data_17509 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 17509 _Entry.Title ; NMR structure of the protein YP_557733.1 from Burkholderia xenovorans ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2011-03-04 _Entry.Accession_date 2011-03-04 _Entry.Last_release_date 2011-03-25 _Entry.Original_release_date 2011-03-25 _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, 20 STRUCTURES' _Entry.Details 'The deposited structure represent the main conformation in solution. An additional conformation involving residues 1-17 was observed by NMR (peak doubling). The ratio between the two conformations is 95:5.' _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 Kristaps Jaudzems . . . 17509 2 Pedro Serrano . . . 17509 3 Geralt Michael . . . 17509 4 Horst Reto . . . 17509 5 Kurt Wuthrich . . . 17509 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 . 'PSI, Protein Structure Initiative' 'Joint Center for Structural Genomics' . 17509 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'Pilot Secretin MxiM fold' . 17509 PX10320C . 17509 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 17509 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 462 17509 '15N chemical shifts' 159 17509 '1H chemical shifts' 969 17509 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2011-03-25 2011-03-04 original author . 17509 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2LA7 'BMRB Entry Tracking System' 17509 stop_ save_ ############### # Citations # ############### save_citations _Citation.Sf_category citations _Citation.Sf_framecode citations _Citation.Entry_ID 17509 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title Null _Citation.Status 'in preparation' _Citation.Type journal _Citation.Journal_abbrev 'To be Published' _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first . _Citation.Page_last . _Citation.Year . _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 Kristaps Jaudzems . . . 17509 1 2 Pedro Serrano . . . 17509 1 3 Geralt Michael . . . 17509 1 4 Horst Reto . . . 17509 1 5 Kurt Wuthrich . . . 17509 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 17509 _Assembly.ID 1 _Assembly.Name YP_557733.1 _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 YP_557733.1 1 $YP_557733.1 A . yes native no no . . . 17509 1 stop_ loop_ _Bond.ID _Bond.Type _Bond.Value_order _Bond.Assembly_atom_ID_1 _Bond.Entity_assembly_ID_1 _Bond.Entity_assembly_name_1 _Bond.Entity_ID_1 _Bond.Comp_ID_1 _Bond.Comp_index_ID_1 _Bond.Seq_ID_1 _Bond.Atom_ID_1 _Bond.Assembly_atom_ID_2 _Bond.Entity_assembly_ID_2 _Bond.Entity_assembly_name_2 _Bond.Entity_ID_2 _Bond.Comp_ID_2 _Bond.Comp_index_ID_2 _Bond.Seq_ID_2 _Bond.Atom_ID_2 _Bond.Auth_entity_assembly_ID_1 _Bond.Auth_entity_assembly_name_1 _Bond.Auth_seq_ID_1 _Bond.Auth_comp_ID_1 _Bond.Auth_atom_ID_1 _Bond.Auth_entity_assembly_ID_2 _Bond.Auth_entity_assembly_name_2 _Bond.Auth_seq_ID_2 _Bond.Auth_comp_ID_2 _Bond.Auth_atom_ID_2 _Bond.Entry_ID _Bond.Assembly_ID 1 disulfide single . 1 . 1 CYS 71 71 SG . 1 . 1 CYS 97 97 SG . . . . . . . . . . 17509 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_YP_557733.1 _Entity.Sf_category entity _Entity.Sf_framecode YP_557733.1 _Entity.Entry_ID 17509 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name YP_557733.1 _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 ; IPKHPDSEAVAPDPFNPAAT QLLDDTSWVLSAWKQADGTA RAVPSADQGAPITLTLSTST GQRHASGFSGCNRYMGSYAL KDGKLSFGTLGGTRMACMTP GGQIEGAYLNALTHIDRTGV QMRAPQQMQLVLDNGDTLTF DRSTR ; _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 145 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all disulfide bound' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 15414.306 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 2LA7 . "Nmr Structure Of The Protein Yp_557733.1 From Burkholderia Xenovorans" . . . . . 100.00 145 100.00 100.00 2.92e-101 . . . . 17509 1 2 no GB ABE29681 . "Conserved hypothetical protein [Burkholderia xenovorans LB400]" . . . . . 100.00 179 100.00 100.00 1.09e-101 . . . . 17509 1 3 no GB EIF32471 . "heat shock protein [Burkholderia sp. Ch1-1]" . . . . . 100.00 179 97.93 100.00 3.68e-100 . . . . 17509 1 4 no REF WP_007175698 . "heat-shock protein [Burkholderia sp. Ch1-1]" . . . . . 100.00 179 97.93 100.00 3.68e-100 . . . . 17509 1 5 no REF WP_011487414 . "heat-shock protein [Burkholderia xenovorans]" . . . . . 100.00 179 100.00 100.00 1.09e-101 . . . . 17509 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 . ILE . 17509 1 2 . PRO . 17509 1 3 . LYS . 17509 1 4 . HIS . 17509 1 5 . PRO . 17509 1 6 . ASP . 17509 1 7 . SER . 17509 1 8 . GLU . 17509 1 9 . ALA . 17509 1 10 . VAL . 17509 1 11 . ALA . 17509 1 12 . PRO . 17509 1 13 . ASP . 17509 1 14 . PRO . 17509 1 15 . PHE . 17509 1 16 . ASN . 17509 1 17 . PRO . 17509 1 18 . ALA . 17509 1 19 . ALA . 17509 1 20 . THR . 17509 1 21 . GLN . 17509 1 22 . LEU . 17509 1 23 . LEU . 17509 1 24 . ASP . 17509 1 25 . ASP . 17509 1 26 . THR . 17509 1 27 . SER . 17509 1 28 . TRP . 17509 1 29 . VAL . 17509 1 30 . LEU . 17509 1 31 . SER . 17509 1 32 . ALA . 17509 1 33 . TRP . 17509 1 34 . LYS . 17509 1 35 . GLN . 17509 1 36 . ALA . 17509 1 37 . ASP . 17509 1 38 . GLY . 17509 1 39 . THR . 17509 1 40 . ALA . 17509 1 41 . ARG . 17509 1 42 . ALA . 17509 1 43 . VAL . 17509 1 44 . PRO . 17509 1 45 . SER . 17509 1 46 . ALA . 17509 1 47 . ASP . 17509 1 48 . GLN . 17509 1 49 . GLY . 17509 1 50 . ALA . 17509 1 51 . PRO . 17509 1 52 . ILE . 17509 1 53 . THR . 17509 1 54 . LEU . 17509 1 55 . THR . 17509 1 56 . LEU . 17509 1 57 . SER . 17509 1 58 . THR . 17509 1 59 . SER . 17509 1 60 . THR . 17509 1 61 . GLY . 17509 1 62 . GLN . 17509 1 63 . ARG . 17509 1 64 . HIS . 17509 1 65 . ALA . 17509 1 66 . SER . 17509 1 67 . GLY . 17509 1 68 . PHE . 17509 1 69 . SER . 17509 1 70 . GLY . 17509 1 71 . CYS . 17509 1 72 . ASN . 17509 1 73 . ARG . 17509 1 74 . TYR . 17509 1 75 . MET . 17509 1 76 . GLY . 17509 1 77 . SER . 17509 1 78 . TYR . 17509 1 79 . ALA . 17509 1 80 . LEU . 17509 1 81 . LYS . 17509 1 82 . ASP . 17509 1 83 . GLY . 17509 1 84 . LYS . 17509 1 85 . LEU . 17509 1 86 . SER . 17509 1 87 . PHE . 17509 1 88 . GLY . 17509 1 89 . THR . 17509 1 90 . LEU . 17509 1 91 . GLY . 17509 1 92 . GLY . 17509 1 93 . THR . 17509 1 94 . ARG . 17509 1 95 . MET . 17509 1 96 . ALA . 17509 1 97 . CYS . 17509 1 98 . MET . 17509 1 99 . THR . 17509 1 100 . PRO . 17509 1 101 . GLY . 17509 1 102 . GLY . 17509 1 103 . GLN . 17509 1 104 . ILE . 17509 1 105 . GLU . 17509 1 106 . GLY . 17509 1 107 . ALA . 17509 1 108 . TYR . 17509 1 109 . LEU . 17509 1 110 . ASN . 17509 1 111 . ALA . 17509 1 112 . LEU . 17509 1 113 . THR . 17509 1 114 . HIS . 17509 1 115 . ILE . 17509 1 116 . ASP . 17509 1 117 . ARG . 17509 1 118 . THR . 17509 1 119 . GLY . 17509 1 120 . VAL . 17509 1 121 . GLN . 17509 1 122 . MET . 17509 1 123 . ARG . 17509 1 124 . ALA . 17509 1 125 . PRO . 17509 1 126 . GLN . 17509 1 127 . GLN . 17509 1 128 . MET . 17509 1 129 . GLN . 17509 1 130 . LEU . 17509 1 131 . VAL . 17509 1 132 . LEU . 17509 1 133 . ASP . 17509 1 134 . ASN . 17509 1 135 . GLY . 17509 1 136 . ASP . 17509 1 137 . THR . 17509 1 138 . LEU . 17509 1 139 . THR . 17509 1 140 . PHE . 17509 1 141 . ASP . 17509 1 142 . ARG . 17509 1 143 . SER . 17509 1 144 . THR . 17509 1 145 . ARG . 17509 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 . ILE 1 1 17509 1 . PRO 2 2 17509 1 . LYS 3 3 17509 1 . HIS 4 4 17509 1 . PRO 5 5 17509 1 . ASP 6 6 17509 1 . SER 7 7 17509 1 . GLU 8 8 17509 1 . ALA 9 9 17509 1 . VAL 10 10 17509 1 . ALA 11 11 17509 1 . PRO 12 12 17509 1 . ASP 13 13 17509 1 . PRO 14 14 17509 1 . PHE 15 15 17509 1 . ASN 16 16 17509 1 . PRO 17 17 17509 1 . ALA 18 18 17509 1 . ALA 19 19 17509 1 . THR 20 20 17509 1 . GLN 21 21 17509 1 . LEU 22 22 17509 1 . LEU 23 23 17509 1 . ASP 24 24 17509 1 . ASP 25 25 17509 1 . THR 26 26 17509 1 . SER 27 27 17509 1 . TRP 28 28 17509 1 . VAL 29 29 17509 1 . LEU 30 30 17509 1 . SER 31 31 17509 1 . ALA 32 32 17509 1 . TRP 33 33 17509 1 . LYS 34 34 17509 1 . GLN 35 35 17509 1 . ALA 36 36 17509 1 . ASP 37 37 17509 1 . GLY 38 38 17509 1 . THR 39 39 17509 1 . ALA 40 40 17509 1 . ARG 41 41 17509 1 . ALA 42 42 17509 1 . VAL 43 43 17509 1 . PRO 44 44 17509 1 . SER 45 45 17509 1 . ALA 46 46 17509 1 . ASP 47 47 17509 1 . GLN 48 48 17509 1 . GLY 49 49 17509 1 . ALA 50 50 17509 1 . PRO 51 51 17509 1 . ILE 52 52 17509 1 . THR 53 53 17509 1 . LEU 54 54 17509 1 . THR 55 55 17509 1 . LEU 56 56 17509 1 . SER 57 57 17509 1 . THR 58 58 17509 1 . SER 59 59 17509 1 . THR 60 60 17509 1 . GLY 61 61 17509 1 . GLN 62 62 17509 1 . ARG 63 63 17509 1 . HIS 64 64 17509 1 . ALA 65 65 17509 1 . SER 66 66 17509 1 . GLY 67 67 17509 1 . PHE 68 68 17509 1 . SER 69 69 17509 1 . GLY 70 70 17509 1 . CYS 71 71 17509 1 . ASN 72 72 17509 1 . ARG 73 73 17509 1 . TYR 74 74 17509 1 . MET 75 75 17509 1 . GLY 76 76 17509 1 . SER 77 77 17509 1 . TYR 78 78 17509 1 . ALA 79 79 17509 1 . LEU 80 80 17509 1 . LYS 81 81 17509 1 . ASP 82 82 17509 1 . GLY 83 83 17509 1 . LYS 84 84 17509 1 . LEU 85 85 17509 1 . SER 86 86 17509 1 . PHE 87 87 17509 1 . GLY 88 88 17509 1 . THR 89 89 17509 1 . LEU 90 90 17509 1 . GLY 91 91 17509 1 . GLY 92 92 17509 1 . THR 93 93 17509 1 . ARG 94 94 17509 1 . MET 95 95 17509 1 . ALA 96 96 17509 1 . CYS 97 97 17509 1 . MET 98 98 17509 1 . THR 99 99 17509 1 . PRO 100 100 17509 1 . GLY 101 101 17509 1 . GLY 102 102 17509 1 . GLN 103 103 17509 1 . ILE 104 104 17509 1 . GLU 105 105 17509 1 . GLY 106 106 17509 1 . ALA 107 107 17509 1 . TYR 108 108 17509 1 . LEU 109 109 17509 1 . ASN 110 110 17509 1 . ALA 111 111 17509 1 . LEU 112 112 17509 1 . THR 113 113 17509 1 . HIS 114 114 17509 1 . ILE 115 115 17509 1 . ASP 116 116 17509 1 . ARG 117 117 17509 1 . THR 118 118 17509 1 . GLY 119 119 17509 1 . VAL 120 120 17509 1 . GLN 121 121 17509 1 . MET 122 122 17509 1 . ARG 123 123 17509 1 . ALA 124 124 17509 1 . PRO 125 125 17509 1 . GLN 126 126 17509 1 . GLN 127 127 17509 1 . MET 128 128 17509 1 . GLN 129 129 17509 1 . LEU 130 130 17509 1 . VAL 131 131 17509 1 . LEU 132 132 17509 1 . ASP 133 133 17509 1 . ASN 134 134 17509 1 . GLY 135 135 17509 1 . ASP 136 136 17509 1 . THR 137 137 17509 1 . LEU 138 138 17509 1 . THR 139 139 17509 1 . PHE 140 140 17509 1 . ASP 141 141 17509 1 . ARG 142 142 17509 1 . SER 143 143 17509 1 . THR 144 144 17509 1 . ARG 145 145 17509 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 17509 _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 $YP_557733.1 . 36873 organism . 'Burkholderia xenovorans' 'Burkholderia xenovorans' . . Bacteria . Burkholderia xenovorans lb400 . . . . . . . . . . . . . . . . . . . . 17509 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 17509 _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 $YP_557733.1 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli 'BL21 DE3' . . . . . . . . . . . . . . . pSpeedET . . . . . . 17509 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 17509 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% 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 entity '[U-98% 13C; U-98% 15N]' . . 1 $YP_557733.1 . . 1 . . mM . . . . 17509 1 2 'sodium chloride' 'natural abundance' . . . . . . 50 . . mM . . . . 17509 1 3 'sodium phosphate' 'natural abundance' . . . . . . 20 . . mM . . . . 17509 1 4 'sodium azide' 'natural abundance' . . . . . . 4.5 . . mM . . . . 17509 1 5 H2O 'natural abundance' . . . . . . 95 . . % . . . . 17509 1 6 D2O 'natural abundance' . . . . . . 5 . . % . . . . 17509 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 17509 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0.225 . M 17509 1 pH 6.0 . pH 17509 1 pressure 1 . atm 17509 1 temperature 298 . K 17509 1 stop_ save_ ############################ # Computer software used # ############################ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 17509 _Software.ID 1 _Software.Name CYANA _Software.Version 3.0 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . 17509 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 17509 1 stop_ save_ save_UNIO _Software.Sf_category software _Software.Sf_framecode UNIO _Software.Entry_ID 17509 _Software.ID 2 _Software.Name UNIO _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Unio Herrmann Wuthrich' . . 17509 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 17509 2 processing 17509 2 'structure solution' 17509 2 stop_ save_ save_TOPSPIN _Software.Sf_category software _Software.Sf_framecode TOPSPIN _Software.Entry_ID 17509 _Software.ID 3 _Software.Name TOPSPIN _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 17509 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 17509 3 'data analysis' 17509 3 processing 17509 3 stop_ save_ save_CARA _Software.Sf_category software _Software.Sf_framecode CARA _Software.Entry_ID 17509 _Software.ID 4 _Software.Name CARA _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Keller and Wuthrich' . . 17509 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 17509 4 'data analysis' 17509 4 stop_ save_ save_OPAL _Software.Sf_category software _Software.Sf_framecode OPAL _Software.Entry_ID 17509 _Software.ID 5 _Software.Name OPAL _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Luginbuhl, Guntert, Billeter and Wuthrich' . . 17509 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 17509 5 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 17509 _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 17509 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 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 17509 _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 . . . 17509 1 2 spectrometer_2 Bruker Avance . 800 . . . 17509 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 17509 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17509 1 2 '2D 1H-13C HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17509 1 3 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 17509 1 4 '3D 1H-13C NOESY aliphatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 17509 1 5 '3D 1H-13C NOESY aromatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 17509 1 6 '5D APSY-HACACONH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17509 1 7 '4D APSY-HACANH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17509 1 8 '5D APSY-CBCACONH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17509 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 17509 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 . indirect 0.251449530 . . . . . . . . . 17509 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 17509 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 . indirect 0.101329118 . . . . . . . . . 17509 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 17509 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 17509 1 3 '3D 1H-15N NOESY' . . . 17509 1 4 '3D 1H-13C NOESY aliphatic' . . . 17509 1 5 '3D 1H-13C NOESY aromatic' . . . 17509 1 6 '5D APSY-HACACONH' . . . 17509 1 7 '4D APSY-HACANH' . . . 17509 1 8 '5D APSY-CBCACONH' . . . 17509 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 ILE HA H 1 4.483 0.020 . 1 . . . A 1 ILE HA . 17509 1 2 . 1 1 1 1 ILE HB H 1 1.820 0.020 . 1 . . . A 1 ILE HB . 17509 1 3 . 1 1 1 1 ILE HG12 H 1 1.476 0.020 . 2 . . . A 1 ILE HG12 . 17509 1 4 . 1 1 1 1 ILE HG13 H 1 1.157 0.020 . 2 . . . A 1 ILE HG13 . 17509 1 5 . 1 1 1 1 ILE HG21 H 1 0.949 0.020 . 1 . . . A 1 ILE HG21 . 17509 1 6 . 1 1 1 1 ILE HG22 H 1 0.949 0.020 . 1 . . . A 1 ILE HG22 . 17509 1 7 . 1 1 1 1 ILE HG23 H 1 0.949 0.020 . 1 . . . A 1 ILE HG23 . 17509 1 8 . 1 1 1 1 ILE HD11 H 1 0.845 0.020 . 1 . . . A 1 ILE HD11 . 17509 1 9 . 1 1 1 1 ILE HD12 H 1 0.845 0.020 . 1 . . . A 1 ILE HD12 . 17509 1 10 . 1 1 1 1 ILE HD13 H 1 0.845 0.020 . 1 . . . A 1 ILE HD13 . 17509 1 11 . 1 1 1 1 ILE H H 1 8.454 0.020 . 1 . . . A 1 ILE H1 . 17509 1 12 . 1 1 1 1 ILE CA C 13 58.981 0.400 . 1 . . . A 1 ILE CA . 17509 1 13 . 1 1 1 1 ILE CB C 13 38.727 0.400 . 1 . . . A 1 ILE CB . 17509 1 14 . 1 1 1 1 ILE CG1 C 13 26.944 0.400 . 1 . . . A 1 ILE CG1 . 17509 1 15 . 1 1 1 1 ILE CG2 C 13 17.113 0.400 . 1 . . . A 1 ILE CG2 . 17509 1 16 . 1 1 1 1 ILE CD1 C 13 12.913 0.400 . 1 . . . A 1 ILE CD1 . 17509 1 17 . 1 1 1 1 ILE N N 15 121.371 0.400 . 1 . . . A 1 ILE N . 17509 1 18 . 1 1 2 2 PRO HA H 1 4.364 0.020 . 1 . . . A 2 PRO HA . 17509 1 19 . 1 1 2 2 PRO HB2 H 1 2.258 0.020 . 2 . . . A 2 PRO HB2 . 17509 1 20 . 1 1 2 2 PRO HB3 H 1 1.787 0.020 . 2 . . . A 2 PRO HB3 . 17509 1 21 . 1 1 2 2 PRO HG2 H 1 2.015 0.020 . 2 . . . A 2 PRO HG2 . 17509 1 22 . 1 1 2 2 PRO HG3 H 1 1.972 0.020 . 2 . . . A 2 PRO HG3 . 17509 1 23 . 1 1 2 2 PRO HD2 H 1 3.889 0.020 . 2 . . . A 2 PRO HD2 . 17509 1 24 . 1 1 2 2 PRO HD3 H 1 3.667 0.020 . 2 . . . A 2 PRO HD3 . 17509 1 25 . 1 1 2 2 PRO CA C 13 63.032 0.400 . 1 . . . A 2 PRO CA . 17509 1 26 . 1 1 2 2 PRO CB C 13 32.172 0.400 . 1 . . . A 2 PRO CB . 17509 1 27 . 1 1 2 2 PRO CG C 13 27.590 0.400 . 1 . . . A 2 PRO CG . 17509 1 28 . 1 1 2 2 PRO CD C 13 51.099 0.400 . 1 . . . A 2 PRO CD . 17509 1 29 . 1 1 3 3 LYS H H 1 8.360 0.020 . 1 . . . A 3 LYS H . 17509 1 30 . 1 1 3 3 LYS HA H 1 4.185 0.020 . 1 . . . A 3 LYS HA . 17509 1 31 . 1 1 3 3 LYS HB2 H 1 1.689 0.020 . 2 . . . A 3 LYS HB2 . 17509 1 32 . 1 1 3 3 LYS HB3 H 1 1.689 0.020 . 2 . . . A 3 LYS HB3 . 17509 1 33 . 1 1 3 3 LYS HG2 H 1 1.388 0.020 . 2 . . . A 3 LYS HG2 . 17509 1 34 . 1 1 3 3 LYS HG3 H 1 1.343 0.020 . 2 . . . A 3 LYS HG3 . 17509 1 35 . 1 1 3 3 LYS HD2 H 1 1.640 0.020 . 2 . . . A 3 LYS HD2 . 17509 1 36 . 1 1 3 3 LYS HD3 H 1 1.640 0.020 . 2 . . . A 3 LYS HD3 . 17509 1 37 . 1 1 3 3 LYS HE2 H 1 2.957 0.020 . 2 . . . A 3 LYS HE2 . 17509 1 38 . 1 1 3 3 LYS HE3 H 1 2.957 0.020 . 2 . . . A 3 LYS HE3 . 17509 1 39 . 1 1 3 3 LYS CA C 13 56.226 0.400 . 1 . . . A 3 LYS CA . 17509 1 40 . 1 1 3 3 LYS CB C 13 33.210 0.400 . 1 . . . A 3 LYS CB . 17509 1 41 . 1 1 3 3 LYS CG C 13 24.722 0.400 . 1 . . . A 3 LYS CG . 17509 1 42 . 1 1 3 3 LYS CD C 13 29.106 0.400 . 1 . . . A 3 LYS CD . 17509 1 43 . 1 1 3 3 LYS CE C 13 42.116 0.400 . 1 . . . A 3 LYS CE . 17509 1 44 . 1 1 3 3 LYS N N 15 121.626 0.400 . 1 . . . A 3 LYS N . 17509 1 45 . 1 1 4 4 HIS H H 1 8.458 0.020 . 1 . . . A 4 HIS H . 17509 1 46 . 1 1 4 4 HIS HA H 1 4.916 0.020 . 1 . . . A 4 HIS HA . 17509 1 47 . 1 1 4 4 HIS HB2 H 1 3.162 0.020 . 2 . . . A 4 HIS HB2 . 17509 1 48 . 1 1 4 4 HIS HB3 H 1 3.083 0.020 . 2 . . . A 4 HIS HB3 . 17509 1 49 . 1 1 4 4 HIS HD2 H 1 7.214 0.020 . 1 . . . A 4 HIS HD2 . 17509 1 50 . 1 1 4 4 HIS HE1 H 1 8.321 0.020 . 1 . . . A 4 HIS HE1 . 17509 1 51 . 1 1 4 4 HIS CA C 13 53.554 0.400 . 1 . . . A 4 HIS CA . 17509 1 52 . 1 1 4 4 HIS CB C 13 29.333 0.400 . 1 . . . A 4 HIS CB . 17509 1 53 . 1 1 4 4 HIS CD2 C 13 120.308 0.400 . 1 . . . A 4 HIS CD2 . 17509 1 54 . 1 1 4 4 HIS CE1 C 13 137.126 0.400 . 1 . . . A 4 HIS CE1 . 17509 1 55 . 1 1 4 4 HIS N N 15 120.983 0.400 . 1 . . . A 4 HIS N . 17509 1 56 . 1 1 5 5 PRO HA H 1 4.405 0.020 . 1 . . . A 5 PRO HA . 17509 1 57 . 1 1 5 5 PRO HB2 H 1 2.275 0.020 . 2 . . . A 5 PRO HB2 . 17509 1 58 . 1 1 5 5 PRO HB3 H 1 1.924 0.020 . 2 . . . A 5 PRO HB3 . 17509 1 59 . 1 1 5 5 PRO HG2 H 1 1.963 0.020 . 2 . . . A 5 PRO HG2 . 17509 1 60 . 1 1 5 5 PRO HG3 H 1 1.963 0.020 . 2 . . . A 5 PRO HG3 . 17509 1 61 . 1 1 5 5 PRO HD2 H 1 3.705 0.020 . 2 . . . A 5 PRO HD2 . 17509 1 62 . 1 1 5 5 PRO HD3 H 1 3.484 0.020 . 2 . . . A 5 PRO HD3 . 17509 1 63 . 1 1 5 5 PRO CA C 13 63.373 0.400 . 1 . . . A 5 PRO CA . 17509 1 64 . 1 1 5 5 PRO CB C 13 32.196 0.400 . 1 . . . A 5 PRO CB . 17509 1 65 . 1 1 5 5 PRO CG C 13 27.375 0.400 . 1 . . . A 5 PRO CG . 17509 1 66 . 1 1 5 5 PRO CD C 13 50.663 0.400 . 1 . . . A 5 PRO CD . 17509 1 67 . 1 1 6 6 ASP H H 1 8.655 0.020 . 1 . . . A 6 ASP H . 17509 1 68 . 1 1 6 6 ASP HA H 1 4.583 0.020 . 1 . . . A 6 ASP HA . 17509 1 69 . 1 1 6 6 ASP HB2 H 1 2.728 0.020 . 2 . . . A 6 ASP HB2 . 17509 1 70 . 1 1 6 6 ASP HB3 H 1 2.628 0.020 . 2 . . . A 6 ASP HB3 . 17509 1 71 . 1 1 6 6 ASP CA C 13 54.802 0.400 . 1 . . . A 6 ASP CA . 17509 1 72 . 1 1 6 6 ASP CB C 13 41.047 0.400 . 1 . . . A 6 ASP CB . 17509 1 73 . 1 1 6 6 ASP N N 15 120.983 0.400 . 1 . . . A 6 ASP N . 17509 1 74 . 1 1 7 7 SER H H 1 8.188 0.020 . 1 . . . A 7 SER H . 17509 1 75 . 1 1 7 7 SER HA H 1 4.378 0.020 . 1 . . . A 7 SER HA . 17509 1 76 . 1 1 7 7 SER HB2 H 1 3.898 0.020 . 2 . . . A 7 SER HB2 . 17509 1 77 . 1 1 7 7 SER HB3 H 1 3.831 0.020 . 2 . . . A 7 SER HB3 . 17509 1 78 . 1 1 7 7 SER CA C 13 58.706 0.400 . 1 . . . A 7 SER CA . 17509 1 79 . 1 1 7 7 SER CB C 13 63.770 0.400 . 1 . . . A 7 SER CB . 17509 1 80 . 1 1 7 7 SER N N 15 115.198 0.400 . 1 . . . A 7 SER N . 17509 1 81 . 1 1 8 8 GLU H H 1 8.297 0.020 . 1 . . . A 8 GLU H . 17509 1 82 . 1 1 8 8 GLU HA H 1 4.268 0.020 . 1 . . . A 8 GLU HA . 17509 1 83 . 1 1 8 8 GLU HB2 H 1 1.900 0.020 . 2 . . . A 8 GLU HB2 . 17509 1 84 . 1 1 8 8 GLU HB3 H 1 2.056 0.020 . 2 . . . A 8 GLU HB3 . 17509 1 85 . 1 1 8 8 GLU HG2 H 1 2.256 0.020 . 2 . . . A 8 GLU HG2 . 17509 1 86 . 1 1 8 8 GLU HG3 H 1 2.219 0.020 . 2 . . . A 8 GLU HG3 . 17509 1 87 . 1 1 8 8 GLU CA C 13 56.445 0.400 . 1 . . . A 8 GLU CA . 17509 1 88 . 1 1 8 8 GLU CB C 13 30.322 0.400 . 1 . . . A 8 GLU CB . 17509 1 89 . 1 1 8 8 GLU CG C 13 36.296 0.400 . 1 . . . A 8 GLU CG . 17509 1 90 . 1 1 8 8 GLU N N 15 122.292 0.400 . 1 . . . A 8 GLU N . 17509 1 91 . 1 1 9 9 ALA H H 1 8.165 0.020 . 1 . . . A 9 ALA H . 17509 1 92 . 1 1 9 9 ALA HA H 1 4.290 0.020 . 1 . . . A 9 ALA HA . 17509 1 93 . 1 1 9 9 ALA HB1 H 1 1.345 0.020 . 1 . . . A 9 ALA HB1 . 17509 1 94 . 1 1 9 9 ALA HB2 H 1 1.345 0.020 . 1 . . . A 9 ALA HB2 . 17509 1 95 . 1 1 9 9 ALA HB3 H 1 1.345 0.020 . 1 . . . A 9 ALA HB3 . 17509 1 96 . 1 1 9 9 ALA CA C 13 52.460 0.400 . 1 . . . A 9 ALA CA . 17509 1 97 . 1 1 9 9 ALA CB C 13 19.138 0.400 . 1 . . . A 9 ALA CB . 17509 1 98 . 1 1 9 9 ALA N N 15 124.958 0.400 . 1 . . . A 9 ALA N . 17509 1 99 . 1 1 10 10 VAL H H 1 8.024 0.020 . 1 . . . A 10 VAL H . 17509 1 100 . 1 1 10 10 VAL HA H 1 4.057 0.020 . 1 . . . A 10 VAL HA . 17509 1 101 . 1 1 10 10 VAL HB H 1 2.008 0.020 . 1 . . . A 10 VAL HB . 17509 1 102 . 1 1 10 10 VAL HG11 H 1 0.897 0.020 . 2 . . . A 10 VAL HG11 . 17509 1 103 . 1 1 10 10 VAL HG12 H 1 0.897 0.020 . 2 . . . A 10 VAL HG12 . 17509 1 104 . 1 1 10 10 VAL HG13 H 1 0.897 0.020 . 2 . . . A 10 VAL HG13 . 17509 1 105 . 1 1 10 10 VAL HG21 H 1 0.895 0.020 . 2 . . . A 10 VAL HG21 . 17509 1 106 . 1 1 10 10 VAL HG22 H 1 0.895 0.020 . 2 . . . A 10 VAL HG22 . 17509 1 107 . 1 1 10 10 VAL HG23 H 1 0.895 0.020 . 2 . . . A 10 VAL HG23 . 17509 1 108 . 1 1 10 10 VAL CA C 13 61.852 0.400 . 1 . . . A 10 VAL CA . 17509 1 109 . 1 1 10 10 VAL CB C 13 32.886 0.400 . 1 . . . A 10 VAL CB . 17509 1 110 . 1 1 10 10 VAL CG1 C 13 20.342 0.400 . 2 . . . A 10 VAL CG1 . 17509 1 111 . 1 1 10 10 VAL CG2 C 13 20.788 0.400 . 2 . . . A 10 VAL CG2 . 17509 1 112 . 1 1 10 10 VAL N N 15 119.599 0.400 . 1 . . . A 10 VAL N . 17509 1 113 . 1 1 11 11 ALA H H 1 8.376 0.020 . 1 . . . A 11 ALA H . 17509 1 114 . 1 1 11 11 ALA HA H 1 4.574 0.020 . 1 . . . A 11 ALA HA . 17509 1 115 . 1 1 11 11 ALA HB1 H 1 1.333 0.020 . 1 . . . A 11 ALA HB1 . 17509 1 116 . 1 1 11 11 ALA HB2 H 1 1.333 0.020 . 1 . . . A 11 ALA HB2 . 17509 1 117 . 1 1 11 11 ALA HB3 H 1 1.333 0.020 . 1 . . . A 11 ALA HB3 . 17509 1 118 . 1 1 11 11 ALA CA C 13 50.276 0.400 . 1 . . . A 11 ALA CA . 17509 1 119 . 1 1 11 11 ALA CB C 13 18.350 0.400 . 1 . . . A 11 ALA CB . 17509 1 120 . 1 1 11 11 ALA N N 15 129.545 0.400 . 1 . . . A 11 ALA N . 17509 1 121 . 1 1 12 12 PRO HA H 1 4.374 0.020 . 1 . . . A 12 PRO HA . 17509 1 122 . 1 1 12 12 PRO HB2 H 1 2.237 0.020 . 2 . . . A 12 PRO HB2 . 17509 1 123 . 1 1 12 12 PRO HB3 H 1 1.838 0.020 . 2 . . . A 12 PRO HB3 . 17509 1 124 . 1 1 12 12 PRO HG2 H 1 1.974 0.020 . 2 . . . A 12 PRO HG2 . 17509 1 125 . 1 1 12 12 PRO HG3 H 1 1.974 0.020 . 2 . . . A 12 PRO HG3 . 17509 1 126 . 1 1 12 12 PRO HD2 H 1 3.775 0.020 . 2 . . . A 12 PRO HD2 . 17509 1 127 . 1 1 12 12 PRO HD3 H 1 3.617 0.020 . 2 . . . A 12 PRO HD3 . 17509 1 128 . 1 1 12 12 PRO CA C 13 62.798 0.400 . 1 . . . A 12 PRO CA . 17509 1 129 . 1 1 12 12 PRO CB C 13 32.072 0.400 . 1 . . . A 12 PRO CB . 17509 1 130 . 1 1 12 12 PRO CG C 13 27.400 0.400 . 1 . . . A 12 PRO CG . 17509 1 131 . 1 1 12 12 PRO CD C 13 50.489 0.400 . 1 . . . A 12 PRO CD . 17509 1 132 . 1 1 13 13 ASP H H 1 8.388 0.020 . 1 . . . A 13 ASP H . 17509 1 133 . 1 1 13 13 ASP HA H 1 4.806 0.020 . 1 . . . A 13 ASP HA . 17509 1 134 . 1 1 13 13 ASP HB2 H 1 2.728 0.020 . 2 . . . A 13 ASP HB2 . 17509 1 135 . 1 1 13 13 ASP HB3 H 1 2.539 0.020 . 2 . . . A 13 ASP HB3 . 17509 1 136 . 1 1 13 13 ASP CA C 13 52.102 0.400 . 1 . . . A 13 ASP CA . 17509 1 137 . 1 1 13 13 ASP CB C 13 41.634 0.400 . 1 . . . A 13 ASP CB . 17509 1 138 . 1 1 13 13 ASP N N 15 122.674 0.400 . 1 . . . A 13 ASP N . 17509 1 139 . 1 1 14 14 PRO HA H 1 4.320 0.020 . 1 . . . A 14 PRO HA . 17509 1 140 . 1 1 14 14 PRO HB2 H 1 2.086 0.020 . 2 . . . A 14 PRO HB2 . 17509 1 141 . 1 1 14 14 PRO HB3 H 1 1.586 0.020 . 2 . . . A 14 PRO HB3 . 17509 1 142 . 1 1 14 14 PRO HG2 H 1 1.798 0.020 . 2 . . . A 14 PRO HG2 . 17509 1 143 . 1 1 14 14 PRO HG3 H 1 1.913 0.020 . 2 . . . A 14 PRO HG3 . 17509 1 144 . 1 1 14 14 PRO HD2 H 1 3.834 0.020 . 2 . . . A 14 PRO HD2 . 17509 1 145 . 1 1 14 14 PRO HD3 H 1 3.834 0.020 . 2 . . . A 14 PRO HD3 . 17509 1 146 . 1 1 14 14 PRO CA C 13 63.486 0.400 . 1 . . . A 14 PRO CA . 17509 1 147 . 1 1 14 14 PRO CB C 13 32.293 0.400 . 1 . . . A 14 PRO CB . 17509 1 148 . 1 1 14 14 PRO CG C 13 27.067 0.400 . 1 . . . A 14 PRO CG . 17509 1 149 . 1 1 14 14 PRO CD C 13 50.816 0.400 . 1 . . . A 14 PRO CD . 17509 1 150 . 1 1 15 15 PHE H H 1 8.331 0.020 . 1 . . . A 15 PHE H . 17509 1 151 . 1 1 15 15 PHE HA H 1 4.142 0.020 . 1 . . . A 15 PHE HA . 17509 1 152 . 1 1 15 15 PHE HB2 H 1 2.949 0.020 . 2 . . . A 15 PHE HB2 . 17509 1 153 . 1 1 15 15 PHE HB3 H 1 2.578 0.020 . 2 . . . A 15 PHE HB3 . 17509 1 154 . 1 1 15 15 PHE HD1 H 1 7.067 0.020 . 3 . . . A 15 PHE HD1 . 17509 1 155 . 1 1 15 15 PHE HD2 H 1 7.067 0.020 . 3 . . . A 15 PHE HD2 . 17509 1 156 . 1 1 15 15 PHE HE1 H 1 7.073 0.020 . 3 . . . A 15 PHE HE1 . 17509 1 157 . 1 1 15 15 PHE HE2 H 1 7.073 0.020 . 3 . . . A 15 PHE HE2 . 17509 1 158 . 1 1 15 15 PHE HZ H 1 7.160 0.020 . 1 . . . A 15 PHE HZ . 17509 1 159 . 1 1 15 15 PHE CA C 13 57.964 0.400 . 1 . . . A 15 PHE CA . 17509 1 160 . 1 1 15 15 PHE CB C 13 38.314 0.400 . 1 . . . A 15 PHE CB . 17509 1 161 . 1 1 15 15 PHE CD1 C 13 131.892 0.400 . 3 . . . A 15 PHE CD1 . 17509 1 162 . 1 1 15 15 PHE CD2 C 13 131.892 0.400 . 3 . . . A 15 PHE CD2 . 17509 1 163 . 1 1 15 15 PHE CE1 C 13 131.512 0.400 . 3 . . . A 15 PHE CE1 . 17509 1 164 . 1 1 15 15 PHE CE2 C 13 131.512 0.400 . 3 . . . A 15 PHE CE2 . 17509 1 165 . 1 1 15 15 PHE CZ C 13 129.555 0.400 . 1 . . . A 15 PHE CZ . 17509 1 166 . 1 1 15 15 PHE N N 15 117.488 0.400 . 1 . . . A 15 PHE N . 17509 1 167 . 1 1 16 16 ASN H H 1 7.906 0.020 . 1 . . . A 16 ASN H . 17509 1 168 . 1 1 16 16 ASN HA H 1 5.006 0.020 . 1 . . . A 16 ASN HA . 17509 1 169 . 1 1 16 16 ASN HB2 H 1 3.023 0.020 . 2 . . . A 16 ASN HB2 . 17509 1 170 . 1 1 16 16 ASN HB3 H 1 2.850 0.020 . 2 . . . A 16 ASN HB3 . 17509 1 171 . 1 1 16 16 ASN HD21 H 1 7.822 0.020 . 2 . . . A 16 ASN HD21 . 17509 1 172 . 1 1 16 16 ASN HD22 H 1 7.139 0.020 . 2 . . . A 16 ASN HD22 . 17509 1 173 . 1 1 16 16 ASN CA C 13 51.251 0.400 . 1 . . . A 16 ASN CA . 17509 1 174 . 1 1 16 16 ASN CB C 13 39.973 0.400 . 1 . . . A 16 ASN CB . 17509 1 175 . 1 1 16 16 ASN N N 15 123.753 0.400 . 1 . . . A 16 ASN N . 17509 1 176 . 1 1 16 16 ASN ND2 N 15 112.922 0.400 . 1 . . . A 16 ASN ND2 . 17509 1 177 . 1 1 17 17 PRO HA H 1 4.817 0.020 . 1 . . . A 17 PRO HA . 17509 1 178 . 1 1 17 17 PRO HB2 H 1 2.454 0.020 . 2 . . . A 17 PRO HB2 . 17509 1 179 . 1 1 17 17 PRO HB3 H 1 2.050 0.020 . 2 . . . A 17 PRO HB3 . 17509 1 180 . 1 1 17 17 PRO HG2 H 1 2.096 0.020 . 2 . . . A 17 PRO HG2 . 17509 1 181 . 1 1 17 17 PRO HG3 H 1 2.152 0.020 . 2 . . . A 17 PRO HG3 . 17509 1 182 . 1 1 17 17 PRO HD2 H 1 4.055 0.020 . 2 . . . A 17 PRO HD2 . 17509 1 183 . 1 1 17 17 PRO HD3 H 1 3.909 0.020 . 2 . . . A 17 PRO HD3 . 17509 1 184 . 1 1 17 17 PRO CA C 13 64.163 0.400 . 1 . . . A 17 PRO CA . 17509 1 185 . 1 1 17 17 PRO CB C 13 32.283 0.400 . 1 . . . A 17 PRO CB . 17509 1 186 . 1 1 17 17 PRO CG C 13 27.537 0.400 . 1 . . . A 17 PRO CG . 17509 1 187 . 1 1 17 17 PRO CD C 13 51.299 0.400 . 1 . . . A 17 PRO CD . 17509 1 188 . 1 1 18 18 ALA H H 1 7.984 0.020 . 1 . . . A 18 ALA H . 17509 1 189 . 1 1 18 18 ALA HA H 1 4.156 0.020 . 1 . . . A 18 ALA HA . 17509 1 190 . 1 1 18 18 ALA HB1 H 1 1.326 0.020 . 1 . . . A 18 ALA HB1 . 17509 1 191 . 1 1 18 18 ALA HB2 H 1 1.326 0.020 . 1 . . . A 18 ALA HB2 . 17509 1 192 . 1 1 18 18 ALA HB3 H 1 1.326 0.020 . 1 . . . A 18 ALA HB3 . 17509 1 193 . 1 1 18 18 ALA CA C 13 53.868 0.400 . 1 . . . A 18 ALA CA . 17509 1 194 . 1 1 18 18 ALA CB C 13 18.607 0.400 . 1 . . . A 18 ALA CB . 17509 1 195 . 1 1 18 18 ALA N N 15 121.605 0.400 . 1 . . . A 18 ALA N . 17509 1 196 . 1 1 19 19 ALA H H 1 7.445 0.020 . 1 . . . A 19 ALA H . 17509 1 197 . 1 1 19 19 ALA HA H 1 4.275 0.020 . 1 . . . A 19 ALA HA . 17509 1 198 . 1 1 19 19 ALA HB1 H 1 1.536 0.020 . 1 . . . A 19 ALA HB1 . 17509 1 199 . 1 1 19 19 ALA HB2 H 1 1.536 0.020 . 1 . . . A 19 ALA HB2 . 17509 1 200 . 1 1 19 19 ALA HB3 H 1 1.536 0.020 . 1 . . . A 19 ALA HB3 . 17509 1 201 . 1 1 19 19 ALA CA C 13 52.971 0.400 . 1 . . . A 19 ALA CA . 17509 1 202 . 1 1 19 19 ALA CB C 13 19.601 0.400 . 1 . . . A 19 ALA CB . 17509 1 203 . 1 1 19 19 ALA N N 15 120.115 0.400 . 1 . . . A 19 ALA N . 17509 1 204 . 1 1 20 20 THR H H 1 7.917 0.020 . 1 . . . A 20 THR H . 17509 1 205 . 1 1 20 20 THR HA H 1 3.634 0.020 . 1 . . . A 20 THR HA . 17509 1 206 . 1 1 20 20 THR HB H 1 4.105 0.020 . 1 . . . A 20 THR HB . 17509 1 207 . 1 1 20 20 THR HG21 H 1 1.074 0.020 . 1 . . . A 20 THR HG21 . 17509 1 208 . 1 1 20 20 THR HG22 H 1 1.074 0.020 . 1 . . . A 20 THR HG22 . 17509 1 209 . 1 1 20 20 THR HG23 H 1 1.074 0.020 . 1 . . . A 20 THR HG23 . 17509 1 210 . 1 1 20 20 THR CA C 13 65.559 0.400 . 1 . . . A 20 THR CA . 17509 1 211 . 1 1 20 20 THR CB C 13 68.613 0.400 . 1 . . . A 20 THR CB . 17509 1 212 . 1 1 20 20 THR CG2 C 13 22.619 0.400 . 1 . . . A 20 THR CG2 . 17509 1 213 . 1 1 20 20 THR N N 15 115.390 0.400 . 1 . . . A 20 THR N . 17509 1 214 . 1 1 21 21 GLN H H 1 7.876 0.020 . 1 . . . A 21 GLN H . 17509 1 215 . 1 1 21 21 GLN HA H 1 4.067 0.020 . 1 . . . A 21 GLN HA . 17509 1 216 . 1 1 21 21 GLN HB2 H 1 2.176 0.020 . 2 . . . A 21 GLN HB2 . 17509 1 217 . 1 1 21 21 GLN HB3 H 1 2.027 0.020 . 2 . . . A 21 GLN HB3 . 17509 1 218 . 1 1 21 21 GLN HG2 H 1 2.274 0.020 . 2 . . . A 21 GLN HG2 . 17509 1 219 . 1 1 21 21 GLN HG3 H 1 2.395 0.020 . 2 . . . A 21 GLN HG3 . 17509 1 220 . 1 1 21 21 GLN HE21 H 1 7.545 0.020 . 2 . . . A 21 GLN HE21 . 17509 1 221 . 1 1 21 21 GLN HE22 H 1 6.799 0.020 . 2 . . . A 21 GLN HE22 . 17509 1 222 . 1 1 21 21 GLN CA C 13 57.597 0.400 . 1 . . . A 21 GLN CA . 17509 1 223 . 1 1 21 21 GLN CB C 13 28.749 0.400 . 1 . . . A 21 GLN CB . 17509 1 224 . 1 1 21 21 GLN CG C 13 34.174 0.400 . 1 . . . A 21 GLN CG . 17509 1 225 . 1 1 21 21 GLN N N 15 115.623 0.400 . 1 . . . A 21 GLN N . 17509 1 226 . 1 1 21 21 GLN NE2 N 15 111.239 0.400 . 1 . . . A 21 GLN NE2 . 17509 1 227 . 1 1 22 22 LEU H H 1 7.599 0.020 . 1 . . . A 22 LEU H . 17509 1 228 . 1 1 22 22 LEU HA H 1 4.436 0.020 . 1 . . . A 22 LEU HA . 17509 1 229 . 1 1 22 22 LEU HB2 H 1 1.850 0.020 . 2 . . . A 22 LEU HB2 . 17509 1 230 . 1 1 22 22 LEU HB3 H 1 1.743 0.020 . 2 . . . A 22 LEU HB3 . 17509 1 231 . 1 1 22 22 LEU HG H 1 1.588 0.020 . 1 . . . A 22 LEU HG . 17509 1 232 . 1 1 22 22 LEU HD11 H 1 0.956 0.020 . 2 . . . A 22 LEU HD11 . 17509 1 233 . 1 1 22 22 LEU HD12 H 1 0.956 0.020 . 2 . . . A 22 LEU HD12 . 17509 1 234 . 1 1 22 22 LEU HD13 H 1 0.956 0.020 . 2 . . . A 22 LEU HD13 . 17509 1 235 . 1 1 22 22 LEU HD21 H 1 0.856 0.020 . 2 . . . A 22 LEU HD21 . 17509 1 236 . 1 1 22 22 LEU HD22 H 1 0.856 0.020 . 2 . . . A 22 LEU HD22 . 17509 1 237 . 1 1 22 22 LEU HD23 H 1 0.856 0.020 . 2 . . . A 22 LEU HD23 . 17509 1 238 . 1 1 22 22 LEU CA C 13 55.033 0.400 . 1 . . . A 22 LEU CA . 17509 1 239 . 1 1 22 22 LEU CB C 13 41.574 0.400 . 1 . . . A 22 LEU CB . 17509 1 240 . 1 1 22 22 LEU CG C 13 27.233 0.400 . 1 . . . A 22 LEU CG . 17509 1 241 . 1 1 22 22 LEU CD1 C 13 25.546 0.400 . 2 . . . A 22 LEU CD1 . 17509 1 242 . 1 1 22 22 LEU CD2 C 13 22.572 0.400 . 2 . . . A 22 LEU CD2 . 17509 1 243 . 1 1 22 22 LEU N N 15 118.587 0.400 . 1 . . . A 22 LEU N . 17509 1 244 . 1 1 23 23 LEU H H 1 7.097 0.020 . 1 . . . A 23 LEU H . 17509 1 245 . 1 1 23 23 LEU HA H 1 4.354 0.020 . 1 . . . A 23 LEU HA . 17509 1 246 . 1 1 23 23 LEU HB2 H 1 1.726 0.020 . 2 . . . A 23 LEU HB2 . 17509 1 247 . 1 1 23 23 LEU HB3 H 1 1.413 0.020 . 2 . . . A 23 LEU HB3 . 17509 1 248 . 1 1 23 23 LEU HG H 1 1.602 0.020 . 1 . . . A 23 LEU HG . 17509 1 249 . 1 1 23 23 LEU HD11 H 1 0.797 0.020 . 2 . . . A 23 LEU HD11 . 17509 1 250 . 1 1 23 23 LEU HD12 H 1 0.797 0.020 . 2 . . . A 23 LEU HD12 . 17509 1 251 . 1 1 23 23 LEU HD13 H 1 0.797 0.020 . 2 . . . A 23 LEU HD13 . 17509 1 252 . 1 1 23 23 LEU HD21 H 1 0.582 0.020 . 2 . . . A 23 LEU HD21 . 17509 1 253 . 1 1 23 23 LEU HD22 H 1 0.582 0.020 . 2 . . . A 23 LEU HD22 . 17509 1 254 . 1 1 23 23 LEU HD23 H 1 0.582 0.020 . 2 . . . A 23 LEU HD23 . 17509 1 255 . 1 1 23 23 LEU CA C 13 55.335 0.400 . 1 . . . A 23 LEU CA . 17509 1 256 . 1 1 23 23 LEU CB C 13 43.586 0.400 . 1 . . . A 23 LEU CB . 17509 1 257 . 1 1 23 23 LEU CG C 13 27.209 0.400 . 1 . . . A 23 LEU CG . 17509 1 258 . 1 1 23 23 LEU CD1 C 13 24.532 0.400 . 2 . . . A 23 LEU CD1 . 17509 1 259 . 1 1 23 23 LEU CD2 C 13 26.282 0.400 . 2 . . . A 23 LEU CD2 . 17509 1 260 . 1 1 23 23 LEU N N 15 114.991 0.400 . 1 . . . A 23 LEU N . 17509 1 261 . 1 1 24 24 ASP H H 1 7.923 0.020 . 1 . . . A 24 ASP H . 17509 1 262 . 1 1 24 24 ASP HA H 1 4.302 0.020 . 1 . . . A 24 ASP HA . 17509 1 263 . 1 1 24 24 ASP HB2 H 1 2.573 0.020 . 2 . . . A 24 ASP HB2 . 17509 1 264 . 1 1 24 24 ASP HB3 H 1 2.573 0.020 . 2 . . . A 24 ASP HB3 . 17509 1 265 . 1 1 24 24 ASP CA C 13 56.774 0.400 . 1 . . . A 24 ASP CA . 17509 1 266 . 1 1 24 24 ASP CB C 13 41.000 0.400 . 1 . . . A 24 ASP CB . 17509 1 267 . 1 1 24 24 ASP N N 15 119.712 0.400 . 1 . . . A 24 ASP N . 17509 1 268 . 1 1 25 25 ASP H H 1 7.214 0.020 . 1 . . . A 25 ASP H . 17509 1 269 . 1 1 25 25 ASP HA H 1 5.017 0.020 . 1 . . . A 25 ASP HA . 17509 1 270 . 1 1 25 25 ASP HB2 H 1 2.902 0.020 . 2 . . . A 25 ASP HB2 . 17509 1 271 . 1 1 25 25 ASP HB3 H 1 2.637 0.020 . 2 . . . A 25 ASP HB3 . 17509 1 272 . 1 1 25 25 ASP CA C 13 56.529 0.400 . 1 . . . A 25 ASP CA . 17509 1 273 . 1 1 25 25 ASP CB C 13 38.632 0.400 . 1 . . . A 25 ASP CB . 17509 1 274 . 1 1 25 25 ASP N N 15 115.645 0.400 . 1 . . . A 25 ASP N . 17509 1 275 . 1 1 26 26 THR H H 1 8.144 0.020 . 1 . . . A 26 THR H . 17509 1 276 . 1 1 26 26 THR HA H 1 4.458 0.020 . 1 . . . A 26 THR HA . 17509 1 277 . 1 1 26 26 THR HB H 1 3.637 0.020 . 1 . . . A 26 THR HB . 17509 1 278 . 1 1 26 26 THR HG21 H 1 1.197 0.020 . 1 . . . A 26 THR HG21 . 17509 1 279 . 1 1 26 26 THR HG22 H 1 1.197 0.020 . 1 . . . A 26 THR HG22 . 17509 1 280 . 1 1 26 26 THR HG23 H 1 1.197 0.020 . 1 . . . A 26 THR HG23 . 17509 1 281 . 1 1 26 26 THR CA C 13 60.714 0.400 . 1 . . . A 26 THR CA . 17509 1 282 . 1 1 26 26 THR CB C 13 72.996 0.400 . 1 . . . A 26 THR CB . 17509 1 283 . 1 1 26 26 THR CG2 C 13 21.843 0.400 . 1 . . . A 26 THR CG2 . 17509 1 284 . 1 1 26 26 THR N N 15 107.808 0.400 . 1 . . . A 26 THR N . 17509 1 285 . 1 1 27 27 SER H H 1 7.259 0.020 . 1 . . . A 27 SER H . 17509 1 286 . 1 1 27 27 SER HA H 1 5.352 0.020 . 1 . . . A 27 SER HA . 17509 1 287 . 1 1 27 27 SER HB2 H 1 3.725 0.020 . 2 . . . A 27 SER HB2 . 17509 1 288 . 1 1 27 27 SER HB3 H 1 3.633 0.020 . 2 . . . A 27 SER HB3 . 17509 1 289 . 1 1 27 27 SER CA C 13 57.939 0.400 . 1 . . . A 27 SER CA . 17509 1 290 . 1 1 27 27 SER CB C 13 65.414 0.400 . 1 . . . A 27 SER CB . 17509 1 291 . 1 1 27 27 SER N N 15 113.697 0.400 . 1 . . . A 27 SER N . 17509 1 292 . 1 1 28 28 TRP H H 1 9.087 0.020 . 1 . . . A 28 TRP H . 17509 1 293 . 1 1 28 28 TRP HA H 1 5.379 0.020 . 1 . . . A 28 TRP HA . 17509 1 294 . 1 1 28 28 TRP HB2 H 1 2.900 0.020 . 2 . . . A 28 TRP HB2 . 17509 1 295 . 1 1 28 28 TRP HB3 H 1 3.533 0.020 . 2 . . . A 28 TRP HB3 . 17509 1 296 . 1 1 28 28 TRP HD1 H 1 6.697 0.020 . 1 . . . A 28 TRP HD1 . 17509 1 297 . 1 1 28 28 TRP HE1 H 1 10.959 0.020 . 1 . . . A 28 TRP HE1 . 17509 1 298 . 1 1 28 28 TRP HE3 H 1 7.206 0.020 . 1 . . . A 28 TRP HE3 . 17509 1 299 . 1 1 28 28 TRP HZ2 H 1 7.166 0.020 . 1 . . . A 28 TRP HZ2 . 17509 1 300 . 1 1 28 28 TRP HZ3 H 1 6.726 0.020 . 1 . . . A 28 TRP HZ3 . 17509 1 301 . 1 1 28 28 TRP HH2 H 1 6.819 0.020 . 1 . . . A 28 TRP HH2 . 17509 1 302 . 1 1 28 28 TRP CA C 13 57.555 0.400 . 1 . . . A 28 TRP CA . 17509 1 303 . 1 1 28 28 TRP CB C 13 35.091 0.400 . 1 . . . A 28 TRP CB . 17509 1 304 . 1 1 28 28 TRP CD1 C 13 127.366 0.400 . 1 . . . A 28 TRP CD1 . 17509 1 305 . 1 1 28 28 TRP CE3 C 13 119.862 0.400 . 1 . . . A 28 TRP CE3 . 17509 1 306 . 1 1 28 28 TRP CZ2 C 13 114.165 0.400 . 1 . . . A 28 TRP CZ2 . 17509 1 307 . 1 1 28 28 TRP CZ3 C 13 121.512 0.400 . 1 . . . A 28 TRP CZ3 . 17509 1 308 . 1 1 28 28 TRP CH2 C 13 123.046 0.400 . 1 . . . A 28 TRP CH2 . 17509 1 309 . 1 1 28 28 TRP N N 15 123.162 0.400 . 1 . . . A 28 TRP N . 17509 1 310 . 1 1 28 28 TRP NE1 N 15 129.695 0.400 . 1 . . . A 28 TRP NE1 . 17509 1 311 . 1 1 29 29 VAL H H 1 9.835 0.020 . 1 . . . A 29 VAL H . 17509 1 312 . 1 1 29 29 VAL HA H 1 5.105 0.020 . 1 . . . A 29 VAL HA . 17509 1 313 . 1 1 29 29 VAL HB H 1 2.077 0.020 . 1 . . . A 29 VAL HB . 17509 1 314 . 1 1 29 29 VAL HG11 H 1 1.308 0.020 . 2 . . . A 29 VAL HG11 . 17509 1 315 . 1 1 29 29 VAL HG12 H 1 1.308 0.020 . 2 . . . A 29 VAL HG12 . 17509 1 316 . 1 1 29 29 VAL HG13 H 1 1.308 0.020 . 2 . . . A 29 VAL HG13 . 17509 1 317 . 1 1 29 29 VAL HG21 H 1 1.021 0.020 . 2 . . . A 29 VAL HG21 . 17509 1 318 . 1 1 29 29 VAL HG22 H 1 1.021 0.020 . 2 . . . A 29 VAL HG22 . 17509 1 319 . 1 1 29 29 VAL HG23 H 1 1.021 0.020 . 2 . . . A 29 VAL HG23 . 17509 1 320 . 1 1 29 29 VAL CA C 13 60.418 0.400 . 1 . . . A 29 VAL CA . 17509 1 321 . 1 1 29 29 VAL CB C 13 35.559 0.400 . 1 . . . A 29 VAL CB . 17509 1 322 . 1 1 29 29 VAL CG1 C 13 22.428 0.400 . 2 . . . A 29 VAL CG1 . 17509 1 323 . 1 1 29 29 VAL CG2 C 13 21.474 0.400 . 2 . . . A 29 VAL CG2 . 17509 1 324 . 1 1 29 29 VAL N N 15 122.822 0.400 . 1 . . . A 29 VAL N . 17509 1 325 . 1 1 30 30 LEU H H 1 8.999 0.020 . 1 . . . A 30 LEU H . 17509 1 326 . 1 1 30 30 LEU HA H 1 3.690 0.020 . 1 . . . A 30 LEU HA . 17509 1 327 . 1 1 30 30 LEU HB2 H 1 1.814 0.020 . 2 . . . A 30 LEU HB2 . 17509 1 328 . 1 1 30 30 LEU HB3 H 1 0.774 0.020 . 2 . . . A 30 LEU HB3 . 17509 1 329 . 1 1 30 30 LEU HG H 1 1.169 0.020 . 1 . . . A 30 LEU HG . 17509 1 330 . 1 1 30 30 LEU HD11 H 1 0.122 0.020 . 2 . . . A 30 LEU HD11 . 17509 1 331 . 1 1 30 30 LEU HD12 H 1 0.122 0.020 . 2 . . . A 30 LEU HD12 . 17509 1 332 . 1 1 30 30 LEU HD13 H 1 0.122 0.020 . 2 . . . A 30 LEU HD13 . 17509 1 333 . 1 1 30 30 LEU HD21 H 1 0.827 0.020 . 2 . . . A 30 LEU HD21 . 17509 1 334 . 1 1 30 30 LEU HD22 H 1 0.827 0.020 . 2 . . . A 30 LEU HD22 . 17509 1 335 . 1 1 30 30 LEU HD23 H 1 0.827 0.020 . 2 . . . A 30 LEU HD23 . 17509 1 336 . 1 1 30 30 LEU CA C 13 56.586 0.400 . 1 . . . A 30 LEU CA . 17509 1 337 . 1 1 30 30 LEU CB C 13 40.539 0.400 . 1 . . . A 30 LEU CB . 17509 1 338 . 1 1 30 30 LEU CG C 13 27.069 0.400 . 1 . . . A 30 LEU CG . 17509 1 339 . 1 1 30 30 LEU CD1 C 13 22.377 0.400 . 2 . . . A 30 LEU CD1 . 17509 1 340 . 1 1 30 30 LEU CD2 C 13 26.837 0.400 . 2 . . . A 30 LEU CD2 . 17509 1 341 . 1 1 30 30 LEU N N 15 129.515 0.400 . 1 . . . A 30 LEU N . 17509 1 342 . 1 1 31 31 SER H H 1 9.476 0.020 . 1 . . . A 31 SER H . 17509 1 343 . 1 1 31 31 SER HA H 1 4.720 0.020 . 1 . . . A 31 SER HA . 17509 1 344 . 1 1 31 31 SER HB2 H 1 3.886 0.020 . 2 . . . A 31 SER HB2 . 17509 1 345 . 1 1 31 31 SER HB3 H 1 3.671 0.020 . 2 . . . A 31 SER HB3 . 17509 1 346 . 1 1 31 31 SER CA C 13 58.030 0.400 . 1 . . . A 31 SER CA . 17509 1 347 . 1 1 31 31 SER CB C 13 65.870 0.400 . 1 . . . A 31 SER CB . 17509 1 348 . 1 1 31 31 SER N N 15 124.371 0.400 . 1 . . . A 31 SER N . 17509 1 349 . 1 1 32 32 ALA H H 1 8.085 0.020 . 1 . . . A 32 ALA H . 17509 1 350 . 1 1 32 32 ALA HA H 1 4.595 0.020 . 1 . . . A 32 ALA HA . 17509 1 351 . 1 1 32 32 ALA HB1 H 1 1.421 0.020 . 1 . . . A 32 ALA HB1 . 17509 1 352 . 1 1 32 32 ALA HB2 H 1 1.421 0.020 . 1 . . . A 32 ALA HB2 . 17509 1 353 . 1 1 32 32 ALA HB3 H 1 1.421 0.020 . 1 . . . A 32 ALA HB3 . 17509 1 354 . 1 1 32 32 ALA CA C 13 52.650 0.400 . 1 . . . A 32 ALA CA . 17509 1 355 . 1 1 32 32 ALA CB C 13 22.634 0.400 . 1 . . . A 32 ALA CB . 17509 1 356 . 1 1 32 32 ALA N N 15 122.773 0.400 . 1 . . . A 32 ALA N . 17509 1 357 . 1 1 33 33 TRP H H 1 9.243 0.020 . 1 . . . A 33 TRP H . 17509 1 358 . 1 1 33 33 TRP HA H 1 5.280 0.020 . 1 . . . A 33 TRP HA . 17509 1 359 . 1 1 33 33 TRP HB2 H 1 3.275 0.020 . 2 . . . A 33 TRP HB2 . 17509 1 360 . 1 1 33 33 TRP HB3 H 1 2.826 0.020 . 2 . . . A 33 TRP HB3 . 17509 1 361 . 1 1 33 33 TRP HD1 H 1 6.683 0.020 . 1 . . . A 33 TRP HD1 . 17509 1 362 . 1 1 33 33 TRP HE1 H 1 11.187 0.020 . 1 . . . A 33 TRP HE1 . 17509 1 363 . 1 1 33 33 TRP HE3 H 1 7.227 0.020 . 1 . . . A 33 TRP HE3 . 17509 1 364 . 1 1 33 33 TRP HZ2 H 1 7.340 0.020 . 1 . . . A 33 TRP HZ2 . 17509 1 365 . 1 1 33 33 TRP HZ3 H 1 6.820 0.020 . 1 . . . A 33 TRP HZ3 . 17509 1 366 . 1 1 33 33 TRP HH2 H 1 6.826 0.020 . 1 . . . A 33 TRP HH2 . 17509 1 367 . 1 1 33 33 TRP CA C 13 55.357 0.400 . 1 . . . A 33 TRP CA . 17509 1 368 . 1 1 33 33 TRP CB C 13 31.426 0.400 . 1 . . . A 33 TRP CB . 17509 1 369 . 1 1 33 33 TRP CD1 C 13 122.477 0.400 . 1 . . . A 33 TRP CD1 . 17509 1 370 . 1 1 33 33 TRP CE3 C 13 120.083 0.400 . 1 . . . A 33 TRP CE3 . 17509 1 371 . 1 1 33 33 TRP CZ2 C 13 113.963 0.400 . 1 . . . A 33 TRP CZ2 . 17509 1 372 . 1 1 33 33 TRP CZ3 C 13 120.159 0.400 . 1 . . . A 33 TRP CZ3 . 17509 1 373 . 1 1 33 33 TRP CH2 C 13 124.003 0.400 . 1 . . . A 33 TRP CH2 . 17509 1 374 . 1 1 33 33 TRP N N 15 124.280 0.400 . 1 . . . A 33 TRP N . 17509 1 375 . 1 1 33 33 TRP NE1 N 15 130.427 0.400 . 1 . . . A 33 TRP NE1 . 17509 1 376 . 1 1 34 34 LYS H H 1 9.329 0.020 . 1 . . . A 34 LYS H . 17509 1 377 . 1 1 34 34 LYS HA H 1 5.015 0.020 . 1 . . . A 34 LYS HA . 17509 1 378 . 1 1 34 34 LYS HB2 H 1 1.844 0.020 . 2 . . . A 34 LYS HB2 . 17509 1 379 . 1 1 34 34 LYS HB3 H 1 1.742 0.020 . 2 . . . A 34 LYS HB3 . 17509 1 380 . 1 1 34 34 LYS HG2 H 1 1.471 0.020 . 2 . . . A 34 LYS HG2 . 17509 1 381 . 1 1 34 34 LYS HG3 H 1 1.371 0.020 . 2 . . . A 34 LYS HG3 . 17509 1 382 . 1 1 34 34 LYS HD2 H 1 1.656 0.020 . 2 . . . A 34 LYS HD2 . 17509 1 383 . 1 1 34 34 LYS HD3 H 1 1.656 0.020 . 2 . . . A 34 LYS HD3 . 17509 1 384 . 1 1 34 34 LYS HE2 H 1 2.954 0.020 . 2 . . . A 34 LYS HE2 . 17509 1 385 . 1 1 34 34 LYS HE3 H 1 2.954 0.020 . 2 . . . A 34 LYS HE3 . 17509 1 386 . 1 1 34 34 LYS CA C 13 54.581 0.400 . 1 . . . A 34 LYS CA . 17509 1 387 . 1 1 34 34 LYS CB C 13 35.181 0.400 . 1 . . . A 34 LYS CB . 17509 1 388 . 1 1 34 34 LYS CG C 13 24.577 0.400 . 1 . . . A 34 LYS CG . 17509 1 389 . 1 1 34 34 LYS CD C 13 29.316 0.400 . 1 . . . A 34 LYS CD . 17509 1 390 . 1 1 34 34 LYS CE C 13 41.987 0.400 . 1 . . . A 34 LYS CE . 17509 1 391 . 1 1 34 34 LYS N N 15 126.962 0.400 . 1 . . . A 34 LYS N . 17509 1 392 . 1 1 35 35 GLN H H 1 9.092 0.020 . 1 . . . A 35 GLN H . 17509 1 393 . 1 1 35 35 GLN HA H 1 4.710 0.020 . 1 . . . A 35 GLN HA . 17509 1 394 . 1 1 35 35 GLN HB2 H 1 2.266 0.020 . 2 . . . A 35 GLN HB2 . 17509 1 395 . 1 1 35 35 GLN HB3 H 1 2.266 0.020 . 2 . . . A 35 GLN HB3 . 17509 1 396 . 1 1 35 35 GLN HG2 H 1 2.220 0.020 . 2 . . . A 35 GLN HG2 . 17509 1 397 . 1 1 35 35 GLN HG3 H 1 2.220 0.020 . 2 . . . A 35 GLN HG3 . 17509 1 398 . 1 1 35 35 GLN HE21 H 1 7.246 0.020 . 2 . . . A 35 GLN HE21 . 17509 1 399 . 1 1 35 35 GLN HE22 H 1 6.716 0.020 . 2 . . . A 35 GLN HE22 . 17509 1 400 . 1 1 35 35 GLN CA C 13 55.519 0.400 . 1 . . . A 35 GLN CA . 17509 1 401 . 1 1 35 35 GLN CB C 13 30.406 0.400 . 1 . . . A 35 GLN CB . 17509 1 402 . 1 1 35 35 GLN CG C 13 36.059 0.400 . 1 . . . A 35 GLN CG . 17509 1 403 . 1 1 35 35 GLN N N 15 123.210 0.400 . 1 . . . A 35 GLN N . 17509 1 404 . 1 1 35 35 GLN NE2 N 15 111.573 0.400 . 1 . . . A 35 GLN NE2 . 17509 1 405 . 1 1 36 36 ALA H H 1 8.761 0.020 . 1 . . . A 36 ALA H . 17509 1 406 . 1 1 36 36 ALA HA H 1 3.967 0.020 . 1 . . . A 36 ALA HA . 17509 1 407 . 1 1 36 36 ALA HB1 H 1 1.506 0.020 . 1 . . . A 36 ALA HB1 . 17509 1 408 . 1 1 36 36 ALA HB2 H 1 1.506 0.020 . 1 . . . A 36 ALA HB2 . 17509 1 409 . 1 1 36 36 ALA HB3 H 1 1.506 0.020 . 1 . . . A 36 ALA HB3 . 17509 1 410 . 1 1 36 36 ALA CA C 13 55.344 0.400 . 1 . . . A 36 ALA CA . 17509 1 411 . 1 1 36 36 ALA CB C 13 18.479 0.400 . 1 . . . A 36 ALA CB . 17509 1 412 . 1 1 36 36 ALA N N 15 125.273 0.400 . 1 . . . A 36 ALA N . 17509 1 413 . 1 1 37 37 ASP H H 1 7.826 0.020 . 1 . . . A 37 ASP H . 17509 1 414 . 1 1 37 37 ASP HA H 1 4.422 0.020 . 1 . . . A 37 ASP HA . 17509 1 415 . 1 1 37 37 ASP HB2 H 1 3.054 0.020 . 2 . . . A 37 ASP HB2 . 17509 1 416 . 1 1 37 37 ASP HB3 H 1 2.580 0.020 . 2 . . . A 37 ASP HB3 . 17509 1 417 . 1 1 37 37 ASP CA C 13 53.570 0.400 . 1 . . . A 37 ASP CA . 17509 1 418 . 1 1 37 37 ASP CB C 13 39.666 0.400 . 1 . . . A 37 ASP CB . 17509 1 419 . 1 1 37 37 ASP N N 15 113.998 0.400 . 1 . . . A 37 ASP N . 17509 1 420 . 1 1 38 38 GLY H H 1 8.343 0.020 . 1 . . . A 38 GLY H . 17509 1 421 . 1 1 38 38 GLY HA2 H 1 3.541 0.020 . 2 . . . A 38 GLY HA2 . 17509 1 422 . 1 1 38 38 GLY HA3 H 1 4.413 0.020 . 2 . . . A 38 GLY HA3 . 17509 1 423 . 1 1 38 38 GLY CA C 13 45.028 0.400 . 1 . . . A 38 GLY CA . 17509 1 424 . 1 1 38 38 GLY N N 15 108.553 0.400 . 1 . . . A 38 GLY N . 17509 1 425 . 1 1 39 39 THR H H 1 8.067 0.020 . 1 . . . A 39 THR H . 17509 1 426 . 1 1 39 39 THR HA H 1 4.123 0.020 . 1 . . . A 39 THR HA . 17509 1 427 . 1 1 39 39 THR HB H 1 4.078 0.020 . 1 . . . A 39 THR HB . 17509 1 428 . 1 1 39 39 THR HG21 H 1 1.109 0.020 . 1 . . . A 39 THR HG21 . 17509 1 429 . 1 1 39 39 THR HG22 H 1 1.109 0.020 . 1 . . . A 39 THR HG22 . 17509 1 430 . 1 1 39 39 THR HG23 H 1 1.109 0.020 . 1 . . . A 39 THR HG23 . 17509 1 431 . 1 1 39 39 THR CA C 13 63.197 0.400 . 1 . . . A 39 THR CA . 17509 1 432 . 1 1 39 39 THR CB C 13 69.781 0.400 . 1 . . . A 39 THR CB . 17509 1 433 . 1 1 39 39 THR CG2 C 13 21.524 0.400 . 1 . . . A 39 THR CG2 . 17509 1 434 . 1 1 39 39 THR N N 15 116.670 0.400 . 1 . . . A 39 THR N . 17509 1 435 . 1 1 40 40 ALA H H 1 8.719 0.020 . 1 . . . A 40 ALA H . 17509 1 436 . 1 1 40 40 ALA HA H 1 4.817 0.020 . 1 . . . A 40 ALA HA . 17509 1 437 . 1 1 40 40 ALA HB1 H 1 1.409 0.020 . 1 . . . A 40 ALA HB1 . 17509 1 438 . 1 1 40 40 ALA HB2 H 1 1.409 0.020 . 1 . . . A 40 ALA HB2 . 17509 1 439 . 1 1 40 40 ALA HB3 H 1 1.409 0.020 . 1 . . . A 40 ALA HB3 . 17509 1 440 . 1 1 40 40 ALA CA C 13 51.986 0.400 . 1 . . . A 40 ALA CA . 17509 1 441 . 1 1 40 40 ALA CB C 13 20.111 0.400 . 1 . . . A 40 ALA CB . 17509 1 442 . 1 1 40 40 ALA N N 15 127.123 0.400 . 1 . . . A 40 ALA N . 17509 1 443 . 1 1 41 41 ARG H H 1 8.698 0.020 . 1 . . . A 41 ARG H . 17509 1 444 . 1 1 41 41 ARG HA H 1 4.257 0.020 . 1 . . . A 41 ARG HA . 17509 1 445 . 1 1 41 41 ARG HB2 H 1 1.113 0.020 . 2 . . . A 41 ARG HB2 . 17509 1 446 . 1 1 41 41 ARG HB3 H 1 1.019 0.020 . 2 . . . A 41 ARG HB3 . 17509 1 447 . 1 1 41 41 ARG HG2 H 1 0.957 0.020 . 2 . . . A 41 ARG HG2 . 17509 1 448 . 1 1 41 41 ARG HG3 H 1 0.868 0.020 . 2 . . . A 41 ARG HG3 . 17509 1 449 . 1 1 41 41 ARG HD2 H 1 1.471 0.020 . 2 . . . A 41 ARG HD2 . 17509 1 450 . 1 1 41 41 ARG HD3 H 1 1.656 0.020 . 2 . . . A 41 ARG HD3 . 17509 1 451 . 1 1 41 41 ARG HE H 1 6.475 0.020 . 1 . . . A 41 ARG HE . 17509 1 452 . 1 1 41 41 ARG HH11 H 1 6.323 0.020 . 2 . . . A 41 ARG HH11 . 17509 1 453 . 1 1 41 41 ARG HH12 H 1 6.323 0.020 . 2 . . . A 41 ARG HH12 . 17509 1 454 . 1 1 41 41 ARG CA C 13 54.734 0.400 . 1 . . . A 41 ARG CA . 17509 1 455 . 1 1 41 41 ARG CB C 13 31.042 0.400 . 1 . . . A 41 ARG CB . 17509 1 456 . 1 1 41 41 ARG CG C 13 27.030 0.400 . 1 . . . A 41 ARG CG . 17509 1 457 . 1 1 41 41 ARG CD C 13 42.099 0.400 . 1 . . . A 41 ARG CD . 17509 1 458 . 1 1 41 41 ARG N N 15 122.817 0.400 . 1 . . . A 41 ARG N . 17509 1 459 . 1 1 41 41 ARG NE N 15 83.582 0.400 . 1 . . . A 41 ARG NE . 17509 1 460 . 1 1 41 41 ARG NH1 N 15 71.003 0.400 . 2 . . . A 41 ARG NH1 . 17509 1 461 . 1 1 42 42 ALA H H 1 8.312 0.020 . 1 . . . A 42 ALA H . 17509 1 462 . 1 1 42 42 ALA HA H 1 4.274 0.020 . 1 . . . A 42 ALA HA . 17509 1 463 . 1 1 42 42 ALA HB1 H 1 1.238 0.020 . 1 . . . A 42 ALA HB1 . 17509 1 464 . 1 1 42 42 ALA HB2 H 1 1.238 0.020 . 1 . . . A 42 ALA HB2 . 17509 1 465 . 1 1 42 42 ALA HB3 H 1 1.238 0.020 . 1 . . . A 42 ALA HB3 . 17509 1 466 . 1 1 42 42 ALA CA C 13 52.721 0.400 . 1 . . . A 42 ALA CA . 17509 1 467 . 1 1 42 42 ALA CB C 13 18.341 0.400 . 1 . . . A 42 ALA CB . 17509 1 468 . 1 1 42 42 ALA N N 15 127.247 0.400 . 1 . . . A 42 ALA N . 17509 1 469 . 1 1 43 43 VAL H H 1 8.126 0.020 . 1 . . . A 43 VAL H . 17509 1 470 . 1 1 43 43 VAL HA H 1 4.652 0.020 . 1 . . . A 43 VAL HA . 17509 1 471 . 1 1 43 43 VAL HB H 1 2.104 0.020 . 1 . . . A 43 VAL HB . 17509 1 472 . 1 1 43 43 VAL HG11 H 1 0.686 0.020 . 2 . . . A 43 VAL HG11 . 17509 1 473 . 1 1 43 43 VAL HG12 H 1 0.686 0.020 . 2 . . . A 43 VAL HG12 . 17509 1 474 . 1 1 43 43 VAL HG13 H 1 0.686 0.020 . 2 . . . A 43 VAL HG13 . 17509 1 475 . 1 1 43 43 VAL HG21 H 1 0.943 0.020 . 2 . . . A 43 VAL HG21 . 17509 1 476 . 1 1 43 43 VAL HG22 H 1 0.943 0.020 . 2 . . . A 43 VAL HG22 . 17509 1 477 . 1 1 43 43 VAL HG23 H 1 0.943 0.020 . 2 . . . A 43 VAL HG23 . 17509 1 478 . 1 1 43 43 VAL CA C 13 57.786 0.400 . 1 . . . A 43 VAL CA . 17509 1 479 . 1 1 43 43 VAL CB C 13 32.332 0.400 . 1 . . . A 43 VAL CB . 17509 1 480 . 1 1 43 43 VAL CG1 C 13 19.227 0.400 . 2 . . . A 43 VAL CG1 . 17509 1 481 . 1 1 43 43 VAL CG2 C 13 22.480 0.400 . 2 . . . A 43 VAL CG2 . 17509 1 482 . 1 1 43 43 VAL N N 15 116.720 0.400 . 1 . . . A 43 VAL N . 17509 1 483 . 1 1 44 44 PRO HA H 1 4.373 0.020 . 1 . . . A 44 PRO HA . 17509 1 484 . 1 1 44 44 PRO HB2 H 1 2.235 0.020 . 2 . . . A 44 PRO HB2 . 17509 1 485 . 1 1 44 44 PRO HB3 H 1 1.972 0.020 . 2 . . . A 44 PRO HB3 . 17509 1 486 . 1 1 44 44 PRO HG2 H 1 2.101 0.020 . 2 . . . A 44 PRO HG2 . 17509 1 487 . 1 1 44 44 PRO HG3 H 1 1.856 0.020 . 2 . . . A 44 PRO HG3 . 17509 1 488 . 1 1 44 44 PRO HD2 H 1 3.704 0.020 . 2 . . . A 44 PRO HD2 . 17509 1 489 . 1 1 44 44 PRO HD3 H 1 3.617 0.020 . 2 . . . A 44 PRO HD3 . 17509 1 490 . 1 1 44 44 PRO CA C 13 62.847 0.400 . 1 . . . A 44 PRO CA . 17509 1 491 . 1 1 44 44 PRO CB C 13 32.166 0.400 . 1 . . . A 44 PRO CB . 17509 1 492 . 1 1 44 44 PRO CG C 13 28.219 0.400 . 1 . . . A 44 PRO CG . 17509 1 493 . 1 1 44 44 PRO CD C 13 50.356 0.400 . 1 . . . A 44 PRO CD . 17509 1 494 . 1 1 45 45 SER H H 1 8.417 0.020 . 1 . . . A 45 SER H . 17509 1 495 . 1 1 45 45 SER HA H 1 4.508 0.020 . 1 . . . A 45 SER HA . 17509 1 496 . 1 1 45 45 SER HB2 H 1 4.098 0.020 . 2 . . . A 45 SER HB2 . 17509 1 497 . 1 1 45 45 SER HB3 H 1 3.890 0.020 . 2 . . . A 45 SER HB3 . 17509 1 498 . 1 1 45 45 SER CA C 13 57.502 0.400 . 1 . . . A 45 SER CA . 17509 1 499 . 1 1 45 45 SER CB C 13 64.683 0.400 . 1 . . . A 45 SER CB . 17509 1 500 . 1 1 45 45 SER N N 15 118.021 0.400 . 1 . . . A 45 SER N . 17509 1 501 . 1 1 46 46 ALA H H 1 8.954 0.020 . 1 . . . A 46 ALA H . 17509 1 502 . 1 1 46 46 ALA HA H 1 4.094 0.020 . 1 . . . A 46 ALA HA . 17509 1 503 . 1 1 46 46 ALA HB1 H 1 1.466 0.020 . 1 . . . A 46 ALA HB1 . 17509 1 504 . 1 1 46 46 ALA HB2 H 1 1.466 0.020 . 1 . . . A 46 ALA HB2 . 17509 1 505 . 1 1 46 46 ALA HB3 H 1 1.466 0.020 . 1 . . . A 46 ALA HB3 . 17509 1 506 . 1 1 46 46 ALA CA C 13 54.566 0.400 . 1 . . . A 46 ALA CA . 17509 1 507 . 1 1 46 46 ALA CB C 13 18.198 0.400 . 1 . . . A 46 ALA CB . 17509 1 508 . 1 1 46 46 ALA N N 15 126.332 0.400 . 1 . . . A 46 ALA N . 17509 1 509 . 1 1 47 47 ASP H H 1 8.351 0.020 . 1 . . . A 47 ASP H . 17509 1 510 . 1 1 47 47 ASP HA H 1 4.437 0.020 . 1 . . . A 47 ASP HA . 17509 1 511 . 1 1 47 47 ASP HB2 H 1 2.664 0.020 . 2 . . . A 47 ASP HB2 . 17509 1 512 . 1 1 47 47 ASP HB3 H 1 2.664 0.020 . 2 . . . A 47 ASP HB3 . 17509 1 513 . 1 1 47 47 ASP CA C 13 55.549 0.400 . 1 . . . A 47 ASP CA . 17509 1 514 . 1 1 47 47 ASP CB C 13 40.349 0.400 . 1 . . . A 47 ASP CB . 17509 1 515 . 1 1 47 47 ASP N N 15 116.021 0.400 . 1 . . . A 47 ASP N . 17509 1 516 . 1 1 48 48 GLN H H 1 7.528 0.020 . 1 . . . A 48 GLN H . 17509 1 517 . 1 1 48 48 GLN HA H 1 4.409 0.020 . 1 . . . A 48 GLN HA . 17509 1 518 . 1 1 48 48 GLN HB2 H 1 2.310 0.020 . 2 . . . A 48 GLN HB2 . 17509 1 519 . 1 1 48 48 GLN HB3 H 1 2.020 0.020 . 2 . . . A 48 GLN HB3 . 17509 1 520 . 1 1 48 48 GLN HG2 H 1 2.345 0.020 . 2 . . . A 48 GLN HG2 . 17509 1 521 . 1 1 48 48 GLN HG3 H 1 2.345 0.020 . 2 . . . A 48 GLN HG3 . 17509 1 522 . 1 1 48 48 GLN HE21 H 1 6.822 0.020 . 2 . . . A 48 GLN HE21 . 17509 1 523 . 1 1 48 48 GLN HE22 H 1 7.561 0.020 . 2 . . . A 48 GLN HE22 . 17509 1 524 . 1 1 48 48 GLN CA C 13 55.794 0.400 . 1 . . . A 48 GLN CA . 17509 1 525 . 1 1 48 48 GLN CB C 13 29.494 0.400 . 1 . . . A 48 GLN CB . 17509 1 526 . 1 1 48 48 GLN CG C 13 34.412 0.400 . 1 . . . A 48 GLN CG . 17509 1 527 . 1 1 48 48 GLN N N 15 116.756 0.400 . 1 . . . A 48 GLN N . 17509 1 528 . 1 1 48 48 GLN NE2 N 15 112.794 0.400 . 1 . . . A 48 GLN NE2 . 17509 1 529 . 1 1 49 49 GLY H H 1 7.636 0.020 . 1 . . . A 49 GLY H . 17509 1 530 . 1 1 49 49 GLY HA2 H 1 3.749 0.020 . 2 . . . A 49 GLY HA2 . 17509 1 531 . 1 1 49 49 GLY HA3 H 1 4.131 0.020 . 2 . . . A 49 GLY HA3 . 17509 1 532 . 1 1 49 49 GLY CA C 13 45.784 0.400 . 1 . . . A 49 GLY CA . 17509 1 533 . 1 1 49 49 GLY N N 15 107.346 0.400 . 1 . . . A 49 GLY N . 17509 1 534 . 1 1 50 50 ALA H H 1 8.440 0.020 . 1 . . . A 50 ALA H . 17509 1 535 . 1 1 50 50 ALA HA H 1 4.595 0.020 . 1 . . . A 50 ALA HA . 17509 1 536 . 1 1 50 50 ALA HB1 H 1 1.109 0.020 . 1 . . . A 50 ALA HB1 . 17509 1 537 . 1 1 50 50 ALA HB2 H 1 1.109 0.020 . 1 . . . A 50 ALA HB2 . 17509 1 538 . 1 1 50 50 ALA HB3 H 1 1.109 0.020 . 1 . . . A 50 ALA HB3 . 17509 1 539 . 1 1 50 50 ALA CA C 13 50.118 0.400 . 1 . . . A 50 ALA CA . 17509 1 540 . 1 1 50 50 ALA CB C 13 19.158 0.400 . 1 . . . A 50 ALA CB . 17509 1 541 . 1 1 50 50 ALA N N 15 124.987 0.400 . 1 . . . A 50 ALA N . 17509 1 542 . 1 1 51 51 PRO HA H 1 4.391 0.020 . 1 . . . A 51 PRO HA . 17509 1 543 . 1 1 51 51 PRO HB2 H 1 2.081 0.020 . 2 . . . A 51 PRO HB2 . 17509 1 544 . 1 1 51 51 PRO HB3 H 1 1.924 0.020 . 2 . . . A 51 PRO HB3 . 17509 1 545 . 1 1 51 51 PRO HG2 H 1 1.906 0.020 . 2 . . . A 51 PRO HG2 . 17509 1 546 . 1 1 51 51 PRO HG3 H 1 1.768 0.020 . 2 . . . A 51 PRO HG3 . 17509 1 547 . 1 1 51 51 PRO HD2 H 1 3.474 0.020 . 2 . . . A 51 PRO HD2 . 17509 1 548 . 1 1 51 51 PRO HD3 H 1 3.573 0.020 . 2 . . . A 51 PRO HD3 . 17509 1 549 . 1 1 51 51 PRO CA C 13 62.373 0.400 . 1 . . . A 51 PRO CA . 17509 1 550 . 1 1 51 51 PRO CB C 13 32.321 0.400 . 1 . . . A 51 PRO CB . 17509 1 551 . 1 1 51 51 PRO CG C 13 26.948 0.400 . 1 . . . A 51 PRO CG . 17509 1 552 . 1 1 51 51 PRO CD C 13 50.185 0.400 . 1 . . . A 51 PRO CD . 17509 1 553 . 1 1 52 52 ILE H H 1 8.877 0.020 . 1 . . . A 52 ILE H . 17509 1 554 . 1 1 52 52 ILE HA H 1 4.375 0.020 . 1 . . . A 52 ILE HA . 17509 1 555 . 1 1 52 52 ILE HB H 1 1.563 0.020 . 1 . . . A 52 ILE HB . 17509 1 556 . 1 1 52 52 ILE HG12 H 1 1.441 0.020 . 2 . . . A 52 ILE HG12 . 17509 1 557 . 1 1 52 52 ILE HG13 H 1 0.471 0.020 . 2 . . . A 52 ILE HG13 . 17509 1 558 . 1 1 52 52 ILE HG21 H 1 0.178 0.020 . 1 . . . A 52 ILE HG21 . 17509 1 559 . 1 1 52 52 ILE HG22 H 1 0.178 0.020 . 1 . . . A 52 ILE HG22 . 17509 1 560 . 1 1 52 52 ILE HG23 H 1 0.178 0.020 . 1 . . . A 52 ILE HG23 . 17509 1 561 . 1 1 52 52 ILE HD11 H 1 0.467 0.020 . 1 . . . A 52 ILE HD11 . 17509 1 562 . 1 1 52 52 ILE HD12 H 1 0.467 0.020 . 1 . . . A 52 ILE HD12 . 17509 1 563 . 1 1 52 52 ILE HD13 H 1 0.467 0.020 . 1 . . . A 52 ILE HD13 . 17509 1 564 . 1 1 52 52 ILE CA C 13 62.338 0.400 . 1 . . . A 52 ILE CA . 17509 1 565 . 1 1 52 52 ILE CB C 13 37.098 0.400 . 1 . . . A 52 ILE CB . 17509 1 566 . 1 1 52 52 ILE CG1 C 13 29.174 0.400 . 1 . . . A 52 ILE CG1 . 17509 1 567 . 1 1 52 52 ILE CG2 C 13 15.616 0.400 . 1 . . . A 52 ILE CG2 . 17509 1 568 . 1 1 52 52 ILE CD1 C 13 13.589 0.400 . 1 . . . A 52 ILE CD1 . 17509 1 569 . 1 1 52 52 ILE N N 15 120.617 0.400 . 1 . . . A 52 ILE N . 17509 1 570 . 1 1 53 53 THR H H 1 8.975 0.020 . 1 . . . A 53 THR H . 17509 1 571 . 1 1 53 53 THR HA H 1 5.547 0.020 . 1 . . . A 53 THR HA . 17509 1 572 . 1 1 53 53 THR HB H 1 4.530 0.020 . 1 . . . A 53 THR HB . 17509 1 573 . 1 1 53 53 THR HG21 H 1 1.308 0.020 . 1 . . . A 53 THR HG21 . 17509 1 574 . 1 1 53 53 THR HG22 H 1 1.308 0.020 . 1 . . . A 53 THR HG22 . 17509 1 575 . 1 1 53 53 THR HG23 H 1 1.308 0.020 . 1 . . . A 53 THR HG23 . 17509 1 576 . 1 1 53 53 THR CA C 13 59.047 0.400 . 1 . . . A 53 THR CA . 17509 1 577 . 1 1 53 53 THR CB C 13 73.425 0.400 . 1 . . . A 53 THR CB . 17509 1 578 . 1 1 53 53 THR CG2 C 13 22.384 0.400 . 1 . . . A 53 THR CG2 . 17509 1 579 . 1 1 53 53 THR N N 15 115.731 0.400 . 1 . . . A 53 THR N . 17509 1 580 . 1 1 54 54 LEU H H 1 8.724 0.020 . 1 . . . A 54 LEU H . 17509 1 581 . 1 1 54 54 LEU HA H 1 4.895 0.020 . 1 . . . A 54 LEU HA . 17509 1 582 . 1 1 54 54 LEU HB2 H 1 1.592 0.020 . 2 . . . A 54 LEU HB2 . 17509 1 583 . 1 1 54 54 LEU HB3 H 1 1.538 0.020 . 2 . . . A 54 LEU HB3 . 17509 1 584 . 1 1 54 54 LEU HG H 1 1.304 0.020 . 1 . . . A 54 LEU HG . 17509 1 585 . 1 1 54 54 LEU HD11 H 1 1.070 0.020 . 2 . . . A 54 LEU HD11 . 17509 1 586 . 1 1 54 54 LEU HD12 H 1 1.070 0.020 . 2 . . . A 54 LEU HD12 . 17509 1 587 . 1 1 54 54 LEU HD13 H 1 1.070 0.020 . 2 . . . A 54 LEU HD13 . 17509 1 588 . 1 1 54 54 LEU HD21 H 1 0.326 0.020 . 2 . . . A 54 LEU HD21 . 17509 1 589 . 1 1 54 54 LEU HD22 H 1 0.326 0.020 . 2 . . . A 54 LEU HD22 . 17509 1 590 . 1 1 54 54 LEU HD23 H 1 0.326 0.020 . 2 . . . A 54 LEU HD23 . 17509 1 591 . 1 1 54 54 LEU CA C 13 55.755 0.400 . 1 . . . A 54 LEU CA . 17509 1 592 . 1 1 54 54 LEU CB C 13 45.902 0.400 . 1 . . . A 54 LEU CB . 17509 1 593 . 1 1 54 54 LEU CG C 13 28.471 0.400 . 1 . . . A 54 LEU CG . 17509 1 594 . 1 1 54 54 LEU CD1 C 13 22.672 0.400 . 2 . . . A 54 LEU CD1 . 17509 1 595 . 1 1 54 54 LEU CD2 C 13 25.706 0.400 . 2 . . . A 54 LEU CD2 . 17509 1 596 . 1 1 54 54 LEU N N 15 123.897 0.400 . 1 . . . A 54 LEU N . 17509 1 597 . 1 1 55 55 THR H H 1 9.941 0.020 . 1 . . . A 55 THR H . 17509 1 598 . 1 1 55 55 THR HA H 1 4.961 0.020 . 1 . . . A 55 THR HA . 17509 1 599 . 1 1 55 55 THR HB H 1 4.055 0.020 . 1 . . . A 55 THR HB . 17509 1 600 . 1 1 55 55 THR HG21 H 1 1.242 0.020 . 1 . . . A 55 THR HG21 . 17509 1 601 . 1 1 55 55 THR HG22 H 1 1.242 0.020 . 1 . . . A 55 THR HG22 . 17509 1 602 . 1 1 55 55 THR HG23 H 1 1.242 0.020 . 1 . . . A 55 THR HG23 . 17509 1 603 . 1 1 55 55 THR CA C 13 62.810 0.400 . 1 . . . A 55 THR CA . 17509 1 604 . 1 1 55 55 THR CB C 13 70.851 0.400 . 1 . . . A 55 THR CB . 17509 1 605 . 1 1 55 55 THR CG2 C 13 22.258 0.400 . 1 . . . A 55 THR CG2 . 17509 1 606 . 1 1 55 55 THR N N 15 126.289 0.400 . 1 . . . A 55 THR N . 17509 1 607 . 1 1 56 56 LEU H H 1 8.812 0.020 . 1 . . . A 56 LEU H . 17509 1 608 . 1 1 56 56 LEU HA H 1 4.604 0.020 . 1 . . . A 56 LEU HA . 17509 1 609 . 1 1 56 56 LEU HB2 H 1 2.150 0.020 . 2 . . . A 56 LEU HB2 . 17509 1 610 . 1 1 56 56 LEU HB3 H 1 0.887 0.020 . 2 . . . A 56 LEU HB3 . 17509 1 611 . 1 1 56 56 LEU HG H 1 1.297 0.020 . 1 . . . A 56 LEU HG . 17509 1 612 . 1 1 56 56 LEU HD11 H 1 0.494 0.020 . 2 . . . A 56 LEU HD11 . 17509 1 613 . 1 1 56 56 LEU HD12 H 1 0.494 0.020 . 2 . . . A 56 LEU HD12 . 17509 1 614 . 1 1 56 56 LEU HD13 H 1 0.494 0.020 . 2 . . . A 56 LEU HD13 . 17509 1 615 . 1 1 56 56 LEU HD21 H 1 0.094 0.020 . 2 . . . A 56 LEU HD21 . 17509 1 616 . 1 1 56 56 LEU HD22 H 1 0.094 0.020 . 2 . . . A 56 LEU HD22 . 17509 1 617 . 1 1 56 56 LEU HD23 H 1 0.094 0.020 . 2 . . . A 56 LEU HD23 . 17509 1 618 . 1 1 56 56 LEU CA C 13 53.525 0.400 . 1 . . . A 56 LEU CA . 17509 1 619 . 1 1 56 56 LEU CB C 13 40.845 0.400 . 1 . . . A 56 LEU CB . 17509 1 620 . 1 1 56 56 LEU CG C 13 26.920 0.400 . 1 . . . A 56 LEU CG . 17509 1 621 . 1 1 56 56 LEU CD1 C 13 26.541 0.400 . 2 . . . A 56 LEU CD1 . 17509 1 622 . 1 1 56 56 LEU CD2 C 13 23.566 0.400 . 2 . . . A 56 LEU CD2 . 17509 1 623 . 1 1 56 56 LEU N N 15 127.867 0.400 . 1 . . . A 56 LEU N . 17509 1 624 . 1 1 57 57 SER H H 1 9.053 0.020 . 1 . . . A 57 SER H . 17509 1 625 . 1 1 57 57 SER HA H 1 5.349 0.020 . 1 . . . A 57 SER HA . 17509 1 626 . 1 1 57 57 SER HB2 H 1 3.889 0.020 . 2 . . . A 57 SER HB2 . 17509 1 627 . 1 1 57 57 SER HB3 H 1 3.847 0.020 . 2 . . . A 57 SER HB3 . 17509 1 628 . 1 1 57 57 SER CA C 13 56.275 0.400 . 1 . . . A 57 SER CA . 17509 1 629 . 1 1 57 57 SER CB C 13 66.582 0.400 . 1 . . . A 57 SER CB . 17509 1 630 . 1 1 57 57 SER N N 15 117.486 0.400 . 1 . . . A 57 SER N . 17509 1 631 . 1 1 58 58 THR H H 1 9.996 0.020 . 1 . . . A 58 THR H . 17509 1 632 . 1 1 58 58 THR HA H 1 5.073 0.020 . 1 . . . A 58 THR HA . 17509 1 633 . 1 1 58 58 THR HB H 1 4.359 0.020 . 1 . . . A 58 THR HB . 17509 1 634 . 1 1 58 58 THR HG21 H 1 1.062 0.020 . 1 . . . A 58 THR HG21 . 17509 1 635 . 1 1 58 58 THR HG22 H 1 1.062 0.020 . 1 . . . A 58 THR HG22 . 17509 1 636 . 1 1 58 58 THR HG23 H 1 1.062 0.020 . 1 . . . A 58 THR HG23 . 17509 1 637 . 1 1 58 58 THR CA C 13 61.658 0.400 . 1 . . . A 58 THR CA . 17509 1 638 . 1 1 58 58 THR CB C 13 69.475 0.400 . 1 . . . A 58 THR CB . 17509 1 639 . 1 1 58 58 THR CG2 C 13 22.019 0.400 . 1 . . . A 58 THR CG2 . 17509 1 640 . 1 1 58 58 THR N N 15 119.416 0.400 . 1 . . . A 58 THR N . 17509 1 641 . 1 1 59 59 SER H H 1 8.649 0.020 . 1 . . . A 59 SER H . 17509 1 642 . 1 1 59 59 SER HA H 1 4.198 0.020 . 1 . . . A 59 SER HA . 17509 1 643 . 1 1 59 59 SER HB2 H 1 3.946 0.020 . 2 . . . A 59 SER HB2 . 17509 1 644 . 1 1 59 59 SER HB3 H 1 3.946 0.020 . 2 . . . A 59 SER HB3 . 17509 1 645 . 1 1 59 59 SER CA C 13 61.881 0.400 . 1 . . . A 59 SER CA . 17509 1 646 . 1 1 59 59 SER CB C 13 63.164 0.400 . 1 . . . A 59 SER CB . 17509 1 647 . 1 1 59 59 SER N N 15 121.026 0.400 . 1 . . . A 59 SER N . 17509 1 648 . 1 1 60 60 THR H H 1 8.610 0.020 . 1 . . . A 60 THR H . 17509 1 649 . 1 1 60 60 THR HA H 1 4.381 0.020 . 1 . . . A 60 THR HA . 17509 1 650 . 1 1 60 60 THR HB H 1 4.436 0.020 . 1 . . . A 60 THR HB . 17509 1 651 . 1 1 60 60 THR HG21 H 1 1.158 0.020 . 1 . . . A 60 THR HG21 . 17509 1 652 . 1 1 60 60 THR HG22 H 1 1.158 0.020 . 1 . . . A 60 THR HG22 . 17509 1 653 . 1 1 60 60 THR HG23 H 1 1.158 0.020 . 1 . . . A 60 THR HG23 . 17509 1 654 . 1 1 60 60 THR CA C 13 62.651 0.400 . 1 . . . A 60 THR CA . 17509 1 655 . 1 1 60 60 THR CB C 13 70.061 0.400 . 1 . . . A 60 THR CB . 17509 1 656 . 1 1 60 60 THR CG2 C 13 21.476 0.400 . 1 . . . A 60 THR CG2 . 17509 1 657 . 1 1 60 60 THR N N 15 111.340 0.400 . 1 . . . A 60 THR N . 17509 1 658 . 1 1 61 61 GLY H H 1 8.441 0.020 . 1 . . . A 61 GLY H . 17509 1 659 . 1 1 61 61 GLY HA2 H 1 3.670 0.020 . 2 . . . A 61 GLY HA2 . 17509 1 660 . 1 1 61 61 GLY HA3 H 1 4.416 0.020 . 2 . . . A 61 GLY HA3 . 17509 1 661 . 1 1 61 61 GLY CA C 13 44.918 0.400 . 1 . . . A 61 GLY CA . 17509 1 662 . 1 1 61 61 GLY N N 15 110.536 0.400 . 1 . . . A 61 GLY N . 17509 1 663 . 1 1 62 62 GLN H H 1 7.341 0.020 . 1 . . . A 62 GLN H . 17509 1 664 . 1 1 62 62 GLN HA H 1 4.473 0.020 . 1 . . . A 62 GLN HA . 17509 1 665 . 1 1 62 62 GLN HB2 H 1 1.996 0.020 . 2 . . . A 62 GLN HB2 . 17509 1 666 . 1 1 62 62 GLN HB3 H 1 1.583 0.020 . 2 . . . A 62 GLN HB3 . 17509 1 667 . 1 1 62 62 GLN HG2 H 1 2.196 0.020 . 2 . . . A 62 GLN HG2 . 17509 1 668 . 1 1 62 62 GLN HG3 H 1 2.124 0.020 . 2 . . . A 62 GLN HG3 . 17509 1 669 . 1 1 62 62 GLN HE21 H 1 7.506 0.020 . 2 . . . A 62 GLN HE21 . 17509 1 670 . 1 1 62 62 GLN HE22 H 1 6.798 0.020 . 2 . . . A 62 GLN HE22 . 17509 1 671 . 1 1 62 62 GLN CA C 13 53.385 0.400 . 1 . . . A 62 GLN CA . 17509 1 672 . 1 1 62 62 GLN CB C 13 32.009 0.400 . 1 . . . A 62 GLN CB . 17509 1 673 . 1 1 62 62 GLN CG C 13 33.449 0.400 . 1 . . . A 62 GLN CG . 17509 1 674 . 1 1 62 62 GLN N N 15 116.888 0.400 . 1 . . . A 62 GLN N . 17509 1 675 . 1 1 62 62 GLN NE2 N 15 112.462 0.400 . 1 . . . A 62 GLN NE2 . 17509 1 676 . 1 1 63 63 ARG H H 1 8.176 0.020 . 1 . . . A 63 ARG H . 17509 1 677 . 1 1 63 63 ARG HA H 1 4.015 0.020 . 1 . . . A 63 ARG HA . 17509 1 678 . 1 1 63 63 ARG HB2 H 1 0.954 0.020 . 2 . . . A 63 ARG HB2 . 17509 1 679 . 1 1 63 63 ARG HB3 H 1 1.501 0.020 . 2 . . . A 63 ARG HB3 . 17509 1 680 . 1 1 63 63 ARG HG2 H 1 1.159 0.020 . 2 . . . A 63 ARG HG2 . 17509 1 681 . 1 1 63 63 ARG HG3 H 1 -0.282 0.020 . 2 . . . A 63 ARG HG3 . 17509 1 682 . 1 1 63 63 ARG HD2 H 1 2.991 0.020 . 2 . . . A 63 ARG HD2 . 17509 1 683 . 1 1 63 63 ARG HD3 H 1 2.177 0.020 . 2 . . . A 63 ARG HD3 . 17509 1 684 . 1 1 63 63 ARG HE H 1 8.717 0.020 . 1 . . . A 63 ARG HE . 17509 1 685 . 1 1 63 63 ARG HH11 H 1 6.790 0.020 . 2 . . . A 63 ARG HH11 . 17509 1 686 . 1 1 63 63 ARG HH12 H 1 6.790 0.020 . 2 . . . A 63 ARG HH12 . 17509 1 687 . 1 1 63 63 ARG CA C 13 58.095 0.400 . 1 . . . A 63 ARG CA . 17509 1 688 . 1 1 63 63 ARG CB C 13 30.317 0.400 . 1 . . . A 63 ARG CB . 17509 1 689 . 1 1 63 63 ARG CG C 13 29.616 0.400 . 1 . . . A 63 ARG CG . 17509 1 690 . 1 1 63 63 ARG CD C 13 43.495 0.400 . 1 . . . A 63 ARG CD . 17509 1 691 . 1 1 63 63 ARG N N 15 120.745 0.400 . 1 . . . A 63 ARG N . 17509 1 692 . 1 1 63 63 ARG NE N 15 87.602 0.400 . 1 . . . A 63 ARG NE . 17509 1 693 . 1 1 64 64 HIS H H 1 9.395 0.020 . 1 . . . A 64 HIS H . 17509 1 694 . 1 1 64 64 HIS HA H 1 5.229 0.020 . 1 . . . A 64 HIS HA . 17509 1 695 . 1 1 64 64 HIS HB2 H 1 3.319 0.020 . 2 . . . A 64 HIS HB2 . 17509 1 696 . 1 1 64 64 HIS HB3 H 1 2.956 0.020 . 2 . . . A 64 HIS HB3 . 17509 1 697 . 1 1 64 64 HIS HD2 H 1 7.057 0.020 . 1 . . . A 64 HIS HD2 . 17509 1 698 . 1 1 64 64 HIS HE1 H 1 8.111 0.020 . 1 . . . A 64 HIS HE1 . 17509 1 699 . 1 1 64 64 HIS CA C 13 55.615 0.400 . 1 . . . A 64 HIS CA . 17509 1 700 . 1 1 64 64 HIS CB C 13 33.275 0.400 . 1 . . . A 64 HIS CB . 17509 1 701 . 1 1 64 64 HIS CD2 C 13 120.270 0.400 . 1 . . . A 64 HIS CD2 . 17509 1 702 . 1 1 64 64 HIS CE1 C 13 137.478 0.400 . 1 . . . A 64 HIS CE1 . 17509 1 703 . 1 1 64 64 HIS N N 15 128.099 0.400 . 1 . . . A 64 HIS N . 17509 1 704 . 1 1 65 65 ALA H H 1 9.925 0.020 . 1 . . . A 65 ALA H . 17509 1 705 . 1 1 65 65 ALA HA H 1 5.894 0.020 . 1 . . . A 65 ALA HA . 17509 1 706 . 1 1 65 65 ALA HB1 H 1 1.493 0.020 . 1 . . . A 65 ALA HB1 . 17509 1 707 . 1 1 65 65 ALA HB2 H 1 1.493 0.020 . 1 . . . A 65 ALA HB2 . 17509 1 708 . 1 1 65 65 ALA HB3 H 1 1.493 0.020 . 1 . . . A 65 ALA HB3 . 17509 1 709 . 1 1 65 65 ALA CA C 13 49.225 0.400 . 1 . . . A 65 ALA CA . 17509 1 710 . 1 1 65 65 ALA CB C 13 22.537 0.400 . 1 . . . A 65 ALA CB . 17509 1 711 . 1 1 65 65 ALA N N 15 131.198 0.400 . 1 . . . A 65 ALA N . 17509 1 712 . 1 1 66 66 SER H H 1 8.929 0.020 . 1 . . . A 66 SER H . 17509 1 713 . 1 1 66 66 SER HA H 1 4.879 0.020 . 1 . . . A 66 SER HA . 17509 1 714 . 1 1 66 66 SER HB2 H 1 3.997 0.020 . 2 . . . A 66 SER HB2 . 17509 1 715 . 1 1 66 66 SER HB3 H 1 3.922 0.020 . 2 . . . A 66 SER HB3 . 17509 1 716 . 1 1 66 66 SER CA C 13 56.932 0.400 . 1 . . . A 66 SER CA . 17509 1 717 . 1 1 66 66 SER CB C 13 66.381 0.400 . 1 . . . A 66 SER CB . 17509 1 718 . 1 1 66 66 SER N N 15 111.598 0.400 . 1 . . . A 66 SER N . 17509 1 719 . 1 1 67 67 GLY H H 1 7.120 0.020 . 1 . . . A 67 GLY H . 17509 1 720 . 1 1 67 67 GLY HA2 H 1 3.736 0.020 . 2 . . . A 67 GLY HA2 . 17509 1 721 . 1 1 67 67 GLY HA3 H 1 4.054 0.020 . 2 . . . A 67 GLY HA3 . 17509 1 722 . 1 1 67 67 GLY CA C 13 45.588 0.400 . 1 . . . A 67 GLY CA . 17509 1 723 . 1 1 67 67 GLY N N 15 102.836 0.400 . 1 . . . A 67 GLY N . 17509 1 724 . 1 1 68 68 PHE H H 1 8.056 0.020 . 1 . . . A 68 PHE H . 17509 1 725 . 1 1 68 68 PHE HA H 1 5.303 0.020 . 1 . . . A 68 PHE HA . 17509 1 726 . 1 1 68 68 PHE HB2 H 1 3.285 0.020 . 2 . . . A 68 PHE HB2 . 17509 1 727 . 1 1 68 68 PHE HB3 H 1 3.036 0.020 . 2 . . . A 68 PHE HB3 . 17509 1 728 . 1 1 68 68 PHE HD1 H 1 7.259 0.020 . 3 . . . A 68 PHE HD1 . 17509 1 729 . 1 1 68 68 PHE HD2 H 1 7.259 0.020 . 3 . . . A 68 PHE HD2 . 17509 1 730 . 1 1 68 68 PHE HE1 H 1 7.102 0.020 . 3 . . . A 68 PHE HE1 . 17509 1 731 . 1 1 68 68 PHE HE2 H 1 7.102 0.020 . 3 . . . A 68 PHE HE2 . 17509 1 732 . 1 1 68 68 PHE HZ H 1 6.981 0.020 . 1 . . . A 68 PHE HZ . 17509 1 733 . 1 1 68 68 PHE CA C 13 56.627 0.400 . 1 . . . A 68 PHE CA . 17509 1 734 . 1 1 68 68 PHE CB C 13 41.915 0.400 . 1 . . . A 68 PHE CB . 17509 1 735 . 1 1 68 68 PHE CD1 C 13 132.534 0.400 . 3 . . . A 68 PHE CD1 . 17509 1 736 . 1 1 68 68 PHE CD2 C 13 132.534 0.400 . 3 . . . A 68 PHE CD2 . 17509 1 737 . 1 1 68 68 PHE CE1 C 13 131.858 0.400 . 3 . . . A 68 PHE CE1 . 17509 1 738 . 1 1 68 68 PHE CE2 C 13 131.858 0.400 . 3 . . . A 68 PHE CE2 . 17509 1 739 . 1 1 68 68 PHE CZ C 13 129.785 0.400 . 1 . . . A 68 PHE CZ . 17509 1 740 . 1 1 68 68 PHE N N 15 122.105 0.400 . 1 . . . A 68 PHE N . 17509 1 741 . 1 1 69 69 SER H H 1 8.925 0.020 . 1 . . . A 69 SER H . 17509 1 742 . 1 1 69 69 SER HA H 1 4.418 0.020 . 1 . . . A 69 SER HA . 17509 1 743 . 1 1 69 69 SER HB2 H 1 3.654 0.020 . 2 . . . A 69 SER HB2 . 17509 1 744 . 1 1 69 69 SER HB3 H 1 3.654 0.020 . 2 . . . A 69 SER HB3 . 17509 1 745 . 1 1 69 69 SER CA C 13 57.346 0.400 . 1 . . . A 69 SER CA . 17509 1 746 . 1 1 69 69 SER CB C 13 62.769 0.400 . 1 . . . A 69 SER CB . 17509 1 747 . 1 1 69 69 SER N N 15 116.776 0.400 . 1 . . . A 69 SER N . 17509 1 748 . 1 1 70 70 GLY HA2 H 1 4.549 0.020 . 2 . . . A 70 GLY HA2 . 17509 1 749 . 1 1 70 70 GLY HA3 H 1 2.838 0.020 . 2 . . . A 70 GLY HA3 . 17509 1 750 . 1 1 70 70 GLY CA C 13 44.356 0.400 . 1 . . . A 70 GLY CA . 17509 1 751 . 1 1 71 71 CYS H H 1 7.101 0.020 . 1 . . . A 71 CYS H . 17509 1 752 . 1 1 71 71 CYS HA H 1 4.491 0.020 . 1 . . . A 71 CYS HA . 17509 1 753 . 1 1 71 71 CYS HB2 H 1 2.951 0.020 . 2 . . . A 71 CYS HB2 . 17509 1 754 . 1 1 71 71 CYS HB3 H 1 2.668 0.020 . 2 . . . A 71 CYS HB3 . 17509 1 755 . 1 1 71 71 CYS CA C 13 56.186 0.400 . 1 . . . A 71 CYS CA . 17509 1 756 . 1 1 71 71 CYS CB C 13 38.762 0.400 . 1 . . . A 71 CYS CB . 17509 1 757 . 1 1 71 71 CYS N N 15 119.126 0.400 . 1 . . . A 71 CYS N . 17509 1 758 . 1 1 72 72 ASN H H 1 10.633 0.020 . 1 . . . A 72 ASN H . 17509 1 759 . 1 1 72 72 ASN HA H 1 4.774 0.020 . 1 . . . A 72 ASN HA . 17509 1 760 . 1 1 72 72 ASN HB2 H 1 2.845 0.020 . 2 . . . A 72 ASN HB2 . 17509 1 761 . 1 1 72 72 ASN HB3 H 1 2.683 0.020 . 2 . . . A 72 ASN HB3 . 17509 1 762 . 1 1 72 72 ASN HD21 H 1 9.270 0.020 . 2 . . . A 72 ASN HD21 . 17509 1 763 . 1 1 72 72 ASN HD22 H 1 8.166 0.020 . 2 . . . A 72 ASN HD22 . 17509 1 764 . 1 1 72 72 ASN CA C 13 52.741 0.400 . 1 . . . A 72 ASN CA . 17509 1 765 . 1 1 72 72 ASN CB C 13 43.538 0.400 . 1 . . . A 72 ASN CB . 17509 1 766 . 1 1 72 72 ASN N N 15 122.020 0.400 . 1 . . . A 72 ASN N . 17509 1 767 . 1 1 72 72 ASN ND2 N 15 122.789 0.400 . 1 . . . A 72 ASN ND2 . 17509 1 768 . 1 1 73 73 ARG H H 1 7.886 0.020 . 1 . . . A 73 ARG H . 17509 1 769 . 1 1 73 73 ARG HA H 1 5.457 0.020 . 1 . . . A 73 ARG HA . 17509 1 770 . 1 1 73 73 ARG HB2 H 1 2.126 0.020 . 2 . . . A 73 ARG HB2 . 17509 1 771 . 1 1 73 73 ARG HB3 H 1 1.841 0.020 . 2 . . . A 73 ARG HB3 . 17509 1 772 . 1 1 73 73 ARG HG2 H 1 1.852 0.020 . 2 . . . A 73 ARG HG2 . 17509 1 773 . 1 1 73 73 ARG HG3 H 1 2.005 0.020 . 2 . . . A 73 ARG HG3 . 17509 1 774 . 1 1 73 73 ARG HD2 H 1 3.326 0.020 . 2 . . . A 73 ARG HD2 . 17509 1 775 . 1 1 73 73 ARG HD3 H 1 3.265 0.020 . 2 . . . A 73 ARG HD3 . 17509 1 776 . 1 1 73 73 ARG HE H 1 7.286 0.020 . 1 . . . A 73 ARG HE . 17509 1 777 . 1 1 73 73 ARG CA C 13 55.690 0.400 . 1 . . . A 73 ARG CA . 17509 1 778 . 1 1 73 73 ARG CB C 13 31.427 0.400 . 1 . . . A 73 ARG CB . 17509 1 779 . 1 1 73 73 ARG CG C 13 28.230 0.400 . 1 . . . A 73 ARG CG . 17509 1 780 . 1 1 73 73 ARG CD C 13 42.948 0.400 . 1 . . . A 73 ARG CD . 17509 1 781 . 1 1 73 73 ARG N N 15 115.919 0.400 . 1 . . . A 73 ARG N . 17509 1 782 . 1 1 73 73 ARG NE N 15 84.106 0.400 . 1 . . . A 73 ARG NE . 17509 1 783 . 1 1 74 74 TYR H H 1 8.665 0.020 . 1 . . . A 74 TYR H . 17509 1 784 . 1 1 74 74 TYR HA H 1 5.806 0.020 . 1 . . . A 74 TYR HA . 17509 1 785 . 1 1 74 74 TYR HB2 H 1 3.173 0.020 . 2 . . . A 74 TYR HB2 . 17509 1 786 . 1 1 74 74 TYR HB3 H 1 2.752 0.020 . 2 . . . A 74 TYR HB3 . 17509 1 787 . 1 1 74 74 TYR HD1 H 1 6.767 0.020 . 3 . . . A 74 TYR HD1 . 17509 1 788 . 1 1 74 74 TYR HD2 H 1 6.767 0.020 . 3 . . . A 74 TYR HD2 . 17509 1 789 . 1 1 74 74 TYR HE1 H 1 6.442 0.020 . 3 . . . A 74 TYR HE1 . 17509 1 790 . 1 1 74 74 TYR HE2 H 1 6.442 0.020 . 3 . . . A 74 TYR HE2 . 17509 1 791 . 1 1 74 74 TYR CA C 13 55.357 0.400 . 1 . . . A 74 TYR CA . 17509 1 792 . 1 1 74 74 TYR CB C 13 42.327 0.400 . 1 . . . A 74 TYR CB . 17509 1 793 . 1 1 74 74 TYR CD1 C 13 133.991 0.400 . 3 . . . A 74 TYR CD1 . 17509 1 794 . 1 1 74 74 TYR CD2 C 13 133.991 0.400 . 3 . . . A 74 TYR CD2 . 17509 1 795 . 1 1 74 74 TYR CE1 C 13 119.305 0.400 . 3 . . . A 74 TYR CE1 . 17509 1 796 . 1 1 74 74 TYR CE2 C 13 119.305 0.400 . 3 . . . A 74 TYR CE2 . 17509 1 797 . 1 1 74 74 TYR N N 15 118.327 0.400 . 1 . . . A 74 TYR N . 17509 1 798 . 1 1 75 75 MET H H 1 8.085 0.020 . 1 . . . A 75 MET H . 17509 1 799 . 1 1 75 75 MET HA H 1 5.345 0.020 . 1 . . . A 75 MET HA . 17509 1 800 . 1 1 75 75 MET HB2 H 1 2.282 0.020 . 2 . . . A 75 MET HB2 . 17509 1 801 . 1 1 75 75 MET HB3 H 1 2.153 0.020 . 2 . . . A 75 MET HB3 . 17509 1 802 . 1 1 75 75 MET HG2 H 1 2.633 0.020 . 2 . . . A 75 MET HG2 . 17509 1 803 . 1 1 75 75 MET HG3 H 1 2.571 0.020 . 2 . . . A 75 MET HG3 . 17509 1 804 . 1 1 75 75 MET HE1 H 1 2.028 0.020 . 1 . . . A 75 MET HE1 . 17509 1 805 . 1 1 75 75 MET HE2 H 1 2.028 0.020 . 1 . . . A 75 MET HE2 . 17509 1 806 . 1 1 75 75 MET HE3 H 1 2.028 0.020 . 1 . . . A 75 MET HE3 . 17509 1 807 . 1 1 75 75 MET CA C 13 54.910 0.400 . 1 . . . A 75 MET CA . 17509 1 808 . 1 1 75 75 MET CB C 13 34.627 0.400 . 1 . . . A 75 MET CB . 17509 1 809 . 1 1 75 75 MET CG C 13 31.523 0.400 . 1 . . . A 75 MET CG . 17509 1 810 . 1 1 75 75 MET CE C 13 17.577 0.400 . 1 . . . A 75 MET CE . 17509 1 811 . 1 1 75 75 MET N N 15 115.531 0.400 . 1 . . . A 75 MET N . 17509 1 812 . 1 1 76 76 GLY H H 1 8.622 0.020 . 1 . . . A 76 GLY H . 17509 1 813 . 1 1 76 76 GLY HA2 H 1 4.298 0.020 . 2 . . . A 76 GLY HA2 . 17509 1 814 . 1 1 76 76 GLY HA3 H 1 4.389 0.020 . 2 . . . A 76 GLY HA3 . 17509 1 815 . 1 1 76 76 GLY CA C 13 45.832 0.400 . 1 . . . A 76 GLY CA . 17509 1 816 . 1 1 76 76 GLY N N 15 108.548 0.400 . 1 . . . A 76 GLY N . 17509 1 817 . 1 1 77 77 SER H H 1 9.094 0.020 . 1 . . . A 77 SER H . 17509 1 818 . 1 1 77 77 SER HA H 1 5.061 0.020 . 1 . . . A 77 SER HA . 17509 1 819 . 1 1 77 77 SER HB2 H 1 3.959 0.020 . 2 . . . A 77 SER HB2 . 17509 1 820 . 1 1 77 77 SER HB3 H 1 3.959 0.020 . 2 . . . A 77 SER HB3 . 17509 1 821 . 1 1 77 77 SER CA C 13 58.474 0.400 . 1 . . . A 77 SER CA . 17509 1 822 . 1 1 77 77 SER CB C 13 65.015 0.400 . 1 . . . A 77 SER CB . 17509 1 823 . 1 1 77 77 SER N N 15 117.440 0.400 . 1 . . . A 77 SER N . 17509 1 824 . 1 1 78 78 TYR H H 1 7.112 0.020 . 1 . . . A 78 TYR H . 17509 1 825 . 1 1 78 78 TYR HA H 1 5.370 0.020 . 1 . . . A 78 TYR HA . 17509 1 826 . 1 1 78 78 TYR HB2 H 1 2.567 0.020 . 2 . . . A 78 TYR HB2 . 17509 1 827 . 1 1 78 78 TYR HB3 H 1 2.465 0.020 . 2 . . . A 78 TYR HB3 . 17509 1 828 . 1 1 78 78 TYR HD1 H 1 6.347 0.020 . 3 . . . A 78 TYR HD1 . 17509 1 829 . 1 1 78 78 TYR HD2 H 1 6.347 0.020 . 3 . . . A 78 TYR HD2 . 17509 1 830 . 1 1 78 78 TYR HE1 H 1 6.770 0.020 . 3 . . . A 78 TYR HE1 . 17509 1 831 . 1 1 78 78 TYR HE2 H 1 6.770 0.020 . 3 . . . A 78 TYR HE2 . 17509 1 832 . 1 1 78 78 TYR CA C 13 55.645 0.400 . 1 . . . A 78 TYR CA . 17509 1 833 . 1 1 78 78 TYR CB C 13 41.891 0.400 . 1 . . . A 78 TYR CB . 17509 1 834 . 1 1 78 78 TYR CD2 C 13 133.370 0.400 . 3 . . . A 78 TYR CD2 . 17509 1 835 . 1 1 78 78 TYR CE2 C 13 118.220 0.400 . 3 . . . A 78 TYR CE2 . 17509 1 836 . 1 1 78 78 TYR N N 15 114.542 0.400 . 1 . . . A 78 TYR N . 17509 1 837 . 1 1 79 79 ALA H H 1 8.632 0.020 . 1 . . . A 79 ALA H . 17509 1 838 . 1 1 79 79 ALA HA H 1 4.277 0.020 . 1 . . . A 79 ALA HA . 17509 1 839 . 1 1 79 79 ALA HB1 H 1 1.117 0.020 . 1 . . . A 79 ALA HB1 . 17509 1 840 . 1 1 79 79 ALA HB2 H 1 1.117 0.020 . 1 . . . A 79 ALA HB2 . 17509 1 841 . 1 1 79 79 ALA HB3 H 1 1.117 0.020 . 1 . . . A 79 ALA HB3 . 17509 1 842 . 1 1 79 79 ALA CA C 13 50.678 0.400 . 1 . . . A 79 ALA CA . 17509 1 843 . 1 1 79 79 ALA CB C 13 22.626 0.400 . 1 . . . A 79 ALA CB . 17509 1 844 . 1 1 79 79 ALA N N 15 120.647 0.400 . 1 . . . A 79 ALA N . 17509 1 845 . 1 1 80 80 LEU H H 1 7.755 0.020 . 1 . . . A 80 LEU H . 17509 1 846 . 1 1 80 80 LEU HA H 1 4.949 0.020 . 1 . . . A 80 LEU HA . 17509 1 847 . 1 1 80 80 LEU HB2 H 1 1.515 0.020 . 2 . . . A 80 LEU HB2 . 17509 1 848 . 1 1 80 80 LEU HB3 H 1 1.235 0.020 . 2 . . . A 80 LEU HB3 . 17509 1 849 . 1 1 80 80 LEU HG H 1 1.444 0.020 . 1 . . . A 80 LEU HG . 17509 1 850 . 1 1 80 80 LEU HD11 H 1 0.891 0.020 . 2 . . . A 80 LEU HD11 . 17509 1 851 . 1 1 80 80 LEU HD12 H 1 0.891 0.020 . 2 . . . A 80 LEU HD12 . 17509 1 852 . 1 1 80 80 LEU HD13 H 1 0.891 0.020 . 2 . . . A 80 LEU HD13 . 17509 1 853 . 1 1 80 80 LEU HD21 H 1 0.800 0.020 . 2 . . . A 80 LEU HD21 . 17509 1 854 . 1 1 80 80 LEU HD22 H 1 0.800 0.020 . 2 . . . A 80 LEU HD22 . 17509 1 855 . 1 1 80 80 LEU HD23 H 1 0.800 0.020 . 2 . . . A 80 LEU HD23 . 17509 1 856 . 1 1 80 80 LEU CA C 13 53.164 0.400 . 1 . . . A 80 LEU CA . 17509 1 857 . 1 1 80 80 LEU CB C 13 44.054 0.400 . 1 . . . A 80 LEU CB . 17509 1 858 . 1 1 80 80 LEU CG C 13 27.226 0.400 . 1 . . . A 80 LEU CG . 17509 1 859 . 1 1 80 80 LEU CD1 C 13 25.802 0.400 . 2 . . . A 80 LEU CD1 . 17509 1 860 . 1 1 80 80 LEU CD2 C 13 24.676 0.400 . 2 . . . A 80 LEU CD2 . 17509 1 861 . 1 1 80 80 LEU N N 15 118.705 0.400 . 1 . . . A 80 LEU N . 17509 1 862 . 1 1 81 81 LYS H H 1 7.970 0.020 . 1 . . . A 81 LYS H . 17509 1 863 . 1 1 81 81 LYS HA H 1 4.375 0.020 . 1 . . . A 81 LYS HA . 17509 1 864 . 1 1 81 81 LYS HB2 H 1 1.745 0.020 . 2 . . . A 81 LYS HB2 . 17509 1 865 . 1 1 81 81 LYS HB3 H 1 1.664 0.020 . 2 . . . A 81 LYS HB3 . 17509 1 866 . 1 1 81 81 LYS HG2 H 1 1.280 0.020 . 2 . . . A 81 LYS HG2 . 17509 1 867 . 1 1 81 81 LYS HG3 H 1 1.280 0.020 . 2 . . . A 81 LYS HG3 . 17509 1 868 . 1 1 81 81 LYS HD2 H 1 1.582 0.020 . 2 . . . A 81 LYS HD2 . 17509 1 869 . 1 1 81 81 LYS HD3 H 1 1.582 0.020 . 2 . . . A 81 LYS HD3 . 17509 1 870 . 1 1 81 81 LYS HE2 H 1 2.901 0.020 . 2 . . . A 81 LYS HE2 . 17509 1 871 . 1 1 81 81 LYS HE3 H 1 2.901 0.020 . 2 . . . A 81 LYS HE3 . 17509 1 872 . 1 1 81 81 LYS CA C 13 55.545 0.400 . 1 . . . A 81 LYS CA . 17509 1 873 . 1 1 81 81 LYS CB C 13 34.748 0.400 . 1 . . . A 81 LYS CB . 17509 1 874 . 1 1 81 81 LYS CG C 13 24.411 0.400 . 1 . . . A 81 LYS CG . 17509 1 875 . 1 1 81 81 LYS CD C 13 29.323 0.400 . 1 . . . A 81 LYS CD . 17509 1 876 . 1 1 81 81 LYS CE C 13 42.056 0.400 . 1 . . . A 81 LYS CE . 17509 1 877 . 1 1 81 81 LYS N N 15 122.770 0.400 . 1 . . . A 81 LYS N . 17509 1 878 . 1 1 82 82 ASP H H 1 9.023 0.020 . 1 . . . A 82 ASP H . 17509 1 879 . 1 1 82 82 ASP HA H 1 4.218 0.020 . 1 . . . A 82 ASP HA . 17509 1 880 . 1 1 82 82 ASP HB2 H 1 2.819 0.020 . 2 . . . A 82 ASP HB2 . 17509 1 881 . 1 1 82 82 ASP HB3 H 1 2.615 0.020 . 2 . . . A 82 ASP HB3 . 17509 1 882 . 1 1 82 82 ASP CA C 13 55.924 0.400 . 1 . . . A 82 ASP CA . 17509 1 883 . 1 1 82 82 ASP CB C 13 39.880 0.400 . 1 . . . A 82 ASP CB . 17509 1 884 . 1 1 82 82 ASP N N 15 123.306 0.400 . 1 . . . A 82 ASP N . 17509 1 885 . 1 1 83 83 GLY H H 1 8.358 0.020 . 1 . . . A 83 GLY H . 17509 1 886 . 1 1 83 83 GLY HA2 H 1 3.830 0.020 . 2 . . . A 83 GLY HA2 . 17509 1 887 . 1 1 83 83 GLY HA3 H 1 4.103 0.020 . 2 . . . A 83 GLY HA3 . 17509 1 888 . 1 1 83 83 GLY CA C 13 46.158 0.400 . 1 . . . A 83 GLY CA . 17509 1 889 . 1 1 83 83 GLY N N 15 107.025 0.400 . 1 . . . A 83 GLY N . 17509 1 890 . 1 1 84 84 LYS H H 1 7.800 0.020 . 1 . . . A 84 LYS H . 17509 1 891 . 1 1 84 84 LYS HA H 1 4.349 0.020 . 1 . . . A 84 LYS HA . 17509 1 892 . 1 1 84 84 LYS HB2 H 1 1.657 0.020 . 2 . . . A 84 LYS HB2 . 17509 1 893 . 1 1 84 84 LYS HB3 H 1 1.623 0.020 . 2 . . . A 84 LYS HB3 . 17509 1 894 . 1 1 84 84 LYS HG2 H 1 1.132 0.020 . 2 . . . A 84 LYS HG2 . 17509 1 895 . 1 1 84 84 LYS HG3 H 1 1.175 0.020 . 2 . . . A 84 LYS HG3 . 17509 1 896 . 1 1 84 84 LYS HD2 H 1 1.569 0.020 . 2 . . . A 84 LYS HD2 . 17509 1 897 . 1 1 84 84 LYS HD3 H 1 1.569 0.020 . 2 . . . A 84 LYS HD3 . 17509 1 898 . 1 1 84 84 LYS HE2 H 1 2.940 0.020 . 2 . . . A 84 LYS HE2 . 17509 1 899 . 1 1 84 84 LYS HE3 H 1 2.940 0.020 . 2 . . . A 84 LYS HE3 . 17509 1 900 . 1 1 84 84 LYS CA C 13 56.313 0.400 . 1 . . . A 84 LYS CA . 17509 1 901 . 1 1 84 84 LYS CB C 13 35.258 0.400 . 1 . . . A 84 LYS CB . 17509 1 902 . 1 1 84 84 LYS CG C 13 24.668 0.400 . 1 . . . A 84 LYS CG . 17509 1 903 . 1 1 84 84 LYS CD C 13 29.507 0.400 . 1 . . . A 84 LYS CD . 17509 1 904 . 1 1 84 84 LYS CE C 13 42.301 0.400 . 1 . . . A 84 LYS CE . 17509 1 905 . 1 1 84 84 LYS N N 15 119.643 0.400 . 1 . . . A 84 LYS N . 17509 1 906 . 1 1 85 85 LEU H H 1 7.606 0.020 . 1 . . . A 85 LEU H . 17509 1 907 . 1 1 85 85 LEU HA H 1 4.697 0.020 . 1 . . . A 85 LEU HA . 17509 1 908 . 1 1 85 85 LEU HB2 H 1 1.552 0.020 . 2 . . . A 85 LEU HB2 . 17509 1 909 . 1 1 85 85 LEU HB3 H 1 0.882 0.020 . 2 . . . A 85 LEU HB3 . 17509 1 910 . 1 1 85 85 LEU HG H 1 0.923 0.020 . 1 . . . A 85 LEU HG . 17509 1 911 . 1 1 85 85 LEU HD11 H 1 0.421 0.020 . 2 . . . A 85 LEU HD11 . 17509 1 912 . 1 1 85 85 LEU HD12 H 1 0.421 0.020 . 2 . . . A 85 LEU HD12 . 17509 1 913 . 1 1 85 85 LEU HD13 H 1 0.421 0.020 . 2 . . . A 85 LEU HD13 . 17509 1 914 . 1 1 85 85 LEU HD21 H 1 0.505 0.020 . 2 . . . A 85 LEU HD21 . 17509 1 915 . 1 1 85 85 LEU HD22 H 1 0.505 0.020 . 2 . . . A 85 LEU HD22 . 17509 1 916 . 1 1 85 85 LEU HD23 H 1 0.505 0.020 . 2 . . . A 85 LEU HD23 . 17509 1 917 . 1 1 85 85 LEU CA C 13 53.868 0.400 . 1 . . . A 85 LEU CA . 17509 1 918 . 1 1 85 85 LEU CB C 13 44.240 0.400 . 1 . . . A 85 LEU CB . 17509 1 919 . 1 1 85 85 LEU CG C 13 27.071 0.400 . 1 . . . A 85 LEU CG . 17509 1 920 . 1 1 85 85 LEU CD1 C 13 23.924 0.400 . 2 . . . A 85 LEU CD1 . 17509 1 921 . 1 1 85 85 LEU CD2 C 13 26.067 0.400 . 2 . . . A 85 LEU CD2 . 17509 1 922 . 1 1 85 85 LEU N N 15 128.645 0.400 . 1 . . . A 85 LEU N . 17509 1 923 . 1 1 86 86 SER H H 1 8.279 0.020 . 1 . . . A 86 SER H . 17509 1 924 . 1 1 86 86 SER HA H 1 4.675 0.020 . 1 . . . A 86 SER HA . 17509 1 925 . 1 1 86 86 SER HB2 H 1 3.697 0.020 . 2 . . . A 86 SER HB2 . 17509 1 926 . 1 1 86 86 SER HB3 H 1 3.571 0.020 . 2 . . . A 86 SER HB3 . 17509 1 927 . 1 1 86 86 SER CA C 13 56.583 0.400 . 1 . . . A 86 SER CA . 17509 1 928 . 1 1 86 86 SER CB C 13 66.147 0.400 . 1 . . . A 86 SER CB . 17509 1 929 . 1 1 86 86 SER N N 15 116.989 0.400 . 1 . . . A 86 SER N . 17509 1 930 . 1 1 87 87 PHE H H 1 8.541 0.020 . 1 . . . A 87 PHE H . 17509 1 931 . 1 1 87 87 PHE HA H 1 5.187 0.020 . 1 . . . A 87 PHE HA . 17509 1 932 . 1 1 87 87 PHE HB2 H 1 3.262 0.020 . 2 . . . A 87 PHE HB2 . 17509 1 933 . 1 1 87 87 PHE HB3 H 1 2.547 0.020 . 2 . . . A 87 PHE HB3 . 17509 1 934 . 1 1 87 87 PHE HD1 H 1 7.283 0.020 . 3 . . . A 87 PHE HD1 . 17509 1 935 . 1 1 87 87 PHE HD2 H 1 7.283 0.020 . 3 . . . A 87 PHE HD2 . 17509 1 936 . 1 1 87 87 PHE HE1 H 1 6.837 0.020 . 3 . . . A 87 PHE HE1 . 17509 1 937 . 1 1 87 87 PHE HE2 H 1 6.837 0.020 . 3 . . . A 87 PHE HE2 . 17509 1 938 . 1 1 87 87 PHE HZ H 1 6.838 0.020 . 1 . . . A 87 PHE HZ . 17509 1 939 . 1 1 87 87 PHE CA C 13 57.574 0.400 . 1 . . . A 87 PHE CA . 17509 1 940 . 1 1 87 87 PHE CB C 13 43.008 0.400 . 1 . . . A 87 PHE CB . 17509 1 941 . 1 1 87 87 PHE CD1 C 13 132.280 0.400 . 3 . . . A 87 PHE CD1 . 17509 1 942 . 1 1 87 87 PHE CD2 C 13 132.280 0.400 . 3 . . . A 87 PHE CD2 . 17509 1 943 . 1 1 87 87 PHE CE1 C 13 130.118 0.400 . 3 . . . A 87 PHE CE1 . 17509 1 944 . 1 1 87 87 PHE CE2 C 13 130.118 0.400 . 3 . . . A 87 PHE CE2 . 17509 1 945 . 1 1 87 87 PHE CZ C 13 128.192 0.400 . 1 . . . A 87 PHE CZ . 17509 1 946 . 1 1 87 87 PHE N N 15 117.457 0.400 . 1 . . . A 87 PHE N . 17509 1 947 . 1 1 88 88 GLY H H 1 8.118 0.020 . 1 . . . A 88 GLY H . 17509 1 948 . 1 1 88 88 GLY HA2 H 1 3.705 0.020 . 2 . . . A 88 GLY HA2 . 17509 1 949 . 1 1 88 88 GLY HA3 H 1 4.257 0.020 . 2 . . . A 88 GLY HA3 . 17509 1 950 . 1 1 88 88 GLY CA C 13 43.861 0.400 . 1 . . . A 88 GLY CA . 17509 1 951 . 1 1 88 88 GLY N N 15 109.111 0.400 . 1 . . . A 88 GLY N . 17509 1 952 . 1 1 89 89 THR H H 1 8.060 0.020 . 1 . . . A 89 THR H . 17509 1 953 . 1 1 89 89 THR HA H 1 3.913 0.020 . 1 . . . A 89 THR HA . 17509 1 954 . 1 1 89 89 THR HB H 1 3.999 0.020 . 1 . . . A 89 THR HB . 17509 1 955 . 1 1 89 89 THR HG21 H 1 1.204 0.020 . 1 . . . A 89 THR HG21 . 17509 1 956 . 1 1 89 89 THR HG22 H 1 1.204 0.020 . 1 . . . A 89 THR HG22 . 17509 1 957 . 1 1 89 89 THR HG23 H 1 1.204 0.020 . 1 . . . A 89 THR HG23 . 17509 1 958 . 1 1 89 89 THR CA C 13 63.945 0.400 . 1 . . . A 89 THR CA . 17509 1 959 . 1 1 89 89 THR CB C 13 69.401 0.400 . 1 . . . A 89 THR CB . 17509 1 960 . 1 1 89 89 THR CG2 C 13 22.051 0.400 . 1 . . . A 89 THR CG2 . 17509 1 961 . 1 1 89 89 THR N N 15 113.632 0.400 . 1 . . . A 89 THR N . 17509 1 962 . 1 1 90 90 LEU H H 1 8.665 0.020 . 1 . . . A 90 LEU H . 17509 1 963 . 1 1 90 90 LEU HA H 1 4.935 0.020 . 1 . . . A 90 LEU HA . 17509 1 964 . 1 1 90 90 LEU HB2 H 1 1.811 0.020 . 2 . . . A 90 LEU HB2 . 17509 1 965 . 1 1 90 90 LEU HB3 H 1 1.182 0.020 . 2 . . . A 90 LEU HB3 . 17509 1 966 . 1 1 90 90 LEU HG H 1 1.817 0.020 . 1 . . . A 90 LEU HG . 17509 1 967 . 1 1 90 90 LEU HD11 H 1 0.683 0.020 . 2 . . . A 90 LEU HD11 . 17509 1 968 . 1 1 90 90 LEU HD12 H 1 0.683 0.020 . 2 . . . A 90 LEU HD12 . 17509 1 969 . 1 1 90 90 LEU HD13 H 1 0.683 0.020 . 2 . . . A 90 LEU HD13 . 17509 1 970 . 1 1 90 90 LEU HD21 H 1 0.506 0.020 . 2 . . . A 90 LEU HD21 . 17509 1 971 . 1 1 90 90 LEU HD22 H 1 0.506 0.020 . 2 . . . A 90 LEU HD22 . 17509 1 972 . 1 1 90 90 LEU HD23 H 1 0.506 0.020 . 2 . . . A 90 LEU HD23 . 17509 1 973 . 1 1 90 90 LEU CA C 13 54.239 0.400 . 1 . . . A 90 LEU CA . 17509 1 974 . 1 1 90 90 LEU CB C 13 43.191 0.400 . 1 . . . A 90 LEU CB . 17509 1 975 . 1 1 90 90 LEU CG C 13 26.417 0.400 . 1 . . . A 90 LEU CG . 17509 1 976 . 1 1 90 90 LEU CD1 C 13 22.833 0.400 . 2 . . . A 90 LEU CD1 . 17509 1 977 . 1 1 90 90 LEU CD2 C 13 26.315 0.400 . 2 . . . A 90 LEU CD2 . 17509 1 978 . 1 1 90 90 LEU N N 15 129.046 0.400 . 1 . . . A 90 LEU N . 17509 1 979 . 1 1 91 91 GLY H H 1 8.915 0.020 . 1 . . . A 91 GLY H . 17509 1 980 . 1 1 91 91 GLY HA2 H 1 3.851 0.020 . 2 . . . A 91 GLY HA2 . 17509 1 981 . 1 1 91 91 GLY HA3 H 1 4.574 0.020 . 2 . . . A 91 GLY HA3 . 17509 1 982 . 1 1 91 91 GLY CA C 13 44.050 0.400 . 1 . . . A 91 GLY CA . 17509 1 983 . 1 1 91 91 GLY N N 15 111.321 0.400 . 1 . . . A 91 GLY N . 17509 1 984 . 1 1 92 92 GLY H H 1 8.187 0.020 . 1 . . . A 92 GLY H . 17509 1 985 . 1 1 92 92 GLY HA2 H 1 4.127 0.020 . 2 . . . A 92 GLY HA2 . 17509 1 986 . 1 1 92 92 GLY HA3 H 1 4.784 0.020 . 2 . . . A 92 GLY HA3 . 17509 1 987 . 1 1 92 92 GLY CA C 13 45.277 0.400 . 1 . . . A 92 GLY CA . 17509 1 988 . 1 1 92 92 GLY N N 15 107.082 0.400 . 1 . . . A 92 GLY N . 17509 1 989 . 1 1 93 93 THR H H 1 7.697 0.020 . 1 . . . A 93 THR H . 17509 1 990 . 1 1 93 93 THR HA H 1 4.323 0.020 . 1 . . . A 93 THR HA . 17509 1 991 . 1 1 93 93 THR HB H 1 4.514 0.020 . 1 . . . A 93 THR HB . 17509 1 992 . 1 1 93 93 THR HG21 H 1 1.318 0.020 . 1 . . . A 93 THR HG21 . 17509 1 993 . 1 1 93 93 THR HG22 H 1 1.318 0.020 . 1 . . . A 93 THR HG22 . 17509 1 994 . 1 1 93 93 THR HG23 H 1 1.318 0.020 . 1 . . . A 93 THR HG23 . 17509 1 995 . 1 1 93 93 THR CA C 13 62.327 0.400 . 1 . . . A 93 THR CA . 17509 1 996 . 1 1 93 93 THR CB C 13 70.031 0.400 . 1 . . . A 93 THR CB . 17509 1 997 . 1 1 93 93 THR CG2 C 13 21.965 0.400 . 1 . . . A 93 THR CG2 . 17509 1 998 . 1 1 93 93 THR N N 15 109.885 0.400 . 1 . . . A 93 THR N . 17509 1 999 . 1 1 94 94 ARG H H 1 8.568 0.020 . 1 . . . A 94 ARG H . 17509 1 1000 . 1 1 94 94 ARG HA H 1 4.621 0.020 . 1 . . . A 94 ARG HA . 17509 1 1001 . 1 1 94 94 ARG HB2 H 1 1.546 0.020 . 2 . . . A 94 ARG HB2 . 17509 1 1002 . 1 1 94 94 ARG HB3 H 1 1.982 0.020 . 2 . . . A 94 ARG HB3 . 17509 1 1003 . 1 1 94 94 ARG HG2 H 1 1.603 0.020 . 2 . . . A 94 ARG HG2 . 17509 1 1004 . 1 1 94 94 ARG HG3 H 1 1.418 0.020 . 2 . . . A 94 ARG HG3 . 17509 1 1005 . 1 1 94 94 ARG HD2 H 1 3.092 0.020 . 2 . . . A 94 ARG HD2 . 17509 1 1006 . 1 1 94 94 ARG HD3 H 1 3.154 0.020 . 2 . . . A 94 ARG HD3 . 17509 1 1007 . 1 1 94 94 ARG HE H 1 7.115 0.020 . 1 . . . A 94 ARG HE . 17509 1 1008 . 1 1 94 94 ARG CA C 13 54.542 0.400 . 1 . . . A 94 ARG CA . 17509 1 1009 . 1 1 94 94 ARG CB C 13 30.310 0.400 . 1 . . . A 94 ARG CB . 17509 1 1010 . 1 1 94 94 ARG CG C 13 26.877 0.400 . 1 . . . A 94 ARG CG . 17509 1 1011 . 1 1 94 94 ARG CD C 13 43.189 0.400 . 1 . . . A 94 ARG CD . 17509 1 1012 . 1 1 94 94 ARG N N 15 120.802 0.400 . 1 . . . A 94 ARG N . 17509 1 1013 . 1 1 94 94 ARG NE N 15 84.850 0.400 . 1 . . . A 94 ARG NE . 17509 1 1014 . 1 1 95 95 MET H H 1 8.854 0.020 . 1 . . . A 95 MET H . 17509 1 1015 . 1 1 95 95 MET HA H 1 4.419 0.020 . 1 . . . A 95 MET HA . 17509 1 1016 . 1 1 95 95 MET HB2 H 1 2.133 0.020 . 2 . . . A 95 MET HB2 . 17509 1 1017 . 1 1 95 95 MET HB3 H 1 2.027 0.020 . 2 . . . A 95 MET HB3 . 17509 1 1018 . 1 1 95 95 MET HG2 H 1 2.606 0.020 . 2 . . . A 95 MET HG2 . 17509 1 1019 . 1 1 95 95 MET HG3 H 1 2.634 0.020 . 2 . . . A 95 MET HG3 . 17509 1 1020 . 1 1 95 95 MET HE1 H 1 2.150 0.020 . 1 . . . A 95 MET HE1 . 17509 1 1021 . 1 1 95 95 MET HE2 H 1 2.150 0.020 . 1 . . . A 95 MET HE2 . 17509 1 1022 . 1 1 95 95 MET HE3 H 1 2.150 0.020 . 1 . . . A 95 MET HE3 . 17509 1 1023 . 1 1 95 95 MET CA C 13 56.209 0.400 . 1 . . . A 95 MET CA . 17509 1 1024 . 1 1 95 95 MET CB C 13 33.460 0.400 . 1 . . . A 95 MET CB . 17509 1 1025 . 1 1 95 95 MET CG C 13 32.339 0.400 . 1 . . . A 95 MET CG . 17509 1 1026 . 1 1 95 95 MET CE C 13 17.213 0.400 . 1 . . . A 95 MET CE . 17509 1 1027 . 1 1 95 95 MET N N 15 121.279 0.400 . 1 . . . A 95 MET N . 17509 1 1028 . 1 1 96 96 ALA H H 1 8.542 0.020 . 1 . . . A 96 ALA H . 17509 1 1029 . 1 1 96 96 ALA HA H 1 4.685 0.020 . 1 . . . A 96 ALA HA . 17509 1 1030 . 1 1 96 96 ALA HB1 H 1 1.314 0.020 . 1 . . . A 96 ALA HB1 . 17509 1 1031 . 1 1 96 96 ALA HB2 H 1 1.314 0.020 . 1 . . . A 96 ALA HB2 . 17509 1 1032 . 1 1 96 96 ALA HB3 H 1 1.314 0.020 . 1 . . . A 96 ALA HB3 . 17509 1 1033 . 1 1 96 96 ALA CA C 13 51.501 0.400 . 1 . . . A 96 ALA CA . 17509 1 1034 . 1 1 96 96 ALA CB C 13 20.273 0.400 . 1 . . . A 96 ALA CB . 17509 1 1035 . 1 1 96 96 ALA N N 15 124.575 0.400 . 1 . . . A 96 ALA N . 17509 1 1036 . 1 1 97 97 CYS H H 1 8.787 0.020 . 1 . . . A 97 CYS H . 17509 1 1037 . 1 1 97 97 CYS HA H 1 4.974 0.020 . 1 . . . A 97 CYS HA . 17509 1 1038 . 1 1 97 97 CYS HB2 H 1 3.134 0.020 . 2 . . . A 97 CYS HB2 . 17509 1 1039 . 1 1 97 97 CYS HB3 H 1 2.780 0.020 . 2 . . . A 97 CYS HB3 . 17509 1 1040 . 1 1 97 97 CYS CA C 13 57.161 0.400 . 1 . . . A 97 CYS CA . 17509 1 1041 . 1 1 97 97 CYS CB C 13 40.888 0.400 . 1 . . . A 97 CYS CB . 17509 1 1042 . 1 1 97 97 CYS N N 15 118.992 0.400 . 1 . . . A 97 CYS N . 17509 1 1043 . 1 1 98 98 MET H H 1 9.240 0.020 . 1 . . . A 98 MET H . 17509 1 1044 . 1 1 98 98 MET HA H 1 4.789 0.020 . 1 . . . A 98 MET HA . 17509 1 1045 . 1 1 98 98 MET HB2 H 1 2.185 0.020 . 2 . . . A 98 MET HB2 . 17509 1 1046 . 1 1 98 98 MET HB3 H 1 1.947 0.020 . 2 . . . A 98 MET HB3 . 17509 1 1047 . 1 1 98 98 MET HG2 H 1 2.648 0.020 . 2 . . . A 98 MET HG2 . 17509 1 1048 . 1 1 98 98 MET HG3 H 1 2.503 0.020 . 2 . . . A 98 MET HG3 . 17509 1 1049 . 1 1 98 98 MET HE1 H 1 2.043 0.020 . 1 . . . A 98 MET HE1 . 17509 1 1050 . 1 1 98 98 MET HE2 H 1 2.043 0.020 . 1 . . . A 98 MET HE2 . 17509 1 1051 . 1 1 98 98 MET HE3 H 1 2.043 0.020 . 1 . . . A 98 MET HE3 . 17509 1 1052 . 1 1 98 98 MET CA C 13 53.901 0.400 . 1 . . . A 98 MET CA . 17509 1 1053 . 1 1 98 98 MET CB C 13 30.188 0.400 . 1 . . . A 98 MET CB . 17509 1 1054 . 1 1 98 98 MET CG C 13 32.311 0.400 . 1 . . . A 98 MET CG . 17509 1 1055 . 1 1 98 98 MET CE C 13 17.102 0.400 . 1 . . . A 98 MET CE . 17509 1 1056 . 1 1 98 98 MET N N 15 127.374 0.400 . 1 . . . A 98 MET N . 17509 1 1057 . 1 1 99 99 THR H H 1 7.418 0.020 . 1 . . . A 99 THR H . 17509 1 1058 . 1 1 99 99 THR HA H 1 4.848 0.020 . 1 . . . A 99 THR HA . 17509 1 1059 . 1 1 99 99 THR HB H 1 4.616 0.020 . 1 . . . A 99 THR HB . 17509 1 1060 . 1 1 99 99 THR HG21 H 1 1.199 0.020 . 1 . . . A 99 THR HG21 . 17509 1 1061 . 1 1 99 99 THR HG22 H 1 1.199 0.020 . 1 . . . A 99 THR HG22 . 17509 1 1062 . 1 1 99 99 THR HG23 H 1 1.199 0.020 . 1 . . . A 99 THR HG23 . 17509 1 1063 . 1 1 99 99 THR CA C 13 58.555 0.400 . 1 . . . A 99 THR CA . 17509 1 1064 . 1 1 99 99 THR CB C 13 70.156 0.400 . 1 . . . A 99 THR CB . 17509 1 1065 . 1 1 99 99 THR CG2 C 13 22.387 0.400 . 1 . . . A 99 THR CG2 . 17509 1 1066 . 1 1 99 99 THR N N 15 110.218 0.400 . 1 . . . A 99 THR N . 17509 1 1067 . 1 1 100 100 PRO HA H 1 4.303 0.020 . 1 . . . A 100 PRO HA . 17509 1 1068 . 1 1 100 100 PRO HB2 H 1 2.382 0.020 . 2 . . . A 100 PRO HB2 . 17509 1 1069 . 1 1 100 100 PRO HB3 H 1 1.828 0.020 . 2 . . . A 100 PRO HB3 . 17509 1 1070 . 1 1 100 100 PRO HG2 H 1 2.173 0.020 . 2 . . . A 100 PRO HG2 . 17509 1 1071 . 1 1 100 100 PRO HG3 H 1 1.987 0.020 . 2 . . . A 100 PRO HG3 . 17509 1 1072 . 1 1 100 100 PRO HD2 H 1 3.905 0.020 . 2 . . . A 100 PRO HD2 . 17509 1 1073 . 1 1 100 100 PRO HD3 H 1 3.818 0.020 . 2 . . . A 100 PRO HD3 . 17509 1 1074 . 1 1 100 100 PRO CA C 13 65.556 0.400 . 1 . . . A 100 PRO CA . 17509 1 1075 . 1 1 100 100 PRO CB C 13 31.969 0.400 . 1 . . . A 100 PRO CB . 17509 1 1076 . 1 1 100 100 PRO CG C 13 28.315 0.400 . 1 . . . A 100 PRO CG . 17509 1 1077 . 1 1 100 100 PRO CD C 13 50.688 0.400 . 1 . . . A 100 PRO CD . 17509 1 1078 . 1 1 101 101 GLY H H 1 8.680 0.020 . 1 . . . A 101 GLY H . 17509 1 1079 . 1 1 101 101 GLY HA2 H 1 3.693 0.020 . 2 . . . A 101 GLY HA2 . 17509 1 1080 . 1 1 101 101 GLY HA3 H 1 4.043 0.020 . 2 . . . A 101 GLY HA3 . 17509 1 1081 . 1 1 101 101 GLY CA C 13 46.675 0.400 . 1 . . . A 101 GLY CA . 17509 1 1082 . 1 1 101 101 GLY N N 15 106.755 0.400 . 1 . . . A 101 GLY N . 17509 1 1083 . 1 1 102 102 GLY H H 1 8.087 0.020 . 1 . . . A 102 GLY H . 17509 1 1084 . 1 1 102 102 GLY HA2 H 1 3.722 0.020 . 2 . . . A 102 GLY HA2 . 17509 1 1085 . 1 1 102 102 GLY HA3 H 1 4.233 0.020 . 2 . . . A 102 GLY HA3 . 17509 1 1086 . 1 1 102 102 GLY CA C 13 46.796 0.400 . 1 . . . A 102 GLY CA . 17509 1 1087 . 1 1 102 102 GLY N N 15 107.749 0.400 . 1 . . . A 102 GLY N . 17509 1 1088 . 1 1 103 103 GLN H H 1 7.908 0.020 . 1 . . . A 103 GLN H . 17509 1 1089 . 1 1 103 103 GLN HA H 1 4.237 0.020 . 1 . . . A 103 GLN HA . 17509 1 1090 . 1 1 103 103 GLN HB2 H 1 2.143 0.020 . 2 . . . A 103 GLN HB2 . 17509 1 1091 . 1 1 103 103 GLN HB3 H 1 2.143 0.020 . 2 . . . A 103 GLN HB3 . 17509 1 1092 . 1 1 103 103 GLN HG2 H 1 2.418 0.020 . 2 . . . A 103 GLN HG2 . 17509 1 1093 . 1 1 103 103 GLN HG3 H 1 2.487 0.020 . 2 . . . A 103 GLN HG3 . 17509 1 1094 . 1 1 103 103 GLN HE21 H 1 6.788 0.020 . 2 . . . A 103 GLN HE21 . 17509 1 1095 . 1 1 103 103 GLN HE22 H 1 7.347 0.020 . 2 . . . A 103 GLN HE22 . 17509 1 1096 . 1 1 103 103 GLN CA C 13 57.766 0.400 . 1 . . . A 103 GLN CA . 17509 1 1097 . 1 1 103 103 GLN CB C 13 28.787 0.400 . 1 . . . A 103 GLN CB . 17509 1 1098 . 1 1 103 103 GLN CG C 13 34.115 0.400 . 1 . . . A 103 GLN CG . 17509 1 1099 . 1 1 103 103 GLN N N 15 118.906 0.400 . 1 . . . A 103 GLN N . 17509 1 1100 . 1 1 103 103 GLN NE2 N 15 111.913 0.400 . 1 . . . A 103 GLN NE2 . 17509 1 1101 . 1 1 104 104 ILE H H 1 7.495 0.020 . 1 . . . A 104 ILE H . 17509 1 1102 . 1 1 104 104 ILE HA H 1 4.322 0.020 . 1 . . . A 104 ILE HA . 17509 1 1103 . 1 1 104 104 ILE HB H 1 1.819 0.020 . 1 . . . A 104 ILE HB . 17509 1 1104 . 1 1 104 104 ILE HG12 H 1 1.449 0.020 . 2 . . . A 104 ILE HG12 . 17509 1 1105 . 1 1 104 104 ILE HG13 H 1 1.449 0.020 . 2 . . . A 104 ILE HG13 . 17509 1 1106 . 1 1 104 104 ILE HG21 H 1 1.035 0.020 . 1 . . . A 104 ILE HG21 . 17509 1 1107 . 1 1 104 104 ILE HG22 H 1 1.035 0.020 . 1 . . . A 104 ILE HG22 . 17509 1 1108 . 1 1 104 104 ILE HG23 H 1 1.035 0.020 . 1 . . . A 104 ILE HG23 . 17509 1 1109 . 1 1 104 104 ILE HD11 H 1 0.735 0.020 . 1 . . . A 104 ILE HD11 . 17509 1 1110 . 1 1 104 104 ILE HD12 H 1 0.735 0.020 . 1 . . . A 104 ILE HD12 . 17509 1 1111 . 1 1 104 104 ILE HD13 H 1 0.735 0.020 . 1 . . . A 104 ILE HD13 . 17509 1 1112 . 1 1 104 104 ILE CA C 13 61.145 0.400 . 1 . . . A 104 ILE CA . 17509 1 1113 . 1 1 104 104 ILE CB C 13 39.929 0.400 . 1 . . . A 104 ILE CB . 17509 1 1114 . 1 1 104 104 ILE CG1 C 13 30.053 0.400 . 1 . . . A 104 ILE CG1 . 17509 1 1115 . 1 1 104 104 ILE CG2 C 13 17.046 0.400 . 1 . . . A 104 ILE CG2 . 17509 1 1116 . 1 1 104 104 ILE CD1 C 13 14.640 0.400 . 1 . . . A 104 ILE CD1 . 17509 1 1117 . 1 1 104 104 ILE N N 15 117.399 0.400 . 1 . . . A 104 ILE N . 17509 1 1118 . 1 1 105 105 GLU H H 1 7.418 0.020 . 1 . . . A 105 GLU H . 17509 1 1119 . 1 1 105 105 GLU HA H 1 4.500 0.020 . 1 . . . A 105 GLU HA . 17509 1 1120 . 1 1 105 105 GLU HB2 H 1 2.167 0.020 . 2 . . . A 105 GLU HB2 . 17509 1 1121 . 1 1 105 105 GLU HB3 H 1 1.912 0.020 . 2 . . . A 105 GLU HB3 . 17509 1 1122 . 1 1 105 105 GLU HG2 H 1 2.002 0.020 . 2 . . . A 105 GLU HG2 . 17509 1 1123 . 1 1 105 105 GLU HG3 H 1 1.906 0.020 . 2 . . . A 105 GLU HG3 . 17509 1 1124 . 1 1 105 105 GLU CA C 13 60.251 0.400 . 1 . . . A 105 GLU CA . 17509 1 1125 . 1 1 105 105 GLU CB C 13 30.733 0.400 . 1 . . . A 105 GLU CB . 17509 1 1126 . 1 1 105 105 GLU CG C 13 37.268 0.400 . 1 . . . A 105 GLU CG . 17509 1 1127 . 1 1 105 105 GLU N N 15 123.867 0.400 . 1 . . . A 105 GLU N . 17509 1 1128 . 1 1 106 106 GLY H H 1 8.609 0.020 . 1 . . . A 106 GLY H . 17509 1 1129 . 1 1 106 106 GLY HA2 H 1 3.714 0.020 . 2 . . . A 106 GLY HA2 . 17509 1 1130 . 1 1 106 106 GLY HA3 H 1 3.863 0.020 . 2 . . . A 106 GLY HA3 . 17509 1 1131 . 1 1 106 106 GLY CA C 13 47.227 0.400 . 1 . . . A 106 GLY CA . 17509 1 1132 . 1 1 106 106 GLY N N 15 104.684 0.400 . 1 . . . A 106 GLY N . 17509 1 1133 . 1 1 107 107 ALA H H 1 7.941 0.020 . 1 . . . A 107 ALA H . 17509 1 1134 . 1 1 107 107 ALA HA H 1 4.260 0.020 . 1 . . . A 107 ALA HA . 17509 1 1135 . 1 1 107 107 ALA HB1 H 1 1.497 0.020 . 1 . . . A 107 ALA HB1 . 17509 1 1136 . 1 1 107 107 ALA HB2 H 1 1.497 0.020 . 1 . . . A 107 ALA HB2 . 17509 1 1137 . 1 1 107 107 ALA HB3 H 1 1.497 0.020 . 1 . . . A 107 ALA HB3 . 17509 1 1138 . 1 1 107 107 ALA CA C 13 54.620 0.400 . 1 . . . A 107 ALA CA . 17509 1 1139 . 1 1 107 107 ALA CB C 13 18.054 0.400 . 1 . . . A 107 ALA CB . 17509 1 1140 . 1 1 107 107 ALA N N 15 124.998 0.400 . 1 . . . A 107 ALA N . 17509 1 1141 . 1 1 108 108 TYR H H 1 9.069 0.020 . 1 . . . A 108 TYR H . 17509 1 1142 . 1 1 108 108 TYR HA H 1 4.210 0.020 . 1 . . . A 108 TYR HA . 17509 1 1143 . 1 1 108 108 TYR HB2 H 1 3.237 0.020 . 2 . . . A 108 TYR HB2 . 17509 1 1144 . 1 1 108 108 TYR HB3 H 1 3.066 0.020 . 2 . . . A 108 TYR HB3 . 17509 1 1145 . 1 1 108 108 TYR HD1 H 1 6.583 0.020 . 3 . . . A 108 TYR HD1 . 17509 1 1146 . 1 1 108 108 TYR HD2 H 1 6.583 0.020 . 3 . . . A 108 TYR HD2 . 17509 1 1147 . 1 1 108 108 TYR CA C 13 62.152 0.400 . 1 . . . A 108 TYR CA . 17509 1 1148 . 1 1 108 108 TYR CB C 13 38.462 0.400 . 1 . . . A 108 TYR CB . 17509 1 1149 . 1 1 108 108 TYR CD1 C 13 131.988 0.400 . 3 . . . A 108 TYR CD1 . 17509 1 1150 . 1 1 108 108 TYR CD2 C 13 131.988 0.400 . 3 . . . A 108 TYR CD2 . 17509 1 1151 . 1 1 108 108 TYR N N 15 123.328 0.400 . 1 . . . A 108 TYR N . 17509 1 1152 . 1 1 109 109 LEU H H 1 8.614 0.020 . 1 . . . A 109 LEU H . 17509 1 1153 . 1 1 109 109 LEU HA H 1 3.371 0.020 . 1 . . . A 109 LEU HA . 17509 1 1154 . 1 1 109 109 LEU HB2 H 1 1.730 0.020 . 2 . . . A 109 LEU HB2 . 17509 1 1155 . 1 1 109 109 LEU HB3 H 1 1.175 0.020 . 2 . . . A 109 LEU HB3 . 17509 1 1156 . 1 1 109 109 LEU HG H 1 1.755 0.020 . 1 . . . A 109 LEU HG . 17509 1 1157 . 1 1 109 109 LEU HD11 H 1 0.742 0.020 . 2 . . . A 109 LEU HD11 . 17509 1 1158 . 1 1 109 109 LEU HD12 H 1 0.742 0.020 . 2 . . . A 109 LEU HD12 . 17509 1 1159 . 1 1 109 109 LEU HD13 H 1 0.742 0.020 . 2 . . . A 109 LEU HD13 . 17509 1 1160 . 1 1 109 109 LEU HD21 H 1 0.268 0.020 . 2 . . . A 109 LEU HD21 . 17509 1 1161 . 1 1 109 109 LEU HD22 H 1 0.268 0.020 . 2 . . . A 109 LEU HD22 . 17509 1 1162 . 1 1 109 109 LEU HD23 H 1 0.268 0.020 . 2 . . . A 109 LEU HD23 . 17509 1 1163 . 1 1 109 109 LEU CA C 13 57.651 0.400 . 1 . . . A 109 LEU CA . 17509 1 1164 . 1 1 109 109 LEU CB C 13 41.132 0.400 . 1 . . . A 109 LEU CB . 17509 1 1165 . 1 1 109 109 LEU CG C 13 27.145 0.400 . 1 . . . A 109 LEU CG . 17509 1 1166 . 1 1 109 109 LEU CD1 C 13 25.752 0.400 . 2 . . . A 109 LEU CD1 . 17509 1 1167 . 1 1 109 109 LEU CD2 C 13 21.124 0.400 . 2 . . . A 109 LEU CD2 . 17509 1 1168 . 1 1 109 109 LEU N N 15 117.313 0.400 . 1 . . . A 109 LEU N . 17509 1 1169 . 1 1 110 110 ASN H H 1 7.723 0.020 . 1 . . . A 110 ASN H . 17509 1 1170 . 1 1 110 110 ASN HA H 1 4.380 0.020 . 1 . . . A 110 ASN HA . 17509 1 1171 . 1 1 110 110 ASN HB2 H 1 2.810 0.020 . 2 . . . A 110 ASN HB2 . 17509 1 1172 . 1 1 110 110 ASN HB3 H 1 2.725 0.020 . 2 . . . A 110 ASN HB3 . 17509 1 1173 . 1 1 110 110 ASN HD21 H 1 7.803 0.020 . 2 . . . A 110 ASN HD21 . 17509 1 1174 . 1 1 110 110 ASN HD22 H 1 6.956 0.020 . 2 . . . A 110 ASN HD22 . 17509 1 1175 . 1 1 110 110 ASN CA C 13 56.404 0.400 . 1 . . . A 110 ASN CA . 17509 1 1176 . 1 1 110 110 ASN CB C 13 39.628 0.400 . 1 . . . A 110 ASN CB . 17509 1 1177 . 1 1 110 110 ASN N N 15 114.981 0.400 . 1 . . . A 110 ASN N . 17509 1 1178 . 1 1 110 110 ASN ND2 N 15 113.709 0.400 . 1 . . . A 110 ASN ND2 . 17509 1 1179 . 1 1 111 111 ALA H H 1 8.286 0.020 . 1 . . . A 111 ALA H . 17509 1 1180 . 1 1 111 111 ALA HA H 1 4.000 0.020 . 1 . . . A 111 ALA HA . 17509 1 1181 . 1 1 111 111 ALA HB1 H 1 1.334 0.020 . 1 . . . A 111 ALA HB1 . 17509 1 1182 . 1 1 111 111 ALA HB2 H 1 1.334 0.020 . 1 . . . A 111 ALA HB2 . 17509 1 1183 . 1 1 111 111 ALA HB3 H 1 1.334 0.020 . 1 . . . A 111 ALA HB3 . 17509 1 1184 . 1 1 111 111 ALA CA C 13 55.619 0.400 . 1 . . . A 111 ALA CA . 17509 1 1185 . 1 1 111 111 ALA CB C 13 18.628 0.400 . 1 . . . A 111 ALA CB . 17509 1 1186 . 1 1 111 111 ALA N N 15 126.092 0.400 . 1 . . . A 111 ALA N . 17509 1 1187 . 1 1 112 112 LEU H H 1 6.882 0.020 . 1 . . . A 112 LEU H . 17509 1 1188 . 1 1 112 112 LEU HA H 1 3.661 0.020 . 1 . . . A 112 LEU HA . 17509 1 1189 . 1 1 112 112 LEU HB2 H 1 1.240 0.020 . 2 . . . A 112 LEU HB2 . 17509 1 1190 . 1 1 112 112 LEU HB3 H 1 0.828 0.020 . 2 . . . A 112 LEU HB3 . 17509 1 1191 . 1 1 112 112 LEU HG H 1 0.912 0.020 . 1 . . . A 112 LEU HG . 17509 1 1192 . 1 1 112 112 LEU HD11 H 1 -0.256 0.020 . 2 . . . A 112 LEU HD11 . 17509 1 1193 . 1 1 112 112 LEU HD12 H 1 -0.256 0.020 . 2 . . . A 112 LEU HD12 . 17509 1 1194 . 1 1 112 112 LEU HD13 H 1 -0.256 0.020 . 2 . . . A 112 LEU HD13 . 17509 1 1195 . 1 1 112 112 LEU HD21 H 1 0.106 0.020 . 2 . . . A 112 LEU HD21 . 17509 1 1196 . 1 1 112 112 LEU HD22 H 1 0.106 0.020 . 2 . . . A 112 LEU HD22 . 17509 1 1197 . 1 1 112 112 LEU HD23 H 1 0.106 0.020 . 2 . . . A 112 LEU HD23 . 17509 1 1198 . 1 1 112 112 LEU CA C 13 56.674 0.400 . 1 . . . A 112 LEU CA . 17509 1 1199 . 1 1 112 112 LEU CB C 13 39.793 0.400 . 1 . . . A 112 LEU CB . 17509 1 1200 . 1 1 112 112 LEU CG C 13 25.344 0.400 . 1 . . . A 112 LEU CG . 17509 1 1201 . 1 1 112 112 LEU CD1 C 13 24.501 0.400 . 2 . . . A 112 LEU CD1 . 17509 1 1202 . 1 1 112 112 LEU CD2 C 13 19.375 0.400 . 2 . . . A 112 LEU CD2 . 17509 1 1203 . 1 1 112 112 LEU N N 15 111.601 0.400 . 1 . . . A 112 LEU N . 17509 1 1204 . 1 1 113 113 THR H H 1 7.339 0.020 . 1 . . . A 113 THR H . 17509 1 1205 . 1 1 113 113 THR HA H 1 4.496 0.020 . 1 . . . A 113 THR HA . 17509 1 1206 . 1 1 113 113 THR HB H 1 4.303 0.020 . 1 . . . A 113 THR HB . 17509 1 1207 . 1 1 113 113 THR HG21 H 1 1.177 0.020 . 1 . . . A 113 THR HG21 . 17509 1 1208 . 1 1 113 113 THR HG22 H 1 1.177 0.020 . 1 . . . A 113 THR HG22 . 17509 1 1209 . 1 1 113 113 THR HG23 H 1 1.177 0.020 . 1 . . . A 113 THR HG23 . 17509 1 1210 . 1 1 113 113 THR CA C 13 61.782 0.400 . 1 . . . A 113 THR CA . 17509 1 1211 . 1 1 113 113 THR CB C 13 69.221 0.400 . 1 . . . A 113 THR CB . 17509 1 1212 . 1 1 113 113 THR CG2 C 13 21.811 0.400 . 1 . . . A 113 THR CG2 . 17509 1 1213 . 1 1 113 113 THR N N 15 105.777 0.400 . 1 . . . A 113 THR N . 17509 1 1214 . 1 1 114 114 HIS H H 1 8.021 0.020 . 1 . . . A 114 HIS H . 17509 1 1215 . 1 1 114 114 HIS HA H 1 4.751 0.020 . 1 . . . A 114 HIS HA . 17509 1 1216 . 1 1 114 114 HIS HB2 H 1 3.949 0.020 . 2 . . . A 114 HIS HB2 . 17509 1 1217 . 1 1 114 114 HIS HB3 H 1 2.760 0.020 . 2 . . . A 114 HIS HB3 . 17509 1 1218 . 1 1 114 114 HIS HD2 H 1 7.284 0.020 . 1 . . . A 114 HIS HD2 . 17509 1 1219 . 1 1 114 114 HIS HE1 H 1 8.441 0.020 . 1 . . . A 114 HIS HE1 . 17509 1 1220 . 1 1 114 114 HIS CA C 13 55.907 0.400 . 1 . . . A 114 HIS CA . 17509 1 1221 . 1 1 114 114 HIS CB C 13 29.351 0.400 . 1 . . . A 114 HIS CB . 17509 1 1222 . 1 1 114 114 HIS CD2 C 13 120.743 0.400 . 1 . . . A 114 HIS CD2 . 17509 1 1223 . 1 1 114 114 HIS CE1 C 13 135.659 0.400 . 1 . . . A 114 HIS CE1 . 17509 1 1224 . 1 1 114 114 HIS N N 15 121.664 0.400 . 1 . . . A 114 HIS N . 17509 1 1225 . 1 1 115 115 ILE H H 1 7.358 0.020 . 1 . . . A 115 ILE H . 17509 1 1226 . 1 1 115 115 ILE HA H 1 3.565 0.020 . 1 . . . A 115 ILE HA . 17509 1 1227 . 1 1 115 115 ILE HB H 1 1.798 0.020 . 1 . . . A 115 ILE HB . 17509 1 1228 . 1 1 115 115 ILE HG12 H 1 1.990 0.020 . 2 . . . A 115 ILE HG12 . 17509 1 1229 . 1 1 115 115 ILE HG13 H 1 0.663 0.020 . 2 . . . A 115 ILE HG13 . 17509 1 1230 . 1 1 115 115 ILE HG21 H 1 0.819 0.020 . 1 . . . A 115 ILE HG21 . 17509 1 1231 . 1 1 115 115 ILE HG22 H 1 0.819 0.020 . 1 . . . A 115 ILE HG22 . 17509 1 1232 . 1 1 115 115 ILE HG23 H 1 0.819 0.020 . 1 . . . A 115 ILE HG23 . 17509 1 1233 . 1 1 115 115 ILE HD11 H 1 1.035 0.020 . 1 . . . A 115 ILE HD11 . 17509 1 1234 . 1 1 115 115 ILE HD12 H 1 1.035 0.020 . 1 . . . A 115 ILE HD12 . 17509 1 1235 . 1 1 115 115 ILE HD13 H 1 1.035 0.020 . 1 . . . A 115 ILE HD13 . 17509 1 1236 . 1 1 115 115 ILE CA C 13 64.390 0.400 . 1 . . . A 115 ILE CA . 17509 1 1237 . 1 1 115 115 ILE CB C 13 39.588 0.400 . 1 . . . A 115 ILE CB . 17509 1 1238 . 1 1 115 115 ILE CG1 C 13 28.228 0.400 . 1 . . . A 115 ILE CG1 . 17509 1 1239 . 1 1 115 115 ILE CG2 C 13 19.067 0.400 . 1 . . . A 115 ILE CG2 . 17509 1 1240 . 1 1 115 115 ILE CD1 C 13 16.027 0.400 . 1 . . . A 115 ILE CD1 . 17509 1 1241 . 1 1 115 115 ILE N N 15 120.375 0.400 . 1 . . . A 115 ILE N . 17509 1 1242 . 1 1 116 116 ASP H H 1 9.575 0.020 . 1 . . . A 116 ASP H . 17509 1 1243 . 1 1 116 116 ASP HA H 1 4.920 0.020 . 1 . . . A 116 ASP HA . 17509 1 1244 . 1 1 116 116 ASP HB2 H 1 2.454 0.020 . 2 . . . A 116 ASP HB2 . 17509 1 1245 . 1 1 116 116 ASP HB3 H 1 2.294 0.020 . 2 . . . A 116 ASP HB3 . 17509 1 1246 . 1 1 116 116 ASP CA C 13 55.433 0.400 . 1 . . . A 116 ASP CA . 17509 1 1247 . 1 1 116 116 ASP CB C 13 44.254 0.400 . 1 . . . A 116 ASP CB . 17509 1 1248 . 1 1 116 116 ASP N N 15 129.927 0.400 . 1 . . . A 116 ASP N . 17509 1 1249 . 1 1 117 117 ARG H H 1 8.184 0.020 . 1 . . . A 117 ARG H . 17509 1 1250 . 1 1 117 117 ARG HA H 1 4.839 0.020 . 1 . . . A 117 ARG HA . 17509 1 1251 . 1 1 117 117 ARG HB2 H 1 1.667 0.020 . 2 . . . A 117 ARG HB2 . 17509 1 1252 . 1 1 117 117 ARG HB3 H 1 1.870 0.020 . 2 . . . A 117 ARG HB3 . 17509 1 1253 . 1 1 117 117 ARG HG2 H 1 1.572 0.020 . 2 . . . A 117 ARG HG2 . 17509 1 1254 . 1 1 117 117 ARG HG3 H 1 1.510 0.020 . 2 . . . A 117 ARG HG3 . 17509 1 1255 . 1 1 117 117 ARG HD2 H 1 3.084 0.020 . 2 . . . A 117 ARG HD2 . 17509 1 1256 . 1 1 117 117 ARG HD3 H 1 3.084 0.020 . 2 . . . A 117 ARG HD3 . 17509 1 1257 . 1 1 117 117 ARG HE H 1 7.166 0.020 . 1 . . . A 117 ARG HE . 17509 1 1258 . 1 1 117 117 ARG CA C 13 54.879 0.400 . 1 . . . A 117 ARG CA . 17509 1 1259 . 1 1 117 117 ARG CB C 13 34.246 0.400 . 1 . . . A 117 ARG CB . 17509 1 1260 . 1 1 117 117 ARG CG C 13 27.130 0.400 . 1 . . . A 117 ARG CG . 17509 1 1261 . 1 1 117 117 ARG CD C 13 43.550 0.400 . 1 . . . A 117 ARG CD . 17509 1 1262 . 1 1 117 117 ARG N N 15 114.521 0.400 . 1 . . . A 117 ARG N . 17509 1 1263 . 1 1 117 117 ARG NE N 15 84.243 0.400 . 1 . . . A 117 ARG NE . 17509 1 1264 . 1 1 118 118 THR H H 1 8.440 0.020 . 1 . . . A 118 THR H . 17509 1 1265 . 1 1 118 118 THR HA H 1 5.118 0.020 . 1 . . . A 118 THR HA . 17509 1 1266 . 1 1 118 118 THR HB H 1 3.688 0.020 . 1 . . . A 118 THR HB . 17509 1 1267 . 1 1 118 118 THR HG21 H 1 0.935 0.020 . 1 . . . A 118 THR HG21 . 17509 1 1268 . 1 1 118 118 THR HG22 H 1 0.935 0.020 . 1 . . . A 118 THR HG22 . 17509 1 1269 . 1 1 118 118 THR HG23 H 1 0.935 0.020 . 1 . . . A 118 THR HG23 . 17509 1 1270 . 1 1 118 118 THR CA C 13 61.657 0.400 . 1 . . . A 118 THR CA . 17509 1 1271 . 1 1 118 118 THR CB C 13 72.774 0.400 . 1 . . . A 118 THR CB . 17509 1 1272 . 1 1 118 118 THR CG2 C 13 22.431 0.400 . 1 . . . A 118 THR CG2 . 17509 1 1273 . 1 1 118 118 THR N N 15 118.639 0.400 . 1 . . . A 118 THR N . 17509 1 1274 . 1 1 119 119 GLY H H 1 8.641 0.020 . 1 . . . A 119 GLY H . 17509 1 1275 . 1 1 119 119 GLY HA2 H 1 3.232 0.020 . 2 . . . A 119 GLY HA2 . 17509 1 1276 . 1 1 119 119 GLY HA3 H 1 4.492 0.020 . 2 . . . A 119 GLY HA3 . 17509 1 1277 . 1 1 119 119 GLY CA C 13 44.513 0.400 . 1 . . . A 119 GLY CA . 17509 1 1278 . 1 1 119 119 GLY N N 15 112.235 0.400 . 1 . . . A 119 GLY N . 17509 1 1279 . 1 1 120 120 VAL H H 1 8.400 0.020 . 1 . . . A 120 VAL H . 17509 1 1280 . 1 1 120 120 VAL HA H 1 4.749 0.020 . 1 . . . A 120 VAL HA . 17509 1 1281 . 1 1 120 120 VAL HB H 1 1.842 0.020 . 1 . . . A 120 VAL HB . 17509 1 1282 . 1 1 120 120 VAL HG11 H 1 0.898 0.020 . 2 . . . A 120 VAL HG11 . 17509 1 1283 . 1 1 120 120 VAL HG12 H 1 0.898 0.020 . 2 . . . A 120 VAL HG12 . 17509 1 1284 . 1 1 120 120 VAL HG13 H 1 0.898 0.020 . 2 . . . A 120 VAL HG13 . 17509 1 1285 . 1 1 120 120 VAL HG21 H 1 0.651 0.020 . 2 . . . A 120 VAL HG21 . 17509 1 1286 . 1 1 120 120 VAL HG22 H 1 0.651 0.020 . 2 . . . A 120 VAL HG22 . 17509 1 1287 . 1 1 120 120 VAL HG23 H 1 0.651 0.020 . 2 . . . A 120 VAL HG23 . 17509 1 1288 . 1 1 120 120 VAL CA C 13 57.759 0.400 . 1 . . . A 120 VAL CA . 17509 1 1289 . 1 1 120 120 VAL CB C 13 35.617 0.400 . 1 . . . A 120 VAL CB . 17509 1 1290 . 1 1 120 120 VAL CG1 C 13 21.741 0.400 . 2 . . . A 120 VAL CG1 . 17509 1 1291 . 1 1 120 120 VAL CG2 C 13 21.303 0.400 . 2 . . . A 120 VAL CG2 . 17509 1 1292 . 1 1 120 120 VAL N N 15 120.887 0.400 . 1 . . . A 120 VAL N . 17509 1 1293 . 1 1 121 121 GLN H H 1 9.115 0.020 . 1 . . . A 121 GLN H . 17509 1 1294 . 1 1 121 121 GLN HA H 1 4.610 0.020 . 1 . . . A 121 GLN HA . 17509 1 1295 . 1 1 121 121 GLN HB2 H 1 2.066 0.020 . 2 . . . A 121 GLN HB2 . 17509 1 1296 . 1 1 121 121 GLN HB3 H 1 1.393 0.020 . 2 . . . A 121 GLN HB3 . 17509 1 1297 . 1 1 121 121 GLN HG2 H 1 2.096 0.020 . 2 . . . A 121 GLN HG2 . 17509 1 1298 . 1 1 121 121 GLN HG3 H 1 2.096 0.020 . 2 . . . A 121 GLN HG3 . 17509 1 1299 . 1 1 121 121 GLN HE21 H 1 6.954 0.020 . 2 . . . A 121 GLN HE21 . 17509 1 1300 . 1 1 121 121 GLN HE22 H 1 7.234 0.020 . 2 . . . A 121 GLN HE22 . 17509 1 1301 . 1 1 121 121 GLN CA C 13 55.150 0.400 . 1 . . . A 121 GLN CA . 17509 1 1302 . 1 1 121 121 GLN CB C 13 31.212 0.400 . 1 . . . A 121 GLN CB . 17509 1 1303 . 1 1 121 121 GLN CG C 13 34.697 0.400 . 1 . . . A 121 GLN CG . 17509 1 1304 . 1 1 121 121 GLN N N 15 130.881 0.400 . 1 . . . A 121 GLN N . 17509 1 1305 . 1 1 121 121 GLN NE2 N 15 111.725 0.400 . 1 . . . A 121 GLN NE2 . 17509 1 1306 . 1 1 122 122 MET H H 1 8.469 0.020 . 1 . . . A 122 MET H . 17509 1 1307 . 1 1 122 122 MET HA H 1 4.570 0.020 . 1 . . . A 122 MET HA . 17509 1 1308 . 1 1 122 122 MET HB2 H 1 2.392 0.020 . 2 . . . A 122 MET HB2 . 17509 1 1309 . 1 1 122 122 MET HB3 H 1 2.700 0.020 . 2 . . . A 122 MET HB3 . 17509 1 1310 . 1 1 122 122 MET HG2 H 1 1.983 0.020 . 2 . . . A 122 MET HG2 . 17509 1 1311 . 1 1 122 122 MET HG3 H 1 2.182 0.020 . 2 . . . A 122 MET HG3 . 17509 1 1312 . 1 1 122 122 MET HE1 H 1 2.066 0.020 . 1 . . . A 122 MET HE1 . 17509 1 1313 . 1 1 122 122 MET HE2 H 1 2.066 0.020 . 1 . . . A 122 MET HE2 . 17509 1 1314 . 1 1 122 122 MET HE3 H 1 2.066 0.020 . 1 . . . A 122 MET HE3 . 17509 1 1315 . 1 1 122 122 MET CA C 13 55.509 0.400 . 1 . . . A 122 MET CA . 17509 1 1316 . 1 1 122 122 MET CB C 13 32.583 0.400 . 1 . . . A 122 MET CB . 17509 1 1317 . 1 1 122 122 MET CG C 13 32.353 0.400 . 1 . . . A 122 MET CG . 17509 1 1318 . 1 1 122 122 MET CE C 13 16.694 0.400 . 1 . . . A 122 MET CE . 17509 1 1319 . 1 1 122 122 MET N N 15 121.643 0.400 . 1 . . . A 122 MET N . 17509 1 1320 . 1 1 123 123 ARG H H 1 8.346 0.020 . 1 . . . A 123 ARG H . 17509 1 1321 . 1 1 123 123 ARG HA H 1 4.304 0.020 . 1 . . . A 123 ARG HA . 17509 1 1322 . 1 1 123 123 ARG HB2 H 1 1.768 0.020 . 2 . . . A 123 ARG HB2 . 17509 1 1323 . 1 1 123 123 ARG HB3 H 1 1.707 0.020 . 2 . . . A 123 ARG HB3 . 17509 1 1324 . 1 1 123 123 ARG HG3 H 1 1.766 0.020 . 2 . . . A 123 ARG HG3 . 17509 1 1325 . 1 1 123 123 ARG HD2 H 1 3.155 0.020 . 2 . . . A 123 ARG HD2 . 17509 1 1326 . 1 1 123 123 ARG HD3 H 1 3.155 0.020 . 2 . . . A 123 ARG HD3 . 17509 1 1327 . 1 1 123 123 ARG HE H 1 7.183 0.020 . 1 . . . A 123 ARG HE . 17509 1 1328 . 1 1 123 123 ARG CA C 13 55.570 0.400 . 1 . . . A 123 ARG CA . 17509 1 1329 . 1 1 123 123 ARG CB C 13 30.562 0.400 . 1 . . . A 123 ARG CB . 17509 1 1330 . 1 1 123 123 ARG CG C 13 27.214 0.400 . 1 . . . A 123 ARG CG . 17509 1 1331 . 1 1 123 123 ARG CD C 13 43.559 0.400 . 1 . . . A 123 ARG CD . 17509 1 1332 . 1 1 123 123 ARG N N 15 122.592 0.400 . 1 . . . A 123 ARG N . 17509 1 1333 . 1 1 123 123 ARG NE N 15 84.785 0.400 . 1 . . . A 123 ARG NE . 17509 1 1334 . 1 1 124 124 ALA H H 1 8.295 0.020 . 1 . . . A 124 ALA H . 17509 1 1335 . 1 1 124 124 ALA HA H 1 4.379 0.020 . 1 . . . A 124 ALA HA . 17509 1 1336 . 1 1 124 124 ALA HB1 H 1 1.328 0.020 . 1 . . . A 124 ALA HB1 . 17509 1 1337 . 1 1 124 124 ALA HB2 H 1 1.328 0.020 . 1 . . . A 124 ALA HB2 . 17509 1 1338 . 1 1 124 124 ALA HB3 H 1 1.328 0.020 . 1 . . . A 124 ALA HB3 . 17509 1 1339 . 1 1 124 124 ALA CA C 13 50.781 0.400 . 1 . . . A 124 ALA CA . 17509 1 1340 . 1 1 124 124 ALA CB C 13 17.856 0.400 . 1 . . . A 124 ALA CB . 17509 1 1341 . 1 1 124 124 ALA N N 15 125.003 0.400 . 1 . . . A 124 ALA N . 17509 1 1342 . 1 1 125 125 PRO HA H 1 4.573 0.020 . 1 . . . A 125 PRO HA . 17509 1 1343 . 1 1 125 125 PRO HB2 H 1 2.278 0.020 . 2 . . . A 125 PRO HB2 . 17509 1 1344 . 1 1 125 125 PRO HB3 H 1 2.278 0.020 . 2 . . . A 125 PRO HB3 . 17509 1 1345 . 1 1 125 125 PRO HG2 H 1 2.088 0.020 . 2 . . . A 125 PRO HG2 . 17509 1 1346 . 1 1 125 125 PRO HG3 H 1 1.905 0.020 . 2 . . . A 125 PRO HG3 . 17509 1 1347 . 1 1 125 125 PRO HD2 H 1 3.510 0.020 . 2 . . . A 125 PRO HD2 . 17509 1 1348 . 1 1 125 125 PRO HD3 H 1 3.510 0.020 . 2 . . . A 125 PRO HD3 . 17509 1 1349 . 1 1 125 125 PRO CA C 13 62.256 0.400 . 1 . . . A 125 PRO CA . 17509 1 1350 . 1 1 125 125 PRO CB C 13 33.291 0.400 . 1 . . . A 125 PRO CB . 17509 1 1351 . 1 1 125 125 PRO CG C 13 25.042 0.400 . 1 . . . A 125 PRO CG . 17509 1 1352 . 1 1 125 125 PRO CD C 13 50.287 0.400 . 1 . . . A 125 PRO CD . 17509 1 1353 . 1 1 126 126 GLN H H 1 8.824 0.020 . 1 . . . A 126 GLN H . 17509 1 1354 . 1 1 126 126 GLN HA H 1 4.449 0.020 . 1 . . . A 126 GLN HA . 17509 1 1355 . 1 1 126 126 GLN HB2 H 1 2.058 0.020 . 2 . . . A 126 GLN HB2 . 17509 1 1356 . 1 1 126 126 GLN HB3 H 1 2.119 0.020 . 2 . . . A 126 GLN HB3 . 17509 1 1357 . 1 1 126 126 GLN HG2 H 1 2.347 0.020 . 2 . . . A 126 GLN HG2 . 17509 1 1358 . 1 1 126 126 GLN HG3 H 1 2.347 0.020 . 2 . . . A 126 GLN HG3 . 17509 1 1359 . 1 1 126 126 GLN HE21 H 1 7.491 0.020 . 2 . . . A 126 GLN HE21 . 17509 1 1360 . 1 1 126 126 GLN HE22 H 1 7.023 0.020 . 2 . . . A 126 GLN HE22 . 17509 1 1361 . 1 1 126 126 GLN CA C 13 57.600 0.400 . 1 . . . A 126 GLN CA . 17509 1 1362 . 1 1 126 126 GLN CB C 13 29.800 0.400 . 1 . . . A 126 GLN CB . 17509 1 1363 . 1 1 126 126 GLN CG C 13 34.549 0.400 . 1 . . . A 126 GLN CG . 17509 1 1364 . 1 1 126 126 GLN N N 15 124.447 0.400 . 1 . . . A 126 GLN N . 17509 1 1365 . 1 1 126 126 GLN NE2 N 15 110.322 0.400 . 1 . . . A 126 GLN NE2 . 17509 1 1366 . 1 1 127 127 GLN H H 1 8.422 0.020 . 1 . . . A 127 GLN H . 17509 1 1367 . 1 1 127 127 GLN HA H 1 5.882 0.020 . 1 . . . A 127 GLN HA . 17509 1 1368 . 1 1 127 127 GLN HB2 H 1 2.197 0.020 . 2 . . . A 127 GLN HB2 . 17509 1 1369 . 1 1 127 127 GLN HB3 H 1 2.142 0.020 . 2 . . . A 127 GLN HB3 . 17509 1 1370 . 1 1 127 127 GLN HG2 H 1 2.735 0.020 . 2 . . . A 127 GLN HG2 . 17509 1 1371 . 1 1 127 127 GLN HG3 H 1 2.490 0.020 . 2 . . . A 127 GLN HG3 . 17509 1 1372 . 1 1 127 127 GLN HE21 H 1 6.586 0.020 . 2 . . . A 127 GLN HE21 . 17509 1 1373 . 1 1 127 127 GLN HE22 H 1 8.223 0.020 . 2 . . . A 127 GLN HE22 . 17509 1 1374 . 1 1 127 127 GLN CA C 13 55.265 0.400 . 1 . . . A 127 GLN CA . 17509 1 1375 . 1 1 127 127 GLN CB C 13 35.933 0.400 . 1 . . . A 127 GLN CB . 17509 1 1376 . 1 1 127 127 GLN CG C 13 35.172 0.400 . 1 . . . A 127 GLN CG . 17509 1 1377 . 1 1 127 127 GLN N N 15 119.552 0.400 . 1 . . . A 127 GLN N . 17509 1 1378 . 1 1 127 127 GLN NE2 N 15 113.573 0.400 . 1 . . . A 127 GLN NE2 . 17509 1 1379 . 1 1 128 128 MET H H 1 8.938 0.020 . 1 . . . A 128 MET H . 17509 1 1380 . 1 1 128 128 MET HA H 1 4.991 0.020 . 1 . . . A 128 MET HA . 17509 1 1381 . 1 1 128 128 MET HB2 H 1 0.767 0.020 . 2 . . . A 128 MET HB2 . 17509 1 1382 . 1 1 128 128 MET HB3 H 1 0.533 0.020 . 2 . . . A 128 MET HB3 . 17509 1 1383 . 1 1 128 128 MET HG2 H 1 1.609 0.020 . 2 . . . A 128 MET HG2 . 17509 1 1384 . 1 1 128 128 MET HG3 H 1 1.609 0.020 . 2 . . . A 128 MET HG3 . 17509 1 1385 . 1 1 128 128 MET HE1 H 1 0.169 0.020 . 1 . . . A 128 MET HE1 . 17509 1 1386 . 1 1 128 128 MET HE2 H 1 0.169 0.020 . 1 . . . A 128 MET HE2 . 17509 1 1387 . 1 1 128 128 MET HE3 H 1 0.169 0.020 . 1 . . . A 128 MET HE3 . 17509 1 1388 . 1 1 128 128 MET CA C 13 54.052 0.400 . 1 . . . A 128 MET CA . 17509 1 1389 . 1 1 128 128 MET CB C 13 35.277 0.400 . 1 . . . A 128 MET CB . 17509 1 1390 . 1 1 128 128 MET CG C 13 30.650 0.400 . 1 . . . A 128 MET CG . 17509 1 1391 . 1 1 128 128 MET CE C 13 14.633 0.400 . 1 . . . A 128 MET CE . 17509 1 1392 . 1 1 128 128 MET N N 15 123.016 0.400 . 1 . . . A 128 MET N . 17509 1 1393 . 1 1 129 129 GLN H H 1 8.934 0.020 . 1 . . . A 129 GLN H . 17509 1 1394 . 1 1 129 129 GLN HA H 1 5.516 0.020 . 1 . . . A 129 GLN HA . 17509 1 1395 . 1 1 129 129 GLN HB2 H 1 1.036 0.020 . 2 . . . A 129 GLN HB2 . 17509 1 1396 . 1 1 129 129 GLN HB3 H 1 1.238 0.020 . 2 . . . A 129 GLN HB3 . 17509 1 1397 . 1 1 129 129 GLN HG2 H 1 1.809 0.020 . 2 . . . A 129 GLN HG2 . 17509 1 1398 . 1 1 129 129 GLN HG3 H 1 1.735 0.020 . 2 . . . A 129 GLN HG3 . 17509 1 1399 . 1 1 129 129 GLN HE21 H 1 6.512 0.020 . 2 . . . A 129 GLN HE21 . 17509 1 1400 . 1 1 129 129 GLN HE22 H 1 6.975 0.020 . 2 . . . A 129 GLN HE22 . 17509 1 1401 . 1 1 129 129 GLN CA C 13 53.741 0.400 . 1 . . . A 129 GLN CA . 17509 1 1402 . 1 1 129 129 GLN CB C 13 32.737 0.400 . 1 . . . A 129 GLN CB . 17509 1 1403 . 1 1 129 129 GLN CG C 13 34.651 0.400 . 1 . . . A 129 GLN CG . 17509 1 1404 . 1 1 129 129 GLN N N 15 124.593 0.400 . 1 . . . A 129 GLN N . 17509 1 1405 . 1 1 129 129 GLN NE2 N 15 110.439 0.400 . 1 . . . A 129 GLN NE2 . 17509 1 1406 . 1 1 130 130 LEU H H 1 9.191 0.020 . 1 . . . A 130 LEU H . 17509 1 1407 . 1 1 130 130 LEU HA H 1 5.034 0.020 . 1 . . . A 130 LEU HA . 17509 1 1408 . 1 1 130 130 LEU HB2 H 1 1.818 0.020 . 2 . . . A 130 LEU HB2 . 17509 1 1409 . 1 1 130 130 LEU HB3 H 1 1.211 0.020 . 2 . . . A 130 LEU HB3 . 17509 1 1410 . 1 1 130 130 LEU HG H 1 1.674 0.020 . 1 . . . A 130 LEU HG . 17509 1 1411 . 1 1 130 130 LEU HD11 H 1 0.826 0.020 . 2 . . . A 130 LEU HD11 . 17509 1 1412 . 1 1 130 130 LEU HD12 H 1 0.826 0.020 . 2 . . . A 130 LEU HD12 . 17509 1 1413 . 1 1 130 130 LEU HD13 H 1 0.826 0.020 . 2 . . . A 130 LEU HD13 . 17509 1 1414 . 1 1 130 130 LEU HD21 H 1 0.688 0.020 . 2 . . . A 130 LEU HD21 . 17509 1 1415 . 1 1 130 130 LEU HD22 H 1 0.688 0.020 . 2 . . . A 130 LEU HD22 . 17509 1 1416 . 1 1 130 130 LEU HD23 H 1 0.688 0.020 . 2 . . . A 130 LEU HD23 . 17509 1 1417 . 1 1 130 130 LEU CA C 13 52.918 0.400 . 1 . . . A 130 LEU CA . 17509 1 1418 . 1 1 130 130 LEU CB C 13 43.898 0.400 . 1 . . . A 130 LEU CB . 17509 1 1419 . 1 1 130 130 LEU CG C 13 26.758 0.400 . 1 . . . A 130 LEU CG . 17509 1 1420 . 1 1 130 130 LEU CD1 C 13 24.643 0.400 . 2 . . . A 130 LEU CD1 . 17509 1 1421 . 1 1 130 130 LEU CD2 C 13 25.090 0.400 . 2 . . . A 130 LEU CD2 . 17509 1 1422 . 1 1 130 130 LEU N N 15 123.438 0.400 . 1 . . . A 130 LEU N . 17509 1 1423 . 1 1 131 131 VAL H H 1 8.690 0.020 . 1 . . . A 131 VAL H . 17509 1 1424 . 1 1 131 131 VAL HA H 1 4.873 0.020 . 1 . . . A 131 VAL HA . 17509 1 1425 . 1 1 131 131 VAL HB H 1 1.801 0.020 . 1 . . . A 131 VAL HB . 17509 1 1426 . 1 1 131 131 VAL HG11 H 1 0.951 0.020 . 2 . . . A 131 VAL HG11 . 17509 1 1427 . 1 1 131 131 VAL HG12 H 1 0.951 0.020 . 2 . . . A 131 VAL HG12 . 17509 1 1428 . 1 1 131 131 VAL HG13 H 1 0.951 0.020 . 2 . . . A 131 VAL HG13 . 17509 1 1429 . 1 1 131 131 VAL HG21 H 1 0.792 0.020 . 2 . . . A 131 VAL HG21 . 17509 1 1430 . 1 1 131 131 VAL HG22 H 1 0.792 0.020 . 2 . . . A 131 VAL HG22 . 17509 1 1431 . 1 1 131 131 VAL HG23 H 1 0.792 0.020 . 2 . . . A 131 VAL HG23 . 17509 1 1432 . 1 1 131 131 VAL CA C 13 60.966 0.400 . 1 . . . A 131 VAL CA . 17509 1 1433 . 1 1 131 131 VAL CB C 13 32.896 0.400 . 1 . . . A 131 VAL CB . 17509 1 1434 . 1 1 131 131 VAL CG1 C 13 20.551 0.400 . 2 . . . A 131 VAL CG1 . 17509 1 1435 . 1 1 131 131 VAL CG2 C 13 20.571 0.400 . 2 . . . A 131 VAL CG2 . 17509 1 1436 . 1 1 131 131 VAL N N 15 123.401 0.400 . 1 . . . A 131 VAL N . 17509 1 1437 . 1 1 132 132 LEU H H 1 9.328 0.020 . 1 . . . A 132 LEU H . 17509 1 1438 . 1 1 132 132 LEU HA H 1 4.998 0.020 . 1 . . . A 132 LEU HA . 17509 1 1439 . 1 1 132 132 LEU HB2 H 1 2.340 0.020 . 2 . . . A 132 LEU HB2 . 17509 1 1440 . 1 1 132 132 LEU HB3 H 1 1.565 0.020 . 2 . . . A 132 LEU HB3 . 17509 1 1441 . 1 1 132 132 LEU HG H 1 1.435 0.020 . 1 . . . A 132 LEU HG . 17509 1 1442 . 1 1 132 132 LEU HD11 H 1 0.910 0.020 . 2 . . . A 132 LEU HD11 . 17509 1 1443 . 1 1 132 132 LEU HD12 H 1 0.910 0.020 . 2 . . . A 132 LEU HD12 . 17509 1 1444 . 1 1 132 132 LEU HD13 H 1 0.910 0.020 . 2 . . . A 132 LEU HD13 . 17509 1 1445 . 1 1 132 132 LEU HD21 H 1 0.546 0.020 . 2 . . . A 132 LEU HD21 . 17509 1 1446 . 1 1 132 132 LEU HD22 H 1 0.546 0.020 . 2 . . . A 132 LEU HD22 . 17509 1 1447 . 1 1 132 132 LEU HD23 H 1 0.546 0.020 . 2 . . . A 132 LEU HD23 . 17509 1 1448 . 1 1 132 132 LEU CA C 13 53.852 0.400 . 1 . . . A 132 LEU CA . 17509 1 1449 . 1 1 132 132 LEU CB C 13 41.539 0.400 . 1 . . . A 132 LEU CB . 17509 1 1450 . 1 1 132 132 LEU CG C 13 26.944 0.400 . 1 . . . A 132 LEU CG . 17509 1 1451 . 1 1 132 132 LEU CD1 C 13 25.544 0.400 . 2 . . . A 132 LEU CD1 . 17509 1 1452 . 1 1 132 132 LEU CD2 C 13 21.081 0.400 . 2 . . . A 132 LEU CD2 . 17509 1 1453 . 1 1 132 132 LEU N N 15 125.685 0.400 . 1 . . . A 132 LEU N . 17509 1 1454 . 1 1 133 133 ASP H H 1 8.865 0.020 . 1 . . . A 133 ASP H . 17509 1 1455 . 1 1 133 133 ASP HA H 1 4.216 0.020 . 1 . . . A 133 ASP HA . 17509 1 1456 . 1 1 133 133 ASP HB2 H 1 2.950 0.020 . 2 . . . A 133 ASP HB2 . 17509 1 1457 . 1 1 133 133 ASP HB3 H 1 2.677 0.020 . 2 . . . A 133 ASP HB3 . 17509 1 1458 . 1 1 133 133 ASP CA C 13 56.403 0.400 . 1 . . . A 133 ASP CA . 17509 1 1459 . 1 1 133 133 ASP CB C 13 39.583 0.400 . 1 . . . A 133 ASP CB . 17509 1 1460 . 1 1 133 133 ASP N N 15 122.357 0.400 . 1 . . . A 133 ASP N . 17509 1 1461 . 1 1 134 134 ASN H H 1 7.540 0.020 . 1 . . . A 134 ASN H . 17509 1 1462 . 1 1 134 134 ASN HA H 1 4.642 0.020 . 1 . . . A 134 ASN HA . 17509 1 1463 . 1 1 134 134 ASN HB2 H 1 3.230 0.020 . 2 . . . A 134 ASN HB2 . 17509 1 1464 . 1 1 134 134 ASN HB3 H 1 2.710 0.020 . 2 . . . A 134 ASN HB3 . 17509 1 1465 . 1 1 134 134 ASN HD21 H 1 6.557 0.020 . 2 . . . A 134 ASN HD21 . 17509 1 1466 . 1 1 134 134 ASN HD22 H 1 7.182 0.020 . 2 . . . A 134 ASN HD22 . 17509 1 1467 . 1 1 134 134 ASN CA C 13 52.039 0.400 . 1 . . . A 134 ASN CA . 17509 1 1468 . 1 1 134 134 ASN CB C 13 37.813 0.400 . 1 . . . A 134 ASN CB . 17509 1 1469 . 1 1 134 134 ASN N N 15 115.956 0.400 . 1 . . . A 134 ASN N . 17509 1 1470 . 1 1 134 134 ASN ND2 N 15 107.440 0.400 . 1 . . . A 134 ASN ND2 . 17509 1 1471 . 1 1 135 135 GLY H H 1 8.152 0.020 . 1 . . . A 135 GLY H . 17509 1 1472 . 1 1 135 135 GLY HA2 H 1 3.510 0.020 . 2 . . . A 135 GLY HA2 . 17509 1 1473 . 1 1 135 135 GLY HA3 H 1 4.352 0.020 . 2 . . . A 135 GLY HA3 . 17509 1 1474 . 1 1 135 135 GLY CA C 13 44.986 0.400 . 1 . . . A 135 GLY CA . 17509 1 1475 . 1 1 135 135 GLY N N 15 108.055 0.400 . 1 . . . A 135 GLY N . 17509 1 1476 . 1 1 136 136 ASP H H 1 8.196 0.020 . 1 . . . A 136 ASP H . 17509 1 1477 . 1 1 136 136 ASP HA H 1 4.706 0.020 . 1 . . . A 136 ASP HA . 17509 1 1478 . 1 1 136 136 ASP HB2 H 1 2.545 0.020 . 2 . . . A 136 ASP HB2 . 17509 1 1479 . 1 1 136 136 ASP HB3 H 1 2.892 0.020 . 2 . . . A 136 ASP HB3 . 17509 1 1480 . 1 1 136 136 ASP CA C 13 55.277 0.400 . 1 . . . A 136 ASP CA . 17509 1 1481 . 1 1 136 136 ASP CB C 13 41.582 0.400 . 1 . . . A 136 ASP CB . 17509 1 1482 . 1 1 136 136 ASP N N 15 123.488 0.400 . 1 . . . A 136 ASP N . 17509 1 1483 . 1 1 137 137 THR H H 1 8.936 0.020 . 1 . . . A 137 THR H . 17509 1 1484 . 1 1 137 137 THR HA H 1 5.181 0.020 . 1 . . . A 137 THR HA . 17509 1 1485 . 1 1 137 137 THR HB H 1 3.773 0.020 . 1 . . . A 137 THR HB . 17509 1 1486 . 1 1 137 137 THR HG21 H 1 0.927 0.020 . 1 . . . A 137 THR HG21 . 17509 1 1487 . 1 1 137 137 THR HG22 H 1 0.927 0.020 . 1 . . . A 137 THR HG22 . 17509 1 1488 . 1 1 137 137 THR HG23 H 1 0.927 0.020 . 1 . . . A 137 THR HG23 . 17509 1 1489 . 1 1 137 137 THR CA C 13 61.422 0.400 . 1 . . . A 137 THR CA . 17509 1 1490 . 1 1 137 137 THR CB C 13 71.111 0.400 . 1 . . . A 137 THR CB . 17509 1 1491 . 1 1 137 137 THR CG2 C 13 21.379 0.400 . 1 . . . A 137 THR CG2 . 17509 1 1492 . 1 1 137 137 THR N N 15 112.392 0.400 . 1 . . . A 137 THR N . 17509 1 1493 . 1 1 138 138 LEU H H 1 9.401 0.020 . 1 . . . A 138 LEU H . 17509 1 1494 . 1 1 138 138 LEU HA H 1 4.817 0.020 . 1 . . . A 138 LEU HA . 17509 1 1495 . 1 1 138 138 LEU HB2 H 1 1.275 0.020 . 2 . . . A 138 LEU HB2 . 17509 1 1496 . 1 1 138 138 LEU HB3 H 1 1.222 0.020 . 2 . . . A 138 LEU HB3 . 17509 1 1497 . 1 1 138 138 LEU HG H 1 0.644 0.020 . 1 . . . A 138 LEU HG . 17509 1 1498 . 1 1 138 138 LEU HD11 H 1 -0.109 0.020 . 2 . . . A 138 LEU HD11 . 17509 1 1499 . 1 1 138 138 LEU HD12 H 1 -0.109 0.020 . 2 . . . A 138 LEU HD12 . 17509 1 1500 . 1 1 138 138 LEU HD13 H 1 -0.109 0.020 . 2 . . . A 138 LEU HD13 . 17509 1 1501 . 1 1 138 138 LEU HD21 H 1 -0.184 0.020 . 2 . . . A 138 LEU HD21 . 17509 1 1502 . 1 1 138 138 LEU HD22 H 1 -0.184 0.020 . 2 . . . A 138 LEU HD22 . 17509 1 1503 . 1 1 138 138 LEU HD23 H 1 -0.184 0.020 . 2 . . . A 138 LEU HD23 . 17509 1 1504 . 1 1 138 138 LEU CA C 13 55.502 0.400 . 1 . . . A 138 LEU CA . 17509 1 1505 . 1 1 138 138 LEU CB C 13 44.141 0.400 . 1 . . . A 138 LEU CB . 17509 1 1506 . 1 1 138 138 LEU CG C 13 30.838 0.400 . 1 . . . A 138 LEU CG . 17509 1 1507 . 1 1 138 138 LEU CD1 C 13 25.088 0.400 . 2 . . . A 138 LEU CD1 . 17509 1 1508 . 1 1 138 138 LEU CD2 C 13 22.831 0.400 . 2 . . . A 138 LEU CD2 . 17509 1 1509 . 1 1 138 138 LEU N N 15 132.541 0.400 . 1 . . . A 138 LEU N . 17509 1 1510 . 1 1 139 139 THR H H 1 8.855 0.020 . 1 . . . A 139 THR H . 17509 1 1511 . 1 1 139 139 THR HA H 1 5.038 0.020 . 1 . . . A 139 THR HA . 17509 1 1512 . 1 1 139 139 THR HB H 1 3.769 0.020 . 1 . . . A 139 THR HB . 17509 1 1513 . 1 1 139 139 THR HG21 H 1 1.183 0.020 . 1 . . . A 139 THR HG21 . 17509 1 1514 . 1 1 139 139 THR HG22 H 1 1.183 0.020 . 1 . . . A 139 THR HG22 . 17509 1 1515 . 1 1 139 139 THR HG23 H 1 1.183 0.020 . 1 . . . A 139 THR HG23 . 17509 1 1516 . 1 1 139 139 THR CA C 13 62.492 0.400 . 1 . . . A 139 THR CA . 17509 1 1517 . 1 1 139 139 THR CB C 13 70.122 0.400 . 1 . . . A 139 THR CB . 17509 1 1518 . 1 1 139 139 THR CG2 C 13 22.097 0.400 . 1 . . . A 139 THR CG2 . 17509 1 1519 . 1 1 139 139 THR N N 15 118.435 0.400 . 1 . . . A 139 THR N . 17509 1 1520 . 1 1 140 140 PHE H H 1 9.848 0.020 . 1 . . . A 140 PHE H . 17509 1 1521 . 1 1 140 140 PHE HA H 1 5.594 0.020 . 1 . . . A 140 PHE HA . 17509 1 1522 . 1 1 140 140 PHE HB2 H 1 3.290 0.020 . 2 . . . A 140 PHE HB2 . 17509 1 1523 . 1 1 140 140 PHE HB3 H 1 2.893 0.020 . 2 . . . A 140 PHE HB3 . 17509 1 1524 . 1 1 140 140 PHE HD1 H 1 6.984 0.020 . 3 . . . A 140 PHE HD1 . 17509 1 1525 . 1 1 140 140 PHE HD2 H 1 6.984 0.020 . 3 . . . A 140 PHE HD2 . 17509 1 1526 . 1 1 140 140 PHE HE1 H 1 7.032 0.020 . 3 . . . A 140 PHE HE1 . 17509 1 1527 . 1 1 140 140 PHE HE2 H 1 7.032 0.020 . 3 . . . A 140 PHE HE2 . 17509 1 1528 . 1 1 140 140 PHE HZ H 1 7.228 0.020 . 1 . . . A 140 PHE HZ . 17509 1 1529 . 1 1 140 140 PHE CA C 13 55.544 0.400 . 1 . . . A 140 PHE CA . 17509 1 1530 . 1 1 140 140 PHE CB C 13 42.937 0.400 . 1 . . . A 140 PHE CB . 17509 1 1531 . 1 1 140 140 PHE CD1 C 13 131.954 0.400 . 3 . . . A 140 PHE CD1 . 17509 1 1532 . 1 1 140 140 PHE CD2 C 13 131.941 0.400 . 3 . . . A 140 PHE CD2 . 17509 1 1533 . 1 1 140 140 PHE CE1 C 13 131.632 0.400 . 3 . . . A 140 PHE CE1 . 17509 1 1534 . 1 1 140 140 PHE CE2 C 13 131.632 0.400 . 3 . . . A 140 PHE CE2 . 17509 1 1535 . 1 1 140 140 PHE CZ C 13 129.434 0.400 . 1 . . . A 140 PHE CZ . 17509 1 1536 . 1 1 140 140 PHE N N 15 124.899 0.400 . 1 . . . A 140 PHE N . 17509 1 1537 . 1 1 141 141 ASP H H 1 9.623 0.020 . 1 . . . A 141 ASP H . 17509 1 1538 . 1 1 141 141 ASP HA H 1 5.533 0.020 . 1 . . . A 141 ASP HA . 17509 1 1539 . 1 1 141 141 ASP HB2 H 1 2.886 0.020 . 2 . . . A 141 ASP HB2 . 17509 1 1540 . 1 1 141 141 ASP HB3 H 1 2.581 0.020 . 2 . . . A 141 ASP HB3 . 17509 1 1541 . 1 1 141 141 ASP CA C 13 53.430 0.400 . 1 . . . A 141 ASP CA . 17509 1 1542 . 1 1 141 141 ASP CB C 13 43.273 0.400 . 1 . . . A 141 ASP CB . 17509 1 1543 . 1 1 141 141 ASP N N 15 121.729 0.400 . 1 . . . A 141 ASP N . 17509 1 1544 . 1 1 142 142 ARG H H 1 8.229 0.020 . 1 . . . A 142 ARG H . 17509 1 1545 . 1 1 142 142 ARG HA H 1 3.643 0.020 . 1 . . . A 142 ARG HA . 17509 1 1546 . 1 1 142 142 ARG HB2 H 1 1.700 0.020 . 2 . . . A 142 ARG HB2 . 17509 1 1547 . 1 1 142 142 ARG HB3 H 1 1.346 0.020 . 2 . . . A 142 ARG HB3 . 17509 1 1548 . 1 1 142 142 ARG HG2 H 1 1.415 0.020 . 2 . . . A 142 ARG HG2 . 17509 1 1549 . 1 1 142 142 ARG HG3 H 1 1.065 0.020 . 2 . . . A 142 ARG HG3 . 17509 1 1550 . 1 1 142 142 ARG HD2 H 1 2.326 0.020 . 2 . . . A 142 ARG HD2 . 17509 1 1551 . 1 1 142 142 ARG HD3 H 1 2.454 0.020 . 2 . . . A 142 ARG HD3 . 17509 1 1552 . 1 1 142 142 ARG HE H 1 7.169 0.020 . 1 . . . A 142 ARG HE . 17509 1 1553 . 1 1 142 142 ARG CA C 13 56.519 0.400 . 1 . . . A 142 ARG CA . 17509 1 1554 . 1 1 142 142 ARG CB C 13 30.544 0.400 . 1 . . . A 142 ARG CB . 17509 1 1555 . 1 1 142 142 ARG CG C 13 26.593 0.400 . 1 . . . A 142 ARG CG . 17509 1 1556 . 1 1 142 142 ARG CD C 13 42.166 0.400 . 1 . . . A 142 ARG CD . 17509 1 1557 . 1 1 142 142 ARG N N 15 124.283 0.400 . 1 . . . A 142 ARG N . 17509 1 1558 . 1 1 142 142 ARG NE N 15 85.644 0.400 . 1 . . . A 142 ARG NE . 17509 1 1559 . 1 1 143 143 SER H H 1 8.390 0.020 . 1 . . . A 143 SER H . 17509 1 1560 . 1 1 143 143 SER HA H 1 4.515 0.020 . 1 . . . A 143 SER HA . 17509 1 1561 . 1 1 143 143 SER HB2 H 1 3.640 0.020 . 2 . . . A 143 SER HB2 . 17509 1 1562 . 1 1 143 143 SER HB3 H 1 3.514 0.020 . 2 . . . A 143 SER HB3 . 17509 1 1563 . 1 1 143 143 SER CA C 13 57.292 0.400 . 1 . . . A 143 SER CA . 17509 1 1564 . 1 1 143 143 SER CB C 13 63.981 0.400 . 1 . . . A 143 SER CB . 17509 1 1565 . 1 1 143 143 SER N N 15 122.117 0.400 . 1 . . . A 143 SER N . 17509 1 1566 . 1 1 144 144 THR H H 1 8.408 0.020 . 1 . . . A 144 THR H . 17509 1 1567 . 1 1 144 144 THR HA H 1 4.314 0.020 . 1 . . . A 144 THR HA . 17509 1 1568 . 1 1 144 144 THR HB H 1 4.289 0.020 . 1 . . . A 144 THR HB . 17509 1 1569 . 1 1 144 144 THR HG21 H 1 1.128 0.020 . 1 . . . A 144 THR HG21 . 17509 1 1570 . 1 1 144 144 THR HG22 H 1 1.128 0.020 . 1 . . . A 144 THR HG22 . 17509 1 1571 . 1 1 144 144 THR HG23 H 1 1.128 0.020 . 1 . . . A 144 THR HG23 . 17509 1 1572 . 1 1 144 144 THR CA C 13 61.672 0.400 . 1 . . . A 144 THR CA . 17509 1 1573 . 1 1 144 144 THR CB C 13 69.464 0.400 . 1 . . . A 144 THR CB . 17509 1 1574 . 1 1 144 144 THR CG2 C 13 21.546 0.400 . 1 . . . A 144 THR CG2 . 17509 1 1575 . 1 1 144 144 THR N N 15 117.350 0.400 . 1 . . . A 144 THR N . 17509 1 1576 . 1 1 145 145 ARG H H 1 7.768 0.020 . 1 . . . A 145 ARG H . 17509 1 1577 . 1 1 145 145 ARG HA H 1 4.110 0.020 . 1 . . . A 145 ARG HA . 17509 1 1578 . 1 1 145 145 ARG HB2 H 1 1.776 0.020 . 2 . . . A 145 ARG HB2 . 17509 1 1579 . 1 1 145 145 ARG HB3 H 1 1.638 0.020 . 2 . . . A 145 ARG HB3 . 17509 1 1580 . 1 1 145 145 ARG HG2 H 1 1.526 0.020 . 2 . . . A 145 ARG HG2 . 17509 1 1581 . 1 1 145 145 ARG HG3 H 1 1.526 0.020 . 2 . . . A 145 ARG HG3 . 17509 1 1582 . 1 1 145 145 ARG HD2 H 1 3.121 0.020 . 2 . . . A 145 ARG HD2 . 17509 1 1583 . 1 1 145 145 ARG HD3 H 1 3.121 0.020 . 2 . . . A 145 ARG HD3 . 17509 1 1584 . 1 1 145 145 ARG HE H 1 7.143 0.020 . 1 . . . A 145 ARG HE . 17509 1 1585 . 1 1 145 145 ARG CA C 13 57.546 0.400 . 1 . . . A 145 ARG CA . 17509 1 1586 . 1 1 145 145 ARG CB C 13 31.418 0.400 . 1 . . . A 145 ARG CB . 17509 1 1587 . 1 1 145 145 ARG CG C 13 27.113 0.400 . 1 . . . A 145 ARG CG . 17509 1 1588 . 1 1 145 145 ARG CD C 13 43.420 0.400 . 1 . . . A 145 ARG CD . 17509 1 1589 . 1 1 145 145 ARG N N 15 127.153 0.400 . 1 . . . A 145 ARG N . 17509 1 1590 . 1 1 145 145 ARG NE N 15 85.773 0.400 . 1 . . . A 145 ARG NE . 17509 1 stop_ save_