data_16113 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 16113 _Entry.Title ; H, 13C, and 15N Chemical Shift Assignments of Protein yppE from Bacillus subtilis. Northeast Structural Genomics Consortium Target SR213 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2009-01-09 _Entry.Accession_date 2009-01-09 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.0.9.13 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Gaohua Liu . . . 16113 2 Kiran SINGARAPU . K. . 16113 3 David Parish . . . 16113 4 Alexandre Eletsky . . . 16113 5 Duanxiang Xu . . . 16113 6 'Chi Kent' HO . . . 16113 7 Yinyi Fang . . . 16113 8 Kellie CUNNINGHAM . . . 16113 9 Li-Chung MA . . . 16113 10 Rong Xiao . . . 16113 11 Jinfeng Liu . . . 16113 12 Michael Baran . G. . 16113 13 G.V.T Swapna . . . 16113 14 Thomas Acton . B. . 16113 15 Burkhard Rost . . . 16113 16 Gaetano Montelione . T. . 16113 17 Thomas Szyperski . . . 16113 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID . 'PSI, Protein Structure Initiative' 'Northeast Structural Genomics Consortium' . 16113 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 16113 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 388 16113 '15N chemical shifts' 101 16113 '1H chemical shifts' 814 16113 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 2 . . 2009-06-11 2009-01-09 update BMRB 'added time domain data' 16113 1 . . 2009-03-02 2009-01-09 original author 'original release' 16113 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2HFI 'NMR structure' 16113 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 16113 _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 NMR Structure of Protein yppE from Bacillus subtilis. Northeast Structural Genomics Consortium Target SR213' _Citation.Status 'in preparation' _Citation.Type journal _Citation.Journal_abbrev 'Not known' _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 Gaohua Liu . . . 16113 1 2 Kiran Singarapu . K. . 16113 1 3 Gaetano Montelione . T. . 16113 1 4 Thomas Szyperski . . . 16113 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 16113 _Assembly.ID 1 _Assembly.Name yppe _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 yppe 1 $yppe A . yes native no no . . . 16113 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_yppe _Entity.Sf_category entity _Entity.Sf_framecode yppe _Entity.Entry_ID 16113 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name yppe _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 ; MLSQTLLEMTEQMIEVAEKG ADRYQEGKNSNHSYDFFETI KPAVEENDELAARWAEGALE LIKVRRPKYVHKEQIEAVKD NFLELVLQSYVHHIHKKRFK DITESVLYTLHAVKDEIARE DSRLEHHHHHH ; _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 131 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details 'equilibrium with transit dimer' _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 2HFI . "Solution Nmr Structure Of Protein Yppe From Bacillus Subtilis. Northeast Structural Genomics Consortium Target Sr213" . . . . . 100.00 131 100.00 100.00 8.36e-89 . . . . 16113 1 2 no PDB 2IM8 . "X-ray Crystal Structure Of Protein Yppe From Bacillus Subtilis. Northeast Structural Genomics Consortium Target Sr213" . . . . . 99.24 131 98.46 98.46 1.23e-85 . . . . 16113 1 3 no DBJ BAI85724 . "hypothetical protein BSNT_08621 [Bacillus subtilis subsp. natto BEST195]" . . . . . 90.08 118 99.15 100.00 1.53e-78 . . . . 16113 1 4 no DBJ BAM52709 . "hypothetical protein BEST7613_3778 [Bacillus subtilis BEST7613]" . . . . . 84.73 111 100.00 100.00 1.64e-73 . . . . 16113 1 5 no DBJ BAM58284 . "hypothetical protein BEST7003_2083 [Bacillus subtilis BEST7003]" . . . . . 93.89 123 100.00 100.00 5.89e-83 . . . . 16113 1 6 no DBJ GAK79397 . "hypothetical protein BSMD_013050 [Bacillus subtilis Miyagi-4]" . . . . . 93.89 123 100.00 100.00 5.89e-83 . . . . 16113 1 7 no EMBL CAB14144 . "conserved hypothetical protein [Bacillus subtilis subsp. subtilis str. 168]" . . . . . 93.89 123 100.00 100.00 5.89e-83 . . . . 16113 1 8 no EMBL CCU58728 . "hypothetical protein BSUBE1_2097 [Bacillus subtilis E1]" . . . . . 93.89 123 99.19 99.19 2.57e-82 . . . . 16113 1 9 no EMBL CEI57439 . "hypothetical protein BS49_24550 [Bacillus subtilis]" . . . . . 93.89 123 100.00 100.00 5.89e-83 . . . . 16113 1 10 no EMBL CEJ77864 . "hypothetical protein BS34A_24550 [Bacillus sp.]" . . . . . 93.89 123 100.00 100.00 5.89e-83 . . . . 16113 1 11 no EMBL CJT23466 . "Bacterial domain of uncharacterised function (DUF1798) [Streptococcus pneumoniae]" . . . . . 93.89 123 97.56 98.37 1.16e-80 . . . . 16113 1 12 no GB AAB38463 . "putative [Bacillus subtilis subsp. subtilis str. 168]" . . . . . 93.89 123 100.00 100.00 5.89e-83 . . . . 16113 1 13 no GB ADV92956 . "hypothetical protein BSn5_01610 [Bacillus subtilis BSn5]" . . . . . 93.89 123 97.56 97.56 1.85e-80 . . . . 16113 1 14 no GB AEP91245 . "YppE [Bacillus subtilis subsp. subtilis str. RO-NN-1]" . . . . . 93.89 123 100.00 100.00 5.89e-83 . . . . 16113 1 15 no GB AFQ58175 . "YppE [Bacillus subtilis QB928]" . . . . . 93.89 123 100.00 100.00 5.89e-83 . . . . 16113 1 16 no GB AGA23534 . "Hypothetical protein YppE [Bacillus subtilis subsp. subtilis str. BSP1]" . . . . . 93.89 123 100.00 100.00 5.89e-83 . . . . 16113 1 17 no REF NP_390109 . "hypothetical protein BSU22270 [Bacillus subtilis subsp. subtilis str. 168]" . . . . . 93.89 123 100.00 100.00 5.89e-83 . . . . 16113 1 18 no REF WP_003246080 . "MULTISPECIES: hypothetical protein [Bacillus]" . . . . . 93.89 123 100.00 100.00 5.89e-83 . . . . 16113 1 19 no REF WP_015483369 . "hypothetical protein [Bacillus subtilis]" . . . . . 93.89 123 98.37 100.00 1.02e-81 . . . . 16113 1 20 no REF WP_015714151 . "hypothetical protein [Bacillus subtilis]" . . . . . 93.89 123 97.56 97.56 1.85e-80 . . . . 16113 1 21 no REF WP_017696991 . "hypothetical protein [Bacillus subtilis]" . . . . . 93.89 123 98.37 98.37 4.84e-81 . . . . 16113 1 22 no SP P50833 . "RecName: Full=Uncharacterized protein YppE" . . . . . 93.89 123 100.00 100.00 5.89e-83 . . . . 16113 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . MET . 16113 1 2 . LEU . 16113 1 3 . SER . 16113 1 4 . GLN . 16113 1 5 . THR . 16113 1 6 . LEU . 16113 1 7 . LEU . 16113 1 8 . GLU . 16113 1 9 . MET . 16113 1 10 . THR . 16113 1 11 . GLU . 16113 1 12 . GLN . 16113 1 13 . MET . 16113 1 14 . ILE . 16113 1 15 . GLU . 16113 1 16 . VAL . 16113 1 17 . ALA . 16113 1 18 . GLU . 16113 1 19 . LYS . 16113 1 20 . GLY . 16113 1 21 . ALA . 16113 1 22 . ASP . 16113 1 23 . ARG . 16113 1 24 . TYR . 16113 1 25 . GLN . 16113 1 26 . GLU . 16113 1 27 . GLY . 16113 1 28 . LYS . 16113 1 29 . ASN . 16113 1 30 . SER . 16113 1 31 . ASN . 16113 1 32 . HIS . 16113 1 33 . SER . 16113 1 34 . TYR . 16113 1 35 . ASP . 16113 1 36 . PHE . 16113 1 37 . PHE . 16113 1 38 . GLU . 16113 1 39 . THR . 16113 1 40 . ILE . 16113 1 41 . LYS . 16113 1 42 . PRO . 16113 1 43 . ALA . 16113 1 44 . VAL . 16113 1 45 . GLU . 16113 1 46 . GLU . 16113 1 47 . ASN . 16113 1 48 . ASP . 16113 1 49 . GLU . 16113 1 50 . LEU . 16113 1 51 . ALA . 16113 1 52 . ALA . 16113 1 53 . ARG . 16113 1 54 . TRP . 16113 1 55 . ALA . 16113 1 56 . GLU . 16113 1 57 . GLY . 16113 1 58 . ALA . 16113 1 59 . LEU . 16113 1 60 . GLU . 16113 1 61 . LEU . 16113 1 62 . ILE . 16113 1 63 . LYS . 16113 1 64 . VAL . 16113 1 65 . ARG . 16113 1 66 . ARG . 16113 1 67 . PRO . 16113 1 68 . LYS . 16113 1 69 . TYR . 16113 1 70 . VAL . 16113 1 71 . HIS . 16113 1 72 . LYS . 16113 1 73 . GLU . 16113 1 74 . GLN . 16113 1 75 . ILE . 16113 1 76 . GLU . 16113 1 77 . ALA . 16113 1 78 . VAL . 16113 1 79 . LYS . 16113 1 80 . ASP . 16113 1 81 . ASN . 16113 1 82 . PHE . 16113 1 83 . LEU . 16113 1 84 . GLU . 16113 1 85 . LEU . 16113 1 86 . VAL . 16113 1 87 . LEU . 16113 1 88 . GLN . 16113 1 89 . SER . 16113 1 90 . TYR . 16113 1 91 . VAL . 16113 1 92 . HIS . 16113 1 93 . HIS . 16113 1 94 . ILE . 16113 1 95 . HIS . 16113 1 96 . LYS . 16113 1 97 . LYS . 16113 1 98 . ARG . 16113 1 99 . PHE . 16113 1 100 . LYS . 16113 1 101 . ASP . 16113 1 102 . ILE . 16113 1 103 . THR . 16113 1 104 . GLU . 16113 1 105 . SER . 16113 1 106 . VAL . 16113 1 107 . LEU . 16113 1 108 . TYR . 16113 1 109 . THR . 16113 1 110 . LEU . 16113 1 111 . HIS . 16113 1 112 . ALA . 16113 1 113 . VAL . 16113 1 114 . LYS . 16113 1 115 . ASP . 16113 1 116 . GLU . 16113 1 117 . ILE . 16113 1 118 . ALA . 16113 1 119 . ARG . 16113 1 120 . GLU . 16113 1 121 . ASP . 16113 1 122 . SER . 16113 1 123 . ARG . 16113 1 124 . LEU . 16113 1 125 . GLU . 16113 1 126 . HIS . 16113 1 127 . HIS . 16113 1 128 . HIS . 16113 1 129 . HIS . 16113 1 130 . HIS . 16113 1 131 . HIS . 16113 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 16113 1 . LEU 2 2 16113 1 . SER 3 3 16113 1 . GLN 4 4 16113 1 . THR 5 5 16113 1 . LEU 6 6 16113 1 . LEU 7 7 16113 1 . GLU 8 8 16113 1 . MET 9 9 16113 1 . THR 10 10 16113 1 . GLU 11 11 16113 1 . GLN 12 12 16113 1 . MET 13 13 16113 1 . ILE 14 14 16113 1 . GLU 15 15 16113 1 . VAL 16 16 16113 1 . ALA 17 17 16113 1 . GLU 18 18 16113 1 . LYS 19 19 16113 1 . GLY 20 20 16113 1 . ALA 21 21 16113 1 . ASP 22 22 16113 1 . ARG 23 23 16113 1 . TYR 24 24 16113 1 . GLN 25 25 16113 1 . GLU 26 26 16113 1 . GLY 27 27 16113 1 . LYS 28 28 16113 1 . ASN 29 29 16113 1 . SER 30 30 16113 1 . ASN 31 31 16113 1 . HIS 32 32 16113 1 . SER 33 33 16113 1 . TYR 34 34 16113 1 . ASP 35 35 16113 1 . PHE 36 36 16113 1 . PHE 37 37 16113 1 . GLU 38 38 16113 1 . THR 39 39 16113 1 . ILE 40 40 16113 1 . LYS 41 41 16113 1 . PRO 42 42 16113 1 . ALA 43 43 16113 1 . VAL 44 44 16113 1 . GLU 45 45 16113 1 . GLU 46 46 16113 1 . ASN 47 47 16113 1 . ASP 48 48 16113 1 . GLU 49 49 16113 1 . LEU 50 50 16113 1 . ALA 51 51 16113 1 . ALA 52 52 16113 1 . ARG 53 53 16113 1 . TRP 54 54 16113 1 . ALA 55 55 16113 1 . GLU 56 56 16113 1 . GLY 57 57 16113 1 . ALA 58 58 16113 1 . LEU 59 59 16113 1 . GLU 60 60 16113 1 . LEU 61 61 16113 1 . ILE 62 62 16113 1 . LYS 63 63 16113 1 . VAL 64 64 16113 1 . ARG 65 65 16113 1 . ARG 66 66 16113 1 . PRO 67 67 16113 1 . LYS 68 68 16113 1 . TYR 69 69 16113 1 . VAL 70 70 16113 1 . HIS 71 71 16113 1 . LYS 72 72 16113 1 . GLU 73 73 16113 1 . GLN 74 74 16113 1 . ILE 75 75 16113 1 . GLU 76 76 16113 1 . ALA 77 77 16113 1 . VAL 78 78 16113 1 . LYS 79 79 16113 1 . ASP 80 80 16113 1 . ASN 81 81 16113 1 . PHE 82 82 16113 1 . LEU 83 83 16113 1 . GLU 84 84 16113 1 . LEU 85 85 16113 1 . VAL 86 86 16113 1 . LEU 87 87 16113 1 . GLN 88 88 16113 1 . SER 89 89 16113 1 . TYR 90 90 16113 1 . VAL 91 91 16113 1 . HIS 92 92 16113 1 . HIS 93 93 16113 1 . ILE 94 94 16113 1 . HIS 95 95 16113 1 . LYS 96 96 16113 1 . LYS 97 97 16113 1 . ARG 98 98 16113 1 . PHE 99 99 16113 1 . LYS 100 100 16113 1 . ASP 101 101 16113 1 . ILE 102 102 16113 1 . THR 103 103 16113 1 . GLU 104 104 16113 1 . SER 105 105 16113 1 . VAL 106 106 16113 1 . LEU 107 107 16113 1 . TYR 108 108 16113 1 . THR 109 109 16113 1 . LEU 110 110 16113 1 . HIS 111 111 16113 1 . ALA 112 112 16113 1 . VAL 113 113 16113 1 . LYS 114 114 16113 1 . ASP 115 115 16113 1 . GLU 116 116 16113 1 . ILE 117 117 16113 1 . ALA 118 118 16113 1 . ARG 119 119 16113 1 . GLU 120 120 16113 1 . ASP 121 121 16113 1 . SER 122 122 16113 1 . ARG 123 123 16113 1 . LEU 124 124 16113 1 . GLU 125 125 16113 1 . HIS 126 126 16113 1 . HIS 127 127 16113 1 . HIS 128 128 16113 1 . HIS 129 129 16113 1 . HIS 130 130 16113 1 . HIS 131 131 16113 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 16113 _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 $yppe . 1423 organism . 'Bacillus subtilis' 'Bacillus subtilis' . . Bacteria . Bacillus subtilis . . . . . . . . . . . . . . . . . . . . . 16113 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 16113 _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 $yppe . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . . . . . . . . . . . 'pET 21-23C' . . . . . . 16113 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 16113 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details 'MC2023 -- 1X protease inhibitors, 10mM DTT, 50mM Arginine, 50mM Bis-Tris pH 6.5, 10% D2O, 50uM DSS, 0.02% NaN3' _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 yppe 'natural abundance' . . 1 $yppe . . 0.94 . . mM . . . . 16113 1 2 DTT 'natural abundance' . . . . . . 10 . . mM . . . . 16113 1 3 Arginine 'natural abundance' . . . . . . 50 . . mM . . . . 16113 1 4 'Bis-Tris pH 6.5' 'natural abundance' . . . . . . 50 . . mM . . . . 16113 1 5 DSS 'natural abundance' . . . . . . 50 . . uM . . . . 16113 1 6 NaN3 'natural abundance' . . . . . . 0.02 . . % . . . . 16113 1 7 H2O 'natural abundance' . . . . . . 95 . . % . . . . 16113 1 8 D2O 'natural abundance' . . . . . . 5 . . % . . . . 16113 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 16113 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 6.5 . pH 16113 1 pressure 1 . atm 16113 1 temperature 298 . K 16113 1 stop_ save_ ############################ # Computer software used # ############################ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 16113 _Software.ID 1 _Software.Name CYANA _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . 16113 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'geometry optimization' 16113 1 refinement 16113 1 'structure solution' 16113 1 stop_ save_ save_AutoStructure _Software.Sf_category software _Software.Sf_framecode AutoStructure _Software.Entry_ID 16113 _Software.ID 2 _Software.Name AutoStruct _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Huang, Tejero, Powers and Montelione' . . 16113 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 16113 2 refinement 16113 2 stop_ save_ save_XEASY _Software.Sf_category software _Software.Sf_framecode XEASY _Software.Entry_ID 16113 _Software.ID 3 _Software.Name XEASY _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bartels et al.' . . 16113 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 16113 3 'peak picking' 16113 3 refinement 16113 3 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 16113 _Software.ID 4 _Software.Name NMRPipe _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 16113 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 16113 4 stop_ save_ save_VNMR _Software.Sf_category software _Software.Sf_framecode VNMR _Software.Entry_ID 16113 _Software.ID 5 _Software.Name VNMR _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Varian . . 16113 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 16113 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 16113 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 750 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 16113 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 16113 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Varian INOVA . 750 . . . 16113 1 2 spectrometer_2 Varian INOVA . 600 . . . 16113 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 16113 _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 'SIMULTANEOUS HETERONUCLEAR RESOLVED [1H,1H]-NOESY' yes . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16113 1 2 'GFT (4,3)D HNNCABCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 16113 1 3 'GFT (4,3)D CABCA(CO)NHN' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 16113 1 4 'GFT (4,3) HCCH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 16113 1 5 HNCACB no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16113 1 6 HABCONH no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16113 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 16113 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 . indirect 0.251449530 . . . 1 $entry_citation . . 1 $entry_citation 16113 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . 1 $entry_citation . . 1 $entry_citation 16113 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 . indirect 0.101329118 . . . 1 $entry_citation . . 1 $entry_citation 16113 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 16113 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 'SIMULTANEOUS HETERONUCLEAR RESOLVED [1H,1H]-NOESY' . . . 16113 1 2 'GFT (4,3)D HNNCABCA' . . . 16113 1 3 'GFT (4,3)D CABCA(CO)NHN' . . . 16113 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 3 $XEASY . . 16113 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 6 6 LEU HA H 1 4.23 . . 1 . . . . 6 LEU HA . 16113 1 2 . 1 1 6 6 LEU HB2 H 1 1.44 . . 2 . . . . 6 LEU HB2 . 16113 1 3 . 1 1 6 6 LEU HB3 H 1 1.79 . . 2 . . . . 6 LEU HB3 . 16113 1 4 . 1 1 6 6 LEU HD11 H 1 0.66 . . 2 . . . . 6 LEU HD1 . 16113 1 5 . 1 1 6 6 LEU HD12 H 1 0.66 . . 2 . . . . 6 LEU HD1 . 16113 1 6 . 1 1 6 6 LEU HD13 H 1 0.66 . . 2 . . . . 6 LEU HD1 . 16113 1 7 . 1 1 6 6 LEU HD21 H 1 0.58 . . 2 . . . . 6 LEU HD2 . 16113 1 8 . 1 1 6 6 LEU HD22 H 1 0.58 . . 2 . . . . 6 LEU HD2 . 16113 1 9 . 1 1 6 6 LEU HD23 H 1 0.58 . . 2 . . . . 6 LEU HD2 . 16113 1 10 . 1 1 6 6 LEU HG H 1 1.37 . . 1 . . . . 6 LEU HG . 16113 1 11 . 1 1 6 6 LEU CA C 13 58.0 . . 1 . . . . 6 LEU CA . 16113 1 12 . 1 1 6 6 LEU CB C 13 40.9 . . 1 . . . . 6 LEU CB . 16113 1 13 . 1 1 6 6 LEU CD1 C 13 26.5 . . 1 . . . . 6 LEU CD1 . 16113 1 14 . 1 1 6 6 LEU CD2 C 13 23.9 . . 1 . . . . 6 LEU CD2 . 16113 1 15 . 1 1 6 6 LEU CG C 13 26.5 . . 1 . . . . 6 LEU CG . 16113 1 16 . 1 1 7 7 LEU H H 1 8.97 . . 1 . . . . 7 LEU H . 16113 1 17 . 1 1 7 7 LEU HA H 1 3.97 . . 1 . . . . 7 LEU HA . 16113 1 18 . 1 1 7 7 LEU HB2 H 1 1.64 . . 2 . . . . 7 LEU HB2 . 16113 1 19 . 1 1 7 7 LEU HB3 H 1 1.91 . . 2 . . . . 7 LEU HB3 . 16113 1 20 . 1 1 7 7 LEU HD11 H 1 0.96 . . 2 . . . . 7 LEU HD1 . 16113 1 21 . 1 1 7 7 LEU HD12 H 1 0.96 . . 2 . . . . 7 LEU HD1 . 16113 1 22 . 1 1 7 7 LEU HD13 H 1 0.96 . . 2 . . . . 7 LEU HD1 . 16113 1 23 . 1 1 7 7 LEU HD21 H 1 0.94 . . 2 . . . . 7 LEU HD2 . 16113 1 24 . 1 1 7 7 LEU HD22 H 1 0.94 . . 2 . . . . 7 LEU HD2 . 16113 1 25 . 1 1 7 7 LEU HD23 H 1 0.94 . . 2 . . . . 7 LEU HD2 . 16113 1 26 . 1 1 7 7 LEU HG H 1 1.62 . . 1 . . . . 7 LEU HG . 16113 1 27 . 1 1 7 7 LEU CA C 13 58.5 . . 1 . . . . 7 LEU CA . 16113 1 28 . 1 1 7 7 LEU CB C 13 41.0 . . 1 . . . . 7 LEU CB . 16113 1 29 . 1 1 7 7 LEU CD1 C 13 25.5 . . 1 . . . . 7 LEU CD1 . 16113 1 30 . 1 1 7 7 LEU CD2 C 13 23.0 . . 1 . . . . 7 LEU CD2 . 16113 1 31 . 1 1 7 7 LEU CG C 13 26.8 . . 1 . . . . 7 LEU CG . 16113 1 32 . 1 1 7 7 LEU N N 15 124.3 . . 1 . . . . 7 LEU N . 16113 1 33 . 1 1 8 8 GLU H H 1 7.91 . . 1 . . . . 8 GLU H . 16113 1 34 . 1 1 8 8 GLU HA H 1 4.04 . . 1 . . . . 8 GLU HA . 16113 1 35 . 1 1 8 8 GLU HB2 H 1 2.05 . . 2 . . . . 8 GLU HB2 . 16113 1 36 . 1 1 8 8 GLU HB3 H 1 2.31 . . 2 . . . . 8 GLU HB3 . 16113 1 37 . 1 1 8 8 GLU HG2 H 1 2.29 . . 2 . . . . 8 GLU HG2 . 16113 1 38 . 1 1 8 8 GLU HG3 H 1 2.40 . . 2 . . . . 8 GLU HG3 . 16113 1 39 . 1 1 8 8 GLU CA C 13 59.5 . . 1 . . . . 8 GLU CA . 16113 1 40 . 1 1 8 8 GLU CB C 13 29.2 . . 1 . . . . 8 GLU CB . 16113 1 41 . 1 1 8 8 GLU CG C 13 36.8 . . 1 . . . . 8 GLU CG . 16113 1 42 . 1 1 8 8 GLU N N 15 119.0 . . 1 . . . . 8 GLU N . 16113 1 43 . 1 1 9 9 MET H H 1 8.52 . . 1 . . . . 9 MET H . 16113 1 44 . 1 1 9 9 MET HA H 1 4.03 . . 1 . . . . 9 MET HA . 16113 1 45 . 1 1 9 9 MET HB2 H 1 2.52 . . 2 . . . . 9 MET HB2 . 16113 1 46 . 1 1 9 9 MET HB3 H 1 2.52 . . 2 . . . . 9 MET HB3 . 16113 1 47 . 1 1 9 9 MET HE1 H 1 2.00 . . 1 . . . . 9 MET HE . 16113 1 48 . 1 1 9 9 MET HE2 H 1 2.00 . . 1 . . . . 9 MET HE . 16113 1 49 . 1 1 9 9 MET HE3 H 1 2.00 . . 1 . . . . 9 MET HE . 16113 1 50 . 1 1 9 9 MET HG2 H 1 2.42 . . 2 . . . . 9 MET HG2 . 16113 1 51 . 1 1 9 9 MET HG3 H 1 2.78 . . 2 . . . . 9 MET HG3 . 16113 1 52 . 1 1 9 9 MET CA C 13 59.9 . . 1 . . . . 9 MET CA . 16113 1 53 . 1 1 9 9 MET CB C 13 36.0 . . 1 . . . . 9 MET CB . 16113 1 54 . 1 1 9 9 MET CE C 13 17.6 . . 1 . . . . 9 MET CE . 16113 1 55 . 1 1 9 9 MET CG C 13 32.9 . . 1 . . . . 9 MET CG . 16113 1 56 . 1 1 9 9 MET N N 15 117.5 . . 1 . . . . 9 MET N . 16113 1 57 . 1 1 10 10 THR H H 1 8.47 . . 1 . . . . 10 THR H . 16113 1 58 . 1 1 10 10 THR HA H 1 3.55 . . 1 . . . . 10 THR HA . 16113 1 59 . 1 1 10 10 THR HB H 1 4.49 . . 1 . . . . 10 THR HB . 16113 1 60 . 1 1 10 10 THR HG1 H 1 5.21 . . 1 . . . . 10 THR HG1 . 16113 1 61 . 1 1 10 10 THR HG21 H 1 1.21 . . 1 . . . . 10 THR HG2 . 16113 1 62 . 1 1 10 10 THR HG22 H 1 1.21 . . 1 . . . . 10 THR HG2 . 16113 1 63 . 1 1 10 10 THR HG23 H 1 1.21 . . 1 . . . . 10 THR HG2 . 16113 1 64 . 1 1 10 10 THR CA C 13 67.2 . . 1 . . . . 10 THR CA . 16113 1 65 . 1 1 10 10 THR CB C 13 68.5 . . 1 . . . . 10 THR CB . 16113 1 66 . 1 1 10 10 THR CG2 C 13 22.6 . . 1 . . . . 10 THR CG2 . 16113 1 67 . 1 1 10 10 THR N N 15 116.6 . . 1 . . . . 10 THR N . 16113 1 68 . 1 1 11 11 GLU H H 1 8.50 . . 1 . . . . 11 GLU H . 16113 1 69 . 1 1 11 11 GLU HA H 1 3.91 . . 1 . . . . 11 GLU HA . 16113 1 70 . 1 1 11 11 GLU HB2 H 1 2.08 . . 2 . . . . 11 GLU HB2 . 16113 1 71 . 1 1 11 11 GLU HB3 H 1 1.97 . . 2 . . . . 11 GLU HB3 . 16113 1 72 . 1 1 11 11 GLU HG2 H 1 2.06 . . 2 . . . . 11 GLU HG2 . 16113 1 73 . 1 1 11 11 GLU HG3 H 1 2.46 . . 2 . . . . 11 GLU HG3 . 16113 1 74 . 1 1 11 11 GLU CA C 13 59.4 . . 1 . . . . 11 GLU CA . 16113 1 75 . 1 1 11 11 GLU CB C 13 29.2 . . 1 . . . . 11 GLU CB . 16113 1 76 . 1 1 11 11 GLU CG C 13 36.8 . . 1 . . . . 11 GLU CG . 16113 1 77 . 1 1 11 11 GLU N N 15 119.4 . . 1 . . . . 11 GLU N . 16113 1 78 . 1 1 12 12 GLN H H 1 8.14 . . 1 . . . . 12 GLN H . 16113 1 79 . 1 1 12 12 GLN HA H 1 4.10 . . 1 . . . . 12 GLN HA . 16113 1 80 . 1 1 12 12 GLN HB2 H 1 2.09 . . 2 . . . . 12 GLN HB2 . 16113 1 81 . 1 1 12 12 GLN HB3 H 1 2.26 . . 2 . . . . 12 GLN HB3 . 16113 1 82 . 1 1 12 12 GLN HE21 H 1 7.34 . . 2 . . . . 12 GLN HE21 . 16113 1 83 . 1 1 12 12 GLN HE22 H 1 6.70 . . 2 . . . . 12 GLN HE22 . 16113 1 84 . 1 1 12 12 GLN HG2 H 1 2.32 . . 2 . . . . 12 GLN HG2 . 16113 1 85 . 1 1 12 12 GLN HG3 H 1 2.50 . . 2 . . . . 12 GLN HG3 . 16113 1 86 . 1 1 12 12 GLN CA C 13 59.0 . . 1 . . . . 12 GLN CA . 16113 1 87 . 1 1 12 12 GLN CB C 13 27.8 . . 1 . . . . 12 GLN CB . 16113 1 88 . 1 1 12 12 GLN CG C 13 33.7 . . 1 . . . . 12 GLN CG . 16113 1 89 . 1 1 12 12 GLN N N 15 120.4 . . 1 . . . . 12 GLN N . 16113 1 90 . 1 1 12 12 GLN NE2 N 15 110.1 . . 1 . . . . 12 GLN NE2 . 16113 1 91 . 1 1 13 13 MET H H 1 8.12 . . 1 . . . . 13 MET H . 16113 1 92 . 1 1 13 13 MET HA H 1 3.71 . . 1 . . . . 13 MET HA . 16113 1 93 . 1 1 13 13 MET HB2 H 1 1.20 . . 2 . . . . 13 MET HB2 . 16113 1 94 . 1 1 13 13 MET HB3 H 1 1.61 . . 2 . . . . 13 MET HB3 . 16113 1 95 . 1 1 13 13 MET HE1 H 1 0.30 . . 1 . . . . 13 MET HE . 16113 1 96 . 1 1 13 13 MET HE2 H 1 0.30 . . 1 . . . . 13 MET HE . 16113 1 97 . 1 1 13 13 MET HE3 H 1 0.30 . . 1 . . . . 13 MET HE . 16113 1 98 . 1 1 13 13 MET HG2 H 1 1.20 . . 2 . . . . 13 MET HG2 . 16113 1 99 . 1 1 13 13 MET HG3 H 1 1.20 . . 2 . . . . 13 MET HG3 . 16113 1 100 . 1 1 13 13 MET CA C 13 59.6 . . 1 . . . . 13 MET CA . 16113 1 101 . 1 1 13 13 MET CB C 13 33.3 . . 1 . . . . 13 MET CB . 16113 1 102 . 1 1 13 13 MET CE C 13 14.2 . . 1 . . . . 13 MET CE . 16113 1 103 . 1 1 13 13 MET CG C 13 33.4 . . 1 . . . . 13 MET CG . 16113 1 104 . 1 1 13 13 MET N N 15 118.5 . . 1 . . . . 13 MET N . 16113 1 105 . 1 1 14 14 ILE H H 1 8.04 . . 1 . . . . 14 ILE H . 16113 1 106 . 1 1 14 14 ILE HA H 1 3.27 . . 1 . . . . 14 ILE HA . 16113 1 107 . 1 1 14 14 ILE HB H 1 1.75 . . 1 . . . . 14 ILE HB . 16113 1 108 . 1 1 14 14 ILE HD11 H 1 0.22 . . 1 . . . . 14 ILE HD1 . 16113 1 109 . 1 1 14 14 ILE HD12 H 1 0.22 . . 1 . . . . 14 ILE HD1 . 16113 1 110 . 1 1 14 14 ILE HD13 H 1 0.22 . . 1 . . . . 14 ILE HD1 . 16113 1 111 . 1 1 14 14 ILE HG12 H 1 1.53 . . 2 . . . . 14 ILE HG12 . 16113 1 112 . 1 1 14 14 ILE HG13 H 1 1.53 . . 2 . . . . 14 ILE HG13 . 16113 1 113 . 1 1 14 14 ILE HG21 H 1 0.80 . . 1 . . . . 14 ILE HG2 . 16113 1 114 . 1 1 14 14 ILE HG22 H 1 0.80 . . 1 . . . . 14 ILE HG2 . 16113 1 115 . 1 1 14 14 ILE HG23 H 1 0.80 . . 1 . . . . 14 ILE HG2 . 16113 1 116 . 1 1 14 14 ILE CA C 13 65.7 . . 1 . . . . 14 ILE CA . 16113 1 117 . 1 1 14 14 ILE CB C 13 38.0 . . 1 . . . . 14 ILE CB . 16113 1 118 . 1 1 14 14 ILE CD1 C 13 12.6 . . 1 . . . . 14 ILE CD1 . 16113 1 119 . 1 1 14 14 ILE CG1 C 13 29.6 . . 1 . . . . 14 ILE CG1 . 16113 1 120 . 1 1 14 14 ILE CG2 C 13 16.7 . . 1 . . . . 14 ILE CG2 . 16113 1 121 . 1 1 14 14 ILE N N 15 119.4 . . 1 . . . . 14 ILE N . 16113 1 122 . 1 1 15 15 GLU H H 1 7.70 . . 1 . . . . 15 GLU H . 16113 1 123 . 1 1 15 15 GLU HA H 1 4.11 . . 1 . . . . 15 GLU HA . 16113 1 124 . 1 1 15 15 GLU HB2 H 1 2.07 . . 2 . . . . 15 GLU HB2 . 16113 1 125 . 1 1 15 15 GLU HB3 H 1 2.16 . . 2 . . . . 15 GLU HB3 . 16113 1 126 . 1 1 15 15 GLU HG2 H 1 2.21 . . 2 . . . . 15 GLU HG2 . 16113 1 127 . 1 1 15 15 GLU HG3 H 1 2.38 . . 2 . . . . 15 GLU HG3 . 16113 1 128 . 1 1 15 15 GLU CA C 13 59.3 . . 1 . . . . 15 GLU CA . 16113 1 129 . 1 1 15 15 GLU CB C 13 29.2 . . 1 . . . . 15 GLU CB . 16113 1 130 . 1 1 15 15 GLU CG C 13 36.4 . . 1 . . . . 15 GLU CG . 16113 1 131 . 1 1 15 15 GLU N N 15 119.0 . . 1 . . . . 15 GLU N . 16113 1 132 . 1 1 16 16 VAL H H 1 8.41 . . 1 . . . . 16 VAL H . 16113 1 133 . 1 1 16 16 VAL HA H 1 3.53 . . 1 . . . . 16 VAL HA . 16113 1 134 . 1 1 16 16 VAL HB H 1 2.29 . . 1 . . . . 16 VAL HB . 16113 1 135 . 1 1 16 16 VAL HG11 H 1 0.78 . . 2 . . . . 16 VAL HG1 . 16113 1 136 . 1 1 16 16 VAL HG12 H 1 0.78 . . 2 . . . . 16 VAL HG1 . 16113 1 137 . 1 1 16 16 VAL HG13 H 1 0.78 . . 2 . . . . 16 VAL HG1 . 16113 1 138 . 1 1 16 16 VAL HG21 H 1 1.24 . . 2 . . . . 16 VAL HG2 . 16113 1 139 . 1 1 16 16 VAL HG22 H 1 1.24 . . 2 . . . . 16 VAL HG2 . 16113 1 140 . 1 1 16 16 VAL HG23 H 1 1.24 . . 2 . . . . 16 VAL HG2 . 16113 1 141 . 1 1 16 16 VAL CA C 13 66.6 . . 1 . . . . 16 VAL CA . 16113 1 142 . 1 1 16 16 VAL CB C 13 31.9 . . 1 . . . . 16 VAL CB . 16113 1 143 . 1 1 16 16 VAL CG1 C 13 22.9 . . 1 . . . . 16 VAL CG1 . 16113 1 144 . 1 1 16 16 VAL CG2 C 13 21.8 . . 1 . . . . 16 VAL CG2 . 16113 1 145 . 1 1 16 16 VAL N N 15 119.5 . . 1 . . . . 16 VAL N . 16113 1 146 . 1 1 17 17 ALA H H 1 8.60 . . 1 . . . . 17 ALA H . 16113 1 147 . 1 1 17 17 ALA HA H 1 4.08 . . 1 . . . . 17 ALA HA . 16113 1 148 . 1 1 17 17 ALA HB1 H 1 1.45 . . 1 . . . . 17 ALA HB . 16113 1 149 . 1 1 17 17 ALA HB2 H 1 1.45 . . 1 . . . . 17 ALA HB . 16113 1 150 . 1 1 17 17 ALA HB3 H 1 1.45 . . 1 . . . . 17 ALA HB . 16113 1 151 . 1 1 17 17 ALA CA C 13 54.7 . . 1 . . . . 17 ALA CA . 16113 1 152 . 1 1 17 17 ALA CB C 13 17.7 . . 1 . . . . 17 ALA CB . 16113 1 153 . 1 1 17 17 ALA N N 15 123.1 . . 1 . . . . 17 ALA N . 16113 1 154 . 1 1 18 18 GLU H H 1 8.85 . . 1 . . . . 18 GLU H . 16113 1 155 . 1 1 18 18 GLU HA H 1 3.99 . . 1 . . . . 18 GLU HA . 16113 1 156 . 1 1 18 18 GLU HB2 H 1 2.23 . . 2 . . . . 18 GLU HB2 . 16113 1 157 . 1 1 18 18 GLU HB3 H 1 1.96 . . 2 . . . . 18 GLU HB3 . 16113 1 158 . 1 1 18 18 GLU HG2 H 1 2.14 . . 2 . . . . 18 GLU HG2 . 16113 1 159 . 1 1 18 18 GLU HG3 H 1 2.68 . . 2 . . . . 18 GLU HG3 . 16113 1 160 . 1 1 18 18 GLU CA C 13 59.5 . . 1 . . . . 18 GLU CA . 16113 1 161 . 1 1 18 18 GLU CB C 13 29.7 . . 1 . . . . 18 GLU CB . 16113 1 162 . 1 1 18 18 GLU CG C 13 37.3 . . 1 . . . . 18 GLU CG . 16113 1 163 . 1 1 18 18 GLU N N 15 117.9 . . 1 . . . . 18 GLU N . 16113 1 164 . 1 1 19 19 LYS H H 1 8.75 . . 1 . . . . 19 LYS H . 16113 1 165 . 1 1 19 19 LYS HA H 1 4.15 . . 1 . . . . 19 LYS HA . 16113 1 166 . 1 1 19 19 LYS HB2 H 1 2.00 . . 2 . . . . 19 LYS HB2 . 16113 1 167 . 1 1 19 19 LYS HB3 H 1 1.74 . . 2 . . . . 19 LYS HB3 . 16113 1 168 . 1 1 19 19 LYS HD2 H 1 1.67 . . 2 . . . . 19 LYS HD2 . 16113 1 169 . 1 1 19 19 LYS HD3 H 1 1.67 . . 2 . . . . 19 LYS HD3 . 16113 1 170 . 1 1 19 19 LYS HE2 H 1 2.96 . . 2 . . . . 19 LYS HE2 . 16113 1 171 . 1 1 19 19 LYS HE3 H 1 2.96 . . 2 . . . . 19 LYS HE3 . 16113 1 172 . 1 1 19 19 LYS HG2 H 1 1.54 . . 2 . . . . 19 LYS HG2 . 16113 1 173 . 1 1 19 19 LYS HG3 H 1 1.69 . . 2 . . . . 19 LYS HG3 . 16113 1 174 . 1 1 19 19 LYS CA C 13 58.7 . . 1 . . . . 19 LYS CA . 16113 1 175 . 1 1 19 19 LYS CB C 13 31.9 . . 1 . . . . 19 LYS CB . 16113 1 176 . 1 1 19 19 LYS CD C 13 28.8 . . 1 . . . . 19 LYS CD . 16113 1 177 . 1 1 19 19 LYS CE C 13 42.1 . . 1 . . . . 19 LYS CE . 16113 1 178 . 1 1 19 19 LYS CG C 13 25.7 . . 1 . . . . 19 LYS CG . 16113 1 179 . 1 1 19 19 LYS N N 15 119.2 . . 1 . . . . 19 LYS N . 16113 1 180 . 1 1 20 20 GLY H H 1 8.64 . . 1 . . . . 20 GLY H . 16113 1 181 . 1 1 20 20 GLY HA2 H 1 3.79 . . 2 . . . . 20 GLY HA2 . 16113 1 182 . 1 1 20 20 GLY HA3 H 1 3.50 . . 2 . . . . 20 GLY HA3 . 16113 1 183 . 1 1 20 20 GLY CA C 13 46.4 . . 1 . . . . 20 GLY CA . 16113 1 184 . 1 1 20 20 GLY N N 15 110.3 . . 1 . . . . 20 GLY N . 16113 1 185 . 1 1 21 21 ALA H H 1 8.55 . . 1 . . . . 21 ALA H . 16113 1 186 . 1 1 21 21 ALA HA H 1 4.49 . . 1 . . . . 21 ALA HA . 16113 1 187 . 1 1 21 21 ALA HB1 H 1 1.68 . . 1 . . . . 21 ALA HB . 16113 1 188 . 1 1 21 21 ALA HB2 H 1 1.68 . . 1 . . . . 21 ALA HB . 16113 1 189 . 1 1 21 21 ALA HB3 H 1 1.68 . . 1 . . . . 21 ALA HB . 16113 1 190 . 1 1 21 21 ALA CA C 13 55.1 . . 1 . . . . 21 ALA CA . 16113 1 191 . 1 1 21 21 ALA CB C 13 17.3 . . 1 . . . . 21 ALA CB . 16113 1 192 . 1 1 21 21 ALA N N 15 125.3 . . 1 . . . . 21 ALA N . 16113 1 193 . 1 1 22 22 ASP H H 1 7.66 . . 1 . . . . 22 ASP H . 16113 1 194 . 1 1 22 22 ASP HA H 1 4.46 . . 1 . . . . 22 ASP HA . 16113 1 195 . 1 1 22 22 ASP HB2 H 1 2.72 . . 2 . . . . 22 ASP HB2 . 16113 1 196 . 1 1 22 22 ASP HB3 H 1 2.72 . . 2 . . . . 22 ASP HB3 . 16113 1 197 . 1 1 22 22 ASP CA C 13 56.9 . . 1 . . . . 22 ASP CA . 16113 1 198 . 1 1 22 22 ASP CB C 13 40.5 . . 1 . . . . 22 ASP CB . 16113 1 199 . 1 1 22 22 ASP N N 15 119.0 . . 1 . . . . 22 ASP N . 16113 1 200 . 1 1 23 23 ARG H H 1 8.11 . . 1 . . . . 23 ARG H . 16113 1 201 . 1 1 23 23 ARG HA H 1 4.00 . . 1 . . . . 23 ARG HA . 16113 1 202 . 1 1 23 23 ARG HB2 H 1 1.69 . . 2 . . . . 23 ARG HB2 . 16113 1 203 . 1 1 23 23 ARG HB3 H 1 1.82 . . 2 . . . . 23 ARG HB3 . 16113 1 204 . 1 1 23 23 ARG HD2 H 1 3.16 . . 2 . . . . 23 ARG HD2 . 16113 1 205 . 1 1 23 23 ARG HD3 H 1 3.16 . . 2 . . . . 23 ARG HD3 . 16113 1 206 . 1 1 23 23 ARG HG2 H 1 1.53 . . 2 . . . . 23 ARG HG2 . 16113 1 207 . 1 1 23 23 ARG HG3 H 1 1.53 . . 2 . . . . 23 ARG HG3 . 16113 1 208 . 1 1 23 23 ARG CA C 13 59.2 . . 1 . . . . 23 ARG CA . 16113 1 209 . 1 1 23 23 ARG CB C 13 30.7 . . 1 . . . . 23 ARG CB . 16113 1 210 . 1 1 23 23 ARG CD C 13 43.1 . . 1 . . . . 23 ARG CD . 16113 1 211 . 1 1 23 23 ARG CG C 13 27.0 . . 1 . . . . 23 ARG CG . 16113 1 212 . 1 1 23 23 ARG N N 15 121.8 . . 1 . . . . 23 ARG N . 16113 1 213 . 1 1 24 24 TYR H H 1 8.46 . . 1 . . . . 24 TYR H . 16113 1 214 . 1 1 24 24 TYR HA H 1 3.78 . . 1 . . . . 24 TYR HA . 16113 1 215 . 1 1 24 24 TYR HB2 H 1 2.11 . . 2 . . . . 24 TYR HB2 . 16113 1 216 . 1 1 24 24 TYR HB3 H 1 2.39 . . 2 . . . . 24 TYR HB3 . 16113 1 217 . 1 1 24 24 TYR HD1 H 1 6.42 . . 3 . . . . 24 TYR HD1 . 16113 1 218 . 1 1 24 24 TYR HD2 H 1 6.42 . . 3 . . . . 24 TYR HD2 . 16113 1 219 . 1 1 24 24 TYR HE1 H 1 6.24 . . 3 . . . . 24 TYR HE1 . 16113 1 220 . 1 1 24 24 TYR HE2 H 1 6.24 . . 3 . . . . 24 TYR HE2 . 16113 1 221 . 1 1 24 24 TYR CA C 13 60.9 . . 1 . . . . 24 TYR CA . 16113 1 222 . 1 1 24 24 TYR CB C 13 39.4 . . 1 . . . . 24 TYR CB . 16113 1 223 . 1 1 24 24 TYR CD1 C 13 132.7 . . 1 . . . . 24 TYR CD1 . 16113 1 224 . 1 1 24 24 TYR CE1 C 13 115.5 . . 1 . . . . 24 TYR CE1 . 16113 1 225 . 1 1 24 24 TYR N N 15 120.4 . . 1 . . . . 24 TYR N . 16113 1 226 . 1 1 25 25 GLN H H 1 7.54 . . 1 . . . . 25 GLN H . 16113 1 227 . 1 1 25 25 GLN HA H 1 3.75 . . 1 . . . . 25 GLN HA . 16113 1 228 . 1 1 25 25 GLN HB2 H 1 2.16 . . 2 . . . . 25 GLN HB2 . 16113 1 229 . 1 1 25 25 GLN HB3 H 1 2.19 . . 2 . . . . 25 GLN HB3 . 16113 1 230 . 1 1 25 25 GLN HG2 H 1 2.46 . . 2 . . . . 25 GLN HG2 . 16113 1 231 . 1 1 25 25 GLN HG3 H 1 2.46 . . 2 . . . . 25 GLN HG3 . 16113 1 232 . 1 1 25 25 GLN CA C 13 57.8 . . 1 . . . . 25 GLN CA . 16113 1 233 . 1 1 25 25 GLN CB C 13 28.4 . . 1 . . . . 25 GLN CB . 16113 1 234 . 1 1 25 25 GLN CG C 13 33.5 . . 1 . . . . 25 GLN CG . 16113 1 235 . 1 1 25 25 GLN N N 15 117.5 . . 1 . . . . 25 GLN N . 16113 1 236 . 1 1 26 26 GLU H H 1 7.98 . . 1 . . . . 26 GLU H . 16113 1 237 . 1 1 26 26 GLU HA H 1 4.01 . . 1 . . . . 26 GLU HA . 16113 1 238 . 1 1 26 26 GLU HB2 H 1 2.03 . . 2 . . . . 26 GLU HB2 . 16113 1 239 . 1 1 26 26 GLU HB3 H 1 2.03 . . 2 . . . . 26 GLU HB3 . 16113 1 240 . 1 1 26 26 GLU HG2 H 1 2.24 . . 2 . . . . 26 GLU HG2 . 16113 1 241 . 1 1 26 26 GLU HG3 H 1 2.34 . . 2 . . . . 26 GLU HG3 . 16113 1 242 . 1 1 26 26 GLU CA C 13 57.9 . . 1 . . . . 26 GLU CA . 16113 1 243 . 1 1 26 26 GLU CB C 13 29.7 . . 1 . . . . 26 GLU CB . 16113 1 244 . 1 1 26 26 GLU CG C 13 36.0 . . 1 . . . . 26 GLU CG . 16113 1 245 . 1 1 26 26 GLU N N 15 117.9 . . 1 . . . . 26 GLU N . 16113 1 246 . 1 1 32 32 HIS HA H 1 4.62 . . 1 . . . . 32 HIS HA . 16113 1 247 . 1 1 32 32 HIS HB2 H 1 3.75 . . 2 . . . . 32 HIS HB2 . 16113 1 248 . 1 1 32 32 HIS HB3 H 1 3.75 . . 2 . . . . 32 HIS HB3 . 16113 1 249 . 1 1 32 32 HIS CA C 13 56.9 . . 1 . . . . 32 HIS CA . 16113 1 250 . 1 1 32 32 HIS CB C 13 64.0 . . 1 . . . . 32 HIS CB . 16113 1 251 . 1 1 33 33 SER HA H 1 4.61 . . 1 . . . . 33 SER HA . 16113 1 252 . 1 1 33 33 SER HB2 H 1 3.73 . . 2 . . . . 33 SER HB2 . 16113 1 253 . 1 1 33 33 SER HB3 H 1 3.73 . . 2 . . . . 33 SER HB3 . 16113 1 254 . 1 1 33 33 SER CA C 13 56.9 . . 1 . . . . 33 SER CA . 16113 1 255 . 1 1 33 33 SER CB C 13 64.0 . . 1 . . . . 33 SER CB . 16113 1 256 . 1 1 34 34 TYR HA H 1 4.63 . . 1 . . . . 34 TYR HA . 16113 1 257 . 1 1 34 34 TYR HB2 H 1 2.76 . . 2 . . . . 34 TYR HB2 . 16113 1 258 . 1 1 34 34 TYR HB3 H 1 2.76 . . 2 . . . . 34 TYR HB3 . 16113 1 259 . 1 1 34 34 TYR HD1 H 1 7.43 . . 3 . . . . 34 TYR HD1 . 16113 1 260 . 1 1 34 34 TYR HD2 H 1 7.43 . . 3 . . . . 34 TYR HD2 . 16113 1 261 . 1 1 34 34 TYR HE1 H 1 6.99 . . 3 . . . . 34 TYR HE1 . 16113 1 262 . 1 1 34 34 TYR HE2 H 1 6.99 . . 3 . . . . 34 TYR HE2 . 16113 1 263 . 1 1 34 34 TYR CA C 13 56.9 . . 1 . . . . 34 TYR CA . 16113 1 264 . 1 1 34 34 TYR CB C 13 40.7 . . 1 . . . . 34 TYR CB . 16113 1 265 . 1 1 34 34 TYR CD1 C 13 133.5 . . 1 . . . . 34 TYR CD1 . 16113 1 266 . 1 1 34 34 TYR CE1 C 13 117.5 . . 1 . . . . 34 TYR CE1 . 16113 1 267 . 1 1 36 36 PHE HA H 1 3.91 . . 1 . . . . 36 PHE HA . 16113 1 268 . 1 1 36 36 PHE HB2 H 1 2.63 . . 2 . . . . 36 PHE HB2 . 16113 1 269 . 1 1 36 36 PHE HB3 H 1 3.15 . . 2 . . . . 36 PHE HB3 . 16113 1 270 . 1 1 36 36 PHE HD1 H 1 6.40 . . 3 . . . . 36 PHE HD1 . 16113 1 271 . 1 1 36 36 PHE HD2 H 1 6.40 . . 3 . . . . 36 PHE HD2 . 16113 1 272 . 1 1 36 36 PHE HE1 H 1 7.04 . . 3 . . . . 36 PHE HE1 . 16113 1 273 . 1 1 36 36 PHE HE2 H 1 7.04 . . 3 . . . . 36 PHE HE2 . 16113 1 274 . 1 1 36 36 PHE HZ H 1 7.13 . . 1 . . . . 36 PHE HZ . 16113 1 275 . 1 1 36 36 PHE CA C 13 62.0 . . 1 . . . . 36 PHE CA . 16113 1 276 . 1 1 36 36 PHE CB C 13 39.2 . . 1 . . . . 36 PHE CB . 16113 1 277 . 1 1 36 36 PHE CD1 C 13 130.8 . . 1 . . . . 36 PHE CD1 . 16113 1 278 . 1 1 36 36 PHE CE1 C 13 130.5 . . 1 . . . . 36 PHE CE1 . 16113 1 279 . 1 1 36 36 PHE CZ C 13 129.1 . . 1 . . . . 36 PHE CZ . 16113 1 280 . 1 1 37 37 PHE H H 1 8.09 . . 1 . . . . 37 PHE H . 16113 1 281 . 1 1 37 37 PHE HA H 1 3.98 . . 1 . . . . 37 PHE HA . 16113 1 282 . 1 1 37 37 PHE HB2 H 1 3.13 . . 2 . . . . 37 PHE HB2 . 16113 1 283 . 1 1 37 37 PHE HB3 H 1 3.13 . . 2 . . . . 37 PHE HB3 . 16113 1 284 . 1 1 37 37 PHE HD1 H 1 7.45 . . 3 . . . . 37 PHE HD1 . 16113 1 285 . 1 1 37 37 PHE HD2 H 1 7.45 . . 3 . . . . 37 PHE HD2 . 16113 1 286 . 1 1 37 37 PHE HE1 H 1 7.47 . . 3 . . . . 37 PHE HE1 . 16113 1 287 . 1 1 37 37 PHE HE2 H 1 7.47 . . 3 . . . . 37 PHE HE2 . 16113 1 288 . 1 1 37 37 PHE HZ H 1 7.36 . . 1 . . . . 37 PHE HZ . 16113 1 289 . 1 1 37 37 PHE CA C 13 61.6 . . 1 . . . . 37 PHE CA . 16113 1 290 . 1 1 37 37 PHE CB C 13 38.6 . . 1 . . . . 37 PHE CB . 16113 1 291 . 1 1 37 37 PHE CD1 C 13 131.2 . . 1 . . . . 37 PHE CD1 . 16113 1 292 . 1 1 37 37 PHE CE1 C 13 130.6 . . 1 . . . . 37 PHE CE1 . 16113 1 293 . 1 1 37 37 PHE CZ C 13 129.3 . . 1 . . . . 37 PHE CZ . 16113 1 294 . 1 1 37 37 PHE N N 15 116.2 . . 1 . . . . 37 PHE N . 16113 1 295 . 1 1 38 38 GLU H H 1 9.00 . . 1 . . . . 38 GLU H . 16113 1 296 . 1 1 38 38 GLU HA H 1 4.13 . . 1 . . . . 38 GLU HA . 16113 1 297 . 1 1 38 38 GLU HB2 H 1 1.96 . . 2 . . . . 38 GLU HB2 . 16113 1 298 . 1 1 38 38 GLU HB3 H 1 2.06 . . 2 . . . . 38 GLU HB3 . 16113 1 299 . 1 1 38 38 GLU HG2 H 1 2.26 . . 2 . . . . 38 GLU HG2 . 16113 1 300 . 1 1 38 38 GLU HG3 H 1 2.36 . . 2 . . . . 38 GLU HG3 . 16113 1 301 . 1 1 38 38 GLU CA C 13 57.7 . . 1 . . . . 38 GLU CA . 16113 1 302 . 1 1 38 38 GLU CB C 13 30.6 . . 1 . . . . 38 GLU CB . 16113 1 303 . 1 1 38 38 GLU CG C 13 36.3 . . 1 . . . . 38 GLU CG . 16113 1 304 . 1 1 38 38 GLU N N 15 116.0 . . 1 . . . . 38 GLU N . 16113 1 305 . 1 1 39 39 THR H H 1 7.39 . . 1 . . . . 39 THR H . 16113 1 306 . 1 1 39 39 THR HA H 1 4.28 . . 1 . . . . 39 THR HA . 16113 1 307 . 1 1 39 39 THR HB H 1 4.08 . . 1 . . . . 39 THR HB . 16113 1 308 . 1 1 39 39 THR HG21 H 1 0.94 . . 1 . . . . 39 THR HG2 . 16113 1 309 . 1 1 39 39 THR HG22 H 1 0.94 . . 1 . . . . 39 THR HG2 . 16113 1 310 . 1 1 39 39 THR HG23 H 1 0.94 . . 1 . . . . 39 THR HG2 . 16113 1 311 . 1 1 39 39 THR CA C 13 64.1 . . 1 . . . . 39 THR CA . 16113 1 312 . 1 1 39 39 THR CB C 13 70.0 . . 1 . . . . 39 THR CB . 16113 1 313 . 1 1 39 39 THR CG2 C 13 22.5 . . 1 . . . . 39 THR CG2 . 16113 1 314 . 1 1 39 39 THR N N 15 110.4 . . 1 . . . . 39 THR N . 16113 1 315 . 1 1 40 40 ILE H H 1 7.25 . . 1 . . . . 40 ILE H . 16113 1 316 . 1 1 40 40 ILE HA H 1 2.57 . . 1 . . . . 40 ILE HA . 16113 1 317 . 1 1 40 40 ILE HB H 1 1.47 . . 1 . . . . 40 ILE HB . 16113 1 318 . 1 1 40 40 ILE HD11 H 1 0.77 . . 1 . . . . 40 ILE HD1 . 16113 1 319 . 1 1 40 40 ILE HD12 H 1 0.77 . . 1 . . . . 40 ILE HD1 . 16113 1 320 . 1 1 40 40 ILE HD13 H 1 0.77 . . 1 . . . . 40 ILE HD1 . 16113 1 321 . 1 1 40 40 ILE HG12 H 1 0.20 . . 2 . . . . 40 ILE HG12 . 16113 1 322 . 1 1 40 40 ILE HG13 H 1 1.13 . . 2 . . . . 40 ILE HG13 . 16113 1 323 . 1 1 40 40 ILE HG21 H 1 0.51 . . 1 . . . . 40 ILE HG2 . 16113 1 324 . 1 1 40 40 ILE HG22 H 1 0.51 . . 1 . . . . 40 ILE HG2 . 16113 1 325 . 1 1 40 40 ILE HG23 H 1 0.51 . . 1 . . . . 40 ILE HG2 . 16113 1 326 . 1 1 40 40 ILE CA C 13 65.8 . . 1 . . . . 40 ILE CA . 16113 1 327 . 1 1 40 40 ILE CB C 13 37.3 . . 1 . . . . 40 ILE CB . 16113 1 328 . 1 1 40 40 ILE CD1 C 13 13.6 . . 1 . . . . 40 ILE CD1 . 16113 1 329 . 1 1 40 40 ILE CG1 C 13 27.6 . . 1 . . . . 40 ILE CG1 . 16113 1 330 . 1 1 40 40 ILE CG2 C 13 16.6 . . 1 . . . . 40 ILE CG2 . 16113 1 331 . 1 1 40 40 ILE N N 15 120.9 . . 1 . . . . 40 ILE N . 16113 1 332 . 1 1 41 41 LYS H H 1 8.40 . . 1 . . . . 41 LYS H . 16113 1 333 . 1 1 41 41 LYS HA H 1 3.65 . . 1 . . . . 41 LYS HA . 16113 1 334 . 1 1 41 41 LYS HB2 H 1 1.60 . . 2 . . . . 41 LYS HB2 . 16113 1 335 . 1 1 41 41 LYS HB3 H 1 1.60 . . 2 . . . . 41 LYS HB3 . 16113 1 336 . 1 1 41 41 LYS CA C 13 59.0 . . 1 . . . . 41 LYS CA . 16113 1 337 . 1 1 41 41 LYS CB C 13 29.7 . . 1 . . . . 41 LYS CB . 16113 1 338 . 1 1 41 41 LYS N N 15 118.8 . . 1 . . . . 41 LYS N . 16113 1 339 . 1 1 42 42 PRO HA H 1 4.28 . . 1 . . . . 42 PRO HA . 16113 1 340 . 1 1 42 42 PRO HB2 H 1 1.63 . . 2 . . . . 42 PRO HB2 . 16113 1 341 . 1 1 42 42 PRO HB3 H 1 2.17 . . 2 . . . . 42 PRO HB3 . 16113 1 342 . 1 1 42 42 PRO HD2 H 1 2.95 . . 2 . . . . 42 PRO HD2 . 16113 1 343 . 1 1 42 42 PRO HD3 H 1 3.32 . . 2 . . . . 42 PRO HD3 . 16113 1 344 . 1 1 42 42 PRO HG2 H 1 1.75 . . 2 . . . . 42 PRO HG2 . 16113 1 345 . 1 1 42 42 PRO HG3 H 1 1.75 . . 2 . . . . 42 PRO HG3 . 16113 1 346 . 1 1 42 42 PRO CA C 13 65.3 . . 1 . . . . 42 PRO CA . 16113 1 347 . 1 1 42 42 PRO CB C 13 30.2 . . 1 . . . . 42 PRO CB . 16113 1 348 . 1 1 42 42 PRO CD C 13 49.4 . . 1 . . . . 42 PRO CD . 16113 1 349 . 1 1 42 42 PRO CG C 13 27.9 . . 1 . . . . 42 PRO CG . 16113 1 350 . 1 1 43 43 ALA H H 1 6.79 . . 1 . . . . 43 ALA H . 16113 1 351 . 1 1 43 43 ALA HA H 1 4.19 . . 1 . . . . 43 ALA HA . 16113 1 352 . 1 1 43 43 ALA HB1 H 1 1.31 . . 1 . . . . 43 ALA HB . 16113 1 353 . 1 1 43 43 ALA HB2 H 1 1.31 . . 1 . . . . 43 ALA HB . 16113 1 354 . 1 1 43 43 ALA HB3 H 1 1.31 . . 1 . . . . 43 ALA HB . 16113 1 355 . 1 1 43 43 ALA CA C 13 54.9 . . 1 . . . . 43 ALA CA . 16113 1 356 . 1 1 43 43 ALA CB C 13 18.0 . . 1 . . . . 43 ALA CB . 16113 1 357 . 1 1 43 43 ALA N N 15 119.5 . . 1 . . . . 43 ALA N . 16113 1 358 . 1 1 44 44 VAL H H 1 8.38 . . 1 . . . . 44 VAL H . 16113 1 359 . 1 1 44 44 VAL HA H 1 3.46 . . 1 . . . . 44 VAL HA . 16113 1 360 . 1 1 44 44 VAL HB H 1 2.15 . . 1 . . . . 44 VAL HB . 16113 1 361 . 1 1 44 44 VAL HG11 H 1 0.94 . . 2 . . . . 44 VAL HG1 . 16113 1 362 . 1 1 44 44 VAL HG12 H 1 0.94 . . 2 . . . . 44 VAL HG1 . 16113 1 363 . 1 1 44 44 VAL HG13 H 1 0.94 . . 2 . . . . 44 VAL HG1 . 16113 1 364 . 1 1 44 44 VAL HG21 H 1 0.91 . . 2 . . . . 44 VAL HG2 . 16113 1 365 . 1 1 44 44 VAL HG22 H 1 0.91 . . 2 . . . . 44 VAL HG2 . 16113 1 366 . 1 1 44 44 VAL HG23 H 1 0.91 . . 2 . . . . 44 VAL HG2 . 16113 1 367 . 1 1 44 44 VAL CA C 13 67.2 . . 1 . . . . 44 VAL CA . 16113 1 368 . 1 1 44 44 VAL CB C 13 31.5 . . 1 . . . . 44 VAL CB . 16113 1 369 . 1 1 44 44 VAL CG1 C 13 22.8 . . 1 . . . . 44 VAL CG1 . 16113 1 370 . 1 1 44 44 VAL CG2 C 13 21.1 . . 1 . . . . 44 VAL CG2 . 16113 1 371 . 1 1 44 44 VAL N N 15 120.5 . . 1 . . . . 44 VAL N . 16113 1 372 . 1 1 45 45 GLU H H 1 8.41 . . 1 . . . . 45 GLU H . 16113 1 373 . 1 1 45 45 GLU HA H 1 4.06 . . 1 . . . . 45 GLU HA . 16113 1 374 . 1 1 45 45 GLU HB2 H 1 2.00 . . 2 . . . . 45 GLU HB2 . 16113 1 375 . 1 1 45 45 GLU HB3 H 1 2.04 . . 2 . . . . 45 GLU HB3 . 16113 1 376 . 1 1 45 45 GLU HG2 H 1 2.26 . . 2 . . . . 45 GLU HG2 . 16113 1 377 . 1 1 45 45 GLU HG3 H 1 2.48 . . 2 . . . . 45 GLU HG3 . 16113 1 378 . 1 1 45 45 GLU CA C 13 59.6 . . 1 . . . . 45 GLU CA . 16113 1 379 . 1 1 45 45 GLU CB C 13 29.3 . . 1 . . . . 45 GLU CB . 16113 1 380 . 1 1 45 45 GLU CG C 13 36.9 . . 1 . . . . 45 GLU CG . 16113 1 381 . 1 1 45 45 GLU N N 15 118.4 . . 1 . . . . 45 GLU N . 16113 1 382 . 1 1 46 46 GLU H H 1 8.39 . . 1 . . . . 46 GLU H . 16113 1 383 . 1 1 46 46 GLU HA H 1 4.20 . . 1 . . . . 46 GLU HA . 16113 1 384 . 1 1 46 46 GLU HB2 H 1 2.03 . . 2 . . . . 46 GLU HB2 . 16113 1 385 . 1 1 46 46 GLU HB3 H 1 2.17 . . 2 . . . . 46 GLU HB3 . 16113 1 386 . 1 1 46 46 GLU HG2 H 1 2.31 . . 2 . . . . 46 GLU HG2 . 16113 1 387 . 1 1 46 46 GLU HG3 H 1 2.31 . . 2 . . . . 46 GLU HG3 . 16113 1 388 . 1 1 46 46 GLU CA C 13 58.9 . . 1 . . . . 46 GLU CA . 16113 1 389 . 1 1 46 46 GLU CB C 13 29.3 . . 1 . . . . 46 GLU CB . 16113 1 390 . 1 1 46 46 GLU CG C 13 35.9 . . 1 . . . . 46 GLU CG . 16113 1 391 . 1 1 46 46 GLU N N 15 118.8 . . 1 . . . . 46 GLU N . 16113 1 392 . 1 1 47 47 ASN H H 1 7.70 . . 1 . . . . 47 ASN H . 16113 1 393 . 1 1 47 47 ASN HA H 1 4.90 . . 1 . . . . 47 ASN HA . 16113 1 394 . 1 1 47 47 ASN HB2 H 1 2.72 . . 2 . . . . 47 ASN HB2 . 16113 1 395 . 1 1 47 47 ASN HB3 H 1 2.82 . . 2 . . . . 47 ASN HB3 . 16113 1 396 . 1 1 47 47 ASN HD21 H 1 7.49 . . 2 . . . . 47 ASN HD21 . 16113 1 397 . 1 1 47 47 ASN HD22 H 1 6.72 . . 2 . . . . 47 ASN HD22 . 16113 1 398 . 1 1 47 47 ASN CA C 13 57.1 . . 1 . . . . 47 ASN CA . 16113 1 399 . 1 1 47 47 ASN CB C 13 39.0 . . 1 . . . . 47 ASN CB . 16113 1 400 . 1 1 47 47 ASN N N 15 118.0 . . 1 . . . . 47 ASN N . 16113 1 401 . 1 1 47 47 ASN ND2 N 15 112.5 . . 1 . . . . 47 ASN ND2 . 16113 1 402 . 1 1 48 48 ASP H H 1 8.81 . . 1 . . . . 48 ASP H . 16113 1 403 . 1 1 48 48 ASP HA H 1 4.52 . . 1 . . . . 48 ASP HA . 16113 1 404 . 1 1 48 48 ASP HB2 H 1 2.88 . . 2 . . . . 48 ASP HB2 . 16113 1 405 . 1 1 48 48 ASP HB3 H 1 2.96 . . 2 . . . . 48 ASP HB3 . 16113 1 406 . 1 1 48 48 ASP CA C 13 57.8 . . 1 . . . . 48 ASP CA . 16113 1 407 . 1 1 48 48 ASP CB C 13 41.7 . . 1 . . . . 48 ASP CB . 16113 1 408 . 1 1 48 48 ASP N N 15 124.0 . . 1 . . . . 48 ASP N . 16113 1 409 . 1 1 49 49 GLU H H 1 7.31 . . 1 . . . . 49 GLU H . 16113 1 410 . 1 1 49 49 GLU HA H 1 4.07 . . 1 . . . . 49 GLU HA . 16113 1 411 . 1 1 49 49 GLU HB2 H 1 2.15 . . 2 . . . . 49 GLU HB2 . 16113 1 412 . 1 1 49 49 GLU HB3 H 1 2.15 . . 2 . . . . 49 GLU HB3 . 16113 1 413 . 1 1 49 49 GLU HG2 H 1 2.32 . . 2 . . . . 49 GLU HG2 . 16113 1 414 . 1 1 49 49 GLU HG3 H 1 2.45 . . 2 . . . . 49 GLU HG3 . 16113 1 415 . 1 1 49 49 GLU CA C 13 59.5 . . 1 . . . . 49 GLU CA . 16113 1 416 . 1 1 49 49 GLU CB C 13 29.3 . . 1 . . . . 49 GLU CB . 16113 1 417 . 1 1 49 49 GLU CG C 13 35.9 . . 1 . . . . 49 GLU CG . 16113 1 418 . 1 1 49 49 GLU N N 15 117.6 . . 1 . . . . 49 GLU N . 16113 1 419 . 1 1 50 50 LEU H H 1 7.59 . . 1 . . . . 50 LEU H . 16113 1 420 . 1 1 50 50 LEU HA H 1 4.16 . . 1 . . . . 50 LEU HA . 16113 1 421 . 1 1 50 50 LEU HB2 H 1 2.12 . . 2 . . . . 50 LEU HB2 . 16113 1 422 . 1 1 50 50 LEU HB3 H 1 1.68 . . 2 . . . . 50 LEU HB3 . 16113 1 423 . 1 1 50 50 LEU HD11 H 1 0.96 . . 2 . . . . 50 LEU HD1 . 16113 1 424 . 1 1 50 50 LEU HD12 H 1 0.96 . . 2 . . . . 50 LEU HD1 . 16113 1 425 . 1 1 50 50 LEU HD13 H 1 0.96 . . 2 . . . . 50 LEU HD1 . 16113 1 426 . 1 1 50 50 LEU HD21 H 1 1.00 . . 2 . . . . 50 LEU HD2 . 16113 1 427 . 1 1 50 50 LEU HD22 H 1 1.00 . . 2 . . . . 50 LEU HD2 . 16113 1 428 . 1 1 50 50 LEU HD23 H 1 1.00 . . 2 . . . . 50 LEU HD2 . 16113 1 429 . 1 1 50 50 LEU HG H 1 1.56 . . 1 . . . . 50 LEU HG . 16113 1 430 . 1 1 50 50 LEU CA C 13 58.0 . . 1 . . . . 50 LEU CA . 16113 1 431 . 1 1 50 50 LEU CB C 13 41.8 . . 1 . . . . 50 LEU CB . 16113 1 432 . 1 1 50 50 LEU CD1 C 13 22.1 . . 1 . . . . 50 LEU CD1 . 16113 1 433 . 1 1 50 50 LEU CD2 C 13 26.4 . . 1 . . . . 50 LEU CD2 . 16113 1 434 . 1 1 50 50 LEU CG C 13 26.8 . . 1 . . . . 50 LEU CG . 16113 1 435 . 1 1 50 50 LEU N N 15 119.5 . . 1 . . . . 50 LEU N . 16113 1 436 . 1 1 51 51 ALA H H 1 8.62 . . 1 . . . . 51 ALA H . 16113 1 437 . 1 1 51 51 ALA HA H 1 4.21 . . 1 . . . . 51 ALA HA . 16113 1 438 . 1 1 51 51 ALA HB1 H 1 1.63 . . 1 . . . . 51 ALA HB . 16113 1 439 . 1 1 51 51 ALA HB2 H 1 1.63 . . 1 . . . . 51 ALA HB . 16113 1 440 . 1 1 51 51 ALA HB3 H 1 1.63 . . 1 . . . . 51 ALA HB . 16113 1 441 . 1 1 51 51 ALA CA C 13 54.9 . . 1 . . . . 51 ALA CA . 16113 1 442 . 1 1 51 51 ALA CB C 13 18.6 . . 1 . . . . 51 ALA CB . 16113 1 443 . 1 1 51 51 ALA N N 15 118.9 . . 1 . . . . 51 ALA N . 16113 1 444 . 1 1 52 52 ALA H H 1 8.41 . . 1 . . . . 52 ALA H . 16113 1 445 . 1 1 52 52 ALA HA H 1 4.21 . . 1 . . . . 52 ALA HA . 16113 1 446 . 1 1 52 52 ALA HB1 H 1 1.59 . . 1 . . . . 52 ALA HB . 16113 1 447 . 1 1 52 52 ALA HB2 H 1 1.59 . . 1 . . . . 52 ALA HB . 16113 1 448 . 1 1 52 52 ALA HB3 H 1 1.59 . . 1 . . . . 52 ALA HB . 16113 1 449 . 1 1 52 52 ALA CA C 13 55.1 . . 1 . . . . 52 ALA CA . 16113 1 450 . 1 1 52 52 ALA CB C 13 18.4 . . 1 . . . . 52 ALA CB . 16113 1 451 . 1 1 52 52 ALA N N 15 119.4 . . 1 . . . . 52 ALA N . 16113 1 452 . 1 1 53 53 ARG H H 1 8.07 . . 1 . . . . 53 ARG H . 16113 1 453 . 1 1 53 53 ARG HA H 1 4.13 . . 1 . . . . 53 ARG HA . 16113 1 454 . 1 1 53 53 ARG HB2 H 1 2.11 . . 2 . . . . 53 ARG HB2 . 16113 1 455 . 1 1 53 53 ARG HB3 H 1 1.90 . . 2 . . . . 53 ARG HB3 . 16113 1 456 . 1 1 53 53 ARG HD2 H 1 3.27 . . 2 . . . . 53 ARG HD2 . 16113 1 457 . 1 1 53 53 ARG HD3 H 1 3.27 . . 2 . . . . 53 ARG HD3 . 16113 1 458 . 1 1 53 53 ARG HG2 H 1 1.92 . . 2 . . . . 53 ARG HG2 . 16113 1 459 . 1 1 53 53 ARG HG3 H 1 1.81 . . 2 . . . . 53 ARG HG3 . 16113 1 460 . 1 1 53 53 ARG CA C 13 59.1 . . 1 . . . . 53 ARG CA . 16113 1 461 . 1 1 53 53 ARG CB C 13 30.9 . . 1 . . . . 53 ARG CB . 16113 1 462 . 1 1 53 53 ARG CD C 13 43.5 . . 1 . . . . 53 ARG CD . 16113 1 463 . 1 1 53 53 ARG CG C 13 27.8 . . 1 . . . . 53 ARG CG . 16113 1 464 . 1 1 53 53 ARG N N 15 119.5 . . 1 . . . . 53 ARG N . 16113 1 465 . 1 1 54 54 TRP H H 1 9.27 . . 1 . . . . 54 TRP H . 16113 1 466 . 1 1 54 54 TRP HA H 1 3.83 . . 1 . . . . 54 TRP HA . 16113 1 467 . 1 1 54 54 TRP HB2 H 1 3.07 . . 2 . . . . 54 TRP HB2 . 16113 1 468 . 1 1 54 54 TRP HB3 H 1 3.44 . . 2 . . . . 54 TRP HB3 . 16113 1 469 . 1 1 54 54 TRP HD1 H 1 6.76 . . 1 . . . . 54 TRP HD1 . 16113 1 470 . 1 1 54 54 TRP HE1 H 1 9.82 . . 1 . . . . 54 TRP HE1 . 16113 1 471 . 1 1 54 54 TRP HE3 H 1 7.49 . . 1 . . . . 54 TRP HE3 . 16113 1 472 . 1 1 54 54 TRP HH2 H 1 6.74 . . 1 . . . . 54 TRP HH2 . 16113 1 473 . 1 1 54 54 TRP HZ2 H 1 6.99 . . 1 . . . . 54 TRP HZ2 . 16113 1 474 . 1 1 54 54 TRP HZ3 H 1 7.02 . . 1 . . . . 54 TRP HZ3 . 16113 1 475 . 1 1 54 54 TRP CA C 13 62.4 . . 1 . . . . 54 TRP CA . 16113 1 476 . 1 1 54 54 TRP CB C 13 29.2 . . 1 . . . . 54 TRP CB . 16113 1 477 . 1 1 54 54 TRP CD1 C 13 125.5 . . 1 . . . . 54 TRP CD1 . 16113 1 478 . 1 1 54 54 TRP CE3 C 13 120.2 . . 1 . . . . 54 TRP CE3 . 16113 1 479 . 1 1 54 54 TRP CH2 C 13 121.7 . . 1 . . . . 54 TRP CH2 . 16113 1 480 . 1 1 54 54 TRP CZ2 C 13 112.5 . . 1 . . . . 54 TRP CZ2 . 16113 1 481 . 1 1 54 54 TRP CZ3 C 13 120.3 . . 1 . . . . 54 TRP CZ3 . 16113 1 482 . 1 1 54 54 TRP N N 15 124.0 . . 1 . . . . 54 TRP N . 16113 1 483 . 1 1 54 54 TRP NE1 N 15 128.4 . . 1 . . . . 54 TRP NE1 . 16113 1 484 . 1 1 55 55 ALA H H 1 8.81 . . 1 . . . . 55 ALA H . 16113 1 485 . 1 1 55 55 ALA HA H 1 3.22 . . 1 . . . . 55 ALA HA . 16113 1 486 . 1 1 55 55 ALA HB1 H 1 1.52 . . 1 . . . . 55 ALA HB . 16113 1 487 . 1 1 55 55 ALA HB2 H 1 1.52 . . 1 . . . . 55 ALA HB . 16113 1 488 . 1 1 55 55 ALA HB3 H 1 1.52 . . 1 . . . . 55 ALA HB . 16113 1 489 . 1 1 55 55 ALA CA C 13 55.1 . . 1 . . . . 55 ALA CA . 16113 1 490 . 1 1 55 55 ALA CB C 13 17.5 . . 1 . . . . 55 ALA CB . 16113 1 491 . 1 1 55 55 ALA N N 15 120.8 . . 1 . . . . 55 ALA N . 16113 1 492 . 1 1 56 56 GLU H H 1 7.46 . . 1 . . . . 56 GLU H . 16113 1 493 . 1 1 56 56 GLU HA H 1 3.88 . . 1 . . . . 56 GLU HA . 16113 1 494 . 1 1 56 56 GLU HB2 H 1 2.04 . . 2 . . . . 56 GLU HB2 . 16113 1 495 . 1 1 56 56 GLU HB3 H 1 2.10 . . 2 . . . . 56 GLU HB3 . 16113 1 496 . 1 1 56 56 GLU HG2 H 1 2.22 . . 2 . . . . 56 GLU HG2 . 16113 1 497 . 1 1 56 56 GLU HG3 H 1 2.38 . . 2 . . . . 56 GLU HG3 . 16113 1 498 . 1 1 56 56 GLU CA C 13 59.2 . . 1 . . . . 56 GLU CA . 16113 1 499 . 1 1 56 56 GLU CB C 13 29.5 . . 1 . . . . 56 GLU CB . 16113 1 500 . 1 1 56 56 GLU CG C 13 36.0 . . 1 . . . . 56 GLU CG . 16113 1 501 . 1 1 56 56 GLU N N 15 114.8 . . 1 . . . . 56 GLU N . 16113 1 502 . 1 1 57 57 GLY H H 1 7.65 . . 1 . . . . 57 GLY H . 16113 1 503 . 1 1 57 57 GLY HA2 H 1 3.49 . . 2 . . . . 57 GLY HA2 . 16113 1 504 . 1 1 57 57 GLY HA3 H 1 3.85 . . 2 . . . . 57 GLY HA3 . 16113 1 505 . 1 1 57 57 GLY CA C 13 47.1 . . 1 . . . . 57 GLY CA . 16113 1 506 . 1 1 57 57 GLY N N 15 106.0 . . 1 . . . . 57 GLY N . 16113 1 507 . 1 1 58 58 ALA H H 1 8.95 . . 1 . . . . 58 ALA H . 16113 1 508 . 1 1 58 58 ALA HA H 1 3.64 . . 1 . . . . 58 ALA HA . 16113 1 509 . 1 1 58 58 ALA HB1 H 1 0.34 . . 1 . . . . 58 ALA HB . 16113 1 510 . 1 1 58 58 ALA HB2 H 1 0.34 . . 1 . . . . 58 ALA HB . 16113 1 511 . 1 1 58 58 ALA HB3 H 1 0.34 . . 1 . . . . 58 ALA HB . 16113 1 512 . 1 1 58 58 ALA CA C 13 54.5 . . 1 . . . . 58 ALA CA . 16113 1 513 . 1 1 58 58 ALA CB C 13 16.7 . . 1 . . . . 58 ALA CB . 16113 1 514 . 1 1 58 58 ALA N N 15 127.4 . . 1 . . . . 58 ALA N . 16113 1 515 . 1 1 59 59 LEU H H 1 8.37 . . 1 . . . . 59 LEU H . 16113 1 516 . 1 1 59 59 LEU HA H 1 3.92 . . 1 . . . . 59 LEU HA . 16113 1 517 . 1 1 59 59 LEU HB2 H 1 1.86 . . 2 . . . . 59 LEU HB2 . 16113 1 518 . 1 1 59 59 LEU HB3 H 1 1.31 . . 2 . . . . 59 LEU HB3 . 16113 1 519 . 1 1 59 59 LEU HD11 H 1 0.83 . . 2 . . . . 59 LEU HD1 . 16113 1 520 . 1 1 59 59 LEU HD12 H 1 0.83 . . 2 . . . . 59 LEU HD1 . 16113 1 521 . 1 1 59 59 LEU HD13 H 1 0.83 . . 2 . . . . 59 LEU HD1 . 16113 1 522 . 1 1 59 59 LEU HD21 H 1 0.84 . . 2 . . . . 59 LEU HD2 . 16113 1 523 . 1 1 59 59 LEU HD22 H 1 0.84 . . 2 . . . . 59 LEU HD2 . 16113 1 524 . 1 1 59 59 LEU HD23 H 1 0.84 . . 2 . . . . 59 LEU HD2 . 16113 1 525 . 1 1 59 59 LEU HG H 1 1.82 . . 1 . . . . 59 LEU HG . 16113 1 526 . 1 1 59 59 LEU CA C 13 57.3 . . 1 . . . . 59 LEU CA . 16113 1 527 . 1 1 59 59 LEU CB C 13 40.8 . . 1 . . . . 59 LEU CB . 16113 1 528 . 1 1 59 59 LEU CD1 C 13 25.2 . . 1 . . . . 59 LEU CD1 . 16113 1 529 . 1 1 59 59 LEU CD2 C 13 23.4 . . 1 . . . . 59 LEU CD2 . 16113 1 530 . 1 1 59 59 LEU CG C 13 27.0 . . 1 . . . . 59 LEU CG . 16113 1 531 . 1 1 59 59 LEU N N 15 116.8 . . 1 . . . . 59 LEU N . 16113 1 532 . 1 1 60 60 GLU H H 1 7.31 . . 1 . . . . 60 GLU H . 16113 1 533 . 1 1 60 60 GLU HA H 1 4.03 . . 1 . . . . 60 GLU HA . 16113 1 534 . 1 1 60 60 GLU HB2 H 1 2.04 . . 2 . . . . 60 GLU HB2 . 16113 1 535 . 1 1 60 60 GLU HB3 H 1 2.08 . . 2 . . . . 60 GLU HB3 . 16113 1 536 . 1 1 60 60 GLU HG2 H 1 2.29 . . 2 . . . . 60 GLU HG2 . 16113 1 537 . 1 1 60 60 GLU HG3 H 1 2.29 . . 2 . . . . 60 GLU HG3 . 16113 1 538 . 1 1 60 60 GLU CA C 13 58.8 . . 1 . . . . 60 GLU CA . 16113 1 539 . 1 1 60 60 GLU CB C 13 28.9 . . 1 . . . . 60 GLU CB . 16113 1 540 . 1 1 60 60 GLU CG C 13 35.6 . . 1 . . . . 60 GLU CG . 16113 1 541 . 1 1 60 60 GLU N N 15 119.0 . . 1 . . . . 60 GLU N . 16113 1 542 . 1 1 61 61 LEU H H 1 7.70 . . 1 . . . . 61 LEU H . 16113 1 543 . 1 1 61 61 LEU HA H 1 4.00 . . 1 . . . . 61 LEU HA . 16113 1 544 . 1 1 61 61 LEU HB2 H 1 2.04 . . 2 . . . . 61 LEU HB2 . 16113 1 545 . 1 1 61 61 LEU HB3 H 1 1.38 . . 2 . . . . 61 LEU HB3 . 16113 1 546 . 1 1 61 61 LEU HD11 H 1 0.85 . . 2 . . . . 61 LEU HD1 . 16113 1 547 . 1 1 61 61 LEU HD12 H 1 0.85 . . 2 . . . . 61 LEU HD1 . 16113 1 548 . 1 1 61 61 LEU HD13 H 1 0.85 . . 2 . . . . 61 LEU HD1 . 16113 1 549 . 1 1 61 61 LEU HD21 H 1 0.72 . . 2 . . . . 61 LEU HD2 . 16113 1 550 . 1 1 61 61 LEU HD22 H 1 0.72 . . 2 . . . . 61 LEU HD2 . 16113 1 551 . 1 1 61 61 LEU HD23 H 1 0.72 . . 2 . . . . 61 LEU HD2 . 16113 1 552 . 1 1 61 61 LEU HG H 1 1.44 . . 1 . . . . 61 LEU HG . 16113 1 553 . 1 1 61 61 LEU CA C 13 58.1 . . 1 . . . . 61 LEU CA . 16113 1 554 . 1 1 61 61 LEU CB C 13 41.4 . . 1 . . . . 61 LEU CB . 16113 1 555 . 1 1 61 61 LEU CD1 C 13 26.1 . . 1 . . . . 61 LEU CD1 . 16113 1 556 . 1 1 61 61 LEU CD2 C 13 23.8 . . 1 . . . . 61 LEU CD2 . 16113 1 557 . 1 1 61 61 LEU CG C 13 26.6 . . 1 . . . . 61 LEU CG . 16113 1 558 . 1 1 61 61 LEU N N 15 120.8 . . 1 . . . . 61 LEU N . 16113 1 559 . 1 1 62 62 ILE H H 1 7.51 . . 1 . . . . 62 ILE H . 16113 1 560 . 1 1 62 62 ILE HA H 1 4.04 . . 1 . . . . 62 ILE HA . 16113 1 561 . 1 1 62 62 ILE HB H 1 1.99 . . 1 . . . . 62 ILE HB . 16113 1 562 . 1 1 62 62 ILE HD11 H 1 0.70 . . 1 . . . . 62 ILE HD1 . 16113 1 563 . 1 1 62 62 ILE HD12 H 1 0.70 . . 1 . . . . 62 ILE HD1 . 16113 1 564 . 1 1 62 62 ILE HD13 H 1 0.70 . . 1 . . . . 62 ILE HD1 . 16113 1 565 . 1 1 62 62 ILE HG12 H 1 1.33 . . 2 . . . . 62 ILE HG12 . 16113 1 566 . 1 1 62 62 ILE HG13 H 1 1.33 . . 2 . . . . 62 ILE HG13 . 16113 1 567 . 1 1 62 62 ILE HG21 H 1 0.84 . . 1 . . . . 62 ILE HG2 . 16113 1 568 . 1 1 62 62 ILE HG22 H 1 0.84 . . 1 . . . . 62 ILE HG2 . 16113 1 569 . 1 1 62 62 ILE HG23 H 1 0.84 . . 1 . . . . 62 ILE HG2 . 16113 1 570 . 1 1 62 62 ILE CA C 13 63.2 . . 1 . . . . 62 ILE CA . 16113 1 571 . 1 1 62 62 ILE CB C 13 37.2 . . 1 . . . . 62 ILE CB . 16113 1 572 . 1 1 62 62 ILE CD1 C 13 14.0 . . 1 . . . . 62 ILE CD1 . 16113 1 573 . 1 1 62 62 ILE CG1 C 13 27.4 . . 1 . . . . 62 ILE CG1 . 16113 1 574 . 1 1 62 62 ILE CG2 C 13 17.6 . . 1 . . . . 62 ILE CG2 . 16113 1 575 . 1 1 62 62 ILE N N 15 110.7 . . 1 . . . . 62 ILE N . 16113 1 576 . 1 1 63 63 LYS H H 1 7.52 . . 1 . . . . 63 LYS H . 16113 1 577 . 1 1 63 63 LYS HA H 1 4.07 . . 1 . . . . 63 LYS HA . 16113 1 578 . 1 1 63 63 LYS HB2 H 1 1.95 . . 2 . . . . 63 LYS HB2 . 16113 1 579 . 1 1 63 63 LYS HB3 H 1 1.95 . . 2 . . . . 63 LYS HB3 . 16113 1 580 . 1 1 63 63 LYS HD2 H 1 1.64 . . 2 . . . . 63 LYS HD2 . 16113 1 581 . 1 1 63 63 LYS HD3 H 1 1.66 . . 2 . . . . 63 LYS HD3 . 16113 1 582 . 1 1 63 63 LYS HE2 H 1 2.90 . . 2 . . . . 63 LYS HE2 . 16113 1 583 . 1 1 63 63 LYS HE3 H 1 2.90 . . 2 . . . . 63 LYS HE3 . 16113 1 584 . 1 1 63 63 LYS HG2 H 1 1.34 . . 2 . . . . 63 LYS HG2 . 16113 1 585 . 1 1 63 63 LYS HG3 H 1 1.59 . . 2 . . . . 63 LYS HG3 . 16113 1 586 . 1 1 63 63 LYS CA C 13 58.6 . . 1 . . . . 63 LYS CA . 16113 1 587 . 1 1 63 63 LYS CB C 13 32.8 . . 1 . . . . 63 LYS CB . 16113 1 588 . 1 1 63 63 LYS CD C 13 29.6 . . 1 . . . . 63 LYS CD . 16113 1 589 . 1 1 63 63 LYS CG C 13 24.7 . . 1 . . . . 63 LYS CG . 16113 1 590 . 1 1 63 63 LYS N N 15 121.1 . . 1 . . . . 63 LYS N . 16113 1 591 . 1 1 64 64 VAL H H 1 7.63 . . 1 . . . . 64 VAL H . 16113 1 592 . 1 1 64 64 VAL HA H 1 3.95 . . 1 . . . . 64 VAL HA . 16113 1 593 . 1 1 64 64 VAL HB H 1 2.15 . . 1 . . . . 64 VAL HB . 16113 1 594 . 1 1 64 64 VAL HG11 H 1 0.94 . . 2 . . . . 64 VAL HG1 . 16113 1 595 . 1 1 64 64 VAL HG12 H 1 0.94 . . 2 . . . . 64 VAL HG1 . 16113 1 596 . 1 1 64 64 VAL HG13 H 1 0.94 . . 2 . . . . 64 VAL HG1 . 16113 1 597 . 1 1 64 64 VAL HG21 H 1 1.02 . . 2 . . . . 64 VAL HG2 . 16113 1 598 . 1 1 64 64 VAL HG22 H 1 1.02 . . 2 . . . . 64 VAL HG2 . 16113 1 599 . 1 1 64 64 VAL HG23 H 1 1.02 . . 2 . . . . 64 VAL HG2 . 16113 1 600 . 1 1 64 64 VAL CA C 13 63.9 . . 1 . . . . 64 VAL CA . 16113 1 601 . 1 1 64 64 VAL CB C 13 32.4 . . 1 . . . . 64 VAL CB . 16113 1 602 . 1 1 64 64 VAL CG1 C 13 21.0 . . 1 . . . . 64 VAL CG1 . 16113 1 603 . 1 1 64 64 VAL CG2 C 13 21.1 . . 1 . . . . 64 VAL CG2 . 16113 1 604 . 1 1 64 64 VAL N N 15 115.2 . . 1 . . . . 64 VAL N . 16113 1 605 . 1 1 65 65 ARG H H 1 7.98 . . 1 . . . . 65 ARG H . 16113 1 606 . 1 1 65 65 ARG HA H 1 4.39 . . 1 . . . . 65 ARG HA . 16113 1 607 . 1 1 65 65 ARG HB2 H 1 1.85 . . 2 . . . . 65 ARG HB2 . 16113 1 608 . 1 1 65 65 ARG HB3 H 1 1.85 . . 2 . . . . 65 ARG HB3 . 16113 1 609 . 1 1 65 65 ARG HD2 H 1 3.12 . . 2 . . . . 65 ARG HD2 . 16113 1 610 . 1 1 65 65 ARG HD3 H 1 3.12 . . 2 . . . . 65 ARG HD3 . 16113 1 611 . 1 1 65 65 ARG HG2 H 1 1.57 . . 2 . . . . 65 ARG HG2 . 16113 1 612 . 1 1 65 65 ARG HG3 H 1 1.57 . . 2 . . . . 65 ARG HG3 . 16113 1 613 . 1 1 65 65 ARG CA C 13 55.2 . . 1 . . . . 65 ARG CA . 16113 1 614 . 1 1 65 65 ARG CB C 13 31.5 . . 1 . . . . 65 ARG CB . 16113 1 615 . 1 1 65 65 ARG CD C 13 43.1 . . 1 . . . . 65 ARG CD . 16113 1 616 . 1 1 65 65 ARG CG C 13 27.1 . . 1 . . . . 65 ARG CG . 16113 1 617 . 1 1 65 65 ARG N N 15 118.3 . . 1 . . . . 65 ARG N . 16113 1 618 . 1 1 66 66 ARG HA H 1 4.34 . . 1 . . . . 66 ARG HA . 16113 1 619 . 1 1 66 66 ARG HB2 H 1 1.79 . . 2 . . . . 66 ARG HB2 . 16113 1 620 . 1 1 66 66 ARG HB3 H 1 1.79 . . 2 . . . . 66 ARG HB3 . 16113 1 621 . 1 1 66 66 ARG CA C 13 54.9 . . 1 . . . . 66 ARG CA . 16113 1 622 . 1 1 66 66 ARG CB C 13 29.2 . . 1 . . . . 66 ARG CB . 16113 1 623 . 1 1 67 67 PRO HD2 H 1 3.77 . . 2 . . . . 67 PRO HD2 . 16113 1 624 . 1 1 67 67 PRO HD3 H 1 3.90 . . 2 . . . . 67 PRO HD3 . 16113 1 625 . 1 1 67 67 PRO HG2 H 1 2.08 . . 2 . . . . 67 PRO HG2 . 16113 1 626 . 1 1 67 67 PRO HG3 H 1 1.76 . . 2 . . . . 67 PRO HG3 . 16113 1 627 . 1 1 67 67 PRO CD C 13 50.8 . . 1 . . . . 67 PRO CD . 16113 1 628 . 1 1 67 67 PRO CG C 13 27.4 . . 1 . . . . 67 PRO CG . 16113 1 629 . 1 1 68 68 LYS HA H 1 4.10 . . 1 . . . . 68 LYS HA . 16113 1 630 . 1 1 68 68 LYS HB2 H 1 1.09 . . 2 . . . . 68 LYS HB2 . 16113 1 631 . 1 1 68 68 LYS HB3 H 1 1.23 . . 2 . . . . 68 LYS HB3 . 16113 1 632 . 1 1 68 68 LYS HD2 H 1 1.37 . . 2 . . . . 68 LYS HD2 . 16113 1 633 . 1 1 68 68 LYS HD3 H 1 1.42 . . 2 . . . . 68 LYS HD3 . 16113 1 634 . 1 1 68 68 LYS HE2 H 1 2.82 . . 2 . . . . 68 LYS HE2 . 16113 1 635 . 1 1 68 68 LYS HE3 H 1 2.82 . . 2 . . . . 68 LYS HE3 . 16113 1 636 . 1 1 68 68 LYS HG2 H 1 0.69 . . 2 . . . . 68 LYS HG2 . 16113 1 637 . 1 1 68 68 LYS HG3 H 1 1.03 . . 2 . . . . 68 LYS HG3 . 16113 1 638 . 1 1 68 68 LYS CA C 13 57.9 . . 1 . . . . 68 LYS CA . 16113 1 639 . 1 1 68 68 LYS CB C 13 34.1 . . 1 . . . . 68 LYS CB . 16113 1 640 . 1 1 68 68 LYS CD C 13 29.2 . . 1 . . . . 68 LYS CD . 16113 1 641 . 1 1 68 68 LYS CE C 13 41.7 . . 1 . . . . 68 LYS CE . 16113 1 642 . 1 1 68 68 LYS CG C 13 24.8 . . 1 . . . . 68 LYS CG . 16113 1 643 . 1 1 69 69 TYR HA H 1 4.76 . . 1 . . . . 69 TYR HA . 16113 1 644 . 1 1 69 69 TYR HB2 H 1 2.81 . . 2 . . . . 69 TYR HB2 . 16113 1 645 . 1 1 69 69 TYR HB3 H 1 3.44 . . 2 . . . . 69 TYR HB3 . 16113 1 646 . 1 1 69 69 TYR HD1 H 1 7.13 . . 3 . . . . 69 TYR HD1 . 16113 1 647 . 1 1 69 69 TYR HD2 H 1 7.13 . . 3 . . . . 69 TYR HD2 . 16113 1 648 . 1 1 69 69 TYR HE1 H 1 6.74 . . 3 . . . . 69 TYR HE1 . 16113 1 649 . 1 1 69 69 TYR HE2 H 1 6.74 . . 3 . . . . 69 TYR HE2 . 16113 1 650 . 1 1 69 69 TYR CA C 13 57.8 . . 1 . . . . 69 TYR CA . 16113 1 651 . 1 1 69 69 TYR CB C 13 39.6 . . 1 . . . . 69 TYR CB . 16113 1 652 . 1 1 69 69 TYR CD1 C 13 132.5 . . 1 . . . . 69 TYR CD1 . 16113 1 653 . 1 1 69 69 TYR CE1 C 13 117.6 . . 1 . . . . 69 TYR CE1 . 16113 1 654 . 1 1 70 70 VAL H H 1 6.95 . . 1 . . . . 70 VAL H . 16113 1 655 . 1 1 70 70 VAL HA H 1 4.72 . . 1 . . . . 70 VAL HA . 16113 1 656 . 1 1 70 70 VAL HB H 1 1.82 . . 1 . . . . 70 VAL HB . 16113 1 657 . 1 1 70 70 VAL HG11 H 1 0.78 . . 2 . . . . 70 VAL HG1 . 16113 1 658 . 1 1 70 70 VAL HG12 H 1 0.78 . . 2 . . . . 70 VAL HG1 . 16113 1 659 . 1 1 70 70 VAL HG13 H 1 0.78 . . 2 . . . . 70 VAL HG1 . 16113 1 660 . 1 1 70 70 VAL HG21 H 1 0.96 . . 2 . . . . 70 VAL HG2 . 16113 1 661 . 1 1 70 70 VAL HG22 H 1 0.96 . . 2 . . . . 70 VAL HG2 . 16113 1 662 . 1 1 70 70 VAL HG23 H 1 0.96 . . 2 . . . . 70 VAL HG2 . 16113 1 663 . 1 1 70 70 VAL CA C 13 60.0 . . 1 . . . . 70 VAL CA . 16113 1 664 . 1 1 70 70 VAL CB C 13 34.5 . . 1 . . . . 70 VAL CB . 16113 1 665 . 1 1 70 70 VAL CG1 C 13 20.4 . . 1 . . . . 70 VAL CG1 . 16113 1 666 . 1 1 70 70 VAL CG2 C 13 21.0 . . 1 . . . . 70 VAL CG2 . 16113 1 667 . 1 1 70 70 VAL N N 15 115.4 . . 1 . . . . 70 VAL N . 16113 1 668 . 1 1 71 71 HIS H H 1 7.87 . . 1 . . . . 71 HIS H . 16113 1 669 . 1 1 71 71 HIS HA H 1 4.91 . . 1 . . . . 71 HIS HA . 16113 1 670 . 1 1 71 71 HIS HB2 H 1 3.04 . . 2 . . . . 71 HIS HB2 . 16113 1 671 . 1 1 71 71 HIS HB3 H 1 3.28 . . 2 . . . . 71 HIS HB3 . 16113 1 672 . 1 1 71 71 HIS HD2 H 1 7.01 . . 1 . . . . 71 HIS HD2 . 16113 1 673 . 1 1 71 71 HIS CA C 13 54.1 . . 1 . . . . 71 HIS CA . 16113 1 674 . 1 1 71 71 HIS CB C 13 33.7 . . 1 . . . . 71 HIS CB . 16113 1 675 . 1 1 71 71 HIS CD2 C 13 119.9 . . 1 . . . . 71 HIS CD2 . 16113 1 676 . 1 1 71 71 HIS N N 15 120.6 . . 1 . . . . 71 HIS N . 16113 1 677 . 1 1 72 72 LYS H H 1 8.40 . . 1 . . . . 72 LYS H . 16113 1 678 . 1 1 72 72 LYS HA H 1 3.68 . . 1 . . . . 72 LYS HA . 16113 1 679 . 1 1 72 72 LYS HB2 H 1 1.77 . . 2 . . . . 72 LYS HB2 . 16113 1 680 . 1 1 72 72 LYS HB3 H 1 1.85 . . 2 . . . . 72 LYS HB3 . 16113 1 681 . 1 1 72 72 LYS HD2 H 1 1.65 . . 2 . . . . 72 LYS HD2 . 16113 1 682 . 1 1 72 72 LYS HD3 H 1 1.65 . . 2 . . . . 72 LYS HD3 . 16113 1 683 . 1 1 72 72 LYS HE2 H 1 2.95 . . 2 . . . . 72 LYS HE2 . 16113 1 684 . 1 1 72 72 LYS HE3 H 1 2.95 . . 2 . . . . 72 LYS HE3 . 16113 1 685 . 1 1 72 72 LYS HG2 H 1 1.30 . . 2 . . . . 72 LYS HG2 . 16113 1 686 . 1 1 72 72 LYS HG3 H 1 1.30 . . 2 . . . . 72 LYS HG3 . 16113 1 687 . 1 1 72 72 LYS CA C 13 60.6 . . 1 . . . . 72 LYS CA . 16113 1 688 . 1 1 72 72 LYS CB C 13 32.8 . . 1 . . . . 72 LYS CB . 16113 1 689 . 1 1 72 72 LYS CD C 13 29.7 . . 1 . . . . 72 LYS CD . 16113 1 690 . 1 1 72 72 LYS CE C 13 41.8 . . 1 . . . . 72 LYS CE . 16113 1 691 . 1 1 72 72 LYS CG C 13 24.0 . . 1 . . . . 72 LYS CG . 16113 1 692 . 1 1 73 73 GLU H H 1 9.68 . . 1 . . . . 73 GLU H . 16113 1 693 . 1 1 73 73 GLU HA H 1 4.17 . . 1 . . . . 73 GLU HA . 16113 1 694 . 1 1 73 73 GLU HB2 H 1 2.07 . . 2 . . . . 73 GLU HB2 . 16113 1 695 . 1 1 73 73 GLU HB3 H 1 2.12 . . 2 . . . . 73 GLU HB3 . 16113 1 696 . 1 1 73 73 GLU HG2 H 1 2.37 . . 2 . . . . 73 GLU HG2 . 16113 1 697 . 1 1 73 73 GLU HG3 H 1 2.48 . . 2 . . . . 73 GLU HG3 . 16113 1 698 . 1 1 73 73 GLU CA C 13 60.0 . . 1 . . . . 73 GLU CA . 16113 1 699 . 1 1 73 73 GLU CB C 13 28.3 . . 1 . . . . 73 GLU CB . 16113 1 700 . 1 1 73 73 GLU CG C 13 36.9 . . 1 . . . . 73 GLU CG . 16113 1 701 . 1 1 73 73 GLU N N 15 117.3 . . 1 . . . . 73 GLU N . 16113 1 702 . 1 1 74 74 GLN H H 1 7.36 . . 1 . . . . 74 GLN H . 16113 1 703 . 1 1 74 74 GLN HA H 1 4.18 . . 1 . . . . 74 GLN HA . 16113 1 704 . 1 1 74 74 GLN HB2 H 1 2.31 . . 2 . . . . 74 GLN HB2 . 16113 1 705 . 1 1 74 74 GLN HB3 H 1 2.20 . . 2 . . . . 74 GLN HB3 . 16113 1 706 . 1 1 74 74 GLN HE21 H 1 7.57 . . 2 . . . . 74 GLN HE21 . 16113 1 707 . 1 1 74 74 GLN HE22 H 1 6.94 . . 2 . . . . 74 GLN HE22 . 16113 1 708 . 1 1 74 74 GLN HG2 H 1 2.45 . . 2 . . . . 74 GLN HG2 . 16113 1 709 . 1 1 74 74 GLN HG3 H 1 2.31 . . 2 . . . . 74 GLN HG3 . 16113 1 710 . 1 1 74 74 GLN CA C 13 58.3 . . 1 . . . . 74 GLN CA . 16113 1 711 . 1 1 74 74 GLN CB C 13 28.3 . . 1 . . . . 74 GLN CB . 16113 1 712 . 1 1 74 74 GLN CG C 13 34.5 . . 1 . . . . 74 GLN CG . 16113 1 713 . 1 1 74 74 GLN N N 15 117.7 . . 1 . . . . 74 GLN N . 16113 1 714 . 1 1 74 74 GLN NE2 N 15 110.0 . . 1 . . . . 74 GLN NE2 . 16113 1 715 . 1 1 75 75 ILE H H 1 7.53 . . 1 . . . . 75 ILE H . 16113 1 716 . 1 1 75 75 ILE HA H 1 3.78 . . 1 . . . . 75 ILE HA . 16113 1 717 . 1 1 75 75 ILE HB H 1 2.11 . . 1 . . . . 75 ILE HB . 16113 1 718 . 1 1 75 75 ILE HD11 H 1 0.56 . . 1 . . . . 75 ILE HD1 . 16113 1 719 . 1 1 75 75 ILE HD12 H 1 0.56 . . 1 . . . . 75 ILE HD1 . 16113 1 720 . 1 1 75 75 ILE HD13 H 1 0.56 . . 1 . . . . 75 ILE HD1 . 16113 1 721 . 1 1 75 75 ILE HG12 H 1 1.33 . . 2 . . . . 75 ILE HG12 . 16113 1 722 . 1 1 75 75 ILE HG13 H 1 1.10 . . 2 . . . . 75 ILE HG13 . 16113 1 723 . 1 1 75 75 ILE HG21 H 1 0.76 . . 1 . . . . 75 ILE HG2 . 16113 1 724 . 1 1 75 75 ILE HG22 H 1 0.76 . . 1 . . . . 75 ILE HG2 . 16113 1 725 . 1 1 75 75 ILE HG23 H 1 0.76 . . 1 . . . . 75 ILE HG2 . 16113 1 726 . 1 1 75 75 ILE CA C 13 64.1 . . 1 . . . . 75 ILE CA . 16113 1 727 . 1 1 75 75 ILE CB C 13 36.8 . . 1 . . . . 75 ILE CB . 16113 1 728 . 1 1 75 75 ILE CD1 C 13 12.8 . . 1 . . . . 75 ILE CD1 . 16113 1 729 . 1 1 75 75 ILE CG1 C 13 28.4 . . 1 . . . . 75 ILE CG1 . 16113 1 730 . 1 1 75 75 ILE CG2 C 13 18.1 . . 1 . . . . 75 ILE CG2 . 16113 1 731 . 1 1 75 75 ILE N N 15 120.6 . . 1 . . . . 75 ILE N . 16113 1 732 . 1 1 76 76 GLU H H 1 8.34 . . 1 . . . . 76 GLU H . 16113 1 733 . 1 1 76 76 GLU HA H 1 3.97 . . 1 . . . . 76 GLU HA . 16113 1 734 . 1 1 76 76 GLU HB2 H 1 2.08 . . 2 . . . . 76 GLU HB2 . 16113 1 735 . 1 1 76 76 GLU HB3 H 1 2.08 . . 2 . . . . 76 GLU HB3 . 16113 1 736 . 1 1 76 76 GLU HG2 H 1 2.18 . . 2 . . . . 76 GLU HG2 . 16113 1 737 . 1 1 76 76 GLU HG3 H 1 2.51 . . 2 . . . . 76 GLU HG3 . 16113 1 738 . 1 1 76 76 GLU CA C 13 59.2 . . 1 . . . . 76 GLU CA . 16113 1 739 . 1 1 76 76 GLU CB C 13 29.7 . . 1 . . . . 76 GLU CB . 16113 1 740 . 1 1 76 76 GLU CG C 13 37.3 . . 1 . . . . 76 GLU CG . 16113 1 741 . 1 1 76 76 GLU N N 15 117.5 . . 1 . . . . 76 GLU N . 16113 1 742 . 1 1 77 77 ALA H H 1 7.39 . . 1 . . . . 77 ALA H . 16113 1 743 . 1 1 77 77 ALA HA H 1 4.37 . . 1 . . . . 77 ALA HA . 16113 1 744 . 1 1 77 77 ALA HB1 H 1 1.52 . . 1 . . . . 77 ALA HB . 16113 1 745 . 1 1 77 77 ALA HB2 H 1 1.52 . . 1 . . . . 77 ALA HB . 16113 1 746 . 1 1 77 77 ALA HB3 H 1 1.52 . . 1 . . . . 77 ALA HB . 16113 1 747 . 1 1 77 77 ALA CA C 13 53.4 . . 1 . . . . 77 ALA CA . 16113 1 748 . 1 1 77 77 ALA CB C 13 18.8 . . 1 . . . . 77 ALA CB . 16113 1 749 . 1 1 77 77 ALA N N 15 118.6 . . 1 . . . . 77 ALA N . 16113 1 750 . 1 1 78 78 VAL H H 1 7.62 . . 1 . . . . 78 VAL H . 16113 1 751 . 1 1 78 78 VAL HA H 1 3.72 . . 1 . . . . 78 VAL HA . 16113 1 752 . 1 1 78 78 VAL HB H 1 2.43 . . 1 . . . . 78 VAL HB . 16113 1 753 . 1 1 78 78 VAL HG11 H 1 0.56 . . 2 . . . . 78 VAL HG1 . 16113 1 754 . 1 1 78 78 VAL HG12 H 1 0.56 . . 2 . . . . 78 VAL HG1 . 16113 1 755 . 1 1 78 78 VAL HG13 H 1 0.56 . . 2 . . . . 78 VAL HG1 . 16113 1 756 . 1 1 78 78 VAL HG21 H 1 1.34 . . 2 . . . . 78 VAL HG2 . 16113 1 757 . 1 1 78 78 VAL HG22 H 1 1.34 . . 2 . . . . 78 VAL HG2 . 16113 1 758 . 1 1 78 78 VAL HG23 H 1 1.34 . . 2 . . . . 78 VAL HG2 . 16113 1 759 . 1 1 78 78 VAL CA C 13 66.7 . . 1 . . . . 78 VAL CA . 16113 1 760 . 1 1 78 78 VAL CB C 13 31.5 . . 1 . . . . 78 VAL CB . 16113 1 761 . 1 1 78 78 VAL CG1 C 13 22.1 . . 1 . . . . 78 VAL CG1 . 16113 1 762 . 1 1 78 78 VAL CG2 C 13 24.8 . . 1 . . . . 78 VAL CG2 . 16113 1 763 . 1 1 78 78 VAL N N 15 116.8 . . 1 . . . . 78 VAL N . 16113 1 764 . 1 1 79 79 LYS H H 1 8.57 . . 1 . . . . 79 LYS H . 16113 1 765 . 1 1 79 79 LYS HA H 1 3.78 . . 1 . . . . 79 LYS HA . 16113 1 766 . 1 1 79 79 LYS HB2 H 1 1.92 . . 2 . . . . 79 LYS HB2 . 16113 1 767 . 1 1 79 79 LYS HB3 H 1 2.06 . . 2 . . . . 79 LYS HB3 . 16113 1 768 . 1 1 79 79 LYS HD2 H 1 1.68 . . 2 . . . . 79 LYS HD2 . 16113 1 769 . 1 1 79 79 LYS HD3 H 1 1.72 . . 2 . . . . 79 LYS HD3 . 16113 1 770 . 1 1 79 79 LYS HE2 H 1 2.99 . . 2 . . . . 79 LYS HE2 . 16113 1 771 . 1 1 79 79 LYS HE3 H 1 2.99 . . 2 . . . . 79 LYS HE3 . 16113 1 772 . 1 1 79 79 LYS HG2 H 1 1.48 . . 2 . . . . 79 LYS HG2 . 16113 1 773 . 1 1 79 79 LYS HG3 H 1 1.52 . . 2 . . . . 79 LYS HG3 . 16113 1 774 . 1 1 79 79 LYS CA C 13 61.8 . . 1 . . . . 79 LYS CA . 16113 1 775 . 1 1 79 79 LYS CB C 13 31.5 . . 1 . . . . 79 LYS CB . 16113 1 776 . 1 1 79 79 LYS CD C 13 29.3 . . 1 . . . . 79 LYS CD . 16113 1 777 . 1 1 79 79 LYS CE C 13 41.9 . . 1 . . . . 79 LYS CE . 16113 1 778 . 1 1 79 79 LYS CG C 13 24.9 . . 1 . . . . 79 LYS CG . 16113 1 779 . 1 1 79 79 LYS N N 15 119.5 . . 1 . . . . 79 LYS N . 16113 1 780 . 1 1 80 80 ASP H H 1 8.35 . . 1 . . . . 80 ASP H . 16113 1 781 . 1 1 80 80 ASP HA H 1 4.49 . . 1 . . . . 80 ASP HA . 16113 1 782 . 1 1 80 80 ASP HB2 H 1 2.63 . . 2 . . . . 80 ASP HB2 . 16113 1 783 . 1 1 80 80 ASP HB3 H 1 2.66 . . 2 . . . . 80 ASP HB3 . 16113 1 784 . 1 1 80 80 ASP CA C 13 57.3 . . 1 . . . . 80 ASP CA . 16113 1 785 . 1 1 80 80 ASP CB C 13 40.0 . . 1 . . . . 80 ASP CB . 16113 1 786 . 1 1 80 80 ASP N N 15 115.5 . . 1 . . . . 80 ASP N . 16113 1 787 . 1 1 81 81 ASN H H 1 7.69 . . 1 . . . . 81 ASN H . 16113 1 788 . 1 1 81 81 ASN HA H 1 4.54 . . 1 . . . . 81 ASN HA . 16113 1 789 . 1 1 81 81 ASN HB2 H 1 2.80 . . 2 . . . . 81 ASN HB2 . 16113 1 790 . 1 1 81 81 ASN HB3 H 1 2.46 . . 2 . . . . 81 ASN HB3 . 16113 1 791 . 1 1 81 81 ASN HD21 H 1 8.02 . . 2 . . . . 81 ASN HD21 . 16113 1 792 . 1 1 81 81 ASN HD22 H 1 6.98 . . 2 . . . . 81 ASN HD22 . 16113 1 793 . 1 1 81 81 ASN CA C 13 55.5 . . 1 . . . . 81 ASN CA . 16113 1 794 . 1 1 81 81 ASN CB C 13 38.6 . . 1 . . . . 81 ASN CB . 16113 1 795 . 1 1 81 81 ASN N N 15 118.3 . . 1 . . . . 81 ASN N . 16113 1 796 . 1 1 81 81 ASN ND2 N 15 111.9 . . 1 . . . . 81 ASN ND2 . 16113 1 797 . 1 1 82 82 PHE H H 1 9.62 . . 1 . . . . 82 PHE H . 16113 1 798 . 1 1 82 82 PHE HA H 1 4.06 . . 1 . . . . 82 PHE HA . 16113 1 799 . 1 1 82 82 PHE HB2 H 1 2.97 . . 2 . . . . 82 PHE HB2 . 16113 1 800 . 1 1 82 82 PHE HB3 H 1 3.12 . . 2 . . . . 82 PHE HB3 . 16113 1 801 . 1 1 82 82 PHE HD1 H 1 6.92 . . 3 . . . . 82 PHE HD1 . 16113 1 802 . 1 1 82 82 PHE HD2 H 1 6.92 . . 3 . . . . 82 PHE HD2 . 16113 1 803 . 1 1 82 82 PHE HE1 H 1 7.45 . . 3 . . . . 82 PHE HE1 . 16113 1 804 . 1 1 82 82 PHE HE2 H 1 7.45 . . 3 . . . . 82 PHE HE2 . 16113 1 805 . 1 1 82 82 PHE HZ H 1 7.17 . . 1 . . . . 82 PHE HZ . 16113 1 806 . 1 1 82 82 PHE CA C 13 60.9 . . 1 . . . . 82 PHE CA . 16113 1 807 . 1 1 82 82 PHE CB C 13 39.5 . . 1 . . . . 82 PHE CB . 16113 1 808 . 1 1 82 82 PHE CD1 C 13 130.5 . . 1 . . . . 82 PHE CD1 . 16113 1 809 . 1 1 82 82 PHE CE1 C 13 130.5 . . 1 . . . . 82 PHE CE1 . 16113 1 810 . 1 1 82 82 PHE CZ C 13 129.9 . . 1 . . . . 82 PHE CZ . 16113 1 811 . 1 1 82 82 PHE N N 15 121.4 . . 1 . . . . 82 PHE N . 16113 1 812 . 1 1 83 83 LEU H H 1 8.21 . . 1 . . . . 83 LEU H . 16113 1 813 . 1 1 83 83 LEU HA H 1 3.90 . . 1 . . . . 83 LEU HA . 16113 1 814 . 1 1 83 83 LEU HB2 H 1 1.95 . . 2 . . . . 83 LEU HB2 . 16113 1 815 . 1 1 83 83 LEU HB3 H 1 1.58 . . 2 . . . . 83 LEU HB3 . 16113 1 816 . 1 1 83 83 LEU HD11 H 1 1.03 . . 2 . . . . 83 LEU HD1 . 16113 1 817 . 1 1 83 83 LEU HD12 H 1 1.03 . . 2 . . . . 83 LEU HD1 . 16113 1 818 . 1 1 83 83 LEU HD13 H 1 1.03 . . 2 . . . . 83 LEU HD1 . 16113 1 819 . 1 1 83 83 LEU HD21 H 1 0.88 . . 2 . . . . 83 LEU HD2 . 16113 1 820 . 1 1 83 83 LEU HD22 H 1 0.88 . . 2 . . . . 83 LEU HD2 . 16113 1 821 . 1 1 83 83 LEU HD23 H 1 0.88 . . 2 . . . . 83 LEU HD2 . 16113 1 822 . 1 1 83 83 LEU HG H 1 2.06 . . 1 . . . . 83 LEU HG . 16113 1 823 . 1 1 83 83 LEU CA C 13 57.0 . . 1 . . . . 83 LEU CA . 16113 1 824 . 1 1 83 83 LEU CB C 13 40.4 . . 1 . . . . 83 LEU CB . 16113 1 825 . 1 1 83 83 LEU CD1 C 13 22.1 . . 1 . . . . 83 LEU CD1 . 16113 1 826 . 1 1 83 83 LEU CD2 C 13 25.3 . . 1 . . . . 83 LEU CD2 . 16113 1 827 . 1 1 83 83 LEU CG C 13 27.0 . . 1 . . . . 83 LEU CG . 16113 1 828 . 1 1 83 83 LEU N N 15 117.4 . . 1 . . . . 83 LEU N . 16113 1 829 . 1 1 84 84 GLU H H 1 7.66 . . 1 . . . . 84 GLU H . 16113 1 830 . 1 1 84 84 GLU HA H 1 4.15 . . 1 . . . . 84 GLU HA . 16113 1 831 . 1 1 84 84 GLU HB2 H 1 2.09 . . 2 . . . . 84 GLU HB2 . 16113 1 832 . 1 1 84 84 GLU HB3 H 1 2.09 . . 2 . . . . 84 GLU HB3 . 16113 1 833 . 1 1 84 84 GLU HG2 H 1 2.30 . . 2 . . . . 84 GLU HG2 . 16113 1 834 . 1 1 84 84 GLU HG3 H 1 2.30 . . 2 . . . . 84 GLU HG3 . 16113 1 835 . 1 1 84 84 GLU CA C 13 59.5 . . 1 . . . . 84 GLU CA . 16113 1 836 . 1 1 84 84 GLU CB C 13 28.7 . . 1 . . . . 84 GLU CB . 16113 1 837 . 1 1 84 84 GLU CG C 13 35.9 . . 1 . . . . 84 GLU CG . 16113 1 838 . 1 1 84 84 GLU N N 15 121.5 . . 1 . . . . 84 GLU N . 16113 1 839 . 1 1 85 85 LEU H H 1 8.10 . . 1 . . . . 85 LEU H . 16113 1 840 . 1 1 85 85 LEU HA H 1 3.60 . . 1 . . . . 85 LEU HA . 16113 1 841 . 1 1 85 85 LEU HB2 H 1 1.56 . . 2 . . . . 85 LEU HB2 . 16113 1 842 . 1 1 85 85 LEU HB3 H 1 1.79 . . 2 . . . . 85 LEU HB3 . 16113 1 843 . 1 1 85 85 LEU HD11 H 1 0.70 . . 2 . . . . 85 LEU HD1 . 16113 1 844 . 1 1 85 85 LEU HD12 H 1 0.70 . . 2 . . . . 85 LEU HD1 . 16113 1 845 . 1 1 85 85 LEU HD13 H 1 0.70 . . 2 . . . . 85 LEU HD1 . 16113 1 846 . 1 1 85 85 LEU HD21 H 1 0.72 . . 2 . . . . 85 LEU HD2 . 16113 1 847 . 1 1 85 85 LEU HD22 H 1 0.72 . . 2 . . . . 85 LEU HD2 . 16113 1 848 . 1 1 85 85 LEU HD23 H 1 0.72 . . 2 . . . . 85 LEU HD2 . 16113 1 849 . 1 1 85 85 LEU HG H 1 1.47 . . 1 . . . . 85 LEU HG . 16113 1 850 . 1 1 85 85 LEU CA C 13 59.3 . . 1 . . . . 85 LEU CA . 16113 1 851 . 1 1 85 85 LEU CB C 13 41.8 . . 1 . . . . 85 LEU CB . 16113 1 852 . 1 1 85 85 LEU CD1 C 13 28.3 . . 1 . . . . 85 LEU CD1 . 16113 1 853 . 1 1 85 85 LEU CD2 C 13 23.4 . . 1 . . . . 85 LEU CD2 . 16113 1 854 . 1 1 85 85 LEU CG C 13 26.8 . . 1 . . . . 85 LEU CG . 16113 1 855 . 1 1 85 85 LEU N N 15 121.7 . . 1 . . . . 85 LEU N . 16113 1 856 . 1 1 86 86 VAL H H 1 8.22 . . 1 . . . . 86 VAL H . 16113 1 857 . 1 1 86 86 VAL HA H 1 3.10 . . 1 . . . . 86 VAL HA . 16113 1 858 . 1 1 86 86 VAL HB H 1 1.87 . . 1 . . . . 86 VAL HB . 16113 1 859 . 1 1 86 86 VAL HG11 H 1 0.81 . . 2 . . . . 86 VAL HG1 . 16113 1 860 . 1 1 86 86 VAL HG12 H 1 0.81 . . 2 . . . . 86 VAL HG1 . 16113 1 861 . 1 1 86 86 VAL HG13 H 1 0.81 . . 2 . . . . 86 VAL HG1 . 16113 1 862 . 1 1 86 86 VAL HG21 H 1 0.29 . . 2 . . . . 86 VAL HG2 . 16113 1 863 . 1 1 86 86 VAL HG22 H 1 0.29 . . 2 . . . . 86 VAL HG2 . 16113 1 864 . 1 1 86 86 VAL HG23 H 1 0.29 . . 2 . . . . 86 VAL HG2 . 16113 1 865 . 1 1 86 86 VAL CA C 13 67.2 . . 1 . . . . 86 VAL CA . 16113 1 866 . 1 1 86 86 VAL CB C 13 31.5 . . 1 . . . . 86 VAL CB . 16113 1 867 . 1 1 86 86 VAL CG1 C 13 22.0 . . 1 . . . . 86 VAL CG1 . 16113 1 868 . 1 1 86 86 VAL CG2 C 13 21.2 . . 1 . . . . 86 VAL CG2 . 16113 1 869 . 1 1 86 86 VAL N N 15 118.4 . . 1 . . . . 86 VAL N . 16113 1 870 . 1 1 87 87 LEU H H 1 8.45 . . 1 . . . . 87 LEU H . 16113 1 871 . 1 1 87 87 LEU HA H 1 3.96 . . 1 . . . . 87 LEU HA . 16113 1 872 . 1 1 87 87 LEU HB2 H 1 1.62 . . 2 . . . . 87 LEU HB2 . 16113 1 873 . 1 1 87 87 LEU HB3 H 1 2.01 . . 2 . . . . 87 LEU HB3 . 16113 1 874 . 1 1 87 87 LEU HD11 H 1 0.93 . . 2 . . . . 87 LEU HD1 . 16113 1 875 . 1 1 87 87 LEU HD12 H 1 0.93 . . 2 . . . . 87 LEU HD1 . 16113 1 876 . 1 1 87 87 LEU HD13 H 1 0.93 . . 2 . . . . 87 LEU HD1 . 16113 1 877 . 1 1 87 87 LEU HD21 H 1 1.01 . . 2 . . . . 87 LEU HD2 . 16113 1 878 . 1 1 87 87 LEU HD22 H 1 1.01 . . 2 . . . . 87 LEU HD2 . 16113 1 879 . 1 1 87 87 LEU HD23 H 1 1.01 . . 2 . . . . 87 LEU HD2 . 16113 1 880 . 1 1 87 87 LEU HG H 1 1.54 . . 1 . . . . 87 LEU HG . 16113 1 881 . 1 1 87 87 LEU CA C 13 59.1 . . 1 . . . . 87 LEU CA . 16113 1 882 . 1 1 87 87 LEU CB C 13 42.3 . . 1 . . . . 87 LEU CB . 16113 1 883 . 1 1 87 87 LEU CD1 C 13 23.1 . . 1 . . . . 87 LEU CD1 . 16113 1 884 . 1 1 87 87 LEU CD2 C 13 25.7 . . 1 . . . . 87 LEU CD2 . 16113 1 885 . 1 1 87 87 LEU CG C 13 26.8 . . 1 . . . . 87 LEU CG . 16113 1 886 . 1 1 87 87 LEU N N 15 120.2 . . 1 . . . . 87 LEU N . 16113 1 887 . 1 1 88 88 GLN H H 1 9.35 . . 1 . . . . 88 GLN H . 16113 1 888 . 1 1 88 88 GLN HA H 1 4.18 . . 1 . . . . 88 GLN HA . 16113 1 889 . 1 1 88 88 GLN HB2 H 1 2.41 . . 2 . . . . 88 GLN HB2 . 16113 1 890 . 1 1 88 88 GLN HB3 H 1 2.23 . . 2 . . . . 88 GLN HB3 . 16113 1 891 . 1 1 88 88 GLN HE21 H 1 7.55 . . 2 . . . . 88 GLN HE21 . 16113 1 892 . 1 1 88 88 GLN HE22 H 1 6.83 . . 2 . . . . 88 GLN HE22 . 16113 1 893 . 1 1 88 88 GLN HG2 H 1 2.37 . . 2 . . . . 88 GLN HG2 . 16113 1 894 . 1 1 88 88 GLN HG3 H 1 2.37 . . 2 . . . . 88 GLN HG3 . 16113 1 895 . 1 1 88 88 GLN CA C 13 57.3 . . 1 . . . . 88 GLN CA . 16113 1 896 . 1 1 88 88 GLN CB C 13 25.4 . . 1 . . . . 88 GLN CB . 16113 1 897 . 1 1 88 88 GLN CG C 13 34.1 . . 1 . . . . 88 GLN CG . 16113 1 898 . 1 1 88 88 GLN N N 15 114.9 . . 1 . . . . 88 GLN N . 16113 1 899 . 1 1 88 88 GLN NE2 N 15 111.3 . . 1 . . . . 88 GLN NE2 . 16113 1 900 . 1 1 89 89 SER H H 1 8.68 . . 1 . . . . 89 SER H . 16113 1 901 . 1 1 89 89 SER HA H 1 4.08 . . 1 . . . . 89 SER HA . 16113 1 902 . 1 1 89 89 SER HB2 H 1 4.00 . . 2 . . . . 89 SER HB2 . 16113 1 903 . 1 1 89 89 SER HB3 H 1 4.00 . . 2 . . . . 89 SER HB3 . 16113 1 904 . 1 1 89 89 SER CA C 13 61.9 . . 1 . . . . 89 SER CA . 16113 1 905 . 1 1 89 89 SER CB C 13 62.2 . . 1 . . . . 89 SER CB . 16113 1 906 . 1 1 89 89 SER N N 15 117.5 . . 1 . . . . 89 SER N . 16113 1 907 . 1 1 90 90 TYR H H 1 7.33 . . 1 . . . . 90 TYR H . 16113 1 908 . 1 1 90 90 TYR HA H 1 4.32 . . 1 . . . . 90 TYR HA . 16113 1 909 . 1 1 90 90 TYR HB2 H 1 2.76 . . 2 . . . . 90 TYR HB2 . 16113 1 910 . 1 1 90 90 TYR HB3 H 1 2.59 . . 2 . . . . 90 TYR HB3 . 16113 1 911 . 1 1 90 90 TYR HD1 H 1 6.39 . . 3 . . . . 90 TYR HD1 . 16113 1 912 . 1 1 90 90 TYR HD2 H 1 6.39 . . 3 . . . . 90 TYR HD2 . 16113 1 913 . 1 1 90 90 TYR HE1 H 1 6.13 . . 3 . . . . 90 TYR HE1 . 16113 1 914 . 1 1 90 90 TYR HE2 H 1 6.13 . . 3 . . . . 90 TYR HE2 . 16113 1 915 . 1 1 90 90 TYR CA C 13 59.7 . . 1 . . . . 90 TYR CA . 16113 1 916 . 1 1 90 90 TYR CB C 13 41.4 . . 1 . . . . 90 TYR CB . 16113 1 917 . 1 1 90 90 TYR CD1 C 13 132.4 . . 1 . . . . 90 TYR CD1 . 16113 1 918 . 1 1 90 90 TYR CE1 C 13 116.4 . . 1 . . . . 90 TYR CE1 . 16113 1 919 . 1 1 90 90 TYR N N 15 116.0 . . 1 . . . . 90 TYR N . 16113 1 920 . 1 1 91 91 VAL H H 1 7.73 . . 1 . . . . 91 VAL H . 16113 1 921 . 1 1 91 91 VAL HA H 1 4.01 . . 1 . . . . 91 VAL HA . 16113 1 922 . 1 1 91 91 VAL HB H 1 1.93 . . 1 . . . . 91 VAL HB . 16113 1 923 . 1 1 91 91 VAL HG11 H 1 0.91 . . 2 . . . . 91 VAL HG1 . 16113 1 924 . 1 1 91 91 VAL HG12 H 1 0.91 . . 2 . . . . 91 VAL HG1 . 16113 1 925 . 1 1 91 91 VAL HG13 H 1 0.91 . . 2 . . . . 91 VAL HG1 . 16113 1 926 . 1 1 91 91 VAL HG21 H 1 0.85 . . 2 . . . . 91 VAL HG2 . 16113 1 927 . 1 1 91 91 VAL HG22 H 1 0.85 . . 2 . . . . 91 VAL HG2 . 16113 1 928 . 1 1 91 91 VAL HG23 H 1 0.85 . . 2 . . . . 91 VAL HG2 . 16113 1 929 . 1 1 91 91 VAL CA C 13 62.6 . . 1 . . . . 91 VAL CA . 16113 1 930 . 1 1 91 91 VAL CB C 13 32.7 . . 1 . . . . 91 VAL CB . 16113 1 931 . 1 1 91 91 VAL CG1 C 13 21.7 . . 1 . . . . 91 VAL CG1 . 16113 1 932 . 1 1 91 91 VAL CG2 C 13 20.2 . . 1 . . . . 91 VAL CG2 . 16113 1 933 . 1 1 91 91 VAL N N 15 110.5 . . 1 . . . . 91 VAL N . 16113 1 934 . 1 1 92 92 HIS H H 1 8.60 . . 1 . . . . 92 HIS H . 16113 1 935 . 1 1 92 92 HIS HA H 1 4.28 . . 1 . . . . 92 HIS HA . 16113 1 936 . 1 1 92 92 HIS HB2 H 1 2.91 . . 2 . . . . 92 HIS HB2 . 16113 1 937 . 1 1 92 92 HIS HB3 H 1 3.26 . . 2 . . . . 92 HIS HB3 . 16113 1 938 . 1 1 92 92 HIS HD2 H 1 6.96 . . 1 . . . . 92 HIS HD2 . 16113 1 939 . 1 1 92 92 HIS CA C 13 56.0 . . 1 . . . . 92 HIS CA . 16113 1 940 . 1 1 92 92 HIS CB C 13 29.2 . . 1 . . . . 92 HIS CB . 16113 1 941 . 1 1 92 92 HIS CD2 C 13 117.7 . . 1 . . . . 92 HIS CD2 . 16113 1 942 . 1 1 92 92 HIS N N 15 114.5 . . 1 . . . . 92 HIS N . 16113 1 943 . 1 1 93 93 HIS H H 1 8.35 . . 1 . . . . 93 HIS H . 16113 1 944 . 1 1 93 93 HIS HA H 1 4.78 . . 1 . . . . 93 HIS HA . 16113 1 945 . 1 1 93 93 HIS HB2 H 1 3.28 . . 2 . . . . 93 HIS HB2 . 16113 1 946 . 1 1 93 93 HIS HB3 H 1 3.28 . . 2 . . . . 93 HIS HB3 . 16113 1 947 . 1 1 93 93 HIS HD2 H 1 6.89 . . 1 . . . . 93 HIS HD2 . 16113 1 948 . 1 1 93 93 HIS CA C 13 57.6 . . 1 . . . . 93 HIS CA . 16113 1 949 . 1 1 93 93 HIS CB C 13 31.9 . . 1 . . . . 93 HIS CB . 16113 1 950 . 1 1 93 93 HIS CD2 C 13 118.6 . . 1 . . . . 93 HIS CD2 . 16113 1 951 . 1 1 93 93 HIS N N 15 118.2 . . 1 . . . . 93 HIS N . 16113 1 952 . 1 1 94 94 ILE H H 1 7.47 . . 1 . . . . 94 ILE H . 16113 1 953 . 1 1 94 94 ILE HA H 1 4.37 . . 1 . . . . 94 ILE HA . 16113 1 954 . 1 1 94 94 ILE HB H 1 1.96 . . 1 . . . . 94 ILE HB . 16113 1 955 . 1 1 94 94 ILE HD11 H 1 0.88 . . 1 . . . . 94 ILE HD1 . 16113 1 956 . 1 1 94 94 ILE HD12 H 1 0.88 . . 1 . . . . 94 ILE HD1 . 16113 1 957 . 1 1 94 94 ILE HD13 H 1 0.88 . . 1 . . . . 94 ILE HD1 . 16113 1 958 . 1 1 94 94 ILE HG12 H 1 1.53 . . 2 . . . . 94 ILE HG12 . 16113 1 959 . 1 1 94 94 ILE HG13 H 1 1.28 . . 2 . . . . 94 ILE HG13 . 16113 1 960 . 1 1 94 94 ILE HG21 H 1 1.04 . . 1 . . . . 94 ILE HG2 . 16113 1 961 . 1 1 94 94 ILE HG22 H 1 1.04 . . 1 . . . . 94 ILE HG2 . 16113 1 962 . 1 1 94 94 ILE HG23 H 1 1.04 . . 1 . . . . 94 ILE HG2 . 16113 1 963 . 1 1 94 94 ILE CA C 13 60.9 . . 1 . . . . 94 ILE CA . 16113 1 964 . 1 1 94 94 ILE CB C 13 39.6 . . 1 . . . . 94 ILE CB . 16113 1 965 . 1 1 94 94 ILE CD1 C 13 14.1 . . 1 . . . . 94 ILE CD1 . 16113 1 966 . 1 1 94 94 ILE CG1 C 13 27.2 . . 1 . . . . 94 ILE CG1 . 16113 1 967 . 1 1 94 94 ILE CG2 C 13 17.7 . . 1 . . . . 94 ILE CG2 . 16113 1 968 . 1 1 94 94 ILE N N 15 111.4 . . 1 . . . . 94 ILE N . 16113 1 969 . 1 1 95 95 HIS H H 1 6.99 . . 1 . . . . 95 HIS H . 16113 1 970 . 1 1 96 96 LYS HA H 1 4.04 . . 1 . . . . 96 LYS HA . 16113 1 971 . 1 1 96 96 LYS HD2 H 1 1.96 . . 2 . . . . 96 LYS HD2 . 16113 1 972 . 1 1 96 96 LYS HD3 H 1 1.96 . . 2 . . . . 96 LYS HD3 . 16113 1 973 . 1 1 96 96 LYS HE2 H 1 2.93 . . 2 . . . . 96 LYS HE2 . 16113 1 974 . 1 1 96 96 LYS HE3 H 1 2.93 . . 2 . . . . 96 LYS HE3 . 16113 1 975 . 1 1 96 96 LYS HG2 H 1 1.49 . . 2 . . . . 96 LYS HG2 . 16113 1 976 . 1 1 96 96 LYS HG3 H 1 1.49 . . 2 . . . . 96 LYS HG3 . 16113 1 977 . 1 1 97 97 LYS HA H 1 4.13 . . 1 . . . . 97 LYS HA . 16113 1 978 . 1 1 97 97 LYS HB2 H 1 1.96 . . 2 . . . . 97 LYS HB2 . 16113 1 979 . 1 1 97 97 LYS HB3 H 1 1.96 . . 2 . . . . 97 LYS HB3 . 16113 1 980 . 1 1 97 97 LYS HD2 H 1 1.63 . . 2 . . . . 97 LYS HD2 . 16113 1 981 . 1 1 97 97 LYS HD3 H 1 1.63 . . 2 . . . . 97 LYS HD3 . 16113 1 982 . 1 1 97 97 LYS HE2 H 1 2.98 . . 2 . . . . 97 LYS HE2 . 16113 1 983 . 1 1 97 97 LYS HE3 H 1 2.98 . . 2 . . . . 97 LYS HE3 . 16113 1 984 . 1 1 97 97 LYS HG2 H 1 1.49 . . 2 . . . . 97 LYS HG2 . 16113 1 985 . 1 1 97 97 LYS HG3 H 1 1.49 . . 2 . . . . 97 LYS HG3 . 16113 1 986 . 1 1 97 97 LYS CA C 13 59.4 . . 1 . . . . 97 LYS CA . 16113 1 987 . 1 1 97 97 LYS CB C 13 32.0 . . 1 . . . . 97 LYS CB . 16113 1 988 . 1 1 97 97 LYS CD C 13 28.8 . . 1 . . . . 97 LYS CD . 16113 1 989 . 1 1 97 97 LYS CE C 13 42.1 . . 1 . . . . 97 LYS CE . 16113 1 990 . 1 1 97 97 LYS CG C 13 25.2 . . 1 . . . . 97 LYS CG . 16113 1 991 . 1 1 98 98 ARG H H 1 7.15 . . 1 . . . . 98 ARG H . 16113 1 992 . 1 1 98 98 ARG HA H 1 4.15 . . 1 . . . . 98 ARG HA . 16113 1 993 . 1 1 98 98 ARG HB2 H 1 1.74 . . 2 . . . . 98 ARG HB2 . 16113 1 994 . 1 1 98 98 ARG HB3 H 1 1.74 . . 2 . . . . 98 ARG HB3 . 16113 1 995 . 1 1 98 98 ARG HD2 H 1 3.17 . . 2 . . . . 98 ARG HD2 . 16113 1 996 . 1 1 98 98 ARG HD3 H 1 3.17 . . 2 . . . . 98 ARG HD3 . 16113 1 997 . 1 1 98 98 ARG HG2 H 1 1.61 . . 2 . . . . 98 ARG HG2 . 16113 1 998 . 1 1 98 98 ARG HG3 H 1 1.61 . . 2 . . . . 98 ARG HG3 . 16113 1 999 . 1 1 98 98 ARG CA C 13 57.9 . . 1 . . . . 98 ARG CA . 16113 1 1000 . 1 1 98 98 ARG CB C 13 28.6 . . 1 . . . . 98 ARG CB . 16113 1 1001 . 1 1 98 98 ARG CD C 13 43.1 . . 1 . . . . 98 ARG CD . 16113 1 1002 . 1 1 98 98 ARG CG C 13 27.0 . . 1 . . . . 98 ARG CG . 16113 1 1003 . 1 1 98 98 ARG N N 15 118.5 . . 1 . . . . 98 ARG N . 16113 1 1004 . 1 1 99 99 PHE H H 1 8.26 . . 1 . . . . 99 PHE H . 16113 1 1005 . 1 1 99 99 PHE HA H 1 3.45 . . 1 . . . . 99 PHE HA . 16113 1 1006 . 1 1 99 99 PHE HB2 H 1 2.20 . . 2 . . . . 99 PHE HB2 . 16113 1 1007 . 1 1 99 99 PHE HB3 H 1 2.53 . . 2 . . . . 99 PHE HB3 . 16113 1 1008 . 1 1 99 99 PHE HD1 H 1 6.45 . . 3 . . . . 99 PHE HD1 . 16113 1 1009 . 1 1 99 99 PHE HD2 H 1 6.45 . . 3 . . . . 99 PHE HD2 . 16113 1 1010 . 1 1 99 99 PHE HE1 H 1 7.08 . . 3 . . . . 99 PHE HE1 . 16113 1 1011 . 1 1 99 99 PHE HE2 H 1 7.08 . . 3 . . . . 99 PHE HE2 . 16113 1 1012 . 1 1 99 99 PHE HZ H 1 6.67 . . 1 . . . . 99 PHE HZ . 16113 1 1013 . 1 1 99 99 PHE CA C 13 62.7 . . 1 . . . . 99 PHE CA . 16113 1 1014 . 1 1 99 99 PHE CB C 13 39.2 . . 1 . . . . 99 PHE CB . 16113 1 1015 . 1 1 99 99 PHE CD1 C 13 130.2 . . 1 . . . . 99 PHE CD1 . 16113 1 1016 . 1 1 99 99 PHE CE1 C 13 130.0 . . 1 . . . . 99 PHE CE1 . 16113 1 1017 . 1 1 99 99 PHE CZ C 13 128.2 . . 1 . . . . 99 PHE CZ . 16113 1 1018 . 1 1 99 99 PHE N N 15 119.1 . . 1 . . . . 99 PHE N . 16113 1 1019 . 1 1 100 100 LYS H H 1 8.50 . . 1 . . . . 100 LYS H . 16113 1 1020 . 1 1 100 100 LYS HA H 1 3.98 . . 1 . . . . 100 LYS HA . 16113 1 1021 . 1 1 100 100 LYS HB2 H 1 1.97 . . 2 . . . . 100 LYS HB2 . 16113 1 1022 . 1 1 100 100 LYS HB3 H 1 2.02 . . 2 . . . . 100 LYS HB3 . 16113 1 1023 . 1 1 100 100 LYS HD2 H 1 1.71 . . 2 . . . . 100 LYS HD2 . 16113 1 1024 . 1 1 100 100 LYS HD3 H 1 1.74 . . 2 . . . . 100 LYS HD3 . 16113 1 1025 . 1 1 100 100 LYS HE2 H 1 3.00 . . 2 . . . . 100 LYS HE2 . 16113 1 1026 . 1 1 100 100 LYS HE3 H 1 3.00 . . 2 . . . . 100 LYS HE3 . 16113 1 1027 . 1 1 100 100 LYS HG2 H 1 1.46 . . 2 . . . . 100 LYS HG2 . 16113 1 1028 . 1 1 100 100 LYS HG3 H 1 1.52 . . 2 . . . . 100 LYS HG3 . 16113 1 1029 . 1 1 100 100 LYS CA C 13 59.3 . . 1 . . . . 100 LYS CA . 16113 1 1030 . 1 1 100 100 LYS CB C 13 31.9 . . 1 . . . . 100 LYS CB . 16113 1 1031 . 1 1 100 100 LYS CD C 13 29.0 . . 1 . . . . 100 LYS CD . 16113 1 1032 . 1 1 100 100 LYS CE C 13 42.0 . . 1 . . . . 100 LYS CE . 16113 1 1033 . 1 1 100 100 LYS CG C 13 24.8 . . 1 . . . . 100 LYS CG . 16113 1 1034 . 1 1 100 100 LYS N N 15 121.7 . . 1 . . . . 100 LYS N . 16113 1 1035 . 1 1 101 101 ASP H H 1 8.15 . . 1 . . . . 101 ASP H . 16113 1 1036 . 1 1 101 101 ASP HA H 1 4.29 . . 1 . . . . 101 ASP HA . 16113 1 1037 . 1 1 101 101 ASP HB2 H 1 2.61 . . 2 . . . . 101 ASP HB2 . 16113 1 1038 . 1 1 101 101 ASP HB3 H 1 2.87 . . 2 . . . . 101 ASP HB3 . 16113 1 1039 . 1 1 101 101 ASP CA C 13 57.3 . . 1 . . . . 101 ASP CA . 16113 1 1040 . 1 1 101 101 ASP CB C 13 39.9 . . 1 . . . . 101 ASP CB . 16113 1 1041 . 1 1 101 101 ASP N N 15 119.8 . . 1 . . . . 101 ASP N . 16113 1 1042 . 1 1 102 102 ILE H H 1 8.22 . . 1 . . . . 102 ILE H . 16113 1 1043 . 1 1 102 102 ILE HA H 1 3.69 . . 1 . . . . 102 ILE HA . 16113 1 1044 . 1 1 102 102 ILE HB H 1 1.55 . . 1 . . . . 102 ILE HB . 16113 1 1045 . 1 1 102 102 ILE HD11 H 1 0.57 . . 1 . . . . 102 ILE HD1 . 16113 1 1046 . 1 1 102 102 ILE HD12 H 1 0.57 . . 1 . . . . 102 ILE HD1 . 16113 1 1047 . 1 1 102 102 ILE HD13 H 1 0.57 . . 1 . . . . 102 ILE HD1 . 16113 1 1048 . 1 1 102 102 ILE HG12 H 1 1.06 . . 2 . . . . 102 ILE HG12 . 16113 1 1049 . 1 1 102 102 ILE HG13 H 1 1.37 . . 2 . . . . 102 ILE HG13 . 16113 1 1050 . 1 1 102 102 ILE HG21 H 1 0.66 . . 1 . . . . 102 ILE HG2 . 16113 1 1051 . 1 1 102 102 ILE HG22 H 1 0.66 . . 1 . . . . 102 ILE HG2 . 16113 1 1052 . 1 1 102 102 ILE HG23 H 1 0.66 . . 1 . . . . 102 ILE HG2 . 16113 1 1053 . 1 1 102 102 ILE CA C 13 65.0 . . 1 . . . . 102 ILE CA . 16113 1 1054 . 1 1 102 102 ILE CB C 13 37.7 . . 1 . . . . 102 ILE CB . 16113 1 1055 . 1 1 102 102 ILE CD1 C 13 13.3 . . 1 . . . . 102 ILE CD1 . 16113 1 1056 . 1 1 102 102 ILE CG1 C 13 27.4 . . 1 . . . . 102 ILE CG1 . 16113 1 1057 . 1 1 102 102 ILE CG2 C 13 17.6 . . 1 . . . . 102 ILE CG2 . 16113 1 1058 . 1 1 102 102 ILE N N 15 118.8 . . 1 . . . . 102 ILE N . 16113 1 1059 . 1 1 103 103 THR H H 1 7.93 . . 1 . . . . 103 THR H . 16113 1 1060 . 1 1 103 103 THR HA H 1 3.48 . . 1 . . . . 103 THR HA . 16113 1 1061 . 1 1 103 103 THR HB H 1 4.09 . . 1 . . . . 103 THR HB . 16113 1 1062 . 1 1 103 103 THR HG1 H 1 3.26 . . 1 . . . . 103 THR HG1 . 16113 1 1063 . 1 1 103 103 THR HG21 H 1 1.00 . . 1 . . . . 103 THR HG2 . 16113 1 1064 . 1 1 103 103 THR HG22 H 1 1.00 . . 1 . . . . 103 THR HG2 . 16113 1 1065 . 1 1 103 103 THR HG23 H 1 1.00 . . 1 . . . . 103 THR HG2 . 16113 1 1066 . 1 1 103 103 THR CA C 13 67.3 . . 1 . . . . 103 THR CA . 16113 1 1067 . 1 1 103 103 THR CB C 13 67.7 . . 1 . . . . 103 THR CB . 16113 1 1068 . 1 1 103 103 THR CG2 C 13 21.1 . . 1 . . . . 103 THR CG2 . 16113 1 1069 . 1 1 103 103 THR N N 15 117.9 . . 1 . . . . 103 THR N . 16113 1 1070 . 1 1 104 104 GLU H H 1 8.47 . . 1 . . . . 104 GLU H . 16113 1 1071 . 1 1 104 104 GLU HA H 1 3.92 . . 1 . . . . 104 GLU HA . 16113 1 1072 . 1 1 104 104 GLU HB2 H 1 1.98 . . 2 . . . . 104 GLU HB2 . 16113 1 1073 . 1 1 104 104 GLU HB3 H 1 2.08 . . 2 . . . . 104 GLU HB3 . 16113 1 1074 . 1 1 104 104 GLU HG2 H 1 2.20 . . 2 . . . . 104 GLU HG2 . 16113 1 1075 . 1 1 104 104 GLU HG3 H 1 2.46 . . 2 . . . . 104 GLU HG3 . 16113 1 1076 . 1 1 104 104 GLU CA C 13 59.5 . . 1 . . . . 104 GLU CA . 16113 1 1077 . 1 1 104 104 GLU CB C 13 29.2 . . 1 . . . . 104 GLU CB . 16113 1 1078 . 1 1 104 104 GLU CG C 13 36.7 . . 1 . . . . 104 GLU CG . 16113 1 1079 . 1 1 104 104 GLU N N 15 118.9 . . 1 . . . . 104 GLU N . 16113 1 1080 . 1 1 105 105 SER H H 1 7.84 . . 1 . . . . 105 SER H . 16113 1 1081 . 1 1 105 105 SER HA H 1 4.29 . . 1 . . . . 105 SER HA . 16113 1 1082 . 1 1 105 105 SER HB2 H 1 3.96 . . 2 . . . . 105 SER HB2 . 16113 1 1083 . 1 1 105 105 SER HB3 H 1 3.96 . . 2 . . . . 105 SER HB3 . 16113 1 1084 . 1 1 105 105 SER CA C 13 60.9 . . 1 . . . . 105 SER CA . 16113 1 1085 . 1 1 105 105 SER CB C 13 62.7 . . 1 . . . . 105 SER CB . 16113 1 1086 . 1 1 105 105 SER N N 15 114.2 . . 1 . . . . 105 SER N . 16113 1 1087 . 1 1 106 106 VAL H H 1 8.29 . . 1 . . . . 106 VAL H . 16113 1 1088 . 1 1 106 106 VAL HA H 1 3.69 . . 1 . . . . 106 VAL HA . 16113 1 1089 . 1 1 106 106 VAL HB H 1 2.15 . . 1 . . . . 106 VAL HB . 16113 1 1090 . 1 1 106 106 VAL HG11 H 1 0.85 . . 2 . . . . 106 VAL HG1 . 16113 1 1091 . 1 1 106 106 VAL HG12 H 1 0.85 . . 2 . . . . 106 VAL HG1 . 16113 1 1092 . 1 1 106 106 VAL HG13 H 1 0.85 . . 2 . . . . 106 VAL HG1 . 16113 1 1093 . 1 1 106 106 VAL HG21 H 1 1.06 . . 2 . . . . 106 VAL HG2 . 16113 1 1094 . 1 1 106 106 VAL HG22 H 1 1.06 . . 2 . . . . 106 VAL HG2 . 16113 1 1095 . 1 1 106 106 VAL HG23 H 1 1.06 . . 2 . . . . 106 VAL HG2 . 16113 1 1096 . 1 1 106 106 VAL CA C 13 66.3 . . 1 . . . . 106 VAL CA . 16113 1 1097 . 1 1 106 106 VAL CB C 13 31.9 . . 1 . . . . 106 VAL CB . 16113 1 1098 . 1 1 106 106 VAL CG1 C 13 22.0 . . 1 . . . . 106 VAL CG1 . 16113 1 1099 . 1 1 106 106 VAL CG2 C 13 24.5 . . 1 . . . . 106 VAL CG2 . 16113 1 1100 . 1 1 106 106 VAL N N 15 122.1 . . 1 . . . . 106 VAL N . 16113 1 1101 . 1 1 107 107 LEU H H 1 8.56 . . 1 . . . . 107 LEU H . 16113 1 1102 . 1 1 107 107 LEU HA H 1 3.90 . . 1 . . . . 107 LEU HA . 16113 1 1103 . 1 1 107 107 LEU HB2 H 1 1.98 . . 2 . . . . 107 LEU HB2 . 16113 1 1104 . 1 1 107 107 LEU HB3 H 1 1.44 . . 2 . . . . 107 LEU HB3 . 16113 1 1105 . 1 1 107 107 LEU HD11 H 1 0.87 . . 2 . . . . 107 LEU HD1 . 16113 1 1106 . 1 1 107 107 LEU HD12 H 1 0.87 . . 2 . . . . 107 LEU HD1 . 16113 1 1107 . 1 1 107 107 LEU HD13 H 1 0.87 . . 2 . . . . 107 LEU HD1 . 16113 1 1108 . 1 1 107 107 LEU HD21 H 1 0.98 . . 2 . . . . 107 LEU HD2 . 16113 1 1109 . 1 1 107 107 LEU HD22 H 1 0.98 . . 2 . . . . 107 LEU HD2 . 16113 1 1110 . 1 1 107 107 LEU HD23 H 1 0.98 . . 2 . . . . 107 LEU HD2 . 16113 1 1111 . 1 1 107 107 LEU HG H 1 1.72 . . 1 . . . . 107 LEU HG . 16113 1 1112 . 1 1 107 107 LEU CA C 13 58.3 . . 1 . . . . 107 LEU CA . 16113 1 1113 . 1 1 107 107 LEU CB C 13 41.2 . . 1 . . . . 107 LEU CB . 16113 1 1114 . 1 1 107 107 LEU CD1 C 13 24.3 . . 1 . . . . 107 LEU CD1 . 16113 1 1115 . 1 1 107 107 LEU CD2 C 13 25.7 . . 1 . . . . 107 LEU CD2 . 16113 1 1116 . 1 1 107 107 LEU CG C 13 27.4 . . 1 . . . . 107 LEU CG . 16113 1 1117 . 1 1 107 107 LEU N N 15 117.5 . . 1 . . . . 107 LEU N . 16113 1 1118 . 1 1 108 108 TYR H H 1 8.45 . . 1 . . . . 108 TYR H . 16113 1 1119 . 1 1 108 108 TYR HA H 1 4.17 . . 1 . . . . 108 TYR HA . 16113 1 1120 . 1 1 108 108 TYR HB2 H 1 3.28 . . 2 . . . . 108 TYR HB2 . 16113 1 1121 . 1 1 108 108 TYR HB3 H 1 3.17 . . 2 . . . . 108 TYR HB3 . 16113 1 1122 . 1 1 108 108 TYR HD1 H 1 7.13 . . 3 . . . . 108 TYR HD1 . 16113 1 1123 . 1 1 108 108 TYR HD2 H 1 7.13 . . 3 . . . . 108 TYR HD2 . 16113 1 1124 . 1 1 108 108 TYR HE1 H 1 6.81 . . 3 . . . . 108 TYR HE1 . 16113 1 1125 . 1 1 108 108 TYR HE2 H 1 6.81 . . 3 . . . . 108 TYR HE2 . 16113 1 1126 . 1 1 108 108 TYR CA C 13 61.8 . . 1 . . . . 108 TYR CA . 16113 1 1127 . 1 1 108 108 TYR CB C 13 37.9 . . 1 . . . . 108 TYR CB . 16113 1 1128 . 1 1 108 108 TYR CD1 C 13 132.7 . . 1 . . . . 108 TYR CD1 . 16113 1 1129 . 1 1 108 108 TYR CE1 C 13 117.4 . . 1 . . . . 108 TYR CE1 . 16113 1 1130 . 1 1 108 108 TYR N N 15 119.0 . . 1 . . . . 108 TYR N . 16113 1 1131 . 1 1 109 109 THR H H 1 7.80 . . 1 . . . . 109 THR H . 16113 1 1132 . 1 1 109 109 THR HA H 1 3.86 . . 1 . . . . 109 THR HA . 16113 1 1133 . 1 1 109 109 THR HB H 1 4.18 . . 1 . . . . 109 THR HB . 16113 1 1134 . 1 1 109 109 THR HG21 H 1 1.23 . . 1 . . . . 109 THR HG2 . 16113 1 1135 . 1 1 109 109 THR HG22 H 1 1.23 . . 1 . . . . 109 THR HG2 . 16113 1 1136 . 1 1 109 109 THR HG23 H 1 1.23 . . 1 . . . . 109 THR HG2 . 16113 1 1137 . 1 1 109 109 THR CA C 13 66.8 . . 1 . . . . 109 THR CA . 16113 1 1138 . 1 1 109 109 THR CB C 13 67.8 . . 1 . . . . 109 THR CB . 16113 1 1139 . 1 1 109 109 THR CG2 C 13 23.0 . . 1 . . . . 109 THR CG2 . 16113 1 1140 . 1 1 109 109 THR N N 15 116.5 . . 1 . . . . 109 THR N . 16113 1 1141 . 1 1 110 110 LEU H H 1 8.51 . . 1 . . . . 110 LEU H . 16113 1 1142 . 1 1 110 110 LEU HA H 1 3.90 . . 1 . . . . 110 LEU HA . 16113 1 1143 . 1 1 110 110 LEU HB2 H 1 0.98 . . 2 . . . . 110 LEU HB2 . 16113 1 1144 . 1 1 110 110 LEU HB3 H 1 1.61 . . 2 . . . . 110 LEU HB3 . 16113 1 1145 . 1 1 110 110 LEU HD11 H 1 0.37 . . 2 . . . . 110 LEU HD1 . 16113 1 1146 . 1 1 110 110 LEU HD12 H 1 0.37 . . 2 . . . . 110 LEU HD1 . 16113 1 1147 . 1 1 110 110 LEU HD13 H 1 0.37 . . 2 . . . . 110 LEU HD1 . 16113 1 1148 . 1 1 110 110 LEU HD21 H 1 0.02 . . 2 . . . . 110 LEU HD2 . 16113 1 1149 . 1 1 110 110 LEU HD22 H 1 0.02 . . 2 . . . . 110 LEU HD2 . 16113 1 1150 . 1 1 110 110 LEU HD23 H 1 0.02 . . 2 . . . . 110 LEU HD2 . 16113 1 1151 . 1 1 110 110 LEU HG H 1 1.63 . . 1 . . . . 110 LEU HG . 16113 1 1152 . 1 1 110 110 LEU CA C 13 58.5 . . 1 . . . . 110 LEU CA . 16113 1 1153 . 1 1 110 110 LEU CB C 13 41.3 . . 1 . . . . 110 LEU CB . 16113 1 1154 . 1 1 110 110 LEU CD1 C 13 22.4 . . 1 . . . . 110 LEU CD1 . 16113 1 1155 . 1 1 110 110 LEU CD2 C 13 26.6 . . 1 . . . . 110 LEU CD2 . 16113 1 1156 . 1 1 110 110 LEU CG C 13 26.5 . . 1 . . . . 110 LEU CG . 16113 1 1157 . 1 1 110 110 LEU N N 15 121.0 . . 1 . . . . 110 LEU N . 16113 1 1158 . 1 1 111 111 HIS H H 1 8.44 . . 1 . . . . 111 HIS H . 16113 1 1159 . 1 1 111 111 HIS HA H 1 4.00 . . 1 . . . . 111 HIS HA . 16113 1 1160 . 1 1 111 111 HIS HB2 H 1 2.98 . . 2 . . . . 111 HIS HB2 . 16113 1 1161 . 1 1 111 111 HIS HB3 H 1 3.00 . . 2 . . . . 111 HIS HB3 . 16113 1 1162 . 1 1 111 111 HIS HD2 H 1 6.95 . . 1 . . . . 111 HIS HD2 . 16113 1 1163 . 1 1 111 111 HIS CA C 13 60.9 . . 1 . . . . 111 HIS CA . 16113 1 1164 . 1 1 111 111 HIS CB C 13 29.7 . . 1 . . . . 111 HIS CB . 16113 1 1165 . 1 1 111 111 HIS CD2 C 13 119.7 . . 1 . . . . 111 HIS CD2 . 16113 1 1166 . 1 1 111 111 HIS N N 15 116.3 . . 1 . . . . 111 HIS N . 16113 1 1167 . 1 1 112 112 ALA H H 1 7.92 . . 1 . . . . 112 ALA H . 16113 1 1168 . 1 1 112 112 ALA HA H 1 4.13 . . 1 . . . . 112 ALA HA . 16113 1 1169 . 1 1 112 112 ALA HB1 H 1 1.40 . . 1 . . . . 112 ALA HB . 16113 1 1170 . 1 1 112 112 ALA HB2 H 1 1.40 . . 1 . . . . 112 ALA HB . 16113 1 1171 . 1 1 112 112 ALA HB3 H 1 1.40 . . 1 . . . . 112 ALA HB . 16113 1 1172 . 1 1 112 112 ALA CA C 13 55.0 . . 1 . . . . 112 ALA CA . 16113 1 1173 . 1 1 112 112 ALA CB C 13 17.6 . . 1 . . . . 112 ALA CB . 16113 1 1174 . 1 1 112 112 ALA N N 15 122.9 . . 1 . . . . 112 ALA N . 16113 1 1175 . 1 1 113 113 VAL H H 1 8.30 . . 1 . . . . 113 VAL H . 16113 1 1176 . 1 1 113 113 VAL HA H 1 3.54 . . 1 . . . . 113 VAL HA . 16113 1 1177 . 1 1 113 113 VAL HB H 1 2.52 . . 1 . . . . 113 VAL HB . 16113 1 1178 . 1 1 113 113 VAL HG11 H 1 0.98 . . 2 . . . . 113 VAL HG1 . 16113 1 1179 . 1 1 113 113 VAL HG12 H 1 0.98 . . 2 . . . . 113 VAL HG1 . 16113 1 1180 . 1 1 113 113 VAL HG13 H 1 0.98 . . 2 . . . . 113 VAL HG1 . 16113 1 1181 . 1 1 113 113 VAL HG21 H 1 1.20 . . 2 . . . . 113 VAL HG2 . 16113 1 1182 . 1 1 113 113 VAL HG22 H 1 1.20 . . 2 . . . . 113 VAL HG2 . 16113 1 1183 . 1 1 113 113 VAL HG23 H 1 1.20 . . 2 . . . . 113 VAL HG2 . 16113 1 1184 . 1 1 113 113 VAL CA C 13 67.2 . . 1 . . . . 113 VAL CA . 16113 1 1185 . 1 1 113 113 VAL CB C 13 31.0 . . 1 . . . . 113 VAL CB . 16113 1 1186 . 1 1 113 113 VAL CG1 C 13 20.7 . . 1 . . . . 113 VAL CG1 . 16113 1 1187 . 1 1 113 113 VAL CG2 C 13 24.7 . . 1 . . . . 113 VAL CG2 . 16113 1 1188 . 1 1 113 113 VAL N N 15 119.0 . . 1 . . . . 113 VAL N . 16113 1 1189 . 1 1 114 114 LYS H H 1 8.22 . . 1 . . . . 114 LYS H . 16113 1 1190 . 1 1 114 114 LYS HA H 1 3.81 . . 1 . . . . 114 LYS HA . 16113 1 1191 . 1 1 114 114 LYS HB2 H 1 1.80 . . 2 . . . . 114 LYS HB2 . 16113 1 1192 . 1 1 114 114 LYS HB3 H 1 2.05 . . 2 . . . . 114 LYS HB3 . 16113 1 1193 . 1 1 114 114 LYS HD2 H 1 1.49 . . 2 . . . . 114 LYS HD2 . 16113 1 1194 . 1 1 114 114 LYS HD3 H 1 1.49 . . 2 . . . . 114 LYS HD3 . 16113 1 1195 . 1 1 114 114 LYS HE2 H 1 2.88 . . 2 . . . . 114 LYS HE2 . 16113 1 1196 . 1 1 114 114 LYS HE3 H 1 2.88 . . 2 . . . . 114 LYS HE3 . 16113 1 1197 . 1 1 114 114 LYS HG2 H 1 1.33 . . 2 . . . . 114 LYS HG2 . 16113 1 1198 . 1 1 114 114 LYS HG3 H 1 1.50 . . 2 . . . . 114 LYS HG3 . 16113 1 1199 . 1 1 114 114 LYS CA C 13 60.8 . . 1 . . . . 114 LYS CA . 16113 1 1200 . 1 1 114 114 LYS CB C 13 31.5 . . 1 . . . . 114 LYS CB . 16113 1 1201 . 1 1 114 114 LYS CD C 13 29.5 . . 1 . . . . 114 LYS CD . 16113 1 1202 . 1 1 114 114 LYS CE C 13 41.3 . . 1 . . . . 114 LYS CE . 16113 1 1203 . 1 1 114 114 LYS CG C 13 25.2 . . 1 . . . . 114 LYS CG . 16113 1 1204 . 1 1 114 114 LYS N N 15 120.6 . . 1 . . . . 114 LYS N . 16113 1 1205 . 1 1 115 115 ASP H H 1 8.18 . . 1 . . . . 115 ASP H . 16113 1 1206 . 1 1 115 115 ASP HA H 1 4.30 . . 1 . . . . 115 ASP HA . 16113 1 1207 . 1 1 115 115 ASP HB2 H 1 2.14 . . 2 . . . . 115 ASP HB2 . 16113 1 1208 . 1 1 115 115 ASP HB3 H 1 2.63 . . 2 . . . . 115 ASP HB3 . 16113 1 1209 . 1 1 115 115 ASP CA C 13 56.8 . . 1 . . . . 115 ASP CA . 16113 1 1210 . 1 1 115 115 ASP CB C 13 39.6 . . 1 . . . . 115 ASP CB . 16113 1 1211 . 1 1 115 115 ASP N N 15 118.8 . . 1 . . . . 115 ASP N . 16113 1 1212 . 1 1 116 116 GLU H H 1 7.99 . . 1 . . . . 116 GLU H . 16113 1 1213 . 1 1 116 116 GLU HA H 1 4.06 . . 1 . . . . 116 GLU HA . 16113 1 1214 . 1 1 116 116 GLU HB2 H 1 2.12 . . 2 . . . . 116 GLU HB2 . 16113 1 1215 . 1 1 116 116 GLU HB3 H 1 2.17 . . 2 . . . . 116 GLU HB3 . 16113 1 1216 . 1 1 116 116 GLU HG2 H 1 2.25 . . 2 . . . . 116 GLU HG2 . 16113 1 1217 . 1 1 116 116 GLU HG3 H 1 2.35 . . 2 . . . . 116 GLU HG3 . 16113 1 1218 . 1 1 116 116 GLU CA C 13 58.4 . . 1 . . . . 116 GLU CA . 16113 1 1219 . 1 1 116 116 GLU CB C 13 29.0 . . 1 . . . . 116 GLU CB . 16113 1 1220 . 1 1 116 116 GLU CG C 13 35.8 . . 1 . . . . 116 GLU CG . 16113 1 1221 . 1 1 116 116 GLU N N 15 120.8 . . 1 . . . . 116 GLU N . 16113 1 1222 . 1 1 117 117 ILE H H 1 8.37 . . 1 . . . . 117 ILE H . 16113 1 1223 . 1 1 117 117 ILE HA H 1 3.61 . . 1 . . . . 117 ILE HA . 16113 1 1224 . 1 1 117 117 ILE HB H 1 1.94 . . 1 . . . . 117 ILE HB . 16113 1 1225 . 1 1 117 117 ILE HD11 H 1 0.74 . . 1 . . . . 117 ILE HD1 . 16113 1 1226 . 1 1 117 117 ILE HD12 H 1 0.74 . . 1 . . . . 117 ILE HD1 . 16113 1 1227 . 1 1 117 117 ILE HD13 H 1 0.74 . . 1 . . . . 117 ILE HD1 . 16113 1 1228 . 1 1 117 117 ILE HG12 H 1 0.96 . . 2 . . . . 117 ILE HG12 . 16113 1 1229 . 1 1 117 117 ILE HG13 H 1 1.93 . . 2 . . . . 117 ILE HG13 . 16113 1 1230 . 1 1 117 117 ILE HG21 H 1 0.95 . . 1 . . . . 117 ILE HG2 . 16113 1 1231 . 1 1 117 117 ILE HG22 H 1 0.95 . . 1 . . . . 117 ILE HG2 . 16113 1 1232 . 1 1 117 117 ILE HG23 H 1 0.95 . . 1 . . . . 117 ILE HG2 . 16113 1 1233 . 1 1 117 117 ILE CA C 13 64.8 . . 1 . . . . 117 ILE CA . 16113 1 1234 . 1 1 117 117 ILE CB C 13 38.6 . . 1 . . . . 117 ILE CB . 16113 1 1235 . 1 1 117 117 ILE CD1 C 13 14.4 . . 1 . . . . 117 ILE CD1 . 16113 1 1236 . 1 1 117 117 ILE CG1 C 13 29.3 . . 1 . . . . 117 ILE CG1 . 16113 1 1237 . 1 1 117 117 ILE CG2 C 13 17.6 . . 1 . . . . 117 ILE CG2 . 16113 1 1238 . 1 1 117 117 ILE N N 15 119.7 . . 1 . . . . 117 ILE N . 16113 1 1239 . 1 1 118 118 ALA H H 1 7.72 . . 1 . . . . 118 ALA H . 16113 1 1240 . 1 1 118 118 ALA HA H 1 4.25 . . 1 . . . . 118 ALA HA . 16113 1 1241 . 1 1 118 118 ALA HB1 H 1 1.50 . . 1 . . . . 118 ALA HB . 16113 1 1242 . 1 1 118 118 ALA HB2 H 1 1.50 . . 1 . . . . 118 ALA HB . 16113 1 1243 . 1 1 118 118 ALA HB3 H 1 1.50 . . 1 . . . . 118 ALA HB . 16113 1 1244 . 1 1 118 118 ALA CA C 13 52.9 . . 1 . . . . 118 ALA CA . 16113 1 1245 . 1 1 118 118 ALA CB C 13 18.7 . . 1 . . . . 118 ALA CB . 16113 1 1246 . 1 1 118 118 ALA N N 15 119.9 . . 1 . . . . 118 ALA N . 16113 1 1247 . 1 1 119 119 ARG H H 1 7.45 . . 1 . . . . 119 ARG H . 16113 1 1248 . 1 1 119 119 ARG HA H 1 4.11 . . 1 . . . . 119 ARG HA . 16113 1 1249 . 1 1 119 119 ARG HB2 H 1 2.03 . . 2 . . . . 119 ARG HB2 . 16113 1 1250 . 1 1 119 119 ARG HB3 H 1 1.88 . . 2 . . . . 119 ARG HB3 . 16113 1 1251 . 1 1 119 119 ARG HD2 H 1 3.26 . . 2 . . . . 119 ARG HD2 . 16113 1 1252 . 1 1 119 119 ARG HD3 H 1 3.26 . . 2 . . . . 119 ARG HD3 . 16113 1 1253 . 1 1 119 119 ARG HG2 H 1 1.73 . . 2 . . . . 119 ARG HG2 . 16113 1 1254 . 1 1 119 119 ARG HG3 H 1 1.82 . . 2 . . . . 119 ARG HG3 . 16113 1 1255 . 1 1 119 119 ARG CA C 13 57.6 . . 1 . . . . 119 ARG CA . 16113 1 1256 . 1 1 119 119 ARG CB C 13 31.0 . . 1 . . . . 119 ARG CB . 16113 1 1257 . 1 1 119 119 ARG CD C 13 43.7 . . 1 . . . . 119 ARG CD . 16113 1 1258 . 1 1 119 119 ARG CG C 13 27.3 . . 1 . . . . 119 ARG CG . 16113 1 1259 . 1 1 119 119 ARG N N 15 118.4 . . 1 . . . . 119 ARG N . 16113 1 1260 . 1 1 120 120 GLU H H 1 8.89 . . 1 . . . . 120 GLU H . 16113 1 1261 . 1 1 120 120 GLU HA H 1 4.28 . . 1 . . . . 120 GLU HA . 16113 1 1262 . 1 1 120 120 GLU HB2 H 1 1.97 . . 2 . . . . 120 GLU HB2 . 16113 1 1263 . 1 1 120 120 GLU HB3 H 1 2.11 . . 2 . . . . 120 GLU HB3 . 16113 1 1264 . 1 1 120 120 GLU HG2 H 1 2.28 . . 2 . . . . 120 GLU HG2 . 16113 1 1265 . 1 1 120 120 GLU HG3 H 1 2.31 . . 2 . . . . 120 GLU HG3 . 16113 1 1266 . 1 1 120 120 GLU CA C 13 57.6 . . 1 . . . . 120 GLU CA . 16113 1 1267 . 1 1 120 120 GLU CB C 13 30.1 . . 1 . . . . 120 GLU CB . 16113 1 1268 . 1 1 120 120 GLU CG C 13 36.0 . . 1 . . . . 120 GLU CG . 16113 1 1269 . 1 1 120 120 GLU N N 15 114.9 . . 1 . . . . 120 GLU N . 16113 1 1270 . 1 1 123 123 ARG HA H 1 4.28 . . 1 . . . . 123 ARG HA . 16113 1 1271 . 1 1 123 123 ARG HB2 H 1 1.76 . . 2 . . . . 123 ARG HB2 . 16113 1 1272 . 1 1 123 123 ARG HB3 H 1 1.85 . . 2 . . . . 123 ARG HB3 . 16113 1 1273 . 1 1 123 123 ARG HD2 H 1 3.16 . . 2 . . . . 123 ARG HD2 . 16113 1 1274 . 1 1 123 123 ARG HD3 H 1 3.16 . . 2 . . . . 123 ARG HD3 . 16113 1 1275 . 1 1 123 123 ARG HG2 H 1 1.58 . . 2 . . . . 123 ARG HG2 . 16113 1 1276 . 1 1 123 123 ARG HG3 H 1 1.58 . . 2 . . . . 123 ARG HG3 . 16113 1 1277 . 1 1 123 123 ARG CA C 13 56.0 . . 1 . . . . 123 ARG CA . 16113 1 1278 . 1 1 123 123 ARG CB C 13 30.1 . . 1 . . . . 123 ARG CB . 16113 1 1279 . 1 1 123 123 ARG CD C 13 43.1 . . 1 . . . . 123 ARG CD . 16113 1 1280 . 1 1 123 123 ARG CG C 13 27.0 . . 1 . . . . 123 ARG CG . 16113 1 1281 . 1 1 124 124 LEU HA H 1 4.34 . . 1 . . . . 124 LEU HA . 16113 1 1282 . 1 1 124 124 LEU HB2 H 1 1.59 . . 2 . . . . 124 LEU HB2 . 16113 1 1283 . 1 1 124 124 LEU HB3 H 1 1.59 . . 2 . . . . 124 LEU HB3 . 16113 1 1284 . 1 1 124 124 LEU HD11 H 1 0.91 . . 2 . . . . 124 LEU HD1 . 16113 1 1285 . 1 1 124 124 LEU HD12 H 1 0.91 . . 2 . . . . 124 LEU HD1 . 16113 1 1286 . 1 1 124 124 LEU HD13 H 1 0.91 . . 2 . . . . 124 LEU HD1 . 16113 1 1287 . 1 1 124 124 LEU HD21 H 1 0.86 . . 2 . . . . 124 LEU HD2 . 16113 1 1288 . 1 1 124 124 LEU HD22 H 1 0.86 . . 2 . . . . 124 LEU HD2 . 16113 1 1289 . 1 1 124 124 LEU HD23 H 1 0.86 . . 2 . . . . 124 LEU HD2 . 16113 1 1290 . 1 1 124 124 LEU HG H 1 1.60 . . 1 . . . . 124 LEU HG . 16113 1 1291 . 1 1 124 124 LEU CA C 13 55.1 . . 1 . . . . 124 LEU CA . 16113 1 1292 . 1 1 124 124 LEU CB C 13 42.2 . . 1 . . . . 124 LEU CB . 16113 1 1293 . 1 1 124 124 LEU CD1 C 13 23.9 . . 1 . . . . 124 LEU CD1 . 16113 1 1294 . 1 1 124 124 LEU CD2 C 13 24.8 . . 1 . . . . 124 LEU CD2 . 16113 1 1295 . 1 1 124 124 LEU CG C 13 27.0 . . 1 . . . . 124 LEU CG . 16113 1 1296 . 1 1 125 125 GLU HA H 1 4.18 . . 1 . . . . 125 GLU HA . 16113 1 1297 . 1 1 125 125 GLU HB2 H 1 1.83 . . 2 . . . . 125 GLU HB2 . 16113 1 1298 . 1 1 125 125 GLU HB3 H 1 1.90 . . 2 . . . . 125 GLU HB3 . 16113 1 1299 . 1 1 125 125 GLU HG2 H 1 2.11 . . 2 . . . . 125 GLU HG2 . 16113 1 1300 . 1 1 125 125 GLU HG3 H 1 2.18 . . 2 . . . . 125 GLU HG3 . 16113 1 1301 . 1 1 125 125 GLU CA C 13 56.5 . . 1 . . . . 125 GLU CA . 16113 1 1302 . 1 1 125 125 GLU CB C 13 30.1 . . 1 . . . . 125 GLU CB . 16113 1 1303 . 1 1 125 125 GLU CG C 13 35.9 . . 1 . . . . 125 GLU CG . 16113 1 stop_ save_