data_27259 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 27259 _Entry.Title ; 1H, 15N, 13C resonance assignments for Human prion protein (91-231): mutant V127M129 (scilicet HuPrPG127V) ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2017-09-20 _Entry.Accession_date 2017-09-20 _Entry.Last_release_date 2017-09-20 _Entry.Original_release_date 2017-09-20 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.0.16 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 Zhen Zheng . . . . 27259 2 Donghai Lin . . . . 27259 3 Liubin Feng . . . . 27259 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 27259 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 532 27259 '15N chemical shifts' 147 27259 '1H chemical shifts' 900 27259 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 2 . . 2018-10-02 2017-09-20 update BMRB 'update entry citation' 27259 1 . . 2017-10-20 2017-09-20 original author 'original release' 27259 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 27264 '1H, 15N, 13C resonance assignments for Human prion protein (91-231): wild type (scilicet HuPrPM129)' 27259 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 27259 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 30181558 _Citation.Full_citation . _Citation.Title ; Structural basis for the complete resistance of the human prion protein mutant G127V to prion disease ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Sci. Rep.' _Citation.Journal_name_full 'Scientific reports' _Citation.Journal_volume 8 _Citation.Journal_issue 1 _Citation.Journal_ASTM . _Citation.Journal_ISSN 2045-2322 _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 13211 _Citation.Page_last 13211 _Citation.Year 2018 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Zhen Zheng Z. . . . 27259 1 2 Meilan Zhang M. . . . 27259 1 3 Yongheng Wang Y. . . . 27259 1 4 Rongsheng Ma R. . . . 27259 1 5 Chenyun Guo C. . . . 27259 1 6 Liubin Feng L. . . . 27259 1 7 Jihui Wu J. . . . 27259 1 8 Hongwei Yao H. . . . 27259 1 9 Donghai Lin D. . . . 27259 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly_1 _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly_1 _Assembly.Entry_ID 27259 _Assembly.ID 1 _Assembly.Name HuPrPG127V _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 HuPrPG127V 1 $HuPrPG127V A . yes native no no . . . 27259 1 stop_ loop_ _Bond.ID _Bond.Type _Bond.Value_order _Bond.Assembly_atom_ID_1 _Bond.Entity_assembly_ID_1 _Bond.Entity_assembly_name_1 _Bond.Entity_ID_1 _Bond.Comp_ID_1 _Bond.Comp_index_ID_1 _Bond.Seq_ID_1 _Bond.Atom_ID_1 _Bond.Assembly_atom_ID_2 _Bond.Entity_assembly_ID_2 _Bond.Entity_assembly_name_2 _Bond.Entity_ID_2 _Bond.Comp_ID_2 _Bond.Comp_index_ID_2 _Bond.Seq_ID_2 _Bond.Atom_ID_2 _Bond.Auth_entity_assembly_ID_1 _Bond.Auth_entity_assembly_name_1 _Bond.Auth_asym_ID_1 _Bond.Auth_seq_ID_1 _Bond.Auth_comp_ID_1 _Bond.Auth_atom_ID_1 _Bond.Auth_entity_assembly_ID_2 _Bond.Auth_entity_assembly_name_2 _Bond.Auth_asym_ID_2 _Bond.Auth_seq_ID_2 _Bond.Auth_comp_ID_2 _Bond.Auth_atom_ID_2 _Bond.Entry_ID _Bond.Assembly_ID 1 disulfide single . 1 . 1 CYS 90 90 SG . 1 . 1 CYS 125 125 SG . . . . . . . . . . . . 27259 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_HuPrPG127V _Entity.Sf_category entity _Entity.Sf_framecode HuPrPG127V _Entity.Entry_ID 27259 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name HuPrPG127V _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MQGGGTHSQWNKPSKPKTNM KHMAGAAAAGAVVGGLGVYM LGSAMSRPIIHFGSDYEDRY YRENMHRYPNQVYYRPMDEY SNQNNFVHDCVNITIKQHTV TTTTKGENFTETDVKMMERV VEQMCITQYERESQAYYQRG SS ; _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 142 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all disulfide bound' _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 MET . 27259 1 2 2 GLN . 27259 1 3 3 GLY . 27259 1 4 4 GLY . 27259 1 5 5 GLY . 27259 1 6 6 THR . 27259 1 7 7 HIS . 27259 1 8 8 SER . 27259 1 9 9 GLN . 27259 1 10 10 TRP . 27259 1 11 11 ASN . 27259 1 12 12 LYS . 27259 1 13 13 PRO . 27259 1 14 14 SER . 27259 1 15 15 LYS . 27259 1 16 16 PRO . 27259 1 17 17 LYS . 27259 1 18 18 THR . 27259 1 19 19 ASN . 27259 1 20 20 MET . 27259 1 21 21 LYS . 27259 1 22 22 HIS . 27259 1 23 23 MET . 27259 1 24 24 ALA . 27259 1 25 25 GLY . 27259 1 26 26 ALA . 27259 1 27 27 ALA . 27259 1 28 28 ALA . 27259 1 29 29 ALA . 27259 1 30 30 GLY . 27259 1 31 31 ALA . 27259 1 32 32 VAL . 27259 1 33 33 VAL . 27259 1 34 34 GLY . 27259 1 35 35 GLY . 27259 1 36 36 LEU . 27259 1 37 37 GLY . 27259 1 38 38 VAL . 27259 1 39 39 TYR . 27259 1 40 40 MET . 27259 1 41 41 LEU . 27259 1 42 42 GLY . 27259 1 43 43 SER . 27259 1 44 44 ALA . 27259 1 45 45 MET . 27259 1 46 46 SER . 27259 1 47 47 ARG . 27259 1 48 48 PRO . 27259 1 49 49 ILE . 27259 1 50 50 ILE . 27259 1 51 51 HIS . 27259 1 52 52 PHE . 27259 1 53 53 GLY . 27259 1 54 54 SER . 27259 1 55 55 ASP . 27259 1 56 56 TYR . 27259 1 57 57 GLU . 27259 1 58 58 ASP . 27259 1 59 59 ARG . 27259 1 60 60 TYR . 27259 1 61 61 TYR . 27259 1 62 62 ARG . 27259 1 63 63 GLU . 27259 1 64 64 ASN . 27259 1 65 65 MET . 27259 1 66 66 HIS . 27259 1 67 67 ARG . 27259 1 68 68 TYR . 27259 1 69 69 PRO . 27259 1 70 70 ASN . 27259 1 71 71 GLN . 27259 1 72 72 VAL . 27259 1 73 73 TYR . 27259 1 74 74 TYR . 27259 1 75 75 ARG . 27259 1 76 76 PRO . 27259 1 77 77 MET . 27259 1 78 78 ASP . 27259 1 79 79 GLU . 27259 1 80 80 TYR . 27259 1 81 81 SER . 27259 1 82 82 ASN . 27259 1 83 83 GLN . 27259 1 84 84 ASN . 27259 1 85 85 ASN . 27259 1 86 86 PHE . 27259 1 87 87 VAL . 27259 1 88 88 HIS . 27259 1 89 89 ASP . 27259 1 90 90 CYS . 27259 1 91 91 VAL . 27259 1 92 92 ASN . 27259 1 93 93 ILE . 27259 1 94 94 THR . 27259 1 95 95 ILE . 27259 1 96 96 LYS . 27259 1 97 97 GLN . 27259 1 98 98 HIS . 27259 1 99 99 THR . 27259 1 100 100 VAL . 27259 1 101 101 THR . 27259 1 102 102 THR . 27259 1 103 103 THR . 27259 1 104 104 THR . 27259 1 105 105 LYS . 27259 1 106 106 GLY . 27259 1 107 107 GLU . 27259 1 108 108 ASN . 27259 1 109 109 PHE . 27259 1 110 110 THR . 27259 1 111 111 GLU . 27259 1 112 112 THR . 27259 1 113 113 ASP . 27259 1 114 114 VAL . 27259 1 115 115 LYS . 27259 1 116 116 MET . 27259 1 117 117 MET . 27259 1 118 118 GLU . 27259 1 119 119 ARG . 27259 1 120 120 VAL . 27259 1 121 121 VAL . 27259 1 122 122 GLU . 27259 1 123 123 GLN . 27259 1 124 124 MET . 27259 1 125 125 CYS . 27259 1 126 126 ILE . 27259 1 127 127 THR . 27259 1 128 128 GLN . 27259 1 129 129 TYR . 27259 1 130 130 GLU . 27259 1 131 131 ARG . 27259 1 132 132 GLU . 27259 1 133 133 SER . 27259 1 134 134 GLN . 27259 1 135 135 ALA . 27259 1 136 136 TYR . 27259 1 137 137 TYR . 27259 1 138 138 GLN . 27259 1 139 139 ARG . 27259 1 140 140 GLY . 27259 1 141 141 SER . 27259 1 142 142 SER . 27259 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 27259 1 . GLN 2 2 27259 1 . GLY 3 3 27259 1 . GLY 4 4 27259 1 . GLY 5 5 27259 1 . THR 6 6 27259 1 . HIS 7 7 27259 1 . SER 8 8 27259 1 . GLN 9 9 27259 1 . TRP 10 10 27259 1 . ASN 11 11 27259 1 . LYS 12 12 27259 1 . PRO 13 13 27259 1 . SER 14 14 27259 1 . LYS 15 15 27259 1 . PRO 16 16 27259 1 . LYS 17 17 27259 1 . THR 18 18 27259 1 . ASN 19 19 27259 1 . MET 20 20 27259 1 . LYS 21 21 27259 1 . HIS 22 22 27259 1 . MET 23 23 27259 1 . ALA 24 24 27259 1 . GLY 25 25 27259 1 . ALA 26 26 27259 1 . ALA 27 27 27259 1 . ALA 28 28 27259 1 . ALA 29 29 27259 1 . GLY 30 30 27259 1 . ALA 31 31 27259 1 . VAL 32 32 27259 1 . VAL 33 33 27259 1 . GLY 34 34 27259 1 . GLY 35 35 27259 1 . LEU 36 36 27259 1 . GLY 37 37 27259 1 . VAL 38 38 27259 1 . TYR 39 39 27259 1 . MET 40 40 27259 1 . LEU 41 41 27259 1 . GLY 42 42 27259 1 . SER 43 43 27259 1 . ALA 44 44 27259 1 . MET 45 45 27259 1 . SER 46 46 27259 1 . ARG 47 47 27259 1 . PRO 48 48 27259 1 . ILE 49 49 27259 1 . ILE 50 50 27259 1 . HIS 51 51 27259 1 . PHE 52 52 27259 1 . GLY 53 53 27259 1 . SER 54 54 27259 1 . ASP 55 55 27259 1 . TYR 56 56 27259 1 . GLU 57 57 27259 1 . ASP 58 58 27259 1 . ARG 59 59 27259 1 . TYR 60 60 27259 1 . TYR 61 61 27259 1 . ARG 62 62 27259 1 . GLU 63 63 27259 1 . ASN 64 64 27259 1 . MET 65 65 27259 1 . HIS 66 66 27259 1 . ARG 67 67 27259 1 . TYR 68 68 27259 1 . PRO 69 69 27259 1 . ASN 70 70 27259 1 . GLN 71 71 27259 1 . VAL 72 72 27259 1 . TYR 73 73 27259 1 . TYR 74 74 27259 1 . ARG 75 75 27259 1 . PRO 76 76 27259 1 . MET 77 77 27259 1 . ASP 78 78 27259 1 . GLU 79 79 27259 1 . TYR 80 80 27259 1 . SER 81 81 27259 1 . ASN 82 82 27259 1 . GLN 83 83 27259 1 . ASN 84 84 27259 1 . ASN 85 85 27259 1 . PHE 86 86 27259 1 . VAL 87 87 27259 1 . HIS 88 88 27259 1 . ASP 89 89 27259 1 . CYS 90 90 27259 1 . VAL 91 91 27259 1 . ASN 92 92 27259 1 . ILE 93 93 27259 1 . THR 94 94 27259 1 . ILE 95 95 27259 1 . LYS 96 96 27259 1 . GLN 97 97 27259 1 . HIS 98 98 27259 1 . THR 99 99 27259 1 . VAL 100 100 27259 1 . THR 101 101 27259 1 . THR 102 102 27259 1 . THR 103 103 27259 1 . THR 104 104 27259 1 . LYS 105 105 27259 1 . GLY 106 106 27259 1 . GLU 107 107 27259 1 . ASN 108 108 27259 1 . PHE 109 109 27259 1 . THR 110 110 27259 1 . GLU 111 111 27259 1 . THR 112 112 27259 1 . ASP 113 113 27259 1 . VAL 114 114 27259 1 . LYS 115 115 27259 1 . MET 116 116 27259 1 . MET 117 117 27259 1 . GLU 118 118 27259 1 . ARG 119 119 27259 1 . VAL 120 120 27259 1 . VAL 121 121 27259 1 . GLU 122 122 27259 1 . GLN 123 123 27259 1 . MET 124 124 27259 1 . CYS 125 125 27259 1 . ILE 126 126 27259 1 . THR 127 127 27259 1 . GLN 128 128 27259 1 . TYR 129 129 27259 1 . GLU 130 130 27259 1 . ARG 131 131 27259 1 . GLU 132 132 27259 1 . SER 133 133 27259 1 . GLN 134 134 27259 1 . ALA 135 135 27259 1 . TYR 136 136 27259 1 . TYR 137 137 27259 1 . GLN 138 138 27259 1 . ARG 139 139 27259 1 . GLY 140 140 27259 1 . SER 141 141 27259 1 . SER 142 142 27259 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 27259 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $HuPrPG127V . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . 27259 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 27259 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $HuPrPG127V . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . pET30a . . . 27259 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 27259 _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 HuPrPG127V '[U-100% 13C; U-100% 15N]' . . 1 $HuPrPG127V . . 0.5 . . mM . . . . 27259 1 2 NaOAc 'natural abundance' . . . . . . 20 . . mM . . . . 27259 1 3 NaN3 'natural abundance' . . . . . . 0.2 . . % . . . . 27259 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 27259 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0.02 . M 27259 1 pH 4.5 . pH 27259 1 pressure 1 . atm 27259 1 temperature 298 . K 27259 1 stop_ save_ ############################ # Computer software used # ############################ save_CARA _Software.Sf_category software _Software.Sf_framecode CARA _Software.Entry_ID 27259 _Software.ID 1 _Software.Type . _Software.Name CARA _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Keller and Wuthrich' . . 27259 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 27259 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 27259 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 850 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 27259 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker Avance . 850 . . . 27259 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 27259 _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 . . . . . . . . . . . . . . . . 27259 1 2 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27259 1 3 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27259 1 4 '3D HN(CO)CA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27259 1 5 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27259 1 6 '3D H(CCO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27259 1 7 '3D HBHA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27259 1 8 '3D C(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27259 1 9 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27259 1 10 '3D 1H-13C NOESY aliphatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27259 1 11 '3D HCCH-TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27259 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chem_shift_reference_1 _Chem_shift_reference.Entry_ID 27259 _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.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . 27259 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . 27259 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . 27259 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_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 27259 _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 $chem_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' . . . 27259 1 2 '3D CBCA(CO)NH' . . . 27259 1 3 '3D HNCACB' . . . 27259 1 4 '3D HN(CO)CA' . . . 27259 1 5 '3D HNCA' . . . 27259 1 6 '3D H(CCO)NH' . . . 27259 1 7 '3D HBHA(CO)NH' . . . 27259 1 8 '3D C(CO)NH' . . . 27259 1 9 '3D 1H-15N NOESY' . . . 27259 1 10 '3D 1H-13C NOESY aliphatic' . . . 27259 1 11 '3D HCCH-TOCSY' . . . 27259 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.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 MET HA H 1 4.159 0.020 . 1 . . . . . 1 MET HA . 27259 1 2 . 1 1 1 1 MET HB2 H 1 2.187 0.020 . 2 . . . . . 1 MET HB2 . 27259 1 3 . 1 1 1 1 MET HB3 H 1 2.187 0.020 . 2 . . . . . 1 MET HB3 . 27259 1 4 . 1 1 1 1 MET HG2 H 1 2.604 0.020 . 1 . . . . . 1 MET HG2 . 27259 1 5 . 1 1 1 1 MET HG3 H 1 2.604 0.020 . 1 . . . . . 1 MET HG3 . 27259 1 6 . 1 1 1 1 MET C C 13 172.115 0.3 . 1 . . . . . 1 MET C . 27259 1 7 . 1 1 1 1 MET CA C 13 54.931 0.3 . 1 . . . . . 1 MET CA . 27259 1 8 . 1 1 1 1 MET CB C 13 32.517 0.3 . 1 . . . . . 1 MET CB . 27259 1 9 . 1 1 1 1 MET CG C 13 30.518 0.3 . 1 . . . . . 1 MET CG . 27259 1 10 . 1 1 2 2 GLN H H 1 8.857 0.020 . 1 . . . . . 2 GLN H . 27259 1 11 . 1 1 2 2 GLN HA H 1 4.438 0.020 . 1 . . . . . 2 GLN HA . 27259 1 12 . 1 1 2 2 GLN HB2 H 1 2.130 0.020 . 2 . . . . . 2 GLN HB2 . 27259 1 13 . 1 1 2 2 GLN HB3 H 1 2.042 0.020 . 2 . . . . . 2 GLN HB3 . 27259 1 14 . 1 1 2 2 GLN HG2 H 1 2.410 0.020 . 1 . . . . . 2 GLN HG2 . 27259 1 15 . 1 1 2 2 GLN HG3 H 1 2.410 0.020 . 1 . . . . . 2 GLN HG3 . 27259 1 16 . 1 1 2 2 GLN C C 13 175.904 0.3 . 1 . . . . . 2 GLN C . 27259 1 17 . 1 1 2 2 GLN CA C 13 55.687 0.3 . 1 . . . . . 2 GLN CA . 27259 1 18 . 1 1 2 2 GLN CB C 13 29.480 0.3 . 1 . . . . . 2 GLN CB . 27259 1 19 . 1 1 2 2 GLN CG C 13 33.486 0.3 . 1 . . . . . 2 GLN CG . 27259 1 20 . 1 1 2 2 GLN N N 15 123.813 0.3 . 1 . . . . . 2 GLN N . 27259 1 21 . 1 1 3 3 GLY H H 1 8.635 0.020 . 1 . . . . . 3 GLY H . 27259 1 22 . 1 1 3 3 GLY HA2 H 1 3.948 0.020 . 1 . . . . . 3 GLY HA2 . 27259 1 23 . 1 1 3 3 GLY HA3 H 1 3.948 0.020 . 1 . . . . . 3 GLY HA3 . 27259 1 24 . 1 1 3 3 GLY C C 13 174.535 0.3 . 1 . . . . . 3 GLY C . 27259 1 25 . 1 1 3 3 GLY CA C 13 45.180 0.3 . 1 . . . . . 3 GLY CA . 27259 1 26 . 1 1 3 3 GLY N N 15 111.483 0.3 . 1 . . . . . 3 GLY N . 27259 1 27 . 1 1 4 4 GLY H H 1 8.369 0.020 . 1 . . . . . 4 GLY H . 27259 1 28 . 1 1 4 4 GLY HA2 H 1 3.945 0.020 . 1 . . . . . 4 GLY HA2 . 27259 1 29 . 1 1 4 4 GLY HA3 H 1 3.945 0.020 . 1 . . . . . 4 GLY HA3 . 27259 1 30 . 1 1 4 4 GLY C C 13 174.694 0.3 . 1 . . . . . 4 GLY C . 27259 1 31 . 1 1 4 4 GLY CA C 13 45.197 0.3 . 1 . . . . . 4 GLY CA . 27259 1 32 . 1 1 4 4 GLY N N 15 108.680 0.3 . 1 . . . . . 4 GLY N . 27259 1 33 . 1 1 5 5 GLY HA2 H 1 3.870 0.020 . 1 . . . . . 5 GLY HA2 . 27259 1 34 . 1 1 5 5 GLY HA3 H 1 3.870 0.020 . 1 . . . . . 5 GLY HA3 . 27259 1 35 . 1 1 5 5 GLY C C 13 174.352 0.3 . 1 . . . . . 5 GLY C . 27259 1 36 . 1 1 5 5 GLY CA C 13 45.085 0.3 . 1 . . . . . 5 GLY CA . 27259 1 37 . 1 1 6 6 THR H H 1 8.127 0.020 . 1 . . . . . 6 THR H . 27259 1 38 . 1 1 6 6 THR HA H 1 4.303 0.020 . 1 . . . . . 6 THR HA . 27259 1 39 . 1 1 6 6 THR HB H 1 4.189 0.020 . 1 . . . . . 6 THR HB . 27259 1 40 . 1 1 6 6 THR HG21 H 1 1.167 0.020 . 1 . . . . . 6 THR HG2 . 27259 1 41 . 1 1 6 6 THR HG22 H 1 1.167 0.020 . 1 . . . . . 6 THR HG2 . 27259 1 42 . 1 1 6 6 THR HG23 H 1 1.167 0.020 . 1 . . . . . 6 THR HG2 . 27259 1 43 . 1 1 6 6 THR C C 13 174.535 0.3 . 1 . . . . . 6 THR C . 27259 1 44 . 1 1 6 6 THR CA C 13 61.941 0.3 . 1 . . . . . 6 THR CA . 27259 1 45 . 1 1 6 6 THR CB C 13 69.534 0.3 . 1 . . . . . 6 THR CB . 27259 1 46 . 1 1 6 6 THR CG2 C 13 20.981 0.3 . 1 . . . . . 6 THR CG2 . 27259 1 47 . 1 1 6 6 THR N N 15 113.404 0.3 . 1 . . . . . 6 THR N . 27259 1 48 . 1 1 7 7 HIS H H 1 8.580 0.020 . 1 . . . . . 7 HIS H . 27259 1 49 . 1 1 7 7 HIS HA H 1 4.692 0.020 . 1 . . . . . 7 HIS HA . 27259 1 50 . 1 1 7 7 HIS HB2 H 1 3.261 0.020 . 2 . . . . . 7 HIS HB2 . 27259 1 51 . 1 1 7 7 HIS HB3 H 1 3.145 0.020 . 2 . . . . . 7 HIS HB3 . 27259 1 52 . 1 1 7 7 HIS C C 13 174.352 0.3 . 1 . . . . . 7 HIS C . 27259 1 53 . 1 1 7 7 HIS CA C 13 55.193 0.3 . 1 . . . . . 7 HIS CA . 27259 1 54 . 1 1 7 7 HIS CB C 13 28.658 0.3 . 1 . . . . . 7 HIS CB . 27259 1 55 . 1 1 7 7 HIS N N 15 120.580 0.3 . 1 . . . . . 7 HIS N . 27259 1 56 . 1 1 8 8 SER H H 1 8.318 0.020 . 1 . . . . . 8 SER H . 27259 1 57 . 1 1 8 8 SER HA H 1 4.409 0.020 . 1 . . . . . 8 SER HA . 27259 1 58 . 1 1 8 8 SER HB2 H 1 3.835 0.020 . 2 . . . . . 8 SER HB2 . 27259 1 59 . 1 1 8 8 SER HB3 H 1 3.780 0.020 . 2 . . . . . 8 SER HB3 . 27259 1 60 . 1 1 8 8 SER C C 13 174.352 0.3 . 1 . . . . . 8 SER C . 27259 1 61 . 1 1 8 8 SER CA C 13 58.463 0.3 . 1 . . . . . 8 SER CA . 27259 1 62 . 1 1 8 8 SER CB C 13 63.621 0.3 . 1 . . . . . 8 SER CB . 27259 1 63 . 1 1 8 8 SER N N 15 117.059 0.3 . 1 . . . . . 8 SER N . 27259 1 64 . 1 1 9 9 GLN H H 1 8.476 0.020 . 1 . . . . . 9 GLN H . 27259 1 65 . 1 1 9 9 GLN HA H 1 4.246 0.020 . 1 . . . . . 9 GLN HA . 27259 1 66 . 1 1 9 9 GLN HB2 H 1 1.976 0.020 . 2 . . . . . 9 GLN HB2 . 27259 1 67 . 1 1 9 9 GLN HB3 H 1 1.880 0.020 . 2 . . . . . 9 GLN HB3 . 27259 1 68 . 1 1 9 9 GLN HG2 H 1 2.175 0.020 . 1 . . . . . 9 GLN HG2 . 27259 1 69 . 1 1 9 9 GLN HG3 H 1 2.175 0.020 . 1 . . . . . 9 GLN HG3 . 27259 1 70 . 1 1 9 9 GLN C C 13 175.562 0.3 . 1 . . . . . 9 GLN C . 27259 1 71 . 1 1 9 9 GLN CA C 13 55.944 0.3 . 1 . . . . . 9 GLN CA . 27259 1 72 . 1 1 9 9 GLN CB C 13 29.024 0.3 . 1 . . . . . 9 GLN CB . 27259 1 73 . 1 1 9 9 GLN CG C 13 33.247 0.3 . 1 . . . . . 9 GLN CG . 27259 1 74 . 1 1 9 9 GLN N N 15 122.117 0.3 . 1 . . . . . 9 GLN N . 27259 1 75 . 1 1 10 10 TRP H H 1 8.121 0.020 . 1 . . . . . 10 TRP H . 27259 1 76 . 1 1 10 10 TRP HA H 1 4.683 0.020 . 1 . . . . . 10 TRP HA . 27259 1 77 . 1 1 10 10 TRP HB2 H 1 3.305 0.020 . 2 . . . . . 10 TRP HB2 . 27259 1 78 . 1 1 10 10 TRP HB3 H 1 2.953 0.020 . 2 . . . . . 10 TRP HB3 . 27259 1 79 . 1 1 10 10 TRP HD1 H 1 7.225 0.020 . 1 . . . . . 10 TRP HD1 . 27259 1 80 . 1 1 10 10 TRP HE1 H 1 10.099 0.020 . 1 . . . . . 10 TRP HE1 . 27259 1 81 . 1 1 10 10 TRP C C 13 175.562 0.3 . 1 . . . . . 10 TRP C . 27259 1 82 . 1 1 10 10 TRP CA C 13 57.063 0.3 . 1 . . . . . 10 TRP CA . 27259 1 83 . 1 1 10 10 TRP CB C 13 29.168 0.3 . 1 . . . . . 10 TRP CB . 27259 1 84 . 1 1 10 10 TRP N N 15 121.847 0.3 . 1 . . . . . 10 TRP N . 27259 1 85 . 1 1 10 10 TRP NE1 N 15 129.214 0.3 . 1 . . . . . 10 TRP NE1 . 27259 1 86 . 1 1 11 11 ASN H H 1 8.112 0.020 . 1 . . . . . 11 ASN H . 27259 1 87 . 1 1 11 11 ASN HA H 1 4.620 0.020 . 1 . . . . . 11 ASN HA . 27259 1 88 . 1 1 11 11 ASN HB2 H 1 2.590 0.020 . 2 . . . . . 11 ASN HB2 . 27259 1 89 . 1 1 11 11 ASN HB3 H 1 2.546 0.020 . 2 . . . . . 11 ASN HB3 . 27259 1 90 . 1 1 11 11 ASN C C 13 174.010 0.3 . 1 . . . . . 11 ASN C . 27259 1 91 . 1 1 11 11 ASN CA C 13 52.690 0.3 . 1 . . . . . 11 ASN CA . 27259 1 92 . 1 1 11 11 ASN CB C 13 38.838 0.3 . 1 . . . . . 11 ASN CB . 27259 1 93 . 1 1 11 11 ASN N N 15 120.685 0.3 . 1 . . . . . 11 ASN N . 27259 1 94 . 1 1 12 12 LYS H H 1 8.000 0.020 . 1 . . . . . 12 LYS H . 27259 1 95 . 1 1 12 12 LYS HA H 1 4.450 0.020 . 1 . . . . . 12 LYS HA . 27259 1 96 . 1 1 12 12 LYS HB2 H 1 1.653 0.020 . 1 . . . . . 12 LYS HB2 . 27259 1 97 . 1 1 12 12 LYS HB3 H 1 1.653 0.020 . 1 . . . . . 12 LYS HB3 . 27259 1 98 . 1 1 12 12 LYS HG2 H 1 1.393 0.020 . 1 . . . . . 12 LYS HG2 . 27259 1 99 . 1 1 12 12 LYS HG3 H 1 1.393 0.020 . 1 . . . . . 12 LYS HG3 . 27259 1 100 . 1 1 12 12 LYS HD2 H 1 1.715 0.020 . 1 . . . . . 12 LYS HD2 . 27259 1 101 . 1 1 12 12 LYS HD3 H 1 1.715 0.020 . 1 . . . . . 12 LYS HD3 . 27259 1 102 . 1 1 12 12 LYS HE2 H 1 3.011 0.020 . 1 . . . . . 12 LYS HE2 . 27259 1 103 . 1 1 12 12 LYS HE3 H 1 3.011 0.020 . 1 . . . . . 12 LYS HE3 . 27259 1 104 . 1 1 12 12 LYS C C 13 178.484 0.3 . 1 . . . . . 12 LYS C . 27259 1 105 . 1 1 12 12 LYS CA C 13 54.136 0.3 . 1 . . . . . 12 LYS CA . 27259 1 106 . 1 1 12 12 LYS CB C 13 32.329 0.3 . 1 . . . . . 12 LYS CB . 27259 1 107 . 1 1 12 12 LYS CG C 13 24.427 0.3 . 1 . . . . . 12 LYS CG . 27259 1 108 . 1 1 12 12 LYS CD C 13 29.034 0.3 . 1 . . . . . 12 LYS CD . 27259 1 109 . 1 1 12 12 LYS CE C 13 41.920 0.3 . 1 . . . . . 12 LYS CE . 27259 1 110 . 1 1 12 12 LYS N N 15 122.687 0.3 . 1 . . . . . 12 LYS N . 27259 1 111 . 1 1 13 13 PRO HA H 1 4.437 0.020 . 1 . . . . . 13 PRO HA . 27259 1 112 . 1 1 13 13 PRO HB2 H 1 2.303 0.020 . 2 . . . . . 13 PRO HB2 . 27259 1 113 . 1 1 13 13 PRO HB3 H 1 1.897 0.020 . 2 . . . . . 13 PRO HB3 . 27259 1 114 . 1 1 13 13 PRO HG2 H 1 1.973 0.020 . 1 . . . . . 13 PRO HG2 . 27259 1 115 . 1 1 13 13 PRO HG3 H 1 1.973 0.020 . 1 . . . . . 13 PRO HG3 . 27259 1 116 . 1 1 13 13 PRO HD2 H 1 3.784 0.020 . 2 . . . . . 13 PRO HD2 . 27259 1 117 . 1 1 13 13 PRO HD3 H 1 3.659 0.020 . 2 . . . . . 13 PRO HD3 . 27259 1 118 . 1 1 13 13 PRO C C 13 176.749 0.3 . 1 . . . . . 13 PRO C . 27259 1 119 . 1 1 13 13 PRO CA C 13 63.063 0.3 . 1 . . . . . 13 PRO CA . 27259 1 120 . 1 1 13 13 PRO CB C 13 31.829 0.3 . 1 . . . . . 13 PRO CB . 27259 1 121 . 1 1 13 13 PRO CG C 13 26.822 0.3 . 1 . . . . . 13 PRO CG . 27259 1 122 . 1 1 13 13 PRO CD C 13 50.442 0.3 . 1 . . . . . 13 PRO CD . 27259 1 123 . 1 1 14 14 SER H H 1 8.430 0.020 . 1 . . . . . 14 SER H . 27259 1 124 . 1 1 14 14 SER HA H 1 4.380 0.020 . 1 . . . . . 14 SER HA . 27259 1 125 . 1 1 14 14 SER HB2 H 1 3.850 0.020 . 1 . . . . . 14 SER HB2 . 27259 1 126 . 1 1 14 14 SER HB3 H 1 3.850 0.020 . 1 . . . . . 14 SER HB3 . 27259 1 127 . 1 1 14 14 SER C C 13 174.010 0.3 . 1 . . . . . 14 SER C . 27259 1 128 . 1 1 14 14 SER CA C 13 58.063 0.3 . 1 . . . . . 14 SER CA . 27259 1 129 . 1 1 14 14 SER CB C 13 63.872 0.3 . 1 . . . . . 14 SER CB . 27259 1 130 . 1 1 14 14 SER N N 15 116.931 0.3 . 1 . . . . . 14 SER N . 27259 1 131 . 1 1 15 15 LYS H H 1 8.334 0.020 . 1 . . . . . 15 LYS H . 27259 1 132 . 1 1 15 15 LYS HA H 1 4.641 0.020 . 1 . . . . . 15 LYS HA . 27259 1 133 . 1 1 15 15 LYS HB2 H 1 1.772 0.020 . 2 . . . . . 15 LYS HB2 . 27259 1 134 . 1 1 15 15 LYS HB3 H 1 1.740 0.020 . 2 . . . . . 15 LYS HB3 . 27259 1 135 . 1 1 15 15 LYS HG2 H 1 1.416 0.020 . 1 . . . . . 15 LYS HG2 . 27259 1 136 . 1 1 15 15 LYS HG3 H 1 1.416 0.020 . 1 . . . . . 15 LYS HG3 . 27259 1 137 . 1 1 15 15 LYS HD2 H 1 1.674 0.020 . 1 . . . . . 15 LYS HD2 . 27259 1 138 . 1 1 15 15 LYS HD3 H 1 1.674 0.020 . 1 . . . . . 15 LYS HD3 . 27259 1 139 . 1 1 15 15 LYS HE2 H 1 2.982 0.020 . 1 . . . . . 15 LYS HE2 . 27259 1 140 . 1 1 15 15 LYS HE3 H 1 2.982 0.020 . 1 . . . . . 15 LYS HE3 . 27259 1 141 . 1 1 15 15 LYS C C 13 174.352 0.3 . 1 . . . . . 15 LYS C . 27259 1 142 . 1 1 15 15 LYS CA C 13 54.180 0.3 . 1 . . . . . 15 LYS CA . 27259 1 143 . 1 1 15 15 LYS CB C 13 32.568 0.3 . 1 . . . . . 15 LYS CB . 27259 1 144 . 1 1 15 15 LYS CG C 13 24.496 0.3 . 1 . . . . . 15 LYS CG . 27259 1 145 . 1 1 15 15 LYS CD C 13 29.034 0.3 . 1 . . . . . 15 LYS CD . 27259 1 146 . 1 1 15 15 LYS CE C 13 41.842 0.3 . 1 . . . . . 15 LYS CE . 27259 1 147 . 1 1 15 15 LYS N N 15 124.175 0.3 . 1 . . . . . 15 LYS N . 27259 1 148 . 1 1 16 16 PRO HA H 1 4.435 0.020 . 1 . . . . . 16 PRO HA . 27259 1 149 . 1 1 16 16 PRO HB2 H 1 2.311 0.020 . 2 . . . . . 16 PRO HB2 . 27259 1 150 . 1 1 16 16 PRO HB3 H 1 1.911 0.020 . 2 . . . . . 16 PRO HB3 . 27259 1 151 . 1 1 16 16 PRO HG2 H 1 2.032 0.020 . 2 . . . . . 16 PRO HG2 . 27259 1 152 . 1 1 16 16 PRO HG3 H 1 2.003 0.020 . 2 . . . . . 16 PRO HG3 . 27259 1 153 . 1 1 16 16 PRO HD2 H 1 3.838 0.020 . 2 . . . . . 16 PRO HD2 . 27259 1 154 . 1 1 16 16 PRO HD3 H 1 3.631 0.020 . 2 . . . . . 16 PRO HD3 . 27259 1 155 . 1 1 16 16 PRO C C 13 176.749 0.3 . 1 . . . . . 16 PRO C . 27259 1 156 . 1 1 16 16 PRO CA C 13 62.954 0.3 . 1 . . . . . 16 PRO CA . 27259 1 157 . 1 1 16 16 PRO CB C 13 31.924 0.3 . 1 . . . . . 16 PRO CB . 27259 1 158 . 1 1 16 16 PRO CG C 13 27.238 0.3 . 1 . . . . . 16 PRO CG . 27259 1 159 . 1 1 16 16 PRO CD C 13 50.697 0.3 . 1 . . . . . 16 PRO CD . 27259 1 160 . 1 1 17 17 LYS H H 1 8.524 0.020 . 1 . . . . . 17 LYS H . 27259 1 161 . 1 1 17 17 LYS HA H 1 4.358 0.020 . 1 . . . . . 17 LYS HA . 27259 1 162 . 1 1 17 17 LYS HB2 H 1 1.875 0.020 . 2 . . . . . 17 LYS HB2 . 27259 1 163 . 1 1 17 17 LYS HB3 H 1 1.739 0.020 . 2 . . . . . 17 LYS HB3 . 27259 1 164 . 1 1 17 17 LYS HG2 H 1 1.446 0.020 . 1 . . . . . 17 LYS HG2 . 27259 1 165 . 1 1 17 17 LYS HG3 H 1 1.446 0.020 . 1 . . . . . 17 LYS HG3 . 27259 1 166 . 1 1 17 17 LYS HD2 H 1 1.717 0.020 . 1 . . . . . 17 LYS HD2 . 27259 1 167 . 1 1 17 17 LYS HD3 H 1 1.717 0.020 . 1 . . . . . 17 LYS HD3 . 27259 1 168 . 1 1 17 17 LYS HE2 H 1 2.997 0.020 . 1 . . . . . 17 LYS HE2 . 27259 1 169 . 1 1 17 17 LYS HE3 H 1 2.997 0.020 . 1 . . . . . 17 LYS HE3 . 27259 1 170 . 1 1 17 17 LYS C C 13 176.749 0.3 . 1 . . . . . 17 LYS C . 27259 1 171 . 1 1 17 17 LYS CA C 13 56.500 0.3 . 1 . . . . . 17 LYS CA . 27259 1 172 . 1 1 17 17 LYS CB C 13 32.913 0.3 . 1 . . . . . 17 LYS CB . 27259 1 173 . 1 1 17 17 LYS CG C 13 24.661 0.3 . 1 . . . . . 17 LYS CG . 27259 1 174 . 1 1 17 17 LYS CD C 13 29.034 0.3 . 1 . . . . . 17 LYS CD . 27259 1 175 . 1 1 17 17 LYS CE C 13 41.926 0.3 . 1 . . . . . 17 LYS CE . 27259 1 176 . 1 1 17 17 LYS N N 15 122.111 0.3 . 1 . . . . . 17 LYS N . 27259 1 177 . 1 1 18 18 THR H H 1 8.144 0.020 . 1 . . . . . 18 THR H . 27259 1 178 . 1 1 18 18 THR HA H 1 4.345 0.020 . 1 . . . . . 18 THR HA . 27259 1 179 . 1 1 18 18 THR HB H 1 4.188 0.020 . 1 . . . . . 18 THR HB . 27259 1 180 . 1 1 18 18 THR HG21 H 1 1.188 0.020 . 1 . . . . . 18 THR HG2 . 27259 1 181 . 1 1 18 18 THR HG22 H 1 1.188 0.020 . 1 . . . . . 18 THR HG2 . 27259 1 182 . 1 1 18 18 THR HG23 H 1 1.188 0.020 . 1 . . . . . 18 THR HG2 . 27259 1 183 . 1 1 18 18 THR C C 13 173.827 0.3 . 1 . . . . . 18 THR C . 27259 1 184 . 1 1 18 18 THR CA C 13 61.563 0.3 . 1 . . . . . 18 THR CA . 27259 1 185 . 1 1 18 18 THR CB C 13 69.880 0.3 . 1 . . . . . 18 THR CB . 27259 1 186 . 1 1 18 18 THR CG2 C 13 20.981 0.3 . 1 . . . . . 18 THR CG2 . 27259 1 187 . 1 1 18 18 THR N N 15 115.265 0.3 . 1 . . . . . 18 THR N . 27259 1 188 . 1 1 19 19 ASN H H 1 8.539 0.020 . 1 . . . . . 19 ASN H . 27259 1 189 . 1 1 19 19 ASN HA H 1 4.737 0.020 . 1 . . . . . 19 ASN HA . 27259 1 190 . 1 1 19 19 ASN HB2 H 1 2.851 0.020 . 2 . . . . . 19 ASN HB2 . 27259 1 191 . 1 1 19 19 ASN HB3 H 1 2.764 0.020 . 2 . . . . . 19 ASN HB3 . 27259 1 192 . 1 1 19 19 ASN C C 13 175.037 0.3 . 1 . . . . . 19 ASN C . 27259 1 193 . 1 1 19 19 ASN CA C 13 53.107 0.3 . 1 . . . . . 19 ASN CA . 27259 1 194 . 1 1 19 19 ASN CB C 13 38.588 0.3 . 1 . . . . . 19 ASN CB . 27259 1 195 . 1 1 19 19 ASN N N 15 121.324 0.3 . 1 . . . . . 19 ASN N . 27259 1 196 . 1 1 20 20 MET H H 1 8.350 0.020 . 1 . . . . . 20 MET H . 27259 1 197 . 1 1 20 20 MET HA H 1 4.454 0.020 . 1 . . . . . 20 MET HA . 27259 1 198 . 1 1 20 20 MET HB2 H 1 2.078 0.020 . 2 . . . . . 20 MET HB2 . 27259 1 199 . 1 1 20 20 MET HB3 H 1 1.971 0.020 . 2 . . . . . 20 MET HB3 . 27259 1 200 . 1 1 20 20 MET HG2 H 1 2.578 0.020 . 2 . . . . . 20 MET HG2 . 27259 1 201 . 1 1 20 20 MET HG3 H 1 2.503 0.020 . 2 . . . . . 20 MET HG3 . 27259 1 202 . 1 1 20 20 MET C C 13 176.064 0.3 . 1 . . . . . 20 MET C . 27259 1 203 . 1 1 20 20 MET CA C 13 55.197 0.3 . 1 . . . . . 20 MET CA . 27259 1 204 . 1 1 20 20 MET CB C 13 32.718 0.3 . 1 . . . . . 20 MET CB . 27259 1 205 . 1 1 20 20 MET CG C 13 31.495 0.3 . 1 . . . . . 20 MET CG . 27259 1 206 . 1 1 20 20 MET N N 15 121.324 0.3 . 1 . . . . . 20 MET N . 27259 1 207 . 1 1 21 21 LYS H H 1 8.302 0.020 . 1 . . . . . 21 LYS H . 27259 1 208 . 1 1 21 21 LYS HA H 1 4.251 0.020 . 1 . . . . . 21 LYS HA . 27259 1 209 . 1 1 21 21 LYS HB2 H 1 1.773 0.020 . 1 . . . . . 21 LYS HB2 . 27259 1 210 . 1 1 21 21 LYS HB3 H 1 1.773 0.020 . 1 . . . . . 21 LYS HB3 . 27259 1 211 . 1 1 21 21 LYS HG2 H 1 1.429 0.020 . 2 . . . . . 21 LYS HG2 . 27259 1 212 . 1 1 21 21 LYS HG3 H 1 1.360 0.020 . 2 . . . . . 21 LYS HG3 . 27259 1 213 . 1 1 21 21 LYS HD2 H 1 1.678 0.020 . 1 . . . . . 21 LYS HD2 . 27259 1 214 . 1 1 21 21 LYS HD3 H 1 1.678 0.020 . 1 . . . . . 21 LYS HD3 . 27259 1 215 . 1 1 21 21 LYS HE2 H 1 3.024 0.020 . 1 . . . . . 21 LYS HE2 . 27259 1 216 . 1 1 21 21 LYS HE3 H 1 3.024 0.020 . 1 . . . . . 21 LYS HE3 . 27259 1 217 . 1 1 21 21 LYS C C 13 176.064 0.3 . 1 . . . . . 21 LYS C . 27259 1 218 . 1 1 21 21 LYS CA C 13 56.260 0.3 . 1 . . . . . 21 LYS CA . 27259 1 219 . 1 1 21 21 LYS CB C 13 32.828 0.3 . 1 . . . . . 21 LYS CB . 27259 1 220 . 1 1 21 21 LYS CG C 13 24.639 0.3 . 1 . . . . . 21 LYS CG . 27259 1 221 . 1 1 21 21 LYS CD C 13 28.745 0.3 . 1 . . . . . 21 LYS CD . 27259 1 222 . 1 1 21 21 LYS CE C 13 41.920 0.3 . 1 . . . . . 21 LYS CE . 27259 1 223 . 1 1 21 21 LYS N N 15 122.242 0.3 . 1 . . . . . 21 LYS N . 27259 1 224 . 1 1 22 22 HIS H H 1 8.513 0.020 . 1 . . . . . 22 HIS H . 27259 1 225 . 1 1 22 22 HIS HA H 1 4.687 0.020 . 1 . . . . . 22 HIS HA . 27259 1 226 . 1 1 22 22 HIS HB2 H 1 3.253 0.020 . 2 . . . . . 22 HIS HB2 . 27259 1 227 . 1 1 22 22 HIS HB3 H 1 3.161 0.020 . 2 . . . . . 22 HIS HB3 . 27259 1 228 . 1 1 22 22 HIS C C 13 174.192 0.3 . 1 . . . . . 22 HIS C . 27259 1 229 . 1 1 22 22 HIS CA C 13 55.193 0.3 . 1 . . . . . 22 HIS CA . 27259 1 230 . 1 1 22 22 HIS CB C 13 28.825 0.3 . 1 . . . . . 22 HIS CB . 27259 1 231 . 1 1 22 22 HIS N N 15 119.776 0.3 . 1 . . . . . 22 HIS N . 27259 1 232 . 1 1 23 23 MET H H 1 8.428 0.020 . 1 . . . . . 23 MET H . 27259 1 233 . 1 1 23 23 MET HA H 1 4.478 0.020 . 1 . . . . . 23 MET HA . 27259 1 234 . 1 1 23 23 MET HB2 H 1 2.094 0.020 . 2 . . . . . 23 MET HB2 . 27259 1 235 . 1 1 23 23 MET HB3 H 1 1.969 0.020 . 2 . . . . . 23 MET HB3 . 27259 1 236 . 1 1 23 23 MET HG2 H 1 2.594 0.020 . 2 . . . . . 23 MET HG2 . 27259 1 237 . 1 1 23 23 MET HG3 H 1 2.511 0.020 . 2 . . . . . 23 MET HG3 . 27259 1 238 . 1 1 23 23 MET C C 13 175.562 0.3 . 1 . . . . . 23 MET C . 27259 1 239 . 1 1 23 23 MET CA C 13 55.193 0.3 . 1 . . . . . 23 MET CA . 27259 1 240 . 1 1 23 23 MET CB C 13 32.913 0.3 . 1 . . . . . 23 MET CB . 27259 1 241 . 1 1 23 23 MET CG C 13 31.495 0.3 . 1 . . . . . 23 MET CG . 27259 1 242 . 1 1 23 23 MET N N 15 122.677 0.3 . 1 . . . . . 23 MET N . 27259 1 243 . 1 1 24 24 ALA H H 1 8.442 0.020 . 1 . . . . . 24 ALA H . 27259 1 244 . 1 1 24 24 ALA HA H 1 4.334 0.020 . 1 . . . . . 24 ALA HA . 27259 1 245 . 1 1 24 24 ALA HB1 H 1 1.414 0.020 . 1 . . . . . 24 ALA HB . 27259 1 246 . 1 1 24 24 ALA HB2 H 1 1.414 0.020 . 1 . . . . . 24 ALA HB . 27259 1 247 . 1 1 24 24 ALA HB3 H 1 1.414 0.020 . 1 . . . . . 24 ALA HB . 27259 1 248 . 1 1 24 24 ALA C C 13 177.959 0.3 . 1 . . . . . 24 ALA C . 27259 1 249 . 1 1 24 24 ALA CA C 13 52.595 0.3 . 1 . . . . . 24 ALA CA . 27259 1 250 . 1 1 24 24 ALA CB C 13 19.133 0.3 . 1 . . . . . 24 ALA CB . 27259 1 251 . 1 1 24 24 ALA N N 15 125.841 0.3 . 1 . . . . . 24 ALA N . 27259 1 252 . 1 1 25 25 GLY H H 1 8.395 0.020 . 1 . . . . . 25 GLY H . 27259 1 253 . 1 1 25 25 GLY HA2 H 1 3.942 0.020 . 1 . . . . . 25 GLY HA2 . 27259 1 254 . 1 1 25 25 GLY HA3 H 1 3.942 0.020 . 1 . . . . . 25 GLY HA3 . 27259 1 255 . 1 1 25 25 GLY C C 13 173.827 0.3 . 1 . . . . . 25 GLY C . 27259 1 256 . 1 1 25 25 GLY CA C 13 45.063 0.3 . 1 . . . . . 25 GLY CA . 27259 1 257 . 1 1 25 25 GLY N N 15 108.561 0.3 . 1 . . . . . 25 GLY N . 27259 1 258 . 1 1 26 26 ALA H H 1 8.144 0.020 . 1 . . . . . 26 ALA H . 27259 1 259 . 1 1 26 26 ALA HA H 1 4.320 0.020 . 1 . . . . . 26 ALA HA . 27259 1 260 . 1 1 26 26 ALA HB1 H 1 1.399 0.020 . 1 . . . . . 26 ALA HB . 27259 1 261 . 1 1 26 26 ALA HB2 H 1 1.399 0.020 . 1 . . . . . 26 ALA HB . 27259 1 262 . 1 1 26 26 ALA HB3 H 1 1.399 0.020 . 1 . . . . . 26 ALA HB . 27259 1 263 . 1 1 26 26 ALA C C 13 177.616 0.3 . 1 . . . . . 26 ALA C . 27259 1 264 . 1 1 26 26 ALA CA C 13 52.428 0.3 . 1 . . . . . 26 ALA CA . 27259 1 265 . 1 1 26 26 ALA CB C 13 19.145 0.3 . 1 . . . . . 26 ALA CB . 27259 1 266 . 1 1 26 26 ALA N N 15 123.832 0.3 . 1 . . . . . 26 ALA N . 27259 1 267 . 1 1 27 27 ALA H H 1 8.287 0.020 . 1 . . . . . 27 ALA H . 27259 1 268 . 1 1 27 27 ALA HA H 1 4.276 0.020 . 1 . . . . . 27 ALA HA . 27259 1 269 . 1 1 27 27 ALA HB1 H 1 1.385 0.020 . 1 . . . . . 27 ALA HB . 27259 1 270 . 1 1 27 27 ALA HB2 H 1 1.385 0.020 . 1 . . . . . 27 ALA HB . 27259 1 271 . 1 1 27 27 ALA HB3 H 1 1.385 0.020 . 1 . . . . . 27 ALA HB . 27259 1 272 . 1 1 27 27 ALA C C 13 177.457 0.3 . 1 . . . . . 27 ALA C . 27259 1 273 . 1 1 27 27 ALA CA C 13 52.463 0.3 . 1 . . . . . 27 ALA CA . 27259 1 274 . 1 1 27 27 ALA CB C 13 19.228 0.3 . 1 . . . . . 27 ALA CB . 27259 1 275 . 1 1 27 27 ALA N N 15 123.201 0.3 . 1 . . . . . 27 ALA N . 27259 1 276 . 1 1 28 28 ALA H H 1 8.186 0.020 . 1 . . . . . 28 ALA H . 27259 1 277 . 1 1 28 28 ALA HA H 1 4.276 0.020 . 1 . . . . . 28 ALA HA . 27259 1 278 . 1 1 28 28 ALA HB1 H 1 1.370 0.020 . 1 . . . . . 28 ALA HB . 27259 1 279 . 1 1 28 28 ALA HB2 H 1 1.370 0.020 . 1 . . . . . 28 ALA HB . 27259 1 280 . 1 1 28 28 ALA HB3 H 1 1.370 0.020 . 1 . . . . . 28 ALA HB . 27259 1 281 . 1 1 28 28 ALA C C 13 177.457 0.3 . 1 . . . . . 28 ALA C . 27259 1 282 . 1 1 28 28 ALA CA C 13 52.356 0.3 . 1 . . . . . 28 ALA CA . 27259 1 283 . 1 1 28 28 ALA CB C 13 18.978 0.3 . 1 . . . . . 28 ALA CB . 27259 1 284 . 1 1 28 28 ALA N N 15 123.268 0.3 . 1 . . . . . 28 ALA N . 27259 1 285 . 1 1 29 29 ALA H H 1 8.223 0.020 . 1 . . . . . 29 ALA H . 27259 1 286 . 1 1 29 29 ALA HA H 1 4.320 0.020 . 1 . . . . . 29 ALA HA . 27259 1 287 . 1 1 29 29 ALA HB1 H 1 1.414 0.020 . 1 . . . . . 29 ALA HB . 27259 1 288 . 1 1 29 29 ALA HB2 H 1 1.414 0.020 . 1 . . . . . 29 ALA HB . 27259 1 289 . 1 1 29 29 ALA HB3 H 1 1.414 0.020 . 1 . . . . . 29 ALA HB . 27259 1 290 . 1 1 29 29 ALA C C 13 178.141 0.3 . 1 . . . . . 29 ALA C . 27259 1 291 . 1 1 29 29 ALA CA C 13 52.773 0.3 . 1 . . . . . 29 ALA CA . 27259 1 292 . 1 1 29 29 ALA CB C 13 18.978 0.3 . 1 . . . . . 29 ALA CB . 27259 1 293 . 1 1 29 29 ALA N N 15 123.262 0.3 . 1 . . . . . 29 ALA N . 27259 1 294 . 1 1 30 30 GLY H H 1 8.287 0.020 . 1 . . . . . 30 GLY H . 27259 1 295 . 1 1 30 30 GLY HA2 H 1 3.942 0.020 . 1 . . . . . 30 GLY HA2 . 27259 1 296 . 1 1 30 30 GLY HA3 H 1 3.942 0.020 . 1 . . . . . 30 GLY HA3 . 27259 1 297 . 1 1 30 30 GLY C C 13 173.485 0.3 . 1 . . . . . 30 GLY C . 27259 1 298 . 1 1 30 30 GLY CA C 13 45.063 0.3 . 1 . . . . . 30 GLY CA . 27259 1 299 . 1 1 30 30 GLY N N 15 107.996 0.3 . 1 . . . . . 30 GLY N . 27259 1 300 . 1 1 31 31 ALA H H 1 8.050 0.020 . 1 . . . . . 31 ALA H . 27259 1 301 . 1 1 31 31 ALA HA H 1 4.391 0.020 . 1 . . . . . 31 ALA HA . 27259 1 302 . 1 1 31 31 ALA HB1 H 1 1.369 0.020 . 1 . . . . . 31 ALA HB . 27259 1 303 . 1 1 31 31 ALA HB2 H 1 1.369 0.020 . 1 . . . . . 31 ALA HB . 27259 1 304 . 1 1 31 31 ALA HB3 H 1 1.369 0.020 . 1 . . . . . 31 ALA HB . 27259 1 305 . 1 1 31 31 ALA C C 13 177.457 0.3 . 1 . . . . . 31 ALA C . 27259 1 306 . 1 1 31 31 ALA CA C 13 52.356 0.3 . 1 . . . . . 31 ALA CA . 27259 1 307 . 1 1 31 31 ALA CB C 13 19.479 0.3 . 1 . . . . . 31 ALA CB . 27259 1 308 . 1 1 31 31 ALA N N 15 123.444 0.3 . 1 . . . . . 31 ALA N . 27259 1 309 . 1 1 32 32 VAL H H 1 8.176 0.020 . 1 . . . . . 32 VAL H . 27259 1 310 . 1 1 32 32 VAL HA H 1 4.131 0.020 . 1 . . . . . 32 VAL HA . 27259 1 311 . 1 1 32 32 VAL HB H 1 1.995 0.020 . 1 . . . . . 32 VAL HB . 27259 1 312 . 1 1 32 32 VAL HG11 H 1 0.845 0.020 . 2 . . . . . 32 VAL HG1 . 27259 1 313 . 1 1 32 32 VAL HG12 H 1 0.845 0.020 . 2 . . . . . 32 VAL HG1 . 27259 1 314 . 1 1 32 32 VAL HG13 H 1 0.845 0.020 . 2 . . . . . 32 VAL HG1 . 27259 1 315 . 1 1 32 32 VAL HG21 H 1 0.844 0.020 . 2 . . . . . 32 VAL HG2 . 27259 1 316 . 1 1 32 32 VAL HG22 H 1 0.844 0.020 . 2 . . . . . 32 VAL HG2 . 27259 1 317 . 1 1 32 32 VAL HG23 H 1 0.844 0.020 . 2 . . . . . 32 VAL HG2 . 27259 1 318 . 1 1 32 32 VAL C C 13 176.064 0.3 . 1 . . . . . 32 VAL C . 27259 1 319 . 1 1 32 32 VAL CA C 13 62.108 0.3 . 1 . . . . . 32 VAL CA . 27259 1 320 . 1 1 32 32 VAL CB C 13 32.580 0.3 . 1 . . . . . 32 VAL CB . 27259 1 321 . 1 1 32 32 VAL CG1 C 13 20.981 0.3 . 1 . . . . . 32 VAL CG1 . 27259 1 322 . 1 1 32 32 VAL CG2 C 13 20.397 0.3 . 1 . . . . . 32 VAL CG2 . 27259 1 323 . 1 1 32 32 VAL N N 15 119.786 0.3 . 1 . . . . . 32 VAL N . 27259 1 324 . 1 1 33 33 VAL H H 1 8.287 0.020 . 1 . . . . . 33 VAL H . 27259 1 325 . 1 1 33 33 VAL HA H 1 4.128 0.020 . 1 . . . . . 33 VAL HA . 27259 1 326 . 1 1 33 33 VAL HB H 1 2.036 0.020 . 1 . . . . . 33 VAL HB . 27259 1 327 . 1 1 33 33 VAL HG11 H 1 0.910 0.020 . 1 . . . . . 33 VAL HG1 . 27259 1 328 . 1 1 33 33 VAL HG12 H 1 0.910 0.020 . 1 . . . . . 33 VAL HG1 . 27259 1 329 . 1 1 33 33 VAL HG13 H 1 0.910 0.020 . 1 . . . . . 33 VAL HG1 . 27259 1 330 . 1 1 33 33 VAL HG21 H 1 0.910 0.020 . 1 . . . . . 33 VAL HG2 . 27259 1 331 . 1 1 33 33 VAL HG22 H 1 0.910 0.020 . 1 . . . . . 33 VAL HG2 . 27259 1 332 . 1 1 33 33 VAL HG23 H 1 0.910 0.020 . 1 . . . . . 33 VAL HG2 . 27259 1 333 . 1 1 33 33 VAL C C 13 176.407 0.3 . 1 . . . . . 33 VAL C . 27259 1 334 . 1 1 33 33 VAL CA C 13 62.525 0.3 . 1 . . . . . 33 VAL CA . 27259 1 335 . 1 1 33 33 VAL CB C 13 32.484 0.3 . 1 . . . . . 33 VAL CB . 27259 1 336 . 1 1 33 33 VAL CG1 C 13 20.897 0.3 . 1 . . . . . 33 VAL CG1 . 27259 1 337 . 1 1 33 33 VAL CG2 C 13 20.397 0.3 . 1 . . . . . 33 VAL CG2 . 27259 1 338 . 1 1 33 33 VAL N N 15 124.941 0.3 . 1 . . . . . 33 VAL N . 27259 1 339 . 1 1 34 34 GLY H H 1 8.514 0.020 . 1 . . . . . 34 GLY H . 27259 1 340 . 1 1 34 34 GLY HA2 H 1 3.971 0.020 . 1 . . . . . 34 GLY HA2 . 27259 1 341 . 1 1 34 34 GLY HA3 H 1 3.971 0.020 . 1 . . . . . 34 GLY HA3 . 27259 1 342 . 1 1 34 34 GLY C C 13 174.352 0.3 . 1 . . . . . 34 GLY C . 27259 1 343 . 1 1 34 34 GLY CA C 13 45.168 0.3 . 1 . . . . . 34 GLY CA . 27259 1 344 . 1 1 34 34 GLY N N 15 113.145 0.3 . 1 . . . . . 34 GLY N . 27259 1 345 . 1 1 35 35 GLY H H 1 8.274 0.020 . 1 . . . . . 35 GLY H . 27259 1 346 . 1 1 35 35 GLY HA2 H 1 3.971 0.020 . 1 . . . . . 35 GLY HA2 . 27259 1 347 . 1 1 35 35 GLY HA3 H 1 3.971 0.020 . 1 . . . . . 35 GLY HA3 . 27259 1 348 . 1 1 35 35 GLY C C 13 174.192 0.3 . 1 . . . . . 35 GLY C . 27259 1 349 . 1 1 35 35 GLY CA C 13 45.330 0.3 . 1 . . . . . 35 GLY CA . 27259 1 350 . 1 1 35 35 GLY N N 15 108.658 0.3 . 1 . . . . . 35 GLY N . 27259 1 351 . 1 1 36 36 LEU H H 1 8.285 0.020 . 1 . . . . . 36 LEU H . 27259 1 352 . 1 1 36 36 LEU HA H 1 4.362 0.020 . 1 . . . . . 36 LEU HA . 27259 1 353 . 1 1 36 36 LEU HB2 H 1 1.602 0.020 . 1 . . . . . 36 LEU HB2 . 27259 1 354 . 1 1 36 36 LEU HB3 H 1 1.602 0.020 . 1 . . . . . 36 LEU HB3 . 27259 1 355 . 1 1 36 36 LEU HG H 1 1.585 0.020 . 1 . . . . . 36 LEU HG . 27259 1 356 . 1 1 36 36 LEU HD11 H 1 0.784 0.020 . 2 . . . . . 36 LEU HD1 . 27259 1 357 . 1 1 36 36 LEU HD12 H 1 0.784 0.020 . 2 . . . . . 36 LEU HD1 . 27259 1 358 . 1 1 36 36 LEU HD13 H 1 0.784 0.020 . 2 . . . . . 36 LEU HD1 . 27259 1 359 . 1 1 36 36 LEU HD21 H 1 0.739 0.020 . 2 . . . . . 36 LEU HD2 . 27259 1 360 . 1 1 36 36 LEU HD22 H 1 0.739 0.020 . 2 . . . . . 36 LEU HD2 . 27259 1 361 . 1 1 36 36 LEU HD23 H 1 0.739 0.020 . 2 . . . . . 36 LEU HD2 . 27259 1 362 . 1 1 36 36 LEU C C 13 177.479 0.3 . 1 . . . . . 36 LEU C . 27259 1 363 . 1 1 36 36 LEU CA C 13 55.110 0.3 . 1 . . . . . 36 LEU CA . 27259 1 364 . 1 1 36 36 LEU CB C 13 42.426 0.3 . 1 . . . . . 36 LEU CB . 27259 1 365 . 1 1 36 36 LEU CG C 13 26.738 0.3 . 1 . . . . . 36 LEU CG . 27259 1 366 . 1 1 36 36 LEU CD1 C 13 24.661 0.3 . 1 . . . . . 36 LEU CD1 . 27259 1 367 . 1 1 36 36 LEU CD2 C 13 23.255 0.3 . 1 . . . . . 36 LEU CD2 . 27259 1 368 . 1 1 36 36 LEU N N 15 121.324 0.3 . 1 . . . . . 36 LEU N . 27259 1 369 . 1 1 37 37 GLY H H 1 8.337 0.020 . 1 . . . . . 37 GLY H . 27259 1 370 . 1 1 37 37 GLY HA2 H 1 3.936 0.020 . 2 . . . . . 37 GLY HA2 . 27259 1 371 . 1 1 37 37 GLY HA3 H 1 3.845 0.020 . 2 . . . . . 37 GLY HA3 . 27259 1 372 . 1 1 37 37 GLY C C 13 173.667 0.3 . 1 . . . . . 37 GLY C . 27259 1 373 . 1 1 37 37 GLY CA C 13 45.497 0.3 . 1 . . . . . 37 GLY CA . 27259 1 374 . 1 1 37 37 GLY N N 15 109.006 0.3 . 1 . . . . . 37 GLY N . 27259 1 375 . 1 1 38 38 VAL H H 1 7.749 0.020 . 1 . . . . . 38 VAL H . 27259 1 376 . 1 1 38 38 VAL HA H 1 4.103 0.020 . 1 . . . . . 38 VAL HA . 27259 1 377 . 1 1 38 38 VAL HB H 1 1.969 0.020 . 1 . . . . . 38 VAL HB . 27259 1 378 . 1 1 38 38 VAL HG11 H 1 0.773 0.020 . 2 . . . . . 38 VAL HG1 . 27259 1 379 . 1 1 38 38 VAL HG12 H 1 0.773 0.020 . 2 . . . . . 38 VAL HG1 . 27259 1 380 . 1 1 38 38 VAL HG13 H 1 0.773 0.020 . 2 . . . . . 38 VAL HG1 . 27259 1 381 . 1 1 38 38 VAL HG21 H 1 0.725 0.020 . 2 . . . . . 38 VAL HG2 . 27259 1 382 . 1 1 38 38 VAL HG22 H 1 0.725 0.020 . 2 . . . . . 38 VAL HG2 . 27259 1 383 . 1 1 38 38 VAL HG23 H 1 0.725 0.020 . 2 . . . . . 38 VAL HG2 . 27259 1 384 . 1 1 38 38 VAL C C 13 175.219 0.3 . 1 . . . . . 38 VAL C . 27259 1 385 . 1 1 38 38 VAL CA C 13 62.203 0.3 . 1 . . . . . 38 VAL CA . 27259 1 386 . 1 1 38 38 VAL CB C 13 32.329 0.3 . 1 . . . . . 38 VAL CB . 27259 1 387 . 1 1 38 38 VAL CG1 C 13 20.834 0.3 . 1 . . . . . 38 VAL CG1 . 27259 1 388 . 1 1 38 38 VAL CG2 C 13 19.897 0.3 . 1 . . . . . 38 VAL CG2 . 27259 1 389 . 1 1 38 38 VAL N N 15 118.625 0.3 . 1 . . . . . 38 VAL N . 27259 1 390 . 1 1 39 39 TYR HA H 1 4.562 0.020 . 1 . . . . . 39 TYR HA . 27259 1 391 . 1 1 39 39 TYR HB2 H 1 2.886 0.020 . 2 . . . . . 39 TYR HB2 . 27259 1 392 . 1 1 39 39 TYR HB3 H 1 2.819 0.020 . 2 . . . . . 39 TYR HB3 . 27259 1 393 . 1 1 39 39 TYR HD1 H 1 6.789 0.020 . 1 . . . . . 39 TYR HD1 . 27259 1 394 . 1 1 39 39 TYR HD2 H 1 6.789 0.020 . 1 . . . . . 39 TYR HD2 . 27259 1 395 . 1 1 39 39 TYR HE1 H 1 6.557 0.020 . 1 . . . . . 39 TYR HE1 . 27259 1 396 . 1 1 39 39 TYR HE2 H 1 6.557 0.020 . 1 . . . . . 39 TYR HE2 . 27259 1 397 . 1 1 39 39 TYR C C 13 175.219 0.3 . 1 . . . . . 39 TYR C . 27259 1 398 . 1 1 39 39 TYR CA C 13 57.430 0.3 . 1 . . . . . 39 TYR CA . 27259 1 399 . 1 1 39 39 TYR CB C 13 40.006 0.3 . 1 . . . . . 39 TYR CB . 27259 1 400 . 1 1 40 40 MET H H 1 8.855 0.020 . 1 . . . . . 40 MET H . 27259 1 401 . 1 1 40 40 MET HA H 1 4.528 0.020 . 1 . . . . . 40 MET HA . 27259 1 402 . 1 1 40 40 MET HB2 H 1 1.594 0.020 . 2 . . . . . 40 MET HB2 . 27259 1 403 . 1 1 40 40 MET HB3 H 1 0.906 0.020 . 2 . . . . . 40 MET HB3 . 27259 1 404 . 1 1 40 40 MET HG2 H 1 2.252 0.020 . 1 . . . . . 40 MET HG2 . 27259 1 405 . 1 1 40 40 MET HG3 H 1 2.252 0.020 . 1 . . . . . 40 MET HG3 . 27259 1 406 . 1 1 40 40 MET HE1 H 1 2.026 0.020 . 1 . . . . . 40 MET HE . 27259 1 407 . 1 1 40 40 MET HE2 H 1 2.026 0.020 . 1 . . . . . 40 MET HE . 27259 1 408 . 1 1 40 40 MET HE3 H 1 2.026 0.020 . 1 . . . . . 40 MET HE . 27259 1 409 . 1 1 40 40 MET C C 13 172.982 0.3 . 1 . . . . . 40 MET C . 27259 1 410 . 1 1 40 40 MET CA C 13 53.563 0.3 . 1 . . . . . 40 MET CA . 27259 1 411 . 1 1 40 40 MET CB C 13 34.165 0.3 . 1 . . . . . 40 MET CB . 27259 1 412 . 1 1 40 40 MET CG C 13 32.079 0.3 . 1 . . . . . 40 MET CG . 27259 1 413 . 1 1 40 40 MET CE C 13 17.059 0.3 . 1 . . . . . 40 MET CE . 27259 1 414 . 1 1 40 40 MET N N 15 120.724 0.3 . 1 . . . . . 40 MET N . 27259 1 415 . 1 1 41 41 LEU H H 1 8.060 0.020 . 1 . . . . . 41 LEU H . 27259 1 416 . 1 1 41 41 LEU HA H 1 4.480 0.020 . 1 . . . . . 41 LEU HA . 27259 1 417 . 1 1 41 41 LEU HB2 H 1 1.617 0.020 . 2 . . . . . 41 LEU HB2 . 27259 1 418 . 1 1 41 41 LEU HB3 H 1 0.985 0.020 . 2 . . . . . 41 LEU HB3 . 27259 1 419 . 1 1 41 41 LEU HG H 1 1.392 0.020 . 1 . . . . . 41 LEU HG . 27259 1 420 . 1 1 41 41 LEU HD11 H 1 0.631 0.020 . 2 . . . . . 41 LEU HD1 . 27259 1 421 . 1 1 41 41 LEU HD12 H 1 0.631 0.020 . 2 . . . . . 41 LEU HD1 . 27259 1 422 . 1 1 41 41 LEU HD13 H 1 0.631 0.020 . 2 . . . . . 41 LEU HD1 . 27259 1 423 . 1 1 41 41 LEU HD21 H 1 0.006 0.020 . 2 . . . . . 41 LEU HD2 . 27259 1 424 . 1 1 41 41 LEU HD22 H 1 0.006 0.020 . 2 . . . . . 41 LEU HD2 . 27259 1 425 . 1 1 41 41 LEU HD23 H 1 0.006 0.020 . 2 . . . . . 41 LEU HD2 . 27259 1 426 . 1 1 41 41 LEU C C 13 177.982 0.3 . 1 . . . . . 41 LEU C . 27259 1 427 . 1 1 41 41 LEU CA C 13 53.244 0.3 . 1 . . . . . 41 LEU CA . 27259 1 428 . 1 1 41 41 LEU CB C 13 43.511 0.3 . 1 . . . . . 41 LEU CB . 27259 1 429 . 1 1 41 41 LEU CG C 13 25.832 0.3 . 1 . . . . . 41 LEU CG . 27259 1 430 . 1 1 41 41 LEU CD1 C 13 25.536 0.3 . 1 . . . . . 41 LEU CD1 . 27259 1 431 . 1 1 41 41 LEU CD2 C 13 21.693 0.3 . 1 . . . . . 41 LEU CD2 . 27259 1 432 . 1 1 41 41 LEU N N 15 121.461 0.3 . 1 . . . . . 41 LEU N . 27259 1 433 . 1 1 42 42 GLY H H 1 9.323 0.020 . 1 . . . . . 42 GLY H . 27259 1 434 . 1 1 42 42 GLY HA2 H 1 4.431 0.020 . 2 . . . . . 42 GLY HA2 . 27259 1 435 . 1 1 42 42 GLY HA3 H 1 3.999 0.020 . 2 . . . . . 42 GLY HA3 . 27259 1 436 . 1 1 42 42 GLY C C 13 172.640 0.3 . 1 . . . . . 42 GLY C . 27259 1 437 . 1 1 42 42 GLY CA C 13 44.667 0.3 . 1 . . . . . 42 GLY CA . 27259 1 438 . 1 1 42 42 GLY N N 15 114.946 0.3 . 1 . . . . . 42 GLY N . 27259 1 439 . 1 1 43 43 SER H H 1 8.395 0.020 . 1 . . . . . 43 SER H . 27259 1 440 . 1 1 43 43 SER HA H 1 4.377 0.020 . 1 . . . . . 43 SER HA . 27259 1 441 . 1 1 43 43 SER HB2 H 1 3.988 0.020 . 2 . . . . . 43 SER HB2 . 27259 1 442 . 1 1 43 43 SER HB3 H 1 3.918 0.020 . 2 . . . . . 43 SER HB3 . 27259 1 443 . 1 1 43 43 SER C C 13 175.037 0.3 . 1 . . . . . 43 SER C . 27259 1 444 . 1 1 43 43 SER CA C 13 58.448 0.3 . 1 . . . . . 43 SER CA . 27259 1 445 . 1 1 43 43 SER CB C 13 63.872 0.3 . 1 . . . . . 43 SER CB . 27259 1 446 . 1 1 43 43 SER N N 15 113.654 0.3 . 1 . . . . . 43 SER N . 27259 1 447 . 1 1 44 44 ALA H H 1 8.777 0.020 . 1 . . . . . 44 ALA H . 27259 1 448 . 1 1 44 44 ALA HA H 1 4.447 0.020 . 1 . . . . . 44 ALA HA . 27259 1 449 . 1 1 44 44 ALA HB1 H 1 1.302 0.020 . 1 . . . . . 44 ALA HB . 27259 1 450 . 1 1 44 44 ALA HB2 H 1 1.302 0.020 . 1 . . . . . 44 ALA HB . 27259 1 451 . 1 1 44 44 ALA HB3 H 1 1.302 0.020 . 1 . . . . . 44 ALA HB . 27259 1 452 . 1 1 44 44 ALA C C 13 177.274 0.3 . 1 . . . . . 44 ALA C . 27259 1 453 . 1 1 44 44 ALA CA C 13 52.929 0.3 . 1 . . . . . 44 ALA CA . 27259 1 454 . 1 1 44 44 ALA CB C 13 18.215 0.3 . 1 . . . . . 44 ALA CB . 27259 1 455 . 1 1 44 44 ALA N N 15 125.667 0.3 . 1 . . . . . 44 ALA N . 27259 1 456 . 1 1 45 45 MET H H 1 8.698 0.020 . 1 . . . . . 45 MET H . 27259 1 457 . 1 1 45 45 MET HA H 1 4.754 0.020 . 1 . . . . . 45 MET HA . 27259 1 458 . 1 1 45 45 MET HB2 H 1 2.034 0.020 . 2 . . . . . 45 MET HB2 . 27259 1 459 . 1 1 45 45 MET HB3 H 1 2.007 0.020 . 2 . . . . . 45 MET HB3 . 27259 1 460 . 1 1 45 45 MET HG2 H 1 2.476 0.020 . 2 . . . . . 45 MET HG2 . 27259 1 461 . 1 1 45 45 MET HG3 H 1 2.422 0.020 . 2 . . . . . 45 MET HG3 . 27259 1 462 . 1 1 45 45 MET HE1 H 1 2.168 0.020 . 1 . . . . . 45 MET HE . 27259 1 463 . 1 1 45 45 MET HE2 H 1 2.168 0.020 . 1 . . . . . 45 MET HE . 27259 1 464 . 1 1 45 45 MET HE3 H 1 2.168 0.020 . 1 . . . . . 45 MET HE . 27259 1 465 . 1 1 45 45 MET C C 13 175.379 0.3 . 1 . . . . . 45 MET C . 27259 1 466 . 1 1 45 45 MET CA C 13 53.858 0.3 . 1 . . . . . 45 MET CA . 27259 1 467 . 1 1 45 45 MET CB C 13 36.668 0.3 . 1 . . . . . 45 MET CB . 27259 1 468 . 1 1 45 45 MET CG C 13 30.752 0.3 . 1 . . . . . 45 MET CG . 27259 1 469 . 1 1 45 45 MET CE C 13 17.372 0.3 . 1 . . . . . 45 MET CE . 27259 1 470 . 1 1 45 45 MET N N 15 120.684 0.3 . 1 . . . . . 45 MET N . 27259 1 471 . 1 1 46 46 SER H H 1 8.432 0.020 . 1 . . . . . 46 SER H . 27259 1 472 . 1 1 46 46 SER HA H 1 4.381 0.020 . 1 . . . . . 46 SER HA . 27259 1 473 . 1 1 46 46 SER HB2 H 1 3.845 0.020 . 2 . . . . . 46 SER HB2 . 27259 1 474 . 1 1 46 46 SER HB3 H 1 3.761 0.020 . 2 . . . . . 46 SER HB3 . 27259 1 475 . 1 1 46 46 SER C C 13 174.329 0.3 . 1 . . . . . 46 SER C . 27259 1 476 . 1 1 46 46 SER CA C 13 58.563 0.3 . 1 . . . . . 46 SER CA . 27259 1 477 . 1 1 46 46 SER CB C 13 62.942 0.3 . 1 . . . . . 46 SER CB . 27259 1 478 . 1 1 46 46 SER N N 15 116.260 0.3 . 1 . . . . . 46 SER N . 27259 1 479 . 1 1 47 47 ARG H H 1 8.649 0.020 . 1 . . . . . 47 ARG H . 27259 1 480 . 1 1 47 47 ARG HA H 1 4.421 0.020 . 1 . . . . . 47 ARG HA . 27259 1 481 . 1 1 47 47 ARG HB2 H 1 1.732 0.020 . 1 . . . . . 47 ARG HB2 . 27259 1 482 . 1 1 47 47 ARG HB3 H 1 1.732 0.020 . 1 . . . . . 47 ARG HB3 . 27259 1 483 . 1 1 47 47 ARG HG2 H 1 2.050 0.020 . 2 . . . . . 47 ARG HG2 . 27259 1 484 . 1 1 47 47 ARG HG3 H 1 1.834 0.020 . 2 . . . . . 47 ARG HG3 . 27259 1 485 . 1 1 47 47 ARG HD2 H 1 3.156 0.020 . 2 . . . . . 47 ARG HD2 . 27259 1 486 . 1 1 47 47 ARG HD3 H 1 3.071 0.020 . 2 . . . . . 47 ARG HD3 . 27259 1 487 . 1 1 47 47 ARG HE H 1 6.699 0.020 . 1 . . . . . 47 ARG HE . 27259 1 488 . 1 1 47 47 ARG C C 13 174.535 0.3 . 1 . . . . . 47 ARG C . 27259 1 489 . 1 1 47 47 ARG CA C 13 54.848 0.3 . 1 . . . . . 47 ARG CA . 27259 1 490 . 1 1 47 47 ARG CB C 13 29.480 0.3 . 1 . . . . . 47 ARG CB . 27259 1 491 . 1 1 47 47 ARG CG C 13 28.721 0.3 . 1 . . . . . 47 ARG CG . 27259 1 492 . 1 1 47 47 ARG CD C 13 43.326 0.3 . 1 . . . . . 47 ARG CD . 27259 1 493 . 1 1 47 47 ARG N N 15 126.473 0.3 . 1 . . . . . 47 ARG N . 27259 1 494 . 1 1 47 47 ARG NE N 15 85.678 0.3 . 1 . . . . . 47 ARG NE . 27259 1 495 . 1 1 48 48 PRO HA H 1 4.440 0.020 . 1 . . . . . 48 PRO HA . 27259 1 496 . 1 1 48 48 PRO HB2 H 1 2.272 0.020 . 2 . . . . . 48 PRO HB2 . 27259 1 497 . 1 1 48 48 PRO HB3 H 1 1.773 0.020 . 2 . . . . . 48 PRO HB3 . 27259 1 498 . 1 1 48 48 PRO HG2 H 1 2.044 0.020 . 2 . . . . . 48 PRO HG2 . 27259 1 499 . 1 1 48 48 PRO HG3 H 1 1.998 0.020 . 2 . . . . . 48 PRO HG3 . 27259 1 500 . 1 1 48 48 PRO HD2 H 1 3.847 0.020 . 2 . . . . . 48 PRO HD2 . 27259 1 501 . 1 1 48 48 PRO HD3 H 1 3.625 0.020 . 2 . . . . . 48 PRO HD3 . 27259 1 502 . 1 1 48 48 PRO C C 13 175.562 0.3 . 1 . . . . . 48 PRO C . 27259 1 503 . 1 1 48 48 PRO CA C 13 62.286 0.3 . 1 . . . . . 48 PRO CA . 27259 1 504 . 1 1 48 48 PRO CB C 13 32.240 0.3 . 1 . . . . . 48 PRO CB . 27259 1 505 . 1 1 48 48 PRO CG C 13 27.262 0.3 . 1 . . . . . 48 PRO CG . 27259 1 506 . 1 1 48 48 PRO CD C 13 50.908 0.3 . 1 . . . . . 48 PRO CD . 27259 1 507 . 1 1 49 49 ILE H H 1 8.639 0.020 . 1 . . . . . 49 ILE H . 27259 1 508 . 1 1 49 49 ILE HA H 1 4.144 0.020 . 1 . . . . . 49 ILE HA . 27259 1 509 . 1 1 49 49 ILE HB H 1 1.921 0.020 . 1 . . . . . 49 ILE HB . 27259 1 510 . 1 1 49 49 ILE HG12 H 1 1.591 0.020 . 2 . . . . . 49 ILE HG12 . 27259 1 511 . 1 1 49 49 ILE HG13 H 1 1.381 0.020 . 2 . . . . . 49 ILE HG13 . 27259 1 512 . 1 1 49 49 ILE HG21 H 1 0.745 0.020 . 1 . . . . . 49 ILE HG2 . 27259 1 513 . 1 1 49 49 ILE HG22 H 1 0.745 0.020 . 1 . . . . . 49 ILE HG2 . 27259 1 514 . 1 1 49 49 ILE HG23 H 1 0.745 0.020 . 1 . . . . . 49 ILE HG2 . 27259 1 515 . 1 1 49 49 ILE HD11 H 1 0.904 0.020 . 1 . . . . . 49 ILE HD1 . 27259 1 516 . 1 1 49 49 ILE HD12 H 1 0.904 0.020 . 1 . . . . . 49 ILE HD1 . 27259 1 517 . 1 1 49 49 ILE HD13 H 1 0.904 0.020 . 1 . . . . . 49 ILE HD1 . 27259 1 518 . 1 1 49 49 ILE C C 13 175.037 0.3 . 1 . . . . . 49 ILE C . 27259 1 519 . 1 1 49 49 ILE CA C 13 60.951 0.3 . 1 . . . . . 49 ILE CA . 27259 1 520 . 1 1 49 49 ILE CB C 13 36.084 0.3 . 1 . . . . . 49 ILE CB . 27259 1 521 . 1 1 49 49 ILE CG1 C 13 26.828 0.3 . 1 . . . . . 49 ILE CG1 . 27259 1 522 . 1 1 49 49 ILE CG2 C 13 17.416 0.3 . 1 . . . . . 49 ILE CG2 . 27259 1 523 . 1 1 49 49 ILE CD1 C 13 11.316 0.3 . 1 . . . . . 49 ILE CD1 . 27259 1 524 . 1 1 49 49 ILE N N 15 122.527 0.3 . 1 . . . . . 49 ILE N . 27259 1 525 . 1 1 50 50 ILE H H 1 6.465 0.020 . 1 . . . . . 50 ILE H . 27259 1 526 . 1 1 50 50 ILE HA H 1 3.928 0.020 . 1 . . . . . 50 ILE HA . 27259 1 527 . 1 1 50 50 ILE HB H 1 0.874 0.020 . 1 . . . . . 50 ILE HB . 27259 1 528 . 1 1 50 50 ILE HG12 H 1 0.922 0.020 . 2 . . . . . 50 ILE HG12 . 27259 1 529 . 1 1 50 50 ILE HG13 H 1 0.783 0.020 . 2 . . . . . 50 ILE HG13 . 27259 1 530 . 1 1 50 50 ILE HG21 H 1 -0.045 0.020 . 1 . . . . . 50 ILE HG2 . 27259 1 531 . 1 1 50 50 ILE HG22 H 1 -0.045 0.020 . 1 . . . . . 50 ILE HG2 . 27259 1 532 . 1 1 50 50 ILE HG23 H 1 -0.045 0.020 . 1 . . . . . 50 ILE HG2 . 27259 1 533 . 1 1 50 50 ILE HD11 H 1 0.477 0.020 . 1 . . . . . 50 ILE HD1 . 27259 1 534 . 1 1 50 50 ILE HD12 H 1 0.477 0.020 . 1 . . . . . 50 ILE HD1 . 27259 1 535 . 1 1 50 50 ILE HD13 H 1 0.477 0.020 . 1 . . . . . 50 ILE HD1 . 27259 1 536 . 1 1 50 50 ILE C C 13 173.142 0.3 . 1 . . . . . 50 ILE C . 27259 1 537 . 1 1 50 50 ILE CA C 13 58.633 0.3 . 1 . . . . . 50 ILE CA . 27259 1 538 . 1 1 50 50 ILE CB C 13 39.160 0.3 . 1 . . . . . 50 ILE CB . 27259 1 539 . 1 1 50 50 ILE CG1 C 13 26.379 0.3 . 1 . . . . . 50 ILE CG1 . 27259 1 540 . 1 1 50 50 ILE CG2 C 13 17.007 0.3 . 1 . . . . . 50 ILE CG2 . 27259 1 541 . 1 1 50 50 ILE CD1 C 13 12.405 0.3 . 1 . . . . . 50 ILE CD1 . 27259 1 542 . 1 1 50 50 ILE N N 15 126.876 0.3 . 1 . . . . . 50 ILE N . 27259 1 543 . 1 1 51 51 HIS H H 1 8.241 0.020 . 1 . . . . . 51 HIS H . 27259 1 544 . 1 1 51 51 HIS HA H 1 4.932 0.020 . 1 . . . . . 51 HIS HA . 27259 1 545 . 1 1 51 51 HIS HB2 H 1 3.306 0.020 . 2 . . . . . 51 HIS HB2 . 27259 1 546 . 1 1 51 51 HIS HB3 H 1 2.957 0.020 . 2 . . . . . 51 HIS HB3 . 27259 1 547 . 1 1 51 51 HIS HD2 H 1 7.312 0.020 . 1 . . . . . 51 HIS HD2 . 27259 1 548 . 1 1 51 51 HIS C C 13 174.535 0.3 . 1 . . . . . 51 HIS C . 27259 1 549 . 1 1 51 51 HIS CA C 13 54.063 0.3 . 1 . . . . . 51 HIS CA . 27259 1 550 . 1 1 51 51 HIS CB C 13 29.158 0.3 . 1 . . . . . 51 HIS CB . 27259 1 551 . 1 1 51 51 HIS N N 15 122.038 0.3 . 1 . . . . . 51 HIS N . 27259 1 552 . 1 1 52 52 PHE H H 1 10.183 0.020 . 1 . . . . . 52 PHE H . 27259 1 553 . 1 1 52 52 PHE HA H 1 4.362 0.020 . 1 . . . . . 52 PHE HA . 27259 1 554 . 1 1 52 52 PHE HB2 H 1 3.344 0.020 . 2 . . . . . 52 PHE HB2 . 27259 1 555 . 1 1 52 52 PHE HB3 H 1 2.794 0.020 . 2 . . . . . 52 PHE HB3 . 27259 1 556 . 1 1 52 52 PHE HD1 H 1 7.370 0.020 . 1 . . . . . 52 PHE HD1 . 27259 1 557 . 1 1 52 52 PHE HD2 H 1 7.370 0.020 . 1 . . . . . 52 PHE HD2 . 27259 1 558 . 1 1 52 52 PHE HE1 H 1 6.905 0.020 . 1 . . . . . 52 PHE HE1 . 27259 1 559 . 1 1 52 52 PHE HE2 H 1 6.905 0.020 . 1 . . . . . 52 PHE HE2 . 27259 1 560 . 1 1 52 52 PHE HZ H 1 6.731 0.020 . 1 . . . . . 52 PHE HZ . 27259 1 561 . 1 1 52 52 PHE C C 13 176.589 0.3 . 1 . . . . . 52 PHE C . 27259 1 562 . 1 1 52 52 PHE CA C 13 59.270 0.3 . 1 . . . . . 52 PHE CA . 27259 1 563 . 1 1 52 52 PHE CB C 13 41.246 0.3 . 1 . . . . . 52 PHE CB . 27259 1 564 . 1 1 52 52 PHE N N 15 123.980 0.3 . 1 . . . . . 52 PHE N . 27259 1 565 . 1 1 53 53 GLY H H 1 8.998 0.020 . 1 . . . . . 53 GLY H . 27259 1 566 . 1 1 53 53 GLY HA2 H 1 4.175 0.020 . 2 . . . . . 53 GLY HA2 . 27259 1 567 . 1 1 53 53 GLY HA3 H 1 3.836 0.020 . 2 . . . . . 53 GLY HA3 . 27259 1 568 . 1 1 53 53 GLY C C 13 173.325 0.3 . 1 . . . . . 53 GLY C . 27259 1 569 . 1 1 53 53 GLY CA C 13 45.669 0.3 . 1 . . . . . 53 GLY CA . 27259 1 570 . 1 1 53 53 GLY N N 15 108.504 0.3 . 1 . . . . . 53 GLY N . 27259 1 571 . 1 1 54 54 SER H H 1 7.287 0.020 . 1 . . . . . 54 SER H . 27259 1 572 . 1 1 54 54 SER HA H 1 4.821 0.020 . 1 . . . . . 54 SER HA . 27259 1 573 . 1 1 54 54 SER HB2 H 1 4.149 0.020 . 2 . . . . . 54 SER HB2 . 27259 1 574 . 1 1 54 54 SER HB3 H 1 3.942 0.020 . 2 . . . . . 54 SER HB3 . 27259 1 575 . 1 1 54 54 SER C C 13 173.827 0.3 . 1 . . . . . 54 SER C . 27259 1 576 . 1 1 54 54 SER CA C 13 56.596 0.3 . 1 . . . . . 54 SER CA . 27259 1 577 . 1 1 54 54 SER CB C 13 65.791 0.3 . 1 . . . . . 54 SER CB . 27259 1 578 . 1 1 54 54 SER N N 15 111.734 0.3 . 1 . . . . . 54 SER N . 27259 1 579 . 1 1 55 55 ASP H H 1 9.044 0.020 . 1 . . . . . 55 ASP H . 27259 1 580 . 1 1 55 55 ASP HA H 1 4.522 0.020 . 1 . . . . . 55 ASP HA . 27259 1 581 . 1 1 55 55 ASP HB2 H 1 2.761 0.020 . 1 . . . . . 55 ASP HB2 . 27259 1 582 . 1 1 55 55 ASP HB3 H 1 2.761 0.020 . 1 . . . . . 55 ASP HB3 . 27259 1 583 . 1 1 55 55 ASP C C 13 178.461 0.3 . 1 . . . . . 55 ASP C . 27259 1 584 . 1 1 55 55 ASP CA C 13 57.563 0.3 . 1 . . . . . 55 ASP CA . 27259 1 585 . 1 1 55 55 ASP CB C 13 40.412 0.3 . 1 . . . . . 55 ASP CB . 27259 1 586 . 1 1 55 55 ASP N N 15 124.529 0.3 . 1 . . . . . 55 ASP N . 27259 1 587 . 1 1 56 56 TYR H H 1 8.571 0.020 . 1 . . . . . 56 TYR H . 27259 1 588 . 1 1 56 56 TYR HA H 1 4.203 0.020 . 1 . . . . . 56 TYR HA . 27259 1 589 . 1 1 56 56 TYR HB2 H 1 3.269 0.020 . 2 . . . . . 56 TYR HB2 . 27259 1 590 . 1 1 56 56 TYR HB3 H 1 2.855 0.020 . 2 . . . . . 56 TYR HB3 . 27259 1 591 . 1 1 56 56 TYR HD1 H 1 7.008 0.020 . 1 . . . . . 56 TYR HD1 . 27259 1 592 . 1 1 56 56 TYR HD2 H 1 7.008 0.020 . 1 . . . . . 56 TYR HD2 . 27259 1 593 . 1 1 56 56 TYR HE1 H 1 6.781 0.020 . 1 . . . . . 56 TYR HE1 . 27259 1 594 . 1 1 56 56 TYR HE2 H 1 6.781 0.020 . 1 . . . . . 56 TYR HE2 . 27259 1 595 . 1 1 56 56 TYR C C 13 177.799 0.3 . 1 . . . . . 56 TYR C . 27259 1 596 . 1 1 56 56 TYR CA C 13 61.452 0.3 . 1 . . . . . 56 TYR CA . 27259 1 597 . 1 1 56 56 TYR CB C 13 37.920 0.3 . 1 . . . . . 56 TYR CB . 27259 1 598 . 1 1 56 56 TYR N N 15 118.907 0.3 . 1 . . . . . 56 TYR N . 27259 1 599 . 1 1 57 57 GLU H H 1 7.707 0.020 . 1 . . . . . 57 GLU H . 27259 1 600 . 1 1 57 57 GLU HA H 1 3.603 0.020 . 1 . . . . . 57 GLU HA . 27259 1 601 . 1 1 57 57 GLU HB2 H 1 1.975 0.020 . 2 . . . . . 57 GLU HB2 . 27259 1 602 . 1 1 57 57 GLU HB3 H 1 1.569 0.020 . 2 . . . . . 57 GLU HB3 . 27259 1 603 . 1 1 57 57 GLU HG2 H 1 2.273 0.020 . 2 . . . . . 57 GLU HG2 . 27259 1 604 . 1 1 57 57 GLU HG3 H 1 1.927 0.020 . 2 . . . . . 57 GLU HG3 . 27259 1 605 . 1 1 57 57 GLU C C 13 177.434 0.3 . 1 . . . . . 57 GLU C . 27259 1 606 . 1 1 57 57 GLU CA C 13 59.763 0.3 . 1 . . . . . 57 GLU CA . 27259 1 607 . 1 1 57 57 GLU CB C 13 29.826 0.3 . 1 . . . . . 57 GLU CB . 27259 1 608 . 1 1 57 57 GLU CG C 13 37.514 0.3 . 1 . . . . . 57 GLU CG . 27259 1 609 . 1 1 57 57 GLU N N 15 119.084 0.3 . 1 . . . . . 57 GLU N . 27259 1 610 . 1 1 58 58 ASP H H 1 8.181 0.020 . 1 . . . . . 58 ASP H . 27259 1 611 . 1 1 58 58 ASP HA H 1 4.668 0.020 . 1 . . . . . 58 ASP HA . 27259 1 612 . 1 1 58 58 ASP HB2 H 1 3.043 0.020 . 2 . . . . . 58 ASP HB2 . 27259 1 613 . 1 1 58 58 ASP HB3 H 1 2.889 0.020 . 2 . . . . . 58 ASP HB3 . 27259 1 614 . 1 1 58 58 ASP C C 13 179.169 0.3 . 1 . . . . . 58 ASP C . 27259 1 615 . 1 1 58 58 ASP CA C 13 58.363 0.3 . 1 . . . . . 58 ASP CA . 27259 1 616 . 1 1 58 58 ASP CB C 13 40.161 0.3 . 1 . . . . . 58 ASP CB . 27259 1 617 . 1 1 58 58 ASP N N 15 119.842 0.3 . 1 . . . . . 58 ASP N . 27259 1 618 . 1 1 59 59 ARG H H 1 8.207 0.020 . 1 . . . . . 59 ARG H . 27259 1 619 . 1 1 59 59 ARG HA H 1 4.014 0.020 . 1 . . . . . 59 ARG HA . 27259 1 620 . 1 1 59 59 ARG HB2 H 1 1.918 0.020 . 1 . . . . . 59 ARG HB2 . 27259 1 621 . 1 1 59 59 ARG HB3 H 1 1.918 0.020 . 1 . . . . . 59 ARG HB3 . 27259 1 622 . 1 1 59 59 ARG HG2 H 1 1.760 0.020 . 2 . . . . . 59 ARG HG2 . 27259 1 623 . 1 1 59 59 ARG HG3 H 1 1.548 0.020 . 2 . . . . . 59 ARG HG3 . 27259 1 624 . 1 1 59 59 ARG HD2 H 1 3.247 0.020 . 2 . . . . . 59 ARG HD2 . 27259 1 625 . 1 1 59 59 ARG HD3 H 1 3.211 0.020 . 2 . . . . . 59 ARG HD3 . 27259 1 626 . 1 1 59 59 ARG HE H 1 7.451 0.020 . 1 . . . . . 59 ARG HE . 27259 1 627 . 1 1 59 59 ARG C C 13 177.639 0.3 . 1 . . . . . 59 ARG C . 27259 1 628 . 1 1 59 59 ARG CA C 13 59.604 0.3 . 1 . . . . . 59 ARG CA . 27259 1 629 . 1 1 59 59 ARG CB C 13 29.814 0.3 . 1 . . . . . 59 ARG CB . 27259 1 630 . 1 1 59 59 ARG CG C 13 27.806 0.3 . 1 . . . . . 59 ARG CG . 27259 1 631 . 1 1 59 59 ARG CD C 13 43.419 0.3 . 1 . . . . . 59 ARG CD . 27259 1 632 . 1 1 59 59 ARG N N 15 120.363 0.3 . 1 . . . . . 59 ARG N . 27259 1 633 . 1 1 59 59 ARG NE N 15 85.129 0.3 . 1 . . . . . 59 ARG NE . 27259 1 634 . 1 1 60 60 TYR H H 1 8.296 0.020 . 1 . . . . . 60 TYR H . 27259 1 635 . 1 1 60 60 TYR HA H 1 3.845 0.020 . 1 . . . . . 60 TYR HA . 27259 1 636 . 1 1 60 60 TYR HB2 H 1 2.861 0.020 . 2 . . . . . 60 TYR HB2 . 27259 1 637 . 1 1 60 60 TYR HB3 H 1 2.619 0.020 . 2 . . . . . 60 TYR HB3 . 27259 1 638 . 1 1 60 60 TYR HD1 H 1 6.895 0.020 . 1 . . . . . 60 TYR HD1 . 27259 1 639 . 1 1 60 60 TYR HD2 H 1 6.895 0.020 . 1 . . . . . 60 TYR HD2 . 27259 1 640 . 1 1 60 60 TYR HE1 H 1 6.822 0.020 . 1 . . . . . 60 TYR HE1 . 27259 1 641 . 1 1 60 60 TYR HE2 H 1 6.822 0.020 . 1 . . . . . 60 TYR HE2 . 27259 1 642 . 1 1 60 60 TYR C C 13 179.511 0.3 . 1 . . . . . 60 TYR C . 27259 1 643 . 1 1 60 60 TYR CA C 13 62.229 0.3 . 1 . . . . . 60 TYR CA . 27259 1 644 . 1 1 60 60 TYR CB C 13 37.908 0.3 . 1 . . . . . 60 TYR CB . 27259 1 645 . 1 1 60 60 TYR N N 15 121.389 0.3 . 1 . . . . . 60 TYR N . 27259 1 646 . 1 1 61 61 TYR H H 1 8.954 0.020 . 1 . . . . . 61 TYR H . 27259 1 647 . 1 1 61 61 TYR HA H 1 4.136 0.020 . 1 . . . . . 61 TYR HA . 27259 1 648 . 1 1 61 61 TYR HB2 H 1 3.534 0.020 . 2 . . . . . 61 TYR HB2 . 27259 1 649 . 1 1 61 61 TYR HB3 H 1 3.273 0.020 . 2 . . . . . 61 TYR HB3 . 27259 1 650 . 1 1 61 61 TYR HD1 H 1 7.546 0.020 . 1 . . . . . 61 TYR HD1 . 27259 1 651 . 1 1 61 61 TYR HD2 H 1 7.546 0.020 . 1 . . . . . 61 TYR HD2 . 27259 1 652 . 1 1 61 61 TYR HE1 H 1 6.892 0.020 . 1 . . . . . 61 TYR HE1 . 27259 1 653 . 1 1 61 61 TYR HE2 H 1 6.892 0.020 . 1 . . . . . 61 TYR HE2 . 27259 1 654 . 1 1 61 61 TYR C C 13 176.932 0.3 . 1 . . . . . 61 TYR C . 27259 1 655 . 1 1 61 61 TYR CA C 13 62.863 0.3 . 1 . . . . . 61 TYR CA . 27259 1 656 . 1 1 61 61 TYR CB C 13 37.933 0.3 . 1 . . . . . 61 TYR CB . 27259 1 657 . 1 1 61 61 TYR N N 15 120.617 0.3 . 1 . . . . . 61 TYR N . 27259 1 658 . 1 1 62 62 ARG H H 1 7.974 0.020 . 1 . . . . . 62 ARG H . 27259 1 659 . 1 1 62 62 ARG HA H 1 3.939 0.020 . 1 . . . . . 62 ARG HA . 27259 1 660 . 1 1 62 62 ARG HB2 H 1 2.082 0.020 . 2 . . . . . 62 ARG HB2 . 27259 1 661 . 1 1 62 62 ARG HB3 H 1 1.975 0.020 . 2 . . . . . 62 ARG HB3 . 27259 1 662 . 1 1 62 62 ARG HG2 H 1 2.025 0.020 . 2 . . . . . 62 ARG HG2 . 27259 1 663 . 1 1 62 62 ARG HG3 H 1 1.748 0.020 . 2 . . . . . 62 ARG HG3 . 27259 1 664 . 1 1 62 62 ARG HD2 H 1 3.395 0.020 . 2 . . . . . 62 ARG HD2 . 27259 1 665 . 1 1 62 62 ARG HD3 H 1 3.298 0.020 . 2 . . . . . 62 ARG HD3 . 27259 1 666 . 1 1 62 62 ARG HE H 1 7.469 0.020 . 1 . . . . . 62 ARG HE . 27259 1 667 . 1 1 62 62 ARG C C 13 179.511 0.3 . 1 . . . . . 62 ARG C . 27259 1 668 . 1 1 62 62 ARG CA C 13 59.950 0.3 . 1 . . . . . 62 ARG CA . 27259 1 669 . 1 1 62 62 ARG CB C 13 29.826 0.3 . 1 . . . . . 62 ARG CB . 27259 1 670 . 1 1 62 62 ARG CG C 13 28.073 0.3 . 1 . . . . . 62 ARG CG . 27259 1 671 . 1 1 62 62 ARG CD C 13 43.241 0.3 . 1 . . . . . 62 ARG CD . 27259 1 672 . 1 1 62 62 ARG N N 15 117.984 0.3 . 1 . . . . . 62 ARG N . 27259 1 673 . 1 1 62 62 ARG NE N 15 84.188 0.3 . 1 . . . . . 62 ARG NE . 27259 1 674 . 1 1 63 63 GLU H H 1 8.052 0.020 . 1 . . . . . 63 GLU H . 27259 1 675 . 1 1 63 63 GLU HA H 1 4.082 0.020 . 1 . . . . . 63 GLU HA . 27259 1 676 . 1 1 63 63 GLU HB2 H 1 1.901 0.020 . 1 . . . . . 63 GLU HB2 . 27259 1 677 . 1 1 63 63 GLU HB3 H 1 1.901 0.020 . 1 . . . . . 63 GLU HB3 . 27259 1 678 . 1 1 63 63 GLU HG2 H 1 2.436 0.020 . 2 . . . . . 63 GLU HG2 . 27259 1 679 . 1 1 63 63 GLU HG3 H 1 2.228 0.020 . 2 . . . . . 63 GLU HG3 . 27259 1 680 . 1 1 63 63 GLU C C 13 177.274 0.3 . 1 . . . . . 63 GLU C . 27259 1 681 . 1 1 63 63 GLU CA C 13 58.063 0.3 . 1 . . . . . 63 GLU CA . 27259 1 682 . 1 1 63 63 GLU CB C 13 29.484 0.3 . 1 . . . . . 63 GLU CB . 27259 1 683 . 1 1 63 63 GLU CG C 13 35.618 0.3 . 1 . . . . . 63 GLU CG . 27259 1 684 . 1 1 63 63 GLU N N 15 116.645 0.3 . 1 . . . . . 63 GLU N . 27259 1 685 . 1 1 64 64 ASN H H 1 7.592 0.020 . 1 . . . . . 64 ASN H . 27259 1 686 . 1 1 64 64 ASN HA H 1 4.278 0.020 . 1 . . . . . 64 ASN HA . 27259 1 687 . 1 1 64 64 ASN HB2 H 1 2.169 0.020 . 1 . . . . . 64 ASN HB2 . 27259 1 688 . 1 1 64 64 ASN HB3 H 1 2.169 0.020 . 1 . . . . . 64 ASN HB3 . 27259 1 689 . 1 1 64 64 ASN HD21 H 1 6.688 0.020 . 1 . . . . . 64 ASN HD21 . 27259 1 690 . 1 1 64 64 ASN HD22 H 1 6.578 0.020 . 1 . . . . . 64 ASN HD22 . 27259 1 691 . 1 1 64 64 ASN C C 13 175.379 0.3 . 1 . . . . . 64 ASN C . 27259 1 692 . 1 1 64 64 ASN CA C 13 54.863 0.3 . 1 . . . . . 64 ASN CA . 27259 1 693 . 1 1 64 64 ASN CB C 13 41.008 0.3 . 1 . . . . . 64 ASN CB . 27259 1 694 . 1 1 64 64 ASN N N 15 114.703 0.3 . 1 . . . . . 64 ASN N . 27259 1 695 . 1 1 64 64 ASN ND2 N 15 117.086 0.3 . 1 . . . . . 64 ASN ND2 . 27259 1 696 . 1 1 65 65 MET H H 1 8.100 0.020 . 1 . . . . . 65 MET H . 27259 1 697 . 1 1 65 65 MET HA H 1 3.463 0.020 . 1 . . . . . 65 MET HA . 27259 1 698 . 1 1 65 65 MET HB2 H 1 1.652 0.020 . 2 . . . . . 65 MET HB2 . 27259 1 699 . 1 1 65 65 MET HB3 H 1 1.319 0.020 . 2 . . . . . 65 MET HB3 . 27259 1 700 . 1 1 65 65 MET HG2 H 1 2.561 0.020 . 2 . . . . . 65 MET HG2 . 27259 1 701 . 1 1 65 65 MET HG3 H 1 2.136 0.020 . 2 . . . . . 65 MET HG3 . 27259 1 702 . 1 1 65 65 MET HE1 H 1 2.026 0.020 . 1 . . . . . 65 MET HE . 27259 1 703 . 1 1 65 65 MET HE2 H 1 2.026 0.020 . 1 . . . . . 65 MET HE . 27259 1 704 . 1 1 65 65 MET HE3 H 1 2.026 0.020 . 1 . . . . . 65 MET HE . 27259 1 705 . 1 1 65 65 MET C C 13 176.407 0.3 . 1 . . . . . 65 MET C . 27259 1 706 . 1 1 65 65 MET CA C 13 59.216 0.3 . 1 . . . . . 65 MET CA . 27259 1 707 . 1 1 65 65 MET CB C 13 29.802 0.3 . 1 . . . . . 65 MET CB . 27259 1 708 . 1 1 65 65 MET CG C 13 30.529 0.3 . 1 . . . . . 65 MET CG . 27259 1 709 . 1 1 65 65 MET CE C 13 17.377 0.3 . 1 . . . . . 65 MET CE . 27259 1 710 . 1 1 65 65 MET N N 15 119.702 0.3 . 1 . . . . . 65 MET N . 27259 1 711 . 1 1 66 66 HIS H H 1 8.062 0.020 . 1 . . . . . 66 HIS H . 27259 1 712 . 1 1 66 66 HIS HA H 1 4.236 0.020 . 1 . . . . . 66 HIS HA . 27259 1 713 . 1 1 66 66 HIS HB2 H 1 3.312 0.020 . 2 . . . . . 66 HIS HB2 . 27259 1 714 . 1 1 66 66 HIS HB3 H 1 3.067 0.020 . 2 . . . . . 66 HIS HB3 . 27259 1 715 . 1 1 66 66 HIS HD2 H 1 7.327 0.020 . 1 . . . . . 66 HIS HD2 . 27259 1 716 . 1 1 66 66 HIS C C 13 174.877 0.3 . 1 . . . . . 66 HIS C . 27259 1 717 . 1 1 66 66 HIS CA C 13 57.563 0.3 . 1 . . . . . 66 HIS CA . 27259 1 718 . 1 1 66 66 HIS CB C 13 27.311 0.3 . 1 . . . . . 66 HIS CB . 27259 1 719 . 1 1 66 66 HIS N N 15 115.088 0.3 . 1 . . . . . 66 HIS N . 27259 1 720 . 1 1 67 67 ARG H H 1 7.589 0.020 . 1 . . . . . 67 ARG H . 27259 1 721 . 1 1 67 67 ARG HA H 1 4.133 0.020 . 1 . . . . . 67 ARG HA . 27259 1 722 . 1 1 67 67 ARG HB2 H 1 2.102 0.020 . 2 . . . . . 67 ARG HB2 . 27259 1 723 . 1 1 67 67 ARG HB3 H 1 1.419 0.020 . 2 . . . . . 67 ARG HB3 . 27259 1 724 . 1 1 67 67 ARG HG2 H 1 1.383 0.020 . 2 . . . . . 67 ARG HG2 . 27259 1 725 . 1 1 67 67 ARG HG3 H 1 0.335 0.020 . 2 . . . . . 67 ARG HG3 . 27259 1 726 . 1 1 67 67 ARG HD2 H 1 3.244 0.020 . 2 . . . . . 67 ARG HD2 . 27259 1 727 . 1 1 67 67 ARG HD3 H 1 3.093 0.020 . 2 . . . . . 67 ARG HD3 . 27259 1 728 . 1 1 67 67 ARG HE H 1 7.372 0.020 . 1 . . . . . 67 ARG HE . 27259 1 729 . 1 1 67 67 ARG C C 13 176.407 0.3 . 1 . . . . . 67 ARG C . 27259 1 730 . 1 1 67 67 ARG CA C 13 56.196 0.3 . 1 . . . . . 67 ARG CA . 27259 1 731 . 1 1 67 67 ARG CB C 13 30.410 0.3 . 1 . . . . . 67 ARG CB . 27259 1 732 . 1 1 67 67 ARG CG C 13 26.822 0.3 . 1 . . . . . 67 ARG CG . 27259 1 733 . 1 1 67 67 ARG CD C 13 43.961 0.3 . 1 . . . . . 67 ARG CD . 27259 1 734 . 1 1 67 67 ARG N N 15 118.188 0.3 . 1 . . . . . 67 ARG N . 27259 1 735 . 1 1 67 67 ARG NE N 15 84.100 0.3 . 1 . . . . . 67 ARG NE . 27259 1 736 . 1 1 68 68 TYR H H 1 7.461 0.020 . 1 . . . . . 68 TYR H . 27259 1 737 . 1 1 68 68 TYR HA H 1 5.035 0.020 . 1 . . . . . 68 TYR HA . 27259 1 738 . 1 1 68 68 TYR HB2 H 1 3.127 0.020 . 1 . . . . . 68 TYR HB2 . 27259 1 739 . 1 1 68 68 TYR HB3 H 1 3.127 0.020 . 1 . . . . . 68 TYR HB3 . 27259 1 740 . 1 1 68 68 TYR HD1 H 1 6.822 0.020 . 1 . . . . . 68 TYR HD1 . 27259 1 741 . 1 1 68 68 TYR HD2 H 1 6.822 0.020 . 1 . . . . . 68 TYR HD2 . 27259 1 742 . 1 1 68 68 TYR HE1 H 1 6.572 0.020 . 1 . . . . . 68 TYR HE1 . 27259 1 743 . 1 1 68 68 TYR HE2 H 1 6.572 0.020 . 1 . . . . . 68 TYR HE2 . 27259 1 744 . 1 1 68 68 TYR C C 13 172.800 0.3 . 1 . . . . . 68 TYR C . 27259 1 745 . 1 1 68 68 TYR CA C 13 52.696 0.3 . 1 . . . . . 68 TYR CA . 27259 1 746 . 1 1 68 68 TYR CB C 13 34.833 0.3 . 1 . . . . . 68 TYR CB . 27259 1 747 . 1 1 68 68 TYR N N 15 120.928 0.3 . 1 . . . . . 68 TYR N . 27259 1 748 . 1 1 69 69 PRO HA H 1 4.414 0.020 . 1 . . . . . 69 PRO HA . 27259 1 749 . 1 1 69 69 PRO HB2 H 1 2.478 0.020 . 2 . . . . . 69 PRO HB2 . 27259 1 750 . 1 1 69 69 PRO HB3 H 1 1.687 0.020 . 2 . . . . . 69 PRO HB3 . 27259 1 751 . 1 1 69 69 PRO HG2 H 1 1.561 0.020 . 2 . . . . . 69 PRO HG2 . 27259 1 752 . 1 1 69 69 PRO HG3 H 1 1.411 0.020 . 2 . . . . . 69 PRO HG3 . 27259 1 753 . 1 1 69 69 PRO HD2 H 1 3.319 0.020 . 2 . . . . . 69 PRO HD2 . 27259 1 754 . 1 1 69 69 PRO HD3 H 1 3.128 0.020 . 2 . . . . . 69 PRO HD3 . 27259 1 755 . 1 1 69 69 PRO C C 13 174.877 0.3 . 1 . . . . . 69 PRO C . 27259 1 756 . 1 1 69 69 PRO CA C 13 63.538 0.3 . 1 . . . . . 69 PRO CA . 27259 1 757 . 1 1 69 69 PRO CB C 13 32.240 0.3 . 1 . . . . . 69 PRO CB . 27259 1 758 . 1 1 69 69 PRO CG C 13 27.028 0.3 . 1 . . . . . 69 PRO CG . 27259 1 759 . 1 1 69 69 PRO CD C 13 49.975 0.3 . 1 . . . . . 69 PRO CD . 27259 1 760 . 1 1 70 70 ASN H H 1 8.556 0.020 . 1 . . . . . 70 ASN H . 27259 1 761 . 1 1 70 70 ASN HA H 1 4.734 0.020 . 1 . . . . . 70 ASN HA . 27259 1 762 . 1 1 70 70 ASN HB2 H 1 3.661 0.020 . 2 . . . . . 70 ASN HB2 . 27259 1 763 . 1 1 70 70 ASN HB3 H 1 2.469 0.020 . 2 . . . . . 70 ASN HB3 . 27259 1 764 . 1 1 70 70 ASN HD21 H 1 7.465 0.020 . 1 . . . . . 70 ASN HD21 . 27259 1 765 . 1 1 70 70 ASN HD22 H 1 6.766 0.020 . 1 . . . . . 70 ASN HD22 . 27259 1 766 . 1 1 70 70 ASN C C 13 172.800 0.3 . 1 . . . . . 70 ASN C . 27259 1 767 . 1 1 70 70 ASN CA C 13 51.939 0.3 . 1 . . . . . 70 ASN CA . 27259 1 768 . 1 1 70 70 ASN CB C 13 38.254 0.3 . 1 . . . . . 70 ASN CB . 27259 1 769 . 1 1 70 70 ASN N N 15 116.386 0.3 . 1 . . . . . 70 ASN N . 27259 1 770 . 1 1 70 70 ASN ND2 N 15 109.193 0.3 . 1 . . . . . 70 ASN ND2 . 27259 1 771 . 1 1 71 71 GLN H H 1 7.259 0.020 . 1 . . . . . 71 GLN H . 27259 1 772 . 1 1 71 71 GLN HA H 1 4.553 0.020 . 1 . . . . . 71 GLN HA . 27259 1 773 . 1 1 71 71 GLN HB2 H 1 1.976 0.020 . 2 . . . . . 71 GLN HB2 . 27259 1 774 . 1 1 71 71 GLN HB3 H 1 1.718 0.020 . 2 . . . . . 71 GLN HB3 . 27259 1 775 . 1 1 71 71 GLN HG2 H 1 2.194 0.020 . 1 . . . . . 71 GLN HG2 . 27259 1 776 . 1 1 71 71 GLN HG3 H 1 2.194 0.020 . 1 . . . . . 71 GLN HG3 . 27259 1 777 . 1 1 71 71 GLN HE21 H 1 7.889 0.020 . 1 . . . . . 71 GLN HE21 . 27259 1 778 . 1 1 71 71 GLN HE22 H 1 6.974 0.020 . 1 . . . . . 71 GLN HE22 . 27259 1 779 . 1 1 71 71 GLN C C 13 174.694 0.3 . 1 . . . . . 71 GLN C . 27259 1 780 . 1 1 71 71 GLN CA C 13 54.063 0.3 . 1 . . . . . 71 GLN CA . 27259 1 781 . 1 1 71 71 GLN CB C 13 33.247 0.3 . 1 . . . . . 71 GLN CB . 27259 1 782 . 1 1 71 71 GLN CG C 13 33.831 0.3 . 1 . . . . . 71 GLN CG . 27259 1 783 . 1 1 71 71 GLN N N 15 113.864 0.3 . 1 . . . . . 71 GLN N . 27259 1 784 . 1 1 71 71 GLN NE2 N 15 112.624 0.3 . 1 . . . . . 71 GLN NE2 . 27259 1 785 . 1 1 72 72 VAL H H 1 8.521 0.020 . 1 . . . . . 72 VAL H . 27259 1 786 . 1 1 72 72 VAL HA H 1 4.921 0.020 . 1 . . . . . 72 VAL HA . 27259 1 787 . 1 1 72 72 VAL HB H 1 2.619 0.020 . 1 . . . . . 72 VAL HB . 27259 1 788 . 1 1 72 72 VAL HG11 H 1 0.970 0.020 . 2 . . . . . 72 VAL HG1 . 27259 1 789 . 1 1 72 72 VAL HG12 H 1 0.970 0.020 . 2 . . . . . 72 VAL HG1 . 27259 1 790 . 1 1 72 72 VAL HG13 H 1 0.970 0.020 . 2 . . . . . 72 VAL HG1 . 27259 1 791 . 1 1 72 72 VAL HG21 H 1 0.773 0.020 . 2 . . . . . 72 VAL HG2 . 27259 1 792 . 1 1 72 72 VAL HG22 H 1 0.773 0.020 . 2 . . . . . 72 VAL HG2 . 27259 1 793 . 1 1 72 72 VAL HG23 H 1 0.773 0.020 . 2 . . . . . 72 VAL HG2 . 27259 1 794 . 1 1 72 72 VAL C C 13 173.827 0.3 . 1 . . . . . 72 VAL C . 27259 1 795 . 1 1 72 72 VAL CA C 13 58.696 0.3 . 1 . . . . . 72 VAL CA . 27259 1 796 . 1 1 72 72 VAL CB C 13 33.569 0.3 . 1 . . . . . 72 VAL CB . 27259 1 797 . 1 1 72 72 VAL CG1 C 13 23.456 0.3 . 1 . . . . . 72 VAL CG1 . 27259 1 798 . 1 1 72 72 VAL CG2 C 13 18.330 0.3 . 1 . . . . . 72 VAL CG2 . 27259 1 799 . 1 1 72 72 VAL N N 15 112.853 0.3 . 1 . . . . . 72 VAL N . 27259 1 800 . 1 1 73 73 TYR H H 1 8.500 0.020 . 1 . . . . . 73 TYR H . 27259 1 801 . 1 1 73 73 TYR HA H 1 5.531 0.020 . 1 . . . . . 73 TYR HA . 27259 1 802 . 1 1 73 73 TYR HB2 H 1 2.585 0.020 . 2 . . . . . 73 TYR HB2 . 27259 1 803 . 1 1 73 73 TYR HB3 H 1 2.521 0.020 . 2 . . . . . 73 TYR HB3 . 27259 1 804 . 1 1 73 73 TYR HD1 H 1 6.897 0.020 . 1 . . . . . 73 TYR HD1 . 27259 1 805 . 1 1 73 73 TYR HD2 H 1 6.897 0.020 . 1 . . . . . 73 TYR HD2 . 27259 1 806 . 1 1 73 73 TYR HE1 H 1 6.786 0.020 . 1 . . . . . 73 TYR HE1 . 27259 1 807 . 1 1 73 73 TYR HE2 H 1 6.786 0.020 . 1 . . . . . 73 TYR HE2 . 27259 1 808 . 1 1 73 73 TYR C C 13 174.192 0.3 . 1 . . . . . 73 TYR C . 27259 1 809 . 1 1 73 73 TYR CA C 13 56.863 0.3 . 1 . . . . . 73 TYR CA . 27259 1 810 . 1 1 73 73 TYR CB C 13 41.914 0.3 . 1 . . . . . 73 TYR CB . 27259 1 811 . 1 1 73 73 TYR N N 15 121.317 0.3 . 1 . . . . . 73 TYR N . 27259 1 812 . 1 1 74 74 TYR H H 1 8.582 0.020 . 1 . . . . . 74 TYR H . 27259 1 813 . 1 1 74 74 TYR HA H 1 4.750 0.020 . 1 . . . . . 74 TYR HA . 27259 1 814 . 1 1 74 74 TYR HB2 H 1 2.709 0.020 . 2 . . . . . 74 TYR HB2 . 27259 1 815 . 1 1 74 74 TYR HB3 H 1 2.620 0.020 . 2 . . . . . 74 TYR HB3 . 27259 1 816 . 1 1 74 74 TYR HD1 H 1 6.892 0.020 . 1 . . . . . 74 TYR HD1 . 27259 1 817 . 1 1 74 74 TYR HD2 H 1 6.892 0.020 . 1 . . . . . 74 TYR HD2 . 27259 1 818 . 1 1 74 74 TYR HE1 H 1 6.456 0.020 . 1 . . . . . 74 TYR HE1 . 27259 1 819 . 1 1 74 74 TYR HE2 H 1 6.456 0.020 . 1 . . . . . 74 TYR HE2 . 27259 1 820 . 1 1 74 74 TYR C C 13 172.982 0.3 . 1 . . . . . 74 TYR C . 27259 1 821 . 1 1 74 74 TYR CA C 13 55.521 0.3 . 1 . . . . . 74 TYR CA . 27259 1 822 . 1 1 74 74 TYR CB C 13 40.368 0.3 . 1 . . . . . 74 TYR CB . 27259 1 823 . 1 1 74 74 TYR N N 15 111.011 0.3 . 1 . . . . . 74 TYR N . 27259 1 824 . 1 1 76 76 PRO HA H 1 4.537 0.020 . 1 . . . . . 76 PRO HA . 27259 1 825 . 1 1 76 76 PRO HB2 H 1 2.316 0.020 . 2 . . . . . 76 PRO HB2 . 27259 1 826 . 1 1 76 76 PRO HB3 H 1 1.921 0.020 . 2 . . . . . 76 PRO HB3 . 27259 1 827 . 1 1 76 76 PRO HG2 H 1 2.110 0.020 . 2 . . . . . 76 PRO HG2 . 27259 1 828 . 1 1 76 76 PRO HG3 H 1 1.914 0.020 . 2 . . . . . 76 PRO HG3 . 27259 1 829 . 1 1 76 76 PRO HD2 H 1 3.574 0.020 . 1 . . . . . 76 PRO HD2 . 27259 1 830 . 1 1 76 76 PRO HD3 H 1 3.574 0.020 . 1 . . . . . 76 PRO HD3 . 27259 1 831 . 1 1 76 76 PRO C C 13 177.091 0.3 . 1 . . . . . 76 PRO C . 27259 1 832 . 1 1 76 76 PRO CA C 13 63.139 0.3 . 1 . . . . . 76 PRO CA . 27259 1 833 . 1 1 76 76 PRO CB C 13 32.549 0.3 . 1 . . . . . 76 PRO CB . 27259 1 834 . 1 1 76 76 PRO CG C 13 28.019 0.3 . 1 . . . . . 76 PRO CG . 27259 1 835 . 1 1 76 76 PRO CD C 13 50.433 0.3 . 1 . . . . . 76 PRO CD . 27259 1 836 . 1 1 77 77 MET H H 1 8.903 0.020 . 1 . . . . . 77 MET H . 27259 1 837 . 1 1 77 77 MET HA H 1 4.479 0.020 . 1 . . . . . 77 MET HA . 27259 1 838 . 1 1 77 77 MET HB2 H 1 2.348 0.020 . 1 . . . . . 77 MET HB2 . 27259 1 839 . 1 1 77 77 MET HB3 H 1 2.348 0.020 . 1 . . . . . 77 MET HB3 . 27259 1 840 . 1 1 77 77 MET HG2 H 1 1.840 0.020 . 2 . . . . . 77 MET HG2 . 27259 1 841 . 1 1 77 77 MET HG3 H 1 1.748 0.020 . 2 . . . . . 77 MET HG3 . 27259 1 842 . 1 1 77 77 MET HE1 H 1 1.632 0.020 . 1 . . . . . 77 MET HE . 27259 1 843 . 1 1 77 77 MET HE2 H 1 1.632 0.020 . 1 . . . . . 77 MET HE . 27259 1 844 . 1 1 77 77 MET HE3 H 1 1.632 0.020 . 1 . . . . . 77 MET HE . 27259 1 845 . 1 1 77 77 MET C C 13 176.589 0.3 . 1 . . . . . 77 MET C . 27259 1 846 . 1 1 77 77 MET CA C 13 56.993 0.3 . 1 . . . . . 77 MET CA . 27259 1 847 . 1 1 77 77 MET CB C 13 31.924 0.3 . 1 . . . . . 77 MET CB . 27259 1 848 . 1 1 77 77 MET CG C 13 32.939 0.3 . 1 . . . . . 77 MET CG . 27259 1 849 . 1 1 77 77 MET CE C 13 17.048 0.3 . 1 . . . . . 77 MET CE . 27259 1 850 . 1 1 77 77 MET N N 15 120.823 0.3 . 1 . . . . . 77 MET N . 27259 1 851 . 1 1 78 78 ASP H H 1 8.387 0.020 . 1 . . . . . 78 ASP H . 27259 1 852 . 1 1 78 78 ASP HA H 1 4.494 0.020 . 1 . . . . . 78 ASP HA . 27259 1 853 . 1 1 78 78 ASP HB2 H 1 2.982 0.020 . 1 . . . . . 78 ASP HB2 . 27259 1 854 . 1 1 78 78 ASP HB3 H 1 2.982 0.020 . 1 . . . . . 78 ASP HB3 . 27259 1 855 . 1 1 78 78 ASP C C 13 174.192 0.3 . 1 . . . . . 78 ASP C . 27259 1 856 . 1 1 78 78 ASP CA C 13 55.230 0.3 . 1 . . . . . 78 ASP CA . 27259 1 857 . 1 1 78 78 ASP CB C 13 39.144 0.3 . 1 . . . . . 78 ASP CB . 27259 1 858 . 1 1 78 78 ASP N N 15 118.827 0.3 . 1 . . . . . 78 ASP N . 27259 1 859 . 1 1 79 79 GLU H H 1 8.427 0.020 . 1 . . . . . 79 GLU H . 27259 1 860 . 1 1 79 79 GLU HA H 1 4.493 0.020 . 1 . . . . . 79 GLU HA . 27259 1 861 . 1 1 79 79 GLU CA C 13 53.879 0.3 . 1 . . . . . 79 GLU CA . 27259 1 862 . 1 1 79 79 GLU N N 15 117.057 0.3 . 1 . . . . . 79 GLU N . 27259 1 863 . 1 1 82 82 ASN HA H 1 4.784 0.020 . 1 . . . . . 82 ASN HA . 27259 1 864 . 1 1 82 82 ASN HB2 H 1 3.068 0.020 . 1 . . . . . 82 ASN HB2 . 27259 1 865 . 1 1 82 82 ASN HB3 H 1 3.068 0.020 . 1 . . . . . 82 ASN HB3 . 27259 1 866 . 1 1 82 82 ASN C C 13 174.010 0.3 . 1 . . . . . 82 ASN C . 27259 1 867 . 1 1 82 82 ASN CA C 13 52.189 0.3 . 1 . . . . . 82 ASN CA . 27259 1 868 . 1 1 82 82 ASN CB C 13 39.707 0.3 . 1 . . . . . 82 ASN CB . 27259 1 869 . 1 1 83 83 GLN H H 1 8.659 0.020 . 1 . . . . . 83 GLN H . 27259 1 870 . 1 1 83 83 GLN HA H 1 2.820 0.020 . 1 . . . . . 83 GLN HA . 27259 1 871 . 1 1 83 83 GLN HB2 H 1 1.627 0.020 . 1 . . . . . 83 GLN HB2 . 27259 1 872 . 1 1 83 83 GLN HB3 H 1 1.627 0.020 . 1 . . . . . 83 GLN HB3 . 27259 1 873 . 1 1 83 83 GLN HG2 H 1 1.501 0.020 . 2 . . . . . 83 GLN HG2 . 27259 1 874 . 1 1 83 83 GLN HG3 H 1 1.210 0.020 . 2 . . . . . 83 GLN HG3 . 27259 1 875 . 1 1 83 83 GLN C C 13 176.749 0.3 . 1 . . . . . 83 GLN C . 27259 1 876 . 1 1 83 83 GLN CA C 13 59.532 0.3 . 1 . . . . . 83 GLN CA . 27259 1 877 . 1 1 83 83 GLN CB C 13 28.825 0.3 . 1 . . . . . 83 GLN CB . 27259 1 878 . 1 1 83 83 GLN CG C 13 33.408 0.3 . 1 . . . . . 83 GLN CG . 27259 1 879 . 1 1 83 83 GLN N N 15 120.176 0.3 . 1 . . . . . 83 GLN N . 27259 1 880 . 1 1 83 83 GLN NE2 N 15 113.753 0.3 . 1 . . . . . 83 GLN NE2 . 27259 1 881 . 1 1 84 84 ASN H H 1 8.349 0.020 . 1 . . . . . 84 ASN H . 27259 1 882 . 1 1 84 84 ASN HA H 1 4.269 0.020 . 1 . . . . . 84 ASN HA . 27259 1 883 . 1 1 84 84 ASN HB2 H 1 2.761 0.020 . 2 . . . . . 84 ASN HB2 . 27259 1 884 . 1 1 84 84 ASN HB3 H 1 2.694 0.020 . 2 . . . . . 84 ASN HB3 . 27259 1 885 . 1 1 84 84 ASN HD21 H 1 7.590 0.020 . 1 . . . . . 84 ASN HD21 . 27259 1 886 . 1 1 84 84 ASN HD22 H 1 6.892 0.020 . 1 . . . . . 84 ASN HD22 . 27259 1 887 . 1 1 84 84 ASN C C 13 177.799 0.3 . 1 . . . . . 84 ASN C . 27259 1 888 . 1 1 84 84 ASN CA C 13 56.563 0.3 . 1 . . . . . 84 ASN CA . 27259 1 889 . 1 1 84 84 ASN CB C 13 38.004 0.3 . 1 . . . . . 84 ASN CB . 27259 1 890 . 1 1 84 84 ASN N N 15 116.685 0.3 . 1 . . . . . 84 ASN N . 27259 1 891 . 1 1 84 84 ASN ND2 N 15 112.686 0.3 . 1 . . . . . 84 ASN ND2 . 27259 1 892 . 1 1 85 85 ASN H H 1 8.674 0.020 . 1 . . . . . 85 ASN H . 27259 1 893 . 1 1 85 85 ASN HA H 1 4.570 0.020 . 1 . . . . . 85 ASN HA . 27259 1 894 . 1 1 85 85 ASN HB2 H 1 3.044 0.020 . 2 . . . . . 85 ASN HB2 . 27259 1 895 . 1 1 85 85 ASN HB3 H 1 2.944 0.020 . 2 . . . . . 85 ASN HB3 . 27259 1 896 . 1 1 85 85 ASN HD21 H 1 7.662 0.020 . 1 . . . . . 85 ASN HD21 . 27259 1 897 . 1 1 85 85 ASN HD22 H 1 6.775 0.020 . 1 . . . . . 85 ASN HD22 . 27259 1 898 . 1 1 85 85 ASN C C 13 177.251 0.3 . 1 . . . . . 85 ASN C . 27259 1 899 . 1 1 85 85 ASN CA C 13 55.944 0.3 . 1 . . . . . 85 ASN CA . 27259 1 900 . 1 1 85 85 ASN CB C 13 37.586 0.3 . 1 . . . . . 85 ASN CB . 27259 1 901 . 1 1 85 85 ASN N N 15 118.495 0.3 . 1 . . . . . 85 ASN N . 27259 1 902 . 1 1 86 86 PHE C C 13 178.301 0.3 . 1 . . . . . 86 PHE C . 27259 1 903 . 1 1 86 86 PHE CA C 13 60.996 0.3 . 1 . . . . . 86 PHE CA . 27259 1 904 . 1 1 87 87 VAL H H 1 8.968 0.020 . 1 . . . . . 87 VAL H . 27259 1 905 . 1 1 87 87 VAL HA H 1 3.532 0.020 . 1 . . . . . 87 VAL HA . 27259 1 906 . 1 1 87 87 VAL HB H 1 2.241 0.020 . 1 . . . . . 87 VAL HB . 27259 1 907 . 1 1 87 87 VAL HG11 H 1 1.098 0.020 . 2 . . . . . 87 VAL HG1 . 27259 1 908 . 1 1 87 87 VAL HG12 H 1 1.098 0.020 . 2 . . . . . 87 VAL HG1 . 27259 1 909 . 1 1 87 87 VAL HG13 H 1 1.098 0.020 . 2 . . . . . 87 VAL HG1 . 27259 1 910 . 1 1 87 87 VAL HG21 H 1 1.048 0.020 . 2 . . . . . 87 VAL HG2 . 27259 1 911 . 1 1 87 87 VAL HG22 H 1 1.048 0.020 . 2 . . . . . 87 VAL HG2 . 27259 1 912 . 1 1 87 87 VAL HG23 H 1 1.048 0.020 . 2 . . . . . 87 VAL HG2 . 27259 1 913 . 1 1 87 87 VAL C C 13 176.749 0.3 . 1 . . . . . 87 VAL C . 27259 1 914 . 1 1 87 87 VAL CA C 13 67.762 0.3 . 1 . . . . . 87 VAL CA . 27259 1 915 . 1 1 87 87 VAL CB C 13 31.662 0.3 . 1 . . . . . 87 VAL CB . 27259 1 916 . 1 1 87 87 VAL CG1 C 13 24.724 0.3 . 1 . . . . . 87 VAL CG1 . 27259 1 917 . 1 1 87 87 VAL CG2 C 13 21.757 0.3 . 1 . . . . . 87 VAL CG2 . 27259 1 918 . 1 1 87 87 VAL N N 15 120.478 0.3 . 1 . . . . . 87 VAL N . 27259 1 919 . 1 1 88 88 HIS H H 1 8.319 0.020 . 1 . . . . . 88 HIS H . 27259 1 920 . 1 1 88 88 HIS HA H 1 4.313 0.020 . 1 . . . . . 88 HIS HA . 27259 1 921 . 1 1 88 88 HIS HB2 H 1 3.404 0.020 . 2 . . . . . 88 HIS HB2 . 27259 1 922 . 1 1 88 88 HIS HB3 H 1 3.327 0.020 . 2 . . . . . 88 HIS HB3 . 27259 1 923 . 1 1 88 88 HIS CA C 13 59.463 0.3 . 1 . . . . . 88 HIS CA . 27259 1 924 . 1 1 88 88 HIS CB C 13 28.316 0.3 . 1 . . . . . 88 HIS CB . 27259 1 925 . 1 1 88 88 HIS N N 15 116.759 0.3 . 1 . . . . . 88 HIS N . 27259 1 926 . 1 1 89 89 ASP H H 1 7.751 0.020 . 1 . . . . . 89 ASP H . 27259 1 927 . 1 1 89 89 ASP HA H 1 4.567 0.020 . 1 . . . . . 89 ASP HA . 27259 1 928 . 1 1 89 89 ASP HB2 H 1 2.969 0.020 . 2 . . . . . 89 ASP HB2 . 27259 1 929 . 1 1 89 89 ASP HB3 H 1 2.765 0.020 . 2 . . . . . 89 ASP HB3 . 27259 1 930 . 1 1 89 89 ASP C C 13 175.904 0.3 . 1 . . . . . 89 ASP C . 27259 1 931 . 1 1 89 89 ASP CA C 13 57.264 0.3 . 1 . . . . . 89 ASP CA . 27259 1 932 . 1 1 89 89 ASP CB C 13 40.833 0.3 . 1 . . . . . 89 ASP CB . 27259 1 933 . 1 1 89 89 ASP N N 15 118.646 0.3 . 1 . . . . . 89 ASP N . 27259 1 934 . 1 1 90 90 CYS H H 1 8.073 0.020 . 1 . . . . . 90 CYS H . 27259 1 935 . 1 1 90 90 CYS HA H 1 4.720 0.020 . 1 . . . . . 90 CYS HA . 27259 1 936 . 1 1 90 90 CYS HB2 H 1 3.353 0.020 . 2 . . . . . 90 CYS HB2 . 27259 1 937 . 1 1 90 90 CYS HB3 H 1 2.969 0.020 . 2 . . . . . 90 CYS HB3 . 27259 1 938 . 1 1 90 90 CYS C C 13 177.091 0.3 . 1 . . . . . 90 CYS C . 27259 1 939 . 1 1 90 90 CYS CA C 13 58.563 0.3 . 1 . . . . . 90 CYS CA . 27259 1 940 . 1 1 90 90 CYS CB C 13 40.328 0.3 . 1 . . . . . 90 CYS CB . 27259 1 941 . 1 1 90 90 CYS N N 15 119.307 0.3 . 1 . . . . . 90 CYS N . 27259 1 942 . 1 1 91 91 VAL H H 1 9.106 0.020 . 1 . . . . . 91 VAL H . 27259 1 943 . 1 1 91 91 VAL HA H 1 3.650 0.020 . 1 . . . . . 91 VAL HA . 27259 1 944 . 1 1 91 91 VAL HB H 1 2.219 0.020 . 1 . . . . . 91 VAL HB . 27259 1 945 . 1 1 91 91 VAL HG11 H 1 1.093 0.020 . 2 . . . . . 91 VAL HG1 . 27259 1 946 . 1 1 91 91 VAL HG12 H 1 1.093 0.020 . 2 . . . . . 91 VAL HG1 . 27259 1 947 . 1 1 91 91 VAL HG13 H 1 1.093 0.020 . 2 . . . . . 91 VAL HG1 . 27259 1 948 . 1 1 91 91 VAL HG21 H 1 0.977 0.020 . 2 . . . . . 91 VAL HG2 . 27259 1 949 . 1 1 91 91 VAL HG22 H 1 0.977 0.020 . 2 . . . . . 91 VAL HG2 . 27259 1 950 . 1 1 91 91 VAL HG23 H 1 0.977 0.020 . 2 . . . . . 91 VAL HG2 . 27259 1 951 . 1 1 91 91 VAL C C 13 177.091 0.3 . 1 . . . . . 91 VAL C . 27259 1 952 . 1 1 91 91 VAL CA C 13 66.113 0.3 . 1 . . . . . 91 VAL CA . 27259 1 953 . 1 1 91 91 VAL CB C 13 31.650 0.3 . 1 . . . . . 91 VAL CB . 27259 1 954 . 1 1 91 91 VAL CG1 C 13 22.733 0.3 . 1 . . . . . 91 VAL CG1 . 27259 1 955 . 1 1 91 91 VAL CG2 C 13 21.565 0.3 . 1 . . . . . 91 VAL CG2 . 27259 1 956 . 1 1 91 91 VAL N N 15 124.941 0.3 . 1 . . . . . 91 VAL N . 27259 1 957 . 1 1 92 92 ASN H H 1 7.623 0.020 . 1 . . . . . 92 ASN H . 27259 1 958 . 1 1 92 92 ASN HA H 1 4.326 0.020 . 1 . . . . . 92 ASN HA . 27259 1 959 . 1 1 92 92 ASN HB2 H 1 2.861 0.020 . 2 . . . . . 92 ASN HB2 . 27259 1 960 . 1 1 92 92 ASN HB3 H 1 2.786 0.020 . 2 . . . . . 92 ASN HB3 . 27259 1 961 . 1 1 92 92 ASN HD21 H 1 7.668 0.020 . 1 . . . . . 92 ASN HD21 . 27259 1 962 . 1 1 92 92 ASN HD22 H 1 7.102 0.020 . 1 . . . . . 92 ASN HD22 . 27259 1 963 . 1 1 92 92 ASN C C 13 178.301 0.3 . 1 . . . . . 92 ASN C . 27259 1 964 . 1 1 92 92 ASN CA C 13 56.563 0.3 . 1 . . . . . 92 ASN CA . 27259 1 965 . 1 1 92 92 ASN CB C 13 38.588 0.3 . 1 . . . . . 92 ASN CB . 27259 1 966 . 1 1 92 92 ASN N N 15 116.317 0.3 . 1 . . . . . 92 ASN N . 27259 1 967 . 1 1 92 92 ASN ND2 N 15 112.363 0.3 . 1 . . . . . 92 ASN ND2 . 27259 1 968 . 1 1 93 93 ILE H H 1 8.707 0.020 . 1 . . . . . 93 ILE H . 27259 1 969 . 1 1 93 93 ILE HA H 1 3.728 0.020 . 1 . . . . . 93 ILE HA . 27259 1 970 . 1 1 93 93 ILE HB H 1 1.527 0.020 . 1 . . . . . 93 ILE HB . 27259 1 971 . 1 1 93 93 ILE HG12 H 1 0.914 0.020 . 2 . . . . . 93 ILE HG12 . 27259 1 972 . 1 1 93 93 ILE HG13 H 1 0.800 0.020 . 2 . . . . . 93 ILE HG13 . 27259 1 973 . 1 1 93 93 ILE HG21 H 1 0.253 0.020 . 1 . . . . . 93 ILE HG2 . 27259 1 974 . 1 1 93 93 ILE HG22 H 1 0.253 0.020 . 1 . . . . . 93 ILE HG2 . 27259 1 975 . 1 1 93 93 ILE HG23 H 1 0.253 0.020 . 1 . . . . . 93 ILE HG2 . 27259 1 976 . 1 1 93 93 ILE HD11 H 1 0.430 0.020 . 1 . . . . . 93 ILE HD1 . 27259 1 977 . 1 1 93 93 ILE HD12 H 1 0.430 0.020 . 1 . . . . . 93 ILE HD1 . 27259 1 978 . 1 1 93 93 ILE HD13 H 1 0.430 0.020 . 1 . . . . . 93 ILE HD1 . 27259 1 979 . 1 1 93 93 ILE C C 13 177.799 0.3 . 1 . . . . . 93 ILE C . 27259 1 980 . 1 1 93 93 ILE CA C 13 62.563 0.3 . 1 . . . . . 93 ILE CA . 27259 1 981 . 1 1 93 93 ILE CB C 13 36.657 0.3 . 1 . . . . . 93 ILE CB . 27259 1 982 . 1 1 93 93 ILE CG1 C 13 27.456 0.3 . 1 . . . . . 93 ILE CG1 . 27259 1 983 . 1 1 93 93 ILE CG2 C 13 18.221 0.3 . 1 . . . . . 93 ILE CG2 . 27259 1 984 . 1 1 93 93 ILE CD1 C 13 11.773 0.3 . 1 . . . . . 93 ILE CD1 . 27259 1 985 . 1 1 93 93 ILE N N 15 118.615 0.3 . 1 . . . . . 93 ILE N . 27259 1 986 . 1 1 94 94 THR H H 1 8.175 0.020 . 1 . . . . . 94 THR H . 27259 1 987 . 1 1 94 94 THR HA H 1 4.069 0.020 . 1 . . . . . 94 THR HA . 27259 1 988 . 1 1 94 94 THR HB H 1 4.487 0.020 . 1 . . . . . 94 THR HB . 27259 1 989 . 1 1 94 94 THR HG21 H 1 1.427 0.020 . 1 . . . . . 94 THR HG2 . 27259 1 990 . 1 1 94 94 THR HG22 H 1 1.427 0.020 . 1 . . . . . 94 THR HG2 . 27259 1 991 . 1 1 94 94 THR HG23 H 1 1.427 0.020 . 1 . . . . . 94 THR HG2 . 27259 1 992 . 1 1 94 94 THR C C 13 177.274 0.3 . 1 . . . . . 94 THR C . 27259 1 993 . 1 1 94 94 THR CA C 13 68.829 0.3 . 1 . . . . . 94 THR CA . 27259 1 994 . 1 1 94 94 THR CB C 13 67.960 0.3 . 1 . . . . . 94 THR CB . 27259 1 995 . 1 1 94 94 THR CG2 C 13 21.194 0.3 . 1 . . . . . 94 THR CG2 . 27259 1 996 . 1 1 94 94 THR N N 15 118.008 0.3 . 1 . . . . . 94 THR N . 27259 1 997 . 1 1 95 95 ILE H H 1 8.519 0.020 . 1 . . . . . 95 ILE H . 27259 1 998 . 1 1 95 95 ILE HA H 1 3.709 0.020 . 1 . . . . . 95 ILE HA . 27259 1 999 . 1 1 95 95 ILE HB H 1 2.106 0.020 . 1 . . . . . 95 ILE HB . 27259 1 1000 . 1 1 95 95 ILE HG12 H 1 1.831 0.020 . 2 . . . . . 95 ILE HG12 . 27259 1 1001 . 1 1 95 95 ILE HG13 H 1 1.229 0.020 . 2 . . . . . 95 ILE HG13 . 27259 1 1002 . 1 1 95 95 ILE HG21 H 1 0.889 0.020 . 1 . . . . . 95 ILE HG2 . 27259 1 1003 . 1 1 95 95 ILE HG22 H 1 0.889 0.020 . 1 . . . . . 95 ILE HG2 . 27259 1 1004 . 1 1 95 95 ILE HG23 H 1 0.889 0.020 . 1 . . . . . 95 ILE HG2 . 27259 1 1005 . 1 1 95 95 ILE HD11 H 1 0.776 0.020 . 1 . . . . . 95 ILE HD1 . 27259 1 1006 . 1 1 95 95 ILE HD12 H 1 0.776 0.020 . 1 . . . . . 95 ILE HD1 . 27259 1 1007 . 1 1 95 95 ILE HD13 H 1 0.776 0.020 . 1 . . . . . 95 ILE HD1 . 27259 1 1008 . 1 1 95 95 ILE C C 13 178.826 0.3 . 1 . . . . . 95 ILE C . 27259 1 1009 . 1 1 95 95 ILE CA C 13 65.596 0.3 . 1 . . . . . 95 ILE CA . 27259 1 1010 . 1 1 95 95 ILE CB C 13 36.585 0.3 . 1 . . . . . 95 ILE CB . 27259 1 1011 . 1 1 95 95 ILE CG1 C 13 29.601 0.3 . 1 . . . . . 95 ILE CG1 . 27259 1 1012 . 1 1 95 95 ILE CG2 C 13 16.715 0.3 . 1 . . . . . 95 ILE CG2 . 27259 1 1013 . 1 1 95 95 ILE CD1 C 13 12.887 0.3 . 1 . . . . . 95 ILE CD1 . 27259 1 1014 . 1 1 95 95 ILE N N 15 120.812 0.3 . 1 . . . . . 95 ILE N . 27259 1 1015 . 1 1 96 96 LYS HA H 1 4.085 0.020 . 1 . . . . . 96 LYS HA . 27259 1 1016 . 1 1 96 96 LYS HB2 H 1 1.914 0.020 . 2 . . . . . 96 LYS HB2 . 27259 1 1017 . 1 1 96 96 LYS HB3 H 1 1.863 0.020 . 2 . . . . . 96 LYS HB3 . 27259 1 1018 . 1 1 96 96 LYS HG2 H 1 1.486 0.020 . 2 . . . . . 96 LYS HG2 . 27259 1 1019 . 1 1 96 96 LYS HG3 H 1 1.386 0.020 . 2 . . . . . 96 LYS HG3 . 27259 1 1020 . 1 1 96 96 LYS HD2 H 1 1.610 0.020 . 1 . . . . . 96 LYS HD2 . 27259 1 1021 . 1 1 96 96 LYS HD3 H 1 1.610 0.020 . 1 . . . . . 96 LYS HD3 . 27259 1 1022 . 1 1 96 96 LYS HE2 H 1 2.921 0.020 . 1 . . . . . 96 LYS HE2 . 27259 1 1023 . 1 1 96 96 LYS HE3 H 1 2.921 0.020 . 1 . . . . . 96 LYS HE3 . 27259 1 1024 . 1 1 96 96 LYS C C 13 178.826 0.3 . 1 . . . . . 96 LYS C . 27259 1 1025 . 1 1 96 96 LYS CA C 13 59.963 0.3 . 1 . . . . . 96 LYS CA . 27259 1 1026 . 1 1 96 96 LYS CB C 13 31.959 0.3 . 1 . . . . . 96 LYS CB . 27259 1 1027 . 1 1 96 96 LYS CG C 13 24.895 0.3 . 1 . . . . . 96 LYS CG . 27259 1 1028 . 1 1 96 96 LYS CD C 13 28.725 0.3 . 1 . . . . . 96 LYS CD . 27259 1 1029 . 1 1 96 96 LYS CE C 13 41.901 0.3 . 1 . . . . . 96 LYS CE . 27259 1 1030 . 1 1 97 97 GLN H H 1 8.334 0.020 . 1 . . . . . 97 GLN H . 27259 1 1031 . 1 1 97 97 GLN HA H 1 4.053 0.020 . 1 . . . . . 97 GLN HA . 27259 1 1032 . 1 1 97 97 GLN HB2 H 1 1.978 0.020 . 2 . . . . . 97 GLN HB2 . 27259 1 1033 . 1 1 97 97 GLN HB3 H 1 1.864 0.020 . 2 . . . . . 97 GLN HB3 . 27259 1 1034 . 1 1 97 97 GLN HG2 H 1 2.070 0.020 . 2 . . . . . 97 GLN HG2 . 27259 1 1035 . 1 1 97 97 GLN HG3 H 1 1.553 0.020 . 2 . . . . . 97 GLN HG3 . 27259 1 1036 . 1 1 97 97 GLN HE21 H 1 6.690 0.020 . 1 . . . . . 97 GLN HE21 . 27259 1 1037 . 1 1 97 97 GLN HE22 H 1 6.674 0.020 . 1 . . . . . 97 GLN HE22 . 27259 1 1038 . 1 1 97 97 GLN C C 13 177.959 0.3 . 1 . . . . . 97 GLN C . 27259 1 1039 . 1 1 97 97 GLN CA C 13 57.696 0.3 . 1 . . . . . 97 GLN CA . 27259 1 1040 . 1 1 97 97 GLN CB C 13 27.907 0.3 . 1 . . . . . 97 GLN CB . 27259 1 1041 . 1 1 97 97 GLN CG C 13 33.247 0.3 . 1 . . . . . 97 GLN CG . 27259 1 1042 . 1 1 97 97 GLN N N 15 116.498 0.3 . 1 . . . . . 97 GLN N . 27259 1 1043 . 1 1 97 97 GLN NE2 N 15 110.050 0.3 . 1 . . . . . 97 GLN NE2 . 27259 1 1044 . 1 1 98 98 HIS H H 1 8.158 0.020 . 1 . . . . . 98 HIS H . 27259 1 1045 . 1 1 98 98 HIS HA H 1 4.603 0.020 . 1 . . . . . 98 HIS HA . 27259 1 1046 . 1 1 98 98 HIS HB2 H 1 3.331 0.020 . 2 . . . . . 98 HIS HB2 . 27259 1 1047 . 1 1 98 98 HIS HB3 H 1 3.269 0.020 . 2 . . . . . 98 HIS HB3 . 27259 1 1048 . 1 1 98 98 HIS HD2 H 1 7.123 0.020 . 1 . . . . . 98 HIS HD2 . 27259 1 1049 . 1 1 98 98 HIS C C 13 176.932 0.3 . 1 . . . . . 98 HIS C . 27259 1 1050 . 1 1 98 98 HIS CA C 13 58.830 0.3 . 1 . . . . . 98 HIS CA . 27259 1 1051 . 1 1 98 98 HIS CB C 13 30.410 0.3 . 1 . . . . . 98 HIS CB . 27259 1 1052 . 1 1 98 98 HIS N N 15 117.977 0.3 . 1 . . . . . 98 HIS N . 27259 1 1053 . 1 1 99 99 THR H H 1 8.230 0.020 . 1 . . . . . 99 THR H . 27259 1 1054 . 1 1 99 99 THR HA H 1 4.186 0.020 . 1 . . . . . 99 THR HA . 27259 1 1055 . 1 1 99 99 THR HB H 1 4.450 0.020 . 1 . . . . . 99 THR HB . 27259 1 1056 . 1 1 99 99 THR HG21 H 1 1.210 0.020 . 1 . . . . . 99 THR HG2 . 27259 1 1057 . 1 1 99 99 THR HG22 H 1 1.210 0.020 . 1 . . . . . 99 THR HG2 . 27259 1 1058 . 1 1 99 99 THR HG23 H 1 1.210 0.020 . 1 . . . . . 99 THR HG2 . 27259 1 1059 . 1 1 99 99 THR C C 13 175.722 0.3 . 1 . . . . . 99 THR C . 27259 1 1060 . 1 1 99 99 THR CA C 13 65.229 0.3 . 1 . . . . . 99 THR CA . 27259 1 1061 . 1 1 99 99 THR CB C 13 68.962 0.3 . 1 . . . . . 99 THR CB . 27259 1 1062 . 1 1 99 99 THR CG2 C 13 20.994 0.3 . 1 . . . . . 99 THR CG2 . 27259 1 1063 . 1 1 99 99 THR N N 15 113.928 0.3 . 1 . . . . . 99 THR N . 27259 1 1064 . 1 1 100 100 VAL H H 1 7.986 0.020 . 1 . . . . . 100 VAL H . 27259 1 1065 . 1 1 100 100 VAL HA H 1 4.003 0.020 . 1 . . . . . 100 VAL HA . 27259 1 1066 . 1 1 100 100 VAL HB H 1 2.219 0.020 . 1 . . . . . 100 VAL HB . 27259 1 1067 . 1 1 100 100 VAL HG11 H 1 1.034 0.020 . 2 . . . . . 100 VAL HG1 . 27259 1 1068 . 1 1 100 100 VAL HG12 H 1 1.034 0.020 . 2 . . . . . 100 VAL HG1 . 27259 1 1069 . 1 1 100 100 VAL HG13 H 1 1.034 0.020 . 2 . . . . . 100 VAL HG1 . 27259 1 1070 . 1 1 100 100 VAL HG21 H 1 0.959 0.020 . 2 . . . . . 100 VAL HG2 . 27259 1 1071 . 1 1 100 100 VAL HG22 H 1 0.959 0.020 . 2 . . . . . 100 VAL HG2 . 27259 1 1072 . 1 1 100 100 VAL HG23 H 1 0.959 0.020 . 2 . . . . . 100 VAL HG2 . 27259 1 1073 . 1 1 100 100 VAL C C 13 177.616 0.3 . 1 . . . . . 100 VAL C . 27259 1 1074 . 1 1 100 100 VAL CA C 13 65.074 0.3 . 1 . . . . . 100 VAL CA . 27259 1 1075 . 1 1 100 100 VAL CB C 13 31.996 0.3 . 1 . . . . . 100 VAL CB . 27259 1 1076 . 1 1 100 100 VAL CG1 C 13 20.994 0.3 . 1 . . . . . 100 VAL CG1 . 27259 1 1077 . 1 1 100 100 VAL CG2 C 13 20.760 0.3 . 1 . . . . . 100 VAL CG2 . 27259 1 1078 . 1 1 100 100 VAL N N 15 122.179 0.3 . 1 . . . . . 100 VAL N . 27259 1 1079 . 1 1 101 101 THR H H 1 8.065 0.020 . 1 . . . . . 101 THR H . 27259 1 1080 . 1 1 101 101 THR HA H 1 4.239 0.020 . 1 . . . . . 101 THR HA . 27259 1 1081 . 1 1 101 101 THR HB H 1 4.293 0.020 . 1 . . . . . 101 THR HB . 27259 1 1082 . 1 1 101 101 THR HG21 H 1 1.212 0.020 . 1 . . . . . 101 THR HG2 . 27259 1 1083 . 1 1 101 101 THR HG22 H 1 1.212 0.020 . 1 . . . . . 101 THR HG2 . 27259 1 1084 . 1 1 101 101 THR HG23 H 1 1.212 0.020 . 1 . . . . . 101 THR HG2 . 27259 1 1085 . 1 1 101 101 THR C C 13 175.904 0.3 . 1 . . . . . 101 THR C . 27259 1 1086 . 1 1 101 101 THR CA C 13 64.163 0.3 . 1 . . . . . 101 THR CA . 27259 1 1087 . 1 1 101 101 THR CB C 13 69.230 0.3 . 1 . . . . . 101 THR CB . 27259 1 1088 . 1 1 101 101 THR CG2 C 13 21.539 0.3 . 1 . . . . . 101 THR CG2 . 27259 1 1089 . 1 1 101 101 THR N N 15 115.178 0.3 . 1 . . . . . 101 THR N . 27259 1 1090 . 1 1 102 102 THR H H 1 8.000 0.020 . 1 . . . . . 102 THR H . 27259 1 1091 . 1 1 102 102 THR HA H 1 4.218 0.020 . 1 . . . . . 102 THR HA . 27259 1 1092 . 1 1 102 102 THR HB H 1 4.178 0.020 . 1 . . . . . 102 THR HB . 27259 1 1093 . 1 1 102 102 THR HG21 H 1 0.986 0.020 . 1 . . . . . 102 THR HG2 . 27259 1 1094 . 1 1 102 102 THR HG22 H 1 0.986 0.020 . 1 . . . . . 102 THR HG2 . 27259 1 1095 . 1 1 102 102 THR HG23 H 1 0.986 0.020 . 1 . . . . . 102 THR HG2 . 27259 1 1096 . 1 1 102 102 THR C C 13 176.064 0.3 . 1 . . . . . 102 THR C . 27259 1 1097 . 1 1 102 102 THR CA C 13 64.029 0.3 . 1 . . . . . 102 THR CA . 27259 1 1098 . 1 1 102 102 THR CB C 13 69.045 0.3 . 1 . . . . . 102 THR CB . 27259 1 1099 . 1 1 102 102 THR CG2 C 13 20.994 0.3 . 1 . . . . . 102 THR CG2 . 27259 1 1100 . 1 1 102 102 THR N N 15 114.885 0.3 . 1 . . . . . 102 THR N . 27259 1 1101 . 1 1 103 103 THR H H 1 8.176 0.020 . 1 . . . . . 103 THR H . 27259 1 1102 . 1 1 103 103 THR HA H 1 4.391 0.020 . 1 . . . . . 103 THR HA . 27259 1 1103 . 1 1 103 103 THR HB H 1 4.377 0.020 . 1 . . . . . 103 THR HB . 27259 1 1104 . 1 1 103 103 THR HG21 H 1 1.289 0.020 . 1 . . . . . 103 THR HG2 . 27259 1 1105 . 1 1 103 103 THR HG22 H 1 1.289 0.020 . 1 . . . . . 103 THR HG2 . 27259 1 1106 . 1 1 103 103 THR HG23 H 1 1.289 0.020 . 1 . . . . . 103 THR HG2 . 27259 1 1107 . 1 1 103 103 THR C C 13 176.658 0.3 . 1 . . . . . 103 THR C . 27259 1 1108 . 1 1 103 103 THR CA C 13 64.122 0.3 . 1 . . . . . 103 THR CA . 27259 1 1109 . 1 1 103 103 THR CB C 13 69.062 0.3 . 1 . . . . . 103 THR CB . 27259 1 1110 . 1 1 103 103 THR CG2 C 13 20.994 0.3 . 1 . . . . . 103 THR CG2 . 27259 1 1111 . 1 1 103 103 THR N N 15 116.779 0.3 . 1 . . . . . 103 THR N . 27259 1 1112 . 1 1 104 104 THR H H 1 7.919 0.020 . 1 . . . . . 104 THR H . 27259 1 1113 . 1 1 104 104 THR HA H 1 4.253 0.020 . 1 . . . . . 104 THR HA . 27259 1 1114 . 1 1 104 104 THR HB H 1 4.307 0.020 . 1 . . . . . 104 THR HB . 27259 1 1115 . 1 1 104 104 THR HG21 H 1 1.285 0.020 . 1 . . . . . 104 THR HG2 . 27259 1 1116 . 1 1 104 104 THR HG22 H 1 1.285 0.020 . 1 . . . . . 104 THR HG2 . 27259 1 1117 . 1 1 104 104 THR HG23 H 1 1.285 0.020 . 1 . . . . . 104 THR HG2 . 27259 1 1118 . 1 1 104 104 THR C C 13 174.877 0.3 . 1 . . . . . 104 THR C . 27259 1 1119 . 1 1 104 104 THR CA C 13 63.829 0.3 . 1 . . . . . 104 THR CA . 27259 1 1120 . 1 1 104 104 THR CB C 13 69.045 0.3 . 1 . . . . . 104 THR CB . 27259 1 1121 . 1 1 104 104 THR CG2 C 13 21.539 0.3 . 1 . . . . . 104 THR CG2 . 27259 1 1122 . 1 1 104 104 THR N N 15 116.175 0.3 . 1 . . . . . 104 THR N . 27259 1 1123 . 1 1 105 105 LYS H H 1 7.810 0.020 . 1 . . . . . 105 LYS H . 27259 1 1124 . 1 1 105 105 LYS HA H 1 4.365 0.020 . 1 . . . . . 105 LYS HA . 27259 1 1125 . 1 1 105 105 LYS HB2 H 1 1.970 0.020 . 2 . . . . . 105 LYS HB2 . 27259 1 1126 . 1 1 105 105 LYS HB3 H 1 1.864 0.020 . 2 . . . . . 105 LYS HB3 . 27259 1 1127 . 1 1 105 105 LYS HG2 H 1 1.530 0.020 . 2 . . . . . 105 LYS HG2 . 27259 1 1128 . 1 1 105 105 LYS HG3 H 1 1.470 0.020 . 2 . . . . . 105 LYS HG3 . 27259 1 1129 . 1 1 105 105 LYS HD2 H 1 1.697 0.020 . 1 . . . . . 105 LYS HD2 . 27259 1 1130 . 1 1 105 105 LYS HD3 H 1 1.697 0.020 . 1 . . . . . 105 LYS HD3 . 27259 1 1131 . 1 1 105 105 LYS HE2 H 1 2.935 0.020 . 1 . . . . . 105 LYS HE2 . 27259 1 1132 . 1 1 105 105 LYS HE3 H 1 2.935 0.020 . 1 . . . . . 105 LYS HE3 . 27259 1 1133 . 1 1 105 105 LYS C C 13 176.749 0.3 . 1 . . . . . 105 LYS C . 27259 1 1134 . 1 1 105 105 LYS CA C 13 56.445 0.3 . 1 . . . . . 105 LYS CA . 27259 1 1135 . 1 1 105 105 LYS CB C 13 32.329 0.3 . 1 . . . . . 105 LYS CB . 27259 1 1136 . 1 1 105 105 LYS CG C 13 24.495 0.3 . 1 . . . . . 105 LYS CG . 27259 1 1137 . 1 1 105 105 LYS CD C 13 28.617 0.3 . 1 . . . . . 105 LYS CD . 27259 1 1138 . 1 1 105 105 LYS CE C 13 42.041 0.3 . 1 . . . . . 105 LYS CE . 27259 1 1139 . 1 1 105 105 LYS N N 15 121.033 0.3 . 1 . . . . . 105 LYS N . 27259 1 1140 . 1 1 106 106 GLY H H 1 8.098 0.020 . 1 . . . . . 106 GLY H . 27259 1 1141 . 1 1 106 106 GLY HA2 H 1 4.096 0.020 . 2 . . . . . 106 GLY HA2 . 27259 1 1142 . 1 1 106 106 GLY HA3 H 1 3.839 0.020 . 2 . . . . . 106 GLY HA3 . 27259 1 1143 . 1 1 106 106 GLY C C 13 174.010 0.3 . 1 . . . . . 106 GLY C . 27259 1 1144 . 1 1 106 106 GLY CA C 13 45.463 0.3 . 1 . . . . . 106 GLY CA . 27259 1 1145 . 1 1 106 106 GLY N N 15 108.930 0.3 . 1 . . . . . 106 GLY N . 27259 1 1146 . 1 1 107 107 GLU H H 1 7.686 0.020 . 1 . . . . . 107 GLU H . 27259 1 1147 . 1 1 107 107 GLU HA H 1 4.276 0.020 . 1 . . . . . 107 GLU HA . 27259 1 1148 . 1 1 107 107 GLU HB2 H 1 1.661 0.020 . 1 . . . . . 107 GLU HB2 . 27259 1 1149 . 1 1 107 107 GLU HB3 H 1 1.661 0.020 . 1 . . . . . 107 GLU HB3 . 27259 1 1150 . 1 1 107 107 GLU HG2 H 1 2.119 0.020 . 2 . . . . . 107 GLU HG2 . 27259 1 1151 . 1 1 107 107 GLU HG3 H 1 2.058 0.020 . 2 . . . . . 107 GLU HG3 . 27259 1 1152 . 1 1 107 107 GLU C C 13 175.037 0.3 . 1 . . . . . 107 GLU C . 27259 1 1153 . 1 1 107 107 GLU CA C 13 55.694 0.3 . 1 . . . . . 107 GLU CA . 27259 1 1154 . 1 1 107 107 GLU CB C 13 30.744 0.3 . 1 . . . . . 107 GLU CB . 27259 1 1155 . 1 1 107 107 GLU CG C 13 35.618 0.3 . 1 . . . . . 107 GLU CG . 27259 1 1156 . 1 1 107 107 GLU N N 15 119.969 0.3 . 1 . . . . . 107 GLU N . 27259 1 1157 . 1 1 108 108 ASN H H 1 8.450 0.020 . 1 . . . . . 108 ASN H . 27259 1 1158 . 1 1 108 108 ASN HA H 1 4.683 0.020 . 1 . . . . . 108 ASN HA . 27259 1 1159 . 1 1 108 108 ASN HB2 H 1 2.710 0.020 . 2 . . . . . 108 ASN HB2 . 27259 1 1160 . 1 1 108 108 ASN HB3 H 1 2.631 0.020 . 2 . . . . . 108 ASN HB3 . 27259 1 1161 . 1 1 108 108 ASN HD21 H 1 7.529 0.020 . 1 . . . . . 108 ASN HD21 . 27259 1 1162 . 1 1 108 108 ASN HD22 H 1 6.805 0.020 . 1 . . . . . 108 ASN HD22 . 27259 1 1163 . 1 1 108 108 ASN C C 13 173.827 0.3 . 1 . . . . . 108 ASN C . 27259 1 1164 . 1 1 108 108 ASN CA C 13 52.857 0.3 . 1 . . . . . 108 ASN CA . 27259 1 1165 . 1 1 108 108 ASN CB C 13 40.090 0.3 . 1 . . . . . 108 ASN CB . 27259 1 1166 . 1 1 108 108 ASN N N 15 119.663 0.3 . 1 . . . . . 108 ASN N . 27259 1 1167 . 1 1 108 108 ASN ND2 N 15 113.142 0.3 . 1 . . . . . 108 ASN ND2 . 27259 1 1168 . 1 1 109 109 PHE H H 1 8.664 0.020 . 1 . . . . . 109 PHE H . 27259 1 1169 . 1 1 109 109 PHE HA H 1 5.283 0.020 . 1 . . . . . 109 PHE HA . 27259 1 1170 . 1 1 109 109 PHE HB2 H 1 3.186 0.020 . 2 . . . . . 109 PHE HB2 . 27259 1 1171 . 1 1 109 109 PHE HB3 H 1 2.982 0.020 . 2 . . . . . 109 PHE HB3 . 27259 1 1172 . 1 1 109 109 PHE HD1 H 1 7.328 0.020 . 1 . . . . . 109 PHE HD1 . 27259 1 1173 . 1 1 109 109 PHE HD2 H 1 7.328 0.020 . 1 . . . . . 109 PHE HD2 . 27259 1 1174 . 1 1 109 109 PHE C C 13 176.589 0.3 . 1 . . . . . 109 PHE C . 27259 1 1175 . 1 1 109 109 PHE CA C 13 56.695 0.3 . 1 . . . . . 109 PHE CA . 27259 1 1176 . 1 1 109 109 PHE CB C 13 39.830 0.3 . 1 . . . . . 109 PHE CB . 27259 1 1177 . 1 1 109 109 PHE N N 15 121.980 0.3 . 1 . . . . . 109 PHE N . 27259 1 1178 . 1 1 110 110 THR H H 1 9.487 0.020 . 1 . . . . . 110 THR H . 27259 1 1179 . 1 1 110 110 THR HA H 1 4.628 0.020 . 1 . . . . . 110 THR HA . 27259 1 1180 . 1 1 110 110 THR HB H 1 4.845 0.020 . 1 . . . . . 110 THR HB . 27259 1 1181 . 1 1 110 110 THR HG21 H 1 1.436 0.020 . 1 . . . . . 110 THR HG2 . 27259 1 1182 . 1 1 110 110 THR HG22 H 1 1.436 0.020 . 1 . . . . . 110 THR HG2 . 27259 1 1183 . 1 1 110 110 THR HG23 H 1 1.436 0.020 . 1 . . . . . 110 THR HG2 . 27259 1 1184 . 1 1 110 110 THR C C 13 175.219 0.3 . 1 . . . . . 110 THR C . 27259 1 1185 . 1 1 110 110 THR CA C 13 60.439 0.3 . 1 . . . . . 110 THR CA . 27259 1 1186 . 1 1 110 110 THR CB C 13 72.038 0.3 . 1 . . . . . 110 THR CB . 27259 1 1187 . 1 1 110 110 THR CG2 C 13 20.994 0.3 . 1 . . . . . 110 THR CG2 . 27259 1 1188 . 1 1 110 110 THR N N 15 116.155 0.3 . 1 . . . . . 110 THR N . 27259 1 1189 . 1 1 111 111 GLU H H 1 9.109 0.020 . 1 . . . . . 111 GLU H . 27259 1 1190 . 1 1 111 111 GLU HA H 1 4.095 0.020 . 1 . . . . . 111 GLU HA . 27259 1 1191 . 1 1 111 111 GLU HB2 H 1 2.141 0.020 . 2 . . . . . 111 GLU HB2 . 27259 1 1192 . 1 1 111 111 GLU HB3 H 1 2.079 0.020 . 2 . . . . . 111 GLU HB3 . 27259 1 1193 . 1 1 111 111 GLU HG2 H 1 2.444 0.020 . 2 . . . . . 111 GLU HG2 . 27259 1 1194 . 1 1 111 111 GLU HG3 H 1 2.361 0.020 . 2 . . . . . 111 GLU HG3 . 27259 1 1195 . 1 1 111 111 GLU C C 13 178.986 0.3 . 1 . . . . . 111 GLU C . 27259 1 1196 . 1 1 111 111 GLU CA C 13 59.854 0.3 . 1 . . . . . 111 GLU CA . 27259 1 1197 . 1 1 111 111 GLU CB C 13 28.562 0.3 . 1 . . . . . 111 GLU CB . 27259 1 1198 . 1 1 111 111 GLU CG C 13 35.618 0.3 . 1 . . . . . 111 GLU CG . 27259 1 1199 . 1 1 111 111 GLU N N 15 119.908 0.3 . 1 . . . . . 111 GLU N . 27259 1 1200 . 1 1 112 112 THR H H 1 7.940 0.020 . 1 . . . . . 112 THR H . 27259 1 1201 . 1 1 112 112 THR HA H 1 3.810 0.020 . 1 . . . . . 112 THR HA . 27259 1 1202 . 1 1 112 112 THR HB H 1 3.738 0.020 . 1 . . . . . 112 THR HB . 27259 1 1203 . 1 1 112 112 THR HG21 H 1 0.716 0.020 . 1 . . . . . 112 THR HG2 . 27259 1 1204 . 1 1 112 112 THR HG22 H 1 0.716 0.020 . 1 . . . . . 112 THR HG2 . 27259 1 1205 . 1 1 112 112 THR HG23 H 1 0.716 0.020 . 1 . . . . . 112 THR HG2 . 27259 1 1206 . 1 1 112 112 THR C C 13 175.402 0.3 . 1 . . . . . 112 THR C . 27259 1 1207 . 1 1 112 112 THR CA C 13 66.829 0.3 . 1 . . . . . 112 THR CA . 27259 1 1208 . 1 1 112 112 THR CB C 13 68.560 0.3 . 1 . . . . . 112 THR CB . 27259 1 1209 . 1 1 112 112 THR CG2 C 13 20.994 0.3 . 1 . . . . . 112 THR CG2 . 27259 1 1210 . 1 1 112 112 THR N N 15 116.223 0.3 . 1 . . . . . 112 THR N . 27259 1 1211 . 1 1 113 113 ASP H H 1 7.474 0.020 . 1 . . . . . 113 ASP H . 27259 1 1212 . 1 1 113 113 ASP HA H 1 4.587 0.020 . 1 . . . . . 113 ASP HA . 27259 1 1213 . 1 1 113 113 ASP HB2 H 1 3.344 0.020 . 2 . . . . . 113 ASP HB2 . 27259 1 1214 . 1 1 113 113 ASP HB3 H 1 2.569 0.020 . 2 . . . . . 113 ASP HB3 . 27259 1 1215 . 1 1 113 113 ASP C C 13 177.457 0.3 . 1 . . . . . 113 ASP C . 27259 1 1216 . 1 1 113 113 ASP CA C 13 57.963 0.3 . 1 . . . . . 113 ASP CA . 27259 1 1217 . 1 1 113 113 ASP CB C 13 41.341 0.3 . 1 . . . . . 113 ASP CB . 27259 1 1218 . 1 1 113 113 ASP N N 15 120.245 0.3 . 1 . . . . . 113 ASP N . 27259 1 1219 . 1 1 114 114 VAL H H 1 8.212 0.020 . 1 . . . . . 114 VAL H . 27259 1 1220 . 1 1 114 114 VAL HA H 1 3.319 0.020 . 1 . . . . . 114 VAL HA . 27259 1 1221 . 1 1 114 114 VAL HB H 1 2.127 0.020 . 1 . . . . . 114 VAL HB . 27259 1 1222 . 1 1 114 114 VAL HG11 H 1 1.006 0.020 . 2 . . . . . 114 VAL HG1 . 27259 1 1223 . 1 1 114 114 VAL HG12 H 1 1.006 0.020 . 2 . . . . . 114 VAL HG1 . 27259 1 1224 . 1 1 114 114 VAL HG13 H 1 1.006 0.020 . 2 . . . . . 114 VAL HG1 . 27259 1 1225 . 1 1 114 114 VAL HG21 H 1 0.908 0.020 . 2 . . . . . 114 VAL HG2 . 27259 1 1226 . 1 1 114 114 VAL HG22 H 1 0.908 0.020 . 2 . . . . . 114 VAL HG2 . 27259 1 1227 . 1 1 114 114 VAL HG23 H 1 0.908 0.020 . 2 . . . . . 114 VAL HG2 . 27259 1 1228 . 1 1 114 114 VAL C C 13 177.616 0.3 . 1 . . . . . 114 VAL C . 27259 1 1229 . 1 1 114 114 VAL CA C 13 67.696 0.3 . 1 . . . . . 114 VAL CA . 27259 1 1230 . 1 1 114 114 VAL CB C 13 31.328 0.3 . 1 . . . . . 114 VAL CB . 27259 1 1231 . 1 1 114 114 VAL CG1 C 13 22.427 0.3 . 1 . . . . . 114 VAL CG1 . 27259 1 1232 . 1 1 114 114 VAL CG2 C 13 20.994 0.3 . 1 . . . . . 114 VAL CG2 . 27259 1 1233 . 1 1 114 114 VAL N N 15 119.658 0.3 . 1 . . . . . 114 VAL N . 27259 1 1234 . 1 1 115 115 LYS H H 1 7.716 0.020 . 1 . . . . . 115 LYS H . 27259 1 1235 . 1 1 115 115 LYS HA H 1 4.095 0.020 . 1 . . . . . 115 LYS HA . 27259 1 1236 . 1 1 115 115 LYS HB2 H 1 1.980 0.020 . 2 . . . . . 115 LYS HB2 . 27259 1 1237 . 1 1 115 115 LYS HB3 H 1 1.928 0.020 . 2 . . . . . 115 LYS HB3 . 27259 1 1238 . 1 1 115 115 LYS HG2 H 1 1.652 0.020 . 2 . . . . . 115 LYS HG2 . 27259 1 1239 . 1 1 115 115 LYS HG3 H 1 1.467 0.020 . 2 . . . . . 115 LYS HG3 . 27259 1 1240 . 1 1 115 115 LYS HD2 H 1 1.704 0.020 . 1 . . . . . 115 LYS HD2 . 27259 1 1241 . 1 1 115 115 LYS HD3 H 1 1.704 0.020 . 1 . . . . . 115 LYS HD3 . 27259 1 1242 . 1 1 115 115 LYS HE2 H 1 2.983 0.020 . 1 . . . . . 115 LYS HE2 . 27259 1 1243 . 1 1 115 115 LYS HE3 H 1 2.983 0.020 . 1 . . . . . 115 LYS HE3 . 27259 1 1244 . 1 1 115 115 LYS C C 13 179.990 0.3 . 1 . . . . . 115 LYS C . 27259 1 1245 . 1 1 115 115 LYS CA C 13 59.330 0.3 . 1 . . . . . 115 LYS CA . 27259 1 1246 . 1 1 115 115 LYS CB C 13 31.662 0.3 . 1 . . . . . 115 LYS CB . 27259 1 1247 . 1 1 115 115 LYS CG C 13 25.039 0.3 . 1 . . . . . 115 LYS CG . 27259 1 1248 . 1 1 115 115 LYS CD C 13 29.162 0.3 . 1 . . . . . 115 LYS CD . 27259 1 1249 . 1 1 115 115 LYS CE C 13 41.842 0.3 . 1 . . . . . 115 LYS CE . 27259 1 1250 . 1 1 115 115 LYS N N 15 119.095 0.3 . 1 . . . . . 115 LYS N . 27259 1 1251 . 1 1 116 116 MET H H 1 8.208 0.020 . 1 . . . . . 116 MET H . 27259 1 1252 . 1 1 116 116 MET HA H 1 4.175 0.020 . 1 . . . . . 116 MET HA . 27259 1 1253 . 1 1 116 116 MET HB2 H 1 2.272 0.020 . 2 . . . . . 116 MET HB2 . 27259 1 1254 . 1 1 116 116 MET HB3 H 1 1.940 0.020 . 2 . . . . . 116 MET HB3 . 27259 1 1255 . 1 1 116 116 MET HG2 H 1 2.938 0.020 . 2 . . . . . 116 MET HG2 . 27259 1 1256 . 1 1 116 116 MET HG3 H 1 2.191 0.020 . 2 . . . . . 116 MET HG3 . 27259 1 1257 . 1 1 116 116 MET HE1 H 1 1.497 0.020 . 1 . . . . . 116 MET HE . 27259 1 1258 . 1 1 116 116 MET HE2 H 1 1.497 0.020 . 1 . . . . . 116 MET HE . 27259 1 1259 . 1 1 116 116 MET HE3 H 1 1.497 0.020 . 1 . . . . . 116 MET HE . 27259 1 1260 . 1 1 116 116 MET C C 13 177.982 0.3 . 1 . . . . . 116 MET C . 27259 1 1261 . 1 1 116 116 MET CA C 13 60.033 0.3 . 1 . . . . . 116 MET CA . 27259 1 1262 . 1 1 116 116 MET CB C 13 32.329 0.3 . 1 . . . . . 116 MET CB . 27259 1 1263 . 1 1 116 116 MET CG C 13 33.829 0.3 . 1 . . . . . 116 MET CG . 27259 1 1264 . 1 1 116 116 MET CE C 13 17.986 0.3 . 1 . . . . . 116 MET CE . 27259 1 1265 . 1 1 116 116 MET N N 15 118.751 0.3 . 1 . . . . . 116 MET N . 27259 1 1266 . 1 1 117 117 MET H H 1 8.729 0.020 . 1 . . . . . 117 MET H . 27259 1 1267 . 1 1 117 117 MET HA H 1 3.586 0.020 . 1 . . . . . 117 MET HA . 27259 1 1268 . 1 1 117 117 MET HB2 H 1 1.969 0.020 . 2 . . . . . 117 MET HB2 . 27259 1 1269 . 1 1 117 117 MET HB3 H 1 1.690 0.020 . 2 . . . . . 117 MET HB3 . 27259 1 1270 . 1 1 117 117 MET HG2 H 1 1.947 0.020 . 2 . . . . . 117 MET HG2 . 27259 1 1271 . 1 1 117 117 MET HG3 H 1 1.752 0.020 . 2 . . . . . 117 MET HG3 . 27259 1 1272 . 1 1 117 117 MET HE1 H 1 1.407 0.020 . 1 . . . . . 117 MET HE . 27259 1 1273 . 1 1 117 117 MET HE2 H 1 1.407 0.020 . 1 . . . . . 117 MET HE . 27259 1 1274 . 1 1 117 117 MET HE3 H 1 1.407 0.020 . 1 . . . . . 117 MET HE . 27259 1 1275 . 1 1 117 117 MET C C 13 177.616 0.3 . 1 . . . . . 117 MET C . 27259 1 1276 . 1 1 117 117 MET CA C 13 59.616 0.3 . 1 . . . . . 117 MET CA . 27259 1 1277 . 1 1 117 117 MET CB C 13 33.247 0.3 . 1 . . . . . 117 MET CB . 27259 1 1278 . 1 1 117 117 MET CG C 13 32.662 0.3 . 1 . . . . . 117 MET CG . 27259 1 1279 . 1 1 117 117 MET CE C 13 15.844 0.3 . 1 . . . . . 117 MET CE . 27259 1 1280 . 1 1 117 117 MET N N 15 118.368 0.3 . 1 . . . . . 117 MET N . 27259 1 1281 . 1 1 118 118 GLU H H 1 8.400 0.020 . 1 . . . . . 118 GLU H . 27259 1 1282 . 1 1 118 118 GLU HA H 1 3.686 0.020 . 1 . . . . . 118 GLU HA . 27259 1 1283 . 1 1 118 118 GLU HB2 H 1 2.227 0.020 . 2 . . . . . 118 GLU HB2 . 27259 1 1284 . 1 1 118 118 GLU HB3 H 1 2.083 0.020 . 2 . . . . . 118 GLU HB3 . 27259 1 1285 . 1 1 118 118 GLU HG2 H 1 2.561 0.020 . 2 . . . . . 118 GLU HG2 . 27259 1 1286 . 1 1 118 118 GLU HG3 H 1 2.215 0.020 . 2 . . . . . 118 GLU HG3 . 27259 1 1287 . 1 1 118 118 GLU C C 13 178.141 0.3 . 1 . . . . . 118 GLU C . 27259 1 1288 . 1 1 118 118 GLU CA C 13 60.563 0.3 . 1 . . . . . 118 GLU CA . 27259 1 1289 . 1 1 118 118 GLU CB C 13 28.157 0.3 . 1 . . . . . 118 GLU CB . 27259 1 1290 . 1 1 118 118 GLU CG C 13 34.996 0.3 . 1 . . . . . 118 GLU CG . 27259 1 1291 . 1 1 118 118 GLU N N 15 118.425 0.3 . 1 . . . . . 118 GLU N . 27259 1 1292 . 1 1 119 119 ARG H H 1 7.296 0.020 . 1 . . . . . 119 ARG H . 27259 1 1293 . 1 1 119 119 ARG HA H 1 4.220 0.020 . 1 . . . . . 119 ARG HA . 27259 1 1294 . 1 1 119 119 ARG HB2 H 1 2.116 0.020 . 2 . . . . . 119 ARG HB2 . 27259 1 1295 . 1 1 119 119 ARG HB3 H 1 1.969 0.020 . 2 . . . . . 119 ARG HB3 . 27259 1 1296 . 1 1 119 119 ARG HG2 H 1 1.853 0.020 . 2 . . . . . 119 ARG HG2 . 27259 1 1297 . 1 1 119 119 ARG HG3 H 1 1.767 0.020 . 2 . . . . . 119 ARG HG3 . 27259 1 1298 . 1 1 119 119 ARG HD2 H 1 3.277 0.020 . 2 . . . . . 119 ARG HD2 . 27259 1 1299 . 1 1 119 119 ARG HD3 H 1 3.172 0.020 . 2 . . . . . 119 ARG HD3 . 27259 1 1300 . 1 1 119 119 ARG HE H 1 7.251 0.020 . 1 . . . . . 119 ARG HE . 27259 1 1301 . 1 1 119 119 ARG C C 13 179.169 0.3 . 1 . . . . . 119 ARG C . 27259 1 1302 . 1 1 119 119 ARG CA C 13 58.463 0.3 . 1 . . . . . 119 ARG CA . 27259 1 1303 . 1 1 119 119 ARG CB C 13 29.826 0.3 . 1 . . . . . 119 ARG CB . 27259 1 1304 . 1 1 119 119 ARG CG C 13 26.750 0.3 . 1 . . . . . 119 ARG CG . 27259 1 1305 . 1 1 119 119 ARG CD C 13 42.545 0.3 . 1 . . . . . 119 ARG CD . 27259 1 1306 . 1 1 119 119 ARG N N 15 116.936 0.3 . 1 . . . . . 119 ARG N . 27259 1 1307 . 1 1 119 119 ARG NE N 15 83.253 0.3 . 1 . . . . . 119 ARG NE . 27259 1 1308 . 1 1 120 120 VAL H H 1 8.256 0.020 . 1 . . . . . 120 VAL H . 27259 1 1309 . 1 1 120 120 VAL HA H 1 3.811 0.020 . 1 . . . . . 120 VAL HA . 27259 1 1310 . 1 1 120 120 VAL HB H 1 2.336 0.020 . 1 . . . . . 120 VAL HB . 27259 1 1311 . 1 1 120 120 VAL HG11 H 1 1.330 0.020 . 2 . . . . . 120 VAL HG1 . 27259 1 1312 . 1 1 120 120 VAL HG12 H 1 1.330 0.020 . 2 . . . . . 120 VAL HG1 . 27259 1 1313 . 1 1 120 120 VAL HG13 H 1 1.330 0.020 . 2 . . . . . 120 VAL HG1 . 27259 1 1314 . 1 1 120 120 VAL HG21 H 1 1.281 0.020 . 2 . . . . . 120 VAL HG2 . 27259 1 1315 . 1 1 120 120 VAL HG22 H 1 1.281 0.020 . 2 . . . . . 120 VAL HG2 . 27259 1 1316 . 1 1 120 120 VAL HG23 H 1 1.281 0.020 . 2 . . . . . 120 VAL HG2 . 27259 1 1317 . 1 1 120 120 VAL C C 13 177.091 0.3 . 1 . . . . . 120 VAL C . 27259 1 1318 . 1 1 120 120 VAL CA C 13 65.829 0.3 . 1 . . . . . 120 VAL CA . 27259 1 1319 . 1 1 120 120 VAL CB C 13 32.007 0.3 . 1 . . . . . 120 VAL CB . 27259 1 1320 . 1 1 120 120 VAL CG1 C 13 23.872 0.3 . 1 . . . . . 120 VAL CG1 . 27259 1 1321 . 1 1 120 120 VAL CG2 C 13 20.372 0.3 . 1 . . . . . 120 VAL CG2 . 27259 1 1322 . 1 1 120 120 VAL N N 15 119.250 0.3 . 1 . . . . . 120 VAL N . 27259 1 1323 . 1 1 121 121 VAL H H 1 9.024 0.020 . 1 . . . . . 121 VAL H . 27259 1 1324 . 1 1 121 121 VAL HA H 1 3.651 0.020 . 1 . . . . . 121 VAL HA . 27259 1 1325 . 1 1 121 121 VAL HB H 1 2.285 0.020 . 1 . . . . . 121 VAL HB . 27259 1 1326 . 1 1 121 121 VAL HG11 H 1 1.235 0.020 . 2 . . . . . 121 VAL HG1 . 27259 1 1327 . 1 1 121 121 VAL HG12 H 1 1.235 0.020 . 2 . . . . . 121 VAL HG1 . 27259 1 1328 . 1 1 121 121 VAL HG13 H 1 1.235 0.020 . 2 . . . . . 121 VAL HG1 . 27259 1 1329 . 1 1 121 121 VAL HG21 H 1 0.972 0.020 . 2 . . . . . 121 VAL HG2 . 27259 1 1330 . 1 1 121 121 VAL HG22 H 1 0.972 0.020 . 2 . . . . . 121 VAL HG2 . 27259 1 1331 . 1 1 121 121 VAL HG23 H 1 0.972 0.020 . 2 . . . . . 121 VAL HG2 . 27259 1 1332 . 1 1 121 121 VAL C C 13 177.274 0.3 . 1 . . . . . 121 VAL C . 27259 1 1333 . 1 1 121 121 VAL CA C 13 66.530 0.3 . 1 . . . . . 121 VAL CA . 27259 1 1334 . 1 1 121 121 VAL CB C 13 31.066 0.3 . 1 . . . . . 121 VAL CB . 27259 1 1335 . 1 1 121 121 VAL CG1 C 13 24.598 0.3 . 1 . . . . . 121 VAL CG1 . 27259 1 1336 . 1 1 121 121 VAL CG2 C 13 24.085 0.3 . 1 . . . . . 121 VAL CG2 . 27259 1 1337 . 1 1 121 121 VAL N N 15 121.334 0.3 . 1 . . . . . 121 VAL N . 27259 1 1338 . 1 1 122 122 GLU H H 1 8.050 0.020 . 1 . . . . . 122 GLU H . 27259 1 1339 . 1 1 122 122 GLU HA H 1 3.613 0.020 . 1 . . . . . 122 GLU HA . 27259 1 1340 . 1 1 122 122 GLU HB2 H 1 2.244 0.020 . 1 . . . . . 122 GLU HB2 . 27259 1 1341 . 1 1 122 122 GLU HB3 H 1 2.244 0.020 . 1 . . . . . 122 GLU HB3 . 27259 1 1342 . 1 1 122 122 GLU HG2 H 1 2.169 0.020 . 1 . . . . . 122 GLU HG2 . 27259 1 1343 . 1 1 122 122 GLU HG3 H 1 2.169 0.020 . 1 . . . . . 122 GLU HG3 . 27259 1 1344 . 1 1 122 122 GLU C C 13 177.457 0.3 . 1 . . . . . 122 GLU C . 27259 1 1345 . 1 1 122 122 GLU CA C 13 60.996 0.3 . 1 . . . . . 122 GLU CA . 27259 1 1346 . 1 1 122 122 GLU CB C 13 28.825 0.3 . 1 . . . . . 122 GLU CB . 27259 1 1347 . 1 1 122 122 GLU CG C 13 35.618 0.3 . 1 . . . . . 122 GLU CG . 27259 1 1348 . 1 1 122 122 GLU N N 15 120.513 0.3 . 1 . . . . . 122 GLU N . 27259 1 1349 . 1 1 123 123 GLN H H 1 7.159 0.020 . 1 . . . . . 123 GLN H . 27259 1 1350 . 1 1 123 123 GLN HA H 1 4.003 0.020 . 1 . . . . . 123 GLN HA . 27259 1 1351 . 1 1 123 123 GLN HB2 H 1 2.224 0.020 . 2 . . . . . 123 GLN HB2 . 27259 1 1352 . 1 1 123 123 GLN HB3 H 1 2.142 0.020 . 2 . . . . . 123 GLN HB3 . 27259 1 1353 . 1 1 123 123 GLN HG2 H 1 2.453 0.020 . 1 . . . . . 123 GLN HG2 . 27259 1 1354 . 1 1 123 123 GLN HG3 H 1 2.453 0.020 . 1 . . . . . 123 GLN HG3 . 27259 1 1355 . 1 1 123 123 GLN HE21 H 1 7.543 0.020 . 1 . . . . . 123 GLN HE21 . 27259 1 1356 . 1 1 123 123 GLN HE22 H 1 6.881 0.020 . 1 . . . . . 123 GLN HE22 . 27259 1 1357 . 1 1 123 123 GLN C C 13 178.826 0.3 . 1 . . . . . 123 GLN C . 27259 1 1358 . 1 1 123 123 GLN CA C 13 58.863 0.3 . 1 . . . . . 123 GLN CA . 27259 1 1359 . 1 1 123 123 GLN CB C 13 27.656 0.3 . 1 . . . . . 123 GLN CB . 27259 1 1360 . 1 1 123 123 GLN CG C 13 33.284 0.3 . 1 . . . . . 123 GLN CG . 27259 1 1361 . 1 1 123 123 GLN N N 15 114.858 0.3 . 1 . . . . . 123 GLN N . 27259 1 1362 . 1 1 123 123 GLN NE2 N 15 113.267 0.3 . 1 . . . . . 123 GLN NE2 . 27259 1 1363 . 1 1 124 124 MET H H 1 8.246 0.020 . 1 . . . . . 124 MET H . 27259 1 1364 . 1 1 124 124 MET HA H 1 4.186 0.020 . 1 . . . . . 124 MET HA . 27259 1 1365 . 1 1 124 124 MET HB2 H 1 2.177 0.020 . 2 . . . . . 124 MET HB2 . 27259 1 1366 . 1 1 124 124 MET HB3 H 1 2.127 0.020 . 2 . . . . . 124 MET HB3 . 27259 1 1367 . 1 1 124 124 MET HG2 H 1 2.844 0.020 . 2 . . . . . 124 MET HG2 . 27259 1 1368 . 1 1 124 124 MET HG3 H 1 2.508 0.020 . 2 . . . . . 124 MET HG3 . 27259 1 1369 . 1 1 124 124 MET HE1 H 1 1.895 0.020 . 1 . . . . . 124 MET HE . 27259 1 1370 . 1 1 124 124 MET HE2 H 1 1.895 0.020 . 1 . . . . . 124 MET HE . 27259 1 1371 . 1 1 124 124 MET HE3 H 1 1.895 0.020 . 1 . . . . . 124 MET HE . 27259 1 1372 . 1 1 124 124 MET C C 13 178.484 0.3 . 1 . . . . . 124 MET C . 27259 1 1373 . 1 1 124 124 MET CA C 13 59.829 0.3 . 1 . . . . . 124 MET CA . 27259 1 1374 . 1 1 124 124 MET CB C 13 34.491 0.3 . 1 . . . . . 124 MET CB . 27259 1 1375 . 1 1 124 124 MET CG C 13 32.118 0.3 . 1 . . . . . 124 MET CG . 27259 1 1376 . 1 1 124 124 MET CE C 13 16.416 0.3 . 1 . . . . . 124 MET CE . 27259 1 1377 . 1 1 124 124 MET N N 15 119.302 0.3 . 1 . . . . . 124 MET N . 27259 1 1378 . 1 1 125 125 CYS H H 1 9.193 0.020 . 1 . . . . . 125 CYS H . 27259 1 1379 . 1 1 125 125 CYS HA H 1 4.437 0.020 . 1 . . . . . 125 CYS HA . 27259 1 1380 . 1 1 125 125 CYS HB2 H 1 3.543 0.020 . 2 . . . . . 125 CYS HB2 . 27259 1 1381 . 1 1 125 125 CYS HB3 H 1 2.880 0.020 . 2 . . . . . 125 CYS HB3 . 27259 1 1382 . 1 1 125 125 CYS C C 13 176.749 0.3 . 1 . . . . . 125 CYS C . 27259 1 1383 . 1 1 125 125 CYS CA C 13 59.854 0.3 . 1 . . . . . 125 CYS CA . 27259 1 1384 . 1 1 125 125 CYS CB C 13 41.663 0.3 . 1 . . . . . 125 CYS CB . 27259 1 1385 . 1 1 125 125 CYS N N 15 119.299 0.3 . 1 . . . . . 125 CYS N . 27259 1 1386 . 1 1 126 126 ILE H H 1 8.246 0.020 . 1 . . . . . 126 ILE H . 27259 1 1387 . 1 1 126 126 ILE HA H 1 3.595 0.020 . 1 . . . . . 126 ILE HA . 27259 1 1388 . 1 1 126 126 ILE HB H 1 2.055 0.020 . 1 . . . . . 126 ILE HB . 27259 1 1389 . 1 1 126 126 ILE HG12 H 1 1.997 0.020 . 2 . . . . . 126 ILE HG12 . 27259 1 1390 . 1 1 126 126 ILE HG13 H 1 0.877 0.020 . 2 . . . . . 126 ILE HG13 . 27259 1 1391 . 1 1 126 126 ILE HG21 H 1 0.900 0.020 . 1 . . . . . 126 ILE HG2 . 27259 1 1392 . 1 1 126 126 ILE HG22 H 1 0.900 0.020 . 1 . . . . . 126 ILE HG2 . 27259 1 1393 . 1 1 126 126 ILE HG23 H 1 0.900 0.020 . 1 . . . . . 126 ILE HG2 . 27259 1 1394 . 1 1 126 126 ILE HD11 H 1 0.865 0.020 . 1 . . . . . 126 ILE HD1 . 27259 1 1395 . 1 1 126 126 ILE HD12 H 1 0.865 0.020 . 1 . . . . . 126 ILE HD1 . 27259 1 1396 . 1 1 126 126 ILE HD13 H 1 0.865 0.020 . 1 . . . . . 126 ILE HD1 . 27259 1 1397 . 1 1 126 126 ILE C C 13 177.959 0.3 . 1 . . . . . 126 ILE C . 27259 1 1398 . 1 1 126 126 ILE CA C 13 66.563 0.3 . 1 . . . . . 126 ILE CA . 27259 1 1399 . 1 1 126 126 ILE CB C 13 37.837 0.3 . 1 . . . . . 126 ILE CB . 27259 1 1400 . 1 1 126 126 ILE CG1 C 13 30.596 0.3 . 1 . . . . . 126 ILE CG1 . 27259 1 1401 . 1 1 126 126 ILE CG2 C 13 16.872 0.3 . 1 . . . . . 126 ILE CG2 . 27259 1 1402 . 1 1 126 126 ILE CD1 C 13 14.067 0.3 . 1 . . . . . 126 ILE CD1 . 27259 1 1403 . 1 1 126 126 ILE N N 15 123.944 0.3 . 1 . . . . . 126 ILE N . 27259 1 1404 . 1 1 127 127 THR H H 1 8.064 0.020 . 1 . . . . . 127 THR H . 27259 1 1405 . 1 1 127 127 THR HA H 1 3.967 0.020 . 1 . . . . . 127 THR HA . 27259 1 1406 . 1 1 127 127 THR HB H 1 4.301 0.020 . 1 . . . . . 127 THR HB . 27259 1 1407 . 1 1 127 127 THR HG21 H 1 1.250 0.020 . 1 . . . . . 127 THR HG2 . 27259 1 1408 . 1 1 127 127 THR HG22 H 1 1.250 0.020 . 1 . . . . . 127 THR HG2 . 27259 1 1409 . 1 1 127 127 THR HG23 H 1 1.250 0.020 . 1 . . . . . 127 THR HG2 . 27259 1 1410 . 1 1 127 127 THR C C 13 176.749 0.3 . 1 . . . . . 127 THR C . 27259 1 1411 . 1 1 127 127 THR CA C 13 67.126 0.3 . 1 . . . . . 127 THR CA . 27259 1 1412 . 1 1 127 127 THR CB C 13 67.960 0.3 . 1 . . . . . 127 THR CB . 27259 1 1413 . 1 1 127 127 THR CG2 C 13 21.539 0.3 . 1 . . . . . 127 THR CG2 . 27259 1 1414 . 1 1 127 127 THR N N 15 118.702 0.3 . 1 . . . . . 127 THR N . 27259 1 1415 . 1 1 128 128 GLN H H 1 8.729 0.020 . 1 . . . . . 128 GLN H . 27259 1 1416 . 1 1 128 128 GLN HA H 1 3.659 0.020 . 1 . . . . . 128 GLN HA . 27259 1 1417 . 1 1 128 128 GLN HB2 H 1 2.051 0.020 . 1 . . . . . 128 GLN HB2 . 27259 1 1418 . 1 1 128 128 GLN HB3 H 1 2.051 0.020 . 1 . . . . . 128 GLN HB3 . 27259 1 1419 . 1 1 128 128 GLN HG2 H 1 1.674 0.020 . 1 . . . . . 128 GLN HG2 . 27259 1 1420 . 1 1 128 128 GLN HG3 H 1 1.674 0.020 . 1 . . . . . 128 GLN HG3 . 27259 1 1421 . 1 1 128 128 GLN HE21 H 1 7.313 0.020 . 1 . . . . . 128 GLN HE21 . 27259 1 1422 . 1 1 128 128 GLN HE22 H 1 6.769 0.020 . 1 . . . . . 128 GLN HE22 . 27259 1 1423 . 1 1 128 128 GLN C C 13 177.091 0.3 . 1 . . . . . 128 GLN C . 27259 1 1424 . 1 1 128 128 GLN CA C 13 58.603 0.3 . 1 . . . . . 128 GLN CA . 27259 1 1425 . 1 1 128 128 GLN CB C 13 27.895 0.3 . 1 . . . . . 128 GLN CB . 27259 1 1426 . 1 1 128 128 GLN CG C 13 32.627 0.3 . 1 . . . . . 128 GLN CG . 27259 1 1427 . 1 1 128 128 GLN N N 15 122.241 0.3 . 1 . . . . . 128 GLN N . 27259 1 1428 . 1 1 128 128 GLN NE2 N 15 115.661 0.3 . 1 . . . . . 128 GLN NE2 . 27259 1 1429 . 1 1 129 129 TYR HA H 1 2.957 0.020 . 1 . . . . . 129 TYR HA . 27259 1 1430 . 1 1 129 129 TYR HB2 H 1 3.127 0.020 . 2 . . . . . 129 TYR HB2 . 27259 1 1431 . 1 1 129 129 TYR HB3 H 1 2.783 0.020 . 2 . . . . . 129 TYR HB3 . 27259 1 1432 . 1 1 129 129 TYR HD1 H 1 6.237 0.020 . 1 . . . . . 129 TYR HD1 . 27259 1 1433 . 1 1 129 129 TYR HD2 H 1 6.237 0.020 . 1 . . . . . 129 TYR HD2 . 27259 1 1434 . 1 1 129 129 TYR C C 13 177.959 0.3 . 1 . . . . . 129 TYR C . 27259 1 1435 . 1 1 129 129 TYR CA C 13 61.929 0.3 . 1 . . . . . 129 TYR CA . 27259 1 1436 . 1 1 129 129 TYR CB C 13 36.781 0.3 . 1 . . . . . 129 TYR CB . 27259 1 1437 . 1 1 130 130 GLU H H 1 8.250 0.020 . 1 . . . . . 130 GLU H . 27259 1 1438 . 1 1 130 130 GLU HA H 1 3.738 0.020 . 1 . . . . . 130 GLU HA . 27259 1 1439 . 1 1 130 130 GLU HB2 H 1 2.378 0.020 . 2 . . . . . 130 GLU HB2 . 27259 1 1440 . 1 1 130 130 GLU HB3 H 1 2.086 0.020 . 2 . . . . . 130 GLU HB3 . 27259 1 1441 . 1 1 130 130 GLU HG2 H 1 2.648 0.020 . 2 . . . . . 130 GLU HG2 . 27259 1 1442 . 1 1 130 130 GLU HG3 H 1 2.411 0.020 . 2 . . . . . 130 GLU HG3 . 27259 1 1443 . 1 1 130 130 GLU C C 13 178.826 0.3 . 1 . . . . . 130 GLU C . 27259 1 1444 . 1 1 130 130 GLU CA C 13 59.363 0.3 . 1 . . . . . 130 GLU CA . 27259 1 1445 . 1 1 130 130 GLU CB C 13 27.907 0.3 . 1 . . . . . 130 GLU CB . 27259 1 1446 . 1 1 130 130 GLU CG C 13 34.451 0.3 . 1 . . . . . 130 GLU CG . 27259 1 1447 . 1 1 130 130 GLU N N 15 120.841 0.3 . 1 . . . . . 130 GLU N . 27259 1 1448 . 1 1 131 131 ARG H H 1 7.900 0.020 . 1 . . . . . 131 ARG H . 27259 1 1449 . 1 1 131 131 ARG HA H 1 4.003 0.020 . 1 . . . . . 131 ARG HA . 27259 1 1450 . 1 1 131 131 ARG HB2 H 1 1.877 0.020 . 2 . . . . . 131 ARG HB2 . 27259 1 1451 . 1 1 131 131 ARG HB3 H 1 1.835 0.020 . 2 . . . . . 131 ARG HB3 . 27259 1 1452 . 1 1 131 131 ARG HG2 H 1 1.854 0.020 . 2 . . . . . 131 ARG HG2 . 27259 1 1453 . 1 1 131 131 ARG HG3 H 1 1.622 0.020 . 2 . . . . . 131 ARG HG3 . 27259 1 1454 . 1 1 131 131 ARG HD2 H 1 3.095 0.020 . 2 . . . . . 131 ARG HD2 . 27259 1 1455 . 1 1 131 131 ARG HD3 H 1 2.938 0.020 . 2 . . . . . 131 ARG HD3 . 27259 1 1456 . 1 1 131 131 ARG HE H 1 7.225 0.020 . 1 . . . . . 131 ARG HE . 27259 1 1457 . 1 1 131 131 ARG C C 13 179.511 0.3 . 1 . . . . . 131 ARG C . 27259 1 1458 . 1 1 131 131 ARG CA C 13 59.163 0.3 . 1 . . . . . 131 ARG CA . 27259 1 1459 . 1 1 131 131 ARG CB C 13 30.076 0.3 . 1 . . . . . 131 ARG CB . 27259 1 1460 . 1 1 131 131 ARG CG C 13 26.454 0.3 . 1 . . . . . 131 ARG CG . 27259 1 1461 . 1 1 131 131 ARG CD C 13 43.676 0.3 . 1 . . . . . 131 ARG CD . 27259 1 1462 . 1 1 131 131 ARG N N 15 119.014 0.3 . 1 . . . . . 131 ARG N . 27259 1 1463 . 1 1 131 131 ARG NE N 15 84.042 0.3 . 1 . . . . . 131 ARG NE . 27259 1 1464 . 1 1 132 132 GLU H H 1 8.397 0.020 . 1 . . . . . 132 GLU H . 27259 1 1465 . 1 1 132 132 GLU HA H 1 4.045 0.020 . 1 . . . . . 132 GLU HA . 27259 1 1466 . 1 1 132 132 GLU HB2 H 1 1.681 0.020 . 1 . . . . . 132 GLU HB2 . 27259 1 1467 . 1 1 132 132 GLU HB3 H 1 1.681 0.020 . 1 . . . . . 132 GLU HB3 . 27259 1 1468 . 1 1 132 132 GLU HG2 H 1 2.412 0.020 . 2 . . . . . 132 GLU HG2 . 27259 1 1469 . 1 1 132 132 GLU HG3 H 1 2.191 0.020 . 2 . . . . . 132 GLU HG3 . 27259 1 1470 . 1 1 132 132 GLU C C 13 178.644 0.3 . 1 . . . . . 132 GLU C . 27259 1 1471 . 1 1 132 132 GLU CA C 13 57.863 0.3 . 1 . . . . . 132 GLU CA . 27259 1 1472 . 1 1 132 132 GLU CB C 13 28.825 0.3 . 1 . . . . . 132 GLU CB . 27259 1 1473 . 1 1 132 132 GLU CG C 13 36.362 0.3 . 1 . . . . . 132 GLU CG . 27259 1 1474 . 1 1 132 132 GLU N N 15 118.862 0.3 . 1 . . . . . 132 GLU N . 27259 1 1475 . 1 1 133 133 SER H H 1 8.438 0.020 . 1 . . . . . 133 SER H . 27259 1 1476 . 1 1 133 133 SER HA H 1 3.912 0.020 . 1 . . . . . 133 SER HA . 27259 1 1477 . 1 1 133 133 SER HB2 H 1 3.611 0.020 . 2 . . . . . 133 SER HB2 . 27259 1 1478 . 1 1 133 133 SER HB3 H 1 3.395 0.020 . 2 . . . . . 133 SER HB3 . 27259 1 1479 . 1 1 133 133 SER C C 13 175.722 0.3 . 1 . . . . . 133 SER C . 27259 1 1480 . 1 1 133 133 SER CA C 13 61.329 0.3 . 1 . . . . . 133 SER CA . 27259 1 1481 . 1 1 133 133 SER CB C 13 62.331 0.3 . 1 . . . . . 133 SER CB . 27259 1 1482 . 1 1 133 133 SER N N 15 115.955 0.3 . 1 . . . . . 133 SER N . 27259 1 1483 . 1 1 134 134 GLN H H 1 7.565 0.020 . 1 . . . . . 134 GLN H . 27259 1 1484 . 1 1 134 134 GLN HA H 1 4.136 0.020 . 1 . . . . . 134 GLN HA . 27259 1 1485 . 1 1 134 134 GLN HB2 H 1 2.127 0.020 . 1 . . . . . 134 GLN HB2 . 27259 1 1486 . 1 1 134 134 GLN HB3 H 1 2.127 0.020 . 1 . . . . . 134 GLN HB3 . 27259 1 1487 . 1 1 134 134 GLN HG2 H 1 2.514 0.020 . 2 . . . . . 134 GLN HG2 . 27259 1 1488 . 1 1 134 134 GLN HG3 H 1 2.403 0.020 . 2 . . . . . 134 GLN HG3 . 27259 1 1489 . 1 1 134 134 GLN HE21 H 1 7.450 0.020 . 1 . . . . . 134 GLN HE21 . 27259 1 1490 . 1 1 134 134 GLN HE22 H 1 6.786 0.020 . 1 . . . . . 134 GLN HE22 . 27259 1 1491 . 1 1 134 134 GLN C C 13 177.616 0.3 . 1 . . . . . 134 GLN C . 27259 1 1492 . 1 1 134 134 GLN CA C 13 58.263 0.3 . 1 . . . . . 134 GLN CA . 27259 1 1493 . 1 1 134 134 GLN CB C 13 28.074 0.3 . 1 . . . . . 134 GLN CB . 27259 1 1494 . 1 1 134 134 GLN CG C 13 33.829 0.3 . 1 . . . . . 134 GLN CG . 27259 1 1495 . 1 1 134 134 GLN N N 15 120.373 0.3 . 1 . . . . . 134 GLN N . 27259 1 1496 . 1 1 134 134 GLN NE2 N 15 111.824 0.3 . 1 . . . . . 134 GLN NE2 . 27259 1 1497 . 1 1 135 135 ALA H H 1 7.475 0.020 . 1 . . . . . 135 ALA H . 27259 1 1498 . 1 1 135 135 ALA HA H 1 4.186 0.020 . 1 . . . . . 135 ALA HA . 27259 1 1499 . 1 1 135 135 ALA HB1 H 1 1.436 0.020 . 1 . . . . . 135 ALA HB . 27259 1 1500 . 1 1 135 135 ALA HB2 H 1 1.436 0.020 . 1 . . . . . 135 ALA HB . 27259 1 1501 . 1 1 135 135 ALA HB3 H 1 1.436 0.020 . 1 . . . . . 135 ALA HB . 27259 1 1502 . 1 1 135 135 ALA C C 13 178.986 0.3 . 1 . . . . . 135 ALA C . 27259 1 1503 . 1 1 135 135 ALA CA C 13 54.063 0.3 . 1 . . . . . 135 ALA CA . 27259 1 1504 . 1 1 135 135 ALA CB C 13 18.227 0.3 . 1 . . . . . 135 ALA CB . 27259 1 1505 . 1 1 135 135 ALA N N 15 120.636 0.3 . 1 . . . . . 135 ALA N . 27259 1 1506 . 1 1 136 136 TYR H H 1 8.060 0.020 . 1 . . . . . 136 TYR H . 27259 1 1507 . 1 1 136 136 TYR HA H 1 4.170 0.020 . 1 . . . . . 136 TYR HA . 27259 1 1508 . 1 1 136 136 TYR HB2 H 1 3.036 0.020 . 2 . . . . . 136 TYR HB2 . 27259 1 1509 . 1 1 136 136 TYR HB3 H 1 2.836 0.020 . 2 . . . . . 136 TYR HB3 . 27259 1 1510 . 1 1 136 136 TYR HD1 H 1 6.673 0.020 . 1 . . . . . 136 TYR HD1 . 27259 1 1511 . 1 1 136 136 TYR HD2 H 1 6.673 0.020 . 1 . . . . . 136 TYR HD2 . 27259 1 1512 . 1 1 136 136 TYR C C 13 177.091 0.3 . 1 . . . . . 136 TYR C . 27259 1 1513 . 1 1 136 136 TYR CA C 13 60.463 0.3 . 1 . . . . . 136 TYR CA . 27259 1 1514 . 1 1 136 136 TYR CB C 13 38.910 0.3 . 1 . . . . . 136 TYR CB . 27259 1 1515 . 1 1 136 136 TYR N N 15 119.257 0.3 . 1 . . . . . 136 TYR N . 27259 1 1516 . 1 1 137 137 TYR H H 1 7.958 0.020 . 1 . . . . . 137 TYR H . 27259 1 1517 . 1 1 137 137 TYR HA H 1 4.378 0.020 . 1 . . . . . 137 TYR HA . 27259 1 1518 . 1 1 137 137 TYR HB2 H 1 3.186 0.020 . 2 . . . . . 137 TYR HB2 . 27259 1 1519 . 1 1 137 137 TYR HB3 H 1 2.953 0.020 . 2 . . . . . 137 TYR HB3 . 27259 1 1520 . 1 1 137 137 TYR HD1 H 1 7.156 0.020 . 1 . . . . . 137 TYR HD1 . 27259 1 1521 . 1 1 137 137 TYR HD2 H 1 7.156 0.020 . 1 . . . . . 137 TYR HD2 . 27259 1 1522 . 1 1 137 137 TYR HE1 H 1 6.687 0.020 . 1 . . . . . 137 TYR HE1 . 27259 1 1523 . 1 1 137 137 TYR HE2 H 1 6.687 0.020 . 1 . . . . . 137 TYR HE2 . 27259 1 1524 . 1 1 137 137 TYR C C 13 176.589 0.3 . 1 . . . . . 137 TYR C . 27259 1 1525 . 1 1 137 137 TYR CA C 13 59.196 0.3 . 1 . . . . . 137 TYR CA . 27259 1 1526 . 1 1 137 137 TYR CB C 13 37.920 0.3 . 1 . . . . . 137 TYR CB . 27259 1 1527 . 1 1 137 137 TYR N N 15 117.972 0.3 . 1 . . . . . 137 TYR N . 27259 1 1528 . 1 1 138 138 GLN H H 1 7.843 0.020 . 1 . . . . . 138 GLN H . 27259 1 1529 . 1 1 138 138 GLN HA H 1 4.253 0.020 . 1 . . . . . 138 GLN HA . 27259 1 1530 . 1 1 138 138 GLN HB2 H 1 2.152 0.020 . 2 . . . . . 138 GLN HB2 . 27259 1 1531 . 1 1 138 138 GLN HB3 H 1 2.077 0.020 . 2 . . . . . 138 GLN HB3 . 27259 1 1532 . 1 1 138 138 GLN HG2 H 1 2.394 0.020 . 1 . . . . . 138 GLN HG2 . 27259 1 1533 . 1 1 138 138 GLN HG3 H 1 2.394 0.020 . 1 . . . . . 138 GLN HG3 . 27259 1 1534 . 1 1 138 138 GLN HE21 H 1 7.465 0.020 . 1 . . . . . 138 GLN HE21 . 27259 1 1535 . 1 1 138 138 GLN HE22 H 1 6.815 0.020 . 1 . . . . . 138 GLN HE22 . 27259 1 1536 . 1 1 138 138 GLN C C 13 176.247 0.3 . 1 . . . . . 138 GLN C . 27259 1 1537 . 1 1 138 138 GLN CA C 13 56.362 0.3 . 1 . . . . . 138 GLN CA . 27259 1 1538 . 1 1 138 138 GLN CB C 13 28.574 0.3 . 1 . . . . . 138 GLN CB . 27259 1 1539 . 1 1 138 138 GLN CG C 13 33.751 0.3 . 1 . . . . . 138 GLN CG . 27259 1 1540 . 1 1 138 138 GLN N N 15 119.423 0.3 . 1 . . . . . 138 GLN N . 27259 1 1541 . 1 1 138 138 GLN NE2 N 15 111.923 0.3 . 1 . . . . . 138 GLN NE2 . 27259 1 1542 . 1 1 139 139 ARG H H 1 7.937 0.020 . 1 . . . . . 139 ARG H . 27259 1 1543 . 1 1 139 139 ARG HA H 1 4.278 0.020 . 1 . . . . . 139 ARG HA . 27259 1 1544 . 1 1 139 139 ARG HB2 H 1 1.861 0.020 . 2 . . . . . 139 ARG HB2 . 27259 1 1545 . 1 1 139 139 ARG HB3 H 1 1.811 0.020 . 2 . . . . . 139 ARG HB3 . 27259 1 1546 . 1 1 139 139 ARG HG2 H 1 1.702 0.020 . 2 . . . . . 139 ARG HG2 . 27259 1 1547 . 1 1 139 139 ARG HG3 H 1 1.636 0.020 . 2 . . . . . 139 ARG HG3 . 27259 1 1548 . 1 1 139 139 ARG HD2 H 1 3.181 0.020 . 2 . . . . . 139 ARG HD2 . 27259 1 1549 . 1 1 139 139 ARG HD3 H 1 3.158 0.020 . 2 . . . . . 139 ARG HD3 . 27259 1 1550 . 1 1 139 139 ARG HE H 1 7.142 0.020 . 1 . . . . . 139 ARG HE . 27259 1 1551 . 1 1 139 139 ARG C C 13 176.932 0.3 . 1 . . . . . 139 ARG C . 27259 1 1552 . 1 1 139 139 ARG CA C 13 56.946 0.3 . 1 . . . . . 139 ARG CA . 27259 1 1553 . 1 1 139 139 ARG CB C 13 30.410 0.3 . 1 . . . . . 139 ARG CB . 27259 1 1554 . 1 1 139 139 ARG CG C 13 26.828 0.3 . 1 . . . . . 139 ARG CG . 27259 1 1555 . 1 1 139 139 ARG CD C 13 43.241 0.3 . 1 . . . . . 139 ARG CD . 27259 1 1556 . 1 1 139 139 ARG N N 15 120.690 0.3 . 1 . . . . . 139 ARG N . 27259 1 1557 . 1 1 139 139 ARG NE N 15 84.509 0.3 . 1 . . . . . 139 ARG NE . 27259 1 1558 . 1 1 140 140 GLY H H 1 8.239 0.020 . 1 . . . . . 140 GLY H . 27259 1 1559 . 1 1 140 140 GLY HA2 H 1 4.003 0.020 . 1 . . . . . 140 GLY HA2 . 27259 1 1560 . 1 1 140 140 GLY HA3 H 1 4.003 0.020 . 1 . . . . . 140 GLY HA3 . 27259 1 1561 . 1 1 140 140 GLY C C 13 173.941 0.3 . 1 . . . . . 140 GLY C . 27259 1 1562 . 1 1 140 140 GLY CA C 13 45.197 0.3 . 1 . . . . . 140 GLY CA . 27259 1 1563 . 1 1 140 140 GLY N N 15 109.223 0.3 . 1 . . . . . 140 GLY N . 27259 1 1564 . 1 1 141 141 SER H H 1 8.129 0.020 . 1 . . . . . 141 SER H . 27259 1 1565 . 1 1 141 141 SER HA H 1 4.520 0.020 . 1 . . . . . 141 SER HA . 27259 1 1566 . 1 1 141 141 SER HB2 H 1 3.845 0.020 . 1 . . . . . 141 SER HB2 . 27259 1 1567 . 1 1 141 141 SER HB3 H 1 3.845 0.020 . 1 . . . . . 141 SER HB3 . 27259 1 1568 . 1 1 141 141 SER C C 13 173.667 0.3 . 1 . . . . . 141 SER C . 27259 1 1569 . 1 1 141 141 SER CA C 13 58.197 0.3 . 1 . . . . . 141 SER CA . 27259 1 1570 . 1 1 141 141 SER CB C 13 63.872 0.3 . 1 . . . . . 141 SER CB . 27259 1 1571 . 1 1 141 141 SER N N 15 115.660 0.3 . 1 . . . . . 141 SER N . 27259 1 1572 . 1 1 142 142 SER H H 1 8.002 0.020 . 1 . . . . . 142 SER H . 27259 1 1573 . 1 1 142 142 SER HA H 1 4.321 0.020 . 1 . . . . . 142 SER HA . 27259 1 1574 . 1 1 142 142 SER HB2 H 1 3.833 0.020 . 1 . . . . . 142 SER HB2 . 27259 1 1575 . 1 1 142 142 SER HB3 H 1 3.833 0.020 . 1 . . . . . 142 SER HB3 . 27259 1 1576 . 1 1 142 142 SER C C 13 174.192 0.3 . 1 . . . . . 142 SER C . 27259 1 1577 . 1 1 142 142 SER CA C 13 59.963 0.3 . 1 . . . . . 142 SER CA . 27259 1 1578 . 1 1 142 142 SER CB C 13 64.563 0.3 . 1 . . . . . 142 SER CB . 27259 1 1579 . 1 1 142 142 SER N N 15 122.746 0.3 . 1 . . . . . 142 SER N . 27259 1 stop_ save_