data_51149 ####################### # Entry information # ####################### save_entry_information_1 _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information_1 _Entry.ID 51149 _Entry.Title ; DENV2 S135A NS3pro/NS2B chemical shifts ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2021-10-21 _Entry.Accession_date 2021-10-21 _Entry.Last_release_date 2021-10-21 _Entry.Original_release_date 2021-10-21 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.14.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _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.ORCID _Entry_author.Entry_ID 1 Peter Agback . . . 0000-0003-2226-0746 51149 2 Dmitry Lesovoy . . . . 51149 3 Xiao Han . . . . 51149 4 Renhua Sun . . . . 51149 5 Tatyana Sandalova . . . . 51149 6 Tatiana Agback . . . . 51149 7 Adnane Achour . . . . 51149 8 Vladislav Orekhov . Yu . . 51149 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 2 51149 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 721 51149 '15N chemical shifts' 216 51149 '1H chemical shifts' 642 51149 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 2 . . 2022-05-22 2021-10-21 update BMRB 'update entry citation' 51149 1 . . 2022-02-18 2021-10-21 original author 'original release' 51149 stop_ save_ ############### # Citations # ############### save_citations_1 _Citation.Sf_category citations _Citation.Sf_framecode citations_1 _Citation.Entry_ID 51149 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 35149939 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; 1H, 13C and 15N resonance assignment of backbone and IVL-methyl side chain of the S135A mutant NS3pro/NS2B protein of Dengue II virus reveals unique secondary structure features in solution ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assignments' _Citation.Journal_name_full . _Citation.Journal_volume 16 _Citation.Journal_issue 1 _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 135 _Citation.Page_last 145 _Citation.Year 2022 _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.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Peter Agback . . . . 51149 1 2 Dmitry Lesovoy . . . . 51149 1 3 Xiao Han . . . . 51149 1 4 Renhua Sun . . . . 51149 1 5 Tatyana Sandalova . . . . 51149 1 6 Tatiana Agback . . . . 51149 1 7 Adnane Achour . . . . 51149 1 8 Vladislav Orekhov . Yu . . 51149 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly_1 _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly_1 _Assembly.Entry_ID 51149 _Assembly.ID 1 _Assembly.Name complex _Assembly.BMRB_code . _Assembly.Number_of_components 2 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states no _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange no _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 NS3pro 1 $entity_1 . . yes native no no . . . 51149 1 2 NS2B 2 $entity_2 . . yes native no no . . . 51149 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 51149 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity_1 _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 ; AGVLWDVPSPPPVGKAELED GAYRIKQKGILGYSQIGAGV YKEGTFHTMWHVTRGAVLMH KGKRIEPSWADVKKDLISYG GGWKLEGEWKEGEEVQVLAL EPGKNPRAVQTKPGLFKTNT GTIGAVSLDFSPGTAGSPIV DKKGKVVGLYGNGVVTRSGA YVSAIAQTEKSIEDNPEIED DIFRK ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 185 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation S135A _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . 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 . ALA . 51149 1 2 . GLY . 51149 1 3 . VAL . 51149 1 4 . LEU . 51149 1 5 . TRP . 51149 1 6 . ASP . 51149 1 7 . VAL . 51149 1 8 . PRO . 51149 1 9 . SER . 51149 1 10 . PRO . 51149 1 11 . PRO . 51149 1 12 . PRO . 51149 1 13 . VAL . 51149 1 14 . GLY . 51149 1 15 . LYS . 51149 1 16 . ALA . 51149 1 17 . GLU . 51149 1 18 . LEU . 51149 1 19 . GLU . 51149 1 20 . ASP . 51149 1 21 . GLY . 51149 1 22 . ALA . 51149 1 23 . TYR . 51149 1 24 . ARG . 51149 1 25 . ILE . 51149 1 26 . LYS . 51149 1 27 . GLN . 51149 1 28 . LYS . 51149 1 29 . GLY . 51149 1 30 . ILE . 51149 1 31 . LEU . 51149 1 32 . GLY . 51149 1 33 . TYR . 51149 1 34 . SER . 51149 1 35 . GLN . 51149 1 36 . ILE . 51149 1 37 . GLY . 51149 1 38 . ALA . 51149 1 39 . GLY . 51149 1 40 . VAL . 51149 1 41 . TYR . 51149 1 42 . LYS . 51149 1 43 . GLU . 51149 1 44 . GLY . 51149 1 45 . THR . 51149 1 46 . PHE . 51149 1 47 . HIS . 51149 1 48 . THR . 51149 1 49 . MET . 51149 1 50 . TRP . 51149 1 51 . HIS . 51149 1 52 . VAL . 51149 1 53 . THR . 51149 1 54 . ARG . 51149 1 55 . GLY . 51149 1 56 . ALA . 51149 1 57 . VAL . 51149 1 58 . LEU . 51149 1 59 . MET . 51149 1 60 . HIS . 51149 1 61 . LYS . 51149 1 62 . GLY . 51149 1 63 . LYS . 51149 1 64 . ARG . 51149 1 65 . ILE . 51149 1 66 . GLU . 51149 1 67 . PRO . 51149 1 68 . SER . 51149 1 69 . TRP . 51149 1 70 . ALA . 51149 1 71 . ASP . 51149 1 72 . VAL . 51149 1 73 . LYS . 51149 1 74 . LYS . 51149 1 75 . ASP . 51149 1 76 . LEU . 51149 1 77 . ILE . 51149 1 78 . SER . 51149 1 79 . TYR . 51149 1 80 . GLY . 51149 1 81 . GLY . 51149 1 82 . GLY . 51149 1 83 . TRP . 51149 1 84 . LYS . 51149 1 85 . LEU . 51149 1 86 . GLU . 51149 1 87 . GLY . 51149 1 88 . GLU . 51149 1 89 . TRP . 51149 1 90 . LYS . 51149 1 91 . GLU . 51149 1 92 . GLY . 51149 1 93 . GLU . 51149 1 94 . GLU . 51149 1 95 . VAL . 51149 1 96 . GLN . 51149 1 97 . VAL . 51149 1 98 . LEU . 51149 1 99 . ALA . 51149 1 100 . LEU . 51149 1 101 . GLU . 51149 1 102 . PRO . 51149 1 103 . GLY . 51149 1 104 . LYS . 51149 1 105 . ASN . 51149 1 106 . PRO . 51149 1 107 . ARG . 51149 1 108 . ALA . 51149 1 109 . VAL . 51149 1 110 . GLN . 51149 1 111 . THR . 51149 1 112 . LYS . 51149 1 113 . PRO . 51149 1 114 . GLY . 51149 1 115 . LEU . 51149 1 116 . PHE . 51149 1 117 . LYS . 51149 1 118 . THR . 51149 1 119 . ASN . 51149 1 120 . THR . 51149 1 121 . GLY . 51149 1 122 . THR . 51149 1 123 . ILE . 51149 1 124 . GLY . 51149 1 125 . ALA . 51149 1 126 . VAL . 51149 1 127 . SER . 51149 1 128 . LEU . 51149 1 129 . ASP . 51149 1 130 . PHE . 51149 1 131 . SER . 51149 1 132 . PRO . 51149 1 133 . GLY . 51149 1 134 . THR . 51149 1 135 . ALA . 51149 1 136 . GLY . 51149 1 137 . SER . 51149 1 138 . PRO . 51149 1 139 . ILE . 51149 1 140 . VAL . 51149 1 141 . ASP . 51149 1 142 . LYS . 51149 1 143 . LYS . 51149 1 144 . GLY . 51149 1 145 . LYS . 51149 1 146 . VAL . 51149 1 147 . VAL . 51149 1 148 . GLY . 51149 1 149 . LEU . 51149 1 150 . TYR . 51149 1 151 . GLY . 51149 1 152 . ASN . 51149 1 153 . GLY . 51149 1 154 . VAL . 51149 1 155 . VAL . 51149 1 156 . THR . 51149 1 157 . ARG . 51149 1 158 . SER . 51149 1 159 . GLY . 51149 1 160 . ALA . 51149 1 161 . TYR . 51149 1 162 . VAL . 51149 1 163 . SER . 51149 1 164 . ALA . 51149 1 165 . ILE . 51149 1 166 . ALA . 51149 1 167 . GLN . 51149 1 168 . THR . 51149 1 169 . GLU . 51149 1 170 . LYS . 51149 1 171 . SER . 51149 1 172 . ILE . 51149 1 173 . GLU . 51149 1 174 . ASP . 51149 1 175 . ASN . 51149 1 176 . PRO . 51149 1 177 . GLU . 51149 1 178 . ILE . 51149 1 179 . GLU . 51149 1 180 . ASP . 51149 1 181 . ASP . 51149 1 182 . ILE . 51149 1 183 . PHE . 51149 1 184 . ARG . 51149 1 185 . LYS . 51149 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 . ALA 1 1 51149 1 . GLY 2 2 51149 1 . VAL 3 3 51149 1 . LEU 4 4 51149 1 . TRP 5 5 51149 1 . ASP 6 6 51149 1 . VAL 7 7 51149 1 . PRO 8 8 51149 1 . SER 9 9 51149 1 . PRO 10 10 51149 1 . PRO 11 11 51149 1 . PRO 12 12 51149 1 . VAL 13 13 51149 1 . GLY 14 14 51149 1 . LYS 15 15 51149 1 . ALA 16 16 51149 1 . GLU 17 17 51149 1 . LEU 18 18 51149 1 . GLU 19 19 51149 1 . ASP 20 20 51149 1 . GLY 21 21 51149 1 . ALA 22 22 51149 1 . TYR 23 23 51149 1 . ARG 24 24 51149 1 . ILE 25 25 51149 1 . LYS 26 26 51149 1 . GLN 27 27 51149 1 . LYS 28 28 51149 1 . GLY 29 29 51149 1 . ILE 30 30 51149 1 . LEU 31 31 51149 1 . GLY 32 32 51149 1 . TYR 33 33 51149 1 . SER 34 34 51149 1 . GLN 35 35 51149 1 . ILE 36 36 51149 1 . GLY 37 37 51149 1 . ALA 38 38 51149 1 . GLY 39 39 51149 1 . VAL 40 40 51149 1 . TYR 41 41 51149 1 . LYS 42 42 51149 1 . GLU 43 43 51149 1 . GLY 44 44 51149 1 . THR 45 45 51149 1 . PHE 46 46 51149 1 . HIS 47 47 51149 1 . THR 48 48 51149 1 . MET 49 49 51149 1 . TRP 50 50 51149 1 . HIS 51 51 51149 1 . VAL 52 52 51149 1 . THR 53 53 51149 1 . ARG 54 54 51149 1 . GLY 55 55 51149 1 . ALA 56 56 51149 1 . VAL 57 57 51149 1 . LEU 58 58 51149 1 . MET 59 59 51149 1 . HIS 60 60 51149 1 . LYS 61 61 51149 1 . GLY 62 62 51149 1 . LYS 63 63 51149 1 . ARG 64 64 51149 1 . ILE 65 65 51149 1 . GLU 66 66 51149 1 . PRO 67 67 51149 1 . SER 68 68 51149 1 . TRP 69 69 51149 1 . ALA 70 70 51149 1 . ASP 71 71 51149 1 . VAL 72 72 51149 1 . LYS 73 73 51149 1 . LYS 74 74 51149 1 . ASP 75 75 51149 1 . LEU 76 76 51149 1 . ILE 77 77 51149 1 . SER 78 78 51149 1 . TYR 79 79 51149 1 . GLY 80 80 51149 1 . GLY 81 81 51149 1 . GLY 82 82 51149 1 . TRP 83 83 51149 1 . LYS 84 84 51149 1 . LEU 85 85 51149 1 . GLU 86 86 51149 1 . GLY 87 87 51149 1 . GLU 88 88 51149 1 . TRP 89 89 51149 1 . LYS 90 90 51149 1 . GLU 91 91 51149 1 . GLY 92 92 51149 1 . GLU 93 93 51149 1 . GLU 94 94 51149 1 . VAL 95 95 51149 1 . GLN 96 96 51149 1 . VAL 97 97 51149 1 . LEU 98 98 51149 1 . ALA 99 99 51149 1 . LEU 100 100 51149 1 . GLU 101 101 51149 1 . PRO 102 102 51149 1 . GLY 103 103 51149 1 . LYS 104 104 51149 1 . ASN 105 105 51149 1 . PRO 106 106 51149 1 . ARG 107 107 51149 1 . ALA 108 108 51149 1 . VAL 109 109 51149 1 . GLN 110 110 51149 1 . THR 111 111 51149 1 . LYS 112 112 51149 1 . PRO 113 113 51149 1 . GLY 114 114 51149 1 . LEU 115 115 51149 1 . PHE 116 116 51149 1 . LYS 117 117 51149 1 . THR 118 118 51149 1 . ASN 119 119 51149 1 . THR 120 120 51149 1 . GLY 121 121 51149 1 . THR 122 122 51149 1 . ILE 123 123 51149 1 . GLY 124 124 51149 1 . ALA 125 125 51149 1 . VAL 126 126 51149 1 . SER 127 127 51149 1 . LEU 128 128 51149 1 . ASP 129 129 51149 1 . PHE 130 130 51149 1 . SER 131 131 51149 1 . PRO 132 132 51149 1 . GLY 133 133 51149 1 . THR 134 134 51149 1 . ALA 135 135 51149 1 . GLY 136 136 51149 1 . SER 137 137 51149 1 . PRO 138 138 51149 1 . ILE 139 139 51149 1 . VAL 140 140 51149 1 . ASP 141 141 51149 1 . LYS 142 142 51149 1 . LYS 143 143 51149 1 . GLY 144 144 51149 1 . LYS 145 145 51149 1 . VAL 146 146 51149 1 . VAL 147 147 51149 1 . GLY 148 148 51149 1 . LEU 149 149 51149 1 . TYR 150 150 51149 1 . GLY 151 151 51149 1 . ASN 152 152 51149 1 . GLY 153 153 51149 1 . VAL 154 154 51149 1 . VAL 155 155 51149 1 . THR 156 156 51149 1 . ARG 157 157 51149 1 . SER 158 158 51149 1 . GLY 159 159 51149 1 . ALA 160 160 51149 1 . TYR 161 161 51149 1 . VAL 162 162 51149 1 . SER 163 163 51149 1 . ALA 164 164 51149 1 . ILE 165 165 51149 1 . ALA 166 166 51149 1 . GLN 167 167 51149 1 . THR 168 168 51149 1 . GLU 169 169 51149 1 . LYS 170 170 51149 1 . SER 171 171 51149 1 . ILE 172 172 51149 1 . GLU 173 173 51149 1 . ASP 174 174 51149 1 . ASN 175 175 51149 1 . PRO 176 176 51149 1 . GLU 177 177 51149 1 . ILE 178 178 51149 1 . GLU 179 179 51149 1 . ASP 180 180 51149 1 . ASP 181 181 51149 1 . ILE 182 182 51149 1 . PHE 183 183 51149 1 . ARG 184 184 51149 1 . LYS 185 185 51149 1 stop_ save_ save_entity_2 _Entity.Sf_category entity _Entity.Sf_framecode entity_2 _Entity.Entry_ID 51149 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name entity_2 _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 ; HMLEADLELERAADVRWEEQ AEISGSSPILSITISEDGSM SIKNEEEEQTL ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 51 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID 2 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . 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 . HIS . 51149 2 2 . MET . 51149 2 3 . LEU . 51149 2 4 . GLU . 51149 2 5 . ALA . 51149 2 6 . ASP . 51149 2 7 . LEU . 51149 2 8 . GLU . 51149 2 9 . LEU . 51149 2 10 . GLU . 51149 2 11 . ARG . 51149 2 12 . ALA . 51149 2 13 . ALA . 51149 2 14 . ASP . 51149 2 15 . VAL . 51149 2 16 . ARG . 51149 2 17 . TRP . 51149 2 18 . GLU . 51149 2 19 . GLU . 51149 2 20 . GLN . 51149 2 21 . ALA . 51149 2 22 . GLU . 51149 2 23 . ILE . 51149 2 24 . SER . 51149 2 25 . GLY . 51149 2 26 . SER . 51149 2 27 . SER . 51149 2 28 . PRO . 51149 2 29 . ILE . 51149 2 30 . LEU . 51149 2 31 . SER . 51149 2 32 . ILE . 51149 2 33 . THR . 51149 2 34 . ILE . 51149 2 35 . SER . 51149 2 36 . GLU . 51149 2 37 . ASP . 51149 2 38 . GLY . 51149 2 39 . SER . 51149 2 40 . MET . 51149 2 41 . SER . 51149 2 42 . ILE . 51149 2 43 . LYS . 51149 2 44 . ASN . 51149 2 45 . GLU . 51149 2 46 . GLU . 51149 2 47 . GLU . 51149 2 48 . GLU . 51149 2 49 . GLN . 51149 2 50 . THR . 51149 2 51 . LEU . 51149 2 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 . HIS 1 1 51149 2 . MET 2 2 51149 2 . LEU 3 3 51149 2 . GLU 4 4 51149 2 . ALA 5 5 51149 2 . ASP 6 6 51149 2 . LEU 7 7 51149 2 . GLU 8 8 51149 2 . LEU 9 9 51149 2 . GLU 10 10 51149 2 . ARG 11 11 51149 2 . ALA 12 12 51149 2 . ALA 13 13 51149 2 . ASP 14 14 51149 2 . VAL 15 15 51149 2 . ARG 16 16 51149 2 . TRP 17 17 51149 2 . GLU 18 18 51149 2 . GLU 19 19 51149 2 . GLN 20 20 51149 2 . ALA 21 21 51149 2 . GLU 22 22 51149 2 . ILE 23 23 51149 2 . SER 24 24 51149 2 . GLY 25 25 51149 2 . SER 26 26 51149 2 . SER 27 27 51149 2 . PRO 28 28 51149 2 . ILE 29 29 51149 2 . LEU 30 30 51149 2 . SER 31 31 51149 2 . ILE 32 32 51149 2 . THR 33 33 51149 2 . ILE 34 34 51149 2 . SER 35 35 51149 2 . GLU 36 36 51149 2 . ASP 37 37 51149 2 . GLY 38 38 51149 2 . SER 39 39 51149 2 . MET 40 40 51149 2 . SER 41 41 51149 2 . ILE 42 42 51149 2 . LYS 43 43 51149 2 . ASN 44 44 51149 2 . GLU 45 45 51149 2 . GLU 46 46 51149 2 . GLU 47 47 51149 2 . GLU 48 48 51149 2 . GLN 49 49 51149 2 . THR 50 50 51149 2 . LEU 51 51 51149 2 stop_ save_ #################### # Natural source # #################### save_natural_source_1 _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source_1 _Entity_natural_src_list.Entry_ID 51149 _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.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.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity_1 . 11051 organism . 'Dengue virus 2' 'Dengue virus 2' . . Viruses . Flavivirus 'Dengue virus' . . . . . . . . . . . . . 51149 1 2 2 $entity_2 . 11051 organism . 'Dengue virus 2' 'Dengue virus 2' . . Viruses . Flavivirus 'Dengue virus' . . . . . . . . . . . . . 51149 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source_1 _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source_1 _Entity_experimental_src_list.Entry_ID 51149 _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_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.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . plasmid . . pET21b . . . 51149 1 2 2 $entity_2 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . plasmid . . pET21b . . . 51149 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 51149 _Sample.ID 1 _Sample.Name H-version _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number 1 _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 NS3pro '[U-99% 13C; U-99% 15N]' . . 1 $entity_1 . . 0.8 . . mM . . . . 51149 1 2 NS2B '[U-99% 13C; U-99% 15N]' . . 2 $entity_2 . . 0.8 . . mM . . . . 51149 1 3 MES 'natural abundance' . . . . . . 20 . . mM . . . . 51149 1 4 NaCl 'natural abundance' . . . . . . 100 . . mM . . . . 51149 1 5 CaCl2 'natural abundance' . . . . . . 5 . . mM . . . . 51149 1 6 NaN3 'natural abundance' . . . . . . 0.02 . . % . . . . 51149 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 51149 _Sample.ID 2 _Sample.Name D-version _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number 1 _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 NS3pro '[U-100% 13C; U-100% 15N; U-80% 2H]' . . 1 $entity_1 . . 0.7 . . mM . . . . 51149 2 2 NS2B '[U-100% 13C; U-100% 15N; U-80% 2H]' . . 2 $entity_2 . . 0.7 . . mM . . . . 51149 2 3 MES 'natural abundance' . . . . . . 20 . . mM . . . . 51149 2 4 NaCl 'natural abundance' . . . . . . 100 . . mM . . . . 51149 2 5 CaCl2 'natural abundance' . . . . . . 5 . . mM . . . . 51149 2 6 NaN3 'natural abundance' . . . . . . 0.02 . . % . . . . 51149 2 stop_ save_ save_sample_3 _Sample.Sf_category sample _Sample.Sf_framecode sample_3 _Sample.Entry_ID 51149 _Sample.ID 3 _Sample.Name ILV-version _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number 1 _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 NS3pro '[U-13C; U-15N; U-2H; 99% 1HD-Ile,Leu; 99% 1HG-Val]' . . 1 $entity_1 . . 0.4 . . mM . . . . 51149 3 2 NS2B '[U-13C; U-15N; U-2H; 99% 1HD-Ile,Leu; 99% 1HG-Val]' . . 2 $entity_2 . . 0.4 . . mM . . . . 51149 3 3 MES 'natural abundance' . . . . . . 20 . . mM . . . . 51149 3 4 NaCl 'natural abundance' . . . . . . 100 . . mM . . . . 51149 3 5 CaCl2 'natural abundance' . . . . . . 5 . . mM . . . . 51149 3 6 NaN3 'natural abundance' . . . . . . 0.02 . . % . . . . 51149 3 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 51149 _Sample_condition_list.ID 1 _Sample_condition_list.Name normal _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' 0.125 . M 51149 1 pH 6.5 . pH 51149 1 pressure 1 . atm 51149 1 temperature 298 . K 51149 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 51149 _Software.ID 1 _Software.Type . _Software.Name TOPSPIN _Software.Version 3.5 _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID collection . 51149 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 51149 _Software.ID 2 _Software.Type . _Software.Name CcpNMR _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 51149 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 51149 _Software.ID 3 _Software.Type . _Software.Name NMRPipe _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID processing . 51149 3 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 51149 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name 600 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE III' _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 51149 _NMR_spectrometer.ID 2 _NMR_spectrometer.Name 800 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE III' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_NMR_spectrometer_3 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_3 _NMR_spectrometer.Entry_ID 51149 _NMR_spectrometer.ID 3 _NMR_spectrometer.Name 900 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE III' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 900 save_ ############################# # NMR applied experiments # ############################# save_experiment_list_1 _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list_1 _Experiment_list.Entry_ID 51149 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NUS_flag _Experiment.Interleaved_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.Details _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no yes no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51149 1 2 '2D 1H-15N TROSY' no yes no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51149 1 3 '3D HNCO' no yes no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 51149 1 4 '3D CBCANH' no yes yes . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 51149 1 5 HMCM(CGCB)CA no yes no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 3 $NMR_spectrometer_3 . . . . . . . . . . . . . . . . . 51149 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chem_shift_reference_1 _Chem_shift_reference.Entry_ID 51149 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name DSS _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.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 internal indirect . . . . . . 51149 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1 . . . . . 51149 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 internal indirect . . . . . . 51149 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 51149 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name NS3 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err 0.02 _Assigned_chem_shift_list.Chem_shift_13C_err 0.1 _Assigned_chem_shift_list.Chem_shift_15N_err 0.1 _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 2 '2D 1H-15N TROSY' . . . 51149 1 3 '3D HNCO' . . . 51149 1 4 '3D CBCANH' . . . 51149 1 5 HMCM(CGCB)CA . . . 51149 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 2 $software_2 . . 51149 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_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.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 1 1 ALA HA H 1 4.32 0.02 . 1 . . . . . 1 ALA HA . 51149 1 2 . 1 . 1 1 1 ALA C C 13 179.08 0.1 . 1 . . . . . 1 ALA C . 51149 1 3 . 1 . 1 1 1 ALA CA C 13 52.27 0.1 . 1 . . . . . 1 ALA CA . 51149 1 4 . 1 . 1 1 1 ALA CB C 13 18.34 0.1 . 1 . . . . . 1 ALA CB . 51149 1 5 . 1 . 1 1 1 ALA N N 15 125.74 0.1 . 1 . . . . . 1 ALA N . 51149 1 6 . 1 . 1 2 2 GLY H H 1 8.31 0.02 . 1 . . . . . 2 GLY HN . 51149 1 7 . 1 . 1 2 2 GLY HA2 H 1 3.89 0.02 . 2 . . . . . 2 GLY HA2 . 51149 1 8 . 1 . 1 2 2 GLY HA3 H 1 3.80 0.02 . 2 . . . . . 2 GLY HA3 . 51149 1 9 . 1 . 1 2 2 GLY C C 13 179.92 0.1 . 1 . . . . . 2 GLY C . 51149 1 10 . 1 . 1 2 2 GLY CA C 13 44.77 0.1 . 1 . . . . . 2 GLY CA . 51149 1 11 . 1 . 1 2 2 GLY N N 15 107.94 0.1 . 1 . . . . . 2 GLY N . 51149 1 12 . 1 . 1 3 3 VAL H H 1 7.82 0.02 . 1 . . . . . 3 VAL HN . 51149 1 13 . 1 . 1 3 3 VAL HA H 1 4.02 0.02 . 1 . . . . . 3 VAL HA . 51149 1 14 . 1 . 1 3 3 VAL HG11 H 1 0.72 0.02 . 2 . . . . . 3 VAL MG1 . 51149 1 15 . 1 . 1 3 3 VAL HG12 H 1 0.72 0.02 . 2 . . . . . 3 VAL MG1 . 51149 1 16 . 1 . 1 3 3 VAL HG13 H 1 0.72 0.02 . 2 . . . . . 3 VAL MG1 . 51149 1 17 . 1 . 1 3 3 VAL HG21 H 1 0.79 0.02 . 2 . . . . . 3 VAL MG2 . 51149 1 18 . 1 . 1 3 3 VAL HG22 H 1 0.79 0.02 . 2 . . . . . 3 VAL MG2 . 51149 1 19 . 1 . 1 3 3 VAL HG23 H 1 0.79 0.02 . 2 . . . . . 3 VAL MG2 . 51149 1 20 . 1 . 1 3 3 VAL C C 13 176.98 0.1 . 1 . . . . . 3 VAL C . 51149 1 21 . 1 . 1 3 3 VAL CA C 13 61.71 0.1 . 1 . . . . . 3 VAL CA . 51149 1 22 . 1 . 1 3 3 VAL CB C 13 32.15 0.1 . 1 . . . . . 3 VAL CB . 51149 1 23 . 1 . 1 3 3 VAL CG1 C 13 20.14 0.1 . 2 . . . . . 3 VAL CG1 . 51149 1 24 . 1 . 1 3 3 VAL CG2 C 13 20.87 0.1 . 2 . . . . . 3 VAL CG2 . 51149 1 25 . 1 . 1 3 3 VAL N N 15 118.85 0.1 . 1 . . . . . 3 VAL N . 51149 1 26 . 1 . 1 4 4 LEU H H 1 8.13 0.02 . 1 . . . . . 4 LEU HN . 51149 1 27 . 1 . 1 4 4 LEU HA H 1 4.29 0.02 . 1 . . . . . 4 LEU HA . 51149 1 28 . 1 . 1 4 4 LEU HD11 H 1 0.76 0.02 . 2 . . . . . 4 LEU MD1 . 51149 1 29 . 1 . 1 4 4 LEU HD12 H 1 0.76 0.02 . 2 . . . . . 4 LEU MD1 . 51149 1 30 . 1 . 1 4 4 LEU HD13 H 1 0.76 0.02 . 2 . . . . . 4 LEU MD1 . 51149 1 31 . 1 . 1 4 4 LEU HD21 H 1 0.82 0.02 . 2 . . . . . 4 LEU MD2 . 51149 1 32 . 1 . 1 4 4 LEU HD22 H 1 0.82 0.02 . 2 . . . . . 4 LEU MD2 . 51149 1 33 . 1 . 1 4 4 LEU HD23 H 1 0.82 0.02 . 2 . . . . . 4 LEU MD2 . 51149 1 34 . 1 . 1 4 4 LEU C C 13 177.76 0.1 . 1 . . . . . 4 LEU C . 51149 1 35 . 1 . 1 4 4 LEU CA C 13 54.59 0.1 . 1 . . . . . 4 LEU CA . 51149 1 36 . 1 . 1 4 4 LEU CB C 13 41.17 0.1 . 1 . . . . . 4 LEU CB . 51149 1 37 . 1 . 1 4 4 LEU CD1 C 13 23.36 0.1 . 2 . . . . . 4 LEU CD1 . 51149 1 38 . 1 . 1 4 4 LEU CD2 C 13 24.71 0.1 . 2 . . . . . 4 LEU CD2 . 51149 1 39 . 1 . 1 4 4 LEU N N 15 124.82 0.1 . 1 . . . . . 4 LEU N . 51149 1 40 . 1 . 1 5 5 TRP H H 1 7.86 0.02 . 1 . . . . . 5 TRP HN . 51149 1 41 . 1 . 1 5 5 TRP HA H 1 4.55 0.02 . 1 . . . . . 5 TRP HA . 51149 1 42 . 1 . 1 5 5 TRP C C 13 176.57 0.1 . 1 . . . . . 5 TRP C . 51149 1 43 . 1 . 1 5 5 TRP CA C 13 56.29 0.1 . 1 . . . . . 5 TRP CA . 51149 1 44 . 1 . 1 5 5 TRP CB C 13 29.08 0.1 . 1 . . . . . 5 TRP CB . 51149 1 45 . 1 . 1 5 5 TRP N N 15 120.83 0.1 . 1 . . . . . 5 TRP N . 51149 1 46 . 1 . 1 6 6 ASP H H 1 8.17 0.02 . 1 . . . . . 6 ASP HN . 51149 1 47 . 1 . 1 6 6 ASP HA H 1 4.40 0.02 . 1 . . . . . 6 ASP HA . 51149 1 48 . 1 . 1 6 6 ASP C C 13 176.42 0.1 . 1 . . . . . 6 ASP C . 51149 1 49 . 1 . 1 6 6 ASP CA C 13 53.57 0.1 . 1 . . . . . 6 ASP CA . 51149 1 50 . 1 . 1 6 6 ASP CB C 13 40.35 0.1 . 1 . . . . . 6 ASP CB . 51149 1 51 . 1 . 1 6 6 ASP N N 15 121.49 0.1 . 1 . . . . . 6 ASP N . 51149 1 52 . 1 . 1 7 7 VAL H H 1 7.85 0.02 . 1 . . . . . 7 VAL HN . 51149 1 53 . 1 . 1 7 7 VAL HA H 1 4.15 0.02 . 1 . . . . . 7 VAL HA . 51149 1 54 . 1 . 1 7 7 VAL HG11 H 1 0.95 0.02 . 2 . . . . . 7 VAL MG1 . 51149 1 55 . 1 . 1 7 7 VAL HG12 H 1 0.95 0.02 . 2 . . . . . 7 VAL MG1 . 51149 1 56 . 1 . 1 7 7 VAL HG13 H 1 0.95 0.02 . 2 . . . . . 7 VAL MG1 . 51149 1 57 . 1 . 1 7 7 VAL HG21 H 1 0.86 0.02 . 2 . . . . . 7 VAL MG2 . 51149 1 58 . 1 . 1 7 7 VAL HG22 H 1 0.86 0.02 . 2 . . . . . 7 VAL MG2 . 51149 1 59 . 1 . 1 7 7 VAL HG23 H 1 0.86 0.02 . 2 . . . . . 7 VAL MG2 . 51149 1 60 . 1 . 1 7 7 VAL C C 13 175.44 0.1 . 1 . . . . . 7 VAL C . 51149 1 61 . 1 . 1 7 7 VAL CA C 13 59.19 0.1 . 1 . . . . . 7 VAL CA . 51149 1 62 . 1 . 1 7 7 VAL CB C 13 32.12 0.1 . 1 . . . . . 7 VAL CB . 51149 1 63 . 1 . 1 7 7 VAL CG1 C 13 20.95 0.1 . 2 . . . . . 7 VAL CG1 . 51149 1 64 . 1 . 1 7 7 VAL CG2 C 13 20.08 0.1 . 2 . . . . . 7 VAL CG2 . 51149 1 65 . 1 . 1 7 7 VAL N N 15 120.74 0.1 . 1 . . . . . 7 VAL N . 51149 1 66 . 1 . 1 8 8 PRO HA H 1 4.43 0.02 . 1 . . . . . 8 PRO HA . 51149 1 67 . 1 . 1 8 8 PRO C C 13 176.50 0.1 . 1 . . . . . 8 PRO C . 51149 1 68 . 1 . 1 8 8 PRO CA C 13 62.76 0.1 . 1 . . . . . 8 PRO CA . 51149 1 69 . 1 . 1 8 8 PRO CB C 13 31.31 0.1 . 1 . . . . . 8 PRO CB . 51149 1 70 . 1 . 1 9 9 SER H H 1 8.03 0.02 . 1 . . . . . 9 SER HN . 51149 1 71 . 1 . 1 9 9 SER HA H 1 4.33 0.02 . 1 . . . . . 9 SER HA . 51149 1 72 . 1 . 1 9 9 SER CA C 13 54.48 0.1 . 1 . . . . . 9 SER CA . 51149 1 73 . 1 . 1 9 9 SER CB C 13 63.90 0.1 . 1 . . . . . 9 SER CB . 51149 1 74 . 1 . 1 9 9 SER N N 15 114.98 0.1 . 1 . . . . . 9 SER N . 51149 1 75 . 1 . 1 12 12 PRO HA H 1 4.44 0.02 . 1 . . . . . 12 PRO HA . 51149 1 76 . 1 . 1 12 12 PRO C C 13 178.06 0.1 . 1 . . . . . 12 PRO C . 51149 1 77 . 1 . 1 12 12 PRO CA C 13 62.25 0.1 . 1 . . . . . 12 PRO CA . 51149 1 78 . 1 . 1 12 12 PRO CB C 13 30.95 0.1 . 1 . . . . . 12 PRO CB . 51149 1 79 . 1 . 1 13 13 VAL H H 1 8.18 0.02 . 1 . . . . . 13 VAL HN . 51149 1 80 . 1 . 1 13 13 VAL HA H 1 4.07 0.02 . 1 . . . . . 13 VAL HA . 51149 1 81 . 1 . 1 13 13 VAL HG11 H 1 0.96 0.02 . 2 . . . . . 13 VAL MG1 . 51149 1 82 . 1 . 1 13 13 VAL HG12 H 1 0.96 0.02 . 2 . . . . . 13 VAL MG1 . 51149 1 83 . 1 . 1 13 13 VAL HG13 H 1 0.96 0.02 . 2 . . . . . 13 VAL MG1 . 51149 1 84 . 1 . 1 13 13 VAL HG21 H 1 0.95 0.02 . 2 . . . . . 13 VAL MG2 . 51149 1 85 . 1 . 1 13 13 VAL HG22 H 1 0.95 0.02 . 2 . . . . . 13 VAL MG2 . 51149 1 86 . 1 . 1 13 13 VAL HG23 H 1 0.95 0.02 . 2 . . . . . 13 VAL MG2 . 51149 1 87 . 1 . 1 13 13 VAL C C 13 177.78 0.1 . 1 . . . . . 13 VAL C . 51149 1 88 . 1 . 1 13 13 VAL CA C 13 61.89 0.1 . 1 . . . . . 13 VAL CA . 51149 1 89 . 1 . 1 13 13 VAL CB C 13 32.23 0.1 . 1 . . . . . 13 VAL CB . 51149 1 90 . 1 . 1 13 13 VAL CG1 C 13 20.43 0.1 . 2 . . . . . 13 VAL CG1 . 51149 1 91 . 1 . 1 13 13 VAL CG2 C 13 21.04 0.1 . 2 . . . . . 13 VAL CG2 . 51149 1 92 . 1 . 1 13 13 VAL N N 15 120.06 0.1 . 1 . . . . . 13 VAL N . 51149 1 93 . 1 . 1 14 14 GLY H H 1 8.46 0.02 . 1 . . . . . 14 GLY HN . 51149 1 94 . 1 . 1 14 14 GLY HA2 H 1 3.98 0.02 . 2 . . . . . 14 GLY HA2 . 51149 1 95 . 1 . 1 14 14 GLY HA3 H 1 3.90 0.02 . 2 . . . . . 14 GLY HA3 . 51149 1 96 . 1 . 1 14 14 GLY C C 13 174.87 0.1 . 1 . . . . . 14 GLY C . 51149 1 97 . 1 . 1 14 14 GLY CA C 13 44.66 0.1 . 1 . . . . . 14 GLY CA . 51149 1 98 . 1 . 1 14 14 GLY N N 15 112.26 0.1 . 1 . . . . . 14 GLY N . 51149 1 99 . 1 . 1 15 15 LYS H H 1 8.17 0.02 . 1 . . . . . 15 LYS HN . 51149 1 100 . 1 . 1 15 15 LYS HA H 1 4.32 0.02 . 1 . . . . . 15 LYS HA . 51149 1 101 . 1 . 1 15 15 LYS C C 13 177.37 0.1 . 1 . . . . . 15 LYS C . 51149 1 102 . 1 . 1 15 15 LYS CA C 13 55.59 0.1 . 1 . . . . . 15 LYS CA . 51149 1 103 . 1 . 1 15 15 LYS CB C 13 32.26 0.1 . 1 . . . . . 15 LYS CB . 51149 1 104 . 1 . 1 15 15 LYS N N 15 121.01 0.1 . 1 . . . . . 15 LYS N . 51149 1 105 . 1 . 1 16 16 ALA H H 1 8.43 0.02 . 1 . . . . . 16 ALA HN . 51149 1 106 . 1 . 1 16 16 ALA HA H 1 4.18 0.02 . 1 . . . . . 16 ALA HA . 51149 1 107 . 1 . 1 16 16 ALA C C 13 178.26 0.1 . 1 . . . . . 16 ALA C . 51149 1 108 . 1 . 1 16 16 ALA CA C 13 51.93 0.1 . 1 . . . . . 16 ALA CA . 51149 1 109 . 1 . 1 16 16 ALA CB C 13 18.30 0.1 . 1 . . . . . 16 ALA CB . 51149 1 110 . 1 . 1 16 16 ALA N N 15 124.95 0.1 . 1 . . . . . 16 ALA N . 51149 1 111 . 1 . 1 17 17 GLU H H 1 8.28 0.02 . 1 . . . . . 17 GLU HN . 51149 1 112 . 1 . 1 17 17 GLU HA H 1 4.24 0.02 . 1 . . . . . 17 GLU HA . 51149 1 113 . 1 . 1 17 17 GLU C C 13 176.99 0.1 . 1 . . . . . 17 GLU C . 51149 1 114 . 1 . 1 17 17 GLU CA C 13 55.86 0.1 . 1 . . . . . 17 GLU CA . 51149 1 115 . 1 . 1 17 17 GLU CB C 13 29.40 0.1 . 1 . . . . . 17 GLU CB . 51149 1 116 . 1 . 1 17 17 GLU N N 15 119.96 0.1 . 1 . . . . . 17 GLU N . 51149 1 117 . 1 . 1 18 18 LEU H H 1 7.67 0.02 . 1 . . . . . 18 LEU HN . 51149 1 118 . 1 . 1 18 18 LEU HA H 1 4.00 0.02 . 1 . . . . . 18 LEU HA . 51149 1 119 . 1 . 1 18 18 LEU HD11 H 1 0.37 0.02 . 2 . . . . . 18 LEU MD1 . 51149 1 120 . 1 . 1 18 18 LEU HD12 H 1 0.37 0.02 . 2 . . . . . 18 LEU MD1 . 51149 1 121 . 1 . 1 18 18 LEU HD13 H 1 0.37 0.02 . 2 . . . . . 18 LEU MD1 . 51149 1 122 . 1 . 1 18 18 LEU HD21 H 1 0.08 0.02 . 2 . . . . . 18 LEU MD2 . 51149 1 123 . 1 . 1 18 18 LEU HD22 H 1 0.08 0.02 . 2 . . . . . 18 LEU MD2 . 51149 1 124 . 1 . 1 18 18 LEU HD23 H 1 0.08 0.02 . 2 . . . . . 18 LEU MD2 . 51149 1 125 . 1 . 1 18 18 LEU C C 13 176.75 0.1 . 1 . . . . . 18 LEU C . 51149 1 126 . 1 . 1 18 18 LEU CA C 13 54.27 0.1 . 1 . . . . . 18 LEU CA . 51149 1 127 . 1 . 1 18 18 LEU CB C 13 40.30 0.1 . 1 . . . . . 18 LEU CB . 51149 1 128 . 1 . 1 18 18 LEU CD1 C 13 25.65 0.1 . 2 . . . . . 18 LEU CD1 . 51149 1 129 . 1 . 1 18 18 LEU CD2 C 13 23.55 0.1 . 2 . . . . . 18 LEU CD2 . 51149 1 130 . 1 . 1 18 18 LEU N N 15 122.54 0.1 . 1 . . . . . 18 LEU N . 51149 1 131 . 1 . 1 19 19 GLU H H 1 7.74 0.02 . 1 . . . . . 19 GLU HN . 51149 1 132 . 1 . 1 19 19 GLU HA H 1 4.26 0.02 . 1 . . . . . 19 GLU HA . 51149 1 133 . 1 . 1 19 19 GLU C C 13 178.55 0.1 . 1 . . . . . 19 GLU C . 51149 1 134 . 1 . 1 19 19 GLU CA C 13 55.27 0.1 . 1 . . . . . 19 GLU CA . 51149 1 135 . 1 . 1 19 19 GLU CB C 13 30.48 0.1 . 1 . . . . . 19 GLU CB . 51149 1 136 . 1 . 1 19 19 GLU N N 15 119.41 0.1 . 1 . . . . . 19 GLU N . 51149 1 137 . 1 . 1 20 20 ASP H H 1 8.85 0.02 . 1 . . . . . 20 ASP HN . 51149 1 138 . 1 . 1 20 20 ASP HA H 1 4.58 0.02 . 1 . . . . . 20 ASP HA . 51149 1 139 . 1 . 1 20 20 ASP C C 13 178.12 0.1 . 1 . . . . . 20 ASP C . 51149 1 140 . 1 . 1 20 20 ASP CA C 13 55.30 0.1 . 1 . . . . . 20 ASP CA . 51149 1 141 . 1 . 1 20 20 ASP CB C 13 39.77 0.1 . 1 . . . . . 20 ASP CB . 51149 1 142 . 1 . 1 20 20 ASP N N 15 124.24 0.1 . 1 . . . . . 20 ASP N . 51149 1 143 . 1 . 1 21 21 GLY H H 1 8.78 0.02 . 1 . . . . . 21 GLY HN . 51149 1 144 . 1 . 1 21 21 GLY HA2 H 1 4.59 0.02 . 2 . . . . . 21 GLY HA2 . 51149 1 145 . 1 . 1 21 21 GLY HA3 H 1 4.43 0.02 . 2 . . . . . 21 GLY HA3 . 51149 1 146 . 1 . 1 21 21 GLY C C 13 172.27 0.1 . 1 . . . . . 21 GLY C . 51149 1 147 . 1 . 1 21 21 GLY CA C 13 44.80 0.1 . 1 . . . . . 21 GLY CA . 51149 1 148 . 1 . 1 21 21 GLY N N 15 107.65 0.1 . 1 . . . . . 21 GLY N . 51149 1 149 . 1 . 1 22 22 ALA H H 1 9.41 0.02 . 1 . . . . . 22 ALA HN . 51149 1 150 . 1 . 1 22 22 ALA HA H 1 5.55 0.02 . 1 . . . . . 22 ALA HA . 51149 1 151 . 1 . 1 22 22 ALA C C 13 177.63 0.1 . 1 . . . . . 22 ALA C . 51149 1 152 . 1 . 1 22 22 ALA CA C 13 50.25 0.1 . 1 . . . . . 22 ALA CA . 51149 1 153 . 1 . 1 22 22 ALA CB C 13 19.13 0.1 . 1 . . . . . 22 ALA CB . 51149 1 154 . 1 . 1 22 22 ALA N N 15 122.69 0.1 . 1 . . . . . 22 ALA N . 51149 1 155 . 1 . 1 23 23 TYR H H 1 9.52 0.02 . 1 . . . . . 23 TYR HN . 51149 1 156 . 1 . 1 23 23 TYR HA H 1 5.01 0.02 . 1 . . . . . 23 TYR HA . 51149 1 157 . 1 . 1 23 23 TYR C C 13 175.80 0.1 . 1 . . . . . 23 TYR C . 51149 1 158 . 1 . 1 23 23 TYR CA C 13 56.44 0.1 . 1 . . . . . 23 TYR CA . 51149 1 159 . 1 . 1 23 23 TYR CB C 13 42.01 0.1 . 1 . . . . . 23 TYR CB . 51149 1 160 . 1 . 1 23 23 TYR N N 15 122.69 0.1 . 1 . . . . . 23 TYR N . 51149 1 161 . 1 . 1 24 24 ARG H H 1 9.20 0.02 . 1 . . . . . 24 ARG HN . 51149 1 162 . 1 . 1 24 24 ARG HA H 1 4.73 0.02 . 1 . . . . . 24 ARG HA . 51149 1 163 . 1 . 1 24 24 ARG C C 13 175.96 0.1 . 1 . . . . . 24 ARG C . 51149 1 164 . 1 . 1 24 24 ARG CA C 13 54.72 0.1 . 1 . . . . . 24 ARG CA . 51149 1 165 . 1 . 1 24 24 ARG CB C 13 31.99 0.1 . 1 . . . . . 24 ARG CB . 51149 1 166 . 1 . 1 24 24 ARG N N 15 116.81 0.1 . 1 . . . . . 24 ARG N . 51149 1 167 . 1 . 1 25 25 ILE H H 1 8.82 0.02 . 1 . . . . . 25 ILE HN . 51149 1 168 . 1 . 1 25 25 ILE HA H 1 4.47 0.02 . 1 . . . . . 25 ILE HA . 51149 1 169 . 1 . 1 25 25 ILE HD11 H 1 0.84 0.02 . 1 . . . . . 25 ILE MD . 51149 1 170 . 1 . 1 25 25 ILE HD12 H 1 0.84 0.02 . 1 . . . . . 25 ILE MD . 51149 1 171 . 1 . 1 25 25 ILE HD13 H 1 0.84 0.02 . 1 . . . . . 25 ILE MD . 51149 1 172 . 1 . 1 25 25 ILE C C 13 176.40 0.1 . 1 . . . . . 25 ILE C . 51149 1 173 . 1 . 1 25 25 ILE CA C 13 60.61 0.1 . 1 . . . . . 25 ILE CA . 51149 1 174 . 1 . 1 25 25 ILE CB C 13 38.00 0.1 . 1 . . . . . 25 ILE CB . 51149 1 175 . 1 . 1 25 25 ILE CD1 C 13 12.71 0.1 . 1 . . . . . 25 ILE CD . 51149 1 176 . 1 . 1 25 25 ILE N N 15 120.97 0.1 . 1 . . . . . 25 ILE N . 51149 1 177 . 1 . 1 26 26 LYS H H 1 9.56 0.02 . 1 . . . . . 26 LYS HN . 51149 1 178 . 1 . 1 26 26 LYS HA H 1 4.80 0.02 . 1 . . . . . 26 LYS HA . 51149 1 179 . 1 . 1 26 26 LYS C C 13 174.95 0.1 . 1 . . . . . 26 LYS C . 51149 1 180 . 1 . 1 26 26 LYS CA C 13 53.91 0.1 . 1 . . . . . 26 LYS CA . 51149 1 181 . 1 . 1 26 26 LYS CB C 13 34.68 0.1 . 1 . . . . . 26 LYS CB . 51149 1 182 . 1 . 1 26 26 LYS N N 15 126.49 0.1 . 1 . . . . . 26 LYS N . 51149 1 183 . 1 . 1 27 27 GLN H H 1 9.21 0.02 . 1 . . . . . 27 GLN HN . 51149 1 184 . 1 . 1 27 27 GLN HA H 1 5.18 0.02 . 1 . . . . . 27 GLN HA . 51149 1 185 . 1 . 1 27 27 GLN C C 13 176.53 0.1 . 1 . . . . . 27 GLN C . 51149 1 186 . 1 . 1 27 27 GLN CA C 13 53.50 0.1 . 1 . . . . . 27 GLN CA . 51149 1 187 . 1 . 1 27 27 GLN CB C 13 32.03 0.1 . 1 . . . . . 27 GLN CB . 51149 1 188 . 1 . 1 27 27 GLN N N 15 121.87 0.1 . 1 . . . . . 27 GLN N . 51149 1 189 . 1 . 1 28 28 LYS H H 1 9.10 0.02 . 1 . . . . . 28 LYS HN . 51149 1 190 . 1 . 1 28 28 LYS HA H 1 4.43 0.02 . 1 . . . . . 28 LYS HA . 51149 1 191 . 1 . 1 28 28 LYS C C 13 176.48 0.1 . 1 . . . . . 28 LYS C . 51149 1 192 . 1 . 1 28 28 LYS CA C 13 56.88 0.1 . 1 . . . . . 28 LYS CA . 51149 1 193 . 1 . 1 28 28 LYS CB C 13 31.98 0.1 . 1 . . . . . 28 LYS CB . 51149 1 194 . 1 . 1 28 28 LYS N N 15 131.04 0.1 . 1 . . . . . 28 LYS N . 51149 1 195 . 1 . 1 29 29 GLY H H 1 7.90 0.02 . 1 . . . . . 29 GLY HN . 51149 1 196 . 1 . 1 29 29 GLY HA2 H 1 3.45 0.02 . 2 . . . . . 29 GLY HA2 . 51149 1 197 . 1 . 1 29 29 GLY HA3 H 1 3.85 0.02 . 2 . . . . . 29 GLY HA3 . 51149 1 198 . 1 . 1 29 29 GLY C C 13 175.49 0.1 . 1 . . . . . 29 GLY C . 51149 1 199 . 1 . 1 29 29 GLY CA C 13 43.76 0.1 . 1 . . . . . 29 GLY CA . 51149 1 200 . 1 . 1 29 29 GLY N N 15 115.39 0.1 . 1 . . . . . 29 GLY N . 51149 1 201 . 1 . 1 30 30 ILE H H 1 8.42 0.02 . 1 . . . . . 30 ILE HN . 51149 1 202 . 1 . 1 30 30 ILE HA H 1 4.32 0.02 . 1 . . . . . 30 ILE HA . 51149 1 203 . 1 . 1 30 30 ILE HD11 H 1 0.86 0.02 . 1 . . . . . 30 ILE MD . 51149 1 204 . 1 . 1 30 30 ILE HD12 H 1 0.86 0.02 . 1 . . . . . 30 ILE MD . 51149 1 205 . 1 . 1 30 30 ILE HD13 H 1 0.86 0.02 . 1 . . . . . 30 ILE MD . 51149 1 206 . 1 . 1 30 30 ILE C C 13 178.49 0.1 . 1 . . . . . 30 ILE C . 51149 1 207 . 1 . 1 30 30 ILE CA C 13 63.33 0.1 . 1 . . . . . 30 ILE CA . 51149 1 208 . 1 . 1 30 30 ILE CB C 13 37.16 0.1 . 1 . . . . . 30 ILE CB . 51149 1 209 . 1 . 1 30 30 ILE CD1 C 13 13.00 0.1 . 1 . . . . . 30 ILE CD . 51149 1 210 . 1 . 1 30 30 ILE N N 15 120.75 0.1 . 1 . . . . . 30 ILE N . 51149 1 211 . 1 . 1 31 31 LEU H H 1 8.33 0.02 . 1 . . . . . 31 LEU HN . 51149 1 212 . 1 . 1 31 31 LEU HA H 1 4.45 0.02 . 1 . . . . . 31 LEU HA . 51149 1 213 . 1 . 1 31 31 LEU HD11 H 1 0.84 0.02 . 2 . . . . . 31 LEU MD1 . 51149 1 214 . 1 . 1 31 31 LEU HD12 H 1 0.84 0.02 . 2 . . . . . 31 LEU MD1 . 51149 1 215 . 1 . 1 31 31 LEU HD13 H 1 0.84 0.02 . 2 . . . . . 31 LEU MD1 . 51149 1 216 . 1 . 1 31 31 LEU HD21 H 1 0.88 0.02 . 2 . . . . . 31 LEU MD2 . 51149 1 217 . 1 . 1 31 31 LEU HD22 H 1 0.88 0.02 . 2 . . . . . 31 LEU MD2 . 51149 1 218 . 1 . 1 31 31 LEU HD23 H 1 0.88 0.02 . 2 . . . . . 31 LEU MD2 . 51149 1 219 . 1 . 1 31 31 LEU C C 13 177.84 0.1 . 1 . . . . . 31 LEU C . 51149 1 220 . 1 . 1 31 31 LEU CA C 13 53.96 0.1 . 1 . . . . . 31 LEU CA . 51149 1 221 . 1 . 1 31 31 LEU CB C 13 40.89 0.1 . 1 . . . . . 31 LEU CB . 51149 1 222 . 1 . 1 31 31 LEU CD1 C 13 25.03 0.1 . 2 . . . . . 31 LEU CD1 . 51149 1 223 . 1 . 1 31 31 LEU CD2 C 13 22.53 0.1 . 2 . . . . . 31 LEU CD2 . 51149 1 224 . 1 . 1 31 31 LEU N N 15 118.84 0.1 . 1 . . . . . 31 LEU N . 51149 1 225 . 1 . 1 32 32 GLY H H 1 7.43 0.02 . 1 . . . . . 32 GLY HN . 51149 1 226 . 1 . 1 32 32 GLY HA2 H 1 4.00 0.02 . 2 . . . . . 32 GLY HA2 . 51149 1 227 . 1 . 1 32 32 GLY HA3 H 1 3.67 0.02 . 2 . . . . . 32 GLY HA3 . 51149 1 228 . 1 . 1 32 32 GLY C C 13 174.35 0.1 . 1 . . . . . 32 GLY C . 51149 1 229 . 1 . 1 32 32 GLY CA C 13 43.95 0.1 . 1 . . . . . 32 GLY CA . 51149 1 230 . 1 . 1 32 32 GLY N N 15 107.47 0.1 . 1 . . . . . 32 GLY N . 51149 1 231 . 1 . 1 33 33 TYR H H 1 8.83 0.02 . 1 . . . . . 33 TYR HN . 51149 1 232 . 1 . 1 33 33 TYR HA H 1 4.99 0.02 . 1 . . . . . 33 TYR HA . 51149 1 233 . 1 . 1 33 33 TYR C C 13 177.81 0.1 . 1 . . . . . 33 TYR C . 51149 1 234 . 1 . 1 33 33 TYR CA C 13 57.90 0.1 . 1 . . . . . 33 TYR CA . 51149 1 235 . 1 . 1 33 33 TYR CB C 13 40.05 0.1 . 1 . . . . . 33 TYR CB . 51149 1 236 . 1 . 1 33 33 TYR N N 15 120.39 0.1 . 1 . . . . . 33 TYR N . 51149 1 237 . 1 . 1 34 34 SER H H 1 8.60 0.02 . 1 . . . . . 34 SER HN . 51149 1 238 . 1 . 1 34 34 SER HA H 1 4.51 0.02 . 1 . . . . . 34 SER HA . 51149 1 239 . 1 . 1 34 34 SER C C 13 174.52 0.1 . 1 . . . . . 34 SER C . 51149 1 240 . 1 . 1 34 34 SER CA C 13 56.65 0.1 . 1 . . . . . 34 SER CA . 51149 1 241 . 1 . 1 34 34 SER CB C 13 64.63 0.1 . 1 . . . . . 34 SER CB . 51149 1 242 . 1 . 1 34 34 SER N N 15 115.53 0.1 . 1 . . . . . 34 SER N . 51149 1 243 . 1 . 1 35 35 GLN H H 1 9.30 0.02 . 1 . . . . . 35 GLN HN . 51149 1 244 . 1 . 1 35 35 GLN C C 13 176.56 0.1 . 1 . . . . . 35 GLN C . 51149 1 245 . 1 . 1 35 35 GLN CA C 13 56.03 0.1 . 1 . . . . . 35 GLN CA . 51149 1 246 . 1 . 1 35 35 GLN CB C 13 27.92 0.1 . 1 . . . . . 35 GLN CB . 51149 1 247 . 1 . 1 35 35 GLN N N 15 125.21 0.1 . 1 . . . . . 35 GLN N . 51149 1 248 . 1 . 1 36 36 ILE H H 1 8.68 0.02 . 1 . . . . . 36 ILE HN . 51149 1 249 . 1 . 1 36 36 ILE HA H 1 4.58 0.02 . 1 . . . . . 36 ILE HA . 51149 1 250 . 1 . 1 36 36 ILE HD11 H 1 0.80 0.02 . 1 . . . . . 36 ILE MD . 51149 1 251 . 1 . 1 36 36 ILE HD12 H 1 0.80 0.02 . 1 . . . . . 36 ILE MD . 51149 1 252 . 1 . 1 36 36 ILE HD13 H 1 0.80 0.02 . 1 . . . . . 36 ILE MD . 51149 1 253 . 1 . 1 36 36 ILE C C 13 175.95 0.1 . 1 . . . . . 36 ILE C . 51149 1 254 . 1 . 1 36 36 ILE CA C 13 60.36 0.1 . 1 . . . . . 36 ILE CA . 51149 1 255 . 1 . 1 36 36 ILE CB C 13 38.97 0.1 . 1 . . . . . 36 ILE CB . 51149 1 256 . 1 . 1 36 36 ILE CD1 C 13 14.85 0.1 . 1 . . . . . 36 ILE CD . 51149 1 257 . 1 . 1 36 36 ILE N N 15 119.60 0.1 . 1 . . . . . 36 ILE N . 51149 1 258 . 1 . 1 37 37 GLY H H 1 7.75 0.02 . 1 . . . . . 37 GLY HN . 51149 1 259 . 1 . 1 37 37 GLY HA2 H 1 4.02 0.02 . 2 . . . . . 37 GLY HA2 . 51149 1 260 . 1 . 1 37 37 GLY HA3 H 1 4.48 0.02 . 2 . . . . . 37 GLY HA3 . 51149 1 261 . 1 . 1 37 37 GLY C C 13 171.68 0.1 . 1 . . . . . 37 GLY C . 51149 1 262 . 1 . 1 37 37 GLY CA C 13 45.77 0.1 . 1 . . . . . 37 GLY CA . 51149 1 263 . 1 . 1 37 37 GLY N N 15 109.73 0.1 . 1 . . . . . 37 GLY N . 51149 1 264 . 1 . 1 38 38 ALA H H 1 9.24 0.02 . 1 . . . . . 38 ALA HN . 51149 1 265 . 1 . 1 38 38 ALA HA H 1 5.49 0.02 . 1 . . . . . 38 ALA HA . 51149 1 266 . 1 . 1 38 38 ALA C C 13 176.14 0.1 . 1 . . . . . 38 ALA C . 51149 1 267 . 1 . 1 38 38 ALA CA C 13 50.32 0.1 . 1 . . . . . 38 ALA CA . 51149 1 268 . 1 . 1 38 38 ALA CB C 13 22.70 0.1 . 1 . . . . . 38 ALA CB . 51149 1 269 . 1 . 1 38 38 ALA N N 15 124.26 0.1 . 1 . . . . . 38 ALA N . 51149 1 270 . 1 . 1 39 39 GLY H H 1 8.78 0.02 . 1 . . . . . 39 GLY HN . 51149 1 271 . 1 . 1 39 39 GLY HA2 H 1 4.09 0.02 . 2 . . . . . 39 GLY HA2 . 51149 1 272 . 1 . 1 39 39 GLY HA3 H 1 3.51 0.02 . 2 . . . . . 39 GLY HA3 . 51149 1 273 . 1 . 1 39 39 GLY C C 13 174.08 0.1 . 1 . . . . . 39 GLY C . 51149 1 274 . 1 . 1 39 39 GLY CA C 13 46.36 0.1 . 1 . . . . . 39 GLY CA . 51149 1 275 . 1 . 1 39 39 GLY N N 15 104.29 0.1 . 1 . . . . . 39 GLY N . 51149 1 276 . 1 . 1 40 40 VAL H H 1 8.41 0.02 . 1 . . . . . 40 VAL HN . 51149 1 277 . 1 . 1 40 40 VAL HA H 1 5.28 0.02 . 1 . . . . . 40 VAL HA . 51149 1 278 . 1 . 1 40 40 VAL HG11 H 1 0.93 0.02 . 2 . . . . . 40 VAL MG1 . 51149 1 279 . 1 . 1 40 40 VAL HG12 H 1 0.93 0.02 . 2 . . . . . 40 VAL MG1 . 51149 1 280 . 1 . 1 40 40 VAL HG13 H 1 0.93 0.02 . 2 . . . . . 40 VAL MG1 . 51149 1 281 . 1 . 1 40 40 VAL HG21 H 1 0.85 0.02 . 2 . . . . . 40 VAL MG2 . 51149 1 282 . 1 . 1 40 40 VAL HG22 H 1 0.85 0.02 . 2 . . . . . 40 VAL MG2 . 51149 1 283 . 1 . 1 40 40 VAL HG23 H 1 0.85 0.02 . 2 . . . . . 40 VAL MG2 . 51149 1 284 . 1 . 1 40 40 VAL C C 13 176.05 0.1 . 1 . . . . . 40 VAL C . 51149 1 285 . 1 . 1 40 40 VAL CA C 13 59.40 0.1 . 1 . . . . . 40 VAL CA . 51149 1 286 . 1 . 1 40 40 VAL CB C 13 36.34 0.1 . 1 . . . . . 40 VAL CB . 51149 1 287 . 1 . 1 40 40 VAL CG1 C 13 21.87 0.1 . 2 . . . . . 40 VAL CG1 . 51149 1 288 . 1 . 1 40 40 VAL CG2 C 13 22.21 0.1 . 2 . . . . . 40 VAL CG2 . 51149 1 289 . 1 . 1 40 40 VAL N N 15 115.90 0.1 . 1 . . . . . 40 VAL N . 51149 1 290 . 1 . 1 41 41 TYR H H 1 10.16 0.02 . 1 . . . . . 41 TYR HN . 51149 1 291 . 1 . 1 41 41 TYR HA H 1 5.28 0.02 . 1 . . . . . 41 TYR HA . 51149 1 292 . 1 . 1 41 41 TYR C C 13 176.08 0.1 . 1 . . . . . 41 TYR C . 51149 1 293 . 1 . 1 41 41 TYR CA C 13 56.83 0.1 . 1 . . . . . 41 TYR CA . 51149 1 294 . 1 . 1 41 41 TYR CB C 13 40.53 0.1 . 1 . . . . . 41 TYR CB . 51149 1 295 . 1 . 1 41 41 TYR N N 15 134.45 0.1 . 1 . . . . . 41 TYR N . 51149 1 296 . 1 . 1 42 42 LYS H H 1 8.94 0.02 . 1 . . . . . 42 LYS HN . 51149 1 297 . 1 . 1 42 42 LYS HA H 1 4.53 0.02 . 1 . . . . . 42 LYS HA . 51149 1 298 . 1 . 1 42 42 LYS C C 13 175.66 0.1 . 1 . . . . . 42 LYS C . 51149 1 299 . 1 . 1 42 42 LYS CA C 13 55.81 0.1 . 1 . . . . . 42 LYS CA . 51149 1 300 . 1 . 1 42 42 LYS CB C 13 35.73 0.1 . 1 . . . . . 42 LYS CB . 51149 1 301 . 1 . 1 42 42 LYS N N 15 127.86 0.1 . 1 . . . . . 42 LYS N . 51149 1 302 . 1 . 1 43 43 GLU H H 1 9.30 0.02 . 1 . . . . . 43 GLU HN . 51149 1 303 . 1 . 1 43 43 GLU HA H 1 3.88 0.02 . 1 . . . . . 43 GLU HA . 51149 1 304 . 1 . 1 43 43 GLU C C 13 177.49 0.1 . 1 . . . . . 43 GLU C . 51149 1 305 . 1 . 1 43 43 GLU CA C 13 56.42 0.1 . 1 . . . . . 43 GLU CA . 51149 1 306 . 1 . 1 43 43 GLU CB C 13 27.53 0.1 . 1 . . . . . 43 GLU CB . 51149 1 307 . 1 . 1 43 43 GLU N N 15 125.97 0.1 . 1 . . . . . 43 GLU N . 51149 1 308 . 1 . 1 44 44 GLY H H 1 8.50 0.02 . 1 . . . . . 44 GLY HN . 51149 1 309 . 1 . 1 44 44 GLY HA2 H 1 3.62 0.02 . 2 . . . . . 44 GLY HA2 . 51149 1 310 . 1 . 1 44 44 GLY HA3 H 1 4.14 0.02 . 2 . . . . . 44 GLY HA3 . 51149 1 311 . 1 . 1 44 44 GLY C C 13 174.73 0.1 . 1 . . . . . 44 GLY C . 51149 1 312 . 1 . 1 44 44 GLY CA C 13 45.36 0.1 . 1 . . . . . 44 GLY CA . 51149 1 313 . 1 . 1 44 44 GLY N N 15 104.46 0.1 . 1 . . . . . 44 GLY N . 51149 1 314 . 1 . 1 45 45 THR H H 1 7.46 0.02 . 1 . . . . . 45 THR HN . 51149 1 315 . 1 . 1 45 45 THR HA H 1 4.56 0.02 . 1 . . . . . 45 THR HA . 51149 1 316 . 1 . 1 45 45 THR C C 13 173.17 0.1 . 1 . . . . . 45 THR C . 51149 1 317 . 1 . 1 45 45 THR CA C 13 60.29 0.1 . 1 . . . . . 45 THR CA . 51149 1 318 . 1 . 1 45 45 THR CB C 13 71.33 0.1 . 1 . . . . . 45 THR CB . 51149 1 319 . 1 . 1 45 45 THR N N 15 117.06 0.1 . 1 . . . . . 45 THR N . 51149 1 320 . 1 . 1 46 46 PHE H H 1 9.02 0.02 . 1 . . . . . 46 PHE HN . 51149 1 321 . 1 . 1 46 46 PHE HA H 1 4.94 0.02 . 1 . . . . . 46 PHE HA . 51149 1 322 . 1 . 1 46 46 PHE C C 13 173.82 0.1 . 1 . . . . . 46 PHE C . 51149 1 323 . 1 . 1 46 46 PHE CA C 13 56.80 0.1 . 1 . . . . . 46 PHE CA . 51149 1 324 . 1 . 1 46 46 PHE CB C 13 39.56 0.1 . 1 . . . . . 46 PHE CB . 51149 1 325 . 1 . 1 46 46 PHE N N 15 126.17 0.1 . 1 . . . . . 46 PHE N . 51149 1 326 . 1 . 1 47 47 HIS H H 1 8.03 0.02 . 1 . . . . . 47 HIS HN . 51149 1 327 . 1 . 1 47 47 HIS C C 13 174.50 0.1 . 1 . . . . . 47 HIS C . 51149 1 328 . 1 . 1 47 47 HIS CA C 13 55.04 0.1 . 1 . . . . . 47 HIS CA . 51149 1 329 . 1 . 1 47 47 HIS CB C 13 29.86 0.1 . 1 . . . . . 47 HIS CB . 51149 1 330 . 1 . 1 47 47 HIS N N 15 127.01 0.1 . 1 . . . . . 47 HIS N . 51149 1 331 . 1 . 1 48 48 THR H H 1 9.00 0.02 . 1 . . . . . 48 THR HN . 51149 1 332 . 1 . 1 48 48 THR HA H 1 4.11 0.02 . 1 . . . . . 48 THR HA . 51149 1 333 . 1 . 1 48 48 THR C C 13 173.43 0.1 . 1 . . . . . 48 THR C . 51149 1 334 . 1 . 1 48 48 THR CA C 13 59.86 0.1 . 1 . . . . . 48 THR CA . 51149 1 335 . 1 . 1 48 48 THR CB C 13 67.01 0.1 . 1 . . . . . 48 THR CB . 51149 1 336 . 1 . 1 48 48 THR N N 15 117.38 0.1 . 1 . . . . . 48 THR N . 51149 1 337 . 1 . 1 49 49 MET H H 1 8.73 0.02 . 1 . . . . . 49 MET HN . 51149 1 338 . 1 . 1 49 49 MET HA H 1 4.40 0.02 . 1 . . . . . 49 MET HA . 51149 1 339 . 1 . 1 49 49 MET C C 13 178.47 0.1 . 1 . . . . . 49 MET C . 51149 1 340 . 1 . 1 49 49 MET CA C 13 53.69 0.1 . 1 . . . . . 49 MET CA . 51149 1 341 . 1 . 1 49 49 MET CB C 13 32.88 0.1 . 1 . . . . . 49 MET CB . 51149 1 342 . 1 . 1 49 49 MET N N 15 117.07 0.1 . 1 . . . . . 49 MET N . 51149 1 343 . 1 . 1 50 50 TRP H H 1 7.50 0.02 . 1 . . . . . 50 TRP HN . 51149 1 344 . 1 . 1 50 50 TRP HA H 1 3.91 0.02 . 1 . . . . . 50 TRP HA . 51149 1 345 . 1 . 1 50 50 TRP C C 13 179.63 0.1 . 1 . . . . . 50 TRP C . 51149 1 346 . 1 . 1 50 50 TRP CA C 13 60.65 0.1 . 1 . . . . . 50 TRP CA . 51149 1 347 . 1 . 1 50 50 TRP CB C 13 26.95 0.1 . 1 . . . . . 50 TRP CB . 51149 1 348 . 1 . 1 50 50 TRP N N 15 125.68 0.1 . 1 . . . . . 50 TRP N . 51149 1 349 . 1 . 1 51 51 HIS H H 1 10.25 0.02 . 1 . . . . . 51 HIS HN . 51149 1 350 . 1 . 1 51 51 HIS HA H 1 3.51 0.02 . 1 . . . . . 51 HIS HA . 51149 1 351 . 1 . 1 51 51 HIS C C 13 176.32 0.1 . 1 . . . . . 51 HIS C . 51149 1 352 . 1 . 1 51 51 HIS CA C 13 58.57 0.1 . 1 . . . . . 51 HIS CA . 51149 1 353 . 1 . 1 51 51 HIS CB C 13 26.66 0.1 . 1 . . . . . 51 HIS CB . 51149 1 354 . 1 . 1 51 51 HIS N N 15 113.65 0.1 . 1 . . . . . 51 HIS N . 51149 1 355 . 1 . 1 52 52 VAL H H 1 6.84 0.02 . 1 . . . . . 52 VAL HN . 51149 1 356 . 1 . 1 52 52 VAL HA H 1 4.21 0.02 . 1 . . . . . 52 VAL HA . 51149 1 357 . 1 . 1 52 52 VAL C C 13 176.65 0.1 . 1 . . . . . 52 VAL C . 51149 1 358 . 1 . 1 52 52 VAL CA C 13 64.38 0.1 . 1 . . . . . 52 VAL CA . 51149 1 359 . 1 . 1 52 52 VAL CB C 13 30.74 0.1 . 1 . . . . . 52 VAL CB . 51149 1 360 . 1 . 1 52 52 VAL N N 15 118.06 0.1 . 1 . . . . . 52 VAL N . 51149 1 361 . 1 . 1 53 53 THR H H 1 6.42 0.02 . 1 . . . . . 53 THR HN . 51149 1 362 . 1 . 1 53 53 THR HA H 1 4.22 0.02 . 1 . . . . . 53 THR HA . 51149 1 363 . 1 . 1 53 53 THR C C 13 176.59 0.1 . 1 . . . . . 53 THR C . 51149 1 364 . 1 . 1 53 53 THR CA C 13 60.46 0.1 . 1 . . . . . 53 THR CA . 51149 1 365 . 1 . 1 53 53 THR CB C 13 69.24 0.1 . 1 . . . . . 53 THR CB . 51149 1 366 . 1 . 1 53 53 THR N N 15 101.40 0.1 . 1 . . . . . 53 THR N . 51149 1 367 . 1 . 1 54 54 ARG H H 1 9.05 0.02 . 1 . . . . . 54 ARG HN . 51149 1 368 . 1 . 1 54 54 ARG HA H 1 4.51 0.02 . 1 . . . . . 54 ARG HA . 51149 1 369 . 1 . 1 54 54 ARG C C 13 176.64 0.1 . 1 . . . . . 54 ARG C . 51149 1 370 . 1 . 1 54 54 ARG CA C 13 55.45 0.1 . 1 . . . . . 54 ARG CA . 51149 1 371 . 1 . 1 54 54 ARG CB C 13 26.36 0.1 . 1 . . . . . 54 ARG CB . 51149 1 372 . 1 . 1 54 54 ARG N N 15 121.05 0.1 . 1 . . . . . 54 ARG N . 51149 1 373 . 1 . 1 55 55 GLY H H 1 6.91 0.02 . 1 . . . . . 55 GLY HN . 51149 1 374 . 1 . 1 55 55 GLY HA2 H 1 4.14 0.02 . 2 . . . . . 55 GLY HA2 . 51149 1 375 . 1 . 1 55 55 GLY HA3 H 1 4.14 0.02 . 2 . . . . . 55 GLY HA3 . 51149 1 376 . 1 . 1 55 55 GLY C C 13 174.20 0.1 . 1 . . . . . 55 GLY C . 51149 1 377 . 1 . 1 55 55 GLY CA C 13 44.55 0.1 . 1 . . . . . 55 GLY CA . 51149 1 378 . 1 . 1 55 55 GLY N N 15 101.09 0.1 . 1 . . . . . 55 GLY N . 51149 1 379 . 1 . 1 56 56 ALA H H 1 7.41 0.02 . 1 . . . . . 56 ALA HN . 51149 1 380 . 1 . 1 56 56 ALA HA H 1 4.25 0.02 . 1 . . . . . 56 ALA HA . 51149 1 381 . 1 . 1 56 56 ALA C C 13 178.83 0.1 . 1 . . . . . 56 ALA C . 51149 1 382 . 1 . 1 56 56 ALA CA C 13 51.52 0.1 . 1 . . . . . 56 ALA CA . 51149 1 383 . 1 . 1 56 56 ALA CB C 13 18.89 0.1 . 1 . . . . . 56 ALA CB . 51149 1 384 . 1 . 1 56 56 ALA N N 15 120.80 0.1 . 1 . . . . . 56 ALA N . 51149 1 385 . 1 . 1 57 57 VAL H H 1 8.45 0.02 . 1 . . . . . 57 VAL HN . 51149 1 386 . 1 . 1 57 57 VAL HA H 1 4.41 0.02 . 1 . . . . . 57 VAL HA . 51149 1 387 . 1 . 1 57 57 VAL HG11 H 1 1.10 0.02 . 2 . . . . . 57 VAL MG1 . 51149 1 388 . 1 . 1 57 57 VAL HG12 H 1 1.10 0.02 . 2 . . . . . 57 VAL MG1 . 51149 1 389 . 1 . 1 57 57 VAL HG13 H 1 1.10 0.02 . 2 . . . . . 57 VAL MG1 . 51149 1 390 . 1 . 1 57 57 VAL HG21 H 1 0.98 0.02 . 2 . . . . . 57 VAL MG2 . 51149 1 391 . 1 . 1 57 57 VAL HG22 H 1 0.98 0.02 . 2 . . . . . 57 VAL MG2 . 51149 1 392 . 1 . 1 57 57 VAL HG23 H 1 0.98 0.02 . 2 . . . . . 57 VAL MG2 . 51149 1 393 . 1 . 1 57 57 VAL C C 13 175.10 0.1 . 1 . . . . . 57 VAL C . 51149 1 394 . 1 . 1 57 57 VAL CA C 13 63.63 0.1 . 1 . . . . . 57 VAL CA . 51149 1 395 . 1 . 1 57 57 VAL CB C 13 31.95 0.1 . 1 . . . . . 57 VAL CB . 51149 1 396 . 1 . 1 57 57 VAL CG1 C 13 21.62 0.1 . 2 . . . . . 57 VAL CG1 . 51149 1 397 . 1 . 1 57 57 VAL CG2 C 13 22.34 0.1 . 2 . . . . . 57 VAL CG2 . 51149 1 398 . 1 . 1 57 57 VAL N N 15 120.29 0.1 . 1 . . . . . 57 VAL N . 51149 1 399 . 1 . 1 58 58 LEU H H 1 7.94 0.02 . 1 . . . . . 58 LEU HN . 51149 1 400 . 1 . 1 58 58 LEU HD11 H 1 0.42 0.02 . 2 . . . . . 58 LEU MD1 . 51149 1 401 . 1 . 1 58 58 LEU HD12 H 1 0.42 0.02 . 2 . . . . . 58 LEU MD1 . 51149 1 402 . 1 . 1 58 58 LEU HD13 H 1 0.42 0.02 . 2 . . . . . 58 LEU MD1 . 51149 1 403 . 1 . 1 58 58 LEU HD21 H 1 -0.40 0.02 . 2 . . . . . 58 LEU MD2 . 51149 1 404 . 1 . 1 58 58 LEU HD22 H 1 -0.40 0.02 . 2 . . . . . 58 LEU MD2 . 51149 1 405 . 1 . 1 58 58 LEU HD23 H 1 -0.40 0.02 . 2 . . . . . 58 LEU MD2 . 51149 1 406 . 1 . 1 58 58 LEU C C 13 176.00 0.1 . 1 . . . . . 58 LEU C . 51149 1 407 . 1 . 1 58 58 LEU CA C 13 52.22 0.1 . 1 . . . . . 58 LEU CA . 51149 1 408 . 1 . 1 58 58 LEU CB C 13 43.84 0.1 . 1 . . . . . 58 LEU CB . 51149 1 409 . 1 . 1 58 58 LEU CD1 C 13 24.39 0.1 . 2 . . . . . 58 LEU CD1 . 51149 1 410 . 1 . 1 58 58 LEU CD2 C 13 25.44 0.1 . 2 . . . . . 58 LEU CD2 . 51149 1 411 . 1 . 1 58 58 LEU N N 15 122.39 0.1 . 1 . . . . . 58 LEU N . 51149 1 412 . 1 . 1 59 59 MET H H 1 8.17 0.02 . 1 . . . . . 59 MET HN . 51149 1 413 . 1 . 1 59 59 MET HA H 1 4.38 0.02 . 1 . . . . . 59 MET HA . 51149 1 414 . 1 . 1 59 59 MET C C 13 176.99 0.1 . 1 . . . . . 59 MET C . 51149 1 415 . 1 . 1 59 59 MET CA C 13 52.50 0.1 . 1 . . . . . 59 MET CA . 51149 1 416 . 1 . 1 59 59 MET CB C 13 33.43 0.1 . 1 . . . . . 59 MET CB . 51149 1 417 . 1 . 1 59 59 MET N N 15 117.23 0.1 . 1 . . . . . 59 MET N . 51149 1 418 . 1 . 1 60 60 HIS H H 1 8.81 0.02 . 1 . . . . . 60 HIS HN . 51149 1 419 . 1 . 1 60 60 HIS HA H 1 4.56 0.02 . 1 . . . . . 60 HIS HA . 51149 1 420 . 1 . 1 60 60 HIS C C 13 175.48 0.1 . 1 . . . . . 60 HIS C . 51149 1 421 . 1 . 1 60 60 HIS CA C 13 55.74 0.1 . 1 . . . . . 60 HIS CA . 51149 1 422 . 1 . 1 60 60 HIS CB C 13 31.20 0.1 . 1 . . . . . 60 HIS CB . 51149 1 423 . 1 . 1 60 60 HIS N N 15 119.54 0.1 . 1 . . . . . 60 HIS N . 51149 1 424 . 1 . 1 61 61 LYS H H 1 9.55 0.02 . 1 . . . . . 61 LYS HN . 51149 1 425 . 1 . 1 61 61 LYS HA H 1 4.13 0.02 . 1 . . . . . 61 LYS HA . 51149 1 426 . 1 . 1 61 61 LYS C C 13 177.64 0.1 . 1 . . . . . 61 LYS C . 51149 1 427 . 1 . 1 61 61 LYS CA C 13 56.46 0.1 . 1 . . . . . 61 LYS CA . 51149 1 428 . 1 . 1 61 61 LYS CB C 13 29.01 0.1 . 1 . . . . . 61 LYS CB . 51149 1 429 . 1 . 1 61 61 LYS N N 15 128.40 0.1 . 1 . . . . . 61 LYS N . 51149 1 430 . 1 . 1 62 62 GLY H H 1 8.77 0.02 . 1 . . . . . 62 GLY HN . 51149 1 431 . 1 . 1 62 62 GLY HA2 H 1 3.53 0.02 . 2 . . . . . 62 GLY HA2 . 51149 1 432 . 1 . 1 62 62 GLY HA3 H 1 3.67 0.02 . 2 . . . . . 62 GLY HA3 . 51149 1 433 . 1 . 1 62 62 GLY C C 13 174.75 0.1 . 1 . . . . . 62 GLY C . 51149 1 434 . 1 . 1 62 62 GLY CA C 13 44.75 0.1 . 1 . . . . . 62 GLY CA . 51149 1 435 . 1 . 1 62 62 GLY N N 15 104.27 0.1 . 1 . . . . . 62 GLY N . 51149 1 436 . 1 . 1 63 63 LYS H H 1 7.89 0.02 . 1 . . . . . 63 LYS HN . 51149 1 437 . 1 . 1 63 63 LYS HA H 1 4.52 0.02 . 1 . . . . . 63 LYS HA . 51149 1 438 . 1 . 1 63 63 LYS C C 13 175.92 0.1 . 1 . . . . . 63 LYS C . 51149 1 439 . 1 . 1 63 63 LYS CA C 13 54.41 0.1 . 1 . . . . . 63 LYS CA . 51149 1 440 . 1 . 1 63 63 LYS CB C 13 32.82 0.1 . 1 . . . . . 63 LYS CB . 51149 1 441 . 1 . 1 63 63 LYS N N 15 121.88 0.1 . 1 . . . . . 63 LYS N . 51149 1 442 . 1 . 1 64 64 ARG H H 1 8.41 0.02 . 1 . . . . . 64 ARG HN . 51149 1 443 . 1 . 1 64 64 ARG HA H 1 4.52 0.02 . 1 . . . . . 64 ARG HA . 51149 1 444 . 1 . 1 64 64 ARG C C 13 177.37 0.1 . 1 . . . . . 64 ARG C . 51149 1 445 . 1 . 1 64 64 ARG CA C 13 55.59 0.1 . 1 . . . . . 64 ARG CA . 51149 1 446 . 1 . 1 64 64 ARG CB C 13 31.35 0.1 . 1 . . . . . 64 ARG CB . 51149 1 447 . 1 . 1 64 64 ARG N N 15 123.57 0.1 . 1 . . . . . 64 ARG N . 51149 1 448 . 1 . 1 65 65 ILE H H 1 9.36 0.02 . 1 . . . . . 65 ILE HN . 51149 1 449 . 1 . 1 65 65 ILE HA H 1 4.40 0.02 . 1 . . . . . 65 ILE HA . 51149 1 450 . 1 . 1 65 65 ILE HD11 H 1 0.52 0.02 . 1 . . . . . 65 ILE MD . 51149 1 451 . 1 . 1 65 65 ILE HD12 H 1 0.52 0.02 . 1 . . . . . 65 ILE MD . 51149 1 452 . 1 . 1 65 65 ILE HD13 H 1 0.52 0.02 . 1 . . . . . 65 ILE MD . 51149 1 453 . 1 . 1 65 65 ILE C C 13 175.79 0.1 . 1 . . . . . 65 ILE C . 51149 1 454 . 1 . 1 65 65 ILE CA C 13 60.50 0.1 . 1 . . . . . 65 ILE CA . 51149 1 455 . 1 . 1 65 65 ILE CB C 13 38.66 0.1 . 1 . . . . . 65 ILE CB . 51149 1 456 . 1 . 1 65 65 ILE CD1 C 13 13.45 0.1 . 1 . . . . . 65 ILE CD . 51149 1 457 . 1 . 1 65 65 ILE N N 15 125.46 0.1 . 1 . . . . . 65 ILE N . 51149 1 458 . 1 . 1 66 66 GLU H H 1 8.65 0.02 . 1 . . . . . 66 GLU HN . 51149 1 459 . 1 . 1 66 66 GLU HA H 1 4.41 0.02 . 1 . . . . . 66 GLU HA . 51149 1 460 . 1 . 1 66 66 GLU CA C 13 53.89 0.1 . 1 . . . . . 66 GLU CA . 51149 1 461 . 1 . 1 66 66 GLU CB C 13 29.06 0.1 . 1 . . . . . 66 GLU CB . 51149 1 462 . 1 . 1 66 66 GLU N N 15 125.08 0.1 . 1 . . . . . 66 GLU N . 51149 1 463 . 1 . 1 67 67 PRO HA H 1 4.66 0.02 . 1 . . . . . 67 PRO HA . 51149 1 464 . 1 . 1 67 67 PRO C C 13 177.48 0.1 . 1 . . . . . 67 PRO C . 51149 1 465 . 1 . 1 67 67 PRO CA C 13 62.84 0.1 . 1 . . . . . 67 PRO CA . 51149 1 466 . 1 . 1 67 67 PRO CB C 13 30.83 0.1 . 1 . . . . . 67 PRO CB . 51149 1 467 . 1 . 1 68 68 SER H H 1 9.83 0.02 . 1 . . . . . 68 SER HN . 51149 1 468 . 1 . 1 68 68 SER HA H 1 3.75 0.02 . 1 . . . . . 68 SER HA . 51149 1 469 . 1 . 1 68 68 SER C C 13 174.49 0.1 . 1 . . . . . 68 SER C . 51149 1 470 . 1 . 1 68 68 SER CA C 13 58.63 0.1 . 1 . . . . . 68 SER CA . 51149 1 471 . 1 . 1 68 68 SER CB C 13 64.51 0.1 . 1 . . . . . 68 SER CB . 51149 1 472 . 1 . 1 68 68 SER N N 15 115.094 0.1 . 1 . . . . . 68 SER N . 51149 1 473 . 1 . 1 69 69 TRP H H 1 7.90 0.02 . 1 . . . . . 69 TRP HN . 51149 1 474 . 1 . 1 69 69 TRP HA H 1 4.53 0.02 . 1 . . . . . 69 TRP HA . 51149 1 475 . 1 . 1 69 69 TRP C C 13 173.51 0.1 . 1 . . . . . 69 TRP C . 51149 1 476 . 1 . 1 69 69 TRP CA C 13 57.46 0.1 . 1 . . . . . 69 TRP CA . 51149 1 477 . 1 . 1 69 69 TRP CB C 13 29.50 0.1 . 1 . . . . . 69 TRP CB . 51149 1 478 . 1 . 1 69 69 TRP N N 15 123.69 0.1 . 1 . . . . . 69 TRP N . 51149 1 479 . 1 . 1 70 70 ALA H H 1 7.08 0.02 . 1 . . . . . 70 ALA HN . 51149 1 480 . 1 . 1 70 70 ALA HA H 1 4.19 0.02 . 1 . . . . . 70 ALA HA . 51149 1 481 . 1 . 1 70 70 ALA C C 13 175.71 0.1 . 1 . . . . . 70 ALA C . 51149 1 482 . 1 . 1 70 70 ALA CA C 13 51.30 0.1 . 1 . . . . . 70 ALA CA . 51149 1 483 . 1 . 1 70 70 ALA CB C 13 21.97 0.1 . 1 . . . . . 70 ALA CB . 51149 1 484 . 1 . 1 70 70 ALA N N 15 125.29 0.1 . 1 . . . . . 70 ALA N . 51149 1 485 . 1 . 1 71 71 ASP H H 1 7.63 0.02 . 1 . . . . . 71 ASP HN . 51149 1 486 . 1 . 1 71 71 ASP HA H 1 4.23 0.02 . 1 . . . . . 71 ASP HA . 51149 1 487 . 1 . 1 71 71 ASP C C 13 177.37 0.1 . 1 . . . . . 71 ASP C . 51149 1 488 . 1 . 1 71 71 ASP CA C 13 52.36 0.1 . 1 . . . . . 71 ASP CA . 51149 1 489 . 1 . 1 71 71 ASP CB C 13 42.54 0.1 . 1 . . . . . 71 ASP CB . 51149 1 490 . 1 . 1 71 71 ASP N N 15 117.31 0.1 . 1 . . . . . 71 ASP N . 51149 1 491 . 1 . 1 72 72 VAL H H 1 8.29 0.02 . 1 . . . . . 72 VAL HN . 51149 1 492 . 1 . 1 72 72 VAL HA H 1 3.96 0.02 . 1 . . . . . 72 VAL HA . 51149 1 493 . 1 . 1 72 72 VAL HG11 H 1 0.15 0.02 . 2 . . . . . 72 VAL MG1 . 51149 1 494 . 1 . 1 72 72 VAL HG12 H 1 0.15 0.02 . 2 . . . . . 72 VAL MG1 . 51149 1 495 . 1 . 1 72 72 VAL HG13 H 1 0.15 0.02 . 2 . . . . . 72 VAL MG1 . 51149 1 496 . 1 . 1 72 72 VAL HG21 H 1 -0.09 0.02 . 2 . . . . . 72 VAL MG2 . 51149 1 497 . 1 . 1 72 72 VAL HG22 H 1 -0.09 0.02 . 2 . . . . . 72 VAL MG2 . 51149 1 498 . 1 . 1 72 72 VAL HG23 H 1 -0.09 0.02 . 2 . . . . . 72 VAL MG2 . 51149 1 499 . 1 . 1 72 72 VAL C C 13 178.34 0.1 . 1 . . . . . 72 VAL C . 51149 1 500 . 1 . 1 72 72 VAL CA C 13 65.49 0.1 . 1 . . . . . 72 VAL CA . 51149 1 501 . 1 . 1 72 72 VAL CB C 13 30.60 0.1 . 1 . . . . . 72 VAL CB . 51149 1 502 . 1 . 1 72 72 VAL CG1 C 13 19.80 0.1 . 2 . . . . . 72 VAL CG1 . 51149 1 503 . 1 . 1 72 72 VAL CG2 C 13 19.87 0.1 . 2 . . . . . 72 VAL CG2 . 51149 1 504 . 1 . 1 72 72 VAL N N 15 124.63 0.1 . 1 . . . . . 72 VAL N . 51149 1 505 . 1 . 1 73 73 LYS H H 1 7.66 0.02 . 1 . . . . . 73 LYS HN . 51149 1 506 . 1 . 1 73 73 LYS C C 13 179.46 0.1 . 1 . . . . . 73 LYS C . 51149 1 507 . 1 . 1 73 73 LYS CA C 13 58.76 0.1 . 1 . . . . . 73 LYS CA . 51149 1 508 . 1 . 1 73 73 LYS CB C 13 31.14 0.1 . 1 . . . . . 73 LYS CB . 51149 1 509 . 1 . 1 73 73 LYS N N 15 119.25 0.1 . 1 . . . . . 73 LYS N . 51149 1 510 . 1 . 1 74 74 LYS H H 1 7.35 0.02 . 1 . . . . . 74 LYS HN . 51149 1 511 . 1 . 1 74 74 LYS HA H 1 4.13 0.02 . 1 . . . . . 74 LYS HA . 51149 1 512 . 1 . 1 74 74 LYS C C 13 176.69 0.1 . 1 . . . . . 74 LYS C . 51149 1 513 . 1 . 1 74 74 LYS CA C 13 55.90 0.1 . 1 . . . . . 74 LYS CA . 51149 1 514 . 1 . 1 74 74 LYS CB C 13 33.03 0.1 . 1 . . . . . 74 LYS CB . 51149 1 515 . 1 . 1 74 74 LYS N N 15 116.36 0.1 . 1 . . . . . 74 LYS N . 51149 1 516 . 1 . 1 75 75 ASP H H 1 7.99 0.02 . 1 . . . . . 75 ASP HN . 51149 1 517 . 1 . 1 75 75 ASP HA H 1 4.81 0.02 . 1 . . . . . 75 ASP HA . 51149 1 518 . 1 . 1 75 75 ASP C C 13 176.34 0.1 . 1 . . . . . 75 ASP C . 51149 1 519 . 1 . 1 75 75 ASP CA C 13 54.41 0.1 . 1 . . . . . 75 ASP CA . 51149 1 520 . 1 . 1 75 75 ASP CB C 13 38.78 0.1 . 1 . . . . . 75 ASP CB . 51149 1 521 . 1 . 1 75 75 ASP N N 15 117.30 0.1 . 1 . . . . . 75 ASP N . 51149 1 522 . 1 . 1 76 76 LEU H H 1 7.75 0.02 . 1 . . . . . 76 LEU HN . 51149 1 523 . 1 . 1 76 76 LEU HA H 1 5.50 0.02 . 1 . . . . . 76 LEU HA . 51149 1 524 . 1 . 1 76 76 LEU HD11 H 1 0.21 0.02 . 2 . . . . . 76 LEU MD1 . 51149 1 525 . 1 . 1 76 76 LEU HD12 H 1 0.21 0.02 . 2 . . . . . 76 LEU MD1 . 51149 1 526 . 1 . 1 76 76 LEU HD13 H 1 0.21 0.02 . 2 . . . . . 76 LEU MD1 . 51149 1 527 . 1 . 1 76 76 LEU HD21 H 1 1.06 0.02 . 2 . . . . . 76 LEU MD2 . 51149 1 528 . 1 . 1 76 76 LEU HD22 H 1 1.06 0.02 . 2 . . . . . 76 LEU MD2 . 51149 1 529 . 1 . 1 76 76 LEU HD23 H 1 1.06 0.02 . 2 . . . . . 76 LEU MD2 . 51149 1 530 . 1 . 1 76 76 LEU C C 13 175.96 0.1 . 1 . . . . . 76 LEU C . 51149 1 531 . 1 . 1 76 76 LEU CA C 13 53.78 0.1 . 1 . . . . . 76 LEU CA . 51149 1 532 . 1 . 1 76 76 LEU CB C 13 45.79 0.1 . 1 . . . . . 76 LEU CB . 51149 1 533 . 1 . 1 76 76 LEU CD1 C 13 25.41 0.1 . 2 . . . . . 76 LEU CD1 . 51149 1 534 . 1 . 1 76 76 LEU CD2 C 13 22.09 0.1 . 2 . . . . . 76 LEU CD2 . 51149 1 535 . 1 . 1 76 76 LEU N N 15 116.76 0.1 . 1 . . . . . 76 LEU N . 51149 1 536 . 1 . 1 77 77 ILE H H 1 8.72 0.02 . 1 . . . . . 77 ILE HN . 51149 1 537 . 1 . 1 77 77 ILE HA H 1 5.32 0.02 . 1 . . . . . 77 ILE HA . 51149 1 538 . 1 . 1 77 77 ILE HD11 H 1 0.72 0.02 . 1 . . . . . 77 ILE MD . 51149 1 539 . 1 . 1 77 77 ILE HD12 H 1 0.72 0.02 . 1 . . . . . 77 ILE MD . 51149 1 540 . 1 . 1 77 77 ILE HD13 H 1 0.72 0.02 . 1 . . . . . 77 ILE MD . 51149 1 541 . 1 . 1 77 77 ILE C C 13 172.51 0.1 . 1 . . . . . 77 ILE C . 51149 1 542 . 1 . 1 77 77 ILE CA C 13 59.81 0.1 . 1 . . . . . 77 ILE CA . 51149 1 543 . 1 . 1 77 77 ILE CB C 13 41.16 0.1 . 1 . . . . . 77 ILE CB . 51149 1 544 . 1 . 1 77 77 ILE CD1 C 13 15.22 0.1 . 1 . . . . . 77 ILE CD . 51149 1 545 . 1 . 1 77 77 ILE N N 15 118.36 0.1 . 1 . . . . . 77 ILE N . 51149 1 546 . 1 . 1 78 78 SER H H 1 9.99 0.02 . 1 . . . . . 78 SER HN . 51149 1 547 . 1 . 1 78 78 SER HA H 1 4.15 0.02 . 1 . . . . . 78 SER HA . 51149 1 548 . 1 . 1 78 78 SER C C 13 174.87 0.1 . 1 . . . . . 78 SER C . 51149 1 549 . 1 . 1 78 78 SER CA C 13 56.42 0.1 . 1 . . . . . 78 SER CA . 51149 1 550 . 1 . 1 78 78 SER CB C 13 67.17 0.1 . 1 . . . . . 78 SER CB . 51149 1 551 . 1 . 1 78 78 SER N N 15 120.96 0.1 . 1 . . . . . 78 SER N . 51149 1 552 . 1 . 1 79 79 TYR H H 1 9.47 0.02 . 1 . . . . . 79 TYR HN . 51149 1 553 . 1 . 1 79 79 TYR C C 13 176.79 0.1 . 1 . . . . . 79 TYR C . 51149 1 554 . 1 . 1 79 79 TYR CA C 13 56.76 0.1 . 1 . . . . . 79 TYR CA . 51149 1 555 . 1 . 1 79 79 TYR CB C 13 40.42 0.1 . 1 . . . . . 79 TYR CB . 51149 1 556 . 1 . 1 79 79 TYR N N 15 120.56 0.1 . 1 . . . . . 79 TYR N . 51149 1 557 . 1 . 1 80 80 GLY H H 1 8.41 0.02 . 1 . . . . . 80 GLY HN . 51149 1 558 . 1 . 1 80 80 GLY HA2 H 1 4.44 0.02 . 2 . . . . . 80 GLY HA2 . 51149 1 559 . 1 . 1 80 80 GLY HA3 H 1 3.86 0.02 . 2 . . . . . 80 GLY HA3 . 51149 1 560 . 1 . 1 80 80 GLY C C 13 174.15 0.1 . 1 . . . . . 80 GLY C . 51149 1 561 . 1 . 1 80 80 GLY CA C 13 45.38 0.1 . 1 . . . . . 80 GLY CA . 51149 1 562 . 1 . 1 80 80 GLY N N 15 112.37 0.1 . 1 . . . . . 80 GLY N . 51149 1 563 . 1 . 1 81 81 GLY H H 1 7.45 0.02 . 1 . . . . . 81 GLY HN . 51149 1 564 . 1 . 1 81 81 GLY HA2 H 1 4.04 0.02 . 2 . . . . . 81 GLY HA2 . 51149 1 565 . 1 . 1 81 81 GLY HA3 H 1 3.55 0.02 . 2 . . . . . 81 GLY HA3 . 51149 1 566 . 1 . 1 81 81 GLY C C 13 173.63 0.1 . 1 . . . . . 81 GLY C . 51149 1 567 . 1 . 1 81 81 GLY CA C 13 43.65 0.1 . 1 . . . . . 81 GLY CA . 51149 1 568 . 1 . 1 81 81 GLY N N 15 107.45 0.1 . 1 . . . . . 81 GLY N . 51149 1 569 . 1 . 1 82 82 GLY H H 1 8.34 0.02 . 1 . . . . . 82 GLY HN . 51149 1 570 . 1 . 1 82 82 GLY HA2 H 1 3.99 0.02 . 2 . . . . . 82 GLY HA2 . 51149 1 571 . 1 . 1 82 82 GLY HA3 H 1 3.73 0.02 . 2 . . . . . 82 GLY HA3 . 51149 1 572 . 1 . 1 82 82 GLY C C 13 173.26 0.1 . 1 . . . . . 82 GLY C . 51149 1 573 . 1 . 1 82 82 GLY CA C 13 43.33 0.1 . 1 . . . . . 82 GLY CA . 51149 1 574 . 1 . 1 82 82 GLY N N 15 105.69 0.1 . 1 . . . . . 82 GLY N . 51149 1 575 . 1 . 1 83 83 TRP H H 1 7.96 0.02 . 1 . . . . . 83 TRP HN . 51149 1 576 . 1 . 1 83 83 TRP C C 13 179.31 0.1 . 1 . . . . . 83 TRP C . 51149 1 577 . 1 . 1 83 83 TRP CA C 13 59.26 0.1 . 1 . . . . . 83 TRP CA . 51149 1 578 . 1 . 1 83 83 TRP CB C 13 29.20 0.1 . 1 . . . . . 83 TRP CB . 51149 1 579 . 1 . 1 83 83 TRP N N 15 119.46 0.1 . 1 . . . . . 83 TRP N . 51149 1 580 . 1 . 1 84 84 LYS H H 1 11.40 0.02 . 1 . . . . . 84 LYS HN . 51149 1 581 . 1 . 1 84 84 LYS C C 13 177.82 0.1 . 1 . . . . . 84 LYS C . 51149 1 582 . 1 . 1 84 84 LYS CA C 13 53.45 0.1 . 1 . . . . . 84 LYS CA . 51149 1 583 . 1 . 1 84 84 LYS N N 15 127.31 0.1 . 1 . . . . . 84 LYS N . 51149 1 584 . 1 . 1 85 85 LEU H H 1 5.85 0.02 . 1 . . . . . 85 LEU HN . 51149 1 585 . 1 . 1 85 85 LEU HA H 1 4.21 0.02 . 1 . . . . . 85 LEU HA . 51149 1 586 . 1 . 1 85 85 LEU HD11 H 1 -0.05 0.02 . 2 . . . . . 85 LEU MD1 . 51149 1 587 . 1 . 1 85 85 LEU HD12 H 1 -0.05 0.02 . 2 . . . . . 85 LEU MD1 . 51149 1 588 . 1 . 1 85 85 LEU HD13 H 1 -0.05 0.02 . 2 . . . . . 85 LEU MD1 . 51149 1 589 . 1 . 1 85 85 LEU HD21 H 1 0.43 0.02 . 2 . . . . . 85 LEU MD2 . 51149 1 590 . 1 . 1 85 85 LEU HD22 H 1 0.43 0.02 . 2 . . . . . 85 LEU MD2 . 51149 1 591 . 1 . 1 85 85 LEU HD23 H 1 0.43 0.02 . 2 . . . . . 85 LEU MD2 . 51149 1 592 . 1 . 1 85 85 LEU C C 13 178.11 0.1 . 1 . . . . . 85 LEU C . 51149 1 593 . 1 . 1 85 85 LEU CA C 13 54.56 0.1 . 1 . . . . . 85 LEU CA . 51149 1 594 . 1 . 1 85 85 LEU CB C 13 38.46 0.1 . 1 . . . . . 85 LEU CB . 51149 1 595 . 1 . 1 85 85 LEU CD1 C 13 24.69 0.1 . 2 . . . . . 85 LEU CD1 . 51149 1 596 . 1 . 1 85 85 LEU CD2 C 13 20.81 0.1 . 2 . . . . . 85 LEU CD2 . 51149 1 597 . 1 . 1 85 85 LEU N N 15 117.44 0.1 . 1 . . . . . 85 LEU N . 51149 1 598 . 1 . 1 86 86 GLU H H 1 9.08 0.02 . 1 . . . . . 86 GLU HN . 51149 1 599 . 1 . 1 86 86 GLU HA H 1 4.52 0.02 . 1 . . . . . 86 GLU HA . 51149 1 600 . 1 . 1 86 86 GLU C C 13 178.03 0.1 . 1 . . . . . 86 GLU C . 51149 1 601 . 1 . 1 86 86 GLU CA C 13 55.66 0.1 . 1 . . . . . 86 GLU CA . 51149 1 602 . 1 . 1 86 86 GLU CB C 13 31.87 0.1 . 1 . . . . . 86 GLU CB . 51149 1 603 . 1 . 1 86 86 GLU N N 15 120.88 0.1 . 1 . . . . . 86 GLU N . 51149 1 604 . 1 . 1 87 87 GLY H H 1 7.78 0.02 . 1 . . . . . 87 GLY HN . 51149 1 605 . 1 . 1 87 87 GLY HA2 H 1 4.01 0.02 . 2 . . . . . 87 GLY HA2 . 51149 1 606 . 1 . 1 87 87 GLY HA3 H 1 4.18 0.02 . 2 . . . . . 87 GLY HA3 . 51149 1 607 . 1 . 1 87 87 GLY C C 13 173.75 0.1 . 1 . . . . . 87 GLY C . 51149 1 608 . 1 . 1 87 87 GLY CA C 13 45.91 0.1 . 1 . . . . . 87 GLY CA . 51149 1 609 . 1 . 1 87 87 GLY N N 15 108.98 0.1 . 1 . . . . . 87 GLY N . 51149 1 610 . 1 . 1 88 88 GLU H H 1 8.74 0.02 . 1 . . . . . 88 GLU HN . 51149 1 611 . 1 . 1 88 88 GLU HA H 1 4.92 0.02 . 1 . . . . . 88 GLU HA . 51149 1 612 . 1 . 1 88 88 GLU C C 13 176.47 0.1 . 1 . . . . . 88 GLU C . 51149 1 613 . 1 . 1 88 88 GLU CA C 13 54.01 0.1 . 1 . . . . . 88 GLU CA . 51149 1 614 . 1 . 1 88 88 GLU CB C 13 31.67 0.1 . 1 . . . . . 88 GLU CB . 51149 1 615 . 1 . 1 88 88 GLU N N 15 124.68 0.1 . 1 . . . . . 88 GLU N . 51149 1 616 . 1 . 1 89 89 TRP H H 1 9.49 0.02 . 1 . . . . . 89 TRP HN . 51149 1 617 . 1 . 1 89 89 TRP HA H 1 4.41 0.02 . 1 . . . . . 89 TRP HA . 51149 1 618 . 1 . 1 89 89 TRP C C 13 175.55 0.1 . 1 . . . . . 89 TRP C . 51149 1 619 . 1 . 1 89 89 TRP CA C 13 58.55 0.1 . 1 . . . . . 89 TRP CA . 51149 1 620 . 1 . 1 89 89 TRP CB C 13 27.28 0.1 . 1 . . . . . 89 TRP CB . 51149 1 621 . 1 . 1 89 89 TRP N N 15 129.36 0.1 . 1 . . . . . 89 TRP N . 51149 1 622 . 1 . 1 90 90 LYS H H 1 7.38 0.02 . 1 . . . . . 90 LYS HN . 51149 1 623 . 1 . 1 90 90 LYS HA H 1 3.86 0.02 . 1 . . . . . 90 LYS HA . 51149 1 624 . 1 . 1 90 90 LYS C C 13 174.00 0.1 . 1 . . . . . 90 LYS C . 51149 1 625 . 1 . 1 90 90 LYS CA C 13 53.25 0.1 . 1 . . . . . 90 LYS CA . 51149 1 626 . 1 . 1 90 90 LYS CB C 13 32.56 0.1 . 1 . . . . . 90 LYS CB . 51149 1 627 . 1 . 1 90 90 LYS N N 15 129.98 0.1 . 1 . . . . . 90 LYS N . 51149 1 628 . 1 . 1 91 91 GLU H H 1 7.53 0.02 . 1 . . . . . 91 GLU HN . 51149 1 629 . 1 . 1 91 91 GLU C C 13 178.15 0.1 . 1 . . . . . 91 GLU C . 51149 1 630 . 1 . 1 91 91 GLU CA C 13 57.11 0.1 . 1 . . . . . 91 GLU CA . 51149 1 631 . 1 . 1 91 91 GLU CB C 13 28.24 0.1 . 1 . . . . . 91 GLU CB . 51149 1 632 . 1 . 1 91 91 GLU N N 15 121.07 0.1 . 1 . . . . . 91 GLU N . 51149 1 633 . 1 . 1 92 92 GLY H H 1 7.83 0.02 . 1 . . . . . 92 GLY HN . 51149 1 634 . 1 . 1 92 92 GLY HA2 H 1 4.27 0.02 . 2 . . . . . 92 GLY HA2 . 51149 1 635 . 1 . 1 92 92 GLY HA3 H 1 3.75 0.02 . 2 . . . . . 92 GLY HA3 . 51149 1 636 . 1 . 1 92 92 GLY C C 13 175.36 0.1 . 1 . . . . . 92 GLY C . 51149 1 637 . 1 . 1 92 92 GLY CA C 13 44.52 0.1 . 1 . . . . . 92 GLY CA . 51149 1 638 . 1 . 1 92 92 GLY N N 15 113.08 0.1 . 1 . . . . . 92 GLY N . 51149 1 639 . 1 . 1 93 93 GLU H H 1 7.91 0.02 . 1 . . . . . 93 GLU HN . 51149 1 640 . 1 . 1 93 93 GLU HA H 1 4.50 0.02 . 1 . . . . . 93 GLU HA . 51149 1 641 . 1 . 1 93 93 GLU C C 13 178.43 0.1 . 1 . . . . . 93 GLU C . 51149 1 642 . 1 . 1 93 93 GLU CA C 13 55.75 0.1 . 1 . . . . . 93 GLU CA . 51149 1 643 . 1 . 1 93 93 GLU CB C 13 29.46 0.1 . 1 . . . . . 93 GLU CB . 51149 1 644 . 1 . 1 93 93 GLU N N 15 119.92 0.1 . 1 . . . . . 93 GLU N . 51149 1 645 . 1 . 1 94 94 GLU H H 1 8.78 0.02 . 1 . . . . . 94 GLU HN . 51149 1 646 . 1 . 1 94 94 GLU HA H 1 4.31 0.02 . 1 . . . . . 94 GLU HA . 51149 1 647 . 1 . 1 94 94 GLU C C 13 176.68 0.1 . 1 . . . . . 94 GLU C . 51149 1 648 . 1 . 1 94 94 GLU CA C 13 56.87 0.1 . 1 . . . . . 94 GLU CA . 51149 1 649 . 1 . 1 94 94 GLU CB C 13 30.98 0.1 . 1 . . . . . 94 GLU CB . 51149 1 650 . 1 . 1 94 94 GLU N N 15 121.17 0.1 . 1 . . . . . 94 GLU N . 51149 1 651 . 1 . 1 95 95 VAL H H 1 8.80 0.02 . 1 . . . . . 95 VAL HN . 51149 1 652 . 1 . 1 95 95 VAL HA H 1 4.23 0.02 . 1 . . . . . 95 VAL HA . 51149 1 653 . 1 . 1 95 95 VAL HG11 H 1 1.01 0.02 . 2 . . . . . 95 VAL MG1 . 51149 1 654 . 1 . 1 95 95 VAL HG12 H 1 1.01 0.02 . 2 . . . . . 95 VAL MG1 . 51149 1 655 . 1 . 1 95 95 VAL HG13 H 1 1.01 0.02 . 2 . . . . . 95 VAL MG1 . 51149 1 656 . 1 . 1 95 95 VAL HG21 H 1 0.46 0.02 . 2 . . . . . 95 VAL MG2 . 51149 1 657 . 1 . 1 95 95 VAL HG22 H 1 0.46 0.02 . 2 . . . . . 95 VAL MG2 . 51149 1 658 . 1 . 1 95 95 VAL HG23 H 1 0.46 0.02 . 2 . . . . . 95 VAL MG2 . 51149 1 659 . 1 . 1 95 95 VAL C C 13 175.85 0.1 . 1 . . . . . 95 VAL C . 51149 1 660 . 1 . 1 95 95 VAL CA C 13 58.39 0.1 . 1 . . . . . 95 VAL CA . 51149 1 661 . 1 . 1 95 95 VAL CB C 13 35.65 0.1 . 1 . . . . . 95 VAL CB . 51149 1 662 . 1 . 1 95 95 VAL CG1 C 13 18.30 0.1 . 2 . . . . . 95 VAL CG1 . 51149 1 663 . 1 . 1 95 95 VAL CG2 C 13 23.21 0.1 . 2 . . . . . 95 VAL CG2 . 51149 1 664 . 1 . 1 95 95 VAL N N 15 109.93 0.1 . 1 . . . . . 95 VAL N . 51149 1 665 . 1 . 1 96 96 GLN H H 1 9.10 0.02 . 1 . . . . . 96 GLN HN . 51149 1 666 . 1 . 1 96 96 GLN HA H 1 5.48 0.02 . 1 . . . . . 96 GLN HA . 51149 1 667 . 1 . 1 96 96 GLN C C 13 177.22 0.1 . 1 . . . . . 96 GLN C . 51149 1 668 . 1 . 1 96 96 GLN CA C 13 53.07 0.1 . 1 . . . . . 96 GLN CA . 51149 1 669 . 1 . 1 96 96 GLN CB C 13 29.28 0.1 . 1 . . . . . 96 GLN CB . 51149 1 670 . 1 . 1 96 96 GLN N N 15 116.62 0.1 . 1 . . . . . 96 GLN N . 51149 1 671 . 1 . 1 97 97 VAL H H 1 8.93 0.02 . 1 . . . . . 97 VAL HN . 51149 1 672 . 1 . 1 97 97 VAL HG11 H 1 0.77 0.02 . 2 . . . . . 97 VAL MG1 . 51149 1 673 . 1 . 1 97 97 VAL HG12 H 1 0.77 0.02 . 2 . . . . . 97 VAL MG1 . 51149 1 674 . 1 . 1 97 97 VAL HG13 H 1 0.77 0.02 . 2 . . . . . 97 VAL MG1 . 51149 1 675 . 1 . 1 97 97 VAL HG21 H 1 0.87 0.02 . 2 . . . . . 97 VAL MG2 . 51149 1 676 . 1 . 1 97 97 VAL HG22 H 1 0.87 0.02 . 2 . . . . . 97 VAL MG2 . 51149 1 677 . 1 . 1 97 97 VAL HG23 H 1 0.87 0.02 . 2 . . . . . 97 VAL MG2 . 51149 1 678 . 1 . 1 97 97 VAL C C 13 175.41 0.1 . 1 . . . . . 97 VAL C . 51149 1 679 . 1 . 1 97 97 VAL CA C 13 61.26 0.1 . 1 . . . . . 97 VAL CA . 51149 1 680 . 1 . 1 97 97 VAL CB C 13 31.45 0.1 . 1 . . . . . 97 VAL CB . 51149 1 681 . 1 . 1 97 97 VAL CG1 C 13 19.65 0.1 . 2 . . . . . 97 VAL CG1 . 51149 1 682 . 1 . 1 97 97 VAL CG2 C 13 22.21 0.1 . 2 . . . . . 97 VAL CG2 . 51149 1 683 . 1 . 1 97 97 VAL N N 15 121.15 0.1 . 1 . . . . . 97 VAL N . 51149 1 684 . 1 . 1 98 98 LEU H H 1 8.44 0.02 . 1 . . . . . 98 LEU HN . 51149 1 685 . 1 . 1 98 98 LEU HA H 1 4.33 0.02 . 1 . . . . . 98 LEU HA . 51149 1 686 . 1 . 1 98 98 LEU HD11 H 1 0.72 0.02 . 2 . . . . . 98 LEU MD1 . 51149 1 687 . 1 . 1 98 98 LEU HD12 H 1 0.72 0.02 . 2 . . . . . 98 LEU MD1 . 51149 1 688 . 1 . 1 98 98 LEU HD13 H 1 0.72 0.02 . 2 . . . . . 98 LEU MD1 . 51149 1 689 . 1 . 1 98 98 LEU HD21 H 1 0.80 0.02 . 2 . . . . . 98 LEU MD2 . 51149 1 690 . 1 . 1 98 98 LEU HD22 H 1 0.80 0.02 . 2 . . . . . 98 LEU MD2 . 51149 1 691 . 1 . 1 98 98 LEU HD23 H 1 0.80 0.02 . 2 . . . . . 98 LEU MD2 . 51149 1 692 . 1 . 1 98 98 LEU C C 13 174.19 0.1 . 1 . . . . . 98 LEU C . 51149 1 693 . 1 . 1 98 98 LEU CA C 13 52.74 0.1 . 1 . . . . . 98 LEU CA . 51149 1 694 . 1 . 1 98 98 LEU CB C 13 38.28 0.1 . 1 . . . . . 98 LEU CB . 51149 1 695 . 1 . 1 98 98 LEU CD1 C 13 24.90 0.1 . 2 . . . . . 98 LEU CD1 . 51149 1 696 . 1 . 1 98 98 LEU CD2 C 13 24.19 0.1 . 2 . . . . . 98 LEU CD2 . 51149 1 697 . 1 . 1 98 98 LEU N N 15 132.33 0.1 . 1 . . . . . 98 LEU N . 51149 1 698 . 1 . 1 99 99 ALA H H 1 7.86 0.02 . 1 . . . . . 99 ALA HN . 51149 1 699 . 1 . 1 99 99 ALA HA H 1 5.09 0.02 . 1 . . . . . 99 ALA HA . 51149 1 700 . 1 . 1 99 99 ALA C C 13 179.16 0.1 . 1 . . . . . 99 ALA C . 51149 1 701 . 1 . 1 99 99 ALA CA C 13 51.97 0.1 . 1 . . . . . 99 ALA CA . 51149 1 702 . 1 . 1 99 99 ALA CB C 13 17.09 0.1 . 1 . . . . . 99 ALA CB . 51149 1 703 . 1 . 1 99 99 ALA N N 15 123.11 0.1 . 1 . . . . . 99 ALA N . 51149 1 704 . 1 . 1 100 100 LEU H H 1 7.85 0.02 . 1 . . . . . 100 LEU HN . 51149 1 705 . 1 . 1 100 100 LEU HD11 H 1 0.76 0.02 . 2 . . . . . 100 LEU MD1 . 51149 1 706 . 1 . 1 100 100 LEU HD12 H 1 0.76 0.02 . 2 . . . . . 100 LEU MD1 . 51149 1 707 . 1 . 1 100 100 LEU HD13 H 1 0.76 0.02 . 2 . . . . . 100 LEU MD1 . 51149 1 708 . 1 . 1 100 100 LEU HD21 H 1 0.61 0.02 . 2 . . . . . 100 LEU MD2 . 51149 1 709 . 1 . 1 100 100 LEU HD22 H 1 0.61 0.02 . 2 . . . . . 100 LEU MD2 . 51149 1 710 . 1 . 1 100 100 LEU HD23 H 1 0.61 0.02 . 2 . . . . . 100 LEU MD2 . 51149 1 711 . 1 . 1 100 100 LEU C C 13 175.81 0.1 . 1 . . . . . 100 LEU C . 51149 1 712 . 1 . 1 100 100 LEU CA C 13 51.59 0.1 . 1 . . . . . 100 LEU CA . 51149 1 713 . 1 . 1 100 100 LEU CB C 13 38.83 0.1 . 1 . . . . . 100 LEU CB . 51149 1 714 . 1 . 1 100 100 LEU CD1 C 13 25.99 0.1 . 2 . . . . . 100 LEU CD1 . 51149 1 715 . 1 . 1 100 100 LEU CD2 C 13 25.46 0.1 . 2 . . . . . 100 LEU CD2 . 51149 1 716 . 1 . 1 100 100 LEU N N 15 128.69 0.1 . 1 . . . . . 100 LEU N . 51149 1 717 . 1 . 1 101 101 GLU H H 1 8.15 0.02 . 1 . . . . . 101 GLU HN . 51149 1 718 . 1 . 1 101 101 GLU C C 13 176.95 0.1 . 1 . . . . . 101 GLU C . 51149 1 719 . 1 . 1 101 101 GLU CA C 13 54.15 0.1 . 1 . . . . . 101 GLU CA . 51149 1 720 . 1 . 1 101 101 GLU CB C 13 29.70 0.1 . 1 . . . . . 101 GLU CB . 51149 1 721 . 1 . 1 101 101 GLU N N 15 121.08 0.1 . 1 . . . . . 101 GLU N . 51149 1 722 . 1 . 1 102 102 PRO C C 13 178.89 0.1 . 1 . . . . . 102 PRO C . 51149 1 723 . 1 . 1 102 102 PRO CA C 13 63.07 0.1 . 1 . . . . . 102 PRO CA . 51149 1 724 . 1 . 1 102 102 PRO CB C 13 31.01 0.1 . 1 . . . . . 102 PRO CB . 51149 1 725 . 1 . 1 103 103 GLY H H 1 8.85 0.02 . 1 . . . . . 103 GLY HN . 51149 1 726 . 1 . 1 103 103 GLY HA2 H 1 4.01 0.02 . 2 . . . . . 103 GLY HA2 . 51149 1 727 . 1 . 1 103 103 GLY HA3 H 1 3.66 0.02 . 2 . . . . . 103 GLY HA3 . 51149 1 728 . 1 . 1 103 103 GLY C C 13 174.43 0.1 . 1 . . . . . 103 GLY C . 51149 1 729 . 1 . 1 103 103 GLY CA C 13 45.41 0.1 . 1 . . . . . 103 GLY CA . 51149 1 730 . 1 . 1 103 103 GLY N N 15 111.64 0.1 . 1 . . . . . 103 GLY N . 51149 1 731 . 1 . 1 104 104 LYS H H 1 7.74 0.02 . 1 . . . . . 104 LYS HN . 51149 1 732 . 1 . 1 104 104 LYS HA H 1 4.52 0.02 . 1 . . . . . 104 LYS HA . 51149 1 733 . 1 . 1 104 104 LYS C C 13 177.21 0.1 . 1 . . . . . 104 LYS C . 51149 1 734 . 1 . 1 104 104 LYS CA C 13 53.20 0.1 . 1 . . . . . 104 LYS CA . 51149 1 735 . 1 . 1 104 104 LYS CB C 13 34.47 0.1 . 1 . . . . . 104 LYS CB . 51149 1 736 . 1 . 1 104 104 LYS N N 15 118.22 0.1 . 1 . . . . . 104 LYS N . 51149 1 737 . 1 . 1 105 105 ASN H H 1 8.72 0.02 . 1 . . . . . 105 ASN HN . 51149 1 738 . 1 . 1 105 105 ASN C C 13 174.79 0.1 . 1 . . . . . 105 ASN C . 51149 1 739 . 1 . 1 105 105 ASN CA C 13 51.64 0.1 . 1 . . . . . 105 ASN CA . 51149 1 740 . 1 . 1 105 105 ASN CB C 13 35.74 0.1 . 1 . . . . . 105 ASN CB . 51149 1 741 . 1 . 1 105 105 ASN N N 15 120.31 0.1 . 1 . . . . . 105 ASN N . 51149 1 742 . 1 . 1 106 106 PRO HA H 1 4.37 0.02 . 1 . . . . . 106 PRO HA . 51149 1 743 . 1 . 1 106 106 PRO C C 13 175.89 0.1 . 1 . . . . . 106 PRO C . 51149 1 744 . 1 . 1 106 106 PRO CA C 13 63.14 0.1 . 1 . . . . . 106 PRO CA . 51149 1 745 . 1 . 1 106 106 PRO CB C 13 30.81 0.1 . 1 . . . . . 106 PRO CB . 51149 1 746 . 1 . 1 107 107 ARG H H 1 8.00 0.02 . 1 . . . . . 107 ARG HN . 51149 1 747 . 1 . 1 107 107 ARG HA H 1 4.54 0.02 . 1 . . . . . 107 ARG HA . 51149 1 748 . 1 . 1 107 107 ARG C C 13 173.25 0.1 . 1 . . . . . 107 ARG C . 51149 1 749 . 1 . 1 107 107 ARG CA C 13 54.68 0.1 . 1 . . . . . 107 ARG CA . 51149 1 750 . 1 . 1 107 107 ARG CB C 13 32.84 0.1 . 1 . . . . . 107 ARG CB . 51149 1 751 . 1 . 1 107 107 ARG N N 15 122.87 0.1 . 1 . . . . . 107 ARG N . 51149 1 752 . 1 . 1 108 108 ALA H H 1 8.47 0.02 . 1 . . . . . 108 ALA HN . 51149 1 753 . 1 . 1 108 108 ALA HA H 1 5.10 0.02 . 1 . . . . . 108 ALA HA . 51149 1 754 . 1 . 1 108 108 ALA C C 13 178.02 0.1 . 1 . . . . . 108 ALA C . 51149 1 755 . 1 . 1 108 108 ALA CA C 13 50.06 0.1 . 1 . . . . . 108 ALA CA . 51149 1 756 . 1 . 1 108 108 ALA CB C 13 19.31 0.1 . 1 . . . . . 108 ALA CB . 51149 1 757 . 1 . 1 108 108 ALA N N 15 126.58 0.1 . 1 . . . . . 108 ALA N . 51149 1 758 . 1 . 1 109 109 VAL H H 1 8.55 0.02 . 1 . . . . . 109 VAL HN . 51149 1 759 . 1 . 1 109 109 VAL HA H 1 4.34 0.02 . 1 . . . . . 109 VAL HA . 51149 1 760 . 1 . 1 109 109 VAL C C 13 175.00 0.1 . 1 . . . . . 109 VAL C . 51149 1 761 . 1 . 1 109 109 VAL CA C 13 61.25 0.1 . 1 . . . . . 109 VAL CA . 51149 1 762 . 1 . 1 109 109 VAL CB C 13 33.69 0.1 . 1 . . . . . 109 VAL CB . 51149 1 763 . 1 . 1 109 109 VAL N N 15 122.52 0.1 . 1 . . . . . 109 VAL N . 51149 1 764 . 1 . 1 110 110 GLN H H 1 9.37 0.02 . 1 . . . . . 110 GLN HN . 51149 1 765 . 1 . 1 110 110 GLN HA H 1 5.10 0.02 . 1 . . . . . 110 GLN HA . 51149 1 766 . 1 . 1 110 110 GLN C C 13 174.78 0.1 . 1 . . . . . 110 GLN C . 51149 1 767 . 1 . 1 110 110 GLN CA C 13 54.02 0.1 . 1 . . . . . 110 GLN CA . 51149 1 768 . 1 . 1 110 110 GLN CB C 13 30.17 0.1 . 1 . . . . . 110 GLN CB . 51149 1 769 . 1 . 1 110 110 GLN N N 15 129.91 0.1 . 1 . . . . . 110 GLN N . 51149 1 770 . 1 . 1 111 111 THR H H 1 9.16 0.02 . 1 . . . . . 111 THR HN . 51149 1 771 . 1 . 1 111 111 THR HA H 1 4.94 0.02 . 1 . . . . . 111 THR HA . 51149 1 772 . 1 . 1 111 111 THR C C 13 171.71 0.1 . 1 . . . . . 111 THR C . 51149 1 773 . 1 . 1 111 111 THR CA C 13 60.00 0.1 . 1 . . . . . 111 THR CA . 51149 1 774 . 1 . 1 111 111 THR CB C 13 69.97 0.1 . 1 . . . . . 111 THR CB . 51149 1 775 . 1 . 1 111 111 THR N N 15 117.93 0.1 . 1 . . . . . 111 THR N . 51149 1 776 . 1 . 1 112 112 LYS H H 1 7.98 0.02 . 1 . . . . . 112 LYS HN . 51149 1 777 . 1 . 1 112 112 LYS C C 13 174.50 0.1 . 1 . . . . . 112 LYS C . 51149 1 778 . 1 . 1 112 112 LYS CA C 13 52.44 0.1 . 1 . . . . . 112 LYS CA . 51149 1 779 . 1 . 1 112 112 LYS CB C 13 31.93 0.1 . 1 . . . . . 112 LYS CB . 51149 1 780 . 1 . 1 112 112 LYS N N 15 127.42 0.1 . 1 . . . . . 112 LYS N . 51149 1 781 . 1 . 1 113 113 PRO HA H 1 4.57 0.02 . 1 . . . . . 113 PRO HA . 51149 1 782 . 1 . 1 113 113 PRO C C 13 179.36 0.1 . 1 . . . . . 113 PRO C . 51149 1 783 . 1 . 1 113 113 PRO CA C 13 63.05 0.1 . 1 . . . . . 113 PRO CA . 51149 1 784 . 1 . 1 114 114 GLY H H 1 8.71 0.02 . 1 . . . . . 114 GLY HN . 51149 1 785 . 1 . 1 114 114 GLY C C 13 173.72 0.1 . 1 . . . . . 114 GLY C . 51149 1 786 . 1 . 1 114 114 GLY CA C 13 42.80 0.1 . 1 . . . . . 114 GLY CA . 51149 1 787 . 1 . 1 114 114 GLY N N 15 107.69 0.1 . 1 . . . . . 114 GLY N . 51149 1 788 . 1 . 1 115 115 LEU H H 1 8.56 0.02 . 1 . . . . . 115 LEU HN . 51149 1 789 . 1 . 1 115 115 LEU HA H 1 5.02 0.02 . 1 . . . . . 115 LEU HA . 51149 1 790 . 1 . 1 115 115 LEU HD11 H 1 1.05 0.02 . 2 . . . . . 115 LEU MD1 . 51149 1 791 . 1 . 1 115 115 LEU HD12 H 1 1.05 0.02 . 2 . . . . . 115 LEU MD1 . 51149 1 792 . 1 . 1 115 115 LEU HD13 H 1 1.05 0.02 . 2 . . . . . 115 LEU MD1 . 51149 1 793 . 1 . 1 115 115 LEU HD21 H 1 0.95 0.02 . 2 . . . . . 115 LEU MD2 . 51149 1 794 . 1 . 1 115 115 LEU HD22 H 1 0.95 0.02 . 2 . . . . . 115 LEU MD2 . 51149 1 795 . 1 . 1 115 115 LEU HD23 H 1 0.95 0.02 . 2 . . . . . 115 LEU MD2 . 51149 1 796 . 1 . 1 115 115 LEU C C 13 176.61 0.1 . 1 . . . . . 115 LEU C . 51149 1 797 . 1 . 1 115 115 LEU CA C 13 53.67 0.1 . 1 . . . . . 115 LEU CA . 51149 1 798 . 1 . 1 115 115 LEU CB C 13 46.50 0.1 . 1 . . . . . 115 LEU CB . 51149 1 799 . 1 . 1 115 115 LEU CD1 C 13 25.42 0.1 . 2 . . . . . 115 LEU CD1 . 51149 1 800 . 1 . 1 115 115 LEU CD2 C 13 24.43 0.1 . 2 . . . . . 115 LEU CD2 . 51149 1 801 . 1 . 1 115 115 LEU N N 15 118.25 0.1 . 1 . . . . . 115 LEU N . 51149 1 802 . 1 . 1 116 116 PHE H H 1 9.46 0.02 . 1 . . . . . 116 PHE HN . 51149 1 803 . 1 . 1 116 116 PHE HA H 1 5.23 0.02 . 1 . . . . . 116 PHE HA . 51149 1 804 . 1 . 1 116 116 PHE C C 13 177.06 0.1 . 1 . . . . . 116 PHE C . 51149 1 805 . 1 . 1 116 116 PHE CA C 13 53.00 0.1 . 1 . . . . . 116 PHE CA . 51149 1 806 . 1 . 1 116 116 PHE CB C 13 38.93 0.1 . 1 . . . . . 116 PHE CB . 51149 1 807 . 1 . 1 116 116 PHE N N 15 119.08 0.1 . 1 . . . . . 116 PHE N . 51149 1 808 . 1 . 1 117 117 LYS H H 1 9.24 0.02 . 1 . . . . . 117 LYS HN . 51149 1 809 . 1 . 1 117 117 LYS C C 13 177.52 0.1 . 1 . . . . . 117 LYS C . 51149 1 810 . 1 . 1 117 117 LYS CA C 13 55.39 0.1 . 1 . . . . . 117 LYS CA . 51149 1 811 . 1 . 1 117 117 LYS CB C 13 31.56 0.1 . 1 . . . . . 117 LYS CB . 51149 1 812 . 1 . 1 117 117 LYS N N 15 122.34 0.1 . 1 . . . . . 117 LYS N . 51149 1 813 . 1 . 1 118 118 THR H H 1 8.22 0.02 . 1 . . . . . 118 THR HN . 51149 1 814 . 1 . 1 118 118 THR C C 13 176.28 0.1 . 1 . . . . . 118 THR C . 51149 1 815 . 1 . 1 118 118 THR CA C 13 59.33 0.1 . 1 . . . . . 118 THR CA . 51149 1 816 . 1 . 1 118 118 THR CB C 13 71.11 0.1 . 1 . . . . . 118 THR CB . 51149 1 817 . 1 . 1 118 118 THR N N 15 115.40 0.1 . 1 . . . . . 118 THR N . 51149 1 818 . 1 . 1 119 119 ASN C C 13 177.34 0.1 . 1 . . . . . 119 ASN C . 51149 1 819 . 1 . 1 119 119 ASN CA C 13 54.97 0.1 . 1 . . . . . 119 ASN CA . 51149 1 820 . 1 . 1 119 119 ASN CB C 13 36.69 0.1 . 1 . . . . . 119 ASN CB . 51149 1 821 . 1 . 1 120 120 THR H H 1 8.26 0.02 . 1 . . . . . 120 THR HN . 51149 1 822 . 1 . 1 120 120 THR HA H 1 4.56 0.02 . 1 . . . . . 120 THR HA . 51149 1 823 . 1 . 1 120 120 THR C C 13 175.10 0.1 . 1 . . . . . 120 THR C . 51149 1 824 . 1 . 1 120 120 THR CA C 13 60.35 0.1 . 1 . . . . . 120 THR CA . 51149 1 825 . 1 . 1 120 120 THR CB C 13 68.86 0.1 . 1 . . . . . 120 THR CB . 51149 1 826 . 1 . 1 120 120 THR N N 15 108.003 0.1 . 1 . . . . . 120 THR N . 51149 1 827 . 1 . 1 121 121 GLY H H 1 7.40 0.02 . 1 . . . . . 121 GLY HN . 51149 1 828 . 1 . 1 121 121 GLY HA2 H 1 4.01 0.02 . 2 . . . . . 121 GLY HA2 . 51149 1 829 . 1 . 1 121 121 GLY HA3 H 1 4.49 0.02 . 2 . . . . . 121 GLY HA3 . 51149 1 830 . 1 . 1 121 121 GLY C C 13 174.47 0.1 . 1 . . . . . 121 GLY C . 51149 1 831 . 1 . 1 121 121 GLY CA C 13 44.52 0.1 . 1 . . . . . 121 GLY CA . 51149 1 832 . 1 . 1 121 121 GLY N N 15 110.50 0.1 . 1 . . . . . 121 GLY N . 51149 1 833 . 1 . 1 122 122 THR H H 1 8.62 0.02 . 1 . . . . . 122 THR HN . 51149 1 834 . 1 . 1 122 122 THR HA H 1 5.51 0.02 . 1 . . . . . 122 THR HA . 51149 1 835 . 1 . 1 122 122 THR C C 13 175.62 0.1 . 1 . . . . . 122 THR C . 51149 1 836 . 1 . 1 122 122 THR CA C 13 60.64 0.1 . 1 . . . . . 122 THR CA . 51149 1 837 . 1 . 1 122 122 THR CB C 13 70.75 0.1 . 1 . . . . . 122 THR CB . 51149 1 838 . 1 . 1 122 122 THR N N 15 116.03 0.1 . 1 . . . . . 122 THR N . 51149 1 839 . 1 . 1 123 123 ILE H H 1 9.08 0.02 . 1 . . . . . 123 ILE HN . 51149 1 840 . 1 . 1 123 123 ILE HA H 1 4.72 0.02 . 1 . . . . . 123 ILE HA . 51149 1 841 . 1 . 1 123 123 ILE HD11 H 1 0.89 0.02 . 1 . . . . . 123 ILE HD1 . 51149 1 842 . 1 . 1 123 123 ILE HD12 H 1 0.89 0.02 . 1 . . . . . 123 ILE HD1 . 51149 1 843 . 1 . 1 123 123 ILE HD13 H 1 0.89 0.02 . 1 . . . . . 123 ILE HD1 . 51149 1 844 . 1 . 1 123 123 ILE C C 13 176.14 0.1 . 1 . . . . . 123 ILE C . 51149 1 845 . 1 . 1 123 123 ILE CA C 13 59.41 0.1 . 1 . . . . . 123 ILE CA . 51149 1 846 . 1 . 1 123 123 ILE CB C 13 42.24 0.1 . 1 . . . . . 123 ILE CB . 51149 1 847 . 1 . 1 123 123 ILE CD1 C 13 14.24 0.1 . 1 . . . . . 123 ILE CD . 51149 1 848 . 1 . 1 123 123 ILE N N 15 122.87 0.1 . 1 . . . . . 123 ILE N . 51149 1 849 . 1 . 1 124 124 GLY H H 1 9.21 0.02 . 1 . . . . . 124 GLY HN . 51149 1 850 . 1 . 1 124 124 GLY C C 13 175.47 0.1 . 1 . . . . . 124 GLY C . 51149 1 851 . 1 . 1 124 124 GLY CA C 13 46.38 0.1 . 1 . . . . . 124 GLY CA . 51149 1 852 . 1 . 1 124 124 GLY N N 15 111.71 0.1 . 1 . . . . . 124 GLY N . 51149 1 853 . 1 . 1 125 125 ALA H H 1 7.08 0.02 . 1 . . . . . 125 ALA HN . 51149 1 854 . 1 . 1 125 125 ALA HA H 1 4.50 0.02 . 1 . . . . . 125 ALA HA . 51149 1 855 . 1 . 1 125 125 ALA C C 13 176.18 0.1 . 1 . . . . . 125 ALA C . 51149 1 856 . 1 . 1 125 125 ALA CA C 13 49.49 0.1 . 1 . . . . . 125 ALA CA . 51149 1 857 . 1 . 1 125 125 ALA CB C 13 18.75 0.1 . 1 . . . . . 125 ALA CB . 51149 1 858 . 1 . 1 125 125 ALA N N 15 123.77 0.1 . 1 . . . . . 125 ALA N . 51149 1 859 . 1 . 1 126 126 VAL H H 1 9.31 0.02 . 1 . . . . . 126 VAL HN . 51149 1 860 . 1 . 1 126 126 VAL CA C 13 57.40 0.1 . 1 . . . . . 126 VAL CA . 51149 1 861 . 1 . 1 126 126 VAL N N 15 116.50 0.1 . 1 . . . . . 126 VAL N . 51149 1 862 . 1 . 1 127 127 SER H H 1 9.66 0.02 . 1 . . . . . 127 SER HN . 51149 1 863 . 1 . 1 127 127 SER HA H 1 4.44 0.02 . 1 . . . . . 127 SER HA . 51149 1 864 . 1 . 1 127 127 SER C C 13 174.18 0.1 . 1 . . . . . 127 SER C . 51149 1 865 . 1 . 1 127 127 SER CA C 13 54.76 0.1 . 1 . . . . . 127 SER CA . 51149 1 866 . 1 . 1 127 127 SER N N 15 126.40 0.1 . 1 . . . . . 127 SER N . 51149 1 867 . 1 . 1 128 128 LEU H H 1 7.31 0.02 . 1 . . . . . 128 LEU HN . 51149 1 868 . 1 . 1 128 128 LEU HA H 1 4.92 0.02 . 1 . . . . . 128 LEU HA . 51149 1 869 . 1 . 1 128 128 LEU HD11 H 1 0.76 0.02 . 2 . . . . . 128 LEU MD1 . 51149 1 870 . 1 . 1 128 128 LEU HD12 H 1 0.76 0.02 . 2 . . . . . 128 LEU MD1 . 51149 1 871 . 1 . 1 128 128 LEU HD13 H 1 0.76 0.02 . 2 . . . . . 128 LEU MD1 . 51149 1 872 . 1 . 1 128 128 LEU HD21 H 1 0.73 0.02 . 2 . . . . . 128 LEU MD2 . 51149 1 873 . 1 . 1 128 128 LEU HD22 H 1 0.73 0.02 . 2 . . . . . 128 LEU MD2 . 51149 1 874 . 1 . 1 128 128 LEU HD23 H 1 0.73 0.02 . 2 . . . . . 128 LEU MD2 . 51149 1 875 . 1 . 1 128 128 LEU C C 13 175.16 0.1 . 1 . . . . . 128 LEU C . 51149 1 876 . 1 . 1 128 128 LEU CA C 13 52.96 0.1 . 1 . . . . . 128 LEU CA . 51149 1 877 . 1 . 1 128 128 LEU CB C 13 46.34 0.1 . 1 . . . . . 128 LEU CB . 51149 1 878 . 1 . 1 128 128 LEU CD1 C 13 25.95 0.1 . 2 . . . . . 128 LEU CD1 . 51149 1 879 . 1 . 1 128 128 LEU CD2 C 13 25.95 0.1 . 2 . . . . . 128 LEU CD2 . 51149 1 880 . 1 . 1 128 128 LEU N N 15 120.55 0.1 . 1 . . . . . 128 LEU N . 51149 1 881 . 1 . 1 129 129 ASP H H 1 8.44 0.02 . 1 . . . . . 129 ASP HN . 51149 1 882 . 1 . 1 129 129 ASP C C 13 174.88 0.1 . 1 . . . . . 129 ASP C . 51149 1 883 . 1 . 1 129 129 ASP CA C 13 53.00 0.1 . 1 . . . . . 129 ASP CA . 51149 1 884 . 1 . 1 129 129 ASP CB C 13 41.74 0.1 . 1 . . . . . 129 ASP CB . 51149 1 885 . 1 . 1 129 129 ASP N N 15 123.99 0.1 . 1 . . . . . 129 ASP N . 51149 1 886 . 1 . 1 130 130 PHE H H 1 7.52 0.02 . 1 . . . . . 130 PHE HN . 51149 1 887 . 1 . 1 130 130 PHE C C 13 176.17 0.1 . 1 . . . . . 130 PHE C . 51149 1 888 . 1 . 1 130 130 PHE CA C 13 55.48 0.1 . 1 . . . . . 130 PHE CA . 51149 1 889 . 1 . 1 130 130 PHE N N 15 120.48 0.1 . 1 . . . . . 130 PHE N . 51149 1 890 . 1 . 1 131 131 SER H H 1 9.32 0.02 . 1 . . . . . 131 SER HN . 51149 1 891 . 1 . 1 131 131 SER CA C 13 57.22 0.1 . 1 . . . . . 131 SER CA . 51149 1 892 . 1 . 1 131 131 SER CB C 13 62.25 0.1 . 1 . . . . . 131 SER CB . 51149 1 893 . 1 . 1 131 131 SER N N 15 116.59 0.1 . 1 . . . . . 131 SER N . 51149 1 894 . 1 . 1 132 132 PRO C C 13 178.34 0.1 . 1 . . . . . 132 PRO C . 51149 1 895 . 1 . 1 132 132 PRO CA C 13 64.58 0.1 . 1 . . . . . 132 PRO CA . 51149 1 896 . 1 . 1 132 132 PRO CB C 13 31.06 0.1 . 1 . . . . . 132 PRO CB . 51149 1 897 . 1 . 1 133 133 GLY H H 1 8.89 0.02 . 1 . . . . . 133 GLY HN . 51149 1 898 . 1 . 1 133 133 GLY C C 13 173.52 0.1 . 1 . . . . . 133 GLY C . 51149 1 899 . 1 . 1 133 133 GLY CA C 13 45.06 0.1 . 1 . . . . . 133 GLY CA . 51149 1 900 . 1 . 1 133 133 GLY N N 15 109.57 0.1 . 1 . . . . . 133 GLY N . 51149 1 901 . 1 . 1 134 134 THR H H 1 7.65 0.02 . 1 . . . . . 134 THR HN . 51149 1 902 . 1 . 1 134 134 THR C C 13 176.36 0.1 . 1 . . . . . 134 THR C . 51149 1 903 . 1 . 1 134 134 THR CA C 13 62.47 0.1 . 1 . . . . . 134 THR CA . 51149 1 904 . 1 . 1 134 134 THR CB C 13 68.32 0.1 . 1 . . . . . 134 THR CB . 51149 1 905 . 1 . 1 134 134 THR N N 15 115.89 0.1 . 1 . . . . . 134 THR N . 51149 1 906 . 1 . 1 135 135 ALA H H 1 8.22 0.02 . 1 . . . . . 135 ALA HN . 51149 1 907 . 1 . 1 135 135 ALA HA H 1 4.30 0.02 . 1 . . . . . 135 ALA HA . 51149 1 908 . 1 . 1 135 135 ALA C C 13 176.41 0.1 . 1 . . . . . 135 ALA C . 51149 1 909 . 1 . 1 135 135 ALA CA C 13 53.33 0.1 . 1 . . . . . 135 ALA CA . 51149 1 910 . 1 . 1 135 135 ALA CB C 13 18.82 0.1 . 1 . . . . . 135 ALA CB . 51149 1 911 . 1 . 1 135 135 ALA N N 15 125.16 0.1 . 1 . . . . . 135 ALA N . 51149 1 912 . 1 . 1 136 136 GLY H H 1 9.81 0.02 . 1 . . . . . 136 GLY HN . 51149 1 913 . 1 . 1 136 136 GLY C C 13 173.67 0.1 . 1 . . . . . 136 GLY C . 51149 1 914 . 1 . 1 136 136 GLY CA C 13 43.77 0.1 . 1 . . . . . 136 GLY CA . 51149 1 915 . 1 . 1 136 136 GLY N N 15 108.79 0.1 . 1 . . . . . 136 GLY N . 51149 1 916 . 1 . 1 137 137 SER H H 1 7.98 0.02 . 1 . . . . . 137 SER HN . 51149 1 917 . 1 . 1 137 137 SER HA H 1 4.34 0.02 . 1 . . . . . 137 SER HA . 51149 1 918 . 1 . 1 137 137 SER C C 13 172.38 0.1 . 1 . . . . . 137 SER C . 51149 1 919 . 1 . 1 137 137 SER CA C 13 59.07 0.1 . 1 . . . . . 137 SER CA . 51149 1 920 . 1 . 1 137 137 SER CB C 13 61.80 0.1 . 1 . . . . . 137 SER CB . 51149 1 921 . 1 . 1 137 137 SER N N 15 115.60 0.1 . 1 . . . . . 137 SER N . 51149 1 922 . 1 . 1 138 138 PRO C C 13 174.36 0.1 . 1 . . . . . 138 PRO C . 51149 1 923 . 1 . 1 138 138 PRO CA C 13 62.14 0.1 . 1 . . . . . 138 PRO CA . 51149 1 924 . 1 . 1 138 138 PRO CB C 13 32.04 0.1 . 1 . . . . . 138 PRO CB . 51149 1 925 . 1 . 1 139 139 ILE H H 1 8.33 0.02 . 1 . . . . . 139 ILE HN . 51149 1 926 . 1 . 1 139 139 ILE HD11 H 1 0.70 0.02 . 1 . . . . . 139 ILE MD . 51149 1 927 . 1 . 1 139 139 ILE HD12 H 1 0.70 0.02 . 1 . . . . . 139 ILE MD . 51149 1 928 . 1 . 1 139 139 ILE HD13 H 1 0.70 0.02 . 1 . . . . . 139 ILE MD . 51149 1 929 . 1 . 1 139 139 ILE C C 13 176.67 0.1 . 1 . . . . . 139 ILE C . 51149 1 930 . 1 . 1 139 139 ILE CA C 13 59.63 0.1 . 1 . . . . . 139 ILE CA . 51149 1 931 . 1 . 1 139 139 ILE CB C 13 37.11 0.1 . 1 . . . . . 139 ILE CB . 51149 1 932 . 1 . 1 139 139 ILE CD1 C 13 15.16 0.1 . 1 . . . . . 139 ILE CD . 51149 1 933 . 1 . 1 139 139 ILE N N 15 119.41 0.1 . 1 . . . . . 139 ILE N . 51149 1 934 . 1 . 1 140 140 VAL H H 1 9.88 0.02 . 1 . . . . . 140 VAL HN . 51149 1 935 . 1 . 1 140 140 VAL HA H 1 4.50 0.02 . 1 . . . . . 140 VAL HA . 51149 1 936 . 1 . 1 140 140 VAL HG11 H 1 0.94 0.02 . 2 . . . . . 140 VAL MG1 . 51149 1 937 . 1 . 1 140 140 VAL HG12 H 1 0.94 0.02 . 2 . . . . . 140 VAL MG1 . 51149 1 938 . 1 . 1 140 140 VAL HG13 H 1 0.94 0.02 . 2 . . . . . 140 VAL MG1 . 51149 1 939 . 1 . 1 140 140 VAL HG21 H 1 0.94 0.02 . 2 . . . . . 140 VAL MG2 . 51149 1 940 . 1 . 1 140 140 VAL HG22 H 1 0.94 0.02 . 2 . . . . . 140 VAL MG2 . 51149 1 941 . 1 . 1 140 140 VAL HG23 H 1 0.94 0.02 . 2 . . . . . 140 VAL MG2 . 51149 1 942 . 1 . 1 140 140 VAL C C 13 176.50 0.1 . 1 . . . . . 140 VAL C . 51149 1 943 . 1 . 1 140 140 VAL CA C 13 59.70 0.1 . 1 . . . . . 140 VAL CA . 51149 1 944 . 1 . 1 140 140 VAL CB C 13 35.27 0.1 . 1 . . . . . 140 VAL CB . 51149 1 945 . 1 . 1 140 140 VAL CG1 C 13 21.11 0.1 . 2 . . . . . 140 VAL CG1 . 51149 1 946 . 1 . 1 140 140 VAL CG2 C 13 20.65 0.1 . 2 . . . . . 140 VAL CG2 . 51149 1 947 . 1 . 1 140 140 VAL N N 15 125.41 0.1 . 1 . . . . . 140 VAL N . 51149 1 948 . 1 . 1 141 141 ASP H H 1 8.80 0.02 . 1 . . . . . 141 ASP HN . 51149 1 949 . 1 . 1 141 141 ASP HA H 1 5.21 0.02 . 1 . . . . . 141 ASP HA . 51149 1 950 . 1 . 1 141 141 ASP C C 13 179.53 0.1 . 1 . . . . . 141 ASP C . 51149 1 951 . 1 . 1 141 141 ASP CA C 13 51.62 0.1 . 1 . . . . . 141 ASP CA . 51149 1 952 . 1 . 1 141 141 ASP CB C 13 42.13 0.1 . 1 . . . . . 141 ASP CB . 51149 1 953 . 1 . 1 141 141 ASP N N 15 121.95 0.1 . 1 . . . . . 141 ASP N . 51149 1 954 . 1 . 1 142 142 LYS H H 1 7.89 0.02 . 1 . . . . . 142 LYS HN . 51149 1 955 . 1 . 1 142 142 LYS C C 13 179.19 0.1 . 1 . . . . . 142 LYS C . 51149 1 956 . 1 . 1 142 142 LYS CA C 13 57.49 0.1 . 1 . . . . . 142 LYS CA . 51149 1 957 . 1 . 1 142 142 LYS CB C 13 30.68 0.1 . 1 . . . . . 142 LYS CB . 51149 1 958 . 1 . 1 142 142 LYS N N 15 116.05 0.1 . 1 . . . . . 142 LYS N . 51149 1 959 . 1 . 1 143 143 LYS H H 1 7.81 0.02 . 1 . . . . . 143 LYS HN . 51149 1 960 . 1 . 1 143 143 LYS HA H 1 4.21 0.02 . 1 . . . . . 143 LYS HA . 51149 1 961 . 1 . 1 143 143 LYS C C 13 178.06 0.1 . 1 . . . . . 143 LYS C . 51149 1 962 . 1 . 1 143 143 LYS CA C 13 54.93 0.1 . 1 . . . . . 143 LYS CA . 51149 1 963 . 1 . 1 143 143 LYS CB C 13 30.95 0.1 . 1 . . . . . 143 LYS CB . 51149 1 964 . 1 . 1 143 143 LYS N N 15 118.33 0.1 . 1 . . . . . 143 LYS N . 51149 1 965 . 1 . 1 144 144 GLY H H 1 8.76 0.02 . 1 . . . . . 144 GLY HN . 51149 1 966 . 1 . 1 144 144 GLY HA2 H 1 4.23 0.02 . 2 . . . . . 144 GLY HA2 . 51149 1 967 . 1 . 1 144 144 GLY HA3 H 1 3.39 0.02 . 2 . . . . . 144 GLY HA3 . 51149 1 968 . 1 . 1 144 144 GLY C C 13 174.90 0.1 . 1 . . . . . 144 GLY C . 51149 1 969 . 1 . 1 144 144 GLY CA C 13 45.13 0.1 . 1 . . . . . 144 GLY CA . 51149 1 970 . 1 . 1 144 144 GLY N N 15 109.59 0.1 . 1 . . . . . 144 GLY N . 51149 1 971 . 1 . 1 145 145 LYS H H 1 8.52 0.02 . 1 . . . . . 145 LYS HN . 51149 1 972 . 1 . 1 145 145 LYS HA H 1 4.32 0.02 . 1 . . . . . 145 LYS HA . 51149 1 973 . 1 . 1 145 145 LYS C C 13 176.50 0.1 . 1 . . . . . 145 LYS C . 51149 1 974 . 1 . 1 145 145 LYS CA C 13 53.66 0.1 . 1 . . . . . 145 LYS CA . 51149 1 975 . 1 . 1 145 145 LYS CB C 13 30.77 0.1 . 1 . . . . . 145 LYS CB . 51149 1 976 . 1 . 1 145 145 LYS N N 15 119.83 0.1 . 1 . . . . . 145 LYS N . 51149 1 977 . 1 . 1 146 146 VAL H H 1 9.00 0.02 . 1 . . . . . 146 VAL HN . 51149 1 978 . 1 . 1 146 146 VAL HA H 1 4.36 0.02 . 1 . . . . . 146 VAL HA . 51149 1 979 . 1 . 1 146 146 VAL HG11 H 1 1.05 0.02 . 2 . . . . . 146 VAL MG1 . 51149 1 980 . 1 . 1 146 146 VAL HG12 H 1 1.05 0.02 . 2 . . . . . 146 VAL MG1 . 51149 1 981 . 1 . 1 146 146 VAL HG13 H 1 1.05 0.02 . 2 . . . . . 146 VAL MG1 . 51149 1 982 . 1 . 1 146 146 VAL HG21 H 1 0.94 0.02 . 2 . . . . . 146 VAL MG2 . 51149 1 983 . 1 . 1 146 146 VAL HG22 H 1 0.94 0.02 . 2 . . . . . 146 VAL MG2 . 51149 1 984 . 1 . 1 146 146 VAL HG23 H 1 0.94 0.02 . 2 . . . . . 146 VAL MG2 . 51149 1 985 . 1 . 1 146 146 VAL C C 13 177.88 0.1 . 1 . . . . . 146 VAL C . 51149 1 986 . 1 . 1 146 146 VAL CA C 13 61.98 0.1 . 1 . . . . . 146 VAL CA . 51149 1 987 . 1 . 1 146 146 VAL CB C 13 29.97 0.1 . 1 . . . . . 146 VAL CB . 51149 1 988 . 1 . 1 146 146 VAL CG1 C 13 22.84 0.1 . 1 . . . . . 146 VAL CG1 . 51149 1 989 . 1 . 1 146 146 VAL CG2 C 13 24.18 0.1 . 1 . . . . . 146 VAL CG2 . 51149 1 990 . 1 . 1 146 146 VAL N N 15 122.71 0.1 . 1 . . . . . 146 VAL N . 51149 1 991 . 1 . 1 147 147 VAL H H 1 8.91 0.02 . 1 . . . . . 147 VAL HN . 51149 1 992 . 1 . 1 147 147 VAL HG11 H 1 0.90 0.02 . 2 . . . . . 147 VAL MG1 . 51149 1 993 . 1 . 1 147 147 VAL HG12 H 1 0.90 0.02 . 2 . . . . . 147 VAL MG1 . 51149 1 994 . 1 . 1 147 147 VAL HG13 H 1 0.90 0.02 . 2 . . . . . 147 VAL MG1 . 51149 1 995 . 1 . 1 147 147 VAL HG21 H 1 0.71 0.02 . 2 . . . . . 147 VAL MG2 . 51149 1 996 . 1 . 1 147 147 VAL HG22 H 1 0.71 0.02 . 2 . . . . . 147 VAL MG2 . 51149 1 997 . 1 . 1 147 147 VAL HG23 H 1 0.71 0.02 . 2 . . . . . 147 VAL MG2 . 51149 1 998 . 1 . 1 147 147 VAL C C 13 175.45 0.1 . 1 . . . . . 147 VAL C . 51149 1 999 . 1 . 1 147 147 VAL CA C 13 59.91 0.1 . 1 . . . . . 147 VAL CA . 51149 1 1000 . 1 . 1 147 147 VAL CB C 13 30.44 0.1 . 1 . . . . . 147 VAL CB . 51149 1 1001 . 1 . 1 147 147 VAL CG1 C 13 22.81 0.1 . 2 . . . . . 147 VAL CG1 . 51149 1 1002 . 1 . 1 147 147 VAL CG2 C 13 19.29 0.1 . 2 . . . . . 147 VAL CG2 . 51149 1 1003 . 1 . 1 147 147 VAL N N 15 120.21 0.1 . 1 . . . . . 147 VAL N . 51149 1 1004 . 1 . 1 148 148 GLY H H 1 7.52 0.02 . 1 . . . . . 148 GLY HN . 51149 1 1005 . 1 . 1 148 148 GLY HA2 H 1 4.05 0.02 . 2 . . . . . 148 GLY HA2 . 51149 1 1006 . 1 . 1 148 148 GLY HA3 H 1 4.05 0.02 . 2 . . . . . 148 GLY HA3 . 51149 1 1007 . 1 . 1 148 148 GLY C C 13 170.74 0.1 . 1 . . . . . 148 GLY C . 51149 1 1008 . 1 . 1 148 148 GLY CA C 13 44.42 0.1 . 1 . . . . . 148 GLY CA . 51149 1 1009 . 1 . 1 148 148 GLY N N 15 104.47 0.1 . 1 . . . . . 148 GLY N . 51149 1 1010 . 1 . 1 149 149 LEU H H 1 9.29 0.02 . 1 . . . . . 149 LEU HN . 51149 1 1011 . 1 . 1 149 149 LEU HA H 1 4.52 0.02 . 1 . . . . . 149 LEU HA . 51149 1 1012 . 1 . 1 149 149 LEU HD11 H 1 1.06 0.02 . 2 . . . . . 149 LEU MD1 . 51149 1 1013 . 1 . 1 149 149 LEU HD12 H 1 1.06 0.02 . 2 . . . . . 149 LEU MD1 . 51149 1 1014 . 1 . 1 149 149 LEU HD13 H 1 1.06 0.02 . 2 . . . . . 149 LEU MD1 . 51149 1 1015 . 1 . 1 149 149 LEU HD21 H 1 0.81 0.02 . 2 . . . . . 149 LEU MD2 . 51149 1 1016 . 1 . 1 149 149 LEU HD22 H 1 0.81 0.02 . 2 . . . . . 149 LEU MD2 . 51149 1 1017 . 1 . 1 149 149 LEU HD23 H 1 0.81 0.02 . 2 . . . . . 149 LEU MD2 . 51149 1 1018 . 1 . 1 149 149 LEU C C 13 177.15 0.1 . 1 . . . . . 149 LEU C . 51149 1 1019 . 1 . 1 149 149 LEU CA C 13 52.81 0.1 . 1 . . . . . 149 LEU CA . 51149 1 1020 . 1 . 1 149 149 LEU CB C 13 43.54 0.1 . 1 . . . . . 149 LEU CB . 51149 1 1021 . 1 . 1 149 149 LEU CD1 C 13 26.41 0.1 . 2 . . . . . 149 LEU CD1 . 51149 1 1022 . 1 . 1 149 149 LEU CD2 C 13 21.66 0.1 . 2 . . . . . 149 LEU CD2 . 51149 1 1023 . 1 . 1 149 149 LEU N N 15 116.87 0.1 . 1 . . . . . 149 LEU N . 51149 1 1024 . 1 . 1 150 150 TYR H H 1 8.94 0.02 . 1 . . . . . 150 TYR HN . 51149 1 1025 . 1 . 1 150 150 TYR CA C 13 57.61 0.1 . 1 . . . . . 150 TYR CA . 51149 1 1026 . 1 . 1 150 150 TYR CB C 13 40.24 0.1 . 1 . . . . . 150 TYR CB . 51149 1 1027 . 1 . 1 150 150 TYR N N 15 121.80 0.1 . 1 . . . . . 150 TYR N . 51149 1 1028 . 1 . 1 151 151 GLY H H 1 7.99 0.02 . 1 . . . . . 151 GLY HN . 51149 1 1029 . 1 . 1 151 151 GLY CA C 13 45.94 0.1 . 1 . . . . . 151 GLY CA . 51149 1 1030 . 1 . 1 151 151 GLY N N 15 113.06 0.1 . 1 . . . . . 151 GLY N . 51149 1 1031 . 1 . 1 152 152 ASN H H 1 9.38 0.02 . 1 . . . . . 152 ASN HN . 51149 1 1032 . 1 . 1 154 154 VAL HG11 H 1 0.63 0.02 . 2 . . . . . 154 VAL MG1 . 51149 1 1033 . 1 . 1 154 154 VAL HG12 H 1 0.63 0.02 . 2 . . . . . 154 VAL MG1 . 51149 1 1034 . 1 . 1 154 154 VAL HG13 H 1 0.63 0.02 . 2 . . . . . 154 VAL MG1 . 51149 1 1035 . 1 . 1 154 154 VAL HG21 H 1 0.52 0.02 . 2 . . . . . 154 VAL MG2 . 51149 1 1036 . 1 . 1 154 154 VAL HG22 H 1 0.52 0.02 . 2 . . . . . 154 VAL MG2 . 51149 1 1037 . 1 . 1 154 154 VAL HG23 H 1 0.52 0.02 . 2 . . . . . 154 VAL MG2 . 51149 1 1038 . 1 . 1 154 154 VAL CG1 C 13 18.46 0.1 . 2 . . . . . 154 VAL CG1 . 51149 1 1039 . 1 . 1 154 154 VAL CG2 C 13 21.68 0.1 . 2 . . . . . 154 VAL CG2 . 51149 1 1040 . 1 . 1 155 155 VAL HG11 H 1 0.58 0.02 . 2 . . . . . 155 VAL MG1 . 51149 1 1041 . 1 . 1 155 155 VAL HG12 H 1 0.58 0.02 . 2 . . . . . 155 VAL MG1 . 51149 1 1042 . 1 . 1 155 155 VAL HG13 H 1 0.58 0.02 . 2 . . . . . 155 VAL MG1 . 51149 1 1043 . 1 . 1 155 155 VAL HG21 H 1 0.78 0.02 . 2 . . . . . 155 VAL MG2 . 51149 1 1044 . 1 . 1 155 155 VAL HG22 H 1 0.78 0.02 . 2 . . . . . 155 VAL MG2 . 51149 1 1045 . 1 . 1 155 155 VAL HG23 H 1 0.78 0.02 . 2 . . . . . 155 VAL MG2 . 51149 1 1046 . 1 . 1 155 155 VAL CA C 13 60.43 0.1 . 1 . . . . . 155 VAL CA . 51149 1 1047 . 1 . 1 155 155 VAL CB C 13 32.17 0.1 . 1 . . . . . 155 VAL CB . 51149 1 1048 . 1 . 1 155 155 VAL CG1 C 13 22.23 0.1 . 2 . . . . . 155 VAL CG1 . 51149 1 1049 . 1 . 1 155 155 VAL CG2 C 13 22.29 0.1 . 2 . . . . . 155 VAL CG2 . 51149 1 1050 . 1 . 1 156 156 THR H H 1 8.83 0.02 . 1 . . . . . 156 THR HN . 51149 1 1051 . 1 . 1 156 156 THR C C 13 178.43 0.1 . 1 . . . . . 156 THR C . 51149 1 1052 . 1 . 1 156 156 THR CA C 13 60.73 0.1 . 1 . . . . . 156 THR CA . 51149 1 1053 . 1 . 1 156 156 THR CB C 13 70.36 0.1 . 1 . . . . . 156 THR CB . 51149 1 1054 . 1 . 1 156 156 THR N N 15 117.11 0.1 . 1 . . . . . 156 THR N . 51149 1 1055 . 1 . 1 157 157 ARG H H 1 9.83 0.02 . 1 . . . . . 157 ARG HN . 51149 1 1056 . 1 . 1 157 157 ARG C C 13 178.88 0.1 . 1 . . . . . 157 ARG C . 51149 1 1057 . 1 . 1 157 157 ARG CA C 13 58.60 0.1 . 1 . . . . . 157 ARG CA . 51149 1 1058 . 1 . 1 157 157 ARG CB C 13 28.57 0.1 . 1 . . . . . 157 ARG CB . 51149 1 1059 . 1 . 1 157 157 ARG N N 15 122.28 0.1 . 1 . . . . . 157 ARG N . 51149 1 1060 . 1 . 1 158 158 SER H H 1 8.05 0.02 . 1 . . . . . 158 SER HN . 51149 1 1061 . 1 . 1 158 158 SER HA H 1 4.34 0.02 . 1 . . . . . 158 SER HA . 51149 1 1062 . 1 . 1 158 158 SER C C 13 176.05 0.1 . 1 . . . . . 158 SER C . 51149 1 1063 . 1 . 1 158 158 SER CA C 13 58.09 0.1 . 1 . . . . . 158 SER CA . 51149 1 1064 . 1 . 1 158 158 SER CB C 13 62.78 0.1 . 1 . . . . . 158 SER CB . 51149 1 1065 . 1 . 1 158 158 SER N N 15 111.58 0.1 . 1 . . . . . 158 SER N . 51149 1 1066 . 1 . 1 159 159 GLY H H 1 8.13 0.02 . 1 . . . . . 159 GLY HN . 51149 1 1067 . 1 . 1 159 159 GLY HA2 H 1 3.42 0.02 . 2 . . . . . 159 GLY HA2 . 51149 1 1068 . 1 . 1 159 159 GLY HA3 H 1 4.31 0.02 . 2 . . . . . 159 GLY HA3 . 51149 1 1069 . 1 . 1 159 159 GLY C C 13 174.59 0.1 . 1 . . . . . 159 GLY C . 51149 1 1070 . 1 . 1 159 159 GLY CA C 13 44.45 0.1 . 1 . . . . . 159 GLY CA . 51149 1 1071 . 1 . 1 159 159 GLY N N 15 110.76 0.1 . 1 . . . . . 159 GLY N . 51149 1 1072 . 1 . 1 160 160 ALA H H 1 7.25 0.02 . 1 . . . . . 160 ALA HN . 51149 1 1073 . 1 . 1 160 160 ALA HA H 1 4.47 0.02 . 1 . . . . . 160 ALA HA . 51149 1 1074 . 1 . 1 160 160 ALA C C 13 176.80 0.1 . 1 . . . . . 160 ALA C . 51149 1 1075 . 1 . 1 160 160 ALA CA C 13 51.30 0.1 . 1 . . . . . 160 ALA CA . 51149 1 1076 . 1 . 1 160 160 ALA CB C 13 18.01 0.1 . 1 . . . . . 160 ALA CB . 51149 1 1077 . 1 . 1 160 160 ALA N N 15 123.97 0.1 . 1 . . . . . 160 ALA N . 51149 1 1078 . 1 . 1 161 161 TYR H H 1 8.43 0.02 . 1 . . . . . 161 TYR HN . 51149 1 1079 . 1 . 1 161 161 TYR HA H 1 4.39 0.02 . 1 . . . . . 161 TYR HA . 51149 1 1080 . 1 . 1 161 161 TYR CA C 13 57.29 0.1 . 1 . . . . . 161 TYR CA . 51149 1 1081 . 1 . 1 161 161 TYR CB C 13 39.11 0.1 . 1 . . . . . 161 TYR CB . 51149 1 1082 . 1 . 1 161 161 TYR N N 15 123.92 0.1 . 1 . . . . . 161 TYR N . 51149 1 1083 . 1 . 1 162 162 VAL H H 1 7.95 0.02 . 1 . . . . . 162 VAL HN . 51149 1 1084 . 1 . 1 162 162 VAL HA H 1 4.38 0.02 . 1 . . . . . 162 VAL HA . 51149 1 1085 . 1 . 1 162 162 VAL HG11 H 1 0.60 0.02 . 2 . . . . . 162 VAL MG1 . 51149 1 1086 . 1 . 1 162 162 VAL HG12 H 1 0.60 0.02 . 2 . . . . . 162 VAL MG1 . 51149 1 1087 . 1 . 1 162 162 VAL HG13 H 1 0.60 0.02 . 2 . . . . . 162 VAL MG1 . 51149 1 1088 . 1 . 1 162 162 VAL HG21 H 1 0.29 0.02 . 2 . . . . . 162 VAL MG2 . 51149 1 1089 . 1 . 1 162 162 VAL HG22 H 1 0.29 0.02 . 2 . . . . . 162 VAL MG2 . 51149 1 1090 . 1 . 1 162 162 VAL HG23 H 1 0.29 0.02 . 2 . . . . . 162 VAL MG2 . 51149 1 1091 . 1 . 1 162 162 VAL CG1 C 13 23.52 0.1 . 2 . . . . . 162 VAL CG1 . 51149 1 1092 . 1 . 1 162 162 VAL CG2 C 13 20.42 0.1 . 2 . . . . . 162 VAL CG2 . 51149 1 1093 . 1 . 1 162 162 VAL N N 15 125.44 0.1 . 1 . . . . . 162 VAL N . 51149 1 1094 . 1 . 1 163 163 SER H H 1 8.73 0.02 . 1 . . . . . 163 SER HN . 51149 1 1095 . 1 . 1 163 163 SER HA H 1 4.44 0.02 . 1 . . . . . 163 SER HA . 51149 1 1096 . 1 . 1 163 163 SER CA C 13 55.50 0.1 . 1 . . . . . 163 SER CA . 51149 1 1097 . 1 . 1 163 163 SER N N 15 117.57 0.1 . 1 . . . . . 163 SER N . 51149 1 1098 . 1 . 1 164 164 ALA H H 1 9.43 0.02 . 1 . . . . . 164 ALA HN . 51149 1 1099 . 1 . 1 164 164 ALA C C 13 180.43 0.1 . 1 . . . . . 164 ALA C . 51149 1 1100 . 1 . 1 164 164 ALA CA C 13 52.68 0.1 . 1 . . . . . 164 ALA CA . 51149 1 1101 . 1 . 1 164 164 ALA CB C 13 17.94 0.1 . 1 . . . . . 164 ALA CB . 51149 1 1102 . 1 . 1 164 164 ALA N N 15 129.50 0.1 . 1 . . . . . 164 ALA N . 51149 1 1103 . 1 . 1 165 165 ILE H H 1 7.75 0.02 . 1 . . . . . 165 ILE HN . 51149 1 1104 . 1 . 1 165 165 ILE HD11 H 1 -0.04 0.02 . 1 . . . . . 165 ILE MD . 51149 1 1105 . 1 . 1 165 165 ILE HD12 H 1 -0.04 0.02 . 1 . . . . . 165 ILE MD . 51149 1 1106 . 1 . 1 165 165 ILE HD13 H 1 -0.04 0.02 . 1 . . . . . 165 ILE MD . 51149 1 1107 . 1 . 1 165 165 ILE C C 13 175.40 0.1 . 1 . . . . . 165 ILE C . 51149 1 1108 . 1 . 1 165 165 ILE CA C 13 61.68 0.1 . 1 . . . . . 165 ILE CA . 51149 1 1109 . 1 . 1 165 165 ILE CB C 13 34.96 0.1 . 1 . . . . . 165 ILE CB . 51149 1 1110 . 1 . 1 165 165 ILE CD1 C 13 12.36 0.1 . 1 . . . . . 165 ILE CD . 51149 1 1111 . 1 . 1 165 165 ILE N N 15 122.22 0.1 . 1 . . . . . 165 ILE N . 51149 1 1112 . 1 . 1 166 166 ALA H H 1 8.43 0.02 . 1 . . . . . 166 ALA HN . 51149 1 1113 . 1 . 1 166 166 ALA HA H 1 4.53 0.02 . 1 . . . . . 166 ALA HA . 51149 1 1114 . 1 . 1 166 166 ALA C C 13 175.81 0.1 . 1 . . . . . 166 ALA C . 51149 1 1115 . 1 . 1 166 166 ALA CA C 13 52.80 0.1 . 1 . . . . . 166 ALA CA . 51149 1 1116 . 1 . 1 166 166 ALA CB C 13 19.47 0.1 . 1 . . . . . 166 ALA CB . 51149 1 1117 . 1 . 1 166 166 ALA N N 15 123.92 0.1 . 1 . . . . . 166 ALA N . 51149 1 1118 . 1 . 1 167 167 GLN H H 1 8.20 0.02 . 1 . . . . . 167 GLN HN . 51149 1 1119 . 1 . 1 167 167 GLN C C 13 174.98 0.1 . 1 . . . . . 167 GLN C . 51149 1 1120 . 1 . 1 167 167 GLN CA C 13 52.84 0.1 . 1 . . . . . 167 GLN CA . 51149 1 1121 . 1 . 1 167 167 GLN CB C 13 32.53 0.1 . 1 . . . . . 167 GLN CB . 51149 1 1122 . 1 . 1 167 167 GLN N N 15 124.19 0.1 . 1 . . . . . 167 GLN N . 51149 1 1123 . 1 . 1 168 168 THR H H 1 8.01 0.02 . 1 . . . . . 168 THR HN . 51149 1 1124 . 1 . 1 168 168 THR HA H 1 4.42 0.02 . 1 . . . . . 168 THR HA . 51149 1 1125 . 1 . 1 168 168 THR C C 13 173.21 0.1 . 1 . . . . . 168 THR C . 51149 1 1126 . 1 . 1 168 168 THR CA C 13 59.23 0.1 . 1 . . . . . 168 THR CA . 51149 1 1127 . 1 . 1 168 168 THR CB C 13 69.46 0.1 . 1 . . . . . 168 THR CB . 51149 1 1128 . 1 . 1 168 168 THR N N 15 118.29 0.1 . 1 . . . . . 168 THR N . 51149 1 1129 . 1 . 1 169 169 GLU H H 1 7.79 0.02 . 1 . . . . . 169 GLU HN . 51149 1 1130 . 1 . 1 169 169 GLU HA H 1 4.15 0.02 . 1 . . . . . 169 GLU HA . 51149 1 1131 . 1 . 1 169 169 GLU C C 13 177.05 0.1 . 1 . . . . . 169 GLU C . 51149 1 1132 . 1 . 1 169 169 GLU CA C 13 56.16 0.1 . 1 . . . . . 169 GLU CA . 51149 1 1133 . 1 . 1 169 169 GLU CB C 13 29.51 0.1 . 1 . . . . . 169 GLU CB . 51149 1 1134 . 1 . 1 169 169 GLU N N 15 121.18 0.1 . 1 . . . . . 169 GLU N . 51149 1 1135 . 1 . 1 170 170 LYS H H 1 8.35 0.02 . 1 . . . . . 170 LYS HN . 51149 1 1136 . 1 . 1 170 170 LYS HA H 1 4.06 0.02 . 1 . . . . . 170 LYS HA . 51149 1 1137 . 1 . 1 170 170 LYS C C 13 177.79 0.1 . 1 . . . . . 170 LYS C . 51149 1 1138 . 1 . 1 170 170 LYS CA C 13 56.42 0.1 . 1 . . . . . 170 LYS CA . 51149 1 1139 . 1 . 1 170 170 LYS CB C 13 31.79 0.1 . 1 . . . . . 170 LYS CB . 51149 1 1140 . 1 . 1 170 170 LYS N N 15 122.89 0.1 . 1 . . . . . 170 LYS N . 51149 1 1141 . 1 . 1 171 171 SER H H 1 8.77 0.02 . 1 . . . . . 171 SER HN . 51149 1 1142 . 1 . 1 171 171 SER HA H 1 4.34 0.02 . 1 . . . . . 171 SER HA . 51149 1 1143 . 1 . 1 171 171 SER C C 13 175.64 0.1 . 1 . . . . . 171 SER C . 51149 1 1144 . 1 . 1 171 171 SER CA C 13 57.49 0.1 . 1 . . . . . 171 SER CA . 51149 1 1145 . 1 . 1 171 171 SER CB C 13 63.18 0.1 . 1 . . . . . 171 SER CB . 51149 1 1146 . 1 . 1 171 171 SER N N 15 119.85 0.1 . 1 . . . . . 171 SER N . 51149 1 1147 . 1 . 1 172 172 ILE H H 1 8.31 0.02 . 1 . . . . . 172 ILE HN . 51149 1 1148 . 1 . 1 172 172 ILE HA H 1 4.20 0.02 . 1 . . . . . 172 ILE HA . 51149 1 1149 . 1 . 1 172 172 ILE HD11 H 1 0.84 0.02 . 1 . . . . . 172 ILE MD . 51149 1 1150 . 1 . 1 172 172 ILE HD12 H 1 0.84 0.02 . 1 . . . . . 172 ILE MD . 51149 1 1151 . 1 . 1 172 172 ILE HD13 H 1 0.84 0.02 . 1 . . . . . 172 ILE MD . 51149 1 1152 . 1 . 1 172 172 ILE C C 13 177.24 0.1 . 1 . . . . . 172 ILE C . 51149 1 1153 . 1 . 1 172 172 ILE CA C 13 60.55 0.1 . 1 . . . . . 172 ILE CA . 51149 1 1154 . 1 . 1 172 172 ILE CB C 13 37.82 0.1 . 1 . . . . . 172 ILE CB . 51149 1 1155 . 1 . 1 172 172 ILE CD1 C 13 12.93 0.1 . 1 . . . . . 172 ILE CD . 51149 1 1156 . 1 . 1 172 172 ILE N N 15 123.07 0.1 . 1 . . . . . 172 ILE N . 51149 1 1157 . 1 . 1 173 173 GLU H H 1 8.34 0.02 . 1 . . . . . 173 GLU HN . 51149 1 1158 . 1 . 1 173 173 GLU HA H 1 4.27 0.02 . 1 . . . . . 173 GLU HA . 51149 1 1159 . 1 . 1 173 173 GLU C C 13 176.88 0.1 . 1 . . . . . 173 GLU C . 51149 1 1160 . 1 . 1 173 173 GLU CA C 13 55.78 0.1 . 1 . . . . . 173 GLU CA . 51149 1 1161 . 1 . 1 173 173 GLU CB C 13 29.47 0.1 . 1 . . . . . 173 GLU CB . 51149 1 1162 . 1 . 1 173 173 GLU N N 15 124.00 0.1 . 1 . . . . . 173 GLU N . 51149 1 1163 . 1 . 1 174 174 ASP H H 1 8.36 0.02 . 1 . . . . . 174 ASP HN . 51149 1 1164 . 1 . 1 174 174 ASP HA H 1 4.54 0.02 . 1 . . . . . 174 ASP HA . 51149 1 1165 . 1 . 1 174 174 ASP C C 13 176.52 0.1 . 1 . . . . . 174 ASP C . 51149 1 1166 . 1 . 1 174 174 ASP CA C 13 53.89 0.1 . 1 . . . . . 174 ASP CA . 51149 1 1167 . 1 . 1 174 174 ASP CB C 13 40.59 0.1 . 1 . . . . . 174 ASP CB . 51149 1 1168 . 1 . 1 174 174 ASP N N 15 121.70 0.1 . 1 . . . . . 174 ASP N . 51149 1 1169 . 1 . 1 175 175 ASN H H 1 8.41 0.02 . 1 . . . . . 175 ASN HN . 51149 1 1170 . 1 . 1 175 175 ASN HA H 1 4.96 0.02 . 1 . . . . . 175 ASN HA . 51149 1 1171 . 1 . 1 175 175 ASN C C 13 174.20 0.1 . 1 . . . . . 175 ASN C . 51149 1 1172 . 1 . 1 175 175 ASN CA C 13 50.88 0.1 . 1 . . . . . 175 ASN CA . 51149 1 1173 . 1 . 1 175 175 ASN CB C 13 38.41 0.1 . 1 . . . . . 175 ASN CB . 51149 1 1174 . 1 . 1 175 175 ASN N N 15 119.52 0.1 . 1 . . . . . 175 ASN N . 51149 1 1175 . 1 . 1 176 176 PRO HA H 1 4.41 0.02 . 1 . . . . . 176 PRO HA . 51149 1 1176 . 1 . 1 176 176 PRO C C 13 177.91 0.1 . 1 . . . . . 176 PRO C . 51149 1 1177 . 1 . 1 176 176 PRO CA C 13 62.84 0.1 . 1 . . . . . 176 PRO CA . 51149 1 1178 . 1 . 1 176 176 PRO CB C 13 31.23 0.1 . 1 . . . . . 176 PRO CB . 51149 1 1179 . 1 . 1 177 177 GLU H H 1 8.39 0.02 . 1 . . . . . 177 GLU HN . 51149 1 1180 . 1 . 1 177 177 GLU HA H 1 4.24 0.02 . 1 . . . . . 177 GLU HA . 51149 1 1181 . 1 . 1 177 177 GLU C C 13 177.48 0.1 . 1 . . . . . 177 GLU C . 51149 1 1182 . 1 . 1 177 177 GLU CA C 13 56.04 0.1 . 1 . . . . . 177 GLU CA . 51149 1 1183 . 1 . 1 177 177 GLU CB C 13 29.12 0.1 . 1 . . . . . 177 GLU CB . 51149 1 1184 . 1 . 1 177 177 GLU N N 15 120.27 0.1 . 1 . . . . . 177 GLU N . 51149 1 1185 . 1 . 1 178 178 ILE H H 1 8.04 0.02 . 1 . . . . . 178 ILE HN . 51149 1 1186 . 1 . 1 178 178 ILE HA H 1 4.27 0.02 . 1 . . . . . 178 ILE HA . 51149 1 1187 . 1 . 1 178 178 ILE HD11 H 1 0.83 0.02 . 1 . . . . . 178 ILE MD . 51149 1 1188 . 1 . 1 178 178 ILE HD12 H 1 0.83 0.02 . 1 . . . . . 178 ILE MD . 51149 1 1189 . 1 . 1 178 178 ILE HD13 H 1 0.83 0.02 . 1 . . . . . 178 ILE MD . 51149 1 1190 . 1 . 1 178 178 ILE C C 13 177.19 0.1 . 1 . . . . . 178 ILE C . 51149 1 1191 . 1 . 1 178 178 ILE CA C 13 60.42 0.1 . 1 . . . . . 178 ILE CA . 51149 1 1192 . 1 . 1 178 178 ILE CB C 13 37.85 0.1 . 1 . . . . . 178 ILE CB . 51149 1 1193 . 1 . 1 178 178 ILE CD1 C 13 12.68 0.1 . 1 . . . . . 178 ILE CD . 51149 1 1194 . 1 . 1 178 178 ILE N N 15 121.42 0.1 . 1 . . . . . 178 ILE N . 51149 1 1195 . 1 . 1 179 179 GLU H H 1 8.43 0.02 . 1 . . . . . 179 GLU HN . 51149 1 1196 . 1 . 1 179 179 GLU HA H 1 4.29 0.02 . 1 . . . . . 179 GLU HA . 51149 1 1197 . 1 . 1 179 179 GLU C C 13 177.13 0.1 . 1 . . . . . 179 GLU C . 51149 1 1198 . 1 . 1 179 179 GLU CA C 13 56.05 0.1 . 1 . . . . . 179 GLU CA . 51149 1 1199 . 1 . 1 179 179 GLU CB C 13 29.43 0.1 . 1 . . . . . 179 GLU CB . 51149 1 1200 . 1 . 1 179 179 GLU N N 15 124.98 0.1 . 1 . . . . . 179 GLU N . 51149 1 1201 . 1 . 1 180 180 ASP H H 1 8.30 0.02 . 1 . . . . . 180 ASP HN . 51149 1 1202 . 1 . 1 180 180 ASP HA H 1 4.56 0.02 . 1 . . . . . 180 ASP HA . 51149 1 1203 . 1 . 1 180 180 ASP C C 13 177.03 0.1 . 1 . . . . . 180 ASP C . 51149 1 1204 . 1 . 1 180 180 ASP CA C 13 54.13 0.1 . 1 . . . . . 180 ASP CA . 51149 1 1205 . 1 . 1 180 180 ASP CB C 13 40.79 0.1 . 1 . . . . . 180 ASP CB . 51149 1 1206 . 1 . 1 180 180 ASP N N 15 121.40 0.1 . 1 . . . . . 180 ASP N . 51149 1 1207 . 1 . 1 181 181 ASP H H 1 8.29 0.02 . 1 . . . . . 181 ASP HN . 51149 1 1208 . 1 . 1 181 181 ASP HA H 1 4.54 0.02 . 1 . . . . . 181 ASP HA . 51149 1 1209 . 1 . 1 181 181 ASP C C 13 177.74 0.1 . 1 . . . . . 181 ASP C . 51149 1 1210 . 1 . 1 181 181 ASP CA C 13 54.07 0.1 . 1 . . . . . 181 ASP CA . 51149 1 1211 . 1 . 1 181 181 ASP CB C 13 40.42 0.1 . 1 . . . . . 181 ASP CB . 51149 1 1212 . 1 . 1 181 181 ASP N N 15 120.48 0.1 . 1 . . . . . 181 ASP N . 51149 1 1213 . 1 . 1 182 182 ILE H H 1 7.89 0.02 . 1 . . . . . 182 ILE HN . 51149 1 1214 . 1 . 1 182 182 ILE HA H 1 4.00 0.02 . 1 . . . . . 182 ILE HA . 51149 1 1215 . 1 . 1 182 182 ILE HD11 H 1 0.71 0.02 . 1 . . . . . 182 ILE MD . 51149 1 1216 . 1 . 1 182 182 ILE HD12 H 1 0.71 0.02 . 1 . . . . . 182 ILE MD . 51149 1 1217 . 1 . 1 182 182 ILE HD13 H 1 0.71 0.02 . 1 . . . . . 182 ILE MD . 51149 1 1218 . 1 . 1 182 182 ILE C C 13 177.25 0.1 . 1 . . . . . 182 ILE C . 51149 1 1219 . 1 . 1 182 182 ILE CA C 13 61.53 0.1 . 1 . . . . . 182 ILE CA . 51149 1 1220 . 1 . 1 182 182 ILE CB C 13 37.43 0.1 . 1 . . . . . 182 ILE CB . 51149 1 1221 . 1 . 1 182 182 ILE CD1 C 13 13.11 0.1 . 1 . . . . . 182 ILE CD . 51149 1 1222 . 1 . 1 182 182 ILE N N 15 119.34 0.1 . 1 . . . . . 182 ILE N . 51149 1 1223 . 1 . 1 183 183 PHE H H 1 8.13 0.02 . 1 . . . . . 183 PHE HN . 51149 1 1224 . 1 . 1 183 183 PHE HA H 1 4.60 0.02 . 1 . . . . . 183 PHE HA . 51149 1 1225 . 1 . 1 183 183 PHE C C 13 176.63 0.1 . 1 . . . . . 183 PHE C . 51149 1 1226 . 1 . 1 183 183 PHE CA C 13 57.36 0.1 . 1 . . . . . 183 PHE CA . 51149 1 1227 . 1 . 1 183 183 PHE CB C 13 38.17 0.1 . 1 . . . . . 183 PHE CB . 51149 1 1228 . 1 . 1 183 183 PHE N N 15 121.63 0.1 . 1 . . . . . 183 PHE N . 51149 1 1229 . 1 . 1 184 184 ARG H H 1 7.86 0.02 . 1 . . . . . 184 ARG HN . 51149 1 1230 . 1 . 1 184 184 ARG HA H 1 4.31 0.02 . 1 . . . . . 184 ARG HA . 51149 1 1231 . 1 . 1 184 184 ARG C C 13 176.01 0.1 . 1 . . . . . 184 ARG C . 51149 1 1232 . 1 . 1 184 184 ARG CA C 13 55.49 0.1 . 1 . . . . . 184 ARG CA . 51149 1 1233 . 1 . 1 184 184 ARG CB C 13 29.83 0.1 . 1 . . . . . 184 ARG CB . 51149 1 1234 . 1 . 1 184 184 ARG N N 15 122.63 0.1 . 1 . . . . . 184 ARG N . 51149 1 1235 . 1 . 1 185 185 LYS H H 1 7.86 0.02 . 1 . . . . . 185 LYS HN . 51149 1 1236 . 1 . 1 185 185 LYS HA H 1 4.10 0.02 . 1 . . . . . 185 LYS HA . 51149 1 1237 . 1 . 1 185 185 LYS C C 13 182.42 0.1 . 1 . . . . . 185 LYS C . 51149 1 1238 . 1 . 1 185 185 LYS CA C 13 57.18 0.1 . 1 . . . . . 185 LYS CA . 51149 1 1239 . 1 . 1 185 185 LYS CB C 13 32.58 0.1 . 1 . . . . . 185 LYS CB . 51149 1 1240 . 1 . 1 185 185 LYS N N 15 127.74 0.1 . 1 . . . . . 185 LYS N . 51149 1 stop_ save_ save_assigned_chemical_shifts_2 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_2 _Assigned_chem_shift_list.Entry_ID 51149 _Assigned_chem_shift_list.ID 2 _Assigned_chem_shift_list.Name NS2B _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err 0.02 _Assigned_chem_shift_list.Chem_shift_13C_err 0.1 _Assigned_chem_shift_list.Chem_shift_15N_err 0.1 _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 2 '2D 1H-15N TROSY' . . . 51149 2 3 '3D HNCO' . . . 51149 2 4 '3D CBCANH' . . . 51149 2 5 HMCM(CGCB)CA . . . 51149 2 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 2 $software_2 . . 51149 2 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_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.Ambiguity_set_ID _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 . 2 . 2 1 1 HIS HA H 1 4.55 0.02 . 1 . . . . . 1 HIS HA . 51149 2 2 . 2 . 2 1 1 HIS C C 13 175.67 0.1 . 1 . . . . . 1 HIS C . 51149 2 3 . 2 . 2 1 1 HIS CA C 13 55.27 0.1 . 1 . . . . . 1 HIS CA . 51149 2 4 . 2 . 2 2 2 MET H H 1 8.36 0.02 . 1 . . . . . 2 MET HN . 51149 2 5 . 2 . 2 2 2 MET HA H 1 4.38 0.02 . 1 . . . . . 2 MET HA . 51149 2 6 . 2 . 2 2 2 MET C C 13 176.81 0.1 . 1 . . . . . 2 MET C . 51149 2 7 . 2 . 2 2 2 MET CA C 13 55.19 0.1 . 1 . . . . . 2 MET CA . 51149 2 8 . 2 . 2 2 2 MET CB C 13 31.96 0.1 . 1 . . . . . 2 MET CB . 51149 2 9 . 2 . 2 2 2 MET N N 15 121.79 0.1 . 1 . . . . . 2 MET N . 51149 2 10 . 2 . 2 3 3 LEU H H 1 8.28 0.02 . 1 . . . . . 3 LEU HN . 51149 2 11 . 2 . 2 3 3 LEU HA H 1 4.27 0.02 . 1 . . . . . 3 LEU HA . 51149 2 12 . 2 . 2 3 3 LEU C C 13 177.97 0.1 . 1 . . . . . 3 LEU C . 51149 2 13 . 2 . 2 3 3 LEU CA C 13 54.68 0.1 . 1 . . . . . 3 LEU CA . 51149 2 14 . 2 . 2 3 3 LEU CB C 13 41.27 0.1 . 1 . . . . . 3 LEU CB . 51149 2 15 . 2 . 2 3 3 LEU N N 15 123.21 0.1 . 1 . . . . . 3 LEU N . 51149 2 16 . 2 . 2 4 4 GLU H H 1 8.32 0.02 . 1 . . . . . 4 GLU HN . 51149 2 17 . 2 . 2 4 4 GLU HA H 1 4.28 0.02 . 1 . . . . . 4 GLU HA . 51149 2 18 . 2 . 2 4 4 GLU C C 13 176.72 0.1 . 1 . . . . . 4 GLU C . 51149 2 19 . 2 . 2 4 4 GLU CA C 13 55.65 0.1 . 1 . . . . . 4 GLU CA . 51149 2 20 . 2 . 2 4 4 GLU CB C 13 29.47 0.1 . 1 . . . . . 4 GLU CB . 51149 2 21 . 2 . 2 4 4 GLU N N 15 121.98 0.1 . 1 . . . . . 4 GLU N . 51149 2 22 . 2 . 2 5 5 ALA H H 1 8.22 0.02 . 1 . . . . . 5 ALA HN . 51149 2 23 . 2 . 2 5 5 ALA HA H 1 4.39 0.02 . 1 . . . . . 5 ALA HA . 51149 2 24 . 2 . 2 5 5 ALA C C 13 177.81 0.1 . 1 . . . . . 5 ALA C . 51149 2 25 . 2 . 2 5 5 ALA CA C 13 51.38 0.1 . 1 . . . . . 5 ALA CA . 51149 2 26 . 2 . 2 5 5 ALA CB C 13 19.25 0.1 . 1 . . . . . 5 ALA CB . 51149 2 27 . 2 . 2 5 5 ALA N N 15 125.00 0.1 . 1 . . . . . 5 ALA N . 51149 2 28 . 2 . 2 6 6 ASP H H 1 8.33 0.02 . 1 . . . . . 6 ASP HN . 51149 2 29 . 2 . 2 6 6 ASP HA H 1 4.33 0.02 . 1 . . . . . 6 ASP HA . 51149 2 30 . 2 . 2 6 6 ASP C C 13 176.29 0.1 . 1 . . . . . 6 ASP C . 51149 2 31 . 2 . 2 6 6 ASP CA C 13 54.24 0.1 . 1 . . . . . 6 ASP CA . 51149 2 32 . 2 . 2 6 6 ASP CB C 13 40.99 0.1 . 1 . . . . . 6 ASP CB . 51149 2 33 . 2 . 2 6 6 ASP N N 15 120.25 0.1 . 1 . . . . . 6 ASP N . 51149 2 34 . 2 . 2 7 7 LEU H H 1 8.18 0.02 . 1 . . . . . 7 LEU HN . 51149 2 35 . 2 . 2 7 7 LEU HA H 1 5.12 0.02 . 1 . . . . . 7 LEU HA . 51149 2 36 . 2 . 2 7 7 LEU HD11 H 1 0.72 0.02 . 2 . . . . . 7 LEU MD1 . 51149 2 37 . 2 . 2 7 7 LEU HD12 H 1 0.72 0.02 . 2 . . . . . 7 LEU MD1 . 51149 2 38 . 2 . 2 7 7 LEU HD13 H 1 0.72 0.02 . 2 . . . . . 7 LEU MD1 . 51149 2 39 . 2 . 2 7 7 LEU HD21 H 1 0.75 0.02 . 2 . . . . . 7 LEU MD2 . 51149 2 40 . 2 . 2 7 7 LEU HD22 H 1 0.75 0.02 . 2 . . . . . 7 LEU MD2 . 51149 2 41 . 2 . 2 7 7 LEU HD23 H 1 0.75 0.02 . 2 . . . . . 7 LEU MD2 . 51149 2 42 . 2 . 2 7 7 LEU C C 13 176.79 0.1 . 1 . . . . . 7 LEU C . 51149 2 43 . 2 . 2 7 7 LEU CA C 13 53.29 0.1 . 1 . . . . . 7 LEU CA . 51149 2 44 . 2 . 2 7 7 LEU CB C 13 43.10 0.1 . 1 . . . . . 7 LEU CB . 51149 2 45 . 2 . 2 7 7 LEU CD1 C 13 25.73 0.1 . 2 . . . . . 7 LEU CD1 . 51149 2 46 . 2 . 2 7 7 LEU CD2 C 13 23.76 0.1 . 2 . . . . . 7 LEU CD2 . 51149 2 47 . 2 . 2 7 7 LEU N N 15 120.65 0.1 . 1 . . . . . 7 LEU N . 51149 2 48 . 2 . 2 8 8 GLU H H 1 9.16 0.02 . 1 . . . . . 8 GLU HN . 51149 2 49 . 2 . 2 8 8 GLU C C 13 176.74 0.1 . 1 . . . . . 8 GLU C . 51149 2 50 . 2 . 2 8 8 GLU CA C 13 53.73 0.1 . 1 . . . . . 8 GLU CA . 51149 2 51 . 2 . 2 8 8 GLU CB C 13 32.96 0.1 . 1 . . . . . 8 GLU CB . 51149 2 52 . 2 . 2 8 8 GLU N N 15 121.82 0.1 . 1 . . . . . 8 GLU N . 51149 2 53 . 2 . 2 9 9 LEU H H 1 8.41 0.02 . 1 . . . . . 9 LEU HN . 51149 2 54 . 2 . 2 9 9 LEU HD11 H 1 -0.06 0.02 . 2 . . . . . 9 LEU MD1 . 51149 2 55 . 2 . 2 9 9 LEU HD12 H 1 -0.06 0.02 . 2 . . . . . 9 LEU MD1 . 51149 2 56 . 2 . 2 9 9 LEU HD13 H 1 -0.06 0.02 . 2 . . . . . 9 LEU MD1 . 51149 2 57 . 2 . 2 9 9 LEU HD21 H 1 -0.41 0.02 . 2 . . . . . 9 LEU MD2 . 51149 2 58 . 2 . 2 9 9 LEU HD22 H 1 -0.41 0.02 . 2 . . . . . 9 LEU MD2 . 51149 2 59 . 2 . 2 9 9 LEU HD23 H 1 -0.41 0.02 . 2 . . . . . 9 LEU MD2 . 51149 2 60 . 2 . 2 9 9 LEU C C 13 178.47 0.1 . 1 . . . . . 9 LEU C . 51149 2 61 . 2 . 2 9 9 LEU CA C 13 52.87 0.1 . 1 . . . . . 9 LEU CA . 51149 2 62 . 2 . 2 9 9 LEU CB C 13 43.81 0.1 . 1 . . . . . 9 LEU CB . 51149 2 63 . 2 . 2 9 9 LEU CD1 C 13 24.79 0.1 . 2 . . . . . 9 LEU CD1 . 51149 2 64 . 2 . 2 9 9 LEU CD2 C 13 23.97 0.1 . 2 . . . . . 9 LEU CD2 . 51149 2 65 . 2 . 2 9 9 LEU N N 15 121.06 0.1 . 1 . . . . . 9 LEU N . 51149 2 66 . 2 . 2 10 10 GLU H H 1 8.63 0.02 . 1 . . . . . 10 GLU HN . 51149 2 67 . 2 . 2 10 10 GLU C C 13 175.58 0.1 . 1 . . . . . 10 GLU C . 51149 2 68 . 2 . 2 10 10 GLU CA C 13 54.51 0.1 . 1 . . . . . 10 GLU CA . 51149 2 69 . 2 . 2 10 10 GLU CB C 13 33.75 0.1 . 1 . . . . . 10 GLU CB . 51149 2 70 . 2 . 2 10 10 GLU N N 15 120.79 0.1 . 1 . . . . . 10 GLU N . 51149 2 71 . 2 . 2 11 11 ARG H H 1 9.50 0.02 . 1 . . . . . 11 ARG HN . 51149 2 72 . 2 . 2 11 11 ARG C C 13 176.25 0.1 . 1 . . . . . 11 ARG C . 51149 2 73 . 2 . 2 11 11 ARG CA C 13 58.55 0.1 . 1 . . . . . 11 ARG CA . 51149 2 74 . 2 . 2 11 11 ARG CB C 13 27.92 0.1 . 1 . . . . . 11 ARG CB . 51149 2 75 . 2 . 2 11 11 ARG N N 15 132.22 0.1 . 1 . . . . . 11 ARG N . 51149 2 76 . 2 . 2 12 12 ALA H H 1 9.05 0.02 . 1 . . . . . 12 ALA HN . 51149 2 77 . 2 . 2 12 12 ALA HA H 1 4.74 0.02 . 1 . . . . . 12 ALA HA . 51149 2 78 . 2 . 2 12 12 ALA C C 13 177.38 0.1 . 1 . . . . . 12 ALA C . 51149 2 79 . 2 . 2 12 12 ALA CA C 13 51.72 0.1 . 1 . . . . . 12 ALA CA . 51149 2 80 . 2 . 2 12 12 ALA CB C 13 22.98 0.1 . 1 . . . . . 12 ALA CB . 51149 2 81 . 2 . 2 12 12 ALA N N 15 126.88 0.1 . 1 . . . . . 12 ALA N . 51149 2 82 . 2 . 2 13 13 ALA H H 1 7.64 0.02 . 1 . . . . . 13 ALA HN . 51149 2 83 . 2 . 2 13 13 ALA HA H 1 4.68 0.02 . 1 . . . . . 13 ALA HA . 51149 2 84 . 2 . 2 13 13 ALA C C 13 176.37 0.1 . 1 . . . . . 13 ALA C . 51149 2 85 . 2 . 2 13 13 ALA CA C 13 51.45 0.1 . 1 . . . . . 13 ALA CA . 51149 2 86 . 2 . 2 13 13 ALA CB C 13 21.78 0.1 . 1 . . . . . 13 ALA CB . 51149 2 87 . 2 . 2 13 13 ALA N N 15 116.18 0.1 . 1 . . . . . 13 ALA N . 51149 2 88 . 2 . 2 14 14 ASP H H 1 8.53 0.02 . 1 . . . . . 14 ASP HN . 51149 2 89 . 2 . 2 14 14 ASP HA H 1 4.62 0.02 . 1 . . . . . 14 ASP HA . 51149 2 90 . 2 . 2 14 14 ASP C C 13 176.50 0.1 . 1 . . . . . 14 ASP C . 51149 2 91 . 2 . 2 14 14 ASP CA C 13 53.55 0.1 . 1 . . . . . 14 ASP CA . 51149 2 92 . 2 . 2 14 14 ASP CB C 13 40.90 0.1 . 1 . . . . . 14 ASP CB . 51149 2 93 . 2 . 2 14 14 ASP N N 15 119.84 0.1 . 1 . . . . . 14 ASP N . 51149 2 94 . 2 . 2 15 15 VAL H H 1 8.94 0.02 . 1 . . . . . 15 VAL HN . 51149 2 95 . 2 . 2 15 15 VAL HA H 1 3.72 0.02 . 1 . . . . . 15 VAL HA . 51149 2 96 . 2 . 2 15 15 VAL HG11 H 1 0.89 0.02 . 2 . . . . . 15 VAL MG1 . 51149 2 97 . 2 . 2 15 15 VAL HG12 H 1 0.89 0.02 . 2 . . . . . 15 VAL MG1 . 51149 2 98 . 2 . 2 15 15 VAL HG13 H 1 0.89 0.02 . 2 . . . . . 15 VAL MG1 . 51149 2 99 . 2 . 2 15 15 VAL HG21 H 1 0.75 0.02 . 2 . . . . . 15 VAL MG2 . 51149 2 100 . 2 . 2 15 15 VAL HG22 H 1 0.75 0.02 . 2 . . . . . 15 VAL MG2 . 51149 2 101 . 2 . 2 15 15 VAL HG23 H 1 0.75 0.02 . 2 . . . . . 15 VAL MG2 . 51149 2 102 . 2 . 2 15 15 VAL C C 13 175.46 0.1 . 1 . . . . . 15 VAL C . 51149 2 103 . 2 . 2 15 15 VAL CA C 13 62.97 0.1 . 1 . . . . . 15 VAL CA . 51149 2 104 . 2 . 2 15 15 VAL CB C 13 30.14 0.1 . 1 . . . . . 15 VAL CB . 51149 2 105 . 2 . 2 15 15 VAL CG1 C 13 22.17 0.1 . 2 . . . . . 15 VAL CG1 . 51149 2 106 . 2 . 2 15 15 VAL CG2 C 13 22.06 0.1 . 2 . . . . . 15 VAL CG2 . 51149 2 107 . 2 . 2 15 15 VAL N N 15 121.25 0.1 . 1 . . . . . 15 VAL N . 51149 2 108 . 2 . 2 16 16 ARG H H 1 7.12 0.02 . 1 . . . . . 16 ARG HN . 51149 2 109 . 2 . 2 16 16 ARG HA H 1 4.54 0.02 . 1 . . . . . 16 ARG HA . 51149 2 110 . 2 . 2 16 16 ARG C C 13 173.78 0.1 . 1 . . . . . 16 ARG C . 51149 2 111 . 2 . 2 16 16 ARG CA C 13 53.94 0.1 . 1 . . . . . 16 ARG CA . 51149 2 112 . 2 . 2 16 16 ARG CB C 13 31.28 0.1 . 1 . . . . . 16 ARG CB . 51149 2 113 . 2 . 2 16 16 ARG N N 15 123.75 0.1 . 1 . . . . . 16 ARG N . 51149 2 114 . 2 . 2 17 17 TRP H H 1 8.71 0.02 . 1 . . . . . 17 TRP HN . 51149 2 115 . 2 . 2 17 17 TRP C C 13 176.67 0.1 . 1 . . . . . 17 TRP C . 51149 2 116 . 2 . 2 17 17 TRP CA C 13 56.62 0.1 . 1 . . . . . 17 TRP CA . 51149 2 117 . 2 . 2 17 17 TRP CB C 13 28.43 0.1 . 1 . . . . . 17 TRP CB . 51149 2 118 . 2 . 2 17 17 TRP N N 15 122.02 0.1 . 1 . . . . . 17 TRP N . 51149 2 119 . 2 . 2 18 18 GLU H H 1 9.28 0.02 . 1 . . . . . 18 GLU HN . 51149 2 120 . 2 . 2 18 18 GLU HA H 1 4.37 0.02 . 1 . . . . . 18 GLU HA . 51149 2 121 . 2 . 2 18 18 GLU C C 13 177.51 0.1 . 1 . . . . . 18 GLU C . 51149 2 122 . 2 . 2 18 18 GLU CA C 13 54.29 0.1 . 1 . . . . . 18 GLU CA . 51149 2 123 . 2 . 2 18 18 GLU CB C 13 29.51 0.1 . 1 . . . . . 18 GLU CB . 51149 2 124 . 2 . 2 18 18 GLU N N 15 131.81 0.1 . 1 . . . . . 18 GLU N . 51149 2 125 . 2 . 2 19 19 GLU H H 1 8.85 0.02 . 1 . . . . . 19 GLU HN . 51149 2 126 . 2 . 2 19 19 GLU HA H 1 4.13 0.02 . 1 . . . . . 19 GLU HA . 51149 2 127 . 2 . 2 19 19 GLU C C 13 178.03 0.1 . 1 . . . . . 19 GLU C . 51149 2 128 . 2 . 2 19 19 GLU CA C 13 58.09 0.1 . 1 . . . . . 19 GLU CA . 51149 2 129 . 2 . 2 19 19 GLU CB C 13 29.03 0.1 . 1 . . . . . 19 GLU CB . 51149 2 130 . 2 . 2 19 19 GLU N N 15 125.16 0.1 . 1 . . . . . 19 GLU N . 51149 2 131 . 2 . 2 20 20 GLN H H 1 8.73 0.02 . 1 . . . . . 20 GLN HN . 51149 2 132 . 2 . 2 20 20 GLN HA H 1 4.38 0.02 . 1 . . . . . 20 GLN HA . 51149 2 133 . 2 . 2 20 20 GLN C C 13 175.43 0.1 . 1 . . . . . 20 GLN C . 51149 2 134 . 2 . 2 20 20 GLN CA C 13 54.43 0.1 . 1 . . . . . 20 GLN CA . 51149 2 135 . 2 . 2 20 20 GLN CB C 13 27.16 0.1 . 1 . . . . . 20 GLN CB . 51149 2 136 . 2 . 2 20 20 GLN N N 15 117.55 0.1 . 1 . . . . . 20 GLN N . 51149 2 137 . 2 . 2 21 21 ALA H H 1 7.43 0.02 . 1 . . . . . 21 ALA HN . 51149 2 138 . 2 . 2 21 21 ALA HA H 1 4.24 0.02 . 1 . . . . . 21 ALA HA . 51149 2 139 . 2 . 2 21 21 ALA C C 13 178.16 0.1 . 1 . . . . . 21 ALA C . 51149 2 140 . 2 . 2 21 21 ALA CA C 13 51.26 0.1 . 1 . . . . . 21 ALA CA . 51149 2 141 . 2 . 2 21 21 ALA CB C 13 19.87 0.1 . 1 . . . . . 21 ALA CB . 51149 2 142 . 2 . 2 21 21 ALA N N 15 123.37 0.1 . 1 . . . . . 21 ALA N . 51149 2 143 . 2 . 2 22 22 GLU H H 1 8.01 0.02 . 1 . . . . . 22 GLU HN . 51149 2 144 . 2 . 2 22 22 GLU HA H 1 4.20 0.02 . 1 . . . . . 22 GLU HA . 51149 2 145 . 2 . 2 22 22 GLU C C 13 175.31 0.1 . 1 . . . . . 22 GLU C . 51149 2 146 . 2 . 2 22 22 GLU CA C 13 55.72 0.1 . 1 . . . . . 22 GLU CA . 51149 2 147 . 2 . 2 22 22 GLU CB C 13 30.05 0.1 . 1 . . . . . 22 GLU CB . 51149 2 148 . 2 . 2 22 22 GLU N N 15 121.10 0.1 . 1 . . . . . 22 GLU N . 51149 2 149 . 2 . 2 23 23 ILE H H 1 8.29 0.02 . 1 . . . . . 23 ILE HN . 51149 2 150 . 2 . 2 23 23 ILE HA H 1 4.37 0.02 . 1 . . . . . 23 ILE HA . 51149 2 151 . 2 . 2 23 23 ILE HD11 H 1 0.86 0.02 . 1 . . . . . 23 ILE MD . 51149 2 152 . 2 . 2 23 23 ILE HD12 H 1 0.86 0.02 . 1 . . . . . 23 ILE MD . 51149 2 153 . 2 . 2 23 23 ILE HD13 H 1 0.86 0.02 . 1 . . . . . 23 ILE MD . 51149 2 154 . 2 . 2 23 23 ILE C C 13 178.11 0.1 . 1 . . . . . 23 ILE C . 51149 2 155 . 2 . 2 23 23 ILE CA C 13 59.30 0.1 . 1 . . . . . 23 ILE CA . 51149 2 156 . 2 . 2 23 23 ILE CB C 13 38.15 0.1 . 1 . . . . . 23 ILE CB . 51149 2 157 . 2 . 2 23 23 ILE CD1 C 13 13.13 0.1 . 1 . . . . . 23 ILE CD . 51149 2 158 . 2 . 2 23 23 ILE N N 15 123.61 0.1 . 1 . . . . . 23 ILE N . 51149 2 159 . 2 . 2 24 24 SER H H 1 8.80 0.02 . 1 . . . . . 24 SER HN . 51149 2 160 . 2 . 2 24 24 SER HA H 1 4.16 0.02 . 1 . . . . . 24 SER HA . 51149 2 161 . 2 . 2 24 24 SER C C 13 175.62 0.1 . 1 . . . . . 24 SER C . 51149 2 162 . 2 . 2 24 24 SER CA C 13 56.62 0.1 . 1 . . . . . 24 SER CA . 51149 2 163 . 2 . 2 24 24 SER CB C 13 64.38 0.1 . 1 . . . . . 24 SER CB . 51149 2 164 . 2 . 2 24 24 SER N N 15 120.43 0.1 . 1 . . . . . 24 SER N . 51149 2 165 . 2 . 2 25 25 GLY H H 1 8.34 0.02 . 1 . . . . . 25 GLY HN . 51149 2 166 . 2 . 2 25 25 GLY HA2 H 1 3.96 0.02 . 2 . . . . . 25 GLY HA2 . 51149 2 167 . 2 . 2 25 25 GLY HA3 H 1 4.12 0.02 . 2 . . . . . 25 GLY HA3 . 51149 2 168 . 2 . 2 25 25 GLY C C 13 174.37 0.1 . 1 . . . . . 25 GLY C . 51149 2 169 . 2 . 2 25 25 GLY CA C 13 44.71 0.1 . 1 . . . . . 25 GLY CA . 51149 2 170 . 2 . 2 25 25 GLY N N 15 109.59 0.1 . 1 . . . . . 25 GLY N . 51149 2 171 . 2 . 2 26 26 SER H H 1 7.48 0.02 . 1 . . . . . 26 SER HN . 51149 2 172 . 2 . 2 26 26 SER C C 13 173.44 0.1 . 1 . . . . . 26 SER C . 51149 2 173 . 2 . 2 26 26 SER CA C 13 57.09 0.1 . 1 . . . . . 26 SER CA . 51149 2 174 . 2 . 2 26 26 SER CB C 13 63.84 0.1 . 1 . . . . . 26 SER CB . 51149 2 175 . 2 . 2 26 26 SER N N 15 113.86 0.1 . 1 . . . . . 26 SER N . 51149 2 176 . 2 . 2 27 27 SER H H 1 8.41 0.02 . 1 . . . . . 27 SER HN . 51149 2 177 . 2 . 2 27 27 SER CA C 13 53.96 0.1 . 1 . . . . . 27 SER CA . 51149 2 178 . 2 . 2 27 27 SER CB C 13 62.71 0.1 . 1 . . . . . 27 SER CB . 51149 2 179 . 2 . 2 27 27 SER N N 15 113.06 0.1 . 1 . . . . . 27 SER N . 51149 2 180 . 2 . 2 28 28 PRO HA H 1 4.52 0.02 . 1 . . . . . 28 PRO HA . 51149 2 181 . 2 . 2 28 28 PRO C C 13 175.67 0.1 . 1 . . . . . 28 PRO C . 51149 2 182 . 2 . 2 28 28 PRO CA C 13 62.16 0.1 . 1 . . . . . 28 PRO CA . 51149 2 183 . 2 . 2 28 28 PRO CB C 13 31.76 0.1 . 1 . . . . . 28 PRO CB . 51149 2 184 . 2 . 2 29 29 ILE H H 1 8.05 0.02 . 1 . . . . . 29 ILE HN . 51149 2 185 . 2 . 2 29 29 ILE HA H 1 5.02 0.02 . 1 . . . . . 29 ILE HA . 51149 2 186 . 2 . 2 29 29 ILE HD11 H 1 0.90 0.02 . 1 . . . . . 29 ILE MD . 51149 2 187 . 2 . 2 29 29 ILE HD12 H 1 0.90 0.02 . 1 . . . . . 29 ILE MD . 51149 2 188 . 2 . 2 29 29 ILE HD13 H 1 0.90 0.02 . 1 . . . . . 29 ILE MD . 51149 2 189 . 2 . 2 29 29 ILE C C 13 177.10 0.1 . 1 . . . . . 29 ILE C . 51149 2 190 . 2 . 2 29 29 ILE CA C 13 60.17 0.1 . 1 . . . . . 29 ILE CA . 51149 2 191 . 2 . 2 29 29 ILE CB C 13 37.97 0.1 . 1 . . . . . 29 ILE CB . 51149 2 192 . 2 . 2 29 29 ILE CD1 C 13 13.06 0.1 . 1 . . . . . 29 ILE CD . 51149 2 193 . 2 . 2 29 29 ILE N N 15 117.72 0.1 . 1 . . . . . 29 ILE N . 51149 2 194 . 2 . 2 30 30 LEU H H 1 8.68 0.02 . 1 . . . . . 30 LEU HN . 51149 2 195 . 2 . 2 30 30 LEU HA H 1 4.97 0.02 . 1 . . . . . 30 LEU HA . 51149 2 196 . 2 . 2 30 30 LEU HD11 H 1 0.75 0.02 . 2 . . . . . 30 LEU MD1 . 51149 2 197 . 2 . 2 30 30 LEU HD12 H 1 0.75 0.02 . 2 . . . . . 30 LEU MD1 . 51149 2 198 . 2 . 2 30 30 LEU HD13 H 1 0.75 0.02 . 2 . . . . . 30 LEU MD1 . 51149 2 199 . 2 . 2 30 30 LEU HD21 H 1 0.96 0.02 . 2 . . . . . 30 LEU MD2 . 51149 2 200 . 2 . 2 30 30 LEU HD22 H 1 0.96 0.02 . 2 . . . . . 30 LEU MD2 . 51149 2 201 . 2 . 2 30 30 LEU HD23 H 1 0.96 0.02 . 2 . . . . . 30 LEU MD2 . 51149 2 202 . 2 . 2 30 30 LEU C C 13 176.57 0.1 . 1 . . . . . 30 LEU C . 51149 2 203 . 2 . 2 30 30 LEU CA C 13 53.33 0.1 . 1 . . . . . 30 LEU CA . 51149 2 204 . 2 . 2 30 30 LEU CB C 13 45.58 0.1 . 1 . . . . . 30 LEU CB . 51149 2 205 . 2 . 2 30 30 LEU CD1 C 13 24.53 0.1 . 2 . . . . . 30 LEU CD1 . 51149 2 206 . 2 . 2 30 30 LEU CD2 C 13 26.32 0.1 . 2 . . . . . 30 LEU CD2 . 51149 2 207 . 2 . 2 30 30 LEU N N 15 126.49 0.1 . 1 . . . . . 30 LEU N . 51149 2 208 . 2 . 2 31 31 SER H H 1 8.92 0.02 . 1 . . . . . 31 SER HN . 51149 2 209 . 2 . 2 31 31 SER C C 13 175.23 0.1 . 1 . . . . . 31 SER C . 51149 2 210 . 2 . 2 31 31 SER CA C 13 57.52 0.1 . 1 . . . . . 31 SER CA . 51149 2 211 . 2 . 2 31 31 SER CB C 13 62.95 0.1 . 1 . . . . . 31 SER CB . 51149 2 212 . 2 . 2 31 31 SER N N 15 118.53 0.1 . 1 . . . . . 31 SER N . 51149 2 213 . 2 . 2 32 32 ILE HD11 H 1 0.08 0.02 . 1 . . . . . 32 ILE MD . 51149 2 214 . 2 . 2 32 32 ILE HD12 H 1 0.08 0.02 . 1 . . . . . 32 ILE MD . 51149 2 215 . 2 . 2 32 32 ILE HD13 H 1 0.08 0.02 . 1 . . . . . 32 ILE MD . 51149 2 216 . 2 . 2 32 32 ILE C C 13 176.34 0.1 . 1 . . . . . 32 ILE C . 51149 2 217 . 2 . 2 32 32 ILE CA C 13 58.07 0.1 . 1 . . . . . 32 ILE CA . 51149 2 218 . 2 . 2 32 32 ILE CD1 C 13 13.66 0.1 . 1 . . . . . 32 ILE CD . 51149 2 219 . 2 . 2 33 33 THR H H 1 8.84 0.02 . 1 . . . . . 33 THR HN . 51149 2 220 . 2 . 2 33 33 THR C C 13 174.12 0.1 . 1 . . . . . 33 THR C . 51149 2 221 . 2 . 2 33 33 THR CA C 13 60.41 0.1 . 1 . . . . . 33 THR CA . 51149 2 222 . 2 . 2 33 33 THR CB C 13 70.00 0.1 . 1 . . . . . 33 THR CB . 51149 2 223 . 2 . 2 33 33 THR N N 15 116.56 0.1 . 1 . . . . . 33 THR N . 51149 2 224 . 2 . 2 34 34 ILE H H 1 8.72 0.02 . 1 . . . . . 34 ILE HN . 51149 2 225 . 2 . 2 34 34 ILE HA H 1 4.43 0.02 . 1 . . . . . 34 ILE HA . 51149 2 226 . 2 . 2 34 34 ILE HD11 H 1 0.81 0.02 . 1 . . . . . 34 ILE MD . 51149 2 227 . 2 . 2 34 34 ILE HD12 H 1 0.81 0.02 . 1 . . . . . 34 ILE MD . 51149 2 228 . 2 . 2 34 34 ILE HD13 H 1 0.81 0.02 . 1 . . . . . 34 ILE MD . 51149 2 229 . 2 . 2 34 34 ILE C C 13 177.66 0.1 . 1 . . . . . 34 ILE C . 51149 2 230 . 2 . 2 34 34 ILE CA C 13 60.47 0.1 . 1 . . . . . 34 ILE CA . 51149 2 231 . 2 . 2 34 34 ILE CB C 13 38.15 0.1 . 1 . . . . . 34 ILE CB . 51149 2 232 . 2 . 2 34 34 ILE CD1 C 13 13.47 0.1 . 1 . . . . . 34 ILE CD . 51149 2 233 . 2 . 2 34 34 ILE N N 15 125.89 0.1 . 1 . . . . . 34 ILE N . 51149 2 234 . 2 . 2 35 35 SER H H 1 8.86 0.02 . 1 . . . . . 35 SER HN . 51149 2 235 . 2 . 2 35 35 SER HA H 1 4.51 0.02 . 1 . . . . . 35 SER HA . 51149 2 236 . 2 . 2 35 35 SER C C 13 176.43 0.1 . 1 . . . . . 35 SER C . 51149 2 237 . 2 . 2 35 35 SER CA C 13 57.78 0.1 . 1 . . . . . 35 SER CA . 51149 2 238 . 2 . 2 35 35 SER CB C 13 63.35 0.1 . 1 . . . . . 35 SER CB . 51149 2 239 . 2 . 2 35 35 SER N N 15 123.80 0.1 . 1 . . . . . 35 SER N . 51149 2 240 . 2 . 2 36 36 GLU H H 1 8.77 0.02 . 1 . . . . . 36 GLU HN . 51149 2 241 . 2 . 2 36 36 GLU C C 13 177.08 0.1 . 1 . . . . . 36 GLU C . 51149 2 242 . 2 . 2 36 36 GLU CA C 13 58.52 0.1 . 1 . . . . . 36 GLU CA . 51149 2 243 . 2 . 2 36 36 GLU CB C 13 32.95 0.1 . 1 . . . . . 36 GLU CB . 51149 2 244 . 2 . 2 36 36 GLU N N 15 120.84 0.1 . 1 . . . . . 36 GLU N . 51149 2 245 . 2 . 2 37 37 ASP C C 13 177.22 0.1 . 1 . . . . . 37 ASP C . 51149 2 246 . 2 . 2 37 37 ASP CA C 13 52.47 0.1 . 1 . . . . . 37 ASP CA . 51149 2 247 . 2 . 2 37 37 ASP CB C 13 40.39 0.1 . 1 . . . . . 37 ASP CB . 51149 2 248 . 2 . 2 38 38 GLY H H 1 8.00 0.02 . 1 . . . . . 38 GLY HN . 51149 2 249 . 2 . 2 38 38 GLY HA2 H 1 3.91 0.02 . 2 . . . . . 38 GLY HA2 . 51149 2 250 . 2 . 2 38 38 GLY HA3 H 1 3.69 0.02 . 2 . . . . . 38 GLY HA3 . 51149 2 251 . 2 . 2 38 38 GLY C C 13 175.61 0.1 . 1 . . . . . 38 GLY C . 51149 2 252 . 2 . 2 38 38 GLY CA C 13 45.34 0.1 . 1 . . . . . 38 GLY CA . 51149 2 253 . 2 . 2 38 38 GLY N N 15 107.29 0.1 . 1 . . . . . 38 GLY N . 51149 2 254 . 2 . 2 39 39 SER H H 1 8.07 0.02 . 1 . . . . . 39 SER HN . 51149 2 255 . 2 . 2 39 39 SER HA H 1 4.33 0.02 . 1 . . . . . 39 SER HA . 51149 2 256 . 2 . 2 39 39 SER C C 13 174.80 0.1 . 1 . . . . . 39 SER C . 51149 2 257 . 2 . 2 39 39 SER CA C 13 58.62 0.1 . 1 . . . . . 39 SER CA . 51149 2 258 . 2 . 2 39 39 SER CB C 13 63.04 0.1 . 1 . . . . . 39 SER CB . 51149 2 259 . 2 . 2 39 39 SER N N 15 116.51 0.1 . 1 . . . . . 39 SER N . 51149 2 260 . 2 . 2 40 40 MET H H 1 8.79 0.02 . 1 . . . . . 40 MET HN . 51149 2 261 . 2 . 2 40 40 MET C C 13 176.23 0.1 . 1 . . . . . 40 MET C . 51149 2 262 . 2 . 2 40 40 MET CA C 13 54.47 0.1 . 1 . . . . . 40 MET CA . 51149 2 263 . 2 . 2 40 40 MET CB C 13 35.20 0.1 . 1 . . . . . 40 MET CB . 51149 2 264 . 2 . 2 40 40 MET N N 15 121.97 0.1 . 1 . . . . . 40 MET N . 51149 2 265 . 2 . 2 41 41 SER H H 1 8.36 0.02 . 1 . . . . . 41 SER HN . 51149 2 266 . 2 . 2 41 41 SER C C 13 174.10 0.1 . 1 . . . . . 41 SER C . 51149 2 267 . 2 . 2 41 41 SER CA C 13 56.69 0.1 . 1 . . . . . 41 SER CA . 51149 2 268 . 2 . 2 41 41 SER CB C 13 64.75 0.1 . 1 . . . . . 41 SER CB . 51149 2 269 . 2 . 2 41 41 SER N N 15 113.94 0.1 . 1 . . . . . 41 SER N . 51149 2 270 . 2 . 2 42 42 ILE H H 1 8.83 0.02 . 1 . . . . . 42 ILE HN . 51149 2 271 . 2 . 2 42 42 ILE HD11 H 1 0.84 0.02 . 1 . . . . . 42 ILE MD . 51149 2 272 . 2 . 2 42 42 ILE HD12 H 1 0.84 0.02 . 1 . . . . . 42 ILE MD . 51149 2 273 . 2 . 2 42 42 ILE HD13 H 1 0.84 0.02 . 1 . . . . . 42 ILE MD . 51149 2 274 . 2 . 2 42 42 ILE C C 13 177.25 0.1 . 1 . . . . . 42 ILE C . 51149 2 275 . 2 . 2 42 42 ILE CA C 13 61.64 0.1 . 1 . . . . . 42 ILE CA . 51149 2 276 . 2 . 2 42 42 ILE CB C 13 37.58 0.1 . 1 . . . . . 42 ILE CB . 51149 2 277 . 2 . 2 42 42 ILE CD1 C 13 13.98 0.1 . 1 . . . . . 42 ILE CD . 51149 2 278 . 2 . 2 42 42 ILE N N 15 123.50 0.1 . 1 . . . . . 42 ILE N . 51149 2 279 . 2 . 2 43 43 LYS H H 1 8.70 0.02 . 1 . . . . . 43 LYS HN . 51149 2 280 . 2 . 2 43 43 LYS C C 13 176.78 0.1 . 1 . . . . . 43 LYS C . 51149 2 281 . 2 . 2 43 43 LYS CA C 13 55.83 0.1 . 1 . . . . . 43 LYS CA . 51149 2 282 . 2 . 2 43 43 LYS CB C 13 32.26 0.1 . 1 . . . . . 43 LYS CB . 51149 2 283 . 2 . 2 43 43 LYS N N 15 129.26 0.1 . 1 . . . . . 43 LYS N . 51149 2 284 . 2 . 2 44 44 ASN H H 1 8.37 0.02 . 1 . . . . . 44 ASN HN . 51149 2 285 . 2 . 2 44 44 ASN HA H 1 4.68 0.02 . 1 . . . . . 44 ASN HA . 51149 2 286 . 2 . 2 44 44 ASN C C 13 175.64 0.1 . 1 . . . . . 44 ASN C . 51149 2 287 . 2 . 2 44 44 ASN CA C 13 53.16 0.1 . 1 . . . . . 44 ASN CA . 51149 2 288 . 2 . 2 44 44 ASN CB C 13 38.92 0.1 . 1 . . . . . 44 ASN CB . 51149 2 289 . 2 . 2 44 44 ASN N N 15 119.84 0.1 . 1 . . . . . 44 ASN N . 51149 2 290 . 2 . 2 45 45 GLU H H 1 8.64 0.02 . 1 . . . . . 45 GLU HN . 51149 2 291 . 2 . 2 45 45 GLU HA H 1 4.32 0.02 . 1 . . . . . 45 GLU HA . 51149 2 292 . 2 . 2 45 45 GLU C C 13 177.36 0.1 . 1 . . . . . 45 GLU C . 51149 2 293 . 2 . 2 45 45 GLU CA C 13 56.31 0.1 . 1 . . . . . 45 GLU CA . 51149 2 294 . 2 . 2 45 45 GLU CB C 13 29.42 0.1 . 1 . . . . . 45 GLU CB . 51149 2 295 . 2 . 2 45 45 GLU N N 15 122.06 0.1 . 1 . . . . . 45 GLU N . 51149 2 296 . 2 . 2 46 46 GLU H H 1 8.42 0.02 . 1 . . . . . 46 GLU HN . 51149 2 297 . 2 . 2 46 46 GLU HA H 1 4.30 0.02 . 1 . . . . . 46 GLU HA . 51149 2 298 . 2 . 2 46 46 GLU C C 13 177.60 0.1 . 1 . . . . . 46 GLU C . 51149 2 299 . 2 . 2 46 46 GLU CA C 13 56.10 0.1 . 1 . . . . . 46 GLU CA . 51149 2 300 . 2 . 2 46 46 GLU CB C 13 29.12 0.1 . 1 . . . . . 46 GLU CB . 51149 2 301 . 2 . 2 46 46 GLU N N 15 121.01 0.1 . 1 . . . . . 46 GLU N . 51149 2 302 . 2 . 2 47 47 GLU H H 1 8.34 0.02 . 1 . . . . . 47 GLU HN . 51149 2 303 . 2 . 2 47 47 GLU HA H 1 4.28 0.02 . 1 . . . . . 47 GLU HA . 51149 2 304 . 2 . 2 47 47 GLU C C 13 177.52 0.1 . 1 . . . . . 47 GLU C . 51149 2 305 . 2 . 2 47 47 GLU CA C 13 55.96 0.1 . 1 . . . . . 47 GLU CA . 51149 2 306 . 2 . 2 47 47 GLU CB C 13 29.65 0.1 . 1 . . . . . 47 GLU CB . 51149 2 307 . 2 . 2 47 47 GLU N N 15 121.25 0.1 . 1 . . . . . 47 GLU N . 51149 2 308 . 2 . 2 48 48 GLU H H 1 8.43 0.02 . 1 . . . . . 48 GLU HN . 51149 2 309 . 2 . 2 48 48 GLU HA H 1 4.26 0.02 . 1 . . . . . 48 GLU HA . 51149 2 310 . 2 . 2 48 48 GLU C C 13 177.40 0.1 . 1 . . . . . 48 GLU C . 51149 2 311 . 2 . 2 48 48 GLU CA C 13 56.19 0.1 . 1 . . . . . 48 GLU CA . 51149 2 312 . 2 . 2 48 48 GLU CB C 13 29.31 0.1 . 1 . . . . . 48 GLU CB . 51149 2 313 . 2 . 2 48 48 GLU N N 15 122.09 0.1 . 1 . . . . . 48 GLU N . 51149 2 314 . 2 . 2 49 49 GLN H H 1 8.46 0.02 . 1 . . . . . 49 GLN HN . 51149 2 315 . 2 . 2 49 49 GLN HA H 1 4.40 0.02 . 1 . . . . . 49 GLN HA . 51149 2 316 . 2 . 2 49 49 GLN C C 13 176.94 0.1 . 1 . . . . . 49 GLN C . 51149 2 317 . 2 . 2 49 49 GLN CA C 13 55.16 0.1 . 1 . . . . . 49 GLN CA . 51149 2 318 . 2 . 2 49 49 GLN CB C 13 28.87 0.1 . 1 . . . . . 49 GLN CB . 51149 2 319 . 2 . 2 49 49 GLN N N 15 121.76 0.1 . 1 . . . . . 49 GLN N . 51149 2 320 . 2 . 2 50 50 THR H H 1 8.29 0.02 . 1 . . . . . 50 THR HN . 51149 2 321 . 2 . 2 50 50 THR HA H 1 4.19 0.02 . 1 . . . . . 50 THR HA . 51149 2 322 . 2 . 2 50 50 THR C C 13 174.68 0.1 . 1 . . . . . 50 THR C . 51149 2 323 . 2 . 2 50 50 THR CA C 13 61.33 0.1 . 1 . . . . . 50 THR CA . 51149 2 324 . 2 . 2 50 50 THR CB C 13 69.39 0.1 . 1 . . . . . 50 THR CB . 51149 2 325 . 2 . 2 50 50 THR N N 15 116.69 0.1 . 1 . . . . . 50 THR N . 51149 2 326 . 2 . 2 51 51 LEU H H 1 7.98 0.02 . 1 . . . . . 51 LEU HN . 51149 2 327 . 2 . 2 51 51 LEU HA H 1 4.35 0.02 . 1 . . . . . 51 LEU HA . 51149 2 328 . 2 . 2 51 51 LEU HD11 H 1 0.86 0.02 . 2 . . . . . 51 LEU MD1 . 51149 2 329 . 2 . 2 51 51 LEU HD12 H 1 0.86 0.02 . 2 . . . . . 51 LEU MD1 . 51149 2 330 . 2 . 2 51 51 LEU HD13 H 1 0.86 0.02 . 2 . . . . . 51 LEU MD1 . 51149 2 331 . 2 . 2 51 51 LEU HD21 H 1 0.90 0.02 . 2 . . . . . 51 LEU MD2 . 51149 2 332 . 2 . 2 51 51 LEU HD22 H 1 0.90 0.02 . 2 . . . . . 51 LEU MD2 . 51149 2 333 . 2 . 2 51 51 LEU HD23 H 1 0.90 0.02 . 2 . . . . . 51 LEU MD2 . 51149 2 334 . 2 . 2 51 51 LEU C C 13 169.45 0.1 . 1 . . . . . 51 LEU C . 51149 2 335 . 2 . 2 51 51 LEU CA C 13 56.40 0.1 . 1 . . . . . 51 LEU CA . 51149 2 336 . 2 . 2 51 51 LEU CB C 13 42.26 0.1 . 1 . . . . . 51 LEU CB . 51149 2 337 . 2 . 2 51 51 LEU CD1 C 13 25.03 0.1 . 2 . . . . . 51 LEU CD1 . 51149 2 338 . 2 . 2 51 51 LEU CD2 C 13 23.43 0.1 . 2 . . . . . 51 LEU CD2 . 51149 2 339 . 2 . 2 51 51 LEU N N 15 130.40 0.1 . 1 . . . . . 51 LEU N . 51149 2 stop_ save_