data_26748 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 26748 _Entry.Title ; NMR study of Met-1 Human Angiogenin - 1H, 13C, 15N backbone and side chain resonance assignment ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2016-02-19 _Entry.Accession_date 2016-02-19 _Entry.Last_release_date 2016-09-29 _Entry.Original_release_date 2016-09-29 _Entry.Origination author _Entry.NMR_STAR_version 3.1.2.6 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 Aikaterini Tsika . C. . . 26748 2 Dimitra Chatzileontiadou . S.M . . 26748 3 Demetres Leonidas . D. . . 26748 4 Georgios Spyroulias . A. . . 26748 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 26748 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 469 26748 '15N chemical shifts' 112 26748 '1H chemical shifts' 714 26748 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2016-09-29 . original BMRB . 26748 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 1AWZ '3D SOLUTION STRUCTURE OF HUMAN ANGIOGENIN DETERMINED BY 1H, 15N NMR SPECTROSCOPY, 30 STRUCTURES' 26748 PDB 2ANG 'CRYSTAL STRUCTURE OF HUMAN ANGIOGENIN OF THE MET(-1) FORM' 26748 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 26748 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 27624767 _Citation.Full_citation . _Citation.Title ; NMR study of Met-1 human Angiogenin: (1)H, (13)C, (15)N backbone and side-chain resonance assignment ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assign.' _Citation.Journal_name_full . _Citation.Journal_volume 10 _Citation.Journal_issue 2 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 379 _Citation.Page_last 383 _Citation.Year 2016 _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 Aikaterini Tsika . C. . . 26748 1 2 Dimitra Chatzileontiadou . S.M. . . 26748 1 3 Dimitra Leonidas . D. . . 26748 1 4 Georgios Spyroulias . A. . . 26748 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID Angiogenin 26748 1 'NMR spectroscopy' 26748 1 'RNase superfamily' 26748 1 angiogenesis 26748 1 'recombinant protein expression' 26748 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 26748 _Assembly.ID 1 _Assembly.Name 'Met-1 Human Ang' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass 14274.1 _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 'Met-1 Human Ang' 1 $Met-1_Human_Ang A . yes native yes yes . . . 26748 1 stop_ loop_ _Assembly_db_link.Author_supplied _Assembly_db_link.Database_code _Assembly_db_link.Accession_code _Assembly_db_link.Entry_mol_code _Assembly_db_link.Entry_mol_name _Assembly_db_link.Entry_experimental_method _Assembly_db_link.Entry_structure_resolution _Assembly_db_link.Entry_relation_type _Assembly_db_link.Entry_details _Assembly_db_link.Entry_ID _Assembly_db_link.Assembly_ID yes PDB 1AWZ . . 'solution NMR' . 'Three-dimensional solution structure of human angiogenin determined by 1H,15N-NMR spectroscopy' . 26748 1 yes PDB 2ANG . . X-ray 2.0 'RYSTAL STRUCTURE OF HUMAN ANGIOGENIN OF THE MET(-1) FORM' . 26748 1 stop_ loop_ _Assembly_bio_function.Biological_function _Assembly_bio_function.Entry_ID _Assembly_bio_function.Assembly_ID hydrolase 26748 1 'pancreatic ribonuclease' 26748 1 'stimulator of angiogenesis' 26748 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_Met-1_Human_Ang _Entity.Sf_category entity _Entity.Sf_framecode Met-1_Human_Ang _Entity.Entry_ID 26748 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name Met-1_Human_Ang _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 ; MQDNSRYTHFLTQHYDAKPQ GRDDRYCESIMRRRGLTSPC KDINTFIHGNKRSIKAICEN KNGNPHRENLRISKSSFQVT TCKLHGGSPWPPCQYRATAG FRNVVVACENGLPVHLDQSI FRRP ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states yes _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 124 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all disulfide bound' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment 'Met-1 Human Ang' _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 14274.1 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID hydrolase 26748 1 'pancreatic ribonuclease' 26748 1 'stimulator of angiogenesis' 26748 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 0 MET . 26748 1 2 1 GLN . 26748 1 3 2 ASP . 26748 1 4 3 ASN . 26748 1 5 4 SER . 26748 1 6 5 ARG . 26748 1 7 6 TYR . 26748 1 8 7 THR . 26748 1 9 8 HIS . 26748 1 10 9 PHE . 26748 1 11 10 LEU . 26748 1 12 11 THR . 26748 1 13 12 GLN . 26748 1 14 13 HIS . 26748 1 15 14 TYR . 26748 1 16 15 ASP . 26748 1 17 16 ALA . 26748 1 18 17 LYS . 26748 1 19 18 PRO . 26748 1 20 19 GLN . 26748 1 21 20 GLY . 26748 1 22 21 ARG . 26748 1 23 22 ASP . 26748 1 24 23 ASP . 26748 1 25 24 ARG . 26748 1 26 25 TYR . 26748 1 27 26 CYS . 26748 1 28 27 GLU . 26748 1 29 28 SER . 26748 1 30 29 ILE . 26748 1 31 30 MET . 26748 1 32 31 ARG . 26748 1 33 32 ARG . 26748 1 34 33 ARG . 26748 1 35 34 GLY . 26748 1 36 35 LEU . 26748 1 37 36 THR . 26748 1 38 37 SER . 26748 1 39 38 PRO . 26748 1 40 39 CYS . 26748 1 41 40 LYS . 26748 1 42 41 ASP . 26748 1 43 42 ILE . 26748 1 44 43 ASN . 26748 1 45 44 THR . 26748 1 46 45 PHE . 26748 1 47 46 ILE . 26748 1 48 47 HIS . 26748 1 49 48 GLY . 26748 1 50 49 ASN . 26748 1 51 50 LYS . 26748 1 52 51 ARG . 26748 1 53 52 SER . 26748 1 54 53 ILE . 26748 1 55 54 LYS . 26748 1 56 55 ALA . 26748 1 57 56 ILE . 26748 1 58 57 CYS . 26748 1 59 58 GLU . 26748 1 60 59 ASN . 26748 1 61 60 LYS . 26748 1 62 61 ASN . 26748 1 63 62 GLY . 26748 1 64 63 ASN . 26748 1 65 64 PRO . 26748 1 66 65 HIS . 26748 1 67 66 ARG . 26748 1 68 67 GLU . 26748 1 69 68 ASN . 26748 1 70 69 LEU . 26748 1 71 70 ARG . 26748 1 72 71 ILE . 26748 1 73 72 SER . 26748 1 74 73 LYS . 26748 1 75 74 SER . 26748 1 76 75 SER . 26748 1 77 76 PHE . 26748 1 78 77 GLN . 26748 1 79 78 VAL . 26748 1 80 79 THR . 26748 1 81 80 THR . 26748 1 82 81 CYS . 26748 1 83 82 LYS . 26748 1 84 83 LEU . 26748 1 85 84 HIS . 26748 1 86 85 GLY . 26748 1 87 86 GLY . 26748 1 88 87 SER . 26748 1 89 88 PRO . 26748 1 90 89 TRP . 26748 1 91 90 PRO . 26748 1 92 91 PRO . 26748 1 93 92 CYS . 26748 1 94 93 GLN . 26748 1 95 94 TYR . 26748 1 96 95 ARG . 26748 1 97 96 ALA . 26748 1 98 97 THR . 26748 1 99 98 ALA . 26748 1 100 99 GLY . 26748 1 101 100 PHE . 26748 1 102 101 ARG . 26748 1 103 102 ASN . 26748 1 104 103 VAL . 26748 1 105 104 VAL . 26748 1 106 105 VAL . 26748 1 107 106 ALA . 26748 1 108 107 CYS . 26748 1 109 108 GLU . 26748 1 110 109 ASN . 26748 1 111 110 GLY . 26748 1 112 111 LEU . 26748 1 113 112 PRO . 26748 1 114 113 VAL . 26748 1 115 114 HIS . 26748 1 116 115 LEU . 26748 1 117 116 ASP . 26748 1 118 117 GLN . 26748 1 119 118 SER . 26748 1 120 119 ILE . 26748 1 121 120 PHE . 26748 1 122 121 ARG . 26748 1 123 122 ARG . 26748 1 124 123 PRO . 26748 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 26748 1 . GLN 2 2 26748 1 . ASP 3 3 26748 1 . ASN 4 4 26748 1 . SER 5 5 26748 1 . ARG 6 6 26748 1 . TYR 7 7 26748 1 . THR 8 8 26748 1 . HIS 9 9 26748 1 . PHE 10 10 26748 1 . LEU 11 11 26748 1 . THR 12 12 26748 1 . GLN 13 13 26748 1 . HIS 14 14 26748 1 . TYR 15 15 26748 1 . ASP 16 16 26748 1 . ALA 17 17 26748 1 . LYS 18 18 26748 1 . PRO 19 19 26748 1 . GLN 20 20 26748 1 . GLY 21 21 26748 1 . ARG 22 22 26748 1 . ASP 23 23 26748 1 . ASP 24 24 26748 1 . ARG 25 25 26748 1 . TYR 26 26 26748 1 . CYS 27 27 26748 1 . GLU 28 28 26748 1 . SER 29 29 26748 1 . ILE 30 30 26748 1 . MET 31 31 26748 1 . ARG 32 32 26748 1 . ARG 33 33 26748 1 . ARG 34 34 26748 1 . GLY 35 35 26748 1 . LEU 36 36 26748 1 . THR 37 37 26748 1 . SER 38 38 26748 1 . PRO 39 39 26748 1 . CYS 40 40 26748 1 . LYS 41 41 26748 1 . ASP 42 42 26748 1 . ILE 43 43 26748 1 . ASN 44 44 26748 1 . THR 45 45 26748 1 . PHE 46 46 26748 1 . ILE 47 47 26748 1 . HIS 48 48 26748 1 . GLY 49 49 26748 1 . ASN 50 50 26748 1 . LYS 51 51 26748 1 . ARG 52 52 26748 1 . SER 53 53 26748 1 . ILE 54 54 26748 1 . LYS 55 55 26748 1 . ALA 56 56 26748 1 . ILE 57 57 26748 1 . CYS 58 58 26748 1 . GLU 59 59 26748 1 . ASN 60 60 26748 1 . LYS 61 61 26748 1 . ASN 62 62 26748 1 . GLY 63 63 26748 1 . ASN 64 64 26748 1 . PRO 65 65 26748 1 . HIS 66 66 26748 1 . ARG 67 67 26748 1 . GLU 68 68 26748 1 . ASN 69 69 26748 1 . LEU 70 70 26748 1 . ARG 71 71 26748 1 . ILE 72 72 26748 1 . SER 73 73 26748 1 . LYS 74 74 26748 1 . SER 75 75 26748 1 . SER 76 76 26748 1 . PHE 77 77 26748 1 . GLN 78 78 26748 1 . VAL 79 79 26748 1 . THR 80 80 26748 1 . THR 81 81 26748 1 . CYS 82 82 26748 1 . LYS 83 83 26748 1 . LEU 84 84 26748 1 . HIS 85 85 26748 1 . GLY 86 86 26748 1 . GLY 87 87 26748 1 . SER 88 88 26748 1 . PRO 89 89 26748 1 . TRP 90 90 26748 1 . PRO 91 91 26748 1 . PRO 92 92 26748 1 . CYS 93 93 26748 1 . GLN 94 94 26748 1 . TYR 95 95 26748 1 . ARG 96 96 26748 1 . ALA 97 97 26748 1 . THR 98 98 26748 1 . ALA 99 99 26748 1 . GLY 100 100 26748 1 . PHE 101 101 26748 1 . ARG 102 102 26748 1 . ASN 103 103 26748 1 . VAL 104 104 26748 1 . VAL 105 105 26748 1 . VAL 106 106 26748 1 . ALA 107 107 26748 1 . CYS 108 108 26748 1 . GLU 109 109 26748 1 . ASN 110 110 26748 1 . GLY 111 111 26748 1 . LEU 112 112 26748 1 . PRO 113 113 26748 1 . VAL 114 114 26748 1 . HIS 115 115 26748 1 . LEU 116 116 26748 1 . ASP 117 117 26748 1 . GLN 118 118 26748 1 . SER 119 119 26748 1 . ILE 120 120 26748 1 . PHE 121 121 26748 1 . ARG 122 122 26748 1 . ARG 123 123 26748 1 . PRO 124 124 26748 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 26748 _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 $Met-1_Human_Ang . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . ANG . 26748 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 26748 _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 $Met-1_Human_Ang . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli BL21 DE3 . . . . pET28a(+) . . . 26748 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 26748 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details ; Sodium Acetate 50mM EDTA 0.2mM pH 5 ; _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 'Met-1 Human Ang' '[U-99% 15N]' . . 1 $Met-1_Human_Ang . . 0.6 . . mM . . . . 26748 1 2 'Sodium Acetate' 'natural abundance' . . . . . . 50 . . mM . . . . 26748 1 3 EDTA 'natural abundance' . . . . . . 0.2 . . mM . . . . 26748 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 26748 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details ; Sodium Acetate 50mM EDTA 0.2mM pH 5 ; _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 'Met-1 Human Ang' '[U-99% 13C; U-99% 15N]' . . 1 $Met-1_Human_Ang . . 0.6 . . mM . . . . 26748 2 2 'Sodium Acetate' 'natural abundance' . . . . . . 50 . . mM . . . . 26748 2 3 EDTA 'natural abundance' . . . . . . 0.2 . . mM . . . . 26748 2 stop_ save_ save_sample_3 _Sample.Sf_category sample _Sample.Sf_framecode sample_3 _Sample.Entry_ID 26748 _Sample.ID 3 _Sample.Type solution _Sample.Sub_type . _Sample.Details ; Reverse Labeling [U-14N]Asn-Lys Sodium Acetate 50mM EDTA 0.2mM pH 5 ; _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 'Met-1 Human Ang' '[U-99% 15N]' . . 1 $Met-1_Human_Ang . . 0.3 . . mM . . . . 26748 3 2 'Sodium Acetate' 'natural abundance' . . . . . . 50 . . mM . . . . 26748 3 3 EDTA 'natural abundance' . . . . . . 0.2 . . mM . . . . 26748 3 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 26748 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 5 . pH 26748 1 pressure 1 . atm 26748 1 temperature 298 . K 26748 1 stop_ save_ save_sample_conditions_2 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_2 _Sample_condition_list.Entry_ID 26748 _Sample_condition_list.ID 2 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 5 . pH 26748 2 pressure 1 . atm 26748 2 temperature 298 . K 26748 2 stop_ save_ save_sample_conditions_3 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_3 _Sample_condition_list.Entry_ID 26748 _Sample_condition_list.ID 3 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 5 . pH 26748 3 pressure 1 . atm 26748 3 temperature 298 . K 26748 3 stop_ save_ ############################ # Computer software used # ############################ save_TOPSPIN _Software.Sf_category software _Software.Sf_framecode TOPSPIN _Software.Entry_ID 26748 _Software.ID 1 _Software.Name TOPSPIN _Software.Version '3.2 PI6' _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 26748 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 26748 1 processing 26748 1 stop_ save_ save_CARA _Software.Sf_category software _Software.Sf_framecode CARA _Software.Entry_ID 26748 _Software.ID 2 _Software.Name CARA _Software.Version 1.5.5 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'ROCHUS KELLER' . . 26748 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 26748 2 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 26748 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details 'TCI 5mm cryoprobe, 4 channels' _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'Avance HD-III HD' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 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 26748 _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 HD-III HD' . 700 'TCI 5mm cryoprobe, 4 channels' . . 26748 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 26748 _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 . . . . . . . . . . . . . . . . 26748 1 2 '2D 1H-15N HSQC' no . . . . . . . . . . 3 $sample_3 isotropic . . 3 $sample_conditions_3 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26748 1 3 '2D 1H-13C HSQC' no . . . . . . . . . . 2 $sample_2 isotropic . . 2 $sample_conditions_2 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26748 1 4 '3D CBCA(CO)NH' no . . . . . . . . . . 2 $sample_2 isotropic . . 2 $sample_conditions_2 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26748 1 5 '3D HNCACB' no . . . . . . . . . . 2 $sample_2 isotropic . . 2 $sample_conditions_2 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26748 1 6 '3D HNCA' no . . . . . . . . . . 2 $sample_2 isotropic . . 2 $sample_conditions_2 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26748 1 7 '3D HNCO' no . . . . . . . . . . 2 $sample_2 isotropic . . 2 $sample_conditions_2 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26748 1 8 '3D HN(CO)CA' no . . . . . . . . . . 2 $sample_2 isotropic . . 2 $sample_conditions_2 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26748 1 9 '3D HCCH-TOCSY' no . . . . . . . . . . 2 $sample_2 isotropic . . 2 $sample_conditions_2 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26748 1 10 '3D HBHA(CO)NH' no . . . . . . . . . . 2 $sample_2 isotropic . . 2 $sample_conditions_2 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26748 1 11 '2D 1H-13C HSQC' no . . . . . . . . . . 2 $sample_2 isotropic . . 2 $sample_conditions_2 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26748 1 12 '2D 1H-13C HSQC aliphatic' no . . . . . . . . . . 2 $sample_2 isotropic . . 2 $sample_conditions_2 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26748 1 13 '2D 1H-13C HSQC aromatic' no . . . . . . . . . . 2 $sample_2 isotropic . . 2 $sample_conditions_2 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26748 1 14 '3D HNHA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26748 1 15 '3D 1H-13C NOESY aliphatic' no . . . . . . . . . . 2 $sample_2 isotropic . . 2 $sample_conditions_2 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26748 1 16 '3D 1H-13C NOESY aromatic' no . . . . . . . . . . 2 $sample_2 isotropic . . 2 $sample_conditions_2 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26748 1 17 '3D H(CA)CO' no . . . . . . . . . . 2 $sample_2 isotropic . . 2 $sample_conditions_2 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26748 1 18 '2D 1H-15N HSQC' no . . . . . . . . . . 2 $sample_2 isotropic . . 2 $sample_conditions_2 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 26748 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 26748 _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 . . . . . 26748 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . 26748 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . 26748 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 26748 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 2 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_2 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 26748 1 2 '2D 1H-15N HSQC' . . . 26748 1 3 '2D 1H-13C HSQC' . . . 26748 1 4 '3D CBCA(CO)NH' . . . 26748 1 5 '3D HNCACB' . . . 26748 1 6 '3D HNCA' . . . 26748 1 7 '3D HNCO' . . . 26748 1 8 '3D HN(CO)CA' . . . 26748 1 9 '3D HCCH-TOCSY' . . . 26748 1 10 '3D HBHA(CO)NH' . . . 26748 1 12 '2D 1H-13C HSQC aliphatic' . . . 26748 1 13 '2D 1H-13C HSQC aromatic' . . . 26748 1 14 '3D HNHA' . . . 26748 1 15 '3D 1H-13C NOESY aliphatic' . . . 26748 1 16 '3D 1H-13C NOESY aromatic' . . . 26748 1 17 '3D H(CA)CO' . . . 26748 1 18 '2D 1H-15N HSQC' . . . 26748 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 2 2 GLN HA H 1 4.325 0.020 . 1 . . . . 1 GLN HA . 26748 1 2 . 1 1 2 2 GLN HB2 H 1 2.003 0.020 . 2 . . . . 1 GLN HB2 . 26748 1 3 . 1 1 2 2 GLN HB3 H 1 2.079 0.020 . 2 . . . . 1 GLN HB3 . 26748 1 4 . 1 1 2 2 GLN HG2 H 1 2.365 0.020 . 2 . . . . 1 GLN HG2 . 26748 1 5 . 1 1 2 2 GLN HG3 H 1 2.377 0.020 . 2 . . . . 1 GLN HG3 . 26748 1 6 . 1 1 2 2 GLN C C 13 174.981 0.3 . 1 . . . . 1 GLN C . 26748 1 7 . 1 1 2 2 GLN CA C 13 55.884 0.3 . 1 . . . . 1 GLN CA . 26748 1 8 . 1 1 2 2 GLN CB C 13 28.955 0.3 . 1 . . . . 1 GLN CB . 26748 1 9 . 1 1 2 2 GLN CG C 13 33.637 0.3 . 1 . . . . 1 GLN CG . 26748 1 10 . 1 1 3 3 ASP H H 1 8.602 0.020 . 1 . . . . 2 ASP H . 26748 1 11 . 1 1 3 3 ASP HA H 1 4.646 0.020 . 1 . . . . 2 ASP HA . 26748 1 12 . 1 1 3 3 ASP HB2 H 1 2.710 0.020 . 2 . . . . 2 ASP HB2 . 26748 1 13 . 1 1 3 3 ASP HB3 H 1 2.769 0.020 . 2 . . . . 2 ASP HB3 . 26748 1 14 . 1 1 3 3 ASP C C 13 176.098 0.3 . 1 . . . . 2 ASP C . 26748 1 15 . 1 1 3 3 ASP CA C 13 54.084 0.3 . 1 . . . . 2 ASP CA . 26748 1 16 . 1 1 3 3 ASP CB C 13 41.363 0.3 . 1 . . . . 2 ASP CB . 26748 1 17 . 1 1 3 3 ASP N N 15 122.948 0.3 . 1 . . . . 2 ASP N . 26748 1 18 . 1 1 4 4 ASN H H 1 8.677 0.020 . 1 . . . . 3 ASN H . 26748 1 19 . 1 1 4 4 ASN HA H 1 4.997 0.020 . 1 . . . . 3 ASN HA . 26748 1 20 . 1 1 4 4 ASN HB2 H 1 2.970 0.020 . 2 . . . . 3 ASN HB2 . 26748 1 21 . 1 1 4 4 ASN HB3 H 1 2.909 0.020 . 2 . . . . 3 ASN HB3 . 26748 1 22 . 1 1 4 4 ASN HD21 H 1 7.612 0.020 . 1 . . . . 3 ASN HD21 . 26748 1 23 . 1 1 4 4 ASN HD22 H 1 6.904 0.020 . 1 . . . . 3 ASN HD22 . 26748 1 24 . 1 1 4 4 ASN C C 13 176.426 0.3 . 1 . . . . 3 ASN C . 26748 1 25 . 1 1 4 4 ASN CA C 13 52.922 0.3 . 1 . . . . 3 ASN CA . 26748 1 26 . 1 1 4 4 ASN CB C 13 38.806 0.3 . 1 . . . . 3 ASN CB . 26748 1 27 . 1 1 4 4 ASN N N 15 121.982 0.3 . 1 . . . . 3 ASN N . 26748 1 28 . 1 1 4 4 ASN ND2 N 15 112.431 0.3 . 1 . . . . 3 ASN ND2 . 26748 1 29 . 1 1 5 5 SER H H 1 8.658 0.020 . 1 . . . . 4 SER H . 26748 1 30 . 1 1 5 5 SER HA H 1 4.303 0.020 . 1 . . . . 4 SER HA . 26748 1 31 . 1 1 5 5 SER HB2 H 1 4.020 0.020 . 2 . . . . 4 SER HB2 . 26748 1 32 . 1 1 5 5 SER HB3 H 1 3.998 0.020 . 2 . . . . 4 SER HB3 . 26748 1 33 . 1 1 5 5 SER C C 13 176.360 0.3 . 1 . . . . 4 SER C . 26748 1 34 . 1 1 5 5 SER CA C 13 61.052 0.3 . 1 . . . . 4 SER CA . 26748 1 35 . 1 1 5 5 SER CB C 13 63.337 0.3 . 1 . . . . 4 SER CB . 26748 1 36 . 1 1 5 5 SER N N 15 117.911 0.3 . 1 . . . . 4 SER N . 26748 1 37 . 1 1 6 6 ARG H H 1 8.698 0.020 . 1 . . . . 5 ARG H . 26748 1 38 . 1 1 6 6 ARG HA H 1 4.237 0.020 . 1 . . . . 5 ARG HA . 26748 1 39 . 1 1 6 6 ARG HB2 H 1 1.994 0.020 . 2 . . . . 5 ARG HB2 . 26748 1 40 . 1 1 6 6 ARG HB3 H 1 2.016 0.020 . 2 . . . . 5 ARG HB3 . 26748 1 41 . 1 1 6 6 ARG HG2 H 1 1.758 0.020 . 1 . . . . 5 ARG HG2 . 26748 1 42 . 1 1 6 6 ARG HG3 H 1 1.758 0.020 . 1 . . . . 5 ARG HG3 . 26748 1 43 . 1 1 6 6 ARG HD2 H 1 3.252 0.020 . 2 . . . . 5 ARG HD2 . 26748 1 44 . 1 1 6 6 ARG HD3 H 1 3.312 0.020 . 2 . . . . 5 ARG HD3 . 26748 1 45 . 1 1 6 6 ARG C C 13 179.942 0.3 . 1 . . . . 5 ARG C . 26748 1 46 . 1 1 6 6 ARG CA C 13 60.426 0.3 . 1 . . . . 5 ARG CA . 26748 1 47 . 1 1 6 6 ARG CB C 13 29.354 0.3 . 1 . . . . 5 ARG CB . 26748 1 48 . 1 1 6 6 ARG CG C 13 28.022 0.3 . 1 . . . . 5 ARG CG . 26748 1 49 . 1 1 6 6 ARG CD C 13 43.354 0.3 . 1 . . . . 5 ARG CD . 26748 1 50 . 1 1 6 6 ARG N N 15 122.785 0.3 . 1 . . . . 5 ARG N . 26748 1 51 . 1 1 7 7 TYR H H 1 8.560 0.020 . 1 . . . . 6 TYR H . 26748 1 52 . 1 1 7 7 TYR HA H 1 5.112 0.020 . 1 . . . . 6 TYR HA . 26748 1 53 . 1 1 7 7 TYR HB2 H 1 3.100 0.020 . 2 . . . . 6 TYR HB2 . 26748 1 54 . 1 1 7 7 TYR HB3 H 1 3.009 0.020 . 2 . . . . 6 TYR HB3 . 26748 1 55 . 1 1 7 7 TYR HD1 H 1 7.435 0.020 . 3 . . . . 6 TYR HD1 . 26748 1 56 . 1 1 7 7 TYR HD2 H 1 7.461 0.020 . 3 . . . . 6 TYR HD2 . 26748 1 57 . 1 1 7 7 TYR HE1 H 1 6.608 0.020 . 1 . . . . 6 TYR HE1 . 26748 1 58 . 1 1 7 7 TYR HE2 H 1 6.608 0.020 . 1 . . . . 6 TYR HE2 . 26748 1 59 . 1 1 7 7 TYR C C 13 177.107 0.3 . 1 . . . . 6 TYR C . 26748 1 60 . 1 1 7 7 TYR CA C 13 59.078 0.3 . 1 . . . . 6 TYR CA . 26748 1 61 . 1 1 7 7 TYR CB C 13 39.037 0.3 . 1 . . . . 6 TYR CB . 26748 1 62 . 1 1 7 7 TYR CD1 C 13 133.901 0.3 . 1 . . . . 6 TYR CD1 . 26748 1 63 . 1 1 7 7 TYR CD2 C 13 133.450 0.3 . 1 . . . . 6 TYR CD2 . 26748 1 64 . 1 1 7 7 TYR CE1 C 13 117.107 0.3 . 1 . . . . 6 TYR CE1 . 26748 1 65 . 1 1 7 7 TYR N N 15 123.896 0.3 . 1 . . . . 6 TYR N . 26748 1 66 . 1 1 8 8 THR H H 1 8.381 0.020 . 1 . . . . 7 THR H . 26748 1 67 . 1 1 8 8 THR HA H 1 4.261 0.020 . 1 . . . . 7 THR HA . 26748 1 68 . 1 1 8 8 THR HB H 1 3.641 0.020 . 1 . . . . 7 THR HB . 26748 1 69 . 1 1 8 8 THR HG21 H 1 1.257 0.020 . 1 . . . . 7 THR HG2 . 26748 1 70 . 1 1 8 8 THR HG22 H 1 1.257 0.020 . 1 . . . . 7 THR HG2 . 26748 1 71 . 1 1 8 8 THR HG23 H 1 1.257 0.020 . 1 . . . . 7 THR HG2 . 26748 1 72 . 1 1 8 8 THR C C 13 177.461 0.3 . 1 . . . . 7 THR C . 26748 1 73 . 1 1 8 8 THR CA C 13 66.917 0.3 . 1 . . . . 7 THR CA . 26748 1 74 . 1 1 8 8 THR CB C 13 67.833 0.3 . 1 . . . . 7 THR CB . 26748 1 75 . 1 1 8 8 THR CG2 C 13 22.084 0.3 . 1 . . . . 7 THR CG2 . 26748 1 76 . 1 1 8 8 THR N N 15 115.490 0.3 . 1 . . . . 7 THR N . 26748 1 77 . 1 1 9 9 HIS H H 1 8.381 0.020 . 1 . . . . 8 HIS H . 26748 1 78 . 1 1 9 9 HIS HA H 1 4.492 0.020 . 1 . . . . 8 HIS HA . 26748 1 79 . 1 1 9 9 HIS HB2 H 1 3.387 0.020 . 2 . . . . 8 HIS HB2 . 26748 1 80 . 1 1 9 9 HIS HB3 H 1 3.346 0.020 . 2 . . . . 8 HIS HB3 . 26748 1 81 . 1 1 9 9 HIS HD2 H 1 7.407 0.020 . 1 . . . . 8 HIS HD2 . 26748 1 82 . 1 1 9 9 HIS C C 13 176.317 0.3 . 1 . . . . 8 HIS C . 26748 1 83 . 1 1 9 9 HIS CA C 13 59.011 0.3 . 1 . . . . 8 HIS CA . 26748 1 84 . 1 1 9 9 HIS CB C 13 28.471 0.3 . 1 . . . . 8 HIS CB . 26748 1 85 . 1 1 9 9 HIS CD2 C 13 119.853 0.3 . 1 . . . . 8 HIS CD2 . 26748 1 86 . 1 1 9 9 HIS N N 15 120.767 0.3 . 1 . . . . 8 HIS N . 26748 1 87 . 1 1 10 10 PHE H H 1 8.194 0.020 . 1 . . . . 9 PHE H . 26748 1 88 . 1 1 10 10 PHE HA H 1 4.331 0.020 . 1 . . . . 9 PHE HA . 26748 1 89 . 1 1 10 10 PHE HB2 H 1 3.126 0.020 . 2 . . . . 9 PHE HB2 . 26748 1 90 . 1 1 10 10 PHE HB3 H 1 3.103 0.020 . 2 . . . . 9 PHE HB3 . 26748 1 91 . 1 1 10 10 PHE HD1 H 1 6.885 0.020 . 3 . . . . 9 PHE HD1 . 26748 1 92 . 1 1 10 10 PHE HD2 H 1 7.133 0.020 . 3 . . . . 9 PHE HD2 . 26748 1 93 . 1 1 10 10 PHE HE1 H 1 6.797 0.020 . 1 . . . . 9 PHE HE1 . 26748 1 94 . 1 1 10 10 PHE C C 13 177.052 0.3 . 1 . . . . 9 PHE C . 26748 1 95 . 1 1 10 10 PHE CA C 13 61.269 0.3 . 1 . . . . 9 PHE CA . 26748 1 96 . 1 1 10 10 PHE CB C 13 38.620 0.3 . 1 . . . . 9 PHE CB . 26748 1 97 . 1 1 10 10 PHE CD1 C 13 132.893 0.3 . 1 . . . . 9 PHE CD1 . 26748 1 98 . 1 1 10 10 PHE CD2 C 13 131.867 0.3 . 1 . . . . 9 PHE CD2 . 26748 1 99 . 1 1 10 10 PHE CE1 C 13 129.687 0.3 . 1 . . . . 9 PHE CE1 . 26748 1 100 . 1 1 10 10 PHE N N 15 122.319 0.3 . 1 . . . . 9 PHE N . 26748 1 101 . 1 1 11 11 LEU H H 1 8.403 0.020 . 1 . . . . 10 LEU H . 26748 1 102 . 1 1 11 11 LEU HA H 1 3.885 0.020 . 1 . . . . 10 LEU HA . 26748 1 103 . 1 1 11 11 LEU HB2 H 1 2.055 0.020 . 2 . . . . 10 LEU HB2 . 26748 1 104 . 1 1 11 11 LEU HB3 H 1 1.469 0.020 . 2 . . . . 10 LEU HB3 . 26748 1 105 . 1 1 11 11 LEU HG H 1 1.432 0.020 . 1 . . . . 10 LEU HG . 26748 1 106 . 1 1 11 11 LEU HD11 H 1 0.586 0.020 . 1 . . . . 10 LEU HD1 . 26748 1 107 . 1 1 11 11 LEU HD12 H 1 0.586 0.020 . 1 . . . . 10 LEU HD1 . 26748 1 108 . 1 1 11 11 LEU HD13 H 1 0.586 0.020 . 1 . . . . 10 LEU HD1 . 26748 1 109 . 1 1 11 11 LEU HD21 H 1 0.604 0.020 . 1 . . . . 10 LEU HD2 . 26748 1 110 . 1 1 11 11 LEU HD22 H 1 0.604 0.020 . 1 . . . . 10 LEU HD2 . 26748 1 111 . 1 1 11 11 LEU HD23 H 1 0.604 0.020 . 1 . . . . 10 LEU HD2 . 26748 1 112 . 1 1 11 11 LEU C C 13 180.814 0.3 . 1 . . . . 10 LEU C . 26748 1 113 . 1 1 11 11 LEU CA C 13 57.357 0.3 . 1 . . . . 10 LEU CA . 26748 1 114 . 1 1 11 11 LEU CB C 13 41.503 0.3 . 1 . . . . 10 LEU CB . 26748 1 115 . 1 1 11 11 LEU CG C 13 25.602 0.3 . 1 . . . . 10 LEU CG . 26748 1 116 . 1 1 11 11 LEU CD1 C 13 20.563 0.3 . 1 . . . . 10 LEU CD1 . 26748 1 117 . 1 1 11 11 LEU CD2 C 13 20.723 0.3 . 1 . . . . 10 LEU CD2 . 26748 1 118 . 1 1 11 11 LEU N N 15 120.078 0.3 . 1 . . . . 10 LEU N . 26748 1 119 . 1 1 12 12 THR H H 1 8.487 0.020 . 1 . . . . 11 THR H . 26748 1 120 . 1 1 12 12 THR HA H 1 3.976 0.020 . 1 . . . . 11 THR HA . 26748 1 121 . 1 1 12 12 THR HB H 1 4.326 0.020 . 1 . . . . 11 THR HB . 26748 1 122 . 1 1 12 12 THR HG21 H 1 1.313 0.020 . 1 . . . . 11 THR HG2 . 26748 1 123 . 1 1 12 12 THR HG22 H 1 1.313 0.020 . 1 . . . . 11 THR HG2 . 26748 1 124 . 1 1 12 12 THR HG23 H 1 1.313 0.020 . 1 . . . . 11 THR HG2 . 26748 1 125 . 1 1 12 12 THR C C 13 175.989 0.3 . 1 . . . . 11 THR C . 26748 1 126 . 1 1 12 12 THR CA C 13 66.337 0.3 . 1 . . . . 11 THR CA . 26748 1 127 . 1 1 12 12 THR CB C 13 68.641 0.3 . 1 . . . . 11 THR CB . 26748 1 128 . 1 1 12 12 THR CG2 C 13 22.131 0.3 . 1 . . . . 11 THR CG2 . 26748 1 129 . 1 1 12 12 THR N N 15 117.495 0.3 . 1 . . . . 11 THR N . 26748 1 130 . 1 1 13 13 GLN H H 1 7.786 0.020 . 1 . . . . 12 GLN H . 26748 1 131 . 1 1 13 13 GLN HA H 1 3.855 0.020 . 1 . . . . 12 GLN HA . 26748 1 132 . 1 1 13 13 GLN HB2 H 1 1.195 0.020 . 2 . . . . 12 GLN HB2 . 26748 1 133 . 1 1 13 13 GLN HB3 H 1 1.399 0.020 . 2 . . . . 12 GLN HB3 . 26748 1 134 . 1 1 13 13 GLN HG2 H 1 2.122 0.020 . 1 . . . . 12 GLN HG2 . 26748 1 135 . 1 1 13 13 GLN HG3 H 1 2.122 0.020 . 1 . . . . 12 GLN HG3 . 26748 1 136 . 1 1 13 13 GLN HE21 H 1 7.201 0.020 . 1 . . . . 12 GLN HE21 . 26748 1 137 . 1 1 13 13 GLN HE22 H 1 6.878 0.020 . 1 . . . . 12 GLN HE22 . 26748 1 138 . 1 1 13 13 GLN C C 13 175.690 0.3 . 1 . . . . 12 GLN C . 26748 1 139 . 1 1 13 13 GLN CA C 13 57.800 0.3 . 1 . . . . 12 GLN CA . 26748 1 140 . 1 1 13 13 GLN CB C 13 29.240 0.3 . 1 . . . . 12 GLN CB . 26748 1 141 . 1 1 13 13 GLN CG C 13 34.398 0.3 . 1 . . . . 12 GLN CG . 26748 1 142 . 1 1 13 13 GLN N N 15 115.947 0.3 . 1 . . . . 12 GLN N . 26748 1 143 . 1 1 13 13 GLN NE2 N 15 112.883 0.3 . 1 . . . . 12 GLN NE2 . 26748 1 144 . 1 1 14 14 HIS H H 1 7.920 0.020 . 1 . . . . 13 HIS H . 26748 1 145 . 1 1 14 14 HIS HA H 1 4.750 0.020 . 1 . . . . 13 HIS HA . 26748 1 146 . 1 1 14 14 HIS HB2 H 1 2.871 0.020 . 1 . . . . 13 HIS HB2 . 26748 1 147 . 1 1 14 14 HIS HB3 H 1 2.871 0.020 . 1 . . . . 13 HIS HB3 . 26748 1 148 . 1 1 14 14 HIS HD2 H 1 6.722 0.020 . 1 . . . . 13 HIS HD2 . 26748 1 149 . 1 1 14 14 HIS C C 13 173.782 0.3 . 1 . . . . 13 HIS C . 26748 1 150 . 1 1 14 14 HIS CA C 13 55.094 0.3 . 1 . . . . 13 HIS CA . 26748 1 151 . 1 1 14 14 HIS CB C 13 29.307 0.3 . 1 . . . . 13 HIS CB . 26748 1 152 . 1 1 14 14 HIS CD2 C 13 121.678 0.3 . 1 . . . . 13 HIS CD2 . 26748 1 153 . 1 1 14 14 HIS N N 15 106.871 0.3 . 1 . . . . 13 HIS N . 26748 1 154 . 1 1 15 15 TYR H H 1 8.729 0.020 . 1 . . . . 14 TYR H . 26748 1 155 . 1 1 15 15 TYR HA H 1 5.682 0.020 . 1 . . . . 14 TYR HA . 26748 1 156 . 1 1 15 15 TYR HB2 H 1 3.361 0.020 . 2 . . . . 14 TYR HB2 . 26748 1 157 . 1 1 15 15 TYR HB3 H 1 2.597 0.020 . 2 . . . . 14 TYR HB3 . 26748 1 158 . 1 1 15 15 TYR HD1 H 1 7.067 0.020 . 3 . . . . 14 TYR HD1 . 26748 1 159 . 1 1 15 15 TYR HD2 H 1 7.063 0.020 . 3 . . . . 14 TYR HD2 . 26748 1 160 . 1 1 15 15 TYR C C 13 174.409 0.3 . 1 . . . . 14 TYR C . 26748 1 161 . 1 1 15 15 TYR CA C 13 56.477 0.3 . 1 . . . . 14 TYR CA . 26748 1 162 . 1 1 15 15 TYR CB C 13 41.836 0.3 . 1 . . . . 14 TYR CB . 26748 1 163 . 1 1 15 15 TYR CD1 C 13 132.541 0.3 . 1 . . . . 14 TYR CD1 . 26748 1 164 . 1 1 15 15 TYR CD2 C 13 133.776 0.3 . 1 . . . . 14 TYR CD2 . 26748 1 165 . 1 1 15 15 TYR N N 15 121.284 0.3 . 1 . . . . 14 TYR N . 26748 1 166 . 1 1 16 16 ASP H H 1 8.241 0.020 . 1 . . . . 15 ASP H . 26748 1 167 . 1 1 16 16 ASP HA H 1 4.542 0.020 . 1 . . . . 15 ASP HA . 26748 1 168 . 1 1 16 16 ASP HB2 H 1 2.303 0.020 . 2 . . . . 15 ASP HB2 . 26748 1 169 . 1 1 16 16 ASP HB3 H 1 2.214 0.020 . 2 . . . . 15 ASP HB3 . 26748 1 170 . 1 1 16 16 ASP C C 13 174.790 0.3 . 1 . . . . 15 ASP C . 26748 1 171 . 1 1 16 16 ASP CA C 13 53.474 0.3 . 1 . . . . 15 ASP CA . 26748 1 172 . 1 1 16 16 ASP CB C 13 41.663 0.3 . 1 . . . . 15 ASP CB . 26748 1 173 . 1 1 16 16 ASP N N 15 128.065 0.3 . 1 . . . . 15 ASP N . 26748 1 174 . 1 1 17 17 ALA H H 1 8.343 0.020 . 1 . . . . 16 ALA H . 26748 1 175 . 1 1 17 17 ALA HA H 1 3.987 0.020 . 1 . . . . 16 ALA HA . 26748 1 176 . 1 1 17 17 ALA HB1 H 1 1.529 0.020 . 1 . . . . 16 ALA HB . 26748 1 177 . 1 1 17 17 ALA HB2 H 1 1.529 0.020 . 1 . . . . 16 ALA HB . 26748 1 178 . 1 1 17 17 ALA HB3 H 1 1.529 0.020 . 1 . . . . 16 ALA HB . 26748 1 179 . 1 1 17 17 ALA C C 13 178.633 0.3 . 1 . . . . 16 ALA C . 26748 1 180 . 1 1 17 17 ALA CA C 13 56.639 0.3 . 1 . . . . 16 ALA CA . 26748 1 181 . 1 1 17 17 ALA CB C 13 20.147 0.3 . 1 . . . . 16 ALA CB . 26748 1 182 . 1 1 17 17 ALA N N 15 129.160 0.3 . 1 . . . . 16 ALA N . 26748 1 183 . 1 1 18 18 LYS H H 1 8.352 0.020 . 1 . . . . 17 LYS H . 26748 1 184 . 1 1 18 18 LYS HA H 1 4.309 0.020 . 1 . . . . 17 LYS HA . 26748 1 185 . 1 1 18 18 LYS HB2 H 1 1.761 0.020 . 2 . . . . 17 LYS HB2 . 26748 1 186 . 1 1 18 18 LYS HB3 H 1 1.815 0.020 . 2 . . . . 17 LYS HB3 . 26748 1 187 . 1 1 18 18 LYS HG2 H 1 1.213 0.020 . 2 . . . . 17 LYS HG2 . 26748 1 188 . 1 1 18 18 LYS HG3 H 1 1.266 0.020 . 2 . . . . 17 LYS HG3 . 26748 1 189 . 1 1 18 18 LYS HD2 H 1 1.670 0.020 . 1 . . . . 17 LYS HD2 . 26748 1 190 . 1 1 18 18 LYS HD3 H 1 1.670 0.020 . 1 . . . . 17 LYS HD3 . 26748 1 191 . 1 1 18 18 LYS HE2 H 1 3.012 0.020 . 1 . . . . 17 LYS HE2 . 26748 1 192 . 1 1 18 18 LYS HE3 H 1 3.012 0.020 . 1 . . . . 17 LYS HE3 . 26748 1 193 . 1 1 18 18 LYS C C 13 172.392 0.3 . 1 . . . . 17 LYS C . 26748 1 194 . 1 1 18 18 LYS CA C 13 55.788 0.3 . 1 . . . . 17 LYS CA . 26748 1 195 . 1 1 18 18 LYS CB C 13 33.524 0.3 . 1 . . . . 17 LYS CB . 26748 1 196 . 1 1 18 18 LYS CG C 13 24.650 0.3 . 1 . . . . 17 LYS CG . 26748 1 197 . 1 1 18 18 LYS CD C 13 28.917 0.3 . 1 . . . . 17 LYS CD . 26748 1 198 . 1 1 18 18 LYS CE C 13 41.851 0.3 . 1 . . . . 17 LYS CE . 26748 1 199 . 1 1 18 18 LYS N N 15 116.856 0.3 . 1 . . . . 17 LYS N . 26748 1 200 . 1 1 19 19 PRO HA H 1 4.530 0.020 . 1 . . . . 18 PRO HA . 26748 1 201 . 1 1 19 19 PRO HB2 H 1 1.228 0.020 . 2 . . . . 18 PRO HB2 . 26748 1 202 . 1 1 19 19 PRO HB3 H 1 1.274 0.020 . 2 . . . . 18 PRO HB3 . 26748 1 203 . 1 1 19 19 PRO HG2 H 1 2.312 0.020 . 2 . . . . 18 PRO HG2 . 26748 1 204 . 1 1 19 19 PRO HG3 H 1 2.153 0.020 . 2 . . . . 18 PRO HG3 . 26748 1 205 . 1 1 19 19 PRO HD2 H 1 4.049 0.020 . 2 . . . . 18 PRO HD2 . 26748 1 206 . 1 1 19 19 PRO HD3 H 1 4.194 0.020 . 2 . . . . 18 PRO HD3 . 26748 1 207 . 1 1 19 19 PRO C C 13 177.598 0.3 . 1 . . . . 18 PRO C . 26748 1 208 . 1 1 19 19 PRO CA C 13 61.934 0.3 . 1 . . . . 18 PRO CA . 26748 1 209 . 1 1 19 19 PRO CB C 13 30.761 0.3 . 1 . . . . 18 PRO CB . 26748 1 210 . 1 1 19 19 PRO CG C 13 27.738 0.3 . 1 . . . . 18 PRO CG . 26748 1 211 . 1 1 19 19 PRO CD C 13 50.999 0.3 . 1 . . . . 18 PRO CD . 26748 1 212 . 1 1 20 20 GLN H H 1 8.170 0.020 . 1 . . . . 19 GLN H . 26748 1 213 . 1 1 20 20 GLN HA H 1 4.120 0.020 . 1 . . . . 19 GLN HA . 26748 1 214 . 1 1 20 20 GLN HB2 H 1 1.981 0.020 . 1 . . . . 19 GLN HB2 . 26748 1 215 . 1 1 20 20 GLN HB3 H 1 1.981 0.020 . 1 . . . . 19 GLN HB3 . 26748 1 216 . 1 1 20 20 GLN HG2 H 1 2.362 0.020 . 2 . . . . 19 GLN HG2 . 26748 1 217 . 1 1 20 20 GLN HG3 H 1 2.344 0.020 . 2 . . . . 19 GLN HG3 . 26748 1 218 . 1 1 20 20 GLN HE21 H 1 7.505 0.020 . 1 . . . . 19 GLN HE21 . 26748 1 219 . 1 1 20 20 GLN HE22 H 1 6.909 0.020 . 1 . . . . 19 GLN HE22 . 26748 1 220 . 1 1 20 20 GLN C C 13 175.662 0.3 . 1 . . . . 19 GLN C . 26748 1 221 . 1 1 20 20 GLN CA C 13 55.884 0.3 . 1 . . . . 19 GLN CA . 26748 1 222 . 1 1 20 20 GLN CB C 13 28.684 0.3 . 1 . . . . 19 GLN CB . 26748 1 223 . 1 1 20 20 GLN CG C 13 33.855 0.3 . 1 . . . . 19 GLN CG . 26748 1 224 . 1 1 20 20 GLN N N 15 121.248 0.3 . 1 . . . . 19 GLN N . 26748 1 225 . 1 1 21 21 GLY H H 1 7.475 0.020 . 1 . . . . 20 GLY H . 26748 1 226 . 1 1 21 21 GLY HA2 H 1 3.969 0.020 . 2 . . . . 20 GLY HA2 . 26748 1 227 . 1 1 21 21 GLY HA3 H 1 3.617 0.020 . 2 . . . . 20 GLY HA3 . 26748 1 228 . 1 1 21 21 GLY C C 13 171.219 0.3 . 1 . . . . 20 GLY C . 26748 1 229 . 1 1 21 21 GLY CA C 13 44.852 0.3 . 1 . . . . 20 GLY CA . 26748 1 230 . 1 1 21 21 GLY N N 15 108.878 0.3 . 1 . . . . 20 GLY N . 26748 1 231 . 1 1 22 22 ARG H H 1 7.702 0.020 . 1 . . . . 21 ARG H . 26748 1 232 . 1 1 22 22 ARG HA H 1 3.935 0.020 . 1 . . . . 21 ARG HA . 26748 1 233 . 1 1 22 22 ARG HB2 H 1 2.083 0.020 . 2 . . . . 21 ARG HB2 . 26748 1 234 . 1 1 22 22 ARG HB3 H 1 1.282 0.020 . 2 . . . . 21 ARG HB3 . 26748 1 235 . 1 1 22 22 ARG HG2 H 1 1.516 0.020 . 1 . . . . 21 ARG HG2 . 26748 1 236 . 1 1 22 22 ARG HG3 H 1 1.516 0.020 . 1 . . . . 21 ARG HG3 . 26748 1 237 . 1 1 22 22 ARG HD2 H 1 3.200 0.020 . 1 . . . . 21 ARG HD2 . 26748 1 238 . 1 1 22 22 ARG HD3 H 1 3.200 0.020 . 1 . . . . 21 ARG HD3 . 26748 1 239 . 1 1 22 22 ARG C C 13 173.673 0.3 . 1 . . . . 21 ARG C . 26748 1 240 . 1 1 22 22 ARG CA C 13 54.142 0.3 . 1 . . . . 21 ARG CA . 26748 1 241 . 1 1 22 22 ARG CB C 13 29.252 0.3 . 1 . . . . 21 ARG CB . 26748 1 242 . 1 1 22 22 ARG CG C 13 25.378 0.3 . 1 . . . . 21 ARG CG . 26748 1 243 . 1 1 22 22 ARG CD C 13 42.608 0.3 . 1 . . . . 21 ARG CD . 26748 1 244 . 1 1 22 22 ARG N N 15 114.122 0.3 . 1 . . . . 21 ARG N . 26748 1 245 . 1 1 23 23 ASP H H 1 7.716 0.020 . 1 . . . . 22 ASP H . 26748 1 246 . 1 1 23 23 ASP HA H 1 4.840 0.020 . 1 . . . . 22 ASP HA . 26748 1 247 . 1 1 23 23 ASP HB2 H 1 3.296 0.020 . 2 . . . . 22 ASP HB2 . 26748 1 248 . 1 1 23 23 ASP HB3 H 1 2.652 0.020 . 2 . . . . 22 ASP HB3 . 26748 1 249 . 1 1 23 23 ASP C C 13 176.453 0.3 . 1 . . . . 22 ASP C . 26748 1 250 . 1 1 23 23 ASP CA C 13 51.988 0.3 . 1 . . . . 22 ASP CA . 26748 1 251 . 1 1 23 23 ASP CB C 13 42.962 0.3 . 1 . . . . 22 ASP CB . 26748 1 252 . 1 1 23 23 ASP N N 15 117.955 0.3 . 1 . . . . 22 ASP N . 26748 1 253 . 1 1 24 24 ASP H H 1 8.155 0.020 . 1 . . . . 23 ASP H . 26748 1 254 . 1 1 24 24 ASP HA H 1 4.070 0.020 . 1 . . . . 23 ASP HA . 26748 1 255 . 1 1 24 24 ASP HB2 H 1 3.036 0.020 . 2 . . . . 23 ASP HB2 . 26748 1 256 . 1 1 24 24 ASP HB3 H 1 2.718 0.020 . 2 . . . . 23 ASP HB3 . 26748 1 257 . 1 1 24 24 ASP C C 13 178.115 0.3 . 1 . . . . 23 ASP C . 26748 1 258 . 1 1 24 24 ASP CA C 13 58.791 0.3 . 1 . . . . 23 ASP CA . 26748 1 259 . 1 1 24 24 ASP CB C 13 39.677 0.3 . 1 . . . . 23 ASP CB . 26748 1 260 . 1 1 24 24 ASP N N 15 121.580 0.3 . 1 . . . . 23 ASP N . 26748 1 261 . 1 1 25 25 ARG H H 1 7.736 0.020 . 1 . . . . 24 ARG H . 26748 1 262 . 1 1 25 25 ARG HA H 1 3.985 0.020 . 1 . . . . 24 ARG HA . 26748 1 263 . 1 1 25 25 ARG HB2 H 1 1.893 0.020 . 2 . . . . 24 ARG HB2 . 26748 1 264 . 1 1 25 25 ARG HB3 H 1 1.969 0.020 . 2 . . . . 24 ARG HB3 . 26748 1 265 . 1 1 25 25 ARG HG2 H 1 1.752 0.020 . 2 . . . . 24 ARG HG2 . 26748 1 266 . 1 1 25 25 ARG HG3 H 1 1.790 0.020 . 2 . . . . 24 ARG HG3 . 26748 1 267 . 1 1 25 25 ARG HD2 H 1 3.253 0.020 . 2 . . . . 24 ARG HD2 . 26748 1 268 . 1 1 25 25 ARG HD3 H 1 3.149 0.020 . 2 . . . . 24 ARG HD3 . 26748 1 269 . 1 1 25 25 ARG C C 13 179.424 0.3 . 1 . . . . 24 ARG C . 26748 1 270 . 1 1 25 25 ARG CA C 13 59.105 0.3 . 1 . . . . 24 ARG CA . 26748 1 271 . 1 1 25 25 ARG CB C 13 29.606 0.3 . 1 . . . . 24 ARG CB . 26748 1 272 . 1 1 25 25 ARG CG C 13 27.286 0.3 . 1 . . . . 24 ARG CG . 26748 1 273 . 1 1 25 25 ARG CD C 13 43.334 0.3 . 1 . . . . 24 ARG CD . 26748 1 274 . 1 1 25 25 ARG N N 15 117.841 0.3 . 1 . . . . 24 ARG N . 26748 1 275 . 1 1 26 26 TYR H H 1 7.974 0.020 . 1 . . . . 25 TYR H . 26748 1 276 . 1 1 26 26 TYR HA H 1 4.242 0.020 . 1 . . . . 25 TYR HA . 26748 1 277 . 1 1 26 26 TYR HB2 H 1 3.443 0.020 . 2 . . . . 25 TYR HB2 . 26748 1 278 . 1 1 26 26 TYR HB3 H 1 3.074 0.020 . 2 . . . . 25 TYR HB3 . 26748 1 279 . 1 1 26 26 TYR HD1 H 1 6.888 0.020 . 1 . . . . 25 TYR HD1 . 26748 1 280 . 1 1 26 26 TYR HE1 H 1 6.729 0.020 . 1 . . . . 25 TYR HE1 . 26748 1 281 . 1 1 26 26 TYR C C 13 177.052 0.3 . 1 . . . . 25 TYR C . 26748 1 282 . 1 1 26 26 TYR CA C 13 60.820 0.3 . 1 . . . . 25 TYR CA . 26748 1 283 . 1 1 26 26 TYR CB C 13 36.810 0.3 . 1 . . . . 25 TYR CB . 26748 1 284 . 1 1 26 26 TYR CD1 C 13 133.252 0.3 . 1 . . . . 25 TYR CD1 . 26748 1 285 . 1 1 26 26 TYR CD2 C 13 31.680 0.3 . 1 . . . . 25 TYR CD2 . 26748 1 286 . 1 1 26 26 TYR CE1 C 13 117.543 0.3 . 1 . . . . 25 TYR CE1 . 26748 1 287 . 1 1 26 26 TYR N N 15 122.529 0.3 . 1 . . . . 25 TYR N . 26748 1 288 . 1 1 27 27 CYS H H 1 8.056 0.020 . 1 . . . . 26 CYS H . 26748 1 289 . 1 1 27 27 CYS HA H 1 3.856 0.020 . 1 . . . . 26 CYS HA . 26748 1 290 . 1 1 27 27 CYS HB2 H 1 3.153 0.020 . 2 . . . . 26 CYS HB2 . 26748 1 291 . 1 1 27 27 CYS HB3 H 1 2.294 0.020 . 2 . . . . 26 CYS HB3 . 26748 1 292 . 1 1 27 27 CYS C C 13 175.908 0.3 . 1 . . . . 26 CYS C . 26748 1 293 . 1 1 27 27 CYS CA C 13 60.043 0.3 . 1 . . . . 26 CYS CA . 26748 1 294 . 1 1 27 27 CYS CB C 13 39.898 0.3 . 1 . . . . 26 CYS CB . 26748 1 295 . 1 1 27 27 CYS N N 15 115.854 0.3 . 1 . . . . 26 CYS N . 26748 1 296 . 1 1 28 28 GLU H H 1 8.373 0.020 . 1 . . . . 27 GLU H . 26748 1 297 . 1 1 28 28 GLU HA H 1 3.856 0.020 . 1 . . . . 27 GLU HA . 26748 1 298 . 1 1 28 28 GLU HB2 H 1 2.197 0.020 . 2 . . . . 27 GLU HB2 . 26748 1 299 . 1 1 28 28 GLU HB3 H 1 2.249 0.020 . 2 . . . . 27 GLU HB3 . 26748 1 300 . 1 1 28 28 GLU HG2 H 1 2.644 0.020 . 2 . . . . 27 GLU HG2 . 26748 1 301 . 1 1 28 28 GLU HG3 H 1 2.713 0.020 . 2 . . . . 27 GLU HG3 . 26748 1 302 . 1 1 28 28 GLU C C 13 178.170 0.3 . 1 . . . . 27 GLU C . 26748 1 303 . 1 1 28 28 GLU CA C 13 60.231 0.3 . 1 . . . . 27 GLU CA . 26748 1 304 . 1 1 28 28 GLU CB C 13 29.707 0.3 . 1 . . . . 27 GLU CB . 26748 1 305 . 1 1 28 28 GLU CG C 13 37.414 0.3 . 1 . . . . 27 GLU CG . 26748 1 306 . 1 1 28 28 GLU N N 15 117.550 0.3 . 1 . . . . 27 GLU N . 26748 1 307 . 1 1 29 29 SER H H 1 7.629 0.020 . 1 . . . . 28 SER H . 26748 1 308 . 1 1 29 29 SER HA H 1 4.278 0.020 . 1 . . . . 28 SER HA . 26748 1 309 . 1 1 29 29 SER HB2 H 1 3.938 0.020 . 2 . . . . 28 SER HB2 . 26748 1 310 . 1 1 29 29 SER HB3 H 1 3.976 0.020 . 2 . . . . 28 SER HB3 . 26748 1 311 . 1 1 29 29 SER C C 13 177.025 0.3 . 1 . . . . 28 SER C . 26748 1 312 . 1 1 29 29 SER CA C 13 60.558 0.3 . 1 . . . . 28 SER CA . 26748 1 313 . 1 1 29 29 SER CB C 13 63.274 0.3 . 1 . . . . 28 SER CB . 26748 1 314 . 1 1 29 29 SER N N 15 112.021 0.3 . 1 . . . . 28 SER N . 26748 1 315 . 1 1 30 30 ILE H H 1 8.773 0.020 . 1 . . . . 29 ILE H . 26748 1 316 . 1 1 30 30 ILE HA H 1 3.792 0.020 . 1 . . . . 29 ILE HA . 26748 1 317 . 1 1 30 30 ILE HB H 1 1.884 0.020 . 1 . . . . 29 ILE HB . 26748 1 318 . 1 1 30 30 ILE HG12 H 1 0.647 0.020 . 2 . . . . 29 ILE HG12 . 26748 1 319 . 1 1 30 30 ILE HG13 H 1 0.270 0.020 . 2 . . . . 29 ILE HG13 . 26748 1 320 . 1 1 30 30 ILE HG21 H 1 0.601 0.020 . 1 . . . . 29 ILE HG2 . 26748 1 321 . 1 1 30 30 ILE HG22 H 1 0.601 0.020 . 1 . . . . 29 ILE HG2 . 26748 1 322 . 1 1 30 30 ILE HG23 H 1 0.601 0.020 . 1 . . . . 29 ILE HG2 . 26748 1 323 . 1 1 30 30 ILE HD11 H 1 0.184 0.020 . 1 . . . . 29 ILE HD1 . 26748 1 324 . 1 1 30 30 ILE HD12 H 1 0.184 0.020 . 1 . . . . 29 ILE HD1 . 26748 1 325 . 1 1 30 30 ILE HD13 H 1 0.184 0.020 . 1 . . . . 29 ILE HD1 . 26748 1 326 . 1 1 30 30 ILE C C 13 176.589 0.3 . 1 . . . . 29 ILE C . 26748 1 327 . 1 1 30 30 ILE CA C 13 63.201 0.3 . 1 . . . . 29 ILE CA . 26748 1 328 . 1 1 30 30 ILE CB C 13 37.143 0.3 . 1 . . . . 29 ILE CB . 26748 1 329 . 1 1 30 30 ILE CG1 C 13 29.524 0.3 . 1 . . . . 29 ILE CG1 . 26748 1 330 . 1 1 30 30 ILE CG2 C 13 18.413 0.3 . 1 . . . . 29 ILE CG2 . 26748 1 331 . 1 1 30 30 ILE CD1 C 13 13.886 0.3 . 1 . . . . 29 ILE CD1 . 26748 1 332 . 1 1 30 30 ILE N N 15 123.143 0.3 . 1 . . . . 29 ILE N . 26748 1 333 . 1 1 31 31 MET H H 1 7.834 0.020 . 1 . . . . 30 MET H . 26748 1 334 . 1 1 31 31 MET HA H 1 4.154 0.020 . 1 . . . . 30 MET HA . 26748 1 335 . 1 1 31 31 MET HB2 H 1 1.671 0.020 . 2 . . . . 30 MET HB2 . 26748 1 336 . 1 1 31 31 MET HB3 H 1 1.824 0.020 . 2 . . . . 30 MET HB3 . 26748 1 337 . 1 1 31 31 MET HG2 H 1 1.933 0.020 . 2 . . . . 30 MET HG2 . 26748 1 338 . 1 1 31 31 MET HG3 H 1 2.355 0.020 . 2 . . . . 30 MET HG3 . 26748 1 339 . 1 1 31 31 MET C C 13 178.306 0.3 . 1 . . . . 30 MET C . 26748 1 340 . 1 1 31 31 MET CA C 13 57.985 0.3 . 1 . . . . 30 MET CA . 26748 1 341 . 1 1 31 31 MET CB C 13 29.072 0.3 . 1 . . . . 30 MET CB . 26748 1 342 . 1 1 31 31 MET CG C 13 32.679 0.3 . 1 . . . . 30 MET CG . 26748 1 343 . 1 1 31 31 MET CE C 13 18.517 0.3 . 1 . . . . 30 MET CE . 26748 1 344 . 1 1 31 31 MET N N 15 119.964 0.3 . 1 . . . . 30 MET N . 26748 1 345 . 1 1 32 32 ARG H H 1 6.750 0.020 . 1 . . . . 31 ARG H . 26748 1 346 . 1 1 32 32 ARG HA H 1 4.243 0.020 . 1 . . . . 31 ARG HA . 26748 1 347 . 1 1 32 32 ARG HB2 H 1 2.006 0.020 . 2 . . . . 31 ARG HB2 . 26748 1 348 . 1 1 32 32 ARG HB3 H 1 1.948 0.020 . 2 . . . . 31 ARG HB3 . 26748 1 349 . 1 1 32 32 ARG HG2 H 1 1.607 0.020 . 2 . . . . 31 ARG HG2 . 26748 1 350 . 1 1 32 32 ARG HG3 H 1 1.595 0.020 . 2 . . . . 31 ARG HG3 . 26748 1 351 . 1 1 32 32 ARG HD2 H 1 3.219 0.020 . 1 . . . . 31 ARG HD2 . 26748 1 352 . 1 1 32 32 ARG HD3 H 1 3.219 0.020 . 1 . . . . 31 ARG HD3 . 26748 1 353 . 1 1 32 32 ARG C C 13 180.650 0.3 . 1 . . . . 31 ARG C . 26748 1 354 . 1 1 32 32 ARG CA C 13 58.671 0.3 . 1 . . . . 31 ARG CA . 26748 1 355 . 1 1 32 32 ARG CB C 13 29.823 0.3 . 1 . . . . 31 ARG CB . 26748 1 356 . 1 1 32 32 ARG CG C 13 27.219 0.3 . 1 . . . . 31 ARG CG . 26748 1 357 . 1 1 32 32 ARG CD C 13 43.359 0.3 . 1 . . . . 31 ARG CD . 26748 1 358 . 1 1 32 32 ARG N N 15 116.968 0.3 . 1 . . . . 31 ARG N . 26748 1 359 . 1 1 33 33 ARG H H 1 8.464 0.020 . 1 . . . . 32 ARG H . 26748 1 360 . 1 1 33 33 ARG HA H 1 4.053 0.020 . 1 . . . . 32 ARG HA . 26748 1 361 . 1 1 33 33 ARG HB2 H 1 1.905 0.020 . 2 . . . . 32 ARG HB2 . 26748 1 362 . 1 1 33 33 ARG HB3 H 1 1.861 0.020 . 2 . . . . 32 ARG HB3 . 26748 1 363 . 1 1 33 33 ARG HG2 H 1 3.229 0.020 . 2 . . . . 32 ARG HG2 . 26748 1 364 . 1 1 33 33 ARG HG3 H 1 3.159 0.020 . 2 . . . . 32 ARG HG3 . 26748 1 365 . 1 1 33 33 ARG HD2 H 1 3.316 0.020 . 1 . . . . 32 ARG HD2 . 26748 1 366 . 1 1 33 33 ARG HD3 H 1 3.316 0.020 . 1 . . . . 32 ARG HD3 . 26748 1 367 . 1 1 33 33 ARG C C 13 178.552 0.3 . 1 . . . . 32 ARG C . 26748 1 368 . 1 1 33 33 ARG CA C 13 59.311 0.3 . 1 . . . . 32 ARG CA . 26748 1 369 . 1 1 33 33 ARG CB C 13 30.408 0.3 . 1 . . . . 32 ARG CB . 26748 1 370 . 1 1 33 33 ARG CG C 13 27.301 0.3 . 1 . . . . 32 ARG CG . 26748 1 371 . 1 1 33 33 ARG CD C 13 43.457 0.3 . 1 . . . . 32 ARG CD . 26748 1 372 . 1 1 33 33 ARG N N 15 121.172 0.3 . 1 . . . . 32 ARG N . 26748 1 373 . 1 1 34 34 ARG H H 1 7.989 0.020 . 1 . . . . 33 ARG H . 26748 1 374 . 1 1 34 34 ARG HA H 1 4.374 0.020 . 1 . . . . 33 ARG HA . 26748 1 375 . 1 1 34 34 ARG HB2 H 1 2.254 0.020 . 2 . . . . 33 ARG HB2 . 26748 1 376 . 1 1 34 34 ARG HB3 H 1 1.783 0.020 . 2 . . . . 33 ARG HB3 . 26748 1 377 . 1 1 34 34 ARG HG2 H 1 1.681 0.020 . 1 . . . . 33 ARG HG2 . 26748 1 378 . 1 1 34 34 ARG HG3 H 1 1.681 0.020 . 1 . . . . 33 ARG HG3 . 26748 1 379 . 1 1 34 34 ARG HD2 H 1 3.515 0.020 . 2 . . . . 33 ARG HD2 . 26748 1 380 . 1 1 34 34 ARG HD3 H 1 3.478 0.020 . 2 . . . . 33 ARG HD3 . 26748 1 381 . 1 1 34 34 ARG C C 13 175.826 0.3 . 1 . . . . 33 ARG C . 26748 1 382 . 1 1 34 34 ARG CA C 13 53.387 0.3 . 1 . . . . 33 ARG CA . 26748 1 383 . 1 1 34 34 ARG CB C 13 28.234 0.3 . 1 . . . . 33 ARG CB . 26748 1 384 . 1 1 34 34 ARG CG C 13 26.941 0.3 . 1 . . . . 33 ARG CG . 26748 1 385 . 1 1 34 34 ARG CD C 13 41.649 0.3 . 1 . . . . 33 ARG CD . 26748 1 386 . 1 1 34 34 ARG N N 15 113.452 0.3 . 1 . . . . 33 ARG N . 26748 1 387 . 1 1 35 35 GLY H H 1 7.637 0.020 . 1 . . . . 34 GLY H . 26748 1 388 . 1 1 35 35 GLY HA2 H 1 4.019 0.020 . 2 . . . . 34 GLY HA2 . 26748 1 389 . 1 1 35 35 GLY HA3 H 1 3.961 0.020 . 2 . . . . 34 GLY HA3 . 26748 1 390 . 1 1 35 35 GLY C C 13 176.426 0.3 . 1 . . . . 34 GLY C . 26748 1 391 . 1 1 35 35 GLY CA C 13 46.941 0.3 . 1 . . . . 34 GLY CA . 26748 1 392 . 1 1 35 35 GLY N N 15 106.644 0.3 . 1 . . . . 34 GLY N . 26748 1 393 . 1 1 36 36 LEU H H 1 8.161 0.020 . 1 . . . . 35 LEU H . 26748 1 394 . 1 1 36 36 LEU HA H 1 4.665 0.020 . 1 . . . . 35 LEU HA . 26748 1 395 . 1 1 36 36 LEU HB2 H 1 1.796 0.020 . 2 . . . . 35 LEU HB2 . 26748 1 396 . 1 1 36 36 LEU HB3 H 1 1.661 0.020 . 2 . . . . 35 LEU HB3 . 26748 1 397 . 1 1 36 36 LEU HG H 1 1.394 0.020 . 1 . . . . 35 LEU HG . 26748 1 398 . 1 1 36 36 LEU HD11 H 1 0.686 0.020 . 1 . . . . 35 LEU HD1 . 26748 1 399 . 1 1 36 36 LEU HD12 H 1 0.686 0.020 . 1 . . . . 35 LEU HD1 . 26748 1 400 . 1 1 36 36 LEU HD13 H 1 0.686 0.020 . 1 . . . . 35 LEU HD1 . 26748 1 401 . 1 1 36 36 LEU HD21 H 1 0.700 0.020 . 1 . . . . 35 LEU HD2 . 26748 1 402 . 1 1 36 36 LEU HD22 H 1 0.700 0.020 . 1 . . . . 35 LEU HD2 . 26748 1 403 . 1 1 36 36 LEU HD23 H 1 0.700 0.020 . 1 . . . . 35 LEU HD2 . 26748 1 404 . 1 1 36 36 LEU C C 13 175.090 0.3 . 1 . . . . 35 LEU C . 26748 1 405 . 1 1 36 36 LEU CA C 13 54.142 0.3 . 1 . . . . 35 LEU CA . 26748 1 406 . 1 1 36 36 LEU CB C 13 41.286 0.3 . 1 . . . . 35 LEU CB . 26748 1 407 . 1 1 36 36 LEU CG C 13 26.694 0.3 . 1 . . . . 35 LEU CG . 26748 1 408 . 1 1 36 36 LEU CD1 C 13 23.342 0.3 . 1 . . . . 35 LEU CD1 . 26748 1 409 . 1 1 36 36 LEU CD2 C 13 23.035 0.3 . 1 . . . . 35 LEU CD2 . 26748 1 410 . 1 1 36 36 LEU N N 15 119.657 0.3 . 1 . . . . 35 LEU N . 26748 1 411 . 1 1 37 37 THR H H 1 7.315 0.020 . 1 . . . . 36 THR H . 26748 1 412 . 1 1 37 37 THR HA H 1 4.679 0.020 . 1 . . . . 36 THR HA . 26748 1 413 . 1 1 37 37 THR HB H 1 4.864 0.020 . 1 . . . . 36 THR HB . 26748 1 414 . 1 1 37 37 THR HG21 H 1 1.034 0.020 . 1 . . . . 36 THR HG2 . 26748 1 415 . 1 1 37 37 THR HG22 H 1 1.034 0.020 . 1 . . . . 36 THR HG2 . 26748 1 416 . 1 1 37 37 THR HG23 H 1 1.034 0.020 . 1 . . . . 36 THR HG2 . 26748 1 417 . 1 1 37 37 THR C C 13 173.073 0.3 . 1 . . . . 36 THR C . 26748 1 418 . 1 1 37 37 THR CA C 13 60.530 0.3 . 1 . . . . 36 THR CA . 26748 1 419 . 1 1 37 37 THR CB C 13 68.925 0.3 . 1 . . . . 36 THR CB . 26748 1 420 . 1 1 37 37 THR CG2 C 13 21.477 0.3 . 1 . . . . 36 THR CG2 . 26748 1 421 . 1 1 37 37 THR N N 15 102.519 0.3 . 1 . . . . 36 THR N . 26748 1 422 . 1 1 38 38 SER H H 1 7.518 0.020 . 1 . . . . 37 SER H . 26748 1 423 . 1 1 38 38 SER HA H 1 4.854 0.020 . 1 . . . . 37 SER HA . 26748 1 424 . 1 1 38 38 SER HB2 H 1 3.691 0.020 . 2 . . . . 37 SER HB2 . 26748 1 425 . 1 1 38 38 SER HB3 H 1 3.888 0.020 . 2 . . . . 37 SER HB3 . 26748 1 426 . 1 1 38 38 SER C C 13 172.610 0.3 . 1 . . . . 37 SER C . 26748 1 427 . 1 1 38 38 SER CA C 13 54.606 0.3 . 1 . . . . 37 SER CA . 26748 1 428 . 1 1 38 38 SER CB C 13 63.621 0.3 . 1 . . . . 37 SER CB . 26748 1 429 . 1 1 38 38 SER N N 15 115.043 0.3 . 1 . . . . 37 SER N . 26748 1 430 . 1 1 39 39 PRO HA H 1 4.458 0.020 . 1 . . . . 38 PRO HA . 26748 1 431 . 1 1 39 39 PRO HB2 H 1 1.659 0.020 . 2 . . . . 38 PRO HB2 . 26748 1 432 . 1 1 39 39 PRO HB3 H 1 1.441 0.020 . 2 . . . . 38 PRO HB3 . 26748 1 433 . 1 1 39 39 PRO HG2 H 1 1.974 0.020 . 1 . . . . 38 PRO HG2 . 26748 1 434 . 1 1 39 39 PRO HG3 H 1 1.974 0.020 . 1 . . . . 38 PRO HG3 . 26748 1 435 . 1 1 39 39 PRO HD2 H 1 3.625 0.020 . 2 . . . . 38 PRO HD2 . 26748 1 436 . 1 1 39 39 PRO HD3 H 1 3.435 0.020 . 2 . . . . 38 PRO HD3 . 26748 1 437 . 1 1 39 39 PRO C C 13 175.553 0.3 . 1 . . . . 38 PRO C . 26748 1 438 . 1 1 39 39 PRO CA C 13 63.201 0.3 . 1 . . . . 38 PRO CA . 26748 1 439 . 1 1 39 39 PRO CB C 13 32.920 0.3 . 1 . . . . 38 PRO CB . 26748 1 440 . 1 1 39 39 PRO CG C 13 26.834 0.3 . 1 . . . . 38 PRO CG . 26748 1 441 . 1 1 39 39 PRO CD C 13 50.551 0.3 . 1 . . . . 38 PRO CD . 26748 1 442 . 1 1 40 40 CYS H H 1 8.001 0.020 . 1 . . . . 39 CYS H . 26748 1 443 . 1 1 40 40 CYS HA H 1 4.265 0.020 . 1 . . . . 39 CYS HA . 26748 1 444 . 1 1 40 40 CYS HB2 H 1 2.430 0.020 . 2 . . . . 39 CYS HB2 . 26748 1 445 . 1 1 40 40 CYS HB3 H 1 3.147 0.020 . 2 . . . . 39 CYS HB3 . 26748 1 446 . 1 1 40 40 CYS C C 13 174.981 0.3 . 1 . . . . 39 CYS C . 26748 1 447 . 1 1 40 40 CYS CA C 13 55.419 0.3 . 1 . . . . 39 CYS CA . 26748 1 448 . 1 1 40 40 CYS CB C 13 39.564 0.3 . 1 . . . . 39 CYS CB . 26748 1 449 . 1 1 40 40 CYS N N 15 114.478 0.3 . 1 . . . . 39 CYS N . 26748 1 450 . 1 1 41 41 LYS H H 1 7.895 0.020 . 1 . . . . 40 LYS H . 26748 1 451 . 1 1 41 41 LYS HA H 1 4.118 0.020 . 1 . . . . 40 LYS HA . 26748 1 452 . 1 1 41 41 LYS HB2 H 1 1.692 0.020 . 2 . . . . 40 LYS HB2 . 26748 1 453 . 1 1 41 41 LYS HB3 H 1 1.767 0.020 . 2 . . . . 40 LYS HB3 . 26748 1 454 . 1 1 41 41 LYS HG2 H 1 1.461 0.020 . 2 . . . . 40 LYS HG2 . 26748 1 455 . 1 1 41 41 LYS HG3 H 1 1.396 0.020 . 2 . . . . 40 LYS HG3 . 26748 1 456 . 1 1 41 41 LYS HD2 H 1 1.823 0.020 . 1 . . . . 40 LYS HD2 . 26748 1 457 . 1 1 41 41 LYS HD3 H 1 1.823 0.020 . 1 . . . . 40 LYS HD3 . 26748 1 458 . 1 1 41 41 LYS HE2 H 1 3.100 0.020 . 2 . . . . 40 LYS HE2 . 26748 1 459 . 1 1 41 41 LYS HE3 H 1 3.193 0.020 . 2 . . . . 40 LYS HE3 . 26748 1 460 . 1 1 41 41 LYS C C 13 177.816 0.3 . 1 . . . . 40 LYS C . 26748 1 461 . 1 1 41 41 LYS CA C 13 55.847 0.3 . 1 . . . . 40 LYS CA . 26748 1 462 . 1 1 41 41 LYS CB C 13 33.915 0.3 . 1 . . . . 40 LYS CB . 26748 1 463 . 1 1 41 41 LYS CG C 13 25.356 0.3 . 1 . . . . 40 LYS CG . 26748 1 464 . 1 1 41 41 LYS CD C 13 29.426 0.3 . 1 . . . . 40 LYS CD . 26748 1 465 . 1 1 41 41 LYS CE C 13 42.121 0.3 . 1 . . . . 40 LYS CE . 26748 1 466 . 1 1 41 41 LYS N N 15 126.917 0.3 . 1 . . . . 40 LYS N . 26748 1 467 . 1 1 42 42 ASP H H 1 8.800 0.020 . 1 . . . . 41 ASP H . 26748 1 468 . 1 1 42 42 ASP HA H 1 4.856 0.020 . 1 . . . . 41 ASP HA . 26748 1 469 . 1 1 42 42 ASP HB2 H 1 2.798 0.020 . 2 . . . . 41 ASP HB2 . 26748 1 470 . 1 1 42 42 ASP HB3 H 1 2.744 0.020 . 2 . . . . 41 ASP HB3 . 26748 1 471 . 1 1 42 42 ASP C C 13 175.799 0.3 . 1 . . . . 41 ASP C . 26748 1 472 . 1 1 42 42 ASP CA C 13 57.161 0.3 . 1 . . . . 41 ASP CA . 26748 1 473 . 1 1 42 42 ASP CB C 13 40.037 0.3 . 1 . . . . 41 ASP CB . 26748 1 474 . 1 1 42 42 ASP N N 15 125.671 0.3 . 1 . . . . 41 ASP N . 26748 1 475 . 1 1 43 43 ILE H H 1 7.871 0.020 . 1 . . . . 42 ILE H . 26748 1 476 . 1 1 43 43 ILE HA H 1 5.340 0.020 . 1 . . . . 42 ILE HA . 26748 1 477 . 1 1 43 43 ILE HB H 1 1.887 0.020 . 1 . . . . 42 ILE HB . 26748 1 478 . 1 1 43 43 ILE HG12 H 1 1.409 0.020 . 2 . . . . 42 ILE HG12 . 26748 1 479 . 1 1 43 43 ILE HG13 H 1 0.898 0.020 . 2 . . . . 42 ILE HG13 . 26748 1 480 . 1 1 43 43 ILE HG21 H 1 0.777 0.020 . 1 . . . . 42 ILE HG2 . 26748 1 481 . 1 1 43 43 ILE HG22 H 1 0.777 0.020 . 1 . . . . 42 ILE HG2 . 26748 1 482 . 1 1 43 43 ILE HG23 H 1 0.777 0.020 . 1 . . . . 42 ILE HG2 . 26748 1 483 . 1 1 43 43 ILE HD11 H 1 0.795 0.020 . 1 . . . . 42 ILE HD1 . 26748 1 484 . 1 1 43 43 ILE HD12 H 1 0.795 0.020 . 1 . . . . 42 ILE HD1 . 26748 1 485 . 1 1 43 43 ILE HD13 H 1 0.795 0.020 . 1 . . . . 42 ILE HD1 . 26748 1 486 . 1 1 43 43 ILE C C 13 173.100 0.3 . 1 . . . . 42 ILE C . 26748 1 487 . 1 1 43 43 ILE CA C 13 59.426 0.3 . 1 . . . . 42 ILE CA . 26748 1 488 . 1 1 43 43 ILE CB C 13 40.418 0.3 . 1 . . . . 42 ILE CB . 26748 1 489 . 1 1 43 43 ILE CG1 C 13 29.121 0.3 . 1 . . . . 42 ILE CG1 . 26748 1 490 . 1 1 43 43 ILE CG2 C 13 17.953 0.3 . 1 . . . . 42 ILE CG2 . 26748 1 491 . 1 1 43 43 ILE CD1 C 13 14.441 0.3 . 1 . . . . 42 ILE CD1 . 26748 1 492 . 1 1 43 43 ILE N N 15 117.210 0.3 . 1 . . . . 42 ILE N . 26748 1 493 . 1 1 44 44 ASN H H 1 8.425 0.020 . 1 . . . . 43 ASN H . 26748 1 494 . 1 1 44 44 ASN HA H 1 4.630 0.020 . 1 . . . . 43 ASN HA . 26748 1 495 . 1 1 44 44 ASN HB2 H 1 2.270 0.020 . 2 . . . . 43 ASN HB2 . 26748 1 496 . 1 1 44 44 ASN HB3 H 1 2.164 0.020 . 2 . . . . 43 ASN HB3 . 26748 1 497 . 1 1 44 44 ASN HD21 H 1 6.934 0.020 . 1 . . . . 43 ASN HD21 . 26748 1 498 . 1 1 44 44 ASN C C 13 173.209 0.3 . 1 . . . . 43 ASN C . 26748 1 499 . 1 1 44 44 ASN CA C 13 54.490 0.3 . 1 . . . . 43 ASN CA . 26748 1 500 . 1 1 44 44 ASN CB C 13 44.299 0.3 . 1 . . . . 43 ASN CB . 26748 1 501 . 1 1 44 44 ASN N N 15 121.578 0.3 . 1 . . . . 43 ASN N . 26748 1 502 . 1 1 44 44 ASN ND2 N 15 113.015 0.3 . 1 . . . . 43 ASN ND2 . 26748 1 503 . 1 1 45 45 THR H H 1 8.588 0.020 . 1 . . . . 44 THR H . 26748 1 504 . 1 1 45 45 THR HA H 1 4.939 0.020 . 1 . . . . 44 THR HA . 26748 1 505 . 1 1 45 45 THR HB H 1 3.045 0.020 . 1 . . . . 44 THR HB . 26748 1 506 . 1 1 45 45 THR HG21 H 1 0.122 0.020 . 1 . . . . 44 THR HG2 . 26748 1 507 . 1 1 45 45 THR HG22 H 1 0.122 0.020 . 1 . . . . 44 THR HG2 . 26748 1 508 . 1 1 45 45 THR HG23 H 1 0.122 0.020 . 1 . . . . 44 THR HG2 . 26748 1 509 . 1 1 45 45 THR C C 13 172.119 0.3 . 1 . . . . 44 THR C . 26748 1 510 . 1 1 45 45 THR CA C 13 62.518 0.3 . 1 . . . . 44 THR CA . 26748 1 511 . 1 1 45 45 THR CB C 13 69.241 0.3 . 1 . . . . 44 THR CB . 26748 1 512 . 1 1 45 45 THR CG2 C 13 19.783 0.3 . 1 . . . . 44 THR CG2 . 26748 1 513 . 1 1 45 45 THR N N 15 124.421 0.3 . 1 . . . . 44 THR N . 26748 1 514 . 1 1 46 46 PHE H H 1 9.172 0.020 . 1 . . . . 45 PHE H . 26748 1 515 . 1 1 46 46 PHE HA H 1 4.388 0.020 . 1 . . . . 45 PHE HA . 26748 1 516 . 1 1 46 46 PHE HB2 H 1 2.851 0.020 . 2 . . . . 45 PHE HB2 . 26748 1 517 . 1 1 46 46 PHE HB3 H 1 2.485 0.020 . 2 . . . . 45 PHE HB3 . 26748 1 518 . 1 1 46 46 PHE HD1 H 1 7.018 0.020 . 1 . . . . 45 PHE HD1 . 26748 1 519 . 1 1 46 46 PHE C C 13 172.555 0.3 . 1 . . . . 45 PHE C . 26748 1 520 . 1 1 46 46 PHE CA C 13 56.871 0.3 . 1 . . . . 45 PHE CA . 26748 1 521 . 1 1 46 46 PHE CB C 13 41.837 0.3 . 1 . . . . 45 PHE CB . 26748 1 522 . 1 1 46 46 PHE N N 15 125.601 0.3 . 1 . . . . 45 PHE N . 26748 1 523 . 1 1 47 47 ILE H H 1 8.968 0.020 . 1 . . . . 46 ILE H . 26748 1 524 . 1 1 47 47 ILE HA H 1 3.848 0.020 . 1 . . . . 46 ILE HA . 26748 1 525 . 1 1 47 47 ILE HB H 1 1.580 0.020 . 1 . . . . 46 ILE HB . 26748 1 526 . 1 1 47 47 ILE HG12 H 1 1.531 0.020 . 1 . . . . 46 ILE HG12 . 26748 1 527 . 1 1 47 47 ILE HG13 H 1 1.531 0.020 . 1 . . . . 46 ILE HG13 . 26748 1 528 . 1 1 47 47 ILE HG21 H 1 0.657 0.020 . 1 . . . . 46 ILE HG2 . 26748 1 529 . 1 1 47 47 ILE HG22 H 1 0.657 0.020 . 1 . . . . 46 ILE HG2 . 26748 1 530 . 1 1 47 47 ILE HG23 H 1 0.657 0.020 . 1 . . . . 46 ILE HG2 . 26748 1 531 . 1 1 47 47 ILE HD11 H 1 0.584 0.020 . 1 . . . . 46 ILE HD1 . 26748 1 532 . 1 1 47 47 ILE HD12 H 1 0.584 0.020 . 1 . . . . 46 ILE HD1 . 26748 1 533 . 1 1 47 47 ILE HD13 H 1 0.584 0.020 . 1 . . . . 46 ILE HD1 . 26748 1 534 . 1 1 47 47 ILE C C 13 174.245 0.3 . 1 . . . . 46 ILE C . 26748 1 535 . 1 1 47 47 ILE CA C 13 60.239 0.3 . 1 . . . . 46 ILE CA . 26748 1 536 . 1 1 47 47 ILE CB C 13 39.974 0.3 . 1 . . . . 46 ILE CB . 26748 1 537 . 1 1 47 47 ILE CG1 C 13 26.863 0.3 . 1 . . . . 46 ILE CG1 . 26748 1 538 . 1 1 47 47 ILE CG2 C 13 19.051 0.3 . 1 . . . . 46 ILE CG2 . 26748 1 539 . 1 1 47 47 ILE CD1 C 13 14.198 0.3 . 1 . . . . 46 ILE CD1 . 26748 1 540 . 1 1 47 47 ILE N N 15 121.700 0.3 . 1 . . . . 46 ILE N . 26748 1 541 . 1 1 48 48 HIS H H 1 8.367 0.020 . 1 . . . . 47 HIS H . 26748 1 542 . 1 1 48 48 HIS HA H 1 5.575 0.020 . 1 . . . . 47 HIS HA . 26748 1 543 . 1 1 48 48 HIS HB2 H 1 3.119 0.020 . 2 . . . . 47 HIS HB2 . 26748 1 544 . 1 1 48 48 HIS HB3 H 1 2.985 0.020 . 2 . . . . 47 HIS HB3 . 26748 1 545 . 1 1 48 48 HIS HD2 H 1 6.186 0.020 . 1 . . . . 47 HIS HD2 . 26748 1 546 . 1 1 48 48 HIS C C 13 175.608 0.3 . 1 . . . . 47 HIS C . 26748 1 547 . 1 1 48 48 HIS CA C 13 52.399 0.3 . 1 . . . . 47 HIS CA . 26748 1 548 . 1 1 48 48 HIS CB C 13 29.823 0.3 . 1 . . . . 47 HIS CB . 26748 1 549 . 1 1 48 48 HIS CD2 C 13 127.175 0.3 . 1 . . . . 47 HIS CD2 . 26748 1 550 . 1 1 48 48 HIS N N 15 124.455 0.3 . 1 . . . . 47 HIS N . 26748 1 551 . 1 1 49 49 GLY H H 1 8.590 0.020 . 1 . . . . 48 GLY H . 26748 1 552 . 1 1 49 49 GLY HA2 H 1 4.845 0.020 . 2 . . . . 48 GLY HA2 . 26748 1 553 . 1 1 49 49 GLY HA3 H 1 3.986 0.020 . 2 . . . . 48 GLY HA3 . 26748 1 554 . 1 1 49 49 GLY C C 13 173.509 0.3 . 1 . . . . 48 GLY C . 26748 1 555 . 1 1 49 49 GLY CA C 13 44.489 0.3 . 1 . . . . 48 GLY CA . 26748 1 556 . 1 1 49 49 GLY N N 15 107.976 0.3 . 1 . . . . 48 GLY N . 26748 1 557 . 1 1 50 50 ASN H H 1 9.010 0.020 . 1 . . . . 49 ASN H . 26748 1 558 . 1 1 50 50 ASN HA H 1 4.558 0.020 . 1 . . . . 49 ASN HA . 26748 1 559 . 1 1 50 50 ASN HB2 H 1 3.039 0.020 . 1 . . . . 49 ASN HB2 . 26748 1 560 . 1 1 50 50 ASN HB3 H 1 3.039 0.020 . 1 . . . . 49 ASN HB3 . 26748 1 561 . 1 1 50 50 ASN C C 13 176.289 0.3 . 1 . . . . 49 ASN C . 26748 1 562 . 1 1 50 50 ASN CA C 13 53.567 0.3 . 1 . . . . 49 ASN CA . 26748 1 563 . 1 1 50 50 ASN CB C 13 39.583 0.3 . 1 . . . . 49 ASN CB . 26748 1 564 . 1 1 50 50 ASN N N 15 122.042 0.3 . 1 . . . . 49 ASN N . 26748 1 565 . 1 1 51 51 LYS H H 1 9.019 0.020 . 1 . . . . 50 LYS H . 26748 1 566 . 1 1 51 51 LYS HA H 1 4.600 0.020 . 1 . . . . 50 LYS HA . 26748 1 567 . 1 1 51 51 LYS HB2 H 1 1.840 0.020 . 2 . . . . 50 LYS HB2 . 26748 1 568 . 1 1 51 51 LYS HB3 H 1 1.862 0.020 . 2 . . . . 50 LYS HB3 . 26748 1 569 . 1 1 51 51 LYS HG2 H 1 0.835 0.020 . 1 . . . . 50 LYS HG2 . 26748 1 570 . 1 1 51 51 LYS HG3 H 1 0.835 0.020 . 1 . . . . 50 LYS HG3 . 26748 1 571 . 1 1 51 51 LYS C C 13 178.824 0.3 . 1 . . . . 50 LYS C . 26748 1 572 . 1 1 51 51 LYS CA C 13 59.929 0.3 . 1 . . . . 50 LYS CA . 26748 1 573 . 1 1 51 51 LYS CB C 13 34.459 0.3 . 1 . . . . 50 LYS CB . 26748 1 574 . 1 1 51 51 LYS CG C 13 22.656 0.3 . 1 . . . . 50 LYS CG . 26748 1 575 . 1 1 51 51 LYS N N 15 126.361 0.3 . 1 . . . . 50 LYS N . 26748 1 576 . 1 1 52 52 ARG HA H 1 4.030 0.020 . 1 . . . . 51 ARG HA . 26748 1 577 . 1 1 52 52 ARG HB2 H 1 1.956 0.020 . 2 . . . . 51 ARG HB2 . 26748 1 578 . 1 1 52 52 ARG HB3 H 1 1.891 0.020 . 2 . . . . 51 ARG HB3 . 26748 1 579 . 1 1 52 52 ARG HG2 H 1 1.703 0.020 . 1 . . . . 51 ARG HG2 . 26748 1 580 . 1 1 52 52 ARG HG3 H 1 1.703 0.020 . 1 . . . . 51 ARG HG3 . 26748 1 581 . 1 1 52 52 ARG HD2 H 1 3.151 0.020 . 1 . . . . 51 ARG HD2 . 26748 1 582 . 1 1 52 52 ARG HD3 H 1 3.151 0.020 . 1 . . . . 51 ARG HD3 . 26748 1 583 . 1 1 52 52 ARG C C 13 179.178 0.3 . 1 . . . . 51 ARG C . 26748 1 584 . 1 1 52 52 ARG CA C 13 59.484 0.3 . 1 . . . . 51 ARG CA . 26748 1 585 . 1 1 52 52 ARG CB C 13 29.240 0.3 . 1 . . . . 51 ARG CB . 26748 1 586 . 1 1 52 52 ARG CG C 13 27.143 0.3 . 1 . . . . 51 ARG CG . 26748 1 587 . 1 1 52 52 ARG CD C 13 43.331 0.3 . 1 . . . . 51 ARG CD . 26748 1 588 . 1 1 53 53 SER H H 1 7.856 0.020 . 1 . . . . 52 SER H . 26748 1 589 . 1 1 53 53 SER HA H 1 4.325 0.020 . 1 . . . . 52 SER HA . 26748 1 590 . 1 1 53 53 SER HB2 H 1 4.099 0.020 . 2 . . . . 52 SER HB2 . 26748 1 591 . 1 1 53 53 SER HB3 H 1 4.154 0.020 . 2 . . . . 52 SER HB3 . 26748 1 592 . 1 1 53 53 SER C C 13 173.836 0.3 . 1 . . . . 52 SER C . 26748 1 593 . 1 1 53 53 SER CA C 13 61.459 0.3 . 1 . . . . 52 SER CA . 26748 1 594 . 1 1 53 53 SER CB C 13 63.148 0.3 . 1 . . . . 52 SER CB . 26748 1 595 . 1 1 53 53 SER N N 15 114.729 0.3 . 1 . . . . 52 SER N . 26748 1 596 . 1 1 54 54 ILE H H 1 7.347 0.020 . 1 . . . . 53 ILE H . 26748 1 597 . 1 1 54 54 ILE HA H 1 3.701 0.020 . 1 . . . . 53 ILE HA . 26748 1 598 . 1 1 54 54 ILE HB H 1 1.903 0.020 . 1 . . . . 53 ILE HB . 26748 1 599 . 1 1 54 54 ILE HG12 H 1 1.830 0.020 . 2 . . . . 53 ILE HG12 . 26748 1 600 . 1 1 54 54 ILE HG13 H 1 1.807 0.020 . 2 . . . . 53 ILE HG13 . 26748 1 601 . 1 1 54 54 ILE HG21 H 1 0.777 0.020 . 1 . . . . 53 ILE HG2 . 26748 1 602 . 1 1 54 54 ILE HG22 H 1 0.777 0.020 . 1 . . . . 53 ILE HG2 . 26748 1 603 . 1 1 54 54 ILE HG23 H 1 0.777 0.020 . 1 . . . . 53 ILE HG2 . 26748 1 604 . 1 1 54 54 ILE HD11 H 1 0.590 0.020 . 1 . . . . 53 ILE HD1 . 26748 1 605 . 1 1 54 54 ILE HD12 H 1 0.590 0.020 . 1 . . . . 53 ILE HD1 . 26748 1 606 . 1 1 54 54 ILE HD13 H 1 0.590 0.020 . 1 . . . . 53 ILE HD1 . 26748 1 607 . 1 1 54 54 ILE C C 13 177.707 0.3 . 1 . . . . 53 ILE C . 26748 1 608 . 1 1 54 54 ILE CA C 13 63.782 0.3 . 1 . . . . 53 ILE CA . 26748 1 609 . 1 1 54 54 ILE CB C 13 38.057 0.3 . 1 . . . . 53 ILE CB . 26748 1 610 . 1 1 54 54 ILE CG1 C 13 28.999 0.3 . 1 . . . . 53 ILE CG1 . 26748 1 611 . 1 1 54 54 ILE CG2 C 13 17.110 0.3 . 1 . . . . 53 ILE CG2 . 26748 1 612 . 1 1 54 54 ILE CD1 C 13 14.805 0.3 . 1 . . . . 53 ILE CD1 . 26748 1 613 . 1 1 54 54 ILE N N 15 121.334 0.3 . 1 . . . . 53 ILE N . 26748 1 614 . 1 1 55 55 LYS H H 1 7.829 0.020 . 1 . . . . 54 LYS H . 26748 1 615 . 1 1 55 55 LYS HA H 1 3.619 0.020 . 1 . . . . 54 LYS HA . 26748 1 616 . 1 1 55 55 LYS HB2 H 1 1.888 0.020 . 2 . . . . 54 LYS HB2 . 26748 1 617 . 1 1 55 55 LYS HB3 H 1 1.825 0.020 . 2 . . . . 54 LYS HB3 . 26748 1 618 . 1 1 55 55 LYS HG2 H 1 1.426 0.020 . 2 . . . . 54 LYS HG2 . 26748 1 619 . 1 1 55 55 LYS HG3 H 1 1.328 0.020 . 2 . . . . 54 LYS HG3 . 26748 1 620 . 1 1 55 55 LYS HD2 H 1 1.690 0.020 . 2 . . . . 54 LYS HD2 . 26748 1 621 . 1 1 55 55 LYS HD3 H 1 1.561 0.020 . 2 . . . . 54 LYS HD3 . 26748 1 622 . 1 1 55 55 LYS HE2 H 1 2.999 0.020 . 2 . . . . 54 LYS HE2 . 26748 1 623 . 1 1 55 55 LYS HE3 H 1 2.791 0.020 . 2 . . . . 54 LYS HE3 . 26748 1 624 . 1 1 55 55 LYS C C 13 178.279 0.3 . 1 . . . . 54 LYS C . 26748 1 625 . 1 1 55 55 LYS CA C 13 60.159 0.3 . 1 . . . . 54 LYS CA . 26748 1 626 . 1 1 55 55 LYS CB C 13 30.970 0.3 . 1 . . . . 54 LYS CB . 26748 1 627 . 1 1 55 55 LYS CG C 13 24.652 0.3 . 1 . . . . 54 LYS CG . 26748 1 628 . 1 1 55 55 LYS CD C 13 29.653 0.3 . 1 . . . . 54 LYS CD . 26748 1 629 . 1 1 55 55 LYS CE C 13 41.820 0.3 . 1 . . . . 54 LYS CE . 26748 1 630 . 1 1 55 55 LYS N N 15 119.099 0.3 . 1 . . . . 54 LYS N . 26748 1 631 . 1 1 56 56 ALA H H 1 7.657 0.020 . 1 . . . . 55 ALA H . 26748 1 632 . 1 1 56 56 ALA HA H 1 4.139 0.020 . 1 . . . . 55 ALA HA . 26748 1 633 . 1 1 56 56 ALA HB1 H 1 1.469 0.020 . 1 . . . . 55 ALA HB . 26748 1 634 . 1 1 56 56 ALA HB2 H 1 1.469 0.020 . 1 . . . . 55 ALA HB . 26748 1 635 . 1 1 56 56 ALA HB3 H 1 1.469 0.020 . 1 . . . . 55 ALA HB . 26748 1 636 . 1 1 56 56 ALA C C 13 178.851 0.3 . 1 . . . . 55 ALA C . 26748 1 637 . 1 1 56 56 ALA CA C 13 53.561 0.3 . 1 . . . . 55 ALA CA . 26748 1 638 . 1 1 56 56 ALA CB C 13 18.347 0.3 . 1 . . . . 55 ALA CB . 26748 1 639 . 1 1 56 56 ALA N N 15 116.033 0.3 . 1 . . . . 55 ALA N . 26748 1 640 . 1 1 57 57 ILE H H 1 7.672 0.020 . 1 . . . . 56 ILE H . 26748 1 641 . 1 1 57 57 ILE HA H 1 3.626 0.020 . 1 . . . . 56 ILE HA . 26748 1 642 . 1 1 57 57 ILE HB H 1 1.550 0.020 . 1 . . . . 56 ILE HB . 26748 1 643 . 1 1 57 57 ILE HG12 H 1 0.925 0.020 . 2 . . . . 56 ILE HG12 . 26748 1 644 . 1 1 57 57 ILE HG13 H 1 2.338 0.020 . 2 . . . . 56 ILE HG13 . 26748 1 645 . 1 1 57 57 ILE HG21 H 1 0.711 0.020 . 1 . . . . 56 ILE HG2 . 26748 1 646 . 1 1 57 57 ILE HG22 H 1 0.711 0.020 . 1 . . . . 56 ILE HG2 . 26748 1 647 . 1 1 57 57 ILE HG23 H 1 0.711 0.020 . 1 . . . . 56 ILE HG2 . 26748 1 648 . 1 1 57 57 ILE HD11 H 1 0.787 0.020 . 1 . . . . 56 ILE HD1 . 26748 1 649 . 1 1 57 57 ILE HD12 H 1 0.787 0.020 . 1 . . . . 56 ILE HD1 . 26748 1 650 . 1 1 57 57 ILE HD13 H 1 0.787 0.020 . 1 . . . . 56 ILE HD1 . 26748 1 651 . 1 1 57 57 ILE C C 13 177.788 0.3 . 1 . . . . 56 ILE C . 26748 1 652 . 1 1 57 57 ILE CA C 13 64.304 0.3 . 1 . . . . 56 ILE CA . 26748 1 653 . 1 1 57 57 ILE CB C 13 38.739 0.3 . 1 . . . . 56 ILE CB . 26748 1 654 . 1 1 57 57 ILE CG1 C 13 27.665 0.3 . 1 . . . . 56 ILE CG1 . 26748 1 655 . 1 1 57 57 ILE CG2 C 13 17.959 0.3 . 1 . . . . 56 ILE CG2 . 26748 1 656 . 1 1 57 57 ILE CD1 C 13 14.926 0.3 . 1 . . . . 56 ILE CD1 . 26748 1 657 . 1 1 57 57 ILE N N 15 120.524 0.3 . 1 . . . . 56 ILE N . 26748 1 658 . 1 1 58 58 CYS H H 1 7.350 0.020 . 1 . . . . 57 CYS H . 26748 1 659 . 1 1 58 58 CYS HA H 1 4.437 0.020 . 1 . . . . 57 CYS HA . 26748 1 660 . 1 1 58 58 CYS HB2 H 1 2.648 0.020 . 2 . . . . 57 CYS HB2 . 26748 1 661 . 1 1 58 58 CYS HB3 H 1 2.606 0.020 . 2 . . . . 57 CYS HB3 . 26748 1 662 . 1 1 58 58 CYS C C 13 174.109 0.3 . 1 . . . . 57 CYS C . 26748 1 663 . 1 1 58 58 CYS CA C 13 54.838 0.3 . 1 . . . . 57 CYS CA . 26748 1 664 . 1 1 58 58 CYS CB C 13 31.794 0.3 . 1 . . . . 57 CYS CB . 26748 1 665 . 1 1 58 58 CYS N N 15 116.632 0.3 . 1 . . . . 57 CYS N . 26748 1 666 . 1 1 59 59 GLU H H 1 7.476 0.020 . 1 . . . . 58 GLU H . 26748 1 667 . 1 1 59 59 GLU HA H 1 4.412 0.020 . 1 . . . . 58 GLU HA . 26748 1 668 . 1 1 59 59 GLU HB2 H 1 2.051 0.020 . 2 . . . . 58 GLU HB2 . 26748 1 669 . 1 1 59 59 GLU HB3 H 1 2.122 0.020 . 2 . . . . 58 GLU HB3 . 26748 1 670 . 1 1 59 59 GLU HG2 H 1 2.224 0.020 . 2 . . . . 58 GLU HG2 . 26748 1 671 . 1 1 59 59 GLU HG3 H 1 2.172 0.020 . 2 . . . . 58 GLU HG3 . 26748 1 672 . 1 1 59 59 GLU C C 13 176.180 0.3 . 1 . . . . 58 GLU C . 26748 1 673 . 1 1 59 59 GLU CA C 13 55.419 0.3 . 1 . . . . 58 GLU CA . 26748 1 674 . 1 1 59 59 GLU CB C 13 31.513 0.3 . 1 . . . . 58 GLU CB . 26748 1 675 . 1 1 59 59 GLU CG C 13 36.220 0.3 . 1 . . . . 58 GLU CG . 26748 1 676 . 1 1 59 59 GLU N N 15 119.964 0.3 . 1 . . . . 58 GLU N . 26748 1 677 . 1 1 60 60 ASN H H 1 8.686 0.020 . 1 . . . . 59 ASN H . 26748 1 678 . 1 1 60 60 ASN HA H 1 3.986 0.020 . 1 . . . . 59 ASN HA . 26748 1 679 . 1 1 60 60 ASN HB2 H 1 1.889 0.020 . 2 . . . . 59 ASN HB2 . 26748 1 680 . 1 1 60 60 ASN HB3 H 1 1.957 0.020 . 2 . . . . 59 ASN HB3 . 26748 1 681 . 1 1 60 60 ASN HD21 H 1 3.144 0.020 . 1 . . . . 59 ASN HD21 . 26748 1 682 . 1 1 60 60 ASN HD22 H 1 3.144 0.020 . 1 . . . . 59 ASN HD22 . 26748 1 683 . 1 1 60 60 ASN CA C 13 59.452 0.3 . 1 . . . . 59 ASN CA . 26748 1 684 . 1 1 60 60 ASN CB C 13 29.255 0.3 . 1 . . . . 59 ASN CB . 26748 1 685 . 1 1 60 60 ASN CG C 13 27.328 0.3 . 1 . . . . 59 ASN CG . 26748 1 686 . 1 1 60 60 ASN N N 15 119.521 0.3 . 1 . . . . 59 ASN N . 26748 1 687 . 1 1 62 62 ASN H H 1 7.850 0.020 . 1 . . . . 61 ASN H . 26748 1 688 . 1 1 62 62 ASN HA H 1 4.582 0.020 . 1 . . . . 61 ASN HA . 26748 1 689 . 1 1 62 62 ASN HB2 H 1 2.517 0.020 . 2 . . . . 61 ASN HB2 . 26748 1 690 . 1 1 62 62 ASN HB3 H 1 2.468 0.020 . 2 . . . . 61 ASN HB3 . 26748 1 691 . 1 1 62 62 ASN C C 13 175.717 0.3 . 1 . . . . 61 ASN C . 26748 1 692 . 1 1 62 62 ASN CA C 13 52.960 0.3 . 1 . . . . 61 ASN CA . 26748 1 693 . 1 1 62 62 ASN CB C 13 40.248 0.3 . 1 . . . . 61 ASN CB . 26748 1 694 . 1 1 62 62 ASN N N 15 123.526 0.3 . 1 . . . . 61 ASN N . 26748 1 695 . 1 1 63 63 GLY H H 1 7.816 0.020 . 1 . . . . 62 GLY H . 26748 1 696 . 1 1 63 63 GLY HA2 H 1 3.814 0.020 . 2 . . . . 62 GLY HA2 . 26748 1 697 . 1 1 63 63 GLY HA3 H 1 3.917 0.020 . 2 . . . . 62 GLY HA3 . 26748 1 698 . 1 1 63 63 GLY C C 13 171.683 0.3 . 1 . . . . 62 GLY C . 26748 1 699 . 1 1 63 63 GLY CA C 13 45.257 0.3 . 1 . . . . 62 GLY CA . 26748 1 700 . 1 1 63 63 GLY N N 15 108.977 0.3 . 1 . . . . 62 GLY N . 26748 1 701 . 1 1 64 64 ASN H H 1 8.442 0.020 . 1 . . . . 63 ASN H . 26748 1 702 . 1 1 64 64 ASN HA H 1 4.960 0.020 . 1 . . . . 63 ASN HA . 26748 1 703 . 1 1 64 64 ASN HB2 H 1 2.693 0.020 . 1 . . . . 63 ASN HB2 . 26748 1 704 . 1 1 64 64 ASN HB3 H 1 2.693 0.020 . 1 . . . . 63 ASN HB3 . 26748 1 705 . 1 1 64 64 ASN C C 13 175.553 0.3 . 1 . . . . 63 ASN C . 26748 1 706 . 1 1 64 64 ASN CA C 13 51.067 0.3 . 1 . . . . 63 ASN CA . 26748 1 707 . 1 1 64 64 ASN CB C 13 38.833 0.3 . 1 . . . . 63 ASN CB . 26748 1 708 . 1 1 64 64 ASN N N 15 119.467 0.3 . 1 . . . . 63 ASN N . 26748 1 709 . 1 1 68 68 GLU H H 1 8.793 0.020 . 1 . . . . 67 GLU H . 26748 1 710 . 1 1 68 68 GLU HA H 1 5.073 0.020 . 1 . . . . 67 GLU HA . 26748 1 711 . 1 1 68 68 GLU HB2 H 1 2.062 0.020 . 2 . . . . 67 GLU HB2 . 26748 1 712 . 1 1 68 68 GLU HB3 H 1 2.086 0.020 . 2 . . . . 67 GLU HB3 . 26748 1 713 . 1 1 68 68 GLU HG2 H 1 2.238 0.020 . 2 . . . . 67 GLU HG2 . 26748 1 714 . 1 1 68 68 GLU HG3 H 1 2.205 0.020 . 2 . . . . 67 GLU HG3 . 26748 1 715 . 1 1 68 68 GLU C C 13 176.126 0.3 . 1 . . . . 67 GLU C . 26748 1 716 . 1 1 68 68 GLU CA C 13 57.857 0.3 . 1 . . . . 67 GLU CA . 26748 1 717 . 1 1 68 68 GLU CB C 13 28.415 0.3 . 1 . . . . 67 GLU CB . 26748 1 718 . 1 1 68 68 GLU CG C 13 36.326 0.3 . 1 . . . . 67 GLU CG . 26748 1 719 . 1 1 68 68 GLU N N 15 119.865 0.3 . 1 . . . . 67 GLU N . 26748 1 720 . 1 1 69 69 ASN H H 1 8.595 0.020 . 1 . . . . 68 ASN H . 26748 1 721 . 1 1 69 69 ASN HA H 1 4.659 0.020 . 1 . . . . 68 ASN HA . 26748 1 722 . 1 1 69 69 ASN HB2 H 1 2.842 0.020 . 1 . . . . 68 ASN HB2 . 26748 1 723 . 1 1 69 69 ASN C C 13 174.654 0.3 . 1 . . . . 68 ASN C . 26748 1 724 . 1 1 69 69 ASN CA C 13 53.541 0.3 . 1 . . . . 68 ASN CA . 26748 1 725 . 1 1 69 69 ASN CB C 13 38.551 0.3 . 1 . . . . 68 ASN CB . 26748 1 726 . 1 1 69 69 ASN N N 15 118.483 0.3 . 1 . . . . 68 ASN N . 26748 1 727 . 1 1 69 69 ASN ND2 N 15 113.307 0.3 . 1 . . . . 68 ASN ND2 . 26748 1 728 . 1 1 70 70 LEU H H 1 8.180 0.020 . 1 . . . . 69 LEU H . 26748 1 729 . 1 1 70 70 LEU HA H 1 4.161 0.020 . 1 . . . . 69 LEU HA . 26748 1 730 . 1 1 70 70 LEU HB2 H 1 1.787 0.020 . 2 . . . . 69 LEU HB2 . 26748 1 731 . 1 1 70 70 LEU HB3 H 1 1.692 0.020 . 2 . . . . 69 LEU HB3 . 26748 1 732 . 1 1 70 70 LEU HG H 1 1.543 0.020 . 1 . . . . 69 LEU HG . 26748 1 733 . 1 1 70 70 LEU HD11 H 1 0.564 0.020 . 1 . . . . 69 LEU HD1 . 26748 1 734 . 1 1 70 70 LEU HD12 H 1 0.564 0.020 . 1 . . . . 69 LEU HD1 . 26748 1 735 . 1 1 70 70 LEU HD13 H 1 0.564 0.020 . 1 . . . . 69 LEU HD1 . 26748 1 736 . 1 1 70 70 LEU C C 13 176.862 0.3 . 1 . . . . 69 LEU C . 26748 1 737 . 1 1 70 70 LEU CA C 13 55.996 0.3 . 1 . . . . 69 LEU CA . 26748 1 738 . 1 1 70 70 LEU CB C 13 43.198 0.3 . 1 . . . . 69 LEU CB . 26748 1 739 . 1 1 70 70 LEU CG C 13 26.328 0.3 . 1 . . . . 69 LEU CG . 26748 1 740 . 1 1 70 70 LEU CD1 C 13 22.955 0.3 . 1 . . . . 69 LEU CD1 . 26748 1 741 . 1 1 70 70 LEU CD2 C 13 24.463 0.3 . 1 . . . . 69 LEU CD2 . 26748 1 742 . 1 1 70 70 LEU N N 15 120.632 0.3 . 1 . . . . 69 LEU N . 26748 1 743 . 1 1 71 71 ARG H H 1 9.361 0.020 . 1 . . . . 70 ARG H . 26748 1 744 . 1 1 71 71 ARG HA H 1 4.907 0.020 . 1 . . . . 70 ARG HA . 26748 1 745 . 1 1 71 71 ARG HB2 H 1 1.913 0.020 . 1 . . . . 70 ARG HB2 . 26748 1 746 . 1 1 71 71 ARG HB3 H 1 1.913 0.020 . 1 . . . . 70 ARG HB3 . 26748 1 747 . 1 1 71 71 ARG HG2 H 1 1.492 0.020 . 2 . . . . 70 ARG HG2 . 26748 1 748 . 1 1 71 71 ARG HG3 H 1 1.604 0.020 . 2 . . . . 70 ARG HG3 . 26748 1 749 . 1 1 71 71 ARG HD2 H 1 3.083 0.020 . 1 . . . . 70 ARG HD2 . 26748 1 750 . 1 1 71 71 ARG HD3 H 1 3.083 0.020 . 1 . . . . 70 ARG HD3 . 26748 1 751 . 1 1 71 71 ARG C C 13 173.509 0.3 . 1 . . . . 70 ARG C . 26748 1 752 . 1 1 71 71 ARG CA C 13 53.831 0.3 . 1 . . . . 70 ARG CA . 26748 1 753 . 1 1 71 71 ARG CB C 13 33.837 0.3 . 1 . . . . 70 ARG CB . 26748 1 754 . 1 1 71 71 ARG CG C 13 27.528 0.3 . 1 . . . . 70 ARG CG . 26748 1 755 . 1 1 71 71 ARG CD C 13 43.210 0.3 . 1 . . . . 70 ARG CD . 26748 1 756 . 1 1 71 71 ARG N N 15 122.504 0.3 . 1 . . . . 70 ARG N . 26748 1 757 . 1 1 73 73 SER H H 1 9.195 0.020 . 1 . . . . 72 SER H . 26748 1 758 . 1 1 73 73 SER HA H 1 4.325 0.020 . 1 . . . . 72 SER HA . 26748 1 759 . 1 1 73 73 SER HB2 H 1 4.108 0.020 . 1 . . . . 72 SER HB2 . 26748 1 760 . 1 1 73 73 SER HB3 H 1 4.108 0.020 . 1 . . . . 72 SER HB3 . 26748 1 761 . 1 1 73 73 SER C C 13 174.545 0.3 . 1 . . . . 72 SER C . 26748 1 762 . 1 1 73 73 SER CA C 13 59.198 0.3 . 1 . . . . 72 SER CA . 26748 1 763 . 1 1 73 73 SER CB C 13 64.924 0.3 . 1 . . . . 72 SER CB . 26748 1 764 . 1 1 73 73 SER N N 15 123.075 0.3 . 1 . . . . 72 SER N . 26748 1 765 . 1 1 74 74 LYS HA H 1 4.153 0.020 . 1 . . . . 73 LYS HA . 26748 1 766 . 1 1 74 74 LYS HB2 H 1 1.765 0.020 . 2 . . . . 73 LYS HB2 . 26748 1 767 . 1 1 74 74 LYS HB3 H 1 1.855 0.020 . 2 . . . . 73 LYS HB3 . 26748 1 768 . 1 1 74 74 LYS HG2 H 1 1.421 0.020 . 1 . . . . 73 LYS HG2 . 26748 1 769 . 1 1 74 74 LYS HG3 H 1 1.421 0.020 . 1 . . . . 73 LYS HG3 . 26748 1 770 . 1 1 74 74 LYS HD2 H 1 1.673 0.020 . 1 . . . . 73 LYS HD2 . 26748 1 771 . 1 1 74 74 LYS HD3 H 1 1.673 0.020 . 1 . . . . 73 LYS HD3 . 26748 1 772 . 1 1 74 74 LYS HE2 H 1 2.979 0.020 . 2 . . . . 73 LYS HE2 . 26748 1 773 . 1 1 74 74 LYS HE3 H 1 2.963 0.020 . 2 . . . . 73 LYS HE3 . 26748 1 774 . 1 1 74 74 LYS C C 13 177.897 0.3 . 1 . . . . 73 LYS C . 26748 1 775 . 1 1 74 74 LYS CA C 13 58.207 0.3 . 1 . . . . 73 LYS CA . 26748 1 776 . 1 1 74 74 LYS CB C 13 32.744 0.3 . 1 . . . . 73 LYS CB . 26748 1 777 . 1 1 74 74 LYS CG C 13 24.510 0.3 . 1 . . . . 73 LYS CG . 26748 1 778 . 1 1 74 74 LYS CD C 13 29.100 0.3 . 1 . . . . 73 LYS CD . 26748 1 779 . 1 1 74 74 LYS CE C 13 41.955 0.3 . 1 . . . . 73 LYS CE . 26748 1 780 . 1 1 75 75 SER H H 1 8.191 0.020 . 1 . . . . 74 SER H . 26748 1 781 . 1 1 75 75 SER HA H 1 4.483 0.020 . 1 . . . . 74 SER HA . 26748 1 782 . 1 1 75 75 SER HB2 H 1 3.627 0.020 . 2 . . . . 74 SER HB2 . 26748 1 783 . 1 1 75 75 SER HB3 H 1 3.737 0.020 . 2 . . . . 74 SER HB3 . 26748 1 784 . 1 1 75 75 SER C C 13 173.509 0.3 . 1 . . . . 74 SER C . 26748 1 785 . 1 1 75 75 SER CA C 13 56.987 0.3 . 1 . . . . 74 SER CA . 26748 1 786 . 1 1 75 75 SER CB C 13 64.379 0.3 . 1 . . . . 74 SER CB . 26748 1 787 . 1 1 75 75 SER N N 15 113.106 0.3 . 1 . . . . 74 SER N . 26748 1 788 . 1 1 76 76 SER H H 1 8.329 0.020 . 1 . . . . 75 SER H . 26748 1 789 . 1 1 76 76 SER HA H 1 4.075 0.020 . 1 . . . . 75 SER HA . 26748 1 790 . 1 1 76 76 SER HB2 H 1 2.187 0.020 . 2 . . . . 75 SER HB2 . 26748 1 791 . 1 1 76 76 SER HB3 H 1 2.763 0.020 . 2 . . . . 75 SER HB3 . 26748 1 792 . 1 1 76 76 SER C C 13 172.310 0.3 . 1 . . . . 75 SER C . 26748 1 793 . 1 1 76 76 SER CA C 13 58.202 0.3 . 1 . . . . 75 SER CA . 26748 1 794 . 1 1 76 76 SER CB C 13 63.610 0.3 . 1 . . . . 75 SER CB . 26748 1 795 . 1 1 76 76 SER N N 15 117.612 0.3 . 1 . . . . 75 SER N . 26748 1 796 . 1 1 77 77 PHE H H 1 8.551 0.020 . 1 . . . . 76 PHE H . 26748 1 797 . 1 1 77 77 PHE HA H 1 4.628 0.020 . 1 . . . . 76 PHE HA . 26748 1 798 . 1 1 77 77 PHE HB2 H 1 3.161 0.020 . 2 . . . . 76 PHE HB2 . 26748 1 799 . 1 1 77 77 PHE HB3 H 1 2.611 0.020 . 2 . . . . 76 PHE HB3 . 26748 1 800 . 1 1 77 77 PHE HD1 H 1 7.342 0.020 . 3 . . . . 76 PHE HD1 . 26748 1 801 . 1 1 77 77 PHE HD2 H 1 7.363 0.020 . 3 . . . . 76 PHE HD2 . 26748 1 802 . 1 1 77 77 PHE HE1 H 1 6.967 0.020 . 1 . . . . 76 PHE HE1 . 26748 1 803 . 1 1 77 77 PHE HE2 H 1 6.967 0.020 . 1 . . . . 76 PHE HE2 . 26748 1 804 . 1 1 77 77 PHE C C 13 176.317 0.3 . 1 . . . . 76 PHE C . 26748 1 805 . 1 1 77 77 PHE CA C 13 57.103 0.3 . 1 . . . . 76 PHE CA . 26748 1 806 . 1 1 77 77 PHE CB C 13 42.305 0.3 . 1 . . . . 76 PHE CB . 26748 1 807 . 1 1 77 77 PHE CD1 C 13 132.256 0.3 . 1 . . . . 76 PHE CD1 . 26748 1 808 . 1 1 77 77 PHE CD2 C 13 131.859 0.3 . 1 . . . . 76 PHE CD2 . 26748 1 809 . 1 1 77 77 PHE CE1 C 13 132.125 0.3 . 1 . . . . 76 PHE CE1 . 26748 1 810 . 1 1 77 77 PHE N N 15 120.640 0.3 . 1 . . . . 76 PHE N . 26748 1 811 . 1 1 78 78 GLN H H 1 9.324 0.020 . 1 . . . . 77 GLN H . 26748 1 812 . 1 1 78 78 GLN HA H 1 5.017 0.020 . 1 . . . . 77 GLN HA . 26748 1 813 . 1 1 78 78 GLN HB2 H 1 2.261 0.020 . 1 . . . . 77 GLN HB2 . 26748 1 814 . 1 1 78 78 GLN HB3 H 1 2.261 0.020 . 1 . . . . 77 GLN HB3 . 26748 1 815 . 1 1 78 78 GLN HG2 H 1 2.613 0.020 . 2 . . . . 77 GLN HG2 . 26748 1 816 . 1 1 78 78 GLN HG3 H 1 2.722 0.020 . 2 . . . . 77 GLN HG3 . 26748 1 817 . 1 1 78 78 GLN C C 13 174.872 0.3 . 1 . . . . 77 GLN C . 26748 1 818 . 1 1 78 78 GLN CA C 13 56.348 0.3 . 1 . . . . 77 GLN CA . 26748 1 819 . 1 1 78 78 GLN CB C 13 28.103 0.3 . 1 . . . . 77 GLN CB . 26748 1 820 . 1 1 78 78 GLN CG C 13 32.790 0.3 . 1 . . . . 77 GLN CG . 26748 1 821 . 1 1 78 78 GLN N N 15 120.658 0.3 . 1 . . . . 77 GLN N . 26748 1 822 . 1 1 79 79 VAL H H 1 8.613 0.020 . 1 . . . . 78 VAL H . 26748 1 823 . 1 1 79 79 VAL HA H 1 5.290 0.020 . 1 . . . . 78 VAL HA . 26748 1 824 . 1 1 79 79 VAL HB H 1 1.620 0.020 . 1 . . . . 78 VAL HB . 26748 1 825 . 1 1 79 79 VAL HG11 H 1 0.719 0.020 . 1 . . . . 78 VAL HG1 . 26748 1 826 . 1 1 79 79 VAL HG12 H 1 0.719 0.020 . 1 . . . . 78 VAL HG1 . 26748 1 827 . 1 1 79 79 VAL HG13 H 1 0.719 0.020 . 1 . . . . 78 VAL HG1 . 26748 1 828 . 1 1 79 79 VAL HG21 H 1 0.719 0.020 . 1 . . . . 78 VAL HG2 . 26748 1 829 . 1 1 79 79 VAL HG22 H 1 0.719 0.020 . 1 . . . . 78 VAL HG2 . 26748 1 830 . 1 1 79 79 VAL HG23 H 1 0.719 0.020 . 1 . . . . 78 VAL HG2 . 26748 1 831 . 1 1 79 79 VAL C C 13 174.872 0.3 . 1 . . . . 78 VAL C . 26748 1 832 . 1 1 79 79 VAL CA C 13 58.412 0.3 . 1 . . . . 78 VAL CA . 26748 1 833 . 1 1 79 79 VAL CB C 13 36.059 0.3 . 1 . . . . 78 VAL CB . 26748 1 834 . 1 1 79 79 VAL CG1 C 13 22.005 0.3 . 1 . . . . 78 VAL CG1 . 26748 1 835 . 1 1 79 79 VAL CG2 C 13 21.603 0.3 . 1 . . . . 78 VAL CG2 . 26748 1 836 . 1 1 79 79 VAL N N 15 115.216 0.3 . 1 . . . . 78 VAL N . 26748 1 837 . 1 1 80 80 THR H H 1 9.197 0.020 . 1 . . . . 79 THR H . 26748 1 838 . 1 1 80 80 THR HA H 1 4.868 0.020 . 1 . . . . 79 THR HA . 26748 1 839 . 1 1 80 80 THR HB H 1 4.195 0.020 . 1 . . . . 79 THR HB . 26748 1 840 . 1 1 80 80 THR HG21 H 1 1.175 0.020 . 1 . . . . 79 THR HG2 . 26748 1 841 . 1 1 80 80 THR HG22 H 1 1.175 0.020 . 1 . . . . 79 THR HG2 . 26748 1 842 . 1 1 80 80 THR HG23 H 1 1.175 0.020 . 1 . . . . 79 THR HG2 . 26748 1 843 . 1 1 80 80 THR C C 13 173.373 0.3 . 1 . . . . 79 THR C . 26748 1 844 . 1 1 80 80 THR CA C 13 64.014 0.3 . 1 . . . . 79 THR CA . 26748 1 845 . 1 1 80 80 THR CB C 13 69.967 0.3 . 1 . . . . 79 THR CB . 26748 1 846 . 1 1 80 80 THR CG2 C 13 22.047 0.3 . 1 . . . . 79 THR CG2 . 26748 1 847 . 1 1 80 80 THR N N 15 121.692 0.3 . 1 . . . . 79 THR N . 26748 1 848 . 1 1 81 81 THR H H 1 9.058 0.020 . 1 . . . . 80 THR H . 26748 1 849 . 1 1 81 81 THR HA H 1 4.605 0.020 . 1 . . . . 80 THR HA . 26748 1 850 . 1 1 81 81 THR HB H 1 4.072 0.020 . 1 . . . . 80 THR HB . 26748 1 851 . 1 1 81 81 THR HG21 H 1 1.179 0.020 . 1 . . . . 80 THR HG2 . 26748 1 852 . 1 1 81 81 THR HG22 H 1 1.179 0.020 . 1 . . . . 80 THR HG2 . 26748 1 853 . 1 1 81 81 THR HG23 H 1 1.179 0.020 . 1 . . . . 80 THR HG2 . 26748 1 854 . 1 1 81 81 THR C C 13 172.855 0.3 . 1 . . . . 80 THR C . 26748 1 855 . 1 1 81 81 THR CA C 13 62.014 0.3 . 1 . . . . 80 THR CA . 26748 1 856 . 1 1 81 81 THR CB C 13 69.053 0.3 . 1 . . . . 80 THR CB . 26748 1 857 . 1 1 81 81 THR CG2 C 13 21.609 0.3 . 1 . . . . 80 THR CG2 . 26748 1 858 . 1 1 81 81 THR N N 15 125.216 0.3 . 1 . . . . 80 THR N . 26748 1 859 . 1 1 82 82 CYS H H 1 9.056 0.020 . 1 . . . . 81 CYS H . 26748 1 860 . 1 1 82 82 CYS HA H 1 5.307 0.020 . 1 . . . . 81 CYS HA . 26748 1 861 . 1 1 82 82 CYS HB2 H 1 2.439 0.020 . 2 . . . . 81 CYS HB2 . 26748 1 862 . 1 1 82 82 CYS HB3 H 1 2.847 0.020 . 2 . . . . 81 CYS HB3 . 26748 1 863 . 1 1 82 82 CYS C C 13 173.127 0.3 . 1 . . . . 81 CYS C . 26748 1 864 . 1 1 82 82 CYS CA C 13 52.333 0.3 . 1 . . . . 81 CYS CA . 26748 1 865 . 1 1 82 82 CYS CB C 13 38.833 0.3 . 1 . . . . 81 CYS CB . 26748 1 866 . 1 1 82 82 CYS N N 15 126.965 0.3 . 1 . . . . 81 CYS N . 26748 1 867 . 1 1 83 83 LYS H H 1 9.114 0.020 . 1 . . . . 82 LYS H . 26748 1 868 . 1 1 83 83 LYS HA H 1 5.204 0.020 . 1 . . . . 82 LYS HA . 26748 1 869 . 1 1 83 83 LYS HB2 H 1 2.022 0.020 . 2 . . . . 82 LYS HB2 . 26748 1 870 . 1 1 83 83 LYS HB3 H 1 1.683 0.020 . 2 . . . . 82 LYS HB3 . 26748 1 871 . 1 1 83 83 LYS HG2 H 1 1.485 0.020 . 2 . . . . 82 LYS HG2 . 26748 1 872 . 1 1 83 83 LYS HG3 H 1 1.350 0.020 . 2 . . . . 82 LYS HG3 . 26748 1 873 . 1 1 83 83 LYS HD2 H 1 1.715 0.020 . 1 . . . . 82 LYS HD2 . 26748 1 874 . 1 1 83 83 LYS HD3 H 1 1.715 0.020 . 1 . . . . 82 LYS HD3 . 26748 1 875 . 1 1 83 83 LYS C C 13 175.635 0.3 . 1 . . . . 82 LYS C . 26748 1 876 . 1 1 83 83 LYS CA C 13 54.807 0.3 . 1 . . . . 82 LYS CA . 26748 1 877 . 1 1 83 83 LYS CB C 13 35.855 0.3 . 1 . . . . 82 LYS CB . 26748 1 878 . 1 1 83 83 LYS CG C 13 25.750 0.3 . 1 . . . . 82 LYS CG . 26748 1 879 . 1 1 83 83 LYS CD C 13 29.007 0.3 . 1 . . . . 82 LYS CD . 26748 1 880 . 1 1 83 83 LYS CE C 13 42.132 0.3 . 1 . . . . 82 LYS CE . 26748 1 881 . 1 1 83 83 LYS N N 15 125.216 0.3 . 1 . . . . 82 LYS N . 26748 1 882 . 1 1 84 84 LEU H H 1 9.141 0.020 . 1 . . . . 83 LEU H . 26748 1 883 . 1 1 84 84 LEU HA H 1 3.845 0.020 . 1 . . . . 83 LEU HA . 26748 1 884 . 1 1 84 84 LEU HB2 H 1 1.786 0.020 . 2 . . . . 83 LEU HB2 . 26748 1 885 . 1 1 84 84 LEU HB3 H 1 1.692 0.020 . 2 . . . . 83 LEU HB3 . 26748 1 886 . 1 1 84 84 LEU HG H 1 1.275 0.020 . 1 . . . . 83 LEU HG . 26748 1 887 . 1 1 84 84 LEU HD11 H 1 0.559 0.020 . 1 . . . . 83 LEU HD1 . 26748 1 888 . 1 1 84 84 LEU HD12 H 1 0.559 0.020 . 1 . . . . 83 LEU HD1 . 26748 1 889 . 1 1 84 84 LEU HD13 H 1 0.559 0.020 . 1 . . . . 83 LEU HD1 . 26748 1 890 . 1 1 84 84 LEU HD21 H 1 0.573 0.020 . 1 . . . . 83 LEU HD2 . 26748 1 891 . 1 1 84 84 LEU HD22 H 1 0.573 0.020 . 1 . . . . 83 LEU HD2 . 26748 1 892 . 1 1 84 84 LEU HD23 H 1 0.573 0.020 . 1 . . . . 83 LEU HD2 . 26748 1 893 . 1 1 84 84 LEU C C 13 176.616 0.3 . 1 . . . . 83 LEU C . 26748 1 894 . 1 1 84 84 LEU CA C 13 56.131 0.3 . 1 . . . . 83 LEU CA . 26748 1 895 . 1 1 84 84 LEU CB C 13 43.587 0.3 . 1 . . . . 83 LEU CB . 26748 1 896 . 1 1 84 84 LEU CG C 13 25.904 0.3 . 1 . . . . 83 LEU CG . 26748 1 897 . 1 1 84 84 LEU CD1 C 13 22.715 0.3 . 1 . . . . 83 LEU CD1 . 26748 1 898 . 1 1 84 84 LEU CD2 C 13 23.033 0.3 . 1 . . . . 83 LEU CD2 . 26748 1 899 . 1 1 84 84 LEU N N 15 132.161 0.3 . 1 . . . . 83 LEU N . 26748 1 900 . 1 1 85 85 HIS H H 1 8.751 0.020 . 1 . . . . 84 HIS H . 26748 1 901 . 1 1 85 85 HIS HA H 1 4.636 0.020 . 1 . . . . 84 HIS HA . 26748 1 902 . 1 1 85 85 HIS HB2 H 1 2.583 0.020 . 2 . . . . 84 HIS HB2 . 26748 1 903 . 1 1 85 85 HIS HB3 H 1 2.636 0.020 . 2 . . . . 84 HIS HB3 . 26748 1 904 . 1 1 85 85 HIS C C 13 174.126 0.3 . 1 . . . . 84 HIS C . 26748 1 905 . 1 1 85 85 HIS CA C 13 55.089 0.3 . 1 . . . . 84 HIS CA . 26748 1 906 . 1 1 85 85 HIS CB C 13 30.092 0.3 . 1 . . . . 84 HIS CB . 26748 1 907 . 1 1 85 85 HIS N N 15 125.826 0.3 . 1 . . . . 84 HIS N . 26748 1 908 . 1 1 86 86 GLY H H 1 8.282 0.020 . 1 . . . . 85 GLY H . 26748 1 909 . 1 1 86 86 GLY HA2 H 1 4.088 0.020 . 2 . . . . 85 GLY HA2 . 26748 1 910 . 1 1 86 86 GLY HA3 H 1 3.573 0.020 . 2 . . . . 85 GLY HA3 . 26748 1 911 . 1 1 86 86 GLY C C 13 174.126 0.3 . 1 . . . . 85 GLY C . 26748 1 912 . 1 1 86 86 GLY CA C 13 44.850 0.3 . 1 . . . . 85 GLY CA . 26748 1 913 . 1 1 86 86 GLY N N 15 112.397 0.3 . 1 . . . . 85 GLY N . 26748 1 914 . 1 1 87 87 GLY H H 1 8.134 0.020 . 1 . . . . 86 GLY H . 26748 1 915 . 1 1 87 87 GLY HA2 H 1 3.920 0.020 . 2 . . . . 86 GLY HA2 . 26748 1 916 . 1 1 87 87 GLY HA3 H 1 3.812 0.020 . 2 . . . . 86 GLY HA3 . 26748 1 917 . 1 1 87 87 GLY C C 13 174.245 0.3 . 1 . . . . 86 GLY C . 26748 1 918 . 1 1 87 87 GLY CA C 13 45.625 0.3 . 1 . . . . 86 GLY CA . 26748 1 919 . 1 1 87 87 GLY N N 15 106.387 0.3 . 1 . . . . 86 GLY N . 26748 1 920 . 1 1 88 88 SER H H 1 8.003 0.020 . 1 . . . . 87 SER H . 26748 1 921 . 1 1 88 88 SER HA H 1 4.851 0.020 . 1 . . . . 87 SER HA . 26748 1 922 . 1 1 88 88 SER HB2 H 1 3.879 0.020 . 2 . . . . 87 SER HB2 . 26748 1 923 . 1 1 88 88 SER HB3 H 1 3.666 0.020 . 2 . . . . 87 SER HB3 . 26748 1 924 . 1 1 88 88 SER C C 13 173.891 0.3 . 1 . . . . 87 SER C . 26748 1 925 . 1 1 88 88 SER CA C 13 54.600 0.3 . 1 . . . . 87 SER CA . 26748 1 926 . 1 1 88 88 SER CB C 13 63.891 0.3 . 1 . . . . 87 SER CB . 26748 1 927 . 1 1 88 88 SER N N 15 116.205 0.3 . 1 . . . . 87 SER N . 26748 1 928 . 1 1 90 90 TRP H H 1 7.346 0.020 . 1 . . . . 89 TRP H . 26748 1 929 . 1 1 90 90 TRP HA H 1 5.111 0.020 . 1 . . . . 89 TRP HA . 26748 1 930 . 1 1 90 90 TRP HB2 H 1 2.945 0.020 . 2 . . . . 89 TRP HB2 . 26748 1 931 . 1 1 90 90 TRP HB3 H 1 3.465 0.020 . 2 . . . . 89 TRP HB3 . 26748 1 932 . 1 1 90 90 TRP HD1 H 1 7.233 0.020 . 1 . . . . 89 TRP HD1 . 26748 1 933 . 1 1 90 90 TRP HE1 H 1 10.193 0.020 . 1 . . . . 89 TRP HE1 . 26748 1 934 . 1 1 90 90 TRP C C 13 173.236 0.3 . 1 . . . . 89 TRP C . 26748 1 935 . 1 1 90 90 TRP CA C 13 53.909 0.3 . 1 . . . . 89 TRP CA . 26748 1 936 . 1 1 90 90 TRP CB C 13 29.388 0.3 . 1 . . . . 89 TRP CB . 26748 1 937 . 1 1 90 90 TRP CD1 C 13 127.248 0.3 . 1 . . . . 89 TRP CD1 . 26748 1 938 . 1 1 90 90 TRP N N 15 120.031 0.3 . 1 . . . . 89 TRP N . 26748 1 939 . 1 1 92 92 PRO HA H 1 4.464 0.020 . 1 . . . . 91 PRO HA . 26748 1 940 . 1 1 92 92 PRO HB2 H 1 2.373 0.020 . 2 . . . . 91 PRO HB2 . 26748 1 941 . 1 1 92 92 PRO HB3 H 1 2.060 0.020 . 2 . . . . 91 PRO HB3 . 26748 1 942 . 1 1 92 92 PRO HG2 H 1 1.931 0.020 . 2 . . . . 91 PRO HG2 . 26748 1 943 . 1 1 92 92 PRO HG3 H 1 2.039 0.020 . 2 . . . . 91 PRO HG3 . 26748 1 944 . 1 1 92 92 PRO HD2 H 1 2.828 0.020 . 1 . . . . 91 PRO HD2 . 26748 1 945 . 1 1 92 92 PRO HD3 H 1 2.828 0.020 . 1 . . . . 91 PRO HD3 . 26748 1 946 . 1 1 92 92 PRO C C 13 175.853 0.3 . 1 . . . . 91 PRO C . 26748 1 947 . 1 1 92 92 PRO CA C 13 62.272 0.3 . 1 . . . . 91 PRO CA . 26748 1 948 . 1 1 92 92 PRO CB C 13 34.016 0.3 . 1 . . . . 91 PRO CB . 26748 1 949 . 1 1 92 92 PRO CG C 13 25.052 0.3 . 1 . . . . 91 PRO CG . 26748 1 950 . 1 1 92 92 PRO CD C 13 50.594 0.3 . 1 . . . . 91 PRO CD . 26748 1 951 . 1 1 93 93 CYS H H 1 9.078 0.020 . 1 . . . . 92 CYS H . 26748 1 952 . 1 1 93 93 CYS HA H 1 4.504 0.020 . 1 . . . . 92 CYS HA . 26748 1 953 . 1 1 93 93 CYS HB2 H 1 2.930 0.020 . 2 . . . . 92 CYS HB2 . 26748 1 954 . 1 1 93 93 CYS HB3 H 1 2.855 0.020 . 2 . . . . 92 CYS HB3 . 26748 1 955 . 1 1 93 93 CYS C C 13 173.809 0.3 . 1 . . . . 92 CYS C . 26748 1 956 . 1 1 93 93 CYS CA C 13 53.561 0.3 . 1 . . . . 92 CYS CA . 26748 1 957 . 1 1 93 93 CYS CB C 13 39.717 0.3 . 1 . . . . 92 CYS CB . 26748 1 958 . 1 1 93 93 CYS N N 15 124.167 0.3 . 1 . . . . 92 CYS N . 26748 1 959 . 1 1 94 94 GLN H H 1 8.821 0.020 . 1 . . . . 93 GLN H . 26748 1 960 . 1 1 94 94 GLN HA H 1 4.637 0.020 . 1 . . . . 93 GLN HA . 26748 1 961 . 1 1 94 94 GLN HB2 H 1 1.916 0.020 . 2 . . . . 93 GLN HB2 . 26748 1 962 . 1 1 94 94 GLN HB3 H 1 2.020 0.020 . 2 . . . . 93 GLN HB3 . 26748 1 963 . 1 1 94 94 GLN HG2 H 1 2.240 0.020 . 1 . . . . 93 GLN HG2 . 26748 1 964 . 1 1 94 94 GLN HG3 H 1 2.240 0.020 . 1 . . . . 93 GLN HG3 . 26748 1 965 . 1 1 94 94 GLN C C 13 175.799 0.3 . 1 . . . . 93 GLN C . 26748 1 966 . 1 1 94 94 GLN CA C 13 55.013 0.3 . 1 . . . . 93 GLN CA . 26748 1 967 . 1 1 94 94 GLN CB C 13 29.903 0.3 . 1 . . . . 93 GLN CB . 26748 1 968 . 1 1 94 94 GLN CG C 13 34.168 0.3 . 1 . . . . 93 GLN CG . 26748 1 969 . 1 1 94 94 GLN N N 15 125.903 0.3 . 1 . . . . 93 GLN N . 26748 1 970 . 1 1 95 95 TYR H H 1 8.764 0.020 . 1 . . . . 94 TYR H . 26748 1 971 . 1 1 95 95 TYR HA H 1 4.926 0.020 . 1 . . . . 94 TYR HA . 26748 1 972 . 1 1 95 95 TYR HB2 H 1 2.576 0.020 . 2 . . . . 94 TYR HB2 . 26748 1 973 . 1 1 95 95 TYR HB3 H 1 2.440 0.020 . 2 . . . . 94 TYR HB3 . 26748 1 974 . 1 1 95 95 TYR C C 13 176.262 0.3 . 1 . . . . 94 TYR C . 26748 1 975 . 1 1 95 95 TYR CA C 13 58.635 0.3 . 1 . . . . 94 TYR CA . 26748 1 976 . 1 1 95 95 TYR CB C 13 44.276 0.3 . 1 . . . . 94 TYR CB . 26748 1 977 . 1 1 95 95 TYR N N 15 120.254 0.3 . 1 . . . . 94 TYR N . 26748 1 978 . 1 1 96 96 ARG H H 1 9.002 0.020 . 1 . . . . 95 ARG H . 26748 1 979 . 1 1 96 96 ARG HA H 1 4.886 0.020 . 1 . . . . 95 ARG HA . 26748 1 980 . 1 1 96 96 ARG HB2 H 1 1.738 0.020 . 2 . . . . 95 ARG HB2 . 26748 1 981 . 1 1 96 96 ARG HB3 H 1 1.822 0.020 . 2 . . . . 95 ARG HB3 . 26748 1 982 . 1 1 96 96 ARG HG2 H 1 1.516 0.020 . 1 . . . . 95 ARG HG2 . 26748 1 983 . 1 1 96 96 ARG HG3 H 1 1.516 0.020 . 1 . . . . 95 ARG HG3 . 26748 1 984 . 1 1 96 96 ARG HD2 H 1 3.083 0.020 . 1 . . . . 95 ARG HD2 . 26748 1 985 . 1 1 96 96 ARG HD3 H 1 3.083 0.020 . 1 . . . . 95 ARG HD3 . 26748 1 986 . 1 1 96 96 ARG C C 13 176.780 0.3 . 1 . . . . 95 ARG C . 26748 1 987 . 1 1 96 96 ARG CA C 13 52.922 0.3 . 1 . . . . 95 ARG CA . 26748 1 988 . 1 1 96 96 ARG CB C 13 31.702 0.3 . 1 . . . . 95 ARG CB . 26748 1 989 . 1 1 96 96 ARG CG C 13 26.901 0.3 . 1 . . . . 95 ARG CG . 26748 1 990 . 1 1 96 96 ARG CD C 13 43.072 0.3 . 1 . . . . 95 ARG CD . 26748 1 991 . 1 1 96 96 ARG N N 15 118.237 0.3 . 1 . . . . 95 ARG N . 26748 1 992 . 1 1 97 97 ALA H H 1 9.106 0.020 . 1 . . . . 96 ALA H . 26748 1 993 . 1 1 97 97 ALA HA H 1 5.483 0.020 . 1 . . . . 96 ALA HA . 26748 1 994 . 1 1 97 97 ALA HB1 H 1 1.313 0.020 . 1 . . . . 96 ALA HB . 26748 1 995 . 1 1 97 97 ALA HB2 H 1 1.313 0.020 . 1 . . . . 96 ALA HB . 26748 1 996 . 1 1 97 97 ALA HB3 H 1 1.313 0.020 . 1 . . . . 96 ALA HB . 26748 1 997 . 1 1 97 97 ALA C C 13 178.770 0.3 . 1 . . . . 96 ALA C . 26748 1 998 . 1 1 97 97 ALA CA C 13 51.412 0.3 . 1 . . . . 96 ALA CA . 26748 1 999 . 1 1 97 97 ALA CB C 13 22.420 0.3 . 1 . . . . 96 ALA CB . 26748 1 1000 . 1 1 97 97 ALA N N 15 129.843 0.3 . 1 . . . . 96 ALA N . 26748 1 1001 . 1 1 98 98 THR H H 1 9.255 0.020 . 1 . . . . 97 THR H . 26748 1 1002 . 1 1 98 98 THR HA H 1 4.587 0.020 . 1 . . . . 97 THR HA . 26748 1 1003 . 1 1 98 98 THR HB H 1 3.953 0.020 . 1 . . . . 97 THR HB . 26748 1 1004 . 1 1 98 98 THR HG21 H 1 1.274 0.020 . 1 . . . . 97 THR HG2 . 26748 1 1005 . 1 1 98 98 THR HG22 H 1 1.274 0.020 . 1 . . . . 97 THR HG2 . 26748 1 1006 . 1 1 98 98 THR HG23 H 1 1.274 0.020 . 1 . . . . 97 THR HG2 . 26748 1 1007 . 1 1 98 98 THR C C 13 174.136 0.3 . 1 . . . . 97 THR C . 26748 1 1008 . 1 1 98 98 THR CA C 13 62.620 0.3 . 1 . . . . 97 THR CA . 26748 1 1009 . 1 1 98 98 THR CB C 13 71.293 0.3 . 1 . . . . 97 THR CB . 26748 1 1010 . 1 1 98 98 THR CG2 C 13 21.640 0.3 . 1 . . . . 97 THR CG2 . 26748 1 1011 . 1 1 98 98 THR N N 15 117.494 0.3 . 1 . . . . 97 THR N . 26748 1 1012 . 1 1 99 99 ALA H H 1 9.499 0.020 . 1 . . . . 98 ALA H . 26748 1 1013 . 1 1 99 99 ALA HA H 1 5.273 0.020 . 1 . . . . 98 ALA HA . 26748 1 1014 . 1 1 99 99 ALA HB1 H 1 1.496 0.020 . 1 . . . . 98 ALA HB . 26748 1 1015 . 1 1 99 99 ALA HB2 H 1 1.496 0.020 . 1 . . . . 98 ALA HB . 26748 1 1016 . 1 1 99 99 ALA HB3 H 1 1.496 0.020 . 1 . . . . 98 ALA HB . 26748 1 1017 . 1 1 99 99 ALA C C 13 176.698 0.3 . 1 . . . . 98 ALA C . 26748 1 1018 . 1 1 99 99 ALA CA C 13 51.354 0.3 . 1 . . . . 98 ALA CA . 26748 1 1019 . 1 1 99 99 ALA CB C 13 19.791 0.3 . 1 . . . . 98 ALA CB . 26748 1 1020 . 1 1 99 99 ALA N N 15 134.491 0.3 . 1 . . . . 98 ALA N . 26748 1 1021 . 1 1 100 100 GLY H H 1 8.687 0.020 . 1 . . . . 99 GLY H . 26748 1 1022 . 1 1 100 100 GLY HA2 H 1 3.803 0.020 . 2 . . . . 99 GLY HA2 . 26748 1 1023 . 1 1 100 100 GLY HA3 H 1 4.574 0.020 . 2 . . . . 99 GLY HA3 . 26748 1 1024 . 1 1 100 100 GLY C C 13 171.328 0.3 . 1 . . . . 99 GLY C . 26748 1 1025 . 1 1 100 100 GLY CA C 13 45.152 0.3 . 1 . . . . 99 GLY CA . 26748 1 1026 . 1 1 100 100 GLY N N 15 108.922 0.3 . 1 . . . . 99 GLY N . 26748 1 1027 . 1 1 101 101 PHE H H 1 8.537 0.020 . 1 . . . . 100 PHE H . 26748 1 1028 . 1 1 101 101 PHE HA H 1 5.736 0.020 . 1 . . . . 100 PHE HA . 26748 1 1029 . 1 1 101 101 PHE HB2 H 1 3.031 0.020 . 2 . . . . 100 PHE HB2 . 26748 1 1030 . 1 1 101 101 PHE HB3 H 1 2.993 0.020 . 2 . . . . 100 PHE HB3 . 26748 1 1031 . 1 1 101 101 PHE HD1 H 1 7.071 0.020 . 1 . . . . 100 PHE HD1 . 26748 1 1032 . 1 1 101 101 PHE C C 13 174.872 0.3 . 1 . . . . 100 PHE C . 26748 1 1033 . 1 1 101 101 PHE CA C 13 56.116 0.3 . 1 . . . . 100 PHE CA . 26748 1 1034 . 1 1 101 101 PHE CB C 13 39.945 0.3 . 1 . . . . 100 PHE CB . 26748 1 1035 . 1 1 101 101 PHE CD1 C 13 128.810 0.3 . 1 . . . . 100 PHE CD1 . 26748 1 1036 . 1 1 101 101 PHE N N 15 122.150 0.3 . 1 . . . . 100 PHE N . 26748 1 1037 . 1 1 102 102 ARG H H 1 8.770 0.020 . 1 . . . . 101 ARG H . 26748 1 1038 . 1 1 102 102 ARG HA H 1 4.654 0.020 . 1 . . . . 101 ARG HA . 26748 1 1039 . 1 1 102 102 ARG HB2 H 1 1.791 0.020 . 2 . . . . 101 ARG HB2 . 26748 1 1040 . 1 1 102 102 ARG HB3 H 1 2.187 0.020 . 2 . . . . 101 ARG HB3 . 26748 1 1041 . 1 1 102 102 ARG HG2 H 1 1.696 0.020 . 1 . . . . 101 ARG HG2 . 26748 1 1042 . 1 1 102 102 ARG HG3 H 1 1.696 0.020 . 1 . . . . 101 ARG HG3 . 26748 1 1043 . 1 1 102 102 ARG C C 13 175.308 0.3 . 1 . . . . 101 ARG C . 26748 1 1044 . 1 1 102 102 ARG CA C 13 54.664 0.3 . 1 . . . . 101 ARG CA . 26748 1 1045 . 1 1 102 102 ARG CB C 13 32.732 0.3 . 1 . . . . 101 ARG CB . 26748 1 1046 . 1 1 102 102 ARG CG C 13 29.122 0.3 . 1 . . . . 101 ARG CG . 26748 1 1047 . 1 1 102 102 ARG CD C 13 41.826 0.3 . 1 . . . . 101 ARG CD . 26748 1 1048 . 1 1 102 102 ARG N N 15 121.109 0.3 . 1 . . . . 101 ARG N . 26748 1 1049 . 1 1 103 103 ASN H H 1 8.290 0.020 . 1 . . . . 102 ASN H . 26748 1 1050 . 1 1 103 103 ASN HA H 1 4.666 0.020 . 1 . . . . 102 ASN HA . 26748 1 1051 . 1 1 103 103 ASN HB2 H 1 2.797 0.020 . 2 . . . . 102 ASN HB2 . 26748 1 1052 . 1 1 103 103 ASN HB3 H 1 2.669 0.020 . 2 . . . . 102 ASN HB3 . 26748 1 1053 . 1 1 103 103 ASN C C 13 174.054 0.3 . 1 . . . . 102 ASN C . 26748 1 1054 . 1 1 103 103 ASN CA C 13 54.200 0.3 . 1 . . . . 102 ASN CA . 26748 1 1055 . 1 1 103 103 ASN CB C 13 38.143 0.3 . 1 . . . . 102 ASN CB . 26748 1 1056 . 1 1 103 103 ASN N N 15 118.908 0.3 . 1 . . . . 102 ASN N . 26748 1 1057 . 1 1 104 104 VAL H H 1 8.436 0.020 . 1 . . . . 103 VAL H . 26748 1 1058 . 1 1 104 104 VAL HA H 1 4.507 0.020 . 1 . . . . 103 VAL HA . 26748 1 1059 . 1 1 104 104 VAL HB H 1 1.854 0.020 . 1 . . . . 103 VAL HB . 26748 1 1060 . 1 1 104 104 VAL HG11 H 1 0.830 0.020 . 1 . . . . 103 VAL HG1 . 26748 1 1061 . 1 1 104 104 VAL HG12 H 1 0.830 0.020 . 1 . . . . 103 VAL HG1 . 26748 1 1062 . 1 1 104 104 VAL HG13 H 1 0.830 0.020 . 1 . . . . 103 VAL HG1 . 26748 1 1063 . 1 1 104 104 VAL HG21 H 1 0.830 0.020 . 1 . . . . 103 VAL HG2 . 26748 1 1064 . 1 1 104 104 VAL HG22 H 1 0.830 0.020 . 1 . . . . 103 VAL HG2 . 26748 1 1065 . 1 1 104 104 VAL HG23 H 1 0.830 0.020 . 1 . . . . 103 VAL HG2 . 26748 1 1066 . 1 1 104 104 VAL C C 13 173.373 0.3 . 1 . . . . 103 VAL C . 26748 1 1067 . 1 1 104 104 VAL CA C 13 60.123 0.3 . 1 . . . . 103 VAL CA . 26748 1 1068 . 1 1 104 104 VAL CB C 13 34.354 0.3 . 1 . . . . 103 VAL CB . 26748 1 1069 . 1 1 104 104 VAL CG1 C 13 21.577 0.3 . 1 . . . . 103 VAL CG1 . 26748 1 1070 . 1 1 104 104 VAL CG2 C 13 19.833 0.3 . 1 . . . . 103 VAL CG2 . 26748 1 1071 . 1 1 104 104 VAL N N 15 113.132 0.3 . 1 . . . . 103 VAL N . 26748 1 1072 . 1 1 105 105 VAL H H 1 7.867 0.020 . 1 . . . . 104 VAL H . 26748 1 1073 . 1 1 105 105 VAL HA H 1 5.151 0.020 . 1 . . . . 104 VAL HA . 26748 1 1074 . 1 1 105 105 VAL HB H 1 1.959 0.020 . 1 . . . . 104 VAL HB . 26748 1 1075 . 1 1 105 105 VAL HG11 H 1 0.879 0.020 . 1 . . . . 104 VAL HG1 . 26748 1 1076 . 1 1 105 105 VAL HG12 H 1 0.879 0.020 . 1 . . . . 104 VAL HG1 . 26748 1 1077 . 1 1 105 105 VAL HG13 H 1 0.879 0.020 . 1 . . . . 104 VAL HG1 . 26748 1 1078 . 1 1 105 105 VAL HG21 H 1 0.929 0.020 . 1 . . . . 104 VAL HG2 . 26748 1 1079 . 1 1 105 105 VAL HG22 H 1 0.929 0.020 . 1 . . . . 104 VAL HG2 . 26748 1 1080 . 1 1 105 105 VAL HG23 H 1 0.929 0.020 . 1 . . . . 104 VAL HG2 . 26748 1 1081 . 1 1 105 105 VAL C C 13 176.262 0.3 . 1 . . . . 104 VAL C . 26748 1 1082 . 1 1 105 105 VAL CA C 13 60.994 0.3 . 1 . . . . 104 VAL CA . 26748 1 1083 . 1 1 105 105 VAL CB C 13 32.904 0.3 . 1 . . . . 104 VAL CB . 26748 1 1084 . 1 1 105 105 VAL CG1 C 13 23.218 0.3 . 1 . . . . 104 VAL CG1 . 26748 1 1085 . 1 1 105 105 VAL CG2 C 13 20.906 0.3 . 1 . . . . 104 VAL CG2 . 26748 1 1086 . 1 1 105 105 VAL N N 15 122.543 0.3 . 1 . . . . 104 VAL N . 26748 1 1087 . 1 1 106 106 VAL H H 1 8.988 0.020 . 1 . . . . 105 VAL H . 26748 1 1088 . 1 1 106 106 VAL HA H 1 5.358 0.020 . 1 . . . . 105 VAL HA . 26748 1 1089 . 1 1 106 106 VAL HB H 1 2.021 0.020 . 1 . . . . 105 VAL HB . 26748 1 1090 . 1 1 106 106 VAL HG11 H 1 0.576 0.020 . 1 . . . . 105 VAL HG1 . 26748 1 1091 . 1 1 106 106 VAL HG12 H 1 0.576 0.020 . 1 . . . . 105 VAL HG1 . 26748 1 1092 . 1 1 106 106 VAL HG13 H 1 0.576 0.020 . 1 . . . . 105 VAL HG1 . 26748 1 1093 . 1 1 106 106 VAL HG21 H 1 0.717 0.020 . 1 . . . . 105 VAL HG2 . 26748 1 1094 . 1 1 106 106 VAL HG22 H 1 0.717 0.020 . 1 . . . . 105 VAL HG2 . 26748 1 1095 . 1 1 106 106 VAL HG23 H 1 0.717 0.020 . 1 . . . . 105 VAL HG2 . 26748 1 1096 . 1 1 106 106 VAL C C 13 174.027 0.3 . 1 . . . . 105 VAL C . 26748 1 1097 . 1 1 106 106 VAL CA C 13 57.857 0.3 . 1 . . . . 105 VAL CA . 26748 1 1098 . 1 1 106 106 VAL CB C 13 35.548 0.3 . 1 . . . . 105 VAL CB . 26748 1 1099 . 1 1 106 106 VAL CG1 C 13 19.059 0.3 . 1 . . . . 105 VAL CG1 . 26748 1 1100 . 1 1 106 106 VAL CG2 C 13 21.707 0.3 . 1 . . . . 105 VAL CG2 . 26748 1 1101 . 1 1 106 106 VAL N N 15 120.192 0.3 . 1 . . . . 105 VAL N . 26748 1 1102 . 1 1 107 107 ALA H H 1 8.347 0.020 . 1 . . . . 106 ALA H . 26748 1 1103 . 1 1 107 107 ALA HA H 1 4.965 0.020 . 1 . . . . 106 ALA HA . 26748 1 1104 . 1 1 107 107 ALA HB1 H 1 1.379 0.020 . 1 . . . . 106 ALA HB . 26748 1 1105 . 1 1 107 107 ALA HB2 H 1 1.379 0.020 . 1 . . . . 106 ALA HB . 26748 1 1106 . 1 1 107 107 ALA HB3 H 1 1.379 0.020 . 1 . . . . 106 ALA HB . 26748 1 1107 . 1 1 107 107 ALA C C 13 176.971 0.3 . 1 . . . . 106 ALA C . 26748 1 1108 . 1 1 107 107 ALA CA C 13 50.607 0.3 . 1 . . . . 106 ALA CA . 26748 1 1109 . 1 1 107 107 ALA CB C 13 21.470 0.3 . 1 . . . . 106 ALA CB . 26748 1 1110 . 1 1 107 107 ALA N N 15 120.941 0.3 . 1 . . . . 106 ALA N . 26748 1 1111 . 1 1 108 108 CYS H H 1 8.932 0.020 . 1 . . . . 107 CYS H . 26748 1 1112 . 1 1 108 108 CYS HA H 1 5.449 0.020 . 1 . . . . 107 CYS HA . 26748 1 1113 . 1 1 108 108 CYS HB2 H 1 3.057 0.020 . 1 . . . . 107 CYS HB2 . 26748 1 1114 . 1 1 108 108 CYS HG H 1 2.643 0.020 . 1 . . . . 107 CYS HG . 26748 1 1115 . 1 1 108 108 CYS C C 13 174.136 0.3 . 1 . . . . 107 CYS C . 26748 1 1116 . 1 1 108 108 CYS CA C 13 55.187 0.3 . 1 . . . . 107 CYS CA . 26748 1 1117 . 1 1 108 108 CYS CB C 13 46.627 0.3 . 1 . . . . 107 CYS CB . 26748 1 1118 . 1 1 108 108 CYS N N 15 120.206 0.3 . 1 . . . . 107 CYS N . 26748 1 1119 . 1 1 109 109 GLU H H 1 9.276 0.020 . 1 . . . . 108 GLU H . 26748 1 1120 . 1 1 109 109 GLU HA H 1 4.393 0.020 . 1 . . . . 108 GLU HA . 26748 1 1121 . 1 1 109 109 GLU HB2 H 1 1.771 0.020 . 2 . . . . 108 GLU HB2 . 26748 1 1122 . 1 1 109 109 GLU HB3 H 1 1.678 0.020 . 2 . . . . 108 GLU HB3 . 26748 1 1123 . 1 1 109 109 GLU HG2 H 1 2.145 0.020 . 2 . . . . 108 GLU HG2 . 26748 1 1124 . 1 1 109 109 GLU HG3 H 1 2.094 0.020 . 2 . . . . 108 GLU HG3 . 26748 1 1125 . 1 1 109 109 GLU C C 13 176.235 0.3 . 1 . . . . 108 GLU C . 26748 1 1126 . 1 1 109 109 GLU CA C 13 56.016 0.3 . 1 . . . . 108 GLU CA . 26748 1 1127 . 1 1 109 109 GLU CB C 13 33.295 0.3 . 1 . . . . 108 GLU CB . 26748 1 1128 . 1 1 109 109 GLU CG C 13 36.278 0.3 . 1 . . . . 108 GLU CG . 26748 1 1129 . 1 1 109 109 GLU N N 15 122.493 0.3 . 1 . . . . 108 GLU N . 26748 1 1130 . 1 1 110 110 ASN H H 1 9.583 0.020 . 1 . . . . 109 ASN H . 26748 1 1131 . 1 1 110 110 ASN HA H 1 4.327 0.020 . 1 . . . . 109 ASN HA . 26748 1 1132 . 1 1 110 110 ASN HB2 H 1 2.633 0.020 . 2 . . . . 109 ASN HB2 . 26748 1 1133 . 1 1 110 110 ASN HB3 H 1 2.769 0.020 . 2 . . . . 109 ASN HB3 . 26748 1 1134 . 1 1 110 110 ASN C C 13 174.518 0.3 . 1 . . . . 109 ASN C . 26748 1 1135 . 1 1 110 110 ASN CA C 13 54.245 0.3 . 1 . . . . 109 ASN CA . 26748 1 1136 . 1 1 110 110 ASN CB C 13 37.575 0.3 . 1 . . . . 109 ASN CB . 26748 1 1137 . 1 1 110 110 ASN N N 15 126.121 0.3 . 1 . . . . 109 ASN N . 26748 1 1138 . 1 1 111 111 GLY H H 1 8.778 0.020 . 1 . . . . 110 GLY H . 26748 1 1139 . 1 1 111 111 GLY HA2 H 1 3.976 0.020 . 2 . . . . 110 GLY HA2 . 26748 1 1140 . 1 1 111 111 GLY HA3 H 1 3.393 0.020 . 2 . . . . 110 GLY HA3 . 26748 1 1141 . 1 1 111 111 GLY C C 13 172.719 0.3 . 1 . . . . 110 GLY C . 26748 1 1142 . 1 1 111 111 GLY CA C 13 45.082 0.3 . 1 . . . . 110 GLY CA . 26748 1 1143 . 1 1 111 111 GLY N N 15 102.631 0.3 . 1 . . . . 110 GLY N . 26748 1 1144 . 1 1 112 112 LEU H H 1 7.450 0.020 . 1 . . . . 111 LEU H . 26748 1 1145 . 1 1 112 112 LEU HA H 1 4.669 0.020 . 1 . . . . 111 LEU HA . 26748 1 1146 . 1 1 112 112 LEU HB2 H 1 1.486 0.020 . 2 . . . . 111 LEU HB2 . 26748 1 1147 . 1 1 112 112 LEU HB3 H 1 0.757 0.020 . 2 . . . . 111 LEU HB3 . 26748 1 1148 . 1 1 112 112 LEU HG H 1 1.319 0.020 . 1 . . . . 111 LEU HG . 26748 1 1149 . 1 1 112 112 LEU HD11 H 1 0.212 0.020 . 1 . . . . 111 LEU HD1 . 26748 1 1150 . 1 1 112 112 LEU HD12 H 1 0.212 0.020 . 1 . . . . 111 LEU HD1 . 26748 1 1151 . 1 1 112 112 LEU HD13 H 1 0.212 0.020 . 1 . . . . 111 LEU HD1 . 26748 1 1152 . 1 1 112 112 LEU HD21 H 1 0.170 0.020 . 1 . . . . 111 LEU HD2 . 26748 1 1153 . 1 1 112 112 LEU HD22 H 1 0.170 0.020 . 1 . . . . 111 LEU HD2 . 26748 1 1154 . 1 1 112 112 LEU HD23 H 1 0.170 0.020 . 1 . . . . 111 LEU HD2 . 26748 1 1155 . 1 1 112 112 LEU C C 13 173.891 0.3 . 1 . . . . 111 LEU C . 26748 1 1156 . 1 1 112 112 LEU CA C 13 50.541 0.3 . 1 . . . . 111 LEU CA . 26748 1 1157 . 1 1 112 112 LEU CB C 13 42.672 0.3 . 1 . . . . 111 LEU CB . 26748 1 1158 . 1 1 112 112 LEU CG C 13 24.753 0.3 . 1 . . . . 111 LEU CG . 26748 1 1159 . 1 1 112 112 LEU CD1 C 13 22.084 0.3 . 1 . . . . 111 LEU CD1 . 26748 1 1160 . 1 1 112 112 LEU CD2 C 13 21.477 0.3 . 1 . . . . 111 LEU CD2 . 26748 1 1161 . 1 1 112 112 LEU N N 15 118.298 0.3 . 1 . . . . 111 LEU N . 26748 1 1162 . 1 1 113 113 PRO HA H 1 4.529 0.020 . 1 . . . . 112 PRO HA . 26748 1 1163 . 1 1 113 113 PRO HB2 H 1 2.571 0.020 . 2 . . . . 112 PRO HB2 . 26748 1 1164 . 1 1 113 113 PRO HB3 H 1 1.946 0.020 . 2 . . . . 112 PRO HB3 . 26748 1 1165 . 1 1 113 113 PRO HG2 H 1 1.671 0.020 . 1 . . . . 112 PRO HG2 . 26748 1 1166 . 1 1 113 113 PRO HG3 H 1 1.671 0.020 . 1 . . . . 112 PRO HG3 . 26748 1 1167 . 1 1 113 113 PRO HD2 H 1 3.819 0.020 . 2 . . . . 112 PRO HD2 . 26748 1 1168 . 1 1 113 113 PRO HD3 H 1 3.746 0.020 . 2 . . . . 112 PRO HD3 . 26748 1 1169 . 1 1 113 113 PRO C C 13 175.226 0.3 . 1 . . . . 112 PRO C . 26748 1 1170 . 1 1 113 113 PRO CA C 13 61.878 0.3 . 1 . . . . 112 PRO CA . 26748 1 1171 . 1 1 113 113 PRO CB C 13 30.506 0.3 . 1 . . . . 112 PRO CB . 26748 1 1172 . 1 1 113 113 PRO CG C 13 27.609 0.3 . 1 . . . . 112 PRO CG . 26748 1 1173 . 1 1 113 113 PRO CD C 13 50.955 0.3 . 1 . . . . 112 PRO CD . 26748 1 1174 . 1 1 114 114 VAL H H 1 8.259 0.020 . 1 . . . . 113 VAL H . 26748 1 1175 . 1 1 114 114 VAL HA H 1 4.585 0.020 . 1 . . . . 113 VAL HA . 26748 1 1176 . 1 1 114 114 VAL HB H 1 2.224 0.020 . 1 . . . . 113 VAL HB . 26748 1 1177 . 1 1 114 114 VAL HG11 H 1 0.826 0.020 . 1 . . . . 113 VAL HG1 . 26748 1 1178 . 1 1 114 114 VAL HG12 H 1 0.826 0.020 . 1 . . . . 113 VAL HG1 . 26748 1 1179 . 1 1 114 114 VAL HG13 H 1 0.826 0.020 . 1 . . . . 113 VAL HG1 . 26748 1 1180 . 1 1 114 114 VAL HG21 H 1 0.599 0.020 . 1 . . . . 113 VAL HG2 . 26748 1 1181 . 1 1 114 114 VAL HG22 H 1 0.599 0.020 . 1 . . . . 113 VAL HG2 . 26748 1 1182 . 1 1 114 114 VAL HG23 H 1 0.599 0.020 . 1 . . . . 113 VAL HG2 . 26748 1 1183 . 1 1 114 114 VAL C C 13 176.262 0.3 . 1 . . . . 113 VAL C . 26748 1 1184 . 1 1 114 114 VAL CA C 13 60.117 0.3 . 1 . . . . 113 VAL CA . 26748 1 1185 . 1 1 114 114 VAL CB C 13 34.354 0.3 . 1 . . . . 113 VAL CB . 26748 1 1186 . 1 1 114 114 VAL CG1 C 13 22.593 0.3 . 1 . . . . 113 VAL CG1 . 26748 1 1187 . 1 1 114 114 VAL CG2 C 13 17.598 0.3 . 1 . . . . 113 VAL CG2 . 26748 1 1188 . 1 1 114 114 VAL N N 15 107.070 0.3 . 1 . . . . 113 VAL N . 26748 1 1189 . 1 1 115 115 HIS H H 1 7.381 0.020 . 1 . . . . 114 HIS H . 26748 1 1190 . 1 1 115 115 HIS HA H 1 4.146 0.020 . 1 . . . . 114 HIS HA . 26748 1 1191 . 1 1 115 115 HIS HB2 H 1 1.912 0.020 . 1 . . . . 114 HIS HB2 . 26748 1 1192 . 1 1 115 115 HIS HB3 H 1 1.912 0.020 . 1 . . . . 114 HIS HB3 . 26748 1 1193 . 1 1 115 115 HIS C C 13 172.528 0.3 . 1 . . . . 114 HIS C . 26748 1 1194 . 1 1 115 115 HIS CA C 13 55.538 0.3 . 1 . . . . 114 HIS CA . 26748 1 1195 . 1 1 115 115 HIS CB C 13 30.782 0.3 . 1 . . . . 114 HIS CB . 26748 1 1196 . 1 1 115 115 HIS N N 15 118.745 0.3 . 1 . . . . 114 HIS N . 26748 1 1197 . 1 1 116 116 LEU H H 1 8.806 0.020 . 1 . . . . 115 LEU H . 26748 1 1198 . 1 1 116 116 LEU HA H 1 4.657 0.020 . 1 . . . . 115 LEU HA . 26748 1 1199 . 1 1 116 116 LEU HB2 H 1 0.907 0.020 . 2 . . . . 115 LEU HB2 . 26748 1 1200 . 1 1 116 116 LEU HB3 H 1 0.616 0.020 . 2 . . . . 115 LEU HB3 . 26748 1 1201 . 1 1 116 116 LEU HG H 1 1.345 0.020 . 1 . . . . 115 LEU HG . 26748 1 1202 . 1 1 116 116 LEU HD11 H 1 1.178 0.020 . 1 . . . . 115 LEU HD1 . 26748 1 1203 . 1 1 116 116 LEU HD12 H 1 1.178 0.020 . 1 . . . . 115 LEU HD1 . 26748 1 1204 . 1 1 116 116 LEU HD13 H 1 1.178 0.020 . 1 . . . . 115 LEU HD1 . 26748 1 1205 . 1 1 116 116 LEU HD21 H 1 0.819 0.020 . 1 . . . . 115 LEU HD2 . 26748 1 1206 . 1 1 116 116 LEU HD22 H 1 0.819 0.020 . 1 . . . . 115 LEU HD2 . 26748 1 1207 . 1 1 116 116 LEU HD23 H 1 0.819 0.020 . 1 . . . . 115 LEU HD2 . 26748 1 1208 . 1 1 116 116 LEU C C 13 174.736 0.3 . 1 . . . . 115 LEU C . 26748 1 1209 . 1 1 116 116 LEU CA C 13 54.019 0.3 . 1 . . . . 115 LEU CA . 26748 1 1210 . 1 1 116 116 LEU CB C 13 43.150 0.3 . 1 . . . . 115 LEU CB . 26748 1 1211 . 1 1 116 116 LEU CG C 13 26.547 0.3 . 1 . . . . 115 LEU CG . 26748 1 1212 . 1 1 116 116 LEU CD1 C 13 24.787 0.3 . 1 . . . . 115 LEU CD1 . 26748 1 1213 . 1 1 116 116 LEU CD2 C 13 23.395 0.3 . 1 . . . . 115 LEU CD2 . 26748 1 1214 . 1 1 116 116 LEU N N 15 127.994 0.3 . 1 . . . . 115 LEU N . 26748 1 1215 . 1 1 117 117 ASP H H 1 7.992 0.020 . 1 . . . . 116 ASP H . 26748 1 1216 . 1 1 117 117 ASP HA H 1 4.566 0.020 . 1 . . . . 116 ASP HA . 26748 1 1217 . 1 1 117 117 ASP HB2 H 1 3.147 0.020 . 2 . . . . 116 ASP HB2 . 26748 1 1218 . 1 1 117 117 ASP HB3 H 1 2.337 0.020 . 2 . . . . 116 ASP HB3 . 26748 1 1219 . 1 1 117 117 ASP C C 13 175.853 0.3 . 1 . . . . 116 ASP C . 26748 1 1220 . 1 1 117 117 ASP CA C 13 53.735 0.3 . 1 . . . . 116 ASP CA . 26748 1 1221 . 1 1 117 117 ASP CB C 13 40.147 0.3 . 1 . . . . 116 ASP CB . 26748 1 1222 . 1 1 117 117 ASP N N 15 124.133 0.3 . 1 . . . . 116 ASP N . 26748 1 1223 . 1 1 118 118 GLN H H 1 8.620 0.020 . 1 . . . . 117 GLN H . 26748 1 1224 . 1 1 118 118 GLN HA H 1 4.246 0.020 . 1 . . . . 117 GLN HA . 26748 1 1225 . 1 1 118 118 GLN HB2 H 1 2.152 0.020 . 2 . . . . 117 GLN HB2 . 26748 1 1226 . 1 1 118 118 GLN HB3 H 1 2.094 0.020 . 2 . . . . 117 GLN HB3 . 26748 1 1227 . 1 1 118 118 GLN HG2 H 1 2.559 0.020 . 1 . . . . 117 GLN HG2 . 26748 1 1228 . 1 1 118 118 GLN HG3 H 1 2.559 0.020 . 1 . . . . 117 GLN HG3 . 26748 1 1229 . 1 1 118 118 GLN C C 13 177.816 0.3 . 1 . . . . 117 GLN C . 26748 1 1230 . 1 1 118 118 GLN CA C 13 56.361 0.3 . 1 . . . . 117 GLN CA . 26748 1 1231 . 1 1 118 118 GLN CB C 13 29.447 0.3 . 1 . . . . 117 GLN CB . 26748 1 1232 . 1 1 118 118 GLN CG C 13 35.231 0.3 . 1 . . . . 117 GLN CG . 26748 1 1233 . 1 1 118 118 GLN N N 15 125.765 0.3 . 1 . . . . 117 GLN N . 26748 1 1234 . 1 1 119 119 SER H H 1 8.561 0.020 . 1 . . . . 118 SER H . 26748 1 1235 . 1 1 119 119 SER HA H 1 4.047 0.020 . 1 . . . . 118 SER HA . 26748 1 1236 . 1 1 119 119 SER HB2 H 1 3.898 0.020 . 1 . . . . 118 SER HB2 . 26748 1 1237 . 1 1 119 119 SER HB3 H 1 3.898 0.020 . 1 . . . . 118 SER HB3 . 26748 1 1238 . 1 1 119 119 SER C C 13 176.916 0.3 . 1 . . . . 118 SER C . 26748 1 1239 . 1 1 119 119 SER CA C 13 61.807 0.3 . 1 . . . . 118 SER CA . 26748 1 1240 . 1 1 119 119 SER CB C 13 62.580 0.3 . 1 . . . . 118 SER CB . 26748 1 1241 . 1 1 119 119 SER N N 15 117.525 0.3 . 1 . . . . 118 SER N . 26748 1 1242 . 1 1 120 120 ILE H H 1 6.806 0.020 . 1 . . . . 119 ILE H . 26748 1 1243 . 1 1 120 120 ILE HA H 1 3.896 0.020 . 1 . . . . 119 ILE HA . 26748 1 1244 . 1 1 120 120 ILE HB H 1 1.615 0.020 . 1 . . . . 119 ILE HB . 26748 1 1245 . 1 1 120 120 ILE HG12 H 1 1.078 0.020 . 1 . . . . 119 ILE HG12 . 26748 1 1246 . 1 1 120 120 ILE HG13 H 1 1.078 0.020 . 1 . . . . 119 ILE HG13 . 26748 1 1247 . 1 1 120 120 ILE HG21 H 1 0.591 0.020 . 1 . . . . 119 ILE HG2 . 26748 1 1248 . 1 1 120 120 ILE HG22 H 1 0.591 0.020 . 1 . . . . 119 ILE HG2 . 26748 1 1249 . 1 1 120 120 ILE HG23 H 1 0.591 0.020 . 1 . . . . 119 ILE HG2 . 26748 1 1250 . 1 1 120 120 ILE HD11 H 1 0.542 0.020 . 1 . . . . 119 ILE HD1 . 26748 1 1251 . 1 1 120 120 ILE HD12 H 1 0.542 0.020 . 1 . . . . 119 ILE HD1 . 26748 1 1252 . 1 1 120 120 ILE HD13 H 1 0.542 0.020 . 1 . . . . 119 ILE HD1 . 26748 1 1253 . 1 1 120 120 ILE C C 13 176.044 0.3 . 1 . . . . 119 ILE C . 26748 1 1254 . 1 1 120 120 ILE CA C 13 62.485 0.3 . 1 . . . . 119 ILE CA . 26748 1 1255 . 1 1 120 120 ILE CB C 13 36.580 0.3 . 1 . . . . 119 ILE CB . 26748 1 1256 . 1 1 120 120 ILE CG1 C 13 22.448 0.3 . 1 . . . . 119 ILE CG1 . 26748 1 1257 . 1 1 120 120 ILE CG2 C 13 18.080 0.3 . 1 . . . . 119 ILE CG2 . 26748 1 1258 . 1 1 120 120 ILE CD1 C 13 13.834 0.3 . 1 . . . . 119 ILE CD1 . 26748 1 1259 . 1 1 120 120 ILE N N 15 116.152 0.3 . 1 . . . . 119 ILE N . 26748 1 1260 . 1 1 121 121 PHE H H 1 7.269 0.020 . 1 . . . . 120 PHE H . 26748 1 1261 . 1 1 121 121 PHE HA H 1 4.588 0.020 . 1 . . . . 120 PHE HA . 26748 1 1262 . 1 1 121 121 PHE HB2 H 1 3.535 0.020 . 2 . . . . 120 PHE HB2 . 26748 1 1263 . 1 1 121 121 PHE HB3 H 1 2.424 0.020 . 2 . . . . 120 PHE HB3 . 26748 1 1264 . 1 1 121 121 PHE C C 13 175.112 0.3 . 1 . . . . 120 PHE C . 26748 1 1265 . 1 1 121 121 PHE CA C 13 57.915 0.3 . 1 . . . . 120 PHE CA . 26748 1 1266 . 1 1 121 121 PHE CB C 13 39.491 0.3 . 1 . . . . 120 PHE CB . 26748 1 1267 . 1 1 121 121 PHE N N 15 118.026 0.3 . 1 . . . . 120 PHE N . 26748 1 1268 . 1 1 122 122 ARG H H 1 7.409 0.020 . 1 . . . . 121 ARG H . 26748 1 1269 . 1 1 122 122 ARG HA H 1 4.129 0.020 . 1 . . . . 121 ARG HA . 26748 1 1270 . 1 1 122 122 ARG HB2 H 1 1.891 0.020 . 2 . . . . 121 ARG HB2 . 26748 1 1271 . 1 1 122 122 ARG HB3 H 1 1.833 0.020 . 2 . . . . 121 ARG HB3 . 26748 1 1272 . 1 1 122 122 ARG HG2 H 1 1.605 0.020 . 2 . . . . 121 ARG HG2 . 26748 1 1273 . 1 1 122 122 ARG HG3 H 1 1.692 0.020 . 2 . . . . 121 ARG HG3 . 26748 1 1274 . 1 1 122 122 ARG HD2 H 1 3.197 0.020 . 2 . . . . 121 ARG HD2 . 26748 1 1275 . 1 1 122 122 ARG HD3 H 1 3.133 0.020 . 2 . . . . 121 ARG HD3 . 26748 1 1276 . 1 1 122 122 ARG C C 13 175.645 0.3 . 1 . . . . 121 ARG C . 26748 1 1277 . 1 1 122 122 ARG CA C 13 57.161 0.3 . 1 . . . . 121 ARG CA . 26748 1 1278 . 1 1 122 122 ARG CB C 13 30.471 0.3 . 1 . . . . 121 ARG CB . 26748 1 1279 . 1 1 122 122 ARG CG C 13 27.806 0.3 . 1 . . . . 121 ARG CG . 26748 1 1280 . 1 1 122 122 ARG CD C 13 43.321 0.3 . 1 . . . . 121 ARG CD . 26748 1 1281 . 1 1 122 122 ARG N N 15 119.277 0.3 . 1 . . . . 121 ARG N . 26748 1 1282 . 1 1 123 123 ARG H H 1 7.873 0.020 . 1 . . . . 122 ARG H . 26748 1 1283 . 1 1 123 123 ARG HA H 1 4.616 0.020 . 1 . . . . 122 ARG HA . 26748 1 1284 . 1 1 123 123 ARG HB2 H 1 1.797 0.020 . 2 . . . . 122 ARG HB2 . 26748 1 1285 . 1 1 123 123 ARG HB3 H 1 1.902 0.020 . 2 . . . . 122 ARG HB3 . 26748 1 1286 . 1 1 123 123 ARG HG2 H 1 1.418 0.020 . 2 . . . . 122 ARG HG2 . 26748 1 1287 . 1 1 123 123 ARG HG3 H 1 1.616 0.020 . 2 . . . . 122 ARG HG3 . 26748 1 1288 . 1 1 123 123 ARG HD2 H 1 2.809 0.020 . 2 . . . . 122 ARG HD2 . 26748 1 1289 . 1 1 123 123 ARG HD3 H 1 2.761 0.020 . 2 . . . . 122 ARG HD3 . 26748 1 1290 . 1 1 123 123 ARG C C 13 173.155 0.3 . 1 . . . . 122 ARG C . 26748 1 1291 . 1 1 123 123 ARG CA C 13 53.503 0.3 . 1 . . . . 122 ARG CA . 26748 1 1292 . 1 1 123 123 ARG CB C 13 29.332 0.3 . 1 . . . . 122 ARG CB . 26748 1 1293 . 1 1 123 123 ARG CG C 13 24.572 0.3 . 1 . . . . 122 ARG CG . 26748 1 1294 . 1 1 123 123 ARG CD C 13 42.223 0.3 . 1 . . . . 122 ARG CD . 26748 1 1295 . 1 1 123 123 ARG N N 15 121.524 0.3 . 1 . . . . 122 ARG N . 26748 1 stop_ save_