data_17818 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 17818 _Entry.Title ; Solution NMR structure of a FKBP-type peptidyl-prolyl cis-trans isomerase from Giardia lamblia. Seattle Structural Genomics Center for Infectious Disease (SSGCID) target GilaA.00840.a ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2011-07-29 _Entry.Accession_date 2011-07-29 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype SOLUTION _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Garry Buchko . W. . 17818 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID 1 'not applicable' 'Seattle Structural Genomics Center for Infectious Disease' . 17818 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID giardiasis . 17818 'infectious diesease' . 17818 isomerase . 17818 SSGCID . 17818 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 17818 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 378 17818 '15N chemical shifts' 116 17818 '1H chemical shifts' 726 17818 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 2 . . 2014-06-09 2011-07-29 update BMRB 'update entry citation' 17818 1 . . 2011-08-17 2011-07-29 original author 'original release' 17818 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2LGO 'BMRB Entry Tracking System' 17818 TargetDB GilaA.00840.a . 17818 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 17818 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 24293257 _Citation.Full_citation . _Citation.Title 'Solution structure of a putative FKBP-type peptidyl-propyl cis-trans isomerase from Giardia lamblia.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biomol. NMR' _Citation.Journal_name_full 'Journal of biomolecular NMR' _Citation.Journal_volume 57 _Citation.Journal_issue 4 _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 369 _Citation.Page_last 374 _Citation.Year 2013 _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 Garry Buchko . W. . 17818 1 2 Stephen Hewitt . N. . 17818 1 3 Wesley 'Van Voorhis' . C. . 17818 1 4 Peter Myler . J. . 17818 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 17818 _Assembly.ID 1 _Assembly.Name 'FKBP-type peptidyl-prolyl cis-trans isomerase' _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 FKBP 1 $FKBP A . yes native no no . . . 17818 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_FKBP _Entity.Sf_category entity _Entity.Sf_framecode FKBP _Entity.Entry_ID 17818 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name FKBP _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 ; MAHHHHHHMGTLEAQTQGPG SMSAQLEKKVLTPGDGVTKP QAGKKVTVHYDGRFPDGKQF DSSRSRGKPFQFTLGAGEVI KGWDQGVATMTLGEKALFTI PYQLAYGERGYPPVIPPKAT LVFEVELLAV ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details 'The first 21 residues are a tag for protein isolation (MAHHHHHHMGTLEAQTQGPGS). The first native residue is M22.' _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 130 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 14160.289 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 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 PDB 2LGO . "Solution Nmr Structure Of A Fkbp-type Peptidyl-prolyl Cis-trans Isomerase From Giardia Lamblia, Seattle Structural Genomics Cen" . . . . . 100.00 130 100.00 100.00 2.22e-88 . . . . 17818 1 2 no GB AAM33435 . "FKBP [Giardia lamblia ATCC 50803]" . . . . . 83.85 109 100.00 100.00 1.68e-71 . . . . 17818 1 3 no GB EDO81467 . "FKBP-type peptidyl-prolyl cis-trans isomerase [Giardia lamblia ATCC 50803]" . . . . . 83.85 109 100.00 100.00 1.68e-71 . . . . 17818 1 4 no GB EET00236 . "FKBP-type peptidyl-prolyl cis-trans isomerase [Giardia intestinalis ATCC 50581]" . . . . . 83.85 109 97.25 100.00 8.82e-70 . . . . 17818 1 5 no GB EFO62827 . "FKBP-type peptidyl-prolyl cis-trans isomerase [Giardia lamblia P15]" . . . . . 83.85 109 99.08 100.00 4.21e-71 . . . . 17818 1 6 no GB ESU38634 . "Peptidyl-prolyl cis-trans isomerase [Giardia intestinalis]" . . . . . 83.85 109 100.00 100.00 1.68e-71 . . . . 17818 1 7 no REF XP_001709141 . "FKBP-type peptidyl-prolyl cis-trans isomerase [Giardia lamblia ATCC 50803]" . . . . . 83.85 109 100.00 100.00 1.68e-71 . . . . 17818 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 . 17818 1 2 . ALA . 17818 1 3 . HIS . 17818 1 4 . HIS . 17818 1 5 . HIS . 17818 1 6 . HIS . 17818 1 7 . HIS . 17818 1 8 . HIS . 17818 1 9 . MET . 17818 1 10 . GLY . 17818 1 11 . THR . 17818 1 12 . LEU . 17818 1 13 . GLU . 17818 1 14 . ALA . 17818 1 15 . GLN . 17818 1 16 . THR . 17818 1 17 . GLN . 17818 1 18 . GLY . 17818 1 19 . PRO . 17818 1 20 . GLY . 17818 1 21 . SER . 17818 1 22 . MET . 17818 1 23 . SER . 17818 1 24 . ALA . 17818 1 25 . GLN . 17818 1 26 . LEU . 17818 1 27 . GLU . 17818 1 28 . LYS . 17818 1 29 . LYS . 17818 1 30 . VAL . 17818 1 31 . LEU . 17818 1 32 . THR . 17818 1 33 . PRO . 17818 1 34 . GLY . 17818 1 35 . ASP . 17818 1 36 . GLY . 17818 1 37 . VAL . 17818 1 38 . THR . 17818 1 39 . LYS . 17818 1 40 . PRO . 17818 1 41 . GLN . 17818 1 42 . ALA . 17818 1 43 . GLY . 17818 1 44 . LYS . 17818 1 45 . LYS . 17818 1 46 . VAL . 17818 1 47 . THR . 17818 1 48 . VAL . 17818 1 49 . HIS . 17818 1 50 . TYR . 17818 1 51 . ASP . 17818 1 52 . GLY . 17818 1 53 . ARG . 17818 1 54 . PHE . 17818 1 55 . PRO . 17818 1 56 . ASP . 17818 1 57 . GLY . 17818 1 58 . LYS . 17818 1 59 . GLN . 17818 1 60 . PHE . 17818 1 61 . ASP . 17818 1 62 . SER . 17818 1 63 . SER . 17818 1 64 . ARG . 17818 1 65 . SER . 17818 1 66 . ARG . 17818 1 67 . GLY . 17818 1 68 . LYS . 17818 1 69 . PRO . 17818 1 70 . PHE . 17818 1 71 . GLN . 17818 1 72 . PHE . 17818 1 73 . THR . 17818 1 74 . LEU . 17818 1 75 . GLY . 17818 1 76 . ALA . 17818 1 77 . GLY . 17818 1 78 . GLU . 17818 1 79 . VAL . 17818 1 80 . ILE . 17818 1 81 . LYS . 17818 1 82 . GLY . 17818 1 83 . TRP . 17818 1 84 . ASP . 17818 1 85 . GLN . 17818 1 86 . GLY . 17818 1 87 . VAL . 17818 1 88 . ALA . 17818 1 89 . THR . 17818 1 90 . MET . 17818 1 91 . THR . 17818 1 92 . LEU . 17818 1 93 . GLY . 17818 1 94 . GLU . 17818 1 95 . LYS . 17818 1 96 . ALA . 17818 1 97 . LEU . 17818 1 98 . PHE . 17818 1 99 . THR . 17818 1 100 . ILE . 17818 1 101 . PRO . 17818 1 102 . TYR . 17818 1 103 . GLN . 17818 1 104 . LEU . 17818 1 105 . ALA . 17818 1 106 . TYR . 17818 1 107 . GLY . 17818 1 108 . GLU . 17818 1 109 . ARG . 17818 1 110 . GLY . 17818 1 111 . TYR . 17818 1 112 . PRO . 17818 1 113 . PRO . 17818 1 114 . VAL . 17818 1 115 . ILE . 17818 1 116 . PRO . 17818 1 117 . PRO . 17818 1 118 . LYS . 17818 1 119 . ALA . 17818 1 120 . THR . 17818 1 121 . LEU . 17818 1 122 . VAL . 17818 1 123 . PHE . 17818 1 124 . GLU . 17818 1 125 . VAL . 17818 1 126 . GLU . 17818 1 127 . LEU . 17818 1 128 . LEU . 17818 1 129 . ALA . 17818 1 130 . VAL . 17818 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 17818 1 . ALA 2 2 17818 1 . HIS 3 3 17818 1 . HIS 4 4 17818 1 . HIS 5 5 17818 1 . HIS 6 6 17818 1 . HIS 7 7 17818 1 . HIS 8 8 17818 1 . MET 9 9 17818 1 . GLY 10 10 17818 1 . THR 11 11 17818 1 . LEU 12 12 17818 1 . GLU 13 13 17818 1 . ALA 14 14 17818 1 . GLN 15 15 17818 1 . THR 16 16 17818 1 . GLN 17 17 17818 1 . GLY 18 18 17818 1 . PRO 19 19 17818 1 . GLY 20 20 17818 1 . SER 21 21 17818 1 . MET 22 22 17818 1 . SER 23 23 17818 1 . ALA 24 24 17818 1 . GLN 25 25 17818 1 . LEU 26 26 17818 1 . GLU 27 27 17818 1 . LYS 28 28 17818 1 . LYS 29 29 17818 1 . VAL 30 30 17818 1 . LEU 31 31 17818 1 . THR 32 32 17818 1 . PRO 33 33 17818 1 . GLY 34 34 17818 1 . ASP 35 35 17818 1 . GLY 36 36 17818 1 . VAL 37 37 17818 1 . THR 38 38 17818 1 . LYS 39 39 17818 1 . PRO 40 40 17818 1 . GLN 41 41 17818 1 . ALA 42 42 17818 1 . GLY 43 43 17818 1 . LYS 44 44 17818 1 . LYS 45 45 17818 1 . VAL 46 46 17818 1 . THR 47 47 17818 1 . VAL 48 48 17818 1 . HIS 49 49 17818 1 . TYR 50 50 17818 1 . ASP 51 51 17818 1 . GLY 52 52 17818 1 . ARG 53 53 17818 1 . PHE 54 54 17818 1 . PRO 55 55 17818 1 . ASP 56 56 17818 1 . GLY 57 57 17818 1 . LYS 58 58 17818 1 . GLN 59 59 17818 1 . PHE 60 60 17818 1 . ASP 61 61 17818 1 . SER 62 62 17818 1 . SER 63 63 17818 1 . ARG 64 64 17818 1 . SER 65 65 17818 1 . ARG 66 66 17818 1 . GLY 67 67 17818 1 . LYS 68 68 17818 1 . PRO 69 69 17818 1 . PHE 70 70 17818 1 . GLN 71 71 17818 1 . PHE 72 72 17818 1 . THR 73 73 17818 1 . LEU 74 74 17818 1 . GLY 75 75 17818 1 . ALA 76 76 17818 1 . GLY 77 77 17818 1 . GLU 78 78 17818 1 . VAL 79 79 17818 1 . ILE 80 80 17818 1 . LYS 81 81 17818 1 . GLY 82 82 17818 1 . TRP 83 83 17818 1 . ASP 84 84 17818 1 . GLN 85 85 17818 1 . GLY 86 86 17818 1 . VAL 87 87 17818 1 . ALA 88 88 17818 1 . THR 89 89 17818 1 . MET 90 90 17818 1 . THR 91 91 17818 1 . LEU 92 92 17818 1 . GLY 93 93 17818 1 . GLU 94 94 17818 1 . LYS 95 95 17818 1 . ALA 96 96 17818 1 . LEU 97 97 17818 1 . PHE 98 98 17818 1 . THR 99 99 17818 1 . ILE 100 100 17818 1 . PRO 101 101 17818 1 . TYR 102 102 17818 1 . GLN 103 103 17818 1 . LEU 104 104 17818 1 . ALA 105 105 17818 1 . TYR 106 106 17818 1 . GLY 107 107 17818 1 . GLU 108 108 17818 1 . ARG 109 109 17818 1 . GLY 110 110 17818 1 . TYR 111 111 17818 1 . PRO 112 112 17818 1 . PRO 113 113 17818 1 . VAL 114 114 17818 1 . ILE 115 115 17818 1 . PRO 116 116 17818 1 . PRO 117 117 17818 1 . LYS 118 118 17818 1 . ALA 119 119 17818 1 . THR 120 120 17818 1 . LEU 121 121 17818 1 . VAL 122 122 17818 1 . PHE 123 123 17818 1 . GLU 124 124 17818 1 . VAL 125 125 17818 1 . GLU 126 126 17818 1 . LEU 127 127 17818 1 . LEU 128 128 17818 1 . ALA 129 129 17818 1 . VAL 130 130 17818 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 17818 _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 $FKBP . 184922 organism . 'Giardia lamblia' 'Giardia lamblia' . . Eukaryota . Giardia lamblia 'ATCC 50803' . . . . . . . . . . . . . . . . . . . . 17818 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 17818 _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 $FKBP . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli BL21 . . . . . . . . . . . . . . . AVA0421 . . . . . . 17818 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 17818 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '93% H2O/7% 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 FKBP '[U-99% 13C; U-99% 15N]' . . 1 $FKBP . . 1 . . mM 0.2 . . . 17818 1 2 'sodium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 17818 1 3 TRIS 'natural abundance' . . . . . . 20 . . mM . . . . 17818 1 4 DTT 'natural abundance' . . . . . . 1 . . mM . . . . 17818 1 5 D2O 'natural abundance' . . . . . . 7 . . % . . . . 17818 1 6 H2O 'natural abundance' . . . . . . 93 . . % . . . . 17818 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 17818 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% 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 FKBP '[U-99% 13C; U-99% 15N]' . . 1 $FKBP . . 1 . . mM 0.2 . . . 17818 2 2 'sodium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 17818 2 3 TRIS 'natural abundance' . . . . . . 20 . . mM . . . . 17818 2 4 DTT 'natural abundance' . . . . . . 1 . . mM . . . . 17818 2 5 D2O 'natural abundance' . . . . . . 100 . . % . . . . 17818 2 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 17818 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0.12 0.01 M 17818 1 pH 7 0.2 pH 17818 1 pressure 1 . atm 17818 1 temperature 293 0.5 K 17818 1 stop_ save_ ############################ # Computer software used # ############################ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 17818 _Software.ID 1 _Software.Name CYANA _Software.Version 3.0 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . 17818 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 17818 1 stop_ save_ save_Felix _Software.Sf_category software _Software.Sf_framecode Felix _Software.Entry_ID 17818 _Software.ID 2 _Software.Name FELIX _Software.Version 2007 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Accelrys Software Inc.' . . 17818 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 17818 2 stop_ save_ save_SPARKY _Software.Sf_category software _Software.Sf_framecode SPARKY _Software.Entry_ID 17818 _Software.ID 3 _Software.Name SPARKY _Software.Version 3.115 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . 17818 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 17818 3 stop_ save_ save_CNS _Software.Sf_category software _Software.Sf_framecode CNS _Software.Entry_ID 17818 _Software.ID 4 _Software.Name CNS _Software.Version 1.1 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Brunger, Adams, Clore, Gros, Nilges and Read' . . 17818 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 17818 4 stop_ save_ save_PSVS _Software.Sf_category software _Software.Sf_framecode PSVS _Software.Entry_ID 17818 _Software.ID 5 _Software.Name PSVS _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bhattacharya and Montelione' . . 17818 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 17818 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 17818 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 750 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 17818 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 17818 _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 Varian INOVA . 750 . . . 17818 1 2 spectrometer_2 Varian INOVA . 600 . . . 17818 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 17818 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17818 1 2 '2D 1H-13C HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17818 1 3 '2D 1H-13C HSQC aliphatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17818 1 4 '2D 1H-13C HSQC aromatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17818 1 5 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 17818 1 6 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 17818 1 7 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 17818 1 8 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17818 1 9 '3D 1H-13C NOESY aliphatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17818 1 10 '3D 1H-13C NOESY aromatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17818 1 11 'deuterium exchange' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17818 1 12 '3D C(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17818 1 13 '2D HBCBCGCDCDHD' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17818 1 14 '2D HBCBCGCDCEHE' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17818 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 17818 _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 0.00 na indirect 0.251449530 . . . . . . . . . 17818 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 17818 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . . . . . 17818 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 17818 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err 0.02 _Assigned_chem_shift_list.Chem_shift_13C_err 0.2 _Assigned_chem_shift_list.Chem_shift_15N_err 0.2 _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 8 '3D 1H-15N NOESY' . . . 17818 1 9 '3D 1H-13C NOESY aliphatic' . . . 17818 1 10 '3D 1H-13C NOESY aromatic' . . . 17818 1 12 '3D C(CO)NH' . . . 17818 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 8 8 HIS CA C 13 54.7 0.2 . 1 . . . A 8 HIS CA . 17818 1 2 . 1 1 8 8 HIS CB C 13 31.2 0.2 . 1 . . . A 8 HIS CB . 17818 1 3 . 1 1 9 9 MET H H 1 8.11 0.02 . 1 . . . A 9 MET H . 17818 1 4 . 1 1 9 9 MET HA H 1 4.28 0.02 . 1 . . . A 9 MET HA . 17818 1 5 . 1 1 9 9 MET CA C 13 55.5 0.2 . 1 . . . A 9 MET CA . 17818 1 6 . 1 1 9 9 MET CB C 13 32.5 0.2 . 1 . . . A 9 MET CB . 17818 1 7 . 1 1 9 9 MET CG C 13 31.9 0.2 . 1 . . . A 9 MET CG . 17818 1 8 . 1 1 9 9 MET N N 15 120.0 0.2 . 1 . . . A 9 MET N . 17818 1 9 . 1 1 10 10 GLY H H 1 8.44 0.02 . 1 . . . A 10 GLY H . 17818 1 10 . 1 1 10 10 GLY HA2 H 1 3.99 0.02 . 2 . . . A 10 GLY HA2 . 17818 1 11 . 1 1 10 10 GLY HA3 H 1 3.99 0.02 . 2 . . . A 10 GLY HA3 . 17818 1 12 . 1 1 10 10 GLY CA C 13 45.3 0.2 . 1 . . . A 10 GLY CA . 17818 1 13 . 1 1 10 10 GLY N N 15 109.8 0.2 . 1 . . . A 10 GLY N . 17818 1 14 . 1 1 11 11 THR H H 1 8.07 0.02 . 1 . . . A 11 THR H . 17818 1 15 . 1 1 11 11 THR HA H 1 4.33 0.02 . 1 . . . A 11 THR HA . 17818 1 16 . 1 1 11 11 THR HB H 1 4.24 0.02 . 1 . . . A 11 THR HB . 17818 1 17 . 1 1 11 11 THR HG21 H 1 1.20 0.02 . 1 . . . A 11 THR HG21 . 17818 1 18 . 1 1 11 11 THR HG22 H 1 1.20 0.02 . 1 . . . A 11 THR HG22 . 17818 1 19 . 1 1 11 11 THR HG23 H 1 1.20 0.02 . 1 . . . A 11 THR HG23 . 17818 1 20 . 1 1 11 11 THR CA C 13 62.0 0.2 . 1 . . . A 11 THR CA . 17818 1 21 . 1 1 11 11 THR CB C 13 69.9 0.2 . 1 . . . A 11 THR CB . 17818 1 22 . 1 1 11 11 THR CG2 C 13 21.7 0.2 . 1 . . . A 11 THR CG2 . 17818 1 23 . 1 1 11 11 THR N N 15 113.6 0.2 . 1 . . . A 11 THR N . 17818 1 24 . 1 1 12 12 LEU H H 1 8.38 0.02 . 1 . . . A 12 LEU H . 17818 1 25 . 1 1 12 12 LEU HA H 1 4.32 0.02 . 1 . . . A 12 LEU HA . 17818 1 26 . 1 1 12 12 LEU HB2 H 1 1.60 0.02 . 2 . . . A 12 LEU HB2 . 17818 1 27 . 1 1 12 12 LEU HB3 H 1 1.60 0.02 . 2 . . . A 12 LEU HB3 . 17818 1 28 . 1 1 12 12 LEU CA C 13 55.5 0.2 . 1 . . . A 12 LEU CA . 17818 1 29 . 1 1 12 12 LEU CB C 13 42.1 0.2 . 1 . . . A 12 LEU CB . 17818 1 30 . 1 1 12 12 LEU N N 15 124.2 0.2 . 1 . . . A 12 LEU N . 17818 1 31 . 1 1 13 13 GLU H H 1 8.43 0.02 . 1 . . . A 13 GLU H . 17818 1 32 . 1 1 13 13 GLU HA H 1 4.20 0.02 . 1 . . . A 13 GLU HA . 17818 1 33 . 1 1 13 13 GLU HB2 H 1 2.02 0.02 . 2 . . . A 13 GLU HB2 . 17818 1 34 . 1 1 13 13 GLU HB3 H 1 1.93 0.02 . 2 . . . A 13 GLU HB3 . 17818 1 35 . 1 1 13 13 GLU HG2 H 1 2.26 0.02 . 2 . . . A 13 GLU HG2 . 17818 1 36 . 1 1 13 13 GLU HG3 H 1 2.26 0.02 . 2 . . . A 13 GLU HG3 . 17818 1 37 . 1 1 13 13 GLU CA C 13 56.9 0.2 . 1 . . . A 13 GLU CA . 17818 1 38 . 1 1 13 13 GLU CB C 13 30.0 0.2 . 1 . . . A 13 GLU CB . 17818 1 39 . 1 1 13 13 GLU CG C 13 36.3 0.2 . 1 . . . A 13 GLU CG . 17818 1 40 . 1 1 13 13 GLU N N 15 121.6 0.2 . 1 . . . A 13 GLU N . 17818 1 41 . 1 1 14 14 ALA H H 1 8.29 0.02 . 1 . . . A 14 ALA H . 17818 1 42 . 1 1 14 14 ALA HA H 1 4.27 0.02 . 1 . . . A 14 ALA HA . 17818 1 43 . 1 1 14 14 ALA HB1 H 1 1.39 0.02 . 1 . . . A 14 ALA HB1 . 17818 1 44 . 1 1 14 14 ALA HB2 H 1 1.39 0.02 . 1 . . . A 14 ALA HB2 . 17818 1 45 . 1 1 14 14 ALA HB3 H 1 1.39 0.02 . 1 . . . A 14 ALA HB3 . 17818 1 46 . 1 1 14 14 ALA CA C 13 52.7 0.2 . 1 . . . A 14 ALA CA . 17818 1 47 . 1 1 14 14 ALA CB C 13 19.1 0.2 . 1 . . . A 14 ALA CB . 17818 1 48 . 1 1 14 14 ALA N N 15 124.4 0.2 . 1 . . . A 14 ALA N . 17818 1 49 . 1 1 15 15 GLN H H 1 8.37 0.02 . 1 . . . A 15 GLN H . 17818 1 50 . 1 1 15 15 GLN HA H 1 4.39 0.02 . 1 . . . A 15 GLN HA . 17818 1 51 . 1 1 15 15 GLN HB2 H 1 2.02 0.02 . 2 . . . A 15 GLN HB2 . 17818 1 52 . 1 1 15 15 GLN HB3 H 1 2.15 0.02 . 2 . . . A 15 GLN HB3 . 17818 1 53 . 1 1 15 15 GLN CA C 13 56.0 0.2 . 1 . . . A 15 GLN CA . 17818 1 54 . 1 1 15 15 GLN CB C 13 29.4 0.2 . 1 . . . A 15 GLN CB . 17818 1 55 . 1 1 15 15 GLN N N 15 119.1 0.2 . 1 . . . A 15 GLN N . 17818 1 56 . 1 1 16 16 THR H H 1 8.20 0.02 . 1 . . . A 16 THR H . 17818 1 57 . 1 1 16 16 THR CA C 13 62.1 0.2 . 1 . . . A 16 THR CA . 17818 1 58 . 1 1 16 16 THR CB C 13 69.8 0.2 . 1 . . . A 16 THR CB . 17818 1 59 . 1 1 16 16 THR CG2 C 13 21.4 0.2 . 1 . . . A 16 THR CG2 . 17818 1 60 . 1 1 16 16 THR N N 15 114.9 0.2 . 1 . . . A 16 THR N . 17818 1 61 . 1 1 17 17 GLN H H 1 8.42 0.02 . 1 . . . A 17 GLN H . 17818 1 62 . 1 1 17 17 GLN HA H 1 4.43 0.02 . 1 . . . A 17 GLN HA . 17818 1 63 . 1 1 17 17 GLN HB2 H 1 2.00 0.02 . 2 . . . A 17 GLN HB2 . 17818 1 64 . 1 1 17 17 GLN HB3 H 1 2.16 0.02 . 2 . . . A 17 GLN HB3 . 17818 1 65 . 1 1 17 17 GLN HG2 H 1 2.40 0.02 . 2 . . . A 17 GLN HG2 . 17818 1 66 . 1 1 17 17 GLN HG3 H 1 2.40 0.02 . 2 . . . A 17 GLN HG3 . 17818 1 67 . 1 1 17 17 GLN CA C 13 55.6 0.2 . 1 . . . A 17 GLN CA . 17818 1 68 . 1 1 17 17 GLN CB C 13 29.7 0.2 . 1 . . . A 17 GLN CB . 17818 1 69 . 1 1 17 17 GLN CG C 13 33.8 0.2 . 1 . . . A 17 GLN CG . 17818 1 70 . 1 1 17 17 GLN N N 15 122.2 0.2 . 1 . . . A 17 GLN N . 17818 1 71 . 1 1 18 18 GLY H H 1 8.36 0.02 . 1 . . . A 18 GLY H . 17818 1 72 . 1 1 18 18 GLY HA2 H 1 4.09 0.02 . 2 . . . A 18 GLY HA2 . 17818 1 73 . 1 1 18 18 GLY HA3 H 1 4.09 0.02 . 2 . . . A 18 GLY HA3 . 17818 1 74 . 1 1 18 18 GLY CA C 13 44.6 0.2 . 1 . . . A 18 GLY CA . 17818 1 75 . 1 1 18 18 GLY N N 15 110.1 0.2 . 1 . . . A 18 GLY N . 17818 1 76 . 1 1 19 19 PRO HA H 1 4.44 0.02 . 1 . . . A 19 PRO HA . 17818 1 77 . 1 1 19 19 PRO HB2 H 1 2.29 0.02 . 2 . . . A 19 PRO HB2 . 17818 1 78 . 1 1 19 19 PRO HB3 H 1 1.99 0.02 . 2 . . . A 19 PRO HB3 . 17818 1 79 . 1 1 19 19 PRO HG2 H 1 2.04 0.02 . 2 . . . A 19 PRO HG2 . 17818 1 80 . 1 1 19 19 PRO HG3 H 1 2.04 0.02 . 2 . . . A 19 PRO HG3 . 17818 1 81 . 1 1 19 19 PRO HD2 H 1 3.66 0.02 . 2 . . . A 19 PRO HD2 . 17818 1 82 . 1 1 19 19 PRO HD3 H 1 3.66 0.02 . 2 . . . A 19 PRO HD3 . 17818 1 83 . 1 1 19 19 PRO CA C 13 63.6 0.2 . 1 . . . A 19 PRO CA . 17818 1 84 . 1 1 19 19 PRO CB C 13 32.0 0.2 . 1 . . . A 19 PRO CB . 17818 1 85 . 1 1 19 19 PRO CG C 13 27.1 0.2 . 1 . . . A 19 PRO CG . 17818 1 86 . 1 1 19 19 PRO CD C 13 49.7 0.2 . 1 . . . A 19 PRO CD . 17818 1 87 . 1 1 20 20 GLY H H 1 8.63 0.02 . 1 . . . A 20 GLY H . 17818 1 88 . 1 1 20 20 GLY CA C 13 45.3 0.2 . 1 . . . A 20 GLY CA . 17818 1 89 . 1 1 20 20 GLY N N 15 109.4 0.2 . 1 . . . A 20 GLY N . 17818 1 90 . 1 1 21 21 SER H H 1 8.18 0.02 . 1 . . . A 21 SER H . 17818 1 91 . 1 1 21 21 SER CA C 13 63.8 0.2 . 1 . . . A 21 SER CA . 17818 1 92 . 1 1 21 21 SER N N 15 115.4 0.2 . 1 . . . A 21 SER N . 17818 1 93 . 1 1 22 22 MET H H 1 8.44 0.02 . 1 . . . A 22 MET H . 17818 1 94 . 1 1 22 22 MET CA C 13 55.5 0.2 . 1 . . . A 22 MET CA . 17818 1 95 . 1 1 22 22 MET CB C 13 32.8 0.2 . 1 . . . A 22 MET CB . 17818 1 96 . 1 1 22 22 MET CG C 13 32.0 0.2 . 1 . . . A 22 MET CG . 17818 1 97 . 1 1 22 22 MET N N 15 121.9 0.2 . 1 . . . A 22 MET N . 17818 1 98 . 1 1 23 23 SER H H 1 8.29 0.02 . 1 . . . A 23 SER H . 17818 1 99 . 1 1 23 23 SER HA H 1 4.40 0.02 . 1 . . . A 23 SER HA . 17818 1 100 . 1 1 23 23 SER HB2 H 1 3.84 0.02 . 2 . . . A 23 SER HB2 . 17818 1 101 . 1 1 23 23 SER HB3 H 1 3.84 0.02 . 2 . . . A 23 SER HB3 . 17818 1 102 . 1 1 23 23 SER CA C 13 58.3 0.2 . 1 . . . A 23 SER CA . 17818 1 103 . 1 1 23 23 SER CB C 13 63.7 0.2 . 1 . . . A 23 SER CB . 17818 1 104 . 1 1 23 23 SER N N 15 116.6 0.2 . 1 . . . A 23 SER N . 17818 1 105 . 1 1 24 24 ALA H H 1 8.20 0.02 . 1 . . . A 24 ALA H . 17818 1 106 . 1 1 24 24 ALA HA H 1 4.29 0.02 . 1 . . . A 24 ALA HA . 17818 1 107 . 1 1 24 24 ALA HB1 H 1 1.20 0.02 . 1 . . . A 24 ALA HB1 . 17818 1 108 . 1 1 24 24 ALA HB2 H 1 1.20 0.02 . 1 . . . A 24 ALA HB2 . 17818 1 109 . 1 1 24 24 ALA HB3 H 1 1.20 0.02 . 1 . . . A 24 ALA HB3 . 17818 1 110 . 1 1 24 24 ALA CA C 13 52.1 0.2 . 1 . . . A 24 ALA CA . 17818 1 111 . 1 1 24 24 ALA CB C 13 19.3 0.2 . 1 . . . A 24 ALA CB . 17818 1 112 . 1 1 24 24 ALA N N 15 125.7 0.2 . 1 . . . A 24 ALA N . 17818 1 113 . 1 1 25 25 GLN H H 1 8.28 0.02 . 1 . . . A 25 GLN H . 17818 1 114 . 1 1 25 25 GLN HA H 1 4.51 0.02 . 1 . . . A 25 GLN HA . 17818 1 115 . 1 1 25 25 GLN HB2 H 1 2.11 0.02 . 2 . . . A 25 GLN HB2 . 17818 1 116 . 1 1 25 25 GLN HB3 H 1 1.88 0.02 . 2 . . . A 25 GLN HB3 . 17818 1 117 . 1 1 25 25 GLN HG2 H 1 2.33 0.02 . 2 . . . A 25 GLN HG2 . 17818 1 118 . 1 1 25 25 GLN HG3 H 1 2.33 0.02 . 2 . . . A 25 GLN HG3 . 17818 1 119 . 1 1 25 25 GLN CA C 13 54.2 0.2 . 1 . . . A 25 GLN CA . 17818 1 120 . 1 1 25 25 GLN CB C 13 31.3 0.2 . 1 . . . A 25 GLN CB . 17818 1 121 . 1 1 25 25 GLN CG C 13 33.5 0.2 . 1 . . . A 25 GLN CG . 17818 1 122 . 1 1 25 25 GLN N N 15 118.3 0.2 . 1 . . . A 25 GLN N . 17818 1 123 . 1 1 26 26 LEU H H 1 8.48 0.02 . 1 . . . A 26 LEU H . 17818 1 124 . 1 1 26 26 LEU HA H 1 4.46 0.02 . 1 . . . A 26 LEU HA . 17818 1 125 . 1 1 26 26 LEU HB2 H 1 1.80 0.02 . 2 . . . A 26 LEU HB2 . 17818 1 126 . 1 1 26 26 LEU HB3 H 1 1.51 0.02 . 2 . . . A 26 LEU HB3 . 17818 1 127 . 1 1 26 26 LEU CA C 13 55.3 0.2 . 1 . . . A 26 LEU CA . 17818 1 128 . 1 1 26 26 LEU CB C 13 43.5 0.2 . 1 . . . A 26 LEU CB . 17818 1 129 . 1 1 26 26 LEU N N 15 122.1 0.2 . 1 . . . A 26 LEU N . 17818 1 130 . 1 1 27 27 GLU H H 1 8.24 0.02 . 1 . . . A 27 GLU H . 17818 1 131 . 1 1 27 27 GLU HB2 H 1 2.15 0.02 . 2 . . . A 27 GLU HB2 . 17818 1 132 . 1 1 27 27 GLU HB3 H 1 2.00 0.02 . 2 . . . A 27 GLU HB3 . 17818 1 133 . 1 1 27 27 GLU HG2 H 1 2.33 0.02 . 2 . . . A 27 GLU HG2 . 17818 1 134 . 1 1 27 27 GLU HG3 H 1 2.21 0.02 . 2 . . . A 27 GLU HG3 . 17818 1 135 . 1 1 27 27 GLU CA C 13 55.3 0.2 . 1 . . . A 27 GLU CA . 17818 1 136 . 1 1 27 27 GLU CB C 13 32.4 0.2 . 1 . . . A 27 GLU CB . 17818 1 137 . 1 1 27 27 GLU CG C 13 36.1 0.2 . 1 . . . A 27 GLU CG . 17818 1 138 . 1 1 27 27 GLU N N 15 125.3 0.2 . 1 . . . A 27 GLU N . 17818 1 139 . 1 1 28 28 LYS H H 1 8.81 0.02 . 1 . . . A 28 LYS H . 17818 1 140 . 1 1 28 28 LYS HA H 1 4.61 0.02 . 1 . . . A 28 LYS HA . 17818 1 141 . 1 1 28 28 LYS HB2 H 1 1.74 0.02 . 2 . . . A 28 LYS HB2 . 17818 1 142 . 1 1 28 28 LYS HB3 H 1 1.69 0.02 . 2 . . . A 28 LYS HB3 . 17818 1 143 . 1 1 28 28 LYS HG2 H 1 1.39 0.02 . 2 . . . A 28 LYS HG2 . 17818 1 144 . 1 1 28 28 LYS HG3 H 1 1.20 0.02 . 2 . . . A 28 LYS HG3 . 17818 1 145 . 1 1 28 28 LYS HE2 H 1 2.94 0.02 . 2 . . . A 28 LYS HE2 . 17818 1 146 . 1 1 28 28 LYS HE3 H 1 2.94 0.02 . 2 . . . A 28 LYS HE3 . 17818 1 147 . 1 1 28 28 LYS CA C 13 54.5 0.2 . 1 . . . A 28 LYS CA . 17818 1 148 . 1 1 28 28 LYS CB C 13 35.7 0.2 . 1 . . . A 28 LYS CB . 17818 1 149 . 1 1 28 28 LYS CG C 13 24.7 0.2 . 1 . . . A 28 LYS CG . 17818 1 150 . 1 1 28 28 LYS CE C 13 42.0 0.2 . 1 . . . A 28 LYS CE . 17818 1 151 . 1 1 28 28 LYS N N 15 125.0 0.2 . 1 . . . A 28 LYS N . 17818 1 152 . 1 1 29 29 LYS H H 1 8.85 0.02 . 1 . . . A 29 LYS H . 17818 1 153 . 1 1 29 29 LYS HA H 1 5.03 0.02 . 1 . . . A 29 LYS HA . 17818 1 154 . 1 1 29 29 LYS HB2 H 1 1.70 0.02 . 2 . . . A 29 LYS HB2 . 17818 1 155 . 1 1 29 29 LYS HB3 H 1 1.54 0.02 . 2 . . . A 29 LYS HB3 . 17818 1 156 . 1 1 29 29 LYS HD2 H 1 1.87 0.02 . 2 . . . A 29 LYS HD2 . 17818 1 157 . 1 1 29 29 LYS HD3 H 1 1.70 0.02 . 2 . . . A 29 LYS HD3 . 17818 1 158 . 1 1 29 29 LYS CA C 13 55.0 0.2 . 1 . . . A 29 LYS CA . 17818 1 159 . 1 1 29 29 LYS CB C 13 36.2 0.2 . 1 . . . A 29 LYS CB . 17818 1 160 . 1 1 29 29 LYS CG C 13 26.3 0.2 . 1 . . . A 29 LYS CG . 17818 1 161 . 1 1 29 29 LYS CD C 13 28.8 0.2 . 1 . . . A 29 LYS CD . 17818 1 162 . 1 1 29 29 LYS N N 15 128.1 0.2 . 1 . . . A 29 LYS N . 17818 1 163 . 1 1 30 30 VAL H H 1 9.17 0.02 . 1 . . . A 30 VAL H . 17818 1 164 . 1 1 30 30 VAL HA H 1 3.66 0.02 . 1 . . . A 30 VAL HA . 17818 1 165 . 1 1 30 30 VAL HB H 1 1.98 0.02 . 1 . . . A 30 VAL HB . 17818 1 166 . 1 1 30 30 VAL HG11 H 1 0.76 0.02 . 2 . . . A 30 VAL HG11 . 17818 1 167 . 1 1 30 30 VAL HG12 H 1 0.76 0.02 . 2 . . . A 30 VAL HG12 . 17818 1 168 . 1 1 30 30 VAL HG13 H 1 0.76 0.02 . 2 . . . A 30 VAL HG13 . 17818 1 169 . 1 1 30 30 VAL HG21 H 1 0.75 0.02 . 2 . . . A 30 VAL HG21 . 17818 1 170 . 1 1 30 30 VAL HG22 H 1 0.75 0.02 . 2 . . . A 30 VAL HG22 . 17818 1 171 . 1 1 30 30 VAL HG23 H 1 0.75 0.02 . 2 . . . A 30 VAL HG23 . 17818 1 172 . 1 1 30 30 VAL CA C 13 64.8 0.2 . 1 . . . A 30 VAL CA . 17818 1 173 . 1 1 30 30 VAL CB C 13 31.6 0.2 . 1 . . . A 30 VAL CB . 17818 1 174 . 1 1 30 30 VAL CG1 C 13 21.7 0.2 . 2 . . . A 30 VAL CG1 . 17818 1 175 . 1 1 30 30 VAL N N 15 127.2 0.2 . 1 . . . A 30 VAL N . 17818 1 176 . 1 1 31 31 LEU H H 1 9.02 0.02 . 1 . . . A 31 LEU H . 17818 1 177 . 1 1 31 31 LEU HA H 1 4.44 0.02 . 1 . . . A 31 LEU HA . 17818 1 178 . 1 1 31 31 LEU HB2 H 1 1.55 0.02 . 2 . . . A 31 LEU HB2 . 17818 1 179 . 1 1 31 31 LEU HB3 H 1 1.44 0.02 . 2 . . . A 31 LEU HB3 . 17818 1 180 . 1 1 31 31 LEU HG H 1 0.82 0.02 . 1 . . . A 31 LEU HG . 17818 1 181 . 1 1 31 31 LEU HD11 H 1 0.76 0.02 . 2 . . . A 31 LEU HD11 . 17818 1 182 . 1 1 31 31 LEU HD12 H 1 0.76 0.02 . 2 . . . A 31 LEU HD12 . 17818 1 183 . 1 1 31 31 LEU HD13 H 1 0.76 0.02 . 2 . . . A 31 LEU HD13 . 17818 1 184 . 1 1 31 31 LEU HD21 H 1 0.76 0.02 . 2 . . . A 31 LEU HD21 . 17818 1 185 . 1 1 31 31 LEU HD22 H 1 0.76 0.02 . 2 . . . A 31 LEU HD22 . 17818 1 186 . 1 1 31 31 LEU HD23 H 1 0.76 0.02 . 2 . . . A 31 LEU HD23 . 17818 1 187 . 1 1 31 31 LEU CA C 13 56.0 0.2 . 1 . . . A 31 LEU CA . 17818 1 188 . 1 1 31 31 LEU CB C 13 41.8 0.2 . 1 . . . A 31 LEU CB . 17818 1 189 . 1 1 31 31 LEU CG C 13 26.0 0.2 . 1 . . . A 31 LEU CG . 17818 1 190 . 1 1 31 31 LEU CD1 C 13 21.7 0.2 . 2 . . . A 31 LEU CD1 . 17818 1 191 . 1 1 31 31 LEU CD2 C 13 21.7 0.2 . 2 . . . A 31 LEU CD2 . 17818 1 192 . 1 1 31 31 LEU N N 15 129.8 0.2 . 1 . . . A 31 LEU N . 17818 1 193 . 1 1 32 32 THR H H 1 8.22 0.02 . 1 . . . A 32 THR H . 17818 1 194 . 1 1 32 32 THR HB H 1 3.94 0.02 . 1 . . . A 32 THR HB . 17818 1 195 . 1 1 32 32 THR HG21 H 1 1.32 0.02 . 1 . . . A 32 THR HG1 . 17818 1 196 . 1 1 32 32 THR HG22 H 1 1.32 0.02 . 1 . . . A 32 THR HG1 . 17818 1 197 . 1 1 32 32 THR HG23 H 1 1.32 0.02 . 1 . . . A 32 THR HG1 . 17818 1 198 . 1 1 32 32 THR CA C 13 59.3 0.2 . 1 . . . A 32 THR CA . 17818 1 199 . 1 1 32 32 THR CB C 13 72.5 0.2 . 1 . . . A 32 THR CB . 17818 1 200 . 1 1 32 32 THR CG2 C 13 21.7 0.2 . 1 . . . A 32 THR CG2 . 17818 1 201 . 1 1 32 32 THR N N 15 115.7 0.2 . 1 . . . A 32 THR N . 17818 1 202 . 1 1 33 33 PRO HA H 1 4.29 0.02 . 1 . . . A 33 PRO HA . 17818 1 203 . 1 1 33 33 PRO HB2 H 1 2.33 0.02 . 2 . . . A 33 PRO HB2 . 17818 1 204 . 1 1 33 33 PRO HB3 H 1 2.03 0.02 . 2 . . . A 33 PRO HB3 . 17818 1 205 . 1 1 33 33 PRO CA C 13 63.0 0.2 . 1 . . . A 33 PRO CA . 17818 1 206 . 1 1 33 33 PRO CB C 13 32.4 0.2 . 1 . . . A 33 PRO CB . 17818 1 207 . 1 1 33 33 PRO CG C 13 27.3 0.2 . 1 . . . A 33 PRO CG . 17818 1 208 . 1 1 33 33 PRO CD C 13 51.2 0.2 . 1 . . . A 33 PRO CD . 17818 1 209 . 1 1 34 34 GLY H H 1 9.01 0.02 . 1 . . . A 34 GLY H . 17818 1 210 . 1 1 34 34 GLY HA2 H 1 4.11 0.02 . 2 . . . A 34 GLY HA2 . 17818 1 211 . 1 1 34 34 GLY HA3 H 1 3.63 0.02 . 2 . . . A 34 GLY HA3 . 17818 1 212 . 1 1 34 34 GLY CA C 13 44.2 0.2 . 1 . . . A 34 GLY CA . 17818 1 213 . 1 1 34 34 GLY N N 15 109.4 0.2 . 1 . . . A 34 GLY N . 17818 1 214 . 1 1 35 35 ASP H H 1 8.37 0.02 . 1 . . . A 35 ASP H . 17818 1 215 . 1 1 35 35 ASP HA H 1 4.33 0.02 . 1 . . . A 35 ASP HA . 17818 1 216 . 1 1 35 35 ASP HB2 H 1 3.09 0.02 . 2 . . . A 35 ASP HB2 . 17818 1 217 . 1 1 35 35 ASP HB3 H 1 2.79 0.02 . 2 . . . A 35 ASP HB3 . 17818 1 218 . 1 1 35 35 ASP CA C 13 54.7 0.2 . 1 . . . A 35 ASP CA . 17818 1 219 . 1 1 35 35 ASP CB C 13 39.4 0.2 . 1 . . . A 35 ASP CB . 17818 1 220 . 1 1 35 35 ASP N N 15 119.4 0.2 . 1 . . . A 35 ASP N . 17818 1 221 . 1 1 36 36 GLY H H 1 8.75 0.02 . 1 . . . A 36 GLY H . 17818 1 222 . 1 1 36 36 GLY HA2 H 1 4.25 0.02 . 2 . . . A 36 GLY HA2 . 17818 1 223 . 1 1 36 36 GLY HA3 H 1 3.68 0.02 . 2 . . . A 36 GLY HA3 . 17818 1 224 . 1 1 36 36 GLY CA C 13 46.0 0.2 . 1 . . . A 36 GLY CA . 17818 1 225 . 1 1 36 36 GLY N N 15 107.9 0.2 . 1 . . . A 36 GLY N . 17818 1 226 . 1 1 37 37 VAL H H 1 8.59 0.02 . 1 . . . A 37 VAL H . 17818 1 227 . 1 1 37 37 VAL HA H 1 4.50 0.02 . 1 . . . A 37 VAL HA . 17818 1 228 . 1 1 37 37 VAL HB H 1 2.01 0.02 . 1 . . . A 37 VAL HB . 17818 1 229 . 1 1 37 37 VAL HG11 H 1 0.89 0.02 . 2 . . . A 37 VAL HG11 . 17818 1 230 . 1 1 37 37 VAL HG12 H 1 0.89 0.02 . 2 . . . A 37 VAL HG12 . 17818 1 231 . 1 1 37 37 VAL HG13 H 1 0.89 0.02 . 2 . . . A 37 VAL HG13 . 17818 1 232 . 1 1 37 37 VAL HG21 H 1 0.81 0.02 . 2 . . . A 37 VAL HG21 . 17818 1 233 . 1 1 37 37 VAL HG22 H 1 0.81 0.02 . 2 . . . A 37 VAL HG22 . 17818 1 234 . 1 1 37 37 VAL HG23 H 1 0.81 0.02 . 2 . . . A 37 VAL HG23 . 17818 1 235 . 1 1 37 37 VAL CA C 13 62.5 0.2 . 1 . . . A 37 VAL CA . 17818 1 236 . 1 1 37 37 VAL CB C 13 35.9 0.2 . 1 . . . A 37 VAL CB . 17818 1 237 . 1 1 37 37 VAL CG1 C 13 21.4 0.2 . 2 . . . A 37 VAL CG1 . 17818 1 238 . 1 1 37 37 VAL CG2 C 13 19.3 0.2 . 2 . . . A 37 VAL CG2 . 17818 1 239 . 1 1 37 37 VAL N N 15 116.2 0.2 . 1 . . . A 37 VAL N . 17818 1 240 . 1 1 38 38 THR H H 1 10.65 0.02 . 1 . . . A 38 THR H . 17818 1 241 . 1 1 38 38 THR HA H 1 4.21 0.02 . 1 . . . A 38 THR HA . 17818 1 242 . 1 1 38 38 THR HB H 1 4.48 0.02 . 1 . . . A 38 THR HB . 17818 1 243 . 1 1 38 38 THR HG21 H 1 1.15 0.02 . 1 . . . A 38 THR HG21 . 17818 1 244 . 1 1 38 38 THR HG22 H 1 1.15 0.02 . 1 . . . A 38 THR HG22 . 17818 1 245 . 1 1 38 38 THR HG23 H 1 1.15 0.02 . 1 . . . A 38 THR HG23 . 17818 1 246 . 1 1 38 38 THR CA C 13 63.3 0.2 . 1 . . . A 38 THR CA . 17818 1 247 . 1 1 38 38 THR CB C 13 65.8 0.2 . 1 . . . A 38 THR CB . 17818 1 248 . 1 1 38 38 THR CG2 C 13 22.7 0.2 . 1 . . . A 38 THR CG2 . 17818 1 249 . 1 1 38 38 THR N N 15 126.4 0.2 . 1 . . . A 38 THR N . 17818 1 250 . 1 1 39 39 LYS H H 1 8.39 0.02 . 1 . . . A 39 LYS H . 17818 1 251 . 1 1 39 39 LYS HB2 H 1 1.87 0.02 . 2 . . . A 39 LYS HB2 . 17818 1 252 . 1 1 39 39 LYS HB3 H 1 1.56 0.02 . 2 . . . A 39 LYS HB3 . 17818 1 253 . 1 1 39 39 LYS CA C 13 53.4 0.2 . 1 . . . A 39 LYS CA . 17818 1 254 . 1 1 39 39 LYS CB C 13 33.2 0.2 . 1 . . . A 39 LYS CB . 17818 1 255 . 1 1 39 39 LYS N N 15 127.0 0.2 . 1 . . . A 39 LYS N . 17818 1 256 . 1 1 40 40 PRO HB2 H 1 1.96 0.02 . 2 . . . A 40 PRO HB2 . 17818 1 257 . 1 1 40 40 PRO HB3 H 1 1.77 0.02 . 2 . . . A 40 PRO HB3 . 17818 1 258 . 1 1 40 40 PRO HG2 H 1 1.96 0.02 . 2 . . . A 40 PRO HG2 . 17818 1 259 . 1 1 40 40 PRO HG3 H 1 1.88 0.02 . 2 . . . A 40 PRO HG3 . 17818 1 260 . 1 1 40 40 PRO HD2 H 1 4.02 0.02 . 2 . . . A 40 PRO HD2 . 17818 1 261 . 1 1 40 40 PRO HD3 H 1 3.59 0.02 . 2 . . . A 40 PRO HD3 . 17818 1 262 . 1 1 40 40 PRO CA C 13 62.2 0.2 . 1 . . . A 40 PRO CA . 17818 1 263 . 1 1 40 40 PRO CB C 13 33.3 0.2 . 1 . . . A 40 PRO CB . 17818 1 264 . 1 1 40 40 PRO CG C 13 27.1 0.2 . 1 . . . A 40 PRO CG . 17818 1 265 . 1 1 40 40 PRO CD C 13 51.1 0.2 . 1 . . . A 40 PRO CD . 17818 1 266 . 1 1 41 41 GLN H H 1 8.75 0.02 . 1 . . . A 41 GLN H . 17818 1 267 . 1 1 41 41 GLN HA H 1 4.46 0.02 . 1 . . . A 41 GLN HA . 17818 1 268 . 1 1 41 41 GLN HB2 H 1 1.94 0.02 . 2 . . . A 41 GLN HB2 . 17818 1 269 . 1 1 41 41 GLN HB3 H 1 1.75 0.02 . 2 . . . A 41 GLN HB3 . 17818 1 270 . 1 1 41 41 GLN HG2 H 1 2.33 0.02 . 2 . . . A 41 GLN HG2 . 17818 1 271 . 1 1 41 41 GLN HG3 H 1 2.33 0.02 . 2 . . . A 41 GLN HG3 . 17818 1 272 . 1 1 41 41 GLN HE21 H 1 7.55 0.02 . 2 . . . A 41 GLN HE21 . 17818 1 273 . 1 1 41 41 GLN HE22 H 1 6.93 0.02 . 2 . . . A 41 GLN HE22 . 17818 1 274 . 1 1 41 41 GLN CA C 13 53.7 0.2 . 1 . . . A 41 GLN CA . 17818 1 275 . 1 1 41 41 GLN CB C 13 31.5 0.2 . 1 . . . A 41 GLN CB . 17818 1 276 . 1 1 41 41 GLN CG C 13 33.7 0.2 . 1 . . . A 41 GLN CG . 17818 1 277 . 1 1 41 41 GLN N N 15 120.9 0.2 . 1 . . . A 41 GLN N . 17818 1 278 . 1 1 41 41 GLN NE2 N 15 113.1 0.2 . 1 . . . A 41 GLN NE2 . 17818 1 279 . 1 1 42 42 ALA H H 1 8.55 0.02 . 1 . . . A 42 ALA H . 17818 1 280 . 1 1 42 42 ALA HA H 1 3.78 0.02 . 1 . . . A 42 ALA HA . 17818 1 281 . 1 1 42 42 ALA HB1 H 1 1.33 0.02 . 1 . . . A 42 ALA HB1 . 17818 1 282 . 1 1 42 42 ALA HB2 H 1 1.33 0.02 . 1 . . . A 42 ALA HB2 . 17818 1 283 . 1 1 42 42 ALA HB3 H 1 1.33 0.02 . 1 . . . A 42 ALA HB3 . 17818 1 284 . 1 1 42 42 ALA CA C 13 53.4 0.2 . 1 . . . A 42 ALA CA . 17818 1 285 . 1 1 42 42 ALA CB C 13 17.8 0.2 . 1 . . . A 42 ALA CB . 17818 1 286 . 1 1 42 42 ALA N N 15 125.7 0.2 . 1 . . . A 42 ALA N . 17818 1 287 . 1 1 43 43 GLY H H 1 8.97 0.02 . 1 . . . A 43 GLY H . 17818 1 288 . 1 1 43 43 GLY HA2 H 1 4.21 0.02 . 2 . . . A 43 GLY HA2 . 17818 1 289 . 1 1 43 43 GLY HA3 H 1 3.48 0.02 . 2 . . . A 43 GLY HA3 . 17818 1 290 . 1 1 43 43 GLY CA C 13 45.2 0.2 . 1 . . . A 43 GLY CA . 17818 1 291 . 1 1 43 43 GLY N N 15 109.7 0.2 . 1 . . . A 43 GLY N . 17818 1 292 . 1 1 44 44 LYS H H 1 7.92 0.02 . 1 . . . A 44 LYS H . 17818 1 293 . 1 1 44 44 LYS HA H 1 4.67 0.02 . 1 . . . A 44 LYS HA . 17818 1 294 . 1 1 44 44 LYS HB2 H 1 1.95 0.02 . 2 . . . A 44 LYS HB2 . 17818 1 295 . 1 1 44 44 LYS HB3 H 1 1.95 0.02 . 2 . . . A 44 LYS HB3 . 17818 1 296 . 1 1 44 44 LYS HG2 H 1 1.39 0.02 . 2 . . . A 44 LYS HG2 . 17818 1 297 . 1 1 44 44 LYS HG3 H 1 1.27 0.02 . 2 . . . A 44 LYS HG3 . 17818 1 298 . 1 1 44 44 LYS HD2 H 1 1.64 0.02 . 2 . . . A 44 LYS HD2 . 17818 1 299 . 1 1 44 44 LYS HD3 H 1 1.64 0.02 . 2 . . . A 44 LYS HD3 . 17818 1 300 . 1 1 44 44 LYS HE2 H 1 2.98 0.02 . 2 . . . A 44 LYS HE2 . 17818 1 301 . 1 1 44 44 LYS HE3 H 1 2.98 0.02 . 2 . . . A 44 LYS HE3 . 17818 1 302 . 1 1 44 44 LYS CA C 13 53.8 0.2 . 1 . . . A 44 LYS CA . 17818 1 303 . 1 1 44 44 LYS CB C 13 34.1 0.2 . 1 . . . A 44 LYS CB . 17818 1 304 . 1 1 44 44 LYS CG C 13 25.2 0.2 . 1 . . . A 44 LYS CG . 17818 1 305 . 1 1 44 44 LYS CD C 13 28.5 0.2 . 1 . . . A 44 LYS CD . 17818 1 306 . 1 1 44 44 LYS CE C 13 42.1 0.2 . 1 . . . A 44 LYS CE . 17818 1 307 . 1 1 44 44 LYS N N 15 120.3 0.2 . 1 . . . A 44 LYS N . 17818 1 308 . 1 1 45 45 LYS H H 1 8.34 0.02 . 1 . . . A 45 LYS H . 17818 1 309 . 1 1 45 45 LYS HA H 1 4.52 0.02 . 1 . . . A 45 LYS HA . 17818 1 310 . 1 1 45 45 LYS HB2 H 1 1.56 0.02 . 2 . . . A 45 LYS HB2 . 17818 1 311 . 1 1 45 45 LYS HB3 H 1 1.33 0.02 . 2 . . . A 45 LYS HB3 . 17818 1 312 . 1 1 45 45 LYS HG2 H 1 1.28 0.02 . 2 . . . A 45 LYS HG2 . 17818 1 313 . 1 1 45 45 LYS HG3 H 1 1.13 0.02 . 2 . . . A 45 LYS HG3 . 17818 1 314 . 1 1 45 45 LYS HD2 H 1 1.36 0.02 . 2 . . . A 45 LYS HD2 . 17818 1 315 . 1 1 45 45 LYS HD3 H 1 1.36 0.02 . 2 . . . A 45 LYS HD3 . 17818 1 316 . 1 1 45 45 LYS HE2 H 1 2.78 0.02 . 2 . . . A 45 LYS HE2 . 17818 1 317 . 1 1 45 45 LYS HE3 H 1 2.78 0.02 . 2 . . . A 45 LYS HE3 . 17818 1 318 . 1 1 45 45 LYS CA C 13 56.3 0.2 . 1 . . . A 45 LYS CA . 17818 1 319 . 1 1 45 45 LYS CB C 13 32.9 0.2 . 1 . . . A 45 LYS CB . 17818 1 320 . 1 1 45 45 LYS CG C 13 25.2 0.2 . 1 . . . A 45 LYS CG . 17818 1 321 . 1 1 45 45 LYS CD C 13 29.0 0.2 . 1 . . . A 45 LYS CD . 17818 1 322 . 1 1 45 45 LYS CE C 13 41.8 0.2 . 1 . . . A 45 LYS CE . 17818 1 323 . 1 1 45 45 LYS N N 15 120.8 0.2 . 1 . . . A 45 LYS N . 17818 1 324 . 1 1 46 46 VAL H H 1 8.56 0.02 . 1 . . . A 46 VAL H . 17818 1 325 . 1 1 46 46 VAL HA H 1 4.56 0.02 . 1 . . . A 46 VAL HA . 17818 1 326 . 1 1 46 46 VAL HB H 1 1.80 0.02 . 1 . . . A 46 VAL HB . 17818 1 327 . 1 1 46 46 VAL HG11 H 1 0.76 0.02 . 2 . . . A 46 VAL HG11 . 17818 1 328 . 1 1 46 46 VAL HG12 H 1 0.76 0.02 . 2 . . . A 46 VAL HG12 . 17818 1 329 . 1 1 46 46 VAL HG13 H 1 0.76 0.02 . 2 . . . A 46 VAL HG13 . 17818 1 330 . 1 1 46 46 VAL HG21 H 1 0.09 0.02 . 2 . . . A 46 VAL HG21 . 17818 1 331 . 1 1 46 46 VAL HG22 H 1 0.09 0.02 . 2 . . . A 46 VAL HG22 . 17818 1 332 . 1 1 46 46 VAL HG23 H 1 0.09 0.02 . 2 . . . A 46 VAL HG23 . 17818 1 333 . 1 1 46 46 VAL CA C 13 58.9 0.2 . 1 . . . A 46 VAL CA . 17818 1 334 . 1 1 46 46 VAL CB C 13 33.9 0.2 . 1 . . . A 46 VAL CB . 17818 1 335 . 1 1 46 46 VAL CG1 C 13 23.2 0.2 . 2 . . . A 46 VAL CG1 . 17818 1 336 . 1 1 46 46 VAL CG2 C 13 19.3 0.2 . 2 . . . A 46 VAL CG2 . 17818 1 337 . 1 1 46 46 VAL N N 15 117.6 0.2 . 1 . . . A 46 VAL N . 17818 1 338 . 1 1 47 47 THR H H 1 8.13 0.02 . 1 . . . A 47 THR H . 17818 1 339 . 1 1 47 47 THR HA H 1 5.10 0.02 . 1 . . . A 47 THR HA . 17818 1 340 . 1 1 47 47 THR HB H 1 3.82 0.02 . 1 . . . A 47 THR HB . 17818 1 341 . 1 1 47 47 THR HG21 H 1 1.03 0.02 . 1 . . . A 47 THR HG21 . 17818 1 342 . 1 1 47 47 THR HG22 H 1 1.03 0.02 . 1 . . . A 47 THR HG22 . 17818 1 343 . 1 1 47 47 THR HG23 H 1 1.03 0.02 . 1 . . . A 47 THR HG23 . 17818 1 344 . 1 1 47 47 THR CA C 13 61.6 0.2 . 1 . . . A 47 THR CA . 17818 1 345 . 1 1 47 47 THR CB C 13 69.8 0.2 . 1 . . . A 47 THR CB . 17818 1 346 . 1 1 47 47 THR CG2 C 13 21.9 0.2 . 1 . . . A 47 THR CG2 . 17818 1 347 . 1 1 47 47 THR N N 15 115.6 0.2 . 1 . . . A 47 THR N . 17818 1 348 . 1 1 48 48 VAL H H 1 9.74 0.02 . 1 . . . A 48 VAL H . 17818 1 349 . 1 1 48 48 VAL HA H 1 5.79 0.02 . 1 . . . A 48 VAL HA . 17818 1 350 . 1 1 48 48 VAL HB H 1 2.45 0.02 . 1 . . . A 48 VAL HB . 17818 1 351 . 1 1 48 48 VAL HG11 H 1 0.92 0.02 . 2 . . . A 48 VAL HG11 . 17818 1 352 . 1 1 48 48 VAL HG12 H 1 0.92 0.02 . 2 . . . A 48 VAL HG12 . 17818 1 353 . 1 1 48 48 VAL HG13 H 1 0.92 0.02 . 2 . . . A 48 VAL HG13 . 17818 1 354 . 1 1 48 48 VAL HG21 H 1 1.23 0.02 . 2 . . . A 48 VAL HG21 . 17818 1 355 . 1 1 48 48 VAL HG22 H 1 1.23 0.02 . 2 . . . A 48 VAL HG22 . 17818 1 356 . 1 1 48 48 VAL HG23 H 1 1.23 0.02 . 2 . . . A 48 VAL HG23 . 17818 1 357 . 1 1 48 48 VAL CA C 13 58.0 0.2 . 1 . . . A 48 VAL CA . 17818 1 358 . 1 1 48 48 VAL CB C 13 35.5 0.2 . 1 . . . A 48 VAL CB . 17818 1 359 . 1 1 48 48 VAL CG1 C 13 21.6 0.2 . 2 . . . A 48 VAL CG1 . 17818 1 360 . 1 1 48 48 VAL CG2 C 13 19.4 0.2 . 2 . . . A 48 VAL CG2 . 17818 1 361 . 1 1 48 48 VAL N N 15 118.1 0.2 . 1 . . . A 48 VAL N . 17818 1 362 . 1 1 49 49 HIS H H 1 8.63 0.02 . 1 . . . A 49 HIS H . 17818 1 363 . 1 1 49 49 HIS HA H 1 5.81 0.02 . 1 . . . A 49 HIS HA . 17818 1 364 . 1 1 49 49 HIS HB2 H 1 2.89 0.02 . 2 . . . A 49 HIS HB2 . 17818 1 365 . 1 1 49 49 HIS HB3 H 1 2.83 0.02 . 2 . . . A 49 HIS HB3 . 17818 1 366 . 1 1 49 49 HIS HD1 H 1 12.47 0.02 . 1 . . . A 49 HIS HD1 . 17818 1 367 . 1 1 49 49 HIS HD2 H 1 6.99 0.02 . 1 . . . A 49 HIS HD2 . 17818 1 368 . 1 1 49 49 HIS HE1 H 1 7.11 0.02 . 1 . . . A 49 HIS HE1 . 17818 1 369 . 1 1 49 49 HIS CA C 13 54.6 0.2 . 1 . . . A 49 HIS CA . 17818 1 370 . 1 1 49 49 HIS CB C 13 35.6 0.2 . 1 . . . A 49 HIS CB . 17818 1 371 . 1 1 49 49 HIS CD2 C 13 117.6 0.2 . 1 . . . A 49 HIS CD2 . 17818 1 372 . 1 1 49 49 HIS CE1 C 13 136.9 0.2 . 1 . . . A 49 HIS CE1 . 17818 1 373 . 1 1 49 49 HIS N N 15 119.0 0.2 . 1 . . . A 49 HIS N . 17818 1 374 . 1 1 49 49 HIS ND1 N 15 145.1 0.2 . 1 . . . A 49 HIS ND1 . 17818 1 375 . 1 1 50 50 TYR H H 1 9.87 0.02 . 1 . . . A 50 TYR H . 17818 1 376 . 1 1 50 50 TYR HA H 1 6.23 0.02 . 1 . . . A 50 TYR HA . 17818 1 377 . 1 1 50 50 TYR HB2 H 1 2.98 0.02 . 2 . . . A 50 TYR HB2 . 17818 1 378 . 1 1 50 50 TYR HB3 H 1 2.82 0.02 . 2 . . . A 50 TYR HB3 . 17818 1 379 . 1 1 50 50 TYR HD1 H 1 6.95 0.02 . 3 . . . A 50 TYR HD1 . 17818 1 380 . 1 1 50 50 TYR HD2 H 1 6.95 0.02 . 3 . . . A 50 TYR HD2 . 17818 1 381 . 1 1 50 50 TYR HE1 H 1 6.58 0.02 . 3 . . . A 50 TYR HE1 . 17818 1 382 . 1 1 50 50 TYR HE2 H 1 6.58 0.02 . 3 . . . A 50 TYR HE2 . 17818 1 383 . 1 1 50 50 TYR CA C 13 56.0 0.2 . 1 . . . A 50 TYR CA . 17818 1 384 . 1 1 50 50 TYR CB C 13 43.5 0.2 . 1 . . . A 50 TYR CB . 17818 1 385 . 1 1 50 50 TYR CD1 C 13 133.2 0.2 . 3 . . . A 50 TYR CD1 . 17818 1 386 . 1 1 50 50 TYR CD2 C 13 133.2 0.2 . 3 . . . A 50 TYR CD2 . 17818 1 387 . 1 1 50 50 TYR CE1 C 13 117.6 0.2 . 3 . . . A 50 TYR CE1 . 17818 1 388 . 1 1 50 50 TYR CE2 C 13 117.6 0.2 . 3 . . . A 50 TYR CE2 . 17818 1 389 . 1 1 50 50 TYR N N 15 116.8 0.2 . 1 . . . A 50 TYR N . 17818 1 390 . 1 1 51 51 ASP H H 1 8.84 0.02 . 1 . . . A 51 ASP H . 17818 1 391 . 1 1 51 51 ASP HA H 1 4.95 0.02 . 1 . . . A 51 ASP HA . 17818 1 392 . 1 1 51 51 ASP HB2 H 1 2.68 0.02 . 2 . . . A 51 ASP HB2 . 17818 1 393 . 1 1 51 51 ASP HB3 H 1 2.50 0.02 . 2 . . . A 51 ASP HB3 . 17818 1 394 . 1 1 51 51 ASP CA C 13 54.4 0.2 . 1 . . . A 51 ASP CA . 17818 1 395 . 1 1 51 51 ASP CB C 13 44.9 0.2 . 1 . . . A 51 ASP CB . 17818 1 396 . 1 1 51 51 ASP N N 15 120.4 0.2 . 1 . . . A 51 ASP N . 17818 1 397 . 1 1 52 52 GLY H H 1 9.13 0.02 . 1 . . . A 52 GLY H . 17818 1 398 . 1 1 52 52 GLY HA2 H 1 4.36 0.02 . 2 . . . A 52 GLY HA2 . 17818 1 399 . 1 1 52 52 GLY HA3 H 1 2.26 0.02 . 2 . . . A 52 GLY HA3 . 17818 1 400 . 1 1 52 52 GLY CA C 13 45.3 0.2 . 1 . . . A 52 GLY CA . 17818 1 401 . 1 1 52 52 GLY N N 15 112.5 0.2 . 1 . . . A 52 GLY N . 17818 1 402 . 1 1 53 53 ARG H H 1 9.37 0.02 . 1 . . . A 53 ARG H . 17818 1 403 . 1 1 53 53 ARG HA H 1 5.03 0.02 . 1 . . . A 53 ARG HA . 17818 1 404 . 1 1 53 53 ARG HB2 H 1 1.63 0.02 . 2 . . . A 53 ARG HB2 . 17818 1 405 . 1 1 53 53 ARG HB3 H 1 1.43 0.02 . 2 . . . A 53 ARG HB3 . 17818 1 406 . 1 1 53 53 ARG HG2 H 1 1.26 0.02 . 2 . . . A 53 ARG HG2 . 17818 1 407 . 1 1 53 53 ARG HG3 H 1 1.26 0.02 . 2 . . . A 53 ARG HG3 . 17818 1 408 . 1 1 53 53 ARG HD2 H 1 3.10 0.02 . 2 . . . A 53 ARG HD2 . 17818 1 409 . 1 1 53 53 ARG HD3 H 1 2.93 0.02 . 2 . . . A 53 ARG HD3 . 17818 1 410 . 1 1 53 53 ARG CA C 13 53.9 0.2 . 1 . . . A 53 ARG CA . 17818 1 411 . 1 1 53 53 ARG CB C 13 34.8 0.2 . 1 . . . A 53 ARG CB . 17818 1 412 . 1 1 53 53 ARG CG C 13 27.4 0.2 . 1 . . . A 53 ARG CG . 17818 1 413 . 1 1 53 53 ARG CD C 13 43.8 0.2 . 1 . . . A 53 ARG CD . 17818 1 414 . 1 1 53 53 ARG N N 15 125.2 0.2 . 1 . . . A 53 ARG N . 17818 1 415 . 1 1 54 54 PHE H H 1 8.77 0.02 . 1 . . . A 54 PHE H . 17818 1 416 . 1 1 54 54 PHE HA H 1 4.24 0.02 . 1 . . . A 54 PHE HA . 17818 1 417 . 1 1 54 54 PHE HB2 H 1 3.55 0.02 . 2 . . . A 54 PHE HB2 . 17818 1 418 . 1 1 54 54 PHE HB3 H 1 3.26 0.02 . 2 . . . A 54 PHE HB3 . 17818 1 419 . 1 1 54 54 PHE HD1 H 1 7.45 0.02 . 3 . . . A 54 PHE HD1 . 17818 1 420 . 1 1 54 54 PHE HD2 H 1 7.45 0.02 . 3 . . . A 54 PHE HD2 . 17818 1 421 . 1 1 54 54 PHE HE1 H 1 7.16 0.02 . 3 . . . A 54 PHE HE1 . 17818 1 422 . 1 1 54 54 PHE HE2 H 1 7.16 0.02 . 3 . . . A 54 PHE HE2 . 17818 1 423 . 1 1 54 54 PHE CA C 13 57.3 0.2 . 1 . . . A 54 PHE CA . 17818 1 424 . 1 1 54 54 PHE CB C 13 37.7 0.2 . 1 . . . A 54 PHE CB . 17818 1 425 . 1 1 54 54 PHE CD1 C 13 131.6 0.2 . 3 . . . A 54 PHE CD1 . 17818 1 426 . 1 1 54 54 PHE CD2 C 13 131.6 0.2 . 3 . . . A 54 PHE CD2 . 17818 1 427 . 1 1 54 54 PHE N N 15 119.4 0.2 . 1 . . . A 54 PHE N . 17818 1 428 . 1 1 55 55 PRO HA H 1 4.28 0.02 . 1 . . . A 55 PRO HA . 17818 1 429 . 1 1 55 55 PRO HB2 H 1 2.48 0.02 . 2 . . . A 55 PRO HB2 . 17818 1 430 . 1 1 55 55 PRO HB3 H 1 2.48 0.02 . 2 . . . A 55 PRO HB3 . 17818 1 431 . 1 1 55 55 PRO HG2 H 1 2.29 0.02 . 2 . . . A 55 PRO HG2 . 17818 1 432 . 1 1 55 55 PRO HG3 H 1 1.77 0.02 . 2 . . . A 55 PRO HG3 . 17818 1 433 . 1 1 55 55 PRO HD2 H 1 4.37 0.02 . 2 . . . A 55 PRO HD2 . 17818 1 434 . 1 1 55 55 PRO HD3 H 1 4.17 0.02 . 2 . . . A 55 PRO HD3 . 17818 1 435 . 1 1 55 55 PRO CA C 13 65.7 0.2 . 1 . . . A 55 PRO CA . 17818 1 436 . 1 1 55 55 PRO CB C 13 31.8 0.2 . 1 . . . A 55 PRO CB . 17818 1 437 . 1 1 55 55 PRO CG C 13 28.5 0.2 . 1 . . . A 55 PRO CG . 17818 1 438 . 1 1 55 55 PRO CD C 13 51.1 0.2 . 1 . . . A 55 PRO CD . 17818 1 439 . 1 1 56 56 ASP H H 1 7.78 0.02 . 1 . . . A 56 ASP H . 17818 1 440 . 1 1 56 56 ASP HA H 1 4.47 0.02 . 1 . . . A 56 ASP HA . 17818 1 441 . 1 1 56 56 ASP HB2 H 1 3.02 0.02 . 2 . . . A 56 ASP HB2 . 17818 1 442 . 1 1 56 56 ASP HB3 H 1 2.66 0.02 . 2 . . . A 56 ASP HB3 . 17818 1 443 . 1 1 56 56 ASP CA C 13 53.9 0.2 . 1 . . . A 56 ASP CA . 17818 1 444 . 1 1 56 56 ASP CB C 13 39.8 0.2 . 1 . . . A 56 ASP CB . 17818 1 445 . 1 1 56 56 ASP N N 15 113.6 0.2 . 1 . . . A 56 ASP N . 17818 1 446 . 1 1 57 57 GLY H H 1 8.44 0.02 . 1 . . . A 57 GLY H . 17818 1 447 . 1 1 57 57 GLY HA2 H 1 4.43 0.02 . 2 . . . A 57 GLY HA2 . 17818 1 448 . 1 1 57 57 GLY HA3 H 1 4.43 0.02 . 2 . . . A 57 GLY HA3 . 17818 1 449 . 1 1 57 57 GLY CA C 13 44.9 0.2 . 1 . . . A 57 GLY CA . 17818 1 450 . 1 1 57 57 GLY N N 15 108.7 0.2 . 1 . . . A 57 GLY N . 17818 1 451 . 1 1 58 58 LYS H H 1 8.23 0.02 . 1 . . . A 58 LYS H . 17818 1 452 . 1 1 58 58 LYS HA H 1 4.25 0.02 . 1 . . . A 58 LYS HA . 17818 1 453 . 1 1 58 58 LYS HB2 H 1 2.10 0.02 . 2 . . . A 58 LYS HB2 . 17818 1 454 . 1 1 58 58 LYS HB3 H 1 2.10 0.02 . 2 . . . A 58 LYS HB3 . 17818 1 455 . 1 1 58 58 LYS HG2 H 1 1.57 0.02 . 2 . . . A 58 LYS HG2 . 17818 1 456 . 1 1 58 58 LYS HG3 H 1 1.47 0.02 . 2 . . . A 58 LYS HG3 . 17818 1 457 . 1 1 58 58 LYS HD2 H 1 1.80 0.02 . 2 . . . A 58 LYS HD2 . 17818 1 458 . 1 1 58 58 LYS HD3 H 1 1.80 0.02 . 2 . . . A 58 LYS HD3 . 17818 1 459 . 1 1 58 58 LYS HE2 H 1 3.07 0.02 . 2 . . . A 58 LYS HE2 . 17818 1 460 . 1 1 58 58 LYS HE3 H 1 3.07 0.02 . 2 . . . A 58 LYS HE3 . 17818 1 461 . 1 1 58 58 LYS CA C 13 57.5 0.2 . 1 . . . A 58 LYS CA . 17818 1 462 . 1 1 58 58 LYS CB C 13 32.6 0.2 . 1 . . . A 58 LYS CB . 17818 1 463 . 1 1 58 58 LYS CG C 13 25.1 0.2 . 1 . . . A 58 LYS CG . 17818 1 464 . 1 1 58 58 LYS CD C 13 29.0 0.2 . 1 . . . A 58 LYS CD . 17818 1 465 . 1 1 58 58 LYS CE C 13 42.2 0.2 . 1 . . . A 58 LYS CE . 17818 1 466 . 1 1 58 58 LYS N N 15 122.8 0.2 . 1 . . . A 58 LYS N . 17818 1 467 . 1 1 59 59 GLN H H 1 8.81 0.02 . 1 . . . A 59 GLN H . 17818 1 468 . 1 1 59 59 GLN HA H 1 4.45 0.02 . 1 . . . A 59 GLN HA . 17818 1 469 . 1 1 59 59 GLN HG2 H 1 2.35 0.02 . 2 . . . A 59 GLN HG2 . 17818 1 470 . 1 1 59 59 GLN HG3 H 1 2.02 0.02 . 2 . . . A 59 GLN HG3 . 17818 1 471 . 1 1 59 59 GLN HE21 H 1 8.00 0.02 . 2 . . . A 59 GLN HE21 . 17818 1 472 . 1 1 59 59 GLN HE22 H 1 6.79 0.02 . 2 . . . A 59 GLN HE22 . 17818 1 473 . 1 1 59 59 GLN CA C 13 56.3 0.2 . 1 . . . A 59 GLN CA . 17818 1 474 . 1 1 59 59 GLN CB C 13 30.9 0.2 . 1 . . . A 59 GLN CB . 17818 1 475 . 1 1 59 59 GLN CG C 13 34.7 0.2 . 1 . . . A 59 GLN CG . 17818 1 476 . 1 1 59 59 GLN N N 15 125.8 0.2 . 1 . . . A 59 GLN N . 17818 1 477 . 1 1 59 59 GLN NE2 N 15 113.5 0.2 . 1 . . . A 59 GLN NE2 . 17818 1 478 . 1 1 60 60 PHE H H 1 8.34 0.02 . 1 . . . A 60 PHE H . 17818 1 479 . 1 1 60 60 PHE HA H 1 5.10 0.02 . 1 . . . A 60 PHE HA . 17818 1 480 . 1 1 60 60 PHE HB2 H 1 3.13 0.02 . 2 . . . A 60 PHE HB2 . 17818 1 481 . 1 1 60 60 PHE HB3 H 1 2.54 0.02 . 2 . . . A 60 PHE HB3 . 17818 1 482 . 1 1 60 60 PHE HD1 H 1 6.36 0.02 . 3 . . . A 60 PHE HD1 . 17818 1 483 . 1 1 60 60 PHE HD2 H 1 6.36 0.02 . 3 . . . A 60 PHE HD2 . 17818 1 484 . 1 1 60 60 PHE CA C 13 56.5 0.2 . 1 . . . A 60 PHE CA . 17818 1 485 . 1 1 60 60 PHE CB C 13 40.9 0.2 . 1 . . . A 60 PHE CB . 17818 1 486 . 1 1 60 60 PHE CD1 C 13 132.2 0.2 . 3 . . . A 60 PHE CD1 . 17818 1 487 . 1 1 60 60 PHE CD2 C 13 132.2 0.2 . 3 . . . A 60 PHE CD2 . 17818 1 488 . 1 1 60 60 PHE N N 15 121.2 0.2 . 1 . . . A 60 PHE N . 17818 1 489 . 1 1 61 61 ASP H H 1 7.03 0.02 . 1 . . . A 61 ASP H . 17818 1 490 . 1 1 61 61 ASP HB2 H 1 3.26 0.02 . 2 . . . A 61 ASP HB2 . 17818 1 491 . 1 1 61 61 ASP HB3 H 1 2.22 0.02 . 2 . . . A 61 ASP HB3 . 17818 1 492 . 1 1 61 61 ASP CA C 13 54.7 0.2 . 1 . . . A 61 ASP CA . 17818 1 493 . 1 1 61 61 ASP CB C 13 44.2 0.2 . 1 . . . A 61 ASP CB . 17818 1 494 . 1 1 61 61 ASP N N 15 119.1 0.2 . 1 . . . A 61 ASP N . 17818 1 495 . 1 1 62 62 SER H H 1 8.10 0.02 . 1 . . . A 62 SER H . 17818 1 496 . 1 1 62 62 SER HB2 H 1 4.24 0.02 . 2 . . . A 62 SER HB2 . 17818 1 497 . 1 1 62 62 SER HB3 H 1 3.56 0.02 . 2 . . . A 62 SER HB3 . 17818 1 498 . 1 1 62 62 SER CA C 13 57.0 0.2 . 1 . . . A 62 SER CA . 17818 1 499 . 1 1 62 62 SER CB C 13 64.8 0.2 . 1 . . . A 62 SER CB . 17818 1 500 . 1 1 62 62 SER N N 15 117.4 0.2 . 1 . . . A 62 SER N . 17818 1 501 . 1 1 63 63 SER H H 1 8.07 0.02 . 1 . . . A 63 SER H . 17818 1 502 . 1 1 63 63 SER HA H 1 4.20 0.02 . 1 . . . A 63 SER HA . 17818 1 503 . 1 1 63 63 SER HB2 H 1 4.20 0.02 . 2 . . . A 63 SER HB2 . 17818 1 504 . 1 1 63 63 SER HB3 H 1 3.80 0.02 . 2 . . . A 63 SER HB3 . 17818 1 505 . 1 1 63 63 SER CA C 13 61.3 0.2 . 1 . . . A 63 SER CA . 17818 1 506 . 1 1 63 63 SER CB C 13 61.3 0.2 . 1 . . . A 63 SER CB . 17818 1 507 . 1 1 63 63 SER N N 15 123.6 0.2 . 1 . . . A 63 SER N . 17818 1 508 . 1 1 64 64 ARG H H 1 8.81 0.02 . 1 . . . A 64 ARG H . 17818 1 509 . 1 1 64 64 ARG HA H 1 3.62 0.02 . 1 . . . A 64 ARG HA . 17818 1 510 . 1 1 64 64 ARG HB2 H 1 1.12 0.02 . 2 . . . A 64 ARG HB2 . 17818 1 511 . 1 1 64 64 ARG HB3 H 1 0.61 0.02 . 2 . . . A 64 ARG HB3 . 17818 1 512 . 1 1 64 64 ARG HG2 H 1 1.48 0.02 . 2 . . . A 64 ARG HG2 . 17818 1 513 . 1 1 64 64 ARG HG3 H 1 1.48 0.02 . 2 . . . A 64 ARG HG3 . 17818 1 514 . 1 1 64 64 ARG HD2 H 1 3.01 0.02 . 2 . . . A 64 ARG HD2 . 17818 1 515 . 1 1 64 64 ARG HD3 H 1 2.83 0.02 . 2 . . . A 64 ARG HD3 . 17818 1 516 . 1 1 64 64 ARG CA C 13 59.3 0.2 . 1 . . . A 64 ARG CA . 17818 1 517 . 1 1 64 64 ARG CB C 13 28.8 0.2 . 1 . . . A 64 ARG CB . 17818 1 518 . 1 1 64 64 ARG CG C 13 28.8 0.2 . 1 . . . A 64 ARG CG . 17818 1 519 . 1 1 64 64 ARG CD C 13 42.5 0.2 . 1 . . . A 64 ARG CD . 17818 1 520 . 1 1 64 64 ARG N N 15 124.0 0.2 . 1 . . . A 64 ARG N . 17818 1 521 . 1 1 65 65 SER H H 1 7.80 0.02 . 1 . . . A 65 SER H . 17818 1 522 . 1 1 65 65 SER HA H 1 4.19 0.02 . 1 . . . A 65 SER HA . 17818 1 523 . 1 1 65 65 SER HB2 H 1 3.90 0.02 . 2 . . . A 65 SER HB2 . 17818 1 524 . 1 1 65 65 SER HB3 H 1 3.90 0.02 . 2 . . . A 65 SER HB3 . 17818 1 525 . 1 1 65 65 SER CA C 13 60.7 0.2 . 1 . . . A 65 SER CA . 17818 1 526 . 1 1 65 65 SER CB C 13 62.7 0.2 . 1 . . . A 65 SER CB . 17818 1 527 . 1 1 65 65 SER N N 15 114.6 0.2 . 1 . . . A 65 SER N . 17818 1 528 . 1 1 66 66 ARG H H 1 7.11 0.02 . 1 . . . A 66 ARG H . 17818 1 529 . 1 1 66 66 ARG HA H 1 4.42 0.02 . 1 . . . A 66 ARG HA . 17818 1 530 . 1 1 66 66 ARG HB2 H 1 2.12 0.02 . 2 . . . A 66 ARG HB2 . 17818 1 531 . 1 1 66 66 ARG HB3 H 1 2.04 0.02 . 2 . . . A 66 ARG HB3 . 17818 1 532 . 1 1 66 66 ARG HG2 H 1 1.87 0.02 . 2 . . . A 66 ARG HG2 . 17818 1 533 . 1 1 66 66 ARG HG3 H 1 1.71 0.02 . 2 . . . A 66 ARG HG3 . 17818 1 534 . 1 1 66 66 ARG HD2 H 1 3.48 0.02 . 2 . . . A 66 ARG HD2 . 17818 1 535 . 1 1 66 66 ARG HD3 H 1 3.30 0.02 . 2 . . . A 66 ARG HD3 . 17818 1 536 . 1 1 66 66 ARG CA C 13 57.1 0.2 . 1 . . . A 66 ARG CA . 17818 1 537 . 1 1 66 66 ARG CB C 13 31.5 0.2 . 1 . . . A 66 ARG CB . 17818 1 538 . 1 1 66 66 ARG CG C 13 28.9 0.2 . 1 . . . A 66 ARG CG . 17818 1 539 . 1 1 66 66 ARG CD C 13 43.6 0.2 . 1 . . . A 66 ARG CD . 17818 1 540 . 1 1 66 66 ARG N N 15 118.0 0.2 . 1 . . . A 66 ARG N . 17818 1 541 . 1 1 67 67 GLY H H 1 7.80 0.02 . 1 . . . A 67 GLY H . 17818 1 542 . 1 1 67 67 GLY HA2 H 1 4.19 0.02 . 2 . . . A 67 GLY HA2 . 17818 1 543 . 1 1 67 67 GLY HA3 H 1 3.87 0.02 . 2 . . . A 67 GLY HA3 . 17818 1 544 . 1 1 67 67 GLY CA C 13 45.8 0.2 . 1 . . . A 67 GLY CA . 17818 1 545 . 1 1 67 67 GLY N N 15 106.7 0.2 . 1 . . . A 67 GLY N . 17818 1 546 . 1 1 68 68 LYS H H 1 7.44 0.02 . 1 . . . A 68 LYS H . 17818 1 547 . 1 1 68 68 LYS HA H 1 5.01 0.02 . 1 . . . A 68 LYS HA . 17818 1 548 . 1 1 68 68 LYS HB2 H 1 1.91 0.02 . 2 . . . A 68 LYS HB2 . 17818 1 549 . 1 1 68 68 LYS HB3 H 1 1.74 0.02 . 2 . . . A 68 LYS HB3 . 17818 1 550 . 1 1 68 68 LYS CA C 13 53.1 0.2 . 1 . . . A 68 LYS CA . 17818 1 551 . 1 1 68 68 LYS CB C 13 34.9 0.2 . 1 . . . A 68 LYS CB . 17818 1 552 . 1 1 68 68 LYS N N 15 117.6 0.2 . 1 . . . A 68 LYS N . 17818 1 553 . 1 1 69 69 PRO HA H 1 4.06 0.02 . 1 . . . A 69 PRO HA . 17818 1 554 . 1 1 69 69 PRO HB2 H 1 1.46 0.02 . 2 . . . A 69 PRO HB2 . 17818 1 555 . 1 1 69 69 PRO HB3 H 1 1.20 0.02 . 2 . . . A 69 PRO HB3 . 17818 1 556 . 1 1 69 69 PRO HG2 H 1 1.72 0.02 . 2 . . . A 69 PRO HG2 . 17818 1 557 . 1 1 69 69 PRO HG3 H 1 1.39 0.02 . 2 . . . A 69 PRO HG3 . 17818 1 558 . 1 1 69 69 PRO HD2 H 1 3.69 0.02 . 2 . . . A 69 PRO HD2 . 17818 1 559 . 1 1 69 69 PRO HD3 H 1 3.62 0.02 . 2 . . . A 69 PRO HD3 . 17818 1 560 . 1 1 69 69 PRO CA C 13 62.7 0.2 . 1 . . . A 69 PRO CA . 17818 1 561 . 1 1 69 69 PRO CB C 13 32.3 0.2 . 1 . . . A 69 PRO CB . 17818 1 562 . 1 1 69 69 PRO CG C 13 26.4 0.2 . 1 . . . A 69 PRO CG . 17818 1 563 . 1 1 69 69 PRO CD C 13 50.4 0.2 . 1 . . . A 69 PRO CD . 17818 1 564 . 1 1 70 70 PHE H H 1 9.18 0.02 . 1 . . . A 70 PHE H . 17818 1 565 . 1 1 70 70 PHE HA H 1 5.04 0.02 . 1 . . . A 70 PHE HA . 17818 1 566 . 1 1 70 70 PHE HB2 H 1 3.59 0.02 . 2 . . . A 70 PHE HB2 . 17818 1 567 . 1 1 70 70 PHE HB3 H 1 3.28 0.02 . 2 . . . A 70 PHE HB3 . 17818 1 568 . 1 1 70 70 PHE HD1 H 1 7.40 0.02 . 3 . . . A 70 PHE HD1 . 17818 1 569 . 1 1 70 70 PHE HD2 H 1 7.40 0.02 . 3 . . . A 70 PHE HD2 . 17818 1 570 . 1 1 70 70 PHE CA C 13 57.1 0.2 . 1 . . . A 70 PHE CA . 17818 1 571 . 1 1 70 70 PHE CB C 13 42.9 0.2 . 1 . . . A 70 PHE CB . 17818 1 572 . 1 1 70 70 PHE CD1 C 13 131.4 0.2 . 3 . . . A 70 PHE CD1 . 17818 1 573 . 1 1 70 70 PHE CD2 C 13 131.4 0.2 . 3 . . . A 70 PHE CD2 . 17818 1 574 . 1 1 70 70 PHE N N 15 123.2 0.2 . 1 . . . A 70 PHE N . 17818 1 575 . 1 1 71 71 GLN H H 1 8.02 0.02 . 1 . . . A 71 GLN H . 17818 1 576 . 1 1 71 71 GLN HA H 1 5.75 0.02 . 1 . . . A 71 GLN HA . 17818 1 577 . 1 1 71 71 GLN HB2 H 1 1.73 0.02 . 2 . . . A 71 GLN HB2 . 17818 1 578 . 1 1 71 71 GLN HB3 H 1 1.66 0.02 . 2 . . . A 71 GLN HB3 . 17818 1 579 . 1 1 71 71 GLN HG2 H 1 2.19 0.02 . 2 . . . A 71 GLN HG2 . 17818 1 580 . 1 1 71 71 GLN HG3 H 1 2.12 0.02 . 2 . . . A 71 GLN HG3 . 17818 1 581 . 1 1 71 71 GLN HE21 H 1 7.19 0.02 . 2 . . . A 71 GLN HE21 . 17818 1 582 . 1 1 71 71 GLN HE22 H 1 6.87 0.02 . 2 . . . A 71 GLN HE22 . 17818 1 583 . 1 1 71 71 GLN CA C 13 53.3 0.2 . 1 . . . A 71 GLN CA . 17818 1 584 . 1 1 71 71 GLN CB C 13 32.9 0.2 . 1 . . . A 71 GLN CB . 17818 1 585 . 1 1 71 71 GLN CG C 13 34.5 0.2 . 1 . . . A 71 GLN CG . 17818 1 586 . 1 1 71 71 GLN N N 15 126.0 0.2 . 1 . . . A 71 GLN N . 17818 1 587 . 1 1 71 71 GLN NE2 N 15 112.7 0.2 . 1 . . . A 71 GLN NE2 . 17818 1 588 . 1 1 72 72 PHE H H 1 8.11 0.02 . 1 . . . A 72 PHE H . 17818 1 589 . 1 1 72 72 PHE HA H 1 4.70 0.02 . 1 . . . A 72 PHE HA . 17818 1 590 . 1 1 72 72 PHE HB2 H 1 2.98 0.02 . 2 . . . A 72 PHE HB2 . 17818 1 591 . 1 1 72 72 PHE HB3 H 1 2.84 0.02 . 2 . . . A 72 PHE HB3 . 17818 1 592 . 1 1 72 72 PHE HD1 H 1 6.92 0.02 . 3 . . . A 72 PHE HD1 . 17818 1 593 . 1 1 72 72 PHE HD2 H 1 6.92 0.02 . 3 . . . A 72 PHE HD2 . 17818 1 594 . 1 1 72 72 PHE CA C 13 55.5 0.2 . 1 . . . A 72 PHE CA . 17818 1 595 . 1 1 72 72 PHE CB C 13 40.9 0.2 . 1 . . . A 72 PHE CB . 17818 1 596 . 1 1 72 72 PHE CD1 C 13 131.1 0.2 . 3 . . . A 72 PHE CD1 . 17818 1 597 . 1 1 72 72 PHE CD2 C 13 131.1 0.2 . 3 . . . A 72 PHE CD2 . 17818 1 598 . 1 1 72 72 PHE N N 15 116.8 0.2 . 1 . . . A 72 PHE N . 17818 1 599 . 1 1 73 73 THR H H 1 9.08 0.02 . 1 . . . A 73 THR H . 17818 1 600 . 1 1 73 73 THR HA H 1 3.96 0.02 . 1 . . . A 73 THR HA . 17818 1 601 . 1 1 73 73 THR HB H 1 3.87 0.02 . 1 . . . A 73 THR HB . 17818 1 602 . 1 1 73 73 THR HG21 H 1 0.84 0.02 . 1 . . . A 73 THR HG21 . 17818 1 603 . 1 1 73 73 THR HG22 H 1 0.84 0.02 . 1 . . . A 73 THR HG22 . 17818 1 604 . 1 1 73 73 THR HG23 H 1 0.84 0.02 . 1 . . . A 73 THR HG23 . 17818 1 605 . 1 1 73 73 THR CA C 13 62.6 0.2 . 1 . . . A 73 THR CA . 17818 1 606 . 1 1 73 73 THR CB C 13 67.5 0.2 . 1 . . . A 73 THR CB . 17818 1 607 . 1 1 73 73 THR CG2 C 13 21.4 0.2 . 1 . . . A 73 THR CG2 . 17818 1 608 . 1 1 73 73 THR N N 15 118.8 0.2 . 1 . . . A 73 THR N . 17818 1 609 . 1 1 74 74 LEU H H 1 8.22 0.02 . 1 . . . A 74 LEU H . 17818 1 610 . 1 1 74 74 LEU HA H 1 4.14 0.02 . 1 . . . A 74 LEU HA . 17818 1 611 . 1 1 74 74 LEU HB2 H 1 2.08 0.02 . 2 . . . A 74 LEU HB2 . 17818 1 612 . 1 1 74 74 LEU HB3 H 1 1.12 0.02 . 2 . . . A 74 LEU HB3 . 17818 1 613 . 1 1 74 74 LEU HG H 1 1.63 0.02 . 1 . . . A 74 LEU HG . 17818 1 614 . 1 1 74 74 LEU HD11 H 1 1.09 0.02 . 2 . . . A 74 LEU HD11 . 17818 1 615 . 1 1 74 74 LEU HD12 H 1 1.09 0.02 . 2 . . . A 74 LEU HD12 . 17818 1 616 . 1 1 74 74 LEU HD13 H 1 1.09 0.02 . 2 . . . A 74 LEU HD13 . 17818 1 617 . 1 1 74 74 LEU HD21 H 1 0.63 0.02 . 2 . . . A 74 LEU HD21 . 17818 1 618 . 1 1 74 74 LEU HD22 H 1 0.63 0.02 . 2 . . . A 74 LEU HD22 . 17818 1 619 . 1 1 74 74 LEU HD23 H 1 0.63 0.02 . 2 . . . A 74 LEU HD23 . 17818 1 620 . 1 1 74 74 LEU CA C 13 56.8 0.2 . 1 . . . A 74 LEU CA . 17818 1 621 . 1 1 74 74 LEU CB C 13 41.8 0.2 . 1 . . . A 74 LEU CB . 17818 1 622 . 1 1 74 74 LEU CG C 13 26.1 0.2 . 1 . . . A 74 LEU CG . 17818 1 623 . 1 1 74 74 LEU CD1 C 13 24.6 0.2 . 2 . . . A 74 LEU CD1 . 17818 1 624 . 1 1 74 74 LEU CD2 C 13 26.2 0.2 . 2 . . . A 74 LEU CD2 . 17818 1 625 . 1 1 74 74 LEU N N 15 132.5 0.2 . 1 . . . A 74 LEU N . 17818 1 626 . 1 1 75 75 GLY H H 1 9.85 0.02 . 1 . . . A 75 GLY H . 17818 1 627 . 1 1 75 75 GLY HA2 H 1 4.11 0.02 . 2 . . . A 75 GLY HA2 . 17818 1 628 . 1 1 75 75 GLY HA3 H 1 3.66 0.02 . 2 . . . A 75 GLY HA3 . 17818 1 629 . 1 1 75 75 GLY CA C 13 46.2 0.2 . 1 . . . A 75 GLY CA . 17818 1 630 . 1 1 75 75 GLY N N 15 118.1 0.2 . 1 . . . A 75 GLY N . 17818 1 631 . 1 1 76 76 ALA H H 1 7.55 0.02 . 1 . . . A 76 ALA H . 17818 1 632 . 1 1 76 76 ALA HA H 1 4.50 0.02 . 1 . . . A 76 ALA HA . 17818 1 633 . 1 1 76 76 ALA HB1 H 1 1.40 0.02 . 1 . . . A 76 ALA HB1 . 17818 1 634 . 1 1 76 76 ALA HB2 H 1 1.40 0.02 . 1 . . . A 76 ALA HB2 . 17818 1 635 . 1 1 76 76 ALA HB3 H 1 1.40 0.02 . 1 . . . A 76 ALA HB3 . 17818 1 636 . 1 1 76 76 ALA CA C 13 51.9 0.2 . 1 . . . A 76 ALA CA . 17818 1 637 . 1 1 76 76 ALA CB C 13 20.2 0.2 . 1 . . . A 76 ALA CB . 17818 1 638 . 1 1 76 76 ALA N N 15 120.6 0.2 . 1 . . . A 76 ALA N . 17818 1 639 . 1 1 77 77 GLY H H 1 8.79 0.02 . 1 . . . A 77 GLY H . 17818 1 640 . 1 1 77 77 GLY HA2 H 1 4.04 0.02 . 2 . . . A 77 GLY HA2 . 17818 1 641 . 1 1 77 77 GLY HA3 H 1 4.04 0.02 . 2 . . . A 77 GLY HA3 . 17818 1 642 . 1 1 77 77 GLY CA C 13 46.4 0.2 . 1 . . . A 77 GLY CA . 17818 1 643 . 1 1 77 77 GLY N N 15 110.5 0.2 . 1 . . . A 77 GLY N . 17818 1 644 . 1 1 78 78 GLU H H 1 9.24 0.02 . 1 . . . A 78 GLU H . 17818 1 645 . 1 1 78 78 GLU HA H 1 4.15 0.02 . 1 . . . A 78 GLU HA . 17818 1 646 . 1 1 78 78 GLU HB2 H 1 2.14 0.02 . 2 . . . A 78 GLU HB2 . 17818 1 647 . 1 1 78 78 GLU HB3 H 1 2.14 0.02 . 2 . . . A 78 GLU HB3 . 17818 1 648 . 1 1 78 78 GLU HG2 H 1 2.35 0.02 . 2 . . . A 78 GLU HG2 . 17818 1 649 . 1 1 78 78 GLU HG3 H 1 2.27 0.02 . 2 . . . A 78 GLU HG3 . 17818 1 650 . 1 1 78 78 GLU CA C 13 57.2 0.2 . 1 . . . A 78 GLU CA . 17818 1 651 . 1 1 78 78 GLU CB C 13 30.9 0.2 . 1 . . . A 78 GLU CB . 17818 1 652 . 1 1 78 78 GLU CG C 13 36.6 0.2 . 1 . . . A 78 GLU CG . 17818 1 653 . 1 1 78 78 GLU N N 15 119.4 0.2 . 1 . . . A 78 GLU N . 17818 1 654 . 1 1 79 79 VAL H H 1 6.76 0.02 . 1 . . . A 79 VAL H . 17818 1 655 . 1 1 79 79 VAL HA H 1 4.22 0.02 . 1 . . . A 79 VAL HA . 17818 1 656 . 1 1 79 79 VAL HB H 1 1.40 0.02 . 1 . . . A 79 VAL HB . 17818 1 657 . 1 1 79 79 VAL HG11 H 1 0.16 0.02 . 2 . . . A 79 VAL HG11 . 17818 1 658 . 1 1 79 79 VAL HG12 H 1 0.16 0.02 . 2 . . . A 79 VAL HG12 . 17818 1 659 . 1 1 79 79 VAL HG13 H 1 0.16 0.02 . 2 . . . A 79 VAL HG13 . 17818 1 660 . 1 1 79 79 VAL HG21 H 1 -0.03 0.02 . 2 . . . A 79 VAL HG21 . 17818 1 661 . 1 1 79 79 VAL HG22 H 1 -0.03 0.02 . 2 . . . A 79 VAL HG22 . 17818 1 662 . 1 1 79 79 VAL HG23 H 1 -0.03 0.02 . 2 . . . A 79 VAL HG23 . 17818 1 663 . 1 1 79 79 VAL CA C 13 57.3 0.2 . 1 . . . A 79 VAL CA . 17818 1 664 . 1 1 79 79 VAL CB C 13 35.4 0.2 . 1 . . . A 79 VAL CB . 17818 1 665 . 1 1 79 79 VAL CG1 C 13 18.3 0.2 . 2 . . . A 79 VAL CG1 . 17818 1 666 . 1 1 79 79 VAL CG2 C 13 21.2 0.2 . 2 . . . A 79 VAL CG2 . 17818 1 667 . 1 1 79 79 VAL N N 15 108.6 0.2 . 1 . . . A 79 VAL N . 17818 1 668 . 1 1 80 80 ILE H H 1 7.30 0.02 . 1 . . . A 80 ILE H . 17818 1 669 . 1 1 80 80 ILE HA H 1 3.80 0.02 . 1 . . . A 80 ILE HA . 17818 1 670 . 1 1 80 80 ILE HB H 1 2.02 0.02 . 1 . . . A 80 ILE HB . 17818 1 671 . 1 1 80 80 ILE HG12 H 1 0.95 0.02 . 2 . . . A 80 ILE HG12 . 17818 1 672 . 1 1 80 80 ILE HG13 H 1 0.47 0.02 . 2 . . . A 80 ILE HG13 . 17818 1 673 . 1 1 80 80 ILE HG21 H 1 -0.01 0.02 . 1 . . . A 80 ILE HG21 . 17818 1 674 . 1 1 80 80 ILE HG22 H 1 -0.01 0.02 . 1 . . . A 80 ILE HG22 . 17818 1 675 . 1 1 80 80 ILE HG23 H 1 -0.01 0.02 . 1 . . . A 80 ILE HG23 . 17818 1 676 . 1 1 80 80 ILE HD11 H 1 0.51 0.02 . 1 . . . A 80 ILE HD11 . 17818 1 677 . 1 1 80 80 ILE HD12 H 1 0.51 0.02 . 1 . . . A 80 ILE HD12 . 17818 1 678 . 1 1 80 80 ILE HD13 H 1 0.51 0.02 . 1 . . . A 80 ILE HD13 . 17818 1 679 . 1 1 80 80 ILE CA C 13 61.8 0.2 . 1 . . . A 80 ILE CA . 17818 1 680 . 1 1 80 80 ILE CB C 13 38.0 0.2 . 1 . . . A 80 ILE CB . 17818 1 681 . 1 1 80 80 ILE CG1 C 13 24.8 0.2 . 1 . . . A 80 ILE CG1 . 17818 1 682 . 1 1 80 80 ILE CG2 C 13 17.3 0.2 . 1 . . . A 80 ILE CG2 . 17818 1 683 . 1 1 80 80 ILE CD1 C 13 14.1 0.2 . 1 . . . A 80 ILE CD1 . 17818 1 684 . 1 1 80 80 ILE N N 15 111.8 0.2 . 1 . . . A 80 ILE N . 17818 1 685 . 1 1 81 81 LYS H H 1 8.88 0.02 . 1 . . . A 81 LYS H . 17818 1 686 . 1 1 81 81 LYS HA H 1 4.16 0.02 . 1 . . . A 81 LYS HA . 17818 1 687 . 1 1 81 81 LYS HB2 H 1 1.71 0.02 . 2 . . . A 81 LYS HB2 . 17818 1 688 . 1 1 81 81 LYS HB3 H 1 1.71 0.02 . 2 . . . A 81 LYS HB3 . 17818 1 689 . 1 1 81 81 LYS HG2 H 1 1.55 0.02 . 2 . . . A 81 LYS HG2 . 17818 1 690 . 1 1 81 81 LYS HG3 H 1 1.47 0.02 . 2 . . . A 81 LYS HG3 . 17818 1 691 . 1 1 81 81 LYS HD2 H 1 1.72 0.02 . 2 . . . A 81 LYS HD2 . 17818 1 692 . 1 1 81 81 LYS HD3 H 1 1.72 0.02 . 2 . . . A 81 LYS HD3 . 17818 1 693 . 1 1 81 81 LYS HE2 H 1 2.99 0.02 . 2 . . . A 81 LYS HE2 . 17818 1 694 . 1 1 81 81 LYS HE3 H 1 2.99 0.02 . 2 . . . A 81 LYS HE3 . 17818 1 695 . 1 1 81 81 LYS CA C 13 59.7 0.2 . 1 . . . A 81 LYS CA . 17818 1 696 . 1 1 81 81 LYS CB C 13 32.8 0.2 . 1 . . . A 81 LYS CB . 17818 1 697 . 1 1 81 81 LYS CG C 13 24.9 0.2 . 1 . . . A 81 LYS CG . 17818 1 698 . 1 1 81 81 LYS CD C 13 28.9 0.2 . 1 . . . A 81 LYS CD . 17818 1 699 . 1 1 81 81 LYS CE C 13 41.8 0.2 . 1 . . . A 81 LYS CE . 17818 1 700 . 1 1 81 81 LYS N N 15 124.7 0.2 . 1 . . . A 81 LYS N . 17818 1 701 . 1 1 82 82 GLY H H 1 9.58 0.02 . 1 . . . A 82 GLY H . 17818 1 702 . 1 1 82 82 GLY HA2 H 1 3.76 0.02 . 2 . . . A 82 GLY HA2 . 17818 1 703 . 1 1 82 82 GLY HA3 H 1 3.51 0.02 . 2 . . . A 82 GLY HA3 . 17818 1 704 . 1 1 82 82 GLY CA C 13 47.3 0.2 . 1 . . . A 82 GLY CA . 17818 1 705 . 1 1 82 82 GLY N N 15 101.7 0.2 . 1 . . . A 82 GLY N . 17818 1 706 . 1 1 83 83 TRP H H 1 7.45 0.02 . 1 . . . A 83 TRP H . 17818 1 707 . 1 1 83 83 TRP HA H 1 4.01 0.02 . 1 . . . A 83 TRP HA . 17818 1 708 . 1 1 83 83 TRP HB2 H 1 2.72 0.02 . 2 . . . A 83 TRP HB2 . 17818 1 709 . 1 1 83 83 TRP HB3 H 1 2.72 0.02 . 2 . . . A 83 TRP HB3 . 17818 1 710 . 1 1 83 83 TRP HD1 H 1 6.17 0.02 . 1 . . . A 83 TRP HD1 . 17818 1 711 . 1 1 83 83 TRP HE3 H 1 6.54 0.02 . 1 . . . A 83 TRP HE3 . 17818 1 712 . 1 1 83 83 TRP HZ2 H 1 6.16 0.02 . 1 . . . A 83 TRP HZ2 . 17818 1 713 . 1 1 83 83 TRP HZ3 H 1 6.50 0.02 . 1 . . . A 83 TRP HZ3 . 17818 1 714 . 1 1 83 83 TRP HH2 H 1 5.65 0.02 . 1 . . . A 83 TRP HH2 . 17818 1 715 . 1 1 83 83 TRP CA C 13 59.3 0.2 . 1 . . . A 83 TRP CA . 17818 1 716 . 1 1 83 83 TRP CB C 13 29.1 0.2 . 1 . . . A 83 TRP CB . 17818 1 717 . 1 1 83 83 TRP CD1 C 13 120.4 0.2 . 1 . . . A 83 TRP CD1 . 17818 1 718 . 1 1 83 83 TRP CE3 C 13 119.6 0.2 . 1 . . . A 83 TRP CE3 . 17818 1 719 . 1 1 83 83 TRP CZ2 C 13 112.0 0.2 . 1 . . . A 83 TRP CZ2 . 17818 1 720 . 1 1 83 83 TRP CZ3 C 13 121.0 0.2 . 1 . . . A 83 TRP CZ3 . 17818 1 721 . 1 1 83 83 TRP CH2 C 13 124.1 0.2 . 1 . . . A 83 TRP CH2 . 17818 1 722 . 1 1 83 83 TRP N N 15 119.3 0.2 . 1 . . . A 83 TRP N . 17818 1 723 . 1 1 84 84 ASP H H 1 7.12 0.02 . 1 . . . A 84 ASP H . 17818 1 724 . 1 1 84 84 ASP HA H 1 4.00 0.02 . 1 . . . A 84 ASP HA . 17818 1 725 . 1 1 84 84 ASP HB2 H 1 2.71 0.02 . 2 . . . A 84 ASP HB2 . 17818 1 726 . 1 1 84 84 ASP HB3 H 1 2.54 0.02 . 2 . . . A 84 ASP HB3 . 17818 1 727 . 1 1 84 84 ASP CA C 13 58.2 0.2 . 1 . . . A 84 ASP CA . 17818 1 728 . 1 1 84 84 ASP CB C 13 41.0 0.2 . 1 . . . A 84 ASP CB . 17818 1 729 . 1 1 84 84 ASP N N 15 120.9 0.2 . 1 . . . A 84 ASP N . 17818 1 730 . 1 1 85 85 GLN H H 1 8.36 0.02 . 1 . . . A 85 GLN H . 17818 1 731 . 1 1 85 85 GLN HA H 1 4.00 0.02 . 1 . . . A 85 GLN HA . 17818 1 732 . 1 1 85 85 GLN HB2 H 1 1.98 0.02 . 2 . . . A 85 GLN HB2 . 17818 1 733 . 1 1 85 85 GLN HB3 H 1 1.88 0.02 . 2 . . . A 85 GLN HB3 . 17818 1 734 . 1 1 85 85 GLN HG2 H 1 2.51 0.02 . 2 . . . A 85 GLN HG2 . 17818 1 735 . 1 1 85 85 GLN HG3 H 1 2.26 0.02 . 2 . . . A 85 GLN HG3 . 17818 1 736 . 1 1 85 85 GLN HE21 H 1 7.40 0.02 . 2 . . . A 85 GLN HE21 . 17818 1 737 . 1 1 85 85 GLN HE22 H 1 6.67 0.02 . 2 . . . A 85 GLN HE22 . 17818 1 738 . 1 1 85 85 GLN CA C 13 58.2 0.2 . 1 . . . A 85 GLN CA . 17818 1 739 . 1 1 85 85 GLN CB C 13 28.9 0.2 . 1 . . . A 85 GLN CB . 17818 1 740 . 1 1 85 85 GLN CG C 13 33.9 0.2 . 1 . . . A 85 GLN CG . 17818 1 741 . 1 1 85 85 GLN N N 15 114.5 0.2 . 1 . . . A 85 GLN N . 17818 1 742 . 1 1 85 85 GLN NE2 N 15 108.8 0.2 . 1 . . . A 85 GLN NE2 . 17818 1 743 . 1 1 86 86 GLY H H 1 7.96 0.02 . 1 . . . A 86 GLY H . 17818 1 744 . 1 1 86 86 GLY HA2 H 1 3.66 0.02 . 2 . . . A 86 GLY HA2 . 17818 1 745 . 1 1 86 86 GLY HA3 H 1 2.91 0.02 . 2 . . . A 86 GLY HA3 . 17818 1 746 . 1 1 86 86 GLY CA C 13 47.7 0.2 . 1 . . . A 86 GLY CA . 17818 1 747 . 1 1 86 86 GLY N N 15 106.3 0.2 . 1 . . . A 86 GLY N . 17818 1 748 . 1 1 87 87 VAL H H 1 9.09 0.02 . 1 . . . A 87 VAL H . 17818 1 749 . 1 1 87 87 VAL HA H 1 3.63 0.02 . 1 . . . A 87 VAL HA . 17818 1 750 . 1 1 87 87 VAL HB H 1 2.19 0.02 . 1 . . . A 87 VAL HB . 17818 1 751 . 1 1 87 87 VAL HG11 H 1 0.94 0.02 . 2 . . . A 87 VAL HG11 . 17818 1 752 . 1 1 87 87 VAL HG12 H 1 0.94 0.02 . 2 . . . A 87 VAL HG12 . 17818 1 753 . 1 1 87 87 VAL HG13 H 1 0.94 0.02 . 2 . . . A 87 VAL HG13 . 17818 1 754 . 1 1 87 87 VAL HG21 H 1 0.95 0.02 . 2 . . . A 87 VAL HG21 . 17818 1 755 . 1 1 87 87 VAL HG22 H 1 0.95 0.02 . 2 . . . A 87 VAL HG22 . 17818 1 756 . 1 1 87 87 VAL HG23 H 1 0.95 0.02 . 2 . . . A 87 VAL HG23 . 17818 1 757 . 1 1 87 87 VAL CA C 13 66.4 0.2 . 1 . . . A 87 VAL CA . 17818 1 758 . 1 1 87 87 VAL CB C 13 30.3 0.2 . 1 . . . A 87 VAL CB . 17818 1 759 . 1 1 87 87 VAL CG1 C 13 23.7 0.2 . 2 . . . A 87 VAL CG1 . 17818 1 760 . 1 1 87 87 VAL CG2 C 13 22.0 0.2 . 2 . . . A 87 VAL CG2 . 17818 1 761 . 1 1 87 87 VAL N N 15 125.3 0.2 . 1 . . . A 87 VAL N . 17818 1 762 . 1 1 88 88 ALA H H 1 6.75 0.02 . 1 . . . A 88 ALA H . 17818 1 763 . 1 1 88 88 ALA HA H 1 3.99 0.02 . 1 . . . A 88 ALA HA . 17818 1 764 . 1 1 88 88 ALA HB1 H 1 1.56 0.02 . 1 . . . A 88 ALA HB1 . 17818 1 765 . 1 1 88 88 ALA HB2 H 1 1.56 0.02 . 1 . . . A 88 ALA HB2 . 17818 1 766 . 1 1 88 88 ALA HB3 H 1 1.56 0.02 . 1 . . . A 88 ALA HB3 . 17818 1 767 . 1 1 88 88 ALA CA C 13 54.3 0.2 . 1 . . . A 88 ALA CA . 17818 1 768 . 1 1 88 88 ALA CB C 13 18.6 0.2 . 1 . . . A 88 ALA CB . 17818 1 769 . 1 1 88 88 ALA N N 15 116.5 0.2 . 1 . . . A 88 ALA N . 17818 1 770 . 1 1 89 89 THR H H 1 7.40 0.02 . 1 . . . A 89 THR H . 17818 1 771 . 1 1 89 89 THR HA H 1 4.52 0.02 . 1 . . . A 89 THR HA . 17818 1 772 . 1 1 89 89 THR HB H 1 4.62 0.02 . 1 . . . A 89 THR HB . 17818 1 773 . 1 1 89 89 THR HG21 H 1 1.47 0.02 . 1 . . . A 89 THR HG21 . 17818 1 774 . 1 1 89 89 THR HG22 H 1 1.47 0.02 . 1 . . . A 89 THR HG22 . 17818 1 775 . 1 1 89 89 THR HG23 H 1 1.47 0.02 . 1 . . . A 89 THR HG23 . 17818 1 776 . 1 1 89 89 THR CA C 13 62.3 0.2 . 1 . . . A 89 THR CA . 17818 1 777 . 1 1 89 89 THR CB C 13 71.1 0.2 . 1 . . . A 89 THR CB . 17818 1 778 . 1 1 89 89 THR CG2 C 13 20.8 0.2 . 1 . . . A 89 THR CG2 . 17818 1 779 . 1 1 89 89 THR N N 15 105.5 0.2 . 1 . . . A 89 THR N . 17818 1 780 . 1 1 90 90 MET H H 1 7.55 0.02 . 1 . . . A 90 MET H . 17818 1 781 . 1 1 90 90 MET HB2 H 1 2.13 0.02 . 2 . . . A 90 MET HB2 . 17818 1 782 . 1 1 90 90 MET HB3 H 1 2.13 0.02 . 2 . . . A 90 MET HB3 . 17818 1 783 . 1 1 90 90 MET HG2 H 1 2.99 0.02 . 2 . . . A 90 MET HG2 . 17818 1 784 . 1 1 90 90 MET HG3 H 1 2.59 0.02 . 2 . . . A 90 MET HG3 . 17818 1 785 . 1 1 90 90 MET HE1 H 1 2.18 0.02 . 1 . . . A 90 MET HE1 . 17818 1 786 . 1 1 90 90 MET HE2 H 1 2.18 0.02 . 1 . . . A 90 MET HE2 . 17818 1 787 . 1 1 90 90 MET HE3 H 1 2.18 0.02 . 1 . . . A 90 MET HE3 . 17818 1 788 . 1 1 90 90 MET CA C 13 56.2 0.2 . 1 . . . A 90 MET CA . 17818 1 789 . 1 1 90 90 MET CB C 13 36.8 0.2 . 1 . . . A 90 MET CB . 17818 1 790 . 1 1 90 90 MET CG C 13 32.7 0.2 . 1 . . . A 90 MET CG . 17818 1 791 . 1 1 90 90 MET CE C 13 18.8 0.2 . 1 . . . A 90 MET CE . 17818 1 792 . 1 1 90 90 MET N N 15 122.4 0.2 . 1 . . . A 90 MET N . 17818 1 793 . 1 1 91 91 THR H H 1 7.35 0.02 . 1 . . . A 91 THR H . 17818 1 794 . 1 1 91 91 THR HA H 1 5.12 0.02 . 1 . . . A 91 THR HA . 17818 1 795 . 1 1 91 91 THR HB H 1 4.38 0.02 . 1 . . . A 91 THR HB . 17818 1 796 . 1 1 91 91 THR HG21 H 1 0.97 0.02 . 1 . . . A 91 THR HG21 . 17818 1 797 . 1 1 91 91 THR HG22 H 1 0.97 0.02 . 1 . . . A 91 THR HG22 . 17818 1 798 . 1 1 91 91 THR HG23 H 1 0.97 0.02 . 1 . . . A 91 THR HG23 . 17818 1 799 . 1 1 91 91 THR CA C 13 59.8 0.2 . 1 . . . A 91 THR CA . 17818 1 800 . 1 1 91 91 THR CB C 13 71.9 0.2 . 1 . . . A 91 THR CB . 17818 1 801 . 1 1 91 91 THR CG2 C 13 21.7 0.2 . 1 . . . A 91 THR CG2 . 17818 1 802 . 1 1 91 91 THR N N 15 105.2 0.2 . 1 . . . A 91 THR N . 17818 1 803 . 1 1 92 92 LEU H H 1 8.18 0.02 . 1 . . . A 92 LEU H . 17818 1 804 . 1 1 92 92 LEU HA H 1 3.60 0.02 . 1 . . . A 92 LEU HA . 17818 1 805 . 1 1 92 92 LEU HB2 H 1 2.01 0.02 . 2 . . . A 92 LEU HB2 . 17818 1 806 . 1 1 92 92 LEU HB3 H 1 1.13 0.02 . 2 . . . A 92 LEU HB3 . 17818 1 807 . 1 1 92 92 LEU HG H 1 0.97 0.02 . 1 . . . A 92 LEU HG . 17818 1 808 . 1 1 92 92 LEU HD11 H 1 0.83 0.02 . 2 . . . A 92 LEU HD11 . 17818 1 809 . 1 1 92 92 LEU HD12 H 1 0.83 0.02 . 2 . . . A 92 LEU HD12 . 17818 1 810 . 1 1 92 92 LEU HD13 H 1 0.83 0.02 . 2 . . . A 92 LEU HD13 . 17818 1 811 . 1 1 92 92 LEU HD21 H 1 0.67 0.02 . 2 . . . A 92 LEU HD21 . 17818 1 812 . 1 1 92 92 LEU HD22 H 1 0.67 0.02 . 2 . . . A 92 LEU HD22 . 17818 1 813 . 1 1 92 92 LEU HD23 H 1 0.67 0.02 . 2 . . . A 92 LEU HD23 . 17818 1 814 . 1 1 92 92 LEU CA C 13 58.1 0.2 . 1 . . . A 92 LEU CA . 17818 1 815 . 1 1 92 92 LEU CB C 13 43.4 0.2 . 1 . . . A 92 LEU CB . 17818 1 816 . 1 1 92 92 LEU CG C 13 26.2 0.2 . 1 . . . A 92 LEU CG . 17818 1 817 . 1 1 92 92 LEU CD1 C 13 23.6 0.2 . 2 . . . A 92 LEU CD1 . 17818 1 818 . 1 1 92 92 LEU CD2 C 13 23.2 0.2 . 2 . . . A 92 LEU CD2 . 17818 1 819 . 1 1 92 92 LEU N N 15 121.2 0.2 . 1 . . . A 92 LEU N . 17818 1 820 . 1 1 93 93 GLY H H 1 8.49 0.02 . 1 . . . A 93 GLY H . 17818 1 821 . 1 1 93 93 GLY HA2 H 1 4.43 0.02 . 2 . . . A 93 GLY HA2 . 17818 1 822 . 1 1 93 93 GLY HA3 H 1 3.92 0.02 . 2 . . . A 93 GLY HA3 . 17818 1 823 . 1 1 93 93 GLY CA C 13 44.7 0.2 . 1 . . . A 93 GLY CA . 17818 1 824 . 1 1 93 93 GLY N N 15 115.8 0.2 . 1 . . . A 93 GLY N . 17818 1 825 . 1 1 94 94 GLU H H 1 8.65 0.02 . 1 . . . A 94 GLU H . 17818 1 826 . 1 1 94 94 GLU HA H 1 4.29 0.02 . 1 . . . A 94 GLU HA . 17818 1 827 . 1 1 94 94 GLU HB2 H 1 2.40 0.02 . 2 . . . A 94 GLU HB2 . 17818 1 828 . 1 1 94 94 GLU HB3 H 1 2.18 0.02 . 2 . . . A 94 GLU HB3 . 17818 1 829 . 1 1 94 94 GLU HG2 H 1 2.61 0.02 . 2 . . . A 94 GLU HG2 . 17818 1 830 . 1 1 94 94 GLU HG3 H 1 1.93 0.02 . 2 . . . A 94 GLU HG3 . 17818 1 831 . 1 1 94 94 GLU CA C 13 56.1 0.2 . 1 . . . A 94 GLU CA . 17818 1 832 . 1 1 94 94 GLU CB C 13 33.5 0.2 . 1 . . . A 94 GLU CB . 17818 1 833 . 1 1 94 94 GLU CG C 13 37.5 0.2 . 1 . . . A 94 GLU CG . 17818 1 834 . 1 1 94 94 GLU N N 15 123.7 0.2 . 1 . . . A 94 GLU N . 17818 1 835 . 1 1 95 95 LYS H H 1 8.95 0.02 . 1 . . . A 95 LYS H . 17818 1 836 . 1 1 95 95 LYS HA H 1 5.56 0.02 . 1 . . . A 95 LYS HA . 17818 1 837 . 1 1 95 95 LYS HB2 H 1 1.81 0.02 . 2 . . . A 95 LYS HB2 . 17818 1 838 . 1 1 95 95 LYS HB3 H 1 1.65 0.02 . 2 . . . A 95 LYS HB3 . 17818 1 839 . 1 1 95 95 LYS HG2 H 1 1.31 0.02 . 2 . . . A 95 LYS HG2 . 17818 1 840 . 1 1 95 95 LYS HG3 H 1 1.16 0.02 . 2 . . . A 95 LYS HG3 . 17818 1 841 . 1 1 95 95 LYS HD2 H 1 1.63 0.02 . 2 . . . A 95 LYS HD2 . 17818 1 842 . 1 1 95 95 LYS HD3 H 1 1.63 0.02 . 2 . . . A 95 LYS HD3 . 17818 1 843 . 1 1 95 95 LYS HE2 H 1 2.78 0.02 . 2 . . . A 95 LYS HE2 . 17818 1 844 . 1 1 95 95 LYS HE3 H 1 2.78 0.02 . 2 . . . A 95 LYS HE3 . 17818 1 845 . 1 1 95 95 LYS CA C 13 54.6 0.2 . 1 . . . A 95 LYS CA . 17818 1 846 . 1 1 95 95 LYS CB C 13 35.3 0.2 . 1 . . . A 95 LYS CB . 17818 1 847 . 1 1 95 95 LYS CG C 13 25.6 0.2 . 1 . . . A 95 LYS CG . 17818 1 848 . 1 1 95 95 LYS CD C 13 29.2 0.2 . 1 . . . A 95 LYS CD . 17818 1 849 . 1 1 95 95 LYS CE C 13 41.5 0.2 . 1 . . . A 95 LYS CE . 17818 1 850 . 1 1 95 95 LYS N N 15 124.2 0.2 . 1 . . . A 95 LYS N . 17818 1 851 . 1 1 96 96 ALA H H 1 9.53 0.02 . 1 . . . A 96 ALA H . 17818 1 852 . 1 1 96 96 ALA HA H 1 4.99 0.02 . 1 . . . A 96 ALA HA . 17818 1 853 . 1 1 96 96 ALA HB1 H 1 1.09 0.02 . 1 . . . A 96 ALA HB1 . 17818 1 854 . 1 1 96 96 ALA HB2 H 1 1.09 0.02 . 1 . . . A 96 ALA HB2 . 17818 1 855 . 1 1 96 96 ALA HB3 H 1 1.09 0.02 . 1 . . . A 96 ALA HB3 . 17818 1 856 . 1 1 96 96 ALA CA C 13 50.5 0.2 . 1 . . . A 96 ALA CA . 17818 1 857 . 1 1 96 96 ALA CB C 13 23.9 0.2 . 1 . . . A 96 ALA CB . 17818 1 858 . 1 1 96 96 ALA N N 15 129.1 0.2 . 1 . . . A 96 ALA N . 17818 1 859 . 1 1 97 97 LEU H H 1 9.10 0.02 . 1 . . . A 97 LEU H . 17818 1 860 . 1 1 97 97 LEU HA H 1 5.18 0.02 . 1 . . . A 97 LEU HA . 17818 1 861 . 1 1 97 97 LEU HB2 H 1 1.86 0.02 . 2 . . . A 97 LEU HB2 . 17818 1 862 . 1 1 97 97 LEU HB3 H 1 1.24 0.02 . 2 . . . A 97 LEU HB3 . 17818 1 863 . 1 1 97 97 LEU HG H 1 1.37 0.02 . 1 . . . A 97 LEU HG . 17818 1 864 . 1 1 97 97 LEU HD11 H 1 0.83 0.02 . 2 . . . A 97 LEU HD11 . 17818 1 865 . 1 1 97 97 LEU HD12 H 1 0.83 0.02 . 2 . . . A 97 LEU HD12 . 17818 1 866 . 1 1 97 97 LEU HD13 H 1 0.83 0.02 . 2 . . . A 97 LEU HD13 . 17818 1 867 . 1 1 97 97 LEU HD21 H 1 0.88 0.02 . 2 . . . A 97 LEU HD21 . 17818 1 868 . 1 1 97 97 LEU HD22 H 1 0.88 0.02 . 2 . . . A 97 LEU HD22 . 17818 1 869 . 1 1 97 97 LEU HD23 H 1 0.88 0.02 . 2 . . . A 97 LEU HD23 . 17818 1 870 . 1 1 97 97 LEU CA C 13 53.0 0.2 . 1 . . . A 97 LEU CA . 17818 1 871 . 1 1 97 97 LEU CB C 13 45.8 0.2 . 1 . . . A 97 LEU CB . 17818 1 872 . 1 1 97 97 LEU CG C 13 27.1 0.2 . 1 . . . A 97 LEU CG . 17818 1 873 . 1 1 97 97 LEU CD1 C 13 25.4 0.2 . 2 . . . A 97 LEU CD1 . 17818 1 874 . 1 1 97 97 LEU CD2 C 13 24.8 0.2 . 2 . . . A 97 LEU CD2 . 17818 1 875 . 1 1 97 97 LEU N N 15 122.2 0.2 . 1 . . . A 97 LEU N . 17818 1 876 . 1 1 98 98 PHE H H 1 9.94 0.02 . 1 . . . A 98 PHE H . 17818 1 877 . 1 1 98 98 PHE HA H 1 5.70 0.02 . 1 . . . A 98 PHE HA . 17818 1 878 . 1 1 98 98 PHE HB2 H 1 2.99 0.02 . 2 . . . A 98 PHE HB2 . 17818 1 879 . 1 1 98 98 PHE HB3 H 1 2.99 0.02 . 2 . . . A 98 PHE HB3 . 17818 1 880 . 1 1 98 98 PHE HD1 H 1 7.15 0.02 . 3 . . . A 98 PHE HD1 . 17818 1 881 . 1 1 98 98 PHE HD2 H 1 7.15 0.02 . 3 . . . A 98 PHE HD2 . 17818 1 882 . 1 1 98 98 PHE CA C 13 56.5 0.2 . 1 . . . A 98 PHE CA . 17818 1 883 . 1 1 98 98 PHE CB C 13 42.3 0.2 . 1 . . . A 98 PHE CB . 17818 1 884 . 1 1 98 98 PHE N N 15 125.8 0.2 . 1 . . . A 98 PHE N . 17818 1 885 . 1 1 99 99 THR H H 1 9.10 0.02 . 1 . . . A 99 THR H . 17818 1 886 . 1 1 99 99 THR HB H 1 4.14 0.02 . 1 . . . A 99 THR HB . 17818 1 887 . 1 1 99 99 THR HG21 H 1 1.12 0.02 . 1 . . . A 99 THR HG21 . 17818 1 888 . 1 1 99 99 THR HG22 H 1 1.12 0.02 . 1 . . . A 99 THR HG22 . 17818 1 889 . 1 1 99 99 THR HG23 H 1 1.12 0.02 . 1 . . . A 99 THR HG23 . 17818 1 890 . 1 1 99 99 THR CA C 13 63.5 0.2 . 1 . . . A 99 THR CA . 17818 1 891 . 1 1 99 99 THR CB C 13 68.6 0.2 . 1 . . . A 99 THR CB . 17818 1 892 . 1 1 99 99 THR CG2 C 13 21.4 0.2 . 1 . . . A 99 THR CG2 . 17818 1 893 . 1 1 99 99 THR N N 15 121.6 0.2 . 1 . . . A 99 THR N . 17818 1 894 . 1 1 100 100 ILE H H 1 9.88 0.02 . 1 . . . A 100 ILE H . 17818 1 895 . 1 1 100 100 ILE HB H 1 2.12 0.02 . 1 . . . A 100 ILE HB . 17818 1 896 . 1 1 100 100 ILE HG21 H 1 0.96 0.02 . 1 . . . A 100 ILE HG21 . 17818 1 897 . 1 1 100 100 ILE HG22 H 1 0.96 0.02 . 1 . . . A 100 ILE HG22 . 17818 1 898 . 1 1 100 100 ILE HG23 H 1 0.96 0.02 . 1 . . . A 100 ILE HG23 . 17818 1 899 . 1 1 100 100 ILE HD11 H 1 0.74 0.02 . 1 . . . A 100 ILE HD11 . 17818 1 900 . 1 1 100 100 ILE HD12 H 1 0.74 0.02 . 1 . . . A 100 ILE HD12 . 17818 1 901 . 1 1 100 100 ILE HD13 H 1 0.74 0.02 . 1 . . . A 100 ILE HD13 . 17818 1 902 . 1 1 100 100 ILE CA C 13 58.7 0.2 . 1 . . . A 100 ILE CA . 17818 1 903 . 1 1 100 100 ILE CB C 13 39.4 0.2 . 1 . . . A 100 ILE CB . 17818 1 904 . 1 1 100 100 ILE CG2 C 13 19.7 0.2 . 1 . . . A 100 ILE CG2 . 17818 1 905 . 1 1 100 100 ILE CD1 C 13 14.0 0.2 . 1 . . . A 100 ILE CD1 . 17818 1 906 . 1 1 100 100 ILE N N 15 127.4 0.2 . 1 . . . A 100 ILE N . 17818 1 907 . 1 1 101 101 PRO CA C 13 62.2 0.2 . 1 . . . A 101 PRO CA . 17818 1 908 . 1 1 101 101 PRO CB C 13 32.5 0.2 . 1 . . . A 101 PRO CB . 17818 1 909 . 1 1 101 101 PRO CG C 13 27.0 0.2 . 1 . . . A 101 PRO CG . 17818 1 910 . 1 1 101 101 PRO CD C 13 51.1 0.2 . 1 . . . A 101 PRO CD . 17818 1 911 . 1 1 102 102 TYR H H 1 8.45 0.02 . 1 . . . A 102 TYR H . 17818 1 912 . 1 1 102 102 TYR HA H 1 4.47 0.02 . 1 . . . A 102 TYR HA . 17818 1 913 . 1 1 102 102 TYR HB2 H 1 2.89 0.02 . 2 . . . A 102 TYR HB2 . 17818 1 914 . 1 1 102 102 TYR HB3 H 1 2.80 0.02 . 2 . . . A 102 TYR HB3 . 17818 1 915 . 1 1 102 102 TYR HD1 H 1 6.80 0.02 . 3 . . . A 102 TYR HD1 . 17818 1 916 . 1 1 102 102 TYR HD2 H 1 6.80 0.02 . 3 . . . A 102 TYR HD2 . 17818 1 917 . 1 1 102 102 TYR HE1 H 1 6.83 0.02 . 3 . . . A 102 TYR HE1 . 17818 1 918 . 1 1 102 102 TYR HE2 H 1 6.83 0.02 . 3 . . . A 102 TYR HE2 . 17818 1 919 . 1 1 102 102 TYR CA C 13 61.1 0.2 . 1 . . . A 102 TYR CA . 17818 1 920 . 1 1 102 102 TYR CB C 13 37.0 0.2 . 1 . . . A 102 TYR CB . 17818 1 921 . 1 1 102 102 TYR CD1 C 13 132.4 0.2 . 3 . . . A 102 TYR CD1 . 17818 1 922 . 1 1 102 102 TYR CD2 C 13 132.4 0.2 . 3 . . . A 102 TYR CD2 . 17818 1 923 . 1 1 102 102 TYR CE1 C 13 118.1 0.2 . 3 . . . A 102 TYR CE1 . 17818 1 924 . 1 1 102 102 TYR CE2 C 13 118.1 0.2 . 3 . . . A 102 TYR CE2 . 17818 1 925 . 1 1 102 102 TYR N N 15 118.1 0.2 . 1 . . . A 102 TYR N . 17818 1 926 . 1 1 103 103 GLN H H 1 9.08 0.02 . 1 . . . A 103 GLN H . 17818 1 927 . 1 1 103 103 GLN HA H 1 4.05 0.02 . 1 . . . A 103 GLN HA . 17818 1 928 . 1 1 103 103 GLN HB2 H 1 1.94 0.02 . 2 . . . A 103 GLN HB2 . 17818 1 929 . 1 1 103 103 GLN HB3 H 1 1.55 0.02 . 2 . . . A 103 GLN HB3 . 17818 1 930 . 1 1 103 103 GLN HG2 H 1 2.51 0.02 . 2 . . . A 103 GLN HG2 . 17818 1 931 . 1 1 103 103 GLN HG3 H 1 2.12 0.02 . 2 . . . A 103 GLN HG3 . 17818 1 932 . 1 1 103 103 GLN CA C 13 59.5 0.2 . 1 . . . A 103 GLN CA . 17818 1 933 . 1 1 103 103 GLN CB C 13 27.3 0.2 . 1 . . . A 103 GLN CB . 17818 1 934 . 1 1 103 103 GLN CG C 13 33.6 0.2 . 1 . . . A 103 GLN CG . 17818 1 935 . 1 1 103 103 GLN N N 15 123.8 0.2 . 1 . . . A 103 GLN N . 17818 1 936 . 1 1 104 104 LEU H H 1 7.79 0.02 . 1 . . . A 104 LEU H . 17818 1 937 . 1 1 104 104 LEU HA H 1 4.52 0.02 . 1 . . . A 104 LEU HA . 17818 1 938 . 1 1 104 104 LEU HB2 H 1 1.41 0.02 . 2 . . . A 104 LEU HB2 . 17818 1 939 . 1 1 104 104 LEU HB3 H 1 1.41 0.02 . 2 . . . A 104 LEU HB3 . 17818 1 940 . 1 1 104 104 LEU HG H 1 0.85 0.02 . 1 . . . A 104 LEU HG . 17818 1 941 . 1 1 104 104 LEU HD11 H 1 0.78 0.02 . 2 . . . A 104 LEU HD11 . 17818 1 942 . 1 1 104 104 LEU HD12 H 1 0.78 0.02 . 2 . . . A 104 LEU HD12 . 17818 1 943 . 1 1 104 104 LEU HD13 H 1 0.78 0.02 . 2 . . . A 104 LEU HD13 . 17818 1 944 . 1 1 104 104 LEU HD21 H 1 0.78 0.02 . 2 . . . A 104 LEU HD21 . 17818 1 945 . 1 1 104 104 LEU HD22 H 1 0.78 0.02 . 2 . . . A 104 LEU HD22 . 17818 1 946 . 1 1 104 104 LEU HD23 H 1 0.78 0.02 . 2 . . . A 104 LEU HD23 . 17818 1 947 . 1 1 104 104 LEU CA C 13 53.1 0.2 . 1 . . . A 104 LEU CA . 17818 1 948 . 1 1 104 104 LEU CB C 13 43.4 0.2 . 1 . . . A 104 LEU CB . 17818 1 949 . 1 1 104 104 LEU CG C 13 26.4 0.2 . 1 . . . A 104 LEU CG . 17818 1 950 . 1 1 104 104 LEU CD1 C 13 23.0 0.2 . 2 . . . A 104 LEU CD1 . 17818 1 951 . 1 1 104 104 LEU CD2 C 13 23.0 0.2 . 2 . . . A 104 LEU CD2 . 17818 1 952 . 1 1 104 104 LEU N N 15 116.8 0.2 . 1 . . . A 104 LEU N . 17818 1 953 . 1 1 105 105 ALA H H 1 7.78 0.02 . 1 . . . A 105 ALA H . 17818 1 954 . 1 1 105 105 ALA HA H 1 4.47 0.02 . 1 . . . A 105 ALA HA . 17818 1 955 . 1 1 105 105 ALA HB1 H 1 1.37 0.02 . 1 . . . A 105 ALA HB1 . 17818 1 956 . 1 1 105 105 ALA HB2 H 1 1.37 0.02 . 1 . . . A 105 ALA HB2 . 17818 1 957 . 1 1 105 105 ALA HB3 H 1 1.37 0.02 . 1 . . . A 105 ALA HB3 . 17818 1 958 . 1 1 105 105 ALA CA C 13 51.0 0.2 . 1 . . . A 105 ALA CA . 17818 1 959 . 1 1 105 105 ALA CB C 13 18.9 0.2 . 1 . . . A 105 ALA CB . 17818 1 960 . 1 1 105 105 ALA N N 15 125.4 0.2 . 1 . . . A 105 ALA N . 17818 1 961 . 1 1 106 106 TYR H H 1 9.43 0.02 . 1 . . . A 106 TYR H . 17818 1 962 . 1 1 106 106 TYR HA H 1 4.61 0.02 . 1 . . . A 106 TYR HA . 17818 1 963 . 1 1 106 106 TYR HB2 H 1 3.26 0.02 . 2 . . . A 106 TYR HB2 . 17818 1 964 . 1 1 106 106 TYR HB3 H 1 2.75 0.02 . 2 . . . A 106 TYR HB3 . 17818 1 965 . 1 1 106 106 TYR HD1 H 1 6.43 0.02 . 3 . . . A 106 TYR HD1 . 17818 1 966 . 1 1 106 106 TYR HD2 H 1 6.43 0.02 . 3 . . . A 106 TYR HD2 . 17818 1 967 . 1 1 106 106 TYR HE1 H 1 7.10 0.02 . 3 . . . A 106 TYR HE1 . 17818 1 968 . 1 1 106 106 TYR HE2 H 1 7.10 0.02 . 3 . . . A 106 TYR HE2 . 17818 1 969 . 1 1 106 106 TYR CA C 13 59.3 0.2 . 1 . . . A 106 TYR CA . 17818 1 970 . 1 1 106 106 TYR CB C 13 37.4 0.2 . 1 . . . A 106 TYR CB . 17818 1 971 . 1 1 106 106 TYR CD1 C 13 131.2 0.2 . 3 . . . A 106 TYR CD1 . 17818 1 972 . 1 1 106 106 TYR CD2 C 13 131.2 0.2 . 3 . . . A 106 TYR CD2 . 17818 1 973 . 1 1 106 106 TYR CE1 C 13 117.7 0.2 . 3 . . . A 106 TYR CE1 . 17818 1 974 . 1 1 106 106 TYR CE2 C 13 117.7 0.2 . 3 . . . A 106 TYR CE2 . 17818 1 975 . 1 1 106 106 TYR N N 15 122.0 0.2 . 1 . . . A 106 TYR N . 17818 1 976 . 1 1 107 107 GLY H H 1 8.49 0.02 . 1 . . . A 107 GLY H . 17818 1 977 . 1 1 107 107 GLY HA2 H 1 4.37 0.02 . 2 . . . A 107 GLY HA2 . 17818 1 978 . 1 1 107 107 GLY HA3 H 1 3.99 0.02 . 2 . . . A 107 GLY HA3 . 17818 1 979 . 1 1 107 107 GLY CA C 13 46.5 0.2 . 1 . . . A 107 GLY CA . 17818 1 980 . 1 1 107 107 GLY N N 15 105.5 0.2 . 1 . . . A 107 GLY N . 17818 1 981 . 1 1 108 108 GLU HA H 1 3.51 0.02 . 1 . . . A 108 GLU HA . 17818 1 982 . 1 1 108 108 GLU HB2 H 1 2.03 0.02 . 2 . . . A 108 GLU HB2 . 17818 1 983 . 1 1 108 108 GLU HB3 H 1 2.03 0.02 . 2 . . . A 108 GLU HB3 . 17818 1 984 . 1 1 108 108 GLU HG2 H 1 2.33 0.02 . 2 . . . A 108 GLU HG2 . 17818 1 985 . 1 1 108 108 GLU HG3 H 1 2.18 0.02 . 2 . . . A 108 GLU HG3 . 17818 1 986 . 1 1 108 108 GLU CA C 13 59.5 0.2 . 1 . . . A 108 GLU CA . 17818 1 987 . 1 1 108 108 GLU CB C 13 29.6 0.2 . 1 . . . A 108 GLU CB . 17818 1 988 . 1 1 108 108 GLU CG C 13 36.9 0.2 . 1 . . . A 108 GLU CG . 17818 1 989 . 1 1 109 109 ARG H H 1 8.84 0.02 . 1 . . . A 109 ARG H . 17818 1 990 . 1 1 109 109 ARG HA H 1 4.18 0.02 . 1 . . . A 109 ARG HA . 17818 1 991 . 1 1 109 109 ARG HB2 H 1 1.95 0.02 . 2 . . . A 109 ARG HB2 . 17818 1 992 . 1 1 109 109 ARG HB3 H 1 1.95 0.02 . 2 . . . A 109 ARG HB3 . 17818 1 993 . 1 1 109 109 ARG HG2 H 1 1.76 0.02 . 2 . . . A 109 ARG HG2 . 17818 1 994 . 1 1 109 109 ARG HG3 H 1 1.62 0.02 . 2 . . . A 109 ARG HG3 . 17818 1 995 . 1 1 109 109 ARG HD2 H 1 3.24 0.02 . 2 . . . A 109 ARG HD2 . 17818 1 996 . 1 1 109 109 ARG HD3 H 1 3.24 0.02 . 2 . . . A 109 ARG HD3 . 17818 1 997 . 1 1 109 109 ARG CA C 13 57.4 0.2 . 1 . . . A 109 ARG CA . 17818 1 998 . 1 1 109 109 ARG CB C 13 30.7 0.2 . 1 . . . A 109 ARG CB . 17818 1 999 . 1 1 109 109 ARG CG C 13 27.6 0.2 . 1 . . . A 109 ARG CG . 17818 1 1000 . 1 1 109 109 ARG CD C 13 43.2 0.2 . 1 . . . A 109 ARG CD . 17818 1 1001 . 1 1 109 109 ARG N N 15 115.9 0.2 . 1 . . . A 109 ARG N . 17818 1 1002 . 1 1 110 110 GLY H H 1 7.14 0.02 . 1 . . . A 110 GLY H . 17818 1 1003 . 1 1 110 110 GLY HA2 H 1 3.63 0.02 . 2 . . . A 110 GLY HA2 . 17818 1 1004 . 1 1 110 110 GLY HA3 H 1 3.50 0.02 . 2 . . . A 110 GLY HA3 . 17818 1 1005 . 1 1 110 110 GLY CA C 13 44.8 0.2 . 1 . . . A 110 GLY CA . 17818 1 1006 . 1 1 110 110 GLY N N 15 103.0 0.2 . 1 . . . A 110 GLY N . 17818 1 1007 . 1 1 111 111 TYR H H 1 8.57 0.02 . 1 . . . A 111 TYR H . 17818 1 1008 . 1 1 111 111 TYR HB2 H 1 2.45 0.02 . 2 . . . A 111 TYR HB2 . 17818 1 1009 . 1 1 111 111 TYR HB3 H 1 2.13 0.02 . 2 . . . A 111 TYR HB3 . 17818 1 1010 . 1 1 111 111 TYR HD1 H 1 6.80 0.02 . 3 . . . A 111 TYR HD1 . 17818 1 1011 . 1 1 111 111 TYR HD2 H 1 6.80 0.02 . 3 . . . A 111 TYR HD2 . 17818 1 1012 . 1 1 111 111 TYR HE1 H 1 6.78 0.02 . 3 . . . A 111 TYR HE1 . 17818 1 1013 . 1 1 111 111 TYR HE2 H 1 6.78 0.02 . 3 . . . A 111 TYR HE2 . 17818 1 1014 . 1 1 111 111 TYR CA C 13 54.5 0.2 . 1 . . . A 111 TYR CA . 17818 1 1015 . 1 1 111 111 TYR CB C 13 38.6 0.2 . 1 . . . A 111 TYR CB . 17818 1 1016 . 1 1 111 111 TYR CD1 C 13 132.4 0.2 . 3 . . . A 111 TYR CD1 . 17818 1 1017 . 1 1 111 111 TYR CD2 C 13 132.4 0.2 . 3 . . . A 111 TYR CD2 . 17818 1 1018 . 1 1 111 111 TYR CE1 C 13 118.1 0.2 . 3 . . . A 111 TYR CE1 . 17818 1 1019 . 1 1 111 111 TYR CE2 C 13 118.1 0.2 . 3 . . . A 111 TYR CE2 . 17818 1 1020 . 1 1 111 111 TYR N N 15 119.7 0.2 . 1 . . . A 111 TYR N . 17818 1 1021 . 1 1 113 113 PRO CA C 13 63.8 0.2 . 1 . . . A 113 PRO CA . 17818 1 1022 . 1 1 113 113 PRO CB C 13 34.3 0.2 . 1 . . . A 113 PRO CB . 17818 1 1023 . 1 1 114 114 VAL H H 1 7.87 0.02 . 1 . . . A 114 VAL H . 17818 1 1024 . 1 1 114 114 VAL HA H 1 3.85 0.02 . 1 . . . A 114 VAL HA . 17818 1 1025 . 1 1 114 114 VAL HB H 1 2.04 0.02 . 1 . . . A 114 VAL HB . 17818 1 1026 . 1 1 114 114 VAL HG11 H 1 1.04 0.02 . 2 . . . A 114 VAL HG11 . 17818 1 1027 . 1 1 114 114 VAL HG12 H 1 1.04 0.02 . 2 . . . A 114 VAL HG12 . 17818 1 1028 . 1 1 114 114 VAL HG13 H 1 1.04 0.02 . 2 . . . A 114 VAL HG13 . 17818 1 1029 . 1 1 114 114 VAL HG21 H 1 1.04 0.02 . 2 . . . A 114 VAL HG21 . 17818 1 1030 . 1 1 114 114 VAL HG22 H 1 1.04 0.02 . 2 . . . A 114 VAL HG22 . 17818 1 1031 . 1 1 114 114 VAL HG23 H 1 1.04 0.02 . 2 . . . A 114 VAL HG23 . 17818 1 1032 . 1 1 114 114 VAL CA C 13 65.6 0.2 . 1 . . . A 114 VAL CA . 17818 1 1033 . 1 1 114 114 VAL CB C 13 33.0 0.2 . 1 . . . A 114 VAL CB . 17818 1 1034 . 1 1 114 114 VAL CG1 C 13 21.4 0.2 . 2 . . . A 114 VAL CG1 . 17818 1 1035 . 1 1 114 114 VAL CG2 C 13 21.4 0.2 . 2 . . . A 114 VAL CG2 . 17818 1 1036 . 1 1 114 114 VAL N N 15 122.9 0.2 . 1 . . . A 114 VAL N . 17818 1 1037 . 1 1 115 115 ILE H H 1 7.55 0.02 . 1 . . . A 115 ILE H . 17818 1 1038 . 1 1 115 115 ILE HB H 1 1.64 0.02 . 1 . . . A 115 ILE HB . 17818 1 1039 . 1 1 115 115 ILE HG21 H 1 0.95 0.02 . 1 . . . A 115 ILE HG21 . 17818 1 1040 . 1 1 115 115 ILE HG22 H 1 0.95 0.02 . 1 . . . A 115 ILE HG22 . 17818 1 1041 . 1 1 115 115 ILE HG23 H 1 0.95 0.02 . 1 . . . A 115 ILE HG23 . 17818 1 1042 . 1 1 115 115 ILE HD11 H 1 0.05 0.02 . 1 . . . A 115 ILE HD11 . 17818 1 1043 . 1 1 115 115 ILE HD12 H 1 0.05 0.02 . 1 . . . A 115 ILE HD12 . 17818 1 1044 . 1 1 115 115 ILE HD13 H 1 0.05 0.02 . 1 . . . A 115 ILE HD13 . 17818 1 1045 . 1 1 115 115 ILE CA C 13 56.3 0.2 . 1 . . . A 115 ILE CA . 17818 1 1046 . 1 1 115 115 ILE CB C 13 37.7 0.2 . 1 . . . A 115 ILE CB . 17818 1 1047 . 1 1 115 115 ILE CG2 C 13 17.4 0.2 . 1 . . . A 115 ILE CG2 . 17818 1 1048 . 1 1 115 115 ILE CD1 C 13 10.3 0.2 . 1 . . . A 115 ILE CD1 . 17818 1 1049 . 1 1 115 115 ILE N N 15 118.1 0.2 . 1 . . . A 115 ILE N . 17818 1 1050 . 1 1 117 117 PRO HA H 1 3.62 0.02 . 1 . . . A 117 PRO HA . 17818 1 1051 . 1 1 117 117 PRO HB2 H 1 2.53 0.02 . 2 . . . A 117 PRO HB2 . 17818 1 1052 . 1 1 117 117 PRO HB3 H 1 1.61 0.02 . 2 . . . A 117 PRO HB3 . 17818 1 1053 . 1 1 117 117 PRO HG2 H 1 1.99 0.02 . 2 . . . A 117 PRO HG2 . 17818 1 1054 . 1 1 117 117 PRO HG3 H 1 1.80 0.02 . 2 . . . A 117 PRO HG3 . 17818 1 1055 . 1 1 117 117 PRO HD2 H 1 3.68 0.02 . 2 . . . A 117 PRO HD2 . 17818 1 1056 . 1 1 117 117 PRO HD3 H 1 3.47 0.02 . 2 . . . A 117 PRO HD3 . 17818 1 1057 . 1 1 117 117 PRO CA C 13 63.4 0.2 . 1 . . . A 117 PRO CA . 17818 1 1058 . 1 1 117 117 PRO CB C 13 32.8 0.2 . 1 . . . A 117 PRO CB . 17818 1 1059 . 1 1 117 117 PRO CG C 13 27.6 0.2 . 1 . . . A 117 PRO CG . 17818 1 1060 . 1 1 117 117 PRO CD C 13 51.0 0.2 . 1 . . . A 117 PRO CD . 17818 1 1061 . 1 1 118 118 LYS H H 1 7.33 0.02 . 1 . . . A 118 LYS H . 17818 1 1062 . 1 1 118 118 LYS HA H 1 2.58 0.02 . 1 . . . A 118 LYS HA . 17818 1 1063 . 1 1 118 118 LYS HB2 H 1 1.50 0.02 . 2 . . . A 118 LYS HB2 . 17818 1 1064 . 1 1 118 118 LYS HB3 H 1 1.46 0.02 . 2 . . . A 118 LYS HB3 . 17818 1 1065 . 1 1 118 118 LYS HG2 H 1 1.06 0.02 . 2 . . . A 118 LYS HG2 . 17818 1 1066 . 1 1 118 118 LYS HG3 H 1 -0.09 0.02 . 2 . . . A 118 LYS HG3 . 17818 1 1067 . 1 1 118 118 LYS HD2 H 1 1.50 0.02 . 2 . . . A 118 LYS HD2 . 17818 1 1068 . 1 1 118 118 LYS HD3 H 1 1.40 0.02 . 2 . . . A 118 LYS HD3 . 17818 1 1069 . 1 1 118 118 LYS HE2 H 1 2.78 0.02 . 2 . . . A 118 LYS HE2 . 17818 1 1070 . 1 1 118 118 LYS HE3 H 1 2.78 0.02 . 2 . . . A 118 LYS HE3 . 17818 1 1071 . 1 1 118 118 LYS CA C 13 57.9 0.2 . 1 . . . A 118 LYS CA . 17818 1 1072 . 1 1 118 118 LYS CB C 13 29.7 0.2 . 1 . . . A 118 LYS CB . 17818 1 1073 . 1 1 118 118 LYS CG C 13 26.5 0.2 . 1 . . . A 118 LYS CG . 17818 1 1074 . 1 1 118 118 LYS CD C 13 29.7 0.2 . 1 . . . A 118 LYS CD . 17818 1 1075 . 1 1 118 118 LYS CE C 13 42.0 0.2 . 1 . . . A 118 LYS CE . 17818 1 1076 . 1 1 118 118 LYS N N 15 115.1 0.2 . 1 . . . A 118 LYS N . 17818 1 1077 . 1 1 119 119 ALA H H 1 7.90 0.02 . 1 . . . A 119 ALA H . 17818 1 1078 . 1 1 119 119 ALA HA H 1 4.45 0.02 . 1 . . . A 119 ALA HA . 17818 1 1079 . 1 1 119 119 ALA HB1 H 1 1.30 0.02 . 1 . . . A 119 ALA HB1 . 17818 1 1080 . 1 1 119 119 ALA HB2 H 1 1.30 0.02 . 1 . . . A 119 ALA HB2 . 17818 1 1081 . 1 1 119 119 ALA HB3 H 1 1.30 0.02 . 1 . . . A 119 ALA HB3 . 17818 1 1082 . 1 1 119 119 ALA CA C 13 52.7 0.2 . 1 . . . A 119 ALA CA . 17818 1 1083 . 1 1 119 119 ALA CB C 13 20.1 0.2 . 1 . . . A 119 ALA CB . 17818 1 1084 . 1 1 119 119 ALA N N 15 121.9 0.2 . 1 . . . A 119 ALA N . 17818 1 1085 . 1 1 120 120 THR H H 1 8.17 0.02 . 1 . . . A 120 THR H . 17818 1 1086 . 1 1 120 120 THR HB H 1 4.04 0.02 . 1 . . . A 120 THR HB . 17818 1 1087 . 1 1 120 120 THR HG21 H 1 1.15 0.02 . 1 . . . A 120 THR HG21 . 17818 1 1088 . 1 1 120 120 THR HG22 H 1 1.15 0.02 . 1 . . . A 120 THR HG22 . 17818 1 1089 . 1 1 120 120 THR HG23 H 1 1.15 0.02 . 1 . . . A 120 THR HG23 . 17818 1 1090 . 1 1 120 120 THR CA C 13 63.1 0.2 . 1 . . . A 120 THR CA . 17818 1 1091 . 1 1 120 120 THR CB C 13 69.8 0.2 . 1 . . . A 120 THR CB . 17818 1 1092 . 1 1 120 120 THR CG2 C 13 22.1 0.2 . 1 . . . A 120 THR CG2 . 17818 1 1093 . 1 1 120 120 THR N N 15 121.8 0.2 . 1 . . . A 120 THR N . 17818 1 1094 . 1 1 121 121 LEU H H 1 8.64 0.02 . 1 . . . A 121 LEU H . 17818 1 1095 . 1 1 121 121 LEU HB2 H 1 1.75 0.02 . 2 . . . A 121 LEU HB2 . 17818 1 1096 . 1 1 121 121 LEU HB3 H 1 1.42 0.02 . 2 . . . A 121 LEU HB3 . 17818 1 1097 . 1 1 121 121 LEU HG H 1 1.15 0.02 . 1 . . . A 121 LEU HG . 17818 1 1098 . 1 1 121 121 LEU HD11 H 1 0.68 0.02 . 2 . . . A 121 LEU HD11 . 17818 1 1099 . 1 1 121 121 LEU HD12 H 1 0.68 0.02 . 2 . . . A 121 LEU HD12 . 17818 1 1100 . 1 1 121 121 LEU HD13 H 1 0.68 0.02 . 2 . . . A 121 LEU HD13 . 17818 1 1101 . 1 1 121 121 LEU HD21 H 1 0.68 0.02 . 2 . . . A 121 LEU HD21 . 17818 1 1102 . 1 1 121 121 LEU HD22 H 1 0.68 0.02 . 2 . . . A 121 LEU HD22 . 17818 1 1103 . 1 1 121 121 LEU HD23 H 1 0.68 0.02 . 2 . . . A 121 LEU HD23 . 17818 1 1104 . 1 1 121 121 LEU CA C 13 53.1 0.2 . 1 . . . A 121 LEU CA . 17818 1 1105 . 1 1 121 121 LEU CB C 13 46.3 0.2 . 1 . . . A 121 LEU CB . 17818 1 1106 . 1 1 121 121 LEU CG C 13 26.8 0.2 . 1 . . . A 121 LEU CG . 17818 1 1107 . 1 1 121 121 LEU CD1 C 13 22.9 0.2 . 2 . . . A 121 LEU CD1 . 17818 1 1108 . 1 1 121 121 LEU CD2 C 13 22.9 0.2 . 2 . . . A 121 LEU CD2 . 17818 1 1109 . 1 1 121 121 LEU N N 15 124.2 0.2 . 1 . . . A 121 LEU N . 17818 1 1110 . 1 1 122 122 VAL H H 1 8.86 0.02 . 1 . . . A 122 VAL H . 17818 1 1111 . 1 1 122 122 VAL HA H 1 5.29 0.02 . 1 . . . A 122 VAL HA . 17818 1 1112 . 1 1 122 122 VAL HB H 1 1.83 0.02 . 1 . . . A 122 VAL HB . 17818 1 1113 . 1 1 122 122 VAL HG11 H 1 0.88 0.02 . 2 . . . A 122 VAL HG11 . 17818 1 1114 . 1 1 122 122 VAL HG12 H 1 0.88 0.02 . 2 . . . A 122 VAL HG12 . 17818 1 1115 . 1 1 122 122 VAL HG13 H 1 0.88 0.02 . 2 . . . A 122 VAL HG13 . 17818 1 1116 . 1 1 122 122 VAL HG21 H 1 0.88 0.02 . 2 . . . A 122 VAL HG21 . 17818 1 1117 . 1 1 122 122 VAL HG22 H 1 0.88 0.02 . 2 . . . A 122 VAL HG22 . 17818 1 1118 . 1 1 122 122 VAL HG23 H 1 0.88 0.02 . 2 . . . A 122 VAL HG23 . 17818 1 1119 . 1 1 122 122 VAL CA C 13 60.7 0.2 . 1 . . . A 122 VAL CA . 17818 1 1120 . 1 1 122 122 VAL CB C 13 33.3 0.2 . 1 . . . A 122 VAL CB . 17818 1 1121 . 1 1 122 122 VAL CG1 C 13 20.7 0.2 . 2 . . . A 122 VAL CG1 . 17818 1 1122 . 1 1 122 122 VAL CG2 C 13 20.7 0.2 . 2 . . . A 122 VAL CG2 . 17818 1 1123 . 1 1 122 122 VAL N N 15 122.2 0.2 . 1 . . . A 122 VAL N . 17818 1 1124 . 1 1 123 123 PHE H H 1 9.62 0.02 . 1 . . . A 123 PHE H . 17818 1 1125 . 1 1 123 123 PHE HA H 1 5.40 0.02 . 1 . . . A 123 PHE HA . 17818 1 1126 . 1 1 123 123 PHE HB2 H 1 2.85 0.02 . 2 . . . A 123 PHE HB2 . 17818 1 1127 . 1 1 123 123 PHE HB3 H 1 2.80 0.02 . 2 . . . A 123 PHE HB3 . 17818 1 1128 . 1 1 123 123 PHE HD1 H 1 7.14 0.02 . 3 . . . A 123 PHE HD1 . 17818 1 1129 . 1 1 123 123 PHE HD2 H 1 7.14 0.02 . 3 . . . A 123 PHE HD2 . 17818 1 1130 . 1 1 123 123 PHE CA C 13 55.4 0.2 . 1 . . . A 123 PHE CA . 17818 1 1131 . 1 1 123 123 PHE CB C 13 44.0 0.2 . 1 . . . A 123 PHE CB . 17818 1 1132 . 1 1 123 123 PHE N N 15 122.9 0.2 . 1 . . . A 123 PHE N . 17818 1 1133 . 1 1 124 124 GLU H H 1 9.18 0.02 . 1 . . . A 124 GLU H . 17818 1 1134 . 1 1 124 124 GLU HA H 1 5.90 0.02 . 1 . . . A 124 GLU HA . 17818 1 1135 . 1 1 124 124 GLU HB2 H 1 2.13 0.02 . 2 . . . A 124 GLU HB2 . 17818 1 1136 . 1 1 124 124 GLU HB3 H 1 2.01 0.02 . 2 . . . A 124 GLU HB3 . 17818 1 1137 . 1 1 124 124 GLU HG2 H 1 2.11 0.02 . 2 . . . A 124 GLU HG2 . 17818 1 1138 . 1 1 124 124 GLU HG3 H 1 1.93 0.02 . 2 . . . A 124 GLU HG3 . 17818 1 1139 . 1 1 124 124 GLU CA C 13 55.6 0.2 . 1 . . . A 124 GLU CA . 17818 1 1140 . 1 1 124 124 GLU CB C 13 31.8 0.2 . 1 . . . A 124 GLU CB . 17818 1 1141 . 1 1 124 124 GLU CG C 13 37.6 0.2 . 1 . . . A 124 GLU CG . 17818 1 1142 . 1 1 124 124 GLU N N 15 125.5 0.2 . 1 . . . A 124 GLU N . 17818 1 1143 . 1 1 125 125 VAL H H 1 9.60 0.02 . 1 . . . A 125 VAL H . 17818 1 1144 . 1 1 125 125 VAL HB H 1 1.98 0.02 . 1 . . . A 125 VAL HB . 17818 1 1145 . 1 1 125 125 VAL HG11 H 1 0.87 0.02 . 2 . . . A 125 VAL HG11 . 17818 1 1146 . 1 1 125 125 VAL HG12 H 1 0.87 0.02 . 2 . . . A 125 VAL HG12 . 17818 1 1147 . 1 1 125 125 VAL HG13 H 1 0.87 0.02 . 2 . . . A 125 VAL HG13 . 17818 1 1148 . 1 1 125 125 VAL HG21 H 1 0.71 0.02 . 2 . . . A 125 VAL HG21 . 17818 1 1149 . 1 1 125 125 VAL HG22 H 1 0.71 0.02 . 2 . . . A 125 VAL HG22 . 17818 1 1150 . 1 1 125 125 VAL HG23 H 1 0.71 0.02 . 2 . . . A 125 VAL HG23 . 17818 1 1151 . 1 1 125 125 VAL CA C 13 61.3 0.2 . 1 . . . A 125 VAL CA . 17818 1 1152 . 1 1 125 125 VAL CB C 13 35.8 0.2 . 1 . . . A 125 VAL CB . 17818 1 1153 . 1 1 125 125 VAL CG1 C 13 21.1 0.2 . 2 . . . A 125 VAL CG1 . 17818 1 1154 . 1 1 125 125 VAL CG2 C 13 21.8 0.2 . 2 . . . A 125 VAL CG2 . 17818 1 1155 . 1 1 125 125 VAL N N 15 128.1 0.2 . 1 . . . A 125 VAL N . 17818 1 1156 . 1 1 126 126 GLU H H 1 9.42 0.02 . 1 . . . A 126 GLU H . 17818 1 1157 . 1 1 126 126 GLU HA H 1 5.63 0.02 . 1 . . . A 126 GLU HA . 17818 1 1158 . 1 1 126 126 GLU HB2 H 1 2.08 0.02 . 2 . . . A 126 GLU HB2 . 17818 1 1159 . 1 1 126 126 GLU HB3 H 1 1.63 0.02 . 2 . . . A 126 GLU HB3 . 17818 1 1160 . 1 1 126 126 GLU HG2 H 1 2.08 0.02 . 2 . . . A 126 GLU HG2 . 17818 1 1161 . 1 1 126 126 GLU HG3 H 1 1.90 0.02 . 2 . . . A 126 GLU HG3 . 17818 1 1162 . 1 1 126 126 GLU CA C 13 53.5 0.2 . 1 . . . A 126 GLU CA . 17818 1 1163 . 1 1 126 126 GLU CB C 13 34.0 0.2 . 1 . . . A 126 GLU CB . 17818 1 1164 . 1 1 126 126 GLU CG C 13 35.6 0.2 . 1 . . . A 126 GLU CG . 17818 1 1165 . 1 1 126 126 GLU N N 15 128.5 0.2 . 1 . . . A 126 GLU N . 17818 1 1166 . 1 1 127 127 LEU H H 1 8.72 0.02 . 1 . . . A 127 LEU H . 17818 1 1167 . 1 1 127 127 LEU HB2 H 1 2.31 0.02 . 2 . . . A 127 LEU HB2 . 17818 1 1168 . 1 1 127 127 LEU HB3 H 1 1.41 0.02 . 2 . . . A 127 LEU HB3 . 17818 1 1169 . 1 1 127 127 LEU HG H 1 0.66 0.02 . 1 . . . A 127 LEU HG . 17818 1 1170 . 1 1 127 127 LEU HD11 H 1 0.89 0.02 . 2 . . . A 127 LEU HD11 . 17818 1 1171 . 1 1 127 127 LEU HD12 H 1 0.89 0.02 . 2 . . . A 127 LEU HD12 . 17818 1 1172 . 1 1 127 127 LEU HD13 H 1 0.89 0.02 . 2 . . . A 127 LEU HD13 . 17818 1 1173 . 1 1 127 127 LEU HD21 H 1 0.89 0.02 . 2 . . . A 127 LEU HD21 . 17818 1 1174 . 1 1 127 127 LEU HD22 H 1 0.89 0.02 . 2 . . . A 127 LEU HD22 . 17818 1 1175 . 1 1 127 127 LEU HD23 H 1 0.89 0.02 . 2 . . . A 127 LEU HD23 . 17818 1 1176 . 1 1 127 127 LEU CA C 13 55.1 0.2 . 1 . . . A 127 LEU CA . 17818 1 1177 . 1 1 127 127 LEU CB C 13 41.4 0.2 . 1 . . . A 127 LEU CB . 17818 1 1178 . 1 1 127 127 LEU CG C 13 25.8 0.2 . 1 . . . A 127 LEU CG . 17818 1 1179 . 1 1 127 127 LEU CD1 C 13 23.8 0.2 . 2 . . . A 127 LEU CD1 . 17818 1 1180 . 1 1 127 127 LEU CD2 C 13 23.8 0.2 . 2 . . . A 127 LEU CD2 . 17818 1 1181 . 1 1 127 127 LEU N N 15 127.9 0.2 . 1 . . . A 127 LEU N . 17818 1 1182 . 1 1 128 128 LEU H H 1 8.69 0.02 . 1 . . . A 128 LEU H . 17818 1 1183 . 1 1 128 128 LEU HA H 1 4.40 0.02 . 1 . . . A 128 LEU HA . 17818 1 1184 . 1 1 128 128 LEU HB2 H 1 1.51 0.02 . 2 . . . A 128 LEU HB2 . 17818 1 1185 . 1 1 128 128 LEU HB3 H 1 1.30 0.02 . 2 . . . A 128 LEU HB3 . 17818 1 1186 . 1 1 128 128 LEU HG H 1 0.73 0.02 . 1 . . . A 128 LEU HG . 17818 1 1187 . 1 1 128 128 LEU HD11 H 1 0.82 0.02 . 2 . . . A 128 LEU HD11 . 17818 1 1188 . 1 1 128 128 LEU HD12 H 1 0.82 0.02 . 2 . . . A 128 LEU HD12 . 17818 1 1189 . 1 1 128 128 LEU HD13 H 1 0.82 0.02 . 2 . . . A 128 LEU HD13 . 17818 1 1190 . 1 1 128 128 LEU HD21 H 1 0.82 0.02 . 2 . . . A 128 LEU HD21 . 17818 1 1191 . 1 1 128 128 LEU HD22 H 1 0.82 0.02 . 2 . . . A 128 LEU HD22 . 17818 1 1192 . 1 1 128 128 LEU HD23 H 1 0.82 0.02 . 2 . . . A 128 LEU HD23 . 17818 1 1193 . 1 1 128 128 LEU CA C 13 55.9 0.2 . 1 . . . A 128 LEU CA . 17818 1 1194 . 1 1 128 128 LEU CB C 13 43.7 0.2 . 1 . . . A 128 LEU CB . 17818 1 1195 . 1 1 128 128 LEU CG C 13 26.6 0.2 . 1 . . . A 128 LEU CG . 17818 1 1196 . 1 1 128 128 LEU CD1 C 13 22.5 0.2 . 2 . . . A 128 LEU CD1 . 17818 1 1197 . 1 1 128 128 LEU CD2 C 13 22.5 0.2 . 2 . . . A 128 LEU CD2 . 17818 1 1198 . 1 1 128 128 LEU N N 15 128.7 0.2 . 1 . . . A 128 LEU N . 17818 1 1199 . 1 1 129 129 ALA H H 1 7.81 0.02 . 1 . . . A 129 ALA H . 17818 1 1200 . 1 1 129 129 ALA HA H 1 4.46 0.02 . 1 . . . A 129 ALA HA . 17818 1 1201 . 1 1 129 129 ALA HB1 H 1 1.34 0.02 . 1 . . . A 129 ALA HB1 . 17818 1 1202 . 1 1 129 129 ALA HB2 H 1 1.34 0.02 . 1 . . . A 129 ALA HB2 . 17818 1 1203 . 1 1 129 129 ALA HB3 H 1 1.34 0.02 . 1 . . . A 129 ALA HB3 . 17818 1 1204 . 1 1 129 129 ALA CA C 13 52.8 0.2 . 1 . . . A 129 ALA CA . 17818 1 1205 . 1 1 129 129 ALA CB C 13 21.1 0.2 . 1 . . . A 129 ALA CB . 17818 1 1206 . 1 1 129 129 ALA N N 15 118.6 0.2 . 1 . . . A 129 ALA N . 17818 1 1207 . 1 1 130 130 VAL H H 1 7.93 0.02 . 1 . . . A 130 VAL H . 17818 1 1208 . 1 1 130 130 VAL HA H 1 4.45 0.02 . 1 . . . A 130 VAL HA . 17818 1 1209 . 1 1 130 130 VAL HB H 1 2.36 0.02 . 1 . . . A 130 VAL HB . 17818 1 1210 . 1 1 130 130 VAL HG11 H 1 0.67 0.02 . 2 . . . A 130 VAL HG11 . 17818 1 1211 . 1 1 130 130 VAL HG12 H 1 0.67 0.02 . 2 . . . A 130 VAL HG12 . 17818 1 1212 . 1 1 130 130 VAL HG13 H 1 0.67 0.02 . 2 . . . A 130 VAL HG13 . 17818 1 1213 . 1 1 130 130 VAL HG21 H 1 0.67 0.02 . 2 . . . A 130 VAL HG21 . 17818 1 1214 . 1 1 130 130 VAL HG22 H 1 0.67 0.02 . 2 . . . A 130 VAL HG22 . 17818 1 1215 . 1 1 130 130 VAL HG23 H 1 0.67 0.02 . 2 . . . A 130 VAL HG23 . 17818 1 1216 . 1 1 130 130 VAL CA C 13 61.0 0.2 . 1 . . . A 130 VAL CA . 17818 1 1217 . 1 1 130 130 VAL CB C 13 33.7 0.2 . 1 . . . A 130 VAL CB . 17818 1 1218 . 1 1 130 130 VAL CG1 C 13 19.4 0.2 . 2 . . . A 130 VAL CG1 . 17818 1 1219 . 1 1 130 130 VAL CG2 C 13 19.4 0.2 . 2 . . . A 130 VAL CG2 . 17818 1 1220 . 1 1 130 130 VAL N N 15 117.4 0.2 . 1 . . . A 130 VAL N . 17818 1 stop_ save_