data_15401 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 15401 _Entry.Title ; Calcium binding protein in the free form ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2007-07-22 _Entry.Accession_date 2007-07-22 _Entry.Last_release_date 2011-05-03 _Entry.Original_release_date 2011-05-03 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.0.8.78 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 X. Zhang X. . . 15401 2 Y. Hu Y. . . 15401 3 C. Jin C. . . 15401 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'calcium binding' 'calcium binding' 15401 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 15401 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 532 15401 '15N chemical shifts' 127 15401 '1H chemical shifts' 805 15401 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 . . 2011-05-03 2007-07-22 original author . 15401 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 15402 'complex with calcium ion' 15401 stop_ save_ ############### # Citations # ############### save_citations _Citation.Sf_category citations _Citation.Sf_framecode citations _Citation.Entry_ID 15401 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 21330362 _Citation.Full_citation . _Citation.Title 'Structures of Anabaena Calcium-binding Protein CcbP: INSIGHTS INTO CA2+ SIGNALING DURING HETEROCYST DIFFERENTIATION.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biol. Chem.' _Citation.Journal_name_full 'The Journal of biological chemistry' _Citation.Journal_volume 286 _Citation.Journal_issue 14 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 12381 _Citation.Page_last 12388 _Citation.Year 2011 _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.Entry_ID _Citation_author.Citation_ID 1 Yunfei Hu . . . 15401 1 2 Xinxin Zhang . . . 15401 1 3 Yunming Shi . . . 15401 1 4 Yanfeng Zhou . . . 15401 1 5 Wei Zhang . . . 15401 1 6 Xiao-Dong Su . . . 15401 1 7 Bin Xia . . . 15401 1 8 Jindong Zhao . . . 15401 1 9 Changwen Jin . . . 15401 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 15401 _Assembly.ID 1 _Assembly.Name ccbp _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 ccbp 1 $Alr1010_protein A . yes native no no . . . 15401 1 stop_ loop_ _Assembly_db_link.Author_supplied _Assembly_db_link.Database_code _Assembly_db_link.Accession_code _Assembly_db_link.Entry_mol_code _Assembly_db_link.Entry_mol_name _Assembly_db_link.Entry_experimental_method _Assembly_db_link.Entry_structure_resolution _Assembly_db_link.Entry_relation_type _Assembly_db_link.Entry_details _Assembly_db_link.Entry_ID _Assembly_db_link.Assembly_ID yes PDB 2P0P . . . . . . 15401 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_Alr1010_protein _Entity.Sf_category entity _Entity.Sf_framecode Alr1010_protein _Entity.Entry_ID 15401 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name Alr1010_protein _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 ; MASVERDETREHRIETEIIV DAEDKEERAMGWYYYLDDTL EFPFMGKWKKKSRKTSTIEE KTVEVLGMAPDDECLKDMYV EVADIGGKDDDVYTAKLSDI EAIDVDDDTQEAIADWLYWL ARGYKF ; _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 126 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method man _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-26 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no BMRB 15402 . Alr1010_protein . . . . . 100.00 126 100.00 100.00 6.74e-83 . . . . 15401 1 2 no PDB 2K2V . "Anabaena Ccbp In The Calcium-Bound Form" . . . . . 100.00 126 100.00 100.00 6.74e-83 . . . . 15401 1 3 no PDB 2P0P . "Calcium Binding Protein In The Free Form" . . . . . 100.00 126 100.00 100.00 6.74e-83 . . . . 15401 1 4 no PDB 2P0Q . "Calcium Binding Protein In The Calcium-Binding Form" . . . . . 100.00 126 100.00 100.00 6.74e-83 . . . . 15401 1 5 no PDB 3URG . "The Crystal Structure Of Anabaena Ccbp" . . . . . 100.00 146 100.00 100.00 1.63e-83 . . . . 15401 1 6 no DBJ BAB72967 . "alr1010 [Nostoc sp. PCC 7120]" . . . . . 100.00 126 100.00 100.00 6.74e-83 . . . . 15401 1 7 no GB AAX13998 . "CcbP [Nostoc sp. PCC 7120]" . . . . . 100.00 126 100.00 100.00 6.74e-83 . . . . 15401 1 8 no REF WP_010995184 . "hypothetical protein [Nostoc sp. PCC 7120]" . . . . . 100.00 126 100.00 100.00 6.74e-83 . . . . 15401 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'Alr1010 protein' RCSB_NAME 15401 1 CcbP SWS-SYNONYM 15401 1 'Complete proteome' SWS-KEYWORD 15401 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . MET . 15401 1 2 . ALA . 15401 1 3 . SER . 15401 1 4 . VAL . 15401 1 5 . GLU . 15401 1 6 . ARG . 15401 1 7 . ASP . 15401 1 8 . GLU . 15401 1 9 . THR . 15401 1 10 . ARG . 15401 1 11 . GLU . 15401 1 12 . HIS . 15401 1 13 . ARG . 15401 1 14 . ILE . 15401 1 15 . GLU . 15401 1 16 . THR . 15401 1 17 . GLU . 15401 1 18 . ILE . 15401 1 19 . ILE . 15401 1 20 . VAL . 15401 1 21 . ASP . 15401 1 22 . ALA . 15401 1 23 . GLU . 15401 1 24 . ASP . 15401 1 25 . LYS . 15401 1 26 . GLU . 15401 1 27 . GLU . 15401 1 28 . ARG . 15401 1 29 . ALA . 15401 1 30 . MET . 15401 1 31 . GLY . 15401 1 32 . TRP . 15401 1 33 . TYR . 15401 1 34 . TYR . 15401 1 35 . TYR . 15401 1 36 . LEU . 15401 1 37 . ASP . 15401 1 38 . ASP . 15401 1 39 . THR . 15401 1 40 . LEU . 15401 1 41 . GLU . 15401 1 42 . PHE . 15401 1 43 . PRO . 15401 1 44 . PHE . 15401 1 45 . MET . 15401 1 46 . GLY . 15401 1 47 . LYS . 15401 1 48 . TRP . 15401 1 49 . LYS . 15401 1 50 . LYS . 15401 1 51 . LYS . 15401 1 52 . SER . 15401 1 53 . ARG . 15401 1 54 . LYS . 15401 1 55 . THR . 15401 1 56 . SER . 15401 1 57 . THR . 15401 1 58 . ILE . 15401 1 59 . GLU . 15401 1 60 . GLU . 15401 1 61 . LYS . 15401 1 62 . THR . 15401 1 63 . VAL . 15401 1 64 . GLU . 15401 1 65 . VAL . 15401 1 66 . LEU . 15401 1 67 . GLY . 15401 1 68 . MET . 15401 1 69 . ALA . 15401 1 70 . PRO . 15401 1 71 . ASP . 15401 1 72 . ASP . 15401 1 73 . GLU . 15401 1 74 . CYS . 15401 1 75 . LEU . 15401 1 76 . LYS . 15401 1 77 . ASP . 15401 1 78 . MET . 15401 1 79 . TYR . 15401 1 80 . VAL . 15401 1 81 . GLU . 15401 1 82 . VAL . 15401 1 83 . ALA . 15401 1 84 . ASP . 15401 1 85 . ILE . 15401 1 86 . GLY . 15401 1 87 . GLY . 15401 1 88 . LYS . 15401 1 89 . ASP . 15401 1 90 . ASP . 15401 1 91 . ASP . 15401 1 92 . VAL . 15401 1 93 . TYR . 15401 1 94 . THR . 15401 1 95 . ALA . 15401 1 96 . LYS . 15401 1 97 . LEU . 15401 1 98 . SER . 15401 1 99 . ASP . 15401 1 100 . ILE . 15401 1 101 . GLU . 15401 1 102 . ALA . 15401 1 103 . ILE . 15401 1 104 . ASP . 15401 1 105 . VAL . 15401 1 106 . ASP . 15401 1 107 . ASP . 15401 1 108 . ASP . 15401 1 109 . THR . 15401 1 110 . GLN . 15401 1 111 . GLU . 15401 1 112 . ALA . 15401 1 113 . ILE . 15401 1 114 . ALA . 15401 1 115 . ASP . 15401 1 116 . TRP . 15401 1 117 . LEU . 15401 1 118 . TYR . 15401 1 119 . TRP . 15401 1 120 . LEU . 15401 1 121 . ALA . 15401 1 122 . ARG . 15401 1 123 . GLY . 15401 1 124 . TYR . 15401 1 125 . LYS . 15401 1 126 . PHE . 15401 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 15401 1 . ALA 2 2 15401 1 . SER 3 3 15401 1 . VAL 4 4 15401 1 . GLU 5 5 15401 1 . ARG 6 6 15401 1 . ASP 7 7 15401 1 . GLU 8 8 15401 1 . THR 9 9 15401 1 . ARG 10 10 15401 1 . GLU 11 11 15401 1 . HIS 12 12 15401 1 . ARG 13 13 15401 1 . ILE 14 14 15401 1 . GLU 15 15 15401 1 . THR 16 16 15401 1 . GLU 17 17 15401 1 . ILE 18 18 15401 1 . ILE 19 19 15401 1 . VAL 20 20 15401 1 . ASP 21 21 15401 1 . ALA 22 22 15401 1 . GLU 23 23 15401 1 . ASP 24 24 15401 1 . LYS 25 25 15401 1 . GLU 26 26 15401 1 . GLU 27 27 15401 1 . ARG 28 28 15401 1 . ALA 29 29 15401 1 . MET 30 30 15401 1 . GLY 31 31 15401 1 . TRP 32 32 15401 1 . TYR 33 33 15401 1 . TYR 34 34 15401 1 . TYR 35 35 15401 1 . LEU 36 36 15401 1 . ASP 37 37 15401 1 . ASP 38 38 15401 1 . THR 39 39 15401 1 . LEU 40 40 15401 1 . GLU 41 41 15401 1 . PHE 42 42 15401 1 . PRO 43 43 15401 1 . PHE 44 44 15401 1 . MET 45 45 15401 1 . GLY 46 46 15401 1 . LYS 47 47 15401 1 . TRP 48 48 15401 1 . LYS 49 49 15401 1 . LYS 50 50 15401 1 . LYS 51 51 15401 1 . SER 52 52 15401 1 . ARG 53 53 15401 1 . LYS 54 54 15401 1 . THR 55 55 15401 1 . SER 56 56 15401 1 . THR 57 57 15401 1 . ILE 58 58 15401 1 . GLU 59 59 15401 1 . GLU 60 60 15401 1 . LYS 61 61 15401 1 . THR 62 62 15401 1 . VAL 63 63 15401 1 . GLU 64 64 15401 1 . VAL 65 65 15401 1 . LEU 66 66 15401 1 . GLY 67 67 15401 1 . MET 68 68 15401 1 . ALA 69 69 15401 1 . PRO 70 70 15401 1 . ASP 71 71 15401 1 . ASP 72 72 15401 1 . GLU 73 73 15401 1 . CYS 74 74 15401 1 . LEU 75 75 15401 1 . LYS 76 76 15401 1 . ASP 77 77 15401 1 . MET 78 78 15401 1 . TYR 79 79 15401 1 . VAL 80 80 15401 1 . GLU 81 81 15401 1 . VAL 82 82 15401 1 . ALA 83 83 15401 1 . ASP 84 84 15401 1 . ILE 85 85 15401 1 . GLY 86 86 15401 1 . GLY 87 87 15401 1 . LYS 88 88 15401 1 . ASP 89 89 15401 1 . ASP 90 90 15401 1 . ASP 91 91 15401 1 . VAL 92 92 15401 1 . TYR 93 93 15401 1 . THR 94 94 15401 1 . ALA 95 95 15401 1 . LYS 96 96 15401 1 . LEU 97 97 15401 1 . SER 98 98 15401 1 . ASP 99 99 15401 1 . ILE 100 100 15401 1 . GLU 101 101 15401 1 . ALA 102 102 15401 1 . ILE 103 103 15401 1 . ASP 104 104 15401 1 . VAL 105 105 15401 1 . ASP 106 106 15401 1 . ASP 107 107 15401 1 . ASP 108 108 15401 1 . THR 109 109 15401 1 . GLN 110 110 15401 1 . GLU 111 111 15401 1 . ALA 112 112 15401 1 . ILE 113 113 15401 1 . ALA 114 114 15401 1 . ASP 115 115 15401 1 . TRP 116 116 15401 1 . LEU 117 117 15401 1 . TYR 118 118 15401 1 . TRP 119 119 15401 1 . LEU 120 120 15401 1 . ALA 121 121 15401 1 . ARG 122 122 15401 1 . GLY 123 123 15401 1 . TYR 124 124 15401 1 . LYS 125 125 15401 1 . PHE 126 126 15401 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 15401 _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.Subvariant _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.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $Alr1010_protein . 1167 organism . 'Anabaena sp.' 'Anabaena sp.' . . Bacteria . Anabaena 'Anabaena sp.' 'PCC 7120' . . . . . . . . . . . . . . . ccbP . . . . 15401 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 15401 _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_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _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.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $Alr1010_protein . 'recombinant technology' 'Escherichia coli' Bacteria . . Escherichia coli BL21(DE3) . . . . . . . . . . . . . . . pET15b . . . . . . 15401 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample _Sample.Sf_category sample _Sample.Sf_framecode sample _Sample.Entry_ID 15401 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details '1mM Ccbp U-15N,13C, 20mM Tris, 220mM NaCl,10mM DTT; 90% H2O, 10% D2O' _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 'Alr1010 protein' '[U-15N; U-13C]' . . 1 $Alr1010_protein . . 1 . . mM . . . . 15401 1 2 Tris . . . . . . . 20 . . mM . . . . 15401 1 3 NaCl . . . . . . . 220 . . mM . . . . 15401 1 4 DTT . . . . . . . 10 . . mM . . . . 15401 1 5 H2O . . . . . . . 90 . . % . . . . 15401 1 6 D2O . . . . . . . 10 . . % . . . . 15401 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 15401 _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' 220 . mM 15401 1 pH 7.5 . pH 15401 1 pressure 1 . atm 15401 1 temperature 303 . K 15401 1 stop_ save_ ############################ # Computer software used # ############################ save_XWINNMR _Software.Sf_category software _Software.Sf_framecode XWINNMR _Software.Entry_ID 15401 _Software.ID 1 _Software.Name xwinnmr _Software.Version 3.5 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Bruker . . 15401 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 15401 1 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 15401 _Software.ID 2 _Software.Name NMRPipe _Software.Version 2.1 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'F.Delaglio, S.Grzesiek, G.W.Vuister, G.Zhu, J.Pfeifer, A.Bax' . . 15401 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 15401 2 stop_ save_ save_NMRVIEW _Software.Sf_category software _Software.Sf_framecode NMRVIEW _Software.Entry_ID 15401 _Software.ID 3 _Software.Name NMRView _Software.Version 5 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'B.A.Johnson, R.A.Blevins' . . 15401 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 15401 3 stop_ save_ save_DYANA _Software.Sf_category software _Software.Sf_framecode DYANA _Software.Entry_ID 15401 _Software.ID 4 _Software.Name DYANA _Software.Version cyana2.0 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'P.Guntert, C.Mumenthaler, Wuthrich, K.W.Thrich' . . 15401 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 15401 4 stop_ save_ save_AMBER _Software.Sf_category software _Software.Sf_framecode AMBER _Software.Entry_ID 15401 _Software.ID 5 _Software.Name AMBER _Software.Version 7.0 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID D.A.Case . . 15401 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 15401 5 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 15401 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model AVANCE _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 15401 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model AVANCE _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 500 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 15401 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker AVANCE . 800 . . . 15401 1 2 spectrometer_2 Bruker AVANCE . 500 . . . 15401 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 15401 _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 3D_13C-separated_NOESY no . . . . . . . . . . 1 $sample isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 15401 1 2 3D_15N-separated_NOESY no . . . . . . . . . . 1 $sample isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 15401 1 3 HNCACB,CBCA(CO)NH no . . . . . . . . . . 1 $sample isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 15401 1 4 HNCO,HN(CA)CO no . . . . . . . . . . 1 $sample isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 15401 1 5 HC(C)H-COSY no . . . . . . . . . . 1 $sample isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 15401 1 6 HC(C)H-TOCSY no . . . . . . . . . . 1 $sample isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 15401 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 15401 _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.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0 internal indirect 0.25144952 . . . 1 $citations . . 1 $citations 15401 1 H 1 DSS 'methyl protons' . . . . ppm 0 internal direct 1 . . . 1 $citations . . 1 $citations 15401 1 N 15 DSS 'methyl protons' . . . . ppm 0 internal indirect 0.10132905 . . . 1 $citations . . 1 $citations 15401 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 15401 _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 3 HNCACB,CBCA(CO)NH . . . 15401 1 4 HNCO,HN(CA)CO . . . 15401 1 5 HC(C)H-COSY . . . 15401 1 6 HC(C)H-TOCSY . . . 15401 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 MET H H 1 8.180 0.03 . 1 . . . . 1 MET H . 15401 1 2 . 1 1 1 1 MET HA H 1 4.380 0.03 . 1 . . . . 1 MET HA . 15401 1 3 . 1 1 1 1 MET HB2 H 1 1.869 0.03 . 2 . . . . 1 MET HB1 . 15401 1 4 . 1 1 1 1 MET HB3 H 1 1.984 0.03 . 2 . . . . 1 MET HB2 . 15401 1 5 . 1 1 1 1 MET HG2 H 1 2.387 0.03 . 2 . . . . 1 MET HG1 . 15401 1 6 . 1 1 1 1 MET HG3 H 1 2.441 0.03 . 2 . . . . 1 MET HG2 . 15401 1 7 . 1 1 1 1 MET C C 13 175.348 0.30 . 1 . . . . 1 MET C . 15401 1 8 . 1 1 1 1 MET CA C 13 55.186 0.30 . 1 . . . . 1 MET CA . 15401 1 9 . 1 1 1 1 MET CB C 13 33.124 0.30 . 1 . . . . 1 MET CB . 15401 1 10 . 1 1 1 1 MET CG C 13 31.868 0.30 . 1 . . . . 1 MET CG . 15401 1 11 . 1 1 1 1 MET N N 15 122.591 0.30 . 1 . . . . 1 MET N . 15401 1 12 . 1 1 2 2 ALA H H 1 8.224 0.03 . 1 . . . . 2 ALA HN . 15401 1 13 . 1 1 2 2 ALA HA H 1 4.269 0.03 . 1 . . . . 2 ALA HA . 15401 1 14 . 1 1 2 2 ALA HB1 H 1 1.341 0.03 . 1 . . . . 2 ALA HB1 . 15401 1 15 . 1 1 2 2 ALA HB2 H 1 1.341 0.03 . 1 . . . . 2 ALA HB1 . 15401 1 16 . 1 1 2 2 ALA HB3 H 1 1.341 0.03 . 1 . . . . 2 ALA HB1 . 15401 1 17 . 1 1 2 2 ALA C C 13 177.664 0.30 . 1 . . . . 2 ALA C . 15401 1 18 . 1 1 2 2 ALA CA C 13 52.309 0.30 . 1 . . . . 2 ALA CA . 15401 1 19 . 1 1 2 2 ALA CB C 13 19.648 0.30 . 1 . . . . 2 ALA CB . 15401 1 20 . 1 1 2 2 ALA N N 15 126.143 0.30 . 1 . . . . 2 ALA N . 15401 1 21 . 1 1 3 3 SER H H 1 8.263 0.03 . 1 . . . . 3 SER HN . 15401 1 22 . 1 1 3 3 SER HA H 1 4.441 0.03 . 1 . . . . 3 SER HA . 15401 1 23 . 1 1 3 3 SER HB2 H 1 3.826 0.03 . 2 . . . . 3 SER HB1 . 15401 1 24 . 1 1 3 3 SER HB3 H 1 3.785 0.03 . 2 . . . . 3 SER HB2 . 15401 1 25 . 1 1 3 3 SER C C 13 174.192 0.30 . 1 . . . . 3 SER C . 15401 1 26 . 1 1 3 3 SER CA C 13 58.243 0.30 . 1 . . . . 3 SER CA . 15401 1 27 . 1 1 3 3 SER CB C 13 64.142 0.30 . 1 . . . . 3 SER CB . 15401 1 28 . 1 1 3 3 SER N N 15 115.895 0.30 . 1 . . . . 3 SER N . 15401 1 29 . 1 1 4 4 VAL H H 1 7.465 0.03 . 1 . . . . 4 VAL HN . 15401 1 30 . 1 1 4 4 VAL HA H 1 4.353 0.03 . 1 . . . . 4 VAL HA . 15401 1 31 . 1 1 4 4 VAL HB H 1 2.077 0.03 . 1 . . . . 4 VAL HB . 15401 1 32 . 1 1 4 4 VAL HG11 H 1 0.750 0.03 . 2 . . . . 4 VAL HG11 . 15401 1 33 . 1 1 4 4 VAL HG12 H 1 0.750 0.03 . 2 . . . . 4 VAL HG11 . 15401 1 34 . 1 1 4 4 VAL HG13 H 1 0.750 0.03 . 2 . . . . 4 VAL HG11 . 15401 1 35 . 1 1 4 4 VAL HG21 H 1 0.817 0.03 . 2 . . . . 4 VAL HG21 . 15401 1 36 . 1 1 4 4 VAL HG22 H 1 0.817 0.03 . 2 . . . . 4 VAL HG21 . 15401 1 37 . 1 1 4 4 VAL HG23 H 1 0.817 0.03 . 2 . . . . 4 VAL HG21 . 15401 1 38 . 1 1 4 4 VAL C C 13 175.289 0.30 . 1 . . . . 4 VAL C . 15401 1 39 . 1 1 4 4 VAL CA C 13 60.412 0.30 . 1 . . . . 4 VAL CA . 15401 1 40 . 1 1 4 4 VAL CB C 13 34.167 0.30 . 1 . . . . 4 VAL CB . 15401 1 41 . 1 1 4 4 VAL CG1 C 13 19.857 0.30 . 1 . . . . 4 VAL CG1 . 15401 1 42 . 1 1 4 4 VAL CG2 C 13 21.351 0.30 . 1 . . . . 4 VAL CG2 . 15401 1 43 . 1 1 4 4 VAL N N 15 118.472 0.30 . 1 . . . . 4 VAL N . 15401 1 44 . 1 1 5 5 GLU H H 1 8.433 0.03 . 1 . . . . 5 GLU HN . 15401 1 45 . 1 1 5 5 GLU HA H 1 4.156 0.03 . 1 . . . . 5 GLU HA . 15401 1 46 . 1 1 5 5 GLU HB2 H 1 1.947 0.03 . 2 . . . . 5 GLU HB1 . 15401 1 47 . 1 1 5 5 GLU HB3 H 1 2.105 0.03 . 2 . . . . 5 GLU HB2 . 15401 1 48 . 1 1 5 5 GLU HG2 H 1 2.406 0.03 . 2 . . . . 5 GLU HG1 . 15401 1 49 . 1 1 5 5 GLU HG3 H 1 2.360 0.03 . 2 . . . . 5 GLU HG2 . 15401 1 50 . 1 1 5 5 GLU C C 13 176.081 0.30 . 1 . . . . 5 GLU C . 15401 1 51 . 1 1 5 5 GLU CA C 13 56.141 0.30 . 1 . . . . 5 GLU CA . 15401 1 52 . 1 1 5 5 GLU CB C 13 30.491 0.30 . 1 . . . . 5 GLU CB . 15401 1 53 . 1 1 5 5 GLU CG C 13 36.405 0.30 . 1 . . . . 5 GLU CG . 15401 1 54 . 1 1 5 5 GLU N N 15 124.745 0.30 . 1 . . . . 5 GLU N . 15401 1 55 . 1 1 6 6 ARG H H 1 8.574 0.03 . 1 . . . . 6 ARG HN . 15401 1 56 . 1 1 6 6 ARG HA H 1 4.445 0.03 . 1 . . . . 6 ARG HA . 15401 1 57 . 1 1 6 6 ARG HB2 H 1 1.668 0.03 . 2 . . . . 6 ARG HB1 . 15401 1 58 . 1 1 6 6 ARG HB3 H 1 1.769 0.03 . 2 . . . . 6 ARG HB2 . 15401 1 59 . 1 1 6 6 ARG HD2 H 1 3.161 0.03 . 2 . . . . 6 ARG HD1 . 15401 1 60 . 1 1 6 6 ARG HD3 H 1 3.329 0.03 . 2 . . . . 6 ARG HD2 . 15401 1 61 . 1 1 6 6 ARG HG2 H 1 1.422 0.03 . 2 . . . . 6 ARG HG2 . 15401 1 62 . 1 1 6 6 ARG C C 13 176.061 0.30 . 1 . . . . 6 ARG C . 15401 1 63 . 1 1 6 6 ARG CA C 13 57.201 0.30 . 1 . . . . 6 ARG CA . 15401 1 64 . 1 1 6 6 ARG CB C 13 31.219 0.30 . 1 . . . . 6 ARG CB . 15401 1 65 . 1 1 6 6 ARG CD C 13 43.442 0.30 . 1 . . . . 6 ARG CD . 15401 1 66 . 1 1 6 6 ARG CG C 13 28.923 0.30 . 1 . . . . 6 ARG CG . 15401 1 67 . 1 1 6 6 ARG N N 15 122.929 0.30 . 1 . . . . 6 ARG N . 15401 1 68 . 1 1 7 7 ASP H H 1 8.851 0.03 . 1 . . . . 7 ASP HN . 15401 1 69 . 1 1 7 7 ASP HA H 1 4.913 0.03 . 1 . . . . 7 ASP HA . 15401 1 70 . 1 1 7 7 ASP HB2 H 1 2.412 0.03 . 2 . . . . 7 ASP HB1 . 15401 1 71 . 1 1 7 7 ASP HB3 H 1 2.380 0.03 . 2 . . . . 7 ASP HB2 . 15401 1 72 . 1 1 7 7 ASP C C 13 176.239 0.30 . 1 . . . . 7 ASP C . 15401 1 73 . 1 1 7 7 ASP CA C 13 52.280 0.30 . 1 . . . . 7 ASP CA . 15401 1 74 . 1 1 7 7 ASP CB C 13 43.042 0.30 . 1 . . . . 7 ASP CB . 15401 1 75 . 1 1 7 7 ASP N N 15 127.048 0.30 . 1 . . . . 7 ASP N . 15401 1 76 . 1 1 8 8 GLU H H 1 9.184 0.03 . 1 . . . . 8 GLU HN . 15401 1 77 . 1 1 8 8 GLU HA H 1 4.019 0.03 . 1 . . . . 8 GLU HA . 15401 1 78 . 1 1 8 8 GLU HB2 H 1 2.017 0.03 . 2 . . . . 8 GLU HB1 . 15401 1 79 . 1 1 8 8 GLU HB3 H 1 2.115 0.03 . 2 . . . . 8 GLU HB2 . 15401 1 80 . 1 1 8 8 GLU HG2 H 1 2.403 0.03 . 2 . . . . 8 GLU HG2 . 15401 1 81 . 1 1 8 8 GLU C C 13 178.822 0.30 . 1 . . . . 8 GLU C . 15401 1 82 . 1 1 8 8 GLU CA C 13 59.267 0.30 . 1 . . . . 8 GLU CA . 15401 1 83 . 1 1 8 8 GLU CB C 13 29.266 0.30 . 1 . . . . 8 GLU CB . 15401 1 84 . 1 1 8 8 GLU CG C 13 35.192 0.30 . 1 . . . . 8 GLU CG . 15401 1 85 . 1 1 8 8 GLU N N 15 125.106 0.30 . 1 . . . . 8 GLU N . 15401 1 86 . 1 1 9 9 THR H H 1 8.163 0.03 . 1 . . . . 9 THR HN . 15401 1 87 . 1 1 9 9 THR HA H 1 4.005 0.03 . 1 . . . . 9 THR HA . 15401 1 88 . 1 1 9 9 THR HB H 1 4.301 0.03 . 1 . . . . 9 THR HB . 15401 1 89 . 1 1 9 9 THR HG21 H 1 1.215 0.03 . 1 . . . . 9 THR HG21 . 15401 1 90 . 1 1 9 9 THR HG22 H 1 1.215 0.03 . 1 . . . . 9 THR HG21 . 15401 1 91 . 1 1 9 9 THR HG23 H 1 1.215 0.03 . 1 . . . . 9 THR HG21 . 15401 1 92 . 1 1 9 9 THR C C 13 177.460 0.30 . 1 . . . . 9 THR C . 15401 1 93 . 1 1 9 9 THR CA C 13 66.606 0.30 . 1 . . . . 9 THR CA . 15401 1 94 . 1 1 9 9 THR CB C 13 68.076 0.30 . 1 . . . . 9 THR CB . 15401 1 95 . 1 1 9 9 THR CG2 C 13 22.032 0.30 . 1 . . . . 9 THR CG2 . 15401 1 96 . 1 1 9 9 THR N N 15 117.384 0.30 . 1 . . . . 9 THR N . 15401 1 97 . 1 1 10 10 ARG H H 1 7.522 0.03 . 1 . . . . 10 ARG HN . 15401 1 98 . 1 1 10 10 ARG HA H 1 3.929 0.03 . 1 . . . . 10 ARG HA . 15401 1 99 . 1 1 10 10 ARG HB2 H 1 1.010 0.03 . 2 . . . . 10 ARG HB1 . 15401 1 100 . 1 1 10 10 ARG HB3 H 1 1.342 0.03 . 2 . . . . 10 ARG HB2 . 15401 1 101 . 1 1 10 10 ARG HD2 H 1 3.249 0.03 . 2 . . . . 10 ARG HD2 . 15401 1 102 . 1 1 10 10 ARG HE H 1 9.857 0.03 . 1 . . . . 10 ARG HE . 15401 1 103 . 1 1 10 10 ARG HG2 H 1 1.523 0.03 . 2 . . . . 10 ARG HG2 . 15401 1 104 . 1 1 10 10 ARG C C 13 178.752 0.30 . 1 . . . . 10 ARG C . 15401 1 105 . 1 1 10 10 ARG CA C 13 60.424 0.30 . 1 . . . . 10 ARG CA . 15401 1 106 . 1 1 10 10 ARG CB C 13 29.482 0.30 . 1 . . . . 10 ARG CB . 15401 1 107 . 1 1 10 10 ARG CD C 13 43.414 0.30 . 1 . . . . 10 ARG CD . 15401 1 108 . 1 1 10 10 ARG N N 15 122.364 0.30 . 1 . . . . 10 ARG N . 15401 1 109 . 1 1 10 10 ARG NE N 15 115.964 0.30 . 1 . . . . 10 ARG NE . 15401 1 110 . 1 1 11 11 GLU H H 1 8.656 0.03 . 1 . . . . 11 GLU HN . 15401 1 111 . 1 1 11 11 GLU HA H 1 4.099 0.03 . 1 . . . . 11 GLU HA . 15401 1 112 . 1 1 11 11 GLU HB2 H 1 2.391 0.03 . 2 . . . . 11 GLU HB1 . 15401 1 113 . 1 1 11 11 GLU HG2 H 1 2.286 0.03 . 2 . . . . 11 GLU HG1 . 15401 1 114 . 1 1 11 11 GLU HG3 H 1 2.811 0.03 . 2 . . . . 11 GLU HG2 . 15401 1 115 . 1 1 11 11 GLU C C 13 178.839 0.30 . 1 . . . . 11 GLU C . 15401 1 116 . 1 1 11 11 GLU CA C 13 59.570 0.30 . 1 . . . . 11 GLU CA . 15401 1 117 . 1 1 11 11 GLU CB C 13 28.692 0.30 . 1 . . . . 11 GLU CB . 15401 1 118 . 1 1 11 11 GLU CG C 13 34.900 0.30 . 1 . . . . 11 GLU CG . 15401 1 119 . 1 1 11 11 GLU N N 15 117.657 0.30 . 1 . . . . 11 GLU N . 15401 1 120 . 1 1 12 12 HIS H H 1 8.193 0.03 . 1 . . . . 12 HIS HN . 15401 1 121 . 1 1 12 12 HIS HA H 1 4.423 0.03 . 1 . . . . 12 HIS HA . 15401 1 122 . 1 1 12 12 HIS HB2 H 1 3.232 0.03 . 2 . . . . 12 HIS HB1 . 15401 1 123 . 1 1 12 12 HIS HB3 H 1 3.364 0.03 . 2 . . . . 12 HIS HB2 . 15401 1 124 . 1 1 12 12 HIS HD2 H 1 7.110 0.03 . 1 . . . . 12 HIS HD2 . 15401 1 125 . 1 1 12 12 HIS HE1 H 1 8.070 0.03 . 1 . . . . 12 HIS HE1 . 15401 1 126 . 1 1 12 12 HIS C C 13 178.630 0.30 . 1 . . . . 12 HIS C . 15401 1 127 . 1 1 12 12 HIS CA C 13 59.823 0.30 . 1 . . . . 12 HIS CA . 15401 1 128 . 1 1 12 12 HIS CB C 13 29.679 0.30 . 1 . . . . 12 HIS CB . 15401 1 129 . 1 1 12 12 HIS CE1 C 13 137.918 0.30 . 1 . . . . 12 HIS CE1 . 15401 1 130 . 1 1 12 12 HIS N N 15 118.079 0.30 . 1 . . . . 12 HIS N . 15401 1 131 . 1 1 13 13 ARG H H 1 7.662 0.03 . 1 . . . . 13 ARG HN . 15401 1 132 . 1 1 13 13 ARG HA H 1 3.872 0.03 . 1 . . . . 13 ARG HA . 15401 1 133 . 1 1 13 13 ARG HB2 H 1 1.922 0.03 . 2 . . . . 13 ARG HB1 . 15401 1 134 . 1 1 13 13 ARG HB3 H 1 1.780 0.03 . 2 . . . . 13 ARG HB2 . 15401 1 135 . 1 1 13 13 ARG HD2 H 1 3.264 0.03 . 2 . . . . 13 ARG HD2 . 15401 1 136 . 1 1 13 13 ARG HE H 1 9.837 0.03 . 1 . . . . 13 ARG HE . 15401 1 137 . 1 1 13 13 ARG HG2 H 1 1.489 0.03 . 2 . . . . 13 ARG HG1 . 15401 1 138 . 1 1 13 13 ARG HG3 H 1 1.200 0.03 . 2 . . . . 13 ARG HG2 . 15401 1 139 . 1 1 13 13 ARG C C 13 178.247 0.30 . 1 . . . . 13 ARG C . 15401 1 140 . 1 1 13 13 ARG CA C 13 60.426 0.30 . 1 . . . . 13 ARG CA . 15401 1 141 . 1 1 13 13 ARG CB C 13 30.380 0.30 . 1 . . . . 13 ARG CB . 15401 1 142 . 1 1 13 13 ARG CD C 13 43.636 0.30 . 1 . . . . 13 ARG CD . 15401 1 143 . 1 1 13 13 ARG CG C 13 28.064 0.30 . 1 . . . . 13 ARG CG . 15401 1 144 . 1 1 13 13 ARG N N 15 124.257 0.30 . 1 . . . . 13 ARG N . 15401 1 145 . 1 1 13 13 ARG NE N 15 116.051 0.30 . 1 . . . . 13 ARG NE . 15401 1 146 . 1 1 14 14 ILE H H 1 8.827 0.03 . 1 . . . . 14 ILE HN . 15401 1 147 . 1 1 14 14 ILE HA H 1 3.360 0.03 . 1 . . . . 14 ILE HA . 15401 1 148 . 1 1 14 14 ILE HB H 1 2.226 0.03 . 1 . . . . 14 ILE HB . 15401 1 149 . 1 1 14 14 ILE HD11 H 1 1.588 0.03 . 1 . . . . 14 ILE HD11 . 15401 1 150 . 1 1 14 14 ILE HD12 H 1 1.588 0.03 . 1 . . . . 14 ILE HD11 . 15401 1 151 . 1 1 14 14 ILE HD13 H 1 1.588 0.03 . 1 . . . . 14 ILE HD11 . 15401 1 152 . 1 1 14 14 ILE HG12 H 1 1.347 0.03 . 1 . . . . 14 ILE HG12 . 15401 1 153 . 1 1 14 14 ILE HG21 H 1 1.269 0.03 . 1 . . . . 14 ILE HG21 . 15401 1 154 . 1 1 14 14 ILE HG22 H 1 1.269 0.03 . 1 . . . . 14 ILE HG21 . 15401 1 155 . 1 1 14 14 ILE HG23 H 1 1.269 0.03 . 1 . . . . 14 ILE HG21 . 15401 1 156 . 1 1 14 14 ILE C C 13 178.093 0.30 . 1 . . . . 14 ILE C . 15401 1 157 . 1 1 14 14 ILE CA C 13 65.469 0.30 . 1 . . . . 14 ILE CA . 15401 1 158 . 1 1 14 14 ILE CB C 13 38.749 0.30 . 1 . . . . 14 ILE CB . 15401 1 159 . 1 1 14 14 ILE CD1 C 13 14.190 0.30 . 1 . . . . 14 ILE CD1 . 15401 1 160 . 1 1 14 14 ILE CG1 C 13 30.282 0.30 . 1 . . . . 14 ILE CG1 . 15401 1 161 . 1 1 14 14 ILE CG2 C 13 18.665 0.30 . 1 . . . . 14 ILE CG2 . 15401 1 162 . 1 1 14 14 ILE N N 15 121.202 0.30 . 1 . . . . 14 ILE N . 15401 1 163 . 1 1 15 15 GLU H H 1 8.249 0.03 . 1 . . . . 15 GLU HN . 15401 1 164 . 1 1 15 15 GLU HA H 1 4.008 0.03 . 1 . . . . 15 GLU HA . 15401 1 165 . 1 1 15 15 GLU HB2 H 1 2.045 0.03 . 2 . . . . 15 GLU HB1 . 15401 1 166 . 1 1 15 15 GLU HB3 H 1 2.159 0.03 . 2 . . . . 15 GLU HB2 . 15401 1 167 . 1 1 15 15 GLU HG2 H 1 2.266 0.03 . 2 . . . . 15 GLU HG1 . 15401 1 168 . 1 1 15 15 GLU HG3 H 1 2.466 0.03 . 2 . . . . 15 GLU HG2 . 15401 1 169 . 1 1 15 15 GLU C C 13 178.353 0.30 . 1 . . . . 15 GLU C . 15401 1 170 . 1 1 15 15 GLU CA C 13 59.512 0.30 . 1 . . . . 15 GLU CA . 15401 1 171 . 1 1 15 15 GLU CB C 13 30.534 0.30 . 1 . . . . 15 GLU CB . 15401 1 172 . 1 1 15 15 GLU CG C 13 36.411 0.30 . 1 . . . . 15 GLU CG . 15401 1 173 . 1 1 15 15 GLU N N 15 117.221 0.30 . 1 . . . . 15 GLU N . 15401 1 174 . 1 1 16 16 THR H H 1 7.838 0.03 . 1 . . . . 16 THR HN . 15401 1 175 . 1 1 16 16 THR HA H 1 4.242 0.03 . 1 . . . . 16 THR HA . 15401 1 176 . 1 1 16 16 THR HB H 1 4.070 0.03 . 1 . . . . 16 THR HB . 15401 1 177 . 1 1 16 16 THR HG21 H 1 1.005 0.03 . 1 . . . . 16 THR HG21 . 15401 1 178 . 1 1 16 16 THR HG22 H 1 1.005 0.03 . 1 . . . . 16 THR HG21 . 15401 1 179 . 1 1 16 16 THR HG23 H 1 1.005 0.03 . 1 . . . . 16 THR HG21 . 15401 1 180 . 1 1 16 16 THR C C 13 175.613 0.30 . 1 . . . . 16 THR C . 15401 1 181 . 1 1 16 16 THR CA C 13 63.542 0.30 . 1 . . . . 16 THR CA . 15401 1 182 . 1 1 16 16 THR CB C 13 70.739 0.30 . 1 . . . . 16 THR CB . 15401 1 183 . 1 1 16 16 THR CG2 C 13 21.576 0.30 . 1 . . . . 16 THR CG2 . 15401 1 184 . 1 1 16 16 THR N N 15 106.278 0.30 . 1 . . . . 16 THR N . 15401 1 185 . 1 1 17 17 GLU H H 1 8.145 0.03 . 1 . . . . 17 GLU HN . 15401 1 186 . 1 1 17 17 GLU HA H 1 4.539 0.03 . 1 . . . . 17 GLU HA . 15401 1 187 . 1 1 17 17 GLU HB2 H 1 1.829 0.03 . 2 . . . . 17 GLU HB1 . 15401 1 188 . 1 1 17 17 GLU HB3 H 1 1.991 0.03 . 2 . . . . 17 GLU HB2 . 15401 1 189 . 1 1 17 17 GLU HG2 H 1 2.226 0.03 . 2 . . . . 17 GLU HG1 . 15401 1 190 . 1 1 17 17 GLU HG3 H 1 2.105 0.03 . 2 . . . . 17 GLU HG2 . 15401 1 191 . 1 1 17 17 GLU C C 13 176.259 0.30 . 1 . . . . 17 GLU C . 15401 1 192 . 1 1 17 17 GLU CA C 13 56.851 0.30 . 1 . . . . 17 GLU CA . 15401 1 193 . 1 1 17 17 GLU CB C 13 31.622 0.30 . 1 . . . . 17 GLU CB . 15401 1 194 . 1 1 17 17 GLU CG C 13 36.362 0.30 . 1 . . . . 17 GLU CG . 15401 1 195 . 1 1 17 17 GLU N N 15 118.623 0.30 . 1 . . . . 17 GLU N . 15401 1 196 . 1 1 18 18 ILE H H 1 6.909 0.03 . 1 . . . . 18 ILE HN . 15401 1 197 . 1 1 18 18 ILE HA H 1 3.464 0.03 . 1 . . . . 18 ILE HA . 15401 1 198 . 1 1 18 18 ILE HB H 1 1.212 0.03 . 1 . . . . 18 ILE HB . 15401 1 199 . 1 1 18 18 ILE HD11 H 1 -0.446 0.03 . 1 . . . . 18 ILE HD11 . 15401 1 200 . 1 1 18 18 ILE HD12 H 1 -0.446 0.03 . 1 . . . . 18 ILE HD11 . 15401 1 201 . 1 1 18 18 ILE HD13 H 1 -0.446 0.03 . 1 . . . . 18 ILE HD11 . 15401 1 202 . 1 1 18 18 ILE HG12 H 1 -1.128 0.03 . 1 . . . . 18 ILE HG11 . 15401 1 203 . 1 1 18 18 ILE HG13 H 1 0.704 0.03 . 1 . . . . 18 ILE HG12 . 15401 1 204 . 1 1 18 18 ILE HG21 H 1 -0.931 0.03 . 1 . . . . 18 ILE HG21 . 15401 1 205 . 1 1 18 18 ILE HG22 H 1 -0.931 0.03 . 1 . . . . 18 ILE HG21 . 15401 1 206 . 1 1 18 18 ILE HG23 H 1 -0.931 0.03 . 1 . . . . 18 ILE HG21 . 15401 1 207 . 1 1 18 18 ILE C C 13 176.152 0.30 . 1 . . . . 18 ILE C . 15401 1 208 . 1 1 18 18 ILE CA C 13 65.151 0.30 . 1 . . . . 18 ILE CA . 15401 1 209 . 1 1 18 18 ILE CB C 13 37.687 0.30 . 1 . . . . 18 ILE CB . 15401 1 210 . 1 1 18 18 ILE CD1 C 13 13.450 0.30 . 1 . . . . 18 ILE CD1 . 15401 1 211 . 1 1 18 18 ILE CG1 C 13 25.789 0.30 . 1 . . . . 18 ILE CG1 . 15401 1 212 . 1 1 18 18 ILE CG2 C 13 14.007 0.30 . 1 . . . . 18 ILE CG2 . 15401 1 213 . 1 1 18 18 ILE N N 15 118.230 0.30 . 1 . . . . 18 ILE N . 15401 1 214 . 1 1 19 19 ILE H H 1 8.034 0.03 . 1 . . . . 19 ILE HN . 15401 1 215 . 1 1 19 19 ILE HA H 1 4.141 0.03 . 1 . . . . 19 ILE HA . 15401 1 216 . 1 1 19 19 ILE HB H 1 2.283 0.03 . 1 . . . . 19 ILE HB . 15401 1 217 . 1 1 19 19 ILE HD11 H 1 1.010 0.03 . 1 . . . . 19 ILE HD11 . 15401 1 218 . 1 1 19 19 ILE HD12 H 1 1.010 0.03 . 1 . . . . 19 ILE HD11 . 15401 1 219 . 1 1 19 19 ILE HD13 H 1 1.010 0.03 . 1 . . . . 19 ILE HD11 . 15401 1 220 . 1 1 19 19 ILE HG12 H 1 1.203 0.03 . 1 . . . . 19 ILE HG11 . 15401 1 221 . 1 1 19 19 ILE HG13 H 1 1.466 0.03 . 1 . . . . 19 ILE HG12 . 15401 1 222 . 1 1 19 19 ILE HG21 H 1 0.879 0.03 . 1 . . . . 19 ILE HG21 . 15401 1 223 . 1 1 19 19 ILE HG22 H 1 0.879 0.03 . 1 . . . . 19 ILE HG21 . 15401 1 224 . 1 1 19 19 ILE HG23 H 1 0.879 0.03 . 1 . . . . 19 ILE HG21 . 15401 1 225 . 1 1 19 19 ILE C C 13 176.031 0.30 . 1 . . . . 19 ILE C . 15401 1 226 . 1 1 19 19 ILE CA C 13 60.510 0.30 . 1 . . . . 19 ILE CA . 15401 1 227 . 1 1 19 19 ILE CB C 13 37.267 0.30 . 1 . . . . 19 ILE CB . 15401 1 228 . 1 1 19 19 ILE CD1 C 13 12.691 0.30 . 1 . . . . 19 ILE CD1 . 15401 1 229 . 1 1 19 19 ILE CG1 C 13 27.000 0.30 . 1 . . . . 19 ILE CG1 . 15401 1 230 . 1 1 19 19 ILE CG2 C 13 19.153 0.30 . 1 . . . . 19 ILE CG2 . 15401 1 231 . 1 1 19 19 ILE N N 15 112.970 0.30 . 1 . . . . 19 ILE N . 15401 1 232 . 1 1 20 20 VAL H H 1 6.528 0.03 . 1 . . . . 20 VAL HN . 15401 1 233 . 1 1 20 20 VAL HA H 1 3.679 0.03 . 1 . . . . 20 VAL HA . 15401 1 234 . 1 1 20 20 VAL HB H 1 1.905 0.03 . 1 . . . . 20 VAL HB . 15401 1 235 . 1 1 20 20 VAL HG11 H 1 0.741 0.03 . 2 . . . . 20 VAL HG11 . 15401 1 236 . 1 1 20 20 VAL HG12 H 1 0.741 0.03 . 2 . . . . 20 VAL HG11 . 15401 1 237 . 1 1 20 20 VAL HG13 H 1 0.741 0.03 . 2 . . . . 20 VAL HG11 . 15401 1 238 . 1 1 20 20 VAL HG21 H 1 0.717 0.03 . 2 . . . . 20 VAL HG21 . 15401 1 239 . 1 1 20 20 VAL HG22 H 1 0.717 0.03 . 2 . . . . 20 VAL HG21 . 15401 1 240 . 1 1 20 20 VAL HG23 H 1 0.717 0.03 . 2 . . . . 20 VAL HG21 . 15401 1 241 . 1 1 20 20 VAL C C 13 174.614 0.30 . 1 . . . . 20 VAL C . 15401 1 242 . 1 1 20 20 VAL CA C 13 63.090 0.30 . 1 . . . . 20 VAL CA . 15401 1 243 . 1 1 20 20 VAL CB C 13 30.691 0.30 . 1 . . . . 20 VAL CB . 15401 1 244 . 1 1 20 20 VAL CG1 C 13 19.888 0.30 . 1 . . . . 20 VAL CG1 . 15401 1 245 . 1 1 20 20 VAL CG2 C 13 21.262 0.30 . 1 . . . . 20 VAL CG2 . 15401 1 246 . 1 1 20 20 VAL N N 15 120.388 0.30 . 1 . . . . 20 VAL N . 15401 1 247 . 1 1 21 21 ASP H H 1 8.617 0.03 . 1 . . . . 21 ASP HN . 15401 1 248 . 1 1 21 21 ASP HA H 1 4.516 0.03 . 1 . . . . 21 ASP HA . 15401 1 249 . 1 1 21 21 ASP HB2 H 1 2.740 0.03 . 2 . . . . 21 ASP HB1 . 15401 1 250 . 1 1 21 21 ASP HB3 H 1 2.837 0.03 . 2 . . . . 21 ASP HB2 . 15401 1 251 . 1 1 21 21 ASP C C 13 175.002 0.30 . 1 . . . . 21 ASP C . 15401 1 252 . 1 1 21 21 ASP CA C 13 55.034 0.30 . 1 . . . . 21 ASP CA . 15401 1 253 . 1 1 21 21 ASP CB C 13 40.373 0.30 . 1 . . . . 21 ASP CB . 15401 1 254 . 1 1 21 21 ASP N N 15 122.489 0.30 . 1 . . . . 21 ASP N . 15401 1 255 . 1 1 22 22 ALA H H 1 7.776 0.03 . 1 . . . . 22 ALA HN . 15401 1 256 . 1 1 22 22 ALA HA H 1 4.343 0.03 . 1 . . . . 22 ALA HA . 15401 1 257 . 1 1 22 22 ALA HB1 H 1 1.294 0.03 . 1 . . . . 22 ALA HB1 . 15401 1 258 . 1 1 22 22 ALA HB2 H 1 1.294 0.03 . 1 . . . . 22 ALA HB1 . 15401 1 259 . 1 1 22 22 ALA HB3 H 1 1.294 0.03 . 1 . . . . 22 ALA HB1 . 15401 1 260 . 1 1 22 22 ALA C C 13 177.894 0.30 . 1 . . . . 22 ALA C . 15401 1 261 . 1 1 22 22 ALA CA C 13 52.718 0.30 . 1 . . . . 22 ALA CA . 15401 1 262 . 1 1 22 22 ALA CB C 13 20.122 0.30 . 1 . . . . 22 ALA CB . 15401 1 263 . 1 1 22 22 ALA N N 15 123.462 0.30 . 1 . . . . 22 ALA N . 15401 1 264 . 1 1 23 23 GLU H H 1 9.124 0.03 . 1 . . . . 23 GLU HN . 15401 1 265 . 1 1 23 23 GLU HA H 1 4.533 0.03 . 1 . . . . 23 GLU HA . 15401 1 266 . 1 1 23 23 GLU HB2 H 1 1.969 0.03 . 2 . . . . 23 GLU HB1 . 15401 1 267 . 1 1 23 23 GLU HB3 H 1 2.147 0.03 . 2 . . . . 23 GLU HB2 . 15401 1 268 . 1 1 23 23 GLU HG2 H 1 2.222 0.03 . 2 . . . . 23 GLU HG1 . 15401 1 269 . 1 1 23 23 GLU HG3 H 1 2.336 0.03 . 2 . . . . 23 GLU HG2 . 15401 1 270 . 1 1 23 23 GLU C C 13 175.919 0.30 . 1 . . . . 23 GLU C . 15401 1 271 . 1 1 23 23 GLU CA C 13 57.178 0.30 . 1 . . . . 23 GLU CA . 15401 1 272 . 1 1 23 23 GLU CB C 13 32.465 0.30 . 1 . . . . 23 GLU CB . 15401 1 273 . 1 1 23 23 GLU CG C 13 36.497 0.30 . 1 . . . . 23 GLU CG . 15401 1 274 . 1 1 23 23 GLU N N 15 122.983 0.30 . 1 . . . . 23 GLU N . 15401 1 275 . 1 1 24 24 ASP H H 1 7.910 0.03 . 1 . . . . 24 ASP HN . 15401 1 276 . 1 1 24 24 ASP HA H 1 4.865 0.03 . 1 . . . . 24 ASP HA . 15401 1 277 . 1 1 24 24 ASP HB2 H 1 2.829 0.03 . 2 . . . . 24 ASP HB1 . 15401 1 278 . 1 1 24 24 ASP HB3 H 1 3.037 0.03 . 2 . . . . 24 ASP HB2 . 15401 1 279 . 1 1 24 24 ASP C C 13 176.731 0.30 . 1 . . . . 24 ASP C . 15401 1 280 . 1 1 24 24 ASP CA C 13 53.196 0.30 . 1 . . . . 24 ASP CA . 15401 1 281 . 1 1 24 24 ASP CB C 13 42.927 0.30 . 1 . . . . 24 ASP CB . 15401 1 282 . 1 1 24 24 ASP N N 15 119.336 0.30 . 1 . . . . 24 ASP N . 15401 1 283 . 1 1 25 25 LYS H H 1 8.576 0.03 . 1 . . . . 25 LYS HN . 15401 1 284 . 1 1 25 25 LYS HA H 1 4.380 0.03 . 1 . . . . 25 LYS HA . 15401 1 285 . 1 1 25 25 LYS HB2 H 1 1.965 0.03 . 2 . . . . 25 LYS HB2 . 15401 1 286 . 1 1 25 25 LYS HD2 H 1 1.832 0.03 . 2 . . . . 25 LYS HD2 . 15401 1 287 . 1 1 25 25 LYS HE2 H 1 3.179 0.03 . 2 . . . . 25 LYS HE2 . 15401 1 288 . 1 1 25 25 LYS HG2 H 1 1.614 0.03 . 2 . . . . 25 LYS HG1 . 15401 1 289 . 1 1 25 25 LYS HG3 H 1 1.787 0.03 . 2 . . . . 25 LYS HG2 . 15401 1 290 . 1 1 25 25 LYS C C 13 179.385 0.30 . 1 . . . . 25 LYS C . 15401 1 291 . 1 1 25 25 LYS CA C 13 60.404 0.30 . 1 . . . . 25 LYS CA . 15401 1 292 . 1 1 25 25 LYS CB C 13 33.055 0.30 . 1 . . . . 25 LYS CB . 15401 1 293 . 1 1 25 25 LYS CD C 13 29.809 0.30 . 1 . . . . 25 LYS CD . 15401 1 294 . 1 1 25 25 LYS CE C 13 42.274 0.30 . 1 . . . . 25 LYS CE . 15401 1 295 . 1 1 25 25 LYS CG C 13 24.335 0.30 . 1 . . . . 25 LYS CG . 15401 1 296 . 1 1 25 25 LYS N N 15 120.321 0.30 . 1 . . . . 25 LYS N . 15401 1 297 . 1 1 26 26 GLU H H 1 8.520 0.03 . 1 . . . . 26 GLU HN . 15401 1 298 . 1 1 26 26 GLU HA H 1 4.013 0.03 . 1 . . . . 26 GLU HA . 15401 1 299 . 1 1 26 26 GLU HB2 H 1 2.062 0.03 . 2 . . . . 26 GLU HB1 . 15401 1 300 . 1 1 26 26 GLU HB3 H 1 2.176 0.03 . 2 . . . . 26 GLU HB2 . 15401 1 301 . 1 1 26 26 GLU HG2 H 1 2.299 0.03 . 2 . . . . 26 GLU HG2 . 15401 1 302 . 1 1 26 26 GLU C C 13 178.519 0.30 . 1 . . . . 26 GLU C . 15401 1 303 . 1 1 26 26 GLU CA C 13 60.378 0.30 . 1 . . . . 26 GLU CA . 15401 1 304 . 1 1 26 26 GLU CB C 13 28.883 0.30 . 1 . . . . 26 GLU CB . 15401 1 305 . 1 1 26 26 GLU CG C 13 37.411 0.30 . 1 . . . . 26 GLU CG . 15401 1 306 . 1 1 26 26 GLU N N 15 122.445 0.30 . 1 . . . . 26 GLU N . 15401 1 307 . 1 1 27 27 GLU H H 1 8.292 0.03 . 1 . . . . 27 GLU HN . 15401 1 308 . 1 1 27 27 GLU HA H 1 4.025 0.03 . 1 . . . . 27 GLU HA . 15401 1 309 . 1 1 27 27 GLU HB2 H 1 2.051 0.03 . 2 . . . . 27 GLU HB1 . 15401 1 310 . 1 1 27 27 GLU HB3 H 1 2.156 0.03 . 2 . . . . 27 GLU HB2 . 15401 1 311 . 1 1 27 27 GLU HG2 H 1 2.724 0.03 . 2 . . . . 27 GLU HG1 . 15401 1 312 . 1 1 27 27 GLU HG3 H 1 2.310 0.03 . 2 . . . . 27 GLU HG2 . 15401 1 313 . 1 1 27 27 GLU C C 13 180.729 0.30 . 1 . . . . 27 GLU C . 15401 1 314 . 1 1 27 27 GLU CA C 13 59.226 0.30 . 1 . . . . 27 GLU CA . 15401 1 315 . 1 1 27 27 GLU CB C 13 30.458 0.30 . 1 . . . . 27 GLU CB . 15401 1 316 . 1 1 27 27 GLU CG C 13 36.942 0.30 . 1 . . . . 27 GLU CG . 15401 1 317 . 1 1 27 27 GLU N N 15 119.259 0.30 . 1 . . . . 27 GLU N . 15401 1 318 . 1 1 28 28 ARG H H 1 8.491 0.03 . 1 . . . . 28 ARG HN . 15401 1 319 . 1 1 28 28 ARG HA H 1 3.835 0.03 . 1 . . . . 28 ARG HA . 15401 1 320 . 1 1 28 28 ARG HB2 H 1 2.078 0.03 . 2 . . . . 28 ARG HB2 . 15401 1 321 . 1 1 28 28 ARG C C 13 176.877 0.30 . 1 . . . . 28 ARG C . 15401 1 322 . 1 1 28 28 ARG CA C 13 60.641 0.30 . 1 . . . . 28 ARG CA . 15401 1 323 . 1 1 28 28 ARG CB C 13 30.855 0.30 . 1 . . . . 28 ARG CB . 15401 1 324 . 1 1 28 28 ARG CD C 13 43.758 0.30 . 1 . . . . 28 ARG CD . 15401 1 325 . 1 1 28 28 ARG CG C 13 28.247 0.30 . 1 . . . . 28 ARG CG . 15401 1 326 . 1 1 28 28 ARG N N 15 122.003 0.30 . 1 . . . . 28 ARG N . 15401 1 327 . 1 1 29 29 ALA H H 1 7.460 0.03 . 1 . . . . 29 ALA HN . 15401 1 328 . 1 1 29 29 ALA HA H 1 2.759 0.03 . 1 . . . . 29 ALA HA . 15401 1 329 . 1 1 29 29 ALA HB1 H 1 0.957 0.03 . 1 . . . . 29 ALA HB1 . 15401 1 330 . 1 1 29 29 ALA HB2 H 1 0.957 0.03 . 1 . . . . 29 ALA HB1 . 15401 1 331 . 1 1 29 29 ALA HB3 H 1 0.957 0.03 . 1 . . . . 29 ALA HB1 . 15401 1 332 . 1 1 29 29 ALA C C 13 179.873 0.30 . 1 . . . . 29 ALA C . 15401 1 333 . 1 1 29 29 ALA CA C 13 55.237 0.30 . 1 . . . . 29 ALA CA . 15401 1 334 . 1 1 29 29 ALA CB C 13 18.691 0.30 . 1 . . . . 29 ALA CB . 15401 1 335 . 1 1 29 29 ALA N N 15 121.847 0.30 . 1 . . . . 29 ALA N . 15401 1 336 . 1 1 30 30 MET H H 1 8.227 0.03 . 1 . . . . 30 MET HN . 15401 1 337 . 1 1 30 30 MET HA H 1 4.526 0.03 . 1 . . . . 30 MET HA . 15401 1 338 . 1 1 30 30 MET HB2 H 1 2.534 0.03 . 2 . . . . 30 MET HB1 . 15401 1 339 . 1 1 30 30 MET HB3 H 1 2.891 0.03 . 2 . . . . 30 MET HB2 . 15401 1 340 . 1 1 30 30 MET HE1 H 1 1.664 0.03 . 1 . . . . 30 MET HE1 . 15401 1 341 . 1 1 30 30 MET HE2 H 1 1.664 0.03 . 1 . . . . 30 MET HE1 . 15401 1 342 . 1 1 30 30 MET HE3 H 1 1.664 0.03 . 1 . . . . 30 MET HE1 . 15401 1 343 . 1 1 30 30 MET HG2 H 1 2.010 0.03 . 2 . . . . 30 MET HG1 . 15401 1 344 . 1 1 30 30 MET HG3 H 1 2.219 0.03 . 2 . . . . 30 MET HG2 . 15401 1 345 . 1 1 30 30 MET C C 13 178.543 0.30 . 1 . . . . 30 MET C . 15401 1 346 . 1 1 30 30 MET CA C 13 56.155 0.30 . 1 . . . . 30 MET CA . 15401 1 347 . 1 1 30 30 MET CB C 13 33.383 0.30 . 1 . . . . 30 MET CB . 15401 1 348 . 1 1 30 30 MET CE C 13 19.441 0.30 . 1 . . . . 30 MET CE . 15401 1 349 . 1 1 30 30 MET CG C 13 33.442 0.30 . 1 . . . . 30 MET CG . 15401 1 350 . 1 1 30 30 MET N N 15 114.806 0.30 . 1 . . . . 30 MET N . 15401 1 351 . 1 1 31 31 GLY H H 1 8.295 0.03 . 1 . . . . 31 GLY HN . 15401 1 352 . 1 1 31 31 GLY HA2 H 1 3.676 0.03 . 2 . . . . 31 GLY HA1 . 15401 1 353 . 1 1 31 31 GLY HA3 H 1 3.955 0.03 . 2 . . . . 31 GLY HA2 . 15401 1 354 . 1 1 31 31 GLY C C 13 177.116 0.30 . 1 . . . . 31 GLY C . 15401 1 355 . 1 1 31 31 GLY CA C 13 47.505 0.30 . 1 . . . . 31 GLY CA . 15401 1 356 . 1 1 31 31 GLY N N 15 110.613 0.30 . 1 . . . . 31 GLY N . 15401 1 357 . 1 1 32 32 TRP H H 1 7.159 0.03 . 1 . . . . 32 TRP HN . 15401 1 358 . 1 1 32 32 TRP HA H 1 3.991 0.03 . 1 . . . . 32 TRP HA . 15401 1 359 . 1 1 32 32 TRP HB2 H 1 3.052 0.03 . 2 . . . . 32 TRP HB1 . 15401 1 360 . 1 1 32 32 TRP HB3 H 1 3.172 0.03 . 2 . . . . 32 TRP HB2 . 15401 1 361 . 1 1 32 32 TRP HD1 H 1 6.769 0.03 . 1 . . . . 32 TRP HD1 . 15401 1 362 . 1 1 32 32 TRP HE1 H 1 5.704 0.03 . 1 . . . . 32 TRP HE1 . 15401 1 363 . 1 1 32 32 TRP HZ2 H 1 7.457 0.03 . 1 . . . . 32 TRP HZ2 . 15401 1 364 . 1 1 32 32 TRP C C 13 177.155 0.30 . 1 . . . . 32 TRP C . 15401 1 365 . 1 1 32 32 TRP CA C 13 61.676 0.30 . 1 . . . . 32 TRP CA . 15401 1 366 . 1 1 32 32 TRP CB C 13 28.907 0.30 . 1 . . . . 32 TRP CB . 15401 1 367 . 1 1 32 32 TRP CD1 C 13 125.465 0.30 . 1 . . . . 32 TRP CD1 . 15401 1 368 . 1 1 32 32 TRP CZ2 C 13 114.564 0.30 . 1 . . . . 32 TRP CZ2 . 15401 1 369 . 1 1 32 32 TRP N N 15 122.938 0.30 . 1 . . . . 32 TRP N . 15401 1 370 . 1 1 32 32 TRP NE1 N 15 119.222 0.30 . 1 . . . . 32 TRP NE1 . 15401 1 371 . 1 1 33 33 TYR H H 1 8.746 0.03 . 1 . . . . 33 TYR HN . 15401 1 372 . 1 1 33 33 TYR HA H 1 3.891 0.03 . 1 . . . . 33 TYR HA . 15401 1 373 . 1 1 33 33 TYR HB2 H 1 3.120 0.03 . 2 . . . . 33 TYR HB1 . 15401 1 374 . 1 1 33 33 TYR HB3 H 1 2.784 0.03 . 2 . . . . 33 TYR HB2 . 15401 1 375 . 1 1 33 33 TYR HD1 H 1 6.288 0.03 . 3 . . . . 33 TYR HD1 . 15401 1 376 . 1 1 33 33 TYR HE1 H 1 6.925 0.03 . 3 . . . . 33 TYR HE1 . 15401 1 377 . 1 1 33 33 TYR C C 13 177.361 0.30 . 1 . . . . 33 TYR C . 15401 1 378 . 1 1 33 33 TYR CA C 13 63.053 0.30 . 1 . . . . 33 TYR CA . 15401 1 379 . 1 1 33 33 TYR CB C 13 39.630 0.30 . 1 . . . . 33 TYR CB . 15401 1 380 . 1 1 33 33 TYR CD1 C 13 133.168 0.30 . 3 . . . . 33 TYR CD1 . 15401 1 381 . 1 1 33 33 TYR CE1 C 13 117.762 0.30 . 3 . . . . 33 TYR CE1 . 15401 1 382 . 1 1 33 33 TYR N N 15 121.069 0.30 . 1 . . . . 33 TYR N . 15401 1 383 . 1 1 34 34 TYR H H 1 8.869 0.03 . 1 . . . . 34 TYR HN . 15401 1 384 . 1 1 34 34 TYR HA H 1 4.296 0.03 . 1 . . . . 34 TYR HA . 15401 1 385 . 1 1 34 34 TYR HB2 H 1 3.023 0.03 . 2 . . . . 34 TYR HB1 . 15401 1 386 . 1 1 34 34 TYR HB3 H 1 3.285 0.03 . 2 . . . . 34 TYR HB2 . 15401 1 387 . 1 1 34 34 TYR HD1 H 1 7.543 0.03 . 3 . . . . 34 TYR HD1 . 15401 1 388 . 1 1 34 34 TYR HE1 H 1 6.943 0.03 . 3 . . . . 34 TYR HE1 . 15401 1 389 . 1 1 34 34 TYR C C 13 178.856 0.30 . 1 . . . . 34 TYR C . 15401 1 390 . 1 1 34 34 TYR CA C 13 62.123 0.30 . 1 . . . . 34 TYR CA . 15401 1 391 . 1 1 34 34 TYR CB C 13 37.426 0.30 . 1 . . . . 34 TYR CB . 15401 1 392 . 1 1 34 34 TYR CD1 C 13 133.700 0.30 . 3 . . . . 34 TYR CD1 . 15401 1 393 . 1 1 34 34 TYR CE1 C 13 118.599 0.30 . 3 . . . . 34 TYR CE1 . 15401 1 394 . 1 1 34 34 TYR N N 15 115.757 0.30 . 1 . . . . 34 TYR N . 15401 1 395 . 1 1 35 35 TYR H H 1 7.876 0.03 . 1 . . . . 35 TYR HN . 15401 1 396 . 1 1 35 35 TYR HA H 1 4.403 0.03 . 1 . . . . 35 TYR HA . 15401 1 397 . 1 1 35 35 TYR HB2 H 1 3.025 0.03 . 2 . . . . 35 TYR HB1 . 15401 1 398 . 1 1 35 35 TYR HB3 H 1 3.173 0.03 . 2 . . . . 35 TYR HB2 . 15401 1 399 . 1 1 35 35 TYR HD1 H 1 6.957 0.03 . 3 . . . . 35 TYR HD1 . 15401 1 400 . 1 1 35 35 TYR HE1 H 1 7.601 0.03 . 3 . . . . 35 TYR HE1 . 15401 1 401 . 1 1 35 35 TYR C C 13 178.838 0.30 . 1 . . . . 35 TYR C . 15401 1 402 . 1 1 35 35 TYR CA C 13 61.550 0.30 . 1 . . . . 35 TYR CA . 15401 1 403 . 1 1 35 35 TYR CB C 13 39.449 0.30 . 1 . . . . 35 TYR CB . 15401 1 404 . 1 1 35 35 TYR CD1 C 13 133.250 0.30 . 3 . . . . 35 TYR CD1 . 15401 1 405 . 1 1 35 35 TYR CE1 C 13 114.309 0.30 . 3 . . . . 35 TYR CE1 . 15401 1 406 . 1 1 35 35 TYR N N 15 122.185 0.30 . 1 . . . . 35 TYR N . 15401 1 407 . 1 1 36 36 LEU H H 1 8.838 0.03 . 1 . . . . 36 LEU HN . 15401 1 408 . 1 1 36 36 LEU HA H 1 3.731 0.03 . 1 . . . . 36 LEU HA . 15401 1 409 . 1 1 36 36 LEU HB2 H 1 1.974 0.03 . 2 . . . . 36 LEU HB1 . 15401 1 410 . 1 1 36 36 LEU HB3 H 1 1.333 0.03 . 2 . . . . 36 LEU HB2 . 15401 1 411 . 1 1 36 36 LEU HD11 H 1 0.594 0.03 . 2 . . . . 36 LEU HD11 . 15401 1 412 . 1 1 36 36 LEU HD12 H 1 0.594 0.03 . 2 . . . . 36 LEU HD11 . 15401 1 413 . 1 1 36 36 LEU HD13 H 1 0.594 0.03 . 2 . . . . 36 LEU HD11 . 15401 1 414 . 1 1 36 36 LEU HD21 H 1 0.925 0.03 . 2 . . . . 36 LEU HD21 . 15401 1 415 . 1 1 36 36 LEU HD22 H 1 0.925 0.03 . 2 . . . . 36 LEU HD21 . 15401 1 416 . 1 1 36 36 LEU HD23 H 1 0.925 0.03 . 2 . . . . 36 LEU HD21 . 15401 1 417 . 1 1 36 36 LEU HG H 1 2.324 0.03 . 1 . . . . 36 LEU HG . 15401 1 418 . 1 1 36 36 LEU C C 13 178.400 0.30 . 1 . . . . 36 LEU C . 15401 1 419 . 1 1 36 36 LEU CA C 13 58.452 0.30 . 1 . . . . 36 LEU CA . 15401 1 420 . 1 1 36 36 LEU CB C 13 40.790 0.30 . 1 . . . . 36 LEU CB . 15401 1 421 . 1 1 36 36 LEU CD1 C 13 25.604 0.30 . 1 . . . . 36 LEU CD1 . 15401 1 422 . 1 1 36 36 LEU CD2 C 13 22.460 0.30 . 1 . . . . 36 LEU CD2 . 15401 1 423 . 1 1 36 36 LEU CG C 13 27.295 0.30 . 1 . . . . 36 LEU CG . 15401 1 424 . 1 1 36 36 LEU N N 15 123.319 0.30 . 1 . . . . 36 LEU N . 15401 1 425 . 1 1 37 37 ASP H H 1 8.714 0.03 . 1 . . . . 37 ASP HN . 15401 1 426 . 1 1 37 37 ASP HA H 1 4.392 0.03 . 1 . . . . 37 ASP HA . 15401 1 427 . 1 1 37 37 ASP HB2 H 1 2.322 0.03 . 2 . . . . 37 ASP HB1 . 15401 1 428 . 1 1 37 37 ASP HB3 H 1 2.571 0.03 . 2 . . . . 37 ASP HB2 . 15401 1 429 . 1 1 37 37 ASP C C 13 177.657 0.30 . 1 . . . . 37 ASP C . 15401 1 430 . 1 1 37 37 ASP CA C 13 57.785 0.30 . 1 . . . . 37 ASP CA . 15401 1 431 . 1 1 37 37 ASP CB C 13 42.562 0.30 . 1 . . . . 37 ASP CB . 15401 1 432 . 1 1 37 37 ASP N N 15 118.361 0.30 . 1 . . . . 37 ASP N . 15401 1 433 . 1 1 38 38 ASP H H 1 7.742 0.03 . 1 . . . . 38 ASP HN . 15401 1 434 . 1 1 38 38 ASP HA H 1 4.559 0.03 . 1 . . . . 38 ASP HA . 15401 1 435 . 1 1 38 38 ASP HB2 H 1 2.549 0.03 . 2 . . . . 38 ASP HB1 . 15401 1 436 . 1 1 38 38 ASP HB3 H 1 2.842 0.03 . 2 . . . . 38 ASP HB2 . 15401 1 437 . 1 1 38 38 ASP C C 13 177.921 0.30 . 1 . . . . 38 ASP C . 15401 1 438 . 1 1 38 38 ASP CA C 13 55.949 0.30 . 1 . . . . 38 ASP CA . 15401 1 439 . 1 1 38 38 ASP CB C 13 42.564 0.30 . 1 . . . . 38 ASP CB . 15401 1 440 . 1 1 38 38 ASP N N 15 113.426 0.30 . 1 . . . . 38 ASP N . 15401 1 441 . 1 1 39 39 THR H H 1 7.681 0.03 . 1 . . . . 39 THR HN . 15401 1 442 . 1 1 39 39 THR HA H 1 3.854 0.03 . 1 . . . . 39 THR HA . 15401 1 443 . 1 1 39 39 THR HB H 1 3.253 0.03 . 1 . . . . 39 THR HB . 15401 1 444 . 1 1 39 39 THR HG21 H 1 0.918 0.03 . 1 . . . . 39 THR HG21 . 15401 1 445 . 1 1 39 39 THR HG22 H 1 0.918 0.03 . 1 . . . . 39 THR HG21 . 15401 1 446 . 1 1 39 39 THR HG23 H 1 0.918 0.03 . 1 . . . . 39 THR HG21 . 15401 1 447 . 1 1 39 39 THR C C 13 174.811 0.30 . 1 . . . . 39 THR C . 15401 1 448 . 1 1 39 39 THR CA C 13 65.324 0.30 . 1 . . . . 39 THR CA . 15401 1 449 . 1 1 39 39 THR CB C 13 69.373 0.30 . 1 . . . . 39 THR CB . 15401 1 450 . 1 1 39 39 THR CG2 C 13 22.607 0.30 . 1 . . . . 39 THR CG2 . 15401 1 451 . 1 1 39 39 THR N N 15 115.365 0.30 . 1 . . . . 39 THR N . 15401 1 452 . 1 1 40 40 LEU H H 1 8.085 0.03 . 1 . . . . 40 LEU HN . 15401 1 453 . 1 1 40 40 LEU HA H 1 3.694 0.03 . 1 . . . . 40 LEU HA . 15401 1 454 . 1 1 40 40 LEU HB2 H 1 0.210 0.03 . 2 . . . . 40 LEU HB1 . 15401 1 455 . 1 1 40 40 LEU HB3 H 1 1.410 0.03 . 2 . . . . 40 LEU HB2 . 15401 1 456 . 1 1 40 40 LEU HD11 H 1 1.832 0.03 . 2 . . . . 40 LEU HD11 . 15401 1 457 . 1 1 40 40 LEU HD12 H 1 1.832 0.03 . 2 . . . . 40 LEU HD11 . 15401 1 458 . 1 1 40 40 LEU HD13 H 1 1.832 0.03 . 2 . . . . 40 LEU HD11 . 15401 1 459 . 1 1 40 40 LEU HD21 H 1 0.802 0.03 . 2 . . . . 40 LEU HD21 . 15401 1 460 . 1 1 40 40 LEU HD22 H 1 0.802 0.03 . 2 . . . . 40 LEU HD21 . 15401 1 461 . 1 1 40 40 LEU HD23 H 1 0.802 0.03 . 2 . . . . 40 LEU HD21 . 15401 1 462 . 1 1 40 40 LEU HG H 1 0.848 0.03 . 1 . . . . 40 LEU HG . 15401 1 463 . 1 1 40 40 LEU C C 13 176.218 0.30 . 1 . . . . 40 LEU C . 15401 1 464 . 1 1 40 40 LEU CA C 13 55.842 0.30 . 1 . . . . 40 LEU CA . 15401 1 465 . 1 1 40 40 LEU CB C 13 40.057 0.30 . 1 . . . . 40 LEU CB . 15401 1 466 . 1 1 40 40 LEU CD1 C 13 27.518 0.30 . 1 . . . . 40 LEU CD1 . 15401 1 467 . 1 1 40 40 LEU CD2 C 13 25.941 0.30 . 1 . . . . 40 LEU CD2 . 15401 1 468 . 1 1 40 40 LEU CG C 13 26.151 0.30 . 1 . . . . 40 LEU CG . 15401 1 469 . 1 1 40 40 LEU N N 15 121.147 0.30 . 1 . . . . 40 LEU N . 15401 1 470 . 1 1 41 41 GLU H H 1 7.588 0.03 . 1 . . . . 41 GLU HN . 15401 1 471 . 1 1 41 41 GLU HA H 1 4.347 0.03 . 1 . . . . 41 GLU HA . 15401 1 472 . 1 1 41 41 GLU HB2 H 1 1.777 0.03 . 2 . . . . 41 GLU HB1 . 15401 1 473 . 1 1 41 41 GLU HB3 H 1 1.945 0.03 . 2 . . . . 41 GLU HB2 . 15401 1 474 . 1 1 41 41 GLU HG2 H 1 2.177 0.03 . 2 . . . . 41 GLU HG2 . 15401 1 475 . 1 1 41 41 GLU C C 13 174.980 0.30 . 1 . . . . 41 GLU C . 15401 1 476 . 1 1 41 41 GLU CA C 13 54.700 0.30 . 1 . . . . 41 GLU CA . 15401 1 477 . 1 1 41 41 GLU CB C 13 28.595 0.30 . 1 . . . . 41 GLU CB . 15401 1 478 . 1 1 41 41 GLU CG C 13 35.952 0.30 . 1 . . . . 41 GLU CG . 15401 1 479 . 1 1 41 41 GLU N N 15 124.765 0.30 . 1 . . . . 41 GLU N . 15401 1 480 . 1 1 42 42 PHE H H 1 7.795 0.03 . 1 . . . . 42 PHE HN . 15401 1 481 . 1 1 42 42 PHE HA H 1 4.653 0.03 . 1 . . . . 42 PHE HA . 15401 1 482 . 1 1 42 42 PHE HB2 H 1 2.992 0.03 . 2 . . . . 42 PHE HB1 . 15401 1 483 . 1 1 42 42 PHE HB3 H 1 2.661 0.03 . 2 . . . . 42 PHE HB2 . 15401 1 484 . 1 1 42 42 PHE HD1 H 1 7.137 0.03 . 3 . . . . 42 PHE HD1 . 15401 1 485 . 1 1 42 42 PHE HE1 H 1 7.226 0.03 . 3 . . . . 42 PHE HE1 . 15401 1 486 . 1 1 42 42 PHE CA C 13 56.624 0.30 . 1 . . . . 42 PHE CA . 15401 1 487 . 1 1 42 42 PHE CB C 13 39.663 0.30 . 1 . . . . 42 PHE CB . 15401 1 488 . 1 1 42 42 PHE CD1 C 13 134.638 0.30 . 3 . . . . 42 PHE CD1 . 15401 1 489 . 1 1 42 42 PHE N N 15 123.306 0.30 . 1 . . . . 42 PHE N . 15401 1 490 . 1 1 43 43 PRO HA H 1 5.502 0.03 . 1 . . . . 43 PRO HA . 15401 1 491 . 1 1 43 43 PRO HB2 H 1 2.180 0.03 . 2 . . . . 43 PRO HB1 . 15401 1 492 . 1 1 43 43 PRO HB3 H 1 2.331 0.03 . 2 . . . . 43 PRO HB2 . 15401 1 493 . 1 1 43 43 PRO HD2 H 1 3.561 0.03 . 2 . . . . 43 PRO HD1 . 15401 1 494 . 1 1 43 43 PRO HD3 H 1 3.779 0.03 . 2 . . . . 43 PRO HD2 . 15401 1 495 . 1 1 43 43 PRO HG2 H 1 2.018 0.03 . 2 . . . . 43 PRO HG1 . 15401 1 496 . 1 1 43 43 PRO HG3 H 1 1.975 0.03 . 2 . . . . 43 PRO HG2 . 15401 1 497 . 1 1 43 43 PRO C C 13 175.627 0.30 . 1 . . . . 43 PRO C . 15401 1 498 . 1 1 43 43 PRO CA C 13 62.505 0.30 . 1 . . . . 43 PRO CA . 15401 1 499 . 1 1 43 43 PRO CB C 13 36.035 0.30 . 1 . . . . 43 PRO CB . 15401 1 500 . 1 1 43 43 PRO CD C 13 50.511 0.30 . 1 . . . . 43 PRO CD . 15401 1 501 . 1 1 43 43 PRO CG C 13 24.582 0.30 . 1 . . . . 43 PRO CG . 15401 1 502 . 1 1 44 44 PHE H H 1 8.001 0.03 . 1 . . . . 44 PHE HN . 15401 1 503 . 1 1 44 44 PHE HA H 1 5.156 0.03 . 1 . . . . 44 PHE HA . 15401 1 504 . 1 1 44 44 PHE HB2 H 1 3.270 0.03 . 2 . . . . 44 PHE HB1 . 15401 1 505 . 1 1 44 44 PHE HB3 H 1 3.319 0.03 . 2 . . . . 44 PHE HB2 . 15401 1 506 . 1 1 44 44 PHE HD1 H 1 7.185 0.03 . 3 . . . . 44 PHE HD1 . 15401 1 507 . 1 1 44 44 PHE HE1 H 1 7.117 0.03 . 3 . . . . 44 PHE HE1 . 15401 1 508 . 1 1 44 44 PHE C C 13 173.238 0.30 . 1 . . . . 44 PHE C . 15401 1 509 . 1 1 44 44 PHE CA C 13 55.739 0.30 . 1 . . . . 44 PHE CA . 15401 1 510 . 1 1 44 44 PHE CB C 13 41.600 0.30 . 1 . . . . 44 PHE CB . 15401 1 511 . 1 1 44 44 PHE CD1 C 13 133.934 0.30 . 3 . . . . 44 PHE CD1 . 15401 1 512 . 1 1 44 44 PHE N N 15 114.137 0.30 . 1 . . . . 44 PHE N . 15401 1 513 . 1 1 45 45 MET H H 1 9.438 0.03 . 1 . . . . 45 MET HN . 15401 1 514 . 1 1 45 45 MET HA H 1 5.299 0.03 . 1 . . . . 45 MET HA . 15401 1 515 . 1 1 45 45 MET HB2 H 1 2.224 0.03 . 2 . . . . 45 MET HB1 . 15401 1 516 . 1 1 45 45 MET HB3 H 1 2.019 0.03 . 2 . . . . 45 MET HB2 . 15401 1 517 . 1 1 45 45 MET HE1 H 1 2.060 0.03 . 1 . . . . 45 MET HE1 . 15401 1 518 . 1 1 45 45 MET HE2 H 1 2.060 0.03 . 1 . . . . 45 MET HE1 . 15401 1 519 . 1 1 45 45 MET HE3 H 1 2.060 0.03 . 1 . . . . 45 MET HE1 . 15401 1 520 . 1 1 45 45 MET HG2 H 1 2.647 0.03 . 2 . . . . 45 MET HG1 . 15401 1 521 . 1 1 45 45 MET HG3 H 1 2.790 0.03 . 2 . . . . 45 MET HG2 . 15401 1 522 . 1 1 45 45 MET C C 13 175.990 0.30 . 1 . . . . 45 MET C . 15401 1 523 . 1 1 45 45 MET CA C 13 54.362 0.30 . 1 . . . . 45 MET CA . 15401 1 524 . 1 1 45 45 MET CB C 13 33.277 0.30 . 1 . . . . 45 MET CB . 15401 1 525 . 1 1 45 45 MET CE C 13 16.691 0.30 . 1 . . . . 45 MET CE . 15401 1 526 . 1 1 45 45 MET CG C 13 32.713 0.30 . 1 . . . . 45 MET CG . 15401 1 527 . 1 1 45 45 MET N N 15 121.063 0.30 . 1 . . . . 45 MET N . 15401 1 528 . 1 1 46 46 GLY H H 1 9.208 0.03 . 1 . . . . 46 GLY HN . 15401 1 529 . 1 1 46 46 GLY HA2 H 1 5.133 0.03 . 2 . . . . 46 GLY HA1 . 15401 1 530 . 1 1 46 46 GLY HA3 H 1 3.383 0.03 . 2 . . . . 46 GLY HA2 . 15401 1 531 . 1 1 46 46 GLY C C 13 171.493 0.30 . 1 . . . . 46 GLY C . 15401 1 532 . 1 1 46 46 GLY CA C 13 45.283 0.30 . 1 . . . . 46 GLY CA . 15401 1 533 . 1 1 46 46 GLY N N 15 108.155 0.30 . 1 . . . . 46 GLY N . 15401 1 534 . 1 1 47 47 LYS H H 1 9.096 0.03 . 1 . . . . 47 LYS HN . 15401 1 535 . 1 1 47 47 LYS HA H 1 5.137 0.03 . 1 . . . . 47 LYS HA . 15401 1 536 . 1 1 47 47 LYS HB2 H 1 1.706 0.03 . 2 . . . . 47 LYS HB1 . 15401 1 537 . 1 1 47 47 LYS HB3 H 1 1.830 0.03 . 2 . . . . 47 LYS HB2 . 15401 1 538 . 1 1 47 47 LYS HD2 H 1 1.591 0.03 . 2 . . . . 47 LYS HD1 . 15401 1 539 . 1 1 47 47 LYS HD3 H 1 1.684 0.03 . 2 . . . . 47 LYS HD2 . 15401 1 540 . 1 1 47 47 LYS HE2 H 1 2.884 0.03 . 2 . . . . 47 LYS HE2 . 15401 1 541 . 1 1 47 47 LYS HG2 H 1 1.379 0.03 . 2 . . . . 47 LYS HG1 . 15401 1 542 . 1 1 47 47 LYS HG3 H 1 1.450 0.03 . 2 . . . . 47 LYS HG2 . 15401 1 543 . 1 1 47 47 LYS C C 13 175.252 0.30 . 1 . . . . 47 LYS C . 15401 1 544 . 1 1 47 47 LYS CA C 13 54.587 0.30 . 1 . . . . 47 LYS CA . 15401 1 545 . 1 1 47 47 LYS CB C 13 34.463 0.30 . 1 . . . . 47 LYS CB . 15401 1 546 . 1 1 47 47 LYS CD C 13 29.158 0.30 . 1 . . . . 47 LYS CD . 15401 1 547 . 1 1 47 47 LYS CE C 13 42.000 0.30 . 1 . . . . 47 LYS CE . 15401 1 548 . 1 1 47 47 LYS CG C 13 24.691 0.30 . 1 . . . . 47 LYS CG . 15401 1 549 . 1 1 47 47 LYS N N 15 120.280 0.30 . 1 . . . . 47 LYS N . 15401 1 550 . 1 1 48 48 TRP H H 1 9.618 0.03 . 1 . . . . 48 TRP HN . 15401 1 551 . 1 1 48 48 TRP HA H 1 5.455 0.03 . 1 . . . . 48 TRP HA . 15401 1 552 . 1 1 48 48 TRP HB2 H 1 2.680 0.03 . 2 . . . . 48 TRP HB1 . 15401 1 553 . 1 1 48 48 TRP HB3 H 1 3.399 0.03 . 2 . . . . 48 TRP HB2 . 15401 1 554 . 1 1 48 48 TRP HD1 H 1 7.120 0.03 . 1 . . . . 48 TRP HD1 . 15401 1 555 . 1 1 48 48 TRP HE1 H 1 10.922 0.03 . 1 . . . . 48 TRP HE1 . 15401 1 556 . 1 1 48 48 TRP HE3 H 1 7.055 0.03 . 1 . . . . 48 TRP HE3 . 15401 1 557 . 1 1 48 48 TRP HH2 H 1 6.989 0.03 . 1 . . . . 48 TRP HH2 . 15401 1 558 . 1 1 48 48 TRP HZ2 H 1 7.591 0.03 . 1 . . . . 48 TRP HZ2 . 15401 1 559 . 1 1 48 48 TRP HZ3 H 1 7.233 0.03 . 1 . . . . 48 TRP HZ3 . 15401 1 560 . 1 1 48 48 TRP C C 13 175.209 0.30 . 1 . . . . 48 TRP C . 15401 1 561 . 1 1 48 48 TRP CA C 13 54.190 0.30 . 1 . . . . 48 TRP CA . 15401 1 562 . 1 1 48 48 TRP CB C 13 31.419 0.30 . 1 . . . . 48 TRP CB . 15401 1 563 . 1 1 48 48 TRP CD1 C 13 124.934 0.30 . 1 . . . . 48 TRP CD1 . 15401 1 564 . 1 1 48 48 TRP CH2 C 13 124.740 0.30 . 1 . . . . 48 TRP CH2 . 15401 1 565 . 1 1 48 48 TRP CZ2 C 13 114.590 0.30 . 1 . . . . 48 TRP CZ2 . 15401 1 566 . 1 1 48 48 TRP N N 15 128.076 0.30 . 1 . . . . 48 TRP N . 15401 1 567 . 1 1 48 48 TRP NE1 N 15 130.489 0.30 . 1 . . . . 48 TRP NE1 . 15401 1 568 . 1 1 49 49 LYS H H 1 8.747 0.03 . 1 . . . . 49 LYS HN . 15401 1 569 . 1 1 49 49 LYS HA H 1 4.471 0.03 . 1 . . . . 49 LYS HA . 15401 1 570 . 1 1 49 49 LYS HB2 H 1 1.578 0.03 . 2 . . . . 49 LYS HB1 . 15401 1 571 . 1 1 49 49 LYS HB3 H 1 1.792 0.03 . 2 . . . . 49 LYS HB2 . 15401 1 572 . 1 1 49 49 LYS HD2 H 1 1.654 0.03 . 2 . . . . 49 LYS HD2 . 15401 1 573 . 1 1 49 49 LYS HE2 H 1 2.928 0.03 . 2 . . . . 49 LYS HE2 . 15401 1 574 . 1 1 49 49 LYS HG2 H 1 1.284 0.03 . 2 . . . . 49 LYS HG1 . 15401 1 575 . 1 1 49 49 LYS HG3 H 1 1.436 0.03 . 2 . . . . 49 LYS HG2 . 15401 1 576 . 1 1 49 49 LYS C C 13 174.052 0.30 . 1 . . . . 49 LYS C . 15401 1 577 . 1 1 49 49 LYS CA C 13 55.552 0.30 . 1 . . . . 49 LYS CA . 15401 1 578 . 1 1 49 49 LYS CB C 13 32.437 0.30 . 1 . . . . 49 LYS CB . 15401 1 579 . 1 1 49 49 LYS CD C 13 29.345 0.30 . 1 . . . . 49 LYS CD . 15401 1 580 . 1 1 49 49 LYS CE C 13 42.000 0.30 . 1 . . . . 49 LYS CE . 15401 1 581 . 1 1 49 49 LYS CG C 13 25.167 0.30 . 1 . . . . 49 LYS CG . 15401 1 582 . 1 1 49 49 LYS N N 15 129.858 0.30 . 1 . . . . 49 LYS N . 15401 1 583 . 1 1 50 50 LYS H H 1 7.902 0.03 . 1 . . . . 50 LYS HN . 15401 1 584 . 1 1 50 50 LYS HA H 1 3.997 0.03 . 1 . . . . 50 LYS HA . 15401 1 585 . 1 1 50 50 LYS HB2 H 1 0.633 0.03 . 2 . . . . 50 LYS HB1 . 15401 1 586 . 1 1 50 50 LYS HB3 H 1 1.281 0.03 . 2 . . . . 50 LYS HB2 . 15401 1 587 . 1 1 50 50 LYS HD2 H 1 0.900 0.03 . 2 . . . . 50 LYS HD1 . 15401 1 588 . 1 1 50 50 LYS HD3 H 1 1.058 0.03 . 2 . . . . 50 LYS HD2 . 15401 1 589 . 1 1 50 50 LYS HE2 H 1 2.556 0.03 . 2 . . . . 50 LYS HE2 . 15401 1 590 . 1 1 50 50 LYS HG2 H 1 0.759 0.03 . 2 . . . . 50 LYS HG2 . 15401 1 591 . 1 1 50 50 LYS C C 13 175.606 0.30 . 1 . . . . 50 LYS C . 15401 1 592 . 1 1 50 50 LYS CA C 13 55.492 0.30 . 1 . . . . 50 LYS CA . 15401 1 593 . 1 1 50 50 LYS CB C 13 33.659 0.30 . 1 . . . . 50 LYS CB . 15401 1 594 . 1 1 50 50 LYS CD C 13 29.200 0.30 . 1 . . . . 50 LYS CD . 15401 1 595 . 1 1 50 50 LYS CE C 13 41.977 0.30 . 1 . . . . 50 LYS CE . 15401 1 596 . 1 1 50 50 LYS CG C 13 24.133 0.30 . 1 . . . . 50 LYS CG . 15401 1 597 . 1 1 50 50 LYS N N 15 124.789 0.30 . 1 . . . . 50 LYS N . 15401 1 598 . 1 1 51 51 LYS H H 1 8.558 0.03 . 1 . . . . 51 LYS HN . 15401 1 599 . 1 1 51 51 LYS HA H 1 4.364 0.03 . 1 . . . . 51 LYS HA . 15401 1 600 . 1 1 51 51 LYS HB2 H 1 1.650 0.03 . 2 . . . . 51 LYS HB1 . 15401 1 601 . 1 1 51 51 LYS HB3 H 1 1.742 0.03 . 2 . . . . 51 LYS HB2 . 15401 1 602 . 1 1 51 51 LYS HD2 H 1 1.644 0.03 . 2 . . . . 51 LYS HD2 . 15401 1 603 . 1 1 51 51 LYS HG2 H 1 1.302 0.03 . 2 . . . . 51 LYS HG2 . 15401 1 604 . 1 1 51 51 LYS C C 13 176.441 0.30 . 1 . . . . 51 LYS C . 15401 1 605 . 1 1 51 51 LYS CA C 13 56.265 0.30 . 1 . . . . 51 LYS CA . 15401 1 606 . 1 1 51 51 LYS CB C 13 33.276 0.30 . 1 . . . . 51 LYS CB . 15401 1 607 . 1 1 51 51 LYS CD C 13 29.362 0.30 . 1 . . . . 51 LYS CD . 15401 1 608 . 1 1 51 51 LYS CE C 13 42.187 0.30 . 1 . . . . 51 LYS CE . 15401 1 609 . 1 1 51 51 LYS CG C 13 25.004 0.30 . 1 . . . . 51 LYS CG . 15401 1 610 . 1 1 51 51 LYS N N 15 127.402 0.30 . 1 . . . . 51 LYS N . 15401 1 611 . 1 1 52 52 SER H H 1 8.466 0.03 . 1 . . . . 52 SER HN . 15401 1 612 . 1 1 52 52 SER HA H 1 4.520 0.03 . 1 . . . . 52 SER HA . 15401 1 613 . 1 1 52 52 SER HB2 H 1 3.869 0.03 . 2 . . . . 52 SER HB2 . 15401 1 614 . 1 1 52 52 SER CA C 13 57.571 0.30 . 1 . . . . 52 SER CA . 15401 1 615 . 1 1 52 52 SER CB C 13 64.103 0.30 . 1 . . . . 52 SER CB . 15401 1 616 . 1 1 52 52 SER N N 15 120.046 0.30 . 1 . . . . 52 SER N . 15401 1 617 . 1 1 53 53 ARG HA H 1 4.237 0.03 . 1 . . . . 53 ARG HA . 15401 1 618 . 1 1 53 53 ARG HB2 H 1 1.828 0.03 . 2 . . . . 53 ARG HB1 . 15401 1 619 . 1 1 53 53 ARG HB3 H 1 1.901 0.03 . 2 . . . . 53 ARG HB2 . 15401 1 620 . 1 1 53 53 ARG HD2 H 1 3.197 0.03 . 2 . . . . 53 ARG HD2 . 15401 1 621 . 1 1 53 53 ARG HG2 H 1 1.665 0.03 . 2 . . . . 53 ARG HG2 . 15401 1 622 . 1 1 53 53 ARG CA C 13 57.709 0.30 . 1 . . . . 53 ARG CA . 15401 1 623 . 1 1 53 53 ARG CB C 13 30.525 0.30 . 1 . . . . 53 ARG CB . 15401 1 624 . 1 1 53 53 ARG CD C 13 43.387 0.30 . 1 . . . . 53 ARG CD . 15401 1 625 . 1 1 53 53 ARG CG C 13 27.616 0.30 . 1 . . . . 53 ARG CG . 15401 1 626 . 1 1 54 54 LYS HA H 1 4.253 0.03 . 1 . . . . 54 LYS HA . 15401 1 627 . 1 1 54 54 LYS HB2 H 1 1.791 0.03 . 2 . . . . 54 LYS HB1 . 15401 1 628 . 1 1 54 54 LYS HB3 H 1 1.869 0.03 . 2 . . . . 54 LYS HB2 . 15401 1 629 . 1 1 54 54 LYS HD2 H 1 1.672 0.03 . 2 . . . . 54 LYS HD2 . 15401 1 630 . 1 1 54 54 LYS HE2 H 1 3.020 0.03 . 2 . . . . 54 LYS HE2 . 15401 1 631 . 1 1 54 54 LYS HG2 H 1 1.446 0.03 . 2 . . . . 54 LYS HG1 . 15401 1 632 . 1 1 54 54 LYS HG3 H 1 1.383 0.03 . 2 . . . . 54 LYS HG2 . 15401 1 633 . 1 1 54 54 LYS CA C 13 57.759 0.30 . 1 . . . . 54 LYS CA . 15401 1 634 . 1 1 54 54 LYS CB C 13 33.192 0.30 . 1 . . . . 54 LYS CB . 15401 1 635 . 1 1 54 54 LYS CD C 13 29.085 0.30 . 1 . . . . 54 LYS CD . 15401 1 636 . 1 1 54 54 LYS CE C 13 42.211 0.30 . 1 . . . . 54 LYS CE . 15401 1 637 . 1 1 54 54 LYS CG C 13 25.028 0.30 . 1 . . . . 54 LYS CG . 15401 1 638 . 1 1 55 55 THR HA H 1 4.495 0.03 . 1 . . . . 55 THR HA . 15401 1 639 . 1 1 55 55 THR HB H 1 4.391 0.03 . 1 . . . . 55 THR HB . 15401 1 640 . 1 1 55 55 THR HG21 H 1 1.154 0.03 . 1 . . . . 55 THR HG21 . 15401 1 641 . 1 1 55 55 THR HG22 H 1 1.154 0.03 . 1 . . . . 55 THR HG21 . 15401 1 642 . 1 1 55 55 THR HG23 H 1 1.154 0.03 . 1 . . . . 55 THR HG21 . 15401 1 643 . 1 1 55 55 THR CA C 13 60.942 0.30 . 1 . . . . 55 THR CA . 15401 1 644 . 1 1 55 55 THR CB C 13 70.190 0.30 . 1 . . . . 55 THR CB . 15401 1 645 . 1 1 55 55 THR CG2 C 13 21.692 0.30 . 1 . . . . 55 THR CG2 . 15401 1 646 . 1 1 56 56 SER HA H 1 4.327 0.03 . 1 . . . . 56 SER HA . 15401 1 647 . 1 1 56 56 SER HB2 H 1 4.012 0.03 . 2 . . . . 56 SER HB1 . 15401 1 648 . 1 1 56 56 SER HB3 H 1 3.981 0.03 . 2 . . . . 56 SER HB2 . 15401 1 649 . 1 1 56 56 SER C C 13 174.131 0.30 . 1 . . . . 56 SER C . 15401 1 650 . 1 1 56 56 SER CA C 13 59.128 0.30 . 1 . . . . 56 SER CA . 15401 1 651 . 1 1 56 56 SER CB C 13 63.031 0.30 . 1 . . . . 56 SER CB . 15401 1 652 . 1 1 57 57 THR H H 1 7.770 0.03 . 1 . . . . 57 THR HN . 15401 1 653 . 1 1 57 57 THR HA H 1 4.351 0.03 . 1 . . . . 57 THR HA . 15401 1 654 . 1 1 57 57 THR HB H 1 4.091 0.03 . 1 . . . . 57 THR HB . 15401 1 655 . 1 1 57 57 THR HG21 H 1 1.144 0.03 . 1 . . . . 57 THR HG21 . 15401 1 656 . 1 1 57 57 THR HG22 H 1 1.144 0.03 . 1 . . . . 57 THR HG21 . 15401 1 657 . 1 1 57 57 THR HG23 H 1 1.144 0.03 . 1 . . . . 57 THR HG21 . 15401 1 658 . 1 1 57 57 THR C C 13 173.782 0.30 . 1 . . . . 57 THR C . 15401 1 659 . 1 1 57 57 THR CA C 13 61.650 0.30 . 1 . . . . 57 THR CA . 15401 1 660 . 1 1 57 57 THR CB C 13 70.435 0.30 . 1 . . . . 57 THR CB . 15401 1 661 . 1 1 57 57 THR CG2 C 13 21.762 0.30 . 1 . . . . 57 THR CG2 . 15401 1 662 . 1 1 57 57 THR N N 15 115.196 0.30 . 1 . . . . 57 THR N . 15401 1 663 . 1 1 58 58 ILE H H 1 8.385 0.03 . 1 . . . . 58 ILE HN . 15401 1 664 . 1 1 58 58 ILE HA H 1 4.248 0.03 . 1 . . . . 58 ILE HA . 15401 1 665 . 1 1 58 58 ILE HB H 1 1.726 0.03 . 1 . . . . 58 ILE HB . 15401 1 666 . 1 1 58 58 ILE HD11 H 1 0.769 0.03 . 1 . . . . 58 ILE HD11 . 15401 1 667 . 1 1 58 58 ILE HD12 H 1 0.769 0.03 . 1 . . . . 58 ILE HD11 . 15401 1 668 . 1 1 58 58 ILE HD13 H 1 0.769 0.03 . 1 . . . . 58 ILE HD11 . 15401 1 669 . 1 1 58 58 ILE HG12 H 1 1.023 0.03 . 1 . . . . 58 ILE HG11 . 15401 1 670 . 1 1 58 58 ILE HG13 H 1 1.467 0.03 . 1 . . . . 58 ILE HG12 . 15401 1 671 . 1 1 58 58 ILE HG21 H 1 0.686 0.03 . 1 . . . . 58 ILE HG21 . 15401 1 672 . 1 1 58 58 ILE HG22 H 1 0.686 0.03 . 1 . . . . 58 ILE HG21 . 15401 1 673 . 1 1 58 58 ILE HG23 H 1 0.686 0.03 . 1 . . . . 58 ILE HG21 . 15401 1 674 . 1 1 58 58 ILE C C 13 175.694 0.30 . 1 . . . . 58 ILE C . 15401 1 675 . 1 1 58 58 ILE CA C 13 60.712 0.30 . 1 . . . . 58 ILE CA . 15401 1 676 . 1 1 58 58 ILE CB C 13 39.014 0.30 . 1 . . . . 58 ILE CB . 15401 1 677 . 1 1 58 58 ILE CD1 C 13 12.843 0.30 . 1 . . . . 58 ILE CD1 . 15401 1 678 . 1 1 58 58 ILE CG1 C 13 27.818 0.30 . 1 . . . . 58 ILE CG1 . 15401 1 679 . 1 1 58 58 ILE CG2 C 13 17.691 0.30 . 1 . . . . 58 ILE CG2 . 15401 1 680 . 1 1 58 58 ILE N N 15 124.675 0.30 . 1 . . . . 58 ILE N . 15401 1 681 . 1 1 59 59 GLU H H 1 8.455 0.03 . 1 . . . . 59 GLU HN . 15401 1 682 . 1 1 59 59 GLU HA H 1 4.425 0.03 . 1 . . . . 59 GLU HA . 15401 1 683 . 1 1 59 59 GLU HB2 H 1 1.763 0.03 . 2 . . . . 59 GLU HB1 . 15401 1 684 . 1 1 59 59 GLU HB3 H 1 1.833 0.03 . 2 . . . . 59 GLU HB2 . 15401 1 685 . 1 1 59 59 GLU HG2 H 1 2.010 0.03 . 2 . . . . 59 GLU HG1 . 15401 1 686 . 1 1 59 59 GLU HG3 H 1 2.127 0.03 . 2 . . . . 59 GLU HG2 . 15401 1 687 . 1 1 59 59 GLU C C 13 174.608 0.30 . 1 . . . . 59 GLU C . 15401 1 688 . 1 1 59 59 GLU CA C 13 54.999 0.30 . 1 . . . . 59 GLU CA . 15401 1 689 . 1 1 59 59 GLU CB C 13 31.761 0.30 . 1 . . . . 59 GLU CB . 15401 1 690 . 1 1 59 59 GLU CG C 13 36.164 0.30 . 1 . . . . 59 GLU CG . 15401 1 691 . 1 1 59 59 GLU N N 15 128.451 0.30 . 1 . . . . 59 GLU N . 15401 1 692 . 1 1 60 60 GLU H H 1 8.525 0.03 . 1 . . . . 60 GLU HN . 15401 1 693 . 1 1 60 60 GLU HA H 1 4.935 0.03 . 1 . . . . 60 GLU HA . 15401 1 694 . 1 1 60 60 GLU HB2 H 1 1.858 0.03 . 2 . . . . 60 GLU HB2 . 15401 1 695 . 1 1 60 60 GLU HG2 H 1 1.980 0.03 . 2 . . . . 60 GLU HG1 . 15401 1 696 . 1 1 60 60 GLU HG3 H 1 2.090 0.03 . 2 . . . . 60 GLU HG2 . 15401 1 697 . 1 1 60 60 GLU C C 13 175.927 0.30 . 1 . . . . 60 GLU C . 15401 1 698 . 1 1 60 60 GLU CA C 13 55.307 0.30 . 1 . . . . 60 GLU CA . 15401 1 699 . 1 1 60 60 GLU CB C 13 31.697 0.30 . 1 . . . . 60 GLU CB . 15401 1 700 . 1 1 60 60 GLU CG C 13 37.142 0.30 . 1 . . . . 60 GLU CG . 15401 1 701 . 1 1 60 60 GLU N N 15 124.162 0.30 . 1 . . . . 60 GLU N . 15401 1 702 . 1 1 61 61 LYS H H 1 8.727 0.03 . 1 . . . . 61 LYS HN . 15401 1 703 . 1 1 61 61 LYS HA H 1 4.747 0.03 . 1 . . . . 61 LYS HA . 15401 1 704 . 1 1 61 61 LYS HB2 H 1 1.926 0.03 . 2 . . . . 61 LYS HB1 . 15401 1 705 . 1 1 61 61 LYS HB3 H 1 1.761 0.03 . 2 . . . . 61 LYS HB2 . 15401 1 706 . 1 1 61 61 LYS HD2 H 1 1.554 0.03 . 2 . . . . 61 LYS HD2 . 15401 1 707 . 1 1 61 61 LYS HE2 H 1 2.780 0.03 . 2 . . . . 61 LYS HE1 . 15401 1 708 . 1 1 61 61 LYS HE3 H 1 2.833 0.03 . 2 . . . . 61 LYS HE2 . 15401 1 709 . 1 1 61 61 LYS HG2 H 1 1.400 0.03 . 2 . . . . 61 LYS HG1 . 15401 1 710 . 1 1 61 61 LYS HG3 H 1 1.350 0.03 . 2 . . . . 61 LYS HG2 . 15401 1 711 . 1 1 61 61 LYS C C 13 175.764 0.30 . 1 . . . . 61 LYS C . 15401 1 712 . 1 1 61 61 LYS CA C 13 54.948 0.30 . 1 . . . . 61 LYS CA . 15401 1 713 . 1 1 61 61 LYS CB C 13 35.723 0.30 . 1 . . . . 61 LYS CB . 15401 1 714 . 1 1 61 61 LYS CD C 13 29.122 0.30 . 1 . . . . 61 LYS CD . 15401 1 715 . 1 1 61 61 LYS CE C 13 41.700 0.30 . 1 . . . . 61 LYS CE . 15401 1 716 . 1 1 61 61 LYS CG C 13 24.353 0.30 . 1 . . . . 61 LYS CG . 15401 1 717 . 1 1 61 61 LYS N N 15 125.113 0.30 . 1 . . . . 61 LYS N . 15401 1 718 . 1 1 62 62 THR H H 1 8.927 0.03 . 1 . . . . 62 THR HN . 15401 1 719 . 1 1 62 62 THR HA H 1 4.980 0.03 . 1 . . . . 62 THR HA . 15401 1 720 . 1 1 62 62 THR HB H 1 4.109 0.03 . 1 . . . . 62 THR HB . 15401 1 721 . 1 1 62 62 THR HG21 H 1 1.251 0.03 . 1 . . . . 62 THR HG21 . 15401 1 722 . 1 1 62 62 THR HG22 H 1 1.251 0.03 . 1 . . . . 62 THR HG21 . 15401 1 723 . 1 1 62 62 THR HG23 H 1 1.251 0.03 . 1 . . . . 62 THR HG21 . 15401 1 724 . 1 1 62 62 THR C C 13 174.045 0.30 . 1 . . . . 62 THR C . 15401 1 725 . 1 1 62 62 THR CA C 13 63.429 0.30 . 1 . . . . 62 THR CA . 15401 1 726 . 1 1 62 62 THR CB C 13 68.825 0.30 . 1 . . . . 62 THR CB . 15401 1 727 . 1 1 62 62 THR CG2 C 13 22.147 0.30 . 1 . . . . 62 THR CG2 . 15401 1 728 . 1 1 62 62 THR N N 15 122.476 0.30 . 1 . . . . 62 THR N . 15401 1 729 . 1 1 63 63 VAL H H 1 9.258 0.03 . 1 . . . . 63 VAL HN . 15401 1 730 . 1 1 63 63 VAL HA H 1 5.228 0.03 . 1 . . . . 63 VAL HA . 15401 1 731 . 1 1 63 63 VAL HB H 1 2.052 0.03 . 1 . . . . 63 VAL HB . 15401 1 732 . 1 1 63 63 VAL HG11 H 1 0.498 0.03 . 2 . . . . 63 VAL HG11 . 15401 1 733 . 1 1 63 63 VAL HG12 H 1 0.498 0.03 . 2 . . . . 63 VAL HG11 . 15401 1 734 . 1 1 63 63 VAL HG13 H 1 0.498 0.03 . 2 . . . . 63 VAL HG11 . 15401 1 735 . 1 1 63 63 VAL HG21 H 1 0.942 0.03 . 2 . . . . 63 VAL HG21 . 15401 1 736 . 1 1 63 63 VAL HG22 H 1 0.942 0.03 . 2 . . . . 63 VAL HG21 . 15401 1 737 . 1 1 63 63 VAL HG23 H 1 0.942 0.03 . 2 . . . . 63 VAL HG21 . 15401 1 738 . 1 1 63 63 VAL C C 13 173.626 0.30 . 1 . . . . 63 VAL C . 15401 1 739 . 1 1 63 63 VAL CA C 13 58.602 0.30 . 1 . . . . 63 VAL CA . 15401 1 740 . 1 1 63 63 VAL CB C 13 36.501 0.30 . 1 . . . . 63 VAL CB . 15401 1 741 . 1 1 63 63 VAL CG1 C 13 17.733 0.30 . 1 . . . . 63 VAL CG1 . 15401 1 742 . 1 1 63 63 VAL CG2 C 13 22.429 0.30 . 1 . . . . 63 VAL CG2 . 15401 1 743 . 1 1 63 63 VAL N N 15 119.634 0.30 . 1 . . . . 63 VAL N . 15401 1 744 . 1 1 64 64 GLU H H 1 8.963 0.03 . 1 . . . . 64 GLU HN . 15401 1 745 . 1 1 64 64 GLU HA H 1 4.713 0.03 . 1 . . . . 64 GLU HA . 15401 1 746 . 1 1 64 64 GLU HB2 H 1 1.708 0.03 . 2 . . . . 64 GLU HB1 . 15401 1 747 . 1 1 64 64 GLU HB3 H 1 1.956 0.03 . 2 . . . . 64 GLU HB2 . 15401 1 748 . 1 1 64 64 GLU HG2 H 1 1.964 0.03 . 2 . . . . 64 GLU HG1 . 15401 1 749 . 1 1 64 64 GLU HG3 H 1 2.061 0.03 . 2 . . . . 64 GLU HG2 . 15401 1 750 . 1 1 64 64 GLU C C 13 174.988 0.30 . 1 . . . . 64 GLU C . 15401 1 751 . 1 1 64 64 GLU CA C 13 55.428 0.30 . 1 . . . . 64 GLU CA . 15401 1 752 . 1 1 64 64 GLU CB C 13 32.029 0.30 . 1 . . . . 64 GLU CB . 15401 1 753 . 1 1 64 64 GLU CG C 13 37.069 0.30 . 1 . . . . 64 GLU CG . 15401 1 754 . 1 1 64 64 GLU N N 15 121.752 0.30 . 1 . . . . 64 GLU N . 15401 1 755 . 1 1 65 65 VAL H H 1 9.599 0.03 . 1 . . . . 65 VAL HN . 15401 1 756 . 1 1 65 65 VAL HA H 1 3.900 0.03 . 1 . . . . 65 VAL HA . 15401 1 757 . 1 1 65 65 VAL HB H 1 0.784 0.03 . 1 . . . . 65 VAL HB . 15401 1 758 . 1 1 65 65 VAL HG11 H 1 0.435 0.03 . 2 . . . . 65 VAL HG11 . 15401 1 759 . 1 1 65 65 VAL HG12 H 1 0.435 0.03 . 2 . . . . 65 VAL HG11 . 15401 1 760 . 1 1 65 65 VAL HG13 H 1 0.435 0.03 . 2 . . . . 65 VAL HG11 . 15401 1 761 . 1 1 65 65 VAL HG21 H 1 0.573 0.03 . 2 . . . . 65 VAL HG21 . 15401 1 762 . 1 1 65 65 VAL HG22 H 1 0.573 0.03 . 2 . . . . 65 VAL HG21 . 15401 1 763 . 1 1 65 65 VAL HG23 H 1 0.573 0.03 . 2 . . . . 65 VAL HG21 . 15401 1 764 . 1 1 65 65 VAL C C 13 175.851 0.30 . 1 . . . . 65 VAL C . 15401 1 765 . 1 1 65 65 VAL CA C 13 62.658 0.30 . 1 . . . . 65 VAL CA . 15401 1 766 . 1 1 65 65 VAL CB C 13 29.633 0.30 . 1 . . . . 65 VAL CB . 15401 1 767 . 1 1 65 65 VAL CG1 C 13 20.721 0.30 . 1 . . . . 65 VAL CG1 . 15401 1 768 . 1 1 65 65 VAL CG2 C 13 22.231 0.30 . 1 . . . . 65 VAL CG2 . 15401 1 769 . 1 1 65 65 VAL N N 15 128.015 0.30 . 1 . . . . 65 VAL N . 15401 1 770 . 1 1 66 66 LEU H H 1 8.729 0.03 . 1 . . . . 66 LEU HN . 15401 1 771 . 1 1 66 66 LEU HA H 1 4.048 0.03 . 1 . . . . 66 LEU HA . 15401 1 772 . 1 1 66 66 LEU HB2 H 1 1.365 0.03 . 2 . . . . 66 LEU HB1 . 15401 1 773 . 1 1 66 66 LEU HB3 H 1 1.286 0.03 . 2 . . . . 66 LEU HB2 . 15401 1 774 . 1 1 66 66 LEU HD11 H 1 0.659 0.03 . 2 . . . . 66 LEU HD11 . 15401 1 775 . 1 1 66 66 LEU HD12 H 1 0.659 0.03 . 2 . . . . 66 LEU HD11 . 15401 1 776 . 1 1 66 66 LEU HD13 H 1 0.659 0.03 . 2 . . . . 66 LEU HD11 . 15401 1 777 . 1 1 66 66 LEU HD21 H 1 0.696 0.03 . 2 . . . . 66 LEU HD21 . 15401 1 778 . 1 1 66 66 LEU HD22 H 1 0.696 0.03 . 2 . . . . 66 LEU HD21 . 15401 1 779 . 1 1 66 66 LEU HD23 H 1 0.696 0.03 . 2 . . . . 66 LEU HD21 . 15401 1 780 . 1 1 66 66 LEU HG H 1 0.702 0.03 . 1 . . . . 66 LEU HG . 15401 1 781 . 1 1 66 66 LEU C C 13 177.737 0.30 . 1 . . . . 66 LEU C . 15401 1 782 . 1 1 66 66 LEU CA C 13 56.365 0.30 . 1 . . . . 66 LEU CA . 15401 1 783 . 1 1 66 66 LEU CB C 13 43.529 0.30 . 1 . . . . 66 LEU CB . 15401 1 784 . 1 1 66 66 LEU CD1 C 13 22.475 0.30 . 1 . . . . 66 LEU CD1 . 15401 1 785 . 1 1 66 66 LEU CD2 C 13 25.878 0.30 . 1 . . . . 66 LEU CD2 . 15401 1 786 . 1 1 66 66 LEU CG C 13 26.036 0.30 . 1 . . . . 66 LEU CG . 15401 1 787 . 1 1 66 66 LEU N N 15 126.315 0.30 . 1 . . . . 66 LEU N . 15401 1 788 . 1 1 67 67 GLY H H 1 6.857 0.03 . 1 . . . . 67 GLY HN . 15401 1 789 . 1 1 67 67 GLY HA2 H 1 1.186 0.03 . 2 . . . . 67 GLY HA1 . 15401 1 790 . 1 1 67 67 GLY HA3 H 1 3.356 0.03 . 2 . . . . 67 GLY HA2 . 15401 1 791 . 1 1 67 67 GLY C C 13 172.107 0.30 . 1 . . . . 67 GLY C . 15401 1 792 . 1 1 67 67 GLY CA C 13 43.713 0.30 . 1 . . . . 67 GLY CA . 15401 1 793 . 1 1 67 67 GLY N N 15 105.574 0.30 . 1 . . . . 67 GLY N . 15401 1 794 . 1 1 68 68 MET H H 1 8.186 0.03 . 1 . . . . 68 MET HN . 15401 1 795 . 1 1 68 68 MET HA H 1 4.792 0.03 . 1 . . . . 68 MET HA . 15401 1 796 . 1 1 68 68 MET HB2 H 1 1.700 0.03 . 2 . . . . 68 MET HB1 . 15401 1 797 . 1 1 68 68 MET HB3 H 1 2.249 0.03 . 2 . . . . 68 MET HB2 . 15401 1 798 . 1 1 68 68 MET HE1 H 1 1.787 0.03 . 1 . . . . 68 MET HE1 . 15401 1 799 . 1 1 68 68 MET HE2 H 1 1.787 0.03 . 1 . . . . 68 MET HE1 . 15401 1 800 . 1 1 68 68 MET HE3 H 1 1.787 0.03 . 1 . . . . 68 MET HE1 . 15401 1 801 . 1 1 68 68 MET HG2 H 1 2.536 0.03 . 2 . . . . 68 MET HG2 . 15401 1 802 . 1 1 68 68 MET C C 13 178.820 0.30 . 1 . . . . 68 MET C . 15401 1 803 . 1 1 68 68 MET CA C 13 53.874 0.30 . 1 . . . . 68 MET CA . 15401 1 804 . 1 1 68 68 MET CB C 13 30.684 0.30 . 1 . . . . 68 MET CB . 15401 1 805 . 1 1 68 68 MET CE C 13 16.441 0.30 . 1 . . . . 68 MET CE . 15401 1 806 . 1 1 68 68 MET N N 15 117.047 0.30 . 1 . . . . 68 MET N . 15401 1 807 . 1 1 69 69 ALA H H 1 8.084 0.03 . 1 . . . . 69 ALA HN . 15401 1 808 . 1 1 69 69 ALA HA H 1 4.355 0.03 . 1 . . . . 69 ALA HA . 15401 1 809 . 1 1 69 69 ALA HB1 H 1 1.132 0.03 . 1 . . . . 69 ALA HB1 . 15401 1 810 . 1 1 69 69 ALA HB2 H 1 1.132 0.03 . 1 . . . . 69 ALA HB1 . 15401 1 811 . 1 1 69 69 ALA HB3 H 1 1.132 0.03 . 1 . . . . 69 ALA HB1 . 15401 1 812 . 1 1 69 69 ALA CA C 13 51.252 0.30 . 1 . . . . 69 ALA CA . 15401 1 813 . 1 1 69 69 ALA CB C 13 17.576 0.30 . 1 . . . . 69 ALA CB . 15401 1 814 . 1 1 69 69 ALA N N 15 124.941 0.30 . 1 . . . . 69 ALA N . 15401 1 815 . 1 1 70 70 PRO HA H 1 4.325 0.03 . 1 . . . . 70 PRO HA . 15401 1 816 . 1 1 70 70 PRO HB2 H 1 1.773 0.03 . 2 . . . . 70 PRO HB1 . 15401 1 817 . 1 1 70 70 PRO HB3 H 1 2.398 0.03 . 2 . . . . 70 PRO HB2 . 15401 1 818 . 1 1 70 70 PRO HD2 H 1 3.727 0.03 . 2 . . . . 70 PRO HD1 . 15401 1 819 . 1 1 70 70 PRO HD3 H 1 3.341 0.03 . 2 . . . . 70 PRO HD2 . 15401 1 820 . 1 1 70 70 PRO HG2 H 1 1.910 0.03 . 2 . . . . 70 PRO HG1 . 15401 1 821 . 1 1 70 70 PRO HG3 H 1 2.082 0.03 . 2 . . . . 70 PRO HG2 . 15401 1 822 . 1 1 70 70 PRO C C 13 177.078 0.30 . 1 . . . . 70 PRO C . 15401 1 823 . 1 1 70 70 PRO CA C 13 63.913 0.30 . 1 . . . . 70 PRO CA . 15401 1 824 . 1 1 70 70 PRO CB C 13 32.200 0.30 . 1 . . . . 70 PRO CB . 15401 1 825 . 1 1 70 70 PRO CD C 13 50.192 0.30 . 1 . . . . 70 PRO CD . 15401 1 826 . 1 1 70 70 PRO CG C 13 28.563 0.30 . 1 . . . . 70 PRO CG . 15401 1 827 . 1 1 71 71 ASP H H 1 8.452 0.03 . 1 . . . . 71 ASP HN . 15401 1 828 . 1 1 71 71 ASP HA H 1 2.985 0.03 . 1 . . . . 71 ASP HA . 15401 1 829 . 1 1 71 71 ASP HB2 H 1 1.736 0.03 . 2 . . . . 71 ASP HB1 . 15401 1 830 . 1 1 71 71 ASP HB3 H 1 2.005 0.03 . 2 . . . . 71 ASP HB2 . 15401 1 831 . 1 1 71 71 ASP C C 13 177.621 0.30 . 1 . . . . 71 ASP C . 15401 1 832 . 1 1 71 71 ASP CA C 13 57.685 0.30 . 1 . . . . 71 ASP CA . 15401 1 833 . 1 1 71 71 ASP CB C 13 38.712 0.30 . 1 . . . . 71 ASP CB . 15401 1 834 . 1 1 71 71 ASP N N 15 124.341 0.30 . 1 . . . . 71 ASP N . 15401 1 835 . 1 1 72 72 ASP H H 1 8.082 0.03 . 1 . . . . 72 ASP HN . 15401 1 836 . 1 1 72 72 ASP HA H 1 4.190 0.03 . 1 . . . . 72 ASP HA . 15401 1 837 . 1 1 72 72 ASP HB2 H 1 2.563 0.03 . 2 . . . . 72 ASP HB1 . 15401 1 838 . 1 1 72 72 ASP HB3 H 1 2.694 0.03 . 2 . . . . 72 ASP HB2 . 15401 1 839 . 1 1 72 72 ASP C C 13 177.629 0.30 . 1 . . . . 72 ASP C . 15401 1 840 . 1 1 72 72 ASP CA C 13 55.281 0.30 . 1 . . . . 72 ASP CA . 15401 1 841 . 1 1 72 72 ASP CB C 13 39.653 0.30 . 1 . . . . 72 ASP CB . 15401 1 842 . 1 1 72 72 ASP N N 15 117.220 0.30 . 1 . . . . 72 ASP N . 15401 1 843 . 1 1 73 73 GLU H H 1 7.851 0.03 . 1 . . . . 73 GLU HN . 15401 1 844 . 1 1 73 73 GLU HA H 1 4.414 0.03 . 1 . . . . 73 GLU HA . 15401 1 845 . 1 1 73 73 GLU HB2 H 1 1.941 0.03 . 2 . . . . 73 GLU HB1 . 15401 1 846 . 1 1 73 73 GLU HB3 H 1 2.148 0.03 . 2 . . . . 73 GLU HB2 . 15401 1 847 . 1 1 73 73 GLU HG2 H 1 2.123 0.03 . 2 . . . . 73 GLU HG1 . 15401 1 848 . 1 1 73 73 GLU HG3 H 1 2.200 0.03 . 2 . . . . 73 GLU HG2 . 15401 1 849 . 1 1 73 73 GLU C C 13 178.215 0.30 . 1 . . . . 73 GLU C . 15401 1 850 . 1 1 73 73 GLU CA C 13 56.476 0.30 . 1 . . . . 73 GLU CA . 15401 1 851 . 1 1 73 73 GLU CB C 13 30.030 0.30 . 1 . . . . 73 GLU CB . 15401 1 852 . 1 1 73 73 GLU CG C 13 36.377 0.30 . 1 . . . . 73 GLU CG . 15401 1 853 . 1 1 73 73 GLU N N 15 119.078 0.30 . 1 . . . . 73 GLU N . 15401 1 854 . 1 1 74 74 CYS H H 1 7.548 0.03 . 1 . . . . 74 CYS HN . 15401 1 855 . 1 1 74 74 CYS HA H 1 5.755 0.03 . 1 . . . . 74 CYS HA . 15401 1 856 . 1 1 74 74 CYS HB2 H 1 2.701 0.03 . 2 . . . . 74 CYS HB1 . 15401 1 857 . 1 1 74 74 CYS HB3 H 1 3.809 0.03 . 2 . . . . 74 CYS HB2 . 15401 1 858 . 1 1 74 74 CYS C C 13 172.107 0.30 . 1 . . . . 74 CYS C . 15401 1 859 . 1 1 74 74 CYS CA C 13 58.768 0.30 . 1 . . . . 74 CYS CA . 15401 1 860 . 1 1 74 74 CYS CB C 13 29.484 0.30 . 1 . . . . 74 CYS CB . 15401 1 861 . 1 1 74 74 CYS N N 15 118.751 0.30 . 1 . . . . 74 CYS N . 15401 1 862 . 1 1 75 75 LEU H H 1 7.230 0.03 . 1 . . . . 75 LEU HN . 15401 1 863 . 1 1 75 75 LEU HA H 1 4.112 0.03 . 1 . . . . 75 LEU HA . 15401 1 864 . 1 1 75 75 LEU HB2 H 1 1.823 0.03 . 2 . . . . 75 LEU HB1 . 15401 1 865 . 1 1 75 75 LEU HB3 H 1 1.508 0.03 . 2 . . . . 75 LEU HB2 . 15401 1 866 . 1 1 75 75 LEU HD11 H 1 0.818 0.03 . 2 . . . . 75 LEU HD11 . 15401 1 867 . 1 1 75 75 LEU HD12 H 1 0.818 0.03 . 2 . . . . 75 LEU HD11 . 15401 1 868 . 1 1 75 75 LEU HD13 H 1 0.818 0.03 . 2 . . . . 75 LEU HD11 . 15401 1 869 . 1 1 75 75 LEU HD21 H 1 0.938 0.03 . 2 . . . . 75 LEU HD21 . 15401 1 870 . 1 1 75 75 LEU HD22 H 1 0.938 0.03 . 2 . . . . 75 LEU HD21 . 15401 1 871 . 1 1 75 75 LEU HD23 H 1 0.938 0.03 . 2 . . . . 75 LEU HD21 . 15401 1 872 . 1 1 75 75 LEU HG H 1 1.646 0.03 . 1 . . . . 75 LEU HG . 15401 1 873 . 1 1 75 75 LEU C C 13 178.074 0.30 . 1 . . . . 75 LEU C . 15401 1 874 . 1 1 75 75 LEU CA C 13 56.255 0.30 . 1 . . . . 75 LEU CA . 15401 1 875 . 1 1 75 75 LEU CB C 13 41.986 0.30 . 1 . . . . 75 LEU CB . 15401 1 876 . 1 1 75 75 LEU CD1 C 13 23.257 0.30 . 1 . . . . 75 LEU CD1 . 15401 1 877 . 1 1 75 75 LEU CD2 C 13 25.271 0.30 . 1 . . . . 75 LEU CD2 . 15401 1 878 . 1 1 75 75 LEU CG C 13 27.496 0.30 . 1 . . . . 75 LEU CG . 15401 1 879 . 1 1 75 75 LEU N N 15 114.163 0.30 . 1 . . . . 75 LEU N . 15401 1 880 . 1 1 76 76 LYS H H 1 8.879 0.03 . 1 . . . . 76 LYS HN . 15401 1 881 . 1 1 76 76 LYS HA H 1 4.899 0.03 . 1 . . . . 76 LYS HA . 15401 1 882 . 1 1 76 76 LYS HB2 H 1 1.876 0.03 . 2 . . . . 76 LYS HB1 . 15401 1 883 . 1 1 76 76 LYS HB3 H 1 2.084 0.03 . 2 . . . . 76 LYS HB2 . 15401 1 884 . 1 1 76 76 LYS HD2 H 1 1.780 0.03 . 2 . . . . 76 LYS HD2 . 15401 1 885 . 1 1 76 76 LYS HE2 H 1 3.061 0.03 . 2 . . . . 76 LYS HE2 . 15401 1 886 . 1 1 76 76 LYS HG2 H 1 1.520 0.03 . 2 . . . . 76 LYS HG2 . 15401 1 887 . 1 1 76 76 LYS C C 13 176.132 0.30 . 1 . . . . 76 LYS C . 15401 1 888 . 1 1 76 76 LYS CA C 13 56.177 0.30 . 1 . . . . 76 LYS CA . 15401 1 889 . 1 1 76 76 LYS CB C 13 34.600 0.30 . 1 . . . . 76 LYS CB . 15401 1 890 . 1 1 76 76 LYS CD C 13 29.208 0.30 . 1 . . . . 76 LYS CD . 15401 1 891 . 1 1 76 76 LYS CE C 13 42.450 0.30 . 1 . . . . 76 LYS CE . 15401 1 892 . 1 1 76 76 LYS CG C 13 25.299 0.30 . 1 . . . . 76 LYS CG . 15401 1 893 . 1 1 76 76 LYS N N 15 114.777 0.30 . 1 . . . . 76 LYS N . 15401 1 894 . 1 1 77 77 ASP H H 1 8.443 0.03 . 1 . . . . 77 ASP HN . 15401 1 895 . 1 1 77 77 ASP HA H 1 4.773 0.03 . 1 . . . . 77 ASP HA . 15401 1 896 . 1 1 77 77 ASP HB2 H 1 2.450 0.03 . 2 . . . . 77 ASP HB1 . 15401 1 897 . 1 1 77 77 ASP HB3 H 1 2.682 0.03 . 2 . . . . 77 ASP HB2 . 15401 1 898 . 1 1 77 77 ASP C C 13 172.917 0.30 . 1 . . . . 77 ASP C . 15401 1 899 . 1 1 77 77 ASP CA C 13 52.303 0.30 . 1 . . . . 77 ASP CA . 15401 1 900 . 1 1 77 77 ASP CB C 13 43.280 0.30 . 1 . . . . 77 ASP CB . 15401 1 901 . 1 1 77 77 ASP N N 15 120.755 0.30 . 1 . . . . 77 ASP N . 15401 1 902 . 1 1 78 78 MET H H 1 8.855 0.03 . 1 . . . . 78 MET HN . 15401 1 903 . 1 1 78 78 MET HA H 1 4.984 0.03 . 1 . . . . 78 MET HA . 15401 1 904 . 1 1 78 78 MET HB2 H 1 0.659 0.03 . 2 . . . . 78 MET HB1 . 15401 1 905 . 1 1 78 78 MET HB3 H 1 1.266 0.03 . 2 . . . . 78 MET HB2 . 15401 1 906 . 1 1 78 78 MET HE1 H 1 2.158 0.03 . 1 . . . . 78 MET HE1 . 15401 1 907 . 1 1 78 78 MET HE2 H 1 2.158 0.03 . 1 . . . . 78 MET HE1 . 15401 1 908 . 1 1 78 78 MET HE3 H 1 2.158 0.03 . 1 . . . . 78 MET HE1 . 15401 1 909 . 1 1 78 78 MET HG2 H 1 0.933 0.03 . 2 . . . . 78 MET HG1 . 15401 1 910 . 1 1 78 78 MET HG3 H 1 1.184 0.03 . 2 . . . . 78 MET HG2 . 15401 1 911 . 1 1 78 78 MET C C 13 175.616 0.30 . 1 . . . . 78 MET C . 15401 1 912 . 1 1 78 78 MET CA C 13 52.745 0.30 . 1 . . . . 78 MET CA . 15401 1 913 . 1 1 78 78 MET CB C 13 34.896 0.30 . 1 . . . . 78 MET CB . 15401 1 914 . 1 1 78 78 MET CE C 13 22.692 0.30 . 1 . . . . 78 MET CE . 15401 1 915 . 1 1 78 78 MET CG C 13 32.220 0.30 . 1 . . . . 78 MET CG . 15401 1 916 . 1 1 78 78 MET N N 15 116.088 0.30 . 1 . . . . 78 MET N . 15401 1 917 . 1 1 79 79 TYR H H 1 7.482 0.03 . 1 . . . . 79 TYR HN . 15401 1 918 . 1 1 79 79 TYR HA H 1 5.269 0.03 . 1 . . . . 79 TYR HA . 15401 1 919 . 1 1 79 79 TYR HB2 H 1 2.648 0.03 . 2 . . . . 79 TYR HB1 . 15401 1 920 . 1 1 79 79 TYR HB3 H 1 2.674 0.03 . 2 . . . . 79 TYR HB2 . 15401 1 921 . 1 1 79 79 TYR HD1 H 1 6.988 0.03 . 3 . . . . 79 TYR HD1 . 15401 1 922 . 1 1 79 79 TYR HE1 H 1 7.160 0.03 . 3 . . . . 79 TYR HE1 . 15401 1 923 . 1 1 79 79 TYR C C 13 174.121 0.30 . 1 . . . . 79 TYR C . 15401 1 924 . 1 1 79 79 TYR CA C 13 57.018 0.30 . 1 . . . . 79 TYR CA . 15401 1 925 . 1 1 79 79 TYR CB C 13 41.785 0.30 . 1 . . . . 79 TYR CB . 15401 1 926 . 1 1 79 79 TYR CD1 C 13 133.700 0.30 . 3 . . . . 79 TYR CD1 . 15401 1 927 . 1 1 79 79 TYR CE1 C 13 118.663 0.30 . 3 . . . . 79 TYR CE1 . 15401 1 928 . 1 1 79 79 TYR N N 15 124.867 0.30 . 1 . . . . 79 TYR N . 15401 1 929 . 1 1 80 80 VAL H H 1 9.314 0.03 . 1 . . . . 80 VAL HN . 15401 1 930 . 1 1 80 80 VAL HA H 1 4.946 0.03 . 1 . . . . 80 VAL HA . 15401 1 931 . 1 1 80 80 VAL HB H 1 2.069 0.03 . 1 . . . . 80 VAL HB . 15401 1 932 . 1 1 80 80 VAL HG11 H 1 0.491 0.03 . 2 . . . . 80 VAL HG11 . 15401 1 933 . 1 1 80 80 VAL HG12 H 1 0.491 0.03 . 2 . . . . 80 VAL HG11 . 15401 1 934 . 1 1 80 80 VAL HG13 H 1 0.491 0.03 . 2 . . . . 80 VAL HG11 . 15401 1 935 . 1 1 80 80 VAL HG21 H 1 0.904 0.03 . 2 . . . . 80 VAL HG21 . 15401 1 936 . 1 1 80 80 VAL HG22 H 1 0.904 0.03 . 2 . . . . 80 VAL HG21 . 15401 1 937 . 1 1 80 80 VAL HG23 H 1 0.904 0.03 . 2 . . . . 80 VAL HG21 . 15401 1 938 . 1 1 80 80 VAL C C 13 174.388 0.30 . 1 . . . . 80 VAL C . 15401 1 939 . 1 1 80 80 VAL CA C 13 58.294 0.30 . 1 . . . . 80 VAL CA . 15401 1 940 . 1 1 80 80 VAL CB C 13 34.612 0.30 . 1 . . . . 80 VAL CB . 15401 1 941 . 1 1 80 80 VAL CG1 C 13 18.441 0.30 . 1 . . . . 80 VAL CG1 . 15401 1 942 . 1 1 80 80 VAL CG2 C 13 24.057 0.30 . 1 . . . . 80 VAL CG2 . 15401 1 943 . 1 1 80 80 VAL N N 15 112.084 0.30 . 1 . . . . 80 VAL N . 15401 1 944 . 1 1 81 81 GLU H H 1 8.402 0.03 . 1 . . . . 81 GLU HN . 15401 1 945 . 1 1 81 81 GLU HA H 1 4.877 0.03 . 1 . . . . 81 GLU HA . 15401 1 946 . 1 1 81 81 GLU HB2 H 1 1.484 0.03 . 2 . . . . 81 GLU HB1 . 15401 1 947 . 1 1 81 81 GLU HB3 H 1 1.554 0.03 . 2 . . . . 81 GLU HB2 . 15401 1 948 . 1 1 81 81 GLU HG2 H 1 1.829 0.03 . 2 . . . . 81 GLU HG1 . 15401 1 949 . 1 1 81 81 GLU HG3 H 1 1.914 0.03 . 2 . . . . 81 GLU HG2 . 15401 1 950 . 1 1 81 81 GLU C C 13 176.025 0.30 . 1 . . . . 81 GLU C . 15401 1 951 . 1 1 81 81 GLU CA C 13 54.996 0.30 . 1 . . . . 81 GLU CA . 15401 1 952 . 1 1 81 81 GLU CB C 13 30.712 0.30 . 1 . . . . 81 GLU CB . 15401 1 953 . 1 1 81 81 GLU CG C 13 36.809 0.30 . 1 . . . . 81 GLU CG . 15401 1 954 . 1 1 81 81 GLU N N 15 121.666 0.30 . 1 . . . . 81 GLU N . 15401 1 955 . 1 1 82 82 VAL H H 1 8.981 0.03 . 1 . . . . 82 VAL HN . 15401 1 956 . 1 1 82 82 VAL HA H 1 5.406 0.03 . 1 . . . . 82 VAL HA . 15401 1 957 . 1 1 82 82 VAL HB H 1 1.638 0.03 . 1 . . . . 82 VAL HB . 15401 1 958 . 1 1 82 82 VAL HG11 H 1 0.065 0.03 . 2 . . . . 82 VAL HG11 . 15401 1 959 . 1 1 82 82 VAL HG12 H 1 0.065 0.03 . 2 . . . . 82 VAL HG11 . 15401 1 960 . 1 1 82 82 VAL HG13 H 1 0.065 0.03 . 2 . . . . 82 VAL HG11 . 15401 1 961 . 1 1 82 82 VAL HG21 H 1 0.438 0.03 . 2 . . . . 82 VAL HG21 . 15401 1 962 . 1 1 82 82 VAL HG22 H 1 0.438 0.03 . 2 . . . . 82 VAL HG21 . 15401 1 963 . 1 1 82 82 VAL HG23 H 1 0.438 0.03 . 2 . . . . 82 VAL HG21 . 15401 1 964 . 1 1 82 82 VAL C C 13 173.001 0.30 . 1 . . . . 82 VAL C . 15401 1 965 . 1 1 82 82 VAL CA C 13 57.435 0.30 . 1 . . . . 82 VAL CA . 15401 1 966 . 1 1 82 82 VAL CB C 13 35.006 0.30 . 1 . . . . 82 VAL CB . 15401 1 967 . 1 1 82 82 VAL CG1 C 13 19.569 0.30 . 1 . . . . 82 VAL CG1 . 15401 1 968 . 1 1 82 82 VAL CG2 C 13 23.316 0.30 . 1 . . . . 82 VAL CG2 . 15401 1 969 . 1 1 82 82 VAL N N 15 116.081 0.30 . 1 . . . . 82 VAL N . 15401 1 970 . 1 1 83 83 ALA H H 1 8.927 0.03 . 1 . . . . 83 ALA HN . 15401 1 971 . 1 1 83 83 ALA HA H 1 5.039 0.03 . 1 . . . . 83 ALA HA . 15401 1 972 . 1 1 83 83 ALA HB1 H 1 1.417 0.03 . 1 . . . . 83 ALA HB1 . 15401 1 973 . 1 1 83 83 ALA HB2 H 1 1.417 0.03 . 1 . . . . 83 ALA HB1 . 15401 1 974 . 1 1 83 83 ALA HB3 H 1 1.417 0.03 . 1 . . . . 83 ALA HB1 . 15401 1 975 . 1 1 83 83 ALA C C 13 177.238 0.30 . 1 . . . . 83 ALA C . 15401 1 976 . 1 1 83 83 ALA CA C 13 50.213 0.30 . 1 . . . . 83 ALA CA . 15401 1 977 . 1 1 83 83 ALA CB C 13 23.007 0.30 . 1 . . . . 83 ALA CB . 15401 1 978 . 1 1 83 83 ALA N N 15 122.476 0.30 . 1 . . . . 83 ALA N . 15401 1 979 . 1 1 84 84 ASP H H 1 8.931 0.03 . 1 . . . . 84 ASP HN . 15401 1 980 . 1 1 84 84 ASP HA H 1 4.833 0.03 . 1 . . . . 84 ASP HA . 15401 1 981 . 1 1 84 84 ASP HB2 H 1 2.629 0.03 . 2 . . . . 84 ASP HB1 . 15401 1 982 . 1 1 84 84 ASP HB3 H 1 2.968 0.03 . 2 . . . . 84 ASP HB2 . 15401 1 983 . 1 1 84 84 ASP C C 13 177.675 0.30 . 1 . . . . 84 ASP C . 15401 1 984 . 1 1 84 84 ASP CA C 13 54.800 0.30 . 1 . . . . 84 ASP CA . 15401 1 985 . 1 1 84 84 ASP CB C 13 41.856 0.30 . 1 . . . . 84 ASP CB . 15401 1 986 . 1 1 84 84 ASP N N 15 121.522 0.30 . 1 . . . . 84 ASP N . 15401 1 987 . 1 1 85 85 ILE H H 1 8.257 0.03 . 1 . . . . 85 ILE HN . 15401 1 988 . 1 1 85 85 ILE HA H 1 4.226 0.03 . 1 . . . . 85 ILE HA . 15401 1 989 . 1 1 85 85 ILE HB H 1 1.916 0.03 . 1 . . . . 85 ILE HB . 15401 1 990 . 1 1 85 85 ILE HD11 H 1 0.862 0.03 . 1 . . . . 85 ILE HD11 . 15401 1 991 . 1 1 85 85 ILE HD12 H 1 0.862 0.03 . 1 . . . . 85 ILE HD11 . 15401 1 992 . 1 1 85 85 ILE HD13 H 1 0.862 0.03 . 1 . . . . 85 ILE HD11 . 15401 1 993 . 1 1 85 85 ILE HG12 H 1 1.262 0.03 . 1 . . . . 85 ILE HG11 . 15401 1 994 . 1 1 85 85 ILE HG13 H 1 1.455 0.03 . 1 . . . . 85 ILE HG12 . 15401 1 995 . 1 1 85 85 ILE HG21 H 1 0.940 0.03 . 1 . . . . 85 ILE HG21 . 15401 1 996 . 1 1 85 85 ILE HG22 H 1 0.940 0.03 . 1 . . . . 85 ILE HG21 . 15401 1 997 . 1 1 85 85 ILE HG23 H 1 0.940 0.03 . 1 . . . . 85 ILE HG21 . 15401 1 998 . 1 1 85 85 ILE C C 13 177.637 0.30 . 1 . . . . 85 ILE C . 15401 1 999 . 1 1 85 85 ILE CA C 13 62.159 0.30 . 1 . . . . 85 ILE CA . 15401 1 1000 . 1 1 85 85 ILE CB C 13 37.783 0.30 . 1 . . . . 85 ILE CB . 15401 1 1001 . 1 1 85 85 ILE CD1 C 13 13.422 0.30 . 1 . . . . 85 ILE CD1 . 15401 1 1002 . 1 1 85 85 ILE CG1 C 13 27.588 0.30 . 1 . . . . 85 ILE CG1 . 15401 1 1003 . 1 1 85 85 ILE CG2 C 13 17.927 0.30 . 1 . . . . 85 ILE CG2 . 15401 1 1004 . 1 1 85 85 ILE N N 15 123.474 0.30 . 1 . . . . 85 ILE N . 15401 1 1005 . 1 1 86 86 GLY H H 1 8.939 0.03 . 1 . . . . 86 GLY HN . 15401 1 1006 . 1 1 86 86 GLY HA2 H 1 4.025 0.03 . 2 . . . . 86 GLY HA2 . 15401 1 1007 . 1 1 86 86 GLY C C 13 175.264 0.30 . 1 . . . . 86 GLY C . 15401 1 1008 . 1 1 86 86 GLY CA C 13 45.714 0.30 . 1 . . . . 86 GLY CA . 15401 1 1009 . 1 1 86 86 GLY N N 15 114.051 0.30 . 1 . . . . 86 GLY N . 15401 1 1010 . 1 1 87 87 GLY H H 1 8.035 0.03 . 1 . . . . 87 GLY HN . 15401 1 1011 . 1 1 87 87 GLY HA2 H 1 4.273 0.03 . 2 . . . . 87 GLY HA1 . 15401 1 1012 . 1 1 87 87 GLY HA3 H 1 3.900 0.03 . 2 . . . . 87 GLY HA2 . 15401 1 1013 . 1 1 87 87 GLY C C 13 174.357 0.30 . 1 . . . . 87 GLY C . 15401 1 1014 . 1 1 87 87 GLY CA C 13 45.402 0.30 . 1 . . . . 87 GLY CA . 15401 1 1015 . 1 1 87 87 GLY N N 15 109.266 0.30 . 1 . . . . 87 GLY N . 15401 1 1016 . 1 1 88 88 LYS H H 1 8.602 0.03 . 1 . . . . 88 LYS HN . 15401 1 1017 . 1 1 88 88 LYS HA H 1 4.369 0.03 . 1 . . . . 88 LYS HA . 15401 1 1018 . 1 1 88 88 LYS HB2 H 1 1.788 0.03 . 2 . . . . 88 LYS HB1 . 15401 1 1019 . 1 1 88 88 LYS HB3 H 1 1.913 0.03 . 2 . . . . 88 LYS HB2 . 15401 1 1020 . 1 1 88 88 LYS HD2 H 1 1.691 0.03 . 2 . . . . 88 LYS HD2 . 15401 1 1021 . 1 1 88 88 LYS HE2 H 1 3.022 0.03 . 2 . . . . 88 LYS HE2 . 15401 1 1022 . 1 1 88 88 LYS HG2 H 1 1.443 0.03 . 2 . . . . 88 LYS HG2 . 15401 1 1023 . 1 1 88 88 LYS C C 13 176.979 0.30 . 1 . . . . 88 LYS C . 15401 1 1024 . 1 1 88 88 LYS CA C 13 56.597 0.30 . 1 . . . . 88 LYS CA . 15401 1 1025 . 1 1 88 88 LYS CB C 13 32.994 0.30 . 1 . . . . 88 LYS CB . 15401 1 1026 . 1 1 88 88 LYS CD C 13 29.149 0.30 . 1 . . . . 88 LYS CD . 15401 1 1027 . 1 1 88 88 LYS CE C 13 42.233 0.30 . 1 . . . . 88 LYS CE . 15401 1 1028 . 1 1 88 88 LYS CG C 13 24.800 0.30 . 1 . . . . 88 LYS CG . 15401 1 1029 . 1 1 88 88 LYS N N 15 121.374 0.30 . 1 . . . . 88 LYS N . 15401 1 1030 . 1 1 89 89 ASP H H 1 8.302 0.03 . 1 . . . . 89 ASP HN . 15401 1 1031 . 1 1 89 89 ASP HA H 1 4.544 0.03 . 1 . . . . 89 ASP HA . 15401 1 1032 . 1 1 89 89 ASP HB2 H 1 2.646 0.03 . 2 . . . . 89 ASP HB1 . 15401 1 1033 . 1 1 89 89 ASP HB3 H 1 2.755 0.03 . 2 . . . . 89 ASP HB2 . 15401 1 1034 . 1 1 89 89 ASP C C 13 175.921 0.30 . 1 . . . . 89 ASP C . 15401 1 1035 . 1 1 89 89 ASP CA C 13 55.010 0.30 . 1 . . . . 89 ASP CA . 15401 1 1036 . 1 1 89 89 ASP CB C 13 41.467 0.30 . 1 . . . . 89 ASP CB . 15401 1 1037 . 1 1 89 89 ASP N N 15 120.781 0.30 . 1 . . . . 89 ASP N . 15401 1 1038 . 1 1 90 90 ASP H H 1 8.285 0.03 . 1 . . . . 90 ASP HN . 15401 1 1039 . 1 1 90 90 ASP HA H 1 4.631 0.03 . 1 . . . . 90 ASP HA . 15401 1 1040 . 1 1 90 90 ASP HB2 H 1 2.686 0.03 . 2 . . . . 90 ASP HB2 . 15401 1 1041 . 1 1 90 90 ASP C C 13 175.926 0.30 . 1 . . . . 90 ASP C . 15401 1 1042 . 1 1 90 90 ASP CA C 13 54.150 0.30 . 1 . . . . 90 ASP CA . 15401 1 1043 . 1 1 90 90 ASP CB C 13 40.798 0.30 . 1 . . . . 90 ASP CB . 15401 1 1044 . 1 1 90 90 ASP N N 15 119.201 0.30 . 1 . . . . 90 ASP N . 15401 1 1045 . 1 1 91 91 ASP H H 1 7.918 0.03 . 1 . . . . 91 ASP HN . 15401 1 1046 . 1 1 91 91 ASP HA H 1 4.622 0.03 . 1 . . . . 91 ASP HA . 15401 1 1047 . 1 1 91 91 ASP HB2 H 1 2.559 0.03 . 2 . . . . 91 ASP HB1 . 15401 1 1048 . 1 1 91 91 ASP HB3 H 1 2.619 0.03 . 2 . . . . 91 ASP HB2 . 15401 1 1049 . 1 1 91 91 ASP C C 13 174.760 0.30 . 1 . . . . 91 ASP C . 15401 1 1050 . 1 1 91 91 ASP CA C 13 54.472 0.30 . 1 . . . . 91 ASP CA . 15401 1 1051 . 1 1 91 91 ASP CB C 13 41.560 0.30 . 1 . . . . 91 ASP CB . 15401 1 1052 . 1 1 91 91 ASP N N 15 121.892 0.30 . 1 . . . . 91 ASP N . 15401 1 1053 . 1 1 92 92 VAL H H 1 7.682 0.03 . 1 . . . . 92 VAL HN . 15401 1 1054 . 1 1 92 92 VAL HA H 1 4.624 0.03 . 1 . . . . 92 VAL HA . 15401 1 1055 . 1 1 92 92 VAL HB H 1 1.766 0.03 . 1 . . . . 92 VAL HB . 15401 1 1056 . 1 1 92 92 VAL HG11 H 1 0.739 0.03 . 2 . . . . 92 VAL HG11 . 15401 1 1057 . 1 1 92 92 VAL HG12 H 1 0.739 0.03 . 2 . . . . 92 VAL HG11 . 15401 1 1058 . 1 1 92 92 VAL HG13 H 1 0.739 0.03 . 2 . . . . 92 VAL HG11 . 15401 1 1059 . 1 1 92 92 VAL HG21 H 1 0.761 0.03 . 2 . . . . 92 VAL HG21 . 15401 1 1060 . 1 1 92 92 VAL HG22 H 1 0.761 0.03 . 2 . . . . 92 VAL HG21 . 15401 1 1061 . 1 1 92 92 VAL HG23 H 1 0.761 0.03 . 2 . . . . 92 VAL HG21 . 15401 1 1062 . 1 1 92 92 VAL C C 13 175.581 0.30 . 1 . . . . 92 VAL C . 15401 1 1063 . 1 1 92 92 VAL CA C 13 61.006 0.30 . 1 . . . . 92 VAL CA . 15401 1 1064 . 1 1 92 92 VAL CB C 13 34.119 0.30 . 1 . . . . 92 VAL CB . 15401 1 1065 . 1 1 92 92 VAL CG1 C 13 20.899 0.30 . 1 . . . . 92 VAL CG1 . 15401 1 1066 . 1 1 92 92 VAL CG2 C 13 21.441 0.30 . 1 . . . . 92 VAL CG2 . 15401 1 1067 . 1 1 92 92 VAL N N 15 120.488 0.30 . 1 . . . . 92 VAL N . 15401 1 1068 . 1 1 93 93 TYR H H 1 9.159 0.03 . 1 . . . . 93 TYR HN . 15401 1 1069 . 1 1 93 93 TYR HA H 1 4.902 0.03 . 1 . . . . 93 TYR HA . 15401 1 1070 . 1 1 93 93 TYR HB2 H 1 2.552 0.03 . 2 . . . . 93 TYR HB1 . 15401 1 1071 . 1 1 93 93 TYR HB3 H 1 3.159 0.03 . 2 . . . . 93 TYR HB2 . 15401 1 1072 . 1 1 93 93 TYR HD1 H 1 7.138 0.03 . 3 . . . . 93 TYR HD1 . 15401 1 1073 . 1 1 93 93 TYR HE1 H 1 6.811 0.03 . 3 . . . . 93 TYR HE1 . 15401 1 1074 . 1 1 93 93 TYR C C 13 174.495 0.30 . 1 . . . . 93 TYR C . 15401 1 1075 . 1 1 93 93 TYR CA C 13 56.006 0.30 . 1 . . . . 93 TYR CA . 15401 1 1076 . 1 1 93 93 TYR CB C 13 41.428 0.30 . 1 . . . . 93 TYR CB . 15401 1 1077 . 1 1 93 93 TYR CD1 C 13 133.710 0.30 . 3 . . . . 93 TYR CD1 . 15401 1 1078 . 1 1 93 93 TYR CE1 C 13 118.300 0.30 . 3 . . . . 93 TYR CE1 . 15401 1 1079 . 1 1 93 93 TYR N N 15 125.331 0.30 . 1 . . . . 93 TYR N . 15401 1 1080 . 1 1 94 94 THR H H 1 8.423 0.03 . 1 . . . . 94 THR HN . 15401 1 1081 . 1 1 94 94 THR HA H 1 5.023 0.03 . 1 . . . . 94 THR HA . 15401 1 1082 . 1 1 94 94 THR HB H 1 3.950 0.03 . 1 . . . . 94 THR HB . 15401 1 1083 . 1 1 94 94 THR HG21 H 1 1.061 0.03 . 1 . . . . 94 THR HG21 . 15401 1 1084 . 1 1 94 94 THR HG22 H 1 1.061 0.03 . 1 . . . . 94 THR HG21 . 15401 1 1085 . 1 1 94 94 THR HG23 H 1 1.061 0.03 . 1 . . . . 94 THR HG21 . 15401 1 1086 . 1 1 94 94 THR C C 13 173.475 0.30 . 1 . . . . 94 THR C . 15401 1 1087 . 1 1 94 94 THR CA C 13 61.820 0.30 . 1 . . . . 94 THR CA . 15401 1 1088 . 1 1 94 94 THR CB C 13 69.855 0.30 . 1 . . . . 94 THR CB . 15401 1 1089 . 1 1 94 94 THR CG2 C 13 22.753 0.30 . 1 . . . . 94 THR CG2 . 15401 1 1090 . 1 1 94 94 THR N N 15 115.914 0.30 . 1 . . . . 94 THR N . 15401 1 1091 . 1 1 95 95 ALA H H 1 9.176 0.03 . 1 . . . . 95 ALA HN . 15401 1 1092 . 1 1 95 95 ALA HA H 1 4.742 0.03 . 1 . . . . 95 ALA HA . 15401 1 1093 . 1 1 95 95 ALA HB1 H 1 0.323 0.03 . 1 . . . . 95 ALA HB1 . 15401 1 1094 . 1 1 95 95 ALA HB2 H 1 0.323 0.03 . 1 . . . . 95 ALA HB1 . 15401 1 1095 . 1 1 95 95 ALA HB3 H 1 0.323 0.03 . 1 . . . . 95 ALA HB1 . 15401 1 1096 . 1 1 95 95 ALA C C 13 176.686 0.30 . 1 . . . . 95 ALA C . 15401 1 1097 . 1 1 95 95 ALA CA C 13 50.109 0.30 . 1 . . . . 95 ALA CA . 15401 1 1098 . 1 1 95 95 ALA CB C 13 21.940 0.30 . 1 . . . . 95 ALA CB . 15401 1 1099 . 1 1 95 95 ALA N N 15 129.230 0.30 . 1 . . . . 95 ALA N . 15401 1 1100 . 1 1 96 96 LYS H H 1 9.286 0.03 . 1 . . . . 96 LYS HN . 15401 1 1101 . 1 1 96 96 LYS HA H 1 3.975 0.03 . 1 . . . . 96 LYS HA . 15401 1 1102 . 1 1 96 96 LYS HB2 H 1 1.760 0.03 . 2 . . . . 96 LYS HB1 . 15401 1 1103 . 1 1 96 96 LYS HB3 H 1 1.945 0.03 . 2 . . . . 96 LYS HB2 . 15401 1 1104 . 1 1 96 96 LYS HD2 H 1 1.746 0.03 . 2 . . . . 96 LYS HD2 . 15401 1 1105 . 1 1 96 96 LYS HE2 H 1 3.056 0.03 . 2 . . . . 96 LYS HE1 . 15401 1 1106 . 1 1 96 96 LYS HE3 H 1 3.129 0.03 . 2 . . . . 96 LYS HE2 . 15401 1 1107 . 1 1 96 96 LYS HG2 H 1 1.044 0.03 . 2 . . . . 96 LYS HG1 . 15401 1 1108 . 1 1 96 96 LYS HG3 H 1 1.553 0.03 . 2 . . . . 96 LYS HG2 . 15401 1 1109 . 1 1 96 96 LYS C C 13 178.504 0.30 . 1 . . . . 96 LYS C . 15401 1 1110 . 1 1 96 96 LYS CA C 13 57.566 0.30 . 1 . . . . 96 LYS CA . 15401 1 1111 . 1 1 96 96 LYS CB C 13 32.444 0.30 . 1 . . . . 96 LYS CB . 15401 1 1112 . 1 1 96 96 LYS CD C 13 29.628 0.30 . 1 . . . . 96 LYS CD . 15401 1 1113 . 1 1 96 96 LYS CE C 13 42.352 0.30 . 1 . . . . 96 LYS CE . 15401 1 1114 . 1 1 96 96 LYS CG C 13 26.717 0.30 . 1 . . . . 96 LYS CG . 15401 1 1115 . 1 1 96 96 LYS N N 15 123.397 0.30 . 1 . . . . 96 LYS N . 15401 1 1116 . 1 1 97 97 LEU H H 1 8.259 0.03 . 1 . . . . 97 LEU HN . 15401 1 1117 . 1 1 97 97 LEU HA H 1 4.024 0.03 . 1 . . . . 97 LEU HA . 15401 1 1118 . 1 1 97 97 LEU HB2 H 1 1.040 0.03 . 2 . . . . 97 LEU HB1 . 15401 1 1119 . 1 1 97 97 LEU HB3 H 1 1.596 0.03 . 2 . . . . 97 LEU HB2 . 15401 1 1120 . 1 1 97 97 LEU HD11 H 1 1.008 0.03 . 2 . . . . 97 LEU HD11 . 15401 1 1121 . 1 1 97 97 LEU HD12 H 1 1.008 0.03 . 2 . . . . 97 LEU HD11 . 15401 1 1122 . 1 1 97 97 LEU HD13 H 1 1.008 0.03 . 2 . . . . 97 LEU HD11 . 15401 1 1123 . 1 1 97 97 LEU HD21 H 1 1.777 0.03 . 2 . . . . 97 LEU HD21 . 15401 1 1124 . 1 1 97 97 LEU HD22 H 1 1.777 0.03 . 2 . . . . 97 LEU HD21 . 15401 1 1125 . 1 1 97 97 LEU HD23 H 1 1.777 0.03 . 2 . . . . 97 LEU HD21 . 15401 1 1126 . 1 1 97 97 LEU HG H 1 0.709 0.03 . 1 . . . . 97 LEU HG . 15401 1 1127 . 1 1 97 97 LEU C C 13 177.310 0.30 . 1 . . . . 97 LEU C . 15401 1 1128 . 1 1 97 97 LEU CA C 13 57.528 0.30 . 1 . . . . 97 LEU CA . 15401 1 1129 . 1 1 97 97 LEU CB C 13 41.959 0.30 . 1 . . . . 97 LEU CB . 15401 1 1130 . 1 1 97 97 LEU CD1 C 13 21.854 0.30 . 1 . . . . 97 LEU CD1 . 15401 1 1131 . 1 1 97 97 LEU CD2 C 13 27.192 0.30 . 1 . . . . 97 LEU CD2 . 15401 1 1132 . 1 1 97 97 LEU CG C 13 27.192 0.30 . 1 . . . . 97 LEU CG . 15401 1 1133 . 1 1 97 97 LEU N N 15 126.239 0.30 . 1 . . . . 97 LEU N . 15401 1 1134 . 1 1 98 98 SER H H 1 8.605 0.03 . 1 . . . . 98 SER HN . 15401 1 1135 . 1 1 98 98 SER HA H 1 4.206 0.03 . 1 . . . . 98 SER HA . 15401 1 1136 . 1 1 98 98 SER HB2 H 1 3.683 0.03 . 2 . . . . 98 SER HB1 . 15401 1 1137 . 1 1 98 98 SER HB3 H 1 4.102 0.03 . 2 . . . . 98 SER HB2 . 15401 1 1138 . 1 1 98 98 SER C C 13 174.891 0.30 . 1 . . . . 98 SER C . 15401 1 1139 . 1 1 98 98 SER CA C 13 60.222 0.30 . 1 . . . . 98 SER CA . 15401 1 1140 . 1 1 98 98 SER CB C 13 62.821 0.30 . 1 . . . . 98 SER CB . 15401 1 1141 . 1 1 98 98 SER N N 15 109.075 0.30 . 1 . . . . 98 SER N . 15401 1 1142 . 1 1 99 99 ASP H H 1 7.780 0.03 . 1 . . . . 99 ASP HN . 15401 1 1143 . 1 1 99 99 ASP HA H 1 5.146 0.03 . 1 . . . . 99 ASP HA . 15401 1 1144 . 1 1 99 99 ASP HB2 H 1 2.978 0.03 . 2 . . . . 99 ASP HB1 . 15401 1 1145 . 1 1 99 99 ASP HB3 H 1 3.599 0.03 . 2 . . . . 99 ASP HB2 . 15401 1 1146 . 1 1 99 99 ASP C C 13 174.431 0.30 . 1 . . . . 99 ASP C . 15401 1 1147 . 1 1 99 99 ASP CA C 13 54.767 0.30 . 1 . . . . 99 ASP CA . 15401 1 1148 . 1 1 99 99 ASP CB C 13 41.760 0.30 . 1 . . . . 99 ASP CB . 15401 1 1149 . 1 1 99 99 ASP N N 15 122.753 0.30 . 1 . . . . 99 ASP N . 15401 1 1150 . 1 1 100 100 ILE H H 1 7.734 0.03 . 1 . . . . 100 ILE HN . 15401 1 1151 . 1 1 100 100 ILE HA H 1 5.077 0.03 . 1 . . . . 100 ILE HA . 15401 1 1152 . 1 1 100 100 ILE HB H 1 2.325 0.03 . 1 . . . . 100 ILE HB . 15401 1 1153 . 1 1 100 100 ILE HD11 H 1 0.316 0.03 . 1 . . . . 100 ILE HD11 . 15401 1 1154 . 1 1 100 100 ILE HD12 H 1 0.316 0.03 . 1 . . . . 100 ILE HD11 . 15401 1 1155 . 1 1 100 100 ILE HD13 H 1 0.316 0.03 . 1 . . . . 100 ILE HD11 . 15401 1 1156 . 1 1 100 100 ILE HG12 H 1 1.156 0.03 . 1 . . . . 100 ILE HG11 . 15401 1 1157 . 1 1 100 100 ILE HG13 H 1 1.406 0.03 . 1 . . . . 100 ILE HG12 . 15401 1 1158 . 1 1 100 100 ILE HG21 H 1 0.699 0.03 . 1 . . . . 100 ILE HG21 . 15401 1 1159 . 1 1 100 100 ILE HG22 H 1 0.699 0.03 . 1 . . . . 100 ILE HG21 . 15401 1 1160 . 1 1 100 100 ILE HG23 H 1 0.699 0.03 . 1 . . . . 100 ILE HG21 . 15401 1 1161 . 1 1 100 100 ILE C C 13 175.443 0.30 . 1 . . . . 100 ILE C . 15401 1 1162 . 1 1 100 100 ILE CA C 13 58.250 0.30 . 1 . . . . 100 ILE CA . 15401 1 1163 . 1 1 100 100 ILE CB C 13 38.692 0.30 . 1 . . . . 100 ILE CB . 15401 1 1164 . 1 1 100 100 ILE CD1 C 13 11.177 0.30 . 1 . . . . 100 ILE CD1 . 15401 1 1165 . 1 1 100 100 ILE CG1 C 13 26.757 0.30 . 1 . . . . 100 ILE CG1 . 15401 1 1166 . 1 1 100 100 ILE CG2 C 13 17.096 0.30 . 1 . . . . 100 ILE CG2 . 15401 1 1167 . 1 1 100 100 ILE N N 15 121.614 0.30 . 1 . . . . 100 ILE N . 15401 1 1168 . 1 1 101 101 GLU H H 1 8.997 0.03 . 1 . . . . 101 GLU HN . 15401 1 1169 . 1 1 101 101 GLU HA H 1 4.745 0.03 . 1 . . . . 101 GLU HA . 15401 1 1170 . 1 1 101 101 GLU HB2 H 1 1.952 0.03 . 2 . . . . 101 GLU HB1 . 15401 1 1171 . 1 1 101 101 GLU HB3 H 1 2.070 0.03 . 2 . . . . 101 GLU HB2 . 15401 1 1172 . 1 1 101 101 GLU HG2 H 1 2.154 0.03 . 2 . . . . 101 GLU HG1 . 15401 1 1173 . 1 1 101 101 GLU HG3 H 1 2.295 0.03 . 2 . . . . 101 GLU HG2 . 15401 1 1174 . 1 1 101 101 GLU C C 13 175.600 0.30 . 1 . . . . 101 GLU C . 15401 1 1175 . 1 1 101 101 GLU CA C 13 54.305 0.30 . 1 . . . . 101 GLU CA . 15401 1 1176 . 1 1 101 101 GLU CB C 13 31.723 0.30 . 1 . . . . 101 GLU CB . 15401 1 1177 . 1 1 101 101 GLU CG C 13 36.162 0.30 . 1 . . . . 101 GLU CG . 15401 1 1178 . 1 1 101 101 GLU N N 15 128.195 0.30 . 1 . . . . 101 GLU N . 15401 1 1179 . 1 1 102 102 ALA H H 1 9.114 0.03 . 1 . . . . 102 ALA HN . 15401 1 1180 . 1 1 102 102 ALA HA H 1 4.562 0.03 . 1 . . . . 102 ALA HA . 15401 1 1181 . 1 1 102 102 ALA HB1 H 1 1.166 0.03 . 1 . . . . 102 ALA HB1 . 15401 1 1182 . 1 1 102 102 ALA HB2 H 1 1.166 0.03 . 1 . . . . 102 ALA HB1 . 15401 1 1183 . 1 1 102 102 ALA HB3 H 1 1.166 0.03 . 1 . . . . 102 ALA HB1 . 15401 1 1184 . 1 1 102 102 ALA C C 13 177.096 0.30 . 1 . . . . 102 ALA C . 15401 1 1185 . 1 1 102 102 ALA CA C 13 52.733 0.30 . 1 . . . . 102 ALA CA . 15401 1 1186 . 1 1 102 102 ALA CB C 13 20.886 0.30 . 1 . . . . 102 ALA CB . 15401 1 1187 . 1 1 102 102 ALA N N 15 130.836 0.30 . 1 . . . . 102 ALA N . 15401 1 1188 . 1 1 103 103 ILE H H 1 8.659 0.03 . 1 . . . . 103 ILE HN . 15401 1 1189 . 1 1 103 103 ILE HA H 1 4.240 0.03 . 1 . . . . 103 ILE HA . 15401 1 1190 . 1 1 103 103 ILE HB H 1 1.586 0.03 . 1 . . . . 103 ILE HB . 15401 1 1191 . 1 1 103 103 ILE HD11 H 1 0.794 0.03 . 1 . . . . 103 ILE HD11 . 15401 1 1192 . 1 1 103 103 ILE HD12 H 1 0.794 0.03 . 1 . . . . 103 ILE HD11 . 15401 1 1193 . 1 1 103 103 ILE HD13 H 1 0.794 0.03 . 1 . . . . 103 ILE HD11 . 15401 1 1194 . 1 1 103 103 ILE HG12 H 1 1.081 0.03 . 1 . . . . 103 ILE HG11 . 15401 1 1195 . 1 1 103 103 ILE HG13 H 1 1.551 0.03 . 1 . . . . 103 ILE HG12 . 15401 1 1196 . 1 1 103 103 ILE HG21 H 1 0.889 0.03 . 1 . . . . 103 ILE HG21 . 15401 1 1197 . 1 1 103 103 ILE HG22 H 1 0.889 0.03 . 1 . . . . 103 ILE HG21 . 15401 1 1198 . 1 1 103 103 ILE HG23 H 1 0.889 0.03 . 1 . . . . 103 ILE HG21 . 15401 1 1199 . 1 1 103 103 ILE C C 13 174.193 0.30 . 1 . . . . 103 ILE C . 15401 1 1200 . 1 1 103 103 ILE CA C 13 60.697 0.30 . 1 . . . . 103 ILE CA . 15401 1 1201 . 1 1 103 103 ILE CB C 13 40.322 0.30 . 1 . . . . 103 ILE CB . 15401 1 1202 . 1 1 103 103 ILE CD1 C 13 13.555 0.30 . 1 . . . . 103 ILE CD1 . 15401 1 1203 . 1 1 103 103 ILE CG1 C 13 27.162 0.30 . 1 . . . . 103 ILE CG1 . 15401 1 1204 . 1 1 103 103 ILE CG2 C 13 17.321 0.30 . 1 . . . . 103 ILE CG2 . 15401 1 1205 . 1 1 103 103 ILE N N 15 123.693 0.30 . 1 . . . . 103 ILE N . 15401 1 1206 . 1 1 104 104 ASP H H 1 8.671 0.03 . 1 . . . . 104 ASP HN . 15401 1 1207 . 1 1 104 104 ASP HA H 1 4.364 0.03 . 1 . . . . 104 ASP HA . 15401 1 1208 . 1 1 104 104 ASP HB2 H 1 2.659 0.03 . 2 . . . . 104 ASP HB1 . 15401 1 1209 . 1 1 104 104 ASP HB3 H 1 2.944 0.03 . 2 . . . . 104 ASP HB2 . 15401 1 1210 . 1 1 104 104 ASP C C 13 175.041 0.30 . 1 . . . . 104 ASP C . 15401 1 1211 . 1 1 104 104 ASP CA C 13 55.264 0.30 . 1 . . . . 104 ASP CA . 15401 1 1212 . 1 1 104 104 ASP CB C 13 39.442 0.30 . 1 . . . . 104 ASP CB . 15401 1 1213 . 1 1 104 104 ASP N N 15 124.341 0.30 . 1 . . . . 104 ASP N . 15401 1 1214 . 1 1 105 105 VAL H H 1 7.542 0.03 . 1 . . . . 105 VAL HN . 15401 1 1215 . 1 1 105 105 VAL HA H 1 4.718 0.03 . 1 . . . . 105 VAL HA . 15401 1 1216 . 1 1 105 105 VAL HB H 1 1.958 0.03 . 1 . . . . 105 VAL HB . 15401 1 1217 . 1 1 105 105 VAL HG11 H 1 0.560 0.03 . 2 . . . . 105 VAL HG11 . 15401 1 1218 . 1 1 105 105 VAL HG12 H 1 0.560 0.03 . 2 . . . . 105 VAL HG11 . 15401 1 1219 . 1 1 105 105 VAL HG13 H 1 0.560 0.03 . 2 . . . . 105 VAL HG11 . 15401 1 1220 . 1 1 105 105 VAL HG21 H 1 0.633 0.03 . 2 . . . . 105 VAL HG21 . 15401 1 1221 . 1 1 105 105 VAL HG22 H 1 0.633 0.03 . 2 . . . . 105 VAL HG21 . 15401 1 1222 . 1 1 105 105 VAL HG23 H 1 0.633 0.03 . 2 . . . . 105 VAL HG21 . 15401 1 1223 . 1 1 105 105 VAL C C 13 176.080 0.30 . 1 . . . . 105 VAL C . 15401 1 1224 . 1 1 105 105 VAL CA C 13 59.269 0.30 . 1 . . . . 105 VAL CA . 15401 1 1225 . 1 1 105 105 VAL CB C 13 34.612 0.30 . 1 . . . . 105 VAL CB . 15401 1 1226 . 1 1 105 105 VAL CG1 C 13 18.691 0.30 . 1 . . . . 105 VAL CG1 . 15401 1 1227 . 1 1 105 105 VAL CG2 C 13 23.171 0.30 . 1 . . . . 105 VAL CG2 . 15401 1 1228 . 1 1 105 105 VAL N N 15 109.652 0.30 . 1 . . . . 105 VAL N . 15401 1 1229 . 1 1 106 106 ASP H H 1 8.226 0.03 . 1 . . . . 106 ASP HN . 15401 1 1230 . 1 1 106 106 ASP HA H 1 4.594 0.03 . 1 . . . . 106 ASP HA . 15401 1 1231 . 1 1 106 106 ASP HB2 H 1 2.742 0.03 . 2 . . . . 106 ASP HB1 . 15401 1 1232 . 1 1 106 106 ASP HB3 H 1 2.935 0.03 . 2 . . . . 106 ASP HB2 . 15401 1 1233 . 1 1 106 106 ASP C C 13 175.646 0.30 . 1 . . . . 106 ASP C . 15401 1 1234 . 1 1 106 106 ASP CA C 13 53.266 0.30 . 1 . . . . 106 ASP CA . 15401 1 1235 . 1 1 106 106 ASP CB C 13 42.056 0.30 . 1 . . . . 106 ASP CB . 15401 1 1236 . 1 1 106 106 ASP N N 15 120.200 0.30 . 1 . . . . 106 ASP N . 15401 1 1237 . 1 1 107 107 ASP H H 1 8.556 0.03 . 1 . . . . 107 ASP HN . 15401 1 1238 . 1 1 107 107 ASP HA H 1 4.246 0.03 . 1 . . . . 107 ASP HA . 15401 1 1239 . 1 1 107 107 ASP HB2 H 1 2.584 0.03 . 2 . . . . 107 ASP HB1 . 15401 1 1240 . 1 1 107 107 ASP HB3 H 1 2.706 0.03 . 2 . . . . 107 ASP HB2 . 15401 1 1241 . 1 1 107 107 ASP C C 13 178.049 0.30 . 1 . . . . 107 ASP C . 15401 1 1242 . 1 1 107 107 ASP CA C 13 57.937 0.30 . 1 . . . . 107 ASP CA . 15401 1 1243 . 1 1 107 107 ASP CB C 13 40.819 0.30 . 1 . . . . 107 ASP CB . 15401 1 1244 . 1 1 107 107 ASP N N 15 119.660 0.30 . 1 . . . . 107 ASP N . 15401 1 1245 . 1 1 108 108 ASP H H 1 8.240 0.03 . 1 . . . . 108 ASP HN . 15401 1 1246 . 1 1 108 108 ASP HA H 1 4.352 0.03 . 1 . . . . 108 ASP HA . 15401 1 1247 . 1 1 108 108 ASP HB2 H 1 2.481 0.03 . 2 . . . . 108 ASP HB1 . 15401 1 1248 . 1 1 108 108 ASP HB3 H 1 2.755 0.03 . 2 . . . . 108 ASP HB2 . 15401 1 1249 . 1 1 108 108 ASP C C 13 178.759 0.30 . 1 . . . . 108 ASP C . 15401 1 1250 . 1 1 108 108 ASP CA C 13 57.670 0.30 . 1 . . . . 108 ASP CA . 15401 1 1251 . 1 1 108 108 ASP CB C 13 39.998 0.30 . 1 . . . . 108 ASP CB . 15401 1 1252 . 1 1 108 108 ASP N N 15 120.373 0.30 . 1 . . . . 108 ASP N . 15401 1 1253 . 1 1 109 109 THR H H 1 7.996 0.03 . 1 . . . . 109 THR HN . 15401 1 1254 . 1 1 109 109 THR HA H 1 3.600 0.03 . 1 . . . . 109 THR HA . 15401 1 1255 . 1 1 109 109 THR HB H 1 3.831 0.03 . 1 . . . . 109 THR HB . 15401 1 1256 . 1 1 109 109 THR HG21 H 1 0.472 0.03 . 1 . . . . 109 THR HG21 . 15401 1 1257 . 1 1 109 109 THR HG22 H 1 0.472 0.03 . 1 . . . . 109 THR HG21 . 15401 1 1258 . 1 1 109 109 THR HG23 H 1 0.472 0.03 . 1 . . . . 109 THR HG21 . 15401 1 1259 . 1 1 109 109 THR C C 13 175.440 0.30 . 1 . . . . 109 THR C . 15401 1 1260 . 1 1 109 109 THR CA C 13 67.292 0.30 . 1 . . . . 109 THR CA . 15401 1 1261 . 1 1 109 109 THR CB C 13 68.150 0.30 . 1 . . . . 109 THR CB . 15401 1 1262 . 1 1 109 109 THR CG2 C 13 21.442 0.30 . 1 . . . . 109 THR CG2 . 15401 1 1263 . 1 1 109 109 THR N N 15 120.999 0.30 . 1 . . . . 109 THR N . 15401 1 1264 . 1 1 110 110 GLN H H 1 7.826 0.03 . 1 . . . . 110 GLN HN . 15401 1 1265 . 1 1 110 110 GLN HA H 1 3.740 0.03 . 1 . . . . 110 GLN HA . 15401 1 1266 . 1 1 110 110 GLN HB2 H 1 1.986 0.03 . 2 . . . . 110 GLN HB1 . 15401 1 1267 . 1 1 110 110 GLN HB3 H 1 2.072 0.03 . 2 . . . . 110 GLN HB2 . 15401 1 1268 . 1 1 110 110 GLN HE21 H 1 7.346 0.03 . 2 . . . . 110 GLN HE21 . 15401 1 1269 . 1 1 110 110 GLN HE22 H 1 6.750 0.03 . 2 . . . . 110 GLN HE22 . 15401 1 1270 . 1 1 110 110 GLN HG2 H 1 2.294 0.03 . 2 . . . . 110 GLN HG2 . 15401 1 1271 . 1 1 110 110 GLN C C 13 178.747 0.30 . 1 . . . . 110 GLN C . 15401 1 1272 . 1 1 110 110 GLN CA C 13 59.158 0.30 . 1 . . . . 110 GLN CA . 15401 1 1273 . 1 1 110 110 GLN CB C 13 28.989 0.30 . 1 . . . . 110 GLN CB . 15401 1 1274 . 1 1 110 110 GLN CG C 13 33.800 0.30 . 1 . . . . 110 GLN CG . 15401 1 1275 . 1 1 110 110 GLN N N 15 119.068 0.30 . 1 . . . . 110 GLN N . 15401 1 1276 . 1 1 110 110 GLN NE2 N 15 111.972 0.30 . 1 . . . . 110 GLN NE2 . 15401 1 1277 . 1 1 111 111 GLU H H 1 8.307 0.03 . 1 . . . . 111 GLU HN . 15401 1 1278 . 1 1 111 111 GLU HA H 1 4.322 0.03 . 1 . . . . 111 GLU HA . 15401 1 1279 . 1 1 111 111 GLU HB2 H 1 2.106 0.03 . 2 . . . . 111 GLU HB2 . 15401 1 1280 . 1 1 111 111 GLU HG2 H 1 2.268 0.03 . 2 . . . . 111 GLU HG2 . 15401 1 1281 . 1 1 111 111 GLU C C 13 177.496 0.30 . 1 . . . . 111 GLU C . 15401 1 1282 . 1 1 111 111 GLU CA C 13 58.712 0.30 . 1 . . . . 111 GLU CA . 15401 1 1283 . 1 1 111 111 GLU CB C 13 30.186 0.30 . 1 . . . . 111 GLU CB . 15401 1 1284 . 1 1 111 111 GLU CG C 13 36.370 0.30 . 1 . . . . 111 GLU CG . 15401 1 1285 . 1 1 111 111 GLU N N 15 119.732 0.30 . 1 . . . . 111 GLU N . 15401 1 1286 . 1 1 112 112 ALA H H 1 7.607 0.03 . 1 . . . . 112 ALA HN . 15401 1 1287 . 1 1 112 112 ALA HA H 1 4.624 0.03 . 1 . . . . 112 ALA HA . 15401 1 1288 . 1 1 112 112 ALA HB1 H 1 1.358 0.03 . 1 . . . . 112 ALA HB1 . 15401 1 1289 . 1 1 112 112 ALA HB2 H 1 1.358 0.03 . 1 . . . . 112 ALA HB1 . 15401 1 1290 . 1 1 112 112 ALA HB3 H 1 1.358 0.03 . 1 . . . . 112 ALA HB1 . 15401 1 1291 . 1 1 112 112 ALA C C 13 179.991 0.30 . 1 . . . . 112 ALA C . 15401 1 1292 . 1 1 112 112 ALA CA C 13 55.223 0.30 . 1 . . . . 112 ALA CA . 15401 1 1293 . 1 1 112 112 ALA CB C 13 18.483 0.30 . 1 . . . . 112 ALA CB . 15401 1 1294 . 1 1 112 112 ALA N N 15 122.162 0.30 . 1 . . . . 112 ALA N . 15401 1 1295 . 1 1 113 113 ILE H H 1 7.690 0.03 . 1 . . . . 113 ILE HN . 15401 1 1296 . 1 1 113 113 ILE HA H 1 3.710 0.03 . 1 . . . . 113 ILE HA . 15401 1 1297 . 1 1 113 113 ILE HB H 1 1.868 0.03 . 1 . . . . 113 ILE HB . 15401 1 1298 . 1 1 113 113 ILE HD11 H 1 0.650 0.03 . 1 . . . . 113 ILE HD11 . 15401 1 1299 . 1 1 113 113 ILE HD12 H 1 0.650 0.03 . 1 . . . . 113 ILE HD11 . 15401 1 1300 . 1 1 113 113 ILE HD13 H 1 0.650 0.03 . 1 . . . . 113 ILE HD11 . 15401 1 1301 . 1 1 113 113 ILE HG12 H 1 2.018 0.03 . 1 . . . . 113 ILE HG11 . 15401 1 1302 . 1 1 113 113 ILE HG13 H 1 0.798 0.03 . 1 . . . . 113 ILE HG12 . 15401 1 1303 . 1 1 113 113 ILE HG21 H 1 1.054 0.03 . 1 . . . . 113 ILE HG21 . 15401 1 1304 . 1 1 113 113 ILE HG22 H 1 1.054 0.03 . 1 . . . . 113 ILE HG21 . 15401 1 1305 . 1 1 113 113 ILE HG23 H 1 1.054 0.03 . 1 . . . . 113 ILE HG21 . 15401 1 1306 . 1 1 113 113 ILE C C 13 178.160 0.30 . 1 . . . . 113 ILE C . 15401 1 1307 . 1 1 113 113 ILE CA C 13 66.758 0.30 . 1 . . . . 113 ILE CA . 15401 1 1308 . 1 1 113 113 ILE CB C 13 38.312 0.30 . 1 . . . . 113 ILE CB . 15401 1 1309 . 1 1 113 113 ILE CD1 C 13 13.926 0.30 . 1 . . . . 113 ILE CD1 . 15401 1 1310 . 1 1 113 113 ILE CG1 C 13 30.510 0.30 . 1 . . . . 113 ILE CG1 . 15401 1 1311 . 1 1 113 113 ILE CG2 C 13 17.291 0.30 . 1 . . . . 113 ILE CG2 . 15401 1 1312 . 1 1 113 113 ILE N N 15 117.337 0.30 . 1 . . . . 113 ILE N . 15401 1 1313 . 1 1 114 114 ALA H H 1 8.410 0.03 . 1 . . . . 114 ALA HN . 15401 1 1314 . 1 1 114 114 ALA HA H 1 4.160 0.03 . 1 . . . . 114 ALA HA . 15401 1 1315 . 1 1 114 114 ALA HB1 H 1 1.579 0.03 . 1 . . . . 114 ALA HB1 . 15401 1 1316 . 1 1 114 114 ALA HB2 H 1 1.579 0.03 . 1 . . . . 114 ALA HB1 . 15401 1 1317 . 1 1 114 114 ALA HB3 H 1 1.579 0.03 . 1 . . . . 114 ALA HB1 . 15401 1 1318 . 1 1 114 114 ALA C C 13 181.363 0.30 . 1 . . . . 114 ALA C . 15401 1 1319 . 1 1 114 114 ALA CA C 13 55.501 0.30 . 1 . . . . 114 ALA CA . 15401 1 1320 . 1 1 114 114 ALA CB C 13 17.938 0.30 . 1 . . . . 114 ALA CB . 15401 1 1321 . 1 1 114 114 ALA N N 15 121.759 0.30 . 1 . . . . 114 ALA N . 15401 1 1322 . 1 1 115 115 ASP H H 1 9.025 0.03 . 1 . . . . 115 ASP HN . 15401 1 1323 . 1 1 115 115 ASP HA H 1 4.750 0.03 . 1 . . . . 115 ASP HA . 15401 1 1324 . 1 1 115 115 ASP HB2 H 1 2.971 0.03 . 2 . . . . 115 ASP HB1 . 15401 1 1325 . 1 1 115 115 ASP HB3 H 1 3.714 0.03 . 2 . . . . 115 ASP HB2 . 15401 1 1326 . 1 1 115 115 ASP C C 13 177.746 0.30 . 1 . . . . 115 ASP C . 15401 1 1327 . 1 1 115 115 ASP CA C 13 58.814 0.30 . 1 . . . . 115 ASP CA . 15401 1 1328 . 1 1 115 115 ASP CB C 13 39.869 0.30 . 1 . . . . 115 ASP CB . 15401 1 1329 . 1 1 115 115 ASP N N 15 123.603 0.30 . 1 . . . . 115 ASP N . 15401 1 1330 . 1 1 116 116 TRP H H 1 8.112 0.03 . 1 . . . . 116 TRP HN . 15401 1 1331 . 1 1 116 116 TRP HA H 1 4.551 0.03 . 1 . . . . 116 TRP HA . 15401 1 1332 . 1 1 116 116 TRP HB2 H 1 3.430 0.03 . 2 . . . . 116 TRP HB1 . 15401 1 1333 . 1 1 116 116 TRP HB3 H 1 3.569 0.03 . 2 . . . . 116 TRP HB2 . 15401 1 1334 . 1 1 116 116 TRP HD1 H 1 6.562 0.03 . 1 . . . . 116 TRP HD1 . 15401 1 1335 . 1 1 116 116 TRP HE1 H 1 10.193 0.03 . 1 . . . . 116 TRP HE1 . 15401 1 1336 . 1 1 116 116 TRP HZ2 H 1 7.944 0.03 . 1 . . . . 116 TRP HZ2 . 15401 1 1337 . 1 1 116 116 TRP C C 13 176.835 0.30 . 1 . . . . 116 TRP C . 15401 1 1338 . 1 1 116 116 TRP CA C 13 58.824 0.30 . 1 . . . . 116 TRP CA . 15401 1 1339 . 1 1 116 116 TRP CB C 13 30.134 0.30 . 1 . . . . 116 TRP CB . 15401 1 1340 . 1 1 116 116 TRP CD1 C 13 123.340 0.30 . 1 . . . . 116 TRP CD1 . 15401 1 1341 . 1 1 116 116 TRP CZ2 C 13 114.399 0.30 . 1 . . . . 116 TRP CZ2 . 15401 1 1342 . 1 1 116 116 TRP N N 15 124.079 0.30 . 1 . . . . 116 TRP N . 15401 1 1343 . 1 1 116 116 TRP NE1 N 15 126.472 0.30 . 1 . . . . 116 TRP NE1 . 15401 1 1344 . 1 1 117 117 LEU H H 1 8.800 0.03 . 1 . . . . 117 LEU HN . 15401 1 1345 . 1 1 117 117 LEU HA H 1 3.695 0.03 . 1 . . . . 117 LEU HA . 15401 1 1346 . 1 1 117 117 LEU HB2 H 1 1.930 0.03 . 2 . . . . 117 LEU HB1 . 15401 1 1347 . 1 1 117 117 LEU HB3 H 1 1.493 0.03 . 2 . . . . 117 LEU HB2 . 15401 1 1348 . 1 1 117 117 LEU HD11 H 1 1.012 0.03 . 2 . . . . 117 LEU HD11 . 15401 1 1349 . 1 1 117 117 LEU HD12 H 1 1.012 0.03 . 2 . . . . 117 LEU HD11 . 15401 1 1350 . 1 1 117 117 LEU HD13 H 1 1.012 0.03 . 2 . . . . 117 LEU HD11 . 15401 1 1351 . 1 1 117 117 LEU HD21 H 1 0.911 0.03 . 2 . . . . 117 LEU HD21 . 15401 1 1352 . 1 1 117 117 LEU HD22 H 1 0.911 0.03 . 2 . . . . 117 LEU HD21 . 15401 1 1353 . 1 1 117 117 LEU HD23 H 1 0.911 0.03 . 2 . . . . 117 LEU HD21 . 15401 1 1354 . 1 1 117 117 LEU HG H 1 2.085 0.03 . 1 . . . . 117 LEU HG . 15401 1 1355 . 1 1 117 117 LEU C C 13 180.425 0.30 . 1 . . . . 117 LEU C . 15401 1 1356 . 1 1 117 117 LEU CA C 13 57.886 0.30 . 1 . . . . 117 LEU CA . 15401 1 1357 . 1 1 117 117 LEU CB C 13 40.929 0.30 . 1 . . . . 117 LEU CB . 15401 1 1358 . 1 1 117 117 LEU CD1 C 13 25.580 0.30 . 1 . . . . 117 LEU CD1 . 15401 1 1359 . 1 1 117 117 LEU CD2 C 13 22.404 0.30 . 1 . . . . 117 LEU CD2 . 15401 1 1360 . 1 1 117 117 LEU CG C 13 27.192 0.30 . 1 . . . . 117 LEU CG . 15401 1 1361 . 1 1 117 117 LEU N N 15 117.465 0.30 . 1 . . . . 117 LEU N . 15401 1 1362 . 1 1 118 118 TYR H H 1 8.447 0.03 . 1 . . . . 118 TYR HN . 15401 1 1363 . 1 1 118 118 TYR HA H 1 4.200 0.03 . 1 . . . . 118 TYR HA . 15401 1 1364 . 1 1 118 118 TYR HB2 H 1 3.575 0.03 . 2 . . . . 118 TYR HB1 . 15401 1 1365 . 1 1 118 118 TYR HB3 H 1 3.167 0.03 . 2 . . . . 118 TYR HB2 . 15401 1 1366 . 1 1 118 118 TYR HD1 H 1 7.272 0.03 . 3 . . . . 118 TYR HD1 . 15401 1 1367 . 1 1 118 118 TYR C C 13 180.438 0.30 . 1 . . . . 118 TYR C . 15401 1 1368 . 1 1 118 118 TYR CA C 13 61.614 0.30 . 1 . . . . 118 TYR CA . 15401 1 1369 . 1 1 118 118 TYR CB C 13 38.729 0.30 . 1 . . . . 118 TYR CB . 15401 1 1370 . 1 1 118 118 TYR CD1 C 13 133.696 0.30 . 3 . . . . 118 TYR CD1 . 15401 1 1371 . 1 1 118 118 TYR N N 15 123.412 0.30 . 1 . . . . 118 TYR N . 15401 1 1372 . 1 1 119 119 TRP H H 1 8.435 0.03 . 1 . . . . 119 TRP HN . 15401 1 1373 . 1 1 119 119 TRP HA H 1 3.837 0.03 . 1 . . . . 119 TRP HA . 15401 1 1374 . 1 1 119 119 TRP HB2 H 1 3.477 0.03 . 2 . . . . 119 TRP HB1 . 15401 1 1375 . 1 1 119 119 TRP HB3 H 1 3.528 0.03 . 2 . . . . 119 TRP HB2 . 15401 1 1376 . 1 1 119 119 TRP HD1 H 1 5.790 0.03 . 1 . . . . 119 TRP HD1 . 15401 1 1377 . 1 1 119 119 TRP HE1 H 1 9.607 0.03 . 1 . . . . 119 TRP HE1 . 15401 1 1378 . 1 1 119 119 TRP HZ2 H 1 7.112 0.03 . 1 . . . . 119 TRP HZ2 . 15401 1 1379 . 1 1 119 119 TRP C C 13 177.342 0.30 . 1 . . . . 119 TRP C . 15401 1 1380 . 1 1 119 119 TRP CA C 13 61.103 0.30 . 1 . . . . 119 TRP CA . 15401 1 1381 . 1 1 119 119 TRP CB C 13 28.245 0.30 . 1 . . . . 119 TRP CB . 15401 1 1382 . 1 1 119 119 TRP CD1 C 13 130.778 0.30 . 1 . . . . 119 TRP CD1 . 15401 1 1383 . 1 1 119 119 TRP CZ2 C 13 114.666 0.30 . 1 . . . . 119 TRP CZ2 . 15401 1 1384 . 1 1 119 119 TRP N N 15 123.400 0.30 . 1 . . . . 119 TRP N . 15401 1 1385 . 1 1 119 119 TRP NE1 N 15 132.589 0.30 . 1 . . . . 119 TRP NE1 . 15401 1 1386 . 1 1 120 120 LEU H H 1 7.557 0.03 . 1 . . . . 120 LEU HN . 15401 1 1387 . 1 1 120 120 LEU HA H 1 3.638 0.03 . 1 . . . . 120 LEU HA . 15401 1 1388 . 1 1 120 120 LEU HB2 H 1 1.032 0.03 . 2 . . . . 120 LEU HB1 . 15401 1 1389 . 1 1 120 120 LEU HB3 H 1 1.490 0.03 . 2 . . . . 120 LEU HB2 . 15401 1 1390 . 1 1 120 120 LEU HD11 H 1 0.499 0.03 . 2 . . . . 120 LEU HD11 . 15401 1 1391 . 1 1 120 120 LEU HD12 H 1 0.499 0.03 . 2 . . . . 120 LEU HD11 . 15401 1 1392 . 1 1 120 120 LEU HD13 H 1 0.499 0.03 . 2 . . . . 120 LEU HD11 . 15401 1 1393 . 1 1 120 120 LEU HD21 H 1 0.487 0.03 . 2 . . . . 120 LEU HD21 . 15401 1 1394 . 1 1 120 120 LEU HD22 H 1 0.487 0.03 . 2 . . . . 120 LEU HD21 . 15401 1 1395 . 1 1 120 120 LEU HD23 H 1 0.487 0.03 . 2 . . . . 120 LEU HD21 . 15401 1 1396 . 1 1 120 120 LEU C C 13 181.853 0.30 . 1 . . . . 120 LEU C . 15401 1 1397 . 1 1 120 120 LEU CA C 13 56.725 0.30 . 1 . . . . 120 LEU CA . 15401 1 1398 . 1 1 120 120 LEU CB C 13 42.005 0.30 . 1 . . . . 120 LEU CB . 15401 1 1399 . 1 1 120 120 LEU CD1 C 13 22.041 0.30 . 1 . . . . 120 LEU CD1 . 15401 1 1400 . 1 1 120 120 LEU CD2 C 13 26.151 0.30 . 1 . . . . 120 LEU CD2 . 15401 1 1401 . 1 1 120 120 LEU CG C 13 26.225 0.30 . 1 . . . . 120 LEU CG . 15401 1 1402 . 1 1 120 120 LEU N N 15 116.020 0.30 . 1 . . . . 120 LEU N . 15401 1 1403 . 1 1 121 121 ALA H H 1 8.418 0.03 . 1 . . . . 121 ALA HN . 15401 1 1404 . 1 1 121 121 ALA HA H 1 3.899 0.03 . 1 . . . . 121 ALA HA . 15401 1 1405 . 1 1 121 121 ALA HB1 H 1 1.375 0.03 . 1 . . . . 121 ALA HB1 . 15401 1 1406 . 1 1 121 121 ALA HB2 H 1 1.375 0.03 . 1 . . . . 121 ALA HB1 . 15401 1 1407 . 1 1 121 121 ALA HB3 H 1 1.375 0.03 . 1 . . . . 121 ALA HB1 . 15401 1 1408 . 1 1 121 121 ALA C C 13 180.025 0.30 . 1 . . . . 121 ALA C . 15401 1 1409 . 1 1 121 121 ALA CA C 13 54.612 0.30 . 1 . . . . 121 ALA CA . 15401 1 1410 . 1 1 121 121 ALA CB C 13 18.709 0.30 . 1 . . . . 121 ALA CB . 15401 1 1411 . 1 1 121 121 ALA N N 15 125.944 0.30 . 1 . . . . 121 ALA N . 15401 1 1412 . 1 1 122 122 ARG H H 1 7.778 0.03 . 1 . . . . 122 ARG HN . 15401 1 1413 . 1 1 122 122 ARG HA H 1 3.521 0.03 . 1 . . . . 122 ARG HA . 15401 1 1414 . 1 1 122 122 ARG HB2 H 1 0.370 0.03 . 2 . . . . 122 ARG HB1 . 15401 1 1415 . 1 1 122 122 ARG HB3 H 1 0.516 0.03 . 2 . . . . 122 ARG HB2 . 15401 1 1416 . 1 1 122 122 ARG HD2 H 1 2.692 0.03 . 2 . . . . 122 ARG HD2 . 15401 1 1417 . 1 1 122 122 ARG HG2 H 1 0.805 0.03 . 2 . . . . 122 ARG HG2 . 15401 1 1418 . 1 1 122 122 ARG C C 13 176.315 0.30 . 1 . . . . 122 ARG C . 15401 1 1419 . 1 1 122 122 ARG CA C 13 54.089 0.30 . 1 . . . . 122 ARG CA . 15401 1 1420 . 1 1 122 122 ARG CB C 13 26.274 0.30 . 1 . . . . 122 ARG CB . 15401 1 1421 . 1 1 122 122 ARG CD C 13 40.607 0.30 . 1 . . . . 122 ARG CD . 15401 1 1422 . 1 1 122 122 ARG CG C 13 24.738 0.30 . 1 . . . . 122 ARG CG . 15401 1 1423 . 1 1 122 122 ARG N N 15 117.239 0.30 . 1 . . . . 122 ARG N . 15401 1 1424 . 1 1 123 123 GLY H H 1 7.446 0.03 . 1 . . . . 123 GLY HN . 15401 1 1425 . 1 1 123 123 GLY HA2 H 1 3.418 0.03 . 2 . . . . 123 GLY HA1 . 15401 1 1426 . 1 1 123 123 GLY HA3 H 1 3.717 0.03 . 2 . . . . 123 GLY HA2 . 15401 1 1427 . 1 1 123 123 GLY C C 13 174.810 0.30 . 1 . . . . 123 GLY C . 15401 1 1428 . 1 1 123 123 GLY CA C 13 45.118 0.30 . 1 . . . . 123 GLY CA . 15401 1 1429 . 1 1 123 123 GLY N N 15 106.810 0.30 . 1 . . . . 123 GLY N . 15401 1 1430 . 1 1 124 124 TYR H H 1 6.555 0.03 . 1 . . . . 124 TYR HN . 15401 1 1431 . 1 1 124 124 TYR HA H 1 4.218 0.03 . 1 . . . . 124 TYR HA . 15401 1 1432 . 1 1 124 124 TYR HB2 H 1 0.621 0.03 . 2 . . . . 124 TYR HB1 . 15401 1 1433 . 1 1 124 124 TYR HB3 H 1 0.921 0.03 . 2 . . . . 124 TYR HB2 . 15401 1 1434 . 1 1 124 124 TYR HD1 H 1 6.650 0.03 . 3 . . . . 124 TYR HD1 . 15401 1 1435 . 1 1 124 124 TYR HE1 H 1 6.796 0.03 . 3 . . . . 124 TYR HE1 . 15401 1 1436 . 1 1 124 124 TYR C C 13 174.237 0.30 . 1 . . . . 124 TYR C . 15401 1 1437 . 1 1 124 124 TYR CA C 13 54.472 0.30 . 1 . . . . 124 TYR CA . 15401 1 1438 . 1 1 124 124 TYR CB C 13 33.616 0.30 . 1 . . . . 124 TYR CB . 15401 1 1439 . 1 1 124 124 TYR CD1 C 13 132.106 0.30 . 3 . . . . 124 TYR CD1 . 15401 1 1440 . 1 1 124 124 TYR CE1 C 13 116.699 0.30 . 3 . . . . 124 TYR CE1 . 15401 1 1441 . 1 1 124 124 TYR N N 15 120.243 0.30 . 1 . . . . 124 TYR N . 15401 1 1442 . 1 1 125 125 LYS H H 1 7.824 0.03 . 1 . . . . 125 LYS HN . 15401 1 1443 . 1 1 125 125 LYS HA H 1 4.677 0.03 . 1 . . . . 125 LYS HA . 15401 1 1444 . 1 1 125 125 LYS HB2 H 1 1.619 0.03 . 2 . . . . 125 LYS HB1 . 15401 1 1445 . 1 1 125 125 LYS HB3 H 1 1.831 0.03 . 2 . . . . 125 LYS HB2 . 15401 1 1446 . 1 1 125 125 LYS HD2 H 1 1.637 0.03 . 2 . . . . 125 LYS HD2 . 15401 1 1447 . 1 1 125 125 LYS HE2 H 1 2.959 0.03 . 2 . . . . 125 LYS HE2 . 15401 1 1448 . 1 1 125 125 LYS HG2 H 1 1.344 0.03 . 2 . . . . 125 LYS HG2 . 15401 1 1449 . 1 1 125 125 LYS C C 13 176.608 0.30 . 1 . . . . 125 LYS C . 15401 1 1450 . 1 1 125 125 LYS CA C 13 53.851 0.30 . 1 . . . . 125 LYS CA . 15401 1 1451 . 1 1 125 125 LYS CB C 13 35.966 0.30 . 1 . . . . 125 LYS CB . 15401 1 1452 . 1 1 125 125 LYS CD C 13 29.000 0.30 . 1 . . . . 125 LYS CD . 15401 1 1453 . 1 1 125 125 LYS CE C 13 42.380 0.30 . 1 . . . . 125 LYS CE . 15401 1 1454 . 1 1 125 125 LYS CG C 13 24.003 0.30 . 1 . . . . 125 LYS CG . 15401 1 1455 . 1 1 125 125 LYS N N 15 117.271 0.30 . 1 . . . . 125 LYS N . 15401 1 1456 . 1 1 126 126 PHE H H 1 8.064 0.03 . 1 . . . . 126 PHE HN . 15401 1 1457 . 1 1 126 126 PHE HA H 1 4.746 0.03 . 1 . . . . 126 PHE HA . 15401 1 1458 . 1 1 126 126 PHE HB2 H 1 3.981 0.03 . 2 . . . . 126 PHE HB1 . 15401 1 1459 . 1 1 126 126 PHE HB3 H 1 3.132 0.03 . 2 . . . . 126 PHE HB2 . 15401 1 1460 . 1 1 126 126 PHE HD1 H 1 7.475 0.03 . 3 . . . . 126 PHE HD1 . 15401 1 1461 . 1 1 126 126 PHE HE1 H 1 7.096 0.03 . 3 . . . . 126 PHE HE1 . 15401 1 1462 . 1 1 126 126 PHE CA C 13 59.898 0.30 . 1 . . . . 126 PHE CA . 15401 1 1463 . 1 1 126 126 PHE CB C 13 37.555 0.30 . 1 . . . . 126 PHE CB . 15401 1 1464 . 1 1 126 126 PHE N N 15 127.826 0.30 . 1 . . . . 126 PHE N . 15401 1 stop_ save_