data_26808 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 26808 _Entry.Title ; Egr-1 - DNA complex ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2016-05-25 _Entry.Accession_date 2016-05-25 _Entry.Last_release_date 2016-06-29 _Entry.Original_release_date 2016-06-29 _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 Junji Iwahara . . . . 26808 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 26808 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 366 26808 '15N chemical shifts' 109 26808 '1H chemical shifts' 542 26808 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 2 . . 2016-10-26 2016-05-25 update BMRB 'update entry citation' 26808 1 . . 2016-06-29 2016-05-25 original author 'original release' 26808 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 26807 'DNA-binding domain of the human Egr-1 in the free state' 26808 stop_ save_ ############### # Citations # ############### save_Manuscript_1 _Citation.Sf_category citations _Citation.Sf_framecode Manuscript_1 _Citation.Entry_ID 26808 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 27288446 _Citation.Full_citation . _Citation.Title ; Changes in conformational dynamics of basic side chains upon protein-DNA association ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Nucleic Acids Res.' _Citation.Journal_name_full . _Citation.Journal_volume 44 _Citation.Journal_issue 14 _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 6961 _Citation.Page_last 6970 _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 Alexandre Esadze . . . . 26808 1 2 Chuanying Chen . . . . 26808 1 3 Levani Zandarashvili . . . . 26808 1 4 Sourav Roy . . . . 26808 1 5 'B. Montgomery' Pettitt . . . . 26808 1 6 Junji Iwahara . . . . 26808 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 26808 _Assembly.ID 1 _Assembly.Name 'Egr-1 DNA complex' _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 'The DNA-binding domain of the human Egr-1 protein' 1 $The_Egr-1_zinc-finger_protein A . yes native no no . . . 26808 1 2 'DNA strand 1' 2 $DNA_strand_1 B . no native no no . . . 26808 1 3 'DNA strand 2' 3 $DNA_strand_2 C . no native no no . . . 26808 1 4 'Zinc ion 1' 4 $entity_ZN D . no na no no . . . 26808 1 5 'Zinc ion 2' 4 $entity_ZN E . no na no no . . . 26808 1 6 'Zinc ion 3' 4 $entity_ZN F . no na no no . . . 26808 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_The_Egr-1_zinc-finger_protein _Entity.Sf_category entity _Entity.Sf_framecode The_Egr-1_zinc-finger_protein _Entity.Entry_ID 26808 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name The_Egr-1_zinc-finger_protein _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 ; PERPYACPVESCDRRFSRSD ELTRHIRIHTGQKPFQCRIC MRNFSRSDHLTTHIRTHTGE KPFACDICGRKFARSDERKR HTKIHLRQKD ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 90 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'free and other bound' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . PRO . 26808 1 2 . GLU . 26808 1 3 . ARG . 26808 1 4 . PRO . 26808 1 5 . TYR . 26808 1 6 . ALA . 26808 1 7 . CYS . 26808 1 8 . PRO . 26808 1 9 . VAL . 26808 1 10 . GLU . 26808 1 11 . SER . 26808 1 12 . CYS . 26808 1 13 . ASP . 26808 1 14 . ARG . 26808 1 15 . ARG . 26808 1 16 . PHE . 26808 1 17 . SER . 26808 1 18 . ARG . 26808 1 19 . SER . 26808 1 20 . ASP . 26808 1 21 . GLU . 26808 1 22 . LEU . 26808 1 23 . THR . 26808 1 24 . ARG . 26808 1 25 . HIS . 26808 1 26 . ILE . 26808 1 27 . ARG . 26808 1 28 . ILE . 26808 1 29 . HIS . 26808 1 30 . THR . 26808 1 31 . GLY . 26808 1 32 . GLN . 26808 1 33 . LYS . 26808 1 34 . PRO . 26808 1 35 . PHE . 26808 1 36 . GLN . 26808 1 37 . CYS . 26808 1 38 . ARG . 26808 1 39 . ILE . 26808 1 40 . CYS . 26808 1 41 . MET . 26808 1 42 . ARG . 26808 1 43 . ASN . 26808 1 44 . PHE . 26808 1 45 . SER . 26808 1 46 . ARG . 26808 1 47 . SER . 26808 1 48 . ASP . 26808 1 49 . HIS . 26808 1 50 . LEU . 26808 1 51 . THR . 26808 1 52 . THR . 26808 1 53 . HIS . 26808 1 54 . ILE . 26808 1 55 . ARG . 26808 1 56 . THR . 26808 1 57 . HIS . 26808 1 58 . THR . 26808 1 59 . GLY . 26808 1 60 . GLU . 26808 1 61 . LYS . 26808 1 62 . PRO . 26808 1 63 . PHE . 26808 1 64 . ALA . 26808 1 65 . CYS . 26808 1 66 . ASP . 26808 1 67 . ILE . 26808 1 68 . CYS . 26808 1 69 . GLY . 26808 1 70 . ARG . 26808 1 71 . LYS . 26808 1 72 . PHE . 26808 1 73 . ALA . 26808 1 74 . ARG . 26808 1 75 . SER . 26808 1 76 . ASP . 26808 1 77 . GLU . 26808 1 78 . ARG . 26808 1 79 . LYS . 26808 1 80 . ARG . 26808 1 81 . HIS . 26808 1 82 . THR . 26808 1 83 . LYS . 26808 1 84 . ILE . 26808 1 85 . HIS . 26808 1 86 . LEU . 26808 1 87 . ARG . 26808 1 88 . GLN . 26808 1 89 . LYS . 26808 1 90 . ASP . 26808 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 . PRO 1 1 26808 1 . GLU 2 2 26808 1 . ARG 3 3 26808 1 . PRO 4 4 26808 1 . TYR 5 5 26808 1 . ALA 6 6 26808 1 . CYS 7 7 26808 1 . PRO 8 8 26808 1 . VAL 9 9 26808 1 . GLU 10 10 26808 1 . SER 11 11 26808 1 . CYS 12 12 26808 1 . ASP 13 13 26808 1 . ARG 14 14 26808 1 . ARG 15 15 26808 1 . PHE 16 16 26808 1 . SER 17 17 26808 1 . ARG 18 18 26808 1 . SER 19 19 26808 1 . ASP 20 20 26808 1 . GLU 21 21 26808 1 . LEU 22 22 26808 1 . THR 23 23 26808 1 . ARG 24 24 26808 1 . HIS 25 25 26808 1 . ILE 26 26 26808 1 . ARG 27 27 26808 1 . ILE 28 28 26808 1 . HIS 29 29 26808 1 . THR 30 30 26808 1 . GLY 31 31 26808 1 . GLN 32 32 26808 1 . LYS 33 33 26808 1 . PRO 34 34 26808 1 . PHE 35 35 26808 1 . GLN 36 36 26808 1 . CYS 37 37 26808 1 . ARG 38 38 26808 1 . ILE 39 39 26808 1 . CYS 40 40 26808 1 . MET 41 41 26808 1 . ARG 42 42 26808 1 . ASN 43 43 26808 1 . PHE 44 44 26808 1 . SER 45 45 26808 1 . ARG 46 46 26808 1 . SER 47 47 26808 1 . ASP 48 48 26808 1 . HIS 49 49 26808 1 . LEU 50 50 26808 1 . THR 51 51 26808 1 . THR 52 52 26808 1 . HIS 53 53 26808 1 . ILE 54 54 26808 1 . ARG 55 55 26808 1 . THR 56 56 26808 1 . HIS 57 57 26808 1 . THR 58 58 26808 1 . GLY 59 59 26808 1 . GLU 60 60 26808 1 . LYS 61 61 26808 1 . PRO 62 62 26808 1 . PHE 63 63 26808 1 . ALA 64 64 26808 1 . CYS 65 65 26808 1 . ASP 66 66 26808 1 . ILE 67 67 26808 1 . CYS 68 68 26808 1 . GLY 69 69 26808 1 . ARG 70 70 26808 1 . LYS 71 71 26808 1 . PHE 72 72 26808 1 . ALA 73 73 26808 1 . ARG 74 74 26808 1 . SER 75 75 26808 1 . ASP 76 76 26808 1 . GLU 77 77 26808 1 . ARG 78 78 26808 1 . LYS 79 79 26808 1 . ARG 80 80 26808 1 . HIS 81 81 26808 1 . THR 82 82 26808 1 . LYS 83 83 26808 1 . ILE 84 84 26808 1 . HIS 85 85 26808 1 . LEU 86 86 26808 1 . ARG 87 87 26808 1 . GLN 88 88 26808 1 . LYS 89 89 26808 1 . ASP 90 90 26808 1 stop_ save_ save_DNA_strand_1 _Entity.Sf_category entity _Entity.Sf_framecode DNA_strand_1 _Entity.Entry_ID 26808 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name DNA_strand_1 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polydeoxyribonucleotide _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; AGCGTGGGCGTA ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 12 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . DA . 26808 2 2 . DG . 26808 2 3 . DC . 26808 2 4 . DG . 26808 2 5 . DT . 26808 2 6 . DG . 26808 2 7 . DG . 26808 2 8 . DG . 26808 2 9 . DC . 26808 2 10 . DG . 26808 2 11 . DT . 26808 2 12 . DA . 26808 2 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 . DA 1 1 26808 2 . DG 2 2 26808 2 . DC 3 3 26808 2 . DG 4 4 26808 2 . DT 5 5 26808 2 . DG 6 6 26808 2 . DG 7 7 26808 2 . DG 8 8 26808 2 . DC 9 9 26808 2 . DG 10 10 26808 2 . DT 11 11 26808 2 . DA 12 12 26808 2 stop_ save_ save_DNA_strand_2 _Entity.Sf_category entity _Entity.Sf_framecode DNA_strand_2 _Entity.Entry_ID 26808 _Entity.ID 3 _Entity.BMRB_code . _Entity.Name DNA_strand_2 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polydeoxyribonucleotide _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; TACGCCCACGCT ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 12 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . DT . 26808 3 2 . DA . 26808 3 3 . DC . 26808 3 4 . DG . 26808 3 5 . DC . 26808 3 6 . DC . 26808 3 7 . DC . 26808 3 8 . DA . 26808 3 9 . DC . 26808 3 10 . DG . 26808 3 11 . DC . 26808 3 12 . DT . 26808 3 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 . DT 1 1 26808 3 . DA 2 2 26808 3 . DC 3 3 26808 3 . DG 4 4 26808 3 . DC 5 5 26808 3 . DC 6 6 26808 3 . DC 7 7 26808 3 . DA 8 8 26808 3 . DC 9 9 26808 3 . DG 10 10 26808 3 . DC 11 11 26808 3 . DT 12 12 26808 3 stop_ save_ save_entity_ZN _Entity.Sf_category entity _Entity.Sf_framecode entity_ZN _Entity.Entry_ID 26808 _Entity.ID 4 _Entity.BMRB_code ZN _Entity.Name entity_ZN _Entity.Type non-polymer _Entity.Polymer_common_type . _Entity.Polymer_type . _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code . _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer . _Entity.Nstd_chirality . _Entity.Nstd_linkage . _Entity.Nonpolymer_comp_ID ZN _Entity.Nonpolymer_comp_label $chem_comp_ZN _Entity.Number_of_monomers . _Entity.Number_of_nonpolymer_components 1 _Entity.Paramagnetic . _Entity.Thiol_state . _Entity.Src_method . _Entity.Parent_entity_ID 4 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 65.409 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'ZINC ION' BMRB 26808 4 stop_ loop_ _Entity_systematic_name.Name _Entity_systematic_name.Naming_system _Entity_systematic_name.Entry_ID _Entity_systematic_name.Entity_ID 'ZINC ION' BMRB 26808 4 ZN 'Three letter code' 26808 4 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 1 ZN $chem_comp_ZN 26808 4 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 26808 _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 $The_Egr-1_zinc-finger_protein . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . 26808 1 2 2 $DNA_strand_1 . . 'no natural source' . . . . . . . . . . . . . . . . . . . . . . 26808 1 3 3 $DNA_strand_2 . . 'no natural source' . . . . . . . . . . . . . . . . . . . . . . 26808 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 26808 _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 $The_Egr-1_zinc-finger_protein . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . pET49b . . . 26808 1 2 2 $DNA_strand_1 . 'chemical synthesis' . . . . . . . . . . . . . . . . 26808 1 3 2 $DNA_strand_1 . 'chemical synthesis' . . . . . . . . . . . . . . . . 26808 1 stop_ save_ ################################# # Polymer residues and ligands # ################################# save_chem_comp_ZN _Chem_comp.Sf_category chem_comp _Chem_comp.Sf_framecode chem_comp_ZN _Chem_comp.Entry_ID 26808 _Chem_comp.ID ZN _Chem_comp.Provenance PDB _Chem_comp.Name 'ZINC ION' _Chem_comp.Type NON-POLYMER _Chem_comp.BMRB_code ZN _Chem_comp.PDB_code ZN _Chem_comp.Ambiguous_flag no _Chem_comp.Initial_date 2012-11-20 _Chem_comp.Modified_date 2012-11-20 _Chem_comp.Release_status REL _Chem_comp.Replaced_by . _Chem_comp.Replaces . _Chem_comp.One_letter_code . _Chem_comp.Three_letter_code ZN _Chem_comp.Number_atoms_all 1 _Chem_comp.Number_atoms_nh 1 _Chem_comp.PubChem_code . _Chem_comp.Subcomponent_list . _Chem_comp.InChI_code InChI=1S/Zn/q+2 _Chem_comp.Mon_nstd_flag . _Chem_comp.Mon_nstd_class . _Chem_comp.Mon_nstd_details . _Chem_comp.Mon_nstd_parent . _Chem_comp.Mon_nstd_parent_comp_ID . _Chem_comp.Std_deriv_one_letter_code . _Chem_comp.Std_deriv_three_letter_code . _Chem_comp.Std_deriv_BMRB_code . _Chem_comp.Std_deriv_PDB_code . _Chem_comp.Std_deriv_chem_comp_name . _Chem_comp.Synonyms . _Chem_comp.Formal_charge 2 _Chem_comp.Paramagnetic . _Chem_comp.Aromatic no _Chem_comp.Formula Zn _Chem_comp.Formula_weight 65.409 _Chem_comp.Formula_mono_iso_wt_nat . _Chem_comp.Formula_mono_iso_wt_13C . _Chem_comp.Formula_mono_iso_wt_15N . _Chem_comp.Formula_mono_iso_wt_13C_15N . _Chem_comp.Image_file_name . _Chem_comp.Image_file_format . _Chem_comp.Topo_file_name . _Chem_comp.Topo_file_format . _Chem_comp.Struct_file_name . _Chem_comp.Struct_file_format . _Chem_comp.Stereochem_param_file_name . _Chem_comp.Stereochem_param_file_format . _Chem_comp.Model_details . _Chem_comp.Model_erf . _Chem_comp.Model_source . _Chem_comp.Model_coordinates_details . _Chem_comp.Model_coordinates_missing_flag no _Chem_comp.Ideal_coordinates_details . _Chem_comp.Ideal_coordinates_missing_flag no _Chem_comp.Model_coordinates_db_code . _Chem_comp.Processing_site RCSB _Chem_comp.Vendor . _Chem_comp.Vendor_product_code . _Chem_comp.Details . _Chem_comp.DB_query_date . _Chem_comp.DB_last_query_revised_last_date . loop_ _Chem_comp_descriptor.Descriptor _Chem_comp_descriptor.Type _Chem_comp_descriptor.Program _Chem_comp_descriptor.Program_version _Chem_comp_descriptor.Entry_ID _Chem_comp_descriptor.Comp_ID InChI=1S/Zn/q+2 InChI InChI 1.03 26808 ZN PTFCDOFLOPIGGS-UHFFFAOYSA-N InChIKey InChI 1.03 26808 ZN [Zn++] SMILES CACTVS 3.341 26808 ZN [Zn++] SMILES_CANONICAL CACTVS 3.341 26808 ZN [Zn+2] SMILES ACDLabs 10.04 26808 ZN [Zn+2] SMILES 'OpenEye OEToolkits' 1.5.0 26808 ZN [Zn+2] SMILES_CANONICAL 'OpenEye OEToolkits' 1.5.0 26808 ZN stop_ loop_ _Chem_comp_identifier.Identifier _Chem_comp_identifier.Type _Chem_comp_identifier.Program _Chem_comp_identifier.Program_version _Chem_comp_identifier.Entry_ID _Chem_comp_identifier.Comp_ID zinc 'SYSTEMATIC NAME' ACDLabs 10.04 26808 ZN 'zinc(+2) cation' 'SYSTEMATIC NAME' 'OpenEye OEToolkits' 1.5.0 26808 ZN stop_ loop_ _Chem_comp_atom.Atom_ID _Chem_comp_atom.BMRB_code _Chem_comp_atom.PDB_atom_ID _Chem_comp_atom.Alt_atom_ID _Chem_comp_atom.Auth_atom_ID _Chem_comp_atom.Type_symbol _Chem_comp_atom.Isotope_number _Chem_comp_atom.Chirality _Chem_comp_atom.Stereo_config _Chem_comp_atom.Charge _Chem_comp_atom.Partial_charge _Chem_comp_atom.Oxidation_number _Chem_comp_atom.Unpaired_electron_number _Chem_comp_atom.Align _Chem_comp_atom.Aromatic_flag _Chem_comp_atom.Leaving_atom_flag _Chem_comp_atom.Substruct_code _Chem_comp_atom.Ionizable _Chem_comp_atom.Drawing_2D_coord_x _Chem_comp_atom.Drawing_2D_coord_y _Chem_comp_atom.Model_Cartn_x _Chem_comp_atom.Model_Cartn_x_esd _Chem_comp_atom.Model_Cartn_y _Chem_comp_atom.Model_Cartn_y_esd _Chem_comp_atom.Model_Cartn_z _Chem_comp_atom.Model_Cartn_z_esd _Chem_comp_atom.Model_Cartn_x_ideal _Chem_comp_atom.Model_Cartn_y_ideal _Chem_comp_atom.Model_Cartn_z_ideal _Chem_comp_atom.PDBX_ordinal _Chem_comp_atom.Details _Chem_comp_atom.Entry_ID _Chem_comp_atom.Comp_ID ZN ZN ZN ZN . ZN . . N 2 . . . 0 no no . . . . 0.000 . 0.000 . 0.000 . 0.000 0.000 0.000 1 . 26808 ZN stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 26808 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% H2O (D2O separated in co-axial tube)' _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 'The Egr-1 zinc-finger protein' '[U-99% 13C; U-99% 15N]' . . 1 $The_Egr-1_zinc-finger_protein . . 1 . . mM . . . . 26808 1 2 'Zinc ion 1' 'natural abundance' . . 4 $entity_ZN . . 1 . . mM . . . . 26808 1 3 'Zinc ion 2' 'natural abundance' . . 4 $entity_ZN . . 1 . . mM . . . . 26808 1 4 'Zinc ion 3' 'natural abundance' . . 4 $entity_ZN . . 1 . . mM . . . . 26808 1 5 'DNA strand 1' 'natural abundance' . . 2 $DNA_strand_1 . . 1.5 . . mM . . . . 26808 1 6 'DNA strand 2' 'natural abundance' . . 3 $DNA_strand_2 . . 1.5 . . mM . . . . 26808 1 7 'potassium succinate' '[U-99% 2H]' . . . . . . 20 . . mM . . . . 26808 1 8 'potassium chloride' 'natural abundance' . . . . . . 20 . . mM . . . . 26808 1 9 'zinc chloride' 'natural abundance' . . . . . . 0.1 . . mM . . . . 26808 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 26808 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0.040 . M 26808 1 pH 5.8 . pH 26808 1 pressure 1 . atm 26808 1 temperature 303.15 . K 26808 1 stop_ save_ ############################ # Computer software used # ############################ save_NMRView _Software.Sf_category software _Software.Sf_framecode NMRView _Software.Entry_ID 26808 _Software.ID 1 _Software.Name NMRView _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Johnson, One Moon Scientific' . . 26808 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 26808 1 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 26808 _Software.ID 2 _Software.Name NMRPipe _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 26808 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 26808 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 26808 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 26808 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_spectrometer_3 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_3 _NMR_spectrometer.Entry_ID 26808 _NMR_spectrometer.ID 3 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 750 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 26808 _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 . 800 . . . 26808 1 2 spectrometer_2 Bruker Avance . 600 . . . 26808 1 3 spectrometer_3 Bruker Avance . 750 . . . 26808 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 26808 _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 . . . . . . . . . . . . . . . . . . . . . 26808 1 2 '2D 1H-13C HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 26808 1 3 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 26808 1 4 '3D HN(CA)CO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 26808 1 5 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 26808 1 6 '3D HN(CO)CA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 26808 1 7 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 26808 1 8 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 26808 1 9 '3D HBHA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 26808 1 10 '3D H(CCO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 26808 1 11 '3D C(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 26808 1 12 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 26808 1 13 '3D HCCH-TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 26808 1 14 '3D HCCH-COSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 26808 1 15 '2D (H2C)N(CC)H-TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 26808 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 26808 _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 . . . . . 26808 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . 26808 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . 26808 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 26808 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 26808 1 2 '2D 1H-13C HSQC' . . . 26808 1 3 '3D HNCO' . . . 26808 1 4 '3D HN(CA)CO' . . . 26808 1 5 '3D HNCA' . . . 26808 1 6 '3D HN(CO)CA' . . . 26808 1 7 '3D CBCA(CO)NH' . . . 26808 1 8 '3D HNCACB' . . . 26808 1 9 '3D HBHA(CO)NH' . . . 26808 1 10 '3D H(CCO)NH' . . . 26808 1 11 '3D C(CO)NH' . . . 26808 1 12 '3D 1H-15N NOESY' . . . 26808 1 13 '3D HCCH-TOCSY' . . . 26808 1 14 '3D HCCH-COSY' . . . 26808 1 15 '2D (H2C)N(CC)H-TOCSY' . . . 26808 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 PRO HA H 1 4.491 0.02 . 1 . . . . 1 PRO HA . 26808 1 2 . 1 1 1 1 PRO HB2 H 1 1.980 0.02 . 2 . . . . 1 PRO HB2 . 26808 1 3 . 1 1 1 1 PRO HB3 H 1 2.338 0.02 . 2 . . . . 1 PRO HB3 . 26808 1 4 . 1 1 1 1 PRO HG2 H 1 2.081 0.02 . 2 . . . . 1 PRO HG2 . 26808 1 5 . 1 1 1 1 PRO HG3 H 1 2.081 0.02 . 2 . . . . 1 PRO HG3 . 26808 1 6 . 1 1 1 1 PRO HD2 H 1 3.665 0.02 . 2 . . . . 1 PRO HD2 . 26808 1 7 . 1 1 1 1 PRO HD3 H 1 3.596 0.02 . 2 . . . . 1 PRO HD3 . 26808 1 8 . 1 1 1 1 PRO C C 13 176.794 0.30 . 1 . . . . 1 PRO C . 26808 1 9 . 1 1 1 1 PRO CA C 13 63.468 0.30 . 1 . . . . 1 PRO CA . 26808 1 10 . 1 1 1 1 PRO CB C 13 32.152 0.30 . 1 . . . . 1 PRO CB . 26808 1 11 . 1 1 1 1 PRO CG C 13 26.845 0.30 . 1 . . . . 1 PRO CG . 26808 1 12 . 1 1 1 1 PRO CD C 13 49.635 0.30 . 1 . . . . 1 PRO CD . 26808 1 13 . 1 1 2 2 GLU H H 1 8.584 0.02 . 1 . . . . 2 GLU H . 26808 1 14 . 1 1 2 2 GLU HA H 1 4.242 0.02 . 1 . . . . 2 GLU HA . 26808 1 15 . 1 1 2 2 GLU HB2 H 1 2.015 0.02 . 2 . . . . 2 GLU HB2 . 26808 1 16 . 1 1 2 2 GLU HB3 H 1 1.961 0.02 . 2 . . . . 2 GLU HB3 . 26808 1 17 . 1 1 2 2 GLU HG2 H 1 2.254 0.02 . 2 . . . . 2 GLU HG2 . 26808 1 18 . 1 1 2 2 GLU HG3 H 1 2.314 0.02 . 2 . . . . 2 GLU HG3 . 26808 1 19 . 1 1 2 2 GLU C C 13 176.474 0.30 . 1 . . . . 2 GLU C . 26808 1 20 . 1 1 2 2 GLU CA C 13 56.856 0.30 . 1 . . . . 2 GLU CA . 26808 1 21 . 1 1 2 2 GLU CB C 13 29.983 0.30 . 1 . . . . 2 GLU CB . 26808 1 22 . 1 1 2 2 GLU CG C 13 36.036 0.30 . 1 . . . . 2 GLU CG . 26808 1 23 . 1 1 2 2 GLU N N 15 120.830 0.20 . 1 . . . . 2 GLU N . 26808 1 24 . 1 1 3 3 ARG H H 1 8.512 0.02 . 1 . . . . 3 ARG H . 26808 1 25 . 1 1 3 3 ARG HA H 1 4.538 0.02 . 1 . . . . 3 ARG HA . 26808 1 26 . 1 1 3 3 ARG HB2 H 1 1.576 0.02 . 2 . . . . 3 ARG HB2 . 26808 1 27 . 1 1 3 3 ARG HB3 H 1 1.335 0.02 . 2 . . . . 3 ARG HB3 . 26808 1 28 . 1 1 3 3 ARG HG2 H 1 1.426 0.02 . 2 . . . . 3 ARG HG2 . 26808 1 29 . 1 1 3 3 ARG HG3 H 1 1.594 0.02 . 2 . . . . 3 ARG HG3 . 26808 1 30 . 1 1 3 3 ARG HD2 H 1 2.943 0.02 . 2 . . . . 3 ARG HD2 . 26808 1 31 . 1 1 3 3 ARG HD3 H 1 2.943 0.02 . 2 . . . . 3 ARG HD3 . 26808 1 32 . 1 1 3 3 ARG HE H 1 7.119 0.02 . 1 . . . . 3 ARG HE . 26808 1 33 . 1 1 3 3 ARG C C 13 174.231 0.30 . 1 . . . . 3 ARG C . 26808 1 34 . 1 1 3 3 ARG CA C 13 53.744 0.30 . 1 . . . . 3 ARG CA . 26808 1 35 . 1 1 3 3 ARG CB C 13 31.457 0.30 . 1 . . . . 3 ARG CB . 26808 1 36 . 1 1 3 3 ARG CG C 13 27.167 0.30 . 1 . . . . 3 ARG CG . 26808 1 37 . 1 1 3 3 ARG CD C 13 43.979 0.30 . 1 . . . . 3 ARG CD . 26808 1 38 . 1 1 3 3 ARG N N 15 121.836 0.20 . 1 . . . . 3 ARG N . 26808 1 39 . 1 1 3 3 ARG NE N 15 85.456 0.20 . 1 . . . . 3 ARG NE . 26808 1 40 . 1 1 4 4 PRO HA H 1 4.222 0.02 . 1 . . . . 4 PRO HA . 26808 1 41 . 1 1 4 4 PRO HB2 H 1 0.868 0.02 . 2 . . . . 4 PRO HB2 . 26808 1 42 . 1 1 4 4 PRO HB3 H 1 1.981 0.02 . 2 . . . . 4 PRO HB3 . 26808 1 43 . 1 1 4 4 PRO HG2 H 1 1.383 0.02 . 2 . . . . 4 PRO HG2 . 26808 1 44 . 1 1 4 4 PRO HG3 H 1 1.576 0.02 . 2 . . . . 4 PRO HG3 . 26808 1 45 . 1 1 4 4 PRO HD2 H 1 3.747 0.02 . 2 . . . . 4 PRO HD2 . 26808 1 46 . 1 1 4 4 PRO HD3 H 1 3.471 0.02 . 2 . . . . 4 PRO HD3 . 26808 1 47 . 1 1 4 4 PRO C C 13 176.771 0.30 . 1 . . . . 4 PRO C . 26808 1 48 . 1 1 4 4 PRO CA C 13 63.827 0.30 . 1 . . . . 4 PRO CA . 26808 1 49 . 1 1 4 4 PRO CB C 13 32.472 0.30 . 1 . . . . 4 PRO CB . 26808 1 50 . 1 1 4 4 PRO CG C 13 26.376 0.30 . 1 . . . . 4 PRO CG . 26808 1 51 . 1 1 4 4 PRO CD C 13 50.160 0.30 . 1 . . . . 4 PRO CD . 26808 1 52 . 1 1 5 5 TYR H H 1 7.808 0.02 . 1 . . . . 5 TYR H . 26808 1 53 . 1 1 5 5 TYR HA H 1 4.627 0.02 . 1 . . . . 5 TYR HA . 26808 1 54 . 1 1 5 5 TYR HB2 H 1 2.974 0.02 . 2 . . . . 5 TYR HB2 . 26808 1 55 . 1 1 5 5 TYR HB3 H 1 2.910 0.02 . 2 . . . . 5 TYR HB3 . 26808 1 56 . 1 1 5 5 TYR C C 13 174.416 0.30 . 1 . . . . 5 TYR C . 26808 1 57 . 1 1 5 5 TYR CA C 13 58.009 0.30 . 1 . . . . 5 TYR CA . 26808 1 58 . 1 1 5 5 TYR CB C 13 38.099 0.30 . 1 . . . . 5 TYR CB . 26808 1 59 . 1 1 5 5 TYR N N 15 117.135 0.20 . 1 . . . . 5 TYR N . 26808 1 60 . 1 1 6 6 ALA H H 1 8.506 0.02 . 1 . . . . 6 ALA H . 26808 1 61 . 1 1 6 6 ALA HA H 1 4.807 0.02 . 1 . . . . 6 ALA HA . 26808 1 62 . 1 1 6 6 ALA C C 13 175.928 0.30 . 1 . . . . 6 ALA C . 26808 1 63 . 1 1 6 6 ALA CA C 13 50.640 0.30 . 1 . . . . 6 ALA CA . 26808 1 64 . 1 1 6 6 ALA CB C 13 20.467 0.30 . 1 . . . . 6 ALA CB . 26808 1 65 . 1 1 6 6 ALA N N 15 127.979 0.20 . 1 . . . . 6 ALA N . 26808 1 66 . 1 1 7 7 CYS H H 1 8.406 0.02 . 1 . . . . 7 CYS H . 26808 1 67 . 1 1 7 7 CYS HA H 1 4.744 0.02 . 1 . . . . 7 CYS HA . 26808 1 68 . 1 1 7 7 CYS HB2 H 1 2.891 0.02 . 2 . . . . 7 CYS HB2 . 26808 1 69 . 1 1 7 7 CYS HB3 H 1 3.130 0.02 . 2 . . . . 7 CYS HB3 . 26808 1 70 . 1 1 7 7 CYS C C 13 175.928 0.30 . 1 . . . . 7 CYS C . 26808 1 71 . 1 1 7 7 CYS CA C 13 58.225 0.30 . 1 . . . . 7 CYS CA . 26808 1 72 . 1 1 7 7 CYS CB C 13 40.967 0.30 . 1 . . . . 7 CYS CB . 26808 1 73 . 1 1 7 7 CYS N N 15 125.705 0.20 . 1 . . . . 7 CYS N . 26808 1 74 . 1 1 8 8 PRO HA H 1 4.674 0.02 . 1 . . . . 8 PRO HA . 26808 1 75 . 1 1 8 8 PRO HB2 H 1 2.190 0.02 . 2 . . . . 8 PRO HB2 . 26808 1 76 . 1 1 8 8 PRO HB3 H 1 2.311 0.02 . 2 . . . . 8 PRO HB3 . 26808 1 77 . 1 1 8 8 PRO HG2 H 1 1.944 0.02 . 2 . . . . 8 PRO HG2 . 26808 1 78 . 1 1 8 8 PRO HG3 H 1 1.944 0.02 . 2 . . . . 8 PRO HG3 . 26808 1 79 . 1 1 8 8 PRO HD3 H 1 3.333 0.02 . 2 . . . . 8 PRO HD3 . 26808 1 80 . 1 1 8 8 PRO C C 13 177.119 0.30 . 1 . . . . 8 PRO C . 26808 1 81 . 1 1 8 8 PRO CA C 13 63.643 0.30 . 1 . . . . 8 PRO CA . 26808 1 82 . 1 1 8 8 PRO CB C 13 32.058 0.30 . 1 . . . . 8 PRO CB . 26808 1 83 . 1 1 8 8 PRO CG C 13 26.050 0.30 . 1 . . . . 8 PRO CG . 26808 1 84 . 1 1 8 8 PRO CD C 13 51.792 0.30 . 1 . . . . 8 PRO CD . 26808 1 85 . 1 1 9 9 VAL H H 1 8.600 0.02 . 1 . . . . 9 VAL H . 26808 1 86 . 1 1 9 9 VAL HA H 1 3.747 0.02 . 1 . . . . 9 VAL HA . 26808 1 87 . 1 1 9 9 VAL HB H 1 1.852 0.02 . 1 . . . . 9 VAL HB . 26808 1 88 . 1 1 9 9 VAL HG11 H 1 0.628 0.02 . 2 . . . . 9 VAL HG11 . 26808 1 89 . 1 1 9 9 VAL HG12 H 1 0.628 0.02 . 2 . . . . 9 VAL HG11 . 26808 1 90 . 1 1 9 9 VAL HG13 H 1 0.628 0.02 . 2 . . . . 9 VAL HG11 . 26808 1 91 . 1 1 9 9 VAL HG21 H 1 0.573 0.02 . 2 . . . . 9 VAL HG21 . 26808 1 92 . 1 1 9 9 VAL HG22 H 1 0.573 0.02 . 2 . . . . 9 VAL HG21 . 26808 1 93 . 1 1 9 9 VAL HG23 H 1 0.573 0.02 . 2 . . . . 9 VAL HG21 . 26808 1 94 . 1 1 9 9 VAL C C 13 177.238 0.30 . 1 . . . . 9 VAL C . 26808 1 95 . 1 1 9 9 VAL CA C 13 64.600 0.30 . 1 . . . . 9 VAL CA . 26808 1 96 . 1 1 9 9 VAL CB C 13 30.643 0.30 . 1 . . . . 9 VAL CB . 26808 1 97 . 1 1 9 9 VAL CG1 C 13 20.600 0.30 . 2 . . . . 9 VAL CG1 . 26808 1 98 . 1 1 9 9 VAL CG2 C 13 22.336 0.30 . 2 . . . . 9 VAL CG2 . 26808 1 99 . 1 1 9 9 VAL N N 15 126.651 0.20 . 1 . . . . 9 VAL N . 26808 1 100 . 1 1 10 10 GLU H H 1 8.805 0.02 . 1 . . . . 10 GLU H . 26808 1 101 . 1 1 10 10 GLU HA H 1 4.032 0.02 . 1 . . . . 10 GLU HA . 26808 1 102 . 1 1 10 10 GLU HB2 H 1 2.063 0.02 . 2 . . . . 10 GLU HB2 . 26808 1 103 . 1 1 10 10 GLU HB3 H 1 2.063 0.02 . 2 . . . . 10 GLU HB3 . 26808 1 104 . 1 1 10 10 GLU HG2 H 1 2.374 0.02 . 2 . . . . 10 GLU HG2 . 26808 1 105 . 1 1 10 10 GLU HG3 H 1 2.374 0.02 . 2 . . . . 10 GLU HG3 . 26808 1 106 . 1 1 10 10 GLU C C 13 177.132 0.30 . 1 . . . . 10 GLU C . 26808 1 107 . 1 1 10 10 GLU CA C 13 59.412 0.30 . 1 . . . . 10 GLU CA . 26808 1 108 . 1 1 10 10 GLU CB C 13 29.377 0.30 . 1 . . . . 10 GLU CB . 26808 1 109 . 1 1 10 10 GLU CG C 13 36.051 0.30 . 1 . . . . 10 GLU CG . 26808 1 110 . 1 1 10 10 GLU N N 15 129.560 0.20 . 1 . . . . 10 GLU N . 26808 1 111 . 1 1 11 11 SER H H 1 7.988 0.02 . 1 . . . . 11 SER H . 26808 1 112 . 1 1 11 11 SER HA H 1 4.264 0.02 . 1 . . . . 11 SER HA . 26808 1 113 . 1 1 11 11 SER HB2 H 1 3.922 0.02 . 2 . . . . 11 SER HB2 . 26808 1 114 . 1 1 11 11 SER HB3 H 1 4.198 0.02 . 2 . . . . 11 SER HB3 . 26808 1 115 . 1 1 11 11 SER C C 13 172.825 0.30 . 1 . . . . 11 SER C . 26808 1 116 . 1 1 11 11 SER CA C 13 59.268 0.30 . 1 . . . . 11 SER CA . 26808 1 117 . 1 1 11 11 SER CB C 13 62.765 0.30 . 1 . . . . 11 SER CB . 26808 1 118 . 1 1 11 11 SER N N 15 112.284 0.20 . 1 . . . . 11 SER N . 26808 1 119 . 1 1 12 12 CYS H H 1 7.972 0.02 . 1 . . . . 12 CYS H . 26808 1 120 . 1 1 12 12 CYS HA H 1 4.612 0.02 . 1 . . . . 12 CYS HA . 26808 1 121 . 1 1 12 12 CYS HB2 H 1 3.351 0.02 . 2 . . . . 12 CYS HB2 . 26808 1 122 . 1 1 12 12 CYS HB3 H 1 2.688 0.02 . 2 . . . . 12 CYS HB3 . 26808 1 123 . 1 1 12 12 CYS C C 13 174.840 0.30 . 1 . . . . 12 CYS C . 26808 1 124 . 1 1 12 12 CYS CA C 13 59.978 0.30 . 1 . . . . 12 CYS CA . 26808 1 125 . 1 1 12 12 CYS CB C 13 30.800 0.30 . 1 . . . . 12 CYS CB . 26808 1 126 . 1 1 12 12 CYS N N 15 125.844 0.20 . 1 . . . . 12 CYS N . 26808 1 127 . 1 1 13 13 ASP H H 1 8.407 0.02 . 1 . . . . 13 ASP H . 26808 1 128 . 1 1 13 13 ASP HA H 1 4.823 0.02 . 1 . . . . 13 ASP HA . 26808 1 129 . 1 1 13 13 ASP HB2 H 1 2.768 0.02 . 2 . . . . 13 ASP HB2 . 26808 1 130 . 1 1 13 13 ASP HB3 H 1 2.768 0.02 . 2 . . . . 13 ASP HB3 . 26808 1 131 . 1 1 13 13 ASP C C 13 176.665 0.30 . 1 . . . . 13 ASP C . 26808 1 132 . 1 1 13 13 ASP CA C 13 53.744 0.30 . 1 . . . . 13 ASP CA . 26808 1 133 . 1 1 13 13 ASP CB C 13 41.113 0.30 . 1 . . . . 13 ASP CB . 26808 1 134 . 1 1 13 13 ASP N N 15 123.655 0.20 . 1 . . . . 13 ASP N . 26808 1 135 . 1 1 14 14 ARG H H 1 8.305 0.02 . 1 . . . . 14 ARG H . 26808 1 136 . 1 1 14 14 ARG HA H 1 4.029 0.02 . 1 . . . . 14 ARG HA . 26808 1 137 . 1 1 14 14 ARG HB2 H 1 1.124 0.02 . 2 . . . . 14 ARG HB2 . 26808 1 138 . 1 1 14 14 ARG HB3 H 1 1.620 0.02 . 2 . . . . 14 ARG HB3 . 26808 1 139 . 1 1 14 14 ARG HG2 H 1 1.668 0.02 . 2 . . . . 14 ARG HG2 . 26808 1 140 . 1 1 14 14 ARG HG3 H 1 1.613 0.02 . 2 . . . . 14 ARG HG3 . 26808 1 141 . 1 1 14 14 ARG HD2 H 1 3.168 0.02 . 2 . . . . 14 ARG HD2 . 26808 1 142 . 1 1 14 14 ARG HD3 H 1 3.116 0.02 . 2 . . . . 14 ARG HD3 . 26808 1 143 . 1 1 14 14 ARG HE H 1 7.411 0.02 . 1 . . . . 14 ARG HE . 26808 1 144 . 1 1 14 14 ARG C C 13 175.498 0.30 . 1 . . . . 14 ARG C . 26808 1 145 . 1 1 14 14 ARG CA C 13 57.446 0.30 . 1 . . . . 14 ARG CA . 26808 1 146 . 1 1 14 14 ARG CB C 13 31.115 0.30 . 1 . . . . 14 ARG CB . 26808 1 147 . 1 1 14 14 ARG CG C 13 28.100 0.30 . 1 . . . . 14 ARG CG . 26808 1 148 . 1 1 14 14 ARG CD C 13 43.445 0.30 . 1 . . . . 14 ARG CD . 26808 1 149 . 1 1 14 14 ARG N N 15 121.175 0.20 . 1 . . . . 14 ARG N . 26808 1 150 . 1 1 14 14 ARG NE N 15 85.338 0.20 . 1 . . . . 14 ARG NE . 26808 1 151 . 1 1 15 15 ARG H H 1 7.774 0.02 . 1 . . . . 15 ARG H . 26808 1 152 . 1 1 15 15 ARG HA H 1 5.041 0.02 . 1 . . . . 15 ARG HA . 26808 1 153 . 1 1 15 15 ARG HB2 H 1 1.417 0.02 . 2 . . . . 15 ARG HB2 . 26808 1 154 . 1 1 15 15 ARG HB3 H 1 1.778 0.02 . 2 . . . . 15 ARG HB3 . 26808 1 155 . 1 1 15 15 ARG HG2 H 1 1.593 0.02 . 2 . . . . 15 ARG HG2 . 26808 1 156 . 1 1 15 15 ARG HG3 H 1 1.432 0.02 . 2 . . . . 15 ARG HG3 . 26808 1 157 . 1 1 15 15 ARG HD2 H 1 3.281 0.02 . 2 . . . . 15 ARG HD2 . 26808 1 158 . 1 1 15 15 ARG HD3 H 1 3.153 0.02 . 2 . . . . 15 ARG HD3 . 26808 1 159 . 1 1 15 15 ARG HE H 1 7.051 0.02 . 1 . . . . 15 ARG HE . 26808 1 160 . 1 1 15 15 ARG C C 13 175.265 0.30 . 1 . . . . 15 ARG C . 26808 1 161 . 1 1 15 15 ARG CA C 13 54.245 0.30 . 1 . . . . 15 ARG CA . 26808 1 162 . 1 1 15 15 ARG CB C 13 33.756 0.30 . 1 . . . . 15 ARG CB . 26808 1 163 . 1 1 15 15 ARG CG C 13 27.783 0.30 . 1 . . . . 15 ARG CG . 26808 1 164 . 1 1 15 15 ARG CD C 13 43.445 0.30 . 1 . . . . 15 ARG CD . 26808 1 165 . 1 1 15 15 ARG N N 15 118.488 0.20 . 1 . . . . 15 ARG N . 26808 1 166 . 1 1 15 15 ARG NE N 15 84.433 0.20 . 1 . . . . 15 ARG NE . 26808 1 167 . 1 1 16 16 PHE H H 1 8.987 0.02 . 1 . . . . 16 PHE H . 26808 1 168 . 1 1 16 16 PHE HA H 1 5.098 0.02 . 1 . . . . 16 PHE HA . 26808 1 169 . 1 1 16 16 PHE HB2 H 1 3.710 0.02 . 2 . . . . 16 PHE HB2 . 26808 1 170 . 1 1 16 16 PHE HB3 H 1 2.744 0.02 . 2 . . . . 16 PHE HB3 . 26808 1 171 . 1 1 16 16 PHE C C 13 175.944 0.30 . 1 . . . . 16 PHE C . 26808 1 172 . 1 1 16 16 PHE CA C 13 57.495 0.30 . 1 . . . . 16 PHE CA . 26808 1 173 . 1 1 16 16 PHE CB C 13 43.820 0.30 . 1 . . . . 16 PHE CB . 26808 1 174 . 1 1 16 16 PHE N N 15 118.056 0.20 . 1 . . . . 16 PHE N . 26808 1 175 . 1 1 17 17 SER H H 1 8.950 0.02 . 1 . . . . 17 SER H . 26808 1 176 . 1 1 17 17 SER HA H 1 4.827 0.02 . 1 . . . . 17 SER HA . 26808 1 177 . 1 1 17 17 SER HB2 H 1 4.326 0.02 . 2 . . . . 17 SER HB2 . 26808 1 178 . 1 1 17 17 SER HB3 H 1 4.170 0.02 . 2 . . . . 17 SER HB3 . 26808 1 179 . 1 1 17 17 SER C C 13 174.321 0.30 . 1 . . . . 17 SER C . 26808 1 180 . 1 1 17 17 SER CA C 13 61.775 0.30 . 1 . . . . 17 SER CA . 26808 1 181 . 1 1 17 17 SER CB C 13 64.265 0.30 . 1 . . . . 17 SER CB . 26808 1 182 . 1 1 17 17 SER N N 15 117.290 0.20 . 1 . . . . 17 SER N . 26808 1 183 . 1 1 18 18 ARG H H 1 7.900 0.02 . 1 . . . . 18 ARG H . 26808 1 184 . 1 1 18 18 ARG HA H 1 4.957 0.02 . 1 . . . . 18 ARG HA . 26808 1 185 . 1 1 18 18 ARG HB2 H 1 2.166 0.02 . 2 . . . . 18 ARG HB2 . 26808 1 186 . 1 1 18 18 ARG HB3 H 1 1.585 0.02 . 2 . . . . 18 ARG HB3 . 26808 1 187 . 1 1 18 18 ARG HG2 H 1 1.708 0.02 . 2 . . . . 18 ARG HG2 . 26808 1 188 . 1 1 18 18 ARG HG3 H 1 1.649 0.02 . 2 . . . . 18 ARG HG3 . 26808 1 189 . 1 1 18 18 ARG HD2 H 1 3.244 0.02 . 2 . . . . 18 ARG HD2 . 26808 1 190 . 1 1 18 18 ARG HD3 H 1 3.206 0.02 . 2 . . . . 18 ARG HD3 . 26808 1 191 . 1 1 18 18 ARG HE H 1 8.082 0.02 . 1 . . . . 18 ARG HE . 26808 1 192 . 1 1 18 18 ARG C C 13 177.281 0.30 . 1 . . . . 18 ARG C . 26808 1 193 . 1 1 18 18 ARG CA C 13 54.418 0.30 . 1 . . . . 18 ARG CA . 26808 1 194 . 1 1 18 18 ARG CB C 13 35.806 0.30 . 1 . . . . 18 ARG CB . 26808 1 195 . 1 1 18 18 ARG CG C 13 26.563 0.30 . 1 . . . . 18 ARG CG . 26808 1 196 . 1 1 18 18 ARG CD C 13 43.633 0.30 . 1 . . . . 18 ARG CD . 26808 1 197 . 1 1 18 18 ARG N N 15 116.848 0.20 . 1 . . . . 18 ARG N . 26808 1 198 . 1 1 18 18 ARG NE N 15 79.527 0.20 . 1 . . . . 18 ARG NE . 26808 1 199 . 1 1 19 19 SER H H 1 8.569 0.02 . 1 . . . . 19 SER H . 26808 1 200 . 1 1 19 19 SER HA H 1 3.094 0.02 . 1 . . . . 19 SER HA . 26808 1 201 . 1 1 19 19 SER HB2 H 1 3.401 0.02 . 2 . . . . 19 SER HB2 . 26808 1 202 . 1 1 19 19 SER HB3 H 1 3.615 0.02 . 2 . . . . 19 SER HB3 . 26808 1 203 . 1 1 19 19 SER C C 13 176.538 0.30 . 1 . . . . 19 SER C . 26808 1 204 . 1 1 19 19 SER CA C 13 61.051 0.30 . 1 . . . . 19 SER CA . 26808 1 205 . 1 1 19 19 SER CB C 13 62.390 0.30 . 1 . . . . 19 SER CB . 26808 1 206 . 1 1 19 19 SER N N 15 119.000 0.20 . 1 . . . . 19 SER N . 26808 1 207 . 1 1 20 20 ASP H H 1 8.613 0.02 . 1 . . . . 20 ASP H . 26808 1 208 . 1 1 20 20 ASP HA H 1 3.885 0.02 . 1 . . . . 20 ASP HA . 26808 1 209 . 1 1 20 20 ASP HB2 H 1 2.859 0.02 . 2 . . . . 20 ASP HB2 . 26808 1 210 . 1 1 20 20 ASP HB3 H 1 2.517 0.02 . 2 . . . . 20 ASP HB3 . 26808 1 211 . 1 1 20 20 ASP C C 13 178.829 0.30 . 1 . . . . 20 ASP C . 26808 1 212 . 1 1 20 20 ASP CA C 13 57.884 0.30 . 1 . . . . 20 ASP CA . 26808 1 213 . 1 1 20 20 ASP CB C 13 39.881 0.30 . 1 . . . . 20 ASP CB . 26808 1 214 . 1 1 20 20 ASP N N 15 119.039 0.20 . 1 . . . . 20 ASP N . 26808 1 215 . 1 1 21 21 GLU H H 1 6.872 0.02 . 1 . . . . 21 GLU H . 26808 1 216 . 1 1 21 21 GLU HA H 1 4.101 0.02 . 1 . . . . 21 GLU HA . 26808 1 217 . 1 1 21 21 GLU C C 13 178.913 0.30 . 1 . . . . 21 GLU C . 26808 1 218 . 1 1 21 21 GLU CA C 13 56.394 0.30 . 1 . . . . 21 GLU CA . 26808 1 219 . 1 1 21 21 GLU CB C 13 30.783 0.30 . 1 . . . . 21 GLU CB . 26808 1 220 . 1 1 21 21 GLU CG C 13 39.881 0.30 . 1 . . . . 21 GLU CG . 26808 1 221 . 1 1 21 21 GLU N N 15 120.981 0.20 . 1 . . . . 21 GLU N . 26808 1 222 . 1 1 22 22 LEU H H 1 6.868 0.02 . 1 . . . . 22 LEU H . 26808 1 223 . 1 1 22 22 LEU HA H 1 3.494 0.02 . 1 . . . . 22 LEU HA . 26808 1 224 . 1 1 22 22 LEU HB2 H 1 1.300 0.02 . 2 . . . . 22 LEU HB2 . 26808 1 225 . 1 1 22 22 LEU HB3 H 1 2.128 0.02 . 2 . . . . 22 LEU HB3 . 26808 1 226 . 1 1 22 22 LEU HG H 1 1.677 0.02 . 1 . . . . 22 LEU HG . 26808 1 227 . 1 1 22 22 LEU HD11 H 1 0.969 0.02 . 2 . . . . 22 LEU HD11 . 26808 1 228 . 1 1 22 22 LEU HD12 H 1 0.969 0.02 . 2 . . . . 22 LEU HD11 . 26808 1 229 . 1 1 22 22 LEU HD13 H 1 0.969 0.02 . 2 . . . . 22 LEU HD11 . 26808 1 230 . 1 1 22 22 LEU HD21 H 1 1.208 0.02 . 2 . . . . 22 LEU HD21 . 26808 1 231 . 1 1 22 22 LEU HD22 H 1 1.208 0.02 . 2 . . . . 22 LEU HD21 . 26808 1 232 . 1 1 22 22 LEU HD23 H 1 1.208 0.02 . 2 . . . . 22 LEU HD21 . 26808 1 233 . 1 1 22 22 LEU C C 13 177.299 0.30 . 1 . . . . 22 LEU C . 26808 1 234 . 1 1 22 22 LEU CA C 13 57.997 0.30 . 1 . . . . 22 LEU CA . 26808 1 235 . 1 1 22 22 LEU CB C 13 40.069 0.30 . 1 . . . . 22 LEU CB . 26808 1 236 . 1 1 22 22 LEU CG C 13 26.376 0.30 . 1 . . . . 22 LEU CG . 26808 1 237 . 1 1 22 22 LEU CD1 C 13 23.222 0.30 . 2 . . . . 22 LEU CD1 . 26808 1 238 . 1 1 22 22 LEU CD2 C 13 23.104 0.30 . 2 . . . . 22 LEU CD2 . 26808 1 239 . 1 1 22 22 LEU N N 15 120.616 0.20 . 1 . . . . 22 LEU N . 26808 1 240 . 1 1 23 23 THR H H 1 8.281 0.02 . 1 . . . . 23 THR H . 26808 1 241 . 1 1 23 23 THR HA H 1 3.764 0.02 . 1 . . . . 23 THR HA . 26808 1 242 . 1 1 23 23 THR HB H 1 4.161 0.02 . 1 . . . . 23 THR HB . 26808 1 243 . 1 1 23 23 THR HG21 H 1 1.281 0.02 . 1 . . . . 23 THR HG21 . 26808 1 244 . 1 1 23 23 THR HG22 H 1 1.281 0.02 . 1 . . . . 23 THR HG21 . 26808 1 245 . 1 1 23 23 THR HG23 H 1 1.281 0.02 . 1 . . . . 23 THR HG21 . 26808 1 246 . 1 1 23 23 THR C C 13 175.965 0.30 . 1 . . . . 23 THR C . 26808 1 247 . 1 1 23 23 THR CA C 13 67.091 0.30 . 1 . . . . 23 THR CA . 26808 1 248 . 1 1 23 23 THR CB C 13 68.939 0.30 . 1 . . . . 23 THR CB . 26808 1 249 . 1 1 23 23 THR CG2 C 13 22.300 0.30 . 1 . . . . 23 THR CG2 . 26808 1 250 . 1 1 23 23 THR N N 15 115.922 0.20 . 1 . . . . 23 THR N . 26808 1 251 . 1 1 24 24 ARG H H 1 7.415 0.02 . 1 . . . . 24 ARG H . 26808 1 252 . 1 1 24 24 ARG HA H 1 3.947 0.02 . 1 . . . . 24 ARG HA . 26808 1 253 . 1 1 24 24 ARG HB2 H 1 1.903 0.02 . 2 . . . . 24 ARG HB2 . 26808 1 254 . 1 1 24 24 ARG HB3 H 1 1.992 0.02 . 2 . . . . 24 ARG HB3 . 26808 1 255 . 1 1 24 24 ARG HG2 H 1 1.703 0.02 . 2 . . . . 24 ARG HG2 . 26808 1 256 . 1 1 24 24 ARG HG3 H 1 1.823 0.02 . 2 . . . . 24 ARG HG3 . 26808 1 257 . 1 1 24 24 ARG HD2 H 1 2.910 0.02 . 2 . . . . 24 ARG HD2 . 26808 1 258 . 1 1 24 24 ARG HD3 H 1 3.018 0.02 . 2 . . . . 24 ARG HD3 . 26808 1 259 . 1 1 24 24 ARG HE H 1 6.560 0.02 . 1 . . . . 24 ARG HE . 26808 1 260 . 1 1 24 24 ARG C C 13 177.859 0.30 . 1 . . . . 24 ARG C . 26808 1 261 . 1 1 24 24 ARG CA C 13 59.884 0.30 . 1 . . . . 24 ARG CA . 26808 1 262 . 1 1 24 24 ARG CB C 13 31.492 0.30 . 1 . . . . 24 ARG CB . 26808 1 263 . 1 1 24 24 ARG CG C 13 25.760 0.30 . 1 . . . . 24 ARG CG . 26808 1 264 . 1 1 24 24 ARG CD C 13 43.539 0.30 . 1 . . . . 24 ARG CD . 26808 1 265 . 1 1 24 24 ARG N N 15 119.585 0.20 . 1 . . . . 24 ARG N . 26808 1 266 . 1 1 24 24 ARG NE N 15 79.802 0.20 . 1 . . . . 24 ARG NE . 26808 1 267 . 1 1 25 25 HIS H H 1 7.561 0.02 . 1 . . . . 25 HIS H . 26808 1 268 . 1 1 25 25 HIS HA H 1 4.257 0.02 . 1 . . . . 25 HIS HA . 26808 1 269 . 1 1 25 25 HIS HB2 H 1 3.011 0.02 . 2 . . . . 25 HIS HB2 . 26808 1 270 . 1 1 25 25 HIS HB3 H 1 3.253 0.02 . 2 . . . . 25 HIS HB3 . 26808 1 271 . 1 1 25 25 HIS C C 13 177.841 0.30 . 1 . . . . 25 HIS C . 26808 1 272 . 1 1 25 25 HIS CA C 13 59.930 0.30 . 1 . . . . 25 HIS CA . 26808 1 273 . 1 1 25 25 HIS CB C 13 29.605 0.30 . 1 . . . . 25 HIS CB . 26808 1 274 . 1 1 25 25 HIS N N 15 118.885 0.20 . 1 . . . . 25 HIS N . 26808 1 275 . 1 1 26 26 ILE H H 1 8.599 0.02 . 1 . . . . 26 ILE H . 26808 1 276 . 1 1 26 26 ILE HA H 1 3.710 0.02 . 1 . . . . 26 ILE HA . 26808 1 277 . 1 1 26 26 ILE HB H 1 2.047 0.02 . 1 . . . . 26 ILE HB . 26808 1 278 . 1 1 26 26 ILE HG12 H 1 1.512 0.02 . 2 . . . . 26 ILE HG12 . 26808 1 279 . 1 1 26 26 ILE HG13 H 1 2.155 0.02 . 2 . . . . 26 ILE HG13 . 26808 1 280 . 1 1 26 26 ILE C C 13 177.110 0.30 . 1 . . . . 26 ILE C . 26808 1 281 . 1 1 26 26 ILE CA C 13 65.825 0.30 . 1 . . . . 26 ILE CA . 26808 1 282 . 1 1 26 26 ILE CB C 13 38.474 0.30 . 1 . . . . 26 ILE CB . 26808 1 283 . 1 1 26 26 ILE CG1 C 13 30.690 0.30 . 1 . . . . 26 ILE CG1 . 26808 1 284 . 1 1 26 26 ILE CG2 C 13 18.216 0.30 . 1 . . . . 26 ILE CG2 . 26808 1 285 . 1 1 26 26 ILE CD1 C 13 14.184 0.30 . 1 . . . . 26 ILE CD1 . 26808 1 286 . 1 1 26 26 ILE N N 15 117.452 0.20 . 1 . . . . 26 ILE N . 26808 1 287 . 1 1 27 27 ARG H H 1 7.170 0.02 . 1 . . . . 27 ARG H . 26808 1 288 . 1 1 27 27 ARG HA H 1 4.536 0.02 . 1 . . . . 27 ARG HA . 26808 1 289 . 1 1 27 27 ARG HB2 H 1 2.312 0.02 . 2 . . . . 27 ARG HB2 . 26808 1 290 . 1 1 27 27 ARG HB3 H 1 1.880 0.02 . 2 . . . . 27 ARG HB3 . 26808 1 291 . 1 1 27 27 ARG HG2 H 1 2.124 0.02 . 2 . . . . 27 ARG HG2 . 26808 1 292 . 1 1 27 27 ARG HG3 H 1 2.124 0.02 . 2 . . . . 27 ARG HG3 . 26808 1 293 . 1 1 27 27 ARG HD2 H 1 3.379 0.02 . 2 . . . . 27 ARG HD2 . 26808 1 294 . 1 1 27 27 ARG HD3 H 1 3.379 0.02 . 2 . . . . 27 ARG HD3 . 26808 1 295 . 1 1 27 27 ARG HE H 1 7.323 0.02 . 1 . . . . 27 ARG HE . 26808 1 296 . 1 1 27 27 ARG C C 13 179.529 0.30 . 1 . . . . 27 ARG C . 26808 1 297 . 1 1 27 27 ARG CA C 13 59.492 0.30 . 1 . . . . 27 ARG CA . 26808 1 298 . 1 1 27 27 ARG CB C 13 29.268 0.30 . 1 . . . . 27 ARG CB . 26808 1 299 . 1 1 27 27 ARG CG C 13 30.139 0.30 . 1 . . . . 27 ARG CG . 26808 1 300 . 1 1 27 27 ARG CD C 13 44.912 0.30 . 1 . . . . 27 ARG CD . 26808 1 301 . 1 1 27 27 ARG N N 15 117.392 0.20 . 1 . . . . 27 ARG N . 26808 1 302 . 1 1 27 27 ARG NE N 15 85.652 0.20 . 1 . . . . 27 ARG NE . 26808 1 303 . 1 1 28 28 ILE H H 1 8.401 0.02 . 1 . . . . 28 ILE H . 26808 1 304 . 1 1 28 28 ILE HA H 1 3.971 0.02 . 1 . . . . 28 ILE HA . 26808 1 305 . 1 1 28 28 ILE HB H 1 1.525 0.02 . 1 . . . . 28 ILE HB . 26808 1 306 . 1 1 28 28 ILE HG12 H 1 1.025 0.02 . 2 . . . . 28 ILE HG12 . 26808 1 307 . 1 1 28 28 ILE HG13 H 1 1.120 0.02 . 2 . . . . 28 ILE HG13 . 26808 1 308 . 1 1 28 28 ILE C C 13 178.192 0.30 . 1 . . . . 28 ILE C . 26808 1 309 . 1 1 28 28 ILE CA C 13 64.694 0.30 . 1 . . . . 28 ILE CA . 26808 1 310 . 1 1 28 28 ILE CB C 13 38.283 0.30 . 1 . . . . 28 ILE CB . 26808 1 311 . 1 1 28 28 ILE CG1 C 13 26.470 0.30 . 1 . . . . 28 ILE CG1 . 26808 1 312 . 1 1 28 28 ILE CG2 C 13 16.228 0.30 . 1 . . . . 28 ILE CG2 . 26808 1 313 . 1 1 28 28 ILE CD1 C 13 15.100 0.30 . 1 . . . . 28 ILE CD1 . 26808 1 314 . 1 1 28 28 ILE N N 15 119.782 0.20 . 1 . . . . 28 ILE N . 26808 1 315 . 1 1 29 29 HIS H H 1 7.424 0.02 . 1 . . . . 29 HIS H . 26808 1 316 . 1 1 29 29 HIS HA H 1 4.719 0.02 . 1 . . . . 29 HIS HA . 26808 1 317 . 1 1 29 29 HIS HB2 H 1 3.374 0.02 . 2 . . . . 29 HIS HB2 . 26808 1 318 . 1 1 29 29 HIS HB3 H 1 3.302 0.02 . 2 . . . . 29 HIS HB3 . 26808 1 319 . 1 1 29 29 HIS C C 13 177.386 0.30 . 1 . . . . 29 HIS C . 26808 1 320 . 1 1 29 29 HIS CA C 13 56.481 0.30 . 1 . . . . 29 HIS CA . 26808 1 321 . 1 1 29 29 HIS CB C 13 29.096 0.30 . 1 . . . . 29 HIS CB . 26808 1 322 . 1 1 29 29 HIS N N 15 116.890 0.20 . 1 . . . . 29 HIS N . 26808 1 323 . 1 1 30 30 THR H H 1 8.191 0.02 . 1 . . . . 30 THR H . 26808 1 324 . 1 1 30 30 THR HA H 1 4.316 0.02 . 1 . . . . 30 THR HA . 26808 1 325 . 1 1 30 30 THR HB H 1 4.437 0.02 . 1 . . . . 30 THR HB . 26808 1 326 . 1 1 30 30 THR HG21 H 1 1.320 0.02 . 1 . . . . 30 THR HG21 . 26808 1 327 . 1 1 30 30 THR HG22 H 1 1.320 0.02 . 1 . . . . 30 THR HG21 . 26808 1 328 . 1 1 30 30 THR HG23 H 1 1.320 0.02 . 1 . . . . 30 THR HG21 . 26808 1 329 . 1 1 30 30 THR C C 13 177.029 0.30 . 1 . . . . 30 THR C . 26808 1 330 . 1 1 30 30 THR CA C 13 62.296 0.30 . 1 . . . . 30 THR CA . 26808 1 331 . 1 1 30 30 THR CB C 13 70.455 0.30 . 1 . . . . 30 THR CB . 26808 1 332 . 1 1 30 30 THR CG2 C 13 21.780 0.30 . 1 . . . . 30 THR CG2 . 26808 1 333 . 1 1 30 30 THR N N 15 107.519 0.20 . 1 . . . . 30 THR N . 26808 1 334 . 1 1 31 31 GLY H H 1 8.061 0.02 . 1 . . . . 31 GLY H . 26808 1 335 . 1 1 31 31 GLY HA2 H 1 3.863 0.02 . 2 . . . . 31 GLY HA2 . 26808 1 336 . 1 1 31 31 GLY HA3 H 1 4.156 0.02 . 2 . . . . 31 GLY HA3 . 26808 1 337 . 1 1 31 31 GLY C C 13 174.247 0.30 . 1 . . . . 31 GLY C . 26808 1 338 . 1 1 31 31 GLY CA C 13 45.790 0.30 . 1 . . . . 31 GLY CA . 26808 1 339 . 1 1 31 31 GLY N N 15 110.398 0.20 . 1 . . . . 31 GLY N . 26808 1 340 . 1 1 32 32 GLN H H 1 7.506 0.02 . 1 . . . . 32 GLN H . 26808 1 341 . 1 1 32 32 GLN HA H 1 3.957 0.02 . 1 . . . . 32 GLN HA . 26808 1 342 . 1 1 32 32 GLN HB2 H 1 1.889 0.02 . 2 . . . . 32 GLN HB2 . 26808 1 343 . 1 1 32 32 GLN HB3 H 1 1.889 0.02 . 2 . . . . 32 GLN HB3 . 26808 1 344 . 1 1 32 32 GLN HG2 H 1 2.404 0.02 . 2 . . . . 32 GLN HG2 . 26808 1 345 . 1 1 32 32 GLN HG3 H 1 2.145 0.02 . 2 . . . . 32 GLN HG3 . 26808 1 346 . 1 1 32 32 GLN HE21 H 1 6.946 0.02 . 2 . . . . 32 GLN HE21 . 26808 1 347 . 1 1 32 32 GLN HE22 H 1 7.585 0.02 . 2 . . . . 32 GLN HE22 . 26808 1 348 . 1 1 32 32 GLN C C 13 175.986 0.30 . 1 . . . . 32 GLN C . 26808 1 349 . 1 1 32 32 GLN CA C 13 57.446 0.30 . 1 . . . . 32 GLN CA . 26808 1 350 . 1 1 32 32 GLN CB C 13 29.322 0.30 . 1 . . . . 32 GLN CB . 26808 1 351 . 1 1 32 32 GLN CG C 13 33.879 0.30 . 1 . . . . 32 GLN CG . 26808 1 352 . 1 1 32 32 GLN N N 15 119.528 0.20 . 1 . . . . 32 GLN N . 26808 1 353 . 1 1 32 32 GLN NE2 N 15 112.573 0.20 . 1 . . . . 32 GLN NE2 . 26808 1 354 . 1 1 33 33 LYS H H 1 8.451 0.02 . 1 . . . . 33 LYS H . 26808 1 355 . 1 1 33 33 LYS HA H 1 4.538 0.02 . 1 . . . . 33 LYS HA . 26808 1 356 . 1 1 33 33 LYS HB2 H 1 1.586 0.02 . 2 . . . . 33 LYS HB2 . 26808 1 357 . 1 1 33 33 LYS HB3 H 1 1.586 0.02 . 2 . . . . 33 LYS HB3 . 26808 1 358 . 1 1 33 33 LYS HG2 H 1 0.925 0.02 . 2 . . . . 33 LYS HG2 . 26808 1 359 . 1 1 33 33 LYS HG3 H 1 0.925 0.02 . 2 . . . . 33 LYS HG3 . 26808 1 360 . 1 1 33 33 LYS HD2 H 1 1.492 0.02 . 2 . . . . 33 LYS HD2 . 26808 1 361 . 1 1 33 33 LYS HD3 H 1 1.492 0.02 . 2 . . . . 33 LYS HD3 . 26808 1 362 . 1 1 33 33 LYS HE2 H 1 2.977 0.02 . 2 . . . . 33 LYS HE2 . 26808 1 363 . 1 1 33 33 LYS HE3 H 1 3.034 0.02 . 2 . . . . 33 LYS HE3 . 26808 1 364 . 1 1 33 33 LYS C C 13 173.852 0.30 . 1 . . . . 33 LYS C . 26808 1 365 . 1 1 33 33 LYS CA C 13 53.890 0.30 . 1 . . . . 33 LYS CA . 26808 1 366 . 1 1 33 33 LYS CB C 13 35.340 0.30 . 1 . . . . 33 LYS CB . 26808 1 367 . 1 1 33 33 LYS CG C 13 25.299 0.30 . 1 . . . . 33 LYS CG . 26808 1 368 . 1 1 33 33 LYS CD C 13 29.656 0.30 . 1 . . . . 33 LYS CD . 26808 1 369 . 1 1 33 33 LYS CE C 13 42.577 0.30 . 1 . . . . 33 LYS CE . 26808 1 370 . 1 1 33 33 LYS N N 15 125.191 0.20 . 1 . . . . 33 LYS N . 26808 1 371 . 1 1 33 33 LYS NZ N 15 32.922 0.20 . 1 . . . . 33 LYS NZ . 26808 1 372 . 1 1 34 34 PRO HA H 1 4.228 0.02 . 1 . . . . 34 PRO HA . 26808 1 373 . 1 1 34 34 PRO HB2 H 1 1.989 0.02 . 2 . . . . 34 PRO HB2 . 26808 1 374 . 1 1 34 34 PRO HB3 H 1 0.886 0.02 . 2 . . . . 34 PRO HB3 . 26808 1 375 . 1 1 34 34 PRO HG2 H 1 1.379 0.02 . 2 . . . . 34 PRO HG2 . 26808 1 376 . 1 1 34 34 PRO HG3 H 1 1.575 0.02 . 2 . . . . 34 PRO HG3 . 26808 1 377 . 1 1 34 34 PRO HD2 H 1 3.747 0.02 . 2 . . . . 34 PRO HD2 . 26808 1 378 . 1 1 34 34 PRO HD3 H 1 3.469 0.02 . 2 . . . . 34 PRO HD3 . 26808 1 379 . 1 1 34 34 PRO C C 13 175.910 0.30 . 1 . . . . 34 PRO C . 26808 1 380 . 1 1 34 34 PRO CA C 13 63.703 0.30 . 1 . . . . 34 PRO CA . 26808 1 381 . 1 1 34 34 PRO CB C 13 32.284 0.30 . 1 . . . . 34 PRO CB . 26808 1 382 . 1 1 34 34 PRO CG C 13 26.282 0.30 . 1 . . . . 34 PRO CG . 26808 1 383 . 1 1 34 34 PRO CD C 13 49.981 0.30 . 1 . . . . 34 PRO CD . 26808 1 384 . 1 1 35 35 PHE H H 1 7.821 0.02 . 1 . . . . 35 PHE H . 26808 1 385 . 1 1 35 35 PHE HA H 1 4.782 0.02 . 1 . . . . 35 PHE HA . 26808 1 386 . 1 1 35 35 PHE HB2 H 1 3.199 0.02 . 2 . . . . 35 PHE HB2 . 26808 1 387 . 1 1 35 35 PHE HB3 H 1 2.836 0.02 . 2 . . . . 35 PHE HB3 . 26808 1 388 . 1 1 35 35 PHE C C 13 174.247 0.30 . 1 . . . . 35 PHE C . 26808 1 389 . 1 1 35 35 PHE CA C 13 57.513 0.30 . 1 . . . . 35 PHE CA . 26808 1 390 . 1 1 35 35 PHE CB C 13 39.881 0.30 . 1 . . . . 35 PHE CB . 26808 1 391 . 1 1 35 35 PHE N N 15 117.154 0.20 . 1 . . . . 35 PHE N . 26808 1 392 . 1 1 36 36 GLN H H 1 8.950 0.02 . 1 . . . . 36 GLN H . 26808 1 393 . 1 1 36 36 GLN HA H 1 5.215 0.02 . 1 . . . . 36 GLN HA . 26808 1 394 . 1 1 36 36 GLN HB2 H 1 2.097 0.02 . 2 . . . . 36 GLN HB2 . 26808 1 395 . 1 1 36 36 GLN HB3 H 1 1.943 0.02 . 2 . . . . 36 GLN HB3 . 26808 1 396 . 1 1 36 36 GLN HG2 H 1 2.091 0.02 . 2 . . . . 36 GLN HG2 . 26808 1 397 . 1 1 36 36 GLN HG3 H 1 1.933 0.02 . 2 . . . . 36 GLN HG3 . 26808 1 398 . 1 1 36 36 GLN HE21 H 1 6.812 0.02 . 2 . . . . 36 GLN HE21 . 26808 1 399 . 1 1 36 36 GLN HE22 H 1 7.689 0.02 . 2 . . . . 36 GLN HE22 . 26808 1 400 . 1 1 36 36 GLN C C 13 174.777 0.30 . 1 . . . . 36 GLN C . 26808 1 401 . 1 1 36 36 GLN CA C 13 55.254 0.30 . 1 . . . . 36 GLN CA . 26808 1 402 . 1 1 36 36 GLN CB C 13 33.284 0.30 . 1 . . . . 36 GLN CB . 26808 1 403 . 1 1 36 36 GLN CG C 13 34.712 0.30 . 1 . . . . 36 GLN CG . 26808 1 404 . 1 1 36 36 GLN N N 15 125.531 0.20 . 1 . . . . 36 GLN N . 26808 1 405 . 1 1 36 36 GLN NE2 N 15 112.673 0.20 . 1 . . . . 36 GLN NE2 . 26808 1 406 . 1 1 37 37 CYS H H 1 9.249 0.02 . 1 . . . . 37 CYS H . 26808 1 407 . 1 1 37 37 CYS HA H 1 4.629 0.02 . 1 . . . . 37 CYS HA . 26808 1 408 . 1 1 37 37 CYS HB2 H 1 3.544 0.02 . 2 . . . . 37 CYS HB2 . 26808 1 409 . 1 1 37 37 CYS HB3 H 1 3.037 0.02 . 2 . . . . 37 CYS HB3 . 26808 1 410 . 1 1 37 37 CYS C C 13 176.898 0.30 . 1 . . . . 37 CYS C . 26808 1 411 . 1 1 37 37 CYS CA C 13 59.881 0.30 . 1 . . . . 37 CYS CA . 26808 1 412 . 1 1 37 37 CYS CB C 13 29.794 0.30 . 1 . . . . 37 CYS CB . 26808 1 413 . 1 1 37 37 CYS N N 15 128.849 0.20 . 1 . . . . 37 CYS N . 26808 1 414 . 1 1 38 38 ARG H H 1 9.043 0.02 . 1 . . . . 38 ARG H . 26808 1 415 . 1 1 38 38 ARG HA H 1 4.377 0.02 . 1 . . . . 38 ARG HA . 26808 1 416 . 1 1 38 38 ARG HB2 H 1 2.061 0.02 . 2 . . . . 38 ARG HB2 . 26808 1 417 . 1 1 38 38 ARG HB3 H 1 1.966 0.02 . 2 . . . . 38 ARG HB3 . 26808 1 418 . 1 1 38 38 ARG HG2 H 1 1.817 0.02 . 2 . . . . 38 ARG HG2 . 26808 1 419 . 1 1 38 38 ARG HG3 H 1 1.817 0.02 . 2 . . . . 38 ARG HG3 . 26808 1 420 . 1 1 38 38 ARG HD2 H 1 3.304 0.02 . 2 . . . . 38 ARG HD2 . 26808 1 421 . 1 1 38 38 ARG HD3 H 1 3.304 0.02 . 2 . . . . 38 ARG HD3 . 26808 1 422 . 1 1 38 38 ARG HE H 1 7.306 0.02 . 1 . . . . 38 ARG HE . 26808 1 423 . 1 1 38 38 ARG C C 13 175.689 0.30 . 1 . . . . 38 ARG C . 26808 1 424 . 1 1 38 38 ARG CA C 13 57.592 0.30 . 1 . . . . 38 ARG CA . 26808 1 425 . 1 1 38 38 ARG CB C 13 29.377 0.30 . 1 . . . . 38 ARG CB . 26808 1 426 . 1 1 38 38 ARG CG C 13 27.314 0.30 . 1 . . . . 38 ARG CG . 26808 1 427 . 1 1 38 38 ARG CD C 13 43.278 0.30 . 1 . . . . 38 ARG CD . 26808 1 428 . 1 1 38 38 ARG N N 15 130.053 0.20 . 1 . . . . 38 ARG N . 26808 1 429 . 1 1 38 38 ARG NE N 15 84.826 0.20 . 1 . . . . 38 ARG NE . 26808 1 430 . 1 1 39 39 ILE H H 1 8.887 0.02 . 1 . . . . 39 ILE H . 26808 1 431 . 1 1 39 39 ILE HA H 1 3.935 0.02 . 1 . . . . 39 ILE HA . 26808 1 432 . 1 1 39 39 ILE HB H 1 1.310 0.02 . 1 . . . . 39 ILE HB . 26808 1 433 . 1 1 39 39 ILE HG12 H 1 1.075 0.02 . 2 . . . . 39 ILE HG12 . 26808 1 434 . 1 1 39 39 ILE HG13 H 1 1.506 0.02 . 2 . . . . 39 ILE HG13 . 26808 1 435 . 1 1 39 39 ILE C C 13 176.750 0.30 . 1 . . . . 39 ILE C . 26808 1 436 . 1 1 39 39 ILE CA C 13 64.078 0.30 . 1 . . . . 39 ILE CA . 26808 1 437 . 1 1 39 39 ILE CB C 13 38.641 0.30 . 1 . . . . 39 ILE CB . 26808 1 438 . 1 1 39 39 ILE CG1 C 13 28.345 0.30 . 1 . . . . 39 ILE CG1 . 26808 1 439 . 1 1 39 39 ILE CG2 C 13 15.960 0.30 . 1 . . . . 39 ILE CG2 . 26808 1 440 . 1 1 39 39 ILE CD1 C 13 13.281 0.30 . 1 . . . . 39 ILE CD1 . 26808 1 441 . 1 1 39 39 ILE N N 15 121.953 0.20 . 1 . . . . 39 ILE N . 26808 1 442 . 1 1 40 40 CYS H H 1 8.422 0.02 . 1 . . . . 40 CYS H . 26808 1 443 . 1 1 40 40 CYS HA H 1 5.125 0.02 . 1 . . . . 40 CYS HA . 26808 1 444 . 1 1 40 40 CYS HB2 H 1 3.539 0.02 . 2 . . . . 40 CYS HB2 . 26808 1 445 . 1 1 40 40 CYS HB3 H 1 2.818 0.02 . 2 . . . . 40 CYS HB3 . 26808 1 446 . 1 1 40 40 CYS C C 13 175.774 0.30 . 1 . . . . 40 CYS C . 26808 1 447 . 1 1 40 40 CYS CA C 13 58.469 0.30 . 1 . . . . 40 CYS CA . 26808 1 448 . 1 1 40 40 CYS CB C 13 32.058 0.30 . 1 . . . . 40 CYS CB . 26808 1 449 . 1 1 40 40 CYS N N 15 117.725 0.20 . 1 . . . . 40 CYS N . 26808 1 450 . 1 1 41 41 MET H H 1 8.066 0.02 . 1 . . . . 41 MET H . 26808 1 451 . 1 1 41 41 MET HA H 1 4.456 0.02 . 1 . . . . 41 MET HA . 26808 1 452 . 1 1 41 41 MET HB2 H 1 2.532 0.02 . 2 . . . . 41 MET HB2 . 26808 1 453 . 1 1 41 41 MET HB3 H 1 2.246 0.02 . 2 . . . . 41 MET HB3 . 26808 1 454 . 1 1 41 41 MET HG2 H 1 2.625 0.02 . 2 . . . . 41 MET HG2 . 26808 1 455 . 1 1 41 41 MET HG3 H 1 2.330 0.02 . 2 . . . . 41 MET HG3 . 26808 1 456 . 1 1 41 41 MET C C 13 175.095 0.30 . 1 . . . . 41 MET C . 26808 1 457 . 1 1 41 41 MET CA C 13 57.714 0.30 . 1 . . . . 41 MET CA . 26808 1 458 . 1 1 41 41 MET CB C 13 28.533 0.30 . 1 . . . . 41 MET CB . 26808 1 459 . 1 1 41 41 MET CG C 13 32.753 0.30 . 1 . . . . 41 MET CG . 26808 1 460 . 1 1 41 41 MET N N 15 117.476 0.20 . 1 . . . . 41 MET N . 26808 1 461 . 1 1 42 42 ARG H H 1 8.208 0.02 . 1 . . . . 42 ARG H . 26808 1 462 . 1 1 42 42 ARG HA H 1 4.200 0.02 . 1 . . . . 42 ARG HA . 26808 1 463 . 1 1 42 42 ARG HB2 H 1 1.837 0.02 . 2 . . . . 42 ARG HB2 . 26808 1 464 . 1 1 42 42 ARG HB3 H 1 1.444 0.02 . 2 . . . . 42 ARG HB3 . 26808 1 465 . 1 1 42 42 ARG HG2 H 1 1.631 0.02 . 2 . . . . 42 ARG HG2 . 26808 1 466 . 1 1 42 42 ARG HG3 H 1 1.096 0.02 . 2 . . . . 42 ARG HG3 . 26808 1 467 . 1 1 42 42 ARG HD2 H 1 2.881 0.02 . 2 . . . . 42 ARG HD2 . 26808 1 468 . 1 1 42 42 ARG HD3 H 1 3.214 0.02 . 2 . . . . 42 ARG HD3 . 26808 1 469 . 1 1 42 42 ARG HE H 1 7.422 0.02 . 1 . . . . 42 ARG HE . 26808 1 470 . 1 1 42 42 ARG C C 13 173.907 0.30 . 1 . . . . 42 ARG C . 26808 1 471 . 1 1 42 42 ARG CA C 13 57.884 0.30 . 1 . . . . 42 ARG CA . 26808 1 472 . 1 1 42 42 ARG CB C 13 32.284 0.30 . 1 . . . . 42 ARG CB . 26808 1 473 . 1 1 42 42 ARG CG C 13 28.064 0.30 . 1 . . . . 42 ARG CG . 26808 1 474 . 1 1 42 42 ARG CD C 13 44.477 0.30 . 1 . . . . 42 ARG CD . 26808 1 475 . 1 1 42 42 ARG N N 15 122.708 0.20 . 1 . . . . 42 ARG N . 26808 1 476 . 1 1 42 42 ARG NE N 15 86.059 0.20 . 1 . . . . 42 ARG NE . 26808 1 477 . 1 1 43 43 ASN H H 1 8.007 0.02 . 1 . . . . 43 ASN H . 26808 1 478 . 1 1 43 43 ASN HA H 1 5.575 0.02 . 1 . . . . 43 ASN HA . 26808 1 479 . 1 1 43 43 ASN HB2 H 1 2.916 0.02 . 2 . . . . 43 ASN HB2 . 26808 1 480 . 1 1 43 43 ASN HB3 H 1 2.448 0.02 . 2 . . . . 43 ASN HB3 . 26808 1 481 . 1 1 43 43 ASN HD21 H 1 6.742 0.02 . 2 . . . . 43 ASN HD21 . 26808 1 482 . 1 1 43 43 ASN HD22 H 1 7.219 0.02 . 2 . . . . 43 ASN HD22 . 26808 1 483 . 1 1 43 43 ASN C C 13 174.105 0.30 . 1 . . . . 43 ASN C . 26808 1 484 . 1 1 43 43 ASN CA C 13 52.672 0.30 . 1 . . . . 43 ASN CA . 26808 1 485 . 1 1 43 43 ASN CB C 13 41.207 0.30 . 1 . . . . 43 ASN CB . 26808 1 486 . 1 1 43 43 ASN N N 15 121.328 0.20 . 1 . . . . 43 ASN N . 26808 1 487 . 1 1 43 43 ASN ND2 N 15 111.991 0.20 . 1 . . . . 43 ASN ND2 . 26808 1 488 . 1 1 44 44 PHE H H 1 9.327 0.02 . 1 . . . . 44 PHE H . 26808 1 489 . 1 1 44 44 PHE HA H 1 4.827 0.02 . 1 . . . . 44 PHE HA . 26808 1 490 . 1 1 44 44 PHE HB2 H 1 2.796 0.02 . 2 . . . . 44 PHE HB2 . 26808 1 491 . 1 1 44 44 PHE HB3 H 1 3.527 0.02 . 2 . . . . 44 PHE HB3 . 26808 1 492 . 1 1 44 44 PHE C C 13 175.837 0.30 . 1 . . . . 44 PHE C . 26808 1 493 . 1 1 44 44 PHE CA C 13 57.620 0.30 . 1 . . . . 44 PHE CA . 26808 1 494 . 1 1 44 44 PHE CB C 13 43.188 0.30 . 1 . . . . 44 PHE CB . 26808 1 495 . 1 1 44 44 PHE N N 15 117.869 0.20 . 1 . . . . 44 PHE N . 26808 1 496 . 1 1 45 45 SER H H 1 9.785 0.02 . 1 . . . . 45 SER H . 26808 1 497 . 1 1 45 45 SER HA H 1 4.598 0.02 . 1 . . . . 45 SER HA . 26808 1 498 . 1 1 45 45 SER HB2 H 1 4.226 0.02 . 2 . . . . 45 SER HB2 . 26808 1 499 . 1 1 45 45 SER HB3 H 1 4.226 0.02 . 2 . . . . 45 SER HB3 . 26808 1 500 . 1 1 45 45 SER C C 13 174.777 0.30 . 1 . . . . 45 SER C . 26808 1 501 . 1 1 45 45 SER CA C 13 60.710 0.30 . 1 . . . . 45 SER CA . 26808 1 502 . 1 1 45 45 SER CB C 13 64.411 0.30 . 1 . . . . 45 SER CB . 26808 1 503 . 1 1 45 45 SER N N 15 116.953 0.20 . 1 . . . . 45 SER N . 26808 1 504 . 1 1 46 46 ARG H H 1 7.738 0.02 . 1 . . . . 46 ARG H . 26808 1 505 . 1 1 46 46 ARG HA H 1 4.795 0.02 . 1 . . . . 46 ARG HA . 26808 1 506 . 1 1 46 46 ARG HB2 H 1 1.516 0.02 . 2 . . . . 46 ARG HB2 . 26808 1 507 . 1 1 46 46 ARG HB3 H 1 2.244 0.02 . 2 . . . . 46 ARG HB3 . 26808 1 508 . 1 1 46 46 ARG HG2 H 1 1.872 0.02 . 2 . . . . 46 ARG HG2 . 26808 1 509 . 1 1 46 46 ARG HG3 H 1 1.872 0.02 . 2 . . . . 46 ARG HG3 . 26808 1 510 . 1 1 46 46 ARG HD2 H 1 2.875 0.02 . 2 . . . . 46 ARG HD2 . 26808 1 511 . 1 1 46 46 ARG HD3 H 1 3.297 0.02 . 2 . . . . 46 ARG HD3 . 26808 1 512 . 1 1 46 46 ARG HE H 1 6.736 0.02 . 1 . . . . 46 ARG HE . 26808 1 513 . 1 1 46 46 ARG C C 13 176.126 0.30 . 1 . . . . 46 ARG C . 26808 1 514 . 1 1 46 46 ARG CA C 13 55.356 0.30 . 1 . . . . 46 ARG CA . 26808 1 515 . 1 1 46 46 ARG CB C 13 36.448 0.30 . 1 . . . . 46 ARG CB . 26808 1 516 . 1 1 46 46 ARG CG C 13 26.934 0.30 . 1 . . . . 46 ARG CG . 26808 1 517 . 1 1 46 46 ARG CD C 13 44.263 0.30 . 1 . . . . 46 ARG CD . 26808 1 518 . 1 1 46 46 ARG N N 15 119.238 0.20 . 1 . . . . 46 ARG N . 26808 1 519 . 1 1 46 46 ARG NE N 15 77.284 0.20 . 1 . . . . 46 ARG NE . 26808 1 520 . 1 1 47 47 SER H H 1 7.966 0.02 . 1 . . . . 47 SER H . 26808 1 521 . 1 1 47 47 SER HA H 1 3.455 0.02 . 1 . . . . 47 SER HA . 26808 1 522 . 1 1 47 47 SER HB2 H 1 3.182 0.02 . 2 . . . . 47 SER HB2 . 26808 1 523 . 1 1 47 47 SER HB3 H 1 2.999 0.02 . 2 . . . . 47 SER HB3 . 26808 1 524 . 1 1 47 47 SER CA C 13 60.515 0.30 . 1 . . . . 47 SER CA . 26808 1 525 . 1 1 47 47 SER CB C 13 64.223 0.30 . 1 . . . . 47 SER CB . 26808 1 526 . 1 1 47 47 SER N N 15 118.591 0.20 . 1 . . . . 47 SER N . 26808 1 527 . 1 1 48 48 ASP H H 1 8.655 0.02 . 1 . . . . 48 ASP H . 26808 1 528 . 1 1 48 48 ASP HA H 1 4.364 0.02 . 1 . . . . 48 ASP HA . 26808 1 529 . 1 1 48 48 ASP HB2 H 1 2.544 0.02 . 2 . . . . 48 ASP HB2 . 26808 1 530 . 1 1 48 48 ASP HB3 H 1 2.544 0.02 . 2 . . . . 48 ASP HB3 . 26808 1 531 . 1 1 48 48 ASP C C 13 178.446 0.30 . 1 . . . . 48 ASP C . 26808 1 532 . 1 1 48 48 ASP CA C 13 56.314 0.30 . 1 . . . . 48 ASP CA . 26808 1 533 . 1 1 48 48 ASP CB C 13 38.142 0.30 . 1 . . . . 48 ASP CB . 26808 1 534 . 1 1 48 48 ASP N N 15 121.400 0.20 . 1 . . . . 48 ASP N . 26808 1 535 . 1 1 49 49 HIS H H 1 7.120 0.02 . 1 . . . . 49 HIS H . 26808 1 536 . 1 1 49 49 HIS HA H 1 4.396 0.02 . 1 . . . . 49 HIS HA . 26808 1 537 . 1 1 49 49 HIS HB2 H 1 3.138 0.02 . 2 . . . . 49 HIS HB2 . 26808 1 538 . 1 1 49 49 HIS HB3 H 1 2.891 0.02 . 2 . . . . 49 HIS HB3 . 26808 1 539 . 1 1 49 49 HIS CA C 13 54.718 0.30 . 1 . . . . 49 HIS CA . 26808 1 540 . 1 1 49 49 HIS CB C 13 30.203 0.30 . 1 . . . . 49 HIS CB . 26808 1 541 . 1 1 49 49 HIS N N 15 118.885 0.20 . 1 . . . . 49 HIS N . 26808 1 542 . 1 1 50 50 LEU H H 1 7.684 0.02 . 1 . . . . 50 LEU H . 26808 1 543 . 1 1 50 50 LEU HA H 1 3.455 0.02 . 1 . . . . 50 LEU HA . 26808 1 544 . 1 1 50 50 LEU HB2 H 1 2.151 0.02 . 2 . . . . 50 LEU HB2 . 26808 1 545 . 1 1 50 50 LEU HB3 H 1 1.202 0.02 . 2 . . . . 50 LEU HB3 . 26808 1 546 . 1 1 50 50 LEU HG H 1 1.649 0.02 . 1 . . . . 50 LEU HG . 26808 1 547 . 1 1 50 50 LEU HD11 H 1 0.972 0.02 . 2 . . . . 50 LEU HD11 . 26808 1 548 . 1 1 50 50 LEU HD12 H 1 0.972 0.02 . 2 . . . . 50 LEU HD11 . 26808 1 549 . 1 1 50 50 LEU HD13 H 1 0.972 0.02 . 2 . . . . 50 LEU HD11 . 26808 1 550 . 1 1 50 50 LEU HD21 H 1 1.099 0.02 . 2 . . . . 50 LEU HD21 . 26808 1 551 . 1 1 50 50 LEU HD22 H 1 1.099 0.02 . 2 . . . . 50 LEU HD21 . 26808 1 552 . 1 1 50 50 LEU HD23 H 1 1.099 0.02 . 2 . . . . 50 LEU HD21 . 26808 1 553 . 1 1 50 50 LEU C C 13 177.408 0.30 . 1 . . . . 50 LEU C . 26808 1 554 . 1 1 50 50 LEU CA C 13 58.469 0.30 . 1 . . . . 50 LEU CA . 26808 1 555 . 1 1 50 50 LEU CB C 13 40.069 0.30 . 1 . . . . 50 LEU CB . 26808 1 556 . 1 1 50 50 LEU CG C 13 27.400 0.30 . 1 . . . . 50 LEU CG . 26808 1 557 . 1 1 50 50 LEU CD1 C 13 23.282 0.30 . 2 . . . . 50 LEU CD1 . 26808 1 558 . 1 1 50 50 LEU CD2 C 13 26.965 0.30 . 2 . . . . 50 LEU CD2 . 26808 1 559 . 1 1 50 50 LEU N N 15 123.904 0.20 . 1 . . . . 50 LEU N . 26808 1 560 . 1 1 51 51 THR H H 1 8.156 0.02 . 1 . . . . 51 THR H . 26808 1 561 . 1 1 51 51 THR HA H 1 3.857 0.02 . 1 . . . . 51 THR HA . 26808 1 562 . 1 1 51 51 THR HB H 1 4.498 0.02 . 1 . . . . 51 THR HB . 26808 1 563 . 1 1 51 51 THR HG21 H 1 1.296 0.02 . 1 . . . . 51 THR HG21 . 26808 1 564 . 1 1 51 51 THR HG22 H 1 1.296 0.02 . 1 . . . . 51 THR HG21 . 26808 1 565 . 1 1 51 51 THR HG23 H 1 1.296 0.02 . 1 . . . . 51 THR HG21 . 26808 1 566 . 1 1 51 51 THR CA C 13 67.673 0.30 . 1 . . . . 51 THR CA . 26808 1 567 . 1 1 51 51 THR CB C 13 68.599 0.30 . 1 . . . . 51 THR CB . 26808 1 568 . 1 1 51 51 THR CG2 C 13 22.048 0.30 . 1 . . . . 51 THR CG2 . 26808 1 569 . 1 1 51 51 THR N N 15 116.102 0.20 . 1 . . . . 51 THR N . 26808 1 570 . 1 1 52 52 THR H H 1 7.792 0.02 . 1 . . . . 52 THR H . 26808 1 571 . 1 1 52 52 THR HA H 1 4.380 0.02 . 1 . . . . 52 THR HA . 26808 1 572 . 1 1 52 52 THR HB H 1 3.986 0.02 . 1 . . . . 52 THR HB . 26808 1 573 . 1 1 52 52 THR HG21 H 1 1.450 0.02 . 1 . . . . 52 THR HG21 . 26808 1 574 . 1 1 52 52 THR HG22 H 1 1.450 0.02 . 1 . . . . 52 THR HG21 . 26808 1 575 . 1 1 52 52 THR HG23 H 1 1.450 0.02 . 1 . . . . 52 THR HG21 . 26808 1 576 . 1 1 52 52 THR CA C 13 66.604 0.30 . 1 . . . . 52 THR CA . 26808 1 577 . 1 1 52 52 THR CB C 13 66.459 0.30 . 1 . . . . 52 THR CB . 26808 1 578 . 1 1 52 52 THR CG2 C 13 22.389 0.30 . 1 . . . . 52 THR CG2 . 26808 1 579 . 1 1 52 52 THR N N 15 109.674 0.20 . 1 . . . . 52 THR N . 26808 1 580 . 1 1 53 53 HIS H H 1 7.918 0.02 . 1 . . . . 53 HIS H . 26808 1 581 . 1 1 53 53 HIS HA H 1 4.440 0.02 . 1 . . . . 53 HIS HA . 26808 1 582 . 1 1 53 53 HIS HB2 H 1 3.287 0.02 . 2 . . . . 53 HIS HB2 . 26808 1 583 . 1 1 53 53 HIS HB3 H 1 3.169 0.02 . 2 . . . . 53 HIS HB3 . 26808 1 584 . 1 1 53 53 HIS C C 13 176.241 0.30 . 1 . . . . 53 HIS C . 26808 1 585 . 1 1 53 53 HIS CA C 13 60.326 0.30 . 1 . . . . 53 HIS CA . 26808 1 586 . 1 1 53 53 HIS CB C 13 27.408 0.30 . 1 . . . . 53 HIS CB . 26808 1 587 . 1 1 53 53 HIS N N 15 125.056 0.20 . 1 . . . . 53 HIS N . 26808 1 588 . 1 1 54 54 ILE H H 1 8.853 0.02 . 1 . . . . 54 ILE H . 26808 1 589 . 1 1 54 54 ILE HA H 1 3.629 0.02 . 1 . . . . 54 ILE HA . 26808 1 590 . 1 1 54 54 ILE HB H 1 2.118 0.02 . 1 . . . . 54 ILE HB . 26808 1 591 . 1 1 54 54 ILE HG12 H 1 2.211 0.02 . 2 . . . . 54 ILE HG12 . 26808 1 592 . 1 1 54 54 ILE HG13 H 1 1.677 0.02 . 2 . . . . 54 ILE HG13 . 26808 1 593 . 1 1 54 54 ILE C C 13 178.001 0.30 . 1 . . . . 54 ILE C . 26808 1 594 . 1 1 54 54 ILE CA C 13 66.750 0.30 . 1 . . . . 54 ILE CA . 26808 1 595 . 1 1 54 54 ILE CB C 13 37.860 0.30 . 1 . . . . 54 ILE CB . 26808 1 596 . 1 1 54 54 ILE CG1 C 13 31.159 0.30 . 1 . . . . 54 ILE CG1 . 26808 1 597 . 1 1 54 54 ILE CG2 C 13 17.935 0.30 . 1 . . . . 54 ILE CG2 . 26808 1 598 . 1 1 54 54 ILE CD1 C 13 14.559 0.30 . 1 . . . . 54 ILE CD1 . 26808 1 599 . 1 1 54 54 ILE N N 15 123.341 0.20 . 1 . . . . 54 ILE N . 26808 1 600 . 1 1 55 55 ARG H H 1 7.269 0.02 . 1 . . . . 55 ARG H . 26808 1 601 . 1 1 55 55 ARG HA H 1 4.713 0.02 . 1 . . . . 55 ARG HA . 26808 1 602 . 1 1 55 55 ARG HB2 H 1 2.100 0.02 . 2 . . . . 55 ARG HB2 . 26808 1 603 . 1 1 55 55 ARG HB3 H 1 1.440 0.02 . 2 . . . . 55 ARG HB3 . 26808 1 604 . 1 1 55 55 ARG HG2 H 1 2.146 0.02 . 2 . . . . 55 ARG HG2 . 26808 1 605 . 1 1 55 55 ARG HG3 H 1 2.054 0.02 . 2 . . . . 55 ARG HG3 . 26808 1 606 . 1 1 55 55 ARG HD2 H 1 3.315 0.02 . 2 . . . . 55 ARG HD2 . 26808 1 607 . 1 1 55 55 ARG HD3 H 1 3.473 0.02 . 2 . . . . 55 ARG HD3 . 26808 1 608 . 1 1 55 55 ARG HE H 1 7.377 0.02 . 1 . . . . 55 ARG HE . 26808 1 609 . 1 1 55 55 ARG C C 13 179.698 0.30 . 1 . . . . 55 ARG C . 26808 1 610 . 1 1 55 55 ARG CA C 13 59.482 0.30 . 1 . . . . 55 ARG CA . 26808 1 611 . 1 1 55 55 ARG CB C 13 28.662 0.30 . 1 . . . . 55 ARG CB . 26808 1 612 . 1 1 55 55 ARG CG C 13 30.034 0.30 . 1 . . . . 55 ARG CG . 26808 1 613 . 1 1 55 55 ARG CD C 13 44.993 0.30 . 1 . . . . 55 ARG CD . 26808 1 614 . 1 1 55 55 ARG N N 15 117.128 0.20 . 1 . . . . 55 ARG N . 26808 1 615 . 1 1 55 55 ARG NE N 15 86.177 0.20 . 1 . . . . 55 ARG NE . 26808 1 616 . 1 1 56 56 THR H H 1 8.118 0.02 . 1 . . . . 56 THR H . 26808 1 617 . 1 1 56 56 THR HA H 1 4.200 0.02 . 1 . . . . 56 THR HA . 26808 1 618 . 1 1 56 56 THR HB H 1 4.207 0.02 . 1 . . . . 56 THR HB . 26808 1 619 . 1 1 56 56 THR HG21 H 1 1.484 0.02 . 1 . . . . 56 THR HG21 . 26808 1 620 . 1 1 56 56 THR HG22 H 1 1.484 0.02 . 1 . . . . 56 THR HG21 . 26808 1 621 . 1 1 56 56 THR HG23 H 1 1.484 0.02 . 1 . . . . 56 THR HG21 . 26808 1 622 . 1 1 56 56 THR C C 13 176.289 0.30 . 1 . . . . 56 THR C . 26808 1 623 . 1 1 56 56 THR CA C 13 64.828 0.30 . 1 . . . . 56 THR CA . 26808 1 624 . 1 1 56 56 THR CB C 13 68.644 0.30 . 1 . . . . 56 THR CB . 26808 1 625 . 1 1 56 56 THR CG2 C 13 21.499 0.30 . 1 . . . . 56 THR CG2 . 26808 1 626 . 1 1 56 56 THR N N 15 112.600 0.20 . 1 . . . . 56 THR N . 26808 1 627 . 1 1 57 57 HIS H H 1 7.605 0.02 . 1 . . . . 57 HIS H . 26808 1 628 . 1 1 57 57 HIS HA H 1 4.908 0.02 . 1 . . . . 57 HIS HA . 26808 1 629 . 1 1 57 57 HIS HB2 H 1 3.415 0.02 . 2 . . . . 57 HIS HB2 . 26808 1 630 . 1 1 57 57 HIS HB3 H 1 3.388 0.02 . 2 . . . . 57 HIS HB3 . 26808 1 631 . 1 1 57 57 HIS C C 13 177.498 0.30 . 1 . . . . 57 HIS C . 26808 1 632 . 1 1 57 57 HIS CA C 13 56.228 0.30 . 1 . . . . 57 HIS CA . 26808 1 633 . 1 1 57 57 HIS CB C 13 29.888 0.30 . 1 . . . . 57 HIS CB . 26808 1 634 . 1 1 57 57 HIS N N 15 117.964 0.20 . 1 . . . . 57 HIS N . 26808 1 635 . 1 1 58 58 THR H H 1 8.028 0.02 . 1 . . . . 58 THR H . 26808 1 636 . 1 1 58 58 THR HA H 1 4.257 0.02 . 1 . . . . 58 THR HA . 26808 1 637 . 1 1 58 58 THR HB H 1 4.485 0.02 . 1 . . . . 58 THR HB . 26808 1 638 . 1 1 58 58 THR HG21 H 1 1.331 0.02 . 1 . . . . 58 THR HG2 . 26808 1 639 . 1 1 58 58 THR HG22 H 1 1.331 0.02 . 1 . . . . 58 THR HG2 . 26808 1 640 . 1 1 58 58 THR HG23 H 1 1.331 0.02 . 1 . . . . 58 THR HG2 . 26808 1 641 . 1 1 58 58 THR C C 13 176.992 0.30 . 1 . . . . 58 THR C . 26808 1 642 . 1 1 58 58 THR CA C 13 62.661 0.30 . 1 . . . . 58 THR CA . 26808 1 643 . 1 1 58 58 THR CB C 13 70.340 0.30 . 1 . . . . 58 THR CB . 26808 1 644 . 1 1 58 58 THR CG2 C 13 21.593 0.30 . 1 . . . . 58 THR CG2 . 26808 1 645 . 1 1 58 58 THR N N 15 107.604 0.20 . 1 . . . . 58 THR N . 26808 1 646 . 1 1 59 59 GLY H H 1 8.073 0.02 . 1 . . . . 59 GLY H . 26808 1 647 . 1 1 59 59 GLY HA2 H 1 4.170 0.02 . 2 . . . . 59 GLY HA2 . 26808 1 648 . 1 1 59 59 GLY HA3 H 1 3.843 0.02 . 2 . . . . 59 GLY HA3 . 26808 1 649 . 1 1 59 59 GLY C C 13 173.971 0.30 . 1 . . . . 59 GLY C . 26808 1 650 . 1 1 59 59 GLY CA C 13 45.790 0.30 . 1 . . . . 59 GLY CA . 26808 1 651 . 1 1 59 59 GLY N N 15 109.812 0.20 . 1 . . . . 59 GLY N . 26808 1 652 . 1 1 60 60 GLU H H 1 7.492 0.02 . 1 . . . . 60 GLU H . 26808 1 653 . 1 1 60 60 GLU HA H 1 3.993 0.02 . 1 . . . . 60 GLU HA . 26808 1 654 . 1 1 60 60 GLU HB2 H 1 1.919 0.02 . 2 . . . . 60 GLU HB2 . 26808 1 655 . 1 1 60 60 GLU HB3 H 1 1.889 0.02 . 2 . . . . 60 GLU HB3 . 26808 1 656 . 1 1 60 60 GLU HG2 H 1 1.998 0.02 . 2 . . . . 60 GLU HG2 . 26808 1 657 . 1 1 60 60 GLU HG3 H 1 2.295 0.02 . 2 . . . . 60 GLU HG3 . 26808 1 658 . 1 1 60 60 GLU C C 13 176.018 0.30 . 1 . . . . 60 GLU C . 26808 1 659 . 1 1 60 60 GLU CA C 13 57.592 0.30 . 1 . . . . 60 GLU CA . 26808 1 660 . 1 1 60 60 GLU CB C 13 30.360 0.30 . 1 . . . . 60 GLU CB . 26808 1 661 . 1 1 60 60 GLU CG C 13 36.223 0.30 . 1 . . . . 60 GLU CG . 26808 1 662 . 1 1 60 60 GLU N N 15 121.536 0.20 . 1 . . . . 60 GLU N . 26808 1 663 . 1 1 61 61 LYS H H 1 8.343 0.02 . 1 . . . . 61 LYS H . 26808 1 664 . 1 1 61 61 LYS HA H 1 4.586 0.02 . 1 . . . . 61 LYS HA . 26808 1 665 . 1 1 61 61 LYS HB2 H 1 1.586 0.02 . 2 . . . . 61 LYS HB2 . 26808 1 666 . 1 1 61 61 LYS HB3 H 1 1.586 0.02 . 2 . . . . 61 LYS HB3 . 26808 1 667 . 1 1 61 61 LYS HG2 H 1 0.883 0.02 . 2 . . . . 61 LYS HG2 . 26808 1 668 . 1 1 61 61 LYS HG3 H 1 0.883 0.02 . 2 . . . . 61 LYS HG3 . 26808 1 669 . 1 1 61 61 LYS HD2 H 1 1.390 0.02 . 2 . . . . 61 LYS HD2 . 26808 1 670 . 1 1 61 61 LYS HD3 H 1 1.390 0.02 . 2 . . . . 61 LYS HD3 . 26808 1 671 . 1 1 61 61 LYS HE2 H 1 2.945 0.02 . 2 . . . . 61 LYS HE2 . 26808 1 672 . 1 1 61 61 LYS HE3 H 1 2.945 0.02 . 2 . . . . 61 LYS HE3 . 26808 1 673 . 1 1 61 61 LYS C C 13 173.671 0.30 . 1 . . . . 61 LYS C . 26808 1 674 . 1 1 61 61 LYS CA C 13 53.847 0.30 . 1 . . . . 61 LYS CA . 26808 1 675 . 1 1 61 61 LYS CB C 13 35.340 0.30 . 1 . . . . 61 LYS CB . 26808 1 676 . 1 1 61 61 LYS CG C 13 25.299 0.30 . 1 . . . . 61 LYS CG . 26808 1 677 . 1 1 61 61 LYS CD C 13 29.736 0.30 . 1 . . . . 61 LYS CD . 26808 1 678 . 1 1 61 61 LYS CE C 13 43.047 0.30 . 1 . . . . 61 LYS CE . 26808 1 679 . 1 1 61 61 LYS N N 15 126.050 0.20 . 1 . . . . 61 LYS N . 26808 1 680 . 1 1 61 61 LYS NZ N 15 32.457 0.20 . 1 . . . . 61 LYS NZ . 26808 1 681 . 1 1 62 62 PRO HA H 1 4.251 0.02 . 1 . . . . 62 PRO HA . 26808 1 682 . 1 1 62 62 PRO HB2 H 1 2.061 0.02 . 2 . . . . 62 PRO HB2 . 26808 1 683 . 1 1 62 62 PRO HB3 H 1 0.735 0.02 . 2 . . . . 62 PRO HB3 . 26808 1 684 . 1 1 62 62 PRO HG2 H 1 1.484 0.02 . 2 . . . . 62 PRO HG2 . 26808 1 685 . 1 1 62 62 PRO HG3 H 1 1.655 0.02 . 2 . . . . 62 PRO HG3 . 26808 1 686 . 1 1 62 62 PRO HD2 H 1 3.655 0.02 . 2 . . . . 62 PRO HD2 . 26808 1 687 . 1 1 62 62 PRO HD3 H 1 3.590 0.02 . 2 . . . . 62 PRO HD3 . 26808 1 688 . 1 1 62 62 PRO C C 13 176.613 0.30 . 1 . . . . 62 PRO C . 26808 1 689 . 1 1 62 62 PRO CA C 13 63.279 0.30 . 1 . . . . 62 PRO CA . 26808 1 690 . 1 1 62 62 PRO CB C 13 32.378 0.30 . 1 . . . . 62 PRO CB . 26808 1 691 . 1 1 62 62 PRO CG C 13 26.282 0.30 . 1 . . . . 62 PRO CG . 26808 1 692 . 1 1 62 62 PRO CD C 13 50.291 0.30 . 1 . . . . 62 PRO CD . 26808 1 693 . 1 1 63 63 PHE H H 1 7.751 0.02 . 1 . . . . 63 PHE H . 26808 1 694 . 1 1 63 63 PHE HA H 1 4.665 0.02 . 1 . . . . 63 PHE HA . 26808 1 695 . 1 1 63 63 PHE HB2 H 1 2.862 0.02 . 2 . . . . 63 PHE HB2 . 26808 1 696 . 1 1 63 63 PHE HB3 H 1 2.685 0.02 . 2 . . . . 63 PHE HB3 . 26808 1 697 . 1 1 63 63 PHE C C 13 174.353 0.30 . 1 . . . . 63 PHE C . 26808 1 698 . 1 1 63 63 PHE CA C 13 57.419 0.30 . 1 . . . . 63 PHE CA . 26808 1 699 . 1 1 63 63 PHE CB C 13 40.075 0.30 . 1 . . . . 63 PHE CB . 26808 1 700 . 1 1 63 63 PHE N N 15 115.125 0.20 . 1 . . . . 63 PHE N . 26808 1 701 . 1 1 64 64 ALA H H 1 9.067 0.02 . 1 . . . . 64 ALA H . 26808 1 702 . 1 1 64 64 ALA HA H 1 5.326 0.02 . 1 . . . . 64 ALA HA . 26808 1 703 . 1 1 64 64 ALA C C 13 177.769 0.30 . 1 . . . . 64 ALA C . 26808 1 704 . 1 1 64 64 ALA CA C 13 50.546 0.30 . 1 . . . . 64 ALA CA . 26808 1 705 . 1 1 64 64 ALA CB C 13 21.407 0.30 . 1 . . . . 64 ALA CB . 26808 1 706 . 1 1 64 64 ALA N N 15 126.602 0.20 . 1 . . . . 64 ALA N . 26808 1 707 . 1 1 65 65 CYS H H 1 9.431 0.02 . 1 . . . . 65 CYS H . 26808 1 708 . 1 1 65 65 CYS HA H 1 4.620 0.02 . 1 . . . . 65 CYS HA . 26808 1 709 . 1 1 65 65 CYS HB2 H 1 3.467 0.02 . 2 . . . . 65 CYS HB2 . 26808 1 710 . 1 1 65 65 CYS HB3 H 1 2.980 0.02 . 2 . . . . 65 CYS HB3 . 26808 1 711 . 1 1 65 65 CYS C C 13 176.956 0.30 . 1 . . . . 65 CYS C . 26808 1 712 . 1 1 65 65 CYS CA C 13 59.516 0.30 . 1 . . . . 65 CYS CA . 26808 1 713 . 1 1 65 65 CYS CB C 13 30.315 0.30 . 1 . . . . 65 CYS CB . 26808 1 714 . 1 1 65 65 CYS N N 15 125.188 0.20 . 1 . . . . 65 CYS N . 26808 1 715 . 1 1 66 66 ASP H H 1 9.409 0.02 . 1 . . . . 66 ASP H . 26808 1 716 . 1 1 66 66 ASP HA H 1 4.470 0.02 . 1 . . . . 66 ASP HA . 26808 1 717 . 1 1 66 66 ASP HB2 H 1 2.774 0.02 . 2 . . . . 66 ASP HB2 . 26808 1 718 . 1 1 66 66 ASP HB3 H 1 2.837 0.02 . 2 . . . . 66 ASP HB3 . 26808 1 719 . 1 1 66 66 ASP C C 13 175.783 0.30 . 1 . . . . 66 ASP C . 26808 1 720 . 1 1 66 66 ASP CA C 13 56.294 0.30 . 1 . . . . 66 ASP CA . 26808 1 721 . 1 1 66 66 ASP CB C 13 40.641 0.30 . 1 . . . . 66 ASP CB . 26808 1 722 . 1 1 66 66 ASP N N 15 131.456 0.20 . 1 . . . . 66 ASP N . 26808 1 723 . 1 1 67 67 ILE H H 1 8.799 0.02 . 1 . . . . 67 ILE H . 26808 1 724 . 1 1 67 67 ILE HA H 1 3.929 0.02 . 1 . . . . 67 ILE HA . 26808 1 725 . 1 1 67 67 ILE HB H 1 1.170 0.02 . 1 . . . . 67 ILE HB . 26808 1 726 . 1 1 67 67 ILE HG12 H 1 1.442 0.02 . 2 . . . . 67 ILE HG12 . 26808 1 727 . 1 1 67 67 ILE HG13 H 1 1.119 0.02 . 2 . . . . 67 ILE HG13 . 26808 1 728 . 1 1 67 67 ILE C C 13 176.974 0.30 . 1 . . . . 67 ILE C . 26808 1 729 . 1 1 67 67 ILE CA C 13 63.421 0.30 . 1 . . . . 67 ILE CA . 26808 1 730 . 1 1 67 67 ILE CB C 13 38.474 0.30 . 1 . . . . 67 ILE CB . 26808 1 731 . 1 1 67 67 ILE CG1 C 13 28.252 0.30 . 1 . . . . 67 ILE CG1 . 26808 1 732 . 1 1 67 67 ILE CG2 C 13 15.966 0.30 . 1 . . . . 67 ILE CG2 . 26808 1 733 . 1 1 67 67 ILE CD1 C 13 12.308 0.30 . 1 . . . . 67 ILE CD1 . 26808 1 734 . 1 1 67 67 ILE N N 15 121.594 0.20 . 1 . . . . 67 ILE N . 26808 1 735 . 1 1 68 68 CYS H H 1 8.234 0.02 . 1 . . . . 68 CYS H . 26808 1 736 . 1 1 68 68 CYS HA H 1 5.151 0.02 . 1 . . . . 68 CYS HA . 26808 1 737 . 1 1 68 68 CYS HB2 H 1 2.822 0.02 . 1 . . . . 68 CYS HB2 . 26808 1 738 . 1 1 68 68 CYS HB3 H 1 3.536 0.02 . 1 . . . . 68 CYS HB3 . 26808 1 739 . 1 1 68 68 CYS C C 13 176.415 0.30 . 1 . . . . 68 CYS C . 26808 1 740 . 1 1 68 68 CYS CA C 13 58.323 0.30 . 1 . . . . 68 CYS CA . 26808 1 741 . 1 1 68 68 CYS CB C 13 32.660 0.30 . 1 . . . . 68 CYS CB . 26808 1 742 . 1 1 68 68 CYS N N 15 116.366 0.20 . 1 . . . . 68 CYS N . 26808 1 743 . 1 1 69 69 GLY H H 1 7.963 0.02 . 1 . . . . 69 GLY H . 26808 1 744 . 1 1 69 69 GLY HA2 H 1 4.271 0.02 . 2 . . . . 69 GLY HA2 . 26808 1 745 . 1 1 69 69 GLY HA3 H 1 3.886 0.02 . 2 . . . . 69 GLY HA3 . 26808 1 746 . 1 1 69 69 GLY C C 13 173.906 0.30 . 1 . . . . 69 GLY C . 26808 1 747 . 1 1 69 69 GLY CA C 13 46.071 0.30 . 1 . . . . 69 GLY CA . 26808 1 748 . 1 1 69 69 GLY N N 15 112.979 0.20 . 1 . . . . 69 GLY N . 26808 1 749 . 1 1 70 70 ARG H H 1 8.145 0.02 . 1 . . . . 70 ARG H . 26808 1 750 . 1 1 70 70 ARG HA H 1 3.971 0.02 . 1 . . . . 70 ARG HA . 26808 1 751 . 1 1 70 70 ARG HB2 H 1 1.206 0.02 . 2 . . . . 70 ARG HB2 . 26808 1 752 . 1 1 70 70 ARG HB3 H 1 1.576 0.02 . 2 . . . . 70 ARG HB3 . 26808 1 753 . 1 1 70 70 ARG HG2 H 1 1.222 0.02 . 2 . . . . 70 ARG HG2 . 26808 1 754 . 1 1 70 70 ARG HG3 H 1 1.630 0.02 . 2 . . . . 70 ARG HG3 . 26808 1 755 . 1 1 70 70 ARG HD2 H 1 3.101 0.02 . 2 . . . . 70 ARG HD2 . 26808 1 756 . 1 1 70 70 ARG HD3 H 1 2.873 0.02 . 2 . . . . 70 ARG HD3 . 26808 1 757 . 1 1 70 70 ARG HE H 1 7.141 0.02 . 1 . . . . 70 ARG HE . 26808 1 758 . 1 1 70 70 ARG C C 13 174.162 0.30 . 1 . . . . 70 ARG C . 26808 1 759 . 1 1 70 70 ARG CA C 13 58.030 0.30 . 1 . . . . 70 ARG CA . 26808 1 760 . 1 1 70 70 ARG CB C 13 30.737 0.30 . 1 . . . . 70 ARG CB . 26808 1 761 . 1 1 70 70 ARG CG C 13 27.876 0.30 . 1 . . . . 70 ARG CG . 26808 1 762 . 1 1 70 70 ARG CD C 13 43.445 0.30 . 1 . . . . 70 ARG CD . 26808 1 763 . 1 1 70 70 ARG N N 15 123.227 0.20 . 1 . . . . 70 ARG N . 26808 1 764 . 1 1 70 70 ARG NE N 15 84.970 0.20 . 1 . . . . 70 ARG NE . 26808 1 765 . 1 1 71 71 LYS H H 1 7.784 0.02 . 1 . . . . 71 LYS H . 26808 1 766 . 1 1 71 71 LYS HA H 1 5.046 0.02 . 1 . . . . 71 LYS HA . 26808 1 767 . 1 1 71 71 LYS HB2 H 1 1.888 0.02 . 2 . . . . 71 LYS HB2 . 26808 1 768 . 1 1 71 71 LYS HB3 H 1 1.409 0.02 . 2 . . . . 71 LYS HB3 . 26808 1 769 . 1 1 71 71 LYS HG2 H 1 1.217 0.02 . 2 . . . . 71 LYS HG2 . 26808 1 770 . 1 1 71 71 LYS HG3 H 1 1.576 0.02 . 2 . . . . 71 LYS HG3 . 26808 1 771 . 1 1 71 71 LYS HD2 H 1 1.695 0.02 . 2 . . . . 71 LYS HD2 . 26808 1 772 . 1 1 71 71 LYS HE2 H 1 3.009 0.02 . 2 . . . . 71 LYS HE2 . 26808 1 773 . 1 1 71 71 LYS HE3 H 1 3.009 0.02 . 2 . . . . 71 LYS HE3 . 26808 1 774 . 1 1 71 71 LYS C C 13 175.477 0.30 . 1 . . . . 71 LYS C . 26808 1 775 . 1 1 71 71 LYS CA C 13 55.059 0.30 . 1 . . . . 71 LYS CA . 26808 1 776 . 1 1 71 71 LYS CB C 13 35.076 0.30 . 1 . . . . 71 LYS CB . 26808 1 777 . 1 1 71 71 LYS CG C 13 24.964 0.30 . 1 . . . . 71 LYS CG . 26808 1 778 . 1 1 71 71 LYS CD C 13 29.189 0.30 . 1 . . . . 71 LYS CD . 26808 1 779 . 1 1 71 71 LYS CE C 13 42.340 0.30 . 1 . . . . 71 LYS CE . 26808 1 780 . 1 1 71 71 LYS N N 15 120.924 0.20 . 1 . . . . 71 LYS N . 26808 1 781 . 1 1 71 71 LYS NZ N 15 32.498 0.20 . 1 . . . . 71 LYS NZ . 26808 1 782 . 1 1 72 72 PHE H H 1 8.676 0.02 . 1 . . . . 72 PHE H . 26808 1 783 . 1 1 72 72 PHE HA H 1 4.756 0.02 . 1 . . . . 72 PHE HA . 26808 1 784 . 1 1 72 72 PHE HB2 H 1 3.476 0.02 . 2 . . . . 72 PHE HB2 . 26808 1 785 . 1 1 72 72 PHE HB3 H 1 2.745 0.02 . 2 . . . . 72 PHE HB3 . 26808 1 786 . 1 1 72 72 PHE C C 13 175.180 0.30 . 1 . . . . 72 PHE C . 26808 1 787 . 1 1 72 72 PHE CA C 13 57.105 0.30 . 1 . . . . 72 PHE CA . 26808 1 788 . 1 1 72 72 PHE CB C 13 44.289 0.30 . 1 . . . . 72 PHE CB . 26808 1 789 . 1 1 72 72 PHE N N 15 116.215 0.20 . 1 . . . . 72 PHE N . 26808 1 790 . 1 1 73 73 ALA H H 1 9.421 0.02 . 1 . . . . 73 ALA H . 26808 1 791 . 1 1 73 73 ALA HA H 1 4.656 0.02 . 1 . . . . 73 ALA HA . 26808 1 792 . 1 1 73 73 ALA C C 13 177.132 0.30 . 1 . . . . 73 ALA C . 26808 1 793 . 1 1 73 73 ALA CA C 13 54.887 0.30 . 1 . . . . 73 ALA CA . 26808 1 794 . 1 1 73 73 ALA CB C 13 19.905 0.30 . 1 . . . . 73 ALA CB . 26808 1 795 . 1 1 73 73 ALA N N 15 123.737 0.20 . 1 . . . . 73 ALA N . 26808 1 796 . 1 1 74 74 ARG H H 1 7.714 0.02 . 1 . . . . 74 ARG H . 26808 1 797 . 1 1 74 74 ARG HA H 1 5.041 0.02 . 1 . . . . 74 ARG HA . 26808 1 798 . 1 1 74 74 ARG HB2 H 1 2.230 0.02 . 2 . . . . 74 ARG HB2 . 26808 1 799 . 1 1 74 74 ARG HB3 H 1 2.230 0.02 . 2 . . . . 74 ARG HB3 . 26808 1 800 . 1 1 74 74 ARG HG2 H 1 1.914 0.02 . 2 . . . . 74 ARG HG2 . 26808 1 801 . 1 1 74 74 ARG HG3 H 1 1.607 0.02 . 2 . . . . 74 ARG HG3 . 26808 1 802 . 1 1 74 74 ARG HD2 H 1 3.274 0.02 . 2 . . . . 74 ARG HD2 . 26808 1 803 . 1 1 74 74 ARG HD3 H 1 3.198 0.02 . 2 . . . . 74 ARG HD3 . 26808 1 804 . 1 1 74 74 ARG HE H 1 8.064 0.02 . 1 . . . . 74 ARG HE . 26808 1 805 . 1 1 74 74 ARG C C 13 177.938 0.30 . 1 . . . . 74 ARG C . 26808 1 806 . 1 1 74 74 ARG CA C 13 54.100 0.30 . 1 . . . . 74 ARG CA . 26808 1 807 . 1 1 74 74 ARG CB C 13 36.273 0.30 . 1 . . . . 74 ARG CB . 26808 1 808 . 1 1 74 74 ARG CG C 13 26.930 0.30 . 1 . . . . 74 ARG CG . 26808 1 809 . 1 1 74 74 ARG CD C 13 43.633 0.30 . 1 . . . . 74 ARG CD . 26808 1 810 . 1 1 74 74 ARG N N 15 112.309 0.20 . 1 . . . . 74 ARG N . 26808 1 811 . 1 1 74 74 ARG NE N 15 78.910 0.20 . 1 . . . . 74 ARG NE . 26808 1 812 . 1 1 75 75 SER H H 1 8.632 0.02 . 1 . . . . 75 SER H . 26808 1 813 . 1 1 75 75 SER HA H 1 2.976 0.02 . 1 . . . . 75 SER HA . 26808 1 814 . 1 1 75 75 SER HB2 H 1 3.110 0.02 . 2 . . . . 75 SER HB2 . 26808 1 815 . 1 1 75 75 SER HB3 H 1 3.444 0.02 . 2 . . . . 75 SER HB3 . 26808 1 816 . 1 1 75 75 SER C C 13 177.068 0.30 . 1 . . . . 75 SER C . 26808 1 817 . 1 1 75 75 SER CA C 13 60.518 0.30 . 1 . . . . 75 SER CA . 26808 1 818 . 1 1 75 75 SER CB C 13 61.582 0.30 . 1 . . . . 75 SER CB . 26808 1 819 . 1 1 75 75 SER N N 15 120.672 0.20 . 1 . . . . 75 SER N . 26808 1 820 . 1 1 76 76 ASP H H 1 8.712 0.02 . 1 . . . . 76 ASP H . 26808 1 821 . 1 1 76 76 ASP HA H 1 4.386 0.02 . 1 . . . . 76 ASP HA . 26808 1 822 . 1 1 76 76 ASP HB2 H 1 2.749 0.02 . 2 . . . . 76 ASP HB2 . 26808 1 823 . 1 1 76 76 ASP HB3 H 1 2.749 0.02 . 2 . . . . 76 ASP HB3 . 26808 1 824 . 1 1 76 76 ASP C C 13 178.722 0.30 . 1 . . . . 76 ASP C . 26808 1 825 . 1 1 76 76 ASP CA C 13 56.205 0.30 . 1 . . . . 76 ASP CA . 26808 1 826 . 1 1 76 76 ASP CB C 13 39.225 0.30 . 1 . . . . 76 ASP CB . 26808 1 827 . 1 1 76 76 ASP N N 15 120.586 0.20 . 1 . . . . 76 ASP N . 26808 1 828 . 1 1 77 77 GLU H H 1 6.736 0.02 . 1 . . . . 77 GLU H . 26808 1 829 . 1 1 77 77 GLU HA H 1 4.029 0.02 . 1 . . . . 77 GLU HA . 26808 1 830 . 1 1 77 77 GLU HB2 H 1 2.331 0.02 . 2 . . . . 77 GLU HB2 . 26808 1 831 . 1 1 77 77 GLU HB3 H 1 2.489 0.02 . 2 . . . . 77 GLU HB3 . 26808 1 832 . 1 1 77 77 GLU HG2 H 1 2.854 0.02 . 2 . . . . 77 GLU HG2 . 26808 1 833 . 1 1 77 77 GLU HG3 H 1 2.854 0.02 . 2 . . . . 77 GLU HG3 . 26808 1 834 . 1 1 77 77 GLU C C 13 178.956 0.30 . 1 . . . . 77 GLU C . 26808 1 835 . 1 1 77 77 GLU CA C 13 58.517 0.30 . 1 . . . . 77 GLU CA . 26808 1 836 . 1 1 77 77 GLU CB C 13 29.940 0.30 . 1 . . . . 77 GLU CB . 26808 1 837 . 1 1 77 77 GLU CG C 13 34.935 0.30 . 1 . . . . 77 GLU CG . 26808 1 838 . 1 1 77 77 GLU N N 15 121.099 0.20 . 1 . . . . 77 GLU N . 26808 1 839 . 1 1 78 78 ARG H H 1 6.868 0.02 . 1 . . . . 78 ARG H . 26808 1 840 . 1 1 78 78 ARG HA H 1 2.802 0.02 . 1 . . . . 78 ARG HA . 26808 1 841 . 1 1 78 78 ARG HB2 H 1 1.425 0.02 . 2 . . . . 78 ARG HB2 . 26808 1 842 . 1 1 78 78 ARG HB3 H 1 2.104 0.02 . 2 . . . . 78 ARG HB3 . 26808 1 843 . 1 1 78 78 ARG HG2 H 1 1.568 0.02 . 2 . . . . 78 ARG HG2 . 26808 1 844 . 1 1 78 78 ARG HG3 H 1 1.568 0.02 . 2 . . . . 78 ARG HG3 . 26808 1 845 . 1 1 78 78 ARG HD2 H 1 3.379 0.02 . 2 . . . . 78 ARG HD2 . 26808 1 846 . 1 1 78 78 ARG HD3 H 1 3.003 0.02 . 2 . . . . 78 ARG HD3 . 26808 1 847 . 1 1 78 78 ARG HE H 1 7.698 0.02 . 1 . . . . 78 ARG HE . 26808 1 848 . 1 1 78 78 ARG C C 13 177.492 0.30 . 1 . . . . 78 ARG C . 26808 1 849 . 1 1 78 78 ARG CA C 13 59.389 0.30 . 1 . . . . 78 ARG CA . 26808 1 850 . 1 1 78 78 ARG CB C 13 28.473 0.30 . 1 . . . . 78 ARG CB . 26808 1 851 . 1 1 78 78 ARG CG C 13 26.188 0.30 . 1 . . . . 78 ARG CG . 26808 1 852 . 1 1 78 78 ARG CD C 13 43.510 0.30 . 1 . . . . 78 ARG CD . 26808 1 853 . 1 1 78 78 ARG N N 15 120.720 0.20 . 1 . . . . 78 ARG N . 26808 1 854 . 1 1 78 78 ARG NE N 15 82.452 0.20 . 1 . . . . 78 ARG NE . 26808 1 855 . 1 1 79 79 LYS H H 1 8.128 0.02 . 1 . . . . 79 LYS H . 26808 1 856 . 1 1 79 79 LYS HA H 1 4.014 0.02 . 1 . . . . 79 LYS HA . 26808 1 857 . 1 1 79 79 LYS HB2 H 1 1.947 0.02 . 2 . . . . 79 LYS HB2 . 26808 1 858 . 1 1 79 79 LYS HB3 H 1 1.908 0.02 . 2 . . . . 79 LYS HB3 . 26808 1 859 . 1 1 79 79 LYS HG2 H 1 1.456 0.02 . 2 . . . . 79 LYS HG2 . 26808 1 860 . 1 1 79 79 LYS HG3 H 1 1.456 0.02 . 2 . . . . 79 LYS HG3 . 26808 1 861 . 1 1 79 79 LYS HD2 H 1 1.756 0.02 . 2 . . . . 79 LYS HD2 . 26808 1 862 . 1 1 79 79 LYS HD3 H 1 1.756 0.02 . 2 . . . . 79 LYS HD3 . 26808 1 863 . 1 1 79 79 LYS HE2 H 1 3.011 0.02 . 2 . . . . 79 LYS HE2 . 26808 1 864 . 1 1 79 79 LYS HE3 H 1 3.011 0.02 . 2 . . . . 79 LYS HE3 . 26808 1 865 . 1 1 79 79 LYS C C 13 178.960 0.30 . 1 . . . . 79 LYS C . 26808 1 866 . 1 1 79 79 LYS CA C 13 60.039 0.30 . 1 . . . . 79 LYS CA . 26808 1 867 . 1 1 79 79 LYS CB C 13 32.284 0.30 . 1 . . . . 79 LYS CB . 26808 1 868 . 1 1 79 79 LYS CG C 13 24.875 0.30 . 1 . . . . 79 LYS CG . 26808 1 869 . 1 1 79 79 LYS CD C 13 29.096 0.30 . 1 . . . . 79 LYS CD . 26808 1 870 . 1 1 79 79 LYS CE C 13 42.133 0.30 . 1 . . . . 79 LYS CE . 26808 1 871 . 1 1 79 79 LYS N N 15 121.082 0.20 . 1 . . . . 79 LYS N . 26808 1 872 . 1 1 79 79 LYS NZ N 15 32.783 0.20 . 1 . . . . 79 LYS NZ . 26808 1 873 . 1 1 80 80 ARG H H 1 7.694 0.02 . 1 . . . . 80 ARG H . 26808 1 874 . 1 1 80 80 ARG HA H 1 3.986 0.02 . 1 . . . . 80 ARG HA . 26808 1 875 . 1 1 80 80 ARG HB2 H 1 1.939 0.02 . 2 . . . . 80 ARG HB2 . 26808 1 876 . 1 1 80 80 ARG HB3 H 1 1.800 0.02 . 2 . . . . 80 ARG HB3 . 26808 1 877 . 1 1 80 80 ARG HG2 H 1 1.689 0.02 . 2 . . . . 80 ARG HG2 . 26808 1 878 . 1 1 80 80 ARG HG3 H 1 1.867 0.02 . 2 . . . . 80 ARG HG3 . 26808 1 879 . 1 1 80 80 ARG HD2 H 1 3.198 0.02 . 2 . . . . 80 ARG HD2 . 26808 1 880 . 1 1 80 80 ARG HD3 H 1 3.314 0.02 . 2 . . . . 80 ARG HD3 . 26808 1 881 . 1 1 80 80 ARG C C 13 178.574 0.30 . 1 . . . . 80 ARG C . 26808 1 882 . 1 1 80 80 ARG CA C 13 59.995 0.30 . 1 . . . . 80 ARG CA . 26808 1 883 . 1 1 80 80 ARG CB C 13 30.737 0.30 . 1 . . . . 80 ARG CB . 26808 1 884 . 1 1 80 80 ARG CG C 13 27.032 0.30 . 1 . . . . 80 ARG CG . 26808 1 885 . 1 1 80 80 ARG CD C 13 43.914 0.30 . 1 . . . . 80 ARG CD . 26808 1 886 . 1 1 80 80 ARG N N 15 118.721 0.20 . 1 . . . . 80 ARG N . 26808 1 887 . 1 1 81 81 HIS H H 1 7.464 0.02 . 1 . . . . 81 HIS H . 26808 1 888 . 1 1 81 81 HIS HA H 1 4.328 0.02 . 1 . . . . 81 HIS HA . 26808 1 889 . 1 1 81 81 HIS HB2 H 1 3.176 0.02 . 2 . . . . 81 HIS HB2 . 26808 1 890 . 1 1 81 81 HIS HB3 H 1 2.999 0.02 . 2 . . . . 81 HIS HB3 . 26808 1 891 . 1 1 81 81 HIS C C 13 176.410 0.30 . 1 . . . . 81 HIS C . 26808 1 892 . 1 1 81 81 HIS CA C 13 59.295 0.30 . 1 . . . . 81 HIS CA . 26808 1 893 . 1 1 81 81 HIS CB C 13 28.190 0.30 . 1 . . . . 81 HIS CB . 26808 1 894 . 1 1 81 81 HIS N N 15 117.712 0.20 . 1 . . . . 81 HIS N . 26808 1 895 . 1 1 82 82 THR H H 1 8.279 0.02 . 1 . . . . 82 THR H . 26808 1 896 . 1 1 82 82 THR HA H 1 3.764 0.02 . 1 . . . . 82 THR HA . 26808 1 897 . 1 1 82 82 THR HB H 1 4.422 0.02 . 1 . . . . 82 THR HB . 26808 1 898 . 1 1 82 82 THR HG21 H 1 1.642 0.02 . 1 . . . . 82 THR HG21 . 26808 1 899 . 1 1 82 82 THR HG22 H 1 1.642 0.02 . 1 . . . . 82 THR HG21 . 26808 1 900 . 1 1 82 82 THR HG23 H 1 1.642 0.02 . 1 . . . . 82 THR HG21 . 26808 1 901 . 1 1 82 82 THR C C 13 175.689 0.30 . 1 . . . . 82 THR C . 26808 1 902 . 1 1 82 82 THR CA C 13 66.769 0.30 . 1 . . . . 82 THR CA . 26808 1 903 . 1 1 82 82 THR CB C 13 69.599 0.30 . 1 . . . . 82 THR CB . 26808 1 904 . 1 1 82 82 THR CG2 C 13 21.968 0.30 . 1 . . . . 82 THR CG2 . 26808 1 905 . 1 1 82 82 THR N N 15 111.326 0.20 . 1 . . . . 82 THR N . 26808 1 906 . 1 1 83 83 LYS H H 1 7.147 0.02 . 1 . . . . 83 LYS H . 26808 1 907 . 1 1 83 83 LYS HA H 1 4.000 0.02 . 1 . . . . 83 LYS HA . 26808 1 908 . 1 1 83 83 LYS HB2 H 1 1.904 0.02 . 2 . . . . 83 LYS HB2 . 26808 1 909 . 1 1 83 83 LYS HB3 H 1 1.904 0.02 . 2 . . . . 83 LYS HB3 . 26808 1 910 . 1 1 83 83 LYS HG2 H 1 1.522 0.02 . 2 . . . . 83 LYS HG2 . 26808 1 911 . 1 1 83 83 LYS HG3 H 1 1.677 0.02 . 2 . . . . 83 LYS HG3 . 26808 1 912 . 1 1 83 83 LYS HD2 H 1 1.750 0.02 . 2 . . . . 83 LYS HD2 . 26808 1 913 . 1 1 83 83 LYS HD3 H 1 1.750 0.02 . 2 . . . . 83 LYS HD3 . 26808 1 914 . 1 1 83 83 LYS HE2 H 1 3.011 0.02 . 2 . . . . 83 LYS HE2 . 26808 1 915 . 1 1 83 83 LYS HE3 H 1 3.011 0.02 . 2 . . . . 83 LYS HE3 . 26808 1 916 . 1 1 83 83 LYS C C 13 178.807 0.30 . 1 . . . . 83 LYS C . 26808 1 917 . 1 1 83 83 LYS CA C 13 59.107 0.30 . 1 . . . . 83 LYS CA . 26808 1 918 . 1 1 83 83 LYS CB C 13 32.284 0.30 . 1 . . . . 83 LYS CB . 26808 1 919 . 1 1 83 83 LYS CG C 13 25.340 0.30 . 1 . . . . 83 LYS CG . 26808 1 920 . 1 1 83 83 LYS CD C 13 29.377 0.30 . 1 . . . . 83 LYS CD . 26808 1 921 . 1 1 83 83 LYS CE C 13 42.034 0.30 . 1 . . . . 83 LYS CE . 26808 1 922 . 1 1 83 83 LYS N N 15 119.266 0.20 . 1 . . . . 83 LYS N . 26808 1 923 . 1 1 83 83 LYS NZ N 15 33.036 0.20 . 1 . . . . 83 LYS NZ . 26808 1 924 . 1 1 84 84 ILE H H 1 7.835 0.02 . 1 . . . . 84 ILE H . 26808 1 925 . 1 1 84 84 ILE HA H 1 3.962 0.02 . 1 . . . . 84 ILE HA . 26808 1 926 . 1 1 84 84 ILE HB H 1 1.750 0.02 . 1 . . . . 84 ILE HB . 26808 1 927 . 1 1 84 84 ILE HG12 H 1 0.974 0.02 . 2 . . . . 84 ILE HG12 . 26808 1 928 . 1 1 84 84 ILE HG13 H 1 0.848 0.02 . 2 . . . . 84 ILE HG13 . 26808 1 929 . 1 1 84 84 ILE C C 13 177.471 0.30 . 1 . . . . 84 ILE C . 26808 1 930 . 1 1 84 84 ILE CA C 13 63.609 0.30 . 1 . . . . 84 ILE CA . 26808 1 931 . 1 1 84 84 ILE CB C 13 37.536 0.30 . 1 . . . . 84 ILE CB . 26808 1 932 . 1 1 84 84 ILE CG1 C 13 26.563 0.30 . 1 . . . . 84 ILE CG1 . 26808 1 933 . 1 1 84 84 ILE CG2 C 13 16.716 0.30 . 1 . . . . 84 ILE CG2 . 26808 1 934 . 1 1 84 84 ILE CD1 C 13 14.090 0.30 . 1 . . . . 84 ILE CD1 . 26808 1 935 . 1 1 84 84 ILE N N 15 116.301 0.20 . 1 . . . . 84 ILE N . 26808 1 936 . 1 1 85 85 HIS H H 1 7.295 0.02 . 1 . . . . 85 HIS H . 26808 1 937 . 1 1 85 85 HIS HA H 1 4.755 0.02 . 1 . . . . 85 HIS HA . 26808 1 938 . 1 1 85 85 HIS HB2 H 1 3.201 0.02 . 2 . . . . 85 HIS HB2 . 26808 1 939 . 1 1 85 85 HIS HB3 H 1 3.381 0.02 . 2 . . . . 85 HIS HB3 . 26808 1 940 . 1 1 85 85 HIS C C 13 175.350 0.30 . 1 . . . . 85 HIS C . 26808 1 941 . 1 1 85 85 HIS CA C 13 55.545 0.30 . 1 . . . . 85 HIS CA . 26808 1 942 . 1 1 85 85 HIS CB C 13 28.721 0.30 . 1 . . . . 85 HIS CB . 26808 1 943 . 1 1 85 85 HIS N N 15 116.853 0.20 . 1 . . . . 85 HIS N . 26808 1 944 . 1 1 86 86 LEU H H 1 7.499 0.02 . 1 . . . . 86 LEU H . 26808 1 945 . 1 1 86 86 LEU HA H 1 4.371 0.02 . 1 . . . . 86 LEU HA . 26808 1 946 . 1 1 86 86 LEU HB2 H 1 1.747 0.02 . 2 . . . . 86 LEU HB2 . 26808 1 947 . 1 1 86 86 LEU HB3 H 1 1.649 0.02 . 2 . . . . 86 LEU HB3 . 26808 1 948 . 1 1 86 86 LEU HG H 1 0.962 0.02 . 1 . . . . 86 LEU HG . 26808 1 949 . 1 1 86 86 LEU HD11 H 1 0.960 0.02 . 2 . . . . 86 LEU HD11 . 26808 1 950 . 1 1 86 86 LEU HD12 H 1 0.960 0.02 . 2 . . . . 86 LEU HD11 . 26808 1 951 . 1 1 86 86 LEU HD13 H 1 0.960 0.02 . 2 . . . . 86 LEU HD11 . 26808 1 952 . 1 1 86 86 LEU HD21 H 1 0.896 0.02 . 2 . . . . 86 LEU HD21 . 26808 1 953 . 1 1 86 86 LEU HD22 H 1 0.896 0.02 . 2 . . . . 86 LEU HD21 . 26808 1 954 . 1 1 86 86 LEU HD23 H 1 0.896 0.02 . 2 . . . . 86 LEU HD21 . 26808 1 955 . 1 1 86 86 LEU C C 13 177.173 0.30 . 1 . . . . 86 LEU C . 26808 1 956 . 1 1 86 86 LEU CA C 13 55.543 0.30 . 1 . . . . 86 LEU CA . 26808 1 957 . 1 1 86 86 LEU CB C 13 42.132 0.30 . 1 . . . . 86 LEU CB . 26808 1 958 . 1 1 86 86 LEU CG C 13 26.845 0.30 . 1 . . . . 86 LEU CG . 26808 1 959 . 1 1 86 86 LEU CD1 C 13 25.217 0.30 . 2 . . . . 86 LEU CD1 . 26808 1 960 . 1 1 86 86 LEU CD2 C 13 22.922 0.30 . 2 . . . . 86 LEU CD2 . 26808 1 961 . 1 1 86 86 LEU N N 15 120.054 0.20 . 1 . . . . 86 LEU N . 26808 1 962 . 1 1 87 87 ARG H H 1 7.992 0.02 . 1 . . . . 87 ARG H . 26808 1 963 . 1 1 87 87 ARG HA H 1 4.359 0.02 . 1 . . . . 87 ARG HA . 26808 1 964 . 1 1 87 87 ARG HB2 H 1 1.907 0.02 . 2 . . . . 87 ARG HB2 . 26808 1 965 . 1 1 87 87 ARG HB3 H 1 1.806 0.02 . 2 . . . . 87 ARG HB3 . 26808 1 966 . 1 1 87 87 ARG HG2 H 1 1.681 0.02 . 2 . . . . 87 ARG HG2 . 26808 1 967 . 1 1 87 87 ARG HG3 H 1 1.681 0.02 . 2 . . . . 87 ARG HG3 . 26808 1 968 . 1 1 87 87 ARG HD2 H 1 3.236 0.02 . 2 . . . . 87 ARG HD2 . 26808 1 969 . 1 1 87 87 ARG HD3 H 1 3.236 0.02 . 2 . . . . 87 ARG HD3 . 26808 1 970 . 1 1 87 87 ARG HE H 1 7.238 0.02 . 1 . . . . 87 ARG HE . 26808 1 971 . 1 1 87 87 ARG C C 13 176.177 0.30 . 1 . . . . 87 ARG C . 26808 1 972 . 1 1 87 87 ARG CA C 13 56.220 0.30 . 1 . . . . 87 ARG CA . 26808 1 973 . 1 1 87 87 ARG CB C 13 30.784 0.30 . 1 . . . . 87 ARG CB . 26808 1 974 . 1 1 87 87 ARG CG C 13 27.220 0.30 . 1 . . . . 87 ARG CG . 26808 1 975 . 1 1 87 87 ARG CD C 13 43.633 0.30 . 1 . . . . 87 ARG CD . 26808 1 976 . 1 1 87 87 ARG N N 15 120.552 0.20 . 1 . . . . 87 ARG N . 26808 1 977 . 1 1 87 87 ARG NE N 15 84.983 0.20 . 1 . . . . 87 ARG NE . 26808 1 978 . 1 1 88 88 GLN H H 1 8.292 0.02 . 1 . . . . 88 GLN H . 26808 1 979 . 1 1 88 88 GLN HA H 1 4.370 0.02 . 1 . . . . 88 GLN HA . 26808 1 980 . 1 1 88 88 GLN HB2 H 1 2.161 0.02 . 2 . . . . 88 GLN HB2 . 26808 1 981 . 1 1 88 88 GLN HB3 H 1 2.061 0.02 . 2 . . . . 88 GLN HB3 . 26808 1 982 . 1 1 88 88 GLN HG2 H 1 2.412 0.02 . 2 . . . . 88 GLN HG2 . 26808 1 983 . 1 1 88 88 GLN HG3 H 1 2.412 0.02 . 2 . . . . 88 GLN HG3 . 26808 1 984 . 1 1 88 88 GLN HE21 H 1 7.561 0.02 . 2 . . . . 88 GLN HE21 . 26808 1 985 . 1 1 88 88 GLN HE22 H 1 6.917 0.02 . 2 . . . . 88 GLN HE22 . 26808 1 986 . 1 1 88 88 GLN C C 13 175.562 0.30 . 1 . . . . 88 GLN C . 26808 1 987 . 1 1 88 88 GLN CA C 13 56.016 0.30 . 1 . . . . 88 GLN CA . 26808 1 988 . 1 1 88 88 GLN CB C 13 29.471 0.30 . 1 . . . . 88 GLN CB . 26808 1 989 . 1 1 88 88 GLN CG C 13 33.819 0.30 . 1 . . . . 88 GLN CG . 26808 1 990 . 1 1 88 88 GLN N N 15 121.652 0.20 . 1 . . . . 88 GLN N . 26808 1 991 . 1 1 88 88 GLN NE2 N 15 112.543 0.20 . 1 . . . . 88 GLN NE2 . 26808 1 992 . 1 1 89 89 LYS H H 1 8.276 0.02 . 1 . . . . 89 LYS H . 26808 1 993 . 1 1 89 89 LYS HA H 1 4.395 0.02 . 1 . . . . 89 LYS HA . 26808 1 994 . 1 1 89 89 LYS HB2 H 1 1.792 0.02 . 2 . . . . 89 LYS HB2 . 26808 1 995 . 1 1 89 89 LYS HB3 H 1 1.898 0.02 . 2 . . . . 89 LYS HB3 . 26808 1 996 . 1 1 89 89 LYS HG2 H 1 1.473 0.02 . 2 . . . . 89 LYS HG2 . 26808 1 997 . 1 1 89 89 LYS HG3 H 1 1.473 0.02 . 2 . . . . 89 LYS HG3 . 26808 1 998 . 1 1 89 89 LYS HD2 H 1 1.726 0.02 . 2 . . . . 89 LYS HD2 . 26808 1 999 . 1 1 89 89 LYS HD3 H 1 1.726 0.02 . 2 . . . . 89 LYS HD3 . 26808 1 1000 . 1 1 89 89 LYS HE2 H 1 3.043 0.02 . 2 . . . . 89 LYS HE2 . 26808 1 1001 . 1 1 89 89 LYS HE3 H 1 3.043 0.02 . 2 . . . . 89 LYS HE3 . 26808 1 1002 . 1 1 89 89 LYS C C 13 175.182 0.30 . 1 . . . . 89 LYS C . 26808 1 1003 . 1 1 89 89 LYS CA C 13 56.032 0.30 . 1 . . . . 89 LYS CA . 26808 1 1004 . 1 1 89 89 LYS CB C 13 33.222 0.30 . 1 . . . . 89 LYS CB . 26808 1 1005 . 1 1 89 89 LYS CG C 13 24.406 0.30 . 1 . . . . 89 LYS CG . 26808 1 1006 . 1 1 89 89 LYS CD C 13 29.002 0.30 . 1 . . . . 89 LYS CD . 26808 1 1007 . 1 1 89 89 LYS CE C 13 42.038 0.30 . 1 . . . . 89 LYS CE . 26808 1 1008 . 1 1 89 89 LYS N N 15 122.771 0.20 . 1 . . . . 89 LYS N . 26808 1 1009 . 1 1 89 89 LYS NZ N 15 32.596 0.20 . 1 . . . . 89 LYS NZ . 26808 1 1010 . 1 1 90 90 ASP H H 1 7.975 0.02 . 1 . . . . 90 ASP H . 26808 1 1011 . 1 1 90 90 ASP HA H 1 4.424 0.02 . 1 . . . . 90 ASP HA . 26808 1 1012 . 1 1 90 90 ASP HB2 H 1 2.606 0.02 . 2 . . . . 90 ASP HB2 . 26808 1 1013 . 1 1 90 90 ASP HB3 H 1 2.714 0.02 . 2 . . . . 90 ASP HB3 . 26808 1 1014 . 1 1 90 90 ASP C C 13 180.821 0.30 . 1 . . . . 90 ASP C . 26808 1 1015 . 1 1 90 90 ASP CA C 13 55.984 0.30 . 1 . . . . 90 ASP CA . 26808 1 1016 . 1 1 90 90 ASP CB C 13 42.097 0.30 . 1 . . . . 90 ASP CB . 26808 1 1017 . 1 1 90 90 ASP N N 15 127.153 0.20 . 1 . . . . 90 ASP N . 26808 1 stop_ save_