data_25805 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 25805 _Entry.Title ; Structure of the cyclic nucleotide-binding homology domain of the hERG channel ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2015-09-10 _Entry.Accession_date 2015-09-18 _Entry.Last_release_date 2016-05-23 _Entry.Original_release_date 2016-05-23 _Entry.Origination author _Entry.NMR_STAR_version 3.1.2.6 _Entry.Original_NMR_STAR_version 3.1.1.61 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype 'NMR, 20 STRUCTURES' _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 Yan Li . . . . 25805 2 'Hui Qi' Ng . . . . 25805 3 Qingxin Li . . . . 25805 4 CongBao Kang . . . . 25805 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID 1 'not applicable' 'not applicable' . 25805 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID CNBHD . 25805 LQTS2 . 25805 NMR . 25805 hERG . 25805 'ion channel' . 25805 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 25805 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 508 25805 '15N chemical shifts' 125 25805 '1H chemical shifts' 845 25805 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2016-05-23 . original BMRB . 25805 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2N7G 'BMRB Entry Tracking System' 25805 stop_ save_ ############### # Citations # ############### save_citations _Citation.Sf_category citations _Citation.Sf_framecode citations _Citation.Entry_ID 25805 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 27025590 _Citation.Full_citation . _Citation.Title ; Structure of the Cyclic Nucleotide-Binding Homology Domain of the hERG Channel and Its Insight into Type 2 Long QT Syndrom ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Sci. Rep.' _Citation.Journal_name_full . _Citation.Journal_volume 6 _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 23712 _Citation.Page_last 23712 _Citation.Year 2016 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Yan Li . . . . 25805 1 2 'Hui Qi' Ng . . . . 25805 1 3 Qingxin Li . . . . 25805 1 4 CongBao Kang . . . . 25805 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 25805 _Assembly.ID 1 _Assembly.Name 'cyclic nucleotide-binding homology domain of hERG channel' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _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 'cyclic nucleotide-binding homology domain of hERG channel' 1 $the_cyclic_nucleotide-binding_homology_domain_of_the_hERG_channel A . yes native no no . . . 25805 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_the_cyclic_nucleotide-binding_homology_domain_of_the_hERG_channel _Entity.Sf_category entity _Entity.Sf_framecode the_cyclic_nucleotide-binding_homology_domain_of_the_hERG_channel _Entity.Entry_ID 25805 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name the_cyclic_nucleotide-binding_homology_domain_of_the_hERG_channel _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MHHHHHHSSGVDLGTENLYF QSMRSLLQHCKPFRGATKGC LRALAMKFKTTHAPPGDTLV HAGDLLTALYFISRGSIEIL RGDVVVAILGKNDIFGEPLN LYARPGKSNGDVRALTYCDL HKIHRDDLLEVLDMYPEFSD HFWSSLEITFNLRD ; _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 154 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 14750.103 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 1 MET . 25805 1 2 2 HIS . 25805 1 3 3 HIS . 25805 1 4 4 HIS . 25805 1 5 5 HIS . 25805 1 6 6 HIS . 25805 1 7 7 HIS . 25805 1 8 8 SER . 25805 1 9 9 SER . 25805 1 10 10 GLY . 25805 1 11 11 VAL . 25805 1 12 12 ASP . 25805 1 13 13 LEU . 25805 1 14 14 GLY . 25805 1 15 15 THR . 25805 1 16 16 GLU . 25805 1 17 17 ASN . 25805 1 18 18 LEU . 25805 1 19 19 TYR . 25805 1 20 20 PHE . 25805 1 21 21 GLN . 25805 1 22 22 SER . 25805 1 23 23 MET . 25805 1 24 24 ARG . 25805 1 25 25 SER . 25805 1 26 26 LEU . 25805 1 27 27 LEU . 25805 1 28 28 GLN . 25805 1 29 29 HIS . 25805 1 30 30 CYS . 25805 1 31 31 LYS . 25805 1 32 32 PRO . 25805 1 33 33 PHE . 25805 1 34 34 ARG . 25805 1 35 35 GLY . 25805 1 36 36 ALA . 25805 1 37 37 THR . 25805 1 38 38 LYS . 25805 1 39 39 GLY . 25805 1 40 40 CYS . 25805 1 41 41 LEU . 25805 1 42 42 ARG . 25805 1 43 43 ALA . 25805 1 44 44 LEU . 25805 1 45 45 ALA . 25805 1 46 46 MET . 25805 1 47 47 LYS . 25805 1 48 48 PHE . 25805 1 49 49 LYS . 25805 1 50 50 THR . 25805 1 51 51 THR . 25805 1 52 52 HIS . 25805 1 53 53 ALA . 25805 1 54 54 PRO . 25805 1 55 55 PRO . 25805 1 56 56 GLY . 25805 1 57 57 ASP . 25805 1 58 58 THR . 25805 1 59 59 LEU . 25805 1 60 60 VAL . 25805 1 61 61 HIS . 25805 1 62 62 ALA . 25805 1 63 63 GLY . 25805 1 64 64 ASP . 25805 1 65 65 LEU . 25805 1 66 66 LEU . 25805 1 67 67 THR . 25805 1 68 68 ALA . 25805 1 69 69 LEU . 25805 1 70 70 TYR . 25805 1 71 71 PHE . 25805 1 72 72 ILE . 25805 1 73 73 SER . 25805 1 74 74 ARG . 25805 1 75 75 GLY . 25805 1 76 76 SER . 25805 1 77 77 ILE . 25805 1 78 78 GLU . 25805 1 79 79 ILE . 25805 1 80 80 LEU . 25805 1 81 81 ARG . 25805 1 82 82 GLY . 25805 1 83 83 ASP . 25805 1 84 84 VAL . 25805 1 85 85 VAL . 25805 1 86 86 VAL . 25805 1 87 87 ALA . 25805 1 88 88 ILE . 25805 1 89 89 LEU . 25805 1 90 90 GLY . 25805 1 91 91 LYS . 25805 1 92 92 ASN . 25805 1 93 93 ASP . 25805 1 94 94 ILE . 25805 1 95 95 PHE . 25805 1 96 96 GLY . 25805 1 97 97 GLU . 25805 1 98 98 PRO . 25805 1 99 99 LEU . 25805 1 100 100 ASN . 25805 1 101 101 LEU . 25805 1 102 102 TYR . 25805 1 103 103 ALA . 25805 1 104 104 ARG . 25805 1 105 105 PRO . 25805 1 106 106 GLY . 25805 1 107 107 LYS . 25805 1 108 108 SER . 25805 1 109 109 ASN . 25805 1 110 110 GLY . 25805 1 111 111 ASP . 25805 1 112 112 VAL . 25805 1 113 113 ARG . 25805 1 114 114 ALA . 25805 1 115 115 LEU . 25805 1 116 116 THR . 25805 1 117 117 TYR . 25805 1 118 118 CYS . 25805 1 119 119 ASP . 25805 1 120 120 LEU . 25805 1 121 121 HIS . 25805 1 122 122 LYS . 25805 1 123 123 ILE . 25805 1 124 124 HIS . 25805 1 125 125 ARG . 25805 1 126 126 ASP . 25805 1 127 127 ASP . 25805 1 128 128 LEU . 25805 1 129 129 LEU . 25805 1 130 130 GLU . 25805 1 131 131 VAL . 25805 1 132 132 LEU . 25805 1 133 133 ASP . 25805 1 134 134 MET . 25805 1 135 135 TYR . 25805 1 136 136 PRO . 25805 1 137 137 GLU . 25805 1 138 138 PHE . 25805 1 139 139 SER . 25805 1 140 140 ASP . 25805 1 141 141 HIS . 25805 1 142 142 PHE . 25805 1 143 143 TRP . 25805 1 144 144 SER . 25805 1 145 145 SER . 25805 1 146 146 LEU . 25805 1 147 147 GLU . 25805 1 148 148 ILE . 25805 1 149 149 THR . 25805 1 150 150 PHE . 25805 1 151 151 ASN . 25805 1 152 152 LEU . 25805 1 153 153 ARG . 25805 1 154 154 ASP . 25805 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 25805 1 . HIS 2 2 25805 1 . HIS 3 3 25805 1 . HIS 4 4 25805 1 . HIS 5 5 25805 1 . HIS 6 6 25805 1 . HIS 7 7 25805 1 . SER 8 8 25805 1 . SER 9 9 25805 1 . GLY 10 10 25805 1 . VAL 11 11 25805 1 . ASP 12 12 25805 1 . LEU 13 13 25805 1 . GLY 14 14 25805 1 . THR 15 15 25805 1 . GLU 16 16 25805 1 . ASN 17 17 25805 1 . LEU 18 18 25805 1 . TYR 19 19 25805 1 . PHE 20 20 25805 1 . GLN 21 21 25805 1 . SER 22 22 25805 1 . MET 23 23 25805 1 . ARG 24 24 25805 1 . SER 25 25 25805 1 . LEU 26 26 25805 1 . LEU 27 27 25805 1 . GLN 28 28 25805 1 . HIS 29 29 25805 1 . CYS 30 30 25805 1 . LYS 31 31 25805 1 . PRO 32 32 25805 1 . PHE 33 33 25805 1 . ARG 34 34 25805 1 . GLY 35 35 25805 1 . ALA 36 36 25805 1 . THR 37 37 25805 1 . LYS 38 38 25805 1 . GLY 39 39 25805 1 . CYS 40 40 25805 1 . LEU 41 41 25805 1 . ARG 42 42 25805 1 . ALA 43 43 25805 1 . LEU 44 44 25805 1 . ALA 45 45 25805 1 . MET 46 46 25805 1 . LYS 47 47 25805 1 . PHE 48 48 25805 1 . LYS 49 49 25805 1 . THR 50 50 25805 1 . THR 51 51 25805 1 . HIS 52 52 25805 1 . ALA 53 53 25805 1 . PRO 54 54 25805 1 . PRO 55 55 25805 1 . GLY 56 56 25805 1 . ASP 57 57 25805 1 . THR 58 58 25805 1 . LEU 59 59 25805 1 . VAL 60 60 25805 1 . HIS 61 61 25805 1 . ALA 62 62 25805 1 . GLY 63 63 25805 1 . ASP 64 64 25805 1 . LEU 65 65 25805 1 . LEU 66 66 25805 1 . THR 67 67 25805 1 . ALA 68 68 25805 1 . LEU 69 69 25805 1 . TYR 70 70 25805 1 . PHE 71 71 25805 1 . ILE 72 72 25805 1 . SER 73 73 25805 1 . ARG 74 74 25805 1 . GLY 75 75 25805 1 . SER 76 76 25805 1 . ILE 77 77 25805 1 . GLU 78 78 25805 1 . ILE 79 79 25805 1 . LEU 80 80 25805 1 . ARG 81 81 25805 1 . GLY 82 82 25805 1 . ASP 83 83 25805 1 . VAL 84 84 25805 1 . VAL 85 85 25805 1 . VAL 86 86 25805 1 . ALA 87 87 25805 1 . ILE 88 88 25805 1 . LEU 89 89 25805 1 . GLY 90 90 25805 1 . LYS 91 91 25805 1 . ASN 92 92 25805 1 . ASP 93 93 25805 1 . ILE 94 94 25805 1 . PHE 95 95 25805 1 . GLY 96 96 25805 1 . GLU 97 97 25805 1 . PRO 98 98 25805 1 . LEU 99 99 25805 1 . ASN 100 100 25805 1 . LEU 101 101 25805 1 . TYR 102 102 25805 1 . ALA 103 103 25805 1 . ARG 104 104 25805 1 . PRO 105 105 25805 1 . GLY 106 106 25805 1 . LYS 107 107 25805 1 . SER 108 108 25805 1 . ASN 109 109 25805 1 . GLY 110 110 25805 1 . ASP 111 111 25805 1 . VAL 112 112 25805 1 . ARG 113 113 25805 1 . ALA 114 114 25805 1 . LEU 115 115 25805 1 . THR 116 116 25805 1 . TYR 117 117 25805 1 . CYS 118 118 25805 1 . ASP 119 119 25805 1 . LEU 120 120 25805 1 . HIS 121 121 25805 1 . LYS 122 122 25805 1 . ILE 123 123 25805 1 . HIS 124 124 25805 1 . ARG 125 125 25805 1 . ASP 126 126 25805 1 . ASP 127 127 25805 1 . LEU 128 128 25805 1 . LEU 129 129 25805 1 . GLU 130 130 25805 1 . VAL 131 131 25805 1 . LEU 132 132 25805 1 . ASP 133 133 25805 1 . MET 134 134 25805 1 . TYR 135 135 25805 1 . PRO 136 136 25805 1 . GLU 137 137 25805 1 . PHE 138 138 25805 1 . SER 139 139 25805 1 . ASP 140 140 25805 1 . HIS 141 141 25805 1 . PHE 142 142 25805 1 . TRP 143 143 25805 1 . SER 144 144 25805 1 . SER 145 145 25805 1 . LEU 146 146 25805 1 . GLU 147 147 25805 1 . ILE 148 148 25805 1 . THR 149 149 25805 1 . PHE 150 150 25805 1 . ASN 151 151 25805 1 . LEU 152 152 25805 1 . ARG 153 153 25805 1 . ASP 154 154 25805 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 25805 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $the_cyclic_nucleotide-binding_homology_domain_of_the_hERG_channel . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . 25805 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 25805 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $the_cyclic_nucleotide-binding_homology_domain_of_the_hERG_channel . 'recombinant technology' 'Escherichia coli' . . 562 Escherichia coli Roestta . . . . . PNIC28-Bsa4 . . . 25805 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 25805 _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 'the cyclic nucleotide-binding homology domain of the hERG channel' '[U-100% 13C; U-100% 15N]' . . 1 $the_cyclic_nucleotide-binding_homology_domain_of_the_hERG_channel . protein 0.4 . . mM . . . . 25805 1 2 'sodium phosphate' 'natural abundance' . . . . . buffer 20 . . mM . . . . 25805 1 3 'sodium chloride' 'natural abundance' . . . . . salt 150 . . mM . . . . 25805 1 4 DTT 'natural abundance' . . . . . . 1 . . mM . . . . 25805 1 5 H2O 'natural abundance' . . . . . solvent 90 . . % . . . . 25805 1 6 D2O [U-2H] . . . . . solvent 10 . . % . . . . 25805 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 25805 _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' 170 . mM 25805 1 pH 7.2 . pH 25805 1 pressure 1 . atm 25805 1 temperature 298 . K 25805 1 stop_ save_ ############################ # Computer software used # ############################ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 25805 _Software.ID 1 _Software.Name NMRPipe _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 25805 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 25805 1 processing 25805 1 'structure solution' 25805 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 25805 _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_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 25805 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 25805 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker Avance . 600 . . . 25805 1 2 spectrometer_2 Bruker Avance . 700 . . . 25805 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 25805 _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 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 25805 1 2 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 25805 1 3 '3D HN(CO)CACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 25805 1 4 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 25805 1 5 '3D HN(CO)CA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25805 1 6 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25805 1 7 '3D HNCACO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25805 1 8 '3D HBHA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25805 1 9 '3D HCCH-TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 25805 1 10 '3D H(CCO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 25805 1 11 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 25805 1 12 '2D 1H-13C HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 25805 1 13 '3D 1H-13C NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 25805 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 25805 _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 internal indirect 0.251449530 . . . . . 25805 1 H 1 DSS 'methyl protons' . . . . ppm 0 internal direct 1 . . . . . 25805 1 N 15 DSS 'methyl protons' . . . . ppm 0 internal indirect 0.101329118 . . . . . 25805 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 25805 _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 25805 1 2 '3D HNCACB' 1 $sample_1 isotropic 25805 1 4 '3D HNCA' 1 $sample_1 isotropic 25805 1 6 '3D HNCO' 1 $sample_1 isotropic 25805 1 11 '3D 1H-15N NOESY' 1 $sample_1 isotropic 25805 1 12 '2D 1H-13C HSQC' 1 $sample_1 isotropic 25805 1 13 '3D 1H-13C NOESY' 1 $sample_1 isotropic 25805 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 24 24 ARG H H 1 8.067 0.020 . 1 . . . A 24 ARG H . 25805 1 2 . 1 1 24 24 ARG HA H 1 3.542 0.020 . 1 . . . A 24 ARG HA . 25805 1 3 . 1 1 24 24 ARG HB2 H 1 1.654 0.020 . 2 . . . A 24 ARG HB2 . 25805 1 4 . 1 1 24 24 ARG HB3 H 1 1.546 0.020 . 2 . . . A 24 ARG HB3 . 25805 1 5 . 1 1 24 24 ARG HG2 H 1 1.351 0.020 . 2 . . . A 24 ARG HG2 . 25805 1 6 . 1 1 24 24 ARG HG3 H 1 1.480 0.020 . 2 . . . A 24 ARG HG3 . 25805 1 7 . 1 1 24 24 ARG HD2 H 1 2.955 0.020 . 2 . . . A 24 ARG HD2 . 25805 1 8 . 1 1 24 24 ARG HD3 H 1 2.955 0.020 . 2 . . . A 24 ARG HD3 . 25805 1 9 . 1 1 24 24 ARG C C 13 178.202 0.400 . 1 . . . A 24 ARG C . 25805 1 10 . 1 1 24 24 ARG CA C 13 60.603 0.400 . 1 . . . A 24 ARG CA . 25805 1 11 . 1 1 24 24 ARG CB C 13 30.020 0.400 . 1 . . . A 24 ARG CB . 25805 1 12 . 1 1 24 24 ARG CG C 13 27.839 0.400 . 1 . . . A 24 ARG CG . 25805 1 13 . 1 1 24 24 ARG CD C 13 44.292 0.400 . 1 . . . A 24 ARG CD . 25805 1 14 . 1 1 24 24 ARG N N 15 118.989 0.400 . 1 . . . A 24 ARG N . 25805 1 15 . 1 1 25 25 SER H H 1 7.702 0.020 . 1 . . . A 25 SER H . 25805 1 16 . 1 1 25 25 SER HA H 1 4.180 0.020 . 1 . . . A 25 SER HA . 25805 1 17 . 1 1 25 25 SER HB2 H 1 3.920 0.020 . 2 . . . A 25 SER HB2 . 25805 1 18 . 1 1 25 25 SER HB3 H 1 3.920 0.020 . 2 . . . A 25 SER HB3 . 25805 1 19 . 1 1 25 25 SER C C 13 176.898 0.400 . 1 . . . A 25 SER C . 25805 1 20 . 1 1 25 25 SER CA C 13 61.511 0.400 . 1 . . . A 25 SER CA . 25805 1 21 . 1 1 25 25 SER CB C 13 63.264 0.400 . 1 . . . A 25 SER CB . 25805 1 22 . 1 1 25 25 SER N N 15 112.977 0.400 . 1 . . . A 25 SER N . 25805 1 23 . 1 1 26 26 LEU H H 1 7.594 0.020 . 1 . . . A 26 LEU H . 25805 1 24 . 1 1 26 26 LEU HA H 1 4.040 0.020 . 1 . . . A 26 LEU HA . 25805 1 25 . 1 1 26 26 LEU HB2 H 1 1.438 0.020 . 2 . . . A 26 LEU HB2 . 25805 1 26 . 1 1 26 26 LEU HB3 H 1 1.212 0.020 . 2 . . . A 26 LEU HB3 . 25805 1 27 . 1 1 26 26 LEU C C 13 179.932 0.400 . 1 . . . A 26 LEU C . 25805 1 28 . 1 1 26 26 LEU CA C 13 57.958 0.400 . 1 . . . A 26 LEU CA . 25805 1 29 . 1 1 26 26 LEU CB C 13 42.447 0.400 . 1 . . . A 26 LEU CB . 25805 1 30 . 1 1 26 26 LEU N N 15 121.751 0.400 . 1 . . . A 26 LEU N . 25805 1 31 . 1 1 27 27 LEU H H 1 7.811 0.020 . 1 . . . A 27 LEU H . 25805 1 32 . 1 1 27 27 LEU HA H 1 3.580 0.020 . 1 . . . A 27 LEU HA . 25805 1 33 . 1 1 27 27 LEU HB2 H 1 0.935 0.020 . 2 . . . A 27 LEU HB2 . 25805 1 34 . 1 1 27 27 LEU HB3 H 1 0.935 0.020 . 2 . . . A 27 LEU HB3 . 25805 1 35 . 1 1 27 27 LEU HG H 1 0.897 0.020 . 1 . . . A 27 LEU HG . 25805 1 36 . 1 1 27 27 LEU HD11 H 1 -0.251 0.020 . 2 . . . A 27 LEU HD11 . 25805 1 37 . 1 1 27 27 LEU HD12 H 1 -0.251 0.020 . 2 . . . A 27 LEU HD12 . 25805 1 38 . 1 1 27 27 LEU HD13 H 1 -0.251 0.020 . 2 . . . A 27 LEU HD13 . 25805 1 39 . 1 1 27 27 LEU HD21 H 1 0.290 0.020 . 2 . . . A 27 LEU HD21 . 25805 1 40 . 1 1 27 27 LEU HD22 H 1 0.290 0.020 . 2 . . . A 27 LEU HD22 . 25805 1 41 . 1 1 27 27 LEU HD23 H 1 0.290 0.020 . 2 . . . A 27 LEU HD23 . 25805 1 42 . 1 1 27 27 LEU C C 13 178.605 0.400 . 1 . . . A 27 LEU C . 25805 1 43 . 1 1 27 27 LEU CA C 13 57.596 0.400 . 1 . . . A 27 LEU CA . 25805 1 44 . 1 1 27 27 LEU CB C 13 41.665 0.400 . 1 . . . A 27 LEU CB . 25805 1 45 . 1 1 27 27 LEU CG C 13 25.103 0.400 . 1 . . . A 27 LEU CG . 25805 1 46 . 1 1 27 27 LEU CD1 C 13 22.374 0.400 . 1 . . . A 27 LEU CD1 . 25805 1 47 . 1 1 27 27 LEU CD2 C 13 26.030 0.400 . 1 . . . A 27 LEU CD2 . 25805 1 48 . 1 1 27 27 LEU N N 15 117.035 0.400 . 1 . . . A 27 LEU N . 25805 1 49 . 1 1 28 28 GLN H H 1 7.520 0.020 . 1 . . . A 28 GLN H . 25805 1 50 . 1 1 28 28 GLN HA H 1 3.855 0.020 . 1 . . . A 28 GLN HA . 25805 1 51 . 1 1 28 28 GLN HB2 H 1 1.947 0.020 . 2 . . . A 28 GLN HB2 . 25805 1 52 . 1 1 28 28 GLN HB3 H 1 1.781 0.020 . 2 . . . A 28 GLN HB3 . 25805 1 53 . 1 1 28 28 GLN HG2 H 1 2.141 0.020 . 2 . . . A 28 GLN HG2 . 25805 1 54 . 1 1 28 28 GLN HG3 H 1 2.096 0.020 . 2 . . . A 28 GLN HG3 . 25805 1 55 . 1 1 28 28 GLN C C 13 176.945 0.400 . 1 . . . A 28 GLN C . 25805 1 56 . 1 1 28 28 GLN CA C 13 58.053 0.400 . 1 . . . A 28 GLN CA . 25805 1 57 . 1 1 28 28 GLN CB C 13 29.182 0.400 . 1 . . . A 28 GLN CB . 25805 1 58 . 1 1 28 28 GLN CG C 13 34.375 0.400 . 1 . . . A 28 GLN CG . 25805 1 59 . 1 1 28 28 GLN N N 15 114.141 0.400 . 1 . . . A 28 GLN N . 25805 1 60 . 1 1 29 29 HIS H H 1 7.306 0.020 . 1 . . . A 29 HIS H . 25805 1 61 . 1 1 29 29 HIS HA H 1 4.713 0.020 . 1 . . . A 29 HIS HA . 25805 1 62 . 1 1 29 29 HIS HB2 H 1 3.386 0.020 . 2 . . . A 29 HIS HB2 . 25805 1 63 . 1 1 29 29 HIS HB3 H 1 2.992 0.020 . 2 . . . A 29 HIS HB3 . 25805 1 64 . 1 1 29 29 HIS C C 13 175.073 0.400 . 1 . . . A 29 HIS C . 25805 1 65 . 1 1 29 29 HIS CA C 13 56.487 0.400 . 1 . . . A 29 HIS CA . 25805 1 66 . 1 1 29 29 HIS CB C 13 31.719 0.400 . 1 . . . A 29 HIS CB . 25805 1 67 . 1 1 29 29 HIS N N 15 114.104 0.400 . 1 . . . A 29 HIS N . 25805 1 68 . 1 1 30 30 CYS H H 1 7.829 0.020 . 1 . . . A 30 CYS H . 25805 1 69 . 1 1 30 30 CYS HA H 1 4.628 0.020 . 1 . . . A 30 CYS HA . 25805 1 70 . 1 1 30 30 CYS HB2 H 1 2.920 0.020 . 2 . . . A 30 CYS HB2 . 25805 1 71 . 1 1 30 30 CYS HB3 H 1 2.887 0.020 . 2 . . . A 30 CYS HB3 . 25805 1 72 . 1 1 30 30 CYS CA C 13 59.497 0.400 . 1 . . . A 30 CYS CA . 25805 1 73 . 1 1 30 30 CYS CB C 13 27.678 0.400 . 1 . . . A 30 CYS CB . 25805 1 74 . 1 1 30 30 CYS N N 15 122.060 0.400 . 1 . . . A 30 CYS N . 25805 1 75 . 1 1 32 32 PRO HA H 1 4.260 0.020 . 1 . . . A 32 PRO HA . 25805 1 76 . 1 1 32 32 PRO HB2 H 1 1.019 0.020 . 2 . . . A 32 PRO HB2 . 25805 1 77 . 1 1 32 32 PRO HB3 H 1 1.019 0.020 . 2 . . . A 32 PRO HB3 . 25805 1 78 . 1 1 32 32 PRO HD2 H 1 4.029 0.020 . 2 . . . A 32 PRO HD2 . 25805 1 79 . 1 1 32 32 PRO HD3 H 1 3.649 0.020 . 2 . . . A 32 PRO HD3 . 25805 1 80 . 1 1 32 32 PRO C C 13 176.258 0.400 . 1 . . . A 32 PRO C . 25805 1 81 . 1 1 32 32 PRO CA C 13 66.005 0.400 . 1 . . . A 32 PRO CA . 25805 1 82 . 1 1 32 32 PRO CB C 13 31.226 0.400 . 1 . . . A 32 PRO CB . 25805 1 83 . 1 1 32 32 PRO CD C 13 50.396 0.400 . 1 . . . A 32 PRO CD . 25805 1 84 . 1 1 33 33 PHE H H 1 7.606 0.020 . 1 . . . A 33 PHE H . 25805 1 85 . 1 1 33 33 PHE HA H 1 4.775 0.020 . 1 . . . A 33 PHE HA . 25805 1 86 . 1 1 33 33 PHE HB2 H 1 3.000 0.020 . 2 . . . A 33 PHE HB2 . 25805 1 87 . 1 1 33 33 PHE HB3 H 1 3.154 0.020 . 2 . . . A 33 PHE HB3 . 25805 1 88 . 1 1 33 33 PHE HD1 H 1 7.071 0.020 . 3 . . . A 33 PHE HD1 . 25805 1 89 . 1 1 33 33 PHE HD2 H 1 7.071 0.020 . 3 . . . A 33 PHE HD2 . 25805 1 90 . 1 1 33 33 PHE C C 13 176.637 0.400 . 1 . . . A 33 PHE C . 25805 1 91 . 1 1 33 33 PHE CA C 13 58.741 0.400 . 1 . . . A 33 PHE CA . 25805 1 92 . 1 1 33 33 PHE CB C 13 39.571 0.400 . 1 . . . A 33 PHE CB . 25805 1 93 . 1 1 33 33 PHE N N 15 111.750 0.400 . 1 . . . A 33 PHE N . 25805 1 94 . 1 1 34 34 ARG H H 1 7.744 0.020 . 1 . . . A 34 ARG H . 25805 1 95 . 1 1 34 34 ARG HA H 1 4.072 0.020 . 1 . . . A 34 ARG HA . 25805 1 96 . 1 1 34 34 ARG HB2 H 1 1.885 0.020 . 2 . . . A 34 ARG HB2 . 25805 1 97 . 1 1 34 34 ARG HB3 H 1 1.843 0.020 . 2 . . . A 34 ARG HB3 . 25805 1 98 . 1 1 34 34 ARG HG2 H 1 1.732 0.020 . 2 . . . A 34 ARG HG2 . 25805 1 99 . 1 1 34 34 ARG HG3 H 1 1.732 0.020 . 2 . . . A 34 ARG HG3 . 25805 1 100 . 1 1 34 34 ARG HD2 H 1 3.218 0.020 . 2 . . . A 34 ARG HD2 . 25805 1 101 . 1 1 34 34 ARG HD3 H 1 3.196 0.020 . 2 . . . A 34 ARG HD3 . 25805 1 102 . 1 1 34 34 ARG C C 13 177.491 0.400 . 1 . . . A 34 ARG C . 25805 1 103 . 1 1 34 34 ARG CA C 13 58.962 0.400 . 1 . . . A 34 ARG CA . 25805 1 104 . 1 1 34 34 ARG CB C 13 30.571 0.400 . 1 . . . A 34 ARG CB . 25805 1 105 . 1 1 34 34 ARG CG C 13 27.539 0.400 . 1 . . . A 34 ARG CG . 25805 1 106 . 1 1 34 34 ARG CD C 13 44.066 0.400 . 1 . . . A 34 ARG CD . 25805 1 107 . 1 1 34 34 ARG N N 15 120.268 0.400 . 1 . . . A 34 ARG N . 25805 1 108 . 1 1 35 35 GLY H H 1 8.423 0.020 . 1 . . . A 35 GLY H . 25805 1 109 . 1 1 35 35 GLY HA2 H 1 3.854 0.020 . 2 . . . A 35 GLY HA2 . 25805 1 110 . 1 1 35 35 GLY HA3 H 1 3.718 0.020 . 2 . . . A 35 GLY HA3 . 25805 1 111 . 1 1 35 35 GLY C C 13 174.670 0.400 . 1 . . . A 35 GLY C . 25805 1 112 . 1 1 35 35 GLY CA C 13 45.153 0.400 . 1 . . . A 35 GLY CA . 25805 1 113 . 1 1 35 35 GLY N N 15 108.192 0.400 . 1 . . . A 35 GLY N . 25805 1 114 . 1 1 36 36 ALA H H 1 7.391 0.020 . 1 . . . A 36 ALA H . 25805 1 115 . 1 1 36 36 ALA HA H 1 3.779 0.020 . 1 . . . A 36 ALA HA . 25805 1 116 . 1 1 36 36 ALA HB1 H 1 0.785 0.020 . 1 . . . A 36 ALA HB1 . 25805 1 117 . 1 1 36 36 ALA HB2 H 1 0.785 0.020 . 1 . . . A 36 ALA HB2 . 25805 1 118 . 1 1 36 36 ALA HB3 H 1 0.785 0.020 . 1 . . . A 36 ALA HB3 . 25805 1 119 . 1 1 36 36 ALA C C 13 177.870 0.400 . 1 . . . A 36 ALA C . 25805 1 120 . 1 1 36 36 ALA CA C 13 52.208 0.400 . 1 . . . A 36 ALA CA . 25805 1 121 . 1 1 36 36 ALA CB C 13 19.354 0.400 . 1 . . . A 36 ALA CB . 25805 1 122 . 1 1 36 36 ALA N N 15 123.790 0.400 . 1 . . . A 36 ALA N . 25805 1 123 . 1 1 37 37 THR H H 1 8.019 0.020 . 1 . . . A 37 THR H . 25805 1 124 . 1 1 37 37 THR HA H 1 4.270 0.020 . 1 . . . A 37 THR HA . 25805 1 125 . 1 1 37 37 THR HB H 1 4.525 0.020 . 1 . . . A 37 THR HB . 25805 1 126 . 1 1 37 37 THR HG21 H 1 1.341 0.020 . 1 . . . A 37 THR HG21 . 25805 1 127 . 1 1 37 37 THR HG22 H 1 1.341 0.020 . 1 . . . A 37 THR HG22 . 25805 1 128 . 1 1 37 37 THR HG23 H 1 1.341 0.020 . 1 . . . A 37 THR HG23 . 25805 1 129 . 1 1 37 37 THR C C 13 175.515 0.400 . 1 . . . A 37 THR C . 25805 1 130 . 1 1 37 37 THR CA C 13 60.948 0.400 . 1 . . . A 37 THR CA . 25805 1 131 . 1 1 37 37 THR CB C 13 71.511 0.400 . 1 . . . A 37 THR CB . 25805 1 132 . 1 1 37 37 THR CG2 C 13 22.679 0.400 . 1 . . . A 37 THR CG2 . 25805 1 133 . 1 1 37 37 THR N N 15 111.901 0.400 . 1 . . . A 37 THR N . 25805 1 134 . 1 1 38 38 LYS H H 1 8.819 0.020 . 1 . . . A 38 LYS H . 25805 1 135 . 1 1 38 38 LYS HA H 1 4.746 0.020 . 1 . . . A 38 LYS HA . 25805 1 136 . 1 1 38 38 LYS HB2 H 1 1.890 0.020 . 2 . . . A 38 LYS HB2 . 25805 1 137 . 1 1 38 38 LYS HB3 H 1 1.709 0.020 . 2 . . . A 38 LYS HB3 . 25805 1 138 . 1 1 38 38 LYS HG2 H 1 1.564 0.020 . 2 . . . A 38 LYS HG2 . 25805 1 139 . 1 1 38 38 LYS HG3 H 1 1.564 0.020 . 2 . . . A 38 LYS HG3 . 25805 1 140 . 1 1 38 38 LYS HD2 H 1 1.664 0.020 . 2 . . . A 38 LYS HD2 . 25805 1 141 . 1 1 38 38 LYS HD3 H 1 1.664 0.020 . 2 . . . A 38 LYS HD3 . 25805 1 142 . 1 1 38 38 LYS HE2 H 1 3.232 0.020 . 2 . . . A 38 LYS HE2 . 25805 1 143 . 1 1 38 38 LYS HE3 H 1 3.232 0.020 . 2 . . . A 38 LYS HE3 . 25805 1 144 . 1 1 38 38 LYS C C 13 175.902 0.400 . 1 . . . A 38 LYS C . 25805 1 145 . 1 1 38 38 LYS CA C 13 53.103 0.400 . 1 . . . A 38 LYS CA . 25805 1 146 . 1 1 38 38 LYS CB C 13 31.336 0.400 . 1 . . . A 38 LYS CB . 25805 1 147 . 1 1 38 38 LYS CG C 13 25.988 0.400 . 1 . . . A 38 LYS CG . 25805 1 148 . 1 1 38 38 LYS CD C 13 27.048 0.400 . 1 . . . A 38 LYS CD . 25805 1 149 . 1 1 38 38 LYS CE C 13 43.277 0.400 . 1 . . . A 38 LYS CE . 25805 1 150 . 1 1 38 38 LYS N N 15 120.923 0.400 . 1 . . . A 38 LYS N . 25805 1 151 . 1 1 39 39 GLY CA C 13 47.243 0.400 . 1 . . . A 39 GLY CA . 25805 1 152 . 1 1 40 40 CYS H H 1 7.009 0.020 . 1 . . . A 40 CYS H . 25805 1 153 . 1 1 40 40 CYS HA H 1 3.204 0.020 . 1 . . . A 40 CYS HA . 25805 1 154 . 1 1 40 40 CYS HB2 H 1 2.259 0.020 . 2 . . . A 40 CYS HB2 . 25805 1 155 . 1 1 40 40 CYS C C 13 175.973 0.400 . 1 . . . A 40 CYS C . 25805 1 156 . 1 1 40 40 CYS CA C 13 61.629 0.400 . 1 . . . A 40 CYS CA . 25805 1 157 . 1 1 40 40 CYS CB C 13 26.661 0.400 . 1 . . . A 40 CYS CB . 25805 1 158 . 1 1 40 40 CYS N N 15 123.617 0.400 . 1 . . . A 40 CYS N . 25805 1 159 . 1 1 41 41 LEU H H 1 7.992 0.020 . 1 . . . A 41 LEU H . 25805 1 160 . 1 1 41 41 LEU HA H 1 3.665 0.020 . 1 . . . A 41 LEU HA . 25805 1 161 . 1 1 41 41 LEU HB2 H 1 1.542 0.020 . 2 . . . A 41 LEU HB2 . 25805 1 162 . 1 1 41 41 LEU HB3 H 1 1.285 0.020 . 2 . . . A 41 LEU HB3 . 25805 1 163 . 1 1 41 41 LEU HG H 1 1.407 0.020 . 1 . . . A 41 LEU HG . 25805 1 164 . 1 1 41 41 LEU HD11 H 1 0.707 0.020 . 2 . . . A 41 LEU HD11 . 25805 1 165 . 1 1 41 41 LEU HD12 H 1 0.707 0.020 . 2 . . . A 41 LEU HD12 . 25805 1 166 . 1 1 41 41 LEU HD13 H 1 0.707 0.020 . 2 . . . A 41 LEU HD13 . 25805 1 167 . 1 1 41 41 LEU HD21 H 1 0.674 0.020 . 2 . . . A 41 LEU HD21 . 25805 1 168 . 1 1 41 41 LEU HD22 H 1 0.674 0.020 . 2 . . . A 41 LEU HD22 . 25805 1 169 . 1 1 41 41 LEU HD23 H 1 0.674 0.020 . 2 . . . A 41 LEU HD23 . 25805 1 170 . 1 1 41 41 LEU C C 13 179.103 0.400 . 1 . . . A 41 LEU C . 25805 1 171 . 1 1 41 41 LEU CA C 13 58.292 0.400 . 1 . . . A 41 LEU CA . 25805 1 172 . 1 1 41 41 LEU CB C 13 42.068 0.400 . 1 . . . A 41 LEU CB . 25805 1 173 . 1 1 41 41 LEU CG C 13 26.920 0.400 . 1 . . . A 41 LEU CG . 25805 1 174 . 1 1 41 41 LEU CD1 C 13 24.972 0.400 . 1 . . . A 41 LEU CD1 . 25805 1 175 . 1 1 41 41 LEU CD2 C 13 24.029 0.400 . 1 . . . A 41 LEU CD2 . 25805 1 176 . 1 1 41 41 LEU N N 15 117.824 0.400 . 1 . . . A 41 LEU N . 25805 1 177 . 1 1 42 42 ARG H H 1 7.932 0.020 . 1 . . . A 42 ARG H . 25805 1 178 . 1 1 42 42 ARG HA H 1 3.792 0.020 . 1 . . . A 42 ARG HA . 25805 1 179 . 1 1 42 42 ARG HB2 H 1 1.827 0.020 . 2 . . . A 42 ARG HB2 . 25805 1 180 . 1 1 42 42 ARG HB3 H 1 1.827 0.020 . 2 . . . A 42 ARG HB3 . 25805 1 181 . 1 1 42 42 ARG HG2 H 1 1.566 0.020 . 2 . . . A 42 ARG HG2 . 25805 1 182 . 1 1 42 42 ARG HG3 H 1 1.433 0.020 . 2 . . . A 42 ARG HG3 . 25805 1 183 . 1 1 42 42 ARG HD2 H 1 3.082 0.020 . 2 . . . A 42 ARG HD2 . 25805 1 184 . 1 1 42 42 ARG HD3 H 1 3.082 0.020 . 2 . . . A 42 ARG HD3 . 25805 1 185 . 1 1 42 42 ARG C C 13 177.917 0.400 . 1 . . . A 42 ARG C . 25805 1 186 . 1 1 42 42 ARG CA C 13 60.014 0.400 . 1 . . . A 42 ARG CA . 25805 1 187 . 1 1 42 42 ARG CB C 13 30.344 0.400 . 1 . . . A 42 ARG CB . 25805 1 188 . 1 1 42 42 ARG CG C 13 28.155 0.400 . 1 . . . A 42 ARG CG . 25805 1 189 . 1 1 42 42 ARG CD C 13 43.857 0.400 . 1 . . . A 42 ARG CD . 25805 1 190 . 1 1 42 42 ARG N N 15 117.992 0.400 . 1 . . . A 42 ARG N . 25805 1 191 . 1 1 43 43 ALA H H 1 7.576 0.020 . 1 . . . A 43 ALA H . 25805 1 192 . 1 1 43 43 ALA HA H 1 4.073 0.020 . 1 . . . A 43 ALA HA . 25805 1 193 . 1 1 43 43 ALA HB1 H 1 1.581 0.020 . 1 . . . A 43 ALA HB1 . 25805 1 194 . 1 1 43 43 ALA HB2 H 1 1.581 0.020 . 1 . . . A 43 ALA HB2 . 25805 1 195 . 1 1 43 43 ALA HB3 H 1 1.581 0.020 . 1 . . . A 43 ALA HB3 . 25805 1 196 . 1 1 43 43 ALA C C 13 181.307 0.400 . 1 . . . A 43 ALA C . 25805 1 197 . 1 1 43 43 ALA CA C 13 55.324 0.400 . 1 . . . A 43 ALA CA . 25805 1 198 . 1 1 43 43 ALA CB C 13 19.020 0.400 . 1 . . . A 43 ALA CB . 25805 1 199 . 1 1 43 43 ALA N N 15 120.834 0.400 . 1 . . . A 43 ALA N . 25805 1 200 . 1 1 44 44 LEU H H 1 8.411 0.020 . 1 . . . A 44 LEU H . 25805 1 201 . 1 1 44 44 LEU HA H 1 3.836 0.020 . 1 . . . A 44 LEU HA . 25805 1 202 . 1 1 44 44 LEU HB2 H 1 1.866 0.020 . 2 . . . A 44 LEU HB2 . 25805 1 203 . 1 1 44 44 LEU HB3 H 1 1.866 0.020 . 2 . . . A 44 LEU HB3 . 25805 1 204 . 1 1 44 44 LEU HG H 1 1.790 0.020 . 1 . . . A 44 LEU HG . 25805 1 205 . 1 1 44 44 LEU HD11 H 1 0.598 0.020 . 2 . . . A 44 LEU HD11 . 25805 1 206 . 1 1 44 44 LEU HD12 H 1 0.598 0.020 . 2 . . . A 44 LEU HD12 . 25805 1 207 . 1 1 44 44 LEU HD13 H 1 0.598 0.020 . 2 . . . A 44 LEU HD13 . 25805 1 208 . 1 1 44 44 LEU HD21 H 1 0.663 0.020 . 2 . . . A 44 LEU HD21 . 25805 1 209 . 1 1 44 44 LEU HD22 H 1 0.663 0.020 . 2 . . . A 44 LEU HD22 . 25805 1 210 . 1 1 44 44 LEU HD23 H 1 0.663 0.020 . 2 . . . A 44 LEU HD23 . 25805 1 211 . 1 1 44 44 LEU C C 13 179.648 0.400 . 1 . . . A 44 LEU C . 25805 1 212 . 1 1 44 44 LEU CA C 13 58.203 0.400 . 1 . . . A 44 LEU CA . 25805 1 213 . 1 1 44 44 LEU CB C 13 43.500 0.400 . 1 . . . A 44 LEU CB . 25805 1 214 . 1 1 44 44 LEU CG C 13 28.064 0.400 . 1 . . . A 44 LEU CG . 25805 1 215 . 1 1 44 44 LEU CD1 C 13 27.238 0.400 . 1 . . . A 44 LEU CD1 . 25805 1 216 . 1 1 44 44 LEU CD2 C 13 23.994 0.400 . 1 . . . A 44 LEU CD2 . 25805 1 217 . 1 1 44 44 LEU N N 15 116.783 0.400 . 1 . . . A 44 LEU N . 25805 1 218 . 1 1 45 45 ALA H H 1 8.532 0.020 . 1 . . . A 45 ALA H . 25805 1 219 . 1 1 45 45 ALA HA H 1 3.864 0.020 . 1 . . . A 45 ALA HA . 25805 1 220 . 1 1 45 45 ALA HB1 H 1 1.352 0.020 . 1 . . . A 45 ALA HB1 . 25805 1 221 . 1 1 45 45 ALA HB2 H 1 1.352 0.020 . 1 . . . A 45 ALA HB2 . 25805 1 222 . 1 1 45 45 ALA HB3 H 1 1.352 0.020 . 1 . . . A 45 ALA HB3 . 25805 1 223 . 1 1 45 45 ALA C C 13 179.316 0.400 . 1 . . . A 45 ALA C . 25805 1 224 . 1 1 45 45 ALA CA C 13 55.788 0.400 . 1 . . . A 45 ALA CA . 25805 1 225 . 1 1 45 45 ALA CB C 13 18.757 0.400 . 1 . . . A 45 ALA CB . 25805 1 226 . 1 1 45 45 ALA N N 15 120.637 0.400 . 1 . . . A 45 ALA N . 25805 1 227 . 1 1 46 46 MET H H 1 7.476 0.020 . 1 . . . A 46 MET H . 25805 1 228 . 1 1 46 46 MET HA H 1 4.265 0.020 . 1 . . . A 46 MET HA . 25805 1 229 . 1 1 46 46 MET HB2 H 1 2.097 0.020 . 2 . . . A 46 MET HB2 . 25805 1 230 . 1 1 46 46 MET HB3 H 1 2.097 0.020 . 2 . . . A 46 MET HB3 . 25805 1 231 . 1 1 46 46 MET HG2 H 1 2.690 0.020 . 2 . . . A 46 MET HG2 . 25805 1 232 . 1 1 46 46 MET HG3 H 1 2.407 0.020 . 2 . . . A 46 MET HG3 . 25805 1 233 . 1 1 46 46 MET HE1 H 1 1.984 0.020 . 1 . . . A 46 MET HE1 . 25805 1 234 . 1 1 46 46 MET HE2 H 1 1.984 0.020 . 1 . . . A 46 MET HE2 . 25805 1 235 . 1 1 46 46 MET HE3 H 1 1.984 0.020 . 1 . . . A 46 MET HE3 . 25805 1 236 . 1 1 46 46 MET C C 13 177.965 0.400 . 1 . . . A 46 MET C . 25805 1 237 . 1 1 46 46 MET CA C 13 57.356 0.400 . 1 . . . A 46 MET CA . 25805 1 238 . 1 1 46 46 MET CB C 13 33.163 0.400 . 1 . . . A 46 MET CB . 25805 1 239 . 1 1 46 46 MET CG C 13 32.572 0.400 . 1 . . . A 46 MET CG . 25805 1 240 . 1 1 46 46 MET CE C 13 17.067 0.400 . 1 . . . A 46 MET CE . 25805 1 241 . 1 1 46 46 MET N N 15 111.791 0.400 . 1 . . . A 46 MET N . 25805 1 242 . 1 1 47 47 LYS H H 1 7.664 0.020 . 1 . . . A 47 LYS H . 25805 1 243 . 1 1 47 47 LYS HA H 1 4.446 0.020 . 1 . . . A 47 LYS HA . 25805 1 244 . 1 1 47 47 LYS HB2 H 1 1.784 0.020 . 2 . . . A 47 LYS HB2 . 25805 1 245 . 1 1 47 47 LYS HB3 H 1 1.961 0.020 . 2 . . . A 47 LYS HB3 . 25805 1 246 . 1 1 47 47 LYS HG2 H 1 1.231 0.020 . 2 . . . A 47 LYS HG2 . 25805 1 247 . 1 1 47 47 LYS HG3 H 1 1.231 0.020 . 2 . . . A 47 LYS HG3 . 25805 1 248 . 1 1 47 47 LYS HD2 H 1 1.321 0.020 . 2 . . . A 47 LYS HD2 . 25805 1 249 . 1 1 47 47 LYS HD3 H 1 1.321 0.020 . 2 . . . A 47 LYS HD3 . 25805 1 250 . 1 1 47 47 LYS HE2 H 1 2.959 0.020 . 2 . . . A 47 LYS HE2 . 25805 1 251 . 1 1 47 47 LYS HE3 H 1 2.959 0.020 . 2 . . . A 47 LYS HE3 . 25805 1 252 . 1 1 47 47 LYS C C 13 177.704 0.400 . 1 . . . A 47 LYS C . 25805 1 253 . 1 1 47 47 LYS CA C 13 54.914 0.400 . 1 . . . A 47 LYS CA . 25805 1 254 . 1 1 47 47 LYS CB C 13 34.170 0.400 . 1 . . . A 47 LYS CB . 25805 1 255 . 1 1 47 47 LYS CG C 13 24.775 0.400 . 1 . . . A 47 LYS CG . 25805 1 256 . 1 1 47 47 LYS CD C 13 28.459 0.400 . 1 . . . A 47 LYS CD . 25805 1 257 . 1 1 47 47 LYS CE C 13 42.465 0.400 . 1 . . . A 47 LYS CE . 25805 1 258 . 1 1 47 47 LYS N N 15 115.813 0.400 . 1 . . . A 47 LYS N . 25805 1 259 . 1 1 48 48 PHE H H 1 7.665 0.020 . 1 . . . A 48 PHE H . 25805 1 260 . 1 1 48 48 PHE HA H 1 4.487 0.020 . 1 . . . A 48 PHE HA . 25805 1 261 . 1 1 48 48 PHE HB2 H 1 2.973 0.020 . 2 . . . A 48 PHE HB2 . 25805 1 262 . 1 1 48 48 PHE HB3 H 1 3.029 0.020 . 2 . . . A 48 PHE HB3 . 25805 1 263 . 1 1 48 48 PHE HD1 H 1 7.135 0.020 . 3 . . . A 48 PHE HD1 . 25805 1 264 . 1 1 48 48 PHE HD2 H 1 7.135 0.020 . 3 . . . A 48 PHE HD2 . 25805 1 265 . 1 1 48 48 PHE C C 13 177.064 0.400 . 1 . . . A 48 PHE C . 25805 1 266 . 1 1 48 48 PHE CA C 13 60.403 0.400 . 1 . . . A 48 PHE CA . 25805 1 267 . 1 1 48 48 PHE CB C 13 41.930 0.400 . 1 . . . A 48 PHE CB . 25805 1 268 . 1 1 48 48 PHE N N 15 121.042 0.400 . 1 . . . A 48 PHE N . 25805 1 269 . 1 1 49 49 LYS H H 1 9.383 0.020 . 1 . . . A 49 LYS H . 25805 1 270 . 1 1 49 49 LYS HA H 1 4.896 0.020 . 1 . . . A 49 LYS HA . 25805 1 271 . 1 1 49 49 LYS HB2 H 1 1.944 0.020 . 2 . . . A 49 LYS HB2 . 25805 1 272 . 1 1 49 49 LYS HB3 H 1 1.944 0.020 . 2 . . . A 49 LYS HB3 . 25805 1 273 . 1 1 49 49 LYS HD2 H 1 1.702 0.020 . 2 . . . A 49 LYS HD2 . 25805 1 274 . 1 1 49 49 LYS HD3 H 1 1.702 0.020 . 2 . . . A 49 LYS HD3 . 25805 1 275 . 1 1 49 49 LYS C C 13 176.993 0.400 . 1 . . . A 49 LYS C . 25805 1 276 . 1 1 49 49 LYS CA C 13 54.754 0.400 . 1 . . . A 49 LYS CA . 25805 1 277 . 1 1 49 49 LYS CB C 13 35.133 0.400 . 1 . . . A 49 LYS CB . 25805 1 278 . 1 1 49 49 LYS CD C 13 29.256 0.400 . 1 . . . A 49 LYS CD . 25805 1 279 . 1 1 49 49 LYS N N 15 121.377 0.400 . 1 . . . A 49 LYS N . 25805 1 280 . 1 1 50 50 THR H H 1 8.870 0.020 . 1 . . . A 50 THR H . 25805 1 281 . 1 1 50 50 THR HA H 1 5.262 0.020 . 1 . . . A 50 THR HA . 25805 1 282 . 1 1 50 50 THR HB H 1 3.934 0.020 . 1 . . . A 50 THR HB . 25805 1 283 . 1 1 50 50 THR HG21 H 1 0.907 0.020 . 1 . . . A 50 THR HG21 . 25805 1 284 . 1 1 50 50 THR HG22 H 1 0.907 0.020 . 1 . . . A 50 THR HG22 . 25805 1 285 . 1 1 50 50 THR HG23 H 1 0.907 0.020 . 1 . . . A 50 THR HG23 . 25805 1 286 . 1 1 50 50 THR C C 13 174.504 0.400 . 1 . . . A 50 THR C . 25805 1 287 . 1 1 50 50 THR CA C 13 62.763 0.400 . 1 . . . A 50 THR CA . 25805 1 288 . 1 1 50 50 THR CB C 13 71.042 0.400 . 1 . . . A 50 THR CB . 25805 1 289 . 1 1 50 50 THR CG2 C 13 21.829 0.400 . 1 . . . A 50 THR CG2 . 25805 1 290 . 1 1 50 50 THR N N 15 121.030 0.400 . 1 . . . A 50 THR N . 25805 1 291 . 1 1 51 51 THR H H 1 9.173 0.020 . 1 . . . A 51 THR H . 25805 1 292 . 1 1 51 51 THR HA H 1 4.487 0.020 . 1 . . . A 51 THR HA . 25805 1 293 . 1 1 51 51 THR HB H 1 3.887 0.020 . 1 . . . A 51 THR HB . 25805 1 294 . 1 1 51 51 THR HG21 H 1 1.170 0.020 . 1 . . . A 51 THR HG21 . 25805 1 295 . 1 1 51 51 THR HG22 H 1 1.170 0.020 . 1 . . . A 51 THR HG22 . 25805 1 296 . 1 1 51 51 THR HG23 H 1 1.170 0.020 . 1 . . . A 51 THR HG23 . 25805 1 297 . 1 1 51 51 THR C C 13 172.038 0.400 . 1 . . . A 51 THR C . 25805 1 298 . 1 1 51 51 THR CA C 13 61.412 0.400 . 1 . . . A 51 THR CA . 25805 1 299 . 1 1 51 51 THR CB C 13 72.292 0.400 . 1 . . . A 51 THR CB . 25805 1 300 . 1 1 51 51 THR CG2 C 13 21.515 0.400 . 1 . . . A 51 THR CG2 . 25805 1 301 . 1 1 51 51 THR N N 15 123.161 0.400 . 1 . . . A 51 THR N . 25805 1 302 . 1 1 52 52 HIS H H 1 8.702 0.020 . 1 . . . A 52 HIS H . 25805 1 303 . 1 1 52 52 HIS HA H 1 5.564 0.020 . 1 . . . A 52 HIS HA . 25805 1 304 . 1 1 52 52 HIS HB2 H 1 3.124 0.020 . 2 . . . A 52 HIS HB2 . 25805 1 305 . 1 1 52 52 HIS HB3 H 1 3.256 0.020 . 2 . . . A 52 HIS HB3 . 25805 1 306 . 1 1 52 52 HIS C C 13 174.551 0.400 . 1 . . . A 52 HIS C . 25805 1 307 . 1 1 52 52 HIS CA C 13 54.193 0.400 . 1 . . . A 52 HIS CA . 25805 1 308 . 1 1 52 52 HIS CB C 13 30.333 0.400 . 1 . . . A 52 HIS CB . 25805 1 309 . 1 1 52 52 HIS N N 15 124.723 0.400 . 1 . . . A 52 HIS N . 25805 1 310 . 1 1 53 53 ALA H H 1 8.964 0.020 . 1 . . . A 53 ALA H . 25805 1 311 . 1 1 53 53 ALA HA H 1 4.996 0.020 . 1 . . . A 53 ALA HA . 25805 1 312 . 1 1 53 53 ALA HB1 H 1 1.258 0.020 . 1 . . . A 53 ALA HB1 . 25805 1 313 . 1 1 53 53 ALA HB2 H 1 1.258 0.020 . 1 . . . A 53 ALA HB2 . 25805 1 314 . 1 1 53 53 ALA HB3 H 1 1.258 0.020 . 1 . . . A 53 ALA HB3 . 25805 1 315 . 1 1 53 53 ALA C C 13 173.650 0.400 . 1 . . . A 53 ALA C . 25805 1 316 . 1 1 53 53 ALA CA C 13 49.140 0.400 . 1 . . . A 53 ALA CA . 25805 1 317 . 1 1 53 53 ALA CB C 13 22.526 0.400 . 1 . . . A 53 ALA CB . 25805 1 318 . 1 1 53 53 ALA N N 15 128.544 0.400 . 1 . . . A 53 ALA N . 25805 1 319 . 1 1 55 55 PRO HA H 1 3.412 0.020 . 1 . . . A 55 PRO HA . 25805 1 320 . 1 1 55 55 PRO HB2 H 1 1.708 0.020 . 2 . . . A 55 PRO HB2 . 25805 1 321 . 1 1 55 55 PRO HB3 H 1 1.681 0.020 . 2 . . . A 55 PRO HB3 . 25805 1 322 . 1 1 55 55 PRO HG2 H 1 1.491 0.020 . 2 . . . A 55 PRO HG2 . 25805 1 323 . 1 1 55 55 PRO HG3 H 1 1.491 0.020 . 2 . . . A 55 PRO HG3 . 25805 1 324 . 1 1 55 55 PRO C C 13 178.486 0.400 . 1 . . . A 55 PRO C . 25805 1 325 . 1 1 55 55 PRO CA C 13 63.677 0.400 . 1 . . . A 55 PRO CA . 25805 1 326 . 1 1 55 55 PRO CB C 13 31.552 0.400 . 1 . . . A 55 PRO CB . 25805 1 327 . 1 1 56 56 GLY H H 1 8.738 0.020 . 1 . . . A 56 GLY H . 25805 1 328 . 1 1 56 56 GLY HA2 H 1 3.522 0.020 . 2 . . . A 56 GLY HA2 . 25805 1 329 . 1 1 56 56 GLY HA3 H 1 4.285 0.020 . 2 . . . A 56 GLY HA3 . 25805 1 330 . 1 1 56 56 GLY C C 13 174.551 0.400 . 1 . . . A 56 GLY C . 25805 1 331 . 1 1 56 56 GLY CA C 13 45.281 0.400 . 1 . . . A 56 GLY CA . 25805 1 332 . 1 1 56 56 GLY N N 15 112.044 0.400 . 1 . . . A 56 GLY N . 25805 1 333 . 1 1 57 57 ASP H H 1 7.585 0.020 . 1 . . . A 57 ASP H . 25805 1 334 . 1 1 57 57 ASP HA H 1 4.550 0.020 . 1 . . . A 57 ASP HA . 25805 1 335 . 1 1 57 57 ASP HB2 H 1 2.417 0.020 . 2 . . . A 57 ASP HB2 . 25805 1 336 . 1 1 57 57 ASP HB3 H 1 2.701 0.020 . 2 . . . A 57 ASP HB3 . 25805 1 337 . 1 1 57 57 ASP C C 13 176.708 0.400 . 1 . . . A 57 ASP C . 25805 1 338 . 1 1 57 57 ASP CA C 13 55.323 0.400 . 1 . . . A 57 ASP CA . 25805 1 339 . 1 1 57 57 ASP CB C 13 42.343 0.400 . 1 . . . A 57 ASP CB . 25805 1 340 . 1 1 57 57 ASP N N 15 121.958 0.400 . 1 . . . A 57 ASP N . 25805 1 341 . 1 1 58 58 THR H H 1 8.570 0.020 . 1 . . . A 58 THR H . 25805 1 342 . 1 1 58 58 THR HA H 1 4.414 0.020 . 1 . . . A 58 THR HA . 25805 1 343 . 1 1 58 58 THR HB H 1 3.782 0.020 . 1 . . . A 58 THR HB . 25805 1 344 . 1 1 58 58 THR HG21 H 1 0.391 0.020 . 1 . . . A 58 THR HG21 . 25805 1 345 . 1 1 58 58 THR HG22 H 1 0.391 0.020 . 1 . . . A 58 THR HG22 . 25805 1 346 . 1 1 58 58 THR HG23 H 1 0.391 0.020 . 1 . . . A 58 THR HG23 . 25805 1 347 . 1 1 58 58 THR C C 13 174.338 0.400 . 1 . . . A 58 THR C . 25805 1 348 . 1 1 58 58 THR CA C 13 63.557 0.400 . 1 . . . A 58 THR CA . 25805 1 349 . 1 1 58 58 THR CB C 13 68.587 0.400 . 1 . . . A 58 THR CB . 25805 1 350 . 1 1 58 58 THR CG2 C 13 21.259 0.400 . 1 . . . A 58 THR CG2 . 25805 1 351 . 1 1 58 58 THR N N 15 120.496 0.400 . 1 . . . A 58 THR N . 25805 1 352 . 1 1 59 59 LEU H H 1 8.870 0.020 . 1 . . . A 59 LEU H . 25805 1 353 . 1 1 59 59 LEU HA H 1 4.228 0.020 . 1 . . . A 59 LEU HA . 25805 1 354 . 1 1 59 59 LEU HB2 H 1 1.496 0.020 . 2 . . . A 59 LEU HB2 . 25805 1 355 . 1 1 59 59 LEU HB3 H 1 1.496 0.020 . 2 . . . A 59 LEU HB3 . 25805 1 356 . 1 1 59 59 LEU HG H 1 1.617 0.020 . 1 . . . A 59 LEU HG . 25805 1 357 . 1 1 59 59 LEU HD11 H 1 0.769 0.020 . 2 . . . A 59 LEU HD11 . 25805 1 358 . 1 1 59 59 LEU HD12 H 1 0.769 0.020 . 2 . . . A 59 LEU HD12 . 25805 1 359 . 1 1 59 59 LEU HD13 H 1 0.769 0.020 . 2 . . . A 59 LEU HD13 . 25805 1 360 . 1 1 59 59 LEU HD21 H 1 0.775 0.020 . 2 . . . A 59 LEU HD21 . 25805 1 361 . 1 1 59 59 LEU HD22 H 1 0.775 0.020 . 2 . . . A 59 LEU HD22 . 25805 1 362 . 1 1 59 59 LEU HD23 H 1 0.775 0.020 . 2 . . . A 59 LEU HD23 . 25805 1 363 . 1 1 59 59 LEU C C 13 177.088 0.400 . 1 . . . A 59 LEU C . 25805 1 364 . 1 1 59 59 LEU CA C 13 56.348 0.400 . 1 . . . A 59 LEU CA . 25805 1 365 . 1 1 59 59 LEU CB C 13 43.106 0.400 . 1 . . . A 59 LEU CB . 25805 1 366 . 1 1 59 59 LEU CG C 13 28.011 0.400 . 1 . . . A 59 LEU CG . 25805 1 367 . 1 1 59 59 LEU CD1 C 13 25.244 0.400 . 1 . . . A 59 LEU CD1 . 25805 1 368 . 1 1 59 59 LEU CD2 C 13 26.630 0.400 . 1 . . . A 59 LEU CD2 . 25805 1 369 . 1 1 59 59 LEU N N 15 128.347 0.400 . 1 . . . A 59 LEU N . 25805 1 370 . 1 1 60 60 VAL H H 1 7.113 0.020 . 1 . . . A 60 VAL H . 25805 1 371 . 1 1 60 60 VAL HA H 1 4.153 0.020 . 1 . . . A 60 VAL HA . 25805 1 372 . 1 1 60 60 VAL HB H 1 1.645 0.020 . 1 . . . A 60 VAL HB . 25805 1 373 . 1 1 60 60 VAL HG11 H 1 1.134 0.020 . 2 . . . A 60 VAL HG11 . 25805 1 374 . 1 1 60 60 VAL HG12 H 1 1.134 0.020 . 2 . . . A 60 VAL HG12 . 25805 1 375 . 1 1 60 60 VAL HG13 H 1 1.134 0.020 . 2 . . . A 60 VAL HG13 . 25805 1 376 . 1 1 60 60 VAL HG21 H 1 0.761 0.020 . 2 . . . A 60 VAL HG21 . 25805 1 377 . 1 1 60 60 VAL HG22 H 1 0.761 0.020 . 2 . . . A 60 VAL HG22 . 25805 1 378 . 1 1 60 60 VAL HG23 H 1 0.761 0.020 . 2 . . . A 60 VAL HG23 . 25805 1 379 . 1 1 60 60 VAL C C 13 174.290 0.400 . 1 . . . A 60 VAL C . 25805 1 380 . 1 1 60 60 VAL CA C 13 61.917 0.400 . 1 . . . A 60 VAL CA . 25805 1 381 . 1 1 60 60 VAL CB C 13 37.401 0.400 . 1 . . . A 60 VAL CB . 25805 1 382 . 1 1 60 60 VAL CG1 C 13 21.901 0.400 . 1 . . . A 60 VAL CG1 . 25805 1 383 . 1 1 60 60 VAL CG2 C 13 20.826 0.400 . 1 . . . A 60 VAL CG2 . 25805 1 384 . 1 1 60 60 VAL N N 15 117.342 0.400 . 1 . . . A 60 VAL N . 25805 1 385 . 1 1 61 61 HIS H H 1 8.947 0.020 . 1 . . . A 61 HIS H . 25805 1 386 . 1 1 61 61 HIS HA H 1 5.022 0.020 . 1 . . . A 61 HIS HA . 25805 1 387 . 1 1 61 61 HIS HB2 H 1 3.137 0.020 . 2 . . . A 61 HIS HB2 . 25805 1 388 . 1 1 61 61 HIS HB3 H 1 3.137 0.020 . 2 . . . A 61 HIS HB3 . 25805 1 389 . 1 1 61 61 HIS C C 13 175.780 0.400 . 1 . . . A 61 HIS C . 25805 1 390 . 1 1 61 61 HIS CA C 13 54.748 0.400 . 1 . . . A 61 HIS CA . 25805 1 391 . 1 1 61 61 HIS CB C 13 30.520 0.400 . 1 . . . A 61 HIS CB . 25805 1 392 . 1 1 61 61 HIS N N 15 125.516 0.400 . 1 . . . A 61 HIS N . 25805 1 393 . 1 1 62 62 ALA H H 1 9.185 0.020 . 1 . . . A 62 ALA H . 25805 1 394 . 1 1 62 62 ALA HA H 1 3.703 0.020 . 1 . . . A 62 ALA HA . 25805 1 395 . 1 1 62 62 ALA HB1 H 1 1.195 0.020 . 1 . . . A 62 ALA HB1 . 25805 1 396 . 1 1 62 62 ALA HB2 H 1 1.195 0.020 . 1 . . . A 62 ALA HB2 . 25805 1 397 . 1 1 62 62 ALA HB3 H 1 1.195 0.020 . 1 . . . A 62 ALA HB3 . 25805 1 398 . 1 1 62 62 ALA C C 13 179.340 0.400 . 1 . . . A 62 ALA C . 25805 1 399 . 1 1 62 62 ALA CA C 13 54.281 0.400 . 1 . . . A 62 ALA CA . 25805 1 400 . 1 1 62 62 ALA CB C 13 17.624 0.400 . 1 . . . A 62 ALA CB . 25805 1 401 . 1 1 62 62 ALA N N 15 126.827 0.400 . 1 . . . A 62 ALA N . 25805 1 402 . 1 1 63 63 GLY H H 1 9.598 0.020 . 1 . . . A 63 GLY H . 25805 1 403 . 1 1 63 63 GLY HA2 H 1 4.490 0.020 . 2 . . . A 63 GLY HA2 . 25805 1 404 . 1 1 63 63 GLY HA3 H 1 3.532 0.020 . 2 . . . A 63 GLY HA3 . 25805 1 405 . 1 1 63 63 GLY C C 13 174.504 0.400 . 1 . . . A 63 GLY C . 25805 1 406 . 1 1 63 63 GLY CA C 13 45.601 0.400 . 1 . . . A 63 GLY CA . 25805 1 407 . 1 1 63 63 GLY N N 15 112.973 0.400 . 1 . . . A 63 GLY N . 25805 1 408 . 1 1 64 64 ASP H H 1 8.396 0.020 . 1 . . . A 64 ASP H . 25805 1 409 . 1 1 64 64 ASP HA H 1 4.587 0.020 . 1 . . . A 64 ASP HA . 25805 1 410 . 1 1 64 64 ASP HB2 H 1 3.026 0.020 . 2 . . . A 64 ASP HB2 . 25805 1 411 . 1 1 64 64 ASP HB3 H 1 2.758 0.020 . 2 . . . A 64 ASP HB3 . 25805 1 412 . 1 1 64 64 ASP C C 13 174.693 0.400 . 1 . . . A 64 ASP C . 25805 1 413 . 1 1 64 64 ASP CA C 13 54.787 0.400 . 1 . . . A 64 ASP CA . 25805 1 414 . 1 1 64 64 ASP CB C 13 41.487 0.400 . 1 . . . A 64 ASP CB . 25805 1 415 . 1 1 64 64 ASP N N 15 121.715 0.400 . 1 . . . A 64 ASP N . 25805 1 416 . 1 1 65 65 LEU H H 1 8.588 0.020 . 1 . . . A 65 LEU H . 25805 1 417 . 1 1 65 65 LEU HA H 1 4.444 0.020 . 1 . . . A 65 LEU HA . 25805 1 418 . 1 1 65 65 LEU HB2 H 1 1.665 0.020 . 2 . . . A 65 LEU HB2 . 25805 1 419 . 1 1 65 65 LEU HB3 H 1 1.469 0.020 . 2 . . . A 65 LEU HB3 . 25805 1 420 . 1 1 65 65 LEU HG H 1 1.626 0.020 . 1 . . . A 65 LEU HG . 25805 1 421 . 1 1 65 65 LEU HD11 H 1 0.835 0.020 . 2 . . . A 65 LEU HD11 . 25805 1 422 . 1 1 65 65 LEU HD12 H 1 0.835 0.020 . 2 . . . A 65 LEU HD12 . 25805 1 423 . 1 1 65 65 LEU HD13 H 1 0.835 0.020 . 2 . . . A 65 LEU HD13 . 25805 1 424 . 1 1 65 65 LEU HD21 H 1 0.836 0.020 . 2 . . . A 65 LEU HD21 . 25805 1 425 . 1 1 65 65 LEU HD22 H 1 0.836 0.020 . 2 . . . A 65 LEU HD22 . 25805 1 426 . 1 1 65 65 LEU HD23 H 1 0.836 0.020 . 2 . . . A 65 LEU HD23 . 25805 1 427 . 1 1 65 65 LEU C C 13 178.842 0.400 . 1 . . . A 65 LEU C . 25805 1 428 . 1 1 65 65 LEU CA C 13 55.971 0.400 . 1 . . . A 65 LEU CA . 25805 1 429 . 1 1 65 65 LEU CB C 13 43.132 0.400 . 1 . . . A 65 LEU CB . 25805 1 430 . 1 1 65 65 LEU CG C 13 27.394 0.400 . 1 . . . A 65 LEU CG . 25805 1 431 . 1 1 65 65 LEU CD1 C 13 25.036 0.400 . 1 . . . A 65 LEU CD1 . 25805 1 432 . 1 1 65 65 LEU CD2 C 13 23.509 0.400 . 1 . . . A 65 LEU CD2 . 25805 1 433 . 1 1 65 65 LEU N N 15 121.376 0.400 . 1 . . . A 65 LEU N . 25805 1 434 . 1 1 66 66 LEU H H 1 8.959 0.020 . 1 . . . A 66 LEU H . 25805 1 435 . 1 1 66 66 LEU HA H 1 4.706 0.020 . 1 . . . A 66 LEU HA . 25805 1 436 . 1 1 66 66 LEU HB2 H 1 1.801 0.020 . 2 . . . A 66 LEU HB2 . 25805 1 437 . 1 1 66 66 LEU HB3 H 1 1.524 0.020 . 2 . . . A 66 LEU HB3 . 25805 1 438 . 1 1 66 66 LEU HG H 1 1.667 0.020 . 1 . . . A 66 LEU HG . 25805 1 439 . 1 1 66 66 LEU HD11 H 1 0.697 0.020 . 2 . . . A 66 LEU HD11 . 25805 1 440 . 1 1 66 66 LEU HD12 H 1 0.697 0.020 . 2 . . . A 66 LEU HD12 . 25805 1 441 . 1 1 66 66 LEU HD13 H 1 0.697 0.020 . 2 . . . A 66 LEU HD13 . 25805 1 442 . 1 1 66 66 LEU HD21 H 1 0.981 0.020 . 2 . . . A 66 LEU HD21 . 25805 1 443 . 1 1 66 66 LEU HD22 H 1 0.981 0.020 . 2 . . . A 66 LEU HD22 . 25805 1 444 . 1 1 66 66 LEU HD23 H 1 0.981 0.020 . 2 . . . A 66 LEU HD23 . 25805 1 445 . 1 1 66 66 LEU C C 13 177.135 0.400 . 1 . . . A 66 LEU C . 25805 1 446 . 1 1 66 66 LEU CA C 13 53.994 0.400 . 1 . . . A 66 LEU CA . 25805 1 447 . 1 1 66 66 LEU CB C 13 40.976 0.400 . 1 . . . A 66 LEU CB . 25805 1 448 . 1 1 66 66 LEU CD1 C 13 26.665 0.400 . 1 . . . A 66 LEU CD1 . 25805 1 449 . 1 1 66 66 LEU CD2 C 13 24.964 0.400 . 1 . . . A 66 LEU CD2 . 25805 1 450 . 1 1 66 66 LEU N N 15 127.251 0.400 . 1 . . . A 66 LEU N . 25805 1 451 . 1 1 67 67 THR H H 1 8.184 0.020 . 1 . . . A 67 THR H . 25805 1 452 . 1 1 67 67 THR HA H 1 4.123 0.020 . 1 . . . A 67 THR HA . 25805 1 453 . 1 1 67 67 THR HB H 1 4.274 0.020 . 1 . . . A 67 THR HB . 25805 1 454 . 1 1 67 67 THR HG21 H 1 1.196 0.020 . 1 . . . A 67 THR HG21 . 25805 1 455 . 1 1 67 67 THR HG22 H 1 1.196 0.020 . 1 . . . A 67 THR HG22 . 25805 1 456 . 1 1 67 67 THR HG23 H 1 1.196 0.020 . 1 . . . A 67 THR HG23 . 25805 1 457 . 1 1 67 67 THR C C 13 173.935 0.400 . 1 . . . A 67 THR C . 25805 1 458 . 1 1 67 67 THR CA C 13 62.057 0.400 . 1 . . . A 67 THR CA . 25805 1 459 . 1 1 67 67 THR CB C 13 70.091 0.400 . 1 . . . A 67 THR CB . 25805 1 460 . 1 1 67 67 THR CG2 C 13 22.496 0.400 . 1 . . . A 67 THR CG2 . 25805 1 461 . 1 1 67 67 THR N N 15 112.895 0.400 . 1 . . . A 67 THR N . 25805 1 462 . 1 1 68 68 ALA H H 1 7.655 0.020 . 1 . . . A 68 ALA H . 25805 1 463 . 1 1 68 68 ALA HA H 1 4.978 0.020 . 1 . . . A 68 ALA HA . 25805 1 464 . 1 1 68 68 ALA HB1 H 1 0.746 0.020 . 1 . . . A 68 ALA HB1 . 25805 1 465 . 1 1 68 68 ALA HB2 H 1 0.746 0.020 . 1 . . . A 68 ALA HB2 . 25805 1 466 . 1 1 68 68 ALA HB3 H 1 0.746 0.020 . 1 . . . A 68 ALA HB3 . 25805 1 467 . 1 1 68 68 ALA C C 13 175.405 0.400 . 1 . . . A 68 ALA C . 25805 1 468 . 1 1 68 68 ALA CA C 13 51.152 0.400 . 1 . . . A 68 ALA CA . 25805 1 469 . 1 1 68 68 ALA CB C 13 23.325 0.400 . 1 . . . A 68 ALA CB . 25805 1 470 . 1 1 68 68 ALA N N 15 121.319 0.400 . 1 . . . A 68 ALA N . 25805 1 471 . 1 1 69 69 LEU H H 1 8.174 0.020 . 1 . . . A 69 LEU H . 25805 1 472 . 1 1 69 69 LEU HA H 1 4.793 0.020 . 1 . . . A 69 LEU HA . 25805 1 473 . 1 1 69 69 LEU HB2 H 1 1.670 0.020 . 2 . . . A 69 LEU HB2 . 25805 1 474 . 1 1 69 69 LEU HB3 H 1 1.670 0.020 . 2 . . . A 69 LEU HB3 . 25805 1 475 . 1 1 69 69 LEU HG H 1 1.661 0.020 . 1 . . . A 69 LEU HG . 25805 1 476 . 1 1 69 69 LEU HD11 H 1 1.043 0.020 . 2 . . . A 69 LEU HD11 . 25805 1 477 . 1 1 69 69 LEU HD12 H 1 1.043 0.020 . 2 . . . A 69 LEU HD12 . 25805 1 478 . 1 1 69 69 LEU HD13 H 1 1.043 0.020 . 2 . . . A 69 LEU HD13 . 25805 1 479 . 1 1 69 69 LEU HD21 H 1 0.993 0.020 . 2 . . . A 69 LEU HD21 . 25805 1 480 . 1 1 69 69 LEU HD22 H 1 0.993 0.020 . 2 . . . A 69 LEU HD22 . 25805 1 481 . 1 1 69 69 LEU HD23 H 1 0.993 0.020 . 2 . . . A 69 LEU HD23 . 25805 1 482 . 1 1 69 69 LEU C C 13 175.215 0.400 . 1 . . . A 69 LEU C . 25805 1 483 . 1 1 69 69 LEU CA C 13 54.712 0.400 . 1 . . . A 69 LEU CA . 25805 1 484 . 1 1 69 69 LEU CB C 13 45.962 0.400 . 1 . . . A 69 LEU CB . 25805 1 485 . 1 1 69 69 LEU CG C 13 28.081 0.400 . 1 . . . A 69 LEU CG . 25805 1 486 . 1 1 69 69 LEU CD1 C 13 26.127 0.400 . 1 . . . A 69 LEU CD1 . 25805 1 487 . 1 1 69 69 LEU CD2 C 13 26.578 0.400 . 1 . . . A 69 LEU CD2 . 25805 1 488 . 1 1 69 69 LEU N N 15 121.056 0.400 . 1 . . . A 69 LEU N . 25805 1 489 . 1 1 70 70 TYR H H 1 8.065 0.020 . 1 . . . A 70 TYR H . 25805 1 490 . 1 1 70 70 TYR HA H 1 5.128 0.020 . 1 . . . A 70 TYR HA . 25805 1 491 . 1 1 70 70 TYR HB2 H 1 3.204 0.020 . 2 . . . A 70 TYR HB2 . 25805 1 492 . 1 1 70 70 TYR HB3 H 1 3.204 0.020 . 2 . . . A 70 TYR HB3 . 25805 1 493 . 1 1 70 70 TYR HD1 H 1 6.698 0.020 . 3 . . . A 70 TYR HD1 . 25805 1 494 . 1 1 70 70 TYR HD2 H 1 6.698 0.020 . 3 . . . A 70 TYR HD2 . 25805 1 495 . 1 1 70 70 TYR C C 13 174.907 0.400 . 1 . . . A 70 TYR C . 25805 1 496 . 1 1 70 70 TYR CA C 13 57.621 0.400 . 1 . . . A 70 TYR CA . 25805 1 497 . 1 1 70 70 TYR CB C 13 41.190 0.400 . 1 . . . A 70 TYR CB . 25805 1 498 . 1 1 70 70 TYR N N 15 120.814 0.400 . 1 . . . A 70 TYR N . 25805 1 499 . 1 1 71 71 PHE H H 1 9.210 0.020 . 1 . . . A 71 PHE H . 25805 1 500 . 1 1 71 71 PHE HA H 1 5.175 0.020 . 1 . . . A 71 PHE HA . 25805 1 501 . 1 1 71 71 PHE HB2 H 1 3.116 0.020 . 2 . . . A 71 PHE HB2 . 25805 1 502 . 1 1 71 71 PHE HB3 H 1 3.116 0.020 . 2 . . . A 71 PHE HB3 . 25805 1 503 . 1 1 71 71 PHE HD1 H 1 7.339 0.020 . 3 . . . A 71 PHE HD1 . 25805 1 504 . 1 1 71 71 PHE HD2 H 1 7.339 0.020 . 3 . . . A 71 PHE HD2 . 25805 1 505 . 1 1 71 71 PHE C C 13 175.397 0.400 . 1 . . . A 71 PHE C . 25805 1 506 . 1 1 71 71 PHE CA C 13 56.549 0.400 . 1 . . . A 71 PHE CA . 25805 1 507 . 1 1 71 71 PHE CB C 13 42.070 0.400 . 1 . . . A 71 PHE CB . 25805 1 508 . 1 1 71 71 PHE N N 15 117.611 0.400 . 1 . . . A 71 PHE N . 25805 1 509 . 1 1 72 72 ILE H H 1 8.663 0.020 . 1 . . . A 72 ILE H . 25805 1 510 . 1 1 72 72 ILE HA H 1 4.479 0.020 . 1 . . . A 72 ILE HA . 25805 1 511 . 1 1 72 72 ILE HB H 1 2.085 0.020 . 1 . . . A 72 ILE HB . 25805 1 512 . 1 1 72 72 ILE HG12 H 1 1.631 0.020 . 2 . . . A 72 ILE HG12 . 25805 1 513 . 1 1 72 72 ILE HG13 H 1 1.631 0.020 . 2 . . . A 72 ILE HG13 . 25805 1 514 . 1 1 72 72 ILE HG21 H 1 0.665 0.020 . 1 . . . A 72 ILE HG21 . 25805 1 515 . 1 1 72 72 ILE HG22 H 1 0.665 0.020 . 1 . . . A 72 ILE HG22 . 25805 1 516 . 1 1 72 72 ILE HG23 H 1 0.665 0.020 . 1 . . . A 72 ILE HG23 . 25805 1 517 . 1 1 72 72 ILE HD11 H 1 0.843 0.020 . 1 . . . A 72 ILE HD11 . 25805 1 518 . 1 1 72 72 ILE HD12 H 1 0.843 0.020 . 1 . . . A 72 ILE HD12 . 25805 1 519 . 1 1 72 72 ILE HD13 H 1 0.843 0.020 . 1 . . . A 72 ILE HD13 . 25805 1 520 . 1 1 72 72 ILE C C 13 177.502 0.400 . 1 . . . A 72 ILE C . 25805 1 521 . 1 1 72 72 ILE CA C 13 62.191 0.400 . 1 . . . A 72 ILE CA . 25805 1 522 . 1 1 72 72 ILE CB C 13 39.516 0.400 . 1 . . . A 72 ILE CB . 25805 1 523 . 1 1 72 72 ILE CG1 C 13 28.349 0.400 . 1 . . . A 72 ILE CG1 . 25805 1 524 . 1 1 72 72 ILE CG2 C 13 18.626 0.400 . 1 . . . A 72 ILE CG2 . 25805 1 525 . 1 1 72 72 ILE CD1 C 13 16.229 0.400 . 1 . . . A 72 ILE CD1 . 25805 1 526 . 1 1 72 72 ILE N N 15 122.646 0.400 . 1 . . . A 72 ILE N . 25805 1 527 . 1 1 73 73 SER H H 1 8.891 0.020 . 1 . . . A 73 SER H . 25805 1 528 . 1 1 73 73 SER HA H 1 4.909 0.020 . 1 . . . A 73 SER HA . 25805 1 529 . 1 1 73 73 SER HB2 H 1 3.965 0.020 . 2 . . . A 73 SER HB2 . 25805 1 530 . 1 1 73 73 SER HB3 H 1 3.753 0.020 . 2 . . . A 73 SER HB3 . 25805 1 531 . 1 1 73 73 SER C C 13 175.025 0.400 . 1 . . . A 73 SER C . 25805 1 532 . 1 1 73 73 SER CA C 13 59.023 0.400 . 1 . . . A 73 SER CA . 25805 1 533 . 1 1 73 73 SER CB C 13 64.288 0.400 . 1 . . . A 73 SER CB . 25805 1 534 . 1 1 73 73 SER N N 15 121.880 0.400 . 1 . . . A 73 SER N . 25805 1 535 . 1 1 74 74 ARG H H 1 7.811 0.020 . 1 . . . A 74 ARG H . 25805 1 536 . 1 1 74 74 ARG HA H 1 4.461 0.020 . 1 . . . A 74 ARG HA . 25805 1 537 . 1 1 74 74 ARG HB2 H 1 2.071 0.020 . 2 . . . A 74 ARG HB2 . 25805 1 538 . 1 1 74 74 ARG HB3 H 1 2.071 0.020 . 2 . . . A 74 ARG HB3 . 25805 1 539 . 1 1 74 74 ARG HG2 H 1 1.738 0.020 . 2 . . . A 74 ARG HG2 . 25805 1 540 . 1 1 74 74 ARG HG3 H 1 1.620 0.020 . 2 . . . A 74 ARG HG3 . 25805 1 541 . 1 1 74 74 ARG HD2 H 1 3.225 0.020 . 2 . . . A 74 ARG HD2 . 25805 1 542 . 1 1 74 74 ARG HD3 H 1 3.225 0.020 . 2 . . . A 74 ARG HD3 . 25805 1 543 . 1 1 74 74 ARG C C 13 174.622 0.400 . 1 . . . A 74 ARG C . 25805 1 544 . 1 1 74 74 ARG CA C 13 57.104 0.400 . 1 . . . A 74 ARG CA . 25805 1 545 . 1 1 74 74 ARG CB C 13 34.683 0.400 . 1 . . . A 74 ARG CB . 25805 1 546 . 1 1 74 74 ARG CG C 13 27.852 0.400 . 1 . . . A 74 ARG CG . 25805 1 547 . 1 1 74 74 ARG CD C 13 44.142 0.400 . 1 . . . A 74 ARG CD . 25805 1 548 . 1 1 74 74 ARG N N 15 121.425 0.400 . 1 . . . A 74 ARG N . 25805 1 549 . 1 1 75 75 GLY H H 1 8.721 0.020 . 1 . . . A 75 GLY H . 25805 1 550 . 1 1 75 75 GLY HA2 H 1 4.949 0.020 . 2 . . . A 75 GLY HA2 . 25805 1 551 . 1 1 75 75 GLY HA3 H 1 3.735 0.020 . 2 . . . A 75 GLY HA3 . 25805 1 552 . 1 1 75 75 GLY C C 13 172.513 0.400 . 1 . . . A 75 GLY C . 25805 1 553 . 1 1 75 75 GLY CA C 13 44.773 0.400 . 1 . . . A 75 GLY CA . 25805 1 554 . 1 1 75 75 GLY N N 15 112.753 0.400 . 1 . . . A 75 GLY N . 25805 1 555 . 1 1 76 76 SER H H 1 7.324 0.020 . 1 . . . A 76 SER H . 25805 1 556 . 1 1 76 76 SER HA H 1 5.466 0.020 . 1 . . . A 76 SER HA . 25805 1 557 . 1 1 76 76 SER HB2 H 1 3.739 0.020 . 2 . . . A 76 SER HB2 . 25805 1 558 . 1 1 76 76 SER HB3 H 1 3.588 0.020 . 2 . . . A 76 SER HB3 . 25805 1 559 . 1 1 76 76 SER C C 13 173.366 0.400 . 1 . . . A 76 SER C . 25805 1 560 . 1 1 76 76 SER CA C 13 57.225 0.400 . 1 . . . A 76 SER CA . 25805 1 561 . 1 1 76 76 SER CB C 13 66.464 0.400 . 1 . . . A 76 SER CB . 25805 1 562 . 1 1 76 76 SER N N 15 110.468 0.400 . 1 . . . A 76 SER N . 25805 1 563 . 1 1 77 77 ILE H H 1 8.799 0.020 . 1 . . . A 77 ILE H . 25805 1 564 . 1 1 77 77 ILE HA H 1 4.671 0.020 . 1 . . . A 77 ILE HA . 25805 1 565 . 1 1 77 77 ILE HB H 1 1.389 0.020 . 1 . . . A 77 ILE HB . 25805 1 566 . 1 1 77 77 ILE HG12 H 1 1.353 0.020 . 2 . . . A 77 ILE HG12 . 25805 1 567 . 1 1 77 77 ILE HG13 H 1 1.353 0.020 . 2 . . . A 77 ILE HG13 . 25805 1 568 . 1 1 77 77 ILE HG21 H 1 0.436 0.020 . 1 . . . A 77 ILE HG21 . 25805 1 569 . 1 1 77 77 ILE HG22 H 1 0.436 0.020 . 1 . . . A 77 ILE HG22 . 25805 1 570 . 1 1 77 77 ILE HG23 H 1 0.436 0.020 . 1 . . . A 77 ILE HG23 . 25805 1 571 . 1 1 77 77 ILE HD11 H 1 0.481 0.020 . 1 . . . A 77 ILE HD11 . 25805 1 572 . 1 1 77 77 ILE HD12 H 1 0.481 0.020 . 1 . . . A 77 ILE HD12 . 25805 1 573 . 1 1 77 77 ILE HD13 H 1 0.481 0.020 . 1 . . . A 77 ILE HD13 . 25805 1 574 . 1 1 77 77 ILE C C 13 173.816 0.400 . 1 . . . A 77 ILE C . 25805 1 575 . 1 1 77 77 ILE CA C 13 58.997 0.400 . 1 . . . A 77 ILE CA . 25805 1 576 . 1 1 77 77 ILE CB C 13 43.067 0.400 . 1 . . . A 77 ILE CB . 25805 1 577 . 1 1 77 77 ILE CG1 C 13 28.021 0.400 . 1 . . . A 77 ILE CG1 . 25805 1 578 . 1 1 77 77 ILE CG2 C 13 19.538 0.400 . 1 . . . A 77 ILE CG2 . 25805 1 579 . 1 1 77 77 ILE CD1 C 13 14.242 0.400 . 1 . . . A 77 ILE CD1 . 25805 1 580 . 1 1 77 77 ILE N N 15 123.997 0.400 . 1 . . . A 77 ILE N . 25805 1 581 . 1 1 78 78 GLU H H 1 9.164 0.020 . 1 . . . A 78 GLU H . 25805 1 582 . 1 1 78 78 GLU HA H 1 5.067 0.020 . 1 . . . A 78 GLU HA . 25805 1 583 . 1 1 78 78 GLU HB2 H 1 1.733 0.020 . 2 . . . A 78 GLU HB2 . 25805 1 584 . 1 1 78 78 GLU HB3 H 1 1.902 0.020 . 2 . . . A 78 GLU HB3 . 25805 1 585 . 1 1 78 78 GLU HG2 H 1 2.105 0.020 . 2 . . . A 78 GLU HG2 . 25805 1 586 . 1 1 78 78 GLU HG3 H 1 2.105 0.020 . 2 . . . A 78 GLU HG3 . 25805 1 587 . 1 1 78 78 GLU C C 13 174.409 0.400 . 1 . . . A 78 GLU C . 25805 1 588 . 1 1 78 78 GLU CA C 13 53.715 0.400 . 1 . . . A 78 GLU CA . 25805 1 589 . 1 1 78 78 GLU CB C 13 33.140 0.400 . 1 . . . A 78 GLU CB . 25805 1 590 . 1 1 78 78 GLU CG C 13 36.821 0.400 . 1 . . . A 78 GLU CG . 25805 1 591 . 1 1 78 78 GLU N N 15 122.040 0.400 . 1 . . . A 78 GLU N . 25805 1 592 . 1 1 79 79 ILE H H 1 8.348 0.020 . 1 . . . A 79 ILE H . 25805 1 593 . 1 1 79 79 ILE HA H 1 4.766 0.020 . 1 . . . A 79 ILE HA . 25805 1 594 . 1 1 79 79 ILE HB H 1 1.070 0.020 . 1 . . . A 79 ILE HB . 25805 1 595 . 1 1 79 79 ILE HG12 H 1 0.589 0.020 . 2 . . . A 79 ILE HG12 . 25805 1 596 . 1 1 79 79 ILE HG13 H 1 0.536 0.020 . 2 . . . A 79 ILE HG13 . 25805 1 597 . 1 1 79 79 ILE HG21 H 1 0.038 0.020 . 1 . . . A 79 ILE HG21 . 25805 1 598 . 1 1 79 79 ILE HG22 H 1 0.038 0.020 . 1 . . . A 79 ILE HG22 . 25805 1 599 . 1 1 79 79 ILE HG23 H 1 0.038 0.020 . 1 . . . A 79 ILE HG23 . 25805 1 600 . 1 1 79 79 ILE HD11 H 1 -0.064 0.020 . 1 . . . A 79 ILE HD11 . 25805 1 601 . 1 1 79 79 ILE HD12 H 1 -0.064 0.020 . 1 . . . A 79 ILE HD12 . 25805 1 602 . 1 1 79 79 ILE HD13 H 1 -0.064 0.020 . 1 . . . A 79 ILE HD13 . 25805 1 603 . 1 1 79 79 ILE C C 13 175.547 0.400 . 1 . . . A 79 ILE C . 25805 1 604 . 1 1 79 79 ILE CA C 13 59.468 0.400 . 1 . . . A 79 ILE CA . 25805 1 605 . 1 1 79 79 ILE CB C 13 37.586 0.400 . 1 . . . A 79 ILE CB . 25805 1 606 . 1 1 79 79 ILE CG1 C 13 27.384 0.400 . 1 . . . A 79 ILE CG1 . 25805 1 607 . 1 1 79 79 ILE CG2 C 13 16.632 0.400 . 1 . . . A 79 ILE CG2 . 25805 1 608 . 1 1 79 79 ILE CD1 C 13 12.868 0.400 . 1 . . . A 79 ILE CD1 . 25805 1 609 . 1 1 79 79 ILE N N 15 121.327 0.400 . 1 . . . A 79 ILE N . 25805 1 610 . 1 1 80 80 LEU H H 1 9.183 0.020 . 1 . . . A 80 LEU H . 25805 1 611 . 1 1 80 80 LEU HA H 1 5.293 0.020 . 1 . . . A 80 LEU HA . 25805 1 612 . 1 1 80 80 LEU HB2 H 1 1.505 0.020 . 2 . . . A 80 LEU HB2 . 25805 1 613 . 1 1 80 80 LEU HB3 H 1 1.505 0.020 . 2 . . . A 80 LEU HB3 . 25805 1 614 . 1 1 80 80 LEU HG H 1 1.281 0.020 . 1 . . . A 80 LEU HG . 25805 1 615 . 1 1 80 80 LEU HD11 H 1 0.622 0.020 . 2 . . . A 80 LEU HD11 . 25805 1 616 . 1 1 80 80 LEU HD12 H 1 0.622 0.020 . 2 . . . A 80 LEU HD12 . 25805 1 617 . 1 1 80 80 LEU HD13 H 1 0.622 0.020 . 2 . . . A 80 LEU HD13 . 25805 1 618 . 1 1 80 80 LEU HD21 H 1 0.653 0.020 . 2 . . . A 80 LEU HD21 . 25805 1 619 . 1 1 80 80 LEU HD22 H 1 0.653 0.020 . 2 . . . A 80 LEU HD22 . 25805 1 620 . 1 1 80 80 LEU HD23 H 1 0.653 0.020 . 2 . . . A 80 LEU HD23 . 25805 1 621 . 1 1 80 80 LEU C C 13 176.851 0.400 . 1 . . . A 80 LEU C . 25805 1 622 . 1 1 80 80 LEU CA C 13 54.787 0.400 . 1 . . . A 80 LEU CA . 25805 1 623 . 1 1 80 80 LEU CB C 13 45.850 0.400 . 1 . . . A 80 LEU CB . 25805 1 624 . 1 1 80 80 LEU CG C 13 29.269 0.400 . 1 . . . A 80 LEU CG . 25805 1 625 . 1 1 80 80 LEU CD1 C 13 26.356 0.400 . 1 . . . A 80 LEU CD1 . 25805 1 626 . 1 1 80 80 LEU CD2 C 13 25.864 0.400 . 1 . . . A 80 LEU CD2 . 25805 1 627 . 1 1 80 80 LEU N N 15 127.820 0.400 . 1 . . . A 80 LEU N . 25805 1 628 . 1 1 81 81 ARG H H 1 8.694 0.020 . 1 . . . A 81 ARG H . 25805 1 629 . 1 1 81 81 ARG HA H 1 4.686 0.020 . 1 . . . A 81 ARG HA . 25805 1 630 . 1 1 81 81 ARG HB2 H 1 1.776 0.020 . 2 . . . A 81 ARG HB2 . 25805 1 631 . 1 1 81 81 ARG HB3 H 1 1.603 0.020 . 2 . . . A 81 ARG HB3 . 25805 1 632 . 1 1 81 81 ARG HG2 H 1 1.616 0.020 . 2 . . . A 81 ARG HG2 . 25805 1 633 . 1 1 81 81 ARG HG3 H 1 1.706 0.020 . 2 . . . A 81 ARG HG3 . 25805 1 634 . 1 1 81 81 ARG HD2 H 1 3.236 0.020 . 2 . . . A 81 ARG HD2 . 25805 1 635 . 1 1 81 81 ARG HD3 H 1 3.236 0.020 . 2 . . . A 81 ARG HD3 . 25805 1 636 . 1 1 81 81 ARG C C 13 177.894 0.400 . 1 . . . A 81 ARG C . 25805 1 637 . 1 1 81 81 ARG CA C 13 55.813 0.400 . 1 . . . A 81 ARG CA . 25805 1 638 . 1 1 81 81 ARG CB C 13 32.144 0.400 . 1 . . . A 81 ARG CB . 25805 1 639 . 1 1 81 81 ARG CG C 13 28.511 0.400 . 1 . . . A 81 ARG CG . 25805 1 640 . 1 1 81 81 ARG CD C 13 44.154 0.400 . 1 . . . A 81 ARG CD . 25805 1 641 . 1 1 81 81 ARG N N 15 121.004 0.400 . 1 . . . A 81 ARG N . 25805 1 642 . 1 1 82 82 GLY H H 1 9.313 0.020 . 1 . . . A 82 GLY H . 25805 1 643 . 1 1 82 82 GLY HA2 H 1 3.704 0.020 . 2 . . . A 82 GLY HA2 . 25805 1 644 . 1 1 82 82 GLY HA3 H 1 3.892 0.020 . 2 . . . A 82 GLY HA3 . 25805 1 645 . 1 1 82 82 GLY C C 13 174.836 0.400 . 1 . . . A 82 GLY C . 25805 1 646 . 1 1 82 82 GLY CA C 13 47.576 0.400 . 1 . . . A 82 GLY CA . 25805 1 647 . 1 1 82 82 GLY N N 15 118.501 0.400 . 1 . . . A 82 GLY N . 25805 1 648 . 1 1 83 83 ASP H H 1 8.745 0.020 . 1 . . . A 83 ASP H . 25805 1 649 . 1 1 83 83 ASP HA H 1 4.451 0.020 . 1 . . . A 83 ASP HA . 25805 1 650 . 1 1 83 83 ASP HB2 H 1 2.750 0.020 . 2 . . . A 83 ASP HB2 . 25805 1 651 . 1 1 83 83 ASP HB3 H 1 2.750 0.020 . 2 . . . A 83 ASP HB3 . 25805 1 652 . 1 1 83 83 ASP C C 13 175.594 0.400 . 1 . . . A 83 ASP C . 25805 1 653 . 1 1 83 83 ASP CA C 13 55.889 0.400 . 1 . . . A 83 ASP CA . 25805 1 654 . 1 1 83 83 ASP CB C 13 42.038 0.400 . 1 . . . A 83 ASP CB . 25805 1 655 . 1 1 83 83 ASP N N 15 120.388 0.400 . 1 . . . A 83 ASP N . 25805 1 656 . 1 1 84 84 VAL H H 1 7.656 0.020 . 1 . . . A 84 VAL H . 25805 1 657 . 1 1 84 84 VAL HA H 1 4.097 0.020 . 1 . . . A 84 VAL HA . 25805 1 658 . 1 1 84 84 VAL HB H 1 2.146 0.020 . 1 . . . A 84 VAL HB . 25805 1 659 . 1 1 84 84 VAL HG11 H 1 0.854 0.020 . 2 . . . A 84 VAL HG11 . 25805 1 660 . 1 1 84 84 VAL HG12 H 1 0.854 0.020 . 2 . . . A 84 VAL HG12 . 25805 1 661 . 1 1 84 84 VAL HG13 H 1 0.854 0.020 . 2 . . . A 84 VAL HG13 . 25805 1 662 . 1 1 84 84 VAL HG21 H 1 0.961 0.020 . 2 . . . A 84 VAL HG21 . 25805 1 663 . 1 1 84 84 VAL HG22 H 1 0.961 0.020 . 2 . . . A 84 VAL HG22 . 25805 1 664 . 1 1 84 84 VAL HG23 H 1 0.961 0.020 . 2 . . . A 84 VAL HG23 . 25805 1 665 . 1 1 84 84 VAL C C 13 175.523 0.400 . 1 . . . A 84 VAL C . 25805 1 666 . 1 1 84 84 VAL CA C 13 61.949 0.400 . 1 . . . A 84 VAL CA . 25805 1 667 . 1 1 84 84 VAL CB C 13 34.362 0.400 . 1 . . . A 84 VAL CB . 25805 1 668 . 1 1 84 84 VAL CG1 C 13 21.561 0.400 . 1 . . . A 84 VAL CG1 . 25805 1 669 . 1 1 84 84 VAL CG2 C 13 21.629 0.400 . 1 . . . A 84 VAL CG2 . 25805 1 670 . 1 1 84 84 VAL N N 15 120.609 0.400 . 1 . . . A 84 VAL N . 25805 1 671 . 1 1 85 85 VAL H H 1 8.563 0.020 . 1 . . . A 85 VAL H . 25805 1 672 . 1 1 85 85 VAL HA H 1 4.107 0.020 . 1 . . . A 85 VAL HA . 25805 1 673 . 1 1 85 85 VAL HB H 1 1.947 0.020 . 1 . . . A 85 VAL HB . 25805 1 674 . 1 1 85 85 VAL HG11 H 1 0.891 0.020 . 2 . . . A 85 VAL HG11 . 25805 1 675 . 1 1 85 85 VAL HG12 H 1 0.891 0.020 . 2 . . . A 85 VAL HG12 . 25805 1 676 . 1 1 85 85 VAL HG13 H 1 0.891 0.020 . 2 . . . A 85 VAL HG13 . 25805 1 677 . 1 1 85 85 VAL HG21 H 1 0.847 0.020 . 2 . . . A 85 VAL HG21 . 25805 1 678 . 1 1 85 85 VAL HG22 H 1 0.847 0.020 . 2 . . . A 85 VAL HG22 . 25805 1 679 . 1 1 85 85 VAL HG23 H 1 0.847 0.020 . 2 . . . A 85 VAL HG23 . 25805 1 680 . 1 1 85 85 VAL C C 13 177.538 0.400 . 1 . . . A 85 VAL C . 25805 1 681 . 1 1 85 85 VAL CA C 13 63.753 0.400 . 1 . . . A 85 VAL CA . 25805 1 682 . 1 1 85 85 VAL CB C 13 31.791 0.400 . 1 . . . A 85 VAL CB . 25805 1 683 . 1 1 85 85 VAL CG1 C 13 22.097 0.400 . 1 . . . A 85 VAL CG1 . 25805 1 684 . 1 1 85 85 VAL CG2 C 13 22.010 0.400 . 1 . . . A 85 VAL CG2 . 25805 1 685 . 1 1 85 85 VAL N N 15 126.880 0.400 . 1 . . . A 85 VAL N . 25805 1 686 . 1 1 86 86 VAL H H 1 9.206 0.020 . 1 . . . A 86 VAL H . 25805 1 687 . 1 1 86 86 VAL HA H 1 4.397 0.020 . 1 . . . A 86 VAL HA . 25805 1 688 . 1 1 86 86 VAL HB H 1 2.257 0.020 . 1 . . . A 86 VAL HB . 25805 1 689 . 1 1 86 86 VAL HG11 H 1 0.666 0.020 . 2 . . . A 86 VAL HG11 . 25805 1 690 . 1 1 86 86 VAL HG12 H 1 0.666 0.020 . 2 . . . A 86 VAL HG12 . 25805 1 691 . 1 1 86 86 VAL HG13 H 1 0.666 0.020 . 2 . . . A 86 VAL HG13 . 25805 1 692 . 1 1 86 86 VAL HG21 H 1 0.990 0.020 . 2 . . . A 86 VAL HG21 . 25805 1 693 . 1 1 86 86 VAL HG22 H 1 0.990 0.020 . 2 . . . A 86 VAL HG22 . 25805 1 694 . 1 1 86 86 VAL HG23 H 1 0.990 0.020 . 2 . . . A 86 VAL HG23 . 25805 1 695 . 1 1 86 86 VAL C C 13 176.400 0.400 . 1 . . . A 86 VAL C . 25805 1 696 . 1 1 86 86 VAL CA C 13 61.795 0.400 . 1 . . . A 86 VAL CA . 25805 1 697 . 1 1 86 86 VAL CB C 13 33.080 0.400 . 1 . . . A 86 VAL CB . 25805 1 698 . 1 1 86 86 VAL CG1 C 13 19.983 0.400 . 1 . . . A 86 VAL CG1 . 25805 1 699 . 1 1 86 86 VAL CG2 C 13 22.500 0.400 . 1 . . . A 86 VAL CG2 . 25805 1 700 . 1 1 86 86 VAL N N 15 123.441 0.400 . 1 . . . A 86 VAL N . 25805 1 701 . 1 1 87 87 ALA H H 1 7.525 0.020 . 1 . . . A 87 ALA H . 25805 1 702 . 1 1 87 87 ALA HA H 1 4.415 0.020 . 1 . . . A 87 ALA HA . 25805 1 703 . 1 1 87 87 ALA HB1 H 1 1.075 0.020 . 1 . . . A 87 ALA HB1 . 25805 1 704 . 1 1 87 87 ALA HB2 H 1 1.075 0.020 . 1 . . . A 87 ALA HB2 . 25805 1 705 . 1 1 87 87 ALA HB3 H 1 1.075 0.020 . 1 . . . A 87 ALA HB3 . 25805 1 706 . 1 1 87 87 ALA C C 13 174.575 0.400 . 1 . . . A 87 ALA C . 25805 1 707 . 1 1 87 87 ALA CA C 13 52.921 0.400 . 1 . . . A 87 ALA CA . 25805 1 708 . 1 1 87 87 ALA CB C 13 23.161 0.400 . 1 . . . A 87 ALA CB . 25805 1 709 . 1 1 87 87 ALA N N 15 121.785 0.400 . 1 . . . A 87 ALA N . 25805 1 710 . 1 1 88 88 ILE H H 1 8.072 0.020 . 1 . . . A 88 ILE H . 25805 1 711 . 1 1 88 88 ILE HA H 1 4.901 0.020 . 1 . . . A 88 ILE HA . 25805 1 712 . 1 1 88 88 ILE HB H 1 1.621 0.020 . 1 . . . A 88 ILE HB . 25805 1 713 . 1 1 88 88 ILE HG12 H 1 1.441 0.020 . 2 . . . A 88 ILE HG12 . 25805 1 714 . 1 1 88 88 ILE HG13 H 1 1.019 0.020 . 2 . . . A 88 ILE HG13 . 25805 1 715 . 1 1 88 88 ILE HG21 H 1 0.782 0.020 . 1 . . . A 88 ILE HG21 . 25805 1 716 . 1 1 88 88 ILE HG22 H 1 0.782 0.020 . 1 . . . A 88 ILE HG22 . 25805 1 717 . 1 1 88 88 ILE HG23 H 1 0.782 0.020 . 1 . . . A 88 ILE HG23 . 25805 1 718 . 1 1 88 88 ILE HD11 H 1 0.827 0.020 . 1 . . . A 88 ILE HD11 . 25805 1 719 . 1 1 88 88 ILE HD12 H 1 0.827 0.020 . 1 . . . A 88 ILE HD12 . 25805 1 720 . 1 1 88 88 ILE HD13 H 1 0.827 0.020 . 1 . . . A 88 ILE HD13 . 25805 1 721 . 1 1 88 88 ILE C C 13 176.072 0.400 . 1 . . . A 88 ILE C . 25805 1 722 . 1 1 88 88 ILE CA C 13 60.447 0.400 . 1 . . . A 88 ILE CA . 25805 1 723 . 1 1 88 88 ILE CB C 13 40.248 0.400 . 1 . . . A 88 ILE CB . 25805 1 724 . 1 1 88 88 ILE CG1 C 13 28.140 0.400 . 1 . . . A 88 ILE CG1 . 25805 1 725 . 1 1 88 88 ILE CG2 C 13 17.472 0.400 . 1 . . . A 88 ILE CG2 . 25805 1 726 . 1 1 88 88 ILE CD1 C 13 13.478 0.400 . 1 . . . A 88 ILE CD1 . 25805 1 727 . 1 1 88 88 ILE N N 15 119.480 0.400 . 1 . . . A 88 ILE N . 25805 1 728 . 1 1 89 89 LEU H H 1 9.229 0.020 . 1 . . . A 89 LEU H . 25805 1 729 . 1 1 89 89 LEU HA H 1 4.803 0.020 . 1 . . . A 89 LEU HA . 25805 1 730 . 1 1 89 89 LEU HB2 H 1 1.803 0.020 . 2 . . . A 89 LEU HB2 . 25805 1 731 . 1 1 89 89 LEU HB3 H 1 1.803 0.020 . 2 . . . A 89 LEU HB3 . 25805 1 732 . 1 1 89 89 LEU HG H 1 1.528 0.020 . 1 . . . A 89 LEU HG . 25805 1 733 . 1 1 89 89 LEU HD11 H 1 0.609 0.020 . 2 . . . A 89 LEU HD11 . 25805 1 734 . 1 1 89 89 LEU HD12 H 1 0.609 0.020 . 2 . . . A 89 LEU HD12 . 25805 1 735 . 1 1 89 89 LEU HD13 H 1 0.609 0.020 . 2 . . . A 89 LEU HD13 . 25805 1 736 . 1 1 89 89 LEU HD21 H 1 0.824 0.020 . 2 . . . A 89 LEU HD21 . 25805 1 737 . 1 1 89 89 LEU HD22 H 1 0.824 0.020 . 2 . . . A 89 LEU HD22 . 25805 1 738 . 1 1 89 89 LEU HD23 H 1 0.824 0.020 . 2 . . . A 89 LEU HD23 . 25805 1 739 . 1 1 89 89 LEU C C 13 176.827 0.400 . 1 . . . A 89 LEU C . 25805 1 740 . 1 1 89 89 LEU CA C 13 53.834 0.400 . 1 . . . A 89 LEU CA . 25805 1 741 . 1 1 89 89 LEU CB C 13 45.730 0.400 . 1 . . . A 89 LEU CB . 25805 1 742 . 1 1 89 89 LEU CG C 13 29.114 0.400 . 1 . . . A 89 LEU CG . 25805 1 743 . 1 1 89 89 LEU CD1 C 13 25.978 0.400 . 1 . . . A 89 LEU CD1 . 25805 1 744 . 1 1 89 89 LEU CD2 C 13 25.274 0.400 . 1 . . . A 89 LEU CD2 . 25805 1 745 . 1 1 89 89 LEU N N 15 128.407 0.400 . 1 . . . A 89 LEU N . 25805 1 746 . 1 1 90 90 GLY H H 1 9.597 0.020 . 1 . . . A 90 GLY H . 25805 1 747 . 1 1 90 90 GLY HA2 H 1 3.728 0.020 . 2 . . . A 90 GLY HA2 . 25805 1 748 . 1 1 90 90 GLY HA3 H 1 5.068 0.020 . 2 . . . A 90 GLY HA3 . 25805 1 749 . 1 1 90 90 GLY C C 13 173.271 0.400 . 1 . . . A 90 GLY C . 25805 1 750 . 1 1 90 90 GLY CA C 13 44.829 0.400 . 1 . . . A 90 GLY CA . 25805 1 751 . 1 1 90 90 GLY N N 15 110.397 0.400 . 1 . . . A 90 GLY N . 25805 1 752 . 1 1 91 91 LYS H H 1 8.180 0.020 . 1 . . . A 91 LYS H . 25805 1 753 . 1 1 91 91 LYS HA H 1 3.598 0.020 . 1 . . . A 91 LYS HA . 25805 1 754 . 1 1 91 91 LYS HB2 H 1 1.787 0.020 . 2 . . . A 91 LYS HB2 . 25805 1 755 . 1 1 91 91 LYS HB3 H 1 1.734 0.020 . 2 . . . A 91 LYS HB3 . 25805 1 756 . 1 1 91 91 LYS HG2 H 1 1.382 0.020 . 2 . . . A 91 LYS HG2 . 25805 1 757 . 1 1 91 91 LYS HG3 H 1 1.497 0.020 . 2 . . . A 91 LYS HG3 . 25805 1 758 . 1 1 91 91 LYS HD2 H 1 1.777 0.020 . 2 . . . A 91 LYS HD2 . 25805 1 759 . 1 1 91 91 LYS HD3 H 1 1.777 0.020 . 2 . . . A 91 LYS HD3 . 25805 1 760 . 1 1 91 91 LYS HE2 H 1 3.086 0.020 . 2 . . . A 91 LYS HE2 . 25805 1 761 . 1 1 91 91 LYS HE3 H 1 3.086 0.020 . 2 . . . A 91 LYS HE3 . 25805 1 762 . 1 1 91 91 LYS C C 13 177.206 0.400 . 1 . . . A 91 LYS C . 25805 1 763 . 1 1 91 91 LYS CA C 13 59.106 0.400 . 1 . . . A 91 LYS CA . 25805 1 764 . 1 1 91 91 LYS CB C 13 33.358 0.400 . 1 . . . A 91 LYS CB . 25805 1 765 . 1 1 91 91 LYS CG C 13 24.368 0.400 . 1 . . . A 91 LYS CG . 25805 1 766 . 1 1 91 91 LYS CD C 13 29.949 0.400 . 1 . . . A 91 LYS CD . 25805 1 767 . 1 1 91 91 LYS CE C 13 42.294 0.400 . 1 . . . A 91 LYS CE . 25805 1 768 . 1 1 91 91 LYS N N 15 119.610 0.400 . 1 . . . A 91 LYS N . 25805 1 769 . 1 1 92 92 ASN H H 1 9.003 0.020 . 1 . . . A 92 ASN H . 25805 1 770 . 1 1 92 92 ASN HA H 1 4.571 0.020 . 1 . . . A 92 ASN HA . 25805 1 771 . 1 1 92 92 ASN HB2 H 1 3.546 0.020 . 2 . . . A 92 ASN HB2 . 25805 1 772 . 1 1 92 92 ASN HB3 H 1 3.160 0.020 . 2 . . . A 92 ASN HB3 . 25805 1 773 . 1 1 92 92 ASN C C 13 176.969 0.400 . 1 . . . A 92 ASN C . 25805 1 774 . 1 1 92 92 ASN CA C 13 56.516 0.400 . 1 . . . A 92 ASN CA . 25805 1 775 . 1 1 92 92 ASN CB C 13 37.717 0.400 . 1 . . . A 92 ASN CB . 25805 1 776 . 1 1 92 92 ASN N N 15 116.827 0.400 . 1 . . . A 92 ASN N . 25805 1 777 . 1 1 93 93 ASP H H 1 8.573 0.020 . 1 . . . A 93 ASP H . 25805 1 778 . 1 1 93 93 ASP HA H 1 4.978 0.020 . 1 . . . A 93 ASP HA . 25805 1 779 . 1 1 93 93 ASP HB2 H 1 2.594 0.020 . 2 . . . A 93 ASP HB2 . 25805 1 780 . 1 1 93 93 ASP HB3 H 1 2.594 0.020 . 2 . . . A 93 ASP HB3 . 25805 1 781 . 1 1 93 93 ASP C C 13 175.405 0.400 . 1 . . . A 93 ASP C . 25805 1 782 . 1 1 93 93 ASP CA C 13 55.723 0.400 . 1 . . . A 93 ASP CA . 25805 1 783 . 1 1 93 93 ASP CB C 13 42.853 0.400 . 1 . . . A 93 ASP CB . 25805 1 784 . 1 1 93 93 ASP N N 15 121.261 0.400 . 1 . . . A 93 ASP N . 25805 1 785 . 1 1 94 94 ILE H H 1 8.525 0.020 . 1 . . . A 94 ILE H . 25805 1 786 . 1 1 94 94 ILE HA H 1 5.255 0.020 . 1 . . . A 94 ILE HA . 25805 1 787 . 1 1 94 94 ILE HB H 1 1.715 0.020 . 1 . . . A 94 ILE HB . 25805 1 788 . 1 1 94 94 ILE HG12 H 1 1.386 0.020 . 2 . . . A 94 ILE HG12 . 25805 1 789 . 1 1 94 94 ILE HG13 H 1 1.386 0.020 . 2 . . . A 94 ILE HG13 . 25805 1 790 . 1 1 94 94 ILE HG21 H 1 0.654 0.020 . 1 . . . A 94 ILE HG21 . 25805 1 791 . 1 1 94 94 ILE HG22 H 1 0.654 0.020 . 1 . . . A 94 ILE HG22 . 25805 1 792 . 1 1 94 94 ILE HG23 H 1 0.654 0.020 . 1 . . . A 94 ILE HG23 . 25805 1 793 . 1 1 94 94 ILE HD11 H 1 0.867 0.020 . 1 . . . A 94 ILE HD11 . 25805 1 794 . 1 1 94 94 ILE HD12 H 1 0.867 0.020 . 1 . . . A 94 ILE HD12 . 25805 1 795 . 1 1 94 94 ILE HD13 H 1 0.867 0.020 . 1 . . . A 94 ILE HD13 . 25805 1 796 . 1 1 94 94 ILE C C 13 176.400 0.400 . 1 . . . A 94 ILE C . 25805 1 797 . 1 1 94 94 ILE CA C 13 60.260 0.400 . 1 . . . A 94 ILE CA . 25805 1 798 . 1 1 94 94 ILE CB C 13 42.877 0.400 . 1 . . . A 94 ILE CB . 25805 1 799 . 1 1 94 94 ILE CG1 C 13 25.560 0.400 . 1 . . . A 94 ILE CG1 . 25805 1 800 . 1 1 94 94 ILE CG2 C 13 18.069 0.400 . 1 . . . A 94 ILE CG2 . 25805 1 801 . 1 1 94 94 ILE CD1 C 13 15.087 0.400 . 1 . . . A 94 ILE CD1 . 25805 1 802 . 1 1 94 94 ILE N N 15 118.832 0.400 . 1 . . . A 94 ILE N . 25805 1 803 . 1 1 95 95 PHE H H 1 8.772 0.020 . 1 . . . A 95 PHE H . 25805 1 804 . 1 1 95 95 PHE HA H 1 5.625 0.020 . 1 . . . A 95 PHE HA . 25805 1 805 . 1 1 95 95 PHE HB2 H 1 3.211 0.020 . 2 . . . A 95 PHE HB2 . 25805 1 806 . 1 1 95 95 PHE HB3 H 1 2.967 0.020 . 2 . . . A 95 PHE HB3 . 25805 1 807 . 1 1 95 95 PHE HD1 H 1 6.837 0.020 . 3 . . . A 95 PHE HD1 . 25805 1 808 . 1 1 95 95 PHE HD2 H 1 6.837 0.020 . 3 . . . A 95 PHE HD2 . 25805 1 809 . 1 1 95 95 PHE C C 13 173.081 0.400 . 1 . . . A 95 PHE C . 25805 1 810 . 1 1 95 95 PHE CA C 13 55.590 0.400 . 1 . . . A 95 PHE CA . 25805 1 811 . 1 1 95 95 PHE CB C 13 42.163 0.400 . 1 . . . A 95 PHE CB . 25805 1 812 . 1 1 95 95 PHE N N 15 120.215 0.400 . 1 . . . A 95 PHE N . 25805 1 813 . 1 1 96 96 GLY H H 1 7.672 0.020 . 1 . . . A 96 GLY H . 25805 1 814 . 1 1 96 96 GLY HA2 H 1 4.876 0.020 . 2 . . . A 96 GLY HA2 . 25805 1 815 . 1 1 96 96 GLY HA3 H 1 3.810 0.020 . 2 . . . A 96 GLY HA3 . 25805 1 816 . 1 1 96 96 GLY C C 13 170.735 0.400 . 1 . . . A 96 GLY C . 25805 1 817 . 1 1 96 96 GLY CA C 13 45.819 0.400 . 1 . . . A 96 GLY CA . 25805 1 818 . 1 1 96 96 GLY N N 15 104.673 0.400 . 1 . . . A 96 GLY N . 25805 1 819 . 1 1 97 97 GLU H H 1 8.750 0.020 . 1 . . . A 97 GLU H . 25805 1 820 . 1 1 97 97 GLU HA H 1 5.275 0.020 . 1 . . . A 97 GLU HA . 25805 1 821 . 1 1 97 97 GLU HB2 H 1 1.902 0.020 . 2 . . . A 97 GLU HB2 . 25805 1 822 . 1 1 97 97 GLU HB3 H 1 1.902 0.020 . 2 . . . A 97 GLU HB3 . 25805 1 823 . 1 1 97 97 GLU HG2 H 1 2.120 0.020 . 2 . . . A 97 GLU HG2 . 25805 1 824 . 1 1 97 97 GLU HG3 H 1 2.120 0.020 . 2 . . . A 97 GLU HG3 . 25805 1 825 . 1 1 97 97 GLU C C 13 173.579 0.400 . 1 . . . A 97 GLU C . 25805 1 826 . 1 1 97 97 GLU CA C 13 54.118 0.400 . 1 . . . A 97 GLU CA . 25805 1 827 . 1 1 97 97 GLU CB C 13 31.513 0.400 . 1 . . . A 97 GLU CB . 25805 1 828 . 1 1 97 97 GLU CG C 13 36.376 0.400 . 1 . . . A 97 GLU CG . 25805 1 829 . 1 1 97 97 GLU N N 15 122.862 0.400 . 1 . . . A 97 GLU N . 25805 1 830 . 1 1 98 98 PRO HA H 1 4.509 0.020 . 1 . . . A 98 PRO HA . 25805 1 831 . 1 1 98 98 PRO HB2 H 1 2.179 0.020 . 2 . . . A 98 PRO HB2 . 25805 1 832 . 1 1 98 98 PRO HB3 H 1 2.179 0.020 . 2 . . . A 98 PRO HB3 . 25805 1 833 . 1 1 98 98 PRO HG2 H 1 2.058 0.020 . 2 . . . A 98 PRO HG2 . 25805 1 834 . 1 1 98 98 PRO HG3 H 1 2.058 0.020 . 2 . . . A 98 PRO HG3 . 25805 1 835 . 1 1 98 98 PRO HD2 H 1 3.704 0.020 . 2 . . . A 98 PRO HD2 . 25805 1 836 . 1 1 98 98 PRO HD3 H 1 3.631 0.020 . 2 . . . A 98 PRO HD3 . 25805 1 837 . 1 1 98 98 PRO C C 13 177.088 0.400 . 1 . . . A 98 PRO C . 25805 1 838 . 1 1 98 98 PRO CA C 13 62.621 0.400 . 1 . . . A 98 PRO CA . 25805 1 839 . 1 1 98 98 PRO CB C 13 30.206 0.400 . 1 . . . A 98 PRO CB . 25805 1 840 . 1 1 98 98 PRO CG C 13 29.024 0.400 . 1 . . . A 98 PRO CG . 25805 1 841 . 1 1 98 98 PRO CD C 13 51.429 0.400 . 1 . . . A 98 PRO CD . 25805 1 842 . 1 1 99 99 LEU H H 1 7.806 0.020 . 1 . . . A 99 LEU H . 25805 1 843 . 1 1 99 99 LEU HA H 1 4.139 0.020 . 1 . . . A 99 LEU HA . 25805 1 844 . 1 1 99 99 LEU HB2 H 1 1.664 0.020 . 2 . . . A 99 LEU HB2 . 25805 1 845 . 1 1 99 99 LEU HB3 H 1 1.664 0.020 . 2 . . . A 99 LEU HB3 . 25805 1 846 . 1 1 99 99 LEU HD11 H 1 1.058 0.020 . 2 . . . A 99 LEU HD11 . 25805 1 847 . 1 1 99 99 LEU HD12 H 1 1.058 0.020 . 2 . . . A 99 LEU HD12 . 25805 1 848 . 1 1 99 99 LEU HD13 H 1 1.058 0.020 . 2 . . . A 99 LEU HD13 . 25805 1 849 . 1 1 99 99 LEU HD21 H 1 1.070 0.020 . 2 . . . A 99 LEU HD21 . 25805 1 850 . 1 1 99 99 LEU HD22 H 1 1.070 0.020 . 2 . . . A 99 LEU HD22 . 25805 1 851 . 1 1 99 99 LEU HD23 H 1 1.070 0.020 . 2 . . . A 99 LEU HD23 . 25805 1 852 . 1 1 99 99 LEU C C 13 176.092 0.400 . 1 . . . A 99 LEU C . 25805 1 853 . 1 1 99 99 LEU CA C 13 57.241 0.400 . 1 . . . A 99 LEU CA . 25805 1 854 . 1 1 99 99 LEU CB C 13 42.175 0.400 . 1 . . . A 99 LEU CB . 25805 1 855 . 1 1 99 99 LEU CD1 C 13 25.727 0.400 . 1 . . . A 99 LEU CD1 . 25805 1 856 . 1 1 99 99 LEU CD2 C 13 27.200 0.400 . 1 . . . A 99 LEU CD2 . 25805 1 857 . 1 1 99 99 LEU N N 15 124.194 0.400 . 1 . . . A 99 LEU N . 25805 1 858 . 1 1 100 100 ASN H H 1 7.597 0.020 . 1 . . . A 100 ASN H . 25805 1 859 . 1 1 100 100 ASN HA H 1 4.528 0.020 . 1 . . . A 100 ASN HA . 25805 1 860 . 1 1 100 100 ASN HB2 H 1 2.675 0.020 . 2 . . . A 100 ASN HB2 . 25805 1 861 . 1 1 100 100 ASN HB3 H 1 2.675 0.020 . 2 . . . A 100 ASN HB3 . 25805 1 862 . 1 1 100 100 ASN C C 13 176.389 0.400 . 1 . . . A 100 ASN C . 25805 1 863 . 1 1 100 100 ASN CA C 13 57.800 0.400 . 1 . . . A 100 ASN CA . 25805 1 864 . 1 1 100 100 ASN CB C 13 39.673 0.400 . 1 . . . A 100 ASN CB . 25805 1 865 . 1 1 100 100 ASN N N 15 116.587 0.400 . 1 . . . A 100 ASN N . 25805 1 866 . 1 1 101 101 LEU H H 1 7.541 0.020 . 1 . . . A 101 LEU H . 25805 1 867 . 1 1 101 101 LEU HA H 1 3.949 0.020 . 1 . . . A 101 LEU HA . 25805 1 868 . 1 1 101 101 LEU HB2 H 1 1.494 0.020 . 2 . . . A 101 LEU HB2 . 25805 1 869 . 1 1 101 101 LEU HB3 H 1 1.494 0.020 . 2 . . . A 101 LEU HB3 . 25805 1 870 . 1 1 101 101 LEU HD11 H 1 0.828 0.020 . 2 . . . A 101 LEU HD11 . 25805 1 871 . 1 1 101 101 LEU HD12 H 1 0.828 0.020 . 2 . . . A 101 LEU HD12 . 25805 1 872 . 1 1 101 101 LEU HD13 H 1 0.828 0.020 . 2 . . . A 101 LEU HD13 . 25805 1 873 . 1 1 101 101 LEU C C 13 176.803 0.400 . 1 . . . A 101 LEU C . 25805 1 874 . 1 1 101 101 LEU CA C 13 55.683 0.400 . 1 . . . A 101 LEU CA . 25805 1 875 . 1 1 101 101 LEU CB C 13 42.365 0.400 . 1 . . . A 101 LEU CB . 25805 1 876 . 1 1 101 101 LEU N N 15 121.766 0.400 . 1 . . . A 101 LEU N . 25805 1 877 . 1 1 102 102 TYR H H 1 7.250 0.020 . 1 . . . A 102 TYR H . 25805 1 878 . 1 1 102 102 TYR HA H 1 5.030 0.020 . 1 . . . A 102 TYR HA . 25805 1 879 . 1 1 102 102 TYR HB2 H 1 2.972 0.020 . 2 . . . A 102 TYR HB2 . 25805 1 880 . 1 1 102 102 TYR HB3 H 1 2.972 0.020 . 2 . . . A 102 TYR HB3 . 25805 1 881 . 1 1 102 102 TYR C C 13 174.739 0.400 . 1 . . . A 102 TYR C . 25805 1 882 . 1 1 102 102 TYR CA C 13 57.114 0.400 . 1 . . . A 102 TYR CA . 25805 1 883 . 1 1 102 102 TYR CB C 13 40.747 0.400 . 1 . . . A 102 TYR CB . 25805 1 884 . 1 1 102 102 TYR N N 15 116.145 0.400 . 1 . . . A 102 TYR N . 25805 1 885 . 1 1 103 103 ALA H H 1 9.158 0.020 . 1 . . . A 103 ALA H . 25805 1 886 . 1 1 103 103 ALA HA H 1 4.228 0.020 . 1 . . . A 103 ALA HA . 25805 1 887 . 1 1 103 103 ALA HB1 H 1 1.420 0.020 . 1 . . . A 103 ALA HB1 . 25805 1 888 . 1 1 103 103 ALA HB2 H 1 1.420 0.020 . 1 . . . A 103 ALA HB2 . 25805 1 889 . 1 1 103 103 ALA HB3 H 1 1.420 0.020 . 1 . . . A 103 ALA HB3 . 25805 1 890 . 1 1 103 103 ALA C C 13 177.941 0.400 . 1 . . . A 103 ALA C . 25805 1 891 . 1 1 103 103 ALA CA C 13 53.578 0.400 . 1 . . . A 103 ALA CA . 25805 1 892 . 1 1 103 103 ALA CB C 13 20.048 0.400 . 1 . . . A 103 ALA CB . 25805 1 893 . 1 1 103 103 ALA N N 15 122.263 0.400 . 1 . . . A 103 ALA N . 25805 1 894 . 1 1 104 104 ARG H H 1 7.988 0.020 . 1 . . . A 104 ARG H . 25805 1 895 . 1 1 104 104 ARG C C 13 174.314 0.400 . 1 . . . A 104 ARG C . 25805 1 896 . 1 1 104 104 ARG CA C 13 53.273 0.400 . 1 . . . A 104 ARG CA . 25805 1 897 . 1 1 104 104 ARG CB C 13 31.142 0.400 . 1 . . . A 104 ARG CB . 25805 1 898 . 1 1 104 104 ARG N N 15 116.897 0.400 . 1 . . . A 104 ARG N . 25805 1 899 . 1 1 105 105 PRO HA H 1 4.621 0.020 . 1 . . . A 105 PRO HA . 25805 1 900 . 1 1 105 105 PRO HB2 H 1 2.287 0.020 . 2 . . . A 105 PRO HB2 . 25805 1 901 . 1 1 105 105 PRO HB3 H 1 1.905 0.020 . 2 . . . A 105 PRO HB3 . 25805 1 902 . 1 1 105 105 PRO HG2 H 1 2.111 0.020 . 2 . . . A 105 PRO HG2 . 25805 1 903 . 1 1 105 105 PRO HG3 H 1 1.908 0.020 . 2 . . . A 105 PRO HG3 . 25805 1 904 . 1 1 105 105 PRO HD2 H 1 3.691 0.020 . 2 . . . A 105 PRO HD2 . 25805 1 905 . 1 1 105 105 PRO HD3 H 1 3.691 0.020 . 2 . . . A 105 PRO HD3 . 25805 1 906 . 1 1 105 105 PRO C C 13 177.420 0.400 . 1 . . . A 105 PRO C . 25805 1 907 . 1 1 105 105 PRO CA C 13 63.416 0.400 . 1 . . . A 105 PRO CA . 25805 1 908 . 1 1 105 105 PRO CB C 13 32.961 0.400 . 1 . . . A 105 PRO CB . 25805 1 909 . 1 1 105 105 PRO CG C 13 27.868 0.400 . 1 . . . A 105 PRO CG . 25805 1 910 . 1 1 105 105 PRO CD C 13 51.354 0.400 . 1 . . . A 105 PRO CD . 25805 1 911 . 1 1 106 106 GLY H H 1 9.888 0.020 . 1 . . . A 106 GLY H . 25805 1 912 . 1 1 106 106 GLY HA2 H 1 3.528 0.020 . 2 . . . A 106 GLY HA2 . 25805 1 913 . 1 1 106 106 GLY HA3 H 1 4.225 0.020 . 2 . . . A 106 GLY HA3 . 25805 1 914 . 1 1 106 106 GLY C C 13 171.873 0.400 . 1 . . . A 106 GLY C . 25805 1 915 . 1 1 106 106 GLY CA C 13 44.064 0.400 . 1 . . . A 106 GLY CA . 25805 1 916 . 1 1 106 106 GLY N N 15 113.736 0.400 . 1 . . . A 106 GLY N . 25805 1 917 . 1 1 107 107 LYS H H 1 8.342 0.020 . 1 . . . A 107 LYS H . 25805 1 918 . 1 1 107 107 LYS HA H 1 4.908 0.020 . 1 . . . A 107 LYS HA . 25805 1 919 . 1 1 107 107 LYS HB2 H 1 1.720 0.020 . 2 . . . A 107 LYS HB2 . 25805 1 920 . 1 1 107 107 LYS HB3 H 1 1.606 0.020 . 2 . . . A 107 LYS HB3 . 25805 1 921 . 1 1 107 107 LYS HG2 H 1 1.534 0.020 . 2 . . . A 107 LYS HG2 . 25805 1 922 . 1 1 107 107 LYS HG3 H 1 1.575 0.020 . 2 . . . A 107 LYS HG3 . 25805 1 923 . 1 1 107 107 LYS HD2 H 1 1.756 0.020 . 2 . . . A 107 LYS HD2 . 25805 1 924 . 1 1 107 107 LYS HD3 H 1 1.710 0.020 . 2 . . . A 107 LYS HD3 . 25805 1 925 . 1 1 107 107 LYS HE2 H 1 3.047 0.020 . 2 . . . A 107 LYS HE2 . 25805 1 926 . 1 1 107 107 LYS HE3 H 1 3.047 0.020 . 2 . . . A 107 LYS HE3 . 25805 1 927 . 1 1 107 107 LYS C C 13 177.088 0.400 . 1 . . . A 107 LYS C . 25805 1 928 . 1 1 107 107 LYS CA C 13 54.582 0.400 . 1 . . . A 107 LYS CA . 25805 1 929 . 1 1 107 107 LYS CB C 13 35.634 0.400 . 1 . . . A 107 LYS CB . 25805 1 930 . 1 1 107 107 LYS CG C 13 25.183 0.400 . 1 . . . A 107 LYS CG . 25805 1 931 . 1 1 107 107 LYS CD C 13 29.389 0.400 . 1 . . . A 107 LYS CD . 25805 1 932 . 1 1 107 107 LYS CE C 13 42.694 0.400 . 1 . . . A 107 LYS CE . 25805 1 933 . 1 1 107 107 LYS N N 15 116.961 0.400 . 1 . . . A 107 LYS N . 25805 1 934 . 1 1 108 108 SER H H 1 8.933 0.020 . 1 . . . A 108 SER H . 25805 1 935 . 1 1 108 108 SER HA H 1 4.482 0.020 . 1 . . . A 108 SER HA . 25805 1 936 . 1 1 108 108 SER HB2 H 1 4.314 0.020 . 2 . . . A 108 SER HB2 . 25805 1 937 . 1 1 108 108 SER HB3 H 1 3.761 0.020 . 2 . . . A 108 SER HB3 . 25805 1 938 . 1 1 108 108 SER C C 13 179.004 0.400 . 1 . . . A 108 SER C . 25805 1 939 . 1 1 108 108 SER CA C 13 58.760 0.400 . 1 . . . A 108 SER CA . 25805 1 940 . 1 1 108 108 SER CB C 13 64.108 0.400 . 1 . . . A 108 SER CB . 25805 1 941 . 1 1 108 108 SER N N 15 111.560 0.400 . 1 . . . A 108 SER N . 25805 1 942 . 1 1 109 109 ASN H H 1 10.119 0.020 . 1 . . . A 109 ASN H . 25805 1 943 . 1 1 109 109 ASN HA H 1 4.601 0.020 . 1 . . . A 109 ASN HA . 25805 1 944 . 1 1 109 109 ASN HB2 H 1 2.614 0.020 . 2 . . . A 109 ASN HB2 . 25805 1 945 . 1 1 109 109 ASN HB3 H 1 3.193 0.020 . 2 . . . A 109 ASN HB3 . 25805 1 946 . 1 1 109 109 ASN C C 13 176.424 0.400 . 1 . . . A 109 ASN C . 25805 1 947 . 1 1 109 109 ASN CA C 13 53.240 0.400 . 1 . . . A 109 ASN CA . 25805 1 948 . 1 1 109 109 ASN CB C 13 38.478 0.400 . 1 . . . A 109 ASN CB . 25805 1 949 . 1 1 109 109 ASN N N 15 129.582 0.400 . 1 . . . A 109 ASN N . 25805 1 950 . 1 1 110 110 GLY H H 1 7.903 0.020 . 1 . . . A 110 GLY H . 25805 1 951 . 1 1 110 110 GLY HA2 H 1 4.665 0.020 . 2 . . . A 110 GLY HA2 . 25805 1 952 . 1 1 110 110 GLY HA3 H 1 3.413 0.020 . 2 . . . A 110 GLY HA3 . 25805 1 953 . 1 1 110 110 GLY C C 13 171.920 0.400 . 1 . . . A 110 GLY C . 25805 1 954 . 1 1 110 110 GLY CA C 13 45.666 0.400 . 1 . . . A 110 GLY CA . 25805 1 955 . 1 1 110 110 GLY N N 15 106.459 0.400 . 1 . . . A 110 GLY N . 25805 1 956 . 1 1 111 111 ASP H H 1 8.716 0.020 . 1 . . . A 111 ASP H . 25805 1 957 . 1 1 111 111 ASP HA H 1 5.148 0.020 . 1 . . . A 111 ASP HA . 25805 1 958 . 1 1 111 111 ASP HB2 H 1 2.367 0.020 . 2 . . . A 111 ASP HB2 . 25805 1 959 . 1 1 111 111 ASP HB3 H 1 2.504 0.020 . 2 . . . A 111 ASP HB3 . 25805 1 960 . 1 1 111 111 ASP C C 13 175.547 0.400 . 1 . . . A 111 ASP C . 25805 1 961 . 1 1 111 111 ASP CA C 13 53.242 0.400 . 1 . . . A 111 ASP CA . 25805 1 962 . 1 1 111 111 ASP CB C 13 43.899 0.400 . 1 . . . A 111 ASP CB . 25805 1 963 . 1 1 111 111 ASP N N 15 119.231 0.400 . 1 . . . A 111 ASP N . 25805 1 964 . 1 1 112 112 VAL H H 1 8.797 0.020 . 1 . . . A 112 VAL H . 25805 1 965 . 1 1 112 112 VAL HA H 1 4.394 0.020 . 1 . . . A 112 VAL HA . 25805 1 966 . 1 1 112 112 VAL HB H 1 1.612 0.020 . 1 . . . A 112 VAL HB . 25805 1 967 . 1 1 112 112 VAL HG11 H 1 0.431 0.020 . 2 . . . A 112 VAL HG11 . 25805 1 968 . 1 1 112 112 VAL HG12 H 1 0.431 0.020 . 2 . . . A 112 VAL HG12 . 25805 1 969 . 1 1 112 112 VAL HG13 H 1 0.431 0.020 . 2 . . . A 112 VAL HG13 . 25805 1 970 . 1 1 112 112 VAL HG21 H 1 0.223 0.020 . 2 . . . A 112 VAL HG21 . 25805 1 971 . 1 1 112 112 VAL HG22 H 1 0.223 0.020 . 2 . . . A 112 VAL HG22 . 25805 1 972 . 1 1 112 112 VAL HG23 H 1 0.223 0.020 . 2 . . . A 112 VAL HG23 . 25805 1 973 . 1 1 112 112 VAL C C 13 175.227 0.400 . 1 . . . A 112 VAL C . 25805 1 974 . 1 1 112 112 VAL CA C 13 61.585 0.400 . 1 . . . A 112 VAL CA . 25805 1 975 . 1 1 112 112 VAL CB C 13 33.262 0.400 . 1 . . . A 112 VAL CB . 25805 1 976 . 1 1 112 112 VAL CG1 C 13 21.050 0.400 . 1 . . . A 112 VAL CG1 . 25805 1 977 . 1 1 112 112 VAL CG2 C 13 22.259 0.400 . 1 . . . A 112 VAL CG2 . 25805 1 978 . 1 1 112 112 VAL N N 15 121.094 0.400 . 1 . . . A 112 VAL N . 25805 1 979 . 1 1 113 113 ARG H H 1 9.301 0.020 . 1 . . . A 113 ARG H . 25805 1 980 . 1 1 113 113 ARG HA H 1 5.287 0.020 . 1 . . . A 113 ARG HA . 25805 1 981 . 1 1 113 113 ARG HB2 H 1 1.654 0.020 . 2 . . . A 113 ARG HB2 . 25805 1 982 . 1 1 113 113 ARG HB3 H 1 1.411 0.020 . 2 . . . A 113 ARG HB3 . 25805 1 983 . 1 1 113 113 ARG HG2 H 1 1.407 0.020 . 2 . . . A 113 ARG HG2 . 25805 1 984 . 1 1 113 113 ARG HG3 H 1 1.254 0.020 . 2 . . . A 113 ARG HG3 . 25805 1 985 . 1 1 113 113 ARG HD2 H 1 2.963 0.020 . 2 . . . A 113 ARG HD2 . 25805 1 986 . 1 1 113 113 ARG HD3 H 1 2.963 0.020 . 2 . . . A 113 ARG HD3 . 25805 1 987 . 1 1 113 113 ARG C C 13 175.096 0.400 . 1 . . . A 113 ARG C . 25805 1 988 . 1 1 113 113 ARG CA C 13 54.395 0.400 . 1 . . . A 113 ARG CA . 25805 1 989 . 1 1 113 113 ARG CB C 13 35.537 0.400 . 1 . . . A 113 ARG CB . 25805 1 990 . 1 1 113 113 ARG CG C 13 26.290 0.400 . 1 . . . A 113 ARG CG . 25805 1 991 . 1 1 113 113 ARG CD C 13 44.367 0.400 . 1 . . . A 113 ARG CD . 25805 1 992 . 1 1 113 113 ARG N N 15 128.067 0.400 . 1 . . . A 113 ARG N . 25805 1 993 . 1 1 114 114 ALA H H 1 8.601 0.020 . 1 . . . A 114 ALA H . 25805 1 994 . 1 1 114 114 ALA HA H 1 4.332 0.020 . 1 . . . A 114 ALA HA . 25805 1 995 . 1 1 114 114 ALA HB1 H 1 1.492 0.020 . 1 . . . A 114 ALA HB1 . 25805 1 996 . 1 1 114 114 ALA HB2 H 1 1.492 0.020 . 1 . . . A 114 ALA HB2 . 25805 1 997 . 1 1 114 114 ALA HB3 H 1 1.492 0.020 . 1 . . . A 114 ALA HB3 . 25805 1 998 . 1 1 114 114 ALA C C 13 178.273 0.400 . 1 . . . A 114 ALA C . 25805 1 999 . 1 1 114 114 ALA CA C 13 53.593 0.400 . 1 . . . A 114 ALA CA . 25805 1 1000 . 1 1 114 114 ALA CB C 13 19.438 0.400 . 1 . . . A 114 ALA CB . 25805 1 1001 . 1 1 114 114 ALA N N 15 127.598 0.400 . 1 . . . A 114 ALA N . 25805 1 1002 . 1 1 115 115 LEU H H 1 9.087 0.020 . 1 . . . A 115 LEU H . 25805 1 1003 . 1 1 115 115 LEU HA H 1 4.441 0.020 . 1 . . . A 115 LEU HA . 25805 1 1004 . 1 1 115 115 LEU HB2 H 1 1.563 0.020 . 2 . . . A 115 LEU HB2 . 25805 1 1005 . 1 1 115 115 LEU HB3 H 1 1.393 0.020 . 2 . . . A 115 LEU HB3 . 25805 1 1006 . 1 1 115 115 LEU HG H 1 1.447 0.020 . 1 . . . A 115 LEU HG . 25805 1 1007 . 1 1 115 115 LEU HD11 H 1 0.804 0.020 . 2 . . . A 115 LEU HD11 . 25805 1 1008 . 1 1 115 115 LEU HD12 H 1 0.804 0.020 . 2 . . . A 115 LEU HD12 . 25805 1 1009 . 1 1 115 115 LEU HD13 H 1 0.804 0.020 . 2 . . . A 115 LEU HD13 . 25805 1 1010 . 1 1 115 115 LEU HD21 H 1 0.821 0.020 . 2 . . . A 115 LEU HD21 . 25805 1 1011 . 1 1 115 115 LEU HD22 H 1 0.821 0.020 . 2 . . . A 115 LEU HD22 . 25805 1 1012 . 1 1 115 115 LEU HD23 H 1 0.821 0.020 . 2 . . . A 115 LEU HD23 . 25805 1 1013 . 1 1 115 115 LEU C C 13 177.372 0.400 . 1 . . . A 115 LEU C . 25805 1 1014 . 1 1 115 115 LEU CA C 13 56.921 0.400 . 1 . . . A 115 LEU CA . 25805 1 1015 . 1 1 115 115 LEU CB C 13 44.219 0.400 . 1 . . . A 115 LEU CB . 25805 1 1016 . 1 1 115 115 LEU CG C 13 27.744 0.400 . 1 . . . A 115 LEU CG . 25805 1 1017 . 1 1 115 115 LEU CD1 C 13 24.824 0.400 . 1 . . . A 115 LEU CD1 . 25805 1 1018 . 1 1 115 115 LEU CD2 C 13 25.158 0.400 . 1 . . . A 115 LEU CD2 . 25805 1 1019 . 1 1 115 115 LEU N N 15 128.676 0.400 . 1 . . . A 115 LEU N . 25805 1 1020 . 1 1 116 116 THR H H 1 7.241 0.020 . 1 . . . A 116 THR H . 25805 1 1021 . 1 1 116 116 THR HA H 1 4.553 0.020 . 1 . . . A 116 THR HA . 25805 1 1022 . 1 1 116 116 THR HB H 1 4.715 0.020 . 1 . . . A 116 THR HB . 25805 1 1023 . 1 1 116 116 THR HG21 H 1 1.158 0.020 . 1 . . . A 116 THR HG21 . 25805 1 1024 . 1 1 116 116 THR HG22 H 1 1.158 0.020 . 1 . . . A 116 THR HG22 . 25805 1 1025 . 1 1 116 116 THR HG23 H 1 1.158 0.020 . 1 . . . A 116 THR HG23 . 25805 1 1026 . 1 1 116 116 THR C C 13 173.864 0.400 . 1 . . . A 116 THR C . 25805 1 1027 . 1 1 116 116 THR CA C 13 59.524 0.400 . 1 . . . A 116 THR CA . 25805 1 1028 . 1 1 116 116 THR CB C 13 72.692 0.400 . 1 . . . A 116 THR CB . 25805 1 1029 . 1 1 116 116 THR CG2 C 13 21.378 0.400 . 1 . . . A 116 THR CG2 . 25805 1 1030 . 1 1 116 116 THR N N 15 108.470 0.400 . 1 . . . A 116 THR N . 25805 1 1031 . 1 1 117 117 TYR H H 1 8.193 0.020 . 1 . . . A 117 TYR H . 25805 1 1032 . 1 1 117 117 TYR HA H 1 4.687 0.020 . 1 . . . A 117 TYR HA . 25805 1 1033 . 1 1 117 117 TYR HB2 H 1 2.948 0.020 . 2 . . . A 117 TYR HB2 . 25805 1 1034 . 1 1 117 117 TYR HB3 H 1 2.919 0.020 . 2 . . . A 117 TYR HB3 . 25805 1 1035 . 1 1 117 117 TYR HD1 H 1 7.154 0.020 . 3 . . . A 117 TYR HD1 . 25805 1 1036 . 1 1 117 117 TYR HD2 H 1 7.154 0.020 . 3 . . . A 117 TYR HD2 . 25805 1 1037 . 1 1 117 117 TYR C C 13 178.818 0.400 . 1 . . . A 117 TYR C . 25805 1 1038 . 1 1 117 117 TYR CA C 13 61.012 0.400 . 1 . . . A 117 TYR CA . 25805 1 1039 . 1 1 117 117 TYR CB C 13 38.441 0.400 . 1 . . . A 117 TYR CB . 25805 1 1040 . 1 1 117 117 TYR N N 15 117.884 0.400 . 1 . . . A 117 TYR N . 25805 1 1041 . 1 1 118 118 CYS H H 1 8.988 0.020 . 1 . . . A 118 CYS H . 25805 1 1042 . 1 1 118 118 CYS HA H 1 5.320 0.020 . 1 . . . A 118 CYS HA . 25805 1 1043 . 1 1 118 118 CYS HB2 H 1 2.801 0.020 . 2 . . . A 118 CYS HB2 . 25805 1 1044 . 1 1 118 118 CYS HB3 H 1 2.486 0.020 . 2 . . . A 118 CYS HB3 . 25805 1 1045 . 1 1 118 118 CYS C C 13 173.484 0.400 . 1 . . . A 118 CYS C . 25805 1 1046 . 1 1 118 118 CYS CA C 13 57.717 0.400 . 1 . . . A 118 CYS CA . 25805 1 1047 . 1 1 118 118 CYS CB C 13 31.898 0.400 . 1 . . . A 118 CYS CB . 25805 1 1048 . 1 1 118 118 CYS N N 15 125.184 0.400 . 1 . . . A 118 CYS N . 25805 1 1049 . 1 1 119 119 ASP H H 1 8.381 0.020 . 1 . . . A 119 ASP H . 25805 1 1050 . 1 1 119 119 ASP HA H 1 5.395 0.020 . 1 . . . A 119 ASP HA . 25805 1 1051 . 1 1 119 119 ASP HB2 H 1 2.795 0.020 . 2 . . . A 119 ASP HB2 . 25805 1 1052 . 1 1 119 119 ASP HB3 H 1 2.425 0.020 . 2 . . . A 119 ASP HB3 . 25805 1 1053 . 1 1 119 119 ASP C C 13 174.077 0.400 . 1 . . . A 119 ASP C . 25805 1 1054 . 1 1 119 119 ASP CA C 13 54.072 0.400 . 1 . . . A 119 ASP CA . 25805 1 1055 . 1 1 119 119 ASP CB C 13 43.245 0.400 . 1 . . . A 119 ASP CB . 25805 1 1056 . 1 1 119 119 ASP N N 15 123.053 0.400 . 1 . . . A 119 ASP N . 25805 1 1057 . 1 1 120 120 LEU H H 1 8.755 0.020 . 1 . . . A 120 LEU H . 25805 1 1058 . 1 1 120 120 LEU HA H 1 4.977 0.020 . 1 . . . A 120 LEU HA . 25805 1 1059 . 1 1 120 120 LEU HB2 H 1 1.675 0.020 . 2 . . . A 120 LEU HB2 . 25805 1 1060 . 1 1 120 120 LEU HB3 H 1 1.675 0.020 . 2 . . . A 120 LEU HB3 . 25805 1 1061 . 1 1 120 120 LEU HG H 1 1.518 0.020 . 1 . . . A 120 LEU HG . 25805 1 1062 . 1 1 120 120 LEU HD11 H 1 0.935 0.020 . 2 . . . A 120 LEU HD11 . 25805 1 1063 . 1 1 120 120 LEU HD12 H 1 0.935 0.020 . 2 . . . A 120 LEU HD12 . 25805 1 1064 . 1 1 120 120 LEU HD13 H 1 0.935 0.020 . 2 . . . A 120 LEU HD13 . 25805 1 1065 . 1 1 120 120 LEU HD21 H 1 1.013 0.020 . 2 . . . A 120 LEU HD21 . 25805 1 1066 . 1 1 120 120 LEU HD22 H 1 1.013 0.020 . 2 . . . A 120 LEU HD22 . 25805 1 1067 . 1 1 120 120 LEU HD23 H 1 1.013 0.020 . 2 . . . A 120 LEU HD23 . 25805 1 1068 . 1 1 120 120 LEU C C 13 174.693 0.400 . 1 . . . A 120 LEU C . 25805 1 1069 . 1 1 120 120 LEU CA C 13 53.738 0.400 . 1 . . . A 120 LEU CA . 25805 1 1070 . 1 1 120 120 LEU CB C 13 45.906 0.400 . 1 . . . A 120 LEU CB . 25805 1 1071 . 1 1 120 120 LEU CD1 C 13 27.096 0.400 . 1 . . . A 120 LEU CD1 . 25805 1 1072 . 1 1 120 120 LEU CD2 C 13 24.724 0.400 . 1 . . . A 120 LEU CD2 . 25805 1 1073 . 1 1 120 120 LEU N N 15 122.640 0.400 . 1 . . . A 120 LEU N . 25805 1 1074 . 1 1 121 121 HIS H H 1 9.116 0.020 . 1 . . . A 121 HIS H . 25805 1 1075 . 1 1 121 121 HIS HA H 1 5.589 0.020 . 1 . . . A 121 HIS HA . 25805 1 1076 . 1 1 121 121 HIS HB2 H 1 2.818 0.020 . 2 . . . A 121 HIS HB2 . 25805 1 1077 . 1 1 121 121 HIS HB3 H 1 2.818 0.020 . 2 . . . A 121 HIS HB3 . 25805 1 1078 . 1 1 121 121 HIS C C 13 174.551 0.400 . 1 . . . A 121 HIS C . 25805 1 1079 . 1 1 121 121 HIS CA C 13 54.487 0.400 . 1 . . . A 121 HIS CA . 25805 1 1080 . 1 1 121 121 HIS CB C 13 31.799 0.400 . 1 . . . A 121 HIS CB . 25805 1 1081 . 1 1 121 121 HIS N N 15 122.427 0.400 . 1 . . . A 121 HIS N . 25805 1 1082 . 1 1 122 122 LYS H H 1 9.496 0.020 . 1 . . . A 122 LYS H . 25805 1 1083 . 1 1 122 122 LYS HA H 1 5.581 0.020 . 1 . . . A 122 LYS HA . 25805 1 1084 . 1 1 122 122 LYS HB2 H 1 1.285 0.020 . 2 . . . A 122 LYS HB2 . 25805 1 1085 . 1 1 122 122 LYS HB3 H 1 1.050 0.020 . 2 . . . A 122 LYS HB3 . 25805 1 1086 . 1 1 122 122 LYS HG2 H 1 1.047 0.020 . 2 . . . A 122 LYS HG2 . 25805 1 1087 . 1 1 122 122 LYS HD2 H 1 1.439 0.020 . 2 . . . A 122 LYS HD2 . 25805 1 1088 . 1 1 122 122 LYS HD3 H 1 1.287 0.020 . 2 . . . A 122 LYS HD3 . 25805 1 1089 . 1 1 122 122 LYS HE2 H 1 2.692 0.020 . 2 . . . A 122 LYS HE2 . 25805 1 1090 . 1 1 122 122 LYS HE3 H 1 2.692 0.020 . 2 . . . A 122 LYS HE3 . 25805 1 1091 . 1 1 122 122 LYS C C 13 175.973 0.400 . 1 . . . A 122 LYS C . 25805 1 1092 . 1 1 122 122 LYS CA C 13 53.951 0.400 . 1 . . . A 122 LYS CA . 25805 1 1093 . 1 1 122 122 LYS CB C 13 37.161 0.400 . 1 . . . A 122 LYS CB . 25805 1 1094 . 1 1 122 122 LYS CG C 13 24.800 0.400 . 1 . . . A 122 LYS CG . 25805 1 1095 . 1 1 122 122 LYS CD C 13 30.647 0.400 . 1 . . . A 122 LYS CD . 25805 1 1096 . 1 1 122 122 LYS CE C 13 42.340 0.400 . 1 . . . A 122 LYS CE . 25805 1 1097 . 1 1 122 122 LYS N N 15 122.853 0.400 . 1 . . . A 122 LYS N . 25805 1 1098 . 1 1 123 123 ILE H H 1 8.366 0.020 . 1 . . . A 123 ILE H . 25805 1 1099 . 1 1 123 123 ILE HA H 1 4.433 0.020 . 1 . . . A 123 ILE HA . 25805 1 1100 . 1 1 123 123 ILE HB H 1 1.658 0.020 . 1 . . . A 123 ILE HB . 25805 1 1101 . 1 1 123 123 ILE HG12 H 1 1.105 0.020 . 2 . . . A 123 ILE HG12 . 25805 1 1102 . 1 1 123 123 ILE HG13 H 1 1.325 0.020 . 2 . . . A 123 ILE HG13 . 25805 1 1103 . 1 1 123 123 ILE HG21 H 1 0.713 0.020 . 1 . . . A 123 ILE HG21 . 25805 1 1104 . 1 1 123 123 ILE HG22 H 1 0.713 0.020 . 1 . . . A 123 ILE HG22 . 25805 1 1105 . 1 1 123 123 ILE HG23 H 1 0.713 0.020 . 1 . . . A 123 ILE HG23 . 25805 1 1106 . 1 1 123 123 ILE HD11 H 1 0.381 0.020 . 1 . . . A 123 ILE HD11 . 25805 1 1107 . 1 1 123 123 ILE HD12 H 1 0.381 0.020 . 1 . . . A 123 ILE HD12 . 25805 1 1108 . 1 1 123 123 ILE HD13 H 1 0.381 0.020 . 1 . . . A 123 ILE HD13 . 25805 1 1109 . 1 1 123 123 ILE C C 13 173.277 0.400 . 1 . . . A 123 ILE C . 25805 1 1110 . 1 1 123 123 ILE CA C 13 58.206 0.400 . 1 . . . A 123 ILE CA . 25805 1 1111 . 1 1 123 123 ILE CB C 13 37.083 0.400 . 1 . . . A 123 ILE CB . 25805 1 1112 . 1 1 123 123 ILE CG1 C 13 28.979 0.400 . 1 . . . A 123 ILE CG1 . 25805 1 1113 . 1 1 123 123 ILE CG2 C 13 16.427 0.400 . 1 . . . A 123 ILE CG2 . 25805 1 1114 . 1 1 123 123 ILE CD1 C 13 14.938 0.400 . 1 . . . A 123 ILE CD1 . 25805 1 1115 . 1 1 123 123 ILE N N 15 121.118 0.400 . 1 . . . A 123 ILE N . 25805 1 1116 . 1 1 124 124 HIS H H 1 9.313 0.020 . 1 . . . A 124 HIS H . 25805 1 1117 . 1 1 124 124 HIS HA H 1 4.400 0.020 . 1 . . . A 124 HIS HA . 25805 1 1118 . 1 1 124 124 HIS HB2 H 1 3.154 0.020 . 2 . . . A 124 HIS HB2 . 25805 1 1119 . 1 1 124 124 HIS HB3 H 1 3.027 0.020 . 2 . . . A 124 HIS HB3 . 25805 1 1120 . 1 1 124 124 HIS C C 13 177.680 0.400 . 1 . . . A 124 HIS C . 25805 1 1121 . 1 1 124 124 HIS CA C 13 58.027 0.400 . 1 . . . A 124 HIS CA . 25805 1 1122 . 1 1 124 124 HIS CB C 13 31.329 0.400 . 1 . . . A 124 HIS CB . 25805 1 1123 . 1 1 124 124 HIS N N 15 128.709 0.400 . 1 . . . A 124 HIS N . 25805 1 1124 . 1 1 125 125 ARG H H 1 8.950 0.020 . 1 . . . A 125 ARG H . 25805 1 1125 . 1 1 125 125 ARG HA H 1 3.925 0.020 . 1 . . . A 125 ARG HA . 25805 1 1126 . 1 1 125 125 ARG HB2 H 1 1.670 0.020 . 2 . . . A 125 ARG HB2 . 25805 1 1127 . 1 1 125 125 ARG HB3 H 1 1.885 0.020 . 2 . . . A 125 ARG HB3 . 25805 1 1128 . 1 1 125 125 ARG HG2 H 1 1.383 0.020 . 2 . . . A 125 ARG HG2 . 25805 1 1129 . 1 1 125 125 ARG HG3 H 1 1.515 0.020 . 2 . . . A 125 ARG HG3 . 25805 1 1130 . 1 1 125 125 ARG HD2 H 1 3.038 0.020 . 2 . . . A 125 ARG HD2 . 25805 1 1131 . 1 1 125 125 ARG HD3 H 1 3.038 0.020 . 2 . . . A 125 ARG HD3 . 25805 1 1132 . 1 1 125 125 ARG C C 13 177.182 0.400 . 1 . . . A 125 ARG C . 25805 1 1133 . 1 1 125 125 ARG CA C 13 60.158 0.400 . 1 . . . A 125 ARG CA . 25805 1 1134 . 1 1 125 125 ARG CB C 13 31.112 0.400 . 1 . . . A 125 ARG CB . 25805 1 1135 . 1 1 125 125 ARG CG C 13 25.926 0.400 . 1 . . . A 125 ARG CG . 25805 1 1136 . 1 1 125 125 ARG CD C 13 42.151 0.400 . 1 . . . A 125 ARG CD . 25805 1 1137 . 1 1 125 125 ARG N N 15 127.229 0.400 . 1 . . . A 125 ARG N . 25805 1 1138 . 1 1 126 126 ASP H H 1 10.457 0.020 . 1 . . . A 126 ASP H . 25805 1 1139 . 1 1 126 126 ASP HA H 1 4.475 0.020 . 1 . . . A 126 ASP HA . 25805 1 1140 . 1 1 126 126 ASP HB2 H 1 2.676 0.020 . 2 . . . A 126 ASP HB2 . 25805 1 1141 . 1 1 126 126 ASP HB3 H 1 2.676 0.020 . 2 . . . A 126 ASP HB3 . 25805 1 1142 . 1 1 126 126 ASP C C 13 179.932 0.400 . 1 . . . A 126 ASP C . 25805 1 1143 . 1 1 126 126 ASP CA C 13 57.988 0.400 . 1 . . . A 126 ASP CA . 25805 1 1144 . 1 1 126 126 ASP CB C 13 39.991 0.400 . 1 . . . A 126 ASP CB . 25805 1 1145 . 1 1 126 126 ASP N N 15 120.300 0.400 . 1 . . . A 126 ASP N . 25805 1 1146 . 1 1 127 127 ASP H H 1 7.170 0.020 . 1 . . . A 127 ASP H . 25805 1 1147 . 1 1 127 127 ASP HA H 1 4.557 0.020 . 1 . . . A 127 ASP HA . 25805 1 1148 . 1 1 127 127 ASP HB2 H 1 2.335 0.020 . 2 . . . A 127 ASP HB2 . 25805 1 1149 . 1 1 127 127 ASP HB3 H 1 2.956 0.020 . 2 . . . A 127 ASP HB3 . 25805 1 1150 . 1 1 127 127 ASP C C 13 177.917 0.400 . 1 . . . A 127 ASP C . 25805 1 1151 . 1 1 127 127 ASP CA C 13 57.660 0.400 . 1 . . . A 127 ASP CA . 25805 1 1152 . 1 1 127 127 ASP CB C 13 41.558 0.400 . 1 . . . A 127 ASP CB . 25805 1 1153 . 1 1 127 127 ASP N N 15 119.841 0.400 . 1 . . . A 127 ASP N . 25805 1 1154 . 1 1 128 128 LEU H H 1 8.182 0.020 . 1 . . . A 128 LEU H . 25805 1 1155 . 1 1 128 128 LEU HA H 1 3.877 0.020 . 1 . . . A 128 LEU HA . 25805 1 1156 . 1 1 128 128 LEU HB2 H 1 1.956 0.020 . 2 . . . A 128 LEU HB2 . 25805 1 1157 . 1 1 128 128 LEU HB3 H 1 1.956 0.020 . 2 . . . A 128 LEU HB3 . 25805 1 1158 . 1 1 128 128 LEU HG H 1 0.984 0.020 . 1 . . . A 128 LEU HG . 25805 1 1159 . 1 1 128 128 LEU HD11 H 1 0.624 0.020 . 2 . . . A 128 LEU HD11 . 25805 1 1160 . 1 1 128 128 LEU HD12 H 1 0.624 0.020 . 2 . . . A 128 LEU HD12 . 25805 1 1161 . 1 1 128 128 LEU HD13 H 1 0.624 0.020 . 2 . . . A 128 LEU HD13 . 25805 1 1162 . 1 1 128 128 LEU HD21 H 1 0.673 0.020 . 2 . . . A 128 LEU HD21 . 25805 1 1163 . 1 1 128 128 LEU HD22 H 1 0.673 0.020 . 2 . . . A 128 LEU HD22 . 25805 1 1164 . 1 1 128 128 LEU HD23 H 1 0.673 0.020 . 2 . . . A 128 LEU HD23 . 25805 1 1165 . 1 1 128 128 LEU C C 13 178.368 0.400 . 1 . . . A 128 LEU C . 25805 1 1166 . 1 1 128 128 LEU CA C 13 58.380 0.400 . 1 . . . A 128 LEU CA . 25805 1 1167 . 1 1 128 128 LEU CB C 13 41.733 0.400 . 1 . . . A 128 LEU CB . 25805 1 1168 . 1 1 128 128 LEU CG C 13 27.582 0.400 . 1 . . . A 128 LEU CG . 25805 1 1169 . 1 1 128 128 LEU CD1 C 13 22.664 0.400 . 1 . . . A 128 LEU CD1 . 25805 1 1170 . 1 1 128 128 LEU CD2 C 13 24.320 0.400 . 1 . . . A 128 LEU CD2 . 25805 1 1171 . 1 1 128 128 LEU N N 15 120.227 0.400 . 1 . . . A 128 LEU N . 25805 1 1172 . 1 1 129 129 LEU H H 1 8.275 0.020 . 1 . . . A 129 LEU H . 25805 1 1173 . 1 1 129 129 LEU HA H 1 4.047 0.020 . 1 . . . A 129 LEU HA . 25805 1 1174 . 1 1 129 129 LEU HB2 H 1 1.927 0.020 . 2 . . . A 129 LEU HB2 . 25805 1 1175 . 1 1 129 129 LEU HB3 H 1 1.927 0.020 . 2 . . . A 129 LEU HB3 . 25805 1 1176 . 1 1 129 129 LEU HD11 H 1 0.996 0.020 . 2 . . . A 129 LEU HD11 . 25805 1 1177 . 1 1 129 129 LEU HD12 H 1 0.996 0.020 . 2 . . . A 129 LEU HD12 . 25805 1 1178 . 1 1 129 129 LEU HD13 H 1 0.996 0.020 . 2 . . . A 129 LEU HD13 . 25805 1 1179 . 1 1 129 129 LEU HD21 H 1 0.546 0.020 . 2 . . . A 129 LEU HD21 . 25805 1 1180 . 1 1 129 129 LEU HD22 H 1 0.546 0.020 . 2 . . . A 129 LEU HD22 . 25805 1 1181 . 1 1 129 129 LEU HD23 H 1 0.546 0.020 . 2 . . . A 129 LEU HD23 . 25805 1 1182 . 1 1 129 129 LEU C C 13 179.529 0.400 . 1 . . . A 129 LEU C . 25805 1 1183 . 1 1 129 129 LEU CA C 13 58.745 0.400 . 1 . . . A 129 LEU CA . 25805 1 1184 . 1 1 129 129 LEU CB C 13 41.195 0.400 . 1 . . . A 129 LEU CB . 25805 1 1185 . 1 1 129 129 LEU CD1 C 13 23.120 0.400 . 1 . . . A 129 LEU CD1 . 25805 1 1186 . 1 1 129 129 LEU CD2 C 13 27.031 0.400 . 1 . . . A 129 LEU CD2 . 25805 1 1187 . 1 1 129 129 LEU N N 15 116.888 0.400 . 1 . . . A 129 LEU N . 25805 1 1188 . 1 1 130 130 GLU H H 1 7.721 0.020 . 1 . . . A 130 GLU H . 25805 1 1189 . 1 1 130 130 GLU HA H 1 4.092 0.020 . 1 . . . A 130 GLU HA . 25805 1 1190 . 1 1 130 130 GLU HB2 H 1 2.309 0.020 . 2 . . . A 130 GLU HB2 . 25805 1 1191 . 1 1 130 130 GLU HB3 H 1 2.269 0.020 . 2 . . . A 130 GLU HB3 . 25805 1 1192 . 1 1 130 130 GLU HG2 H 1 2.424 0.020 . 2 . . . A 130 GLU HG2 . 25805 1 1193 . 1 1 130 130 GLU HG3 H 1 2.134 0.020 . 2 . . . A 130 GLU HG3 . 25805 1 1194 . 1 1 130 130 GLU C C 13 179.553 0.400 . 1 . . . A 130 GLU C . 25805 1 1195 . 1 1 130 130 GLU CA C 13 59.991 0.400 . 1 . . . A 130 GLU CA . 25805 1 1196 . 1 1 130 130 GLU CB C 13 30.280 0.400 . 1 . . . A 130 GLU CB . 25805 1 1197 . 1 1 130 130 GLU CG C 13 36.853 0.400 . 1 . . . A 130 GLU CG . 25805 1 1198 . 1 1 130 130 GLU N N 15 119.104 0.400 . 1 . . . A 130 GLU N . 25805 1 1199 . 1 1 131 131 VAL H H 1 7.656 0.020 . 1 . . . A 131 VAL H . 25805 1 1200 . 1 1 131 131 VAL HA H 1 3.836 0.020 . 1 . . . A 131 VAL HA . 25805 1 1201 . 1 1 131 131 VAL HB H 1 2.123 0.020 . 1 . . . A 131 VAL HB . 25805 1 1202 . 1 1 131 131 VAL HG11 H 1 1.012 0.020 . 2 . . . A 131 VAL HG11 . 25805 1 1203 . 1 1 131 131 VAL HG12 H 1 1.012 0.020 . 2 . . . A 131 VAL HG12 . 25805 1 1204 . 1 1 131 131 VAL HG13 H 1 1.012 0.020 . 2 . . . A 131 VAL HG13 . 25805 1 1205 . 1 1 131 131 VAL HG21 H 1 1.044 0.020 . 2 . . . A 131 VAL HG21 . 25805 1 1206 . 1 1 131 131 VAL HG22 H 1 1.044 0.020 . 2 . . . A 131 VAL HG22 . 25805 1 1207 . 1 1 131 131 VAL HG23 H 1 1.044 0.020 . 2 . . . A 131 VAL HG23 . 25805 1 1208 . 1 1 131 131 VAL C C 13 178.865 0.400 . 1 . . . A 131 VAL C . 25805 1 1209 . 1 1 131 131 VAL CA C 13 67.224 0.400 . 1 . . . A 131 VAL CA . 25805 1 1210 . 1 1 131 131 VAL CB C 13 32.398 0.400 . 1 . . . A 131 VAL CB . 25805 1 1211 . 1 1 131 131 VAL CG1 C 13 23.402 0.400 . 1 . . . A 131 VAL CG1 . 25805 1 1212 . 1 1 131 131 VAL CG2 C 13 23.676 0.400 . 1 . . . A 131 VAL CG2 . 25805 1 1213 . 1 1 131 131 VAL N N 15 118.703 0.400 . 1 . . . A 131 VAL N . 25805 1 1214 . 1 1 132 132 LEU H H 1 8.392 0.020 . 1 . . . A 132 LEU H . 25805 1 1215 . 1 1 132 132 LEU HA H 1 4.065 0.020 . 1 . . . A 132 LEU HA . 25805 1 1216 . 1 1 132 132 LEU HB2 H 1 1.978 0.020 . 2 . . . A 132 LEU HB2 . 25805 1 1217 . 1 1 132 132 LEU HB3 H 1 1.592 0.020 . 2 . . . A 132 LEU HB3 . 25805 1 1218 . 1 1 132 132 LEU HG H 1 0.950 0.020 . 1 . . . A 132 LEU HG . 25805 1 1219 . 1 1 132 132 LEU HD11 H 1 0.536 0.020 . 2 . . . A 132 LEU HD11 . 25805 1 1220 . 1 1 132 132 LEU HD12 H 1 0.536 0.020 . 2 . . . A 132 LEU HD12 . 25805 1 1221 . 1 1 132 132 LEU HD13 H 1 0.536 0.020 . 2 . . . A 132 LEU HD13 . 25805 1 1222 . 1 1 132 132 LEU HD21 H 1 0.382 0.020 . 2 . . . A 132 LEU HD21 . 25805 1 1223 . 1 1 132 132 LEU HD22 H 1 0.382 0.020 . 2 . . . A 132 LEU HD22 . 25805 1 1224 . 1 1 132 132 LEU HD23 H 1 0.382 0.020 . 2 . . . A 132 LEU HD23 . 25805 1 1225 . 1 1 132 132 LEU C C 13 179.790 0.400 . 1 . . . A 132 LEU C . 25805 1 1226 . 1 1 132 132 LEU CA C 13 58.611 0.400 . 1 . . . A 132 LEU CA . 25805 1 1227 . 1 1 132 132 LEU CB C 13 41.051 0.400 . 1 . . . A 132 LEU CB . 25805 1 1228 . 1 1 132 132 LEU CG C 13 25.646 0.400 . 1 . . . A 132 LEU CG . 25805 1 1229 . 1 1 132 132 LEU CD1 C 13 27.547 0.400 . 1 . . . A 132 LEU CD1 . 25805 1 1230 . 1 1 132 132 LEU CD2 C 13 22.829 0.400 . 1 . . . A 132 LEU CD2 . 25805 1 1231 . 1 1 132 132 LEU N N 15 118.114 0.400 . 1 . . . A 132 LEU N . 25805 1 1232 . 1 1 133 133 ASP H H 1 7.942 0.020 . 1 . . . A 133 ASP H . 25805 1 1233 . 1 1 133 133 ASP HA H 1 4.521 0.020 . 1 . . . A 133 ASP HA . 25805 1 1234 . 1 1 133 133 ASP HB2 H 1 2.637 0.020 . 2 . . . A 133 ASP HB2 . 25805 1 1235 . 1 1 133 133 ASP HB3 H 1 2.842 0.020 . 2 . . . A 133 ASP HB3 . 25805 1 1236 . 1 1 133 133 ASP C C 13 178.320 0.400 . 1 . . . A 133 ASP C . 25805 1 1237 . 1 1 133 133 ASP CA C 13 57.042 0.400 . 1 . . . A 133 ASP CA . 25805 1 1238 . 1 1 133 133 ASP CB C 13 41.755 0.400 . 1 . . . A 133 ASP CB . 25805 1 1239 . 1 1 133 133 ASP N N 15 117.916 0.400 . 1 . . . A 133 ASP N . 25805 1 1240 . 1 1 134 134 MET H H 1 7.603 0.020 . 1 . . . A 134 MET H . 25805 1 1241 . 1 1 134 134 MET HA H 1 4.120 0.020 . 1 . . . A 134 MET HA . 25805 1 1242 . 1 1 134 134 MET HB2 H 1 2.248 0.020 . 2 . . . A 134 MET HB2 . 25805 1 1243 . 1 1 134 134 MET HB3 H 1 1.765 0.020 . 2 . . . A 134 MET HB3 . 25805 1 1244 . 1 1 134 134 MET HG2 H 1 2.668 0.020 . 2 . . . A 134 MET HG2 . 25805 1 1245 . 1 1 134 134 MET HG3 H 1 2.342 0.020 . 2 . . . A 134 MET HG3 . 25805 1 1246 . 1 1 134 134 MET HE1 H 1 2.097 0.020 . 1 . . . A 134 MET HE1 . 25805 1 1247 . 1 1 134 134 MET HE2 H 1 2.097 0.020 . 1 . . . A 134 MET HE2 . 25805 1 1248 . 1 1 134 134 MET HE3 H 1 2.097 0.020 . 1 . . . A 134 MET HE3 . 25805 1 1249 . 1 1 134 134 MET C C 13 176.045 0.400 . 1 . . . A 134 MET C . 25805 1 1250 . 1 1 134 134 MET CA C 13 57.369 0.400 . 1 . . . A 134 MET CA . 25805 1 1251 . 1 1 134 134 MET CB C 13 34.436 0.400 . 1 . . . A 134 MET CB . 25805 1 1252 . 1 1 134 134 MET CG C 13 32.734 0.400 . 1 . . . A 134 MET CG . 25805 1 1253 . 1 1 134 134 MET CE C 13 17.336 0.400 . 1 . . . A 134 MET CE . 25805 1 1254 . 1 1 134 134 MET N N 15 116.353 0.400 . 1 . . . A 134 MET N . 25805 1 1255 . 1 1 135 135 TYR H H 1 7.590 0.020 . 1 . . . A 135 TYR H . 25805 1 1256 . 1 1 135 135 TYR HA H 1 5.003 0.020 . 1 . . . A 135 TYR HA . 25805 1 1257 . 1 1 135 135 TYR HB2 H 1 2.916 0.020 . 2 . . . A 135 TYR HB2 . 25805 1 1258 . 1 1 135 135 TYR HB3 H 1 3.361 0.020 . 2 . . . A 135 TYR HB3 . 25805 1 1259 . 1 1 135 135 TYR HD1 H 1 7.432 0.020 . 3 . . . A 135 TYR HD1 . 25805 1 1260 . 1 1 135 135 TYR HD2 H 1 7.432 0.020 . 3 . . . A 135 TYR HD2 . 25805 1 1261 . 1 1 135 135 TYR CA C 13 56.442 0.400 . 1 . . . A 135 TYR CA . 25805 1 1262 . 1 1 135 135 TYR CB C 13 39.714 0.400 . 1 . . . A 135 TYR CB . 25805 1 1263 . 1 1 135 135 TYR N N 15 116.851 0.400 . 1 . . . A 135 TYR N . 25805 1 1264 . 1 1 136 136 PRO HA H 1 4.567 0.020 . 1 . . . A 136 PRO HA . 25805 1 1265 . 1 1 136 136 PRO HB2 H 1 2.439 0.020 . 2 . . . A 136 PRO HB2 . 25805 1 1266 . 1 1 136 136 PRO HB3 H 1 2.103 0.020 . 2 . . . A 136 PRO HB3 . 25805 1 1267 . 1 1 136 136 PRO HG2 H 1 2.093 0.020 . 2 . . . A 136 PRO HG2 . 25805 1 1268 . 1 1 136 136 PRO HG3 H 1 1.915 0.020 . 2 . . . A 136 PRO HG3 . 25805 1 1269 . 1 1 136 136 PRO HD2 H 1 3.733 0.020 . 2 . . . A 136 PRO HD2 . 25805 1 1270 . 1 1 136 136 PRO HD3 H 1 3.406 0.020 . 2 . . . A 136 PRO HD3 . 25805 1 1271 . 1 1 136 136 PRO C C 13 179.672 0.400 . 1 . . . A 136 PRO C . 25805 1 1272 . 1 1 136 136 PRO CA C 13 65.686 0.400 . 1 . . . A 136 PRO CA . 25805 1 1273 . 1 1 136 136 PRO CB C 13 32.176 0.400 . 1 . . . A 136 PRO CB . 25805 1 1274 . 1 1 136 136 PRO CG C 13 27.912 0.400 . 1 . . . A 136 PRO CG . 25805 1 1275 . 1 1 136 136 PRO CD C 13 50.903 0.400 . 1 . . . A 136 PRO CD . 25805 1 1276 . 1 1 137 137 GLU H H 1 9.171 0.020 . 1 . . . A 137 GLU H . 25805 1 1277 . 1 1 137 137 GLU HA H 1 4.316 0.020 . 1 . . . A 137 GLU HA . 25805 1 1278 . 1 1 137 137 GLU HB2 H 1 2.196 0.020 . 2 . . . A 137 GLU HB2 . 25805 1 1279 . 1 1 137 137 GLU HB3 H 1 2.196 0.020 . 2 . . . A 137 GLU HB3 . 25805 1 1280 . 1 1 137 137 GLU HG2 H 1 2.403 0.020 . 2 . . . A 137 GLU HG2 . 25805 1 1281 . 1 1 137 137 GLU HG3 H 1 2.459 0.020 . 2 . . . A 137 GLU HG3 . 25805 1 1282 . 1 1 137 137 GLU C C 13 179.269 0.400 . 1 . . . A 137 GLU C . 25805 1 1283 . 1 1 137 137 GLU CA C 13 59.788 0.400 . 1 . . . A 137 GLU CA . 25805 1 1284 . 1 1 137 137 GLU CB C 13 28.968 0.400 . 1 . . . A 137 GLU CB . 25805 1 1285 . 1 1 137 137 GLU CG C 13 37.107 0.400 . 1 . . . A 137 GLU CG . 25805 1 1286 . 1 1 137 137 GLU N N 15 118.919 0.400 . 1 . . . A 137 GLU N . 25805 1 1287 . 1 1 138 138 PHE H H 1 8.116 0.020 . 1 . . . A 138 PHE H . 25805 1 1288 . 1 1 138 138 PHE HA H 1 4.709 0.020 . 1 . . . A 138 PHE HA . 25805 1 1289 . 1 1 138 138 PHE HB2 H 1 3.206 0.020 . 2 . . . A 138 PHE HB2 . 25805 1 1290 . 1 1 138 138 PHE HB3 H 1 3.580 0.020 . 2 . . . A 138 PHE HB3 . 25805 1 1291 . 1 1 138 138 PHE HD1 H 1 7.043 0.020 . 3 . . . A 138 PHE HD1 . 25805 1 1292 . 1 1 138 138 PHE HD2 H 1 7.043 0.020 . 3 . . . A 138 PHE HD2 . 25805 1 1293 . 1 1 138 138 PHE C C 13 177.111 0.400 . 1 . . . A 138 PHE C . 25805 1 1294 . 1 1 138 138 PHE CA C 13 59.861 0.400 . 1 . . . A 138 PHE CA . 25805 1 1295 . 1 1 138 138 PHE CB C 13 40.523 0.400 . 1 . . . A 138 PHE CB . 25805 1 1296 . 1 1 138 138 PHE N N 15 121.088 0.400 . 1 . . . A 138 PHE N . 25805 1 1297 . 1 1 139 139 SER H H 1 8.400 0.020 . 1 . . . A 139 SER H . 25805 1 1298 . 1 1 139 139 SER HA H 1 3.760 0.020 . 1 . . . A 139 SER HA . 25805 1 1299 . 1 1 139 139 SER HB2 H 1 4.301 0.020 . 2 . . . A 139 SER HB2 . 25805 1 1300 . 1 1 139 139 SER HB3 H 1 4.178 0.020 . 2 . . . A 139 SER HB3 . 25805 1 1301 . 1 1 139 139 SER C C 13 175.926 0.400 . 1 . . . A 139 SER C . 25805 1 1302 . 1 1 139 139 SER CA C 13 62.405 0.400 . 1 . . . A 139 SER CA . 25805 1 1303 . 1 1 139 139 SER CB C 13 63.473 0.400 . 1 . . . A 139 SER CB . 25805 1 1304 . 1 1 139 139 SER N N 15 114.032 0.400 . 1 . . . A 139 SER N . 25805 1 1305 . 1 1 140 140 ASP H H 1 7.897 0.020 . 1 . . . A 140 ASP H . 25805 1 1306 . 1 1 140 140 ASP HA H 1 4.520 0.020 . 1 . . . A 140 ASP HA . 25805 1 1307 . 1 1 140 140 ASP HB2 H 1 2.734 0.020 . 2 . . . A 140 ASP HB2 . 25805 1 1308 . 1 1 140 140 ASP HB3 H 1 2.687 0.020 . 2 . . . A 140 ASP HB3 . 25805 1 1309 . 1 1 140 140 ASP C C 13 179.529 0.400 . 1 . . . A 140 ASP C . 25805 1 1310 . 1 1 140 140 ASP CA C 13 57.888 0.400 . 1 . . . A 140 ASP CA . 25805 1 1311 . 1 1 140 140 ASP CB C 13 40.964 0.400 . 1 . . . A 140 ASP CB . 25805 1 1312 . 1 1 140 140 ASP N N 15 117.228 0.400 . 1 . . . A 140 ASP N . 25805 1 1313 . 1 1 141 141 HIS H H 1 7.506 0.020 . 1 . . . A 141 HIS H . 25805 1 1314 . 1 1 141 141 HIS HA H 1 4.214 0.020 . 1 . . . A 141 HIS HA . 25805 1 1315 . 1 1 141 141 HIS HB2 H 1 3.163 0.020 . 2 . . . A 141 HIS HB2 . 25805 1 1316 . 1 1 141 141 HIS HB3 H 1 3.163 0.020 . 2 . . . A 141 HIS HB3 . 25805 1 1317 . 1 1 141 141 HIS C C 13 177.799 0.400 . 1 . . . A 141 HIS C . 25805 1 1318 . 1 1 141 141 HIS CA C 13 59.654 0.400 . 1 . . . A 141 HIS CA . 25805 1 1319 . 1 1 141 141 HIS CB C 13 30.738 0.400 . 1 . . . A 141 HIS CB . 25805 1 1320 . 1 1 141 141 HIS N N 15 119.319 0.400 . 1 . . . A 141 HIS N . 25805 1 1321 . 1 1 142 142 PHE H H 1 8.662 0.020 . 1 . . . A 142 PHE H . 25805 1 1322 . 1 1 142 142 PHE HA H 1 3.568 0.020 . 1 . . . A 142 PHE HA . 25805 1 1323 . 1 1 142 142 PHE HB2 H 1 1.929 0.020 . 2 . . . A 142 PHE HB2 . 25805 1 1324 . 1 1 142 142 PHE HB3 H 1 2.249 0.020 . 2 . . . A 142 PHE HB3 . 25805 1 1325 . 1 1 142 142 PHE HD1 H 1 5.841 0.020 . 3 . . . A 142 PHE HD1 . 25805 1 1326 . 1 1 142 142 PHE HD2 H 1 5.841 0.020 . 3 . . . A 142 PHE HD2 . 25805 1 1327 . 1 1 142 142 PHE HE1 H 1 7.047 0.020 . 3 . . . A 142 PHE HE1 . 25805 1 1328 . 1 1 142 142 PHE HE2 H 1 7.047 0.020 . 3 . . . A 142 PHE HE2 . 25805 1 1329 . 1 1 142 142 PHE C C 13 177.206 0.400 . 1 . . . A 142 PHE C . 25805 1 1330 . 1 1 142 142 PHE CA C 13 61.937 0.400 . 1 . . . A 142 PHE CA . 25805 1 1331 . 1 1 142 142 PHE CB C 13 38.992 0.400 . 1 . . . A 142 PHE CB . 25805 1 1332 . 1 1 142 142 PHE N N 15 122.680 0.400 . 1 . . . A 142 PHE N . 25805 1 1333 . 1 1 143 143 TRP H H 1 8.139 0.020 . 1 . . . A 143 TRP H . 25805 1 1334 . 1 1 143 143 TRP HA H 1 4.384 0.020 . 1 . . . A 143 TRP HA . 25805 1 1335 . 1 1 143 143 TRP HB2 H 1 3.152 0.020 . 2 . . . A 143 TRP HB2 . 25805 1 1336 . 1 1 143 143 TRP HB3 H 1 3.323 0.020 . 2 . . . A 143 TRP HB3 . 25805 1 1337 . 1 1 143 143 TRP HD1 H 1 7.477 0.020 . 1 . . . A 143 TRP HD1 . 25805 1 1338 . 1 1 143 143 TRP HE1 H 1 10.075 0.020 . 1 . . . A 143 TRP HE1 . 25805 1 1339 . 1 1 143 143 TRP HZ2 H 1 7.223 0.020 . 1 . . . A 143 TRP HZ2 . 25805 1 1340 . 1 1 143 143 TRP C C 13 179.695 0.400 . 1 . . . A 143 TRP C . 25805 1 1341 . 1 1 143 143 TRP CA C 13 59.428 0.400 . 1 . . . A 143 TRP CA . 25805 1 1342 . 1 1 143 143 TRP CB C 13 29.850 0.400 . 1 . . . A 143 TRP CB . 25805 1 1343 . 1 1 143 143 TRP N N 15 115.783 0.400 . 1 . . . A 143 TRP N . 25805 1 1344 . 1 1 143 143 TRP NE1 N 15 128.642 0.400 . 1 . . . A 143 TRP NE1 . 25805 1 1345 . 1 1 144 144 SER H H 1 7.658 0.020 . 1 . . . A 144 SER H . 25805 1 1346 . 1 1 144 144 SER HA H 1 4.366 0.020 . 1 . . . A 144 SER HA . 25805 1 1347 . 1 1 144 144 SER HB2 H 1 3.971 0.020 . 2 . . . A 144 SER HB2 . 25805 1 1348 . 1 1 144 144 SER HB3 H 1 3.923 0.020 . 2 . . . A 144 SER HB3 . 25805 1 1349 . 1 1 144 144 SER C C 13 175.665 0.400 . 1 . . . A 144 SER C . 25805 1 1350 . 1 1 144 144 SER CA C 13 60.796 0.400 . 1 . . . A 144 SER CA . 25805 1 1351 . 1 1 144 144 SER CB C 13 63.578 0.400 . 1 . . . A 144 SER CB . 25805 1 1352 . 1 1 144 144 SER N N 15 111.788 0.400 . 1 . . . A 144 SER N . 25805 1 1353 . 1 1 145 145 SER H H 1 7.393 0.020 . 1 . . . A 145 SER H . 25805 1 1354 . 1 1 145 145 SER HA H 1 4.394 0.020 . 1 . . . A 145 SER HA . 25805 1 1355 . 1 1 145 145 SER HB2 H 1 3.480 0.020 . 2 . . . A 145 SER HB2 . 25805 1 1356 . 1 1 145 145 SER HB3 H 1 3.480 0.020 . 2 . . . A 145 SER HB3 . 25805 1 1357 . 1 1 145 145 SER C C 13 174.290 0.400 . 1 . . . A 145 SER C . 25805 1 1358 . 1 1 145 145 SER CA C 13 59.147 0.400 . 1 . . . A 145 SER CA . 25805 1 1359 . 1 1 145 145 SER CB C 13 64.953 0.400 . 1 . . . A 145 SER CB . 25805 1 1360 . 1 1 145 145 SER N N 15 114.506 0.400 . 1 . . . A 145 SER N . 25805 1 1361 . 1 1 146 146 LEU H H 1 7.327 0.020 . 1 . . . A 146 LEU H . 25805 1 1362 . 1 1 146 146 LEU HA H 1 3.675 0.020 . 1 . . . A 146 LEU HA . 25805 1 1363 . 1 1 146 146 LEU HB2 H 1 1.492 0.020 . 2 . . . A 146 LEU HB2 . 25805 1 1364 . 1 1 146 146 LEU HB3 H 1 1.492 0.020 . 2 . . . A 146 LEU HB3 . 25805 1 1365 . 1 1 146 146 LEU HD11 H 1 0.534 0.020 . 2 . . . A 146 LEU HD11 . 25805 1 1366 . 1 1 146 146 LEU HD12 H 1 0.534 0.020 . 2 . . . A 146 LEU HD12 . 25805 1 1367 . 1 1 146 146 LEU HD13 H 1 0.534 0.020 . 2 . . . A 146 LEU HD13 . 25805 1 1368 . 1 1 146 146 LEU HD21 H 1 0.753 0.020 . 2 . . . A 146 LEU HD21 . 25805 1 1369 . 1 1 146 146 LEU HD22 H 1 0.753 0.020 . 2 . . . A 146 LEU HD22 . 25805 1 1370 . 1 1 146 146 LEU HD23 H 1 0.753 0.020 . 2 . . . A 146 LEU HD23 . 25805 1 1371 . 1 1 146 146 LEU C C 13 175.736 0.400 . 1 . . . A 146 LEU C . 25805 1 1372 . 1 1 146 146 LEU CA C 13 56.364 0.400 . 1 . . . A 146 LEU CA . 25805 1 1373 . 1 1 146 146 LEU CB C 13 41.618 0.400 . 1 . . . A 146 LEU CB . 25805 1 1374 . 1 1 146 146 LEU CD1 C 13 23.884 0.400 . 1 . . . A 146 LEU CD1 . 25805 1 1375 . 1 1 146 146 LEU CD2 C 13 26.871 0.400 . 1 . . . A 146 LEU CD2 . 25805 1 1376 . 1 1 146 146 LEU N N 15 124.189 0.400 . 1 . . . A 146 LEU N . 25805 1 1377 . 1 1 147 147 GLU H H 1 8.481 0.020 . 1 . . . A 147 GLU H . 25805 1 1378 . 1 1 147 147 GLU HA H 1 4.465 0.020 . 1 . . . A 147 GLU HA . 25805 1 1379 . 1 1 147 147 GLU HB2 H 1 1.891 0.020 . 2 . . . A 147 GLU HB2 . 25805 1 1380 . 1 1 147 147 GLU HB3 H 1 1.891 0.020 . 2 . . . A 147 GLU HB3 . 25805 1 1381 . 1 1 147 147 GLU HG2 H 1 2.027 0.020 . 2 . . . A 147 GLU HG2 . 25805 1 1382 . 1 1 147 147 GLU HG3 H 1 2.160 0.020 . 2 . . . A 147 GLU HG3 . 25805 1 1383 . 1 1 147 147 GLU C C 13 175.523 0.400 . 1 . . . A 147 GLU C . 25805 1 1384 . 1 1 147 147 GLU CA C 13 54.943 0.400 . 1 . . . A 147 GLU CA . 25805 1 1385 . 1 1 147 147 GLU CB C 13 31.016 0.400 . 1 . . . A 147 GLU CB . 25805 1 1386 . 1 1 147 147 GLU CG C 13 36.517 0.400 . 1 . . . A 147 GLU CG . 25805 1 1387 . 1 1 147 147 GLU N N 15 129.329 0.400 . 1 . . . A 147 GLU N . 25805 1 1388 . 1 1 148 148 ILE H H 1 8.626 0.020 . 1 . . . A 148 ILE H . 25805 1 1389 . 1 1 148 148 ILE HA H 1 3.668 0.020 . 1 . . . A 148 ILE HA . 25805 1 1390 . 1 1 148 148 ILE HB H 1 1.771 0.020 . 1 . . . A 148 ILE HB . 25805 1 1391 . 1 1 148 148 ILE HG12 H 1 1.382 0.020 . 2 . . . A 148 ILE HG12 . 25805 1 1392 . 1 1 148 148 ILE HG13 H 1 1.382 0.020 . 2 . . . A 148 ILE HG13 . 25805 1 1393 . 1 1 148 148 ILE HG21 H 1 0.641 0.020 . 1 . . . A 148 ILE HG21 . 25805 1 1394 . 1 1 148 148 ILE HG22 H 1 0.641 0.020 . 1 . . . A 148 ILE HG22 . 25805 1 1395 . 1 1 148 148 ILE HG23 H 1 0.641 0.020 . 1 . . . A 148 ILE HG23 . 25805 1 1396 . 1 1 148 148 ILE HD11 H 1 0.671 0.020 . 1 . . . A 148 ILE HD11 . 25805 1 1397 . 1 1 148 148 ILE HD12 H 1 0.671 0.020 . 1 . . . A 148 ILE HD12 . 25805 1 1398 . 1 1 148 148 ILE HD13 H 1 0.671 0.020 . 1 . . . A 148 ILE HD13 . 25805 1 1399 . 1 1 148 148 ILE C C 13 176.163 0.400 . 1 . . . A 148 ILE C . 25805 1 1400 . 1 1 148 148 ILE CA C 13 61.836 0.400 . 1 . . . A 148 ILE CA . 25805 1 1401 . 1 1 148 148 ILE CB C 13 37.512 0.400 . 1 . . . A 148 ILE CB . 25805 1 1402 . 1 1 148 148 ILE CG1 C 13 28.555 0.400 . 1 . . . A 148 ILE CG1 . 25805 1 1403 . 1 1 148 148 ILE CG2 C 13 17.941 0.400 . 1 . . . A 148 ILE CG2 . 25805 1 1404 . 1 1 148 148 ILE CD1 C 13 13.197 0.400 . 1 . . . A 148 ILE CD1 . 25805 1 1405 . 1 1 148 148 ILE N N 15 125.130 0.400 . 1 . . . A 148 ILE N . 25805 1 1406 . 1 1 149 149 THR H H 1 8.516 0.020 . 1 . . . A 149 THR H . 25805 1 1407 . 1 1 149 149 THR HA H 1 4.022 0.020 . 1 . . . A 149 THR HA . 25805 1 1408 . 1 1 149 149 THR HB H 1 4.254 0.020 . 1 . . . A 149 THR HB . 25805 1 1409 . 1 1 149 149 THR HG21 H 1 1.411 0.020 . 1 . . . A 149 THR HG21 . 25805 1 1410 . 1 1 149 149 THR HG22 H 1 1.411 0.020 . 1 . . . A 149 THR HG22 . 25805 1 1411 . 1 1 149 149 THR HG23 H 1 1.411 0.020 . 1 . . . A 149 THR HG23 . 25805 1 1412 . 1 1 149 149 THR C C 13 175.499 0.400 . 1 . . . A 149 THR C . 25805 1 1413 . 1 1 149 149 THR CA C 13 66.694 0.400 . 1 . . . A 149 THR CA . 25805 1 1414 . 1 1 149 149 THR CB C 13 68.864 0.400 . 1 . . . A 149 THR CB . 25805 1 1415 . 1 1 149 149 THR CG2 C 13 23.529 0.400 . 1 . . . A 149 THR CG2 . 25805 1 1416 . 1 1 149 149 THR N N 15 127.371 0.400 . 1 . . . A 149 THR N . 25805 1 1417 . 1 1 150 150 PHE H H 1 7.557 0.020 . 1 . . . A 150 PHE H . 25805 1 1418 . 1 1 150 150 PHE HA H 1 4.416 0.020 . 1 . . . A 150 PHE HA . 25805 1 1419 . 1 1 150 150 PHE HB2 H 1 2.623 0.020 . 2 . . . A 150 PHE HB2 . 25805 1 1420 . 1 1 150 150 PHE HB3 H 1 2.899 0.020 . 2 . . . A 150 PHE HB3 . 25805 1 1421 . 1 1 150 150 PHE HD1 H 1 6.926 0.020 . 3 . . . A 150 PHE HD1 . 25805 1 1422 . 1 1 150 150 PHE HD2 H 1 6.926 0.020 . 3 . . . A 150 PHE HD2 . 25805 1 1423 . 1 1 150 150 PHE HE1 H 1 7.277 0.020 . 3 . . . A 150 PHE HE1 . 25805 1 1424 . 1 1 150 150 PHE HE2 H 1 7.277 0.020 . 3 . . . A 150 PHE HE2 . 25805 1 1425 . 1 1 150 150 PHE C C 13 172.858 0.400 . 1 . . . A 150 PHE C . 25805 1 1426 . 1 1 150 150 PHE CA C 13 59.316 0.400 . 1 . . . A 150 PHE CA . 25805 1 1427 . 1 1 150 150 PHE CB C 13 44.094 0.400 . 1 . . . A 150 PHE CB . 25805 1 1428 . 1 1 150 150 PHE N N 15 118.435 0.400 . 1 . . . A 150 PHE N . 25805 1 1429 . 1 1 151 151 ASN H H 1 7.991 0.020 . 1 . . . A 151 ASN H . 25805 1 1430 . 1 1 151 151 ASN HA H 1 5.066 0.020 . 1 . . . A 151 ASN HA . 25805 1 1431 . 1 1 151 151 ASN HB2 H 1 2.870 0.020 . 2 . . . A 151 ASN HB2 . 25805 1 1432 . 1 1 151 151 ASN HB3 H 1 2.587 0.020 . 2 . . . A 151 ASN HB3 . 25805 1 1433 . 1 1 151 151 ASN HD21 H 1 6.920 0.020 . 2 . . . A 151 ASN HD21 . 25805 1 1434 . 1 1 151 151 ASN HD22 H 1 7.680 0.020 . 2 . . . A 151 ASN HD22 . 25805 1 1435 . 1 1 151 151 ASN C C 13 175.736 0.400 . 1 . . . A 151 ASN C . 25805 1 1436 . 1 1 151 151 ASN CA C 13 51.675 0.400 . 1 . . . A 151 ASN CA . 25805 1 1437 . 1 1 151 151 ASN CB C 13 38.384 0.400 . 1 . . . A 151 ASN CB . 25805 1 1438 . 1 1 151 151 ASN N N 15 126.834 0.400 . 1 . . . A 151 ASN N . 25805 1 1439 . 1 1 151 151 ASN ND2 N 15 113.251 0.400 . 1 . . . A 151 ASN ND2 . 25805 1 1440 . 1 1 152 152 LEU H H 1 8.762 0.020 . 1 . . . A 152 LEU H . 25805 1 1441 . 1 1 152 152 LEU HA H 1 4.553 0.020 . 1 . . . A 152 LEU HA . 25805 1 1442 . 1 1 152 152 LEU HB2 H 1 2.159 0.020 . 2 . . . A 152 LEU HB2 . 25805 1 1443 . 1 1 152 152 LEU HB3 H 1 1.591 0.020 . 2 . . . A 152 LEU HB3 . 25805 1 1444 . 1 1 152 152 LEU HG H 1 2.056 0.020 . 1 . . . A 152 LEU HG . 25805 1 1445 . 1 1 152 152 LEU HD11 H 1 0.895 0.020 . 2 . . . A 152 LEU HD11 . 25805 1 1446 . 1 1 152 152 LEU HD12 H 1 0.895 0.020 . 2 . . . A 152 LEU HD12 . 25805 1 1447 . 1 1 152 152 LEU HD13 H 1 0.895 0.020 . 2 . . . A 152 LEU HD13 . 25805 1 1448 . 1 1 152 152 LEU HD21 H 1 1.062 0.020 . 2 . . . A 152 LEU HD21 . 25805 1 1449 . 1 1 152 152 LEU HD22 H 1 1.062 0.020 . 2 . . . A 152 LEU HD22 . 25805 1 1450 . 1 1 152 152 LEU HD23 H 1 1.062 0.020 . 2 . . . A 152 LEU HD23 . 25805 1 1451 . 1 1 152 152 LEU C C 13 173.887 0.400 . 1 . . . A 152 LEU C . 25805 1 1452 . 1 1 152 152 LEU CA C 13 54.742 0.400 . 1 . . . A 152 LEU CA . 25805 1 1453 . 1 1 152 152 LEU CB C 13 44.916 0.400 . 1 . . . A 152 LEU CB . 25805 1 1454 . 1 1 152 152 LEU CG C 13 28.503 0.400 . 1 . . . A 152 LEU CG . 25805 1 1455 . 1 1 152 152 LEU CD1 C 13 23.153 0.400 . 1 . . . A 152 LEU CD1 . 25805 1 1456 . 1 1 152 152 LEU CD2 C 13 27.258 0.400 . 1 . . . A 152 LEU CD2 . 25805 1 1457 . 1 1 152 152 LEU N N 15 126.318 0.400 . 1 . . . A 152 LEU N . 25805 1 1458 . 1 1 153 153 ARG H H 1 8.374 0.020 . 1 . . . A 153 ARG H . 25805 1 1459 . 1 1 153 153 ARG HA H 1 4.093 0.020 . 1 . . . A 153 ARG HA . 25805 1 1460 . 1 1 153 153 ARG HB2 H 1 1.889 0.020 . 2 . . . A 153 ARG HB2 . 25805 1 1461 . 1 1 153 153 ARG HB3 H 1 1.743 0.020 . 2 . . . A 153 ARG HB3 . 25805 1 1462 . 1 1 153 153 ARG HG2 H 1 1.655 0.020 . 2 . . . A 153 ARG HG2 . 25805 1 1463 . 1 1 153 153 ARG HG3 H 1 1.655 0.020 . 2 . . . A 153 ARG HG3 . 25805 1 1464 . 1 1 153 153 ARG HD2 H 1 3.230 0.020 . 2 . . . A 153 ARG HD2 . 25805 1 1465 . 1 1 153 153 ARG HD3 H 1 3.230 0.020 . 2 . . . A 153 ARG HD3 . 25805 1 1466 . 1 1 153 153 ARG C C 13 176.969 0.400 . 1 . . . A 153 ARG C . 25805 1 1467 . 1 1 153 153 ARG CA C 13 57.763 0.400 . 1 . . . A 153 ARG CA . 25805 1 1468 . 1 1 153 153 ARG CB C 13 31.401 0.400 . 1 . . . A 153 ARG CB . 25805 1 1469 . 1 1 153 153 ARG CG C 13 27.000 0.400 . 1 . . . A 153 ARG CG . 25805 1 1470 . 1 1 153 153 ARG CD C 13 43.936 0.400 . 1 . . . A 153 ARG CD . 25805 1 1471 . 1 1 153 153 ARG N N 15 120.913 0.400 . 1 . . . A 153 ARG N . 25805 1 1472 . 1 1 154 154 ASP H H 1 8.278 0.020 . 1 . . . A 154 ASP H . 25805 1 1473 . 1 1 154 154 ASP HA H 1 4.450 0.020 . 1 . . . A 154 ASP HA . 25805 1 1474 . 1 1 154 154 ASP HB2 H 1 2.358 0.020 . 2 . . . A 154 ASP HB2 . 25805 1 1475 . 1 1 154 154 ASP HB3 H 1 2.618 0.020 . 2 . . . A 154 ASP HB3 . 25805 1 1476 . 1 1 154 154 ASP CA C 13 56.794 0.400 . 1 . . . A 154 ASP CA . 25805 1 1477 . 1 1 154 154 ASP CB C 13 42.606 0.400 . 1 . . . A 154 ASP CB . 25805 1 1478 . 1 1 154 154 ASP N N 15 130.875 0.400 . 1 . . . A 154 ASP N . 25805 1 stop_ save_