data_15437 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 15437 _Entry.Title ; Assignment, structure, and dynamics of de novo designed protein S836 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2007-08-16 _Entry.Accession_date 2007-08-16 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.0.8.109 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Abigail Go . . . 15437 2 Seho Kim . . . 15437 3 Jean Baum . S. . 15437 4 Michael Hecht . H. . 15437 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 15437 heteronucl_NOEs 2 15437 heteronucl_T1_relaxation 2 15437 heteronucl_T2_relaxation 2 15437 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 414 15437 '15N chemical shifts' 121 15437 '1H chemical shifts' 719 15437 'heteronuclear NOE values' 198 15437 'T1 relaxation values' 198 15437 'T2 relaxation values' 198 15437 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 2 . . 2009-08-12 2007-08-16 update BMRB 'complete entry citation' 15437 1 . . 2008-01-28 2007-08-16 original author 'original release' 15437 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 5687 'sibling protein S824' 15437 PDB 1p68 'sibling protein S824' 15437 PDB 2JUA 'BMRB Entry Tracking System' 15437 stop_ save_ ############### # Citations # ############### save_structure_and_dynamics _Citation.Sf_category citations _Citation.Sf_framecode structure_and_dynamics _Citation.Entry_ID 15437 _Citation.ID 1 _Citation.Class 'reference citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title 'Structure and Dynamics of Proteins from Designed Combinatorial Libraries' _Citation.Status 'in preparation' _Citation.Type journal _Citation.Journal_abbrev 'Protein Sci.' _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first . _Citation.Page_last . _Citation.Year . _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Abigail Go . . . 15437 1 2 Seho Kim . . . 15437 1 3 Jean Baum . S. . 15437 1 4 Michael Hecht . H. . 15437 1 stop_ save_ save_sequential_assignment _Citation.Sf_category citations _Citation.Sf_framecode sequential_assignment _Citation.Entry_ID 15437 _Citation.ID 2 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 19636868 _Citation.Full_citation . _Citation.Title 'NMR assignment of S836: a de novo protein from a designed superfamily' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assignments' _Citation.Journal_name_full . _Citation.Journal_volume 1 _Citation.Journal_issue 2 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 213 _Citation.Page_last 215 _Citation.Year 2007 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Abigail Go . . . 15437 2 2 Seho Kim . . . 15437 2 3 Michael Hecht . . . 15437 2 4 Jean Baum . . . 15437 2 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 15437 _Assembly.ID 1 _Assembly.Name 'S836 monomer' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds no _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 'S836 monomer' 1 $S836 A . yes native no no . . . 15437 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_S836 _Entity.Sf_category entity _Entity.Sf_framecode S836 _Entity.Entry_ID 15437 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name S836 _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 ; MYGKLNDLLEDLQEVLKHVN QHWQGGQKNMNKVDHHLQNV IEDIHDFMQGGGSGGKLQEM MKEFQQVLDEIKQQLQGGDN SLHNVHENIKEIFHHLEELV HR ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states yes _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 102 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID 1 _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 'Ambiguous conformational states: Y2, Q24, and N84 register possible alternate alpha carbon chemical shifts' _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2014-05-12 loop_ _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID no PDB 2JUA . "Assignment, Structure, And Dynamics Of De Novo Designed Protein S836" . . . . . 100.00 102 100.00 100.00 8.80e-63 . . . . 15437 1 stop_ loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID 'de novo designed protein' 15437 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . MET . 15437 1 2 . TYR . 15437 1 3 . GLY . 15437 1 4 . LYS . 15437 1 5 . LEU . 15437 1 6 . ASN . 15437 1 7 . ASP . 15437 1 8 . LEU . 15437 1 9 . LEU . 15437 1 10 . GLU . 15437 1 11 . ASP . 15437 1 12 . LEU . 15437 1 13 . GLN . 15437 1 14 . GLU . 15437 1 15 . VAL . 15437 1 16 . LEU . 15437 1 17 . LYS . 15437 1 18 . HIS . 15437 1 19 . VAL . 15437 1 20 . ASN . 15437 1 21 . GLN . 15437 1 22 . HIS . 15437 1 23 . TRP . 15437 1 24 . GLN . 15437 1 25 . GLY . 15437 1 26 . GLY . 15437 1 27 . GLN . 15437 1 28 . LYS . 15437 1 29 . ASN . 15437 1 30 . MET . 15437 1 31 . ASN . 15437 1 32 . LYS . 15437 1 33 . VAL . 15437 1 34 . ASP . 15437 1 35 . HIS . 15437 1 36 . HIS . 15437 1 37 . LEU . 15437 1 38 . GLN . 15437 1 39 . ASN . 15437 1 40 . VAL . 15437 1 41 . ILE . 15437 1 42 . GLU . 15437 1 43 . ASP . 15437 1 44 . ILE . 15437 1 45 . HIS . 15437 1 46 . ASP . 15437 1 47 . PHE . 15437 1 48 . MET . 15437 1 49 . GLN . 15437 1 50 . GLY . 15437 1 51 . GLY . 15437 1 52 . GLY . 15437 1 53 . SER . 15437 1 54 . GLY . 15437 1 55 . GLY . 15437 1 56 . LYS . 15437 1 57 . LEU . 15437 1 58 . GLN . 15437 1 59 . GLU . 15437 1 60 . MET . 15437 1 61 . MET . 15437 1 62 . LYS . 15437 1 63 . GLU . 15437 1 64 . PHE . 15437 1 65 . GLN . 15437 1 66 . GLN . 15437 1 67 . VAL . 15437 1 68 . LEU . 15437 1 69 . ASP . 15437 1 70 . GLU . 15437 1 71 . ILE . 15437 1 72 . LYS . 15437 1 73 . GLN . 15437 1 74 . GLN . 15437 1 75 . LEU . 15437 1 76 . GLN . 15437 1 77 . GLY . 15437 1 78 . GLY . 15437 1 79 . ASP . 15437 1 80 . ASN . 15437 1 81 . SER . 15437 1 82 . LEU . 15437 1 83 . HIS . 15437 1 84 . ASN . 15437 1 85 . VAL . 15437 1 86 . HIS . 15437 1 87 . GLU . 15437 1 88 . ASN . 15437 1 89 . ILE . 15437 1 90 . LYS . 15437 1 91 . GLU . 15437 1 92 . ILE . 15437 1 93 . PHE . 15437 1 94 . HIS . 15437 1 95 . HIS . 15437 1 96 . LEU . 15437 1 97 . GLU . 15437 1 98 . GLU . 15437 1 99 . LEU . 15437 1 100 . VAL . 15437 1 101 . HIS . 15437 1 102 . ARG . 15437 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 15437 1 . TYR 2 2 15437 1 . GLY 3 3 15437 1 . LYS 4 4 15437 1 . LEU 5 5 15437 1 . ASN 6 6 15437 1 . ASP 7 7 15437 1 . LEU 8 8 15437 1 . LEU 9 9 15437 1 . GLU 10 10 15437 1 . ASP 11 11 15437 1 . LEU 12 12 15437 1 . GLN 13 13 15437 1 . GLU 14 14 15437 1 . VAL 15 15 15437 1 . LEU 16 16 15437 1 . LYS 17 17 15437 1 . HIS 18 18 15437 1 . VAL 19 19 15437 1 . ASN 20 20 15437 1 . GLN 21 21 15437 1 . HIS 22 22 15437 1 . TRP 23 23 15437 1 . GLN 24 24 15437 1 . GLY 25 25 15437 1 . GLY 26 26 15437 1 . GLN 27 27 15437 1 . LYS 28 28 15437 1 . ASN 29 29 15437 1 . MET 30 30 15437 1 . ASN 31 31 15437 1 . LYS 32 32 15437 1 . VAL 33 33 15437 1 . ASP 34 34 15437 1 . HIS 35 35 15437 1 . HIS 36 36 15437 1 . LEU 37 37 15437 1 . GLN 38 38 15437 1 . ASN 39 39 15437 1 . VAL 40 40 15437 1 . ILE 41 41 15437 1 . GLU 42 42 15437 1 . ASP 43 43 15437 1 . ILE 44 44 15437 1 . HIS 45 45 15437 1 . ASP 46 46 15437 1 . PHE 47 47 15437 1 . MET 48 48 15437 1 . GLN 49 49 15437 1 . GLY 50 50 15437 1 . GLY 51 51 15437 1 . GLY 52 52 15437 1 . SER 53 53 15437 1 . GLY 54 54 15437 1 . GLY 55 55 15437 1 . LYS 56 56 15437 1 . LEU 57 57 15437 1 . GLN 58 58 15437 1 . GLU 59 59 15437 1 . MET 60 60 15437 1 . MET 61 61 15437 1 . LYS 62 62 15437 1 . GLU 63 63 15437 1 . PHE 64 64 15437 1 . GLN 65 65 15437 1 . GLN 66 66 15437 1 . VAL 67 67 15437 1 . LEU 68 68 15437 1 . ASP 69 69 15437 1 . GLU 70 70 15437 1 . ILE 71 71 15437 1 . LYS 72 72 15437 1 . GLN 73 73 15437 1 . GLN 74 74 15437 1 . LEU 75 75 15437 1 . GLN 76 76 15437 1 . GLY 77 77 15437 1 . GLY 78 78 15437 1 . ASP 79 79 15437 1 . ASN 80 80 15437 1 . SER 81 81 15437 1 . LEU 82 82 15437 1 . HIS 83 83 15437 1 . ASN 84 84 15437 1 . VAL 85 85 15437 1 . HIS 86 86 15437 1 . GLU 87 87 15437 1 . ASN 88 88 15437 1 . ILE 89 89 15437 1 . LYS 90 90 15437 1 . GLU 91 91 15437 1 . ILE 92 92 15437 1 . PHE 93 93 15437 1 . HIS 94 94 15437 1 . HIS 95 95 15437 1 . LEU 96 96 15437 1 . GLU 97 97 15437 1 . GLU 98 98 15437 1 . LEU 99 99 15437 1 . VAL 100 100 15437 1 . HIS 101 101 15437 1 . ARG 102 102 15437 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 15437 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Subvariant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $S836 . . 'not applicable' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 15437 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 15437 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $S836 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli 'BL21 (DE3)' . . . . . . . . . . . . . . . pet3A . . . . . . 15437 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 15437 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number 3 _Sample.Solvent_system . _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 S836 [U-15N] . . 1 $S836 . . . 1 2 mM . . . . 15437 1 2 D2O [U-2H] . . . . . . 10 . . % . . . . 15437 1 3 'acetic acid - sodium acetate' 'natural abundance' . . . . . . 50 . . mM . . . . 15437 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 15437 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number 4 _Sample.Solvent_system . _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 S836 '[U-13C; U-15N]' . . 1 $S836 . . 2 . . mM . . . . 15437 2 2 D2O [U-2H] . . . . . . 10 . . % . . . . 15437 2 3 'acetic acid - sodium acetate' [U-13C] . . . . . . 50 . . mM . . . . 15437 2 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 15437 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 4 . pH 15437 1 pressure 1 . atm 15437 1 temperature 298 . K 15437 1 stop_ save_ ############################ # Computer software used # ############################ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 15437 _Software.ID 1 _Software.Name NMRPipe _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 15437 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 15437 1 stop_ save_ save_SPARKY _Software.Sf_category software _Software.Sf_framecode SPARKY _Software.Entry_ID 15437 _Software.ID 2 _Software.Name SPARKY _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . 15437 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 15437 2 'data analysis' 15437 2 'peak picking' 15437 2 stop_ save_ save_NMRDraw _Software.Sf_category software _Software.Sf_framecode NMRDraw _Software.Entry_ID 15437 _Software.ID 3 _Software.Name NMRDraw _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 15437 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 15437 3 stop_ save_ save_X-PLOR_NIH _Software.Sf_category software _Software.Sf_framecode X-PLOR_NIH _Software.Entry_ID 15437 _Software.ID 4 _Software.Name 'X-PLOR NIH' _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Schwieters, Kuszewski, Tjandra and Clore' . . 15437 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 15437 4 'structure solution' 15437 4 stop_ save_ save_AQUA _Software.Sf_category software _Software.Sf_framecode AQUA _Software.Entry_ID 15437 _Software.ID 5 _Software.Name AQUA _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Rullmann, Doreleijers and Kaptein' . . 15437 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID validation 15437 5 stop_ save_ save_ProcheckNMR _Software.Sf_category software _Software.Sf_framecode ProcheckNMR _Software.Entry_ID 15437 _Software.ID 6 _Software.Name ProcheckNMR _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Laskowski and MacArthur' . . 15437 6 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID validation 15437 6 stop_ save_ save_Molmol _Software.Sf_category software _Software.Sf_framecode Molmol _Software.Entry_ID 15437 _Software.ID 7 _Software.Name Molmol _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Koradi, Billeter and Wuthrich' . . 15437 7 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structural visualization' 15437 7 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 15437 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 15437 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 500 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 15437 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Varian INOVA . 600 . . . 15437 1 2 spectrometer_2 Varian INOVA . 500 . . . 15437 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 15437 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15437 1 2 '2D 1H-13C HSQC' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15437 1 3 '3D CBCA(CO)NH' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15437 1 4 '3D C(CO)NH' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15437 1 5 '3D HNCO' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15437 1 6 '3D HNCA' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15437 1 7 '3D HNCACB' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15437 1 8 '3D H(CCO)NH' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15437 1 9 '3D HCCH-TOCSY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15437 1 10 '3D HNHA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15437 1 11 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15437 1 12 '3D 1H-15N TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15437 1 13 '3D 1H-13C NOESY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15437 1 14 '3D (HCA)CO(CA)NH' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15437 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 15437 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 . indirect 0.251449530 . . . . . . . . . 15437 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 15437 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 . indirect 0.101329118 . . . . . . . . . 15437 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 15437 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err 0.02 _Assigned_chem_shift_list.Chem_shift_13C_err 0.2 _Assigned_chem_shift_list.Chem_shift_15N_err 0.2 _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' . . . 15437 1 5 '3D HNCO' . . . 15437 1 6 '3D HNCA' . . . 15437 1 7 '3D HNCACB' . . . 15437 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 MET HA H 1 4.01 0.02 . 1 . . . . 1 MET HA . 15437 1 2 . 1 1 1 1 MET HB2 H 1 2.019 0.02 . 2 . . . . 1 MET HB2 . 15437 1 3 . 1 1 1 1 MET HB3 H 1 2.019 0.02 . 2 . . . . 1 MET HB3 . 15437 1 4 . 1 1 1 1 MET HG2 H 1 2.422 0.02 . 2 . . . . 1 MET HG2 . 15437 1 5 . 1 1 1 1 MET HG3 H 1 2.422 0.02 . 2 . . . . 1 MET HG3 . 15437 1 6 . 1 1 1 1 MET C C 13 172 0.2 . 1 . . . . 1 MET C . 15437 1 7 . 1 1 1 1 MET CA C 13 55.09 0.2 . 1 . . . . 1 MET CA . 15437 1 8 . 1 1 1 1 MET CB C 13 32.98 0.2 . 1 . . . . 1 MET CB . 15437 1 9 . 1 1 1 1 MET CG C 13 30.8 0.2 . 1 . . . . 1 MET CG . 15437 1 10 . 1 1 2 2 TYR H H 1 8.688 0.02 . 1 . . . . 2 TYR HN . 15437 1 11 . 1 1 2 2 TYR HA H 1 4.737 0.02 . 1 . . . . 2 TYR HA . 15437 1 12 . 1 1 2 2 TYR HB2 H 1 3.017 0.02 . 2 . . . . 2 TYR HB2 . 15437 1 13 . 1 1 2 2 TYR HB3 H 1 2.961 0.02 . 2 . . . . 2 TYR HB3 . 15437 1 14 . 1 1 2 2 TYR HD1 H 1 7.038 0.02 . 3 . . . . 2 TYR HD1 . 15437 1 15 . 1 1 2 2 TYR HD2 H 1 7.038 0.02 . 3 . . . . 2 TYR HD2 . 15437 1 16 . 1 1 2 2 TYR C C 13 175.9 0.2 . 1 . . . . 2 TYR C . 15437 1 17 . 1 1 2 2 TYR CA C 13 57.92 0.2 . 1 . . . . 2 TYR CA . 15437 1 18 . 1 1 2 2 TYR CB C 13 38.34 0.2 . 1 . . . . 2 TYR CB . 15437 1 19 . 1 1 2 2 TYR N N 15 122.1 0.2 . 1 . . . . 2 TYR N . 15437 1 20 . 1 1 3 3 GLY H H 1 8.434 0.02 . 1 . . . . 3 GLY HN . 15437 1 21 . 1 1 3 3 GLY HA2 H 1 3.909 0.02 . 2 . . . . 3 GLY HA2 . 15437 1 22 . 1 1 3 3 GLY HA3 H 1 3.841 0.02 . 2 . . . . 3 GLY HA3 . 15437 1 23 . 1 1 3 3 GLY C C 13 174.3 0.2 . 1 . . . . 3 GLY C . 15437 1 24 . 1 1 3 3 GLY CA C 13 46.05 0.2 . 1 . . . . 3 GLY CA . 15437 1 25 . 1 1 3 3 GLY N N 15 111.1 0.2 . 1 . . . . 3 GLY N . 15437 1 26 . 1 1 4 4 LYS H H 1 8.06 0.02 . 1 . . . . 4 LYS HN . 15437 1 27 . 1 1 4 4 LYS HA H 1 4.297 0.02 . 1 . . . . 4 LYS HA . 15437 1 28 . 1 1 4 4 LYS HB2 H 1 1.843 0.02 . 2 . . . . 4 LYS HB2 . 15437 1 29 . 1 1 4 4 LYS HB3 H 1 1.843 0.02 . 2 . . . . 4 LYS HB3 . 15437 1 30 . 1 1 4 4 LYS HD2 H 1 1.69 0.02 . 2 . . . . 4 LYS HD2 . 15437 1 31 . 1 1 4 4 LYS HD3 H 1 1.69 0.02 . 2 . . . . 4 LYS HD3 . 15437 1 32 . 1 1 4 4 LYS HE2 H 1 2.932 0.02 . 2 . . . . 4 LYS HE2 . 15437 1 33 . 1 1 4 4 LYS HE3 H 1 2.932 0.02 . 2 . . . . 4 LYS HE3 . 15437 1 34 . 1 1 4 4 LYS HG2 H 1 1.409 0.02 . 2 . . . . 4 LYS HG2 . 15437 1 35 . 1 1 4 4 LYS HG3 H 1 1.409 0.02 . 2 . . . . 4 LYS HG3 . 15437 1 36 . 1 1 4 4 LYS C C 13 178 0.2 . 1 . . . . 4 LYS C . 15437 1 37 . 1 1 4 4 LYS CA C 13 56.93 0.2 . 1 . . . . 4 LYS CA . 15437 1 38 . 1 1 4 4 LYS CB C 13 32.68 0.2 . 1 . . . . 4 LYS CB . 15437 1 39 . 1 1 4 4 LYS CD C 13 28.83 0.2 . 1 . . . . 4 LYS CD . 15437 1 40 . 1 1 4 4 LYS CE C 13 42.07 0.2 . 1 . . . . 4 LYS CE . 15437 1 41 . 1 1 4 4 LYS CG C 13 24.99 0.2 . 1 . . . . 4 LYS CG . 15437 1 42 . 1 1 4 4 LYS N N 15 119.5 0.2 . 1 . . . . 4 LYS N . 15437 1 43 . 1 1 5 5 LEU H H 1 8.243 0.02 . 1 . . . . 5 LEU HN . 15437 1 44 . 1 1 5 5 LEU HA H 1 3.947 0.02 . 1 . . . . 5 LEU HA . 15437 1 45 . 1 1 5 5 LEU HB2 H 1 1.625 0.02 . 2 . . . . 5 LEU HB2 . 15437 1 46 . 1 1 5 5 LEU HB3 H 1 1.625 0.02 . 2 . . . . 5 LEU HB3 . 15437 1 47 . 1 1 5 5 LEU HD11 H 1 0.827 0.02 . 2 . . . . 5 LEU HD1 . 15437 1 48 . 1 1 5 5 LEU HD12 H 1 0.827 0.02 . 2 . . . . 5 LEU HD1 . 15437 1 49 . 1 1 5 5 LEU HD13 H 1 0.827 0.02 . 2 . . . . 5 LEU HD1 . 15437 1 50 . 1 1 5 5 LEU HD21 H 1 0.8134 0.02 . 2 . . . . 5 LEU HD2 . 15437 1 51 . 1 1 5 5 LEU HD22 H 1 0.8134 0.02 . 2 . . . . 5 LEU HD2 . 15437 1 52 . 1 1 5 5 LEU HD23 H 1 0.8134 0.02 . 2 . . . . 5 LEU HD2 . 15437 1 53 . 1 1 5 5 LEU HG H 1 1.602 0.02 . 1 . . . . 5 LEU HG . 15437 1 54 . 1 1 5 5 LEU C C 13 177.9 0.2 . 1 . . . . 5 LEU C . 15437 1 55 . 1 1 5 5 LEU CA C 13 57.93 0.2 . 1 . . . . 5 LEU CA . 15437 1 56 . 1 1 5 5 LEU CB C 13 41.62 0.2 . 1 . . . . 5 LEU CB . 15437 1 57 . 1 1 5 5 LEU CD1 C 13 24.89 0.2 . 2 . . . . 5 LEU CD1 . 15437 1 58 . 1 1 5 5 LEU CD2 C 13 24.89 0.2 . 2 . . . . 5 LEU CD2 . 15437 1 59 . 1 1 5 5 LEU CG C 13 27.18 0.2 . 1 . . . . 5 LEU CG . 15437 1 60 . 1 1 5 5 LEU N N 15 120.8 0.2 . 1 . . . . 5 LEU N . 15437 1 61 . 1 1 6 6 ASN H H 1 8.256 0.02 . 1 . . . . 6 ASN HN . 15437 1 62 . 1 1 6 6 ASN HA H 1 4.252 0.02 . 1 . . . . 6 ASN HA . 15437 1 63 . 1 1 6 6 ASN HB2 H 1 2.753 0.02 . 2 . . . . 6 ASN HB2 . 15437 1 64 . 1 1 6 6 ASN HB3 H 1 2.675 0.02 . 2 . . . . 6 ASN HB3 . 15437 1 65 . 1 1 6 6 ASN HD21 H 1 7.603 0.02 . 2 . . . . 6 ASN HD21 . 15437 1 66 . 1 1 6 6 ASN HD22 H 1 6.773 0.02 . 2 . . . . 6 ASN HD22 . 15437 1 67 . 1 1 6 6 ASN C C 13 177.3 0.2 . 1 . . . . 6 ASN C . 15437 1 68 . 1 1 6 6 ASN CA C 13 56.9 0.2 . 1 . . . . 6 ASN CA . 15437 1 69 . 1 1 6 6 ASN CB C 13 38.2 0.2 . 1 . . . . 6 ASN CB . 15437 1 70 . 1 1 6 6 ASN N N 15 116.2 0.2 . 1 . . . . 6 ASN N . 15437 1 71 . 1 1 6 6 ASN ND2 N 15 112.4 0.2 . 1 . . . . 6 ASN ND2 . 15437 1 72 . 1 1 7 7 ASP H H 1 7.699 0.02 . 1 . . . . 7 ASP HN . 15437 1 73 . 1 1 7 7 ASP HA H 1 4.32 0.02 . 1 . . . . 7 ASP HA . 15437 1 74 . 1 1 7 7 ASP HB2 H 1 2.73 0.02 . 2 . . . . 7 ASP HB2 . 15437 1 75 . 1 1 7 7 ASP HB3 H 1 2.73 0.02 . 2 . . . . 7 ASP HB3 . 15437 1 76 . 1 1 7 7 ASP C C 13 178 0.2 . 1 . . . . 7 ASP C . 15437 1 77 . 1 1 7 7 ASP CA C 13 56.98 0.2 . 1 . . . . 7 ASP CA . 15437 1 78 . 1 1 7 7 ASP CB C 13 39.87 0.2 . 1 . . . . 7 ASP CB . 15437 1 79 . 1 1 7 7 ASP N N 15 119.1 0.2 . 1 . . . . 7 ASP N . 15437 1 80 . 1 1 8 8 LEU H H 1 7.58 0.02 . 1 . . . . 8 LEU HN . 15437 1 81 . 1 1 8 8 LEU HA H 1 4.091 0.02 . 1 . . . . 8 LEU HA . 15437 1 82 . 1 1 8 8 LEU HB2 H 1 1.782 0.02 . 2 . . . . 8 LEU HB2 . 15437 1 83 . 1 1 8 8 LEU HB3 H 1 1.523 0.02 . 2 . . . . 8 LEU HB3 . 15437 1 84 . 1 1 8 8 LEU HD11 H 1 0.7764 0.02 . 2 . . . . 8 LEU HD1 . 15437 1 85 . 1 1 8 8 LEU HD12 H 1 0.7764 0.02 . 2 . . . . 8 LEU HD1 . 15437 1 86 . 1 1 8 8 LEU HD13 H 1 0.7764 0.02 . 2 . . . . 8 LEU HD1 . 15437 1 87 . 1 1 8 8 LEU HD21 H 1 0.7977 0.02 . 2 . . . . 8 LEU HD2 . 15437 1 88 . 1 1 8 8 LEU HD22 H 1 0.7977 0.02 . 2 . . . . 8 LEU HD2 . 15437 1 89 . 1 1 8 8 LEU HD23 H 1 0.7977 0.02 . 2 . . . . 8 LEU HD2 . 15437 1 90 . 1 1 8 8 LEU HG H 1 1.686 0.02 . 1 . . . . 8 LEU HG . 15437 1 91 . 1 1 8 8 LEU C C 13 178.8 0.2 . 1 . . . . 8 LEU C . 15437 1 92 . 1 1 8 8 LEU CA C 13 57.79 0.2 . 1 . . . . 8 LEU CA . 15437 1 93 . 1 1 8 8 LEU CB C 13 41.88 0.2 . 1 . . . . 8 LEU CB . 15437 1 94 . 1 1 8 8 LEU CD1 C 13 25.81 0.2 . 2 . . . . 8 LEU CD1 . 15437 1 95 . 1 1 8 8 LEU CD2 C 13 24.53 0.2 . 2 . . . . 8 LEU CD2 . 15437 1 96 . 1 1 8 8 LEU CG C 13 27.16 0.2 . 1 . . . . 8 LEU CG . 15437 1 97 . 1 1 8 8 LEU N N 15 120.4 0.2 . 1 . . . . 8 LEU N . 15437 1 98 . 1 1 9 9 LEU H H 1 8.125 0.02 . 1 . . . . 9 LEU HN . 15437 1 99 . 1 1 9 9 LEU HA H 1 3.891 0.02 . 1 . . . . 9 LEU HA . 15437 1 100 . 1 1 9 9 LEU HB2 H 1 1.813 0.02 . 2 . . . . 9 LEU HB2 . 15437 1 101 . 1 1 9 9 LEU HB3 H 1 1.564 0.02 . 2 . . . . 9 LEU HB3 . 15437 1 102 . 1 1 9 9 LEU HD11 H 1 0.7846 0.02 . 2 . . . . 9 LEU HD1 . 15437 1 103 . 1 1 9 9 LEU HD12 H 1 0.7846 0.02 . 2 . . . . 9 LEU HD1 . 15437 1 104 . 1 1 9 9 LEU HD13 H 1 0.7846 0.02 . 2 . . . . 9 LEU HD1 . 15437 1 105 . 1 1 9 9 LEU HD21 H 1 0.6922 0.02 . 2 . . . . 9 LEU HD2 . 15437 1 106 . 1 1 9 9 LEU HD22 H 1 0.6922 0.02 . 2 . . . . 9 LEU HD2 . 15437 1 107 . 1 1 9 9 LEU HD23 H 1 0.6922 0.02 . 2 . . . . 9 LEU HD2 . 15437 1 108 . 1 1 9 9 LEU HG H 1 1.647 0.02 . 1 . . . . 9 LEU HG . 15437 1 109 . 1 1 9 9 LEU C C 13 178.9 0.2 . 1 . . . . 9 LEU C . 15437 1 110 . 1 1 9 9 LEU CA C 13 58.35 0.2 . 1 . . . . 9 LEU CA . 15437 1 111 . 1 1 9 9 LEU CB C 13 41.51 0.2 . 1 . . . . 9 LEU CB . 15437 1 112 . 1 1 9 9 LEU CD1 C 13 24.52 0.2 . 2 . . . . 9 LEU CD1 . 15437 1 113 . 1 1 9 9 LEU CD2 C 13 23.34 0.2 . 2 . . . . 9 LEU CD2 . 15437 1 114 . 1 1 9 9 LEU CG C 13 26.06 0.2 . 1 . . . . 9 LEU CG . 15437 1 115 . 1 1 9 9 LEU N N 15 118.9 0.2 . 1 . . . . 9 LEU N . 15437 1 116 . 1 1 10 10 GLU H H 1 8.011 0.02 . 1 . . . . 10 GLU HN . 15437 1 117 . 1 1 10 10 GLU HA H 1 4.072 0.02 . 1 . . . . 10 GLU HA . 15437 1 118 . 1 1 10 10 GLU HB2 H 1 2.153 0.02 . 2 . . . . 10 GLU HB2 . 15437 1 119 . 1 1 10 10 GLU HB3 H 1 2.153 0.02 . 2 . . . . 10 GLU HB3 . 15437 1 120 . 1 1 10 10 GLU HG2 H 1 2.467 0.02 . 2 . . . . 10 GLU HG2 . 15437 1 121 . 1 1 10 10 GLU HG3 H 1 2.467 0.02 . 2 . . . . 10 GLU HG3 . 15437 1 122 . 1 1 10 10 GLU C C 13 179 0.2 . 1 . . . . 10 GLU C . 15437 1 123 . 1 1 10 10 GLU CA C 13 59.09 0.2 . 1 . . . . 10 GLU CA . 15437 1 124 . 1 1 10 10 GLU CB C 13 27.91 0.2 . 1 . . . . 10 GLU CB . 15437 1 125 . 1 1 10 10 GLU CG C 13 34 0.2 . 1 . . . . 10 GLU CG . 15437 1 126 . 1 1 10 10 GLU N N 15 119.3 0.2 . 1 . . . . 10 GLU N . 15437 1 127 . 1 1 11 11 ASP H H 1 8.128 0.02 . 1 . . . . 11 ASP HN . 15437 1 128 . 1 1 11 11 ASP HA H 1 4.383 0.02 . 1 . . . . 11 ASP HA . 15437 1 129 . 1 1 11 11 ASP HB2 H 1 3.036 0.02 . 2 . . . . 11 ASP HB2 . 15437 1 130 . 1 1 11 11 ASP HB3 H 1 2.712 0.02 . 2 . . . . 11 ASP HB3 . 15437 1 131 . 1 1 11 11 ASP C C 13 178.5 0.2 . 1 . . . . 11 ASP C . 15437 1 132 . 1 1 11 11 ASP CA C 13 56.58 0.2 . 1 . . . . 11 ASP CA . 15437 1 133 . 1 1 11 11 ASP CB C 13 38.6 0.2 . 1 . . . . 11 ASP CB . 15437 1 134 . 1 1 11 11 ASP N N 15 119.6 0.2 . 1 . . . . 11 ASP N . 15437 1 135 . 1 1 12 12 LEU H H 1 8.394 0.02 . 1 . . . . 12 LEU HN . 15437 1 136 . 1 1 12 12 LEU HA H 1 3.923 0.02 . 1 . . . . 12 LEU HA . 15437 1 137 . 1 1 12 12 LEU HB2 H 1 1.796 0.02 . 2 . . . . 12 LEU HB2 . 15437 1 138 . 1 1 12 12 LEU HB3 H 1 1.553 0.02 . 2 . . . . 12 LEU HB3 . 15437 1 139 . 1 1 12 12 LEU HD11 H 1 0.6961 0.02 . 2 . . . . 12 LEU HD1 . 15437 1 140 . 1 1 12 12 LEU HD12 H 1 0.6961 0.02 . 2 . . . . 12 LEU HD1 . 15437 1 141 . 1 1 12 12 LEU HD13 H 1 0.6961 0.02 . 2 . . . . 12 LEU HD1 . 15437 1 142 . 1 1 12 12 LEU HD21 H 1 0.5374 0.02 . 2 . . . . 12 LEU HD2 . 15437 1 143 . 1 1 12 12 LEU HD22 H 1 0.5374 0.02 . 2 . . . . 12 LEU HD2 . 15437 1 144 . 1 1 12 12 LEU HD23 H 1 0.5374 0.02 . 2 . . . . 12 LEU HD2 . 15437 1 145 . 1 1 12 12 LEU HG H 1 1.594 0.02 . 1 . . . . 12 LEU HG . 15437 1 146 . 1 1 12 12 LEU C C 13 178.2 0.2 . 1 . . . . 12 LEU C . 15437 1 147 . 1 1 12 12 LEU CA C 13 57.88 0.2 . 1 . . . . 12 LEU CA . 15437 1 148 . 1 1 12 12 LEU CB C 13 41.85 0.2 . 1 . . . . 12 LEU CB . 15437 1 149 . 1 1 12 12 LEU CD1 C 13 24.98 0.2 . 2 . . . . 12 LEU CD1 . 15437 1 150 . 1 1 12 12 LEU CD2 C 13 24.36 0.2 . 2 . . . . 12 LEU CD2 . 15437 1 151 . 1 1 12 12 LEU CG C 13 27.05 0.2 . 1 . . . . 12 LEU CG . 15437 1 152 . 1 1 12 12 LEU N N 15 120.5 0.2 . 1 . . . . 12 LEU N . 15437 1 153 . 1 1 13 13 GLN H H 1 8.371 0.02 . 1 . . . . 13 GLN HN . 15437 1 154 . 1 1 13 13 GLN HA H 1 3.879 0.02 . 1 . . . . 13 GLN HA . 15437 1 155 . 1 1 13 13 GLN HB2 H 1 2.275 0.02 . 2 . . . . 13 GLN HB2 . 15437 1 156 . 1 1 13 13 GLN HB3 H 1 2.109 0.02 . 2 . . . . 13 GLN HB3 . 15437 1 157 . 1 1 13 13 GLN HE21 H 1 7.133 0.02 . 2 . . . . 13 GLN HE21 . 15437 1 158 . 1 1 13 13 GLN HE22 H 1 6.81 0.02 . 2 . . . . 13 GLN HE22 . 15437 1 159 . 1 1 13 13 GLN HG2 H 1 2.297 0.02 . 2 . . . . 13 GLN HG2 . 15437 1 160 . 1 1 13 13 GLN HG3 H 1 2.297 0.02 . 2 . . . . 13 GLN HG3 . 15437 1 161 . 1 1 13 13 GLN C C 13 178.6 0.2 . 1 . . . . 13 GLN C . 15437 1 162 . 1 1 13 13 GLN CA C 13 59.57 0.2 . 1 . . . . 13 GLN CA . 15437 1 163 . 1 1 13 13 GLN CB C 13 28.44 0.2 . 1 . . . . 13 GLN CB . 15437 1 164 . 1 1 13 13 GLN CG C 13 34.45 0.2 . 1 . . . . 13 GLN CG . 15437 1 165 . 1 1 13 13 GLN N N 15 118.4 0.2 . 1 . . . . 13 GLN N . 15437 1 166 . 1 1 13 13 GLN NE2 N 15 109.8 0.2 . 1 . . . . 13 GLN NE2 . 15437 1 167 . 1 1 14 14 GLU H H 1 7.913 0.02 . 1 . . . . 14 GLU HN . 15437 1 168 . 1 1 14 14 GLU HA H 1 4.021 0.02 . 1 . . . . 14 GLU HA . 15437 1 169 . 1 1 14 14 GLU HB2 H 1 2.222 0.02 . 2 . . . . 14 GLU HB2 . 15437 1 170 . 1 1 14 14 GLU HB3 H 1 2.125 0.02 . 2 . . . . 14 GLU HB3 . 15437 1 171 . 1 1 14 14 GLU HG2 H 1 2.429 0.02 . 2 . . . . 14 GLU HG2 . 15437 1 172 . 1 1 14 14 GLU HG3 H 1 2.429 0.02 . 2 . . . . 14 GLU HG3 . 15437 1 173 . 1 1 14 14 GLU C C 13 179 0.2 . 1 . . . . 14 GLU C . 15437 1 174 . 1 1 14 14 GLU CA C 13 59.03 0.2 . 1 . . . . 14 GLU CA . 15437 1 175 . 1 1 14 14 GLU CB C 13 28.72 0.2 . 1 . . . . 14 GLU CB . 15437 1 176 . 1 1 14 14 GLU CG C 13 34.86 0.2 . 1 . . . . 14 GLU CG . 15437 1 177 . 1 1 14 14 GLU N N 15 119.1 0.2 . 1 . . . . 14 GLU N . 15437 1 178 . 1 1 15 15 VAL H H 1 7.991 0.02 . 1 . . . . 15 VAL HN . 15437 1 179 . 1 1 15 15 VAL HA H 1 3.696 0.02 . 1 . . . . 15 VAL HA . 15437 1 180 . 1 1 15 15 VAL HB H 1 2.222 0.02 . 1 . . . . 15 VAL HB . 15437 1 181 . 1 1 15 15 VAL HG11 H 1 1.034 0.02 . 2 . . . . 15 VAL HG1 . 15437 1 182 . 1 1 15 15 VAL HG12 H 1 1.034 0.02 . 2 . . . . 15 VAL HG1 . 15437 1 183 . 1 1 15 15 VAL HG13 H 1 1.034 0.02 . 2 . . . . 15 VAL HG1 . 15437 1 184 . 1 1 15 15 VAL HG21 H 1 0.8971 0.02 . 2 . . . . 15 VAL HG2 . 15437 1 185 . 1 1 15 15 VAL HG22 H 1 0.8971 0.02 . 2 . . . . 15 VAL HG2 . 15437 1 186 . 1 1 15 15 VAL HG23 H 1 0.8971 0.02 . 2 . . . . 15 VAL HG2 . 15437 1 187 . 1 1 15 15 VAL C C 13 178.3 0.2 . 1 . . . . 15 VAL C . 15437 1 188 . 1 1 15 15 VAL CA C 13 66.64 0.2 . 1 . . . . 15 VAL CA . 15437 1 189 . 1 1 15 15 VAL CB C 13 31.47 0.2 . 1 . . . . 15 VAL CB . 15437 1 190 . 1 1 15 15 VAL CG1 C 13 23.14 0.2 . 2 . . . . 15 VAL CG1 . 15437 1 191 . 1 1 15 15 VAL CG2 C 13 22.03 0.2 . 2 . . . . 15 VAL CG2 . 15437 1 192 . 1 1 15 15 VAL N N 15 120.3 0.2 . 1 . . . . 15 VAL N . 15437 1 193 . 1 1 16 16 LEU H H 1 8.172 0.02 . 1 . . . . 16 LEU HN . 15437 1 194 . 1 1 16 16 LEU HA H 1 3.876 0.02 . 1 . . . . 16 LEU HA . 15437 1 195 . 1 1 16 16 LEU HB2 H 1 1.668 0.02 . 2 . . . . 16 LEU HB2 . 15437 1 196 . 1 1 16 16 LEU HB3 H 1 1.634 0.02 . 2 . . . . 16 LEU HB3 . 15437 1 197 . 1 1 16 16 LEU HD11 H 1 0.7635 0.02 . 2 . . . . 16 LEU HD1 . 15437 1 198 . 1 1 16 16 LEU HD12 H 1 0.7635 0.02 . 2 . . . . 16 LEU HD1 . 15437 1 199 . 1 1 16 16 LEU HD13 H 1 0.7635 0.02 . 2 . . . . 16 LEU HD1 . 15437 1 200 . 1 1 16 16 LEU HD21 H 1 0.7451 0.02 . 2 . . . . 16 LEU HD2 . 15437 1 201 . 1 1 16 16 LEU HD22 H 1 0.7451 0.02 . 2 . . . . 16 LEU HD2 . 15437 1 202 . 1 1 16 16 LEU HD23 H 1 0.7451 0.02 . 2 . . . . 16 LEU HD2 . 15437 1 203 . 1 1 16 16 LEU HG H 1 2.09 0.02 . 1 . . . . 16 LEU HG . 15437 1 204 . 1 1 16 16 LEU C C 13 178.4 0.2 . 1 . . . . 16 LEU C . 15437 1 205 . 1 1 16 16 LEU CA C 13 58.05 0.2 . 1 . . . . 16 LEU CA . 15437 1 206 . 1 1 16 16 LEU CB C 13 41.42 0.2 . 1 . . . . 16 LEU CB . 15437 1 207 . 1 1 16 16 LEU CD1 C 13 25.14 0.2 . 2 . . . . 16 LEU CD1 . 15437 1 208 . 1 1 16 16 LEU CD2 C 13 24.2 0.2 . 2 . . . . 16 LEU CD2 . 15437 1 209 . 1 1 16 16 LEU CG C 13 26.92 0.2 . 1 . . . . 16 LEU CG . 15437 1 210 . 1 1 16 16 LEU N N 15 119.7 0.2 . 1 . . . . 16 LEU N . 15437 1 211 . 1 1 17 17 LYS H H 1 7.755 0.02 . 1 . . . . 17 LYS HN . 15437 1 212 . 1 1 17 17 LYS HA H 1 3.951 0.02 . 1 . . . . 17 LYS HA . 15437 1 213 . 1 1 17 17 LYS HB2 H 1 1.78 0.02 . 2 . . . . 17 LYS HB2 . 15437 1 214 . 1 1 17 17 LYS HB3 H 1 1.78 0.02 . 2 . . . . 17 LYS HB3 . 15437 1 215 . 1 1 17 17 LYS HD2 H 1 1.587 0.02 . 2 . . . . 17 LYS HD2 . 15437 1 216 . 1 1 17 17 LYS HD3 H 1 1.587 0.02 . 2 . . . . 17 LYS HD3 . 15437 1 217 . 1 1 17 17 LYS HE2 H 1 2.845 0.02 . 2 . . . . 17 LYS HE2 . 15437 1 218 . 1 1 17 17 LYS HE3 H 1 2.845 0.02 . 2 . . . . 17 LYS HE3 . 15437 1 219 . 1 1 17 17 LYS HG2 H 1 1.295 0.02 . 2 . . . . 17 LYS HG2 . 15437 1 220 . 1 1 17 17 LYS HG3 H 1 1.539 0.02 . 2 . . . . 17 LYS HG3 . 15437 1 221 . 1 1 17 17 LYS C C 13 178.8 0.2 . 1 . . . . 17 LYS C . 15437 1 222 . 1 1 17 17 LYS CA C 13 59.47 0.2 . 1 . . . . 17 LYS CA . 15437 1 223 . 1 1 17 17 LYS CB C 13 32.35 0.2 . 1 . . . . 17 LYS CB . 15437 1 224 . 1 1 17 17 LYS CD C 13 29.47 0.2 . 1 . . . . 17 LYS CD . 15437 1 225 . 1 1 17 17 LYS CE C 13 41.99 0.2 . 1 . . . . 17 LYS CE . 15437 1 226 . 1 1 17 17 LYS CG C 13 25.35 0.2 . 1 . . . . 17 LYS CG . 15437 1 227 . 1 1 17 17 LYS N N 15 117.8 0.2 . 1 . . . . 17 LYS N . 15437 1 228 . 1 1 18 18 HIS H H 1 7.847 0.02 . 1 . . . . 18 HIS HN . 15437 1 229 . 1 1 18 18 HIS HA H 1 4.549 0.02 . 1 . . . . 18 HIS HA . 15437 1 230 . 1 1 18 18 HIS HB2 H 1 3.38 0.02 . 2 . . . . 18 HIS HB2 . 15437 1 231 . 1 1 18 18 HIS HB3 H 1 3.322 0.02 . 2 . . . . 18 HIS HB3 . 15437 1 232 . 1 1 18 18 HIS HD2 H 1 7.276 0.02 . 1 . . . . 18 HIS HD2 . 15437 1 233 . 1 1 18 18 HIS C C 13 177.2 0.2 . 1 . . . . 18 HIS C . 15437 1 234 . 1 1 18 18 HIS CA C 13 57.87 0.2 . 1 . . . . 18 HIS CA . 15437 1 235 . 1 1 18 18 HIS CB C 13 28.73 0.2 . 1 . . . . 18 HIS CB . 15437 1 236 . 1 1 18 18 HIS N N 15 116.2 0.2 . 1 . . . . 18 HIS N . 15437 1 237 . 1 1 19 19 VAL H H 1 8.415 0.02 . 1 . . . . 19 VAL HN . 15437 1 238 . 1 1 19 19 VAL HA H 1 3.746 0.02 . 1 . . . . 19 VAL HA . 15437 1 239 . 1 1 19 19 VAL HB H 1 2.178 0.02 . 1 . . . . 19 VAL HB . 15437 1 240 . 1 1 19 19 VAL HG11 H 1 0.968 0.02 . 2 . . . . 19 VAL HG1 . 15437 1 241 . 1 1 19 19 VAL HG12 H 1 0.968 0.02 . 2 . . . . 19 VAL HG1 . 15437 1 242 . 1 1 19 19 VAL HG13 H 1 0.968 0.02 . 2 . . . . 19 VAL HG1 . 15437 1 243 . 1 1 19 19 VAL HG21 H 1 0.758 0.02 . 2 . . . . 19 VAL HG2 . 15437 1 244 . 1 1 19 19 VAL HG22 H 1 0.758 0.02 . 2 . . . . 19 VAL HG2 . 15437 1 245 . 1 1 19 19 VAL HG23 H 1 0.758 0.02 . 2 . . . . 19 VAL HG2 . 15437 1 246 . 1 1 19 19 VAL CA C 13 65.85 0.2 . 1 . . . . 19 VAL CA . 15437 1 247 . 1 1 19 19 VAL CB C 13 31.6 0.2 . 1 . . . . 19 VAL CB . 15437 1 248 . 1 1 19 19 VAL CG1 C 13 22.97 0.2 . 2 . . . . 19 VAL CG1 . 15437 1 249 . 1 1 19 19 VAL CG2 C 13 21.31 0.2 . 2 . . . . 19 VAL CG2 . 15437 1 250 . 1 1 20 20 ASN H H 1 8.041 0.02 . 1 . . . . 20 ASN HN . 15437 1 251 . 1 1 20 20 ASN HA H 1 4.545 0.02 . 1 . . . . 20 ASN HA . 15437 1 252 . 1 1 20 20 ASN HB2 H 1 2.743 0.02 . 2 . . . . 20 ASN HB2 . 15437 1 253 . 1 1 20 20 ASN HB3 H 1 2.818 0.02 . 2 . . . . 20 ASN HB3 . 15437 1 254 . 1 1 20 20 ASN HD21 H 1 7.56 0.02 . 2 . . . . 20 ASN HD21 . 15437 1 255 . 1 1 20 20 ASN HD22 H 1 6.81 0.02 . 2 . . . . 20 ASN HD22 . 15437 1 256 . 1 1 20 20 ASN C C 13 176.9 0.2 . 1 . . . . 20 ASN C . 15437 1 257 . 1 1 20 20 ASN CA C 13 55.07 0.2 . 1 . . . . 20 ASN CA . 15437 1 258 . 1 1 20 20 ASN CB C 13 38.27 0.2 . 1 . . . . 20 ASN CB . 15437 1 259 . 1 1 20 20 ASN N N 15 117.9 0.2 . 1 . . . . 20 ASN N . 15437 1 260 . 1 1 20 20 ASN ND2 N 15 111.3 0.2 . 1 . . . . 20 ASN ND2 . 15437 1 261 . 1 1 21 21 GLN H H 1 7.887 0.02 . 1 . . . . 21 GLN HN . 15437 1 262 . 1 1 21 21 GLN HA H 1 4.096 0.02 . 1 . . . . 21 GLN HA . 15437 1 263 . 1 1 21 21 GLN HB2 H 1 1.99 0.02 . 2 . . . . 21 GLN HB2 . 15437 1 264 . 1 1 21 21 GLN HB3 H 1 1.887 0.02 . 2 . . . . 21 GLN HB3 . 15437 1 265 . 1 1 21 21 GLN HE21 H 1 7.413 0.02 . 2 . . . . 21 GLN HE21 . 15437 1 266 . 1 1 21 21 GLN HE22 H 1 6.808 0.02 . 2 . . . . 21 GLN HE22 . 15437 1 267 . 1 1 21 21 GLN HG2 H 1 2.385 0.02 . 2 . . . . 21 GLN HG2 . 15437 1 268 . 1 1 21 21 GLN HG3 H 1 2.214 0.02 . 2 . . . . 21 GLN HG3 . 15437 1 269 . 1 1 21 21 GLN C C 13 176.9 0.2 . 1 . . . . 21 GLN C . 15437 1 270 . 1 1 21 21 GLN CA C 13 57.51 0.2 . 1 . . . . 21 GLN CA . 15437 1 271 . 1 1 21 21 GLN CB C 13 29.1 0.2 . 1 . . . . 21 GLN CB . 15437 1 272 . 1 1 21 21 GLN CG C 13 33.86 0.2 . 1 . . . . 21 GLN CG . 15437 1 273 . 1 1 21 21 GLN N N 15 117.9 0.2 . 1 . . . . 21 GLN N . 15437 1 274 . 1 1 21 21 GLN NE2 N 15 111.4 0.2 . 1 . . . . 21 GLN NE2 . 15437 1 275 . 1 1 22 22 HIS H H 1 7.887 0.02 . 1 . . . . 22 HIS HN . 15437 1 276 . 1 1 22 22 HIS HA H 1 4.679 0.02 . 1 . . . . 22 HIS HA . 15437 1 277 . 1 1 22 22 HIS HB2 H 1 3.33 0.02 . 2 . . . . 22 HIS HB2 . 15437 1 278 . 1 1 22 22 HIS HB3 H 1 3.003 0.02 . 2 . . . . 22 HIS HB3 . 15437 1 279 . 1 1 22 22 HIS HD2 H 1 7.104 0.02 . 1 . . . . 22 HIS HD2 . 15437 1 280 . 1 1 22 22 HIS C C 13 174.3 0.2 . 1 . . . . 22 HIS C . 15437 1 281 . 1 1 22 22 HIS CA C 13 55.77 0.2 . 1 . . . . 22 HIS CA . 15437 1 282 . 1 1 22 22 HIS CB C 13 28.63 0.2 . 1 . . . . 22 HIS CB . 15437 1 283 . 1 1 22 22 HIS N N 15 116.1 0.2 . 1 . . . . 22 HIS N . 15437 1 284 . 1 1 23 23 TRP H H 1 7.929 0.02 . 1 . . . . 23 TRP HN . 15437 1 285 . 1 1 23 23 TRP HA H 1 4.542 0.02 . 1 . . . . 23 TRP HA . 15437 1 286 . 1 1 23 23 TRP HB2 H 1 3.395 0.02 . 2 . . . . 23 TRP HB2 . 15437 1 287 . 1 1 23 23 TRP HB3 H 1 3.22 0.02 . 2 . . . . 23 TRP HB3 . 15437 1 288 . 1 1 23 23 TRP HD1 H 1 7.078 0.02 . 1 . . . . 23 TRP HD1 . 15437 1 289 . 1 1 23 23 TRP HE1 H 1 9.973 0.02 . 1 . . . . 23 TRP HE1 . 15437 1 290 . 1 1 23 23 TRP HE3 H 1 7.599 0.02 . 1 . . . . 23 TRP HE3 . 15437 1 291 . 1 1 23 23 TRP HZ2 H 1 7.259 0.02 . 1 . . . . 23 TRP HZ2 . 15437 1 292 . 1 1 23 23 TRP C C 13 176.6 0.2 . 1 . . . . 23 TRP C . 15437 1 293 . 1 1 23 23 TRP CA C 13 58.02 0.2 . 1 . . . . 23 TRP CA . 15437 1 294 . 1 1 23 23 TRP CB C 13 29.7 0.2 . 1 . . . . 23 TRP CB . 15437 1 295 . 1 1 23 23 TRP N N 15 122 0.2 . 1 . . . . 23 TRP N . 15437 1 296 . 1 1 23 23 TRP NE1 N 15 128.7 0.2 . 1 . . . . 23 TRP NE1 . 15437 1 297 . 1 1 24 24 GLN H H 1 8.258 0.02 . 1 . . . . 24 GLN HN . 15437 1 298 . 1 1 24 24 GLN HA H 1 4.329 0.02 . 1 . . . . 24 GLN HA . 15437 1 299 . 1 1 24 24 GLN HB2 H 1 1.822 0.02 . 2 . . . . 24 GLN HB2 . 15437 1 300 . 1 1 24 24 GLN HB3 H 1 2.045 0.02 . 2 . . . . 24 GLN HB3 . 15437 1 301 . 1 1 24 24 GLN HE21 H 1 7.312 0.02 . 2 . . . . 24 GLN HE21 . 15437 1 302 . 1 1 24 24 GLN HE22 H 1 6.761 0.02 . 2 . . . . 24 GLN HE22 . 15437 1 303 . 1 1 24 24 GLN HG2 H 1 2.245 0.02 . 2 . . . . 24 GLN HG2 . 15437 1 304 . 1 1 24 24 GLN HG3 H 1 2.245 0.02 . 2 . . . . 24 GLN HG3 . 15437 1 305 . 1 1 24 24 GLN C C 13 176.2 0.2 . 1 . . . . 24 GLN C . 15437 1 306 . 1 1 24 24 GLN CA C 13 55.96 0.2 . 1 . . . . 24 GLN CA . 15437 1 307 . 1 1 24 24 GLN CB C 13 29.44 0.2 . 1 . . . . 24 GLN CB . 15437 1 308 . 1 1 24 24 GLN CG C 13 33.72 0.2 . 1 . . . . 24 GLN CG . 15437 1 309 . 1 1 24 24 GLN N N 15 123.8 0.2 . 1 . . . . 24 GLN N . 15437 1 310 . 1 1 24 24 GLN NE2 N 15 112 0.2 . 1 . . . . 24 GLN NE2 . 15437 1 311 . 1 1 25 25 GLY H H 1 7.47 0.02 . 1 . . . . 25 GLY HN . 15437 1 312 . 1 1 25 25 GLY HA2 H 1 3.939 0.02 . 2 . . . . 25 GLY HA2 . 15437 1 313 . 1 1 25 25 GLY HA3 H 1 3.8 0.02 . 2 . . . . 25 GLY HA3 . 15437 1 314 . 1 1 25 25 GLY C C 13 174.8 0.2 . 1 . . . . 25 GLY C . 15437 1 315 . 1 1 25 25 GLY CA C 13 45.47 0.2 . 1 . . . . 25 GLY CA . 15437 1 316 . 1 1 25 25 GLY N N 15 108.1 0.2 . 1 . . . . 25 GLY N . 15437 1 317 . 1 1 26 26 GLY H H 1 8.332 0.02 . 1 . . . . 26 GLY HN . 15437 1 318 . 1 1 26 26 GLY HA2 H 1 4.105 0.02 . 2 . . . . 26 GLY HA2 . 15437 1 319 . 1 1 26 26 GLY HA3 H 1 3.974 0.02 . 2 . . . . 26 GLY HA3 . 15437 1 320 . 1 1 26 26 GLY C C 13 174.9 0.2 . 1 . . . . 26 GLY C . 15437 1 321 . 1 1 26 26 GLY CA C 13 45.41 0.2 . 1 . . . . 26 GLY CA . 15437 1 322 . 1 1 26 26 GLY N N 15 108.7 0.2 . 1 . . . . 26 GLY N . 15437 1 323 . 1 1 27 27 GLN H H 1 8.474 0.02 . 1 . . . . 27 GLN HN . 15437 1 324 . 1 1 27 27 GLN HA H 1 4.106 0.02 . 1 . . . . 27 GLN HA . 15437 1 325 . 1 1 27 27 GLN HB2 H 1 2.034 0.02 . 2 . . . . 27 GLN HB2 . 15437 1 326 . 1 1 27 27 GLN HB3 H 1 2.05 0.02 . 2 . . . . 27 GLN HB3 . 15437 1 327 . 1 1 27 27 GLN HE21 H 1 7.493 0.02 . 2 . . . . 27 GLN HE21 . 15437 1 328 . 1 1 27 27 GLN HE22 H 1 6.815 0.02 . 2 . . . . 27 GLN HE22 . 15437 1 329 . 1 1 27 27 GLN HG2 H 1 2.339 0.02 . 2 . . . . 27 GLN HG2 . 15437 1 330 . 1 1 27 27 GLN HG3 H 1 2.339 0.02 . 2 . . . . 27 GLN HG3 . 15437 1 331 . 1 1 27 27 GLN C C 13 177.1 0.2 . 1 . . . . 27 GLN C . 15437 1 332 . 1 1 27 27 GLN CA C 13 57.54 0.2 . 1 . . . . 27 GLN CA . 15437 1 333 . 1 1 27 27 GLN CB C 13 29.05 0.2 . 1 . . . . 27 GLN CB . 15437 1 334 . 1 1 27 27 GLN CG C 13 33.92 0.2 . 1 . . . . 27 GLN CG . 15437 1 335 . 1 1 27 27 GLN N N 15 121.1 0.2 . 1 . . . . 27 GLN N . 15437 1 336 . 1 1 27 27 GLN NE2 N 15 112.4 0.2 . 1 . . . . 27 GLN NE2 . 15437 1 337 . 1 1 28 28 LYS H H 1 8.448 0.02 . 1 . . . . 28 LYS HN . 15437 1 338 . 1 1 28 28 LYS HA H 1 4.068 0.02 . 1 . . . . 28 LYS HA . 15437 1 339 . 1 1 28 28 LYS HB2 H 1 1.762 0.02 . 2 . . . . 28 LYS HB2 . 15437 1 340 . 1 1 28 28 LYS HB3 H 1 1.762 0.02 . 2 . . . . 28 LYS HB3 . 15437 1 341 . 1 1 28 28 LYS HD2 H 1 1.422 0.02 . 2 . . . . 28 LYS HD2 . 15437 1 342 . 1 1 28 28 LYS HD3 H 1 1.422 0.02 . 2 . . . . 28 LYS HD3 . 15437 1 343 . 1 1 28 28 LYS HE2 H 1 2.925 0.02 . 2 . . . . 28 LYS HE2 . 15437 1 344 . 1 1 28 28 LYS HE3 H 1 2.925 0.02 . 2 . . . . 28 LYS HE3 . 15437 1 345 . 1 1 28 28 LYS HG2 H 1 1.319 0.02 . 2 . . . . 28 LYS HG2 . 15437 1 346 . 1 1 28 28 LYS HG3 H 1 1.319 0.02 . 2 . . . . 28 LYS HG3 . 15437 1 347 . 1 1 28 28 LYS C C 13 177.9 0.2 . 1 . . . . 28 LYS C . 15437 1 348 . 1 1 28 28 LYS CA C 13 58.41 0.2 . 1 . . . . 28 LYS CA . 15437 1 349 . 1 1 28 28 LYS CB C 13 32.21 0.2 . 1 . . . . 28 LYS CB . 15437 1 350 . 1 1 28 28 LYS CD C 13 29.12 0.2 . 1 . . . . 28 LYS CD . 15437 1 351 . 1 1 28 28 LYS CE C 13 41.93 0.2 . 1 . . . . 28 LYS CE . 15437 1 352 . 1 1 28 28 LYS CG C 13 24.89 0.2 . 1 . . . . 28 LYS CG . 15437 1 353 . 1 1 28 28 LYS N N 15 120.5 0.2 . 1 . . . . 28 LYS N . 15437 1 354 . 1 1 29 29 ASN H H 1 8.273 0.02 . 1 . . . . 29 ASN HN . 15437 1 355 . 1 1 29 29 ASN HA H 1 4.584 0.02 . 1 . . . . 29 ASN HA . 15437 1 356 . 1 1 29 29 ASN HB2 H 1 2.914 0.02 . 2 . . . . 29 ASN HB2 . 15437 1 357 . 1 1 29 29 ASN HB3 H 1 2.825 0.02 . 2 . . . . 29 ASN HB3 . 15437 1 358 . 1 1 29 29 ASN HD21 H 1 7.681 0.02 . 2 . . . . 29 ASN HD21 . 15437 1 359 . 1 1 29 29 ASN HD22 H 1 6.978 0.02 . 2 . . . . 29 ASN HD22 . 15437 1 360 . 1 1 29 29 ASN C C 13 176.2 0.2 . 1 . . . . 29 ASN C . 15437 1 361 . 1 1 29 29 ASN CA C 13 54.4 0.2 . 1 . . . . 29 ASN CA . 15437 1 362 . 1 1 29 29 ASN CB C 13 38.28 0.2 . 1 . . . . 29 ASN CB . 15437 1 363 . 1 1 29 29 ASN N N 15 117.5 0.2 . 1 . . . . 29 ASN N . 15437 1 364 . 1 1 29 29 ASN ND2 N 15 112.6 0.2 . 1 . . . . 29 ASN ND2 . 15437 1 365 . 1 1 30 30 MET H H 1 7.87 0.02 . 1 . . . . 30 MET HN . 15437 1 366 . 1 1 30 30 MET HA H 1 4.085 0.02 . 1 . . . . 30 MET HA . 15437 1 367 . 1 1 30 30 MET HB2 H 1 2.542 0.02 . 2 . . . . 30 MET HB2 . 15437 1 368 . 1 1 30 30 MET HB3 H 1 2.542 0.02 . 2 . . . . 30 MET HB3 . 15437 1 369 . 1 1 30 30 MET HG2 H 1 2.814 0.02 . 2 . . . . 30 MET HG2 . 15437 1 370 . 1 1 30 30 MET HG3 H 1 2.814 0.02 . 2 . . . . 30 MET HG3 . 15437 1 371 . 1 1 30 30 MET C C 13 177 0.2 . 1 . . . . 30 MET C . 15437 1 372 . 1 1 30 30 MET CA C 13 56.88 0.2 . 1 . . . . 30 MET CA . 15437 1 373 . 1 1 30 30 MET CB C 13 32.34 0.2 . 1 . . . . 30 MET CB . 15437 1 374 . 1 1 30 30 MET CG C 13 30.77 0.2 . 1 . . . . 30 MET CG . 15437 1 375 . 1 1 30 30 MET N N 15 121.1 0.2 . 1 . . . . 30 MET N . 15437 1 376 . 1 1 31 31 ASN H H 1 8.186 0.02 . 1 . . . . 31 ASN HN . 15437 1 377 . 1 1 31 31 ASN HA H 1 4.311 0.02 . 1 . . . . 31 ASN HA . 15437 1 378 . 1 1 31 31 ASN HB2 H 1 2.743 0.02 . 2 . . . . 31 ASN HB2 . 15437 1 379 . 1 1 31 31 ASN HB3 H 1 2.743 0.02 . 2 . . . . 31 ASN HB3 . 15437 1 380 . 1 1 31 31 ASN HD21 H 1 7.508 0.02 . 2 . . . . 31 ASN HD21 . 15437 1 381 . 1 1 31 31 ASN HD22 H 1 6.865 0.02 . 2 . . . . 31 ASN HD22 . 15437 1 382 . 1 1 31 31 ASN C C 13 176.7 0.2 . 1 . . . . 31 ASN C . 15437 1 383 . 1 1 31 31 ASN CA C 13 55.32 0.2 . 1 . . . . 31 ASN CA . 15437 1 384 . 1 1 31 31 ASN CB C 13 38.41 0.2 . 1 . . . . 31 ASN CB . 15437 1 385 . 1 1 31 31 ASN N N 15 117.9 0.2 . 1 . . . . 31 ASN N . 15437 1 386 . 1 1 31 31 ASN ND2 N 15 112 0.2 . 1 . . . . 31 ASN ND2 . 15437 1 387 . 1 1 32 32 LYS H H 1 7.792 0.02 . 1 . . . . 32 LYS HN . 15437 1 388 . 1 1 32 32 LYS HA H 1 3.992 0.02 . 1 . . . . 32 LYS HA . 15437 1 389 . 1 1 32 32 LYS HB2 H 1 1.795 0.02 . 2 . . . . 32 LYS HB2 . 15437 1 390 . 1 1 32 32 LYS HB3 H 1 1.795 0.02 . 2 . . . . 32 LYS HB3 . 15437 1 391 . 1 1 32 32 LYS HD2 H 1 1.442 0.02 . 2 . . . . 32 LYS HD2 . 15437 1 392 . 1 1 32 32 LYS HD3 H 1 1.442 0.02 . 2 . . . . 32 LYS HD3 . 15437 1 393 . 1 1 32 32 LYS HE2 H 1 2.927 0.02 . 2 . . . . 32 LYS HE2 . 15437 1 394 . 1 1 32 32 LYS HE3 H 1 2.927 0.02 . 2 . . . . 32 LYS HE3 . 15437 1 395 . 1 1 32 32 LYS HG2 H 1 1.321 0.02 . 2 . . . . 32 LYS HG2 . 15437 1 396 . 1 1 32 32 LYS HG3 H 1 1.321 0.02 . 2 . . . . 32 LYS HG3 . 15437 1 397 . 1 1 32 32 LYS C C 13 177.9 0.2 . 1 . . . . 32 LYS C . 15437 1 398 . 1 1 32 32 LYS CA C 13 59.05 0.2 . 1 . . . . 32 LYS CA . 15437 1 399 . 1 1 32 32 LYS CB C 13 32.46 0.2 . 1 . . . . 32 LYS CB . 15437 1 400 . 1 1 32 32 LYS CD C 13 29.27 0.2 . 1 . . . . 32 LYS CD . 15437 1 401 . 1 1 32 32 LYS CE C 13 42.1 0.2 . 1 . . . . 32 LYS CE . 15437 1 402 . 1 1 32 32 LYS CG C 13 24.89 0.2 . 1 . . . . 32 LYS CG . 15437 1 403 . 1 1 32 32 LYS N N 15 120.4 0.2 . 1 . . . . 32 LYS N . 15437 1 404 . 1 1 33 33 VAL H H 1 7.689 0.02 . 1 . . . . 33 VAL HN . 15437 1 405 . 1 1 33 33 VAL HA H 1 3.791 0.02 . 1 . . . . 33 VAL HA . 15437 1 406 . 1 1 33 33 VAL HB H 1 1.932 0.02 . 1 . . . . 33 VAL HB . 15437 1 407 . 1 1 33 33 VAL HG11 H 1 0.9561 0.02 . 2 . . . . 33 VAL HG1 . 15437 1 408 . 1 1 33 33 VAL HG12 H 1 0.9561 0.02 . 2 . . . . 33 VAL HG1 . 15437 1 409 . 1 1 33 33 VAL HG13 H 1 0.9561 0.02 . 2 . . . . 33 VAL HG1 . 15437 1 410 . 1 1 33 33 VAL HG21 H 1 0.7562 0.02 . 2 . . . . 33 VAL HG2 . 15437 1 411 . 1 1 33 33 VAL HG22 H 1 0.7562 0.02 . 2 . . . . 33 VAL HG2 . 15437 1 412 . 1 1 33 33 VAL HG23 H 1 0.7562 0.02 . 2 . . . . 33 VAL HG2 . 15437 1 413 . 1 1 33 33 VAL C C 13 177.1 0.2 . 1 . . . . 33 VAL C . 15437 1 414 . 1 1 33 33 VAL CA C 13 65.36 0.2 . 1 . . . . 33 VAL CA . 15437 1 415 . 1 1 33 33 VAL CB C 13 31.92 0.2 . 1 . . . . 33 VAL CB . 15437 1 416 . 1 1 33 33 VAL CG1 C 13 22.76 0.2 . 2 . . . . 33 VAL CG1 . 15437 1 417 . 1 1 33 33 VAL CG2 C 13 21.13 0.2 . 2 . . . . 33 VAL CG2 . 15437 1 418 . 1 1 33 33 VAL N N 15 120.2 0.2 . 1 . . . . 33 VAL N . 15437 1 419 . 1 1 34 34 ASP H H 1 8.408 0.02 . 1 . . . . 34 ASP HN . 15437 1 420 . 1 1 34 34 ASP HA H 1 4.303 0.02 . 1 . . . . 34 ASP HA . 15437 1 421 . 1 1 34 34 ASP HB2 H 1 2.714 0.02 . 2 . . . . 34 ASP HB2 . 15437 1 422 . 1 1 34 34 ASP HB3 H 1 2.714 0.02 . 2 . . . . 34 ASP HB3 . 15437 1 423 . 1 1 34 34 ASP C C 13 178.2 0.2 . 1 . . . . 34 ASP C . 15437 1 424 . 1 1 34 34 ASP CA C 13 55.88 0.2 . 1 . . . . 34 ASP CA . 15437 1 425 . 1 1 34 34 ASP CB C 13 38.71 0.2 . 1 . . . . 34 ASP CB . 15437 1 426 . 1 1 34 34 ASP N N 15 120.1 0.2 . 1 . . . . 34 ASP N . 15437 1 427 . 1 1 35 35 HIS H H 1 8.204 0.02 . 1 . . . . 35 HIS HN . 15437 1 428 . 1 1 35 35 HIS HA H 1 4.343 0.02 . 1 . . . . 35 HIS HA . 15437 1 429 . 1 1 35 35 HIS HB2 H 1 3.137 0.02 . 2 . . . . 35 HIS HB2 . 15437 1 430 . 1 1 35 35 HIS HB3 H 1 3.137 0.02 . 2 . . . . 35 HIS HB3 . 15437 1 431 . 1 1 35 35 HIS C C 13 176.8 0.2 . 1 . . . . 35 HIS C . 15437 1 432 . 1 1 35 35 HIS CA C 13 58.31 0.2 . 1 . . . . 35 HIS CA . 15437 1 433 . 1 1 35 35 HIS CB C 13 28.07 0.2 . 1 . . . . 35 HIS CB . 15437 1 434 . 1 1 35 35 HIS N N 15 118.2 0.2 . 1 . . . . 35 HIS N . 15437 1 435 . 1 1 36 36 HIS H H 1 8.067 0.02 . 1 . . . . 36 HIS HN . 15437 1 436 . 1 1 36 36 HIS HA H 1 4.602 0.02 . 1 . . . . 36 HIS HA . 15437 1 437 . 1 1 36 36 HIS HB2 H 1 3.276 0.02 . 2 . . . . 36 HIS HB2 . 15437 1 438 . 1 1 36 36 HIS HB3 H 1 3.276 0.02 . 2 . . . . 36 HIS HB3 . 15437 1 439 . 1 1 36 36 HIS HD2 H 1 7.434 0.02 . 1 . . . . 36 HIS HD2 . 15437 1 440 . 1 1 36 36 HIS C C 13 177.1 0.2 . 1 . . . . 36 HIS C . 15437 1 441 . 1 1 36 36 HIS CA C 13 58.52 0.2 . 1 . . . . 36 HIS CA . 15437 1 442 . 1 1 36 36 HIS CB C 13 28.72 0.2 . 1 . . . . 36 HIS CB . 15437 1 443 . 1 1 36 36 HIS N N 15 117.1 0.2 . 1 . . . . 36 HIS N . 15437 1 444 . 1 1 37 37 LEU H H 1 8.473 0.02 . 1 . . . . 37 LEU HN . 15437 1 445 . 1 1 37 37 LEU HA H 1 3.894 0.02 . 1 . . . . 37 LEU HA . 15437 1 446 . 1 1 37 37 LEU HB2 H 1 1.887 0.02 . 2 . . . . 37 LEU HB2 . 15437 1 447 . 1 1 37 37 LEU HB3 H 1 1.517 0.02 . 2 . . . . 37 LEU HB3 . 15437 1 448 . 1 1 37 37 LEU HD11 H 1 0.7807 0.02 . 2 . . . . 37 LEU HD1 . 15437 1 449 . 1 1 37 37 LEU HD12 H 1 0.7807 0.02 . 2 . . . . 37 LEU HD1 . 15437 1 450 . 1 1 37 37 LEU HD13 H 1 0.7807 0.02 . 2 . . . . 37 LEU HD1 . 15437 1 451 . 1 1 37 37 LEU HD21 H 1 0.7807 0.02 . 2 . . . . 37 LEU HD2 . 15437 1 452 . 1 1 37 37 LEU HD22 H 1 0.7807 0.02 . 2 . . . . 37 LEU HD2 . 15437 1 453 . 1 1 37 37 LEU HD23 H 1 0.7807 0.02 . 2 . . . . 37 LEU HD2 . 15437 1 454 . 1 1 37 37 LEU HG H 1 1.716 0.02 . 1 . . . . 37 LEU HG . 15437 1 455 . 1 1 37 37 LEU C C 13 178.2 0.2 . 1 . . . . 37 LEU C . 15437 1 456 . 1 1 37 37 LEU CA C 13 58.52 0.2 . 1 . . . . 37 LEU CA . 15437 1 457 . 1 1 37 37 LEU CB C 13 41.81 0.2 . 1 . . . . 37 LEU CB . 15437 1 458 . 1 1 37 37 LEU CD1 C 13 25.73 0.2 . 2 . . . . 37 LEU CD1 . 15437 1 459 . 1 1 37 37 LEU CD2 C 13 24.65 0.2 . 2 . . . . 37 LEU CD2 . 15437 1 460 . 1 1 37 37 LEU CG C 13 27.29 0.2 . 1 . . . . 37 LEU CG . 15437 1 461 . 1 1 37 37 LEU N N 15 119.6 0.2 . 1 . . . . 37 LEU N . 15437 1 462 . 1 1 38 38 GLN H H 1 8.337 0.02 . 1 . . . . 38 GLN HN . 15437 1 463 . 1 1 38 38 GLN HA H 1 3.882 0.02 . 1 . . . . 38 GLN HA . 15437 1 464 . 1 1 38 38 GLN HB2 H 1 2.039 0.02 . 2 . . . . 38 GLN HB2 . 15437 1 465 . 1 1 38 38 GLN HB3 H 1 1.901 0.02 . 2 . . . . 38 GLN HB3 . 15437 1 466 . 1 1 38 38 GLN HE21 H 1 7.423 0.02 . 2 . . . . 38 GLN HE21 . 15437 1 467 . 1 1 38 38 GLN HE22 H 1 6.802 0.02 . 2 . . . . 38 GLN HE22 . 15437 1 468 . 1 1 38 38 GLN HG2 H 1 2.31 0.02 . 2 . . . . 38 GLN HG2 . 15437 1 469 . 1 1 38 38 GLN HG3 H 1 2.127 0.02 . 2 . . . . 38 GLN HG3 . 15437 1 470 . 1 1 38 38 GLN C C 13 178.5 0.2 . 1 . . . . 38 GLN C . 15437 1 471 . 1 1 38 38 GLN CA C 13 59.2 0.2 . 1 . . . . 38 GLN CA . 15437 1 472 . 1 1 38 38 GLN CB C 13 27.85 0.2 . 1 . . . . 38 GLN CB . 15437 1 473 . 1 1 38 38 GLN CG C 13 33.91 0.2 . 1 . . . . 38 GLN CG . 15437 1 474 . 1 1 38 38 GLN N N 15 118 0.2 . 1 . . . . 38 GLN N . 15437 1 475 . 1 1 38 38 GLN NE2 N 15 111.6 0.2 . 1 . . . . 38 GLN NE2 . 15437 1 476 . 1 1 39 39 ASN H H 1 7.923 0.02 . 1 . . . . 39 ASN HN . 15437 1 477 . 1 1 39 39 ASN HA H 1 4.39 0.02 . 1 . . . . 39 ASN HA . 15437 1 478 . 1 1 39 39 ASN HB2 H 1 3.075 0.02 . 2 . . . . 39 ASN HB2 . 15437 1 479 . 1 1 39 39 ASN HB3 H 1 2.811 0.02 . 2 . . . . 39 ASN HB3 . 15437 1 480 . 1 1 39 39 ASN HD21 H 1 7.826 0.02 . 2 . . . . 39 ASN HD21 . 15437 1 481 . 1 1 39 39 ASN HD22 H 1 6.464 0.02 . 2 . . . . 39 ASN HD22 . 15437 1 482 . 1 1 39 39 ASN C C 13 177.5 0.2 . 1 . . . . 39 ASN C . 15437 1 483 . 1 1 39 39 ASN CA C 13 55.78 0.2 . 1 . . . . 39 ASN CA . 15437 1 484 . 1 1 39 39 ASN CB C 13 37.45 0.2 . 1 . . . . 39 ASN CB . 15437 1 485 . 1 1 39 39 ASN N N 15 118.7 0.2 . 1 . . . . 39 ASN N . 15437 1 486 . 1 1 39 39 ASN ND2 N 15 110.3 0.2 . 1 . . . . 39 ASN ND2 . 15437 1 487 . 1 1 40 40 VAL H H 1 7.907 0.02 . 1 . . . . 40 VAL HN . 15437 1 488 . 1 1 40 40 VAL HA H 1 3.629 0.02 . 1 . . . . 40 VAL HA . 15437 1 489 . 1 1 40 40 VAL HB H 1 2.174 0.02 . 1 . . . . 40 VAL HB . 15437 1 490 . 1 1 40 40 VAL HG11 H 1 0.9479 0.02 . 2 . . . . 40 VAL HG1 . 15437 1 491 . 1 1 40 40 VAL HG12 H 1 0.9479 0.02 . 2 . . . . 40 VAL HG1 . 15437 1 492 . 1 1 40 40 VAL HG13 H 1 0.9479 0.02 . 2 . . . . 40 VAL HG1 . 15437 1 493 . 1 1 40 40 VAL HG21 H 1 0.7661 0.02 . 2 . . . . 40 VAL HG2 . 15437 1 494 . 1 1 40 40 VAL HG22 H 1 0.7661 0.02 . 2 . . . . 40 VAL HG2 . 15437 1 495 . 1 1 40 40 VAL HG23 H 1 0.7661 0.02 . 2 . . . . 40 VAL HG2 . 15437 1 496 . 1 1 40 40 VAL C C 13 177.5 0.2 . 1 . . . . 40 VAL C . 15437 1 497 . 1 1 40 40 VAL CA C 13 67.08 0.2 . 1 . . . . 40 VAL CA . 15437 1 498 . 1 1 40 40 VAL CB C 13 31.39 0.2 . 1 . . . . 40 VAL CB . 15437 1 499 . 1 1 40 40 VAL CG1 C 13 23.05 0.2 . 2 . . . . 40 VAL CG1 . 15437 1 500 . 1 1 40 40 VAL CG2 C 13 22.16 0.2 . 2 . . . . 40 VAL CG2 . 15437 1 501 . 1 1 40 40 VAL N N 15 120.4 0.2 . 1 . . . . 40 VAL N . 15437 1 502 . 1 1 41 41 ILE H H 1 8.103 0.02 . 1 . . . . 41 ILE HN . 15437 1 503 . 1 1 41 41 ILE HA H 1 3.401 0.02 . 1 . . . . 41 ILE HA . 15437 1 504 . 1 1 41 41 ILE HB H 1 1.904 0.02 . 1 . . . . 41 ILE HB . 15437 1 505 . 1 1 41 41 ILE HD11 H 1 0.6862 0.02 . 1 . . . . 41 ILE HD1 . 15437 1 506 . 1 1 41 41 ILE HD12 H 1 0.6862 0.02 . 1 . . . . 41 ILE HD1 . 15437 1 507 . 1 1 41 41 ILE HD13 H 1 0.6862 0.02 . 1 . . . . 41 ILE HD1 . 15437 1 508 . 1 1 41 41 ILE HG12 H 1 0.8238 0.02 . 2 . . . . 41 ILE HG12 . 15437 1 509 . 1 1 41 41 ILE HG13 H 1 0.8238 0.02 . 2 . . . . 41 ILE HG13 . 15437 1 510 . 1 1 41 41 ILE HG21 H 1 0.832 0.02 . 1 . . . . 41 ILE HG2 . 15437 1 511 . 1 1 41 41 ILE HG22 H 1 0.832 0.02 . 1 . . . . 41 ILE HG2 . 15437 1 512 . 1 1 41 41 ILE HG23 H 1 0.832 0.02 . 1 . . . . 41 ILE HG2 . 15437 1 513 . 1 1 41 41 ILE C C 13 178 0.2 . 1 . . . . 41 ILE C . 15437 1 514 . 1 1 41 41 ILE CA C 13 66.43 0.2 . 1 . . . . 41 ILE CA . 15437 1 515 . 1 1 41 41 ILE CB C 13 38.05 0.2 . 1 . . . . 41 ILE CB . 15437 1 516 . 1 1 41 41 ILE CD1 C 13 13.45 0.2 . 1 . . . . 41 ILE CD1 . 15437 1 517 . 1 1 41 41 ILE CG1 C 13 31.02 0.2 . 1 . . . . 41 ILE CG1 . 15437 1 518 . 1 1 41 41 ILE CG2 C 13 17.07 0.2 . 1 . . . . 41 ILE CG2 . 15437 1 519 . 1 1 41 41 ILE N N 15 120.6 0.2 . 1 . . . . 41 ILE N . 15437 1 520 . 1 1 42 42 GLU H H 1 8.15 0.02 . 1 . . . . 42 GLU HN . 15437 1 521 . 1 1 42 42 GLU HA H 1 4.062 0.02 . 1 . . . . 42 GLU HA . 15437 1 522 . 1 1 42 42 GLU HB2 H 1 2.144 0.02 . 2 . . . . 42 GLU HB2 . 15437 1 523 . 1 1 42 42 GLU HB3 H 1 2.144 0.02 . 2 . . . . 42 GLU HB3 . 15437 1 524 . 1 1 42 42 GLU HG2 H 1 2.466 0.02 . 2 . . . . 42 GLU HG2 . 15437 1 525 . 1 1 42 42 GLU HG3 H 1 2.466 0.02 . 2 . . . . 42 GLU HG3 . 15437 1 526 . 1 1 42 42 GLU C C 13 178.5 0.2 . 1 . . . . 42 GLU C . 15437 1 527 . 1 1 42 42 GLU CA C 13 59.12 0.2 . 1 . . . . 42 GLU CA . 15437 1 528 . 1 1 42 42 GLU CB C 13 28.16 0.2 . 1 . . . . 42 GLU CB . 15437 1 529 . 1 1 42 42 GLU CG C 13 34.4 0.2 . 1 . . . . 42 GLU CG . 15437 1 530 . 1 1 42 42 GLU N N 15 119.9 0.2 . 1 . . . . 42 GLU N . 15437 1 531 . 1 1 43 43 ASP H H 1 8.453 0.02 . 1 . . . . 43 ASP HN . 15437 1 532 . 1 1 43 43 ASP HA H 1 4.445 0.02 . 1 . . . . 43 ASP HA . 15437 1 533 . 1 1 43 43 ASP HB2 H 1 3.192 0.02 . 2 . . . . 43 ASP HB2 . 15437 1 534 . 1 1 43 43 ASP HB3 H 1 2.716 0.02 . 2 . . . . 43 ASP HB3 . 15437 1 535 . 1 1 43 43 ASP C C 13 178.4 0.2 . 1 . . . . 43 ASP C . 15437 1 536 . 1 1 43 43 ASP CA C 13 56.49 0.2 . 1 . . . . 43 ASP CA . 15437 1 537 . 1 1 43 43 ASP CB C 13 37.82 0.2 . 1 . . . . 43 ASP CB . 15437 1 538 . 1 1 43 43 ASP N N 15 119.7 0.2 . 1 . . . . 43 ASP N . 15437 1 539 . 1 1 44 44 ILE H H 1 8.544 0.02 . 1 . . . . 44 ILE HN . 15437 1 540 . 1 1 44 44 ILE HA H 1 3.59 0.02 . 1 . . . . 44 ILE HA . 15437 1 541 . 1 1 44 44 ILE HB H 1 1.962 0.02 . 1 . . . . 44 ILE HB . 15437 1 542 . 1 1 44 44 ILE HD11 H 1 0.6807 0.02 . 1 . . . . 44 ILE HD1 . 15437 1 543 . 1 1 44 44 ILE HD12 H 1 0.6807 0.02 . 1 . . . . 44 ILE HD1 . 15437 1 544 . 1 1 44 44 ILE HD13 H 1 0.6807 0.02 . 1 . . . . 44 ILE HD1 . 15437 1 545 . 1 1 44 44 ILE HG12 H 1 0.8519 0.02 . 2 . . . . 44 ILE HG12 . 15437 1 546 . 1 1 44 44 ILE HG13 H 1 0.8519 0.02 . 2 . . . . 44 ILE HG13 . 15437 1 547 . 1 1 44 44 ILE HG21 H 1 0.8629 0.02 . 1 . . . . 44 ILE HG2 . 15437 1 548 . 1 1 44 44 ILE HG22 H 1 0.8629 0.02 . 1 . . . . 44 ILE HG2 . 15437 1 549 . 1 1 44 44 ILE HG23 H 1 0.8629 0.02 . 1 . . . . 44 ILE HG2 . 15437 1 550 . 1 1 44 44 ILE C C 13 177.8 0.2 . 1 . . . . 44 ILE C . 15437 1 551 . 1 1 44 44 ILE CA C 13 66.32 0.2 . 1 . . . . 44 ILE CA . 15437 1 552 . 1 1 44 44 ILE CB C 13 37.69 0.2 . 1 . . . . 44 ILE CB . 15437 1 553 . 1 1 44 44 ILE CD1 C 13 14.4 0.2 . 1 . . . . 44 ILE CD1 . 15437 1 554 . 1 1 44 44 ILE CG1 C 13 29.83 0.2 . 1 . . . . 44 ILE CG1 . 15437 1 555 . 1 1 44 44 ILE CG2 C 13 18.6 0.2 . 1 . . . . 44 ILE CG2 . 15437 1 556 . 1 1 44 44 ILE N N 15 121.5 0.2 . 1 . . . . 44 ILE N . 15437 1 557 . 1 1 45 45 HIS H H 1 8.261 0.02 . 1 . . . . 45 HIS HN . 15437 1 558 . 1 1 45 45 HIS HA H 1 4.255 0.02 . 1 . . . . 45 HIS HA . 15437 1 559 . 1 1 45 45 HIS HB2 H 1 3.406 0.02 . 2 . . . . 45 HIS HB2 . 15437 1 560 . 1 1 45 45 HIS HB3 H 1 3.406 0.02 . 2 . . . . 45 HIS HB3 . 15437 1 561 . 1 1 45 45 HIS HD2 H 1 7.293 0.02 . 1 . . . . 45 HIS HD2 . 15437 1 562 . 1 1 45 45 HIS C C 13 177.2 0.2 . 1 . . . . 45 HIS C . 15437 1 563 . 1 1 45 45 HIS CA C 13 59.58 0.2 . 1 . . . . 45 HIS CA . 15437 1 564 . 1 1 45 45 HIS CB C 13 27.79 0.2 . 1 . . . . 45 HIS CB . 15437 1 565 . 1 1 45 45 HIS N N 15 118.8 0.2 . 1 . . . . 45 HIS N . 15437 1 566 . 1 1 46 46 ASP H H 1 8.68 0.02 . 1 . . . . 46 ASP HN . 15437 1 567 . 1 1 46 46 ASP HA H 1 4.338 0.02 . 1 . . . . 46 ASP HA . 15437 1 568 . 1 1 46 46 ASP HB2 H 1 2.753 0.02 . 2 . . . . 46 ASP HB2 . 15437 1 569 . 1 1 46 46 ASP HB3 H 1 2.937 0.02 . 2 . . . . 46 ASP HB3 . 15437 1 570 . 1 1 46 46 ASP C C 13 178.7 0.2 . 1 . . . . 46 ASP C . 15437 1 571 . 1 1 46 46 ASP CA C 13 57.01 0.2 . 1 . . . . 46 ASP CA . 15437 1 572 . 1 1 46 46 ASP CB C 13 39.4 0.2 . 1 . . . . 46 ASP CB . 15437 1 573 . 1 1 46 46 ASP N N 15 119.2 0.2 . 1 . . . . 46 ASP N . 15437 1 574 . 1 1 47 47 PHE H H 1 8.38 0.02 . 1 . . . . 47 PHE HN . 15437 1 575 . 1 1 47 47 PHE HA H 1 4.07 0.02 . 1 . . . . 47 PHE HA . 15437 1 576 . 1 1 47 47 PHE HB2 H 1 3.186 0.02 . 2 . . . . 47 PHE HB2 . 15437 1 577 . 1 1 47 47 PHE HB3 H 1 3.116 0.02 . 2 . . . . 47 PHE HB3 . 15437 1 578 . 1 1 47 47 PHE HD1 H 1 7.102 0.02 . 3 . . . . 47 PHE HD1 . 15437 1 579 . 1 1 47 47 PHE HD2 H 1 7.102 0.02 . 3 . . . . 47 PHE HD2 . 15437 1 580 . 1 1 47 47 PHE C C 13 178.6 0.2 . 1 . . . . 47 PHE C . 15437 1 581 . 1 1 47 47 PHE CA C 13 61.25 0.2 . 1 . . . . 47 PHE CA . 15437 1 582 . 1 1 47 47 PHE CB C 13 39.57 0.2 . 1 . . . . 47 PHE CB . 15437 1 583 . 1 1 47 47 PHE N N 15 121.8 0.2 . 1 . . . . 47 PHE N . 15437 1 584 . 1 1 48 48 MET H H 1 8.366 0.02 . 1 . . . . 48 MET HN . 15437 1 585 . 1 1 48 48 MET HA H 1 3.998 0.02 . 1 . . . . 48 MET HA . 15437 1 586 . 1 1 48 48 MET HB2 H 1 2.166 0.02 . 2 . . . . 48 MET HB2 . 15437 1 587 . 1 1 48 48 MET HB3 H 1 2.166 0.02 . 2 . . . . 48 MET HB3 . 15437 1 588 . 1 1 48 48 MET HG2 H 1 2.51 0.02 . 2 . . . . 48 MET HG2 . 15437 1 589 . 1 1 48 48 MET HG3 H 1 2.773 0.02 . 2 . . . . 48 MET HG3 . 15437 1 590 . 1 1 48 48 MET C C 13 177.4 0.2 . 1 . . . . 48 MET C . 15437 1 591 . 1 1 48 48 MET CA C 13 58.47 0.2 . 1 . . . . 48 MET CA . 15437 1 592 . 1 1 48 48 MET CB C 13 33.17 0.2 . 1 . . . . 48 MET CB . 15437 1 593 . 1 1 48 48 MET CG C 13 32.58 0.2 . 1 . . . . 48 MET CG . 15437 1 594 . 1 1 48 48 MET N N 15 117.7 0.2 . 1 . . . . 48 MET N . 15437 1 595 . 1 1 49 49 GLN H H 1 7.659 0.02 . 1 . . . . 49 GLN HN . 15437 1 596 . 1 1 49 49 GLN HA H 1 4.258 0.02 . 1 . . . . 49 GLN HA . 15437 1 597 . 1 1 49 49 GLN HB2 H 1 2.13 0.02 . 2 . . . . 49 GLN HB2 . 15437 1 598 . 1 1 49 49 GLN HB3 H 1 1.977 0.02 . 2 . . . . 49 GLN HB3 . 15437 1 599 . 1 1 49 49 GLN HE21 H 1 7.3 0.02 . 2 . . . . 49 GLN HE21 . 15437 1 600 . 1 1 49 49 GLN HE22 H 1 6.791 0.02 . 2 . . . . 49 GLN HE22 . 15437 1 601 . 1 1 49 49 GLN HG2 H 1 2.295 0.02 . 2 . . . . 49 GLN HG2 . 15437 1 602 . 1 1 49 49 GLN HG3 H 1 2.302 0.02 . 2 . . . . 49 GLN HG3 . 15437 1 603 . 1 1 49 49 GLN C C 13 176.7 0.2 . 1 . . . . 49 GLN C . 15437 1 604 . 1 1 49 49 GLN CA C 13 56.38 0.2 . 1 . . . . 49 GLN CA . 15437 1 605 . 1 1 49 49 GLN CB C 13 28.98 0.2 . 1 . . . . 49 GLN CB . 15437 1 606 . 1 1 49 49 GLN CG C 13 33.81 0.2 . 1 . . . . 49 GLN CG . 15437 1 607 . 1 1 49 49 GLN N N 15 116.7 0.2 . 1 . . . . 49 GLN N . 15437 1 608 . 1 1 49 49 GLN NE2 N 15 111.5 0.2 . 1 . . . . 49 GLN NE2 . 15437 1 609 . 1 1 50 50 GLY H H 1 7.685 0.02 . 1 . . . . 50 GLY HN . 15437 1 610 . 1 1 50 50 GLY HA2 H 1 3.998 0.02 . 2 . . . . 50 GLY HA2 . 15437 1 611 . 1 1 50 50 GLY HA3 H 1 3.998 0.02 . 2 . . . . 50 GLY HA3 . 15437 1 612 . 1 1 50 50 GLY C C 13 174.9 0.2 . 1 . . . . 50 GLY C . 15437 1 613 . 1 1 50 50 GLY CA C 13 45.46 0.2 . 1 . . . . 50 GLY CA . 15437 1 614 . 1 1 50 50 GLY N N 15 106.4 0.2 . 1 . . . . 50 GLY N . 15437 1 615 . 1 1 51 51 GLY H H 1 8.031 0.02 . 1 . . . . 51 GLY HN . 15437 1 616 . 1 1 51 51 GLY HA2 H 1 3.817 0.02 . 2 . . . . 51 GLY HA2 . 15437 1 617 . 1 1 51 51 GLY HA3 H 1 3.817 0.02 . 2 . . . . 51 GLY HA3 . 15437 1 618 . 1 1 51 51 GLY C C 13 174.5 0.2 . 1 . . . . 51 GLY C . 15437 1 619 . 1 1 51 51 GLY CA C 13 45.19 0.2 . 1 . . . . 51 GLY CA . 15437 1 620 . 1 1 51 51 GLY N N 15 108.9 0.2 . 1 . . . . 51 GLY N . 15437 1 621 . 1 1 52 52 GLY H H 1 8.126 0.02 . 1 . . . . 52 GLY HN . 15437 1 622 . 1 1 52 52 GLY HA2 H 1 3.362 0.02 . 2 . . . . 52 GLY HA2 . 15437 1 623 . 1 1 52 52 GLY HA3 H 1 3.362 0.02 . 2 . . . . 52 GLY HA3 . 15437 1 624 . 1 1 52 52 GLY C C 13 173.3 0.2 . 1 . . . . 52 GLY C . 15437 1 625 . 1 1 52 52 GLY CA C 13 45.12 0.2 . 1 . . . . 52 GLY CA . 15437 1 626 . 1 1 52 52 GLY N N 15 108.1 0.2 . 1 . . . . 52 GLY N . 15437 1 627 . 1 1 53 53 SER H H 1 7.594 0.02 . 1 . . . . 53 SER HN . 15437 1 628 . 1 1 53 53 SER HA H 1 4.53 0.02 . 1 . . . . 53 SER HA . 15437 1 629 . 1 1 53 53 SER HB2 H 1 4.042 0.02 . 2 . . . . 53 SER HB2 . 15437 1 630 . 1 1 53 53 SER HB3 H 1 3.94 0.02 . 2 . . . . 53 SER HB3 . 15437 1 631 . 1 1 53 53 SER C C 13 175.3 0.2 . 1 . . . . 53 SER C . 15437 1 632 . 1 1 53 53 SER CA C 13 57.77 0.2 . 1 . . . . 53 SER CA . 15437 1 633 . 1 1 53 53 SER CB C 13 64.75 0.2 . 1 . . . . 53 SER CB . 15437 1 634 . 1 1 53 53 SER N N 15 114.1 0.2 . 1 . . . . 53 SER N . 15437 1 635 . 1 1 54 54 GLY H H 1 9.003 0.02 . 1 . . . . 54 GLY HN . 15437 1 636 . 1 1 54 54 GLY HA2 H 1 4.037 0.02 . 2 . . . . 54 GLY HA2 . 15437 1 637 . 1 1 54 54 GLY HA3 H 1 3.911 0.02 . 2 . . . . 54 GLY HA3 . 15437 1 638 . 1 1 54 54 GLY C C 13 176.5 0.2 . 1 . . . . 54 GLY C . 15437 1 639 . 1 1 54 54 GLY CA C 13 47.04 0.2 . 1 . . . . 54 GLY CA . 15437 1 640 . 1 1 54 54 GLY N N 15 110.4 0.2 . 1 . . . . 54 GLY N . 15437 1 641 . 1 1 55 55 GLY H H 1 8.617 0.02 . 1 . . . . 55 GLY HN . 15437 1 642 . 1 1 55 55 GLY HA2 H 1 3.946 0.02 . 2 . . . . 55 GLY HA2 . 15437 1 643 . 1 1 55 55 GLY HA3 H 1 3.946 0.02 . 2 . . . . 55 GLY HA3 . 15437 1 644 . 1 1 55 55 GLY C C 13 176.4 0.2 . 1 . . . . 55 GLY C . 15437 1 645 . 1 1 55 55 GLY CA C 13 46.63 0.2 . 1 . . . . 55 GLY CA . 15437 1 646 . 1 1 55 55 GLY N N 15 109.8 0.2 . 1 . . . . 55 GLY N . 15437 1 647 . 1 1 56 56 LYS H H 1 7.876 0.02 . 1 . . . . 56 LYS HN . 15437 1 648 . 1 1 56 56 LYS HA H 1 4.195 0.02 . 1 . . . . 56 LYS HA . 15437 1 649 . 1 1 56 56 LYS HB2 H 1 1.922 0.02 . 2 . . . . 56 LYS HB2 . 15437 1 650 . 1 1 56 56 LYS HB3 H 1 1.922 0.02 . 2 . . . . 56 LYS HB3 . 15437 1 651 . 1 1 56 56 LYS HD2 H 1 1.711 0.02 . 2 . . . . 56 LYS HD2 . 15437 1 652 . 1 1 56 56 LYS HD3 H 1 1.711 0.02 . 2 . . . . 56 LYS HD3 . 15437 1 653 . 1 1 56 56 LYS HE2 H 1 2.935 0.02 . 2 . . . . 56 LYS HE2 . 15437 1 654 . 1 1 56 56 LYS HE3 H 1 2.935 0.02 . 2 . . . . 56 LYS HE3 . 15437 1 655 . 1 1 56 56 LYS HG2 H 1 1.513 0.02 . 2 . . . . 56 LYS HG2 . 15437 1 656 . 1 1 56 56 LYS HG3 H 1 1.513 0.02 . 2 . . . . 56 LYS HG3 . 15437 1 657 . 1 1 56 56 LYS C C 13 178.6 0.2 . 1 . . . . 56 LYS C . 15437 1 658 . 1 1 56 56 LYS CA C 13 57.96 0.2 . 1 . . . . 56 LYS CA . 15437 1 659 . 1 1 56 56 LYS CB C 13 32.11 0.2 . 1 . . . . 56 LYS CB . 15437 1 660 . 1 1 56 56 LYS CD C 13 28.43 0.2 . 1 . . . . 56 LYS CD . 15437 1 661 . 1 1 56 56 LYS CE C 13 41.9 0.2 . 1 . . . . 56 LYS CE . 15437 1 662 . 1 1 56 56 LYS CG C 13 25.03 0.2 . 1 . . . . 56 LYS CG . 15437 1 663 . 1 1 56 56 LYS N N 15 121.8 0.2 . 1 . . . . 56 LYS N . 15437 1 664 . 1 1 57 57 LEU H H 1 8.153 0.02 . 1 . . . . 57 LEU HN . 15437 1 665 . 1 1 57 57 LEU HA H 1 3.992 0.02 . 1 . . . . 57 LEU HA . 15437 1 666 . 1 1 57 57 LEU HB2 H 1 1.787 0.02 . 2 . . . . 57 LEU HB2 . 15437 1 667 . 1 1 57 57 LEU HB3 H 1 1.636 0.02 . 2 . . . . 57 LEU HB3 . 15437 1 668 . 1 1 57 57 LEU HD11 H 1 0.6901 0.02 . 2 . . . . 57 LEU HD1 . 15437 1 669 . 1 1 57 57 LEU HD12 H 1 0.6901 0.02 . 2 . . . . 57 LEU HD1 . 15437 1 670 . 1 1 57 57 LEU HD13 H 1 0.6901 0.02 . 2 . . . . 57 LEU HD1 . 15437 1 671 . 1 1 57 57 LEU HD21 H 1 0.6291 0.02 . 2 . . . . 57 LEU HD2 . 15437 1 672 . 1 1 57 57 LEU HD22 H 1 0.6291 0.02 . 2 . . . . 57 LEU HD2 . 15437 1 673 . 1 1 57 57 LEU HD23 H 1 0.6291 0.02 . 2 . . . . 57 LEU HD2 . 15437 1 674 . 1 1 57 57 LEU HG H 1 1.485 0.02 . 1 . . . . 57 LEU HG . 15437 1 675 . 1 1 57 57 LEU C C 13 178.4 0.2 . 1 . . . . 57 LEU C . 15437 1 676 . 1 1 57 57 LEU CA C 13 58.19 0.2 . 1 . . . . 57 LEU CA . 15437 1 677 . 1 1 57 57 LEU CB C 13 41.36 0.2 . 1 . . . . 57 LEU CB . 15437 1 678 . 1 1 57 57 LEU CD1 C 13 24.92 0.2 . 2 . . . . 57 LEU CD1 . 15437 1 679 . 1 1 57 57 LEU CD2 C 13 23.94 0.2 . 2 . . . . 57 LEU CD2 . 15437 1 680 . 1 1 57 57 LEU CG C 13 27.03 0.2 . 1 . . . . 57 LEU CG . 15437 1 681 . 1 1 57 57 LEU N N 15 120.7 0.2 . 1 . . . . 57 LEU N . 15437 1 682 . 1 1 58 58 GLN H H 1 8.019 0.02 . 1 . . . . 58 GLN HN . 15437 1 683 . 1 1 58 58 GLN HA H 1 3.942 0.02 . 1 . . . . 58 GLN HA . 15437 1 684 . 1 1 58 58 GLN HB2 H 1 2.148 0.02 . 2 . . . . 58 GLN HB2 . 15437 1 685 . 1 1 58 58 GLN HB3 H 1 2.148 0.02 . 2 . . . . 58 GLN HB3 . 15437 1 686 . 1 1 58 58 GLN HE21 H 1 7.468 0.02 . 2 . . . . 58 GLN HE21 . 15437 1 687 . 1 1 58 58 GLN HE22 H 1 6.839 0.02 . 2 . . . . 58 GLN HE22 . 15437 1 688 . 1 1 58 58 GLN HG2 H 1 2.427 0.02 . 2 . . . . 58 GLN HG2 . 15437 1 689 . 1 1 58 58 GLN HG3 H 1 2.427 0.02 . 2 . . . . 58 GLN HG3 . 15437 1 690 . 1 1 58 58 GLN C C 13 179.1 0.2 . 1 . . . . 58 GLN C . 15437 1 691 . 1 1 58 58 GLN CA C 13 59.36 0.2 . 1 . . . . 58 GLN CA . 15437 1 692 . 1 1 58 58 GLN CB C 13 28.03 0.2 . 1 . . . . 58 GLN CB . 15437 1 693 . 1 1 58 58 GLN CG C 13 34.06 0.2 . 1 . . . . 58 GLN CG . 15437 1 694 . 1 1 58 58 GLN N N 15 117.4 0.2 . 1 . . . . 58 GLN N . 15437 1 695 . 1 1 58 58 GLN NE2 N 15 111.9 0.2 . 1 . . . . 58 GLN NE2 . 15437 1 696 . 1 1 59 59 GLU H H 1 7.838 0.02 . 1 . . . . 59 GLU HN . 15437 1 697 . 1 1 59 59 GLU HA H 1 4.03 0.02 . 1 . . . . 59 GLU HA . 15437 1 698 . 1 1 59 59 GLU HB2 H 1 2.142 0.02 . 2 . . . . 59 GLU HB2 . 15437 1 699 . 1 1 59 59 GLU HB3 H 1 2.142 0.02 . 2 . . . . 59 GLU HB3 . 15437 1 700 . 1 1 59 59 GLU HG2 H 1 2.354 0.02 . 2 . . . . 59 GLU HG2 . 15437 1 701 . 1 1 59 59 GLU HG3 H 1 2.426 0.02 . 2 . . . . 59 GLU HG3 . 15437 1 702 . 1 1 59 59 GLU C C 13 178.6 0.2 . 1 . . . . 59 GLU C . 15437 1 703 . 1 1 59 59 GLU CA C 13 59.25 0.2 . 1 . . . . 59 GLU CA . 15437 1 704 . 1 1 59 59 GLU CB C 13 28.96 0.2 . 1 . . . . 59 GLU CB . 15437 1 705 . 1 1 59 59 GLU CG C 13 35.16 0.2 . 1 . . . . 59 GLU CG . 15437 1 706 . 1 1 59 59 GLU N N 15 119.9 0.2 . 1 . . . . 59 GLU N . 15437 1 707 . 1 1 60 60 MET H H 1 8.223 0.02 . 1 . . . . 60 MET HN . 15437 1 708 . 1 1 60 60 MET HA H 1 3.966 0.02 . 1 . . . . 60 MET HA . 15437 1 709 . 1 1 60 60 MET HB2 H 1 2.2 0.02 . 2 . . . . 60 MET HB2 . 15437 1 710 . 1 1 60 60 MET HB3 H 1 2.379 0.02 . 2 . . . . 60 MET HB3 . 15437 1 711 . 1 1 60 60 MET HG2 H 1 2.5 0.02 . 2 . . . . 60 MET HG2 . 15437 1 712 . 1 1 60 60 MET HG3 H 1 2.362 0.02 . 2 . . . . 60 MET HG3 . 15437 1 713 . 1 1 60 60 MET C C 13 177.9 0.2 . 1 . . . . 60 MET C . 15437 1 714 . 1 1 60 60 MET CA C 13 59.35 0.2 . 1 . . . . 60 MET CA . 15437 1 715 . 1 1 60 60 MET CB C 13 33.21 0.2 . 1 . . . . 60 MET CB . 15437 1 716 . 1 1 60 60 MET CG C 13 31.59 0.2 . 1 . . . . 60 MET CG . 15437 1 717 . 1 1 60 60 MET N N 15 120.1 0.2 . 1 . . . . 60 MET N . 15437 1 718 . 1 1 61 61 MET H H 1 8.134 0.02 . 1 . . . . 61 MET HN . 15437 1 719 . 1 1 61 61 MET HA H 1 4.195 0.02 . 1 . . . . 61 MET HA . 15437 1 720 . 1 1 61 61 MET HB2 H 1 2.094 0.02 . 2 . . . . 61 MET HB2 . 15437 1 721 . 1 1 61 61 MET HB3 H 1 2.165 0.02 . 2 . . . . 61 MET HB3 . 15437 1 722 . 1 1 61 61 MET HG2 H 1 2.443 0.02 . 2 . . . . 61 MET HG2 . 15437 1 723 . 1 1 61 61 MET HG3 H 1 2.515 0.02 . 2 . . . . 61 MET HG3 . 15437 1 724 . 1 1 61 61 MET C C 13 179.1 0.2 . 1 . . . . 61 MET C . 15437 1 725 . 1 1 61 61 MET CA C 13 58.21 0.2 . 1 . . . . 61 MET CA . 15437 1 726 . 1 1 61 61 MET CB C 13 31.34 0.2 . 1 . . . . 61 MET CB . 15437 1 727 . 1 1 61 61 MET CG C 13 32.43 0.2 . 1 . . . . 61 MET CG . 15437 1 728 . 1 1 61 61 MET N N 15 117 0.2 . 1 . . . . 61 MET N . 15437 1 729 . 1 1 62 62 LYS H H 1 7.782 0.02 . 1 . . . . 62 LYS HN . 15437 1 730 . 1 1 62 62 LYS HA H 1 4.085 0.02 . 1 . . . . 62 LYS HA . 15437 1 731 . 1 1 62 62 LYS HB2 H 1 1.937 0.02 . 2 . . . . 62 LYS HB2 . 15437 1 732 . 1 1 62 62 LYS HB3 H 1 1.937 0.02 . 2 . . . . 62 LYS HB3 . 15437 1 733 . 1 1 62 62 LYS HD2 H 1 1.658 0.02 . 2 . . . . 62 LYS HD2 . 15437 1 734 . 1 1 62 62 LYS HD3 H 1 1.658 0.02 . 2 . . . . 62 LYS HD3 . 15437 1 735 . 1 1 62 62 LYS HE2 H 1 2.925 0.02 . 2 . . . . 62 LYS HE2 . 15437 1 736 . 1 1 62 62 LYS HE3 H 1 2.925 0.02 . 2 . . . . 62 LYS HE3 . 15437 1 737 . 1 1 62 62 LYS HG2 H 1 1.384 0.02 . 2 . . . . 62 LYS HG2 . 15437 1 738 . 1 1 62 62 LYS HG3 H 1 1.56 0.02 . 2 . . . . 62 LYS HG3 . 15437 1 739 . 1 1 62 62 LYS C C 13 179.6 0.2 . 1 . . . . 62 LYS C . 15437 1 740 . 1 1 62 62 LYS CA C 13 59.61 0.2 . 1 . . . . 62 LYS CA . 15437 1 741 . 1 1 62 62 LYS CB C 13 32.18 0.2 . 1 . . . . 62 LYS CB . 15437 1 742 . 1 1 62 62 LYS CD C 13 29.24 0.2 . 1 . . . . 62 LYS CD . 15437 1 743 . 1 1 62 62 LYS CE C 13 42.11 0.2 . 1 . . . . 62 LYS CE . 15437 1 744 . 1 1 62 62 LYS CG C 13 25.06 0.2 . 1 . . . . 62 LYS CG . 15437 1 745 . 1 1 62 62 LYS N N 15 120.6 0.2 . 1 . . . . 62 LYS N . 15437 1 746 . 1 1 63 63 GLU H H 1 8.041 0.02 . 1 . . . . 63 GLU HN . 15437 1 747 . 1 1 63 63 GLU HA H 1 4.057 0.02 . 1 . . . . 63 GLU HA . 15437 1 748 . 1 1 63 63 GLU HB2 H 1 2.142 0.02 . 2 . . . . 63 GLU HB2 . 15437 1 749 . 1 1 63 63 GLU HB3 H 1 2.142 0.02 . 2 . . . . 63 GLU HB3 . 15437 1 750 . 1 1 63 63 GLU HG2 H 1 2.406 0.02 . 2 . . . . 63 GLU HG2 . 15437 1 751 . 1 1 63 63 GLU HG3 H 1 2.406 0.02 . 2 . . . . 63 GLU HG3 . 15437 1 752 . 1 1 63 63 GLU C C 13 178.9 0.2 . 1 . . . . 63 GLU C . 15437 1 753 . 1 1 63 63 GLU CA C 13 59.17 0.2 . 1 . . . . 63 GLU CA . 15437 1 754 . 1 1 63 63 GLU CB C 13 29 0.2 . 1 . . . . 63 GLU CB . 15437 1 755 . 1 1 63 63 GLU CG C 13 35.61 0.2 . 1 . . . . 63 GLU CG . 15437 1 756 . 1 1 63 63 GLU N N 15 120.2 0.2 . 1 . . . . 63 GLU N . 15437 1 757 . 1 1 64 64 PHE H H 1 8.604 0.02 . 1 . . . . 64 PHE HN . 15437 1 758 . 1 1 64 64 PHE HA H 1 4.155 0.02 . 1 . . . . 64 PHE HA . 15437 1 759 . 1 1 64 64 PHE HB2 H 1 3.228 0.02 . 2 . . . . 64 PHE HB2 . 15437 1 760 . 1 1 64 64 PHE HB3 H 1 3.054 0.02 . 2 . . . . 64 PHE HB3 . 15437 1 761 . 1 1 64 64 PHE HD1 H 1 7.143 0.02 . 3 . . . . 64 PHE HD1 . 15437 1 762 . 1 1 64 64 PHE HD2 H 1 7.143 0.02 . 3 . . . . 64 PHE HD2 . 15437 1 763 . 1 1 64 64 PHE C C 13 177.8 0.2 . 1 . . . . 64 PHE C . 15437 1 764 . 1 1 64 64 PHE CA C 13 59.82 0.2 . 1 . . . . 64 PHE CA . 15437 1 765 . 1 1 64 64 PHE CB C 13 38.47 0.2 . 1 . . . . 64 PHE CB . 15437 1 766 . 1 1 64 64 PHE N N 15 119.7 0.2 . 1 . . . . 64 PHE N . 15437 1 767 . 1 1 65 65 GLN H H 1 8.177 0.02 . 1 . . . . 65 GLN HN . 15437 1 768 . 1 1 65 65 GLN HA H 1 3.637 0.02 . 1 . . . . 65 GLN HA . 15437 1 769 . 1 1 65 65 GLN HB2 H 1 2.155 0.02 . 2 . . . . 65 GLN HB2 . 15437 1 770 . 1 1 65 65 GLN HB3 H 1 2.155 0.02 . 2 . . . . 65 GLN HB3 . 15437 1 771 . 1 1 65 65 GLN HE21 H 1 7.442 0.02 . 2 . . . . 65 GLN HE21 . 15437 1 772 . 1 1 65 65 GLN HE22 H 1 6.669 0.02 . 2 . . . . 65 GLN HE22 . 15437 1 773 . 1 1 65 65 GLN HG2 H 1 2.278 0.02 . 2 . . . . 65 GLN HG2 . 15437 1 774 . 1 1 65 65 GLN HG3 H 1 2.278 0.02 . 2 . . . . 65 GLN HG3 . 15437 1 775 . 1 1 65 65 GLN C C 13 177.8 0.2 . 1 . . . . 65 GLN C . 15437 1 776 . 1 1 65 65 GLN CA C 13 58.97 0.2 . 1 . . . . 65 GLN CA . 15437 1 777 . 1 1 65 65 GLN CB C 13 28.28 0.2 . 1 . . . . 65 GLN CB . 15437 1 778 . 1 1 65 65 GLN CG C 13 33.86 0.2 . 1 . . . . 65 GLN CG . 15437 1 779 . 1 1 65 65 GLN N N 15 118.5 0.2 . 1 . . . . 65 GLN N . 15437 1 780 . 1 1 65 65 GLN NE2 N 15 113.5 0.2 . 1 . . . . 65 GLN NE2 . 15437 1 781 . 1 1 66 66 GLN H H 1 7.622 0.02 . 1 . . . . 66 GLN HN . 15437 1 782 . 1 1 66 66 GLN HA H 1 4.04 0.02 . 1 . . . . 66 GLN HA . 15437 1 783 . 1 1 66 66 GLN HB2 H 1 1.908 0.02 . 2 . . . . 66 GLN HB2 . 15437 1 784 . 1 1 66 66 GLN HB3 H 1 1.752 0.02 . 2 . . . . 66 GLN HB3 . 15437 1 785 . 1 1 66 66 GLN HE21 H 1 7.221 0.02 . 2 . . . . 66 GLN HE21 . 15437 1 786 . 1 1 66 66 GLN HE22 H 1 6.717 0.02 . 2 . . . . 66 GLN HE22 . 15437 1 787 . 1 1 66 66 GLN HG2 H 1 2.325 0.02 . 2 . . . . 66 GLN HG2 . 15437 1 788 . 1 1 66 66 GLN HG3 H 1 2.172 0.02 . 2 . . . . 66 GLN HG3 . 15437 1 789 . 1 1 66 66 GLN C C 13 178.6 0.2 . 1 . . . . 66 GLN C . 15437 1 790 . 1 1 66 66 GLN CA C 13 59.15 0.2 . 1 . . . . 66 GLN CA . 15437 1 791 . 1 1 66 66 GLN CB C 13 28.23 0.2 . 1 . . . . 66 GLN CB . 15437 1 792 . 1 1 66 66 GLN CG C 13 34.19 0.2 . 1 . . . . 66 GLN CG . 15437 1 793 . 1 1 66 66 GLN N N 15 117.4 0.2 . 1 . . . . 66 GLN N . 15437 1 794 . 1 1 66 66 GLN NE2 N 15 111 0.2 . 1 . . . . 66 GLN NE2 . 15437 1 795 . 1 1 67 67 VAL H H 1 7.744 0.02 . 1 . . . . 67 VAL HN . 15437 1 796 . 1 1 67 67 VAL HA H 1 3.785 0.02 . 1 . . . . 67 VAL HA . 15437 1 797 . 1 1 67 67 VAL HB H 1 2.249 0.02 . 1 . . . . 67 VAL HB . 15437 1 798 . 1 1 67 67 VAL HG11 H 1 1.047 0.02 . 2 . . . . 67 VAL HG1 . 15437 1 799 . 1 1 67 67 VAL HG12 H 1 1.047 0.02 . 2 . . . . 67 VAL HG1 . 15437 1 800 . 1 1 67 67 VAL HG13 H 1 1.047 0.02 . 2 . . . . 67 VAL HG1 . 15437 1 801 . 1 1 67 67 VAL HG21 H 1 0.8975 0.02 . 2 . . . . 67 VAL HG2 . 15437 1 802 . 1 1 67 67 VAL HG22 H 1 0.8975 0.02 . 2 . . . . 67 VAL HG2 . 15437 1 803 . 1 1 67 67 VAL HG23 H 1 0.8975 0.02 . 2 . . . . 67 VAL HG2 . 15437 1 804 . 1 1 67 67 VAL C C 13 177.5 0.2 . 1 . . . . 67 VAL C . 15437 1 805 . 1 1 67 67 VAL CA C 13 66.22 0.2 . 1 . . . . 67 VAL CA . 15437 1 806 . 1 1 67 67 VAL CB C 13 31.39 0.2 . 1 . . . . 67 VAL CB . 15437 1 807 . 1 1 67 67 VAL CG1 C 13 23.91 0.2 . 2 . . . . 67 VAL CG1 . 15437 1 808 . 1 1 67 67 VAL CG2 C 13 21.44 0.2 . 2 . . . . 67 VAL CG2 . 15437 1 809 . 1 1 67 67 VAL N N 15 119.5 0.2 . 1 . . . . 67 VAL N . 15437 1 810 . 1 1 68 68 LEU H H 1 7.983 0.02 . 1 . . . . 68 LEU HN . 15437 1 811 . 1 1 68 68 LEU HA H 1 3.825 0.02 . 1 . . . . 68 LEU HA . 15437 1 812 . 1 1 68 68 LEU HB2 H 1 1.681 0.02 . 2 . . . . 68 LEU HB2 . 15437 1 813 . 1 1 68 68 LEU HB3 H 1 1.544 0.02 . 2 . . . . 68 LEU HB3 . 15437 1 814 . 1 1 68 68 LEU HD11 H 1 0.4678 0.02 . 2 . . . . 68 LEU HD1 . 15437 1 815 . 1 1 68 68 LEU HD12 H 1 0.4678 0.02 . 2 . . . . 68 LEU HD1 . 15437 1 816 . 1 1 68 68 LEU HD13 H 1 0.4678 0.02 . 2 . . . . 68 LEU HD1 . 15437 1 817 . 1 1 68 68 LEU HD21 H 1 0.5563 0.02 . 2 . . . . 68 LEU HD2 . 15437 1 818 . 1 1 68 68 LEU HD22 H 1 0.5563 0.02 . 2 . . . . 68 LEU HD2 . 15437 1 819 . 1 1 68 68 LEU HD23 H 1 0.5563 0.02 . 2 . . . . 68 LEU HD2 . 15437 1 820 . 1 1 68 68 LEU HG H 1 1.491 0.02 . 1 . . . . 68 LEU HG . 15437 1 821 . 1 1 68 68 LEU C C 13 179.1 0.2 . 1 . . . . 68 LEU C . 15437 1 822 . 1 1 68 68 LEU CA C 13 58.74 0.2 . 1 . . . . 68 LEU CA . 15437 1 823 . 1 1 68 68 LEU CB C 13 41.09 0.2 . 1 . . . . 68 LEU CB . 15437 1 824 . 1 1 68 68 LEU CD1 C 13 25.04 0.2 . 2 . . . . 68 LEU CD1 . 15437 1 825 . 1 1 68 68 LEU CD2 C 13 24.21 0.2 . 2 . . . . 68 LEU CD2 . 15437 1 826 . 1 1 68 68 LEU CG C 13 27.11 0.2 . 1 . . . . 68 LEU CG . 15437 1 827 . 1 1 68 68 LEU N N 15 120.4 0.2 . 1 . . . . 68 LEU N . 15437 1 828 . 1 1 69 69 ASP H H 1 8.179 0.02 . 1 . . . . 69 ASP HN . 15437 1 829 . 1 1 69 69 ASP HA H 1 4.38 0.02 . 1 . . . . 69 ASP HA . 15437 1 830 . 1 1 69 69 ASP HB2 H 1 2.798 0.02 . 2 . . . . 69 ASP HB2 . 15437 1 831 . 1 1 69 69 ASP HB3 H 1 2.664 0.02 . 2 . . . . 69 ASP HB3 . 15437 1 832 . 1 1 69 69 ASP C C 13 178.9 0.2 . 1 . . . . 69 ASP C . 15437 1 833 . 1 1 69 69 ASP CA C 13 57.32 0.2 . 1 . . . . 69 ASP CA . 15437 1 834 . 1 1 69 69 ASP CB C 13 40.04 0.2 . 1 . . . . 69 ASP CB . 15437 1 835 . 1 1 69 69 ASP N N 15 119 0.2 . 1 . . . . 69 ASP N . 15437 1 836 . 1 1 70 70 GLU H H 1 8.166 0.02 . 1 . . . . 70 GLU HN . 15437 1 837 . 1 1 70 70 GLU HA H 1 4.082 0.02 . 1 . . . . 70 GLU HA . 15437 1 838 . 1 1 70 70 GLU HB2 H 1 2.06 0.02 . 2 . . . . 70 GLU HB2 . 15437 1 839 . 1 1 70 70 GLU HB3 H 1 2.06 0.02 . 2 . . . . 70 GLU HB3 . 15437 1 840 . 1 1 70 70 GLU HG2 H 1 2.416 0.02 . 2 . . . . 70 GLU HG2 . 15437 1 841 . 1 1 70 70 GLU HG3 H 1 2.416 0.02 . 2 . . . . 70 GLU HG3 . 15437 1 842 . 1 1 70 70 GLU C C 13 179.6 0.2 . 1 . . . . 70 GLU C . 15437 1 843 . 1 1 70 70 GLU CA C 13 59.01 0.2 . 1 . . . . 70 GLU CA . 15437 1 844 . 1 1 70 70 GLU CB C 13 28.9 0.2 . 1 . . . . 70 GLU CB . 15437 1 845 . 1 1 70 70 GLU CG C 13 35.22 0.2 . 1 . . . . 70 GLU CG . 15437 1 846 . 1 1 70 70 GLU N N 15 120.5 0.2 . 1 . . . . 70 GLU N . 15437 1 847 . 1 1 71 71 ILE H H 1 8.415 0.02 . 1 . . . . 71 ILE HN . 15437 1 848 . 1 1 71 71 ILE HA H 1 3.79 0.02 . 1 . . . . 71 ILE HA . 15437 1 849 . 1 1 71 71 ILE HB H 1 2.019 0.02 . 1 . . . . 71 ILE HB . 15437 1 850 . 1 1 71 71 ILE HD11 H 1 0.7726 0.02 . 1 . . . . 71 ILE HD1 . 15437 1 851 . 1 1 71 71 ILE HD12 H 1 0.7726 0.02 . 1 . . . . 71 ILE HD1 . 15437 1 852 . 1 1 71 71 ILE HD13 H 1 0.7726 0.02 . 1 . . . . 71 ILE HD1 . 15437 1 853 . 1 1 71 71 ILE HG12 H 1 1.193 0.02 . 2 . . . . 71 ILE HG12 . 15437 1 854 . 1 1 71 71 ILE HG13 H 1 1.193 0.02 . 2 . . . . 71 ILE HG13 . 15437 1 855 . 1 1 71 71 ILE HG21 H 1 0.8606 0.02 . 1 . . . . 71 ILE HG2 . 15437 1 856 . 1 1 71 71 ILE HG22 H 1 0.8606 0.02 . 1 . . . . 71 ILE HG2 . 15437 1 857 . 1 1 71 71 ILE HG23 H 1 0.8606 0.02 . 1 . . . . 71 ILE HG2 . 15437 1 858 . 1 1 71 71 ILE C C 13 177.4 0.2 . 1 . . . . 71 ILE C . 15437 1 859 . 1 1 71 71 ILE CA C 13 64.89 0.2 . 1 . . . . 71 ILE CA . 15437 1 860 . 1 1 71 71 ILE CB C 13 37.68 0.2 . 1 . . . . 71 ILE CB . 15437 1 861 . 1 1 71 71 ILE CD1 C 13 13.85 0.2 . 1 . . . . 71 ILE CD1 . 15437 1 862 . 1 1 71 71 ILE CG1 C 13 32.8 0.2 . 1 . . . . 71 ILE CG1 . 15437 1 863 . 1 1 71 71 ILE CG2 C 13 17.75 0.2 . 1 . . . . 71 ILE CG2 . 15437 1 864 . 1 1 71 71 ILE N N 15 119.2 0.2 . 1 . . . . 71 ILE N . 15437 1 865 . 1 1 72 72 LYS H H 1 8.248 0.02 . 1 . . . . 72 LYS HN . 15437 1 866 . 1 1 72 72 LYS HA H 1 3.625 0.02 . 1 . . . . 72 LYS HA . 15437 1 867 . 1 1 72 72 LYS HB2 H 1 1.978 0.02 . 2 . . . . 72 LYS HB2 . 15437 1 868 . 1 1 72 72 LYS HB3 H 1 1.905 0.02 . 2 . . . . 72 LYS HB3 . 15437 1 869 . 1 1 72 72 LYS HE2 H 1 2.909 0.02 . 2 . . . . 72 LYS HE2 . 15437 1 870 . 1 1 72 72 LYS HE3 H 1 2.909 0.02 . 2 . . . . 72 LYS HE3 . 15437 1 871 . 1 1 72 72 LYS HG2 H 1 1.329 0.02 . 2 . . . . 72 LYS HG2 . 15437 1 872 . 1 1 72 72 LYS HG3 H 1 1.329 0.02 . 2 . . . . 72 LYS HG3 . 15437 1 873 . 1 1 72 72 LYS C C 13 178.4 0.2 . 1 . . . . 72 LYS C . 15437 1 874 . 1 1 72 72 LYS CA C 13 59.85 0.2 . 1 . . . . 72 LYS CA . 15437 1 875 . 1 1 72 72 LYS CB C 13 32.07 0.2 . 1 . . . . 72 LYS CB . 15437 1 876 . 1 1 72 72 LYS CD C 13 29.39 0.2 . 1 . . . . 72 LYS CD . 15437 1 877 . 1 1 72 72 LYS CE C 13 42.03 0.2 . 1 . . . . 72 LYS CE . 15437 1 878 . 1 1 72 72 LYS CG C 13 24.83 0.2 . 1 . . . . 72 LYS CG . 15437 1 879 . 1 1 72 72 LYS N N 15 120.8 0.2 . 1 . . . . 72 LYS N . 15437 1 880 . 1 1 73 73 GLN H H 1 7.937 0.02 . 1 . . . . 73 GLN HN . 15437 1 881 . 1 1 73 73 GLN HA H 1 4.042 0.02 . 1 . . . . 73 GLN HA . 15437 1 882 . 1 1 73 73 GLN HB2 H 1 2.136 0.02 . 2 . . . . 73 GLN HB2 . 15437 1 883 . 1 1 73 73 GLN HB3 H 1 2.136 0.02 . 2 . . . . 73 GLN HB3 . 15437 1 884 . 1 1 73 73 GLN HE21 H 1 7.417 0.02 . 2 . . . . 73 GLN HE21 . 15437 1 885 . 1 1 73 73 GLN HE22 H 1 6.786 0.02 . 2 . . . . 73 GLN HE22 . 15437 1 886 . 1 1 73 73 GLN HG2 H 1 2.466 0.02 . 2 . . . . 73 GLN HG2 . 15437 1 887 . 1 1 73 73 GLN HG3 H 1 2.378 0.02 . 2 . . . . 73 GLN HG3 . 15437 1 888 . 1 1 73 73 GLN C C 13 178.4 0.2 . 1 . . . . 73 GLN C . 15437 1 889 . 1 1 73 73 GLN CA C 13 58.51 0.2 . 1 . . . . 73 GLN CA . 15437 1 890 . 1 1 73 73 GLN CB C 13 28.43 0.2 . 1 . . . . 73 GLN CB . 15437 1 891 . 1 1 73 73 GLN CG C 13 33.98 0.2 . 1 . . . . 73 GLN CG . 15437 1 892 . 1 1 73 73 GLN N N 15 117 0.2 . 1 . . . . 73 GLN N . 15437 1 893 . 1 1 73 73 GLN NE2 N 15 111.8 0.2 . 1 . . . . 73 GLN NE2 . 15437 1 894 . 1 1 74 74 GLN H H 1 7.712 0.02 . 1 . . . . 74 GLN HN . 15437 1 895 . 1 1 74 74 GLN HA H 1 4.08 0.02 . 1 . . . . 74 GLN HA . 15437 1 896 . 1 1 74 74 GLN HB2 H 1 1.997 0.02 . 2 . . . . 74 GLN HB2 . 15437 1 897 . 1 1 74 74 GLN HB3 H 1 1.997 0.02 . 2 . . . . 74 GLN HB3 . 15437 1 898 . 1 1 74 74 GLN HE21 H 1 7.463 0.02 . 2 . . . . 74 GLN HE21 . 15437 1 899 . 1 1 74 74 GLN HE22 H 1 6.528 0.02 . 2 . . . . 74 GLN HE22 . 15437 1 900 . 1 1 74 74 GLN HG2 H 1 2.164 0.02 . 2 . . . . 74 GLN HG2 . 15437 1 901 . 1 1 74 74 GLN HG3 H 1 2.164 0.02 . 2 . . . . 74 GLN HG3 . 15437 1 902 . 1 1 74 74 GLN C C 13 177.8 0.2 . 1 . . . . 74 GLN C . 15437 1 903 . 1 1 74 74 GLN CA C 13 57.27 0.2 . 1 . . . . 74 GLN CA . 15437 1 904 . 1 1 74 74 GLN CB C 13 28.7 0.2 . 1 . . . . 74 GLN CB . 15437 1 905 . 1 1 74 74 GLN CG C 13 33.59 0.2 . 1 . . . . 74 GLN CG . 15437 1 906 . 1 1 74 74 GLN N N 15 118.2 0.2 . 1 . . . . 74 GLN N . 15437 1 907 . 1 1 74 74 GLN NE2 N 15 111.3 0.2 . 1 . . . . 74 GLN NE2 . 15437 1 908 . 1 1 75 75 LEU H H 1 7.956 0.02 . 1 . . . . 75 LEU HN . 15437 1 909 . 1 1 75 75 LEU HA H 1 4.212 0.02 . 1 . . . . 75 LEU HA . 15437 1 910 . 1 1 75 75 LEU HB2 H 1 1.627 0.02 . 2 . . . . 75 LEU HB2 . 15437 1 911 . 1 1 75 75 LEU HB3 H 1 1.583 0.02 . 2 . . . . 75 LEU HB3 . 15437 1 912 . 1 1 75 75 LEU HD11 H 1 0.6648 0.02 . 2 . . . . 75 LEU HD1 . 15437 1 913 . 1 1 75 75 LEU HD12 H 1 0.6648 0.02 . 2 . . . . 75 LEU HD1 . 15437 1 914 . 1 1 75 75 LEU HD13 H 1 0.6648 0.02 . 2 . . . . 75 LEU HD1 . 15437 1 915 . 1 1 75 75 LEU HD21 H 1 0.6973 0.02 . 2 . . . . 75 LEU HD2 . 15437 1 916 . 1 1 75 75 LEU HD22 H 1 0.6973 0.02 . 2 . . . . 75 LEU HD2 . 15437 1 917 . 1 1 75 75 LEU HD23 H 1 0.6973 0.02 . 2 . . . . 75 LEU HD2 . 15437 1 918 . 1 1 75 75 LEU HG H 1 1.609 0.02 . 1 . . . . 75 LEU HG . 15437 1 919 . 1 1 75 75 LEU CA C 13 56.66 0.2 . 1 . . . . 75 LEU CA . 15437 1 920 . 1 1 75 75 LEU CB C 13 42 0.2 . 1 . . . . 75 LEU CB . 15437 1 921 . 1 1 75 75 LEU CD1 C 13 25.41 0.2 . 2 . . . . 75 LEU CD1 . 15437 1 922 . 1 1 75 75 LEU CD2 C 13 24.18 0.2 . 2 . . . . 75 LEU CD2 . 15437 1 923 . 1 1 75 75 LEU CG C 13 26.6 0.2 . 1 . . . . 75 LEU CG . 15437 1 924 . 1 1 75 75 LEU N N 15 120.7 0.2 . 1 . . . . 75 LEU N . 15437 1 925 . 1 1 76 76 GLN H H 1 8.315 0.02 . 1 . . . . 76 GLN HN . 15437 1 926 . 1 1 76 76 GLN HA H 1 4.113 0.02 . 1 . . . . 76 GLN HA . 15437 1 927 . 1 1 76 76 GLN HB2 H 1 2.064 0.02 . 2 . . . . 76 GLN HB2 . 15437 1 928 . 1 1 76 76 GLN HB3 H 1 2.064 0.02 . 2 . . . . 76 GLN HB3 . 15437 1 929 . 1 1 76 76 GLN HE21 H 1 7.342 0.02 . 2 . . . . 76 GLN HE21 . 15437 1 930 . 1 1 76 76 GLN HE22 H 1 6.707 0.02 . 2 . . . . 76 GLN HE22 . 15437 1 931 . 1 1 76 76 GLN HG2 H 1 2.381 0.02 . 2 . . . . 76 GLN HG2 . 15437 1 932 . 1 1 76 76 GLN HG3 H 1 2.381 0.02 . 2 . . . . 76 GLN HG3 . 15437 1 933 . 1 1 76 76 GLN C C 13 177.1 0.2 . 1 . . . . 76 GLN C . 15437 1 934 . 1 1 76 76 GLN CA C 13 57.4 0.2 . 1 . . . . 76 GLN CA . 15437 1 935 . 1 1 76 76 GLN CB C 13 28.64 0.2 . 1 . . . . 76 GLN CB . 15437 1 936 . 1 1 76 76 GLN CG C 13 34.04 0.2 . 1 . . . . 76 GLN CG . 15437 1 937 . 1 1 76 76 GLN N N 15 120.1 0.2 . 1 . . . . 76 GLN N . 15437 1 938 . 1 1 76 76 GLN NE2 N 15 111.2 0.2 . 1 . . . . 76 GLN NE2 . 15437 1 939 . 1 1 77 77 GLY H H 1 8.021 0.02 . 1 . . . . 77 GLY HN . 15437 1 940 . 1 1 77 77 GLY HA2 H 1 4.042 0.02 . 2 . . . . 77 GLY HA2 . 15437 1 941 . 1 1 77 77 GLY HA3 H 1 3.869 0.02 . 2 . . . . 77 GLY HA3 . 15437 1 942 . 1 1 77 77 GLY C C 13 174.6 0.2 . 1 . . . . 77 GLY C . 15437 1 943 . 1 1 77 77 GLY CA C 13 45.43 0.2 . 1 . . . . 77 GLY CA . 15437 1 944 . 1 1 77 77 GLY N N 15 107.7 0.2 . 1 . . . . 77 GLY N . 15437 1 945 . 1 1 78 78 GLY H H 1 7.819 0.02 . 1 . . . . 78 GLY HN . 15437 1 946 . 1 1 78 78 GLY HA2 H 1 4.208 0.02 . 2 . . . . 78 GLY HA2 . 15437 1 947 . 1 1 78 78 GLY HA3 H 1 3.801 0.02 . 2 . . . . 78 GLY HA3 . 15437 1 948 . 1 1 78 78 GLY C C 13 173.9 0.2 . 1 . . . . 78 GLY C . 15437 1 949 . 1 1 78 78 GLY CA C 13 45.14 0.2 . 1 . . . . 78 GLY CA . 15437 1 950 . 1 1 78 78 GLY N N 15 107.1 0.2 . 1 . . . . 78 GLY N . 15437 1 951 . 1 1 79 79 ASP H H 1 7.912 0.02 . 1 . . . . 79 ASP HN . 15437 1 952 . 1 1 79 79 ASP HA H 1 4.722 0.02 . 1 . . . . 79 ASP HA . 15437 1 953 . 1 1 79 79 ASP HB2 H 1 2.768 0.02 . 2 . . . . 79 ASP HB2 . 15437 1 954 . 1 1 79 79 ASP HB3 H 1 2.583 0.02 . 2 . . . . 79 ASP HB3 . 15437 1 955 . 1 1 79 79 ASP C C 13 176.2 0.2 . 1 . . . . 79 ASP C . 15437 1 956 . 1 1 79 79 ASP CA C 13 53.21 0.2 . 1 . . . . 79 ASP CA . 15437 1 957 . 1 1 79 79 ASP CB C 13 40.16 0.2 . 1 . . . . 79 ASP CB . 15437 1 958 . 1 1 79 79 ASP N N 15 119.8 0.2 . 1 . . . . 79 ASP N . 15437 1 959 . 1 1 80 80 ASN H H 1 8.45 0.02 . 1 . . . . 80 ASN HN . 15437 1 960 . 1 1 80 80 ASN HA H 1 4.593 0.02 . 1 . . . . 80 ASN HA . 15437 1 961 . 1 1 80 80 ASN HB2 H 1 2.807 0.02 . 2 . . . . 80 ASN HB2 . 15437 1 962 . 1 1 80 80 ASN HB3 H 1 2.807 0.02 . 2 . . . . 80 ASN HB3 . 15437 1 963 . 1 1 80 80 ASN HD21 H 1 7.585 0.02 . 2 . . . . 80 ASN HD21 . 15437 1 964 . 1 1 80 80 ASN HD22 H 1 6.902 0.02 . 2 . . . . 80 ASN HD22 . 15437 1 965 . 1 1 80 80 ASN C C 13 177.3 0.2 . 1 . . . . 80 ASN C . 15437 1 966 . 1 1 80 80 ASN CA C 13 54.68 0.2 . 1 . . . . 80 ASN CA . 15437 1 967 . 1 1 80 80 ASN CB C 13 38.79 0.2 . 1 . . . . 80 ASN CB . 15437 1 968 . 1 1 80 80 ASN N N 15 121.7 0.2 . 1 . . . . 80 ASN N . 15437 1 969 . 1 1 80 80 ASN ND2 N 15 113.2 0.2 . 1 . . . . 80 ASN ND2 . 15437 1 970 . 1 1 81 81 SER H H 1 8.444 0.02 . 1 . . . . 81 SER HN . 15437 1 971 . 1 1 81 81 SER HA H 1 4.263 0.02 . 1 . . . . 81 SER HA . 15437 1 972 . 1 1 81 81 SER HB2 H 1 3.872 0.02 . 2 . . . . 81 SER HB2 . 15437 1 973 . 1 1 81 81 SER HB3 H 1 3.872 0.02 . 2 . . . . 81 SER HB3 . 15437 1 974 . 1 1 81 81 SER C C 13 176.1 0.2 . 1 . . . . 81 SER C . 15437 1 975 . 1 1 81 81 SER CA C 13 61.47 0.2 . 1 . . . . 81 SER CA . 15437 1 976 . 1 1 81 81 SER CB C 13 61.47 0.2 . 1 . . . . 81 SER CB . 15437 1 977 . 1 1 81 81 SER N N 15 117.1 0.2 . 1 . . . . 81 SER N . 15437 1 978 . 1 1 82 82 LEU H H 1 7.929 0.02 . 1 . . . . 82 LEU HN . 15437 1 979 . 1 1 82 82 LEU HA H 1 4.332 0.02 . 1 . . . . 82 LEU HA . 15437 1 980 . 1 1 82 82 LEU HB2 H 1 1.653 0.02 . 2 . . . . 82 LEU HB2 . 15437 1 981 . 1 1 82 82 LEU HB3 H 1 1.653 0.02 . 2 . . . . 82 LEU HB3 . 15437 1 982 . 1 1 82 82 LEU HD11 H 1 0.8396 0.02 . 2 . . . . 82 LEU HD1 . 15437 1 983 . 1 1 82 82 LEU HD12 H 1 0.8396 0.02 . 2 . . . . 82 LEU HD1 . 15437 1 984 . 1 1 82 82 LEU HD13 H 1 0.8396 0.02 . 2 . . . . 82 LEU HD1 . 15437 1 985 . 1 1 82 82 LEU HD21 H 1 0.7069 0.02 . 2 . . . . 82 LEU HD2 . 15437 1 986 . 1 1 82 82 LEU HD22 H 1 0.7069 0.02 . 2 . . . . 82 LEU HD2 . 15437 1 987 . 1 1 82 82 LEU HD23 H 1 0.7069 0.02 . 2 . . . . 82 LEU HD2 . 15437 1 988 . 1 1 82 82 LEU HG H 1 1.514 0.02 . 1 . . . . 82 LEU HG . 15437 1 989 . 1 1 82 82 LEU C C 13 177.4 0.2 . 1 . . . . 82 LEU C . 15437 1 990 . 1 1 82 82 LEU CA C 13 55.06 0.2 . 1 . . . . 82 LEU CA . 15437 1 991 . 1 1 82 82 LEU CB C 13 41.94 0.2 . 1 . . . . 82 LEU CB . 15437 1 992 . 1 1 82 82 LEU CD1 C 13 26.22 0.2 . 2 . . . . 82 LEU CD1 . 15437 1 993 . 1 1 82 82 LEU CD2 C 13 23.34 0.2 . 2 . . . . 82 LEU CD2 . 15437 1 994 . 1 1 82 82 LEU CG C 13 26.76 0.2 . 1 . . . . 82 LEU CG . 15437 1 995 . 1 1 82 82 LEU N N 15 120.4 0.2 . 1 . . . . 82 LEU N . 15437 1 996 . 1 1 83 83 HIS H H 1 8.014 0.02 . 1 . . . . 83 HIS HN . 15437 1 997 . 1 1 83 83 HIS HA H 1 4.173 0.02 . 1 . . . . 83 HIS HA . 15437 1 998 . 1 1 83 83 HIS HB2 H 1 3.344 0.02 . 2 . . . . 83 HIS HB2 . 15437 1 999 . 1 1 83 83 HIS HB3 H 1 3.344 0.02 . 2 . . . . 83 HIS HB3 . 15437 1 1000 . 1 1 83 83 HIS C C 13 176.1 0.2 . 1 . . . . 83 HIS C . 15437 1 1001 . 1 1 83 83 HIS CA C 13 59.94 0.2 . 1 . . . . 83 HIS CA . 15437 1 1002 . 1 1 83 83 HIS CB C 13 28.05 0.2 . 1 . . . . 83 HIS CB . 15437 1 1003 . 1 1 83 83 HIS N N 15 119.4 0.2 . 1 . . . . 83 HIS N . 15437 1 1004 . 1 1 84 84 ASN H H 1 8.598 0.02 . 1 . . . . 84 ASN HN . 15437 1 1005 . 1 1 84 84 ASN HA H 1 4.735 0.02 . 1 . . . . 84 ASN HA . 15437 1 1006 . 1 1 84 84 ASN HB2 H 1 2.806 0.02 . 2 . . . . 84 ASN HB2 . 15437 1 1007 . 1 1 84 84 ASN HB3 H 1 2.806 0.02 . 2 . . . . 84 ASN HB3 . 15437 1 1008 . 1 1 84 84 ASN HD21 H 1 7.592 0.02 . 2 . . . . 84 ASN HD21 . 15437 1 1009 . 1 1 84 84 ASN HD22 H 1 6.941 0.02 . 2 . . . . 84 ASN HD22 . 15437 1 1010 . 1 1 84 84 ASN C C 13 177.4 0.2 . 1 . . . . 84 ASN C . 15437 1 1011 . 1 1 84 84 ASN CA C 13 55.79 0.2 . 1 . . . . 84 ASN CA . 15437 1 1012 . 1 1 84 84 ASN CB C 13 37.52 0.2 . 1 . . . . 84 ASN CB . 15437 1 1013 . 1 1 84 84 ASN N N 15 118.1 0.2 . 1 . . . . 84 ASN N . 15437 1 1014 . 1 1 84 84 ASN ND2 N 15 112.3 0.2 . 1 . . . . 84 ASN ND2 . 15437 1 1015 . 1 1 85 85 VAL H H 1 7.933 0.02 . 1 . . . . 85 VAL HN . 15437 1 1016 . 1 1 85 85 VAL HA H 1 3.849 0.02 . 1 . . . . 85 VAL HA . 15437 1 1017 . 1 1 85 85 VAL HB H 1 2.053 0.02 . 1 . . . . 85 VAL HB . 15437 1 1018 . 1 1 85 85 VAL HG11 H 1 0.9928 0.02 . 2 . . . . 85 VAL HG1 . 15437 1 1019 . 1 1 85 85 VAL HG12 H 1 0.9928 0.02 . 2 . . . . 85 VAL HG1 . 15437 1 1020 . 1 1 85 85 VAL HG13 H 1 0.9928 0.02 . 2 . . . . 85 VAL HG1 . 15437 1 1021 . 1 1 85 85 VAL HG21 H 1 0.8819 0.02 . 2 . . . . 85 VAL HG2 . 15437 1 1022 . 1 1 85 85 VAL HG22 H 1 0.8819 0.02 . 2 . . . . 85 VAL HG2 . 15437 1 1023 . 1 1 85 85 VAL HG23 H 1 0.8819 0.02 . 2 . . . . 85 VAL HG2 . 15437 1 1024 . 1 1 85 85 VAL C C 13 177.1 0.2 . 1 . . . . 85 VAL C . 15437 1 1025 . 1 1 85 85 VAL CA C 13 65.49 0.2 . 1 . . . . 85 VAL CA . 15437 1 1026 . 1 1 85 85 VAL CB C 13 31.76 0.2 . 1 . . . . 85 VAL CB . 15437 1 1027 . 1 1 85 85 VAL CG1 C 13 22.45 0.2 . 2 . . . . 85 VAL CG1 . 15437 1 1028 . 1 1 85 85 VAL CG2 C 13 21.52 0.2 . 2 . . . . 85 VAL CG2 . 15437 1 1029 . 1 1 85 85 VAL N N 15 120.5 0.2 . 1 . . . . 85 VAL N . 15437 1 1030 . 1 1 86 86 HIS H H 1 8.46 0.02 . 1 . . . . 86 HIS HN . 15437 1 1031 . 1 1 86 86 HIS HA H 1 4.054 0.02 . 1 . . . . 86 HIS HA . 15437 1 1032 . 1 1 86 86 HIS HB2 H 1 3.334 0.02 . 2 . . . . 86 HIS HB2 . 15437 1 1033 . 1 1 86 86 HIS HB3 H 1 3.085 0.02 . 2 . . . . 86 HIS HB3 . 15437 1 1034 . 1 1 86 86 HIS HD2 H 1 6.889 0.02 . 1 . . . . 86 HIS HD2 . 15437 1 1035 . 1 1 86 86 HIS C C 13 176.3 0.2 . 1 . . . . 86 HIS C . 15437 1 1036 . 1 1 86 86 HIS CA C 13 59.86 0.2 . 1 . . . . 86 HIS CA . 15437 1 1037 . 1 1 86 86 HIS CB C 13 29.67 0.2 . 1 . . . . 86 HIS CB . 15437 1 1038 . 1 1 86 86 HIS N N 15 119.3 0.2 . 1 . . . . 86 HIS N . 15437 1 1039 . 1 1 87 87 GLU H H 1 7.897 0.02 . 1 . . . . 87 GLU HN . 15437 1 1040 . 1 1 87 87 GLU HA H 1 3.838 0.02 . 1 . . . . 87 GLU HA . 15437 1 1041 . 1 1 87 87 GLU HB2 H 1 2.019 0.02 . 2 . . . . 87 GLU HB2 . 15437 1 1042 . 1 1 87 87 GLU HB3 H 1 2.019 0.02 . 2 . . . . 87 GLU HB3 . 15437 1 1043 . 1 1 87 87 GLU HG2 H 1 2.252 0.02 . 2 . . . . 87 GLU HG2 . 15437 1 1044 . 1 1 87 87 GLU HG3 H 1 2.252 0.02 . 2 . . . . 87 GLU HG3 . 15437 1 1045 . 1 1 87 87 GLU C C 13 178.3 0.2 . 1 . . . . 87 GLU C . 15437 1 1046 . 1 1 87 87 GLU CA C 13 58.69 0.2 . 1 . . . . 87 GLU CA . 15437 1 1047 . 1 1 87 87 GLU CB C 13 28.46 0.2 . 1 . . . . 87 GLU CB . 15437 1 1048 . 1 1 87 87 GLU CG C 13 35.1 0.2 . 1 . . . . 87 GLU CG . 15437 1 1049 . 1 1 87 87 GLU N N 15 117.1 0.2 . 1 . . . . 87 GLU N . 15437 1 1050 . 1 1 88 88 ASN H H 1 8.103 0.02 . 1 . . . . 88 ASN HN . 15437 1 1051 . 1 1 88 88 ASN HA H 1 4.503 0.02 . 1 . . . . 88 ASN HA . 15437 1 1052 . 1 1 88 88 ASN HB2 H 1 2.763 0.02 . 2 . . . . 88 ASN HB2 . 15437 1 1053 . 1 1 88 88 ASN HB3 H 1 2.866 0.02 . 2 . . . . 88 ASN HB3 . 15437 1 1054 . 1 1 88 88 ASN HD21 H 1 7.415 0.02 . 2 . . . . 88 ASN HD21 . 15437 1 1055 . 1 1 88 88 ASN HD22 H 1 6.98 0.02 . 2 . . . . 88 ASN HD22 . 15437 1 1056 . 1 1 88 88 ASN C C 13 177.7 0.2 . 1 . . . . 88 ASN C . 15437 1 1057 . 1 1 88 88 ASN CA C 13 55.99 0.2 . 1 . . . . 88 ASN CA . 15437 1 1058 . 1 1 88 88 ASN CB C 13 39.01 0.2 . 1 . . . . 88 ASN CB . 15437 1 1059 . 1 1 88 88 ASN N N 15 118.4 0.2 . 1 . . . . 88 ASN N . 15437 1 1060 . 1 1 88 88 ASN ND2 N 15 111.2 0.2 . 1 . . . . 88 ASN ND2 . 15437 1 1061 . 1 1 89 89 ILE H H 1 8.501 0.02 . 1 . . . . 89 ILE HN . 15437 1 1062 . 1 1 89 89 ILE HA H 1 3.67 0.02 . 1 . . . . 89 ILE HA . 15437 1 1063 . 1 1 89 89 ILE HB H 1 1.843 0.02 . 1 . . . . 89 ILE HB . 15437 1 1064 . 1 1 89 89 ILE HD11 H 1 0.6992 0.02 . 1 . . . . 89 ILE HD1 . 15437 1 1065 . 1 1 89 89 ILE HD12 H 1 0.6992 0.02 . 1 . . . . 89 ILE HD1 . 15437 1 1066 . 1 1 89 89 ILE HD13 H 1 0.6992 0.02 . 1 . . . . 89 ILE HD1 . 15437 1 1067 . 1 1 89 89 ILE HG12 H 1 1.024 0.02 . 2 . . . . 89 ILE HG12 . 15437 1 1068 . 1 1 89 89 ILE HG13 H 1 1.024 0.02 . 2 . . . . 89 ILE HG13 . 15437 1 1069 . 1 1 89 89 ILE HG21 H 1 0.7787 0.02 . 1 . . . . 89 ILE HG2 . 15437 1 1070 . 1 1 89 89 ILE HG22 H 1 0.7787 0.02 . 1 . . . . 89 ILE HG2 . 15437 1 1071 . 1 1 89 89 ILE HG23 H 1 0.7787 0.02 . 1 . . . . 89 ILE HG2 . 15437 1 1072 . 1 1 89 89 ILE C C 13 177 0.2 . 1 . . . . 89 ILE C . 15437 1 1073 . 1 1 89 89 ILE CA C 13 65.39 0.2 . 1 . . . . 89 ILE CA . 15437 1 1074 . 1 1 89 89 ILE CB C 13 37.44 0.2 . 1 . . . . 89 ILE CB . 15437 1 1075 . 1 1 89 89 ILE CD1 C 13 14.35 0.2 . 1 . . . . 89 ILE CD1 . 15437 1 1076 . 1 1 89 89 ILE CG1 C 13 29.15 0.2 . 1 . . . . 89 ILE CG1 . 15437 1 1077 . 1 1 89 89 ILE CG2 C 13 18.06 0.2 . 1 . . . . 89 ILE CG2 . 15437 1 1078 . 1 1 89 89 ILE N N 15 118.7 0.2 . 1 . . . . 89 ILE N . 15437 1 1079 . 1 1 90 90 LYS H H 1 8.017 0.02 . 1 . . . . 90 LYS HN . 15437 1 1080 . 1 1 90 90 LYS HA H 1 3.775 0.02 . 1 . . . . 90 LYS HA . 15437 1 1081 . 1 1 90 90 LYS HB2 H 1 1.702 0.02 . 2 . . . . 90 LYS HB2 . 15437 1 1082 . 1 1 90 90 LYS HB3 H 1 1.702 0.02 . 2 . . . . 90 LYS HB3 . 15437 1 1083 . 1 1 90 90 LYS HD2 H 1 1.484 0.02 . 2 . . . . 90 LYS HD2 . 15437 1 1084 . 1 1 90 90 LYS HD3 H 1 1.484 0.02 . 2 . . . . 90 LYS HD3 . 15437 1 1085 . 1 1 90 90 LYS HE2 H 1 2.75 0.02 . 2 . . . . 90 LYS HE2 . 15437 1 1086 . 1 1 90 90 LYS HE3 H 1 2.75 0.02 . 2 . . . . 90 LYS HE3 . 15437 1 1087 . 1 1 90 90 LYS HG2 H 1 1.214 0.02 . 2 . . . . 90 LYS HG2 . 15437 1 1088 . 1 1 90 90 LYS HG3 H 1 1.331 0.02 . 2 . . . . 90 LYS HG3 . 15437 1 1089 . 1 1 90 90 LYS C C 13 178.8 0.2 . 1 . . . . 90 LYS C . 15437 1 1090 . 1 1 90 90 LYS CA C 13 60.45 0.2 . 1 . . . . 90 LYS CA . 15437 1 1091 . 1 1 90 90 LYS CB C 13 32.11 0.2 . 1 . . . . 90 LYS CB . 15437 1 1092 . 1 1 90 90 LYS CD C 13 29.52 0.2 . 1 . . . . 90 LYS CD . 15437 1 1093 . 1 1 90 90 LYS CE C 13 41.54 0.2 . 1 . . . . 90 LYS CE . 15437 1 1094 . 1 1 90 90 LYS CG C 13 25.18 0.2 . 1 . . . . 90 LYS CG . 15437 1 1095 . 1 1 90 90 LYS N N 15 120.9 0.2 . 1 . . . . 90 LYS N . 15437 1 1096 . 1 1 91 91 GLU H H 1 7.732 0.02 . 1 . . . . 91 GLU HN . 15437 1 1097 . 1 1 91 91 GLU HA H 1 4.083 0.02 . 1 . . . . 91 GLU HA . 15437 1 1098 . 1 1 91 91 GLU HB2 H 1 2.134 0.02 . 2 . . . . 91 GLU HB2 . 15437 1 1099 . 1 1 91 91 GLU HB3 H 1 2.155 0.02 . 2 . . . . 91 GLU HB3 . 15437 1 1100 . 1 1 91 91 GLU HG2 H 1 2.436 0.02 . 2 . . . . 91 GLU HG2 . 15437 1 1101 . 1 1 91 91 GLU HG3 H 1 2.436 0.02 . 2 . . . . 91 GLU HG3 . 15437 1 1102 . 1 1 91 91 GLU C C 13 179.1 0.2 . 1 . . . . 91 GLU C . 15437 1 1103 . 1 1 91 91 GLU CA C 13 59.12 0.2 . 1 . . . . 91 GLU CA . 15437 1 1104 . 1 1 91 91 GLU CB C 13 28.81 0.2 . 1 . . . . 91 GLU CB . 15437 1 1105 . 1 1 91 91 GLU CG C 13 34.99 0.2 . 1 . . . . 91 GLU CG . 15437 1 1106 . 1 1 91 91 GLU N N 15 119.3 0.2 . 1 . . . . 91 GLU N . 15437 1 1107 . 1 1 92 92 ILE H H 1 8.11 0.02 . 1 . . . . 92 ILE HN . 15437 1 1108 . 1 1 92 92 ILE HA H 1 3.685 0.02 . 1 . . . . 92 ILE HA . 15437 1 1109 . 1 1 92 92 ILE HB H 1 1.852 0.02 . 1 . . . . 92 ILE HB . 15437 1 1110 . 1 1 92 92 ILE HD11 H 1 0.7045 0.02 . 1 . . . . 92 ILE HD1 . 15437 1 1111 . 1 1 92 92 ILE HD12 H 1 0.7045 0.02 . 1 . . . . 92 ILE HD1 . 15437 1 1112 . 1 1 92 92 ILE HD13 H 1 0.7045 0.02 . 1 . . . . 92 ILE HD1 . 15437 1 1113 . 1 1 92 92 ILE HG12 H 1 1.013 0.02 . 2 . . . . 92 ILE HG12 . 15437 1 1114 . 1 1 92 92 ILE HG13 H 1 1.013 0.02 . 2 . . . . 92 ILE HG13 . 15437 1 1115 . 1 1 92 92 ILE HG21 H 1 0.8681 0.02 . 1 . . . . 92 ILE HG2 . 15437 1 1116 . 1 1 92 92 ILE HG22 H 1 0.8681 0.02 . 1 . . . . 92 ILE HG2 . 15437 1 1117 . 1 1 92 92 ILE HG23 H 1 0.8681 0.02 . 1 . . . . 92 ILE HG2 . 15437 1 1118 . 1 1 92 92 ILE C C 13 178 0.2 . 1 . . . . 92 ILE C . 15437 1 1119 . 1 1 92 92 ILE CA C 13 65.9 0.2 . 1 . . . . 92 ILE CA . 15437 1 1120 . 1 1 92 92 ILE CB C 13 38.4 0.2 . 1 . . . . 92 ILE CB . 15437 1 1121 . 1 1 92 92 ILE CD1 C 13 14.28 0.2 . 1 . . . . 92 ILE CD1 . 15437 1 1122 . 1 1 92 92 ILE CG1 C 13 27.85 0.2 . 1 . . . . 92 ILE CG1 . 15437 1 1123 . 1 1 92 92 ILE CG2 C 13 17.9 0.2 . 1 . . . . 92 ILE CG2 . 15437 1 1124 . 1 1 92 92 ILE N N 15 121.1 0.2 . 1 . . . . 92 ILE N . 15437 1 1125 . 1 1 93 93 PHE H H 1 8.651 0.02 . 1 . . . . 93 PHE HN . 15437 1 1126 . 1 1 93 93 PHE HA H 1 3.873 0.02 . 1 . . . . 93 PHE HA . 15437 1 1127 . 1 1 93 93 PHE HB2 H 1 2.813 0.02 . 2 . . . . 93 PHE HB2 . 15437 1 1128 . 1 1 93 93 PHE HB3 H 1 3.023 0.02 . 2 . . . . 93 PHE HB3 . 15437 1 1129 . 1 1 93 93 PHE HD1 H 1 6.734 0.02 . 3 . . . . 93 PHE HD1 . 15437 1 1130 . 1 1 93 93 PHE HD2 H 1 6.734 0.02 . 3 . . . . 93 PHE HD2 . 15437 1 1131 . 1 1 93 93 PHE HE1 H 1 7.026 0.02 . 3 . . . . 93 PHE HE1 . 15437 1 1132 . 1 1 93 93 PHE HE2 H 1 7.026 0.02 . 3 . . . . 93 PHE HE2 . 15437 1 1133 . 1 1 93 93 PHE C C 13 177.1 0.2 . 1 . . . . 93 PHE C . 15437 1 1134 . 1 1 93 93 PHE CA C 13 61.02 0.2 . 1 . . . . 93 PHE CA . 15437 1 1135 . 1 1 93 93 PHE CB C 13 38.56 0.2 . 1 . . . . 93 PHE CB . 15437 1 1136 . 1 1 93 93 PHE CD1 C 13 130.3 0.2 . 3 . . . . 93 PHE CD1 . 15437 1 1137 . 1 1 93 93 PHE CD2 C 13 130.3 0.2 . 3 . . . . 93 PHE CD2 . 15437 1 1138 . 1 1 93 93 PHE N N 15 119.4 0.2 . 1 . . . . 93 PHE N . 15437 1 1139 . 1 1 94 94 HIS H H 1 8.126 0.02 . 1 . . . . 94 HIS HN . 15437 1 1140 . 1 1 94 94 HIS HA H 1 4.368 0.02 . 1 . . . . 94 HIS HA . 15437 1 1141 . 1 1 94 94 HIS HB2 H 1 3.258 0.02 . 2 . . . . 94 HIS HB2 . 15437 1 1142 . 1 1 94 94 HIS HB3 H 1 3.258 0.02 . 2 . . . . 94 HIS HB3 . 15437 1 1143 . 1 1 94 94 HIS HD2 H 1 6.735 0.02 . 1 . . . . 94 HIS HD2 . 15437 1 1144 . 1 1 94 94 HIS HE1 H 1 7.098 0.02 . 1 . . . . 94 HIS HE1 . 15437 1 1145 . 1 1 94 94 HIS C C 13 177.1 0.2 . 1 . . . . 94 HIS C . 15437 1 1146 . 1 1 94 94 HIS CA C 13 58.31 0.2 . 1 . . . . 94 HIS CA . 15437 1 1147 . 1 1 94 94 HIS CB C 13 27.91 0.2 . 1 . . . . 94 HIS CB . 15437 1 1148 . 1 1 94 94 HIS N N 15 116.4 0.2 . 1 . . . . 94 HIS N . 15437 1 1149 . 1 1 95 95 HIS H H 1 8.058 0.02 . 1 . . . . 95 HIS HN . 15437 1 1150 . 1 1 95 95 HIS HA H 1 4.465 0.02 . 1 . . . . 95 HIS HA . 15437 1 1151 . 1 1 95 95 HIS HB2 H 1 3.288 0.02 . 2 . . . . 95 HIS HB2 . 15437 1 1152 . 1 1 95 95 HIS HB3 H 1 3.231 0.02 . 2 . . . . 95 HIS HB3 . 15437 1 1153 . 1 1 95 95 HIS HD2 H 1 7.2 0.02 . 1 . . . . 95 HIS HD2 . 15437 1 1154 . 1 1 95 95 HIS C C 13 177.3 0.2 . 1 . . . . 95 HIS C . 15437 1 1155 . 1 1 95 95 HIS CA C 13 57.9 0.2 . 1 . . . . 95 HIS CA . 15437 1 1156 . 1 1 95 95 HIS CB C 13 28.49 0.2 . 1 . . . . 95 HIS CB . 15437 1 1157 . 1 1 95 95 HIS N N 15 117 0.2 . 1 . . . . 95 HIS N . 15437 1 1158 . 1 1 96 96 LEU H H 1 8.525 0.02 . 1 . . . . 96 LEU HN . 15437 1 1159 . 1 1 96 96 LEU HA H 1 3.865 0.02 . 1 . . . . 96 LEU HA . 15437 1 1160 . 1 1 96 96 LEU HB2 H 1 1.726 0.02 . 2 . . . . 96 LEU HB2 . 15437 1 1161 . 1 1 96 96 LEU HB3 H 1 1.515 0.02 . 2 . . . . 96 LEU HB3 . 15437 1 1162 . 1 1 96 96 LEU HD11 H 1 0.6515 0.02 . 2 . . . . 96 LEU HD1 . 15437 1 1163 . 1 1 96 96 LEU HD12 H 1 0.6515 0.02 . 2 . . . . 96 LEU HD1 . 15437 1 1164 . 1 1 96 96 LEU HD13 H 1 0.6515 0.02 . 2 . . . . 96 LEU HD1 . 15437 1 1165 . 1 1 96 96 LEU HD21 H 1 0.7695 0.02 . 2 . . . . 96 LEU HD2 . 15437 1 1166 . 1 1 96 96 LEU HD22 H 1 0.7695 0.02 . 2 . . . . 96 LEU HD2 . 15437 1 1167 . 1 1 96 96 LEU HD23 H 1 0.7695 0.02 . 2 . . . . 96 LEU HD2 . 15437 1 1168 . 1 1 96 96 LEU HG H 1 1.62 0.02 . 1 . . . . 96 LEU HG . 15437 1 1169 . 1 1 96 96 LEU C C 13 178.3 0.2 . 1 . . . . 96 LEU C . 15437 1 1170 . 1 1 96 96 LEU CA C 13 58.25 0.2 . 1 . . . . 96 LEU CA . 15437 1 1171 . 1 1 96 96 LEU CB C 13 41.72 0.2 . 1 . . . . 96 LEU CB . 15437 1 1172 . 1 1 96 96 LEU CD1 C 13 25.43 0.2 . 2 . . . . 96 LEU CD1 . 15437 1 1173 . 1 1 96 96 LEU CD2 C 13 25.01 0.2 . 2 . . . . 96 LEU CD2 . 15437 1 1174 . 1 1 96 96 LEU CG C 13 27.95 0.2 . 1 . . . . 96 LEU CG . 15437 1 1175 . 1 1 96 96 LEU N N 15 121.3 0.2 . 1 . . . . 96 LEU N . 15437 1 1176 . 1 1 97 97 GLU H H 1 8.076 0.02 . 1 . . . . 97 GLU HN . 15437 1 1177 . 1 1 97 97 GLU HA H 1 3.719 0.02 . 1 . . . . 97 GLU HA . 15437 1 1178 . 1 1 97 97 GLU HB2 H 1 1.994 0.02 . 2 . . . . 97 GLU HB2 . 15437 1 1179 . 1 1 97 97 GLU HB3 H 1 1.88 0.02 . 2 . . . . 97 GLU HB3 . 15437 1 1180 . 1 1 97 97 GLU HG2 H 1 2.107 0.02 . 2 . . . . 97 GLU HG2 . 15437 1 1181 . 1 1 97 97 GLU HG3 H 1 2.107 0.02 . 2 . . . . 97 GLU HG3 . 15437 1 1182 . 1 1 97 97 GLU C C 13 178.3 0.2 . 1 . . . . 97 GLU C . 15437 1 1183 . 1 1 97 97 GLU CA C 13 59.3 0.2 . 1 . . . . 97 GLU CA . 15437 1 1184 . 1 1 97 97 GLU CB C 13 28.96 0.2 . 1 . . . . 97 GLU CB . 15437 1 1185 . 1 1 97 97 GLU CG C 13 35.24 0.2 . 1 . . . . 97 GLU CG . 15437 1 1186 . 1 1 97 97 GLU N N 15 117.1 0.2 . 1 . . . . 97 GLU N . 15437 1 1187 . 1 1 98 98 GLU H H 1 7.329 0.02 . 1 . . . . 98 GLU HN . 15437 1 1188 . 1 1 98 98 GLU HA H 1 4.024 0.02 . 1 . . . . 98 GLU HA . 15437 1 1189 . 1 1 98 98 GLU HB2 H 1 2.12 0.02 . 2 . . . . 98 GLU HB2 . 15437 1 1190 . 1 1 98 98 GLU HB3 H 1 2.027 0.02 . 2 . . . . 98 GLU HB3 . 15437 1 1191 . 1 1 98 98 GLU HG2 H 1 2.348 0.02 . 2 . . . . 98 GLU HG2 . 15437 1 1192 . 1 1 98 98 GLU HG3 H 1 2.23 0.02 . 2 . . . . 98 GLU HG3 . 15437 1 1193 . 1 1 98 98 GLU C C 13 177.9 0.2 . 1 . . . . 98 GLU C . 15437 1 1194 . 1 1 98 98 GLU CA C 13 58.19 0.2 . 1 . . . . 98 GLU CA . 15437 1 1195 . 1 1 98 98 GLU CB C 13 29.12 0.2 . 1 . . . . 98 GLU CB . 15437 1 1196 . 1 1 98 98 GLU CG C 13 35.11 0.2 . 1 . . . . 98 GLU CG . 15437 1 1197 . 1 1 98 98 GLU N N 15 116 0.2 . 1 . . . . 98 GLU N . 15437 1 1198 . 1 1 99 99 LEU H H 1 7.535 0.02 . 1 . . . . 99 LEU HN . 15437 1 1199 . 1 1 99 99 LEU HA H 1 4.183 0.02 . 1 . . . . 99 LEU HA . 15437 1 1200 . 1 1 99 99 LEU HB2 H 1 1.788 0.02 . 2 . . . . 99 LEU HB2 . 15437 1 1201 . 1 1 99 99 LEU HB3 H 1 1.502 0.02 . 2 . . . . 99 LEU HB3 . 15437 1 1202 . 1 1 99 99 LEU HD11 H 1 0.7268 0.02 . 2 . . . . 99 LEU HD1 . 15437 1 1203 . 1 1 99 99 LEU HD12 H 1 0.7268 0.02 . 2 . . . . 99 LEU HD1 . 15437 1 1204 . 1 1 99 99 LEU HD13 H 1 0.7268 0.02 . 2 . . . . 99 LEU HD1 . 15437 1 1205 . 1 1 99 99 LEU HD21 H 1 0.7777 0.02 . 2 . . . . 99 LEU HD2 . 15437 1 1206 . 1 1 99 99 LEU HD22 H 1 0.7777 0.02 . 2 . . . . 99 LEU HD2 . 15437 1 1207 . 1 1 99 99 LEU HD23 H 1 0.7777 0.02 . 2 . . . . 99 LEU HD2 . 15437 1 1208 . 1 1 99 99 LEU HG H 1 1.705 0.02 . 1 . . . . 99 LEU HG . 15437 1 1209 . 1 1 99 99 LEU C C 13 178.1 0.2 . 1 . . . . 99 LEU C . 15437 1 1210 . 1 1 99 99 LEU CA C 13 56.44 0.2 . 1 . . . . 99 LEU CA . 15437 1 1211 . 1 1 99 99 LEU CB C 13 43.01 0.2 . 1 . . . . 99 LEU CB . 15437 1 1212 . 1 1 99 99 LEU CD1 C 13 25.72 0.2 . 2 . . . . 99 LEU CD1 . 15437 1 1213 . 1 1 99 99 LEU CD2 C 13 23.22 0.2 . 2 . . . . 99 LEU CD2 . 15437 1 1214 . 1 1 99 99 LEU CG C 13 26.75 0.2 . 1 . . . . 99 LEU CG . 15437 1 1215 . 1 1 99 99 LEU N N 15 118.2 0.2 . 1 . . . . 99 LEU N . 15437 1 1216 . 1 1 100 100 VAL H H 1 7.561 0.02 . 1 . . . . 100 VAL HN . 15437 1 1217 . 1 1 100 100 VAL HA H 1 4.033 0.02 . 1 . . . . 100 VAL HA . 15437 1 1218 . 1 1 100 100 VAL HB H 1 2.044 0.02 . 1 . . . . 100 VAL HB . 15437 1 1219 . 1 1 100 100 VAL HG11 H 1 0.6971 0.02 . 2 . . . . 100 VAL HG1 . 15437 1 1220 . 1 1 100 100 VAL HG12 H 1 0.6971 0.02 . 2 . . . . 100 VAL HG1 . 15437 1 1221 . 1 1 100 100 VAL HG13 H 1 0.6971 0.02 . 2 . . . . 100 VAL HG1 . 15437 1 1222 . 1 1 100 100 VAL HG21 H 1 0.7888 0.02 . 2 . . . . 100 VAL HG2 . 15437 1 1223 . 1 1 100 100 VAL HG22 H 1 0.7888 0.02 . 2 . . . . 100 VAL HG2 . 15437 1 1224 . 1 1 100 100 VAL HG23 H 1 0.7888 0.02 . 2 . . . . 100 VAL HG2 . 15437 1 1225 . 1 1 100 100 VAL C C 13 175.4 0.2 . 1 . . . . 100 VAL C . 15437 1 1226 . 1 1 100 100 VAL CA C 13 62.43 0.2 . 1 . . . . 100 VAL CA . 15437 1 1227 . 1 1 100 100 VAL CB C 13 32.05 0.2 . 1 . . . . 100 VAL CB . 15437 1 1228 . 1 1 100 100 VAL CG1 C 13 21.22 0.2 . 2 . . . . 100 VAL CG1 . 15437 1 1229 . 1 1 100 100 VAL CG2 C 13 20.53 0.2 . 2 . . . . 100 VAL CG2 . 15437 1 1230 . 1 1 100 100 VAL N N 15 114.8 0.2 . 1 . . . . 100 VAL N . 15437 1 1231 . 1 1 101 101 HIS H H 1 7.827 0.02 . 1 . . . . 101 HIS HN . 15437 1 1232 . 1 1 101 101 HIS HA H 1 4.63 0.02 . 1 . . . . 101 HIS HA . 15437 1 1233 . 1 1 101 101 HIS HB2 H 1 3.283 0.02 . 2 . . . . 101 HIS HB2 . 15437 1 1234 . 1 1 101 101 HIS HB3 H 1 3.183 0.02 . 2 . . . . 101 HIS HB3 . 15437 1 1235 . 1 1 101 101 HIS HD2 H 1 7.267 0.02 . 1 . . . . 101 HIS HD2 . 15437 1 1236 . 1 1 101 101 HIS HE1 H 1 7.424 0.02 . 1 . . . . 101 HIS HE1 . 15437 1 1237 . 1 1 101 101 HIS C C 13 173.5 0.2 . 1 . . . . 101 HIS C . 15437 1 1238 . 1 1 101 101 HIS CA C 13 55.41 0.2 . 1 . . . . 101 HIS CA . 15437 1 1239 . 1 1 101 101 HIS CB C 13 28.87 0.2 . 1 . . . . 101 HIS CB . 15437 1 1240 . 1 1 101 101 HIS N N 15 120.3 0.2 . 1 . . . . 101 HIS N . 15437 1 1241 . 1 1 102 102 ARG H H 1 7.987 0.02 . 1 . . . . 102 ARG HN . 15437 1 1242 . 1 1 102 102 ARG HA H 1 4.122 0.02 . 1 . . . . 102 ARG HA . 15437 1 1243 . 1 1 102 102 ARG HB2 H 1 1.827 0.02 . 2 . . . . 102 ARG HB2 . 15437 1 1244 . 1 1 102 102 ARG HB3 H 1 1.696 0.02 . 2 . . . . 102 ARG HB3 . 15437 1 1245 . 1 1 102 102 ARG HD2 H 1 3.154 0.02 . 2 . . . . 102 ARG HD2 . 15437 1 1246 . 1 1 102 102 ARG HD3 H 1 3.154 0.02 . 2 . . . . 102 ARG HD3 . 15437 1 1247 . 1 1 102 102 ARG HG2 H 1 1.593 0.02 . 2 . . . . 102 ARG HG2 . 15437 1 1248 . 1 1 102 102 ARG HG3 H 1 1.593 0.02 . 2 . . . . 102 ARG HG3 . 15437 1 1249 . 1 1 102 102 ARG C C 13 180.8 0.2 . 1 . . . . 102 ARG C . 15437 1 1250 . 1 1 102 102 ARG CA C 13 57.57 0.2 . 1 . . . . 102 ARG CA . 15437 1 1251 . 1 1 102 102 ARG CB C 13 31.24 0.2 . 1 . . . . 102 ARG CB . 15437 1 1252 . 1 1 102 102 ARG CD C 13 43.54 0.2 . 1 . . . . 102 ARG CD . 15437 1 1253 . 1 1 102 102 ARG CG C 13 27.25 0.2 . 1 . . . . 102 ARG CG . 15437 1 1254 . 1 1 102 102 ARG N N 15 127.3 0.2 . 1 . . . . 102 ARG N . 15437 1 stop_ save_ ############################## # Heteronuclear NOE values # ############################## save_NOE_list_1 _Heteronucl_NOE_list.Sf_category heteronucl_NOEs _Heteronucl_NOE_list.Sf_framecode NOE_list_1 _Heteronucl_NOE_list.Entry_ID 15437 _Heteronucl_NOE_list.ID 1 _Heteronucl_NOE_list.Sample_condition_list_ID 1 _Heteronucl_NOE_list.Sample_condition_list_label $sample_conditions_1 _Heteronucl_NOE_list.Spectrometer_frequency_1H 500 _Heteronucl_NOE_list.Heteronuclear_NOE_val_type 'relative intensities' _Heteronucl_NOE_list.NOE_ref_val . _Heteronucl_NOE_list.NOE_ref_description . _Heteronucl_NOE_list.Details . _Heteronucl_NOE_list.Text_data_format . _Heteronucl_NOE_list.Text_data . loop_ _Heteronucl_NOE_experiment.Experiment_ID _Heteronucl_NOE_experiment.Experiment_name _Heteronucl_NOE_experiment.Sample_ID _Heteronucl_NOE_experiment.Sample_label _Heteronucl_NOE_experiment.Sample_state _Heteronucl_NOE_experiment.Entry_ID _Heteronucl_NOE_experiment.Heteronucl_NOE_list_ID 1 '2D 1H-15N HSQC' . . . 15437 1 stop_ loop_ _Heteronucl_NOE.ID _Heteronucl_NOE.Assembly_atom_ID_1 _Heteronucl_NOE.Entity_assembly_ID_1 _Heteronucl_NOE.Entity_ID_1 _Heteronucl_NOE.Comp_index_ID_1 _Heteronucl_NOE.Seq_ID_1 _Heteronucl_NOE.Comp_ID_1 _Heteronucl_NOE.Atom_ID_1 _Heteronucl_NOE.Atom_type_1 _Heteronucl_NOE.Atom_isotope_number_1 _Heteronucl_NOE.Assembly_atom_ID_2 _Heteronucl_NOE.Entity_assembly_ID_2 _Heteronucl_NOE.Entity_ID_2 _Heteronucl_NOE.Comp_index_ID_2 _Heteronucl_NOE.Seq_ID_2 _Heteronucl_NOE.Comp_ID_2 _Heteronucl_NOE.Atom_ID_2 _Heteronucl_NOE.Atom_type_2 _Heteronucl_NOE.Atom_isotope_number_2 _Heteronucl_NOE.Val _Heteronucl_NOE.Val_err _Heteronucl_NOE.Resonance_ID_1 _Heteronucl_NOE.Resonance_ID_2 _Heteronucl_NOE.Auth_entity_assembly_ID_1 _Heteronucl_NOE.Auth_seq_ID_1 _Heteronucl_NOE.Auth_comp_ID_1 _Heteronucl_NOE.Auth_atom_ID_1 _Heteronucl_NOE.Auth_entity_assembly_ID_2 _Heteronucl_NOE.Auth_seq_ID_2 _Heteronucl_NOE.Auth_comp_ID_2 _Heteronucl_NOE.Auth_atom_ID_2 _Heteronucl_NOE.Entry_ID _Heteronucl_NOE.Heteronucl_NOE_list_ID 1 . 1 1 2 2 TYR N N 15 . 1 1 2 2 TYR H H 1 0.128 0.326 . . . . . . . . . . 15437 1 2 . 1 1 3 3 GLY N N 15 . 1 1 3 3 GLY H H 1 0.664 0.146 . . . . . . . . . . 15437 1 3 . 1 1 4 4 LYS N N 15 . 1 1 4 4 LYS H H 1 0.815 0.124 . . . . . . . . . . 15437 1 4 . 1 1 5 5 LEU N N 15 . 1 1 5 5 LEU H H 1 0.644 0.093 . . . . . . . . . . 15437 1 5 . 1 1 6 6 ASN N N 15 . 1 1 6 6 ASN H H 1 0.608 0.081 . . . . . . . . . . 15437 1 6 . 1 1 7 7 ASP N N 15 . 1 1 7 7 ASP H H 1 0.822 0.103 . . . . . . . . . . 15437 1 7 . 1 1 8 8 LEU N N 15 . 1 1 8 8 LEU H H 1 0.815 0.136 . . . . . . . . . . 15437 1 8 . 1 1 9 9 LEU N N 15 . 1 1 9 9 LEU H H 1 0.876 0.127 . . . . . . . . . . 15437 1 9 . 1 1 10 10 GLU N N 15 . 1 1 10 10 GLU H H 1 0.925 0.138 . . . . . . . . . . 15437 1 10 . 1 1 11 11 ASP N N 15 . 1 1 11 11 ASP H H 1 0.823 0.109 . . . . . . . . . . 15437 1 11 . 1 1 12 12 LEU N N 15 . 1 1 12 12 LEU H H 1 0.885 0.130 . . . . . . . . . . 15437 1 12 . 1 1 13 13 GLN N N 15 . 1 1 13 13 GLN H H 1 0.865 0.191 . . . . . . . . . . 15437 1 13 . 1 1 14 14 GLU N N 15 . 1 1 14 14 GLU H H 1 0.783 0.133 . . . . . . . . . . 15437 1 14 . 1 1 15 15 VAL N N 15 . 1 1 15 15 VAL H H 1 0.925 0.096 . . . . . . . . . . 15437 1 15 . 1 1 16 16 LEU N N 15 . 1 1 16 16 LEU H H 1 0.859 0.132 . . . . . . . . . . 15437 1 16 . 1 1 17 17 LYS N N 15 . 1 1 17 17 LYS H H 1 0.786 0.226 . . . . . . . . . . 15437 1 17 . 1 1 18 18 HIS N N 15 . 1 1 18 18 HIS H H 1 0.715 0.175 . . . . . . . . . . 15437 1 18 . 1 1 20 20 ASN N N 15 . 1 1 20 20 ASN H H 1 0.777 0.313 . . . . . . . . . . 15437 1 19 . 1 1 21 21 GLN N N 15 . 1 1 21 21 GLN H H 1 0.581 0.122 . . . . . . . . . . 15437 1 20 . 1 1 22 22 HIS N N 15 . 1 1 22 22 HIS H H 1 0.621 0.226 . . . . . . . . . . 15437 1 21 . 1 1 23 23 TRP N N 15 . 1 1 23 23 TRP H H 1 0.646 0.140 . . . . . . . . . . 15437 1 22 . 1 1 24 24 GLN N N 15 . 1 1 24 24 GLN H H 1 0.391 0.258 . . . . . . . . . . 15437 1 23 . 1 1 26 26 GLY N N 15 . 1 1 26 26 GLY H H 1 0.519 0.129 . . . . . . . . . . 15437 1 24 . 1 1 27 27 GLN N N 15 . 1 1 27 27 GLN H H 1 0.765 0.254 . . . . . . . . . . 15437 1 25 . 1 1 28 28 LYS N N 15 . 1 1 28 28 LYS H H 1 0.906 0.122 . . . . . . . . . . 15437 1 26 . 1 1 29 29 ASN N N 15 . 1 1 29 29 ASN H H 1 0.369 0.078 . . . . . . . . . . 15437 1 27 . 1 1 30 30 MET N N 15 . 1 1 30 30 MET H H 1 0.574 0.328 . . . . . . . . . . 15437 1 28 . 1 1 31 31 ASN N N 15 . 1 1 31 31 ASN H H 1 0.663 0.165 . . . . . . . . . . 15437 1 29 . 1 1 32 32 LYS N N 15 . 1 1 32 32 LYS H H 1 0.660 0.204 . . . . . . . . . . 15437 1 30 . 1 1 33 33 VAL N N 15 . 1 1 33 33 VAL H H 1 0.821 0.182 . . . . . . . . . . 15437 1 31 . 1 1 34 34 ASP N N 15 . 1 1 34 34 ASP H H 1 0.874 0.284 . . . . . . . . . . 15437 1 32 . 1 1 35 35 HIS N N 15 . 1 1 35 35 HIS H H 1 0.775 0.482 . . . . . . . . . . 15437 1 33 . 1 1 36 36 HIS N N 15 . 1 1 36 36 HIS H H 1 0.931 0.048 . . . . . . . . . . 15437 1 34 . 1 1 37 37 LEU N N 15 . 1 1 37 37 LEU H H 1 0.965 0.171 . . . . . . . . . . 15437 1 35 . 1 1 38 38 GLN N N 15 . 1 1 38 38 GLN H H 1 0.783 0.196 . . . . . . . . . . 15437 1 36 . 1 1 39 39 ASN N N 15 . 1 1 39 39 ASN H H 1 0.794 0.136 . . . . . . . . . . 15437 1 37 . 1 1 40 40 VAL N N 15 . 1 1 40 40 VAL H H 1 0.739 0.078 . . . . . . . . . . 15437 1 38 . 1 1 41 41 ILE N N 15 . 1 1 41 41 ILE H H 1 0.905 0.143 . . . . . . . . . . 15437 1 39 . 1 1 42 42 GLU N N 15 . 1 1 42 42 GLU H H 1 0.832 0.105 . . . . . . . . . . 15437 1 40 . 1 1 43 43 ASP N N 15 . 1 1 43 43 ASP H H 1 0.948 0.105 . . . . . . . . . . 15437 1 41 . 1 1 44 44 ILE N N 15 . 1 1 44 44 ILE H H 1 0.848 0.174 . . . . . . . . . . 15437 1 42 . 1 1 45 45 HIS N N 15 . 1 1 45 45 HIS H H 1 0.720 0.124 . . . . . . . . . . 15437 1 43 . 1 1 46 46 ASP N N 15 . 1 1 46 46 ASP H H 1 0.702 0.101 . . . . . . . . . . 15437 1 44 . 1 1 47 47 PHE N N 15 . 1 1 47 47 PHE H H 1 0.864 0.166 . . . . . . . . . . 15437 1 45 . 1 1 48 48 MET N N 15 . 1 1 48 48 MET H H 1 0.834 0.192 . . . . . . . . . . 15437 1 46 . 1 1 49 49 GLN N N 15 . 1 1 49 49 GLN H H 1 0.929 0.138 . . . . . . . . . . 15437 1 47 . 1 1 50 50 GLY N N 15 . 1 1 50 50 GLY H H 1 0.728 0.123 . . . . . . . . . . 15437 1 48 . 1 1 51 51 GLY N N 15 . 1 1 51 51 GLY H H 1 0.791 0.103 . . . . . . . . . . 15437 1 49 . 1 1 52 52 GLY N N 15 . 1 1 52 52 GLY H H 1 0.602 0.074 . . . . . . . . . . 15437 1 50 . 1 1 53 53 SER N N 15 . 1 1 53 53 SER H H 1 0.493 0.214 . . . . . . . . . . 15437 1 51 . 1 1 54 54 GLY N N 15 . 1 1 54 54 GLY H H 1 0.595 0.193 . . . . . . . . . . 15437 1 52 . 1 1 55 55 GLY N N 15 . 1 1 55 55 GLY H H 1 0.617 0.144 . . . . . . . . . . 15437 1 53 . 1 1 56 56 LYS N N 15 . 1 1 56 56 LYS H H 1 0.614 0.153 . . . . . . . . . . 15437 1 54 . 1 1 57 57 LEU N N 15 . 1 1 57 57 LEU H H 1 0.789 0.088 . . . . . . . . . . 15437 1 55 . 1 1 58 58 GLN N N 15 . 1 1 58 58 GLN H H 1 0.895 0.115 . . . . . . . . . . 15437 1 56 . 1 1 59 59 GLU N N 15 . 1 1 59 59 GLU H H 1 0.603 0.116 . . . . . . . . . . 15437 1 57 . 1 1 60 60 MET N N 15 . 1 1 60 60 MET H H 1 0.703 0.137 . . . . . . . . . . 15437 1 58 . 1 1 61 61 MET N N 15 . 1 1 61 61 MET H H 1 0.858 0.151 . . . . . . . . . . 15437 1 59 . 1 1 62 62 LYS N N 15 . 1 1 62 62 LYS H H 1 0.769 0.143 . . . . . . . . . . 15437 1 60 . 1 1 63 63 GLU N N 15 . 1 1 63 63 GLU H H 1 0.919 0.163 . . . . . . . . . . 15437 1 61 . 1 1 64 64 PHE N N 15 . 1 1 64 64 PHE H H 1 0.820 0.173 . . . . . . . . . . 15437 1 62 . 1 1 65 65 GLN N N 15 . 1 1 65 65 GLN H H 1 0.798 0.127 . . . . . . . . . . 15437 1 63 . 1 1 66 66 GLN N N 15 . 1 1 66 66 GLN H H 1 0.900 0.171 . . . . . . . . . . 15437 1 64 . 1 1 67 67 VAL N N 15 . 1 1 67 67 VAL H H 1 0.866 0.080 . . . . . . . . . . 15437 1 65 . 1 1 68 68 LEU N N 15 . 1 1 68 68 LEU H H 1 0.842 0.115 . . . . . . . . . . 15437 1 66 . 1 1 69 69 ASP N N 15 . 1 1 69 69 ASP H H 1 0.786 0.134 . . . . . . . . . . 15437 1 67 . 1 1 70 70 GLU N N 15 . 1 1 70 70 GLU H H 1 0.817 0.126 . . . . . . . . . . 15437 1 68 . 1 1 71 71 ILE N N 15 . 1 1 71 71 ILE H H 1 0.845 0.281 . . . . . . . . . . 15437 1 69 . 1 1 72 72 LYS N N 15 . 1 1 72 72 LYS H H 1 0.631 0.090 . . . . . . . . . . 15437 1 70 . 1 1 73 73 GLN N N 15 . 1 1 73 73 GLN H H 1 0.766 0.127 . . . . . . . . . . 15437 1 71 . 1 1 74 74 GLN N N 15 . 1 1 74 74 GLN H H 1 0.855 0.223 . . . . . . . . . . 15437 1 72 . 1 1 75 75 LEU N N 15 . 1 1 75 75 LEU H H 1 0.774 0.237 . . . . . . . . . . 15437 1 73 . 1 1 76 76 GLN N N 15 . 1 1 76 76 GLN H H 1 0.643 0.377 . . . . . . . . . . 15437 1 74 . 1 1 77 77 GLY N N 15 . 1 1 77 77 GLY H H 1 0.757 0.225 . . . . . . . . . . 15437 1 75 . 1 1 78 78 GLY N N 15 . 1 1 78 78 GLY H H 1 0.594 0.245 . . . . . . . . . . 15437 1 76 . 1 1 79 79 ASP N N 15 . 1 1 79 79 ASP H H 1 0.649 0.157 . . . . . . . . . . 15437 1 77 . 1 1 80 80 ASN N N 15 . 1 1 80 80 ASN H H 1 0.913 0.174 . . . . . . . . . . 15437 1 78 . 1 1 81 81 SER N N 15 . 1 1 81 81 SER H H 1 0.847 0.251 . . . . . . . . . . 15437 1 79 . 1 1 82 82 LEU N N 15 . 1 1 82 82 LEU H H 1 0.728 0.057 . . . . . . . . . . 15437 1 80 . 1 1 83 83 HIS N N 15 . 1 1 83 83 HIS H H 1 0.822 0.199 . . . . . . . . . . 15437 1 81 . 1 1 84 84 ASN N N 15 . 1 1 84 84 ASN H H 1 0.747 0.202 . . . . . . . . . . 15437 1 82 . 1 1 85 85 VAL N N 15 . 1 1 85 85 VAL H H 1 0.741 0.061 . . . . . . . . . . 15437 1 83 . 1 1 86 86 HIS N N 15 . 1 1 86 86 HIS H H 1 0.922 0.152 . . . . . . . . . . 15437 1 84 . 1 1 87 87 GLU N N 15 . 1 1 87 87 GLU H H 1 0.660 0.283 . . . . . . . . . . 15437 1 85 . 1 1 88 88 ASN N N 15 . 1 1 88 88 ASN H H 1 0.895 0.219 . . . . . . . . . . 15437 1 86 . 1 1 89 89 ILE N N 15 . 1 1 89 89 ILE H H 1 0.867 0.467 . . . . . . . . . . 15437 1 87 . 1 1 90 90 LYS N N 15 . 1 1 90 90 LYS H H 1 0.930 0.111 . . . . . . . . . . 15437 1 88 . 1 1 91 91 GLU N N 15 . 1 1 91 91 GLU H H 1 0.847 0.068 . . . . . . . . . . 15437 1 89 . 1 1 92 92 ILE N N 15 . 1 1 92 92 ILE H H 1 0.881 0.160 . . . . . . . . . . 15437 1 90 . 1 1 93 93 PHE N N 15 . 1 1 93 93 PHE H H 1 0.748 0.238 . . . . . . . . . . 15437 1 91 . 1 1 94 94 HIS N N 15 . 1 1 94 94 HIS H H 1 0.839 0.149 . . . . . . . . . . 15437 1 92 . 1 1 95 95 HIS N N 15 . 1 1 95 95 HIS H H 1 0.814 0.058 . . . . . . . . . . 15437 1 93 . 1 1 96 96 LEU N N 15 . 1 1 96 96 LEU H H 1 0.834 0.191 . . . . . . . . . . 15437 1 94 . 1 1 97 97 GLU N N 15 . 1 1 97 97 GLU H H 1 1.002 0.058 . . . . . . . . . . 15437 1 95 . 1 1 98 98 GLU N N 15 . 1 1 98 98 GLU H H 1 0.740 0.172 . . . . . . . . . . 15437 1 96 . 1 1 99 99 LEU N N 15 . 1 1 99 99 LEU H H 1 0.736 0.102 . . . . . . . . . . 15437 1 97 . 1 1 100 100 VAL N N 15 . 1 1 100 100 VAL H H 1 0.700 0.246 . . . . . . . . . . 15437 1 98 . 1 1 101 101 HIS N N 15 . 1 1 101 101 HIS H H 1 0.395 0.089 . . . . . . . . . . 15437 1 99 . 1 1 102 102 ARG N N 15 . 1 1 102 102 ARG H H 1 0.204 0.069 . . . . . . . . . . 15437 1 stop_ save_ save_NOE_list_2 _Heteronucl_NOE_list.Sf_category heteronucl_NOEs _Heteronucl_NOE_list.Sf_framecode NOE_list_2 _Heteronucl_NOE_list.Entry_ID 15437 _Heteronucl_NOE_list.ID 2 _Heteronucl_NOE_list.Sample_condition_list_ID 1 _Heteronucl_NOE_list.Sample_condition_list_label $sample_conditions_1 _Heteronucl_NOE_list.Spectrometer_frequency_1H 600 _Heteronucl_NOE_list.Heteronuclear_NOE_val_type 'relative intensities' _Heteronucl_NOE_list.NOE_ref_val . _Heteronucl_NOE_list.NOE_ref_description . _Heteronucl_NOE_list.Details . _Heteronucl_NOE_list.Text_data_format . _Heteronucl_NOE_list.Text_data . loop_ _Heteronucl_NOE_experiment.Experiment_ID _Heteronucl_NOE_experiment.Experiment_name _Heteronucl_NOE_experiment.Sample_ID _Heteronucl_NOE_experiment.Sample_label _Heteronucl_NOE_experiment.Sample_state _Heteronucl_NOE_experiment.Entry_ID _Heteronucl_NOE_experiment.Heteronucl_NOE_list_ID 1 '2D 1H-15N HSQC' . . . 15437 2 stop_ loop_ _Heteronucl_NOE.ID _Heteronucl_NOE.Assembly_atom_ID_1 _Heteronucl_NOE.Entity_assembly_ID_1 _Heteronucl_NOE.Entity_ID_1 _Heteronucl_NOE.Comp_index_ID_1 _Heteronucl_NOE.Seq_ID_1 _Heteronucl_NOE.Comp_ID_1 _Heteronucl_NOE.Atom_ID_1 _Heteronucl_NOE.Atom_type_1 _Heteronucl_NOE.Atom_isotope_number_1 _Heteronucl_NOE.Assembly_atom_ID_2 _Heteronucl_NOE.Entity_assembly_ID_2 _Heteronucl_NOE.Entity_ID_2 _Heteronucl_NOE.Comp_index_ID_2 _Heteronucl_NOE.Seq_ID_2 _Heteronucl_NOE.Comp_ID_2 _Heteronucl_NOE.Atom_ID_2 _Heteronucl_NOE.Atom_type_2 _Heteronucl_NOE.Atom_isotope_number_2 _Heteronucl_NOE.Val _Heteronucl_NOE.Val_err _Heteronucl_NOE.Resonance_ID_1 _Heteronucl_NOE.Resonance_ID_2 _Heteronucl_NOE.Auth_entity_assembly_ID_1 _Heteronucl_NOE.Auth_seq_ID_1 _Heteronucl_NOE.Auth_comp_ID_1 _Heteronucl_NOE.Auth_atom_ID_1 _Heteronucl_NOE.Auth_entity_assembly_ID_2 _Heteronucl_NOE.Auth_seq_ID_2 _Heteronucl_NOE.Auth_comp_ID_2 _Heteronucl_NOE.Auth_atom_ID_2 _Heteronucl_NOE.Entry_ID _Heteronucl_NOE.Heteronucl_NOE_list_ID 1 . 1 1 2 2 TYR N N 15 . 1 1 2 2 TYR H H 1 0.133 0.189 . . . . . . . . . . 15437 2 2 . 1 1 3 3 GLY N N 15 . 1 1 3 3 GLY H H 1 0.396 0.106 . . . . . . . . . . 15437 2 3 . 1 1 4 4 LYS N N 15 . 1 1 4 4 LYS H H 1 0.518 0.130 . . . . . . . . . . 15437 2 4 . 1 1 5 5 LEU N N 15 . 1 1 5 5 LEU H H 1 0.793 0.153 . . . . . . . . . . 15437 2 5 . 1 1 6 6 ASN N N 15 . 1 1 6 6 ASN H H 1 0.780 0.110 . . . . . . . . . . 15437 2 6 . 1 1 7 7 ASP N N 15 . 1 1 7 7 ASP H H 1 0.671 0.100 . . . . . . . . . . 15437 2 7 . 1 1 8 8 LEU N N 15 . 1 1 8 8 LEU H H 1 0.811 0.091 . . . . . . . . . . 15437 2 8 . 1 1 9 9 LEU N N 15 . 1 1 9 9 LEU H H 1 0.815 0.132 . . . . . . . . . . 15437 2 9 . 1 1 10 10 GLU N N 15 . 1 1 10 10 GLU H H 1 0.714 0.157 . . . . . . . . . . 15437 2 10 . 1 1 11 11 ASP N N 15 . 1 1 11 11 ASP H H 1 0.821 0.128 . . . . . . . . . . 15437 2 11 . 1 1 12 12 LEU N N 15 . 1 1 12 12 LEU H H 1 0.725 0.145 . . . . . . . . . . 15437 2 12 . 1 1 13 13 GLN N N 15 . 1 1 13 13 GLN H H 1 0.718 0.214 . . . . . . . . . . 15437 2 13 . 1 1 14 14 GLU N N 15 . 1 1 14 14 GLU H H 1 0.808 0.148 . . . . . . . . . . 15437 2 14 . 1 1 15 15 VAL N N 15 . 1 1 15 15 VAL H H 1 0.768 0.125 . . . . . . . . . . 15437 2 15 . 1 1 16 16 LEU N N 15 . 1 1 16 16 LEU H H 1 0.878 0.177 . . . . . . . . . . 15437 2 16 . 1 1 17 17 LYS N N 15 . 1 1 17 17 LYS H H 1 0.723 0.287 . . . . . . . . . . 15437 2 17 . 1 1 18 18 HIS N N 15 . 1 1 18 18 HIS H H 1 0.808 0.223 . . . . . . . . . . 15437 2 18 . 1 1 20 20 ASN N N 15 . 1 1 20 20 ASN H H 1 0.732 0.496 . . . . . . . . . . 15437 2 19 . 1 1 21 21 GLN N N 15 . 1 1 21 21 GLN H H 1 0.782 0.140 . . . . . . . . . . 15437 2 20 . 1 1 22 22 HIS N N 15 . 1 1 22 22 HIS H H 1 0.823 0.296 . . . . . . . . . . 15437 2 21 . 1 1 23 23 TRP N N 15 . 1 1 23 23 TRP H H 1 0.649 0.165 . . . . . . . . . . 15437 2 22 . 1 1 24 24 GLN N N 15 . 1 1 24 24 GLN H H 1 0.672 0.409 . . . . . . . . . . 15437 2 23 . 1 1 26 26 GLY N N 15 . 1 1 26 26 GLY H H 1 0.479 0.159 . . . . . . . . . . 15437 2 24 . 1 1 27 27 GLN N N 15 . 1 1 27 27 GLN H H 1 0.708 0.312 . . . . . . . . . . 15437 2 25 . 1 1 28 28 LYS N N 15 . 1 1 28 28 LYS H H 1 0.618 0.122 . . . . . . . . . . 15437 2 26 . 1 1 29 29 ASN N N 15 . 1 1 29 29 ASN H H 1 0.591 0.099 . . . . . . . . . . 15437 2 27 . 1 1 30 30 MET N N 15 . 1 1 30 30 MET H H 1 0.672 0.434 . . . . . . . . . . 15437 2 28 . 1 1 31 31 ASN N N 15 . 1 1 31 31 ASN H H 1 0.741 0.239 . . . . . . . . . . 15437 2 29 . 1 1 32 32 LYS N N 15 . 1 1 32 32 LYS H H 1 0.662 0.308 . . . . . . . . . . 15437 2 30 . 1 1 33 33 VAL N N 15 . 1 1 33 33 VAL H H 1 0.629 0.185 . . . . . . . . . . 15437 2 31 . 1 1 34 34 ASP N N 15 . 1 1 34 34 ASP H H 1 0.699 0.303 . . . . . . . . . . 15437 2 32 . 1 1 35 35 HIS N N 15 . 1 1 35 35 HIS H H 1 0.848 0.667 . . . . . . . . . . 15437 2 33 . 1 1 36 36 HIS N N 15 . 1 1 36 36 HIS H H 1 0.752 0.072 . . . . . . . . . . 15437 2 34 . 1 1 37 37 LEU N N 15 . 1 1 37 37 LEU H H 1 0.839 0.194 . . . . . . . . . . 15437 2 35 . 1 1 38 38 GLN N N 15 . 1 1 38 38 GLN H H 1 0.738 0.232 . . . . . . . . . . 15437 2 36 . 1 1 39 39 ASN N N 15 . 1 1 39 39 ASN H H 1 0.826 0.143 . . . . . . . . . . 15437 2 37 . 1 1 40 40 VAL N N 15 . 1 1 40 40 VAL H H 1 0.789 0.178 . . . . . . . . . . 15437 2 38 . 1 1 41 41 ILE N N 15 . 1 1 41 41 ILE H H 1 0.801 0.183 . . . . . . . . . . 15437 2 39 . 1 1 42 42 GLU N N 15 . 1 1 42 42 GLU H H 1 0.833 0.123 . . . . . . . . . . 15437 2 40 . 1 1 43 43 ASP N N 15 . 1 1 43 43 ASP H H 1 0.824 0.111 . . . . . . . . . . 15437 2 41 . 1 1 44 44 ILE N N 15 . 1 1 44 44 ILE H H 1 0.876 0.212 . . . . . . . . . . 15437 2 42 . 1 1 45 45 HIS N N 15 . 1 1 45 45 HIS H H 1 0.814 0.149 . . . . . . . . . . 15437 2 43 . 1 1 46 46 ASP N N 15 . 1 1 46 46 ASP H H 1 0.729 0.098 . . . . . . . . . . 15437 2 44 . 1 1 47 47 PHE N N 15 . 1 1 47 47 PHE H H 1 0.697 0.162 . . . . . . . . . . 15437 2 45 . 1 1 48 48 MET N N 15 . 1 1 48 48 MET H H 1 0.759 0.214 . . . . . . . . . . 15437 2 46 . 1 1 49 49 GLN N N 15 . 1 1 49 49 GLN H H 1 0.613 0.127 . . . . . . . . . . 15437 2 47 . 1 1 50 50 GLY N N 15 . 1 1 50 50 GLY H H 1 0.449 0.108 . . . . . . . . . . 15437 2 48 . 1 1 51 51 GLY N N 15 . 1 1 51 51 GLY H H 1 0.427 0.093 . . . . . . . . . . 15437 2 49 . 1 1 52 52 GLY N N 15 . 1 1 52 52 GLY H H 1 0.576 0.087 . . . . . . . . . . 15437 2 50 . 1 1 53 53 SER N N 15 . 1 1 53 53 SER H H 1 0.508 0.258 . . . . . . . . . . 15437 2 51 . 1 1 54 54 GLY N N 15 . 1 1 54 54 GLY H H 1 0.583 0.181 . . . . . . . . . . 15437 2 52 . 1 1 55 55 GLY N N 15 . 1 1 55 55 GLY H H 1 0.661 0.136 . . . . . . . . . . 15437 2 53 . 1 1 56 56 LYS N N 15 . 1 1 56 56 LYS H H 1 0.789 0.169 . . . . . . . . . . 15437 2 54 . 1 1 57 57 LEU N N 15 . 1 1 57 57 LEU H H 1 0.843 0.120 . . . . . . . . . . 15437 2 55 . 1 1 58 58 GLN N N 15 . 1 1 58 58 GLN H H 1 0.657 0.112 . . . . . . . . . . 15437 2 56 . 1 1 59 59 GLU N N 15 . 1 1 59 59 GLU H H 1 0.849 0.136 . . . . . . . . . . 15437 2 57 . 1 1 60 60 MET N N 15 . 1 1 60 60 MET H H 1 0.838 0.165 . . . . . . . . . . 15437 2 58 . 1 1 61 61 MET N N 15 . 1 1 61 61 MET H H 1 0.788 0.194 . . . . . . . . . . 15437 2 59 . 1 1 62 62 LYS N N 15 . 1 1 62 62 LYS H H 1 0.843 0.208 . . . . . . . . . . 15437 2 60 . 1 1 63 63 GLU N N 15 . 1 1 63 63 GLU H H 1 0.728 0.206 . . . . . . . . . . 15437 2 61 . 1 1 64 64 PHE N N 15 . 1 1 64 64 PHE H H 1 0.833 0.206 . . . . . . . . . . 15437 2 62 . 1 1 65 65 GLN N N 15 . 1 1 65 65 GLN H H 1 0.861 0.166 . . . . . . . . . . 15437 2 63 . 1 1 66 66 GLN N N 15 . 1 1 66 66 GLN H H 1 0.748 0.169 . . . . . . . . . . 15437 2 64 . 1 1 67 67 VAL N N 15 . 1 1 67 67 VAL H H 1 0.766 0.090 . . . . . . . . . . 15437 2 65 . 1 1 68 68 LEU N N 15 . 1 1 68 68 LEU H H 1 0.759 0.148 . . . . . . . . . . 15437 2 66 . 1 1 69 69 ASP N N 15 . 1 1 69 69 ASP H H 1 0.818 0.155 . . . . . . . . . . 15437 2 67 . 1 1 70 70 GLU N N 15 . 1 1 70 70 GLU H H 1 0.826 0.155 . . . . . . . . . . 15437 2 68 . 1 1 71 71 ILE N N 15 . 1 1 71 71 ILE H H 1 0.652 0.289 . . . . . . . . . . 15437 2 69 . 1 1 72 72 LYS N N 15 . 1 1 72 72 LYS H H 1 0.835 0.187 . . . . . . . . . . 15437 2 70 . 1 1 73 73 GLN N N 15 . 1 1 73 73 GLN H H 1 0.790 0.160 . . . . . . . . . . 15437 2 71 . 1 1 74 74 GLN N N 15 . 1 1 74 74 GLN H H 1 0.713 0.227 . . . . . . . . . . 15437 2 72 . 1 1 75 75 LEU N N 15 . 1 1 75 75 LEU H H 1 0.827 0.668 . . . . . . . . . . 15437 2 73 . 1 1 76 76 GLN N N 15 . 1 1 76 76 GLN H H 1 0.666 0.424 . . . . . . . . . . 15437 2 74 . 1 1 77 77 GLY N N 15 . 1 1 77 77 GLY H H 1 0.531 0.306 . . . . . . . . . . 15437 2 75 . 1 1 78 78 GLY N N 15 . 1 1 78 78 GLY H H 1 0.654 0.309 . . . . . . . . . . 15437 2 76 . 1 1 79 79 ASP N N 15 . 1 1 79 79 ASP H H 1 0.689 0.177 . . . . . . . . . . 15437 2 77 . 1 1 80 80 ASN N N 15 . 1 1 80 80 ASN H H 1 0.648 0.150 . . . . . . . . . . 15437 2 78 . 1 1 81 81 SER N N 15 . 1 1 81 81 SER H H 1 0.692 0.247 . . . . . . . . . . 15437 2 79 . 1 1 82 82 LEU N N 15 . 1 1 82 82 LEU H H 1 0.727 0.071 . . . . . . . . . . 15437 2 80 . 1 1 83 83 HIS N N 15 . 1 1 83 83 HIS H H 1 0.675 0.183 . . . . . . . . . . 15437 2 81 . 1 1 84 84 ASN N N 15 . 1 1 84 84 ASN H H 1 0.753 0.185 . . . . . . . . . . 15437 2 82 . 1 1 85 85 VAL N N 15 . 1 1 85 85 VAL H H 1 0.746 0.081 . . . . . . . . . . 15437 2 83 . 1 1 86 86 HIS N N 15 . 1 1 86 86 HIS H H 1 0.763 0.128 . . . . . . . . . . 15437 2 84 . 1 1 87 87 GLU N N 15 . 1 1 87 87 GLU H H 1 0.749 0.361 . . . . . . . . . . 15437 2 85 . 1 1 88 88 ASN N N 15 . 1 1 88 88 ASN H H 1 0.760 0.208 . . . . . . . . . . 15437 2 86 . 1 1 89 89 ILE N N 15 . 1 1 89 89 ILE H H 1 0.800 0.450 . . . . . . . . . . 15437 2 87 . 1 1 90 90 LYS N N 15 . 1 1 90 90 LYS H H 1 0.731 0.140 . . . . . . . . . . 15437 2 88 . 1 1 91 91 GLU N N 15 . 1 1 91 91 GLU H H 1 0.746 0.075 . . . . . . . . . . 15437 2 89 . 1 1 92 92 ILE N N 15 . 1 1 92 92 ILE H H 1 0.804 0.199 . . . . . . . . . . 15437 2 90 . 1 1 93 93 PHE N N 15 . 1 1 93 93 PHE H H 1 0.785 0.280 . . . . . . . . . . 15437 2 91 . 1 1 94 94 HIS N N 15 . 1 1 94 94 HIS H H 1 0.823 0.178 . . . . . . . . . . 15437 2 92 . 1 1 95 95 HIS N N 15 . 1 1 95 95 HIS H H 1 0.742 0.055 . . . . . . . . . . 15437 2 93 . 1 1 96 96 LEU N N 15 . 1 1 96 96 LEU H H 1 0.810 0.202 . . . . . . . . . . 15437 2 94 . 1 1 97 97 GLU N N 15 . 1 1 97 97 GLU H H 1 0.854 0.162 . . . . . . . . . . 15437 2 95 . 1 1 98 98 GLU N N 15 . 1 1 98 98 GLU H H 1 0.696 0.234 . . . . . . . . . . 15437 2 96 . 1 1 99 99 LEU N N 15 . 1 1 99 99 LEU H H 1 0.826 0.120 . . . . . . . . . . 15437 2 97 . 1 1 100 100 VAL N N 15 . 1 1 100 100 VAL H H 1 0.720 0.325 . . . . . . . . . . 15437 2 98 . 1 1 101 101 HIS N N 15 . 1 1 101 101 HIS H H 1 0.617 0.105 . . . . . . . . . . 15437 2 99 . 1 1 102 102 ARG N N 15 . 1 1 102 102 ARG H H 1 -0.078 0.038 . . . . . . . . . . 15437 2 stop_ save_ ######################################## # Heteronuclear T1 relaxation values # ######################################## save_T1_list_1 _Heteronucl_T1_list.Sf_category heteronucl_T1_relaxation _Heteronucl_T1_list.Sf_framecode T1_list_1 _Heteronucl_T1_list.Entry_ID 15437 _Heteronucl_T1_list.ID 1 _Heteronucl_T1_list.Sample_condition_list_ID 1 _Heteronucl_T1_list.Sample_condition_list_label $sample_conditions_1 _Heteronucl_T1_list.Spectrometer_frequency_1H 500 _Heteronucl_T1_list.T1_coherence_type Nz _Heteronucl_T1_list.T1_val_units s _Heteronucl_T1_list.Details . _Heteronucl_T1_list.Text_data_format . _Heteronucl_T1_list.Text_data . loop_ _Heteronucl_T1_experiment.Experiment_ID _Heteronucl_T1_experiment.Experiment_name _Heteronucl_T1_experiment.Sample_ID _Heteronucl_T1_experiment.Sample_label _Heteronucl_T1_experiment.Sample_state _Heteronucl_T1_experiment.Entry_ID _Heteronucl_T1_experiment.Heteronucl_T1_list_ID 1 '2D 1H-15N HSQC' . . . 15437 1 stop_ loop_ _T1.ID _T1.Assembly_atom_ID _T1.Entity_assembly_ID _T1.Entity_ID _T1.Comp_index_ID _T1.Seq_ID _T1.Comp_ID _T1.Atom_ID _T1.Atom_type _T1.Atom_isotope_number _T1.Val _T1.Val_err _T1.Resonance_ID _T1.Auth_entity_assembly_ID _T1.Auth_seq_ID _T1.Auth_comp_ID _T1.Auth_atom_ID _T1.Entry_ID _T1.Heteronucl_T1_list_ID 1 . 1 1 2 2 TYR N N 15 0.3911 0.0782 . . . . . 15437 1 2 . 1 1 3 3 GLY N N 15 0.5181 0.0289 . . . . . 15437 1 3 . 1 1 4 4 LYS N N 15 0.4902 0.0245 . . . . . 15437 1 4 . 1 1 5 5 LEU N N 15 0.4742 0.0216 . . . . . 15437 1 5 . 1 1 6 6 ASN N N 15 0.4929 0.0189 . . . . . 15437 1 6 . 1 1 7 7 ASP N N 15 0.4943 0.0209 . . . . . 15437 1 7 . 1 1 8 8 LEU N N 15 0.4902 0.0290 . . . . . 15437 1 8 . 1 1 9 9 LEU N N 15 0.4871 0.0247 . . . . . 15437 1 9 . 1 1 10 10 GLU N N 15 0.4776 0.0278 . . . . . 15437 1 10 . 1 1 11 11 ASP N N 15 0.4847 0.0237 . . . . . 15437 1 11 . 1 1 12 12 LEU N N 15 0.4701 0.0269 . . . . . 15437 1 12 . 1 1 13 13 GLN N N 15 0.4742 0.0374 . . . . . 15437 1 13 . 1 1 14 14 GLU N N 15 0.4838 0.0280 . . . . . 15437 1 14 . 1 1 15 15 VAL N N 15 0.4801 0.0182 . . . . . 15437 1 15 . 1 1 16 16 LEU N N 15 0.4878 0.0277 . . . . . 15437 1 16 . 1 1 17 17 LYS N N 15 0.4695 0.0492 . . . . . 15437 1 17 . 1 1 18 18 HIS N N 15 0.4916 0.0420 . . . . . 15437 1 18 . 1 1 20 20 ASN N N 15 0.4771 0.0775 . . . . . 15437 1 19 . 1 1 21 21 GLN N N 15 0.4808 0.0284 . . . . . 15437 1 20 . 1 1 22 22 HIS N N 15 0.4721 0.0592 . . . . . 15437 1 21 . 1 1 23 23 TRP N N 15 0.5033 0.0338 . . . . . 15437 1 22 . 1 1 24 24 GLN N N 15 0.4885 0.0742 . . . . . 15437 1 23 . 1 1 26 26 GLY N N 15 0.5118 0.0359 . . . . . 15437 1 24 . 1 1 27 27 GLN N N 15 0.4866 0.0598 . . . . . 15437 1 25 . 1 1 28 28 LYS N N 15 0.5058 0.0219 . . . . . 15437 1 26 . 1 1 29 29 ASN N N 15 0.5123 0.0188 . . . . . 15437 1 27 . 1 1 30 30 MET N N 15 0.4792 0.0890 . . . . . 15437 1 28 . 1 1 31 31 ASN N N 15 0.4941 0.0398 . . . . . 15437 1 29 . 1 1 32 32 LYS N N 15 0.4892 0.0539 . . . . . 15437 1 30 . 1 1 33 33 VAL N N 15 0.4890 0.0390 . . . . . 15437 1 31 . 1 1 34 34 ASP N N 15 0.4476 0.0572 . . . . . 15437 1 32 . 1 1 35 35 HIS N N 15 0.3984 0.1121 . . . . . 15437 1 33 . 1 1 36 36 HIS N N 15 0.4739 0.0099 . . . . . 15437 1 34 . 1 1 37 37 LEU N N 15 0.4778 0.0335 . . . . . 15437 1 35 . 1 1 38 38 GLN N N 15 0.4649 0.0445 . . . . . 15437 1 36 . 1 1 39 39 ASN N N 15 0.4675 0.0280 . . . . . 15437 1 37 . 1 1 40 40 VAL N N 15 0.4746 0.0180 . . . . . 15437 1 38 . 1 1 41 41 ILE N N 15 0.4801 0.0346 . . . . . 15437 1 39 . 1 1 42 42 GLU N N 15 0.4737 0.0228 . . . . . 15437 1 40 . 1 1 43 43 ASP N N 15 0.4780 0.0217 . . . . . 15437 1 41 . 1 1 44 44 ILE N N 15 0.4766 0.0394 . . . . . 15437 1 42 . 1 1 45 45 HIS N N 15 0.4798 0.0285 . . . . . 15437 1 43 . 1 1 46 46 ASP N N 15 0.4739 0.0228 . . . . . 15437 1 44 . 1 1 47 47 PHE N N 15 0.4819 0.0376 . . . . . 15437 1 45 . 1 1 48 48 MET N N 15 0.4744 0.0413 . . . . . 15437 1 46 . 1 1 49 49 GLN N N 15 0.4995 0.0271 . . . . . 15437 1 47 . 1 1 50 50 GLY N N 15 0.5444 0.0294 . . . . . 15437 1 48 . 1 1 51 51 GLY N N 15 0.5260 0.0234 . . . . . 15437 1 49 . 1 1 52 52 GLY N N 15 0.5195 0.0170 . . . . . 15437 1 50 . 1 1 53 53 SER N N 15 0.5562 0.0600 . . . . . 15437 1 51 . 1 1 54 54 GLY N N 15 0.4900 0.0520 . . . . . 15437 1 52 . 1 1 55 55 GLY N N 15 0.4778 0.0345 . . . . . 15437 1 53 . 1 1 56 56 LYS N N 15 0.4610 0.0380 . . . . . 15437 1 54 . 1 1 57 57 LEU N N 15 0.4895 0.0194 . . . . . 15437 1 55 . 1 1 58 58 GLN N N 15 0.4878 0.0234 . . . . . 15437 1 56 . 1 1 59 59 GLU N N 15 0.4739 0.0256 . . . . . 15437 1 57 . 1 1 60 60 MET N N 15 0.4704 0.0309 . . . . . 15437 1 58 . 1 1 61 61 MET N N 15 0.4782 0.0314 . . . . . 15437 1 59 . 1 1 62 62 LYS N N 15 0.4669 0.0312 . . . . . 15437 1 60 . 1 1 63 63 GLU N N 15 0.4699 0.0341 . . . . . 15437 1 61 . 1 1 64 64 PHE N N 15 0.4764 0.0369 . . . . . 15437 1 62 . 1 1 65 65 GLN N N 15 0.4755 0.0275 . . . . . 15437 1 63 . 1 1 66 66 GLN N N 15 0.4742 0.0340 . . . . . 15437 1 64 . 1 1 67 67 VAL N N 15 0.4888 0.0158 . . . . . 15437 1 65 . 1 1 68 68 LEU N N 15 0.4739 0.0238 . . . . . 15437 1 66 . 1 1 69 69 ASP N N 15 0.4677 0.0273 . . . . . 15437 1 67 . 1 1 70 70 GLU N N 15 0.4766 0.0274 . . . . . 15437 1 68 . 1 1 71 71 ILE N N 15 0.4602 0.0579 . . . . . 15437 1 69 . 1 1 72 72 LYS N N 15 0.4762 0.0206 . . . . . 15437 1 70 . 1 1 73 73 GLN N N 15 0.4728 0.0277 . . . . . 15437 1 71 . 1 1 74 74 GLN N N 15 0.4817 0.0449 . . . . . 15437 1 72 . 1 1 75 75 LEU N N 15 0.4664 0.0506 . . . . . 15437 1 73 . 1 1 76 76 GLN N N 15 0.4562 0.0888 . . . . . 15437 1 74 . 1 1 77 77 GLY N N 15 0.5043 0.0594 . . . . . 15437 1 75 . 1 1 78 78 GLY N N 15 0.5294 0.0712 . . . . . 15437 1 76 . 1 1 79 79 ASP N N 15 0.4958 0.0404 . . . . . 15437 1 77 . 1 1 80 80 ASN N N 15 0.5061 0.0353 . . . . . 15437 1 78 . 1 1 81 81 SER N N 15 0.4301 0.0486 . . . . . 15437 1 79 . 1 1 82 82 LEU N N 15 0.4808 0.0126 . . . . . 15437 1 80 . 1 1 83 83 HIS N N 15 0.4608 0.0419 . . . . . 15437 1 81 . 1 1 84 84 ASN N N 15 0.4203 0.0403 . . . . . 15437 1 82 . 1 1 85 85 VAL N N 15 0.4888 0.0135 . . . . . 15437 1 83 . 1 1 86 86 HIS N N 15 0.4679 0.0296 . . . . . 15437 1 84 . 1 1 87 87 GLU N N 15 0.4562 0.0835 . . . . . 15437 1 85 . 1 1 88 88 ASN N N 15 0.4864 0.0461 . . . . . 15437 1 86 . 1 1 89 89 ILE N N 15 0.4484 0.0927 . . . . . 15437 1 87 . 1 1 90 90 LYS N N 15 0.4613 0.0209 . . . . . 15437 1 88 . 1 1 91 91 GLU N N 15 0.485 0.0135 . . . . . 15437 1 89 . 1 1 92 92 ILE N N 15 0.481 0.0347 . . . . . 15437 1 90 . 1 1 93 93 PHE N N 15 0.4664 0.0560 . . . . . 15437 1 91 . 1 1 94 94 HIS N N 15 0.4606 0.0322 . . . . . 15437 1 92 . 1 1 95 95 HIS N N 15 0.4636 0.0137 . . . . . 15437 1 93 . 1 1 96 96 LEU N N 15 0.4819 0.0425 . . . . . 15437 1 94 . 1 1 97 97 GLU N N 15 0.4805 0.0111 . . . . . 15437 1 95 . 1 1 98 98 GLU N N 15 0.4864 0.0397 . . . . . 15437 1 96 . 1 1 99 99 LEU N N 15 0.5043 0.0220 . . . . . 15437 1 97 . 1 1 100 100 VAL N N 15 0.4900 0.0598 . . . . . 15437 1 98 . 1 1 101 101 HIS N N 15 0.4929 0.0231 . . . . . 15437 1 99 . 1 1 102 102 ARG N N 15 0.6246 0.0164 . . . . . 15437 1 stop_ save_ save_T1_list_2 _Heteronucl_T1_list.Sf_category heteronucl_T1_relaxation _Heteronucl_T1_list.Sf_framecode T1_list_2 _Heteronucl_T1_list.Entry_ID 15437 _Heteronucl_T1_list.ID 2 _Heteronucl_T1_list.Sample_condition_list_ID 1 _Heteronucl_T1_list.Sample_condition_list_label $sample_conditions_1 _Heteronucl_T1_list.Spectrometer_frequency_1H 600 _Heteronucl_T1_list.T1_coherence_type Nz _Heteronucl_T1_list.T1_val_units s _Heteronucl_T1_list.Details . _Heteronucl_T1_list.Text_data_format . _Heteronucl_T1_list.Text_data . loop_ _Heteronucl_T1_experiment.Experiment_ID _Heteronucl_T1_experiment.Experiment_name _Heteronucl_T1_experiment.Sample_ID _Heteronucl_T1_experiment.Sample_label _Heteronucl_T1_experiment.Sample_state _Heteronucl_T1_experiment.Entry_ID _Heteronucl_T1_experiment.Heteronucl_T1_list_ID 1 '2D 1H-15N HSQC' . . . 15437 2 stop_ loop_ _T1.ID _T1.Assembly_atom_ID _T1.Entity_assembly_ID _T1.Entity_ID _T1.Comp_index_ID _T1.Seq_ID _T1.Comp_ID _T1.Atom_ID _T1.Atom_type _T1.Atom_isotope_number _T1.Val _T1.Val_err _T1.Resonance_ID _T1.Auth_entity_assembly_ID _T1.Auth_seq_ID _T1.Auth_comp_ID _T1.Auth_atom_ID _T1.Entry_ID _T1.Heteronucl_T1_list_ID 1 . 1 1 2 2 TYR N N 15 0.4840 0.0660 . . . . . 15437 2 2 . 1 1 3 3 GLY N N 15 0.5754 0.0314 . . . . . 15437 2 3 . 1 1 4 4 LYS N N 15 0.5903 0.0394 . . . . . 15437 2 4 . 1 1 5 5 LEU N N 15 0.6010 0.0380 . . . . . 15437 2 5 . 1 1 6 6 ASN N N 15 0.6297 0.0312 . . . . . 15437 2 6 . 1 1 7 7 ASP N N 15 0.6274 0.0284 . . . . . 15437 2 7 . 1 1 8 8 LEU N N 15 0.6046 0.0275 . . . . . 15437 2 8 . 1 1 9 9 LEU N N 15 0.6135 0.0375 . . . . . 15437 2 9 . 1 1 10 10 GLU N N 15 0.6068 0.0464 . . . . . 15437 2 10 . 1 1 11 11 ASP N N 15 0.6146 0.0446 . . . . . 15437 2 11 . 1 1 12 12 LEU N N 15 0.6146 0.0415 . . . . . 15437 2 12 . 1 1 13 13 GLN N N 15 0.6112 0.0631 . . . . . 15437 2 13 . 1 1 14 14 GLU N N 15 0.6083 0.0415 . . . . . 15437 2 14 . 1 1 15 15 VAL N N 15 0.6098 0.0309 . . . . . 15437 2 15 . 1 1 16 16 LEU N N 15 0.6072 0.0564 . . . . . 15437 2 16 . 1 1 17 17 LYS N N 15 0.6112 0.0866 . . . . . 15437 2 17 . 1 1 18 18 HIS N N 15 0.6035 0.0663 . . . . . 15437 2 18 . 1 1 20 20 ASN N N 15 0.5928 0.1496 . . . . . 15437 2 19 . 1 1 21 21 GLN N N 15 0.6028 0.0411 . . . . . 15437 2 20 . 1 1 22 22 HIS N N 15 0.5900 0.0940 . . . . . 15437 2 21 . 1 1 23 23 TRP N N 15 0.6031 0.0500 . . . . . 15437 2 22 . 1 1 24 24 GLN N N 15 0.5984 0.1374 . . . . . 15437 2 23 . 1 1 26 26 GLY N N 15 0.5928 0.0608 . . . . . 15437 2 24 . 1 1 27 27 GLN N N 15 0.6127 0.1129 . . . . . 15437 2 25 . 1 1 28 28 LYS N N 15 0.6002 0.0323 . . . . . 15437 2 26 . 1 1 29 29 ASN N N 15 0.6112 0.0265 . . . . . 15437 2 27 . 1 1 30 30 MET N N 15 0.5875 0.1689 . . . . . 15437 2 28 . 1 1 31 31 ASN N N 15 0.6024 0.0687 . . . . . 15437 2 29 . 1 1 32 32 LYS N N 15 0.6143 0.1052 . . . . . 15437 2 30 . 1 1 33 33 VAL N N 15 0.6161 0.0646 . . . . . 15437 2 31 . 1 1 34 34 ASP N N 15 0.5831 0.0976 . . . . . 15437 2 32 . 1 1 35 35 HIS N N 15 0.5695 0.2563 . . . . . 15437 2 33 . 1 1 36 36 HIS N N 15 0.5956 0.0194 . . . . . 15437 2 34 . 1 1 37 37 LEU N N 15 0.5949 0.0466 . . . . . 15437 2 35 . 1 1 38 38 GLN N N 15 0.5974 0.0756 . . . . . 15437 2 36 . 1 1 39 39 ASN N N 15 0.5959 0.0394 . . . . . 15437 2 37 . 1 1 40 40 VAL N N 15 0.6262 0.0504 . . . . . 15437 2 38 . 1 1 41 41 ILE N N 15 0.6013 0.0553 . . . . . 15437 2 39 . 1 1 42 42 GLU N N 15 0.5935 0.0386 . . . . . 15437 2 40 . 1 1 43 43 ASP N N 15 0.6098 0.0309 . . . . . 15437 2 41 . 1 1 44 44 ILE N N 15 0.6068 0.0568 . . . . . 15437 2 42 . 1 1 45 45 HIS N N 15 0.6072 0.0439 . . . . . 15437 2 43 . 1 1 46 46 ASP N N 15 0.5967 0.0303 . . . . . 15437 2 44 . 1 1 47 47 PHE N N 15 0.6112 0.0550 . . . . . 15437 2 45 . 1 1 48 48 MET N N 15 0.6101 0.0655 . . . . . 15437 2 46 . 1 1 49 49 GLN N N 15 0.6285 0.0386 . . . . . 15437 2 47 . 1 1 50 50 GLY N N 15 0.6601 0.0442 . . . . . 15437 2 48 . 1 1 51 51 GLY N N 15 0.6154 0.0357 . . . . . 15437 2 49 . 1 1 52 52 GLY N N 15 0.5967 0.0272 . . . . . 15437 2 50 . 1 1 53 53 SER N N 15 0.6337 0.0904 . . . . . 15437 2 51 . 1 1 54 54 GLY N N 15 0.5754 0.0628 . . . . . 15437 2 52 . 1 1 55 55 GLY N N 15 0.5637 0.0435 . . . . . 15437 2 53 . 1 1 56 56 LYS N N 15 0.5764 0.0490 . . . . . 15437 2 54 . 1 1 57 57 LEU N N 15 0.6090 0.0341 . . . . . 15437 2 55 . 1 1 58 58 GLN N N 15 0.6158 0.0370 . . . . . 15437 2 56 . 1 1 59 59 GLU N N 15 0.6083 0.0369 . . . . . 15437 2 57 . 1 1 60 60 MET N N 15 0.6010 0.0531 . . . . . 15437 2 58 . 1 1 61 61 MET N N 15 0.5900 0.0556 . . . . . 15437 2 59 . 1 1 62 62 LYS N N 15 0.6002 0.0542 . . . . . 15437 2 60 . 1 1 63 63 GLU N N 15 0.6064 0.0683 . . . . . 15437 2 61 . 1 1 64 64 PHE N N 15 0.6039 0.0571 . . . . . 15437 2 62 . 1 1 65 65 GLN N N 15 0.5984 0.0438 . . . . . 15437 2 63 . 1 1 66 66 GLN N N 15 0.6002 0.0500 . . . . . 15437 2 64 . 1 1 67 67 VAL N N 15 0.6090 0.0203 . . . . . 15437 2 65 . 1 1 68 68 LEU N N 15 0.5992 0.0398 . . . . . 15437 2 66 . 1 1 69 69 ASP N N 15 0.5952 0.0421 . . . . . 15437 2 67 . 1 1 70 70 GLU N N 15 0.6031 0.0437 . . . . . 15437 2 68 . 1 1 71 71 ILE N N 15 0.6105 0.1063 . . . . . 15437 2 69 . 1 1 72 72 LYS N N 15 0.5984 0.0459 . . . . . 15437 2 70 . 1 1 73 73 GLN N N 15 0.5963 0.0431 . . . . . 15437 2 71 . 1 1 74 74 GLN N N 15 0.6154 0.0705 . . . . . 15437 2 72 . 1 1 75 75 LEU N N 15 0.6050 0.1625 . . . . . 15437 2 73 . 1 1 76 76 GLN N N 15 0.5942 0.1692 . . . . . 15437 2 74 . 1 1 77 77 GLY N N 15 0.6223 0.1446 . . . . . 15437 2 75 . 1 1 78 78 GLY N N 15 0.6266 0.1208 . . . . . 15437 2 76 . 1 1 79 79 ASP N N 15 0.5942 0.0620 . . . . . 15437 2 77 . 1 1 80 80 ASN N N 15 0.6127 0.0513 . . . . . 15437 2 78 . 1 1 81 81 SER N N 15 0.5271 0.0684 . . . . . 15437 2 79 . 1 1 82 82 LEU N N 15 0.6002 0.0197 . . . . . 15437 2 80 . 1 1 83 83 HIS N N 15 0.5705 0.0657 . . . . . 15437 2 81 . 1 1 84 84 ASN N N 15 0.5330 0.0528 . . . . . 15437 2 82 . 1 1 85 85 VAL N N 15 0.6006 0.0244 . . . . . 15437 2 83 . 1 1 86 86 HIS N N 15 0.5744 0.0376 . . . . . 15437 2 84 . 1 1 87 87 GLU N N 15 0.5928 0.1398 . . . . . 15437 2 85 . 1 1 88 88 ASN N N 15 0.6024 0.0746 . . . . . 15437 2 86 . 1 1 89 89 ILE N N 15 0.6075 0.1478 . . . . . 15437 2 87 . 1 1 90 90 LYS N N 15 0.5869 0.0316 . . . . . 15437 2 88 . 1 1 91 91 GLU N N 15 0.6053 0.0189 . . . . . 15437 2 89 . 1 1 92 92 ILE N N 15 0.6086 0.0567 . . . . . 15437 2 90 . 1 1 93 93 PHE N N 15 0.5910 0.0920 . . . . . 15437 2 91 . 1 1 94 94 HIS N N 15 0.5875 0.0564 . . . . . 15437 2 92 . 1 1 95 95 HIS N N 15 0.5952 0.0160 . . . . . 15437 2 93 . 1 1 96 96 LEU N N 15 0.6039 0.0641 . . . . . 15437 2 94 . 1 1 97 97 GLU N N 15 0.5828 0.0342 . . . . . 15437 2 95 . 1 1 98 98 GLU N N 15 0.6002 0.0664 . . . . . 15437 2 96 . 1 1 99 99 LEU N N 15 0.6254 0.0321 . . . . . 15437 2 97 . 1 1 100 100 VAL N N 15 0.6131 0.1017 . . . . . 15437 2 98 . 1 1 101 101 HIS N N 15 0.5865 0.0331 . . . . . 15437 2 99 . 1 1 102 102 ARG N N 15 0.6940 0.0198 . . . . . 15437 2 stop_ save_ ######################################## # Heteronuclear T2 relaxation values # ######################################## save_T2_list_1 _Heteronucl_T2_list.Sf_category heteronucl_T2_relaxation _Heteronucl_T2_list.Sf_framecode T2_list_1 _Heteronucl_T2_list.Entry_ID 15437 _Heteronucl_T2_list.ID 1 _Heteronucl_T2_list.Sample_condition_list_ID 1 _Heteronucl_T2_list.Sample_condition_list_label $sample_conditions_1 _Heteronucl_T2_list.Temp_calibration_method . _Heteronucl_T2_list.Temp_control_method . _Heteronucl_T2_list.Spectrometer_frequency_1H 500 _Heteronucl_T2_list.T2_coherence_type Nz _Heteronucl_T2_list.T2_val_units s _Heteronucl_T2_list.Rex_units . _Heteronucl_T2_list.Details . _Heteronucl_T2_list.Text_data_format . _Heteronucl_T2_list.Text_data . loop_ _Heteronucl_T2_experiment.Experiment_ID _Heteronucl_T2_experiment.Experiment_name _Heteronucl_T2_experiment.Sample_ID _Heteronucl_T2_experiment.Sample_label _Heteronucl_T2_experiment.Sample_state _Heteronucl_T2_experiment.Entry_ID _Heteronucl_T2_experiment.Heteronucl_T2_list_ID 1 '2D 1H-15N HSQC' . . . 15437 1 stop_ loop_ _T2.ID _T2.Assembly_atom_ID _T2.Entity_assembly_ID _T2.Entity_ID _T2.Comp_index_ID _T2.Seq_ID _T2.Comp_ID _T2.Atom_ID _T2.Atom_type _T2.Atom_isotope_number _T2.T2_val _T2.T2_val_err _T2.Rex_val _T2.Rex_err _T2.Resonance_ID _T2.Auth_entity_assembly_ID _T2.Auth_seq_ID _T2.Auth_comp_ID _T2.Auth_atom_ID _T2.Entry_ID _T2.Heteronucl_T2_list_ID 1 . 1 1 2 2 TYR N N 15 0.1359 0.0421 . . . . . . . 15437 1 2 . 1 1 3 3 GLY N N 15 0.1444 0.0132 . . . . . . . 15437 1 3 . 1 1 4 4 LYS N N 15 0.1216 0.0094 . . . . . . . 15437 1 4 . 1 1 5 5 LEU N N 15 0.1021 0.0072 . . . . . . . 15437 1 5 . 1 1 6 6 ASN N N 15 0.113 0.0069 . . . . . . . 15437 1 6 . 1 1 7 7 ASP N N 15 0.1091 0.0073 0.598 0.373 . . . . . 15437 1 7 . 1 1 8 8 LEU N N 15 0.1038 0.0098 . . . . . . . 15437 1 8 . 1 1 9 9 LEU N N 15 0.0948 0.0075 1.028 0.551 . . . . . 15437 1 9 . 1 1 10 10 GLU N N 15 0.0915 0.0083 1.425 0.667 . . . . . 15437 1 10 . 1 1 11 11 ASP N N 15 0.1009 0.0078 0.752 0.536 . . . . . 15437 1 11 . 1 1 12 12 LEU N N 15 0.0931 0.0078 . . . . . . . 15437 1 12 . 1 1 13 13 GLN N N 15 0.0972 0.0120 . . . . . . . 15437 1 13 . 1 1 14 14 GLU N N 15 0.0870 0.0079 2.571 0.646 . . . . . 15437 1 14 . 1 1 15 15 VAL N N 15 0.0947 0.0056 1.494 0.481 . . . . . 15437 1 15 . 1 1 16 16 LEU N N 15 0.0910 0.0088 . . . . . . . 15437 1 16 . 1 1 17 17 LYS N N 15 0.0831 0.0143 . . . . . . . 15437 1 17 . 1 1 18 18 HIS N N 15 0.1002 0.0137 . . . . . . . 15437 1 18 . 1 1 20 20 ASN N N 15 0.0743 0.0208 . . . . . . . 15437 1 19 . 1 1 21 21 GLN N N 15 0.1002 0.0095 1.781 0.618 . . . . . 15437 1 20 . 1 1 22 22 HIS N N 15 0.0861 0.0191 . . . . . . . 15437 1 21 . 1 1 23 23 TRP N N 15 0.0976 0.0104 2.413 0.708 . . . . . 15437 1 22 . 1 1 24 24 GLN N N 15 0.0423 0.0137 13.1 2.553 . . . . . 15437 1 23 . 1 1 26 26 GLY N N 15 0.1836 0.0219 . . . . . . . 15437 1 24 . 1 1 27 27 GLN N N 15 0.0763 0.0155 . . . . . . . 15437 1 25 . 1 1 28 28 LYS N N 15 0.1284 0.0088 . . . . . . . 15437 1 26 . 1 1 29 29 ASN N N 15 0.1414 0.0083 . . . . . . . 15437 1 27 . 1 1 30 30 MET N N 15 0.0825 0.0258 . . . . . . . 15437 1 28 . 1 1 31 31 ASN N N 15 0.0834 0.0109 . . . . . . . 15437 1 29 . 1 1 32 32 LYS N N 15 0.1233 0.0233 . . . . . . . 15437 1 30 . 1 1 33 33 VAL N N 15 0.1151 0.0150 . . . . . . . 15437 1 31 . 1 1 34 34 ASP N N 15 0.0480 0.0115 10.72 2.593 . . . . . 15437 1 32 . 1 1 35 35 HIS N N 15 0.0692 0.0415 . . . . . . . 15437 1 33 . 1 1 36 36 HIS N N 15 0.1021 0.0035 . . . . . . . 15437 1 34 . 1 1 37 37 LEU N N 15 0.0920 0.0109 . . . . . . . 15437 1 35 . 1 1 38 38 GLN N N 15 0.0970 0.0147 . . . . . . . 15437 1 36 . 1 1 39 39 ASN N N 15 0.0947 0.0088 . . . . . . . 15437 1 37 . 1 1 40 40 VAL N N 15 0.1031 0.0057 . . . . . . . 15437 1 38 . 1 1 41 41 ILE N N 15 0.0981 0.0098 . . . . . . . 15437 1 39 . 1 1 42 42 GLU N N 15 0.1008 0.0076 . . . . . . . 15437 1 40 . 1 1 43 43 ASP N N 15 0.0979 0.0066 . . . . . . . 15437 1 41 . 1 1 44 44 ILE N N 15 0.0966 0.0125 . . . . . . . 15437 1 42 . 1 1 45 45 HIS N N 15 0.1022 0.0092 . . . . . . . 15437 1 43 . 1 1 46 46 ASP N N 15 0.1099 0.0083 . . . . . . . 15437 1 44 . 1 1 47 47 PHE N N 15 0.0999 0.0132 . . . . . . . 15437 1 45 . 1 1 48 48 MET N N 15 0.0993 0.0145 . . . . . . . 15437 1 46 . 1 1 49 49 GLN N N 15 0.1178 0.0109 . . . . . . . 15437 1 47 . 1 1 50 50 GLY N N 15 0.1503 0.0134 . . . . . . . 15437 1 48 . 1 1 51 51 GLY N N 15 0.1691 0.0129 . . . . . . . 15437 1 49 . 1 1 52 52 GLY N N 15 0.1958 0.0121 . . . . . . . 15437 1 50 . 1 1 53 53 SER N N 15 0.1662 0.0325 . . . . . . . 15437 1 51 . 1 1 54 54 GLY N N 15 0.1507 0.0280 . . . . . . . 15437 1 52 . 1 1 55 55 GLY N N 15 0.1394 0.0165 . . . . . . . 15437 1 53 . 1 1 56 56 LYS N N 15 0.1153 0.0170 . . . . . . . 15437 1 54 . 1 1 57 57 LEU N N 15 0.1043 0.0066 . . . . . . . 15437 1 55 . 1 1 58 58 GLN N N 15 0.1115 0.0084 . . . . . . . 15437 1 56 . 1 1 59 59 GLU N N 15 0.1118 0.0096 . . . . . . . 15437 1 57 . 1 1 60 60 MET N N 15 0.0996 0.0105 . . . . . . . 15437 1 58 . 1 1 61 61 MET N N 15 0.0998 0.0103 . . . . . . . 15437 1 59 . 1 1 62 62 LYS N N 15 0.0961 0.0105 . . . . . . . 15437 1 60 . 1 1 63 63 GLU N N 15 0.0997 0.0111 . . . . . . . 15437 1 61 . 1 1 64 64 PHE N N 15 0.0919 0.0107 1.812 0.821 . . . . . 15437 1 62 . 1 1 65 65 GLN N N 15 0.0978 0.0090 1.773 0.651 . . . . . 15437 1 63 . 1 1 66 66 GLN N N 15 0.1072 0.0121 . . . . . . . 15437 1 64 . 1 1 67 67 VAL N N 15 0.1048 0.0052 0.303 0.281 . . . . . 15437 1 65 . 1 1 68 68 LEU N N 15 0.0928 0.0068 0.89 0.509 . . . . . 15437 1 66 . 1 1 69 69 ASP N N 15 0.1031 0.0094 . . . . . . . 15437 1 67 . 1 1 70 70 GLU N N 15 0.1005 0.0095 . . . . . . . 15437 1 68 . 1 1 71 71 ILE N N 15 0.0513 0.0113 9.898 2.554 . . . . . 15437 1 69 . 1 1 72 72 LYS N N 15 0.1019 0.0068 0.504 0.481 . . . . . 15437 1 70 . 1 1 73 73 GLN N N 15 0.1054 0.0093 0.917 0.582 . . . . . 15437 1 71 . 1 1 74 74 GLN N N 15 0.0834 0.0132 3.187 1.114 . . . . . 15437 1 72 . 1 1 75 75 LEU N N 15 0.0808 0.0178 2.849 1.707 . . . . . 15437 1 73 . 1 1 76 76 GLN N N 15 0.0801 0.0283 4.661 2.268 . . . . . 15437 1 74 . 1 1 77 77 GLY N N 15 0.0659 0.0137 6.804 2.271 . . . . . 15437 1 75 . 1 1 78 78 GLY N N 15 0.1128 0.0249 1.793 1.126 . . . . . 15437 1 76 . 1 1 79 79 ASP N N 15 0.1367 0.0178 . . . . . . . 15437 1 77 . 1 1 80 80 ASN N N 15 0.0927 0.0104 1.669 0.765 . . . . . 15437 1 78 . 1 1 81 81 SER N N 15 0.0928 0.0165 . . . . . . . 15437 1 79 . 1 1 82 82 LEU N N 15 0.1003 0.0039 0.851 0.346 . . . . . 15437 1 80 . 1 1 83 83 HIS N N 15 0.0967 0.0141 . . . . . . . 15437 1 81 . 1 1 84 84 ASN N N 15 0.1099 0.0162 . . . . . . . 15437 1 82 . 1 1 85 85 VAL N N 15 0.099 0.0043 0.839 0.394 . . . . . 15437 1 83 . 1 1 86 86 HIS N N 15 0.0904 0.0090 1.977 0.636 . . . . . 15437 1 84 . 1 1 87 87 GLU N N 15 0.0668 0.0230 6.211 2.324 . . . . . 15437 1 85 . 1 1 88 88 ASN N N 15 0.0966 0.0149 . . . . . . . 15437 1 86 . 1 1 89 89 ILE N N 15 0.0649 0.0254 . . . . . . . 15437 1 87 . 1 1 90 90 LYS N N 15 0.0951 0.0068 0.878 0.475 . . . . . 15437 1 88 . 1 1 91 91 GLU N N 15 0.106 0.0046 1.254 0.299 . . . . . 15437 1 89 . 1 1 92 92 ILE N N 15 0.1024 0.0117 . . . . . . . 15437 1 90 . 1 1 93 93 PHE N N 15 0.0929 0.0177 . . . . . . . 15437 1 91 . 1 1 94 94 HIS N N 15 0.0940 0.0106 . . . . . . . 15437 1 92 . 1 1 95 95 HIS N N 15 0.0995 0.0041 1.341 0.302 . . . . . 15437 1 93 . 1 1 96 96 LEU N N 15 0.0854 0.0139 . . . . . . . 15437 1 94 . 1 1 97 97 GLU N N 15 0.1053 0.0041 . . . . . . . 15437 1 95 . 1 1 98 98 GLU N N 15 0.1085 0.0147 . . . . . . . 15437 1 96 . 1 1 99 99 LEU N N 15 0.1138 0.0079 0.543 0.381 . . . . . 15437 1 97 . 1 1 100 100 VAL N N 15 0.0527 0.0128 7.947 2.25 . . . . . 15437 1 98 . 1 1 101 101 HIS N N 15 0.1401 0.0104 . . . . . . . 15437 1 99 . 1 1 102 102 ARG N N 15 0.3099 0.0194 . . . . . . . 15437 1 stop_ save_ save_T2_list_2 _Heteronucl_T2_list.Sf_category heteronucl_T2_relaxation _Heteronucl_T2_list.Sf_framecode T2_list_2 _Heteronucl_T2_list.Entry_ID 15437 _Heteronucl_T2_list.ID 2 _Heteronucl_T2_list.Sample_condition_list_ID 1 _Heteronucl_T2_list.Sample_condition_list_label $sample_conditions_1 _Heteronucl_T2_list.Temp_calibration_method . _Heteronucl_T2_list.Temp_control_method . _Heteronucl_T2_list.Spectrometer_frequency_1H 600 _Heteronucl_T2_list.T2_coherence_type Nz _Heteronucl_T2_list.T2_val_units s _Heteronucl_T2_list.Rex_units . _Heteronucl_T2_list.Details . _Heteronucl_T2_list.Text_data_format . _Heteronucl_T2_list.Text_data . loop_ _Heteronucl_T2_experiment.Experiment_ID _Heteronucl_T2_experiment.Experiment_name _Heteronucl_T2_experiment.Sample_ID _Heteronucl_T2_experiment.Sample_label _Heteronucl_T2_experiment.Sample_state _Heteronucl_T2_experiment.Entry_ID _Heteronucl_T2_experiment.Heteronucl_T2_list_ID 1 '2D 1H-15N HSQC' . . . 15437 2 stop_ loop_ _T2.ID _T2.Assembly_atom_ID _T2.Entity_assembly_ID _T2.Entity_ID _T2.Comp_index_ID _T2.Seq_ID _T2.Comp_ID _T2.Atom_ID _T2.Atom_type _T2.Atom_isotope_number _T2.T2_val _T2.T2_val_err _T2.Rex_val _T2.Rex_err _T2.Resonance_ID _T2.Auth_entity_assembly_ID _T2.Auth_seq_ID _T2.Auth_comp_ID _T2.Auth_atom_ID _T2.Entry_ID _T2.Heteronucl_T2_list_ID 1 . 1 1 2 2 TYR N N 15 0.1282 0.0159 . . . . . . . 15437 2 2 . 1 1 3 3 GLY N N 15 0.1188 0.0052 . . . . . . . 15437 2 3 . 1 1 4 4 LYS N N 15 0.0932 0.0048 . . . . . . . 15437 2 4 . 1 1 5 5 LEU N N 15 0.0870 0.0045 . . . . . . . 15437 2 5 . 1 1 6 6 ASN N N 15 0.0968 0.0038 . . . . . . . 15437 2 6 . 1 1 7 7 ASP N N 15 0.0886 0.0032 . . . . . . . 15437 2 7 . 1 1 8 8 LEU N N 15 0.0890 0.0030 . . . . . . . 15437 2 8 . 1 1 9 9 LEU N N 15 0.0789 0.0037 . . . . . . . 15437 2 9 . 1 1 10 10 GLU N N 15 0.0752 0.0044 . . . . . . . 15437 2 10 . 1 1 11 11 ASP N N 15 0.0831 0.0044 . . . . . . . 15437 2 11 . 1 1 12 12 LEU N N 15 0.0820 0.0046 . . . . . . . 15437 2 12 . 1 1 13 13 GLN N N 15 0.0806 0.0059 . . . . . . . 15437 2 13 . 1 1 14 14 GLU N N 15 0.0695 0.0037 . . . . . . . 15437 2 14 . 1 1 15 15 VAL N N 15 0.0781 0.0033 . . . . . . . 15437 2 15 . 1 1 16 16 LEU N N 15 0.0763 0.0059 . . . . . . . 15437 2 16 . 1 1 17 17 LYS N N 15 0.0645 0.0070 . . . . . . . 15437 2 17 . 1 1 18 18 HIS N N 15 0.0828 0.0072 . . . . . . . 15437 2 18 . 1 1 20 20 ASN N N 15 0.0618 0.0120 . . . . . . . 15437 2 19 . 1 1 21 21 GLN N N 15 0.0799 0.0040 . . . . . . . 15437 2 20 . 1 1 22 22 HIS N N 15 0.0652 0.0084 . . . . . . . 15437 2 21 . 1 1 23 23 TRP N N 15 0.0842 0.0056 . . . . . . . 15437 2 22 . 1 1 24 24 GLN N N 15 0.0348 0.0084 . . . . . . . 15437 2 23 . 1 1 26 26 GLY N N 15 0.1376 0.0108 . . . . . . . 15437 2 24 . 1 1 27 27 GLN N N 15 0.0671 0.0091 . . . . . . . 15437 2 25 . 1 1 28 28 LYS N N 15 0.1033 0.0046 . . . . . . . 15437 2 26 . 1 1 29 29 ASN N N 15 0.1123 0.0038 . . . . . . . 15437 2 27 . 1 1 30 30 MET N N 15 0.0697 0.0147 . . . . . . . 15437 2 28 . 1 1 31 31 ASN N N 15 0.0635 0.0058 . . . . . . . 15437 2 29 . 1 1 32 32 LYS N N 15 0.1013 0.0136 . . . . . . . 15437 2 30 . 1 1 33 33 VAL N N 15 0.0994 0.0081 . . . . . . . 15437 2 31 . 1 1 34 34 ASP N N 15 0.0381 0.0065 . . . . . . . 15437 2 32 . 1 1 35 35 HIS N N 15 0.0543 0.0207 . . . . . . . 15437 2 33 . 1 1 36 36 HIS N N 15 0.0851 0.0021 . . . . . . . 15437 2 34 . 1 1 37 37 LEU N N 15 0.0746 0.0049 . . . . . . . 15437 2 35 . 1 1 38 38 GLN N N 15 0.0840 0.0077 . . . . . . . 15437 2 36 . 1 1 39 39 ASN N N 15 0.0786 0.0040 . . . . . . . 15437 2 37 . 1 1 40 40 VAL N N 15 0.0908 0.0059 . . . . . . . 15437 2 38 . 1 1 41 41 ILE N N 15 0.0858 0.0060 . . . . . . . 15437 2 39 . 1 1 42 42 GLU N N 15 0.0835 0.0045 . . . . . . . 15437 2 40 . 1 1 43 43 ASP N N 15 0.0834 0.0032 . . . . . . . 15437 2 41 . 1 1 44 44 ILE N N 15 0.0924 0.0074 . . . . . . . 15437 2 42 . 1 1 45 45 HIS N N 15 0.0870 0.0046 . . . . . . . 15437 2 43 . 1 1 46 46 ASP N N 15 0.0908 0.0037 . . . . . . . 15437 2 44 . 1 1 47 47 PHE N N 15 0.0969 0.0072 . . . . . . . 15437 2 45 . 1 1 48 48 MET N N 15 0.0789 0.0064 . . . . . . . 15437 2 46 . 1 1 49 49 GLN N N 15 0.0966 0.0046 . . . . . . . 15437 2 47 . 1 1 50 50 GLY N N 15 0.1217 0.0064 . . . . . . . 15437 2 48 . 1 1 51 51 GLY N N 15 0.1294 0.0060 . . . . . . . 15437 2 49 . 1 1 52 52 GLY N N 15 0.1449 0.0057 . . . . . . . 15437 2 50 . 1 1 53 53 SER N N 15 0.1485 0.0183 . . . . . . . 15437 2 51 . 1 1 54 54 GLY N N 15 0.1403 0.0128 . . . . . . . 15437 2 52 . 1 1 55 55 GLY N N 15 0.1234 0.0079 . . . . . . . 15437 2 53 . 1 1 56 56 LYS N N 15 0.1053 0.0077 . . . . . . . 15437 2 54 . 1 1 57 57 LEU N N 15 0.0917 0.0043 . . . . . . . 15437 2 55 . 1 1 58 58 GLN N N 15 0.0933 0.0043 . . . . . . . 15437 2 56 . 1 1 59 59 GLU N N 15 0.0956 0.0046 . . . . . . . 15437 2 57 . 1 1 60 60 MET N N 15 0.0851 0.0060 . . . . . . . 15437 2 58 . 1 1 61 61 MET N N 15 0.0811 0.0055 . . . . . . . 15437 2 59 . 1 1 62 62 LYS N N 15 0.0853 0.0063 . . . . . . . 15437 2 60 . 1 1 63 63 GLU N N 15 0.0861 0.0071 . . . . . . . 15437 2 61 . 1 1 64 64 PHE N N 15 0.0757 0.0056 . . . . . . . 15437 2 62 . 1 1 65 65 GLN N N 15 0.0799 0.0044 . . . . . . . 15437 2 63 . 1 1 66 66 GLN N N 15 0.0879 0.0055 . . . . . . . 15437 2 64 . 1 1 67 67 VAL N N 15 0.0850 0.0023 . . . . . . . 15437 2 65 . 1 1 68 68 LEU N N 15 0.0792 0.0037 . . . . . . . 15437 2 66 . 1 1 69 69 ASP N N 15 0.0858 0.0046 . . . . . . . 15437 2 67 . 1 1 70 70 GLU N N 15 0.0853 0.0051 . . . . . . . 15437 2 68 . 1 1 71 71 ILE N N 15 0.039 0.0066 . . . . . . . 15437 2 69 . 1 1 72 72 LYS N N 15 0.0854 0.0054 . . . . . . . 15437 2 70 . 1 1 73 73 GLN N N 15 0.088 0.0050 . . . . . . . 15437 2 71 . 1 1 74 74 GLN N N 15 0.0653 0.0058 . . . . . . . 15437 2 72 . 1 1 75 75 LEU N N 15 0.0691 0.0146 . . . . . . . 15437 2 73 . 1 1 76 76 GLN N N 15 0.0600 0.0132 . . . . . . . 15437 2 74 . 1 1 77 77 GLY N N 15 0.0449 0.0090 . . . . . . . 15437 2 75 . 1 1 78 78 GLY N N 15 0.0887 0.0124 . . . . . . . 15437 2 76 . 1 1 79 79 ASP N N 15 0.1110 0.0091 . . . . . . . 15437 2 77 . 1 1 80 80 ASN N N 15 0.0784 0.0055 . . . . . . . 15437 2 78 . 1 1 81 81 SER N N 15 0.0714 0.0070 . . . . . . . 15437 2 79 . 1 1 82 82 LEU N N 15 0.0823 0.0022 . . . . . . . 15437 2 80 . 1 1 83 83 HIS N N 15 0.0709 0.0060 . . . . . . . 15437 2 81 . 1 1 84 84 ASN N N 15 0.0872 0.0066 . . . . . . . 15437 2 82 . 1 1 85 85 VAL N N 15 0.0782 0.0028 . . . . . . . 15437 2 83 . 1 1 86 86 HIS N N 15 0.0716 0.0037 . . . . . . . 15437 2 84 . 1 1 87 87 GLU N N 15 0.0540 0.0097 . . . . . . . 15437 2 85 . 1 1 88 88 ASN N N 15 0.0791 0.0076 . . . . . . . 15437 2 86 . 1 1 89 89 ILE N N 15 0.0478 0.0097 . . . . . . . 15437 2 87 . 1 1 90 90 LYS N N 15 0.0822 0.0036 . . . . . . . 15437 2 88 . 1 1 91 91 GLU N N 15 0.0880 0.0021 . . . . . . . 15437 2 89 . 1 1 92 92 ILE N N 15 0.0947 0.0073 . . . . . . . 15437 2 90 . 1 1 93 93 PHE N N 15 0.0763 0.0090 . . . . . . . 15437 2 91 . 1 1 94 94 HIS N N 15 0.0784 0.0058 . . . . . . . 15437 2 92 . 1 1 95 95 HIS N N 15 0.0847 0.0017 . . . . . . . 15437 2 93 . 1 1 96 96 LEU N N 15 0.0725 0.0067 . . . . . . . 15437 2 94 . 1 1 97 97 GLU N N 15 0.0826 0.0041 . . . . . . . 15437 2 95 . 1 1 98 98 GLU N N 15 0.0924 0.0082 . . . . . . . 15437 2 96 . 1 1 99 99 LEU N N 15 0.0944 0.0037 . . . . . . . 15437 2 97 . 1 1 100 100 VAL N N 15 0.0467 0.0072 . . . . . . . 15437 2 98 . 1 1 101 101 HIS N N 15 0.1116 0.0050 . . . . . . . 15437 2 99 . 1 1 102 102 ARG N N 15 0.2375 0.0077 . . . . . . . 15437 2 stop_ save_