data_19599 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 19599 _Entry.Title ; Human EPRS R12 Repeats ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2013-11-04 _Entry.Accession_date 2013-11-04 _Entry.Last_release_date 2014-02-11 _Entry.Original_release_date 2014-02-11 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.1 _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 ChinHo Shin . . . 19599 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 19599 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 520 19599 '15N chemical shifts' 136 19599 '1H chemical shifts' 851 19599 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 . . 2014-02-11 2013-11-04 original author . 19599 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 19598 'WHEP repeats' 19599 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 19599 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 24378977 _Citation.Full_citation . _Citation.Title '(1)H, (13)C and (15)N resonance assignment of WHEP domains of human glutamyl-prolyl tRNA synthetase.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assignments' _Citation.Journal_name_full 'Biomolecular NMR assignments' _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 2013 _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 Chinho Shin . . . 19599 1 2 Geum-Sook Hwang . . . 19599 1 3 Hee-Chul Ahn . . . 19599 1 4 Sunghoon Kim . . . 19599 1 5 Key-Sun Kim . . . 19599 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 19599 _Assembly.ID 1 _Assembly.Name 'hman EPRS R12 repeats' _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 'human EPRS repeats' 1 $human_EPRS_R12_repeats A . yes native no no . . . 19599 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_human_EPRS_R12_repeats _Entity.Sf_category entity _Entity.Sf_framecode human_EPRS_R12_repeats _Entity.Entry_ID 19599 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name human_EPRS_R12_repeats _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(D) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; DSLVLYNRVAVQGDVVRELK AKKAPKEDVDAAVKQLLSLK AEYKEKTGQEYKPGNPPAEI GQNISSNSSASILESKSLYD EVAAQGEVVRKLKAEKSPKA KINEAVECLLSLKAQYKEKT GKEYIPGQ ; _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 128 _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 . 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 1 ASP . 19599 1 2 2 SER . 19599 1 3 3 LEU . 19599 1 4 4 VAL . 19599 1 5 5 LEU . 19599 1 6 6 TYR . 19599 1 7 7 ASN . 19599 1 8 8 ARG . 19599 1 9 9 VAL . 19599 1 10 10 ALA . 19599 1 11 11 VAL . 19599 1 12 12 GLN . 19599 1 13 13 GLY . 19599 1 14 14 ASP . 19599 1 15 15 VAL . 19599 1 16 16 VAL . 19599 1 17 17 ARG . 19599 1 18 18 GLU . 19599 1 19 19 LEU . 19599 1 20 20 LYS . 19599 1 21 21 ALA . 19599 1 22 22 LYS . 19599 1 23 23 LYS . 19599 1 24 24 ALA . 19599 1 25 25 PRO . 19599 1 26 26 LYS . 19599 1 27 27 GLU . 19599 1 28 28 ASP . 19599 1 29 29 VAL . 19599 1 30 30 ASP . 19599 1 31 31 ALA . 19599 1 32 32 ALA . 19599 1 33 33 VAL . 19599 1 34 34 LYS . 19599 1 35 35 GLN . 19599 1 36 36 LEU . 19599 1 37 37 LEU . 19599 1 38 38 SER . 19599 1 39 39 LEU . 19599 1 40 40 LYS . 19599 1 41 41 ALA . 19599 1 42 42 GLU . 19599 1 43 43 TYR . 19599 1 44 44 LYS . 19599 1 45 45 GLU . 19599 1 46 46 LYS . 19599 1 47 47 THR . 19599 1 48 48 GLY . 19599 1 49 49 GLN . 19599 1 50 50 GLU . 19599 1 51 51 TYR . 19599 1 52 52 LYS . 19599 1 53 53 PRO . 19599 1 54 54 GLY . 19599 1 55 55 ASN . 19599 1 56 56 PRO . 19599 1 57 57 PRO . 19599 1 58 58 ALA . 19599 1 59 59 GLU . 19599 1 60 60 ILE . 19599 1 61 61 GLY . 19599 1 62 62 GLN . 19599 1 63 63 ASN . 19599 1 64 64 ILE . 19599 1 65 65 SER . 19599 1 66 66 SER . 19599 1 67 67 ASN . 19599 1 68 68 SER . 19599 1 69 69 SER . 19599 1 70 70 ALA . 19599 1 71 71 SER . 19599 1 72 72 ILE . 19599 1 73 73 LEU . 19599 1 74 74 GLU . 19599 1 75 75 SER . 19599 1 76 76 LYS . 19599 1 77 77 SER . 19599 1 78 78 LEU . 19599 1 79 79 TYR . 19599 1 80 80 ASP . 19599 1 81 81 GLU . 19599 1 82 82 VAL . 19599 1 83 83 ALA . 19599 1 84 84 ALA . 19599 1 85 85 GLN . 19599 1 86 86 GLY . 19599 1 87 87 GLU . 19599 1 88 88 VAL . 19599 1 89 89 VAL . 19599 1 90 90 ARG . 19599 1 91 91 LYS . 19599 1 92 92 LEU . 19599 1 93 93 LYS . 19599 1 94 94 ALA . 19599 1 95 95 GLU . 19599 1 96 96 LYS . 19599 1 97 97 SER . 19599 1 98 98 PRO . 19599 1 99 99 LYS . 19599 1 100 100 ALA . 19599 1 101 101 LYS . 19599 1 102 102 ILE . 19599 1 103 103 ASN . 19599 1 104 104 GLU . 19599 1 105 105 ALA . 19599 1 106 106 VAL . 19599 1 107 107 GLU . 19599 1 108 108 CYS . 19599 1 109 109 LEU . 19599 1 110 110 LEU . 19599 1 111 111 SER . 19599 1 112 112 LEU . 19599 1 113 113 LYS . 19599 1 114 114 ALA . 19599 1 115 115 GLN . 19599 1 116 116 TYR . 19599 1 117 117 LYS . 19599 1 118 118 GLU . 19599 1 119 119 LYS . 19599 1 120 120 THR . 19599 1 121 121 GLY . 19599 1 122 122 LYS . 19599 1 123 123 GLU . 19599 1 124 124 TYR . 19599 1 125 125 ILE . 19599 1 126 126 PRO . 19599 1 127 127 GLY . 19599 1 128 128 GLN . 19599 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 . ASP 1 1 19599 1 . SER 2 2 19599 1 . LEU 3 3 19599 1 . VAL 4 4 19599 1 . LEU 5 5 19599 1 . TYR 6 6 19599 1 . ASN 7 7 19599 1 . ARG 8 8 19599 1 . VAL 9 9 19599 1 . ALA 10 10 19599 1 . VAL 11 11 19599 1 . GLN 12 12 19599 1 . GLY 13 13 19599 1 . ASP 14 14 19599 1 . VAL 15 15 19599 1 . VAL 16 16 19599 1 . ARG 17 17 19599 1 . GLU 18 18 19599 1 . LEU 19 19 19599 1 . LYS 20 20 19599 1 . ALA 21 21 19599 1 . LYS 22 22 19599 1 . LYS 23 23 19599 1 . ALA 24 24 19599 1 . PRO 25 25 19599 1 . LYS 26 26 19599 1 . GLU 27 27 19599 1 . ASP 28 28 19599 1 . VAL 29 29 19599 1 . ASP 30 30 19599 1 . ALA 31 31 19599 1 . ALA 32 32 19599 1 . VAL 33 33 19599 1 . LYS 34 34 19599 1 . GLN 35 35 19599 1 . LEU 36 36 19599 1 . LEU 37 37 19599 1 . SER 38 38 19599 1 . LEU 39 39 19599 1 . LYS 40 40 19599 1 . ALA 41 41 19599 1 . GLU 42 42 19599 1 . TYR 43 43 19599 1 . LYS 44 44 19599 1 . GLU 45 45 19599 1 . LYS 46 46 19599 1 . THR 47 47 19599 1 . GLY 48 48 19599 1 . GLN 49 49 19599 1 . GLU 50 50 19599 1 . TYR 51 51 19599 1 . LYS 52 52 19599 1 . PRO 53 53 19599 1 . GLY 54 54 19599 1 . ASN 55 55 19599 1 . PRO 56 56 19599 1 . PRO 57 57 19599 1 . ALA 58 58 19599 1 . GLU 59 59 19599 1 . ILE 60 60 19599 1 . GLY 61 61 19599 1 . GLN 62 62 19599 1 . ASN 63 63 19599 1 . ILE 64 64 19599 1 . SER 65 65 19599 1 . SER 66 66 19599 1 . ASN 67 67 19599 1 . SER 68 68 19599 1 . SER 69 69 19599 1 . ALA 70 70 19599 1 . SER 71 71 19599 1 . ILE 72 72 19599 1 . LEU 73 73 19599 1 . GLU 74 74 19599 1 . SER 75 75 19599 1 . LYS 76 76 19599 1 . SER 77 77 19599 1 . LEU 78 78 19599 1 . TYR 79 79 19599 1 . ASP 80 80 19599 1 . GLU 81 81 19599 1 . VAL 82 82 19599 1 . ALA 83 83 19599 1 . ALA 84 84 19599 1 . GLN 85 85 19599 1 . GLY 86 86 19599 1 . GLU 87 87 19599 1 . VAL 88 88 19599 1 . VAL 89 89 19599 1 . ARG 90 90 19599 1 . LYS 91 91 19599 1 . LEU 92 92 19599 1 . LYS 93 93 19599 1 . ALA 94 94 19599 1 . GLU 95 95 19599 1 . LYS 96 96 19599 1 . SER 97 97 19599 1 . PRO 98 98 19599 1 . LYS 99 99 19599 1 . ALA 100 100 19599 1 . LYS 101 101 19599 1 . ILE 102 102 19599 1 . ASN 103 103 19599 1 . GLU 104 104 19599 1 . ALA 105 105 19599 1 . VAL 106 106 19599 1 . GLU 107 107 19599 1 . CYS 108 108 19599 1 . LEU 109 109 19599 1 . LEU 110 110 19599 1 . SER 111 111 19599 1 . LEU 112 112 19599 1 . LYS 113 113 19599 1 . ALA 114 114 19599 1 . GLN 115 115 19599 1 . TYR 116 116 19599 1 . LYS 117 117 19599 1 . GLU 118 118 19599 1 . LYS 119 119 19599 1 . THR 120 120 19599 1 . GLY 121 121 19599 1 . LYS 122 122 19599 1 . GLU 123 123 19599 1 . TYR 124 124 19599 1 . ILE 125 125 19599 1 . PRO 126 126 19599 1 . GLY 127 127 19599 1 . GLN 128 128 19599 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 19599 _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 $human_EPRS_R12_repeats . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 19599 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 19599 _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 $human_EPRS_R12_repeats . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . . . . . . . . . . . pET15b . . . . . . 19599 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 19599 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'human EPRS R12 repeats' '[U-95% 13C; U-90% 15N]' . . 1 $human_EPRS_R12_repeats . . 2 . . mM . . . . 19599 1 2 H2O 'natural abundance' . . . . . . 90 . . % . . . . 19599 1 3 D2O 'natural abundance' . . . . . . 10 . . % . . . . 19599 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 19599 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 5 . pH 19599 1 pressure 1 . atm 19599 1 temperature 273 . K 19599 1 stop_ save_ ############################ # Computer software used # ############################ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 19599 _Software.ID 1 _Software.Name NMRPipe _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID CCPN . . 19599 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 19599 1 'data analysis' 19599 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 19599 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model Unity _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 900 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 19599 _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 Unity . 900 . . . 19599 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 19599 _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 . . . . . . . . . . . . . . . . 19599 1 2 '2D 1H-13C HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19599 1 3 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19599 1 4 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19599 1 5 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19599 1 6 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19599 1 7 '3D HCCH-TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19599 1 8 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19599 1 9 '3D 1H-13C NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19599 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 19599 _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 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 19599 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 19599 _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' . . . 19599 1 3 '3D CBCA(CO)NH' . . . 19599 1 4 '3D HNCO' . . . 19599 1 5 '3D HNCA' . . . 19599 1 6 '3D HCCH-TOCSY' . . . 19599 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 ASP H H 1 8.275 0.008 . 1 . . . . 1 Asp H . 19599 1 2 . 1 1 1 1 ASP HA H 1 4.493 0.004 . 1 . . . . 1 Asp HA . 19599 1 3 . 1 1 1 1 ASP HB3 H 1 2.738 0.003 . 1 . . . . 1 Asp HB3 . 19599 1 4 . 1 1 1 1 ASP C C 13 177.656 0.000 . 1 . . . . 1 Asp C . 19599 1 5 . 1 1 1 1 ASP CA C 13 55.720 0.026 . 1 . . . . 1 Asp CA . 19599 1 6 . 1 1 1 1 ASP CB C 13 40.782 0.066 . 1 . . . . 1 Asp CB . 19599 1 7 . 1 1 1 1 ASP N N 15 121.101 0.039 . 1 . . . . 1 Asp N . 19599 1 8 . 1 1 2 2 SER H H 1 8.488 0.008 . 1 . . . . 2 Ser H . 19599 1 9 . 1 1 2 2 SER HA H 1 4.130 0.008 . 1 . . . . 2 Ser HA . 19599 1 10 . 1 1 2 2 SER HB2 H 1 3.806 0.007 . 2 . . . . 2 Ser HB2 . 19599 1 11 . 1 1 2 2 SER HB3 H 1 3.922 0.002 . 2 . . . . 2 Ser HB3 . 19599 1 12 . 1 1 2 2 SER C C 13 175.033 0.000 . 1 . . . . 2 Ser C . 19599 1 13 . 1 1 2 2 SER CA C 13 61.743 0.050 . 1 . . . . 2 Ser CA . 19599 1 14 . 1 1 2 2 SER CB C 13 62.613 0.054 . 1 . . . . 2 Ser CB . 19599 1 15 . 1 1 2 2 SER N N 15 117.261 0.027 . 1 . . . . 2 Ser N . 19599 1 16 . 1 1 3 3 LEU H H 1 8.092 0.006 . 1 . . . . 3 Leu H . 19599 1 17 . 1 1 3 3 LEU HA H 1 4.178 0.017 . 1 . . . . 3 Leu HA . 19599 1 18 . 1 1 3 3 LEU HB2 H 1 1.887 0.008 . 2 . . . . 3 Leu HB2 . 19599 1 19 . 1 1 3 3 LEU HB3 H 1 1.585 0.007 . 2 . . . . 3 Leu HB3 . 19599 1 20 . 1 1 3 3 LEU HG H 1 1.628 0.017 . 1 . . . . 3 Leu HG . 19599 1 21 . 1 1 3 3 LEU HD11 H 1 0.940 0.004 . 2 . . . . 3 Leu HD11 . 19599 1 22 . 1 1 3 3 LEU HD12 H 1 0.940 0.004 . 2 . . . . 3 Leu HD12 . 19599 1 23 . 1 1 3 3 LEU HD13 H 1 0.940 0.004 . 2 . . . . 3 Leu HD13 . 19599 1 24 . 1 1 3 3 LEU HD21 H 1 0.897 0.005 . 2 . . . . 3 Leu HD21 . 19599 1 25 . 1 1 3 3 LEU HD22 H 1 0.897 0.005 . 2 . . . . 3 Leu HD22 . 19599 1 26 . 1 1 3 3 LEU HD23 H 1 0.897 0.005 . 2 . . . . 3 Leu HD23 . 19599 1 27 . 1 1 3 3 LEU C C 13 178.206 0.000 . 1 . . . . 3 Leu C . 19599 1 28 . 1 1 3 3 LEU CA C 13 57.768 0.186 . 1 . . . . 3 Leu CA . 19599 1 29 . 1 1 3 3 LEU CB C 13 41.796 0.135 . 1 . . . . 3 Leu CB . 19599 1 30 . 1 1 3 3 LEU CG C 13 27.141 0.047 . 1 . . . . 3 Leu CG . 19599 1 31 . 1 1 3 3 LEU CD1 C 13 23.962 0.150 . 2 . . . . 3 Leu CD1 . 19599 1 32 . 1 1 3 3 LEU CD2 C 13 24.827 0.000 . 2 . . . . 3 Leu CD2 . 19599 1 33 . 1 1 3 3 LEU N N 15 124.633 0.042 . 1 . . . . 3 Leu N . 19599 1 34 . 1 1 4 4 VAL H H 1 7.960 0.004 . 1 . . . . 4 Val H . 19599 1 35 . 1 1 4 4 VAL HA H 1 3.759 0.005 . 1 . . . . 4 Val HA . 19599 1 36 . 1 1 4 4 VAL HB H 1 2.176 0.005 . 1 . . . . 4 Val HB . 19599 1 37 . 1 1 4 4 VAL HG11 H 1 0.959 0.006 . 2 . . . . 4 Val HG11 . 19599 1 38 . 1 1 4 4 VAL HG12 H 1 0.959 0.006 . 2 . . . . 4 Val HG12 . 19599 1 39 . 1 1 4 4 VAL HG13 H 1 0.959 0.006 . 2 . . . . 4 Val HG13 . 19599 1 40 . 1 1 4 4 VAL HG21 H 1 1.097 0.005 . 2 . . . . 4 Val HG21 . 19599 1 41 . 1 1 4 4 VAL HG22 H 1 1.097 0.005 . 2 . . . . 4 Val HG22 . 19599 1 42 . 1 1 4 4 VAL HG23 H 1 1.097 0.005 . 2 . . . . 4 Val HG23 . 19599 1 43 . 1 1 4 4 VAL C C 13 179.037 0.000 . 1 . . . . 4 Val C . 19599 1 44 . 1 1 4 4 VAL CA C 13 66.406 0.078 . 1 . . . . 4 Val CA . 19599 1 45 . 1 1 4 4 VAL CB C 13 31.871 0.059 . 1 . . . . 4 Val CB . 19599 1 46 . 1 1 4 4 VAL CG1 C 13 21.118 0.089 . 2 . . . . 4 Val CG1 . 19599 1 47 . 1 1 4 4 VAL CG2 C 13 22.794 0.037 . 2 . . . . 4 Val CG2 . 19599 1 48 . 1 1 4 4 VAL N N 15 119.898 0.020 . 1 . . . . 4 Val N . 19599 1 49 . 1 1 5 5 LEU H H 1 7.772 0.009 . 1 . . . . 5 Leu H . 19599 1 50 . 1 1 5 5 LEU HA H 1 4.132 0.011 . 1 . . . . 5 Leu HA . 19599 1 51 . 1 1 5 5 LEU HB3 H 1 1.890 0.011 . 1 . . . . 5 Leu HB3 . 19599 1 52 . 1 1 5 5 LEU HG H 1 1.833 0.007 . 1 . . . . 5 Leu HG . 19599 1 53 . 1 1 5 5 LEU HD11 H 1 0.931 0.007 . 1 . . . . 5 Leu HD11 . 19599 1 54 . 1 1 5 5 LEU HD12 H 1 0.931 0.007 . 1 . . . . 5 Leu HD12 . 19599 1 55 . 1 1 5 5 LEU HD13 H 1 0.931 0.007 . 1 . . . . 5 Leu HD13 . 19599 1 56 . 1 1 5 5 LEU C C 13 177.688 0.000 . 1 . . . . 5 Leu C . 19599 1 57 . 1 1 5 5 LEU CA C 13 58.164 0.039 . 1 . . . . 5 Leu CA . 19599 1 58 . 1 1 5 5 LEU CB C 13 42.189 0.065 . 1 . . . . 5 Leu CB . 19599 1 59 . 1 1 5 5 LEU CG C 13 27.642 0.052 . 1 . . . . 5 Leu CG . 19599 1 60 . 1 1 5 5 LEU CD1 C 13 24.908 0.142 . 1 . . . . 5 Leu CD1 . 19599 1 61 . 1 1 5 5 LEU N N 15 119.927 0.042 . 1 . . . . 5 Leu N . 19599 1 62 . 1 1 6 6 TYR H H 1 8.745 0.003 . 1 . . . . 6 Tyr H . 19599 1 63 . 1 1 6 6 TYR HA H 1 3.756 0.006 . 1 . . . . 6 Tyr HA . 19599 1 64 . 1 1 6 6 TYR HB2 H 1 3.405 0.016 . 2 . . . . 6 Tyr HB2 . 19599 1 65 . 1 1 6 6 TYR HB3 H 1 3.442 0.009 . 2 . . . . 6 Tyr HB3 . 19599 1 66 . 1 1 6 6 TYR HD1 H 1 7.069 0.031 . 3 . . . . 6 Tyr HD1 . 19599 1 67 . 1 1 6 6 TYR HD2 H 1 7.069 0.031 . 3 . . . . 6 Tyr HD2 . 19599 1 68 . 1 1 6 6 TYR HE1 H 1 6.638 0.001 . 3 . . . . 6 Tyr HE1 . 19599 1 69 . 1 1 6 6 TYR HE2 H 1 6.638 0.001 . 3 . . . . 6 Tyr HE2 . 19599 1 70 . 1 1 6 6 TYR C C 13 176.756 0.000 . 1 . . . . 6 Tyr C . 19599 1 71 . 1 1 6 6 TYR CA C 13 62.687 0.057 . 1 . . . . 6 Tyr CA . 19599 1 72 . 1 1 6 6 TYR CB C 13 38.951 0.043 . 1 . . . . 6 Tyr CB . 19599 1 73 . 1 1 6 6 TYR N N 15 120.278 0.027 . 1 . . . . 6 Tyr N . 19599 1 74 . 1 1 7 7 ASN H H 1 8.495 0.006 . 1 . . . . 7 Asn H . 19599 1 75 . 1 1 7 7 ASN HA H 1 4.500 0.004 . 1 . . . . 7 Asn HA . 19599 1 76 . 1 1 7 7 ASN HB2 H 1 2.853 0.004 . 2 . . . . 7 Asn HB2 . 19599 1 77 . 1 1 7 7 ASN HB3 H 1 2.980 0.006 . 2 . . . . 7 Asn HB3 . 19599 1 78 . 1 1 7 7 ASN HD21 H 1 7.571 0.003 . 1 . . . . 7 Asn HD21 . 19599 1 79 . 1 1 7 7 ASN HD22 H 1 6.869 0.007 . 1 . . . . 7 Asn HD22 . 19599 1 80 . 1 1 7 7 ASN C C 13 177.225 0.000 . 1 . . . . 7 Asn C . 19599 1 81 . 1 1 7 7 ASN CA C 13 55.888 0.139 . 1 . . . . 7 Asn CA . 19599 1 82 . 1 1 7 7 ASN CB C 13 38.179 0.053 . 1 . . . . 7 Asn CB . 19599 1 83 . 1 1 7 7 ASN N N 15 116.666 0.033 . 1 . . . . 7 Asn N . 19599 1 84 . 1 1 7 7 ASN ND2 N 15 111.193 0.206 . 1 . . . . 7 Asn ND2 . 19599 1 85 . 1 1 8 8 ARG H H 1 8.131 0.005 . 1 . . . . 8 Arg H . 19599 1 86 . 1 1 8 8 ARG HA H 1 4.005 0.009 . 1 . . . . 8 Arg HA . 19599 1 87 . 1 1 8 8 ARG HB2 H 1 1.938 0.004 . 2 . . . . 8 Arg HB2 . 19599 1 88 . 1 1 8 8 ARG HB3 H 1 2.059 0.008 . 2 . . . . 8 Arg HB3 . 19599 1 89 . 1 1 8 8 ARG HG3 H 1 1.683 0.005 . 1 . . . . 8 Arg HG3 . 19599 1 90 . 1 1 8 8 ARG HD2 H 1 3.167 0.006 . 2 . . . . 8 Arg HD2 . 19599 1 91 . 1 1 8 8 ARG HD3 H 1 3.101 0.013 . 2 . . . . 8 Arg HD3 . 19599 1 92 . 1 1 8 8 ARG HE H 1 7.209 0.002 . 1 . . . . 8 Arg HE . 19599 1 93 . 1 1 8 8 ARG C C 13 179.295 0.000 . 1 . . . . 8 Arg C . 19599 1 94 . 1 1 8 8 ARG CA C 13 59.749 0.070 . 1 . . . . 8 Arg CA . 19599 1 95 . 1 1 8 8 ARG CB C 13 30.334 0.130 . 1 . . . . 8 Arg CB . 19599 1 96 . 1 1 8 8 ARG CG C 13 27.804 0.071 . 1 . . . . 8 Arg CG . 19599 1 97 . 1 1 8 8 ARG CD C 13 43.874 0.093 . 1 . . . . 8 Arg CD . 19599 1 98 . 1 1 8 8 ARG N N 15 119.944 0.029 . 1 . . . . 8 Arg N . 19599 1 99 . 1 1 8 8 ARG NE N 15 84.047 0.000 . 1 . . . . 8 Arg NE . 19599 1 100 . 1 1 9 9 VAL H H 1 7.877 0.007 . 1 . . . . 9 Val H . 19599 1 101 . 1 1 9 9 VAL HA H 1 3.084 0.006 . 1 . . . . 9 Val HA . 19599 1 102 . 1 1 9 9 VAL HB H 1 1.442 0.006 . 1 . . . . 9 Val HB . 19599 1 103 . 1 1 9 9 VAL HG11 H 1 0.570 0.004 . 2 . . . . 9 Val HG11 . 19599 1 104 . 1 1 9 9 VAL HG12 H 1 0.570 0.004 . 2 . . . . 9 Val HG12 . 19599 1 105 . 1 1 9 9 VAL HG13 H 1 0.570 0.004 . 2 . . . . 9 Val HG13 . 19599 1 106 . 1 1 9 9 VAL HG21 H 1 -0.484 0.003 . 2 . . . . 9 Val HG21 . 19599 1 107 . 1 1 9 9 VAL HG22 H 1 -0.484 0.003 . 2 . . . . 9 Val HG22 . 19599 1 108 . 1 1 9 9 VAL HG23 H 1 -0.484 0.003 . 2 . . . . 9 Val HG23 . 19599 1 109 . 1 1 9 9 VAL C C 13 177.367 0.000 . 1 . . . . 9 Val C . 19599 1 110 . 1 1 9 9 VAL CA C 13 66.544 0.045 . 1 . . . . 9 Val CA . 19599 1 111 . 1 1 9 9 VAL CB C 13 31.369 0.183 . 1 . . . . 9 Val CB . 19599 1 112 . 1 1 9 9 VAL CG1 C 13 22.082 0.050 . 2 . . . . 9 Val CG1 . 19599 1 113 . 1 1 9 9 VAL CG2 C 13 21.368 0.087 . 2 . . . . 9 Val CG2 . 19599 1 114 . 1 1 9 9 VAL N N 15 120.326 0.011 . 1 . . . . 9 Val N . 19599 1 115 . 1 1 10 10 ALA H H 1 7.681 0.007 . 1 . . . . 10 Ala H . 19599 1 116 . 1 1 10 10 ALA HA H 1 3.771 0.003 . 1 . . . . 10 Ala HA . 19599 1 117 . 1 1 10 10 ALA HB1 H 1 1.416 0.004 . 1 . . . . 10 Ala HB1 . 19599 1 118 . 1 1 10 10 ALA HB2 H 1 1.416 0.004 . 1 . . . . 10 Ala HB2 . 19599 1 119 . 1 1 10 10 ALA HB3 H 1 1.416 0.004 . 1 . . . . 10 Ala HB3 . 19599 1 120 . 1 1 10 10 ALA C C 13 180.857 0.000 . 1 . . . . 10 Ala C . 19599 1 121 . 1 1 10 10 ALA CA C 13 55.481 0.036 . 1 . . . . 10 Ala CA . 19599 1 122 . 1 1 10 10 ALA CB C 13 18.134 0.044 . 1 . . . . 10 Ala CB . 19599 1 123 . 1 1 10 10 ALA N N 15 122.609 0.061 . 1 . . . . 10 Ala N . 19599 1 124 . 1 1 11 11 VAL H H 1 8.286 0.007 . 1 . . . . 11 Val H . 19599 1 125 . 1 1 11 11 VAL HA H 1 3.762 0.006 . 1 . . . . 11 Val HA . 19599 1 126 . 1 1 11 11 VAL HB H 1 2.033 0.003 . 1 . . . . 11 Val HB . 19599 1 127 . 1 1 11 11 VAL HG11 H 1 0.946 0.005 . 2 . . . . 11 Val HG11 . 19599 1 128 . 1 1 11 11 VAL HG12 H 1 0.946 0.005 . 2 . . . . 11 Val HG12 . 19599 1 129 . 1 1 11 11 VAL HG13 H 1 0.946 0.005 . 2 . . . . 11 Val HG13 . 19599 1 130 . 1 1 11 11 VAL HG21 H 1 1.077 0.004 . 2 . . . . 11 Val HG21 . 19599 1 131 . 1 1 11 11 VAL HG22 H 1 1.077 0.004 . 2 . . . . 11 Val HG22 . 19599 1 132 . 1 1 11 11 VAL HG23 H 1 1.077 0.004 . 2 . . . . 11 Val HG23 . 19599 1 133 . 1 1 11 11 VAL C C 13 178.299 0.000 . 1 . . . . 11 Val C . 19599 1 134 . 1 1 11 11 VAL CA C 13 66.153 0.050 . 1 . . . . 11 Val CA . 19599 1 135 . 1 1 11 11 VAL CB C 13 32.104 0.084 . 1 . . . . 11 Val CB . 19599 1 136 . 1 1 11 11 VAL CG1 C 13 21.146 0.011 . 2 . . . . 11 Val CG1 . 19599 1 137 . 1 1 11 11 VAL CG2 C 13 23.120 0.058 . 2 . . . . 11 Val CG2 . 19599 1 138 . 1 1 11 11 VAL N N 15 118.494 0.039 . 1 . . . . 11 Val N . 19599 1 139 . 1 1 12 12 GLN H H 1 7.721 0.009 . 1 . . . . 12 Gln H . 19599 1 140 . 1 1 12 12 GLN HA H 1 4.093 0.009 . 1 . . . . 12 Gln HA . 19599 1 141 . 1 1 12 12 GLN HB2 H 1 1.864 0.006 . 2 . . . . 12 Gln HB2 . 19599 1 142 . 1 1 12 12 GLN HB3 H 1 2.064 0.012 . 2 . . . . 12 Gln HB3 . 19599 1 143 . 1 1 12 12 GLN HG2 H 1 2.304 0.008 . 2 . . . . 12 Gln HG2 . 19599 1 144 . 1 1 12 12 GLN HG3 H 1 2.018 0.011 . 2 . . . . 12 Gln HG3 . 19599 1 145 . 1 1 12 12 GLN HE21 H 1 7.139 0.007 . 1 . . . . 12 Gln HE21 . 19599 1 146 . 1 1 12 12 GLN HE22 H 1 7.559 0.008 . 1 . . . . 12 Gln HE22 . 19599 1 147 . 1 1 12 12 GLN C C 13 178.108 0.000 . 1 . . . . 12 Gln C . 19599 1 148 . 1 1 12 12 GLN CA C 13 57.390 0.050 . 1 . . . . 12 Gln CA . 19599 1 149 . 1 1 12 12 GLN CB C 13 26.236 0.063 . 1 . . . . 12 Gln CB . 19599 1 150 . 1 1 12 12 GLN CG C 13 32.029 0.111 . 1 . . . . 12 Gln CG . 19599 1 151 . 1 1 12 12 GLN N N 15 120.547 0.043 . 1 . . . . 12 Gln N . 19599 1 152 . 1 1 12 12 GLN NE2 N 15 110.428 0.035 . 1 . . . . 12 Gln NE2 . 19599 1 153 . 1 1 13 13 GLY H H 1 8.630 0.007 . 1 . . . . 13 Gly H . 19599 1 154 . 1 1 13 13 GLY HA2 H 1 3.941 0.007 . 2 . . . . 13 Gly HA2 . 19599 1 155 . 1 1 13 13 GLY HA3 H 1 3.648 0.004 . 2 . . . . 13 Gly HA3 . 19599 1 156 . 1 1 13 13 GLY C C 13 176.318 0.000 . 1 . . . . 13 Gly C . 19599 1 157 . 1 1 13 13 GLY CA C 13 47.244 0.034 . 1 . . . . 13 Gly CA . 19599 1 158 . 1 1 13 13 GLY N N 15 108.549 0.048 . 1 . . . . 13 Gly N . 19599 1 159 . 1 1 14 14 ASP H H 1 7.668 0.008 . 1 . . . . 14 Asp H . 19599 1 160 . 1 1 14 14 ASP HA H 1 4.510 0.008 . 1 . . . . 14 Asp HA . 19599 1 161 . 1 1 14 14 ASP HB2 H 1 2.712 0.002 . 2 . . . . 14 Asp HB2 . 19599 1 162 . 1 1 14 14 ASP HB3 H 1 2.965 0.004 . 2 . . . . 14 Asp HB3 . 19599 1 163 . 1 1 14 14 ASP C C 13 177.772 0.000 . 1 . . . . 14 Asp C . 19599 1 164 . 1 1 14 14 ASP CA C 13 57.394 0.051 . 1 . . . . 14 Asp CA . 19599 1 165 . 1 1 14 14 ASP CB C 13 40.137 0.058 . 1 . . . . 14 Asp CB . 19599 1 166 . 1 1 14 14 ASP N N 15 124.046 0.032 . 1 . . . . 14 Asp N . 19599 1 167 . 1 1 15 15 VAL H H 1 7.984 0.010 . 1 . . . . 15 Val H . 19599 1 168 . 1 1 15 15 VAL HA H 1 3.635 0.024 . 1 . . . . 15 Val HA . 19599 1 169 . 1 1 15 15 VAL HB H 1 2.309 0.005 . 1 . . . . 15 Val HB . 19599 1 170 . 1 1 15 15 VAL HG11 H 1 1.005 0.010 . 2 . . . . 15 Val HG11 . 19599 1 171 . 1 1 15 15 VAL HG12 H 1 1.005 0.010 . 2 . . . . 15 Val HG12 . 19599 1 172 . 1 1 15 15 VAL HG13 H 1 1.005 0.010 . 2 . . . . 15 Val HG13 . 19599 1 173 . 1 1 15 15 VAL HG21 H 1 0.884 0.004 . 2 . . . . 15 Val HG21 . 19599 1 174 . 1 1 15 15 VAL HG22 H 1 0.884 0.004 . 2 . . . . 15 Val HG22 . 19599 1 175 . 1 1 15 15 VAL HG23 H 1 0.884 0.004 . 2 . . . . 15 Val HG23 . 19599 1 176 . 1 1 15 15 VAL C C 13 178.170 0.000 . 1 . . . . 15 Val C . 19599 1 177 . 1 1 15 15 VAL CA C 13 66.717 0.024 . 1 . . . . 15 Val CA . 19599 1 178 . 1 1 15 15 VAL CB C 13 31.484 0.059 . 1 . . . . 15 Val CB . 19599 1 179 . 1 1 15 15 VAL CG1 C 13 22.702 0.022 . 2 . . . . 15 Val CG1 . 19599 1 180 . 1 1 15 15 VAL CG2 C 13 20.980 0.071 . 2 . . . . 15 Val CG2 . 19599 1 181 . 1 1 15 15 VAL N N 15 123.303 0.033 . 1 . . . . 15 Val N . 19599 1 182 . 1 1 16 16 VAL H H 1 7.912 0.009 . 1 . . . . 16 Val H . 19599 1 183 . 1 1 16 16 VAL HA H 1 3.311 0.005 . 1 . . . . 16 Val HA . 19599 1 184 . 1 1 16 16 VAL HB H 1 2.194 0.006 . 1 . . . . 16 Val HB . 19599 1 185 . 1 1 16 16 VAL HG11 H 1 0.867 0.004 . 2 . . . . 16 Val HG11 . 19599 1 186 . 1 1 16 16 VAL HG12 H 1 0.867 0.004 . 2 . . . . 16 Val HG12 . 19599 1 187 . 1 1 16 16 VAL HG13 H 1 0.867 0.004 . 2 . . . . 16 Val HG13 . 19599 1 188 . 1 1 16 16 VAL HG21 H 1 1.033 0.013 . 2 . . . . 16 Val HG21 . 19599 1 189 . 1 1 16 16 VAL HG22 H 1 1.033 0.013 . 2 . . . . 16 Val HG22 . 19599 1 190 . 1 1 16 16 VAL HG23 H 1 1.033 0.013 . 2 . . . . 16 Val HG23 . 19599 1 191 . 1 1 16 16 VAL C C 13 176.679 0.000 . 1 . . . . 16 Val C . 19599 1 192 . 1 1 16 16 VAL CA C 13 67.678 0.020 . 1 . . . . 16 Val CA . 19599 1 193 . 1 1 16 16 VAL CB C 13 31.961 0.057 . 1 . . . . 16 Val CB . 19599 1 194 . 1 1 16 16 VAL CG1 C 13 21.812 0.039 . 2 . . . . 16 Val CG1 . 19599 1 195 . 1 1 16 16 VAL CG2 C 13 24.199 0.026 . 2 . . . . 16 Val CG2 . 19599 1 196 . 1 1 16 16 VAL N N 15 118.379 0.045 . 1 . . . . 16 Val N . 19599 1 197 . 1 1 17 17 ARG H H 1 7.738 0.007 . 1 . . . . 17 Arg H . 19599 1 198 . 1 1 17 17 ARG HA H 1 3.862 0.013 . 1 . . . . 17 Arg HA . 19599 1 199 . 1 1 17 17 ARG HB2 H 1 1.952 0.010 . 2 . . . . 17 Arg HB2 . 19599 1 200 . 1 1 17 17 ARG HB3 H 1 2.011 0.002 . 2 . . . . 17 Arg HB3 . 19599 1 201 . 1 1 17 17 ARG HG2 H 1 1.550 0.009 . 2 . . . . 17 Arg HG2 . 19599 1 202 . 1 1 17 17 ARG HG3 H 1 1.761 0.007 . 2 . . . . 17 Arg HG3 . 19599 1 203 . 1 1 17 17 ARG HD2 H 1 3.204 0.001 . 2 . . . . 17 Arg HD2 . 19599 1 204 . 1 1 17 17 ARG HD3 H 1 3.245 0.020 . 2 . . . . 17 Arg HD3 . 19599 1 205 . 1 1 17 17 ARG HE H 1 7.323 0.002 . 1 . . . . 17 Arg HE . 19599 1 206 . 1 1 17 17 ARG C C 13 179.176 0.000 . 1 . . . . 17 Arg C . 19599 1 207 . 1 1 17 17 ARG CA C 13 60.026 0.058 . 1 . . . . 17 Arg CA . 19599 1 208 . 1 1 17 17 ARG CB C 13 30.161 0.022 . 1 . . . . 17 Arg CB . 19599 1 209 . 1 1 17 17 ARG CG C 13 27.467 0.048 . 1 . . . . 17 Arg CG . 19599 1 210 . 1 1 17 17 ARG CD C 13 43.145 0.042 . 1 . . . . 17 Arg CD . 19599 1 211 . 1 1 17 17 ARG N N 15 117.818 0.019 . 1 . . . . 17 Arg N . 19599 1 212 . 1 1 17 17 ARG NE N 15 83.140 0.000 . 1 . . . . 17 Arg NE . 19599 1 213 . 1 1 18 18 GLU H H 1 8.404 0.009 . 1 . . . . 18 Glu H . 19599 1 214 . 1 1 18 18 GLU HA H 1 4.084 0.008 . 1 . . . . 18 Glu HA . 19599 1 215 . 1 1 18 18 GLU HB2 H 1 2.121 0.011 . 2 . . . . 18 Glu HB2 . 19599 1 216 . 1 1 18 18 GLU HB3 H 1 2.083 0.009 . 2 . . . . 18 Glu HB3 . 19599 1 217 . 1 1 18 18 GLU HG2 H 1 2.271 0.003 . 2 . . . . 18 Glu HG2 . 19599 1 218 . 1 1 18 18 GLU HG3 H 1 2.344 0.008 . 2 . . . . 18 Glu HG3 . 19599 1 219 . 1 1 18 18 GLU C C 13 178.429 0.000 . 1 . . . . 18 Glu C . 19599 1 220 . 1 1 18 18 GLU CA C 13 59.187 0.018 . 1 . . . . 18 Glu CA . 19599 1 221 . 1 1 18 18 GLU CB C 13 29.059 0.108 . 1 . . . . 18 Glu CB . 19599 1 222 . 1 1 18 18 GLU CG C 13 35.618 0.026 . 1 . . . . 18 Glu CG . 19599 1 223 . 1 1 18 18 GLU N N 15 120.693 0.078 . 1 . . . . 18 Glu N . 19599 1 224 . 1 1 19 19 LEU H H 1 8.407 0.007 . 1 . . . . 19 Leu H . 19599 1 225 . 1 1 19 19 LEU HA H 1 3.926 0.008 . 1 . . . . 19 Leu HA . 19599 1 226 . 1 1 19 19 LEU HB2 H 1 1.177 0.010 . 2 . . . . 19 Leu HB2 . 19599 1 227 . 1 1 19 19 LEU HB3 H 1 1.915 0.012 . 2 . . . . 19 Leu HB3 . 19599 1 228 . 1 1 19 19 LEU HG H 1 1.900 0.008 . 1 . . . . 19 Leu HG . 19599 1 229 . 1 1 19 19 LEU HD11 H 1 0.738 0.012 . 2 . . . . 19 Leu HD11 . 19599 1 230 . 1 1 19 19 LEU HD12 H 1 0.738 0.012 . 2 . . . . 19 Leu HD12 . 19599 1 231 . 1 1 19 19 LEU HD13 H 1 0.738 0.012 . 2 . . . . 19 Leu HD13 . 19599 1 232 . 1 1 19 19 LEU HD21 H 1 0.673 0.013 . 2 . . . . 19 Leu HD21 . 19599 1 233 . 1 1 19 19 LEU HD22 H 1 0.673 0.013 . 2 . . . . 19 Leu HD22 . 19599 1 234 . 1 1 19 19 LEU HD23 H 1 0.673 0.013 . 2 . . . . 19 Leu HD23 . 19599 1 235 . 1 1 19 19 LEU C C 13 179.206 0.000 . 1 . . . . 19 Leu C . 19599 1 236 . 1 1 19 19 LEU CA C 13 58.095 0.066 . 1 . . . . 19 Leu CA . 19599 1 237 . 1 1 19 19 LEU CB C 13 42.698 0.072 . 1 . . . . 19 Leu CB . 19599 1 238 . 1 1 19 19 LEU CG C 13 26.651 0.020 . 1 . . . . 19 Leu CG . 19599 1 239 . 1 1 19 19 LEU CD1 C 13 22.677 0.057 . 2 . . . . 19 Leu CD1 . 19599 1 240 . 1 1 19 19 LEU CD2 C 13 27.497 0.064 . 2 . . . . 19 Leu CD2 . 19599 1 241 . 1 1 19 19 LEU N N 15 119.949 0.053 . 1 . . . . 19 Leu N . 19599 1 242 . 1 1 20 20 LYS H H 1 8.081 0.007 . 1 . . . . 20 Lys H . 19599 1 243 . 1 1 20 20 LYS HA H 1 4.019 0.015 . 1 . . . . 20 Lys HA . 19599 1 244 . 1 1 20 20 LYS HB3 H 1 1.827 0.009 . 1 . . . . 20 Lys HB3 . 19599 1 245 . 1 1 20 20 LYS HG2 H 1 1.360 0.015 . 2 . . . . 20 Lys HG2 . 19599 1 246 . 1 1 20 20 LYS HG3 H 1 1.692 0.007 . 2 . . . . 20 Lys HG3 . 19599 1 247 . 1 1 20 20 LYS HD3 H 1 1.599 0.023 . 1 . . . . 20 Lys HD3 . 19599 1 248 . 1 1 20 20 LYS HE2 H 1 2.840 0.002 . 2 . . . . 20 Lys HE2 . 19599 1 249 . 1 1 20 20 LYS HE3 H 1 2.685 0.004 . 2 . . . . 20 Lys HE3 . 19599 1 250 . 1 1 20 20 LYS C C 13 180.509 0.000 . 1 . . . . 20 Lys C . 19599 1 251 . 1 1 20 20 LYS CA C 13 59.897 0.080 . 1 . . . . 20 Lys CA . 19599 1 252 . 1 1 20 20 LYS CB C 13 32.593 0.085 . 1 . . . . 20 Lys CB . 19599 1 253 . 1 1 20 20 LYS CG C 13 26.796 0.062 . 1 . . . . 20 Lys CG . 19599 1 254 . 1 1 20 20 LYS CD C 13 30.076 0.090 . 1 . . . . 20 Lys CD . 19599 1 255 . 1 1 20 20 LYS CE C 13 41.803 0.000 . 1 . . . . 20 Lys CE . 19599 1 256 . 1 1 20 20 LYS N N 15 116.827 0.020 . 1 . . . . 20 Lys N . 19599 1 257 . 1 1 21 21 ALA H H 1 8.263 0.006 . 1 . . . . 21 Ala H . 19599 1 258 . 1 1 21 21 ALA HA H 1 4.113 0.009 . 1 . . . . 21 Ala HA . 19599 1 259 . 1 1 21 21 ALA HB1 H 1 1.510 0.002 . 1 . . . . 21 Ala HB1 . 19599 1 260 . 1 1 21 21 ALA HB2 H 1 1.510 0.002 . 1 . . . . 21 Ala HB2 . 19599 1 261 . 1 1 21 21 ALA HB3 H 1 1.510 0.002 . 1 . . . . 21 Ala HB3 . 19599 1 262 . 1 1 21 21 ALA C C 13 178.989 0.000 . 1 . . . . 21 Ala C . 19599 1 263 . 1 1 21 21 ALA CA C 13 54.988 0.023 . 1 . . . . 21 Ala CA . 19599 1 264 . 1 1 21 21 ALA CB C 13 18.180 0.041 . 1 . . . . 21 Ala CB . 19599 1 265 . 1 1 21 21 ALA N N 15 123.588 0.041 . 1 . . . . 21 Ala N . 19599 1 266 . 1 1 22 22 LYS H H 1 7.838 0.005 . 1 . . . . 22 Lys H . 19599 1 267 . 1 1 22 22 LYS HA H 1 4.292 0.009 . 1 . . . . 22 Lys HA . 19599 1 268 . 1 1 22 22 LYS HB3 H 1 1.889 0.006 . 1 . . . . 22 Lys HB3 . 19599 1 269 . 1 1 22 22 LYS HG2 H 1 1.505 0.002 . 2 . . . . 22 Lys HG2 . 19599 1 270 . 1 1 22 22 LYS HG3 H 1 1.614 0.006 . 2 . . . . 22 Lys HG3 . 19599 1 271 . 1 1 22 22 LYS HD3 H 1 1.630 0.008 . 1 . . . . 22 Lys HD3 . 19599 1 272 . 1 1 22 22 LYS HE3 H 1 2.920 0.008 . 1 . . . . 22 Lys HE3 . 19599 1 273 . 1 1 22 22 LYS C C 13 175.189 0.000 . 1 . . . . 22 Lys C . 19599 1 274 . 1 1 22 22 LYS CA C 13 55.670 0.014 . 1 . . . . 22 Lys CA . 19599 1 275 . 1 1 22 22 LYS CB C 13 32.108 0.035 . 1 . . . . 22 Lys CB . 19599 1 276 . 1 1 22 22 LYS CG C 13 24.821 0.046 . 1 . . . . 22 Lys CG . 19599 1 277 . 1 1 22 22 LYS CD C 13 29.271 0.047 . 1 . . . . 22 Lys CD . 19599 1 278 . 1 1 22 22 LYS CE C 13 42.090 0.045 . 1 . . . . 22 Lys CE . 19599 1 279 . 1 1 22 22 LYS N N 15 115.144 0.016 . 1 . . . . 22 Lys N . 19599 1 280 . 1 1 23 23 LYS H H 1 7.833 0.005 . 1 . . . . 23 Lys H . 19599 1 281 . 1 1 23 23 LYS HA H 1 3.868 0.006 . 1 . . . . 23 Lys HA . 19599 1 282 . 1 1 23 23 LYS HB2 H 1 1.810 0.004 . 2 . . . . 23 Lys HB2 . 19599 1 283 . 1 1 23 23 LYS HB3 H 1 2.013 0.006 . 2 . . . . 23 Lys HB3 . 19599 1 284 . 1 1 23 23 LYS HG3 H 1 1.328 0.003 . 1 . . . . 23 Lys HG3 . 19599 1 285 . 1 1 23 23 LYS HD3 H 1 1.645 0.024 . 1 . . . . 23 Lys HD3 . 19599 1 286 . 1 1 23 23 LYS HE3 H 1 2.974 0.003 . 1 . . . . 23 Lys HE3 . 19599 1 287 . 1 1 23 23 LYS C C 13 175.383 0.000 . 1 . . . . 23 Lys C . 19599 1 288 . 1 1 23 23 LYS CA C 13 56.847 0.102 . 1 . . . . 23 Lys CA . 19599 1 289 . 1 1 23 23 LYS CB C 13 28.677 0.155 . 1 . . . . 23 Lys CB . 19599 1 290 . 1 1 23 23 LYS CG C 13 24.923 0.093 . 1 . . . . 23 Lys CG . 19599 1 291 . 1 1 23 23 LYS N N 15 117.379 0.032 . 1 . . . . 23 Lys N . 19599 1 292 . 1 1 24 24 ALA H H 1 7.727 0.004 . 1 . . . . 24 Ala H . 19599 1 293 . 1 1 24 24 ALA HA H 1 4.394 0.003 . 1 . . . . 24 Ala HA . 19599 1 294 . 1 1 24 24 ALA HB1 H 1 1.316 0.010 . 1 . . . . 24 Ala HB1 . 19599 1 295 . 1 1 24 24 ALA HB2 H 1 1.316 0.010 . 1 . . . . 24 Ala HB2 . 19599 1 296 . 1 1 24 24 ALA HB3 H 1 1.316 0.010 . 1 . . . . 24 Ala HB3 . 19599 1 297 . 1 1 24 24 ALA CA C 13 51.241 0.037 . 1 . . . . 24 Ala CA . 19599 1 298 . 1 1 24 24 ALA CB C 13 18.516 0.058 . 1 . . . . 24 Ala CB . 19599 1 299 . 1 1 24 24 ALA N N 15 120.704 0.050 . 1 . . . . 24 Ala N . 19599 1 300 . 1 1 25 25 PRO HA H 1 4.326 0.008 . 1 . . . . 25 Pro HA . 19599 1 301 . 1 1 25 25 PRO HB2 H 1 2.442 0.003 . 2 . . . . 25 Pro HB2 . 19599 1 302 . 1 1 25 25 PRO HB3 H 1 1.839 0.007 . 2 . . . . 25 Pro HB3 . 19599 1 303 . 1 1 25 25 PRO HG2 H 1 2.016 0.010 . 2 . . . . 25 Pro HG2 . 19599 1 304 . 1 1 25 25 PRO HG3 H 1 2.104 0.000 . 2 . . . . 25 Pro HG3 . 19599 1 305 . 1 1 25 25 PRO HD2 H 1 3.672 0.001 . 2 . . . . 25 Pro HD2 . 19599 1 306 . 1 1 25 25 PRO HD3 H 1 3.837 0.013 . 2 . . . . 25 Pro HD3 . 19599 1 307 . 1 1 25 25 PRO C C 13 177.152 0.000 . 1 . . . . 25 Pro C . 19599 1 308 . 1 1 25 25 PRO CA C 13 63.107 0.072 . 1 . . . . 25 Pro CA . 19599 1 309 . 1 1 25 25 PRO CB C 13 32.545 0.160 . 1 . . . . 25 Pro CB . 19599 1 310 . 1 1 25 25 PRO CG C 13 28.349 0.179 . 1 . . . . 25 Pro CG . 19599 1 311 . 1 1 25 25 PRO CD C 13 50.242 0.056 . 1 . . . . 25 Pro CD . 19599 1 312 . 1 1 26 26 LYS H H 1 8.670 0.003 . 1 . . . . 26 Lys H . 19599 1 313 . 1 1 26 26 LYS HA H 1 3.831 0.002 . 1 . . . . 26 Lys HA . 19599 1 314 . 1 1 26 26 LYS HB2 H 1 1.711 0.001 . 2 . . . . 26 Lys HB2 . 19599 1 315 . 1 1 26 26 LYS HB3 H 1 1.910 0.005 . 2 . . . . 26 Lys HB3 . 19599 1 316 . 1 1 26 26 LYS HG3 H 1 1.401 0.004 . 1 . . . . 26 Lys HG3 . 19599 1 317 . 1 1 26 26 LYS HD3 H 1 1.620 0.019 . 1 . . . . 26 Lys HD3 . 19599 1 318 . 1 1 26 26 LYS HE3 H 1 3.002 0.000 . 1 . . . . 26 Lys HE3 . 19599 1 319 . 1 1 26 26 LYS C C 13 177.313 0.000 . 1 . . . . 26 Lys C . 19599 1 320 . 1 1 26 26 LYS CA C 13 59.966 0.118 . 1 . . . . 26 Lys CA . 19599 1 321 . 1 1 26 26 LYS CB C 13 32.690 0.091 . 1 . . . . 26 Lys CB . 19599 1 322 . 1 1 26 26 LYS CG C 13 24.574 0.114 . 1 . . . . 26 Lys CG . 19599 1 323 . 1 1 26 26 LYS N N 15 125.095 0.035 . 1 . . . . 26 Lys N . 19599 1 324 . 1 1 27 27 GLU H H 1 9.371 0.006 . 1 . . . . 27 Glu H . 19599 1 325 . 1 1 27 27 GLU HA H 1 4.085 0.004 . 1 . . . . 27 Glu HA . 19599 1 326 . 1 1 27 27 GLU HB2 H 1 1.980 0.004 . 1 . . . . 27 Glu HB2 . 19599 1 327 . 1 1 27 27 GLU HG2 H 1 2.320 0.008 . 2 . . . . 27 Glu HG2 . 19599 1 328 . 1 1 27 27 GLU HG3 H 1 2.421 0.012 . 2 . . . . 27 Glu HG3 . 19599 1 329 . 1 1 27 27 GLU C C 13 178.844 0.000 . 1 . . . . 27 Glu C . 19599 1 330 . 1 1 27 27 GLU CA C 13 60.047 0.072 . 1 . . . . 27 Glu CA . 19599 1 331 . 1 1 27 27 GLU CB C 13 28.510 0.052 . 1 . . . . 27 Glu CB . 19599 1 332 . 1 1 27 27 GLU CG C 13 36.142 0.109 . 1 . . . . 27 Glu CG . 19599 1 333 . 1 1 27 27 GLU N N 15 116.113 0.015 . 1 . . . . 27 Glu N . 19599 1 334 . 1 1 28 28 ASP H H 1 7.426 0.010 . 1 . . . . 28 Asp H . 19599 1 335 . 1 1 28 28 ASP HA H 1 4.454 0.008 . 1 . . . . 28 Asp HA . 19599 1 336 . 1 1 28 28 ASP HB2 H 1 2.546 0.001 . 2 . . . . 28 Asp HB2 . 19599 1 337 . 1 1 28 28 ASP HB3 H 1 2.798 0.012 . 2 . . . . 28 Asp HB3 . 19599 1 338 . 1 1 28 28 ASP C C 13 178.788 0.000 . 1 . . . . 28 Asp C . 19599 1 339 . 1 1 28 28 ASP CA C 13 56.752 0.056 . 1 . . . . 28 Asp CA . 19599 1 340 . 1 1 28 28 ASP CB C 13 40.029 0.038 . 1 . . . . 28 Asp CB . 19599 1 341 . 1 1 28 28 ASP N N 15 120.445 0.053 . 1 . . . . 28 Asp N . 19599 1 342 . 1 1 29 29 VAL H H 1 7.761 0.006 . 1 . . . . 29 Val H . 19599 1 343 . 1 1 29 29 VAL HA H 1 3.392 0.012 . 1 . . . . 29 Val HA . 19599 1 344 . 1 1 29 29 VAL HB H 1 2.118 0.009 . 1 . . . . 29 Val HB . 19599 1 345 . 1 1 29 29 VAL HG11 H 1 0.897 0.006 . 2 . . . . 29 Val HG11 . 19599 1 346 . 1 1 29 29 VAL HG12 H 1 0.897 0.006 . 2 . . . . 29 Val HG12 . 19599 1 347 . 1 1 29 29 VAL HG13 H 1 0.897 0.006 . 2 . . . . 29 Val HG13 . 19599 1 348 . 1 1 29 29 VAL HG21 H 1 0.833 0.012 . 2 . . . . 29 Val HG21 . 19599 1 349 . 1 1 29 29 VAL HG22 H 1 0.833 0.012 . 2 . . . . 29 Val HG22 . 19599 1 350 . 1 1 29 29 VAL HG23 H 1 0.833 0.012 . 2 . . . . 29 Val HG23 . 19599 1 351 . 1 1 29 29 VAL C C 13 177.133 0.000 . 1 . . . . 29 Val C . 19599 1 352 . 1 1 29 29 VAL CA C 13 67.462 0.040 . 1 . . . . 29 Val CA . 19599 1 353 . 1 1 29 29 VAL CB C 13 31.865 0.029 . 1 . . . . 29 Val CB . 19599 1 354 . 1 1 29 29 VAL CG1 C 13 22.113 0.035 . 2 . . . . 29 Val CG1 . 19599 1 355 . 1 1 29 29 VAL CG2 C 13 22.847 0.033 . 2 . . . . 29 Val CG2 . 19599 1 356 . 1 1 29 29 VAL N N 15 122.683 0.023 . 1 . . . . 29 Val N . 19599 1 357 . 1 1 30 30 ASP H H 1 9.096 0.005 . 1 . . . . 30 Asp H . 19599 1 358 . 1 1 30 30 ASP HA H 1 4.272 0.005 . 1 . . . . 30 Asp HA . 19599 1 359 . 1 1 30 30 ASP HB2 H 1 2.546 0.006 . 2 . . . . 30 Asp HB2 . 19599 1 360 . 1 1 30 30 ASP HB3 H 1 2.673 0.005 . 2 . . . . 30 Asp HB3 . 19599 1 361 . 1 1 30 30 ASP C C 13 179.100 0.000 . 1 . . . . 30 Asp C . 19599 1 362 . 1 1 30 30 ASP CA C 13 57.429 0.025 . 1 . . . . 30 Asp CA . 19599 1 363 . 1 1 30 30 ASP CB C 13 39.887 0.064 . 1 . . . . 30 Asp CB . 19599 1 364 . 1 1 30 30 ASP N N 15 119.161 0.015 . 1 . . . . 30 Asp N . 19599 1 365 . 1 1 31 31 ALA H H 1 7.577 0.009 . 1 . . . . 31 Ala H . 19599 1 366 . 1 1 31 31 ALA HA H 1 4.124 0.010 . 1 . . . . 31 Ala HA . 19599 1 367 . 1 1 31 31 ALA HB1 H 1 1.502 0.002 . 1 . . . . 31 Ala HB1 . 19599 1 368 . 1 1 31 31 ALA HB2 H 1 1.502 0.002 . 1 . . . . 31 Ala HB2 . 19599 1 369 . 1 1 31 31 ALA HB3 H 1 1.502 0.002 . 1 . . . . 31 Ala HB3 . 19599 1 370 . 1 1 31 31 ALA C C 13 179.758 0.000 . 1 . . . . 31 Ala C . 19599 1 371 . 1 1 31 31 ALA CA C 13 55.130 0.070 . 1 . . . . 31 Ala CA . 19599 1 372 . 1 1 31 31 ALA CB C 13 18.191 0.064 . 1 . . . . 31 Ala CB . 19599 1 373 . 1 1 31 31 ALA N N 15 121.464 0.018 . 1 . . . . 31 Ala N . 19599 1 374 . 1 1 32 32 ALA H H 1 7.654 0.012 . 1 . . . . 32 Ala H . 19599 1 375 . 1 1 32 32 ALA HA H 1 4.079 0.005 . 1 . . . . 32 Ala HA . 19599 1 376 . 1 1 32 32 ALA HB1 H 1 1.426 0.007 . 1 . . . . 32 Ala HB1 . 19599 1 377 . 1 1 32 32 ALA HB2 H 1 1.426 0.007 . 1 . . . . 32 Ala HB2 . 19599 1 378 . 1 1 32 32 ALA HB3 H 1 1.426 0.007 . 1 . . . . 32 Ala HB3 . 19599 1 379 . 1 1 32 32 ALA C C 13 180.394 0.000 . 1 . . . . 32 Ala C . 19599 1 380 . 1 1 32 32 ALA CA C 13 54.602 0.051 . 1 . . . . 32 Ala CA . 19599 1 381 . 1 1 32 32 ALA CB C 13 19.199 0.040 . 1 . . . . 32 Ala CB . 19599 1 382 . 1 1 32 32 ALA N N 15 122.503 0.058 . 1 . . . . 32 Ala N . 19599 1 383 . 1 1 33 33 VAL H H 1 8.937 0.007 . 1 . . . . 33 Val H . 19599 1 384 . 1 1 33 33 VAL HA H 1 3.536 0.005 . 1 . . . . 33 Val HA . 19599 1 385 . 1 1 33 33 VAL HB H 1 2.202 0.006 . 1 . . . . 33 Val HB . 19599 1 386 . 1 1 33 33 VAL HG11 H 1 1.076 0.015 . 2 . . . . 33 Val HG11 . 19599 1 387 . 1 1 33 33 VAL HG12 H 1 1.076 0.015 . 2 . . . . 33 Val HG12 . 19599 1 388 . 1 1 33 33 VAL HG13 H 1 1.076 0.015 . 2 . . . . 33 Val HG13 . 19599 1 389 . 1 1 33 33 VAL HG21 H 1 0.925 0.007 . 2 . . . . 33 Val HG21 . 19599 1 390 . 1 1 33 33 VAL HG22 H 1 0.925 0.007 . 2 . . . . 33 Val HG22 . 19599 1 391 . 1 1 33 33 VAL HG23 H 1 0.925 0.007 . 2 . . . . 33 Val HG23 . 19599 1 392 . 1 1 33 33 VAL C C 13 177.249 0.000 . 1 . . . . 33 Val C . 19599 1 393 . 1 1 33 33 VAL CA C 13 66.712 0.042 . 1 . . . . 33 Val CA . 19599 1 394 . 1 1 33 33 VAL CB C 13 32.039 0.039 . 1 . . . . 33 Val CB . 19599 1 395 . 1 1 33 33 VAL CG1 C 13 24.142 0.019 . 2 . . . . 33 Val CG1 . 19599 1 396 . 1 1 33 33 VAL CG2 C 13 21.180 0.040 . 2 . . . . 33 Val CG2 . 19599 1 397 . 1 1 33 33 VAL N N 15 122.811 0.034 . 1 . . . . 33 Val N . 19599 1 398 . 1 1 34 34 LYS H H 1 8.231 0.006 . 1 . . . . 34 Lys H . 19599 1 399 . 1 1 34 34 LYS HA H 1 3.929 0.006 . 1 . . . . 34 Lys HA . 19599 1 400 . 1 1 34 34 LYS HB3 H 1 1.916 0.008 . 1 . . . . 34 Lys HB3 . 19599 1 401 . 1 1 34 34 LYS HG2 H 1 1.384 0.003 . 2 . . . . 34 Lys HG2 . 19599 1 402 . 1 1 34 34 LYS HG3 H 1 1.525 0.007 . 2 . . . . 34 Lys HG3 . 19599 1 403 . 1 1 34 34 LYS HE3 H 1 2.929 0.002 . 1 . . . . 34 Lys HE3 . 19599 1 404 . 1 1 34 34 LYS C C 13 179.422 0.000 . 1 . . . . 34 Lys C . 19599 1 405 . 1 1 34 34 LYS CA C 13 60.245 0.105 . 1 . . . . 34 Lys CA . 19599 1 406 . 1 1 34 34 LYS CB C 13 32.193 0.030 . 1 . . . . 34 Lys CB . 19599 1 407 . 1 1 34 34 LYS CG C 13 25.358 0.113 . 1 . . . . 34 Lys CG . 19599 1 408 . 1 1 34 34 LYS N N 15 120.878 0.046 . 1 . . . . 34 Lys N . 19599 1 409 . 1 1 35 35 GLN H H 1 7.611 0.006 . 1 . . . . 35 Gln H . 19599 1 410 . 1 1 35 35 GLN HA H 1 4.271 0.002 . 1 . . . . 35 Gln HA . 19599 1 411 . 1 1 35 35 GLN HB2 H 1 2.161 0.015 . 2 . . . . 35 Gln HB2 . 19599 1 412 . 1 1 35 35 GLN HB3 H 1 1.981 0.014 . 2 . . . . 35 Gln HB3 . 19599 1 413 . 1 1 35 35 GLN HG2 H 1 2.343 0.011 . 2 . . . . 35 Gln HG2 . 19599 1 414 . 1 1 35 35 GLN HG3 H 1 2.216 0.004 . 2 . . . . 35 Gln HG3 . 19599 1 415 . 1 1 35 35 GLN HE21 H 1 6.870 0.003 . 1 . . . . 35 Gln HE21 . 19599 1 416 . 1 1 35 35 GLN HE22 H 1 7.126 0.006 . 1 . . . . 35 Gln HE22 . 19599 1 417 . 1 1 35 35 GLN C C 13 177.677 0.000 . 1 . . . . 35 Gln C . 19599 1 418 . 1 1 35 35 GLN CA C 13 58.213 0.097 . 1 . . . . 35 Gln CA . 19599 1 419 . 1 1 35 35 GLN CB C 13 28.165 0.104 . 1 . . . . 35 Gln CB . 19599 1 420 . 1 1 35 35 GLN CG C 13 32.970 0.120 . 1 . . . . 35 Gln CG . 19599 1 421 . 1 1 35 35 GLN N N 15 118.379 0.019 . 1 . . . . 35 Gln N . 19599 1 422 . 1 1 35 35 GLN NE2 N 15 110.030 0.238 . 1 . . . . 35 Gln NE2 . 19599 1 423 . 1 1 36 36 LEU H H 1 8.022 0.010 . 1 . . . . 36 Leu H . 19599 1 424 . 1 1 36 36 LEU HA H 1 3.857 0.006 . 1 . . . . 36 Leu HA . 19599 1 425 . 1 1 36 36 LEU HB2 H 1 2.460 0.003 . 2 . . . . 36 Leu HB2 . 19599 1 426 . 1 1 36 36 LEU HB3 H 1 1.334 0.010 . 2 . . . . 36 Leu HB3 . 19599 1 427 . 1 1 36 36 LEU HG H 1 1.357 0.008 . 1 . . . . 36 Leu HG . 19599 1 428 . 1 1 36 36 LEU HD11 H 1 0.939 0.005 . 2 . . . . 36 Leu HD11 . 19599 1 429 . 1 1 36 36 LEU HD12 H 1 0.939 0.005 . 2 . . . . 36 Leu HD12 . 19599 1 430 . 1 1 36 36 LEU HD13 H 1 0.939 0.005 . 2 . . . . 36 Leu HD13 . 19599 1 431 . 1 1 36 36 LEU HD21 H 1 0.725 0.003 . 2 . . . . 36 Leu HD21 . 19599 1 432 . 1 1 36 36 LEU HD22 H 1 0.725 0.003 . 2 . . . . 36 Leu HD22 . 19599 1 433 . 1 1 36 36 LEU HD23 H 1 0.725 0.003 . 2 . . . . 36 Leu HD23 . 19599 1 434 . 1 1 36 36 LEU C C 13 177.377 0.000 . 1 . . . . 36 Leu C . 19599 1 435 . 1 1 36 36 LEU CA C 13 58.667 0.037 . 1 . . . . 36 Leu CA . 19599 1 436 . 1 1 36 36 LEU CB C 13 42.090 0.093 . 1 . . . . 36 Leu CB . 19599 1 437 . 1 1 36 36 LEU CG C 13 27.068 0.097 . 1 . . . . 36 Leu CG . 19599 1 438 . 1 1 36 36 LEU CD1 C 13 26.571 0.033 . 2 . . . . 36 Leu CD1 . 19599 1 439 . 1 1 36 36 LEU CD2 C 13 24.152 0.049 . 2 . . . . 36 Leu CD2 . 19599 1 440 . 1 1 36 36 LEU N N 15 121.723 0.012 . 1 . . . . 36 Leu N . 19599 1 441 . 1 1 37 37 LEU H H 1 8.708 0.005 . 1 . . . . 37 Leu H . 19599 1 442 . 1 1 37 37 LEU HA H 1 3.916 0.006 . 1 . . . . 37 Leu HA . 19599 1 443 . 1 1 37 37 LEU HB2 H 1 1.521 0.005 . 2 . . . . 37 Leu HB2 . 19599 1 444 . 1 1 37 37 LEU HB3 H 1 1.898 0.011 . 2 . . . . 37 Leu HB3 . 19599 1 445 . 1 1 37 37 LEU HG H 1 1.864 0.005 . 1 . . . . 37 Leu HG . 19599 1 446 . 1 1 37 37 LEU HD11 H 1 0.860 0.008 . 2 . . . . 37 Leu HD11 . 19599 1 447 . 1 1 37 37 LEU HD12 H 1 0.860 0.008 . 2 . . . . 37 Leu HD12 . 19599 1 448 . 1 1 37 37 LEU HD13 H 1 0.860 0.008 . 2 . . . . 37 Leu HD13 . 19599 1 449 . 1 1 37 37 LEU HD21 H 1 0.835 0.002 . 2 . . . . 37 Leu HD21 . 19599 1 450 . 1 1 37 37 LEU HD22 H 1 0.835 0.002 . 2 . . . . 37 Leu HD22 . 19599 1 451 . 1 1 37 37 LEU HD23 H 1 0.835 0.002 . 2 . . . . 37 Leu HD23 . 19599 1 452 . 1 1 37 37 LEU C C 13 180.320 0.000 . 1 . . . . 37 Leu C . 19599 1 453 . 1 1 37 37 LEU CA C 13 58.366 0.064 . 1 . . . . 37 Leu CA . 19599 1 454 . 1 1 37 37 LEU CB C 13 41.048 0.044 . 1 . . . . 37 Leu CB . 19599 1 455 . 1 1 37 37 LEU CG C 13 27.026 0.029 . 1 . . . . 37 Leu CG . 19599 1 456 . 1 1 37 37 LEU CD1 C 13 25.307 0.039 . 2 . . . . 37 Leu CD1 . 19599 1 457 . 1 1 37 37 LEU CD2 C 13 22.676 0.026 . 2 . . . . 37 Leu CD2 . 19599 1 458 . 1 1 37 37 LEU N N 15 118.584 0.048 . 1 . . . . 37 Leu N . 19599 1 459 . 1 1 38 38 SER H H 1 8.091 0.008 . 1 . . . . 38 Ser H . 19599 1 460 . 1 1 38 38 SER HA H 1 4.277 0.002 . 1 . . . . 38 Ser HA . 19599 1 461 . 1 1 38 38 SER HB3 H 1 3.991 0.009 . 1 . . . . 38 Ser HB3 . 19599 1 462 . 1 1 38 38 SER C C 13 177.212 0.000 . 1 . . . . 38 Ser C . 19599 1 463 . 1 1 38 38 SER CA C 13 61.713 0.090 . 1 . . . . 38 Ser CA . 19599 1 464 . 1 1 38 38 SER CB C 13 62.606 0.077 . 1 . . . . 38 Ser CB . 19599 1 465 . 1 1 38 38 SER N N 15 116.735 0.031 . 1 . . . . 38 Ser N . 19599 1 466 . 1 1 39 39 LEU H H 1 8.269 0.006 . 1 . . . . 39 Leu H . 19599 1 467 . 1 1 39 39 LEU HA H 1 4.141 0.008 . 1 . . . . 39 Leu HA . 19599 1 468 . 1 1 39 39 LEU HB2 H 1 1.280 0.012 . 2 . . . . 39 Leu HB2 . 19599 1 469 . 1 1 39 39 LEU HB3 H 1 1.914 0.008 . 2 . . . . 39 Leu HB3 . 19599 1 470 . 1 1 39 39 LEU HG H 1 1.817 0.010 . 1 . . . . 39 Leu HG . 19599 1 471 . 1 1 39 39 LEU HD11 H 1 0.780 0.008 . 2 . . . . 39 Leu HD11 . 19599 1 472 . 1 1 39 39 LEU HD12 H 1 0.780 0.008 . 2 . . . . 39 Leu HD12 . 19599 1 473 . 1 1 39 39 LEU HD13 H 1 0.780 0.008 . 2 . . . . 39 Leu HD13 . 19599 1 474 . 1 1 39 39 LEU HD21 H 1 0.703 0.008 . 2 . . . . 39 Leu HD21 . 19599 1 475 . 1 1 39 39 LEU HD22 H 1 0.703 0.008 . 2 . . . . 39 Leu HD22 . 19599 1 476 . 1 1 39 39 LEU HD23 H 1 0.703 0.008 . 2 . . . . 39 Leu HD23 . 19599 1 477 . 1 1 39 39 LEU C C 13 179.142 0.000 . 1 . . . . 39 Leu C . 19599 1 478 . 1 1 39 39 LEU CA C 13 57.914 0.091 . 1 . . . . 39 Leu CA . 19599 1 479 . 1 1 39 39 LEU CB C 13 42.737 0.150 . 1 . . . . 39 Leu CB . 19599 1 480 . 1 1 39 39 LEU CG C 13 26.913 0.151 . 1 . . . . 39 Leu CG . 19599 1 481 . 1 1 39 39 LEU CD1 C 13 22.651 0.050 . 2 . . . . 39 Leu CD1 . 19599 1 482 . 1 1 39 39 LEU CD2 C 13 26.633 0.057 . 2 . . . . 39 Leu CD2 . 19599 1 483 . 1 1 39 39 LEU N N 15 123.633 0.023 . 1 . . . . 39 Leu N . 19599 1 484 . 1 1 40 40 LYS H H 1 8.573 0.009 . 1 . . . . 40 Lys H . 19599 1 485 . 1 1 40 40 LYS HA H 1 3.735 0.003 . 1 . . . . 40 Lys HA . 19599 1 486 . 1 1 40 40 LYS HB2 H 1 1.885 0.018 . 2 . . . . 40 Lys HB2 . 19599 1 487 . 1 1 40 40 LYS HB3 H 1 2.022 0.010 . 2 . . . . 40 Lys HB3 . 19599 1 488 . 1 1 40 40 LYS HG2 H 1 1.621 0.004 . 2 . . . . 40 Lys HG2 . 19599 1 489 . 1 1 40 40 LYS HG3 H 1 0.894 0.014 . 2 . . . . 40 Lys HG3 . 19599 1 490 . 1 1 40 40 LYS HD3 H 1 1.637 0.013 . 1 . . . . 40 Lys HD3 . 19599 1 491 . 1 1 40 40 LYS HE2 H 1 2.751 0.002 . 2 . . . . 40 Lys HE2 . 19599 1 492 . 1 1 40 40 LYS HE3 H 1 2.665 0.008 . 2 . . . . 40 Lys HE3 . 19599 1 493 . 1 1 40 40 LYS C C 13 179.300 0.000 . 1 . . . . 40 Lys C . 19599 1 494 . 1 1 40 40 LYS CA C 13 61.341 0.011 . 1 . . . . 40 Lys CA . 19599 1 495 . 1 1 40 40 LYS CB C 13 32.503 0.084 . 1 . . . . 40 Lys CB . 19599 1 496 . 1 1 40 40 LYS CG C 13 28.217 0.022 . 1 . . . . 40 Lys CG . 19599 1 497 . 1 1 40 40 LYS CD C 13 30.074 0.093 . 1 . . . . 40 Lys CD . 19599 1 498 . 1 1 40 40 LYS CE C 13 41.820 0.138 . 1 . . . . 40 Lys CE . 19599 1 499 . 1 1 40 40 LYS N N 15 119.390 0.013 . 1 . . . . 40 Lys N . 19599 1 500 . 1 1 41 41 ALA H H 1 8.108 0.003 . 1 . . . . 41 Ala H . 19599 1 501 . 1 1 41 41 ALA HA H 1 4.284 0.005 . 1 . . . . 41 Ala HA . 19599 1 502 . 1 1 41 41 ALA HB1 H 1 1.563 0.006 . 1 . . . . 41 Ala HB1 . 19599 1 503 . 1 1 41 41 ALA HB2 H 1 1.563 0.006 . 1 . . . . 41 Ala HB2 . 19599 1 504 . 1 1 41 41 ALA HB3 H 1 1.563 0.006 . 1 . . . . 41 Ala HB3 . 19599 1 505 . 1 1 41 41 ALA C C 13 180.044 0.000 . 1 . . . . 41 Ala C . 19599 1 506 . 1 1 41 41 ALA CA C 13 55.263 0.038 . 1 . . . . 41 Ala CA . 19599 1 507 . 1 1 41 41 ALA CB C 13 17.690 0.025 . 1 . . . . 41 Ala CB . 19599 1 508 . 1 1 41 41 ALA N N 15 124.112 0.014 . 1 . . . . 41 Ala N . 19599 1 509 . 1 1 42 42 GLU H H 1 8.251 0.003 . 1 . . . . 42 Glu H . 19599 1 510 . 1 1 42 42 GLU HA H 1 4.079 0.007 . 1 . . . . 42 Glu HA . 19599 1 511 . 1 1 42 42 GLU HB2 H 1 2.182 0.003 . 2 . . . . 42 Glu HB2 . 19599 1 512 . 1 1 42 42 GLU HB3 H 1 2.167 0.006 . 2 . . . . 42 Glu HB3 . 19599 1 513 . 1 1 42 42 GLU HG2 H 1 2.200 0.004 . 2 . . . . 42 Glu HG2 . 19599 1 514 . 1 1 42 42 GLU HG3 H 1 2.436 0.007 . 2 . . . . 42 Glu HG3 . 19599 1 515 . 1 1 42 42 GLU C C 13 177.850 0.000 . 1 . . . . 42 Glu C . 19599 1 516 . 1 1 42 42 GLU CA C 13 59.304 0.062 . 1 . . . . 42 Glu CA . 19599 1 517 . 1 1 42 42 GLU CB C 13 29.514 0.017 . 1 . . . . 42 Glu CB . 19599 1 518 . 1 1 42 42 GLU CG C 13 35.955 0.025 . 1 . . . . 42 Glu CG . 19599 1 519 . 1 1 42 42 GLU N N 15 121.718 0.041 . 1 . . . . 42 Glu N . 19599 1 520 . 1 1 43 43 TYR H H 1 8.636 0.006 . 1 . . . . 43 Tyr H . 19599 1 521 . 1 1 43 43 TYR HA H 1 3.942 0.001 . 1 . . . . 43 Tyr HA . 19599 1 522 . 1 1 43 43 TYR HB2 H 1 2.955 0.007 . 2 . . . . 43 Tyr HB2 . 19599 1 523 . 1 1 43 43 TYR HB3 H 1 3.298 0.004 . 2 . . . . 43 Tyr HB3 . 19599 1 524 . 1 1 43 43 TYR HD1 H 1 7.162 0.006 . 3 . . . . 43 Tyr HD1 . 19599 1 525 . 1 1 43 43 TYR HD2 H 1 7.162 0.006 . 3 . . . . 43 Tyr HD2 . 19599 1 526 . 1 1 43 43 TYR HE1 H 1 6.854 0.005 . 3 . . . . 43 Tyr HE1 . 19599 1 527 . 1 1 43 43 TYR HE2 H 1 6.854 0.005 . 3 . . . . 43 Tyr HE2 . 19599 1 528 . 1 1 43 43 TYR C C 13 177.791 0.000 . 1 . . . . 43 Tyr C . 19599 1 529 . 1 1 43 43 TYR CA C 13 63.060 0.065 . 1 . . . . 43 Tyr CA . 19599 1 530 . 1 1 43 43 TYR CB C 13 38.770 0.034 . 1 . . . . 43 Tyr CB . 19599 1 531 . 1 1 43 43 TYR N N 15 120.318 0.023 . 1 . . . . 43 Tyr N . 19599 1 532 . 1 1 44 44 LYS H H 1 8.053 0.006 . 1 . . . . 44 Lys H . 19599 1 533 . 1 1 44 44 LYS HA H 1 4.437 0.013 . 1 . . . . 44 Lys HA . 19599 1 534 . 1 1 44 44 LYS HB3 H 1 1.991 0.012 . 1 . . . . 44 Lys HB3 . 19599 1 535 . 1 1 44 44 LYS HG2 H 1 1.046 0.002 . 2 . . . . 44 Lys HG2 . 19599 1 536 . 1 1 44 44 LYS HG3 H 1 1.350 0.006 . 2 . . . . 44 Lys HG3 . 19599 1 537 . 1 1 44 44 LYS HD2 H 1 1.466 0.002 . 2 . . . . 44 Lys HD2 . 19599 1 538 . 1 1 44 44 LYS HD3 H 1 1.546 0.001 . 2 . . . . 44 Lys HD3 . 19599 1 539 . 1 1 44 44 LYS HE3 H 1 2.872 0.010 . 1 . . . . 44 Lys HE3 . 19599 1 540 . 1 1 44 44 LYS C C 13 179.345 0.000 . 1 . . . . 44 Lys C . 19599 1 541 . 1 1 44 44 LYS CA C 13 58.412 0.039 . 1 . . . . 44 Lys CA . 19599 1 542 . 1 1 44 44 LYS CB C 13 32.322 0.024 . 1 . . . . 44 Lys CB . 19599 1 543 . 1 1 44 44 LYS CG C 13 24.726 0.035 . 1 . . . . 44 Lys CG . 19599 1 544 . 1 1 44 44 LYS CD C 13 29.337 0.089 . 1 . . . . 44 Lys CD . 19599 1 545 . 1 1 44 44 LYS CE C 13 42.258 0.040 . 1 . . . . 44 Lys CE . 19599 1 546 . 1 1 44 44 LYS N N 15 122.817 0.027 . 1 . . . . 44 Lys N . 19599 1 547 . 1 1 45 45 GLU H H 1 8.232 0.009 . 1 . . . . 45 Glu H . 19599 1 548 . 1 1 45 45 GLU HA H 1 3.936 0.006 . 1 . . . . 45 Glu HA . 19599 1 549 . 1 1 45 45 GLU HB2 H 1 2.133 0.004 . 1 . . . . 45 Glu HB2 . 19599 1 550 . 1 1 45 45 GLU HG2 H 1 2.243 0.002 . 2 . . . . 45 Glu HG2 . 19599 1 551 . 1 1 45 45 GLU HG3 H 1 2.331 0.013 . 2 . . . . 45 Glu HG3 . 19599 1 552 . 1 1 45 45 GLU C C 13 178.187 0.000 . 1 . . . . 45 Glu C . 19599 1 553 . 1 1 45 45 GLU CA C 13 59.270 0.026 . 1 . . . . 45 Glu CA . 19599 1 554 . 1 1 45 45 GLU CB C 13 29.340 0.067 . 1 . . . . 45 Glu CB . 19599 1 555 . 1 1 45 45 GLU CG C 13 35.660 0.035 . 1 . . . . 45 Glu CG . 19599 1 556 . 1 1 45 45 GLU N N 15 120.753 0.081 . 1 . . . . 45 Glu N . 19599 1 557 . 1 1 46 46 LYS H H 1 8.235 0.005 . 1 . . . . 46 Lys H . 19599 1 558 . 1 1 46 46 LYS HA H 1 4.137 0.003 . 1 . . . . 46 Lys HA . 19599 1 559 . 1 1 46 46 LYS HB3 H 1 1.770 0.010 . 1 . . . . 46 Lys HB3 . 19599 1 560 . 1 1 46 46 LYS HG2 H 1 1.439 0.009 . 2 . . . . 46 Lys HG2 . 19599 1 561 . 1 1 46 46 LYS HG3 H 1 1.543 0.011 . 2 . . . . 46 Lys HG3 . 19599 1 562 . 1 1 46 46 LYS HD3 H 1 1.646 0.008 . 1 . . . . 46 Lys HD3 . 19599 1 563 . 1 1 46 46 LYS HE3 H 1 2.933 0.009 . 1 . . . . 46 Lys HE3 . 19599 1 564 . 1 1 46 46 LYS C C 13 178.100 0.000 . 1 . . . . 46 Lys C . 19599 1 565 . 1 1 46 46 LYS CA C 13 58.126 0.115 . 1 . . . . 46 Lys CA . 19599 1 566 . 1 1 46 46 LYS CB C 13 33.120 0.022 . 1 . . . . 46 Lys CB . 19599 1 567 . 1 1 46 46 LYS CG C 13 25.641 0.145 . 1 . . . . 46 Lys CG . 19599 1 568 . 1 1 46 46 LYS CD C 13 29.066 0.203 . 1 . . . . 46 Lys CD . 19599 1 569 . 1 1 46 46 LYS CE C 13 42.192 0.035 . 1 . . . . 46 Lys CE . 19599 1 570 . 1 1 46 46 LYS N N 15 115.615 0.018 . 1 . . . . 46 Lys N . 19599 1 571 . 1 1 47 47 THR H H 1 8.035 0.005 . 1 . . . . 47 Thr H . 19599 1 572 . 1 1 47 47 THR HA H 1 4.367 0.009 . 1 . . . . 47 Thr HA . 19599 1 573 . 1 1 47 47 THR HB H 1 4.065 0.018 . 1 . . . . 47 Thr HB . 19599 1 574 . 1 1 47 47 THR HG1 H 1 2.712 0.005 . 1 . . . . 47 Thr HG1 . 19599 1 575 . 1 1 47 47 THR HG21 H 1 0.767 0.006 . 1 . . . . 47 Thr HG21 . 19599 1 576 . 1 1 47 47 THR HG22 H 1 0.767 0.006 . 1 . . . . 47 Thr HG22 . 19599 1 577 . 1 1 47 47 THR HG23 H 1 0.767 0.006 . 1 . . . . 47 Thr HG23 . 19599 1 578 . 1 1 47 47 THR C C 13 176.028 0.000 . 1 . . . . 47 Thr C . 19599 1 579 . 1 1 47 47 THR CA C 13 62.493 0.014 . 1 . . . . 47 Thr CA . 19599 1 580 . 1 1 47 47 THR CB C 13 71.245 0.064 . 1 . . . . 47 Thr CB . 19599 1 581 . 1 1 47 47 THR CG2 C 13 19.517 0.119 . 1 . . . . 47 Thr CG2 . 19599 1 582 . 1 1 47 47 THR N N 15 106.193 0.049 . 1 . . . . 47 Thr N . 19599 1 583 . 1 1 48 48 GLY H H 1 8.149 0.006 . 1 . . . . 48 Gly H . 19599 1 584 . 1 1 48 48 GLY HA2 H 1 4.230 0.008 . 2 . . . . 48 Gly HA2 . 19599 1 585 . 1 1 48 48 GLY HA3 H 1 3.794 0.003 . 2 . . . . 48 Gly HA3 . 19599 1 586 . 1 1 48 48 GLY C C 13 173.013 0.000 . 1 . . . . 48 Gly C . 19599 1 587 . 1 1 48 48 GLY CA C 13 45.589 0.059 . 1 . . . . 48 Gly CA . 19599 1 588 . 1 1 48 48 GLY N N 15 111.920 0.016 . 1 . . . . 48 Gly N . 19599 1 589 . 1 1 49 49 GLN H H 1 8.252 0.005 . 1 . . . . 49 Gln H . 19599 1 590 . 1 1 49 49 GLN HA H 1 4.606 0.008 . 1 . . . . 49 Gln HA . 19599 1 591 . 1 1 49 49 GLN HB2 H 1 1.922 0.004 . 2 . . . . 49 Gln HB2 . 19599 1 592 . 1 1 49 49 GLN HB3 H 1 2.105 0.005 . 2 . . . . 49 Gln HB3 . 19599 1 593 . 1 1 49 49 GLN HG3 H 1 2.263 0.003 . 1 . . . . 49 Gln HG3 . 19599 1 594 . 1 1 49 49 GLN HE21 H 1 6.862 0.005 . 1 . . . . 49 Gln HE21 . 19599 1 595 . 1 1 49 49 GLN HE22 H 1 7.465 0.001 . 1 . . . . 49 Gln HE22 . 19599 1 596 . 1 1 49 49 GLN C C 13 173.151 0.000 . 1 . . . . 49 Gln C . 19599 1 597 . 1 1 49 49 GLN CA C 13 53.527 0.106 . 1 . . . . 49 Gln CA . 19599 1 598 . 1 1 49 49 GLN CB C 13 31.870 0.093 . 1 . . . . 49 Gln CB . 19599 1 599 . 1 1 49 49 GLN CG C 13 33.349 0.131 . 1 . . . . 49 Gln CG . 19599 1 600 . 1 1 49 49 GLN N N 15 119.592 0.021 . 1 . . . . 49 Gln N . 19599 1 601 . 1 1 49 49 GLN NE2 N 15 112.115 0.225 . 1 . . . . 49 Gln NE2 . 19599 1 602 . 1 1 50 50 GLU H H 1 8.271 0.003 . 1 . . . . 50 Glu H . 19599 1 603 . 1 1 50 50 GLU HA H 1 4.392 0.008 . 1 . . . . 50 Glu HA . 19599 1 604 . 1 1 50 50 GLU HB2 H 1 1.960 0.003 . 2 . . . . 50 Glu HB2 . 19599 1 605 . 1 1 50 50 GLU HB3 H 1 1.889 0.006 . 2 . . . . 50 Glu HB3 . 19599 1 606 . 1 1 50 50 GLU HG2 H 1 2.293 0.000 . 2 . . . . 50 Glu HG2 . 19599 1 607 . 1 1 50 50 GLU HG3 H 1 2.358 0.011 . 2 . . . . 50 Glu HG3 . 19599 1 608 . 1 1 50 50 GLU C C 13 177.266 0.000 . 1 . . . . 50 Glu C . 19599 1 609 . 1 1 50 50 GLU CA C 13 55.711 0.026 . 1 . . . . 50 Glu CA . 19599 1 610 . 1 1 50 50 GLU CB C 13 30.495 0.084 . 1 . . . . 50 Glu CB . 19599 1 611 . 1 1 50 50 GLU CG C 13 36.247 0.000 . 1 . . . . 50 Glu CG . 19599 1 612 . 1 1 50 50 GLU N N 15 118.004 0.014 . 1 . . . . 50 Glu N . 19599 1 613 . 1 1 51 51 TYR H H 1 9.347 0.004 . 1 . . . . 51 Tyr H . 19599 1 614 . 1 1 51 51 TYR HA H 1 3.865 0.001 . 1 . . . . 51 Tyr HA . 19599 1 615 . 1 1 51 51 TYR HB2 H 1 2.450 0.002 . 2 . . . . 51 Tyr HB2 . 19599 1 616 . 1 1 51 51 TYR HB3 H 1 2.642 0.002 . 2 . . . . 51 Tyr HB3 . 19599 1 617 . 1 1 51 51 TYR HD1 H 1 6.206 0.008 . 3 . . . . 51 Tyr HD1 . 19599 1 618 . 1 1 51 51 TYR HD2 H 1 6.206 0.008 . 3 . . . . 51 Tyr HD2 . 19599 1 619 . 1 1 51 51 TYR HE1 H 1 6.038 0.011 . 3 . . . . 51 Tyr HE1 . 19599 1 620 . 1 1 51 51 TYR HE2 H 1 6.038 0.011 . 3 . . . . 51 Tyr HE2 . 19599 1 621 . 1 1 51 51 TYR C C 13 173.974 0.000 . 1 . . . . 51 Tyr C . 19599 1 622 . 1 1 51 51 TYR CA C 13 60.281 0.059 . 1 . . . . 51 Tyr CA . 19599 1 623 . 1 1 51 51 TYR CB C 13 38.283 0.022 . 1 . . . . 51 Tyr CB . 19599 1 624 . 1 1 51 51 TYR N N 15 125.838 0.034 . 1 . . . . 51 Tyr N . 19599 1 625 . 1 1 52 52 LYS H H 1 7.760 0.004 . 1 . . . . 52 Lys H . 19599 1 626 . 1 1 52 52 LYS HA H 1 4.484 0.004 . 1 . . . . 52 Lys HA . 19599 1 627 . 1 1 52 52 LYS HB2 H 1 1.576 0.014 . 2 . . . . 52 Lys HB2 . 19599 1 628 . 1 1 52 52 LYS HB3 H 1 1.663 0.013 . 2 . . . . 52 Lys HB3 . 19599 1 629 . 1 1 52 52 LYS HG2 H 1 1.278 0.010 . 2 . . . . 52 Lys HG2 . 19599 1 630 . 1 1 52 52 LYS HG3 H 1 1.323 0.015 . 2 . . . . 52 Lys HG3 . 19599 1 631 . 1 1 52 52 LYS HD3 H 1 1.599 0.005 . 1 . . . . 52 Lys HD3 . 19599 1 632 . 1 1 52 52 LYS HE3 H 1 2.894 0.000 . 1 . . . . 52 Lys HE3 . 19599 1 633 . 1 1 52 52 LYS CA C 13 52.515 0.058 . 1 . . . . 52 Lys CA . 19599 1 634 . 1 1 52 52 LYS CB C 13 34.578 0.091 . 1 . . . . 52 Lys CB . 19599 1 635 . 1 1 52 52 LYS CG C 13 24.440 0.199 . 1 . . . . 52 Lys CG . 19599 1 636 . 1 1 52 52 LYS CD C 13 29.047 0.031 . 1 . . . . 52 Lys CD . 19599 1 637 . 1 1 52 52 LYS CE C 13 41.737 0.001 . 1 . . . . 52 Lys CE . 19599 1 638 . 1 1 52 52 LYS N N 15 130.404 0.014 . 1 . . . . 52 Lys N . 19599 1 639 . 1 1 53 53 PRO HA H 1 4.047 0.004 . 1 . . . . 53 Pro HA . 19599 1 640 . 1 1 53 53 PRO HB2 H 1 2.265 0.010 . 2 . . . . 53 Pro HB2 . 19599 1 641 . 1 1 53 53 PRO HB3 H 1 1.891 0.003 . 2 . . . . 53 Pro HB3 . 19599 1 642 . 1 1 53 53 PRO HG2 H 1 2.003 0.012 . 1 . . . . 53 Pro HG2 . 19599 1 643 . 1 1 53 53 PRO HD2 H 1 3.490 0.013 . 2 . . . . 53 Pro HD2 . 19599 1 644 . 1 1 53 53 PRO HD3 H 1 3.603 0.004 . 2 . . . . 53 Pro HD3 . 19599 1 645 . 1 1 53 53 PRO C C 13 176.980 0.000 . 1 . . . . 53 Pro C . 19599 1 646 . 1 1 53 53 PRO CA C 13 62.981 0.164 . 1 . . . . 53 Pro CA . 19599 1 647 . 1 1 53 53 PRO CB C 13 31.924 0.096 . 1 . . . . 53 Pro CB . 19599 1 648 . 1 1 53 53 PRO CG C 13 27.236 0.033 . 1 . . . . 53 Pro CG . 19599 1 649 . 1 1 53 53 PRO CD C 13 50.998 0.101 . 1 . . . . 53 Pro CD . 19599 1 650 . 1 1 54 54 GLY H H 1 8.550 0.006 . 1 . . . . 54 Gly H . 19599 1 651 . 1 1 54 54 GLY HA2 H 1 4.010 0.014 . 2 . . . . 54 Gly HA2 . 19599 1 652 . 1 1 54 54 GLY HA3 H 1 3.780 0.003 . 2 . . . . 54 Gly HA3 . 19599 1 653 . 1 1 54 54 GLY C C 13 173.111 0.000 . 1 . . . . 54 Gly C . 19599 1 654 . 1 1 54 54 GLY CA C 13 45.773 0.046 . 1 . . . . 54 Gly CA . 19599 1 655 . 1 1 54 54 GLY N N 15 110.763 0.023 . 1 . . . . 54 Gly N . 19599 1 656 . 1 1 55 55 ASN H H 1 7.835 0.002 . 1 . . . . 55 Asn H . 19599 1 657 . 1 1 55 55 ASN HA H 1 5.076 0.004 . 1 . . . . 55 Asn HA . 19599 1 658 . 1 1 55 55 ASN HB2 H 1 2.345 0.003 . 2 . . . . 55 Asn HB2 . 19599 1 659 . 1 1 55 55 ASN HB3 H 1 2.646 0.004 . 2 . . . . 55 Asn HB3 . 19599 1 660 . 1 1 55 55 ASN HD21 H 1 6.846 0.003 . 1 . . . . 55 Asn HD21 . 19599 1 661 . 1 1 55 55 ASN HD22 H 1 7.066 0.003 . 1 . . . . 55 Asn HD22 . 19599 1 662 . 1 1 55 55 ASN CA C 13 50.901 0.050 . 1 . . . . 55 Asn CA . 19599 1 663 . 1 1 55 55 ASN CB C 13 39.980 0.052 . 1 . . . . 55 Asn CB . 19599 1 664 . 1 1 55 55 ASN N N 15 118.274 0.014 . 1 . . . . 55 Asn N . 19599 1 665 . 1 1 55 55 ASN ND2 N 15 112.000 0.215 . 1 . . . . 55 Asn ND2 . 19599 1 666 . 1 1 56 56 PRO HA H 1 4.166 0.008 . 1 . . . . 56 Pro HA . 19599 1 667 . 1 1 56 56 PRO HB2 H 1 2.167 0.003 . 2 . . . . 56 Pro HB2 . 19599 1 668 . 1 1 56 56 PRO HB3 H 1 1.851 0.004 . 2 . . . . 56 Pro HB3 . 19599 1 669 . 1 1 56 56 PRO HG2 H 1 1.807 0.002 . 1 . . . . 56 Pro HG2 . 19599 1 670 . 1 1 56 56 PRO HD2 H 1 3.499 0.006 . 2 . . . . 56 Pro HD2 . 19599 1 671 . 1 1 56 56 PRO HD3 H 1 3.344 0.008 . 2 . . . . 56 Pro HD3 . 19599 1 672 . 1 1 56 56 PRO CA C 13 64.320 0.143 . 1 . . . . 56 Pro CA . 19599 1 673 . 1 1 56 56 PRO CB C 13 31.688 0.082 . 1 . . . . 56 Pro CB . 19599 1 674 . 1 1 56 56 PRO CG C 13 26.948 0.114 . 1 . . . . 56 Pro CG . 19599 1 675 . 1 1 56 56 PRO CD C 13 50.217 0.082 . 1 . . . . 56 Pro CD . 19599 1 676 . 1 1 57 57 PRO HA H 1 4.311 0.007 . 1 . . . . 57 Pro HA . 19599 1 677 . 1 1 57 57 PRO HB2 H 1 2.211 0.006 . 2 . . . . 57 Pro HB2 . 19599 1 678 . 1 1 57 57 PRO HB3 H 1 1.883 0.008 . 2 . . . . 57 Pro HB3 . 19599 1 679 . 1 1 57 57 PRO HG2 H 1 1.984 0.013 . 2 . . . . 57 Pro HG2 . 19599 1 680 . 1 1 57 57 PRO HG3 H 1 1.786 0.009 . 2 . . . . 57 Pro HG3 . 19599 1 681 . 1 1 57 57 PRO HD2 H 1 3.442 0.013 . 2 . . . . 57 Pro HD2 . 19599 1 682 . 1 1 57 57 PRO HD3 H 1 3.048 0.005 . 2 . . . . 57 Pro HD3 . 19599 1 683 . 1 1 57 57 PRO C C 13 175.432 0.000 . 1 . . . . 57 Pro C . 19599 1 684 . 1 1 57 57 PRO CA C 13 62.508 0.107 . 1 . . . . 57 Pro CA . 19599 1 685 . 1 1 57 57 PRO CB C 13 31.686 0.166 . 1 . . . . 57 Pro CB . 19599 1 686 . 1 1 57 57 PRO CG C 13 27.254 0.055 . 1 . . . . 57 Pro CG . 19599 1 687 . 1 1 57 57 PRO CD C 13 50.305 0.097 . 1 . . . . 57 Pro CD . 19599 1 688 . 1 1 58 58 ALA H H 1 8.141 0.003 . 1 . . . . 58 Ala H . 19599 1 689 . 1 1 58 58 ALA HA H 1 4.270 0.017 . 1 . . . . 58 Ala HA . 19599 1 690 . 1 1 58 58 ALA HB1 H 1 1.296 0.003 . 1 . . . . 58 Ala HB1 . 19599 1 691 . 1 1 58 58 ALA HB2 H 1 1.296 0.003 . 1 . . . . 58 Ala HB2 . 19599 1 692 . 1 1 58 58 ALA HB3 H 1 1.296 0.003 . 1 . . . . 58 Ala HB3 . 19599 1 693 . 1 1 58 58 ALA C C 13 177.089 0.000 . 1 . . . . 58 Ala C . 19599 1 694 . 1 1 58 58 ALA CA C 13 51.772 0.041 . 1 . . . . 58 Ala CA . 19599 1 695 . 1 1 58 58 ALA CB C 13 20.050 0.071 . 1 . . . . 58 Ala CB . 19599 1 696 . 1 1 58 58 ALA N N 15 124.070 0.032 . 1 . . . . 58 Ala N . 19599 1 697 . 1 1 59 59 GLU H H 1 8.400 0.004 . 1 . . . . 59 Glu H . 19599 1 698 . 1 1 59 59 GLU HA H 1 4.223 0.008 . 1 . . . . 59 Glu HA . 19599 1 699 . 1 1 59 59 GLU HB2 H 1 1.953 0.013 . 2 . . . . 59 Glu HB2 . 19599 1 700 . 1 1 59 59 GLU HB3 H 1 1.790 0.025 . 2 . . . . 59 Glu HB3 . 19599 1 701 . 1 1 59 59 GLU HG2 H 1 2.214 0.011 . 2 . . . . 59 Glu HG2 . 19599 1 702 . 1 1 59 59 GLU HG3 H 1 2.184 0.005 . 2 . . . . 59 Glu HG3 . 19599 1 703 . 1 1 59 59 GLU C C 13 175.819 0.000 . 1 . . . . 59 Glu C . 19599 1 704 . 1 1 59 59 GLU CA C 13 56.187 0.026 . 1 . . . . 59 Glu CA . 19599 1 705 . 1 1 59 59 GLU CB C 13 30.151 0.054 . 1 . . . . 59 Glu CB . 19599 1 706 . 1 1 59 59 GLU CG C 13 35.772 0.062 . 1 . . . . 59 Glu CG . 19599 1 707 . 1 1 59 59 GLU N N 15 120.573 0.047 . 1 . . . . 59 Glu N . 19599 1 708 . 1 1 60 60 ILE H H 1 8.214 0.003 . 1 . . . . 60 Ile H . 19599 1 709 . 1 1 60 60 ILE HA H 1 4.133 0.012 . 1 . . . . 60 Ile HA . 19599 1 710 . 1 1 60 60 ILE HB H 1 1.833 0.009 . 1 . . . . 60 Ile HB . 19599 1 711 . 1 1 60 60 ILE HG12 H 1 1.154 0.010 . 2 . . . . 60 Ile HG12 . 19599 1 712 . 1 1 60 60 ILE HG13 H 1 1.435 0.008 . 2 . . . . 60 Ile HG13 . 19599 1 713 . 1 1 60 60 ILE HG21 H 1 0.876 0.009 . 1 . . . . 60 Ile HG21 . 19599 1 714 . 1 1 60 60 ILE HG22 H 1 0.876 0.009 . 1 . . . . 60 Ile HG22 . 19599 1 715 . 1 1 60 60 ILE HG23 H 1 0.876 0.009 . 1 . . . . 60 Ile HG23 . 19599 1 716 . 1 1 60 60 ILE HD11 H 1 0.818 0.011 . 1 . . . . 60 Ile HD11 . 19599 1 717 . 1 1 60 60 ILE HD12 H 1 0.818 0.011 . 1 . . . . 60 Ile HD12 . 19599 1 718 . 1 1 60 60 ILE HD13 H 1 0.818 0.011 . 1 . . . . 60 Ile HD13 . 19599 1 719 . 1 1 60 60 ILE C C 13 176.328 0.000 . 1 . . . . 60 Ile C . 19599 1 720 . 1 1 60 60 ILE CA C 13 61.268 0.123 . 1 . . . . 60 Ile CA . 19599 1 721 . 1 1 60 60 ILE CB C 13 38.713 0.120 . 1 . . . . 60 Ile CB . 19599 1 722 . 1 1 60 60 ILE CG1 C 13 27.246 0.086 . 1 . . . . 60 Ile CG1 . 19599 1 723 . 1 1 60 60 ILE CG2 C 13 17.493 0.147 . 1 . . . . 60 Ile CG2 . 19599 1 724 . 1 1 60 60 ILE CD1 C 13 13.008 0.134 . 1 . . . . 60 Ile CD1 . 19599 1 725 . 1 1 60 60 ILE N N 15 122.126 0.042 . 1 . . . . 60 Ile N . 19599 1 726 . 1 1 61 61 GLY H H 1 8.481 0.005 . 1 . . . . 61 Gly H . 19599 1 727 . 1 1 61 61 GLY HA3 H 1 3.918 0.004 . 1 . . . . 61 Gly HA3 . 19599 1 728 . 1 1 61 61 GLY C C 13 173.600 0.000 . 1 . . . . 61 Gly C . 19599 1 729 . 1 1 61 61 GLY CA C 13 45.302 0.010 . 1 . . . . 61 Gly CA . 19599 1 730 . 1 1 61 61 GLY N N 15 112.669 0.035 . 1 . . . . 61 Gly N . 19599 1 731 . 1 1 62 62 GLN H H 1 8.216 0.004 . 1 . . . . 62 Gln H . 19599 1 732 . 1 1 62 62 GLN HA H 1 4.296 0.006 . 1 . . . . 62 Gln HA . 19599 1 733 . 1 1 62 62 GLN HB2 H 1 1.927 0.005 . 2 . . . . 62 Gln HB2 . 19599 1 734 . 1 1 62 62 GLN HB3 H 1 2.063 0.002 . 2 . . . . 62 Gln HB3 . 19599 1 735 . 1 1 62 62 GLN HG3 H 1 2.295 0.003 . 1 . . . . 62 Gln HG3 . 19599 1 736 . 1 1 62 62 GLN HE21 H 1 6.828 0.000 . 1 . . . . 62 Gln HE21 . 19599 1 737 . 1 1 62 62 GLN HE22 H 1 7.506 0.000 . 1 . . . . 62 Gln HE22 . 19599 1 738 . 1 1 62 62 GLN C C 13 175.285 0.000 . 1 . . . . 62 Gln C . 19599 1 739 . 1 1 62 62 GLN CA C 13 55.805 0.073 . 1 . . . . 62 Gln CA . 19599 1 740 . 1 1 62 62 GLN CB C 13 29.695 0.039 . 1 . . . . 62 Gln CB . 19599 1 741 . 1 1 62 62 GLN CG C 13 33.739 0.033 . 1 . . . . 62 Gln CG . 19599 1 742 . 1 1 62 62 GLN N N 15 119.561 0.030 . 1 . . . . 62 Gln N . 19599 1 743 . 1 1 62 62 GLN NE2 N 15 111.907 0.042 . 1 . . . . 62 Gln NE2 . 19599 1 744 . 1 1 63 63 ASN H H 1 8.548 0.004 . 1 . . . . 63 Asn H . 19599 1 745 . 1 1 63 63 ASN HA H 1 4.677 0.003 . 1 . . . . 63 Asn HA . 19599 1 746 . 1 1 63 63 ASN HB2 H 1 2.709 0.003 . 2 . . . . 63 Asn HB2 . 19599 1 747 . 1 1 63 63 ASN HB3 H 1 2.806 0.003 . 2 . . . . 63 Asn HB3 . 19599 1 748 . 1 1 63 63 ASN HD21 H 1 6.894 0.001 . 1 . . . . 63 Asn HD21 . 19599 1 749 . 1 1 63 63 ASN HD22 H 1 7.578 0.002 . 1 . . . . 63 Asn HD22 . 19599 1 750 . 1 1 63 63 ASN C C 13 174.692 0.000 . 1 . . . . 63 Asn C . 19599 1 751 . 1 1 63 63 ASN CA C 13 53.290 0.002 . 1 . . . . 63 Asn CA . 19599 1 752 . 1 1 63 63 ASN CB C 13 38.742 0.050 . 1 . . . . 63 Asn CB . 19599 1 753 . 1 1 63 63 ASN N N 15 119.920 0.028 . 1 . . . . 63 Asn N . 19599 1 754 . 1 1 63 63 ASN ND2 N 15 112.567 0.189 . 1 . . . . 63 Asn ND2 . 19599 1 755 . 1 1 64 64 ILE H H 1 8.104 0.004 . 1 . . . . 64 Ile H . 19599 1 756 . 1 1 64 64 ILE HA H 1 4.178 0.008 . 1 . . . . 64 Ile HA . 19599 1 757 . 1 1 64 64 ILE HB H 1 1.861 0.005 . 1 . . . . 64 Ile HB . 19599 1 758 . 1 1 64 64 ILE HG12 H 1 1.135 0.006 . 2 . . . . 64 Ile HG12 . 19599 1 759 . 1 1 64 64 ILE HG13 H 1 1.399 0.010 . 2 . . . . 64 Ile HG13 . 19599 1 760 . 1 1 64 64 ILE HG21 H 1 0.863 0.007 . 1 . . . . 64 Ile HG21 . 19599 1 761 . 1 1 64 64 ILE HG22 H 1 0.863 0.007 . 1 . . . . 64 Ile HG22 . 19599 1 762 . 1 1 64 64 ILE HG23 H 1 0.863 0.007 . 1 . . . . 64 Ile HG23 . 19599 1 763 . 1 1 64 64 ILE HD11 H 1 0.791 0.014 . 1 . . . . 64 Ile HD11 . 19599 1 764 . 1 1 64 64 ILE HD12 H 1 0.791 0.014 . 1 . . . . 64 Ile HD12 . 19599 1 765 . 1 1 64 64 ILE HD13 H 1 0.791 0.014 . 1 . . . . 64 Ile HD13 . 19599 1 766 . 1 1 64 64 ILE C C 13 175.992 0.000 . 1 . . . . 64 Ile C . 19599 1 767 . 1 1 64 64 ILE CA C 13 61.157 0.090 . 1 . . . . 64 Ile CA . 19599 1 768 . 1 1 64 64 ILE CB C 13 38.636 0.095 . 1 . . . . 64 Ile CB . 19599 1 769 . 1 1 64 64 ILE CG1 C 13 27.110 0.099 . 1 . . . . 64 Ile CG1 . 19599 1 770 . 1 1 64 64 ILE CG2 C 13 17.587 0.092 . 1 . . . . 64 Ile CG2 . 19599 1 771 . 1 1 64 64 ILE CD1 C 13 12.879 0.099 . 1 . . . . 64 Ile CD1 . 19599 1 772 . 1 1 64 64 ILE N N 15 121.003 0.019 . 1 . . . . 64 Ile N . 19599 1 773 . 1 1 65 65 SER H H 1 8.407 0.008 . 1 . . . . 65 Ser H . 19599 1 774 . 1 1 65 65 SER HA H 1 4.462 0.000 . 1 . . . . 65 Ser HA . 19599 1 775 . 1 1 65 65 SER HB3 H 1 3.848 0.014 . 1 . . . . 65 Ser HB3 . 19599 1 776 . 1 1 65 65 SER CA C 13 58.306 0.000 . 1 . . . . 65 Ser CA . 19599 1 777 . 1 1 65 65 SER CB C 13 63.769 0.036 . 1 . . . . 65 Ser CB . 19599 1 778 . 1 1 65 65 SER N N 15 119.633 0.018 . 1 . . . . 65 Ser N . 19599 1 779 . 1 1 66 66 SER HA H 1 4.437 0.004 . 1 . . . . 66 Ser HA . 19599 1 780 . 1 1 66 66 SER C C 13 174.019 0.000 . 1 . . . . 66 Ser C . 19599 1 781 . 1 1 66 66 SER CA C 13 58.549 0.037 . 1 . . . . 66 Ser CA . 19599 1 782 . 1 1 66 66 SER CB C 13 63.714 0.018 . 1 . . . . 66 Ser CB . 19599 1 783 . 1 1 67 67 ASN H H 1 8.397 0.009 . 1 . . . . 67 Asn H . 19599 1 784 . 1 1 67 67 ASN HA H 1 4.747 0.004 . 1 . . . . 67 Asn HA . 19599 1 785 . 1 1 67 67 ASN HB2 H 1 2.757 0.001 . 2 . . . . 67 Asn HB2 . 19599 1 786 . 1 1 67 67 ASN HB3 H 1 2.826 0.006 . 2 . . . . 67 Asn HB3 . 19599 1 787 . 1 1 67 67 ASN HD21 H 1 6.891 0.015 . 1 . . . . 67 Asn HD21 . 19599 1 788 . 1 1 67 67 ASN HD22 H 1 7.581 0.001 . 1 . . . . 67 Asn HD22 . 19599 1 789 . 1 1 67 67 ASN C C 13 175.030 0.000 . 1 . . . . 67 Asn C . 19599 1 790 . 1 1 67 67 ASN CA C 13 53.304 0.002 . 1 . . . . 67 Asn CA . 19599 1 791 . 1 1 67 67 ASN CB C 13 38.876 0.063 . 1 . . . . 67 Asn CB . 19599 1 792 . 1 1 67 67 ASN N N 15 120.597 0.039 . 1 . . . . 67 Asn N . 19599 1 793 . 1 1 67 67 ASN ND2 N 15 112.204 0.000 . 1 . . . . 67 Asn ND2 . 19599 1 794 . 1 1 68 68 SER H H 1 8.274 0.004 . 1 . . . . 68 Ser H . 19599 1 795 . 1 1 68 68 SER HA H 1 4.456 0.004 . 1 . . . . 68 Ser HA . 19599 1 796 . 1 1 68 68 SER HB3 H 1 3.869 0.007 . 1 . . . . 68 Ser HB3 . 19599 1 797 . 1 1 68 68 SER C C 13 174.389 0.000 . 1 . . . . 68 Ser C . 19599 1 798 . 1 1 68 68 SER CA C 13 58.504 0.100 . 1 . . . . 68 Ser CA . 19599 1 799 . 1 1 68 68 SER CB C 13 63.730 0.051 . 1 . . . . 68 Ser CB . 19599 1 800 . 1 1 68 68 SER N N 15 116.317 0.023 . 1 . . . . 68 Ser N . 19599 1 801 . 1 1 69 69 SER H H 1 8.355 0.005 . 1 . . . . 69 Ser H . 19599 1 802 . 1 1 69 69 SER HA H 1 4.389 0.002 . 1 . . . . 69 Ser HA . 19599 1 803 . 1 1 69 69 SER HB3 H 1 3.881 0.013 . 1 . . . . 69 Ser HB3 . 19599 1 804 . 1 1 69 69 SER C C 13 174.477 0.000 . 1 . . . . 69 Ser C . 19599 1 805 . 1 1 69 69 SER CA C 13 59.088 0.073 . 1 . . . . 69 Ser CA . 19599 1 806 . 1 1 69 69 SER CB C 13 63.607 0.013 . 1 . . . . 69 Ser CB . 19599 1 807 . 1 1 69 69 SER N N 15 117.839 0.056 . 1 . . . . 69 Ser N . 19599 1 808 . 1 1 70 70 ALA H H 1 8.273 0.003 . 1 . . . . 70 Ala H . 19599 1 809 . 1 1 70 70 ALA HA H 1 4.267 0.022 . 1 . . . . 70 Ala HA . 19599 1 810 . 1 1 70 70 ALA HB1 H 1 1.374 0.002 . 1 . . . . 70 Ala HB1 . 19599 1 811 . 1 1 70 70 ALA HB2 H 1 1.374 0.002 . 1 . . . . 70 Ala HB2 . 19599 1 812 . 1 1 70 70 ALA HB3 H 1 1.374 0.002 . 1 . . . . 70 Ala HB3 . 19599 1 813 . 1 1 70 70 ALA C C 13 178.252 0.000 . 1 . . . . 70 Ala C . 19599 1 814 . 1 1 70 70 ALA CA C 13 53.414 0.103 . 1 . . . . 70 Ala CA . 19599 1 815 . 1 1 70 70 ALA CB C 13 19.005 0.046 . 1 . . . . 70 Ala CB . 19599 1 816 . 1 1 70 70 ALA N N 15 125.213 0.009 . 1 . . . . 70 Ala N . 19599 1 817 . 1 1 71 71 SER H H 1 8.274 0.005 . 1 . . . . 71 Ser H . 19599 1 818 . 1 1 71 71 SER HA H 1 4.384 0.000 . 1 . . . . 71 Ser HA . 19599 1 819 . 1 1 71 71 SER HB2 H 1 3.907 0.005 . 2 . . . . 71 Ser HB2 . 19599 1 820 . 1 1 71 71 SER HB3 H 1 3.972 0.003 . 2 . . . . 71 Ser HB3 . 19599 1 821 . 1 1 71 71 SER C C 13 175.735 0.000 . 1 . . . . 71 Ser C . 19599 1 822 . 1 1 71 71 SER CA C 13 59.238 0.057 . 1 . . . . 71 Ser CA . 19599 1 823 . 1 1 71 71 SER CB C 13 63.565 0.027 . 1 . . . . 71 Ser CB . 19599 1 824 . 1 1 71 71 SER N N 15 114.990 0.022 . 1 . . . . 71 Ser N . 19599 1 825 . 1 1 72 72 ILE H H 1 8.143 0.006 . 1 . . . . 72 Ile H . 19599 1 826 . 1 1 72 72 ILE HA H 1 4.021 0.006 . 1 . . . . 72 Ile HA . 19599 1 827 . 1 1 72 72 ILE HB H 1 1.901 0.004 . 1 . . . . 72 Ile HB . 19599 1 828 . 1 1 72 72 ILE HG12 H 1 1.507 0.009 . 2 . . . . 72 Ile HG12 . 19599 1 829 . 1 1 72 72 ILE HG13 H 1 1.220 0.004 . 2 . . . . 72 Ile HG13 . 19599 1 830 . 1 1 72 72 ILE HG21 H 1 0.903 0.005 . 1 . . . . 72 Ile HG21 . 19599 1 831 . 1 1 72 72 ILE HG22 H 1 0.903 0.005 . 1 . . . . 72 Ile HG22 . 19599 1 832 . 1 1 72 72 ILE HG23 H 1 0.903 0.005 . 1 . . . . 72 Ile HG23 . 19599 1 833 . 1 1 72 72 ILE HD11 H 1 0.856 0.011 . 1 . . . . 72 Ile HD11 . 19599 1 834 . 1 1 72 72 ILE HD12 H 1 0.856 0.011 . 1 . . . . 72 Ile HD12 . 19599 1 835 . 1 1 72 72 ILE HD13 H 1 0.856 0.011 . 1 . . . . 72 Ile HD13 . 19599 1 836 . 1 1 72 72 ILE C C 13 177.156 0.000 . 1 . . . . 72 Ile C . 19599 1 837 . 1 1 72 72 ILE CA C 13 62.888 0.049 . 1 . . . . 72 Ile CA . 19599 1 838 . 1 1 72 72 ILE CB C 13 38.091 0.085 . 1 . . . . 72 Ile CB . 19599 1 839 . 1 1 72 72 ILE CG1 C 13 28.126 0.087 . 1 . . . . 72 Ile CG1 . 19599 1 840 . 1 1 72 72 ILE CG2 C 13 17.549 0.089 . 1 . . . . 72 Ile CG2 . 19599 1 841 . 1 1 72 72 ILE CD1 C 13 12.956 0.132 . 1 . . . . 72 Ile CD1 . 19599 1 842 . 1 1 72 72 ILE N N 15 123.463 0.050 . 1 . . . . 72 Ile N . 19599 1 843 . 1 1 73 73 LEU H H 1 8.035 0.008 . 1 . . . . 73 Leu H . 19599 1 844 . 1 1 73 73 LEU HA H 1 4.186 0.003 . 1 . . . . 73 Leu HA . 19599 1 845 . 1 1 73 73 LEU HB2 H 1 1.598 0.005 . 2 . . . . 73 Leu HB2 . 19599 1 846 . 1 1 73 73 LEU HB3 H 1 1.716 0.007 . 2 . . . . 73 Leu HB3 . 19599 1 847 . 1 1 73 73 LEU HG H 1 1.658 0.012 . 1 . . . . 73 Leu HG . 19599 1 848 . 1 1 73 73 LEU HD11 H 1 0.861 0.005 . 2 . . . . 73 Leu HD11 . 19599 1 849 . 1 1 73 73 LEU HD12 H 1 0.861 0.005 . 2 . . . . 73 Leu HD12 . 19599 1 850 . 1 1 73 73 LEU HD13 H 1 0.861 0.005 . 2 . . . . 73 Leu HD13 . 19599 1 851 . 1 1 73 73 LEU HD21 H 1 0.885 0.005 . 2 . . . . 73 Leu HD21 . 19599 1 852 . 1 1 73 73 LEU HD22 H 1 0.885 0.005 . 2 . . . . 73 Leu HD22 . 19599 1 853 . 1 1 73 73 LEU HD23 H 1 0.885 0.005 . 2 . . . . 73 Leu HD23 . 19599 1 854 . 1 1 73 73 LEU C C 13 178.823 0.000 . 1 . . . . 73 Leu C . 19599 1 855 . 1 1 73 73 LEU CA C 13 57.130 0.049 . 1 . . . . 73 Leu CA . 19599 1 856 . 1 1 73 73 LEU CB C 13 41.758 0.106 . 1 . . . . 73 Leu CB . 19599 1 857 . 1 1 73 73 LEU CG C 13 27.080 0.032 . 1 . . . . 73 Leu CG . 19599 1 858 . 1 1 73 73 LEU CD1 C 13 23.603 0.030 . 2 . . . . 73 Leu CD1 . 19599 1 859 . 1 1 73 73 LEU CD2 C 13 24.969 0.011 . 2 . . . . 73 Leu CD2 . 19599 1 860 . 1 1 73 73 LEU N N 15 122.878 0.055 . 1 . . . . 73 Leu N . 19599 1 861 . 1 1 74 74 GLU H H 1 8.219 0.006 . 1 . . . . 74 Glu H . 19599 1 862 . 1 1 74 74 GLU HA H 1 4.190 0.004 . 1 . . . . 74 Glu HA . 19599 1 863 . 1 1 74 74 GLU HB2 H 1 2.077 0.005 . 1 . . . . 74 Glu HB2 . 19599 1 864 . 1 1 74 74 GLU HG2 H 1 2.252 0.013 . 2 . . . . 74 Glu HG2 . 19599 1 865 . 1 1 74 74 GLU HG3 H 1 2.357 0.002 . 2 . . . . 74 Glu HG3 . 19599 1 866 . 1 1 74 74 GLU C C 13 178.154 0.000 . 1 . . . . 74 Glu C . 19599 1 867 . 1 1 74 74 GLU CA C 13 58.355 0.070 . 1 . . . . 74 Glu CA . 19599 1 868 . 1 1 74 74 GLU CB C 13 29.612 0.067 . 1 . . . . 74 Glu CB . 19599 1 869 . 1 1 74 74 GLU N N 15 120.624 0.078 . 1 . . . . 74 Glu N . 19599 1 870 . 1 1 75 75 SER H H 1 8.345 0.007 . 1 . . . . 75 Ser H . 19599 1 871 . 1 1 75 75 SER HA H 1 4.120 0.005 . 1 . . . . 75 Ser HA . 19599 1 872 . 1 1 75 75 SER HB2 H 1 3.806 0.005 . 2 . . . . 75 Ser HB2 . 19599 1 873 . 1 1 75 75 SER HB3 H 1 3.991 0.004 . 2 . . . . 75 Ser HB3 . 19599 1 874 . 1 1 75 75 SER C C 13 175.224 0.000 . 1 . . . . 75 Ser C . 19599 1 875 . 1 1 75 75 SER CA C 13 61.808 0.037 . 1 . . . . 75 Ser CA . 19599 1 876 . 1 1 75 75 SER CB C 13 62.671 0.040 . 1 . . . . 75 Ser CB . 19599 1 877 . 1 1 75 75 SER N N 15 116.160 0.027 . 1 . . . . 75 Ser N . 19599 1 878 . 1 1 76 76 LYS H H 1 8.201 0.007 . 1 . . . . 76 Lys H . 19599 1 879 . 1 1 76 76 LYS HA H 1 4.131 0.011 . 1 . . . . 76 Lys HA . 19599 1 880 . 1 1 76 76 LYS HB2 H 1 1.921 0.000 . 2 . . . . 76 Lys HB2 . 19599 1 881 . 1 1 76 76 LYS HB3 H 1 2.023 0.002 . 2 . . . . 76 Lys HB3 . 19599 1 882 . 1 1 76 76 LYS HG3 H 1 1.556 0.000 . 1 . . . . 76 Lys HG3 . 19599 1 883 . 1 1 76 76 LYS HE3 H 1 2.971 0.000 . 1 . . . . 76 Lys HE3 . 19599 1 884 . 1 1 76 76 LYS C C 13 177.515 0.000 . 1 . . . . 76 Lys C . 19599 1 885 . 1 1 76 76 LYS CA C 13 59.063 0.186 . 1 . . . . 76 Lys CA . 19599 1 886 . 1 1 76 76 LYS CB C 13 32.500 0.000 . 1 . . . . 76 Lys CB . 19599 1 887 . 1 1 76 76 LYS N N 15 123.130 0.039 . 1 . . . . 76 Lys N . 19599 1 888 . 1 1 77 77 SER H H 1 8.152 0.004 . 1 . . . . 77 Ser H . 19599 1 889 . 1 1 77 77 SER HA H 1 4.400 0.006 . 1 . . . . 77 Ser HA . 19599 1 890 . 1 1 77 77 SER HB3 H 1 4.024 0.010 . 1 . . . . 77 Ser HB3 . 19599 1 891 . 1 1 77 77 SER C C 13 176.787 0.000 . 1 . . . . 77 Ser C . 19599 1 892 . 1 1 77 77 SER CA C 13 61.337 0.076 . 1 . . . . 77 Ser CA . 19599 1 893 . 1 1 77 77 SER CB C 13 62.750 0.049 . 1 . . . . 77 Ser CB . 19599 1 894 . 1 1 77 77 SER N N 15 114.930 0.010 . 1 . . . . 77 Ser N . 19599 1 895 . 1 1 78 78 LEU H H 1 8.148 0.003 . 1 . . . . 78 Leu H . 19599 1 896 . 1 1 78 78 LEU HA H 1 4.307 0.006 . 1 . . . . 78 Leu HA . 19599 1 897 . 1 1 78 78 LEU HB2 H 1 1.794 0.011 . 2 . . . . 78 Leu HB2 . 19599 1 898 . 1 1 78 78 LEU HB3 H 1 1.986 0.006 . 2 . . . . 78 Leu HB3 . 19599 1 899 . 1 1 78 78 LEU HG H 1 1.846 0.005 . 1 . . . . 78 Leu HG . 19599 1 900 . 1 1 78 78 LEU HD21 H 1 0.915 0.007 . 1 . . . . 78 Leu HD21 . 19599 1 901 . 1 1 78 78 LEU HD22 H 1 0.915 0.007 . 1 . . . . 78 Leu HD22 . 19599 1 902 . 1 1 78 78 LEU HD23 H 1 0.915 0.007 . 1 . . . . 78 Leu HD23 . 19599 1 903 . 1 1 78 78 LEU C C 13 178.205 0.000 . 1 . . . . 78 Leu C . 19599 1 904 . 1 1 78 78 LEU CA C 13 57.973 0.081 . 1 . . . . 78 Leu CA . 19599 1 905 . 1 1 78 78 LEU CB C 13 42.672 0.053 . 1 . . . . 78 Leu CB . 19599 1 906 . 1 1 78 78 LEU CG C 13 27.610 0.112 . 1 . . . . 78 Leu CG . 19599 1 907 . 1 1 78 78 LEU CD2 C 13 24.584 0.129 . 1 . . . . 78 Leu CD2 . 19599 1 908 . 1 1 78 78 LEU N N 15 122.607 0.036 . 1 . . . . 78 Leu N . 19599 1 909 . 1 1 79 79 TYR H H 1 8.661 0.005 . 1 . . . . 79 Tyr H . 19599 1 910 . 1 1 79 79 TYR HA H 1 3.773 0.009 . 1 . . . . 79 Tyr HA . 19599 1 911 . 1 1 79 79 TYR HB2 H 1 3.373 0.003 . 2 . . . . 79 Tyr HB2 . 19599 1 912 . 1 1 79 79 TYR HB3 H 1 3.501 0.004 . 2 . . . . 79 Tyr HB3 . 19599 1 913 . 1 1 79 79 TYR HD1 H 1 7.250 0.007 . 3 . . . . 79 Tyr HD1 . 19599 1 914 . 1 1 79 79 TYR HD2 H 1 7.250 0.007 . 3 . . . . 79 Tyr HD2 . 19599 1 915 . 1 1 79 79 TYR HE1 H 1 6.675 0.001 . 3 . . . . 79 Tyr HE1 . 19599 1 916 . 1 1 79 79 TYR HE2 H 1 6.675 0.001 . 3 . . . . 79 Tyr HE2 . 19599 1 917 . 1 1 79 79 TYR C C 13 176.644 0.000 . 1 . . . . 79 Tyr C . 19599 1 918 . 1 1 79 79 TYR CA C 13 62.790 0.149 . 1 . . . . 79 Tyr CA . 19599 1 919 . 1 1 79 79 TYR CB C 13 38.653 0.022 . 1 . . . . 79 Tyr CB . 19599 1 920 . 1 1 79 79 TYR N N 15 120.939 0.058 . 1 . . . . 79 Tyr N . 19599 1 921 . 1 1 80 80 ASP H H 1 8.416 0.007 . 1 . . . . 80 Asp H . 19599 1 922 . 1 1 80 80 ASP HA H 1 4.413 0.004 . 1 . . . . 80 Asp HA . 19599 1 923 . 1 1 80 80 ASP HB2 H 1 2.954 0.005 . 2 . . . . 80 Asp HB2 . 19599 1 924 . 1 1 80 80 ASP HB3 H 1 2.723 0.006 . 2 . . . . 80 Asp HB3 . 19599 1 925 . 1 1 80 80 ASP C C 13 179.194 0.000 . 1 . . . . 80 Asp C . 19599 1 926 . 1 1 80 80 ASP CA C 13 57.082 0.029 . 1 . . . . 80 Asp CA . 19599 1 927 . 1 1 80 80 ASP CB C 13 39.804 0.106 . 1 . . . . 80 Asp CB . 19599 1 928 . 1 1 80 80 ASP N N 15 118.413 0.041 . 1 . . . . 80 Asp N . 19599 1 929 . 1 1 81 81 GLU H H 1 8.160 0.008 . 1 . . . . 81 Glu H . 19599 1 930 . 1 1 81 81 GLU HA H 1 4.098 0.004 . 1 . . . . 81 Glu HA . 19599 1 931 . 1 1 81 81 GLU HB2 H 1 2.145 0.007 . 2 . . . . 81 Glu HB2 . 19599 1 932 . 1 1 81 81 GLU HB3 H 1 2.334 0.014 . 2 . . . . 81 Glu HB3 . 19599 1 933 . 1 1 81 81 GLU HG2 H 1 2.644 0.003 . 2 . . . . 81 Glu HG2 . 19599 1 934 . 1 1 81 81 GLU HG3 H 1 2.352 0.035 . 2 . . . . 81 Glu HG3 . 19599 1 935 . 1 1 81 81 GLU C C 13 179.090 0.000 . 1 . . . . 81 Glu C . 19599 1 936 . 1 1 81 81 GLU CA C 13 59.223 0.027 . 1 . . . . 81 Glu CA . 19599 1 937 . 1 1 81 81 GLU CB C 13 29.170 0.076 . 1 . . . . 81 Glu CB . 19599 1 938 . 1 1 81 81 GLU CG C 13 35.153 0.095 . 1 . . . . 81 Glu CG . 19599 1 939 . 1 1 81 81 GLU N N 15 121.703 0.061 . 1 . . . . 81 Glu N . 19599 1 940 . 1 1 82 82 VAL H H 1 8.224 0.010 . 1 . . . . 82 Val H . 19599 1 941 . 1 1 82 82 VAL HA H 1 3.115 0.008 . 1 . . . . 82 Val HA . 19599 1 942 . 1 1 82 82 VAL HB H 1 1.422 0.007 . 1 . . . . 82 Val HB . 19599 1 943 . 1 1 82 82 VAL HG11 H 1 0.586 0.007 . 2 . . . . 82 Val HG11 . 19599 1 944 . 1 1 82 82 VAL HG12 H 1 0.586 0.007 . 2 . . . . 82 Val HG12 . 19599 1 945 . 1 1 82 82 VAL HG13 H 1 0.586 0.007 . 2 . . . . 82 Val HG13 . 19599 1 946 . 1 1 82 82 VAL HG21 H 1 -0.490 0.005 . 2 . . . . 82 Val HG21 . 19599 1 947 . 1 1 82 82 VAL HG22 H 1 -0.490 0.005 . 2 . . . . 82 Val HG22 . 19599 1 948 . 1 1 82 82 VAL HG23 H 1 -0.490 0.005 . 2 . . . . 82 Val HG23 . 19599 1 949 . 1 1 82 82 VAL C C 13 177.824 0.000 . 1 . . . . 82 Val C . 19599 1 950 . 1 1 82 82 VAL CA C 13 66.669 0.060 . 1 . . . . 82 Val CA . 19599 1 951 . 1 1 82 82 VAL CB C 13 31.460 0.141 . 1 . . . . 82 Val CB . 19599 1 952 . 1 1 82 82 VAL CG1 C 13 22.339 0.237 . 2 . . . . 82 Val CG1 . 19599 1 953 . 1 1 82 82 VAL CG2 C 13 21.295 0.172 . 2 . . . . 82 Val CG2 . 19599 1 954 . 1 1 82 82 VAL N N 15 122.014 0.043 . 1 . . . . 82 Val N . 19599 1 955 . 1 1 83 83 ALA H H 1 8.054 0.009 . 1 . . . . 83 Ala H . 19599 1 956 . 1 1 83 83 ALA HA H 1 3.806 0.015 . 1 . . . . 83 Ala HA . 19599 1 957 . 1 1 83 83 ALA HB1 H 1 1.376 0.006 . 1 . . . . 83 Ala HB1 . 19599 1 958 . 1 1 83 83 ALA HB2 H 1 1.376 0.006 . 1 . . . . 83 Ala HB2 . 19599 1 959 . 1 1 83 83 ALA HB3 H 1 1.376 0.006 . 1 . . . . 83 Ala HB3 . 19599 1 960 . 1 1 83 83 ALA C C 13 181.038 0.000 . 1 . . . . 83 Ala C . 19599 1 961 . 1 1 83 83 ALA CA C 13 55.175 0.037 . 1 . . . . 83 Ala CA . 19599 1 962 . 1 1 83 83 ALA CB C 13 17.981 0.100 . 1 . . . . 83 Ala CB . 19599 1 963 . 1 1 83 83 ALA N N 15 122.170 0.044 . 1 . . . . 83 Ala N . 19599 1 964 . 1 1 84 84 ALA H H 1 8.269 0.014 . 1 . . . . 84 Ala H . 19599 1 965 . 1 1 84 84 ALA HA H 1 4.112 0.003 . 1 . . . . 84 Ala HA . 19599 1 966 . 1 1 84 84 ALA HB1 H 1 1.482 0.003 . 1 . . . . 84 Ala HB1 . 19599 1 967 . 1 1 84 84 ALA HB2 H 1 1.482 0.003 . 1 . . . . 84 Ala HB2 . 19599 1 968 . 1 1 84 84 ALA HB3 H 1 1.482 0.003 . 1 . . . . 84 Ala HB3 . 19599 1 969 . 1 1 84 84 ALA C C 13 180.481 0.000 . 1 . . . . 84 Ala C . 19599 1 970 . 1 1 84 84 ALA CA C 13 54.942 0.062 . 1 . . . . 84 Ala CA . 19599 1 971 . 1 1 84 84 ALA CB C 13 17.936 0.217 . 1 . . . . 84 Ala CB . 19599 1 972 . 1 1 84 84 ALA N N 15 120.904 0.064 . 1 . . . . 84 Ala N . 19599 1 973 . 1 1 85 85 GLN H H 1 8.016 0.008 . 1 . . . . 85 Gln H . 19599 1 974 . 1 1 85 85 GLN HA H 1 4.193 0.011 . 1 . . . . 85 Gln HA . 19599 1 975 . 1 1 85 85 GLN HB2 H 1 1.847 0.014 . 2 . . . . 85 Gln HB2 . 19599 1 976 . 1 1 85 85 GLN HB3 H 1 2.108 0.013 . 2 . . . . 85 Gln HB3 . 19599 1 977 . 1 1 85 85 GLN HG3 H 1 2.300 0.005 . 1 . . . . 85 Gln HG3 . 19599 1 978 . 1 1 85 85 GLN HE22 H 1 7.480 0.001 . 1 . . . . 85 Gln HE22 . 19599 1 979 . 1 1 85 85 GLN C C 13 178.128 0.000 . 1 . . . . 85 Gln C . 19599 1 980 . 1 1 85 85 GLN CA C 13 57.109 0.053 . 1 . . . . 85 Gln CA . 19599 1 981 . 1 1 85 85 GLN CB C 13 26.210 0.080 . 1 . . . . 85 Gln CB . 19599 1 982 . 1 1 85 85 GLN CG C 13 32.188 0.000 . 1 . . . . 85 Gln CG . 19599 1 983 . 1 1 85 85 GLN N N 15 120.618 0.039 . 1 . . . . 85 Gln N . 19599 1 984 . 1 1 85 85 GLN NE2 N 15 109.715 0.046 . 1 . . . . 85 Gln NE2 . 19599 1 985 . 1 1 86 86 GLY H H 1 8.728 0.010 . 1 . . . . 86 Gly H . 19599 1 986 . 1 1 86 86 GLY HA2 H 1 3.656 0.008 . 2 . . . . 86 Gly HA2 . 19599 1 987 . 1 1 86 86 GLY HA3 H 1 3.966 0.011 . 2 . . . . 86 Gly HA3 . 19599 1 988 . 1 1 86 86 GLY C C 13 176.387 0.000 . 1 . . . . 86 Gly C . 19599 1 989 . 1 1 86 86 GLY CA C 13 47.228 0.069 . 1 . . . . 86 Gly CA . 19599 1 990 . 1 1 86 86 GLY N N 15 109.514 0.035 . 1 . . . . 86 Gly N . 19599 1 991 . 1 1 87 87 GLU H H 1 7.540 0.007 . 1 . . . . 87 Glu H . 19599 1 992 . 1 1 87 87 GLU HA H 1 4.343 0.006 . 1 . . . . 87 Glu HA . 19599 1 993 . 1 1 87 87 GLU HB2 H 1 2.140 0.012 . 2 . . . . 87 Glu HB2 . 19599 1 994 . 1 1 87 87 GLU HB3 H 1 2.086 0.011 . 2 . . . . 87 Glu HB3 . 19599 1 995 . 1 1 87 87 GLU HG2 H 1 2.304 0.000 . 2 . . . . 87 Glu HG2 . 19599 1 996 . 1 1 87 87 GLU HG3 H 1 2.335 0.008 . 2 . . . . 87 Glu HG3 . 19599 1 997 . 1 1 87 87 GLU C C 13 177.733 0.000 . 1 . . . . 87 Glu C . 19599 1 998 . 1 1 87 87 GLU CA C 13 58.161 0.035 . 1 . . . . 87 Glu CA . 19599 1 999 . 1 1 87 87 GLU CB C 13 28.588 0.234 . 1 . . . . 87 Glu CB . 19599 1 1000 . 1 1 87 87 GLU CG C 13 35.339 0.019 . 1 . . . . 87 Glu CG . 19599 1 1001 . 1 1 87 87 GLU N N 15 122.683 0.023 . 1 . . . . 87 Glu N . 19599 1 1002 . 1 1 88 88 VAL H H 1 7.578 0.003 . 1 . . . . 88 Val H . 19599 1 1003 . 1 1 88 88 VAL HA H 1 3.557 0.005 . 1 . . . . 88 Val HA . 19599 1 1004 . 1 1 88 88 VAL HB H 1 2.313 0.003 . 1 . . . . 88 Val HB . 19599 1 1005 . 1 1 88 88 VAL HG11 H 1 1.024 0.006 . 2 . . . . 88 Val HG11 . 19599 1 1006 . 1 1 88 88 VAL HG12 H 1 1.024 0.006 . 2 . . . . 88 Val HG12 . 19599 1 1007 . 1 1 88 88 VAL HG13 H 1 1.024 0.006 . 2 . . . . 88 Val HG13 . 19599 1 1008 . 1 1 88 88 VAL HG21 H 1 0.893 0.006 . 2 . . . . 88 Val HG21 . 19599 1 1009 . 1 1 88 88 VAL HG22 H 1 0.893 0.006 . 2 . . . . 88 Val HG22 . 19599 1 1010 . 1 1 88 88 VAL HG23 H 1 0.893 0.006 . 2 . . . . 88 Val HG23 . 19599 1 1011 . 1 1 88 88 VAL C C 13 178.045 0.000 . 1 . . . . 88 Val C . 19599 1 1012 . 1 1 88 88 VAL CA C 13 67.025 0.027 . 1 . . . . 88 Val CA . 19599 1 1013 . 1 1 88 88 VAL CB C 13 31.426 0.088 . 1 . . . . 88 Val CB . 19599 1 1014 . 1 1 88 88 VAL CG1 C 13 22.657 0.078 . 2 . . . . 88 Val CG1 . 19599 1 1015 . 1 1 88 88 VAL CG2 C 13 21.052 0.045 . 2 . . . . 88 Val CG2 . 19599 1 1016 . 1 1 88 88 VAL N N 15 122.330 0.030 . 1 . . . . 88 Val N . 19599 1 1017 . 1 1 89 89 VAL H H 1 7.895 0.011 . 1 . . . . 89 Val H . 19599 1 1018 . 1 1 89 89 VAL HA H 1 3.281 0.003 . 1 . . . . 89 Val HA . 19599 1 1019 . 1 1 89 89 VAL HB H 1 2.177 0.008 . 1 . . . . 89 Val HB . 19599 1 1020 . 1 1 89 89 VAL HG11 H 1 0.868 0.009 . 2 . . . . 89 Val HG11 . 19599 1 1021 . 1 1 89 89 VAL HG12 H 1 0.868 0.009 . 2 . . . . 89 Val HG12 . 19599 1 1022 . 1 1 89 89 VAL HG13 H 1 0.868 0.009 . 2 . . . . 89 Val HG13 . 19599 1 1023 . 1 1 89 89 VAL HG21 H 1 1.033 0.016 . 2 . . . . 89 Val HG21 . 19599 1 1024 . 1 1 89 89 VAL HG22 H 1 1.033 0.016 . 2 . . . . 89 Val HG22 . 19599 1 1025 . 1 1 89 89 VAL HG23 H 1 1.033 0.016 . 2 . . . . 89 Val HG23 . 19599 1 1026 . 1 1 89 89 VAL C C 13 176.475 0.000 . 1 . . . . 89 Val C . 19599 1 1027 . 1 1 89 89 VAL CA C 13 67.638 0.032 . 1 . . . . 89 Val CA . 19599 1 1028 . 1 1 89 89 VAL CB C 13 31.964 0.170 . 1 . . . . 89 Val CB . 19599 1 1029 . 1 1 89 89 VAL CG1 C 13 21.753 0.085 . 2 . . . . 89 Val CG1 . 19599 1 1030 . 1 1 89 89 VAL CG2 C 13 24.148 0.077 . 2 . . . . 89 Val CG2 . 19599 1 1031 . 1 1 89 89 VAL N N 15 117.851 0.034 . 1 . . . . 89 Val N . 19599 1 1032 . 1 1 90 90 ARG H H 1 7.819 0.007 . 1 . . . . 90 Arg H . 19599 1 1033 . 1 1 90 90 ARG HA H 1 3.801 0.003 . 1 . . . . 90 Arg HA . 19599 1 1034 . 1 1 90 90 ARG HB2 H 1 1.904 0.015 . 1 . . . . 90 Arg HB2 . 19599 1 1035 . 1 1 90 90 ARG HG2 H 1 1.503 0.003 . 2 . . . . 90 Arg HG2 . 19599 1 1036 . 1 1 90 90 ARG HG3 H 1 1.698 0.010 . 2 . . . . 90 Arg HG3 . 19599 1 1037 . 1 1 90 90 ARG HD2 H 1 3.271 0.006 . 2 . . . . 90 Arg HD2 . 19599 1 1038 . 1 1 90 90 ARG HD3 H 1 3.082 0.006 . 2 . . . . 90 Arg HD3 . 19599 1 1039 . 1 1 90 90 ARG HE H 1 8.054 0.007 . 1 . . . . 90 Arg HE . 19599 1 1040 . 1 1 90 90 ARG HH11 H 1 6.853 0.006 . 1 . . . . 90 Arg HH11 . 19599 1 1041 . 1 1 90 90 ARG HH21 H 1 6.853 0.006 . 1 . . . . 90 Arg HH21 . 19599 1 1042 . 1 1 90 90 ARG C C 13 179.311 0.000 . 1 . . . . 90 Arg C . 19599 1 1043 . 1 1 90 90 ARG CA C 13 60.066 0.096 . 1 . . . . 90 Arg CA . 19599 1 1044 . 1 1 90 90 ARG CB C 13 30.123 0.021 . 1 . . . . 90 Arg CB . 19599 1 1045 . 1 1 90 90 ARG CG C 13 27.083 0.099 . 1 . . . . 90 Arg CG . 19599 1 1046 . 1 1 90 90 ARG CD C 13 42.811 0.033 . 1 . . . . 90 Arg CD . 19599 1 1047 . 1 1 90 90 ARG N N 15 118.292 0.027 . 1 . . . . 90 Arg N . 19599 1 1048 . 1 1 90 90 ARG NE N 15 83.003 0.000 . 1 . . . . 90 Arg NE . 19599 1 1049 . 1 1 91 91 LYS H H 1 8.351 0.004 . 1 . . . . 91 Lys H . 19599 1 1050 . 1 1 91 91 LYS HA H 1 3.925 0.005 . 1 . . . . 91 Lys HA . 19599 1 1051 . 1 1 91 91 LYS HB3 H 1 1.877 0.007 . 1 . . . . 91 Lys HB3 . 19599 1 1052 . 1 1 91 91 LYS HG2 H 1 1.283 0.005 . 2 . . . . 91 Lys HG2 . 19599 1 1053 . 1 1 91 91 LYS HG3 H 1 1.514 0.002 . 2 . . . . 91 Lys HG3 . 19599 1 1054 . 1 1 91 91 LYS HD3 H 1 1.626 0.002 . 1 . . . . 91 Lys HD3 . 19599 1 1055 . 1 1 91 91 LYS HE3 H 1 2.923 0.000 . 1 . . . . 91 Lys HE3 . 19599 1 1056 . 1 1 91 91 LYS C C 13 178.268 0.000 . 1 . . . . 91 Lys C . 19599 1 1057 . 1 1 91 91 LYS CA C 13 59.996 0.004 . 1 . . . . 91 Lys CA . 19599 1 1058 . 1 1 91 91 LYS CB C 13 32.546 0.056 . 1 . . . . 91 Lys CB . 19599 1 1059 . 1 1 91 91 LYS CG C 13 25.332 0.170 . 1 . . . . 91 Lys CG . 19599 1 1060 . 1 1 91 91 LYS N N 15 120.800 0.030 . 1 . . . . 91 Lys N . 19599 1 1061 . 1 1 92 92 LEU H H 1 8.353 0.009 . 1 . . . . 92 Leu H . 19599 1 1062 . 1 1 92 92 LEU HA H 1 4.028 0.007 . 1 . . . . 92 Leu HA . 19599 1 1063 . 1 1 92 92 LEU HB2 H 1 1.168 0.008 . 2 . . . . 92 Leu HB2 . 19599 1 1064 . 1 1 92 92 LEU HB3 H 1 1.892 0.009 . 2 . . . . 92 Leu HB3 . 19599 1 1065 . 1 1 92 92 LEU HG H 1 1.911 0.014 . 1 . . . . 92 Leu HG . 19599 1 1066 . 1 1 92 92 LEU HD11 H 1 0.796 0.005 . 2 . . . . 92 Leu HD11 . 19599 1 1067 . 1 1 92 92 LEU HD12 H 1 0.796 0.005 . 2 . . . . 92 Leu HD12 . 19599 1 1068 . 1 1 92 92 LEU HD13 H 1 0.796 0.005 . 2 . . . . 92 Leu HD13 . 19599 1 1069 . 1 1 92 92 LEU HD21 H 1 0.674 0.006 . 2 . . . . 92 Leu HD21 . 19599 1 1070 . 1 1 92 92 LEU HD22 H 1 0.674 0.006 . 2 . . . . 92 Leu HD22 . 19599 1 1071 . 1 1 92 92 LEU HD23 H 1 0.674 0.006 . 2 . . . . 92 Leu HD23 . 19599 1 1072 . 1 1 92 92 LEU C C 13 180.546 0.000 . 1 . . . . 92 Leu C . 19599 1 1073 . 1 1 92 92 LEU CA C 13 57.785 0.028 . 1 . . . . 92 Leu CA . 19599 1 1074 . 1 1 92 92 LEU CB C 13 42.902 0.096 . 1 . . . . 92 Leu CB . 19599 1 1075 . 1 1 92 92 LEU CG C 13 26.675 0.061 . 1 . . . . 92 Leu CG . 19599 1 1076 . 1 1 92 92 LEU CD1 C 13 22.536 0.072 . 2 . . . . 92 Leu CD1 . 19599 1 1077 . 1 1 92 92 LEU CD2 C 13 27.613 0.080 . 2 . . . . 92 Leu CD2 . 19599 1 1078 . 1 1 92 92 LEU N N 15 118.693 0.023 . 1 . . . . 92 Leu N . 19599 1 1079 . 1 1 93 93 LYS H H 1 8.147 0.008 . 1 . . . . 93 Lys H . 19599 1 1080 . 1 1 93 93 LYS HA H 1 4.013 0.004 . 1 . . . . 93 Lys HA . 19599 1 1081 . 1 1 93 93 LYS HB3 H 1 1.836 0.010 . 1 . . . . 93 Lys HB3 . 19599 1 1082 . 1 1 93 93 LYS HG2 H 1 1.681 0.008 . 2 . . . . 93 Lys HG2 . 19599 1 1083 . 1 1 93 93 LYS HG3 H 1 1.365 0.005 . 2 . . . . 93 Lys HG3 . 19599 1 1084 . 1 1 93 93 LYS HD3 H 1 1.591 0.006 . 1 . . . . 93 Lys HD3 . 19599 1 1085 . 1 1 93 93 LYS HE2 H 1 2.696 0.002 . 2 . . . . 93 Lys HE2 . 19599 1 1086 . 1 1 93 93 LYS HE3 H 1 2.834 0.008 . 2 . . . . 93 Lys HE3 . 19599 1 1087 . 1 1 93 93 LYS C C 13 179.871 0.000 . 1 . . . . 93 Lys C . 19599 1 1088 . 1 1 93 93 LYS CA C 13 59.929 0.062 . 1 . . . . 93 Lys CA . 19599 1 1089 . 1 1 93 93 LYS CB C 13 32.701 0.063 . 1 . . . . 93 Lys CB . 19599 1 1090 . 1 1 93 93 LYS CG C 13 26.729 0.028 . 1 . . . . 93 Lys CG . 19599 1 1091 . 1 1 93 93 LYS CD C 13 30.217 0.031 . 1 . . . . 93 Lys CD . 19599 1 1092 . 1 1 93 93 LYS CE C 13 41.780 0.040 . 1 . . . . 93 Lys CE . 19599 1 1093 . 1 1 93 93 LYS N N 15 117.512 0.034 . 1 . . . . 93 Lys N . 19599 1 1094 . 1 1 94 94 ALA H H 1 8.224 0.013 . 1 . . . . 94 Ala H . 19599 1 1095 . 1 1 94 94 ALA HA H 1 4.122 0.007 . 1 . . . . 94 Ala HA . 19599 1 1096 . 1 1 94 94 ALA HB1 H 1 1.517 0.007 . 1 . . . . 94 Ala HB1 . 19599 1 1097 . 1 1 94 94 ALA HB2 H 1 1.517 0.007 . 1 . . . . 94 Ala HB2 . 19599 1 1098 . 1 1 94 94 ALA HB3 H 1 1.517 0.007 . 1 . . . . 94 Ala HB3 . 19599 1 1099 . 1 1 94 94 ALA C C 13 179.060 0.000 . 1 . . . . 94 Ala C . 19599 1 1100 . 1 1 94 94 ALA CA C 13 54.856 0.041 . 1 . . . . 94 Ala CA . 19599 1 1101 . 1 1 94 94 ALA CB C 13 18.202 0.082 . 1 . . . . 94 Ala CB . 19599 1 1102 . 1 1 94 94 ALA N N 15 123.940 0.026 . 1 . . . . 94 Ala N . 19599 1 1103 . 1 1 95 95 GLU H H 1 7.842 0.010 . 1 . . . . 95 Glu H . 19599 1 1104 . 1 1 95 95 GLU HA H 1 4.254 0.017 . 1 . . . . 95 Glu HA . 19599 1 1105 . 1 1 95 95 GLU HB2 H 1 1.931 0.012 . 2 . . . . 95 Glu HB2 . 19599 1 1106 . 1 1 95 95 GLU HB3 H 1 2.135 0.002 . 2 . . . . 95 Glu HB3 . 19599 1 1107 . 1 1 95 95 GLU HG2 H 1 2.439 0.007 . 2 . . . . 95 Glu HG2 . 19599 1 1108 . 1 1 95 95 GLU HG3 H 1 2.378 0.015 . 2 . . . . 95 Glu HG3 . 19599 1 1109 . 1 1 95 95 GLU C C 13 175.013 0.000 . 1 . . . . 95 Glu C . 19599 1 1110 . 1 1 95 95 GLU CA C 13 55.650 0.029 . 1 . . . . 95 Glu CA . 19599 1 1111 . 1 1 95 95 GLU CB C 13 29.264 0.179 . 1 . . . . 95 Glu CB . 19599 1 1112 . 1 1 95 95 GLU CG C 13 35.819 0.097 . 1 . . . . 95 Glu CG . 19599 1 1113 . 1 1 95 95 GLU N N 15 115.145 0.022 . 1 . . . . 95 Glu N . 19599 1 1114 . 1 1 96 96 LYS H H 1 7.919 0.003 . 1 . . . . 96 Lys H . 19599 1 1115 . 1 1 96 96 LYS HA H 1 3.897 0.007 . 1 . . . . 96 Lys HA . 19599 1 1116 . 1 1 96 96 LYS HB2 H 1 1.819 0.004 . 2 . . . . 96 Lys HB2 . 19599 1 1117 . 1 1 96 96 LYS HB3 H 1 2.009 0.002 . 2 . . . . 96 Lys HB3 . 19599 1 1118 . 1 1 96 96 LYS HG3 H 1 1.331 0.003 . 1 . . . . 96 Lys HG3 . 19599 1 1119 . 1 1 96 96 LYS HD3 H 1 1.699 0.000 . 1 . . . . 96 Lys HD3 . 19599 1 1120 . 1 1 96 96 LYS HE3 H 1 2.976 0.000 . 1 . . . . 96 Lys HE3 . 19599 1 1121 . 1 1 96 96 LYS C C 13 175.865 0.000 . 1 . . . . 96 Lys C . 19599 1 1122 . 1 1 96 96 LYS CA C 13 57.027 0.086 . 1 . . . . 96 Lys CA . 19599 1 1123 . 1 1 96 96 LYS CB C 13 28.673 0.039 . 1 . . . . 96 Lys CB . 19599 1 1124 . 1 1 96 96 LYS CG C 13 24.820 0.065 . 1 . . . . 96 Lys CG . 19599 1 1125 . 1 1 96 96 LYS N N 15 116.988 0.036 . 1 . . . . 96 Lys N . 19599 1 1126 . 1 1 97 97 SER H H 1 7.591 0.004 . 1 . . . . 97 Ser H . 19599 1 1127 . 1 1 97 97 SER HA H 1 4.543 0.006 . 1 . . . . 97 Ser HA . 19599 1 1128 . 1 1 97 97 SER HB2 H 1 3.752 0.014 . 2 . . . . 97 Ser HB2 . 19599 1 1129 . 1 1 97 97 SER HB3 H 1 3.543 0.006 . 2 . . . . 97 Ser HB3 . 19599 1 1130 . 1 1 97 97 SER CA C 13 58.714 0.000 . 1 . . . . 97 Ser CA . 19599 1 1131 . 1 1 97 97 SER CB C 13 62.586 0.023 . 1 . . . . 97 Ser CB . 19599 1 1132 . 1 1 97 97 SER N N 15 114.493 0.009 . 1 . . . . 97 Ser N . 19599 1 1133 . 1 1 98 98 PRO HA H 1 4.390 0.011 . 1 . . . . 98 Pro HA . 19599 1 1134 . 1 1 98 98 PRO HB2 H 1 1.823 0.007 . 2 . . . . 98 Pro HB2 . 19599 1 1135 . 1 1 98 98 PRO HB3 H 1 2.465 0.008 . 2 . . . . 98 Pro HB3 . 19599 1 1136 . 1 1 98 98 PRO HG2 H 1 2.098 0.012 . 1 . . . . 98 Pro HG2 . 19599 1 1137 . 1 1 98 98 PRO HD2 H 1 3.973 0.002 . 2 . . . . 98 Pro HD2 . 19599 1 1138 . 1 1 98 98 PRO HD3 H 1 3.506 0.006 . 2 . . . . 98 Pro HD3 . 19599 1 1139 . 1 1 98 98 PRO C C 13 177.439 0.000 . 1 . . . . 98 Pro C . 19599 1 1140 . 1 1 98 98 PRO CA C 13 63.276 0.025 . 1 . . . . 98 Pro CA . 19599 1 1141 . 1 1 98 98 PRO CB C 13 32.289 0.175 . 1 . . . . 98 Pro CB . 19599 1 1142 . 1 1 98 98 PRO CG C 13 28.206 0.104 . 1 . . . . 98 Pro CG . 19599 1 1143 . 1 1 98 98 PRO CD C 13 50.723 0.049 . 1 . . . . 98 Pro CD . 19599 1 1144 . 1 1 99 99 LYS H H 1 8.649 0.005 . 1 . . . . 99 Lys H . 19599 1 1145 . 1 1 99 99 LYS HA H 1 3.801 0.007 . 1 . . . . 99 Lys HA . 19599 1 1146 . 1 1 99 99 LYS HB2 H 1 1.787 0.006 . 2 . . . . 99 Lys HB2 . 19599 1 1147 . 1 1 99 99 LYS HB3 H 1 1.853 0.003 . 2 . . . . 99 Lys HB3 . 19599 1 1148 . 1 1 99 99 LYS HG2 H 1 1.493 0.007 . 2 . . . . 99 Lys HG2 . 19599 1 1149 . 1 1 99 99 LYS HG3 H 1 1.432 0.005 . 2 . . . . 99 Lys HG3 . 19599 1 1150 . 1 1 99 99 LYS HD3 H 1 1.663 0.000 . 1 . . . . 99 Lys HD3 . 19599 1 1151 . 1 1 99 99 LYS C C 13 177.674 0.000 . 1 . . . . 99 Lys C . 19599 1 1152 . 1 1 99 99 LYS CA C 13 59.752 0.060 . 1 . . . . 99 Lys CA . 19599 1 1153 . 1 1 99 99 LYS CB C 13 32.256 0.053 . 1 . . . . 99 Lys CB . 19599 1 1154 . 1 1 99 99 LYS CG C 13 24.722 0.075 . 1 . . . . 99 Lys CG . 19599 1 1155 . 1 1 99 99 LYS N N 15 124.787 0.034 . 1 . . . . 99 Lys N . 19599 1 1156 . 1 1 100 100 ALA H H 1 8.890 0.003 . 1 . . . . 100 Ala H . 19599 1 1157 . 1 1 100 100 ALA HA H 1 4.098 0.005 . 1 . . . . 100 Ala HA . 19599 1 1158 . 1 1 100 100 ALA HB1 H 1 1.395 0.008 . 1 . . . . 100 Ala HB1 . 19599 1 1159 . 1 1 100 100 ALA HB2 H 1 1.395 0.008 . 1 . . . . 100 Ala HB2 . 19599 1 1160 . 1 1 100 100 ALA HB3 H 1 1.395 0.008 . 1 . . . . 100 Ala HB3 . 19599 1 1161 . 1 1 100 100 ALA C C 13 180.183 0.000 . 1 . . . . 100 Ala C . 19599 1 1162 . 1 1 100 100 ALA CA C 13 55.312 0.025 . 1 . . . . 100 Ala CA . 19599 1 1163 . 1 1 100 100 ALA CB C 13 18.473 0.050 . 1 . . . . 100 Ala CB . 19599 1 1164 . 1 1 100 100 ALA N N 15 119.001 0.033 . 1 . . . . 100 Ala N . 19599 1 1165 . 1 1 101 101 LYS H H 1 7.149 0.002 . 1 . . . . 101 Lys H . 19599 1 1166 . 1 1 101 101 LYS HA H 1 4.138 0.003 . 1 . . . . 101 Lys HA . 19599 1 1167 . 1 1 101 101 LYS HB2 H 1 1.840 0.006 . 2 . . . . 101 Lys HB2 . 19599 1 1168 . 1 1 101 101 LYS HB3 H 1 1.953 0.002 . 2 . . . . 101 Lys HB3 . 19599 1 1169 . 1 1 101 101 LYS HG2 H 1 1.522 0.015 . 2 . . . . 101 Lys HG2 . 19599 1 1170 . 1 1 101 101 LYS HG3 H 1 1.447 0.004 . 2 . . . . 101 Lys HG3 . 19599 1 1171 . 1 1 101 101 LYS C C 13 179.378 0.000 . 1 . . . . 101 Lys C . 19599 1 1172 . 1 1 101 101 LYS CA C 13 57.703 0.025 . 1 . . . . 101 Lys CA . 19599 1 1173 . 1 1 101 101 LYS CB C 13 32.167 0.032 . 1 . . . . 101 Lys CB . 19599 1 1174 . 1 1 101 101 LYS CG C 13 24.723 0.065 . 1 . . . . 101 Lys CG . 19599 1 1175 . 1 1 101 101 LYS N N 15 116.191 0.025 . 1 . . . . 101 Lys N . 19599 1 1176 . 1 1 102 102 ILE H H 1 7.623 0.007 . 1 . . . . 102 Ile H . 19599 1 1177 . 1 1 102 102 ILE HA H 1 3.499 0.007 . 1 . . . . 102 Ile HA . 19599 1 1178 . 1 1 102 102 ILE HB H 1 1.824 0.009 . 1 . . . . 102 Ile HB . 19599 1 1179 . 1 1 102 102 ILE HG12 H 1 0.684 0.004 . 2 . . . . 102 Ile HG12 . 19599 1 1180 . 1 1 102 102 ILE HG13 H 1 1.493 0.006 . 2 . . . . 102 Ile HG13 . 19599 1 1181 . 1 1 102 102 ILE HG21 H 1 0.856 0.004 . 1 . . . . 102 Ile HG21 . 19599 1 1182 . 1 1 102 102 ILE HG22 H 1 0.856 0.004 . 1 . . . . 102 Ile HG22 . 19599 1 1183 . 1 1 102 102 ILE HG23 H 1 0.856 0.004 . 1 . . . . 102 Ile HG23 . 19599 1 1184 . 1 1 102 102 ILE HD11 H 1 0.794 0.008 . 1 . . . . 102 Ile HD11 . 19599 1 1185 . 1 1 102 102 ILE HD12 H 1 0.794 0.008 . 1 . . . . 102 Ile HD12 . 19599 1 1186 . 1 1 102 102 ILE HD13 H 1 0.794 0.008 . 1 . . . . 102 Ile HD13 . 19599 1 1187 . 1 1 102 102 ILE C C 13 176.946 0.000 . 1 . . . . 102 Ile C . 19599 1 1188 . 1 1 102 102 ILE CA C 13 65.985 0.021 . 1 . . . . 102 Ile CA . 19599 1 1189 . 1 1 102 102 ILE CB C 13 38.291 0.174 . 1 . . . . 102 Ile CB . 19599 1 1190 . 1 1 102 102 ILE CG1 C 13 30.143 0.084 . 1 . . . . 102 Ile CG1 . 19599 1 1191 . 1 1 102 102 ILE CG2 C 13 17.686 0.099 . 1 . . . . 102 Ile CG2 . 19599 1 1192 . 1 1 102 102 ILE CD1 C 13 14.443 0.086 . 1 . . . . 102 Ile CD1 . 19599 1 1193 . 1 1 102 102 ILE N N 15 120.913 0.026 . 1 . . . . 102 Ile N . 19599 1 1194 . 1 1 103 103 ASN H H 1 8.787 0.005 . 1 . . . . 103 Asn H . 19599 1 1195 . 1 1 103 103 ASN HA H 1 4.328 0.013 . 1 . . . . 103 Asn HA . 19599 1 1196 . 1 1 103 103 ASN HB3 H 1 2.807 0.003 . 1 . . . . 103 Asn HB3 . 19599 1 1197 . 1 1 103 103 ASN HD21 H 1 6.759 0.003 . 1 . . . . 103 Asn HD21 . 19599 1 1198 . 1 1 103 103 ASN HD22 H 1 7.622 0.013 . 1 . . . . 103 Asn HD22 . 19599 1 1199 . 1 1 103 103 ASN C C 13 177.712 0.000 . 1 . . . . 103 Asn C . 19599 1 1200 . 1 1 103 103 ASN CA C 13 56.275 0.047 . 1 . . . . 103 Asn CA . 19599 1 1201 . 1 1 103 103 ASN CB C 13 37.539 0.062 . 1 . . . . 103 Asn CB . 19599 1 1202 . 1 1 103 103 ASN N N 15 117.686 0.021 . 1 . . . . 103 Asn N . 19599 1 1203 . 1 1 103 103 ASN ND2 N 15 110.778 0.244 . 1 . . . . 103 Asn ND2 . 19599 1 1204 . 1 1 104 104 GLU H H 1 7.691 0.005 . 1 . . . . 104 Glu H . 19599 1 1205 . 1 1 104 104 GLU HA H 1 4.041 0.005 . 1 . . . . 104 Glu HA . 19599 1 1206 . 1 1 104 104 GLU HB2 H 1 2.107 0.006 . 2 . . . . 104 Glu HB2 . 19599 1 1207 . 1 1 104 104 GLU HB3 H 1 2.077 0.009 . 2 . . . . 104 Glu HB3 . 19599 1 1208 . 1 1 104 104 GLU HG2 H 1 2.213 0.018 . 2 . . . . 104 Glu HG2 . 19599 1 1209 . 1 1 104 104 GLU HG3 H 1 2.428 0.002 . 2 . . . . 104 Glu HG3 . 19599 1 1210 . 1 1 104 104 GLU C C 13 178.142 0.000 . 1 . . . . 104 Glu C . 19599 1 1211 . 1 1 104 104 GLU CA C 13 59.308 0.030 . 1 . . . . 104 Glu CA . 19599 1 1212 . 1 1 104 104 GLU CB C 13 29.662 0.063 . 1 . . . . 104 Glu CB . 19599 1 1213 . 1 1 104 104 GLU CG C 13 36.031 0.032 . 1 . . . . 104 Glu CG . 19599 1 1214 . 1 1 104 104 GLU N N 15 119.587 0.021 . 1 . . . . 104 Glu N . 19599 1 1215 . 1 1 105 105 ALA H H 1 7.612 0.005 . 1 . . . . 105 Ala H . 19599 1 1216 . 1 1 105 105 ALA HA H 1 4.073 0.007 . 1 . . . . 105 Ala HA . 19599 1 1217 . 1 1 105 105 ALA HB1 H 1 1.429 0.003 . 1 . . . . 105 Ala HB1 . 19599 1 1218 . 1 1 105 105 ALA HB2 H 1 1.429 0.003 . 1 . . . . 105 Ala HB2 . 19599 1 1219 . 1 1 105 105 ALA HB3 H 1 1.429 0.003 . 1 . . . . 105 Ala HB3 . 19599 1 1220 . 1 1 105 105 ALA C C 13 180.383 0.000 . 1 . . . . 105 Ala C . 19599 1 1221 . 1 1 105 105 ALA CA C 13 54.630 0.044 . 1 . . . . 105 Ala CA . 19599 1 1222 . 1 1 105 105 ALA CB C 13 19.209 0.041 . 1 . . . . 105 Ala CB . 19599 1 1223 . 1 1 105 105 ALA N N 15 122.937 0.020 . 1 . . . . 105 Ala N . 19599 1 1224 . 1 1 106 106 VAL H H 1 8.895 0.010 . 1 . . . . 106 Val H . 19599 1 1225 . 1 1 106 106 VAL HA H 1 3.538 0.006 . 1 . . . . 106 Val HA . 19599 1 1226 . 1 1 106 106 VAL HB H 1 2.210 0.004 . 1 . . . . 106 Val HB . 19599 1 1227 . 1 1 106 106 VAL HG11 H 1 1.069 0.009 . 2 . . . . 106 Val HG11 . 19599 1 1228 . 1 1 106 106 VAL HG12 H 1 1.069 0.009 . 2 . . . . 106 Val HG12 . 19599 1 1229 . 1 1 106 106 VAL HG13 H 1 1.069 0.009 . 2 . . . . 106 Val HG13 . 19599 1 1230 . 1 1 106 106 VAL HG21 H 1 0.926 0.010 . 2 . . . . 106 Val HG21 . 19599 1 1231 . 1 1 106 106 VAL HG22 H 1 0.926 0.010 . 2 . . . . 106 Val HG22 . 19599 1 1232 . 1 1 106 106 VAL HG23 H 1 0.926 0.010 . 2 . . . . 106 Val HG23 . 19599 1 1233 . 1 1 106 106 VAL C C 13 177.226 0.000 . 1 . . . . 106 Val C . 19599 1 1234 . 1 1 106 106 VAL CA C 13 66.724 0.057 . 1 . . . . 106 Val CA . 19599 1 1235 . 1 1 106 106 VAL CB C 13 32.087 0.071 . 1 . . . . 106 Val CB . 19599 1 1236 . 1 1 106 106 VAL CG1 C 13 24.130 0.051 . 2 . . . . 106 Val CG1 . 19599 1 1237 . 1 1 106 106 VAL CG2 C 13 21.147 0.049 . 2 . . . . 106 Val CG2 . 19599 1 1238 . 1 1 106 106 VAL N N 15 122.687 0.013 . 1 . . . . 106 Val N . 19599 1 1239 . 1 1 107 107 GLU H H 1 8.369 0.003 . 1 . . . . 107 Glu H . 19599 1 1240 . 1 1 107 107 GLU HA H 1 3.944 0.009 . 1 . . . . 107 Glu HA . 19599 1 1241 . 1 1 107 107 GLU HB2 H 1 2.096 0.011 . 1 . . . . 107 Glu HB2 . 19599 1 1242 . 1 1 107 107 GLU HG2 H 1 2.413 0.003 . 2 . . . . 107 Glu HG2 . 19599 1 1243 . 1 1 107 107 GLU HG3 H 1 2.307 0.004 . 2 . . . . 107 Glu HG3 . 19599 1 1244 . 1 1 107 107 GLU C C 13 179.034 0.000 . 1 . . . . 107 Glu C . 19599 1 1245 . 1 1 107 107 GLU CA C 13 59.879 0.000 . 1 . . . . 107 Glu CA . 19599 1 1246 . 1 1 107 107 GLU CB C 13 28.573 0.104 . 1 . . . . 107 Glu CB . 19599 1 1247 . 1 1 107 107 GLU CG C 13 35.700 0.063 . 1 . . . . 107 Glu CG . 19599 1 1248 . 1 1 107 107 GLU N N 15 120.555 0.029 . 1 . . . . 107 Glu N . 19599 1 1249 . 1 1 108 108 CYS H H 1 7.740 0.005 . 1 . . . . 108 Cys H . 19599 1 1250 . 1 1 108 108 CYS HA H 1 4.169 0.005 . 1 . . . . 108 Cys HA . 19599 1 1251 . 1 1 108 108 CYS HB2 H 1 2.822 0.002 . 2 . . . . 108 Cys HB2 . 19599 1 1252 . 1 1 108 108 CYS HB3 H 1 3.164 0.002 . 2 . . . . 108 Cys HB3 . 19599 1 1253 . 1 1 108 108 CYS C C 13 176.091 0.000 . 1 . . . . 108 Cys C . 19599 1 1254 . 1 1 108 108 CYS CA C 13 61.785 0.038 . 1 . . . . 108 Cys CA . 19599 1 1255 . 1 1 108 108 CYS CB C 13 26.534 0.033 . 1 . . . . 108 Cys CB . 19599 1 1256 . 1 1 108 108 CYS N N 15 118.901 0.034 . 1 . . . . 108 Cys N . 19599 1 1257 . 1 1 109 109 LEU H H 1 7.971 0.013 . 1 . . . . 109 Leu H . 19599 1 1258 . 1 1 109 109 LEU HA H 1 3.863 0.005 . 1 . . . . 109 Leu HA . 19599 1 1259 . 1 1 109 109 LEU HB2 H 1 2.453 0.004 . 2 . . . . 109 Leu HB2 . 19599 1 1260 . 1 1 109 109 LEU HB3 H 1 1.339 0.008 . 2 . . . . 109 Leu HB3 . 19599 1 1261 . 1 1 109 109 LEU HG H 1 1.368 0.011 . 1 . . . . 109 Leu HG . 19599 1 1262 . 1 1 109 109 LEU HD11 H 1 0.943 0.007 . 2 . . . . 109 Leu HD11 . 19599 1 1263 . 1 1 109 109 LEU HD12 H 1 0.943 0.007 . 2 . . . . 109 Leu HD12 . 19599 1 1264 . 1 1 109 109 LEU HD13 H 1 0.943 0.007 . 2 . . . . 109 Leu HD13 . 19599 1 1265 . 1 1 109 109 LEU HD21 H 1 0.736 0.005 . 2 . . . . 109 Leu HD21 . 19599 1 1266 . 1 1 109 109 LEU HD22 H 1 0.736 0.005 . 2 . . . . 109 Leu HD22 . 19599 1 1267 . 1 1 109 109 LEU HD23 H 1 0.736 0.005 . 2 . . . . 109 Leu HD23 . 19599 1 1268 . 1 1 109 109 LEU C C 13 177.351 0.000 . 1 . . . . 109 Leu C . 19599 1 1269 . 1 1 109 109 LEU CA C 13 58.722 0.048 . 1 . . . . 109 Leu CA . 19599 1 1270 . 1 1 109 109 LEU CB C 13 42.127 0.049 . 1 . . . . 109 Leu CB . 19599 1 1271 . 1 1 109 109 LEU CG C 13 27.139 0.089 . 1 . . . . 109 Leu CG . 19599 1 1272 . 1 1 109 109 LEU CD1 C 13 26.538 0.073 . 2 . . . . 109 Leu CD1 . 19599 1 1273 . 1 1 109 109 LEU CD2 C 13 24.046 0.072 . 2 . . . . 109 Leu CD2 . 19599 1 1274 . 1 1 109 109 LEU N N 15 120.817 0.033 . 1 . . . . 109 Leu N . 19599 1 1275 . 1 1 110 110 LEU H H 1 8.820 0.007 . 1 . . . . 110 Leu H . 19599 1 1276 . 1 1 110 110 LEU HA H 1 3.922 0.013 . 1 . . . . 110 Leu HA . 19599 1 1277 . 1 1 110 110 LEU HB2 H 1 1.512 0.008 . 2 . . . . 110 Leu HB2 . 19599 1 1278 . 1 1 110 110 LEU HB3 H 1 1.891 0.013 . 2 . . . . 110 Leu HB3 . 19599 1 1279 . 1 1 110 110 LEU HG H 1 1.862 0.001 . 1 . . . . 110 Leu HG . 19599 1 1280 . 1 1 110 110 LEU HD11 H 1 0.836 0.001 . 2 . . . . 110 Leu HD11 . 19599 1 1281 . 1 1 110 110 LEU HD12 H 1 0.836 0.001 . 2 . . . . 110 Leu HD12 . 19599 1 1282 . 1 1 110 110 LEU HD13 H 1 0.836 0.001 . 2 . . . . 110 Leu HD13 . 19599 1 1283 . 1 1 110 110 LEU HD21 H 1 0.850 0.004 . 2 . . . . 110 Leu HD21 . 19599 1 1284 . 1 1 110 110 LEU HD22 H 1 0.850 0.004 . 2 . . . . 110 Leu HD22 . 19599 1 1285 . 1 1 110 110 LEU HD23 H 1 0.850 0.004 . 2 . . . . 110 Leu HD23 . 19599 1 1286 . 1 1 110 110 LEU C C 13 180.257 0.000 . 1 . . . . 110 Leu C . 19599 1 1287 . 1 1 110 110 LEU CA C 13 58.427 0.013 . 1 . . . . 110 Leu CA . 19599 1 1288 . 1 1 110 110 LEU CB C 13 41.071 0.051 . 1 . . . . 110 Leu CB . 19599 1 1289 . 1 1 110 110 LEU CG C 13 27.161 0.141 . 1 . . . . 110 Leu CG . 19599 1 1290 . 1 1 110 110 LEU CD1 C 13 22.615 0.046 . 2 . . . . 110 Leu CD1 . 19599 1 1291 . 1 1 110 110 LEU CD2 C 13 25.326 0.019 . 2 . . . . 110 Leu CD2 . 19599 1 1292 . 1 1 110 110 LEU N N 15 118.491 0.020 . 1 . . . . 110 Leu N . 19599 1 1293 . 1 1 111 111 SER H H 1 8.063 0.008 . 1 . . . . 111 Ser H . 19599 1 1294 . 1 1 111 111 SER HA H 1 4.320 0.002 . 1 . . . . 111 Ser HA . 19599 1 1295 . 1 1 111 111 SER HB3 H 1 4.043 0.012 . 1 . . . . 111 Ser HB3 . 19599 1 1296 . 1 1 111 111 SER C C 13 177.318 0.000 . 1 . . . . 111 Ser C . 19599 1 1297 . 1 1 111 111 SER CA C 13 61.468 0.014 . 1 . . . . 111 Ser CA . 19599 1 1298 . 1 1 111 111 SER CB C 13 62.666 0.029 . 1 . . . . 111 Ser CB . 19599 1 1299 . 1 1 111 111 SER N N 15 116.672 0.055 . 1 . . . . 111 Ser N . 19599 1 1300 . 1 1 112 112 LEU H H 1 8.390 0.005 . 1 . . . . 112 Leu H . 19599 1 1301 . 1 1 112 112 LEU HA H 1 4.085 0.012 . 1 . . . . 112 Leu HA . 19599 1 1302 . 1 1 112 112 LEU HB2 H 1 1.286 0.015 . 2 . . . . 112 Leu HB2 . 19599 1 1303 . 1 1 112 112 LEU HB3 H 1 1.926 0.019 . 2 . . . . 112 Leu HB3 . 19599 1 1304 . 1 1 112 112 LEU HG H 1 1.841 0.004 . 1 . . . . 112 Leu HG . 19599 1 1305 . 1 1 112 112 LEU HD11 H 1 0.753 0.012 . 2 . . . . 112 Leu HD11 . 19599 1 1306 . 1 1 112 112 LEU HD12 H 1 0.753 0.012 . 2 . . . . 112 Leu HD12 . 19599 1 1307 . 1 1 112 112 LEU HD13 H 1 0.753 0.012 . 2 . . . . 112 Leu HD13 . 19599 1 1308 . 1 1 112 112 LEU HD21 H 1 0.706 0.012 . 2 . . . . 112 Leu HD21 . 19599 1 1309 . 1 1 112 112 LEU HD22 H 1 0.706 0.012 . 2 . . . . 112 Leu HD22 . 19599 1 1310 . 1 1 112 112 LEU HD23 H 1 0.706 0.012 . 2 . . . . 112 Leu HD23 . 19599 1 1311 . 1 1 112 112 LEU C C 13 179.225 0.000 . 1 . . . . 112 Leu C . 19599 1 1312 . 1 1 112 112 LEU CA C 13 58.104 0.073 . 1 . . . . 112 Leu CA . 19599 1 1313 . 1 1 112 112 LEU CB C 13 42.774 0.130 . 1 . . . . 112 Leu CB . 19599 1 1314 . 1 1 112 112 LEU CG C 13 26.784 0.120 . 1 . . . . 112 Leu CG . 19599 1 1315 . 1 1 112 112 LEU CD1 C 13 22.283 0.130 . 2 . . . . 112 Leu CD1 . 19599 1 1316 . 1 1 112 112 LEU CD2 C 13 26.767 0.084 . 2 . . . . 112 Leu CD2 . 19599 1 1317 . 1 1 112 112 LEU N N 15 123.212 0.046 . 1 . . . . 112 Leu N . 19599 1 1318 . 1 1 113 113 LYS H H 1 8.671 0.012 . 1 . . . . 113 Lys H . 19599 1 1319 . 1 1 113 113 LYS HA H 1 3.733 0.004 . 1 . . . . 113 Lys HA . 19599 1 1320 . 1 1 113 113 LYS HB2 H 1 1.908 0.009 . 2 . . . . 113 Lys HB2 . 19599 1 1321 . 1 1 113 113 LYS HB3 H 1 2.015 0.002 . 2 . . . . 113 Lys HB3 . 19599 1 1322 . 1 1 113 113 LYS HG2 H 1 1.630 0.005 . 2 . . . . 113 Lys HG2 . 19599 1 1323 . 1 1 113 113 LYS HG3 H 1 0.915 0.009 . 2 . . . . 113 Lys HG3 . 19599 1 1324 . 1 1 113 113 LYS HD3 H 1 1.635 0.011 . 1 . . . . 113 Lys HD3 . 19599 1 1325 . 1 1 113 113 LYS HE2 H 1 2.686 0.015 . 2 . . . . 113 Lys HE2 . 19599 1 1326 . 1 1 113 113 LYS HE3 H 1 2.761 0.027 . 2 . . . . 113 Lys HE3 . 19599 1 1327 . 1 1 113 113 LYS C C 13 179.283 0.000 . 1 . . . . 113 Lys C . 19599 1 1328 . 1 1 113 113 LYS CA C 13 61.319 0.104 . 1 . . . . 113 Lys CA . 19599 1 1329 . 1 1 113 113 LYS CB C 13 32.402 0.144 . 1 . . . . 113 Lys CB . 19599 1 1330 . 1 1 113 113 LYS CG C 13 28.223 0.034 . 1 . . . . 113 Lys CG . 19599 1 1331 . 1 1 113 113 LYS CD C 13 30.069 0.016 . 1 . . . . 113 Lys CD . 19599 1 1332 . 1 1 113 113 LYS CE C 13 41.834 0.046 . 1 . . . . 113 Lys CE . 19599 1 1333 . 1 1 113 113 LYS N N 15 119.233 0.030 . 1 . . . . 113 Lys N . 19599 1 1334 . 1 1 114 114 ALA H H 1 8.085 0.003 . 1 . . . . 114 Ala H . 19599 1 1335 . 1 1 114 114 ALA HA H 1 4.284 0.014 . 1 . . . . 114 Ala HA . 19599 1 1336 . 1 1 114 114 ALA HB1 H 1 1.584 0.005 . 1 . . . . 114 Ala HB1 . 19599 1 1337 . 1 1 114 114 ALA HB2 H 1 1.584 0.005 . 1 . . . . 114 Ala HB2 . 19599 1 1338 . 1 1 114 114 ALA HB3 H 1 1.584 0.005 . 1 . . . . 114 Ala HB3 . 19599 1 1339 . 1 1 114 114 ALA C C 13 180.378 0.000 . 1 . . . . 114 Ala C . 19599 1 1340 . 1 1 114 114 ALA CA C 13 55.275 0.032 . 1 . . . . 114 Ala CA . 19599 1 1341 . 1 1 114 114 ALA CB C 13 17.693 0.036 . 1 . . . . 114 Ala CB . 19599 1 1342 . 1 1 114 114 ALA N N 15 124.096 0.016 . 1 . . . . 114 Ala N . 19599 1 1343 . 1 1 115 115 GLN H H 1 8.324 0.004 . 1 . . . . 115 Gln H . 19599 1 1344 . 1 1 115 115 GLN HA H 1 4.084 0.008 . 1 . . . . 115 Gln HA . 19599 1 1345 . 1 1 115 115 GLN HB2 H 1 2.270 0.004 . 2 . . . . 115 Gln HB2 . 19599 1 1346 . 1 1 115 115 GLN HB3 H 1 2.159 0.006 . 2 . . . . 115 Gln HB3 . 19599 1 1347 . 1 1 115 115 GLN HG2 H 1 2.323 0.005 . 2 . . . . 115 Gln HG2 . 19599 1 1348 . 1 1 115 115 GLN HG3 H 1 2.579 0.004 . 2 . . . . 115 Gln HG3 . 19599 1 1349 . 1 1 115 115 GLN HE21 H 1 6.831 0.004 . 1 . . . . 115 Gln HE21 . 19599 1 1350 . 1 1 115 115 GLN HE22 H 1 7.193 0.003 . 1 . . . . 115 Gln HE22 . 19599 1 1351 . 1 1 115 115 GLN C C 13 177.797 0.000 . 1 . . . . 115 Gln C . 19599 1 1352 . 1 1 115 115 GLN CA C 13 58.978 0.006 . 1 . . . . 115 Gln CA . 19599 1 1353 . 1 1 115 115 GLN CB C 13 29.184 0.070 . 1 . . . . 115 Gln CB . 19599 1 1354 . 1 1 115 115 GLN CG C 13 34.661 0.082 . 1 . . . . 115 Gln CG . 19599 1 1355 . 1 1 115 115 GLN N N 15 120.440 0.060 . 1 . . . . 115 Gln N . 19599 1 1356 . 1 1 115 115 GLN NE2 N 15 110.724 0.247 . 1 . . . . 115 Gln NE2 . 19599 1 1357 . 1 1 116 116 TYR H H 1 8.722 0.005 . 1 . . . . 116 Tyr H . 19599 1 1358 . 1 1 116 116 TYR HA H 1 3.944 0.006 . 1 . . . . 116 Tyr HA . 19599 1 1359 . 1 1 116 116 TYR HB2 H 1 2.956 0.004 . 2 . . . . 116 Tyr HB2 . 19599 1 1360 . 1 1 116 116 TYR HB3 H 1 3.305 0.006 . 2 . . . . 116 Tyr HB3 . 19599 1 1361 . 1 1 116 116 TYR HD1 H 1 7.159 0.005 . 3 . . . . 116 Tyr HD1 . 19599 1 1362 . 1 1 116 116 TYR HD2 H 1 7.159 0.005 . 3 . . . . 116 Tyr HD2 . 19599 1 1363 . 1 1 116 116 TYR HE1 H 1 6.852 0.003 . 3 . . . . 116 Tyr HE1 . 19599 1 1364 . 1 1 116 116 TYR HE2 H 1 6.852 0.003 . 3 . . . . 116 Tyr HE2 . 19599 1 1365 . 1 1 116 116 TYR C C 13 177.682 0.000 . 1 . . . . 116 Tyr C . 19599 1 1366 . 1 1 116 116 TYR CA C 13 63.034 0.041 . 1 . . . . 116 Tyr CA . 19599 1 1367 . 1 1 116 116 TYR CB C 13 38.761 0.030 . 1 . . . . 116 Tyr CB . 19599 1 1368 . 1 1 116 116 TYR N N 15 121.219 0.035 . 1 . . . . 116 Tyr N . 19599 1 1369 . 1 1 117 117 LYS H H 1 8.056 0.006 . 1 . . . . 117 Lys H . 19599 1 1370 . 1 1 117 117 LYS HA H 1 4.448 0.016 . 1 . . . . 117 Lys HA . 19599 1 1371 . 1 1 117 117 LYS HB3 H 1 1.991 0.003 . 1 . . . . 117 Lys HB3 . 19599 1 1372 . 1 1 117 117 LYS HG2 H 1 1.045 0.002 . 2 . . . . 117 Lys HG2 . 19599 1 1373 . 1 1 117 117 LYS HG3 H 1 1.352 0.003 . 2 . . . . 117 Lys HG3 . 19599 1 1374 . 1 1 117 117 LYS HD2 H 1 1.525 0.015 . 2 . . . . 117 Lys HD2 . 19599 1 1375 . 1 1 117 117 LYS HD3 H 1 1.472 0.006 . 2 . . . . 117 Lys HD3 . 19599 1 1376 . 1 1 117 117 LYS HE3 H 1 2.876 0.013 . 1 . . . . 117 Lys HE3 . 19599 1 1377 . 1 1 117 117 LYS C C 13 179.371 0.000 . 1 . . . . 117 Lys C . 19599 1 1378 . 1 1 117 117 LYS CA C 13 58.269 0.106 . 1 . . . . 117 Lys CA . 19599 1 1379 . 1 1 117 117 LYS CB C 13 32.275 0.142 . 1 . . . . 117 Lys CB . 19599 1 1380 . 1 1 117 117 LYS CG C 13 24.710 0.046 . 1 . . . . 117 Lys CG . 19599 1 1381 . 1 1 117 117 LYS CD C 13 29.809 0.000 . 1 . . . . 117 Lys CD . 19599 1 1382 . 1 1 117 117 LYS CE C 13 42.222 0.103 . 1 . . . . 117 Lys CE . 19599 1 1383 . 1 1 117 117 LYS N N 15 122.865 0.038 . 1 . . . . 117 Lys N . 19599 1 1384 . 1 1 118 118 GLU H H 1 8.158 0.008 . 1 . . . . 118 Glu H . 19599 1 1385 . 1 1 118 118 GLU HA H 1 3.929 0.011 . 1 . . . . 118 Glu HA . 19599 1 1386 . 1 1 118 118 GLU HB2 H 1 2.115 0.003 . 1 . . . . 118 Glu HB2 . 19599 1 1387 . 1 1 118 118 GLU HG2 H 1 2.246 0.010 . 2 . . . . 118 Glu HG2 . 19599 1 1388 . 1 1 118 118 GLU HG3 H 1 2.347 0.000 . 2 . . . . 118 Glu HG3 . 19599 1 1389 . 1 1 118 118 GLU C C 13 178.020 0.000 . 1 . . . . 118 Glu C . 19599 1 1390 . 1 1 118 118 GLU CA C 13 59.188 0.041 . 1 . . . . 118 Glu CA . 19599 1 1391 . 1 1 118 118 GLU CB C 13 29.265 0.122 . 1 . . . . 118 Glu CB . 19599 1 1392 . 1 1 118 118 GLU CG C 13 35.728 0.038 . 1 . . . . 118 Glu CG . 19599 1 1393 . 1 1 118 118 GLU N N 15 120.471 0.056 . 1 . . . . 118 Glu N . 19599 1 1394 . 1 1 119 119 LYS H H 1 8.134 0.005 . 1 . . . . 119 Lys H . 19599 1 1395 . 1 1 119 119 LYS HA H 1 4.138 0.006 . 1 . . . . 119 Lys HA . 19599 1 1396 . 1 1 119 119 LYS HB2 H 1 1.773 0.008 . 2 . . . . 119 Lys HB2 . 19599 1 1397 . 1 1 119 119 LYS HB3 H 1 1.739 0.011 . 2 . . . . 119 Lys HB3 . 19599 1 1398 . 1 1 119 119 LYS HG3 H 1 1.448 0.010 . 1 . . . . 119 Lys HG3 . 19599 1 1399 . 1 1 119 119 LYS HD3 H 1 1.628 0.013 . 1 . . . . 119 Lys HD3 . 19599 1 1400 . 1 1 119 119 LYS HE3 H 1 2.926 0.002 . 1 . . . . 119 Lys HE3 . 19599 1 1401 . 1 1 119 119 LYS C C 13 177.951 0.000 . 1 . . . . 119 Lys C . 19599 1 1402 . 1 1 119 119 LYS CA C 13 58.016 0.034 . 1 . . . . 119 Lys CA . 19599 1 1403 . 1 1 119 119 LYS CB C 13 32.950 0.117 . 1 . . . . 119 Lys CB . 19599 1 1404 . 1 1 119 119 LYS CG C 13 25.154 0.162 . 1 . . . . 119 Lys CG . 19599 1 1405 . 1 1 119 119 LYS CD C 13 28.641 0.149 . 1 . . . . 119 Lys CD . 19599 1 1406 . 1 1 119 119 LYS CE C 13 41.760 0.000 . 1 . . . . 119 Lys CE . 19599 1 1407 . 1 1 119 119 LYS N N 15 115.866 0.017 . 1 . . . . 119 Lys N . 19599 1 1408 . 1 1 120 120 THR H H 1 8.070 0.008 . 1 . . . . 120 Thr H . 19599 1 1409 . 1 1 120 120 THR HA H 1 4.341 0.008 . 1 . . . . 120 Thr HA . 19599 1 1410 . 1 1 120 120 THR HB H 1 4.036 0.006 . 1 . . . . 120 Thr HB . 19599 1 1411 . 1 1 120 120 THR HG1 H 1 2.665 0.004 . 1 . . . . 120 Thr HG1 . 19599 1 1412 . 1 1 120 120 THR HG21 H 1 0.766 0.002 . 1 . . . . 120 Thr HG21 . 19599 1 1413 . 1 1 120 120 THR HG22 H 1 0.766 0.002 . 1 . . . . 120 Thr HG22 . 19599 1 1414 . 1 1 120 120 THR HG23 H 1 0.766 0.002 . 1 . . . . 120 Thr HG23 . 19599 1 1415 . 1 1 120 120 THR C C 13 176.007 0.000 . 1 . . . . 120 Thr C . 19599 1 1416 . 1 1 120 120 THR CA C 13 62.510 0.005 . 1 . . . . 120 Thr CA . 19599 1 1417 . 1 1 120 120 THR CB C 13 71.173 0.060 . 1 . . . . 120 Thr CB . 19599 1 1418 . 1 1 120 120 THR CG2 C 13 19.672 0.089 . 1 . . . . 120 Thr CG2 . 19599 1 1419 . 1 1 120 120 THR N N 15 106.039 0.019 . 1 . . . . 120 Thr N . 19599 1 1420 . 1 1 121 121 GLY H H 1 8.174 0.012 . 1 . . . . 121 Gly H . 19599 1 1421 . 1 1 121 121 GLY HA2 H 1 4.222 0.003 . 2 . . . . 121 Gly HA2 . 19599 1 1422 . 1 1 121 121 GLY HA3 H 1 3.791 0.002 . 2 . . . . 121 Gly HA3 . 19599 1 1423 . 1 1 121 121 GLY C C 13 172.991 0.000 . 1 . . . . 121 Gly C . 19599 1 1424 . 1 1 121 121 GLY CA C 13 45.622 0.035 . 1 . . . . 121 Gly CA . 19599 1 1425 . 1 1 121 121 GLY N N 15 111.893 0.053 . 1 . . . . 121 Gly N . 19599 1 1426 . 1 1 122 122 LYS H H 1 8.274 0.005 . 1 . . . . 122 Lys H . 19599 1 1427 . 1 1 122 122 LYS HA H 1 4.603 0.001 . 1 . . . . 122 Lys HA . 19599 1 1428 . 1 1 122 122 LYS HB2 H 1 1.744 0.004 . 2 . . . . 122 Lys HB2 . 19599 1 1429 . 1 1 122 122 LYS HB3 H 1 1.868 0.004 . 2 . . . . 122 Lys HB3 . 19599 1 1430 . 1 1 122 122 LYS HG3 H 1 1.348 0.020 . 1 . . . . 122 Lys HG3 . 19599 1 1431 . 1 1 122 122 LYS HD3 H 1 1.653 0.003 . 1 . . . . 122 Lys HD3 . 19599 1 1432 . 1 1 122 122 LYS HE3 H 1 2.979 0.022 . 1 . . . . 122 Lys HE3 . 19599 1 1433 . 1 1 122 122 LYS C C 13 173.547 0.000 . 1 . . . . 122 Lys C . 19599 1 1434 . 1 1 122 122 LYS CA C 13 54.563 0.081 . 1 . . . . 122 Lys CA . 19599 1 1435 . 1 1 122 122 LYS CB C 13 35.435 0.121 . 1 . . . . 122 Lys CB . 19599 1 1436 . 1 1 122 122 LYS CG C 13 24.412 0.046 . 1 . . . . 122 Lys CG . 19599 1 1437 . 1 1 122 122 LYS CD C 13 28.926 0.020 . 1 . . . . 122 Lys CD . 19599 1 1438 . 1 1 122 122 LYS CE C 13 42.113 0.145 . 1 . . . . 122 Lys CE . 19599 1 1439 . 1 1 122 122 LYS N N 15 121.160 0.090 . 1 . . . . 122 Lys N . 19599 1 1440 . 1 1 123 123 GLU H H 1 8.041 0.007 . 1 . . . . 123 Glu H . 19599 1 1441 . 1 1 123 123 GLU HA H 1 4.392 0.004 . 1 . . . . 123 Glu HA . 19599 1 1442 . 1 1 123 123 GLU HB2 H 1 1.955 0.008 . 2 . . . . 123 Glu HB2 . 19599 1 1443 . 1 1 123 123 GLU HB3 H 1 1.870 0.003 . 2 . . . . 123 Glu HB3 . 19599 1 1444 . 1 1 123 123 GLU HG2 H 1 2.314 0.009 . 2 . . . . 123 Glu HG2 . 19599 1 1445 . 1 1 123 123 GLU HG3 H 1 2.357 0.012 . 2 . . . . 123 Glu HG3 . 19599 1 1446 . 1 1 123 123 GLU C C 13 177.177 0.000 . 1 . . . . 123 Glu C . 19599 1 1447 . 1 1 123 123 GLU CA C 13 55.648 0.114 . 1 . . . . 123 Glu CA . 19599 1 1448 . 1 1 123 123 GLU CB C 13 30.482 0.127 . 1 . . . . 123 Glu CB . 19599 1 1449 . 1 1 123 123 GLU CG C 13 36.006 0.095 . 1 . . . . 123 Glu CG . 19599 1 1450 . 1 1 123 123 GLU N N 15 117.078 0.014 . 1 . . . . 123 Glu N . 19599 1 1451 . 1 1 124 124 TYR H H 1 9.117 0.004 . 1 . . . . 124 Tyr H . 19599 1 1452 . 1 1 124 124 TYR HA H 1 3.901 0.002 . 1 . . . . 124 Tyr HA . 19599 1 1453 . 1 1 124 124 TYR HB2 H 1 2.340 0.004 . 2 . . . . 124 Tyr HB2 . 19599 1 1454 . 1 1 124 124 TYR HB3 H 1 2.625 0.009 . 2 . . . . 124 Tyr HB3 . 19599 1 1455 . 1 1 124 124 TYR HD1 H 1 6.218 0.016 . 3 . . . . 124 Tyr HD1 . 19599 1 1456 . 1 1 124 124 TYR HD2 H 1 6.218 0.016 . 3 . . . . 124 Tyr HD2 . 19599 1 1457 . 1 1 124 124 TYR HE1 H 1 6.035 0.008 . 3 . . . . 124 Tyr HE1 . 19599 1 1458 . 1 1 124 124 TYR HE2 H 1 6.035 0.008 . 3 . . . . 124 Tyr HE2 . 19599 1 1459 . 1 1 124 124 TYR C C 13 173.685 0.000 . 1 . . . . 124 Tyr C . 19599 1 1460 . 1 1 124 124 TYR CA C 13 59.822 0.021 . 1 . . . . 124 Tyr CA . 19599 1 1461 . 1 1 124 124 TYR CB C 13 38.157 0.027 . 1 . . . . 124 Tyr CB . 19599 1 1462 . 1 1 124 124 TYR N N 15 124.991 0.016 . 1 . . . . 124 Tyr N . 19599 1 1463 . 1 1 125 125 ILE H H 1 7.838 0.003 . 1 . . . . 125 Ile H . 19599 1 1464 . 1 1 125 125 ILE HA H 1 4.237 0.004 . 1 . . . . 125 Ile HA . 19599 1 1465 . 1 1 125 125 ILE HB H 1 1.622 0.003 . 1 . . . . 125 Ile HB . 19599 1 1466 . 1 1 125 125 ILE HG12 H 1 1.448 0.005 . 2 . . . . 125 Ile HG12 . 19599 1 1467 . 1 1 125 125 ILE HG13 H 1 1.013 0.004 . 2 . . . . 125 Ile HG13 . 19599 1 1468 . 1 1 125 125 ILE HG21 H 1 0.744 0.006 . 1 . . . . 125 Ile HG21 . 19599 1 1469 . 1 1 125 125 ILE HG22 H 1 0.744 0.006 . 1 . . . . 125 Ile HG22 . 19599 1 1470 . 1 1 125 125 ILE HG23 H 1 0.744 0.006 . 1 . . . . 125 Ile HG23 . 19599 1 1471 . 1 1 125 125 ILE HD11 H 1 0.767 0.005 . 1 . . . . 125 Ile HD11 . 19599 1 1472 . 1 1 125 125 ILE HD12 H 1 0.767 0.005 . 1 . . . . 125 Ile HD12 . 19599 1 1473 . 1 1 125 125 ILE HD13 H 1 0.767 0.005 . 1 . . . . 125 Ile HD13 . 19599 1 1474 . 1 1 125 125 ILE CA C 13 56.991 0.181 . 1 . . . . 125 Ile CA . 19599 1 1475 . 1 1 125 125 ILE CB C 13 40.545 0.131 . 1 . . . . 125 Ile CB . 19599 1 1476 . 1 1 125 125 ILE CG1 C 13 26.565 0.118 . 1 . . . . 125 Ile CG1 . 19599 1 1477 . 1 1 125 125 ILE CG2 C 13 16.501 0.130 . 1 . . . . 125 Ile CG2 . 19599 1 1478 . 1 1 125 125 ILE CD1 C 13 12.409 0.154 . 1 . . . . 125 Ile CD1 . 19599 1 1479 . 1 1 125 125 ILE N N 15 131.495 0.034 . 1 . . . . 125 Ile N . 19599 1 1480 . 1 1 126 126 PRO HA H 1 3.969 0.005 . 1 . . . . 126 Pro HA . 19599 1 1481 . 1 1 126 126 PRO HB2 H 1 2.259 0.004 . 2 . . . . 126 Pro HB2 . 19599 1 1482 . 1 1 126 126 PRO HB3 H 1 1.897 0.001 . 2 . . . . 126 Pro HB3 . 19599 1 1483 . 1 1 126 126 PRO HG2 H 1 2.022 0.012 . 1 . . . . 126 Pro HG2 . 19599 1 1484 . 1 1 126 126 PRO HD2 H 1 3.467 0.009 . 2 . . . . 126 Pro HD2 . 19599 1 1485 . 1 1 126 126 PRO HD3 H 1 3.621 0.009 . 2 . . . . 126 Pro HD3 . 19599 1 1486 . 1 1 126 126 PRO C C 13 176.943 0.000 . 1 . . . . 126 Pro C . 19599 1 1487 . 1 1 126 126 PRO CA C 13 63.070 0.027 . 1 . . . . 126 Pro CA . 19599 1 1488 . 1 1 126 126 PRO CB C 13 31.847 0.025 . 1 . . . . 126 Pro CB . 19599 1 1489 . 1 1 126 126 PRO CG C 13 27.185 0.082 . 1 . . . . 126 Pro CG . 19599 1 1490 . 1 1 126 126 PRO CD C 13 51.034 0.106 . 1 . . . . 126 Pro CD . 19599 1 1491 . 1 1 127 127 GLY H H 1 8.446 0.003 . 1 . . . . 127 Gly H . 19599 1 1492 . 1 1 127 127 GLY HA2 H 1 3.718 0.003 . 2 . . . . 127 Gly HA2 . 19599 1 1493 . 1 1 127 127 GLY HA3 H 1 4.078 0.014 . 2 . . . . 127 Gly HA3 . 19599 1 1494 . 1 1 127 127 GLY C C 13 173.395 0.000 . 1 . . . . 127 Gly C . 19599 1 1495 . 1 1 127 127 GLY CA C 13 45.539 0.029 . 1 . . . . 127 Gly CA . 19599 1 1496 . 1 1 127 127 GLY N N 15 110.761 0.012 . 1 . . . . 127 Gly N . 19599 1 1497 . 1 1 128 128 GLN H H 1 7.779 0.005 . 1 . . . . 128 Gln H . 19599 1 1498 . 1 1 128 128 GLN HB2 H 1 1.959 0.011 . 2 . . . . 128 Gln HB2 . 19599 1 1499 . 1 1 128 128 GLN HB3 H 1 1.703 0.010 . 2 . . . . 128 Gln HB3 . 19599 1 1500 . 1 1 128 128 GLN HG3 H 1 2.143 0.003 . 1 . . . . 128 Gln HG3 . 19599 1 1501 . 1 1 128 128 GLN HE21 H 1 6.744 0.005 . 1 . . . . 128 Gln HE21 . 19599 1 1502 . 1 1 128 128 GLN HE22 H 1 7.451 0.003 . 1 . . . . 128 Gln HE22 . 19599 1 1503 . 1 1 128 128 GLN CA C 13 52.714 0.000 . 1 . . . . 128 Gln CA . 19599 1 1504 . 1 1 128 128 GLN CB C 13 29.045 0.077 . 1 . . . . 128 Gln CB . 19599 1 1505 . 1 1 128 128 GLN CG C 13 33.537 0.042 . 1 . . . . 128 Gln CG . 19599 1 1506 . 1 1 128 128 GLN N N 15 119.798 0.030 . 1 . . . . 128 Gln N . 19599 1 1507 . 1 1 128 128 GLN NE2 N 15 111.717 0.214 . 1 . . . . 128 Gln NE2 . 19599 1 stop_ save_