data_17991 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 17991 _Entry.Title ; WSA major conformation ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2011-10-11 _Entry.Accession_date 2011-10-11 _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 'NMR, 15 STRUCTURES' _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Yan Xu . . . 17991 2 David Mowrey . . . 17991 3 Tanxing Cui . . . 17991 4 Jose Perez-Aguilar . M. . 17991 5 Jeffrey Saven . G. . 17991 6 Roderic Eckenhoff . . . 17991 7 Pei Tang . . . 17991 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID 1 'not applicable' 'not applicable' . 17991 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'acetylcholine receptor' . 17991 NMR . 17991 'transmembrane domain' . 17991 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 17991 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 334 17991 '15N chemical shifts' 127 17991 '1H chemical shifts' 845 17991 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 . . 2012-02-14 2011-10-11 update BMRB 'update entry citation' 17991 1 . . 2012-01-09 2011-10-11 original author 'original release' 17991 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 17992 'NMR Structure and Dynamics of Water-Solubilized Transmembrane Domains of Nicotinic Acetylcholine Receptor' 17991 PDB 2LKG 'BMRB Entry Tracking System' 17991 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 17991 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 22155685 _Citation.Full_citation . _Citation.Title 'NMR structure and dynamics of a designed water-soluble transmembrane domain of nicotinic acetylcholine receptor.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biochim. Biophys. Acta' _Citation.Journal_name_full 'Biochimica et biophysica acta' _Citation.Journal_volume 1818 _Citation.Journal_issue 3 _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 617 _Citation.Page_last 626 _Citation.Year 2012 _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 Tanxing Cui . . . 17991 1 2 David Mowrey . . . 17991 1 3 Vasyl Bondarenko . . . 17991 1 4 Tommy Tillman . . . 17991 1 5 Dejian Ma . . . 17991 1 6 Elizabeth Landrum . . . 17991 1 7 'Jose Manuel' Perez-Aguilar . . . 17991 1 8 Jing He . . . 17991 1 9 Wei Wang . . . 17991 1 10 Jeffery Saven . G. . 17991 1 11 Roderic Eckenhoff . G. . 17991 1 12 Pei Tang . . . 17991 1 13 Yan Xu . . . 17991 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 17991 _Assembly.ID 1 _Assembly.Name Nicotinic_Acetylcholine_Receptor _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 Nicotinic_Acetylcholine_Receptor 1 $Nicotinic_Acetylcholine_Receptor A . yes native no no . . . 17991 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_Nicotinic_Acetylcholine_Receptor _Entity.Sf_category entity _Entity.Sf_framecode Nicotinic_Acetylcholine_Receptor _Entity.Entry_ID 17991 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity _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 ; MAHHHHHHAMVIDHILKCVF DKICKIGTESVEAGRLIELS QEGGGGGGPLYFVVNVIEPC KKFSELTGLVFYLPTDSGEK MTESKSVLKSLTEKLKKIVE LIPSTSSAVPLIGKYMLFTK EFVESSIKITEEVINTHHRS ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 140 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 15558.247 _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 BMRB 17992 . Nicotinic_Acetylcholine_Receptor . . . . . 100.00 140 100.00 100.00 6.40e-94 . . . . 17991 1 2 no PDB 2LKG . "Wsa Major Conformation" . . . . . 100.00 140 100.00 100.00 6.40e-94 . . . . 17991 1 3 no PDB 2LKH . "Wsa Minor Conformation" . . . . . 100.00 140 100.00 100.00 6.40e-94 . . . . 17991 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 1 MET . 17991 1 2 2 ALA . 17991 1 3 3 HIS . 17991 1 4 4 HIS . 17991 1 5 5 HIS . 17991 1 6 6 HIS . 17991 1 7 7 HIS . 17991 1 8 8 HIS . 17991 1 9 9 ALA . 17991 1 10 10 MET . 17991 1 11 11 VAL . 17991 1 12 12 ILE . 17991 1 13 13 ASP . 17991 1 14 14 HIS . 17991 1 15 15 ILE . 17991 1 16 16 LEU . 17991 1 17 17 LYS . 17991 1 18 18 CYS . 17991 1 19 19 VAL . 17991 1 20 20 PHE . 17991 1 21 21 ASP . 17991 1 22 22 LYS . 17991 1 23 23 ILE . 17991 1 24 24 CYS . 17991 1 25 25 LYS . 17991 1 26 26 ILE . 17991 1 27 27 GLY . 17991 1 28 28 THR . 17991 1 29 29 GLU . 17991 1 30 30 SER . 17991 1 31 31 VAL . 17991 1 32 32 GLU . 17991 1 33 33 ALA . 17991 1 34 34 GLY . 17991 1 35 35 ARG . 17991 1 36 36 LEU . 17991 1 37 37 ILE . 17991 1 38 38 GLU . 17991 1 39 39 LEU . 17991 1 40 40 SER . 17991 1 41 41 GLN . 17991 1 42 42 GLU . 17991 1 43 43 GLY . 17991 1 44 44 GLY . 17991 1 45 45 GLY . 17991 1 46 46 GLY . 17991 1 47 47 GLY . 17991 1 48 48 GLY . 17991 1 49 49 PRO . 17991 1 50 50 LEU . 17991 1 51 51 TYR . 17991 1 52 52 PHE . 17991 1 53 53 VAL . 17991 1 54 54 VAL . 17991 1 55 55 ASN . 17991 1 56 56 VAL . 17991 1 57 57 ILE . 17991 1 58 58 GLU . 17991 1 59 59 PRO . 17991 1 60 60 CYS . 17991 1 61 61 LYS . 17991 1 62 62 LYS . 17991 1 63 63 PHE . 17991 1 64 64 SER . 17991 1 65 65 GLU . 17991 1 66 66 LEU . 17991 1 67 67 THR . 17991 1 68 68 GLY . 17991 1 69 69 LEU . 17991 1 70 70 VAL . 17991 1 71 71 PHE . 17991 1 72 72 TYR . 17991 1 73 73 LEU . 17991 1 74 74 PRO . 17991 1 75 75 THR . 17991 1 76 76 ASP . 17991 1 77 77 SER . 17991 1 78 78 GLY . 17991 1 79 79 GLU . 17991 1 80 80 LYS . 17991 1 81 81 MET . 17991 1 82 82 THR . 17991 1 83 83 GLU . 17991 1 84 84 SER . 17991 1 85 85 LYS . 17991 1 86 86 SER . 17991 1 87 87 VAL . 17991 1 88 88 LEU . 17991 1 89 89 LYS . 17991 1 90 90 SER . 17991 1 91 91 LEU . 17991 1 92 92 THR . 17991 1 93 93 GLU . 17991 1 94 94 LYS . 17991 1 95 95 LEU . 17991 1 96 96 LYS . 17991 1 97 97 LYS . 17991 1 98 98 ILE . 17991 1 99 99 VAL . 17991 1 100 100 GLU . 17991 1 101 101 LEU . 17991 1 102 102 ILE . 17991 1 103 103 PRO . 17991 1 104 104 SER . 17991 1 105 105 THR . 17991 1 106 106 SER . 17991 1 107 107 SER . 17991 1 108 108 ALA . 17991 1 109 109 VAL . 17991 1 110 110 PRO . 17991 1 111 111 LEU . 17991 1 112 112 ILE . 17991 1 113 113 GLY . 17991 1 114 114 LYS . 17991 1 115 115 TYR . 17991 1 116 116 MET . 17991 1 117 117 LEU . 17991 1 118 118 PHE . 17991 1 119 119 THR . 17991 1 120 120 LYS . 17991 1 121 121 GLU . 17991 1 122 122 PHE . 17991 1 123 123 VAL . 17991 1 124 124 GLU . 17991 1 125 125 SER . 17991 1 126 126 SER . 17991 1 127 127 ILE . 17991 1 128 128 LYS . 17991 1 129 129 ILE . 17991 1 130 130 THR . 17991 1 131 131 GLU . 17991 1 132 132 GLU . 17991 1 133 133 VAL . 17991 1 134 134 ILE . 17991 1 135 135 ASN . 17991 1 136 136 THR . 17991 1 137 137 HIS . 17991 1 138 138 HIS . 17991 1 139 139 ARG . 17991 1 140 140 SER . 17991 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 17991 1 . ALA 2 2 17991 1 . HIS 3 3 17991 1 . HIS 4 4 17991 1 . HIS 5 5 17991 1 . HIS 6 6 17991 1 . HIS 7 7 17991 1 . HIS 8 8 17991 1 . ALA 9 9 17991 1 . MET 10 10 17991 1 . VAL 11 11 17991 1 . ILE 12 12 17991 1 . ASP 13 13 17991 1 . HIS 14 14 17991 1 . ILE 15 15 17991 1 . LEU 16 16 17991 1 . LYS 17 17 17991 1 . CYS 18 18 17991 1 . VAL 19 19 17991 1 . PHE 20 20 17991 1 . ASP 21 21 17991 1 . LYS 22 22 17991 1 . ILE 23 23 17991 1 . CYS 24 24 17991 1 . LYS 25 25 17991 1 . ILE 26 26 17991 1 . GLY 27 27 17991 1 . THR 28 28 17991 1 . GLU 29 29 17991 1 . SER 30 30 17991 1 . VAL 31 31 17991 1 . GLU 32 32 17991 1 . ALA 33 33 17991 1 . GLY 34 34 17991 1 . ARG 35 35 17991 1 . LEU 36 36 17991 1 . ILE 37 37 17991 1 . GLU 38 38 17991 1 . LEU 39 39 17991 1 . SER 40 40 17991 1 . GLN 41 41 17991 1 . GLU 42 42 17991 1 . GLY 43 43 17991 1 . GLY 44 44 17991 1 . GLY 45 45 17991 1 . GLY 46 46 17991 1 . GLY 47 47 17991 1 . GLY 48 48 17991 1 . PRO 49 49 17991 1 . LEU 50 50 17991 1 . TYR 51 51 17991 1 . PHE 52 52 17991 1 . VAL 53 53 17991 1 . VAL 54 54 17991 1 . ASN 55 55 17991 1 . VAL 56 56 17991 1 . ILE 57 57 17991 1 . GLU 58 58 17991 1 . PRO 59 59 17991 1 . CYS 60 60 17991 1 . LYS 61 61 17991 1 . LYS 62 62 17991 1 . PHE 63 63 17991 1 . SER 64 64 17991 1 . GLU 65 65 17991 1 . LEU 66 66 17991 1 . THR 67 67 17991 1 . GLY 68 68 17991 1 . LEU 69 69 17991 1 . VAL 70 70 17991 1 . PHE 71 71 17991 1 . TYR 72 72 17991 1 . LEU 73 73 17991 1 . PRO 74 74 17991 1 . THR 75 75 17991 1 . ASP 76 76 17991 1 . SER 77 77 17991 1 . GLY 78 78 17991 1 . GLU 79 79 17991 1 . LYS 80 80 17991 1 . MET 81 81 17991 1 . THR 82 82 17991 1 . GLU 83 83 17991 1 . SER 84 84 17991 1 . LYS 85 85 17991 1 . SER 86 86 17991 1 . VAL 87 87 17991 1 . LEU 88 88 17991 1 . LYS 89 89 17991 1 . SER 90 90 17991 1 . LEU 91 91 17991 1 . THR 92 92 17991 1 . GLU 93 93 17991 1 . LYS 94 94 17991 1 . LEU 95 95 17991 1 . LYS 96 96 17991 1 . LYS 97 97 17991 1 . ILE 98 98 17991 1 . VAL 99 99 17991 1 . GLU 100 100 17991 1 . LEU 101 101 17991 1 . ILE 102 102 17991 1 . PRO 103 103 17991 1 . SER 104 104 17991 1 . THR 105 105 17991 1 . SER 106 106 17991 1 . SER 107 107 17991 1 . ALA 108 108 17991 1 . VAL 109 109 17991 1 . PRO 110 110 17991 1 . LEU 111 111 17991 1 . ILE 112 112 17991 1 . GLY 113 113 17991 1 . LYS 114 114 17991 1 . TYR 115 115 17991 1 . MET 116 116 17991 1 . LEU 117 117 17991 1 . PHE 118 118 17991 1 . THR 119 119 17991 1 . LYS 120 120 17991 1 . GLU 121 121 17991 1 . PHE 122 122 17991 1 . VAL 123 123 17991 1 . GLU 124 124 17991 1 . SER 125 125 17991 1 . SER 126 126 17991 1 . ILE 127 127 17991 1 . LYS 128 128 17991 1 . ILE 129 129 17991 1 . THR 130 130 17991 1 . GLU 131 131 17991 1 . GLU 132 132 17991 1 . VAL 133 133 17991 1 . ILE 134 134 17991 1 . ASN 135 135 17991 1 . THR 136 136 17991 1 . HIS 137 137 17991 1 . HIS 138 138 17991 1 . ARG 139 139 17991 1 . SER 140 140 17991 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 17991 _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 $Nicotinic_Acetylcholine_Receptor . 7788 organism . 'Torpedo marmorata' 'Marbled electric ray' . . Eukaryota Metazoa Torpedo marmorata . . . . . . . . . . . . . . . . . . . . . 17991 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 17991 _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 $Nicotinic_Acetylcholine_Receptor . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . . . . . . . . . . . NA . . . . . . 17991 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 17991 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'sodium phosphate' 'natural abundance' . . . . . . 20 . . mM . . . . 17991 1 2 LPPG 'natural abundance' . . . . . . 2 . . % . . . . 17991 1 3 D2O '[U-100% 2H]' . . . . . . 10 . . % . . . . 17991 1 4 H2O '[U-100% 2H]' . . . . . . 90 . . % . . . . 17991 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 17991 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 5.8 . pH 17991 1 pressure 1 . atm 17991 1 temperature 273 . K 17991 1 stop_ save_ ############################ # Computer software used # ############################ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 17991 _Software.ID 1 _Software.Name CYANA _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . 17991 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 17991 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 17991 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 17991 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 save_ save_spectrometer_3 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_3 _NMR_spectrometer.Entry_ID 17991 _NMR_spectrometer.ID 3 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_spectrometer_4 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_4 _NMR_spectrometer.Entry_ID 17991 _NMR_spectrometer.ID 4 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 900 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 17991 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker Avance . 600 . . . 17991 1 2 spectrometer_2 Bruker Avance . 700 . . . 17991 1 3 spectrometer_3 Bruker Avance . 800 . . . 17991 1 4 spectrometer_4 Bruker Avance . 900 . . . 17991 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 17991 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '3D HN(CO)CA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17991 1 2 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17991 1 3 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17991 1 4 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17991 1 5 '3D HCCH-TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17991 1 6 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17991 1 7 '3D 1H-13C NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 17991 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 17991 _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 0.0 internal indirect 0.25144953 . . . . . . . . . 17991 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 internal direct 1.0 . . . . . . . . . 17991 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 internal indirect 0.101329118 . . . . . . . . . 17991 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 17991 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '3D 1H-15N NOESY' . . . 17991 1 2 '3D 1H-13C NOESY' . . . 17991 1 3 '3D HNCA' . . . 17991 1 4 '3D HNCACB' . . . 17991 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 H H 1 8.686 0.000 . 1 . . . A 8 HIS H . 17991 1 2 . 1 1 8 8 HIS HA H 1 4.738 0.018 . 1 . . . A 8 HIS HA . 17991 1 3 . 1 1 8 8 HIS HB2 H 1 3.242 0.024 . 2 . . . A 8 HIS HB2 . 17991 1 4 . 1 1 8 8 HIS HB3 H 1 3.242 0.024 . 2 . . . A 8 HIS HB3 . 17991 1 5 . 1 1 8 8 HIS HD2 H 1 7.314 0.014 . 1 . . . A 8 HIS HD2 . 17991 1 6 . 1 1 8 8 HIS CA C 13 55.776 0.204 . 1 . . . A 8 HIS CA . 17991 1 7 . 1 1 8 8 HIS CB C 13 29.344 0.132 . 1 . . . A 8 HIS CB . 17991 1 8 . 1 1 9 9 ALA H H 1 8.457 0.020 . 1 . . . A 9 ALA H . 17991 1 9 . 1 1 9 9 ALA HA H 1 4.387 0.016 . 1 . . . A 9 ALA HA . 17991 1 10 . 1 1 9 9 ALA HB1 H 1 1.519 0.009 . . . . . A 9 ALA HB1 . 17991 1 11 . 1 1 9 9 ALA HB2 H 1 1.519 0.009 . . . . . A 9 ALA HB2 . 17991 1 12 . 1 1 9 9 ALA HB3 H 1 1.519 0.009 . . . . . A 9 ALA HB3 . 17991 1 13 . 1 1 9 9 ALA CA C 13 53.287 0.080 . 1 . . . A 9 ALA CA . 17991 1 14 . 1 1 9 9 ALA CB C 13 19.175 0.124 . 1 . . . A 9 ALA CB . 17991 1 15 . 1 1 9 9 ALA N N 15 124.079 0.045 . 1 . . . A 9 ALA N . 17991 1 16 . 1 1 10 10 MET H H 1 8.545 0.022 . 1 . . . A 10 MET H . 17991 1 17 . 1 1 10 10 MET HA H 1 4.390 0.009 . 1 . . . A 10 MET HA . 17991 1 18 . 1 1 10 10 MET HB2 H 1 2.181 0.022 . 2 . . . A 10 MET HB2 . 17991 1 19 . 1 1 10 10 MET HB3 H 1 2.181 0.022 . 2 . . . A 10 MET HB3 . 17991 1 20 . 1 1 10 10 MET HG2 H 1 2.699 0.015 . 2 . . . A 10 MET HG2 . 17991 1 21 . 1 1 10 10 MET HG3 H 1 2.699 0.015 . 2 . . . A 10 MET HG3 . 17991 1 22 . 1 1 10 10 MET HE1 H 1 2.154 0.005 . . . . . A 10 MET HE1 . 17991 1 23 . 1 1 10 10 MET HE2 H 1 2.154 0.005 . . . . . A 10 MET HE2 . 17991 1 24 . 1 1 10 10 MET HE3 H 1 2.154 0.005 . . . . . A 10 MET HE3 . 17991 1 25 . 1 1 10 10 MET CA C 13 57.753 0.196 . 1 . . . A 10 MET CA . 17991 1 26 . 1 1 10 10 MET CB C 13 32.355 0.049 . 1 . . . A 10 MET CB . 17991 1 27 . 1 1 10 10 MET CG C 13 32.609 0.060 . 1 . . . A 10 MET CG . 17991 1 28 . 1 1 10 10 MET CE C 13 17.151 0.097 . 1 . . . A 10 MET CE . 17991 1 29 . 1 1 10 10 MET N N 15 120.430 0.102 . 1 . . . A 10 MET N . 17991 1 30 . 1 1 11 11 VAL H H 1 8.339 0.022 . 1 . . . A 11 VAL H . 17991 1 31 . 1 1 11 11 VAL HA H 1 4.016 0.020 . 1 . . . A 11 VAL HA . 17991 1 32 . 1 1 11 11 VAL HB H 1 2.256 0.021 . 1 . . . A 11 VAL HB . 17991 1 33 . 1 1 11 11 VAL HG21 H 1 1.067 0.030 . . . . . A 11 VAL HG21 . 17991 1 34 . 1 1 11 11 VAL HG22 H 1 1.067 0.030 . . . . . A 11 VAL HG22 . 17991 1 35 . 1 1 11 11 VAL HG23 H 1 1.067 0.030 . . . . . A 11 VAL HG23 . 17991 1 36 . 1 1 11 11 VAL CA C 13 65.271 0.037 . 1 . . . A 11 VAL CA . 17991 1 37 . 1 1 11 11 VAL CB C 13 31.611 0.000 . 1 . . . A 11 VAL CB . 17991 1 38 . 1 1 11 11 VAL CG2 C 13 21.471 0.002 . 2 . . . A 11 VAL CG2 . 17991 1 39 . 1 1 11 11 VAL N N 15 119.159 0.075 . 1 . . . A 11 VAL N . 17991 1 40 . 1 1 12 12 ILE H H 1 7.705 0.017 . 1 . . . A 12 ILE H . 17991 1 41 . 1 1 12 12 ILE HA H 1 3.953 0.019 . 1 . . . A 12 ILE HA . 17991 1 42 . 1 1 12 12 ILE HB H 1 1.731 0.012 . 1 . . . A 12 ILE HB . 17991 1 43 . 1 1 12 12 ILE HG12 H 1 1.295 0.013 . . . . . A 12 ILE HG12 . 17991 1 44 . 1 1 12 12 ILE HG13 H 1 1.295 0.013 . . . . . A 12 ILE HG13 . 17991 1 45 . 1 1 12 12 ILE HG21 H 1 0.993 0.017 . . . . . A 12 ILE HG21 . 17991 1 46 . 1 1 12 12 ILE HG22 H 1 0.993 0.017 . . . . . A 12 ILE HG22 . 17991 1 47 . 1 1 12 12 ILE HG23 H 1 0.993 0.017 . . . . . A 12 ILE HG23 . 17991 1 48 . 1 1 12 12 ILE HD11 H 1 0.919 0.018 . . . . . A 12 ILE HD11 . 17991 1 49 . 1 1 12 12 ILE HD12 H 1 0.919 0.018 . . . . . A 12 ILE HD12 . 17991 1 50 . 1 1 12 12 ILE HD13 H 1 0.919 0.018 . . . . . A 12 ILE HD13 . 17991 1 51 . 1 1 12 12 ILE CA C 13 64.334 0.023 . 1 . . . A 12 ILE CA . 17991 1 52 . 1 1 12 12 ILE CB C 13 37.496 0.000 . 1 . . . A 12 ILE CB . 17991 1 53 . 1 1 12 12 ILE CG2 C 13 17.866 0.000 . 1 . . . A 12 ILE CG2 . 17991 1 54 . 1 1 12 12 ILE CD1 C 13 13.210 0.063 . 1 . . . A 12 ILE CD1 . 17991 1 55 . 1 1 12 12 ILE N N 15 119.461 0.096 . 1 . . . A 12 ILE N . 17991 1 56 . 1 1 13 13 ASP H H 1 8.172 0.013 . 1 . . . A 13 ASP H . 17991 1 57 . 1 1 13 13 ASP HA H 1 4.384 0.000 . 1 . . . A 13 ASP HA . 17991 1 58 . 1 1 13 13 ASP HB2 H 1 2.902 0.010 . 2 . . . A 13 ASP HB2 . 17991 1 59 . 1 1 13 13 ASP HB3 H 1 2.902 0.010 . 2 . . . A 13 ASP HB3 . 17991 1 60 . 1 1 13 13 ASP CA C 13 57.524 0.084 . 1 . . . A 13 ASP CA . 17991 1 61 . 1 1 13 13 ASP CB C 13 39.412 0.125 . 1 . . . A 13 ASP CB . 17991 1 62 . 1 1 13 13 ASP N N 15 119.460 0.050 . 1 . . . A 13 ASP N . 17991 1 63 . 1 1 14 14 HIS H H 1 8.138 0.009 . 1 . . . A 14 HIS H . 17991 1 64 . 1 1 14 14 HIS HA H 1 4.540 0.019 . 1 . . . A 14 HIS HA . 17991 1 65 . 1 1 14 14 HIS HB2 H 1 3.499 0.013 . 2 . . . A 14 HIS HB2 . 17991 1 66 . 1 1 14 14 HIS HB3 H 1 3.499 0.013 . 2 . . . A 14 HIS HB3 . 17991 1 67 . 1 1 14 14 HIS HD2 H 1 7.351 0.000 . 1 . . . A 14 HIS HD2 . 17991 1 68 . 1 1 14 14 HIS CA C 13 58.748 0.012 . 1 . . . A 14 HIS CA . 17991 1 69 . 1 1 14 14 HIS CB C 13 28.652 0.207 . 1 . . . A 14 HIS CB . 17991 1 70 . 1 1 14 14 HIS N N 15 116.421 0.098 . 1 . . . A 14 HIS N . 17991 1 71 . 1 1 15 15 ILE H H 1 8.224 0.016 . 1 . . . A 15 ILE H . 17991 1 72 . 1 1 15 15 ILE HA H 1 3.808 0.014 . 1 . . . A 15 ILE HA . 17991 1 73 . 1 1 15 15 ILE HB H 1 2.064 0.000 . 1 . . . A 15 ILE HB . 17991 1 74 . 1 1 15 15 ILE HG12 H 1 1.290 0.006 . . . . . A 15 ILE HG12 . 17991 1 75 . 1 1 15 15 ILE HG13 H 1 1.290 0.006 . . . . . A 15 ILE HG13 . 17991 1 76 . 1 1 15 15 ILE HG21 H 1 1.021 0.000 . . . . . A 15 ILE HG21 . 17991 1 77 . 1 1 15 15 ILE HG22 H 1 1.021 0.000 . . . . . A 15 ILE HG22 . 17991 1 78 . 1 1 15 15 ILE HG23 H 1 1.021 0.000 . . . . . A 15 ILE HG23 . 17991 1 79 . 1 1 15 15 ILE CA C 13 65.404 0.030 . 1 . . . A 15 ILE CA . 17991 1 80 . 1 1 15 15 ILE CB C 13 37.787 0.000 . 1 . . . A 15 ILE CB . 17991 1 81 . 1 1 15 15 ILE N N 15 119.970 0.104 . 1 . . . A 15 ILE N . 17991 1 82 . 1 1 16 16 LEU H H 1 8.480 0.005 . 1 . . . A 16 LEU H . 17991 1 83 . 1 1 16 16 LEU HA H 1 3.992 0.003 . 1 . . . A 16 LEU HA . 17991 1 84 . 1 1 16 16 LEU HB2 H 1 2.005 0.014 . 2 . . . A 16 LEU HB2 . 17991 1 85 . 1 1 16 16 LEU HB3 H 1 2.005 0.014 . 2 . . . A 16 LEU HB3 . 17991 1 86 . 1 1 16 16 LEU HG H 1 1.492 0.027 . 1 . . . A 16 LEU HG . 17991 1 87 . 1 1 16 16 LEU HD11 H 1 0.935 0.020 . . . . . A 16 LEU HD11 . 17991 1 88 . 1 1 16 16 LEU HD12 H 1 0.935 0.020 . . . . . A 16 LEU HD12 . 17991 1 89 . 1 1 16 16 LEU HD13 H 1 0.935 0.020 . . . . . A 16 LEU HD13 . 17991 1 90 . 1 1 16 16 LEU HD21 H 1 0.935 0.020 . . . . . A 16 LEU HD21 . 17991 1 91 . 1 1 16 16 LEU HD22 H 1 0.935 0.020 . . . . . A 16 LEU HD22 . 17991 1 92 . 1 1 16 16 LEU HD23 H 1 0.935 0.020 . . . . . A 16 LEU HD23 . 17991 1 93 . 1 1 16 16 LEU CA C 13 58.786 0.257 . 1 . . . A 16 LEU CA . 17991 1 94 . 1 1 16 16 LEU N N 15 118.635 0.084 . 1 . . . A 16 LEU N . 17991 1 95 . 1 1 17 17 LYS H H 1 8.098 0.011 . 1 . . . A 17 LYS H . 17991 1 96 . 1 1 17 17 LYS HA H 1 4.094 0.017 . 1 . . . A 17 LYS HA . 17991 1 97 . 1 1 17 17 LYS HB2 H 1 2.055 0.000 . 2 . . . A 17 LYS HB2 . 17991 1 98 . 1 1 17 17 LYS HB3 H 1 2.055 0.000 . 2 . . . A 17 LYS HB3 . 17991 1 99 . 1 1 17 17 LYS HE2 H 1 3.304 0.005 . 2 . . . A 17 LYS HE2 . 17991 1 100 . 1 1 17 17 LYS HE3 H 1 3.304 0.005 . 2 . . . A 17 LYS HE3 . 17991 1 101 . 1 1 17 17 LYS CA C 13 59.882 0.116 . 1 . . . A 17 LYS CA . 17991 1 102 . 1 1 17 17 LYS CB C 13 32.216 0.000 . 1 . . . A 17 LYS CB . 17991 1 103 . 1 1 17 17 LYS N N 15 118.257 0.117 . 1 . . . A 17 LYS N . 17991 1 104 . 1 1 18 18 CYS H H 1 7.899 0.010 . 1 . . . A 18 CYS H . 17991 1 105 . 1 1 18 18 CYS HA H 1 4.329 0.007 . 1 . . . A 18 CYS HA . 17991 1 106 . 1 1 18 18 CYS HB2 H 1 3.031 0.016 . 2 . . . A 18 CYS HB2 . 17991 1 107 . 1 1 18 18 CYS HB3 H 1 3.031 0.016 . 2 . . . A 18 CYS HB3 . 17991 1 108 . 1 1 18 18 CYS CA C 13 63.218 0.091 . 1 . . . A 18 CYS CA . 17991 1 109 . 1 1 18 18 CYS CB C 13 26.822 0.137 . 1 . . . A 18 CYS CB . 17991 1 110 . 1 1 18 18 CYS N N 15 117.220 0.079 . 1 . . . A 18 CYS N . 17991 1 111 . 1 1 19 19 VAL H H 1 8.352 0.020 . 1 . . . A 19 VAL H . 17991 1 112 . 1 1 19 19 VAL HA H 1 3.725 0.021 . 1 . . . A 19 VAL HA . 17991 1 113 . 1 1 19 19 VAL HB H 1 2.337 0.024 . 1 . . . A 19 VAL HB . 17991 1 114 . 1 1 19 19 VAL HG11 H 1 1.248 0.002 . . . . . A 19 VAL HG11 . 17991 1 115 . 1 1 19 19 VAL HG12 H 1 1.248 0.002 . . . . . A 19 VAL HG12 . 17991 1 116 . 1 1 19 19 VAL HG13 H 1 1.248 0.002 . . . . . A 19 VAL HG13 . 17991 1 117 . 1 1 19 19 VAL HG21 H 1 1.009 0.011 . . . . . A 19 VAL HG21 . 17991 1 118 . 1 1 19 19 VAL HG22 H 1 1.009 0.011 . . . . . A 19 VAL HG22 . 17991 1 119 . 1 1 19 19 VAL HG23 H 1 1.009 0.011 . . . . . A 19 VAL HG23 . 17991 1 120 . 1 1 19 19 VAL CA C 13 67.080 0.045 . 1 . . . A 19 VAL CA . 17991 1 121 . 1 1 19 19 VAL CB C 13 32.057 0.319 . 1 . . . A 19 VAL CB . 17991 1 122 . 1 1 19 19 VAL CG1 C 13 23.643 0.000 . 2 . . . A 19 VAL CG1 . 17991 1 123 . 1 1 19 19 VAL CG2 C 13 21.713 0.028 . 2 . . . A 19 VAL CG2 . 17991 1 124 . 1 1 19 19 VAL N N 15 118.929 0.086 . 1 . . . A 19 VAL N . 17991 1 125 . 1 1 20 20 PHE H H 1 8.791 0.016 . 1 . . . A 20 PHE H . 17991 1 126 . 1 1 20 20 PHE HA H 1 4.274 0.015 . 1 . . . A 20 PHE HA . 17991 1 127 . 1 1 20 20 PHE HB2 H 1 3.298 0.019 . 2 . . . A 20 PHE HB2 . 17991 1 128 . 1 1 20 20 PHE HB3 H 1 3.298 0.019 . 2 . . . A 20 PHE HB3 . 17991 1 129 . 1 1 20 20 PHE HD1 H 1 7.279 0.011 . 3 . . . A 20 PHE HD1 . 17991 1 130 . 1 1 20 20 PHE HD2 H 1 7.279 0.011 . 3 . . . A 20 PHE HD2 . 17991 1 131 . 1 1 20 20 PHE CA C 13 61.626 0.142 . 1 . . . A 20 PHE CA . 17991 1 132 . 1 1 20 20 PHE CB C 13 39.080 0.000 . 1 . . . A 20 PHE CB . 17991 1 133 . 1 1 20 20 PHE N N 15 120.244 0.076 . 1 . . . A 20 PHE N . 17991 1 134 . 1 1 21 21 ASP H H 1 8.705 0.027 . 1 . . . A 21 ASP H . 17991 1 135 . 1 1 21 21 ASP HA H 1 4.363 0.005 . 1 . . . A 21 ASP HA . 17991 1 136 . 1 1 21 21 ASP HB2 H 1 2.819 0.009 . 2 . . . A 21 ASP HB2 . 17991 1 137 . 1 1 21 21 ASP HB3 H 1 2.819 0.009 . 2 . . . A 21 ASP HB3 . 17991 1 138 . 1 1 21 21 ASP CA C 13 57.517 0.098 . 1 . . . A 21 ASP CA . 17991 1 139 . 1 1 21 21 ASP CB C 13 40.068 0.094 . 1 . . . A 21 ASP CB . 17991 1 140 . 1 1 21 21 ASP N N 15 118.761 0.159 . 1 . . . A 21 ASP N . 17991 1 141 . 1 1 22 22 LYS H H 1 7.810 0.012 . 1 . . . A 22 LYS H . 17991 1 142 . 1 1 22 22 LYS HA H 1 4.194 0.019 . 1 . . . A 22 LYS HA . 17991 1 143 . 1 1 22 22 LYS HB2 H 1 2.053 0.029 . 2 . . . A 22 LYS HB2 . 17991 1 144 . 1 1 22 22 LYS HB3 H 1 2.053 0.029 . 2 . . . A 22 LYS HB3 . 17991 1 145 . 1 1 22 22 LYS HG2 H 1 1.506 0.003 . 2 . . . A 22 LYS HG2 . 17991 1 146 . 1 1 22 22 LYS HG3 H 1 1.506 0.003 . 2 . . . A 22 LYS HG3 . 17991 1 147 . 1 1 22 22 LYS HE2 H 1 3.047 0.009 . 2 . . . A 22 LYS HE2 . 17991 1 148 . 1 1 22 22 LYS HE3 H 1 3.047 0.009 . 2 . . . A 22 LYS HE3 . 17991 1 149 . 1 1 22 22 LYS CA C 13 58.593 0.025 . 1 . . . A 22 LYS CA . 17991 1 150 . 1 1 22 22 LYS CB C 13 32.299 0.000 . 1 . . . A 22 LYS CB . 17991 1 151 . 1 1 22 22 LYS CG C 13 25.433 0.185 . 1 . . . A 22 LYS CG . 17991 1 152 . 1 1 22 22 LYS CE C 13 42.268 0.010 . 1 . . . A 22 LYS CE . 17991 1 153 . 1 1 22 22 LYS N N 15 118.200 0.060 . 1 . . . A 22 LYS N . 17991 1 154 . 1 1 23 23 ILE H H 1 8.351 0.006 . 1 . . . A 23 ILE H . 17991 1 155 . 1 1 23 23 ILE HA H 1 3.781 0.010 . 1 . . . A 23 ILE HA . 17991 1 156 . 1 1 23 23 ILE HB H 1 1.815 0.017 . 1 . . . A 23 ILE HB . 17991 1 157 . 1 1 23 23 ILE HG12 H 1 1.228 0.013 . . . . . A 23 ILE HG12 . 17991 1 158 . 1 1 23 23 ILE HG13 H 1 1.228 0.013 . . . . . A 23 ILE HG13 . 17991 1 159 . 1 1 23 23 ILE HG21 H 1 0.971 0.010 . . . . . A 23 ILE HG21 . 17991 1 160 . 1 1 23 23 ILE HG22 H 1 0.971 0.010 . . . . . A 23 ILE HG22 . 17991 1 161 . 1 1 23 23 ILE HG23 H 1 0.971 0.010 . . . . . A 23 ILE HG23 . 17991 1 162 . 1 1 23 23 ILE HD11 H 1 0.914 0.013 . . . . . A 23 ILE HD11 . 17991 1 163 . 1 1 23 23 ILE HD12 H 1 0.914 0.013 . . . . . A 23 ILE HD12 . 17991 1 164 . 1 1 23 23 ILE HD13 H 1 0.914 0.013 . . . . . A 23 ILE HD13 . 17991 1 165 . 1 1 23 23 ILE CA C 13 65.096 0.037 . 1 . . . A 23 ILE CA . 17991 1 166 . 1 1 23 23 ILE CG1 C 13 23.768 0.000 . 1 . . . A 23 ILE CG1 . 17991 1 167 . 1 1 23 23 ILE CG2 C 13 18.110 0.049 . 1 . . . A 23 ILE CG2 . 17991 1 168 . 1 1 23 23 ILE CD1 C 13 13.498 0.108 . 1 . . . A 23 ILE CD1 . 17991 1 169 . 1 1 23 23 ILE N N 15 118.534 0.132 . 1 . . . A 23 ILE N . 17991 1 170 . 1 1 24 24 CYS H H 1 8.203 0.009 . 1 . . . A 24 CYS H . 17991 1 171 . 1 1 24 24 CYS HA H 1 4.049 0.021 . 1 . . . A 24 CYS HA . 17991 1 172 . 1 1 24 24 CYS HB2 H 1 2.872 0.017 . 2 . . . A 24 CYS HB2 . 17991 1 173 . 1 1 24 24 CYS HB3 H 1 2.872 0.017 . 2 . . . A 24 CYS HB3 . 17991 1 174 . 1 1 24 24 CYS CA C 13 63.499 0.133 . 1 . . . A 24 CYS CA . 17991 1 175 . 1 1 24 24 CYS CB C 13 26.626 0.000 . 1 . . . A 24 CYS CB . 17991 1 176 . 1 1 24 24 CYS N N 15 117.155 0.079 . 1 . . . A 24 CYS N . 17991 1 177 . 1 1 25 25 LYS H H 1 7.760 0.015 . 1 . . . A 25 LYS H . 17991 1 178 . 1 1 25 25 LYS HB2 H 1 2.033 0.000 . 2 . . . A 25 LYS HB2 . 17991 1 179 . 1 1 25 25 LYS HB3 H 1 2.033 0.000 . 2 . . . A 25 LYS HB3 . 17991 1 180 . 1 1 25 25 LYS CA C 13 58.762 0.026 . 1 . . . A 25 LYS CA . 17991 1 181 . 1 1 25 25 LYS CB C 13 32.385 0.000 . 1 . . . A 25 LYS CB . 17991 1 182 . 1 1 25 25 LYS N N 15 119.995 0.093 . 1 . . . A 25 LYS N . 17991 1 183 . 1 1 26 26 ILE H H 1 8.055 0.020 . 1 . . . A 26 ILE H . 17991 1 184 . 1 1 26 26 ILE HA H 1 3.974 0.011 . 1 . . . A 26 ILE HA . 17991 1 185 . 1 1 26 26 ILE HB H 1 1.838 0.025 . 1 . . . A 26 ILE HB . 17991 1 186 . 1 1 26 26 ILE HG12 H 1 1.310 0.004 . . . . . A 26 ILE HG12 . 17991 1 187 . 1 1 26 26 ILE HG13 H 1 1.310 0.004 . . . . . A 26 ILE HG13 . 17991 1 188 . 1 1 26 26 ILE HG21 H 1 0.973 0.004 . . . . . A 26 ILE HG21 . 17991 1 189 . 1 1 26 26 ILE HG22 H 1 0.973 0.004 . . . . . A 26 ILE HG22 . 17991 1 190 . 1 1 26 26 ILE HG23 H 1 0.973 0.004 . . . . . A 26 ILE HG23 . 17991 1 191 . 1 1 26 26 ILE HD11 H 1 0.927 0.000 . . . . . A 26 ILE HD11 . 17991 1 192 . 1 1 26 26 ILE HD12 H 1 0.927 0.000 . . . . . A 26 ILE HD12 . 17991 1 193 . 1 1 26 26 ILE HD13 H 1 0.927 0.000 . . . . . A 26 ILE HD13 . 17991 1 194 . 1 1 26 26 ILE CA C 13 64.106 0.052 . 1 . . . A 26 ILE CA . 17991 1 195 . 1 1 26 26 ILE CB C 13 37.556 0.000 . 1 . . . A 26 ILE CB . 17991 1 196 . 1 1 26 26 ILE CG2 C 13 17.914 0.245 . 1 . . . A 26 ILE CG2 . 17991 1 197 . 1 1 26 26 ILE CD1 C 13 13.606 0.000 . 1 . . . A 26 ILE CD1 . 17991 1 198 . 1 1 26 26 ILE N N 15 119.168 0.153 . 1 . . . A 26 ILE N . 17991 1 199 . 1 1 27 27 GLY H H 1 8.568 0.013 . 1 . . . A 27 GLY H . 17991 1 200 . 1 1 27 27 GLY HA2 H 1 3.894 0.016 . 2 . . . A 27 GLY HA2 . 17991 1 201 . 1 1 27 27 GLY HA3 H 1 3.894 0.016 . 2 . . . A 27 GLY HA3 . 17991 1 202 . 1 1 27 27 GLY CA C 13 46.989 0.164 . 1 . . . A 27 GLY CA . 17991 1 203 . 1 1 27 27 GLY N N 15 108.257 0.073 . 1 . . . A 27 GLY N . 17991 1 204 . 1 1 28 28 THR H H 1 8.059 0.010 . 1 . . . A 28 THR H . 17991 1 205 . 1 1 28 28 THR HA H 1 3.912 0.004 . 1 . . . A 28 THR HA . 17991 1 206 . 1 1 28 28 THR HB H 1 4.305 0.000 . 1 . . . A 28 THR HB . 17991 1 207 . 1 1 28 28 THR HG21 H 1 1.349 0.000 . . . . . A 28 THR HG21 . 17991 1 208 . 1 1 28 28 THR HG22 H 1 1.349 0.000 . . . . . A 28 THR HG22 . 17991 1 209 . 1 1 28 28 THR HG23 H 1 1.349 0.000 . . . . . A 28 THR HG23 . 17991 1 210 . 1 1 28 28 THR CA C 13 64.717 0.136 . 1 . . . A 28 THR CA . 17991 1 211 . 1 1 28 28 THR CB C 13 69.375 0.000 . 1 . . . A 28 THR CB . 17991 1 212 . 1 1 28 28 THR N N 15 112.727 0.088 . 1 . . . A 28 THR N . 17991 1 213 . 1 1 29 29 GLU H H 1 8.113 0.001 . 1 . . . A 29 GLU H . 17991 1 214 . 1 1 29 29 GLU HB2 H 1 2.204 0.005 . 2 . . . A 29 GLU HB2 . 17991 1 215 . 1 1 29 29 GLU HB3 H 1 2.204 0.005 . 2 . . . A 29 GLU HB3 . 17991 1 216 . 1 1 29 29 GLU HG2 H 1 2.542 0.003 . 2 . . . A 29 GLU HG2 . 17991 1 217 . 1 1 29 29 GLU HG3 H 1 2.542 0.003 . 2 . . . A 29 GLU HG3 . 17991 1 218 . 1 1 29 29 GLU CA C 13 57.604 0.090 . 1 . . . A 29 GLU CA . 17991 1 219 . 1 1 29 29 GLU CB C 13 29.093 0.000 . 1 . . . A 29 GLU CB . 17991 1 220 . 1 1 29 29 GLU CG C 13 34.741 0.000 . 1 . . . A 29 GLU CG . 17991 1 221 . 1 1 29 29 GLU N N 15 120.068 0.013 . 1 . . . A 29 GLU N . 17991 1 222 . 1 1 30 30 SER H H 1 8.060 0.008 . 1 . . . A 30 SER H . 17991 1 223 . 1 1 30 30 SER HA H 1 4.374 0.005 . 1 . . . A 30 SER HA . 17991 1 224 . 1 1 30 30 SER HB2 H 1 4.105 0.000 . 2 . . . A 30 SER HB2 . 17991 1 225 . 1 1 30 30 SER HB3 H 1 4.105 0.000 . 2 . . . A 30 SER HB3 . 17991 1 226 . 1 1 30 30 SER CA C 13 60.353 0.122 . 1 . . . A 30 SER CA . 17991 1 227 . 1 1 30 30 SER N N 15 114.882 0.100 . 1 . . . A 30 SER N . 17991 1 228 . 1 1 31 31 VAL H H 1 8.127 0.024 . 1 . . . A 31 VAL H . 17991 1 229 . 1 1 31 31 VAL HA H 1 4.017 0.027 . 1 . . . A 31 VAL HA . 17991 1 230 . 1 1 31 31 VAL HB H 1 2.263 0.007 . 1 . . . A 31 VAL HB . 17991 1 231 . 1 1 31 31 VAL HG21 H 1 1.065 0.027 . . . . . A 31 VAL HG21 . 17991 1 232 . 1 1 31 31 VAL HG22 H 1 1.065 0.027 . . . . . A 31 VAL HG22 . 17991 1 233 . 1 1 31 31 VAL HG23 H 1 1.065 0.027 . . . . . A 31 VAL HG23 . 17991 1 234 . 1 1 31 31 VAL CA C 13 64.627 0.087 . 1 . . . A 31 VAL CA . 17991 1 235 . 1 1 31 31 VAL CB C 13 31.985 0.018 . 1 . . . A 31 VAL CB . 17991 1 236 . 1 1 31 31 VAL CG2 C 13 21.471 0.002 . 2 . . . A 31 VAL CG2 . 17991 1 237 . 1 1 31 31 VAL N N 15 122.098 0.204 . 1 . . . A 31 VAL N . 17991 1 238 . 1 1 32 32 GLU H H 1 8.243 0.013 . 1 . . . A 32 GLU H . 17991 1 239 . 1 1 32 32 GLU HA H 1 4.318 0.001 . 1 . . . A 32 GLU HA . 17991 1 240 . 1 1 32 32 GLU HB2 H 1 2.152 0.013 . 2 . . . A 32 GLU HB2 . 17991 1 241 . 1 1 32 32 GLU HB3 H 1 2.152 0.013 . 2 . . . A 32 GLU HB3 . 17991 1 242 . 1 1 32 32 GLU HG2 H 1 2.521 0.010 . 2 . . . A 32 GLU HG2 . 17991 1 243 . 1 1 32 32 GLU HG3 H 1 2.521 0.010 . 2 . . . A 32 GLU HG3 . 17991 1 244 . 1 1 32 32 GLU CA C 13 57.887 0.074 . 1 . . . A 32 GLU CA . 17991 1 245 . 1 1 32 32 GLU CB C 13 28.653 0.000 . 1 . . . A 32 GLU CB . 17991 1 246 . 1 1 32 32 GLU CG C 13 34.680 0.061 . 1 . . . A 32 GLU CG . 17991 1 247 . 1 1 32 32 GLU N N 15 120.280 0.176 . 1 . . . A 32 GLU N . 17991 1 248 . 1 1 33 33 ALA H H 1 8.218 0.006 . 1 . . . A 33 ALA H . 17991 1 249 . 1 1 33 33 ALA HA H 1 4.189 0.015 . 1 . . . A 33 ALA HA . 17991 1 250 . 1 1 33 33 ALA HB1 H 1 1.560 0.003 . . . . . A 33 ALA HB1 . 17991 1 251 . 1 1 33 33 ALA HB2 H 1 1.560 0.003 . . . . . A 33 ALA HB2 . 17991 1 252 . 1 1 33 33 ALA HB3 H 1 1.560 0.003 . . . . . A 33 ALA HB3 . 17991 1 253 . 1 1 33 33 ALA CA C 13 54.724 0.045 . 1 . . . A 33 ALA CA . 17991 1 254 . 1 1 33 33 ALA CB C 13 18.728 0.028 . 1 . . . A 33 ALA CB . 17991 1 255 . 1 1 33 33 ALA N N 15 121.715 0.097 . 1 . . . A 33 ALA N . 17991 1 256 . 1 1 34 34 GLY H H 1 8.308 0.010 . 1 . . . A 34 GLY H . 17991 1 257 . 1 1 34 34 GLY HA2 H 1 3.975 0.017 . 2 . . . A 34 GLY HA2 . 17991 1 258 . 1 1 34 34 GLY HA3 H 1 3.975 0.017 . 2 . . . A 34 GLY HA3 . 17991 1 259 . 1 1 34 34 GLY CA C 13 47.074 0.029 . 1 . . . A 34 GLY CA . 17991 1 260 . 1 1 34 34 GLY N N 15 104.656 0.034 . 1 . . . A 34 GLY N . 17991 1 261 . 1 1 35 35 ARG H H 1 7.975 0.022 . 1 . . . A 35 ARG H . 17991 1 262 . 1 1 35 35 ARG HA H 1 4.276 0.014 . 1 . . . A 35 ARG HA . 17991 1 263 . 1 1 35 35 ARG HB2 H 1 1.999 0.034 . 2 . . . A 35 ARG HB2 . 17991 1 264 . 1 1 35 35 ARG HB3 H 1 1.999 0.034 . 2 . . . A 35 ARG HB3 . 17991 1 265 . 1 1 35 35 ARG HG2 H 1 1.745 0.003 . 2 . . . A 35 ARG HG2 . 17991 1 266 . 1 1 35 35 ARG HG3 H 1 1.745 0.003 . 2 . . . A 35 ARG HG3 . 17991 1 267 . 1 1 35 35 ARG HD2 H 1 3.286 0.018 . 2 . . . A 35 ARG HD2 . 17991 1 268 . 1 1 35 35 ARG HD3 H 1 3.286 0.018 . 2 . . . A 35 ARG HD3 . 17991 1 269 . 1 1 35 35 ARG HE H 1 7.419 0.040 . 1 . . . A 35 ARG HE . 17991 1 270 . 1 1 35 35 ARG HH11 H 1 6.812 0.000 . 2 . . . A 35 ARG HH11 . 17991 1 271 . 1 1 35 35 ARG CA C 13 58.025 0.163 . 1 . . . A 35 ARG CA . 17991 1 272 . 1 1 35 35 ARG CB C 13 30.289 0.061 . 1 . . . A 35 ARG CB . 17991 1 273 . 1 1 35 35 ARG CG C 13 27.554 0.273 . 1 . . . A 35 ARG CG . 17991 1 274 . 1 1 35 35 ARG CD C 13 43.441 0.069 . 1 . . . A 35 ARG CD . 17991 1 275 . 1 1 35 35 ARG N N 15 119.958 0.067 . 1 . . . A 35 ARG N . 17991 1 276 . 1 1 35 35 ARG NE N 15 84.953 0.120 . 1 . . . A 35 ARG NE . 17991 1 277 . 1 1 35 35 ARG NH1 N 15 87.786 0.000 . 2 . . . A 35 ARG NH1 . 17991 1 278 . 1 1 36 36 LEU H H 1 7.958 0.017 . 1 . . . A 36 LEU H . 17991 1 279 . 1 1 36 36 LEU HA H 1 4.224 0.015 . 1 . . . A 36 LEU HA . 17991 1 280 . 1 1 36 36 LEU HB2 H 1 1.936 0.004 . 2 . . . A 36 LEU HB2 . 17991 1 281 . 1 1 36 36 LEU HB3 H 1 1.692 0.021 . 2 . . . A 36 LEU HB3 . 17991 1 282 . 1 1 36 36 LEU HD11 H 1 0.969 0.007 . . . . . A 36 LEU HD11 . 17991 1 283 . 1 1 36 36 LEU HD12 H 1 0.969 0.007 . . . . . A 36 LEU HD12 . 17991 1 284 . 1 1 36 36 LEU HD13 H 1 0.969 0.007 . . . . . A 36 LEU HD13 . 17991 1 285 . 1 1 36 36 LEU HD21 H 1 0.969 0.007 . . . . . A 36 LEU HD21 . 17991 1 286 . 1 1 36 36 LEU HD22 H 1 0.969 0.007 . . . . . A 36 LEU HD22 . 17991 1 287 . 1 1 36 36 LEU HD23 H 1 0.969 0.007 . . . . . A 36 LEU HD23 . 17991 1 288 . 1 1 36 36 LEU CA C 13 57.803 0.253 . 1 . . . A 36 LEU CA . 17991 1 289 . 1 1 36 36 LEU CB C 13 42.193 0.118 . 1 . . . A 36 LEU CB . 17991 1 290 . 1 1 36 36 LEU N N 15 118.931 0.081 . 1 . . . A 36 LEU N . 17991 1 291 . 1 1 37 37 ILE H H 1 7.904 0.010 . 1 . . . A 37 ILE H . 17991 1 292 . 1 1 37 37 ILE HA H 1 3.931 0.017 . 1 . . . A 37 ILE HA . 17991 1 293 . 1 1 37 37 ILE HB H 1 2.027 0.008 . 1 . . . A 37 ILE HB . 17991 1 294 . 1 1 37 37 ILE HG12 H 1 1.274 0.021 . . . . . A 37 ILE HG12 . 17991 1 295 . 1 1 37 37 ILE HG13 H 1 1.274 0.021 . . . . . A 37 ILE HG13 . 17991 1 296 . 1 1 37 37 ILE HG21 H 1 0.971 0.011 . . . . . A 37 ILE HG21 . 17991 1 297 . 1 1 37 37 ILE HG22 H 1 0.971 0.011 . . . . . A 37 ILE HG22 . 17991 1 298 . 1 1 37 37 ILE HG23 H 1 0.971 0.011 . . . . . A 37 ILE HG23 . 17991 1 299 . 1 1 37 37 ILE HD11 H 1 0.917 0.000 . . . . . A 37 ILE HD11 . 17991 1 300 . 1 1 37 37 ILE HD12 H 1 0.917 0.000 . . . . . A 37 ILE HD12 . 17991 1 301 . 1 1 37 37 ILE HD13 H 1 0.917 0.000 . . . . . A 37 ILE HD13 . 17991 1 302 . 1 1 37 37 ILE CA C 13 63.859 0.009 . 1 . . . A 37 ILE CA . 17991 1 303 . 1 1 37 37 ILE CB C 13 38.039 0.073 . 1 . . . A 37 ILE CB . 17991 1 304 . 1 1 37 37 ILE CG2 C 13 17.705 0.124 . 1 . . . A 37 ILE CG2 . 17991 1 305 . 1 1 37 37 ILE CD1 C 13 13.499 0.000 . 1 . . . A 37 ILE CD1 . 17991 1 306 . 1 1 37 37 ILE N N 15 118.087 0.180 . 1 . . . A 37 ILE N . 17991 1 307 . 1 1 38 38 GLU H H 1 8.041 0.015 . 1 . . . A 38 GLU H . 17991 1 308 . 1 1 38 38 GLU HA H 1 4.231 0.016 . 1 . . . A 38 GLU HA . 17991 1 309 . 1 1 38 38 GLU HB2 H 1 2.202 0.016 . 2 . . . A 38 GLU HB2 . 17991 1 310 . 1 1 38 38 GLU HB3 H 1 2.202 0.016 . 2 . . . A 38 GLU HB3 . 17991 1 311 . 1 1 38 38 GLU HG2 H 1 2.479 0.007 . 2 . . . A 38 GLU HG2 . 17991 1 312 . 1 1 38 38 GLU HG3 H 1 2.479 0.007 . 2 . . . A 38 GLU HG3 . 17991 1 313 . 1 1 38 38 GLU CA C 13 58.445 0.189 . 1 . . . A 38 GLU CA . 17991 1 314 . 1 1 38 38 GLU CB C 13 29.011 0.000 . 1 . . . A 38 GLU CB . 17991 1 315 . 1 1 38 38 GLU CG C 13 34.741 0.000 . 1 . . . A 38 GLU CG . 17991 1 316 . 1 1 38 38 GLU N N 15 120.989 0.048 . 1 . . . A 38 GLU N . 17991 1 317 . 1 1 39 39 LEU H H 1 8.173 0.010 . 1 . . . A 39 LEU H . 17991 1 318 . 1 1 39 39 LEU HA H 1 4.271 0.009 . 1 . . . A 39 LEU HA . 17991 1 319 . 1 1 39 39 LEU HB2 H 1 1.886 0.017 . 2 . . . A 39 LEU HB2 . 17991 1 320 . 1 1 39 39 LEU HB3 H 1 1.704 0.027 . 2 . . . A 39 LEU HB3 . 17991 1 321 . 1 1 39 39 LEU HD11 H 1 0.964 0.006 . . . . . A 39 LEU HD11 . 17991 1 322 . 1 1 39 39 LEU HD12 H 1 0.964 0.006 . . . . . A 39 LEU HD12 . 17991 1 323 . 1 1 39 39 LEU HD13 H 1 0.964 0.006 . . . . . A 39 LEU HD13 . 17991 1 324 . 1 1 39 39 LEU HD21 H 1 0.964 0.006 . . . . . A 39 LEU HD21 . 17991 1 325 . 1 1 39 39 LEU HD22 H 1 0.964 0.006 . . . . . A 39 LEU HD22 . 17991 1 326 . 1 1 39 39 LEU HD23 H 1 0.964 0.006 . . . . . A 39 LEU HD23 . 17991 1 327 . 1 1 39 39 LEU CA C 13 57.411 0.288 . 1 . . . A 39 LEU CA . 17991 1 328 . 1 1 39 39 LEU CB C 13 42.295 0.000 . 1 . . . A 39 LEU CB . 17991 1 329 . 1 1 39 39 LEU N N 15 120.111 0.043 . 1 . . . A 39 LEU N . 17991 1 330 . 1 1 40 40 SER H H 1 8.031 0.009 . 1 . . . A 40 SER H . 17991 1 331 . 1 1 40 40 SER HA H 1 4.312 0.016 . 1 . . . A 40 SER HA . 17991 1 332 . 1 1 40 40 SER HB2 H 1 4.025 0.021 . 2 . . . A 40 SER HB2 . 17991 1 333 . 1 1 40 40 SER HB3 H 1 4.025 0.021 . 2 . . . A 40 SER HB3 . 17991 1 334 . 1 1 40 40 SER CA C 13 60.406 0.056 . 1 . . . A 40 SER CA . 17991 1 335 . 1 1 40 40 SER CB C 13 63.646 0.181 . 1 . . . A 40 SER CB . 17991 1 336 . 1 1 40 40 SER N N 15 113.806 0.059 . 1 . . . A 40 SER N . 17991 1 337 . 1 1 41 41 GLN H H 1 7.956 0.011 . 1 . . . A 41 GLN H . 17991 1 338 . 1 1 41 41 GLN HA H 1 4.396 0.017 . 1 . . . A 41 GLN HA . 17991 1 339 . 1 1 41 41 GLN HB2 H 1 2.188 0.027 . 2 . . . A 41 GLN HB2 . 17991 1 340 . 1 1 41 41 GLN HB3 H 1 2.188 0.027 . 2 . . . A 41 GLN HB3 . 17991 1 341 . 1 1 41 41 GLN HG2 H 1 2.494 0.012 . 2 . . . A 41 GLN HG2 . 17991 1 342 . 1 1 41 41 GLN HG3 H 1 2.455 0.000 . 2 . . . A 41 GLN HG3 . 17991 1 343 . 1 1 41 41 GLN HE21 H 1 7.370 0.024 . 2 . . . A 41 GLN HE21 . 17991 1 344 . 1 1 41 41 GLN HE22 H 1 6.803 0.023 . 2 . . . A 41 GLN HE22 . 17991 1 345 . 1 1 41 41 GLN CA C 13 56.601 0.161 . 1 . . . A 41 GLN CA . 17991 1 346 . 1 1 41 41 GLN CB C 13 29.385 0.031 . 1 . . . A 41 GLN CB . 17991 1 347 . 1 1 41 41 GLN CG C 13 34.212 0.047 . 1 . . . A 41 GLN CG . 17991 1 348 . 1 1 41 41 GLN N N 15 120.139 0.056 . 1 . . . A 41 GLN N . 17991 1 349 . 1 1 41 41 GLN NE2 N 15 111.168 0.122 . 1 . . . A 41 GLN NE2 . 17991 1 350 . 1 1 42 42 GLU H H 1 8.114 0.017 . 1 . . . A 42 GLU H . 17991 1 351 . 1 1 42 42 GLU HA H 1 4.373 0.010 . 1 . . . A 42 GLU HA . 17991 1 352 . 1 1 42 42 GLU HB2 H 1 2.181 0.011 . 2 . . . A 42 GLU HB2 . 17991 1 353 . 1 1 42 42 GLU HB3 H 1 2.181 0.011 . 2 . . . A 42 GLU HB3 . 17991 1 354 . 1 1 42 42 GLU HG2 H 1 2.509 0.015 . 2 . . . A 42 GLU HG2 . 17991 1 355 . 1 1 42 42 GLU HG3 H 1 2.509 0.015 . 2 . . . A 42 GLU HG3 . 17991 1 356 . 1 1 42 42 GLU CA C 13 57.089 0.076 . 1 . . . A 42 GLU CA . 17991 1 357 . 1 1 42 42 GLU CB C 13 29.355 0.000 . 1 . . . A 42 GLU CB . 17991 1 358 . 1 1 42 42 GLU CG C 13 34.440 0.000 . 1 . . . A 42 GLU CG . 17991 1 359 . 1 1 42 42 GLU N N 15 119.728 0.060 . 1 . . . A 42 GLU N . 17991 1 360 . 1 1 43 43 GLY H H 1 8.325 0.013 . 1 . . . A 43 GLY H . 17991 1 361 . 1 1 43 43 GLY HA2 H 1 4.027 0.003 . 2 . . . A 43 GLY HA2 . 17991 1 362 . 1 1 43 43 GLY HA3 H 1 4.027 0.003 . 2 . . . A 43 GLY HA3 . 17991 1 363 . 1 1 43 43 GLY CA C 13 45.623 0.027 . 1 . . . A 43 GLY CA . 17991 1 364 . 1 1 43 43 GLY N N 15 108.655 0.046 . 1 . . . A 43 GLY N . 17991 1 365 . 1 1 44 44 GLY H H 1 8.105 0.004 . 1 . . . A 44 GLY H . 17991 1 366 . 1 1 44 44 GLY HA2 H 1 3.953 0.005 . 2 . . . A 44 GLY HA2 . 17991 1 367 . 1 1 44 44 GLY HA3 H 1 3.953 0.005 . 2 . . . A 44 GLY HA3 . 17991 1 368 . 1 1 44 44 GLY CA C 13 45.487 0.000 . 1 . . . A 44 GLY CA . 17991 1 369 . 1 1 44 44 GLY N N 15 107.872 0.054 . 1 . . . A 44 GLY N . 17991 1 370 . 1 1 48 48 GLY HA2 H 1 3.965 0.008 . 2 . . . A 48 GLY HA2 . 17991 1 371 . 1 1 48 48 GLY HA3 H 1 3.965 0.008 . 2 . . . A 48 GLY HA3 . 17991 1 372 . 1 1 48 48 GLY CA C 13 45.395 0.000 . 1 . . . A 48 GLY CA . 17991 1 373 . 1 1 49 49 PRO HA H 1 4.469 0.020 . 1 . . . A 49 PRO HA . 17991 1 374 . 1 1 49 49 PRO HB2 H 1 2.365 0.010 . 2 . . . A 49 PRO HB2 . 17991 1 375 . 1 1 49 49 PRO HB3 H 1 2.113 0.010 . 2 . . . A 49 PRO HB3 . 17991 1 376 . 1 1 49 49 PRO HG2 H 1 2.101 0.013 . 2 . . . A 49 PRO HG2 . 17991 1 377 . 1 1 49 49 PRO HG3 H 1 2.101 0.013 . 2 . . . A 49 PRO HG3 . 17991 1 378 . 1 1 49 49 PRO HD2 H 1 3.787 0.012 . 2 . . . A 49 PRO HD2 . 17991 1 379 . 1 1 49 49 PRO HD3 H 1 3.787 0.012 . 2 . . . A 49 PRO HD3 . 17991 1 380 . 1 1 49 49 PRO CA C 13 65.430 0.146 . 1 . . . A 49 PRO CA . 17991 1 381 . 1 1 49 49 PRO CB C 13 32.321 0.031 . 1 . . . A 49 PRO CB . 17991 1 382 . 1 1 49 49 PRO CG C 13 27.479 0.000 . 1 . . . A 49 PRO CG . 17991 1 383 . 1 1 49 49 PRO CD C 13 50.049 0.204 . 1 . . . A 49 PRO CD . 17991 1 384 . 1 1 50 50 LEU H H 1 8.336 0.014 . 1 . . . A 50 LEU H . 17991 1 385 . 1 1 50 50 LEU HA H 1 4.202 0.013 . 1 . . . A 50 LEU HA . 17991 1 386 . 1 1 50 50 LEU HB2 H 1 1.732 0.018 . 2 . . . A 50 LEU HB2 . 17991 1 387 . 1 1 50 50 LEU HB3 H 1 1.732 0.018 . 2 . . . A 50 LEU HB3 . 17991 1 388 . 1 1 50 50 LEU HG H 1 1.717 0.000 . 1 . . . A 50 LEU HG . 17991 1 389 . 1 1 50 50 LEU HD11 H 1 0.981 0.011 . . . . . A 50 LEU HD11 . 17991 1 390 . 1 1 50 50 LEU HD12 H 1 0.981 0.011 . . . . . A 50 LEU HD12 . 17991 1 391 . 1 1 50 50 LEU HD13 H 1 0.981 0.011 . . . . . A 50 LEU HD13 . 17991 1 392 . 1 1 50 50 LEU HD21 H 1 0.981 0.011 . . . . . A 50 LEU HD21 . 17991 1 393 . 1 1 50 50 LEU HD22 H 1 0.981 0.011 . . . . . A 50 LEU HD22 . 17991 1 394 . 1 1 50 50 LEU HD23 H 1 0.981 0.011 . . . . . A 50 LEU HD23 . 17991 1 395 . 1 1 50 50 LEU CA C 13 57.549 0.180 . 1 . . . A 50 LEU CA . 17991 1 396 . 1 1 50 50 LEU CB C 13 41.699 0.180 . 1 . . . A 50 LEU CB . 17991 1 397 . 1 1 50 50 LEU CG C 13 27.976 0.000 . 1 . . . A 50 LEU CG . 17991 1 398 . 1 1 50 50 LEU CD1 C 13 24.852 0.263 . 2 . . . A 50 LEU CD1 . 17991 1 399 . 1 1 50 50 LEU N N 15 116.864 0.048 . 1 . . . A 50 LEU N . 17991 1 400 . 1 1 51 51 TYR H H 1 7.765 0.009 . 1 . . . A 51 TYR H . 17991 1 401 . 1 1 51 51 TYR HA H 1 4.165 0.016 . 1 . . . A 51 TYR HA . 17991 1 402 . 1 1 51 51 TYR HB2 H 1 3.115 0.012 . 2 . . . A 51 TYR HB2 . 17991 1 403 . 1 1 51 51 TYR HB3 H 1 3.115 0.012 . 2 . . . A 51 TYR HB3 . 17991 1 404 . 1 1 51 51 TYR HD1 H 1 7.071 0.007 . 3 . . . A 51 TYR HD1 . 17991 1 405 . 1 1 51 51 TYR HD2 H 1 7.071 0.007 . 3 . . . A 51 TYR HD2 . 17991 1 406 . 1 1 51 51 TYR CA C 13 61.034 0.162 . 1 . . . A 51 TYR CA . 17991 1 407 . 1 1 51 51 TYR CB C 13 38.484 0.283 . 1 . . . A 51 TYR CB . 17991 1 408 . 1 1 51 51 TYR N N 15 118.433 0.110 . 1 . . . A 51 TYR N . 17991 1 409 . 1 1 52 52 PHE H H 1 7.873 0.021 . 1 . . . A 52 PHE H . 17991 1 410 . 1 1 52 52 PHE HA H 1 4.260 0.015 . 1 . . . A 52 PHE HA . 17991 1 411 . 1 1 52 52 PHE HB2 H 1 3.272 0.016 . 2 . . . A 52 PHE HB2 . 17991 1 412 . 1 1 52 52 PHE HB3 H 1 3.272 0.016 . 2 . . . A 52 PHE HB3 . 17991 1 413 . 1 1 52 52 PHE HD1 H 1 7.272 0.013 . 3 . . . A 52 PHE HD1 . 17991 1 414 . 1 1 52 52 PHE HD2 H 1 7.272 0.013 . 3 . . . A 52 PHE HD2 . 17991 1 415 . 1 1 52 52 PHE HE1 H 1 7.013 0.000 . 3 . . . A 52 PHE HE1 . 17991 1 416 . 1 1 52 52 PHE HE2 H 1 7.013 0.000 . 3 . . . A 52 PHE HE2 . 17991 1 417 . 1 1 52 52 PHE CA C 13 61.251 0.243 . 1 . . . A 52 PHE CA . 17991 1 418 . 1 1 52 52 PHE CB C 13 39.319 0.055 . 1 . . . A 52 PHE CB . 17991 1 419 . 1 1 52 52 PHE N N 15 117.945 0.105 . 1 . . . A 52 PHE N . 17991 1 420 . 1 1 53 53 VAL H H 1 7.864 0.006 . 1 . . . A 53 VAL H . 17991 1 421 . 1 1 53 53 VAL HA H 1 3.652 0.024 . 1 . . . A 53 VAL HA . 17991 1 422 . 1 1 53 53 VAL HB H 1 2.284 0.019 . 1 . . . A 53 VAL HB . 17991 1 423 . 1 1 53 53 VAL HG21 H 1 1.052 0.008 . . . . . A 53 VAL HG21 . 17991 1 424 . 1 1 53 53 VAL HG22 H 1 1.052 0.008 . . . . . A 53 VAL HG22 . 17991 1 425 . 1 1 53 53 VAL HG23 H 1 1.052 0.008 . . . . . A 53 VAL HG23 . 17991 1 426 . 1 1 53 53 VAL CA C 13 66.298 0.228 . 1 . . . A 53 VAL CA . 17991 1 427 . 1 1 53 53 VAL CB C 13 31.810 0.000 . 1 . . . A 53 VAL CB . 17991 1 428 . 1 1 53 53 VAL CG2 C 13 22.074 0.000 . 2 . . . A 53 VAL CG2 . 17991 1 429 . 1 1 53 53 VAL N N 15 117.468 0.131 . 1 . . . A 53 VAL N . 17991 1 430 . 1 1 54 54 VAL H H 1 7.958 0.010 . 1 . . . A 54 VAL H . 17991 1 431 . 1 1 54 54 VAL HA H 1 3.702 0.009 . 1 . . . A 54 VAL HA . 17991 1 432 . 1 1 54 54 VAL HB H 1 2.122 0.012 . 1 . . . A 54 VAL HB . 17991 1 433 . 1 1 54 54 VAL HG21 H 1 0.989 0.016 . . . . . A 54 VAL HG21 . 17991 1 434 . 1 1 54 54 VAL HG22 H 1 0.989 0.016 . . . . . A 54 VAL HG22 . 17991 1 435 . 1 1 54 54 VAL HG23 H 1 0.989 0.016 . . . . . A 54 VAL HG23 . 17991 1 436 . 1 1 54 54 VAL CA C 13 66.067 0.192 . 1 . . . A 54 VAL CA . 17991 1 437 . 1 1 54 54 VAL CB C 13 31.801 0.151 . 1 . . . A 54 VAL CB . 17991 1 438 . 1 1 54 54 VAL CG2 C 13 21.650 0.026 . 2 . . . A 54 VAL CG2 . 17991 1 439 . 1 1 54 54 VAL N N 15 116.929 0.109 . 1 . . . A 54 VAL N . 17991 1 440 . 1 1 55 55 ASN H H 1 7.823 0.012 . 1 . . . A 55 ASN H . 17991 1 441 . 1 1 55 55 ASN HA H 1 4.630 0.022 . 1 . . . A 55 ASN HA . 17991 1 442 . 1 1 55 55 ASN HB2 H 1 2.663 0.028 . 2 . . . A 55 ASN HB2 . 17991 1 443 . 1 1 55 55 ASN HB3 H 1 2.663 0.028 . 2 . . . A 55 ASN HB3 . 17991 1 444 . 1 1 55 55 ASN HD21 H 1 7.045 0.009 . 2 . . . A 55 ASN HD21 . 17991 1 445 . 1 1 55 55 ASN HD22 H 1 6.669 0.009 . 2 . . . A 55 ASN HD22 . 17991 1 446 . 1 1 55 55 ASN CA C 13 55.460 0.005 . 1 . . . A 55 ASN CA . 17991 1 447 . 1 1 55 55 ASN CB C 13 39.929 0.476 . 1 . . . A 55 ASN CB . 17991 1 448 . 1 1 55 55 ASN N N 15 115.543 0.076 . 1 . . . A 55 ASN N . 17991 1 449 . 1 1 55 55 ASN ND2 N 15 112.546 0.013 . 1 . . . A 55 ASN ND2 . 17991 1 450 . 1 1 56 56 VAL H H 1 7.664 0.014 . 1 . . . A 56 VAL H . 17991 1 451 . 1 1 56 56 VAL HA H 1 4.097 0.011 . 1 . . . A 56 VAL HA . 17991 1 452 . 1 1 56 56 VAL HB H 1 2.111 0.022 . 1 . . . A 56 VAL HB . 17991 1 453 . 1 1 56 56 VAL HG21 H 1 0.915 0.010 . . . . . A 56 VAL HG21 . 17991 1 454 . 1 1 56 56 VAL HG22 H 1 0.915 0.010 . . . . . A 56 VAL HG22 . 17991 1 455 . 1 1 56 56 VAL HG23 H 1 0.915 0.010 . . . . . A 56 VAL HG23 . 17991 1 456 . 1 1 56 56 VAL CA C 13 64.139 0.161 . 1 . . . A 56 VAL CA . 17991 1 457 . 1 1 56 56 VAL CB C 13 32.003 0.084 . 1 . . . A 56 VAL CB . 17991 1 458 . 1 1 56 56 VAL CG2 C 13 21.569 0.126 . 2 . . . A 56 VAL CG2 . 17991 1 459 . 1 1 56 56 VAL N N 15 116.125 0.057 . 1 . . . A 56 VAL N . 17991 1 460 . 1 1 57 57 ILE H H 1 7.587 0.015 . 1 . . . A 57 ILE H . 17991 1 461 . 1 1 57 57 ILE HA H 1 4.009 0.009 . 1 . . . A 57 ILE HA . 17991 1 462 . 1 1 57 57 ILE HB H 1 1.638 0.017 . 1 . . . A 57 ILE HB . 17991 1 463 . 1 1 57 57 ILE HG12 H 1 1.309 0.011 . . . . . A 57 ILE HG12 . 17991 1 464 . 1 1 57 57 ILE HG13 H 1 1.309 0.011 . . . . . A 57 ILE HG13 . 17991 1 465 . 1 1 57 57 ILE HG21 H 1 0.947 0.017 . . . . . A 57 ILE HG21 . 17991 1 466 . 1 1 57 57 ILE HG22 H 1 0.947 0.017 . . . . . A 57 ILE HG22 . 17991 1 467 . 1 1 57 57 ILE HG23 H 1 0.947 0.017 . . . . . A 57 ILE HG23 . 17991 1 468 . 1 1 57 57 ILE HD11 H 1 0.907 0.000 . . . . . A 57 ILE HD11 . 17991 1 469 . 1 1 57 57 ILE HD12 H 1 0.907 0.000 . . . . . A 57 ILE HD12 . 17991 1 470 . 1 1 57 57 ILE HD13 H 1 0.907 0.000 . . . . . A 57 ILE HD13 . 17991 1 471 . 1 1 57 57 ILE CA C 13 63.550 0.014 . 1 . . . A 57 ILE CA . 17991 1 472 . 1 1 57 57 ILE CB C 13 37.763 0.000 . 1 . . . A 57 ILE CB . 17991 1 473 . 1 1 57 57 ILE CD1 C 13 13.027 0.000 . 1 . . . A 57 ILE CD1 . 17991 1 474 . 1 1 57 57 ILE N N 15 116.872 0.095 . 1 . . . A 57 ILE N . 17991 1 475 . 1 1 58 58 GLU H H 1 8.114 0.014 . 1 . . . A 58 GLU H . 17991 1 476 . 1 1 58 58 GLU HA H 1 4.199 0.003 . 1 . . . A 58 GLU HA . 17991 1 477 . 1 1 58 58 GLU HB2 H 1 2.186 0.008 . 2 . . . A 58 GLU HB2 . 17991 1 478 . 1 1 58 58 GLU HB3 H 1 2.186 0.008 . 2 . . . A 58 GLU HB3 . 17991 1 479 . 1 1 58 58 GLU HG2 H 1 2.428 0.023 . 2 . . . A 58 GLU HG2 . 17991 1 480 . 1 1 58 58 GLU HG3 H 1 2.428 0.023 . 2 . . . A 58 GLU HG3 . 17991 1 481 . 1 1 58 58 GLU CA C 13 60.305 0.000 . 1 . . . A 58 GLU CA . 17991 1 482 . 1 1 58 58 GLU CG C 13 34.345 0.285 . 1 . . . A 58 GLU CG . 17991 1 483 . 1 1 58 58 GLU N N 15 118.190 0.103 . 1 . . . A 58 GLU N . 17991 1 484 . 1 1 59 59 PRO HA H 1 4.509 0.018 . 1 . . . A 59 PRO HA . 17991 1 485 . 1 1 59 59 PRO HG2 H 1 2.088 0.009 . 2 . . . A 59 PRO HG2 . 17991 1 486 . 1 1 59 59 PRO HG3 H 1 2.088 0.009 . 2 . . . A 59 PRO HG3 . 17991 1 487 . 1 1 59 59 PRO HD2 H 1 3.901 0.006 . 2 . . . A 59 PRO HD2 . 17991 1 488 . 1 1 59 59 PRO HD3 H 1 3.901 0.006 . 2 . . . A 59 PRO HD3 . 17991 1 489 . 1 1 59 59 PRO CA C 13 65.562 0.034 . 1 . . . A 59 PRO CA . 17991 1 490 . 1 1 59 59 PRO CB C 13 31.466 0.000 . 1 . . . A 59 PRO CB . 17991 1 491 . 1 1 59 59 PRO CG C 13 27.636 0.249 . 1 . . . A 59 PRO CG . 17991 1 492 . 1 1 60 60 CYS H H 1 7.913 0.010 . 1 . . . A 60 CYS H . 17991 1 493 . 1 1 60 60 CYS HA H 1 4.268 0.011 . 1 . . . A 60 CYS HA . 17991 1 494 . 1 1 60 60 CYS HB2 H 1 3.197 0.006 . 2 . . . A 60 CYS HB2 . 17991 1 495 . 1 1 60 60 CYS HB3 H 1 2.992 0.036 . 2 . . . A 60 CYS HB3 . 17991 1 496 . 1 1 60 60 CYS CA C 13 62.113 0.056 . 1 . . . A 60 CYS CA . 17991 1 497 . 1 1 60 60 CYS CB C 13 26.990 0.082 . 1 . . . A 60 CYS CB . 17991 1 498 . 1 1 60 60 CYS N N 15 115.035 0.080 . 1 . . . A 60 CYS N . 17991 1 499 . 1 1 61 61 LYS H H 1 8.197 0.009 . 1 . . . A 61 LYS H . 17991 1 500 . 1 1 61 61 LYS HA H 1 4.272 0.002 . 1 . . . A 61 LYS HA . 17991 1 501 . 1 1 61 61 LYS HB2 H 1 1.940 0.020 . 2 . . . A 61 LYS HB2 . 17991 1 502 . 1 1 61 61 LYS HB3 H 1 1.940 0.020 . 2 . . . A 61 LYS HB3 . 17991 1 503 . 1 1 61 61 LYS HG2 H 1 1.505 0.005 . 2 . . . A 61 LYS HG2 . 17991 1 504 . 1 1 61 61 LYS HG3 H 1 1.505 0.005 . 2 . . . A 61 LYS HG3 . 17991 1 505 . 1 1 61 61 LYS HE2 H 1 2.922 0.114 . 2 . . . A 61 LYS HE2 . 17991 1 506 . 1 1 61 61 LYS HE3 H 1 2.922 0.114 . 2 . . . A 61 LYS HE3 . 17991 1 507 . 1 1 61 61 LYS CA C 13 59.089 0.010 . 1 . . . A 61 LYS CA . 17991 1 508 . 1 1 61 61 LYS CB C 13 32.428 0.000 . 1 . . . A 61 LYS CB . 17991 1 509 . 1 1 61 61 LYS CG C 13 25.430 0.103 . 1 . . . A 61 LYS CG . 17991 1 510 . 1 1 61 61 LYS N N 15 121.184 0.158 . 1 . . . A 61 LYS N . 17991 1 511 . 1 1 62 62 LYS H H 1 7.982 0.002 . 1 . . . A 62 LYS H . 17991 1 512 . 1 1 62 62 LYS CA C 13 57.844 0.073 . 1 . . . A 62 LYS CA . 17991 1 513 . 1 1 62 62 LYS CB C 13 32.090 0.000 . 1 . . . A 62 LYS CB . 17991 1 514 . 1 1 62 62 LYS N N 15 118.253 0.073 . 1 . . . A 62 LYS N . 17991 1 515 . 1 1 63 63 PHE H H 1 8.155 0.016 . 1 . . . A 63 PHE H . 17991 1 516 . 1 1 63 63 PHE HA H 1 4.255 0.004 . 1 . . . A 63 PHE HA . 17991 1 517 . 1 1 63 63 PHE HB2 H 1 3.324 0.019 . 2 . . . A 63 PHE HB2 . 17991 1 518 . 1 1 63 63 PHE HB3 H 1 3.324 0.019 . 2 . . . A 63 PHE HB3 . 17991 1 519 . 1 1 63 63 PHE HD1 H 1 7.280 0.005 . 3 . . . A 63 PHE HD1 . 17991 1 520 . 1 1 63 63 PHE HD2 H 1 7.280 0.005 . 3 . . . A 63 PHE HD2 . 17991 1 521 . 1 1 63 63 PHE CA C 13 60.534 0.001 . 1 . . . A 63 PHE CA . 17991 1 522 . 1 1 63 63 PHE CB C 13 39.150 0.086 . 1 . . . A 63 PHE CB . 17991 1 523 . 1 1 63 63 PHE N N 15 118.763 0.110 . 1 . . . A 63 PHE N . 17991 1 524 . 1 1 64 64 SER H H 1 8.218 0.006 . 1 . . . A 64 SER H . 17991 1 525 . 1 1 64 64 SER HA H 1 4.268 0.008 . 1 . . . A 64 SER HA . 17991 1 526 . 1 1 64 64 SER HB2 H 1 4.054 0.029 . 2 . . . A 64 SER HB2 . 17991 1 527 . 1 1 64 64 SER HB3 H 1 4.054 0.029 . 2 . . . A 64 SER HB3 . 17991 1 528 . 1 1 64 64 SER CA C 13 61.588 0.078 . 1 . . . A 64 SER CA . 17991 1 529 . 1 1 64 64 SER CB C 13 63.175 0.000 . 1 . . . A 64 SER CB . 17991 1 530 . 1 1 64 64 SER N N 15 114.881 0.100 . 1 . . . A 64 SER N . 17991 1 531 . 1 1 65 65 GLU H H 1 8.067 0.013 . 1 . . . A 65 GLU H . 17991 1 532 . 1 1 65 65 GLU HA H 1 4.284 0.012 . 1 . . . A 65 GLU HA . 17991 1 533 . 1 1 65 65 GLU HB2 H 1 2.227 0.029 . 2 . . . A 65 GLU HB2 . 17991 1 534 . 1 1 65 65 GLU HB3 H 1 2.227 0.029 . 2 . . . A 65 GLU HB3 . 17991 1 535 . 1 1 65 65 GLU HG2 H 1 2.509 0.013 . 2 . . . A 65 GLU HG2 . 17991 1 536 . 1 1 65 65 GLU HG3 H 1 2.509 0.013 . 2 . . . A 65 GLU HG3 . 17991 1 537 . 1 1 65 65 GLU CA C 13 58.211 0.043 . 1 . . . A 65 GLU CA . 17991 1 538 . 1 1 65 65 GLU CB C 13 28.962 0.120 . 1 . . . A 65 GLU CB . 17991 1 539 . 1 1 65 65 GLU CG C 13 34.535 0.103 . 1 . . . A 65 GLU CG . 17991 1 540 . 1 1 65 65 GLU N N 15 120.937 0.034 . 1 . . . A 65 GLU N . 17991 1 541 . 1 1 66 66 LEU H H 1 8.003 0.012 . 1 . . . A 66 LEU H . 17991 1 542 . 1 1 66 66 LEU HA H 1 4.263 0.020 . 1 . . . A 66 LEU HA . 17991 1 543 . 1 1 66 66 LEU HB2 H 1 1.880 0.007 . 2 . . . A 66 LEU HB2 . 17991 1 544 . 1 1 66 66 LEU HB3 H 1 1.880 0.007 . 2 . . . A 66 LEU HB3 . 17991 1 545 . 1 1 66 66 LEU HG H 1 1.854 0.012 . 1 . . . A 66 LEU HG . 17991 1 546 . 1 1 66 66 LEU HD11 H 1 0.965 0.012 . . . . . A 66 LEU HD11 . 17991 1 547 . 1 1 66 66 LEU HD12 H 1 0.965 0.012 . . . . . A 66 LEU HD12 . 17991 1 548 . 1 1 66 66 LEU HD13 H 1 0.965 0.012 . . . . . A 66 LEU HD13 . 17991 1 549 . 1 1 66 66 LEU HD21 H 1 0.965 0.012 . . . . . A 66 LEU HD21 . 17991 1 550 . 1 1 66 66 LEU HD22 H 1 0.965 0.012 . . . . . A 66 LEU HD22 . 17991 1 551 . 1 1 66 66 LEU HD23 H 1 0.965 0.012 . . . . . A 66 LEU HD23 . 17991 1 552 . 1 1 66 66 LEU CA C 13 57.222 0.046 . 1 . . . A 66 LEU CA . 17991 1 553 . 1 1 66 66 LEU CB C 13 42.325 0.000 . 1 . . . A 66 LEU CB . 17991 1 554 . 1 1 66 66 LEU CG C 13 27.146 0.107 . 1 . . . A 66 LEU CG . 17991 1 555 . 1 1 66 66 LEU CD1 C 13 24.361 0.185 . 2 . . . A 66 LEU CD1 . 17991 1 556 . 1 1 66 66 LEU N N 15 118.904 0.088 . 1 . . . A 66 LEU N . 17991 1 557 . 1 1 67 67 THR H H 1 7.783 0.013 . 1 . . . A 67 THR H . 17991 1 558 . 1 1 67 67 THR HA H 1 4.043 0.002 . 1 . . . A 67 THR HA . 17991 1 559 . 1 1 67 67 THR HB H 1 4.258 0.015 . 1 . . . A 67 THR HB . 17991 1 560 . 1 1 67 67 THR HG21 H 1 1.167 0.028 . . . . . A 67 THR HG21 . 17991 1 561 . 1 1 67 67 THR HG22 H 1 1.167 0.028 . . . . . A 67 THR HG22 . 17991 1 562 . 1 1 67 67 THR HG23 H 1 1.167 0.028 . . . . . A 67 THR HG23 . 17991 1 563 . 1 1 67 67 THR CA C 13 64.579 0.073 . 1 . . . A 67 THR CA . 17991 1 564 . 1 1 67 67 THR CB C 13 69.410 0.090 . 1 . . . A 67 THR CB . 17991 1 565 . 1 1 67 67 THR CG2 C 13 22.984 0.030 . 1 . . . A 67 THR CG2 . 17991 1 566 . 1 1 67 67 THR N N 15 108.190 0.090 . 1 . . . A 67 THR N . 17991 1 567 . 1 1 68 68 GLY H H 1 7.964 0.010 . 1 . . . A 68 GLY H . 17991 1 568 . 1 1 68 68 GLY HA2 H 1 4.066 0.007 . 2 . . . A 68 GLY HA2 . 17991 1 569 . 1 1 68 68 GLY HA3 H 1 4.066 0.007 . 2 . . . A 68 GLY HA3 . 17991 1 570 . 1 1 68 68 GLY CA C 13 46.244 0.023 . 1 . . . A 68 GLY CA . 17991 1 571 . 1 1 68 68 GLY N N 15 108.141 0.067 . 1 . . . A 68 GLY N . 17991 1 572 . 1 1 69 69 LEU H H 1 7.749 0.021 . 1 . . . A 69 LEU H . 17991 1 573 . 1 1 69 69 LEU HA H 1 4.352 0.014 . 1 . . . A 69 LEU HA . 17991 1 574 . 1 1 69 69 LEU HB2 H 1 1.890 0.010 . 2 . . . A 69 LEU HB2 . 17991 1 575 . 1 1 69 69 LEU HB3 H 1 1.613 0.015 . 2 . . . A 69 LEU HB3 . 17991 1 576 . 1 1 69 69 LEU HG H 1 1.841 0.000 . 1 . . . A 69 LEU HG . 17991 1 577 . 1 1 69 69 LEU HD11 H 1 0.979 0.009 . . . . . A 69 LEU HD11 . 17991 1 578 . 1 1 69 69 LEU HD12 H 1 0.979 0.009 . . . . . A 69 LEU HD12 . 17991 1 579 . 1 1 69 69 LEU HD13 H 1 0.979 0.009 . . . . . A 69 LEU HD13 . 17991 1 580 . 1 1 69 69 LEU HD21 H 1 0.979 0.009 . . . . . A 69 LEU HD21 . 17991 1 581 . 1 1 69 69 LEU HD22 H 1 0.979 0.009 . . . . . A 69 LEU HD22 . 17991 1 582 . 1 1 69 69 LEU HD23 H 1 0.979 0.009 . . . . . A 69 LEU HD23 . 17991 1 583 . 1 1 69 69 LEU CA C 13 56.486 0.246 . 1 . . . A 69 LEU CA . 17991 1 584 . 1 1 69 69 LEU CB C 13 42.374 0.075 . 1 . . . A 69 LEU CB . 17991 1 585 . 1 1 69 69 LEU CG C 13 27.384 0.000 . 1 . . . A 69 LEU CG . 17991 1 586 . 1 1 69 69 LEU N N 15 120.124 0.048 . 1 . . . A 69 LEU N . 17991 1 587 . 1 1 70 70 VAL H H 1 7.607 0.016 . 1 . . . A 70 VAL H . 17991 1 588 . 1 1 70 70 VAL HA H 1 3.935 0.019 . 1 . . . A 70 VAL HA . 17991 1 589 . 1 1 70 70 VAL HB H 1 2.064 0.012 . 1 . . . A 70 VAL HB . 17991 1 590 . 1 1 70 70 VAL HG21 H 1 0.838 0.037 . . . . . A 70 VAL HG21 . 17991 1 591 . 1 1 70 70 VAL HG22 H 1 0.838 0.037 . . . . . A 70 VAL HG22 . 17991 1 592 . 1 1 70 70 VAL HG23 H 1 0.838 0.037 . . . . . A 70 VAL HG23 . 17991 1 593 . 1 1 70 70 VAL CA C 13 63.630 0.223 . 1 . . . A 70 VAL CA . 17991 1 594 . 1 1 70 70 VAL CB C 13 32.264 0.066 . 1 . . . A 70 VAL CB . 17991 1 595 . 1 1 70 70 VAL CG2 C 13 21.275 0.146 . 2 . . . A 70 VAL CG2 . 17991 1 596 . 1 1 70 70 VAL N N 15 115.546 0.162 . 1 . . . A 70 VAL N . 17991 1 597 . 1 1 71 71 PHE H H 1 7.618 0.011 . 1 . . . A 71 PHE H . 17991 1 598 . 1 1 71 71 PHE HA H 1 4.558 0.011 . 1 . . . A 71 PHE HA . 17991 1 599 . 1 1 71 71 PHE HB2 H 1 3.120 0.022 . 2 . . . A 71 PHE HB2 . 17991 1 600 . 1 1 71 71 PHE HB3 H 1 3.120 0.022 . 2 . . . A 71 PHE HB3 . 17991 1 601 . 1 1 71 71 PHE HD1 H 1 7.216 0.009 . 3 . . . A 71 PHE HD1 . 17991 1 602 . 1 1 71 71 PHE HD2 H 1 7.216 0.009 . 3 . . . A 71 PHE HD2 . 17991 1 603 . 1 1 71 71 PHE CA C 13 58.547 0.032 . 1 . . . A 71 PHE CA . 17991 1 604 . 1 1 71 71 PHE CB C 13 39.300 0.000 . 1 . . . A 71 PHE CB . 17991 1 605 . 1 1 71 71 PHE N N 15 119.035 0.084 . 1 . . . A 71 PHE N . 17991 1 606 . 1 1 72 72 TYR H H 1 7.740 0.016 . 1 . . . A 72 TYR H . 17991 1 607 . 1 1 72 72 TYR HA H 1 4.579 0.013 . 1 . . . A 72 TYR HA . 17991 1 608 . 1 1 72 72 TYR HB2 H 1 3.133 0.054 . 2 . . . A 72 TYR HB2 . 17991 1 609 . 1 1 72 72 TYR HB3 H 1 2.956 0.016 . 2 . . . A 72 TYR HB3 . 17991 1 610 . 1 1 72 72 TYR HD1 H 1 7.205 0.011 . 3 . . . A 72 TYR HD1 . 17991 1 611 . 1 1 72 72 TYR HD2 H 1 7.205 0.011 . 3 . . . A 72 TYR HD2 . 17991 1 612 . 1 1 72 72 TYR HE1 H 1 6.918 0.012 . 3 . . . A 72 TYR HE1 . 17991 1 613 . 1 1 72 72 TYR HE2 H 1 6.918 0.012 . 3 . . . A 72 TYR HE2 . 17991 1 614 . 1 1 72 72 TYR CA C 13 58.097 0.025 . 1 . . . A 72 TYR CA . 17991 1 615 . 1 1 72 72 TYR CB C 13 39.244 0.135 . 1 . . . A 72 TYR CB . 17991 1 616 . 1 1 72 72 TYR N N 15 118.365 0.027 . 1 . . . A 72 TYR N . 17991 1 617 . 1 1 73 73 LEU H H 1 7.713 0.011 . 1 . . . A 73 LEU H . 17991 1 618 . 1 1 73 73 LEU HA H 1 4.575 0.012 . 1 . . . A 73 LEU HA . 17991 1 619 . 1 1 73 73 LEU HB2 H 1 1.822 0.006 . 2 . . . A 73 LEU HB2 . 17991 1 620 . 1 1 73 73 LEU HB3 H 1 1.582 0.007 . 2 . . . A 73 LEU HB3 . 17991 1 621 . 1 1 73 73 LEU HD11 H 1 0.991 0.002 . . . . . A 73 LEU HD11 . 17991 1 622 . 1 1 73 73 LEU HD12 H 1 0.991 0.002 . . . . . A 73 LEU HD12 . 17991 1 623 . 1 1 73 73 LEU HD13 H 1 0.991 0.002 . . . . . A 73 LEU HD13 . 17991 1 624 . 1 1 73 73 LEU HD21 H 1 0.991 0.002 . . . . . A 73 LEU HD21 . 17991 1 625 . 1 1 73 73 LEU HD22 H 1 0.991 0.002 . . . . . A 73 LEU HD22 . 17991 1 626 . 1 1 73 73 LEU HD23 H 1 0.991 0.002 . . . . . A 73 LEU HD23 . 17991 1 627 . 1 1 73 73 LEU CA C 13 53.549 0.000 . 1 . . . A 73 LEU CA . 17991 1 628 . 1 1 73 73 LEU CB C 13 42.081 0.095 . 1 . . . A 73 LEU CB . 17991 1 629 . 1 1 73 73 LEU N N 15 121.184 0.065 . 1 . . . A 73 LEU N . 17991 1 630 . 1 1 74 74 PRO HA H 1 4.638 0.001 . 1 . . . A 74 PRO HA . 17991 1 631 . 1 1 74 74 PRO HB2 H 1 2.404 0.011 . 2 . . . A 74 PRO HB2 . 17991 1 632 . 1 1 74 74 PRO HB3 H 1 2.115 0.025 . 2 . . . A 74 PRO HB3 . 17991 1 633 . 1 1 74 74 PRO HG2 H 1 2.080 0.000 . 2 . . . A 74 PRO HG2 . 17991 1 634 . 1 1 74 74 PRO HG3 H 1 2.080 0.000 . 2 . . . A 74 PRO HG3 . 17991 1 635 . 1 1 74 74 PRO HD2 H 1 3.618 0.005 . 2 . . . A 74 PRO HD2 . 17991 1 636 . 1 1 74 74 PRO HD3 H 1 3.618 0.005 . 2 . . . A 74 PRO HD3 . 17991 1 637 . 1 1 74 74 PRO CA C 13 63.204 0.078 . 1 . . . A 74 PRO CA . 17991 1 638 . 1 1 74 74 PRO CB C 13 31.681 0.000 . 1 . . . A 74 PRO CB . 17991 1 639 . 1 1 74 74 PRO CG C 13 27.397 0.000 . 1 . . . A 74 PRO CG . 17991 1 640 . 1 1 74 74 PRO CD C 13 50.295 0.112 . 1 . . . A 74 PRO CD . 17991 1 641 . 1 1 75 75 THR H H 1 8.217 0.022 . 1 . . . A 75 THR H . 17991 1 642 . 1 1 75 75 THR HA H 1 4.339 0.009 . 1 . . . A 75 THR HA . 17991 1 643 . 1 1 75 75 THR HB H 1 4.346 0.008 . 1 . . . A 75 THR HB . 17991 1 644 . 1 1 75 75 THR HG21 H 1 1.306 0.006 . . . . . A 75 THR HG21 . 17991 1 645 . 1 1 75 75 THR HG22 H 1 1.306 0.006 . . . . . A 75 THR HG22 . 17991 1 646 . 1 1 75 75 THR HG23 H 1 1.306 0.006 . . . . . A 75 THR HG23 . 17991 1 647 . 1 1 75 75 THR CA C 13 62.684 0.122 . 1 . . . A 75 THR CA . 17991 1 648 . 1 1 75 75 THR CG2 C 13 21.678 0.000 . 1 . . . A 75 THR CG2 . 17991 1 649 . 1 1 75 75 THR N N 15 113.231 0.095 . 1 . . . A 75 THR N . 17991 1 650 . 1 1 76 76 ASP H H 1 8.406 0.008 . 1 . . . A 76 ASP H . 17991 1 651 . 1 1 76 76 ASP HA H 1 4.790 0.012 . 1 . . . A 76 ASP HA . 17991 1 652 . 1 1 76 76 ASP HB2 H 1 2.866 0.010 . 2 . . . A 76 ASP HB2 . 17991 1 653 . 1 1 76 76 ASP HB3 H 1 2.866 0.010 . 2 . . . A 76 ASP HB3 . 17991 1 654 . 1 1 76 76 ASP CA C 13 54.239 0.022 . 1 . . . A 76 ASP CA . 17991 1 655 . 1 1 76 76 ASP CB C 13 40.315 0.097 . 1 . . . A 76 ASP CB . 17991 1 656 . 1 1 76 76 ASP N N 15 120.892 0.060 . 1 . . . A 76 ASP N . 17991 1 657 . 1 1 77 77 SER H H 1 8.238 0.018 . 1 . . . A 77 SER H . 17991 1 658 . 1 1 77 77 SER HA H 1 4.345 0.012 . 1 . . . A 77 SER HA . 17991 1 659 . 1 1 77 77 SER HB2 H 1 3.954 0.018 . 2 . . . A 77 SER HB2 . 17991 1 660 . 1 1 77 77 SER HB3 H 1 3.954 0.018 . 2 . . . A 77 SER HB3 . 17991 1 661 . 1 1 77 77 SER CA C 13 60.528 0.271 . 1 . . . A 77 SER CA . 17991 1 662 . 1 1 77 77 SER CB C 13 63.812 0.174 . 1 . . . A 77 SER CB . 17991 1 663 . 1 1 77 77 SER N N 15 115.861 0.126 . 1 . . . A 77 SER N . 17991 1 664 . 1 1 78 78 GLY H H 1 8.570 0.018 . 1 . . . A 78 GLY H . 17991 1 665 . 1 1 78 78 GLY HA2 H 1 4.025 0.016 . 2 . . . A 78 GLY HA2 . 17991 1 666 . 1 1 78 78 GLY HA3 H 1 4.025 0.016 . 2 . . . A 78 GLY HA3 . 17991 1 667 . 1 1 78 78 GLY CA C 13 46.653 0.032 . 1 . . . A 78 GLY CA . 17991 1 668 . 1 1 78 78 GLY N N 15 110.440 0.055 . 1 . . . A 78 GLY N . 17991 1 669 . 1 1 79 79 GLU H H 1 8.237 0.010 . 1 . . . A 79 GLU H . 17991 1 670 . 1 1 79 79 GLU HA H 1 4.320 0.007 . 1 . . . A 79 GLU HA . 17991 1 671 . 1 1 79 79 GLU HB2 H 1 2.166 0.016 . 2 . . . A 79 GLU HB2 . 17991 1 672 . 1 1 79 79 GLU HB3 H 1 2.166 0.016 . 2 . . . A 79 GLU HB3 . 17991 1 673 . 1 1 79 79 GLU HG2 H 1 2.450 0.014 . 2 . . . A 79 GLU HG2 . 17991 1 674 . 1 1 79 79 GLU HG3 H 1 2.450 0.014 . 2 . . . A 79 GLU HG3 . 17991 1 675 . 1 1 79 79 GLU CA C 13 58.018 0.223 . 1 . . . A 79 GLU CA . 17991 1 676 . 1 1 79 79 GLU CB C 13 29.082 0.075 . 1 . . . A 79 GLU CB . 17991 1 677 . 1 1 79 79 GLU CG C 13 34.654 0.026 . 1 . . . A 79 GLU CG . 17991 1 678 . 1 1 79 79 GLU N N 15 121.242 0.167 . 1 . . . A 79 GLU N . 17991 1 679 . 1 1 80 80 LYS H H 1 8.252 0.009 . 1 . . . A 80 LYS H . 17991 1 680 . 1 1 80 80 LYS HA H 1 4.319 0.008 . 1 . . . A 80 LYS HA . 17991 1 681 . 1 1 80 80 LYS HB2 H 1 1.952 0.007 . 2 . . . A 80 LYS HB2 . 17991 1 682 . 1 1 80 80 LYS HB3 H 1 1.952 0.007 . 2 . . . A 80 LYS HB3 . 17991 1 683 . 1 1 80 80 LYS HG2 H 1 1.600 0.014 . 2 . . . A 80 LYS HG2 . 17991 1 684 . 1 1 80 80 LYS HG3 H 1 1.600 0.014 . 2 . . . A 80 LYS HG3 . 17991 1 685 . 1 1 80 80 LYS HE2 H 1 3.041 0.010 . 2 . . . A 80 LYS HE2 . 17991 1 686 . 1 1 80 80 LYS HE3 H 1 3.041 0.010 . 2 . . . A 80 LYS HE3 . 17991 1 687 . 1 1 80 80 LYS CA C 13 57.881 0.309 . 1 . . . A 80 LYS CA . 17991 1 688 . 1 1 80 80 LYS CB C 13 32.746 0.000 . 1 . . . A 80 LYS CB . 17991 1 689 . 1 1 80 80 LYS CG C 13 25.264 0.011 . 1 . . . A 80 LYS CG . 17991 1 690 . 1 1 80 80 LYS N N 15 119.708 0.183 . 1 . . . A 80 LYS N . 17991 1 691 . 1 1 81 81 MET H H 1 8.419 0.022 . 1 . . . A 81 MET H . 17991 1 692 . 1 1 81 81 MET HA H 1 4.367 0.016 . 1 . . . A 81 MET HA . 17991 1 693 . 1 1 81 81 MET HB2 H 1 2.226 0.008 . 2 . . . A 81 MET HB2 . 17991 1 694 . 1 1 81 81 MET HB3 H 1 2.226 0.008 . 2 . . . A 81 MET HB3 . 17991 1 695 . 1 1 81 81 MET HG2 H 1 2.646 0.015 . 2 . . . A 81 MET HG2 . 17991 1 696 . 1 1 81 81 MET HG3 H 1 2.646 0.015 . 2 . . . A 81 MET HG3 . 17991 1 697 . 1 1 81 81 MET HE1 H 1 2.130 0.004 . . . . . A 81 MET HE1 . 17991 1 698 . 1 1 81 81 MET HE2 H 1 2.130 0.004 . . . . . A 81 MET HE2 . 17991 1 699 . 1 1 81 81 MET HE3 H 1 2.130 0.004 . . . . . A 81 MET HE3 . 17991 1 700 . 1 1 81 81 MET CA C 13 57.845 0.093 . 1 . . . A 81 MET CA . 17991 1 701 . 1 1 81 81 MET CB C 13 32.658 0.249 . 1 . . . A 81 MET CB . 17991 1 702 . 1 1 81 81 MET CG C 13 32.713 0.000 . 1 . . . A 81 MET CG . 17991 1 703 . 1 1 81 81 MET CE C 13 17.400 0.026 . 1 . . . A 81 MET CE . 17991 1 704 . 1 1 81 81 MET N N 15 119.849 0.174 . 1 . . . A 81 MET N . 17991 1 705 . 1 1 82 82 THR H H 1 8.115 0.015 . 1 . . . A 82 THR H . 17991 1 706 . 1 1 82 82 THR HA H 1 4.132 0.032 . 1 . . . A 82 THR HA . 17991 1 707 . 1 1 82 82 THR HB H 1 4.375 0.008 . 1 . . . A 82 THR HB . 17991 1 708 . 1 1 82 82 THR HG21 H 1 1.325 0.014 . . . . . A 82 THR HG21 . 17991 1 709 . 1 1 82 82 THR HG22 H 1 1.325 0.014 . . . . . A 82 THR HG22 . 17991 1 710 . 1 1 82 82 THR HG23 H 1 1.325 0.014 . . . . . A 82 THR HG23 . 17991 1 711 . 1 1 82 82 THR CA C 13 65.377 0.027 . 1 . . . A 82 THR CA . 17991 1 712 . 1 1 82 82 THR CB C 13 69.035 0.132 . 1 . . . A 82 THR CB . 17991 1 713 . 1 1 82 82 THR CG2 C 13 22.026 0.063 . 1 . . . A 82 THR CG2 . 17991 1 714 . 1 1 82 82 THR N N 15 114.947 0.200 . 1 . . . A 82 THR N . 17991 1 715 . 1 1 83 83 GLU H H 1 8.336 0.011 . 1 . . . A 83 GLU H . 17991 1 716 . 1 1 83 83 GLU HA H 1 4.373 0.006 . 1 . . . A 83 GLU HA . 17991 1 717 . 1 1 83 83 GLU HB2 H 1 2.228 0.014 . 2 . . . A 83 GLU HB2 . 17991 1 718 . 1 1 83 83 GLU HB3 H 1 2.228 0.014 . 2 . . . A 83 GLU HB3 . 17991 1 719 . 1 1 83 83 GLU HG2 H 1 2.535 0.013 . 2 . . . A 83 GLU HG2 . 17991 1 720 . 1 1 83 83 GLU HG3 H 1 2.535 0.013 . 2 . . . A 83 GLU HG3 . 17991 1 721 . 1 1 83 83 GLU CA C 13 58.064 0.026 . 1 . . . A 83 GLU CA . 17991 1 722 . 1 1 83 83 GLU CB C 13 28.942 0.000 . 1 . . . A 83 GLU CB . 17991 1 723 . 1 1 83 83 GLU CG C 13 34.741 0.000 . 1 . . . A 83 GLU CG . 17991 1 724 . 1 1 83 83 GLU N N 15 121.416 0.071 . 1 . . . A 83 GLU N . 17991 1 725 . 1 1 84 84 SER H H 1 8.191 0.007 . 1 . . . A 84 SER H . 17991 1 726 . 1 1 84 84 SER HA H 1 4.278 0.009 . 1 . . . A 84 SER HA . 17991 1 727 . 1 1 84 84 SER HB2 H 1 4.029 0.010 . 2 . . . A 84 SER HB2 . 17991 1 728 . 1 1 84 84 SER HB3 H 1 4.029 0.010 . 2 . . . A 84 SER HB3 . 17991 1 729 . 1 1 84 84 SER CA C 13 61.685 0.120 . 1 . . . A 84 SER CA . 17991 1 730 . 1 1 84 84 SER N N 15 115.783 0.074 . 1 . . . A 84 SER N . 17991 1 731 . 1 1 85 85 LYS H H 1 8.113 0.007 . 1 . . . A 85 LYS H . 17991 1 732 . 1 1 85 85 LYS HA H 1 4.085 0.004 . 1 . . . A 85 LYS HA . 17991 1 733 . 1 1 85 85 LYS HB2 H 1 1.997 0.022 . 2 . . . A 85 LYS HB2 . 17991 1 734 . 1 1 85 85 LYS HB3 H 1 1.997 0.022 . 2 . . . A 85 LYS HB3 . 17991 1 735 . 1 1 85 85 LYS HG2 H 1 1.700 0.104 . 2 . . . A 85 LYS HG2 . 17991 1 736 . 1 1 85 85 LYS HG3 H 1 1.700 0.104 . 2 . . . A 85 LYS HG3 . 17991 1 737 . 1 1 85 85 LYS CA C 13 59.788 0.017 . 1 . . . A 85 LYS CA . 17991 1 738 . 1 1 85 85 LYS CB C 13 32.430 0.000 . 1 . . . A 85 LYS CB . 17991 1 739 . 1 1 85 85 LYS CG C 13 25.292 0.000 . 1 . . . A 85 LYS CG . 17991 1 740 . 1 1 85 85 LYS N N 15 121.318 0.079 . 1 . . . A 85 LYS N . 17991 1 741 . 1 1 86 86 SER H H 1 8.066 0.007 . 1 . . . A 86 SER H . 17991 1 742 . 1 1 86 86 SER HA H 1 4.389 0.008 . 1 . . . A 86 SER HA . 17991 1 743 . 1 1 86 86 SER HB2 H 1 4.103 0.002 . 2 . . . A 86 SER HB2 . 17991 1 744 . 1 1 86 86 SER HB3 H 1 4.103 0.002 . 2 . . . A 86 SER HB3 . 17991 1 745 . 1 1 86 86 SER CA C 13 61.437 0.056 . 1 . . . A 86 SER CA . 17991 1 746 . 1 1 86 86 SER CB C 13 63.116 0.000 . 1 . . . A 86 SER CB . 17991 1 747 . 1 1 86 86 SER N N 15 115.042 0.076 . 1 . . . A 86 SER N . 17991 1 748 . 1 1 87 87 VAL H H 1 8.103 0.016 . 1 . . . A 87 VAL H . 17991 1 749 . 1 1 87 87 VAL HA H 1 4.380 0.000 . 1 . . . A 87 VAL HA . 17991 1 750 . 1 1 87 87 VAL HB H 1 2.272 0.013 . 1 . . . A 87 VAL HB . 17991 1 751 . 1 1 87 87 VAL HG21 H 1 1.096 0.000 . . . . . A 87 VAL HG21 . 17991 1 752 . 1 1 87 87 VAL HG22 H 1 1.096 0.000 . . . . . A 87 VAL HG22 . 17991 1 753 . 1 1 87 87 VAL HG23 H 1 1.096 0.000 . . . . . A 87 VAL HG23 . 17991 1 754 . 1 1 87 87 VAL CA C 13 66.123 0.065 . 1 . . . A 87 VAL CA . 17991 1 755 . 1 1 87 87 VAL CB C 13 31.379 0.000 . 1 . . . A 87 VAL CB . 17991 1 756 . 1 1 87 87 VAL CG2 C 13 21.954 0.000 . 2 . . . A 87 VAL CG2 . 17991 1 757 . 1 1 87 87 VAL N N 15 122.920 0.163 . 1 . . . A 87 VAL N . 17991 1 758 . 1 1 88 88 LEU H H 1 8.146 0.009 . 1 . . . A 88 LEU H . 17991 1 759 . 1 1 88 88 LEU HA H 1 4.122 0.008 . 1 . . . A 88 LEU HA . 17991 1 760 . 1 1 88 88 LEU HB2 H 1 1.893 0.004 . 2 . . . A 88 LEU HB2 . 17991 1 761 . 1 1 88 88 LEU HB3 H 1 1.893 0.004 . 2 . . . A 88 LEU HB3 . 17991 1 762 . 1 1 88 88 LEU HG H 1 1.854 0.002 . 1 . . . A 88 LEU HG . 17991 1 763 . 1 1 88 88 LEU HD21 H 1 1.020 0.021 . . . . . A 88 LEU HD21 . 17991 1 764 . 1 1 88 88 LEU HD22 H 1 1.020 0.021 . . . . . A 88 LEU HD22 . 17991 1 765 . 1 1 88 88 LEU HD23 H 1 1.020 0.021 . . . . . A 88 LEU HD23 . 17991 1 766 . 1 1 88 88 LEU CA C 13 57.906 0.244 . 1 . . . A 88 LEU CA . 17991 1 767 . 1 1 88 88 LEU CB C 13 41.944 0.263 . 1 . . . A 88 LEU CB . 17991 1 768 . 1 1 88 88 LEU CG C 13 27.306 0.072 . 1 . . . A 88 LEU CG . 17991 1 769 . 1 1 88 88 LEU CD2 C 13 21.553 0.129 . 2 . . . A 88 LEU CD2 . 17991 1 770 . 1 1 88 88 LEU N N 15 119.501 0.099 . 1 . . . A 88 LEU N . 17991 1 771 . 1 1 89 89 LYS H H 1 8.245 0.006 . 1 . . . A 89 LYS H . 17991 1 772 . 1 1 89 89 LYS HA H 1 4.095 0.001 . 1 . . . A 89 LYS HA . 17991 1 773 . 1 1 89 89 LYS HB2 H 1 2.018 0.008 . 2 . . . A 89 LYS HB2 . 17991 1 774 . 1 1 89 89 LYS HB3 H 1 2.018 0.008 . 2 . . . A 89 LYS HB3 . 17991 1 775 . 1 1 89 89 LYS HE2 H 1 3.029 0.009 . 2 . . . A 89 LYS HE2 . 17991 1 776 . 1 1 89 89 LYS HE3 H 1 3.029 0.009 . 2 . . . A 89 LYS HE3 . 17991 1 777 . 1 1 89 89 LYS CA C 13 59.887 0.021 . 1 . . . A 89 LYS CA . 17991 1 778 . 1 1 89 89 LYS CB C 13 32.226 0.000 . 1 . . . A 89 LYS CB . 17991 1 779 . 1 1 89 89 LYS CE C 13 42.289 0.000 . 1 . . . A 89 LYS CE . 17991 1 780 . 1 1 89 89 LYS N N 15 120.285 0.077 . 1 . . . A 89 LYS N . 17991 1 781 . 1 1 90 90 SER H H 1 8.037 0.015 . 1 . . . A 90 SER H . 17991 1 782 . 1 1 90 90 SER HA H 1 4.362 0.006 . 1 . . . A 90 SER HA . 17991 1 783 . 1 1 90 90 SER CA C 13 61.815 0.264 . 1 . . . A 90 SER CA . 17991 1 784 . 1 1 90 90 SER N N 15 115.131 0.071 . 1 . . . A 90 SER N . 17991 1 785 . 1 1 91 91 LEU H H 1 8.445 0.008 . 1 . . . A 91 LEU H . 17991 1 786 . 1 1 91 91 LEU HA H 1 4.148 0.009 . 1 . . . A 91 LEU HA . 17991 1 787 . 1 1 91 91 LEU HB2 H 1 1.968 0.009 . 2 . . . A 91 LEU HB2 . 17991 1 788 . 1 1 91 91 LEU HB3 H 1 1.760 0.008 . 2 . . . A 91 LEU HB3 . 17991 1 789 . 1 1 91 91 LEU HD11 H 1 0.974 0.005 . . . . . A 91 LEU HD11 . 17991 1 790 . 1 1 91 91 LEU HD12 H 1 0.974 0.005 . . . . . A 91 LEU HD12 . 17991 1 791 . 1 1 91 91 LEU HD13 H 1 0.974 0.005 . . . . . A 91 LEU HD13 . 17991 1 792 . 1 1 91 91 LEU HD21 H 1 0.974 0.005 . . . . . A 91 LEU HD21 . 17991 1 793 . 1 1 91 91 LEU HD22 H 1 0.974 0.005 . . . . . A 91 LEU HD22 . 17991 1 794 . 1 1 91 91 LEU HD23 H 1 0.974 0.005 . . . . . A 91 LEU HD23 . 17991 1 795 . 1 1 91 91 LEU CA C 13 58.413 0.010 . 1 . . . A 91 LEU CA . 17991 1 796 . 1 1 91 91 LEU CB C 13 42.175 0.000 . 1 . . . A 91 LEU CB . 17991 1 797 . 1 1 91 91 LEU N N 15 120.855 0.069 . 1 . . . A 91 LEU N . 17991 1 798 . 1 1 92 92 THR H H 1 8.383 0.006 . 1 . . . A 92 THR H . 17991 1 799 . 1 1 92 92 THR HA H 1 3.904 0.011 . 1 . . . A 92 THR HA . 17991 1 800 . 1 1 92 92 THR HB H 1 4.361 0.020 . 1 . . . A 92 THR HB . 17991 1 801 . 1 1 92 92 THR HG21 H 1 1.329 0.018 . . . . . A 92 THR HG21 . 17991 1 802 . 1 1 92 92 THR HG22 H 1 1.329 0.018 . . . . . A 92 THR HG22 . 17991 1 803 . 1 1 92 92 THR HG23 H 1 1.329 0.018 . . . . . A 92 THR HG23 . 17991 1 804 . 1 1 92 92 THR CA C 13 67.390 0.201 . 1 . . . A 92 THR CA . 17991 1 805 . 1 1 92 92 THR CB C 13 69.367 0.535 . 1 . . . A 92 THR CB . 17991 1 806 . 1 1 92 92 THR CG2 C 13 21.678 0.000 . 1 . . . A 92 THR CG2 . 17991 1 807 . 1 1 92 92 THR N N 15 112.933 0.107 . 1 . . . A 92 THR N . 17991 1 808 . 1 1 93 93 GLU H H 1 7.971 0.015 . 1 . . . A 93 GLU H . 17991 1 809 . 1 1 93 93 GLU HB2 H 1 2.223 0.015 . 2 . . . A 93 GLU HB2 . 17991 1 810 . 1 1 93 93 GLU HB3 H 1 2.223 0.015 . 2 . . . A 93 GLU HB3 . 17991 1 811 . 1 1 93 93 GLU HG2 H 1 2.506 0.008 . 2 . . . A 93 GLU HG2 . 17991 1 812 . 1 1 93 93 GLU HG3 H 1 2.506 0.008 . 2 . . . A 93 GLU HG3 . 17991 1 813 . 1 1 93 93 GLU CA C 13 59.487 0.010 . 1 . . . A 93 GLU CA . 17991 1 814 . 1 1 93 93 GLU CB C 13 29.145 0.000 . 1 . . . A 93 GLU CB . 17991 1 815 . 1 1 93 93 GLU CG C 13 34.741 0.000 . 1 . . . A 93 GLU CG . 17991 1 816 . 1 1 93 93 GLU N N 15 120.387 0.153 . 1 . . . A 93 GLU N . 17991 1 817 . 1 1 94 94 LYS H H 1 7.804 0.008 . 1 . . . A 94 LYS H . 17991 1 818 . 1 1 94 94 LYS HA H 1 4.166 0.008 . 1 . . . A 94 LYS HA . 17991 1 819 . 1 1 94 94 LYS HB2 H 1 2.143 0.019 . 2 . . . A 94 LYS HB2 . 17991 1 820 . 1 1 94 94 LYS HB3 H 1 2.143 0.019 . 2 . . . A 94 LYS HB3 . 17991 1 821 . 1 1 94 94 LYS HG2 H 1 1.625 0.001 . 2 . . . A 94 LYS HG2 . 17991 1 822 . 1 1 94 94 LYS HG3 H 1 1.625 0.001 . 2 . . . A 94 LYS HG3 . 17991 1 823 . 1 1 94 94 LYS HE2 H 1 3.057 0.000 . 2 . . . A 94 LYS HE2 . 17991 1 824 . 1 1 94 94 LYS HE3 H 1 3.057 0.000 . 2 . . . A 94 LYS HE3 . 17991 1 825 . 1 1 94 94 LYS CA C 13 59.046 0.025 . 1 . . . A 94 LYS CA . 17991 1 826 . 1 1 94 94 LYS CB C 13 32.347 0.000 . 1 . . . A 94 LYS CB . 17991 1 827 . 1 1 94 94 LYS CG C 13 25.403 0.178 . 1 . . . A 94 LYS CG . 17991 1 828 . 1 1 94 94 LYS CE C 13 42.280 0.000 . 1 . . . A 94 LYS CE . 17991 1 829 . 1 1 94 94 LYS N N 15 118.470 0.087 . 1 . . . A 94 LYS N . 17991 1 830 . 1 1 95 95 LEU H H 1 8.256 0.013 . 1 . . . A 95 LEU H . 17991 1 831 . 1 1 95 95 LEU HA H 1 4.159 0.010 . 1 . . . A 95 LEU HA . 17991 1 832 . 1 1 95 95 LEU HB2 H 1 1.935 0.008 . 2 . . . A 95 LEU HB2 . 17991 1 833 . 1 1 95 95 LEU HB3 H 1 1.737 0.008 . 2 . . . A 95 LEU HB3 . 17991 1 834 . 1 1 95 95 LEU HD21 H 1 0.965 0.006 . . . . . A 95 LEU HD21 . 17991 1 835 . 1 1 95 95 LEU HD22 H 1 0.965 0.006 . . . . . A 95 LEU HD22 . 17991 1 836 . 1 1 95 95 LEU HD23 H 1 0.965 0.006 . . . . . A 95 LEU HD23 . 17991 1 837 . 1 1 95 95 LEU CA C 13 57.877 0.002 . 1 . . . A 95 LEU CA . 17991 1 838 . 1 1 95 95 LEU CB C 13 41.949 0.000 . 1 . . . A 95 LEU CB . 17991 1 839 . 1 1 95 95 LEU CD2 C 13 21.407 0.051 . 2 . . . A 95 LEU CD2 . 17991 1 840 . 1 1 95 95 LEU N N 15 118.397 0.096 . 1 . . . A 95 LEU N . 17991 1 841 . 1 1 96 96 LYS H H 1 8.105 0.015 . 1 . . . A 96 LYS H . 17991 1 842 . 1 1 96 96 LYS HA H 1 3.940 0.024 . 1 . . . A 96 LYS HA . 17991 1 843 . 1 1 96 96 LYS HB2 H 1 2.006 0.007 . 2 . . . A 96 LYS HB2 . 17991 1 844 . 1 1 96 96 LYS HB3 H 1 2.006 0.007 . 2 . . . A 96 LYS HB3 . 17991 1 845 . 1 1 96 96 LYS HG2 H 1 1.593 0.001 . 2 . . . A 96 LYS HG2 . 17991 1 846 . 1 1 96 96 LYS HG3 H 1 1.593 0.001 . 2 . . . A 96 LYS HG3 . 17991 1 847 . 1 1 96 96 LYS CA C 13 60.282 0.133 . 1 . . . A 96 LYS CA . 17991 1 848 . 1 1 96 96 LYS CB C 13 32.349 0.039 . 1 . . . A 96 LYS CB . 17991 1 849 . 1 1 96 96 LYS CG C 13 25.347 0.164 . 1 . . . A 96 LYS CG . 17991 1 850 . 1 1 96 96 LYS N N 15 117.747 0.120 . 1 . . . A 96 LYS N . 17991 1 851 . 1 1 97 97 LYS H H 1 7.520 0.016 . 1 . . . A 97 LYS H . 17991 1 852 . 1 1 97 97 LYS HA H 1 4.167 0.011 . 1 . . . A 97 LYS HA . 17991 1 853 . 1 1 97 97 LYS HB2 H 1 2.019 0.012 . 2 . . . A 97 LYS HB2 . 17991 1 854 . 1 1 97 97 LYS HB3 H 1 2.019 0.012 . 2 . . . A 97 LYS HB3 . 17991 1 855 . 1 1 97 97 LYS HG2 H 1 1.694 0.015 . 2 . . . A 97 LYS HG2 . 17991 1 856 . 1 1 97 97 LYS HG3 H 1 1.694 0.015 . 2 . . . A 97 LYS HG3 . 17991 1 857 . 1 1 97 97 LYS HE2 H 1 3.053 0.009 . 2 . . . A 97 LYS HE2 . 17991 1 858 . 1 1 97 97 LYS HE3 H 1 3.053 0.009 . 2 . . . A 97 LYS HE3 . 17991 1 859 . 1 1 97 97 LYS CA C 13 58.543 0.133 . 1 . . . A 97 LYS CA . 17991 1 860 . 1 1 97 97 LYS CB C 13 32.151 0.056 . 1 . . . A 97 LYS CB . 17991 1 861 . 1 1 97 97 LYS CG C 13 25.432 0.191 . 1 . . . A 97 LYS CG . 17991 1 862 . 1 1 97 97 LYS CE C 13 42.130 0.060 . 1 . . . A 97 LYS CE . 17991 1 863 . 1 1 97 97 LYS N N 15 116.451 0.052 . 1 . . . A 97 LYS N . 17991 1 864 . 1 1 98 98 ILE H H 1 7.782 0.014 . 1 . . . A 98 ILE H . 17991 1 865 . 1 1 98 98 ILE HA H 1 3.930 0.021 . 1 . . . A 98 ILE HA . 17991 1 866 . 1 1 98 98 ILE HB H 1 2.115 0.017 . 1 . . . A 98 ILE HB . 17991 1 867 . 1 1 98 98 ILE HG12 H 1 1.320 0.017 . . . . . A 98 ILE HG12 . 17991 1 868 . 1 1 98 98 ILE HG13 H 1 1.320 0.017 . . . . . A 98 ILE HG13 . 17991 1 869 . 1 1 98 98 ILE HG21 H 1 0.986 0.018 . . . . . A 98 ILE HG21 . 17991 1 870 . 1 1 98 98 ILE HG22 H 1 0.986 0.018 . . . . . A 98 ILE HG22 . 17991 1 871 . 1 1 98 98 ILE HG23 H 1 0.986 0.018 . . . . . A 98 ILE HG23 . 17991 1 872 . 1 1 98 98 ILE HD11 H 1 0.958 0.000 . . . . . A 98 ILE HD11 . 17991 1 873 . 1 1 98 98 ILE HD12 H 1 0.958 0.000 . . . . . A 98 ILE HD12 . 17991 1 874 . 1 1 98 98 ILE HD13 H 1 0.958 0.000 . . . . . A 98 ILE HD13 . 17991 1 875 . 1 1 98 98 ILE CA C 13 64.299 0.250 . 1 . . . A 98 ILE CA . 17991 1 876 . 1 1 98 98 ILE CB C 13 37.749 0.000 . 1 . . . A 98 ILE CB . 17991 1 877 . 1 1 98 98 ILE CG2 C 13 17.734 0.047 . 1 . . . A 98 ILE CG2 . 17991 1 878 . 1 1 98 98 ILE CD1 C 13 13.384 0.000 . 1 . . . A 98 ILE CD1 . 17991 1 879 . 1 1 98 98 ILE N N 15 117.587 0.154 . 1 . . . A 98 ILE N . 17991 1 880 . 1 1 99 99 VAL H H 1 7.917 0.015 . 1 . . . A 99 VAL H . 17991 1 881 . 1 1 99 99 VAL HA H 1 3.825 0.027 . 1 . . . A 99 VAL HA . 17991 1 882 . 1 1 99 99 VAL HB H 1 2.292 0.014 . 1 . . . A 99 VAL HB . 17991 1 883 . 1 1 99 99 VAL HG21 H 1 1.082 0.021 . . . . . A 99 VAL HG21 . 17991 1 884 . 1 1 99 99 VAL HG22 H 1 1.082 0.021 . . . . . A 99 VAL HG22 . 17991 1 885 . 1 1 99 99 VAL HG23 H 1 1.082 0.021 . . . . . A 99 VAL HG23 . 17991 1 886 . 1 1 99 99 VAL CA C 13 65.963 0.089 . 1 . . . A 99 VAL CA . 17991 1 887 . 1 1 99 99 VAL CB C 13 31.482 0.176 . 1 . . . A 99 VAL CB . 17991 1 888 . 1 1 99 99 VAL CG2 C 13 21.954 0.000 . 2 . . . A 99 VAL CG2 . 17991 1 889 . 1 1 99 99 VAL N N 15 116.989 0.057 . 1 . . . A 99 VAL N . 17991 1 890 . 1 1 100 100 GLU H H 1 7.702 0.010 . 1 . . . A 100 GLU H . 17991 1 891 . 1 1 100 100 GLU HA H 1 4.213 0.006 . 1 . . . A 100 GLU HA . 17991 1 892 . 1 1 100 100 GLU HB2 H 1 2.266 0.005 . 2 . . . A 100 GLU HB2 . 17991 1 893 . 1 1 100 100 GLU HB3 H 1 2.266 0.005 . 2 . . . A 100 GLU HB3 . 17991 1 894 . 1 1 100 100 GLU HG2 H 1 2.650 0.033 . 2 . . . A 100 GLU HG2 . 17991 1 895 . 1 1 100 100 GLU HG3 H 1 2.650 0.033 . 2 . . . A 100 GLU HG3 . 17991 1 896 . 1 1 100 100 GLU CA C 13 57.974 0.120 . 1 . . . A 100 GLU CA . 17991 1 897 . 1 1 100 100 GLU CB C 13 28.923 0.000 . 1 . . . A 100 GLU CB . 17991 1 898 . 1 1 100 100 GLU CG C 13 34.825 0.127 . 1 . . . A 100 GLU CG . 17991 1 899 . 1 1 100 100 GLU N N 15 116.782 0.059 . 1 . . . A 100 GLU N . 17991 1 900 . 1 1 101 101 LEU H H 1 7.751 0.014 . 1 . . . A 101 LEU H . 17991 1 901 . 1 1 101 101 LEU HA H 1 4.155 0.018 . 1 . . . A 101 LEU HA . 17991 1 902 . 1 1 101 101 LEU HB2 H 1 2.028 0.007 . 2 . . . A 101 LEU HB2 . 17991 1 903 . 1 1 101 101 LEU HB3 H 1 1.720 0.021 . 2 . . . A 101 LEU HB3 . 17991 1 904 . 1 1 101 101 LEU HD11 H 1 0.980 0.013 . . . . . A 101 LEU HD11 . 17991 1 905 . 1 1 101 101 LEU HD12 H 1 0.980 0.013 . . . . . A 101 LEU HD12 . 17991 1 906 . 1 1 101 101 LEU HD13 H 1 0.980 0.013 . . . . . A 101 LEU HD13 . 17991 1 907 . 1 1 101 101 LEU HD21 H 1 0.980 0.013 . . . . . A 101 LEU HD21 . 17991 1 908 . 1 1 101 101 LEU HD22 H 1 0.980 0.013 . . . . . A 101 LEU HD22 . 17991 1 909 . 1 1 101 101 LEU HD23 H 1 0.980 0.013 . . . . . A 101 LEU HD23 . 17991 1 910 . 1 1 101 101 LEU CA C 13 55.736 0.010 . 1 . . . A 101 LEU CA . 17991 1 911 . 1 1 101 101 LEU CB C 13 43.039 0.000 . 1 . . . A 101 LEU CB . 17991 1 912 . 1 1 101 101 LEU CD1 C 13 24.208 0.000 . 2 . . . A 101 LEU CD1 . 17991 1 913 . 1 1 101 101 LEU N N 15 118.218 0.070 . 1 . . . A 101 LEU N . 17991 1 914 . 1 1 102 102 ILE H H 1 7.559 0.011 . 1 . . . A 102 ILE H . 17991 1 915 . 1 1 102 102 ILE HA H 1 3.727 0.011 . 1 . . . A 102 ILE HA . 17991 1 916 . 1 1 102 102 ILE HB H 1 2.091 0.015 . 1 . . . A 102 ILE HB . 17991 1 917 . 1 1 102 102 ILE HG12 H 1 1.244 0.008 . . . . . A 102 ILE HG12 . 17991 1 918 . 1 1 102 102 ILE HG13 H 1 1.244 0.008 . . . . . A 102 ILE HG13 . 17991 1 919 . 1 1 102 102 ILE HG21 H 1 1.030 0.013 . . . . . A 102 ILE HG21 . 17991 1 920 . 1 1 102 102 ILE HG22 H 1 1.030 0.013 . . . . . A 102 ILE HG22 . 17991 1 921 . 1 1 102 102 ILE HG23 H 1 1.030 0.013 . . . . . A 102 ILE HG23 . 17991 1 922 . 1 1 102 102 ILE HD11 H 1 0.981 0.000 . . . . . A 102 ILE HD11 . 17991 1 923 . 1 1 102 102 ILE HD12 H 1 0.981 0.000 . . . . . A 102 ILE HD12 . 17991 1 924 . 1 1 102 102 ILE HD13 H 1 0.981 0.000 . . . . . A 102 ILE HD13 . 17991 1 925 . 1 1 102 102 ILE CA C 13 61.809 0.000 . 1 . . . A 102 ILE CA . 17991 1 926 . 1 1 102 102 ILE CG2 C 13 17.551 0.027 . 1 . . . A 102 ILE CG2 . 17991 1 927 . 1 1 102 102 ILE CD1 C 13 13.159 0.000 . 1 . . . A 102 ILE CD1 . 17991 1 928 . 1 1 102 102 ILE N N 15 119.412 0.078 . 1 . . . A 102 ILE N . 17991 1 929 . 1 1 103 103 PRO HA H 1 4.587 0.014 . 1 . . . A 103 PRO HA . 17991 1 930 . 1 1 103 103 PRO HB2 H 1 2.391 0.023 . 2 . . . A 103 PRO HB2 . 17991 1 931 . 1 1 103 103 PRO HB3 H 1 2.083 0.012 . 2 . . . A 103 PRO HB3 . 17991 1 932 . 1 1 103 103 PRO HG2 H 1 2.078 0.002 . 2 . . . A 103 PRO HG2 . 17991 1 933 . 1 1 103 103 PRO HG3 H 1 2.078 0.002 . 2 . . . A 103 PRO HG3 . 17991 1 934 . 1 1 103 103 PRO HD2 H 1 3.623 0.008 . 2 . . . A 103 PRO HD2 . 17991 1 935 . 1 1 103 103 PRO HD3 H 1 3.623 0.008 . 2 . . . A 103 PRO HD3 . 17991 1 936 . 1 1 103 103 PRO CA C 13 64.289 0.100 . 1 . . . A 103 PRO CA . 17991 1 937 . 1 1 103 103 PRO CB C 13 31.886 0.053 . 1 . . . A 103 PRO CB . 17991 1 938 . 1 1 103 103 PRO CG C 13 27.476 0.123 . 1 . . . A 103 PRO CG . 17991 1 939 . 1 1 103 103 PRO CD C 13 50.316 0.109 . 1 . . . A 103 PRO CD . 17991 1 940 . 1 1 104 104 SER H H 1 8.100 0.016 . 1 . . . A 104 SER H . 17991 1 941 . 1 1 104 104 SER HA H 1 4.571 0.016 . 1 . . . A 104 SER HA . 17991 1 942 . 1 1 104 104 SER HB2 H 1 4.057 0.007 . 2 . . . A 104 SER HB2 . 17991 1 943 . 1 1 104 104 SER HB3 H 1 4.057 0.007 . 2 . . . A 104 SER HB3 . 17991 1 944 . 1 1 104 104 SER CA C 13 59.286 0.067 . 1 . . . A 104 SER CA . 17991 1 945 . 1 1 104 104 SER CB C 13 63.849 0.000 . 1 . . . A 104 SER CB . 17991 1 946 . 1 1 104 104 SER N N 15 112.794 0.173 . 1 . . . A 104 SER N . 17991 1 947 . 1 1 105 105 THR H H 1 8.186 0.004 . 1 . . . A 105 THR H . 17991 1 948 . 1 1 105 105 THR HA H 1 4.318 0.015 . 1 . . . A 105 THR HA . 17991 1 949 . 1 1 105 105 THR HB H 1 4.008 0.014 . 1 . . . A 105 THR HB . 17991 1 950 . 1 1 105 105 THR HG21 H 1 1.321 0.004 . . . . . A 105 THR HG21 . 17991 1 951 . 1 1 105 105 THR HG22 H 1 1.321 0.004 . . . . . A 105 THR HG22 . 17991 1 952 . 1 1 105 105 THR HG23 H 1 1.321 0.004 . . . . . A 105 THR HG23 . 17991 1 953 . 1 1 105 105 THR CA C 13 64.056 0.018 . 1 . . . A 105 THR CA . 17991 1 954 . 1 1 105 105 THR CB C 13 69.861 0.000 . 1 . . . A 105 THR CB . 17991 1 955 . 1 1 105 105 THR N N 15 114.655 0.044 . 1 . . . A 105 THR N . 17991 1 956 . 1 1 106 106 SER H H 1 8.200 0.016 . 1 . . . A 106 SER H . 17991 1 957 . 1 1 106 106 SER HA H 1 4.344 0.007 . 1 . . . A 106 SER HA . 17991 1 958 . 1 1 106 106 SER HB2 H 1 4.038 0.003 . 2 . . . A 106 SER HB2 . 17991 1 959 . 1 1 106 106 SER HB3 H 1 4.038 0.003 . 2 . . . A 106 SER HB3 . 17991 1 960 . 1 1 106 106 SER CA C 13 60.864 0.273 . 1 . . . A 106 SER CA . 17991 1 961 . 1 1 106 106 SER CB C 13 63.462 0.097 . 1 . . . A 106 SER CB . 17991 1 962 . 1 1 106 106 SER N N 15 116.165 0.082 . 1 . . . A 106 SER N . 17991 1 963 . 1 1 107 107 SER H H 1 8.114 0.014 . 1 . . . A 107 SER H . 17991 1 964 . 1 1 107 107 SER HA H 1 4.413 0.013 . 1 . . . A 107 SER HA . 17991 1 965 . 1 1 107 107 SER HB2 H 1 4.002 0.022 . 2 . . . A 107 SER HB2 . 17991 1 966 . 1 1 107 107 SER HB3 H 1 4.002 0.022 . 2 . . . A 107 SER HB3 . 17991 1 967 . 1 1 107 107 SER CA C 13 60.051 0.033 . 1 . . . A 107 SER CA . 17991 1 968 . 1 1 107 107 SER CB C 13 63.921 0.071 . 1 . . . A 107 SER CB . 17991 1 969 . 1 1 107 107 SER N N 15 116.732 0.068 . 1 . . . A 107 SER N . 17991 1 970 . 1 1 108 108 ALA H H 1 8.022 0.009 . 1 . . . A 108 ALA H . 17991 1 971 . 1 1 108 108 ALA HA H 1 4.434 0.021 . 1 . . . A 108 ALA HA . 17991 1 972 . 1 1 108 108 ALA HB1 H 1 1.546 0.007 . . . . . A 108 ALA HB1 . 17991 1 973 . 1 1 108 108 ALA HB2 H 1 1.546 0.007 . . . . . A 108 ALA HB2 . 17991 1 974 . 1 1 108 108 ALA HB3 H 1 1.546 0.007 . . . . . A 108 ALA HB3 . 17991 1 975 . 1 1 108 108 ALA CA C 13 53.482 0.335 . 1 . . . A 108 ALA CA . 17991 1 976 . 1 1 108 108 ALA CB C 13 19.331 0.281 . 1 . . . A 108 ALA CB . 17991 1 977 . 1 1 108 108 ALA N N 15 122.523 0.066 . 1 . . . A 108 ALA N . 17991 1 978 . 1 1 109 109 VAL H H 1 7.829 0.008 . 1 . . . A 109 VAL H . 17991 1 979 . 1 1 109 109 VAL HA H 1 3.788 0.020 . 1 . . . A 109 VAL HA . 17991 1 980 . 1 1 109 109 VAL HB H 1 2.382 0.011 . 1 . . . A 109 VAL HB . 17991 1 981 . 1 1 109 109 VAL HG11 H 1 1.126 0.016 . . . . . A 109 VAL HG11 . 17991 1 982 . 1 1 109 109 VAL HG12 H 1 1.126 0.016 . . . . . A 109 VAL HG12 . 17991 1 983 . 1 1 109 109 VAL HG13 H 1 1.126 0.016 . . . . . A 109 VAL HG13 . 17991 1 984 . 1 1 109 109 VAL HG21 H 1 1.126 0.016 . . . . . A 109 VAL HG21 . 17991 1 985 . 1 1 109 109 VAL HG22 H 1 1.126 0.016 . . . . . A 109 VAL HG22 . 17991 1 986 . 1 1 109 109 VAL HG23 H 1 1.126 0.016 . . . . . A 109 VAL HG23 . 17991 1 987 . 1 1 109 109 VAL CA C 13 66.835 0.000 . 1 . . . A 109 VAL CA . 17991 1 988 . 1 1 109 109 VAL CG2 C 13 21.954 0.000 . 2 . . . A 109 VAL CG2 . 17991 1 989 . 1 1 109 109 VAL N N 15 117.146 0.053 . 1 . . . A 109 VAL N . 17991 1 990 . 1 1 110 110 PRO HA H 1 4.480 0.008 . 1 . . . A 110 PRO HA . 17991 1 991 . 1 1 110 110 PRO HB2 H 1 2.394 0.006 . 2 . . . A 110 PRO HB2 . 17991 1 992 . 1 1 110 110 PRO HB3 H 1 2.394 0.006 . 2 . . . A 110 PRO HB3 . 17991 1 993 . 1 1 110 110 PRO HG2 H 1 2.098 0.004 . 2 . . . A 110 PRO HG2 . 17991 1 994 . 1 1 110 110 PRO HG3 H 1 2.098 0.004 . 2 . . . A 110 PRO HG3 . 17991 1 995 . 1 1 110 110 PRO CA C 13 65.445 0.059 . 1 . . . A 110 PRO CA . 17991 1 996 . 1 1 110 110 PRO CB C 13 31.379 0.000 . 1 . . . A 110 PRO CB . 17991 1 997 . 1 1 110 110 PRO CG C 13 27.746 0.000 . 1 . . . A 110 PRO CG . 17991 1 998 . 1 1 111 111 LEU H H 1 7.538 0.014 . 1 . . . A 111 LEU H . 17991 1 999 . 1 1 111 111 LEU HA H 1 4.213 0.008 . 1 . . . A 111 LEU HA . 17991 1 1000 . 1 1 111 111 LEU HB2 H 1 1.969 0.036 . 2 . . . A 111 LEU HB2 . 17991 1 1001 . 1 1 111 111 LEU HB3 H 1 1.769 0.028 . 2 . . . A 111 LEU HB3 . 17991 1 1002 . 1 1 111 111 LEU HD11 H 1 1.055 0.001 . . . . . A 111 LEU HD11 . 17991 1 1003 . 1 1 111 111 LEU HD12 H 1 1.055 0.001 . . . . . A 111 LEU HD12 . 17991 1 1004 . 1 1 111 111 LEU HD13 H 1 1.055 0.001 . . . . . A 111 LEU HD13 . 17991 1 1005 . 1 1 111 111 LEU HD21 H 1 1.055 0.001 . . . . . A 111 LEU HD21 . 17991 1 1006 . 1 1 111 111 LEU HD22 H 1 1.055 0.001 . . . . . A 111 LEU HD22 . 17991 1 1007 . 1 1 111 111 LEU HD23 H 1 1.055 0.001 . . . . . A 111 LEU HD23 . 17991 1 1008 . 1 1 111 111 LEU CA C 13 57.782 0.032 . 1 . . . A 111 LEU CA . 17991 1 1009 . 1 1 111 111 LEU CB C 13 42.448 0.212 . 1 . . . A 111 LEU CB . 17991 1 1010 . 1 1 111 111 LEU CD1 C 13 25.117 0.060 . 2 . . . A 111 LEU CD1 . 17991 1 1011 . 1 1 111 111 LEU N N 15 117.393 0.161 . 1 . . . A 111 LEU N . 17991 1 1012 . 1 1 112 112 ILE H H 1 8.118 0.013 . 1 . . . A 112 ILE H . 17991 1 1013 . 1 1 112 112 ILE HA H 1 4.001 0.012 . 1 . . . A 112 ILE HA . 17991 1 1014 . 1 1 112 112 ILE HB H 1 2.132 0.008 . 1 . . . A 112 ILE HB . 17991 1 1015 . 1 1 112 112 ILE HG12 H 1 1.298 0.010 . . . . . A 112 ILE HG12 . 17991 1 1016 . 1 1 112 112 ILE HG13 H 1 1.298 0.010 . . . . . A 112 ILE HG13 . 17991 1 1017 . 1 1 112 112 ILE HG21 H 1 1.036 0.008 . . . . . A 112 ILE HG21 . 17991 1 1018 . 1 1 112 112 ILE HG22 H 1 1.036 0.008 . . . . . A 112 ILE HG22 . 17991 1 1019 . 1 1 112 112 ILE HG23 H 1 1.036 0.008 . . . . . A 112 ILE HG23 . 17991 1 1020 . 1 1 112 112 ILE HD11 H 1 0.985 0.000 . . . . . A 112 ILE HD11 . 17991 1 1021 . 1 1 112 112 ILE HD12 H 1 0.985 0.000 . . . . . A 112 ILE HD12 . 17991 1 1022 . 1 1 112 112 ILE HD13 H 1 0.985 0.000 . . . . . A 112 ILE HD13 . 17991 1 1023 . 1 1 112 112 ILE CA C 13 64.626 0.056 . 1 . . . A 112 ILE CA . 17991 1 1024 . 1 1 112 112 ILE CG2 C 13 17.787 0.205 . 1 . . . A 112 ILE CG2 . 17991 1 1025 . 1 1 112 112 ILE CD1 C 13 13.159 0.000 . 1 . . . A 112 ILE CD1 . 17991 1 1026 . 1 1 112 112 ILE N N 15 117.001 0.141 . 1 . . . A 112 ILE N . 17991 1 1027 . 1 1 113 113 GLY H H 1 8.409 0.020 . 1 . . . A 113 GLY H . 17991 1 1028 . 1 1 113 113 GLY HA2 H 1 3.871 0.011 . 2 . . . A 113 GLY HA2 . 17991 1 1029 . 1 1 113 113 GLY HA3 H 1 3.871 0.011 . 2 . . . A 113 GLY HA3 . 17991 1 1030 . 1 1 113 113 GLY CA C 13 47.772 0.074 . 1 . . . A 113 GLY CA . 17991 1 1031 . 1 1 113 113 GLY N N 15 106.840 0.048 . 1 . . . A 113 GLY N . 17991 1 1032 . 1 1 114 114 LYS H H 1 7.847 0.008 . 1 . . . A 114 LYS H . 17991 1 1033 . 1 1 114 114 LYS HA H 1 4.120 0.001 . 1 . . . A 114 LYS HA . 17991 1 1034 . 1 1 114 114 LYS HB2 H 1 1.796 0.012 . 2 . . . A 114 LYS HB2 . 17991 1 1035 . 1 1 114 114 LYS HB3 H 1 1.796 0.012 . 2 . . . A 114 LYS HB3 . 17991 1 1036 . 1 1 114 114 LYS HE2 H 1 3.051 0.000 . 2 . . . A 114 LYS HE2 . 17991 1 1037 . 1 1 114 114 LYS HE3 H 1 3.051 0.000 . 2 . . . A 114 LYS HE3 . 17991 1 1038 . 1 1 114 114 LYS CA C 13 59.138 0.002 . 1 . . . A 114 LYS CA . 17991 1 1039 . 1 1 114 114 LYS N N 15 120.736 0.132 . 1 . . . A 114 LYS N . 17991 1 1040 . 1 1 115 115 TYR H H 1 7.891 0.011 . 1 . . . A 115 TYR H . 17991 1 1041 . 1 1 115 115 TYR HA H 1 4.272 0.004 . 1 . . . A 115 TYR HA . 17991 1 1042 . 1 1 115 115 TYR HB2 H 1 3.246 0.021 . 2 . . . A 115 TYR HB2 . 17991 1 1043 . 1 1 115 115 TYR HB3 H 1 3.246 0.021 . 2 . . . A 115 TYR HB3 . 17991 1 1044 . 1 1 115 115 TYR HD1 H 1 7.160 0.018 . 3 . . . A 115 TYR HD1 . 17991 1 1045 . 1 1 115 115 TYR HD2 H 1 7.160 0.018 . 3 . . . A 115 TYR HD2 . 17991 1 1046 . 1 1 115 115 TYR HE1 H 1 6.788 0.002 . 3 . . . A 115 TYR HE1 . 17991 1 1047 . 1 1 115 115 TYR HE2 H 1 6.788 0.002 . 3 . . . A 115 TYR HE2 . 17991 1 1048 . 1 1 115 115 TYR CA C 13 60.430 0.000 . 1 . . . A 115 TYR CA . 17991 1 1049 . 1 1 115 115 TYR CE1 C 13 117.385 0.103 . 3 . . . A 115 TYR CE1 . 17991 1 1050 . 1 1 115 115 TYR N N 15 117.055 0.089 . 1 . . . A 115 TYR N . 17991 1 1051 . 1 1 116 116 MET H H 1 8.170 0.003 . 1 . . . A 116 MET H . 17991 1 1052 . 1 1 116 116 MET HB2 H 1 2.083 0.000 . 2 . . . A 116 MET HB2 . 17991 1 1053 . 1 1 116 116 MET HB3 H 1 2.083 0.000 . 2 . . . A 116 MET HB3 . 17991 1 1054 . 1 1 116 116 MET HG2 H 1 2.701 0.000 . 2 . . . A 116 MET HG2 . 17991 1 1055 . 1 1 116 116 MET HG3 H 1 2.701 0.000 . 2 . . . A 116 MET HG3 . 17991 1 1056 . 1 1 116 116 MET HE1 H 1 2.124 0.004 . . . . . A 116 MET HE1 . 17991 1 1057 . 1 1 116 116 MET HE2 H 1 2.124 0.004 . . . . . A 116 MET HE2 . 17991 1 1058 . 1 1 116 116 MET HE3 H 1 2.124 0.004 . . . . . A 116 MET HE3 . 17991 1 1059 . 1 1 116 116 MET CG C 13 32.732 0.000 . 1 . . . A 116 MET CG . 17991 1 1060 . 1 1 116 116 MET CE C 13 17.428 0.027 . 1 . . . A 116 MET CE . 17991 1 1061 . 1 1 117 117 LEU H H 1 7.781 0.009 . 1 . . . A 117 LEU H . 17991 1 1062 . 1 1 117 117 LEU HA H 1 3.909 0.000 . 1 . . . A 117 LEU HA . 17991 1 1063 . 1 1 117 117 LEU HB2 H 1 1.804 0.000 . 2 . . . A 117 LEU HB2 . 17991 1 1064 . 1 1 117 117 LEU HB3 H 1 1.804 0.000 . 2 . . . A 117 LEU HB3 . 17991 1 1065 . 1 1 117 117 LEU HG H 1 1.744 0.042 . 1 . . . A 117 LEU HG . 17991 1 1066 . 1 1 117 117 LEU HD11 H 1 0.982 0.000 . . . . . A 117 LEU HD11 . 17991 1 1067 . 1 1 117 117 LEU HD12 H 1 0.982 0.000 . . . . . A 117 LEU HD12 . 17991 1 1068 . 1 1 117 117 LEU HD13 H 1 0.982 0.000 . . . . . A 117 LEU HD13 . 17991 1 1069 . 1 1 117 117 LEU HD21 H 1 0.982 0.000 . . . . . A 117 LEU HD21 . 17991 1 1070 . 1 1 117 117 LEU HD22 H 1 0.982 0.000 . . . . . A 117 LEU HD22 . 17991 1 1071 . 1 1 117 117 LEU HD23 H 1 0.982 0.000 . . . . . A 117 LEU HD23 . 17991 1 1072 . 1 1 117 117 LEU CA C 13 58.594 0.000 . 1 . . . A 117 LEU CA . 17991 1 1073 . 1 1 117 117 LEU CB C 13 41.336 0.000 . 1 . . . A 117 LEU CB . 17991 1 1074 . 1 1 117 117 LEU CG C 13 27.891 0.974 . 1 . . . A 117 LEU CG . 17991 1 1075 . 1 1 117 117 LEU N N 15 117.768 0.114 . 1 . . . A 117 LEU N . 17991 1 1076 . 1 1 118 118 PHE H H 1 8.024 0.008 . 1 . . . A 118 PHE H . 17991 1 1077 . 1 1 118 118 PHE HA H 1 4.428 0.012 . 1 . . . A 118 PHE HA . 17991 1 1078 . 1 1 118 118 PHE HB2 H 1 3.342 0.016 . 2 . . . A 118 PHE HB2 . 17991 1 1079 . 1 1 118 118 PHE HB3 H 1 3.342 0.016 . 2 . . . A 118 PHE HB3 . 17991 1 1080 . 1 1 118 118 PHE HD1 H 1 7.286 0.002 . 3 . . . A 118 PHE HD1 . 17991 1 1081 . 1 1 118 118 PHE HD2 H 1 7.286 0.002 . 3 . . . A 118 PHE HD2 . 17991 1 1082 . 1 1 118 118 PHE CA C 13 60.735 0.301 . 1 . . . A 118 PHE CA . 17991 1 1083 . 1 1 118 118 PHE N N 15 118.204 0.087 . 1 . . . A 118 PHE N . 17991 1 1084 . 1 1 119 119 THR H H 1 8.171 0.008 . 1 . . . A 119 THR H . 17991 1 1085 . 1 1 119 119 THR HA H 1 3.972 0.023 . 1 . . . A 119 THR HA . 17991 1 1086 . 1 1 119 119 THR HB H 1 4.539 0.013 . 1 . . . A 119 THR HB . 17991 1 1087 . 1 1 119 119 THR HG21 H 1 1.309 0.008 . . . . . A 119 THR HG21 . 17991 1 1088 . 1 1 119 119 THR HG22 H 1 1.309 0.008 . . . . . A 119 THR HG22 . 17991 1 1089 . 1 1 119 119 THR HG23 H 1 1.309 0.008 . . . . . A 119 THR HG23 . 17991 1 1090 . 1 1 119 119 THR CA C 13 67.518 0.005 . 1 . . . A 119 THR CA . 17991 1 1091 . 1 1 119 119 THR CB C 13 69.194 0.000 . 1 . . . A 119 THR CB . 17991 1 1092 . 1 1 119 119 THR CG2 C 13 20.450 0.000 . 1 . . . A 119 THR CG2 . 17991 1 1093 . 1 1 119 119 THR N N 15 114.941 0.206 . 1 . . . A 119 THR N . 17991 1 1094 . 1 1 120 120 LYS H H 1 8.359 0.015 . 1 . . . A 120 LYS H . 17991 1 1095 . 1 1 120 120 LYS HA H 1 3.980 0.007 . 1 . . . A 120 LYS HA . 17991 1 1096 . 1 1 120 120 LYS HB2 H 1 1.876 0.018 . 2 . . . A 120 LYS HB2 . 17991 1 1097 . 1 1 120 120 LYS HB3 H 1 1.876 0.018 . 2 . . . A 120 LYS HB3 . 17991 1 1098 . 1 1 120 120 LYS HG2 H 1 1.521 0.000 . 2 . . . A 120 LYS HG2 . 17991 1 1099 . 1 1 120 120 LYS HG3 H 1 1.521 0.000 . 2 . . . A 120 LYS HG3 . 17991 1 1100 . 1 1 120 120 LYS CA C 13 60.810 0.041 . 1 . . . A 120 LYS CA . 17991 1 1101 . 1 1 120 120 LYS CB C 13 32.515 0.000 . 1 . . . A 120 LYS CB . 17991 1 1102 . 1 1 120 120 LYS CG C 13 25.015 0.000 . 1 . . . A 120 LYS CG . 17991 1 1103 . 1 1 120 120 LYS N N 15 121.758 0.105 . 1 . . . A 120 LYS N . 17991 1 1104 . 1 1 121 121 GLU H H 1 8.222 0.012 . 1 . . . A 121 GLU H . 17991 1 1105 . 1 1 121 121 GLU HA H 1 4.214 0.013 . 1 . . . A 121 GLU HA . 17991 1 1106 . 1 1 121 121 GLU HB2 H 1 2.279 0.003 . 2 . . . A 121 GLU HB2 . 17991 1 1107 . 1 1 121 121 GLU HB3 H 1 2.182 0.002 . 2 . . . A 121 GLU HB3 . 17991 1 1108 . 1 1 121 121 GLU HG2 H 1 2.598 0.017 . 2 . . . A 121 GLU HG2 . 17991 1 1109 . 1 1 121 121 GLU HG3 H 1 2.598 0.017 . 2 . . . A 121 GLU HG3 . 17991 1 1110 . 1 1 121 121 GLU CA C 13 59.240 0.071 . 1 . . . A 121 GLU CA . 17991 1 1111 . 1 1 121 121 GLU CB C 13 28.383 0.000 . 1 . . . A 121 GLU CB . 17991 1 1112 . 1 1 121 121 GLU CG C 13 35.329 0.000 . 1 . . . A 121 GLU CG . 17991 1 1113 . 1 1 121 121 GLU N N 15 117.504 0.084 . 1 . . . A 121 GLU N . 17991 1 1114 . 1 1 122 122 PHE H H 1 8.562 0.016 . 1 . . . A 122 PHE H . 17991 1 1115 . 1 1 122 122 PHE HA H 1 4.294 0.010 . 1 . . . A 122 PHE HA . 17991 1 1116 . 1 1 122 122 PHE HB2 H 1 3.217 0.018 . 2 . . . A 122 PHE HB2 . 17991 1 1117 . 1 1 122 122 PHE HB3 H 1 3.217 0.018 . 2 . . . A 122 PHE HB3 . 17991 1 1118 . 1 1 122 122 PHE HD1 H 1 7.215 0.005 . 3 . . . A 122 PHE HD1 . 17991 1 1119 . 1 1 122 122 PHE HD2 H 1 7.215 0.005 . 3 . . . A 122 PHE HD2 . 17991 1 1120 . 1 1 122 122 PHE CA C 13 61.574 0.052 . 1 . . . A 122 PHE CA . 17991 1 1121 . 1 1 122 122 PHE CB C 13 39.359 0.000 . 1 . . . A 122 PHE CB . 17991 1 1122 . 1 1 122 122 PHE N N 15 121.586 0.114 . 1 . . . A 122 PHE N . 17991 1 1123 . 1 1 123 123 VAL H H 1 8.784 0.019 . 1 . . . A 123 VAL H . 17991 1 1124 . 1 1 123 123 VAL HA H 1 3.516 0.011 . 1 . . . A 123 VAL HA . 17991 1 1125 . 1 1 123 123 VAL HB H 1 2.356 0.009 . 1 . . . A 123 VAL HB . 17991 1 1126 . 1 1 123 123 VAL HG11 H 1 1.268 0.006 . . . . . A 123 VAL HG11 . 17991 1 1127 . 1 1 123 123 VAL HG12 H 1 1.268 0.006 . . . . . A 123 VAL HG12 . 17991 1 1128 . 1 1 123 123 VAL HG13 H 1 1.268 0.006 . . . . . A 123 VAL HG13 . 17991 1 1129 . 1 1 123 123 VAL HG21 H 1 1.032 0.012 . . . . . A 123 VAL HG21 . 17991 1 1130 . 1 1 123 123 VAL HG22 H 1 1.032 0.012 . . . . . A 123 VAL HG22 . 17991 1 1131 . 1 1 123 123 VAL HG23 H 1 1.032 0.012 . . . . . A 123 VAL HG23 . 17991 1 1132 . 1 1 123 123 VAL CA C 13 67.608 0.138 . 1 . . . A 123 VAL CA . 17991 1 1133 . 1 1 123 123 VAL CB C 13 31.461 0.000 . 1 . . . A 123 VAL CB . 17991 1 1134 . 1 1 123 123 VAL CG1 C 13 23.596 0.202 . 2 . . . A 123 VAL CG1 . 17991 1 1135 . 1 1 123 123 VAL CG2 C 13 21.867 0.087 . 2 . . . A 123 VAL CG2 . 17991 1 1136 . 1 1 123 123 VAL N N 15 121.558 0.136 . 1 . . . A 123 VAL N . 17991 1 1137 . 1 1 124 124 GLU H H 1 8.564 0.008 . 1 . . . A 124 GLU H . 17991 1 1138 . 1 1 124 124 GLU HA H 1 4.042 0.000 . 1 . . . A 124 GLU HA . 17991 1 1139 . 1 1 124 124 GLU HB2 H 1 2.361 0.042 . 2 . . . A 124 GLU HB2 . 17991 1 1140 . 1 1 124 124 GLU HB3 H 1 2.361 0.042 . 2 . . . A 124 GLU HB3 . 17991 1 1141 . 1 1 124 124 GLU HG2 H 1 2.712 0.013 . 2 . . . A 124 GLU HG2 . 17991 1 1142 . 1 1 124 124 GLU HG3 H 1 2.712 0.013 . 2 . . . A 124 GLU HG3 . 17991 1 1143 . 1 1 124 124 GLU CA C 13 60.207 0.073 . 1 . . . A 124 GLU CA . 17991 1 1144 . 1 1 124 124 GLU CB C 13 28.425 0.000 . 1 . . . A 124 GLU CB . 17991 1 1145 . 1 1 124 124 GLU CG C 13 34.727 0.014 . 1 . . . A 124 GLU CG . 17991 1 1146 . 1 1 124 124 GLU N N 15 118.314 0.094 . 1 . . . A 124 GLU N . 17991 1 1147 . 1 1 125 125 SER H H 1 8.348 0.019 . 1 . . . A 125 SER H . 17991 1 1148 . 1 1 125 125 SER HA H 1 4.265 0.015 . 1 . . . A 125 SER HA . 17991 1 1149 . 1 1 125 125 SER CA C 13 62.342 0.013 . 1 . . . A 125 SER CA . 17991 1 1150 . 1 1 125 125 SER CB C 13 63.162 0.000 . 1 . . . A 125 SER CB . 17991 1 1151 . 1 1 125 125 SER N N 15 114.779 0.149 . 1 . . . A 125 SER N . 17991 1 1152 . 1 1 126 126 SER H H 1 8.144 0.004 . 1 . . . A 126 SER H . 17991 1 1153 . 1 1 126 126 SER HA H 1 4.069 0.006 . 1 . . . A 126 SER HA . 17991 1 1154 . 1 1 126 126 SER HB2 H 1 3.649 0.008 . 2 . . . A 126 SER HB2 . 17991 1 1155 . 1 1 126 126 SER HB3 H 1 3.649 0.008 . 2 . . . A 126 SER HB3 . 17991 1 1156 . 1 1 126 126 SER CA C 13 62.846 0.338 . 1 . . . A 126 SER CA . 17991 1 1157 . 1 1 126 126 SER N N 15 118.464 0.034 . 1 . . . A 126 SER N . 17991 1 1158 . 1 1 127 127 ILE H H 1 8.280 0.008 . 1 . . . A 127 ILE H . 17991 1 1159 . 1 1 127 127 ILE HA H 1 3.681 0.023 . 1 . . . A 127 ILE HA . 17991 1 1160 . 1 1 127 127 ILE HB H 1 2.000 0.021 . 1 . . . A 127 ILE HB . 17991 1 1161 . 1 1 127 127 ILE HG12 H 1 1.294 0.013 . . . . . A 127 ILE HG12 . 17991 1 1162 . 1 1 127 127 ILE HG13 H 1 1.294 0.013 . . . . . A 127 ILE HG13 . 17991 1 1163 . 1 1 127 127 ILE HG21 H 1 0.951 0.011 . . . . . A 127 ILE HG21 . 17991 1 1164 . 1 1 127 127 ILE HG22 H 1 0.951 0.011 . . . . . A 127 ILE HG22 . 17991 1 1165 . 1 1 127 127 ILE HG23 H 1 0.951 0.011 . . . . . A 127 ILE HG23 . 17991 1 1166 . 1 1 127 127 ILE HD11 H 1 0.910 0.006 . . . . . A 127 ILE HD11 . 17991 1 1167 . 1 1 127 127 ILE HD12 H 1 0.910 0.006 . . . . . A 127 ILE HD12 . 17991 1 1168 . 1 1 127 127 ILE HD13 H 1 0.910 0.006 . . . . . A 127 ILE HD13 . 17991 1 1169 . 1 1 127 127 ILE CA C 13 65.641 0.066 . 1 . . . A 127 ILE CA . 17991 1 1170 . 1 1 127 127 ILE CB C 13 38.034 0.000 . 1 . . . A 127 ILE CB . 17991 1 1171 . 1 1 127 127 ILE CG2 C 13 17.573 0.000 . 1 . . . A 127 ILE CG2 . 17991 1 1172 . 1 1 127 127 ILE CD1 C 13 13.637 0.117 . 1 . . . A 127 ILE CD1 . 17991 1 1173 . 1 1 127 127 ILE N N 15 124.705 0.092 . 1 . . . A 127 ILE N . 17991 1 1174 . 1 1 128 128 LYS H H 1 7.741 0.015 . 1 . . . A 128 LYS H . 17991 1 1175 . 1 1 128 128 LYS HB2 H 1 1.757 0.008 . 2 . . . A 128 LYS HB2 . 17991 1 1176 . 1 1 128 128 LYS HB3 H 1 1.757 0.008 . 2 . . . A 128 LYS HB3 . 17991 1 1177 . 1 1 128 128 LYS HG2 H 1 1.529 0.000 . 2 . . . A 128 LYS HG2 . 17991 1 1178 . 1 1 128 128 LYS HG3 H 1 1.529 0.000 . 2 . . . A 128 LYS HG3 . 17991 1 1179 . 1 1 128 128 LYS CA C 13 59.885 0.031 . 1 . . . A 128 LYS CA . 17991 1 1180 . 1 1 128 128 LYS CB C 13 32.248 0.000 . 1 . . . A 128 LYS CB . 17991 1 1181 . 1 1 128 128 LYS CG C 13 25.040 0.000 . 1 . . . A 128 LYS CG . 17991 1 1182 . 1 1 128 128 LYS N N 15 119.907 0.136 . 1 . . . A 128 LYS N . 17991 1 1183 . 1 1 129 129 ILE H H 1 8.215 0.010 . 1 . . . A 129 ILE H . 17991 1 1184 . 1 1 129 129 ILE HA H 1 4.107 0.006 . 1 . . . A 129 ILE HA . 17991 1 1185 . 1 1 129 129 ILE HB H 1 1.966 0.018 . 1 . . . A 129 ILE HB . 17991 1 1186 . 1 1 129 129 ILE HG21 H 1 0.974 0.015 . . . . . A 129 ILE HG21 . 17991 1 1187 . 1 1 129 129 ILE HG22 H 1 0.974 0.015 . . . . . A 129 ILE HG22 . 17991 1 1188 . 1 1 129 129 ILE HG23 H 1 0.974 0.015 . . . . . A 129 ILE HG23 . 17991 1 1189 . 1 1 129 129 ILE HD11 H 1 0.956 0.007 . . . . . A 129 ILE HD11 . 17991 1 1190 . 1 1 129 129 ILE HD12 H 1 0.956 0.007 . . . . . A 129 ILE HD12 . 17991 1 1191 . 1 1 129 129 ILE HD13 H 1 0.956 0.007 . . . . . A 129 ILE HD13 . 17991 1 1192 . 1 1 129 129 ILE CA C 13 64.392 0.342 . 1 . . . A 129 ILE CA . 17991 1 1193 . 1 1 129 129 ILE CB C 13 38.050 0.000 . 1 . . . A 129 ILE CB . 17991 1 1194 . 1 1 129 129 ILE CG2 C 13 17.706 0.000 . 1 . . . A 129 ILE CG2 . 17991 1 1195 . 1 1 129 129 ILE CD1 C 13 13.603 0.000 . 1 . . . A 129 ILE CD1 . 17991 1 1196 . 1 1 129 129 ILE N N 15 118.807 0.090 . 1 . . . A 129 ILE N . 17991 1 1197 . 1 1 130 130 THR H H 1 7.988 0.010 . 1 . . . A 130 THR H . 17991 1 1198 . 1 1 130 130 THR HA H 1 3.921 0.000 . 1 . . . A 130 THR HA . 17991 1 1199 . 1 1 130 130 THR HB H 1 4.313 0.013 . 1 . . . A 130 THR HB . 17991 1 1200 . 1 1 130 130 THR HG1 H 1 1.222 0.000 . 1 . . . A 130 THR HG1 . 17991 1 1201 . 1 1 130 130 THR HG21 H 1 1.248 0.014 . . . . . A 130 THR HG21 . 17991 1 1202 . 1 1 130 130 THR HG22 H 1 1.248 0.014 . . . . . A 130 THR HG22 . 17991 1 1203 . 1 1 130 130 THR HG23 H 1 1.248 0.014 . . . . . A 130 THR HG23 . 17991 1 1204 . 1 1 130 130 THR CA C 13 68.210 0.250 . 1 . . . A 130 THR CA . 17991 1 1205 . 1 1 130 130 THR CG2 C 13 21.678 0.000 . 1 . . . A 130 THR CG2 . 17991 1 1206 . 1 1 130 130 THR N N 15 117.328 0.107 . 1 . . . A 130 THR N . 17991 1 1207 . 1 1 131 131 GLU H H 1 8.439 0.008 . 1 . . . A 131 GLU H . 17991 1 1208 . 1 1 131 131 GLU HA H 1 3.978 0.016 . 1 . . . A 131 GLU HA . 17991 1 1209 . 1 1 131 131 GLU HB2 H 1 2.382 0.009 . 2 . . . A 131 GLU HB2 . 17991 1 1210 . 1 1 131 131 GLU HB3 H 1 2.382 0.009 . 2 . . . A 131 GLU HB3 . 17991 1 1211 . 1 1 131 131 GLU HG2 H 1 2.716 0.008 . 2 . . . A 131 GLU HG2 . 17991 1 1212 . 1 1 131 131 GLU HG3 H 1 2.716 0.008 . 2 . . . A 131 GLU HG3 . 17991 1 1213 . 1 1 131 131 GLU CA C 13 59.600 0.138 . 1 . . . A 131 GLU CA . 17991 1 1214 . 1 1 131 131 GLU CG C 13 34.723 0.018 . 1 . . . A 131 GLU CG . 17991 1 1215 . 1 1 131 131 GLU N N 15 118.968 0.054 . 1 . . . A 131 GLU N . 17991 1 1216 . 1 1 132 132 GLU H H 1 7.987 0.009 . 1 . . . A 132 GLU H . 17991 1 1217 . 1 1 132 132 GLU HA H 1 4.226 0.000 . 1 . . . A 132 GLU HA . 17991 1 1218 . 1 1 132 132 GLU HB2 H 1 2.255 0.000 . 2 . . . A 132 GLU HB2 . 17991 1 1219 . 1 1 132 132 GLU HB3 H 1 2.255 0.000 . 2 . . . A 132 GLU HB3 . 17991 1 1220 . 1 1 132 132 GLU HG2 H 1 2.668 0.002 . 2 . . . A 132 GLU HG2 . 17991 1 1221 . 1 1 132 132 GLU HG3 H 1 2.668 0.002 . 2 . . . A 132 GLU HG3 . 17991 1 1222 . 1 1 132 132 GLU CA C 13 59.267 0.093 . 1 . . . A 132 GLU CA . 17991 1 1223 . 1 1 132 132 GLU CB C 13 28.619 0.000 . 1 . . . A 132 GLU CB . 17991 1 1224 . 1 1 132 132 GLU CG C 13 34.674 0.076 . 1 . . . A 132 GLU CG . 17991 1 1225 . 1 1 132 132 GLU N N 15 118.712 0.023 . 1 . . . A 132 GLU N . 17991 1 1226 . 1 1 133 133 VAL H H 1 8.341 0.004 . 1 . . . A 133 VAL H . 17991 1 1227 . 1 1 133 133 VAL HA H 1 3.867 0.015 . 1 . . . A 133 VAL HA . 17991 1 1228 . 1 1 133 133 VAL HB H 1 2.355 0.003 . 1 . . . A 133 VAL HB . 17991 1 1229 . 1 1 133 133 VAL HG11 H 1 1.201 0.003 . . . . . A 133 VAL HG11 . 17991 1 1230 . 1 1 133 133 VAL HG12 H 1 1.201 0.003 . . . . . A 133 VAL HG12 . 17991 1 1231 . 1 1 133 133 VAL HG13 H 1 1.201 0.003 . . . . . A 133 VAL HG13 . 17991 1 1232 . 1 1 133 133 VAL HG21 H 1 0.998 0.020 . . . . . A 133 VAL HG21 . 17991 1 1233 . 1 1 133 133 VAL HG22 H 1 0.998 0.020 . . . . . A 133 VAL HG22 . 17991 1 1234 . 1 1 133 133 VAL HG23 H 1 0.998 0.020 . . . . . A 133 VAL HG23 . 17991 1 1235 . 1 1 133 133 VAL CA C 13 66.330 0.234 . 1 . . . A 133 VAL CA . 17991 1 1236 . 1 1 133 133 VAL CB C 13 32.156 0.076 . 1 . . . A 133 VAL CB . 17991 1 1237 . 1 1 133 133 VAL CG2 C 13 21.954 0.000 . 2 . . . A 133 VAL CG2 . 17991 1 1238 . 1 1 133 133 VAL N N 15 120.060 0.095 . 1 . . . A 133 VAL N . 17991 1 1239 . 1 1 134 134 ILE H H 1 8.331 0.009 . 1 . . . A 134 ILE H . 17991 1 1240 . 1 1 134 134 ILE HA H 1 3.860 0.014 . 1 . . . A 134 ILE HA . 17991 1 1241 . 1 1 134 134 ILE HB H 1 1.815 0.009 . 1 . . . A 134 ILE HB . 17991 1 1242 . 1 1 134 134 ILE HG21 H 1 0.994 0.006 . . . . . A 134 ILE HG21 . 17991 1 1243 . 1 1 134 134 ILE HG22 H 1 0.994 0.006 . . . . . A 134 ILE HG22 . 17991 1 1244 . 1 1 134 134 ILE HG23 H 1 0.994 0.006 . . . . . A 134 ILE HG23 . 17991 1 1245 . 1 1 134 134 ILE HD11 H 1 0.961 0.020 . . . . . A 134 ILE HD11 . 17991 1 1246 . 1 1 134 134 ILE HD12 H 1 0.961 0.020 . . . . . A 134 ILE HD12 . 17991 1 1247 . 1 1 134 134 ILE HD13 H 1 0.961 0.020 . . . . . A 134 ILE HD13 . 17991 1 1248 . 1 1 134 134 ILE CA C 13 65.184 0.013 . 1 . . . A 134 ILE CA . 17991 1 1249 . 1 1 134 134 ILE CB C 13 37.902 0.000 . 1 . . . A 134 ILE CB . 17991 1 1250 . 1 1 134 134 ILE CG2 C 13 17.748 0.125 . 1 . . . A 134 ILE CG2 . 17991 1 1251 . 1 1 134 134 ILE CD1 C 13 13.334 0.193 . 1 . . . A 134 ILE CD1 . 17991 1 1252 . 1 1 134 134 ILE N N 15 119.699 0.132 . 1 . . . A 134 ILE N . 17991 1 1253 . 1 1 135 135 ASN H H 1 8.318 0.013 . 1 . . . A 135 ASN H . 17991 1 1254 . 1 1 135 135 ASN HA H 1 4.675 0.005 . 1 . . . A 135 ASN HA . 17991 1 1255 . 1 1 135 135 ASN HB2 H 1 2.970 0.010 . 2 . . . A 135 ASN HB2 . 17991 1 1256 . 1 1 135 135 ASN HB3 H 1 2.970 0.010 . 2 . . . A 135 ASN HB3 . 17991 1 1257 . 1 1 135 135 ASN HD21 H 1 7.598 0.003 . 2 . . . A 135 ASN HD21 . 17991 1 1258 . 1 1 135 135 ASN HD22 H 1 6.898 0.004 . 2 . . . A 135 ASN HD22 . 17991 1 1259 . 1 1 135 135 ASN CA C 13 55.505 0.015 . 1 . . . A 135 ASN CA . 17991 1 1260 . 1 1 135 135 ASN CB C 13 39.127 0.079 . 1 . . . A 135 ASN CB . 17991 1 1261 . 1 1 135 135 ASN N N 15 117.396 0.089 . 1 . . . A 135 ASN N . 17991 1 1262 . 1 1 135 135 ASN ND2 N 15 111.636 0.038 . 1 . . . A 135 ASN ND2 . 17991 1 1263 . 1 1 136 136 THR H H 1 8.006 0.009 . 1 . . . A 136 THR H . 17991 1 1264 . 1 1 136 136 THR HA H 1 4.308 0.006 . 1 . . . A 136 THR HA . 17991 1 1265 . 1 1 136 136 THR HB H 1 4.679 0.000 . 1 . . . A 136 THR HB . 17991 1 1266 . 1 1 136 136 THR HG21 H 1 1.299 0.007 . . . . . A 136 THR HG21 . 17991 1 1267 . 1 1 136 136 THR HG22 H 1 1.299 0.007 . . . . . A 136 THR HG22 . 17991 1 1268 . 1 1 136 136 THR HG23 H 1 1.299 0.007 . . . . . A 136 THR HG23 . 17991 1 1269 . 1 1 136 136 THR CA C 13 63.872 0.032 . 1 . . . A 136 THR CA . 17991 1 1270 . 1 1 136 136 THR CB C 13 69.779 0.000 . 1 . . . A 136 THR CB . 17991 1 1271 . 1 1 136 136 THR CG2 C 13 21.903 0.000 . 1 . . . A 136 THR CG2 . 17991 1 1272 . 1 1 136 136 THR N N 15 111.419 0.047 . 1 . . . A 136 THR N . 17991 1 1273 . 1 1 137 137 HIS H H 1 8.013 0.013 . 1 . . . A 137 HIS H . 17991 1 1274 . 1 1 137 137 HIS HA H 1 4.703 0.016 . 1 . . . A 137 HIS HA . 17991 1 1275 . 1 1 137 137 HIS HB2 H 1 3.457 0.033 . 2 . . . A 137 HIS HB2 . 17991 1 1276 . 1 1 137 137 HIS HB3 H 1 3.208 0.017 . 2 . . . A 137 HIS HB3 . 17991 1 1277 . 1 1 137 137 HIS CA C 13 56.460 0.014 . 1 . . . A 137 HIS CA . 17991 1 1278 . 1 1 137 137 HIS CB C 13 28.712 0.341 . 1 . . . A 137 HIS CB . 17991 1 1279 . 1 1 137 137 HIS N N 15 118.612 0.150 . 1 . . . A 137 HIS N . 17991 1 1280 . 1 1 138 138 HIS H H 1 8.169 0.017 . 1 . . . A 138 HIS H . 17991 1 1281 . 1 1 138 138 HIS HA H 1 4.826 0.011 . 1 . . . A 138 HIS HA . 17991 1 1282 . 1 1 138 138 HIS HB2 H 1 3.398 0.026 . 2 . . . A 138 HIS HB2 . 17991 1 1283 . 1 1 138 138 HIS HB3 H 1 3.278 0.010 . 2 . . . A 138 HIS HB3 . 17991 1 1284 . 1 1 138 138 HIS HD2 H 1 7.311 0.002 . 1 . . . A 138 HIS HD2 . 17991 1 1285 . 1 1 138 138 HIS CA C 13 55.514 0.145 . 1 . . . A 138 HIS CA . 17991 1 1286 . 1 1 138 138 HIS CB C 13 29.246 0.085 . 1 . . . A 138 HIS CB . 17991 1 1287 . 1 1 138 138 HIS N N 15 118.709 0.024 . 1 . . . A 138 HIS N . 17991 1 1288 . 1 1 139 139 ARG H H 1 8.419 0.013 . 1 . . . A 139 ARG H . 17991 1 1289 . 1 1 139 139 ARG HA H 1 4.566 0.020 . 1 . . . A 139 ARG HA . 17991 1 1290 . 1 1 139 139 ARG HB2 H 1 1.860 0.018 . 2 . . . A 139 ARG HB2 . 17991 1 1291 . 1 1 139 139 ARG HB3 H 1 1.860 0.018 . 2 . . . A 139 ARG HB3 . 17991 1 1292 . 1 1 139 139 ARG HG2 H 1 1.938 0.000 . 2 . . . A 139 ARG HG2 . 17991 1 1293 . 1 1 139 139 ARG HG3 H 1 1.938 0.000 . 2 . . . A 139 ARG HG3 . 17991 1 1294 . 1 1 139 139 ARG HD2 H 1 3.283 0.010 . 2 . . . A 139 ARG HD2 . 17991 1 1295 . 1 1 139 139 ARG HD3 H 1 3.283 0.010 . 2 . . . A 139 ARG HD3 . 17991 1 1296 . 1 1 139 139 ARG CA C 13 56.394 0.082 . 1 . . . A 139 ARG CA . 17991 1 1297 . 1 1 139 139 ARG CB C 13 31.021 0.030 . 1 . . . A 139 ARG CB . 17991 1 1298 . 1 1 139 139 ARG CG C 13 26.951 0.000 . 1 . . . A 139 ARG CG . 17991 1 1299 . 1 1 139 139 ARG CD C 13 43.423 0.073 . 1 . . . A 139 ARG CD . 17991 1 1300 . 1 1 139 139 ARG N N 15 123.025 0.070 . 1 . . . A 139 ARG N . 17991 1 1301 . 1 1 140 140 SER H H 1 8.017 0.011 . 1 . . . A 140 SER H . 17991 1 1302 . 1 1 140 140 SER HA H 1 4.445 0.020 . 1 . . . A 140 SER HA . 17991 1 1303 . 1 1 140 140 SER HB2 H 1 3.976 0.033 . 2 . . . A 140 SER HB2 . 17991 1 1304 . 1 1 140 140 SER HB3 H 1 3.976 0.033 . 2 . . . A 140 SER HB3 . 17991 1 1305 . 1 1 140 140 SER CA C 13 60.821 0.000 . 1 . . . A 140 SER CA . 17991 1 1306 . 1 1 140 140 SER N N 15 122.549 0.046 . 1 . . . A 140 SER N . 17991 1 stop_ save_