 2 22 22 ALA HA H 1 4.684 0.020 . 1 . . . . . 22 ALA HA . 25170 2 99 . 2 . 2 22 22 ALA HB1 H 1 1.385 0.020 . 1 . . . . . 22 ALA HB . 25170 2 100 . 2 . 2 22 22 ALA HB2 H 1 1.385 0.020 . 1 . . . . . 22 ALA HB . 25170 2 101 . 2 . 2 22 22 ALA HB3 H 1 1.385 0.020 . 1 . . . . . 22 ALA HB . 25170 2 102 . 2 . 2 22 22 ALA C C 13 175.659 0.3 . 1 . . . . . 22 ALA C . 25170 2 103 . 2 . 2 22 22 ALA CA C 13 50.285 0.3 . 1 . . . . . 22 ALA CA . 25170 2 104 . 2 . 2 22 22 ALA CB C 13 15.991 0.3 . 1 . . . . . 22 ALA CB . 25170 2 105 . 2 . 2 22 22 ALA N N 15 124.743 0.3 . 1 . . . . . 22 ALA N . 25170 2 106 . 2 . 2 23 23 GLY H H 1 8.368 0.020 . 1 . . . . . 23 GLY H . 25170 2 107 . 2 . 2 23 23 GLY C C 13 171.576 0.3 . 1 . . . . . 23 GLY C . 25170 2 108 . 2 . 2 23 23 GLY CA C 13 42.526 0.3 . 1 . . . . . 23 GLY CA . 25170 2 109 . 2 . 2 23 23 GLY N N 15 107.615 0.3 . 1 . . . . . 23 GLY N . 25170 2 110 . 2 . 2 24 24 ALA H H 1 8.065 0.020 . 1 . . . . . 24 ALA H . 25170 2 111 . 2 . 2 24 24 ALA HA H 1 4.670 0.020 . 1 . . . . . 24 ALA HA . 25170 2 112 . 2 . 2 24 24 ALA HB1 H 1 1.335 0.020 . 1 . . . . . 24 ALA HB . 25170 2 113 . 2 . 2 24 24 ALA HB2 H 1 1.335 0.020 . 1 . . . . . 24 ALA HB . 25170 2 114 . 2 . 2 24 24 ALA HB3 H 1 1.335 0.020 . 1 . . . . . 24 ALA HB . 25170 2 115 . 2 . 2 24 24 ALA C C 13 175.812 0.3 . 1 . . . . . 24 ALA C . 25170 2 116 . 2 . 2 24 24 ALA CA C 13 49.769 0.3 . 1 . . . . . 24 ALA CA . 25170 2 117 . 2 . 2 24 24 ALA CB C 13 16.181 0.3 . 1 . . . . . 24 ALA CB . 25170 2 118 . 2 . 2 24 24 ALA N N 15 123.568 0.3 . 1 . . . . . 24 ALA N . 25170 2 119 . 2 . 2 25 25 GLY H H 1 8.309 0.020 . 1 . . . . . 25 GLY H . 25170 2 120 . 2 . 2 25 25 GLY C C 13 171.081 0.3 . 1 . . . . . 25 GLY C . 25170 2 121 . 2 . 2 25 25 GLY CA C 13 42.370 0.3 . 1 . . . . . 25 GLY CA . 25170 2 122 . 2 . 2 25 25 GLY N N 15 108.290 0.3 . 1 . . . . . 25 GLY N . 25170 2 123 . 2 . 2 26 26 ALA H H 1 8.016 0.020 . 1 . . . . . 26 ALA H . 25170 2 124 . 2 . 2 26 26 ALA C C 13 174.949 0.3 . 1 . . . . . 26 ALA C . 25170 2 125 . 2 . 2 26 26 ALA CA C 13 49.769 0.3 . 1 . . . . . 26 ALA CA . 25170 2 126 . 2 . 2 26 26 ALA CB C 13 16.181 0.3 . 1 . . . . . 26 ALA CB . 25170 2 127 . 2 . 2 26 26 ALA N N 15 123.683 0.3 . 1 . . . . . 26 ALA N . 25170 2 128 . 2 . 2 27 27 ALA H H 1 8.031 0.020 . 1 . . . . . 27 ALA H . 25170 2 129 . 2 . 2 27 27 ALA C C 13 174.873 0.3 . 1 . . . . . 27 ALA C . 25170 2 130 . 2 . 2 27 27 ALA CA C 13 49.864 0.3 . 1 . . . . . 27 ALA CA . 25170 2 131 . 2 . 2 27 27 ALA CB C 13 15.801 0.3 . 1 . . . . . 27 ALA CB . 25170 2 132 . 2 . 2 27 27 ALA N N 15 122.548 0.3 . 1 . . . . . 27 ALA N . 25170 2 133 . 2 . 2 28 28 ALA H H 1 8.050 0.020 . 1 . . . . . 28 ALA H . 25170 2 134 . 2 . 2 28 28 ALA CA C 13 49.674 0.3 . 1 . . . . . 28 ALA CA . 25170 2 135 . 2 . 2 28 28 ALA CB C 13 16.276 0.3 . 1 . . . . . 28 ALA CB . 25170 2 136 . 2 . 2 28 28 ALA N N 15 122.946 0.3 . 1 . . . . . 28 ALA N . 25170 2 137 . 2 . 2 29 29 LYS H H 1 8.141 0.020 . 1 . . . . . 29 LYS H . 25170 2 138 . 2 . 2 29 29 LYS HA H 1 4.687 0.020 . 1 . . . . . 29 LYS HA . 25170 2 139 . 2 . 2 29 29 LYS HB2 H 1 4.259 0.020 . 1 . . . . . 29 LYS HB2 . 25170 2 140 . 2 . 2 29 29 LYS HB3 H 1 4.259 0.020 . 2 . . . . . 29 LYS HB3 . 25170 2 141 . 2 . 2 29 29 LYS C C 13 173.732 0.3 . 1 . . . . . 29 LYS C . 25170 2 142 . 2 . 2 29 29 LYS CA C 13 53.375 0.3 . 1 . . . . . 29 LYS CA . 25170 2 143 . 2 . 2 29 29 LYS CB C 13 29.939 0.3 . 1 . . . . . 29 LYS CB . 25170 2 144 . 2 . 2 29 29 LYS N N 15 120.850 0.3 . 1 . . . . . 29 LYS N . 25170 2 145 . 2 . 2 30 30 LYS H H 1 8.325 0.020 . 1 . . . . . 30 LYS H . 25170 2 146 . 2 . 2 30 30 LYS C C 13 173.798 0.3 . 1 . . . . . 30 LYS C . 25170 2 147 . 2 . 2 30 30 LYS CA C 13 53.469 0.3 . 1 . . . . . 30 LYS CA . 25170 2 148 . 2 . 2 30 30 LYS CB C 13 30.034 0.3 . 1 . . . . . 30 LYS CB . 25170 2 149 . 2 . 2 30 30 LYS N N 15 123.430 0.3 . 1 . . . . . 30 LYS N . 25170 2 150 . 2 . 2 31 31 GLU H H 1 8.162 0.020 . 1 . . . . . 31 GLU H . 25170 2 151 . 2 . 2 31 31 GLU C C 13 171.677 0.3 . 1 . . . . . 31 GLU C . 25170 2 152 . 2 . 2 31 31 GLU CA C 13 56.885 0.3 . 1 . . . . . 31 GLU CA . 25170 2 153 . 2 . 2 31 31 GLU CB C 13 29.654 0.3 . 1 . . . . . 31 GLU CB . 25170 2 154 . 2 . 2 31 31 GLU N N 15 122.923 0.3 . 1 . . . . . 31 GLU N . 25170 2 155 . 2 . 2 35 35 LYS H H 1 8.393 0.020 . 1 . . . . . 35 LYS H . 25170 2 156 . 2 . 2 35 35 LYS HA H 1 4.242 0.020 . 1 . . . . . 35 LYS HA . 25170 2 157 . 2 . 2 35 35 LYS HB2 H 1 1.934 0.020 . 1 . . . . . 35 LYS HB2 . 25170 2 158 . 2 . 2 35 35 LYS HB3 H 1 2.231 0.020 . 2 . . . . . 35 LYS HB3 . 25170 2 159 . 2 . 2 35 35 LYS C C 13 173.554 0.3 . 1 . . . . . 35 LYS C . 25170 2 160 . 2 . 2 35 35 LYS CA C 13 53.783 0.3 . 1 . . . . . 35 LYS CA . 25170 2 161 . 2 . 2 35 35 LYS N N 15 121.426 0.3 . 1 . . . . . 35 LYS N . 25170 2 162 . 2 . 2 36 36 GLU H H 1 8.317 0.020 . 1 . . . . . 36 GLU H . 25170 2 163 . 2 . 2 36 36 GLU HA H 1 4.687 0.020 . 1 . . . . . 36 GLU HA . 25170 2 164 . 2 . 2 36 36 GLU HB2 H 1 2.214 0.020 . 2 . . . . . 36 GLU HB2 . 25170 2 165 . 2 . 2 36 36 GLU HB3 H 1 1.951 0.020 . 2 . . . . . 36 GLU HB3 . 25170 2 166 . 2 . 2 36 36 GLU C C 13 173.427 0.3 . 1 . . . . . 36 GLU C . 25170 2 167 . 2 . 2 36 36 GLU CA C 13 53.659 0.3 . 1 . . . . . 36 GLU CA . 25170 2 168 . 2 . 2 36 36 GLU CB C 13 27.377 0.3 . 1 . . . . . 36 GLU CB . 25170 2 169 . 2 . 2 36 36 GLU N N 15 122.094 0.3 . 1 . . . . . 36 GLU N . 25170 2 170 . 2 . 2 37 37 GLU H H 1 8.410 0.020 . 1 . . . . . 37 GLU H . 25170 2 171 . 2 . 2 37 37 GLU HA H 1 4.242 0.020 . 1 . . . . . 37 GLU HA . 25170 2 172 . 2 . 2 37 37 GLU HB2 H 1 1.951 0.020 . 1 . . . . . 37 GLU HB2 . 25170 2 173 . 2 . 2 37 37 GLU HB3 H 1 2.214 0.020 . 2 . . . . . 37 GLU HB3 . 25170 2 174 . 2 . 2 37 37 GLU C C 13 173.554 0.3 . 1 . . . . . 37 GLU C . 25170 2 175 . 2 . 2 37 37 GLU CA C 13 53.659 0.3 . 1 . . . . . 37 GLU CA . 25170 2 176 . 2 . 2 37 37 GLU CB C 13 27.187 0.3 . 1 . . . . . 37 GLU CB . 25170 2 177 . 2 . 2 37 37 GLU N N 15 121.173 0.3 . 1 . . . . . 37 GLU N . 25170 2 178 . 2 . 2 38 38 GLU H H 1 8.450 0.020 . 1 . . . . . 38 GLU H . 25170 2 179 . 2 . 2 38 38 GLU HA H 1 4.259 0.020 . 1 . . . . . 38 GLU HA . 25170 2 180 . 2 . 2 38 38 GLU HB2 H 1 1.918 0.020 . 1 . . . . . 38 GLU HB2 . 25170 2 181 . 2 . 2 38 38 GLU HB3 H 1 2.231 0.020 . 2 . . . . . 38 GLU HB3 . 25170 2 182 . 2 . 2 38 38 GLU C C 13 173.351 0.3 . 1 . . . . . 38 GLU C . 25170 2 183 . 2 . 2 38 38 GLU CA C 13 53.564 0.3 . 1 . . . . . 38 GLU CA . 25170 2 184 . 2 . 2 38 38 GLU CB C 13 27.567 0.3 . 1 . . . . . 38 GLU CB . 25170 2 185 . 2 . 2 38 38 GLU N N 15 122.555 0.3 . 1 . . . . . 38 GLU N . 25170 2 186 . 2 . 2 39 39 GLU H H 1 8.369 0.020 . 1 . . . . . 39 GLU H . 25170 2 187 . 2 . 2 39 39 GLU HA H 1 4.275 0.020 . 1 . . . . . 39 GLU HA . 25170 2 188 . 2 . 2 39 39 GLU HB2 H 1 2.198 0.020 . 1 . . . . . 39 GLU HB2 . 25170 2 189 . 2 . 2 39 39 GLU HB3 H 1 2.198 0.020 . 2 . . . . . 39 GLU HB3 . 25170 2 190 . 2 . 2 39 39 GLU C C 13 173.427 0.3 . 1 . . . . . 39 GLU C . 25170 2 191 . 2 . 2 39 39 GLU CA C 13 53.659 0.3 . 1 . . . . . 39 GLU CA . 25170 2 192 . 2 . 2 39 39 GLU CB C 13 27.377 0.3 . 1 . . . . . 39 GLU CB . 25170 2 193 . 2 . 2 39 39 GLU N N 15 122.048 0.3 . 1 . . . . . 39 GLU N . 25170 2 194 . 2 . 2 40 40 GLU H H 1 8.508 0.020 . 1 . . . . . 40 GLU H . 25170 2 195 . 2 . 2 40 40 GLU HA H 1 4.687 0.020 . 1 . . . . . 40 GLU HA . 25170 2 196 . 2 . 2 40 40 GLU HB2 H 1 2.231 0.020 . 2 . . . . . 40 GLU HB2 . 25170 2 197 . 2 . 2 40 40 GLU HB3 H 1 1.951 0.020 . 2 . . . . . 40 GLU HB3 . 25170 2 198 . 2 . 2 40 40 GLU C C 13 173.656 0.3 . 1 . . . . . 40 GLU C . 25170 2 199 . 2 . 2 40 40 GLU CA C 13 53.754 0.3 . 1 . . . . . 40 GLU CA . 25170 2 200 . 2 . 2 40 40 GLU CB C 13 27.187 0.3 . 1 . . . . . 40 GLU CB . 25170 2 201 . 2 . 2 40 40 GLU N N 15 122.647 0.3 . 1 . . . . . 40 GLU N . 25170 2 202 . 2 . 2 41 41 GLU H H 1 8.348 0.020 . 1 . . . . . 41 GLU H . 25170 2 203 . 2 . 2 41 41 GLU HA H 1 4.259 0.020 . 1 . . . . . 41 GLU HA . 25170 2 204 . 2 . 2 41 41 GLU HB2 H 1 1.918 0.020 . 1 . . . . . 41 GLU HB2 . 25170 2 205 . 2 . 2 41 41 GLU HB3 H 1 2.214 0.020 . 2 . . . . . 41 GLU HB3 . 25170 2 206 . 2 . 2 41 41 GLU C C 13 173.427 0.3 . 1 . . . . . 41 GLU C . 25170 2 207 . 2 . 2 41 41 GLU CA C 13 53.659 0.3 . 1 . . . . . 41 GLU CA . 25170 2 208 . 2 . 2 41 41 GLU CB C 13 27.377 0.3 . 1 . . . . . 41 GLU CB . 25170 2 209 . 2 . 2 41 41 GLU N N 15 121.610 0.3 . 1 . . . . . 41 GLU N . 25170 2 210 . 2 . 2 42 42 ASP H H 1 8.367 0.020 . 1 . . . . . 42 ASP H . 25170 2 211 . 2 . 2 42 42 ASP HA H 1 4.391 0.020 . 1 . . . . . 42 ASP HA . 25170 2 212 . 2 . 2 42 42 ASP HB2 H 1 2.511 0.020 . 1 . . . . . 42 ASP HB2 . 25170 2 213 . 2 . 2 42 42 ASP HB3 H 1 2.511 0.020 . 2 . . . . . 42 ASP HB3 . 25170 2 214 . 2 . 2 42 42 ASP C C 13 173.377 0.3 . 1 . . . . . 42 ASP C . 25170 2 215 . 2 . 2 42 42 ASP CA C 13 52.953 0.3 . 1 . . . . . 42 ASP CA . 25170 2 216 . 2 . 2 42 42 ASP N N 15 120.528 0.3 . 1 . . . . . 42 ASP N . 25170 2 217 . 2 . 2 43 43 ASP H H 1 8.400 0.020 . 1 . . . . . 43 ASP H . 25170 2 218 . 2 . 2 43 43 ASP HA H 1 4.654 0.020 . 1 . . . . . 43 ASP HA . 25170 2 219 . 2 . 2 43 43 ASP HB2 H 1 2.627 0.020 . 1 . . . . . 43 ASP HB2 . 25170 2 220 . 2 . 2 43 43 ASP HB3 H 1 2.627 0.020 . 1 . . . . . 43 ASP HB3 . 25170 2 221 . 2 . 2 43 43 ASP C C 13 173.342 0.3 . 1 . . . . . 43 ASP C . 25170 2 222 . 2 . 2 43 43 ASP CA C 13 53.553 0.3 . 1 . . . . . 43 ASP CA . 25170 2 223 . 2 . 2 43 43 ASP CB C 13 38.573 0.3 . 1 . . . . . 43 ASP CB . 25170 2 224 . 2 . 2 43 43 ASP N N 15 122.509 0.3 . 1 . . . . . 43 ASP N . 25170 2 225 . 2 . 2 44 44 MET H H 1 7.745 0.020 . 1 . . . . . 44 MET H . 25170 2 226 . 2 . 2 44 44 MET C C 13 177.942 0.3 . 1 . . . . . 44 MET C . 25170 2 227 . 2 . 2 44 44 MET CA C 13 54.575 0.3 . 1 . . . . . 44 MET CA . 25170 2 228 . 2 . 2 44 44 MET CB C 13 28.610 0.3 . 1 . . . . . 44 MET CB . 25170 2 229 . 2 . 2 44 44 MET N N 15 125.963 0.3 . 1 . . . . . 44 MET N . 25170 2 230 . 2 . 2 46 46 PHE H H 1 7.928 0.020 . 1 . . . . . 46 PHE H . 25170 2 231 . 2 . 2 46 46 PHE C C 13 172.895 0.3 . 1 . . . . . 46 PHE C . 25170 2 232 . 2 . 2 46 46 PHE CA C 13 54.703 0.3 . 1 . . . . . 46 PHE CA . 25170 2 233 . 2 . 2 46 46 PHE CB C 13 36.770 0.3 . 1 . . . . . 46 PHE CB . 25170 2 234 . 2 . 2 46 46 PHE N N 15 119.584 0.3 . 1 . . . . . 46 PHE N . 25170 2 235 . 2 . 2 47 47 SER H H 1 8.198 0.020 . 1 . . . . . 47 SER H . 25170 2 236 . 2 . 2 47 47 SER C C 13 172.007 0.3 . 1 . . . . . 47 SER C . 25170 2 237 . 2 . 2 47 47 SER CA C 13 55.082 0.3 . 1 . . . . . 47 SER CA . 25170 2 238 . 2 . 2 47 47 SER CB C 13 61.439 0.3 . 1 . . . . . 47 SER CB . 25170 2 239 . 2 . 2 47 47 SER N N 15 117.257 0.3 . 1 . . . . . 47 SER N . 25170 2 240 . 2 . 2 49 49 PHE H H 1 7.993 0.020 . 1 . . . . . 49 PHE H . 25170 2 241 . 2 . 2 49 49 PHE HA H 1 4.671 0.020 . 1 . . . . . 49 PHE HA . 25170 2 242 . 2 . 2 49 49 PHE HB2 H 1 2.857 0.020 . 1 . . . . . 49 PHE HB2 . 25170 2 243 . 2 . 2 49 49 PHE HB3 H 1 3.253 0.020 . 2 . . . . . 49 PHE HB3 . 25170 2 244 . 2 . 2 49 49 PHE C C 13 171.753 0.3 . 1 . . . . . 49 PHE C . 25170 2 245 . 2 . 2 49 49 PHE CA C 13 54.323 0.3 . 1 . . . . . 49 PHE CA . 25170 2 246 . 2 . 2 49 49 PHE CB C 13 36.960 0.3 . 1 . . . . . 49 PHE CB . 25170 2 247 . 2 . 2 49 49 PHE N N 15 119.330 0.3 . 1 . . . . . 49 PHE N . 25170 2 248 . 2 . 2 50 50 ASP H H 1 7.793 0.020 . 1 . . . . . 50 ASP H . 25170 2 249 . 2 . 2 50 50 ASP HA H 1 4.358 0.020 . 1 . . . . . 50 ASP HA . 25170 2 250 . 2 . 2 50 50 ASP HB2 H 1 2.561 0.020 . 1 . . . . . 50 ASP HB2 . 25170 2 251 . 2 . 2 50 50 ASP HB3 H 1 2.561 0.020 . 1 . . . . . 50 ASP HB3 . 25170 2 252 . 2 . 2 50 50 ASP C C 13 177.993 0.3 . 1 . . . . . 50 ASP C . 25170 2 253 . 2 . 2 50 50 ASP CA C 13 53.214 0.3 . 1 . . . . . 50 ASP CA . 25170 2 254 . 2 . 2 50 50 ASP CB C 13 39.522 0.3 . 1 . . . . . 50 ASP CB . 25170 2 255 . 2 . 2 50 50 ASP N N 15 126.424 0.3 . 1 . . . . . 50 ASP N . 25170 2 stop_ save_ save_assigned_chem_shift_list_3 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_3 _Assigned_chem_shift_list.Entry_ID 25170 _Assigned_chem_shift_list.ID 3 _Assigned_chem_shift_list.Name . _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_referenceing _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 25170 3 2 '3D CBCA(CO)NH' . . . 25170 3 3 '3D HNCACB' . . . 25170 3 4 '3D HNCO' . . . 25170 3 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_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.Ambiguity_set_ID _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 . 3 . 3 1 1 LYS H H 1 8.423 0.020 . 1 . . . . . 1 LYS H . 25170 3 2 . 3 . 3 1 1 LYS HA H 1 4.478 0.020 . 1 . . . . . 1 LYS HA . 25170 3 3 . 3 . 3 1 1 LYS HB2 H 1 2.104 0.020 . 1 . . . . . 1 LYS HB2 . 25170 3 4 . 3 . 3 1 1 LYS HB3 H 1 2.104 0.020 . 1 . . . . . 1 LYS HB3 . 25170 3 5 . 3 . 3 1 1 LYS C C 13 173.586 0.3 . 1 . . . . . 1 LYS C . 25170 3 6 . 3 . 3 1 1 LYS CA C 13 53.426 0.3 . 1 . . . . . 1 LYS CA . 25170 3 7 . 3 . 3 1 1 LYS CB C 13 27.653 0.3 . 1 . . . . . 1 LYS CB . 25170 3 8 . 3 . 3 1 1 LYS N N 15 122.205 0.3 . 1 . . . . . 1 LYS N . 25170 3 9 . 3 . 3 2 2 LEU H H 1 8.382 0.020 . 1 . . . . . 2 LEU H . 25170 3 10 . 3 . 3 2 2 LEU HA H 1 4.511 0.020 . 1 . . . . . 2 LEU HA . 25170 3 11 . 3 . 3 2 2 LEU HB2 H 1 2.335 0.020 . 1 . . . . . 2 LEU HB2 . 25170 3 12 . 3 . 3 2 2 LEU HB3 H 1 2.335 0.020 . 1 . . . . . 2 LEU HB3 . 25170 3 13 . 3 . 3 2 2 LEU C C 13 173.586 0.3 . 1 . . . . . 2 LEU C . 25170 3 14 . 3 . 3 2 2 LEU CA C 13 51.298 0.3 . 1 . . . . . 2 LEU CA . 25170 3 15 . 3 . 3 2 2 LEU CB C 13 38.668 0.3 . 1 . . . . . 2 LEU CB . 25170 3 16 . 3 . 3 2 2 LEU N N 15 122.029 0.3 . 1 . . . . . 2 LEU N . 25170 3 17 . 3 . 3 5 5 ILE H H 1 8.086 0.020 . 1 . . . . . 5 ILE H . 25170 3 18 . 3 . 3 5 5 ILE HA H 1 4.593 0.020 . 1 . . . . . 5 ILE HA . 25170 3 19 . 3 . 3 5 5 ILE C C 13 174.061 0.3 . 1 . . . . . 5 ILE C . 25170 3 20 . 3 . 3 5 5 ILE CA C 13 58.703 0.3 . 1 . . . . . 5 ILE CA . 25170 3 21 . 3 . 3 5 5 ILE CB C 13 35.439 0.3 . 1 . . . . . 5 ILE CB . 25170 3 22 . 3 . 3 5 5 ILE N N 15 120.702 0.3 . 1 . . . . . 5 ILE N . 25170 3 23 . 3 . 3 6 6 GLY H H 1 8.455 0.020 . 1 . . . . . 6 GLY H . 25170 3 24 . 3 . 3 6 6 GLY HA2 H 1 4.692 0.020 . 1 . . . . . 6 GLY HA2 . 25170 3 25 . 3 . 3 6 6 GLY HA3 H 1 4.692 0.020 . 1 . . . . . 6 GLY HA3 . 25170 3 26 . 3 . 3 6 6 GLY CA C 13 43.036 0.3 . 1 . . . . . 6 GLY CA . 25170 3 27 . 3 . 3 6 6 GLY N N 15 112.494 0.3 . 1 . . . . . 6 GLY N . 25170 3 28 . 3 . 3 7 7 GLY H H 1 8.232 0.020 . 1 . . . . . 7 GLY H . 25170 3 29 . 3 . 3 7 7 GLY HA2 H 1 4.692 0.020 . 1 . . . . . 7 GLY HA2 . 25170 3 30 . 3 . 3 7 7 GLY HA3 H 1 4.692 0.020 . 1 . . . . . 7 GLY HA3 . 25170 3 31 . 3 . 3 7 7 GLY CA C 13 42.479 0.3 . 1 . . . . . 7 GLY CA . 25170 3 32 . 3 . 3 7 7 GLY N N 15 108.634 0.3 . 1 . . . . . 7 GLY N . 25170 3 33 . 3 . 3 8 8 GLY H H 1 8.287 0.020 . 1 . . . . . 8 GLY H . 25170 3 34 . 3 . 3 8 8 GLY HA2 H 1 4.692 0.020 . 1 . . . . . 8 GLY HA2 . 25170 3 35 . 3 . 3 8 8 GLY HA3 H 1 4.692 0.020 . 1 . . . . . 8 GLY HA3 . 25170 3 36 . 3 . 3 8 8 GLY C C 13 171.438 0.3 . 1 . . . . . 8 GLY C . 25170 3 37 . 3 . 3 8 8 GLY CA C 13 42.466 0.3 . 1 . . . . . 8 GLY CA . 25170 3 38 . 3 . 3 8 8 GLY N N 15 108.693 0.3 . 1 . . . . . 8 GLY N . 25170 3 39 . 3 . 3 9 9 VAL H H 1 7.939 0.020 . 1 . . . . . 9 VAL H . 25170 3 40 . 3 . 3 9 9 VAL HA H 1 4.462 0.020 . 1 . . . . . 9 VAL HA . 25170 3 41 . 3 . 3 9 9 VAL CA C 13 59.463 0.3 . 1 . . . . . 9 VAL CA . 25170 3 42 . 3 . 3 9 9 VAL CB C 13 29.932 0.3 . 1 . . . . . 9 VAL CB . 25170 3 43 . 3 . 3 9 9 VAL N N 15 119.022 0.3 . 1 . . . . . 9 VAL N . 25170 3 44 . 3 . 3 10 10 ALA H H 1 8.309 0.020 . 1 . . . . . 10 ALA H . 25170 3 45 . 3 . 3 10 10 ALA HA H 1 4.676 0.020 . 1 . . . . . 10 ALA HA . 25170 3 46 . 3 . 3 10 10 ALA HB1 H 1 1.461 0.020 . 1 . . . . . 10 ALA HB . 25170 3 47 . 3 . 3 10 10 ALA HB2 H 1 1.461 0.020 . 1 . . . . . 10 ALA HB . 25170 3 48 . 3 . 3 10 10 ALA HB3 H 1 1.461 0.020 . 1 . . . . . 10 ALA HB . 25170 3 49 . 3 . 3 10 10 ALA C C 13 175.065 0.3 . 1 . . . . . 10 ALA C . 25170 3 50 . 3 . 3 10 10 ALA CA C 13 49.872 0.3 . 1 . . . . . 10 ALA CA . 25170 3 51 . 3 . 3 10 10 ALA CB C 13 16.258 0.3 . 1 . . . . . 10 ALA CB . 25170 3 52 . 3 . 3 10 10 ALA N N 15 126.257 0.3 . 1 . . . . . 10 ALA N . 25170 3 53 . 3 . 3 11 11 ALA H H 1 8.169 0.020 . 1 . . . . . 11 ALA H . 25170 3 54 . 3 . 3 11 11 ALA HA H 1 4.643 0.020 . 1 . . . . . 11 ALA HA . 25170 3 55 . 3 . 3 11 11 ALA HB1 H 1 1.412 0.020 . 1 . . . . . 11 ALA HB . 25170 3 56 . 3 . 3 11 11 ALA HB2 H 1 1.412 0.020 . 1 . . . . . 11 ALA HB . 25170 3 57 . 3 . 3 11 11 ALA HB3 H 1 1.412 0.020 . 1 . . . . . 11 ALA HB . 25170 3 58 . 3 . 3 11 11 ALA C C 13 174.777 0.3 . 1 . . . . . 11 ALA C . 25170 3 59 . 3 . 3 11 11 ALA CA C 13 49.493 0.3 . 1 . . . . . 11 ALA CA . 25170 3 60 . 3 . 3 11 11 ALA CB C 13 16.163 0.3 . 1 . . . . . 11 ALA CB . 25170 3 61 . 3 . 3 11 11 ALA N N 15 122.884 0.3 . 1 . . . . . 11 ALA N . 25170 3 62 . 3 . 3 12 12 ALA H H 1 8.139 0.020 . 1 . . . . . 12 ALA H . 25170 3 63 . 3 . 3 12 12 ALA HA H 1 4.676 0.020 . 1 . . . . . 12 ALA HA . 25170 3 64 . 3 . 3 12 12 ALA HB1 H 1 1.412 0.020 . 1 . . . . . 12 ALA HB . 25170 3 65 . 3 . 3 12 12 ALA HB2 H 1 1.412 0.020 . 1 . . . . . 12 ALA HB . 25170 3 66 . 3 . 3 12 12 ALA HB3 H 1 1.412 0.020 . 1 . . . . . 12 ALA HB . 25170 3 67 . 3 . 3 12 12 ALA C C 13 174.312 0.3 . 1 . . . . . 12 ALA C . 25170 3 68 . 3 . 3 12 12 ALA CA C 13 49.303 0.3 . 1 . . . . . 12 ALA CA . 25170 3 69 . 3 . 3 12 12 ALA CB C 13 16.353 0.3 . 1 . . . . . 12 ALA CB . 25170 3 70 . 3 . 3 12 12 ALA N N 15 123.411 0.3 . 1 . . . . . 12 ALA N . 25170 3 71 . 3 . 3 14 14 ALA H H 1 8.357 0.020 . 1 . . . . . 14 ALA H . 25170 3 72 . 3 . 3 14 14 ALA HA H 1 4.643 0.020 . 1 . . . . . 14 ALA HA . 25170 3 73 . 3 . 3 14 14 ALA HB1 H 1 1.395 0.020 . 1 . . . . . 14 ALA HB . 25170 3 74 . 3 . 3 14 14 ALA HB2 H 1 1.395 0.020 . 1 . . . . . 14 ALA HB . 25170 3 75 . 3 . 3 14 14 ALA HB3 H 1 1.395 0.020 . 1 . . . . . 14 ALA HB . 25170 3 76 . 3 . 3 14 14 ALA C C 13 175.623 0.3 . 1 . . . . . 14 ALA C . 25170 3 77 . 3 . 3 14 14 ALA CA C 13 49.682 0.3 . 1 . . . . . 14 ALA CA . 25170 3 78 . 3 . 3 14 14 ALA CB C 13 16.163 0.3 . 1 . . . . . 14 ALA CB . 25170 3 79 . 3 . 3 14 14 ALA N N 15 124.265 0.3 . 1 . . . . . 14 ALA N . 25170 3 80 . 3 . 3 15 15 GLY H H 1 8.304 0.020 . 1 . . . . . 15 GLY H . 25170 3 81 . 3 . 3 15 15 GLY HA2 H 1 4.692 0.020 . 1 . . . . . 15 GLY HA2 . 25170 3 82 . 3 . 3 15 15 GLY HA3 H 1 4.692 0.020 . 1 . . . . . 15 GLY HA3 . 25170 3 83 . 3 . 3 15 15 GLY C C 13 170.991 0.3 . 1 . . . . . 15 GLY C . 25170 3 84 . 3 . 3 15 15 GLY CA C 13 42.404 0.3 . 1 . . . . . 15 GLY CA . 25170 3 85 . 3 . 3 15 15 GLY N N 15 108.134 0.3 . 1 . . . . . 15 GLY N . 25170 3 86 . 3 . 3 16 16 ALA H H 1 8.051 0.020 . 1 . . . . . 16 ALA H . 25170 3 87 . 3 . 3 16 16 ALA HA H 1 4.659 0.020 . 1 . . . . . 16 ALA HA . 25170 3 88 . 3 . 3 16 16 ALA HB1 H 1 1.428 0.020 . 1 . . . . . 16 ALA HB . 25170 3 89 . 3 . 3 16 16 ALA HB2 H 1 1.428 0.020 . 1 . . . . . 16 ALA HB . 25170 3 90 . 3 . 3 16 16 ALA HB3 H 1 1.428 0.020 . 1 . . . . . 16 ALA HB . 25170 3 91 . 3 . 3 16 16 ALA C C 13 173.810 0.3 . 1 . . . . . 16 ALA C . 25170 3 92 . 3 . 3 16 16 ALA CA C 13 49.346 0.3 . 1 . . . . . 16 ALA CA . 25170 3 93 . 3 . 3 16 16 ALA CB C 13 16.543 0.3 . 1 . . . . . 16 ALA CB . 25170 3 94 . 3 . 3 16 16 ALA N N 15 123.907 0.3 . 1 . . . . . 16 ALA N . 25170 3 95 . 3 . 3 17 17 ALA H H 1 7.856 0.020 . 1 . . . . . 17 ALA H . 25170 3 96 . 3 . 3 17 17 ALA C C 13 179.698 0.3 . 1 . . . . . 17 ALA C . 25170 3 97 . 3 . 3 17 17 ALA CA C 13 50.442 0.3 . 1 . . . . . 17 ALA CA . 25170 3 98 . 3 . 3 17 17 ALA CB C 13 17.208 0.3 . 1 . . . . . 17 ALA CB . 25170 3 99 . 3 . 3 17 17 ALA N N 15 128.986 0.3 . 1 . . . . . 17 ALA N . 25170 3 100 . 3 . 3 19 19 VAL H H 1 7.997 0.020 . 1 . . . . . 19 VAL H . 25170 3 101 . 3 . 3 19 19 VAL HA H 1 4.115 0.020 . 1 . . . . . 19 VAL HA . 25170 3 102 . 3 . 3 19 19 VAL HB H 1 2.022 0.020 . 1 . . . . . 19 VAL HB . 25170 3 103 . 3 . 3 19 19 VAL C C 13 173.531 0.3 . 1 . . . . . 19 VAL C . 25170 3 104 . 3 . 3 19 19 VAL CA C 13 59.368 0.3 . 1 . . . . . 19 VAL CA . 25170 3 105 . 3 . 3 19 19 VAL CB C 13 29.552 0.3 . 1 . . . . . 19 VAL CB . 25170 3 106 . 3 . 3 19 19 VAL N N 15 119.105 0.3 . 1 . . . . . 19 VAL N . 25170 3 107 . 3 . 3 20 20 GLU H H 1 8.455 0.020 . 1 . . . . . 20 GLU H . 25170 3 108 . 3 . 3 20 20 GLU HA H 1 4.560 0.020 . 1 . . . . . 20 GLU HA . 25170 3 109 . 3 . 3 20 20 GLU HB2 H 1 2.104 0.020 . 1 . . . . . 20 GLU HB2 . 25170 3 110 . 3 . 3 20 20 GLU HB3 H 1 2.104 0.020 . 1 . . . . . 20 GLU HB3 . 25170 3 111 . 3 . 3 20 20 GLU C C 13 173.838 0.3 . 1 . . . . . 20 GLU C . 25170 3 112 . 3 . 3 20 20 GLU CA C 13 53.386 0.3 . 1 . . . . . 20 GLU CA . 25170 3 113 . 3 . 3 20 20 GLU CB C 13 30.691 0.3 . 1 . . . . . 20 GLU CB . 25170 3 114 . 3 . 3 20 20 GLU N N 15 124.382 0.3 . 1 . . . . . 20 GLU N . 25170 3 115 . 3 . 3 21 21 THR H H 1 8.120 0.020 . 1 . . . . . 21 THR H . 25170 3 116 . 3 . 3 21 21 THR HA H 1 4.511 0.020 . 1 . . . . . 21 THR HA . 25170 3 117 . 3 . 3 21 21 THR C C 13 171.828 0.3 . 1 . . . . . 21 THR C . 25170 3 118 . 3 . 3 21 21 THR CA C 13 58.608 0.3 . 1 . . . . . 21 THR CA . 25170 3 119 . 3 . 3 21 21 THR CB C 13 66.869 0.3 . 1 . . . . . 21 THR CB . 25170 3 120 . 3 . 3 21 21 THR N N 15 115.427 0.3 . 1 . . . . . 21 THR N . 25170 3 121 . 3 . 3 22 22 ALA H H 1 8.311 0.020 . 1 . . . . . 22 ALA H . 25170 3 122 . 3 . 3 22 22 ALA HA H 1 4.659 0.020 . 1 . . . . . 22 ALA HA . 25170 3 123 . 3 . 3 22 22 ALA HB1 H 1 1.379 0.020 . 1 . . . . . 22 ALA HB . 25170 3 124 . 3 . 3 22 22 ALA HB2 H 1 1.379 0.020 . 1 . . . . . 22 ALA HB . 25170 3 125 . 3 . 3 22 22 ALA HB3 H 1 1.379 0.020 . 1 . . . . . 22 ALA HB . 25170 3 126 . 3 . 3 22 22 ALA C C 13 174.424 0.3 . 1 . . . . . 22 ALA C . 25170 3 127 . 3 . 3 22 22 ALA CA C 13 49.303 0.3 . 1 . . . . . 22 ALA CA . 25170 3 128 . 3 . 3 22 22 ALA CB C 13 16.258 0.3 . 1 . . . . . 22 ALA CB . 25170 3 129 . 3 . 3 22 22 ALA N N 15 127.712 0.3 . 1 . . . . . 22 ALA N . 25170 3 130 . 3 . 3 23 23 GLU H H 1 8.283 0.020 . 1 . . . . . 23 GLU H . 25170 3 131 . 3 . 3 23 23 GLU HA H 1 4.577 0.020 . 1 . . . . . 23 GLU HA . 25170 3 132 . 3 . 3 23 23 GLU HB2 H 1 2.137 0.020 . 1 . . . . . 23 GLU HB2 . 25170 3 133 . 3 . 3 23 23 GLU HB3 H 1 2.137 0.020 . 1 . . . . . 23 GLU HB3 . 25170 3 134 . 3 . 3 23 23 GLU C C 13 173.419 0.3 . 1 . . . . . 23 GLU C . 25170 3 135 . 3 . 3 23 23 GLU CA C 13 53.827 0.3 . 1 . . . . . 23 GLU CA . 25170 3 136 . 3 . 3 23 23 GLU CB C 13 27.572 0.3 . 1 . . . . . 23 GLU CB . 25170 3 137 . 3 . 3 23 23 GLU N N 15 119.949 0.3 . 1 . . . . . 23 GLU N . 25170 3 138 . 3 . 3 24 24 ALA H H 1 8.171 0.020 . 1 . . . . . 24 ALA H . 25170 3 139 . 3 . 3 24 24 ALA HA H 1 4.676 0.020 . 1 . . . . . 24 ALA HA . 25170 3 140 . 3 . 3 24 24 ALA HB1 H 1 1.412 0.020 . 1 . . . . . 24 ALA HB . 25170 3 141 . 3 . 3 24 24 ALA HB2 H 1 1.412 0.020 . 1 . . . . . 24 ALA HB . 25170 3 142 . 3 . 3 24 24 ALA HB3 H 1 1.412 0.020 . 1 . . . . . 24 ALA HB . 25170 3 143 . 3 . 3 24 24 ALA C C 13 172.833 0.3 . 1 . . . . . 24 ALA C . 25170 3 144 . 3 . 3 24 24 ALA CA C 13 49.346 0.3 . 1 . . . . . 24 ALA CA . 25170 3 145 . 3 . 3 24 24 ALA CB C 13 15.783 0.3 . 1 . . . . . 24 ALA CB . 25170 3 146 . 3 . 3 24 24 ALA N N 15 125.150 0.3 . 1 . . . . . 24 ALA N . 25170 3 147 . 3 . 3 25 25 LYS H H 1 8.191 0.020 . 1 . . . . . 25 LYS H . 25170 3 148 . 3 . 3 25 25 LYS HA H 1 4.544 0.020 . 1 . . . . . 25 LYS HA . 25170 3 149 . 3 . 3 25 25 LYS HB2 H 1 1.708 0.020 . 1 . . . . . 25 LYS HB2 . 25170 3 150 . 3 . 3 25 25 LYS HB3 H 1 1.708 0.020 . 1 . . . . . 25 LYS HB3 . 25170 3 151 . 3 . 3 25 25 LYS C C 13 173.949 0.3 . 1 . . . . . 25 LYS C . 25170 3 152 . 3 . 3 25 25 LYS CA C 13 53.386 0.3 . 1 . . . . . 25 LYS CA . 25170 3 153 . 3 . 3 25 25 LYS CB C 13 29.837 0.3 . 1 . . . . . 25 LYS CB . 25170 3 154 . 3 . 3 25 25 LYS N N 15 120.815 0.3 . 1 . . . . . 25 LYS N . 25170 3 155 . 3 . 3 26 26 LYS H H 1 8.345 0.020 . 1 . . . . . 26 LYS H . 25170 3 156 . 3 . 3 26 26 LYS HA H 1 4.560 0.020 . 1 . . . . . 26 LYS HA . 25170 3 157 . 3 . 3 26 26 LYS HB2 H 1 1.725 0.020 . 1 . . . . . 26 LYS HB2 . 25170 3 158 . 3 . 3 26 26 LYS HB3 H 1 1.725 0.020 . 1 . . . . . 26 LYS HB3 . 25170 3 159 . 3 . 3 26 26 LYS C C 13 173.586 0.3 . 1 . . . . . 26 LYS C . 25170 3 160 . 3 . 3 26 26 LYS CA C 13 53.387 0.3 . 1 . . . . . 26 LYS CA . 25170 3 161 . 3 . 3 26 26 LYS CB C 13 29.647 0.3 . 1 . . . . . 26 LYS CB . 25170 3 162 . 3 . 3 26 26 LYS N N 15 123.258 0.3 . 1 . . . . . 26 LYS N . 25170 3 163 . 3 . 3 27 27 GLU H H 1 8.452 0.020 . 1 . . . . . 27 GLU H . 25170 3 164 . 3 . 3 27 27 GLU HA H 1 4.626 0.020 . 1 . . . . . 27 GLU HA . 25170 3 165 . 3 . 3 27 27 GLU HB2 H 1 2.137 0.020 . 1 . . . . . 27 GLU HB2 . 25170 3 166 . 3 . 3 27 27 GLU HB3 H 1 2.137 0.020 . 1 . . . . . 27 GLU HB3 . 25170 3 167 . 3 . 3 27 27 GLU C C 13 173.586 0.3 . 1 . . . . . 27 GLU C . 25170 3 168 . 3 . 3 27 27 GLU CA C 13 53.618 0.3 . 1 . . . . . 27 GLU CA . 25170 3 169 . 3 . 3 27 27 GLU CB C 13 27.741 0.3 . 1 . . . . . 27 GLU CB . 25170 3 170 . 3 . 3 27 27 GLU N N 15 122.123 0.3 . 1 . . . . . 27 GLU N . 25170 3 171 . 3 . 3 30 30 LYS H H 1 8.416 0.020 . 1 . . . . . 30 LYS H . 25170 3 172 . 3 . 3 30 30 LYS HA H 1 4.346 0.020 . 1 . . . . . 30 LYS HA . 25170 3 173 . 3 . 3 30 30 LYS HB2 H 1 2.120 0.020 . 1 . . . . . 30 LYS HB2 . 25170 3 174 . 3 . 3 30 30 LYS HB3 H 1 2.120 0.020 . 1 . . . . . 30 LYS HB3 . 25170 3 175 . 3 . 3 30 30 LYS C C 13 173.670 0.3 . 1 . . . . . 30 LYS C . 25170 3 176 . 3 . 3 30 30 LYS CA C 13 53.780 0.3 . 1 . . . . . 30 LYS CA . 25170 3 177 . 3 . 3 30 30 LYS CB C 13 27.048 0.3 . 1 . . . . . 30 LYS CB . 25170 3 178 . 3 . 3 30 30 LYS N N 15 120.935 0.3 . 1 . . . . . 30 LYS N . 25170 3 179 . 3 . 3 31 31 GLU H H 1 8.323 0.020 . 1 . . . . . 31 GLU H . 25170 3 180 . 3 . 3 31 31 GLU HA H 1 4.577 0.020 . 1 . . . . . 31 GLU HA . 25170 3 181 . 3 . 3 31 31 GLU HB2 H 1 2.401 0.020 . 1 . . . . . 31 GLU HB2 . 25170 3 182 . 3 . 3 31 31 GLU HB3 H 1 2.401 0.020 . 1 . . . . . 31 GLU HB3 . 25170 3 183 . 3 . 3 31 31 GLU C C 13 172.889 0.3 . 1 . . . . . 31 GLU C . 25170 3 184 . 3 . 3 31 31 GLU CA C 13 53.006 0.3 . 1 . . . . . 31 GLU CA . 25170 3 185 . 3 . 3 31 31 GLU CB C 13 27.558 0.3 . 1 . . . . . 31 GLU CB . 25170 3 186 . 3 . 3 31 31 GLU N N 15 122.135 0.3 . 1 . . . . . 31 GLU N . 25170 3 187 . 3 . 3 32 32 GLU H H 1 8.319 0.020 . 1 . . . . . 32 GLU H . 25170 3 188 . 3 . 3 32 32 GLU HA H 1 4.593 0.020 . 1 . . . . . 32 GLU HA . 25170 3 189 . 3 . 3 32 32 GLU HB2 H 1 1.659 0.020 . 1 . . . . . 32 GLU HB2 . 25170 3 190 . 3 . 3 32 32 GLU HB3 H 1 1.659 0.020 . 1 . . . . . 32 GLU HB3 . 25170 3 191 . 3 . 3 32 32 GLU C C 13 173.586 0.3 . 1 . . . . . 32 GLU C . 25170 3 192 . 3 . 3 32 32 GLU CA C 13 53.291 0.3 . 1 . . . . . 32 GLU CA . 25170 3 193 . 3 . 3 32 32 GLU CB C 13 29.932 0.3 . 1 . . . . . 32 GLU CB . 25170 3 194 . 3 . 3 32 32 GLU N N 15 123.258 0.3 . 1 . . . . . 32 GLU N . 25170 3 195 . 3 . 3 33 33 LYS H H 1 8.443 0.020 . 1 . . . . . 33 LYS H . 25170 3 196 . 3 . 3 33 33 LYS HA H 1 4.511 0.020 . 1 . . . . . 33 LYS HA . 25170 3 197 . 3 . 3 33 33 LYS HB2 H 1 1.708 0.020 . 1 . . . . . 33 LYS HB2 . 25170 3 198 . 3 . 3 33 33 LYS HB3 H 1 1.708 0.020 . 1 . . . . . 33 LYS HB3 . 25170 3 199 . 3 . 3 33 33 LYS C C 13 173.838 0.3 . 1 . . . . . 33 LYS C . 25170 3 200 . 3 . 3 33 33 LYS CA C 13 53.386 0.3 . 1 . . . . . 33 LYS CA . 25170 3 201 . 3 . 3 33 33 LYS CB C 13 30.217 0.3 . 1 . . . . . 33 LYS CB . 25170 3 202 . 3 . 3 33 33 LYS N N 15 124.207 0.3 . 1 . . . . . 33 LYS N . 25170 3 203 . 3 . 3 34 34 LYS H H 1 8.204 0.020 . 1 . . . . . 34 LYS H . 25170 3 204 . 3 . 3 34 34 LYS HA H 1 4.659 0.020 . 1 . . . . . 34 LYS HA . 25170 3 205 . 3 . 3 34 34 LYS HB2 H 1 1.510 0.020 . 1 . . . . . 34 LYS HB2 . 25170 3 206 . 3 . 3 34 34 LYS HB3 H 1 1.510 0.020 . 1 . . . . . 34 LYS HB3 . 25170 3 207 . 3 . 3 34 34 LYS C C 13 174.703 0.3 . 1 . . . . . 34 LYS C . 25170 3 208 . 3 . 3 34 34 LYS CA C 13 51.961 0.3 . 1 . . . . . 34 LYS CA . 25170 3 209 . 3 . 3 34 34 LYS CB C 13 39.332 0.3 . 1 . . . . . 34 LYS CB . 25170 3 210 . 3 . 3 34 34 LYS N N 15 122.966 0.3 . 1 . . . . . 34 LYS N . 25170 3 211 . 3 . 3 35 35 GLU H H 1 8.253 0.020 . 1 . . . . . 35 GLU H . 25170 3 212 . 3 . 3 35 35 GLU HA H 1 4.659 0.020 . 1 . . . . . 35 GLU HA . 25170 3 213 . 3 . 3 35 35 GLU HB2 H 1 2.351 0.020 . 1 . . . . . 35 GLU HB2 . 25170 3 214 . 3 . 3 35 35 GLU HB3 H 1 2.351 0.020 . 1 . . . . . 35 GLU HB3 . 25170 3 215 . 3 . 3 35 35 GLU C C 13 174.061 0.3 . 1 . . . . . 35 GLU C . 25170 3 216 . 3 . 3 35 35 GLU CA C 13 53.101 0.3 . 1 . . . . . 35 GLU CA . 25170 3 217 . 3 . 3 35 35 GLU CB C 13 26.988 0.3 . 1 . . . . . 35 GLU CB . 25170 3 218 . 3 . 3 35 35 GLU N N 15 120.570 0.3 . 1 . . . . . 35 GLU N . 25170 3 219 . 3 . 3 36 36 GLU H H 1 8.028 0.020 . 1 . . . . . 36 GLU H . 25170 3 220 . 3 . 3 36 36 GLU HA H 1 4.132 0.020 . 1 . . . . . 36 GLU HA . 25170 3 221 . 3 . 3 36 36 GLU HB2 H 1 2.318 0.020 . 1 . . . . . 36 GLU HB2 . 25170 3 222 . 3 . 3 36 36 GLU HB3 H 1 2.318 0.020 . 1 . . . . . 36 GLU HB3 . 25170 3 223 . 3 . 3 36 36 GLU C C 13 178.442 0.3 . 1 . . . . . 36 GLU C . 25170 3 224 . 3 . 3 36 36 GLU CA C 13 55.050 0.3 . 1 . . . . . 36 GLU CA . 25170 3 225 . 3 . 3 36 36 GLU CB C 13 28.507 0.3 . 1 . . . . . 36 GLU CB . 25170 3 226 . 3 . 3 36 36 GLU N N 15 127.303 0.3 . 1 . . . . . 36 GLU N . 25170 3 227 . 3 . 3 37 37 GLU H H 1 8.188 0.020 . 1 . . . . . 37 GLU H . 25170 3 228 . 3 . 3 37 37 GLU HA H 1 4.577 0.020 . 1 . . . . . 37 GLU HA . 25170 3 229 . 3 . 3 37 37 GLU HB2 H 1 1.758 0.020 . 1 . . . . . 37 GLU HB2 . 25170 3 230 . 3 . 3 37 37 GLU HB3 H 1 1.758 0.020 . 1 . . . . . 37 GLU HB3 . 25170 3 231 . 3 . 3 37 37 GLU C C 13 173.559 0.3 . 1 . . . . . 37 GLU C . 25170 3 232 . 3 . 3 37 37 GLU CA C 13 52.816 0.3 . 1 . . . . . 37 GLU CA . 25170 3 233 . 3 . 3 37 37 GLU CB C 13 30.027 0.3 . 1 . . . . . 37 GLU CB . 25170 3 234 . 3 . 3 37 37 GLU N N 15 121.889 0.3 . 1 . . . . . 37 GLU N . 25170 3 235 . 3 . 3 38 38 GLU H H 1 8.367 0.020 . 1 . . . . . 38 GLU H . 25170 3 236 . 3 . 3 38 38 GLU HA H 1 4.527 0.020 . 1 . . . . . 38 GLU HA . 25170 3 237 . 3 . 3 38 38 GLU HB2 H 1 2.120 0.020 . 1 . . . . . 38 GLU HB2 . 25170 3 238 . 3 . 3 38 38 GLU HB3 H 1 2.120 0.020 . 1 . . . . . 38 GLU HB3 . 25170 3 239 . 3 . 3 38 38 GLU C C 13 173.586 0.3 . 1 . . . . . 38 GLU C . 25170 3 240 . 3 . 3 38 38 GLU CA C 13 53.321 0.3 . 1 . . . . . 38 GLU CA . 25170 3 241 . 3 . 3 38 38 GLU CB C 13 27.380 0.3 . 1 . . . . . 38 GLU CB . 25170 3 242 . 3 . 3 38 38 GLU N N 15 122.638 0.3 . 1 . . . . . 38 GLU N . 25170 3 243 . 3 . 3 39 39 GLU H H 1 8.351 0.020 . 1 . . . . . 39 GLU H . 25170 3 244 . 3 . 3 39 39 GLU HA H 1 4.494 0.020 . 1 . . . . . 39 GLU HA . 25170 3 245 . 3 . 3 39 39 GLU HB2 H 1 2.186 0.020 . 1 . . . . . 39 GLU HB2 . 25170 3 246 . 3 . 3 39 39 GLU HB3 H 1 2.186 0.020 . 1 . . . . . 39 GLU HB3 . 25170 3 247 . 3 . 3 39 39 GLU C C 13 173.475 0.3 . 1 . . . . . 39 GLU C . 25170 3 248 . 3 . 3 39 39 GLU CA C 13 53.481 0.3 . 1 . . . . . 39 GLU CA . 25170 3 249 . 3 . 3 39 39 GLU CB C 13 27.653 0.3 . 1 . . . . . 39 GLU CB . 25170 3 250 . 3 . 3 39 39 GLU N N 15 122.018 0.3 . 1 . . . . . 39 GLU N . 25170 3 251 . 3 . 3 41 41 GLU H H 1 8.536 0.020 . 1 . . . . . 41 GLU H . 25170 3 252 . 3 . 3 41 41 GLU HA H 1 4.560 0.020 . 1 . . . . . 41 GLU HA . 25170 3 253 . 3 . 3 41 41 GLU HB2 H 1 2.137 0.020 . 1 . . . . . 41 GLU HB2 . 25170 3 254 . 3 . 3 41 41 GLU HB3 H 1 2.137 0.020 . 1 . . . . . 41 GLU HB3 . 25170 3 255 . 3 . 3 41 41 GLU C C 13 173.586 0.3 . 1 . . . . . 41 GLU C . 25170 3 256 . 3 . 3 41 41 GLU CA C 13 53.955 0.3 . 1 . . . . . 41 GLU CA . 25170 3 257 . 3 . 3 41 41 GLU CB C 13 27.273 0.3 . 1 . . . . . 41 GLU CB . 25170 3 258 . 3 . 3 41 41 GLU N N 15 122.603 0.3 . 1 . . . . . 41 GLU N . 25170 3 259 . 3 . 3 42 42 ASP H H 1 8.321 0.020 . 1 . . . . . 42 ASP H . 25170 3 260 . 3 . 3 42 42 ASP HA H 1 4.363 0.020 . 1 . . . . . 42 ASP HA . 25170 3 261 . 3 . 3 42 42 ASP HB2 H 1 2.137 0.020 . 1 . . . . . 42 ASP HB2 . 25170 3 262 . 3 . 3 42 42 ASP HB3 H 1 2.137 0.020 . 1 . . . . . 42 ASP HB3 . 25170 3 263 . 3 . 3 42 42 ASP C C 13 173.670 0.3 . 1 . . . . . 42 ASP C . 25170 3 264 . 3 . 3 42 42 ASP CA C 13 53.324 0.3 . 1 . . . . . 42 ASP CA . 25170 3 265 . 3 . 3 42 42 ASP CB C 13 38.383 0.3 . 1 . . . . . 42 ASP CB . 25170 3 266 . 3 . 3 42 42 ASP N N 15 121.409 0.3 . 1 . . . . . 42 ASP N . 25170 3 267 . 3 . 3 43 43 ASP H H 1 8.328 0.020 . 1 . . . . . 43 ASP H . 25170 3 268 . 3 . 3 43 43 ASP HA H 1 4.429 0.020 . 1 . . . . . 43 ASP HA . 25170 3 269 . 3 . 3 43 43 ASP HB2 H 1 2.269 0.020 . 1 . . . . . 43 ASP HB2 . 25170 3 270 . 3 . 3 43 43 ASP HB3 H 1 2.269 0.020 . 1 . . . . . 43 ASP HB3 . 25170 3 271 . 3 . 3 43 43 ASP C C 13 173.670 0.3 . 1 . . . . . 43 ASP C . 25170 3 272 . 3 . 3 43 43 ASP CA C 13 51.185 0.3 . 1 . . . . . 43 ASP CA . 25170 3 273 . 3 . 3 43 43 ASP CB C 13 38.003 0.3 . 1 . . . . . 43 ASP CB . 25170 3 274 . 3 . 3 43 43 ASP N N 15 121.151 0.3 . 1 . . . . . 43 ASP N . 25170 3 275 . 3 . 3 44 44 LEU H H 1 8.258 0.020 . 1 . . . . . 44 LEU H . 25170 3 276 . 3 . 3 44 44 LEU HA H 1 4.396 0.020 . 1 . . . . . 44 LEU HA . 25170 3 277 . 3 . 3 44 44 LEU HB2 H 1 1.692 0.020 . 1 . . . . . 44 LEU HB2 . 25170 3 278 . 3 . 3 44 44 LEU HB3 H 1 1.692 0.020 . 1 . . . . . 44 LEU HB3 . 25170 3 279 . 3 . 3 44 44 LEU C C 13 175.317 0.3 . 1 . . . . . 44 LEU C . 25170 3 280 . 3 . 3 44 44 LEU CA C 13 52.436 0.3 . 1 . . . . . 44 LEU CA . 25170 3 281 . 3 . 3 44 44 LEU CB C 13 38.953 0.3 . 1 . . . . . 44 LEU CB . 25170 3 282 . 3 . 3 44 44 LEU N N 15 122.591 0.3 . 1 . . . . . 44 LEU N . 25170 3 283 . 3 . 3 45 45 GLY H H 1 8.332 0.020 . 1 . . . . . 45 GLY H . 25170 3 284 . 3 . 3 45 45 GLY HA2 H 1 4.725 0.020 . 1 . . . . . 45 GLY HA2 . 25170 3 285 . 3 . 3 45 45 GLY HA3 H 1 4.725 0.020 . 1 . . . . . 45 GLY HA3 . 25170 3 286 . 3 . 3 45 45 GLY C C 13 171.187 0.3 . 1 . . . . . 45 GLY C . 25170 3 287 . 3 . 3 45 45 GLY CA C 13 42.751 0.3 . 1 . . . . . 45 GLY CA . 25170 3 288 . 3 . 3 45 45 GLY N N 15 108.175 0.3 . 1 . . . . . 45 GLY N . 25170 3 289 . 3 . 3 46 46 PHE H H 1 7.903 0.020 . 1 . . . . . 46 PHE H . 25170 3 290 . 3 . 3 46 46 PHE HA H 1 4.659 0.020 . 1 . . . . . 46 PHE HA . 25170 3 291 . 3 . 3 46 46 PHE HB2 H 1 3.093 0.020 . 1 . . . . . 46 PHE HB2 . 25170 3 292 . 3 . 3 46 46 PHE HB3 H 1 3.093 0.020 . 1 . . . . . 46 PHE HB3 . 25170 3 293 . 3 . 3 46 46 PHE C C 13 173.224 0.3 . 1 . . . . . 46 PHE C . 25170 3 294 . 3 . 3 46 46 PHE CA C 13 55.570 0.3 . 1 . . . . . 46 PHE CA . 25170 3 295 . 3 . 3 46 46 PHE CB C 13 36.484 0.3 . 1 . . . . . 46 PHE CB . 25170 3 296 . 3 . 3 46 46 PHE N N 15 119.635 0.3 . 1 . . . . . 46 PHE N . 25170 3 297 . 3 . 3 47 47 SER H H 1 8.151 0.020 . 1 . . . . . 47 SER H . 25170 3 298 . 3 . 3 47 47 SER HA H 1 4.626 0.020 . 1 . . . . . 47 SER HA . 25170 3 299 . 3 . 3 47 47 SER CA C 13 54.825 0.3 . 1 . . . . . 47 SER CA . 25170 3 300 . 3 . 3 47 47 SER CB C 13 60.982 0.3 . 1 . . . . . 47 SER CB . 25170 3 301 . 3 . 3 47 47 SER N N 15 117.001 0.3 . 1 . . . . . 47 SER N . 25170 3 302 . 3 . 3 48 48 LEU H H 1 8.051 0.020 . 1 . . . . . 48 LEU H . 25170 3 303 . 3 . 3 48 48 LEU HA H 1 4.643 0.020 . 1 . . . . . 48 LEU HA . 25170 3 304 . 3 . 3 48 48 LEU HB2 H 1 1.412 0.020 . 1 . . . . . 48 LEU HB2 . 25170 3 305 . 3 . 3 48 48 LEU HB3 H 1 1.412 0.020 . 1 . . . . . 48 LEU HB3 . 25170 3 306 . 3 . 3 48 48 LEU C C 13 174.758 0.3 . 1 . . . . . 48 LEU C . 25170 3 307 . 3 . 3 48 48 LEU CA C 13 52.536 0.3 . 1 . . . . . 48 LEU CA . 25170 3 308 . 3 . 3 48 48 LEU CB C 13 42.276 0.3 . 1 . . . . . 48 LEU CB . 25170 3 309 . 3 . 3 48 48 LEU N N 15 124.210 0.3 . 1 . . . . . 48 LEU N . 25170 3 310 . 3 . 3 49 49 PHE H H 1 8.016 0.020 . 1 . . . . . 49 PHE H . 25170 3 311 . 3 . 3 49 49 PHE HA H 1 4.659 0.020 . 1 . . . . . 49 PHE HA . 25170 3 312 . 3 . 3 49 49 PHE HB2 H 1 3.110 0.020 . 1 . . . . . 49 PHE HB2 . 25170 3 313 . 3 . 3 49 49 PHE HB3 H 1 3.110 0.020 . 1 . . . . . 49 PHE HB3 . 25170 3 314 . 3 . 3 49 49 PHE C C 13 173.614 0.3 . 1 . . . . . 49 PHE C . 25170 3 315 . 3 . 3 49 49 PHE CA C 13 54.335 0.3 . 1 . . . . . 49 PHE CA . 25170 3 316 . 3 . 3 49 49 PHE CB C 13 36.958 0.3 . 1 . . . . . 49 PHE CB . 25170 3 317 . 3 . 3 49 49 PHE N N 15 119.360 0.3 . 1 . . . . . 49 PHE N . 25170 3 318 . 3 . 3 50 50 GLY H H 1 7.746 0.020 . 1 . . . . . 50 GLY H . 25170 3 319 . 3 . 3 50 50 GLY HA2 H 1 4.692 0.020 . 1 . . . . . 50 GLY HA2 . 25170 3 320 . 3 . 3 50 50 GLY HA3 H 1 4.692 0.020 . 1 . . . . . 50 GLY HA3 . 25170 3 321 . 3 . 3 50 50 GLY C C 13 176.209 0.3 . 1 . . . . . 50 GLY C . 25170 3 322 . 3 . 3 50 50 GLY CA C 13 43.415 0.3 . 1 . . . . . 50 GLY CA . 25170 3 323 . 3 . 3 50 50 GLY N N 15 115.962 0.3 . 1 . . . . . 50 GLY N . 25170 3 stop_ save_