data_12024 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 12024 _Entry.Title ; Resonance assignments of a cellulosomal double-dockerin from Clostridium thermocellum ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2018-09-28 _Entry.Accession_date 2018-09-28 _Entry.Last_release_date 2018-09-28 _Entry.Original_release_date 2018-09-28 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.0.16 _Entry.Original_NMR_STAR_version 3.2.0.16 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 Chao Chen . . . . 12024 2 Hongwu Yang . . . . 12024 3 Qiu Cui . . . . 12024 4 Yingang Feng . . . . 12024 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 12024 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 615 12024 '15N chemical shifts' 163 12024 '1H chemical shifts' 1008 12024 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2018-12-11 . original BMRB . 12024 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 12024 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI 10.1007/s12104-018-9859-7 _Citation.PubMed_ID 30377946 _Citation.Full_citation . _Citation.Title ; Resonance assignments of a cellulosomal double-dockerin from Clostridium thermocellum. ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assign.' _Citation.Journal_name_full 'Biomolecular NMR assignments' _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN 1874-2718 _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first . _Citation.Page_last . _Citation.Year 2018 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Chao Chen . . . . 12024 1 2 Hongwu Yang . . . . 12024 1 3 Jinsong Xuan . . . . 12024 1 4 Qiu Cui . . . . 12024 1 5 Yingang Feng . . . . 12024 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 12024 _Assembly.ID 1 _Assembly.Name 'cellulosomal double-dockerin' _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 protein 1 $dDoc_0689 A . yes native no no . . . 12024 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_dDoc_0689 _Entity.Sf_category entity _Entity.Sf_framecode dDoc_0689 _Entity.Entry_ID 12024 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name dDoc_0689 _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 ; MSVKIGDIDGNGEISSIDYA ILKSHLINSNLTFKQLAAAD VDGNGYVNSIDLAILQMYLL GKGGTSDIGKNRIYTYGDID NNGIVDENDYILICNHINGT GQLSDASLFAADADGNNVID QTDRILIEKYITGRITHLPV GNQLEHHHHHH ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 151 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_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 . yes UNP A3DK52 . . . . . . . . . . . . . . . . 12024 1 . yes GB ADU73768 . . . . . . . . . . . . . . . . 12024 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 1 MET . 12024 1 2 2 SER . 12024 1 3 3 VAL . 12024 1 4 4 LYS . 12024 1 5 5 ILE . 12024 1 6 6 GLY . 12024 1 7 7 ASP . 12024 1 8 8 ILE . 12024 1 9 9 ASP . 12024 1 10 10 GLY . 12024 1 11 11 ASN . 12024 1 12 12 GLY . 12024 1 13 13 GLU . 12024 1 14 14 ILE . 12024 1 15 15 SER . 12024 1 16 16 SER . 12024 1 17 17 ILE . 12024 1 18 18 ASP . 12024 1 19 19 TYR . 12024 1 20 20 ALA . 12024 1 21 21 ILE . 12024 1 22 22 LEU . 12024 1 23 23 LYS . 12024 1 24 24 SER . 12024 1 25 25 HIS . 12024 1 26 26 LEU . 12024 1 27 27 ILE . 12024 1 28 28 ASN . 12024 1 29 29 SER . 12024 1 30 30 ASN . 12024 1 31 31 LEU . 12024 1 32 32 THR . 12024 1 33 33 PHE . 12024 1 34 34 LYS . 12024 1 35 35 GLN . 12024 1 36 36 LEU . 12024 1 37 37 ALA . 12024 1 38 38 ALA . 12024 1 39 39 ALA . 12024 1 40 40 ASP . 12024 1 41 41 VAL . 12024 1 42 42 ASP . 12024 1 43 43 GLY . 12024 1 44 44 ASN . 12024 1 45 45 GLY . 12024 1 46 46 TYR . 12024 1 47 47 VAL . 12024 1 48 48 ASN . 12024 1 49 49 SER . 12024 1 50 50 ILE . 12024 1 51 51 ASP . 12024 1 52 52 LEU . 12024 1 53 53 ALA . 12024 1 54 54 ILE . 12024 1 55 55 LEU . 12024 1 56 56 GLN . 12024 1 57 57 MET . 12024 1 58 58 TYR . 12024 1 59 59 LEU . 12024 1 60 60 LEU . 12024 1 61 61 GLY . 12024 1 62 62 LYS . 12024 1 63 63 GLY . 12024 1 64 64 GLY . 12024 1 65 65 THR . 12024 1 66 66 SER . 12024 1 67 67 ASP . 12024 1 68 68 ILE . 12024 1 69 69 GLY . 12024 1 70 70 LYS . 12024 1 71 71 ASN . 12024 1 72 72 ARG . 12024 1 73 73 ILE . 12024 1 74 74 TYR . 12024 1 75 75 THR . 12024 1 76 76 TYR . 12024 1 77 77 GLY . 12024 1 78 78 ASP . 12024 1 79 79 ILE . 12024 1 80 80 ASP . 12024 1 81 81 ASN . 12024 1 82 82 ASN . 12024 1 83 83 GLY . 12024 1 84 84 ILE . 12024 1 85 85 VAL . 12024 1 86 86 ASP . 12024 1 87 87 GLU . 12024 1 88 88 ASN . 12024 1 89 89 ASP . 12024 1 90 90 TYR . 12024 1 91 91 ILE . 12024 1 92 92 LEU . 12024 1 93 93 ILE . 12024 1 94 94 CYS . 12024 1 95 95 ASN . 12024 1 96 96 HIS . 12024 1 97 97 ILE . 12024 1 98 98 ASN . 12024 1 99 99 GLY . 12024 1 100 100 THR . 12024 1 101 101 GLY . 12024 1 102 102 GLN . 12024 1 103 103 LEU . 12024 1 104 104 SER . 12024 1 105 105 ASP . 12024 1 106 106 ALA . 12024 1 107 107 SER . 12024 1 108 108 LEU . 12024 1 109 109 PHE . 12024 1 110 110 ALA . 12024 1 111 111 ALA . 12024 1 112 112 ASP . 12024 1 113 113 ALA . 12024 1 114 114 ASP . 12024 1 115 115 GLY . 12024 1 116 116 ASN . 12024 1 117 117 ASN . 12024 1 118 118 VAL . 12024 1 119 119 ILE . 12024 1 120 120 ASP . 12024 1 121 121 GLN . 12024 1 122 122 THR . 12024 1 123 123 ASP . 12024 1 124 124 ARG . 12024 1 125 125 ILE . 12024 1 126 126 LEU . 12024 1 127 127 ILE . 12024 1 128 128 GLU . 12024 1 129 129 LYS . 12024 1 130 130 TYR . 12024 1 131 131 ILE . 12024 1 132 132 THR . 12024 1 133 133 GLY . 12024 1 134 134 ARG . 12024 1 135 135 ILE . 12024 1 136 136 THR . 12024 1 137 137 HIS . 12024 1 138 138 LEU . 12024 1 139 139 PRO . 12024 1 140 140 VAL . 12024 1 141 141 GLY . 12024 1 142 142 ASN . 12024 1 143 143 GLN . 12024 1 144 144 LEU . 12024 1 145 145 GLU . 12024 1 146 146 HIS . 12024 1 147 147 HIS . 12024 1 148 148 HIS . 12024 1 149 149 HIS . 12024 1 150 150 HIS . 12024 1 151 151 HIS . 12024 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 12024 1 . SER 2 2 12024 1 . VAL 3 3 12024 1 . LYS 4 4 12024 1 . ILE 5 5 12024 1 . GLY 6 6 12024 1 . ASP 7 7 12024 1 . ILE 8 8 12024 1 . ASP 9 9 12024 1 . GLY 10 10 12024 1 . ASN 11 11 12024 1 . GLY 12 12 12024 1 . GLU 13 13 12024 1 . ILE 14 14 12024 1 . SER 15 15 12024 1 . SER 16 16 12024 1 . ILE 17 17 12024 1 . ASP 18 18 12024 1 . TYR 19 19 12024 1 . ALA 20 20 12024 1 . ILE 21 21 12024 1 . LEU 22 22 12024 1 . LYS 23 23 12024 1 . SER 24 24 12024 1 . HIS 25 25 12024 1 . LEU 26 26 12024 1 . ILE 27 27 12024 1 . ASN 28 28 12024 1 . SER 29 29 12024 1 . ASN 30 30 12024 1 . LEU 31 31 12024 1 . THR 32 32 12024 1 . PHE 33 33 12024 1 . LYS 34 34 12024 1 . GLN 35 35 12024 1 . LEU 36 36 12024 1 . ALA 37 37 12024 1 . ALA 38 38 12024 1 . ALA 39 39 12024 1 . ASP 40 40 12024 1 . VAL 41 41 12024 1 . ASP 42 42 12024 1 . GLY 43 43 12024 1 . ASN 44 44 12024 1 . GLY 45 45 12024 1 . TYR 46 46 12024 1 . VAL 47 47 12024 1 . ASN 48 48 12024 1 . SER 49 49 12024 1 . ILE 50 50 12024 1 . ASP 51 51 12024 1 . LEU 52 52 12024 1 . ALA 53 53 12024 1 . ILE 54 54 12024 1 . LEU 55 55 12024 1 . GLN 56 56 12024 1 . MET 57 57 12024 1 . TYR 58 58 12024 1 . LEU 59 59 12024 1 . LEU 60 60 12024 1 . GLY 61 61 12024 1 . LYS 62 62 12024 1 . GLY 63 63 12024 1 . GLY 64 64 12024 1 . THR 65 65 12024 1 . SER 66 66 12024 1 . ASP 67 67 12024 1 . ILE 68 68 12024 1 . GLY 69 69 12024 1 . LYS 70 70 12024 1 . ASN 71 71 12024 1 . ARG 72 72 12024 1 . ILE 73 73 12024 1 . TYR 74 74 12024 1 . THR 75 75 12024 1 . TYR 76 76 12024 1 . GLY 77 77 12024 1 . ASP 78 78 12024 1 . ILE 79 79 12024 1 . ASP 80 80 12024 1 . ASN 81 81 12024 1 . ASN 82 82 12024 1 . GLY 83 83 12024 1 . ILE 84 84 12024 1 . VAL 85 85 12024 1 . ASP 86 86 12024 1 . GLU 87 87 12024 1 . ASN 88 88 12024 1 . ASP 89 89 12024 1 . TYR 90 90 12024 1 . ILE 91 91 12024 1 . LEU 92 92 12024 1 . ILE 93 93 12024 1 . CYS 94 94 12024 1 . ASN 95 95 12024 1 . HIS 96 96 12024 1 . ILE 97 97 12024 1 . ASN 98 98 12024 1 . GLY 99 99 12024 1 . THR 100 100 12024 1 . GLY 101 101 12024 1 . GLN 102 102 12024 1 . LEU 103 103 12024 1 . SER 104 104 12024 1 . ASP 105 105 12024 1 . ALA 106 106 12024 1 . SER 107 107 12024 1 . LEU 108 108 12024 1 . PHE 109 109 12024 1 . ALA 110 110 12024 1 . ALA 111 111 12024 1 . ASP 112 112 12024 1 . ALA 113 113 12024 1 . ASP 114 114 12024 1 . GLY 115 115 12024 1 . ASN 116 116 12024 1 . ASN 117 117 12024 1 . VAL 118 118 12024 1 . ILE 119 119 12024 1 . ASP 120 120 12024 1 . GLN 121 121 12024 1 . THR 122 122 12024 1 . ASP 123 123 12024 1 . ARG 124 124 12024 1 . ILE 125 125 12024 1 . LEU 126 126 12024 1 . ILE 127 127 12024 1 . GLU 128 128 12024 1 . LYS 129 129 12024 1 . TYR 130 130 12024 1 . ILE 131 131 12024 1 . THR 132 132 12024 1 . GLY 133 133 12024 1 . ARG 134 134 12024 1 . ILE 135 135 12024 1 . THR 136 136 12024 1 . HIS 137 137 12024 1 . LEU 138 138 12024 1 . PRO 139 139 12024 1 . VAL 140 140 12024 1 . GLY 141 141 12024 1 . ASN 142 142 12024 1 . GLN 143 143 12024 1 . LEU 144 144 12024 1 . GLU 145 145 12024 1 . HIS 146 146 12024 1 . HIS 147 147 12024 1 . HIS 148 148 12024 1 . HIS 149 149 12024 1 . HIS 150 150 12024 1 . HIS 151 151 12024 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 12024 _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 $dDoc_0689 . 1515 organism . 'Hungateiclostridium thermocellum' 'Clostridium thermocellum' . . Bacteria . Hungateiclostridium thermocellum DSM1313 . . . . . . . . . . Clo1313_0689 . 12024 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 12024 _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 $dDoc_0689 . 'recombinant technology' 'Escherichia coli' . . 469008 Escherichia coli BL21(DE3) . . . . . pET30a . . . 12024 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 12024 _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 dDoc_0689 '[U-13C; U-15N]' 1 $assembly 1 $dDoc_0689 . proteni 0.6 . . mM 0.1 . . . 12024 1 2 'sodium acetate' 'natural abundance' . . . . . buffer 50 . . mM . . . . 12024 1 3 'potassium chloride' 'natural abundance' . . . . . salt 50 . . mM . . . . 12024 1 4 CaCl2 'natural abundance' . . . . . salt 10 . . mM . . . . 12024 1 5 DTT 'natural abundance' . . . . . . 3 . . mM . . . . 12024 1 6 DSS 'natural abundance' . . . . . . 0.02 . . '% w/v' . . . . 12024 1 7 'protease inhibitor cocktail (Roche)' 'natural abundance' . . . . . . 0.4 . . tablet/100mL . . . . 12024 1 8 H2O 'natural abundance' . . . . . solvent 90 . . % . . . . 12024 1 9 D2O [U-2H] . . . . . solvent 10 . . % . . . . 12024 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 12024 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 120 . mM 12024 1 pH 4.9 . pH 12024 1 pressure 1 . atm 12024 1 temperature 298 . K 12024 1 stop_ save_ ############################ # Computer software used # ############################ save_TOPSPIN _Software.Sf_category software _Software.Sf_framecode TOPSPIN _Software.Entry_ID 12024 _Software.ID 1 _Software.Type . _Software.Name TOPSPIN _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 12024 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 12024 1 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 12024 _Software.ID 2 _Software.Type . _Software.Name NMRPipe _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 12024 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 12024 2 stop_ save_ save_NMRView _Software.Sf_category software _Software.Sf_framecode NMRView _Software.Entry_ID 12024 _Software.ID 3 _Software.Type . _Software.Name NMRView _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Johnson, One Moon Scientific' . . 12024 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 12024 3 'data analysis' 12024 3 'peak picking' 12024 3 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID 12024 _NMR_spectrometer.ID 1 _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 12024 _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 NMR_spectrometer_1 Bruker Avance . 600 . . . 12024 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 12024 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 12024 1 2 '2D 1H-13C HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 12024 1 3 '2D 1H-13C HSQC aromatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 12024 1 4 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 12024 1 5 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 12024 1 6 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 12024 1 7 '3D HBHA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 12024 1 8 '3D HN(CA)CO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 12024 1 9 '3D HBHANH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 12024 1 10 '3D HA(CA)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 12024 1 11 '3D HA(CA)(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 12024 1 12 '3D HCCH-TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 12024 1 13 '3D CCH-TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 12024 1 14 '3D HCCH-COSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 12024 1 15 '3D 1H-13C NOESY aliphatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 12024 1 16 '3D 1H-13C NOESY aromatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 12024 1 17 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 12024 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 12024 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . 12024 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . 12024 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . 12024 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 12024 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' 1 $sample_1 isotropic 12024 1 2 '2D 1H-13C HSQC' 1 $sample_1 isotropic 12024 1 3 '2D 1H-13C HSQC aromatic' 1 $sample_1 isotropic 12024 1 4 '3D CBCA(CO)NH' 1 $sample_1 isotropic 12024 1 5 '3D HNCACB' 1 $sample_1 isotropic 12024 1 6 '3D HNCO' 1 $sample_1 isotropic 12024 1 7 '3D HBHA(CO)NH' 1 $sample_1 isotropic 12024 1 8 '3D HN(CA)CO' 1 $sample_1 isotropic 12024 1 9 '3D HBHANH' 1 $sample_1 isotropic 12024 1 10 '3D HA(CA)NH' 1 $sample_1 isotropic 12024 1 11 '3D HA(CA)(CO)NH' 1 $sample_1 isotropic 12024 1 12 '3D HCCH-TOCSY' 1 $sample_1 isotropic 12024 1 13 '3D CCH-TOCSY' 1 $sample_1 isotropic 12024 1 14 '3D HCCH-COSY' 1 $sample_1 isotropic 12024 1 15 '3D 1H-13C NOESY aliphatic' 1 $sample_1 isotropic 12024 1 16 '3D 1H-13C NOESY aromatic' 1 $sample_1 isotropic 12024 1 17 '3D 1H-15N NOESY' 1 $sample_1 isotropic 12024 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 2 2 SER HA H 1 4.4510 0.02 . 1 . . . . . 2 SER HA . 12024 1 2 . 1 1 2 2 SER HB2 H 1 3.9230 0.02 . 2 . . . . . 2 SER HB2 . 12024 1 3 . 1 1 2 2 SER HB3 H 1 3.7860 0.02 . 2 . . . . . 2 SER HB3 . 12024 1 4 . 1 1 2 2 SER C C 13 170.2470 0.3 . 1 . . . . . 2 SER C . 12024 1 5 . 1 1 2 2 SER CA C 13 57.4570 0.3 . 1 . . . . . 2 SER CA . 12024 1 6 . 1 1 2 2 SER CB C 13 63.5250 0.3 . 1 . . . . . 2 SER CB . 12024 1 7 . 1 1 3 3 VAL H H 1 8.8280 0.02 . 1 . . . . . 3 VAL H . 12024 1 8 . 1 1 3 3 VAL HA H 1 4.1460 0.02 . 1 . . . . . 3 VAL HA . 12024 1 9 . 1 1 3 3 VAL HB H 1 1.9690 0.02 . 1 . . . . . 3 VAL HB . 12024 1 10 . 1 1 3 3 VAL HG11 H 1 0.6350 0.02 . 2 . . . . . 3 VAL HG11 . 12024 1 11 . 1 1 3 3 VAL HG12 H 1 0.6350 0.02 . 2 . . . . . 3 VAL HG11 . 12024 1 12 . 1 1 3 3 VAL HG13 H 1 0.6350 0.02 . 2 . . . . . 3 VAL HG11 . 12024 1 13 . 1 1 3 3 VAL HG21 H 1 0.6160 0.02 . 2 . . . . . 3 VAL HG21 . 12024 1 14 . 1 1 3 3 VAL HG22 H 1 0.6160 0.02 . 2 . . . . . 3 VAL HG21 . 12024 1 15 . 1 1 3 3 VAL HG23 H 1 0.6160 0.02 . 2 . . . . . 3 VAL HG21 . 12024 1 16 . 1 1 3 3 VAL C C 13 173.4720 0.3 . 1 . . . . . 3 VAL C . 12024 1 17 . 1 1 3 3 VAL CA C 13 61.5650 0.3 . 1 . . . . . 3 VAL CA . 12024 1 18 . 1 1 3 3 VAL CB C 13 34.5600 0.3 . 1 . . . . . 3 VAL CB . 12024 1 19 . 1 1 3 3 VAL CG1 C 13 20.8700 0.3 . 2 . . . . . 3 VAL CG1 . 12024 1 20 . 1 1 3 3 VAL CG2 C 13 21.3600 0.3 . 2 . . . . . 3 VAL CG2 . 12024 1 21 . 1 1 3 3 VAL N N 15 120.0940 0.2 . 1 . . . . . 3 VAL N . 12024 1 22 . 1 1 4 4 LYS H H 1 8.6070 0.02 . 1 . . . . . 4 LYS H . 12024 1 23 . 1 1 4 4 LYS HA H 1 4.7280 0.02 . 1 . . . . . 4 LYS HA . 12024 1 24 . 1 1 4 4 LYS HB2 H 1 1.6280 0.02 . 2 . . . . . 4 LYS HB2 . 12024 1 25 . 1 1 4 4 LYS HB3 H 1 1.8150 0.02 . 2 . . . . . 4 LYS HB3 . 12024 1 26 . 1 1 4 4 LYS HD2 H 1 1.5520 0.02 . 2 . . . . . 4 LYS HD2 . 12024 1 27 . 1 1 4 4 LYS HD3 H 1 1.4300 0.02 . 2 . . . . . 4 LYS HD3 . 12024 1 28 . 1 1 4 4 LYS HE2 H 1 2.9390 0.02 . 2 . . . . . 4 LYS HE2 . 12024 1 29 . 1 1 4 4 LYS HE3 H 1 2.9390 0.02 . 2 . . . . . 4 LYS HE3 . 12024 1 30 . 1 1 4 4 LYS HG2 H 1 0.9790 0.02 . 2 . . . . . 4 LYS HG2 . 12024 1 31 . 1 1 4 4 LYS HG3 H 1 1.0700 0.02 . 2 . . . . . 4 LYS HG3 . 12024 1 32 . 1 1 4 4 LYS C C 13 175.7470 0.3 . 1 . . . . . 4 LYS C . 12024 1 33 . 1 1 4 4 LYS CA C 13 55.1170 0.3 . 1 . . . . . 4 LYS CA . 12024 1 34 . 1 1 4 4 LYS CB C 13 32.2480 0.3 . 1 . . . . . 4 LYS CB . 12024 1 35 . 1 1 4 4 LYS CD C 13 29.0470 0.3 . 1 . . . . . 4 LYS CD . 12024 1 36 . 1 1 4 4 LYS CE C 13 41.3200 0.3 . 1 . . . . . 4 LYS CE . 12024 1 37 . 1 1 4 4 LYS CG C 13 24.4500 0.3 . 1 . . . . . 4 LYS CG . 12024 1 38 . 1 1 4 4 LYS N N 15 129.2310 0.2 . 1 . . . . . 4 LYS N . 12024 1 39 . 1 1 5 5 ILE H H 1 8.9360 0.02 . 1 . . . . . 5 ILE H . 12024 1 40 . 1 1 5 5 ILE HA H 1 3.6180 0.02 . 1 . . . . . 5 ILE HA . 12024 1 41 . 1 1 5 5 ILE HB H 1 2.2140 0.02 . 1 . . . . . 5 ILE HB . 12024 1 42 . 1 1 5 5 ILE HD11 H 1 0.7470 0.02 . 1 . . . . . 5 ILE HD11 . 12024 1 43 . 1 1 5 5 ILE HD12 H 1 0.7470 0.02 . 1 . . . . . 5 ILE HD11 . 12024 1 44 . 1 1 5 5 ILE HD13 H 1 0.7470 0.02 . 1 . . . . . 5 ILE HD11 . 12024 1 45 . 1 1 5 5 ILE HG12 H 1 1.4540 0.02 . 2 . . . . . 5 ILE HG12 . 12024 1 46 . 1 1 5 5 ILE HG13 H 1 1.3190 0.02 . 2 . . . . . 5 ILE HG13 . 12024 1 47 . 1 1 5 5 ILE HG21 H 1 0.7140 0.02 . 1 . . . . . 5 ILE HG21 . 12024 1 48 . 1 1 5 5 ILE HG22 H 1 0.7140 0.02 . 1 . . . . . 5 ILE HG21 . 12024 1 49 . 1 1 5 5 ILE HG23 H 1 0.7140 0.02 . 1 . . . . . 5 ILE HG21 . 12024 1 50 . 1 1 5 5 ILE C C 13 177.3230 0.3 . 1 . . . . . 5 ILE C . 12024 1 51 . 1 1 5 5 ILE CA C 13 62.8370 0.3 . 1 . . . . . 5 ILE CA . 12024 1 52 . 1 1 5 5 ILE CB C 13 34.8570 0.3 . 1 . . . . . 5 ILE CB . 12024 1 53 . 1 1 5 5 ILE CD1 C 13 11.6810 0.3 . 1 . . . . . 5 ILE CD1 . 12024 1 54 . 1 1 5 5 ILE CG1 C 13 27.4250 0.3 . 1 . . . . . 5 ILE CG1 . 12024 1 55 . 1 1 5 5 ILE CG2 C 13 18.8230 0.3 . 1 . . . . . 5 ILE CG2 . 12024 1 56 . 1 1 5 5 ILE N N 15 129.4910 0.2 . 1 . . . . . 5 ILE N . 12024 1 57 . 1 1 6 6 GLY H H 1 9.5480 0.02 . 1 . . . . . 6 GLY H . 12024 1 58 . 1 1 6 6 GLY HA2 H 1 3.0590 0.02 . 2 . . . . . 6 GLY HA2 . 12024 1 59 . 1 1 6 6 GLY HA3 H 1 4.1370 0.02 . 2 . . . . . 6 GLY HA3 . 12024 1 60 . 1 1 6 6 GLY C C 13 170.9890 0.3 . 1 . . . . . 6 GLY C . 12024 1 61 . 1 1 6 6 GLY CA C 13 45.0610 0.3 . 1 . . . . . 6 GLY CA . 12024 1 62 . 1 1 6 6 GLY N N 15 116.4520 0.2 . 1 . . . . . 6 GLY N . 12024 1 63 . 1 1 7 7 ASP H H 1 7.8840 0.02 . 1 . . . . . 7 ASP H . 12024 1 64 . 1 1 7 7 ASP HA H 1 4.7720 0.02 . 1 . . . . . 7 ASP HA . 12024 1 65 . 1 1 7 7 ASP HB2 H 1 1.7220 0.02 . 2 . . . . . 7 ASP HB2 . 12024 1 66 . 1 1 7 7 ASP HB3 H 1 3.0020 0.02 . 2 . . . . . 7 ASP HB3 . 12024 1 67 . 1 1 7 7 ASP C C 13 176.3320 0.3 . 1 . . . . . 7 ASP C . 12024 1 68 . 1 1 7 7 ASP CA C 13 51.7310 0.3 . 1 . . . . . 7 ASP CA . 12024 1 69 . 1 1 7 7 ASP CB C 13 39.2430 0.3 . 1 . . . . . 7 ASP CB . 12024 1 70 . 1 1 7 7 ASP N N 15 117.5580 0.2 . 1 . . . . . 7 ASP N . 12024 1 71 . 1 1 8 8 ILE H H 1 7.9750 0.02 . 1 . . . . . 8 ILE H . 12024 1 72 . 1 1 8 8 ILE HA H 1 3.4670 0.02 . 1 . . . . . 8 ILE HA . 12024 1 73 . 1 1 8 8 ILE HB H 1 1.8070 0.02 . 1 . . . . . 8 ILE HB . 12024 1 74 . 1 1 8 8 ILE HD11 H 1 0.9070 0.02 . 1 . . . . . 8 ILE HD11 . 12024 1 75 . 1 1 8 8 ILE HD12 H 1 0.9070 0.02 . 1 . . . . . 8 ILE HD11 . 12024 1 76 . 1 1 8 8 ILE HD13 H 1 0.9070 0.02 . 1 . . . . . 8 ILE HD11 . 12024 1 77 . 1 1 8 8 ILE HG12 H 1 1.5500 0.02 . 2 . . . . . 8 ILE HG12 . 12024 1 78 . 1 1 8 8 ILE HG13 H 1 1.5500 0.02 . 2 . . . . . 8 ILE HG13 . 12024 1 79 . 1 1 8 8 ILE HG21 H 1 0.9070 0.02 . 1 . . . . . 8 ILE HG21 . 12024 1 80 . 1 1 8 8 ILE HG22 H 1 0.9070 0.02 . 1 . . . . . 8 ILE HG21 . 12024 1 81 . 1 1 8 8 ILE HG23 H 1 0.9070 0.02 . 1 . . . . . 8 ILE HG21 . 12024 1 82 . 1 1 8 8 ILE C C 13 177.5250 0.3 . 1 . . . . . 8 ILE C . 12024 1 83 . 1 1 8 8 ILE CA C 13 64.2470 0.3 . 1 . . . . . 8 ILE CA . 12024 1 84 . 1 1 8 8 ILE CB C 13 39.0140 0.3 . 1 . . . . . 8 ILE CB . 12024 1 85 . 1 1 8 8 ILE CD1 C 13 13.6650 0.3 . 1 . . . . . 8 ILE CD1 . 12024 1 86 . 1 1 8 8 ILE CG1 C 13 29.2800 0.3 . 1 . . . . . 8 ILE CG1 . 12024 1 87 . 1 1 8 8 ILE CG2 C 13 19.8900 0.3 . 1 . . . . . 8 ILE CG2 . 12024 1 88 . 1 1 8 8 ILE N N 15 125.5840 0.2 . 1 . . . . . 8 ILE N . 12024 1 89 . 1 1 9 9 ASP H H 1 8.6070 0.02 . 1 . . . . . 9 ASP H . 12024 1 90 . 1 1 9 9 ASP HA H 1 4.4600 0.02 . 1 . . . . . 9 ASP HA . 12024 1 91 . 1 1 9 9 ASP HB2 H 1 2.3780 0.02 . 2 . . . . . 9 ASP HB2 . 12024 1 92 . 1 1 9 9 ASP HB3 H 1 2.9930 0.02 . 2 . . . . . 9 ASP HB3 . 12024 1 93 . 1 1 9 9 ASP C C 13 178.0740 0.3 . 1 . . . . . 9 ASP C . 12024 1 94 . 1 1 9 9 ASP CA C 13 53.7360 0.3 . 1 . . . . . 9 ASP CA . 12024 1 95 . 1 1 9 9 ASP CB C 13 39.3650 0.3 . 1 . . . . . 9 ASP CB . 12024 1 96 . 1 1 9 9 ASP N N 15 116.0470 0.2 . 1 . . . . . 9 ASP N . 12024 1 97 . 1 1 10 10 GLY H H 1 7.3240 0.02 . 1 . . . . . 10 GLY H . 12024 1 98 . 1 1 10 10 GLY HA2 H 1 3.6620 0.02 . 2 . . . . . 10 GLY HA2 . 12024 1 99 . 1 1 10 10 GLY HA3 H 1 3.8730 0.02 . 2 . . . . . 10 GLY HA3 . 12024 1 100 . 1 1 10 10 GLY C C 13 174.9810 0.3 . 1 . . . . . 10 GLY C . 12024 1 101 . 1 1 10 10 GLY CA C 13 47.2710 0.3 . 1 . . . . . 10 GLY CA . 12024 1 102 . 1 1 10 10 GLY N N 15 108.7270 0.2 . 1 . . . . . 10 GLY N . 12024 1 103 . 1 1 11 11 ASN H H 1 8.2920 0.02 . 1 . . . . . 11 ASN H . 12024 1 104 . 1 1 11 11 ASN HA H 1 4.6000 0.02 . 1 . . . . . 11 ASN HA . 12024 1 105 . 1 1 11 11 ASN HB2 H 1 2.5850 0.02 . 2 . . . . . 11 ASN HB2 . 12024 1 106 . 1 1 11 11 ASN HB3 H 1 3.2990 0.02 . 2 . . . . . 11 ASN HB3 . 12024 1 107 . 1 1 11 11 ASN HD21 H 1 8.0560 0.02 . 2 . . . . . 11 ASN HD21 . 12024 1 108 . 1 1 11 11 ASN HD22 H 1 7.1310 0.02 . 2 . . . . . 11 ASN HD22 . 12024 1 109 . 1 1 11 11 ASN C C 13 176.3560 0.3 . 1 . . . . . 11 ASN C . 12024 1 110 . 1 1 11 11 ASN CA C 13 52.7440 0.3 . 1 . . . . . 11 ASN CA . 12024 1 111 . 1 1 11 11 ASN CB C 13 38.1640 0.3 . 1 . . . . . 11 ASN CB . 12024 1 112 . 1 1 11 11 ASN N N 15 120.3320 0.2 . 1 . . . . . 11 ASN N . 12024 1 113 . 1 1 11 11 ASN ND2 N 15 117.5900 0.2 . 1 . . . . . 11 ASN ND2 . 12024 1 114 . 1 1 12 12 GLY H H 1 10.6010 0.02 . 1 . . . . . 12 GLY H . 12024 1 115 . 1 1 12 12 GLY HA2 H 1 3.3240 0.02 . 2 . . . . . 12 GLY HA2 . 12024 1 116 . 1 1 12 12 GLY HA3 H 1 4.2990 0.02 . 2 . . . . . 12 GLY HA3 . 12024 1 117 . 1 1 12 12 GLY C C 13 173.1440 0.3 . 1 . . . . . 12 GLY C . 12024 1 118 . 1 1 12 12 GLY CA C 13 45.4830 0.3 . 1 . . . . . 12 GLY CA . 12024 1 119 . 1 1 12 12 GLY N N 15 113.6610 0.2 . 1 . . . . . 12 GLY N . 12024 1 120 . 1 1 13 13 GLU H H 1 7.6060 0.02 . 1 . . . . . 13 GLU H . 12024 1 121 . 1 1 13 13 GLU HA H 1 4.7720 0.02 . 1 . . . . . 13 GLU HA . 12024 1 122 . 1 1 13 13 GLU HB2 H 1 1.8160 0.02 . 2 . . . . . 13 GLU HB2 . 12024 1 123 . 1 1 13 13 GLU HB3 H 1 1.9750 0.02 . 2 . . . . . 13 GLU HB3 . 12024 1 124 . 1 1 13 13 GLU HG2 H 1 2.1190 0.02 . 2 . . . . . 13 GLU HG2 . 12024 1 125 . 1 1 13 13 GLU HG3 H 1 2.1190 0.02 . 2 . . . . . 13 GLU HG3 . 12024 1 126 . 1 1 13 13 GLU C C 13 174.8630 0.3 . 1 . . . . . 13 GLU C . 12024 1 127 . 1 1 13 13 GLU CA C 13 53.4530 0.3 . 1 . . . . . 13 GLU CA . 12024 1 128 . 1 1 13 13 GLU CB C 13 33.0710 0.3 . 1 . . . . . 13 GLU CB . 12024 1 129 . 1 1 13 13 GLU CG C 13 34.9570 0.3 . 1 . . . . . 13 GLU CG . 12024 1 130 . 1 1 13 13 GLU N N 15 117.8630 0.2 . 1 . . . . . 13 GLU N . 12024 1 131 . 1 1 14 14 ILE H H 1 9.4230 0.02 . 1 . . . . . 14 ILE H . 12024 1 132 . 1 1 14 14 ILE HA H 1 4.8170 0.02 . 1 . . . . . 14 ILE HA . 12024 1 133 . 1 1 14 14 ILE HB H 1 2.0280 0.02 . 1 . . . . . 14 ILE HB . 12024 1 134 . 1 1 14 14 ILE HD11 H 1 0.5570 0.02 . 1 . . . . . 14 ILE HD11 . 12024 1 135 . 1 1 14 14 ILE HD12 H 1 0.5570 0.02 . 1 . . . . . 14 ILE HD11 . 12024 1 136 . 1 1 14 14 ILE HD13 H 1 0.5570 0.02 . 1 . . . . . 14 ILE HD11 . 12024 1 137 . 1 1 14 14 ILE HG12 H 1 1.0260 0.02 . 2 . . . . . 14 ILE HG12 . 12024 1 138 . 1 1 14 14 ILE HG13 H 1 1.2250 0.02 . 2 . . . . . 14 ILE HG13 . 12024 1 139 . 1 1 14 14 ILE HG21 H 1 0.8160 0.02 . 1 . . . . . 14 ILE HG21 . 12024 1 140 . 1 1 14 14 ILE HG22 H 1 0.8160 0.02 . 1 . . . . . 14 ILE HG21 . 12024 1 141 . 1 1 14 14 ILE HG23 H 1 0.8160 0.02 . 1 . . . . . 14 ILE HG21 . 12024 1 142 . 1 1 14 14 ILE C C 13 175.1710 0.3 . 1 . . . . . 14 ILE C . 12024 1 143 . 1 1 14 14 ILE CA C 13 60.2140 0.3 . 1 . . . . . 14 ILE CA . 12024 1 144 . 1 1 14 14 ILE CB C 13 35.8950 0.3 . 1 . . . . . 14 ILE CB . 12024 1 145 . 1 1 14 14 ILE CD1 C 13 12.2960 0.3 . 1 . . . . . 14 ILE CD1 . 12024 1 146 . 1 1 14 14 ILE CG1 C 13 27.8090 0.3 . 1 . . . . . 14 ILE CG1 . 12024 1 147 . 1 1 14 14 ILE CG2 C 13 18.4390 0.3 . 1 . . . . . 14 ILE CG2 . 12024 1 148 . 1 1 14 14 ILE N N 15 128.4560 0.2 . 1 . . . . . 14 ILE N . 12024 1 149 . 1 1 15 15 SER H H 1 10.4190 0.02 . 1 . . . . . 15 SER H . 12024 1 150 . 1 1 15 15 SER HA H 1 5.1320 0.02 . 1 . . . . . 15 SER HA . 12024 1 151 . 1 1 15 15 SER HB2 H 1 4.4510 0.02 . 2 . . . . . 15 SER HB2 . 12024 1 152 . 1 1 15 15 SER HB3 H 1 3.7850 0.02 . 2 . . . . . 15 SER HB3 . 12024 1 153 . 1 1 15 15 SER C C 13 175.0990 0.3 . 1 . . . . . 15 SER C . 12024 1 154 . 1 1 15 15 SER CA C 13 56.9250 0.3 . 1 . . . . . 15 SER CA . 12024 1 155 . 1 1 15 15 SER CB C 13 69.0420 0.3 . 1 . . . . . 15 SER CB . 12024 1 156 . 1 1 15 15 SER N N 15 126.0780 0.2 . 1 . . . . . 15 SER N . 12024 1 157 . 1 1 16 16 SER H H 1 9.2120 0.02 . 1 . . . . . 16 SER H . 12024 1 158 . 1 1 16 16 SER HA H 1 4.0850 0.02 . 1 . . . . . 16 SER HA . 12024 1 159 . 1 1 16 16 SER HB2 H 1 4.0170 0.02 . 2 . . . . . 16 SER HB2 . 12024 1 160 . 1 1 16 16 SER HB3 H 1 4.0170 0.02 . 2 . . . . . 16 SER HB3 . 12024 1 161 . 1 1 16 16 SER C C 13 176.4600 0.3 . 1 . . . . . 16 SER C . 12024 1 162 . 1 1 16 16 SER CA C 13 61.9290 0.3 . 1 . . . . . 16 SER CA . 12024 1 163 . 1 1 16 16 SER CB C 13 62.4370 0.3 . 1 . . . . . 16 SER CB . 12024 1 164 . 1 1 16 16 SER N N 15 115.8590 0.2 . 1 . . . . . 16 SER N . 12024 1 165 . 1 1 17 17 ILE H H 1 8.0930 0.02 . 1 . . . . . 17 ILE H . 12024 1 166 . 1 1 17 17 ILE HA H 1 3.9870 0.02 . 1 . . . . . 17 ILE HA . 12024 1 167 . 1 1 17 17 ILE HB H 1 1.6810 0.02 . 1 . . . . . 17 ILE HB . 12024 1 168 . 1 1 17 17 ILE HD11 H 1 0.8610 0.02 . 1 . . . . . 17 ILE HD11 . 12024 1 169 . 1 1 17 17 ILE HD12 H 1 0.8610 0.02 . 1 . . . . . 17 ILE HD11 . 12024 1 170 . 1 1 17 17 ILE HD13 H 1 0.8610 0.02 . 1 . . . . . 17 ILE HD11 . 12024 1 171 . 1 1 17 17 ILE HG12 H 1 1.3120 0.02 . 2 . . . . . 17 ILE HG12 . 12024 1 172 . 1 1 17 17 ILE HG13 H 1 1.5730 0.02 . 2 . . . . . 17 ILE HG13 . 12024 1 173 . 1 1 17 17 ILE HG21 H 1 0.9330 0.02 . 1 . . . . . 17 ILE HG21 . 12024 1 174 . 1 1 17 17 ILE HG22 H 1 0.9330 0.02 . 1 . . . . . 17 ILE HG21 . 12024 1 175 . 1 1 17 17 ILE HG23 H 1 0.9330 0.02 . 1 . . . . . 17 ILE HG21 . 12024 1 176 . 1 1 17 17 ILE C C 13 177.5490 0.3 . 1 . . . . . 17 ILE C . 12024 1 177 . 1 1 17 17 ILE CA C 13 64.2650 0.3 . 1 . . . . . 17 ILE CA . 12024 1 178 . 1 1 17 17 ILE CB C 13 37.4110 0.3 . 1 . . . . . 17 ILE CB . 12024 1 179 . 1 1 17 17 ILE CD1 C 13 11.8350 0.3 . 1 . . . . . 17 ILE CD1 . 12024 1 180 . 1 1 17 17 ILE CG1 C 13 28.5000 0.3 . 1 . . . . . 17 ILE CG1 . 12024 1 181 . 1 1 17 17 ILE CG2 C 13 17.7480 0.3 . 1 . . . . . 17 ILE CG2 . 12024 1 182 . 1 1 17 17 ILE N N 15 124.5580 0.2 . 1 . . . . . 17 ILE N . 12024 1 183 . 1 1 18 18 ASP H H 1 7.3980 0.02 . 1 . . . . . 18 ASP H . 12024 1 184 . 1 1 18 18 ASP HA H 1 4.2900 0.02 . 1 . . . . . 18 ASP HA . 12024 1 185 . 1 1 18 18 ASP HB2 H 1 3.0690 0.02 . 2 . . . . . 18 ASP HB2 . 12024 1 186 . 1 1 18 18 ASP HB3 H 1 3.3340 0.02 . 2 . . . . . 18 ASP HB3 . 12024 1 187 . 1 1 18 18 ASP C C 13 177.1900 0.3 . 1 . . . . . 18 ASP C . 12024 1 188 . 1 1 18 18 ASP CA C 13 59.1700 0.3 . 1 . . . . . 18 ASP CA . 12024 1 189 . 1 1 18 18 ASP CB C 13 41.5310 0.3 . 1 . . . . . 18 ASP CB . 12024 1 190 . 1 1 18 18 ASP N N 15 118.6200 0.2 . 1 . . . . . 18 ASP N . 12024 1 191 . 1 1 19 19 TYR H H 1 6.9500 0.02 . 1 . . . . . 19 TYR H . 12024 1 192 . 1 1 19 19 TYR HA H 1 3.9210 0.02 . 1 . . . . . 19 TYR HA . 12024 1 193 . 1 1 19 19 TYR HB2 H 1 3.3310 0.02 . 2 . . . . . 19 TYR HB2 . 12024 1 194 . 1 1 19 19 TYR HB3 H 1 2.8320 0.02 . 2 . . . . . 19 TYR HB3 . 12024 1 195 . 1 1 19 19 TYR HD1 H 1 6.9920 0.02 . 3 . . . . . 19 TYR HD1 . 12024 1 196 . 1 1 19 19 TYR HD2 H 1 6.9920 0.02 . 3 . . . . . 19 TYR HD2 . 12024 1 197 . 1 1 19 19 TYR C C 13 175.3550 0.3 . 1 . . . . . 19 TYR C . 12024 1 198 . 1 1 19 19 TYR CA C 13 61.8620 0.3 . 1 . . . . . 19 TYR CA . 12024 1 199 . 1 1 19 19 TYR CB C 13 38.6640 0.3 . 1 . . . . . 19 TYR CB . 12024 1 200 . 1 1 19 19 TYR CD1 C 13 132.7310 0.3 . 3 . . . . . 19 TYR CD1 . 12024 1 201 . 1 1 19 19 TYR CD2 C 13 132.7310 0.3 . 3 . . . . . 19 TYR CD2 . 12024 1 202 . 1 1 19 19 TYR N N 15 116.1260 0.2 . 1 . . . . . 19 TYR N . 12024 1 203 . 1 1 20 20 ALA H H 1 8.2610 0.02 . 1 . . . . . 20 ALA H . 12024 1 204 . 1 1 20 20 ALA HA H 1 3.9520 0.02 . 1 . . . . . 20 ALA HA . 12024 1 205 . 1 1 20 20 ALA HB1 H 1 1.6590 0.02 . 1 . . . . . 20 ALA HB1 . 12024 1 206 . 1 1 20 20 ALA HB2 H 1 1.6590 0.02 . 1 . . . . . 20 ALA HB1 . 12024 1 207 . 1 1 20 20 ALA HB3 H 1 1.6590 0.02 . 1 . . . . . 20 ALA HB1 . 12024 1 208 . 1 1 20 20 ALA C C 13 181.3110 0.3 . 1 . . . . . 20 ALA C . 12024 1 209 . 1 1 20 20 ALA CA C 13 55.5500 0.3 . 1 . . . . . 20 ALA CA . 12024 1 210 . 1 1 20 20 ALA CB C 13 18.1730 0.3 . 1 . . . . . 20 ALA CB . 12024 1 211 . 1 1 20 20 ALA N N 15 122.2390 0.2 . 1 . . . . . 20 ALA N . 12024 1 212 . 1 1 21 21 ILE H H 1 8.3840 0.02 . 1 . . . . . 21 ILE H . 12024 1 213 . 1 1 21 21 ILE HA H 1 3.8000 0.02 . 1 . . . . . 21 ILE HA . 12024 1 214 . 1 1 21 21 ILE HB H 1 1.8920 0.02 . 1 . . . . . 21 ILE HB . 12024 1 215 . 1 1 21 21 ILE HD11 H 1 0.8050 0.02 . 1 . . . . . 21 ILE HD11 . 12024 1 216 . 1 1 21 21 ILE HD12 H 1 0.8050 0.02 . 1 . . . . . 21 ILE HD11 . 12024 1 217 . 1 1 21 21 ILE HD13 H 1 0.8050 0.02 . 1 . . . . . 21 ILE HD11 . 12024 1 218 . 1 1 21 21 ILE HG12 H 1 1.1000 0.02 . 2 . . . . . 21 ILE HG12 . 12024 1 219 . 1 1 21 21 ILE HG13 H 1 1.1000 0.02 . 2 . . . . . 21 ILE HG13 . 12024 1 220 . 1 1 21 21 ILE HG21 H 1 0.9940 0.02 . 1 . . . . . 21 ILE HG21 . 12024 1 221 . 1 1 21 21 ILE HG22 H 1 0.9940 0.02 . 1 . . . . . 21 ILE HG21 . 12024 1 222 . 1 1 21 21 ILE HG23 H 1 0.9940 0.02 . 1 . . . . . 21 ILE HG21 . 12024 1 223 . 1 1 21 21 ILE C C 13 179.1830 0.3 . 1 . . . . . 21 ILE C . 12024 1 224 . 1 1 21 21 ILE CA C 13 65.2700 0.3 . 1 . . . . . 21 ILE CA . 12024 1 225 . 1 1 21 21 ILE CB C 13 38.3140 0.3 . 1 . . . . . 21 ILE CB . 12024 1 226 . 1 1 21 21 ILE CD1 C 13 15.0720 0.3 . 1 . . . . . 21 ILE CD1 . 12024 1 227 . 1 1 21 21 ILE CG1 C 13 28.8070 0.3 . 1 . . . . . 21 ILE CG1 . 12024 1 228 . 1 1 21 21 ILE CG2 C 13 17.5500 0.3 . 1 . . . . . 21 ILE CG2 . 12024 1 229 . 1 1 21 21 ILE N N 15 118.7160 0.2 . 1 . . . . . 21 ILE N . 12024 1 230 . 1 1 22 22 LEU H H 1 7.7970 0.02 . 1 . . . . . 22 LEU H . 12024 1 231 . 1 1 22 22 LEU HA H 1 4.0370 0.02 . 1 . . . . . 22 LEU HA . 12024 1 232 . 1 1 22 22 LEU HB2 H 1 1.8480 0.02 . 2 . . . . . 22 LEU HB2 . 12024 1 233 . 1 1 22 22 LEU HB3 H 1 1.3960 0.02 . 2 . . . . . 22 LEU HB3 . 12024 1 234 . 1 1 22 22 LEU HD11 H 1 0.9200 0.02 . 2 . . . . . 22 LEU HD11 . 12024 1 235 . 1 1 22 22 LEU HD12 H 1 0.9200 0.02 . 2 . . . . . 22 LEU HD11 . 12024 1 236 . 1 1 22 22 LEU HD13 H 1 0.9200 0.02 . 2 . . . . . 22 LEU HD11 . 12024 1 237 . 1 1 22 22 LEU HD21 H 1 0.8670 0.02 . 2 . . . . . 22 LEU HD21 . 12024 1 238 . 1 1 22 22 LEU HD22 H 1 0.8670 0.02 . 2 . . . . . 22 LEU HD21 . 12024 1 239 . 1 1 22 22 LEU HD23 H 1 0.8670 0.02 . 2 . . . . . 22 LEU HD21 . 12024 1 240 . 1 1 22 22 LEU C C 13 177.1270 0.3 . 1 . . . . . 22 LEU C . 12024 1 241 . 1 1 22 22 LEU CA C 13 58.2830 0.3 . 1 . . . . . 22 LEU CA . 12024 1 242 . 1 1 22 22 LEU CB C 13 40.1200 0.3 . 1 . . . . . 22 LEU CB . 12024 1 243 . 1 1 22 22 LEU CD1 C 13 23.7110 0.3 . 2 . . . . . 22 LEU CD1 . 12024 1 244 . 1 1 22 22 LEU CD2 C 13 24.9000 0.3 . 2 . . . . . 22 LEU CD2 . 12024 1 245 . 1 1 22 22 LEU N N 15 123.1230 0.2 . 1 . . . . . 22 LEU N . 12024 1 246 . 1 1 23 23 LYS H H 1 8.6550 0.02 . 1 . . . . . 23 LYS H . 12024 1 247 . 1 1 23 23 LYS HA H 1 3.6230 0.02 . 1 . . . . . 23 LYS HA . 12024 1 248 . 1 1 23 23 LYS HB2 H 1 1.3330 0.02 . 2 . . . . . 23 LYS HB2 . 12024 1 249 . 1 1 23 23 LYS HB3 H 1 1.8130 0.02 . 2 . . . . . 23 LYS HB3 . 12024 1 250 . 1 1 23 23 LYS HD2 H 1 1.6620 0.02 . 2 . . . . . 23 LYS HD2 . 12024 1 251 . 1 1 23 23 LYS HD3 H 1 1.5590 0.02 . 2 . . . . . 23 LYS HD3 . 12024 1 252 . 1 1 23 23 LYS HE2 H 1 2.9860 0.02 . 2 . . . . . 23 LYS HE2 . 12024 1 253 . 1 1 23 23 LYS HE3 H 1 2.8630 0.02 . 2 . . . . . 23 LYS HE3 . 12024 1 254 . 1 1 23 23 LYS HG2 H 1 1.2890 0.02 . 2 . . . . . 23 LYS HG2 . 12024 1 255 . 1 1 23 23 LYS C C 13 178.8140 0.3 . 1 . . . . . 23 LYS C . 12024 1 256 . 1 1 23 23 LYS CA C 13 60.3870 0.3 . 1 . . . . . 23 LYS CA . 12024 1 257 . 1 1 23 23 LYS CB C 13 32.3850 0.3 . 1 . . . . . 23 LYS CB . 12024 1 258 . 1 1 23 23 LYS CD C 13 29.2370 0.3 . 1 . . . . . 23 LYS CD . 12024 1 259 . 1 1 23 23 LYS CE C 13 42.3670 0.3 . 1 . . . . . 23 LYS CE . 12024 1 260 . 1 1 23 23 LYS CG C 13 24.6390 0.3 . 1 . . . . . 23 LYS CG . 12024 1 261 . 1 1 23 23 LYS N N 15 119.2150 0.2 . 1 . . . . . 23 LYS N . 12024 1 262 . 1 1 24 24 SER H H 1 7.7510 0.02 . 1 . . . . . 24 SER H . 12024 1 263 . 1 1 24 24 SER HA H 1 4.2120 0.02 . 1 . . . . . 24 SER HA . 12024 1 264 . 1 1 24 24 SER HB2 H 1 4.0450 0.02 . 2 . . . . . 24 SER HB2 . 12024 1 265 . 1 1 24 24 SER HB3 H 1 4.0450 0.02 . 2 . . . . . 24 SER HB3 . 12024 1 266 . 1 1 24 24 SER C C 13 176.8420 0.3 . 1 . . . . . 24 SER C . 12024 1 267 . 1 1 24 24 SER CA C 13 61.2330 0.3 . 1 . . . . . 24 SER CA . 12024 1 268 . 1 1 24 24 SER CB C 13 63.0880 0.3 . 1 . . . . . 24 SER CB . 12024 1 269 . 1 1 24 24 SER N N 15 111.3070 0.2 . 1 . . . . . 24 SER N . 12024 1 270 . 1 1 25 25 HIS HA H 1 4.7730 0.02 . 1 . . . . . 25 HIS HA . 12024 1 271 . 1 1 25 25 HIS HB2 H 1 1.9950 0.02 . 2 . . . . . 25 HIS HB2 . 12024 1 272 . 1 1 25 25 HIS HB3 H 1 1.9950 0.02 . 2 . . . . . 25 HIS HB3 . 12024 1 273 . 1 1 25 25 HIS CA C 13 55.6770 0.3 . 1 . . . . . 25 HIS CA . 12024 1 274 . 1 1 25 25 HIS CB C 13 30.9860 0.3 . 1 . . . . . 25 HIS CB . 12024 1 275 . 1 1 26 26 LEU H H 1 8.0240 0.02 . 1 . . . . . 26 LEU H . 12024 1 276 . 1 1 26 26 LEU HA H 1 4.2110 0.02 . 1 . . . . . 26 LEU HA . 12024 1 277 . 1 1 26 26 LEU HB2 H 1 0.7610 0.02 . 2 . . . . . 26 LEU HB2 . 12024 1 278 . 1 1 26 26 LEU HB3 H 1 1.2050 0.02 . 2 . . . . . 26 LEU HB3 . 12024 1 279 . 1 1 26 26 LEU HD11 H 1 0.3870 0.02 . 2 . . . . . 26 LEU HD11 . 12024 1 280 . 1 1 26 26 LEU HD12 H 1 0.3870 0.02 . 2 . . . . . 26 LEU HD11 . 12024 1 281 . 1 1 26 26 LEU HD13 H 1 0.3870 0.02 . 2 . . . . . 26 LEU HD11 . 12024 1 282 . 1 1 26 26 LEU HD21 H 1 0.3870 0.02 . 2 . . . . . 26 LEU HD21 . 12024 1 283 . 1 1 26 26 LEU HD22 H 1 0.3870 0.02 . 2 . . . . . 26 LEU HD21 . 12024 1 284 . 1 1 26 26 LEU HD23 H 1 0.3870 0.02 . 2 . . . . . 26 LEU HD21 . 12024 1 285 . 1 1 26 26 LEU C C 13 177.9230 0.3 . 1 . . . . . 26 LEU C . 12024 1 286 . 1 1 26 26 LEU CA C 13 51.7700 0.3 . 1 . . . . . 26 LEU CA . 12024 1 287 . 1 1 26 26 LEU CB C 13 45.2480 0.3 . 1 . . . . . 26 LEU CB . 12024 1 288 . 1 1 26 26 LEU CD1 C 13 25.3500 0.3 . 2 . . . . . 26 LEU CD1 . 12024 1 289 . 1 1 26 26 LEU CD2 C 13 25.3500 0.3 . 2 . . . . . 26 LEU CD2 . 12024 1 290 . 1 1 26 26 LEU N N 15 122.3630 0.2 . 1 . . . . . 26 LEU N . 12024 1 291 . 1 1 27 27 ILE H H 1 7.2780 0.02 . 1 . . . . . 27 ILE H . 12024 1 292 . 1 1 27 27 ILE HA H 1 3.9760 0.02 . 1 . . . . . 27 ILE HA . 12024 1 293 . 1 1 27 27 ILE HB H 1 1.9340 0.02 . 1 . . . . . 27 ILE HB . 12024 1 294 . 1 1 27 27 ILE HD11 H 1 0.8380 0.02 . 1 . . . . . 27 ILE HD11 . 12024 1 295 . 1 1 27 27 ILE HD12 H 1 0.8380 0.02 . 1 . . . . . 27 ILE HD11 . 12024 1 296 . 1 1 27 27 ILE HD13 H 1 0.8380 0.02 . 1 . . . . . 27 ILE HD11 . 12024 1 297 . 1 1 27 27 ILE HG12 H 1 1.1220 0.02 . 2 . . . . . 27 ILE HG12 . 12024 1 298 . 1 1 27 27 ILE HG13 H 1 1.6720 0.02 . 2 . . . . . 27 ILE HG13 . 12024 1 299 . 1 1 27 27 ILE HG21 H 1 0.9070 0.02 . 1 . . . . . 27 ILE HG21 . 12024 1 300 . 1 1 27 27 ILE HG22 H 1 0.9070 0.02 . 1 . . . . . 27 ILE HG21 . 12024 1 301 . 1 1 27 27 ILE HG23 H 1 0.9070 0.02 . 1 . . . . . 27 ILE HG21 . 12024 1 302 . 1 1 27 27 ILE C C 13 176.2950 0.3 . 1 . . . . . 27 ILE C . 12024 1 303 . 1 1 27 27 ILE CA C 13 63.3660 0.3 . 1 . . . . . 27 ILE CA . 12024 1 304 . 1 1 27 27 ILE CB C 13 38.2170 0.3 . 1 . . . . . 27 ILE CB . 12024 1 305 . 1 1 27 27 ILE CD1 C 13 12.9140 0.3 . 1 . . . . . 27 ILE CD1 . 12024 1 306 . 1 1 27 27 ILE CG1 C 13 27.9220 0.3 . 1 . . . . . 27 ILE CG1 . 12024 1 307 . 1 1 27 27 ILE CG2 C 13 17.4170 0.3 . 1 . . . . . 27 ILE CG2 . 12024 1 308 . 1 1 27 27 ILE N N 15 118.6610 0.2 . 1 . . . . . 27 ILE N . 12024 1 309 . 1 1 28 28 ASN H H 1 7.9550 0.02 . 1 . . . . . 28 ASN H . 12024 1 310 . 1 1 28 28 ASN HA H 1 4.7580 0.02 . 1 . . . . . 28 ASN HA . 12024 1 311 . 1 1 28 28 ASN HB2 H 1 2.6680 0.02 . 2 . . . . . 28 ASN HB2 . 12024 1 312 . 1 1 28 28 ASN HB3 H 1 2.6680 0.02 . 2 . . . . . 28 ASN HB3 . 12024 1 313 . 1 1 28 28 ASN HD21 H 1 7.6240 0.02 . 2 . . . . . 28 ASN HD21 . 12024 1 314 . 1 1 28 28 ASN HD22 H 1 6.9020 0.02 . 2 . . . . . 28 ASN HD22 . 12024 1 315 . 1 1 28 28 ASN C C 13 173.4220 0.3 . 1 . . . . . 28 ASN C . 12024 1 316 . 1 1 28 28 ASN CA C 13 53.5280 0.3 . 1 . . . . . 28 ASN CA . 12024 1 317 . 1 1 28 28 ASN CB C 13 40.7330 0.3 . 1 . . . . . 28 ASN CB . 12024 1 318 . 1 1 28 28 ASN N N 15 118.0430 0.2 . 1 . . . . . 28 ASN N . 12024 1 319 . 1 1 28 28 ASN ND2 N 15 113.8960 0.2 . 1 . . . . . 28 ASN ND2 . 12024 1 320 . 1 1 31 31 LEU HA H 1 4.5340 0.02 . 1 . . . . . 31 LEU HA . 12024 1 321 . 1 1 31 31 LEU HB2 H 1 1.6420 0.02 . 2 . . . . . 31 LEU HB2 . 12024 1 322 . 1 1 31 31 LEU HB3 H 1 1.6420 0.02 . 2 . . . . . 31 LEU HB3 . 12024 1 323 . 1 1 31 31 LEU HD11 H 1 0.5840 0.02 . 2 . . . . . 31 LEU HD11 . 12024 1 324 . 1 1 31 31 LEU HD12 H 1 0.5840 0.02 . 2 . . . . . 31 LEU HD11 . 12024 1 325 . 1 1 31 31 LEU HD13 H 1 0.5840 0.02 . 2 . . . . . 31 LEU HD11 . 12024 1 326 . 1 1 31 31 LEU HD21 H 1 0.8120 0.02 . 2 . . . . . 31 LEU HD21 . 12024 1 327 . 1 1 31 31 LEU HD22 H 1 0.8120 0.02 . 2 . . . . . 31 LEU HD21 . 12024 1 328 . 1 1 31 31 LEU HD23 H 1 0.8120 0.02 . 2 . . . . . 31 LEU HD21 . 12024 1 329 . 1 1 31 31 LEU HG H 1 1.5520 0.02 . 1 . . . . . 31 LEU HG . 12024 1 330 . 1 1 31 31 LEU C C 13 178.2480 0.3 . 1 . . . . . 31 LEU C . 12024 1 331 . 1 1 31 31 LEU CA C 13 55.3320 0.3 . 1 . . . . . 31 LEU CA . 12024 1 332 . 1 1 31 31 LEU CB C 13 41.7600 0.3 . 1 . . . . . 31 LEU CB . 12024 1 333 . 1 1 31 31 LEU CD1 C 13 22.4300 0.3 . 2 . . . . . 31 LEU CD1 . 12024 1 334 . 1 1 31 31 LEU CD2 C 13 25.2200 0.3 . 2 . . . . . 31 LEU CD2 . 12024 1 335 . 1 1 31 31 LEU CG C 13 25.7000 0.3 . 1 . . . . . 31 LEU CG . 12024 1 336 . 1 1 32 32 THR H H 1 8.7780 0.02 . 1 . . . . . 32 THR H . 12024 1 337 . 1 1 32 32 THR HA H 1 4.2650 0.02 . 1 . . . . . 32 THR HA . 12024 1 338 . 1 1 32 32 THR HB H 1 4.5850 0.02 . 1 . . . . . 32 THR HB . 12024 1 339 . 1 1 32 32 THR HG21 H 1 1.2300 0.02 . 1 . . . . . 32 THR HG21 . 12024 1 340 . 1 1 32 32 THR HG22 H 1 1.2300 0.02 . 1 . . . . . 32 THR HG21 . 12024 1 341 . 1 1 32 32 THR HG23 H 1 1.2300 0.02 . 1 . . . . . 32 THR HG21 . 12024 1 342 . 1 1 32 32 THR C C 13 175.2740 0.3 . 1 . . . . . 32 THR C . 12024 1 343 . 1 1 32 32 THR CA C 13 61.0600 0.3 . 1 . . . . . 32 THR CA . 12024 1 344 . 1 1 32 32 THR CB C 13 70.5490 0.3 . 1 . . . . . 32 THR CB . 12024 1 345 . 1 1 32 32 THR CG2 C 13 21.5300 0.3 . 1 . . . . . 32 THR CG2 . 12024 1 346 . 1 1 32 32 THR N N 15 112.0400 0.2 . 1 . . . . . 32 THR N . 12024 1 347 . 1 1 33 33 PHE H H 1 8.7230 0.02 . 1 . . . . . 33 PHE H . 12024 1 348 . 1 1 33 33 PHE HA H 1 4.6610 0.02 . 1 . . . . . 33 PHE HA . 12024 1 349 . 1 1 33 33 PHE HB2 H 1 3.6530 0.02 . 2 . . . . . 33 PHE HB2 . 12024 1 350 . 1 1 33 33 PHE HB3 H 1 3.0840 0.02 . 2 . . . . . 33 PHE HB3 . 12024 1 351 . 1 1 33 33 PHE HD1 H 1 7.2230 0.02 . 3 . . . . . 33 PHE HD1 . 12024 1 352 . 1 1 33 33 PHE HD2 H 1 7.2230 0.02 . 3 . . . . . 33 PHE HD2 . 12024 1 353 . 1 1 33 33 PHE HE1 H 1 7.0430 0.02 . 3 . . . . . 33 PHE HE1 . 12024 1 354 . 1 1 33 33 PHE HE2 H 1 7.0430 0.02 . 3 . . . . . 33 PHE HE2 . 12024 1 355 . 1 1 33 33 PHE C C 13 179.7160 0.3 . 1 . . . . . 33 PHE C . 12024 1 356 . 1 1 33 33 PHE CA C 13 57.8730 0.3 . 1 . . . . . 33 PHE CA . 12024 1 357 . 1 1 33 33 PHE CB C 13 35.4470 0.3 . 1 . . . . . 33 PHE CB . 12024 1 358 . 1 1 33 33 PHE CD1 C 13 130.1020 0.3 . 3 . . . . . 33 PHE CD1 . 12024 1 359 . 1 1 33 33 PHE CD2 C 13 130.1020 0.3 . 3 . . . . . 33 PHE CD2 . 12024 1 360 . 1 1 33 33 PHE CE1 C 13 131.0000 0.3 . 3 . . . . . 33 PHE CE1 . 12024 1 361 . 1 1 33 33 PHE CE2 C 13 131.0000 0.3 . 3 . . . . . 33 PHE CE2 . 12024 1 362 . 1 1 33 33 PHE N N 15 118.3130 0.2 . 1 . . . . . 33 PHE N . 12024 1 363 . 1 1 34 34 LYS H H 1 8.8400 0.02 . 1 . . . . . 34 LYS H . 12024 1 364 . 1 1 34 34 LYS HA H 1 2.8290 0.02 . 1 . . . . . 34 LYS HA . 12024 1 365 . 1 1 34 34 LYS HB2 H 1 1.3950 0.02 . 2 . . . . . 34 LYS HB2 . 12024 1 366 . 1 1 34 34 LYS HB3 H 1 1.3950 0.02 . 2 . . . . . 34 LYS HB3 . 12024 1 367 . 1 1 34 34 LYS HD2 H 1 1.5590 0.02 . 2 . . . . . 34 LYS HD2 . 12024 1 368 . 1 1 34 34 LYS HD3 H 1 1.6620 0.02 . 2 . . . . . 34 LYS HD3 . 12024 1 369 . 1 1 34 34 LYS HE2 H 1 2.9910 0.02 . 2 . . . . . 34 LYS HE2 . 12024 1 370 . 1 1 34 34 LYS HE3 H 1 2.8630 0.02 . 2 . . . . . 34 LYS HE3 . 12024 1 371 . 1 1 34 34 LYS HG2 H 1 1.0050 0.02 . 2 . . . . . 34 LYS HG2 . 12024 1 372 . 1 1 34 34 LYS HG3 H 1 1.0050 0.02 . 2 . . . . . 34 LYS HG3 . 12024 1 373 . 1 1 34 34 LYS C C 13 177.4260 0.3 . 1 . . . . . 34 LYS C . 12024 1 374 . 1 1 34 34 LYS CA C 13 60.0460 0.3 . 1 . . . . . 34 LYS CA . 12024 1 375 . 1 1 34 34 LYS CB C 13 32.4580 0.3 . 1 . . . . . 34 LYS CB . 12024 1 376 . 1 1 34 34 LYS CD C 13 29.2350 0.3 . 1 . . . . . 34 LYS CD . 12024 1 377 . 1 1 34 34 LYS CE C 13 42.2730 0.3 . 1 . . . . . 34 LYS CE . 12024 1 378 . 1 1 34 34 LYS CG C 13 24.6390 0.3 . 1 . . . . . 34 LYS CG . 12024 1 379 . 1 1 34 34 LYS N N 15 122.4110 0.2 . 1 . . . . . 34 LYS N . 12024 1 380 . 1 1 35 35 GLN H H 1 7.1840 0.02 . 1 . . . . . 35 GLN H . 12024 1 381 . 1 1 35 35 GLN HA H 1 3.8440 0.02 . 1 . . . . . 35 GLN HA . 12024 1 382 . 1 1 35 35 GLN HB2 H 1 2.3530 0.02 . 2 . . . . . 35 GLN HB2 . 12024 1 383 . 1 1 35 35 GLN HB3 H 1 1.6440 0.02 . 2 . . . . . 35 GLN HB3 . 12024 1 384 . 1 1 35 35 GLN HE21 H 1 6.9750 0.02 . 2 . . . . . 35 GLN HE21 . 12024 1 385 . 1 1 35 35 GLN HE22 H 1 6.8130 0.02 . 2 . . . . . 35 GLN HE22 . 12024 1 386 . 1 1 35 35 GLN HG2 H 1 2.8270 0.02 . 2 . . . . . 35 GLN HG2 . 12024 1 387 . 1 1 35 35 GLN HG3 H 1 2.7830 0.02 . 2 . . . . . 35 GLN HG3 . 12024 1 388 . 1 1 35 35 GLN C C 13 178.1990 0.3 . 1 . . . . . 35 GLN C . 12024 1 389 . 1 1 35 35 GLN CA C 13 58.9580 0.3 . 1 . . . . . 35 GLN CA . 12024 1 390 . 1 1 35 35 GLN CB C 13 30.2500 0.3 . 1 . . . . . 35 GLN CB . 12024 1 391 . 1 1 35 35 GLN CG C 13 34.6750 0.3 . 1 . . . . . 35 GLN CG . 12024 1 392 . 1 1 35 35 GLN N N 15 116.5470 0.2 . 1 . . . . . 35 GLN N . 12024 1 393 . 1 1 35 35 GLN NE2 N 15 110.6130 0.2 . 1 . . . . . 35 GLN NE2 . 12024 1 394 . 1 1 36 36 LEU H H 1 8.4330 0.02 . 1 . . . . . 36 LEU H . 12024 1 395 . 1 1 36 36 LEU HA H 1 3.6860 0.02 . 1 . . . . . 36 LEU HA . 12024 1 396 . 1 1 36 36 LEU HB2 H 1 1.0930 0.02 . 2 . . . . . 36 LEU HB2 . 12024 1 397 . 1 1 36 36 LEU HB3 H 1 1.0930 0.02 . 2 . . . . . 36 LEU HB3 . 12024 1 398 . 1 1 36 36 LEU HD11 H 1 0.6860 0.02 . 2 . . . . . 36 LEU HD11 . 12024 1 399 . 1 1 36 36 LEU HD12 H 1 0.6860 0.02 . 2 . . . . . 36 LEU HD11 . 12024 1 400 . 1 1 36 36 LEU HD13 H 1 0.6860 0.02 . 2 . . . . . 36 LEU HD11 . 12024 1 401 . 1 1 36 36 LEU HD21 H 1 0.9950 0.02 . 2 . . . . . 36 LEU HD21 . 12024 1 402 . 1 1 36 36 LEU HD22 H 1 0.9950 0.02 . 2 . . . . . 36 LEU HD21 . 12024 1 403 . 1 1 36 36 LEU HD23 H 1 0.9950 0.02 . 2 . . . . . 36 LEU HD21 . 12024 1 404 . 1 1 36 36 LEU HG H 1 1.6500 0.02 . 1 . . . . . 36 LEU HG . 12024 1 405 . 1 1 36 36 LEU C C 13 177.5180 0.3 . 1 . . . . . 36 LEU C . 12024 1 406 . 1 1 36 36 LEU CA C 13 57.8150 0.3 . 1 . . . . . 36 LEU CA . 12024 1 407 . 1 1 36 36 LEU CB C 13 42.7370 0.3 . 1 . . . . . 36 LEU CB . 12024 1 408 . 1 1 36 36 LEU CD1 C 13 24.3300 0.3 . 2 . . . . . 36 LEU CD1 . 12024 1 409 . 1 1 36 36 LEU CD2 C 13 26.4000 0.3 . 2 . . . . . 36 LEU CD2 . 12024 1 410 . 1 1 36 36 LEU CG C 13 26.2340 0.3 . 1 . . . . . 36 LEU CG . 12024 1 411 . 1 1 36 36 LEU N N 15 119.1200 0.2 . 1 . . . . . 36 LEU N . 12024 1 412 . 1 1 37 37 ALA H H 1 7.1720 0.02 . 1 . . . . . 37 ALA H . 12024 1 413 . 1 1 37 37 ALA HA H 1 3.8660 0.02 . 1 . . . . . 37 ALA HA . 12024 1 414 . 1 1 37 37 ALA HB1 H 1 1.1840 0.02 . 1 . . . . . 37 ALA HB1 . 12024 1 415 . 1 1 37 37 ALA HB2 H 1 1.1840 0.02 . 1 . . . . . 37 ALA HB1 . 12024 1 416 . 1 1 37 37 ALA HB3 H 1 1.1840 0.02 . 1 . . . . . 37 ALA HB1 . 12024 1 417 . 1 1 37 37 ALA C C 13 179.8030 0.3 . 1 . . . . . 37 ALA C . 12024 1 418 . 1 1 37 37 ALA CA C 13 55.2170 0.3 . 1 . . . . . 37 ALA CA . 12024 1 419 . 1 1 37 37 ALA CB C 13 17.1640 0.3 . 1 . . . . . 37 ALA CB . 12024 1 420 . 1 1 37 37 ALA N N 15 117.8690 0.2 . 1 . . . . . 37 ALA N . 12024 1 421 . 1 1 38 38 ALA H H 1 7.2470 0.02 . 1 . . . . . 38 ALA H . 12024 1 422 . 1 1 38 38 ALA HA H 1 3.7640 0.02 . 1 . . . . . 38 ALA HA . 12024 1 423 . 1 1 38 38 ALA HB1 H 1 1.2150 0.02 . 1 . . . . . 38 ALA HB1 . 12024 1 424 . 1 1 38 38 ALA HB2 H 1 1.2150 0.02 . 1 . . . . . 38 ALA HB1 . 12024 1 425 . 1 1 38 38 ALA HB3 H 1 1.2150 0.02 . 1 . . . . . 38 ALA HB1 . 12024 1 426 . 1 1 38 38 ALA C C 13 177.5830 0.3 . 1 . . . . . 38 ALA C . 12024 1 427 . 1 1 38 38 ALA CA C 13 54.1710 0.3 . 1 . . . . . 38 ALA CA . 12024 1 428 . 1 1 38 38 ALA CB C 13 19.2160 0.3 . 1 . . . . . 38 ALA CB . 12024 1 429 . 1 1 38 38 ALA N N 15 117.5940 0.2 . 1 . . . . . 38 ALA N . 12024 1 430 . 1 1 39 39 ALA H H 1 7.7850 0.02 . 1 . . . . . 39 ALA H . 12024 1 431 . 1 1 39 39 ALA HA H 1 3.8580 0.02 . 1 . . . . . 39 ALA HA . 12024 1 432 . 1 1 39 39 ALA HB1 H 1 1.3560 0.02 . 1 . . . . . 39 ALA HB1 . 12024 1 433 . 1 1 39 39 ALA HB2 H 1 1.3560 0.02 . 1 . . . . . 39 ALA HB1 . 12024 1 434 . 1 1 39 39 ALA HB3 H 1 1.3560 0.02 . 1 . . . . . 39 ALA HB1 . 12024 1 435 . 1 1 39 39 ALA C C 13 175.6420 0.3 . 1 . . . . . 39 ALA C . 12024 1 436 . 1 1 39 39 ALA CA C 13 52.4340 0.3 . 1 . . . . . 39 ALA CA . 12024 1 437 . 1 1 39 39 ALA CB C 13 20.6370 0.3 . 1 . . . . . 39 ALA CB . 12024 1 438 . 1 1 39 39 ALA N N 15 117.6490 0.2 . 1 . . . . . 39 ALA N . 12024 1 439 . 1 1 40 40 ASP H H 1 6.7580 0.02 . 1 . . . . . 40 ASP H . 12024 1 440 . 1 1 40 40 ASP HA H 1 4.8200 0.02 . 1 . . . . . 40 ASP HA . 12024 1 441 . 1 1 40 40 ASP HB2 H 1 2.6070 0.02 . 2 . . . . . 40 ASP HB2 . 12024 1 442 . 1 1 40 40 ASP HB3 H 1 2.4530 0.02 . 2 . . . . . 40 ASP HB3 . 12024 1 443 . 1 1 40 40 ASP C C 13 177.8960 0.3 . 1 . . . . . 40 ASP C . 12024 1 444 . 1 1 40 40 ASP CA C 13 52.2840 0.3 . 1 . . . . . 40 ASP CA . 12024 1 445 . 1 1 40 40 ASP CB C 13 38.7900 0.3 . 1 . . . . . 40 ASP CB . 12024 1 446 . 1 1 40 40 ASP N N 15 114.8580 0.2 . 1 . . . . . 40 ASP N . 12024 1 447 . 1 1 41 41 VAL H H 1 8.3920 0.02 . 1 . . . . . 41 VAL H . 12024 1 448 . 1 1 41 41 VAL HA H 1 3.7490 0.02 . 1 . . . . . 41 VAL HA . 12024 1 449 . 1 1 41 41 VAL HB H 1 2.1150 0.02 . 1 . . . . . 41 VAL HB . 12024 1 450 . 1 1 41 41 VAL HG11 H 1 0.9070 0.02 . 2 . . . . . 41 VAL HG11 . 12024 1 451 . 1 1 41 41 VAL HG12 H 1 0.9070 0.02 . 2 . . . . . 41 VAL HG11 . 12024 1 452 . 1 1 41 41 VAL HG13 H 1 0.9070 0.02 . 2 . . . . . 41 VAL HG11 . 12024 1 453 . 1 1 41 41 VAL HG21 H 1 1.1320 0.02 . 2 . . . . . 41 VAL HG21 . 12024 1 454 . 1 1 41 41 VAL HG22 H 1 1.1320 0.02 . 2 . . . . . 41 VAL HG21 . 12024 1 455 . 1 1 41 41 VAL HG23 H 1 1.1320 0.02 . 2 . . . . . 41 VAL HG21 . 12024 1 456 . 1 1 41 41 VAL C C 13 176.9640 0.3 . 1 . . . . . 41 VAL C . 12024 1 457 . 1 1 41 41 VAL CA C 13 64.1370 0.3 . 1 . . . . . 41 VAL CA . 12024 1 458 . 1 1 41 41 VAL CB C 13 31.2030 0.3 . 1 . . . . . 41 VAL CB . 12024 1 459 . 1 1 41 41 VAL CG1 C 13 21.5600 0.3 . 2 . . . . . 41 VAL CG1 . 12024 1 460 . 1 1 41 41 VAL CG2 C 13 21.5600 0.3 . 2 . . . . . 41 VAL CG2 . 12024 1 461 . 1 1 41 41 VAL N N 15 122.5550 0.2 . 1 . . . . . 41 VAL N . 12024 1 462 . 1 1 42 42 ASP H H 1 8.2980 0.02 . 1 . . . . . 42 ASP H . 12024 1 463 . 1 1 42 42 ASP HA H 1 4.5850 0.02 . 1 . . . . . 42 ASP HA . 12024 1 464 . 1 1 42 42 ASP HB2 H 1 3.0680 0.02 . 2 . . . . . 42 ASP HB2 . 12024 1 465 . 1 1 42 42 ASP HB3 H 1 2.4350 0.02 . 2 . . . . . 42 ASP HB3 . 12024 1 466 . 1 1 42 42 ASP C C 13 178.1930 0.3 . 1 . . . . . 42 ASP C . 12024 1 467 . 1 1 42 42 ASP CA C 13 53.0020 0.3 . 1 . . . . . 42 ASP CA . 12024 1 468 . 1 1 42 42 ASP CB C 13 39.8000 0.3 . 1 . . . . . 42 ASP CB . 12024 1 469 . 1 1 42 42 ASP N N 15 117.1000 0.2 . 1 . . . . . 42 ASP N . 12024 1 470 . 1 1 43 43 GLY H H 1 7.4130 0.02 . 1 . . . . . 43 GLY H . 12024 1 471 . 1 1 43 43 GLY HA2 H 1 3.8850 0.02 . 2 . . . . . 43 GLY HA2 . 12024 1 472 . 1 1 43 43 GLY HA3 H 1 3.7300 0.02 . 2 . . . . . 43 GLY HA3 . 12024 1 473 . 1 1 43 43 GLY C C 13 174.9040 0.3 . 1 . . . . . 43 GLY C . 12024 1 474 . 1 1 43 43 GLY CA C 13 47.2450 0.3 . 1 . . . . . 43 GLY CA . 12024 1 475 . 1 1 43 43 GLY N N 15 107.9940 0.2 . 1 . . . . . 43 GLY N . 12024 1 476 . 1 1 44 44 ASN H H 1 8.1480 0.02 . 1 . . . . . 44 ASN H . 12024 1 477 . 1 1 44 44 ASN HA H 1 4.6800 0.02 . 1 . . . . . 44 ASN HA . 12024 1 478 . 1 1 44 44 ASN HB2 H 1 2.7400 0.02 . 2 . . . . . 44 ASN HB2 . 12024 1 479 . 1 1 44 44 ASN HB3 H 1 3.4520 0.02 . 2 . . . . . 44 ASN HB3 . 12024 1 480 . 1 1 44 44 ASN HD21 H 1 8.0650 0.02 . 2 . . . . . 44 ASN HD21 . 12024 1 481 . 1 1 44 44 ASN HD22 H 1 7.0720 0.02 . 2 . . . . . 44 ASN HD22 . 12024 1 482 . 1 1 44 44 ASN C C 13 176.0120 0.3 . 1 . . . . . 44 ASN C . 12024 1 483 . 1 1 44 44 ASN CA C 13 52.2950 0.3 . 1 . . . . . 44 ASN CA . 12024 1 484 . 1 1 44 44 ASN CB C 13 37.6100 0.3 . 1 . . . . . 44 ASN CB . 12024 1 485 . 1 1 44 44 ASN N N 15 118.8730 0.2 . 1 . . . . . 44 ASN N . 12024 1 486 . 1 1 44 44 ASN ND2 N 15 116.5400 0.2 . 1 . . . . . 44 ASN ND2 . 12024 1 487 . 1 1 45 45 GLY H H 1 10.4060 0.02 . 1 . . . . . 45 GLY H . 12024 1 488 . 1 1 45 45 GLY HA2 H 1 3.2670 0.02 . 2 . . . . . 45 GLY HA2 . 12024 1 489 . 1 1 45 45 GLY HA3 H 1 4.1300 0.02 . 2 . . . . . 45 GLY HA3 . 12024 1 490 . 1 1 45 45 GLY C C 13 172.6960 0.3 . 1 . . . . . 45 GLY C . 12024 1 491 . 1 1 45 45 GLY CA C 13 45.5210 0.3 . 1 . . . . . 45 GLY CA . 12024 1 492 . 1 1 45 45 GLY N N 15 113.2720 0.2 . 1 . . . . . 45 GLY N . 12024 1 493 . 1 1 46 46 TYR H H 1 7.4830 0.02 . 1 . . . . . 46 TYR H . 12024 1 494 . 1 1 46 46 TYR HA H 1 4.8970 0.02 . 1 . . . . . 46 TYR HA . 12024 1 495 . 1 1 46 46 TYR HB2 H 1 2.4510 0.02 . 2 . . . . . 46 TYR HB2 . 12024 1 496 . 1 1 46 46 TYR HB3 H 1 3.0710 0.02 . 2 . . . . . 46 TYR HB3 . 12024 1 497 . 1 1 46 46 TYR HD1 H 1 7.1260 0.02 . 3 . . . . . 46 TYR HD1 . 12024 1 498 . 1 1 46 46 TYR HD2 H 1 7.1260 0.02 . 3 . . . . . 46 TYR HD2 . 12024 1 499 . 1 1 46 46 TYR HE1 H 1 6.8980 0.02 . 3 . . . . . 46 TYR HE1 . 12024 1 500 . 1 1 46 46 TYR HE2 H 1 6.8980 0.02 . 3 . . . . . 46 TYR HE2 . 12024 1 501 . 1 1 46 46 TYR C C 13 174.8290 0.3 . 1 . . . . . 46 TYR C . 12024 1 502 . 1 1 46 46 TYR CA C 13 57.1130 0.3 . 1 . . . . . 46 TYR CA . 12024 1 503 . 1 1 46 46 TYR CB C 13 41.7000 0.3 . 1 . . . . . 46 TYR CB . 12024 1 504 . 1 1 46 46 TYR CD1 C 13 133.6670 0.3 . 3 . . . . . 46 TYR CD1 . 12024 1 505 . 1 1 46 46 TYR CD2 C 13 133.6670 0.3 . 3 . . . . . 46 TYR CD2 . 12024 1 506 . 1 1 46 46 TYR CE1 C 13 118.2180 0.3 . 3 . . . . . 46 TYR CE1 . 12024 1 507 . 1 1 46 46 TYR CE2 C 13 118.2180 0.3 . 3 . . . . . 46 TYR CE2 . 12024 1 508 . 1 1 46 46 TYR N N 15 117.7020 0.2 . 1 . . . . . 46 TYR N . 12024 1 509 . 1 1 47 47 VAL H H 1 10.1350 0.02 . 1 . . . . . 47 VAL H . 12024 1 510 . 1 1 47 47 VAL HA H 1 4.7420 0.02 . 1 . . . . . 47 VAL HA . 12024 1 511 . 1 1 47 47 VAL HB H 1 2.0540 0.02 . 1 . . . . . 47 VAL HB . 12024 1 512 . 1 1 47 47 VAL HG11 H 1 0.8390 0.02 . 2 . . . . . 47 VAL HG11 . 12024 1 513 . 1 1 47 47 VAL HG12 H 1 0.8390 0.02 . 2 . . . . . 47 VAL HG11 . 12024 1 514 . 1 1 47 47 VAL HG13 H 1 0.8390 0.02 . 2 . . . . . 47 VAL HG11 . 12024 1 515 . 1 1 47 47 VAL HG21 H 1 0.8100 0.02 . 2 . . . . . 47 VAL HG21 . 12024 1 516 . 1 1 47 47 VAL HG22 H 1 0.8100 0.02 . 2 . . . . . 47 VAL HG21 . 12024 1 517 . 1 1 47 47 VAL HG23 H 1 0.8100 0.02 . 2 . . . . . 47 VAL HG21 . 12024 1 518 . 1 1 47 47 VAL C C 13 175.3260 0.3 . 1 . . . . . 47 VAL C . 12024 1 519 . 1 1 47 47 VAL CA C 13 62.5170 0.3 . 1 . . . . . 47 VAL CA . 12024 1 520 . 1 1 47 47 VAL CB C 13 31.2110 0.3 . 1 . . . . . 47 VAL CB . 12024 1 521 . 1 1 47 47 VAL CG1 C 13 23.2500 0.3 . 2 . . . . . 47 VAL CG1 . 12024 1 522 . 1 1 47 47 VAL CG2 C 13 22.4630 0.3 . 2 . . . . . 47 VAL CG2 . 12024 1 523 . 1 1 47 47 VAL N N 15 128.2490 0.2 . 1 . . . . . 47 VAL N . 12024 1 524 . 1 1 48 48 ASN H H 1 10.1710 0.02 . 1 . . . . . 48 ASN H . 12024 1 525 . 1 1 48 48 ASN HA H 1 4.9680 0.02 . 1 . . . . . 48 ASN HA . 12024 1 526 . 1 1 48 48 ASN HB2 H 1 3.4970 0.02 . 2 . . . . . 48 ASN HB2 . 12024 1 527 . 1 1 48 48 ASN HB3 H 1 3.0540 0.02 . 2 . . . . . 48 ASN HB3 . 12024 1 528 . 1 1 48 48 ASN HD21 H 1 7.9560 0.02 . 2 . . . . . 48 ASN HD21 . 12024 1 529 . 1 1 48 48 ASN HD22 H 1 7.0330 0.02 . 2 . . . . . 48 ASN HD22 . 12024 1 530 . 1 1 48 48 ASN C C 13 176.1190 0.3 . 1 . . . . . 48 ASN C . 12024 1 531 . 1 1 48 48 ASN CA C 13 52.3080 0.3 . 1 . . . . . 48 ASN CA . 12024 1 532 . 1 1 48 48 ASN CB C 13 40.0320 0.3 . 1 . . . . . 48 ASN CB . 12024 1 533 . 1 1 48 48 ASN N N 15 127.7860 0.2 . 1 . . . . . 48 ASN N . 12024 1 534 . 1 1 48 48 ASN ND2 N 15 113.6080 0.2 . 1 . . . . . 48 ASN ND2 . 12024 1 535 . 1 1 49 49 SER H H 1 8.6600 0.02 . 1 . . . . . 49 SER H . 12024 1 536 . 1 1 49 49 SER HA H 1 4.1370 0.02 . 1 . . . . . 49 SER HA . 12024 1 537 . 1 1 49 49 SER HB2 H 1 4.0520 0.02 . 2 . . . . . 49 SER HB2 . 12024 1 538 . 1 1 49 49 SER HB3 H 1 4.0520 0.02 . 2 . . . . . 49 SER HB3 . 12024 1 539 . 1 1 49 49 SER C C 13 176.4180 0.3 . 1 . . . . . 49 SER C . 12024 1 540 . 1 1 49 49 SER CA C 13 61.5330 0.3 . 1 . . . . . 49 SER CA . 12024 1 541 . 1 1 49 49 SER CB C 13 62.7510 0.3 . 1 . . . . . 49 SER CB . 12024 1 542 . 1 1 49 49 SER N N 15 112.3960 0.2 . 1 . . . . . 49 SER N . 12024 1 543 . 1 1 50 50 ILE H H 1 8.0790 0.02 . 1 . . . . . 50 ILE H . 12024 1 544 . 1 1 50 50 ILE HA H 1 3.9750 0.02 . 1 . . . . . 50 ILE HA . 12024 1 545 . 1 1 50 50 ILE HB H 1 2.0050 0.02 . 1 . . . . . 50 ILE HB . 12024 1 546 . 1 1 50 50 ILE HD11 H 1 0.8630 0.02 . 1 . . . . . 50 ILE HD11 . 12024 1 547 . 1 1 50 50 ILE HD12 H 1 0.8630 0.02 . 1 . . . . . 50 ILE HD11 . 12024 1 548 . 1 1 50 50 ILE HD13 H 1 0.8630 0.02 . 1 . . . . . 50 ILE HD11 . 12024 1 549 . 1 1 50 50 ILE HG12 H 1 1.2160 0.02 . 2 . . . . . 50 ILE HG12 . 12024 1 550 . 1 1 50 50 ILE HG13 H 1 1.5470 0.02 . 2 . . . . . 50 ILE HG13 . 12024 1 551 . 1 1 50 50 ILE HG21 H 1 1.0100 0.02 . 1 . . . . . 50 ILE HG21 . 12024 1 552 . 1 1 50 50 ILE HG22 H 1 1.0100 0.02 . 1 . . . . . 50 ILE HG21 . 12024 1 553 . 1 1 50 50 ILE HG23 H 1 1.0100 0.02 . 1 . . . . . 50 ILE HG21 . 12024 1 554 . 1 1 50 50 ILE C C 13 178.2230 0.3 . 1 . . . . . 50 ILE C . 12024 1 555 . 1 1 50 50 ILE CA C 13 64.4540 0.3 . 1 . . . . . 50 ILE CA . 12024 1 556 . 1 1 50 50 ILE CB C 13 36.7960 0.3 . 1 . . . . . 50 ILE CB . 12024 1 557 . 1 1 50 50 ILE CD1 C 13 11.8830 0.3 . 1 . . . . . 50 ILE CD1 . 12024 1 558 . 1 1 50 50 ILE CG1 C 13 28.5780 0.3 . 1 . . . . . 50 ILE CG1 . 12024 1 559 . 1 1 50 50 ILE CG2 C 13 17.6980 0.3 . 1 . . . . . 50 ILE CG2 . 12024 1 560 . 1 1 50 50 ILE N N 15 125.8750 0.2 . 1 . . . . . 50 ILE N . 12024 1 561 . 1 1 51 51 ASP H H 1 7.3080 0.02 . 1 . . . . . 51 ASP H . 12024 1 562 . 1 1 51 51 ASP HA H 1 4.3660 0.02 . 1 . . . . . 51 ASP HA . 12024 1 563 . 1 1 51 51 ASP HB2 H 1 3.2640 0.02 . 2 . . . . . 51 ASP HB2 . 12024 1 564 . 1 1 51 51 ASP HB3 H 1 3.2640 0.02 . 2 . . . . . 51 ASP HB3 . 12024 1 565 . 1 1 51 51 ASP C C 13 177.7990 0.3 . 1 . . . . . 51 ASP C . 12024 1 566 . 1 1 51 51 ASP CA C 13 58.7700 0.3 . 1 . . . . . 51 ASP CA . 12024 1 567 . 1 1 51 51 ASP CB C 13 41.3970 0.3 . 1 . . . . . 51 ASP CB . 12024 1 568 . 1 1 51 51 ASP N N 15 118.0900 0.2 . 1 . . . . . 51 ASP N . 12024 1 569 . 1 1 52 52 LEU H H 1 7.0020 0.02 . 1 . . . . . 52 LEU H . 12024 1 570 . 1 1 52 52 LEU HA H 1 4.0130 0.02 . 1 . . . . . 52 LEU HA . 12024 1 571 . 1 1 52 52 LEU HB2 H 1 1.2150 0.02 . 2 . . . . . 52 LEU HB2 . 12024 1 572 . 1 1 52 52 LEU HB3 H 1 2.1620 0.02 . 2 . . . . . 52 LEU HB3 . 12024 1 573 . 1 1 52 52 LEU HD11 H 1 0.8290 0.02 . 2 . . . . . 52 LEU HD11 . 12024 1 574 . 1 1 52 52 LEU HD12 H 1 0.8290 0.02 . 2 . . . . . 52 LEU HD11 . 12024 1 575 . 1 1 52 52 LEU HD13 H 1 0.8290 0.02 . 2 . . . . . 52 LEU HD11 . 12024 1 576 . 1 1 52 52 LEU HD21 H 1 0.8340 0.02 . 2 . . . . . 52 LEU HD21 . 12024 1 577 . 1 1 52 52 LEU HD22 H 1 0.8340 0.02 . 2 . . . . . 52 LEU HD21 . 12024 1 578 . 1 1 52 52 LEU HD23 H 1 0.8340 0.02 . 2 . . . . . 52 LEU HD21 . 12024 1 579 . 1 1 52 52 LEU HG H 1 1.7870 0.02 . 1 . . . . . 52 LEU HG . 12024 1 580 . 1 1 52 52 LEU C C 13 177.5430 0.3 . 1 . . . . . 52 LEU C . 12024 1 581 . 1 1 52 52 LEU CA C 13 58.6740 0.3 . 1 . . . . . 52 LEU CA . 12024 1 582 . 1 1 52 52 LEU CB C 13 42.1850 0.3 . 1 . . . . . 52 LEU CB . 12024 1 583 . 1 1 52 52 LEU CD1 C 13 22.6690 0.3 . 2 . . . . . 52 LEU CD1 . 12024 1 584 . 1 1 52 52 LEU CD2 C 13 25.7600 0.3 . 2 . . . . . 52 LEU CD2 . 12024 1 585 . 1 1 52 52 LEU CG C 13 26.0000 0.3 . 1 . . . . . 52 LEU CG . 12024 1 586 . 1 1 52 52 LEU N N 15 116.5060 0.2 . 1 . . . . . 52 LEU N . 12024 1 587 . 1 1 53 53 ALA H H 1 7.8970 0.02 . 1 . . . . . 53 ALA H . 12024 1 588 . 1 1 53 53 ALA HA H 1 4.3430 0.02 . 1 . . . . . 53 ALA HA . 12024 1 589 . 1 1 53 53 ALA HB1 H 1 1.6610 0.02 . 1 . . . . . 53 ALA HB1 . 12024 1 590 . 1 1 53 53 ALA HB2 H 1 1.6610 0.02 . 1 . . . . . 53 ALA HB1 . 12024 1 591 . 1 1 53 53 ALA HB3 H 1 1.6610 0.02 . 1 . . . . . 53 ALA HB1 . 12024 1 592 . 1 1 53 53 ALA C C 13 180.8770 0.3 . 1 . . . . . 53 ALA C . 12024 1 593 . 1 1 53 53 ALA CA C 13 55.2160 0.3 . 1 . . . . . 53 ALA CA . 12024 1 594 . 1 1 53 53 ALA CB C 13 18.1330 0.3 . 1 . . . . . 53 ALA CB . 12024 1 595 . 1 1 53 53 ALA N N 15 121.3190 0.2 . 1 . . . . . 53 ALA N . 12024 1 596 . 1 1 54 54 ILE H H 1 8.3570 0.02 . 1 . . . . . 54 ILE H . 12024 1 597 . 1 1 54 54 ILE HA H 1 3.8000 0.02 . 1 . . . . . 54 ILE HA . 12024 1 598 . 1 1 54 54 ILE HB H 1 1.8640 0.02 . 1 . . . . . 54 ILE HB . 12024 1 599 . 1 1 54 54 ILE HD11 H 1 0.9410 0.02 . 1 . . . . . 54 ILE HD11 . 12024 1 600 . 1 1 54 54 ILE HD12 H 1 0.9410 0.02 . 1 . . . . . 54 ILE HD11 . 12024 1 601 . 1 1 54 54 ILE HD13 H 1 0.9410 0.02 . 1 . . . . . 54 ILE HD11 . 12024 1 602 . 1 1 54 54 ILE HG12 H 1 1.1030 0.02 . 2 . . . . . 54 ILE HG12 . 12024 1 603 . 1 1 54 54 ILE HG13 H 1 1.1030 0.02 . 2 . . . . . 54 ILE HG13 . 12024 1 604 . 1 1 54 54 ILE HG21 H 1 0.9950 0.02 . 1 . . . . . 54 ILE HG21 . 12024 1 605 . 1 1 54 54 ILE HG22 H 1 0.9950 0.02 . 1 . . . . . 54 ILE HG21 . 12024 1 606 . 1 1 54 54 ILE HG23 H 1 0.9950 0.02 . 1 . . . . . 54 ILE HG21 . 12024 1 607 . 1 1 54 54 ILE C C 13 179.0170 0.3 . 1 . . . . . 54 ILE C . 12024 1 608 . 1 1 54 54 ILE CA C 13 65.5960 0.3 . 1 . . . . . 54 ILE CA . 12024 1 609 . 1 1 54 54 ILE CB C 13 38.4720 0.3 . 1 . . . . . 54 ILE CB . 12024 1 610 . 1 1 54 54 ILE CD1 C 13 15.0720 0.3 . 1 . . . . . 54 ILE CD1 . 12024 1 611 . 1 1 54 54 ILE CG1 C 13 29.2350 0.3 . 1 . . . . . 54 ILE CG1 . 12024 1 612 . 1 1 54 54 ILE CG2 C 13 17.8860 0.3 . 1 . . . . . 54 ILE CG2 . 12024 1 613 . 1 1 54 54 ILE N N 15 120.6240 0.2 . 1 . . . . . 54 ILE N . 12024 1 614 . 1 1 55 55 LEU H H 1 8.3020 0.02 . 1 . . . . . 55 LEU H . 12024 1 615 . 1 1 55 55 LEU HA H 1 4.2570 0.02 . 1 . . . . . 55 LEU HA . 12024 1 616 . 1 1 55 55 LEU HB2 H 1 1.5980 0.02 . 2 . . . . . 55 LEU HB2 . 12024 1 617 . 1 1 55 55 LEU HB3 H 1 2.3820 0.02 . 2 . . . . . 55 LEU HB3 . 12024 1 618 . 1 1 55 55 LEU HD11 H 1 1.0290 0.02 . 2 . . . . . 55 LEU HD11 . 12024 1 619 . 1 1 55 55 LEU HD12 H 1 1.0290 0.02 . 2 . . . . . 55 LEU HD11 . 12024 1 620 . 1 1 55 55 LEU HD13 H 1 1.0290 0.02 . 2 . . . . . 55 LEU HD11 . 12024 1 621 . 1 1 55 55 LEU HD21 H 1 0.9950 0.02 . 2 . . . . . 55 LEU HD21 . 12024 1 622 . 1 1 55 55 LEU HD22 H 1 0.9950 0.02 . 2 . . . . . 55 LEU HD21 . 12024 1 623 . 1 1 55 55 LEU HD23 H 1 0.9950 0.02 . 2 . . . . . 55 LEU HD21 . 12024 1 624 . 1 1 55 55 LEU HG H 1 1.8480 0.02 . 1 . . . . . 55 LEU HG . 12024 1 625 . 1 1 55 55 LEU C C 13 178.0650 0.3 . 1 . . . . . 55 LEU C . 12024 1 626 . 1 1 55 55 LEU CA C 13 58.3670 0.3 . 1 . . . . . 55 LEU CA . 12024 1 627 . 1 1 55 55 LEU CB C 13 42.2780 0.3 . 1 . . . . . 55 LEU CB . 12024 1 628 . 1 1 55 55 LEU CD1 C 13 23.7010 0.3 . 2 . . . . . 55 LEU CD1 . 12024 1 629 . 1 1 55 55 LEU CD2 C 13 26.4000 0.3 . 2 . . . . . 55 LEU CD2 . 12024 1 630 . 1 1 55 55 LEU CG C 13 27.9220 0.3 . 1 . . . . . 55 LEU CG . 12024 1 631 . 1 1 55 55 LEU N N 15 122.5200 0.2 . 1 . . . . . 55 LEU N . 12024 1 632 . 1 1 56 56 GLN H H 1 8.7990 0.02 . 1 . . . . . 56 GLN H . 12024 1 633 . 1 1 56 56 GLN HA H 1 3.7850 0.02 . 1 . . . . . 56 GLN HA . 12024 1 634 . 1 1 56 56 GLN HB2 H 1 2.3960 0.02 . 2 . . . . . 56 GLN HB2 . 12024 1 635 . 1 1 56 56 GLN HB3 H 1 2.3960 0.02 . 2 . . . . . 56 GLN HB3 . 12024 1 636 . 1 1 56 56 GLN HE21 H 1 7.1520 0.02 . 2 . . . . . 56 GLN HE21 . 12024 1 637 . 1 1 56 56 GLN HE22 H 1 6.7550 0.02 . 2 . . . . . 56 GLN HE22 . 12024 1 638 . 1 1 56 56 GLN HG2 H 1 2.0930 0.02 . 2 . . . . . 56 GLN HG2 . 12024 1 639 . 1 1 56 56 GLN HG3 H 1 2.0930 0.02 . 2 . . . . . 56 GLN HG3 . 12024 1 640 . 1 1 56 56 GLN C C 13 178.2790 0.3 . 1 . . . . . 56 GLN C . 12024 1 641 . 1 1 56 56 GLN CA C 13 59.6160 0.3 . 1 . . . . . 56 GLN CA . 12024 1 642 . 1 1 56 56 GLN CB C 13 28.5910 0.3 . 1 . . . . . 56 GLN CB . 12024 1 643 . 1 1 56 56 GLN CG C 13 33.4560 0.3 . 1 . . . . . 56 GLN CG . 12024 1 644 . 1 1 56 56 GLN N N 15 119.2420 0.2 . 1 . . . . . 56 GLN N . 12024 1 645 . 1 1 56 56 GLN NE2 N 15 110.9140 0.2 . 1 . . . . . 56 GLN NE2 . 12024 1 646 . 1 1 57 57 MET H H 1 8.1440 0.02 . 1 . . . . . 57 MET H . 12024 1 647 . 1 1 57 57 MET HA H 1 4.0300 0.02 . 1 . . . . . 57 MET HA . 12024 1 648 . 1 1 57 57 MET HB2 H 1 1.9900 0.02 . 2 . . . . . 57 MET HB2 . 12024 1 649 . 1 1 57 57 MET HB3 H 1 2.3710 0.02 . 2 . . . . . 57 MET HB3 . 12024 1 650 . 1 1 57 57 MET HE1 H 1 2.0710 0.02 . 1 . . . . . 57 MET HE1 . 12024 1 651 . 1 1 57 57 MET HE2 H 1 2.0710 0.02 . 1 . . . . . 57 MET HE1 . 12024 1 652 . 1 1 57 57 MET HE3 H 1 2.0710 0.02 . 1 . . . . . 57 MET HE1 . 12024 1 653 . 1 1 57 57 MET HG2 H 1 2.8250 0.02 . 2 . . . . . 57 MET HG2 . 12024 1 654 . 1 1 57 57 MET HG3 H 1 2.6790 0.02 . 2 . . . . . 57 MET HG3 . 12024 1 655 . 1 1 57 57 MET C C 13 178.7780 0.3 . 1 . . . . . 57 MET C . 12024 1 656 . 1 1 57 57 MET CA C 13 58.8520 0.3 . 1 . . . . . 57 MET CA . 12024 1 657 . 1 1 57 57 MET CB C 13 32.4330 0.3 . 1 . . . . . 57 MET CB . 12024 1 658 . 1 1 57 57 MET CE C 13 17.5000 0.3 . 1 . . . . . 57 MET CE . 12024 1 659 . 1 1 57 57 MET CG C 13 32.4330 0.3 . 1 . . . . . 57 MET CG . 12024 1 660 . 1 1 57 57 MET N N 15 116.9670 0.2 . 1 . . . . . 57 MET N . 12024 1 661 . 1 1 58 58 TYR H H 1 8.3620 0.02 . 1 . . . . . 58 TYR H . 12024 1 662 . 1 1 58 58 TYR HA H 1 4.1240 0.02 . 1 . . . . . 58 TYR HA . 12024 1 663 . 1 1 58 58 TYR HB2 H 1 3.1460 0.02 . 2 . . . . . 58 TYR HB2 . 12024 1 664 . 1 1 58 58 TYR HB3 H 1 3.4240 0.02 . 2 . . . . . 58 TYR HB3 . 12024 1 665 . 1 1 58 58 TYR HD1 H 1 6.9610 0.02 . 3 . . . . . 58 TYR HD1 . 12024 1 666 . 1 1 58 58 TYR HD2 H 1 6.9610 0.02 . 3 . . . . . 58 TYR HD2 . 12024 1 667 . 1 1 58 58 TYR HE1 H 1 6.7290 0.02 . 3 . . . . . 58 TYR HE1 . 12024 1 668 . 1 1 58 58 TYR HE2 H 1 6.7290 0.02 . 3 . . . . . 58 TYR HE2 . 12024 1 669 . 1 1 58 58 TYR C C 13 180.0920 0.3 . 1 . . . . . 58 TYR C . 12024 1 670 . 1 1 58 58 TYR CA C 13 61.6080 0.3 . 1 . . . . . 58 TYR CA . 12024 1 671 . 1 1 58 58 TYR CB C 13 38.5640 0.3 . 1 . . . . . 58 TYR CB . 12024 1 672 . 1 1 58 58 TYR CD1 C 13 133.1100 0.3 . 3 . . . . . 58 TYR CD1 . 12024 1 673 . 1 1 58 58 TYR CD2 C 13 133.1100 0.3 . 3 . . . . . 58 TYR CD2 . 12024 1 674 . 1 1 58 58 TYR CE1 C 13 118.5890 0.3 . 3 . . . . . 58 TYR CE1 . 12024 1 675 . 1 1 58 58 TYR CE2 C 13 118.5890 0.3 . 3 . . . . . 58 TYR CE2 . 12024 1 676 . 1 1 58 58 TYR N N 15 121.0650 0.2 . 1 . . . . . 58 TYR N . 12024 1 677 . 1 1 59 59 LEU H H 1 8.3310 0.02 . 1 . . . . . 59 LEU H . 12024 1 678 . 1 1 59 59 LEU HA H 1 3.9870 0.02 . 1 . . . . . 59 LEU HA . 12024 1 679 . 1 1 59 59 LEU HB2 H 1 1.4810 0.02 . 2 . . . . . 59 LEU HB2 . 12024 1 680 . 1 1 59 59 LEU HB3 H 1 1.9950 0.02 . 2 . . . . . 59 LEU HB3 . 12024 1 681 . 1 1 59 59 LEU HD11 H 1 0.9260 0.02 . 2 . . . . . 59 LEU HD11 . 12024 1 682 . 1 1 59 59 LEU HD12 H 1 0.9260 0.02 . 2 . . . . . 59 LEU HD11 . 12024 1 683 . 1 1 59 59 LEU HD13 H 1 0.9260 0.02 . 2 . . . . . 59 LEU HD11 . 12024 1 684 . 1 1 59 59 LEU HD21 H 1 0.8630 0.02 . 2 . . . . . 59 LEU HD21 . 12024 1 685 . 1 1 59 59 LEU HD22 H 1 0.8630 0.02 . 2 . . . . . 59 LEU HD21 . 12024 1 686 . 1 1 59 59 LEU HD23 H 1 0.8630 0.02 . 2 . . . . . 59 LEU HD21 . 12024 1 687 . 1 1 59 59 LEU HG H 1 2.0330 0.02 . 1 . . . . . 59 LEU HG . 12024 1 688 . 1 1 59 59 LEU C C 13 178.4870 0.3 . 1 . . . . . 59 LEU C . 12024 1 689 . 1 1 59 59 LEU CA C 13 57.3300 0.3 . 1 . . . . . 59 LEU CA . 12024 1 690 . 1 1 59 59 LEU CB C 13 41.2740 0.3 . 1 . . . . . 59 LEU CB . 12024 1 691 . 1 1 59 59 LEU CD1 C 13 22.3880 0.3 . 2 . . . . . 59 LEU CD1 . 12024 1 692 . 1 1 59 59 LEU CD2 C 13 26.8900 0.3 . 2 . . . . . 59 LEU CD2 . 12024 1 693 . 1 1 59 59 LEU CG C 13 26.8900 0.3 . 1 . . . . . 59 LEU CG . 12024 1 694 . 1 1 59 59 LEU N N 15 122.2490 0.2 . 1 . . . . . 59 LEU N . 12024 1 695 . 1 1 60 60 LEU H H 1 7.6720 0.02 . 1 . . . . . 60 LEU H . 12024 1 696 . 1 1 60 60 LEU HA H 1 4.3410 0.02 . 1 . . . . . 60 LEU HA . 12024 1 697 . 1 1 60 60 LEU HB2 H 1 1.7780 0.02 . 2 . . . . . 60 LEU HB2 . 12024 1 698 . 1 1 60 60 LEU HB3 H 1 1.6530 0.02 . 2 . . . . . 60 LEU HB3 . 12024 1 699 . 1 1 60 60 LEU HD11 H 1 0.8130 0.02 . 2 . . . . . 60 LEU HD11 . 12024 1 700 . 1 1 60 60 LEU HD12 H 1 0.8130 0.02 . 2 . . . . . 60 LEU HD11 . 12024 1 701 . 1 1 60 60 LEU HD13 H 1 0.8130 0.02 . 2 . . . . . 60 LEU HD11 . 12024 1 702 . 1 1 60 60 LEU HD21 H 1 0.8350 0.02 . 2 . . . . . 60 LEU HD21 . 12024 1 703 . 1 1 60 60 LEU HD22 H 1 0.8350 0.02 . 2 . . . . . 60 LEU HD21 . 12024 1 704 . 1 1 60 60 LEU HD23 H 1 0.8350 0.02 . 2 . . . . . 60 LEU HD21 . 12024 1 705 . 1 1 60 60 LEU HG H 1 1.7800 0.02 . 1 . . . . . 60 LEU HG . 12024 1 706 . 1 1 60 60 LEU C C 13 177.4890 0.3 . 1 . . . . . 60 LEU C . 12024 1 707 . 1 1 60 60 LEU CA C 13 54.8880 0.3 . 1 . . . . . 60 LEU CA . 12024 1 708 . 1 1 60 60 LEU CB C 13 42.6280 0.3 . 1 . . . . . 60 LEU CB . 12024 1 709 . 1 1 60 60 LEU CD1 C 13 22.2000 0.3 . 2 . . . . . 60 LEU CD1 . 12024 1 710 . 1 1 60 60 LEU CD2 C 13 25.4830 0.3 . 2 . . . . . 60 LEU CD2 . 12024 1 711 . 1 1 60 60 LEU CG C 13 25.4830 0.3 . 1 . . . . . 60 LEU CG . 12024 1 712 . 1 1 60 60 LEU N N 15 117.9480 0.2 . 1 . . . . . 60 LEU N . 12024 1 713 . 1 1 61 61 GLY H H 1 7.7770 0.02 . 1 . . . . . 61 GLY H . 12024 1 714 . 1 1 61 61 GLY HA2 H 1 3.8350 0.02 . 2 . . . . . 61 GLY HA2 . 12024 1 715 . 1 1 61 61 GLY HA3 H 1 4.0850 0.02 . 2 . . . . . 61 GLY HA3 . 12024 1 716 . 1 1 61 61 GLY C C 13 175.2510 0.3 . 1 . . . . . 61 GLY C . 12024 1 717 . 1 1 61 61 GLY CA C 13 46.1810 0.3 . 1 . . . . . 61 GLY CA . 12024 1 718 . 1 1 61 61 GLY N N 15 107.8100 0.2 . 1 . . . . . 61 GLY N . 12024 1 719 . 1 1 62 62 LYS H H 1 7.9770 0.02 . 1 . . . . . 62 LYS H . 12024 1 720 . 1 1 62 62 LYS HA H 1 4.5460 0.02 . 1 . . . . . 62 LYS HA . 12024 1 721 . 1 1 62 62 LYS HB2 H 1 1.5830 0.02 . 2 . . . . . 62 LYS HB2 . 12024 1 722 . 1 1 62 62 LYS HB3 H 1 2.0280 0.02 . 2 . . . . . 62 LYS HB3 . 12024 1 723 . 1 1 62 62 LYS HD2 H 1 1.6680 0.02 . 2 . . . . . 62 LYS HD2 . 12024 1 724 . 1 1 62 62 LYS HD3 H 1 1.6310 0.02 . 2 . . . . . 62 LYS HD3 . 12024 1 725 . 1 1 62 62 LYS HE2 H 1 3.0000 0.02 . 2 . . . . . 62 LYS HE2 . 12024 1 726 . 1 1 62 62 LYS HE3 H 1 2.9540 0.02 . 2 . . . . . 62 LYS HE3 . 12024 1 727 . 1 1 62 62 LYS HG2 H 1 1.3530 0.02 . 2 . . . . . 62 LYS HG2 . 12024 1 728 . 1 1 62 62 LYS HG3 H 1 1.2900 0.02 . 2 . . . . . 62 LYS HG3 . 12024 1 729 . 1 1 62 62 LYS C C 13 176.3250 0.3 . 1 . . . . . 62 LYS C . 12024 1 730 . 1 1 62 62 LYS CA C 13 54.8340 0.3 . 1 . . . . . 62 LYS CA . 12024 1 731 . 1 1 62 62 LYS CB C 13 33.1010 0.3 . 1 . . . . . 62 LYS CB . 12024 1 732 . 1 1 62 62 LYS CD C 13 28.8600 0.3 . 1 . . . . . 62 LYS CD . 12024 1 733 . 1 1 62 62 LYS CE C 13 42.2730 0.3 . 1 . . . . . 62 LYS CE . 12024 1 734 . 1 1 62 62 LYS CG C 13 24.9200 0.3 . 1 . . . . . 62 LYS CG . 12024 1 735 . 1 1 62 62 LYS N N 15 118.9710 0.2 . 1 . . . . . 62 LYS N . 12024 1 736 . 1 1 63 63 GLY H H 1 8.4730 0.02 . 1 . . . . . 63 GLY H . 12024 1 737 . 1 1 63 63 GLY HA2 H 1 3.8740 0.02 . 2 . . . . . 63 GLY HA2 . 12024 1 738 . 1 1 63 63 GLY HA3 H 1 4.1000 0.02 . 2 . . . . . 63 GLY HA3 . 12024 1 739 . 1 1 63 63 GLY C C 13 174.7520 0.3 . 1 . . . . . 63 GLY C . 12024 1 740 . 1 1 63 63 GLY CA C 13 45.5900 0.3 . 1 . . . . . 63 GLY CA . 12024 1 741 . 1 1 63 63 GLY N N 15 108.9490 0.2 . 1 . . . . . 63 GLY N . 12024 1 742 . 1 1 64 64 GLY H H 1 8.4370 0.02 . 1 . . . . . 64 GLY H . 12024 1 743 . 1 1 64 64 GLY HA2 H 1 4.1000 0.02 . 2 . . . . . 64 GLY HA2 . 12024 1 744 . 1 1 64 64 GLY HA3 H 1 4.1000 0.02 . 2 . . . . . 64 GLY HA3 . 12024 1 745 . 1 1 64 64 GLY C C 13 174.5710 0.3 . 1 . . . . . 64 GLY C . 12024 1 746 . 1 1 64 64 GLY CA C 13 45.4190 0.3 . 1 . . . . . 64 GLY CA . 12024 1 747 . 1 1 64 64 GLY N N 15 109.3920 0.2 . 1 . . . . . 64 GLY N . 12024 1 748 . 1 1 65 65 THR H H 1 8.3040 0.02 . 1 . . . . . 65 THR H . 12024 1 749 . 1 1 65 65 THR HA H 1 4.4920 0.02 . 1 . . . . . 65 THR HA . 12024 1 750 . 1 1 65 65 THR HB H 1 4.3120 0.02 . 1 . . . . . 65 THR HB . 12024 1 751 . 1 1 65 65 THR HG21 H 1 1.2270 0.02 . 1 . . . . . 65 THR HG21 . 12024 1 752 . 1 1 65 65 THR HG22 H 1 1.2270 0.02 . 1 . . . . . 65 THR HG21 . 12024 1 753 . 1 1 65 65 THR HG23 H 1 1.2270 0.02 . 1 . . . . . 65 THR HG21 . 12024 1 754 . 1 1 65 65 THR C C 13 174.5440 0.3 . 1 . . . . . 65 THR C . 12024 1 755 . 1 1 65 65 THR CA C 13 62.0350 0.3 . 1 . . . . . 65 THR CA . 12024 1 756 . 1 1 65 65 THR CB C 13 69.2520 0.3 . 1 . . . . . 65 THR CB . 12024 1 757 . 1 1 65 65 THR CG2 C 13 21.6700 0.3 . 1 . . . . . 65 THR CG2 . 12024 1 758 . 1 1 65 65 THR N N 15 114.9710 0.2 . 1 . . . . . 65 THR N . 12024 1 759 . 1 1 66 66 SER H H 1 8.3280 0.02 . 1 . . . . . 66 SER H . 12024 1 760 . 1 1 66 66 SER HA H 1 4.5880 0.02 . 1 . . . . . 66 SER HA . 12024 1 761 . 1 1 66 66 SER HB2 H 1 3.9680 0.02 . 2 . . . . . 66 SER HB2 . 12024 1 762 . 1 1 66 66 SER HB3 H 1 3.9680 0.02 . 2 . . . . . 66 SER HB3 . 12024 1 763 . 1 1 66 66 SER C C 13 173.9270 0.3 . 1 . . . . . 66 SER C . 12024 1 764 . 1 1 66 66 SER CA C 13 58.9410 0.3 . 1 . . . . . 66 SER CA . 12024 1 765 . 1 1 66 66 SER CB C 13 65.4090 0.3 . 1 . . . . . 66 SER CB . 12024 1 766 . 1 1 66 66 SER N N 15 119.8430 0.2 . 1 . . . . . 66 SER N . 12024 1 767 . 1 1 67 67 ASP H H 1 8.8180 0.02 . 1 . . . . . 67 ASP H . 12024 1 768 . 1 1 67 67 ASP HA H 1 4.6870 0.02 . 1 . . . . . 67 ASP HA . 12024 1 769 . 1 1 67 67 ASP HB2 H 1 2.5440 0.02 . 2 . . . . . 67 ASP HB2 . 12024 1 770 . 1 1 67 67 ASP HB3 H 1 2.9430 0.02 . 2 . . . . . 67 ASP HB3 . 12024 1 771 . 1 1 67 67 ASP C C 13 175.2880 0.3 . 1 . . . . . 67 ASP C . 12024 1 772 . 1 1 67 67 ASP CA C 13 54.1390 0.3 . 1 . . . . . 67 ASP CA . 12024 1 773 . 1 1 67 67 ASP CB C 13 40.8480 0.3 . 1 . . . . . 67 ASP CB . 12024 1 774 . 1 1 67 67 ASP N N 15 118.6810 0.2 . 1 . . . . . 67 ASP N . 12024 1 775 . 1 1 68 68 ILE H H 1 7.6690 0.02 . 1 . . . . . 68 ILE H . 12024 1 776 . 1 1 68 68 ILE HA H 1 3.1150 0.02 . 1 . . . . . 68 ILE HA . 12024 1 777 . 1 1 68 68 ILE HB H 1 1.1210 0.02 . 1 . . . . . 68 ILE HB . 12024 1 778 . 1 1 68 68 ILE HD11 H 1 0.7450 0.02 . 1 . . . . . 68 ILE HD11 . 12024 1 779 . 1 1 68 68 ILE HD12 H 1 0.7450 0.02 . 1 . . . . . 68 ILE HD11 . 12024 1 780 . 1 1 68 68 ILE HD13 H 1 0.7450 0.02 . 1 . . . . . 68 ILE HD11 . 12024 1 781 . 1 1 68 68 ILE HG12 H 1 0.5730 0.02 . 2 . . . . . 68 ILE HG12 . 12024 1 782 . 1 1 68 68 ILE HG13 H 1 1.5910 0.02 . 2 . . . . . 68 ILE HG13 . 12024 1 783 . 1 1 68 68 ILE HG21 H 1 -0.0050 0.02 . 1 . . . . . 68 ILE HG21 . 12024 1 784 . 1 1 68 68 ILE HG22 H 1 -0.0050 0.02 . 1 . . . . . 68 ILE HG21 . 12024 1 785 . 1 1 68 68 ILE HG23 H 1 -0.0050 0.02 . 1 . . . . . 68 ILE HG21 . 12024 1 786 . 1 1 68 68 ILE C C 13 177.0590 0.3 . 1 . . . . . 68 ILE C . 12024 1 787 . 1 1 68 68 ILE CA C 13 64.3660 0.3 . 1 . . . . . 68 ILE CA . 12024 1 788 . 1 1 68 68 ILE CB C 13 36.8130 0.3 . 1 . . . . . 68 ILE CB . 12024 1 789 . 1 1 68 68 ILE CD1 C 13 15.0900 0.3 . 1 . . . . . 68 ILE CD1 . 12024 1 790 . 1 1 68 68 ILE CG1 C 13 30.4540 0.3 . 1 . . . . . 68 ILE CG1 . 12024 1 791 . 1 1 68 68 ILE CG2 C 13 16.8400 0.3 . 1 . . . . . 68 ILE CG2 . 12024 1 792 . 1 1 68 68 ILE N N 15 118.8800 0.2 . 1 . . . . . 68 ILE N . 12024 1 793 . 1 1 69 69 GLY H H 1 9.1630 0.02 . 1 . . . . . 69 GLY H . 12024 1 794 . 1 1 69 69 GLY HA2 H 1 3.1390 0.02 . 2 . . . . . 69 GLY HA2 . 12024 1 795 . 1 1 69 69 GLY HA3 H 1 4.3950 0.02 . 2 . . . . . 69 GLY HA3 . 12024 1 796 . 1 1 69 69 GLY C C 13 174.0430 0.3 . 1 . . . . . 69 GLY C . 12024 1 797 . 1 1 69 69 GLY CA C 13 44.8600 0.3 . 1 . . . . . 69 GLY CA . 12024 1 798 . 1 1 69 69 GLY N N 15 115.1410 0.2 . 1 . . . . . 69 GLY N . 12024 1 799 . 1 1 70 70 LYS H H 1 8.0730 0.02 . 1 . . . . . 70 LYS H . 12024 1 800 . 1 1 70 70 LYS HA H 1 4.3510 0.02 . 1 . . . . . 70 LYS HA . 12024 1 801 . 1 1 70 70 LYS HB2 H 1 1.9430 0.02 . 2 . . . . . 70 LYS HB2 . 12024 1 802 . 1 1 70 70 LYS HB3 H 1 1.8430 0.02 . 2 . . . . . 70 LYS HB3 . 12024 1 803 . 1 1 70 70 LYS HD2 H 1 1.6830 0.02 . 2 . . . . . 70 LYS HD2 . 12024 1 804 . 1 1 70 70 LYS HD3 H 1 1.5590 0.02 . 2 . . . . . 70 LYS HD3 . 12024 1 805 . 1 1 70 70 LYS HE2 H 1 3.0400 0.02 . 2 . . . . . 70 LYS HE2 . 12024 1 806 . 1 1 70 70 LYS HE3 H 1 3.0400 0.02 . 2 . . . . . 70 LYS HE3 . 12024 1 807 . 1 1 70 70 LYS HG2 H 1 1.3330 0.02 . 2 . . . . . 70 LYS HG2 . 12024 1 808 . 1 1 70 70 LYS HG3 H 1 1.3330 0.02 . 2 . . . . . 70 LYS HG3 . 12024 1 809 . 1 1 70 70 LYS C C 13 175.1180 0.3 . 1 . . . . . 70 LYS C . 12024 1 810 . 1 1 70 70 LYS CA C 13 56.0430 0.3 . 1 . . . . . 70 LYS CA . 12024 1 811 . 1 1 70 70 LYS CB C 13 33.3660 0.3 . 1 . . . . . 70 LYS CB . 12024 1 812 . 1 1 70 70 LYS CD C 13 29.5160 0.3 . 1 . . . . . 70 LYS CD . 12024 1 813 . 1 1 70 70 LYS CE C 13 42.4600 0.3 . 1 . . . . . 70 LYS CE . 12024 1 814 . 1 1 70 70 LYS CG C 13 25.8580 0.3 . 1 . . . . . 70 LYS CG . 12024 1 815 . 1 1 70 70 LYS N N 15 121.1190 0.2 . 1 . . . . . 70 LYS N . 12024 1 816 . 1 1 71 71 ASN H H 1 8.5560 0.02 . 1 . . . . . 71 ASN H . 12024 1 817 . 1 1 71 71 ASN HA H 1 5.3080 0.02 . 1 . . . . . 71 ASN HA . 12024 1 818 . 1 1 71 71 ASN HB2 H 1 2.4610 0.02 . 2 . . . . . 71 ASN HB2 . 12024 1 819 . 1 1 71 71 ASN HB3 H 1 2.6610 0.02 . 2 . . . . . 71 ASN HB3 . 12024 1 820 . 1 1 71 71 ASN HD21 H 1 7.4420 0.02 . 2 . . . . . 71 ASN HD21 . 12024 1 821 . 1 1 71 71 ASN HD22 H 1 6.8740 0.02 . 2 . . . . . 71 ASN HD22 . 12024 1 822 . 1 1 71 71 ASN C C 13 175.2690 0.3 . 1 . . . . . 71 ASN C . 12024 1 823 . 1 1 71 71 ASN CA C 13 52.5270 0.3 . 1 . . . . . 71 ASN CA . 12024 1 824 . 1 1 71 71 ASN CB C 13 39.3100 0.3 . 1 . . . . . 71 ASN CB . 12024 1 825 . 1 1 71 71 ASN N N 15 118.6450 0.2 . 1 . . . . . 71 ASN N . 12024 1 826 . 1 1 71 71 ASN ND2 N 15 112.6600 0.2 . 1 . . . . . 71 ASN ND2 . 12024 1 827 . 1 1 72 72 ARG H H 1 9.0110 0.02 . 1 . . . . . 72 ARG H . 12024 1 828 . 1 1 72 72 ARG HA H 1 4.4310 0.02 . 1 . . . . . 72 ARG HA . 12024 1 829 . 1 1 72 72 ARG HB2 H 1 1.6670 0.02 . 2 . . . . . 72 ARG HB2 . 12024 1 830 . 1 1 72 72 ARG HB3 H 1 1.5930 0.02 . 2 . . . . . 72 ARG HB3 . 12024 1 831 . 1 1 72 72 ARG HD2 H 1 3.1380 0.02 . 2 . . . . . 72 ARG HD2 . 12024 1 832 . 1 1 72 72 ARG HD3 H 1 3.0380 0.02 . 2 . . . . . 72 ARG HD3 . 12024 1 833 . 1 1 72 72 ARG HE H 1 7.1710 0.02 . 1 . . . . . 72 ARG HE . 12024 1 834 . 1 1 72 72 ARG HG2 H 1 1.5000 0.02 . 2 . . . . . 72 ARG HG2 . 12024 1 835 . 1 1 72 72 ARG HG3 H 1 1.4020 0.02 . 2 . . . . . 72 ARG HG3 . 12024 1 836 . 1 1 72 72 ARG C C 13 175.2040 0.3 . 1 . . . . . 72 ARG C . 12024 1 837 . 1 1 72 72 ARG CA C 13 55.3980 0.3 . 1 . . . . . 72 ARG CA . 12024 1 838 . 1 1 72 72 ARG CB C 13 32.2870 0.3 . 1 . . . . . 72 ARG CB . 12024 1 839 . 1 1 72 72 ARG CD C 13 43.6800 0.3 . 1 . . . . . 72 ARG CD . 12024 1 840 . 1 1 72 72 ARG CG C 13 27.0780 0.3 . 1 . . . . . 72 ARG CG . 12024 1 841 . 1 1 72 72 ARG N N 15 125.5800 0.2 . 1 . . . . . 72 ARG N . 12024 1 842 . 1 1 72 72 ARG NE N 15 85.0400 0.2 . 1 . . . . . 72 ARG NE . 12024 1 843 . 1 1 73 73 ILE H H 1 8.6030 0.02 . 1 . . . . . 73 ILE H . 12024 1 844 . 1 1 73 73 ILE HA H 1 3.9850 0.02 . 1 . . . . . 73 ILE HA . 12024 1 845 . 1 1 73 73 ILE HB H 1 1.7300 0.02 . 1 . . . . . 73 ILE HB . 12024 1 846 . 1 1 73 73 ILE HD11 H 1 0.8140 0.02 . 1 . . . . . 73 ILE HD11 . 12024 1 847 . 1 1 73 73 ILE HD12 H 1 0.8140 0.02 . 1 . . . . . 73 ILE HD11 . 12024 1 848 . 1 1 73 73 ILE HD13 H 1 0.8140 0.02 . 1 . . . . . 73 ILE HD11 . 12024 1 849 . 1 1 73 73 ILE HG12 H 1 1.1770 0.02 . 2 . . . . . 73 ILE HG12 . 12024 1 850 . 1 1 73 73 ILE HG13 H 1 1.5000 0.02 . 2 . . . . . 73 ILE HG13 . 12024 1 851 . 1 1 73 73 ILE HG21 H 1 0.7690 0.02 . 1 . . . . . 73 ILE HG21 . 12024 1 852 . 1 1 73 73 ILE HG22 H 1 0.7690 0.02 . 1 . . . . . 73 ILE HG21 . 12024 1 853 . 1 1 73 73 ILE HG23 H 1 0.7690 0.02 . 1 . . . . . 73 ILE HG21 . 12024 1 854 . 1 1 73 73 ILE C C 13 175.5170 0.3 . 1 . . . . . 73 ILE C . 12024 1 855 . 1 1 73 73 ILE CA C 13 61.5510 0.3 . 1 . . . . . 73 ILE CA . 12024 1 856 . 1 1 73 73 ILE CB C 13 37.6170 0.3 . 1 . . . . . 73 ILE CB . 12024 1 857 . 1 1 73 73 ILE CD1 C 13 12.4400 0.3 . 1 . . . . . 73 ILE CD1 . 12024 1 858 . 1 1 73 73 ILE CG1 C 13 27.6400 0.3 . 1 . . . . . 73 ILE CG1 . 12024 1 859 . 1 1 73 73 ILE CG2 C 13 17.5200 0.3 . 1 . . . . . 73 ILE CG2 . 12024 1 860 . 1 1 73 73 ILE N N 15 127.5020 0.2 . 1 . . . . . 73 ILE N . 12024 1 861 . 1 1 74 74 TYR H H 1 8.0960 0.02 . 1 . . . . . 74 TYR H . 12024 1 862 . 1 1 74 74 TYR HA H 1 4.4920 0.02 . 1 . . . . . 74 TYR HA . 12024 1 863 . 1 1 74 74 TYR HB2 H 1 2.5460 0.02 . 2 . . . . . 74 TYR HB2 . 12024 1 864 . 1 1 74 74 TYR HB3 H 1 2.5960 0.02 . 2 . . . . . 74 TYR HB3 . 12024 1 865 . 1 1 74 74 TYR HD1 H 1 6.8840 0.02 . 3 . . . . . 74 TYR HD1 . 12024 1 866 . 1 1 74 74 TYR HD2 H 1 6.8840 0.02 . 3 . . . . . 74 TYR HD2 . 12024 1 867 . 1 1 74 74 TYR HE1 H 1 6.6120 0.02 . 3 . . . . . 74 TYR HE1 . 12024 1 868 . 1 1 74 74 TYR HE2 H 1 6.6120 0.02 . 3 . . . . . 74 TYR HE2 . 12024 1 869 . 1 1 74 74 TYR C C 13 174.8920 0.3 . 1 . . . . . 74 TYR C . 12024 1 870 . 1 1 74 74 TYR CA C 13 57.7810 0.3 . 1 . . . . . 74 TYR CA . 12024 1 871 . 1 1 74 74 TYR CB C 13 41.8510 0.3 . 1 . . . . . 74 TYR CB . 12024 1 872 . 1 1 74 74 TYR CD1 C 13 132.6720 0.3 . 3 . . . . . 74 TYR CD1 . 12024 1 873 . 1 1 74 74 TYR CD2 C 13 132.6720 0.3 . 3 . . . . . 74 TYR CD2 . 12024 1 874 . 1 1 74 74 TYR CE1 C 13 118.1870 0.3 . 3 . . . . . 74 TYR CE1 . 12024 1 875 . 1 1 74 74 TYR CE2 C 13 118.1870 0.3 . 3 . . . . . 74 TYR CE2 . 12024 1 876 . 1 1 74 74 TYR N N 15 125.9740 0.2 . 1 . . . . . 74 TYR N . 12024 1 877 . 1 1 75 75 THR H H 1 8.9630 0.02 . 1 . . . . . 75 THR H . 12024 1 878 . 1 1 75 75 THR HA H 1 4.2000 0.02 . 1 . . . . . 75 THR HA . 12024 1 879 . 1 1 75 75 THR HB H 1 4.0060 0.02 . 1 . . . . . 75 THR HB . 12024 1 880 . 1 1 75 75 THR HG21 H 1 1.0590 0.02 . 1 . . . . . 75 THR HG21 . 12024 1 881 . 1 1 75 75 THR HG22 H 1 1.0590 0.02 . 1 . . . . . 75 THR HG21 . 12024 1 882 . 1 1 75 75 THR HG23 H 1 1.0590 0.02 . 1 . . . . . 75 THR HG21 . 12024 1 883 . 1 1 75 75 THR C C 13 174.1440 0.3 . 1 . . . . . 75 THR C . 12024 1 884 . 1 1 75 75 THR CA C 13 61.5720 0.3 . 1 . . . . . 75 THR CA . 12024 1 885 . 1 1 75 75 THR CB C 13 69.9380 0.3 . 1 . . . . . 75 THR CB . 12024 1 886 . 1 1 75 75 THR CG2 C 13 20.7800 0.3 . 1 . . . . . 75 THR CG2 . 12024 1 887 . 1 1 75 75 THR N N 15 121.6300 0.2 . 1 . . . . . 75 THR N . 12024 1 888 . 1 1 76 76 TYR H H 1 8.0400 0.02 . 1 . . . . . 76 TYR H . 12024 1 889 . 1 1 76 76 TYR HA H 1 4.0000 0.02 . 1 . . . . . 76 TYR HA . 12024 1 890 . 1 1 76 76 TYR HB2 H 1 2.7160 0.02 . 2 . . . . . 76 TYR HB2 . 12024 1 891 . 1 1 76 76 TYR HB3 H 1 2.5640 0.02 . 2 . . . . . 76 TYR HB3 . 12024 1 892 . 1 1 76 76 TYR HD1 H 1 6.8390 0.02 . 3 . . . . . 76 TYR HD1 . 12024 1 893 . 1 1 76 76 TYR HD2 H 1 6.8390 0.02 . 3 . . . . . 76 TYR HD2 . 12024 1 894 . 1 1 76 76 TYR HE1 H 1 6.3900 0.02 . 3 . . . . . 76 TYR HE1 . 12024 1 895 . 1 1 76 76 TYR HE2 H 1 6.3900 0.02 . 3 . . . . . 76 TYR HE2 . 12024 1 896 . 1 1 76 76 TYR C C 13 175.6660 0.3 . 1 . . . . . 76 TYR C . 12024 1 897 . 1 1 76 76 TYR CA C 13 60.6480 0.3 . 1 . . . . . 76 TYR CA . 12024 1 898 . 1 1 76 76 TYR CB C 13 37.4290 0.3 . 1 . . . . . 76 TYR CB . 12024 1 899 . 1 1 76 76 TYR CD1 C 13 132.6720 0.3 . 3 . . . . . 76 TYR CD1 . 12024 1 900 . 1 1 76 76 TYR CD2 C 13 132.6720 0.3 . 3 . . . . . 76 TYR CD2 . 12024 1 901 . 1 1 76 76 TYR CE1 C 13 119.0920 0.3 . 3 . . . . . 76 TYR CE1 . 12024 1 902 . 1 1 76 76 TYR CE2 C 13 119.0920 0.3 . 3 . . . . . 76 TYR CE2 . 12024 1 903 . 1 1 76 76 TYR N N 15 127.3000 0.2 . 1 . . . . . 76 TYR N . 12024 1 904 . 1 1 77 77 GLY H H 1 9.1740 0.02 . 1 . . . . . 77 GLY H . 12024 1 905 . 1 1 77 77 GLY HA2 H 1 3.2770 0.02 . 2 . . . . . 77 GLY HA2 . 12024 1 906 . 1 1 77 77 GLY HA3 H 1 4.1150 0.02 . 2 . . . . . 77 GLY HA3 . 12024 1 907 . 1 1 77 77 GLY C C 13 171.0930 0.3 . 1 . . . . . 77 GLY C . 12024 1 908 . 1 1 77 77 GLY CA C 13 45.2790 0.3 . 1 . . . . . 77 GLY CA . 12024 1 909 . 1 1 77 77 GLY N N 15 111.2850 0.2 . 1 . . . . . 77 GLY N . 12024 1 910 . 1 1 78 78 ASP H H 1 7.9190 0.02 . 1 . . . . . 78 ASP H . 12024 1 911 . 1 1 78 78 ASP HA H 1 4.8020 0.02 . 1 . . . . . 78 ASP HA . 12024 1 912 . 1 1 78 78 ASP HB2 H 1 3.1800 0.02 . 2 . . . . . 78 ASP HB2 . 12024 1 913 . 1 1 78 78 ASP HB3 H 1 3.1800 0.02 . 2 . . . . . 78 ASP HB3 . 12024 1 914 . 1 1 78 78 ASP C C 13 176.3370 0.3 . 1 . . . . . 78 ASP C . 12024 1 915 . 1 1 78 78 ASP CA C 13 51.9140 0.3 . 1 . . . . . 78 ASP CA . 12024 1 916 . 1 1 78 78 ASP CB C 13 39.4200 0.3 . 1 . . . . . 78 ASP CB . 12024 1 917 . 1 1 78 78 ASP N N 15 117.4260 0.2 . 1 . . . . . 78 ASP N . 12024 1 918 . 1 1 79 79 ILE H H 1 8.2790 0.02 . 1 . . . . . 79 ILE H . 12024 1 919 . 1 1 79 79 ILE HA H 1 3.4840 0.02 . 1 . . . . . 79 ILE HA . 12024 1 920 . 1 1 79 79 ILE HB H 1 1.8010 0.02 . 1 . . . . . 79 ILE HB . 12024 1 921 . 1 1 79 79 ILE HD11 H 1 0.9070 0.02 . 1 . . . . . 79 ILE HD11 . 12024 1 922 . 1 1 79 79 ILE HD12 H 1 0.9070 0.02 . 1 . . . . . 79 ILE HD11 . 12024 1 923 . 1 1 79 79 ILE HD13 H 1 0.9070 0.02 . 1 . . . . . 79 ILE HD11 . 12024 1 924 . 1 1 79 79 ILE HG12 H 1 1.7270 0.02 . 2 . . . . . 79 ILE HG12 . 12024 1 925 . 1 1 79 79 ILE HG13 H 1 1.6760 0.02 . 2 . . . . . 79 ILE HG13 . 12024 1 926 . 1 1 79 79 ILE HG21 H 1 0.9070 0.02 . 1 . . . . . 79 ILE HG21 . 12024 1 927 . 1 1 79 79 ILE HG22 H 1 0.9070 0.02 . 1 . . . . . 79 ILE HG21 . 12024 1 928 . 1 1 79 79 ILE HG23 H 1 0.9070 0.02 . 1 . . . . . 79 ILE HG21 . 12024 1 929 . 1 1 79 79 ILE C C 13 177.1010 0.3 . 1 . . . . . 79 ILE C . 12024 1 930 . 1 1 79 79 ILE CA C 13 64.3940 0.3 . 1 . . . . . 79 ILE CA . 12024 1 931 . 1 1 79 79 ILE CB C 13 39.0270 0.3 . 1 . . . . . 79 ILE CB . 12024 1 932 . 1 1 79 79 ILE CD1 C 13 13.5710 0.3 . 1 . . . . . 79 ILE CD1 . 12024 1 933 . 1 1 79 79 ILE CG1 C 13 29.2100 0.3 . 1 . . . . . 79 ILE CG1 . 12024 1 934 . 1 1 79 79 ILE CG2 C 13 19.9700 0.3 . 1 . . . . . 79 ILE CG2 . 12024 1 935 . 1 1 79 79 ILE N N 15 127.0910 0.2 . 1 . . . . . 79 ILE N . 12024 1 936 . 1 1 80 80 ASP H H 1 8.1910 0.02 . 1 . . . . . 80 ASP H . 12024 1 937 . 1 1 80 80 ASP HA H 1 4.3620 0.02 . 1 . . . . . 80 ASP HA . 12024 1 938 . 1 1 80 80 ASP HB2 H 1 2.3000 0.02 . 2 . . . . . 80 ASP HB2 . 12024 1 939 . 1 1 80 80 ASP HB3 H 1 3.0070 0.02 . 2 . . . . . 80 ASP HB3 . 12024 1 940 . 1 1 80 80 ASP C C 13 176.3100 0.3 . 1 . . . . . 80 ASP C . 12024 1 941 . 1 1 80 80 ASP CA C 13 53.4050 0.3 . 1 . . . . . 80 ASP CA . 12024 1 942 . 1 1 80 80 ASP CB C 13 39.2060 0.3 . 1 . . . . . 80 ASP CB . 12024 1 943 . 1 1 80 80 ASP N N 15 116.2980 0.2 . 1 . . . . . 80 ASP N . 12024 1 944 . 1 1 81 81 ASN H H 1 7.3680 0.02 . 1 . . . . . 81 ASN H . 12024 1 945 . 1 1 81 81 ASN HA H 1 4.4000 0.02 . 1 . . . . . 81 ASN HA . 12024 1 946 . 1 1 81 81 ASN HB2 H 1 2.4610 0.02 . 2 . . . . . 81 ASN HB2 . 12024 1 947 . 1 1 81 81 ASN HB3 H 1 3.1160 0.02 . 2 . . . . . 81 ASN HB3 . 12024 1 948 . 1 1 81 81 ASN HD21 H 1 7.4760 0.02 . 2 . . . . . 81 ASN HD21 . 12024 1 949 . 1 1 81 81 ASN HD22 H 1 6.6570 0.02 . 2 . . . . . 81 ASN HD22 . 12024 1 950 . 1 1 81 81 ASN C C 13 174.7360 0.3 . 1 . . . . . 81 ASN C . 12024 1 951 . 1 1 81 81 ASN CA C 13 54.5140 0.3 . 1 . . . . . 81 ASN CA . 12024 1 952 . 1 1 81 81 ASN CB C 13 37.6040 0.3 . 1 . . . . . 81 ASN CB . 12024 1 953 . 1 1 81 81 ASN N N 15 115.4020 0.2 . 1 . . . . . 81 ASN N . 12024 1 954 . 1 1 81 81 ASN ND2 N 15 112.2400 0.2 . 1 . . . . . 81 ASN ND2 . 12024 1 955 . 1 1 82 82 ASN H H 1 8.6330 0.02 . 1 . . . . . 82 ASN H . 12024 1 956 . 1 1 82 82 ASN HA H 1 4.8040 0.02 . 1 . . . . . 82 ASN HA . 12024 1 957 . 1 1 82 82 ASN HB2 H 1 2.5840 0.02 . 2 . . . . . 82 ASN HB2 . 12024 1 958 . 1 1 82 82 ASN HB3 H 1 3.2570 0.02 . 2 . . . . . 82 ASN HB3 . 12024 1 959 . 1 1 82 82 ASN HD21 H 1 7.8720 0.02 . 2 . . . . . 82 ASN HD21 . 12024 1 960 . 1 1 82 82 ASN HD22 H 1 7.1910 0.02 . 2 . . . . . 82 ASN HD22 . 12024 1 961 . 1 1 82 82 ASN C C 13 176.9690 0.3 . 1 . . . . . 82 ASN C . 12024 1 962 . 1 1 82 82 ASN CA C 13 52.1750 0.3 . 1 . . . . . 82 ASN CA . 12024 1 963 . 1 1 82 82 ASN CB C 13 38.0970 0.3 . 1 . . . . . 82 ASN CB . 12024 1 964 . 1 1 82 82 ASN N N 15 117.9860 0.2 . 1 . . . . . 82 ASN N . 12024 1 965 . 1 1 82 82 ASN ND2 N 15 116.4560 0.2 . 1 . . . . . 82 ASN ND2 . 12024 1 966 . 1 1 83 83 GLY H H 1 10.3960 0.02 . 1 . . . . . 83 GLY H . 12024 1 967 . 1 1 83 83 GLY HA2 H 1 3.4610 0.02 . 2 . . . . . 83 GLY HA2 . 12024 1 968 . 1 1 83 83 GLY HA3 H 1 4.1920 0.02 . 2 . . . . . 83 GLY HA3 . 12024 1 969 . 1 1 83 83 GLY C C 13 173.3010 0.3 . 1 . . . . . 83 GLY C . 12024 1 970 . 1 1 83 83 GLY CA C 13 45.3900 0.3 . 1 . . . . . 83 GLY CA . 12024 1 971 . 1 1 83 83 GLY N N 15 112.9490 0.2 . 1 . . . . . 83 GLY N . 12024 1 972 . 1 1 84 84 ILE H H 1 7.4170 0.02 . 1 . . . . . 84 ILE H . 12024 1 973 . 1 1 84 84 ILE HA H 1 4.5390 0.02 . 1 . . . . . 84 ILE HA . 12024 1 974 . 1 1 84 84 ILE HB H 1 1.6380 0.02 . 1 . . . . . 84 ILE HB . 12024 1 975 . 1 1 84 84 ILE HD11 H 1 0.8430 0.02 . 1 . . . . . 84 ILE HD11 . 12024 1 976 . 1 1 84 84 ILE HD12 H 1 0.8430 0.02 . 1 . . . . . 84 ILE HD11 . 12024 1 977 . 1 1 84 84 ILE HD13 H 1 0.8430 0.02 . 1 . . . . . 84 ILE HD11 . 12024 1 978 . 1 1 84 84 ILE HG12 H 1 1.3040 0.02 . 2 . . . . . 84 ILE HG12 . 12024 1 979 . 1 1 84 84 ILE HG13 H 1 0.9150 0.02 . 2 . . . . . 84 ILE HG13 . 12024 1 980 . 1 1 84 84 ILE HG21 H 1 0.8200 0.02 . 1 . . . . . 84 ILE HG21 . 12024 1 981 . 1 1 84 84 ILE HG22 H 1 0.8200 0.02 . 1 . . . . . 84 ILE HG21 . 12024 1 982 . 1 1 84 84 ILE HG23 H 1 0.8200 0.02 . 1 . . . . . 84 ILE HG21 . 12024 1 983 . 1 1 84 84 ILE C C 13 174.1010 0.3 . 1 . . . . . 84 ILE C . 12024 1 984 . 1 1 84 84 ILE CA C 13 59.1020 0.3 . 1 . . . . . 84 ILE CA . 12024 1 985 . 1 1 84 84 ILE CB C 13 42.3660 0.3 . 1 . . . . . 84 ILE CB . 12024 1 986 . 1 1 84 84 ILE CD1 C 13 13.7590 0.3 . 1 . . . . . 84 ILE CD1 . 12024 1 987 . 1 1 84 84 ILE CG1 C 13 26.9840 0.3 . 1 . . . . . 84 ILE CG1 . 12024 1 988 . 1 1 84 84 ILE CG2 C 13 17.5100 0.3 . 1 . . . . . 84 ILE CG2 . 12024 1 989 . 1 1 84 84 ILE N N 15 117.3300 0.2 . 1 . . . . . 84 ILE N . 12024 1 990 . 1 1 85 85 VAL H H 1 8.9050 0.02 . 1 . . . . . 85 VAL H . 12024 1 991 . 1 1 85 85 VAL HA H 1 4.8640 0.02 . 1 . . . . . 85 VAL HA . 12024 1 992 . 1 1 85 85 VAL HB H 1 2.0920 0.02 . 1 . . . . . 85 VAL HB . 12024 1 993 . 1 1 85 85 VAL HG11 H 1 0.8050 0.02 . 2 . . . . . 85 VAL HG11 . 12024 1 994 . 1 1 85 85 VAL HG12 H 1 0.8050 0.02 . 2 . . . . . 85 VAL HG11 . 12024 1 995 . 1 1 85 85 VAL HG13 H 1 0.8050 0.02 . 2 . . . . . 85 VAL HG11 . 12024 1 996 . 1 1 85 85 VAL HG21 H 1 0.9790 0.02 . 2 . . . . . 85 VAL HG21 . 12024 1 997 . 1 1 85 85 VAL HG22 H 1 0.9790 0.02 . 2 . . . . . 85 VAL HG21 . 12024 1 998 . 1 1 85 85 VAL HG23 H 1 0.9790 0.02 . 2 . . . . . 85 VAL HG21 . 12024 1 999 . 1 1 85 85 VAL C C 13 174.7120 0.3 . 1 . . . . . 85 VAL C . 12024 1 1000 . 1 1 85 85 VAL CA C 13 61.5220 0.3 . 1 . . . . . 85 VAL CA . 12024 1 1001 . 1 1 85 85 VAL CB C 13 30.6640 0.3 . 1 . . . . . 85 VAL CB . 12024 1 1002 . 1 1 85 85 VAL CG1 C 13 21.1000 0.3 . 2 . . . . . 85 VAL CG1 . 12024 1 1003 . 1 1 85 85 VAL CG2 C 13 20.5100 0.3 . 2 . . . . . 85 VAL CG2 . 12024 1 1004 . 1 1 85 85 VAL N N 15 130.6570 0.2 . 1 . . . . . 85 VAL N . 12024 1 1005 . 1 1 86 86 ASP H H 1 10.3450 0.02 . 1 . . . . . 86 ASP H . 12024 1 1006 . 1 1 86 86 ASP HA H 1 4.7620 0.02 . 1 . . . . . 86 ASP HA . 12024 1 1007 . 1 1 86 86 ASP HB2 H 1 3.2680 0.02 . 2 . . . . . 86 ASP HB2 . 12024 1 1008 . 1 1 86 86 ASP HB3 H 1 3.2680 0.02 . 2 . . . . . 86 ASP HB3 . 12024 1 1009 . 1 1 86 86 ASP C C 13 176.7320 0.3 . 1 . . . . . 86 ASP C . 12024 1 1010 . 1 1 86 86 ASP CA C 13 52.7690 0.3 . 1 . . . . . 86 ASP CA . 12024 1 1011 . 1 1 86 86 ASP CB C 13 42.7760 0.3 . 1 . . . . . 86 ASP CB . 12024 1 1012 . 1 1 86 86 ASP N N 15 130.1800 0.2 . 1 . . . . . 86 ASP N . 12024 1 1013 . 1 1 87 87 GLU H H 1 8.6830 0.02 . 1 . . . . . 87 GLU H . 12024 1 1014 . 1 1 87 87 GLU HA H 1 4.1400 0.02 . 1 . . . . . 87 GLU HA . 12024 1 1015 . 1 1 87 87 GLU HB2 H 1 2.1670 0.02 . 2 . . . . . 87 GLU HB2 . 12024 1 1016 . 1 1 87 87 GLU HB3 H 1 2.0690 0.02 . 2 . . . . . 87 GLU HB3 . 12024 1 1017 . 1 1 87 87 GLU HG2 H 1 2.5350 0.02 . 2 . . . . . 87 GLU HG2 . 12024 1 1018 . 1 1 87 87 GLU HG3 H 1 2.4610 0.02 . 2 . . . . . 87 GLU HG3 . 12024 1 1019 . 1 1 87 87 GLU C C 13 177.8100 0.3 . 1 . . . . . 87 GLU C . 12024 1 1020 . 1 1 87 87 GLU CA C 13 58.9100 0.3 . 1 . . . . . 87 GLU CA . 12024 1 1021 . 1 1 87 87 GLU CB C 13 28.8140 0.3 . 1 . . . . . 87 GLU CB . 12024 1 1022 . 1 1 87 87 GLU CG C 13 34.3940 0.3 . 1 . . . . . 87 GLU CG . 12024 1 1023 . 1 1 87 87 GLU N N 15 116.2830 0.2 . 1 . . . . . 87 GLU N . 12024 1 1024 . 1 1 88 88 ASN H H 1 8.4700 0.02 . 1 . . . . . 88 ASN H . 12024 1 1025 . 1 1 88 88 ASN HA H 1 4.6000 0.02 . 1 . . . . . 88 ASN HA . 12024 1 1026 . 1 1 88 88 ASN HB2 H 1 2.6530 0.02 . 2 . . . . . 88 ASN HB2 . 12024 1 1027 . 1 1 88 88 ASN HB3 H 1 2.8350 0.02 . 2 . . . . . 88 ASN HB3 . 12024 1 1028 . 1 1 88 88 ASN HD21 H 1 8.0950 0.02 . 2 . . . . . 88 ASN HD21 . 12024 1 1029 . 1 1 88 88 ASN HD22 H 1 7.0840 0.02 . 2 . . . . . 88 ASN HD22 . 12024 1 1030 . 1 1 88 88 ASN C C 13 178.2700 0.3 . 1 . . . . . 88 ASN C . 12024 1 1031 . 1 1 88 88 ASN CA C 13 56.9590 0.3 . 1 . . . . . 88 ASN CA . 12024 1 1032 . 1 1 88 88 ASN CB C 13 38.4080 0.3 . 1 . . . . . 88 ASN CB . 12024 1 1033 . 1 1 88 88 ASN N N 15 117.4970 0.2 . 1 . . . . . 88 ASN N . 12024 1 1034 . 1 1 88 88 ASN ND2 N 15 115.9640 0.2 . 1 . . . . . 88 ASN ND2 . 12024 1 1035 . 1 1 89 89 ASP H H 1 7.6400 0.02 . 1 . . . . . 89 ASP H . 12024 1 1036 . 1 1 89 89 ASP HA H 1 4.4160 0.02 . 1 . . . . . 89 ASP HA . 12024 1 1037 . 1 1 89 89 ASP HB2 H 1 3.2460 0.02 . 2 . . . . . 89 ASP HB2 . 12024 1 1038 . 1 1 89 89 ASP HB3 H 1 3.2460 0.02 . 2 . . . . . 89 ASP HB3 . 12024 1 1039 . 1 1 89 89 ASP C C 13 177.3870 0.3 . 1 . . . . . 89 ASP C . 12024 1 1040 . 1 1 89 89 ASP CA C 13 58.6030 0.3 . 1 . . . . . 89 ASP CA . 12024 1 1041 . 1 1 89 89 ASP CB C 13 42.0150 0.3 . 1 . . . . . 89 ASP CB . 12024 1 1042 . 1 1 89 89 ASP N N 15 118.3790 0.2 . 1 . . . . . 89 ASP N . 12024 1 1043 . 1 1 90 90 TYR H H 1 7.4840 0.02 . 1 . . . . . 90 TYR H . 12024 1 1044 . 1 1 90 90 TYR HA H 1 4.1850 0.02 . 1 . . . . . 90 TYR HA . 12024 1 1045 . 1 1 90 90 TYR HB2 H 1 2.9270 0.02 . 2 . . . . . 90 TYR HB2 . 12024 1 1046 . 1 1 90 90 TYR HB3 H 1 3.3420 0.02 . 2 . . . . . 90 TYR HB3 . 12024 1 1047 . 1 1 90 90 TYR HD1 H 1 6.9860 0.02 . 3 . . . . . 90 TYR HD1 . 12024 1 1048 . 1 1 90 90 TYR HD2 H 1 6.9860 0.02 . 3 . . . . . 90 TYR HD2 . 12024 1 1049 . 1 1 90 90 TYR HE1 H 1 6.7410 0.02 . 3 . . . . . 90 TYR HE1 . 12024 1 1050 . 1 1 90 90 TYR HE2 H 1 6.7410 0.02 . 3 . . . . . 90 TYR HE2 . 12024 1 1051 . 1 1 90 90 TYR C C 13 177.4000 0.3 . 1 . . . . . 90 TYR C . 12024 1 1052 . 1 1 90 90 TYR CA C 13 61.2570 0.3 . 1 . . . . . 90 TYR CA . 12024 1 1053 . 1 1 90 90 TYR CB C 13 38.6520 0.3 . 1 . . . . . 90 TYR CB . 12024 1 1054 . 1 1 90 90 TYR CD1 C 13 132.1600 0.3 . 3 . . . . . 90 TYR CD1 . 12024 1 1055 . 1 1 90 90 TYR CD2 C 13 132.1600 0.3 . 3 . . . . . 90 TYR CD2 . 12024 1 1056 . 1 1 90 90 TYR CE1 C 13 118.5000 0.3 . 3 . . . . . 90 TYR CE1 . 12024 1 1057 . 1 1 90 90 TYR CE2 C 13 118.5000 0.3 . 3 . . . . . 90 TYR CE2 . 12024 1 1058 . 1 1 90 90 TYR N N 15 117.6960 0.2 . 1 . . . . . 90 TYR N . 12024 1 1059 . 1 1 91 91 ILE H H 1 8.6890 0.02 . 1 . . . . . 91 ILE H . 12024 1 1060 . 1 1 91 91 ILE HA H 1 3.5150 0.02 . 1 . . . . . 91 ILE HA . 12024 1 1061 . 1 1 91 91 ILE HB H 1 1.9460 0.02 . 1 . . . . . 91 ILE HB . 12024 1 1062 . 1 1 91 91 ILE HD11 H 1 0.9410 0.02 . 1 . . . . . 91 ILE HD11 . 12024 1 1063 . 1 1 91 91 ILE HD12 H 1 0.9410 0.02 . 1 . . . . . 91 ILE HD11 . 12024 1 1064 . 1 1 91 91 ILE HD13 H 1 0.9410 0.02 . 1 . . . . . 91 ILE HD11 . 12024 1 1065 . 1 1 91 91 ILE HG12 H 1 1.8660 0.02 . 2 . . . . . 91 ILE HG12 . 12024 1 1066 . 1 1 91 91 ILE HG13 H 1 1.3230 0.02 . 2 . . . . . 91 ILE HG13 . 12024 1 1067 . 1 1 91 91 ILE HG21 H 1 0.9100 0.02 . 1 . . . . . 91 ILE HG21 . 12024 1 1068 . 1 1 91 91 ILE HG22 H 1 0.9100 0.02 . 1 . . . . . 91 ILE HG21 . 12024 1 1069 . 1 1 91 91 ILE HG23 H 1 0.9100 0.02 . 1 . . . . . 91 ILE HG21 . 12024 1 1070 . 1 1 91 91 ILE C C 13 177.8120 0.3 . 1 . . . . . 91 ILE C . 12024 1 1071 . 1 1 91 91 ILE CA C 13 65.1550 0.3 . 1 . . . . . 91 ILE CA . 12024 1 1072 . 1 1 91 91 ILE CB C 13 38.0100 0.3 . 1 . . . . . 91 ILE CB . 12024 1 1073 . 1 1 91 91 ILE CD1 C 13 13.1000 0.3 . 1 . . . . . 91 ILE CD1 . 12024 1 1074 . 1 1 91 91 ILE CG1 C 13 29.2350 0.3 . 1 . . . . . 91 ILE CG1 . 12024 1 1075 . 1 1 91 91 ILE CG2 C 13 17.4700 0.3 . 1 . . . . . 91 ILE CG2 . 12024 1 1076 . 1 1 91 91 ILE N N 15 121.6690 0.2 . 1 . . . . . 91 ILE N . 12024 1 1077 . 1 1 92 92 LEU H H 1 7.5320 0.02 . 1 . . . . . 92 LEU H . 12024 1 1078 . 1 1 92 92 LEU HA H 1 4.0460 0.02 . 1 . . . . . 92 LEU HA . 12024 1 1079 . 1 1 92 92 LEU HB2 H 1 1.2920 0.02 . 2 . . . . . 92 LEU HB2 . 12024 1 1080 . 1 1 92 92 LEU HB3 H 1 2.1230 0.02 . 2 . . . . . 92 LEU HB3 . 12024 1 1081 . 1 1 92 92 LEU HD11 H 1 0.8880 0.02 . 2 . . . . . 92 LEU HD11 . 12024 1 1082 . 1 1 92 92 LEU HD12 H 1 0.8880 0.02 . 2 . . . . . 92 LEU HD11 . 12024 1 1083 . 1 1 92 92 LEU HD13 H 1 0.8880 0.02 . 2 . . . . . 92 LEU HD11 . 12024 1 1084 . 1 1 92 92 LEU HD21 H 1 0.8880 0.02 . 2 . . . . . 92 LEU HD21 . 12024 1 1085 . 1 1 92 92 LEU HD22 H 1 0.8880 0.02 . 2 . . . . . 92 LEU HD21 . 12024 1 1086 . 1 1 92 92 LEU HD23 H 1 0.8880 0.02 . 2 . . . . . 92 LEU HD21 . 12024 1 1087 . 1 1 92 92 LEU HG H 1 2.0030 0.02 . 1 . . . . . 92 LEU HG . 12024 1 1088 . 1 1 92 92 LEU C C 13 180.8380 0.3 . 1 . . . . . 92 LEU C . 12024 1 1089 . 1 1 92 92 LEU CA C 13 58.3610 0.3 . 1 . . . . . 92 LEU CA . 12024 1 1090 . 1 1 92 92 LEU CB C 13 41.4120 0.3 . 1 . . . . . 92 LEU CB . 12024 1 1091 . 1 1 92 92 LEU CD1 C 13 22.6690 0.3 . 2 . . . . . 92 LEU CD1 . 12024 1 1092 . 1 1 92 92 LEU CD2 C 13 26.0460 0.3 . 2 . . . . . 92 LEU CD2 . 12024 1 1093 . 1 1 92 92 LEU CG C 13 26.0460 0.3 . 1 . . . . . 92 LEU CG . 12024 1 1094 . 1 1 92 92 LEU N N 15 117.7950 0.2 . 1 . . . . . 92 LEU N . 12024 1 1095 . 1 1 93 93 ILE H H 1 7.8760 0.02 . 1 . . . . . 93 ILE H . 12024 1 1096 . 1 1 93 93 ILE HA H 1 4.0150 0.02 . 1 . . . . . 93 ILE HA . 12024 1 1097 . 1 1 93 93 ILE HB H 1 1.8140 0.02 . 1 . . . . . 93 ILE HB . 12024 1 1098 . 1 1 93 93 ILE HD11 H 1 0.9440 0.02 . 1 . . . . . 93 ILE HD11 . 12024 1 1099 . 1 1 93 93 ILE HD12 H 1 0.9440 0.02 . 1 . . . . . 93 ILE HD11 . 12024 1 1100 . 1 1 93 93 ILE HD13 H 1 0.9440 0.02 . 1 . . . . . 93 ILE HD11 . 12024 1 1101 . 1 1 93 93 ILE HG12 H 1 1.4670 0.02 . 2 . . . . . 93 ILE HG12 . 12024 1 1102 . 1 1 93 93 ILE HG13 H 1 1.2210 0.02 . 2 . . . . . 93 ILE HG13 . 12024 1 1103 . 1 1 93 93 ILE HG21 H 1 1.1230 0.02 . 1 . . . . . 93 ILE HG21 . 12024 1 1104 . 1 1 93 93 ILE HG22 H 1 1.1230 0.02 . 1 . . . . . 93 ILE HG21 . 12024 1 1105 . 1 1 93 93 ILE HG23 H 1 1.1230 0.02 . 1 . . . . . 93 ILE HG21 . 12024 1 1106 . 1 1 93 93 ILE C C 13 176.9090 0.3 . 1 . . . . . 93 ILE C . 12024 1 1107 . 1 1 93 93 ILE CA C 13 65.3000 0.3 . 1 . . . . . 93 ILE CA . 12024 1 1108 . 1 1 93 93 ILE CB C 13 37.3130 0.3 . 1 . . . . . 93 ILE CB . 12024 1 1109 . 1 1 93 93 ILE CD1 C 13 15.6300 0.3 . 1 . . . . . 93 ILE CD1 . 12024 1 1110 . 1 1 93 93 ILE CG1 C 13 30.9230 0.3 . 1 . . . . . 93 ILE CG1 . 12024 1 1111 . 1 1 93 93 ILE CG2 C 13 16.3500 0.3 . 1 . . . . . 93 ILE CG2 . 12024 1 1112 . 1 1 93 93 ILE N N 15 119.2960 0.2 . 1 . . . . . 93 ILE N . 12024 1 1113 . 1 1 94 94 CYS H H 1 8.1070 0.02 . 1 . . . . . 94 CYS H . 12024 1 1114 . 1 1 94 94 CYS HA H 1 3.8250 0.02 . 1 . . . . . 94 CYS HA . 12024 1 1115 . 1 1 94 94 CYS HB2 H 1 2.4460 0.02 . 2 . . . . . 94 CYS HB2 . 12024 1 1116 . 1 1 94 94 CYS HB3 H 1 2.8690 0.02 . 2 . . . . . 94 CYS HB3 . 12024 1 1117 . 1 1 94 94 CYS C C 13 177.0540 0.3 . 1 . . . . . 94 CYS C . 12024 1 1118 . 1 1 94 94 CYS CA C 13 64.6660 0.3 . 1 . . . . . 94 CYS CA . 12024 1 1119 . 1 1 94 94 CYS CB C 13 26.2580 0.3 . 1 . . . . . 94 CYS CB . 12024 1 1120 . 1 1 94 94 CYS N N 15 122.2300 0.2 . 1 . . . . . 94 CYS N . 12024 1 1121 . 1 1 95 95 ASN H H 1 8.4470 0.02 . 1 . . . . . 95 ASN H . 12024 1 1122 . 1 1 95 95 ASN HA H 1 4.4160 0.02 . 1 . . . . . 95 ASN HA . 12024 1 1123 . 1 1 95 95 ASN HB2 H 1 2.5840 0.02 . 2 . . . . . 95 ASN HB2 . 12024 1 1124 . 1 1 95 95 ASN HB3 H 1 2.8650 0.02 . 2 . . . . . 95 ASN HB3 . 12024 1 1125 . 1 1 95 95 ASN HD21 H 1 7.6530 0.02 . 2 . . . . . 95 ASN HD21 . 12024 1 1126 . 1 1 95 95 ASN HD22 H 1 6.7130 0.02 . 2 . . . . . 95 ASN HD22 . 12024 1 1127 . 1 1 95 95 ASN C C 13 177.1260 0.3 . 1 . . . . . 95 ASN C . 12024 1 1128 . 1 1 95 95 ASN CA C 13 54.9410 0.3 . 1 . . . . . 95 ASN CA . 12024 1 1129 . 1 1 95 95 ASN CB C 13 36.7590 0.3 . 1 . . . . . 95 ASN CB . 12024 1 1130 . 1 1 95 95 ASN N N 15 118.4890 0.2 . 1 . . . . . 95 ASN N . 12024 1 1131 . 1 1 95 95 ASN ND2 N 15 110.2290 0.2 . 1 . . . . . 95 ASN ND2 . 12024 1 1132 . 1 1 96 96 HIS H H 1 7.4990 0.02 . 1 . . . . . 96 HIS H . 12024 1 1133 . 1 1 96 96 HIS HA H 1 4.3540 0.02 . 1 . . . . . 96 HIS HA . 12024 1 1134 . 1 1 96 96 HIS HB2 H 1 3.3140 0.02 . 2 . . . . . 96 HIS HB2 . 12024 1 1135 . 1 1 96 96 HIS HB3 H 1 3.0980 0.02 . 2 . . . . . 96 HIS HB3 . 12024 1 1136 . 1 1 96 96 HIS C C 13 179.6220 0.3 . 1 . . . . . 96 HIS C . 12024 1 1137 . 1 1 96 96 HIS CA C 13 60.0640 0.3 . 1 . . . . . 96 HIS CA . 12024 1 1138 . 1 1 96 96 HIS CB C 13 31.7060 0.3 . 1 . . . . . 96 HIS CB . 12024 1 1139 . 1 1 96 96 HIS N N 15 121.3190 0.2 . 1 . . . . . 96 HIS N . 12024 1 1140 . 1 1 97 97 ILE H H 1 8.2080 0.02 . 1 . . . . . 97 ILE H . 12024 1 1141 . 1 1 97 97 ILE HA H 1 3.7380 0.02 . 1 . . . . . 97 ILE HA . 12024 1 1142 . 1 1 97 97 ILE HB H 1 1.8690 0.02 . 1 . . . . . 97 ILE HB . 12024 1 1143 . 1 1 97 97 ILE HD11 H 1 0.7530 0.02 . 1 . . . . . 97 ILE HD11 . 12024 1 1144 . 1 1 97 97 ILE HD12 H 1 0.7530 0.02 . 1 . . . . . 97 ILE HD11 . 12024 1 1145 . 1 1 97 97 ILE HD13 H 1 0.7530 0.02 . 1 . . . . . 97 ILE HD11 . 12024 1 1146 . 1 1 97 97 ILE HG12 H 1 1.8000 0.02 . 2 . . . . . 97 ILE HG12 . 12024 1 1147 . 1 1 97 97 ILE HG13 H 1 1.0900 0.02 . 2 . . . . . 97 ILE HG13 . 12024 1 1148 . 1 1 97 97 ILE HG21 H 1 0.9420 0.02 . 1 . . . . . 97 ILE HG21 . 12024 1 1149 . 1 1 97 97 ILE HG22 H 1 0.9420 0.02 . 1 . . . . . 97 ILE HG21 . 12024 1 1150 . 1 1 97 97 ILE HG23 H 1 0.9420 0.02 . 1 . . . . . 97 ILE HG21 . 12024 1 1151 . 1 1 97 97 ILE C C 13 177.8860 0.3 . 1 . . . . . 97 ILE C . 12024 1 1152 . 1 1 97 97 ILE CA C 13 64.6420 0.3 . 1 . . . . . 97 ILE CA . 12024 1 1153 . 1 1 97 97 ILE CB C 13 38.3430 0.3 . 1 . . . . . 97 ILE CB . 12024 1 1154 . 1 1 97 97 ILE CD1 C 13 15.2590 0.3 . 1 . . . . . 97 ILE CD1 . 12024 1 1155 . 1 1 97 97 ILE CG1 C 13 30.0790 0.3 . 1 . . . . . 97 ILE CG1 . 12024 1 1156 . 1 1 97 97 ILE CG2 C 13 17.0410 0.3 . 1 . . . . . 97 ILE CG2 . 12024 1 1157 . 1 1 97 97 ILE N N 15 120.7090 0.2 . 1 . . . . . 97 ILE N . 12024 1 1158 . 1 1 98 98 ASN H H 1 8.3320 0.02 . 1 . . . . . 98 ASN H . 12024 1 1159 . 1 1 98 98 ASN HA H 1 4.6390 0.02 . 1 . . . . . 98 ASN HA . 12024 1 1160 . 1 1 98 98 ASN HB2 H 1 2.9460 0.02 . 2 . . . . . 98 ASN HB2 . 12024 1 1161 . 1 1 98 98 ASN HB3 H 1 2.9460 0.02 . 2 . . . . . 98 ASN HB3 . 12024 1 1162 . 1 1 98 98 ASN HD21 H 1 7.3670 0.02 . 2 . . . . . 98 ASN HD21 . 12024 1 1163 . 1 1 98 98 ASN HD22 H 1 6.4630 0.02 . 2 . . . . . 98 ASN HD22 . 12024 1 1164 . 1 1 98 98 ASN C C 13 176.0620 0.3 . 1 . . . . . 98 ASN C . 12024 1 1165 . 1 1 98 98 ASN CA C 13 53.3610 0.3 . 1 . . . . . 98 ASN CA . 12024 1 1166 . 1 1 98 98 ASN CB C 13 38.3110 0.3 . 1 . . . . . 98 ASN CB . 12024 1 1167 . 1 1 98 98 ASN N N 15 115.6360 0.2 . 1 . . . . . 98 ASN N . 12024 1 1168 . 1 1 98 98 ASN ND2 N 15 109.6080 0.2 . 1 . . . . . 98 ASN ND2 . 12024 1 1169 . 1 1 99 99 GLY H H 1 7.6370 0.02 . 1 . . . . . 99 GLY H . 12024 1 1170 . 1 1 99 99 GLY HA2 H 1 3.8620 0.02 . 2 . . . . . 99 GLY HA2 . 12024 1 1171 . 1 1 99 99 GLY HA3 H 1 4.1700 0.02 . 2 . . . . . 99 GLY HA3 . 12024 1 1172 . 1 1 99 99 GLY C C 13 175.0430 0.3 . 1 . . . . . 99 GLY C . 12024 1 1173 . 1 1 99 99 GLY CA C 13 46.0150 0.3 . 1 . . . . . 99 GLY CA . 12024 1 1174 . 1 1 99 99 GLY N N 15 107.7840 0.2 . 1 . . . . . 99 GLY N . 12024 1 1175 . 1 1 100 100 THR H H 1 8.4470 0.02 . 1 . . . . . 100 THR H . 12024 1 1176 . 1 1 100 100 THR HA H 1 4.3610 0.02 . 1 . . . . . 100 THR HA . 12024 1 1177 . 1 1 100 100 THR HB H 1 4.3190 0.02 . 1 . . . . . 100 THR HB . 12024 1 1178 . 1 1 100 100 THR HG21 H 1 1.0850 0.02 . 1 . . . . . 100 THR HG21 . 12024 1 1179 . 1 1 100 100 THR HG22 H 1 1.0850 0.02 . 1 . . . . . 100 THR HG21 . 12024 1 1180 . 1 1 100 100 THR HG23 H 1 1.0850 0.02 . 1 . . . . . 100 THR HG21 . 12024 1 1181 . 1 1 100 100 THR C C 13 174.9050 0.3 . 1 . . . . . 100 THR C . 12024 1 1182 . 1 1 100 100 THR CA C 13 61.8470 0.3 . 1 . . . . . 100 THR CA . 12024 1 1183 . 1 1 100 100 THR CB C 13 68.9430 0.3 . 1 . . . . . 100 THR CB . 12024 1 1184 . 1 1 100 100 THR CG2 C 13 21.6640 0.3 . 1 . . . . . 100 THR CG2 . 12024 1 1185 . 1 1 100 100 THR N N 15 112.0540 0.2 . 1 . . . . . 100 THR N . 12024 1 1186 . 1 1 101 101 GLY H H 1 7.5340 0.02 . 1 . . . . . 101 GLY H . 12024 1 1187 . 1 1 101 101 GLY HA2 H 1 3.6310 0.02 . 2 . . . . . 101 GLY HA2 . 12024 1 1188 . 1 1 101 101 GLY HA3 H 1 4.0770 0.02 . 2 . . . . . 101 GLY HA3 . 12024 1 1189 . 1 1 101 101 GLY C C 13 171.9830 0.3 . 1 . . . . . 101 GLY C . 12024 1 1190 . 1 1 101 101 GLY CA C 13 45.9920 0.3 . 1 . . . . . 101 GLY CA . 12024 1 1191 . 1 1 101 101 GLY N N 15 110.8170 0.2 . 1 . . . . . 101 GLY N . 12024 1 1192 . 1 1 102 102 GLN H H 1 8.5210 0.02 . 1 . . . . . 102 GLN H . 12024 1 1193 . 1 1 102 102 GLN HA H 1 4.7540 0.02 . 1 . . . . . 102 GLN HA . 12024 1 1194 . 1 1 102 102 GLN HB2 H 1 2.0000 0.02 . 2 . . . . . 102 GLN HB2 . 12024 1 1195 . 1 1 102 102 GLN HB3 H 1 2.0000 0.02 . 2 . . . . . 102 GLN HB3 . 12024 1 1196 . 1 1 102 102 GLN HE21 H 1 7.6180 0.02 . 2 . . . . . 102 GLN HE21 . 12024 1 1197 . 1 1 102 102 GLN HE22 H 1 6.8470 0.02 . 2 . . . . . 102 GLN HE22 . 12024 1 1198 . 1 1 102 102 GLN HG2 H 1 2.4530 0.02 . 2 . . . . . 102 GLN HG2 . 12024 1 1199 . 1 1 102 102 GLN HG3 H 1 2.3940 0.02 . 2 . . . . . 102 GLN HG3 . 12024 1 1200 . 1 1 102 102 GLN C C 13 177.1850 0.3 . 1 . . . . . 102 GLN C . 12024 1 1201 . 1 1 102 102 GLN CA C 13 55.6550 0.3 . 1 . . . . . 102 GLN CA . 12024 1 1202 . 1 1 102 102 GLN CB C 13 30.4540 0.3 . 1 . . . . . 102 GLN CB . 12024 1 1203 . 1 1 102 102 GLN CG C 13 33.8310 0.3 . 1 . . . . . 102 GLN CG . 12024 1 1204 . 1 1 102 102 GLN N N 15 124.1150 0.2 . 1 . . . . . 102 GLN N . 12024 1 1205 . 1 1 102 102 GLN NE2 N 15 112.1140 0.2 . 1 . . . . . 102 GLN NE2 . 12024 1 1206 . 1 1 103 103 LEU H H 1 11.0600 0.02 . 1 . . . . . 103 LEU H . 12024 1 1207 . 1 1 103 103 LEU HA H 1 4.2540 0.02 . 1 . . . . . 103 LEU HA . 12024 1 1208 . 1 1 103 103 LEU HB2 H 1 1.3040 0.02 . 2 . . . . . 103 LEU HB2 . 12024 1 1209 . 1 1 103 103 LEU HB3 H 1 1.1960 0.02 . 2 . . . . . 103 LEU HB3 . 12024 1 1210 . 1 1 103 103 LEU HD11 H 1 0.7510 0.02 . 2 . . . . . 103 LEU HD11 . 12024 1 1211 . 1 1 103 103 LEU HD12 H 1 0.7510 0.02 . 2 . . . . . 103 LEU HD11 . 12024 1 1212 . 1 1 103 103 LEU HD13 H 1 0.7510 0.02 . 2 . . . . . 103 LEU HD11 . 12024 1 1213 . 1 1 103 103 LEU HD21 H 1 0.2170 0.02 . 2 . . . . . 103 LEU HD21 . 12024 1 1214 . 1 1 103 103 LEU HD22 H 1 0.2170 0.02 . 2 . . . . . 103 LEU HD21 . 12024 1 1215 . 1 1 103 103 LEU HD23 H 1 0.2170 0.02 . 2 . . . . . 103 LEU HD21 . 12024 1 1216 . 1 1 103 103 LEU HG H 1 1.6580 0.02 . 1 . . . . . 103 LEU HG . 12024 1 1217 . 1 1 103 103 LEU C C 13 177.1680 0.3 . 1 . . . . . 103 LEU C . 12024 1 1218 . 1 1 103 103 LEU CA C 13 54.9430 0.3 . 1 . . . . . 103 LEU CA . 12024 1 1219 . 1 1 103 103 LEU CB C 13 41.4720 0.3 . 1 . . . . . 103 LEU CB . 12024 1 1220 . 1 1 103 103 LEU CD1 C 13 23.9700 0.3 . 2 . . . . . 103 LEU CD1 . 12024 1 1221 . 1 1 103 103 LEU CD2 C 13 25.8200 0.3 . 2 . . . . . 103 LEU CD2 . 12024 1 1222 . 1 1 103 103 LEU CG C 13 26.5340 0.3 . 1 . . . . . 103 LEU CG . 12024 1 1223 . 1 1 103 103 LEU N N 15 131.2720 0.2 . 1 . . . . . 103 LEU N . 12024 1 1224 . 1 1 104 104 SER H H 1 8.5680 0.02 . 1 . . . . . 104 SER H . 12024 1 1225 . 1 1 104 104 SER HA H 1 4.0220 0.02 . 1 . . . . . 104 SER HA . 12024 1 1226 . 1 1 104 104 SER HB2 H 1 3.4150 0.02 . 2 . . . . . 104 SER HB2 . 12024 1 1227 . 1 1 104 104 SER HB3 H 1 3.6690 0.02 . 2 . . . . . 104 SER HB3 . 12024 1 1228 . 1 1 104 104 SER C C 13 174.4460 0.3 . 1 . . . . . 104 SER C . 12024 1 1229 . 1 1 104 104 SER CA C 13 57.6990 0.3 . 1 . . . . . 104 SER CA . 12024 1 1230 . 1 1 104 104 SER CB C 13 62.8050 0.3 . 1 . . . . . 104 SER CB . 12024 1 1231 . 1 1 104 104 SER N N 15 117.6030 0.2 . 1 . . . . . 104 SER N . 12024 1 1232 . 1 1 105 105 ASP H H 1 6.7030 0.02 . 1 . . . . . 105 ASP H . 12024 1 1233 . 1 1 105 105 ASP HA H 1 4.2730 0.02 . 1 . . . . . 105 ASP HA . 12024 1 1234 . 1 1 105 105 ASP HB2 H 1 2.6260 0.02 . 2 . . . . . 105 ASP HB2 . 12024 1 1235 . 1 1 105 105 ASP HB3 H 1 2.7200 0.02 . 2 . . . . . 105 ASP HB3 . 12024 1 1236 . 1 1 105 105 ASP C C 13 177.5080 0.3 . 1 . . . . . 105 ASP C . 12024 1 1237 . 1 1 105 105 ASP CA C 13 57.4120 0.3 . 1 . . . . . 105 ASP CA . 12024 1 1238 . 1 1 105 105 ASP CB C 13 41.6810 0.3 . 1 . . . . . 105 ASP CB . 12024 1 1239 . 1 1 105 105 ASP N N 15 120.0900 0.2 . 1 . . . . . 105 ASP N . 12024 1 1240 . 1 1 106 106 ALA H H 1 8.1430 0.02 . 1 . . . . . 106 ALA H . 12024 1 1241 . 1 1 106 106 ALA HA H 1 3.9540 0.02 . 1 . . . . . 106 ALA HA . 12024 1 1242 . 1 1 106 106 ALA HB1 H 1 1.3760 0.02 . 1 . . . . . 106 ALA HB1 . 12024 1 1243 . 1 1 106 106 ALA HB2 H 1 1.3760 0.02 . 1 . . . . . 106 ALA HB1 . 12024 1 1244 . 1 1 106 106 ALA HB3 H 1 1.3760 0.02 . 1 . . . . . 106 ALA HB1 . 12024 1 1245 . 1 1 106 106 ALA C C 13 176.9610 0.3 . 1 . . . . . 106 ALA C . 12024 1 1246 . 1 1 106 106 ALA CA C 13 53.2940 0.3 . 1 . . . . . 106 ALA CA . 12024 1 1247 . 1 1 106 106 ALA CB C 13 19.4580 0.3 . 1 . . . . . 106 ALA CB . 12024 1 1248 . 1 1 106 106 ALA N N 15 116.3940 0.2 . 1 . . . . . 106 ALA N . 12024 1 1249 . 1 1 107 107 SER H H 1 7.7190 0.02 . 1 . . . . . 107 SER H . 12024 1 1250 . 1 1 107 107 SER HA H 1 4.6850 0.02 . 1 . . . . . 107 SER HA . 12024 1 1251 . 1 1 107 107 SER HB2 H 1 3.9540 0.02 . 2 . . . . . 107 SER HB2 . 12024 1 1252 . 1 1 107 107 SER HB3 H 1 3.8070 0.02 . 2 . . . . . 107 SER HB3 . 12024 1 1253 . 1 1 107 107 SER C C 13 174.5000 0.3 . 1 . . . . . 107 SER C . 12024 1 1254 . 1 1 107 107 SER CA C 13 59.6280 0.3 . 1 . . . . . 107 SER CA . 12024 1 1255 . 1 1 107 107 SER CB C 13 64.9590 0.3 . 1 . . . . . 107 SER CB . 12024 1 1256 . 1 1 107 107 SER N N 15 113.4420 0.2 . 1 . . . . . 107 SER N . 12024 1 1257 . 1 1 108 108 LEU H H 1 6.7740 0.02 . 1 . . . . . 108 LEU H . 12024 1 1258 . 1 1 108 108 LEU HA H 1 3.2690 0.02 . 1 . . . . . 108 LEU HA . 12024 1 1259 . 1 1 108 108 LEU HB2 H 1 1.2350 0.02 . 2 . . . . . 108 LEU HB2 . 12024 1 1260 . 1 1 108 108 LEU HB3 H 1 1.2350 0.02 . 2 . . . . . 108 LEU HB3 . 12024 1 1261 . 1 1 108 108 LEU HD11 H 1 0.1910 0.02 . 2 . . . . . 108 LEU HD11 . 12024 1 1262 . 1 1 108 108 LEU HD12 H 1 0.1910 0.02 . 2 . . . . . 108 LEU HD11 . 12024 1 1263 . 1 1 108 108 LEU HD13 H 1 0.1910 0.02 . 2 . . . . . 108 LEU HD11 . 12024 1 1264 . 1 1 108 108 LEU HD21 H 1 0.2020 0.02 . 2 . . . . . 108 LEU HD21 . 12024 1 1265 . 1 1 108 108 LEU HD22 H 1 0.2020 0.02 . 2 . . . . . 108 LEU HD21 . 12024 1 1266 . 1 1 108 108 LEU HD23 H 1 0.2020 0.02 . 2 . . . . . 108 LEU HD21 . 12024 1 1267 . 1 1 108 108 LEU HG H 1 0.7550 0.02 . 1 . . . . . 108 LEU HG . 12024 1 1268 . 1 1 108 108 LEU C C 13 178.0440 0.3 . 1 . . . . . 108 LEU C . 12024 1 1269 . 1 1 108 108 LEU CA C 13 58.2170 0.3 . 1 . . . . . 108 LEU CA . 12024 1 1270 . 1 1 108 108 LEU CB C 13 39.3660 0.3 . 1 . . . . . 108 LEU CB . 12024 1 1271 . 1 1 108 108 LEU CD1 C 13 23.3260 0.3 . 2 . . . . . 108 LEU CD1 . 12024 1 1272 . 1 1 108 108 LEU CD2 C 13 23.0250 0.3 . 2 . . . . . 108 LEU CD2 . 12024 1 1273 . 1 1 108 108 LEU CG C 13 25.7650 0.3 . 1 . . . . . 108 LEU CG . 12024 1 1274 . 1 1 108 108 LEU N N 15 122.7980 0.2 . 1 . . . . . 108 LEU N . 12024 1 1275 . 1 1 109 109 PHE H H 1 8.7560 0.02 . 1 . . . . . 109 PHE H . 12024 1 1276 . 1 1 109 109 PHE HA H 1 4.2730 0.02 . 1 . . . . . 109 PHE HA . 12024 1 1277 . 1 1 109 109 PHE HB2 H 1 2.8390 0.02 . 2 . . . . . 109 PHE HB2 . 12024 1 1278 . 1 1 109 109 PHE HB3 H 1 2.8390 0.02 . 2 . . . . . 109 PHE HB3 . 12024 1 1279 . 1 1 109 109 PHE HD1 H 1 7.0300 0.02 . 3 . . . . . 109 PHE HD1 . 12024 1 1280 . 1 1 109 109 PHE HD2 H 1 7.0300 0.02 . 3 . . . . . 109 PHE HD2 . 12024 1 1281 . 1 1 109 109 PHE HE1 H 1 6.5650 0.02 . 3 . . . . . 109 PHE HE1 . 12024 1 1282 . 1 1 109 109 PHE HE2 H 1 6.5650 0.02 . 3 . . . . . 109 PHE HE2 . 12024 1 1283 . 1 1 109 109 PHE HZ H 1 7.0270 0.02 . 1 . . . . . 109 PHE HZ . 12024 1 1284 . 1 1 109 109 PHE C C 13 176.7020 0.3 . 1 . . . . . 109 PHE C . 12024 1 1285 . 1 1 109 109 PHE CA C 13 60.0200 0.3 . 1 . . . . . 109 PHE CA . 12024 1 1286 . 1 1 109 109 PHE CB C 13 38.9050 0.3 . 1 . . . . . 109 PHE CB . 12024 1 1287 . 1 1 109 109 PHE CD1 C 13 131.2560 0.3 . 3 . . . . . 109 PHE CD1 . 12024 1 1288 . 1 1 109 109 PHE CD2 C 13 131.2560 0.3 . 3 . . . . . 109 PHE CD2 . 12024 1 1289 . 1 1 109 109 PHE CE1 C 13 130.5120 0.3 . 3 . . . . . 109 PHE CE1 . 12024 1 1290 . 1 1 109 109 PHE CE2 C 13 130.5120 0.3 . 3 . . . . . 109 PHE CE2 . 12024 1 1291 . 1 1 109 109 PHE CZ C 13 130.7000 0.3 . 1 . . . . . 109 PHE CZ . 12024 1 1292 . 1 1 109 109 PHE N N 15 116.2660 0.2 . 1 . . . . . 109 PHE N . 12024 1 1293 . 1 1 110 110 ALA H H 1 7.4240 0.02 . 1 . . . . . 110 ALA H . 12024 1 1294 . 1 1 110 110 ALA HA H 1 3.7770 0.02 . 1 . . . . . 110 ALA HA . 12024 1 1295 . 1 1 110 110 ALA HB1 H 1 1.3530 0.02 . 1 . . . . . 110 ALA HB1 . 12024 1 1296 . 1 1 110 110 ALA HB2 H 1 1.3530 0.02 . 1 . . . . . 110 ALA HB1 . 12024 1 1297 . 1 1 110 110 ALA HB3 H 1 1.3530 0.02 . 1 . . . . . 110 ALA HB1 . 12024 1 1298 . 1 1 110 110 ALA C C 13 178.1060 0.3 . 1 . . . . . 110 ALA C . 12024 1 1299 . 1 1 110 110 ALA CA C 13 54.0250 0.3 . 1 . . . . . 110 ALA CA . 12024 1 1300 . 1 1 110 110 ALA CB C 13 19.2400 0.3 . 1 . . . . . 110 ALA CB . 12024 1 1301 . 1 1 110 110 ALA N N 15 117.6290 0.2 . 1 . . . . . 110 ALA N . 12024 1 1302 . 1 1 111 111 ALA H H 1 7.2990 0.02 . 1 . . . . . 111 ALA H . 12024 1 1303 . 1 1 111 111 ALA HA H 1 3.8380 0.02 . 1 . . . . . 111 ALA HA . 12024 1 1304 . 1 1 111 111 ALA HB1 H 1 1.1450 0.02 . 1 . . . . . 111 ALA HB1 . 12024 1 1305 . 1 1 111 111 ALA HB2 H 1 1.1450 0.02 . 1 . . . . . 111 ALA HB1 . 12024 1 1306 . 1 1 111 111 ALA HB3 H 1 1.1450 0.02 . 1 . . . . . 111 ALA HB1 . 12024 1 1307 . 1 1 111 111 ALA C C 13 174.6730 0.3 . 1 . . . . . 111 ALA C . 12024 1 1308 . 1 1 111 111 ALA CA C 13 52.8180 0.3 . 1 . . . . . 111 ALA CA . 12024 1 1309 . 1 1 111 111 ALA CB C 13 20.0100 0.3 . 1 . . . . . 111 ALA CB . 12024 1 1310 . 1 1 111 111 ALA N N 15 118.0110 0.2 . 1 . . . . . 111 ALA N . 12024 1 1311 . 1 1 112 112 ASP H H 1 6.9390 0.02 . 1 . . . . . 112 ASP H . 12024 1 1312 . 1 1 112 112 ASP HA H 1 4.6770 0.02 . 1 . . . . . 112 ASP HA . 12024 1 1313 . 1 1 112 112 ASP HB2 H 1 2.7840 0.02 . 2 . . . . . 112 ASP HB2 . 12024 1 1314 . 1 1 112 112 ASP HB3 H 1 3.1380 0.02 . 2 . . . . . 112 ASP HB3 . 12024 1 1315 . 1 1 112 112 ASP C C 13 176.8030 0.3 . 1 . . . . . 112 ASP C . 12024 1 1316 . 1 1 112 112 ASP CA C 13 52.7940 0.3 . 1 . . . . . 112 ASP CA . 12024 1 1317 . 1 1 112 112 ASP CB C 13 39.2950 0.3 . 1 . . . . . 112 ASP CB . 12024 1 1318 . 1 1 112 112 ASP N N 15 113.2360 0.2 . 1 . . . . . 112 ASP N . 12024 1 1319 . 1 1 113 113 ALA H H 1 8.3130 0.02 . 1 . . . . . 113 ALA H . 12024 1 1320 . 1 1 113 113 ALA HA H 1 3.7690 0.02 . 1 . . . . . 113 ALA HA . 12024 1 1321 . 1 1 113 113 ALA HB1 H 1 1.4920 0.02 . 1 . . . . . 113 ALA HB1 . 12024 1 1322 . 1 1 113 113 ALA HB2 H 1 1.4920 0.02 . 1 . . . . . 113 ALA HB1 . 12024 1 1323 . 1 1 113 113 ALA HB3 H 1 1.4920 0.02 . 1 . . . . . 113 ALA HB1 . 12024 1 1324 . 1 1 113 113 ALA C C 13 175.9200 0.3 . 1 . . . . . 113 ALA C . 12024 1 1325 . 1 1 113 113 ALA CA C 13 54.2940 0.3 . 1 . . . . . 113 ALA CA . 12024 1 1326 . 1 1 113 113 ALA CB C 13 20.8550 0.3 . 1 . . . . . 113 ALA CB . 12024 1 1327 . 1 1 113 113 ALA N N 15 131.8000 0.2 . 1 . . . . . 113 ALA N . 12024 1 1328 . 1 1 114 114 ASP H H 1 7.9820 0.02 . 1 . . . . . 114 ASP H . 12024 1 1329 . 1 1 114 114 ASP HA H 1 4.4620 0.02 . 1 . . . . . 114 ASP HA . 12024 1 1330 . 1 1 114 114 ASP HB2 H 1 2.1610 0.02 . 2 . . . . . 114 ASP HB2 . 12024 1 1331 . 1 1 114 114 ASP HB3 H 1 2.9540 0.02 . 2 . . . . . 114 ASP HB3 . 12024 1 1332 . 1 1 114 114 ASP C C 13 178.3330 0.3 . 1 . . . . . 114 ASP C . 12024 1 1333 . 1 1 114 114 ASP CA C 13 52.1450 0.3 . 1 . . . . . 114 ASP CA . 12024 1 1334 . 1 1 114 114 ASP CB C 13 39.9310 0.3 . 1 . . . . . 114 ASP CB . 12024 1 1335 . 1 1 114 114 ASP N N 15 110.9960 0.2 . 1 . . . . . 114 ASP N . 12024 1 1336 . 1 1 115 115 GLY H H 1 7.4450 0.02 . 1 . . . . . 115 GLY H . 12024 1 1337 . 1 1 115 115 GLY HA2 H 1 3.7620 0.02 . 2 . . . . . 115 GLY HA2 . 12024 1 1338 . 1 1 115 115 GLY HA3 H 1 3.7620 0.02 . 2 . . . . . 115 GLY HA3 . 12024 1 1339 . 1 1 115 115 GLY C C 13 174.2510 0.3 . 1 . . . . . 115 GLY C . 12024 1 1340 . 1 1 115 115 GLY CA C 13 47.9750 0.3 . 1 . . . . . 115 GLY CA . 12024 1 1341 . 1 1 115 115 GLY N N 15 108.5740 0.2 . 1 . . . . . 115 GLY N . 12024 1 1342 . 1 1 116 116 ASN H H 1 8.0510 0.02 . 1 . . . . . 116 ASN H . 12024 1 1343 . 1 1 116 116 ASN HA H 1 4.6710 0.02 . 1 . . . . . 116 ASN HA . 12024 1 1344 . 1 1 116 116 ASN HB2 H 1 3.2400 0.02 . 2 . . . . . 116 ASN HB2 . 12024 1 1345 . 1 1 116 116 ASN HB3 H 1 2.4900 0.02 . 2 . . . . . 116 ASN HB3 . 12024 1 1346 . 1 1 116 116 ASN HD21 H 1 7.7070 0.02 . 2 . . . . . 116 ASN HD21 . 12024 1 1347 . 1 1 116 116 ASN HD22 H 1 7.2290 0.02 . 2 . . . . . 116 ASN HD22 . 12024 1 1348 . 1 1 116 116 ASN C C 13 176.0610 0.3 . 1 . . . . . 116 ASN C . 12024 1 1349 . 1 1 116 116 ASN CA C 13 52.0650 0.3 . 1 . . . . . 116 ASN CA . 12024 1 1350 . 1 1 116 116 ASN CB C 13 37.9580 0.3 . 1 . . . . . 116 ASN CB . 12024 1 1351 . 1 1 116 116 ASN N N 15 118.6740 0.2 . 1 . . . . . 116 ASN N . 12024 1 1352 . 1 1 116 116 ASN ND2 N 15 114.8660 0.2 . 1 . . . . . 116 ASN ND2 . 12024 1 1353 . 1 1 117 117 ASN H H 1 10.9120 0.02 . 1 . . . . . 117 ASN H . 12024 1 1354 . 1 1 117 117 ASN HA H 1 3.1070 0.02 . 1 . . . . . 117 ASN HA . 12024 1 1355 . 1 1 117 117 ASN HB2 H 1 2.6530 0.02 . 2 . . . . . 117 ASN HB2 . 12024 1 1356 . 1 1 117 117 ASN HB3 H 1 2.4380 0.02 . 2 . . . . . 117 ASN HB3 . 12024 1 1357 . 1 1 117 117 ASN HD21 H 1 7.2990 0.02 . 2 . . . . . 117 ASN HD21 . 12024 1 1358 . 1 1 117 117 ASN HD22 H 1 6.7700 0.02 . 2 . . . . . 117 ASN HD22 . 12024 1 1359 . 1 1 117 117 ASN C C 13 173.2120 0.3 . 1 . . . . . 117 ASN C . 12024 1 1360 . 1 1 117 117 ASN CA C 13 55.5050 0.3 . 1 . . . . . 117 ASN CA . 12024 1 1361 . 1 1 117 117 ASN CB C 13 38.2190 0.3 . 1 . . . . . 117 ASN CB . 12024 1 1362 . 1 1 117 117 ASN N N 15 119.5940 0.2 . 1 . . . . . 117 ASN N . 12024 1 1363 . 1 1 117 117 ASN ND2 N 15 114.6900 0.2 . 1 . . . . . 117 ASN ND2 . 12024 1 1364 . 1 1 118 118 VAL H H 1 7.4480 0.02 . 1 . . . . . 118 VAL H . 12024 1 1365 . 1 1 118 118 VAL HA H 1 4.3230 0.02 . 1 . . . . . 118 VAL HA . 12024 1 1366 . 1 1 118 118 VAL HB H 1 1.8460 0.02 . 1 . . . . . 118 VAL HB . 12024 1 1367 . 1 1 118 118 VAL HG11 H 1 0.8630 0.02 . 2 . . . . . 118 VAL HG11 . 12024 1 1368 . 1 1 118 118 VAL HG12 H 1 0.8630 0.02 . 2 . . . . . 118 VAL HG11 . 12024 1 1369 . 1 1 118 118 VAL HG13 H 1 0.8630 0.02 . 2 . . . . . 118 VAL HG11 . 12024 1 1370 . 1 1 118 118 VAL HG21 H 1 0.8630 0.02 . 2 . . . . . 118 VAL HG21 . 12024 1 1371 . 1 1 118 118 VAL HG22 H 1 0.8630 0.02 . 2 . . . . . 118 VAL HG21 . 12024 1 1372 . 1 1 118 118 VAL HG23 H 1 0.8630 0.02 . 2 . . . . . 118 VAL HG21 . 12024 1 1373 . 1 1 118 118 VAL C C 13 174.8020 0.3 . 1 . . . . . 118 VAL C . 12024 1 1374 . 1 1 118 118 VAL CA C 13 61.4170 0.3 . 1 . . . . . 118 VAL CA . 12024 1 1375 . 1 1 118 118 VAL CB C 13 36.3230 0.3 . 1 . . . . . 118 VAL CB . 12024 1 1376 . 1 1 118 118 VAL CG1 C 13 21.1680 0.3 . 2 . . . . . 118 VAL CG1 . 12024 1 1377 . 1 1 118 118 VAL CG2 C 13 21.1680 0.3 . 2 . . . . . 118 VAL CG2 . 12024 1 1378 . 1 1 118 118 VAL N N 15 115.0020 0.2 . 1 . . . . . 118 VAL N . 12024 1 1379 . 1 1 119 119 ILE H H 1 9.3320 0.02 . 1 . . . . . 119 ILE H . 12024 1 1380 . 1 1 119 119 ILE HA H 1 5.3000 0.02 . 1 . . . . . 119 ILE HA . 12024 1 1381 . 1 1 119 119 ILE HB H 1 2.1850 0.02 . 1 . . . . . 119 ILE HB . 12024 1 1382 . 1 1 119 119 ILE HD11 H 1 0.5810 0.02 . 1 . . . . . 119 ILE HD11 . 12024 1 1383 . 1 1 119 119 ILE HD12 H 1 0.5810 0.02 . 1 . . . . . 119 ILE HD11 . 12024 1 1384 . 1 1 119 119 ILE HD13 H 1 0.5810 0.02 . 1 . . . . . 119 ILE HD11 . 12024 1 1385 . 1 1 119 119 ILE HG12 H 1 1.5280 0.02 . 2 . . . . . 119 ILE HG12 . 12024 1 1386 . 1 1 119 119 ILE HG13 H 1 0.8340 0.02 . 2 . . . . . 119 ILE HG13 . 12024 1 1387 . 1 1 119 119 ILE HG21 H 1 0.7710 0.02 . 1 . . . . . 119 ILE HG21 . 12024 1 1388 . 1 1 119 119 ILE HG22 H 1 0.7710 0.02 . 1 . . . . . 119 ILE HG21 . 12024 1 1389 . 1 1 119 119 ILE HG23 H 1 0.7710 0.02 . 1 . . . . . 119 ILE HG21 . 12024 1 1390 . 1 1 119 119 ILE C C 13 175.2120 0.3 . 1 . . . . . 119 ILE C . 12024 1 1391 . 1 1 119 119 ILE CA C 13 57.6150 0.3 . 1 . . . . . 119 ILE CA . 12024 1 1392 . 1 1 119 119 ILE CB C 13 34.7730 0.3 . 1 . . . . . 119 ILE CB . 12024 1 1393 . 1 1 119 119 ILE CD1 C 13 10.0900 0.3 . 1 . . . . . 119 ILE CD1 . 12024 1 1394 . 1 1 119 119 ILE CG1 C 13 26.7030 0.3 . 1 . . . . . 119 ILE CG1 . 12024 1 1395 . 1 1 119 119 ILE CG2 C 13 17.3700 0.3 . 1 . . . . . 119 ILE CG2 . 12024 1 1396 . 1 1 119 119 ILE N N 15 129.6830 0.2 . 1 . . . . . 119 ILE N . 12024 1 1397 . 1 1 120 120 ASP H H 1 10.1500 0.02 . 1 . . . . . 120 ASP H . 12024 1 1398 . 1 1 120 120 ASP HA H 1 4.7460 0.02 . 1 . . . . . 120 ASP HA . 12024 1 1399 . 1 1 120 120 ASP HB2 H 1 2.7000 0.02 . 2 . . . . . 120 ASP HB2 . 12024 1 1400 . 1 1 120 120 ASP HB3 H 1 3.3080 0.02 . 2 . . . . . 120 ASP HB3 . 12024 1 1401 . 1 1 120 120 ASP C C 13 176.6350 0.3 . 1 . . . . . 120 ASP C . 12024 1 1402 . 1 1 120 120 ASP CA C 13 52.8270 0.3 . 1 . . . . . 120 ASP CA . 12024 1 1403 . 1 1 120 120 ASP CB C 13 42.4770 0.3 . 1 . . . . . 120 ASP CB . 12024 1 1404 . 1 1 120 120 ASP N N 15 130.8910 0.2 . 1 . . . . . 120 ASP N . 12024 1 1405 . 1 1 121 121 GLN H H 1 8.2900 0.02 . 1 . . . . . 121 GLN H . 12024 1 1406 . 1 1 121 121 GLN HA H 1 4.0620 0.02 . 1 . . . . . 121 GLN HA . 12024 1 1407 . 1 1 121 121 GLN HB2 H 1 2.2660 0.02 . 2 . . . . . 121 GLN HB2 . 12024 1 1408 . 1 1 121 121 GLN HB3 H 1 2.1530 0.02 . 2 . . . . . 121 GLN HB3 . 12024 1 1409 . 1 1 121 121 GLN HE21 H 1 7.5620 0.02 . 2 . . . . . 121 GLN HE21 . 12024 1 1410 . 1 1 121 121 GLN HE22 H 1 6.9990 0.02 . 2 . . . . . 121 GLN HE22 . 12024 1 1411 . 1 1 121 121 GLN HG2 H 1 2.5760 0.02 . 2 . . . . . 121 GLN HG2 . 12024 1 1412 . 1 1 121 121 GLN HG3 H 1 2.5150 0.02 . 2 . . . . . 121 GLN HG3 . 12024 1 1413 . 1 1 121 121 GLN C C 13 177.5100 0.3 . 1 . . . . . 121 GLN C . 12024 1 1414 . 1 1 121 121 GLN CA C 13 58.8600 0.3 . 1 . . . . . 121 GLN CA . 12024 1 1415 . 1 1 121 121 GLN CB C 13 28.3150 0.3 . 1 . . . . . 121 GLN CB . 12024 1 1416 . 1 1 121 121 GLN CG C 13 32.7990 0.3 . 1 . . . . . 121 GLN CG . 12024 1 1417 . 1 1 121 121 GLN N N 15 113.8060 0.2 . 1 . . . . . 121 GLN N . 12024 1 1418 . 1 1 121 121 GLN NE2 N 15 112.2110 0.2 . 1 . . . . . 121 GLN NE2 . 12024 1 1419 . 1 1 122 122 THR H H 1 8.2350 0.02 . 1 . . . . . 122 THR H . 12024 1 1420 . 1 1 122 122 THR HA H 1 3.9220 0.02 . 1 . . . . . 122 THR HA . 12024 1 1421 . 1 1 122 122 THR HB H 1 4.2410 0.02 . 1 . . . . . 122 THR HB . 12024 1 1422 . 1 1 122 122 THR HG21 H 1 1.2160 0.02 . 1 . . . . . 122 THR HG21 . 12024 1 1423 . 1 1 122 122 THR HG22 H 1 1.2160 0.02 . 1 . . . . . 122 THR HG21 . 12024 1 1424 . 1 1 122 122 THR HG23 H 1 1.2160 0.02 . 1 . . . . . 122 THR HG21 . 12024 1 1425 . 1 1 122 122 THR C C 13 176.2660 0.3 . 1 . . . . . 122 THR C . 12024 1 1426 . 1 1 122 122 THR CA C 13 67.2170 0.3 . 1 . . . . . 122 THR CA . 12024 1 1427 . 1 1 122 122 THR CB C 13 67.7670 0.3 . 1 . . . . . 122 THR CB . 12024 1 1428 . 1 1 122 122 THR CG2 C 13 22.6000 0.3 . 1 . . . . . 122 THR CG2 . 12024 1 1429 . 1 1 122 122 THR N N 15 117.1150 0.2 . 1 . . . . . 122 THR N . 12024 1 1430 . 1 1 123 123 ASP H H 1 7.5030 0.02 . 1 . . . . . 123 ASP H . 12024 1 1431 . 1 1 123 123 ASP HA H 1 4.3820 0.02 . 1 . . . . . 123 ASP HA . 12024 1 1432 . 1 1 123 123 ASP HB2 H 1 3.0470 0.02 . 2 . . . . . 123 ASP HB2 . 12024 1 1433 . 1 1 123 123 ASP HB3 H 1 3.2480 0.02 . 2 . . . . . 123 ASP HB3 . 12024 1 1434 . 1 1 123 123 ASP C C 13 177.3850 0.3 . 1 . . . . . 123 ASP C . 12024 1 1435 . 1 1 123 123 ASP CA C 13 59.3070 0.3 . 1 . . . . . 123 ASP CA . 12024 1 1436 . 1 1 123 123 ASP CB C 13 41.8300 0.3 . 1 . . . . . 123 ASP CB . 12024 1 1437 . 1 1 123 123 ASP N N 15 119.3450 0.2 . 1 . . . . . 123 ASP N . 12024 1 1438 . 1 1 124 124 ARG H H 1 7.1290 0.02 . 1 . . . . . 124 ARG H . 12024 1 1439 . 1 1 124 124 ARG HA H 1 3.8930 0.02 . 1 . . . . . 124 ARG HA . 12024 1 1440 . 1 1 124 124 ARG HB2 H 1 1.5860 0.02 . 2 . . . . . 124 ARG HB2 . 12024 1 1441 . 1 1 124 124 ARG HB3 H 1 1.5860 0.02 . 2 . . . . . 124 ARG HB3 . 12024 1 1442 . 1 1 124 124 ARG HD2 H 1 3.0460 0.02 . 2 . . . . . 124 ARG HD2 . 12024 1 1443 . 1 1 124 124 ARG HD3 H 1 3.0460 0.02 . 2 . . . . . 124 ARG HD3 . 12024 1 1444 . 1 1 124 124 ARG HE H 1 7.4300 0.02 . 1 . . . . . 124 ARG HE . 12024 1 1445 . 1 1 124 124 ARG HG2 H 1 1.8490 0.02 . 2 . . . . . 124 ARG HG2 . 12024 1 1446 . 1 1 124 124 ARG HG3 H 1 1.8110 0.02 . 2 . . . . . 124 ARG HG3 . 12024 1 1447 . 1 1 124 124 ARG C C 13 177.4720 0.3 . 1 . . . . . 124 ARG C . 12024 1 1448 . 1 1 124 124 ARG CA C 13 60.4480 0.3 . 1 . . . . . 124 ARG CA . 12024 1 1449 . 1 1 124 124 ARG CB C 13 29.9880 0.3 . 1 . . . . . 124 ARG CB . 12024 1 1450 . 1 1 124 124 ARG CD C 13 43.7740 0.3 . 1 . . . . . 124 ARG CD . 12024 1 1451 . 1 1 124 124 ARG CG C 13 27.0900 0.3 . 1 . . . . . 124 ARG CG . 12024 1 1452 . 1 1 124 124 ARG N N 15 117.1560 0.2 . 1 . . . . . 124 ARG N . 12024 1 1453 . 1 1 124 124 ARG NE N 15 82.8800 0.2 . 1 . . . . . 124 ARG NE . 12024 1 1454 . 1 1 125 125 ILE H H 1 8.4560 0.02 . 1 . . . . . 125 ILE H . 12024 1 1455 . 1 1 125 125 ILE HA H 1 3.7930 0.02 . 1 . . . . . 125 ILE HA . 12024 1 1456 . 1 1 125 125 ILE HB H 1 1.9490 0.02 . 1 . . . . . 125 ILE HB . 12024 1 1457 . 1 1 125 125 ILE HD11 H 1 0.6860 0.02 . 1 . . . . . 125 ILE HD11 . 12024 1 1458 . 1 1 125 125 ILE HD12 H 1 0.6860 0.02 . 1 . . . . . 125 ILE HD11 . 12024 1 1459 . 1 1 125 125 ILE HD13 H 1 0.6860 0.02 . 1 . . . . . 125 ILE HD11 . 12024 1 1460 . 1 1 125 125 ILE HG12 H 1 1.2190 0.02 . 2 . . . . . 125 ILE HG12 . 12024 1 1461 . 1 1 125 125 ILE HG13 H 1 1.6530 0.02 . 2 . . . . . 125 ILE HG13 . 12024 1 1462 . 1 1 125 125 ILE HG21 H 1 0.9950 0.02 . 1 . . . . . 125 ILE HG21 . 12024 1 1463 . 1 1 125 125 ILE HG22 H 1 0.9950 0.02 . 1 . . . . . 125 ILE HG21 . 12024 1 1464 . 1 1 125 125 ILE HG23 H 1 0.9950 0.02 . 1 . . . . . 125 ILE HG21 . 12024 1 1465 . 1 1 125 125 ILE CA C 13 64.8800 0.3 . 1 . . . . . 125 ILE CA . 12024 1 1466 . 1 1 125 125 ILE CB C 13 38.3000 0.3 . 1 . . . . . 125 ILE CB . 12024 1 1467 . 1 1 125 125 ILE CD1 C 13 14.7800 0.3 . 1 . . . . . 125 ILE CD1 . 12024 1 1468 . 1 1 125 125 ILE CG1 C 13 28.2400 0.3 . 1 . . . . . 125 ILE CG1 . 12024 1 1469 . 1 1 125 125 ILE CG2 C 13 17.4300 0.3 . 1 . . . . . 125 ILE CG2 . 12024 1 1470 . 1 1 125 125 ILE N N 15 119.8020 0.2 . 1 . . . . . 125 ILE N . 12024 1 1471 . 1 1 126 126 LEU HA H 1 4.0050 0.02 . 1 . . . . . 126 LEU HA . 12024 1 1472 . 1 1 126 126 LEU HB2 H 1 2.0700 0.02 . 2 . . . . . 126 LEU HB2 . 12024 1 1473 . 1 1 126 126 LEU HB3 H 1 2.1400 0.02 . 2 . . . . . 126 LEU HB3 . 12024 1 1474 . 1 1 126 126 LEU HD11 H 1 0.8250 0.02 . 2 . . . . . 126 LEU HD11 . 12024 1 1475 . 1 1 126 126 LEU HD12 H 1 0.8250 0.02 . 2 . . . . . 126 LEU HD11 . 12024 1 1476 . 1 1 126 126 LEU HD13 H 1 0.8250 0.02 . 2 . . . . . 126 LEU HD11 . 12024 1 1477 . 1 1 126 126 LEU HD21 H 1 0.8300 0.02 . 2 . . . . . 126 LEU HD21 . 12024 1 1478 . 1 1 126 126 LEU HD22 H 1 0.8300 0.02 . 2 . . . . . 126 LEU HD21 . 12024 1 1479 . 1 1 126 126 LEU HD23 H 1 0.8300 0.02 . 2 . . . . . 126 LEU HD21 . 12024 1 1480 . 1 1 126 126 LEU HG H 1 1.7800 0.02 . 1 . . . . . 126 LEU HG . 12024 1 1481 . 1 1 126 126 LEU C C 13 179.1140 0.3 . 1 . . . . . 126 LEU C . 12024 1 1482 . 1 1 126 126 LEU CA C 13 58.4110 0.3 . 1 . . . . . 126 LEU CA . 12024 1 1483 . 1 1 126 126 LEU CB C 13 42.3700 0.3 . 1 . . . . . 126 LEU CB . 12024 1 1484 . 1 1 126 126 LEU CD1 C 13 22.3500 0.3 . 2 . . . . . 126 LEU CD1 . 12024 1 1485 . 1 1 126 126 LEU CD2 C 13 25.5000 0.3 . 2 . . . . . 126 LEU CD2 . 12024 1 1486 . 1 1 126 126 LEU CG C 13 25.9000 0.3 . 1 . . . . . 126 LEU CG . 12024 1 1487 . 1 1 127 127 ILE H H 1 8.1820 0.02 . 1 . . . . . 127 ILE H . 12024 1 1488 . 1 1 127 127 ILE HA H 1 3.7950 0.02 . 1 . . . . . 127 ILE HA . 12024 1 1489 . 1 1 127 127 ILE HB H 1 2.1930 0.02 . 1 . . . . . 127 ILE HB . 12024 1 1490 . 1 1 127 127 ILE HD11 H 1 1.0050 0.02 . 1 . . . . . 127 ILE HD11 . 12024 1 1491 . 1 1 127 127 ILE HD12 H 1 1.0050 0.02 . 1 . . . . . 127 ILE HD11 . 12024 1 1492 . 1 1 127 127 ILE HD13 H 1 1.0050 0.02 . 1 . . . . . 127 ILE HD11 . 12024 1 1493 . 1 1 127 127 ILE HG12 H 1 1.2210 0.02 . 2 . . . . . 127 ILE HG12 . 12024 1 1494 . 1 1 127 127 ILE HG13 H 1 1.2210 0.02 . 2 . . . . . 127 ILE HG13 . 12024 1 1495 . 1 1 127 127 ILE HG21 H 1 1.0690 0.02 . 1 . . . . . 127 ILE HG21 . 12024 1 1496 . 1 1 127 127 ILE HG22 H 1 1.0690 0.02 . 1 . . . . . 127 ILE HG21 . 12024 1 1497 . 1 1 127 127 ILE HG23 H 1 1.0690 0.02 . 1 . . . . . 127 ILE HG21 . 12024 1 1498 . 1 1 127 127 ILE C C 13 177.6120 0.3 . 1 . . . . . 127 ILE C . 12024 1 1499 . 1 1 127 127 ILE CA C 13 66.1420 0.3 . 1 . . . . . 127 ILE CA . 12024 1 1500 . 1 1 127 127 ILE CB C 13 37.2110 0.3 . 1 . . . . . 127 ILE CB . 12024 1 1501 . 1 1 127 127 ILE CD1 C 13 13.1000 0.3 . 1 . . . . . 127 ILE CD1 . 12024 1 1502 . 1 1 127 127 ILE CG1 C 13 30.2670 0.3 . 1 . . . . . 127 ILE CG1 . 12024 1 1503 . 1 1 127 127 ILE CG2 C 13 17.2290 0.3 . 1 . . . . . 127 ILE CG2 . 12024 1 1504 . 1 1 127 127 ILE N N 15 118.7270 0.2 . 1 . . . . . 127 ILE N . 12024 1 1505 . 1 1 128 128 GLU H H 1 8.5280 0.02 . 1 . . . . . 128 GLU H . 12024 1 1506 . 1 1 128 128 GLU HA H 1 3.6440 0.02 . 1 . . . . . 128 GLU HA . 12024 1 1507 . 1 1 128 128 GLU HB2 H 1 2.2030 0.02 . 2 . . . . . 128 GLU HB2 . 12024 1 1508 . 1 1 128 128 GLU HB3 H 1 2.2030 0.02 . 2 . . . . . 128 GLU HB3 . 12024 1 1509 . 1 1 128 128 GLU HG2 H 1 2.0240 0.02 . 2 . . . . . 128 GLU HG2 . 12024 1 1510 . 1 1 128 128 GLU HG3 H 1 2.0240 0.02 . 2 . . . . . 128 GLU HG3 . 12024 1 1511 . 1 1 128 128 GLU C C 13 179.8320 0.3 . 1 . . . . . 128 GLU C . 12024 1 1512 . 1 1 128 128 GLU CA C 13 59.8090 0.3 . 1 . . . . . 128 GLU CA . 12024 1 1513 . 1 1 128 128 GLU CB C 13 29.2300 0.3 . 1 . . . . . 128 GLU CB . 12024 1 1514 . 1 1 128 128 GLU CG C 13 34.5810 0.3 . 1 . . . . . 128 GLU CG . 12024 1 1515 . 1 1 128 128 GLU N N 15 121.1970 0.2 . 1 . . . . . 128 GLU N . 12024 1 1516 . 1 1 129 129 LYS H H 1 8.6940 0.02 . 1 . . . . . 129 LYS H . 12024 1 1517 . 1 1 129 129 LYS HA H 1 3.8330 0.02 . 1 . . . . . 129 LYS HA . 12024 1 1518 . 1 1 129 129 LYS HB2 H 1 2.0300 0.02 . 2 . . . . . 129 LYS HB2 . 12024 1 1519 . 1 1 129 129 LYS HB3 H 1 1.5900 0.02 . 2 . . . . . 129 LYS HB3 . 12024 1 1520 . 1 1 129 129 LYS HD2 H 1 1.5650 0.02 . 2 . . . . . 129 LYS HD2 . 12024 1 1521 . 1 1 129 129 LYS HD3 H 1 1.5650 0.02 . 2 . . . . . 129 LYS HD3 . 12024 1 1522 . 1 1 129 129 LYS HE2 H 1 2.8620 0.02 . 2 . . . . . 129 LYS HE2 . 12024 1 1523 . 1 1 129 129 LYS HE3 H 1 2.8620 0.02 . 2 . . . . . 129 LYS HE3 . 12024 1 1524 . 1 1 129 129 LYS HG2 H 1 1.0160 0.02 . 2 . . . . . 129 LYS HG2 . 12024 1 1525 . 1 1 129 129 LYS HG3 H 1 0.4150 0.02 . 2 . . . . . 129 LYS HG3 . 12024 1 1526 . 1 1 129 129 LYS C C 13 177.9990 0.3 . 1 . . . . . 129 LYS C . 12024 1 1527 . 1 1 129 129 LYS CA C 13 59.9830 0.3 . 1 . . . . . 129 LYS CA . 12024 1 1528 . 1 1 129 129 LYS CB C 13 32.8860 0.3 . 1 . . . . . 129 LYS CB . 12024 1 1529 . 1 1 129 129 LYS CD C 13 29.8000 0.3 . 1 . . . . . 129 LYS CD . 12024 1 1530 . 1 1 129 129 LYS CE C 13 42.2600 0.3 . 1 . . . . . 129 LYS CE . 12024 1 1531 . 1 1 129 129 LYS CG C 13 24.8400 0.3 . 1 . . . . . 129 LYS CG . 12024 1 1532 . 1 1 129 129 LYS N N 15 119.5010 0.2 . 1 . . . . . 129 LYS N . 12024 1 1533 . 1 1 130 130 TYR H H 1 8.3700 0.02 . 1 . . . . . 130 TYR H . 12024 1 1534 . 1 1 130 130 TYR HA H 1 4.4810 0.02 . 1 . . . . . 130 TYR HA . 12024 1 1535 . 1 1 130 130 TYR HB2 H 1 3.0920 0.02 . 2 . . . . . 130 TYR HB2 . 12024 1 1536 . 1 1 130 130 TYR HB3 H 1 3.1930 0.02 . 2 . . . . . 130 TYR HB3 . 12024 1 1537 . 1 1 130 130 TYR HD1 H 1 6.8870 0.02 . 3 . . . . . 130 TYR HD1 . 12024 1 1538 . 1 1 130 130 TYR HD2 H 1 6.8870 0.02 . 3 . . . . . 130 TYR HD2 . 12024 1 1539 . 1 1 130 130 TYR HE1 H 1 6.8240 0.02 . 3 . . . . . 130 TYR HE1 . 12024 1 1540 . 1 1 130 130 TYR HE2 H 1 6.8240 0.02 . 3 . . . . . 130 TYR HE2 . 12024 1 1541 . 1 1 130 130 TYR C C 13 179.2880 0.3 . 1 . . . . . 130 TYR C . 12024 1 1542 . 1 1 130 130 TYR CA C 13 60.2760 0.3 . 1 . . . . . 130 TYR CA . 12024 1 1543 . 1 1 130 130 TYR CB C 13 39.3640 0.3 . 1 . . . . . 130 TYR CB . 12024 1 1544 . 1 1 130 130 TYR CD1 C 13 132.0160 0.3 . 3 . . . . . 130 TYR CD1 . 12024 1 1545 . 1 1 130 130 TYR CD2 C 13 132.0160 0.3 . 3 . . . . . 130 TYR CD2 . 12024 1 1546 . 1 1 130 130 TYR CE1 C 13 118.3740 0.3 . 3 . . . . . 130 TYR CE1 . 12024 1 1547 . 1 1 130 130 TYR CE2 C 13 118.3740 0.3 . 3 . . . . . 130 TYR CE2 . 12024 1 1548 . 1 1 130 130 TYR N N 15 121.4770 0.2 . 1 . . . . . 130 TYR N . 12024 1 1549 . 1 1 131 131 ILE H H 1 8.6780 0.02 . 1 . . . . . 131 ILE H . 12024 1 1550 . 1 1 131 131 ILE HA H 1 3.8310 0.02 . 1 . . . . . 131 ILE HA . 12024 1 1551 . 1 1 131 131 ILE HB H 1 1.9340 0.02 . 1 . . . . . 131 ILE HB . 12024 1 1552 . 1 1 131 131 ILE HD11 H 1 0.9420 0.02 . 1 . . . . . 131 ILE HD11 . 12024 1 1553 . 1 1 131 131 ILE HD12 H 1 0.9420 0.02 . 1 . . . . . 131 ILE HD11 . 12024 1 1554 . 1 1 131 131 ILE HD13 H 1 0.9420 0.02 . 1 . . . . . 131 ILE HD11 . 12024 1 1555 . 1 1 131 131 ILE HG12 H 1 1.6640 0.02 . 2 . . . . . 131 ILE HG12 . 12024 1 1556 . 1 1 131 131 ILE HG13 H 1 1.1080 0.02 . 2 . . . . . 131 ILE HG13 . 12024 1 1557 . 1 1 131 131 ILE HG21 H 1 0.9070 0.02 . 1 . . . . . 131 ILE HG21 . 12024 1 1558 . 1 1 131 131 ILE HG22 H 1 0.9070 0.02 . 1 . . . . . 131 ILE HG21 . 12024 1 1559 . 1 1 131 131 ILE HG23 H 1 0.9070 0.02 . 1 . . . . . 131 ILE HG21 . 12024 1 1560 . 1 1 131 131 ILE C C 13 178.0080 0.3 . 1 . . . . . 131 ILE C . 12024 1 1561 . 1 1 131 131 ILE CA C 13 65.1510 0.3 . 1 . . . . . 131 ILE CA . 12024 1 1562 . 1 1 131 131 ILE CB C 13 38.2040 0.3 . 1 . . . . . 131 ILE CB . 12024 1 1563 . 1 1 131 131 ILE CD1 C 13 13.0700 0.3 . 1 . . . . . 131 ILE CD1 . 12024 1 1564 . 1 1 131 131 ILE CG1 C 13 28.0160 0.3 . 1 . . . . . 131 ILE CG1 . 12024 1 1565 . 1 1 131 131 ILE CG2 C 13 17.3230 0.3 . 1 . . . . . 131 ILE CG2 . 12024 1 1566 . 1 1 131 131 ILE N N 15 117.4400 0.2 . 1 . . . . . 131 ILE N . 12024 1 1567 . 1 1 132 132 THR H H 1 7.6800 0.02 . 1 . . . . . 132 THR H . 12024 1 1568 . 1 1 132 132 THR HA H 1 4.3020 0.02 . 1 . . . . . 132 THR HA . 12024 1 1569 . 1 1 132 132 THR HB H 1 4.4420 0.02 . 1 . . . . . 132 THR HB . 12024 1 1570 . 1 1 132 132 THR HG21 H 1 1.2210 0.02 . 1 . . . . . 132 THR HG21 . 12024 1 1571 . 1 1 132 132 THR HG22 H 1 1.2210 0.02 . 1 . . . . . 132 THR HG21 . 12024 1 1572 . 1 1 132 132 THR HG23 H 1 1.2210 0.02 . 1 . . . . . 132 THR HG21 . 12024 1 1573 . 1 1 132 132 THR C C 13 175.5640 0.3 . 1 . . . . . 132 THR C . 12024 1 1574 . 1 1 132 132 THR CA C 13 62.4640 0.3 . 1 . . . . . 132 THR CA . 12024 1 1575 . 1 1 132 132 THR CB C 13 70.1280 0.3 . 1 . . . . . 132 THR CB . 12024 1 1576 . 1 1 132 132 THR CG2 C 13 21.7000 0.3 . 1 . . . . . 132 THR CG2 . 12024 1 1577 . 1 1 132 132 THR N N 15 108.7270 0.2 . 1 . . . . . 132 THR N . 12024 1 1578 . 1 1 133 133 GLY H H 1 7.6810 0.02 . 1 . . . . . 133 GLY H . 12024 1 1579 . 1 1 133 133 GLY HA2 H 1 4.0630 0.02 . 2 . . . . . 133 GLY HA2 . 12024 1 1580 . 1 1 133 133 GLY HA3 H 1 3.8600 0.02 . 2 . . . . . 133 GLY HA3 . 12024 1 1581 . 1 1 133 133 GLY C C 13 174.8760 0.3 . 1 . . . . . 133 GLY C . 12024 1 1582 . 1 1 133 133 GLY CA C 13 46.1810 0.3 . 1 . . . . . 133 GLY CA . 12024 1 1583 . 1 1 133 133 GLY N N 15 109.6490 0.2 . 1 . . . . . 133 GLY N . 12024 1 1584 . 1 1 134 134 ARG HA H 1 4.2260 0.02 . 1 . . . . . 134 ARG HA . 12024 1 1585 . 1 1 134 134 ARG HB2 H 1 1.9850 0.02 . 2 . . . . . 134 ARG HB2 . 12024 1 1586 . 1 1 134 134 ARG HB3 H 1 1.6700 0.02 . 2 . . . . . 134 ARG HB3 . 12024 1 1587 . 1 1 134 134 ARG HD2 H 1 3.1650 0.02 . 2 . . . . . 134 ARG HD2 . 12024 1 1588 . 1 1 134 134 ARG HD3 H 1 3.1650 0.02 . 2 . . . . . 134 ARG HD3 . 12024 1 1589 . 1 1 134 134 ARG HE H 1 7.1080 0.02 . 1 . . . . . 134 ARG HE . 12024 1 1590 . 1 1 134 134 ARG HG2 H 1 1.7010 0.02 . 2 . . . . . 134 ARG HG2 . 12024 1 1591 . 1 1 134 134 ARG HG3 H 1 1.7010 0.02 . 2 . . . . . 134 ARG HG3 . 12024 1 1592 . 1 1 134 134 ARG C C 13 177.0530 0.3 . 1 . . . . . 134 ARG C . 12024 1 1593 . 1 1 134 134 ARG CA C 13 57.3800 0.3 . 1 . . . . . 134 ARG CA . 12024 1 1594 . 1 1 134 134 ARG CB C 13 30.5480 0.3 . 1 . . . . . 134 ARG CB . 12024 1 1595 . 1 1 134 134 ARG CD C 13 43.2630 0.3 . 1 . . . . . 134 ARG CD . 12024 1 1596 . 1 1 134 134 ARG CG C 13 27.3500 0.3 . 1 . . . . . 134 ARG CG . 12024 1 1597 . 1 1 134 134 ARG NE N 15 84.8100 0.2 . 1 . . . . . 134 ARG NE . 12024 1 1598 . 1 1 135 135 ILE H H 1 7.3620 0.02 . 1 . . . . . 135 ILE H . 12024 1 1599 . 1 1 135 135 ILE HA H 1 4.6070 0.02 . 1 . . . . . 135 ILE HA . 12024 1 1600 . 1 1 135 135 ILE HB H 1 1.9760 0.02 . 1 . . . . . 135 ILE HB . 12024 1 1601 . 1 1 135 135 ILE HD11 H 1 0.9260 0.02 . 1 . . . . . 135 ILE HD11 . 12024 1 1602 . 1 1 135 135 ILE HD12 H 1 0.9260 0.02 . 1 . . . . . 135 ILE HD11 . 12024 1 1603 . 1 1 135 135 ILE HD13 H 1 0.9260 0.02 . 1 . . . . . 135 ILE HD11 . 12024 1 1604 . 1 1 135 135 ILE HG12 H 1 1.2860 0.02 . 2 . . . . . 135 ILE HG12 . 12024 1 1605 . 1 1 135 135 ILE HG13 H 1 0.8640 0.02 . 2 . . . . . 135 ILE HG13 . 12024 1 1606 . 1 1 135 135 ILE HG21 H 1 0.8860 0.02 . 1 . . . . . 135 ILE HG21 . 12024 1 1607 . 1 1 135 135 ILE HG22 H 1 0.8860 0.02 . 1 . . . . . 135 ILE HG21 . 12024 1 1608 . 1 1 135 135 ILE HG23 H 1 0.8860 0.02 . 1 . . . . . 135 ILE HG21 . 12024 1 1609 . 1 1 135 135 ILE C C 13 175.8520 0.3 . 1 . . . . . 135 ILE C . 12024 1 1610 . 1 1 135 135 ILE CA C 13 60.2750 0.3 . 1 . . . . . 135 ILE CA . 12024 1 1611 . 1 1 135 135 ILE CB C 13 40.4310 0.3 . 1 . . . . . 135 ILE CB . 12024 1 1612 . 1 1 135 135 ILE CD1 C 13 13.4630 0.3 . 1 . . . . . 135 ILE CD1 . 12024 1 1613 . 1 1 135 135 ILE CG1 C 13 24.9320 0.3 . 1 . . . . . 135 ILE CG1 . 12024 1 1614 . 1 1 135 135 ILE CG2 C 13 17.6980 0.3 . 1 . . . . . 135 ILE CG2 . 12024 1 1615 . 1 1 135 135 ILE N N 15 111.9830 0.2 . 1 . . . . . 135 ILE N . 12024 1 1616 . 1 1 136 136 THR H H 1 8.6920 0.02 . 1 . . . . . 136 THR H . 12024 1 1617 . 1 1 136 136 THR HA H 1 4.2960 0.02 . 1 . . . . . 136 THR HA . 12024 1 1618 . 1 1 136 136 THR HB H 1 4.4410 0.02 . 1 . . . . . 136 THR HB . 12024 1 1619 . 1 1 136 136 THR HG21 H 1 1.2300 0.02 . 1 . . . . . 136 THR HG21 . 12024 1 1620 . 1 1 136 136 THR HG22 H 1 1.2300 0.02 . 1 . . . . . 136 THR HG21 . 12024 1 1621 . 1 1 136 136 THR HG23 H 1 1.2300 0.02 . 1 . . . . . 136 THR HG21 . 12024 1 1622 . 1 1 136 136 THR C C 13 174.4470 0.3 . 1 . . . . . 136 THR C . 12024 1 1623 . 1 1 136 136 THR CA C 13 62.4600 0.3 . 1 . . . . . 136 THR CA . 12024 1 1624 . 1 1 136 136 THR CB C 13 69.9860 0.3 . 1 . . . . . 136 THR CB . 12024 1 1625 . 1 1 136 136 THR CG2 C 13 21.5770 0.3 . 1 . . . . . 136 THR CG2 . 12024 1 1626 . 1 1 136 136 THR N N 15 112.6140 0.2 . 1 . . . . . 136 THR N . 12024 1 1627 . 1 1 137 137 HIS H H 1 7.6040 0.02 . 1 . . . . . 137 HIS H . 12024 1 1628 . 1 1 137 137 HIS HA H 1 4.7960 0.02 . 1 . . . . . 137 HIS HA . 12024 1 1629 . 1 1 137 137 HIS HB2 H 1 3.0600 0.02 . 2 . . . . . 137 HIS HB2 . 12024 1 1630 . 1 1 137 137 HIS HB3 H 1 3.3730 0.02 . 2 . . . . . 137 HIS HB3 . 12024 1 1631 . 1 1 137 137 HIS HE1 H 1 7.8640 0.02 . 1 . . . . . 137 HIS HE1 . 12024 1 1632 . 1 1 137 137 HIS C C 13 173.2550 0.3 . 1 . . . . . 137 HIS C . 12024 1 1633 . 1 1 137 137 HIS CA C 13 54.3590 0.3 . 1 . . . . . 137 HIS CA . 12024 1 1634 . 1 1 137 137 HIS CB C 13 30.2330 0.3 . 1 . . . . . 137 HIS CB . 12024 1 1635 . 1 1 137 137 HIS CE1 C 13 138.5800 0.3 . 1 . . . . . 137 HIS CE1 . 12024 1 1636 . 1 1 137 137 HIS N N 15 115.0190 0.2 . 1 . . . . . 137 HIS N . 12024 1 1637 . 1 1 138 138 LEU H H 1 8.8420 0.02 . 1 . . . . . 138 LEU H . 12024 1 1638 . 1 1 138 138 LEU HA H 1 4.4600 0.02 . 1 . . . . . 138 LEU HA . 12024 1 1639 . 1 1 138 138 LEU HB2 H 1 1.5050 0.02 . 2 . . . . . 138 LEU HB2 . 12024 1 1640 . 1 1 138 138 LEU HB3 H 1 1.5050 0.02 . 2 . . . . . 138 LEU HB3 . 12024 1 1641 . 1 1 138 138 LEU HD11 H 1 0.6420 0.02 . 2 . . . . . 138 LEU HD11 . 12024 1 1642 . 1 1 138 138 LEU HD12 H 1 0.6420 0.02 . 2 . . . . . 138 LEU HD11 . 12024 1 1643 . 1 1 138 138 LEU HD13 H 1 0.6420 0.02 . 2 . . . . . 138 LEU HD11 . 12024 1 1644 . 1 1 138 138 LEU HD21 H 1 0.7250 0.02 . 2 . . . . . 138 LEU HD21 . 12024 1 1645 . 1 1 138 138 LEU HD22 H 1 0.7250 0.02 . 2 . . . . . 138 LEU HD21 . 12024 1 1646 . 1 1 138 138 LEU HD23 H 1 0.7250 0.02 . 2 . . . . . 138 LEU HD21 . 12024 1 1647 . 1 1 138 138 LEU HG H 1 1.1860 0.02 . 1 . . . . . 138 LEU HG . 12024 1 1648 . 1 1 138 138 LEU C C 13 176.2660 0.3 . 1 . . . . . 138 LEU C . 12024 1 1649 . 1 1 138 138 LEU CA C 13 53.0610 0.3 . 1 . . . . . 138 LEU CA . 12024 1 1650 . 1 1 138 138 LEU CB C 13 40.5140 0.3 . 1 . . . . . 138 LEU CB . 12024 1 1651 . 1 1 138 138 LEU CD1 C 13 25.3400 0.3 . 2 . . . . . 138 LEU CD1 . 12024 1 1652 . 1 1 138 138 LEU CD2 C 13 23.9820 0.3 . 2 . . . . . 138 LEU CD2 . 12024 1 1653 . 1 1 138 138 LEU CG C 13 26.7960 0.3 . 1 . . . . . 138 LEU CG . 12024 1 1654 . 1 1 138 138 LEU N N 15 123.3290 0.2 . 1 . . . . . 138 LEU N . 12024 1 1655 . 1 1 139 139 PRO HA H 1 4.3950 0.02 . 1 . . . . . 139 PRO HA . 12024 1 1656 . 1 1 139 139 PRO HB2 H 1 2.2550 0.02 . 2 . . . . . 139 PRO HB2 . 12024 1 1657 . 1 1 139 139 PRO HB3 H 1 1.9900 0.02 . 2 . . . . . 139 PRO HB3 . 12024 1 1658 . 1 1 139 139 PRO HD2 H 1 3.6280 0.02 . 2 . . . . . 139 PRO HD2 . 12024 1 1659 . 1 1 139 139 PRO HD3 H 1 3.6280 0.02 . 2 . . . . . 139 PRO HD3 . 12024 1 1660 . 1 1 139 139 PRO HG2 H 1 2.0740 0.02 . 2 . . . . . 139 PRO HG2 . 12024 1 1661 . 1 1 139 139 PRO HG3 H 1 2.0740 0.02 . 2 . . . . . 139 PRO HG3 . 12024 1 1662 . 1 1 139 139 PRO C C 13 176.9500 0.3 . 1 . . . . . 139 PRO C . 12024 1 1663 . 1 1 139 139 PRO CA C 13 64.6690 0.3 . 1 . . . . . 139 PRO CA . 12024 1 1664 . 1 1 139 139 PRO CB C 13 30.9790 0.3 . 1 . . . . . 139 PRO CB . 12024 1 1665 . 1 1 139 139 PRO CD C 13 50.3390 0.3 . 1 . . . . . 139 PRO CD . 12024 1 1666 . 1 1 139 139 PRO CG C 13 27.9220 0.3 . 1 . . . . . 139 PRO CG . 12024 1 1667 . 1 1 140 140 VAL H H 1 7.3890 0.02 . 1 . . . . . 140 VAL H . 12024 1 1668 . 1 1 140 140 VAL HA H 1 3.8420 0.02 . 1 . . . . . 140 VAL HA . 12024 1 1669 . 1 1 140 140 VAL HB H 1 1.5440 0.02 . 1 . . . . . 140 VAL HB . 12024 1 1670 . 1 1 140 140 VAL HG11 H 1 0.3230 0.02 . 2 . . . . . 140 VAL HG11 . 12024 1 1671 . 1 1 140 140 VAL HG12 H 1 0.3230 0.02 . 2 . . . . . 140 VAL HG11 . 12024 1 1672 . 1 1 140 140 VAL HG13 H 1 0.3230 0.02 . 2 . . . . . 140 VAL HG11 . 12024 1 1673 . 1 1 140 140 VAL HG21 H 1 0.4260 0.02 . 2 . . . . . 140 VAL HG21 . 12024 1 1674 . 1 1 140 140 VAL HG22 H 1 0.4260 0.02 . 2 . . . . . 140 VAL HG21 . 12024 1 1675 . 1 1 140 140 VAL HG23 H 1 0.4260 0.02 . 2 . . . . . 140 VAL HG21 . 12024 1 1676 . 1 1 140 140 VAL C C 13 175.6420 0.3 . 1 . . . . . 140 VAL C . 12024 1 1677 . 1 1 140 140 VAL CA C 13 62.2700 0.3 . 1 . . . . . 140 VAL CA . 12024 1 1678 . 1 1 140 140 VAL CB C 13 31.9510 0.3 . 1 . . . . . 140 VAL CB . 12024 1 1679 . 1 1 140 140 VAL CG1 C 13 20.1650 0.3 . 2 . . . . . 140 VAL CG1 . 12024 1 1680 . 1 1 140 140 VAL CG2 C 13 19.6700 0.3 . 2 . . . . . 140 VAL CG2 . 12024 1 1681 . 1 1 140 140 VAL N N 15 114.7140 0.2 . 1 . . . . . 140 VAL N . 12024 1 1682 . 1 1 141 141 GLY H H 1 7.9190 0.02 . 1 . . . . . 141 GLY H . 12024 1 1683 . 1 1 141 141 GLY HA2 H 1 4.0340 0.02 . 2 . . . . . 141 GLY HA2 . 12024 1 1684 . 1 1 141 141 GLY HA3 H 1 3.9350 0.02 . 2 . . . . . 141 GLY HA3 . 12024 1 1685 . 1 1 141 141 GLY C C 13 174.0340 0.3 . 1 . . . . . 141 GLY C . 12024 1 1686 . 1 1 141 141 GLY CA C 13 45.2700 0.3 . 1 . . . . . 141 GLY CA . 12024 1 1687 . 1 1 141 141 GLY N N 15 109.2690 0.2 . 1 . . . . . 141 GLY N . 12024 1 1688 . 1 1 142 142 ASN H H 1 8.1510 0.02 . 1 . . . . . 142 ASN H . 12024 1 1689 . 1 1 142 142 ASN HA H 1 4.6480 0.02 . 1 . . . . . 142 ASN HA . 12024 1 1690 . 1 1 142 142 ASN HB2 H 1 2.8190 0.02 . 2 . . . . . 142 ASN HB2 . 12024 1 1691 . 1 1 142 142 ASN HB3 H 1 2.7330 0.02 . 2 . . . . . 142 ASN HB3 . 12024 1 1692 . 1 1 142 142 ASN HD21 H 1 7.5940 0.02 . 2 . . . . . 142 ASN HD21 . 12024 1 1693 . 1 1 142 142 ASN HD22 H 1 6.9010 0.02 . 2 . . . . . 142 ASN HD22 . 12024 1 1694 . 1 1 142 142 ASN C C 13 175.4560 0.3 . 1 . . . . . 142 ASN C . 12024 1 1695 . 1 1 142 142 ASN CA C 13 53.2850 0.3 . 1 . . . . . 142 ASN CA . 12024 1 1696 . 1 1 142 142 ASN CB C 13 38.9890 0.3 . 1 . . . . . 142 ASN CB . 12024 1 1697 . 1 1 142 142 ASN N N 15 118.7810 0.2 . 1 . . . . . 142 ASN N . 12024 1 1698 . 1 1 142 142 ASN ND2 N 15 112.5900 0.2 . 1 . . . . . 142 ASN ND2 . 12024 1 1699 . 1 1 143 143 GLN H H 1 8.4290 0.02 . 1 . . . . . 143 GLN H . 12024 1 1700 . 1 1 143 143 GLN HA H 1 4.2490 0.02 . 1 . . . . . 143 GLN HA . 12024 1 1701 . 1 1 143 143 GLN HB2 H 1 1.9660 0.02 . 2 . . . . . 143 GLN HB2 . 12024 1 1702 . 1 1 143 143 GLN HB3 H 1 2.1010 0.02 . 2 . . . . . 143 GLN HB3 . 12024 1 1703 . 1 1 143 143 GLN HE21 H 1 7.4970 0.02 . 2 . . . . . 143 GLN HE21 . 12024 1 1704 . 1 1 143 143 GLN HE22 H 1 6.8570 0.02 . 2 . . . . . 143 GLN HE22 . 12024 1 1705 . 1 1 143 143 GLN HG2 H 1 2.3430 0.02 . 2 . . . . . 143 GLN HG2 . 12024 1 1706 . 1 1 143 143 GLN HG3 H 1 2.3430 0.02 . 2 . . . . . 143 GLN HG3 . 12024 1 1707 . 1 1 143 143 GLN C C 13 176.0280 0.3 . 1 . . . . . 143 GLN C . 12024 1 1708 . 1 1 143 143 GLN CA C 13 56.2820 0.3 . 1 . . . . . 143 GLN CA . 12024 1 1709 . 1 1 143 143 GLN CB C 13 29.0900 0.3 . 1 . . . . . 143 GLN CB . 12024 1 1710 . 1 1 143 143 GLN CG C 13 33.8310 0.3 . 1 . . . . . 143 GLN CG . 12024 1 1711 . 1 1 143 143 GLN N N 15 120.6110 0.2 . 1 . . . . . 143 GLN N . 12024 1 1712 . 1 1 143 143 GLN NE2 N 15 112.5100 0.2 . 1 . . . . . 143 GLN NE2 . 12024 1 1713 . 1 1 144 144 LEU H H 1 8.1850 0.02 . 1 . . . . . 144 LEU H . 12024 1 1714 . 1 1 144 144 LEU HA H 1 4.2720 0.02 . 1 . . . . . 144 LEU HA . 12024 1 1715 . 1 1 144 144 LEU HB2 H 1 1.6130 0.02 . 2 . . . . . 144 LEU HB2 . 12024 1 1716 . 1 1 144 144 LEU HB3 H 1 1.5100 0.02 . 2 . . . . . 144 LEU HB3 . 12024 1 1717 . 1 1 144 144 LEU HD11 H 1 0.9020 0.02 . 2 . . . . . 144 LEU HD11 . 12024 1 1718 . 1 1 144 144 LEU HD12 H 1 0.9020 0.02 . 2 . . . . . 144 LEU HD11 . 12024 1 1719 . 1 1 144 144 LEU HD13 H 1 0.9020 0.02 . 2 . . . . . 144 LEU HD11 . 12024 1 1720 . 1 1 144 144 LEU HD21 H 1 0.8330 0.02 . 2 . . . . . 144 LEU HD21 . 12024 1 1721 . 1 1 144 144 LEU HD22 H 1 0.8330 0.02 . 2 . . . . . 144 LEU HD21 . 12024 1 1722 . 1 1 144 144 LEU HD23 H 1 0.8330 0.02 . 2 . . . . . 144 LEU HD21 . 12024 1 1723 . 1 1 144 144 LEU HG H 1 1.5640 0.02 . 1 . . . . . 144 LEU HG . 12024 1 1724 . 1 1 144 144 LEU C C 13 177.3500 0.3 . 1 . . . . . 144 LEU C . 12024 1 1725 . 1 1 144 144 LEU CA C 13 55.3900 0.3 . 1 . . . . . 144 LEU CA . 12024 1 1726 . 1 1 144 144 LEU CB C 13 42.1250 0.3 . 1 . . . . . 144 LEU CB . 12024 1 1727 . 1 1 144 144 LEU CD1 C 13 24.9700 0.3 . 2 . . . . . 144 LEU CD1 . 12024 1 1728 . 1 1 144 144 LEU CD2 C 13 23.4200 0.3 . 2 . . . . . 144 LEU CD2 . 12024 1 1729 . 1 1 144 144 LEU CG C 13 26.7960 0.3 . 1 . . . . . 144 LEU CG . 12024 1 1730 . 1 1 144 144 LEU N N 15 122.4180 0.2 . 1 . . . . . 144 LEU N . 12024 1 1731 . 1 1 145 145 GLU H H 1 8.1700 0.02 . 1 . . . . . 145 GLU H . 12024 1 1732 . 1 1 145 145 GLU HA H 1 4.1790 0.02 . 1 . . . . . 145 GLU HA . 12024 1 1733 . 1 1 145 145 GLU HB2 H 1 1.8950 0.02 . 2 . . . . . 145 GLU HB2 . 12024 1 1734 . 1 1 145 145 GLU HB3 H 1 1.8950 0.02 . 2 . . . . . 145 GLU HB3 . 12024 1 1735 . 1 1 145 145 GLU HG2 H 1 2.2010 0.02 . 2 . . . . . 145 GLU HG2 . 12024 1 1736 . 1 1 145 145 GLU HG3 H 1 2.2010 0.02 . 2 . . . . . 145 GLU HG3 . 12024 1 1737 . 1 1 145 145 GLU C C 13 176.2510 0.3 . 1 . . . . . 145 GLU C . 12024 1 1738 . 1 1 145 145 GLU CA C 13 56.4150 0.3 . 1 . . . . . 145 GLU CA . 12024 1 1739 . 1 1 145 145 GLU CB C 13 30.2330 0.3 . 1 . . . . . 145 GLU CB . 12024 1 1740 . 1 1 145 145 GLU CG C 13 35.8950 0.3 . 1 . . . . . 145 GLU CG . 12024 1 1741 . 1 1 145 145 GLU N N 15 120.9690 0.2 . 1 . . . . . 145 GLU N . 12024 1 1742 . 1 1 146 146 HIS H H 1 8.4720 0.02 . 1 . . . . . 146 HIS H . 12024 1 1743 . 1 1 146 146 HIS HA H 1 4.6400 0.02 . 1 . . . . . 146 HIS HA . 12024 1 1744 . 1 1 146 146 HIS HB2 H 1 3.1310 0.02 . 2 . . . . . 146 HIS HB2 . 12024 1 1745 . 1 1 146 146 HIS HB3 H 1 3.1310 0.02 . 2 . . . . . 146 HIS HB3 . 12024 1 1746 . 1 1 146 146 HIS C C 13 174.2800 0.3 . 1 . . . . . 146 HIS C . 12024 1 1747 . 1 1 146 146 HIS CA C 13 55.2400 0.3 . 1 . . . . . 146 HIS CA . 12024 1 1748 . 1 1 146 146 HIS CB C 13 29.2670 0.3 . 1 . . . . . 146 HIS CB . 12024 1 1749 . 1 1 146 146 HIS N N 15 119.4770 0.2 . 1 . . . . . 146 HIS N . 12024 1 1750 . 1 1 147 147 HIS H H 1 8.5450 0.02 . 1 . . . . . 147 HIS H . 12024 1 1751 . 1 1 147 147 HIS HA H 1 4.6710 0.02 . 1 . . . . . 147 HIS HA . 12024 1 1752 . 1 1 147 147 HIS HB2 H 1 3.1540 0.02 . 2 . . . . . 147 HIS HB2 . 12024 1 1753 . 1 1 147 147 HIS HB3 H 1 3.1540 0.02 . 2 . . . . . 147 HIS HB3 . 12024 1 1754 . 1 1 147 147 HIS C C 13 174.3150 0.3 . 1 . . . . . 147 HIS C . 12024 1 1755 . 1 1 147 147 HIS CA C 13 55.3500 0.3 . 1 . . . . . 147 HIS CA . 12024 1 1756 . 1 1 147 147 HIS CB C 13 29.2340 0.3 . 1 . . . . . 147 HIS CB . 12024 1 1757 . 1 1 147 147 HIS N N 15 119.2960 0.2 . 1 . . . . . 147 HIS N . 12024 1 1758 . 1 1 148 148 HIS H H 1 8.6460 0.02 . 1 . . . . . 148 HIS H . 12024 1 1759 . 1 1 148 148 HIS HA H 1 4.6640 0.02 . 1 . . . . . 148 HIS HA . 12024 1 1760 . 1 1 148 148 HIS HB2 H 1 3.1700 0.02 . 2 . . . . . 148 HIS HB2 . 12024 1 1761 . 1 1 148 148 HIS HB3 H 1 3.1700 0.02 . 2 . . . . . 148 HIS HB3 . 12024 1 1762 . 1 1 148 148 HIS C C 13 174.1480 0.3 . 1 . . . . . 148 HIS C . 12024 1 1763 . 1 1 148 148 HIS CA C 13 55.4700 0.3 . 1 . . . . . 148 HIS CA . 12024 1 1764 . 1 1 148 148 HIS CB C 13 29.4200 0.3 . 1 . . . . . 148 HIS CB . 12024 1 1765 . 1 1 148 148 HIS N N 15 119.8930 0.2 . 1 . . . . . 148 HIS N . 12024 1 1766 . 1 1 149 149 HIS H H 1 8.6860 0.02 . 1 . . . . . 149 HIS H . 12024 1 1767 . 1 1 149 149 HIS HA H 1 4.6680 0.02 . 1 . . . . . 149 HIS HA . 12024 1 1768 . 1 1 149 149 HIS HB2 H 1 3.1910 0.02 . 2 . . . . . 149 HIS HB2 . 12024 1 1769 . 1 1 149 149 HIS HB3 H 1 3.1910 0.02 . 2 . . . . . 149 HIS HB3 . 12024 1 1770 . 1 1 149 149 HIS CA C 13 55.4700 0.3 . 1 . . . . . 149 HIS CA . 12024 1 1771 . 1 1 149 149 HIS CB C 13 29.5000 0.3 . 1 . . . . . 149 HIS CB . 12024 1 1772 . 1 1 149 149 HIS N N 15 120.5940 0.2 . 1 . . . . . 149 HIS N . 12024 1 1773 . 1 1 150 150 HIS H H 1 8.5790 0.02 . 1 . . . . . 150 HIS H . 12024 1 1774 . 1 1 150 150 HIS HA H 1 4.6580 0.02 . 1 . . . . . 150 HIS HA . 12024 1 1775 . 1 1 150 150 HIS HB2 H 1 3.2170 0.02 . 2 . . . . . 150 HIS HB2 . 12024 1 1776 . 1 1 150 150 HIS HB3 H 1 3.2170 0.02 . 2 . . . . . 150 HIS HB3 . 12024 1 1777 . 1 1 150 150 HIS CA C 13 55.6400 0.3 . 1 . . . . . 150 HIS CA . 12024 1 1778 . 1 1 150 150 HIS CB C 13 29.5800 0.3 . 1 . . . . . 150 HIS CB . 12024 1 1779 . 1 1 150 150 HIS N N 15 120.7670 0.2 . 1 . . . . . 150 HIS N . 12024 1 1780 . 1 1 151 151 HIS H H 1 8.4020 0.02 . 1 . . . . . 151 HIS H . 12024 1 1781 . 1 1 151 151 HIS HA H 1 4.4680 0.02 . 1 . . . . . 151 HIS HA . 12024 1 1782 . 1 1 151 151 HIS HB2 H 1 3.2120 0.02 . 2 . . . . . 151 HIS HB2 . 12024 1 1783 . 1 1 151 151 HIS HB3 H 1 3.2120 0.02 . 2 . . . . . 151 HIS HB3 . 12024 1 1784 . 1 1 151 151 HIS CA C 13 57.2000 0.3 . 1 . . . . . 151 HIS CA . 12024 1 1785 . 1 1 151 151 HIS CB C 13 29.5400 0.3 . 1 . . . . . 151 HIS CB . 12024 1 1786 . 1 1 151 151 HIS N N 15 125.6930 0.2 . 1 . . . . . 151 HIS N . 12024 1 stop_ save_