data_7086 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 7086 _Entry.Title ; Assignment of hypothetical protein tm1012 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2006-04-24 _Entry.Accession_date 2006-04-24 _Entry.Last_release_date 2006-10-20 _Entry.Original_release_date 2006-10-20 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 2.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Bin Wu . . . 7086 2 Adelina Yee . . . 7086 3 Jonathan Lukin . . . 7086 4 Alexander Lemak . . . 7086 5 Theresa Ramelot . . . 7086 6 Anthony Semesi . . . 7086 7 Michael Kennedy . . . 7086 8 Cheryl Arrowsmith . H. . 7086 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 7086 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 663 7086 '15N chemical shifts' 147 7086 '1H chemical shifts' 1103 7086 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2006-10-20 2006-04-24 original author . 7086 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 7086 _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 ; Assignment of hypothetical protein tm1012 from Thermotoga maritima/ Northeast Structural Genomics Consortium Target VT128/ Ontario Center for Structural Proteomics Target tm1012 ; _Citation.Status published _Citation.Type 'BMRB only' _Citation.Journal_abbrev . _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first . _Citation.Page_last . _Citation.Year . _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Bin Wu . . . 7086 1 2 Adelina Yee . . . 7086 1 3 Jonathan Lukin . . . 7086 1 4 Alexander Lemak . . . 7086 1 5 Theresa Ramelot . . . 7086 1 6 Anthony Semesi . . . 7086 1 7 Michael Kennedy . . . 7086 1 8 Cheryl Arrowsmith . H. . 7086 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'hypothetical protein tm1012' 7086 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_system_tm1012 _Assembly.Sf_category assembly _Assembly.Sf_framecode system_tm1012 _Assembly.Entry_ID 7086 _Assembly.ID 1 _Assembly.Name 'hypothetical protein tm1012' _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 'not present' _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Assembly_type.Type _Assembly_type.Entry_ID _Assembly_type.Assembly_ID monomer 7086 1 stop_ loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 tm1012 1 $tm1012 . . . native . . . . . 7086 1 stop_ loop_ _Assembly_common_name.Name _Assembly_common_name.Type _Assembly_common_name.Entry_ID _Assembly_common_name.Assembly_ID 'hypothetical protein tm1012' system 7086 1 tm1012 abbreviation 7086 1 stop_ loop_ _Assembly_bio_function.Biological_function _Assembly_bio_function.Entry_ID _Assembly_bio_function.Assembly_ID 'hypothetical protein' 7086 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_tm1012 _Entity.Sf_category entity _Entity.Sf_framecode tm1012 _Entity.Entry_ID 7086 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'hypothetical protein tm1012' _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 ; MIRPEYLRVLRKIYDRLKNE KVNWVVTGSLSFALQGVPVE VHDIDIQTDEEGAYEIERIF SEFVSKKVRFSSTEKICSHF GELIIDGIKVEIMGDIRKRL EDGTWEDPVDLNKYKRFVET HGMKIPVLSLEYEYQAYLKL GRVEKAETLRKWLNERKG ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer . _Entity.Nstd_chirality . _Entity.Nstd_linkage . _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 158 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic . _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 18630 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-01-28 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 2EWR . "Crystal Structure Of A Putative Nucleotidyltransferase (Tm1012) From Thermotoga Maritima At 1.60 A Resolution" . . . . . 99.37 170 98.73 98.73 5.09e-106 . . . . 7086 1 2 no PDB 4HX0 . "Crystal Structure Of A Putative Nucleotidyltransferase (tm1012) From Thermotoga Maritima At 1.87 A Resolution" . . . . . 100.00 163 100.00 100.00 3.64e-109 . . . . 7086 1 3 no GB AAD36089 . "hypothetical protein TM_1012 [Thermotoga maritima MSB8]" . . . . . 100.00 158 100.00 100.00 3.07e-109 . . . . 7086 1 4 no GB ACB10124 . "conserved hypothetical protein [Thermotoga sp. RQ2]" . . . . . 100.00 158 100.00 100.00 3.07e-109 . . . . 7086 1 5 no GB ACM23742 . "Putative uncharacterized protein [Thermotoga neapolitana DSM 4359]" . . . . . 100.00 158 100.00 100.00 3.07e-109 . . . . 7086 1 6 no GB AGL49939 . "hypothetical protein Tmari_1015 [Thermotoga maritima MSB8]" . . . . . 100.00 158 100.00 100.00 3.07e-109 . . . . 7086 1 7 no GB AHD19079 . "hypothetical protein THEMA_09295 [Thermotoga maritima MSB8]" . . . . . 100.00 158 100.00 100.00 3.07e-109 . . . . 7086 1 8 no REF NP_228818 . "hypothetical protein TM1012 [Thermotoga maritima MSB8]" . . . . . 100.00 158 100.00 100.00 3.07e-109 . . . . 7086 1 9 no REF WP_004080525 . "MULTISPECIES: hypothetical protein [Thermotoga]" . . . . . 100.00 158 100.00 100.00 3.07e-109 . . . . 7086 1 10 no REF YP_001739807 . "hypothetical protein TRQ2_1793 [Thermotoga sp. RQ2]" . . . . . 100.00 158 100.00 100.00 3.07e-109 . . . . 7086 1 11 no REF YP_002535108 . "hypothetical protein CTN_1566 [Thermotoga neapolitana DSM 4359]" . . . . . 100.00 158 100.00 100.00 3.07e-109 . . . . 7086 1 12 no REF YP_007977364 . "hypothetical protein Tmari_1015 [Thermotoga maritima MSB8]" . . . . . 100.00 158 100.00 100.00 3.07e-109 . . . . 7086 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'hypothetical protein tm1012' common 7086 1 tm1012 abbreviation 7086 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 . 7086 1 2 . ILE . 7086 1 3 . ARG . 7086 1 4 . PRO . 7086 1 5 . GLU . 7086 1 6 . TYR . 7086 1 7 . LEU . 7086 1 8 . ARG . 7086 1 9 . VAL . 7086 1 10 . LEU . 7086 1 11 . ARG . 7086 1 12 . LYS . 7086 1 13 . ILE . 7086 1 14 . TYR . 7086 1 15 . ASP . 7086 1 16 . ARG . 7086 1 17 . LEU . 7086 1 18 . LYS . 7086 1 19 . ASN . 7086 1 20 . GLU . 7086 1 21 . LYS . 7086 1 22 . VAL . 7086 1 23 . ASN . 7086 1 24 . TRP . 7086 1 25 . VAL . 7086 1 26 . VAL . 7086 1 27 . THR . 7086 1 28 . GLY . 7086 1 29 . SER . 7086 1 30 . LEU . 7086 1 31 . SER . 7086 1 32 . PHE . 7086 1 33 . ALA . 7086 1 34 . LEU . 7086 1 35 . GLN . 7086 1 36 . GLY . 7086 1 37 . VAL . 7086 1 38 . PRO . 7086 1 39 . VAL . 7086 1 40 . GLU . 7086 1 41 . VAL . 7086 1 42 . HIS . 7086 1 43 . ASP . 7086 1 44 . ILE . 7086 1 45 . ASP . 7086 1 46 . ILE . 7086 1 47 . GLN . 7086 1 48 . THR . 7086 1 49 . ASP . 7086 1 50 . GLU . 7086 1 51 . GLU . 7086 1 52 . GLY . 7086 1 53 . ALA . 7086 1 54 . TYR . 7086 1 55 . GLU . 7086 1 56 . ILE . 7086 1 57 . GLU . 7086 1 58 . ARG . 7086 1 59 . ILE . 7086 1 60 . PHE . 7086 1 61 . SER . 7086 1 62 . GLU . 7086 1 63 . PHE . 7086 1 64 . VAL . 7086 1 65 . SER . 7086 1 66 . LYS . 7086 1 67 . LYS . 7086 1 68 . VAL . 7086 1 69 . ARG . 7086 1 70 . PHE . 7086 1 71 . SER . 7086 1 72 . SER . 7086 1 73 . THR . 7086 1 74 . GLU . 7086 1 75 . LYS . 7086 1 76 . ILE . 7086 1 77 . CYS . 7086 1 78 . SER . 7086 1 79 . HIS . 7086 1 80 . PHE . 7086 1 81 . GLY . 7086 1 82 . GLU . 7086 1 83 . LEU . 7086 1 84 . ILE . 7086 1 85 . ILE . 7086 1 86 . ASP . 7086 1 87 . GLY . 7086 1 88 . ILE . 7086 1 89 . LYS . 7086 1 90 . VAL . 7086 1 91 . GLU . 7086 1 92 . ILE . 7086 1 93 . MET . 7086 1 94 . GLY . 7086 1 95 . ASP . 7086 1 96 . ILE . 7086 1 97 . ARG . 7086 1 98 . LYS . 7086 1 99 . ARG . 7086 1 100 . LEU . 7086 1 101 . GLU . 7086 1 102 . ASP . 7086 1 103 . GLY . 7086 1 104 . THR . 7086 1 105 . TRP . 7086 1 106 . GLU . 7086 1 107 . ASP . 7086 1 108 . PRO . 7086 1 109 . VAL . 7086 1 110 . ASP . 7086 1 111 . LEU . 7086 1 112 . ASN . 7086 1 113 . LYS . 7086 1 114 . TYR . 7086 1 115 . LYS . 7086 1 116 . ARG . 7086 1 117 . PHE . 7086 1 118 . VAL . 7086 1 119 . GLU . 7086 1 120 . THR . 7086 1 121 . HIS . 7086 1 122 . GLY . 7086 1 123 . MET . 7086 1 124 . LYS . 7086 1 125 . ILE . 7086 1 126 . PRO . 7086 1 127 . VAL . 7086 1 128 . LEU . 7086 1 129 . SER . 7086 1 130 . LEU . 7086 1 131 . GLU . 7086 1 132 . TYR . 7086 1 133 . GLU . 7086 1 134 . TYR . 7086 1 135 . GLN . 7086 1 136 . ALA . 7086 1 137 . TYR . 7086 1 138 . LEU . 7086 1 139 . LYS . 7086 1 140 . LEU . 7086 1 141 . GLY . 7086 1 142 . ARG . 7086 1 143 . VAL . 7086 1 144 . GLU . 7086 1 145 . LYS . 7086 1 146 . ALA . 7086 1 147 . GLU . 7086 1 148 . THR . 7086 1 149 . LEU . 7086 1 150 . ARG . 7086 1 151 . LYS . 7086 1 152 . TRP . 7086 1 153 . LEU . 7086 1 154 . ASN . 7086 1 155 . GLU . 7086 1 156 . ARG . 7086 1 157 . LYS . 7086 1 158 . GLY . 7086 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 7086 1 . ILE 2 2 7086 1 . ARG 3 3 7086 1 . PRO 4 4 7086 1 . GLU 5 5 7086 1 . TYR 6 6 7086 1 . LEU 7 7 7086 1 . ARG 8 8 7086 1 . VAL 9 9 7086 1 . LEU 10 10 7086 1 . ARG 11 11 7086 1 . LYS 12 12 7086 1 . ILE 13 13 7086 1 . TYR 14 14 7086 1 . ASP 15 15 7086 1 . ARG 16 16 7086 1 . LEU 17 17 7086 1 . LYS 18 18 7086 1 . ASN 19 19 7086 1 . GLU 20 20 7086 1 . LYS 21 21 7086 1 . VAL 22 22 7086 1 . ASN 23 23 7086 1 . TRP 24 24 7086 1 . VAL 25 25 7086 1 . VAL 26 26 7086 1 . THR 27 27 7086 1 . GLY 28 28 7086 1 . SER 29 29 7086 1 . LEU 30 30 7086 1 . SER 31 31 7086 1 . PHE 32 32 7086 1 . ALA 33 33 7086 1 . LEU 34 34 7086 1 . GLN 35 35 7086 1 . GLY 36 36 7086 1 . VAL 37 37 7086 1 . PRO 38 38 7086 1 . VAL 39 39 7086 1 . GLU 40 40 7086 1 . VAL 41 41 7086 1 . HIS 42 42 7086 1 . ASP 43 43 7086 1 . ILE 44 44 7086 1 . ASP 45 45 7086 1 . ILE 46 46 7086 1 . GLN 47 47 7086 1 . THR 48 48 7086 1 . ASP 49 49 7086 1 . GLU 50 50 7086 1 . GLU 51 51 7086 1 . GLY 52 52 7086 1 . ALA 53 53 7086 1 . TYR 54 54 7086 1 . GLU 55 55 7086 1 . ILE 56 56 7086 1 . GLU 57 57 7086 1 . ARG 58 58 7086 1 . ILE 59 59 7086 1 . PHE 60 60 7086 1 . SER 61 61 7086 1 . GLU 62 62 7086 1 . PHE 63 63 7086 1 . VAL 64 64 7086 1 . SER 65 65 7086 1 . LYS 66 66 7086 1 . LYS 67 67 7086 1 . VAL 68 68 7086 1 . ARG 69 69 7086 1 . PHE 70 70 7086 1 . SER 71 71 7086 1 . SER 72 72 7086 1 . THR 73 73 7086 1 . GLU 74 74 7086 1 . LYS 75 75 7086 1 . ILE 76 76 7086 1 . CYS 77 77 7086 1 . SER 78 78 7086 1 . HIS 79 79 7086 1 . PHE 80 80 7086 1 . GLY 81 81 7086 1 . GLU 82 82 7086 1 . LEU 83 83 7086 1 . ILE 84 84 7086 1 . ILE 85 85 7086 1 . ASP 86 86 7086 1 . GLY 87 87 7086 1 . ILE 88 88 7086 1 . LYS 89 89 7086 1 . VAL 90 90 7086 1 . GLU 91 91 7086 1 . ILE 92 92 7086 1 . MET 93 93 7086 1 . GLY 94 94 7086 1 . ASP 95 95 7086 1 . ILE 96 96 7086 1 . ARG 97 97 7086 1 . LYS 98 98 7086 1 . ARG 99 99 7086 1 . LEU 100 100 7086 1 . GLU 101 101 7086 1 . ASP 102 102 7086 1 . GLY 103 103 7086 1 . THR 104 104 7086 1 . TRP 105 105 7086 1 . GLU 106 106 7086 1 . ASP 107 107 7086 1 . PRO 108 108 7086 1 . VAL 109 109 7086 1 . ASP 110 110 7086 1 . LEU 111 111 7086 1 . ASN 112 112 7086 1 . LYS 113 113 7086 1 . TYR 114 114 7086 1 . LYS 115 115 7086 1 . ARG 116 116 7086 1 . PHE 117 117 7086 1 . VAL 118 118 7086 1 . GLU 119 119 7086 1 . THR 120 120 7086 1 . HIS 121 121 7086 1 . GLY 122 122 7086 1 . MET 123 123 7086 1 . LYS 124 124 7086 1 . ILE 125 125 7086 1 . PRO 126 126 7086 1 . VAL 127 127 7086 1 . LEU 128 128 7086 1 . SER 129 129 7086 1 . LEU 130 130 7086 1 . GLU 131 131 7086 1 . TYR 132 132 7086 1 . GLU 133 133 7086 1 . TYR 134 134 7086 1 . GLN 135 135 7086 1 . ALA 136 136 7086 1 . TYR 137 137 7086 1 . LEU 138 138 7086 1 . LYS 139 139 7086 1 . LEU 140 140 7086 1 . GLY 141 141 7086 1 . ARG 142 142 7086 1 . VAL 143 143 7086 1 . GLU 144 144 7086 1 . LYS 145 145 7086 1 . ALA 146 146 7086 1 . GLU 147 147 7086 1 . THR 148 148 7086 1 . LEU 149 149 7086 1 . ARG 150 150 7086 1 . LYS 151 151 7086 1 . TRP 152 152 7086 1 . LEU 153 153 7086 1 . ASN 154 154 7086 1 . GLU 155 155 7086 1 . ARG 156 156 7086 1 . LYS 157 157 7086 1 . GLY 158 158 7086 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 7086 _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 $tm1012 . 2303 . . 'thermotoga maritima' 'Thermotoga maritima' . . Bacteria . thermotoga maritima . . . . . . . . . . . . . . . . . . . . . 7086 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 7086 _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 $tm1012 . 'recombinant technology' 'Escherichia coli' 'E. coli' . . Escherichia coli 'BL21 (DE3)' . . . . . . . . . . . . plasmid . . PET15B . . . . . . 7086 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 7086 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'hypothetical protein tm1012' '[U-13C; U-15N]' . . 1 $tm1012 . . 1 . . mM . . . . 7086 1 2 NaCl . . . . . . . 500 . . mM . . . . 7086 1 3 Tris . . . . . . . 10 . . mM . . . . 7086 1 stop_ save_ ####################### # Sample conditions # ####################### save_cond_set1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode cond_set1 _Sample_condition_list.Entry_ID 7086 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0.50 . M 7086 1 pH 7.7 0.2 pH 7086 1 temperature 298 1 K 7086 1 stop_ save_ ############################ # Computer software used # ############################ save_SPARKY _Software.Sf_category software _Software.Sf_framecode SPARKY _Software.Entry_ID 7086 _Software.ID 1 _Software.Name SPARKY _Software.Version 3.95 _Software.Details . loop_ _Task.Task _Task.Entry_ID _Task.Software_ID assignemt 7086 1 'spectral analysis' 7086 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID 7086 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_2 _NMR_spectrometer.Entry_ID 7086 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_NMR_spectrometer _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer _NMR_spectrometer.Entry_ID 7086 _NMR_spectrometer.ID 3 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode spectrometer_list _NMR_spectrometer_list.Entry_ID 7086 _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 NMR_spectrometer_1 Varian INOVA . 600 . . . 7086 1 2 NMR_spectrometer_2 Varian INOVA . 800 . . . 7086 1 3 NMR_spectrometer Bruker Avance . 600 . . . 7086 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 7086 _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 '15N HSQC' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 7086 1 2 HNCO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 7086 1 3 CBCAcoNH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 7086 1 4 HNCACB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 7086 1 5 HNCA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 7086 1 6 HNcoCA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 7086 1 7 HBHAcoNH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 7086 1 8 'CCTOCSY NH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 7086 1 9 'HCCTOCSY NH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 7086 1 10 '13C HSQC' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 7086 1 11 HCCHTOCSY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 7086 1 12 HCCHCOSY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 7086 1 13 CCHTOCSY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 7086 1 14 '15N NOESY' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 7086 1 15 '13C NOESY' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 7086 1 stop_ save_ save_NMR_spec_expt__0_1 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_1 _NMR_spec_expt.Entry_ID 7086 _NMR_spec_expt.ID 1 _NMR_spec_expt.Name '15N HSQC' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_2 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_2 _NMR_spec_expt.Entry_ID 7086 _NMR_spec_expt.ID 2 _NMR_spec_expt.Name HNCO _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_3 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_3 _NMR_spec_expt.Entry_ID 7086 _NMR_spec_expt.ID 3 _NMR_spec_expt.Name CBCAcoNH _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_4 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_4 _NMR_spec_expt.Entry_ID 7086 _NMR_spec_expt.ID 4 _NMR_spec_expt.Name HNCACB _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_5 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_5 _NMR_spec_expt.Entry_ID 7086 _NMR_spec_expt.ID 5 _NMR_spec_expt.Name HNCA _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_6 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_6 _NMR_spec_expt.Entry_ID 7086 _NMR_spec_expt.ID 6 _NMR_spec_expt.Name HNcoCA _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_7 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_7 _NMR_spec_expt.Entry_ID 7086 _NMR_spec_expt.ID 7 _NMR_spec_expt.Name HBHAcoNH _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_8 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_8 _NMR_spec_expt.Entry_ID 7086 _NMR_spec_expt.ID 8 _NMR_spec_expt.Name 'CCTOCSY NH' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_9 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_9 _NMR_spec_expt.Entry_ID 7086 _NMR_spec_expt.ID 9 _NMR_spec_expt.Name 'HCCTOCSY NH' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_10 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_10 _NMR_spec_expt.Entry_ID 7086 _NMR_spec_expt.ID 10 _NMR_spec_expt.Name '13C HSQC' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_11 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_11 _NMR_spec_expt.Entry_ID 7086 _NMR_spec_expt.ID 11 _NMR_spec_expt.Name HCCHTOCSY _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_12 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_12 _NMR_spec_expt.Entry_ID 7086 _NMR_spec_expt.ID 12 _NMR_spec_expt.Name HCCHCOSY _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_13 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_13 _NMR_spec_expt.Entry_ID 7086 _NMR_spec_expt.ID 13 _NMR_spec_expt.Name CCHTOCSY _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_14 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_14 _NMR_spec_expt.Entry_ID 7086 _NMR_spec_expt.ID 14 _NMR_spec_expt.Name '15N NOESY' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_15 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_15 _NMR_spec_expt.Entry_ID 7086 _NMR_spec_expt.ID 15 _NMR_spec_expt.Name '13C NOESY' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference _Chem_shift_reference.Entry_ID 7086 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.251449530 . . . . . . . . . 7086 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 internal direct 1.000000000 . . . . . . . . . 7086 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . . . . . . . 7086 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_chemical_shift_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chemical_shift_1 _Assigned_chem_shift_list.Entry_ID 7086 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $cond_set1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference _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 '15N HSQC' 1 $sample_1 . 7086 1 2 HNCO 1 $sample_1 . 7086 1 3 CBCAcoNH 1 $sample_1 . 7086 1 4 HNCACB 1 $sample_1 . 7086 1 5 HNCA 1 $sample_1 . 7086 1 6 HNcoCA 1 $sample_1 . 7086 1 7 HBHAcoNH 1 $sample_1 . 7086 1 8 'CCTOCSY NH' 1 $sample_1 . 7086 1 9 'HCCTOCSY NH' 1 $sample_1 . 7086 1 10 '13C HSQC' 1 $sample_1 . 7086 1 11 HCCHTOCSY 1 $sample_1 . 7086 1 12 HCCHCOSY 1 $sample_1 . 7086 1 13 CCHTOCSY 1 $sample_1 . 7086 1 14 '15N NOESY' 1 $sample_1 . 7086 1 15 '13C NOESY' 1 $sample_1 . 7086 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 4 4 PRO CD C 13 50.9 0.3 . 1 . . . . . . . . 7086 1 2 . 1 1 4 4 PRO CA C 13 65.4 0.3 . 1 . . . . . . . . 7086 1 3 . 1 1 4 4 PRO HA H 1 4.15 0.03 . 1 . . . . . . . . 7086 1 4 . 1 1 4 4 PRO CB C 13 32.2 0.3 . 1 . . . . . . . . 7086 1 5 . 1 1 4 4 PRO HB2 H 1 2.44 0.03 . 2 . . . . . . . . 7086 1 6 . 1 1 4 4 PRO HB3 H 1 1.99 0.03 . 2 . . . . . . . . 7086 1 7 . 1 1 4 4 PRO CG C 13 28.1 0.3 . 1 . . . . . . . . 7086 1 8 . 1 1 4 4 PRO HG2 H 1 2.19 0.03 . 2 . . . . . . . . 7086 1 9 . 1 1 4 4 PRO HG3 H 1 2.14 0.03 . 2 . . . . . . . . 7086 1 10 . 1 1 4 4 PRO HD2 H 1 3.90 0.03 . 2 . . . . . . . . 7086 1 11 . 1 1 4 4 PRO HD3 H 1 3.83 0.03 . 2 . . . . . . . . 7086 1 12 . 1 1 4 4 PRO C C 13 178.8 0.3 . 1 . . . . . . . . 7086 1 13 . 1 1 5 5 GLU N N 15 118.6 0.3 . 1 . . . . . . . . 7086 1 14 . 1 1 5 5 GLU H H 1 10.58 0.03 . 1 . . . . . . . . 7086 1 15 . 1 1 5 5 GLU CA C 13 59.4 0.3 . 1 . . . . . . . . 7086 1 16 . 1 1 5 5 GLU HA H 1 3.96 0.03 . 1 . . . . . . . . 7086 1 17 . 1 1 5 5 GLU CB C 13 28.1 0.3 . 1 . . . . . . . . 7086 1 18 . 1 1 5 5 GLU HB2 H 1 1.95 0.03 . 2 . . . . . . . . 7086 1 19 . 1 1 5 5 GLU HB3 H 1 1.76 0.03 . 2 . . . . . . . . 7086 1 20 . 1 1 5 5 GLU CG C 13 36.0 0.3 . 1 . . . . . . . . 7086 1 21 . 1 1 5 5 GLU HG2 H 1 2.13 0.03 . 2 . . . . . . . . 7086 1 22 . 1 1 5 5 GLU HG3 H 1 2.03 0.03 . 2 . . . . . . . . 7086 1 23 . 1 1 5 5 GLU C C 13 178.8 0.3 . 1 . . . . . . . . 7086 1 24 . 1 1 6 6 TYR N N 15 117.7 0.3 . 1 . . . . . . . . 7086 1 25 . 1 1 6 6 TYR H H 1 7.47 0.03 . 1 . . . . . . . . 7086 1 26 . 1 1 6 6 TYR CA C 13 61.8 0.3 . 1 . . . . . . . . 7086 1 27 . 1 1 6 6 TYR HA H 1 3.90 0.03 . 1 . . . . . . . . 7086 1 28 . 1 1 6 6 TYR CB C 13 38.3 0.3 . 1 . . . . . . . . 7086 1 29 . 1 1 6 6 TYR HB2 H 1 2.94 0.03 . 2 . . . . . . . . 7086 1 30 . 1 1 6 6 TYR HB3 H 1 2.68 0.03 . 2 . . . . . . . . 7086 1 31 . 1 1 6 6 TYR HD1 H 1 6.90 0.03 . 1 . . . . . . . . 7086 1 32 . 1 1 6 6 TYR HD2 H 1 6.90 0.03 . 1 . . . . . . . . 7086 1 33 . 1 1 6 6 TYR HE1 H 1 6.66 0.03 . 1 . . . . . . . . 7086 1 34 . 1 1 6 6 TYR HE2 H 1 6.66 0.03 . 1 . . . . . . . . 7086 1 35 . 1 1 6 6 TYR CD1 C 13 131.7 0.3 . 1 . . . . . . . . 7086 1 36 . 1 1 6 6 TYR C C 13 177.7 0.3 . 1 . . . . . . . . 7086 1 37 . 1 1 7 7 LEU N N 15 119.5 0.3 . 1 . . . . . . . . 7086 1 38 . 1 1 7 7 LEU H H 1 7.07 0.03 . 1 . . . . . . . . 7086 1 39 . 1 1 7 7 LEU CA C 13 57.0 0.3 . 1 . . . . . . . . 7086 1 40 . 1 1 7 7 LEU HA H 1 4.00 0.03 . 1 . . . . . . . . 7086 1 41 . 1 1 7 7 LEU CB C 13 41.1 0.3 . 1 . . . . . . . . 7086 1 42 . 1 1 7 7 LEU HB2 H 1 1.70 0.03 . 2 . . . . . . . . 7086 1 43 . 1 1 7 7 LEU HB3 H 1 1.32 0.03 . 2 . . . . . . . . 7086 1 44 . 1 1 7 7 LEU CG C 13 27.2 0.3 . 1 . . . . . . . . 7086 1 45 . 1 1 7 7 LEU HG H 1 1.41 0.03 . 1 . . . . . . . . 7086 1 46 . 1 1 7 7 LEU HD11 H 1 0.54 0.03 . 2 . . . . . . . . 7086 1 47 . 1 1 7 7 LEU HD12 H 1 0.54 0.03 . 2 . . . . . . . . 7086 1 48 . 1 1 7 7 LEU HD13 H 1 0.54 0.03 . 2 . . . . . . . . 7086 1 49 . 1 1 7 7 LEU HD21 H 1 0.52 0.03 . 2 . . . . . . . . 7086 1 50 . 1 1 7 7 LEU HD22 H 1 0.52 0.03 . 2 . . . . . . . . 7086 1 51 . 1 1 7 7 LEU HD23 H 1 0.52 0.03 . 2 . . . . . . . . 7086 1 52 . 1 1 7 7 LEU CD1 C 13 24.9 0.3 . 1 . . . . . . . . 7086 1 53 . 1 1 7 7 LEU CD2 C 13 23.0 0.3 . 1 . . . . . . . . 7086 1 54 . 1 1 7 7 LEU C C 13 179.2 0.3 . 1 . . . . . . . . 7086 1 55 . 1 1 8 8 ARG N N 15 119.3 0.3 . 1 . . . . . . . . 7086 1 56 . 1 1 8 8 ARG H H 1 8.15 0.03 . 1 . . . . . . . . 7086 1 57 . 1 1 8 8 ARG CA C 13 59.8 0.3 . 1 . . . . . . . . 7086 1 58 . 1 1 8 8 ARG HA H 1 4.04 0.03 . 1 . . . . . . . . 7086 1 59 . 1 1 8 8 ARG CB C 13 30.6 0.3 . 1 . . . . . . . . 7086 1 60 . 1 1 8 8 ARG HB2 H 1 1.90 0.03 . 2 . . . . . . . . 7086 1 61 . 1 1 8 8 ARG HB3 H 1 1.83 0.03 . 2 . . . . . . . . 7086 1 62 . 1 1 8 8 ARG CG C 13 28.4 0.3 . 1 . . . . . . . . 7086 1 63 . 1 1 8 8 ARG HG2 H 1 1.78 0.03 . 2 . . . . . . . . 7086 1 64 . 1 1 8 8 ARG HG3 H 1 1.57 0.03 . 2 . . . . . . . . 7086 1 65 . 1 1 8 8 ARG CD C 13 43.7 0.3 . 1 . . . . . . . . 7086 1 66 . 1 1 8 8 ARG HD2 H 1 3.29 0.03 . 2 . . . . . . . . 7086 1 67 . 1 1 8 8 ARG HD3 H 1 3.17 0.03 . 2 . . . . . . . . 7086 1 68 . 1 1 8 8 ARG C C 13 179.6 0.3 . 1 . . . . . . . . 7086 1 69 . 1 1 9 9 VAL N N 15 120.2 0.3 . 1 . . . . . . . . 7086 1 70 . 1 1 9 9 VAL H H 1 7.32 0.03 . 1 . . . . . . . . 7086 1 71 . 1 1 9 9 VAL CA C 13 66.9 0.3 . 1 . . . . . . . . 7086 1 72 . 1 1 9 9 VAL HA H 1 3.46 0.03 . 1 . . . . . . . . 7086 1 73 . 1 1 9 9 VAL CB C 13 31.6 0.3 . 1 . . . . . . . . 7086 1 74 . 1 1 9 9 VAL HB H 1 1.81 0.03 . 1 . . . . . . . . 7086 1 75 . 1 1 9 9 VAL HG11 H 1 0.97 0.03 . 2 . . . . . . . . 7086 1 76 . 1 1 9 9 VAL HG12 H 1 0.97 0.03 . 2 . . . . . . . . 7086 1 77 . 1 1 9 9 VAL HG13 H 1 0.97 0.03 . 2 . . . . . . . . 7086 1 78 . 1 1 9 9 VAL HG21 H 1 0.64 0.03 . 2 . . . . . . . . 7086 1 79 . 1 1 9 9 VAL HG22 H 1 0.64 0.03 . 2 . . . . . . . . 7086 1 80 . 1 1 9 9 VAL HG23 H 1 0.64 0.03 . 2 . . . . . . . . 7086 1 81 . 1 1 9 9 VAL CG1 C 13 24.9 0.3 . 1 . . . . . . . . 7086 1 82 . 1 1 9 9 VAL CG2 C 13 22.4 0.3 . 1 . . . . . . . . 7086 1 83 . 1 1 9 9 VAL C C 13 177.2 0.3 . 1 . . . . . . . . 7086 1 84 . 1 1 10 10 LEU N N 15 120.1 0.3 . 1 . . . . . . . . 7086 1 85 . 1 1 10 10 LEU H H 1 8.28 0.03 . 1 . . . . . . . . 7086 1 86 . 1 1 10 10 LEU CA C 13 57.9 0.3 . 1 . . . . . . . . 7086 1 87 . 1 1 10 10 LEU HA H 1 4.01 0.03 . 1 . . . . . . . . 7086 1 88 . 1 1 10 10 LEU CB C 13 42.0 0.3 . 1 . . . . . . . . 7086 1 89 . 1 1 10 10 LEU HB2 H 1 2.01 0.03 . 2 . . . . . . . . 7086 1 90 . 1 1 10 10 LEU HB3 H 1 1.56 0.03 . 2 . . . . . . . . 7086 1 91 . 1 1 10 10 LEU CG C 13 27.3 0.3 . 1 . . . . . . . . 7086 1 92 . 1 1 10 10 LEU HG H 1 1.77 0.03 . 1 . . . . . . . . 7086 1 93 . 1 1 10 10 LEU HD11 H 1 0.96 0.03 . 2 . . . . . . . . 7086 1 94 . 1 1 10 10 LEU HD12 H 1 0.96 0.03 . 2 . . . . . . . . 7086 1 95 . 1 1 10 10 LEU HD13 H 1 0.96 0.03 . 2 . . . . . . . . 7086 1 96 . 1 1 10 10 LEU HD21 H 1 1.08 0.03 . 2 . . . . . . . . 7086 1 97 . 1 1 10 10 LEU HD22 H 1 1.08 0.03 . 2 . . . . . . . . 7086 1 98 . 1 1 10 10 LEU HD23 H 1 1.08 0.03 . 2 . . . . . . . . 7086 1 99 . 1 1 10 10 LEU CD1 C 13 26.8 0.3 . 1 . . . . . . . . 7086 1 100 . 1 1 10 10 LEU CD2 C 13 22.8 0.3 . 1 . . . . . . . . 7086 1 101 . 1 1 10 10 LEU C C 13 177.6 0.3 . 1 . . . . . . . . 7086 1 102 . 1 1 11 11 ARG N N 15 118.1 0.3 . 1 . . . . . . . . 7086 1 103 . 1 1 11 11 ARG H H 1 8.09 0.03 . 1 . . . . . . . . 7086 1 104 . 1 1 11 11 ARG CA C 13 58.8 0.3 . 1 . . . . . . . . 7086 1 105 . 1 1 11 11 ARG HA H 1 4.49 0.03 . 1 . . . . . . . . 7086 1 106 . 1 1 11 11 ARG CB C 13 29.3 0.3 . 1 . . . . . . . . 7086 1 107 . 1 1 11 11 ARG HB2 H 1 2.05 0.03 . 1 . . . . . . . . 7086 1 108 . 1 1 11 11 ARG HB3 H 1 2.05 0.03 . 1 . . . . . . . . 7086 1 109 . 1 1 11 11 ARG CG C 13 27.2 0.3 . 1 . . . . . . . . 7086 1 110 . 1 1 11 11 ARG HG2 H 1 1.85 0.03 . 1 . . . . . . . . 7086 1 111 . 1 1 11 11 ARG HG3 H 1 1.85 0.03 . 1 . . . . . . . . 7086 1 112 . 1 1 11 11 ARG CD C 13 43.2 0.3 . 1 . . . . . . . . 7086 1 113 . 1 1 11 11 ARG HD2 H 1 3.45 0.03 . 2 . . . . . . . . 7086 1 114 . 1 1 11 11 ARG HD3 H 1 3.39 0.03 . 2 . . . . . . . . 7086 1 115 . 1 1 11 11 ARG C C 13 177.5 0.3 . 1 . . . . . . . . 7086 1 116 . 1 1 12 12 LYS N N 15 119.4 0.3 . 1 . . . . . . . . 7086 1 117 . 1 1 12 12 LYS H H 1 7.51 0.03 . 1 . . . . . . . . 7086 1 118 . 1 1 12 12 LYS CA C 13 59.7 0.3 . 1 . . . . . . . . 7086 1 119 . 1 1 12 12 LYS HA H 1 4.22 0.03 . 1 . . . . . . . . 7086 1 120 . 1 1 12 12 LYS CB C 13 32.4 0.3 . 1 . . . . . . . . 7086 1 121 . 1 1 12 12 LYS HB2 H 1 2.02 0.03 . 2 . . . . . . . . 7086 1 122 . 1 1 12 12 LYS HB3 H 1 1.82 0.03 . 2 . . . . . . . . 7086 1 123 . 1 1 12 12 LYS CG C 13 26.6 0.3 . 1 . . . . . . . . 7086 1 124 . 1 1 12 12 LYS HG2 H 1 1.79 0.03 . 2 . . . . . . . . 7086 1 125 . 1 1 12 12 LYS HG3 H 1 1.41 0.03 . 2 . . . . . . . . 7086 1 126 . 1 1 12 12 LYS CE C 13 41.8 0.3 . 1 . . . . . . . . 7086 1 127 . 1 1 12 12 LYS HE2 H 1 2.91 0.03 . 1 . . . . . . . . 7086 1 128 . 1 1 12 12 LYS HE3 H 1 2.91 0.03 . 1 . . . . . . . . 7086 1 129 . 1 1 12 12 LYS C C 13 179.9 0.3 . 1 . . . . . . . . 7086 1 130 . 1 1 13 13 ILE N N 15 118.9 0.3 . 1 . . . . . . . . 7086 1 131 . 1 1 13 13 ILE H H 1 7.96 0.03 . 1 . . . . . . . . 7086 1 132 . 1 1 13 13 ILE CA C 13 63.6 0.3 . 1 . . . . . . . . 7086 1 133 . 1 1 13 13 ILE HA H 1 3.92 0.03 . 1 . . . . . . . . 7086 1 134 . 1 1 13 13 ILE CB C 13 38.9 0.3 . 1 . . . . . . . . 7086 1 135 . 1 1 13 13 ILE HB H 1 1.87 0.03 . 1 . . . . . . . . 7086 1 136 . 1 1 13 13 ILE HG21 H 1 0.25 0.03 . 1 . . . . . . . . 7086 1 137 . 1 1 13 13 ILE HG22 H 1 0.25 0.03 . 1 . . . . . . . . 7086 1 138 . 1 1 13 13 ILE HG23 H 1 0.25 0.03 . 1 . . . . . . . . 7086 1 139 . 1 1 13 13 ILE CG2 C 13 16.9 0.3 . 1 . . . . . . . . 7086 1 140 . 1 1 13 13 ILE CG1 C 13 28.2 0.3 . 1 . . . . . . . . 7086 1 141 . 1 1 13 13 ILE HG12 H 1 1.51 0.03 . 2 . . . . . . . . 7086 1 142 . 1 1 13 13 ILE HG13 H 1 0.11 0.03 . 2 . . . . . . . . 7086 1 143 . 1 1 13 13 ILE HD11 H 1 0.45 0.03 . 1 . . . . . . . . 7086 1 144 . 1 1 13 13 ILE HD12 H 1 0.45 0.03 . 1 . . . . . . . . 7086 1 145 . 1 1 13 13 ILE HD13 H 1 0.45 0.03 . 1 . . . . . . . . 7086 1 146 . 1 1 13 13 ILE CD1 C 13 14.7 0.3 . 1 . . . . . . . . 7086 1 147 . 1 1 13 13 ILE C C 13 177.3 0.3 . 1 . . . . . . . . 7086 1 148 . 1 1 14 14 TYR N N 15 120.9 0.3 . 1 . . . . . . . . 7086 1 149 . 1 1 14 14 TYR H H 1 9.29 0.03 . 1 . . . . . . . . 7086 1 150 . 1 1 14 14 TYR CA C 13 61.7 0.3 . 1 . . . . . . . . 7086 1 151 . 1 1 14 14 TYR HA H 1 4.10 0.03 . 1 . . . . . . . . 7086 1 152 . 1 1 14 14 TYR CB C 13 40.3 0.3 . 1 . . . . . . . . 7086 1 153 . 1 1 14 14 TYR HB2 H 1 3.38 0.03 . 2 . . . . . . . . 7086 1 154 . 1 1 14 14 TYR HB3 H 1 3.21 0.03 . 2 . . . . . . . . 7086 1 155 . 1 1 14 14 TYR HD1 H 1 7.36 0.03 . 1 . . . . . . . . 7086 1 156 . 1 1 14 14 TYR HD2 H 1 7.36 0.03 . 1 . . . . . . . . 7086 1 157 . 1 1 14 14 TYR CD1 C 13 133.9 0.3 . 1 . . . . . . . . 7086 1 158 . 1 1 14 14 TYR C C 13 177.9 0.3 . 1 . . . . . . . . 7086 1 159 . 1 1 15 15 ASP N N 15 117.5 0.3 . 1 . . . . . . . . 7086 1 160 . 1 1 15 15 ASP H H 1 9.29 0.03 . 1 . . . . . . . . 7086 1 161 . 1 1 15 15 ASP CA C 13 57.3 0.3 . 1 . . . . . . . . 7086 1 162 . 1 1 15 15 ASP HA H 1 4.37 0.03 . 1 . . . . . . . . 7086 1 163 . 1 1 15 15 ASP CB C 13 40.3 0.3 . 1 . . . . . . . . 7086 1 164 . 1 1 15 15 ASP HB2 H 1 2.91 0.03 . 2 . . . . . . . . 7086 1 165 . 1 1 15 15 ASP HB3 H 1 2.66 0.03 . 2 . . . . . . . . 7086 1 166 . 1 1 15 15 ASP C C 13 179.2 0.3 . 1 . . . . . . . . 7086 1 167 . 1 1 16 16 ARG N N 15 115.5 0.3 . 1 . . . . . . . . 7086 1 168 . 1 1 16 16 ARG H H 1 7.34 0.03 . 1 . . . . . . . . 7086 1 169 . 1 1 16 16 ARG CA C 13 57.9 0.3 . 1 . . . . . . . . 7086 1 170 . 1 1 16 16 ARG HA H 1 4.30 0.03 . 1 . . . . . . . . 7086 1 171 . 1 1 16 16 ARG CB C 13 30.5 0.3 . 1 . . . . . . . . 7086 1 172 . 1 1 16 16 ARG HB2 H 1 1.80 0.03 . 2 . . . . . . . . 7086 1 173 . 1 1 16 16 ARG HB3 H 1 1.42 0.03 . 2 . . . . . . . . 7086 1 174 . 1 1 16 16 ARG CG C 13 27.7 0.3 . 1 . . . . . . . . 7086 1 175 . 1 1 16 16 ARG HG2 H 1 1.77 0.03 . 2 . . . . . . . . 7086 1 176 . 1 1 16 16 ARG HG3 H 1 1.47 0.03 . 2 . . . . . . . . 7086 1 177 . 1 1 16 16 ARG CD C 13 42.9 0.3 . 1 . . . . . . . . 7086 1 178 . 1 1 16 16 ARG HD2 H 1 2.76 0.03 . 2 . . . . . . . . 7086 1 179 . 1 1 16 16 ARG HD3 H 1 2.32 0.03 . 2 . . . . . . . . 7086 1 180 . 1 1 16 16 ARG C C 13 178.0 0.3 . 1 . . . . . . . . 7086 1 181 . 1 1 17 17 LEU N N 15 116.2 0.3 . 1 . . . . . . . . 7086 1 182 . 1 1 17 17 LEU H H 1 7.75 0.03 . 1 . . . . . . . . 7086 1 183 . 1 1 17 17 LEU CA C 13 55.7 0.3 . 1 . . . . . . . . 7086 1 184 . 1 1 17 17 LEU HA H 1 4.21 0.03 . 1 . . . . . . . . 7086 1 185 . 1 1 17 17 LEU CB C 13 41.5 0.3 . 1 . . . . . . . . 7086 1 186 . 1 1 17 17 LEU HB2 H 1 1.39 0.03 . 2 . . . . . . . . 7086 1 187 . 1 1 17 17 LEU HB3 H 1 1.24 0.03 . 2 . . . . . . . . 7086 1 188 . 1 1 17 17 LEU CG C 13 26.4 0.3 . 1 . . . . . . . . 7086 1 189 . 1 1 17 17 LEU HG H 1 1.53 0.03 . 1 . . . . . . . . 7086 1 190 . 1 1 17 17 LEU HD11 H 1 0.57 0.03 . 2 . . . . . . . . 7086 1 191 . 1 1 17 17 LEU HD12 H 1 0.57 0.03 . 2 . . . . . . . . 7086 1 192 . 1 1 17 17 LEU HD13 H 1 0.57 0.03 . 2 . . . . . . . . 7086 1 193 . 1 1 17 17 LEU HD21 H 1 -0.69 0.03 . 2 . . . . . . . . 7086 1 194 . 1 1 17 17 LEU HD22 H 1 -0.69 0.03 . 2 . . . . . . . . 7086 1 195 . 1 1 17 17 LEU HD23 H 1 -0.69 0.03 . 2 . . . . . . . . 7086 1 196 . 1 1 17 17 LEU CD1 C 13 24.3 0.3 . 1 . . . . . . . . 7086 1 197 . 1 1 17 17 LEU CD2 C 13 23.0 0.3 . 1 . . . . . . . . 7086 1 198 . 1 1 17 17 LEU C C 13 179.6 0.3 . 1 . . . . . . . . 7086 1 199 . 1 1 18 18 LYS N N 15 121.3 0.3 . 1 . . . . . . . . 7086 1 200 . 1 1 18 18 LYS H H 1 8.21 0.03 . 1 . . . . . . . . 7086 1 201 . 1 1 18 18 LYS CA C 13 59.4 0.3 . 1 . . . . . . . . 7086 1 202 . 1 1 18 18 LYS HA H 1 4.16 0.03 . 1 . . . . . . . . 7086 1 203 . 1 1 18 18 LYS CB C 13 31.3 0.3 . 1 . . . . . . . . 7086 1 204 . 1 1 18 18 LYS HB2 H 1 1.74 0.03 . 2 . . . . . . . . 7086 1 205 . 1 1 18 18 LYS HB3 H 1 1.34 0.03 . 2 . . . . . . . . 7086 1 206 . 1 1 18 18 LYS CG C 13 24.2 0.3 . 1 . . . . . . . . 7086 1 207 . 1 1 18 18 LYS HG2 H 1 1.40 0.03 . 2 . . . . . . . . 7086 1 208 . 1 1 18 18 LYS HG3 H 1 1.18 0.03 . 2 . . . . . . . . 7086 1 209 . 1 1 18 18 LYS CD C 13 30.0 0.3 . 1 . . . . . . . . 7086 1 210 . 1 1 18 18 LYS HD2 H 1 1.66 0.03 . 2 . . . . . . . . 7086 1 211 . 1 1 18 18 LYS HD3 H 1 1.53 0.03 . 2 . . . . . . . . 7086 1 212 . 1 1 18 18 LYS CE C 13 42.2 0.3 . 1 . . . . . . . . 7086 1 213 . 1 1 18 18 LYS HE2 H 1 3.08 0.03 . 1 . . . . . . . . 7086 1 214 . 1 1 18 18 LYS HE3 H 1 3.08 0.03 . 1 . . . . . . . . 7086 1 215 . 1 1 18 18 LYS C C 13 177.0 0.3 . 1 . . . . . . . . 7086 1 216 . 1 1 19 19 ASN N N 15 116.1 0.3 . 1 . . . . . . . . 7086 1 217 . 1 1 19 19 ASN H H 1 8.37 0.03 . 1 . . . . . . . . 7086 1 218 . 1 1 19 19 ASN CA C 13 53.0 0.3 . 1 . . . . . . . . 7086 1 219 . 1 1 19 19 ASN HA H 1 5.10 0.03 . 1 . . . . . . . . 7086 1 220 . 1 1 19 19 ASN CB C 13 39.1 0.3 . 1 . . . . . . . . 7086 1 221 . 1 1 19 19 ASN HB2 H 1 3.08 0.03 . 2 . . . . . . . . 7086 1 222 . 1 1 19 19 ASN HB3 H 1 2.68 0.03 . 2 . . . . . . . . 7086 1 223 . 1 1 19 19 ASN C C 13 175.0 0.3 . 1 . . . . . . . . 7086 1 224 . 1 1 20 20 GLU N N 15 118.6 0.3 . 1 . . . . . . . . 7086 1 225 . 1 1 20 20 GLU H H 1 7.68 0.03 . 1 . . . . . . . . 7086 1 226 . 1 1 20 20 GLU CA C 13 54.6 0.3 . 1 . . . . . . . . 7086 1 227 . 1 1 20 20 GLU HA H 1 4.65 0.03 . 1 . . . . . . . . 7086 1 228 . 1 1 20 20 GLU CB C 13 31.0 0.3 . 1 . . . . . . . . 7086 1 229 . 1 1 20 20 GLU HB2 H 1 1.78 0.03 . 1 . . . . . . . . 7086 1 230 . 1 1 20 20 GLU HB3 H 1 1.78 0.03 . 1 . . . . . . . . 7086 1 231 . 1 1 20 20 GLU CG C 13 35.0 0.3 . 1 . . . . . . . . 7086 1 232 . 1 1 20 20 GLU HG2 H 1 2.29 0.03 . 1 . . . . . . . . 7086 1 233 . 1 1 20 20 GLU HG3 H 1 2.29 0.03 . 1 . . . . . . . . 7086 1 234 . 1 1 21 21 LYS CA C 13 63.1 0.3 . 1 . . . . . . . . 7086 1 235 . 1 1 21 21 LYS HA H 1 4.55 0.03 . 1 . . . . . . . . 7086 1 236 . 1 1 21 21 LYS CB C 13 31.3 0.3 . 1 . . . . . . . . 7086 1 237 . 1 1 21 21 LYS HB2 H 1 1.97 0.03 . 2 . . . . . . . . 7086 1 238 . 1 1 21 21 LYS HB3 H 1 1.76 0.03 . 2 . . . . . . . . 7086 1 239 . 1 1 21 21 LYS CG C 13 25.2 0.3 . 1 . . . . . . . . 7086 1 240 . 1 1 21 21 LYS HG2 H 1 1.49 0.03 . 2 . . . . . . . . 7086 1 241 . 1 1 21 21 LYS HG3 H 1 1.42 0.03 . 2 . . . . . . . . 7086 1 242 . 1 1 21 21 LYS CD C 13 29.4 0.3 . 1 . . . . . . . . 7086 1 243 . 1 1 21 21 LYS HD2 H 1 1.71 0.03 . 1 . . . . . . . . 7086 1 244 . 1 1 21 21 LYS HD3 H 1 1.71 0.03 . 1 . . . . . . . . 7086 1 245 . 1 1 21 21 LYS CE C 13 42.0 0.3 . 1 . . . . . . . . 7086 1 246 . 1 1 21 21 LYS HE2 H 1 3.03 0.03 . 1 . . . . . . . . 7086 1 247 . 1 1 21 21 LYS HE3 H 1 3.03 0.03 . 1 . . . . . . . . 7086 1 248 . 1 1 21 21 LYS C C 13 175.8 0.3 . 1 . . . . . . . . 7086 1 249 . 1 1 22 22 VAL N N 15 121.7 0.3 . 1 . . . . . . . . 7086 1 250 . 1 1 22 22 VAL H H 1 7.50 0.03 . 1 . . . . . . . . 7086 1 251 . 1 1 22 22 VAL CA C 13 61.4 0.3 . 1 . . . . . . . . 7086 1 252 . 1 1 22 22 VAL HA H 1 4.03 0.03 . 1 . . . . . . . . 7086 1 253 . 1 1 22 22 VAL CB C 13 34.8 0.3 . 1 . . . . . . . . 7086 1 254 . 1 1 22 22 VAL HB H 1 1.91 0.03 . 1 . . . . . . . . 7086 1 255 . 1 1 22 22 VAL CG1 C 13 22.4 0.3 . 1 . . . . . . . . 7086 1 256 . 1 1 22 22 VAL HG11 H 1 0.91 0.03 . 1 . . . . . . . . 7086 1 257 . 1 1 22 22 VAL HG12 H 1 0.91 0.03 . 1 . . . . . . . . 7086 1 258 . 1 1 22 22 VAL HG13 H 1 0.91 0.03 . 1 . . . . . . . . 7086 1 259 . 1 1 22 22 VAL HG21 H 1 0.91 0.03 . 1 . . . . . . . . 7086 1 260 . 1 1 22 22 VAL HG22 H 1 0.91 0.03 . 1 . . . . . . . . 7086 1 261 . 1 1 22 22 VAL HG23 H 1 0.91 0.03 . 1 . . . . . . . . 7086 1 262 . 1 1 22 22 VAL C C 13 174.8 0.3 . 1 . . . . . . . . 7086 1 263 . 1 1 23 23 ASN N N 15 129.4 0.3 . 1 . . . . . . . . 7086 1 264 . 1 1 23 23 ASN H H 1 9.79 0.03 . 1 . . . . . . . . 7086 1 265 . 1 1 23 23 ASN CA C 13 51.9 0.3 . 1 . . . . . . . . 7086 1 266 . 1 1 23 23 ASN HA H 1 4.96 0.03 . 1 . . . . . . . . 7086 1 267 . 1 1 23 23 ASN CB C 13 38.1 0.3 . 1 . . . . . . . . 7086 1 268 . 1 1 23 23 ASN HB2 H 1 3.11 0.03 . 2 . . . . . . . . 7086 1 269 . 1 1 23 23 ASN HB3 H 1 2.82 0.03 . 2 . . . . . . . . 7086 1 270 . 1 1 23 23 ASN ND2 N 15 109.6 0.3 . 1 . . . . . . . . 7086 1 271 . 1 1 23 23 ASN HD21 H 1 7.66 0.03 . 2 . . . . . . . . 7086 1 272 . 1 1 23 23 ASN HD22 H 1 6.25 0.03 . 2 . . . . . . . . 7086 1 273 . 1 1 23 23 ASN C C 13 173.3 0.3 . 1 . . . . . . . . 7086 1 274 . 1 1 24 24 TRP N N 15 123.0 0.3 . 1 . . . . . . . . 7086 1 275 . 1 1 24 24 TRP H H 1 7.92 0.03 . 1 . . . . . . . . 7086 1 276 . 1 1 24 24 TRP CA C 13 54.3 0.3 . 1 . . . . . . . . 7086 1 277 . 1 1 24 24 TRP HA H 1 5.67 0.03 . 1 . . . . . . . . 7086 1 278 . 1 1 24 24 TRP CB C 13 31.5 0.3 . 1 . . . . . . . . 7086 1 279 . 1 1 24 24 TRP HB2 H 1 3.12 0.03 . 2 . . . . . . . . 7086 1 280 . 1 1 24 24 TRP HB3 H 1 2.90 0.03 . 2 . . . . . . . . 7086 1 281 . 1 1 24 24 TRP CD1 C 13 126.4 0.3 . 1 . . . . . . . . 7086 1 282 . 1 1 24 24 TRP NE1 N 15 131.3 0.3 . 1 . . . . . . . . 7086 1 283 . 1 1 24 24 TRP HD1 H 1 7.53 0.03 . 1 . . . . . . . . 7086 1 284 . 1 1 24 24 TRP CZ2 C 13 113.6 0.3 . 1 . . . . . . . . 7086 1 285 . 1 1 24 24 TRP HE1 H 1 10.39 0.03 . 1 . . . . . . . . 7086 1 286 . 1 1 24 24 TRP HZ2 H 1 7.55 0.03 . 1 . . . . . . . . 7086 1 287 . 1 1 24 24 TRP C C 13 173.1 0.3 . 1 . . . . . . . . 7086 1 288 . 1 1 25 25 VAL N N 15 110.5 0.3 . 1 . . . . . . . . 7086 1 289 . 1 1 25 25 VAL H H 1 8.90 0.03 . 1 . . . . . . . . 7086 1 290 . 1 1 25 25 VAL CA C 13 58.6 0.3 . 1 . . . . . . . . 7086 1 291 . 1 1 25 25 VAL HA H 1 4.02 0.03 . 1 . . . . . . . . 7086 1 292 . 1 1 25 25 VAL CB C 13 36.0 0.3 . 1 . . . . . . . . 7086 1 293 . 1 1 25 25 VAL HB H 1 1.81 0.03 . 1 . . . . . . . . 7086 1 294 . 1 1 25 25 VAL HG11 H 1 0.58 0.03 . 2 . . . . . . . . 7086 1 295 . 1 1 25 25 VAL HG12 H 1 0.58 0.03 . 2 . . . . . . . . 7086 1 296 . 1 1 25 25 VAL HG13 H 1 0.58 0.03 . 2 . . . . . . . . 7086 1 297 . 1 1 25 25 VAL HG21 H 1 0.69 0.03 . 2 . . . . . . . . 7086 1 298 . 1 1 25 25 VAL HG22 H 1 0.69 0.03 . 2 . . . . . . . . 7086 1 299 . 1 1 25 25 VAL HG23 H 1 0.69 0.03 . 2 . . . . . . . . 7086 1 300 . 1 1 25 25 VAL CG1 C 13 24.2 0.3 . 1 . . . . . . . . 7086 1 301 . 1 1 25 25 VAL CG2 C 13 20.8 0.3 . 1 . . . . . . . . 7086 1 302 . 1 1 25 25 VAL C C 13 174.4 0.3 . 1 . . . . . . . . 7086 1 303 . 1 1 26 26 VAL N N 15 123.8 0.3 . 1 . . . . . . . . 7086 1 304 . 1 1 26 26 VAL H H 1 8.86 0.03 . 1 . . . . . . . . 7086 1 305 . 1 1 26 26 VAL CA C 13 62.6 0.3 . 1 . . . . . . . . 7086 1 306 . 1 1 26 26 VAL HA H 1 4.71 0.03 . 1 . . . . . . . . 7086 1 307 . 1 1 26 26 VAL CB C 13 32.4 0.3 . 1 . . . . . . . . 7086 1 308 . 1 1 26 26 VAL HB H 1 2.00 0.03 . 1 . . . . . . . . 7086 1 309 . 1 1 26 26 VAL HG11 H 1 1.08 0.03 . 2 . . . . . . . . 7086 1 310 . 1 1 26 26 VAL HG12 H 1 1.08 0.03 . 2 . . . . . . . . 7086 1 311 . 1 1 26 26 VAL HG13 H 1 1.08 0.03 . 2 . . . . . . . . 7086 1 312 . 1 1 26 26 VAL HG21 H 1 1.07 0.03 . 2 . . . . . . . . 7086 1 313 . 1 1 26 26 VAL HG22 H 1 1.07 0.03 . 2 . . . . . . . . 7086 1 314 . 1 1 26 26 VAL HG23 H 1 1.07 0.03 . 2 . . . . . . . . 7086 1 315 . 1 1 26 26 VAL CG1 C 13 24.1 0.3 . 1 . . . . . . . . 7086 1 316 . 1 1 26 26 VAL CG2 C 13 22.9 0.3 . 1 . . . . . . . . 7086 1 317 . 1 1 26 26 VAL C C 13 175.5 0.3 . 1 . . . . . . . . 7086 1 318 . 1 1 27 27 THR N N 15 119.0 0.3 . 1 . . . . . . . . 7086 1 319 . 1 1 27 27 THR H H 1 8.39 0.03 . 1 . . . . . . . . 7086 1 320 . 1 1 27 27 THR CA C 13 59.5 0.3 . 1 . . . . . . . . 7086 1 321 . 1 1 27 27 THR HA H 1 4.93 0.03 . 1 . . . . . . . . 7086 1 322 . 1 1 27 27 THR CB C 13 69.8 0.3 . 1 . . . . . . . . 7086 1 323 . 1 1 27 27 THR HB H 1 4.31 0.03 . 1 . . . . . . . . 7086 1 324 . 1 1 27 27 THR HG21 H 1 1.12 0.03 . 1 . . . . . . . . 7086 1 325 . 1 1 27 27 THR HG22 H 1 1.12 0.03 . 1 . . . . . . . . 7086 1 326 . 1 1 27 27 THR HG23 H 1 1.12 0.03 . 1 . . . . . . . . 7086 1 327 . 1 1 27 27 THR CG2 C 13 22.2 0.3 . 1 . . . . . . . . 7086 1 328 . 1 1 27 27 THR C C 13 173.8 0.3 . 1 . . . . . . . . 7086 1 329 . 1 1 28 28 GLY N N 15 108.8 0.3 . 1 . . . . . . . . 7086 1 330 . 1 1 28 28 GLY H H 1 8.84 0.03 . 1 . . . . . . . . 7086 1 331 . 1 1 28 28 GLY CA C 13 44.8 0.3 . 1 . . . . . . . . 7086 1 332 . 1 1 28 28 GLY HA2 H 1 3.96 0.03 . 2 . . . . . . . . 7086 1 333 . 1 1 28 28 GLY HA3 H 1 3.32 0.03 . 2 . . . . . . . . 7086 1 334 . 1 1 28 28 GLY C C 13 173.7 0.3 . 1 . . . . . . . . 7086 1 335 . 1 1 29 29 SER N N 15 115.0 0.3 . 1 . . . . . . . . 7086 1 336 . 1 1 29 29 SER H H 1 8.21 0.03 . 1 . . . . . . . . 7086 1 337 . 1 1 29 29 SER CA C 13 62.6 0.3 . 1 . . . . . . . . 7086 1 338 . 1 1 29 29 SER HA H 1 3.95 0.03 . 1 . . . . . . . . 7086 1 339 . 1 1 29 29 SER CB C 13 62.2 0.3 . 1 . . . . . . . . 7086 1 340 . 1 1 29 29 SER HB2 H 1 3.66 0.03 . 1 . . . . . . . . 7086 1 341 . 1 1 29 29 SER HB3 H 1 3.66 0.03 . 1 . . . . . . . . 7086 1 342 . 1 1 29 29 SER C C 13 174.8 0.3 . 1 . . . . . . . . 7086 1 343 . 1 1 30 30 LEU N N 15 120.0 0.3 . 1 . . . . . . . . 7086 1 344 . 1 1 30 30 LEU H H 1 9.13 0.03 . 1 . . . . . . . . 7086 1 345 . 1 1 30 30 LEU CA C 13 57.7 0.3 . 1 . . . . . . . . 7086 1 346 . 1 1 30 30 LEU HA H 1 4.04 0.03 . 1 . . . . . . . . 7086 1 347 . 1 1 30 30 LEU CB C 13 41.7 0.3 . 1 . . . . . . . . 7086 1 348 . 1 1 30 30 LEU HB2 H 1 2.03 0.03 . 1 . . . . . . . . 7086 1 349 . 1 1 30 30 LEU HB3 H 1 2.03 0.03 . 1 . . . . . . . . 7086 1 350 . 1 1 30 30 LEU CG C 13 26.8 0.3 . 1 . . . . . . . . 7086 1 351 . 1 1 30 30 LEU HG H 1 1.78 0.03 . 1 . . . . . . . . 7086 1 352 . 1 1 30 30 LEU HD11 H 1 0.95 0.03 . 2 . . . . . . . . 7086 1 353 . 1 1 30 30 LEU HD12 H 1 0.95 0.03 . 2 . . . . . . . . 7086 1 354 . 1 1 30 30 LEU HD13 H 1 0.95 0.03 . 2 . . . . . . . . 7086 1 355 . 1 1 30 30 LEU HD21 H 1 1.06 0.03 . 2 . . . . . . . . 7086 1 356 . 1 1 30 30 LEU HD22 H 1 1.06 0.03 . 2 . . . . . . . . 7086 1 357 . 1 1 30 30 LEU HD23 H 1 1.06 0.03 . 2 . . . . . . . . 7086 1 358 . 1 1 30 30 LEU CD1 C 13 24.6 0.3 . 1 . . . . . . . . 7086 1 359 . 1 1 30 30 LEU CD2 C 13 23.1 0.3 . 1 . . . . . . . . 7086 1 360 . 1 1 30 30 LEU C C 13 178.1 0.3 . 1 . . . . . . . . 7086 1 361 . 1 1 31 31 SER N N 15 111.6 0.3 . 1 . . . . . . . . 7086 1 362 . 1 1 31 31 SER H H 1 6.38 0.03 . 1 . . . . . . . . 7086 1 363 . 1 1 31 31 SER CA C 13 60.0 0.3 . 1 . . . . . . . . 7086 1 364 . 1 1 31 31 SER HA H 1 3.89 0.03 . 1 . . . . . . . . 7086 1 365 . 1 1 31 31 SER CB C 13 62.3 0.3 . 1 . . . . . . . . 7086 1 366 . 1 1 31 31 SER HB2 H 1 3.56 0.03 . 1 . . . . . . . . 7086 1 367 . 1 1 31 31 SER HB3 H 1 3.56 0.03 . 1 . . . . . . . . 7086 1 368 . 1 1 31 31 SER C C 13 177.5 0.3 . 1 . . . . . . . . 7086 1 369 . 1 1 32 32 PHE N N 15 117.4 0.3 . 1 . . . . . . . . 7086 1 370 . 1 1 32 32 PHE H H 1 8.06 0.03 . 1 . . . . . . . . 7086 1 371 . 1 1 32 32 PHE CA C 13 57.7 0.3 . 1 . . . . . . . . 7086 1 372 . 1 1 32 32 PHE HA H 1 4.20 0.03 . 1 . . . . . . . . 7086 1 373 . 1 1 32 32 PHE CB C 13 35.6 0.3 . 1 . . . . . . . . 7086 1 374 . 1 1 32 32 PHE HB2 H 1 3.20 0.03 . 2 . . . . . . . . 7086 1 375 . 1 1 32 32 PHE HB3 H 1 2.83 0.03 . 2 . . . . . . . . 7086 1 376 . 1 1 32 32 PHE HD1 H 1 6.95 0.03 . 1 . . . . . . . . 7086 1 377 . 1 1 32 32 PHE HD2 H 1 6.95 0.03 . 1 . . . . . . . . 7086 1 378 . 1 1 32 32 PHE HE1 H 1 7.19 0.03 . 1 . . . . . . . . 7086 1 379 . 1 1 32 32 PHE HE2 H 1 7.19 0.03 . 1 . . . . . . . . 7086 1 380 . 1 1 32 32 PHE CD1 C 13 130.5 0.3 . 1 . . . . . . . . 7086 1 381 . 1 1 32 32 PHE CE1 C 13 131.0 0.3 . 1 . . . . . . . . 7086 1 382 . 1 1 32 32 PHE C C 13 178.3 0.3 . 1 . . . . . . . . 7086 1 383 . 1 1 33 33 ALA N N 15 122.1 0.3 . 1 . . . . . . . . 7086 1 384 . 1 1 33 33 ALA H H 1 8.70 0.03 . 1 . . . . . . . . 7086 1 385 . 1 1 33 33 ALA CA C 13 54.8 0.3 . 1 . . . . . . . . 7086 1 386 . 1 1 33 33 ALA HA H 1 4.68 0.03 . 1 . . . . . . . . 7086 1 387 . 1 1 33 33 ALA HB1 H 1 1.37 0.03 . 1 . . . . . . . . 7086 1 388 . 1 1 33 33 ALA HB2 H 1 1.37 0.03 . 1 . . . . . . . . 7086 1 389 . 1 1 33 33 ALA HB3 H 1 1.37 0.03 . 1 . . . . . . . . 7086 1 390 . 1 1 33 33 ALA CB C 13 18.9 0.3 . 1 . . . . . . . . 7086 1 391 . 1 1 33 33 ALA C C 13 182.9 0.3 . 1 . . . . . . . . 7086 1 392 . 1 1 34 34 LEU N N 15 120.0 0.3 . 1 . . . . . . . . 7086 1 393 . 1 1 34 34 LEU H H 1 8.62 0.03 . 1 . . . . . . . . 7086 1 394 . 1 1 34 34 LEU CA C 13 57.3 0.3 . 1 . . . . . . . . 7086 1 395 . 1 1 34 34 LEU HA H 1 4.00 0.03 . 1 . . . . . . . . 7086 1 396 . 1 1 34 34 LEU CB C 13 42.3 0.3 . 1 . . . . . . . . 7086 1 397 . 1 1 34 34 LEU HB2 H 1 2.18 0.03 . 1 . . . . . . . . 7086 1 398 . 1 1 34 34 LEU HB3 H 1 2.18 0.03 . 1 . . . . . . . . 7086 1 399 . 1 1 34 34 LEU CG C 13 26.8 0.3 . 1 . . . . . . . . 7086 1 400 . 1 1 34 34 LEU HG H 1 1.91 0.03 . 1 . . . . . . . . 7086 1 401 . 1 1 34 34 LEU HD11 H 1 0.69 0.03 . 2 . . . . . . . . 7086 1 402 . 1 1 34 34 LEU HD12 H 1 0.69 0.03 . 2 . . . . . . . . 7086 1 403 . 1 1 34 34 LEU HD13 H 1 0.69 0.03 . 2 . . . . . . . . 7086 1 404 . 1 1 34 34 LEU HD21 H 1 0.73 0.03 . 2 . . . . . . . . 7086 1 405 . 1 1 34 34 LEU HD22 H 1 0.73 0.03 . 2 . . . . . . . . 7086 1 406 . 1 1 34 34 LEU HD23 H 1 0.73 0.03 . 2 . . . . . . . . 7086 1 407 . 1 1 34 34 LEU CD1 C 13 26.8 0.3 . 1 . . . . . . . . 7086 1 408 . 1 1 34 34 LEU CD2 C 13 23.2 0.3 . 1 . . . . . . . . 7086 1 409 . 1 1 34 34 LEU C C 13 178.1 0.3 . 1 . . . . . . . . 7086 1 410 . 1 1 35 35 GLN N N 15 114.2 0.3 . 1 . . . . . . . . 7086 1 411 . 1 1 35 35 GLN H H 1 7.67 0.03 . 1 . . . . . . . . 7086 1 412 . 1 1 35 35 GLN CA C 13 56.8 0.3 . 1 . . . . . . . . 7086 1 413 . 1 1 35 35 GLN HA H 1 4.35 0.03 . 1 . . . . . . . . 7086 1 414 . 1 1 35 35 GLN CB C 13 30.8 0.3 . 1 . . . . . . . . 7086 1 415 . 1 1 35 35 GLN HB2 H 1 2.50 0.03 . 2 . . . . . . . . 7086 1 416 . 1 1 35 35 GLN HB3 H 1 2.01 0.03 . 2 . . . . . . . . 7086 1 417 . 1 1 35 35 GLN CG C 13 37.0 0.3 . 1 . . . . . . . . 7086 1 418 . 1 1 35 35 GLN HG2 H 1 2.84 0.03 . 2 . . . . . . . . 7086 1 419 . 1 1 35 35 GLN HG3 H 1 1.78 0.03 . 2 . . . . . . . . 7086 1 420 . 1 1 35 35 GLN C C 13 174.6 0.3 . 1 . . . . . . . . 7086 1 421 . 1 1 36 36 GLY N N 15 105.8 0.3 . 1 . . . . . . . . 7086 1 422 . 1 1 36 36 GLY H H 1 7.59 0.03 . 1 . . . . . . . . 7086 1 423 . 1 1 36 36 GLY CA C 13 45.0 0.3 . 1 . . . . . . . . 7086 1 424 . 1 1 36 36 GLY HA2 H 1 4.33 0.03 . 2 . . . . . . . . 7086 1 425 . 1 1 36 36 GLY HA3 H 1 3.45 0.03 . 2 . . . . . . . . 7086 1 426 . 1 1 36 36 GLY C C 13 173.1 0.3 . 1 . . . . . . . . 7086 1 427 . 1 1 37 37 VAL N N 15 124.1 0.3 . 1 . . . . . . . . 7086 1 428 . 1 1 37 37 VAL H H 1 8.08 0.03 . 1 . . . . . . . . 7086 1 429 . 1 1 37 37 VAL CA C 13 57.3 0.3 . 1 . . . . . . . . 7086 1 430 . 1 1 37 37 VAL HA H 1 4.21 0.03 . 1 . . . . . . . . 7086 1 431 . 1 1 37 37 VAL CB C 13 32.0 0.3 . 1 . . . . . . . . 7086 1 432 . 1 1 37 37 VAL HB H 1 1.38 0.03 . 1 . . . . . . . . 7086 1 433 . 1 1 37 37 VAL HG11 H 1 0.30 0.03 . 2 . . . . . . . . 7086 1 434 . 1 1 37 37 VAL HG12 H 1 0.30 0.03 . 2 . . . . . . . . 7086 1 435 . 1 1 37 37 VAL HG13 H 1 0.30 0.03 . 2 . . . . . . . . 7086 1 436 . 1 1 37 37 VAL HG21 H 1 -0.16 0.03 . 2 . . . . . . . . 7086 1 437 . 1 1 37 37 VAL HG22 H 1 -0.16 0.03 . 2 . . . . . . . . 7086 1 438 . 1 1 37 37 VAL HG23 H 1 -0.16 0.03 . 2 . . . . . . . . 7086 1 439 . 1 1 37 37 VAL CG1 C 13 21.1 0.3 . 1 . . . . . . . . 7086 1 440 . 1 1 37 37 VAL CG2 C 13 20.4 0.3 . 1 . . . . . . . . 7086 1 441 . 1 1 38 38 PRO CD C 13 50.7 0.3 . 1 . . . . . . . . 7086 1 442 . 1 1 38 38 PRO CA C 13 62.5 0.3 . 1 . . . . . . . . 7086 1 443 . 1 1 38 38 PRO HA H 1 4.00 0.03 . 1 . . . . . . . . 7086 1 444 . 1 1 38 38 PRO CB C 13 28.9 0.3 . 1 . . . . . . . . 7086 1 445 . 1 1 38 38 PRO HB2 H 1 2.13 0.03 . 2 . . . . . . . . 7086 1 446 . 1 1 38 38 PRO HB3 H 1 1.75 0.03 . 2 . . . . . . . . 7086 1 447 . 1 1 38 38 PRO CG C 13 28.1 0.3 . 1 . . . . . . . . 7086 1 448 . 1 1 38 38 PRO HG2 H 1 1.99 0.03 . 1 . . . . . . . . 7086 1 449 . 1 1 38 38 PRO HG3 H 1 1.99 0.03 . 1 . . . . . . . . 7086 1 450 . 1 1 38 38 PRO HD2 H 1 3.60 0.03 . 2 . . . . . . . . 7086 1 451 . 1 1 38 38 PRO HD3 H 1 3.18 0.03 . 2 . . . . . . . . 7086 1 452 . 1 1 38 38 PRO C C 13 174.9 0.3 . 1 . . . . . . . . 7086 1 453 . 1 1 39 39 VAL N N 15 121.2 0.3 . 1 . . . . . . . . 7086 1 454 . 1 1 39 39 VAL H H 1 7.88 0.03 . 1 . . . . . . . . 7086 1 455 . 1 1 39 39 VAL CA C 13 59.0 0.3 . 1 . . . . . . . . 7086 1 456 . 1 1 39 39 VAL HA H 1 4.47 0.03 . 1 . . . . . . . . 7086 1 457 . 1 1 39 39 VAL CB C 13 34.9 0.3 . 1 . . . . . . . . 7086 1 458 . 1 1 39 39 VAL HB H 1 2.15 0.03 . 1 . . . . . . . . 7086 1 459 . 1 1 39 39 VAL HG11 H 1 0.85 0.03 . 2 . . . . . . . . 7086 1 460 . 1 1 39 39 VAL HG12 H 1 0.85 0.03 . 2 . . . . . . . . 7086 1 461 . 1 1 39 39 VAL HG13 H 1 0.85 0.03 . 2 . . . . . . . . 7086 1 462 . 1 1 39 39 VAL HG21 H 1 0.87 0.03 . 2 . . . . . . . . 7086 1 463 . 1 1 39 39 VAL HG22 H 1 0.87 0.03 . 2 . . . . . . . . 7086 1 464 . 1 1 39 39 VAL HG23 H 1 0.87 0.03 . 2 . . . . . . . . 7086 1 465 . 1 1 39 39 VAL CG1 C 13 22.4 0.3 . 1 . . . . . . . . 7086 1 466 . 1 1 39 39 VAL CG2 C 13 20.7 0.3 . 1 . . . . . . . . 7086 1 467 . 1 1 39 39 VAL C C 13 174.4 0.3 . 1 . . . . . . . . 7086 1 468 . 1 1 40 40 GLU N N 15 121.7 0.3 . 1 . . . . . . . . 7086 1 469 . 1 1 40 40 GLU H H 1 8.21 0.03 . 1 . . . . . . . . 7086 1 470 . 1 1 40 40 GLU CA C 13 55.6 0.3 . 1 . . . . . . . . 7086 1 471 . 1 1 40 40 GLU HA H 1 4.21 0.03 . 1 . . . . . . . . 7086 1 472 . 1 1 40 40 GLU CB C 13 30.9 0.3 . 1 . . . . . . . . 7086 1 473 . 1 1 40 40 GLU HB2 H 1 1.82 0.03 . 2 . . . . . . . . 7086 1 474 . 1 1 40 40 GLU HB3 H 1 1.77 0.03 . 2 . . . . . . . . 7086 1 475 . 1 1 40 40 GLU CG C 13 36.5 0.3 . 1 . . . . . . . . 7086 1 476 . 1 1 40 40 GLU HG2 H 1 2.25 0.03 . 2 . . . . . . . . 7086 1 477 . 1 1 40 40 GLU HG3 H 1 2.11 0.03 . 2 . . . . . . . . 7086 1 478 . 1 1 40 40 GLU C C 13 175.6 0.3 . 1 . . . . . . . . 7086 1 479 . 1 1 41 41 VAL N N 15 122.8 0.3 . 1 . . . . . . . . 7086 1 480 . 1 1 41 41 VAL H H 1 7.79 0.03 . 1 . . . . . . . . 7086 1 481 . 1 1 41 41 VAL CA C 13 61.6 0.3 . 1 . . . . . . . . 7086 1 482 . 1 1 41 41 VAL HA H 1 3.81 0.03 . 1 . . . . . . . . 7086 1 483 . 1 1 41 41 VAL CB C 13 33.2 0.3 . 1 . . . . . . . . 7086 1 484 . 1 1 41 41 VAL HB H 1 1.45 0.03 . 1 . . . . . . . . 7086 1 485 . 1 1 41 41 VAL HG11 H 1 0.38 0.03 . 2 . . . . . . . . 7086 1 486 . 1 1 41 41 VAL HG12 H 1 0.38 0.03 . 2 . . . . . . . . 7086 1 487 . 1 1 41 41 VAL HG13 H 1 0.38 0.03 . 2 . . . . . . . . 7086 1 488 . 1 1 41 41 VAL HG21 H 1 0.59 0.03 . 2 . . . . . . . . 7086 1 489 . 1 1 41 41 VAL HG22 H 1 0.59 0.03 . 2 . . . . . . . . 7086 1 490 . 1 1 41 41 VAL HG23 H 1 0.59 0.03 . 2 . . . . . . . . 7086 1 491 . 1 1 41 41 VAL CG1 C 13 22.5 0.3 . 1 . . . . . . . . 7086 1 492 . 1 1 41 41 VAL CG2 C 13 21.8 0.3 . 1 . . . . . . . . 7086 1 493 . 1 1 42 42 HIS CA C 13 55.6 0.3 . 1 . . . . . . . . 7086 1 494 . 1 1 42 42 HIS HA H 1 4.89 0.03 . 1 . . . . . . . . 7086 1 495 . 1 1 42 42 HIS CB C 13 33.0 0.3 . 1 . . . . . . . . 7086 1 496 . 1 1 42 42 HIS HB2 H 1 3.24 0.03 . 2 . . . . . . . . 7086 1 497 . 1 1 42 42 HIS HB3 H 1 2.83 0.03 . 2 . . . . . . . . 7086 1 498 . 1 1 42 42 HIS C C 13 174.3 0.3 . 1 . . . . . . . . 7086 1 499 . 1 1 43 43 ASP N N 15 119.4 0.3 . 1 . . . . . . . . 7086 1 500 . 1 1 43 43 ASP H H 1 8.15 0.03 . 1 . . . . . . . . 7086 1 501 . 1 1 43 43 ASP CA C 13 53.4 0.3 . 1 . . . . . . . . 7086 1 502 . 1 1 43 43 ASP HA H 1 4.60 0.03 . 1 . . . . . . . . 7086 1 503 . 1 1 43 43 ASP CB C 13 41.9 0.3 . 1 . . . . . . . . 7086 1 504 . 1 1 43 43 ASP HB2 H 1 3.25 0.03 . 2 . . . . . . . . 7086 1 505 . 1 1 43 43 ASP HB3 H 1 3.15 0.03 . 2 . . . . . . . . 7086 1 506 . 1 1 43 43 ASP C C 13 172.9 0.3 . 1 . . . . . . . . 7086 1 507 . 1 1 44 44 ILE N N 15 114.7 0.3 . 1 . . . . . . . . 7086 1 508 . 1 1 44 44 ILE H H 1 8.32 0.03 . 1 . . . . . . . . 7086 1 509 . 1 1 44 44 ILE CA C 13 61.3 0.3 . 1 . . . . . . . . 7086 1 510 . 1 1 44 44 ILE HA H 1 4.55 0.03 . 1 . . . . . . . . 7086 1 511 . 1 1 44 44 ILE CB C 13 41.1 0.3 . 1 . . . . . . . . 7086 1 512 . 1 1 44 44 ILE HB H 1 1.73 0.03 . 1 . . . . . . . . 7086 1 513 . 1 1 44 44 ILE HG21 H 1 0.83 0.03 . 1 . . . . . . . . 7086 1 514 . 1 1 44 44 ILE HG22 H 1 0.83 0.03 . 1 . . . . . . . . 7086 1 515 . 1 1 44 44 ILE HG23 H 1 0.83 0.03 . 1 . . . . . . . . 7086 1 516 . 1 1 44 44 ILE CG2 C 13 16.8 0.3 . 1 . . . . . . . . 7086 1 517 . 1 1 44 44 ILE CG1 C 13 27.2 0.3 . 1 . . . . . . . . 7086 1 518 . 1 1 44 44 ILE HG12 H 1 1.62 0.03 . 1 . . . . . . . . 7086 1 519 . 1 1 44 44 ILE HG13 H 1 1.62 0.03 . 1 . . . . . . . . 7086 1 520 . 1 1 44 44 ILE HD11 H 1 0.81 0.03 . 1 . . . . . . . . 7086 1 521 . 1 1 44 44 ILE HD12 H 1 0.81 0.03 . 1 . . . . . . . . 7086 1 522 . 1 1 44 44 ILE HD13 H 1 0.81 0.03 . 1 . . . . . . . . 7086 1 523 . 1 1 44 44 ILE CD1 C 13 14.1 0.3 . 1 . . . . . . . . 7086 1 524 . 1 1 44 44 ILE C C 13 173.2 0.3 . 1 . . . . . . . . 7086 1 525 . 1 1 45 45 ASP N N 15 129.6 0.3 . 1 . . . . . . . . 7086 1 526 . 1 1 45 45 ASP H H 1 8.79 0.03 . 1 . . . . . . . . 7086 1 527 . 1 1 45 45 ASP CA C 13 53.4 0.3 . 1 . . . . . . . . 7086 1 528 . 1 1 45 45 ASP HA H 1 5.29 0.03 . 1 . . . . . . . . 7086 1 529 . 1 1 45 45 ASP CB C 13 43.4 0.3 . 1 . . . . . . . . 7086 1 530 . 1 1 45 45 ASP HB2 H 1 2.62 0.03 . 2 . . . . . . . . 7086 1 531 . 1 1 45 45 ASP HB3 H 1 2.45 0.03 . 2 . . . . . . . . 7086 1 532 . 1 1 45 45 ASP C C 13 174.1 0.3 . 1 . . . . . . . . 7086 1 533 . 1 1 46 46 ILE N N 15 122.1 0.3 . 1 . . . . . . . . 7086 1 534 . 1 1 46 46 ILE H H 1 9.08 0.03 . 1 . . . . . . . . 7086 1 535 . 1 1 46 46 ILE CA C 13 58.4 0.3 . 1 . . . . . . . . 7086 1 536 . 1 1 46 46 ILE HA H 1 5.09 0.03 . 1 . . . . . . . . 7086 1 537 . 1 1 46 46 ILE CB C 13 40.2 0.3 . 1 . . . . . . . . 7086 1 538 . 1 1 46 46 ILE HB H 1 1.82 0.03 . 1 . . . . . . . . 7086 1 539 . 1 1 46 46 ILE HG21 H 1 0.93 0.03 . 1 . . . . . . . . 7086 1 540 . 1 1 46 46 ILE HG22 H 1 0.93 0.03 . 1 . . . . . . . . 7086 1 541 . 1 1 46 46 ILE HG23 H 1 0.93 0.03 . 1 . . . . . . . . 7086 1 542 . 1 1 46 46 ILE CG2 C 13 18.0 0.3 . 1 . . . . . . . . 7086 1 543 . 1 1 46 46 ILE CG1 C 13 27.5 0.3 . 1 . . . . . . . . 7086 1 544 . 1 1 46 46 ILE HG12 H 1 1.30 0.03 . 2 . . . . . . . . 7086 1 545 . 1 1 46 46 ILE HG13 H 1 1.25 0.03 . 2 . . . . . . . . 7086 1 546 . 1 1 46 46 ILE HD11 H 1 0.64 0.03 . 1 . . . . . . . . 7086 1 547 . 1 1 46 46 ILE HD12 H 1 0.64 0.03 . 1 . . . . . . . . 7086 1 548 . 1 1 46 46 ILE HD13 H 1 0.64 0.03 . 1 . . . . . . . . 7086 1 549 . 1 1 46 46 ILE CD1 C 13 12.7 0.3 . 1 . . . . . . . . 7086 1 550 . 1 1 46 46 ILE C C 13 174.9 0.3 . 1 . . . . . . . . 7086 1 551 . 1 1 47 47 GLN N N 15 127.6 0.3 . 1 . . . . . . . . 7086 1 552 . 1 1 47 47 GLN H H 1 9.27 0.03 . 1 . . . . . . . . 7086 1 553 . 1 1 47 47 GLN CA C 13 53.7 0.3 . 1 . . . . . . . . 7086 1 554 . 1 1 47 47 GLN HA H 1 5.61 0.03 . 1 . . . . . . . . 7086 1 555 . 1 1 47 47 GLN CB C 13 31.7 0.3 . 1 . . . . . . . . 7086 1 556 . 1 1 47 47 GLN HB2 H 1 1.94 0.03 . 1 . . . . . . . . 7086 1 557 . 1 1 47 47 GLN HB3 H 1 1.94 0.03 . 1 . . . . . . . . 7086 1 558 . 1 1 47 47 GLN CG C 13 35.1 0.3 . 1 . . . . . . . . 7086 1 559 . 1 1 47 47 GLN HG2 H 1 2.66 0.03 . 2 . . . . . . . . 7086 1 560 . 1 1 47 47 GLN HG3 H 1 2.48 0.03 . 2 . . . . . . . . 7086 1 561 . 1 1 47 47 GLN NE2 N 15 107.7 0.3 . 1 . . . . . . . . 7086 1 562 . 1 1 47 47 GLN HE21 H 1 7.54 0.03 . 2 . . . . . . . . 7086 1 563 . 1 1 47 47 GLN HE22 H 1 6.75 0.03 . 2 . . . . . . . . 7086 1 564 . 1 1 47 47 GLN C C 13 173.7 0.3 . 1 . . . . . . . . 7086 1 565 . 1 1 48 48 THR N N 15 119.5 0.3 . 1 . . . . . . . . 7086 1 566 . 1 1 48 48 THR H H 1 8.60 0.03 . 1 . . . . . . . . 7086 1 567 . 1 1 48 48 THR CA C 13 58.4 0.3 . 1 . . . . . . . . 7086 1 568 . 1 1 48 48 THR HA H 1 5.11 0.03 . 1 . . . . . . . . 7086 1 569 . 1 1 48 48 THR CB C 13 69.6 0.3 . 1 . . . . . . . . 7086 1 570 . 1 1 48 48 THR HB H 1 4.14 0.03 . 1 . . . . . . . . 7086 1 571 . 1 1 48 48 THR HG21 H 1 1.09 0.03 . 1 . . . . . . . . 7086 1 572 . 1 1 48 48 THR HG22 H 1 1.09 0.03 . 1 . . . . . . . . 7086 1 573 . 1 1 48 48 THR HG23 H 1 1.09 0.03 . 1 . . . . . . . . 7086 1 574 . 1 1 48 48 THR CG2 C 13 18.1 0.3 . 1 . . . . . . . . 7086 1 575 . 1 1 48 48 THR C C 13 174.5 0.3 . 1 . . . . . . . . 7086 1 576 . 1 1 49 49 ASP N N 15 124.6 0.3 . 1 . . . . . . . . 7086 1 577 . 1 1 49 49 ASP H H 1 9.41 0.03 . 1 . . . . . . . . 7086 1 578 . 1 1 49 49 ASP CA C 13 52.1 0.3 . 1 . . . . . . . . 7086 1 579 . 1 1 49 49 ASP HA H 1 5.28 0.03 . 1 . . . . . . . . 7086 1 580 . 1 1 49 49 ASP CB C 13 42.2 0.3 . 1 . . . . . . . . 7086 1 581 . 1 1 49 49 ASP HB2 H 1 3.40 0.03 . 2 . . . . . . . . 7086 1 582 . 1 1 49 49 ASP HB3 H 1 2.86 0.03 . 2 . . . . . . . . 7086 1 583 . 1 1 49 49 ASP C C 13 175.7 0.3 . 1 . . . . . . . . 7086 1 584 . 1 1 50 50 GLU N N 15 121.2 0.3 . 1 . . . . . . . . 7086 1 585 . 1 1 50 50 GLU H H 1 7.80 0.03 . 1 . . . . . . . . 7086 1 586 . 1 1 50 50 GLU CA C 13 61.3 0.3 . 1 . . . . . . . . 7086 1 587 . 1 1 50 50 GLU HA H 1 3.47 0.03 . 1 . . . . . . . . 7086 1 588 . 1 1 50 50 GLU CB C 13 29.5 0.3 . 1 . . . . . . . . 7086 1 589 . 1 1 50 50 GLU HB2 H 1 2.06 0.03 . 2 . . . . . . . . 7086 1 590 . 1 1 50 50 GLU HB3 H 1 1.89 0.03 . 2 . . . . . . . . 7086 1 591 . 1 1 50 50 GLU CG C 13 34.9 0.3 . 1 . . . . . . . . 7086 1 592 . 1 1 50 50 GLU HG2 H 1 1.82 0.03 . 1 . . . . . . . . 7086 1 593 . 1 1 50 50 GLU HG3 H 1 1.82 0.03 . 1 . . . . . . . . 7086 1 594 . 1 1 50 50 GLU C C 13 176.6 0.3 . 1 . . . . . . . . 7086 1 595 . 1 1 51 51 GLU N N 15 114.9 0.3 . 1 . . . . . . . . 7086 1 596 . 1 1 51 51 GLU H H 1 8.59 0.03 . 1 . . . . . . . . 7086 1 597 . 1 1 51 51 GLU CA C 13 59.3 0.3 . 1 . . . . . . . . 7086 1 598 . 1 1 51 51 GLU HA H 1 4.09 0.03 . 1 . . . . . . . . 7086 1 599 . 1 1 51 51 GLU CB C 13 29.9 0.3 . 1 . . . . . . . . 7086 1 600 . 1 1 51 51 GLU HB2 H 1 2.05 0.03 . 2 . . . . . . . . 7086 1 601 . 1 1 51 51 GLU HB3 H 1 2.00 0.03 . 2 . . . . . . . . 7086 1 602 . 1 1 51 51 GLU CG C 13 37.0 0.3 . 1 . . . . . . . . 7086 1 603 . 1 1 51 51 GLU HG2 H 1 2.38 0.03 . 2 . . . . . . . . 7086 1 604 . 1 1 51 51 GLU HG3 H 1 2.31 0.03 . 2 . . . . . . . . 7086 1 605 . 1 1 51 51 GLU C C 13 180.3 0.3 . 1 . . . . . . . . 7086 1 606 . 1 1 52 52 GLY N N 15 108.7 0.3 . 1 . . . . . . . . 7086 1 607 . 1 1 52 52 GLY H H 1 8.70 0.03 . 1 . . . . . . . . 7086 1 608 . 1 1 52 52 GLY CA C 13 47.5 0.3 . 1 . . . . . . . . 7086 1 609 . 1 1 52 52 GLY HA2 H 1 4.51 0.03 . 2 . . . . . . . . 7086 1 610 . 1 1 52 52 GLY HA3 H 1 3.77 0.03 . 2 . . . . . . . . 7086 1 611 . 1 1 52 52 GLY C C 13 175.6 0.3 . 1 . . . . . . . . 7086 1 612 . 1 1 53 53 ALA N N 15 124.2 0.3 . 1 . . . . . . . . 7086 1 613 . 1 1 53 53 ALA H H 1 7.97 0.03 . 1 . . . . . . . . 7086 1 614 . 1 1 53 53 ALA CA C 13 55.5 0.3 . 1 . . . . . . . . 7086 1 615 . 1 1 53 53 ALA HA H 1 3.65 0.03 . 1 . . . . . . . . 7086 1 616 . 1 1 53 53 ALA HB1 H 1 1.03 0.03 . 1 . . . . . . . . 7086 1 617 . 1 1 53 53 ALA HB2 H 1 1.03 0.03 . 1 . . . . . . . . 7086 1 618 . 1 1 53 53 ALA HB3 H 1 1.03 0.03 . 1 . . . . . . . . 7086 1 619 . 1 1 53 53 ALA CB C 13 17.7 0.3 . 1 . . . . . . . . 7086 1 620 . 1 1 53 53 ALA C C 13 178.2 0.3 . 1 . . . . . . . . 7086 1 621 . 1 1 54 54 TYR N N 15 113.4 0.3 . 1 . . . . . . . . 7086 1 622 . 1 1 54 54 TYR H H 1 6.89 0.03 . 1 . . . . . . . . 7086 1 623 . 1 1 54 54 TYR CA C 13 61.2 0.3 . 1 . . . . . . . . 7086 1 624 . 1 1 54 54 TYR HA H 1 4.06 0.03 . 1 . . . . . . . . 7086 1 625 . 1 1 54 54 TYR CB C 13 38.0 0.3 . 1 . . . . . . . . 7086 1 626 . 1 1 54 54 TYR HB2 H 1 3.25 0.03 . 2 . . . . . . . . 7086 1 627 . 1 1 54 54 TYR HB3 H 1 2.88 0.03 . 2 . . . . . . . . 7086 1 628 . 1 1 54 54 TYR HD1 H 1 7.42 0.03 . 1 . . . . . . . . 7086 1 629 . 1 1 54 54 TYR HD2 H 1 7.42 0.03 . 1 . . . . . . . . 7086 1 630 . 1 1 54 54 TYR HE1 H 1 6.66 0.03 . 1 . . . . . . . . 7086 1 631 . 1 1 54 54 TYR HE2 H 1 6.66 0.03 . 1 . . . . . . . . 7086 1 632 . 1 1 54 54 TYR CD1 C 13 133.4 0.3 . 1 . . . . . . . . 7086 1 633 . 1 1 54 54 TYR CE1 C 13 118.7 0.3 . 1 . . . . . . . . 7086 1 634 . 1 1 54 54 TYR C C 13 179.3 0.3 . 1 . . . . . . . . 7086 1 635 . 1 1 55 55 GLU N N 15 122.5 0.3 . 1 . . . . . . . . 7086 1 636 . 1 1 55 55 GLU H H 1 8.25 0.03 . 1 . . . . . . . . 7086 1 637 . 1 1 55 55 GLU CA C 13 58.6 0.3 . 1 . . . . . . . . 7086 1 638 . 1 1 55 55 GLU HA H 1 4.49 0.03 . 1 . . . . . . . . 7086 1 639 . 1 1 55 55 GLU CB C 13 30.5 0.3 . 1 . . . . . . . . 7086 1 640 . 1 1 55 55 GLU HB2 H 1 2.25 0.03 . 2 . . . . . . . . 7086 1 641 . 1 1 55 55 GLU HB3 H 1 1.95 0.03 . 2 . . . . . . . . 7086 1 642 . 1 1 55 55 GLU CG C 13 36.1 0.3 . 1 . . . . . . . . 7086 1 643 . 1 1 55 55 GLU HG2 H 1 2.33 0.03 . 1 . . . . . . . . 7086 1 644 . 1 1 55 55 GLU HG3 H 1 2.33 0.03 . 1 . . . . . . . . 7086 1 645 . 1 1 55 55 GLU C C 13 178.8 0.3 . 1 . . . . . . . . 7086 1 646 . 1 1 56 56 ILE N N 15 120.7 0.3 . 1 . . . . . . . . 7086 1 647 . 1 1 56 56 ILE H H 1 9.04 0.03 . 1 . . . . . . . . 7086 1 648 . 1 1 56 56 ILE CA C 13 66.5 0.3 . 1 . . . . . . . . 7086 1 649 . 1 1 56 56 ILE HA H 1 3.55 0.03 . 1 . . . . . . . . 7086 1 650 . 1 1 56 56 ILE CB C 13 37.5 0.3 . 1 . . . . . . . . 7086 1 651 . 1 1 56 56 ILE HB H 1 1.91 0.03 . 1 . . . . . . . . 7086 1 652 . 1 1 56 56 ILE HG21 H 1 0.74 0.03 . 1 . . . . . . . . 7086 1 653 . 1 1 56 56 ILE HG22 H 1 0.74 0.03 . 1 . . . . . . . . 7086 1 654 . 1 1 56 56 ILE HG23 H 1 0.74 0.03 . 1 . . . . . . . . 7086 1 655 . 1 1 56 56 ILE CG2 C 13 17.8 0.3 . 1 . . . . . . . . 7086 1 656 . 1 1 56 56 ILE CG1 C 13 32.2 0.3 . 1 . . . . . . . . 7086 1 657 . 1 1 56 56 ILE HG12 H 1 2.06 0.03 . 1 . . . . . . . . 7086 1 658 . 1 1 56 56 ILE HG13 H 1 2.06 0.03 . 1 . . . . . . . . 7086 1 659 . 1 1 56 56 ILE HD11 H 1 0.60 0.03 . 1 . . . . . . . . 7086 1 660 . 1 1 56 56 ILE HD12 H 1 0.60 0.03 . 1 . . . . . . . . 7086 1 661 . 1 1 56 56 ILE HD13 H 1 0.60 0.03 . 1 . . . . . . . . 7086 1 662 . 1 1 56 56 ILE CD1 C 13 13.5 0.3 . 1 . . . . . . . . 7086 1 663 . 1 1 56 56 ILE C C 13 177.3 0.3 . 1 . . . . . . . . 7086 1 664 . 1 1 57 57 GLU N N 15 119.0 0.3 . 1 . . . . . . . . 7086 1 665 . 1 1 57 57 GLU H H 1 7.42 0.03 . 1 . . . . . . . . 7086 1 666 . 1 1 57 57 GLU CA C 13 59.9 0.3 . 1 . . . . . . . . 7086 1 667 . 1 1 57 57 GLU HA H 1 3.61 0.03 . 1 . . . . . . . . 7086 1 668 . 1 1 57 57 GLU CB C 13 30.2 0.3 . 1 . . . . . . . . 7086 1 669 . 1 1 57 57 GLU HB2 H 1 2.21 0.03 . 2 . . . . . . . . 7086 1 670 . 1 1 57 57 GLU HB3 H 1 2.09 0.03 . 2 . . . . . . . . 7086 1 671 . 1 1 57 57 GLU CG C 13 37.3 0.3 . 1 . . . . . . . . 7086 1 672 . 1 1 57 57 GLU HG2 H 1 2.23 0.03 . 1 . . . . . . . . 7086 1 673 . 1 1 57 57 GLU HG3 H 1 2.23 0.03 . 1 . . . . . . . . 7086 1 674 . 1 1 57 57 GLU C C 13 176.7 0.3 . 1 . . . . . . . . 7086 1 675 . 1 1 58 58 ARG N N 15 117.0 0.3 . 1 . . . . . . . . 7086 1 676 . 1 1 58 58 ARG H H 1 7.36 0.03 . 1 . . . . . . . . 7086 1 677 . 1 1 58 58 ARG CA C 13 59.5 0.3 . 1 . . . . . . . . 7086 1 678 . 1 1 58 58 ARG HA H 1 4.07 0.03 . 1 . . . . . . . . 7086 1 679 . 1 1 58 58 ARG CB C 13 30.6 0.3 . 1 . . . . . . . . 7086 1 680 . 1 1 58 58 ARG HB2 H 1 2.18 0.03 . 2 . . . . . . . . 7086 1 681 . 1 1 58 58 ARG HB3 H 1 1.99 0.03 . 2 . . . . . . . . 7086 1 682 . 1 1 58 58 ARG CG C 13 27.3 0.3 . 1 . . . . . . . . 7086 1 683 . 1 1 58 58 ARG HG2 H 1 1.76 0.03 . 2 . . . . . . . . 7086 1 684 . 1 1 58 58 ARG HG3 H 1 1.53 0.03 . 2 . . . . . . . . 7086 1 685 . 1 1 58 58 ARG CD C 13 43.1 0.3 . 1 . . . . . . . . 7086 1 686 . 1 1 58 58 ARG HD2 H 1 3.38 0.03 . 2 . . . . . . . . 7086 1 687 . 1 1 58 58 ARG HD3 H 1 3.19 0.03 . 2 . . . . . . . . 7086 1 688 . 1 1 58 58 ARG C C 13 180.2 0.3 . 1 . . . . . . . . 7086 1 689 . 1 1 59 59 ILE N N 15 121.7 0.3 . 1 . . . . . . . . 7086 1 690 . 1 1 59 59 ILE H H 1 8.77 0.03 . 1 . . . . . . . . 7086 1 691 . 1 1 59 59 ILE CA C 13 64.5 0.3 . 1 . . . . . . . . 7086 1 692 . 1 1 59 59 ILE HA H 1 3.47 0.03 . 1 . . . . . . . . 7086 1 693 . 1 1 59 59 ILE CB C 13 39.0 0.3 . 1 . . . . . . . . 7086 1 694 . 1 1 59 59 ILE HB H 1 1.55 0.03 . 1 . . . . . . . . 7086 1 695 . 1 1 59 59 ILE HG21 H 1 0.14 0.03 . 1 . . . . . . . . 7086 1 696 . 1 1 59 59 ILE HG22 H 1 0.14 0.03 . 1 . . . . . . . . 7086 1 697 . 1 1 59 59 ILE HG23 H 1 0.14 0.03 . 1 . . . . . . . . 7086 1 698 . 1 1 59 59 ILE CG2 C 13 18.5 0.3 . 1 . . . . . . . . 7086 1 699 . 1 1 59 59 ILE CG1 C 13 30.1 0.3 . 1 . . . . . . . . 7086 1 700 . 1 1 59 59 ILE HG12 H 1 1.72 0.03 . 2 . . . . . . . . 7086 1 701 . 1 1 59 59 ILE HG13 H 1 0.86 0.03 . 2 . . . . . . . . 7086 1 702 . 1 1 59 59 ILE HD11 H 1 0.62 0.03 . 1 . . . . . . . . 7086 1 703 . 1 1 59 59 ILE HD12 H 1 0.62 0.03 . 1 . . . . . . . . 7086 1 704 . 1 1 59 59 ILE HD13 H 1 0.62 0.03 . 1 . . . . . . . . 7086 1 705 . 1 1 59 59 ILE CD1 C 13 15.2 0.3 . 1 . . . . . . . . 7086 1 706 . 1 1 59 59 ILE C C 13 177.4 0.3 . 1 . . . . . . . . 7086 1 707 . 1 1 60 60 PHE N N 15 117.2 0.3 . 1 . . . . . . . . 7086 1 708 . 1 1 60 60 PHE H H 1 8.29 0.03 . 1 . . . . . . . . 7086 1 709 . 1 1 60 60 PHE CA C 13 57.2 0.3 . 1 . . . . . . . . 7086 1 710 . 1 1 60 60 PHE HA H 1 4.73 0.03 . 1 . . . . . . . . 7086 1 711 . 1 1 60 60 PHE CB C 13 38.8 0.3 . 1 . . . . . . . . 7086 1 712 . 1 1 60 60 PHE HB2 H 1 3.69 0.03 . 2 . . . . . . . . 7086 1 713 . 1 1 60 60 PHE HB3 H 1 2.77 0.03 . 2 . . . . . . . . 7086 1 714 . 1 1 60 60 PHE HD1 H 1 7.49 0.03 . 1 . . . . . . . . 7086 1 715 . 1 1 60 60 PHE HD2 H 1 7.49 0.03 . 1 . . . . . . . . 7086 1 716 . 1 1 60 60 PHE HE1 H 1 6.89 0.03 . 1 . . . . . . . . 7086 1 717 . 1 1 60 60 PHE HE2 H 1 6.89 0.03 . 1 . . . . . . . . 7086 1 718 . 1 1 60 60 PHE CD1 C 13 132.4 0.3 . 1 . . . . . . . . 7086 1 719 . 1 1 60 60 PHE CE1 C 13 130.2 0.3 . 1 . . . . . . . . 7086 1 720 . 1 1 60 60 PHE C C 13 176.4 0.3 . 1 . . . . . . . . 7086 1 721 . 1 1 61 61 SER N N 15 115.3 0.3 . 1 . . . . . . . . 7086 1 722 . 1 1 61 61 SER H H 1 6.88 0.03 . 1 . . . . . . . . 7086 1 723 . 1 1 61 61 SER CA C 13 62.6 0.3 . 1 . . . . . . . . 7086 1 724 . 1 1 61 61 SER HA H 1 4.32 0.03 . 1 . . . . . . . . 7086 1 725 . 1 1 61 61 SER CB C 13 63.3 0.3 . 1 . . . . . . . . 7086 1 726 . 1 1 61 61 SER HB2 H 1 4.20 0.03 . 2 . . . . . . . . 7086 1 727 . 1 1 61 61 SER HB3 H 1 4.05 0.03 . 2 . . . . . . . . 7086 1 728 . 1 1 61 61 SER C C 13 176.6 0.3 . 1 . . . . . . . . 7086 1 729 . 1 1 62 62 GLU N N 15 122.2 0.3 . 1 . . . . . . . . 7086 1 730 . 1 1 62 62 GLU H H 1 10.00 0.03 . 1 . . . . . . . . 7086 1 731 . 1 1 62 62 GLU CA C 13 57.7 0.3 . 1 . . . . . . . . 7086 1 732 . 1 1 62 62 GLU HA H 1 4.30 0.03 . 1 . . . . . . . . 7086 1 733 . 1 1 62 62 GLU CB C 13 28.0 0.3 . 1 . . . . . . . . 7086 1 734 . 1 1 62 62 GLU HB2 H 1 1.77 0.03 . 2 . . . . . . . . 7086 1 735 . 1 1 62 62 GLU HB3 H 1 1.68 0.03 . 2 . . . . . . . . 7086 1 736 . 1 1 62 62 GLU CG C 13 35.1 0.3 . 1 . . . . . . . . 7086 1 737 . 1 1 62 62 GLU HG2 H 1 1.60 0.03 . 2 . . . . . . . . 7086 1 738 . 1 1 62 62 GLU HG3 H 1 0.98 0.03 . 2 . . . . . . . . 7086 1 739 . 1 1 62 62 GLU C C 13 176.7 0.3 . 1 . . . . . . . . 7086 1 740 . 1 1 63 63 PHE N N 15 118.9 0.3 . 1 . . . . . . . . 7086 1 741 . 1 1 63 63 PHE H H 1 8.56 0.03 . 1 . . . . . . . . 7086 1 742 . 1 1 63 63 PHE CA C 13 56.4 0.3 . 1 . . . . . . . . 7086 1 743 . 1 1 63 63 PHE HA H 1 5.08 0.03 . 1 . . . . . . . . 7086 1 744 . 1 1 63 63 PHE CB C 13 40.8 0.3 . 1 . . . . . . . . 7086 1 745 . 1 1 63 63 PHE HB2 H 1 3.83 0.03 . 2 . . . . . . . . 7086 1 746 . 1 1 63 63 PHE HB3 H 1 2.78 0.03 . 2 . . . . . . . . 7086 1 747 . 1 1 63 63 PHE HD1 H 1 7.47 0.03 . 1 . . . . . . . . 7086 1 748 . 1 1 63 63 PHE HD2 H 1 7.47 0.03 . 1 . . . . . . . . 7086 1 749 . 1 1 63 63 PHE HE1 H 1 6.89 0.03 . 1 . . . . . . . . 7086 1 750 . 1 1 63 63 PHE HE2 H 1 6.89 0.03 . 1 . . . . . . . . 7086 1 751 . 1 1 63 63 PHE CD1 C 13 131.7 0.3 . 1 . . . . . . . . 7086 1 752 . 1 1 63 63 PHE C C 13 175.5 0.3 . 1 . . . . . . . . 7086 1 753 . 1 1 64 64 VAL N N 15 121.0 0.3 . 1 . . . . . . . . 7086 1 754 . 1 1 64 64 VAL H H 1 7.21 0.03 . 1 . . . . . . . . 7086 1 755 . 1 1 64 64 VAL CA C 13 64.7 0.3 . 1 . . . . . . . . 7086 1 756 . 1 1 64 64 VAL HA H 1 3.87 0.03 . 1 . . . . . . . . 7086 1 757 . 1 1 64 64 VAL CB C 13 32.7 0.3 . 1 . . . . . . . . 7086 1 758 . 1 1 64 64 VAL HB H 1 2.08 0.03 . 1 . . . . . . . . 7086 1 759 . 1 1 64 64 VAL HG11 H 1 1.18 0.03 . 2 . . . . . . . . 7086 1 760 . 1 1 64 64 VAL HG12 H 1 1.18 0.03 . 2 . . . . . . . . 7086 1 761 . 1 1 64 64 VAL HG13 H 1 1.18 0.03 . 2 . . . . . . . . 7086 1 762 . 1 1 64 64 VAL HG21 H 1 0.92 0.03 . 2 . . . . . . . . 7086 1 763 . 1 1 64 64 VAL HG22 H 1 0.92 0.03 . 2 . . . . . . . . 7086 1 764 . 1 1 64 64 VAL HG23 H 1 0.92 0.03 . 2 . . . . . . . . 7086 1 765 . 1 1 64 64 VAL CG1 C 13 25.2 0.3 . 1 . . . . . . . . 7086 1 766 . 1 1 64 64 VAL CG2 C 13 21.2 0.3 . 1 . . . . . . . . 7086 1 767 . 1 1 64 64 VAL C C 13 175.9 0.3 . 1 . . . . . . . . 7086 1 768 . 1 1 65 65 SER N N 15 125.5 0.3 . 1 . . . . . . . . 7086 1 769 . 1 1 65 65 SER H H 1 9.33 0.03 . 1 . . . . . . . . 7086 1 770 . 1 1 65 65 SER CA C 13 58.3 0.3 . 1 . . . . . . . . 7086 1 771 . 1 1 65 65 SER HA H 1 4.70 0.03 . 1 . . . . . . . . 7086 1 772 . 1 1 65 65 SER CB C 13 63.3 0.3 . 1 . . . . . . . . 7086 1 773 . 1 1 65 65 SER HB2 H 1 3.87 0.03 . 2 . . . . . . . . 7086 1 774 . 1 1 65 65 SER HB3 H 1 3.58 0.03 . 2 . . . . . . . . 7086 1 775 . 1 1 65 65 SER C C 13 176.2 0.3 . 1 . . . . . . . . 7086 1 776 . 1 1 66 66 LYS N N 15 123.2 0.3 . 1 . . . . . . . . 7086 1 777 . 1 1 66 66 LYS H H 1 8.06 0.03 . 1 . . . . . . . . 7086 1 778 . 1 1 66 66 LYS CA C 13 56.0 0.3 . 1 . . . . . . . . 7086 1 779 . 1 1 66 66 LYS HA H 1 4.62 0.03 . 1 . . . . . . . . 7086 1 780 . 1 1 66 66 LYS CB C 13 35.2 0.3 . 1 . . . . . . . . 7086 1 781 . 1 1 66 66 LYS HB2 H 1 1.77 0.03 . 2 . . . . . . . . 7086 1 782 . 1 1 66 66 LYS HB3 H 1 1.58 0.03 . 2 . . . . . . . . 7086 1 783 . 1 1 66 66 LYS CG C 13 25.0 0.3 . 1 . . . . . . . . 7086 1 784 . 1 1 66 66 LYS HG2 H 1 1.44 0.03 . 2 . . . . . . . . 7086 1 785 . 1 1 66 66 LYS HG3 H 1 1.34 0.03 . 2 . . . . . . . . 7086 1 786 . 1 1 66 66 LYS CD C 13 29.5 0.3 . 1 . . . . . . . . 7086 1 787 . 1 1 66 66 LYS HD2 H 1 1.72 0.03 . 2 . . . . . . . . 7086 1 788 . 1 1 66 66 LYS HD3 H 1 1.50 0.03 . 2 . . . . . . . . 7086 1 789 . 1 1 66 66 LYS CE C 13 42.1 0.3 . 1 . . . . . . . . 7086 1 790 . 1 1 66 66 LYS HE2 H 1 3.02 0.03 . 1 . . . . . . . . 7086 1 791 . 1 1 66 66 LYS HE3 H 1 3.02 0.03 . 1 . . . . . . . . 7086 1 792 . 1 1 66 66 LYS C C 13 174.6 0.3 . 1 . . . . . . . . 7086 1 793 . 1 1 67 67 LYS N N 15 124.5 0.3 . 1 . . . . . . . . 7086 1 794 . 1 1 67 67 LYS H H 1 8.39 0.03 . 1 . . . . . . . . 7086 1 795 . 1 1 67 67 LYS CA C 13 56.4 0.3 . 1 . . . . . . . . 7086 1 796 . 1 1 67 67 LYS HA H 1 4.09 0.03 . 1 . . . . . . . . 7086 1 797 . 1 1 67 67 LYS CB C 13 32.6 0.3 . 1 . . . . . . . . 7086 1 798 . 1 1 67 67 LYS HB2 H 1 1.92 0.03 . 2 . . . . . . . . 7086 1 799 . 1 1 67 67 LYS HB3 H 1 1.76 0.03 . 2 . . . . . . . . 7086 1 800 . 1 1 67 67 LYS CG C 13 25.1 0.3 . 1 . . . . . . . . 7086 1 801 . 1 1 67 67 LYS HG2 H 1 1.65 0.03 . 2 . . . . . . . . 7086 1 802 . 1 1 67 67 LYS HG3 H 1 1.49 0.03 . 2 . . . . . . . . 7086 1 803 . 1 1 67 67 LYS CD C 13 29.1 0.3 . 1 . . . . . . . . 7086 1 804 . 1 1 67 67 LYS HD2 H 1 1.80 0.03 . 2 . . . . . . . . 7086 1 805 . 1 1 67 67 LYS HD3 H 1 1.75 0.03 . 2 . . . . . . . . 7086 1 806 . 1 1 67 67 LYS CE C 13 42.2 0.3 . 1 . . . . . . . . 7086 1 807 . 1 1 67 67 LYS HE2 H 1 3.12 0.03 . 1 . . . . . . . . 7086 1 808 . 1 1 67 67 LYS HE3 H 1 3.12 0.03 . 1 . . . . . . . . 7086 1 809 . 1 1 67 67 LYS C C 13 176.3 0.3 . 1 . . . . . . . . 7086 1 810 . 1 1 68 68 VAL N N 15 124.4 0.3 . 1 . . . . . . . . 7086 1 811 . 1 1 68 68 VAL H H 1 9.18 0.03 . 1 . . . . . . . . 7086 1 812 . 1 1 68 68 VAL CA C 13 62.4 0.3 . 1 . . . . . . . . 7086 1 813 . 1 1 68 68 VAL HA H 1 4.14 0.03 . 1 . . . . . . . . 7086 1 814 . 1 1 68 68 VAL CB C 13 30.8 0.3 . 1 . . . . . . . . 7086 1 815 . 1 1 68 68 VAL HB H 1 1.61 0.03 . 1 . . . . . . . . 7086 1 816 . 1 1 68 68 VAL HG11 H 1 0.62 0.03 . 2 . . . . . . . . 7086 1 817 . 1 1 68 68 VAL HG12 H 1 0.62 0.03 . 2 . . . . . . . . 7086 1 818 . 1 1 68 68 VAL HG13 H 1 0.62 0.03 . 2 . . . . . . . . 7086 1 819 . 1 1 68 68 VAL HG21 H 1 0.03 0.03 . 2 . . . . . . . . 7086 1 820 . 1 1 68 68 VAL HG22 H 1 0.03 0.03 . 2 . . . . . . . . 7086 1 821 . 1 1 68 68 VAL HG23 H 1 0.03 0.03 . 2 . . . . . . . . 7086 1 822 . 1 1 68 68 VAL CG1 C 13 22.5 0.3 . 1 . . . . . . . . 7086 1 823 . 1 1 68 68 VAL CG2 C 13 22.2 0.3 . 1 . . . . . . . . 7086 1 824 . 1 1 68 68 VAL C C 13 176.8 0.3 . 1 . . . . . . . . 7086 1 825 . 1 1 69 69 ARG N N 15 125.3 0.3 . 1 . . . . . . . . 7086 1 826 . 1 1 69 69 ARG H H 1 8.58 0.03 . 1 . . . . . . . . 7086 1 827 . 1 1 69 69 ARG CA C 13 53.9 0.3 . 1 . . . . . . . . 7086 1 828 . 1 1 69 69 ARG HA H 1 5.01 0.03 . 1 . . . . . . . . 7086 1 829 . 1 1 69 69 ARG CB C 13 33.4 0.3 . 1 . . . . . . . . 7086 1 830 . 1 1 69 69 ARG HB2 H 1 1.97 0.03 . 1 . . . . . . . . 7086 1 831 . 1 1 69 69 ARG HB3 H 1 1.97 0.03 . 1 . . . . . . . . 7086 1 832 . 1 1 69 69 ARG CG C 13 26.4 0.3 . 1 . . . . . . . . 7086 1 833 . 1 1 69 69 ARG HG2 H 1 1.74 0.03 . 2 . . . . . . . . 7086 1 834 . 1 1 69 69 ARG HG3 H 1 1.69 0.03 . 2 . . . . . . . . 7086 1 835 . 1 1 69 69 ARG CD C 13 43.4 0.3 . 1 . . . . . . . . 7086 1 836 . 1 1 69 69 ARG HD2 H 1 3.39 0.03 . 1 . . . . . . . . 7086 1 837 . 1 1 69 69 ARG HD3 H 1 3.39 0.03 . 1 . . . . . . . . 7086 1 838 . 1 1 69 69 ARG C C 13 175.0 0.3 . 1 . . . . . . . . 7086 1 839 . 1 1 70 70 PHE N N 15 124.7 0.3 . 1 . . . . . . . . 7086 1 840 . 1 1 70 70 PHE H H 1 9.11 0.03 . 1 . . . . . . . . 7086 1 841 . 1 1 70 70 PHE CA C 13 58.8 0.3 . 1 . . . . . . . . 7086 1 842 . 1 1 70 70 PHE HA H 1 4.46 0.03 . 1 . . . . . . . . 7086 1 843 . 1 1 70 70 PHE CB C 13 38.6 0.3 . 1 . . . . . . . . 7086 1 844 . 1 1 70 70 PHE HB2 H 1 2.88 0.03 . 2 . . . . . . . . 7086 1 845 . 1 1 70 70 PHE HB3 H 1 2.82 0.03 . 2 . . . . . . . . 7086 1 846 . 1 1 70 70 PHE HD1 H 1 6.41 0.03 . 1 . . . . . . . . 7086 1 847 . 1 1 70 70 PHE HD2 H 1 6.41 0.03 . 1 . . . . . . . . 7086 1 848 . 1 1 70 70 PHE HE1 H 1 7.12 0.03 . 1 . . . . . . . . 7086 1 849 . 1 1 70 70 PHE HE2 H 1 7.12 0.03 . 1 . . . . . . . . 7086 1 850 . 1 1 70 70 PHE CD1 C 13 131.6 0.3 . 1 . . . . . . . . 7086 1 851 . 1 1 70 70 PHE C C 13 175.1 0.3 . 1 . . . . . . . . 7086 1 852 . 1 1 71 71 SER N N 15 125.2 0.3 . 1 . . . . . . . . 7086 1 853 . 1 1 71 71 SER H H 1 8.63 0.03 . 1 . . . . . . . . 7086 1 854 . 1 1 71 71 SER CA C 13 56.6 0.3 . 1 . . . . . . . . 7086 1 855 . 1 1 71 71 SER HA H 1 4.55 0.03 . 1 . . . . . . . . 7086 1 856 . 1 1 71 71 SER CB C 13 64.8 0.3 . 1 . . . . . . . . 7086 1 857 . 1 1 71 71 SER HB2 H 1 3.70 0.03 . 2 . . . . . . . . 7086 1 858 . 1 1 71 71 SER HB3 H 1 3.62 0.03 . 2 . . . . . . . . 7086 1 859 . 1 1 72 72 SER CA C 13 56.4 0.3 . 1 . . . . . . . . 7086 1 860 . 1 1 72 72 SER HA H 1 5.04 0.03 . 1 . . . . . . . . 7086 1 861 . 1 1 72 72 SER CB C 13 65.7 0.3 . 1 . . . . . . . . 7086 1 862 . 1 1 72 72 SER HB2 H 1 3.69 0.03 . 2 . . . . . . . . 7086 1 863 . 1 1 72 72 SER HB3 H 1 3.64 0.03 . 2 . . . . . . . . 7086 1 864 . 1 1 72 72 SER C C 13 174.4 0.3 . 1 . . . . . . . . 7086 1 865 . 1 1 73 73 THR N N 15 117.0 0.3 . 1 . . . . . . . . 7086 1 866 . 1 1 73 73 THR H H 1 8.94 0.03 . 1 . . . . . . . . 7086 1 867 . 1 1 73 73 THR CA C 13 59.8 0.3 . 1 . . . . . . . . 7086 1 868 . 1 1 73 73 THR HA H 1 4.91 0.03 . 1 . . . . . . . . 7086 1 869 . 1 1 73 73 THR CB C 13 71.3 0.3 . 1 . . . . . . . . 7086 1 870 . 1 1 73 73 THR HB H 1 4.78 0.03 . 1 . . . . . . . . 7086 1 871 . 1 1 73 73 THR HG21 H 1 1.20 0.03 . 1 . . . . . . . . 7086 1 872 . 1 1 73 73 THR HG22 H 1 1.20 0.03 . 1 . . . . . . . . 7086 1 873 . 1 1 73 73 THR HG23 H 1 1.20 0.03 . 1 . . . . . . . . 7086 1 874 . 1 1 73 73 THR CG2 C 13 22.0 0.3 . 1 . . . . . . . . 7086 1 875 . 1 1 75 75 LYS CA C 13 56.4 0.3 . 1 . . . . . . . . 7086 1 876 . 1 1 75 75 LYS HA H 1 4.54 0.03 . 1 . . . . . . . . 7086 1 877 . 1 1 75 75 LYS CB C 13 36.0 0.3 . 1 . . . . . . . . 7086 1 878 . 1 1 75 75 LYS HB2 H 1 1.97 0.03 . 2 . . . . . . . . 7086 1 879 . 1 1 75 75 LYS HB3 H 1 1.82 0.03 . 2 . . . . . . . . 7086 1 880 . 1 1 75 75 LYS CG C 13 25.4 0.3 . 1 . . . . . . . . 7086 1 881 . 1 1 75 75 LYS HG2 H 1 1.49 0.03 . 2 . . . . . . . . 7086 1 882 . 1 1 75 75 LYS HG3 H 1 1.41 0.03 . 2 . . . . . . . . 7086 1 883 . 1 1 75 75 LYS HD2 H 1 1.70 0.03 . 1 . . . . . . . . 7086 1 884 . 1 1 75 75 LYS HD3 H 1 1.70 0.03 . 1 . . . . . . . . 7086 1 885 . 1 1 75 75 LYS CE C 13 42.1 0.3 . 1 . . . . . . . . 7086 1 886 . 1 1 75 75 LYS HE2 H 1 3.01 0.03 . 1 . . . . . . . . 7086 1 887 . 1 1 75 75 LYS HE3 H 1 3.01 0.03 . 1 . . . . . . . . 7086 1 888 . 1 1 75 75 LYS C C 13 176.2 0.3 . 1 . . . . . . . . 7086 1 889 . 1 1 76 76 ILE N N 15 116.8 0.3 . 1 . . . . . . . . 7086 1 890 . 1 1 76 76 ILE H H 1 7.69 0.03 . 1 . . . . . . . . 7086 1 891 . 1 1 76 76 ILE CA C 13 59.8 0.3 . 1 . . . . . . . . 7086 1 892 . 1 1 76 76 ILE HA H 1 5.68 0.03 . 1 . . . . . . . . 7086 1 893 . 1 1 76 76 ILE CB C 13 43.5 0.3 . 1 . . . . . . . . 7086 1 894 . 1 1 76 76 ILE HB H 1 1.72 0.03 . 1 . . . . . . . . 7086 1 895 . 1 1 76 76 ILE HG21 H 1 0.86 0.03 . 1 . . . . . . . . 7086 1 896 . 1 1 76 76 ILE HG22 H 1 0.86 0.03 . 1 . . . . . . . . 7086 1 897 . 1 1 76 76 ILE HG23 H 1 0.86 0.03 . 1 . . . . . . . . 7086 1 898 . 1 1 76 76 ILE CG2 C 13 18.3 0.3 . 1 . . . . . . . . 7086 1 899 . 1 1 76 76 ILE CG1 C 13 27.8 0.3 . 1 . . . . . . . . 7086 1 900 . 1 1 76 76 ILE HG12 H 1 1.48 0.03 . 2 . . . . . . . . 7086 1 901 . 1 1 76 76 ILE HG13 H 1 1.05 0.03 . 2 . . . . . . . . 7086 1 902 . 1 1 76 76 ILE HD11 H 1 0.82 0.03 . 1 . . . . . . . . 7086 1 903 . 1 1 76 76 ILE HD12 H 1 0.82 0.03 . 1 . . . . . . . . 7086 1 904 . 1 1 76 76 ILE HD13 H 1 0.82 0.03 . 1 . . . . . . . . 7086 1 905 . 1 1 76 76 ILE CD1 C 13 14.6 0.3 . 1 . . . . . . . . 7086 1 906 . 1 1 76 76 ILE C C 13 174.3 0.3 . 1 . . . . . . . . 7086 1 907 . 1 1 77 77 CYS N N 15 119.8 0.3 . 1 . . . . . . . . 7086 1 908 . 1 1 77 77 CYS H H 1 8.87 0.03 . 1 . . . . . . . . 7086 1 909 . 1 1 77 77 CYS CA C 13 55.5 0.3 . 1 . . . . . . . . 7086 1 910 . 1 1 77 77 CYS HA H 1 5.38 0.03 . 1 . . . . . . . . 7086 1 911 . 1 1 77 77 CYS CB C 13 31.9 0.3 . 1 . . . . . . . . 7086 1 912 . 1 1 77 77 CYS HB2 H 1 2.40 0.03 . 2 . . . . . . . . 7086 1 913 . 1 1 77 77 CYS HB3 H 1 2.27 0.03 . 2 . . . . . . . . 7086 1 914 . 1 1 77 77 CYS C C 13 171.8 0.3 . 1 . . . . . . . . 7086 1 915 . 1 1 78 78 SER N N 15 111.3 0.3 . 1 . . . . . . . . 7086 1 916 . 1 1 78 78 SER H H 1 8.09 0.03 . 1 . . . . . . . . 7086 1 917 . 1 1 78 78 SER CA C 13 58.4 0.3 . 1 . . . . . . . . 7086 1 918 . 1 1 78 78 SER HA H 1 4.62 0.03 . 1 . . . . . . . . 7086 1 919 . 1 1 78 78 SER CB C 13 65.3 0.3 . 1 . . . . . . . . 7086 1 920 . 1 1 78 78 SER HB2 H 1 3.95 0.03 . 2 . . . . . . . . 7086 1 921 . 1 1 78 78 SER HB3 H 1 3.61 0.03 . 2 . . . . . . . . 7086 1 922 . 1 1 78 78 SER C C 13 172.0 0.3 . 1 . . . . . . . . 7086 1 923 . 1 1 79 79 HIS N N 15 120.3 0.3 . 1 . . . . . . . . 7086 1 924 . 1 1 79 79 HIS H H 1 9.19 0.03 . 1 . . . . . . . . 7086 1 925 . 1 1 79 79 HIS CA C 13 56.8 0.3 . 1 . . . . . . . . 7086 1 926 . 1 1 79 79 HIS HA H 1 4.65 0.03 . 1 . . . . . . . . 7086 1 927 . 1 1 79 79 HIS CB C 13 30.3 0.3 . 1 . . . . . . . . 7086 1 928 . 1 1 79 79 HIS HB2 H 1 2.74 0.03 . 2 . . . . . . . . 7086 1 929 . 1 1 79 79 HIS HB3 H 1 2.46 0.03 . 2 . . . . . . . . 7086 1 930 . 1 1 79 79 HIS C C 13 173.9 0.3 . 1 . . . . . . . . 7086 1 931 . 1 1 80 80 PHE N N 15 127.3 0.3 . 1 . . . . . . . . 7086 1 932 . 1 1 80 80 PHE H H 1 8.50 0.03 . 1 . . . . . . . . 7086 1 933 . 1 1 80 80 PHE CA C 13 55.7 0.3 . 1 . . . . . . . . 7086 1 934 . 1 1 80 80 PHE HA H 1 5.94 0.03 . 1 . . . . . . . . 7086 1 935 . 1 1 80 80 PHE CB C 13 43.1 0.3 . 1 . . . . . . . . 7086 1 936 . 1 1 80 80 PHE HB2 H 1 3.30 0.03 . 2 . . . . . . . . 7086 1 937 . 1 1 80 80 PHE HB3 H 1 2.84 0.03 . 2 . . . . . . . . 7086 1 938 . 1 1 80 80 PHE HD1 H 1 7.21 0.03 . 1 . . . . . . . . 7086 1 939 . 1 1 80 80 PHE HD2 H 1 7.21 0.03 . 1 . . . . . . . . 7086 1 940 . 1 1 80 80 PHE CD1 C 13 131.9 0.3 . 1 . . . . . . . . 7086 1 941 . 1 1 80 80 PHE C C 13 175.4 0.3 . 1 . . . . . . . . 7086 1 942 . 1 1 81 81 GLY N N 15 114.4 0.3 . 1 . . . . . . . . 7086 1 943 . 1 1 81 81 GLY H H 1 8.47 0.03 . 1 . . . . . . . . 7086 1 944 . 1 1 81 81 GLY CA C 13 44.5 0.3 . 1 . . . . . . . . 7086 1 945 . 1 1 81 81 GLY HA2 H 1 3.76 0.03 . 2 . . . . . . . . 7086 1 946 . 1 1 81 81 GLY HA3 H 1 3.45 0.03 . 2 . . . . . . . . 7086 1 947 . 1 1 81 81 GLY C C 13 169.6 0.3 . 1 . . . . . . . . 7086 1 948 . 1 1 82 82 GLU N N 15 118.7 0.3 . 1 . . . . . . . . 7086 1 949 . 1 1 82 82 GLU H H 1 8.95 0.03 . 1 . . . . . . . . 7086 1 950 . 1 1 82 82 GLU CA C 13 55.1 0.3 . 1 . . . . . . . . 7086 1 951 . 1 1 82 82 GLU HA H 1 5.30 0.03 . 1 . . . . . . . . 7086 1 952 . 1 1 82 82 GLU CB C 13 36.4 0.3 . 1 . . . . . . . . 7086 1 953 . 1 1 82 82 GLU HB2 H 1 2.00 0.03 . 2 . . . . . . . . 7086 1 954 . 1 1 82 82 GLU HB3 H 1 1.81 0.03 . 2 . . . . . . . . 7086 1 955 . 1 1 82 82 GLU CG C 13 38.3 0.3 . 1 . . . . . . . . 7086 1 956 . 1 1 82 82 GLU HG2 H 1 2.24 0.03 . 2 . . . . . . . . 7086 1 957 . 1 1 82 82 GLU HG3 H 1 2.04 0.03 . 2 . . . . . . . . 7086 1 958 . 1 1 82 82 GLU C C 13 174.4 0.3 . 1 . . . . . . . . 7086 1 959 . 1 1 83 83 LEU N N 15 125.1 0.3 . 1 . . . . . . . . 7086 1 960 . 1 1 83 83 LEU H H 1 9.54 0.03 . 1 . . . . . . . . 7086 1 961 . 1 1 83 83 LEU CA C 13 52.3 0.3 . 1 . . . . . . . . 7086 1 962 . 1 1 83 83 LEU HA H 1 5.16 0.03 . 1 . . . . . . . . 7086 1 963 . 1 1 83 83 LEU CB C 13 45.1 0.3 . 1 . . . . . . . . 7086 1 964 . 1 1 83 83 LEU CG C 13 26.8 0.3 . 1 . . . . . . . . 7086 1 965 . 1 1 83 83 LEU HG H 1 1.46 0.03 . 1 . . . . . . . . 7086 1 966 . 1 1 83 83 LEU HD11 H 1 0.26 0.03 . 2 . . . . . . . . 7086 1 967 . 1 1 83 83 LEU HD12 H 1 0.26 0.03 . 2 . . . . . . . . 7086 1 968 . 1 1 83 83 LEU HD13 H 1 0.26 0.03 . 2 . . . . . . . . 7086 1 969 . 1 1 83 83 LEU HD21 H 1 0.79 0.03 . 2 . . . . . . . . 7086 1 970 . 1 1 83 83 LEU HD22 H 1 0.79 0.03 . 2 . . . . . . . . 7086 1 971 . 1 1 83 83 LEU HD23 H 1 0.79 0.03 . 2 . . . . . . . . 7086 1 972 . 1 1 83 83 LEU CD1 C 13 26.0 0.3 . 1 . . . . . . . . 7086 1 973 . 1 1 83 83 LEU CD2 C 13 24.0 0.3 . 1 . . . . . . . . 7086 1 974 . 1 1 83 83 LEU C C 13 176.1 0.3 . 1 . . . . . . . . 7086 1 975 . 1 1 84 84 ILE N N 15 118.7 0.3 . 1 . . . . . . . . 7086 1 976 . 1 1 84 84 ILE H H 1 8.52 0.03 . 1 . . . . . . . . 7086 1 977 . 1 1 84 84 ILE CA C 13 61.1 0.3 . 1 . . . . . . . . 7086 1 978 . 1 1 84 84 ILE HA H 1 4.80 0.03 . 1 . . . . . . . . 7086 1 979 . 1 1 84 84 ILE CB C 13 40.1 0.3 . 1 . . . . . . . . 7086 1 980 . 1 1 84 84 ILE HB H 1 1.71 0.03 . 1 . . . . . . . . 7086 1 981 . 1 1 84 84 ILE HG21 H 1 0.66 0.03 . 1 . . . . . . . . 7086 1 982 . 1 1 84 84 ILE HG22 H 1 0.66 0.03 . 1 . . . . . . . . 7086 1 983 . 1 1 84 84 ILE HG23 H 1 0.66 0.03 . 1 . . . . . . . . 7086 1 984 . 1 1 84 84 ILE CG2 C 13 17.4 0.3 . 1 . . . . . . . . 7086 1 985 . 1 1 84 84 ILE CG1 C 13 27.2 0.3 . 1 . . . . . . . . 7086 1 986 . 1 1 84 84 ILE HG12 H 1 1.67 0.03 . 2 . . . . . . . . 7086 1 987 . 1 1 84 84 ILE HG13 H 1 0.96 0.03 . 2 . . . . . . . . 7086 1 988 . 1 1 84 84 ILE HD11 H 1 0.84 0.03 . 1 . . . . . . . . 7086 1 989 . 1 1 84 84 ILE HD12 H 1 0.84 0.03 . 1 . . . . . . . . 7086 1 990 . 1 1 84 84 ILE HD13 H 1 0.84 0.03 . 1 . . . . . . . . 7086 1 991 . 1 1 84 84 ILE CD1 C 13 13.2 0.3 . 1 . . . . . . . . 7086 1 992 . 1 1 84 84 ILE C C 13 176.0 0.3 . 1 . . . . . . . . 7086 1 993 . 1 1 85 85 ILE N N 15 126.3 0.3 . 1 . . . . . . . . 7086 1 994 . 1 1 85 85 ILE H H 1 8.68 0.03 . 1 . . . . . . . . 7086 1 995 . 1 1 85 85 ILE CA C 13 59.8 0.3 . 1 . . . . . . . . 7086 1 996 . 1 1 85 85 ILE HA H 1 3.97 0.03 . 1 . . . . . . . . 7086 1 997 . 1 1 85 85 ILE CB C 13 38.9 0.3 . 1 . . . . . . . . 7086 1 998 . 1 1 85 85 ILE HB H 1 1.33 0.03 . 1 . . . . . . . . 7086 1 999 . 1 1 85 85 ILE HG21 H 1 0.23 0.03 . 1 . . . . . . . . 7086 1 1000 . 1 1 85 85 ILE HG22 H 1 0.23 0.03 . 1 . . . . . . . . 7086 1 1001 . 1 1 85 85 ILE HG23 H 1 0.23 0.03 . 1 . . . . . . . . 7086 1 1002 . 1 1 85 85 ILE CG2 C 13 17.1 0.3 . 1 . . . . . . . . 7086 1 1003 . 1 1 85 85 ILE CG1 C 13 25.4 0.3 . 1 . . . . . . . . 7086 1 1004 . 1 1 85 85 ILE HG12 H 1 1.05 0.03 . 1 . . . . . . . . 7086 1 1005 . 1 1 85 85 ILE HG13 H 1 1.05 0.03 . 1 . . . . . . . . 7086 1 1006 . 1 1 85 85 ILE HD11 H 1 0.13 0.03 . 1 . . . . . . . . 7086 1 1007 . 1 1 85 85 ILE HD12 H 1 0.13 0.03 . 1 . . . . . . . . 7086 1 1008 . 1 1 85 85 ILE HD13 H 1 0.13 0.03 . 1 . . . . . . . . 7086 1 1009 . 1 1 85 85 ILE CD1 C 13 13.3 0.3 . 1 . . . . . . . . 7086 1 1010 . 1 1 85 85 ILE C C 13 174.6 0.3 . 1 . . . . . . . . 7086 1 1011 . 1 1 86 86 ASP N N 15 125.9 0.3 . 1 . . . . . . . . 7086 1 1012 . 1 1 86 86 ASP H H 1 8.90 0.03 . 1 . . . . . . . . 7086 1 1013 . 1 1 86 86 ASP CA C 13 55.1 0.3 . 1 . . . . . . . . 7086 1 1014 . 1 1 86 86 ASP HA H 1 4.16 0.03 . 1 . . . . . . . . 7086 1 1015 . 1 1 86 86 ASP CB C 13 39.3 0.3 . 1 . . . . . . . . 7086 1 1016 . 1 1 86 86 ASP HB2 H 1 2.73 0.03 . 2 . . . . . . . . 7086 1 1017 . 1 1 86 86 ASP HB3 H 1 2.56 0.03 . 2 . . . . . . . . 7086 1 1018 . 1 1 86 86 ASP C C 13 176.0 0.3 . 1 . . . . . . . . 7086 1 1019 . 1 1 87 87 GLY N N 15 101.2 0.3 . 1 . . . . . . . . 7086 1 1020 . 1 1 87 87 GLY H H 1 7.92 0.03 . 1 . . . . . . . . 7086 1 1021 . 1 1 87 87 GLY CA C 13 45.2 0.3 . 1 . . . . . . . . 7086 1 1022 . 1 1 87 87 GLY HA2 H 1 4.10 0.03 . 2 . . . . . . . . 7086 1 1023 . 1 1 87 87 GLY HA3 H 1 3.42 0.03 . 2 . . . . . . . . 7086 1 1024 . 1 1 87 87 GLY C C 13 173.5 0.3 . 1 . . . . . . . . 7086 1 1025 . 1 1 88 88 ILE N N 15 124.5 0.3 . 1 . . . . . . . . 7086 1 1026 . 1 1 88 88 ILE H H 1 8.04 0.03 . 1 . . . . . . . . 7086 1 1027 . 1 1 88 88 ILE CA C 13 59.5 0.3 . 1 . . . . . . . . 7086 1 1028 . 1 1 88 88 ILE HA H 1 4.14 0.03 . 1 . . . . . . . . 7086 1 1029 . 1 1 88 88 ILE CB C 13 38.3 0.3 . 1 . . . . . . . . 7086 1 1030 . 1 1 88 88 ILE HB H 1 2.03 0.03 . 1 . . . . . . . . 7086 1 1031 . 1 1 88 88 ILE HG21 H 1 0.84 0.03 . 1 . . . . . . . . 7086 1 1032 . 1 1 88 88 ILE HG22 H 1 0.84 0.03 . 1 . . . . . . . . 7086 1 1033 . 1 1 88 88 ILE HG23 H 1 0.84 0.03 . 1 . . . . . . . . 7086 1 1034 . 1 1 88 88 ILE CG2 C 13 17.7 0.3 . 1 . . . . . . . . 7086 1 1035 . 1 1 88 88 ILE CG1 C 13 28.3 0.3 . 1 . . . . . . . . 7086 1 1036 . 1 1 88 88 ILE HG12 H 1 1.15 0.03 . 2 . . . . . . . . 7086 1 1037 . 1 1 88 88 ILE HG13 H 1 0.95 0.03 . 2 . . . . . . . . 7086 1 1038 . 1 1 88 88 ILE HD11 H 1 0.15 0.03 . 1 . . . . . . . . 7086 1 1039 . 1 1 88 88 ILE HD12 H 1 0.15 0.03 . 1 . . . . . . . . 7086 1 1040 . 1 1 88 88 ILE HD13 H 1 0.15 0.03 . 1 . . . . . . . . 7086 1 1041 . 1 1 88 88 ILE CD1 C 13 11.8 0.3 . 1 . . . . . . . . 7086 1 1042 . 1 1 88 88 ILE C C 13 173.9 0.3 . 1 . . . . . . . . 7086 1 1043 . 1 1 89 89 LYS N N 15 128.9 0.3 . 1 . . . . . . . . 7086 1 1044 . 1 1 89 89 LYS H H 1 8.64 0.03 . 1 . . . . . . . . 7086 1 1045 . 1 1 89 89 LYS CA C 13 56.9 0.3 . 1 . . . . . . . . 7086 1 1046 . 1 1 89 89 LYS HA H 1 4.54 0.03 . 1 . . . . . . . . 7086 1 1047 . 1 1 89 89 LYS CB C 13 32.5 0.3 . 1 . . . . . . . . 7086 1 1048 . 1 1 89 89 LYS HB2 H 1 1.76 0.03 . 1 . . . . . . . . 7086 1 1049 . 1 1 89 89 LYS HB3 H 1 1.76 0.03 . 1 . . . . . . . . 7086 1 1050 . 1 1 89 89 LYS CG C 13 25.0 0.3 . 1 . . . . . . . . 7086 1 1051 . 1 1 89 89 LYS HG2 H 1 1.50 0.03 . 2 . . . . . . . . 7086 1 1052 . 1 1 89 89 LYS HG3 H 1 1.32 0.03 . 2 . . . . . . . . 7086 1 1053 . 1 1 89 89 LYS CD C 13 29.4 0.3 . 1 . . . . . . . . 7086 1 1054 . 1 1 89 89 LYS HD2 H 1 1.80 0.03 . 2 . . . . . . . . 7086 1 1055 . 1 1 89 89 LYS HD3 H 1 1.72 0.03 . 2 . . . . . . . . 7086 1 1056 . 1 1 89 89 LYS CE C 13 41.7 0.3 . 1 . . . . . . . . 7086 1 1057 . 1 1 89 89 LYS HE2 H 1 3.04 0.03 . 1 . . . . . . . . 7086 1 1058 . 1 1 89 89 LYS HE3 H 1 3.04 0.03 . 1 . . . . . . . . 7086 1 1059 . 1 1 89 89 LYS C C 13 174.7 0.3 . 1 . . . . . . . . 7086 1 1060 . 1 1 90 90 VAL N N 15 127.9 0.3 . 1 . . . . . . . . 7086 1 1061 . 1 1 90 90 VAL H H 1 9.06 0.03 . 1 . . . . . . . . 7086 1 1062 . 1 1 90 90 VAL CA C 13 59.1 0.3 . 1 . . . . . . . . 7086 1 1063 . 1 1 90 90 VAL HA H 1 5.26 0.03 . 1 . . . . . . . . 7086 1 1064 . 1 1 90 90 VAL CB C 13 33.7 0.3 . 1 . . . . . . . . 7086 1 1065 . 1 1 90 90 VAL HB H 1 1.75 0.03 . 1 . . . . . . . . 7086 1 1066 . 1 1 90 90 VAL HG11 H 1 0.49 0.03 . 2 . . . . . . . . 7086 1 1067 . 1 1 90 90 VAL HG12 H 1 0.49 0.03 . 2 . . . . . . . . 7086 1 1068 . 1 1 90 90 VAL HG13 H 1 0.49 0.03 . 2 . . . . . . . . 7086 1 1069 . 1 1 90 90 VAL HG21 H 1 0.63 0.03 . 2 . . . . . . . . 7086 1 1070 . 1 1 90 90 VAL HG22 H 1 0.63 0.03 . 2 . . . . . . . . 7086 1 1071 . 1 1 90 90 VAL HG23 H 1 0.63 0.03 . 2 . . . . . . . . 7086 1 1072 . 1 1 90 90 VAL CG1 C 13 21.3 0.3 . 1 . . . . . . . . 7086 1 1073 . 1 1 90 90 VAL CG2 C 13 20.1 0.3 . 1 . . . . . . . . 7086 1 1074 . 1 1 90 90 VAL C C 13 175.8 0.3 . 1 . . . . . . . . 7086 1 1075 . 1 1 91 91 GLU N N 15 126.5 0.3 . 1 . . . . . . . . 7086 1 1076 . 1 1 91 91 GLU H H 1 8.94 0.03 . 1 . . . . . . . . 7086 1 1077 . 1 1 91 91 GLU CA C 13 56.0 0.3 . 1 . . . . . . . . 7086 1 1078 . 1 1 91 91 GLU HA H 1 4.69 0.03 . 1 . . . . . . . . 7086 1 1079 . 1 1 91 91 GLU CB C 13 31.9 0.3 . 1 . . . . . . . . 7086 1 1080 . 1 1 91 91 GLU HB2 H 1 2.26 0.03 . 2 . . . . . . . . 7086 1 1081 . 1 1 91 91 GLU HB3 H 1 2.16 0.03 . 2 . . . . . . . . 7086 1 1082 . 1 1 91 91 GLU CG C 13 38.5 0.3 . 1 . . . . . . . . 7086 1 1083 . 1 1 91 91 GLU HG2 H 1 2.58 0.03 . 2 . . . . . . . . 7086 1 1084 . 1 1 91 91 GLU HG3 H 1 2.25 0.03 . 2 . . . . . . . . 7086 1 1085 . 1 1 91 91 GLU C C 13 174.4 0.3 . 1 . . . . . . . . 7086 1 1086 . 1 1 92 92 ILE N N 15 123.0 0.3 . 1 . . . . . . . . 7086 1 1087 . 1 1 92 92 ILE H H 1 8.44 0.03 . 1 . . . . . . . . 7086 1 1088 . 1 1 92 92 ILE CA C 13 59.0 0.3 . 1 . . . . . . . . 7086 1 1089 . 1 1 92 92 ILE HA H 1 4.49 0.03 . 1 . . . . . . . . 7086 1 1090 . 1 1 92 92 ILE CB C 13 40.1 0.3 . 1 . . . . . . . . 7086 1 1091 . 1 1 92 92 ILE HB H 1 1.35 0.03 . 1 . . . . . . . . 7086 1 1092 . 1 1 92 92 ILE HG21 H 1 0.67 0.03 . 1 . . . . . . . . 7086 1 1093 . 1 1 92 92 ILE HG22 H 1 0.67 0.03 . 1 . . . . . . . . 7086 1 1094 . 1 1 92 92 ILE HG23 H 1 0.67 0.03 . 1 . . . . . . . . 7086 1 1095 . 1 1 92 92 ILE CG2 C 13 18.2 0.3 . 1 . . . . . . . . 7086 1 1096 . 1 1 92 92 ILE CG1 C 13 27.1 0.3 . 1 . . . . . . . . 7086 1 1097 . 1 1 92 92 ILE HG12 H 1 1.22 0.03 . 2 . . . . . . . . 7086 1 1098 . 1 1 92 92 ILE HG13 H 1 0.79 0.03 . 2 . . . . . . . . 7086 1 1099 . 1 1 92 92 ILE HD11 H 1 0.49 0.03 . 1 . . . . . . . . 7086 1 1100 . 1 1 92 92 ILE HD12 H 1 0.49 0.03 . 1 . . . . . . . . 7086 1 1101 . 1 1 92 92 ILE HD13 H 1 0.49 0.03 . 1 . . . . . . . . 7086 1 1102 . 1 1 92 92 ILE CD1 C 13 13.7 0.3 . 1 . . . . . . . . 7086 1 1103 . 1 1 92 92 ILE C C 13 175.0 0.3 . 1 . . . . . . . . 7086 1 1104 . 1 1 93 93 MET N N 15 122.8 0.3 . 1 . . . . . . . . 7086 1 1105 . 1 1 93 93 MET H H 1 8.51 0.03 . 1 . . . . . . . . 7086 1 1106 . 1 1 93 93 MET CA C 13 54.4 0.3 . 1 . . . . . . . . 7086 1 1107 . 1 1 93 93 MET HA H 1 5.13 0.03 . 1 . . . . . . . . 7086 1 1108 . 1 1 93 93 MET CB C 13 35.9 0.3 . 1 . . . . . . . . 7086 1 1109 . 1 1 93 93 MET HB2 H 1 2.21 0.03 . 2 . . . . . . . . 7086 1 1110 . 1 1 93 93 MET HB3 H 1 1.85 0.03 . 2 . . . . . . . . 7086 1 1111 . 1 1 93 93 MET CG C 13 33.5 0.3 . 1 . . . . . . . . 7086 1 1112 . 1 1 93 93 MET HG2 H 1 2.71 0.03 . 2 . . . . . . . . 7086 1 1113 . 1 1 93 93 MET HG3 H 1 2.61 0.03 . 2 . . . . . . . . 7086 1 1114 . 1 1 93 93 MET HE1 H 1 1.98 0.03 . 1 . . . . . . . . 7086 1 1115 . 1 1 93 93 MET HE2 H 1 1.98 0.03 . 1 . . . . . . . . 7086 1 1116 . 1 1 93 93 MET HE3 H 1 1.98 0.03 . 1 . . . . . . . . 7086 1 1117 . 1 1 93 93 MET CE C 13 17.9 0.3 . 1 . . . . . . . . 7086 1 1118 . 1 1 93 93 MET C C 13 175.2 0.3 . 1 . . . . . . . . 7086 1 1119 . 1 1 94 94 GLY N N 15 111.4 0.3 . 1 . . . . . . . . 7086 1 1120 . 1 1 94 94 GLY H H 1 9.91 0.03 . 1 . . . . . . . . 7086 1 1121 . 1 1 94 94 GLY CA C 13 44.7 0.3 . 1 . . . . . . . . 7086 1 1122 . 1 1 94 94 GLY HA2 H 1 4.64 0.03 . 1 . . . . . . . . 7086 1 1123 . 1 1 94 94 GLY HA3 H 1 4.64 0.03 . 1 . . . . . . . . 7086 1 1124 . 1 1 94 94 GLY C C 13 173.2 0.3 . 1 . . . . . . . . 7086 1 1125 . 1 1 95 95 ASP N N 15 124.9 0.3 . 1 . . . . . . . . 7086 1 1126 . 1 1 95 95 ASP H H 1 9.33 0.03 . 1 . . . . . . . . 7086 1 1127 . 1 1 95 95 ASP CA C 13 54.6 0.3 . 1 . . . . . . . . 7086 1 1128 . 1 1 95 95 ASP HA H 1 4.65 0.03 . 1 . . . . . . . . 7086 1 1129 . 1 1 95 95 ASP CB C 13 40.5 0.3 . 1 . . . . . . . . 7086 1 1130 . 1 1 95 95 ASP HB2 H 1 3.21 0.03 . 2 . . . . . . . . 7086 1 1131 . 1 1 95 95 ASP HB3 H 1 2.50 0.03 . 2 . . . . . . . . 7086 1 1132 . 1 1 95 95 ASP C C 13 174.1 0.3 . 1 . . . . . . . . 7086 1 1133 . 1 1 96 96 ILE N N 15 118.2 0.3 . 1 . . . . . . . . 7086 1 1134 . 1 1 96 96 ILE H H 1 7.92 0.03 . 1 . . . . . . . . 7086 1 1135 . 1 1 96 96 ILE CA C 13 62.9 0.3 . 1 . . . . . . . . 7086 1 1136 . 1 1 96 96 ILE HA H 1 4.38 0.03 . 1 . . . . . . . . 7086 1 1137 . 1 1 96 96 ILE CB C 13 38.7 0.3 . 1 . . . . . . . . 7086 1 1138 . 1 1 96 96 ILE HB H 1 1.71 0.03 . 1 . . . . . . . . 7086 1 1139 . 1 1 96 96 ILE HG21 H 1 0.93 0.03 . 1 . . . . . . . . 7086 1 1140 . 1 1 96 96 ILE HG22 H 1 0.93 0.03 . 1 . . . . . . . . 7086 1 1141 . 1 1 96 96 ILE HG23 H 1 0.93 0.03 . 1 . . . . . . . . 7086 1 1142 . 1 1 96 96 ILE CG2 C 13 17.4 0.3 . 1 . . . . . . . . 7086 1 1143 . 1 1 96 96 ILE CG1 C 13 28.9 0.3 . 1 . . . . . . . . 7086 1 1144 . 1 1 96 96 ILE HG12 H 1 1.64 0.03 . 1 . . . . . . . . 7086 1 1145 . 1 1 96 96 ILE HG13 H 1 1.64 0.03 . 1 . . . . . . . . 7086 1 1146 . 1 1 96 96 ILE HD11 H 1 0.93 0.03 . 1 . . . . . . . . 7086 1 1147 . 1 1 96 96 ILE HD12 H 1 0.93 0.03 . 1 . . . . . . . . 7086 1 1148 . 1 1 96 96 ILE HD13 H 1 0.93 0.03 . 1 . . . . . . . . 7086 1 1149 . 1 1 96 96 ILE CD1 C 13 14.7 0.3 . 1 . . . . . . . . 7086 1 1150 . 1 1 96 96 ILE C C 13 177.6 0.3 . 1 . . . . . . . . 7086 1 1151 . 1 1 97 97 ARG N N 15 127.3 0.3 . 1 . . . . . . . . 7086 1 1152 . 1 1 97 97 ARG H H 1 9.04 0.03 . 1 . . . . . . . . 7086 1 1153 . 1 1 97 97 ARG CA C 13 54.9 0.3 . 1 . . . . . . . . 7086 1 1154 . 1 1 97 97 ARG HA H 1 4.90 0.03 . 1 . . . . . . . . 7086 1 1155 . 1 1 97 97 ARG CB C 13 34.8 0.3 . 1 . . . . . . . . 7086 1 1156 . 1 1 97 97 ARG HB2 H 1 2.20 0.03 . 2 . . . . . . . . 7086 1 1157 . 1 1 97 97 ARG HB3 H 1 1.89 0.03 . 2 . . . . . . . . 7086 1 1158 . 1 1 97 97 ARG CG C 13 26.7 0.3 . 1 . . . . . . . . 7086 1 1159 . 1 1 97 97 ARG HG2 H 1 1.89 0.03 . 2 . . . . . . . . 7086 1 1160 . 1 1 97 97 ARG HG3 H 1 1.55 0.03 . 2 . . . . . . . . 7086 1 1161 . 1 1 97 97 ARG CD C 13 44.5 0.3 . 1 . . . . . . . . 7086 1 1162 . 1 1 97 97 ARG HD2 H 1 3.21 0.03 . 2 . . . . . . . . 7086 1 1163 . 1 1 97 97 ARG HD3 H 1 3.07 0.03 . 2 . . . . . . . . 7086 1 1164 . 1 1 97 97 ARG C C 13 174.8 0.3 . 1 . . . . . . . . 7086 1 1165 . 1 1 98 98 LYS N N 15 121.0 0.3 . 1 . . . . . . . . 7086 1 1166 . 1 1 98 98 LYS H H 1 8.55 0.03 . 1 . . . . . . . . 7086 1 1167 . 1 1 98 98 LYS CA C 13 54.8 0.3 . 1 . . . . . . . . 7086 1 1168 . 1 1 98 98 LYS HA H 1 5.22 0.03 . 1 . . . . . . . . 7086 1 1169 . 1 1 98 98 LYS CB C 13 34.4 0.3 . 1 . . . . . . . . 7086 1 1170 . 1 1 98 98 LYS HB2 H 1 1.83 0.03 . 2 . . . . . . . . 7086 1 1171 . 1 1 98 98 LYS HB3 H 1 1.74 0.03 . 2 . . . . . . . . 7086 1 1172 . 1 1 98 98 LYS CG C 13 25.4 0.3 . 1 . . . . . . . . 7086 1 1173 . 1 1 98 98 LYS HG2 H 1 1.55 0.03 . 2 . . . . . . . . 7086 1 1174 . 1 1 98 98 LYS HG3 H 1 1.50 0.03 . 2 . . . . . . . . 7086 1 1175 . 1 1 98 98 LYS CD C 13 29.4 0.3 . 1 . . . . . . . . 7086 1 1176 . 1 1 98 98 LYS HD2 H 1 1.68 0.03 . 1 . . . . . . . . 7086 1 1177 . 1 1 98 98 LYS HD3 H 1 1.68 0.03 . 1 . . . . . . . . 7086 1 1178 . 1 1 98 98 LYS CE C 13 42.1 0.3 . 1 . . . . . . . . 7086 1 1179 . 1 1 98 98 LYS HE2 H 1 3.02 0.03 . 2 . . . . . . . . 7086 1 1180 . 1 1 98 98 LYS HE3 H 1 2.92 0.03 . 2 . . . . . . . . 7086 1 1181 . 1 1 98 98 LYS C C 13 175.5 0.3 . 1 . . . . . . . . 7086 1 1182 . 1 1 99 99 ARG N N 15 125.4 0.3 . 1 . . . . . . . . 7086 1 1183 . 1 1 99 99 ARG H H 1 8.15 0.03 . 1 . . . . . . . . 7086 1 1184 . 1 1 99 99 ARG CA C 13 55.5 0.3 . 1 . . . . . . . . 7086 1 1185 . 1 1 99 99 ARG HA H 1 3.93 0.03 . 1 . . . . . . . . 7086 1 1186 . 1 1 99 99 ARG CB C 13 31.2 0.3 . 1 . . . . . . . . 7086 1 1187 . 1 1 99 99 ARG HB2 H 1 1.49 0.03 . 2 . . . . . . . . 7086 1 1188 . 1 1 99 99 ARG HB3 H 1 0.78 0.03 . 2 . . . . . . . . 7086 1 1189 . 1 1 99 99 ARG CG C 13 27.0 0.3 . 1 . . . . . . . . 7086 1 1190 . 1 1 99 99 ARG HG2 H 1 1.27 0.03 . 2 . . . . . . . . 7086 1 1191 . 1 1 99 99 ARG HG3 H 1 0.58 0.03 . 2 . . . . . . . . 7086 1 1192 . 1 1 99 99 ARG CD C 13 42.9 0.3 . 1 . . . . . . . . 7086 1 1193 . 1 1 99 99 ARG HD2 H 1 2.28 0.03 . 2 . . . . . . . . 7086 1 1194 . 1 1 99 99 ARG HD3 H 1 2.22 0.03 . 2 . . . . . . . . 7086 1 1195 . 1 1 99 99 ARG C C 13 176.7 0.3 . 1 . . . . . . . . 7086 1 1196 . 1 1 100 100 LEU N N 15 127.7 0.3 . 1 . . . . . . . . 7086 1 1197 . 1 1 100 100 LEU H H 1 9.04 0.03 . 1 . . . . . . . . 7086 1 1198 . 1 1 100 100 LEU CA C 13 54.2 0.3 . 1 . . . . . . . . 7086 1 1199 . 1 1 100 100 LEU HA H 1 4.52 0.03 . 1 . . . . . . . . 7086 1 1200 . 1 1 100 100 LEU CB C 13 42.3 0.3 . 1 . . . . . . . . 7086 1 1201 . 1 1 100 100 LEU HB2 H 1 1.93 0.03 . 2 . . . . . . . . 7086 1 1202 . 1 1 100 100 LEU HB3 H 1 1.53 0.03 . 2 . . . . . . . . 7086 1 1203 . 1 1 100 100 LEU CG C 13 27.8 0.3 . 1 . . . . . . . . 7086 1 1204 . 1 1 100 100 LEU HG H 1 1.64 0.03 . 1 . . . . . . . . 7086 1 1205 . 1 1 100 100 LEU HD11 H 1 0.88 0.03 . 2 . . . . . . . . 7086 1 1206 . 1 1 100 100 LEU HD12 H 1 0.88 0.03 . 2 . . . . . . . . 7086 1 1207 . 1 1 100 100 LEU HD13 H 1 0.88 0.03 . 2 . . . . . . . . 7086 1 1208 . 1 1 100 100 LEU HD21 H 1 0.90 0.03 . 2 . . . . . . . . 7086 1 1209 . 1 1 100 100 LEU HD22 H 1 0.90 0.03 . 2 . . . . . . . . 7086 1 1210 . 1 1 100 100 LEU HD23 H 1 0.90 0.03 . 2 . . . . . . . . 7086 1 1211 . 1 1 100 100 LEU CD1 C 13 25.6 0.3 . 1 . . . . . . . . 7086 1 1212 . 1 1 100 100 LEU CD2 C 13 22.6 0.3 . 1 . . . . . . . . 7086 1 1213 . 1 1 101 101 GLU CA C 13 59.3 0.3 . 1 . . . . . . . . 7086 1 1214 . 1 1 101 101 GLU HA H 1 3.98 0.03 . 1 . . . . . . . . 7086 1 1215 . 1 1 101 101 GLU CB C 13 29.4 0.3 . 1 . . . . . . . . 7086 1 1216 . 1 1 101 101 GLU HB2 H 1 2.06 0.03 . 1 . . . . . . . . 7086 1 1217 . 1 1 101 101 GLU HB3 H 1 2.06 0.03 . 1 . . . . . . . . 7086 1 1218 . 1 1 101 101 GLU CG C 13 36.5 0.3 . 1 . . . . . . . . 7086 1 1219 . 1 1 101 101 GLU HG2 H 1 2.35 0.03 . 1 . . . . . . . . 7086 1 1220 . 1 1 101 101 GLU HG3 H 1 2.35 0.03 . 1 . . . . . . . . 7086 1 1221 . 1 1 101 101 GLU C C 13 176.8 0.3 . 1 . . . . . . . . 7086 1 1222 . 1 1 102 102 ASP N N 15 115.6 0.3 . 1 . . . . . . . . 7086 1 1223 . 1 1 102 102 ASP H H 1 7.62 0.03 . 1 . . . . . . . . 7086 1 1224 . 1 1 102 102 ASP CA C 13 53.1 0.3 . 1 . . . . . . . . 7086 1 1225 . 1 1 102 102 ASP HA H 1 4.49 0.03 . 1 . . . . . . . . 7086 1 1226 . 1 1 102 102 ASP CB C 13 40.2 0.3 . 1 . . . . . . . . 7086 1 1227 . 1 1 102 102 ASP HB2 H 1 3.07 0.03 . 2 . . . . . . . . 7086 1 1228 . 1 1 102 102 ASP HB3 H 1 2.60 0.03 . 2 . . . . . . . . 7086 1 1229 . 1 1 102 102 ASP C C 13 177.2 0.3 . 1 . . . . . . . . 7086 1 1230 . 1 1 103 103 GLY N N 15 107.7 0.3 . 1 . . . . . . . . 7086 1 1231 . 1 1 103 103 GLY H H 1 8.06 0.03 . 1 . . . . . . . . 7086 1 1232 . 1 1 103 103 GLY CA C 13 45.0 0.3 . 1 . . . . . . . . 7086 1 1233 . 1 1 103 103 GLY HA2 H 1 4.28 0.03 . 2 . . . . . . . . 7086 1 1234 . 1 1 103 103 GLY HA3 H 1 3.41 0.03 . 2 . . . . . . . . 7086 1 1235 . 1 1 103 103 GLY C C 13 174.8 0.3 . 1 . . . . . . . . 7086 1 1236 . 1 1 104 104 THR N N 15 114.3 0.3 . 1 . . . . . . . . 7086 1 1237 . 1 1 104 104 THR H H 1 7.92 0.03 . 1 . . . . . . . . 7086 1 1238 . 1 1 104 104 THR CA C 13 61.2 0.3 . 1 . . . . . . . . 7086 1 1239 . 1 1 104 104 THR HA H 1 4.31 0.03 . 1 . . . . . . . . 7086 1 1240 . 1 1 104 104 THR CB C 13 70.7 0.3 . 1 . . . . . . . . 7086 1 1241 . 1 1 104 104 THR HB H 1 4.79 0.03 . 1 . . . . . . . . 7086 1 1242 . 1 1 104 104 THR HG21 H 1 1.14 0.03 . 1 . . . . . . . . 7086 1 1243 . 1 1 104 104 THR HG22 H 1 1.14 0.03 . 1 . . . . . . . . 7086 1 1244 . 1 1 104 104 THR HG23 H 1 1.14 0.03 . 1 . . . . . . . . 7086 1 1245 . 1 1 104 104 THR CG2 C 13 22.1 0.3 . 1 . . . . . . . . 7086 1 1246 . 1 1 104 104 THR C C 13 172.5 0.3 . 1 . . . . . . . . 7086 1 1247 . 1 1 105 105 TRP N N 15 118.7 0.3 . 1 . . . . . . . . 7086 1 1248 . 1 1 105 105 TRP H H 1 8.49 0.03 . 1 . . . . . . . . 7086 1 1249 . 1 1 105 105 TRP CA C 13 56.0 0.3 . 1 . . . . . . . . 7086 1 1250 . 1 1 105 105 TRP HA H 1 5.04 0.03 . 1 . . . . . . . . 7086 1 1251 . 1 1 105 105 TRP CB C 13 31.1 0.3 . 1 . . . . . . . . 7086 1 1252 . 1 1 105 105 TRP HB2 H 1 3.08 0.03 . 1 . . . . . . . . 7086 1 1253 . 1 1 105 105 TRP HB3 H 1 3.08 0.03 . 1 . . . . . . . . 7086 1 1254 . 1 1 105 105 TRP CD1 C 13 127.7 0.3 . 1 . . . . . . . . 7086 1 1255 . 1 1 105 105 TRP NE1 N 15 128.5 0.3 . 1 . . . . . . . . 7086 1 1256 . 1 1 105 105 TRP HD1 H 1 7.33 0.03 . 1 . . . . . . . . 7086 1 1257 . 1 1 105 105 TRP CZ2 C 13 114.8 0.3 . 1 . . . . . . . . 7086 1 1258 . 1 1 105 105 TRP HE1 H 1 10.15 0.03 . 1 . . . . . . . . 7086 1 1259 . 1 1 105 105 TRP HZ2 H 1 7.47 0.03 . 1 . . . . . . . . 7086 1 1260 . 1 1 105 105 TRP C C 13 177.4 0.3 . 1 . . . . . . . . 7086 1 1261 . 1 1 106 106 GLU N N 15 124.7 0.3 . 1 . . . . . . . . 7086 1 1262 . 1 1 106 106 GLU H H 1 8.91 0.03 . 1 . . . . . . . . 7086 1 1263 . 1 1 106 106 GLU CA C 13 56.1 0.3 . 1 . . . . . . . . 7086 1 1264 . 1 1 106 106 GLU HA H 1 4.36 0.03 . 1 . . . . . . . . 7086 1 1265 . 1 1 106 106 GLU CB C 13 31.4 0.3 . 1 . . . . . . . . 7086 1 1266 . 1 1 106 106 GLU HB2 H 1 2.29 0.03 . 1 . . . . . . . . 7086 1 1267 . 1 1 106 106 GLU HB3 H 1 2.29 0.03 . 1 . . . . . . . . 7086 1 1268 . 1 1 106 106 GLU CG C 13 36.4 0.3 . 1 . . . . . . . . 7086 1 1269 . 1 1 106 106 GLU HG2 H 1 2.80 0.03 . 2 . . . . . . . . 7086 1 1270 . 1 1 106 106 GLU HG3 H 1 2.55 0.03 . 2 . . . . . . . . 7086 1 1271 . 1 1 106 106 GLU C C 13 175.4 0.3 . 1 . . . . . . . . 7086 1 1272 . 1 1 107 107 ASP N N 15 122.9 0.3 . 1 . . . . . . . . 7086 1 1273 . 1 1 107 107 ASP H H 1 8.55 0.03 . 1 . . . . . . . . 7086 1 1274 . 1 1 107 107 ASP CA C 13 53.8 0.3 . 1 . . . . . . . . 7086 1 1275 . 1 1 107 107 ASP HA H 1 4.81 0.03 . 1 . . . . . . . . 7086 1 1276 . 1 1 107 107 ASP CB C 13 39.5 0.3 . 1 . . . . . . . . 7086 1 1277 . 1 1 107 107 ASP HB2 H 1 2.83 0.03 . 2 . . . . . . . . 7086 1 1278 . 1 1 107 107 ASP HB3 H 1 2.54 0.03 . 2 . . . . . . . . 7086 1 1279 . 1 1 108 108 PRO CD C 13 50.0 0.3 . 1 . . . . . . . . 7086 1 1280 . 1 1 108 108 PRO CA C 13 62.6 0.3 . 1 . . . . . . . . 7086 1 1281 . 1 1 108 108 PRO HA H 1 4.65 0.03 . 1 . . . . . . . . 7086 1 1282 . 1 1 108 108 PRO CB C 13 32.2 0.3 . 1 . . . . . . . . 7086 1 1283 . 1 1 108 108 PRO HB2 H 1 2.13 0.03 . 2 . . . . . . . . 7086 1 1284 . 1 1 108 108 PRO HB3 H 1 1.97 0.03 . 2 . . . . . . . . 7086 1 1285 . 1 1 108 108 PRO CG C 13 27.9 0.3 . 1 . . . . . . . . 7086 1 1286 . 1 1 108 108 PRO HG2 H 1 2.13 0.03 . 2 . . . . . . . . 7086 1 1287 . 1 1 108 108 PRO HG3 H 1 1.92 0.03 . 2 . . . . . . . . 7086 1 1288 . 1 1 108 108 PRO HD2 H 1 3.72 0.03 . 1 . . . . . . . . 7086 1 1289 . 1 1 108 108 PRO HD3 H 1 3.72 0.03 . 1 . . . . . . . . 7086 1 1290 . 1 1 108 108 PRO C C 13 176.9 0.3 . 1 . . . . . . . . 7086 1 1291 . 1 1 109 109 VAL N N 15 123.7 0.3 . 1 . . . . . . . . 7086 1 1292 . 1 1 109 109 VAL H H 1 8.92 0.03 . 1 . . . . . . . . 7086 1 1293 . 1 1 109 109 VAL CA C 13 61.6 0.3 . 1 . . . . . . . . 7086 1 1294 . 1 1 109 109 VAL HA H 1 4.03 0.03 . 1 . . . . . . . . 7086 1 1295 . 1 1 109 109 VAL CB C 13 33.2 0.3 . 1 . . . . . . . . 7086 1 1296 . 1 1 109 109 VAL HB H 1 2.16 0.03 . 1 . . . . . . . . 7086 1 1297 . 1 1 109 109 VAL HG11 H 1 0.99 0.03 . 2 . . . . . . . . 7086 1 1298 . 1 1 109 109 VAL HG12 H 1 0.99 0.03 . 2 . . . . . . . . 7086 1 1299 . 1 1 109 109 VAL HG13 H 1 0.99 0.03 . 2 . . . . . . . . 7086 1 1300 . 1 1 109 109 VAL HG21 H 1 0.88 0.03 . 2 . . . . . . . . 7086 1 1301 . 1 1 109 109 VAL HG22 H 1 0.88 0.03 . 2 . . . . . . . . 7086 1 1302 . 1 1 109 109 VAL HG23 H 1 0.88 0.03 . 2 . . . . . . . . 7086 1 1303 . 1 1 109 109 VAL CG1 C 13 22.6 0.3 . 1 . . . . . . . . 7086 1 1304 . 1 1 109 109 VAL CG2 C 13 20.7 0.3 . 1 . . . . . . . . 7086 1 1305 . 1 1 109 109 VAL C C 13 175.1 0.3 . 1 . . . . . . . . 7086 1 1306 . 1 1 110 110 ASP N N 15 125.3 0.3 . 1 . . . . . . . . 7086 1 1307 . 1 1 110 110 ASP H H 1 8.33 0.03 . 1 . . . . . . . . 7086 1 1308 . 1 1 110 110 ASP CA C 13 52.1 0.3 . 1 . . . . . . . . 7086 1 1309 . 1 1 110 110 ASP HA H 1 4.81 0.03 . 1 . . . . . . . . 7086 1 1310 . 1 1 110 110 ASP CB C 13 39.9 0.3 . 1 . . . . . . . . 7086 1 1311 . 1 1 110 110 ASP HB2 H 1 2.92 0.03 . 2 . . . . . . . . 7086 1 1312 . 1 1 110 110 ASP HB3 H 1 2.66 0.03 . 2 . . . . . . . . 7086 1 1313 . 1 1 110 110 ASP C C 13 176.5 0.3 . 1 . . . . . . . . 7086 1 1314 . 1 1 111 111 LEU N N 15 126.1 0.3 . 1 . . . . . . . . 7086 1 1315 . 1 1 111 111 LEU H H 1 8.66 0.03 . 1 . . . . . . . . 7086 1 1316 . 1 1 111 111 LEU CA C 13 57.6 0.3 . 1 . . . . . . . . 7086 1 1317 . 1 1 111 111 LEU HA H 1 3.70 0.03 . 1 . . . . . . . . 7086 1 1318 . 1 1 111 111 LEU CB C 13 42.4 0.3 . 1 . . . . . . . . 7086 1 1319 . 1 1 111 111 LEU HB2 H 1 1.74 0.03 . 2 . . . . . . . . 7086 1 1320 . 1 1 111 111 LEU HB3 H 1 1.13 0.03 . 2 . . . . . . . . 7086 1 1321 . 1 1 111 111 LEU CG C 13 27.0 0.3 . 1 . . . . . . . . 7086 1 1322 . 1 1 111 111 LEU HG H 1 1.77 0.03 . 1 . . . . . . . . 7086 1 1323 . 1 1 111 111 LEU HD11 H 1 0.77 0.03 . 2 . . . . . . . . 7086 1 1324 . 1 1 111 111 LEU HD12 H 1 0.77 0.03 . 2 . . . . . . . . 7086 1 1325 . 1 1 111 111 LEU HD13 H 1 0.77 0.03 . 2 . . . . . . . . 7086 1 1326 . 1 1 111 111 LEU HD21 H 1 0.71 0.03 . 2 . . . . . . . . 7086 1 1327 . 1 1 111 111 LEU HD22 H 1 0.71 0.03 . 2 . . . . . . . . 7086 1 1328 . 1 1 111 111 LEU HD23 H 1 0.71 0.03 . 2 . . . . . . . . 7086 1 1329 . 1 1 111 111 LEU CD1 C 13 25.3 0.3 . 1 . . . . . . . . 7086 1 1330 . 1 1 111 111 LEU CD2 C 13 23.7 0.3 . 1 . . . . . . . . 7086 1 1331 . 1 1 111 111 LEU C C 13 179.0 0.3 . 1 . . . . . . . . 7086 1 1332 . 1 1 112 112 ASN N N 15 111.8 0.3 . 1 . . . . . . . . 7086 1 1333 . 1 1 112 112 ASN H H 1 8.10 0.03 . 1 . . . . . . . . 7086 1 1334 . 1 1 112 112 ASN CA C 13 56.0 0.3 . 1 . . . . . . . . 7086 1 1335 . 1 1 112 112 ASN HA H 1 4.29 0.03 . 1 . . . . . . . . 7086 1 1336 . 1 1 112 112 ASN CB C 13 38.3 0.3 . 1 . . . . . . . . 7086 1 1337 . 1 1 112 112 ASN HB2 H 1 2.92 0.03 . 2 . . . . . . . . 7086 1 1338 . 1 1 112 112 ASN HB3 H 1 2.69 0.03 . 2 . . . . . . . . 7086 1 1339 . 1 1 112 112 ASN C C 13 177.6 0.3 . 1 . . . . . . . . 7086 1 1340 . 1 1 113 113 LYS N N 15 119.3 0.3 . 1 . . . . . . . . 7086 1 1341 . 1 1 113 113 LYS H H 1 7.49 0.03 . 1 . . . . . . . . 7086 1 1342 . 1 1 113 113 LYS CA C 13 58.0 0.3 . 1 . . . . . . . . 7086 1 1343 . 1 1 113 113 LYS HA H 1 3.85 0.03 . 1 . . . . . . . . 7086 1 1344 . 1 1 113 113 LYS CB C 13 32.6 0.3 . 1 . . . . . . . . 7086 1 1345 . 1 1 113 113 LYS HB2 H 1 1.44 0.03 . 2 . . . . . . . . 7086 1 1346 . 1 1 113 113 LYS HB3 H 1 1.27 0.03 . 2 . . . . . . . . 7086 1 1347 . 1 1 113 113 LYS CG C 13 25.4 0.3 . 1 . . . . . . . . 7086 1 1348 . 1 1 113 113 LYS HG2 H 1 1.12 0.03 . 2 . . . . . . . . 7086 1 1349 . 1 1 113 113 LYS HG3 H 1 0.64 0.03 . 2 . . . . . . . . 7086 1 1350 . 1 1 113 113 LYS CD C 13 29.6 0.3 . 1 . . . . . . . . 7086 1 1351 . 1 1 113 113 LYS HD2 H 1 1.59 0.03 . 2 . . . . . . . . 7086 1 1352 . 1 1 113 113 LYS HD3 H 1 1.52 0.03 . 2 . . . . . . . . 7086 1 1353 . 1 1 113 113 LYS CE C 13 42.2 0.3 . 1 . . . . . . . . 7086 1 1354 . 1 1 113 113 LYS HE2 H 1 2.94 0.03 . 1 . . . . . . . . 7086 1 1355 . 1 1 113 113 LYS HE3 H 1 2.94 0.03 . 1 . . . . . . . . 7086 1 1356 . 1 1 113 113 LYS C C 13 177.2 0.3 . 1 . . . . . . . . 7086 1 1357 . 1 1 114 114 TYR N N 15 114.5 0.3 . 1 . . . . . . . . 7086 1 1358 . 1 1 114 114 TYR H H 1 6.78 0.03 . 1 . . . . . . . . 7086 1 1359 . 1 1 114 114 TYR CA C 13 57.3 0.3 . 1 . . . . . . . . 7086 1 1360 . 1 1 114 114 TYR HA H 1 4.64 0.03 . 1 . . . . . . . . 7086 1 1361 . 1 1 114 114 TYR CB C 13 40.6 0.3 . 1 . . . . . . . . 7086 1 1362 . 1 1 114 114 TYR HB2 H 1 3.23 0.03 . 2 . . . . . . . . 7086 1 1363 . 1 1 114 114 TYR HB3 H 1 2.00 0.03 . 2 . . . . . . . . 7086 1 1364 . 1 1 114 114 TYR HD1 H 1 6.82 0.03 . 1 . . . . . . . . 7086 1 1365 . 1 1 114 114 TYR HD2 H 1 6.82 0.03 . 1 . . . . . . . . 7086 1 1366 . 1 1 114 114 TYR CD1 C 13 133.3 0.3 . 1 . . . . . . . . 7086 1 1367 . 1 1 114 114 TYR C C 13 173.7 0.3 . 1 . . . . . . . . 7086 1 1368 . 1 1 115 115 LYS N N 15 122.3 0.3 . 1 . . . . . . . . 7086 1 1369 . 1 1 115 115 LYS H H 1 7.00 0.03 . 1 . . . . . . . . 7086 1 1370 . 1 1 115 115 LYS CA C 13 56.9 0.3 . 1 . . . . . . . . 7086 1 1371 . 1 1 115 115 LYS HA H 1 4.51 0.03 . 1 . . . . . . . . 7086 1 1372 . 1 1 115 115 LYS CB C 13 33.1 0.3 . 1 . . . . . . . . 7086 1 1373 . 1 1 115 115 LYS HB2 H 1 1.82 0.03 . 2 . . . . . . . . 7086 1 1374 . 1 1 115 115 LYS HB3 H 1 1.48 0.03 . 2 . . . . . . . . 7086 1 1375 . 1 1 115 115 LYS CG C 13 23.9 0.3 . 1 . . . . . . . . 7086 1 1376 . 1 1 115 115 LYS CD C 13 29.6 0.3 . 1 . . . . . . . . 7086 1 1377 . 1 1 115 115 LYS CE C 13 42.1 0.3 . 1 . . . . . . . . 7086 1 1378 . 1 1 115 115 LYS HE2 H 1 3.09 0.03 . 2 . . . . . . . . 7086 1 1379 . 1 1 115 115 LYS HE3 H 1 2.95 0.03 . 2 . . . . . . . . 7086 1 1380 . 1 1 115 115 LYS C C 13 175.7 0.3 . 1 . . . . . . . . 7086 1 1381 . 1 1 116 116 ARG N N 15 127.7 0.3 . 1 . . . . . . . . 7086 1 1382 . 1 1 116 116 ARG H H 1 9.19 0.03 . 1 . . . . . . . . 7086 1 1383 . 1 1 116 116 ARG CA C 13 53.4 0.3 . 1 . . . . . . . . 7086 1 1384 . 1 1 116 116 ARG HA H 1 4.55 0.03 . 1 . . . . . . . . 7086 1 1385 . 1 1 116 116 ARG CB C 13 32.9 0.3 . 1 . . . . . . . . 7086 1 1386 . 1 1 116 116 ARG HB2 H 1 1.90 0.03 . 2 . . . . . . . . 7086 1 1387 . 1 1 116 116 ARG HB3 H 1 1.51 0.03 . 2 . . . . . . . . 7086 1 1388 . 1 1 116 116 ARG CG C 13 27.1 0.3 . 1 . . . . . . . . 7086 1 1389 . 1 1 116 116 ARG HG2 H 1 1.55 0.03 . 1 . . . . . . . . 7086 1 1390 . 1 1 116 116 ARG HG3 H 1 1.55 0.03 . 1 . . . . . . . . 7086 1 1391 . 1 1 116 116 ARG CD C 13 43.1 0.3 . 1 . . . . . . . . 7086 1 1392 . 1 1 116 116 ARG HD2 H 1 3.36 0.03 . 2 . . . . . . . . 7086 1 1393 . 1 1 116 116 ARG HD3 H 1 3.23 0.03 . 2 . . . . . . . . 7086 1 1394 . 1 1 116 116 ARG C C 13 172.9 0.3 . 1 . . . . . . . . 7086 1 1395 . 1 1 117 117 PHE N N 15 115.0 0.3 . 1 . . . . . . . . 7086 1 1396 . 1 1 117 117 PHE H H 1 8.47 0.03 . 1 . . . . . . . . 7086 1 1397 . 1 1 117 117 PHE CA C 13 56.7 0.3 . 1 . . . . . . . . 7086 1 1398 . 1 1 117 117 PHE HA H 1 5.62 0.03 . 1 . . . . . . . . 7086 1 1399 . 1 1 117 117 PHE CB C 13 42.6 0.3 . 1 . . . . . . . . 7086 1 1400 . 1 1 117 117 PHE HB2 H 1 2.77 0.03 . 2 . . . . . . . . 7086 1 1401 . 1 1 117 117 PHE HB3 H 1 2.52 0.03 . 2 . . . . . . . . 7086 1 1402 . 1 1 117 117 PHE HD1 H 1 6.95 0.03 . 1 . . . . . . . . 7086 1 1403 . 1 1 117 117 PHE HD2 H 1 6.95 0.03 . 1 . . . . . . . . 7086 1 1404 . 1 1 117 117 PHE HE1 H 1 7.27 0.03 . 1 . . . . . . . . 7086 1 1405 . 1 1 117 117 PHE HE2 H 1 7.27 0.03 . 1 . . . . . . . . 7086 1 1406 . 1 1 117 117 PHE CD1 C 13 132.1 0.3 . 1 . . . . . . . . 7086 1 1407 . 1 1 117 117 PHE C C 13 176.3 0.3 . 1 . . . . . . . . 7086 1 1408 . 1 1 118 118 VAL N N 15 122.6 0.3 . 1 . . . . . . . . 7086 1 1409 . 1 1 118 118 VAL H H 1 9.26 0.03 . 1 . . . . . . . . 7086 1 1410 . 1 1 118 118 VAL CA C 13 60.2 0.3 . 1 . . . . . . . . 7086 1 1411 . 1 1 118 118 VAL HA H 1 4.39 0.03 . 1 . . . . . . . . 7086 1 1412 . 1 1 118 118 VAL CB C 13 34.5 0.3 . 1 . . . . . . . . 7086 1 1413 . 1 1 118 118 VAL HB H 1 1.89 0.03 . 1 . . . . . . . . 7086 1 1414 . 1 1 118 118 VAL HG11 H 1 0.86 0.03 . 2 . . . . . . . . 7086 1 1415 . 1 1 118 118 VAL HG12 H 1 0.86 0.03 . 2 . . . . . . . . 7086 1 1416 . 1 1 118 118 VAL HG13 H 1 0.86 0.03 . 2 . . . . . . . . 7086 1 1417 . 1 1 118 118 VAL HG21 H 1 0.91 0.03 . 2 . . . . . . . . 7086 1 1418 . 1 1 118 118 VAL HG22 H 1 0.91 0.03 . 2 . . . . . . . . 7086 1 1419 . 1 1 118 118 VAL HG23 H 1 0.91 0.03 . 2 . . . . . . . . 7086 1 1420 . 1 1 118 118 VAL CG1 C 13 21.8 0.3 . 1 . . . . . . . . 7086 1 1421 . 1 1 118 118 VAL CG2 C 13 21.9 0.3 . 1 . . . . . . . . 7086 1 1422 . 1 1 118 118 VAL C C 13 174.9 0.3 . 1 . . . . . . . . 7086 1 1423 . 1 1 119 119 GLU N N 15 127.9 0.3 . 1 . . . . . . . . 7086 1 1424 . 1 1 119 119 GLU H H 1 8.85 0.03 . 1 . . . . . . . . 7086 1 1425 . 1 1 119 119 GLU CA C 13 54.8 0.3 . 1 . . . . . . . . 7086 1 1426 . 1 1 119 119 GLU HA H 1 5.39 0.03 . 1 . . . . . . . . 7086 1 1427 . 1 1 119 119 GLU CB C 13 30.0 0.3 . 1 . . . . . . . . 7086 1 1428 . 1 1 119 119 GLU HB2 H 1 2.04 0.03 . 2 . . . . . . . . 7086 1 1429 . 1 1 119 119 GLU HB3 H 1 1.92 0.03 . 2 . . . . . . . . 7086 1 1430 . 1 1 119 119 GLU CG C 13 36.8 0.3 . 1 . . . . . . . . 7086 1 1431 . 1 1 119 119 GLU HG2 H 1 2.19 0.03 . 2 . . . . . . . . 7086 1 1432 . 1 1 119 119 GLU HG3 H 1 2.06 0.03 . 2 . . . . . . . . 7086 1 1433 . 1 1 119 119 GLU C C 13 176.0 0.3 . 1 . . . . . . . . 7086 1 1434 . 1 1 120 120 THR N N 15 121.3 0.3 . 1 . . . . . . . . 7086 1 1435 . 1 1 120 120 THR H H 1 8.56 0.03 . 1 . . . . . . . . 7086 1 1436 . 1 1 120 120 THR CA C 13 61.0 0.3 . 1 . . . . . . . . 7086 1 1437 . 1 1 120 120 THR HA H 1 4.64 0.03 . 1 . . . . . . . . 7086 1 1438 . 1 1 120 120 THR CB C 13 69.2 0.3 . 1 . . . . . . . . 7086 1 1439 . 1 1 120 120 THR HB H 1 4.10 0.03 . 1 . . . . . . . . 7086 1 1440 . 1 1 120 120 THR HG21 H 1 1.06 0.03 . 1 . . . . . . . . 7086 1 1441 . 1 1 120 120 THR HG22 H 1 1.06 0.03 . 1 . . . . . . . . 7086 1 1442 . 1 1 120 120 THR HG23 H 1 1.06 0.03 . 1 . . . . . . . . 7086 1 1443 . 1 1 120 120 THR CG2 C 13 19.3 0.3 . 1 . . . . . . . . 7086 1 1444 . 1 1 121 121 HIS CA C 13 57.8 0.3 . 1 . . . . . . . . 7086 1 1445 . 1 1 121 121 HIS HA H 1 3.98 0.03 . 1 . . . . . . . . 7086 1 1446 . 1 1 121 121 HIS CB C 13 28.3 0.3 . 1 . . . . . . . . 7086 1 1447 . 1 1 121 121 HIS HB2 H 1 3.34 0.03 . 2 . . . . . . . . 7086 1 1448 . 1 1 121 121 HIS HB3 H 1 2.91 0.03 . 2 . . . . . . . . 7086 1 1449 . 1 1 121 121 HIS C C 13 175.2 0.3 . 1 . . . . . . . . 7086 1 1450 . 1 1 122 122 GLY N N 15 103.8 0.3 . 1 . . . . . . . . 7086 1 1451 . 1 1 122 122 GLY H H 1 8.75 0.03 . 1 . . . . . . . . 7086 1 1452 . 1 1 122 122 GLY CA C 13 45.8 0.3 . 1 . . . . . . . . 7086 1 1453 . 1 1 122 122 GLY HA2 H 1 4.13 0.03 . 2 . . . . . . . . 7086 1 1454 . 1 1 122 122 GLY HA3 H 1 3.67 0.03 . 2 . . . . . . . . 7086 1 1455 . 1 1 122 122 GLY C C 13 174.2 0.3 . 1 . . . . . . . . 7086 1 1456 . 1 1 123 123 MET N N 15 119.9 0.3 . 1 . . . . . . . . 7086 1 1457 . 1 1 123 123 MET H H 1 8.18 0.03 . 1 . . . . . . . . 7086 1 1458 . 1 1 123 123 MET CA C 13 54.8 0.3 . 1 . . . . . . . . 7086 1 1459 . 1 1 123 123 MET HA H 1 4.12 0.03 . 1 . . . . . . . . 7086 1 1460 . 1 1 123 123 MET CB C 13 37.1 0.3 . 1 . . . . . . . . 7086 1 1461 . 1 1 123 123 MET HB2 H 1 1.93 0.03 . 1 . . . . . . . . 7086 1 1462 . 1 1 123 123 MET HB3 H 1 1.93 0.03 . 1 . . . . . . . . 7086 1 1463 . 1 1 123 123 MET CG C 13 32.6 0.3 . 1 . . . . . . . . 7086 1 1464 . 1 1 123 123 MET HG2 H 1 2.28 0.03 . 1 . . . . . . . . 7086 1 1465 . 1 1 123 123 MET HG3 H 1 2.28 0.03 . 1 . . . . . . . . 7086 1 1466 . 1 1 123 123 MET C C 13 174.1 0.3 . 1 . . . . . . . . 7086 1 1467 . 1 1 124 124 LYS N N 15 121.6 0.3 . 1 . . . . . . . . 7086 1 1468 . 1 1 124 124 LYS H H 1 7.17 0.03 . 1 . . . . . . . . 7086 1 1469 . 1 1 124 124 LYS CA C 13 55.2 0.3 . 1 . . . . . . . . 7086 1 1470 . 1 1 124 124 LYS HA H 1 4.64 0.03 . 1 . . . . . . . . 7086 1 1471 . 1 1 124 124 LYS CB C 13 32.7 0.3 . 1 . . . . . . . . 7086 1 1472 . 1 1 124 124 LYS HB2 H 1 1.76 0.03 . 1 . . . . . . . . 7086 1 1473 . 1 1 124 124 LYS HB3 H 1 1.76 0.03 . 1 . . . . . . . . 7086 1 1474 . 1 1 124 124 LYS CG C 13 25.9 0.3 . 1 . . . . . . . . 7086 1 1475 . 1 1 124 124 LYS HG2 H 1 1.25 0.03 . 2 . . . . . . . . 7086 1 1476 . 1 1 124 124 LYS HG3 H 1 1.17 0.03 . 2 . . . . . . . . 7086 1 1477 . 1 1 124 124 LYS CD C 13 29.7 0.3 . 1 . . . . . . . . 7086 1 1478 . 1 1 124 124 LYS HD2 H 1 1.45 0.03 . 1 . . . . . . . . 7086 1 1479 . 1 1 124 124 LYS HD3 H 1 1.45 0.03 . 1 . . . . . . . . 7086 1 1480 . 1 1 124 124 LYS CE C 13 41.8 0.3 . 1 . . . . . . . . 7086 1 1481 . 1 1 124 124 LYS HE2 H 1 2.56 0.03 . 2 . . . . . . . . 7086 1 1482 . 1 1 124 124 LYS HE3 H 1 2.36 0.03 . 2 . . . . . . . . 7086 1 1483 . 1 1 124 124 LYS C C 13 174.1 0.3 . 1 . . . . . . . . 7086 1 1484 . 1 1 125 125 ILE N N 15 127.0 0.3 . 1 . . . . . . . . 7086 1 1485 . 1 1 125 125 ILE H H 1 9.04 0.03 . 1 . . . . . . . . 7086 1 1486 . 1 1 125 125 ILE CA C 13 56.9 0.3 . 1 . . . . . . . . 7086 1 1487 . 1 1 125 125 ILE HA H 1 4.52 0.03 . 1 . . . . . . . . 7086 1 1488 . 1 1 125 125 ILE CB C 13 39.1 0.3 . 1 . . . . . . . . 7086 1 1489 . 1 1 125 125 ILE HB H 1 2.18 0.03 . 1 . . . . . . . . 7086 1 1490 . 1 1 125 125 ILE HG21 H 1 0.83 0.03 . 1 . . . . . . . . 7086 1 1491 . 1 1 125 125 ILE HG22 H 1 0.83 0.03 . 1 . . . . . . . . 7086 1 1492 . 1 1 125 125 ILE HG23 H 1 0.83 0.03 . 1 . . . . . . . . 7086 1 1493 . 1 1 125 125 ILE CG2 C 13 17.4 0.3 . 1 . . . . . . . . 7086 1 1494 . 1 1 125 125 ILE CG1 C 13 27.6 0.3 . 1 . . . . . . . . 7086 1 1495 . 1 1 125 125 ILE HG12 H 1 1.41 0.03 . 1 . . . . . . . . 7086 1 1496 . 1 1 125 125 ILE HG13 H 1 1.41 0.03 . 1 . . . . . . . . 7086 1 1497 . 1 1 125 125 ILE HD11 H 1 0.85 0.03 . 1 . . . . . . . . 7086 1 1498 . 1 1 125 125 ILE HD12 H 1 0.85 0.03 . 1 . . . . . . . . 7086 1 1499 . 1 1 125 125 ILE HD13 H 1 0.85 0.03 . 1 . . . . . . . . 7086 1 1500 . 1 1 125 125 ILE CD1 C 13 12.5 0.3 . 1 . . . . . . . . 7086 1 1501 . 1 1 126 126 PRO CD C 13 51.5 0.3 . 1 . . . . . . . . 7086 1 1502 . 1 1 126 126 PRO CA C 13 61.3 0.3 . 1 . . . . . . . . 7086 1 1503 . 1 1 126 126 PRO HA H 1 4.62 0.03 . 1 . . . . . . . . 7086 1 1504 . 1 1 126 126 PRO CB C 13 32.4 0.3 . 1 . . . . . . . . 7086 1 1505 . 1 1 126 126 PRO HB2 H 1 1.89 0.03 . 1 . . . . . . . . 7086 1 1506 . 1 1 126 126 PRO HB3 H 1 1.89 0.03 . 1 . . . . . . . . 7086 1 1507 . 1 1 126 126 PRO HG2 H 1 2.27 0.03 . 2 . . . . . . . . 7086 1 1508 . 1 1 126 126 PRO HG3 H 1 1.57 0.03 . 2 . . . . . . . . 7086 1 1509 . 1 1 126 126 PRO HD2 H 1 2.87 0.03 . 1 . . . . . . . . 7086 1 1510 . 1 1 126 126 PRO HD3 H 1 2.87 0.03 . 1 . . . . . . . . 7086 1 1511 . 1 1 126 126 PRO C C 13 175.2 0.3 . 1 . . . . . . . . 7086 1 1512 . 1 1 127 127 VAL N N 15 117.1 0.3 . 1 . . . . . . . . 7086 1 1513 . 1 1 127 127 VAL H H 1 8.77 0.03 . 1 . . . . . . . . 7086 1 1514 . 1 1 127 127 VAL CA C 13 58.5 0.3 . 1 . . . . . . . . 7086 1 1515 . 1 1 127 127 VAL HA H 1 5.18 0.03 . 1 . . . . . . . . 7086 1 1516 . 1 1 127 127 VAL CB C 13 35.9 0.3 . 1 . . . . . . . . 7086 1 1517 . 1 1 127 127 VAL HB H 1 2.42 0.03 . 1 . . . . . . . . 7086 1 1518 . 1 1 127 127 VAL HG11 H 1 0.79 0.03 . 2 . . . . . . . . 7086 1 1519 . 1 1 127 127 VAL HG12 H 1 0.79 0.03 . 2 . . . . . . . . 7086 1 1520 . 1 1 127 127 VAL HG13 H 1 0.79 0.03 . 2 . . . . . . . . 7086 1 1521 . 1 1 127 127 VAL HG21 H 1 0.35 0.03 . 2 . . . . . . . . 7086 1 1522 . 1 1 127 127 VAL HG22 H 1 0.35 0.03 . 2 . . . . . . . . 7086 1 1523 . 1 1 127 127 VAL HG23 H 1 0.35 0.03 . 2 . . . . . . . . 7086 1 1524 . 1 1 127 127 VAL CG1 C 13 22.7 0.3 . 1 . . . . . . . . 7086 1 1525 . 1 1 127 127 VAL CG2 C 13 19.8 0.3 . 1 . . . . . . . . 7086 1 1526 . 1 1 127 127 VAL C C 13 173.7 0.3 . 1 . . . . . . . . 7086 1 1527 . 1 1 128 128 LEU N N 15 119.3 0.3 . 1 . . . . . . . . 7086 1 1528 . 1 1 128 128 LEU H H 1 8.13 0.03 . 1 . . . . . . . . 7086 1 1529 . 1 1 128 128 LEU CA C 13 53.1 0.3 . 1 . . . . . . . . 7086 1 1530 . 1 1 128 128 LEU HA H 1 4.82 0.03 . 1 . . . . . . . . 7086 1 1531 . 1 1 128 128 LEU CB C 13 43.9 0.3 . 1 . . . . . . . . 7086 1 1532 . 1 1 128 128 LEU HB2 H 1 1.80 0.03 . 2 . . . . . . . . 7086 1 1533 . 1 1 128 128 LEU HB3 H 1 1.57 0.03 . 2 . . . . . . . . 7086 1 1534 . 1 1 128 128 LEU CG C 13 26.6 0.3 . 1 . . . . . . . . 7086 1 1535 . 1 1 128 128 LEU HG H 1 1.57 0.03 . 1 . . . . . . . . 7086 1 1536 . 1 1 128 128 LEU HD11 H 1 0.78 0.03 . 2 . . . . . . . . 7086 1 1537 . 1 1 128 128 LEU HD12 H 1 0.78 0.03 . 2 . . . . . . . . 7086 1 1538 . 1 1 128 128 LEU HD13 H 1 0.78 0.03 . 2 . . . . . . . . 7086 1 1539 . 1 1 128 128 LEU HD21 H 1 0.72 0.03 . 2 . . . . . . . . 7086 1 1540 . 1 1 128 128 LEU HD22 H 1 0.72 0.03 . 2 . . . . . . . . 7086 1 1541 . 1 1 128 128 LEU HD23 H 1 0.72 0.03 . 2 . . . . . . . . 7086 1 1542 . 1 1 128 128 LEU CD1 C 13 25.0 0.3 . 1 . . . . . . . . 7086 1 1543 . 1 1 128 128 LEU CD2 C 13 25.0 0.3 . 1 . . . . . . . . 7086 1 1544 . 1 1 128 128 LEU C C 13 177.3 0.3 . 1 . . . . . . . . 7086 1 1545 . 1 1 129 129 SER N N 15 115.5 0.3 . 1 . . . . . . . . 7086 1 1546 . 1 1 129 129 SER H H 1 8.26 0.03 . 1 . . . . . . . . 7086 1 1547 . 1 1 129 129 SER CA C 13 57.9 0.3 . 1 . . . . . . . . 7086 1 1548 . 1 1 129 129 SER HA H 1 4.49 0.03 . 1 . . . . . . . . 7086 1 1549 . 1 1 129 129 SER CB C 13 63.9 0.3 . 1 . . . . . . . . 7086 1 1550 . 1 1 129 129 SER HB2 H 1 4.46 0.03 . 2 . . . . . . . . 7086 1 1551 . 1 1 129 129 SER HB3 H 1 4.08 0.03 . 2 . . . . . . . . 7086 1 1552 . 1 1 129 129 SER C C 13 175.6 0.3 . 1 . . . . . . . . 7086 1 1553 . 1 1 130 130 LEU N N 15 126.2 0.3 . 1 . . . . . . . . 7086 1 1554 . 1 1 130 130 LEU H H 1 9.12 0.03 . 1 . . . . . . . . 7086 1 1555 . 1 1 130 130 LEU CA C 13 57.3 0.3 . 1 . . . . . . . . 7086 1 1556 . 1 1 130 130 LEU HA H 1 4.01 0.03 . 1 . . . . . . . . 7086 1 1557 . 1 1 130 130 LEU CB C 13 42.1 0.3 . 1 . . . . . . . . 7086 1 1558 . 1 1 130 130 LEU HB2 H 1 1.96 0.03 . 2 . . . . . . . . 7086 1 1559 . 1 1 130 130 LEU HB3 H 1 1.28 0.03 . 2 . . . . . . . . 7086 1 1560 . 1 1 130 130 LEU CG C 13 27.1 0.3 . 1 . . . . . . . . 7086 1 1561 . 1 1 130 130 LEU HG H 1 1.83 0.03 . 1 . . . . . . . . 7086 1 1562 . 1 1 130 130 LEU HD11 H 1 0.73 0.03 . 2 . . . . . . . . 7086 1 1563 . 1 1 130 130 LEU HD12 H 1 0.73 0.03 . 2 . . . . . . . . 7086 1 1564 . 1 1 130 130 LEU HD13 H 1 0.73 0.03 . 2 . . . . . . . . 7086 1 1565 . 1 1 130 130 LEU HD21 H 1 0.75 0.03 . 2 . . . . . . . . 7086 1 1566 . 1 1 130 130 LEU HD22 H 1 0.75 0.03 . 2 . . . . . . . . 7086 1 1567 . 1 1 130 130 LEU HD23 H 1 0.75 0.03 . 2 . . . . . . . . 7086 1 1568 . 1 1 130 130 LEU CD1 C 13 26.9 0.3 . 1 . . . . . . . . 7086 1 1569 . 1 1 130 130 LEU CD2 C 13 24.4 0.3 . 1 . . . . . . . . 7086 1 1570 . 1 1 130 130 LEU C C 13 179.0 0.3 . 1 . . . . . . . . 7086 1 1571 . 1 1 131 131 GLU N N 15 117.5 0.3 . 1 . . . . . . . . 7086 1 1572 . 1 1 131 131 GLU H H 1 8.74 0.03 . 1 . . . . . . . . 7086 1 1573 . 1 1 131 131 GLU CA C 13 60.3 0.3 . 1 . . . . . . . . 7086 1 1574 . 1 1 131 131 GLU HA H 1 4.02 0.03 . 1 . . . . . . . . 7086 1 1575 . 1 1 131 131 GLU CB C 13 29.3 0.3 . 1 . . . . . . . . 7086 1 1576 . 1 1 131 131 GLU HB2 H 1 2.10 0.03 . 1 . . . . . . . . 7086 1 1577 . 1 1 131 131 GLU HB3 H 1 2.10 0.03 . 1 . . . . . . . . 7086 1 1578 . 1 1 131 131 GLU CG C 13 37.2 0.3 . 1 . . . . . . . . 7086 1 1579 . 1 1 131 131 GLU HG2 H 1 2.50 0.03 . 2 . . . . . . . . 7086 1 1580 . 1 1 131 131 GLU HG3 H 1 2.38 0.03 . 2 . . . . . . . . 7086 1 1581 . 1 1 131 131 GLU C C 13 179.1 0.3 . 1 . . . . . . . . 7086 1 1582 . 1 1 132 132 TYR N N 15 120.2 0.3 . 1 . . . . . . . . 7086 1 1583 . 1 1 132 132 TYR H H 1 7.60 0.03 . 1 . . . . . . . . 7086 1 1584 . 1 1 132 132 TYR CA C 13 61.5 0.3 . 1 . . . . . . . . 7086 1 1585 . 1 1 132 132 TYR HA H 1 3.95 0.03 . 1 . . . . . . . . 7086 1 1586 . 1 1 132 132 TYR CB C 13 38.1 0.3 . 1 . . . . . . . . 7086 1 1587 . 1 1 132 132 TYR HB2 H 1 3.05 0.03 . 2 . . . . . . . . 7086 1 1588 . 1 1 132 132 TYR HB3 H 1 2.70 0.03 . 2 . . . . . . . . 7086 1 1589 . 1 1 132 132 TYR HD1 H 1 6.35 0.03 . 1 . . . . . . . . 7086 1 1590 . 1 1 132 132 TYR HD2 H 1 6.35 0.03 . 1 . . . . . . . . 7086 1 1591 . 1 1 132 132 TYR HE1 H 1 6.47 0.03 . 1 . . . . . . . . 7086 1 1592 . 1 1 132 132 TYR HE2 H 1 6.47 0.03 . 1 . . . . . . . . 7086 1 1593 . 1 1 132 132 TYR CD1 C 13 132.7 0.3 . 1 . . . . . . . . 7086 1 1594 . 1 1 132 132 TYR C C 13 177.5 0.3 . 1 . . . . . . . . 7086 1 1595 . 1 1 133 133 GLU N N 15 119.0 0.3 . 1 . . . . . . . . 7086 1 1596 . 1 1 133 133 GLU H H 1 8.29 0.03 . 1 . . . . . . . . 7086 1 1597 . 1 1 133 133 GLU CA C 13 59.8 0.3 . 1 . . . . . . . . 7086 1 1598 . 1 1 133 133 GLU HA H 1 4.21 0.03 . 1 . . . . . . . . 7086 1 1599 . 1 1 133 133 GLU CB C 13 29.2 0.3 . 1 . . . . . . . . 7086 1 1600 . 1 1 133 133 GLU HB2 H 1 2.26 0.03 . 1 . . . . . . . . 7086 1 1601 . 1 1 133 133 GLU HB3 H 1 2.26 0.03 . 1 . . . . . . . . 7086 1 1602 . 1 1 133 133 GLU CG C 13 36.5 0.3 . 1 . . . . . . . . 7086 1 1603 . 1 1 133 133 GLU HG2 H 1 2.41 0.03 . 1 . . . . . . . . 7086 1 1604 . 1 1 133 133 GLU HG3 H 1 2.41 0.03 . 1 . . . . . . . . 7086 1 1605 . 1 1 133 133 GLU C C 13 178.3 0.3 . 1 . . . . . . . . 7086 1 1606 . 1 1 134 134 TYR N N 15 118.2 0.3 . 1 . . . . . . . . 7086 1 1607 . 1 1 134 134 TYR H H 1 8.46 0.03 . 1 . . . . . . . . 7086 1 1608 . 1 1 134 134 TYR CA C 13 61.4 0.3 . 1 . . . . . . . . 7086 1 1609 . 1 1 134 134 TYR HA H 1 4.03 0.03 . 1 . . . . . . . . 7086 1 1610 . 1 1 134 134 TYR CB C 13 38.1 0.3 . 1 . . . . . . . . 7086 1 1611 . 1 1 134 134 TYR HB2 H 1 3.03 0.03 . 1 . . . . . . . . 7086 1 1612 . 1 1 134 134 TYR HB3 H 1 3.03 0.03 . 1 . . . . . . . . 7086 1 1613 . 1 1 134 134 TYR HD1 H 1 7.19 0.03 . 1 . . . . . . . . 7086 1 1614 . 1 1 134 134 TYR HD2 H 1 7.19 0.03 . 1 . . . . . . . . 7086 1 1615 . 1 1 134 134 TYR HE1 H 1 6.75 0.03 . 1 . . . . . . . . 7086 1 1616 . 1 1 134 134 TYR HE2 H 1 6.75 0.03 . 1 . . . . . . . . 7086 1 1617 . 1 1 134 134 TYR CD1 C 13 133.3 0.3 . 1 . . . . . . . . 7086 1 1618 . 1 1 134 134 TYR C C 13 175.8 0.3 . 1 . . . . . . . . 7086 1 1619 . 1 1 135 135 GLN N N 15 116.2 0.3 . 1 . . . . . . . . 7086 1 1620 . 1 1 135 135 GLN H H 1 7.17 0.03 . 1 . . . . . . . . 7086 1 1621 . 1 1 135 135 GLN CA C 13 58.0 0.3 . 1 . . . . . . . . 7086 1 1622 . 1 1 135 135 GLN HA H 1 3.50 0.03 . 1 . . . . . . . . 7086 1 1623 . 1 1 135 135 GLN CB C 13 27.6 0.3 . 1 . . . . . . . . 7086 1 1624 . 1 1 135 135 GLN HB2 H 1 1.96 0.03 . 1 . . . . . . . . 7086 1 1625 . 1 1 135 135 GLN HB3 H 1 1.96 0.03 . 1 . . . . . . . . 7086 1 1626 . 1 1 135 135 GLN CG C 13 33.5 0.3 . 1 . . . . . . . . 7086 1 1627 . 1 1 135 135 GLN HG2 H 1 2.58 0.03 . 2 . . . . . . . . 7086 1 1628 . 1 1 135 135 GLN HG3 H 1 2.44 0.03 . 2 . . . . . . . . 7086 1 1629 . 1 1 135 135 GLN NE2 N 15 111.9 0.3 . 1 . . . . . . . . 7086 1 1630 . 1 1 135 135 GLN HE21 H 1 7.40 0.03 . 2 . . . . . . . . 7086 1 1631 . 1 1 135 135 GLN HE22 H 1 6.87 0.03 . 2 . . . . . . . . 7086 1 1632 . 1 1 135 135 GLN C C 13 178.9 0.3 . 1 . . . . . . . . 7086 1 1633 . 1 1 136 136 ALA N N 15 123.7 0.3 . 1 . . . . . . . . 7086 1 1634 . 1 1 136 136 ALA H H 1 8.40 0.03 . 1 . . . . . . . . 7086 1 1635 . 1 1 136 136 ALA CA C 13 55.0 0.3 . 1 . . . . . . . . 7086 1 1636 . 1 1 136 136 ALA HA H 1 3.78 0.03 . 1 . . . . . . . . 7086 1 1637 . 1 1 136 136 ALA HB1 H 1 1.11 0.03 . 1 . . . . . . . . 7086 1 1638 . 1 1 136 136 ALA HB2 H 1 1.11 0.03 . 1 . . . . . . . . 7086 1 1639 . 1 1 136 136 ALA HB3 H 1 1.11 0.03 . 1 . . . . . . . . 7086 1 1640 . 1 1 136 136 ALA CB C 13 17.9 0.3 . 1 . . . . . . . . 7086 1 1641 . 1 1 136 136 ALA C C 13 180.0 0.3 . 1 . . . . . . . . 7086 1 1642 . 1 1 137 137 TYR N N 15 117.9 0.3 . 1 . . . . . . . . 7086 1 1643 . 1 1 137 137 TYR H H 1 8.67 0.03 . 1 . . . . . . . . 7086 1 1644 . 1 1 137 137 TYR CA C 13 60.7 0.3 . 1 . . . . . . . . 7086 1 1645 . 1 1 137 137 TYR HA H 1 4.14 0.03 . 1 . . . . . . . . 7086 1 1646 . 1 1 137 137 TYR CB C 13 37.1 0.3 . 1 . . . . . . . . 7086 1 1647 . 1 1 137 137 TYR HB2 H 1 3.17 0.03 . 2 . . . . . . . . 7086 1 1648 . 1 1 137 137 TYR HB3 H 1 3.08 0.03 . 2 . . . . . . . . 7086 1 1649 . 1 1 137 137 TYR HD1 H 1 7.11 0.03 . 1 . . . . . . . . 7086 1 1650 . 1 1 137 137 TYR HD2 H 1 7.11 0.03 . 1 . . . . . . . . 7086 1 1651 . 1 1 137 137 TYR HE1 H 1 6.97 0.03 . 1 . . . . . . . . 7086 1 1652 . 1 1 137 137 TYR HE2 H 1 6.97 0.03 . 1 . . . . . . . . 7086 1 1653 . 1 1 137 137 TYR CD1 C 13 131.8 0.3 . 1 . . . . . . . . 7086 1 1654 . 1 1 137 137 TYR CE1 C 13 119.0 0.3 . 1 . . . . . . . . 7086 1 1655 . 1 1 137 137 TYR C C 13 179.1 0.3 . 1 . . . . . . . . 7086 1 1656 . 1 1 138 138 LEU N N 15 119.6 0.3 . 1 . . . . . . . . 7086 1 1657 . 1 1 138 138 LEU H H 1 7.86 0.03 . 1 . . . . . . . . 7086 1 1658 . 1 1 138 138 LEU CA C 13 57.8 0.3 . 1 . . . . . . . . 7086 1 1659 . 1 1 138 138 LEU HA H 1 3.80 0.03 . 1 . . . . . . . . 7086 1 1660 . 1 1 138 138 LEU CB C 13 41.7 0.3 . 1 . . . . . . . . 7086 1 1661 . 1 1 138 138 LEU HB2 H 1 1.56 0.03 . 2 . . . . . . . . 7086 1 1662 . 1 1 138 138 LEU HB3 H 1 1.36 0.03 . 2 . . . . . . . . 7086 1 1663 . 1 1 138 138 LEU CG C 13 26.6 0.3 . 1 . . . . . . . . 7086 1 1664 . 1 1 138 138 LEU HG H 1 1.30 0.03 . 1 . . . . . . . . 7086 1 1665 . 1 1 138 138 LEU HD11 H 1 0.60 0.03 . 2 . . . . . . . . 7086 1 1666 . 1 1 138 138 LEU HD12 H 1 0.60 0.03 . 2 . . . . . . . . 7086 1 1667 . 1 1 138 138 LEU HD13 H 1 0.60 0.03 . 2 . . . . . . . . 7086 1 1668 . 1 1 138 138 LEU HD21 H 1 0.70 0.03 . 2 . . . . . . . . 7086 1 1669 . 1 1 138 138 LEU HD22 H 1 0.70 0.03 . 2 . . . . . . . . 7086 1 1670 . 1 1 138 138 LEU HD23 H 1 0.70 0.03 . 2 . . . . . . . . 7086 1 1671 . 1 1 138 138 LEU CD1 C 13 24.8 0.3 . 1 . . . . . . . . 7086 1 1672 . 1 1 138 138 LEU CD2 C 13 23.7 0.3 . 1 . . . . . . . . 7086 1 1673 . 1 1 138 138 LEU C C 13 181.1 0.3 . 1 . . . . . . . . 7086 1 1674 . 1 1 139 139 LYS N N 15 120.7 0.3 . 1 . . . . . . . . 7086 1 1675 . 1 1 139 139 LYS H H 1 7.97 0.03 . 1 . . . . . . . . 7086 1 1676 . 1 1 139 139 LYS CA C 13 58.8 0.3 . 1 . . . . . . . . 7086 1 1677 . 1 1 139 139 LYS HA H 1 4.02 0.03 . 1 . . . . . . . . 7086 1 1678 . 1 1 139 139 LYS CB C 13 32.2 0.3 . 1 . . . . . . . . 7086 1 1679 . 1 1 139 139 LYS HB2 H 1 1.88 0.03 . 1 . . . . . . . . 7086 1 1680 . 1 1 139 139 LYS HB3 H 1 1.88 0.03 . 1 . . . . . . . . 7086 1 1681 . 1 1 139 139 LYS CG C 13 25.9 0.3 . 1 . . . . . . . . 7086 1 1682 . 1 1 139 139 LYS HG2 H 1 1.57 0.03 . 2 . . . . . . . . 7086 1 1683 . 1 1 139 139 LYS HG3 H 1 1.43 0.03 . 2 . . . . . . . . 7086 1 1684 . 1 1 139 139 LYS CD C 13 29.4 0.3 . 1 . . . . . . . . 7086 1 1685 . 1 1 139 139 LYS HD2 H 1 1.67 0.03 . 1 . . . . . . . . 7086 1 1686 . 1 1 139 139 LYS HD3 H 1 1.67 0.03 . 1 . . . . . . . . 7086 1 1687 . 1 1 139 139 LYS CE C 13 41.7 0.3 . 1 . . . . . . . . 7086 1 1688 . 1 1 139 139 LYS HE2 H 1 2.93 0.03 . 1 . . . . . . . . 7086 1 1689 . 1 1 139 139 LYS HE3 H 1 2.93 0.03 . 1 . . . . . . . . 7086 1 1690 . 1 1 139 139 LYS C C 13 178.4 0.3 . 1 . . . . . . . . 7086 1 1691 . 1 1 140 140 LEU N N 15 116.9 0.3 . 1 . . . . . . . . 7086 1 1692 . 1 1 140 140 LEU H H 1 7.75 0.03 . 1 . . . . . . . . 7086 1 1693 . 1 1 140 140 LEU CA C 13 54.8 0.3 . 1 . . . . . . . . 7086 1 1694 . 1 1 140 140 LEU HA H 1 4.29 0.03 . 1 . . . . . . . . 7086 1 1695 . 1 1 140 140 LEU CB C 13 43.1 0.3 . 1 . . . . . . . . 7086 1 1696 . 1 1 140 140 LEU HB2 H 1 1.64 0.03 . 1 . . . . . . . . 7086 1 1697 . 1 1 140 140 LEU HB3 H 1 1.64 0.03 . 1 . . . . . . . . 7086 1 1698 . 1 1 140 140 LEU CG C 13 27.6 0.3 . 1 . . . . . . . . 7086 1 1699 . 1 1 140 140 LEU HG H 1 1.52 0.03 . 1 . . . . . . . . 7086 1 1700 . 1 1 140 140 LEU HD11 H 1 0.77 0.03 . 2 . . . . . . . . 7086 1 1701 . 1 1 140 140 LEU HD12 H 1 0.77 0.03 . 2 . . . . . . . . 7086 1 1702 . 1 1 140 140 LEU HD13 H 1 0.77 0.03 . 2 . . . . . . . . 7086 1 1703 . 1 1 140 140 LEU HD21 H 1 0.84 0.03 . 2 . . . . . . . . 7086 1 1704 . 1 1 140 140 LEU HD22 H 1 0.84 0.03 . 2 . . . . . . . . 7086 1 1705 . 1 1 140 140 LEU HD23 H 1 0.84 0.03 . 2 . . . . . . . . 7086 1 1706 . 1 1 140 140 LEU CD1 C 13 25.6 0.3 . 1 . . . . . . . . 7086 1 1707 . 1 1 140 140 LEU CD2 C 13 23.5 0.3 . 1 . . . . . . . . 7086 1 1708 . 1 1 140 140 LEU C C 13 177.0 0.3 . 1 . . . . . . . . 7086 1 1709 . 1 1 141 141 GLY N N 15 107.9 0.3 . 1 . . . . . . . . 7086 1 1710 . 1 1 141 141 GLY H H 1 7.82 0.03 . 1 . . . . . . . . 7086 1 1711 . 1 1 141 141 GLY CA C 13 46.0 0.3 . 1 . . . . . . . . 7086 1 1712 . 1 1 141 141 GLY HA2 H 1 4.18 0.03 . 2 . . . . . . . . 7086 1 1713 . 1 1 141 141 GLY HA3 H 1 3.81 0.03 . 2 . . . . . . . . 7086 1 1714 . 1 1 141 141 GLY C C 13 175.6 0.3 . 1 . . . . . . . . 7086 1 1715 . 1 1 142 142 ARG N N 15 123.5 0.3 . 1 . . . . . . . . 7086 1 1716 . 1 1 142 142 ARG H H 1 8.29 0.03 . 1 . . . . . . . . 7086 1 1717 . 1 1 142 142 ARG CA C 13 54.0 0.3 . 1 . . . . . . . . 7086 1 1718 . 1 1 142 142 ARG HA H 1 4.69 0.03 . 1 . . . . . . . . 7086 1 1719 . 1 1 142 142 ARG CB C 13 27.9 0.3 . 1 . . . . . . . . 7086 1 1720 . 1 1 142 142 ARG HB2 H 1 1.93 0.03 . 2 . . . . . . . . 7086 1 1721 . 1 1 142 142 ARG HB3 H 1 1.75 0.03 . 2 . . . . . . . . 7086 1 1722 . 1 1 142 142 ARG CG C 13 26.8 0.3 . 1 . . . . . . . . 7086 1 1723 . 1 1 142 142 ARG HG2 H 1 1.59 0.03 . 1 . . . . . . . . 7086 1 1724 . 1 1 142 142 ARG HG3 H 1 1.59 0.03 . 1 . . . . . . . . 7086 1 1725 . 1 1 142 142 ARG CD C 13 43.6 0.3 . 1 . . . . . . . . 7086 1 1726 . 1 1 142 142 ARG HD2 H 1 2.99 0.03 . 2 . . . . . . . . 7086 1 1727 . 1 1 142 142 ARG HD3 H 1 2.81 0.03 . 2 . . . . . . . . 7086 1 1728 . 1 1 142 142 ARG C C 13 176.7 0.3 . 1 . . . . . . . . 7086 1 1729 . 1 1 143 143 VAL N N 15 118.1 0.3 . 1 . . . . . . . . 7086 1 1730 . 1 1 143 143 VAL H H 1 7.52 0.03 . 1 . . . . . . . . 7086 1 1731 . 1 1 143 143 VAL CA C 13 66.2 0.3 . 1 . . . . . . . . 7086 1 1732 . 1 1 143 143 VAL HA H 1 3.53 0.03 . 1 . . . . . . . . 7086 1 1733 . 1 1 143 143 VAL CB C 13 31.9 0.3 . 1 . . . . . . . . 7086 1 1734 . 1 1 143 143 VAL HB H 1 2.11 0.03 . 1 . . . . . . . . 7086 1 1735 . 1 1 143 143 VAL HG11 H 1 0.97 0.03 . 2 . . . . . . . . 7086 1 1736 . 1 1 143 143 VAL HG12 H 1 0.97 0.03 . 2 . . . . . . . . 7086 1 1737 . 1 1 143 143 VAL HG13 H 1 0.97 0.03 . 2 . . . . . . . . 7086 1 1738 . 1 1 143 143 VAL HG21 H 1 1.01 0.03 . 2 . . . . . . . . 7086 1 1739 . 1 1 143 143 VAL HG22 H 1 1.01 0.03 . 2 . . . . . . . . 7086 1 1740 . 1 1 143 143 VAL HG23 H 1 1.01 0.03 . 2 . . . . . . . . 7086 1 1741 . 1 1 143 143 VAL CG1 C 13 21.9 0.3 . 1 . . . . . . . . 7086 1 1742 . 1 1 143 143 VAL CG2 C 13 21.1 0.3 . 1 . . . . . . . . 7086 1 1743 . 1 1 143 143 VAL C C 13 177.8 0.3 . 1 . . . . . . . . 7086 1 1744 . 1 1 144 144 GLU H H 1 8.74 0.03 . 1 . . . . . . . . 7086 1 1745 . 1 1 144 144 GLU CA C 13 59.5 0.3 . 1 . . . . . . . . 7086 1 1746 . 1 1 144 144 GLU HA H 1 4.18 0.03 . 1 . . . . . . . . 7086 1 1747 . 1 1 144 144 GLU CB C 13 28.8 0.3 . 1 . . . . . . . . 7086 1 1748 . 1 1 144 144 GLU HB2 H 1 2.13 0.03 . 1 . . . . . . . . 7086 1 1749 . 1 1 144 144 GLU HB3 H 1 2.13 0.03 . 1 . . . . . . . . 7086 1 1750 . 1 1 144 144 GLU CG C 13 36.7 0.3 . 1 . . . . . . . . 7086 1 1751 . 1 1 144 144 GLU HG2 H 1 2.34 0.03 . 1 . . . . . . . . 7086 1 1752 . 1 1 144 144 GLU HG3 H 1 2.34 0.03 . 1 . . . . . . . . 7086 1 1753 . 1 1 144 144 GLU C C 13 179.8 0.3 . 1 . . . . . . . . 7086 1 1754 . 1 1 145 145 LYS N N 15 120.0 0.3 . 1 . . . . . . . . 7086 1 1755 . 1 1 145 145 LYS H H 1 7.94 0.03 . 1 . . . . . . . . 7086 1 1756 . 1 1 145 145 LYS CA C 13 58.1 0.3 . 1 . . . . . . . . 7086 1 1757 . 1 1 145 145 LYS HA H 1 4.06 0.03 . 1 . . . . . . . . 7086 1 1758 . 1 1 145 145 LYS CB C 13 32.4 0.3 . 1 . . . . . . . . 7086 1 1759 . 1 1 145 145 LYS HB2 H 1 1.54 0.03 . 2 . . . . . . . . 7086 1 1760 . 1 1 145 145 LYS HB3 H 1 1.33 0.03 . 2 . . . . . . . . 7086 1 1761 . 1 1 145 145 LYS CG C 13 26.4 0.3 . 1 . . . . . . . . 7086 1 1762 . 1 1 145 145 LYS HG2 H 1 1.50 0.03 . 2 . . . . . . . . 7086 1 1763 . 1 1 145 145 LYS HG3 H 1 1.41 0.03 . 2 . . . . . . . . 7086 1 1764 . 1 1 145 145 LYS HD2 H 1 1.55 0.03 . 1 . . . . . . . . 7086 1 1765 . 1 1 145 145 LYS HD3 H 1 1.55 0.03 . 1 . . . . . . . . 7086 1 1766 . 1 1 145 145 LYS CE C 13 42.2 0.3 . 1 . . . . . . . . 7086 1 1767 . 1 1 145 145 LYS HE2 H 1 3.00 0.03 . 1 . . . . . . . . 7086 1 1768 . 1 1 145 145 LYS HE3 H 1 3.00 0.03 . 1 . . . . . . . . 7086 1 1769 . 1 1 145 145 LYS C C 13 178.9 0.3 . 1 . . . . . . . . 7086 1 1770 . 1 1 146 146 ALA N N 15 120.0 0.3 . 1 . . . . . . . . 7086 1 1771 . 1 1 146 146 ALA H H 1 8.21 0.03 . 1 . . . . . . . . 7086 1 1772 . 1 1 146 146 ALA CA C 13 55.5 0.3 . 1 . . . . . . . . 7086 1 1773 . 1 1 146 146 ALA HA H 1 4.13 0.03 . 1 . . . . . . . . 7086 1 1774 . 1 1 146 146 ALA HB1 H 1 1.52 0.03 . 1 . . . . . . . . 7086 1 1775 . 1 1 146 146 ALA HB2 H 1 1.52 0.03 . 1 . . . . . . . . 7086 1 1776 . 1 1 146 146 ALA HB3 H 1 1.52 0.03 . 1 . . . . . . . . 7086 1 1777 . 1 1 146 146 ALA CB C 13 18.5 0.3 . 1 . . . . . . . . 7086 1 1778 . 1 1 146 146 ALA C C 13 179.1 0.3 . 1 . . . . . . . . 7086 1 1779 . 1 1 147 147 GLU N N 15 118.1 0.3 . 1 . . . . . . . . 7086 1 1780 . 1 1 147 147 GLU H H 1 8.31 0.03 . 1 . . . . . . . . 7086 1 1781 . 1 1 147 147 GLU CA C 13 58.9 0.3 . 1 . . . . . . . . 7086 1 1782 . 1 1 147 147 GLU HA H 1 4.31 0.03 . 1 . . . . . . . . 7086 1 1783 . 1 1 147 147 GLU CB C 13 29.1 0.3 . 1 . . . . . . . . 7086 1 1784 . 1 1 147 147 GLU HB2 H 1 2.26 0.03 . 2 . . . . . . . . 7086 1 1785 . 1 1 147 147 GLU HB3 H 1 2.11 0.03 . 2 . . . . . . . . 7086 1 1786 . 1 1 147 147 GLU CG C 13 36.1 0.3 . 1 . . . . . . . . 7086 1 1787 . 1 1 147 147 GLU HG2 H 1 2.43 0.03 . 2 . . . . . . . . 7086 1 1788 . 1 1 147 147 GLU HG3 H 1 2.37 0.03 . 2 . . . . . . . . 7086 1 1789 . 1 1 147 147 GLU C C 13 178.7 0.3 . 1 . . . . . . . . 7086 1 1790 . 1 1 148 148 THR N N 15 116.4 0.3 . 1 . . . . . . . . 7086 1 1791 . 1 1 148 148 THR H H 1 7.78 0.03 . 1 . . . . . . . . 7086 1 1792 . 1 1 148 148 THR CA C 13 66.3 0.3 . 1 . . . . . . . . 7086 1 1793 . 1 1 148 148 THR HA H 1 3.90 0.03 . 1 . . . . . . . . 7086 1 1794 . 1 1 148 148 THR CB C 13 68.5 0.3 . 1 . . . . . . . . 7086 1 1795 . 1 1 148 148 THR HB H 1 4.23 0.03 . 1 . . . . . . . . 7086 1 1796 . 1 1 148 148 THR HG21 H 1 1.10 0.03 . 1 . . . . . . . . 7086 1 1797 . 1 1 148 148 THR HG22 H 1 1.10 0.03 . 1 . . . . . . . . 7086 1 1798 . 1 1 148 148 THR HG23 H 1 1.10 0.03 . 1 . . . . . . . . 7086 1 1799 . 1 1 148 148 THR CG2 C 13 21.6 0.3 . 1 . . . . . . . . 7086 1 1800 . 1 1 148 148 THR C C 13 176.6 0.3 . 1 . . . . . . . . 7086 1 1801 . 1 1 149 149 LEU N N 15 120.4 0.3 . 1 . . . . . . . . 7086 1 1802 . 1 1 149 149 LEU H H 1 7.48 0.03 . 1 . . . . . . . . 7086 1 1803 . 1 1 149 149 LEU CA C 13 57.4 0.3 . 1 . . . . . . . . 7086 1 1804 . 1 1 149 149 LEU HA H 1 4.00 0.03 . 1 . . . . . . . . 7086 1 1805 . 1 1 149 149 LEU CB C 13 42.2 0.3 . 1 . . . . . . . . 7086 1 1806 . 1 1 149 149 LEU HB2 H 1 1.95 0.03 . 2 . . . . . . . . 7086 1 1807 . 1 1 149 149 LEU HB3 H 1 1.33 0.03 . 2 . . . . . . . . 7086 1 1808 . 1 1 149 149 LEU CG C 13 26.8 0.3 . 1 . . . . . . . . 7086 1 1809 . 1 1 149 149 LEU HG H 1 1.41 0.03 . 1 . . . . . . . . 7086 1 1810 . 1 1 149 149 LEU HD11 H 1 0.46 0.03 . 2 . . . . . . . . 7086 1 1811 . 1 1 149 149 LEU HD12 H 1 0.46 0.03 . 2 . . . . . . . . 7086 1 1812 . 1 1 149 149 LEU HD13 H 1 0.46 0.03 . 2 . . . . . . . . 7086 1 1813 . 1 1 149 149 LEU HD21 H 1 0.13 0.03 . 2 . . . . . . . . 7086 1 1814 . 1 1 149 149 LEU HD22 H 1 0.13 0.03 . 2 . . . . . . . . 7086 1 1815 . 1 1 149 149 LEU HD23 H 1 0.13 0.03 . 2 . . . . . . . . 7086 1 1816 . 1 1 149 149 LEU CD1 C 13 24.9 0.3 . 1 . . . . . . . . 7086 1 1817 . 1 1 149 149 LEU CD2 C 13 23.1 0.3 . 1 . . . . . . . . 7086 1 1818 . 1 1 149 149 LEU C C 13 177.6 0.3 . 1 . . . . . . . . 7086 1 1819 . 1 1 150 150 ARG N N 15 120.5 0.3 . 1 . . . . . . . . 7086 1 1820 . 1 1 150 150 ARG H H 1 8.70 0.03 . 1 . . . . . . . . 7086 1 1821 . 1 1 150 150 ARG CA C 13 59.3 0.3 . 1 . . . . . . . . 7086 1 1822 . 1 1 150 150 ARG HA H 1 3.31 0.03 . 1 . . . . . . . . 7086 1 1823 . 1 1 150 150 ARG CB C 13 30.4 0.3 . 1 . . . . . . . . 7086 1 1824 . 1 1 150 150 ARG HB2 H 1 1.91 0.03 . 1 . . . . . . . . 7086 1 1825 . 1 1 150 150 ARG HB3 H 1 1.91 0.03 . 1 . . . . . . . . 7086 1 1826 . 1 1 150 150 ARG CG C 13 26.3 0.3 . 1 . . . . . . . . 7086 1 1827 . 1 1 150 150 ARG HG2 H 1 1.37 0.03 . 2 . . . . . . . . 7086 1 1828 . 1 1 150 150 ARG HG3 H 1 1.32 0.03 . 2 . . . . . . . . 7086 1 1829 . 1 1 150 150 ARG CD C 13 43.1 0.3 . 1 . . . . . . . . 7086 1 1830 . 1 1 150 150 ARG HD2 H 1 3.11 0.03 . 1 . . . . . . . . 7086 1 1831 . 1 1 150 150 ARG HD3 H 1 3.11 0.03 . 1 . . . . . . . . 7086 1 1832 . 1 1 150 150 ARG C C 13 178.7 0.3 . 1 . . . . . . . . 7086 1 1833 . 1 1 151 151 LYS N N 15 117.1 0.3 . 1 . . . . . . . . 7086 1 1834 . 1 1 151 151 LYS H H 1 8.10 0.03 . 1 . . . . . . . . 7086 1 1835 . 1 1 151 151 LYS CA C 13 59.4 0.3 . 1 . . . . . . . . 7086 1 1836 . 1 1 151 151 LYS HA H 1 3.90 0.03 . 1 . . . . . . . . 7086 1 1837 . 1 1 151 151 LYS CB C 13 32.5 0.3 . 1 . . . . . . . . 7086 1 1838 . 1 1 151 151 LYS HB2 H 1 1.86 0.03 . 1 . . . . . . . . 7086 1 1839 . 1 1 151 151 LYS HB3 H 1 1.86 0.03 . 1 . . . . . . . . 7086 1 1840 . 1 1 151 151 LYS CG C 13 26.0 0.3 . 1 . . . . . . . . 7086 1 1841 . 1 1 151 151 LYS HG2 H 1 1.56 0.03 . 2 . . . . . . . . 7086 1 1842 . 1 1 151 151 LYS HG3 H 1 1.36 0.03 . 2 . . . . . . . . 7086 1 1843 . 1 1 151 151 LYS CD C 13 29.5 0.3 . 1 . . . . . . . . 7086 1 1844 . 1 1 151 151 LYS HD2 H 1 1.70 0.03 . 1 . . . . . . . . 7086 1 1845 . 1 1 151 151 LYS HD3 H 1 1.70 0.03 . 1 . . . . . . . . 7086 1 1846 . 1 1 151 151 LYS CE C 13 42.1 0.3 . 1 . . . . . . . . 7086 1 1847 . 1 1 151 151 LYS HE2 H 1 2.99 0.03 . 1 . . . . . . . . 7086 1 1848 . 1 1 151 151 LYS HE3 H 1 2.99 0.03 . 1 . . . . . . . . 7086 1 1849 . 1 1 151 151 LYS C C 13 178.6 0.3 . 1 . . . . . . . . 7086 1 1850 . 1 1 152 152 TRP N N 15 119.9 0.3 . 1 . . . . . . . . 7086 1 1851 . 1 1 152 152 TRP H H 1 7.54 0.03 . 1 . . . . . . . . 7086 1 1852 . 1 1 152 152 TRP CA C 13 60.3 0.3 . 1 . . . . . . . . 7086 1 1853 . 1 1 152 152 TRP HA H 1 4.26 0.03 . 1 . . . . . . . . 7086 1 1854 . 1 1 152 152 TRP CB C 13 29.4 0.3 . 1 . . . . . . . . 7086 1 1855 . 1 1 152 152 TRP HB2 H 1 3.29 0.03 . 1 . . . . . . . . 7086 1 1856 . 1 1 152 152 TRP HB3 H 1 3.29 0.03 . 1 . . . . . . . . 7086 1 1857 . 1 1 152 152 TRP CD1 C 13 126.2 0.3 . 1 . . . . . . . . 7086 1 1858 . 1 1 152 152 TRP NE1 N 15 128.6 0.3 . 1 . . . . . . . . 7086 1 1859 . 1 1 152 152 TRP HD1 H 1 7.07 0.03 . 1 . . . . . . . . 7086 1 1860 . 1 1 152 152 TRP CZ2 C 13 114.7 0.3 . 1 . . . . . . . . 7086 1 1861 . 1 1 152 152 TRP HE1 H 1 9.95 0.03 . 1 . . . . . . . . 7086 1 1862 . 1 1 152 152 TRP HZ2 H 1 7.39 0.03 . 1 . . . . . . . . 7086 1 1863 . 1 1 152 152 TRP C C 13 178.6 0.3 . 1 . . . . . . . . 7086 1 1864 . 1 1 153 153 LEU N N 15 118.5 0.3 . 1 . . . . . . . . 7086 1 1865 . 1 1 153 153 LEU H H 1 8.72 0.03 . 1 . . . . . . . . 7086 1 1866 . 1 1 153 153 LEU CA C 13 57.2 0.3 . 1 . . . . . . . . 7086 1 1867 . 1 1 153 153 LEU HA H 1 3.85 0.03 . 1 . . . . . . . . 7086 1 1868 . 1 1 153 153 LEU CB C 13 42.0 0.3 . 1 . . . . . . . . 7086 1 1869 . 1 1 153 153 LEU HB2 H 1 1.76 0.03 . 2 . . . . . . . . 7086 1 1870 . 1 1 153 153 LEU HB3 H 1 1.34 0.03 . 2 . . . . . . . . 7086 1 1871 . 1 1 153 153 LEU CG C 13 27.6 0.3 . 1 . . . . . . . . 7086 1 1872 . 1 1 153 153 LEU HG H 1 1.84 0.03 . 1 . . . . . . . . 7086 1 1873 . 1 1 153 153 LEU HD11 H 1 0.57 0.03 . 2 . . . . . . . . 7086 1 1874 . 1 1 153 153 LEU HD12 H 1 0.57 0.03 . 2 . . . . . . . . 7086 1 1875 . 1 1 153 153 LEU HD13 H 1 0.57 0.03 . 2 . . . . . . . . 7086 1 1876 . 1 1 153 153 LEU HD21 H 1 0.95 0.03 . 2 . . . . . . . . 7086 1 1877 . 1 1 153 153 LEU HD22 H 1 0.95 0.03 . 2 . . . . . . . . 7086 1 1878 . 1 1 153 153 LEU HD23 H 1 0.95 0.03 . 2 . . . . . . . . 7086 1 1879 . 1 1 153 153 LEU CD1 C 13 25.5 0.3 . 1 . . . . . . . . 7086 1 1880 . 1 1 153 153 LEU CD2 C 13 23.5 0.3 . 1 . . . . . . . . 7086 1 1881 . 1 1 153 153 LEU C C 13 179.6 0.3 . 1 . . . . . . . . 7086 1 1882 . 1 1 154 154 ASN N N 15 117.0 0.3 . 1 . . . . . . . . 7086 1 1883 . 1 1 154 154 ASN H H 1 8.21 0.03 . 1 . . . . . . . . 7086 1 1884 . 1 1 154 154 ASN CA C 13 54.8 0.3 . 1 . . . . . . . . 7086 1 1885 . 1 1 154 154 ASN HA H 1 4.49 0.03 . 1 . . . . . . . . 7086 1 1886 . 1 1 154 154 ASN CB C 13 39.0 0.3 . 1 . . . . . . . . 7086 1 1887 . 1 1 154 154 ASN HB2 H 1 2.83 0.03 . 1 . . . . . . . . 7086 1 1888 . 1 1 154 154 ASN HB3 H 1 2.83 0.03 . 1 . . . . . . . . 7086 1 1889 . 1 1 154 154 ASN C C 13 176.9 0.3 . 1 . . . . . . . . 7086 1 1890 . 1 1 155 155 GLU N N 15 119.2 0.3 . 1 . . . . . . . . 7086 1 1891 . 1 1 155 155 GLU H H 1 7.74 0.03 . 1 . . . . . . . . 7086 1 1892 . 1 1 155 155 GLU CA C 13 57.2 0.3 . 1 . . . . . . . . 7086 1 1893 . 1 1 155 155 GLU HA H 1 4.17 0.03 . 1 . . . . . . . . 7086 1 1894 . 1 1 155 155 GLU CB C 13 29.8 0.3 . 1 . . . . . . . . 7086 1 1895 . 1 1 155 155 GLU HB2 H 1 1.98 0.03 . 1 . . . . . . . . 7086 1 1896 . 1 1 155 155 GLU HB3 H 1 1.98 0.03 . 1 . . . . . . . . 7086 1 1897 . 1 1 155 155 GLU CG C 13 36.3 0.3 . 1 . . . . . . . . 7086 1 1898 . 1 1 155 155 GLU HG2 H 1 2.35 0.03 . 2 . . . . . . . . 7086 1 1899 . 1 1 155 155 GLU HG3 H 1 2.23 0.03 . 2 . . . . . . . . 7086 1 1900 . 1 1 155 155 GLU C C 13 177.2 0.3 . 1 . . . . . . . . 7086 1 1901 . 1 1 156 156 ARG N N 15 119.2 0.3 . 1 . . . . . . . . 7086 1 1902 . 1 1 156 156 ARG H H 1 7.64 0.03 . 1 . . . . . . . . 7086 1 1903 . 1 1 156 156 ARG CA C 13 56.2 0.3 . 1 . . . . . . . . 7086 1 1904 . 1 1 156 156 ARG HA H 1 4.04 0.03 . 1 . . . . . . . . 7086 1 1905 . 1 1 156 156 ARG CB C 13 30.1 0.3 . 1 . . . . . . . . 7086 1 1906 . 1 1 156 156 ARG HB2 H 1 1.65 0.03 . 2 . . . . . . . . 7086 1 1907 . 1 1 156 156 ARG HB3 H 1 1.46 0.03 . 2 . . . . . . . . 7086 1 1908 . 1 1 156 156 ARG CG C 13 26.4 0.3 . 1 . . . . . . . . 7086 1 1909 . 1 1 156 156 ARG HG2 H 1 1.31 0.03 . 2 . . . . . . . . 7086 1 1910 . 1 1 156 156 ARG HG3 H 1 1.25 0.03 . 2 . . . . . . . . 7086 1 1911 . 1 1 156 156 ARG CD C 13 43.1 0.3 . 1 . . . . . . . . 7086 1 1912 . 1 1 156 156 ARG HD2 H 1 2.73 0.03 . 1 . . . . . . . . 7086 1 1913 . 1 1 156 156 ARG HD3 H 1 2.73 0.03 . 1 . . . . . . . . 7086 1 stop_ save_