data_17278 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 17278 _Entry.Title ; NMR assignment of actin depolymerizing and dynamics regulatory protein from toxoplasma gondii ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2010-11-03 _Entry.Accession_date 2010-11-03 _Entry.Last_release_date 2010-11-15 _Entry.Original_release_date 2010-11-15 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.0.9.13 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 'Vaibhav Kumar' Shukla . . . 17278 2 'Prem Prakash' Pathak . . . 17278 3 Rahul Yadav . . . 17278 4 Shubhra Srivastava . . . 17278 5 Anupam Jain . . . 17278 6 'S.V.S.R. Krishna' Pulavarti . . . 17278 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 17278 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 478 17278 '15N chemical shifts' 109 17278 '1H chemical shifts' 721 17278 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2010-11-15 2010-11-03 original author . 17278 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 17278 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title 'NMR assignment of actin depolymerizing and dynamics regulatory protein from Toxoplasma gondii' _Citation.Status 'in preparation' _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assignments' _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 'Vaibhav Kumar' Shukla . . . 17278 1 2 'Prem Prakash' Pathak . . . 17278 1 3 Rahul Yadav . . . 17278 1 4 Shubhra Srivastava . . . 17278 1 5 Anupam Jain . . . 17278 1 6 'S.V.S.R. Krishna' Pulavarti . . . 17278 1 7 Ashish Arora . . . 17278 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 17278 _Assembly.ID 1 _Assembly.Name 'TgADF Monomer' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 Monomer 1 $TgADF A . yes native no no . . . 17278 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_TgADF _Entity.Sf_category entity _Entity.Sf_framecode TgADF _Entity.Entry_ID 17278 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name TgADF _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 ; MASGMGVDENCVARFNELKI RKTVKWIVFKIENTKIVVEK DGKGNADEFRGALPANDCRF GVYDCGNKIQFVLWCPDNAP VKPRMTYASSKDALLKKLDG ATAVALEAHEMGDLAPLA ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 118 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 2L72 . "Solution Structure And Dynamics Of Adf From Toxoplasma Gondii (Tgadf)" . . . . . 100.00 139 100.00 100.00 2.95e-81 . . . . 17278 1 2 no PDB 2MOT . "Backbone Structure Of Actin Depolymerizing Factor (adf) Of Toxoplasma Gondii Based On Prot3dnmr Approach" . . . . . 100.00 118 100.00 100.00 2.73e-80 . . . . 17278 1 3 no GB AAC47717 . "actin depolymerizing factor [Toxoplasma gondii]" . . . . . 100.00 118 98.31 99.15 7.13e-79 . . . . 17278 1 4 no GB EPR57074 . "actin depolymerizing factor ADF [Toxoplasma gondii GT1]" . . . . . 100.00 118 100.00 100.00 2.73e-80 . . . . 17278 1 5 no GB EPT31140 . "actin depolymerizing factor ADF [Toxoplasma gondii ME49]" . . . . . 100.00 118 99.15 99.15 3.18e-79 . . . . 17278 1 6 no GB ESS28466 . "actin depolymerizing factor ADF [Toxoplasma gondii VEG]" . . . . . 100.00 118 100.00 100.00 2.73e-80 . . . . 17278 1 7 no GB KFG28323 . "actin depolymerizing factor ADF [Toxoplasma gondii p89]" . . . . . 100.00 118 100.00 100.00 2.73e-80 . . . . 17278 1 8 no REF XP_002371565 . "actin depolymerizing factor [Toxoplasma gondii ME49]" . . . . . 100.00 118 99.15 99.15 3.18e-79 . . . . 17278 1 9 no TPE CEL72722 . "TPA: actin depolymerizing factor [Toxoplasma gondii VEG]" . . . . . 100.00 118 100.00 100.00 2.73e-80 . . . . 17278 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 . 17278 1 2 . ALA . 17278 1 3 . SER . 17278 1 4 . GLY . 17278 1 5 . MET . 17278 1 6 . GLY . 17278 1 7 . VAL . 17278 1 8 . ASP . 17278 1 9 . GLU . 17278 1 10 . ASN . 17278 1 11 . CYS . 17278 1 12 . VAL . 17278 1 13 . ALA . 17278 1 14 . ARG . 17278 1 15 . PHE . 17278 1 16 . ASN . 17278 1 17 . GLU . 17278 1 18 . LEU . 17278 1 19 . LYS . 17278 1 20 . ILE . 17278 1 21 . ARG . 17278 1 22 . LYS . 17278 1 23 . THR . 17278 1 24 . VAL . 17278 1 25 . LYS . 17278 1 26 . TRP . 17278 1 27 . ILE . 17278 1 28 . VAL . 17278 1 29 . PHE . 17278 1 30 . LYS . 17278 1 31 . ILE . 17278 1 32 . GLU . 17278 1 33 . ASN . 17278 1 34 . THR . 17278 1 35 . LYS . 17278 1 36 . ILE . 17278 1 37 . VAL . 17278 1 38 . VAL . 17278 1 39 . GLU . 17278 1 40 . LYS . 17278 1 41 . ASP . 17278 1 42 . GLY . 17278 1 43 . LYS . 17278 1 44 . GLY . 17278 1 45 . ASN . 17278 1 46 . ALA . 17278 1 47 . ASP . 17278 1 48 . GLU . 17278 1 49 . PHE . 17278 1 50 . ARG . 17278 1 51 . GLY . 17278 1 52 . ALA . 17278 1 53 . LEU . 17278 1 54 . PRO . 17278 1 55 . ALA . 17278 1 56 . ASN . 17278 1 57 . ASP . 17278 1 58 . CYS . 17278 1 59 . ARG . 17278 1 60 . PHE . 17278 1 61 . GLY . 17278 1 62 . VAL . 17278 1 63 . TYR . 17278 1 64 . ASP . 17278 1 65 . CYS . 17278 1 66 . GLY . 17278 1 67 . ASN . 17278 1 68 . LYS . 17278 1 69 . ILE . 17278 1 70 . GLN . 17278 1 71 . PHE . 17278 1 72 . VAL . 17278 1 73 . LEU . 17278 1 74 . TRP . 17278 1 75 . CYS . 17278 1 76 . PRO . 17278 1 77 . ASP . 17278 1 78 . ASN . 17278 1 79 . ALA . 17278 1 80 . PRO . 17278 1 81 . VAL . 17278 1 82 . LYS . 17278 1 83 . PRO . 17278 1 84 . ARG . 17278 1 85 . MET . 17278 1 86 . THR . 17278 1 87 . TYR . 17278 1 88 . ALA . 17278 1 89 . SER . 17278 1 90 . SER . 17278 1 91 . LYS . 17278 1 92 . ASP . 17278 1 93 . ALA . 17278 1 94 . LEU . 17278 1 95 . LEU . 17278 1 96 . LYS . 17278 1 97 . LYS . 17278 1 98 . LEU . 17278 1 99 . ASP . 17278 1 100 . GLY . 17278 1 101 . ALA . 17278 1 102 . THR . 17278 1 103 . ALA . 17278 1 104 . VAL . 17278 1 105 . ALA . 17278 1 106 . LEU . 17278 1 107 . GLU . 17278 1 108 . ALA . 17278 1 109 . HIS . 17278 1 110 . GLU . 17278 1 111 . MET . 17278 1 112 . GLY . 17278 1 113 . ASP . 17278 1 114 . LEU . 17278 1 115 . ALA . 17278 1 116 . PRO . 17278 1 117 . LEU . 17278 1 118 . ALA . 17278 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 17278 1 . ALA 2 2 17278 1 . SER 3 3 17278 1 . GLY 4 4 17278 1 . MET 5 5 17278 1 . GLY 6 6 17278 1 . VAL 7 7 17278 1 . ASP 8 8 17278 1 . GLU 9 9 17278 1 . ASN 10 10 17278 1 . CYS 11 11 17278 1 . VAL 12 12 17278 1 . ALA 13 13 17278 1 . ARG 14 14 17278 1 . PHE 15 15 17278 1 . ASN 16 16 17278 1 . GLU 17 17 17278 1 . LEU 18 18 17278 1 . LYS 19 19 17278 1 . ILE 20 20 17278 1 . ARG 21 21 17278 1 . LYS 22 22 17278 1 . THR 23 23 17278 1 . VAL 24 24 17278 1 . LYS 25 25 17278 1 . TRP 26 26 17278 1 . ILE 27 27 17278 1 . VAL 28 28 17278 1 . PHE 29 29 17278 1 . LYS 30 30 17278 1 . ILE 31 31 17278 1 . GLU 32 32 17278 1 . ASN 33 33 17278 1 . THR 34 34 17278 1 . LYS 35 35 17278 1 . ILE 36 36 17278 1 . VAL 37 37 17278 1 . VAL 38 38 17278 1 . GLU 39 39 17278 1 . LYS 40 40 17278 1 . ASP 41 41 17278 1 . GLY 42 42 17278 1 . LYS 43 43 17278 1 . GLY 44 44 17278 1 . ASN 45 45 17278 1 . ALA 46 46 17278 1 . ASP 47 47 17278 1 . GLU 48 48 17278 1 . PHE 49 49 17278 1 . ARG 50 50 17278 1 . GLY 51 51 17278 1 . ALA 52 52 17278 1 . LEU 53 53 17278 1 . PRO 54 54 17278 1 . ALA 55 55 17278 1 . ASN 56 56 17278 1 . ASP 57 57 17278 1 . CYS 58 58 17278 1 . ARG 59 59 17278 1 . PHE 60 60 17278 1 . GLY 61 61 17278 1 . VAL 62 62 17278 1 . TYR 63 63 17278 1 . ASP 64 64 17278 1 . CYS 65 65 17278 1 . GLY 66 66 17278 1 . ASN 67 67 17278 1 . LYS 68 68 17278 1 . ILE 69 69 17278 1 . GLN 70 70 17278 1 . PHE 71 71 17278 1 . VAL 72 72 17278 1 . LEU 73 73 17278 1 . TRP 74 74 17278 1 . CYS 75 75 17278 1 . PRO 76 76 17278 1 . ASP 77 77 17278 1 . ASN 78 78 17278 1 . ALA 79 79 17278 1 . PRO 80 80 17278 1 . VAL 81 81 17278 1 . LYS 82 82 17278 1 . PRO 83 83 17278 1 . ARG 84 84 17278 1 . MET 85 85 17278 1 . THR 86 86 17278 1 . TYR 87 87 17278 1 . ALA 88 88 17278 1 . SER 89 89 17278 1 . SER 90 90 17278 1 . LYS 91 91 17278 1 . ASP 92 92 17278 1 . ALA 93 93 17278 1 . LEU 94 94 17278 1 . LEU 95 95 17278 1 . LYS 96 96 17278 1 . LYS 97 97 17278 1 . LEU 98 98 17278 1 . ASP 99 99 17278 1 . GLY 100 100 17278 1 . ALA 101 101 17278 1 . THR 102 102 17278 1 . ALA 103 103 17278 1 . VAL 104 104 17278 1 . ALA 105 105 17278 1 . LEU 106 106 17278 1 . GLU 107 107 17278 1 . ALA 108 108 17278 1 . HIS 109 109 17278 1 . GLU 110 110 17278 1 . MET 111 111 17278 1 . GLY 112 112 17278 1 . ASP 113 113 17278 1 . LEU 114 114 17278 1 . ALA 115 115 17278 1 . PRO 116 116 17278 1 . LEU 117 117 17278 1 . ALA 118 118 17278 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 17278 _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 $TgADF . 5811 organism . 'Toxoplasma gondii' 'Toxoplasma gondii' . . Eukaryota . Toxoplasma gondii . . . . . . . . . . . . . . . . . . . . . 17278 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 17278 _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 $TgADF . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli 'BL21 (LAMBDA DE3)' . . . . . . . . . . . . . . . pET16b+ . . . . . . 17278 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 17278 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'potassium phosphate' 'natural abundance' . . . . . . 20 . . mM . . . . 17278 1 2 'sodium chloride' 'natural abundance' . . . . . . 50 . . mM . . . . 17278 1 3 'sodium azide' 'natural abundance' . . . . . . 0.1 . . % . . . . 17278 1 4 DTT 'natural abundance' . . . . . . 1 . . mM . . . . 17278 1 5 'AEBSF protease inhibitor' 'natural abundance' . . . . . . 1 . . mM . . . . 17278 1 6 H2O 'natural abundance' . . . . . . 95 . . % . . . . 17278 1 7 D2O 'natural abundance' . . . . . . 5 . . % . . . . 17278 1 8 TgADF '[U-100% 13C; U-100% 15N]' . . . . . . 0.8 . . mM . . . . 17278 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 17278 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 50 . mM 17278 1 pH 6.5 . pH 17278 1 pressure 1 . atm 17278 1 temperature 298 . K 17278 1 stop_ save_ ############################ # Computer software used # ############################ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 17278 _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' . . 17278 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 17278 1 stop_ save_ save_CARA _Software.Sf_category software _Software.Sf_framecode CARA _Software.Entry_ID 17278 _Software.ID 2 _Software.Name CARA _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Keller and Wuthrich' . . 17278 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 17278 2 stop_ save_ save_NMRDraw _Software.Sf_category software _Software.Sf_framecode NMRDraw _Software.Entry_ID 17278 _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' . . 17278 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 17278 3 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 17278 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 17278 _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 . . . 17278 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 17278 _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 . . . . . . . . . . . . . . . . 17278 1 2 '3D HN(CO)CA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17278 1 3 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17278 1 4 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17278 1 5 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17278 1 6 '3D HBHA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17278 1 7 '3D H(CCO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17278 1 8 '3D C(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17278 1 9 '3D HCCH-TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17278 1 10 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17278 1 11 '2D 1H-13C HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17278 1 12 HBCB(CGCD)HD no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17278 1 13 HBCB(CGCDCE)HE no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17278 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 17278 _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 na indirect 0.251449530 . . . . . . . . . 17278 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 17278 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . . . . . 17278 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 17278 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 17278 1 2 '3D HN(CO)CA' . . . 17278 1 3 '3D HNCACB' . . . 17278 1 4 '3D CBCA(CO)NH' . . . 17278 1 5 '3D HNCO' . . . 17278 1 6 '3D HBHA(CO)NH' . . . 17278 1 7 '3D H(CCO)NH' . . . 17278 1 8 '3D C(CO)NH' . . . 17278 1 9 '3D HCCH-TOCSY' . . . 17278 1 10 '3D 1H-15N NOESY' . . . 17278 1 11 '2D 1H-13C HSQC' . . . 17278 1 12 HBCB(CGCD)HD . . . 17278 1 13 HBCB(CGCDCE)HE . . . 17278 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $NMRPipe . . 17278 1 2 $CARA . . 17278 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 H H 1 8.211 0.020 . 1 . . . . 1 MET H . 17278 1 2 . 1 1 1 1 MET HA H 1 4.384 0.020 . 1 . . . . 1 MET HA . 17278 1 3 . 1 1 1 1 MET HB2 H 1 1.995 0.020 . 1 . . . . 1 MET HB2 . 17278 1 4 . 1 1 1 1 MET HB3 H 1 1.995 0.020 . 1 . . . . 1 MET HB3 . 17278 1 5 . 1 1 1 1 MET HG2 H 1 2.444 0.020 . 1 . . . . 1 MET HG2 . 17278 1 6 . 1 1 1 1 MET HG3 H 1 2.444 0.020 . 1 . . . . 1 MET HG3 . 17278 1 7 . 1 1 1 1 MET C C 13 175.945 0.3 . 1 . . . . 1 MET C . 17278 1 8 . 1 1 1 1 MET CA C 13 55.489 0.3 . 1 . . . . 1 MET CA . 17278 1 9 . 1 1 1 1 MET CB C 13 32.848 0.3 . 1 . . . . 1 MET CB . 17278 1 10 . 1 1 1 1 MET CG C 13 31.917 0.3 . 1 . . . . 1 MET CG . 17278 1 11 . 1 1 1 1 MET N N 15 121.961 0.3 . 1 . . . . 1 MET N . 17278 1 12 . 1 1 2 2 ALA H H 1 8.343 0.020 . 1 . . . . 2 ALA H . 17278 1 13 . 1 1 2 2 ALA HA H 1 4.293 0.020 . 1 . . . . 2 ALA HA . 17278 1 14 . 1 1 2 2 ALA HB1 H 1 1.383 0.020 . 1 . . . . 2 ALA HB . 17278 1 15 . 1 1 2 2 ALA HB2 H 1 1.383 0.020 . 1 . . . . 2 ALA HB . 17278 1 16 . 1 1 2 2 ALA HB3 H 1 1.383 0.020 . 1 . . . . 2 ALA HB . 17278 1 17 . 1 1 2 2 ALA C C 13 177.752 0.3 . 1 . . . . 2 ALA C . 17278 1 18 . 1 1 2 2 ALA CA C 13 52.738 0.3 . 1 . . . . 2 ALA CA . 17278 1 19 . 1 1 2 2 ALA CB C 13 19.288 0.3 . 1 . . . . 2 ALA CB . 17278 1 20 . 1 1 2 2 ALA N N 15 125.335 0.3 . 1 . . . . 2 ALA N . 17278 1 21 . 1 1 3 3 SER H H 1 8.226 0.020 . 1 . . . . 3 SER H . 17278 1 22 . 1 1 3 3 SER HA H 1 4.384 0.020 . 1 . . . . 3 SER HA . 17278 1 23 . 1 1 3 3 SER HB2 H 1 3.860 0.020 . 1 . . . . 3 SER HB2 . 17278 1 24 . 1 1 3 3 SER HB3 H 1 3.860 0.020 . 1 . . . . 3 SER HB3 . 17278 1 25 . 1 1 3 3 SER C C 13 174.977 0.3 . 1 . . . . 3 SER C . 17278 1 26 . 1 1 3 3 SER CA C 13 58.777 0.3 . 1 . . . . 3 SER CA . 17278 1 27 . 1 1 3 3 SER CB C 13 63.934 0.3 . 1 . . . . 3 SER CB . 17278 1 28 . 1 1 3 3 SER N N 15 114.932 0.3 . 1 . . . . 3 SER N . 17278 1 29 . 1 1 4 4 GLY H H 1 8.289 0.020 . 1 . . . . 4 GLY H . 17278 1 30 . 1 1 4 4 GLY HA2 H 1 3.909 0.020 . 1 . . . . 4 GLY HA2 . 17278 1 31 . 1 1 4 4 GLY HA3 H 1 3.909 0.020 . 1 . . . . 4 GLY HA3 . 17278 1 32 . 1 1 4 4 GLY C C 13 173.449 0.3 . 1 . . . . 4 GLY C . 17278 1 33 . 1 1 4 4 GLY CA C 13 45.139 0.3 . 1 . . . . 4 GLY CA . 17278 1 34 . 1 1 4 4 GLY N N 15 110.640 0.3 . 1 . . . . 4 GLY N . 17278 1 35 . 1 1 5 5 MET H H 1 7.976 0.020 . 1 . . . . 5 MET H . 17278 1 36 . 1 1 5 5 MET HA H 1 4.569 0.020 . 1 . . . . 5 MET HA . 17278 1 37 . 1 1 5 5 MET HB2 H 1 2.474 0.020 . 2 . . . . 5 MET HB2 . 17278 1 38 . 1 1 5 5 MET HB3 H 1 2.470 0.020 . 2 . . . . 5 MET HB3 . 17278 1 39 . 1 1 5 5 MET HG2 H 1 1.912 0.020 . 2 . . . . 5 MET HG2 . 17278 1 40 . 1 1 5 5 MET HG3 H 1 1.750 0.020 . 2 . . . . 5 MET HG3 . 17278 1 41 . 1 1 5 5 MET C C 13 175.945 0.3 . 1 . . . . 5 MET C . 17278 1 42 . 1 1 5 5 MET CA C 13 54.502 0.3 . 1 . . . . 5 MET CA . 17278 1 43 . 1 1 5 5 MET CB C 13 31.908 0.3 . 1 . . . . 5 MET CB . 17278 1 44 . 1 1 5 5 MET CG C 13 31.886 0.3 . 1 . . . . 5 MET CG . 17278 1 45 . 1 1 5 5 MET N N 15 120.694 0.3 . 1 . . . . 5 MET N . 17278 1 46 . 1 1 6 6 GLY H H 1 8.406 0.020 . 1 . . . . 6 GLY H . 17278 1 47 . 1 1 6 6 GLY HA2 H 1 4.245 0.020 . 2 . . . . 6 GLY HA2 . 17278 1 48 . 1 1 6 6 GLY HA3 H 1 3.755 0.020 . 2 . . . . 6 GLY HA3 . 17278 1 49 . 1 1 6 6 GLY C C 13 172.499 0.3 . 1 . . . . 6 GLY C . 17278 1 50 . 1 1 6 6 GLY CA C 13 44.596 0.3 . 1 . . . . 6 GLY CA . 17278 1 51 . 1 1 6 6 GLY N N 15 112.679 0.3 . 1 . . . . 6 GLY N . 17278 1 52 . 1 1 7 7 VAL H H 1 8.479 0.020 . 1 . . . . 7 VAL H . 17278 1 53 . 1 1 7 7 VAL HA H 1 4.255 0.020 . 1 . . . . 7 VAL HA . 17278 1 54 . 1 1 7 7 VAL HB H 1 1.799 0.020 . 1 . . . . 7 VAL HB . 17278 1 55 . 1 1 7 7 VAL HG11 H 1 0.673 0.020 . 1 . . . . 7 VAL HG1 . 17278 1 56 . 1 1 7 7 VAL HG12 H 1 0.673 0.020 . 1 . . . . 7 VAL HG1 . 17278 1 57 . 1 1 7 7 VAL HG13 H 1 0.673 0.020 . 1 . . . . 7 VAL HG1 . 17278 1 58 . 1 1 7 7 VAL HG21 H 1 0.671 0.020 . 1 . . . . 7 VAL HG2 . 17278 1 59 . 1 1 7 7 VAL HG22 H 1 0.671 0.020 . 1 . . . . 7 VAL HG2 . 17278 1 60 . 1 1 7 7 VAL HG23 H 1 0.671 0.020 . 1 . . . . 7 VAL HG2 . 17278 1 61 . 1 1 7 7 VAL C C 13 175.610 0.3 . 1 . . . . 7 VAL C . 17278 1 62 . 1 1 7 7 VAL CA C 13 61.762 0.3 . 1 . . . . 7 VAL CA . 17278 1 63 . 1 1 7 7 VAL CB C 13 34.351 0.3 . 1 . . . . 7 VAL CB . 17278 1 64 . 1 1 7 7 VAL CG1 C 13 21.061 0.3 . 1 . . . . 7 VAL CG1 . 17278 1 65 . 1 1 7 7 VAL CG2 C 13 21.061 0.3 . 1 . . . . 7 VAL CG2 . 17278 1 66 . 1 1 7 7 VAL N N 15 120.694 0.3 . 1 . . . . 7 VAL N . 17278 1 67 . 1 1 8 8 ASP H H 1 9.011 0.020 . 1 . . . . 8 ASP H . 17278 1 68 . 1 1 8 8 ASP HA H 1 4.495 0.020 . 1 . . . . 8 ASP HA . 17278 1 69 . 1 1 8 8 ASP HB2 H 1 3.117 0.020 . 2 . . . . 8 ASP HB2 . 17278 1 70 . 1 1 8 8 ASP HB3 H 1 2.787 0.020 . 2 . . . . 8 ASP HB3 . 17278 1 71 . 1 1 8 8 ASP C C 13 178.106 0.3 . 1 . . . . 8 ASP C . 17278 1 72 . 1 1 8 8 ASP CA C 13 55.520 0.3 . 1 . . . . 8 ASP CA . 17278 1 73 . 1 1 8 8 ASP CB C 13 44.664 0.3 . 1 . . . . 8 ASP CB . 17278 1 74 . 1 1 8 8 ASP N N 15 128.850 0.3 . 1 . . . . 8 ASP N . 17278 1 75 . 1 1 9 9 GLU H H 1 9.371 0.020 . 1 . . . . 9 GLU H . 17278 1 76 . 1 1 9 9 GLU HA H 1 4.094 0.020 . 1 . . . . 9 GLU HA . 17278 1 77 . 1 1 9 9 GLU HB2 H 1 2.127 0.020 . 1 . . . . 9 GLU HB2 . 17278 1 78 . 1 1 9 9 GLU HB3 H 1 2.127 0.020 . 1 . . . . 9 GLU HB3 . 17278 1 79 . 1 1 9 9 GLU HG2 H 1 2.366 0.020 . 2 . . . . 9 GLU HG2 . 17278 1 80 . 1 1 9 9 GLU HG3 H 1 2.375 0.020 . 2 . . . . 9 GLU HG3 . 17278 1 81 . 1 1 9 9 GLU C C 13 178.739 0.3 . 1 . . . . 9 GLU C . 17278 1 82 . 1 1 9 9 GLU CA C 13 59.727 0.3 . 1 . . . . 9 GLU CA . 17278 1 83 . 1 1 9 9 GLU CB C 13 29.194 0.3 . 1 . . . . 9 GLU CB . 17278 1 84 . 1 1 9 9 GLU CG C 13 36.063 0.3 . 1 . . . . 9 GLU CG . 17278 1 85 . 1 1 9 9 GLU N N 15 128.147 0.3 . 1 . . . . 9 GLU N . 17278 1 86 . 1 1 10 10 ASN H H 1 9.218 0.020 . 1 . . . . 10 ASN H . 17278 1 87 . 1 1 10 10 ASN HA H 1 4.562 0.020 . 1 . . . . 10 ASN HA . 17278 1 88 . 1 1 10 10 ASN HB2 H 1 2.995 0.020 . 2 . . . . 10 ASN HB2 . 17278 1 89 . 1 1 10 10 ASN HB3 H 1 2.817 0.020 . 2 . . . . 10 ASN HB3 . 17278 1 90 . 1 1 10 10 ASN HD21 H 1 7.039 0.020 . 1 . . . . 10 ASN HD21 . 17278 1 91 . 1 1 10 10 ASN HD22 H 1 7.795 0.020 . 1 . . . . 10 ASN HD22 . 17278 1 92 . 1 1 10 10 ASN C C 13 177.547 0.3 . 1 . . . . 10 ASN C . 17278 1 93 . 1 1 10 10 ASN CA C 13 56.343 0.3 . 1 . . . . 10 ASN CA . 17278 1 94 . 1 1 10 10 ASN CB C 13 38.829 0.3 . 1 . . . . 10 ASN CB . 17278 1 95 . 1 1 10 10 ASN N N 15 118.796 0.3 . 1 . . . . 10 ASN N . 17278 1 96 . 1 1 10 10 ASN ND2 N 15 113.171 0.3 . 1 . . . . 10 ASN ND2 . 17278 1 97 . 1 1 11 11 CYS H H 1 8.472 0.020 . 1 . . . . 11 CYS H . 17278 1 98 . 1 1 11 11 CYS HA H 1 4.091 0.020 . 1 . . . . 11 CYS HA . 17278 1 99 . 1 1 11 11 CYS HB2 H 1 2.988 0.020 . 2 . . . . 11 CYS HB2 . 17278 1 100 . 1 1 11 11 CYS HB3 H 1 2.497 0.020 . 2 . . . . 11 CYS HB3 . 17278 1 101 . 1 1 11 11 CYS C C 13 176.262 0.3 . 1 . . . . 11 CYS C . 17278 1 102 . 1 1 11 11 CYS CA C 13 65.267 0.3 . 1 . . . . 11 CYS CA . 17278 1 103 . 1 1 11 11 CYS CB C 13 27.362 0.3 . 1 . . . . 11 CYS CB . 17278 1 104 . 1 1 11 11 CYS N N 15 116.475 0.3 . 1 . . . . 11 CYS N . 17278 1 105 . 1 1 12 12 VAL H H 1 6.910 0.020 . 1 . . . . 12 VAL H . 17278 1 106 . 1 1 12 12 VAL HA H 1 3.487 0.020 . 1 . . . . 12 VAL HA . 17278 1 107 . 1 1 12 12 VAL HB H 1 2.246 0.020 . 1 . . . . 12 VAL HB . 17278 1 108 . 1 1 12 12 VAL HG11 H 1 1.054 0.020 . 1 . . . . 12 VAL HG1 . 17278 1 109 . 1 1 12 12 VAL HG12 H 1 1.054 0.020 . 1 . . . . 12 VAL HG1 . 17278 1 110 . 1 1 12 12 VAL HG13 H 1 1.054 0.020 . 1 . . . . 12 VAL HG1 . 17278 1 111 . 1 1 12 12 VAL HG21 H 1 0.918 0.020 . 1 . . . . 12 VAL HG2 . 17278 1 112 . 1 1 12 12 VAL HG22 H 1 0.918 0.020 . 1 . . . . 12 VAL HG2 . 17278 1 113 . 1 1 12 12 VAL HG23 H 1 0.918 0.020 . 1 . . . . 12 VAL HG2 . 17278 1 114 . 1 1 12 12 VAL C C 13 177.510 0.3 . 1 . . . . 12 VAL C . 17278 1 115 . 1 1 12 12 VAL CA C 13 65.698 0.3 . 1 . . . . 12 VAL CA . 17278 1 116 . 1 1 12 12 VAL CB C 13 32.179 0.3 . 1 . . . . 12 VAL CB . 17278 1 117 . 1 1 12 12 VAL CG1 C 13 22.267 0.3 . 1 . . . . 12 VAL CG1 . 17278 1 118 . 1 1 12 12 VAL CG2 C 13 21.362 0.3 . 1 . . . . 12 VAL CG2 . 17278 1 119 . 1 1 12 12 VAL N N 15 117.741 0.3 . 1 . . . . 12 VAL N . 17278 1 120 . 1 1 13 13 ALA H H 1 7.757 0.020 . 1 . . . . 13 ALA H . 17278 1 121 . 1 1 13 13 ALA HA H 1 4.226 0.020 . 1 . . . . 13 ALA HA . 17278 1 122 . 1 1 13 13 ALA HB1 H 1 1.559 0.020 . 1 . . . . 13 ALA HB . 17278 1 123 . 1 1 13 13 ALA HB2 H 1 1.559 0.020 . 1 . . . . 13 ALA HB . 17278 1 124 . 1 1 13 13 ALA HB3 H 1 1.559 0.020 . 1 . . . . 13 ALA HB . 17278 1 125 . 1 1 13 13 ALA C C 13 181.403 0.3 . 1 . . . . 13 ALA C . 17278 1 126 . 1 1 13 13 ALA CA C 13 55.588 0.3 . 1 . . . . 13 ALA CA . 17278 1 127 . 1 1 13 13 ALA CB C 13 18.338 0.3 . 1 . . . . 13 ALA CB . 17278 1 128 . 1 1 13 13 ALA N N 15 122.171 0.3 . 1 . . . . 13 ALA N . 17278 1 129 . 1 1 14 14 ARG H H 1 8.539 0.020 . 1 . . . . 14 ARG H . 17278 1 130 . 1 1 14 14 ARG HA H 1 4.063 0.020 . 1 . . . . 14 ARG HA . 17278 1 131 . 1 1 14 14 ARG HB2 H 1 1.926 0.020 . 1 . . . . 14 ARG HB2 . 17278 1 132 . 1 1 14 14 ARG HB3 H 1 1.926 0.020 . 1 . . . . 14 ARG HB3 . 17278 1 133 . 1 1 14 14 ARG HD2 H 1 3.209 0.020 . 2 . . . . 14 ARG HD2 . 17278 1 134 . 1 1 14 14 ARG HD3 H 1 3.209 0.020 . 2 . . . . 14 ARG HD3 . 17278 1 135 . 1 1 14 14 ARG HG2 H 1 1.509 0.020 . 2 . . . . 14 ARG HG2 . 17278 1 136 . 1 1 14 14 ARG HG3 H 1 1.508 0.020 . 2 . . . . 14 ARG HG3 . 17278 1 137 . 1 1 14 14 ARG C C 13 178.404 0.3 . 1 . . . . 14 ARG C . 17278 1 138 . 1 1 14 14 ARG CA C 13 56.877 0.3 . 1 . . . . 14 ARG CA . 17278 1 139 . 1 1 14 14 ARG CB C 13 28.448 0.3 . 1 . . . . 14 ARG CB . 17278 1 140 . 1 1 14 14 ARG CD C 13 45.110 0.3 . 1 . . . . 14 ARG CD . 17278 1 141 . 1 1 14 14 ARG CG C 13 25.584 0.3 . 1 . . . . 14 ARG CG . 17278 1 142 . 1 1 14 14 ARG N N 15 117.038 0.3 . 1 . . . . 14 ARG N . 17278 1 143 . 1 1 15 15 PHE H H 1 7.996 0.020 . 1 . . . . 15 PHE H . 17278 1 144 . 1 1 15 15 PHE HA H 1 4.012 0.020 . 1 . . . . 15 PHE HA . 17278 1 145 . 1 1 15 15 PHE HB2 H 1 3.249 0.020 . 1 . . . . 15 PHE HB2 . 17278 1 146 . 1 1 15 15 PHE HB3 H 1 3.249 0.020 . 1 . . . . 15 PHE HB3 . 17278 1 147 . 1 1 15 15 PHE HD1 H 1 7.068 0.020 . 3 . . . . 15 PHE HD1 . 17278 1 148 . 1 1 15 15 PHE HD2 H 1 7.232 0.020 . 3 . . . . 15 PHE HD2 . 17278 1 149 . 1 1 15 15 PHE HE1 H 1 7.232 0.020 . 3 . . . . 15 PHE HE1 . 17278 1 150 . 1 1 15 15 PHE HE2 H 1 7.068 0.020 . 3 . . . . 15 PHE HE2 . 17278 1 151 . 1 1 15 15 PHE C C 13 176.522 0.3 . 1 . . . . 15 PHE C . 17278 1 152 . 1 1 15 15 PHE CA C 13 62.102 0.3 . 1 . . . . 15 PHE CA . 17278 1 153 . 1 1 15 15 PHE CB C 13 39.982 0.3 . 1 . . . . 15 PHE CB . 17278 1 154 . 1 1 15 15 PHE CD1 C 13 127.958 0.3 . 1 . . . . 15 PHE CD1 . 17278 1 155 . 1 1 15 15 PHE CD2 C 13 130.394 0.3 . 1 . . . . 15 PHE CD2 . 17278 1 156 . 1 1 15 15 PHE CE1 C 13 130.394 0.3 . 1 . . . . 15 PHE CE1 . 17278 1 157 . 1 1 15 15 PHE CE2 C 13 127.958 0.3 . 1 . . . . 15 PHE CE2 . 17278 1 158 . 1 1 15 15 PHE N N 15 119.710 0.3 . 1 . . . . 15 PHE N . 17278 1 159 . 1 1 16 16 ASN H H 1 8.800 0.020 . 1 . . . . 16 ASN H . 17278 1 160 . 1 1 16 16 ASN HA H 1 4.386 0.020 . 1 . . . . 16 ASN HA . 17278 1 161 . 1 1 16 16 ASN HB2 H 1 2.923 0.020 . 2 . . . . 16 ASN HB2 . 17278 1 162 . 1 1 16 16 ASN HB3 H 1 2.708 0.020 . 2 . . . . 16 ASN HB3 . 17278 1 163 . 1 1 16 16 ASN HD21 H 1 7.527 0.020 . 1 . . . . 16 ASN HD21 . 17278 1 164 . 1 1 16 16 ASN HD22 H 1 6.918 0.020 . 1 . . . . 16 ASN HD22 . 17278 1 165 . 1 1 16 16 ASN C C 13 178.143 0.3 . 1 . . . . 16 ASN C . 17278 1 166 . 1 1 16 16 ASN CA C 13 56.131 0.3 . 1 . . . . 16 ASN CA . 17278 1 167 . 1 1 16 16 ASN CB C 13 37.607 0.3 . 1 . . . . 16 ASN CB . 17278 1 168 . 1 1 16 16 ASN N N 15 118.725 0.3 . 1 . . . . 16 ASN N . 17278 1 169 . 1 1 16 16 ASN ND2 N 15 110.499 0.3 . 1 . . . . 16 ASN ND2 . 17278 1 170 . 1 1 17 17 GLU H H 1 7.649 0.020 . 1 . . . . 17 GLU H . 17278 1 171 . 1 1 17 17 GLU HA H 1 3.787 0.020 . 1 . . . . 17 GLU HA . 17278 1 172 . 1 1 17 17 GLU HB2 H 1 2.110 0.020 . 1 . . . . 17 GLU HB2 . 17278 1 173 . 1 1 17 17 GLU HB3 H 1 2.110 0.020 . 1 . . . . 17 GLU HB3 . 17278 1 174 . 1 1 17 17 GLU HG2 H 1 2.246 0.020 . 1 . . . . 17 GLU HG2 . 17278 1 175 . 1 1 17 17 GLU HG3 H 1 2.246 0.020 . 1 . . . . 17 GLU HG3 . 17278 1 176 . 1 1 17 17 GLU C C 13 178.068 0.3 . 1 . . . . 17 GLU C . 17278 1 177 . 1 1 17 17 GLU CA C 13 59.950 0.3 . 1 . . . . 17 GLU CA . 17278 1 178 . 1 1 17 17 GLU CB C 13 28.523 0.3 . 1 . . . . 17 GLU CB . 17278 1 179 . 1 1 17 17 GLU CG C 13 35.988 0.3 . 1 . . . . 17 GLU CG . 17278 1 180 . 1 1 17 17 GLU N N 15 121.374 0.3 . 1 . . . . 17 GLU N . 17278 1 181 . 1 1 18 18 LEU H H 1 7.308 0.020 . 1 . . . . 18 LEU H . 17278 1 182 . 1 1 18 18 LEU HA H 1 4.054 0.020 . 1 . . . . 18 LEU HA . 17278 1 183 . 1 1 18 18 LEU HB2 H 1 1.764 0.020 . 2 . . . . 18 LEU HB2 . 17278 1 184 . 1 1 18 18 LEU HB3 H 1 1.295 0.020 . 2 . . . . 18 LEU HB3 . 17278 1 185 . 1 1 18 18 LEU HD11 H 1 0.548 0.020 . 1 . . . . 18 LEU HD1 . 17278 1 186 . 1 1 18 18 LEU HD12 H 1 0.548 0.020 . 1 . . . . 18 LEU HD1 . 17278 1 187 . 1 1 18 18 LEU HD13 H 1 0.548 0.020 . 1 . . . . 18 LEU HD1 . 17278 1 188 . 1 1 18 18 LEU HD21 H 1 0.459 0.020 . 1 . . . . 18 LEU HD2 . 17278 1 189 . 1 1 18 18 LEU HD22 H 1 0.459 0.020 . 1 . . . . 18 LEU HD2 . 17278 1 190 . 1 1 18 18 LEU HD23 H 1 0.459 0.020 . 1 . . . . 18 LEU HD2 . 17278 1 191 . 1 1 18 18 LEU HG H 1 1.295 0.020 . 1 . . . . 18 LEU HG . 17278 1 192 . 1 1 18 18 LEU C C 13 177.789 0.3 . 1 . . . . 18 LEU C . 17278 1 193 . 1 1 18 18 LEU CA C 13 59.071 0.3 . 1 . . . . 18 LEU CA . 17278 1 194 . 1 1 18 18 LEU CB C 13 42.622 0.3 . 1 . . . . 18 LEU CB . 17278 1 195 . 1 1 18 18 LEU CD1 C 13 25.584 0.3 . 1 . . . . 18 LEU CD1 . 17278 1 196 . 1 1 18 18 LEU CD2 C 13 25.584 0.3 . 1 . . . . 18 LEU CD2 . 17278 1 197 . 1 1 18 18 LEU CG C 13 29.806 0.3 . 1 . . . . 18 LEU CG . 17278 1 198 . 1 1 18 18 LEU N N 15 121.708 0.3 . 1 . . . . 18 LEU N . 17278 1 199 . 1 1 19 19 LYS H H 1 8.490 0.020 . 1 . . . . 19 LYS H . 17278 1 200 . 1 1 19 19 LYS C C 13 177.156 0.3 . 1 . . . . 19 LYS C . 17278 1 201 . 1 1 19 19 LYS CA C 13 59.523 0.3 . 1 . . . . 19 LYS CA . 17278 1 202 . 1 1 19 19 LYS CB C 13 33.401 0.3 . 1 . . . . 19 LYS CB . 17278 1 203 . 1 1 19 19 LYS N N 15 118.136 0.3 . 1 . . . . 19 LYS N . 17278 1 204 . 1 1 20 20 ILE HA H 1 4.358 0.020 . 1 . . . . 20 ILE HA . 17278 1 205 . 1 1 20 20 ILE HB H 1 1.916 0.020 . 1 . . . . 20 ILE HB . 17278 1 206 . 1 1 20 20 ILE HD11 H 1 0.331 0.020 . 1 . . . . 20 ILE HD1 . 17278 1 207 . 1 1 20 20 ILE HD12 H 1 0.331 0.020 . 1 . . . . 20 ILE HD1 . 17278 1 208 . 1 1 20 20 ILE HD13 H 1 0.331 0.020 . 1 . . . . 20 ILE HD1 . 17278 1 209 . 1 1 20 20 ILE HG12 H 1 1.559 0.020 . 1 . . . . 20 ILE HG12 . 17278 1 210 . 1 1 20 20 ILE HG13 H 1 1.559 0.020 . 1 . . . . 20 ILE HG13 . 17278 1 211 . 1 1 20 20 ILE HG21 H 1 0.820 0.020 . 1 . . . . 20 ILE HG2 . 17278 1 212 . 1 1 20 20 ILE HG22 H 1 0.820 0.020 . 1 . . . . 20 ILE HG2 . 17278 1 213 . 1 1 20 20 ILE HG23 H 1 0.820 0.020 . 1 . . . . 20 ILE HG2 . 17278 1 214 . 1 1 20 20 ILE C C 13 177.212 0.3 . 1 . . . . 20 ILE C . 17278 1 215 . 1 1 20 20 ILE CA C 13 62.441 0.3 . 1 . . . . 20 ILE CA . 17278 1 216 . 1 1 20 20 ILE CB C 13 38.442 0.3 . 1 . . . . 20 ILE CB . 17278 1 217 . 1 1 20 20 ILE CD1 C 13 14.879 0.3 . 1 . . . . 20 ILE CD1 . 17278 1 218 . 1 1 20 20 ILE CG1 C 13 27.921 0.3 . 1 . . . . 20 ILE CG1 . 17278 1 219 . 1 1 20 20 ILE CG2 C 13 17.140 0.3 . 1 . . . . 20 ILE CG2 . 17278 1 220 . 1 1 21 21 ARG H H 1 7.221 0.020 . 1 . . . . 21 ARG H . 17278 1 221 . 1 1 21 21 ARG HA H 1 4.279 0.020 . 1 . . . . 21 ARG HA . 17278 1 222 . 1 1 21 21 ARG HB2 H 1 1.982 0.020 . 1 . . . . 21 ARG HB2 . 17278 1 223 . 1 1 21 21 ARG HB3 H 1 1.982 0.020 . 1 . . . . 21 ARG HB3 . 17278 1 224 . 1 1 21 21 ARG HD2 H 1 3.179 0.020 . 2 . . . . 21 ARG HD2 . 17278 1 225 . 1 1 21 21 ARG HD3 H 1 3.174 0.020 . 2 . . . . 21 ARG HD3 . 17278 1 226 . 1 1 21 21 ARG HG2 H 1 1.612 0.020 . 1 . . . . 21 ARG HG2 . 17278 1 227 . 1 1 21 21 ARG HG3 H 1 1.612 0.020 . 1 . . . . 21 ARG HG3 . 17278 1 228 . 1 1 21 21 ARG C C 13 176.243 0.3 . 1 . . . . 21 ARG C . 17278 1 229 . 1 1 21 21 ARG CA C 13 57.013 0.3 . 1 . . . . 21 ARG CA . 17278 1 230 . 1 1 21 21 ARG CB C 13 31.365 0.3 . 1 . . . . 21 ARG CB . 17278 1 231 . 1 1 21 21 ARG CD C 13 42.999 0.3 . 1 . . . . 21 ARG CD . 17278 1 232 . 1 1 21 21 ARG CG C 13 28.223 0.3 . 1 . . . . 21 ARG CG . 17278 1 233 . 1 1 21 21 ARG N N 15 116.374 0.3 . 1 . . . . 21 ARG N . 17278 1 234 . 1 1 22 22 LYS H H 1 7.653 0.020 . 1 . . . . 22 LYS H . 17278 1 235 . 1 1 22 22 LYS C C 13 176.746 0.3 . 1 . . . . 22 LYS C . 17278 1 236 . 1 1 22 22 LYS CA C 13 57.081 0.3 . 1 . . . . 22 LYS CA . 17278 1 237 . 1 1 22 22 LYS CB C 13 28.176 0.3 . 1 . . . . 22 LYS CB . 17278 1 238 . 1 1 22 22 LYS N N 15 113.934 0.3 . 1 . . . . 22 LYS N . 17278 1 239 . 1 1 24 24 VAL HA H 1 3.804 0.020 . 1 . . . . 24 VAL HA . 17278 1 240 . 1 1 24 24 VAL HB H 1 1.599 0.020 . 1 . . . . 24 VAL HB . 17278 1 241 . 1 1 24 24 VAL HG11 H 1 0.556 0.020 . 1 . . . . 24 VAL HG1 . 17278 1 242 . 1 1 24 24 VAL HG12 H 1 0.556 0.020 . 1 . . . . 24 VAL HG1 . 17278 1 243 . 1 1 24 24 VAL HG13 H 1 0.556 0.020 . 1 . . . . 24 VAL HG1 . 17278 1 244 . 1 1 24 24 VAL HG21 H 1 0.556 0.020 . 1 . . . . 24 VAL HG2 . 17278 1 245 . 1 1 24 24 VAL HG22 H 1 0.556 0.020 . 1 . . . . 24 VAL HG2 . 17278 1 246 . 1 1 24 24 VAL HG23 H 1 0.556 0.020 . 1 . . . . 24 VAL HG2 . 17278 1 247 . 1 1 24 24 VAL C C 13 173.450 0.3 . 1 . . . . 24 VAL C . 17278 1 248 . 1 1 24 24 VAL CA C 13 60.473 0.3 . 1 . . . . 24 VAL CA . 17278 1 249 . 1 1 24 24 VAL CB C 13 35.368 0.3 . 1 . . . . 24 VAL CB . 17278 1 250 . 1 1 24 24 VAL CG1 C 13 22.568 0.3 . 1 . . . . 24 VAL CG1 . 17278 1 251 . 1 1 24 24 VAL CG2 C 13 19.779 0.3 . 1 . . . . 24 VAL CG2 . 17278 1 252 . 1 1 25 25 LYS H H 1 8.933 0.020 . 1 . . . . 25 LYS H . 17278 1 253 . 1 1 25 25 LYS HA H 1 4.310 0.020 . 1 . . . . 25 LYS HA . 17278 1 254 . 1 1 25 25 LYS HB2 H 1 1.902 0.020 . 2 . . . . 25 LYS HB2 . 17278 1 255 . 1 1 25 25 LYS HB3 H 1 1.652 0.020 . 2 . . . . 25 LYS HB3 . 17278 1 256 . 1 1 25 25 LYS HD2 H 1 1.876 0.020 . 2 . . . . 25 LYS HD2 . 17278 1 257 . 1 1 25 25 LYS HD3 H 1 1.889 0.020 . 2 . . . . 25 LYS HD3 . 17278 1 258 . 1 1 25 25 LYS HE2 H 1 2.975 0.020 . 2 . . . . 25 LYS HE2 . 17278 1 259 . 1 1 25 25 LYS HE3 H 1 2.964 0.020 . 2 . . . . 25 LYS HE3 . 17278 1 260 . 1 1 25 25 LYS HG2 H 1 1.282 0.020 . 1 . . . . 25 LYS HG2 . 17278 1 261 . 1 1 25 25 LYS HG3 H 1 1.282 0.020 . 1 . . . . 25 LYS HG3 . 17278 1 262 . 1 1 25 25 LYS C C 13 173.711 0.3 . 1 . . . . 25 LYS C . 17278 1 263 . 1 1 25 25 LYS CA C 13 56.117 0.3 . 1 . . . . 25 LYS CA . 17278 1 264 . 1 1 25 25 LYS CB C 13 35.837 0.3 . 1 . . . . 25 LYS CB . 17278 1 265 . 1 1 25 25 LYS CD C 13 28.373 0.3 . 1 . . . . 25 LYS CD . 17278 1 266 . 1 1 25 25 LYS CE C 13 42.471 0.3 . 1 . . . . 25 LYS CE . 17278 1 267 . 1 1 25 25 LYS CG C 13 25.207 0.3 . 1 . . . . 25 LYS CG . 17278 1 268 . 1 1 25 25 LYS N N 15 124.069 0.3 . 1 . . . . 25 LYS N . 17278 1 269 . 1 1 26 26 TRP H H 1 7.394 0.020 . 1 . . . . 26 TRP H . 17278 1 270 . 1 1 26 26 TRP HA H 1 5.057 0.020 . 1 . . . . 26 TRP HA . 17278 1 271 . 1 1 26 26 TRP HB2 H 1 3.526 0.020 . 2 . . . . 26 TRP HB2 . 17278 1 272 . 1 1 26 26 TRP HB3 H 1 3.249 0.020 . 2 . . . . 26 TRP HB3 . 17278 1 273 . 1 1 26 26 TRP HD1 H 1 6.704 0.020 . 1 . . . . 26 TRP HD1 . 17278 1 274 . 1 1 26 26 TRP C C 13 174.027 0.3 . 1 . . . . 26 TRP C . 17278 1 275 . 1 1 26 26 TRP CA C 13 54.435 0.3 . 1 . . . . 26 TRP CA . 17278 1 276 . 1 1 26 26 TRP CB C 13 33.061 0.3 . 1 . . . . 26 TRP CB . 17278 1 277 . 1 1 26 26 TRP CD1 C 13 124.369 0.3 . 1 . . . . 26 TRP CD1 . 17278 1 278 . 1 1 26 26 TRP N N 15 113.663 0.3 . 1 . . . . 26 TRP N . 17278 1 279 . 1 1 27 27 ILE H H 1 8.593 0.020 . 1 . . . . 27 ILE H . 17278 1 280 . 1 1 27 27 ILE HA H 1 4.271 0.020 . 1 . . . . 27 ILE HA . 17278 1 281 . 1 1 27 27 ILE HB H 1 1.181 0.020 . 1 . . . . 27 ILE HB . 17278 1 282 . 1 1 27 27 ILE HD11 H 1 0.784 0.020 . 1 . . . . 27 ILE HD1 . 17278 1 283 . 1 1 27 27 ILE HD12 H 1 0.784 0.020 . 1 . . . . 27 ILE HD1 . 17278 1 284 . 1 1 27 27 ILE HD13 H 1 0.784 0.020 . 1 . . . . 27 ILE HD1 . 17278 1 285 . 1 1 27 27 ILE HG12 H 1 1.317 0.020 . 2 . . . . 27 ILE HG12 . 17278 1 286 . 1 1 27 27 ILE HG13 H 1 0.589 0.020 . 2 . . . . 27 ILE HG13 . 17278 1 287 . 1 1 27 27 ILE HG21 H 1 0.186 0.020 . 1 . . . . 27 ILE HG2 . 17278 1 288 . 1 1 27 27 ILE HG22 H 1 0.186 0.020 . 1 . . . . 27 ILE HG2 . 17278 1 289 . 1 1 27 27 ILE HG23 H 1 0.186 0.020 . 1 . . . . 27 ILE HG2 . 17278 1 290 . 1 1 27 27 ILE C C 13 174.661 0.3 . 1 . . . . 27 ILE C . 17278 1 291 . 1 1 27 27 ILE CA C 13 61.287 0.3 . 1 . . . . 27 ILE CA . 17278 1 292 . 1 1 27 27 ILE CB C 13 43.714 0.3 . 1 . . . . 27 ILE CB . 17278 1 293 . 1 1 27 27 ILE CD1 C 13 14.577 0.3 . 1 . . . . 27 ILE CD1 . 17278 1 294 . 1 1 27 27 ILE CG1 C 13 27.393 0.3 . 1 . . . . 27 ILE CG1 . 17278 1 295 . 1 1 27 27 ILE CG2 C 13 18.950 0.3 . 1 . . . . 27 ILE CG2 . 17278 1 296 . 1 1 27 27 ILE N N 15 116.335 0.3 . 1 . . . . 27 ILE N . 17278 1 297 . 1 1 28 28 VAL H H 1 9.289 0.020 . 1 . . . . 28 VAL H . 17278 1 298 . 1 1 28 28 VAL HA H 1 5.004 0.020 . 1 . . . . 28 VAL HA . 17278 1 299 . 1 1 28 28 VAL HB H 1 2.087 0.020 . 1 . . . . 28 VAL HB . 17278 1 300 . 1 1 28 28 VAL HG11 H 1 1.052 0.020 . 1 . . . . 28 VAL HG1 . 17278 1 301 . 1 1 28 28 VAL HG12 H 1 1.052 0.020 . 1 . . . . 28 VAL HG1 . 17278 1 302 . 1 1 28 28 VAL HG13 H 1 1.052 0.020 . 1 . . . . 28 VAL HG1 . 17278 1 303 . 1 1 28 28 VAL HG21 H 1 1.195 0.020 . 1 . . . . 28 VAL HG2 . 17278 1 304 . 1 1 28 28 VAL HG22 H 1 1.195 0.020 . 1 . . . . 28 VAL HG2 . 17278 1 305 . 1 1 28 28 VAL HG23 H 1 1.195 0.020 . 1 . . . . 28 VAL HG2 . 17278 1 306 . 1 1 28 28 VAL C C 13 174.670 0.3 . 1 . . . . 28 VAL C . 17278 1 307 . 1 1 28 28 VAL CA C 13 62.373 0.3 . 1 . . . . 28 VAL CA . 17278 1 308 . 1 1 28 28 VAL CB C 13 35.097 0.3 . 1 . . . . 28 VAL CB . 17278 1 309 . 1 1 28 28 VAL CG1 C 13 23.624 0.3 . 1 . . . . 28 VAL CG1 . 17278 1 310 . 1 1 28 28 VAL CG2 C 13 22.041 0.3 . 1 . . . . 28 VAL CG2 . 17278 1 311 . 1 1 28 28 VAL N N 15 126.249 0.3 . 1 . . . . 28 VAL N . 17278 1 312 . 1 1 29 29 PHE H H 1 9.676 0.020 . 1 . . . . 29 PHE H . 17278 1 313 . 1 1 29 29 PHE HA H 1 5.732 0.020 . 1 . . . . 29 PHE HA . 17278 1 314 . 1 1 29 29 PHE HB2 H 1 3.421 0.020 . 2 . . . . 29 PHE HB2 . 17278 1 315 . 1 1 29 29 PHE HB3 H 1 3.064 0.020 . 2 . . . . 29 PHE HB3 . 17278 1 316 . 1 1 29 29 PHE HD1 H 1 7.182 0.020 . 1 . . . . 29 PHE HD1 . 17278 1 317 . 1 1 29 29 PHE HD2 H 1 7.182 0.020 . 1 . . . . 29 PHE HD2 . 17278 1 318 . 1 1 29 29 PHE HE1 H 1 7.248 0.020 . 3 . . . . 29 PHE HE1 . 17278 1 319 . 1 1 29 29 PHE HE2 H 1 7.208 0.020 . 3 . . . . 29 PHE HE2 . 17278 1 320 . 1 1 29 29 PHE C C 13 174.381 0.3 . 1 . . . . 29 PHE C . 17278 1 321 . 1 1 29 29 PHE CA C 13 55.724 0.3 . 1 . . . . 29 PHE CA . 17278 1 322 . 1 1 29 29 PHE CB C 13 42.221 0.3 . 1 . . . . 29 PHE CB . 17278 1 323 . 1 1 29 29 PHE CD1 C 13 132.873 0.3 . 1 . . . . 29 PHE CD1 . 17278 1 324 . 1 1 29 29 PHE CD2 C 13 132.873 0.3 . 1 . . . . 29 PHE CD2 . 17278 1 325 . 1 1 29 29 PHE CE1 C 13 131.537 0.3 . 1 . . . . 29 PHE CE1 . 17278 1 326 . 1 1 29 29 PHE N N 15 126.038 0.3 . 1 . . . . 29 PHE N . 17278 1 327 . 1 1 30 30 LYS H H 1 9.465 0.020 . 1 . . . . 30 LYS H . 17278 1 328 . 1 1 30 30 LYS HA H 1 5.495 0.020 . 1 . . . . 30 LYS HA . 17278 1 329 . 1 1 30 30 LYS HB2 H 1 1.916 0.020 . 2 . . . . 30 LYS HB2 . 17278 1 330 . 1 1 30 30 LYS HB3 H 1 1.466 0.020 . 2 . . . . 30 LYS HB3 . 17278 1 331 . 1 1 30 30 LYS HD2 H 1 1.625 0.020 . 1 . . . . 30 LYS HD2 . 17278 1 332 . 1 1 30 30 LYS HD3 H 1 1.625 0.020 . 1 . . . . 30 LYS HD3 . 17278 1 333 . 1 1 30 30 LYS HE2 H 1 2.916 0.020 . 2 . . . . 30 LYS HE2 . 17278 1 334 . 1 1 30 30 LYS HE3 H 1 2.919 0.020 . 2 . . . . 30 LYS HE3 . 17278 1 335 . 1 1 30 30 LYS HG2 H 1 1.290 0.020 . 2 . . . . 30 LYS HG2 . 17278 1 336 . 1 1 30 30 LYS HG3 H 1 1.285 0.020 . 2 . . . . 30 LYS HG3 . 17278 1 337 . 1 1 30 30 LYS C C 13 173.599 0.3 . 1 . . . . 30 LYS C . 17278 1 338 . 1 1 30 30 LYS CA C 13 53.620 0.3 . 1 . . . . 30 LYS CA . 17278 1 339 . 1 1 30 30 LYS CB C 13 38.422 0.3 . 1 . . . . 30 LYS CB . 17278 1 340 . 1 1 30 30 LYS CD C 13 29.580 0.3 . 1 . . . . 30 LYS CD . 17278 1 341 . 1 1 30 30 LYS CE C 13 42.170 0.3 . 1 . . . . 30 LYS CE . 17278 1 342 . 1 1 30 30 LYS CG C 13 24.453 0.3 . 1 . . . . 30 LYS CG . 17278 1 343 . 1 1 30 30 LYS N N 15 120.061 0.3 . 1 . . . . 30 LYS N . 17278 1 344 . 1 1 31 31 ILE H H 1 8.474 0.020 . 1 . . . . 31 ILE H . 17278 1 345 . 1 1 31 31 ILE HA H 1 4.385 0.020 . 1 . . . . 31 ILE HA . 17278 1 346 . 1 1 31 31 ILE HB H 1 1.224 0.020 . 1 . . . . 31 ILE HB . 17278 1 347 . 1 1 31 31 ILE HD11 H 1 -0.102 0.020 . 1 . . . . 31 ILE HD1 . 17278 1 348 . 1 1 31 31 ILE HD12 H 1 -0.102 0.020 . 1 . . . . 31 ILE HD1 . 17278 1 349 . 1 1 31 31 ILE HD13 H 1 -0.102 0.020 . 1 . . . . 31 ILE HD1 . 17278 1 350 . 1 1 31 31 ILE HG12 H 1 0.736 0.020 . 2 . . . . 31 ILE HG12 . 17278 1 351 . 1 1 31 31 ILE HG13 H 1 1.089 0.020 . 2 . . . . 31 ILE HG13 . 17278 1 352 . 1 1 31 31 ILE HG21 H 1 0.609 0.020 . 1 . . . . 31 ILE HG2 . 17278 1 353 . 1 1 31 31 ILE HG22 H 1 0.609 0.020 . 1 . . . . 31 ILE HG2 . 17278 1 354 . 1 1 31 31 ILE HG23 H 1 0.609 0.020 . 1 . . . . 31 ILE HG2 . 17278 1 355 . 1 1 31 31 ILE C C 13 175.611 0.3 . 1 . . . . 31 ILE C . 17278 1 356 . 1 1 31 31 ILE CA C 13 61.762 0.3 . 1 . . . . 31 ILE CA . 17278 1 357 . 1 1 31 31 ILE CB C 13 38.625 0.3 . 1 . . . . 31 ILE CB . 17278 1 358 . 1 1 31 31 ILE CD1 C 13 12.918 0.3 . 1 . . . . 31 ILE CD1 . 17278 1 359 . 1 1 31 31 ILE CG1 C 13 29.881 0.3 . 1 . . . . 31 ILE CG1 . 17278 1 360 . 1 1 31 31 ILE CG2 C 13 16.989 0.3 . 1 . . . . 31 ILE CG2 . 17278 1 361 . 1 1 31 31 ILE N N 15 121.397 0.3 . 1 . . . . 31 ILE N . 17278 1 362 . 1 1 32 32 GLU H H 1 9.328 0.020 . 1 . . . . 32 GLU H . 17278 1 363 . 1 1 32 32 GLU C C 13 174.996 0.3 . 1 . . . . 32 GLU C . 17278 1 364 . 1 1 32 32 GLU CA C 13 55.113 0.3 . 1 . . . . 32 GLU CA . 17278 1 365 . 1 1 32 32 GLU CB C 13 32.247 0.3 . 1 . . . . 32 GLU CB . 17278 1 366 . 1 1 32 32 GLU N N 15 131.522 0.3 . 1 . . . . 32 GLU N . 17278 1 367 . 1 1 34 34 THR HA H 1 4.609 0.020 . 1 . . . . 34 THR HA . 17278 1 368 . 1 1 34 34 THR HB H 1 3.896 0.020 . 1 . . . . 34 THR HB . 17278 1 369 . 1 1 34 34 THR HG21 H 1 1.137 0.020 . 1 . . . . 34 THR HG2 . 17278 1 370 . 1 1 34 34 THR HG22 H 1 1.137 0.020 . 1 . . . . 34 THR HG2 . 17278 1 371 . 1 1 34 34 THR HG23 H 1 1.137 0.020 . 1 . . . . 34 THR HG2 . 17278 1 372 . 1 1 34 34 THR C C 13 173.784 0.3 . 1 . . . . 34 THR C . 17278 1 373 . 1 1 34 34 THR CA C 13 61.966 0.3 . 1 . . . . 34 THR CA . 17278 1 374 . 1 1 34 34 THR CB C 13 68.887 0.3 . 1 . . . . 34 THR CB . 17278 1 375 . 1 1 34 34 THR CG2 C 13 21.965 0.3 . 1 . . . . 34 THR CG2 . 17278 1 376 . 1 1 35 35 LYS H H 1 7.734 0.020 . 1 . . . . 35 LYS H . 17278 1 377 . 1 1 35 35 LYS HA H 1 4.886 0.020 . 1 . . . . 35 LYS HA . 17278 1 378 . 1 1 35 35 LYS HB2 H 1 1.619 0.020 . 2 . . . . 35 LYS HB2 . 17278 1 379 . 1 1 35 35 LYS HB3 H 1 1.625 0.020 . 2 . . . . 35 LYS HB3 . 17278 1 380 . 1 1 35 35 LYS HD2 H 1 1.322 0.020 . 2 . . . . 35 LYS HD2 . 17278 1 381 . 1 1 35 35 LYS HD3 H 1 1.308 0.020 . 2 . . . . 35 LYS HD3 . 17278 1 382 . 1 1 35 35 LYS HE2 H 1 2.959 0.020 . 2 . . . . 35 LYS HE2 . 17278 1 383 . 1 1 35 35 LYS HE3 H 1 2.955 0.020 . 2 . . . . 35 LYS HE3 . 17278 1 384 . 1 1 35 35 LYS HG2 H 1 0.965 0.020 . 1 . . . . 35 LYS HG2 . 17278 1 385 . 1 1 35 35 LYS HG3 H 1 0.965 0.020 . 1 . . . . 35 LYS HG3 . 17278 1 386 . 1 1 35 35 LYS C C 13 173.784 0.3 . 1 . . . . 35 LYS C . 17278 1 387 . 1 1 35 35 LYS CA C 13 54.638 0.3 . 1 . . . . 35 LYS CA . 17278 1 388 . 1 1 35 35 LYS CB C 13 36.386 0.3 . 1 . . . . 35 LYS CB . 17278 1 389 . 1 1 35 35 LYS CD C 13 29.504 0.3 . 1 . . . . 35 LYS CD . 17278 1 390 . 1 1 35 35 LYS CE C 13 41.944 0.3 . 1 . . . . 35 LYS CE . 17278 1 391 . 1 1 35 35 LYS CG C 13 24.378 0.3 . 1 . . . . 35 LYS CG . 17278 1 392 . 1 1 35 35 LYS N N 15 120.202 0.3 . 1 . . . . 35 LYS N . 17278 1 393 . 1 1 36 36 ILE H H 1 8.449 0.020 . 1 . . . . 36 ILE H . 17278 1 394 . 1 1 36 36 ILE HA H 1 4.598 0.020 . 1 . . . . 36 ILE HA . 17278 1 395 . 1 1 36 36 ILE HB H 1 1.612 0.020 . 1 . . . . 36 ILE HB . 17278 1 396 . 1 1 36 36 ILE HD11 H 1 0.640 0.020 . 1 . . . . 36 ILE HD1 . 17278 1 397 . 1 1 36 36 ILE HD12 H 1 0.640 0.020 . 1 . . . . 36 ILE HD1 . 17278 1 398 . 1 1 36 36 ILE HD13 H 1 0.640 0.020 . 1 . . . . 36 ILE HD1 . 17278 1 399 . 1 1 36 36 ILE HG12 H 1 0.884 0.020 . 1 . . . . 36 ILE HG12 . 17278 1 400 . 1 1 36 36 ILE HG13 H 1 0.884 0.020 . 1 . . . . 36 ILE HG13 . 17278 1 401 . 1 1 36 36 ILE HG21 H 1 0.640 0.020 . 1 . . . . 36 ILE HG2 . 17278 1 402 . 1 1 36 36 ILE HG22 H 1 0.640 0.020 . 1 . . . . 36 ILE HG2 . 17278 1 403 . 1 1 36 36 ILE HG23 H 1 0.640 0.020 . 1 . . . . 36 ILE HG2 . 17278 1 404 . 1 1 36 36 ILE C C 13 174.715 0.3 . 1 . . . . 36 ILE C . 17278 1 405 . 1 1 36 36 ILE CA C 13 61.491 0.3 . 1 . . . . 36 ILE CA . 17278 1 406 . 1 1 36 36 ILE CB C 13 39.032 0.3 . 1 . . . . 36 ILE CB . 17278 1 407 . 1 1 36 36 ILE CD1 C 13 14.954 0.3 . 1 . . . . 36 ILE CD1 . 17278 1 408 . 1 1 36 36 ILE CG1 C 13 29.580 0.3 . 1 . . . . 36 ILE CG1 . 17278 1 409 . 1 1 36 36 ILE CG2 C 13 17.442 0.3 . 1 . . . . 36 ILE CG2 . 17278 1 410 . 1 1 36 36 ILE N N 15 122.944 0.3 . 1 . . . . 36 ILE N . 17278 1 411 . 1 1 37 37 VAL H H 1 9.250 0.020 . 1 . . . . 37 VAL H . 17278 1 412 . 1 1 37 37 VAL HA H 1 4.625 0.020 . 1 . . . . 37 VAL HA . 17278 1 413 . 1 1 37 37 VAL HB H 1 2.391 0.020 . 1 . . . . 37 VAL HB . 17278 1 414 . 1 1 37 37 VAL HG11 H 1 0.939 0.020 . 1 . . . . 37 VAL HG1 . 17278 1 415 . 1 1 37 37 VAL HG12 H 1 0.939 0.020 . 1 . . . . 37 VAL HG1 . 17278 1 416 . 1 1 37 37 VAL HG13 H 1 0.939 0.020 . 1 . . . . 37 VAL HG1 . 17278 1 417 . 1 1 37 37 VAL HG21 H 1 0.760 0.020 . 1 . . . . 37 VAL HG2 . 17278 1 418 . 1 1 37 37 VAL HG22 H 1 0.760 0.020 . 1 . . . . 37 VAL HG2 . 17278 1 419 . 1 1 37 37 VAL HG23 H 1 0.760 0.020 . 1 . . . . 37 VAL HG2 . 17278 1 420 . 1 1 37 37 VAL C C 13 175.889 0.3 . 1 . . . . 37 VAL C . 17278 1 421 . 1 1 37 37 VAL CA C 13 59.252 0.3 . 1 . . . . 37 VAL CA . 17278 1 422 . 1 1 37 37 VAL CB C 13 35.843 0.3 . 1 . . . . 37 VAL CB . 17278 1 423 . 1 1 37 37 VAL CG1 C 13 21.588 0.3 . 1 . . . . 37 VAL CG1 . 17278 1 424 . 1 1 37 37 VAL CG2 C 13 18.573 0.3 . 1 . . . . 37 VAL CG2 . 17278 1 425 . 1 1 37 37 VAL N N 15 118.753 0.3 . 1 . . . . 37 VAL N . 17278 1 426 . 1 1 38 38 VAL H H 1 8.953 0.020 . 1 . . . . 38 VAL H . 17278 1 427 . 1 1 38 38 VAL HA H 1 3.787 0.020 . 1 . . . . 38 VAL HA . 17278 1 428 . 1 1 38 38 VAL HB H 1 1.982 0.020 . 1 . . . . 38 VAL HB . 17278 1 429 . 1 1 38 38 VAL HG11 H 1 1.084 0.020 . 1 . . . . 38 VAL HG1 . 17278 1 430 . 1 1 38 38 VAL HG12 H 1 1.084 0.020 . 1 . . . . 38 VAL HG1 . 17278 1 431 . 1 1 38 38 VAL HG13 H 1 1.084 0.020 . 1 . . . . 38 VAL HG1 . 17278 1 432 . 1 1 38 38 VAL HG21 H 1 0.665 0.020 . 1 . . . . 38 VAL HG2 . 17278 1 433 . 1 1 38 38 VAL HG22 H 1 0.665 0.020 . 1 . . . . 38 VAL HG2 . 17278 1 434 . 1 1 38 38 VAL HG23 H 1 0.665 0.020 . 1 . . . . 38 VAL HG2 . 17278 1 435 . 1 1 38 38 VAL C C 13 175.929 0.3 . 1 . . . . 38 VAL C . 17278 1 436 . 1 1 38 38 VAL CA C 13 64.409 0.3 . 1 . . . . 38 VAL CA . 17278 1 437 . 1 1 38 38 VAL CB C 13 32.654 0.3 . 1 . . . . 38 VAL CB . 17278 1 438 . 1 1 38 38 VAL CG1 C 13 22.870 0.3 . 1 . . . . 38 VAL CG1 . 17278 1 439 . 1 1 38 38 VAL CG2 C 13 21.288 0.3 . 1 . . . . 38 VAL CG2 . 17278 1 440 . 1 1 38 38 VAL N N 15 122.382 0.3 . 1 . . . . 38 VAL N . 17278 1 441 . 1 1 39 39 GLU H H 1 9.586 0.020 . 1 . . . . 39 GLU H . 17278 1 442 . 1 1 39 39 GLU HA H 1 4.480 0.020 . 1 . . . . 39 GLU HA . 17278 1 443 . 1 1 39 39 GLU HB2 H 1 1.599 0.020 . 2 . . . . 39 GLU HB2 . 17278 1 444 . 1 1 39 39 GLU HB3 H 1 1.600 0.020 . 2 . . . . 39 GLU HB3 . 17278 1 445 . 1 1 39 39 GLU HG2 H 1 2.234 0.020 . 1 . . . . 39 GLU HG2 . 17278 1 446 . 1 1 39 39 GLU HG3 H 1 2.234 0.020 . 1 . . . . 39 GLU HG3 . 17278 1 447 . 1 1 39 39 GLU C C 13 175.592 0.3 . 1 . . . . 39 GLU C . 17278 1 448 . 1 1 39 39 GLU CA C 13 57.488 0.3 . 1 . . . . 39 GLU CA . 17278 1 449 . 1 1 39 39 GLU CB C 13 32.722 0.3 . 1 . . . . 39 GLU CB . 17278 1 450 . 1 1 39 39 GLU CG C 13 37.043 0.3 . 1 . . . . 39 GLU CG . 17278 1 451 . 1 1 39 39 GLU N N 15 130.257 0.3 . 1 . . . . 39 GLU N . 17278 1 452 . 1 1 40 40 LYS H H 1 7.925 0.020 . 1 . . . . 40 LYS H . 17278 1 453 . 1 1 40 40 LYS HA H 1 4.559 0.020 . 1 . . . . 40 LYS HA . 17278 1 454 . 1 1 40 40 LYS HB2 H 1 2.114 0.020 . 2 . . . . 40 LYS HB2 . 17278 1 455 . 1 1 40 40 LYS HB3 H 1 1.826 0.020 . 2 . . . . 40 LYS HB3 . 17278 1 456 . 1 1 40 40 LYS HD2 H 1 1.823 0.020 . 2 . . . . 40 LYS HD2 . 17278 1 457 . 1 1 40 40 LYS HD3 H 1 1.836 0.020 . 2 . . . . 40 LYS HD3 . 17278 1 458 . 1 1 40 40 LYS HE2 H 1 2.985 0.020 . 1 . . . . 40 LYS HE2 . 17278 1 459 . 1 1 40 40 LYS HE3 H 1 2.985 0.020 . 1 . . . . 40 LYS HE3 . 17278 1 460 . 1 1 40 40 LYS HG2 H 1 1.559 0.020 . 1 . . . . 40 LYS HG2 . 17278 1 461 . 1 1 40 40 LYS HG3 H 1 1.559 0.020 . 1 . . . . 40 LYS HG3 . 17278 1 462 . 1 1 40 40 LYS C C 13 171.904 0.3 . 1 . . . . 40 LYS C . 17278 1 463 . 1 1 40 40 LYS CA C 13 54.909 0.3 . 1 . . . . 40 LYS CA . 17278 1 464 . 1 1 40 40 LYS CB C 13 36.997 0.3 . 1 . . . . 40 LYS CB . 17278 1 465 . 1 1 40 40 LYS CD C 13 29.800 0.3 . 1 . . . . 40 LYS CD . 17278 1 466 . 1 1 40 40 LYS CE C 13 41.944 0.3 . 1 . . . . 40 LYS CE . 17278 1 467 . 1 1 40 40 LYS CG C 13 24.679 0.3 . 1 . . . . 40 LYS CG . 17278 1 468 . 1 1 40 40 LYS N N 15 115.632 0.3 . 1 . . . . 40 LYS N . 17278 1 469 . 1 1 41 41 ASP H H 1 7.817 0.020 . 1 . . . . 41 ASP H . 17278 1 470 . 1 1 41 41 ASP HA H 1 3.949 0.020 . 1 . . . . 41 ASP HA . 17278 1 471 . 1 1 41 41 ASP HB2 H 1 2.655 0.020 . 2 . . . . 41 ASP HB2 . 17278 1 472 . 1 1 41 41 ASP HB3 H 1 2.404 0.020 . 2 . . . . 41 ASP HB3 . 17278 1 473 . 1 1 41 41 ASP C C 13 173.450 0.3 . 1 . . . . 41 ASP C . 17278 1 474 . 1 1 41 41 ASP CA C 13 52.195 0.3 . 1 . . . . 41 ASP CA . 17278 1 475 . 1 1 41 41 ASP CB C 13 45.071 0.3 . 1 . . . . 41 ASP CB . 17278 1 476 . 1 1 41 41 ASP N N 15 118.108 0.3 . 1 . . . . 41 ASP N . 17278 1 477 . 1 1 42 42 GLY H H 1 6.205 0.020 . 1 . . . . 42 GLY H . 17278 1 478 . 1 1 42 42 GLY HA2 H 1 4.054 0.020 . 2 . . . . 42 GLY HA2 . 17278 1 479 . 1 1 42 42 GLY HA3 H 1 3.250 0.020 . 2 . . . . 42 GLY HA3 . 17278 1 480 . 1 1 42 42 GLY C C 13 172.500 0.3 . 1 . . . . 42 GLY C . 17278 1 481 . 1 1 42 42 GLY CA C 13 45.275 0.3 . 1 . . . . 42 GLY CA . 17278 1 482 . 1 1 42 42 GLY N N 15 101.288 0.3 . 1 . . . . 42 GLY N . 17278 1 483 . 1 1 43 43 LYS H H 1 8.980 0.020 . 1 . . . . 43 LYS H . 17278 1 484 . 1 1 43 43 LYS HA H 1 4.290 0.020 . 1 . . . . 43 LYS HA . 17278 1 485 . 1 1 43 43 LYS HB2 H 1 1.934 0.020 . 2 . . . . 43 LYS HB2 . 17278 1 486 . 1 1 43 43 LYS HB3 H 1 1.655 0.020 . 2 . . . . 43 LYS HB3 . 17278 1 487 . 1 1 43 43 LYS HD2 H 1 1.708 0.020 . 2 . . . . 43 LYS HD2 . 17278 1 488 . 1 1 43 43 LYS HD3 H 1 1.484 0.020 . 2 . . . . 43 LYS HD3 . 17278 1 489 . 1 1 43 43 LYS HE2 H 1 2.945 0.020 . 1 . . . . 43 LYS HE2 . 17278 1 490 . 1 1 43 43 LYS HE3 H 1 2.945 0.020 . 1 . . . . 43 LYS HE3 . 17278 1 491 . 1 1 43 43 LYS HG2 H 1 1.368 0.020 . 2 . . . . 43 LYS HG2 . 17278 1 492 . 1 1 43 43 LYS HG3 H 1 1.365 0.020 . 2 . . . . 43 LYS HG3 . 17278 1 493 . 1 1 43 43 LYS C C 13 176.262 0.3 . 1 . . . . 43 LYS C . 17278 1 494 . 1 1 43 43 LYS CA C 13 56.470 0.3 . 1 . . . . 43 LYS CA . 17278 1 495 . 1 1 43 43 LYS CB C 13 34.554 0.3 . 1 . . . . 43 LYS CB . 17278 1 496 . 1 1 43 43 LYS CD C 13 29.353 0.3 . 1 . . . . 43 LYS CD . 17278 1 497 . 1 1 43 43 LYS CE C 13 42.019 0.3 . 1 . . . . 43 LYS CE . 17278 1 498 . 1 1 43 43 LYS CG C 13 24.981 0.3 . 1 . . . . 43 LYS CG . 17278 1 499 . 1 1 43 43 LYS N N 15 118.022 0.3 . 1 . . . . 43 LYS N . 17278 1 500 . 1 1 44 44 GLY H H 1 9.070 0.020 . 1 . . . . 44 GLY H . 17278 1 501 . 1 1 44 44 GLY HA2 H 1 4.248 0.020 . 2 . . . . 44 GLY HA2 . 17278 1 502 . 1 1 44 44 GLY HA3 H 1 3.777 0.020 . 2 . . . . 44 GLY HA3 . 17278 1 503 . 1 1 44 44 GLY C C 13 171.215 0.3 . 1 . . . . 44 GLY C . 17278 1 504 . 1 1 44 44 GLY CA C 13 44.868 0.3 . 1 . . . . 44 GLY CA . 17278 1 505 . 1 1 44 44 GLY N N 15 112.257 0.3 . 1 . . . . 44 GLY N . 17278 1 506 . 1 1 45 45 ASN H H 1 7.660 0.020 . 1 . . . . 45 ASN H . 17278 1 507 . 1 1 45 45 ASN HA H 1 4.978 0.020 . 1 . . . . 45 ASN HA . 17278 1 508 . 1 1 45 45 ASN HB2 H 1 3.497 0.020 . 2 . . . . 45 ASN HB2 . 17278 1 509 . 1 1 45 45 ASN HB3 H 1 3.088 0.020 . 2 . . . . 45 ASN HB3 . 17278 1 510 . 1 1 45 45 ASN C C 13 176.560 0.3 . 1 . . . . 45 ASN C . 17278 1 511 . 1 1 45 45 ASN CA C 13 51.992 0.3 . 1 . . . . 45 ASN CA . 17278 1 512 . 1 1 45 45 ASN CB C 13 38.777 0.3 . 1 . . . . 45 ASN CB . 17278 1 513 . 1 1 45 45 ASN N N 15 112.749 0.3 . 1 . . . . 45 ASN N . 17278 1 514 . 1 1 46 46 ALA H H 1 7.692 0.020 . 1 . . . . 46 ALA H . 17278 1 515 . 1 1 46 46 ALA HA H 1 3.487 0.020 . 1 . . . . 46 ALA HA . 17278 1 516 . 1 1 46 46 ALA HB1 H 1 0.794 0.020 . 1 . . . . 46 ALA HB . 17278 1 517 . 1 1 46 46 ALA HB2 H 1 0.794 0.020 . 1 . . . . 46 ALA HB . 17278 1 518 . 1 1 46 46 ALA HB3 H 1 0.794 0.020 . 1 . . . . 46 ALA HB . 17278 1 519 . 1 1 46 46 ALA C C 13 178.721 0.3 . 1 . . . . 46 ALA C . 17278 1 520 . 1 1 46 46 ALA CA C 13 55.384 0.3 . 1 . . . . 46 ALA CA . 17278 1 521 . 1 1 46 46 ALA CB C 13 18.066 0.3 . 1 . . . . 46 ALA CB . 17278 1 522 . 1 1 46 46 ALA N N 15 119.160 0.3 . 1 . . . . 46 ALA N . 17278 1 523 . 1 1 47 47 ASP H H 1 7.910 0.020 . 1 . . . . 47 ASP H . 17278 1 524 . 1 1 47 47 ASP HA H 1 4.234 0.020 . 1 . . . . 47 ASP HA . 17278 1 525 . 1 1 47 47 ASP HB2 H 1 2.615 0.020 . 1 . . . . 47 ASP HB2 . 17278 1 526 . 1 1 47 47 ASP HB3 H 1 2.615 0.020 . 1 . . . . 47 ASP HB3 . 17278 1 527 . 1 1 47 47 ASP C C 13 178.721 0.3 . 1 . . . . 47 ASP C . 17278 1 528 . 1 1 47 47 ASP CA C 13 57.216 0.3 . 1 . . . . 47 ASP CA . 17278 1 529 . 1 1 47 47 ASP CB C 13 39.575 0.3 . 1 . . . . 47 ASP CB . 17278 1 530 . 1 1 47 47 ASP N N 15 116.686 0.3 . 1 . . . . 47 ASP N . 17278 1 531 . 1 1 48 48 GLU H H 1 7.574 0.020 . 1 . . . . 48 GLU H . 17278 1 532 . 1 1 48 48 GLU HA H 1 3.829 0.020 . 1 . . . . 48 GLU HA . 17278 1 533 . 1 1 48 48 GLU HB2 H 1 2.584 0.020 . 2 . . . . 48 GLU HB2 . 17278 1 534 . 1 1 48 48 GLU HB3 H 1 2.140 0.020 . 2 . . . . 48 GLU HB3 . 17278 1 535 . 1 1 48 48 GLU HG2 H 1 2.417 0.020 . 1 . . . . 48 GLU HG2 . 17278 1 536 . 1 1 48 48 GLU HG3 H 1 2.417 0.020 . 1 . . . . 48 GLU HG3 . 17278 1 537 . 1 1 48 48 GLU C C 13 178.069 0.3 . 1 . . . . 48 GLU C . 17278 1 538 . 1 1 48 48 GLU CA C 13 58.981 0.3 . 1 . . . . 48 GLU CA . 17278 1 539 . 1 1 48 48 GLU CB C 13 30.551 0.3 . 1 . . . . 48 GLU CB . 17278 1 540 . 1 1 48 48 GLU CG C 13 37.797 0.3 . 1 . . . . 48 GLU CG . 17278 1 541 . 1 1 48 48 GLU N N 15 124.421 0.3 . 1 . . . . 48 GLU N . 17278 1 542 . 1 1 49 49 PHE H H 1 6.832 0.020 . 1 . . . . 49 PHE H . 17278 1 543 . 1 1 49 49 PHE HA H 1 4.245 0.020 . 1 . . . . 49 PHE HA . 17278 1 544 . 1 1 49 49 PHE HB2 H 1 2.156 0.020 . 2 . . . . 49 PHE HB2 . 17278 1 545 . 1 1 49 49 PHE HB3 H 1 2.255 0.020 . 2 . . . . 49 PHE HB3 . 17278 1 546 . 1 1 49 49 PHE HD1 H 1 6.664 0.020 . 3 . . . . 49 PHE HD1 . 17278 1 547 . 1 1 49 49 PHE HD2 H 1 6.612 0.020 . 3 . . . . 49 PHE HD2 . 17278 1 548 . 1 1 49 49 PHE HE1 H 1 6.705 0.020 . 3 . . . . 49 PHE HE1 . 17278 1 549 . 1 1 49 49 PHE HE2 H 1 6.612 0.020 . 3 . . . . 49 PHE HE2 . 17278 1 550 . 1 1 49 49 PHE C C 13 175.611 0.3 . 1 . . . . 49 PHE C . 17278 1 551 . 1 1 49 49 PHE CA C 13 59.252 0.3 . 1 . . . . 49 PHE CA . 17278 1 552 . 1 1 49 49 PHE CB C 13 38.829 0.3 . 1 . . . . 49 PHE CB . 17278 1 553 . 1 1 49 49 PHE CD1 C 13 118.039 0.3 . 1 . . . . 49 PHE CD1 . 17278 1 554 . 1 1 49 49 PHE CE1 C 13 124.052 0.3 . 1 . . . . 49 PHE CE1 . 17278 1 555 . 1 1 49 49 PHE N N 15 119.429 0.3 . 1 . . . . 49 PHE N . 17278 1 556 . 1 1 50 50 ARG H H 1 8.222 0.020 . 1 . . . . 50 ARG H . 17278 1 557 . 1 1 50 50 ARG HA H 1 2.831 0.020 . 1 . . . . 50 ARG HA . 17278 1 558 . 1 1 50 50 ARG HB2 H 1 1.546 0.020 . 1 . . . . 50 ARG HB2 . 17278 1 559 . 1 1 50 50 ARG HB3 H 1 1.546 0.020 . 1 . . . . 50 ARG HB3 . 17278 1 560 . 1 1 50 50 ARG HG2 H 1 1.044 0.020 . 1 . . . . 50 ARG HG2 . 17278 1 561 . 1 1 50 50 ARG HG3 H 1 1.044 0.020 . 1 . . . . 50 ARG HG3 . 17278 1 562 . 1 1 50 50 ARG C C 13 178.740 0.3 . 1 . . . . 50 ARG C . 17278 1 563 . 1 1 50 50 ARG CA C 13 59.727 0.3 . 1 . . . . 50 ARG CA . 17278 1 564 . 1 1 50 50 ARG CB C 13 30.619 0.3 . 1 . . . . 50 ARG CB . 17278 1 565 . 1 1 50 50 ARG CD C 13 43.301 0.3 . 1 . . . . 50 ARG CD . 17278 1 566 . 1 1 50 50 ARG CG C 13 30.100 0.3 . 1 . . . . 50 ARG CG . 17278 1 567 . 1 1 50 50 ARG N N 15 115.210 0.3 . 1 . . . . 50 ARG N . 17278 1 568 . 1 1 51 51 GLY H H 1 7.234 0.020 . 1 . . . . 51 GLY H . 17278 1 569 . 1 1 51 51 GLY HA2 H 1 3.658 0.020 . 2 . . . . 51 GLY HA2 . 17278 1 570 . 1 1 51 51 GLY HA3 H 1 3.513 0.020 . 2 . . . . 51 GLY HA3 . 17278 1 571 . 1 1 51 51 GLY C C 13 173.711 0.3 . 1 . . . . 51 GLY C . 17278 1 572 . 1 1 51 51 GLY CA C 13 45.546 0.3 . 1 . . . . 51 GLY CA . 17278 1 573 . 1 1 51 51 GLY N N 15 103.257 0.3 . 1 . . . . 51 GLY N . 17278 1 574 . 1 1 52 52 ALA H H 1 6.980 0.020 . 1 . . . . 52 ALA H . 17278 1 575 . 1 1 52 52 ALA HA H 1 4.082 0.020 . 1 . . . . 52 ALA HA . 17278 1 576 . 1 1 52 52 ALA HB1 H 1 0.992 0.020 . 1 . . . . 52 ALA HB . 17278 1 577 . 1 1 52 52 ALA HB2 H 1 0.992 0.020 . 1 . . . . 52 ALA HB . 17278 1 578 . 1 1 52 52 ALA HB3 H 1 0.992 0.020 . 1 . . . . 52 ALA HB . 17278 1 579 . 1 1 52 52 ALA C C 13 176.262 0.3 . 1 . . . . 52 ALA C . 17278 1 580 . 1 1 52 52 ALA CA C 13 51.366 0.3 . 1 . . . . 52 ALA CA . 17278 1 581 . 1 1 52 52 ALA CB C 13 19.872 0.3 . 1 . . . . 52 ALA CB . 17278 1 582 . 1 1 52 52 ALA N N 15 122.382 0.3 . 1 . . . . 52 ALA N . 17278 1 583 . 1 1 53 53 LEU H H 1 6.390 0.020 . 1 . . . . 53 LEU H . 17278 1 584 . 1 1 53 53 LEU HD11 H 1 0.704 0.020 . 1 . . . . 53 LEU HD1 . 17278 1 585 . 1 1 53 53 LEU HD12 H 1 0.704 0.020 . 1 . . . . 53 LEU HD1 . 17278 1 586 . 1 1 53 53 LEU HD13 H 1 0.704 0.020 . 1 . . . . 53 LEU HD1 . 17278 1 587 . 1 1 53 53 LEU HD21 H 1 0.704 0.020 . 1 . . . . 53 LEU HD2 . 17278 1 588 . 1 1 53 53 LEU HD22 H 1 0.704 0.020 . 1 . . . . 53 LEU HD2 . 17278 1 589 . 1 1 53 53 LEU HD23 H 1 0.704 0.020 . 1 . . . . 53 LEU HD2 . 17278 1 590 . 1 1 53 53 LEU HG H 1 1.271 0.020 . 1 . . . . 53 LEU HG . 17278 1 591 . 1 1 53 53 LEU C C 13 174.195 0.3 . 1 . . . . 53 LEU C . 17278 1 592 . 1 1 53 53 LEU CA C 13 51.110 0.3 . 1 . . . . 53 LEU CA . 17278 1 593 . 1 1 53 53 LEU CB C 13 38.761 0.3 . 1 . . . . 53 LEU CB . 17278 1 594 . 1 1 53 53 LEU N N 15 119.499 0.3 . 1 . . . . 53 LEU N . 17278 1 595 . 1 1 54 54 PRO HA H 1 4.464 0.020 . 1 . . . . 54 PRO HA . 17278 1 596 . 1 1 54 54 PRO HB2 H 1 2.246 0.020 . 1 . . . . 54 PRO HB2 . 17278 1 597 . 1 1 54 54 PRO HB3 H 1 2.246 0.020 . 1 . . . . 54 PRO HB3 . 17278 1 598 . 1 1 54 54 PRO HD2 H 1 3.856 0.020 . 1 . . . . 54 PRO HD2 . 17278 1 599 . 1 1 54 54 PRO HD3 H 1 3.856 0.020 . 1 . . . . 54 PRO HD3 . 17278 1 600 . 1 1 54 54 PRO HG2 H 1 1.955 0.020 . 1 . . . . 54 PRO HG2 . 17278 1 601 . 1 1 54 54 PRO HG3 H 1 1.955 0.020 . 2 . . . . 54 PRO HG3 . 17278 1 602 . 1 1 54 54 PRO C C 13 177.231 0.3 . 1 . . . . 54 PRO C . 17278 1 603 . 1 1 54 54 PRO CA C 13 61.898 0.3 . 1 . . . . 54 PRO CA . 17278 1 604 . 1 1 54 54 PRO CB C 13 31.908 0.3 . 1 . . . . 54 PRO CB . 17278 1 605 . 1 1 54 54 PRO CD C 13 50.538 0.3 . 1 . . . . 54 PRO CD . 17278 1 606 . 1 1 54 54 PRO CG C 13 26.564 0.3 . 1 . . . . 54 PRO CG . 17278 1 607 . 1 1 55 55 ALA H H 1 8.703 0.020 . 1 . . . . 55 ALA H . 17278 1 608 . 1 1 55 55 ALA HA H 1 4.239 0.020 . 1 . . . . 55 ALA HA . 17278 1 609 . 1 1 55 55 ALA HB1 H 1 1.414 0.020 . 1 . . . . 55 ALA HB . 17278 1 610 . 1 1 55 55 ALA HB2 H 1 1.414 0.020 . 1 . . . . 55 ALA HB . 17278 1 611 . 1 1 55 55 ALA HB3 H 1 1.414 0.020 . 1 . . . . 55 ALA HB . 17278 1 612 . 1 1 55 55 ALA C C 13 178.125 0.3 . 1 . . . . 55 ALA C . 17278 1 613 . 1 1 55 55 ALA CA C 13 54.774 0.3 . 1 . . . . 55 ALA CA . 17278 1 614 . 1 1 55 55 ALA CB C 13 18.880 0.3 . 1 . . . . 55 ALA CB . 17278 1 615 . 1 1 55 55 ALA N N 15 123.014 0.3 . 1 . . . . 55 ALA N . 17278 1 616 . 1 1 56 56 ASN H H 1 7.972 0.020 . 1 . . . . 56 ASN H . 17278 1 617 . 1 1 56 56 ASN HA H 1 4.556 0.020 . 1 . . . . 56 ASN HA . 17278 1 618 . 1 1 56 56 ASN HB2 H 1 2.847 0.020 . 2 . . . . 56 ASN HB2 . 17278 1 619 . 1 1 56 56 ASN HB3 H 1 2.741 0.020 . 2 . . . . 56 ASN HB3 . 17278 1 620 . 1 1 56 56 ASN C C 13 173.469 0.3 . 1 . . . . 56 ASN C . 17278 1 621 . 1 1 56 56 ASN CA C 13 51.449 0.3 . 1 . . . . 56 ASN CA . 17278 1 622 . 1 1 56 56 ASN CB C 13 39.032 0.3 . 1 . . . . 56 ASN CB . 17278 1 623 . 1 1 56 56 ASN N N 15 109.866 0.3 . 1 . . . . 56 ASN N . 17278 1 624 . 1 1 57 57 ASP H H 1 7.343 0.020 . 1 . . . . 57 ASP H . 17278 1 625 . 1 1 57 57 ASP HA H 1 4.769 0.020 . 1 . . . . 57 ASP HA . 17278 1 626 . 1 1 57 57 ASP HB2 H 1 2.576 0.020 . 2 . . . . 57 ASP HB2 . 17278 1 627 . 1 1 57 57 ASP HB3 H 1 2.312 0.020 . 2 . . . . 57 ASP HB3 . 17278 1 628 . 1 1 57 57 ASP C C 13 172.779 0.3 . 1 . . . . 57 ASP C . 17278 1 629 . 1 1 57 57 ASP CA C 13 52.060 0.3 . 1 . . . . 57 ASP CA . 17278 1 630 . 1 1 57 57 ASP CB C 13 44.325 0.3 . 1 . . . . 57 ASP CB . 17278 1 631 . 1 1 57 57 ASP N N 15 115.772 0.3 . 1 . . . . 57 ASP N . 17278 1 632 . 1 1 58 58 CYS H H 1 7.968 0.020 . 1 . . . . 58 CYS H . 17278 1 633 . 1 1 58 58 CYS HA H 1 4.559 0.020 . 1 . . . . 58 CYS HA . 17278 1 634 . 1 1 58 58 CYS HB2 H 1 2.061 0.020 . 2 . . . . 58 CYS HB2 . 17278 1 635 . 1 1 58 58 CYS HB3 H 1 1.493 0.020 . 2 . . . . 58 CYS HB3 . 17278 1 636 . 1 1 58 58 CYS C C 13 173.748 0.3 . 1 . . . . 58 CYS C . 17278 1 637 . 1 1 58 58 CYS CA C 13 57.013 0.3 . 1 . . . . 58 CYS CA . 17278 1 638 . 1 1 58 58 CYS CB C 13 29.669 0.3 . 1 . . . . 58 CYS CB . 17278 1 639 . 1 1 58 58 CYS N N 15 115.913 0.3 . 1 . . . . 58 CYS N . 17278 1 640 . 1 1 59 59 ARG H H 1 8.937 0.020 . 1 . . . . 59 ARG H . 17278 1 641 . 1 1 59 59 ARG HA H 1 4.688 0.020 . 1 . . . . 59 ARG HA . 17278 1 642 . 1 1 59 59 ARG HB2 H 1 1.599 0.020 . 2 . . . . 59 ARG HB2 . 17278 1 643 . 1 1 59 59 ARG HB3 H 1 1.593 0.020 . 2 . . . . 59 ARG HB3 . 17278 1 644 . 1 1 59 59 ARG HD2 H 1 2.415 0.020 . 2 . . . . 59 ARG HD2 . 17278 1 645 . 1 1 59 59 ARG HD3 H 1 2.391 0.020 . 2 . . . . 59 ARG HD3 . 17278 1 646 . 1 1 59 59 ARG HG2 H 1 1.284 0.020 . 2 . . . . 59 ARG HG2 . 17278 1 647 . 1 1 59 59 ARG HG3 H 1 1.290 0.020 . 2 . . . . 59 ARG HG3 . 17278 1 648 . 1 1 59 59 ARG C C 13 175.312 0.3 . 1 . . . . 59 ARG C . 17278 1 649 . 1 1 59 59 ARG CA C 13 54.095 0.3 . 1 . . . . 59 ARG CA . 17278 1 650 . 1 1 59 59 ARG CB C 13 38.218 0.3 . 1 . . . . 59 ARG CB . 17278 1 651 . 1 1 59 59 ARG CD C 13 38.099 0.3 . 1 . . . . 59 ARG CD . 17278 1 652 . 1 1 59 59 ARG CG C 13 29.504 0.3 . 1 . . . . 59 ARG CG . 17278 1 653 . 1 1 59 59 ARG N N 15 116.475 0.3 . 1 . . . . 59 ARG N . 17278 1 654 . 1 1 60 60 PHE H H 1 8.351 0.020 . 1 . . . . 60 PHE H . 17278 1 655 . 1 1 60 60 PHE HA H 1 5.903 0.020 . 1 . . . . 60 PHE HA . 17278 1 656 . 1 1 60 60 PHE HB2 H 1 3.315 0.020 . 2 . . . . 60 PHE HB2 . 17278 1 657 . 1 1 60 60 PHE HB3 H 1 2.998 0.020 . 2 . . . . 60 PHE HB3 . 17278 1 658 . 1 1 60 60 PHE HD1 H 1 7.179 0.020 . 1 . . . . 60 PHE HD1 . 17278 1 659 . 1 1 60 60 PHE HD2 H 1 7.179 0.020 . 1 . . . . 60 PHE HD2 . 17278 1 660 . 1 1 60 60 PHE HE1 H 1 7.226 0.020 . 1 . . . . 60 PHE HE1 . 17278 1 661 . 1 1 60 60 PHE HE2 H 1 7.226 0.020 . 1 . . . . 60 PHE HE2 . 17278 1 662 . 1 1 60 60 PHE C C 13 175.945 0.3 . 1 . . . . 60 PHE C . 17278 1 663 . 1 1 60 60 PHE CA C 13 54.977 0.3 . 1 . . . . 60 PHE CA . 17278 1 664 . 1 1 60 60 PHE CB C 13 42.764 0.3 . 1 . . . . 60 PHE CB . 17278 1 665 . 1 1 60 60 PHE CD1 C 13 133.179 0.3 . 1 . . . . 60 PHE CD1 . 17278 1 666 . 1 1 60 60 PHE CD2 C 13 133.179 0.3 . 1 . . . . 60 PHE CD2 . 17278 1 667 . 1 1 60 60 PHE CE1 C 13 130.638 0.3 . 1 . . . . 60 PHE CE1 . 17278 1 668 . 1 1 60 60 PHE CE2 C 13 130.638 0.3 . 1 . . . . 60 PHE CE2 . 17278 1 669 . 1 1 60 60 PHE N N 15 114.718 0.3 . 1 . . . . 60 PHE N . 17278 1 670 . 1 1 61 61 GLY H H 1 9.457 0.020 . 1 . . . . 61 GLY H . 17278 1 671 . 1 1 61 61 GLY HA2 H 1 5.959 0.020 . 2 . . . . 61 GLY HA2 . 17278 1 672 . 1 1 61 61 GLY HA3 H 1 3.962 0.020 . 2 . . . . 61 GLY HA3 . 17278 1 673 . 1 1 61 61 GLY C C 13 171.567 0.3 . 1 . . . . 61 GLY C . 17278 1 674 . 1 1 61 61 GLY CA C 13 45.885 0.3 . 1 . . . . 61 GLY CA . 17278 1 675 . 1 1 61 61 GLY N N 15 107.968 0.3 . 1 . . . . 61 GLY N . 17278 1 676 . 1 1 62 62 VAL H H 1 9.191 0.020 . 1 . . . . 62 VAL H . 17278 1 677 . 1 1 62 62 VAL HA H 1 5.691 0.020 . 1 . . . . 62 VAL HA . 17278 1 678 . 1 1 62 62 VAL HB H 1 2.035 0.020 . 1 . . . . 62 VAL HB . 17278 1 679 . 1 1 62 62 VAL HG11 H 1 1.163 0.020 . 1 . . . . 62 VAL HG1 . 17278 1 680 . 1 1 62 62 VAL HG12 H 1 1.163 0.020 . 1 . . . . 62 VAL HG1 . 17278 1 681 . 1 1 62 62 VAL HG13 H 1 1.163 0.020 . 1 . . . . 62 VAL HG1 . 17278 1 682 . 1 1 62 62 VAL HG21 H 1 1.176 0.020 . 1 . . . . 62 VAL HG2 . 17278 1 683 . 1 1 62 62 VAL HG22 H 1 1.176 0.020 . 1 . . . . 62 VAL HG2 . 17278 1 684 . 1 1 62 62 VAL HG23 H 1 1.176 0.020 . 1 . . . . 62 VAL HG2 . 17278 1 685 . 1 1 62 62 VAL C C 13 173.113 0.3 . 1 . . . . 62 VAL C . 17278 1 686 . 1 1 62 62 VAL CA C 13 59.252 0.3 . 1 . . . . 62 VAL CA . 17278 1 687 . 1 1 62 62 VAL CB C 13 35.911 0.3 . 1 . . . . 62 VAL CB . 17278 1 688 . 1 1 62 62 VAL CG1 C 13 23.398 0.3 . 1 . . . . 62 VAL CG1 . 17278 1 689 . 1 1 62 62 VAL CG2 C 13 20.910 0.3 . 1 . . . . 62 VAL CG2 . 17278 1 690 . 1 1 62 62 VAL N N 15 113.311 0.3 . 1 . . . . 62 VAL N . 17278 1 691 . 1 1 63 63 TYR H H 1 8.238 0.020 . 1 . . . . 63 TYR H . 17278 1 692 . 1 1 63 63 TYR HA H 1 4.689 0.020 . 1 . . . . 63 TYR HA . 17278 1 693 . 1 1 63 63 TYR HB2 H 1 2.285 0.020 . 2 . . . . 63 TYR HB2 . 17278 1 694 . 1 1 63 63 TYR HB3 H 1 1.599 0.020 . 2 . . . . 63 TYR HB3 . 17278 1 695 . 1 1 63 63 TYR HD1 H 1 6.628 0.020 . 1 . . . . 63 TYR HD1 . 17278 1 696 . 1 1 63 63 TYR HD2 H 1 6.628 0.020 . 1 . . . . 63 TYR HD2 . 17278 1 697 . 1 1 63 63 TYR HE1 H 1 6.665 0.020 . 1 . . . . 63 TYR HE1 . 17278 1 698 . 1 1 63 63 TYR HE2 H 1 6.665 0.020 . 1 . . . . 63 TYR HE2 . 17278 1 699 . 1 1 63 63 TYR C C 13 173.747 0.3 . 1 . . . . 63 TYR C . 17278 1 700 . 1 1 63 63 TYR CA C 13 57.488 0.3 . 1 . . . . 63 TYR CA . 17278 1 701 . 1 1 63 63 TYR CB C 13 42.493 0.3 . 1 . . . . 63 TYR CB . 17278 1 702 . 1 1 63 63 TYR CD1 C 13 131.902 0.3 . 1 . . . . 63 TYR CD1 . 17278 1 703 . 1 1 63 63 TYR CD2 C 13 131.902 0.3 . 1 . . . . 63 TYR CD2 . 17278 1 704 . 1 1 63 63 TYR CE1 C 13 117.728 0.3 . 1 . . . . 63 TYR CE1 . 17278 1 705 . 1 1 63 63 TYR CE2 C 13 117.728 0.3 . 1 . . . . 63 TYR CE2 . 17278 1 706 . 1 1 63 63 TYR N N 15 121.538 0.3 . 1 . . . . 63 TYR N . 17278 1 707 . 1 1 64 64 ASP H H 1 8.332 0.020 . 1 . . . . 64 ASP H . 17278 1 708 . 1 1 64 64 ASP HA H 1 4.531 0.020 . 1 . . . . 64 ASP HA . 17278 1 709 . 1 1 64 64 ASP HB2 H 1 2.932 0.020 . 2 . . . . 64 ASP HB2 . 17278 1 710 . 1 1 64 64 ASP HB3 H 1 2.180 0.020 . 2 . . . . 64 ASP HB3 . 17278 1 711 . 1 1 64 64 ASP C C 13 174.045 0.3 . 1 . . . . 64 ASP C . 17278 1 712 . 1 1 64 64 ASP CA C 13 54.231 0.3 . 1 . . . . 64 ASP CA . 17278 1 713 . 1 1 64 64 ASP CB C 13 40.525 0.3 . 1 . . . . 64 ASP CB . 17278 1 714 . 1 1 64 64 ASP N N 15 127.022 0.3 . 1 . . . . 64 ASP N . 17278 1 715 . 1 1 65 65 CYS H H 1 8.535 0.020 . 1 . . . . 65 CYS H . 17278 1 716 . 1 1 65 65 CYS HA H 1 4.572 0.020 . 1 . . . . 65 CYS HA . 17278 1 717 . 1 1 65 65 CYS HB2 H 1 3.553 0.020 . 2 . . . . 65 CYS HB2 . 17278 1 718 . 1 1 65 65 CYS HB3 H 1 3.130 0.020 . 2 . . . . 65 CYS HB3 . 17278 1 719 . 1 1 65 65 CYS C C 13 175.610 0.3 . 1 . . . . 65 CYS C . 17278 1 720 . 1 1 65 65 CYS CA C 13 59.388 0.3 . 1 . . . . 65 CYS CA . 17278 1 721 . 1 1 65 65 CYS CB C 13 28.990 0.3 . 1 . . . . 65 CYS CB . 17278 1 722 . 1 1 65 65 CYS N N 15 123.647 0.3 . 1 . . . . 65 CYS N . 17278 1 723 . 1 1 66 66 GLY H H 1 9.043 0.020 . 1 . . . . 66 GLY H . 17278 1 724 . 1 1 66 66 GLY C C 13 175.274 0.3 . 1 . . . . 66 GLY C . 17278 1 725 . 1 1 66 66 GLY CA C 13 46.360 0.3 . 1 . . . . 66 GLY CA . 17278 1 726 . 1 1 66 66 GLY N N 15 113.241 0.3 . 1 . . . . 66 GLY N . 17278 1 727 . 1 1 67 67 ASN HA H 1 5.335 0.020 . 1 . . . . 67 ASN HA . 17278 1 728 . 1 1 67 67 ASN HB2 H 1 2.972 0.020 . 2 . . . . 67 ASN HB2 . 17278 1 729 . 1 1 67 67 ASN HB3 H 1 2.800 0.020 . 2 . . . . 67 ASN HB3 . 17278 1 730 . 1 1 67 67 ASN C C 13 174.268 0.3 . 1 . . . . 67 ASN C . 17278 1 731 . 1 1 67 67 ASN CA C 13 52.874 0.3 . 1 . . . . 67 ASN CA . 17278 1 732 . 1 1 67 67 ASN CB C 13 37.743 0.3 . 1 . . . . 67 ASN CB . 17278 1 733 . 1 1 68 68 LYS H H 1 7.402 0.020 . 1 . . . . 68 LYS H . 17278 1 734 . 1 1 68 68 LYS HA H 1 4.516 0.020 . 1 . . . . 68 LYS HA . 17278 1 735 . 1 1 68 68 LYS HB2 H 1 2.037 0.020 . 2 . . . . 68 LYS HB2 . 17278 1 736 . 1 1 68 68 LYS HB3 H 1 1.630 0.020 . 2 . . . . 68 LYS HB3 . 17278 1 737 . 1 1 68 68 LYS HD2 H 1 1.630 0.020 . 1 . . . . 68 LYS HD2 . 17278 1 738 . 1 1 68 68 LYS HD3 H 1 1.630 0.020 . 1 . . . . 68 LYS HD3 . 17278 1 739 . 1 1 68 68 LYS HE2 H 1 3.065 0.020 . 2 . . . . 68 LYS HE2 . 17278 1 740 . 1 1 68 68 LYS HE3 H 1 3.065 0.020 . 2 . . . . 68 LYS HE3 . 17278 1 741 . 1 1 68 68 LYS HG2 H 1 1.345 0.020 . 1 . . . . 68 LYS HG2 . 17278 1 742 . 1 1 68 68 LYS HG3 H 1 1.345 0.020 . 1 . . . . 68 LYS HG3 . 17278 1 743 . 1 1 68 68 LYS C C 13 173.393 0.3 . 1 . . . . 68 LYS C . 17278 1 744 . 1 1 68 68 LYS CA C 13 55.317 0.3 . 1 . . . . 68 LYS CA . 17278 1 745 . 1 1 68 68 LYS CB C 13 34.079 0.3 . 1 . . . . 68 LYS CB . 17278 1 746 . 1 1 68 68 LYS CD C 13 29.730 0.3 . 1 . . . . 68 LYS CD . 17278 1 747 . 1 1 68 68 LYS CE C 13 42.924 0.3 . 1 . . . . 68 LYS CE . 17278 1 748 . 1 1 68 68 LYS CG C 13 23.021 0.3 . 1 . . . . 68 LYS CG . 17278 1 749 . 1 1 68 68 LYS N N 15 115.280 0.3 . 1 . . . . 68 LYS N . 17278 1 750 . 1 1 69 69 ILE H H 1 9.226 0.020 . 1 . . . . 69 ILE H . 17278 1 751 . 1 1 69 69 ILE HA H 1 4.490 0.020 . 1 . . . . 69 ILE HA . 17278 1 752 . 1 1 69 69 ILE HB H 1 1.862 0.020 . 1 . . . . 69 ILE HB . 17278 1 753 . 1 1 69 69 ILE HD11 H 1 0.635 0.020 . 1 . . . . 69 ILE HD1 . 17278 1 754 . 1 1 69 69 ILE HD12 H 1 0.635 0.020 . 1 . . . . 69 ILE HD1 . 17278 1 755 . 1 1 69 69 ILE HD13 H 1 0.635 0.020 . 1 . . . . 69 ILE HD1 . 17278 1 756 . 1 1 69 69 ILE HG12 H 1 1.575 0.020 . 2 . . . . 69 ILE HG12 . 17278 1 757 . 1 1 69 69 ILE HG13 H 1 1.572 0.020 . 2 . . . . 69 ILE HG13 . 17278 1 758 . 1 1 69 69 ILE HG21 H 1 0.833 0.020 . 1 . . . . 69 ILE HG2 . 17278 1 759 . 1 1 69 69 ILE HG22 H 1 0.833 0.020 . 1 . . . . 69 ILE HG2 . 17278 1 760 . 1 1 69 69 ILE HG23 H 1 0.833 0.020 . 1 . . . . 69 ILE HG2 . 17278 1 761 . 1 1 69 69 ILE C C 13 174.678 0.3 . 1 . . . . 69 ILE C . 17278 1 762 . 1 1 69 69 ILE CA C 13 61.031 0.3 . 1 . . . . 69 ILE CA . 17278 1 763 . 1 1 69 69 ILE CB C 13 38.728 0.3 . 1 . . . . 69 ILE CB . 17278 1 764 . 1 1 69 69 ILE CD1 C 13 13.823 0.3 . 1 . . . . 69 ILE CD1 . 17278 1 765 . 1 1 69 69 ILE CG1 C 13 27.243 0.3 . 1 . . . . 69 ILE CG1 . 17278 1 766 . 1 1 69 69 ILE CG2 C 13 18.874 0.3 . 1 . . . . 69 ILE CG2 . 17278 1 767 . 1 1 69 69 ILE N N 15 122.733 0.3 . 1 . . . . 69 ILE N . 17278 1 768 . 1 1 70 70 GLN H H 1 8.816 0.020 . 1 . . . . 70 GLN H . 17278 1 769 . 1 1 70 70 GLN HA H 1 4.450 0.020 . 1 . . . . 70 GLN HA . 17278 1 770 . 1 1 70 70 GLN HB2 H 1 2.262 0.020 . 2 . . . . 70 GLN HB2 . 17278 1 771 . 1 1 70 70 GLN HB3 H 1 1.982 0.020 . 2 . . . . 70 GLN HB3 . 17278 1 772 . 1 1 70 70 GLN HG2 H 1 2.167 0.020 . 1 . . . . 70 GLN HG2 . 17278 1 773 . 1 1 70 70 GLN HG3 H 1 2.167 0.020 . 1 . . . . 70 GLN HG3 . 17278 1 774 . 1 1 70 70 GLN C C 13 175.162 0.3 . 1 . . . . 70 GLN C . 17278 1 775 . 1 1 70 70 GLN CA C 13 55.181 0.3 . 1 . . . . 70 GLN CA . 17278 1 776 . 1 1 70 70 GLN CB C 13 32.179 0.3 . 1 . . . . 70 GLN CB . 17278 1 777 . 1 1 70 70 GLN CG C 13 34.320 0.3 . 1 . . . . 70 GLN CG . 17278 1 778 . 1 1 70 70 GLN N N 15 126.249 0.3 . 1 . . . . 70 GLN N . 17278 1 779 . 1 1 71 71 PHE H H 1 8.951 0.020 . 1 . . . . 71 PHE H . 17278 1 780 . 1 1 71 71 PHE HA H 1 5.353 0.020 . 1 . . . . 71 PHE HA . 17278 1 781 . 1 1 71 71 PHE HB2 H 1 2.998 0.020 . 1 . . . . 71 PHE HB2 . 17278 1 782 . 1 1 71 71 PHE HB3 H 1 2.998 0.020 . 1 . . . . 71 PHE HB3 . 17278 1 783 . 1 1 71 71 PHE HD1 H 1 6.989 0.020 . 1 . . . . 71 PHE HD1 . 17278 1 784 . 1 1 71 71 PHE HD2 H 1 6.989 0.020 . 1 . . . . 71 PHE HD2 . 17278 1 785 . 1 1 71 71 PHE HE1 H 1 6.989 0.020 . 3 . . . . 71 PHE HE1 . 17278 1 786 . 1 1 71 71 PHE HE2 H 1 7.008 0.020 . 3 . . . . 71 PHE HE2 . 17278 1 787 . 1 1 71 71 PHE C C 13 175.591 0.3 . 1 . . . . 71 PHE C . 17278 1 788 . 1 1 71 71 PHE CA C 13 57.895 0.3 . 1 . . . . 71 PHE CA . 17278 1 789 . 1 1 71 71 PHE CB C 13 41.068 0.3 . 1 . . . . 71 PHE CB . 17278 1 790 . 1 1 71 71 PHE CD1 C 13 132.207 0.3 . 1 . . . . 71 PHE CD1 . 17278 1 791 . 1 1 71 71 PHE CD2 C 13 132.207 0.3 . 1 . . . . 71 PHE CD2 . 17278 1 792 . 1 1 71 71 PHE CE1 C 13 132.207 0.3 . 1 . . . . 71 PHE CE1 . 17278 1 793 . 1 1 71 71 PHE N N 15 128.746 0.3 . 1 . . . . 71 PHE N . 17278 1 794 . 1 1 72 72 VAL H H 1 9.492 0.020 . 1 . . . . 72 VAL H . 17278 1 795 . 1 1 72 72 VAL HA H 1 4.936 0.020 . 1 . . . . 72 VAL HA . 17278 1 796 . 1 1 72 72 VAL HB H 1 1.845 0.020 . 1 . . . . 72 VAL HB . 17278 1 797 . 1 1 72 72 VAL HG11 H 1 1.005 0.020 . 1 . . . . 72 VAL HG1 . 17278 1 798 . 1 1 72 72 VAL HG12 H 1 1.005 0.020 . 1 . . . . 72 VAL HG1 . 17278 1 799 . 1 1 72 72 VAL HG13 H 1 1.005 0.020 . 1 . . . . 72 VAL HG1 . 17278 1 800 . 1 1 72 72 VAL HG21 H 1 1.005 0.020 . 1 . . . . 72 VAL HG2 . 17278 1 801 . 1 1 72 72 VAL HG22 H 1 1.005 0.020 . 1 . . . . 72 VAL HG2 . 17278 1 802 . 1 1 72 72 VAL HG23 H 1 1.005 0.020 . 1 . . . . 72 VAL HG2 . 17278 1 803 . 1 1 72 72 VAL C C 13 173.449 0.3 . 1 . . . . 72 VAL C . 17278 1 804 . 1 1 72 72 VAL CA C 13 61.287 0.3 . 1 . . . . 72 VAL CA . 17278 1 805 . 1 1 72 72 VAL CB C 13 36.861 0.3 . 1 . . . . 72 VAL CB . 17278 1 806 . 1 1 72 72 VAL CG1 C 13 20.830 0.3 . 1 . . . . 72 VAL CG1 . 17278 1 807 . 1 1 72 72 VAL CG2 C 13 20.830 0.3 . 1 . . . . 72 VAL CG2 . 17278 1 808 . 1 1 72 72 VAL N N 15 131.100 0.3 . 1 . . . . 72 VAL N . 17278 1 809 . 1 1 73 73 LEU H H 1 9.183 0.020 . 1 . . . . 73 LEU H . 17278 1 810 . 1 1 73 73 LEU HA H 1 4.992 0.020 . 1 . . . . 73 LEU HA . 17278 1 811 . 1 1 73 73 LEU HB2 H 1 2.100 0.020 . 2 . . . . 73 LEU HB2 . 17278 1 812 . 1 1 73 73 LEU HB3 H 1 1.314 0.020 . 2 . . . . 73 LEU HB3 . 17278 1 813 . 1 1 73 73 LEU HD11 H 1 1.018 0.020 . 1 . . . . 73 LEU HD1 . 17278 1 814 . 1 1 73 73 LEU HD12 H 1 1.018 0.020 . 1 . . . . 73 LEU HD1 . 17278 1 815 . 1 1 73 73 LEU HD13 H 1 1.018 0.020 . 1 . . . . 73 LEU HD1 . 17278 1 816 . 1 1 73 73 LEU HD21 H 1 1.018 0.020 . 1 . . . . 73 LEU HD2 . 17278 1 817 . 1 1 73 73 LEU HD22 H 1 1.018 0.020 . 1 . . . . 73 LEU HD2 . 17278 1 818 . 1 1 73 73 LEU HD23 H 1 1.018 0.020 . 1 . . . . 73 LEU HD2 . 17278 1 819 . 1 1 73 73 LEU HG H 1 1.747 0.020 . 1 . . . . 73 LEU HG . 17278 1 820 . 1 1 73 73 LEU C C 13 172.797 0.3 . 1 . . . . 73 LEU C . 17278 1 821 . 1 1 73 73 LEU CA C 13 54.163 0.3 . 1 . . . . 73 LEU CA . 17278 1 822 . 1 1 73 73 LEU CB C 13 44.393 0.3 . 1 . . . . 73 LEU CB . 17278 1 823 . 1 1 73 73 LEU CD1 C 13 24.755 0.3 . 1 . . . . 73 LEU CD1 . 17278 1 824 . 1 1 73 73 LEU CD2 C 13 24.755 0.3 . 1 . . . . 73 LEU CD2 . 17278 1 825 . 1 1 73 73 LEU CG C 13 27.243 0.3 . 1 . . . . 73 LEU CG . 17278 1 826 . 1 1 73 73 LEU N N 15 128.569 0.3 . 1 . . . . 73 LEU N . 17278 1 827 . 1 1 74 74 TRP H H 1 8.871 0.020 . 1 . . . . 74 TRP H . 17278 1 828 . 1 1 74 74 TRP HA H 1 5.144 0.020 . 1 . . . . 74 TRP HA . 17278 1 829 . 1 1 74 74 TRP HB2 H 1 3.157 0.020 . 2 . . . . 74 TRP HB2 . 17278 1 830 . 1 1 74 74 TRP HB3 H 1 2.594 0.020 . 2 . . . . 74 TRP HB3 . 17278 1 831 . 1 1 74 74 TRP C C 13 172.797 0.3 . 1 . . . . 74 TRP C . 17278 1 832 . 1 1 74 74 TRP CA C 13 55.181 0.3 . 1 . . . . 74 TRP CA . 17278 1 833 . 1 1 74 74 TRP CB C 13 30.279 0.3 . 1 . . . . 74 TRP CB . 17278 1 834 . 1 1 74 74 TRP N N 15 129.694 0.3 . 1 . . . . 74 TRP N . 17278 1 835 . 1 1 75 75 CYS H H 1 8.148 0.020 . 1 . . . . 75 CYS H . 17278 1 836 . 1 1 75 75 CYS C C 13 170.263 0.3 . 1 . . . . 75 CYS C . 17278 1 837 . 1 1 75 75 CYS CA C 13 53.688 0.3 . 1 . . . . 75 CYS CA . 17278 1 838 . 1 1 75 75 CYS CB C 13 28.651 0.3 . 1 . . . . 75 CYS CB . 17278 1 839 . 1 1 75 75 CYS N N 15 124.210 0.3 . 1 . . . . 75 CYS N . 17278 1 840 . 1 1 76 76 PRO HA H 1 4.318 0.020 . 1 . . . . 76 PRO HA . 17278 1 841 . 1 1 76 76 PRO HB2 H 1 2.021 0.020 . 1 . . . . 76 PRO HB2 . 17278 1 842 . 1 1 76 76 PRO HB3 H 1 2.021 0.020 . 1 . . . . 76 PRO HB3 . 17278 1 843 . 1 1 76 76 PRO HD2 H 1 3.896 0.020 . 1 . . . . 76 PRO HD2 . 17278 1 844 . 1 1 76 76 PRO HD3 H 1 3.896 0.020 . 1 . . . . 76 PRO HD3 . 17278 1 845 . 1 1 76 76 PRO HG2 H 1 1.638 0.020 . 1 . . . . 76 PRO HG2 . 17278 1 846 . 1 1 76 76 PRO HG3 H 1 1.638 0.020 . 1 . . . . 76 PRO HG3 . 17278 1 847 . 1 1 76 76 PRO C C 13 177.808 0.3 . 1 . . . . 76 PRO C . 17278 1 848 . 1 1 76 76 PRO CA C 13 61.966 0.3 . 1 . . . . 76 PRO CA . 17278 1 849 . 1 1 76 76 PRO CB C 13 31.569 0.3 . 1 . . . . 76 PRO CB . 17278 1 850 . 1 1 76 76 PRO CD C 13 47.070 0.3 . 1 . . . . 76 PRO CD . 17278 1 851 . 1 1 76 76 PRO CG C 13 27.770 0.3 . 1 . . . . 76 PRO CG . 17278 1 852 . 1 1 77 77 ASP H H 1 7.812 0.020 . 1 . . . . 77 ASP H . 17278 1 853 . 1 1 77 77 ASP HA H 1 4.559 0.020 . 1 . . . . 77 ASP HA . 17278 1 854 . 1 1 77 77 ASP HB2 H 1 2.932 0.020 . 1 . . . . 77 ASP HB2 . 17278 1 855 . 1 1 77 77 ASP HB3 H 1 2.932 0.020 . 1 . . . . 77 ASP HB3 . 17278 1 856 . 1 1 77 77 ASP C C 13 176.542 0.3 . 1 . . . . 77 ASP C . 17278 1 857 . 1 1 77 77 ASP CA C 13 56.741 0.3 . 1 . . . . 77 ASP CA . 17278 1 858 . 1 1 77 77 ASP CB C 13 41.475 0.3 . 1 . . . . 77 ASP CB . 17278 1 859 . 1 1 77 77 ASP N N 15 120.132 0.3 . 1 . . . . 77 ASP N . 17278 1 860 . 1 1 78 78 ASN H H 1 7.812 0.020 . 1 . . . . 78 ASN H . 17278 1 861 . 1 1 78 78 ASN HA H 1 4.424 0.020 . 1 . . . . 78 ASN HA . 17278 1 862 . 1 1 78 78 ASN HB2 H 1 1.850 0.020 . 2 . . . . 78 ASN HB2 . 17278 1 863 . 1 1 78 78 ASN HB3 H 1 1.533 0.020 . 2 . . . . 78 ASN HB3 . 17278 1 864 . 1 1 78 78 ASN C C 13 176.877 0.3 . 1 . . . . 78 ASN C . 17278 1 865 . 1 1 78 78 ASN CA C 13 53.349 0.3 . 1 . . . . 78 ASN CA . 17278 1 866 . 1 1 78 78 ASN CB C 13 41.543 0.3 . 1 . . . . 78 ASN CB . 17278 1 867 . 1 1 78 78 ASN N N 15 114.296 0.3 . 1 . . . . 78 ASN N . 17278 1 868 . 1 1 79 79 ALA H H 1 7.375 0.020 . 1 . . . . 79 ALA H . 17278 1 869 . 1 1 79 79 ALA C C 13 175.611 0.3 . 1 . . . . 79 ALA C . 17278 1 870 . 1 1 79 79 ALA CA C 13 56.063 0.3 . 1 . . . . 79 ALA CA . 17278 1 871 . 1 1 79 79 ALA CB C 13 17.116 0.3 . 1 . . . . 79 ALA CB . 17278 1 872 . 1 1 79 79 ALA N N 15 126.389 0.3 . 1 . . . . 79 ALA N . 17278 1 873 . 1 1 80 80 PRO HA H 1 4.543 0.020 . 1 . . . . 80 PRO HA . 17278 1 874 . 1 1 80 80 PRO HB2 H 1 2.457 0.020 . 1 . . . . 80 PRO HB2 . 17278 1 875 . 1 1 80 80 PRO HB3 H 1 2.457 0.020 . 1 . . . . 80 PRO HB3 . 17278 1 876 . 1 1 80 80 PRO HD2 H 1 3.896 0.020 . 1 . . . . 80 PRO HD2 . 17278 1 877 . 1 1 80 80 PRO HD3 H 1 3.896 0.020 . 1 . . . . 80 PRO HD3 . 17278 1 878 . 1 1 80 80 PRO C C 13 177.174 0.3 . 1 . . . . 80 PRO C . 17278 1 879 . 1 1 80 80 PRO CA C 13 62.441 0.3 . 1 . . . . 80 PRO CA . 17278 1 880 . 1 1 80 80 PRO CB C 13 31.501 0.3 . 1 . . . . 80 PRO CB . 17278 1 881 . 1 1 80 80 PRO CD C 13 50.764 0.3 . 1 . . . . 80 PRO CD . 17278 1 882 . 1 1 80 80 PRO CG C 13 27.770 0.3 . 1 . . . . 80 PRO CG . 17278 1 883 . 1 1 81 81 VAL H H 1 8.109 0.020 . 1 . . . . 81 VAL H . 17278 1 884 . 1 1 81 81 VAL HA H 1 3.526 0.020 . 1 . . . . 81 VAL HA . 17278 1 885 . 1 1 81 81 VAL HB H 1 2.008 0.020 . 1 . . . . 81 VAL HB . 17278 1 886 . 1 1 81 81 VAL HG11 H 1 0.992 0.020 . 1 . . . . 81 VAL HG1 . 17278 1 887 . 1 1 81 81 VAL HG12 H 1 0.992 0.020 . 1 . . . . 81 VAL HG1 . 17278 1 888 . 1 1 81 81 VAL HG13 H 1 0.992 0.020 . 1 . . . . 81 VAL HG1 . 17278 1 889 . 1 1 81 81 VAL HG21 H 1 0.992 0.020 . 1 . . . . 81 VAL HG2 . 17278 1 890 . 1 1 81 81 VAL HG22 H 1 0.992 0.020 . 1 . . . . 81 VAL HG2 . 17278 1 891 . 1 1 81 81 VAL HG23 H 1 0.992 0.020 . 1 . . . . 81 VAL HG2 . 17278 1 892 . 1 1 81 81 VAL C C 13 177.174 0.3 . 1 . . . . 81 VAL C . 17278 1 893 . 1 1 81 81 VAL CA C 13 66.444 0.3 . 1 . . . . 81 VAL CA . 17278 1 894 . 1 1 81 81 VAL CB C 13 32.315 0.3 . 1 . . . . 81 VAL CB . 17278 1 895 . 1 1 81 81 VAL CG1 C 13 22.267 0.3 . 1 . . . . 81 VAL CG1 . 17278 1 896 . 1 1 81 81 VAL CG2 C 13 20.382 0.3 . 1 . . . . 81 VAL CG2 . 17278 1 897 . 1 1 81 81 VAL N N 15 119.569 0.3 . 1 . . . . 81 VAL N . 17278 1 898 . 1 1 82 82 LYS H H 1 8.636 0.020 . 1 . . . . 82 LYS H . 17278 1 899 . 1 1 82 82 LYS C C 13 177.174 0.3 . 1 . . . . 82 LYS C . 17278 1 900 . 1 1 82 82 LYS CA C 13 61.830 0.3 . 1 . . . . 82 LYS CA . 17278 1 901 . 1 1 82 82 LYS CB C 13 29.397 0.3 . 1 . . . . 82 LYS CB . 17278 1 902 . 1 1 82 82 LYS N N 15 119.218 0.3 . 1 . . . . 82 LYS N . 17278 1 903 . 1 1 83 83 PRO HA H 1 4.596 0.020 . 1 . . . . 83 PRO HA . 17278 1 904 . 1 1 83 83 PRO HB2 H 1 2.589 0.020 . 1 . . . . 83 PRO HB2 . 17278 1 905 . 1 1 83 83 PRO HB3 H 1 2.589 0.020 . 1 . . . . 83 PRO HB3 . 17278 1 906 . 1 1 83 83 PRO HD2 H 1 3.764 0.020 . 1 . . . . 83 PRO HD2 . 17278 1 907 . 1 1 83 83 PRO HD3 H 1 3.764 0.020 . 1 . . . . 83 PRO HD3 . 17278 1 908 . 1 1 83 83 PRO HG2 H 1 2.206 0.020 . 2 . . . . 83 PRO HG2 . 17278 1 909 . 1 1 83 83 PRO HG3 H 1 1.873 0.020 . 2 . . . . 83 PRO HG3 . 17278 1 910 . 1 1 83 83 PRO C C 13 178.125 0.3 . 1 . . . . 83 PRO C . 17278 1 911 . 1 1 83 83 PRO CA C 13 66.173 0.3 . 1 . . . . 83 PRO CA . 17278 1 912 . 1 1 83 83 PRO CB C 13 30.347 0.3 . 1 . . . . 83 PRO CB . 17278 1 913 . 1 1 83 83 PRO CD C 13 49.483 0.3 . 1 . . . . 83 PRO CD . 17278 1 914 . 1 1 83 83 PRO CG C 13 28.147 0.3 . 1 . . . . 83 PRO CG . 17278 1 915 . 1 1 84 84 ARG H H 1 7.222 0.020 . 1 . . . . 84 ARG H . 17278 1 916 . 1 1 84 84 ARG HA H 1 4.213 0.020 . 1 . . . . 84 ARG HA . 17278 1 917 . 1 1 84 84 ARG HB2 H 1 1.873 0.020 . 2 . . . . 84 ARG HB2 . 17278 1 918 . 1 1 84 84 ARG HB3 H 1 1.722 0.020 . 2 . . . . 84 ARG HB3 . 17278 1 919 . 1 1 84 84 ARG HD2 H 1 3.116 0.020 . 1 . . . . 84 ARG HD2 . 17278 1 920 . 1 1 84 84 ARG HD3 H 1 3.116 0.020 . 1 . . . . 84 ARG HD3 . 17278 1 921 . 1 1 84 84 ARG HG2 H 1 1.553 0.020 . 2 . . . . 84 ARG HG2 . 17278 1 922 . 1 1 84 84 ARG HG3 H 1 1.124 0.020 . 2 . . . . 84 ARG HG3 . 17278 1 923 . 1 1 84 84 ARG C C 13 179.429 0.3 . 1 . . . . 84 ARG C . 17278 1 924 . 1 1 84 84 ARG CA C 13 61.084 0.3 . 1 . . . . 84 ARG CA . 17278 1 925 . 1 1 84 84 ARG CB C 13 30.415 0.3 . 1 . . . . 84 ARG CB . 17278 1 926 . 1 1 84 84 ARG CD C 13 43.753 0.3 . 1 . . . . 84 ARG CD . 17278 1 927 . 1 1 84 84 ARG CG C 13 29.504 0.3 . 1 . . . . 84 ARG CG . 17278 1 928 . 1 1 84 84 ARG N N 15 117.460 0.3 . 1 . . . . 84 ARG N . 17278 1 929 . 1 1 85 85 MET H H 1 8.355 0.020 . 1 . . . . 85 MET H . 17278 1 930 . 1 1 85 85 MET HA H 1 4.219 0.020 . 1 . . . . 85 MET HA . 17278 1 931 . 1 1 85 85 MET HB2 H 1 2.282 0.020 . 2 . . . . 85 MET HB2 . 17278 1 932 . 1 1 85 85 MET HB3 H 1 2.283 0.020 . 2 . . . . 85 MET HB3 . 17278 1 933 . 1 1 85 85 MET HG2 H 1 2.776 0.020 . 2 . . . . 85 MET HG2 . 17278 1 934 . 1 1 85 85 MET HG3 H 1 2.610 0.020 . 2 . . . . 85 MET HG3 . 17278 1 935 . 1 1 85 85 MET C C 13 179.671 0.3 . 1 . . . . 85 MET C . 17278 1 936 . 1 1 85 85 MET CA C 13 58.234 0.3 . 1 . . . . 85 MET CA . 17278 1 937 . 1 1 85 85 MET CB C 13 32.071 0.3 . 1 . . . . 85 MET CB . 17278 1 938 . 1 1 85 85 MET CG C 13 32.143 0.3 . 1 . . . . 85 MET CG . 17278 1 939 . 1 1 85 85 MET N N 15 117.882 0.3 . 1 . . . . 85 MET N . 17278 1 940 . 1 1 86 86 THR H H 1 8.792 0.020 . 1 . . . . 86 THR H . 17278 1 941 . 1 1 86 86 THR HA H 1 3.892 0.020 . 1 . . . . 86 THR HA . 17278 1 942 . 1 1 86 86 THR HB H 1 4.228 0.020 . 1 . . . . 86 THR HB . 17278 1 943 . 1 1 86 86 THR HG21 H 1 1.084 0.020 . 1 . . . . 86 THR HG2 . 17278 1 944 . 1 1 86 86 THR HG22 H 1 1.084 0.020 . 1 . . . . 86 THR HG2 . 17278 1 945 . 1 1 86 86 THR HG23 H 1 1.084 0.020 . 1 . . . . 86 THR HG2 . 17278 1 946 . 1 1 86 86 THR C C 13 177.771 0.3 . 1 . . . . 86 THR C . 17278 1 947 . 1 1 86 86 THR CA C 13 66.783 0.3 . 1 . . . . 86 THR CA . 17278 1 948 . 1 1 86 86 THR CB C 13 68.548 0.3 . 1 . . . . 86 THR CB . 17278 1 949 . 1 1 86 86 THR CG2 C 13 21.360 0.3 . 1 . . . . 86 THR CG2 . 17278 1 950 . 1 1 86 86 THR N N 15 119.260 0.3 . 1 . . . . 86 THR N . 17278 1 951 . 1 1 87 87 TYR H H 1 9.182 0.020 . 1 . . . . 87 TYR H . 17278 1 952 . 1 1 87 87 TYR HA H 1 3.893 0.020 . 1 . . . . 87 TYR HA . 17278 1 953 . 1 1 87 87 TYR HB2 H 1 2.906 0.020 . 2 . . . . 87 TYR HB2 . 17278 1 954 . 1 1 87 87 TYR HB3 H 1 2.206 0.020 . 2 . . . . 87 TYR HB3 . 17278 1 955 . 1 1 87 87 TYR HD1 H 1 7.710 0.020 . 3 . . . . 87 TYR HD1 . 17278 1 956 . 1 1 87 87 TYR HD2 H 1 7.710 0.020 . 3 . . . . 87 TYR HD2 . 17278 1 957 . 1 1 87 87 TYR HE1 H 1 7.758 0.020 . 3 . . . . 87 TYR HE1 . 17278 1 958 . 1 1 87 87 TYR HE2 H 1 7.717 0.020 . 3 . . . . 87 TYR HE2 . 17278 1 959 . 1 1 87 87 TYR C C 13 178.106 0.3 . 1 . . . . 87 TYR C . 17278 1 960 . 1 1 87 87 TYR CA C 13 63.144 0.3 . 1 . . . . 87 TYR CA . 17278 1 961 . 1 1 87 87 TYR CB C 13 36.929 0.3 . 1 . . . . 87 TYR CB . 17278 1 962 . 1 1 87 87 TYR CE1 C 13 119.335 0.3 . 1 . . . . 87 TYR CE1 . 17278 1 963 . 1 1 87 87 TYR N N 15 122.475 0.3 . 1 . . . . 87 TYR N . 17278 1 964 . 1 1 88 88 ALA H H 1 7.735 0.020 . 1 . . . . 88 ALA H . 17278 1 965 . 1 1 88 88 ALA HA H 1 4.147 0.020 . 1 . . . . 88 ALA HA . 17278 1 966 . 1 1 88 88 ALA HB1 H 1 1.618 0.020 . 1 . . . . 88 ALA HB . 17278 1 967 . 1 1 88 88 ALA HB2 H 1 1.618 0.020 . 1 . . . . 88 ALA HB . 17278 1 968 . 1 1 88 88 ALA HB3 H 1 1.618 0.020 . 1 . . . . 88 ALA HB . 17278 1 969 . 1 1 88 88 ALA C C 13 180.621 0.3 . 1 . . . . 88 ALA C . 17278 1 970 . 1 1 88 88 ALA CA C 13 56.267 0.3 . 1 . . . . 88 ALA CA . 17278 1 971 . 1 1 88 88 ALA CB C 13 18.134 0.3 . 1 . . . . 88 ALA CB . 17278 1 972 . 1 1 88 88 ALA N N 15 119.288 0.3 . 1 . . . . 88 ALA N . 17278 1 973 . 1 1 89 89 SER H H 1 8.105 0.020 . 1 . . . . 89 SER H . 17278 1 974 . 1 1 89 89 SER HA H 1 4.427 0.020 . 1 . . . . 89 SER HA . 17278 1 975 . 1 1 89 89 SER HB2 H 1 4.090 0.020 . 2 . . . . 89 SER HB2 . 17278 1 976 . 1 1 89 89 SER HB3 H 1 4.092 0.020 . 2 . . . . 89 SER HB3 . 17278 1 977 . 1 1 89 89 SER C C 13 175.760 0.3 . 1 . . . . 89 SER C . 17278 1 978 . 1 1 89 89 SER CA C 13 60.813 0.3 . 1 . . . . 89 SER CA . 17278 1 979 . 1 1 89 89 SER CB C 13 63.594 0.3 . 1 . . . . 89 SER CB . 17278 1 980 . 1 1 89 89 SER N N 15 110.358 0.3 . 1 . . . . 89 SER N . 17278 1 981 . 1 1 90 90 SER H H 1 7.640 0.020 . 1 . . . . 90 SER H . 17278 1 982 . 1 1 90 90 SER HA H 1 4.728 0.020 . 1 . . . . 90 SER HA . 17278 1 983 . 1 1 90 90 SER HB2 H 1 3.909 0.020 . 1 . . . . 90 SER HB2 . 17278 1 984 . 1 1 90 90 SER HB3 H 1 3.909 0.020 . 1 . . . . 90 SER HB3 . 17278 1 985 . 1 1 90 90 SER C C 13 173.450 0.3 . 1 . . . . 90 SER C . 17278 1 986 . 1 1 90 90 SER CA C 13 59.274 0.3 . 1 . . . . 90 SER CA . 17278 1 987 . 1 1 90 90 SER CB C 13 62.450 0.3 . 1 . . . . 90 SER CB . 17278 1 988 . 1 1 90 90 SER N N 15 115.210 0.3 . 1 . . . . 90 SER N . 17278 1 989 . 1 1 91 91 LYS H H 1 7.218 0.020 . 1 . . . . 91 LYS H . 17278 1 990 . 1 1 91 91 LYS HA H 1 3.684 0.020 . 1 . . . . 91 LYS HA . 17278 1 991 . 1 1 91 91 LYS HB2 H 1 2.087 0.020 . 1 . . . . 91 LYS HB2 . 17278 1 992 . 1 1 91 91 LYS HB3 H 1 2.087 0.020 . 1 . . . . 91 LYS HB3 . 17278 1 993 . 1 1 91 91 LYS HD2 H 1 1.567 0.020 . 1 . . . . 91 LYS HD2 . 17278 1 994 . 1 1 91 91 LYS HD3 H 1 1.567 0.020 . 1 . . . . 91 LYS HD3 . 17278 1 995 . 1 1 91 91 LYS HE2 H 1 3.027 0.020 . 1 . . . . 91 LYS HE2 . 17278 1 996 . 1 1 91 91 LYS HE3 H 1 3.027 0.020 . 1 . . . . 91 LYS HE3 . 17278 1 997 . 1 1 91 91 LYS HG2 H 1 1.027 0.020 . 2 . . . . 91 LYS HG2 . 17278 1 998 . 1 1 91 91 LYS HG3 H 1 1.031 0.020 . 2 . . . . 91 LYS HG3 . 17278 1 999 . 1 1 91 91 LYS C C 13 176.542 0.3 . 1 . . . . 91 LYS C . 17278 1 1000 . 1 1 91 91 LYS CA C 13 59.659 0.3 . 1 . . . . 91 LYS CA . 17278 1 1001 . 1 1 91 91 LYS CB C 13 32.383 0.3 . 1 . . . . 91 LYS CB . 17278 1 1002 . 1 1 91 91 LYS CD C 13 29.806 0.3 . 1 . . . . 91 LYS CD . 17278 1 1003 . 1 1 91 91 LYS CE C 13 42.321 0.3 . 1 . . . . 91 LYS CE . 17278 1 1004 . 1 1 91 91 LYS CG C 13 23.548 0.3 . 1 . . . . 91 LYS CG . 17278 1 1005 . 1 1 91 91 LYS N N 15 120.413 0.3 . 1 . . . . 91 LYS N . 17278 1 1006 . 1 1 92 92 ASP H H 1 8.445 0.020 . 1 . . . . 92 ASP H . 17278 1 1007 . 1 1 92 92 ASP HA H 1 4.207 0.020 . 1 . . . . 92 ASP HA . 17278 1 1008 . 1 1 92 92 ASP HB2 H 1 2.535 0.020 . 2 . . . . 92 ASP HB2 . 17278 1 1009 . 1 1 92 92 ASP HB3 H 1 2.454 0.020 . 2 . . . . 92 ASP HB3 . 17278 1 1010 . 1 1 92 92 ASP C C 13 177.492 0.3 . 1 . . . . 92 ASP C . 17278 1 1011 . 1 1 92 92 ASP CA C 13 57.420 0.3 . 1 . . . . 92 ASP CA . 17278 1 1012 . 1 1 92 92 ASP CB C 13 40.254 0.3 . 1 . . . . 92 ASP CB . 17278 1 1013 . 1 1 92 92 ASP N N 15 118.585 0.3 . 1 . . . . 92 ASP N . 17278 1 1014 . 1 1 93 93 ALA H H 1 7.609 0.020 . 1 . . . . 93 ALA H . 17278 1 1015 . 1 1 93 93 ALA HA H 1 3.843 0.020 . 1 . . . . 93 ALA HA . 17278 1 1016 . 1 1 93 93 ALA HB1 H 1 1.256 0.020 . 1 . . . . 93 ALA HB . 17278 1 1017 . 1 1 93 93 ALA HB2 H 1 1.256 0.020 . 1 . . . . 93 ALA HB . 17278 1 1018 . 1 1 93 93 ALA HB3 H 1 1.256 0.020 . 1 . . . . 93 ALA HB . 17278 1 1019 . 1 1 93 93 ALA C C 13 179.317 0.3 . 1 . . . . 93 ALA C . 17278 1 1020 . 1 1 93 93 ALA CA C 13 54.570 0.3 . 1 . . . . 93 ALA CA . 17278 1 1021 . 1 1 93 93 ALA CB C 13 17.523 0.3 . 1 . . . . 93 ALA CB . 17278 1 1022 . 1 1 93 93 ALA N N 15 121.679 0.3 . 1 . . . . 93 ALA N . 17278 1 1023 . 1 1 94 94 LEU H H 1 6.488 0.020 . 1 . . . . 94 LEU H . 17278 1 1024 . 1 1 94 94 LEU HA H 1 3.834 0.020 . 1 . . . . 94 LEU HA . 17278 1 1025 . 1 1 94 94 LEU HB2 H 1 1.140 0.020 . 2 . . . . 94 LEU HB2 . 17278 1 1026 . 1 1 94 94 LEU HB3 H 1 0.821 0.020 . 2 . . . . 94 LEU HB3 . 17278 1 1027 . 1 1 94 94 LEU HD11 H 1 0.199 0.020 . 1 . . . . 94 LEU HD1 . 17278 1 1028 . 1 1 94 94 LEU HD12 H 1 0.199 0.020 . 1 . . . . 94 LEU HD1 . 17278 1 1029 . 1 1 94 94 LEU HD13 H 1 0.199 0.020 . 1 . . . . 94 LEU HD1 . 17278 1 1030 . 1 1 94 94 LEU HD21 H 1 0.189 0.020 . 1 . . . . 94 LEU HD2 . 17278 1 1031 . 1 1 94 94 LEU HD22 H 1 0.189 0.020 . 1 . . . . 94 LEU HD2 . 17278 1 1032 . 1 1 94 94 LEU HD23 H 1 0.189 0.020 . 1 . . . . 94 LEU HD2 . 17278 1 1033 . 1 1 94 94 LEU HG H 1 -0.026 0.020 . 1 . . . . 94 LEU HG . 17278 1 1034 . 1 1 94 94 LEU C C 13 177.473 0.3 . 1 . . . . 94 LEU C . 17278 1 1035 . 1 1 94 94 LEU CA C 13 56.267 0.3 . 1 . . . . 94 LEU CA . 17278 1 1036 . 1 1 94 94 LEU CB C 13 41.814 0.3 . 1 . . . . 94 LEU CB . 17278 1 1037 . 1 1 94 94 LEU CD1 C 13 21.890 0.3 . 1 . . . . 94 LEU CD1 . 17278 1 1038 . 1 1 94 94 LEU CD2 C 13 21.890 0.3 . 1 . . . . 94 LEU CD2 . 17278 1 1039 . 1 1 94 94 LEU CG C 13 25.961 0.3 . 1 . . . . 94 LEU CG . 17278 1 1040 . 1 1 94 94 LEU N N 15 113.733 0.3 . 1 . . . . 94 LEU N . 17278 1 1041 . 1 1 95 95 LEU H H 1 7.875 0.020 . 1 . . . . 95 LEU H . 17278 1 1042 . 1 1 95 95 LEU HA H 1 3.103 0.020 . 1 . . . . 95 LEU HA . 17278 1 1043 . 1 1 95 95 LEU HB2 H 1 1.256 0.020 . 2 . . . . 95 LEU HB2 . 17278 1 1044 . 1 1 95 95 LEU HB3 H 1 0.745 0.020 . 2 . . . . 95 LEU HB3 . 17278 1 1045 . 1 1 95 95 LEU HD11 H 1 0.289 0.020 . 1 . . . . 95 LEU HD1 . 17278 1 1046 . 1 1 95 95 LEU HD12 H 1 0.289 0.020 . 1 . . . . 95 LEU HD1 . 17278 1 1047 . 1 1 95 95 LEU HD13 H 1 0.289 0.020 . 1 . . . . 95 LEU HD1 . 17278 1 1048 . 1 1 95 95 LEU HD21 H 1 0.289 0.020 . 1 . . . . 95 LEU HD2 . 17278 1 1049 . 1 1 95 95 LEU HD22 H 1 0.289 0.020 . 1 . . . . 95 LEU HD2 . 17278 1 1050 . 1 1 95 95 LEU HD23 H 1 0.289 0.020 . 1 . . . . 95 LEU HD2 . 17278 1 1051 . 1 1 95 95 LEU HG H 1 0.837 0.020 . 1 . . . . 95 LEU HG . 17278 1 1052 . 1 1 95 95 LEU C C 13 179.019 0.3 . 1 . . . . 95 LEU C . 17278 1 1053 . 1 1 95 95 LEU CA C 13 58.438 0.3 . 1 . . . . 95 LEU CA . 17278 1 1054 . 1 1 95 95 LEU CB C 13 41.814 0.3 . 1 . . . . 95 LEU CB . 17278 1 1055 . 1 1 95 95 LEU CD1 C 13 24.302 0.3 . 1 . . . . 95 LEU CD1 . 17278 1 1056 . 1 1 95 95 LEU CD2 C 13 23.096 0.3 . 1 . . . . 95 LEU CD2 . 17278 1 1057 . 1 1 95 95 LEU CG C 13 27.016 0.3 . 1 . . . . 95 LEU CG . 17278 1 1058 . 1 1 95 95 LEU N N 15 118.866 0.3 . 1 . . . . 95 LEU N . 17278 1 1059 . 1 1 96 96 LYS H H 1 7.695 0.020 . 1 . . . . 96 LYS H . 17278 1 1060 . 1 1 96 96 LYS HA H 1 3.843 0.020 . 1 . . . . 96 LYS HA . 17278 1 1061 . 1 1 96 96 LYS HB2 H 1 1.678 0.020 . 1 . . . . 96 LYS HB2 . 17278 1 1062 . 1 1 96 96 LYS HB3 H 1 1.678 0.020 . 1 . . . . 96 LYS HB3 . 17278 1 1063 . 1 1 96 96 LYS HD2 H 1 1.401 0.020 . 2 . . . . 96 LYS HD2 . 17278 1 1064 . 1 1 96 96 LYS HD3 H 1 1.414 0.020 . 2 . . . . 96 LYS HD3 . 17278 1 1065 . 1 1 96 96 LYS HE2 H 1 2.840 0.020 . 1 . . . . 96 LYS HE2 . 17278 1 1066 . 1 1 96 96 LYS HE3 H 1 2.840 0.020 . 1 . . . . 96 LYS HE3 . 17278 1 1067 . 1 1 96 96 LYS HG3 H 1 0.833 0.020 . 1 . . . . 96 LYS HG3 . 17278 1 1068 . 1 1 96 96 LYS C C 13 177.790 0.3 . 1 . . . . 96 LYS C . 17278 1 1069 . 1 1 96 96 LYS CA C 13 58.234 0.3 . 1 . . . . 96 LYS CA . 17278 1 1070 . 1 1 96 96 LYS CB C 13 32.111 0.3 . 1 . . . . 96 LYS CB . 17278 1 1071 . 1 1 96 96 LYS CD C 13 28.298 0.3 . 1 . . . . 96 LYS CD . 17278 1 1072 . 1 1 96 96 LYS CE C 13 42.094 0.3 . 1 . . . . 96 LYS CE . 17278 1 1073 . 1 1 96 96 LYS CG C 13 25.207 0.3 . 1 . . . . 96 LYS CG . 17278 1 1074 . 1 1 96 96 LYS N N 15 114.577 0.3 . 1 . . . . 96 LYS N . 17278 1 1075 . 1 1 97 97 LYS H H 1 7.164 0.020 . 1 . . . . 97 LYS H . 17278 1 1076 . 1 1 97 97 LYS HA H 1 4.177 0.020 . 1 . . . . 97 LYS HA . 17278 1 1077 . 1 1 97 97 LYS HB2 H 1 1.700 0.020 . 1 . . . . 97 LYS HB2 . 17278 1 1078 . 1 1 97 97 LYS HB3 H 1 1.700 0.020 . 1 . . . . 97 LYS HB3 . 17278 1 1079 . 1 1 97 97 LYS HD2 H 1 1.586 0.020 . 1 . . . . 97 LYS HD2 . 17278 1 1080 . 1 1 97 97 LYS HD3 H 1 1.586 0.020 . 1 . . . . 97 LYS HD3 . 17278 1 1081 . 1 1 97 97 LYS HE2 H 1 2.952 0.020 . 2 . . . . 97 LYS HE2 . 17278 1 1082 . 1 1 97 97 LYS HE3 H 1 2.947 0.020 . 2 . . . . 97 LYS HE3 . 17278 1 1083 . 1 1 97 97 LYS HG2 H 1 1.368 0.020 . 2 . . . . 97 LYS HG2 . 17278 1 1084 . 1 1 97 97 LYS HG3 H 1 1.279 0.020 . 2 . . . . 97 LYS HG3 . 17278 1 1085 . 1 1 97 97 LYS C C 13 175.946 0.3 . 1 . . . . 97 LYS C . 17278 1 1086 . 1 1 97 97 LYS CA C 13 55.588 0.3 . 1 . . . . 97 LYS CA . 17278 1 1087 . 1 1 97 97 LYS CB C 13 32.519 0.3 . 1 . . . . 97 LYS CB . 17278 1 1088 . 1 1 97 97 LYS CD C 13 28.298 0.3 . 1 . . . . 97 LYS CD . 17278 1 1089 . 1 1 97 97 LYS CE C 13 41.868 0.3 . 1 . . . . 97 LYS CE . 17278 1 1090 . 1 1 97 97 LYS CG C 13 24.577 0.3 . 1 . . . . 97 LYS CG . 17278 1 1091 . 1 1 97 97 LYS N N 15 115.913 0.3 . 1 . . . . 97 LYS N . 17278 1 1092 . 1 1 98 98 LEU H H 1 7.105 0.020 . 1 . . . . 98 LEU H . 17278 1 1093 . 1 1 98 98 LEU HA H 1 3.831 0.020 . 1 . . . . 98 LEU HA . 17278 1 1094 . 1 1 98 98 LEU HB2 H 1 1.365 0.020 . 2 . . . . 98 LEU HB2 . 17278 1 1095 . 1 1 98 98 LEU HB3 H 1 1.287 0.020 . 2 . . . . 98 LEU HB3 . 17278 1 1096 . 1 1 98 98 LEU HD11 H 1 0.035 0.020 . 1 . . . . 98 LEU HD1 . 17278 1 1097 . 1 1 98 98 LEU HD12 H 1 0.035 0.020 . 1 . . . . 98 LEU HD1 . 17278 1 1098 . 1 1 98 98 LEU HD13 H 1 0.035 0.020 . 1 . . . . 98 LEU HD1 . 17278 1 1099 . 1 1 98 98 LEU HD21 H 1 0.094 0.020 . 1 . . . . 98 LEU HD2 . 17278 1 1100 . 1 1 98 98 LEU HD22 H 1 0.094 0.020 . 1 . . . . 98 LEU HD2 . 17278 1 1101 . 1 1 98 98 LEU HD23 H 1 0.094 0.020 . 1 . . . . 98 LEU HD2 . 17278 1 1102 . 1 1 98 98 LEU HG H 1 0.213 0.020 . 1 . . . . 98 LEU HG . 17278 1 1103 . 1 1 98 98 LEU C C 13 174.661 0.3 . 1 . . . . 98 LEU C . 17278 1 1104 . 1 1 98 98 LEU CA C 13 52.535 0.3 . 1 . . . . 98 LEU CA . 17278 1 1105 . 1 1 98 98 LEU CB C 13 38.354 0.3 . 1 . . . . 98 LEU CB . 17278 1 1106 . 1 1 98 98 LEU CD1 C 13 20.684 0.3 . 1 . . . . 98 LEU CD1 . 17278 1 1107 . 1 1 98 98 LEU CD2 C 13 20.684 0.3 . 1 . . . . 98 LEU CD2 . 17278 1 1108 . 1 1 98 98 LEU CG C 13 25.961 0.3 . 1 . . . . 98 LEU CG . 17278 1 1109 . 1 1 98 98 LEU N N 15 120.554 0.3 . 1 . . . . 98 LEU N . 17278 1 1110 . 1 1 99 99 ASP H H 1 7.636 0.020 . 1 . . . . 99 ASP H . 17278 1 1111 . 1 1 99 99 ASP HA H 1 4.386 0.020 . 1 . . . . 99 ASP HA . 17278 1 1112 . 1 1 99 99 ASP HB2 H 1 2.700 0.020 . 2 . . . . 99 ASP HB2 . 17278 1 1113 . 1 1 99 99 ASP HB3 H 1 2.533 0.020 . 2 . . . . 99 ASP HB3 . 17278 1 1114 . 1 1 99 99 ASP C C 13 176.244 0.3 . 1 . . . . 99 ASP C . 17278 1 1115 . 1 1 99 99 ASP CA C 13 55.588 0.3 . 1 . . . . 99 ASP CA . 17278 1 1116 . 1 1 99 99 ASP CB C 13 41.339 0.3 . 1 . . . . 99 ASP CB . 17278 1 1117 . 1 1 99 99 ASP N N 15 120.694 0.3 . 1 . . . . 99 ASP N . 17278 1 1118 . 1 1 100 100 GLY H H 1 8.937 0.020 . 1 . . . . 100 GLY H . 17278 1 1119 . 1 1 100 100 GLY HA2 H 1 4.342 0.020 . 2 . . . . 100 GLY HA2 . 17278 1 1120 . 1 1 100 100 GLY HA3 H 1 3.757 0.020 . 2 . . . . 100 GLY HA3 . 17278 1 1121 . 1 1 100 100 GLY C C 13 175.312 0.3 . 1 . . . . 100 GLY C . 17278 1 1122 . 1 1 100 100 GLY CA C 13 44.935 0.3 . 1 . . . . 100 GLY CA . 17278 1 1123 . 1 1 100 100 GLY N N 15 114.366 0.3 . 1 . . . . 100 GLY N . 17278 1 1124 . 1 1 101 101 ALA H H 1 8.040 0.020 . 1 . . . . 101 ALA H . 17278 1 1125 . 1 1 101 101 ALA HA H 1 4.856 0.020 . 1 . . . . 101 ALA HA . 17278 1 1126 . 1 1 101 101 ALA HB1 H 1 1.388 0.020 . 1 . . . . 101 ALA HB . 17278 1 1127 . 1 1 101 101 ALA HB2 H 1 1.388 0.020 . 1 . . . . 101 ALA HB . 17278 1 1128 . 1 1 101 101 ALA HB3 H 1 1.388 0.020 . 1 . . . . 101 ALA HB . 17278 1 1129 . 1 1 101 101 ALA C C 13 177.324 0.3 . 1 . . . . 101 ALA C . 17278 1 1130 . 1 1 101 101 ALA CA C 13 52.042 0.3 . 1 . . . . 101 ALA CA . 17278 1 1131 . 1 1 101 101 ALA CB C 13 19.196 0.3 . 1 . . . . 101 ALA CB . 17278 1 1132 . 1 1 101 101 ALA N N 15 123.152 0.3 . 1 . . . . 101 ALA N . 17278 1 1133 . 1 1 102 102 THR H H 1 8.281 0.020 . 1 . . . . 102 THR H . 17278 1 1134 . 1 1 102 102 THR HA H 1 4.523 0.020 . 1 . . . . 102 THR HA . 17278 1 1135 . 1 1 102 102 THR HB H 1 4.114 0.020 . 1 . . . . 102 THR HB . 17278 1 1136 . 1 1 102 102 THR HG21 H 1 1.427 0.020 . 1 . . . . 102 THR HG2 . 17278 1 1137 . 1 1 102 102 THR HG22 H 1 1.427 0.020 . 1 . . . . 102 THR HG2 . 17278 1 1138 . 1 1 102 102 THR HG23 H 1 1.427 0.020 . 1 . . . . 102 THR HG2 . 17278 1 1139 . 1 1 102 102 THR C C 13 174.325 0.3 . 1 . . . . 102 THR C . 17278 1 1140 . 1 1 102 102 THR CA C 13 61.966 0.3 . 1 . . . . 102 THR CA . 17278 1 1141 . 1 1 102 102 THR CB C 13 70.040 0.3 . 1 . . . . 102 THR CB . 17278 1 1142 . 1 1 102 102 THR CG2 C 13 21.890 0.3 . 1 . . . . 102 THR CG2 . 17278 1 1143 . 1 1 102 102 THR N N 15 112.046 0.3 . 1 . . . . 102 THR N . 17278 1 1144 . 1 1 103 103 ALA H H 1 8.125 0.020 . 1 . . . . 103 ALA H . 17278 1 1145 . 1 1 103 103 ALA HA H 1 4.054 0.020 . 1 . . . . 103 ALA HA . 17278 1 1146 . 1 1 103 103 ALA HB1 H 1 1.388 0.020 . 1 . . . . 103 ALA HB . 17278 1 1147 . 1 1 103 103 ALA HB2 H 1 1.388 0.020 . 1 . . . . 103 ALA HB . 17278 1 1148 . 1 1 103 103 ALA HB3 H 1 1.388 0.020 . 1 . . . . 103 ALA HB . 17278 1 1149 . 1 1 103 103 ALA C C 13 177.585 0.3 . 1 . . . . 103 ALA C . 17278 1 1150 . 1 1 103 103 ALA CA C 13 53.620 0.3 . 1 . . . . 103 ALA CA . 17278 1 1151 . 1 1 103 103 ALA CB C 13 19.220 0.3 . 1 . . . . 103 ALA CB . 17278 1 1152 . 1 1 103 103 ALA N N 15 123.014 0.3 . 1 . . . . 103 ALA N . 17278 1 1153 . 1 1 104 104 VAL H H 1 7.613 0.020 . 1 . . . . 104 VAL H . 17278 1 1154 . 1 1 104 104 VAL HA H 1 4.186 0.020 . 1 . . . . 104 VAL HA . 17278 1 1155 . 1 1 104 104 VAL HB H 1 2.038 0.020 . 1 . . . . 104 VAL HB . 17278 1 1156 . 1 1 104 104 VAL HG11 H 1 0.939 0.020 . 1 . . . . 104 VAL HG1 . 17278 1 1157 . 1 1 104 104 VAL HG12 H 1 0.939 0.020 . 1 . . . . 104 VAL HG1 . 17278 1 1158 . 1 1 104 104 VAL HG13 H 1 0.939 0.020 . 1 . . . . 104 VAL HG1 . 17278 1 1159 . 1 1 104 104 VAL HG21 H 1 0.939 0.020 . 1 . . . . 104 VAL HG2 . 17278 1 1160 . 1 1 104 104 VAL HG22 H 1 0.939 0.020 . 1 . . . . 104 VAL HG2 . 17278 1 1161 . 1 1 104 104 VAL HG23 H 1 0.939 0.020 . 1 . . . . 104 VAL HG2 . 17278 1 1162 . 1 1 104 104 VAL C C 13 175.927 0.3 . 1 . . . . 104 VAL C . 17278 1 1163 . 1 1 104 104 VAL CA C 13 60.541 0.3 . 1 . . . . 104 VAL CA . 17278 1 1164 . 1 1 104 104 VAL CB C 13 33.672 0.3 . 1 . . . . 104 VAL CB . 17278 1 1165 . 1 1 104 104 VAL CG1 C 13 20.533 0.3 . 1 . . . . 104 VAL CG1 . 17278 1 1166 . 1 1 104 104 VAL CG2 C 13 20.533 0.3 . 1 . . . . 104 VAL CG2 . 17278 1 1167 . 1 1 104 104 VAL N N 15 114.366 0.3 . 1 . . . . 104 VAL N . 17278 1 1168 . 1 1 105 105 ALA H H 1 8.912 0.020 . 1 . . . . 105 ALA H . 17278 1 1169 . 1 1 105 105 ALA HA H 1 4.443 0.020 . 1 . . . . 105 ALA HA . 17278 1 1170 . 1 1 105 105 ALA HB1 H 1 1.381 0.020 . 1 . . . . 105 ALA HB . 17278 1 1171 . 1 1 105 105 ALA HB2 H 1 1.381 0.020 . 1 . . . . 105 ALA HB . 17278 1 1172 . 1 1 105 105 ALA HB3 H 1 1.381 0.020 . 1 . . . . 105 ALA HB . 17278 1 1173 . 1 1 105 105 ALA C C 13 176.542 0.3 . 1 . . . . 105 ALA C . 17278 1 1174 . 1 1 105 105 ALA CA C 13 51.653 0.3 . 1 . . . . 105 ALA CA . 17278 1 1175 . 1 1 105 105 ALA CB C 13 19.898 0.3 . 1 . . . . 105 ALA CB . 17278 1 1176 . 1 1 105 105 ALA N N 15 128.169 0.3 . 1 . . . . 105 ALA N . 17278 1 1177 . 1 1 106 106 LEU H H 1 8.539 0.020 . 1 . . . . 106 LEU H . 17278 1 1178 . 1 1 106 106 LEU HA H 1 4.548 0.020 . 1 . . . . 106 LEU HA . 17278 1 1179 . 1 1 106 106 LEU HB2 H 1 1.859 0.020 . 1 . . . . 106 LEU HB2 . 17278 1 1180 . 1 1 106 106 LEU HB3 H 1 1.859 0.020 . 1 . . . . 106 LEU HB3 . 17278 1 1181 . 1 1 106 106 LEU HD11 H 1 0.829 0.020 . 1 . . . . 106 LEU HD1 . 17278 1 1182 . 1 1 106 106 LEU HD12 H 1 0.829 0.020 . 1 . . . . 106 LEU HD1 . 17278 1 1183 . 1 1 106 106 LEU HD13 H 1 0.829 0.020 . 1 . . . . 106 LEU HD1 . 17278 1 1184 . 1 1 106 106 LEU HD21 H 1 0.922 0.020 . 1 . . . . 106 LEU HD2 . 17278 1 1185 . 1 1 106 106 LEU HD22 H 1 0.922 0.020 . 1 . . . . 106 LEU HD2 . 17278 1 1186 . 1 1 106 106 LEU HD23 H 1 0.922 0.020 . 1 . . . . 106 LEU HD2 . 17278 1 1187 . 1 1 106 106 LEU HG H 1 1.619 0.020 . 1 . . . . 106 LEU HG . 17278 1 1188 . 1 1 106 106 LEU C C 13 174.959 0.3 . 1 . . . . 106 LEU C . 17278 1 1189 . 1 1 106 106 LEU CA C 13 55.384 0.3 . 1 . . . . 106 LEU CA . 17278 1 1190 . 1 1 106 106 LEU CB C 13 42.900 0.3 . 1 . . . . 106 LEU CB . 17278 1 1191 . 1 1 106 106 LEU CD1 C 13 24.670 0.3 . 1 . . . . 106 LEU CD1 . 17278 1 1192 . 1 1 106 106 LEU CD2 C 13 24.670 0.3 . 1 . . . . 106 LEU CD2 . 17278 1 1193 . 1 1 106 106 LEU CG C 13 28.223 0.3 . 1 . . . . 106 LEU CG . 17278 1 1194 . 1 1 106 106 LEU N N 15 125.181 0.3 . 1 . . . . 106 LEU N . 17278 1 1195 . 1 1 107 107 GLU H H 1 9.027 0.020 . 1 . . . . 107 GLU H . 17278 1 1196 . 1 1 107 107 GLU HA H 1 4.860 0.020 . 1 . . . . 107 GLU HA . 17278 1 1197 . 1 1 107 107 GLU HB2 H 1 2.017 0.020 . 2 . . . . 107 GLU HB2 . 17278 1 1198 . 1 1 107 107 GLU HB3 H 1 1.933 0.020 . 2 . . . . 107 GLU HB3 . 17278 1 1199 . 1 1 107 107 GLU HG2 H 1 2.258 0.020 . 1 . . . . 107 GLU HG2 . 17278 1 1200 . 1 1 107 107 GLU HG3 H 1 2.258 0.020 . 1 . . . . 107 GLU HG3 . 17278 1 1201 . 1 1 107 107 GLU C C 13 173.431 0.3 . 1 . . . . 107 GLU C . 17278 1 1202 . 1 1 107 107 GLU CA C 13 55.656 0.3 . 1 . . . . 107 GLU CA . 17278 1 1203 . 1 1 107 107 GLU CB C 13 29.126 0.3 . 1 . . . . 107 GLU CB . 17278 1 1204 . 1 1 107 107 GLU CG C 13 36.742 0.3 . 1 . . . . 107 GLU CG . 17278 1 1205 . 1 1 107 107 GLU N N 15 129.975 0.3 . 1 . . . . 107 GLU N . 17278 1 1206 . 1 1 108 108 ALA H H 1 8.918 0.020 . 1 . . . . 108 ALA H . 17278 1 1207 . 1 1 108 108 ALA HA H 1 4.860 0.020 . 1 . . . . 108 ALA HA . 17278 1 1208 . 1 1 108 108 ALA HB1 H 1 1.467 0.020 . 1 . . . . 108 ALA HB . 17278 1 1209 . 1 1 108 108 ALA HB2 H 1 1.467 0.020 . 1 . . . . 108 ALA HB . 17278 1 1210 . 1 1 108 108 ALA HB3 H 1 1.467 0.020 . 1 . . . . 108 ALA HB . 17278 1 1211 . 1 1 108 108 ALA C C 13 174.678 0.3 . 1 . . . . 108 ALA C . 17278 1 1212 . 1 1 108 108 ALA CA C 13 50.092 0.3 . 1 . . . . 108 ALA CA . 17278 1 1213 . 1 1 108 108 ALA CB C 13 22.205 0.3 . 1 . . . . 108 ALA CB . 17278 1 1214 . 1 1 108 108 ALA N N 15 128.746 0.3 . 1 . . . . 108 ALA N . 17278 1 1215 . 1 1 109 109 HIS H H 1 9.680 0.020 . 1 . . . . 109 HIS H . 17278 1 1216 . 1 1 109 109 HIS HA H 1 4.518 0.020 . 1 . . . . 109 HIS HA . 17278 1 1217 . 1 1 109 109 HIS HB2 H 1 3.315 0.020 . 2 . . . . 109 HIS HB2 . 17278 1 1218 . 1 1 109 109 HIS HB3 H 1 3.110 0.020 . 2 . . . . 109 HIS HB3 . 17278 1 1219 . 1 1 109 109 HIS HD1 H 1 7.783 0.020 . 1 . . . . 109 HIS HD1 . 17278 1 1220 . 1 1 109 109 HIS HE1 H 1 7.783 0.020 . 1 . . . . 109 HIS HE1 . 17278 1 1221 . 1 1 109 109 HIS C C 13 173.115 0.3 . 1 . . . . 109 HIS C . 17278 1 1222 . 1 1 109 109 HIS CA C 13 53.824 0.3 . 1 . . . . 109 HIS CA . 17278 1 1223 . 1 1 109 109 HIS CB C 13 30.415 0.3 . 1 . . . . 109 HIS CB . 17278 1 1224 . 1 1 109 109 HIS N N 15 120.624 0.3 . 1 . . . . 109 HIS N . 17278 1 1225 . 1 1 110 110 GLU H H 1 7.976 0.020 . 1 . . . . 110 GLU H . 17278 1 1226 . 1 1 110 110 GLU HA H 1 4.573 0.020 . 1 . . . . 110 GLU HA . 17278 1 1227 . 1 1 110 110 GLU HB2 H 1 2.193 0.020 . 1 . . . . 110 GLU HB2 . 17278 1 1228 . 1 1 110 110 GLU HB3 H 1 2.193 0.020 . 1 . . . . 110 GLU HB3 . 17278 1 1229 . 1 1 110 110 GLU HG2 H 1 1.902 0.020 . 1 . . . . 110 GLU HG2 . 17278 1 1230 . 1 1 110 110 GLU HG3 H 1 1.902 0.020 . 1 . . . . 110 GLU HG3 . 17278 1 1231 . 1 1 110 110 GLU C C 13 177.007 0.3 . 1 . . . . 110 GLU C . 17278 1 1232 . 1 1 110 110 GLU CA C 13 54.502 0.3 . 1 . . . . 110 GLU CA . 17278 1 1233 . 1 1 110 110 GLU CB C 13 32.315 0.3 . 1 . . . . 110 GLU CB . 17278 1 1234 . 1 1 110 110 GLU CG C 13 38.174 0.3 . 1 . . . . 110 GLU CG . 17278 1 1235 . 1 1 110 110 GLU N N 15 116.405 0.3 . 1 . . . . 110 GLU N . 17278 1 1236 . 1 1 111 111 MET H H 1 9.633 0.020 . 1 . . . . 111 MET H . 17278 1 1237 . 1 1 111 111 MET HA H 1 4.490 0.020 . 1 . . . . 111 MET HA . 17278 1 1238 . 1 1 111 111 MET HB2 H 1 2.192 0.020 . 2 . . . . 111 MET HB2 . 17278 1 1239 . 1 1 111 111 MET HB3 H 1 1.912 0.020 . 2 . . . . 111 MET HB3 . 17278 1 1240 . 1 1 111 111 MET HG2 H 1 2.606 0.020 . 1 . . . . 111 MET HG2 . 17278 1 1241 . 1 1 111 111 MET HG3 H 1 2.606 0.020 . 1 . . . . 111 MET HG3 . 17278 1 1242 . 1 1 111 111 MET C C 13 179.690 0.3 . 1 . . . . 111 MET C . 17278 1 1243 . 1 1 111 111 MET CA C 13 58.098 0.3 . 1 . . . . 111 MET CA . 17278 1 1244 . 1 1 111 111 MET CB C 13 31.094 0.3 . 1 . . . . 111 MET CB . 17278 1 1245 . 1 1 111 111 MET CG C 13 32.369 0.3 . 1 . . . . 111 MET CG . 17278 1 1246 . 1 1 111 111 MET N N 15 123.858 0.3 . 1 . . . . 111 MET N . 17278 1 1247 . 1 1 112 112 GLY H H 1 9.289 0.020 . 1 . . . . 112 GLY H . 17278 1 1248 . 1 1 112 112 GLY HA2 H 1 4.006 0.020 . 2 . . . . 112 GLY HA2 . 17278 1 1249 . 1 1 112 112 GLY HA3 H 1 3.849 0.020 . 2 . . . . 112 GLY HA3 . 17278 1 1250 . 1 1 112 112 GLY C C 13 176.542 0.3 . 1 . . . . 112 GLY C . 17278 1 1251 . 1 1 112 112 GLY CA C 13 47.039 0.3 . 1 . . . . 112 GLY CA . 17278 1 1252 . 1 1 112 112 GLY N N 15 108.319 0.3 . 1 . . . . 112 GLY N . 17278 1 1253 . 1 1 113 113 ASP H H 1 7.815 0.020 . 1 . . . . 113 ASP H . 17278 1 1254 . 1 1 113 113 ASP HA H 1 4.150 0.020 . 1 . . . . 113 ASP HA . 17278 1 1255 . 1 1 113 113 ASP HB2 H 1 2.588 0.020 . 2 . . . . 113 ASP HB2 . 17278 1 1256 . 1 1 113 113 ASP HB3 H 1 2.448 0.020 . 2 . . . . 113 ASP HB3 . 17278 1 1257 . 1 1 113 113 ASP C C 13 176.486 0.3 . 1 . . . . 113 ASP C . 17278 1 1258 . 1 1 113 113 ASP CA C 13 56.674 0.3 . 1 . . . . 113 ASP CA . 17278 1 1259 . 1 1 113 113 ASP CB C 13 40.661 0.3 . 1 . . . . 113 ASP CB . 17278 1 1260 . 1 1 113 113 ASP N N 15 119.889 0.3 . 1 . . . . 113 ASP N . 17278 1 1261 . 1 1 114 114 LEU H H 1 7.773 0.020 . 1 . . . . 114 LEU H . 17278 1 1262 . 1 1 114 114 LEU HA H 1 4.573 0.020 . 1 . . . . 114 LEU HA . 17278 1 1263 . 1 1 114 114 LEU HB2 H 1 2.828 0.020 . 2 . . . . 114 LEU HB2 . 17278 1 1264 . 1 1 114 114 LEU HB3 H 1 2.697 0.020 . 2 . . . . 114 LEU HB3 . 17278 1 1265 . 1 1 114 114 LEU C C 13 175.909 0.3 . 1 . . . . 114 LEU C . 17278 1 1266 . 1 1 114 114 LEU CA C 13 53.281 0.3 . 1 . . . . 114 LEU CA . 17278 1 1267 . 1 1 114 114 LEU CB C 13 38.422 0.3 . 1 . . . . 114 LEU CB . 17278 1 1268 . 1 1 114 114 LEU N N 15 111.413 0.3 . 1 . . . . 114 LEU N . 17278 1 1269 . 1 1 115 115 ALA H H 1 7.625 0.020 . 1 . . . . 115 ALA H . 17278 1 1270 . 1 1 115 115 ALA C C 13 174.679 0.3 . 1 . . . . 115 ALA C . 17278 1 1271 . 1 1 115 115 ALA CA C 13 50.363 0.3 . 1 . . . . 115 ALA CA . 17278 1 1272 . 1 1 115 115 ALA CB C 13 18.066 0.3 . 1 . . . . 115 ALA CB . 17278 1 1273 . 1 1 115 115 ALA N N 15 123.014 0.3 . 1 . . . . 115 ALA N . 17278 1 1274 . 1 1 116 116 PRO HA H 1 4.358 0.020 . 1 . . . . 116 PRO HA . 17278 1 1275 . 1 1 116 116 PRO HB2 H 1 2.391 0.020 . 1 . . . . 116 PRO HB2 . 17278 1 1276 . 1 1 116 116 PRO HB3 H 1 2.391 0.020 . 1 . . . . 116 PRO HB3 . 17278 1 1277 . 1 1 116 116 PRO HD2 H 1 3.962 0.020 . 1 . . . . 116 PRO HD2 . 17278 1 1278 . 1 1 116 116 PRO HD3 H 1 3.962 0.020 . 1 . . . . 116 PRO HD3 . 17278 1 1279 . 1 1 116 116 PRO HG2 H 1 1.929 0.020 . 1 . . . . 116 PRO HG2 . 17278 1 1280 . 1 1 116 116 PRO HG3 H 1 1.929 0.020 . 1 . . . . 116 PRO HG3 . 17278 1 1281 . 1 1 116 116 PRO C C 13 177.175 0.3 . 1 . . . . 116 PRO C . 17278 1 1282 . 1 1 116 116 PRO CA C 13 64.951 0.3 . 1 . . . . 116 PRO CA . 17278 1 1283 . 1 1 116 116 PRO CB C 13 31.772 0.3 . 1 . . . . 116 PRO CB . 17278 1 1284 . 1 1 116 116 PRO CD C 13 51.518 0.3 . 1 . . . . 116 PRO CD . 17278 1 1285 . 1 1 116 116 PRO CG C 13 27.996 0.3 . 1 . . . . 116 PRO CG . 17278 1 1286 . 1 1 117 117 LEU H H 1 7.226 0.020 . 1 . . . . 117 LEU H . 17278 1 1287 . 1 1 117 117 LEU HA H 1 4.107 0.020 . 1 . . . . 117 LEU HA . 17278 1 1288 . 1 1 117 117 LEU HB2 H 1 1.449 0.020 . 2 . . . . 117 LEU HB2 . 17278 1 1289 . 1 1 117 117 LEU HB3 H 1 0.785 0.020 . 2 . . . . 117 LEU HB3 . 17278 1 1290 . 1 1 117 117 LEU HD11 H 1 0.603 0.020 . 1 . . . . 117 LEU HD1 . 17278 1 1291 . 1 1 117 117 LEU HD12 H 1 0.603 0.020 . 1 . . . . 117 LEU HD1 . 17278 1 1292 . 1 1 117 117 LEU HD13 H 1 0.603 0.020 . 1 . . . . 117 LEU HD1 . 17278 1 1293 . 1 1 117 117 LEU HD21 H 1 0.603 0.020 . 1 . . . . 117 LEU HD2 . 17278 1 1294 . 1 1 117 117 LEU HD22 H 1 0.603 0.020 . 1 . . . . 117 LEU HD2 . 17278 1 1295 . 1 1 117 117 LEU HD23 H 1 0.603 0.020 . 1 . . . . 117 LEU HD2 . 17278 1 1296 . 1 1 117 117 LEU HG H 1 1.389 0.020 . 1 . . . . 117 LEU HG . 17278 1 1297 . 1 1 117 117 LEU C C 13 174.661 0.3 . 1 . . . . 117 LEU C . 17278 1 1298 . 1 1 117 117 LEU CA C 13 55.384 0.3 . 1 . . . . 117 LEU CA . 17278 1 1299 . 1 1 117 117 LEU CB C 13 41.271 0.3 . 1 . . . . 117 LEU CB . 17278 1 1300 . 1 1 117 117 LEU CD1 C 13 22.857 0.3 . 1 . . . . 117 LEU CD1 . 17278 1 1301 . 1 1 117 117 LEU CD2 C 13 22.857 0.3 . 1 . . . . 117 LEU CD2 . 17278 1 1302 . 1 1 117 117 LEU CG C 13 25.886 0.3 . 1 . . . . 117 LEU CG . 17278 1 1303 . 1 1 117 117 LEU N N 15 115.913 0.3 . 1 . . . . 117 LEU N . 17278 1 1304 . 1 1 118 118 ALA H H 1 7.910 0.020 . 1 . . . . 118 ALA H . 17278 1 1305 . 1 1 118 118 ALA C C 13 182.819 0.3 . 1 . . . . 118 ALA C . 17278 1 1306 . 1 1 118 118 ALA CA C 13 54.095 0.3 . 1 . . . . 118 ALA CA . 17278 1 1307 . 1 1 118 118 ALA CB C 13 21.187 0.3 . 1 . . . . 118 ALA CB . 17278 1 1308 . 1 1 118 118 ALA N N 15 129.975 0.3 . 1 . . . . 118 ALA N . 17278 1 stop_ save_