data_26818 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 26818 _Entry.Title ; 1H, 13C and 15N backbone and side chain chemical shift assignments of CHIP-TPR ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2016-06-17 _Entry.Accession_date 2016-06-17 _Entry.Last_release_date 2016-10-13 _Entry.Original_release_date 2016-10-13 _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 Huaqun Zhang . . . . 26818 2 Richard Page . C. . . 26818 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 26818 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 479 26818 '15N chemical shifts' 124 26818 '1H chemical shifts' 727 26818 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 . . 2017-03-14 2016-06-17 update BMRB 'update entry citation' 26818 1 . . 2016-10-13 2016-06-17 original author 'original release' 26818 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 26819 CHIP-TPR/Hsp70p1 26818 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 26818 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 27709416 _Citation.Full_citation . _Citation.Title ; 1H, 15N and 13C resonance assignments for free and IEEVD peptide-bound forms of the tetratricopeptide repeat domain from the human E3 ubiquitin ligase CHIP ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assign.' _Citation.Journal_name_full . _Citation.Journal_volume 11 _Citation.Journal_issue 1 _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 5 _Citation.Page_last 9 _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 Huaqun Zhang . . . . 26818 1 2 Cameron McGlone . . . . 26818 1 3 Matthew Mannion . M. . . 26818 1 4 Richard Page . C. . . 26818 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 26818 _Assembly.ID 1 _Assembly.Name CHIP-TPR _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _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 CHIP-TPR 1 $CHIP-TPR A . yes native no no . . . 26818 1 stop_ loop_ _Assembly_db_link.Author_supplied _Assembly_db_link.Database_code _Assembly_db_link.Accession_code _Assembly_db_link.Entry_mol_code _Assembly_db_link.Entry_mol_name _Assembly_db_link.Entry_experimental_method _Assembly_db_link.Entry_structure_resolution _Assembly_db_link.Entry_relation_type _Assembly_db_link.Entry_details _Assembly_db_link.Entry_ID _Assembly_db_link.Assembly_ID yes PDB 4kbq . . X-ray . 'Chains A and B are the same domain as used in this study.' . 26818 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_CHIP-TPR _Entity.Sf_category entity _Entity.Sf_framecode CHIP-TPR _Entity.Entry_ID 26818 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name CHIP-TPR _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 ; GAMGSEKSPSAQELKEQGNR LFVGRKYPEAAACYGRAITR NPLVAVYYTNRALCYLKMQQ HEQALADCRRALELDGQSVK AHFFLGQCQLEMESYDEAIA NLQRAYSLAKEQRLNFGDDI PSALRIAKKKRWNSIEERR ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details 'Residues 1-5 are from a non-native affinity tag after cleavage by TEV protease.' _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 139 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment 'The tetratricopeptide repeat domain (TPR) of the C terminus of HSC70-Interacting Protein (CHIP).' _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 15860 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details 'Assignments of the first 5 residues are not included.' _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 yes UNP Q9UNE7 . 'E3 ubiquitin-protein ligase CHIP' . . . . . . . . . . . . . . 26818 1 stop_ loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID 'Binding domain of Ubiquitin ligase to Hsp70/Hsp90' 26818 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 16 GLY . 26818 1 2 17 ALA . 26818 1 3 18 MET . 26818 1 4 19 GLY . 26818 1 5 20 SER . 26818 1 6 21 GLU . 26818 1 7 22 LYS . 26818 1 8 23 SER . 26818 1 9 24 PRO . 26818 1 10 25 SER . 26818 1 11 26 ALA . 26818 1 12 27 GLN . 26818 1 13 28 GLU . 26818 1 14 29 LEU . 26818 1 15 30 LYS . 26818 1 16 31 GLU . 26818 1 17 32 GLN . 26818 1 18 33 GLY . 26818 1 19 34 ASN . 26818 1 20 35 ARG . 26818 1 21 36 LEU . 26818 1 22 37 PHE . 26818 1 23 38 VAL . 26818 1 24 39 GLY . 26818 1 25 40 ARG . 26818 1 26 41 LYS . 26818 1 27 42 TYR . 26818 1 28 43 PRO . 26818 1 29 44 GLU . 26818 1 30 45 ALA . 26818 1 31 46 ALA . 26818 1 32 47 ALA . 26818 1 33 48 CYS . 26818 1 34 49 TYR . 26818 1 35 50 GLY . 26818 1 36 51 ARG . 26818 1 37 52 ALA . 26818 1 38 53 ILE . 26818 1 39 54 THR . 26818 1 40 55 ARG . 26818 1 41 56 ASN . 26818 1 42 57 PRO . 26818 1 43 58 LEU . 26818 1 44 59 VAL . 26818 1 45 60 ALA . 26818 1 46 61 VAL . 26818 1 47 62 TYR . 26818 1 48 63 TYR . 26818 1 49 64 THR . 26818 1 50 65 ASN . 26818 1 51 66 ARG . 26818 1 52 67 ALA . 26818 1 53 68 LEU . 26818 1 54 69 CYS . 26818 1 55 70 TYR . 26818 1 56 71 LEU . 26818 1 57 72 LYS . 26818 1 58 73 MET . 26818 1 59 74 GLN . 26818 1 60 75 GLN . 26818 1 61 76 HIS . 26818 1 62 77 GLU . 26818 1 63 78 GLN . 26818 1 64 79 ALA . 26818 1 65 80 LEU . 26818 1 66 81 ALA . 26818 1 67 82 ASP . 26818 1 68 83 CYS . 26818 1 69 84 ARG . 26818 1 70 85 ARG . 26818 1 71 86 ALA . 26818 1 72 87 LEU . 26818 1 73 88 GLU . 26818 1 74 89 LEU . 26818 1 75 90 ASP . 26818 1 76 91 GLY . 26818 1 77 92 GLN . 26818 1 78 93 SER . 26818 1 79 94 VAL . 26818 1 80 95 LYS . 26818 1 81 96 ALA . 26818 1 82 97 HIS . 26818 1 83 98 PHE . 26818 1 84 99 PHE . 26818 1 85 100 LEU . 26818 1 86 101 GLY . 26818 1 87 102 GLN . 26818 1 88 103 CYS . 26818 1 89 104 GLN . 26818 1 90 105 LEU . 26818 1 91 106 GLU . 26818 1 92 107 MET . 26818 1 93 108 GLU . 26818 1 94 109 SER . 26818 1 95 110 TYR . 26818 1 96 111 ASP . 26818 1 97 112 GLU . 26818 1 98 113 ALA . 26818 1 99 114 ILE . 26818 1 100 115 ALA . 26818 1 101 116 ASN . 26818 1 102 117 LEU . 26818 1 103 118 GLN . 26818 1 104 119 ARG . 26818 1 105 120 ALA . 26818 1 106 121 TYR . 26818 1 107 122 SER . 26818 1 108 123 LEU . 26818 1 109 124 ALA . 26818 1 110 125 LYS . 26818 1 111 126 GLU . 26818 1 112 127 GLN . 26818 1 113 128 ARG . 26818 1 114 129 LEU . 26818 1 115 130 ASN . 26818 1 116 131 PHE . 26818 1 117 132 GLY . 26818 1 118 133 ASP . 26818 1 119 134 ASP . 26818 1 120 135 ILE . 26818 1 121 136 PRO . 26818 1 122 137 SER . 26818 1 123 138 ALA . 26818 1 124 139 LEU . 26818 1 125 140 ARG . 26818 1 126 141 ILE . 26818 1 127 142 ALA . 26818 1 128 143 LYS . 26818 1 129 144 LYS . 26818 1 130 145 LYS . 26818 1 131 146 ARG . 26818 1 132 147 TRP . 26818 1 133 148 ASN . 26818 1 134 149 SER . 26818 1 135 150 ILE . 26818 1 136 151 GLU . 26818 1 137 152 GLU . 26818 1 138 153 ARG . 26818 1 139 154 ARG . 26818 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 . GLY 1 1 26818 1 . ALA 2 2 26818 1 . MET 3 3 26818 1 . GLY 4 4 26818 1 . SER 5 5 26818 1 . GLU 6 6 26818 1 . LYS 7 7 26818 1 . SER 8 8 26818 1 . PRO 9 9 26818 1 . SER 10 10 26818 1 . ALA 11 11 26818 1 . GLN 12 12 26818 1 . GLU 13 13 26818 1 . LEU 14 14 26818 1 . LYS 15 15 26818 1 . GLU 16 16 26818 1 . GLN 17 17 26818 1 . GLY 18 18 26818 1 . ASN 19 19 26818 1 . ARG 20 20 26818 1 . LEU 21 21 26818 1 . PHE 22 22 26818 1 . VAL 23 23 26818 1 . GLY 24 24 26818 1 . ARG 25 25 26818 1 . LYS 26 26 26818 1 . TYR 27 27 26818 1 . PRO 28 28 26818 1 . GLU 29 29 26818 1 . ALA 30 30 26818 1 . ALA 31 31 26818 1 . ALA 32 32 26818 1 . CYS 33 33 26818 1 . TYR 34 34 26818 1 . GLY 35 35 26818 1 . ARG 36 36 26818 1 . ALA 37 37 26818 1 . ILE 38 38 26818 1 . THR 39 39 26818 1 . ARG 40 40 26818 1 . ASN 41 41 26818 1 . PRO 42 42 26818 1 . LEU 43 43 26818 1 . VAL 44 44 26818 1 . ALA 45 45 26818 1 . VAL 46 46 26818 1 . TYR 47 47 26818 1 . TYR 48 48 26818 1 . THR 49 49 26818 1 . ASN 50 50 26818 1 . ARG 51 51 26818 1 . ALA 52 52 26818 1 . LEU 53 53 26818 1 . CYS 54 54 26818 1 . TYR 55 55 26818 1 . LEU 56 56 26818 1 . LYS 57 57 26818 1 . MET 58 58 26818 1 . GLN 59 59 26818 1 . GLN 60 60 26818 1 . HIS 61 61 26818 1 . GLU 62 62 26818 1 . GLN 63 63 26818 1 . ALA 64 64 26818 1 . LEU 65 65 26818 1 . ALA 66 66 26818 1 . ASP 67 67 26818 1 . CYS 68 68 26818 1 . ARG 69 69 26818 1 . ARG 70 70 26818 1 . ALA 71 71 26818 1 . LEU 72 72 26818 1 . GLU 73 73 26818 1 . LEU 74 74 26818 1 . ASP 75 75 26818 1 . GLY 76 76 26818 1 . GLN 77 77 26818 1 . SER 78 78 26818 1 . VAL 79 79 26818 1 . LYS 80 80 26818 1 . ALA 81 81 26818 1 . HIS 82 82 26818 1 . PHE 83 83 26818 1 . PHE 84 84 26818 1 . LEU 85 85 26818 1 . GLY 86 86 26818 1 . GLN 87 87 26818 1 . CYS 88 88 26818 1 . GLN 89 89 26818 1 . LEU 90 90 26818 1 . GLU 91 91 26818 1 . MET 92 92 26818 1 . GLU 93 93 26818 1 . SER 94 94 26818 1 . TYR 95 95 26818 1 . ASP 96 96 26818 1 . GLU 97 97 26818 1 . ALA 98 98 26818 1 . ILE 99 99 26818 1 . ALA 100 100 26818 1 . ASN 101 101 26818 1 . LEU 102 102 26818 1 . GLN 103 103 26818 1 . ARG 104 104 26818 1 . ALA 105 105 26818 1 . TYR 106 106 26818 1 . SER 107 107 26818 1 . LEU 108 108 26818 1 . ALA 109 109 26818 1 . LYS 110 110 26818 1 . GLU 111 111 26818 1 . GLN 112 112 26818 1 . ARG 113 113 26818 1 . LEU 114 114 26818 1 . ASN 115 115 26818 1 . PHE 116 116 26818 1 . GLY 117 117 26818 1 . ASP 118 118 26818 1 . ASP 119 119 26818 1 . ILE 120 120 26818 1 . PRO 121 121 26818 1 . SER 122 122 26818 1 . ALA 123 123 26818 1 . LEU 124 124 26818 1 . ARG 125 125 26818 1 . ILE 126 126 26818 1 . ALA 127 127 26818 1 . LYS 128 128 26818 1 . LYS 129 129 26818 1 . LYS 130 130 26818 1 . ARG 131 131 26818 1 . TRP 132 132 26818 1 . ASN 133 133 26818 1 . SER 134 134 26818 1 . ILE 135 135 26818 1 . GLU 136 136 26818 1 . GLU 137 137 26818 1 . ARG 138 138 26818 1 . ARG 139 139 26818 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 26818 _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 $CHIP-TPR . 9606 organism . 'Homo sapiens' human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . 26818 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 26818 _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 $CHIP-TPR . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli BL21 . . . . . pHis//2 . . . 26818 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 26818 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 CHIP-TPR '[U-100% 15N]' . . 1 $CHIP-TPR . . 0.45 0.4 0.5 mM . . . . 26818 1 2 'sodium chloride' 'natural abundance' . . . . . . 150 . . mM . . . . 26818 1 3 HEPES 'natural abundance' . . . . . . 20 . . mM . . . . 26818 1 4 beta-mercaptoethanol 'natural abundance' . . . . . . 5 . . mM . . . . 26818 1 5 H2O 'natural abundance' . . . . . . 90 . . % . . . . 26818 1 6 D2O 'natural abundance' . . . . . . 10 . . % . . . . 26818 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 26818 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 7.0 . pH 26818 1 temperature 293 . K 26818 1 stop_ save_ ############################ # Computer software used # ############################ save_SPARKY _Software.Sf_category software _Software.Sf_framecode SPARKY _Software.Entry_ID 26818 _Software.ID 1 _Software.Name SPARKY _Software.Version 3.115 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . 26818 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 26818 1 stop_ save_ save_NMRDraw _Software.Sf_category software _Software.Sf_framecode NMRDraw _Software.Entry_ID 26818 _Software.ID 2 _Software.Name NMRDraw _Software.Version 8.1 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 26818 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 26818 2 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 26818 _Software.ID 3 _Software.Name NMRPipe _Software.Version 2012.090.12.09 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 26818 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 26818 3 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 26818 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 850 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 26818 _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_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 26818 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker Avance . 850 . . . 26818 1 2 spectrometer_2 Bruker Avance . 600 . . . 26818 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 26818 _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 . . . . . . . . . . . . . . . . . . . . . 26818 1 2 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 26818 1 3 '3D HN(CO)CA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 26818 1 4 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 26818 1 5 '3D HN(CA)CO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 26818 1 6 '3D HCCH-TCOSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 26818 1 7 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 26818 1 8 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 26818 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 26818 _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 carbon' . . . . ppm 0 external indirect 0.251449530 . . . . . 26818 1 H 1 DSS 'methyl protons' . . . . ppm 0 external direct 1.000000000 . . . . . 26818 1 N 15 '[15N] ammonium chloride' nitrogen . . . . ppm 0 external indirect 0.101329118 . . . . . 26818 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 26818 _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 0.03 _Assigned_chem_shift_list.Chem_shift_13C_err 0.3 _Assigned_chem_shift_list.Chem_shift_15N_err 0.3 _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' . . . 26818 1 2 '3D HNCA' . . . 26818 1 3 '3D HN(CO)CA' . . . 26818 1 4 '3D HNCO' . . . 26818 1 5 '3D HN(CA)CO' . . . 26818 1 6 '3D HCCH-TCOSY' . . . 26818 1 7 '3D CBCA(CO)NH' . . . 26818 1 8 '3D HNCACB' . . . 26818 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $SPARKY . . 26818 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 6 6 GLU H H 1 8.501 0.030 . 1 . . . . 21 GLU H . 26818 1 2 . 1 1 6 6 GLU HA H 1 4.162 0.030 . 1 . . . . 21 GLU HA . 26818 1 3 . 1 1 6 6 GLU HB2 H 1 1.872 0.030 . 2 . . . . 21 GLU HB2 . 26818 1 4 . 1 1 6 6 GLU HB3 H 1 1.919 0.030 . 2 . . . . 21 GLU HB3 . 26818 1 5 . 1 1 6 6 GLU HG2 H 1 2.121 0.030 . 2 . . . . 21 GLU HG2 . 26818 1 6 . 1 1 6 6 GLU HG3 H 1 2.172 0.030 . 2 . . . . 21 GLU HG3 . 26818 1 7 . 1 1 6 6 GLU C C 13 173.671 0.300 . 1 . . . . 21 GLU C . 26818 1 8 . 1 1 6 6 GLU CA C 13 54.109 0.300 . 1 . . . . 21 GLU CA . 26818 1 9 . 1 1 6 6 GLU CB C 13 27.304 0.300 . 1 . . . . 21 GLU CB . 26818 1 10 . 1 1 6 6 GLU CG C 13 33.525 0.300 . 1 . . . . 21 GLU CG . 26818 1 11 . 1 1 6 6 GLU N N 15 122.847 0.300 . 1 . . . . 21 GLU N . 26818 1 12 . 1 1 7 7 LYS H H 1 8.238 0.030 . 1 . . . . 22 LYS H . 26818 1 13 . 1 1 7 7 LYS HA H 1 4.259 0.030 . 1 . . . . 22 LYS HA . 26818 1 14 . 1 1 7 7 LYS HB2 H 1 1.643 0.030 . 2 . . . . 22 LYS HB2 . 26818 1 15 . 1 1 7 7 LYS HB3 H 1 1.7 0.030 . 2 . . . . 22 LYS HB3 . 26818 1 16 . 1 1 7 7 LYS HG2 H 1 1.302 0.030 . 2 . . . . 22 LYS HG2 . 26818 1 17 . 1 1 7 7 LYS HG3 H 1 1.302 0.030 . 2 . . . . 22 LYS HG3 . 26818 1 18 . 1 1 7 7 LYS HD2 H 1 1.557 0.030 . 2 . . . . 22 LYS HD2 . 26818 1 19 . 1 1 7 7 LYS HD3 H 1 1.557 0.030 . 2 . . . . 22 LYS HD3 . 26818 1 20 . 1 1 7 7 LYS HE2 H 1 2.883 0.030 . 2 . . . . 22 LYS HE2 . 26818 1 21 . 1 1 7 7 LYS HE3 H 1 2.883 0.030 . 2 . . . . 22 LYS HE3 . 26818 1 22 . 1 1 7 7 LYS C C 13 173.553 0.300 . 1 . . . . 22 LYS C . 26818 1 23 . 1 1 7 7 LYS CA C 13 53.269 0.300 . 1 . . . . 22 LYS CA . 26818 1 24 . 1 1 7 7 LYS CB C 13 30.411 0.300 . 1 . . . . 22 LYS CB . 26818 1 25 . 1 1 7 7 LYS CG C 13 24.23 0.300 . 1 . . . . 22 LYS CG . 26818 1 26 . 1 1 7 7 LYS CD C 13 27.823 0.300 . 1 . . . . 22 LYS CD . 26818 1 27 . 1 1 7 7 LYS CE C 13 40.693 0.300 . 1 . . . . 22 LYS CE . 26818 1 28 . 1 1 7 7 LYS N N 15 122.29 0.300 . 1 . . . . 22 LYS N . 26818 1 29 . 1 1 8 8 SER H H 1 8.28 0.030 . 1 . . . . 23 SER H . 26818 1 30 . 1 1 8 8 SER CA C 13 53.325 0.300 . 1 . . . . 23 SER CA . 26818 1 31 . 1 1 8 8 SER CB C 13 61.55 0.300 . 1 . . . . 23 SER CB . 26818 1 32 . 1 1 8 8 SER N N 15 118.767 0.300 . 1 . . . . 23 SER N . 26818 1 33 . 1 1 9 9 PRO HA H 1 4.452 0.030 . 1 . . . . 24 PRO HA . 26818 1 34 . 1 1 9 9 PRO HB2 H 1 2.136 0.030 . 2 . . . . 24 PRO HB2 . 26818 1 35 . 1 1 9 9 PRO HB3 H 1 1.683 0.030 . 2 . . . . 24 PRO HB3 . 26818 1 36 . 1 1 9 9 PRO HG2 H 1 1.817 0.030 . 2 . . . . 24 PRO HG2 . 26818 1 37 . 1 1 9 9 PRO HG3 H 1 1.879 0.030 . 2 . . . . 24 PRO HG3 . 26818 1 38 . 1 1 9 9 PRO CA C 13 60.11 0.300 . 1 . . . . 24 PRO CA . 26818 1 39 . 1 1 9 9 PRO CB C 13 29.459 0.300 . 1 . . . . 24 PRO CB . 26818 1 40 . 1 1 9 9 PRO CG C 13 25.018 0.300 . 1 . . . . 24 PRO CG . 26818 1 41 . 1 1 9 9 PRO CD C 13 48.124 0.300 . 1 . . . . 24 PRO CD . 26818 1 42 . 1 1 10 10 SER H H 1 8.686 0.030 . 1 . . . . 25 SER H . 26818 1 43 . 1 1 10 10 SER HA H 1 4.332 0.030 . 1 . . . . 25 SER HA . 26818 1 44 . 1 1 10 10 SER HB2 H 1 3.968 0.030 . 2 . . . . 25 SER HB2 . 26818 1 45 . 1 1 10 10 SER HB3 H 1 3.968 0.030 . 2 . . . . 25 SER HB3 . 26818 1 46 . 1 1 10 10 SER C C 13 171.808 0.300 . 1 . . . . 25 SER C . 26818 1 47 . 1 1 10 10 SER CA C 13 54.421 0.300 . 1 . . . . 25 SER CA . 26818 1 48 . 1 1 10 10 SER CB C 13 62.394 0.300 . 1 . . . . 25 SER CB . 26818 1 49 . 1 1 10 10 SER N N 15 117.574 0.300 . 1 . . . . 25 SER N . 26818 1 50 . 1 1 11 11 ALA H H 1 8.926 0.030 . 1 . . . . 26 ALA H . 26818 1 51 . 1 1 11 11 ALA HA H 1 3.827 0.030 . 1 . . . . 26 ALA HA . 26818 1 52 . 1 1 11 11 ALA HB1 H 1 1.547 0.030 . 1 . . . . 26 ALA HB . 26818 1 53 . 1 1 11 11 ALA HB2 H 1 1.547 0.030 . 1 . . . . 26 ALA HB . 26818 1 54 . 1 1 11 11 ALA HB3 H 1 1.547 0.030 . 1 . . . . 26 ALA HB . 26818 1 55 . 1 1 11 11 ALA C C 13 175.911 0.300 . 1 . . . . 26 ALA C . 26818 1 56 . 1 1 11 11 ALA CA C 13 53.119 0.300 . 1 . . . . 26 ALA CA . 26818 1 57 . 1 1 11 11 ALA CB C 13 15.653 0.300 . 1 . . . . 26 ALA CB . 26818 1 58 . 1 1 11 11 ALA N N 15 123.481 0.300 . 1 . . . . 26 ALA N . 26818 1 59 . 1 1 12 12 GLN H H 1 8.231 0.030 . 1 . . . . 27 GLN H . 26818 1 60 . 1 1 12 12 GLN HA H 1 3.975 0.030 . 1 . . . . 27 GLN HA . 26818 1 61 . 1 1 12 12 GLN HB2 H 1 2.167 0.030 . 2 . . . . 27 GLN HB2 . 26818 1 62 . 1 1 12 12 GLN HB3 H 1 1.982 0.030 . 2 . . . . 27 GLN HB3 . 26818 1 63 . 1 1 12 12 GLN HG2 H 1 2.473 0.030 . 2 . . . . 27 GLN HG2 . 26818 1 64 . 1 1 12 12 GLN HG3 H 1 2.288 0.030 . 2 . . . . 27 GLN HG3 . 26818 1 65 . 1 1 12 12 GLN C C 13 175.635 0.300 . 1 . . . . 27 GLN C . 26818 1 66 . 1 1 12 12 GLN CA C 13 56.351 0.300 . 1 . . . . 27 GLN CA . 26818 1 67 . 1 1 12 12 GLN CB C 13 25.266 0.300 . 1 . . . . 27 GLN CB . 26818 1 68 . 1 1 12 12 GLN CG C 13 31.909 0.300 . 1 . . . . 27 GLN CG . 26818 1 69 . 1 1 12 12 GLN N N 15 115.726 0.300 . 1 . . . . 27 GLN N . 26818 1 70 . 1 1 13 13 GLU H H 1 7.766 0.030 . 1 . . . . 28 GLU H . 26818 1 71 . 1 1 13 13 GLU HA H 1 4.114 0.030 . 1 . . . . 28 GLU HA . 26818 1 72 . 1 1 13 13 GLU HB2 H 1 2.091 0.030 . 2 . . . . 28 GLU HB2 . 26818 1 73 . 1 1 13 13 GLU HB3 H 1 1.933 0.030 . 2 . . . . 28 GLU HB3 . 26818 1 74 . 1 1 13 13 GLU HG2 H 1 1.85 0.030 . 2 . . . . 28 GLU HG2 . 26818 1 75 . 1 1 13 13 GLU HG3 H 1 1.85 0.030 . 2 . . . . 28 GLU HG3 . 26818 1 76 . 1 1 13 13 GLU C C 13 177.2 0.300 . 1 . . . . 28 GLU C . 26818 1 77 . 1 1 13 13 GLU CA C 13 56.611 0.300 . 1 . . . . 28 GLU CA . 26818 1 78 . 1 1 13 13 GLU CB C 13 27.196 0.300 . 1 . . . . 28 GLU CB . 26818 1 79 . 1 1 13 13 GLU CG C 13 33.413 0.300 . 1 . . . . 28 GLU CG . 26818 1 80 . 1 1 13 13 GLU N N 15 120.384 0.300 . 1 . . . . 28 GLU N . 26818 1 81 . 1 1 14 14 LEU H H 1 8.099 0.030 . 1 . . . . 29 LEU H . 26818 1 82 . 1 1 14 14 LEU HA H 1 3.985 0.030 . 1 . . . . 29 LEU HA . 26818 1 83 . 1 1 14 14 LEU HB2 H 1 1.121 0.030 . 2 . . . . 29 LEU HB2 . 26818 1 84 . 1 1 14 14 LEU HB3 H 1 1.121 0.030 . 2 . . . . 29 LEU HB3 . 26818 1 85 . 1 1 14 14 LEU C C 13 175.996 0.300 . 1 . . . . 29 LEU C . 26818 1 86 . 1 1 14 14 LEU CA C 13 54.826 0.300 . 1 . . . . 29 LEU CA . 26818 1 87 . 1 1 14 14 LEU CB C 13 40.718 0.300 . 1 . . . . 29 LEU CB . 26818 1 88 . 1 1 14 14 LEU CG C 13 28.641 0.300 . 1 . . . . 29 LEU CG . 26818 1 89 . 1 1 14 14 LEU CD1 C 13 24.49 0.300 . 2 . . . . 29 LEU CD1 . 26818 1 90 . 1 1 14 14 LEU CD2 C 13 24.49 0.300 . 2 . . . . 29 LEU CD2 . 26818 1 91 . 1 1 14 14 LEU N N 15 122.108 0.300 . 1 . . . . 29 LEU N . 26818 1 92 . 1 1 15 15 LYS H H 1 8.224 0.030 . 1 . . . . 30 LYS H . 26818 1 93 . 1 1 15 15 LYS HA H 1 3.686 0.030 . 1 . . . . 30 LYS HA . 26818 1 94 . 1 1 15 15 LYS HB2 H 1 1.682 0.030 . 2 . . . . 30 LYS HB2 . 26818 1 95 . 1 1 15 15 LYS HB3 H 1 1.682 0.030 . 2 . . . . 30 LYS HB3 . 26818 1 96 . 1 1 15 15 LYS HG2 H 1 1.428 0.030 . 2 . . . . 30 LYS HG2 . 26818 1 97 . 1 1 15 15 LYS HG3 H 1 1.428 0.030 . 2 . . . . 30 LYS HG3 . 26818 1 98 . 1 1 15 15 LYS HE2 H 1 2.949 0.030 . 2 . . . . 30 LYS HE2 . 26818 1 99 . 1 1 15 15 LYS HE3 H 1 2.949 0.030 . 2 . . . . 30 LYS HE3 . 26818 1 100 . 1 1 15 15 LYS C C 13 175.496 0.300 . 1 . . . . 30 LYS C . 26818 1 101 . 1 1 15 15 LYS CA C 13 57.063 0.300 . 1 . . . . 30 LYS CA . 26818 1 102 . 1 1 15 15 LYS CB C 13 27.695 0.300 . 1 . . . . 30 LYS CB . 26818 1 103 . 1 1 15 15 LYS CG C 13 25.515 0.300 . 1 . . . . 30 LYS CG . 26818 1 104 . 1 1 15 15 LYS CD C 13 26.742 0.300 . 1 . . . . 30 LYS CD . 26818 1 105 . 1 1 15 15 LYS CE C 13 40.532 0.300 . 1 . . . . 30 LYS CE . 26818 1 106 . 1 1 15 15 LYS N N 15 120.96 0.300 . 1 . . . . 30 LYS N . 26818 1 107 . 1 1 16 16 GLU H H 1 8.012 0.030 . 1 . . . . 31 GLU H . 26818 1 108 . 1 1 16 16 GLU HA H 1 4.129 0.030 . 1 . . . . 31 GLU HA . 26818 1 109 . 1 1 16 16 GLU HB2 H 1 2.012 0.030 . 2 . . . . 31 GLU HB2 . 26818 1 110 . 1 1 16 16 GLU HB3 H 1 2.012 0.030 . 2 . . . . 31 GLU HB3 . 26818 1 111 . 1 1 16 16 GLU C C 13 176.64 0.300 . 1 . . . . 31 GLU C . 26818 1 112 . 1 1 16 16 GLU CA C 13 56.598 0.300 . 1 . . . . 31 GLU CA . 26818 1 113 . 1 1 16 16 GLU CB C 13 26.241 0.300 . 1 . . . . 31 GLU CB . 26818 1 114 . 1 1 16 16 GLU CG C 13 33.629 0.300 . 1 . . . . 31 GLU CG . 26818 1 115 . 1 1 16 16 GLU N N 15 118.924 0.300 . 1 . . . . 31 GLU N . 26818 1 116 . 1 1 17 17 GLN H H 1 8.177 0.030 . 1 . . . . 32 GLN H . 26818 1 117 . 1 1 17 17 GLN HA H 1 3.861 0.030 . 1 . . . . 32 GLN HA . 26818 1 118 . 1 1 17 17 GLN HB2 H 1 1.997 0.030 . 2 . . . . 32 GLN HB2 . 26818 1 119 . 1 1 17 17 GLN HB3 H 1 2.271 0.030 . 2 . . . . 32 GLN HB3 . 26818 1 120 . 1 1 17 17 GLN HG2 H 1 2.388 0.030 . 2 . . . . 32 GLN HG2 . 26818 1 121 . 1 1 17 17 GLN HG3 H 1 2.443 0.030 . 2 . . . . 32 GLN HG3 . 26818 1 122 . 1 1 17 17 GLN C C 13 176.216 0.300 . 1 . . . . 32 GLN C . 26818 1 123 . 1 1 17 17 GLN CA C 13 56.296 0.300 . 1 . . . . 32 GLN CA . 26818 1 124 . 1 1 17 17 GLN CB C 13 25.34 0.300 . 1 . . . . 32 GLN CB . 26818 1 125 . 1 1 17 17 GLN CG C 13 31.91 0.300 . 1 . . . . 32 GLN CG . 26818 1 126 . 1 1 17 17 GLN N N 15 120.887 0.300 . 1 . . . . 32 GLN N . 26818 1 127 . 1 1 18 18 GLY H H 1 8.395 0.030 . 1 . . . . 33 GLY H . 26818 1 128 . 1 1 18 18 GLY HA2 H 1 3.201 0.030 . 2 . . . . 33 GLY HA2 . 26818 1 129 . 1 1 18 18 GLY HA3 H 1 3.201 0.030 . 2 . . . . 33 GLY HA3 . 26818 1 130 . 1 1 18 18 GLY C C 13 171.718 0.300 . 1 . . . . 33 GLY C . 26818 1 131 . 1 1 18 18 GLY CA C 13 44.643 0.300 . 1 . . . . 33 GLY CA . 26818 1 132 . 1 1 18 18 GLY N N 15 108.205 0.300 . 1 . . . . 33 GLY N . 26818 1 133 . 1 1 19 19 ASN H H 1 8.496 0.030 . 1 . . . . 34 ASN H . 26818 1 134 . 1 1 19 19 ASN HA H 1 4.451 0.030 . 1 . . . . 34 ASN HA . 26818 1 135 . 1 1 19 19 ASN HB2 H 1 3.106 0.030 . 2 . . . . 34 ASN HB2 . 26818 1 136 . 1 1 19 19 ASN HB3 H 1 2.906 0.030 . 2 . . . . 34 ASN HB3 . 26818 1 137 . 1 1 19 19 ASN C C 13 174.793 0.300 . 1 . . . . 34 ASN C . 26818 1 138 . 1 1 19 19 ASN CA C 13 53.27 0.300 . 1 . . . . 34 ASN CA . 26818 1 139 . 1 1 19 19 ASN CB C 13 34.892 0.300 . 1 . . . . 34 ASN CB . 26818 1 140 . 1 1 19 19 ASN N N 15 120.296 0.300 . 1 . . . . 34 ASN N . 26818 1 141 . 1 1 20 20 ARG H H 1 7.869 0.030 . 1 . . . . 35 ARG H . 26818 1 142 . 1 1 20 20 ARG HA H 1 3.944 0.030 . 1 . . . . 35 ARG HA . 26818 1 143 . 1 1 20 20 ARG HB2 H 1 1.783 0.030 . 2 . . . . 35 ARG HB2 . 26818 1 144 . 1 1 20 20 ARG HB3 H 1 1.917 0.030 . 2 . . . . 35 ARG HB3 . 26818 1 145 . 1 1 20 20 ARG HG2 H 1 1.637 0.030 . 2 . . . . 35 ARG HG2 . 26818 1 146 . 1 1 20 20 ARG HG3 H 1 1.507 0.030 . 2 . . . . 35 ARG HG3 . 26818 1 147 . 1 1 20 20 ARG HD2 H 1 3.168 0.030 . 2 . . . . 35 ARG HD2 . 26818 1 148 . 1 1 20 20 ARG HD3 H 1 3.056 0.030 . 2 . . . . 35 ARG HD3 . 26818 1 149 . 1 1 20 20 ARG C C 13 177.584 0.300 . 1 . . . . 35 ARG C . 26818 1 150 . 1 1 20 20 ARG CA C 13 57.061 0.300 . 1 . . . . 35 ARG CA . 26818 1 151 . 1 1 20 20 ARG CB C 13 27.441 0.300 . 1 . . . . 35 ARG CB . 26818 1 152 . 1 1 20 20 ARG CG C 13 25.167 0.300 . 1 . . . . 35 ARG CG . 26818 1 153 . 1 1 20 20 ARG CD C 13 40.65 0.300 . 1 . . . . 35 ARG CD . 26818 1 154 . 1 1 20 20 ARG N N 15 119.948 0.300 . 1 . . . . 35 ARG N . 26818 1 155 . 1 1 21 21 LEU H H 1 7.946 0.030 . 1 . . . . 36 LEU H . 26818 1 156 . 1 1 21 21 LEU HA H 1 3.909 0.030 . 1 . . . . 36 LEU HA . 26818 1 157 . 1 1 21 21 LEU C C 13 175.185 0.300 . 1 . . . . 36 LEU C . 26818 1 158 . 1 1 21 21 LEU CA C 13 55.056 0.300 . 1 . . . . 36 LEU CA . 26818 1 159 . 1 1 21 21 LEU CB C 13 38.746 0.300 . 1 . . . . 36 LEU CB . 26818 1 160 . 1 1 21 21 LEU CG C 13 23.751 0.300 . 1 . . . . 36 LEU CG . 26818 1 161 . 1 1 21 21 LEU N N 15 122.305 0.300 . 1 . . . . 36 LEU N . 26818 1 162 . 1 1 22 22 PHE H H 1 8.863 0.030 . 1 . . . . 37 PHE H . 26818 1 163 . 1 1 22 22 PHE HA H 1 3.591 0.030 . 1 . . . . 37 PHE HA . 26818 1 164 . 1 1 22 22 PHE HB2 H 1 3.087 0.030 . 2 . . . . 37 PHE HB2 . 26818 1 165 . 1 1 22 22 PHE HB3 H 1 3.087 0.030 . 2 . . . . 37 PHE HB3 . 26818 1 166 . 1 1 22 22 PHE C C 13 177.566 0.300 . 1 . . . . 37 PHE C . 26818 1 167 . 1 1 22 22 PHE CA C 13 60.184 0.300 . 1 . . . . 37 PHE CA . 26818 1 168 . 1 1 22 22 PHE CB C 13 37.156 0.300 . 1 . . . . 37 PHE CB . 26818 1 169 . 1 1 22 22 PHE N N 15 122.15 0.300 . 1 . . . . 37 PHE N . 26818 1 170 . 1 1 23 23 VAL H H 1 8.441 0.030 . 1 . . . . 38 VAL H . 26818 1 171 . 1 1 23 23 VAL HA H 1 3.605 0.030 . 1 . . . . 38 VAL HA . 26818 1 172 . 1 1 23 23 VAL HB H 1 2.15 0.030 . 1 . . . . 38 VAL HB . 26818 1 173 . 1 1 23 23 VAL HG11 H 1 1.134 0.030 . 2 . . . . 38 VAL HG1 . 26818 1 174 . 1 1 23 23 VAL HG12 H 1 1.134 0.030 . 2 . . . . 38 VAL HG1 . 26818 1 175 . 1 1 23 23 VAL HG13 H 1 1.134 0.030 . 2 . . . . 38 VAL HG1 . 26818 1 176 . 1 1 23 23 VAL HG21 H 1 0.938 0.030 . 2 . . . . 38 VAL HG2 . 26818 1 177 . 1 1 23 23 VAL HG22 H 1 0.938 0.030 . 2 . . . . 38 VAL HG2 . 26818 1 178 . 1 1 23 23 VAL HG23 H 1 0.938 0.030 . 2 . . . . 38 VAL HG2 . 26818 1 179 . 1 1 23 23 VAL C C 13 174.871 0.300 . 1 . . . . 38 VAL C . 26818 1 180 . 1 1 23 23 VAL CA C 13 63.359 0.300 . 1 . . . . 38 VAL CA . 26818 1 181 . 1 1 23 23 VAL CB C 13 28.977 0.300 . 1 . . . . 38 VAL CB . 26818 1 182 . 1 1 23 23 VAL CG1 C 13 20.014 0.300 . 2 . . . . 38 VAL CG1 . 26818 1 183 . 1 1 23 23 VAL CG2 C 13 18.451 0.300 . 2 . . . . 38 VAL CG2 . 26818 1 184 . 1 1 23 23 VAL N N 15 122.223 0.300 . 1 . . . . 38 VAL N . 26818 1 185 . 1 1 24 24 GLY H H 1 7.335 0.030 . 1 . . . . 39 GLY H . 26818 1 186 . 1 1 24 24 GLY HA2 H 1 4 0.030 . 2 . . . . 39 GLY HA2 . 26818 1 187 . 1 1 24 24 GLY HA3 H 1 3.396 0.030 . 2 . . . . 39 GLY HA3 . 26818 1 188 . 1 1 24 24 GLY C C 13 169.836 0.300 . 1 . . . . 39 GLY C . 26818 1 189 . 1 1 24 24 GLY CA C 13 42.349 0.300 . 1 . . . . 39 GLY CA . 26818 1 190 . 1 1 24 24 GLY N N 15 106.462 0.300 . 1 . . . . 39 GLY N . 26818 1 191 . 1 1 25 25 ARG H H 1 7.526 0.030 . 1 . . . . 40 ARG H . 26818 1 192 . 1 1 25 25 ARG HA H 1 2.629 0.030 . 1 . . . . 40 ARG HA . 26818 1 193 . 1 1 25 25 ARG HB2 H 1 1.845 0.030 . 2 . . . . 40 ARG HB2 . 26818 1 194 . 1 1 25 25 ARG HB3 H 1 1.735 0.030 . 2 . . . . 40 ARG HB3 . 26818 1 195 . 1 1 25 25 ARG HG2 H 1 1.261 0.030 . 2 . . . . 40 ARG HG2 . 26818 1 196 . 1 1 25 25 ARG HG3 H 1 1.261 0.030 . 2 . . . . 40 ARG HG3 . 26818 1 197 . 1 1 25 25 ARG HD2 H 1 3.104 0.030 . 2 . . . . 40 ARG HD2 . 26818 1 198 . 1 1 25 25 ARG HD3 H 1 3.104 0.030 . 2 . . . . 40 ARG HD3 . 26818 1 199 . 1 1 25 25 ARG C C 13 172.073 0.300 . 1 . . . . 40 ARG C . 26818 1 200 . 1 1 25 25 ARG CA C 13 53.863 0.300 . 1 . . . . 40 ARG CA . 26818 1 201 . 1 1 25 25 ARG CB C 13 23.58 0.300 . 1 . . . . 40 ARG CB . 26818 1 202 . 1 1 25 25 ARG CG C 13 24.874 0.300 . 1 . . . . 40 ARG CG . 26818 1 203 . 1 1 25 25 ARG CD C 13 40.891 0.300 . 1 . . . . 40 ARG CD . 26818 1 204 . 1 1 25 25 ARG N N 15 113.579 0.300 . 1 . . . . 40 ARG N . 26818 1 205 . 1 1 26 26 LYS H H 1 7.707 0.030 . 1 . . . . 41 LYS H . 26818 1 206 . 1 1 26 26 LYS HA H 1 4.332 0.030 . 1 . . . . 41 LYS HA . 26818 1 207 . 1 1 26 26 LYS HB2 H 1 1.699 0.030 . 2 . . . . 41 LYS HB2 . 26818 1 208 . 1 1 26 26 LYS HB3 H 1 1.582 0.030 . 2 . . . . 41 LYS HB3 . 26818 1 209 . 1 1 26 26 LYS HG2 H 1 1.125 0.030 . 2 . . . . 41 LYS HG2 . 26818 1 210 . 1 1 26 26 LYS HG3 H 1 1.004 0.030 . 2 . . . . 41 LYS HG3 . 26818 1 211 . 1 1 26 26 LYS HD2 H 1 1.382 0.030 . 2 . . . . 41 LYS HD2 . 26818 1 212 . 1 1 26 26 LYS HD3 H 1 1.543 0.030 . 2 . . . . 41 LYS HD3 . 26818 1 213 . 1 1 26 26 LYS C C 13 173.489 0.300 . 1 . . . . 41 LYS C . 26818 1 214 . 1 1 26 26 LYS CA C 13 50.505 0.300 . 1 . . . . 41 LYS CA . 26818 1 215 . 1 1 26 26 LYS CB C 13 26.608 0.300 . 1 . . . . 41 LYS CB . 26818 1 216 . 1 1 26 26 LYS CG C 13 20.918 0.300 . 1 . . . . 41 LYS CG . 26818 1 217 . 1 1 26 26 LYS N N 15 121.726 0.300 . 1 . . . . 41 LYS N . 26818 1 218 . 1 1 27 27 TYR H H 1 6.948 0.030 . 1 . . . . 42 TYR H . 26818 1 219 . 1 1 27 27 TYR HB2 H 1 2.901 0.030 . 2 . . . . 42 TYR HB2 . 26818 1 220 . 1 1 27 27 TYR HB3 H 1 2.901 0.030 . 2 . . . . 42 TYR HB3 . 26818 1 221 . 1 1 27 27 TYR C C 13 171.737 0.300 . 1 . . . . 42 TYR C . 26818 1 222 . 1 1 27 27 TYR CA C 13 60.038 0.300 . 1 . . . . 42 TYR CA . 26818 1 223 . 1 1 27 27 TYR CB C 13 32.832 0.300 . 1 . . . . 42 TYR CB . 26818 1 224 . 1 1 27 27 TYR N N 15 117.789 0.300 . 1 . . . . 42 TYR N . 26818 1 225 . 1 1 28 28 PRO HA H 1 4.171 0.030 . 1 . . . . 43 PRO HA . 26818 1 226 . 1 1 28 28 PRO HB2 H 1 2.24 0.030 . 2 . . . . 43 PRO HB2 . 26818 1 227 . 1 1 28 28 PRO HB3 H 1 1.742 0.030 . 2 . . . . 43 PRO HB3 . 26818 1 228 . 1 1 28 28 PRO HG2 H 1 2.014 0.030 . 2 . . . . 43 PRO HG2 . 26818 1 229 . 1 1 28 28 PRO HG3 H 1 2.014 0.030 . 2 . . . . 43 PRO HG3 . 26818 1 230 . 1 1 28 28 PRO C C 13 177.895 0.300 . 1 . . . . 43 PRO C . 26818 1 231 . 1 1 28 28 PRO CA C 13 63.51 0.300 . 1 . . . . 43 PRO CA . 26818 1 232 . 1 1 28 28 PRO CB C 13 27.951 0.300 . 1 . . . . 43 PRO CB . 26818 1 233 . 1 1 28 28 PRO CG C 13 25.582 0.300 . 1 . . . . 43 PRO CG . 26818 1 234 . 1 1 28 28 PRO N N 15 117.801 0.300 . 1 . . . . 43 PRO N . 26818 1 235 . 1 1 29 29 GLU H H 1 8.757 0.030 . 1 . . . . 44 GLU H . 26818 1 236 . 1 1 29 29 GLU HA H 1 3.852 0.030 . 1 . . . . 44 GLU HA . 26818 1 237 . 1 1 29 29 GLU HB2 H 1 1.957 0.030 . 2 . . . . 44 GLU HB2 . 26818 1 238 . 1 1 29 29 GLU HB3 H 1 1.799 0.030 . 2 . . . . 44 GLU HB3 . 26818 1 239 . 1 1 29 29 GLU HG2 H 1 2.4 0.030 . 2 . . . . 44 GLU HG2 . 26818 1 240 . 1 1 29 29 GLU HG3 H 1 2.096 0.030 . 2 . . . . 44 GLU HG3 . 26818 1 241 . 1 1 29 29 GLU C C 13 177.112 0.300 . 1 . . . . 44 GLU C . 26818 1 242 . 1 1 29 29 GLU CA C 13 57.814 0.300 . 1 . . . . 44 GLU CA . 26818 1 243 . 1 1 29 29 GLU CB C 13 25.802 0.300 . 1 . . . . 44 GLU CB . 26818 1 244 . 1 1 29 29 GLU CG C 13 34.545 0.300 . 1 . . . . 44 GLU CG . 26818 1 245 . 1 1 29 29 GLU N N 15 120.27 0.300 . 1 . . . . 44 GLU N . 26818 1 246 . 1 1 30 30 ALA H H 1 8.708 0.030 . 1 . . . . 45 ALA H . 26818 1 247 . 1 1 30 30 ALA HA H 1 3.809 0.030 . 1 . . . . 45 ALA HA . 26818 1 248 . 1 1 30 30 ALA HB1 H 1 1.555 0.030 . 1 . . . . 45 ALA HB . 26818 1 249 . 1 1 30 30 ALA HB2 H 1 1.555 0.030 . 1 . . . . 45 ALA HB . 26818 1 250 . 1 1 30 30 ALA HB3 H 1 1.555 0.030 . 1 . . . . 45 ALA HB . 26818 1 251 . 1 1 30 30 ALA C C 13 175.629 0.300 . 1 . . . . 45 ALA C . 26818 1 252 . 1 1 30 30 ALA CA C 13 53.181 0.300 . 1 . . . . 45 ALA CA . 26818 1 253 . 1 1 30 30 ALA CB C 13 15.619 0.300 . 1 . . . . 45 ALA CB . 26818 1 254 . 1 1 30 30 ALA N N 15 124.667 0.300 . 1 . . . . 45 ALA N . 26818 1 255 . 1 1 31 31 ALA H H 1 8.725 0.030 . 1 . . . . 46 ALA H . 26818 1 256 . 1 1 31 31 ALA HA H 1 3.867 0.030 . 1 . . . . 46 ALA HA . 26818 1 257 . 1 1 31 31 ALA HB1 H 1 1.088 0.030 . 1 . . . . 46 ALA HB . 26818 1 258 . 1 1 31 31 ALA HB2 H 1 1.088 0.030 . 1 . . . . 46 ALA HB . 26818 1 259 . 1 1 31 31 ALA HB3 H 1 1.088 0.030 . 1 . . . . 46 ALA HB . 26818 1 260 . 1 1 31 31 ALA C C 13 177.536 0.300 . 1 . . . . 46 ALA C . 26818 1 261 . 1 1 31 31 ALA CA C 13 53.117 0.300 . 1 . . . . 46 ALA CA . 26818 1 262 . 1 1 31 31 ALA CB C 13 14.448 0.300 . 1 . . . . 46 ALA CB . 26818 1 263 . 1 1 31 31 ALA N N 15 120.146 0.300 . 1 . . . . 46 ALA N . 26818 1 264 . 1 1 32 32 ALA H H 1 7.729 0.030 . 1 . . . . 47 ALA H . 26818 1 265 . 1 1 32 32 ALA HA H 1 4.042 0.030 . 1 . . . . 47 ALA HA . 26818 1 266 . 1 1 32 32 ALA HB1 H 1 1.387 0.030 . 1 . . . . 47 ALA HB . 26818 1 267 . 1 1 32 32 ALA HB2 H 1 1.387 0.030 . 1 . . . . 47 ALA HB . 26818 1 268 . 1 1 32 32 ALA HB3 H 1 1.387 0.030 . 1 . . . . 47 ALA HB . 26818 1 269 . 1 1 32 32 ALA C C 13 178.108 0.300 . 1 . . . . 47 ALA C . 26818 1 270 . 1 1 32 32 ALA CA C 13 52.047 0.300 . 1 . . . . 47 ALA CA . 26818 1 271 . 1 1 32 32 ALA CB C 13 14.959 0.300 . 1 . . . . 47 ALA CB . 26818 1 272 . 1 1 32 32 ALA N N 15 120.176 0.300 . 1 . . . . 47 ALA N . 26818 1 273 . 1 1 33 33 CYS H H 1 7.524 0.030 . 1 . . . . 48 CYS H . 26818 1 274 . 1 1 33 33 CYS HA H 1 3.796 0.030 . 1 . . . . 48 CYS HA . 26818 1 275 . 1 1 33 33 CYS HB2 H 1 2.667 0.030 . 2 . . . . 48 CYS HB2 . 26818 1 276 . 1 1 33 33 CYS HB3 H 1 2.479 0.030 . 2 . . . . 48 CYS HB3 . 26818 1 277 . 1 1 33 33 CYS C C 13 174.633 0.300 . 1 . . . . 48 CYS C . 26818 1 278 . 1 1 33 33 CYS CA C 13 61.913 0.300 . 1 . . . . 48 CYS CA . 26818 1 279 . 1 1 33 33 CYS CB C 13 23.032 0.300 . 1 . . . . 48 CYS CB . 26818 1 280 . 1 1 33 33 CYS N N 15 119.297 0.300 . 1 . . . . 48 CYS N . 26818 1 281 . 1 1 34 34 TYR H H 1 8.275 0.030 . 1 . . . . 49 TYR H . 26818 1 282 . 1 1 34 34 TYR HA H 1 3.998 0.030 . 1 . . . . 49 TYR HA . 26818 1 283 . 1 1 34 34 TYR HB2 H 1 2.531 0.030 . 2 . . . . 49 TYR HB2 . 26818 1 284 . 1 1 34 34 TYR HB3 H 1 2.531 0.030 . 2 . . . . 49 TYR HB3 . 26818 1 285 . 1 1 34 34 TYR C C 13 175.531 0.300 . 1 . . . . 49 TYR C . 26818 1 286 . 1 1 34 34 TYR CA C 13 57.984 0.300 . 1 . . . . 49 TYR CA . 26818 1 287 . 1 1 34 34 TYR CB C 13 34.569 0.300 . 1 . . . . 49 TYR CB . 26818 1 288 . 1 1 34 34 TYR N N 15 117.799 0.300 . 1 . . . . 49 TYR N . 26818 1 289 . 1 1 35 35 GLY H H 1 8.495 0.030 . 1 . . . . 50 GLY H . 26818 1 290 . 1 1 35 35 GLY HA2 H 1 3.913 0.030 . 2 . . . . 50 GLY HA2 . 26818 1 291 . 1 1 35 35 GLY HA3 H 1 3.913 0.030 . 2 . . . . 50 GLY HA3 . 26818 1 292 . 1 1 35 35 GLY C C 13 173.725 0.300 . 1 . . . . 50 GLY C . 26818 1 293 . 1 1 35 35 GLY CA C 13 44.548 0.300 . 1 . . . . 50 GLY CA . 26818 1 294 . 1 1 35 35 GLY N N 15 105.618 0.300 . 1 . . . . 50 GLY N . 26818 1 295 . 1 1 36 36 ARG H H 1 7.661 0.030 . 1 . . . . 51 ARG H . 26818 1 296 . 1 1 36 36 ARG HA H 1 3.989 0.030 . 1 . . . . 51 ARG HA . 26818 1 297 . 1 1 36 36 ARG HB2 H 1 1.881 0.030 . 2 . . . . 51 ARG HB2 . 26818 1 298 . 1 1 36 36 ARG HB3 H 1 1.881 0.030 . 2 . . . . 51 ARG HB3 . 26818 1 299 . 1 1 36 36 ARG HG2 H 1 1.503 0.030 . 2 . . . . 51 ARG HG2 . 26818 1 300 . 1 1 36 36 ARG HG3 H 1 1.503 0.030 . 2 . . . . 51 ARG HG3 . 26818 1 301 . 1 1 36 36 ARG C C 13 176.284 0.300 . 1 . . . . 51 ARG C . 26818 1 302 . 1 1 36 36 ARG CA C 13 56.74 0.300 . 1 . . . . 51 ARG CA . 26818 1 303 . 1 1 36 36 ARG CB C 13 28.122 0.300 . 1 . . . . 51 ARG CB . 26818 1 304 . 1 1 36 36 ARG CG C 13 25.167 0.300 . 1 . . . . 51 ARG CG . 26818 1 305 . 1 1 36 36 ARG CD C 13 33.544 0.300 . 1 . . . . 51 ARG CD . 26818 1 306 . 1 1 36 36 ARG N N 15 122.685 0.300 . 1 . . . . 51 ARG N . 26818 1 307 . 1 1 37 37 ALA H H 1 7.74 0.030 . 1 . . . . 52 ALA H . 26818 1 308 . 1 1 37 37 ALA HA H 1 3.557 0.030 . 1 . . . . 52 ALA HA . 26818 1 309 . 1 1 37 37 ALA HB1 H 1 0.705 0.030 . 1 . . . . 52 ALA HB . 26818 1 310 . 1 1 37 37 ALA HB2 H 1 0.705 0.030 . 1 . . . . 52 ALA HB . 26818 1 311 . 1 1 37 37 ALA HB3 H 1 0.705 0.030 . 1 . . . . 52 ALA HB . 26818 1 312 . 1 1 37 37 ALA C C 13 175.419 0.300 . 1 . . . . 52 ALA C . 26818 1 313 . 1 1 37 37 ALA CA C 13 53.061 0.300 . 1 . . . . 52 ALA CA . 26818 1 314 . 1 1 37 37 ALA CB C 13 13.185 0.300 . 1 . . . . 52 ALA CB . 26818 1 315 . 1 1 37 37 ALA N N 15 125.21 0.300 . 1 . . . . 52 ALA N . 26818 1 316 . 1 1 38 38 ILE H H 1 7.98 0.030 . 1 . . . . 53 ILE H . 26818 1 317 . 1 1 38 38 ILE HA H 1 3.511 0.030 . 1 . . . . 53 ILE HA . 26818 1 318 . 1 1 38 38 ILE HB H 1 1.651 0.030 . 1 . . . . 53 ILE HB . 26818 1 319 . 1 1 38 38 ILE HG21 H 1 0.737 0.030 . 1 . . . . 53 ILE HG2 . 26818 1 320 . 1 1 38 38 ILE HG22 H 1 0.737 0.030 . 1 . . . . 53 ILE HG2 . 26818 1 321 . 1 1 38 38 ILE HG23 H 1 0.737 0.030 . 1 . . . . 53 ILE HG2 . 26818 1 322 . 1 1 38 38 ILE C C 13 174.199 0.300 . 1 . . . . 53 ILE C . 26818 1 323 . 1 1 38 38 ILE CA C 13 62.234 0.300 . 1 . . . . 53 ILE CA . 26818 1 324 . 1 1 38 38 ILE CB C 13 35.711 0.300 . 1 . . . . 53 ILE CB . 26818 1 325 . 1 1 38 38 ILE N N 15 119.483 0.300 . 1 . . . . 53 ILE N . 26818 1 326 . 1 1 39 39 THR H H 1 7.611 0.030 . 1 . . . . 54 THR H . 26818 1 327 . 1 1 39 39 THR HA H 1 3.785 0.030 . 1 . . . . 54 THR HA . 26818 1 328 . 1 1 39 39 THR HB H 1 4.073 0.030 . 1 . . . . 54 THR HB . 26818 1 329 . 1 1 39 39 THR HG21 H 1 1.15 0.030 . 1 . . . . 54 THR HG2 . 26818 1 330 . 1 1 39 39 THR HG22 H 1 1.15 0.030 . 1 . . . . 54 THR HG2 . 26818 1 331 . 1 1 39 39 THR HG23 H 1 1.15 0.030 . 1 . . . . 54 THR HG2 . 26818 1 332 . 1 1 39 39 THR C C 13 173.753 0.300 . 1 . . . . 54 THR C . 26818 1 333 . 1 1 39 39 THR CA C 13 63.391 0.300 . 1 . . . . 54 THR CA . 26818 1 334 . 1 1 39 39 THR CB C 13 66.122 0.300 . 1 . . . . 54 THR CB . 26818 1 335 . 1 1 39 39 THR CG2 C 13 19.159 0.300 . 1 . . . . 54 THR CG2 . 26818 1 336 . 1 1 39 39 THR N N 15 112.259 0.300 . 1 . . . . 54 THR N . 26818 1 337 . 1 1 40 40 ARG H H 1 7.207 0.030 . 1 . . . . 55 ARG H . 26818 1 338 . 1 1 40 40 ARG HA H 1 4.067 0.030 . 1 . . . . 55 ARG HA . 26818 1 339 . 1 1 40 40 ARG HB2 H 1 1.917 0.030 . 2 . . . . 55 ARG HB2 . 26818 1 340 . 1 1 40 40 ARG HB3 H 1 1.814 0.030 . 2 . . . . 55 ARG HB3 . 26818 1 341 . 1 1 40 40 ARG HD2 H 1 3.058 0.030 . 2 . . . . 55 ARG HD2 . 26818 1 342 . 1 1 40 40 ARG HD3 H 1 3.058 0.030 . 2 . . . . 55 ARG HD3 . 26818 1 343 . 1 1 40 40 ARG C C 13 174.352 0.300 . 1 . . . . 55 ARG C . 26818 1 344 . 1 1 40 40 ARG CA C 13 54.829 0.300 . 1 . . . . 55 ARG CA . 26818 1 345 . 1 1 40 40 ARG CB C 13 27.421 0.300 . 1 . . . . 55 ARG CB . 26818 1 346 . 1 1 40 40 ARG CG C 13 33.629 0.300 . 1 . . . . 55 ARG CG . 26818 1 347 . 1 1 40 40 ARG CD C 13 40.838 0.300 . 1 . . . . 55 ARG CD . 26818 1 348 . 1 1 40 40 ARG N N 15 118.823 0.300 . 1 . . . . 55 ARG N . 26818 1 349 . 1 1 41 41 ASN H H 1 8.278 0.030 . 1 . . . . 56 ASN H . 26818 1 350 . 1 1 41 41 ASN HA H 1 4.972 0.030 . 1 . . . . 56 ASN HA . 26818 1 351 . 1 1 41 41 ASN HB2 H 1 3.1 0.030 . 2 . . . . 56 ASN HB2 . 26818 1 352 . 1 1 41 41 ASN HB3 H 1 2.669 0.030 . 2 . . . . 56 ASN HB3 . 26818 1 353 . 1 1 41 41 ASN C C 13 175.794 0.300 . 1 . . . . 56 ASN C . 26818 1 354 . 1 1 41 41 ASN CA C 13 48.491 0.300 . 1 . . . . 56 ASN CA . 26818 1 355 . 1 1 41 41 ASN CB C 13 36.771 0.300 . 1 . . . . 56 ASN CB . 26818 1 356 . 1 1 41 41 ASN N N 15 115.738 0.300 . 1 . . . . 56 ASN N . 26818 1 357 . 1 1 42 42 PRO HA H 1 4.929 0.030 . 1 . . . . 57 PRO HA . 26818 1 358 . 1 1 42 42 PRO HB2 H 1 2.377 0.030 . 2 . . . . 57 PRO HB2 . 26818 1 359 . 1 1 42 42 PRO HB3 H 1 2.075 0.030 . 2 . . . . 57 PRO HB3 . 26818 1 360 . 1 1 42 42 PRO C C 13 175.867 0.300 . 1 . . . . 57 PRO C . 26818 1 361 . 1 1 42 42 PRO CA C 13 61.497 0.300 . 1 . . . . 57 PRO CA . 26818 1 362 . 1 1 42 42 PRO CB C 13 29.384 0.300 . 1 . . . . 57 PRO CB . 26818 1 363 . 1 1 42 42 PRO CG C 13 23.787 0.300 . 1 . . . . 57 PRO CG . 26818 1 364 . 1 1 42 42 PRO N N 15 115.741 0.300 . 1 . . . . 57 PRO N . 26818 1 365 . 1 1 43 43 LEU H H 1 7.756 0.030 . 1 . . . . 58 LEU H . 26818 1 366 . 1 1 43 43 LEU HA H 1 4.625 0.030 . 1 . . . . 58 LEU HA . 26818 1 367 . 1 1 43 43 LEU HB2 H 1 1.699 0.030 . 2 . . . . 58 LEU HB2 . 26818 1 368 . 1 1 43 43 LEU HB3 H 1 1.449 0.030 . 2 . . . . 58 LEU HB3 . 26818 1 369 . 1 1 43 43 LEU HD11 H 1 0.872 0.030 . 2 . . . . 58 LEU HD1 . 26818 1 370 . 1 1 43 43 LEU HD12 H 1 0.872 0.030 . 2 . . . . 58 LEU HD1 . 26818 1 371 . 1 1 43 43 LEU HD13 H 1 0.872 0.030 . 2 . . . . 58 LEU HD1 . 26818 1 372 . 1 1 43 43 LEU HD21 H 1 0.712 0.030 . 2 . . . . 58 LEU HD2 . 26818 1 373 . 1 1 43 43 LEU HD22 H 1 0.712 0.030 . 2 . . . . 58 LEU HD2 . 26818 1 374 . 1 1 43 43 LEU HD23 H 1 0.712 0.030 . 2 . . . . 58 LEU HD2 . 26818 1 375 . 1 1 43 43 LEU C C 13 173.257 0.300 . 1 . . . . 58 LEU C . 26818 1 376 . 1 1 43 43 LEU CA C 13 51.635 0.300 . 1 . . . . 58 LEU CA . 26818 1 377 . 1 1 43 43 LEU CB C 13 38.147 0.300 . 1 . . . . 58 LEU CB . 26818 1 378 . 1 1 43 43 LEU CD1 C 13 22.549 0.300 . 2 . . . . 58 LEU CD1 . 26818 1 379 . 1 1 43 43 LEU CD2 C 13 19.665 0.300 . 2 . . . . 58 LEU CD2 . 26818 1 380 . 1 1 43 43 LEU N N 15 119.745 0.300 . 1 . . . . 58 LEU N . 26818 1 381 . 1 1 44 44 VAL H H 1 7.583 0.030 . 1 . . . . 59 VAL H . 26818 1 382 . 1 1 44 44 VAL HA H 1 3.937 0.030 . 1 . . . . 59 VAL HA . 26818 1 383 . 1 1 44 44 VAL HB H 1 1.19 0.030 . 1 . . . . 59 VAL HB . 26818 1 384 . 1 1 44 44 VAL HG11 H 1 0.578 0.030 . 2 . . . . 59 VAL HG1 . 26818 1 385 . 1 1 44 44 VAL HG12 H 1 0.578 0.030 . 2 . . . . 59 VAL HG1 . 26818 1 386 . 1 1 44 44 VAL HG13 H 1 0.578 0.030 . 2 . . . . 59 VAL HG1 . 26818 1 387 . 1 1 44 44 VAL HG21 H 1 0.264 0.030 . 2 . . . . 59 VAL HG2 . 26818 1 388 . 1 1 44 44 VAL HG22 H 1 0.264 0.030 . 2 . . . . 59 VAL HG2 . 26818 1 389 . 1 1 44 44 VAL HG23 H 1 0.264 0.030 . 2 . . . . 59 VAL HG2 . 26818 1 390 . 1 1 44 44 VAL C C 13 173.286 0.300 . 1 . . . . 59 VAL C . 26818 1 391 . 1 1 44 44 VAL CA C 13 59.321 0.300 . 1 . . . . 59 VAL CA . 26818 1 392 . 1 1 44 44 VAL CB C 13 29.265 0.300 . 1 . . . . 59 VAL CB . 26818 1 393 . 1 1 44 44 VAL CG1 C 13 19.043 0.300 . 2 . . . . 59 VAL CG1 . 26818 1 394 . 1 1 44 44 VAL CG2 C 13 17.609 0.300 . 2 . . . . 59 VAL CG2 . 26818 1 395 . 1 1 44 44 VAL N N 15 121.733 0.300 . 1 . . . . 59 VAL N . 26818 1 396 . 1 1 45 45 ALA H H 1 8.637 0.030 . 1 . . . . 60 ALA H . 26818 1 397 . 1 1 45 45 ALA HA H 1 3.958 0.030 . 1 . . . . 60 ALA HA . 26818 1 398 . 1 1 45 45 ALA HB1 H 1 1.48 0.030 . 1 . . . . 60 ALA HB . 26818 1 399 . 1 1 45 45 ALA HB2 H 1 1.48 0.030 . 1 . . . . 60 ALA HB . 26818 1 400 . 1 1 45 45 ALA HB3 H 1 1.48 0.030 . 1 . . . . 60 ALA HB . 26818 1 401 . 1 1 45 45 ALA C C 13 177.104 0.300 . 1 . . . . 60 ALA C . 26818 1 402 . 1 1 45 45 ALA CA C 13 53.474 0.300 . 1 . . . . 60 ALA CA . 26818 1 403 . 1 1 45 45 ALA CB C 13 16.84 0.300 . 1 . . . . 60 ALA CB . 26818 1 404 . 1 1 45 45 ALA N N 15 130.987 0.300 . 1 . . . . 60 ALA N . 26818 1 405 . 1 1 46 46 VAL H H 1 8.002 0.030 . 1 . . . . 61 VAL H . 26818 1 406 . 1 1 46 46 VAL HA H 1 3.928 0.030 . 1 . . . . 61 VAL HA . 26818 1 407 . 1 1 46 46 VAL HB H 1 1.897 0.030 . 1 . . . . 61 VAL HB . 26818 1 408 . 1 1 46 46 VAL HG11 H 1 0.896 0.030 . 2 . . . . 61 VAL HG1 . 26818 1 409 . 1 1 46 46 VAL HG12 H 1 0.896 0.030 . 2 . . . . 61 VAL HG1 . 26818 1 410 . 1 1 46 46 VAL HG13 H 1 0.896 0.030 . 2 . . . . 61 VAL HG1 . 26818 1 411 . 1 1 46 46 VAL HG21 H 1 0.677 0.030 . 2 . . . . 61 VAL HG2 . 26818 1 412 . 1 1 46 46 VAL HG22 H 1 0.677 0.030 . 2 . . . . 61 VAL HG2 . 26818 1 413 . 1 1 46 46 VAL HG23 H 1 0.677 0.030 . 2 . . . . 61 VAL HG2 . 26818 1 414 . 1 1 46 46 VAL C C 13 173.765 0.300 . 1 . . . . 61 VAL C . 26818 1 415 . 1 1 46 46 VAL CA C 13 61.755 0.300 . 1 . . . . 61 VAL CA . 26818 1 416 . 1 1 46 46 VAL CB C 13 28.906 0.300 . 1 . . . . 61 VAL CB . 26818 1 417 . 1 1 46 46 VAL CG1 C 13 19.679 0.300 . 2 . . . . 61 VAL CG1 . 26818 1 418 . 1 1 46 46 VAL CG2 C 13 17.66 0.300 . 2 . . . . 61 VAL CG2 . 26818 1 419 . 1 1 46 46 VAL N N 15 113.297 0.300 . 1 . . . . 61 VAL N . 26818 1 420 . 1 1 47 47 TYR H H 1 6.736 0.030 . 1 . . . . 62 TYR H . 26818 1 421 . 1 1 47 47 TYR HA H 1 4.104 0.030 . 1 . . . . 62 TYR HA . 26818 1 422 . 1 1 47 47 TYR HB2 H 1 2.915 0.030 . 2 . . . . 62 TYR HB2 . 26818 1 423 . 1 1 47 47 TYR HB3 H 1 2.627 0.030 . 2 . . . . 62 TYR HB3 . 26818 1 424 . 1 1 47 47 TYR C C 13 175.1 0.300 . 1 . . . . 62 TYR C . 26818 1 425 . 1 1 47 47 TYR CA C 13 55.507 0.300 . 1 . . . . 62 TYR CA . 26818 1 426 . 1 1 47 47 TYR CB C 13 33.96 0.300 . 1 . . . . 62 TYR CB . 26818 1 427 . 1 1 47 47 TYR N N 15 118.289 0.300 . 1 . . . . 62 TYR N . 26818 1 428 . 1 1 48 48 TYR H H 1 7.05 0.030 . 1 . . . . 63 TYR H . 26818 1 429 . 1 1 48 48 TYR HA H 1 3.89 0.030 . 1 . . . . 63 TYR HA . 26818 1 430 . 1 1 48 48 TYR HB2 H 1 3.284 0.030 . 2 . . . . 63 TYR HB2 . 26818 1 431 . 1 1 48 48 TYR HB3 H 1 2.923 0.030 . 2 . . . . 63 TYR HB3 . 26818 1 432 . 1 1 48 48 TYR C C 13 175.645 0.300 . 1 . . . . 63 TYR C . 26818 1 433 . 1 1 48 48 TYR CA C 13 59.024 0.300 . 1 . . . . 63 TYR CA . 26818 1 434 . 1 1 48 48 TYR CB C 13 35.491 0.300 . 1 . . . . 63 TYR CB . 26818 1 435 . 1 1 48 48 TYR N N 15 115.609 0.300 . 1 . . . . 63 TYR N . 26818 1 436 . 1 1 49 49 THR H H 1 7.922 0.030 . 1 . . . . 64 THR H . 26818 1 437 . 1 1 49 49 THR HA H 1 3.612 0.030 . 1 . . . . 64 THR HA . 26818 1 438 . 1 1 49 49 THR HB H 1 4.042 0.030 . 1 . . . . 64 THR HB . 26818 1 439 . 1 1 49 49 THR HG21 H 1 0.922 0.030 . 1 . . . . 64 THR HG2 . 26818 1 440 . 1 1 49 49 THR HG22 H 1 0.922 0.030 . 1 . . . . 64 THR HG2 . 26818 1 441 . 1 1 49 49 THR HG23 H 1 0.922 0.030 . 1 . . . . 64 THR HG2 . 26818 1 442 . 1 1 49 49 THR C C 13 172.866 0.300 . 1 . . . . 64 THR C . 26818 1 443 . 1 1 49 49 THR CA C 13 63.609 0.300 . 1 . . . . 64 THR CA . 26818 1 444 . 1 1 49 49 THR CB C 13 64.615 0.300 . 1 . . . . 64 THR CB . 26818 1 445 . 1 1 49 49 THR N N 15 114.717 0.300 . 1 . . . . 64 THR N . 26818 1 446 . 1 1 50 50 ASN H H 1 7.996 0.030 . 1 . . . . 65 ASN H . 26818 1 447 . 1 1 50 50 ASN HA H 1 3.9 0.030 . 1 . . . . 65 ASN HA . 26818 1 448 . 1 1 50 50 ASN C C 13 175.145 0.300 . 1 . . . . 65 ASN C . 26818 1 449 . 1 1 50 50 ASN CA C 13 52.41 0.300 . 1 . . . . 65 ASN CA . 26818 1 450 . 1 1 50 50 ASN CB C 13 32.496 0.300 . 1 . . . . 65 ASN CB . 26818 1 451 . 1 1 50 50 ASN N N 15 118.704 0.300 . 1 . . . . 65 ASN N . 26818 1 452 . 1 1 51 51 ARG H H 1 7.616 0.030 . 1 . . . . 66 ARG H . 26818 1 453 . 1 1 51 51 ARG HA H 1 3.617 0.030 . 1 . . . . 66 ARG HA . 26818 1 454 . 1 1 51 51 ARG HB2 H 1 1.339 0.030 . 2 . . . . 66 ARG HB2 . 26818 1 455 . 1 1 51 51 ARG HB3 H 1 1.339 0.030 . 2 . . . . 66 ARG HB3 . 26818 1 456 . 1 1 51 51 ARG C C 13 175.078 0.300 . 1 . . . . 66 ARG C . 26818 1 457 . 1 1 51 51 ARG CA C 13 59.139 0.300 . 1 . . . . 66 ARG CA . 26818 1 458 . 1 1 51 51 ARG CB C 13 27.467 0.300 . 1 . . . . 66 ARG CB . 26818 1 459 . 1 1 51 51 ARG CG C 13 30.289 0.300 . 1 . . . . 66 ARG CG . 26818 1 460 . 1 1 51 51 ARG N N 15 122.466 0.300 . 1 . . . . 66 ARG N . 26818 1 461 . 1 1 52 52 ALA H H 1 8.802 0.030 . 1 . . . . 67 ALA H . 26818 1 462 . 1 1 52 52 ALA HA H 1 4.037 0.030 . 1 . . . . 67 ALA HA . 26818 1 463 . 1 1 52 52 ALA HB1 H 1 1.649 0.030 . 1 . . . . 67 ALA HB . 26818 1 464 . 1 1 52 52 ALA HB2 H 1 1.649 0.030 . 1 . . . . 67 ALA HB . 26818 1 465 . 1 1 52 52 ALA HB3 H 1 1.649 0.030 . 1 . . . . 67 ALA HB . 26818 1 466 . 1 1 52 52 ALA C C 13 176.876 0.300 . 1 . . . . 67 ALA C . 26818 1 467 . 1 1 52 52 ALA CA C 13 53.275 0.300 . 1 . . . . 67 ALA CA . 26818 1 468 . 1 1 52 52 ALA CB C 13 16.994 0.300 . 1 . . . . 67 ALA CB . 26818 1 469 . 1 1 52 52 ALA N N 15 121.992 0.300 . 1 . . . . 67 ALA N . 26818 1 470 . 1 1 53 53 LEU H H 1 7.222 0.030 . 1 . . . . 68 LEU H . 26818 1 471 . 1 1 53 53 LEU HA H 1 3.512 0.030 . 1 . . . . 68 LEU HA . 26818 1 472 . 1 1 53 53 LEU HB2 H 1 1.383 0.030 . 2 . . . . 68 LEU HB2 . 26818 1 473 . 1 1 53 53 LEU HB3 H 1 1.227 0.030 . 2 . . . . 68 LEU HB3 . 26818 1 474 . 1 1 53 53 LEU HD11 H 1 0.311 0.030 . 2 . . . . 68 LEU HD1 . 26818 1 475 . 1 1 53 53 LEU HD12 H 1 0.311 0.030 . 2 . . . . 68 LEU HD1 . 26818 1 476 . 1 1 53 53 LEU HD13 H 1 0.311 0.030 . 2 . . . . 68 LEU HD1 . 26818 1 477 . 1 1 53 53 LEU HD21 H 1 0.896 0.030 . 2 . . . . 68 LEU HD2 . 26818 1 478 . 1 1 53 53 LEU HD22 H 1 0.896 0.030 . 2 . . . . 68 LEU HD2 . 26818 1 479 . 1 1 53 53 LEU HD23 H 1 0.896 0.030 . 2 . . . . 68 LEU HD2 . 26818 1 480 . 1 1 53 53 LEU C C 13 176.423 0.300 . 1 . . . . 68 LEU C . 26818 1 481 . 1 1 53 53 LEU CA C 13 54.653 0.300 . 1 . . . . 68 LEU CA . 26818 1 482 . 1 1 53 53 LEU CB C 13 37.671 0.300 . 1 . . . . 68 LEU CB . 26818 1 483 . 1 1 53 53 LEU N N 15 116.031 0.300 . 1 . . . . 68 LEU N . 26818 1 484 . 1 1 54 54 CYS H H 1 7.075 0.030 . 1 . . . . 69 CYS H . 26818 1 485 . 1 1 54 54 CYS HA H 1 3.803 0.030 . 1 . . . . 69 CYS HA . 26818 1 486 . 1 1 54 54 CYS HB2 H 1 3.323 0.030 . 2 . . . . 69 CYS HB2 . 26818 1 487 . 1 1 54 54 CYS HB3 H 1 2.556 0.030 . 2 . . . . 69 CYS HB3 . 26818 1 488 . 1 1 54 54 CYS C C 13 173.637 0.300 . 1 . . . . 69 CYS C . 26818 1 489 . 1 1 54 54 CYS CA C 13 61.466 0.300 . 1 . . . . 69 CYS CA . 26818 1 490 . 1 1 54 54 CYS CB C 13 24.11 0.300 . 1 . . . . 69 CYS CB . 26818 1 491 . 1 1 54 54 CYS N N 15 116.07 0.300 . 1 . . . . 69 CYS N . 26818 1 492 . 1 1 55 55 TYR H H 1 7.911 0.030 . 1 . . . . 70 TYR H . 26818 1 493 . 1 1 55 55 TYR HA H 1 4.334 0.030 . 1 . . . . 70 TYR HA . 26818 1 494 . 1 1 55 55 TYR HB2 H 1 2.726 0.030 . 2 . . . . 70 TYR HB2 . 26818 1 495 . 1 1 55 55 TYR HB3 H 1 2.726 0.030 . 2 . . . . 70 TYR HB3 . 26818 1 496 . 1 1 55 55 TYR C C 13 176.376 0.300 . 1 . . . . 70 TYR C . 26818 1 497 . 1 1 55 55 TYR CA C 13 57.365 0.300 . 1 . . . . 70 TYR CA . 26818 1 498 . 1 1 55 55 TYR CB C 13 33.958 0.300 . 1 . . . . 70 TYR CB . 26818 1 499 . 1 1 55 55 TYR N N 15 117.934 0.300 . 1 . . . . 70 TYR N . 26818 1 500 . 1 1 56 56 LEU H H 1 8.815 0.030 . 1 . . . . 71 LEU H . 26818 1 501 . 1 1 56 56 LEU HA H 1 3.602 0.030 . 1 . . . . 71 LEU HA . 26818 1 502 . 1 1 56 56 LEU HB2 H 1 1.6 0.030 . 2 . . . . 71 LEU HB2 . 26818 1 503 . 1 1 56 56 LEU HB3 H 1 1.476 0.030 . 2 . . . . 71 LEU HB3 . 26818 1 504 . 1 1 56 56 LEU HG H 1 1.411 0.030 . 1 . . . . 71 LEU HG . 26818 1 505 . 1 1 56 56 LEU HD11 H 1 0.65 0.030 . 2 . . . . 71 LEU HD1 . 26818 1 506 . 1 1 56 56 LEU HD12 H 1 0.65 0.030 . 2 . . . . 71 LEU HD1 . 26818 1 507 . 1 1 56 56 LEU HD13 H 1 0.65 0.030 . 2 . . . . 71 LEU HD1 . 26818 1 508 . 1 1 56 56 LEU HD21 H 1 0.65 0.030 . 2 . . . . 71 LEU HD2 . 26818 1 509 . 1 1 56 56 LEU HD22 H 1 0.65 0.030 . 2 . . . . 71 LEU HD2 . 26818 1 510 . 1 1 56 56 LEU HD23 H 1 0.65 0.030 . 2 . . . . 71 LEU HD2 . 26818 1 511 . 1 1 56 56 LEU C C 13 178.318 0.300 . 1 . . . . 71 LEU C . 26818 1 512 . 1 1 56 56 LEU CA C 13 56.054 0.300 . 1 . . . . 71 LEU CA . 26818 1 513 . 1 1 56 56 LEU CB C 13 38.781 0.300 . 1 . . . . 71 LEU CB . 26818 1 514 . 1 1 56 56 LEU CG C 13 24.277 0.300 . 1 . . . . 71 LEU CG . 26818 1 515 . 1 1 56 56 LEU CD1 C 13 21.529 0.300 . 2 . . . . 71 LEU CD1 . 26818 1 516 . 1 1 56 56 LEU CD2 C 13 21.529 0.300 . 2 . . . . 71 LEU CD2 . 26818 1 517 . 1 1 56 56 LEU N N 15 122.823 0.300 . 1 . . . . 71 LEU N . 26818 1 518 . 1 1 57 57 LYS H H 1 7.799 0.030 . 1 . . . . 72 LYS H . 26818 1 519 . 1 1 57 57 LYS HA H 1 3.788 0.030 . 1 . . . . 72 LYS HA . 26818 1 520 . 1 1 57 57 LYS HB2 H 1 1.202 0.030 . 2 . . . . 72 LYS HB2 . 26818 1 521 . 1 1 57 57 LYS HB3 H 1 0.778 0.030 . 2 . . . . 72 LYS HB3 . 26818 1 522 . 1 1 57 57 LYS HG2 H 1 1.366 0.030 . 2 . . . . 72 LYS HG2 . 26818 1 523 . 1 1 57 57 LYS HG3 H 1 1.475 0.030 . 2 . . . . 72 LYS HG3 . 26818 1 524 . 1 1 57 57 LYS HD2 H 1 1.814 0.030 . 2 . . . . 72 LYS HD2 . 26818 1 525 . 1 1 57 57 LYS HD3 H 1 1.945 0.030 . 2 . . . . 72 LYS HD3 . 26818 1 526 . 1 1 57 57 LYS HE2 H 1 3.122 0.030 . 2 . . . . 72 LYS HE2 . 26818 1 527 . 1 1 57 57 LYS HE3 H 1 3.122 0.030 . 2 . . . . 72 LYS HE3 . 26818 1 528 . 1 1 57 57 LYS C C 13 175.685 0.300 . 1 . . . . 72 LYS C . 26818 1 529 . 1 1 57 57 LYS CA C 13 54.293 0.300 . 1 . . . . 72 LYS CA . 26818 1 530 . 1 1 57 57 LYS CB C 13 27.488 0.300 . 1 . . . . 72 LYS CB . 26818 1 531 . 1 1 57 57 LYS CG C 13 21.782 0.300 . 1 . . . . 72 LYS CG . 26818 1 532 . 1 1 57 57 LYS CD C 13 24.897 0.300 . 1 . . . . 72 LYS CD . 26818 1 533 . 1 1 57 57 LYS N N 15 119.785 0.300 . 1 . . . . 72 LYS N . 26818 1 534 . 1 1 58 58 MET H H 1 7.34 0.030 . 1 . . . . 73 MET H . 26818 1 535 . 1 1 58 58 MET HA H 1 4.216 0.030 . 1 . . . . 73 MET HA . 26818 1 536 . 1 1 58 58 MET HB2 H 1 2.504 0.030 . 2 . . . . 73 MET HB2 . 26818 1 537 . 1 1 58 58 MET HB3 H 1 1.913 0.030 . 2 . . . . 73 MET HB3 . 26818 1 538 . 1 1 58 58 MET C C 13 171.639 0.300 . 1 . . . . 73 MET C . 26818 1 539 . 1 1 58 58 MET CA C 13 53.182 0.300 . 1 . . . . 73 MET CA . 26818 1 540 . 1 1 58 58 MET CB C 13 31.851 0.300 . 1 . . . . 73 MET CB . 26818 1 541 . 1 1 58 58 MET N N 15 116.383 0.300 . 1 . . . . 73 MET N . 26818 1 542 . 1 1 59 59 GLN H H 1 7.747 0.030 . 1 . . . . 74 GLN H . 26818 1 543 . 1 1 59 59 GLN HA H 1 3.192 0.030 . 1 . . . . 74 GLN HA . 26818 1 544 . 1 1 59 59 GLN HB2 H 1 2.262 0.030 . 2 . . . . 74 GLN HB2 . 26818 1 545 . 1 1 59 59 GLN HB3 H 1 2.184 0.030 . 2 . . . . 74 GLN HB3 . 26818 1 546 . 1 1 59 59 GLN C C 13 171.697 0.300 . 1 . . . . 74 GLN C . 26818 1 547 . 1 1 59 59 GLN CA C 13 54.569 0.300 . 1 . . . . 74 GLN CA . 26818 1 548 . 1 1 59 59 GLN CB C 13 22.767 0.300 . 1 . . . . 74 GLN CB . 26818 1 549 . 1 1 59 59 GLN CG C 13 31.751 0.300 . 1 . . . . 74 GLN CG . 26818 1 550 . 1 1 59 59 GLN N N 15 113.449 0.300 . 1 . . . . 74 GLN N . 26818 1 551 . 1 1 60 60 GLN H H 1 8.188 0.030 . 1 . . . . 75 GLN H . 26818 1 552 . 1 1 60 60 GLN HA H 1 4.502 0.030 . 1 . . . . 75 GLN HA . 26818 1 553 . 1 1 60 60 GLN HB2 H 1 2.026 0.030 . 2 . . . . 75 GLN HB2 . 26818 1 554 . 1 1 60 60 GLN HB3 H 1 1.613 0.030 . 2 . . . . 75 GLN HB3 . 26818 1 555 . 1 1 60 60 GLN HG2 H 1 2.171 0.030 . 2 . . . . 75 GLN HG2 . 26818 1 556 . 1 1 60 60 GLN HG3 H 1 2.171 0.030 . 2 . . . . 75 GLN HG3 . 26818 1 557 . 1 1 60 60 GLN C C 13 173.754 0.300 . 1 . . . . 75 GLN C . 26818 1 558 . 1 1 60 60 GLN CA C 13 50.461 0.300 . 1 . . . . 75 GLN CA . 26818 1 559 . 1 1 60 60 GLN CB C 13 23.583 0.300 . 1 . . . . 75 GLN CB . 26818 1 560 . 1 1 60 60 GLN CG C 13 36.019 0.300 . 1 . . . . 75 GLN CG . 26818 1 561 . 1 1 60 60 GLN N N 15 119.594 0.300 . 1 . . . . 75 GLN N . 26818 1 562 . 1 1 61 61 HIS H H 1 7.154 0.030 . 1 . . . . 76 HIS H . 26818 1 563 . 1 1 61 61 HIS HA H 1 3.717 0.030 . 1 . . . . 76 HIS HA . 26818 1 564 . 1 1 61 61 HIS HB2 H 1 2.79 0.030 . 2 . . . . 76 HIS HB2 . 26818 1 565 . 1 1 61 61 HIS HB3 H 1 3.215 0.030 . 2 . . . . 76 HIS HB3 . 26818 1 566 . 1 1 61 61 HIS C C 13 174.16 0.300 . 1 . . . . 76 HIS C . 26818 1 567 . 1 1 61 61 HIS CA C 13 59.493 0.300 . 1 . . . . 76 HIS CA . 26818 1 568 . 1 1 61 61 HIS CB C 13 27.781 0.300 . 1 . . . . 76 HIS CB . 26818 1 569 . 1 1 61 61 HIS N N 15 118.767 0.300 . 1 . . . . 76 HIS N . 26818 1 570 . 1 1 62 62 GLU H H 1 8.869 0.030 . 1 . . . . 77 GLU H . 26818 1 571 . 1 1 62 62 GLU HA H 1 3.75 0.030 . 1 . . . . 77 GLU HA . 26818 1 572 . 1 1 62 62 GLU HB2 H 1 1.852 0.030 . 2 . . . . 77 GLU HB2 . 26818 1 573 . 1 1 62 62 GLU HB3 H 1 1.814 0.030 . 2 . . . . 77 GLU HB3 . 26818 1 574 . 1 1 62 62 GLU HG2 H 1 2.172 0.030 . 2 . . . . 77 GLU HG2 . 26818 1 575 . 1 1 62 62 GLU HG3 H 1 2.127 0.030 . 2 . . . . 77 GLU HG3 . 26818 1 576 . 1 1 62 62 GLU C C 13 176.879 0.300 . 1 . . . . 77 GLU C . 26818 1 577 . 1 1 62 62 GLU CA C 13 57.783 0.300 . 1 . . . . 77 GLU CA . 26818 1 578 . 1 1 62 62 GLU CB C 13 25.931 0.300 . 1 . . . . 77 GLU CB . 26818 1 579 . 1 1 62 62 GLU CG C 13 33.87 0.300 . 1 . . . . 77 GLU CG . 26818 1 580 . 1 1 62 62 GLU N N 15 118.148 0.300 . 1 . . . . 77 GLU N . 26818 1 581 . 1 1 63 63 GLN H H 1 7.698 0.030 . 1 . . . . 78 GLN H . 26818 1 582 . 1 1 63 63 GLN HA H 1 3.723 0.030 . 1 . . . . 78 GLN HA . 26818 1 583 . 1 1 63 63 GLN HB2 H 1 0.732 0.030 . 2 . . . . 78 GLN HB2 . 26818 1 584 . 1 1 63 63 GLN HB3 H 1 1.087 0.030 . 2 . . . . 78 GLN HB3 . 26818 1 585 . 1 1 63 63 GLN HG2 H 1 1.887 0.030 . 2 . . . . 78 GLN HG2 . 26818 1 586 . 1 1 63 63 GLN HG3 H 1 1.819 0.030 . 2 . . . . 78 GLN HG3 . 26818 1 587 . 1 1 63 63 GLN C C 13 175.832 0.300 . 1 . . . . 78 GLN C . 26818 1 588 . 1 1 63 63 GLN CA C 13 56.329 0.300 . 1 . . . . 78 GLN CA . 26818 1 589 . 1 1 63 63 GLN CB C 13 23.812 0.300 . 1 . . . . 78 GLN CB . 26818 1 590 . 1 1 63 63 GLN CG C 13 32.243 0.300 . 1 . . . . 78 GLN CG . 26818 1 591 . 1 1 63 63 GLN N N 15 119.218 0.300 . 1 . . . . 78 GLN N . 26818 1 592 . 1 1 64 64 ALA H H 1 7.708 0.030 . 1 . . . . 79 ALA H . 26818 1 593 . 1 1 64 64 ALA HA H 1 4.112 0.030 . 1 . . . . 79 ALA HA . 26818 1 594 . 1 1 64 64 ALA HB1 H 1 1.451 0.030 . 1 . . . . 79 ALA HB . 26818 1 595 . 1 1 64 64 ALA HB2 H 1 1.451 0.030 . 1 . . . . 79 ALA HB . 26818 1 596 . 1 1 64 64 ALA HB3 H 1 1.451 0.030 . 1 . . . . 79 ALA HB . 26818 1 597 . 1 1 64 64 ALA C C 13 176.438 0.300 . 1 . . . . 79 ALA C . 26818 1 598 . 1 1 64 64 ALA CA C 13 53.092 0.300 . 1 . . . . 79 ALA CA . 26818 1 599 . 1 1 64 64 ALA CB C 13 16.121 0.300 . 1 . . . . 79 ALA CB . 26818 1 600 . 1 1 64 64 ALA N N 15 122.05 0.300 . 1 . . . . 79 ALA N . 26818 1 601 . 1 1 65 65 LEU H H 1 8.607 0.030 . 1 . . . . 80 LEU H . 26818 1 602 . 1 1 65 65 LEU HA H 1 3.705 0.030 . 1 . . . . 80 LEU HA . 26818 1 603 . 1 1 65 65 LEU HB2 H 1 1.756 0.030 . 2 . . . . 80 LEU HB2 . 26818 1 604 . 1 1 65 65 LEU HB3 H 1 1.614 0.030 . 2 . . . . 80 LEU HB3 . 26818 1 605 . 1 1 65 65 LEU HG H 1 1.534 0.030 . 1 . . . . 80 LEU HG . 26818 1 606 . 1 1 65 65 LEU HD11 H 1 0.724 0.030 . 2 . . . . 80 LEU HD1 . 26818 1 607 . 1 1 65 65 LEU HD12 H 1 0.724 0.030 . 2 . . . . 80 LEU HD1 . 26818 1 608 . 1 1 65 65 LEU HD13 H 1 0.724 0.030 . 2 . . . . 80 LEU HD1 . 26818 1 609 . 1 1 65 65 LEU HD21 H 1 0.724 0.030 . 2 . . . . 80 LEU HD2 . 26818 1 610 . 1 1 65 65 LEU HD22 H 1 0.724 0.030 . 2 . . . . 80 LEU HD2 . 26818 1 611 . 1 1 65 65 LEU HD23 H 1 0.724 0.030 . 2 . . . . 80 LEU HD2 . 26818 1 612 . 1 1 65 65 LEU C C 13 175.999 0.300 . 1 . . . . 80 LEU C . 26818 1 613 . 1 1 65 65 LEU CA C 13 56.16 0.300 . 1 . . . . 80 LEU CA . 26818 1 614 . 1 1 65 65 LEU CB C 13 39.614 0.300 . 1 . . . . 80 LEU CB . 26818 1 615 . 1 1 65 65 LEU CG C 13 23.662 0.300 . 1 . . . . 80 LEU CG . 26818 1 616 . 1 1 65 65 LEU CD1 C 13 21.633 0.300 . 2 . . . . 80 LEU CD1 . 26818 1 617 . 1 1 65 65 LEU CD2 C 13 21.633 0.300 . 2 . . . . 80 LEU CD2 . 26818 1 618 . 1 1 65 65 LEU N N 15 120.273 0.300 . 1 . . . . 80 LEU N . 26818 1 619 . 1 1 66 66 ALA H H 1 7.296 0.030 . 1 . . . . 81 ALA H . 26818 1 620 . 1 1 66 66 ALA HA H 1 3.894 0.030 . 1 . . . . 81 ALA HA . 26818 1 621 . 1 1 66 66 ALA HB1 H 1 1.388 0.030 . 1 . . . . 81 ALA HB . 26818 1 622 . 1 1 66 66 ALA HB2 H 1 1.388 0.030 . 1 . . . . 81 ALA HB . 26818 1 623 . 1 1 66 66 ALA HB3 H 1 1.388 0.030 . 1 . . . . 81 ALA HB . 26818 1 624 . 1 1 66 66 ALA C C 13 178.369 0.300 . 1 . . . . 81 ALA C . 26818 1 625 . 1 1 66 66 ALA CA C 13 52.406 0.300 . 1 . . . . 81 ALA CA . 26818 1 626 . 1 1 66 66 ALA CB C 13 15.18 0.300 . 1 . . . . 81 ALA CB . 26818 1 627 . 1 1 66 66 ALA N N 15 119.073 0.300 . 1 . . . . 81 ALA N . 26818 1 628 . 1 1 67 67 ASP H H 1 7.55 0.030 . 1 . . . . 82 ASP H . 26818 1 629 . 1 1 67 67 ASP HA H 1 4.672 0.030 . 1 . . . . 82 ASP HA . 26818 1 630 . 1 1 67 67 ASP HB2 H 1 3.212 0.030 . 2 . . . . 82 ASP HB2 . 26818 1 631 . 1 1 67 67 ASP HB3 H 1 2.708 0.030 . 2 . . . . 82 ASP HB3 . 26818 1 632 . 1 1 67 67 ASP C C 13 176.311 0.300 . 1 . . . . 82 ASP C . 26818 1 633 . 1 1 67 67 ASP CA C 13 55.155 0.300 . 1 . . . . 82 ASP CA . 26818 1 634 . 1 1 67 67 ASP CB C 13 37.856 0.300 . 1 . . . . 82 ASP CB . 26818 1 635 . 1 1 67 67 ASP N N 15 120.332 0.300 . 1 . . . . 82 ASP N . 26818 1 636 . 1 1 68 68 CYS H H 1 8.339 0.030 . 1 . . . . 83 CYS H . 26818 1 637 . 1 1 68 68 CYS HA H 1 3.834 0.030 . 1 . . . . 83 CYS HA . 26818 1 638 . 1 1 68 68 CYS HB2 H 1 3.059 0.030 . 2 . . . . 83 CYS HB2 . 26818 1 639 . 1 1 68 68 CYS HB3 H 1 3.107 0.030 . 2 . . . . 83 CYS HB3 . 26818 1 640 . 1 1 68 68 CYS HG H 1 2.472 0.030 . 1 . . . . 83 CYS HG . 26818 1 641 . 1 1 68 68 CYS C C 13 174.029 0.300 . 1 . . . . 83 CYS C . 26818 1 642 . 1 1 68 68 CYS CA C 13 62.711 0.300 . 1 . . . . 83 CYS CA . 26818 1 643 . 1 1 68 68 CYS CB C 13 25.187 0.300 . 1 . . . . 83 CYS CB . 26818 1 644 . 1 1 68 68 CYS N N 15 118.537 0.300 . 1 . . . . 83 CYS N . 26818 1 645 . 1 1 69 69 ARG H H 1 8.142 0.030 . 1 . . . . 84 ARG H . 26818 1 646 . 1 1 69 69 ARG HA H 1 3.689 0.030 . 1 . . . . 84 ARG HA . 26818 1 647 . 1 1 69 69 ARG HB2 H 1 1.735 0.030 . 2 . . . . 84 ARG HB2 . 26818 1 648 . 1 1 69 69 ARG HB3 H 1 1.541 0.030 . 2 . . . . 84 ARG HB3 . 26818 1 649 . 1 1 69 69 ARG HG2 H 1 1.404 0.030 . 2 . . . . 84 ARG HG2 . 26818 1 650 . 1 1 69 69 ARG HG3 H 1 1.404 0.030 . 2 . . . . 84 ARG HG3 . 26818 1 651 . 1 1 69 69 ARG HD2 H 1 2.846 0.030 . 2 . . . . 84 ARG HD2 . 26818 1 652 . 1 1 69 69 ARG HD3 H 1 2.959 0.030 . 2 . . . . 84 ARG HD3 . 26818 1 653 . 1 1 69 69 ARG C C 13 176.443 0.300 . 1 . . . . 84 ARG C . 26818 1 654 . 1 1 69 69 ARG CA C 13 56.987 0.300 . 1 . . . . 84 ARG CA . 26818 1 655 . 1 1 69 69 ARG CB C 13 26.701 0.300 . 1 . . . . 84 ARG CB . 26818 1 656 . 1 1 69 69 ARG CG C 13 25.423 0.300 . 1 . . . . 84 ARG CG . 26818 1 657 . 1 1 69 69 ARG CD C 13 39.243 0.300 . 1 . . . . 84 ARG CD . 26818 1 658 . 1 1 69 69 ARG N N 15 116.733 0.300 . 1 . . . . 84 ARG N . 26818 1 659 . 1 1 70 70 ARG H H 1 7.579 0.030 . 1 . . . . 85 ARG H . 26818 1 660 . 1 1 70 70 ARG HA H 1 3.746 0.030 . 1 . . . . 85 ARG HA . 26818 1 661 . 1 1 70 70 ARG HB2 H 1 1.458 0.030 . 2 . . . . 85 ARG HB2 . 26818 1 662 . 1 1 70 70 ARG HB3 H 1 1.458 0.030 . 2 . . . . 85 ARG HB3 . 26818 1 663 . 1 1 70 70 ARG HG2 H 1 1.103 0.030 . 2 . . . . 85 ARG HG2 . 26818 1 664 . 1 1 70 70 ARG HG3 H 1 1.103 0.030 . 2 . . . . 85 ARG HG3 . 26818 1 665 . 1 1 70 70 ARG C C 13 175.549 0.300 . 1 . . . . 85 ARG C . 26818 1 666 . 1 1 70 70 ARG CA C 13 55.222 0.300 . 1 . . . . 85 ARG CA . 26818 1 667 . 1 1 70 70 ARG CB C 13 26.306 0.300 . 1 . . . . 85 ARG CB . 26818 1 668 . 1 1 70 70 ARG CG C 13 23.303 0.300 . 1 . . . . 85 ARG CG . 26818 1 669 . 1 1 70 70 ARG N N 15 120.175 0.300 . 1 . . . . 85 ARG N . 26818 1 670 . 1 1 71 71 ALA H H 1 8.074 0.030 . 1 . . . . 86 ALA H . 26818 1 671 . 1 1 71 71 ALA HA H 1 3.647 0.030 . 1 . . . . 86 ALA HA . 26818 1 672 . 1 1 71 71 ALA HB1 H 1 1.368 0.030 . 1 . . . . 86 ALA HB . 26818 1 673 . 1 1 71 71 ALA HB2 H 1 1.368 0.030 . 1 . . . . 86 ALA HB . 26818 1 674 . 1 1 71 71 ALA HB3 H 1 1.368 0.030 . 1 . . . . 86 ALA HB . 26818 1 675 . 1 1 71 71 ALA C C 13 176.632 0.300 . 1 . . . . 86 ALA C . 26818 1 676 . 1 1 71 71 ALA CA C 13 53.085 0.300 . 1 . . . . 86 ALA CA . 26818 1 677 . 1 1 71 71 ALA CB C 13 16.331 0.300 . 1 . . . . 86 ALA CB . 26818 1 678 . 1 1 71 71 ALA N N 15 120.672 0.300 . 1 . . . . 86 ALA N . 26818 1 679 . 1 1 72 72 LEU H H 1 7.499 0.030 . 1 . . . . 87 LEU H . 26818 1 680 . 1 1 72 72 LEU HA H 1 3.885 0.030 . 1 . . . . 87 LEU HA . 26818 1 681 . 1 1 72 72 LEU HB2 H 1 1.096 0.030 . 2 . . . . 87 LEU HB2 . 26818 1 682 . 1 1 72 72 LEU HB3 H 1 1.303 0.030 . 2 . . . . 87 LEU HB3 . 26818 1 683 . 1 1 72 72 LEU HG H 1 1.495 0.030 . 1 . . . . 87 LEU HG . 26818 1 684 . 1 1 72 72 LEU C C 13 176.368 0.300 . 1 . . . . 87 LEU C . 26818 1 685 . 1 1 72 72 LEU CA C 13 53.593 0.300 . 1 . . . . 87 LEU CA . 26818 1 686 . 1 1 72 72 LEU CB C 13 39.175 0.300 . 1 . . . . 87 LEU CB . 26818 1 687 . 1 1 72 72 LEU CG C 13 22.776 0.300 . 1 . . . . 87 LEU CG . 26818 1 688 . 1 1 72 72 LEU N N 15 115.264 0.300 . 1 . . . . 87 LEU N . 26818 1 689 . 1 1 73 73 GLU H H 1 7.306 0.030 . 1 . . . . 88 GLU H . 26818 1 690 . 1 1 73 73 GLU HA H 1 3.817 0.030 . 1 . . . . 88 GLU HA . 26818 1 691 . 1 1 73 73 GLU HB2 H 1 2.063 0.030 . 2 . . . . 88 GLU HB2 . 26818 1 692 . 1 1 73 73 GLU HB3 H 1 1.843 0.030 . 2 . . . . 88 GLU HB3 . 26818 1 693 . 1 1 73 73 GLU HG2 H 1 2.362 0.030 . 2 . . . . 88 GLU HG2 . 26818 1 694 . 1 1 73 73 GLU HG3 H 1 2.362 0.030 . 2 . . . . 88 GLU HG3 . 26818 1 695 . 1 1 73 73 GLU C C 13 175.821 0.300 . 1 . . . . 88 GLU C . 26818 1 696 . 1 1 73 73 GLU CA C 13 55.815 0.300 . 1 . . . . 88 GLU CA . 26818 1 697 . 1 1 73 73 GLU CB C 13 27.014 0.300 . 1 . . . . 88 GLU CB . 26818 1 698 . 1 1 73 73 GLU CG C 13 33.436 0.300 . 1 . . . . 88 GLU CG . 26818 1 699 . 1 1 73 73 GLU N N 15 118.451 0.300 . 1 . . . . 88 GLU N . 26818 1 700 . 1 1 74 74 LEU H H 1 7.066 0.030 . 1 . . . . 89 LEU H . 26818 1 701 . 1 1 74 74 LEU HA H 1 4.111 0.030 . 1 . . . . 89 LEU HA . 26818 1 702 . 1 1 74 74 LEU HB2 H 1 1.279 0.030 . 2 . . . . 89 LEU HB2 . 26818 1 703 . 1 1 74 74 LEU HB3 H 1 1.459 0.030 . 2 . . . . 89 LEU HB3 . 26818 1 704 . 1 1 74 74 LEU HD11 H 1 0.79 0.030 . 2 . . . . 89 LEU HD1 . 26818 1 705 . 1 1 74 74 LEU HD12 H 1 0.79 0.030 . 2 . . . . 89 LEU HD1 . 26818 1 706 . 1 1 74 74 LEU HD13 H 1 0.79 0.030 . 2 . . . . 89 LEU HD1 . 26818 1 707 . 1 1 74 74 LEU HD21 H 1 0.79 0.030 . 2 . . . . 89 LEU HD2 . 26818 1 708 . 1 1 74 74 LEU HD22 H 1 0.79 0.030 . 2 . . . . 89 LEU HD2 . 26818 1 709 . 1 1 74 74 LEU HD23 H 1 0.79 0.030 . 2 . . . . 89 LEU HD2 . 26818 1 710 . 1 1 74 74 LEU C C 13 174.807 0.300 . 1 . . . . 89 LEU C . 26818 1 711 . 1 1 74 74 LEU CA C 13 53.266 0.300 . 1 . . . . 89 LEU CA . 26818 1 712 . 1 1 74 74 LEU CB C 13 40.957 0.300 . 1 . . . . 89 LEU CB . 26818 1 713 . 1 1 74 74 LEU CG C 13 23.89 0.300 . 1 . . . . 89 LEU CG . 26818 1 714 . 1 1 74 74 LEU CD1 C 13 19.506 0.300 . 2 . . . . 89 LEU CD1 . 26818 1 715 . 1 1 74 74 LEU CD2 C 13 19.506 0.300 . 2 . . . . 89 LEU CD2 . 26818 1 716 . 1 1 74 74 LEU N N 15 118.71 0.300 . 1 . . . . 89 LEU N . 26818 1 717 . 1 1 75 75 ASP H H 1 8.58 0.030 . 1 . . . . 90 ASP H . 26818 1 718 . 1 1 75 75 ASP HA H 1 4.544 0.030 . 1 . . . . 90 ASP HA . 26818 1 719 . 1 1 75 75 ASP HB2 H 1 2.547 0.030 . 2 . . . . 90 ASP HB2 . 26818 1 720 . 1 1 75 75 ASP HB3 H 1 2.309 0.030 . 2 . . . . 90 ASP HB3 . 26818 1 721 . 1 1 75 75 ASP C C 13 172.591 0.300 . 1 . . . . 90 ASP C . 26818 1 722 . 1 1 75 75 ASP CA C 13 50.299 0.300 . 1 . . . . 90 ASP CA . 26818 1 723 . 1 1 75 75 ASP CB C 13 38.137 0.300 . 1 . . . . 90 ASP CB . 26818 1 724 . 1 1 75 75 ASP N N 15 120.107 0.300 . 1 . . . . 90 ASP N . 26818 1 725 . 1 1 76 76 GLY H H 1 8.523 0.030 . 1 . . . . 91 GLY H . 26818 1 726 . 1 1 76 76 GLY HA2 H 1 4.117 0.030 . 2 . . . . 91 GLY HA2 . 26818 1 727 . 1 1 76 76 GLY HA3 H 1 3.695 0.030 . 2 . . . . 91 GLY HA3 . 26818 1 728 . 1 1 76 76 GLY C C 13 171.975 0.300 . 1 . . . . 91 GLY C . 26818 1 729 . 1 1 76 76 GLY CA C 13 44.009 0.300 . 1 . . . . 91 GLY CA . 26818 1 730 . 1 1 76 76 GLY N N 15 111.315 0.300 . 1 . . . . 91 GLY N . 26818 1 731 . 1 1 77 77 GLN H H 1 7.729 0.030 . 1 . . . . 92 GLN H . 26818 1 732 . 1 1 77 77 GLN HA H 1 4.348 0.030 . 1 . . . . 92 GLN HA . 26818 1 733 . 1 1 77 77 GLN HB2 H 1 2.216 0.030 . 2 . . . . 92 GLN HB2 . 26818 1 734 . 1 1 77 77 GLN HB3 H 1 2.099 0.030 . 2 . . . . 92 GLN HB3 . 26818 1 735 . 1 1 77 77 GLN C C 13 172.356 0.300 . 1 . . . . 92 GLN C . 26818 1 736 . 1 1 77 77 GLN CA C 13 50.994 0.300 . 1 . . . . 92 GLN CA . 26818 1 737 . 1 1 77 77 GLN CB C 13 26.08 0.300 . 1 . . . . 92 GLN CB . 26818 1 738 . 1 1 77 77 GLN CG C 13 31.182 0.300 . 1 . . . . 92 GLN CG . 26818 1 739 . 1 1 77 77 GLN N N 15 115.671 0.300 . 1 . . . . 92 GLN N . 26818 1 740 . 1 1 78 78 SER H H 1 6.751 0.030 . 1 . . . . 93 SER H . 26818 1 741 . 1 1 78 78 SER HA H 1 4.257 0.030 . 1 . . . . 93 SER HA . 26818 1 742 . 1 1 78 78 SER HB2 H 1 3.874 0.030 . 2 . . . . 93 SER HB2 . 26818 1 743 . 1 1 78 78 SER HB3 H 1 4.043 0.030 . 2 . . . . 93 SER HB3 . 26818 1 744 . 1 1 78 78 SER CA C 13 55.285 0.300 . 1 . . . . 93 SER CA . 26818 1 745 . 1 1 78 78 SER CB C 13 59.508 0.300 . 1 . . . . 93 SER CB . 26818 1 746 . 1 1 78 78 SER N N 15 110.259 0.300 . 1 . . . . 93 SER N . 26818 1 747 . 1 1 80 80 LYS HA H 1 4.056 0.030 . 1 . . . . 95 LYS HA . 26818 1 748 . 1 1 80 80 LYS HB2 H 1 1.726 0.030 . 2 . . . . 95 LYS HB2 . 26818 1 749 . 1 1 80 80 LYS HB3 H 1 1.726 0.030 . 2 . . . . 95 LYS HB3 . 26818 1 750 . 1 1 80 80 LYS HG2 H 1 1.405 0.030 . 2 . . . . 95 LYS HG2 . 26818 1 751 . 1 1 80 80 LYS HG3 H 1 1.036 0.030 . 2 . . . . 95 LYS HG3 . 26818 1 752 . 1 1 80 80 LYS C C 13 172.942 0.300 . 1 . . . . 95 LYS C . 26818 1 753 . 1 1 80 80 LYS CA C 13 58.195 0.300 . 1 . . . . 95 LYS CA . 26818 1 754 . 1 1 80 80 LYS CB C 13 35.889 0.300 . 1 . . . . 95 LYS CB . 26818 1 755 . 1 1 80 80 LYS CG C 13 24.948 0.300 . 1 . . . . 95 LYS CG . 26818 1 756 . 1 1 81 81 ALA H H 1 8.408 0.030 . 1 . . . . 96 ALA H . 26818 1 757 . 1 1 81 81 ALA HA H 1 4.161 0.030 . 1 . . . . 96 ALA HA . 26818 1 758 . 1 1 81 81 ALA HB1 H 1 1.22 0.030 . 1 . . . . 96 ALA HB . 26818 1 759 . 1 1 81 81 ALA HB2 H 1 1.22 0.030 . 1 . . . . 96 ALA HB . 26818 1 760 . 1 1 81 81 ALA HB3 H 1 1.22 0.030 . 1 . . . . 96 ALA HB . 26818 1 761 . 1 1 81 81 ALA C C 13 172.847 0.300 . 1 . . . . 96 ALA C . 26818 1 762 . 1 1 81 81 ALA CA C 13 49.503 0.300 . 1 . . . . 96 ALA CA . 26818 1 763 . 1 1 81 81 ALA CB C 13 16.489 0.300 . 1 . . . . 96 ALA CB . 26818 1 764 . 1 1 81 81 ALA N N 15 129.332 0.300 . 1 . . . . 96 ALA N . 26818 1 765 . 1 1 82 82 HIS H H 1 8.054 0.030 . 1 . . . . 97 HIS H . 26818 1 766 . 1 1 82 82 HIS HA H 1 4.325 0.030 . 1 . . . . 97 HIS HA . 26818 1 767 . 1 1 82 82 HIS HB2 H 1 2.733 0.030 . 2 . . . . 97 HIS HB2 . 26818 1 768 . 1 1 82 82 HIS HB3 H 1 2.733 0.030 . 2 . . . . 97 HIS HB3 . 26818 1 769 . 1 1 82 82 HIS C C 13 170.445 0.300 . 1 . . . . 97 HIS C . 26818 1 770 . 1 1 82 82 HIS CA C 13 55.4 0.300 . 1 . . . . 97 HIS CA . 26818 1 771 . 1 1 82 82 HIS CB C 13 25.542 0.300 . 1 . . . . 97 HIS CB . 26818 1 772 . 1 1 82 82 HIS N N 15 118.44 0.300 . 1 . . . . 97 HIS N . 26818 1 773 . 1 1 83 83 PHE H H 1 7.625 0.030 . 1 . . . . 98 PHE H . 26818 1 774 . 1 1 83 83 PHE HA H 1 4.098 0.030 . 1 . . . . 98 PHE HA . 26818 1 775 . 1 1 83 83 PHE HB2 H 1 2.811 0.030 . 2 . . . . 98 PHE HB2 . 26818 1 776 . 1 1 83 83 PHE HB3 H 1 2.811 0.030 . 2 . . . . 98 PHE HB3 . 26818 1 777 . 1 1 83 83 PHE CA C 13 56.972 0.300 . 1 . . . . 98 PHE CA . 26818 1 778 . 1 1 83 83 PHE CB C 13 36.617 0.300 . 1 . . . . 98 PHE CB . 26818 1 779 . 1 1 83 83 PHE N N 15 126.785 0.300 . 1 . . . . 98 PHE N . 26818 1 780 . 1 1 84 84 PHE HA H 1 4.132 0.030 . 1 . . . . 99 PHE HA . 26818 1 781 . 1 1 84 84 PHE HB2 H 1 2.794 0.030 . 2 . . . . 99 PHE HB2 . 26818 1 782 . 1 1 84 84 PHE HB3 H 1 2.794 0.030 . 2 . . . . 99 PHE HB3 . 26818 1 783 . 1 1 84 84 PHE C C 13 175.126 0.300 . 1 . . . . 99 PHE C . 26818 1 784 . 1 1 84 84 PHE CA C 13 55.739 0.300 . 1 . . . . 99 PHE CA . 26818 1 785 . 1 1 84 84 PHE CB C 13 34.186 0.300 . 1 . . . . 99 PHE CB . 26818 1 786 . 1 1 85 85 LEU H H 1 8.009 0.030 . 1 . . . . 100 LEU H . 26818 1 787 . 1 1 85 85 LEU HA H 1 3.951 0.030 . 1 . . . . 100 LEU HA . 26818 1 788 . 1 1 85 85 LEU HB2 H 1 1.81 0.030 . 2 . . . . 100 LEU HB2 . 26818 1 789 . 1 1 85 85 LEU HB3 H 1 1.81 0.030 . 2 . . . . 100 LEU HB3 . 26818 1 790 . 1 1 85 85 LEU HD11 H 1 0.599 0.030 . 2 . . . . 100 LEU HD1 . 26818 1 791 . 1 1 85 85 LEU HD12 H 1 0.599 0.030 . 2 . . . . 100 LEU HD1 . 26818 1 792 . 1 1 85 85 LEU HD13 H 1 0.599 0.030 . 2 . . . . 100 LEU HD1 . 26818 1 793 . 1 1 85 85 LEU HD21 H 1 0.566 0.030 . 2 . . . . 100 LEU HD2 . 26818 1 794 . 1 1 85 85 LEU HD22 H 1 0.566 0.030 . 2 . . . . 100 LEU HD2 . 26818 1 795 . 1 1 85 85 LEU HD23 H 1 0.566 0.030 . 2 . . . . 100 LEU HD2 . 26818 1 796 . 1 1 85 85 LEU C C 13 175.699 0.300 . 1 . . . . 100 LEU C . 26818 1 797 . 1 1 85 85 LEU CA C 13 56.016 0.300 . 1 . . . . 100 LEU CA . 26818 1 798 . 1 1 85 85 LEU CB C 13 39.32 0.300 . 1 . . . . 100 LEU CB . 26818 1 799 . 1 1 85 85 LEU CG C 13 24.49 0.300 . 1 . . . . 100 LEU CG . 26818 1 800 . 1 1 85 85 LEU CD1 C 13 21.514 0.300 . 2 . . . . 100 LEU CD1 . 26818 1 801 . 1 1 85 85 LEU CD2 C 13 21.514 0.300 . 2 . . . . 100 LEU CD2 . 26818 1 802 . 1 1 85 85 LEU N N 15 122.88 0.300 . 1 . . . . 100 LEU N . 26818 1 803 . 1 1 86 86 GLY H H 1 8.224 0.030 . 1 . . . . 101 GLY H . 26818 1 804 . 1 1 86 86 GLY HA2 H 1 4.115 0.030 . 2 . . . . 101 GLY HA2 . 26818 1 805 . 1 1 86 86 GLY HA3 H 1 3.463 0.030 . 2 . . . . 101 GLY HA3 . 26818 1 806 . 1 1 86 86 GLY C C 13 172.783 0.300 . 1 . . . . 101 GLY C . 26818 1 807 . 1 1 86 86 GLY CA C 13 44.725 0.300 . 1 . . . . 101 GLY CA . 26818 1 808 . 1 1 86 86 GLY N N 15 105.422 0.300 . 1 . . . . 101 GLY N . 26818 1 809 . 1 1 87 87 GLN H H 1 8.475 0.030 . 1 . . . . 102 GLN H . 26818 1 810 . 1 1 87 87 GLN HA H 1 3.892 0.030 . 1 . . . . 102 GLN HA . 26818 1 811 . 1 1 87 87 GLN HB2 H 1 1.935 0.030 . 2 . . . . 102 GLN HB2 . 26818 1 812 . 1 1 87 87 GLN HB3 H 1 1.935 0.030 . 2 . . . . 102 GLN HB3 . 26818 1 813 . 1 1 87 87 GLN HG2 H 1 2.262 0.030 . 2 . . . . 102 GLN HG2 . 26818 1 814 . 1 1 87 87 GLN HG3 H 1 2.262 0.030 . 2 . . . . 102 GLN HG3 . 26818 1 815 . 1 1 87 87 GLN C C 13 175.818 0.300 . 1 . . . . 102 GLN C . 26818 1 816 . 1 1 87 87 GLN CA C 13 56.587 0.300 . 1 . . . . 102 GLN CA . 26818 1 817 . 1 1 87 87 GLN CB C 13 26.293 0.300 . 1 . . . . 102 GLN CB . 26818 1 818 . 1 1 87 87 GLN CG C 13 30.918 0.300 . 1 . . . . 102 GLN CG . 26818 1 819 . 1 1 87 87 GLN N N 15 120.301 0.300 . 1 . . . . 102 GLN N . 26818 1 820 . 1 1 88 88 CYS H H 1 8.44 0.030 . 1 . . . . 103 CYS H . 26818 1 821 . 1 1 88 88 CYS HA H 1 3.74 0.030 . 1 . . . . 103 CYS HA . 26818 1 822 . 1 1 88 88 CYS HB2 H 1 2.951 0.030 . 2 . . . . 103 CYS HB2 . 26818 1 823 . 1 1 88 88 CYS HB3 H 1 2.921 0.030 . 2 . . . . 103 CYS HB3 . 26818 1 824 . 1 1 88 88 CYS C C 13 173.94 0.300 . 1 . . . . 103 CYS C . 26818 1 825 . 1 1 88 88 CYS CA C 13 60.754 0.300 . 1 . . . . 103 CYS CA . 26818 1 826 . 1 1 88 88 CYS CB C 13 24.324 0.300 . 1 . . . . 103 CYS CB . 26818 1 827 . 1 1 88 88 CYS N N 15 119.714 0.300 . 1 . . . . 103 CYS N . 26818 1 828 . 1 1 89 89 GLN H H 1 8.498 0.030 . 1 . . . . 104 GLN H . 26818 1 829 . 1 1 89 89 GLN HA H 1 3.608 0.030 . 1 . . . . 104 GLN HA . 26818 1 830 . 1 1 89 89 GLN HB2 H 1 1.907 0.030 . 2 . . . . 104 GLN HB2 . 26818 1 831 . 1 1 89 89 GLN HB3 H 1 1.907 0.030 . 2 . . . . 104 GLN HB3 . 26818 1 832 . 1 1 89 89 GLN HG2 H 1 2.174 0.030 . 2 . . . . 104 GLN HG2 . 26818 1 833 . 1 1 89 89 GLN HG3 H 1 2.174 0.030 . 2 . . . . 104 GLN HG3 . 26818 1 834 . 1 1 89 89 GLN C C 13 175.513 0.300 . 1 . . . . 104 GLN C . 26818 1 835 . 1 1 89 89 GLN CA C 13 56.459 0.300 . 1 . . . . 104 GLN CA . 26818 1 836 . 1 1 89 89 GLN CB C 13 24.22 0.300 . 1 . . . . 104 GLN CB . 26818 1 837 . 1 1 89 89 GLN N N 15 117.484 0.300 . 1 . . . . 104 GLN N . 26818 1 838 . 1 1 90 90 LEU H H 1 8.433 0.030 . 1 . . . . 105 LEU H . 26818 1 839 . 1 1 90 90 LEU HA H 1 3.604 0.030 . 1 . . . . 105 LEU HA . 26818 1 840 . 1 1 90 90 LEU HB2 H 1 1.457 0.030 . 2 . . . . 105 LEU HB2 . 26818 1 841 . 1 1 90 90 LEU HB3 H 1 2.018 0.030 . 2 . . . . 105 LEU HB3 . 26818 1 842 . 1 1 90 90 LEU HG H 1 1.585 0.030 . 1 . . . . 105 LEU HG . 26818 1 843 . 1 1 90 90 LEU HD11 H 1 0.924 0.030 . 2 . . . . 105 LEU HD1 . 26818 1 844 . 1 1 90 90 LEU HD12 H 1 0.924 0.030 . 2 . . . . 105 LEU HD1 . 26818 1 845 . 1 1 90 90 LEU HD13 H 1 0.924 0.030 . 2 . . . . 105 LEU HD1 . 26818 1 846 . 1 1 90 90 LEU HD21 H 1 0.871 0.030 . 2 . . . . 105 LEU HD2 . 26818 1 847 . 1 1 90 90 LEU HD22 H 1 0.871 0.030 . 2 . . . . 105 LEU HD2 . 26818 1 848 . 1 1 90 90 LEU HD23 H 1 0.871 0.030 . 2 . . . . 105 LEU HD2 . 26818 1 849 . 1 1 90 90 LEU C C 13 177.784 0.300 . 1 . . . . 105 LEU C . 26818 1 850 . 1 1 90 90 LEU CA C 13 55.842 0.300 . 1 . . . . 105 LEU CA . 26818 1 851 . 1 1 90 90 LEU CB C 13 38.89 0.300 . 1 . . . . 105 LEU CB . 26818 1 852 . 1 1 90 90 LEU CG C 13 24.131 0.300 . 1 . . . . 105 LEU CG . 26818 1 853 . 1 1 90 90 LEU CD1 C 13 21.48 0.300 . 2 . . . . 105 LEU CD1 . 26818 1 854 . 1 1 90 90 LEU CD2 C 13 21.48 0.300 . 2 . . . . 105 LEU CD2 . 26818 1 855 . 1 1 90 90 LEU N N 15 122.207 0.300 . 1 . . . . 105 LEU N . 26818 1 856 . 1 1 91 91 GLU H H 1 7.656 0.030 . 1 . . . . 106 GLU H . 26818 1 857 . 1 1 91 91 GLU HA H 1 3.815 0.030 . 1 . . . . 106 GLU HA . 26818 1 858 . 1 1 91 91 GLU HB2 H 1 1.832 0.030 . 2 . . . . 106 GLU HB2 . 26818 1 859 . 1 1 91 91 GLU HB3 H 1 1.871 0.030 . 2 . . . . 106 GLU HB3 . 26818 1 860 . 1 1 91 91 GLU HG2 H 1 2.124 0.030 . 2 . . . . 106 GLU HG2 . 26818 1 861 . 1 1 91 91 GLU HG3 H 1 2.176 0.030 . 2 . . . . 106 GLU HG3 . 26818 1 862 . 1 1 91 91 GLU C C 13 175.141 0.300 . 1 . . . . 106 GLU C . 26818 1 863 . 1 1 91 91 GLU CA C 13 56.283 0.300 . 1 . . . . 106 GLU CA . 26818 1 864 . 1 1 91 91 GLU CB C 13 25.873 0.300 . 1 . . . . 106 GLU CB . 26818 1 865 . 1 1 91 91 GLU CG C 13 33.492 0.300 . 1 . . . . 106 GLU CG . 26818 1 866 . 1 1 91 91 GLU N N 15 120.24 0.300 . 1 . . . . 106 GLU N . 26818 1 867 . 1 1 92 92 MET H H 1 7.228 0.030 . 1 . . . . 107 MET H . 26818 1 868 . 1 1 92 92 MET HA H 1 4.049 0.030 . 1 . . . . 107 MET HA . 26818 1 869 . 1 1 92 92 MET HB2 H 1 2.275 0.030 . 2 . . . . 107 MET HB2 . 26818 1 870 . 1 1 92 92 MET HB3 H 1 1.918 0.030 . 2 . . . . 107 MET HB3 . 26818 1 871 . 1 1 92 92 MET HG2 H 1 2.379 0.030 . 2 . . . . 107 MET HG2 . 26818 1 872 . 1 1 92 92 MET HG3 H 1 2.379 0.030 . 2 . . . . 107 MET HG3 . 26818 1 873 . 1 1 92 92 MET C C 13 171.717 0.300 . 1 . . . . 107 MET C . 26818 1 874 . 1 1 92 92 MET CA C 13 54.13 0.300 . 1 . . . . 107 MET CA . 26818 1 875 . 1 1 92 92 MET CB C 13 31.076 0.300 . 1 . . . . 107 MET CB . 26818 1 876 . 1 1 92 92 MET CG C 13 33.563 0.300 . 1 . . . . 107 MET CG . 26818 1 877 . 1 1 92 92 MET N N 15 115.627 0.300 . 1 . . . . 107 MET N . 26818 1 878 . 1 1 93 93 GLU H H 1 7.439 0.030 . 1 . . . . 108 GLU H . 26818 1 879 . 1 1 93 93 GLU HA H 1 2.723 0.030 . 1 . . . . 108 GLU HA . 26818 1 880 . 1 1 93 93 GLU HB2 H 1 2.144 0.030 . 2 . . . . 108 GLU HB2 . 26818 1 881 . 1 1 93 93 GLU HB3 H 1 1.881 0.030 . 2 . . . . 108 GLU HB3 . 26818 1 882 . 1 1 93 93 GLU HG2 H 1 1.836 0.030 . 2 . . . . 108 GLU HG2 . 26818 1 883 . 1 1 93 93 GLU HG3 H 1 2.021 0.030 . 2 . . . . 108 GLU HG3 . 26818 1 884 . 1 1 93 93 GLU C C 13 171.813 0.300 . 1 . . . . 108 GLU C . 26818 1 885 . 1 1 93 93 GLU CA C 13 54.718 0.300 . 1 . . . . 108 GLU CA . 26818 1 886 . 1 1 93 93 GLU CB C 13 23.012 0.300 . 1 . . . . 108 GLU CB . 26818 1 887 . 1 1 93 93 GLU CG C 13 33.901 0.300 . 1 . . . . 108 GLU CG . 26818 1 888 . 1 1 93 93 GLU N N 15 112.152 0.300 . 1 . . . . 108 GLU N . 26818 1 889 . 1 1 94 94 SER H H 1 8.033 0.030 . 1 . . . . 109 SER H . 26818 1 890 . 1 1 94 94 SER HA H 1 4.539 0.030 . 1 . . . . 109 SER HA . 26818 1 891 . 1 1 94 94 SER HB2 H 1 3.891 0.030 . 2 . . . . 109 SER HB2 . 26818 1 892 . 1 1 94 94 SER HB3 H 1 3.378 0.030 . 2 . . . . 109 SER HB3 . 26818 1 893 . 1 1 94 94 SER C C 13 173.002 0.300 . 1 . . . . 109 SER C . 26818 1 894 . 1 1 94 94 SER CA C 13 51.853 0.300 . 1 . . . . 109 SER CA . 26818 1 895 . 1 1 94 94 SER CB C 13 58.681 0.300 . 1 . . . . 109 SER CB . 26818 1 896 . 1 1 94 94 SER N N 15 116.603 0.300 . 1 . . . . 109 SER N . 26818 1 897 . 1 1 95 95 TYR H H 1 6.832 0.030 . 1 . . . . 110 TYR H . 26818 1 898 . 1 1 95 95 TYR HA H 1 3.8 0.030 . 1 . . . . 110 TYR HA . 26818 1 899 . 1 1 95 95 TYR HB2 H 1 2.841 0.030 . 2 . . . . 110 TYR HB2 . 26818 1 900 . 1 1 95 95 TYR HB3 H 1 2.715 0.030 . 2 . . . . 110 TYR HB3 . 26818 1 901 . 1 1 95 95 TYR C C 13 174.381 0.300 . 1 . . . . 110 TYR C . 26818 1 902 . 1 1 95 95 TYR CA C 13 59.739 0.300 . 1 . . . . 110 TYR CA . 26818 1 903 . 1 1 95 95 TYR CB C 13 35.914 0.300 . 1 . . . . 110 TYR CB . 26818 1 904 . 1 1 95 95 TYR N N 15 117.566 0.300 . 1 . . . . 110 TYR N . 26818 1 905 . 1 1 96 96 ASP H H 1 8.372 0.030 . 1 . . . . 111 ASP H . 26818 1 906 . 1 1 96 96 ASP HA H 1 4.276 0.030 . 1 . . . . 111 ASP HA . 26818 1 907 . 1 1 96 96 ASP HB2 H 1 2.502 0.030 . 2 . . . . 111 ASP HB2 . 26818 1 908 . 1 1 96 96 ASP HB3 H 1 2.502 0.030 . 2 . . . . 111 ASP HB3 . 26818 1 909 . 1 1 96 96 ASP C C 13 177.084 0.300 . 1 . . . . 111 ASP C . 26818 1 910 . 1 1 96 96 ASP CA C 13 55.678 0.300 . 1 . . . . 111 ASP CA . 26818 1 911 . 1 1 96 96 ASP CB C 13 37.156 0.300 . 1 . . . . 111 ASP CB . 26818 1 912 . 1 1 96 96 ASP N N 15 118.452 0.300 . 1 . . . . 111 ASP N . 26818 1 913 . 1 1 97 97 GLU H H 1 8.444 0.030 . 1 . . . . 112 GLU H . 26818 1 914 . 1 1 97 97 GLU HA H 1 3.886 0.030 . 1 . . . . 112 GLU HA . 26818 1 915 . 1 1 97 97 GLU HB2 H 1 2.088 0.030 . 2 . . . . 112 GLU HB2 . 26818 1 916 . 1 1 97 97 GLU HB3 H 1 1.851 0.030 . 2 . . . . 112 GLU HB3 . 26818 1 917 . 1 1 97 97 GLU HG2 H 1 2.172 0.030 . 2 . . . . 112 GLU HG2 . 26818 1 918 . 1 1 97 97 GLU HG3 H 1 2.297 0.030 . 2 . . . . 112 GLU HG3 . 26818 1 919 . 1 1 97 97 GLU C C 13 174.94 0.300 . 1 . . . . 112 GLU C . 26818 1 920 . 1 1 97 97 GLU CA C 13 56.683 0.300 . 1 . . . . 112 GLU CA . 26818 1 921 . 1 1 97 97 GLU CB C 13 27.146 0.300 . 1 . . . . 112 GLU CB . 26818 1 922 . 1 1 97 97 GLU CG C 13 34.567 0.300 . 1 . . . . 112 GLU CG . 26818 1 923 . 1 1 97 97 GLU N N 15 121.429 0.300 . 1 . . . . 112 GLU N . 26818 1 924 . 1 1 98 98 ALA H H 1 7.858 0.030 . 1 . . . . 113 ALA H . 26818 1 925 . 1 1 98 98 ALA HA H 1 4.268 0.030 . 1 . . . . 113 ALA HA . 26818 1 926 . 1 1 98 98 ALA HB1 H 1 1.352 0.030 . 1 . . . . 113 ALA HB . 26818 1 927 . 1 1 98 98 ALA HB2 H 1 1.352 0.030 . 1 . . . . 113 ALA HB . 26818 1 928 . 1 1 98 98 ALA HB3 H 1 1.352 0.030 . 1 . . . . 113 ALA HB . 26818 1 929 . 1 1 98 98 ALA C C 13 177.369 0.300 . 1 . . . . 113 ALA C . 26818 1 930 . 1 1 98 98 ALA CA C 13 52.745 0.300 . 1 . . . . 113 ALA CA . 26818 1 931 . 1 1 98 98 ALA CB C 13 16.278 0.300 . 1 . . . . 113 ALA CB . 26818 1 932 . 1 1 98 98 ALA N N 15 120.337 0.300 . 1 . . . . 113 ALA N . 26818 1 933 . 1 1 99 99 ILE H H 1 8.272 0.030 . 1 . . . . 114 ILE H . 26818 1 934 . 1 1 99 99 ILE HA H 1 3.296 0.030 . 1 . . . . 114 ILE HA . 26818 1 935 . 1 1 99 99 ILE HB H 1 1.781 0.030 . 1 . . . . 114 ILE HB . 26818 1 936 . 1 1 99 99 ILE HG21 H 1 0.755 0.030 . 1 . . . . 114 ILE HG2 . 26818 1 937 . 1 1 99 99 ILE HG22 H 1 0.755 0.030 . 1 . . . . 114 ILE HG2 . 26818 1 938 . 1 1 99 99 ILE HG23 H 1 0.755 0.030 . 1 . . . . 114 ILE HG2 . 26818 1 939 . 1 1 99 99 ILE HD11 H 1 0.755 0.030 . 1 . . . . 114 ILE HD1 . 26818 1 940 . 1 1 99 99 ILE HD12 H 1 0.755 0.030 . 1 . . . . 114 ILE HD1 . 26818 1 941 . 1 1 99 99 ILE HD13 H 1 0.755 0.030 . 1 . . . . 114 ILE HD1 . 26818 1 942 . 1 1 99 99 ILE C C 13 174.434 0.300 . 1 . . . . 114 ILE C . 26818 1 943 . 1 1 99 99 ILE CA C 13 63.199 0.300 . 1 . . . . 114 ILE CA . 26818 1 944 . 1 1 99 99 ILE CB C 13 35.934 0.300 . 1 . . . . 114 ILE CB . 26818 1 945 . 1 1 99 99 ILE CD1 C 13 13.989 0.300 . 1 . . . . 114 ILE CD . 26818 1 946 . 1 1 99 99 ILE N N 15 116.518 0.300 . 1 . . . . 114 ILE N . 26818 1 947 . 1 1 100 100 ALA H H 1 7.471 0.030 . 1 . . . . 115 ALA H . 26818 1 948 . 1 1 100 100 ALA HA H 1 4.083 0.030 . 1 . . . . 115 ALA HA . 26818 1 949 . 1 1 100 100 ALA HB1 H 1 1.401 0.030 . 1 . . . . 115 ALA HB . 26818 1 950 . 1 1 100 100 ALA HB2 H 1 1.401 0.030 . 1 . . . . 115 ALA HB . 26818 1 951 . 1 1 100 100 ALA HB3 H 1 1.401 0.030 . 1 . . . . 115 ALA HB . 26818 1 952 . 1 1 100 100 ALA C C 13 178.898 0.300 . 1 . . . . 115 ALA C . 26818 1 953 . 1 1 100 100 ALA CA C 13 52.671 0.300 . 1 . . . . 115 ALA CA . 26818 1 954 . 1 1 100 100 ALA CB C 13 15.04 0.300 . 1 . . . . 115 ALA CB . 26818 1 955 . 1 1 100 100 ALA N N 15 120.938 0.300 . 1 . . . . 115 ALA N . 26818 1 956 . 1 1 101 101 ASN H H 1 8.345 0.030 . 1 . . . . 116 ASN H . 26818 1 957 . 1 1 101 101 ASN HA H 1 4.715 0.030 . 1 . . . . 116 ASN HA . 26818 1 958 . 1 1 101 101 ASN HB2 H 1 2.87 0.030 . 2 . . . . 116 ASN HB2 . 26818 1 959 . 1 1 101 101 ASN HB3 H 1 2.536 0.030 . 2 . . . . 116 ASN HB3 . 26818 1 960 . 1 1 101 101 ASN C C 13 174.967 0.300 . 1 . . . . 116 ASN C . 26818 1 961 . 1 1 101 101 ASN CA C 13 54.932 0.300 . 1 . . . . 116 ASN CA . 26818 1 962 . 1 1 101 101 ASN CB C 13 35.912 0.300 . 1 . . . . 116 ASN CB . 26818 1 963 . 1 1 101 101 ASN N N 15 117.058 0.300 . 1 . . . . 116 ASN N . 26818 1 964 . 1 1 102 102 LEU H H 1 8.966 0.030 . 1 . . . . 117 LEU H . 26818 1 965 . 1 1 102 102 LEU HA H 1 4.058 0.030 . 1 . . . . 117 LEU HA . 26818 1 966 . 1 1 102 102 LEU HB2 H 1 1.726 0.030 . 2 . . . . 117 LEU HB2 . 26818 1 967 . 1 1 102 102 LEU HB3 H 1 1.598 0.030 . 2 . . . . 117 LEU HB3 . 26818 1 968 . 1 1 102 102 LEU HG H 1 1.48 0.030 . 1 . . . . 117 LEU HG . 26818 1 969 . 1 1 102 102 LEU C C 13 176.062 0.300 . 1 . . . . 117 LEU C . 26818 1 970 . 1 1 102 102 LEU CA C 13 55.434 0.300 . 1 . . . . 117 LEU CA . 26818 1 971 . 1 1 102 102 LEU CB C 13 39.62 0.300 . 1 . . . . 117 LEU CB . 26818 1 972 . 1 1 102 102 LEU N N 15 122.055 0.300 . 1 . . . . 117 LEU N . 26818 1 973 . 1 1 103 103 GLN H H 1 8.764 0.030 . 1 . . . . 118 GLN H . 26818 1 974 . 1 1 103 103 GLN HA H 1 3.965 0.030 . 1 . . . . 118 GLN HA . 26818 1 975 . 1 1 103 103 GLN HB2 H 1 1.978 0.030 . 2 . . . . 118 GLN HB2 . 26818 1 976 . 1 1 103 103 GLN HB3 H 1 1.978 0.030 . 2 . . . . 118 GLN HB3 . 26818 1 977 . 1 1 103 103 GLN HG2 H 1 2.447 0.030 . 2 . . . . 118 GLN HG2 . 26818 1 978 . 1 1 103 103 GLN HG3 H 1 2.289 0.030 . 2 . . . . 118 GLN HG3 . 26818 1 979 . 1 1 103 103 GLN C C 13 176.409 0.300 . 1 . . . . 118 GLN C . 26818 1 980 . 1 1 103 103 GLN CA C 13 56.503 0.300 . 1 . . . . 118 GLN CA . 26818 1 981 . 1 1 103 103 GLN CB C 13 25.216 0.300 . 1 . . . . 118 GLN CB . 26818 1 982 . 1 1 103 103 GLN CG C 13 33.486 0.300 . 1 . . . . 118 GLN CG . 26818 1 983 . 1 1 103 103 GLN N N 15 118.601 0.300 . 1 . . . . 118 GLN N . 26818 1 984 . 1 1 104 104 ARG H H 1 7.84 0.030 . 1 . . . . 119 ARG H . 26818 1 985 . 1 1 104 104 ARG HA H 1 3.967 0.030 . 1 . . . . 119 ARG HA . 26818 1 986 . 1 1 104 104 ARG HB2 H 1 1.567 0.030 . 2 . . . . 119 ARG HB2 . 26818 1 987 . 1 1 104 104 ARG HB3 H 1 1.792 0.030 . 2 . . . . 119 ARG HB3 . 26818 1 988 . 1 1 104 104 ARG HG2 H 1 1.733 0.030 . 2 . . . . 119 ARG HG2 . 26818 1 989 . 1 1 104 104 ARG HG3 H 1 1.733 0.030 . 2 . . . . 119 ARG HG3 . 26818 1 990 . 1 1 104 104 ARG HD2 H 1 2.981 0.030 . 2 . . . . 119 ARG HD2 . 26818 1 991 . 1 1 104 104 ARG HD3 H 1 2.981 0.030 . 2 . . . . 119 ARG HD3 . 26818 1 992 . 1 1 104 104 ARG C C 13 175.116 0.300 . 1 . . . . 119 ARG C . 26818 1 993 . 1 1 104 104 ARG CA C 13 55.985 0.300 . 1 . . . . 119 ARG CA . 26818 1 994 . 1 1 104 104 ARG CB C 13 26.421 0.300 . 1 . . . . 119 ARG CB . 26818 1 995 . 1 1 104 104 ARG CG C 13 23.901 0.300 . 1 . . . . 119 ARG CG . 26818 1 996 . 1 1 104 104 ARG CD C 13 39.273 0.300 . 1 . . . . 119 ARG CD . 26818 1 997 . 1 1 104 104 ARG N N 15 121 0.300 . 1 . . . . 119 ARG N . 26818 1 998 . 1 1 105 105 ALA H H 1 8.34 0.030 . 1 . . . . 120 ALA H . 26818 1 999 . 1 1 105 105 ALA HA H 1 3.705 0.030 . 1 . . . . 120 ALA HA . 26818 1 1000 . 1 1 105 105 ALA HB1 H 1 1.503 0.030 . 1 . . . . 120 ALA HB . 26818 1 1001 . 1 1 105 105 ALA HB2 H 1 1.503 0.030 . 1 . . . . 120 ALA HB . 26818 1 1002 . 1 1 105 105 ALA HB3 H 1 1.503 0.030 . 1 . . . . 120 ALA HB . 26818 1 1003 . 1 1 105 105 ALA C C 13 175.305 0.300 . 1 . . . . 120 ALA C . 26818 1 1004 . 1 1 105 105 ALA CA C 13 52.972 0.300 . 1 . . . . 120 ALA CA . 26818 1 1005 . 1 1 105 105 ALA CB C 13 14.772 0.300 . 1 . . . . 120 ALA CB . 26818 1 1006 . 1 1 105 105 ALA N N 15 120.225 0.300 . 1 . . . . 120 ALA N . 26818 1 1007 . 1 1 106 106 TYR H H 1 8.085 0.030 . 1 . . . . 121 TYR H . 26818 1 1008 . 1 1 106 106 TYR HA H 1 3.992 0.030 . 1 . . . . 121 TYR HA . 26818 1 1009 . 1 1 106 106 TYR HB2 H 1 3.148 0.030 . 2 . . . . 121 TYR HB2 . 26818 1 1010 . 1 1 106 106 TYR HB3 H 1 2.958 0.030 . 2 . . . . 121 TYR HB3 . 26818 1 1011 . 1 1 106 106 TYR C C 13 174.577 0.300 . 1 . . . . 121 TYR C . 26818 1 1012 . 1 1 106 106 TYR CA C 13 57.612 0.300 . 1 . . . . 121 TYR CA . 26818 1 1013 . 1 1 106 106 TYR CB C 13 35.31 0.300 . 1 . . . . 121 TYR CB . 26818 1 1014 . 1 1 106 106 TYR N N 15 116.373 0.300 . 1 . . . . 121 TYR N . 26818 1 1015 . 1 1 107 107 SER H H 1 8.334 0.030 . 1 . . . . 122 SER H . 26818 1 1016 . 1 1 107 107 SER HA H 1 4.057 0.030 . 1 . . . . 122 SER HA . 26818 1 1017 . 1 1 107 107 SER HB2 H 1 3.845 0.030 . 2 . . . . 122 SER HB2 . 26818 1 1018 . 1 1 107 107 SER HB3 H 1 3.845 0.030 . 2 . . . . 122 SER HB3 . 26818 1 1019 . 1 1 107 107 SER C C 13 175.026 0.300 . 1 . . . . 122 SER C . 26818 1 1020 . 1 1 107 107 SER CA C 13 59.228 0.300 . 1 . . . . 122 SER CA . 26818 1 1021 . 1 1 107 107 SER CB C 13 60.064 0.300 . 1 . . . . 122 SER CB . 26818 1 1022 . 1 1 107 107 SER N N 15 115.053 0.300 . 1 . . . . 122 SER N . 26818 1 1023 . 1 1 108 108 LEU H H 1 8.593 0.030 . 1 . . . . 123 LEU H . 26818 1 1024 . 1 1 108 108 LEU HA H 1 3.906 0.030 . 1 . . . . 123 LEU HA . 26818 1 1025 . 1 1 108 108 LEU HB2 H 1 1.552 0.030 . 2 . . . . 123 LEU HB2 . 26818 1 1026 . 1 1 108 108 LEU HB3 H 1 1.415 0.030 . 2 . . . . 123 LEU HB3 . 26818 1 1027 . 1 1 108 108 LEU HG H 1 1.119 0.030 . 1 . . . . 123 LEU HG . 26818 1 1028 . 1 1 108 108 LEU HD11 H 1 0.682 0.030 . 2 . . . . 123 LEU HD1 . 26818 1 1029 . 1 1 108 108 LEU HD12 H 1 0.682 0.030 . 2 . . . . 123 LEU HD1 . 26818 1 1030 . 1 1 108 108 LEU HD13 H 1 0.682 0.030 . 2 . . . . 123 LEU HD1 . 26818 1 1031 . 1 1 108 108 LEU HD21 H 1 0.682 0.030 . 2 . . . . 123 LEU HD2 . 26818 1 1032 . 1 1 108 108 LEU HD22 H 1 0.682 0.030 . 2 . . . . 123 LEU HD2 . 26818 1 1033 . 1 1 108 108 LEU HD23 H 1 0.682 0.030 . 2 . . . . 123 LEU HD2 . 26818 1 1034 . 1 1 108 108 LEU C C 13 175.472 0.300 . 1 . . . . 123 LEU C . 26818 1 1035 . 1 1 108 108 LEU CA C 13 54.987 0.300 . 1 . . . . 123 LEU CA . 26818 1 1036 . 1 1 108 108 LEU CB C 13 40.15 0.300 . 1 . . . . 123 LEU CB . 26818 1 1037 . 1 1 108 108 LEU CG C 13 23.342 0.300 . 1 . . . . 123 LEU CG . 26818 1 1038 . 1 1 108 108 LEU N N 15 123.269 0.300 . 1 . . . . 123 LEU N . 26818 1 1039 . 1 1 109 109 ALA H H 1 8.33 0.030 . 1 . . . . 124 ALA H . 26818 1 1040 . 1 1 109 109 ALA HA H 1 3.663 0.030 . 1 . . . . 124 ALA HA . 26818 1 1041 . 1 1 109 109 ALA HB1 H 1 1.302 0.030 . 1 . . . . 124 ALA HB . 26818 1 1042 . 1 1 109 109 ALA HB2 H 1 1.302 0.030 . 1 . . . . 124 ALA HB . 26818 1 1043 . 1 1 109 109 ALA HB3 H 1 1.302 0.030 . 1 . . . . 124 ALA HB . 26818 1 1044 . 1 1 109 109 ALA C C 13 177.259 0.300 . 1 . . . . 124 ALA C . 26818 1 1045 . 1 1 109 109 ALA CA C 13 53 0.300 . 1 . . . . 124 ALA CA . 26818 1 1046 . 1 1 109 109 ALA CB C 13 14.411 0.300 . 1 . . . . 124 ALA CB . 26818 1 1047 . 1 1 109 109 ALA N N 15 122.031 0.300 . 1 . . . . 124 ALA N . 26818 1 1048 . 1 1 110 110 LYS H H 1 7.601 0.030 . 1 . . . . 125 LYS H . 26818 1 1049 . 1 1 110 110 LYS HA H 1 3.934 0.030 . 1 . . . . 125 LYS HA . 26818 1 1050 . 1 1 110 110 LYS HB2 H 1 1.632 0.030 . 2 . . . . 125 LYS HB2 . 26818 1 1051 . 1 1 110 110 LYS HB3 H 1 1.632 0.030 . 2 . . . . 125 LYS HB3 . 26818 1 1052 . 1 1 110 110 LYS HG2 H 1 1.197 0.030 . 2 . . . . 125 LYS HG2 . 26818 1 1053 . 1 1 110 110 LYS HG3 H 1 1.126 0.030 . 2 . . . . 125 LYS HG3 . 26818 1 1054 . 1 1 110 110 LYS HD2 H 1 1.367 0.030 . 2 . . . . 125 LYS HD2 . 26818 1 1055 . 1 1 110 110 LYS HD3 H 1 1.367 0.030 . 2 . . . . 125 LYS HD3 . 26818 1 1056 . 1 1 110 110 LYS C C 13 177.837 0.300 . 1 . . . . 125 LYS C . 26818 1 1057 . 1 1 110 110 LYS CA C 13 56.244 0.300 . 1 . . . . 125 LYS CA . 26818 1 1058 . 1 1 110 110 LYS CB C 13 28.978 0.300 . 1 . . . . 125 LYS CB . 26818 1 1059 . 1 1 110 110 LYS CG C 13 21.815 0.300 . 1 . . . . 125 LYS CG . 26818 1 1060 . 1 1 110 110 LYS N N 15 117.011 0.300 . 1 . . . . 125 LYS N . 26818 1 1061 . 1 1 111 111 GLU H H 1 7.868 0.030 . 1 . . . . 126 GLU H . 26818 1 1062 . 1 1 111 111 GLU HA H 1 3.897 0.030 . 1 . . . . 126 GLU HA . 26818 1 1063 . 1 1 111 111 GLU HB2 H 1 2.064 0.030 . 2 . . . . 126 GLU HB2 . 26818 1 1064 . 1 1 111 111 GLU HB3 H 1 2.175 0.030 . 2 . . . . 126 GLU HB3 . 26818 1 1065 . 1 1 111 111 GLU HG2 H 1 2.291 0.030 . 2 . . . . 126 GLU HG2 . 26818 1 1066 . 1 1 111 111 GLU HG3 H 1 2.291 0.030 . 2 . . . . 126 GLU HG3 . 26818 1 1067 . 1 1 111 111 GLU C C 13 175.922 0.300 . 1 . . . . 126 GLU C . 26818 1 1068 . 1 1 111 111 GLU CA C 13 56.571 0.300 . 1 . . . . 126 GLU CA . 26818 1 1069 . 1 1 111 111 GLU CB C 13 26.691 0.300 . 1 . . . . 126 GLU CB . 26818 1 1070 . 1 1 111 111 GLU CG C 13 33.466 0.300 . 1 . . . . 126 GLU CG . 26818 1 1071 . 1 1 111 111 GLU N N 15 121.131 0.300 . 1 . . . . 126 GLU N . 26818 1 1072 . 1 1 112 112 GLN H H 1 8.049 0.030 . 1 . . . . 127 GLN H . 26818 1 1073 . 1 1 112 112 GLN HA H 1 3.995 0.030 . 1 . . . . 127 GLN HA . 26818 1 1074 . 1 1 112 112 GLN HB2 H 1 2.043 0.030 . 2 . . . . 127 GLN HB2 . 26818 1 1075 . 1 1 112 112 GLN HB3 H 1 2.136 0.030 . 2 . . . . 127 GLN HB3 . 26818 1 1076 . 1 1 112 112 GLN HG2 H 1 2.251 0.030 . 2 . . . . 127 GLN HG2 . 26818 1 1077 . 1 1 112 112 GLN HG3 H 1 2.496 0.030 . 2 . . . . 127 GLN HG3 . 26818 1 1078 . 1 1 112 112 GLN C C 13 172.078 0.300 . 1 . . . . 127 GLN C . 26818 1 1079 . 1 1 112 112 GLN CA C 13 53.215 0.300 . 1 . . . . 127 GLN CA . 26818 1 1080 . 1 1 112 112 GLN CB C 13 26.508 0.300 . 1 . . . . 127 GLN CB . 26818 1 1081 . 1 1 112 112 GLN CG C 13 33.588 0.300 . 1 . . . . 127 GLN CG . 26818 1 1082 . 1 1 112 112 GLN N N 15 115.534 0.300 . 1 . . . . 127 GLN N . 26818 1 1083 . 1 1 113 113 ARG H H 1 7.695 0.030 . 1 . . . . 128 ARG H . 26818 1 1084 . 1 1 113 113 ARG HA H 1 3.771 0.030 . 1 . . . . 128 ARG HA . 26818 1 1085 . 1 1 113 113 ARG HB2 H 1 1.958 0.030 . 2 . . . . 128 ARG HB2 . 26818 1 1086 . 1 1 113 113 ARG HB3 H 1 1.818 0.030 . 2 . . . . 128 ARG HB3 . 26818 1 1087 . 1 1 113 113 ARG C C 13 174.588 0.300 . 1 . . . . 128 ARG C . 26818 1 1088 . 1 1 113 113 ARG N N 15 116.737 0.300 . 1 . . . . 128 ARG N . 26818 1 1089 . 1 1 114 114 LEU H H 1 8.055 0.030 . 1 . . . . 129 LEU H . 26818 1 1090 . 1 1 114 114 LEU HA H 1 4.313 0.030 . 1 . . . . 129 LEU HA . 26818 1 1091 . 1 1 114 114 LEU HB2 H 1 1.454 0.030 . 2 . . . . 129 LEU HB2 . 26818 1 1092 . 1 1 114 114 LEU HB3 H 1 1.378 0.030 . 2 . . . . 129 LEU HB3 . 26818 1 1093 . 1 1 114 114 LEU HD11 H 1 0.916 0.030 . 2 . . . . 129 LEU HD1 . 26818 1 1094 . 1 1 114 114 LEU HD12 H 1 0.916 0.030 . 2 . . . . 129 LEU HD1 . 26818 1 1095 . 1 1 114 114 LEU HD13 H 1 0.916 0.030 . 2 . . . . 129 LEU HD1 . 26818 1 1096 . 1 1 114 114 LEU HD21 H 1 0.793 0.030 . 2 . . . . 129 LEU HD2 . 26818 1 1097 . 1 1 114 114 LEU HD22 H 1 0.793 0.030 . 2 . . . . 129 LEU HD2 . 26818 1 1098 . 1 1 114 114 LEU HD23 H 1 0.793 0.030 . 2 . . . . 129 LEU HD2 . 26818 1 1099 . 1 1 114 114 LEU CA C 13 51.252 0.300 . 1 . . . . 129 LEU CA . 26818 1 1100 . 1 1 114 114 LEU CB C 13 41.238 0.300 . 1 . . . . 129 LEU CB . 26818 1 1101 . 1 1 114 114 LEU CG C 13 24.02 0.300 . 1 . . . . 129 LEU CG . 26818 1 1102 . 1 1 114 114 LEU CD1 C 13 22.283 0.300 . 2 . . . . 129 LEU CD1 . 26818 1 1103 . 1 1 114 114 LEU CD2 C 13 20.801 0.300 . 2 . . . . 129 LEU CD2 . 26818 1 1104 . 1 1 114 114 LEU N N 15 118.445 0.300 . 1 . . . . 129 LEU N . 26818 1 1105 . 1 1 116 116 PHE HA H 1 4.554 0.030 . 1 . . . . 131 PHE HA . 26818 1 1106 . 1 1 116 116 PHE HB2 H 1 3.042 0.030 . 2 . . . . 131 PHE HB2 . 26818 1 1107 . 1 1 116 116 PHE HB3 H 1 2.823 0.030 . 2 . . . . 131 PHE HB3 . 26818 1 1108 . 1 1 116 116 PHE C C 13 173.178 0.300 . 1 . . . . 131 PHE C . 26818 1 1109 . 1 1 116 116 PHE CA C 13 54.188 0.300 . 1 . . . . 131 PHE CA . 26818 1 1110 . 1 1 116 116 PHE CB C 13 36.758 0.300 . 1 . . . . 131 PHE CB . 26818 1 1111 . 1 1 117 117 GLY H H 1 8.095 0.030 . 1 . . . . 132 GLY H . 26818 1 1112 . 1 1 117 117 GLY HA2 H 1 4.11 0.030 . 2 . . . . 132 GLY HA2 . 26818 1 1113 . 1 1 117 117 GLY HA3 H 1 3.836 0.030 . 2 . . . . 132 GLY HA3 . 26818 1 1114 . 1 1 117 117 GLY CA C 13 43.949 0.300 . 1 . . . . 132 GLY CA . 26818 1 1115 . 1 1 117 117 GLY N N 15 109.72 0.300 . 1 . . . . 132 GLY N . 26818 1 1116 . 1 1 121 121 PRO HA H 1 4.335 0.030 . 1 . . . . 136 PRO HA . 26818 1 1117 . 1 1 121 121 PRO HB2 H 1 2.175 0.030 . 2 . . . . 136 PRO HB2 . 26818 1 1118 . 1 1 121 121 PRO HB3 H 1 1.803 0.030 . 2 . . . . 136 PRO HB3 . 26818 1 1119 . 1 1 121 121 PRO HG2 H 1 1.899 0.030 . 2 . . . . 136 PRO HG2 . 26818 1 1120 . 1 1 121 121 PRO HG3 H 1 1.899 0.030 . 2 . . . . 136 PRO HG3 . 26818 1 1121 . 1 1 121 121 PRO C C 13 174.278 0.300 . 1 . . . . 136 PRO C . 26818 1 1122 . 1 1 121 121 PRO CA C 13 60.592 0.300 . 1 . . . . 136 PRO CA . 26818 1 1123 . 1 1 121 121 PRO CB C 13 29.352 0.300 . 1 . . . . 136 PRO CB . 26818 1 1124 . 1 1 121 121 PRO CG C 13 24.656 0.300 . 1 . . . . 136 PRO CG . 26818 1 1125 . 1 1 121 121 PRO CD C 13 48.125 0.300 . 1 . . . . 136 PRO CD . 26818 1 1126 . 1 1 122 122 SER H H 1 8.398 0.030 . 1 . . . . 137 SER H . 26818 1 1127 . 1 1 122 122 SER HA H 1 4.326 0.030 . 1 . . . . 137 SER HA . 26818 1 1128 . 1 1 122 122 SER HB2 H 1 3.901 0.030 . 2 . . . . 137 SER HB2 . 26818 1 1129 . 1 1 122 122 SER HB3 H 1 3.788 0.030 . 2 . . . . 137 SER HB3 . 26818 1 1130 . 1 1 122 122 SER C C 13 171.761 0.300 . 1 . . . . 137 SER C . 26818 1 1131 . 1 1 122 122 SER CA C 13 55.308 0.300 . 1 . . . . 137 SER CA . 26818 1 1132 . 1 1 122 122 SER CB C 13 61.405 0.300 . 1 . . . . 137 SER CB . 26818 1 1133 . 1 1 122 122 SER N N 15 116.495 0.300 . 1 . . . . 137 SER N . 26818 1 1134 . 1 1 123 123 ALA H H 1 8.365 0.030 . 1 . . . . 138 ALA H . 26818 1 1135 . 1 1 123 123 ALA HA H 1 4.14 0.030 . 1 . . . . 138 ALA HA . 26818 1 1136 . 1 1 123 123 ALA HB1 H 1 1.307 0.030 . 1 . . . . 138 ALA HB . 26818 1 1137 . 1 1 123 123 ALA HB2 H 1 1.307 0.030 . 1 . . . . 138 ALA HB . 26818 1 1138 . 1 1 123 123 ALA HB3 H 1 1.307 0.030 . 1 . . . . 138 ALA HB . 26818 1 1139 . 1 1 123 123 ALA C C 13 176.899 0.300 . 1 . . . . 138 ALA C . 26818 1 1140 . 1 1 123 123 ALA CA C 13 50.849 0.300 . 1 . . . . 138 ALA CA . 26818 1 1141 . 1 1 123 123 ALA CB C 13 15.959 0.300 . 1 . . . . 138 ALA CB . 26818 1 1142 . 1 1 123 123 ALA N N 15 125.111 0.300 . 1 . . . . 138 ALA N . 26818 1 1143 . 1 1 124 124 LEU H H 1 8.19 0.030 . 1 . . . . 139 LEU H . 26818 1 1144 . 1 1 124 124 LEU HA H 1 3.834 0.030 . 1 . . . . 139 LEU HA . 26818 1 1145 . 1 1 124 124 LEU HB2 H 1 1.554 0.030 . 2 . . . . 139 LEU HB2 . 26818 1 1146 . 1 1 124 124 LEU HB3 H 1 1.507 0.030 . 2 . . . . 139 LEU HB3 . 26818 1 1147 . 1 1 124 124 LEU HG H 1 1.423 0.030 . 1 . . . . 139 LEU HG . 26818 1 1148 . 1 1 124 124 LEU HD11 H 1 0.761 0.030 . 2 . . . . 139 LEU HD1 . 26818 1 1149 . 1 1 124 124 LEU HD12 H 1 0.761 0.030 . 2 . . . . 139 LEU HD1 . 26818 1 1150 . 1 1 124 124 LEU HD13 H 1 0.761 0.030 . 2 . . . . 139 LEU HD1 . 26818 1 1151 . 1 1 124 124 LEU HD21 H 1 0.761 0.030 . 2 . . . . 139 LEU HD2 . 26818 1 1152 . 1 1 124 124 LEU HD22 H 1 0.761 0.030 . 2 . . . . 139 LEU HD2 . 26818 1 1153 . 1 1 124 124 LEU HD23 H 1 0.761 0.030 . 2 . . . . 139 LEU HD2 . 26818 1 1154 . 1 1 124 124 LEU C C 13 175.18 0.300 . 1 . . . . 139 LEU C . 26818 1 1155 . 1 1 124 124 LEU CA C 13 55.392 0.300 . 1 . . . . 139 LEU CA . 26818 1 1156 . 1 1 124 124 LEU CB C 13 39.705 0.300 . 1 . . . . 139 LEU CB . 26818 1 1157 . 1 1 124 124 LEU CG C 13 26.344 0.300 . 1 . . . . 139 LEU CG . 26818 1 1158 . 1 1 124 124 LEU CD1 C 13 24.44 0.300 . 2 . . . . 139 LEU CD1 . 26818 1 1159 . 1 1 124 124 LEU CD2 C 13 23.196 0.300 . 2 . . . . 139 LEU CD2 . 26818 1 1160 . 1 1 124 124 LEU N N 15 118.734 0.300 . 1 . . . . 139 LEU N . 26818 1 1161 . 1 1 125 125 ARG H H 1 7.971 0.030 . 1 . . . . 140 ARG H . 26818 1 1162 . 1 1 125 125 ARG HA H 1 3.863 0.030 . 1 . . . . 140 ARG HA . 26818 1 1163 . 1 1 125 125 ARG HB2 H 1 1.929 0.030 . 2 . . . . 140 ARG HB2 . 26818 1 1164 . 1 1 125 125 ARG HB3 H 1 1.783 0.030 . 2 . . . . 140 ARG HB3 . 26818 1 1165 . 1 1 125 125 ARG HG2 H 1 1.429 0.030 . 2 . . . . 140 ARG HG2 . 26818 1 1166 . 1 1 125 125 ARG HG3 H 1 1.429 0.030 . 2 . . . . 140 ARG HG3 . 26818 1 1167 . 1 1 125 125 ARG HD2 H 1 3.192 0.030 . 2 . . . . 140 ARG HD2 . 26818 1 1168 . 1 1 125 125 ARG HD3 H 1 3.093 0.030 . 2 . . . . 140 ARG HD3 . 26818 1 1169 . 1 1 125 125 ARG C C 13 177.217 0.300 . 1 . . . . 140 ARG C . 26818 1 1170 . 1 1 125 125 ARG CA C 13 57.36 0.300 . 1 . . . . 140 ARG CA . 26818 1 1171 . 1 1 125 125 ARG CB C 13 27.576 0.300 . 1 . . . . 140 ARG CB . 26818 1 1172 . 1 1 125 125 ARG CG C 13 25.336 0.300 . 1 . . . . 140 ARG CG . 26818 1 1173 . 1 1 125 125 ARG CD C 13 40.821 0.300 . 1 . . . . 140 ARG CD . 26818 1 1174 . 1 1 125 125 ARG N N 15 118.541 0.300 . 1 . . . . 140 ARG N . 26818 1 1175 . 1 1 126 126 ILE H H 1 7.801 0.030 . 1 . . . . 141 ILE H . 26818 1 1176 . 1 1 126 126 ILE HA H 1 3.626 0.030 . 1 . . . . 141 ILE HA . 26818 1 1177 . 1 1 126 126 ILE HB H 1 1.864 0.030 . 1 . . . . 141 ILE HB . 26818 1 1178 . 1 1 126 126 ILE HG12 H 1 1.664 0.030 . 2 . . . . 141 ILE HG12 . 26818 1 1179 . 1 1 126 126 ILE HG13 H 1 1.086 0.030 . 2 . . . . 141 ILE HG13 . 26818 1 1180 . 1 1 126 126 ILE HG21 H 1 0.856 0.030 . 1 . . . . 141 ILE HG2 . 26818 1 1181 . 1 1 126 126 ILE HG22 H 1 0.856 0.030 . 1 . . . . 141 ILE HG2 . 26818 1 1182 . 1 1 126 126 ILE HG23 H 1 0.856 0.030 . 1 . . . . 141 ILE HG2 . 26818 1 1183 . 1 1 126 126 ILE HD11 H 1 0.77 0.030 . 1 . . . . 141 ILE HD1 . 26818 1 1184 . 1 1 126 126 ILE HD12 H 1 0.77 0.030 . 1 . . . . 141 ILE HD1 . 26818 1 1185 . 1 1 126 126 ILE HD13 H 1 0.77 0.030 . 1 . . . . 141 ILE HD1 . 26818 1 1186 . 1 1 126 126 ILE C C 13 175.108 0.300 . 1 . . . . 141 ILE C . 26818 1 1187 . 1 1 126 126 ILE CA C 13 62.015 0.300 . 1 . . . . 141 ILE CA . 26818 1 1188 . 1 1 126 126 ILE CB C 13 35.19 0.300 . 1 . . . . 141 ILE CB . 26818 1 1189 . 1 1 126 126 ILE CG1 C 13 26.655 0.300 . 1 . . . . 141 ILE CG1 . 26818 1 1190 . 1 1 126 126 ILE CG2 C 13 14.817 0.300 . 1 . . . . 141 ILE CG2 . 26818 1 1191 . 1 1 126 126 ILE N N 15 120.505 0.300 . 1 . . . . 141 ILE N . 26818 1 1192 . 1 1 127 127 ALA H H 1 8.364 0.030 . 1 . . . . 142 ALA H . 26818 1 1193 . 1 1 127 127 ALA HA H 1 3.833 0.030 . 1 . . . . 142 ALA HA . 26818 1 1194 . 1 1 127 127 ALA HB1 H 1 1.363 0.030 . 1 . . . . 142 ALA HB . 26818 1 1195 . 1 1 127 127 ALA HB2 H 1 1.363 0.030 . 1 . . . . 142 ALA HB . 26818 1 1196 . 1 1 127 127 ALA HB3 H 1 1.363 0.030 . 1 . . . . 142 ALA HB . 26818 1 1197 . 1 1 127 127 ALA C C 13 176.414 0.300 . 1 . . . . 142 ALA C . 26818 1 1198 . 1 1 127 127 ALA CA C 13 52.914 0.300 . 1 . . . . 142 ALA CA . 26818 1 1199 . 1 1 127 127 ALA CB C 13 16.619 0.300 . 1 . . . . 142 ALA CB . 26818 1 1200 . 1 1 127 127 ALA N N 15 122.389 0.300 . 1 . . . . 142 ALA N . 26818 1 1201 . 1 1 128 128 LYS H H 1 8.174 0.030 . 1 . . . . 143 LYS H . 26818 1 1202 . 1 1 128 128 LYS HA H 1 3.756 0.030 . 1 . . . . 143 LYS HA . 26818 1 1203 . 1 1 128 128 LYS HB2 H 1 1.712 0.030 . 2 . . . . 143 LYS HB2 . 26818 1 1204 . 1 1 128 128 LYS HB3 H 1 1.865 0.030 . 2 . . . . 143 LYS HB3 . 26818 1 1205 . 1 1 128 128 LYS HG2 H 1 1.545 0.030 . 2 . . . . 143 LYS HG2 . 26818 1 1206 . 1 1 128 128 LYS HG3 H 1 1.269 0.030 . 2 . . . . 143 LYS HG3 . 26818 1 1207 . 1 1 128 128 LYS HD2 H 1 1.802 0.030 . 2 . . . . 143 LYS HD2 . 26818 1 1208 . 1 1 128 128 LYS HD3 H 1 1.611 0.030 . 2 . . . . 143 LYS HD3 . 26818 1 1209 . 1 1 128 128 LYS HE2 H 1 2.172 0.030 . 2 . . . . 143 LYS HE2 . 26818 1 1210 . 1 1 128 128 LYS HE3 H 1 2.131 0.030 . 2 . . . . 143 LYS HE3 . 26818 1 1211 . 1 1 128 128 LYS C C 13 176.359 0.300 . 1 . . . . 143 LYS C . 26818 1 1212 . 1 1 128 128 LYS CA C 13 57.459 0.300 . 1 . . . . 143 LYS CA . 26818 1 1213 . 1 1 128 128 LYS CB C 13 29.902 0.300 . 1 . . . . 143 LYS CB . 26818 1 1214 . 1 1 128 128 LYS CG C 13 24.118 0.300 . 1 . . . . 143 LYS CG . 26818 1 1215 . 1 1 128 128 LYS N N 15 115.267 0.300 . 1 . . . . 143 LYS N . 26818 1 1216 . 1 1 129 129 LYS H H 1 7.672 0.030 . 1 . . . . 144 LYS H . 26818 1 1217 . 1 1 129 129 LYS HA H 1 4.213 0.030 . 1 . . . . 144 LYS HA . 26818 1 1218 . 1 1 129 129 LYS HB2 H 1 1.646 0.030 . 2 . . . . 144 LYS HB2 . 26818 1 1219 . 1 1 129 129 LYS HB3 H 1 1.726 0.030 . 2 . . . . 144 LYS HB3 . 26818 1 1220 . 1 1 129 129 LYS HG2 H 1 1.481 0.030 . 2 . . . . 144 LYS HG2 . 26818 1 1221 . 1 1 129 129 LYS HG3 H 1 1.481 0.030 . 2 . . . . 144 LYS HG3 . 26818 1 1222 . 1 1 129 129 LYS HE2 H 1 3.055 0.030 . 2 . . . . 144 LYS HE2 . 26818 1 1223 . 1 1 129 129 LYS HE3 H 1 3.055 0.030 . 2 . . . . 144 LYS HE3 . 26818 1 1224 . 1 1 129 129 LYS C C 13 175.85 0.300 . 1 . . . . 144 LYS C . 26818 1 1225 . 1 1 129 129 LYS CA C 13 56.218 0.300 . 1 . . . . 144 LYS CA . 26818 1 1226 . 1 1 129 129 LYS CB C 13 29.304 0.300 . 1 . . . . 144 LYS CB . 26818 1 1227 . 1 1 129 129 LYS CG C 13 21.838 0.300 . 1 . . . . 144 LYS CG . 26818 1 1228 . 1 1 129 129 LYS CD C 13 26.243 0.300 . 1 . . . . 144 LYS CD . 26818 1 1229 . 1 1 129 129 LYS CE C 13 38.961 0.300 . 1 . . . . 144 LYS CE . 26818 1 1230 . 1 1 129 129 LYS N N 15 120.902 0.300 . 1 . . . . 144 LYS N . 26818 1 1231 . 1 1 130 130 LYS H H 1 8.282 0.030 . 1 . . . . 145 LYS H . 26818 1 1232 . 1 1 130 130 LYS HA H 1 3.76 0.030 . 1 . . . . 145 LYS HA . 26818 1 1233 . 1 1 130 130 LYS HB2 H 1 1.475 0.030 . 2 . . . . 145 LYS HB2 . 26818 1 1234 . 1 1 130 130 LYS HB3 H 1 1.493 0.030 . 2 . . . . 145 LYS HB3 . 26818 1 1235 . 1 1 130 130 LYS HG2 H 1 1.301 0.030 . 2 . . . . 145 LYS HG2 . 26818 1 1236 . 1 1 130 130 LYS HG3 H 1 1.301 0.030 . 2 . . . . 145 LYS HG3 . 26818 1 1237 . 1 1 130 130 LYS HE2 H 1 2.878 0.030 . 2 . . . . 145 LYS HE2 . 26818 1 1238 . 1 1 130 130 LYS HE3 H 1 2.878 0.030 . 2 . . . . 145 LYS HE3 . 26818 1 1239 . 1 1 130 130 LYS C C 13 176.102 0.300 . 1 . . . . 145 LYS C . 26818 1 1240 . 1 1 130 130 LYS CA C 13 56.182 0.300 . 1 . . . . 145 LYS CA . 26818 1 1241 . 1 1 130 130 LYS CB C 13 29.072 0.300 . 1 . . . . 145 LYS CB . 26818 1 1242 . 1 1 130 130 LYS CG C 13 23.223 0.300 . 1 . . . . 145 LYS CG . 26818 1 1243 . 1 1 130 130 LYS CD C 13 32.242 0.300 . 1 . . . . 145 LYS CD . 26818 1 1244 . 1 1 130 130 LYS CE C 13 39.544 0.300 . 1 . . . . 145 LYS CE . 26818 1 1245 . 1 1 130 130 LYS N N 15 118.753 0.300 . 1 . . . . 145 LYS N . 26818 1 1246 . 1 1 131 131 ARG H H 1 7.723 0.030 . 1 . . . . 146 ARG H . 26818 1 1247 . 1 1 131 131 ARG C C 13 175.054 0.300 . 1 . . . . 146 ARG C . 26818 1 1248 . 1 1 131 131 ARG CA C 13 55.79 0.300 . 1 . . . . 146 ARG CA . 26818 1 1249 . 1 1 131 131 ARG CB C 13 27.328 0.300 . 1 . . . . 146 ARG CB . 26818 1 1250 . 1 1 131 131 ARG N N 15 119.178 0.300 . 1 . . . . 146 ARG N . 26818 1 1251 . 1 1 132 132 TRP H H 1 7.867 0.030 . 1 . . . . 147 TRP H . 26818 1 1252 . 1 1 132 132 TRP HA H 1 4.338 0.030 . 1 . . . . 147 TRP HA . 26818 1 1253 . 1 1 132 132 TRP HB2 H 1 3.292 0.030 . 2 . . . . 147 TRP HB2 . 26818 1 1254 . 1 1 132 132 TRP HB3 H 1 3.202 0.030 . 2 . . . . 147 TRP HB3 . 26818 1 1255 . 1 1 132 132 TRP C C 13 174.645 0.300 . 1 . . . . 147 TRP C . 26818 1 1256 . 1 1 132 132 TRP CA C 13 56.719 0.300 . 1 . . . . 147 TRP CA . 26818 1 1257 . 1 1 132 132 TRP CB C 13 26.27 0.300 . 1 . . . . 147 TRP CB . 26818 1 1258 . 1 1 132 132 TRP N N 15 120.12 0.300 . 1 . . . . 147 TRP N . 26818 1 1259 . 1 1 133 133 ASN H H 1 8.233 0.030 . 1 . . . . 148 ASN H . 26818 1 1260 . 1 1 133 133 ASN HA H 1 4.35 0.030 . 1 . . . . 148 ASN HA . 26818 1 1261 . 1 1 133 133 ASN HB2 H 1 2.713 0.030 . 2 . . . . 148 ASN HB2 . 26818 1 1262 . 1 1 133 133 ASN HB3 H 1 2.713 0.030 . 2 . . . . 148 ASN HB3 . 26818 1 1263 . 1 1 133 133 ASN C C 13 173.418 0.300 . 1 . . . . 148 ASN C . 26818 1 1264 . 1 1 133 133 ASN CA C 13 52.282 0.300 . 1 . . . . 148 ASN CA . 26818 1 1265 . 1 1 133 133 ASN CB C 13 35.899 0.300 . 1 . . . . 148 ASN CB . 26818 1 1266 . 1 1 133 133 ASN N N 15 117.373 0.300 . 1 . . . . 148 ASN N . 26818 1 1267 . 1 1 134 134 SER H H 1 7.739 0.030 . 1 . . . . 149 SER H . 26818 1 1268 . 1 1 134 134 SER HA H 1 4.248 0.030 . 1 . . . . 149 SER HA . 26818 1 1269 . 1 1 134 134 SER HB2 H 1 3.859 0.030 . 2 . . . . 149 SER HB2 . 26818 1 1270 . 1 1 134 134 SER HB3 H 1 3.832 0.030 . 2 . . . . 149 SER HB3 . 26818 1 1271 . 1 1 134 134 SER C C 13 172.584 0.300 . 1 . . . . 149 SER C . 26818 1 1272 . 1 1 134 134 SER CA C 13 57.202 0.300 . 1 . . . . 149 SER CA . 26818 1 1273 . 1 1 134 134 SER CB C 13 60.844 0.300 . 1 . . . . 149 SER CB . 26818 1 1274 . 1 1 134 134 SER N N 15 114.474 0.300 . 1 . . . . 149 SER N . 26818 1 1275 . 1 1 135 135 ILE H H 1 7.611 0.030 . 1 . . . . 150 ILE H . 26818 1 1276 . 1 1 135 135 ILE HA H 1 3.905 0.030 . 1 . . . . 150 ILE HA . 26818 1 1277 . 1 1 135 135 ILE HB H 1 1.724 0.030 . 1 . . . . 150 ILE HB . 26818 1 1278 . 1 1 135 135 ILE HG12 H 1 1.407 0.030 . 2 . . . . 150 ILE HG12 . 26818 1 1279 . 1 1 135 135 ILE HG13 H 1 1.041 0.030 . 2 . . . . 150 ILE HG13 . 26818 1 1280 . 1 1 135 135 ILE HG21 H 1 0.724 0.030 . 1 . . . . 150 ILE HG2 . 26818 1 1281 . 1 1 135 135 ILE HG22 H 1 0.724 0.030 . 1 . . . . 150 ILE HG2 . 26818 1 1282 . 1 1 135 135 ILE HG23 H 1 0.724 0.030 . 1 . . . . 150 ILE HG2 . 26818 1 1283 . 1 1 135 135 ILE C C 13 174.515 0.300 . 1 . . . . 150 ILE C . 26818 1 1284 . 1 1 135 135 ILE CA C 13 59.895 0.300 . 1 . . . . 150 ILE CA . 26818 1 1285 . 1 1 135 135 ILE CB C 13 35.699 0.300 . 1 . . . . 150 ILE CB . 26818 1 1286 . 1 1 135 135 ILE CG1 C 13 25.063 0.300 . 1 . . . . 150 ILE CG1 . 26818 1 1287 . 1 1 135 135 ILE CG2 C 13 14.584 0.300 . 1 . . . . 150 ILE CG2 . 26818 1 1288 . 1 1 135 135 ILE CD1 C 13 10.394 0.300 . 1 . . . . 150 ILE CD1 . 26818 1 1289 . 1 1 135 135 ILE N N 15 121.309 0.300 . 1 . . . . 150 ILE N . 26818 1 1290 . 1 1 136 136 GLU H H 1 7.969 0.030 . 1 . . . . 151 GLU H . 26818 1 1291 . 1 1 136 136 GLU HA H 1 3.953 0.030 . 1 . . . . 151 GLU HA . 26818 1 1292 . 1 1 136 136 GLU HB2 H 1 1.774 0.030 . 2 . . . . 151 GLU HB2 . 26818 1 1293 . 1 1 136 136 GLU HB3 H 1 1.628 0.030 . 2 . . . . 151 GLU HB3 . 26818 1 1294 . 1 1 136 136 GLU HG2 H 1 1.91 0.030 . 2 . . . . 151 GLU HG2 . 26818 1 1295 . 1 1 136 136 GLU HG3 H 1 1.91 0.030 . 2 . . . . 151 GLU HG3 . 26818 1 1296 . 1 1 136 136 GLU C C 13 174.357 0.300 . 1 . . . . 151 GLU C . 26818 1 1297 . 1 1 136 136 GLU CA C 13 54.61 0.300 . 1 . . . . 151 GLU CA . 26818 1 1298 . 1 1 136 136 GLU CB C 13 27.221 0.300 . 1 . . . . 151 GLU CB . 26818 1 1299 . 1 1 136 136 GLU CG C 13 33.244 0.300 . 1 . . . . 151 GLU CG . 26818 1 1300 . 1 1 136 136 GLU N N 15 121.9 0.300 . 1 . . . . 151 GLU N . 26818 1 1301 . 1 1 137 137 GLU H H 1 7.977 0.030 . 1 . . . . 152 GLU H . 26818 1 1302 . 1 1 137 137 GLU HA H 1 4.086 0.030 . 1 . . . . 152 GLU HA . 26818 1 1303 . 1 1 137 137 GLU HB2 H 1 1.865 0.030 . 2 . . . . 152 GLU HB2 . 26818 1 1304 . 1 1 137 137 GLU HB3 H 1 1.925 0.030 . 2 . . . . 152 GLU HB3 . 26818 1 1305 . 1 1 137 137 GLU HG2 H 1 2.113 0.030 . 2 . . . . 152 GLU HG2 . 26818 1 1306 . 1 1 137 137 GLU HG3 H 1 2.183 0.030 . 2 . . . . 152 GLU HG3 . 26818 1 1307 . 1 1 137 137 GLU C C 13 173.631 0.300 . 1 . . . . 152 GLU C . 26818 1 1308 . 1 1 137 137 GLU CA C 13 54.162 0.300 . 1 . . . . 152 GLU CA . 26818 1 1309 . 1 1 137 137 GLU CB C 13 27.036 0.300 . 1 . . . . 152 GLU CB . 26818 1 1310 . 1 1 137 137 GLU CG C 13 33.662 0.300 . 1 . . . . 152 GLU CG . 26818 1 1311 . 1 1 137 137 GLU N N 15 119.978 0.300 . 1 . . . . 152 GLU N . 26818 1 1312 . 1 1 138 138 ARG H H 1 7.883 0.030 . 1 . . . . 153 ARG H . 26818 1 1313 . 1 1 138 138 ARG HA H 1 4.226 0.030 . 1 . . . . 153 ARG HA . 26818 1 1314 . 1 1 138 138 ARG HB2 H 1 1.763 0.030 . 2 . . . . 153 ARG HB2 . 26818 1 1315 . 1 1 138 138 ARG HB3 H 1 1.677 0.030 . 2 . . . . 153 ARG HB3 . 26818 1 1316 . 1 1 138 138 ARG HG2 H 1 1.634 0.030 . 2 . . . . 153 ARG HG2 . 26818 1 1317 . 1 1 138 138 ARG HG3 H 1 1.554 0.030 . 2 . . . . 153 ARG HG3 . 26818 1 1318 . 1 1 138 138 ARG HD2 H 1 3.057 0.030 . 2 . . . . 153 ARG HD2 . 26818 1 1319 . 1 1 138 138 ARG HD3 H 1 2.88 0.030 . 2 . . . . 153 ARG HD3 . 26818 1 1320 . 1 1 138 138 ARG C C 13 172.647 0.300 . 1 . . . . 153 ARG C . 26818 1 1321 . 1 1 138 138 ARG CA C 13 53.305 0.300 . 1 . . . . 153 ARG CA . 26818 1 1322 . 1 1 138 138 ARG CB C 13 30.266 0.300 . 1 . . . . 153 ARG CB . 26818 1 1323 . 1 1 138 138 ARG CG C 13 27.779 0.300 . 1 . . . . 153 ARG CG . 26818 1 1324 . 1 1 138 138 ARG CD C 13 40.643 0.300 . 1 . . . . 153 ARG CD . 26818 1 1325 . 1 1 138 138 ARG N N 15 121.555 0.300 . 1 . . . . 153 ARG N . 26818 1 1326 . 1 1 139 139 ARG H H 1 7.768 0.030 . 1 . . . . 154 ARG H . 26818 1 1327 . 1 1 139 139 ARG C C 13 178.397 0.300 . 1 . . . . 154 ARG C . 26818 1 1328 . 1 1 139 139 ARG CA C 13 54.966 0.300 . 1 . . . . 154 ARG CA . 26818 1 1329 . 1 1 139 139 ARG CB C 13 28.68 0.300 . 1 . . . . 154 ARG CB . 26818 1 1330 . 1 1 139 139 ARG N N 15 127.611 0.300 . 1 . . . . 154 ARG N . 26818 1 stop_ save_