data_10113 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 10113 _Entry.Title ; Solution Structure of the Pleckstrin Homology Domain of Mouse APS ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2007-02-15 _Entry.Accession_date 2007-02-16 _Entry.Last_release_date 2008-08-15 _Entry.Original_release_date 2008-08-15 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version . _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 H. Li . . . 10113 2 N. Tochio . . . 10113 3 S. Koshiba . . . 10113 4 M. Inoue . . . 10113 5 T. Kigawa . . . 10113 6 S. Yokoyama . . . 10113 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . 'Protein Research Group, RIKEN Genomic Sciences Center' . 10113 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 10113 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 556 10113 '15N chemical shifts' 125 10113 '1H chemical shifts' 909 10113 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 . . 2008-08-15 2007-02-15 original author . 10113 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 1V5M 'BMRB Entry Tracking System' 10113 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 10113 _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 'Solution Structure of the Pleckstrin Homology Domain of Mouse APS' _Citation.Status 'in preparation' _Citation.Type journal _Citation.Journal_abbrev . _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 H. Li . . . 10113 1 2 N. Tochio . . . 10113 1 3 S. Koshiba . . . 10113 1 4 M. Inoue . . . 10113 1 5 T. Kigawa . . . 10113 1 6 S. Yokoyama . . . 10113 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 10113 _Assembly.ID 1 _Assembly.Name 'SH2 and PH domain-containing adapter protein APS' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states no _Assembly.Ambiguous_chem_comp_sites no _Assembly.Molecules_in_chemical_exchange no _Assembly.Paramagnetic no _Assembly.Thiol_state 'all free' _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Assembly_type.Type _Assembly_type.Entry_ID _Assembly_type.Assembly_ID 'protein monomer' 10113 1 stop_ 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 'SH2 and PH domain-containing adapter protein APS' 1 $entity_1 . . yes native no no . . . 10113 1 stop_ loop_ _Assembly_db_link.Author_supplied _Assembly_db_link.Database_code _Assembly_db_link.Accession_code _Assembly_db_link.Entry_mol_code _Assembly_db_link.Entry_mol_name _Assembly_db_link.Entry_experimental_method _Assembly_db_link.Entry_structure_resolution _Assembly_db_link.Entry_relation_type _Assembly_db_link.Entry_details _Assembly_db_link.Entry_ID _Assembly_db_link.Assembly_ID . PDB 1V5M . . . . . . 10113 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 10113 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'Pleckstrin Homology Domain' _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GSSGSSGNLAAKVELVDIQR EGALRFMVADDAASGPGGTA QWQKCRLLLRRAVAGERFRL EFFVPPKASRPKVSIPLSAI IEVRTTMPLEMPEKDNTFVL KVENGAEYILETIDSLQKHS WVADIQGCVDSGPSSG ; _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 136 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-26 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 1V5M . "Solution Structure Of The Pleckstrin Homology Domain Of Mouse Aps" . . . . . 100.00 136 100.00 100.00 3.84e-93 . . . . 10113 1 2 no DBJ BAE24331 . "unnamed protein product [Mus musculus]" . . . . . 93.38 621 97.64 97.64 1.53e-78 . . . . 10113 1 3 no DBJ BAE24336 . "unnamed protein product [Mus musculus]" . . . . . 93.38 621 97.64 97.64 1.53e-78 . . . . 10113 1 4 no GB AAC64408 . "APS protein [Rattus norvegicus]" . . . . . 93.38 621 97.64 97.64 1.72e-78 . . . . 10113 1 5 no GB AAF37891 . "APS protein [Mus musculus]" . . . . . 93.38 621 97.64 97.64 1.67e-78 . . . . 10113 1 6 no GB AAH57334 . "SH2B adaptor protein 2 [Mus musculus]" . . . . . 93.38 621 97.64 97.64 1.53e-78 . . . . 10113 1 7 no GB EDL19313 . "SH2B adaptor protein 2, isoform CRA_a [Mus musculus]" . . . . . 93.38 420 97.64 97.64 2.08e-80 . . . . 10113 1 8 no GB EDL19314 . "SH2B adaptor protein 2, isoform CRA_b [Mus musculus]" . . . . . 93.38 481 97.64 97.64 1.46e-79 . . . . 10113 1 9 no REF NP_001289867 . "SH2B adapter protein 2 isoform 1 [Mus musculus]" . . . . . 93.38 621 97.64 97.64 1.53e-78 . . . . 10113 1 10 no REF NP_001289868 . "SH2B adapter protein 2 isoform 2 [Mus musculus]" . . . . . 93.38 420 97.64 97.64 2.08e-80 . . . . 10113 1 11 no REF NP_061295 . "SH2B adapter protein 2 isoform 1 [Mus musculus]" . . . . . 93.38 621 97.64 97.64 1.53e-78 . . . . 10113 1 12 no REF NP_446121 . "SH2B adapter protein 2 [Rattus norvegicus]" . . . . . 93.38 621 97.64 97.64 1.72e-78 . . . . 10113 1 13 no REF XP_005080443 . "PREDICTED: SH2B adapter protein 2 isoform X1 [Mesocricetus auratus]" . . . . . 93.38 616 97.64 97.64 1.14e-78 . . . . 10113 1 14 no SP Q9JID9 . "RecName: Full=SH2B adapter protein 2; AltName: Full=Adapter protein with pleckstrin homology and Src homology 2 domains; AltNam" . . . . . 93.38 621 97.64 97.64 1.53e-78 . . . . 10113 1 15 no SP Q9Z200 . "RecName: Full=SH2B adapter protein 2; AltName: Full=Adapter protein with pleckstrin homology and Src homology 2 domains; AltNam" . . . . . 93.38 621 97.64 97.64 1.72e-78 . . . . 10113 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'Pleckstrin Homology Domain' . 10113 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 . GLY . 10113 1 2 . SER . 10113 1 3 . SER . 10113 1 4 . GLY . 10113 1 5 . SER . 10113 1 6 . SER . 10113 1 7 . GLY . 10113 1 8 . ASN . 10113 1 9 . LEU . 10113 1 10 . ALA . 10113 1 11 . ALA . 10113 1 12 . LYS . 10113 1 13 . VAL . 10113 1 14 . GLU . 10113 1 15 . LEU . 10113 1 16 . VAL . 10113 1 17 . ASP . 10113 1 18 . ILE . 10113 1 19 . GLN . 10113 1 20 . ARG . 10113 1 21 . GLU . 10113 1 22 . GLY . 10113 1 23 . ALA . 10113 1 24 . LEU . 10113 1 25 . ARG . 10113 1 26 . PHE . 10113 1 27 . MET . 10113 1 28 . VAL . 10113 1 29 . ALA . 10113 1 30 . ASP . 10113 1 31 . ASP . 10113 1 32 . ALA . 10113 1 33 . ALA . 10113 1 34 . SER . 10113 1 35 . GLY . 10113 1 36 . PRO . 10113 1 37 . GLY . 10113 1 38 . GLY . 10113 1 39 . THR . 10113 1 40 . ALA . 10113 1 41 . GLN . 10113 1 42 . TRP . 10113 1 43 . GLN . 10113 1 44 . LYS . 10113 1 45 . CYS . 10113 1 46 . ARG . 10113 1 47 . LEU . 10113 1 48 . LEU . 10113 1 49 . LEU . 10113 1 50 . ARG . 10113 1 51 . ARG . 10113 1 52 . ALA . 10113 1 53 . VAL . 10113 1 54 . ALA . 10113 1 55 . GLY . 10113 1 56 . GLU . 10113 1 57 . ARG . 10113 1 58 . PHE . 10113 1 59 . ARG . 10113 1 60 . LEU . 10113 1 61 . GLU . 10113 1 62 . PHE . 10113 1 63 . PHE . 10113 1 64 . VAL . 10113 1 65 . PRO . 10113 1 66 . PRO . 10113 1 67 . LYS . 10113 1 68 . ALA . 10113 1 69 . SER . 10113 1 70 . ARG . 10113 1 71 . PRO . 10113 1 72 . LYS . 10113 1 73 . VAL . 10113 1 74 . SER . 10113 1 75 . ILE . 10113 1 76 . PRO . 10113 1 77 . LEU . 10113 1 78 . SER . 10113 1 79 . ALA . 10113 1 80 . ILE . 10113 1 81 . ILE . 10113 1 82 . GLU . 10113 1 83 . VAL . 10113 1 84 . ARG . 10113 1 85 . THR . 10113 1 86 . THR . 10113 1 87 . MET . 10113 1 88 . PRO . 10113 1 89 . LEU . 10113 1 90 . GLU . 10113 1 91 . MET . 10113 1 92 . PRO . 10113 1 93 . GLU . 10113 1 94 . LYS . 10113 1 95 . ASP . 10113 1 96 . ASN . 10113 1 97 . THR . 10113 1 98 . PHE . 10113 1 99 . VAL . 10113 1 100 . LEU . 10113 1 101 . LYS . 10113 1 102 . VAL . 10113 1 103 . GLU . 10113 1 104 . ASN . 10113 1 105 . GLY . 10113 1 106 . ALA . 10113 1 107 . GLU . 10113 1 108 . TYR . 10113 1 109 . ILE . 10113 1 110 . LEU . 10113 1 111 . GLU . 10113 1 112 . THR . 10113 1 113 . ILE . 10113 1 114 . ASP . 10113 1 115 . SER . 10113 1 116 . LEU . 10113 1 117 . GLN . 10113 1 118 . LYS . 10113 1 119 . HIS . 10113 1 120 . SER . 10113 1 121 . TRP . 10113 1 122 . VAL . 10113 1 123 . ALA . 10113 1 124 . ASP . 10113 1 125 . ILE . 10113 1 126 . GLN . 10113 1 127 . GLY . 10113 1 128 . CYS . 10113 1 129 . VAL . 10113 1 130 . ASP . 10113 1 131 . SER . 10113 1 132 . GLY . 10113 1 133 . PRO . 10113 1 134 . SER . 10113 1 135 . SER . 10113 1 136 . GLY . 10113 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 . GLY 1 1 10113 1 . SER 2 2 10113 1 . SER 3 3 10113 1 . GLY 4 4 10113 1 . SER 5 5 10113 1 . SER 6 6 10113 1 . GLY 7 7 10113 1 . ASN 8 8 10113 1 . LEU 9 9 10113 1 . ALA 10 10 10113 1 . ALA 11 11 10113 1 . LYS 12 12 10113 1 . VAL 13 13 10113 1 . GLU 14 14 10113 1 . LEU 15 15 10113 1 . VAL 16 16 10113 1 . ASP 17 17 10113 1 . ILE 18 18 10113 1 . GLN 19 19 10113 1 . ARG 20 20 10113 1 . GLU 21 21 10113 1 . GLY 22 22 10113 1 . ALA 23 23 10113 1 . LEU 24 24 10113 1 . ARG 25 25 10113 1 . PHE 26 26 10113 1 . MET 27 27 10113 1 . VAL 28 28 10113 1 . ALA 29 29 10113 1 . ASP 30 30 10113 1 . ASP 31 31 10113 1 . ALA 32 32 10113 1 . ALA 33 33 10113 1 . SER 34 34 10113 1 . GLY 35 35 10113 1 . PRO 36 36 10113 1 . GLY 37 37 10113 1 . GLY 38 38 10113 1 . THR 39 39 10113 1 . ALA 40 40 10113 1 . GLN 41 41 10113 1 . TRP 42 42 10113 1 . GLN 43 43 10113 1 . LYS 44 44 10113 1 . CYS 45 45 10113 1 . ARG 46 46 10113 1 . LEU 47 47 10113 1 . LEU 48 48 10113 1 . LEU 49 49 10113 1 . ARG 50 50 10113 1 . ARG 51 51 10113 1 . ALA 52 52 10113 1 . VAL 53 53 10113 1 . ALA 54 54 10113 1 . GLY 55 55 10113 1 . GLU 56 56 10113 1 . ARG 57 57 10113 1 . PHE 58 58 10113 1 . ARG 59 59 10113 1 . LEU 60 60 10113 1 . GLU 61 61 10113 1 . PHE 62 62 10113 1 . PHE 63 63 10113 1 . VAL 64 64 10113 1 . PRO 65 65 10113 1 . PRO 66 66 10113 1 . LYS 67 67 10113 1 . ALA 68 68 10113 1 . SER 69 69 10113 1 . ARG 70 70 10113 1 . PRO 71 71 10113 1 . LYS 72 72 10113 1 . VAL 73 73 10113 1 . SER 74 74 10113 1 . ILE 75 75 10113 1 . PRO 76 76 10113 1 . LEU 77 77 10113 1 . SER 78 78 10113 1 . ALA 79 79 10113 1 . ILE 80 80 10113 1 . ILE 81 81 10113 1 . GLU 82 82 10113 1 . VAL 83 83 10113 1 . ARG 84 84 10113 1 . THR 85 85 10113 1 . THR 86 86 10113 1 . MET 87 87 10113 1 . PRO 88 88 10113 1 . LEU 89 89 10113 1 . GLU 90 90 10113 1 . MET 91 91 10113 1 . PRO 92 92 10113 1 . GLU 93 93 10113 1 . LYS 94 94 10113 1 . ASP 95 95 10113 1 . ASN 96 96 10113 1 . THR 97 97 10113 1 . PHE 98 98 10113 1 . VAL 99 99 10113 1 . LEU 100 100 10113 1 . LYS 101 101 10113 1 . VAL 102 102 10113 1 . GLU 103 103 10113 1 . ASN 104 104 10113 1 . GLY 105 105 10113 1 . ALA 106 106 10113 1 . GLU 107 107 10113 1 . TYR 108 108 10113 1 . ILE 109 109 10113 1 . LEU 110 110 10113 1 . GLU 111 111 10113 1 . THR 112 112 10113 1 . ILE 113 113 10113 1 . ASP 114 114 10113 1 . SER 115 115 10113 1 . LEU 116 116 10113 1 . GLN 117 117 10113 1 . LYS 118 118 10113 1 . HIS 119 119 10113 1 . SER 120 120 10113 1 . TRP 121 121 10113 1 . VAL 122 122 10113 1 . ALA 123 123 10113 1 . ASP 124 124 10113 1 . ILE 125 125 10113 1 . GLN 126 126 10113 1 . GLY 127 127 10113 1 . CYS 128 128 10113 1 . VAL 129 129 10113 1 . ASP 130 130 10113 1 . SER 131 131 10113 1 . GLY 132 132 10113 1 . PRO 133 133 10113 1 . SER 134 134 10113 1 . SER 135 135 10113 1 . GLY 136 136 10113 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 10113 _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 $entity_1 . 10090 . . . mouse . . Eukaryota Metazoa Mus musculus . . . . . . . . . . . . . . . . . . . . . 10113 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 10113 _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 $entity_1 . 'cell free synthesis' . . . . . . . . . . . . . . . . . . . plasmid . . P030212-26 . . . . . . 10113 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 10113 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _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 'Pleckstrin Homology domain' '[U-13C; U-15N]' . . 1 $entity_1 . . 1.23 . . mM . . . . 10113 1 2 d-Tris-HCl . . . . . . buffer 20 . . mM . . . . 10113 1 3 NaCl . . . . . . salt 100 . . mM . . . . 10113 1 4 d-DTT . . . . . . salt 1 . . mM . . . . 10113 1 5 NaN3 . . . . . . . 0.02 . . % . . . . 10113 1 6 H2O . . . . . . solvent 90 . . % . . . . 10113 1 7 D2O . . . . . . solvent 10 . . % . . . . 10113 1 stop_ save_ ####################### # Sample conditions # ####################### save_condition_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode condition_1 _Sample_condition_list.Entry_ID 10113 _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' 120 0.1 mM 10113 1 pH 7.5 0.05 pH 10113 1 pressure 1 0.001 atm 10113 1 temperature 298 0.1 K 10113 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 10113 _Software.ID 1 _Software.Name xwinnmr _Software.Version 2.6 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Bruker . . 10113 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 10113 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 10113 _Software.ID 2 _Software.Name NMRPipe _Software.Version 20020425 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, F.' . . 10113 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 10113 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 10113 _Software.ID 3 _Software.Name NMRView _Software.Version 5.0.4 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Johnson, B.A.' . . 10113 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 10113 3 stop_ save_ save_software_4 _Software.Sf_category software _Software.Sf_framecode software_4 _Software.Entry_ID 10113 _Software.ID 4 _Software.Name Kujira _Software.Version 0.854 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Kobayashi, N.' . . 10113 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 10113 4 stop_ save_ save_software_5 _Software.Sf_category software _Software.Sf_framecode software_5 _Software.Entry_ID 10113 _Software.ID 5 _Software.Name CYANA _Software.Version 2.0.17 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, P.' . . 10113 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 10113 5 'structure solution' 10113 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 10113 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model AVANCE _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ ############################# # NMR applied experiments # ############################# save_NMR_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode NMR_experiment_list _Experiment_list.Entry_ID 10113 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '3D 13C-separated NOESY' no . . . . . . . . . . 1 $sample_1 . . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 10113 1 2 '3D 15N-separated NOESY' no . . . . . . . . . . 1 $sample_1 . . . 1 $condition_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 10113 1 stop_ save_ save_3D_13C-separated_NOESY _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 3D_13C-separated_NOESY _NMR_spec_expt.Entry_ID 10113 _NMR_spec_expt.ID 1 _NMR_spec_expt.Name '3D 13C-separated NOESY' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_1 _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_3D_15N-separated_NOESY _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 3D_15N-separated_NOESY _NMR_spec_expt.Entry_ID 10113 _NMR_spec_expt.ID 2 _NMR_spec_expt.Name '3D 15N-separated NOESY' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID 1 _NMR_spec_expt.NMR_spectrometer_label $spectrometer_1 _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode reference_1 _Chem_shift_reference.Entry_ID 10113 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details ; Chemical shift reference of 1H was based on the proton of water (4.784ppm at 298K) and then those of 15N and 13C were calculated based on their gyromagnetic ratios. ; loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.251449530 . . . . . . . . . 10113 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 . indirect 1.0 . . . . . . . . . 10113 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . . . . . . . 10113 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_chemical_shift_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chemical_shift_1 _Assigned_chem_shift_list.Entry_ID 10113 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $condition_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '3D 13C-separated NOESY' 1 $sample_1 isotropic 10113 1 2 '3D 15N-separated NOESY' 1 $sample_1 isotropic 10113 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 8 8 ASN HA H 1 4.707 0.030 . 1 . . . . 8 ASN HA . 10113 1 2 . 1 1 8 8 ASN HB2 H 1 2.842 0.030 . 2 . . . . 8 ASN HB2 . 10113 1 3 . 1 1 8 8 ASN HB3 H 1 2.752 0.030 . 2 . . . . 8 ASN HB3 . 10113 1 4 . 1 1 8 8 ASN HD21 H 1 6.916 0.030 . 2 . . . . 8 ASN HD21 . 10113 1 5 . 1 1 8 8 ASN HD22 H 1 7.578 0.030 . 2 . . . . 8 ASN HD22 . 10113 1 6 . 1 1 8 8 ASN C C 13 175.396 0.300 . 1 . . . . 8 ASN C . 10113 1 7 . 1 1 8 8 ASN CA C 13 53.262 0.300 . 1 . . . . 8 ASN CA . 10113 1 8 . 1 1 8 8 ASN CB C 13 38.854 0.300 . 1 . . . . 8 ASN CB . 10113 1 9 . 1 1 8 8 ASN ND2 N 15 112.654 0.300 . 1 . . . . 8 ASN ND2 . 10113 1 10 . 1 1 9 9 LEU H H 1 8.241 0.030 . 1 . . . . 9 LEU H . 10113 1 11 . 1 1 9 9 LEU HA H 1 4.333 0.030 . 1 . . . . 9 LEU HA . 10113 1 12 . 1 1 9 9 LEU HB2 H 1 1.723 0.030 . 2 . . . . 9 LEU HB2 . 10113 1 13 . 1 1 9 9 LEU HB3 H 1 1.612 0.030 . 2 . . . . 9 LEU HB3 . 10113 1 14 . 1 1 9 9 LEU HD11 H 1 0.952 0.030 . 1 . . . . 9 LEU HD1 . 10113 1 15 . 1 1 9 9 LEU HD12 H 1 0.952 0.030 . 1 . . . . 9 LEU HD1 . 10113 1 16 . 1 1 9 9 LEU HD13 H 1 0.952 0.030 . 1 . . . . 9 LEU HD1 . 10113 1 17 . 1 1 9 9 LEU HD21 H 1 0.884 0.030 . 1 . . . . 9 LEU HD2 . 10113 1 18 . 1 1 9 9 LEU HD22 H 1 0.884 0.030 . 1 . . . . 9 LEU HD2 . 10113 1 19 . 1 1 9 9 LEU HD23 H 1 0.884 0.030 . 1 . . . . 9 LEU HD2 . 10113 1 20 . 1 1 9 9 LEU C C 13 177.201 0.300 . 1 . . . . 9 LEU C . 10113 1 21 . 1 1 9 9 LEU CA C 13 55.497 0.300 . 1 . . . . 9 LEU CA . 10113 1 22 . 1 1 9 9 LEU CB C 13 42.052 0.300 . 1 . . . . 9 LEU CB . 10113 1 23 . 1 1 9 9 LEU CG C 13 27.029 0.300 . 1 . . . . 9 LEU CG . 10113 1 24 . 1 1 9 9 LEU CD1 C 13 25.142 0.300 . 2 . . . . 9 LEU CD1 . 10113 1 25 . 1 1 9 9 LEU CD2 C 13 23.579 0.300 . 2 . . . . 9 LEU CD2 . 10113 1 26 . 1 1 9 9 LEU N N 15 122.841 0.300 . 1 . . . . 9 LEU N . 10113 1 27 . 1 1 10 10 ALA H H 1 8.164 0.030 . 1 . . . . 10 ALA H . 10113 1 28 . 1 1 10 10 ALA HA H 1 4.308 0.030 . 1 . . . . 10 ALA HA . 10113 1 29 . 1 1 10 10 ALA HB1 H 1 1.363 0.030 . 1 . . . . 10 ALA HB . 10113 1 30 . 1 1 10 10 ALA HB2 H 1 1.363 0.030 . 1 . . . . 10 ALA HB . 10113 1 31 . 1 1 10 10 ALA HB3 H 1 1.363 0.030 . 1 . . . . 10 ALA HB . 10113 1 32 . 1 1 10 10 ALA C C 13 177.359 0.300 . 1 . . . . 10 ALA C . 10113 1 33 . 1 1 10 10 ALA CA C 13 52.494 0.300 . 1 . . . . 10 ALA CA . 10113 1 34 . 1 1 10 10 ALA CB C 13 19.155 0.300 . 1 . . . . 10 ALA CB . 10113 1 35 . 1 1 10 10 ALA N N 15 124.321 0.300 . 1 . . . . 10 ALA N . 10113 1 36 . 1 1 11 11 ALA H H 1 8.077 0.030 . 1 . . . . 11 ALA H . 10113 1 37 . 1 1 11 11 ALA HA H 1 4.278 0.030 . 1 . . . . 11 ALA HA . 10113 1 38 . 1 1 11 11 ALA HB1 H 1 1.377 0.030 . 1 . . . . 11 ALA HB . 10113 1 39 . 1 1 11 11 ALA HB2 H 1 1.377 0.030 . 1 . . . . 11 ALA HB . 10113 1 40 . 1 1 11 11 ALA HB3 H 1 1.377 0.030 . 1 . . . . 11 ALA HB . 10113 1 41 . 1 1 11 11 ALA C C 13 177.573 0.300 . 1 . . . . 11 ALA C . 10113 1 42 . 1 1 11 11 ALA CA C 13 52.393 0.300 . 1 . . . . 11 ALA CA . 10113 1 43 . 1 1 11 11 ALA CB C 13 19.320 0.300 . 1 . . . . 11 ALA CB . 10113 1 44 . 1 1 11 11 ALA N N 15 123.086 0.300 . 1 . . . . 11 ALA N . 10113 1 45 . 1 1 12 12 LYS H H 1 8.211 0.030 . 1 . . . . 12 LYS H . 10113 1 46 . 1 1 12 12 LYS HA H 1 4.342 0.030 . 1 . . . . 12 LYS HA . 10113 1 47 . 1 1 12 12 LYS HB2 H 1 1.793 0.030 . 1 . . . . 12 LYS HB2 . 10113 1 48 . 1 1 12 12 LYS HB3 H 1 1.793 0.030 . 1 . . . . 12 LYS HB3 . 10113 1 49 . 1 1 12 12 LYS HG2 H 1 1.492 0.030 . 2 . . . . 12 LYS HG2 . 10113 1 50 . 1 1 12 12 LYS HG3 H 1 1.422 0.030 . 2 . . . . 12 LYS HG3 . 10113 1 51 . 1 1 12 12 LYS HD2 H 1 1.698 0.030 . 1 . . . . 12 LYS HD2 . 10113 1 52 . 1 1 12 12 LYS HD3 H 1 1.698 0.030 . 1 . . . . 12 LYS HD3 . 10113 1 53 . 1 1 12 12 LYS HE2 H 1 3.012 0.030 . 1 . . . . 12 LYS HE2 . 10113 1 54 . 1 1 12 12 LYS HE3 H 1 3.012 0.030 . 1 . . . . 12 LYS HE3 . 10113 1 55 . 1 1 12 12 LYS C C 13 176.456 0.300 . 1 . . . . 12 LYS C . 10113 1 56 . 1 1 12 12 LYS CA C 13 56.337 0.300 . 1 . . . . 12 LYS CA . 10113 1 57 . 1 1 12 12 LYS CB C 13 32.974 0.300 . 1 . . . . 12 LYS CB . 10113 1 58 . 1 1 12 12 LYS CG C 13 24.813 0.300 . 1 . . . . 12 LYS CG . 10113 1 59 . 1 1 12 12 LYS CD C 13 29.254 0.300 . 1 . . . . 12 LYS CD . 10113 1 60 . 1 1 12 12 LYS CE C 13 42.332 0.300 . 1 . . . . 12 LYS CE . 10113 1 61 . 1 1 12 12 LYS N N 15 121.124 0.300 . 1 . . . . 12 LYS N . 10113 1 62 . 1 1 13 13 VAL H H 1 8.171 0.030 . 1 . . . . 13 VAL H . 10113 1 63 . 1 1 13 13 VAL HA H 1 4.115 0.030 . 1 . . . . 13 VAL HA . 10113 1 64 . 1 1 13 13 VAL HB H 1 2.033 0.030 . 1 . . . . 13 VAL HB . 10113 1 65 . 1 1 13 13 VAL HG11 H 1 0.933 0.030 . 1 . . . . 13 VAL HG1 . 10113 1 66 . 1 1 13 13 VAL HG12 H 1 0.933 0.030 . 1 . . . . 13 VAL HG1 . 10113 1 67 . 1 1 13 13 VAL HG13 H 1 0.933 0.030 . 1 . . . . 13 VAL HG1 . 10113 1 68 . 1 1 13 13 VAL HG21 H 1 0.933 0.030 . 1 . . . . 13 VAL HG2 . 10113 1 69 . 1 1 13 13 VAL HG22 H 1 0.933 0.030 . 1 . . . . 13 VAL HG2 . 10113 1 70 . 1 1 13 13 VAL HG23 H 1 0.933 0.030 . 1 . . . . 13 VAL HG2 . 10113 1 71 . 1 1 13 13 VAL C C 13 175.922 0.300 . 1 . . . . 13 VAL C . 10113 1 72 . 1 1 13 13 VAL CA C 13 62.360 0.300 . 1 . . . . 13 VAL CA . 10113 1 73 . 1 1 13 13 VAL CB C 13 32.882 0.300 . 1 . . . . 13 VAL CB . 10113 1 74 . 1 1 13 13 VAL CG1 C 13 21.111 0.300 . 1 . . . . 13 VAL CG1 . 10113 1 75 . 1 1 13 13 VAL CG2 C 13 21.111 0.300 . 1 . . . . 13 VAL CG2 . 10113 1 76 . 1 1 13 13 VAL N N 15 122.629 0.300 . 1 . . . . 13 VAL N . 10113 1 77 . 1 1 14 14 GLU H H 1 8.577 0.030 . 1 . . . . 14 GLU H . 10113 1 78 . 1 1 14 14 GLU HA H 1 4.333 0.030 . 1 . . . . 14 GLU HA . 10113 1 79 . 1 1 14 14 GLU HB2 H 1 1.895 0.030 . 2 . . . . 14 GLU HB2 . 10113 1 80 . 1 1 14 14 GLU HB3 H 1 2.024 0.030 . 2 . . . . 14 GLU HB3 . 10113 1 81 . 1 1 14 14 GLU HG2 H 1 2.213 0.030 . 1 . . . . 14 GLU HG2 . 10113 1 82 . 1 1 14 14 GLU HG3 H 1 2.213 0.030 . 1 . . . . 14 GLU HG3 . 10113 1 83 . 1 1 14 14 GLU C C 13 176.275 0.300 . 1 . . . . 14 GLU C . 10113 1 84 . 1 1 14 14 GLU CA C 13 56.179 0.300 . 1 . . . . 14 GLU CA . 10113 1 85 . 1 1 14 14 GLU CB C 13 30.465 0.300 . 1 . . . . 14 GLU CB . 10113 1 86 . 1 1 14 14 GLU CG C 13 36.139 0.300 . 1 . . . . 14 GLU CG . 10113 1 87 . 1 1 14 14 GLU N N 15 125.502 0.300 . 1 . . . . 14 GLU N . 10113 1 88 . 1 1 15 15 LEU H H 1 8.353 0.030 . 1 . . . . 15 LEU H . 10113 1 89 . 1 1 15 15 LEU HA H 1 4.328 0.030 . 1 . . . . 15 LEU HA . 10113 1 90 . 1 1 15 15 LEU HB2 H 1 1.662 0.030 . 2 . . . . 15 LEU HB2 . 10113 1 91 . 1 1 15 15 LEU HB3 H 1 1.556 0.030 . 2 . . . . 15 LEU HB3 . 10113 1 92 . 1 1 15 15 LEU HG H 1 1.623 0.030 . 1 . . . . 15 LEU HG . 10113 1 93 . 1 1 15 15 LEU HD11 H 1 0.939 0.030 . 1 . . . . 15 LEU HD1 . 10113 1 94 . 1 1 15 15 LEU HD12 H 1 0.939 0.030 . 1 . . . . 15 LEU HD1 . 10113 1 95 . 1 1 15 15 LEU HD13 H 1 0.939 0.030 . 1 . . . . 15 LEU HD1 . 10113 1 96 . 1 1 15 15 LEU HD21 H 1 0.865 0.030 . 1 . . . . 15 LEU HD2 . 10113 1 97 . 1 1 15 15 LEU HD22 H 1 0.865 0.030 . 1 . . . . 15 LEU HD2 . 10113 1 98 . 1 1 15 15 LEU HD23 H 1 0.865 0.030 . 1 . . . . 15 LEU HD2 . 10113 1 99 . 1 1 15 15 LEU C C 13 177.537 0.300 . 1 . . . . 15 LEU C . 10113 1 100 . 1 1 15 15 LEU CA C 13 55.597 0.300 . 1 . . . . 15 LEU CA . 10113 1 101 . 1 1 15 15 LEU CB C 13 42.103 0.300 . 1 . . . . 15 LEU CB . 10113 1 102 . 1 1 15 15 LEU CG C 13 26.992 0.300 . 1 . . . . 15 LEU CG . 10113 1 103 . 1 1 15 15 LEU CD1 C 13 24.813 0.300 . 2 . . . . 15 LEU CD1 . 10113 1 104 . 1 1 15 15 LEU CD2 C 13 23.655 0.300 . 2 . . . . 15 LEU CD2 . 10113 1 105 . 1 1 15 15 LEU N N 15 124.008 0.300 . 1 . . . . 15 LEU N . 10113 1 106 . 1 1 16 16 VAL H H 1 8.092 0.030 . 1 . . . . 16 VAL H . 10113 1 107 . 1 1 16 16 VAL HA H 1 4.133 0.030 . 1 . . . . 16 VAL HA . 10113 1 108 . 1 1 16 16 VAL HB H 1 2.112 0.030 . 1 . . . . 16 VAL HB . 10113 1 109 . 1 1 16 16 VAL HG11 H 1 0.933 0.030 . 1 . . . . 16 VAL HG1 . 10113 1 110 . 1 1 16 16 VAL HG12 H 1 0.933 0.030 . 1 . . . . 16 VAL HG1 . 10113 1 111 . 1 1 16 16 VAL HG13 H 1 0.933 0.030 . 1 . . . . 16 VAL HG1 . 10113 1 112 . 1 1 16 16 VAL HG21 H 1 0.924 0.030 . 1 . . . . 16 VAL HG2 . 10113 1 113 . 1 1 16 16 VAL HG22 H 1 0.924 0.030 . 1 . . . . 16 VAL HG2 . 10113 1 114 . 1 1 16 16 VAL HG23 H 1 0.924 0.030 . 1 . . . . 16 VAL HG2 . 10113 1 115 . 1 1 16 16 VAL C C 13 175.494 0.300 . 1 . . . . 16 VAL C . 10113 1 116 . 1 1 16 16 VAL CA C 13 62.319 0.300 . 1 . . . . 16 VAL CA . 10113 1 117 . 1 1 16 16 VAL CB C 13 32.604 0.300 . 1 . . . . 16 VAL CB . 10113 1 118 . 1 1 16 16 VAL CG1 C 13 20.328 0.300 . 2 . . . . 16 VAL CG1 . 10113 1 119 . 1 1 16 16 VAL CG2 C 13 21.318 0.300 . 2 . . . . 16 VAL CG2 . 10113 1 120 . 1 1 16 16 VAL N N 15 119.897 0.300 . 1 . . . . 16 VAL N . 10113 1 121 . 1 1 17 17 ASP H H 1 8.342 0.030 . 1 . . . . 17 ASP H . 10113 1 122 . 1 1 17 17 ASP HA H 1 4.663 0.030 . 1 . . . . 17 ASP HA . 10113 1 123 . 1 1 17 17 ASP HB2 H 1 2.790 0.030 . 1 . . . . 17 ASP HB2 . 10113 1 124 . 1 1 17 17 ASP HB3 H 1 2.790 0.030 . 1 . . . . 17 ASP HB3 . 10113 1 125 . 1 1 17 17 ASP C C 13 175.807 0.300 . 1 . . . . 17 ASP C . 10113 1 126 . 1 1 17 17 ASP CA C 13 54.595 0.300 . 1 . . . . 17 ASP CA . 10113 1 127 . 1 1 17 17 ASP CB C 13 41.381 0.300 . 1 . . . . 17 ASP CB . 10113 1 128 . 1 1 17 17 ASP N N 15 122.957 0.300 . 1 . . . . 17 ASP N . 10113 1 129 . 1 1 18 18 ILE H H 1 7.923 0.030 . 1 . . . . 18 ILE H . 10113 1 130 . 1 1 18 18 ILE HA H 1 4.003 0.030 . 1 . . . . 18 ILE HA . 10113 1 131 . 1 1 18 18 ILE HB H 1 1.846 0.030 . 1 . . . . 18 ILE HB . 10113 1 132 . 1 1 18 18 ILE HG12 H 1 1.689 0.030 . 2 . . . . 18 ILE HG12 . 10113 1 133 . 1 1 18 18 ILE HG13 H 1 0.903 0.030 . 2 . . . . 18 ILE HG13 . 10113 1 134 . 1 1 18 18 ILE HG21 H 1 0.763 0.030 . 1 . . . . 18 ILE HG2 . 10113 1 135 . 1 1 18 18 ILE HG22 H 1 0.763 0.030 . 1 . . . . 18 ILE HG2 . 10113 1 136 . 1 1 18 18 ILE HG23 H 1 0.763 0.030 . 1 . . . . 18 ILE HG2 . 10113 1 137 . 1 1 18 18 ILE HD11 H 1 0.833 0.030 . 1 . . . . 18 ILE HD1 . 10113 1 138 . 1 1 18 18 ILE HD12 H 1 0.833 0.030 . 1 . . . . 18 ILE HD1 . 10113 1 139 . 1 1 18 18 ILE HD13 H 1 0.833 0.030 . 1 . . . . 18 ILE HD1 . 10113 1 140 . 1 1 18 18 ILE C C 13 175.399 0.300 . 1 . . . . 18 ILE C . 10113 1 141 . 1 1 18 18 ILE CA C 13 62.342 0.300 . 1 . . . . 18 ILE CA . 10113 1 142 . 1 1 18 18 ILE CB C 13 39.055 0.300 . 1 . . . . 18 ILE CB . 10113 1 143 . 1 1 18 18 ILE CG1 C 13 28.082 0.300 . 1 . . . . 18 ILE CG1 . 10113 1 144 . 1 1 18 18 ILE CG2 C 13 17.686 0.300 . 1 . . . . 18 ILE CG2 . 10113 1 145 . 1 1 18 18 ILE CD1 C 13 13.525 0.300 . 1 . . . . 18 ILE CD1 . 10113 1 146 . 1 1 18 18 ILE N N 15 121.511 0.300 . 1 . . . . 18 ILE N . 10113 1 147 . 1 1 19 19 GLN H H 1 8.904 0.030 . 1 . . . . 19 GLN H . 10113 1 148 . 1 1 19 19 GLN HA H 1 4.371 0.030 . 1 . . . . 19 GLN HA . 10113 1 149 . 1 1 19 19 GLN HB2 H 1 1.863 0.030 . 2 . . . . 19 GLN HB2 . 10113 1 150 . 1 1 19 19 GLN HB3 H 1 2.001 0.030 . 2 . . . . 19 GLN HB3 . 10113 1 151 . 1 1 19 19 GLN HG2 H 1 2.182 0.030 . 1 . . . . 19 GLN HG2 . 10113 1 152 . 1 1 19 19 GLN HG3 H 1 2.182 0.030 . 1 . . . . 19 GLN HG3 . 10113 1 153 . 1 1 19 19 GLN HE21 H 1 7.354 0.030 . 2 . . . . 19 GLN HE21 . 10113 1 154 . 1 1 19 19 GLN HE22 H 1 6.654 0.030 . 2 . . . . 19 GLN HE22 . 10113 1 155 . 1 1 19 19 GLN CB C 13 29.443 0.300 . 1 . . . . 19 GLN CB . 10113 1 156 . 1 1 19 19 GLN CG C 13 33.223 0.300 . 1 . . . . 19 GLN CG . 10113 1 157 . 1 1 19 19 GLN N N 15 127.523 0.300 . 1 . . . . 19 GLN N . 10113 1 158 . 1 1 19 19 GLN NE2 N 15 112.085 0.300 . 1 . . . . 19 GLN NE2 . 10113 1 159 . 1 1 20 20 ARG H H 1 7.851 0.030 . 1 . . . . 20 ARG H . 10113 1 160 . 1 1 20 20 ARG HA H 1 4.258 0.030 . 1 . . . . 20 ARG HA . 10113 1 161 . 1 1 20 20 ARG HB2 H 1 0.937 0.030 . 2 . . . . 20 ARG HB2 . 10113 1 162 . 1 1 20 20 ARG HB3 H 1 1.537 0.030 . 2 . . . . 20 ARG HB3 . 10113 1 163 . 1 1 20 20 ARG HG2 H 1 1.074 0.030 . 2 . . . . 20 ARG HG2 . 10113 1 164 . 1 1 20 20 ARG HG3 H 1 0.550 0.030 . 2 . . . . 20 ARG HG3 . 10113 1 165 . 1 1 20 20 ARG HD2 H 1 1.642 0.030 . 2 . . . . 20 ARG HD2 . 10113 1 166 . 1 1 20 20 ARG HD3 H 1 1.540 0.030 . 2 . . . . 20 ARG HD3 . 10113 1 167 . 1 1 20 20 ARG HE H 1 6.983 0.030 . 1 . . . . 20 ARG HE . 10113 1 168 . 1 1 20 20 ARG C C 13 172.364 0.300 . 1 . . . . 20 ARG C . 10113 1 169 . 1 1 20 20 ARG CA C 13 56.277 0.300 . 1 . . . . 20 ARG CA . 10113 1 170 . 1 1 20 20 ARG CB C 13 32.924 0.300 . 1 . . . . 20 ARG CB . 10113 1 171 . 1 1 20 20 ARG CG C 13 27.557 0.300 . 1 . . . . 20 ARG CG . 10113 1 172 . 1 1 20 20 ARG CD C 13 41.316 0.300 . 1 . . . . 20 ARG CD . 10113 1 173 . 1 1 20 20 ARG N N 15 118.044 0.300 . 1 . . . . 20 ARG N . 10113 1 174 . 1 1 20 20 ARG NE N 15 84.078 0.300 . 1 . . . . 20 ARG NE . 10113 1 175 . 1 1 21 21 GLU H H 1 8.463 0.030 . 1 . . . . 21 GLU H . 10113 1 176 . 1 1 21 21 GLU HA H 1 5.996 0.030 . 1 . . . . 21 GLU HA . 10113 1 177 . 1 1 21 21 GLU HB2 H 1 2.025 0.030 . 1 . . . . 21 GLU HB2 . 10113 1 178 . 1 1 21 21 GLU HB3 H 1 2.025 0.030 . 1 . . . . 21 GLU HB3 . 10113 1 179 . 1 1 21 21 GLU HG2 H 1 2.133 0.030 . 1 . . . . 21 GLU HG2 . 10113 1 180 . 1 1 21 21 GLU HG3 H 1 2.133 0.030 . 1 . . . . 21 GLU HG3 . 10113 1 181 . 1 1 21 21 GLU C C 13 175.855 0.300 . 1 . . . . 21 GLU C . 10113 1 182 . 1 1 21 21 GLU CA C 13 54.415 0.300 . 1 . . . . 21 GLU CA . 10113 1 183 . 1 1 21 21 GLU CB C 13 34.268 0.300 . 1 . . . . 21 GLU CB . 10113 1 184 . 1 1 21 21 GLU CG C 13 36.163 0.300 . 1 . . . . 21 GLU CG . 10113 1 185 . 1 1 21 21 GLU N N 15 124.354 0.300 . 1 . . . . 21 GLU N . 10113 1 186 . 1 1 22 22 GLY H H 1 9.035 0.030 . 1 . . . . 22 GLY H . 10113 1 187 . 1 1 22 22 GLY HA2 H 1 4.605 0.030 . 2 . . . . 22 GLY HA2 . 10113 1 188 . 1 1 22 22 GLY HA3 H 1 4.281 0.030 . 2 . . . . 22 GLY HA3 . 10113 1 189 . 1 1 22 22 GLY C C 13 170.221 0.300 . 1 . . . . 22 GLY C . 10113 1 190 . 1 1 22 22 GLY CA C 13 45.826 0.300 . 1 . . . . 22 GLY CA . 10113 1 191 . 1 1 22 22 GLY N N 15 110.198 0.300 . 1 . . . . 22 GLY N . 10113 1 192 . 1 1 23 23 ALA H H 1 8.601 0.030 . 1 . . . . 23 ALA H . 10113 1 193 . 1 1 23 23 ALA HA H 1 5.312 0.030 . 1 . . . . 23 ALA HA . 10113 1 194 . 1 1 23 23 ALA HB1 H 1 1.507 0.030 . 1 . . . . 23 ALA HB . 10113 1 195 . 1 1 23 23 ALA HB2 H 1 1.507 0.030 . 1 . . . . 23 ALA HB . 10113 1 196 . 1 1 23 23 ALA HB3 H 1 1.507 0.030 . 1 . . . . 23 ALA HB . 10113 1 197 . 1 1 23 23 ALA C C 13 176.480 0.300 . 1 . . . . 23 ALA C . 10113 1 198 . 1 1 23 23 ALA CA C 13 51.443 0.300 . 1 . . . . 23 ALA CA . 10113 1 199 . 1 1 23 23 ALA CB C 13 19.599 0.300 . 1 . . . . 23 ALA CB . 10113 1 200 . 1 1 23 23 ALA N N 15 123.805 0.300 . 1 . . . . 23 ALA N . 10113 1 201 . 1 1 24 24 LEU H H 1 8.482 0.030 . 1 . . . . 24 LEU H . 10113 1 202 . 1 1 24 24 LEU HA H 1 4.905 0.030 . 1 . . . . 24 LEU HA . 10113 1 203 . 1 1 24 24 LEU HB2 H 1 2.033 0.030 . 2 . . . . 24 LEU HB2 . 10113 1 204 . 1 1 24 24 LEU HB3 H 1 1.230 0.030 . 2 . . . . 24 LEU HB3 . 10113 1 205 . 1 1 24 24 LEU HG H 1 1.620 0.030 . 1 . . . . 24 LEU HG . 10113 1 206 . 1 1 24 24 LEU HD11 H 1 0.332 0.030 . 1 . . . . 24 LEU HD1 . 10113 1 207 . 1 1 24 24 LEU HD12 H 1 0.332 0.030 . 1 . . . . 24 LEU HD1 . 10113 1 208 . 1 1 24 24 LEU HD13 H 1 0.332 0.030 . 1 . . . . 24 LEU HD1 . 10113 1 209 . 1 1 24 24 LEU HD21 H 1 0.477 0.030 . 1 . . . . 24 LEU HD2 . 10113 1 210 . 1 1 24 24 LEU HD22 H 1 0.477 0.030 . 1 . . . . 24 LEU HD2 . 10113 1 211 . 1 1 24 24 LEU HD23 H 1 0.477 0.030 . 1 . . . . 24 LEU HD2 . 10113 1 212 . 1 1 24 24 LEU C C 13 175.987 0.300 . 1 . . . . 24 LEU C . 10113 1 213 . 1 1 24 24 LEU CA C 13 55.862 0.300 . 1 . . . . 24 LEU CA . 10113 1 214 . 1 1 24 24 LEU CB C 13 45.657 0.300 . 1 . . . . 24 LEU CB . 10113 1 215 . 1 1 24 24 LEU CG C 13 29.050 0.300 . 1 . . . . 24 LEU CG . 10113 1 216 . 1 1 24 24 LEU CD1 C 13 27.833 0.300 . 2 . . . . 24 LEU CD1 . 10113 1 217 . 1 1 24 24 LEU CD2 C 13 24.865 0.300 . 2 . . . . 24 LEU CD2 . 10113 1 218 . 1 1 24 24 LEU N N 15 124.276 0.300 . 1 . . . . 24 LEU N . 10113 1 219 . 1 1 25 25 ARG H H 1 8.254 0.030 . 1 . . . . 25 ARG H . 10113 1 220 . 1 1 25 25 ARG HA H 1 5.748 0.030 . 1 . . . . 25 ARG HA . 10113 1 221 . 1 1 25 25 ARG HB2 H 1 1.706 0.030 . 1 . . . . 25 ARG HB2 . 10113 1 222 . 1 1 25 25 ARG HB3 H 1 1.706 0.030 . 1 . . . . 25 ARG HB3 . 10113 1 223 . 1 1 25 25 ARG HG2 H 1 1.693 0.030 . 2 . . . . 25 ARG HG2 . 10113 1 224 . 1 1 25 25 ARG HG3 H 1 1.513 0.030 . 2 . . . . 25 ARG HG3 . 10113 1 225 . 1 1 25 25 ARG HD2 H 1 2.743 0.030 . 2 . . . . 25 ARG HD2 . 10113 1 226 . 1 1 25 25 ARG HD3 H 1 3.013 0.030 . 2 . . . . 25 ARG HD3 . 10113 1 227 . 1 1 25 25 ARG C C 13 174.786 0.300 . 1 . . . . 25 ARG C . 10113 1 228 . 1 1 25 25 ARG CA C 13 55.584 0.300 . 1 . . . . 25 ARG CA . 10113 1 229 . 1 1 25 25 ARG CB C 13 34.755 0.300 . 1 . . . . 25 ARG CB . 10113 1 230 . 1 1 25 25 ARG CG C 13 26.852 0.300 . 1 . . . . 25 ARG CG . 10113 1 231 . 1 1 25 25 ARG CD C 13 44.083 0.300 . 1 . . . . 25 ARG CD . 10113 1 232 . 1 1 25 25 ARG N N 15 116.914 0.300 . 1 . . . . 25 ARG N . 10113 1 233 . 1 1 26 26 PHE H H 1 9.609 0.030 . 1 . . . . 26 PHE H . 10113 1 234 . 1 1 26 26 PHE HA H 1 6.529 0.030 . 1 . . . . 26 PHE HA . 10113 1 235 . 1 1 26 26 PHE HB2 H 1 3.273 0.030 . 2 . . . . 26 PHE HB2 . 10113 1 236 . 1 1 26 26 PHE HB3 H 1 3.103 0.030 . 2 . . . . 26 PHE HB3 . 10113 1 237 . 1 1 26 26 PHE HD1 H 1 7.093 0.030 . 1 . . . . 26 PHE HD1 . 10113 1 238 . 1 1 26 26 PHE HD2 H 1 7.093 0.030 . 1 . . . . 26 PHE HD2 . 10113 1 239 . 1 1 26 26 PHE HE1 H 1 6.946 0.030 . 1 . . . . 26 PHE HE1 . 10113 1 240 . 1 1 26 26 PHE HE2 H 1 6.946 0.030 . 1 . . . . 26 PHE HE2 . 10113 1 241 . 1 1 26 26 PHE HZ H 1 6.918 0.030 . 1 . . . . 26 PHE HZ . 10113 1 242 . 1 1 26 26 PHE C C 13 173.056 0.300 . 1 . . . . 26 PHE C . 10113 1 243 . 1 1 26 26 PHE CA C 13 55.439 0.300 . 1 . . . . 26 PHE CA . 10113 1 244 . 1 1 26 26 PHE CB C 13 44.848 0.300 . 1 . . . . 26 PHE CB . 10113 1 245 . 1 1 26 26 PHE CD1 C 13 132.106 0.300 . 1 . . . . 26 PHE CD1 . 10113 1 246 . 1 1 26 26 PHE CD2 C 13 132.106 0.300 . 1 . . . . 26 PHE CD2 . 10113 1 247 . 1 1 26 26 PHE CE1 C 13 130.698 0.300 . 1 . . . . 26 PHE CE1 . 10113 1 248 . 1 1 26 26 PHE CE2 C 13 130.698 0.300 . 1 . . . . 26 PHE CE2 . 10113 1 249 . 1 1 26 26 PHE CZ C 13 129.010 0.300 . 1 . . . . 26 PHE CZ . 10113 1 250 . 1 1 26 26 PHE N N 15 119.676 0.300 . 1 . . . . 26 PHE N . 10113 1 251 . 1 1 27 27 MET H H 1 9.033 0.030 . 1 . . . . 27 MET H . 10113 1 252 . 1 1 27 27 MET HA H 1 4.165 0.030 . 1 . . . . 27 MET HA . 10113 1 253 . 1 1 27 27 MET HB2 H 1 1.043 0.030 . 2 . . . . 27 MET HB2 . 10113 1 254 . 1 1 27 27 MET HB3 H 1 1.152 0.030 . 2 . . . . 27 MET HB3 . 10113 1 255 . 1 1 27 27 MET HG2 H 1 1.288 0.030 . 2 . . . . 27 MET HG2 . 10113 1 256 . 1 1 27 27 MET HG3 H 1 1.433 0.030 . 2 . . . . 27 MET HG3 . 10113 1 257 . 1 1 27 27 MET HE1 H 1 0.993 0.030 . 1 . . . . 27 MET HE . 10113 1 258 . 1 1 27 27 MET HE2 H 1 0.993 0.030 . 1 . . . . 27 MET HE . 10113 1 259 . 1 1 27 27 MET HE3 H 1 0.993 0.030 . 1 . . . . 27 MET HE . 10113 1 260 . 1 1 27 27 MET C C 13 173.693 0.300 . 1 . . . . 27 MET C . 10113 1 261 . 1 1 27 27 MET CA C 13 54.646 0.300 . 1 . . . . 27 MET CA . 10113 1 262 . 1 1 27 27 MET CB C 13 36.154 0.300 . 1 . . . . 27 MET CB . 10113 1 263 . 1 1 27 27 MET CG C 13 30.427 0.300 . 1 . . . . 27 MET CG . 10113 1 264 . 1 1 27 27 MET CE C 13 15.861 0.300 . 1 . . . . 27 MET CE . 10113 1 265 . 1 1 27 27 MET N N 15 120.062 0.300 . 1 . . . . 27 MET N . 10113 1 266 . 1 1 28 28 VAL H H 1 8.226 0.030 . 1 . . . . 28 VAL H . 10113 1 267 . 1 1 28 28 VAL HA H 1 4.291 0.030 . 1 . . . . 28 VAL HA . 10113 1 268 . 1 1 28 28 VAL HB H 1 1.753 0.030 . 1 . . . . 28 VAL HB . 10113 1 269 . 1 1 28 28 VAL HG11 H 1 0.645 0.030 . 1 . . . . 28 VAL HG1 . 10113 1 270 . 1 1 28 28 VAL HG12 H 1 0.645 0.030 . 1 . . . . 28 VAL HG1 . 10113 1 271 . 1 1 28 28 VAL HG13 H 1 0.645 0.030 . 1 . . . . 28 VAL HG1 . 10113 1 272 . 1 1 28 28 VAL HG21 H 1 0.640 0.030 . 1 . . . . 28 VAL HG2 . 10113 1 273 . 1 1 28 28 VAL HG22 H 1 0.640 0.030 . 1 . . . . 28 VAL HG2 . 10113 1 274 . 1 1 28 28 VAL HG23 H 1 0.640 0.030 . 1 . . . . 28 VAL HG2 . 10113 1 275 . 1 1 28 28 VAL C C 13 175.614 0.300 . 1 . . . . 28 VAL C . 10113 1 276 . 1 1 28 28 VAL CA C 13 61.192 0.300 . 1 . . . . 28 VAL CA . 10113 1 277 . 1 1 28 28 VAL CB C 13 33.039 0.300 . 1 . . . . 28 VAL CB . 10113 1 278 . 1 1 28 28 VAL CG1 C 13 21.064 0.300 . 2 . . . . 28 VAL CG1 . 10113 1 279 . 1 1 28 28 VAL CG2 C 13 21.272 0.300 . 2 . . . . 28 VAL CG2 . 10113 1 280 . 1 1 28 28 VAL N N 15 122.162 0.300 . 1 . . . . 28 VAL N . 10113 1 281 . 1 1 29 29 ALA H H 1 8.598 0.030 . 1 . . . . 29 ALA H . 10113 1 282 . 1 1 29 29 ALA HA H 1 4.087 0.030 . 1 . . . . 29 ALA HA . 10113 1 283 . 1 1 29 29 ALA HB1 H 1 1.242 0.030 . 1 . . . . 29 ALA HB . 10113 1 284 . 1 1 29 29 ALA HB2 H 1 1.242 0.030 . 1 . . . . 29 ALA HB . 10113 1 285 . 1 1 29 29 ALA HB3 H 1 1.242 0.030 . 1 . . . . 29 ALA HB . 10113 1 286 . 1 1 29 29 ALA C C 13 177.225 0.300 . 1 . . . . 29 ALA C . 10113 1 287 . 1 1 29 29 ALA CA C 13 52.817 0.300 . 1 . . . . 29 ALA CA . 10113 1 288 . 1 1 29 29 ALA CB C 13 19.224 0.300 . 1 . . . . 29 ALA CB . 10113 1 289 . 1 1 29 29 ALA N N 15 129.888 0.300 . 1 . . . . 29 ALA N . 10113 1 290 . 1 1 30 30 ASP H H 1 8.125 0.030 . 1 . . . . 30 ASP H . 10113 1 291 . 1 1 30 30 ASP HA H 1 4.493 0.030 . 1 . . . . 30 ASP HA . 10113 1 292 . 1 1 30 30 ASP HB2 H 1 2.537 0.030 . 2 . . . . 30 ASP HB2 . 10113 1 293 . 1 1 30 30 ASP HB3 H 1 2.614 0.030 . 2 . . . . 30 ASP HB3 . 10113 1 294 . 1 1 30 30 ASP C C 13 176.059 0.300 . 1 . . . . 30 ASP C . 10113 1 295 . 1 1 30 30 ASP CA C 13 54.300 0.300 . 1 . . . . 30 ASP CA . 10113 1 296 . 1 1 30 30 ASP CB C 13 41.381 0.300 . 1 . . . . 30 ASP CB . 10113 1 297 . 1 1 30 30 ASP N N 15 119.529 0.300 . 1 . . . . 30 ASP N . 10113 1 298 . 1 1 31 31 ASP H H 1 8.196 0.030 . 1 . . . . 31 ASP H . 10113 1 299 . 1 1 31 31 ASP HA H 1 4.514 0.030 . 1 . . . . 31 ASP HA . 10113 1 300 . 1 1 31 31 ASP HB2 H 1 2.612 0.030 . 2 . . . . 31 ASP HB2 . 10113 1 301 . 1 1 31 31 ASP HB3 H 1 2.673 0.030 . 2 . . . . 31 ASP HB3 . 10113 1 302 . 1 1 31 31 ASP C C 13 176.708 0.300 . 1 . . . . 31 ASP C . 10113 1 303 . 1 1 31 31 ASP CA C 13 54.700 0.300 . 1 . . . . 31 ASP CA . 10113 1 304 . 1 1 31 31 ASP CB C 13 41.199 0.300 . 1 . . . . 31 ASP CB . 10113 1 305 . 1 1 31 31 ASP N N 15 120.755 0.300 . 1 . . . . 31 ASP N . 10113 1 306 . 1 1 32 32 ALA H H 1 8.155 0.030 . 1 . . . . 32 ALA H . 10113 1 307 . 1 1 32 32 ALA HA H 1 4.145 0.030 . 1 . . . . 32 ALA HA . 10113 1 308 . 1 1 32 32 ALA HB1 H 1 1.364 0.030 . 1 . . . . 32 ALA HB . 10113 1 309 . 1 1 32 32 ALA HB2 H 1 1.364 0.030 . 1 . . . . 32 ALA HB . 10113 1 310 . 1 1 32 32 ALA HB3 H 1 1.364 0.030 . 1 . . . . 32 ALA HB . 10113 1 311 . 1 1 32 32 ALA C C 13 177.969 0.300 . 1 . . . . 32 ALA C . 10113 1 312 . 1 1 32 32 ALA CA C 13 53.435 0.300 . 1 . . . . 32 ALA CA . 10113 1 313 . 1 1 32 32 ALA CB C 13 18.908 0.300 . 1 . . . . 32 ALA CB . 10113 1 314 . 1 1 32 32 ALA N N 15 123.805 0.300 . 1 . . . . 32 ALA N . 10113 1 315 . 1 1 33 33 ALA H H 1 8.062 0.030 . 1 . . . . 33 ALA H . 10113 1 316 . 1 1 33 33 ALA HA H 1 4.275 0.030 . 1 . . . . 33 ALA HA . 10113 1 317 . 1 1 33 33 ALA HB1 H 1 1.364 0.030 . 1 . . . . 33 ALA HB . 10113 1 318 . 1 1 33 33 ALA HB2 H 1 1.364 0.030 . 1 . . . . 33 ALA HB . 10113 1 319 . 1 1 33 33 ALA HB3 H 1 1.364 0.030 . 1 . . . . 33 ALA HB . 10113 1 320 . 1 1 33 33 ALA C C 13 178.018 0.300 . 1 . . . . 33 ALA C . 10113 1 321 . 1 1 33 33 ALA CA C 13 52.804 0.300 . 1 . . . . 33 ALA CA . 10113 1 322 . 1 1 33 33 ALA CB C 13 19.032 0.300 . 1 . . . . 33 ALA CB . 10113 1 323 . 1 1 33 33 ALA N N 15 121.109 0.300 . 1 . . . . 33 ALA N . 10113 1 324 . 1 1 34 34 SER H H 1 7.889 0.030 . 1 . . . . 34 SER H . 10113 1 325 . 1 1 34 34 SER HA H 1 4.441 0.030 . 1 . . . . 34 SER HA . 10113 1 326 . 1 1 34 34 SER HB2 H 1 3.865 0.030 . 1 . . . . 34 SER HB2 . 10113 1 327 . 1 1 34 34 SER HB3 H 1 3.865 0.030 . 1 . . . . 34 SER HB3 . 10113 1 328 . 1 1 34 34 SER C C 13 174.822 0.300 . 1 . . . . 34 SER C . 10113 1 329 . 1 1 34 34 SER CA C 13 58.562 0.300 . 1 . . . . 34 SER CA . 10113 1 330 . 1 1 34 34 SER CB C 13 63.982 0.300 . 1 . . . . 34 SER CB . 10113 1 331 . 1 1 34 34 SER N N 15 113.343 0.300 . 1 . . . . 34 SER N . 10113 1 332 . 1 1 35 35 GLY H H 1 8.113 0.030 . 1 . . . . 35 GLY H . 10113 1 333 . 1 1 35 35 GLY HA2 H 1 4.098 0.030 . 2 . . . . 35 GLY HA2 . 10113 1 334 . 1 1 35 35 GLY HA3 H 1 4.062 0.030 . 2 . . . . 35 GLY HA3 . 10113 1 335 . 1 1 35 35 GLY C C 13 171.992 0.300 . 1 . . . . 35 GLY C . 10113 1 336 . 1 1 35 35 GLY CA C 13 44.709 0.300 . 1 . . . . 35 GLY CA . 10113 1 337 . 1 1 35 35 GLY N N 15 110.355 0.300 . 1 . . . . 35 GLY N . 10113 1 338 . 1 1 36 36 PRO HA H 1 4.403 0.030 . 1 . . . . 36 PRO HA . 10113 1 339 . 1 1 36 36 PRO HB2 H 1 1.953 0.030 . 2 . . . . 36 PRO HB2 . 10113 1 340 . 1 1 36 36 PRO HB3 H 1 2.263 0.030 . 2 . . . . 36 PRO HB3 . 10113 1 341 . 1 1 36 36 PRO HG2 H 1 2.024 0.030 . 1 . . . . 36 PRO HG2 . 10113 1 342 . 1 1 36 36 PRO HG3 H 1 2.024 0.030 . 1 . . . . 36 PRO HG3 . 10113 1 343 . 1 1 36 36 PRO HD2 H 1 3.623 0.030 . 1 . . . . 36 PRO HD2 . 10113 1 344 . 1 1 36 36 PRO HD3 H 1 3.623 0.030 . 1 . . . . 36 PRO HD3 . 10113 1 345 . 1 1 36 36 PRO CA C 13 63.782 0.300 . 1 . . . . 36 PRO CA . 10113 1 346 . 1 1 36 36 PRO CB C 13 31.862 0.300 . 1 . . . . 36 PRO CB . 10113 1 347 . 1 1 36 36 PRO CD C 13 49.646 0.300 . 1 . . . . 36 PRO CD . 10113 1 348 . 1 1 37 37 GLY HA2 H 1 4.037 0.030 . 2 . . . . 37 GLY HA2 . 10113 1 349 . 1 1 37 37 GLY HA3 H 1 3.969 0.030 . 2 . . . . 37 GLY HA3 . 10113 1 350 . 1 1 37 37 GLY C C 13 174.966 0.300 . 1 . . . . 37 GLY C . 10113 1 351 . 1 1 37 37 GLY CA C 13 45.411 0.300 . 1 . . . . 37 GLY CA . 10113 1 352 . 1 1 38 38 GLY H H 1 8.197 0.030 . 1 . . . . 38 GLY H . 10113 1 353 . 1 1 38 38 GLY HA2 H 1 4.037 0.030 . 2 . . . . 38 GLY HA2 . 10113 1 354 . 1 1 38 38 GLY HA3 H 1 3.969 0.030 . 2 . . . . 38 GLY HA3 . 10113 1 355 . 1 1 38 38 GLY C C 13 174.461 0.300 . 1 . . . . 38 GLY C . 10113 1 356 . 1 1 38 38 GLY CA C 13 45.411 0.300 . 1 . . . . 38 GLY CA . 10113 1 357 . 1 1 38 38 GLY N N 15 108.864 0.300 . 1 . . . . 38 GLY N . 10113 1 358 . 1 1 39 39 THR H H 1 7.875 0.030 . 1 . . . . 39 THR H . 10113 1 359 . 1 1 39 39 THR HA H 1 4.323 0.030 . 1 . . . . 39 THR HA . 10113 1 360 . 1 1 39 39 THR HB H 1 4.185 0.030 . 1 . . . . 39 THR HB . 10113 1 361 . 1 1 39 39 THR HG21 H 1 1.174 0.030 . 1 . . . . 39 THR HG2 . 10113 1 362 . 1 1 39 39 THR HG22 H 1 1.174 0.030 . 1 . . . . 39 THR HG2 . 10113 1 363 . 1 1 39 39 THR HG23 H 1 1.174 0.030 . 1 . . . . 39 THR HG2 . 10113 1 364 . 1 1 39 39 THR C C 13 174.202 0.300 . 1 . . . . 39 THR C . 10113 1 365 . 1 1 39 39 THR CA C 13 61.516 0.300 . 1 . . . . 39 THR CA . 10113 1 366 . 1 1 39 39 THR CB C 13 70.171 0.300 . 1 . . . . 39 THR CB . 10113 1 367 . 1 1 39 39 THR CG2 C 13 21.616 0.300 . 1 . . . . 39 THR CG2 . 10113 1 368 . 1 1 39 39 THR N N 15 112.961 0.300 . 1 . . . . 39 THR N . 10113 1 369 . 1 1 40 40 ALA H H 1 8.261 0.030 . 1 . . . . 40 ALA H . 10113 1 370 . 1 1 40 40 ALA HA H 1 4.216 0.030 . 1 . . . . 40 ALA HA . 10113 1 371 . 1 1 40 40 ALA HB1 H 1 1.214 0.030 . 1 . . . . 40 ALA HB . 10113 1 372 . 1 1 40 40 ALA HB2 H 1 1.214 0.030 . 1 . . . . 40 ALA HB . 10113 1 373 . 1 1 40 40 ALA HB3 H 1 1.214 0.030 . 1 . . . . 40 ALA HB . 10113 1 374 . 1 1 40 40 ALA C C 13 176.924 0.300 . 1 . . . . 40 ALA C . 10113 1 375 . 1 1 40 40 ALA CA C 13 52.481 0.300 . 1 . . . . 40 ALA CA . 10113 1 376 . 1 1 40 40 ALA CB C 13 19.402 0.300 . 1 . . . . 40 ALA CB . 10113 1 377 . 1 1 40 40 ALA N N 15 126.433 0.300 . 1 . . . . 40 ALA N . 10113 1 378 . 1 1 41 41 GLN H H 1 8.003 0.030 . 1 . . . . 41 GLN H . 10113 1 379 . 1 1 41 41 GLN HA H 1 4.443 0.030 . 1 . . . . 41 GLN HA . 10113 1 380 . 1 1 41 41 GLN HB2 H 1 2.040 0.030 . 2 . . . . 41 GLN HB2 . 10113 1 381 . 1 1 41 41 GLN HB3 H 1 1.805 0.030 . 2 . . . . 41 GLN HB3 . 10113 1 382 . 1 1 41 41 GLN HG2 H 1 2.270 0.030 . 1 . . . . 41 GLN HG2 . 10113 1 383 . 1 1 41 41 GLN HG3 H 1 2.270 0.030 . 1 . . . . 41 GLN HG3 . 10113 1 384 . 1 1 41 41 GLN HE21 H 1 7.431 0.030 . 2 . . . . 41 GLN HE21 . 10113 1 385 . 1 1 41 41 GLN HE22 H 1 6.833 0.030 . 2 . . . . 41 GLN HE22 . 10113 1 386 . 1 1 41 41 GLN C C 13 175.231 0.300 . 1 . . . . 41 GLN C . 10113 1 387 . 1 1 41 41 GLN CA C 13 54.433 0.300 . 1 . . . . 41 GLN CA . 10113 1 388 . 1 1 41 41 GLN CB C 13 30.408 0.300 . 1 . . . . 41 GLN CB . 10113 1 389 . 1 1 41 41 GLN CG C 13 33.705 0.300 . 1 . . . . 41 GLN CG . 10113 1 390 . 1 1 41 41 GLN N N 15 119.688 0.300 . 1 . . . . 41 GLN N . 10113 1 391 . 1 1 41 41 GLN NE2 N 15 112.663 0.300 . 1 . . . . 41 GLN NE2 . 10113 1 392 . 1 1 42 42 TRP H H 1 8.070 0.030 . 1 . . . . 42 TRP H . 10113 1 393 . 1 1 42 42 TRP HA H 1 4.399 0.030 . 1 . . . . 42 TRP HA . 10113 1 394 . 1 1 42 42 TRP HB2 H 1 2.989 0.030 . 2 . . . . 42 TRP HB2 . 10113 1 395 . 1 1 42 42 TRP HB3 H 1 2.862 0.030 . 2 . . . . 42 TRP HB3 . 10113 1 396 . 1 1 42 42 TRP HD1 H 1 7.198 0.030 . 1 . . . . 42 TRP HD1 . 10113 1 397 . 1 1 42 42 TRP HE1 H 1 10.010 0.030 . 1 . . . . 42 TRP HE1 . 10113 1 398 . 1 1 42 42 TRP HE3 H 1 7.033 0.030 . 1 . . . . 42 TRP HE3 . 10113 1 399 . 1 1 42 42 TRP HZ2 H 1 7.287 0.030 . 1 . . . . 42 TRP HZ2 . 10113 1 400 . 1 1 42 42 TRP HZ3 H 1 6.839 0.030 . 1 . . . . 42 TRP HZ3 . 10113 1 401 . 1 1 42 42 TRP HH2 H 1 6.857 0.030 . 1 . . . . 42 TRP HH2 . 10113 1 402 . 1 1 42 42 TRP C C 13 177.309 0.300 . 1 . . . . 42 TRP C . 10113 1 403 . 1 1 42 42 TRP CA C 13 57.295 0.300 . 1 . . . . 42 TRP CA . 10113 1 404 . 1 1 42 42 TRP CB C 13 31.652 0.300 . 1 . . . . 42 TRP CB . 10113 1 405 . 1 1 42 42 TRP CD1 C 13 127.736 0.300 . 1 . . . . 42 TRP CD1 . 10113 1 406 . 1 1 42 42 TRP CE3 C 13 119.178 0.300 . 1 . . . . 42 TRP CE3 . 10113 1 407 . 1 1 42 42 TRP CZ2 C 13 114.553 0.300 . 1 . . . . 42 TRP CZ2 . 10113 1 408 . 1 1 42 42 TRP CZ3 C 13 122.097 0.300 . 1 . . . . 42 TRP CZ3 . 10113 1 409 . 1 1 42 42 TRP CH2 C 13 124.099 0.300 . 1 . . . . 42 TRP CH2 . 10113 1 410 . 1 1 42 42 TRP N N 15 122.409 0.300 . 1 . . . . 42 TRP N . 10113 1 411 . 1 1 42 42 TRP NE1 N 15 129.336 0.300 . 1 . . . . 42 TRP NE1 . 10113 1 412 . 1 1 43 43 GLN H H 1 9.061 0.030 . 1 . . . . 43 GLN H . 10113 1 413 . 1 1 43 43 GLN HA H 1 4.815 0.030 . 1 . . . . 43 GLN HA . 10113 1 414 . 1 1 43 43 GLN HB2 H 1 1.983 0.030 . 2 . . . . 43 GLN HB2 . 10113 1 415 . 1 1 43 43 GLN HB3 H 1 1.620 0.030 . 2 . . . . 43 GLN HB3 . 10113 1 416 . 1 1 43 43 GLN HG2 H 1 2.148 0.030 . 2 . . . . 43 GLN HG2 . 10113 1 417 . 1 1 43 43 GLN HG3 H 1 2.213 0.030 . 2 . . . . 43 GLN HG3 . 10113 1 418 . 1 1 43 43 GLN HE21 H 1 7.318 0.030 . 2 . . . . 43 GLN HE21 . 10113 1 419 . 1 1 43 43 GLN HE22 H 1 6.733 0.030 . 2 . . . . 43 GLN HE22 . 10113 1 420 . 1 1 43 43 GLN C C 13 175.903 0.300 . 1 . . . . 43 GLN C . 10113 1 421 . 1 1 43 43 GLN CA C 13 54.588 0.300 . 1 . . . . 43 GLN CA . 10113 1 422 . 1 1 43 43 GLN CB C 13 32.650 0.300 . 1 . . . . 43 GLN CB . 10113 1 423 . 1 1 43 43 GLN CG C 13 34.360 0.300 . 1 . . . . 43 GLN CG . 10113 1 424 . 1 1 43 43 GLN N N 15 120.377 0.300 . 1 . . . . 43 GLN N . 10113 1 425 . 1 1 43 43 GLN NE2 N 15 111.901 0.300 . 1 . . . . 43 GLN NE2 . 10113 1 426 . 1 1 44 44 LYS H H 1 8.771 0.030 . 1 . . . . 44 LYS H . 10113 1 427 . 1 1 44 44 LYS HA H 1 4.766 0.030 . 1 . . . . 44 LYS HA . 10113 1 428 . 1 1 44 44 LYS HB2 H 1 1.873 0.030 . 2 . . . . 44 LYS HB2 . 10113 1 429 . 1 1 44 44 LYS HB3 H 1 2.033 0.030 . 2 . . . . 44 LYS HB3 . 10113 1 430 . 1 1 44 44 LYS HG2 H 1 1.466 0.030 . 2 . . . . 44 LYS HG2 . 10113 1 431 . 1 1 44 44 LYS HG3 H 1 1.673 0.030 . 2 . . . . 44 LYS HG3 . 10113 1 432 . 1 1 44 44 LYS HD2 H 1 1.766 0.030 . 1 . . . . 44 LYS HD2 . 10113 1 433 . 1 1 44 44 LYS HD3 H 1 1.766 0.030 . 1 . . . . 44 LYS HD3 . 10113 1 434 . 1 1 44 44 LYS HE2 H 1 3.005 0.030 . 1 . . . . 44 LYS HE2 . 10113 1 435 . 1 1 44 44 LYS HE3 H 1 3.005 0.030 . 1 . . . . 44 LYS HE3 . 10113 1 436 . 1 1 44 44 LYS C C 13 176.227 0.300 . 1 . . . . 44 LYS C . 10113 1 437 . 1 1 44 44 LYS CA C 13 57.764 0.300 . 1 . . . . 44 LYS CA . 10113 1 438 . 1 1 44 44 LYS CB C 13 32.981 0.300 . 1 . . . . 44 LYS CB . 10113 1 439 . 1 1 44 44 LYS CG C 13 25.934 0.300 . 1 . . . . 44 LYS CG . 10113 1 440 . 1 1 44 44 LYS CD C 13 29.540 0.300 . 1 . . . . 44 LYS CD . 10113 1 441 . 1 1 44 44 LYS CE C 13 41.991 0.300 . 1 . . . . 44 LYS CE . 10113 1 442 . 1 1 44 44 LYS N N 15 123.501 0.300 . 1 . . . . 44 LYS N . 10113 1 443 . 1 1 45 45 CYS H H 1 9.224 0.030 . 1 . . . . 45 CYS H . 10113 1 444 . 1 1 45 45 CYS HA H 1 5.743 0.030 . 1 . . . . 45 CYS HA . 10113 1 445 . 1 1 45 45 CYS HB2 H 1 2.899 0.030 . 2 . . . . 45 CYS HB2 . 10113 1 446 . 1 1 45 45 CYS HB3 H 1 2.867 0.030 . 2 . . . . 45 CYS HB3 . 10113 1 447 . 1 1 45 45 CYS C C 13 173.225 0.300 . 1 . . . . 45 CYS C . 10113 1 448 . 1 1 45 45 CYS CA C 13 55.332 0.300 . 1 . . . . 45 CYS CA . 10113 1 449 . 1 1 45 45 CYS CB C 13 33.475 0.300 . 1 . . . . 45 CYS CB . 10113 1 450 . 1 1 45 45 CYS N N 15 117.076 0.300 . 1 . . . . 45 CYS N . 10113 1 451 . 1 1 46 46 ARG H H 1 8.883 0.030 . 1 . . . . 46 ARG H . 10113 1 452 . 1 1 46 46 ARG HA H 1 5.228 0.030 . 1 . . . . 46 ARG HA . 10113 1 453 . 1 1 46 46 ARG HB2 H 1 1.936 0.030 . 2 . . . . 46 ARG HB2 . 10113 1 454 . 1 1 46 46 ARG HB3 H 1 2.103 0.030 . 2 . . . . 46 ARG HB3 . 10113 1 455 . 1 1 46 46 ARG HG2 H 1 1.280 0.030 . 2 . . . . 46 ARG HG2 . 10113 1 456 . 1 1 46 46 ARG HG3 H 1 1.610 0.030 . 2 . . . . 46 ARG HG3 . 10113 1 457 . 1 1 46 46 ARG HD2 H 1 3.212 0.030 . 2 . . . . 46 ARG HD2 . 10113 1 458 . 1 1 46 46 ARG HD3 H 1 2.833 0.030 . 2 . . . . 46 ARG HD3 . 10113 1 459 . 1 1 46 46 ARG HE H 1 7.183 0.030 . 1 . . . . 46 ARG HE . 10113 1 460 . 1 1 46 46 ARG C C 13 173.629 0.300 . 1 . . . . 46 ARG C . 10113 1 461 . 1 1 46 46 ARG CA C 13 55.157 0.300 . 1 . . . . 46 ARG CA . 10113 1 462 . 1 1 46 46 ARG CB C 13 33.429 0.300 . 1 . . . . 46 ARG CB . 10113 1 463 . 1 1 46 46 ARG CG C 13 27.717 0.300 . 1 . . . . 46 ARG CG . 10113 1 464 . 1 1 46 46 ARG CD C 13 43.441 0.300 . 1 . . . . 46 ARG CD . 10113 1 465 . 1 1 46 46 ARG N N 15 123.243 0.300 . 1 . . . . 46 ARG N . 10113 1 466 . 1 1 46 46 ARG NE N 15 83.034 0.300 . 1 . . . . 46 ARG NE . 10113 1 467 . 1 1 47 47 LEU H H 1 9.211 0.030 . 1 . . . . 47 LEU H . 10113 1 468 . 1 1 47 47 LEU HA H 1 5.034 0.030 . 1 . . . . 47 LEU HA . 10113 1 469 . 1 1 47 47 LEU HB2 H 1 0.430 0.030 . 2 . . . . 47 LEU HB2 . 10113 1 470 . 1 1 47 47 LEU HB3 H 1 1.400 0.030 . 2 . . . . 47 LEU HB3 . 10113 1 471 . 1 1 47 47 LEU HG H 1 0.733 0.030 . 1 . . . . 47 LEU HG . 10113 1 472 . 1 1 47 47 LEU HD11 H 1 -0.524 0.030 . 1 . . . . 47 LEU HD1 . 10113 1 473 . 1 1 47 47 LEU HD12 H 1 -0.524 0.030 . 1 . . . . 47 LEU HD1 . 10113 1 474 . 1 1 47 47 LEU HD13 H 1 -0.524 0.030 . 1 . . . . 47 LEU HD1 . 10113 1 475 . 1 1 47 47 LEU HD21 H 1 -0.665 0.030 . 1 . . . . 47 LEU HD2 . 10113 1 476 . 1 1 47 47 LEU HD22 H 1 -0.665 0.030 . 1 . . . . 47 LEU HD2 . 10113 1 477 . 1 1 47 47 LEU HD23 H 1 -0.665 0.030 . 1 . . . . 47 LEU HD2 . 10113 1 478 . 1 1 47 47 LEU C C 13 174.341 0.300 . 1 . . . . 47 LEU C . 10113 1 479 . 1 1 47 47 LEU CA C 13 53.055 0.300 . 1 . . . . 47 LEU CA . 10113 1 480 . 1 1 47 47 LEU CB C 13 45.310 0.300 . 1 . . . . 47 LEU CB . 10113 1 481 . 1 1 47 47 LEU CG C 13 26.622 0.300 . 1 . . . . 47 LEU CG . 10113 1 482 . 1 1 47 47 LEU CD1 C 13 21.670 0.300 . 2 . . . . 47 LEU CD1 . 10113 1 483 . 1 1 47 47 LEU CD2 C 13 25.086 0.300 . 2 . . . . 47 LEU CD2 . 10113 1 484 . 1 1 47 47 LEU N N 15 131.015 0.300 . 1 . . . . 47 LEU N . 10113 1 485 . 1 1 48 48 LEU H H 1 9.148 0.030 . 1 . . . . 48 LEU H . 10113 1 486 . 1 1 48 48 LEU HA H 1 5.394 0.030 . 1 . . . . 48 LEU HA . 10113 1 487 . 1 1 48 48 LEU HB2 H 1 1.658 0.030 . 2 . . . . 48 LEU HB2 . 10113 1 488 . 1 1 48 48 LEU HB3 H 1 1.983 0.030 . 2 . . . . 48 LEU HB3 . 10113 1 489 . 1 1 48 48 LEU HG H 1 1.663 0.030 . 1 . . . . 48 LEU HG . 10113 1 490 . 1 1 48 48 LEU HD11 H 1 0.994 0.030 . 1 . . . . 48 LEU HD1 . 10113 1 491 . 1 1 48 48 LEU HD12 H 1 0.994 0.030 . 1 . . . . 48 LEU HD1 . 10113 1 492 . 1 1 48 48 LEU HD13 H 1 0.994 0.030 . 1 . . . . 48 LEU HD1 . 10113 1 493 . 1 1 48 48 LEU HD21 H 1 1.038 0.030 . 1 . . . . 48 LEU HD2 . 10113 1 494 . 1 1 48 48 LEU HD22 H 1 1.038 0.030 . 1 . . . . 48 LEU HD2 . 10113 1 495 . 1 1 48 48 LEU HD23 H 1 1.038 0.030 . 1 . . . . 48 LEU HD2 . 10113 1 496 . 1 1 48 48 LEU C C 13 174.441 0.300 . 1 . . . . 48 LEU C . 10113 1 497 . 1 1 48 48 LEU CA C 13 53.994 0.300 . 1 . . . . 48 LEU CA . 10113 1 498 . 1 1 48 48 LEU CB C 13 47.083 0.300 . 1 . . . . 48 LEU CB . 10113 1 499 . 1 1 48 48 LEU CG C 13 28.364 0.300 . 1 . . . . 48 LEU CG . 10113 1 500 . 1 1 48 48 LEU CD1 C 13 25.381 0.300 . 2 . . . . 48 LEU CD1 . 10113 1 501 . 1 1 48 48 LEU CD2 C 13 25.919 0.300 . 2 . . . . 48 LEU CD2 . 10113 1 502 . 1 1 48 48 LEU N N 15 126.082 0.300 . 1 . . . . 48 LEU N . 10113 1 503 . 1 1 49 49 LEU H H 1 9.273 0.030 . 1 . . . . 49 LEU H . 10113 1 504 . 1 1 49 49 LEU HA H 1 5.393 0.030 . 1 . . . . 49 LEU HA . 10113 1 505 . 1 1 49 49 LEU HB2 H 1 2.080 0.030 . 2 . . . . 49 LEU HB2 . 10113 1 506 . 1 1 49 49 LEU HB3 H 1 1.479 0.030 . 2 . . . . 49 LEU HB3 . 10113 1 507 . 1 1 49 49 LEU HG H 1 1.463 0.030 . 1 . . . . 49 LEU HG . 10113 1 508 . 1 1 49 49 LEU HD11 H 1 0.711 0.030 . 1 . . . . 49 LEU HD1 . 10113 1 509 . 1 1 49 49 LEU HD12 H 1 0.711 0.030 . 1 . . . . 49 LEU HD1 . 10113 1 510 . 1 1 49 49 LEU HD13 H 1 0.711 0.030 . 1 . . . . 49 LEU HD1 . 10113 1 511 . 1 1 49 49 LEU HD21 H 1 0.951 0.030 . 1 . . . . 49 LEU HD2 . 10113 1 512 . 1 1 49 49 LEU HD22 H 1 0.951 0.030 . 1 . . . . 49 LEU HD2 . 10113 1 513 . 1 1 49 49 LEU HD23 H 1 0.951 0.030 . 1 . . . . 49 LEU HD2 . 10113 1 514 . 1 1 49 49 LEU C C 13 174.632 0.300 . 1 . . . . 49 LEU C . 10113 1 515 . 1 1 49 49 LEU CA C 13 53.848 0.300 . 1 . . . . 49 LEU CA . 10113 1 516 . 1 1 49 49 LEU CB C 13 44.468 0.300 . 1 . . . . 49 LEU CB . 10113 1 517 . 1 1 49 49 LEU CG C 13 28.102 0.300 . 1 . . . . 49 LEU CG . 10113 1 518 . 1 1 49 49 LEU CD1 C 13 26.063 0.300 . 2 . . . . 49 LEU CD1 . 10113 1 519 . 1 1 49 49 LEU CD2 C 13 23.838 0.300 . 2 . . . . 49 LEU CD2 . 10113 1 520 . 1 1 49 49 LEU N N 15 127.191 0.300 . 1 . . . . 49 LEU N . 10113 1 521 . 1 1 50 50 ARG H H 1 9.348 0.030 . 1 . . . . 50 ARG H . 10113 1 522 . 1 1 50 50 ARG HA H 1 5.378 0.030 . 1 . . . . 50 ARG HA . 10113 1 523 . 1 1 50 50 ARG HB2 H 1 1.812 0.030 . 1 . . . . 50 ARG HB2 . 10113 1 524 . 1 1 50 50 ARG HB3 H 1 1.812 0.030 . 1 . . . . 50 ARG HB3 . 10113 1 525 . 1 1 50 50 ARG HG2 H 1 1.555 0.030 . 1 . . . . 50 ARG HG2 . 10113 1 526 . 1 1 50 50 ARG HG3 H 1 1.555 0.030 . 1 . . . . 50 ARG HG3 . 10113 1 527 . 1 1 50 50 ARG HD2 H 1 3.093 0.030 . 2 . . . . 50 ARG HD2 . 10113 1 528 . 1 1 50 50 ARG HD3 H 1 3.193 0.030 . 2 . . . . 50 ARG HD3 . 10113 1 529 . 1 1 50 50 ARG HE H 1 7.857 0.030 . 1 . . . . 50 ARG HE . 10113 1 530 . 1 1 50 50 ARG C C 13 174.666 0.300 . 1 . . . . 50 ARG C . 10113 1 531 . 1 1 50 50 ARG CA C 13 54.071 0.300 . 1 . . . . 50 ARG CA . 10113 1 532 . 1 1 50 50 ARG CB C 13 33.796 0.300 . 1 . . . . 50 ARG CB . 10113 1 533 . 1 1 50 50 ARG CG C 13 26.394 0.300 . 1 . . . . 50 ARG CG . 10113 1 534 . 1 1 50 50 ARG CD C 13 43.648 0.300 . 1 . . . . 50 ARG CD . 10113 1 535 . 1 1 50 50 ARG N N 15 125.207 0.300 . 1 . . . . 50 ARG N . 10113 1 536 . 1 1 50 50 ARG NE N 15 84.784 0.300 . 1 . . . . 50 ARG NE . 10113 1 537 . 1 1 51 51 ARG H H 1 8.832 0.030 . 1 . . . . 51 ARG H . 10113 1 538 . 1 1 51 51 ARG HA H 1 4.439 0.030 . 1 . . . . 51 ARG HA . 10113 1 539 . 1 1 51 51 ARG HB2 H 1 1.612 0.030 . 2 . . . . 51 ARG HB2 . 10113 1 540 . 1 1 51 51 ARG HB3 H 1 1.699 0.030 . 2 . . . . 51 ARG HB3 . 10113 1 541 . 1 1 51 51 ARG HG2 H 1 1.463 0.030 . 1 . . . . 51 ARG HG2 . 10113 1 542 . 1 1 51 51 ARG HG3 H 1 1.463 0.030 . 1 . . . . 51 ARG HG3 . 10113 1 543 . 1 1 51 51 ARG HD2 H 1 3.113 0.030 . 2 . . . . 51 ARG HD2 . 10113 1 544 . 1 1 51 51 ARG HD3 H 1 3.293 0.030 . 2 . . . . 51 ARG HD3 . 10113 1 545 . 1 1 51 51 ARG C C 13 174.966 0.300 . 1 . . . . 51 ARG C . 10113 1 546 . 1 1 51 51 ARG CA C 13 56.079 0.300 . 1 . . . . 51 ARG CA . 10113 1 547 . 1 1 51 51 ARG CB C 13 31.616 0.300 . 1 . . . . 51 ARG CB . 10113 1 548 . 1 1 51 51 ARG CG C 13 28.012 0.300 . 1 . . . . 51 ARG CG . 10113 1 549 . 1 1 51 51 ARG CD C 13 43.582 0.300 . 1 . . . . 51 ARG CD . 10113 1 550 . 1 1 51 51 ARG N N 15 122.911 0.300 . 1 . . . . 51 ARG N . 10113 1 551 . 1 1 52 52 ALA H H 1 7.901 0.030 . 1 . . . . 52 ALA H . 10113 1 552 . 1 1 52 52 ALA HA H 1 4.517 0.030 . 1 . . . . 52 ALA HA . 10113 1 553 . 1 1 52 52 ALA HB1 H 1 1.291 0.030 . 1 . . . . 52 ALA HB . 10113 1 554 . 1 1 52 52 ALA HB2 H 1 1.291 0.030 . 1 . . . . 52 ALA HB . 10113 1 555 . 1 1 52 52 ALA HB3 H 1 1.291 0.030 . 1 . . . . 52 ALA HB . 10113 1 556 . 1 1 52 52 ALA C C 13 176.636 0.300 . 1 . . . . 52 ALA C . 10113 1 557 . 1 1 52 52 ALA CA C 13 50.992 0.300 . 1 . . . . 52 ALA CA . 10113 1 558 . 1 1 52 52 ALA CB C 13 21.612 0.300 . 1 . . . . 52 ALA CB . 10113 1 559 . 1 1 52 52 ALA N N 15 126.691 0.300 . 1 . . . . 52 ALA N . 10113 1 560 . 1 1 53 53 VAL H H 1 7.729 0.030 . 1 . . . . 53 VAL H . 10113 1 561 . 1 1 53 53 VAL HA H 1 4.176 0.030 . 1 . . . . 53 VAL HA . 10113 1 562 . 1 1 53 53 VAL HB H 1 2.187 0.030 . 1 . . . . 53 VAL HB . 10113 1 563 . 1 1 53 53 VAL HG11 H 1 0.898 0.030 . 1 . . . . 53 VAL HG1 . 10113 1 564 . 1 1 53 53 VAL HG12 H 1 0.898 0.030 . 1 . . . . 53 VAL HG1 . 10113 1 565 . 1 1 53 53 VAL HG13 H 1 0.898 0.030 . 1 . . . . 53 VAL HG1 . 10113 1 566 . 1 1 53 53 VAL HG21 H 1 0.927 0.030 . 1 . . . . 53 VAL HG2 . 10113 1 567 . 1 1 53 53 VAL HG22 H 1 0.927 0.030 . 1 . . . . 53 VAL HG2 . 10113 1 568 . 1 1 53 53 VAL HG23 H 1 0.927 0.030 . 1 . . . . 53 VAL HG2 . 10113 1 569 . 1 1 53 53 VAL C C 13 175.735 0.300 . 1 . . . . 53 VAL C . 10113 1 570 . 1 1 53 53 VAL CA C 13 61.814 0.300 . 1 . . . . 53 VAL CA . 10113 1 571 . 1 1 53 53 VAL CB C 13 33.467 0.300 . 1 . . . . 53 VAL CB . 10113 1 572 . 1 1 53 53 VAL CG1 C 13 19.613 0.300 . 2 . . . . 53 VAL CG1 . 10113 1 573 . 1 1 53 53 VAL CG2 C 13 21.238 0.300 . 2 . . . . 53 VAL CG2 . 10113 1 574 . 1 1 53 53 VAL N N 15 115.377 0.300 . 1 . . . . 53 VAL N . 10113 1 575 . 1 1 54 54 ALA H H 1 8.333 0.030 . 1 . . . . 54 ALA H . 10113 1 576 . 1 1 54 54 ALA HA H 1 4.218 0.030 . 1 . . . . 54 ALA HA . 10113 1 577 . 1 1 54 54 ALA HB1 H 1 1.408 0.030 . 1 . . . . 54 ALA HB . 10113 1 578 . 1 1 54 54 ALA HB2 H 1 1.408 0.030 . 1 . . . . 54 ALA HB . 10113 1 579 . 1 1 54 54 ALA HB3 H 1 1.408 0.030 . 1 . . . . 54 ALA HB . 10113 1 580 . 1 1 54 54 ALA CA C 13 53.225 0.300 . 1 . . . . 54 ALA CA . 10113 1 581 . 1 1 54 54 ALA CB C 13 18.713 0.300 . 1 . . . . 54 ALA CB . 10113 1 582 . 1 1 54 54 ALA N N 15 124.147 0.300 . 1 . . . . 54 ALA N . 10113 1 583 . 1 1 55 55 GLY H H 1 8.046 0.030 . 1 . . . . 55 GLY H . 10113 1 584 . 1 1 55 55 GLY HA2 H 1 3.690 0.030 . 2 . . . . 55 GLY HA2 . 10113 1 585 . 1 1 55 55 GLY HA3 H 1 4.135 0.030 . 2 . . . . 55 GLY HA3 . 10113 1 586 . 1 1 55 55 GLY C C 13 174.608 0.300 . 1 . . . . 55 GLY C . 10113 1 587 . 1 1 55 55 GLY CA C 13 45.569 0.300 . 1 . . . . 55 GLY CA . 10113 1 588 . 1 1 56 56 GLU H H 1 8.033 0.030 . 1 . . . . 56 GLU H . 10113 1 589 . 1 1 56 56 GLU HA H 1 4.330 0.030 . 1 . . . . 56 GLU HA . 10113 1 590 . 1 1 56 56 GLU HB2 H 1 2.071 0.030 . 2 . . . . 56 GLU HB2 . 10113 1 591 . 1 1 56 56 GLU HB3 H 1 2.001 0.030 . 2 . . . . 56 GLU HB3 . 10113 1 592 . 1 1 56 56 GLU HG2 H 1 2.343 0.030 . 2 . . . . 56 GLU HG2 . 10113 1 593 . 1 1 56 56 GLU HG3 H 1 2.253 0.030 . 2 . . . . 56 GLU HG3 . 10113 1 594 . 1 1 56 56 GLU C C 13 177.167 0.300 . 1 . . . . 56 GLU C . 10113 1 595 . 1 1 56 56 GLU CA C 13 56.515 0.300 . 1 . . . . 56 GLU CA . 10113 1 596 . 1 1 56 56 GLU CB C 13 30.767 0.300 . 1 . . . . 56 GLU CB . 10113 1 597 . 1 1 56 56 GLU CG C 13 36.422 0.300 . 1 . . . . 56 GLU CG . 10113 1 598 . 1 1 56 56 GLU N N 15 120.929 0.300 . 1 . . . . 56 GLU N . 10113 1 599 . 1 1 57 57 ARG H H 1 8.253 0.030 . 1 . . . . 57 ARG H . 10113 1 600 . 1 1 57 57 ARG HA H 1 3.912 0.030 . 1 . . . . 57 ARG HA . 10113 1 601 . 1 1 57 57 ARG HB2 H 1 1.763 0.030 . 2 . . . . 57 ARG HB2 . 10113 1 602 . 1 1 57 57 ARG HB3 H 1 2.126 0.030 . 2 . . . . 57 ARG HB3 . 10113 1 603 . 1 1 57 57 ARG HG2 H 1 1.603 0.030 . 2 . . . . 57 ARG HG2 . 10113 1 604 . 1 1 57 57 ARG HG3 H 1 1.473 0.030 . 2 . . . . 57 ARG HG3 . 10113 1 605 . 1 1 57 57 ARG HD2 H 1 3.263 0.030 . 1 . . . . 57 ARG HD2 . 10113 1 606 . 1 1 57 57 ARG HD3 H 1 3.263 0.030 . 1 . . . . 57 ARG HD3 . 10113 1 607 . 1 1 57 57 ARG C C 13 176.637 0.300 . 1 . . . . 57 ARG C . 10113 1 608 . 1 1 57 57 ARG CA C 13 59.375 0.300 . 1 . . . . 57 ARG CA . 10113 1 609 . 1 1 57 57 ARG CB C 13 30.560 0.300 . 1 . . . . 57 ARG CB . 10113 1 610 . 1 1 57 57 ARG CG C 13 27.879 0.300 . 1 . . . . 57 ARG CG . 10113 1 611 . 1 1 57 57 ARG CD C 13 43.483 0.300 . 1 . . . . 57 ARG CD . 10113 1 612 . 1 1 57 57 ARG N N 15 117.648 0.300 . 1 . . . . 57 ARG N . 10113 1 613 . 1 1 58 58 PHE H H 1 8.930 0.030 . 1 . . . . 58 PHE H . 10113 1 614 . 1 1 58 58 PHE HA H 1 5.411 0.030 . 1 . . . . 58 PHE HA . 10113 1 615 . 1 1 58 58 PHE HB2 H 1 3.022 0.030 . 2 . . . . 58 PHE HB2 . 10113 1 616 . 1 1 58 58 PHE HB3 H 1 2.769 0.030 . 2 . . . . 58 PHE HB3 . 10113 1 617 . 1 1 58 58 PHE HD1 H 1 7.148 0.030 . 1 . . . . 58 PHE HD1 . 10113 1 618 . 1 1 58 58 PHE HD2 H 1 7.148 0.030 . 1 . . . . 58 PHE HD2 . 10113 1 619 . 1 1 58 58 PHE HE1 H 1 7.334 0.030 . 1 . . . . 58 PHE HE1 . 10113 1 620 . 1 1 58 58 PHE HE2 H 1 7.334 0.030 . 1 . . . . 58 PHE HE2 . 10113 1 621 . 1 1 58 58 PHE HZ H 1 7.344 0.030 . 1 . . . . 58 PHE HZ . 10113 1 622 . 1 1 58 58 PHE C C 13 175.291 0.300 . 1 . . . . 58 PHE C . 10113 1 623 . 1 1 58 58 PHE CA C 13 57.271 0.300 . 1 . . . . 58 PHE CA . 10113 1 624 . 1 1 58 58 PHE CB C 13 44.079 0.300 . 1 . . . . 58 PHE CB . 10113 1 625 . 1 1 58 58 PHE CD1 C 13 132.171 0.300 . 1 . . . . 58 PHE CD1 . 10113 1 626 . 1 1 58 58 PHE CD2 C 13 132.171 0.300 . 1 . . . . 58 PHE CD2 . 10113 1 627 . 1 1 58 58 PHE CE1 C 13 131.512 0.300 . 1 . . . . 58 PHE CE1 . 10113 1 628 . 1 1 58 58 PHE CE2 C 13 131.512 0.300 . 1 . . . . 58 PHE CE2 . 10113 1 629 . 1 1 58 58 PHE CZ C 13 130.371 0.300 . 1 . . . . 58 PHE CZ . 10113 1 630 . 1 1 58 58 PHE N N 15 117.545 0.300 . 1 . . . . 58 PHE N . 10113 1 631 . 1 1 59 59 ARG H H 1 9.134 0.030 . 1 . . . . 59 ARG H . 10113 1 632 . 1 1 59 59 ARG HA H 1 5.033 0.030 . 1 . . . . 59 ARG HA . 10113 1 633 . 1 1 59 59 ARG HB2 H 1 1.461 0.030 . 2 . . . . 59 ARG HB2 . 10113 1 634 . 1 1 59 59 ARG HB3 H 1 1.572 0.030 . 2 . . . . 59 ARG HB3 . 10113 1 635 . 1 1 59 59 ARG HG2 H 1 1.463 0.030 . 1 . . . . 59 ARG HG2 . 10113 1 636 . 1 1 59 59 ARG HG3 H 1 1.463 0.030 . 1 . . . . 59 ARG HG3 . 10113 1 637 . 1 1 59 59 ARG HD2 H 1 2.982 0.030 . 1 . . . . 59 ARG HD2 . 10113 1 638 . 1 1 59 59 ARG HD3 H 1 2.982 0.030 . 1 . . . . 59 ARG HD3 . 10113 1 639 . 1 1 59 59 ARG C C 13 173.393 0.300 . 1 . . . . 59 ARG C . 10113 1 640 . 1 1 59 59 ARG CA C 13 55.183 0.300 . 1 . . . . 59 ARG CA . 10113 1 641 . 1 1 59 59 ARG CB C 13 34.878 0.300 . 1 . . . . 59 ARG CB . 10113 1 642 . 1 1 59 59 ARG CG C 13 27.872 0.300 . 1 . . . . 59 ARG CG . 10113 1 643 . 1 1 59 59 ARG CD C 13 43.651 0.300 . 1 . . . . 59 ARG CD . 10113 1 644 . 1 1 59 59 ARG N N 15 119.174 0.300 . 1 . . . . 59 ARG N . 10113 1 645 . 1 1 60 60 LEU H H 1 8.904 0.030 . 1 . . . . 60 LEU H . 10113 1 646 . 1 1 60 60 LEU HA H 1 5.406 0.030 . 1 . . . . 60 LEU HA . 10113 1 647 . 1 1 60 60 LEU HB2 H 1 1.383 0.030 . 2 . . . . 60 LEU HB2 . 10113 1 648 . 1 1 60 60 LEU HB3 H 1 1.521 0.030 . 2 . . . . 60 LEU HB3 . 10113 1 649 . 1 1 60 60 LEU HG H 1 1.393 0.030 . 1 . . . . 60 LEU HG . 10113 1 650 . 1 1 60 60 LEU HD11 H 1 0.795 0.030 . 1 . . . . 60 LEU HD1 . 10113 1 651 . 1 1 60 60 LEU HD12 H 1 0.795 0.030 . 1 . . . . 60 LEU HD1 . 10113 1 652 . 1 1 60 60 LEU HD13 H 1 0.795 0.030 . 1 . . . . 60 LEU HD1 . 10113 1 653 . 1 1 60 60 LEU HD21 H 1 0.763 0.030 . 1 . . . . 60 LEU HD2 . 10113 1 654 . 1 1 60 60 LEU HD22 H 1 0.763 0.030 . 1 . . . . 60 LEU HD2 . 10113 1 655 . 1 1 60 60 LEU HD23 H 1 0.763 0.030 . 1 . . . . 60 LEU HD2 . 10113 1 656 . 1 1 60 60 LEU C C 13 175.543 0.300 . 1 . . . . 60 LEU C . 10113 1 657 . 1 1 60 60 LEU CA C 13 53.160 0.300 . 1 . . . . 60 LEU CA . 10113 1 658 . 1 1 60 60 LEU CB C 13 44.776 0.300 . 1 . . . . 60 LEU CB . 10113 1 659 . 1 1 60 60 LEU CG C 13 26.852 0.300 . 1 . . . . 60 LEU CG . 10113 1 660 . 1 1 60 60 LEU CD1 C 13 25.655 0.300 . 2 . . . . 60 LEU CD1 . 10113 1 661 . 1 1 60 60 LEU CD2 C 13 26.129 0.300 . 2 . . . . 60 LEU CD2 . 10113 1 662 . 1 1 60 60 LEU N N 15 123.464 0.300 . 1 . . . . 60 LEU N . 10113 1 663 . 1 1 61 61 GLU H H 1 9.437 0.030 . 1 . . . . 61 GLU H . 10113 1 664 . 1 1 61 61 GLU HA H 1 5.117 0.030 . 1 . . . . 61 GLU HA . 10113 1 665 . 1 1 61 61 GLU HB2 H 1 2.183 0.030 . 2 . . . . 61 GLU HB2 . 10113 1 666 . 1 1 61 61 GLU HB3 H 1 1.564 0.030 . 2 . . . . 61 GLU HB3 . 10113 1 667 . 1 1 61 61 GLU HG2 H 1 2.159 0.030 . 2 . . . . 61 GLU HG2 . 10113 1 668 . 1 1 61 61 GLU HG3 H 1 2.100 0.030 . 2 . . . . 61 GLU HG3 . 10113 1 669 . 1 1 61 61 GLU C C 13 173.825 0.300 . 1 . . . . 61 GLU C . 10113 1 670 . 1 1 61 61 GLU CA C 13 55.040 0.300 . 1 . . . . 61 GLU CA . 10113 1 671 . 1 1 61 61 GLU CB C 13 33.837 0.300 . 1 . . . . 61 GLU CB . 10113 1 672 . 1 1 61 61 GLU CG C 13 37.186 0.300 . 1 . . . . 61 GLU CG . 10113 1 673 . 1 1 61 61 GLU N N 15 123.353 0.300 . 1 . . . . 61 GLU N . 10113 1 674 . 1 1 62 62 PHE H H 1 8.624 0.030 . 1 . . . . 62 PHE H . 10113 1 675 . 1 1 62 62 PHE HA H 1 4.873 0.030 . 1 . . . . 62 PHE HA . 10113 1 676 . 1 1 62 62 PHE HB2 H 1 2.876 0.030 . 2 . . . . 62 PHE HB2 . 10113 1 677 . 1 1 62 62 PHE HB3 H 1 2.003 0.030 . 2 . . . . 62 PHE HB3 . 10113 1 678 . 1 1 62 62 PHE HD1 H 1 6.325 0.030 . 1 . . . . 62 PHE HD1 . 10113 1 679 . 1 1 62 62 PHE HD2 H 1 6.325 0.030 . 1 . . . . 62 PHE HD2 . 10113 1 680 . 1 1 62 62 PHE HE1 H 1 6.331 0.030 . 1 . . . . 62 PHE HE1 . 10113 1 681 . 1 1 62 62 PHE HE2 H 1 6.331 0.030 . 1 . . . . 62 PHE HE2 . 10113 1 682 . 1 1 62 62 PHE HZ H 1 6.282 0.030 . 1 . . . . 62 PHE HZ . 10113 1 683 . 1 1 62 62 PHE C C 13 174.727 0.300 . 1 . . . . 62 PHE C . 10113 1 684 . 1 1 62 62 PHE CA C 13 55.445 0.300 . 1 . . . . 62 PHE CA . 10113 1 685 . 1 1 62 62 PHE CB C 13 39.841 0.300 . 1 . . . . 62 PHE CB . 10113 1 686 . 1 1 62 62 PHE CD1 C 13 131.725 0.300 . 1 . . . . 62 PHE CD1 . 10113 1 687 . 1 1 62 62 PHE CD2 C 13 131.725 0.300 . 1 . . . . 62 PHE CD2 . 10113 1 688 . 1 1 62 62 PHE CE1 C 13 129.924 0.300 . 1 . . . . 62 PHE CE1 . 10113 1 689 . 1 1 62 62 PHE CE2 C 13 129.924 0.300 . 1 . . . . 62 PHE CE2 . 10113 1 690 . 1 1 62 62 PHE CZ C 13 127.645 0.300 . 1 . . . . 62 PHE CZ . 10113 1 691 . 1 1 62 62 PHE N N 15 120.884 0.300 . 1 . . . . 62 PHE N . 10113 1 692 . 1 1 63 63 PHE H H 1 9.759 0.030 . 1 . . . . 63 PHE H . 10113 1 693 . 1 1 63 63 PHE HA H 1 4.513 0.030 . 1 . . . . 63 PHE HA . 10113 1 694 . 1 1 63 63 PHE HB2 H 1 3.349 0.030 . 2 . . . . 63 PHE HB2 . 10113 1 695 . 1 1 63 63 PHE HB3 H 1 2.933 0.030 . 2 . . . . 63 PHE HB3 . 10113 1 696 . 1 1 63 63 PHE HD1 H 1 7.054 0.030 . 1 . . . . 63 PHE HD1 . 10113 1 697 . 1 1 63 63 PHE HD2 H 1 7.054 0.030 . 1 . . . . 63 PHE HD2 . 10113 1 698 . 1 1 63 63 PHE HE1 H 1 7.075 0.030 . 1 . . . . 63 PHE HE1 . 10113 1 699 . 1 1 63 63 PHE HE2 H 1 7.075 0.030 . 1 . . . . 63 PHE HE2 . 10113 1 700 . 1 1 63 63 PHE HZ H 1 7.265 0.030 . 1 . . . . 63 PHE HZ . 10113 1 701 . 1 1 63 63 PHE C C 13 174.011 0.300 . 1 . . . . 63 PHE C . 10113 1 702 . 1 1 63 63 PHE CA C 13 58.410 0.300 . 1 . . . . 63 PHE CA . 10113 1 703 . 1 1 63 63 PHE CB C 13 39.405 0.300 . 1 . . . . 63 PHE CB . 10113 1 704 . 1 1 63 63 PHE CD1 C 13 132.137 0.300 . 1 . . . . 63 PHE CD1 . 10113 1 705 . 1 1 63 63 PHE CD2 C 13 132.137 0.300 . 1 . . . . 63 PHE CD2 . 10113 1 706 . 1 1 63 63 PHE CE1 C 13 131.290 0.300 . 1 . . . . 63 PHE CE1 . 10113 1 707 . 1 1 63 63 PHE CE2 C 13 131.290 0.300 . 1 . . . . 63 PHE CE2 . 10113 1 708 . 1 1 63 63 PHE CZ C 13 129.336 0.300 . 1 . . . . 63 PHE CZ . 10113 1 709 . 1 1 63 63 PHE N N 15 124.570 0.300 . 1 . . . . 63 PHE N . 10113 1 710 . 1 1 64 64 VAL H H 1 8.904 0.030 . 1 . . . . 64 VAL H . 10113 1 711 . 1 1 64 64 VAL HA H 1 4.315 0.030 . 1 . . . . 64 VAL HA . 10113 1 712 . 1 1 64 64 VAL HB H 1 2.032 0.030 . 1 . . . . 64 VAL HB . 10113 1 713 . 1 1 64 64 VAL HG11 H 1 1.138 0.030 . 1 . . . . 64 VAL HG1 . 10113 1 714 . 1 1 64 64 VAL HG12 H 1 1.138 0.030 . 1 . . . . 64 VAL HG1 . 10113 1 715 . 1 1 64 64 VAL HG13 H 1 1.138 0.030 . 1 . . . . 64 VAL HG1 . 10113 1 716 . 1 1 64 64 VAL HG21 H 1 1.047 0.030 . 1 . . . . 64 VAL HG2 . 10113 1 717 . 1 1 64 64 VAL HG22 H 1 1.047 0.030 . 1 . . . . 64 VAL HG2 . 10113 1 718 . 1 1 64 64 VAL HG23 H 1 1.047 0.030 . 1 . . . . 64 VAL HG2 . 10113 1 719 . 1 1 64 64 VAL C C 13 174.845 0.300 . 1 . . . . 64 VAL C . 10113 1 720 . 1 1 64 64 VAL CA C 13 59.320 0.300 . 1 . . . . 64 VAL CA . 10113 1 721 . 1 1 64 64 VAL CB C 13 36.132 0.300 . 1 . . . . 64 VAL CB . 10113 1 722 . 1 1 64 64 VAL CG1 C 13 20.506 0.300 . 2 . . . . 64 VAL CG1 . 10113 1 723 . 1 1 64 64 VAL CG2 C 13 21.225 0.300 . 2 . . . . 64 VAL CG2 . 10113 1 724 . 1 1 64 64 VAL N N 15 125.520 0.300 . 1 . . . . 64 VAL N . 10113 1 725 . 1 1 65 65 PRO HA H 1 5.277 0.030 . 1 . . . . 65 PRO HA . 10113 1 726 . 1 1 65 65 PRO HB2 H 1 2.583 0.030 . 1 . . . . 65 PRO HB2 . 10113 1 727 . 1 1 65 65 PRO HB3 H 1 2.583 0.030 . 1 . . . . 65 PRO HB3 . 10113 1 728 . 1 1 65 65 PRO HG2 H 1 1.794 0.030 . 2 . . . . 65 PRO HG2 . 10113 1 729 . 1 1 65 65 PRO HG3 H 1 2.108 0.030 . 2 . . . . 65 PRO HG3 . 10113 1 730 . 1 1 65 65 PRO HD2 H 1 3.814 0.030 . 2 . . . . 65 PRO HD2 . 10113 1 731 . 1 1 65 65 PRO HD3 H 1 3.642 0.030 . 2 . . . . 65 PRO HD3 . 10113 1 732 . 1 1 65 65 PRO CA C 13 63.664 0.300 . 1 . . . . 65 PRO CA . 10113 1 733 . 1 1 65 65 PRO CB C 13 32.495 0.300 . 1 . . . . 65 PRO CB . 10113 1 734 . 1 1 65 65 PRO CG C 13 25.409 0.300 . 1 . . . . 65 PRO CG . 10113 1 735 . 1 1 65 65 PRO CD C 13 49.996 0.300 . 1 . . . . 65 PRO CD . 10113 1 736 . 1 1 66 66 PRO HA H 1 4.295 0.030 . 1 . . . . 66 PRO HA . 10113 1 737 . 1 1 66 66 PRO HB2 H 1 2.410 0.030 . 2 . . . . 66 PRO HB2 . 10113 1 738 . 1 1 66 66 PRO HB3 H 1 1.965 0.030 . 2 . . . . 66 PRO HB3 . 10113 1 739 . 1 1 66 66 PRO HG2 H 1 1.634 0.030 . 2 . . . . 66 PRO HG2 . 10113 1 740 . 1 1 66 66 PRO HG3 H 1 2.244 0.030 . 2 . . . . 66 PRO HG3 . 10113 1 741 . 1 1 66 66 PRO HD2 H 1 3.873 0.030 . 2 . . . . 66 PRO HD2 . 10113 1 742 . 1 1 66 66 PRO HD3 H 1 3.803 0.030 . 2 . . . . 66 PRO HD3 . 10113 1 743 . 1 1 66 66 PRO C C 13 177.066 0.300 . 1 . . . . 66 PRO C . 10113 1 744 . 1 1 66 66 PRO CA C 13 66.477 0.300 . 1 . . . . 66 PRO CA . 10113 1 745 . 1 1 66 66 PRO CB C 13 32.667 0.300 . 1 . . . . 66 PRO CB . 10113 1 746 . 1 1 66 66 PRO CG C 13 27.977 0.300 . 1 . . . . 66 PRO CG . 10113 1 747 . 1 1 66 66 PRO CD C 13 49.926 0.300 . 1 . . . . 66 PRO CD . 10113 1 748 . 1 1 67 67 LYS H H 1 7.833 0.030 . 1 . . . . 67 LYS H . 10113 1 749 . 1 1 67 67 LYS HA H 1 4.302 0.030 . 1 . . . . 67 LYS HA . 10113 1 750 . 1 1 67 67 LYS HB2 H 1 1.995 0.030 . 2 . . . . 67 LYS HB2 . 10113 1 751 . 1 1 67 67 LYS HB3 H 1 1.763 0.030 . 2 . . . . 67 LYS HB3 . 10113 1 752 . 1 1 67 67 LYS HG2 H 1 1.353 0.030 . 2 . . . . 67 LYS HG2 . 10113 1 753 . 1 1 67 67 LYS HG3 H 1 1.424 0.030 . 2 . . . . 67 LYS HG3 . 10113 1 754 . 1 1 67 67 LYS HD2 H 1 1.663 0.030 . 1 . . . . 67 LYS HD2 . 10113 1 755 . 1 1 67 67 LYS HD3 H 1 1.663 0.030 . 1 . . . . 67 LYS HD3 . 10113 1 756 . 1 1 67 67 LYS HE2 H 1 3.011 0.030 . 1 . . . . 67 LYS HE2 . 10113 1 757 . 1 1 67 67 LYS HE3 H 1 3.011 0.030 . 1 . . . . 67 LYS HE3 . 10113 1 758 . 1 1 67 67 LYS C C 13 176.336 0.300 . 1 . . . . 67 LYS C . 10113 1 759 . 1 1 67 67 LYS CA C 13 55.739 0.300 . 1 . . . . 67 LYS CA . 10113 1 760 . 1 1 67 67 LYS CB C 13 31.450 0.300 . 1 . . . . 67 LYS CB . 10113 1 761 . 1 1 67 67 LYS CG C 13 25.202 0.300 . 1 . . . . 67 LYS CG . 10113 1 762 . 1 1 67 67 LYS CD C 13 29.090 0.300 . 1 . . . . 67 LYS CD . 10113 1 763 . 1 1 67 67 LYS CE C 13 42.003 0.300 . 1 . . . . 67 LYS CE . 10113 1 764 . 1 1 67 67 LYS N N 15 112.009 0.300 . 1 . . . . 67 LYS N . 10113 1 765 . 1 1 68 68 ALA H H 1 8.131 0.030 . 1 . . . . 68 ALA H . 10113 1 766 . 1 1 68 68 ALA HA H 1 4.267 0.030 . 1 . . . . 68 ALA HA . 10113 1 767 . 1 1 68 68 ALA HB1 H 1 1.729 0.030 . 1 . . . . 68 ALA HB . 10113 1 768 . 1 1 68 68 ALA HB2 H 1 1.729 0.030 . 1 . . . . 68 ALA HB . 10113 1 769 . 1 1 68 68 ALA HB3 H 1 1.729 0.030 . 1 . . . . 68 ALA HB . 10113 1 770 . 1 1 68 68 ALA C C 13 177.143 0.300 . 1 . . . . 68 ALA C . 10113 1 771 . 1 1 68 68 ALA CA C 13 52.921 0.300 . 1 . . . . 68 ALA CA . 10113 1 772 . 1 1 68 68 ALA CB C 13 20.333 0.300 . 1 . . . . 68 ALA CB . 10113 1 773 . 1 1 68 68 ALA N N 15 124.515 0.300 . 1 . . . . 68 ALA N . 10113 1 774 . 1 1 69 69 SER H H 1 8.464 0.030 . 1 . . . . 69 SER H . 10113 1 775 . 1 1 69 69 SER HA H 1 4.424 0.030 . 1 . . . . 69 SER HA . 10113 1 776 . 1 1 69 69 SER HB2 H 1 4.013 0.030 . 2 . . . . 69 SER HB2 . 10113 1 777 . 1 1 69 69 SER HB3 H 1 3.952 0.030 . 2 . . . . 69 SER HB3 . 10113 1 778 . 1 1 69 69 SER C C 13 174.727 0.300 . 1 . . . . 69 SER C . 10113 1 779 . 1 1 69 69 SER CA C 13 59.690 0.300 . 1 . . . . 69 SER CA . 10113 1 780 . 1 1 69 69 SER CB C 13 63.881 0.300 . 1 . . . . 69 SER CB . 10113 1 781 . 1 1 69 69 SER N N 15 121.380 0.300 . 1 . . . . 69 SER N . 10113 1 782 . 1 1 70 70 ARG H H 1 7.802 0.030 . 1 . . . . 70 ARG H . 10113 1 783 . 1 1 70 70 ARG HA H 1 5.002 0.030 . 1 . . . . 70 ARG HA . 10113 1 784 . 1 1 70 70 ARG HB2 H 1 1.719 0.030 . 2 . . . . 70 ARG HB2 . 10113 1 785 . 1 1 70 70 ARG HB3 H 1 1.858 0.030 . 2 . . . . 70 ARG HB3 . 10113 1 786 . 1 1 70 70 ARG HG2 H 1 1.673 0.030 . 1 . . . . 70 ARG HG2 . 10113 1 787 . 1 1 70 70 ARG HG3 H 1 1.673 0.030 . 1 . . . . 70 ARG HG3 . 10113 1 788 . 1 1 70 70 ARG HD2 H 1 3.250 0.030 . 1 . . . . 70 ARG HD2 . 10113 1 789 . 1 1 70 70 ARG HD3 H 1 3.250 0.030 . 1 . . . . 70 ARG HD3 . 10113 1 790 . 1 1 70 70 ARG C C 13 173.346 0.300 . 1 . . . . 70 ARG C . 10113 1 791 . 1 1 70 70 ARG CA C 13 52.594 0.300 . 1 . . . . 70 ARG CA . 10113 1 792 . 1 1 70 70 ARG CB C 13 31.758 0.300 . 1 . . . . 70 ARG CB . 10113 1 793 . 1 1 70 70 ARG CG C 13 26.692 0.300 . 1 . . . . 70 ARG CG . 10113 1 794 . 1 1 70 70 ARG CD C 13 43.326 0.300 . 1 . . . . 70 ARG CD . 10113 1 795 . 1 1 70 70 ARG N N 15 120.307 0.300 . 1 . . . . 70 ARG N . 10113 1 796 . 1 1 71 71 PRO HA H 1 3.559 0.030 . 1 . . . . 71 PRO HA . 10113 1 797 . 1 1 71 71 PRO HB2 H 1 1.392 0.030 . 2 . . . . 71 PRO HB2 . 10113 1 798 . 1 1 71 71 PRO HB3 H 1 0.636 0.030 . 2 . . . . 71 PRO HB3 . 10113 1 799 . 1 1 71 71 PRO HG2 H 1 1.769 0.030 . 2 . . . . 71 PRO HG2 . 10113 1 800 . 1 1 71 71 PRO HG3 H 1 1.623 0.030 . 2 . . . . 71 PRO HG3 . 10113 1 801 . 1 1 71 71 PRO HD2 H 1 3.618 0.030 . 1 . . . . 71 PRO HD2 . 10113 1 802 . 1 1 71 71 PRO HD3 H 1 3.618 0.030 . 1 . . . . 71 PRO HD3 . 10113 1 803 . 1 1 71 71 PRO C C 13 175.873 0.300 . 1 . . . . 71 PRO C . 10113 1 804 . 1 1 71 71 PRO CA C 13 62.875 0.300 . 1 . . . . 71 PRO CA . 10113 1 805 . 1 1 71 71 PRO CB C 13 31.409 0.300 . 1 . . . . 71 PRO CB . 10113 1 806 . 1 1 71 71 PRO CG C 13 25.882 0.300 . 1 . . . . 71 PRO CG . 10113 1 807 . 1 1 71 71 PRO CD C 13 50.258 0.300 . 1 . . . . 71 PRO CD . 10113 1 808 . 1 1 72 72 LYS H H 1 8.664 0.030 . 1 . . . . 72 LYS H . 10113 1 809 . 1 1 72 72 LYS HA H 1 4.213 0.030 . 1 . . . . 72 LYS HA . 10113 1 810 . 1 1 72 72 LYS HB2 H 1 2.233 0.030 . 2 . . . . 72 LYS HB2 . 10113 1 811 . 1 1 72 72 LYS HB3 H 1 1.643 0.030 . 2 . . . . 72 LYS HB3 . 10113 1 812 . 1 1 72 72 LYS HG2 H 1 1.591 0.030 . 2 . . . . 72 LYS HG2 . 10113 1 813 . 1 1 72 72 LYS HG3 H 1 1.527 0.030 . 2 . . . . 72 LYS HG3 . 10113 1 814 . 1 1 72 72 LYS HD2 H 1 1.803 0.030 . 2 . . . . 72 LYS HD2 . 10113 1 815 . 1 1 72 72 LYS HD3 H 1 1.693 0.030 . 2 . . . . 72 LYS HD3 . 10113 1 816 . 1 1 72 72 LYS HE2 H 1 3.093 0.030 . 2 . . . . 72 LYS HE2 . 10113 1 817 . 1 1 72 72 LYS HE3 H 1 3.053 0.030 . 2 . . . . 72 LYS HE3 . 10113 1 818 . 1 1 72 72 LYS C C 13 176.359 0.300 . 1 . . . . 72 LYS C . 10113 1 819 . 1 1 72 72 LYS CA C 13 57.218 0.300 . 1 . . . . 72 LYS CA . 10113 1 820 . 1 1 72 72 LYS CB C 13 33.937 0.300 . 1 . . . . 72 LYS CB . 10113 1 821 . 1 1 72 72 LYS CG C 13 25.128 0.300 . 1 . . . . 72 LYS CG . 10113 1 822 . 1 1 72 72 LYS CD C 13 29.336 0.300 . 1 . . . . 72 LYS CD . 10113 1 823 . 1 1 72 72 LYS CE C 13 42.250 0.300 . 1 . . . . 72 LYS CE . 10113 1 824 . 1 1 72 72 LYS N N 15 125.455 0.300 . 1 . . . . 72 LYS N . 10113 1 825 . 1 1 73 73 VAL H H 1 7.144 0.030 . 1 . . . . 73 VAL H . 10113 1 826 . 1 1 73 73 VAL HA H 1 4.184 0.030 . 1 . . . . 73 VAL HA . 10113 1 827 . 1 1 73 73 VAL HB H 1 1.384 0.030 . 1 . . . . 73 VAL HB . 10113 1 828 . 1 1 73 73 VAL HG11 H 1 0.461 0.030 . 1 . . . . 73 VAL HG1 . 10113 1 829 . 1 1 73 73 VAL HG12 H 1 0.461 0.030 . 1 . . . . 73 VAL HG1 . 10113 1 830 . 1 1 73 73 VAL HG13 H 1 0.461 0.030 . 1 . . . . 73 VAL HG1 . 10113 1 831 . 1 1 73 73 VAL HG21 H 1 0.650 0.030 . 1 . . . . 73 VAL HG2 . 10113 1 832 . 1 1 73 73 VAL HG22 H 1 0.650 0.030 . 1 . . . . 73 VAL HG2 . 10113 1 833 . 1 1 73 73 VAL HG23 H 1 0.650 0.030 . 1 . . . . 73 VAL HG2 . 10113 1 834 . 1 1 73 73 VAL C C 13 174.005 0.300 . 1 . . . . 73 VAL C . 10113 1 835 . 1 1 73 73 VAL CA C 13 60.650 0.300 . 1 . . . . 73 VAL CA . 10113 1 836 . 1 1 73 73 VAL CB C 13 35.272 0.300 . 1 . . . . 73 VAL CB . 10113 1 837 . 1 1 73 73 VAL CG1 C 13 20.666 0.300 . 2 . . . . 73 VAL CG1 . 10113 1 838 . 1 1 73 73 VAL CG2 C 13 20.267 0.300 . 2 . . . . 73 VAL CG2 . 10113 1 839 . 1 1 73 73 VAL N N 15 115.496 0.300 . 1 . . . . 73 VAL N . 10113 1 840 . 1 1 74 74 SER H H 1 8.503 0.030 . 1 . . . . 74 SER H . 10113 1 841 . 1 1 74 74 SER HA H 1 5.286 0.030 . 1 . . . . 74 SER HA . 10113 1 842 . 1 1 74 74 SER HB2 H 1 3.458 0.030 . 2 . . . . 74 SER HB2 . 10113 1 843 . 1 1 74 74 SER HB3 H 1 3.628 0.030 . 2 . . . . 74 SER HB3 . 10113 1 844 . 1 1 74 74 SER C C 13 173.820 0.300 . 1 . . . . 74 SER C . 10113 1 845 . 1 1 74 74 SER CA C 13 56.700 0.300 . 1 . . . . 74 SER CA . 10113 1 846 . 1 1 74 74 SER CB C 13 63.486 0.300 . 1 . . . . 74 SER CB . 10113 1 847 . 1 1 74 74 SER N N 15 122.081 0.300 . 1 . . . . 74 SER N . 10113 1 848 . 1 1 75 75 ILE H H 1 9.393 0.030 . 1 . . . . 75 ILE H . 10113 1 849 . 1 1 75 75 ILE HA H 1 4.782 0.030 . 1 . . . . 75 ILE HA . 10113 1 850 . 1 1 75 75 ILE HB H 1 1.839 0.030 . 1 . . . . 75 ILE HB . 10113 1 851 . 1 1 75 75 ILE HG12 H 1 1.377 0.030 . 2 . . . . 75 ILE HG12 . 10113 1 852 . 1 1 75 75 ILE HG13 H 1 0.884 0.030 . 2 . . . . 75 ILE HG13 . 10113 1 853 . 1 1 75 75 ILE HG21 H 1 0.908 0.030 . 1 . . . . 75 ILE HG2 . 10113 1 854 . 1 1 75 75 ILE HG22 H 1 0.908 0.030 . 1 . . . . 75 ILE HG2 . 10113 1 855 . 1 1 75 75 ILE HG23 H 1 0.908 0.030 . 1 . . . . 75 ILE HG2 . 10113 1 856 . 1 1 75 75 ILE HD11 H 1 0.374 0.030 . 1 . . . . 75 ILE HD1 . 10113 1 857 . 1 1 75 75 ILE HD12 H 1 0.374 0.030 . 1 . . . . 75 ILE HD1 . 10113 1 858 . 1 1 75 75 ILE HD13 H 1 0.374 0.030 . 1 . . . . 75 ILE HD1 . 10113 1 859 . 1 1 75 75 ILE CA C 13 57.667 0.300 . 1 . . . . 75 ILE CA . 10113 1 860 . 1 1 75 75 ILE CB C 13 42.118 0.300 . 1 . . . . 75 ILE CB . 10113 1 861 . 1 1 75 75 ILE CG1 C 13 26.625 0.300 . 1 . . . . 75 ILE CG1 . 10113 1 862 . 1 1 75 75 ILE CG2 C 13 17.520 0.300 . 1 . . . . 75 ILE CG2 . 10113 1 863 . 1 1 75 75 ILE CD1 C 13 13.617 0.300 . 1 . . . . 75 ILE CD1 . 10113 1 864 . 1 1 75 75 ILE N N 15 127.126 0.300 . 1 . . . . 75 ILE N . 10113 1 865 . 1 1 76 76 PRO HA H 1 4.853 0.030 . 1 . . . . 76 PRO HA . 10113 1 866 . 1 1 76 76 PRO HB2 H 1 2.223 0.030 . 1 . . . . 76 PRO HB2 . 10113 1 867 . 1 1 76 76 PRO HB3 H 1 2.223 0.030 . 1 . . . . 76 PRO HB3 . 10113 1 868 . 1 1 76 76 PRO HG2 H 1 2.054 0.030 . 2 . . . . 76 PRO HG2 . 10113 1 869 . 1 1 76 76 PRO HG3 H 1 2.233 0.030 . 2 . . . . 76 PRO HG3 . 10113 1 870 . 1 1 76 76 PRO HD2 H 1 3.862 0.030 . 1 . . . . 76 PRO HD2 . 10113 1 871 . 1 1 76 76 PRO HD3 H 1 3.862 0.030 . 1 . . . . 76 PRO HD3 . 10113 1 872 . 1 1 76 76 PRO C C 13 178.117 0.300 . 1 . . . . 76 PRO C . 10113 1 873 . 1 1 76 76 PRO CA C 13 62.400 0.300 . 1 . . . . 76 PRO CA . 10113 1 874 . 1 1 76 76 PRO CB C 13 31.646 0.300 . 1 . . . . 76 PRO CB . 10113 1 875 . 1 1 76 76 PRO CG C 13 27.270 0.300 . 1 . . . . 76 PRO CG . 10113 1 876 . 1 1 76 76 PRO CD C 13 50.961 0.300 . 1 . . . . 76 PRO CD . 10113 1 877 . 1 1 77 77 LEU H H 1 8.336 0.030 . 1 . . . . 77 LEU H . 10113 1 878 . 1 1 77 77 LEU HA H 1 3.963 0.030 . 1 . . . . 77 LEU HA . 10113 1 879 . 1 1 77 77 LEU HB2 H 1 1.864 0.030 . 1 . . . . 77 LEU HB2 . 10113 1 880 . 1 1 77 77 LEU HB3 H 1 1.864 0.030 . 1 . . . . 77 LEU HB3 . 10113 1 881 . 1 1 77 77 LEU HG H 1 1.823 0.030 . 1 . . . . 77 LEU HG . 10113 1 882 . 1 1 77 77 LEU HD11 H 1 0.912 0.030 . 1 . . . . 77 LEU HD1 . 10113 1 883 . 1 1 77 77 LEU HD12 H 1 0.912 0.030 . 1 . . . . 77 LEU HD1 . 10113 1 884 . 1 1 77 77 LEU HD13 H 1 0.912 0.030 . 1 . . . . 77 LEU HD1 . 10113 1 885 . 1 1 77 77 LEU HD21 H 1 0.825 0.030 . 1 . . . . 77 LEU HD2 . 10113 1 886 . 1 1 77 77 LEU HD22 H 1 0.825 0.030 . 1 . . . . 77 LEU HD2 . 10113 1 887 . 1 1 77 77 LEU HD23 H 1 0.825 0.030 . 1 . . . . 77 LEU HD2 . 10113 1 888 . 1 1 77 77 LEU C C 13 179.047 0.300 . 1 . . . . 77 LEU C . 10113 1 889 . 1 1 77 77 LEU CA C 13 57.254 0.300 . 1 . . . . 77 LEU CA . 10113 1 890 . 1 1 77 77 LEU CB C 13 39.918 0.300 . 1 . . . . 77 LEU CB . 10113 1 891 . 1 1 77 77 LEU CG C 13 28.682 0.300 . 1 . . . . 77 LEU CG . 10113 1 892 . 1 1 77 77 LEU CD1 C 13 25.488 0.300 . 2 . . . . 77 LEU CD1 . 10113 1 893 . 1 1 77 77 LEU CD2 C 13 24.244 0.300 . 2 . . . . 77 LEU CD2 . 10113 1 894 . 1 1 77 77 LEU N N 15 126.027 0.300 . 1 . . . . 77 LEU N . 10113 1 895 . 1 1 78 78 SER H H 1 8.576 0.030 . 1 . . . . 78 SER H . 10113 1 896 . 1 1 78 78 SER HA H 1 4.277 0.030 . 1 . . . . 78 SER HA . 10113 1 897 . 1 1 78 78 SER HB2 H 1 4.053 0.030 . 1 . . . . 78 SER HB2 . 10113 1 898 . 1 1 78 78 SER HB3 H 1 4.053 0.030 . 1 . . . . 78 SER HB3 . 10113 1 899 . 1 1 78 78 SER C C 13 174.954 0.300 . 1 . . . . 78 SER C . 10113 1 900 . 1 1 78 78 SER CA C 13 60.180 0.300 . 1 . . . . 78 SER CA . 10113 1 901 . 1 1 78 78 SER CB C 13 62.378 0.300 . 1 . . . . 78 SER CB . 10113 1 902 . 1 1 78 78 SER N N 15 111.794 0.300 . 1 . . . . 78 SER N . 10113 1 903 . 1 1 79 79 ALA H H 1 7.943 0.030 . 1 . . . . 79 ALA H . 10113 1 904 . 1 1 79 79 ALA HA H 1 4.532 0.030 . 1 . . . . 79 ALA HA . 10113 1 905 . 1 1 79 79 ALA HB1 H 1 1.634 0.030 . 1 . . . . 79 ALA HB . 10113 1 906 . 1 1 79 79 ALA HB2 H 1 1.634 0.030 . 1 . . . . 79 ALA HB . 10113 1 907 . 1 1 79 79 ALA HB3 H 1 1.634 0.030 . 1 . . . . 79 ALA HB . 10113 1 908 . 1 1 79 79 ALA C C 13 176.864 0.300 . 1 . . . . 79 ALA C . 10113 1 909 . 1 1 79 79 ALA CA C 13 52.250 0.300 . 1 . . . . 79 ALA CA . 10113 1 910 . 1 1 79 79 ALA CB C 13 19.787 0.300 . 1 . . . . 79 ALA CB . 10113 1 911 . 1 1 79 79 ALA N N 15 123.132 0.300 . 1 . . . . 79 ALA N . 10113 1 912 . 1 1 80 80 ILE H H 1 7.577 0.030 . 1 . . . . 80 ILE H . 10113 1 913 . 1 1 80 80 ILE HA H 1 4.194 0.030 . 1 . . . . 80 ILE HA . 10113 1 914 . 1 1 80 80 ILE HB H 1 2.160 0.030 . 1 . . . . 80 ILE HB . 10113 1 915 . 1 1 80 80 ILE HG12 H 1 1.738 0.030 . 2 . . . . 80 ILE HG12 . 10113 1 916 . 1 1 80 80 ILE HG13 H 1 1.067 0.030 . 2 . . . . 80 ILE HG13 . 10113 1 917 . 1 1 80 80 ILE HG21 H 1 0.820 0.030 . 1 . . . . 80 ILE HG2 . 10113 1 918 . 1 1 80 80 ILE HG22 H 1 0.820 0.030 . 1 . . . . 80 ILE HG2 . 10113 1 919 . 1 1 80 80 ILE HG23 H 1 0.820 0.030 . 1 . . . . 80 ILE HG2 . 10113 1 920 . 1 1 80 80 ILE HD11 H 1 0.863 0.030 . 1 . . . . 80 ILE HD1 . 10113 1 921 . 1 1 80 80 ILE HD12 H 1 0.863 0.030 . 1 . . . . 80 ILE HD1 . 10113 1 922 . 1 1 80 80 ILE HD13 H 1 0.863 0.030 . 1 . . . . 80 ILE HD1 . 10113 1 923 . 1 1 80 80 ILE C C 13 175.747 0.300 . 1 . . . . 80 ILE C . 10113 1 924 . 1 1 80 80 ILE CA C 13 61.866 0.300 . 1 . . . . 80 ILE CA . 10113 1 925 . 1 1 80 80 ILE CB C 13 37.011 0.300 . 1 . . . . 80 ILE CB . 10113 1 926 . 1 1 80 80 ILE CG1 C 13 28.329 0.300 . 1 . . . . 80 ILE CG1 . 10113 1 927 . 1 1 80 80 ILE CG2 C 13 17.801 0.300 . 1 . . . . 80 ILE CG2 . 10113 1 928 . 1 1 80 80 ILE CD1 C 13 13.882 0.300 . 1 . . . . 80 ILE CD1 . 10113 1 929 . 1 1 80 80 ILE N N 15 118.510 0.300 . 1 . . . . 80 ILE N . 10113 1 930 . 1 1 81 81 ILE H H 1 8.858 0.030 . 1 . . . . 81 ILE H . 10113 1 931 . 1 1 81 81 ILE HA H 1 4.437 0.030 . 1 . . . . 81 ILE HA . 10113 1 932 . 1 1 81 81 ILE HB H 1 1.916 0.030 . 1 . . . . 81 ILE HB . 10113 1 933 . 1 1 81 81 ILE HG12 H 1 0.974 0.030 . 2 . . . . 81 ILE HG12 . 10113 1 934 . 1 1 81 81 ILE HG13 H 1 1.285 0.030 . 2 . . . . 81 ILE HG13 . 10113 1 935 . 1 1 81 81 ILE HG21 H 1 0.953 0.030 . 1 . . . . 81 ILE HG2 . 10113 1 936 . 1 1 81 81 ILE HG22 H 1 0.953 0.030 . 1 . . . . 81 ILE HG2 . 10113 1 937 . 1 1 81 81 ILE HG23 H 1 0.953 0.030 . 1 . . . . 81 ILE HG2 . 10113 1 938 . 1 1 81 81 ILE HD11 H 1 0.845 0.030 . 1 . . . . 81 ILE HD1 . 10113 1 939 . 1 1 81 81 ILE HD12 H 1 0.845 0.030 . 1 . . . . 81 ILE HD1 . 10113 1 940 . 1 1 81 81 ILE HD13 H 1 0.845 0.030 . 1 . . . . 81 ILE HD1 . 10113 1 941 . 1 1 81 81 ILE C C 13 176.492 0.300 . 1 . . . . 81 ILE C . 10113 1 942 . 1 1 81 81 ILE CA C 13 61.238 0.300 . 1 . . . . 81 ILE CA . 10113 1 943 . 1 1 81 81 ILE CB C 13 39.055 0.300 . 1 . . . . 81 ILE CB . 10113 1 944 . 1 1 81 81 ILE CG1 C 13 26.850 0.300 . 1 . . . . 81 ILE CG1 . 10113 1 945 . 1 1 81 81 ILE CG2 C 13 17.946 0.300 . 1 . . . . 81 ILE CG2 . 10113 1 946 . 1 1 81 81 ILE CD1 C 13 13.391 0.300 . 1 . . . . 81 ILE CD1 . 10113 1 947 . 1 1 81 81 ILE N N 15 123.713 0.300 . 1 . . . . 81 ILE N . 10113 1 948 . 1 1 82 82 GLU H H 1 7.632 0.030 . 1 . . . . 82 GLU H . 10113 1 949 . 1 1 82 82 GLU HA H 1 4.578 0.030 . 1 . . . . 82 GLU HA . 10113 1 950 . 1 1 82 82 GLU HB2 H 1 2.018 0.030 . 1 . . . . 82 GLU HB2 . 10113 1 951 . 1 1 82 82 GLU HB3 H 1 2.018 0.030 . 1 . . . . 82 GLU HB3 . 10113 1 952 . 1 1 82 82 GLU HG2 H 1 2.257 0.030 . 2 . . . . 82 GLU HG2 . 10113 1 953 . 1 1 82 82 GLU HG3 H 1 2.060 0.030 . 2 . . . . 82 GLU HG3 . 10113 1 954 . 1 1 82 82 GLU C C 13 173.381 0.300 . 1 . . . . 82 GLU C . 10113 1 955 . 1 1 82 82 GLU CA C 13 56.603 0.300 . 1 . . . . 82 GLU CA . 10113 1 956 . 1 1 82 82 GLU CB C 13 34.084 0.300 . 1 . . . . 82 GLU CB . 10113 1 957 . 1 1 82 82 GLU CG C 13 36.739 0.300 . 1 . . . . 82 GLU CG . 10113 1 958 . 1 1 82 82 GLU N N 15 119.612 0.300 . 1 . . . . 82 GLU N . 10113 1 959 . 1 1 83 83 VAL H H 1 8.671 0.030 . 1 . . . . 83 VAL H . 10113 1 960 . 1 1 83 83 VAL HA H 1 5.090 0.030 . 1 . . . . 83 VAL HA . 10113 1 961 . 1 1 83 83 VAL HB H 1 2.142 0.030 . 1 . . . . 83 VAL HB . 10113 1 962 . 1 1 83 83 VAL HG11 H 1 0.963 0.030 . 1 . . . . 83 VAL HG1 . 10113 1 963 . 1 1 83 83 VAL HG12 H 1 0.963 0.030 . 1 . . . . 83 VAL HG1 . 10113 1 964 . 1 1 83 83 VAL HG13 H 1 0.963 0.030 . 1 . . . . 83 VAL HG1 . 10113 1 965 . 1 1 83 83 VAL HG21 H 1 0.963 0.030 . 1 . . . . 83 VAL HG2 . 10113 1 966 . 1 1 83 83 VAL HG22 H 1 0.963 0.030 . 1 . . . . 83 VAL HG2 . 10113 1 967 . 1 1 83 83 VAL HG23 H 1 0.963 0.030 . 1 . . . . 83 VAL HG2 . 10113 1 968 . 1 1 83 83 VAL C C 13 174.786 0.300 . 1 . . . . 83 VAL C . 10113 1 969 . 1 1 83 83 VAL CA C 13 60.635 0.300 . 1 . . . . 83 VAL CA . 10113 1 970 . 1 1 83 83 VAL CB C 13 32.927 0.300 . 1 . . . . 83 VAL CB . 10113 1 971 . 1 1 83 83 VAL CG1 C 13 21.561 0.300 . 2 . . . . 83 VAL CG1 . 10113 1 972 . 1 1 83 83 VAL CG2 C 13 21.075 0.300 . 2 . . . . 83 VAL CG2 . 10113 1 973 . 1 1 83 83 VAL N N 15 124.992 0.300 . 1 . . . . 83 VAL N . 10113 1 974 . 1 1 84 84 ARG H H 1 9.293 0.030 . 1 . . . . 84 ARG H . 10113 1 975 . 1 1 84 84 ARG HA H 1 4.973 0.030 . 1 . . . . 84 ARG HA . 10113 1 976 . 1 1 84 84 ARG HB2 H 1 1.779 0.030 . 2 . . . . 84 ARG HB2 . 10113 1 977 . 1 1 84 84 ARG HB3 H 1 2.023 0.030 . 2 . . . . 84 ARG HB3 . 10113 1 978 . 1 1 84 84 ARG HG2 H 1 1.593 0.030 . 2 . . . . 84 ARG HG2 . 10113 1 979 . 1 1 84 84 ARG HG3 H 1 1.494 0.030 . 2 . . . . 84 ARG HG3 . 10113 1 980 . 1 1 84 84 ARG HD2 H 1 3.313 0.030 . 2 . . . . 84 ARG HD2 . 10113 1 981 . 1 1 84 84 ARG HD3 H 1 3.113 0.030 . 2 . . . . 84 ARG HD3 . 10113 1 982 . 1 1 84 84 ARG C C 13 176.006 0.300 . 1 . . . . 84 ARG C . 10113 1 983 . 1 1 84 84 ARG CA C 13 55.117 0.300 . 1 . . . . 84 ARG CA . 10113 1 984 . 1 1 84 84 ARG CB C 13 32.922 0.300 . 1 . . . . 84 ARG CB . 10113 1 985 . 1 1 84 84 ARG CG C 13 27.062 0.300 . 1 . . . . 84 ARG CG . 10113 1 986 . 1 1 84 84 ARG N N 15 124.626 0.300 . 1 . . . . 84 ARG N . 10113 1 987 . 1 1 85 85 THR HA H 1 4.539 0.030 . 1 . . . . 85 THR HA . 10113 1 988 . 1 1 85 85 THR HB H 1 4.400 0.030 . 1 . . . . 85 THR HB . 10113 1 989 . 1 1 85 85 THR HG21 H 1 1.276 0.030 . 1 . . . . 85 THR HG2 . 10113 1 990 . 1 1 85 85 THR HG22 H 1 1.276 0.030 . 1 . . . . 85 THR HG2 . 10113 1 991 . 1 1 85 85 THR HG23 H 1 1.276 0.030 . 1 . . . . 85 THR HG2 . 10113 1 992 . 1 1 85 85 THR CA C 13 62.324 0.300 . 1 . . . . 85 THR CA . 10113 1 993 . 1 1 85 85 THR CB C 13 69.353 0.300 . 1 . . . . 85 THR CB . 10113 1 994 . 1 1 85 85 THR CG2 C 13 22.048 0.300 . 1 . . . . 85 THR CG2 . 10113 1 995 . 1 1 86 86 THR H H 1 7.775 0.030 . 1 . . . . 86 THR H . 10113 1 996 . 1 1 86 86 THR HA H 1 4.514 0.030 . 1 . . . . 86 THR HA . 10113 1 997 . 1 1 86 86 THR HB H 1 4.177 0.030 . 1 . . . . 86 THR HB . 10113 1 998 . 1 1 86 86 THR HG21 H 1 1.172 0.030 . 1 . . . . 86 THR HG2 . 10113 1 999 . 1 1 86 86 THR HG22 H 1 1.172 0.030 . 1 . . . . 86 THR HG2 . 10113 1 1000 . 1 1 86 86 THR HG23 H 1 1.172 0.030 . 1 . . . . 86 THR HG2 . 10113 1 1001 . 1 1 86 86 THR CA C 13 61.304 0.300 . 1 . . . . 86 THR CA . 10113 1 1002 . 1 1 86 86 THR CB C 13 69.930 0.300 . 1 . . . . 86 THR CB . 10113 1 1003 . 1 1 86 86 THR CG2 C 13 21.804 0.300 . 1 . . . . 86 THR CG2 . 10113 1 1004 . 1 1 86 86 THR N N 15 116.721 0.300 . 1 . . . . 86 THR N . 10113 1 1005 . 1 1 87 87 MET H H 1 8.713 0.030 . 1 . . . . 87 MET H . 10113 1 1006 . 1 1 87 87 MET HA H 1 4.911 0.030 . 1 . . . . 87 MET HA . 10113 1 1007 . 1 1 87 87 MET HB2 H 1 2.161 0.030 . 2 . . . . 87 MET HB2 . 10113 1 1008 . 1 1 87 87 MET HB3 H 1 1.963 0.030 . 2 . . . . 87 MET HB3 . 10113 1 1009 . 1 1 87 87 MET HG2 H 1 2.545 0.030 . 2 . . . . 87 MET HG2 . 10113 1 1010 . 1 1 87 87 MET HG3 H 1 2.783 0.030 . 2 . . . . 87 MET HG3 . 10113 1 1011 . 1 1 87 87 MET HE1 H 1 2.070 0.030 . 1 . . . . 87 MET HE . 10113 1 1012 . 1 1 87 87 MET HE2 H 1 2.070 0.030 . 1 . . . . 87 MET HE . 10113 1 1013 . 1 1 87 87 MET HE3 H 1 2.070 0.030 . 1 . . . . 87 MET HE . 10113 1 1014 . 1 1 87 87 MET CA C 13 52.918 0.300 . 1 . . . . 87 MET CA . 10113 1 1015 . 1 1 87 87 MET CB C 13 32.502 0.300 . 1 . . . . 87 MET CB . 10113 1 1016 . 1 1 87 87 MET CG C 13 32.482 0.300 . 1 . . . . 87 MET CG . 10113 1 1017 . 1 1 87 87 MET CE C 13 17.725 0.300 . 1 . . . . 87 MET CE . 10113 1 1018 . 1 1 87 87 MET N N 15 124.467 0.300 . 1 . . . . 87 MET N . 10113 1 1019 . 1 1 88 88 PRO HA H 1 4.420 0.030 . 1 . . . . 88 PRO HA . 10113 1 1020 . 1 1 88 88 PRO HB2 H 1 2.418 0.030 . 2 . . . . 88 PRO HB2 . 10113 1 1021 . 1 1 88 88 PRO HB3 H 1 1.907 0.030 . 2 . . . . 88 PRO HB3 . 10113 1 1022 . 1 1 88 88 PRO HG2 H 1 2.100 0.030 . 1 . . . . 88 PRO HG2 . 10113 1 1023 . 1 1 88 88 PRO HG3 H 1 2.100 0.030 . 1 . . . . 88 PRO HG3 . 10113 1 1024 . 1 1 88 88 PRO HD2 H 1 3.743 0.030 . 2 . . . . 88 PRO HD2 . 10113 1 1025 . 1 1 88 88 PRO HD3 H 1 3.983 0.030 . 2 . . . . 88 PRO HD3 . 10113 1 1026 . 1 1 88 88 PRO C C 13 176.923 0.300 . 1 . . . . 88 PRO C . 10113 1 1027 . 1 1 88 88 PRO CA C 13 63.949 0.300 . 1 . . . . 88 PRO CA . 10113 1 1028 . 1 1 88 88 PRO CB C 13 32.187 0.300 . 1 . . . . 88 PRO CB . 10113 1 1029 . 1 1 88 88 PRO CG C 13 27.645 0.300 . 1 . . . . 88 PRO CG . 10113 1 1030 . 1 1 88 88 PRO CD C 13 50.792 0.300 . 1 . . . . 88 PRO CD . 10113 1 1031 . 1 1 89 89 LEU H H 1 8.257 0.030 . 1 . . . . 89 LEU H . 10113 1 1032 . 1 1 89 89 LEU HA H 1 4.173 0.030 . 1 . . . . 89 LEU HA . 10113 1 1033 . 1 1 89 89 LEU HB2 H 1 1.596 0.030 . 2 . . . . 89 LEU HB2 . 10113 1 1034 . 1 1 89 89 LEU HB3 H 1 1.724 0.030 . 2 . . . . 89 LEU HB3 . 10113 1 1035 . 1 1 89 89 LEU HD11 H 1 0.924 0.030 . 1 . . . . 89 LEU HD1 . 10113 1 1036 . 1 1 89 89 LEU HD12 H 1 0.924 0.030 . 1 . . . . 89 LEU HD1 . 10113 1 1037 . 1 1 89 89 LEU HD13 H 1 0.924 0.030 . 1 . . . . 89 LEU HD1 . 10113 1 1038 . 1 1 89 89 LEU HD21 H 1 0.902 0.030 . 1 . . . . 89 LEU HD2 . 10113 1 1039 . 1 1 89 89 LEU HD22 H 1 0.902 0.030 . 1 . . . . 89 LEU HD2 . 10113 1 1040 . 1 1 89 89 LEU HD23 H 1 0.902 0.030 . 1 . . . . 89 LEU HD2 . 10113 1 1041 . 1 1 89 89 LEU C C 13 177.806 0.300 . 1 . . . . 89 LEU C . 10113 1 1042 . 1 1 89 89 LEU CA C 13 56.349 0.300 . 1 . . . . 89 LEU CA . 10113 1 1043 . 1 1 89 89 LEU CB C 13 42.021 0.300 . 1 . . . . 89 LEU CB . 10113 1 1044 . 1 1 89 89 LEU CD1 C 13 24.963 0.300 . 2 . . . . 89 LEU CD1 . 10113 1 1045 . 1 1 89 89 LEU CD2 C 13 23.505 0.300 . 2 . . . . 89 LEU CD2 . 10113 1 1046 . 1 1 89 89 LEU N N 15 119.393 0.300 . 1 . . . . 89 LEU N . 10113 1 1047 . 1 1 90 90 GLU H H 1 8.253 0.030 . 1 . . . . 90 GLU H . 10113 1 1048 . 1 1 90 90 GLU HA H 1 4.243 0.030 . 1 . . . . 90 GLU HA . 10113 1 1049 . 1 1 90 90 GLU HB2 H 1 2.063 0.030 . 1 . . . . 90 GLU HB2 . 10113 1 1050 . 1 1 90 90 GLU HB3 H 1 2.063 0.030 . 1 . . . . 90 GLU HB3 . 10113 1 1051 . 1 1 90 90 GLU HG2 H 1 2.253 0.030 . 1 . . . . 90 GLU HG2 . 10113 1 1052 . 1 1 90 90 GLU HG3 H 1 2.253 0.030 . 1 . . . . 90 GLU HG3 . 10113 1 1053 . 1 1 90 90 GLU C C 13 176.183 0.300 . 1 . . . . 90 GLU C . 10113 1 1054 . 1 1 90 90 GLU CA C 13 56.732 0.300 . 1 . . . . 90 GLU CA . 10113 1 1055 . 1 1 90 90 GLU CB C 13 30.177 0.300 . 1 . . . . 90 GLU CB . 10113 1 1056 . 1 1 90 90 GLU CG C 13 36.432 0.300 . 1 . . . . 90 GLU CG . 10113 1 1057 . 1 1 90 90 GLU N N 15 117.364 0.300 . 1 . . . . 90 GLU N . 10113 1 1058 . 1 1 91 91 MET H H 1 8.008 0.030 . 1 . . . . 91 MET H . 10113 1 1059 . 1 1 91 91 MET HA H 1 4.207 0.030 . 1 . . . . 91 MET HA . 10113 1 1060 . 1 1 91 91 MET HB2 H 1 2.211 0.030 . 2 . . . . 91 MET HB2 . 10113 1 1061 . 1 1 91 91 MET HB3 H 1 2.274 0.030 . 2 . . . . 91 MET HB3 . 10113 1 1062 . 1 1 91 91 MET HG2 H 1 2.573 0.030 . 1 . . . . 91 MET HG2 . 10113 1 1063 . 1 1 91 91 MET HG3 H 1 2.573 0.030 . 1 . . . . 91 MET HG3 . 10113 1 1064 . 1 1 91 91 MET HE1 H 1 2.142 0.030 . 1 . . . . 91 MET HE . 10113 1 1065 . 1 1 91 91 MET HE2 H 1 2.142 0.030 . 1 . . . . 91 MET HE . 10113 1 1066 . 1 1 91 91 MET HE3 H 1 2.142 0.030 . 1 . . . . 91 MET HE . 10113 1 1067 . 1 1 91 91 MET C C 13 173.902 0.300 . 1 . . . . 91 MET C . 10113 1 1068 . 1 1 91 91 MET CA C 13 52.649 0.300 . 1 . . . . 91 MET CA . 10113 1 1069 . 1 1 91 91 MET CB C 13 36.142 0.300 . 1 . . . . 91 MET CB . 10113 1 1070 . 1 1 91 91 MET CG C 13 32.512 0.300 . 1 . . . . 91 MET CG . 10113 1 1071 . 1 1 91 91 MET CE C 13 17.624 0.300 . 1 . . . . 91 MET CE . 10113 1 1072 . 1 1 91 91 MET N N 15 119.384 0.300 . 1 . . . . 91 MET N . 10113 1 1073 . 1 1 92 92 PRO HA H 1 4.353 0.030 . 1 . . . . 92 PRO HA . 10113 1 1074 . 1 1 92 92 PRO HB2 H 1 2.379 0.030 . 2 . . . . 92 PRO HB2 . 10113 1 1075 . 1 1 92 92 PRO HB3 H 1 1.957 0.030 . 2 . . . . 92 PRO HB3 . 10113 1 1076 . 1 1 92 92 PRO HG2 H 1 2.093 0.030 . 1 . . . . 92 PRO HG2 . 10113 1 1077 . 1 1 92 92 PRO HG3 H 1 2.093 0.030 . 1 . . . . 92 PRO HG3 . 10113 1 1078 . 1 1 92 92 PRO HD2 H 1 3.751 0.030 . 1 . . . . 92 PRO HD2 . 10113 1 1079 . 1 1 92 92 PRO HD3 H 1 3.751 0.030 . 1 . . . . 92 PRO HD3 . 10113 1 1080 . 1 1 92 92 PRO C C 13 177.806 0.300 . 1 . . . . 92 PRO C . 10113 1 1081 . 1 1 92 92 PRO CA C 13 64.477 0.300 . 1 . . . . 92 PRO CA . 10113 1 1082 . 1 1 92 92 PRO CB C 13 31.946 0.300 . 1 . . . . 92 PRO CB . 10113 1 1083 . 1 1 92 92 PRO CG C 13 27.678 0.300 . 1 . . . . 92 PRO CG . 10113 1 1084 . 1 1 92 92 PRO CD C 13 50.757 0.300 . 1 . . . . 92 PRO CD . 10113 1 1085 . 1 1 93 93 GLU H H 1 8.994 0.030 . 1 . . . . 93 GLU H . 10113 1 1086 . 1 1 93 93 GLU HA H 1 4.235 0.030 . 1 . . . . 93 GLU HA . 10113 1 1087 . 1 1 93 93 GLU HB2 H 1 2.138 0.030 . 2 . . . . 93 GLU HB2 . 10113 1 1088 . 1 1 93 93 GLU HB3 H 1 2.042 0.030 . 2 . . . . 93 GLU HB3 . 10113 1 1089 . 1 1 93 93 GLU HG2 H 1 2.268 0.030 . 1 . . . . 93 GLU HG2 . 10113 1 1090 . 1 1 93 93 GLU HG3 H 1 2.268 0.030 . 1 . . . . 93 GLU HG3 . 10113 1 1091 . 1 1 93 93 GLU C C 13 177.116 0.300 . 1 . . . . 93 GLU C . 10113 1 1092 . 1 1 93 93 GLU CA C 13 57.347 0.300 . 1 . . . . 93 GLU CA . 10113 1 1093 . 1 1 93 93 GLU CB C 13 28.586 0.300 . 1 . . . . 93 GLU CB . 10113 1 1094 . 1 1 93 93 GLU CG C 13 36.245 0.300 . 1 . . . . 93 GLU CG . 10113 1 1095 . 1 1 93 93 GLU N N 15 118.035 0.300 . 1 . . . . 93 GLU N . 10113 1 1096 . 1 1 94 94 LYS H H 1 7.892 0.030 . 1 . . . . 94 LYS H . 10113 1 1097 . 1 1 94 94 LYS HA H 1 4.316 0.030 . 1 . . . . 94 LYS HA . 10113 1 1098 . 1 1 94 94 LYS HB2 H 1 1.805 0.030 . 2 . . . . 94 LYS HB2 . 10113 1 1099 . 1 1 94 94 LYS HB3 H 1 1.923 0.030 . 2 . . . . 94 LYS HB3 . 10113 1 1100 . 1 1 94 94 LYS HG2 H 1 1.422 0.030 . 2 . . . . 94 LYS HG2 . 10113 1 1101 . 1 1 94 94 LYS HG3 H 1 1.493 0.030 . 2 . . . . 94 LYS HG3 . 10113 1 1102 . 1 1 94 94 LYS HD2 H 1 1.728 0.030 . 1 . . . . 94 LYS HD2 . 10113 1 1103 . 1 1 94 94 LYS HD3 H 1 1.728 0.030 . 1 . . . . 94 LYS HD3 . 10113 1 1104 . 1 1 94 94 LYS HE2 H 1 3.003 0.030 . 1 . . . . 94 LYS HE2 . 10113 1 1105 . 1 1 94 94 LYS HE3 H 1 3.003 0.030 . 1 . . . . 94 LYS HE3 . 10113 1 1106 . 1 1 94 94 LYS C C 13 176.877 0.300 . 1 . . . . 94 LYS C . 10113 1 1107 . 1 1 94 94 LYS CA C 13 56.982 0.300 . 1 . . . . 94 LYS CA . 10113 1 1108 . 1 1 94 94 LYS CB C 13 33.382 0.300 . 1 . . . . 94 LYS CB . 10113 1 1109 . 1 1 94 94 LYS CG C 13 24.712 0.300 . 1 . . . . 94 LYS CG . 10113 1 1110 . 1 1 94 94 LYS CD C 13 29.002 0.300 . 1 . . . . 94 LYS CD . 10113 1 1111 . 1 1 94 94 LYS CE C 13 42.155 0.300 . 1 . . . . 94 LYS CE . 10113 1 1112 . 1 1 94 94 LYS N N 15 120.442 0.300 . 1 . . . . 94 LYS N . 10113 1 1113 . 1 1 95 95 ASP H H 1 8.464 0.030 . 1 . . . . 95 ASP H . 10113 1 1114 . 1 1 95 95 ASP HA H 1 4.403 0.030 . 1 . . . . 95 ASP HA . 10113 1 1115 . 1 1 95 95 ASP HB2 H 1 2.604 0.030 . 2 . . . . 95 ASP HB2 . 10113 1 1116 . 1 1 95 95 ASP HB3 H 1 2.855 0.030 . 2 . . . . 95 ASP HB3 . 10113 1 1117 . 1 1 95 95 ASP CA C 13 55.542 0.300 . 1 . . . . 95 ASP CA . 10113 1 1118 . 1 1 96 96 ASN H H 1 8.223 0.030 . 1 . . . . 96 ASN H . 10113 1 1119 . 1 1 96 96 ASN HA H 1 4.653 0.030 . 1 . . . . 96 ASN HA . 10113 1 1120 . 1 1 96 96 ASN HB2 H 1 3.054 0.030 . 2 . . . . 96 ASN HB2 . 10113 1 1121 . 1 1 96 96 ASN HB3 H 1 2.393 0.030 . 2 . . . . 96 ASN HB3 . 10113 1 1122 . 1 1 96 96 ASN HD21 H 1 6.543 0.030 . 2 . . . . 96 ASN HD21 . 10113 1 1123 . 1 1 96 96 ASN HD22 H 1 7.253 0.030 . 2 . . . . 96 ASN HD22 . 10113 1 1124 . 1 1 96 96 ASN C C 13 173.964 0.300 . 1 . . . . 96 ASN C . 10113 1 1125 . 1 1 96 96 ASN CA C 13 52.412 0.300 . 1 . . . . 96 ASN CA . 10113 1 1126 . 1 1 96 96 ASN CB C 13 37.631 0.300 . 1 . . . . 96 ASN CB . 10113 1 1127 . 1 1 96 96 ASN N N 15 115.166 0.300 . 1 . . . . 96 ASN N . 10113 1 1128 . 1 1 96 96 ASN ND2 N 15 110.384 0.300 . 1 . . . . 96 ASN ND2 . 10113 1 1129 . 1 1 97 97 THR H H 1 7.938 0.030 . 1 . . . . 97 THR H . 10113 1 1130 . 1 1 97 97 THR HA H 1 6.031 0.030 . 1 . . . . 97 THR HA . 10113 1 1131 . 1 1 97 97 THR HB H 1 4.016 0.030 . 1 . . . . 97 THR HB . 10113 1 1132 . 1 1 97 97 THR HG21 H 1 1.216 0.030 . 1 . . . . 97 THR HG2 . 10113 1 1133 . 1 1 97 97 THR HG22 H 1 1.216 0.030 . 1 . . . . 97 THR HG2 . 10113 1 1134 . 1 1 97 97 THR HG23 H 1 1.216 0.030 . 1 . . . . 97 THR HG2 . 10113 1 1135 . 1 1 97 97 THR C C 13 174.318 0.300 . 1 . . . . 97 THR C . 10113 1 1136 . 1 1 97 97 THR CA C 13 59.988 0.300 . 1 . . . . 97 THR CA . 10113 1 1137 . 1 1 97 97 THR CB C 13 72.332 0.300 . 1 . . . . 97 THR CB . 10113 1 1138 . 1 1 97 97 THR CG2 C 13 22.308 0.300 . 1 . . . . 97 THR CG2 . 10113 1 1139 . 1 1 97 97 THR N N 15 110.263 0.300 . 1 . . . . 97 THR N . 10113 1 1140 . 1 1 98 98 PHE H H 1 9.209 0.030 . 1 . . . . 98 PHE H . 10113 1 1141 . 1 1 98 98 PHE HA H 1 5.168 0.030 . 1 . . . . 98 PHE HA . 10113 1 1142 . 1 1 98 98 PHE HB2 H 1 3.083 0.030 . 2 . . . . 98 PHE HB2 . 10113 1 1143 . 1 1 98 98 PHE HB3 H 1 2.826 0.030 . 2 . . . . 98 PHE HB3 . 10113 1 1144 . 1 1 98 98 PHE HD1 H 1 6.903 0.030 . 1 . . . . 98 PHE HD1 . 10113 1 1145 . 1 1 98 98 PHE HD2 H 1 6.903 0.030 . 1 . . . . 98 PHE HD2 . 10113 1 1146 . 1 1 98 98 PHE HE1 H 1 6.790 0.030 . 1 . . . . 98 PHE HE1 . 10113 1 1147 . 1 1 98 98 PHE HE2 H 1 6.790 0.030 . 1 . . . . 98 PHE HE2 . 10113 1 1148 . 1 1 98 98 PHE HZ H 1 6.363 0.030 . 1 . . . . 98 PHE HZ . 10113 1 1149 . 1 1 98 98 PHE C C 13 171.171 0.300 . 1 . . . . 98 PHE C . 10113 1 1150 . 1 1 98 98 PHE CA C 13 56.064 0.300 . 1 . . . . 98 PHE CA . 10113 1 1151 . 1 1 98 98 PHE CB C 13 41.462 0.300 . 1 . . . . 98 PHE CB . 10113 1 1152 . 1 1 98 98 PHE CD1 C 13 132.559 0.300 . 1 . . . . 98 PHE CD1 . 10113 1 1153 . 1 1 98 98 PHE CD2 C 13 132.559 0.300 . 1 . . . . 98 PHE CD2 . 10113 1 1154 . 1 1 98 98 PHE CE1 C 13 130.198 0.300 . 1 . . . . 98 PHE CE1 . 10113 1 1155 . 1 1 98 98 PHE CE2 C 13 130.198 0.300 . 1 . . . . 98 PHE CE2 . 10113 1 1156 . 1 1 98 98 PHE CZ C 13 129.637 0.300 . 1 . . . . 98 PHE CZ . 10113 1 1157 . 1 1 98 98 PHE N N 15 118.727 0.300 . 1 . . . . 98 PHE N . 10113 1 1158 . 1 1 99 99 VAL H H 1 9.083 0.030 . 1 . . . . 99 VAL H . 10113 1 1159 . 1 1 99 99 VAL HA H 1 5.305 0.030 . 1 . . . . 99 VAL HA . 10113 1 1160 . 1 1 99 99 VAL HB H 1 1.846 0.030 . 1 . . . . 99 VAL HB . 10113 1 1161 . 1 1 99 99 VAL HG11 H 1 0.865 0.030 . 1 . . . . 99 VAL HG1 . 10113 1 1162 . 1 1 99 99 VAL HG12 H 1 0.865 0.030 . 1 . . . . 99 VAL HG1 . 10113 1 1163 . 1 1 99 99 VAL HG13 H 1 0.865 0.030 . 1 . . . . 99 VAL HG1 . 10113 1 1164 . 1 1 99 99 VAL HG21 H 1 0.953 0.030 . 1 . . . . 99 VAL HG2 . 10113 1 1165 . 1 1 99 99 VAL HG22 H 1 0.953 0.030 . 1 . . . . 99 VAL HG2 . 10113 1 1166 . 1 1 99 99 VAL HG23 H 1 0.953 0.030 . 1 . . . . 99 VAL HG2 . 10113 1 1167 . 1 1 99 99 VAL C C 13 174.869 0.300 . 1 . . . . 99 VAL C . 10113 1 1168 . 1 1 99 99 VAL CA C 13 60.101 0.300 . 1 . . . . 99 VAL CA . 10113 1 1169 . 1 1 99 99 VAL CB C 13 36.323 0.300 . 1 . . . . 99 VAL CB . 10113 1 1170 . 1 1 99 99 VAL CG1 C 13 20.842 0.300 . 2 . . . . 99 VAL CG1 . 10113 1 1171 . 1 1 99 99 VAL CG2 C 13 22.297 0.300 . 2 . . . . 99 VAL CG2 . 10113 1 1172 . 1 1 99 99 VAL N N 15 118.833 0.300 . 1 . . . . 99 VAL N . 10113 1 1173 . 1 1 100 100 LEU H H 1 9.111 0.030 . 1 . . . . 100 LEU H . 10113 1 1174 . 1 1 100 100 LEU HA H 1 5.280 0.030 . 1 . . . . 100 LEU HA . 10113 1 1175 . 1 1 100 100 LEU HB2 H 1 1.907 0.030 . 2 . . . . 100 LEU HB2 . 10113 1 1176 . 1 1 100 100 LEU HB3 H 1 1.433 0.030 . 2 . . . . 100 LEU HB3 . 10113 1 1177 . 1 1 100 100 LEU HG H 1 1.833 0.030 . 1 . . . . 100 LEU HG . 10113 1 1178 . 1 1 100 100 LEU HD11 H 1 0.884 0.030 . 1 . . . . 100 LEU HD1 . 10113 1 1179 . 1 1 100 100 LEU HD12 H 1 0.884 0.030 . 1 . . . . 100 LEU HD1 . 10113 1 1180 . 1 1 100 100 LEU HD13 H 1 0.884 0.030 . 1 . . . . 100 LEU HD1 . 10113 1 1181 . 1 1 100 100 LEU HD21 H 1 1.123 0.030 . 1 . . . . 100 LEU HD2 . 10113 1 1182 . 1 1 100 100 LEU HD22 H 1 1.123 0.030 . 1 . . . . 100 LEU HD2 . 10113 1 1183 . 1 1 100 100 LEU HD23 H 1 1.123 0.030 . 1 . . . . 100 LEU HD2 . 10113 1 1184 . 1 1 100 100 LEU C C 13 174.894 0.300 . 1 . . . . 100 LEU C . 10113 1 1185 . 1 1 100 100 LEU CA C 13 52.921 0.300 . 1 . . . . 100 LEU CA . 10113 1 1186 . 1 1 100 100 LEU CB C 13 44.952 0.300 . 1 . . . . 100 LEU CB . 10113 1 1187 . 1 1 100 100 LEU CG C 13 26.572 0.300 . 1 . . . . 100 LEU CG . 10113 1 1188 . 1 1 100 100 LEU CD1 C 13 26.664 0.300 . 2 . . . . 100 LEU CD1 . 10113 1 1189 . 1 1 100 100 LEU CD2 C 13 25.464 0.300 . 2 . . . . 100 LEU CD2 . 10113 1 1190 . 1 1 100 100 LEU N N 15 124.220 0.300 . 1 . . . . 100 LEU N . 10113 1 1191 . 1 1 101 101 LYS H H 1 8.894 0.030 . 1 . . . . 101 LYS H . 10113 1 1192 . 1 1 101 101 LYS HA H 1 5.253 0.030 . 1 . . . . 101 LYS HA . 10113 1 1193 . 1 1 101 101 LYS HB2 H 1 1.593 0.030 . 2 . . . . 101 LYS HB2 . 10113 1 1194 . 1 1 101 101 LYS HB3 H 1 2.019 0.030 . 2 . . . . 101 LYS HB3 . 10113 1 1195 . 1 1 101 101 LYS HG2 H 1 1.393 0.030 . 1 . . . . 101 LYS HG2 . 10113 1 1196 . 1 1 101 101 LYS HG3 H 1 1.393 0.030 . 1 . . . . 101 LYS HG3 . 10113 1 1197 . 1 1 101 101 LYS HD2 H 1 1.643 0.030 . 2 . . . . 101 LYS HD2 . 10113 1 1198 . 1 1 101 101 LYS HD3 H 1 1.663 0.030 . 2 . . . . 101 LYS HD3 . 10113 1 1199 . 1 1 101 101 LYS HE2 H 1 2.983 0.030 . 2 . . . . 101 LYS HE2 . 10113 1 1200 . 1 1 101 101 LYS HE3 H 1 2.918 0.030 . 2 . . . . 101 LYS HE3 . 10113 1 1201 . 1 1 101 101 LYS C C 13 175.735 0.300 . 1 . . . . 101 LYS C . 10113 1 1202 . 1 1 101 101 LYS CA C 13 55.175 0.300 . 1 . . . . 101 LYS CA . 10113 1 1203 . 1 1 101 101 LYS CB C 13 35.772 0.300 . 1 . . . . 101 LYS CB . 10113 1 1204 . 1 1 101 101 LYS CG C 13 25.220 0.300 . 1 . . . . 101 LYS CG . 10113 1 1205 . 1 1 101 101 LYS CD C 13 29.805 0.300 . 1 . . . . 101 LYS CD . 10113 1 1206 . 1 1 101 101 LYS CE C 13 42.142 0.300 . 1 . . . . 101 LYS CE . 10113 1 1207 . 1 1 101 101 LYS N N 15 124.902 0.300 . 1 . . . . 101 LYS N . 10113 1 1208 . 1 1 102 102 VAL H H 1 8.606 0.030 . 1 . . . . 102 VAL H . 10113 1 1209 . 1 1 102 102 VAL HA H 1 5.169 0.030 . 1 . . . . 102 VAL HA . 10113 1 1210 . 1 1 102 102 VAL HB H 1 2.445 0.030 . 1 . . . . 102 VAL HB . 10113 1 1211 . 1 1 102 102 VAL HG11 H 1 1.073 0.030 . 1 . . . . 102 VAL HG1 . 10113 1 1212 . 1 1 102 102 VAL HG12 H 1 1.073 0.030 . 1 . . . . 102 VAL HG1 . 10113 1 1213 . 1 1 102 102 VAL HG13 H 1 1.073 0.030 . 1 . . . . 102 VAL HG1 . 10113 1 1214 . 1 1 102 102 VAL HG21 H 1 1.113 0.030 . 1 . . . . 102 VAL HG2 . 10113 1 1215 . 1 1 102 102 VAL HG22 H 1 1.113 0.030 . 1 . . . . 102 VAL HG2 . 10113 1 1216 . 1 1 102 102 VAL HG23 H 1 1.113 0.030 . 1 . . . . 102 VAL HG2 . 10113 1 1217 . 1 1 102 102 VAL C C 13 177.621 0.300 . 1 . . . . 102 VAL C . 10113 1 1218 . 1 1 102 102 VAL CA C 13 60.491 0.300 . 1 . . . . 102 VAL CA . 10113 1 1219 . 1 1 102 102 VAL CB C 13 33.919 0.300 . 1 . . . . 102 VAL CB . 10113 1 1220 . 1 1 102 102 VAL CG1 C 13 22.500 0.300 . 2 . . . . 102 VAL CG1 . 10113 1 1221 . 1 1 102 102 VAL CG2 C 13 21.578 0.300 . 2 . . . . 102 VAL CG2 . 10113 1 1222 . 1 1 102 102 VAL N N 15 123.059 0.300 . 1 . . . . 102 VAL N . 10113 1 1223 . 1 1 103 103 GLU H H 1 8.946 0.030 . 1 . . . . 103 GLU H . 10113 1 1224 . 1 1 103 103 GLU HA H 1 4.041 0.030 . 1 . . . . 103 GLU HA . 10113 1 1225 . 1 1 103 103 GLU HB2 H 1 2.195 0.030 . 2 . . . . 103 GLU HB2 . 10113 1 1226 . 1 1 103 103 GLU HB3 H 1 2.138 0.030 . 2 . . . . 103 GLU HB3 . 10113 1 1227 . 1 1 103 103 GLU HG2 H 1 2.349 0.030 . 1 . . . . 103 GLU HG2 . 10113 1 1228 . 1 1 103 103 GLU HG3 H 1 2.349 0.030 . 1 . . . . 103 GLU HG3 . 10113 1 1229 . 1 1 103 103 GLU C C 13 176.446 0.300 . 1 . . . . 103 GLU C . 10113 1 1230 . 1 1 103 103 GLU CA C 13 59.178 0.300 . 1 . . . . 103 GLU CA . 10113 1 1231 . 1 1 103 103 GLU CB C 13 29.703 0.300 . 1 . . . . 103 GLU CB . 10113 1 1232 . 1 1 103 103 GLU CG C 13 35.489 0.300 . 1 . . . . 103 GLU CG . 10113 1 1233 . 1 1 103 103 GLU N N 15 124.017 0.300 . 1 . . . . 103 GLU N . 10113 1 1234 . 1 1 104 104 ASN H H 1 8.263 0.030 . 1 . . . . 104 ASN H . 10113 1 1235 . 1 1 104 104 ASN HA H 1 4.589 0.030 . 1 . . . . 104 ASN HA . 10113 1 1236 . 1 1 104 104 ASN HB2 H 1 3.184 0.030 . 2 . . . . 104 ASN HB2 . 10113 1 1237 . 1 1 104 104 ASN HB3 H 1 2.958 0.030 . 2 . . . . 104 ASN HB3 . 10113 1 1238 . 1 1 104 104 ASN HD21 H 1 7.568 0.030 . 2 . . . . 104 ASN HD21 . 10113 1 1239 . 1 1 104 104 ASN HD22 H 1 6.825 0.030 . 2 . . . . 104 ASN HD22 . 10113 1 1240 . 1 1 104 104 ASN C C 13 176.047 0.300 . 1 . . . . 104 ASN C . 10113 1 1241 . 1 1 104 104 ASN CA C 13 53.766 0.300 . 1 . . . . 104 ASN CA . 10113 1 1242 . 1 1 104 104 ASN CB C 13 37.482 0.300 . 1 . . . . 104 ASN CB . 10113 1 1243 . 1 1 104 104 ASN N N 15 116.934 0.300 . 1 . . . . 104 ASN N . 10113 1 1244 . 1 1 104 104 ASN ND2 N 15 111.279 0.300 . 1 . . . . 104 ASN ND2 . 10113 1 1245 . 1 1 105 105 GLY H H 1 8.377 0.030 . 1 . . . . 105 GLY H . 10113 1 1246 . 1 1 105 105 GLY HA2 H 1 4.281 0.030 . 2 . . . . 105 GLY HA2 . 10113 1 1247 . 1 1 105 105 GLY HA3 H 1 3.746 0.030 . 2 . . . . 105 GLY HA3 . 10113 1 1248 . 1 1 105 105 GLY C C 13 173.970 0.300 . 1 . . . . 105 GLY C . 10113 1 1249 . 1 1 105 105 GLY CA C 13 45.223 0.300 . 1 . . . . 105 GLY CA . 10113 1 1250 . 1 1 105 105 GLY N N 15 108.357 0.300 . 1 . . . . 105 GLY N . 10113 1 1251 . 1 1 106 106 ALA H H 1 7.695 0.030 . 1 . . . . 106 ALA H . 10113 1 1252 . 1 1 106 106 ALA HA H 1 4.226 0.030 . 1 . . . . 106 ALA HA . 10113 1 1253 . 1 1 106 106 ALA HB1 H 1 1.164 0.030 . 1 . . . . 106 ALA HB . 10113 1 1254 . 1 1 106 106 ALA HB2 H 1 1.164 0.030 . 1 . . . . 106 ALA HB . 10113 1 1255 . 1 1 106 106 ALA HB3 H 1 1.164 0.030 . 1 . . . . 106 ALA HB . 10113 1 1256 . 1 1 106 106 ALA C C 13 175.471 0.300 . 1 . . . . 106 ALA C . 10113 1 1257 . 1 1 106 106 ALA CA C 13 52.650 0.300 . 1 . . . . 106 ALA CA . 10113 1 1258 . 1 1 106 106 ALA CB C 13 19.441 0.300 . 1 . . . . 106 ALA CB . 10113 1 1259 . 1 1 106 106 ALA N N 15 124.229 0.300 . 1 . . . . 106 ALA N . 10113 1 1260 . 1 1 107 107 GLU H H 1 7.893 0.030 . 1 . . . . 107 GLU H . 10113 1 1261 . 1 1 107 107 GLU HA H 1 5.146 0.030 . 1 . . . . 107 GLU HA . 10113 1 1262 . 1 1 107 107 GLU HB2 H 1 1.723 0.030 . 2 . . . . 107 GLU HB2 . 10113 1 1263 . 1 1 107 107 GLU HB3 H 1 1.807 0.030 . 2 . . . . 107 GLU HB3 . 10113 1 1264 . 1 1 107 107 GLU HG2 H 1 1.901 0.030 . 2 . . . . 107 GLU HG2 . 10113 1 1265 . 1 1 107 107 GLU HG3 H 1 2.305 0.030 . 2 . . . . 107 GLU HG3 . 10113 1 1266 . 1 1 107 107 GLU C C 13 174.606 0.300 . 1 . . . . 107 GLU C . 10113 1 1267 . 1 1 107 107 GLU CA C 13 54.818 0.300 . 1 . . . . 107 GLU CA . 10113 1 1268 . 1 1 107 107 GLU CB C 13 32.569 0.300 . 1 . . . . 107 GLU CB . 10113 1 1269 . 1 1 107 107 GLU CG C 13 37.397 0.300 . 1 . . . . 107 GLU CG . 10113 1 1270 . 1 1 107 107 GLU N N 15 118.077 0.300 . 1 . . . . 107 GLU N . 10113 1 1271 . 1 1 108 108 TYR H H 1 9.072 0.030 . 1 . . . . 108 TYR H . 10113 1 1272 . 1 1 108 108 TYR HA H 1 4.857 0.030 . 1 . . . . 108 TYR HA . 10113 1 1273 . 1 1 108 108 TYR HB2 H 1 2.853 0.030 . 2 . . . . 108 TYR HB2 . 10113 1 1274 . 1 1 108 108 TYR HB3 H 1 2.648 0.030 . 2 . . . . 108 TYR HB3 . 10113 1 1275 . 1 1 108 108 TYR HD1 H 1 6.763 0.030 . 1 . . . . 108 TYR HD1 . 10113 1 1276 . 1 1 108 108 TYR HD2 H 1 6.763 0.030 . 1 . . . . 108 TYR HD2 . 10113 1 1277 . 1 1 108 108 TYR HE1 H 1 6.350 0.030 . 1 . . . . 108 TYR HE1 . 10113 1 1278 . 1 1 108 108 TYR HE2 H 1 6.350 0.030 . 1 . . . . 108 TYR HE2 . 10113 1 1279 . 1 1 108 108 TYR C C 13 174.041 0.300 . 1 . . . . 108 TYR C . 10113 1 1280 . 1 1 108 108 TYR CA C 13 56.967 0.300 . 1 . . . . 108 TYR CA . 10113 1 1281 . 1 1 108 108 TYR CB C 13 41.004 0.300 . 1 . . . . 108 TYR CB . 10113 1 1282 . 1 1 108 108 TYR CD1 C 13 132.350 0.300 . 1 . . . . 108 TYR CD1 . 10113 1 1283 . 1 1 108 108 TYR CD2 C 13 132.350 0.300 . 1 . . . . 108 TYR CD2 . 10113 1 1284 . 1 1 108 108 TYR CE1 C 13 117.734 0.300 . 1 . . . . 108 TYR CE1 . 10113 1 1285 . 1 1 108 108 TYR CE2 C 13 117.734 0.300 . 1 . . . . 108 TYR CE2 . 10113 1 1286 . 1 1 108 108 TYR N N 15 122.664 0.300 . 1 . . . . 108 TYR N . 10113 1 1287 . 1 1 109 109 ILE H H 1 9.063 0.030 . 1 . . . . 109 ILE H . 10113 1 1288 . 1 1 109 109 ILE HA H 1 4.571 0.030 . 1 . . . . 109 ILE HA . 10113 1 1289 . 1 1 109 109 ILE HB H 1 1.590 0.030 . 1 . . . . 109 ILE HB . 10113 1 1290 . 1 1 109 109 ILE HG12 H 1 1.452 0.030 . 2 . . . . 109 ILE HG12 . 10113 1 1291 . 1 1 109 109 ILE HG13 H 1 0.973 0.030 . 2 . . . . 109 ILE HG13 . 10113 1 1292 . 1 1 109 109 ILE HG21 H 1 0.951 0.030 . 1 . . . . 109 ILE HG2 . 10113 1 1293 . 1 1 109 109 ILE HG22 H 1 0.951 0.030 . 1 . . . . 109 ILE HG2 . 10113 1 1294 . 1 1 109 109 ILE HG23 H 1 0.951 0.030 . 1 . . . . 109 ILE HG2 . 10113 1 1295 . 1 1 109 109 ILE HD11 H 1 0.703 0.030 . 1 . . . . 109 ILE HD1 . 10113 1 1296 . 1 1 109 109 ILE HD12 H 1 0.703 0.030 . 1 . . . . 109 ILE HD1 . 10113 1 1297 . 1 1 109 109 ILE HD13 H 1 0.703 0.030 . 1 . . . . 109 ILE HD1 . 10113 1 1298 . 1 1 109 109 ILE C C 13 174.425 0.300 . 1 . . . . 109 ILE C . 10113 1 1299 . 1 1 109 109 ILE CA C 13 61.068 0.300 . 1 . . . . 109 ILE CA . 10113 1 1300 . 1 1 109 109 ILE CB C 13 38.627 0.300 . 1 . . . . 109 ILE CB . 10113 1 1301 . 1 1 109 109 ILE CG1 C 13 27.936 0.300 . 1 . . . . 109 ILE CG1 . 10113 1 1302 . 1 1 109 109 ILE CG2 C 13 18.958 0.300 . 1 . . . . 109 ILE CG2 . 10113 1 1303 . 1 1 109 109 ILE CD1 C 13 13.934 0.300 . 1 . . . . 109 ILE CD1 . 10113 1 1304 . 1 1 109 109 ILE N N 15 123.519 0.300 . 1 . . . . 109 ILE N . 10113 1 1305 . 1 1 110 110 LEU H H 1 8.992 0.030 . 1 . . . . 110 LEU H . 10113 1 1306 . 1 1 110 110 LEU HA H 1 5.223 0.030 . 1 . . . . 110 LEU HA . 10113 1 1307 . 1 1 110 110 LEU HB2 H 1 0.046 0.030 . 2 . . . . 110 LEU HB2 . 10113 1 1308 . 1 1 110 110 LEU HB3 H 1 0.803 0.030 . 2 . . . . 110 LEU HB3 . 10113 1 1309 . 1 1 110 110 LEU HG H 1 1.360 0.030 . 1 . . . . 110 LEU HG . 10113 1 1310 . 1 1 110 110 LEU HD11 H 1 0.603 0.030 . 1 . . . . 110 LEU HD1 . 10113 1 1311 . 1 1 110 110 LEU HD12 H 1 0.603 0.030 . 1 . . . . 110 LEU HD1 . 10113 1 1312 . 1 1 110 110 LEU HD13 H 1 0.603 0.030 . 1 . . . . 110 LEU HD1 . 10113 1 1313 . 1 1 110 110 LEU HD21 H 1 0.528 0.030 . 1 . . . . 110 LEU HD2 . 10113 1 1314 . 1 1 110 110 LEU HD22 H 1 0.528 0.030 . 1 . . . . 110 LEU HD2 . 10113 1 1315 . 1 1 110 110 LEU HD23 H 1 0.528 0.030 . 1 . . . . 110 LEU HD2 . 10113 1 1316 . 1 1 110 110 LEU C C 13 174.298 0.300 . 1 . . . . 110 LEU C . 10113 1 1317 . 1 1 110 110 LEU CA C 13 54.171 0.300 . 1 . . . . 110 LEU CA . 10113 1 1318 . 1 1 110 110 LEU CB C 13 43.564 0.300 . 1 . . . . 110 LEU CB . 10113 1 1319 . 1 1 110 110 LEU CG C 13 29.475 0.300 . 1 . . . . 110 LEU CG . 10113 1 1320 . 1 1 110 110 LEU CD1 C 13 25.460 0.300 . 2 . . . . 110 LEU CD1 . 10113 1 1321 . 1 1 110 110 LEU CD2 C 13 26.738 0.300 . 2 . . . . 110 LEU CD2 . 10113 1 1322 . 1 1 110 110 LEU N N 15 128.632 0.300 . 1 . . . . 110 LEU N . 10113 1 1323 . 1 1 111 111 GLU H H 1 8.963 0.030 . 1 . . . . 111 GLU H . 10113 1 1324 . 1 1 111 111 GLU HA H 1 5.267 0.030 . 1 . . . . 111 GLU HA . 10113 1 1325 . 1 1 111 111 GLU HB2 H 1 1.397 0.030 . 2 . . . . 111 GLU HB2 . 10113 1 1326 . 1 1 111 111 GLU HB3 H 1 1.514 0.030 . 2 . . . . 111 GLU HB3 . 10113 1 1327 . 1 1 111 111 GLU HG2 H 1 2.022 0.030 . 2 . . . . 111 GLU HG2 . 10113 1 1328 . 1 1 111 111 GLU HG3 H 1 1.818 0.030 . 2 . . . . 111 GLU HG3 . 10113 1 1329 . 1 1 111 111 GLU C C 13 177.249 0.300 . 1 . . . . 111 GLU C . 10113 1 1330 . 1 1 111 111 GLU CA C 13 54.257 0.300 . 1 . . . . 111 GLU CA . 10113 1 1331 . 1 1 111 111 GLU CB C 13 34.388 0.300 . 1 . . . . 111 GLU CB . 10113 1 1332 . 1 1 111 111 GLU CG C 13 36.657 0.300 . 1 . . . . 111 GLU CG . 10113 1 1333 . 1 1 111 111 GLU N N 15 120.525 0.300 . 1 . . . . 111 GLU N . 10113 1 1334 . 1 1 112 112 THR H H 1 9.045 0.030 . 1 . . . . 112 THR H . 10113 1 1335 . 1 1 112 112 THR HA H 1 4.888 0.030 . 1 . . . . 112 THR HA . 10113 1 1336 . 1 1 112 112 THR HB H 1 4.726 0.030 . 1 . . . . 112 THR HB . 10113 1 1337 . 1 1 112 112 THR HG21 H 1 1.269 0.030 . 1 . . . . 112 THR HG2 . 10113 1 1338 . 1 1 112 112 THR HG22 H 1 1.269 0.030 . 1 . . . . 112 THR HG2 . 10113 1 1339 . 1 1 112 112 THR HG23 H 1 1.269 0.030 . 1 . . . . 112 THR HG2 . 10113 1 1340 . 1 1 112 112 THR C C 13 175.651 0.300 . 1 . . . . 112 THR C . 10113 1 1341 . 1 1 112 112 THR CA C 13 60.442 0.300 . 1 . . . . 112 THR CA . 10113 1 1342 . 1 1 112 112 THR CB C 13 70.685 0.300 . 1 . . . . 112 THR CB . 10113 1 1343 . 1 1 112 112 THR CG2 C 13 22.749 0.300 . 1 . . . . 112 THR CG2 . 10113 1 1344 . 1 1 112 112 THR N N 15 118.681 0.300 . 1 . . . . 112 THR N . 10113 1 1345 . 1 1 113 113 ILE H H 1 8.773 0.030 . 1 . . . . 113 ILE H . 10113 1 1346 . 1 1 113 113 ILE HA H 1 4.028 0.030 . 1 . . . . 113 ILE HA . 10113 1 1347 . 1 1 113 113 ILE HB H 1 1.954 0.030 . 1 . . . . 113 ILE HB . 10113 1 1348 . 1 1 113 113 ILE HG12 H 1 1.375 0.030 . 2 . . . . 113 ILE HG12 . 10113 1 1349 . 1 1 113 113 ILE HG13 H 1 1.603 0.030 . 2 . . . . 113 ILE HG13 . 10113 1 1350 . 1 1 113 113 ILE HG21 H 1 1.026 0.030 . 1 . . . . 113 ILE HG2 . 10113 1 1351 . 1 1 113 113 ILE HG22 H 1 1.026 0.030 . 1 . . . . 113 ILE HG2 . 10113 1 1352 . 1 1 113 113 ILE HG23 H 1 1.026 0.030 . 1 . . . . 113 ILE HG2 . 10113 1 1353 . 1 1 113 113 ILE HD11 H 1 0.979 0.030 . 1 . . . . 113 ILE HD1 . 10113 1 1354 . 1 1 113 113 ILE HD12 H 1 0.979 0.030 . 1 . . . . 113 ILE HD1 . 10113 1 1355 . 1 1 113 113 ILE HD13 H 1 0.979 0.030 . 1 . . . . 113 ILE HD1 . 10113 1 1356 . 1 1 113 113 ILE C C 13 175.987 0.300 . 1 . . . . 113 ILE C . 10113 1 1357 . 1 1 113 113 ILE CA C 13 62.988 0.300 . 1 . . . . 113 ILE CA . 10113 1 1358 . 1 1 113 113 ILE CB C 13 38.533 0.300 . 1 . . . . 113 ILE CB . 10113 1 1359 . 1 1 113 113 ILE CG1 C 13 28.230 0.300 . 1 . . . . 113 ILE CG1 . 10113 1 1360 . 1 1 113 113 ILE CG2 C 13 17.904 0.300 . 1 . . . . 113 ILE CG2 . 10113 1 1361 . 1 1 113 113 ILE CD1 C 13 13.451 0.300 . 1 . . . . 113 ILE CD1 . 10113 1 1362 . 1 1 113 113 ILE N N 15 116.717 0.300 . 1 . . . . 113 ILE N . 10113 1 1363 . 1 1 114 114 ASP H H 1 7.262 0.030 . 1 . . . . 114 ASP H . 10113 1 1364 . 1 1 114 114 ASP HA H 1 4.713 0.030 . 1 . . . . 114 ASP HA . 10113 1 1365 . 1 1 114 114 ASP HB2 H 1 2.873 0.030 . 2 . . . . 114 ASP HB2 . 10113 1 1366 . 1 1 114 114 ASP HB3 H 1 3.182 0.030 . 2 . . . . 114 ASP HB3 . 10113 1 1367 . 1 1 114 114 ASP C C 13 177.143 0.300 . 1 . . . . 114 ASP C . 10113 1 1368 . 1 1 114 114 ASP CA C 13 52.567 0.300 . 1 . . . . 114 ASP CA . 10113 1 1369 . 1 1 114 114 ASP CB C 13 43.352 0.300 . 1 . . . . 114 ASP CB . 10113 1 1370 . 1 1 114 114 ASP N N 15 114.428 0.300 . 1 . . . . 114 ASP N . 10113 1 1371 . 1 1 115 115 SER HA H 1 4.426 0.030 . 1 . . . . 115 SER HA . 10113 1 1372 . 1 1 115 115 SER HB2 H 1 4.084 0.030 . 2 . . . . 115 SER HB2 . 10113 1 1373 . 1 1 115 115 SER HB3 H 1 4.019 0.030 . 2 . . . . 115 SER HB3 . 10113 1 1374 . 1 1 115 115 SER C C 13 176.350 0.300 . 1 . . . . 115 SER C . 10113 1 1375 . 1 1 115 115 SER CA C 13 60.781 0.300 . 1 . . . . 115 SER CA . 10113 1 1376 . 1 1 115 115 SER CB C 13 63.388 0.300 . 1 . . . . 115 SER CB . 10113 1 1377 . 1 1 116 116 LEU H H 1 7.809 0.030 . 1 . . . . 116 LEU H . 10113 1 1378 . 1 1 116 116 LEU HA H 1 4.253 0.030 . 1 . . . . 116 LEU HA . 10113 1 1379 . 1 1 116 116 LEU HB2 H 1 1.923 0.030 . 2 . . . . 116 LEU HB2 . 10113 1 1380 . 1 1 116 116 LEU HB3 H 1 1.733 0.030 . 2 . . . . 116 LEU HB3 . 10113 1 1381 . 1 1 116 116 LEU HG H 1 1.701 0.030 . 1 . . . . 116 LEU HG . 10113 1 1382 . 1 1 116 116 LEU HD11 H 1 0.937 0.030 . 1 . . . . 116 LEU HD1 . 10113 1 1383 . 1 1 116 116 LEU HD12 H 1 0.937 0.030 . 1 . . . . 116 LEU HD1 . 10113 1 1384 . 1 1 116 116 LEU HD13 H 1 0.937 0.030 . 1 . . . . 116 LEU HD1 . 10113 1 1385 . 1 1 116 116 LEU HD21 H 1 0.981 0.030 . 1 . . . . 116 LEU HD2 . 10113 1 1386 . 1 1 116 116 LEU HD22 H 1 0.981 0.030 . 1 . . . . 116 LEU HD2 . 10113 1 1387 . 1 1 116 116 LEU HD23 H 1 0.981 0.030 . 1 . . . . 116 LEU HD2 . 10113 1 1388 . 1 1 116 116 LEU C C 13 181.032 0.300 . 1 . . . . 116 LEU C . 10113 1 1389 . 1 1 116 116 LEU CA C 13 58.481 0.300 . 1 . . . . 116 LEU CA . 10113 1 1390 . 1 1 116 116 LEU CB C 13 41.083 0.300 . 1 . . . . 116 LEU CB . 10113 1 1391 . 1 1 116 116 LEU CG C 13 27.471 0.300 . 1 . . . . 116 LEU CG . 10113 1 1392 . 1 1 116 116 LEU CD1 C 13 24.023 0.300 . 2 . . . . 116 LEU CD1 . 10113 1 1393 . 1 1 116 116 LEU CD2 C 13 24.690 0.300 . 2 . . . . 116 LEU CD2 . 10113 1 1394 . 1 1 116 116 LEU N N 15 125.188 0.300 . 1 . . . . 116 LEU N . 10113 1 1395 . 1 1 117 117 GLN H H 1 9.113 0.030 . 1 . . . . 117 GLN H . 10113 1 1396 . 1 1 117 117 GLN HA H 1 4.173 0.030 . 1 . . . . 117 GLN HA . 10113 1 1397 . 1 1 117 117 GLN HB2 H 1 2.191 0.030 . 2 . . . . 117 GLN HB2 . 10113 1 1398 . 1 1 117 117 GLN HB3 H 1 2.479 0.030 . 2 . . . . 117 GLN HB3 . 10113 1 1399 . 1 1 117 117 GLN HG2 H 1 2.711 0.030 . 2 . . . . 117 GLN HG2 . 10113 1 1400 . 1 1 117 117 GLN HG3 H 1 2.911 0.030 . 2 . . . . 117 GLN HG3 . 10113 1 1401 . 1 1 117 117 GLN HE21 H 1 6.993 0.030 . 2 . . . . 117 GLN HE21 . 10113 1 1402 . 1 1 117 117 GLN HE22 H 1 7.984 0.030 . 2 . . . . 117 GLN HE22 . 10113 1 1403 . 1 1 117 117 GLN C C 13 178.341 0.300 . 1 . . . . 117 GLN C . 10113 1 1404 . 1 1 117 117 GLN CA C 13 59.021 0.300 . 1 . . . . 117 GLN CA . 10113 1 1405 . 1 1 117 117 GLN CB C 13 29.162 0.300 . 1 . . . . 117 GLN CB . 10113 1 1406 . 1 1 117 117 GLN CG C 13 34.928 0.300 . 1 . . . . 117 GLN CG . 10113 1 1407 . 1 1 117 117 GLN N N 15 119.217 0.300 . 1 . . . . 117 GLN N . 10113 1 1408 . 1 1 117 117 GLN NE2 N 15 114.210 0.300 . 1 . . . . 117 GLN NE2 . 10113 1 1409 . 1 1 118 118 LYS H H 1 7.414 0.030 . 1 . . . . 118 LYS H . 10113 1 1410 . 1 1 118 118 LYS HA H 1 3.938 0.030 . 1 . . . . 118 LYS HA . 10113 1 1411 . 1 1 118 118 LYS HB2 H 1 2.203 0.030 . 2 . . . . 118 LYS HB2 . 10113 1 1412 . 1 1 118 118 LYS HB3 H 1 2.103 0.030 . 2 . . . . 118 LYS HB3 . 10113 1 1413 . 1 1 118 118 LYS HG2 H 1 0.953 0.030 . 2 . . . . 118 LYS HG2 . 10113 1 1414 . 1 1 118 118 LYS HG3 H 1 1.364 0.030 . 2 . . . . 118 LYS HG3 . 10113 1 1415 . 1 1 118 118 LYS HD2 H 1 1.543 0.030 . 2 . . . . 118 LYS HD2 . 10113 1 1416 . 1 1 118 118 LYS HE2 H 1 2.883 0.030 . 2 . . . . 118 LYS HE2 . 10113 1 1417 . 1 1 118 118 LYS HE3 H 1 2.623 0.030 . 2 . . . . 118 LYS HE3 . 10113 1 1418 . 1 1 118 118 LYS C C 13 177.008 0.300 . 1 . . . . 118 LYS C . 10113 1 1419 . 1 1 118 118 LYS CA C 13 60.860 0.300 . 1 . . . . 118 LYS CA . 10113 1 1420 . 1 1 118 118 LYS CB C 13 30.302 0.300 . 1 . . . . 118 LYS CB . 10113 1 1421 . 1 1 118 118 LYS CG C 13 24.234 0.300 . 1 . . . . 118 LYS CG . 10113 1 1422 . 1 1 118 118 LYS CD C 13 29.282 0.300 . 1 . . . . 118 LYS CD . 10113 1 1423 . 1 1 118 118 LYS CE C 13 41.826 0.300 . 1 . . . . 118 LYS CE . 10113 1 1424 . 1 1 118 118 LYS N N 15 121.438 0.300 . 1 . . . . 118 LYS N . 10113 1 1425 . 1 1 119 119 HIS H H 1 8.170 0.030 . 1 . . . . 119 HIS H . 10113 1 1426 . 1 1 119 119 HIS HA H 1 4.089 0.030 . 1 . . . . 119 HIS HA . 10113 1 1427 . 1 1 119 119 HIS HB2 H 1 3.187 0.030 . 1 . . . . 119 HIS HB2 . 10113 1 1428 . 1 1 119 119 HIS HB3 H 1 3.187 0.030 . 1 . . . . 119 HIS HB3 . 10113 1 1429 . 1 1 119 119 HIS HD2 H 1 7.100 0.030 . 1 . . . . 119 HIS HD2 . 10113 1 1430 . 1 1 119 119 HIS HE1 H 1 7.821 0.030 . 1 . . . . 119 HIS HE1 . 10113 1 1431 . 1 1 119 119 HIS C C 13 178.582 0.300 . 1 . . . . 119 HIS C . 10113 1 1432 . 1 1 119 119 HIS CA C 13 60.253 0.300 . 1 . . . . 119 HIS CA . 10113 1 1433 . 1 1 119 119 HIS CB C 13 30.220 0.300 . 1 . . . . 119 HIS CB . 10113 1 1434 . 1 1 119 119 HIS CD2 C 13 120.858 0.300 . 1 . . . . 119 HIS CD2 . 10113 1 1435 . 1 1 119 119 HIS CE1 C 13 138.490 0.300 . 1 . . . . 119 HIS CE1 . 10113 1 1436 . 1 1 119 119 HIS N N 15 116.855 0.300 . 1 . . . . 119 HIS N . 10113 1 1437 . 1 1 120 120 SER H H 1 8.183 0.030 . 1 . . . . 120 SER H . 10113 1 1438 . 1 1 120 120 SER HA H 1 4.163 0.030 . 1 . . . . 120 SER HA . 10113 1 1439 . 1 1 120 120 SER HB2 H 1 3.873 0.030 . 2 . . . . 120 SER HB2 . 10113 1 1440 . 1 1 120 120 SER HB3 H 1 3.729 0.030 . 2 . . . . 120 SER HB3 . 10113 1 1441 . 1 1 120 120 SER C C 13 176.374 0.300 . 1 . . . . 120 SER C . 10113 1 1442 . 1 1 120 120 SER CA C 13 61.796 0.300 . 1 . . . . 120 SER CA . 10113 1 1443 . 1 1 120 120 SER CB C 13 62.542 0.300 . 1 . . . . 120 SER CB . 10113 1 1444 . 1 1 120 120 SER N N 15 115.134 0.300 . 1 . . . . 120 SER N . 10113 1 1445 . 1 1 121 121 TRP H H 1 8.183 0.030 . 1 . . . . 121 TRP H . 10113 1 1446 . 1 1 121 121 TRP HA H 1 3.932 0.030 . 1 . . . . 121 TRP HA . 10113 1 1447 . 1 1 121 121 TRP HB2 H 1 3.029 0.030 . 2 . . . . 121 TRP HB2 . 10113 1 1448 . 1 1 121 121 TRP HB3 H 1 2.743 0.030 . 2 . . . . 121 TRP HB3 . 10113 1 1449 . 1 1 121 121 TRP HD1 H 1 7.294 0.030 . 1 . . . . 121 TRP HD1 . 10113 1 1450 . 1 1 121 121 TRP HE1 H 1 10.382 0.030 . 1 . . . . 121 TRP HE1 . 10113 1 1451 . 1 1 121 121 TRP HE3 H 1 7.387 0.030 . 1 . . . . 121 TRP HE3 . 10113 1 1452 . 1 1 121 121 TRP HZ2 H 1 6.943 0.030 . 1 . . . . 121 TRP HZ2 . 10113 1 1453 . 1 1 121 121 TRP HZ3 H 1 6.668 0.030 . 1 . . . . 121 TRP HZ3 . 10113 1 1454 . 1 1 121 121 TRP HH2 H 1 6.780 0.030 . 1 . . . . 121 TRP HH2 . 10113 1 1455 . 1 1 121 121 TRP C C 13 178.521 0.300 . 1 . . . . 121 TRP C . 10113 1 1456 . 1 1 121 121 TRP CA C 13 62.082 0.300 . 1 . . . . 121 TRP CA . 10113 1 1457 . 1 1 121 121 TRP CB C 13 30.132 0.300 . 1 . . . . 121 TRP CB . 10113 1 1458 . 1 1 121 121 TRP CD1 C 13 126.745 0.300 . 1 . . . . 121 TRP CD1 . 10113 1 1459 . 1 1 121 121 TRP CE3 C 13 119.436 0.300 . 1 . . . . 121 TRP CE3 . 10113 1 1460 . 1 1 121 121 TRP CZ2 C 13 114.034 0.300 . 1 . . . . 121 TRP CZ2 . 10113 1 1461 . 1 1 121 121 TRP CZ3 C 13 121.003 0.300 . 1 . . . . 121 TRP CZ3 . 10113 1 1462 . 1 1 121 121 TRP CH2 C 13 124.329 0.300 . 1 . . . . 121 TRP CH2 . 10113 1 1463 . 1 1 121 121 TRP N N 15 121.817 0.300 . 1 . . . . 121 TRP N . 10113 1 1464 . 1 1 121 121 TRP NE1 N 15 128.454 0.300 . 1 . . . . 121 TRP NE1 . 10113 1 1465 . 1 1 122 122 VAL H H 1 7.914 0.030 . 1 . . . . 122 VAL H . 10113 1 1466 . 1 1 122 122 VAL HA H 1 3.042 0.030 . 1 . . . . 122 VAL HA . 10113 1 1467 . 1 1 122 122 VAL HB H 1 1.844 0.030 . 1 . . . . 122 VAL HB . 10113 1 1468 . 1 1 122 122 VAL HG11 H 1 0.717 0.030 . 1 . . . . 122 VAL HG1 . 10113 1 1469 . 1 1 122 122 VAL HG12 H 1 0.717 0.030 . 1 . . . . 122 VAL HG1 . 10113 1 1470 . 1 1 122 122 VAL HG13 H 1 0.717 0.030 . 1 . . . . 122 VAL HG1 . 10113 1 1471 . 1 1 122 122 VAL HG21 H 1 0.336 0.030 . 1 . . . . 122 VAL HG2 . 10113 1 1472 . 1 1 122 122 VAL HG22 H 1 0.336 0.030 . 1 . . . . 122 VAL HG2 . 10113 1 1473 . 1 1 122 122 VAL HG23 H 1 0.336 0.030 . 1 . . . . 122 VAL HG2 . 10113 1 1474 . 1 1 122 122 VAL C C 13 177.273 0.300 . 1 . . . . 122 VAL C . 10113 1 1475 . 1 1 122 122 VAL CA C 13 67.350 0.300 . 1 . . . . 122 VAL CA . 10113 1 1476 . 1 1 122 122 VAL CB C 13 31.411 0.300 . 1 . . . . 122 VAL CB . 10113 1 1477 . 1 1 122 122 VAL CG1 C 13 21.016 0.300 . 2 . . . . 122 VAL CG1 . 10113 1 1478 . 1 1 122 122 VAL CG2 C 13 22.801 0.300 . 2 . . . . 122 VAL CG2 . 10113 1 1479 . 1 1 122 122 VAL N N 15 117.120 0.300 . 1 . . . . 122 VAL N . 10113 1 1480 . 1 1 123 123 ALA H H 1 7.862 0.030 . 1 . . . . 123 ALA H . 10113 1 1481 . 1 1 123 123 ALA HA H 1 4.068 0.030 . 1 . . . . 123 ALA HA . 10113 1 1482 . 1 1 123 123 ALA HB1 H 1 1.383 0.030 . 1 . . . . 123 ALA HB . 10113 1 1483 . 1 1 123 123 ALA HB2 H 1 1.383 0.030 . 1 . . . . 123 ALA HB . 10113 1 1484 . 1 1 123 123 ALA HB3 H 1 1.383 0.030 . 1 . . . . 123 ALA HB . 10113 1 1485 . 1 1 123 123 ALA C C 13 181.429 0.300 . 1 . . . . 123 ALA C . 10113 1 1486 . 1 1 123 123 ALA CA C 13 55.002 0.300 . 1 . . . . 123 ALA CA . 10113 1 1487 . 1 1 123 123 ALA CB C 13 17.952 0.300 . 1 . . . . 123 ALA CB . 10113 1 1488 . 1 1 123 123 ALA N N 15 119.722 0.300 . 1 . . . . 123 ALA N . 10113 1 1489 . 1 1 124 124 ASP H H 1 7.914 0.030 . 1 . . . . 124 ASP H . 10113 1 1490 . 1 1 124 124 ASP HA H 1 4.399 0.030 . 1 . . . . 124 ASP HA . 10113 1 1491 . 1 1 124 124 ASP HB2 H 1 2.115 0.030 . 2 . . . . 124 ASP HB2 . 10113 1 1492 . 1 1 124 124 ASP HB3 H 1 2.492 0.030 . 2 . . . . 124 ASP HB3 . 10113 1 1493 . 1 1 124 124 ASP C C 13 179.119 0.300 . 1 . . . . 124 ASP C . 10113 1 1494 . 1 1 124 124 ASP CA C 13 56.959 0.300 . 1 . . . . 124 ASP CA . 10113 1 1495 . 1 1 124 124 ASP CB C 13 40.011 0.300 . 1 . . . . 124 ASP CB . 10113 1 1496 . 1 1 124 124 ASP N N 15 119.606 0.300 . 1 . . . . 124 ASP N . 10113 1 1497 . 1 1 125 125 ILE H H 1 8.480 0.030 . 1 . . . . 125 ILE H . 10113 1 1498 . 1 1 125 125 ILE HA H 1 3.463 0.030 . 1 . . . . 125 ILE HA . 10113 1 1499 . 1 1 125 125 ILE HB H 1 1.835 0.030 . 1 . . . . 125 ILE HB . 10113 1 1500 . 1 1 125 125 ILE HG12 H 1 2.265 0.030 . 2 . . . . 125 ILE HG12 . 10113 1 1501 . 1 1 125 125 ILE HG13 H 1 0.947 0.030 . 2 . . . . 125 ILE HG13 . 10113 1 1502 . 1 1 125 125 ILE HG21 H 1 0.865 0.030 . 1 . . . . 125 ILE HG2 . 10113 1 1503 . 1 1 125 125 ILE HG22 H 1 0.865 0.030 . 1 . . . . 125 ILE HG2 . 10113 1 1504 . 1 1 125 125 ILE HG23 H 1 0.865 0.030 . 1 . . . . 125 ILE HG2 . 10113 1 1505 . 1 1 125 125 ILE HD11 H 1 1.031 0.030 . 1 . . . . 125 ILE HD1 . 10113 1 1506 . 1 1 125 125 ILE HD12 H 1 1.031 0.030 . 1 . . . . 125 ILE HD1 . 10113 1 1507 . 1 1 125 125 ILE HD13 H 1 1.031 0.030 . 1 . . . . 125 ILE HD1 . 10113 1 1508 . 1 1 125 125 ILE C C 13 177.898 0.300 . 1 . . . . 125 ILE C . 10113 1 1509 . 1 1 125 125 ILE CA C 13 66.507 0.300 . 1 . . . . 125 ILE CA . 10113 1 1510 . 1 1 125 125 ILE CB C 13 38.256 0.300 . 1 . . . . 125 ILE CB . 10113 1 1511 . 1 1 125 125 ILE CG1 C 13 30.505 0.300 . 1 . . . . 125 ILE CG1 . 10113 1 1512 . 1 1 125 125 ILE CG2 C 13 17.628 0.300 . 1 . . . . 125 ILE CG2 . 10113 1 1513 . 1 1 125 125 ILE CD1 C 13 14.647 0.300 . 1 . . . . 125 ILE CD1 . 10113 1 1514 . 1 1 125 125 ILE N N 15 119.640 0.300 . 1 . . . . 125 ILE N . 10113 1 1515 . 1 1 126 126 GLN H H 1 8.770 0.030 . 1 . . . . 126 GLN H . 10113 1 1516 . 1 1 126 126 GLN HA H 1 3.890 0.030 . 1 . . . . 126 GLN HA . 10113 1 1517 . 1 1 126 126 GLN HB2 H 1 2.184 0.030 . 2 . . . . 126 GLN HB2 . 10113 1 1518 . 1 1 126 126 GLN HB3 H 1 2.016 0.030 . 2 . . . . 126 GLN HB3 . 10113 1 1519 . 1 1 126 126 GLN HG2 H 1 2.319 0.030 . 2 . . . . 126 GLN HG2 . 10113 1 1520 . 1 1 126 126 GLN HG3 H 1 2.484 0.030 . 2 . . . . 126 GLN HG3 . 10113 1 1521 . 1 1 126 126 GLN HE21 H 1 6.766 0.030 . 2 . . . . 126 GLN HE21 . 10113 1 1522 . 1 1 126 126 GLN HE22 H 1 7.453 0.030 . 2 . . . . 126 GLN HE22 . 10113 1 1523 . 1 1 126 126 GLN C C 13 178.594 0.300 . 1 . . . . 126 GLN C . 10113 1 1524 . 1 1 126 126 GLN CA C 13 58.925 0.300 . 1 . . . . 126 GLN CA . 10113 1 1525 . 1 1 126 126 GLN CB C 13 28.655 0.300 . 1 . . . . 126 GLN CB . 10113 1 1526 . 1 1 126 126 GLN CG C 13 34.189 0.300 . 1 . . . . 126 GLN CG . 10113 1 1527 . 1 1 126 126 GLN N N 15 117.943 0.300 . 1 . . . . 126 GLN N . 10113 1 1528 . 1 1 126 126 GLN NE2 N 15 112.408 0.300 . 1 . . . . 126 GLN NE2 . 10113 1 1529 . 1 1 127 127 GLY H H 1 8.092 0.030 . 1 . . . . 127 GLY H . 10113 1 1530 . 1 1 127 127 GLY HA2 H 1 3.962 0.030 . 2 . . . . 127 GLY HA2 . 10113 1 1531 . 1 1 127 127 GLY HA3 H 1 3.915 0.030 . 2 . . . . 127 GLY HA3 . 10113 1 1532 . 1 1 127 127 GLY C C 13 176.035 0.300 . 1 . . . . 127 GLY C . 10113 1 1533 . 1 1 127 127 GLY CA C 13 46.439 0.300 . 1 . . . . 127 GLY CA . 10113 1 1534 . 1 1 127 127 GLY N N 15 105.363 0.300 . 1 . . . . 127 GLY N . 10113 1 1535 . 1 1 128 128 CYS H H 1 7.530 0.030 . 1 . . . . 128 CYS H . 10113 1 1536 . 1 1 128 128 CYS HA H 1 4.035 0.030 . 1 . . . . 128 CYS HA . 10113 1 1537 . 1 1 128 128 CYS HB2 H 1 2.706 0.030 . 2 . . . . 128 CYS HB2 . 10113 1 1538 . 1 1 128 128 CYS HB3 H 1 2.153 0.030 . 2 . . . . 128 CYS HB3 . 10113 1 1539 . 1 1 128 128 CYS C C 13 176.131 0.300 . 1 . . . . 128 CYS C . 10113 1 1540 . 1 1 128 128 CYS CA C 13 61.844 0.300 . 1 . . . . 128 CYS CA . 10113 1 1541 . 1 1 128 128 CYS CB C 13 28.115 0.300 . 1 . . . . 128 CYS CB . 10113 1 1542 . 1 1 128 128 CYS N N 15 118.314 0.300 . 1 . . . . 128 CYS N . 10113 1 1543 . 1 1 129 129 VAL H H 1 7.830 0.030 . 1 . . . . 129 VAL H . 10113 1 1544 . 1 1 129 129 VAL HA H 1 3.773 0.030 . 1 . . . . 129 VAL HA . 10113 1 1545 . 1 1 129 129 VAL HB H 1 2.234 0.030 . 1 . . . . 129 VAL HB . 10113 1 1546 . 1 1 129 129 VAL HG11 H 1 1.000 0.030 . 1 . . . . 129 VAL HG1 . 10113 1 1547 . 1 1 129 129 VAL HG12 H 1 1.000 0.030 . 1 . . . . 129 VAL HG1 . 10113 1 1548 . 1 1 129 129 VAL HG13 H 1 1.000 0.030 . 1 . . . . 129 VAL HG1 . 10113 1 1549 . 1 1 129 129 VAL HG21 H 1 0.975 0.030 . 1 . . . . 129 VAL HG2 . 10113 1 1550 . 1 1 129 129 VAL HG22 H 1 0.975 0.030 . 1 . . . . 129 VAL HG2 . 10113 1 1551 . 1 1 129 129 VAL HG23 H 1 0.975 0.030 . 1 . . . . 129 VAL HG2 . 10113 1 1552 . 1 1 129 129 VAL C C 13 177.189 0.300 . 1 . . . . 129 VAL C . 10113 1 1553 . 1 1 129 129 VAL CA C 13 64.796 0.300 . 1 . . . . 129 VAL CA . 10113 1 1554 . 1 1 129 129 VAL CB C 13 32.251 0.300 . 1 . . . . 129 VAL CB . 10113 1 1555 . 1 1 129 129 VAL CG1 C 13 21.580 0.300 . 2 . . . . 129 VAL CG1 . 10113 1 1556 . 1 1 129 129 VAL CG2 C 13 21.201 0.300 . 2 . . . . 129 VAL CG2 . 10113 1 1557 . 1 1 129 129 VAL N N 15 121.509 0.300 . 1 . . . . 129 VAL N . 10113 1 1558 . 1 1 130 130 ASP H H 1 8.329 0.030 . 1 . . . . 130 ASP H . 10113 1 1559 . 1 1 130 130 ASP HA H 1 4.645 0.030 . 1 . . . . 130 ASP HA . 10113 1 1560 . 1 1 130 130 ASP HB2 H 1 2.801 0.030 . 2 . . . . 130 ASP HB2 . 10113 1 1561 . 1 1 130 130 ASP HB3 H 1 2.673 0.030 . 2 . . . . 130 ASP HB3 . 10113 1 1562 . 1 1 130 130 ASP C C 13 176.565 0.300 . 1 . . . . 130 ASP C . 10113 1 1563 . 1 1 130 130 ASP CA C 13 55.134 0.300 . 1 . . . . 130 ASP CA . 10113 1 1564 . 1 1 130 130 ASP CB C 13 41.235 0.300 . 1 . . . . 130 ASP CB . 10113 1 1565 . 1 1 130 130 ASP N N 15 121.170 0.300 . 1 . . . . 130 ASP N . 10113 1 1566 . 1 1 131 131 SER H H 1 7.943 0.030 . 1 . . . . 131 SER H . 10113 1 1567 . 1 1 131 131 SER HA H 1 4.503 0.030 . 1 . . . . 131 SER HA . 10113 1 1568 . 1 1 131 131 SER HB2 H 1 4.066 0.030 . 2 . . . . 131 SER HB2 . 10113 1 1569 . 1 1 131 131 SER HB3 H 1 3.991 0.030 . 2 . . . . 131 SER HB3 . 10113 1 1570 . 1 1 131 131 SER C C 13 174.966 0.300 . 1 . . . . 131 SER C . 10113 1 1571 . 1 1 131 131 SER CA C 13 58.809 0.300 . 1 . . . . 131 SER CA . 10113 1 1572 . 1 1 131 131 SER CB C 13 64.000 0.300 . 1 . . . . 131 SER CB . 10113 1 1573 . 1 1 131 131 SER N N 15 115.527 0.300 . 1 . . . . 131 SER N . 10113 1 1574 . 1 1 132 132 GLY H H 1 8.171 0.030 . 1 . . . . 132 GLY H . 10113 1 1575 . 1 1 132 132 GLY HA2 H 1 4.199 0.030 . 2 . . . . 132 GLY HA2 . 10113 1 1576 . 1 1 132 132 GLY HA3 H 1 4.145 0.030 . 2 . . . . 132 GLY HA3 . 10113 1 1577 . 1 1 132 132 GLY C C 13 172.016 0.300 . 1 . . . . 132 GLY C . 10113 1 1578 . 1 1 132 132 GLY CA C 13 45.034 0.300 . 1 . . . . 132 GLY CA . 10113 1 1579 . 1 1 132 132 GLY N N 15 110.475 0.300 . 1 . . . . 132 GLY N . 10113 1 1580 . 1 1 133 133 PRO HA H 1 4.529 0.030 . 1 . . . . 133 PRO HA . 10113 1 1581 . 1 1 133 133 PRO HB2 H 1 2.321 0.030 . 1 . . . . 133 PRO HB2 . 10113 1 1582 . 1 1 133 133 PRO HB3 H 1 2.321 0.030 . 1 . . . . 133 PRO HB3 . 10113 1 1583 . 1 1 133 133 PRO HG2 H 1 2.033 0.030 . 1 . . . . 133 PRO HG2 . 10113 1 1584 . 1 1 133 133 PRO HG3 H 1 2.033 0.030 . 1 . . . . 133 PRO HG3 . 10113 1 1585 . 1 1 133 133 PRO HD2 H 1 3.685 0.030 . 1 . . . . 133 PRO HD2 . 10113 1 1586 . 1 1 133 133 PRO HD3 H 1 3.685 0.030 . 1 . . . . 133 PRO HD3 . 10113 1 1587 . 1 1 133 133 PRO CA C 13 63.377 0.300 . 1 . . . . 133 PRO CA . 10113 1 1588 . 1 1 133 133 PRO CB C 13 32.259 0.300 . 1 . . . . 133 PRO CB . 10113 1 1589 . 1 1 133 133 PRO CG C 13 32.242 0.300 . 1 . . . . 133 PRO CG . 10113 1 1590 . 1 1 133 133 PRO CD C 13 49.889 0.300 . 1 . . . . 133 PRO CD . 10113 1 stop_ save_