data_50479 ####################### # Entry information # ####################### save_entry_information_1 _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information_1 _Entry.ID 50479 _Entry.Title ; 1H, 15N, and 13C resonance assignments for human Atg3 with deletion of residues 90-190 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2020-09-23 _Entry.Accession_date 2020-09-23 _Entry.Last_release_date 2020-09-24 _Entry.Original_release_date 2020-09-24 _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 1 _Entry.Generated_software_label $software_1 _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 Yansheng Ye . . . . 50479 2 Erin Tyndall . R. . . 50479 3 Fang Tian . . . . 50479 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 50479 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 571 50479 '15N chemical shifts' 181 50479 '1H chemical shifts' 181 50479 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 . . 2022-02-15 2020-09-23 update BMRB 'update entry citation' 50479 1 . . 2020-11-25 2020-09-23 original author 'original release' 50479 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 50470 'Human Atg3 without N-terminal 25 resides' 50479 BMRB 50480 'human Atg3 with deletion of 90 to 190 residues in bicelles' 50479 BMRB 50481 'human Atg3 P21A with deletion of 90 to 190 residues in ficelle' 50479 stop_ save_ ############### # Citations # ############### save_citations_1 _Citation.Sf_category citations _Citation.Sf_framecode citations_1 _Citation.Entry_ID 50479 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 33446636 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; An N-terminal conserved region in human Atg3 couples membrane curvature sensitivity to conjugase activity during autophagy ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Nat. Commun.' _Citation.Journal_name_full 'Nature communications' _Citation.Journal_volume 12 _Citation.Journal_issue 1 _Citation.Journal_ASTM . _Citation.Journal_ISSN 2041-1723 _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 374 _Citation.Page_last 374 _Citation.Year 2021 _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 Yansheng Ye Y. . . . 50479 1 2 Erin Tyndall E. R. . . 50479 1 3 Van Bui V. . . . 50479 1 4 Zhenyuan Tang Z. . . . 50479 1 5 Yan Shen Y. . . . 50479 1 6 Xuejun Jiang X. . . . 50479 1 7 John Flanagan J. M. . . 50479 1 8 Hong-Gang Wang H. G. . . 50479 1 9 Fang Tian F. . . . 50479 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID Atg3 50479 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly_1 _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly_1 _Assembly.Entry_ID 50479 _Assembly.ID 1 _Assembly.Name 'human Atg3 with deletion of 90 to 190 residues' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _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 hAtg3_d90-190 1 $entity_1 . . yes native no no . . . 50479 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 50479 _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 ; MQNVINTVKGKALEVAEYLT PVLKESKFKETGVITPEEFV AAGDHLVHHCPTWQWATGEE LKVKAYLPTGKQFLVTKNVP CYKRCKQMEEDAILQTRTYD LYITYDKYYQTPRLWLFGYD EQRQPLTVEHMYEDISQDHV KKTVTIENHPHLPPPPMCSV HPCRHAEVMKKIIETVAEGG GELGVHMYLLIFLKFVQAVI PTIEYDYTRHFTM ; _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 213 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _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 . MET . 50479 1 2 . GLN . 50479 1 3 . ASN . 50479 1 4 . VAL . 50479 1 5 . ILE . 50479 1 6 . ASN . 50479 1 7 . THR . 50479 1 8 . VAL . 50479 1 9 . LYS . 50479 1 10 . GLY . 50479 1 11 . LYS . 50479 1 12 . ALA . 50479 1 13 . LEU . 50479 1 14 . GLU . 50479 1 15 . VAL . 50479 1 16 . ALA . 50479 1 17 . GLU . 50479 1 18 . TYR . 50479 1 19 . LEU . 50479 1 20 . THR . 50479 1 21 . PRO . 50479 1 22 . VAL . 50479 1 23 . LEU . 50479 1 24 . LYS . 50479 1 25 . GLU . 50479 1 26 . SER . 50479 1 27 . LYS . 50479 1 28 . PHE . 50479 1 29 . LYS . 50479 1 30 . GLU . 50479 1 31 . THR . 50479 1 32 . GLY . 50479 1 33 . VAL . 50479 1 34 . ILE . 50479 1 35 . THR . 50479 1 36 . PRO . 50479 1 37 . GLU . 50479 1 38 . GLU . 50479 1 39 . PHE . 50479 1 40 . VAL . 50479 1 41 . ALA . 50479 1 42 . ALA . 50479 1 43 . GLY . 50479 1 44 . ASP . 50479 1 45 . HIS . 50479 1 46 . LEU . 50479 1 47 . VAL . 50479 1 48 . HIS . 50479 1 49 . HIS . 50479 1 50 . CYS . 50479 1 51 . PRO . 50479 1 52 . THR . 50479 1 53 . TRP . 50479 1 54 . GLN . 50479 1 55 . TRP . 50479 1 56 . ALA . 50479 1 57 . THR . 50479 1 58 . GLY . 50479 1 59 . GLU . 50479 1 60 . GLU . 50479 1 61 . LEU . 50479 1 62 . LYS . 50479 1 63 . VAL . 50479 1 64 . LYS . 50479 1 65 . ALA . 50479 1 66 . TYR . 50479 1 67 . LEU . 50479 1 68 . PRO . 50479 1 69 . THR . 50479 1 70 . GLY . 50479 1 71 . LYS . 50479 1 72 . GLN . 50479 1 73 . PHE . 50479 1 74 . LEU . 50479 1 75 . VAL . 50479 1 76 . THR . 50479 1 77 . LYS . 50479 1 78 . ASN . 50479 1 79 . VAL . 50479 1 80 . PRO . 50479 1 81 . CYS . 50479 1 82 . TYR . 50479 1 83 . LYS . 50479 1 84 . ARG . 50479 1 85 . CYS . 50479 1 86 . LYS . 50479 1 87 . GLN . 50479 1 88 . MET . 50479 1 89 . GLU . 50479 1 90 . GLU . 50479 1 91 . ASP . 50479 1 92 . ALA . 50479 1 93 . ILE . 50479 1 94 . LEU . 50479 1 95 . GLN . 50479 1 96 . THR . 50479 1 97 . ARG . 50479 1 98 . THR . 50479 1 99 . TYR . 50479 1 100 . ASP . 50479 1 101 . LEU . 50479 1 102 . TYR . 50479 1 103 . ILE . 50479 1 104 . THR . 50479 1 105 . TYR . 50479 1 106 . ASP . 50479 1 107 . LYS . 50479 1 108 . TYR . 50479 1 109 . TYR . 50479 1 110 . GLN . 50479 1 111 . THR . 50479 1 112 . PRO . 50479 1 113 . ARG . 50479 1 114 . LEU . 50479 1 115 . TRP . 50479 1 116 . LEU . 50479 1 117 . PHE . 50479 1 118 . GLY . 50479 1 119 . TYR . 50479 1 120 . ASP . 50479 1 121 . GLU . 50479 1 122 . GLN . 50479 1 123 . ARG . 50479 1 124 . GLN . 50479 1 125 . PRO . 50479 1 126 . LEU . 50479 1 127 . THR . 50479 1 128 . VAL . 50479 1 129 . GLU . 50479 1 130 . HIS . 50479 1 131 . MET . 50479 1 132 . TYR . 50479 1 133 . GLU . 50479 1 134 . ASP . 50479 1 135 . ILE . 50479 1 136 . SER . 50479 1 137 . GLN . 50479 1 138 . ASP . 50479 1 139 . HIS . 50479 1 140 . VAL . 50479 1 141 . LYS . 50479 1 142 . LYS . 50479 1 143 . THR . 50479 1 144 . VAL . 50479 1 145 . THR . 50479 1 146 . ILE . 50479 1 147 . GLU . 50479 1 148 . ASN . 50479 1 149 . HIS . 50479 1 150 . PRO . 50479 1 151 . HIS . 50479 1 152 . LEU . 50479 1 153 . PRO . 50479 1 154 . PRO . 50479 1 155 . PRO . 50479 1 156 . PRO . 50479 1 157 . MET . 50479 1 158 . CYS . 50479 1 159 . SER . 50479 1 160 . VAL . 50479 1 161 . HIS . 50479 1 162 . PRO . 50479 1 163 . CYS . 50479 1 164 . ARG . 50479 1 165 . HIS . 50479 1 166 . ALA . 50479 1 167 . GLU . 50479 1 168 . VAL . 50479 1 169 . MET . 50479 1 170 . LYS . 50479 1 171 . LYS . 50479 1 172 . ILE . 50479 1 173 . ILE . 50479 1 174 . GLU . 50479 1 175 . THR . 50479 1 176 . VAL . 50479 1 177 . ALA . 50479 1 178 . GLU . 50479 1 179 . GLY . 50479 1 180 . GLY . 50479 1 181 . GLY . 50479 1 182 . GLU . 50479 1 183 . LEU . 50479 1 184 . GLY . 50479 1 185 . VAL . 50479 1 186 . HIS . 50479 1 187 . MET . 50479 1 188 . TYR . 50479 1 189 . LEU . 50479 1 190 . LEU . 50479 1 191 . ILE . 50479 1 192 . PHE . 50479 1 193 . LEU . 50479 1 194 . LYS . 50479 1 195 . PHE . 50479 1 196 . VAL . 50479 1 197 . GLN . 50479 1 198 . ALA . 50479 1 199 . VAL . 50479 1 200 . ILE . 50479 1 201 . PRO . 50479 1 202 . THR . 50479 1 203 . ILE . 50479 1 204 . GLU . 50479 1 205 . TYR . 50479 1 206 . ASP . 50479 1 207 . TYR . 50479 1 208 . THR . 50479 1 209 . ARG . 50479 1 210 . HIS . 50479 1 211 . PHE . 50479 1 212 . THR . 50479 1 213 . MET . 50479 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 50479 1 . GLN 2 2 50479 1 . ASN 3 3 50479 1 . VAL 4 4 50479 1 . ILE 5 5 50479 1 . ASN 6 6 50479 1 . THR 7 7 50479 1 . VAL 8 8 50479 1 . LYS 9 9 50479 1 . GLY 10 10 50479 1 . LYS 11 11 50479 1 . ALA 12 12 50479 1 . LEU 13 13 50479 1 . GLU 14 14 50479 1 . VAL 15 15 50479 1 . ALA 16 16 50479 1 . GLU 17 17 50479 1 . TYR 18 18 50479 1 . LEU 19 19 50479 1 . THR 20 20 50479 1 . PRO 21 21 50479 1 . VAL 22 22 50479 1 . LEU 23 23 50479 1 . LYS 24 24 50479 1 . GLU 25 25 50479 1 . SER 26 26 50479 1 . LYS 27 27 50479 1 . PHE 28 28 50479 1 . LYS 29 29 50479 1 . GLU 30 30 50479 1 . THR 31 31 50479 1 . GLY 32 32 50479 1 . VAL 33 33 50479 1 . ILE 34 34 50479 1 . THR 35 35 50479 1 . PRO 36 36 50479 1 . GLU 37 37 50479 1 . GLU 38 38 50479 1 . PHE 39 39 50479 1 . VAL 40 40 50479 1 . ALA 41 41 50479 1 . ALA 42 42 50479 1 . GLY 43 43 50479 1 . ASP 44 44 50479 1 . HIS 45 45 50479 1 . LEU 46 46 50479 1 . VAL 47 47 50479 1 . HIS 48 48 50479 1 . HIS 49 49 50479 1 . CYS 50 50 50479 1 . PRO 51 51 50479 1 . THR 52 52 50479 1 . TRP 53 53 50479 1 . GLN 54 54 50479 1 . TRP 55 55 50479 1 . ALA 56 56 50479 1 . THR 57 57 50479 1 . GLY 58 58 50479 1 . GLU 59 59 50479 1 . GLU 60 60 50479 1 . LEU 61 61 50479 1 . LYS 62 62 50479 1 . VAL 63 63 50479 1 . LYS 64 64 50479 1 . ALA 65 65 50479 1 . TYR 66 66 50479 1 . LEU 67 67 50479 1 . PRO 68 68 50479 1 . THR 69 69 50479 1 . GLY 70 70 50479 1 . LYS 71 71 50479 1 . GLN 72 72 50479 1 . PHE 73 73 50479 1 . LEU 74 74 50479 1 . VAL 75 75 50479 1 . THR 76 76 50479 1 . LYS 77 77 50479 1 . ASN 78 78 50479 1 . VAL 79 79 50479 1 . PRO 80 80 50479 1 . CYS 81 81 50479 1 . TYR 82 82 50479 1 . LYS 83 83 50479 1 . ARG 84 84 50479 1 . CYS 85 85 50479 1 . LYS 86 86 50479 1 . GLN 87 87 50479 1 . MET 88 88 50479 1 . GLU 89 89 50479 1 . GLU 90 90 50479 1 . ASP 91 91 50479 1 . ALA 92 92 50479 1 . ILE 93 93 50479 1 . LEU 94 94 50479 1 . GLN 95 95 50479 1 . THR 96 96 50479 1 . ARG 97 97 50479 1 . THR 98 98 50479 1 . TYR 99 99 50479 1 . ASP 100 100 50479 1 . LEU 101 101 50479 1 . TYR 102 102 50479 1 . ILE 103 103 50479 1 . THR 104 104 50479 1 . TYR 105 105 50479 1 . ASP 106 106 50479 1 . LYS 107 107 50479 1 . TYR 108 108 50479 1 . TYR 109 109 50479 1 . GLN 110 110 50479 1 . THR 111 111 50479 1 . PRO 112 112 50479 1 . ARG 113 113 50479 1 . LEU 114 114 50479 1 . TRP 115 115 50479 1 . LEU 116 116 50479 1 . PHE 117 117 50479 1 . GLY 118 118 50479 1 . TYR 119 119 50479 1 . ASP 120 120 50479 1 . GLU 121 121 50479 1 . GLN 122 122 50479 1 . ARG 123 123 50479 1 . GLN 124 124 50479 1 . PRO 125 125 50479 1 . LEU 126 126 50479 1 . THR 127 127 50479 1 . VAL 128 128 50479 1 . GLU 129 129 50479 1 . HIS 130 130 50479 1 . MET 131 131 50479 1 . TYR 132 132 50479 1 . GLU 133 133 50479 1 . ASP 134 134 50479 1 . ILE 135 135 50479 1 . SER 136 136 50479 1 . GLN 137 137 50479 1 . ASP 138 138 50479 1 . HIS 139 139 50479 1 . VAL 140 140 50479 1 . LYS 141 141 50479 1 . LYS 142 142 50479 1 . THR 143 143 50479 1 . VAL 144 144 50479 1 . THR 145 145 50479 1 . ILE 146 146 50479 1 . GLU 147 147 50479 1 . ASN 148 148 50479 1 . HIS 149 149 50479 1 . PRO 150 150 50479 1 . HIS 151 151 50479 1 . LEU 152 152 50479 1 . PRO 153 153 50479 1 . PRO 154 154 50479 1 . PRO 155 155 50479 1 . PRO 156 156 50479 1 . MET 157 157 50479 1 . CYS 158 158 50479 1 . SER 159 159 50479 1 . VAL 160 160 50479 1 . HIS 161 161 50479 1 . PRO 162 162 50479 1 . CYS 163 163 50479 1 . ARG 164 164 50479 1 . HIS 165 165 50479 1 . ALA 166 166 50479 1 . GLU 167 167 50479 1 . VAL 168 168 50479 1 . MET 169 169 50479 1 . LYS 170 170 50479 1 . LYS 171 171 50479 1 . ILE 172 172 50479 1 . ILE 173 173 50479 1 . GLU 174 174 50479 1 . THR 175 175 50479 1 . VAL 176 176 50479 1 . ALA 177 177 50479 1 . GLU 178 178 50479 1 . GLY 179 179 50479 1 . GLY 180 180 50479 1 . GLY 181 181 50479 1 . GLU 182 182 50479 1 . LEU 183 183 50479 1 . GLY 184 184 50479 1 . VAL 185 185 50479 1 . HIS 186 186 50479 1 . MET 187 187 50479 1 . TYR 188 188 50479 1 . LEU 189 189 50479 1 . LEU 190 190 50479 1 . ILE 191 191 50479 1 . PHE 192 192 50479 1 . LEU 193 193 50479 1 . LYS 194 194 50479 1 . PHE 195 195 50479 1 . VAL 196 196 50479 1 . GLN 197 197 50479 1 . ALA 198 198 50479 1 . VAL 199 199 50479 1 . ILE 200 200 50479 1 . PRO 201 201 50479 1 . THR 202 202 50479 1 . ILE 203 203 50479 1 . GLU 204 204 50479 1 . TYR 205 205 50479 1 . ASP 206 206 50479 1 . TYR 207 207 50479 1 . THR 208 208 50479 1 . ARG 209 209 50479 1 . HIS 210 210 50479 1 . PHE 211 211 50479 1 . THR 212 212 50479 1 . MET 213 213 50479 1 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 50479 _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 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . 50479 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 50479 _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 . . pET28a . . . 50479 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 50479 _Sample.ID 1 _Sample.Name 'Human Atg3 with deletion of 90 to 190 residues' _Sample.Type solution _Sample.Sub_type . _Sample.Details '2H, 13C, and 15N-labled hAtg3_d90-190 in 50 mM Hepes, 150 mM NaCl, 2 mM cep, pH 6.5' _Sample.Aggregate_sample_number 1 _Sample.Solvent_system '95% H2O/5% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'human Atg3 with deletion of 90 to 190 residues' '[U-13C; U-15N; U-2H]' . . 1 $entity_1 . . 0.5 . . mM . . . . 50479 1 2 'sodium chloride' 'natural abundance' . . . . . . 150 . . mM . . . . 50479 1 3 HEPES 'natural abundance' . . . . . . 50 . . mM . . . . 50479 1 4 TCEP 'natural abundance' . . . . . . 2 . . mM . . . . 50479 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 50479 _Sample_condition_list.ID 1 _Sample_condition_list.Name condition_1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0.15 . M 50479 1 pH 6.5 . pH 50479 1 pressure 1 . atm 50479 1 temperature 298 . K 50479 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 50479 _Software.ID 1 _Software.Type . _Software.Name 'NMRPipe, NMRView' _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'data processing and analysis' . 50479 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID 50479 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name Bruker600 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 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 50479 _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 TROSY' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50479 1 2 '3D HNCO' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50479 1 3 '3D HNCACO' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50479 1 4 '3D HNCA' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50479 1 5 '3D HN(CO)CA' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50479 1 6 '3D HNCACB' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50479 1 7 '3D HN(CO)CACB' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50479 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 50479 _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 na indirect 0.251449530 . . . . . 50479 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . 50479 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . 50479 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 50479 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name '1H, 13C, and 15N resonance assignment for human Atg3 with deletion of 90 to 190 residues' _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 0.04 _Assigned_chem_shift_list.Chem_shift_13C_err 0.3 _Assigned_chem_shift_list.Chem_shift_15N_err 0.2 _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 4 '3D HNCA' . . . 50479 1 5 '3D HN(CO)CA' . . . 50479 1 6 '3D HNCACB' . . . 50479 1 7 '3D HN(CO)CACB' . . . 50479 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 1 $software_1 . . 50479 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 MET C C 13 176.2000 0.3 . 1 . . . . . 1 MET C . 50479 1 2 . 1 . 1 1 1 MET CA C 13 55.2800 0.3 . 1 . . . . . 1 MET CA . 50479 1 3 . 1 . 1 2 2 GLN H H 1 8.2780 0.04 . 1 . . . . . 2 GLN HN . 50479 1 4 . 1 . 1 2 2 GLN C C 13 175.5900 0.3 . 1 . . . . . 2 GLN C . 50479 1 5 . 1 . 1 2 2 GLN CA C 13 55.6200 0.3 . 1 . . . . . 2 GLN CA . 50479 1 6 . 1 . 1 2 2 GLN CB C 13 28.5600 0.3 . 1 . . . . . 2 GLN CB . 50479 1 7 . 1 . 1 2 2 GLN N N 15 121.7800 0.2 . 1 . . . . . 2 GLN N . 50479 1 8 . 1 . 1 3 3 ASN H H 1 8.3540 0.04 . 1 . . . . . 3 ASN HN . 50479 1 9 . 1 . 1 3 3 ASN C C 13 174.9700 0.3 . 1 . . . . . 3 ASN C . 50479 1 10 . 1 . 1 3 3 ASN CA C 13 53.0900 0.3 . 1 . . . . . 3 ASN CA . 50479 1 11 . 1 . 1 3 3 ASN CB C 13 38.3300 0.3 . 1 . . . . . 3 ASN CB . 50479 1 12 . 1 . 1 3 3 ASN N N 15 120.4200 0.2 . 1 . . . . . 3 ASN N . 50479 1 13 . 1 . 1 4 4 VAL H H 1 7.9580 0.04 . 1 . . . . . 4 VAL HN . 50479 1 14 . 1 . 1 4 4 VAL C C 13 176.0700 0.3 . 1 . . . . . 4 VAL C . 50479 1 15 . 1 . 1 4 4 VAL CA C 13 62.1200 0.3 . 1 . . . . . 4 VAL CA . 50479 1 16 . 1 . 1 4 4 VAL CB C 13 31.6900 0.3 . 1 . . . . . 4 VAL CB . 50479 1 17 . 1 . 1 4 4 VAL N N 15 120.9400 0.2 . 1 . . . . . 4 VAL N . 50479 1 18 . 1 . 1 5 5 ILE H H 1 8.1020 0.04 . 1 . . . . . 5 ILE HN . 50479 1 19 . 1 . 1 5 5 ILE C C 13 175.9300 0.3 . 1 . . . . . 5 ILE C . 50479 1 20 . 1 . 1 5 5 ILE CA C 13 60.7000 0.3 . 1 . . . . . 5 ILE CA . 50479 1 21 . 1 . 1 5 5 ILE CB C 13 37.6000 0.3 . 1 . . . . . 5 ILE CB . 50479 1 22 . 1 . 1 5 5 ILE N N 15 124.6400 0.2 . 1 . . . . . 5 ILE N . 50479 1 23 . 1 . 1 6 6 ASN H H 1 8.3820 0.04 . 1 . . . . . 6 ASN HN . 50479 1 24 . 1 . 1 6 6 ASN C C 13 175.2700 0.3 . 1 . . . . . 6 ASN C . 50479 1 25 . 1 . 1 6 6 ASN CA C 13 52.8900 0.3 . 1 . . . . . 6 ASN CA . 50479 1 26 . 1 . 1 6 6 ASN CB C 13 38.2900 0.3 . 1 . . . . . 6 ASN CB . 50479 1 27 . 1 . 1 6 6 ASN N N 15 123.2900 0.2 . 1 . . . . . 6 ASN N . 50479 1 28 . 1 . 1 7 7 THR H H 1 8.0280 0.04 . 1 . . . . . 7 THR HN . 50479 1 29 . 1 . 1 7 7 THR C C 13 174.5700 0.3 . 1 . . . . . 7 THR C . 50479 1 30 . 1 . 1 7 7 THR CA C 13 61.5800 0.3 . 1 . . . . . 7 THR CA . 50479 1 31 . 1 . 1 7 7 THR CB C 13 69.6200 0.3 . 1 . . . . . 7 THR CB . 50479 1 32 . 1 . 1 7 7 THR N N 15 115.7400 0.2 . 1 . . . . . 7 THR N . 50479 1 33 . 1 . 1 8 8 VAL H H 1 8.0540 0.04 . 1 . . . . . 8 VAL HN . 50479 1 34 . 1 . 1 8 8 VAL C C 13 176.1900 0.3 . 1 . . . . . 8 VAL C . 50479 1 35 . 1 . 1 8 8 VAL CA C 13 62.1400 0.3 . 1 . . . . . 8 VAL CA . 50479 1 36 . 1 . 1 8 8 VAL CB C 13 31.8400 0.3 . 1 . . . . . 8 VAL CB . 50479 1 37 . 1 . 1 8 8 VAL N N 15 123.2500 0.2 . 1 . . . . . 8 VAL N . 50479 1 38 . 1 . 1 9 9 LYS H H 1 8.2770 0.04 . 1 . . . . . 9 LYS HN . 50479 1 39 . 1 . 1 9 9 LYS C C 13 177.0800 0.3 . 1 . . . . . 9 LYS C . 50479 1 40 . 1 . 1 9 9 LYS CA C 13 56.1200 0.3 . 1 . . . . . 9 LYS CA . 50479 1 41 . 1 . 1 9 9 LYS CB C 13 32.0000 0.3 . 1 . . . . . 9 LYS CB . 50479 1 42 . 1 . 1 9 9 LYS N N 15 125.5900 0.2 . 1 . . . . . 9 LYS N . 50479 1 43 . 1 . 1 10 10 GLY H H 1 8.2610 0.04 . 1 . . . . . 10 GLY HN . 50479 1 44 . 1 . 1 10 10 GLY C C 13 174.0200 0.3 . 1 . . . . . 10 GLY C . 50479 1 45 . 1 . 1 10 10 GLY CA C 13 44.8300 0.3 . 1 . . . . . 10 GLY CA . 50479 1 46 . 1 . 1 10 10 GLY N N 15 110.5800 0.2 . 1 . . . . . 10 GLY N . 50479 1 47 . 1 . 1 11 11 LYS H H 1 8.0240 0.04 . 1 . . . . . 11 LYS HN . 50479 1 48 . 1 . 1 11 11 LYS C C 13 176.3300 0.3 . 1 . . . . . 11 LYS C . 50479 1 49 . 1 . 1 11 11 LYS CA C 13 55.8500 0.3 . 1 . . . . . 11 LYS CA . 50479 1 50 . 1 . 1 11 11 LYS CB C 13 32.1200 0.3 . 1 . . . . . 11 LYS CB . 50479 1 51 . 1 . 1 11 11 LYS N N 15 121.8400 0.2 . 1 . . . . . 11 LYS N . 50479 1 52 . 1 . 1 12 12 ALA H H 1 8.2090 0.04 . 1 . . . . . 12 ALA HN . 50479 1 53 . 1 . 1 12 12 ALA C C 13 177.6000 0.3 . 1 . . . . . 12 ALA C . 50479 1 54 . 1 . 1 12 12 ALA CA C 13 52.1100 0.3 . 1 . . . . . 12 ALA CA . 50479 1 55 . 1 . 1 12 12 ALA CB C 13 18.4000 0.3 . 1 . . . . . 12 ALA CB . 50479 1 56 . 1 . 1 12 12 ALA N N 15 125.6200 0.2 . 1 . . . . . 12 ALA N . 50479 1 57 . 1 . 1 13 13 LEU H H 1 8.0740 0.04 . 1 . . . . . 13 LEU HN . 50479 1 58 . 1 . 1 13 13 LEU C C 13 177.3800 0.3 . 1 . . . . . 13 LEU C . 50479 1 59 . 1 . 1 13 13 LEU CA C 13 54.8200 0.3 . 1 . . . . . 13 LEU CA . 50479 1 60 . 1 . 1 13 13 LEU CB C 13 41.4000 0.3 . 1 . . . . . 13 LEU CB . 50479 1 61 . 1 . 1 13 13 LEU N N 15 121.8400 0.2 . 1 . . . . . 13 LEU N . 50479 1 62 . 1 . 1 14 14 GLU H H 1 8.2350 0.04 . 1 . . . . . 14 GLU HN . 50479 1 63 . 1 . 1 14 14 GLU C C 13 176.4000 0.3 . 1 . . . . . 14 GLU C . 50479 1 64 . 1 . 1 14 14 GLU CA C 13 56.0900 0.3 . 1 . . . . . 14 GLU CA . 50479 1 65 . 1 . 1 14 14 GLU CB C 13 29.4000 0.3 . 1 . . . . . 14 GLU CB . 50479 1 66 . 1 . 1 14 14 GLU N N 15 122.3300 0.2 . 1 . . . . . 14 GLU N . 50479 1 67 . 1 . 1 15 15 VAL H H 1 7.9850 0.04 . 1 . . . . . 15 VAL HN . 50479 1 68 . 1 . 1 15 15 VAL C C 13 175.7600 0.3 . 1 . . . . . 15 VAL C . 50479 1 69 . 1 . 1 15 15 VAL CA C 13 61.7200 0.3 . 1 . . . . . 15 VAL CA . 50479 1 70 . 1 . 1 15 15 VAL N N 15 121.3800 0.2 . 1 . . . . . 15 VAL N . 50479 1 71 . 1 . 1 16 16 ALA H H 1 8.1740 0.04 . 1 . . . . . 16 ALA HN . 50479 1 72 . 1 . 1 16 16 ALA C C 13 177.5800 0.3 . 1 . . . . . 16 ALA C . 50479 1 73 . 1 . 1 16 16 ALA CA C 13 52.1100 0.3 . 1 . . . . . 16 ALA CA . 50479 1 74 . 1 . 1 16 16 ALA CB C 13 18.3900 0.3 . 1 . . . . . 16 ALA CB . 50479 1 75 . 1 . 1 16 16 ALA N N 15 127.9100 0.2 . 1 . . . . . 16 ALA N . 50479 1 76 . 1 . 1 17 17 GLU H H 1 8.2000 0.04 . 1 . . . . . 17 GLU HN . 50479 1 77 . 1 . 1 17 17 GLU C C 13 176.0700 0.3 . 1 . . . . . 17 GLU C . 50479 1 78 . 1 . 1 17 17 GLU CA C 13 56.4400 0.3 . 1 . . . . . 17 GLU CA . 50479 1 79 . 1 . 1 17 17 GLU CB C 13 29.3500 0.3 . 1 . . . . . 17 GLU CB . 50479 1 80 . 1 . 1 17 17 GLU N N 15 120.4400 0.2 . 1 . . . . . 17 GLU N . 50479 1 81 . 1 . 1 18 18 TYR H H 1 7.8410 0.04 . 1 . . . . . 18 TYR HN . 50479 1 82 . 1 . 1 18 18 TYR C C 13 175.2400 0.3 . 1 . . . . . 18 TYR C . 50479 1 83 . 1 . 1 18 18 TYR CA C 13 57.0700 0.3 . 1 . . . . . 18 TYR CA . 50479 1 84 . 1 . 1 18 18 TYR CB C 13 37.8800 0.3 . 1 . . . . . 18 TYR CB . 50479 1 85 . 1 . 1 18 18 TYR N N 15 120.4200 0.2 . 1 . . . . . 18 TYR N . 50479 1 86 . 1 . 1 19 19 LEU H H 1 7.7790 0.04 . 1 . . . . . 19 LEU HN . 50479 1 87 . 1 . 1 19 19 LEU C C 13 176.5000 0.3 . 1 . . . . . 19 LEU C . 50479 1 88 . 1 . 1 19 19 LEU CA C 13 54.0900 0.3 . 1 . . . . . 19 LEU CA . 50479 1 89 . 1 . 1 19 19 LEU CB C 13 41.4300 0.3 . 1 . . . . . 19 LEU CB . 50479 1 90 . 1 . 1 19 19 LEU N N 15 124.6600 0.2 . 1 . . . . . 19 LEU N . 50479 1 91 . 1 . 1 20 20 THR H H 1 7.7290 0.04 . 1 . . . . . 20 THR HN . 50479 1 92 . 1 . 1 20 20 THR C C 13 173.0500 0.3 . 1 . . . . . 20 THR C . 50479 1 93 . 1 . 1 20 20 THR CA C 13 59.7200 0.3 . 1 . . . . . 20 THR CA . 50479 1 94 . 1 . 1 20 20 THR CB C 13 69.1100 0.3 . 1 . . . . . 20 THR CB . 50479 1 95 . 1 . 1 20 20 THR N N 15 117.6200 0.2 . 1 . . . . . 20 THR N . 50479 1 96 . 1 . 1 21 21 PRO C C 13 177.1100 0.3 . 1 . . . . . 21 PRO C . 50479 1 97 . 1 . 1 21 21 PRO CA C 13 63.2800 0.3 . 1 . . . . . 21 PRO CA . 50479 1 98 . 1 . 1 21 21 PRO CB C 13 31.2100 0.3 . 1 . . . . . 21 PRO CB . 50479 1 99 . 1 . 1 22 22 VAL H H 1 7.9340 0.04 . 1 . . . . . 22 VAL HN . 50479 1 100 . 1 . 1 22 22 VAL C C 13 176.6300 0.3 . 1 . . . . . 22 VAL C . 50479 1 101 . 1 . 1 22 22 VAL CA C 13 62.4100 0.3 . 1 . . . . . 22 VAL CA . 50479 1 102 . 1 . 1 22 22 VAL CB C 13 31.2300 0.3 . 1 . . . . . 22 VAL CB . 50479 1 103 . 1 . 1 22 22 VAL N N 15 119.9700 0.2 . 1 . . . . . 22 VAL N . 50479 1 104 . 1 . 1 23 23 LEU H H 1 8.0510 0.04 . 1 . . . . . 23 LEU HN . 50479 1 105 . 1 . 1 23 23 LEU C C 13 177.8700 0.3 . 1 . . . . . 23 LEU C . 50479 1 106 . 1 . 1 23 23 LEU CA C 13 55.0900 0.3 . 1 . . . . . 23 LEU CA . 50479 1 107 . 1 . 1 23 23 LEU CB C 13 41.1100 0.3 . 1 . . . . . 23 LEU CB . 50479 1 108 . 1 . 1 23 23 LEU N N 15 126.0500 0.2 . 1 . . . . . 23 LEU N . 50479 1 109 . 1 . 1 24 24 LYS H H 1 8.1680 0.04 . 1 . . . . . 24 LYS HN . 50479 1 110 . 1 . 1 24 24 LYS C C 13 176.8000 0.3 . 1 . . . . . 24 LYS C . 50479 1 111 . 1 . 1 24 24 LYS CA C 13 56.6300 0.3 . 1 . . . . . 24 LYS CA . 50479 1 112 . 1 . 1 24 24 LYS CB C 13 31.9300 0.3 . 1 . . . . . 24 LYS CB . 50479 1 113 . 1 . 1 24 24 LYS N N 15 122.3600 0.2 . 1 . . . . . 24 LYS N . 50479 1 114 . 1 . 1 25 25 GLU H H 1 8.1370 0.04 . 1 . . . . . 25 GLU HN . 50479 1 115 . 1 . 1 25 25 GLU C C 13 176.1800 0.3 . 1 . . . . . 25 GLU C . 50479 1 116 . 1 . 1 25 25 GLU CA C 13 55.8500 0.3 . 1 . . . . . 25 GLU CA . 50479 1 117 . 1 . 1 25 25 GLU CB C 13 29.1300 0.3 . 1 . . . . . 25 GLU CB . 50479 1 118 . 1 . 1 25 25 GLU N N 15 120.8900 0.2 . 1 . . . . . 25 GLU N . 50479 1 119 . 1 . 1 26 26 SER H H 1 8.0240 0.04 . 1 . . . . . 26 SER HN . 50479 1 120 . 1 . 1 26 26 SER C C 13 176.1500 0.3 . 1 . . . . . 26 SER C . 50479 1 121 . 1 . 1 26 26 SER CA C 13 58.3300 0.3 . 1 . . . . . 26 SER CA . 50479 1 122 . 1 . 1 26 26 SER CB C 13 63.5300 0.3 . 1 . . . . . 26 SER CB . 50479 1 123 . 1 . 1 26 26 SER N N 15 116.2200 0.2 . 1 . . . . . 26 SER N . 50479 1 124 . 1 . 1 27 27 LYS H H 1 8.9770 0.04 . 1 . . . . . 27 LYS HN . 50479 1 125 . 1 . 1 27 27 LYS C C 13 178.0900 0.3 . 1 . . . . . 27 LYS C . 50479 1 126 . 1 . 1 27 27 LYS CA C 13 55.6700 0.3 . 1 . . . . . 27 LYS CA . 50479 1 127 . 1 . 1 27 27 LYS CB C 13 31.2900 0.3 . 1 . . . . . 27 LYS CB . 50479 1 128 . 1 . 1 27 27 LYS N N 15 127.4700 0.2 . 1 . . . . . 27 LYS N . 50479 1 129 . 1 . 1 28 28 PHE H H 1 8.5290 0.04 . 1 . . . . . 28 PHE HN . 50479 1 130 . 1 . 1 28 28 PHE C C 13 176.4200 0.3 . 1 . . . . . 28 PHE C . 50479 1 131 . 1 . 1 28 28 PHE CA C 13 60.3600 0.3 . 1 . . . . . 28 PHE CA . 50479 1 132 . 1 . 1 28 28 PHE CB C 13 38.2300 0.3 . 1 . . . . . 28 PHE CB . 50479 1 133 . 1 . 1 28 28 PHE N N 15 123.7200 0.2 . 1 . . . . . 28 PHE N . 50479 1 134 . 1 . 1 29 29 LYS H H 1 7.7730 0.04 . 1 . . . . . 29 LYS HN . 50479 1 135 . 1 . 1 29 29 LYS C C 13 176.8500 0.3 . 1 . . . . . 29 LYS C . 50479 1 136 . 1 . 1 29 29 LYS CA C 13 58.0200 0.3 . 1 . . . . . 29 LYS CA . 50479 1 137 . 1 . 1 29 29 LYS CB C 13 31.0700 0.3 . 1 . . . . . 29 LYS CB . 50479 1 138 . 1 . 1 29 29 LYS N N 15 119.3100 0.2 . 1 . . . . . 29 LYS N . 50479 1 139 . 1 . 1 30 30 GLU H H 1 7.7810 0.04 . 1 . . . . . 30 GLU HN . 50479 1 140 . 1 . 1 30 30 GLU C C 13 177.8100 0.3 . 1 . . . . . 30 GLU C . 50479 1 141 . 1 . 1 30 30 GLU CA C 13 57.3100 0.3 . 1 . . . . . 30 GLU CA . 50479 1 142 . 1 . 1 30 30 GLU CB C 13 30.1900 0.3 . 1 . . . . . 30 GLU CB . 50479 1 143 . 1 . 1 30 30 GLU N N 15 116.2200 0.2 . 1 . . . . . 30 GLU N . 50479 1 144 . 1 . 1 31 31 THR H H 1 7.8830 0.04 . 1 . . . . . 31 THR HN . 50479 1 145 . 1 . 1 31 31 THR C C 13 175.8300 0.3 . 1 . . . . . 31 THR C . 50479 1 146 . 1 . 1 31 31 THR CA C 13 61.4600 0.3 . 1 . . . . . 31 THR CA . 50479 1 147 . 1 . 1 31 31 THR CB C 13 70.5400 0.3 . 1 . . . . . 31 THR CB . 50479 1 148 . 1 . 1 31 31 THR N N 15 107.2800 0.2 . 1 . . . . . 31 THR N . 50479 1 149 . 1 . 1 32 32 GLY H H 1 8.4890 0.04 . 1 . . . . . 32 GLY HN . 50479 1 150 . 1 . 1 32 32 GLY C C 13 172.7200 0.3 . 1 . . . . . 32 GLY C . 50479 1 151 . 1 . 1 32 32 GLY CA C 13 45.6200 0.3 . 1 . . . . . 32 GLY CA . 50479 1 152 . 1 . 1 32 32 GLY N N 15 111.0700 0.2 . 1 . . . . . 32 GLY N . 50479 1 153 . 1 . 1 33 33 VAL H H 1 7.3110 0.04 . 1 . . . . . 33 VAL HN . 50479 1 154 . 1 . 1 33 33 VAL C C 13 175.2900 0.3 . 1 . . . . . 33 VAL C . 50479 1 155 . 1 . 1 33 33 VAL CA C 13 59.8800 0.3 . 1 . . . . . 33 VAL CA . 50479 1 156 . 1 . 1 33 33 VAL CB C 13 31.9300 0.3 . 1 . . . . . 33 VAL CB . 50479 1 157 . 1 . 1 33 33 VAL N N 15 113.9700 0.2 . 1 . . . . . 33 VAL N . 50479 1 158 . 1 . 1 34 34 ILE H H 1 8.4880 0.04 . 1 . . . . . 34 ILE HN . 50479 1 159 . 1 . 1 34 34 ILE C C 13 176.3400 0.3 . 1 . . . . . 34 ILE C . 50479 1 160 . 1 . 1 34 34 ILE CA C 13 58.1200 0.3 . 1 . . . . . 34 ILE CA . 50479 1 161 . 1 . 1 34 34 ILE CB C 13 42.2300 0.3 . 1 . . . . . 34 ILE CB . 50479 1 162 . 1 . 1 34 34 ILE N N 15 111.5300 0.2 . 1 . . . . . 34 ILE N . 50479 1 163 . 1 . 1 35 35 THR H H 1 9.2560 0.04 . 1 . . . . . 35 THR HN . 50479 1 164 . 1 . 1 35 35 THR C C 13 173.6400 0.3 . 1 . . . . . 35 THR C . 50479 1 165 . 1 . 1 35 35 THR CA C 13 59.9500 0.3 . 1 . . . . . 35 THR CA . 50479 1 166 . 1 . 1 35 35 THR CB C 13 67.8400 0.3 . 1 . . . . . 35 THR CB . 50479 1 167 . 1 . 1 35 35 THR N N 15 116.6800 0.2 . 1 . . . . . 35 THR N . 50479 1 168 . 1 . 1 36 36 PRO C C 13 178.0300 0.3 . 1 . . . . . 36 PRO C . 50479 1 169 . 1 . 1 36 36 PRO CA C 13 65.4200 0.3 . 1 . . . . . 36 PRO CA . 50479 1 170 . 1 . 1 36 36 PRO CB C 13 30.7700 0.3 . 1 . . . . . 36 PRO CB . 50479 1 171 . 1 . 1 37 37 GLU H H 1 8.3430 0.04 . 1 . . . . . 37 GLU HN . 50479 1 172 . 1 . 1 37 37 GLU C C 13 180.2600 0.3 . 1 . . . . . 37 GLU C . 50479 1 173 . 1 . 1 37 37 GLU CA C 13 60.0500 0.3 . 1 . . . . . 37 GLU CA . 50479 1 174 . 1 . 1 37 37 GLU CB C 13 28.2200 0.3 . 1 . . . . . 37 GLU CB . 50479 1 175 . 1 . 1 37 37 GLU N N 15 115.7800 0.2 . 1 . . . . . 37 GLU N . 50479 1 176 . 1 . 1 38 38 GLU H H 1 7.6190 0.04 . 1 . . . . . 38 GLU HN . 50479 1 177 . 1 . 1 38 38 GLU C C 13 178.0300 0.3 . 1 . . . . . 38 GLU C . 50479 1 178 . 1 . 1 38 38 GLU CA C 13 58.4100 0.3 . 1 . . . . . 38 GLU CA . 50479 1 179 . 1 . 1 38 38 GLU CB C 13 28.4600 0.3 . 1 . . . . . 38 GLU CB . 50479 1 180 . 1 . 1 38 38 GLU N N 15 122.6600 0.2 . 1 . . . . . 38 GLU N . 50479 1 181 . 1 . 1 39 39 PHE H H 1 8.3540 0.04 . 1 . . . . . 39 PHE HN . 50479 1 182 . 1 . 1 39 39 PHE C C 13 176.8100 0.3 . 1 . . . . . 39 PHE C . 50479 1 183 . 1 . 1 39 39 PHE CA C 13 61.4600 0.3 . 1 . . . . . 39 PHE CA . 50479 1 184 . 1 . 1 39 39 PHE CB C 13 37.5400 0.3 . 1 . . . . . 39 PHE CB . 50479 1 185 . 1 . 1 39 39 PHE N N 15 120.9000 0.2 . 1 . . . . . 39 PHE N . 50479 1 186 . 1 . 1 40 40 VAL H H 1 7.9560 0.04 . 1 . . . . . 40 VAL HN . 50479 1 187 . 1 . 1 40 40 VAL C C 13 177.8500 0.3 . 1 . . . . . 40 VAL C . 50479 1 188 . 1 . 1 40 40 VAL CA C 13 65.6600 0.3 . 1 . . . . . 40 VAL CA . 50479 1 189 . 1 . 1 40 40 VAL CB C 13 31.0900 0.3 . 1 . . . . . 40 VAL CB . 50479 1 190 . 1 . 1 40 40 VAL N N 15 119.3500 0.2 . 1 . . . . . 40 VAL N . 50479 1 191 . 1 . 1 41 41 ALA H H 1 7.6350 0.04 . 1 . . . . . 41 ALA HN . 50479 1 192 . 1 . 1 41 41 ALA C C 13 181.2700 0.3 . 1 . . . . . 41 ALA C . 50479 1 193 . 1 . 1 41 41 ALA CA C 13 54.8600 0.3 . 1 . . . . . 41 ALA CA . 50479 1 194 . 1 . 1 41 41 ALA CB C 13 17.3100 0.3 . 1 . . . . . 41 ALA CB . 50479 1 195 . 1 . 1 41 41 ALA N N 15 122.0200 0.2 . 1 . . . . . 41 ALA N . 50479 1 196 . 1 . 1 42 42 ALA H H 1 8.7120 0.04 . 1 . . . . . 42 ALA HN . 50479 1 197 . 1 . 1 42 42 ALA C C 13 181.5400 0.3 . 1 . . . . . 42 ALA C . 50479 1 198 . 1 . 1 42 42 ALA CA C 13 53.2900 0.3 . 1 . . . . . 42 ALA CA . 50479 1 199 . 1 . 1 42 42 ALA CB C 13 17.5900 0.3 . 1 . . . . . 42 ALA CB . 50479 1 200 . 1 . 1 42 42 ALA N N 15 121.4100 0.2 . 1 . . . . . 42 ALA N . 50479 1 201 . 1 . 1 43 43 GLY H H 1 9.1050 0.04 . 1 . . . . . 43 GLY HN . 50479 1 202 . 1 . 1 43 43 GLY C C 13 174.2000 0.3 . 1 . . . . . 43 GLY C . 50479 1 203 . 1 . 1 43 43 GLY CA C 13 47.2500 0.3 . 1 . . . . . 43 GLY CA . 50479 1 204 . 1 . 1 43 43 GLY N N 15 113.4300 0.2 . 1 . . . . . 43 GLY N . 50479 1 205 . 1 . 1 44 44 ASP H H 1 9.3480 0.04 . 1 . . . . . 44 ASP HN . 50479 1 206 . 1 . 1 44 44 ASP C C 13 179.3000 0.3 . 1 . . . . . 44 ASP C . 50479 1 207 . 1 . 1 44 44 ASP CA C 13 57.1300 0.3 . 1 . . . . . 44 ASP CA . 50479 1 208 . 1 . 1 44 44 ASP CB C 13 39.2400 0.3 . 1 . . . . . 44 ASP CB . 50479 1 209 . 1 . 1 44 44 ASP N N 15 123.2100 0.2 . 1 . . . . . 44 ASP N . 50479 1 210 . 1 . 1 45 45 HIS H H 1 7.8220 0.04 . 1 . . . . . 45 HIS HN . 50479 1 211 . 1 . 1 45 45 HIS C C 13 177.3400 0.3 . 1 . . . . . 45 HIS C . 50479 1 212 . 1 . 1 45 45 HIS CA C 13 60.2900 0.3 . 1 . . . . . 45 HIS CA . 50479 1 213 . 1 . 1 45 45 HIS CB C 13 31.0400 0.3 . 1 . . . . . 45 HIS CB . 50479 1 214 . 1 . 1 45 45 HIS N N 15 120.8600 0.2 . 1 . . . . . 45 HIS N . 50479 1 215 . 1 . 1 46 46 LEU H H 1 7.6910 0.04 . 1 . . . . . 46 LEU HN . 50479 1 216 . 1 . 1 46 46 LEU C C 13 177.1300 0.3 . 1 . . . . . 46 LEU C . 50479 1 217 . 1 . 1 46 46 LEU CA C 13 58.7200 0.3 . 1 . . . . . 46 LEU CA . 50479 1 218 . 1 . 1 46 46 LEU CB C 13 41.1500 0.3 . 1 . . . . . 46 LEU CB . 50479 1 219 . 1 . 1 46 46 LEU N N 15 120.4900 0.2 . 1 . . . . . 46 LEU N . 50479 1 220 . 1 . 1 47 47 VAL H H 1 8.2480 0.04 . 1 . . . . . 47 VAL HN . 50479 1 221 . 1 . 1 47 47 VAL C C 13 178.1100 0.3 . 1 . . . . . 47 VAL C . 50479 1 222 . 1 . 1 47 47 VAL CA C 13 64.5300 0.3 . 1 . . . . . 47 VAL CA . 50479 1 223 . 1 . 1 47 47 VAL CB C 13 30.9000 0.3 . 1 . . . . . 47 VAL CB . 50479 1 224 . 1 . 1 47 47 VAL N N 15 115.7200 0.2 . 1 . . . . . 47 VAL N . 50479 1 225 . 1 . 1 48 48 HIS H H 1 7.6050 0.04 . 1 . . . . . 48 HIS HN . 50479 1 226 . 1 . 1 48 48 HIS C C 13 176.4600 0.3 . 1 . . . . . 48 HIS C . 50479 1 227 . 1 . 1 48 48 HIS CA C 13 57.8700 0.3 . 1 . . . . . 48 HIS CA . 50479 1 228 . 1 . 1 48 48 HIS CB C 13 28.7200 0.3 . 1 . . . . . 48 HIS CB . 50479 1 229 . 1 . 1 48 48 HIS N N 15 116.6800 0.2 . 1 . . . . . 48 HIS N . 50479 1 230 . 1 . 1 49 49 HIS H H 1 7.6510 0.04 . 1 . . . . . 49 HIS HN . 50479 1 231 . 1 . 1 49 49 HIS C C 13 175.9600 0.3 . 1 . . . . . 49 HIS C . 50479 1 232 . 1 . 1 49 49 HIS CA C 13 58.7200 0.3 . 1 . . . . . 49 HIS CA . 50479 1 233 . 1 . 1 49 49 HIS CB C 13 31.1200 0.3 . 1 . . . . . 49 HIS CB . 50479 1 234 . 1 . 1 49 49 HIS N N 15 115.7500 0.2 . 1 . . . . . 49 HIS N . 50479 1 235 . 1 . 1 50 50 CYS H H 1 8.8230 0.04 . 1 . . . . . 50 CYS HN . 50479 1 236 . 1 . 1 50 50 CYS C C 13 172.3400 0.3 . 1 . . . . . 50 CYS C . 50479 1 237 . 1 . 1 50 50 CYS CA C 13 55.8900 0.3 . 1 . . . . . 50 CYS CA . 50479 1 238 . 1 . 1 50 50 CYS CB C 13 29.2400 0.3 . 1 . . . . . 50 CYS CB . 50479 1 239 . 1 . 1 50 50 CYS N N 15 119.0300 0.2 . 1 . . . . . 50 CYS N . 50479 1 240 . 1 . 1 51 51 PRO C C 13 177.8000 0.3 . 1 . . . . . 51 PRO C . 50479 1 241 . 1 . 1 51 51 PRO CA C 13 64.5500 0.3 . 1 . . . . . 51 PRO CA . 50479 1 242 . 1 . 1 51 51 PRO CB C 13 30.9900 0.3 . 1 . . . . . 51 PRO CB . 50479 1 243 . 1 . 1 52 52 THR H H 1 7.4900 0.04 . 1 . . . . . 52 THR HN . 50479 1 244 . 1 . 1 52 52 THR C C 13 176.8900 0.3 . 1 . . . . . 52 THR C . 50479 1 245 . 1 . 1 52 52 THR CA C 13 63.4000 0.3 . 1 . . . . . 52 THR CA . 50479 1 246 . 1 . 1 52 52 THR CB C 13 67.8900 0.3 . 1 . . . . . 52 THR CB . 50479 1 247 . 1 . 1 52 52 THR N N 15 110.6100 0.2 . 1 . . . . . 52 THR N . 50479 1 248 . 1 . 1 53 53 TRP H H 1 8.8520 0.04 . 1 . . . . . 53 TRP HN . 50479 1 249 . 1 . 1 53 53 TRP C C 13 174.4700 0.3 . 1 . . . . . 53 TRP C . 50479 1 250 . 1 . 1 53 53 TRP CA C 13 56.6000 0.3 . 1 . . . . . 53 TRP CA . 50479 1 251 . 1 . 1 53 53 TRP CB C 13 29.6700 0.3 . 1 . . . . . 53 TRP CB . 50479 1 252 . 1 . 1 53 53 TRP N N 15 128.3900 0.2 . 1 . . . . . 53 TRP N . 50479 1 253 . 1 . 1 54 54 GLN H H 1 8.6770 0.04 . 1 . . . . . 54 GLN HN . 50479 1 254 . 1 . 1 54 54 GLN C C 13 175.5800 0.3 . 1 . . . . . 54 GLN C . 50479 1 255 . 1 . 1 54 54 GLN CA C 13 53.4900 0.3 . 1 . . . . . 54 GLN CA . 50479 1 256 . 1 . 1 54 54 GLN CB C 13 33.4800 0.3 . 1 . . . . . 54 GLN CB . 50479 1 257 . 1 . 1 54 54 GLN N N 15 115.3100 0.2 . 1 . . . . . 54 GLN N . 50479 1 258 . 1 . 1 55 55 TRP H H 1 8.4420 0.04 . 1 . . . . . 55 TRP HN . 50479 1 259 . 1 . 1 55 55 TRP C C 13 177.0800 0.3 . 1 . . . . . 55 TRP C . 50479 1 260 . 1 . 1 55 55 TRP CA C 13 57.3100 0.3 . 1 . . . . . 55 TRP CA . 50479 1 261 . 1 . 1 55 55 TRP CB C 13 31.7900 0.3 . 1 . . . . . 55 TRP CB . 50479 1 262 . 1 . 1 55 55 TRP N N 15 120.9100 0.2 . 1 . . . . . 55 TRP N . 50479 1 263 . 1 . 1 56 56 ALA H H 1 8.9240 0.04 . 1 . . . . . 56 ALA HN . 50479 1 264 . 1 . 1 56 56 ALA C C 13 175.4400 0.3 . 1 . . . . . 56 ALA C . 50479 1 265 . 1 . 1 56 56 ALA CA C 13 50.7400 0.3 . 1 . . . . . 56 ALA CA . 50479 1 266 . 1 . 1 56 56 ALA CB C 13 22.6100 0.3 . 1 . . . . . 56 ALA CB . 50479 1 267 . 1 . 1 56 56 ALA N N 15 124.1100 0.2 . 1 . . . . . 56 ALA N . 50479 1 268 . 1 . 1 57 57 THR H H 1 7.8420 0.04 . 1 . . . . . 57 THR HN . 50479 1 269 . 1 . 1 57 57 THR C C 13 174.5500 0.3 . 1 . . . . . 57 THR C . 50479 1 270 . 1 . 1 57 57 THR CA C 13 64.4100 0.3 . 1 . . . . . 57 THR CA . 50479 1 271 . 1 . 1 57 57 THR CB C 13 71.1700 0.3 . 1 . . . . . 57 THR CB . 50479 1 272 . 1 . 1 57 57 THR N N 15 115.2100 0.2 . 1 . . . . . 57 THR N . 50479 1 273 . 1 . 1 58 58 GLY H H 1 8.0250 0.04 . 1 . . . . . 58 GLY HN . 50479 1 274 . 1 . 1 58 58 GLY C C 13 173.3600 0.3 . 1 . . . . . 58 GLY C . 50479 1 275 . 1 . 1 58 58 GLY CA C 13 44.0400 0.3 . 1 . . . . . 58 GLY CA . 50479 1 276 . 1 . 1 58 58 GLY N N 15 107.7700 0.2 . 1 . . . . . 58 GLY N . 50479 1 277 . 1 . 1 59 59 GLU H H 1 8.5630 0.04 . 1 . . . . . 59 GLU HN . 50479 1 278 . 1 . 1 59 59 GLU C C 13 179.5900 0.3 . 1 . . . . . 59 GLU C . 50479 1 279 . 1 . 1 59 59 GLU CA C 13 56.8900 0.3 . 1 . . . . . 59 GLU CA . 50479 1 280 . 1 . 1 59 59 GLU CB C 13 29.5300 0.3 . 1 . . . . . 59 GLU CB . 50479 1 281 . 1 . 1 59 59 GLU N N 15 120.4300 0.2 . 1 . . . . . 59 GLU N . 50479 1 282 . 1 . 1 60 60 GLU H H 1 9.0620 0.04 . 1 . . . . . 60 GLU HN . 50479 1 283 . 1 . 1 60 60 GLU C C 13 178.9100 0.3 . 1 . . . . . 60 GLU C . 50479 1 284 . 1 . 1 60 60 GLU CA C 13 59.8300 0.3 . 1 . . . . . 60 GLU CA . 50479 1 285 . 1 . 1 60 60 GLU CB C 13 29.1700 0.3 . 1 . . . . . 60 GLU CB . 50479 1 286 . 1 . 1 60 60 GLU N N 15 128.4000 0.2 . 1 . . . . . 60 GLU N . 50479 1 287 . 1 . 1 61 61 LEU H H 1 8.4850 0.04 . 1 . . . . . 61 LEU HN . 50479 1 288 . 1 . 1 61 61 LEU C C 13 177.9200 0.3 . 1 . . . . . 61 LEU C . 50479 1 289 . 1 . 1 61 61 LEU CA C 13 56.0100 0.3 . 1 . . . . . 61 LEU CA . 50479 1 290 . 1 . 1 61 61 LEU CB C 13 40.5900 0.3 . 1 . . . . . 61 LEU CB . 50479 1 291 . 1 . 1 61 61 LEU N N 15 116.6900 0.2 . 1 . . . . . 61 LEU N . 50479 1 292 . 1 . 1 62 62 LYS H H 1 7.5210 0.04 . 1 . . . . . 62 LYS HN . 50479 1 293 . 1 . 1 62 62 LYS C C 13 174.8400 0.3 . 1 . . . . . 62 LYS C . 50479 1 294 . 1 . 1 62 62 LYS CA C 13 55.2500 0.3 . 1 . . . . . 62 LYS CA . 50479 1 295 . 1 . 1 62 62 LYS CB C 13 32.0300 0.3 . 1 . . . . . 62 LYS CB . 50479 1 296 . 1 . 1 62 62 LYS N N 15 117.6200 0.2 . 1 . . . . . 62 LYS N . 50479 1 297 . 1 . 1 63 63 VAL H H 1 6.7970 0.04 . 1 . . . . . 63 VAL HN . 50479 1 298 . 1 . 1 63 63 VAL C C 13 177.4200 0.3 . 1 . . . . . 63 VAL C . 50479 1 299 . 1 . 1 63 63 VAL CA C 13 63.1800 0.3 . 1 . . . . . 63 VAL CA . 50479 1 300 . 1 . 1 63 63 VAL CB C 13 32.1400 0.3 . 1 . . . . . 63 VAL CB . 50479 1 301 . 1 . 1 63 63 VAL N N 15 120.9000 0.2 . 1 . . . . . 63 VAL N . 50479 1 302 . 1 . 1 64 64 LYS H H 1 10.0300 0.04 . 1 . . . . . 64 LYS HN . 50479 1 303 . 1 . 1 64 64 LYS C C 13 177.9400 0.3 . 1 . . . . . 64 LYS C . 50479 1 304 . 1 . 1 64 64 LYS CA C 13 52.6100 0.3 . 1 . . . . . 64 LYS CA . 50479 1 305 . 1 . 1 64 64 LYS CB C 13 31.8300 0.3 . 1 . . . . . 64 LYS CB . 50479 1 306 . 1 . 1 64 64 LYS N N 15 128.8700 0.2 . 1 . . . . . 64 LYS N . 50479 1 307 . 1 . 1 65 65 ALA H H 1 8.6540 0.04 . 1 . . . . . 65 ALA HN . 50479 1 308 . 1 . 1 65 65 ALA C C 13 177.0500 0.3 . 1 . . . . . 65 ALA C . 50479 1 309 . 1 . 1 65 65 ALA CA C 13 53.5900 0.3 . 1 . . . . . 65 ALA CA . 50479 1 310 . 1 . 1 65 65 ALA CB C 13 18.0100 0.3 . 1 . . . . . 65 ALA CB . 50479 1 311 . 1 . 1 65 65 ALA N N 15 124.6100 0.2 . 1 . . . . . 65 ALA N . 50479 1 312 . 1 . 1 66 66 TYR H H 1 6.1710 0.04 . 1 . . . . . 66 TYR HN . 50479 1 313 . 1 . 1 66 66 TYR C C 13 174.0600 0.3 . 1 . . . . . 66 TYR C . 50479 1 314 . 1 . 1 66 66 TYR CA C 13 54.9100 0.3 . 1 . . . . . 66 TYR CA . 50479 1 315 . 1 . 1 66 66 TYR CB C 13 35.9700 0.3 . 1 . . . . . 66 TYR CB . 50479 1 316 . 1 . 1 66 66 TYR N N 15 109.1100 0.2 . 1 . . . . . 66 TYR N . 50479 1 317 . 1 . 1 67 67 LEU H H 1 7.2180 0.04 . 1 . . . . . 67 LEU HN . 50479 1 318 . 1 . 1 67 67 LEU C C 13 172.6900 0.3 . 1 . . . . . 67 LEU C . 50479 1 319 . 1 . 1 67 67 LEU CA C 13 51.7500 0.3 . 1 . . . . . 67 LEU CA . 50479 1 320 . 1 . 1 67 67 LEU CB C 13 42.6000 0.3 . 1 . . . . . 67 LEU CB . 50479 1 321 . 1 . 1 67 67 LEU N N 15 124.7300 0.2 . 1 . . . . . 67 LEU N . 50479 1 322 . 1 . 1 68 68 PRO C C 13 179.8400 0.3 . 1 . . . . . 68 PRO C . 50479 1 323 . 1 . 1 68 68 PRO CA C 13 61.4900 0.3 . 1 . . . . . 68 PRO CA . 50479 1 324 . 1 . 1 68 68 PRO CB C 13 30.1900 0.3 . 1 . . . . . 68 PRO CB . 50479 1 325 . 1 . 1 69 69 THR H H 1 8.7700 0.04 . 1 . . . . . 69 THR HN . 50479 1 326 . 1 . 1 69 69 THR C C 13 175.2500 0.3 . 1 . . . . . 69 THR C . 50479 1 327 . 1 . 1 69 69 THR CA C 13 66.7400 0.3 . 1 . . . . . 69 THR CA . 50479 1 328 . 1 . 1 69 69 THR CB C 13 68.2700 0.3 . 1 . . . . . 69 THR CB . 50479 1 329 . 1 . 1 69 69 THR N N 15 123.7700 0.2 . 1 . . . . . 69 THR N . 50479 1 330 . 1 . 1 70 70 GLY H H 1 8.3070 0.04 . 1 . . . . . 70 GLY HN . 50479 1 331 . 1 . 1 70 70 GLY C C 13 172.9500 0.3 . 1 . . . . . 70 GLY C . 50479 1 332 . 1 . 1 70 70 GLY CA C 13 44.2500 0.3 . 1 . . . . . 70 GLY CA . 50479 1 333 . 1 . 1 70 70 GLY N N 15 104.9800 0.2 . 1 . . . . . 70 GLY N . 50479 1 334 . 1 . 1 71 71 LYS H H 1 7.1840 0.04 . 1 . . . . . 71 LYS HN . 50479 1 335 . 1 . 1 71 71 LYS C C 13 171.0400 0.3 . 1 . . . . . 71 LYS C . 50479 1 336 . 1 . 1 71 71 LYS CA C 13 54.3400 0.3 . 1 . . . . . 71 LYS CA . 50479 1 337 . 1 . 1 71 71 LYS CB C 13 31.7500 0.3 . 1 . . . . . 71 LYS CB . 50479 1 338 . 1 . 1 71 71 LYS N N 15 121.7300 0.2 . 1 . . . . . 71 LYS N . 50479 1 339 . 1 . 1 72 72 GLN H H 1 6.6820 0.04 . 1 . . . . . 72 GLN HN . 50479 1 340 . 1 . 1 72 72 GLN C C 13 175.7400 0.3 . 1 . . . . . 72 GLN C . 50479 1 341 . 1 . 1 72 72 GLN CA C 13 56.3600 0.3 . 1 . . . . . 72 GLN CA . 50479 1 342 . 1 . 1 72 72 GLN CB C 13 29.1300 0.3 . 1 . . . . . 72 GLN CB . 50479 1 343 . 1 . 1 72 72 GLN N N 15 114.1700 0.2 . 1 . . . . . 72 GLN N . 50479 1 344 . 1 . 1 73 73 PHE H H 1 7.6570 0.04 . 1 . . . . . 73 PHE HN . 50479 1 345 . 1 . 1 73 73 PHE C C 13 171.4500 0.3 . 1 . . . . . 73 PHE C . 50479 1 346 . 1 . 1 73 73 PHE CA C 13 55.6400 0.3 . 1 . . . . . 73 PHE CA . 50479 1 347 . 1 . 1 73 73 PHE CB C 13 40.2100 0.3 . 1 . . . . . 73 PHE CB . 50479 1 348 . 1 . 1 73 73 PHE N N 15 108.7200 0.2 . 1 . . . . . 73 PHE N . 50479 1 349 . 1 . 1 74 74 LEU H H 1 9.0090 0.04 . 1 . . . . . 74 LEU HN . 50479 1 350 . 1 . 1 74 74 LEU C C 13 176.9900 0.3 . 1 . . . . . 74 LEU C . 50479 1 351 . 1 . 1 74 74 LEU CA C 13 53.4900 0.3 . 1 . . . . . 74 LEU CA . 50479 1 352 . 1 . 1 74 74 LEU CB C 13 45.0900 0.3 . 1 . . . . . 74 LEU CB . 50479 1 353 . 1 . 1 74 74 LEU N N 15 121.3300 0.2 . 1 . . . . . 74 LEU N . 50479 1 354 . 1 . 1 75 75 VAL H H 1 9.4740 0.04 . 1 . . . . . 75 VAL HN . 50479 1 355 . 1 . 1 75 75 VAL C C 13 173.0700 0.3 . 1 . . . . . 75 VAL C . 50479 1 356 . 1 . 1 75 75 VAL CA C 13 58.5400 0.3 . 1 . . . . . 75 VAL CA . 50479 1 357 . 1 . 1 75 75 VAL CB C 13 35.1900 0.3 . 1 . . . . . 75 VAL CB . 50479 1 358 . 1 . 1 75 75 VAL N N 15 120.4100 0.2 . 1 . . . . . 75 VAL N . 50479 1 359 . 1 . 1 76 76 THR H H 1 8.4120 0.04 . 1 . . . . . 76 THR HN . 50479 1 360 . 1 . 1 76 76 THR C C 13 171.4000 0.3 . 1 . . . . . 76 THR C . 50479 1 361 . 1 . 1 76 76 THR CA C 13 59.7700 0.3 . 1 . . . . . 76 THR CA . 50479 1 362 . 1 . 1 76 76 THR CB C 13 70.2300 0.3 . 1 . . . . . 76 THR CB . 50479 1 363 . 1 . 1 76 76 THR N N 15 124.6500 0.2 . 1 . . . . . 76 THR N . 50479 1 364 . 1 . 1 77 77 LYS H H 1 7.9250 0.04 . 1 . . . . . 77 LYS HN . 50479 1 365 . 1 . 1 77 77 LYS C C 13 176.6700 0.3 . 1 . . . . . 77 LYS C . 50479 1 366 . 1 . 1 77 77 LYS CA C 13 54.5000 0.3 . 1 . . . . . 77 LYS CA . 50479 1 367 . 1 . 1 77 77 LYS CB C 13 34.9500 0.3 . 1 . . . . . 77 LYS CB . 50479 1 368 . 1 . 1 77 77 LYS N N 15 124.6700 0.2 . 1 . . . . . 77 LYS N . 50479 1 369 . 1 . 1 78 78 ASN H H 1 8.4910 0.04 . 1 . . . . . 78 ASN HN . 50479 1 370 . 1 . 1 78 78 ASN C C 13 174.9500 0.3 . 1 . . . . . 78 ASN C . 50479 1 371 . 1 . 1 78 78 ASN CA C 13 54.3000 0.3 . 1 . . . . . 78 ASN CA . 50479 1 372 . 1 . 1 78 78 ASN CB C 13 36.8900 0.3 . 1 . . . . . 78 ASN CB . 50479 1 373 . 1 . 1 78 78 ASN N N 15 117.6900 0.2 . 1 . . . . . 78 ASN N . 50479 1 374 . 1 . 1 79 79 VAL H H 1 9.5750 0.04 . 1 . . . . . 79 VAL HN . 50479 1 375 . 1 . 1 79 79 VAL CA C 13 59.9400 0.3 . 1 . . . . . 79 VAL CA . 50479 1 376 . 1 . 1 79 79 VAL CB C 13 30.9700 0.3 . 1 . . . . . 79 VAL CB . 50479 1 377 . 1 . 1 79 79 VAL N N 15 122.8100 0.2 . 1 . . . . . 79 VAL N . 50479 1 378 . 1 . 1 80 80 PRO C C 13 175.2700 0.3 . 1 . . . . . 80 PRO C . 50479 1 379 . 1 . 1 80 80 PRO CA C 13 62.9900 0.3 . 1 . . . . . 80 PRO CA . 50479 1 380 . 1 . 1 80 80 PRO CB C 13 32.2400 0.3 . 1 . . . . . 80 PRO CB . 50479 1 381 . 1 . 1 81 81 CYS H H 1 7.9380 0.04 . 1 . . . . . 81 CYS HN . 50479 1 382 . 1 . 1 81 81 CYS C C 13 174.8300 0.3 . 1 . . . . . 81 CYS C . 50479 1 383 . 1 . 1 81 81 CYS CA C 13 57.2000 0.3 . 1 . . . . . 81 CYS CA . 50479 1 384 . 1 . 1 81 81 CYS CB C 13 27.3900 0.3 . 1 . . . . . 81 CYS CB . 50479 1 385 . 1 . 1 81 81 CYS N N 15 120.9400 0.2 . 1 . . . . . 81 CYS N . 50479 1 386 . 1 . 1 82 82 TYR H H 1 9.3470 0.04 . 1 . . . . . 82 TYR HN . 50479 1 387 . 1 . 1 82 82 TYR C C 13 174.8000 0.3 . 1 . . . . . 82 TYR C . 50479 1 388 . 1 . 1 82 82 TYR CA C 13 60.2600 0.3 . 1 . . . . . 82 TYR CA . 50479 1 389 . 1 . 1 82 82 TYR CB C 13 38.8400 0.3 . 1 . . . . . 82 TYR CB . 50479 1 390 . 1 . 1 82 82 TYR N N 15 127.9300 0.2 . 1 . . . . . 82 TYR N . 50479 1 391 . 1 . 1 83 83 LYS H H 1 7.3690 0.04 . 1 . . . . . 83 LYS HN . 50479 1 392 . 1 . 1 83 83 LYS C C 13 174.3200 0.3 . 1 . . . . . 83 LYS C . 50479 1 393 . 1 . 1 83 83 LYS CA C 13 53.7300 0.3 . 1 . . . . . 83 LYS CA . 50479 1 394 . 1 . 1 83 83 LYS CB C 13 35.1900 0.3 . 1 . . . . . 83 LYS CB . 50479 1 395 . 1 . 1 83 83 LYS N N 15 115.2600 0.2 . 1 . . . . . 83 LYS N . 50479 1 396 . 1 . 1 84 84 ARG H H 1 8.3330 0.04 . 1 . . . . . 84 ARG HN . 50479 1 397 . 1 . 1 84 84 ARG C C 13 177.7000 0.3 . 1 . . . . . 84 ARG C . 50479 1 398 . 1 . 1 84 84 ARG CA C 13 53.4700 0.3 . 1 . . . . . 84 ARG CA . 50479 1 399 . 1 . 1 84 84 ARG CB C 13 31.9900 0.3 . 1 . . . . . 84 ARG CB . 50479 1 400 . 1 . 1 84 84 ARG N N 15 119.0200 0.2 . 1 . . . . . 84 ARG N . 50479 1 401 . 1 . 1 85 85 CYS H H 1 8.2880 0.04 . 1 . . . . . 85 CYS HN . 50479 1 402 . 1 . 1 85 85 CYS C C 13 175.7300 0.3 . 1 . . . . . 85 CYS C . 50479 1 403 . 1 . 1 85 85 CYS CA C 13 61.5100 0.3 . 1 . . . . . 85 CYS CA . 50479 1 404 . 1 . 1 85 85 CYS CB C 13 26.3300 0.3 . 1 . . . . . 85 CYS CB . 50479 1 405 . 1 . 1 85 85 CYS N N 15 119.4400 0.2 . 1 . . . . . 85 CYS N . 50479 1 406 . 1 . 1 86 86 LYS H H 1 8.0150 0.04 . 1 . . . . . 86 LYS HN . 50479 1 407 . 1 . 1 86 86 LYS C C 13 175.4700 0.3 . 1 . . . . . 86 LYS C . 50479 1 408 . 1 . 1 86 86 LYS CA C 13 55.9700 0.3 . 1 . . . . . 86 LYS CA . 50479 1 409 . 1 . 1 86 86 LYS CB C 13 32.2900 0.3 . 1 . . . . . 86 LYS CB . 50479 1 410 . 1 . 1 86 86 LYS N N 15 119.7500 0.2 . 1 . . . . . 86 LYS N . 50479 1 411 . 1 . 1 87 87 GLN H H 1 8.1130 0.04 . 1 . . . . . 87 GLN HN . 50479 1 412 . 1 . 1 87 87 GLN C C 13 175.9400 0.3 . 1 . . . . . 87 GLN C . 50479 1 413 . 1 . 1 87 87 GLN CA C 13 55.8500 0.3 . 1 . . . . . 87 GLN CA . 50479 1 414 . 1 . 1 87 87 GLN CB C 13 28.4500 0.3 . 1 . . . . . 87 GLN CB . 50479 1 415 . 1 . 1 87 87 GLN N N 15 122.7900 0.2 . 1 . . . . . 87 GLN N . 50479 1 416 . 1 . 1 88 88 MET H H 1 8.4190 0.04 . 1 . . . . . 88 MET HN . 50479 1 417 . 1 . 1 88 88 MET C C 13 176.4500 0.3 . 1 . . . . . 88 MET C . 50479 1 418 . 1 . 1 88 88 MET CA C 13 55.1100 0.3 . 1 . . . . . 88 MET CA . 50479 1 419 . 1 . 1 88 88 MET CB C 13 32.7900 0.3 . 1 . . . . . 88 MET CB . 50479 1 420 . 1 . 1 88 88 MET N N 15 124.1500 0.2 . 1 . . . . . 88 MET N . 50479 1 421 . 1 . 1 89 89 GLU H H 1 8.5080 0.04 . 1 . . . . . 89 GLU HN . 50479 1 422 . 1 . 1 89 89 GLU C C 13 176.9900 0.3 . 1 . . . . . 89 GLU C . 50479 1 423 . 1 . 1 89 89 GLU CA C 13 56.6000 0.3 . 1 . . . . . 89 GLU CA . 50479 1 424 . 1 . 1 89 89 GLU CB C 13 29.1600 0.3 . 1 . . . . . 89 GLU CB . 50479 1 425 . 1 . 1 89 89 GLU N N 15 120.9300 0.2 . 1 . . . . . 89 GLU N . 50479 1 426 . 1 . 1 90 90 GLU H H 1 8.4160 0.04 . 1 . . . . . 90 GLU HN . 50479 1 427 . 1 . 1 90 90 GLU C C 13 176.4000 0.3 . 1 . . . . . 90 GLU C . 50479 1 428 . 1 . 1 90 90 GLU CA C 13 56.9100 0.3 . 1 . . . . . 90 GLU CA . 50479 1 429 . 1 . 1 90 90 GLU CB C 13 29.1600 0.3 . 1 . . . . . 90 GLU CB . 50479 1 430 . 1 . 1 90 90 GLU N N 15 120.9100 0.2 . 1 . . . . . 90 GLU N . 50479 1 431 . 1 . 1 91 91 ASP H H 1 8.1800 0.04 . 1 . . . . . 91 ASP HN . 50479 1 432 . 1 . 1 91 91 ASP C C 13 175.7300 0.3 . 1 . . . . . 91 ASP C . 50479 1 433 . 1 . 1 91 91 ASP CA C 13 53.9200 0.3 . 1 . . . . . 91 ASP CA . 50479 1 434 . 1 . 1 91 91 ASP CB C 13 40.0300 0.3 . 1 . . . . . 91 ASP CB . 50479 1 435 . 1 . 1 91 91 ASP N N 15 119.9300 0.2 . 1 . . . . . 91 ASP N . 50479 1 436 . 1 . 1 92 92 ALA H H 1 7.6960 0.04 . 1 . . . . . 92 ALA HN . 50479 1 437 . 1 . 1 92 92 ALA C C 13 177.4300 0.3 . 1 . . . . . 92 ALA C . 50479 1 438 . 1 . 1 92 92 ALA CA C 13 52.0600 0.3 . 1 . . . . . 92 ALA CA . 50479 1 439 . 1 . 1 92 92 ALA CB C 13 19.0700 0.3 . 1 . . . . . 92 ALA CB . 50479 1 440 . 1 . 1 92 92 ALA N N 15 123.7200 0.2 . 1 . . . . . 92 ALA N . 50479 1 441 . 1 . 1 93 93 ILE H H 1 8.0380 0.04 . 1 . . . . . 93 ILE HN . 50479 1 442 . 1 . 1 93 93 ILE C C 13 176.0000 0.3 . 1 . . . . . 93 ILE C . 50479 1 443 . 1 . 1 93 93 ILE CA C 13 60.7400 0.3 . 1 . . . . . 93 ILE CA . 50479 1 444 . 1 . 1 93 93 ILE CB C 13 37.5100 0.3 . 1 . . . . . 93 ILE CB . 50479 1 445 . 1 . 1 93 93 ILE N N 15 120.9300 0.2 . 1 . . . . . 93 ILE N . 50479 1 446 . 1 . 1 94 94 LEU H H 1 8.4290 0.04 . 1 . . . . . 94 LEU HN . 50479 1 447 . 1 . 1 94 94 LEU C C 13 176.9600 0.3 . 1 . . . . . 94 LEU C . 50479 1 448 . 1 . 1 94 94 LEU CA C 13 54.5600 0.3 . 1 . . . . . 94 LEU CA . 50479 1 449 . 1 . 1 94 94 LEU CB C 13 41.0100 0.3 . 1 . . . . . 94 LEU CB . 50479 1 450 . 1 . 1 94 94 LEU N N 15 128.3900 0.2 . 1 . . . . . 94 LEU N . 50479 1 451 . 1 . 1 95 95 GLN H H 1 8.2940 0.04 . 1 . . . . . 95 GLN HN . 50479 1 452 . 1 . 1 95 95 GLN C C 13 175.4400 0.3 . 1 . . . . . 95 GLN C . 50479 1 453 . 1 . 1 95 95 GLN CA C 13 54.8500 0.3 . 1 . . . . . 95 GLN CA . 50479 1 454 . 1 . 1 95 95 GLN CB C 13 30.4800 0.3 . 1 . . . . . 95 GLN CB . 50479 1 455 . 1 . 1 95 95 GLN N N 15 123.0400 0.2 . 1 . . . . . 95 GLN N . 50479 1 456 . 1 . 1 96 96 THR H H 1 9.0220 0.04 . 1 . . . . . 96 THR HN . 50479 1 457 . 1 . 1 96 96 THR C C 13 173.9100 0.3 . 1 . . . . . 96 THR C . 50479 1 458 . 1 . 1 96 96 THR CA C 13 63.6700 0.3 . 1 . . . . . 96 THR CA . 50479 1 459 . 1 . 1 96 96 THR CB C 13 68.8100 0.3 . 1 . . . . . 96 THR CB . 50479 1 460 . 1 . 1 96 96 THR N N 15 124.2500 0.2 . 1 . . . . . 96 THR N . 50479 1 461 . 1 . 1 97 97 ARG H H 1 8.4670 0.04 . 1 . . . . . 97 ARG HN . 50479 1 462 . 1 . 1 97 97 ARG C C 13 175.0600 0.3 . 1 . . . . . 97 ARG C . 50479 1 463 . 1 . 1 97 97 ARG CA C 13 53.8400 0.3 . 1 . . . . . 97 ARG CA . 50479 1 464 . 1 . 1 97 97 ARG CB C 13 34.1000 0.3 . 1 . . . . . 97 ARG CB . 50479 1 465 . 1 . 1 97 97 ARG N N 15 127.4900 0.2 . 1 . . . . . 97 ARG N . 50479 1 466 . 1 . 1 98 98 THR H H 1 8.0170 0.04 . 1 . . . . . 98 THR HN . 50479 1 467 . 1 . 1 98 98 THR C C 13 172.8300 0.3 . 1 . . . . . 98 THR C . 50479 1 468 . 1 . 1 98 98 THR CA C 13 59.0700 0.3 . 1 . . . . . 98 THR CA . 50479 1 469 . 1 . 1 98 98 THR CB C 13 72.3700 0.3 . 1 . . . . . 98 THR CB . 50479 1 470 . 1 . 1 98 98 THR N N 15 109.2500 0.2 . 1 . . . . . 98 THR N . 50479 1 471 . 1 . 1 99 99 TYR H H 1 9.4530 0.04 . 1 . . . . . 99 TYR HN . 50479 1 472 . 1 . 1 99 99 TYR C C 13 175.1200 0.3 . 1 . . . . . 99 TYR C . 50479 1 473 . 1 . 1 99 99 TYR CA C 13 57.3600 0.3 . 1 . . . . . 99 TYR CA . 50479 1 474 . 1 . 1 99 99 TYR CB C 13 43.0700 0.3 . 1 . . . . . 99 TYR CB . 50479 1 475 . 1 . 1 99 99 TYR N N 15 119.5100 0.2 . 1 . . . . . 99 TYR N . 50479 1 476 . 1 . 1 100 100 ASP H H 1 9.4360 0.04 . 1 . . . . . 100 ASP HN . 50479 1 477 . 1 . 1 100 100 ASP C C 13 174.8500 0.3 . 1 . . . . . 100 ASP C . 50479 1 478 . 1 . 1 100 100 ASP CA C 13 52.6300 0.3 . 1 . . . . . 100 ASP CA . 50479 1 479 . 1 . 1 100 100 ASP CB C 13 40.9500 0.3 . 1 . . . . . 100 ASP CB . 50479 1 480 . 1 . 1 100 100 ASP N N 15 121.8400 0.2 . 1 . . . . . 100 ASP N . 50479 1 481 . 1 . 1 101 101 LEU H H 1 8.4820 0.04 . 1 . . . . . 101 LEU HN . 50479 1 482 . 1 . 1 101 101 LEU C C 13 175.2300 0.3 . 1 . . . . . 101 LEU C . 50479 1 483 . 1 . 1 101 101 LEU CA C 13 52.9400 0.3 . 1 . . . . . 101 LEU CA . 50479 1 484 . 1 . 1 101 101 LEU CB C 13 44.6400 0.3 . 1 . . . . . 101 LEU CB . 50479 1 485 . 1 . 1 101 101 LEU N N 15 120.6000 0.2 . 1 . . . . . 101 LEU N . 50479 1 486 . 1 . 1 102 102 TYR H H 1 9.2070 0.04 . 1 . . . . . 102 TYR HN . 50479 1 487 . 1 . 1 102 102 TYR C C 13 176.4200 0.3 . 1 . . . . . 102 TYR C . 50479 1 488 . 1 . 1 102 102 TYR CA C 13 54.9200 0.3 . 1 . . . . . 102 TYR CA . 50479 1 489 . 1 . 1 102 102 TYR CB C 13 42.1100 0.3 . 1 . . . . . 102 TYR CB . 50479 1 490 . 1 . 1 102 102 TYR N N 15 114.7800 0.2 . 1 . . . . . 102 TYR N . 50479 1 491 . 1 . 1 103 103 ILE H H 1 9.4950 0.04 . 1 . . . . . 103 ILE HN . 50479 1 492 . 1 . 1 103 103 ILE CA C 13 60.3200 0.3 . 1 . . . . . 103 ILE CA . 50479 1 493 . 1 . 1 103 103 ILE CB C 13 40.1700 0.3 . 1 . . . . . 103 ILE CB . 50479 1 494 . 1 . 1 103 103 ILE N N 15 120.9200 0.2 . 1 . . . . . 103 ILE N . 50479 1 495 . 1 . 1 104 104 THR C C 13 172.0500 0.3 . 1 . . . . . 104 THR C . 50479 1 496 . 1 . 1 104 104 THR CA C 13 59.0400 0.3 . 1 . . . . . 104 THR CA . 50479 1 497 . 1 . 1 104 104 THR CB C 13 70.0100 0.3 . 1 . . . . . 104 THR CB . 50479 1 498 . 1 . 1 105 105 TYR H H 1 8.8770 0.04 . 1 . . . . . 105 TYR HN . 50479 1 499 . 1 . 1 105 105 TYR C C 13 174.7800 0.3 . 1 . . . . . 105 TYR C . 50479 1 500 . 1 . 1 105 105 TYR CA C 13 56.9100 0.3 . 1 . . . . . 105 TYR CA . 50479 1 501 . 1 . 1 105 105 TYR CB C 13 38.0200 0.3 . 1 . . . . . 105 TYR CB . 50479 1 502 . 1 . 1 105 105 TYR N N 15 119.4900 0.2 . 1 . . . . . 105 TYR N . 50479 1 503 . 1 . 1 106 106 ASP H H 1 8.0880 0.04 . 1 . . . . . 106 ASP HN . 50479 1 504 . 1 . 1 106 106 ASP C C 13 174.9900 0.3 . 1 . . . . . 106 ASP C . 50479 1 505 . 1 . 1 106 106 ASP CA C 13 52.4800 0.3 . 1 . . . . . 106 ASP CA . 50479 1 506 . 1 . 1 106 106 ASP CB C 13 42.3000 0.3 . 1 . . . . . 106 ASP CB . 50479 1 507 . 1 . 1 106 106 ASP N N 15 132.1000 0.2 . 1 . . . . . 106 ASP N . 50479 1 508 . 1 . 1 107 107 LYS H H 1 8.3830 0.04 . 1 . . . . . 107 LYS HN . 50479 1 509 . 1 . 1 107 107 LYS C C 13 176.3900 0.3 . 1 . . . . . 107 LYS C . 50479 1 510 . 1 . 1 107 107 LYS CA C 13 57.5200 0.3 . 1 . . . . . 107 LYS CA . 50479 1 511 . 1 . 1 107 107 LYS CB C 13 32.0600 0.3 . 1 . . . . . 107 LYS CB . 50479 1 512 . 1 . 1 107 107 LYS N N 15 126.5500 0.2 . 1 . . . . . 107 LYS N . 50479 1 513 . 1 . 1 108 108 TYR H H 1 8.0110 0.04 . 1 . . . . . 108 TYR HN . 50479 1 514 . 1 . 1 108 108 TYR C C 13 177.5300 0.3 . 1 . . . . . 108 TYR C . 50479 1 515 . 1 . 1 108 108 TYR CA C 13 60.5900 0.3 . 1 . . . . . 108 TYR CA . 50479 1 516 . 1 . 1 108 108 TYR CB C 13 37.2900 0.3 . 1 . . . . . 108 TYR CB . 50479 1 517 . 1 . 1 108 108 TYR N N 15 119.5300 0.2 . 1 . . . . . 108 TYR N . 50479 1 518 . 1 . 1 109 109 TYR H H 1 7.8120 0.04 . 1 . . . . . 109 TYR HN . 50479 1 519 . 1 . 1 109 109 TYR C C 13 175.1400 0.3 . 1 . . . . . 109 TYR C . 50479 1 520 . 1 . 1 109 109 TYR CA C 13 59.4900 0.3 . 1 . . . . . 109 TYR CA . 50479 1 521 . 1 . 1 109 109 TYR CB C 13 38.2900 0.3 . 1 . . . . . 109 TYR CB . 50479 1 522 . 1 . 1 109 109 TYR N N 15 116.2200 0.2 . 1 . . . . . 109 TYR N . 50479 1 523 . 1 . 1 110 110 GLN H H 1 8.0750 0.04 . 1 . . . . . 110 GLN HN . 50479 1 524 . 1 . 1 110 110 GLN C C 13 173.3700 0.3 . 1 . . . . . 110 GLN C . 50479 1 525 . 1 . 1 110 110 GLN CA C 13 56.8700 0.3 . 1 . . . . . 110 GLN CA . 50479 1 526 . 1 . 1 110 110 GLN CB C 13 26.2700 0.3 . 1 . . . . . 110 GLN CB . 50479 1 527 . 1 . 1 110 110 GLN N N 15 116.6200 0.2 . 1 . . . . . 110 GLN N . 50479 1 528 . 1 . 1 111 111 THR H H 1 7.0000 0.04 . 1 . . . . . 111 THR HN . 50479 1 529 . 1 . 1 111 111 THR C C 13 171.4900 0.3 . 1 . . . . . 111 THR C . 50479 1 530 . 1 . 1 111 111 THR CA C 13 57.8100 0.3 . 1 . . . . . 111 THR CA . 50479 1 531 . 1 . 1 111 111 THR CB C 13 70.6400 0.3 . 1 . . . . . 111 THR CB . 50479 1 532 . 1 . 1 111 111 THR N N 15 104.8700 0.2 . 1 . . . . . 111 THR N . 50479 1 533 . 1 . 1 114 114 LEU C C 13 174.7900 0.3 . 1 . . . . . 114 LEU C . 50479 1 534 . 1 . 1 114 114 LEU CA C 13 53.2600 0.3 . 1 . . . . . 114 LEU CA . 50479 1 535 . 1 . 1 115 115 TRP H H 1 9.4850 0.04 . 1 . . . . . 115 TRP HN . 50479 1 536 . 1 . 1 115 115 TRP C C 13 175.2900 0.3 . 1 . . . . . 115 TRP C . 50479 1 537 . 1 . 1 115 115 TRP CA C 13 54.5800 0.3 . 1 . . . . . 115 TRP CA . 50479 1 538 . 1 . 1 115 115 TRP CB C 13 31.9900 0.3 . 1 . . . . . 115 TRP CB . 50479 1 539 . 1 . 1 115 115 TRP N N 15 126.9700 0.2 . 1 . . . . . 115 TRP N . 50479 1 540 . 1 . 1 116 116 LEU H H 1 9.4600 0.04 . 1 . . . . . 116 LEU HN . 50479 1 541 . 1 . 1 116 116 LEU C C 13 175.6700 0.3 . 1 . . . . . 116 LEU C . 50479 1 542 . 1 . 1 116 116 LEU CA C 13 54.4200 0.3 . 1 . . . . . 116 LEU CA . 50479 1 543 . 1 . 1 116 116 LEU CB C 13 45.6600 0.3 . 1 . . . . . 116 LEU CB . 50479 1 544 . 1 . 1 116 116 LEU N N 15 119.9700 0.2 . 1 . . . . . 116 LEU N . 50479 1 545 . 1 . 1 117 117 PHE H H 1 8.9360 0.04 . 1 . . . . . 117 PHE HN . 50479 1 546 . 1 . 1 117 117 PHE C C 13 173.6600 0.3 . 1 . . . . . 117 PHE C . 50479 1 547 . 1 . 1 117 117 PHE CA C 13 59.1700 0.3 . 1 . . . . . 117 PHE CA . 50479 1 548 . 1 . 1 117 117 PHE CB C 13 42.7400 0.3 . 1 . . . . . 117 PHE CB . 50479 1 549 . 1 . 1 117 117 PHE N N 15 122.7800 0.2 . 1 . . . . . 117 PHE N . 50479 1 550 . 1 . 1 118 118 GLY H H 1 6.7970 0.04 . 1 . . . . . 118 GLY HN . 50479 1 551 . 1 . 1 118 118 GLY C C 13 170.9600 0.3 . 1 . . . . . 118 GLY C . 50479 1 552 . 1 . 1 118 118 GLY CA C 13 44.5100 0.3 . 1 . . . . . 118 GLY CA . 50479 1 553 . 1 . 1 118 118 GLY N N 15 114.9600 0.2 . 1 . . . . . 118 GLY N . 50479 1 554 . 1 . 1 119 119 TYR H H 1 8.8040 0.04 . 1 . . . . . 119 TYR HN . 50479 1 555 . 1 . 1 119 119 TYR C C 13 175.4600 0.3 . 1 . . . . . 119 TYR C . 50479 1 556 . 1 . 1 119 119 TYR CA C 13 55.8700 0.3 . 1 . . . . . 119 TYR CA . 50479 1 557 . 1 . 1 119 119 TYR CB C 13 41.9400 0.3 . 1 . . . . . 119 TYR CB . 50479 1 558 . 1 . 1 119 119 TYR N N 15 116.2000 0.2 . 1 . . . . . 119 TYR N . 50479 1 559 . 1 . 1 120 120 ASP H H 1 8.4700 0.04 . 1 . . . . . 120 ASP HN . 50479 1 560 . 1 . 1 120 120 ASP C C 13 178.7000 0.3 . 1 . . . . . 120 ASP C . 50479 1 561 . 1 . 1 120 120 ASP CA C 13 51.6900 0.3 . 1 . . . . . 120 ASP CA . 50479 1 562 . 1 . 1 120 120 ASP CB C 13 41.3500 0.3 . 1 . . . . . 120 ASP CB . 50479 1 563 . 1 . 1 120 120 ASP N N 15 118.4200 0.2 . 1 . . . . . 120 ASP N . 50479 1 564 . 1 . 1 121 121 GLU H H 1 8.8480 0.04 . 1 . . . . . 121 GLU HN . 50479 1 565 . 1 . 1 121 121 GLU C C 13 177.5600 0.3 . 1 . . . . . 121 GLU C . 50479 1 566 . 1 . 1 121 121 GLU CA C 13 58.6200 0.3 . 1 . . . . . 121 GLU CA . 50479 1 567 . 1 . 1 121 121 GLU CB C 13 28.2400 0.3 . 1 . . . . . 121 GLU CB . 50479 1 568 . 1 . 1 121 121 GLU N N 15 119.5700 0.2 . 1 . . . . . 121 GLU N . 50479 1 569 . 1 . 1 122 122 GLN H H 1 8.1710 0.04 . 1 . . . . . 122 GLN HN . 50479 1 570 . 1 . 1 122 122 GLN C C 13 175.0900 0.3 . 1 . . . . . 122 GLN C . 50479 1 571 . 1 . 1 122 122 GLN CA C 13 55.1500 0.3 . 1 . . . . . 122 GLN CA . 50479 1 572 . 1 . 1 122 122 GLN CB C 13 27.4900 0.3 . 1 . . . . . 122 GLN CB . 50479 1 573 . 1 . 1 122 122 GLN N N 15 119.9500 0.2 . 1 . . . . . 122 GLN N . 50479 1 574 . 1 . 1 123 123 ARG H H 1 8.3130 0.04 . 1 . . . . . 123 ARG HN . 50479 1 575 . 1 . 1 123 123 ARG C C 13 174.9600 0.3 . 1 . . . . . 123 ARG C . 50479 1 576 . 1 . 1 123 123 ARG CA C 13 57.1400 0.3 . 1 . . . . . 123 ARG CA . 50479 1 577 . 1 . 1 123 123 ARG CB C 13 25.3100 0.3 . 1 . . . . . 123 ARG CB . 50479 1 578 . 1 . 1 123 123 ARG N N 15 115.2900 0.2 . 1 . . . . . 123 ARG N . 50479 1 579 . 1 . 1 124 124 GLN H H 1 8.4120 0.04 . 1 . . . . . 124 GLN HN . 50479 1 580 . 1 . 1 124 124 GLN C C 13 174.5500 0.3 . 1 . . . . . 124 GLN C . 50479 1 581 . 1 . 1 124 124 GLN CA C 13 52.3500 0.3 . 1 . . . . . 124 GLN CA . 50479 1 582 . 1 . 1 124 124 GLN CB C 13 27.2200 0.3 . 1 . . . . . 124 GLN CB . 50479 1 583 . 1 . 1 124 124 GLN N N 15 120.4300 0.2 . 1 . . . . . 124 GLN N . 50479 1 584 . 1 . 1 125 125 PRO C C 13 177.5600 0.3 . 1 . . . . . 125 PRO C . 50479 1 585 . 1 . 1 125 125 PRO CA C 13 62.6500 0.3 . 1 . . . . . 125 PRO CA . 50479 1 586 . 1 . 1 125 125 PRO CB C 13 31.6400 0.3 . 1 . . . . . 125 PRO CB . 50479 1 587 . 1 . 1 126 126 LEU H H 1 8.0720 0.04 . 1 . . . . . 126 LEU HN . 50479 1 588 . 1 . 1 126 126 LEU C C 13 177.6500 0.3 . 1 . . . . . 126 LEU C . 50479 1 589 . 1 . 1 126 126 LEU CA C 13 53.2700 0.3 . 1 . . . . . 126 LEU CA . 50479 1 590 . 1 . 1 126 126 LEU CB C 13 42.5800 0.3 . 1 . . . . . 126 LEU CB . 50479 1 591 . 1 . 1 126 126 LEU N N 15 125.6400 0.2 . 1 . . . . . 126 LEU N . 50479 1 592 . 1 . 1 127 127 THR H H 1 7.9590 0.04 . 1 . . . . . 127 THR HN . 50479 1 593 . 1 . 1 127 127 THR C C 13 176.4900 0.3 . 1 . . . . . 127 THR C . 50479 1 594 . 1 . 1 127 127 THR CA C 13 60.3600 0.3 . 1 . . . . . 127 THR CA . 50479 1 595 . 1 . 1 127 127 THR CB C 13 70.1900 0.3 . 1 . . . . . 127 THR CB . 50479 1 596 . 1 . 1 127 127 THR N N 15 110.6300 0.2 . 1 . . . . . 127 THR N . 50479 1 597 . 1 . 1 128 128 VAL H H 1 8.5610 0.04 . 1 . . . . . 128 VAL HN . 50479 1 598 . 1 . 1 128 128 VAL C C 13 176.8300 0.3 . 1 . . . . . 128 VAL C . 50479 1 599 . 1 . 1 128 128 VAL CA C 13 66.5900 0.3 . 1 . . . . . 128 VAL CA . 50479 1 600 . 1 . 1 128 128 VAL CB C 13 30.4700 0.3 . 1 . . . . . 128 VAL CB . 50479 1 601 . 1 . 1 128 128 VAL N N 15 121.9000 0.2 . 1 . . . . . 128 VAL N . 50479 1 602 . 1 . 1 129 129 GLU H H 1 8.1760 0.04 . 1 . . . . . 129 GLU HN . 50479 1 603 . 1 . 1 129 129 GLU C C 13 179.6900 0.3 . 1 . . . . . 129 GLU C . 50479 1 604 . 1 . 1 129 129 GLU CA C 13 59.6700 0.3 . 1 . . . . . 129 GLU CA . 50479 1 605 . 1 . 1 129 129 GLU CB C 13 27.5700 0.3 . 1 . . . . . 129 GLU CB . 50479 1 606 . 1 . 1 129 129 GLU N N 15 116.7000 0.2 . 1 . . . . . 129 GLU N . 50479 1 607 . 1 . 1 130 130 HIS H H 1 7.4380 0.04 . 1 . . . . . 130 HIS HN . 50479 1 608 . 1 . 1 130 130 HIS C C 13 179.6200 0.3 . 1 . . . . . 130 HIS C . 50479 1 609 . 1 . 1 130 130 HIS CA C 13 57.8700 0.3 . 1 . . . . . 130 HIS CA . 50479 1 610 . 1 . 1 130 130 HIS CB C 13 29.1900 0.3 . 1 . . . . . 130 HIS CB . 50479 1 611 . 1 . 1 130 130 HIS N N 15 116.2200 0.2 . 1 . . . . . 130 HIS N . 50479 1 612 . 1 . 1 131 131 MET H H 1 8.4120 0.04 . 1 . . . . . 131 MET HN . 50479 1 613 . 1 . 1 131 131 MET C C 13 178.4700 0.3 . 1 . . . . . 131 MET C . 50479 1 614 . 1 . 1 131 131 MET CA C 13 60.1200 0.3 . 1 . . . . . 131 MET CA . 50479 1 615 . 1 . 1 131 131 MET CB C 13 33.2300 0.3 . 1 . . . . . 131 MET CB . 50479 1 616 . 1 . 1 131 131 MET N N 15 125.0900 0.2 . 1 . . . . . 131 MET N . 50479 1 617 . 1 . 1 132 132 TYR H H 1 8.0800 0.04 . 1 . . . . . 132 TYR HN . 50479 1 618 . 1 . 1 132 132 TYR C C 13 178.4000 0.3 . 1 . . . . . 132 TYR C . 50479 1 619 . 1 . 1 132 132 TYR CA C 13 58.8900 0.3 . 1 . . . . . 132 TYR CA . 50479 1 620 . 1 . 1 132 132 TYR CB C 13 36.5500 0.3 . 1 . . . . . 132 TYR CB . 50479 1 621 . 1 . 1 132 132 TYR N N 15 116.1600 0.2 . 1 . . . . . 132 TYR N . 50479 1 622 . 1 . 1 133 133 GLU H H 1 7.6140 0.04 . 1 . . . . . 133 GLU HN . 50479 1 623 . 1 . 1 133 133 GLU C C 13 177.1100 0.3 . 1 . . . . . 133 GLU C . 50479 1 624 . 1 . 1 133 133 GLU CA C 13 57.9200 0.3 . 1 . . . . . 133 GLU CA . 50479 1 625 . 1 . 1 133 133 GLU CB C 13 30.1900 0.3 . 1 . . . . . 133 GLU CB . 50479 1 626 . 1 . 1 133 133 GLU N N 15 116.6800 0.2 . 1 . . . . . 133 GLU N . 50479 1 627 . 1 . 1 134 134 ASP H H 1 8.0330 0.04 . 1 . . . . . 134 ASP HN . 50479 1 628 . 1 . 1 134 134 ASP C C 13 173.5700 0.3 . 1 . . . . . 134 ASP C . 50479 1 629 . 1 . 1 134 134 ASP CA C 13 55.1800 0.3 . 1 . . . . . 134 ASP CA . 50479 1 630 . 1 . 1 134 134 ASP CB C 13 40.4400 0.3 . 1 . . . . . 134 ASP CB . 50479 1 631 . 1 . 1 134 134 ASP N N 15 119.5100 0.2 . 1 . . . . . 134 ASP N . 50479 1 632 . 1 . 1 135 135 ILE H H 1 7.1650 0.04 . 1 . . . . . 135 ILE HN . 50479 1 633 . 1 . 1 135 135 ILE C C 13 175.2500 0.3 . 1 . . . . . 135 ILE C . 50479 1 634 . 1 . 1 135 135 ILE CA C 13 58.7600 0.3 . 1 . . . . . 135 ILE CA . 50479 1 635 . 1 . 1 135 135 ILE CB C 13 38.9100 0.3 . 1 . . . . . 135 ILE CB . 50479 1 636 . 1 . 1 135 135 ILE N N 15 121.3100 0.2 . 1 . . . . . 135 ILE N . 50479 1 637 . 1 . 1 136 136 SER H H 1 8.9790 0.04 . 1 . . . . . 136 SER HN . 50479 1 638 . 1 . 1 136 136 SER C C 13 177.4500 0.3 . 1 . . . . . 136 SER C . 50479 1 639 . 1 . 1 136 136 SER CA C 13 58.5400 0.3 . 1 . . . . . 136 SER CA . 50479 1 640 . 1 . 1 136 136 SER CB C 13 63.1900 0.3 . 1 . . . . . 136 SER CB . 50479 1 641 . 1 . 1 136 136 SER N N 15 121.8500 0.2 . 1 . . . . . 136 SER N . 50479 1 642 . 1 . 1 137 137 GLN C C 13 176.9900 0.3 . 1 . . . . . 137 GLN C . 50479 1 643 . 1 . 1 137 137 GLN CA C 13 57.6100 0.3 . 1 . . . . . 137 GLN CA . 50479 1 644 . 1 . 1 138 138 ASP H H 1 8.3260 0.04 . 1 . . . . . 138 ASP HN . 50479 1 645 . 1 . 1 138 138 ASP C C 13 177.6600 0.3 . 1 . . . . . 138 ASP C . 50479 1 646 . 1 . 1 138 138 ASP CA C 13 55.1400 0.3 . 1 . . . . . 138 ASP CA . 50479 1 647 . 1 . 1 138 138 ASP CB C 13 39.9500 0.3 . 1 . . . . . 138 ASP CB . 50479 1 648 . 1 . 1 138 138 ASP N N 15 118.8900 0.2 . 1 . . . . . 138 ASP N . 50479 1 649 . 1 . 1 139 139 HIS H H 1 7.8120 0.04 . 1 . . . . . 139 HIS HN . 50479 1 650 . 1 . 1 139 139 HIS C C 13 176.6900 0.3 . 1 . . . . . 139 HIS C . 50479 1 651 . 1 . 1 139 139 HIS CA C 13 57.5900 0.3 . 1 . . . . . 139 HIS CA . 50479 1 652 . 1 . 1 139 139 HIS CB C 13 30.1700 0.3 . 1 . . . . . 139 HIS CB . 50479 1 653 . 1 . 1 139 139 HIS N N 15 116.2200 0.2 . 1 . . . . . 139 HIS N . 50479 1 654 . 1 . 1 140 140 VAL H H 1 7.5860 0.04 . 1 . . . . . 140 VAL HN . 50479 1 655 . 1 . 1 140 140 VAL C C 13 176.2700 0.3 . 1 . . . . . 140 VAL C . 50479 1 656 . 1 . 1 140 140 VAL CA C 13 65.2200 0.3 . 1 . . . . . 140 VAL CA . 50479 1 657 . 1 . 1 140 140 VAL CB C 13 31.5600 0.3 . 1 . . . . . 140 VAL CB . 50479 1 658 . 1 . 1 140 140 VAL N N 15 121.3700 0.2 . 1 . . . . . 140 VAL N . 50479 1 659 . 1 . 1 141 141 LYS C C 13 177.7800 0.3 . 1 . . . . . 141 LYS C . 50479 1 660 . 1 . 1 142 142 LYS H H 1 7.9200 0.04 . 1 . . . . . 142 LYS HN . 50479 1 661 . 1 . 1 142 142 LYS C C 13 177.4100 0.3 . 1 . . . . . 142 LYS C . 50479 1 662 . 1 . 1 142 142 LYS CA C 13 57.5300 0.3 . 1 . . . . . 142 LYS CA . 50479 1 663 . 1 . 1 142 142 LYS N N 15 117.5700 0.2 . 1 . . . . . 142 LYS N . 50479 1 664 . 1 . 1 143 143 THR H H 1 8.1260 0.04 . 1 . . . . . 143 THR HN . 50479 1 665 . 1 . 1 143 143 THR C C 13 173.9900 0.3 . 1 . . . . . 143 THR C . 50479 1 666 . 1 . 1 143 143 THR CA C 13 62.7600 0.3 . 1 . . . . . 143 THR CA . 50479 1 667 . 1 . 1 143 143 THR N N 15 112.4700 0.2 . 1 . . . . . 143 THR N . 50479 1 668 . 1 . 1 144 144 VAL H H 1 7.4880 0.04 . 1 . . . . . 144 VAL HN . 50479 1 669 . 1 . 1 144 144 VAL C C 13 176.1900 0.3 . 1 . . . . . 144 VAL C . 50479 1 670 . 1 . 1 144 144 VAL CA C 13 60.8200 0.3 . 1 . . . . . 144 VAL CA . 50479 1 671 . 1 . 1 144 144 VAL CB C 13 32.6000 0.3 . 1 . . . . . 144 VAL CB . 50479 1 672 . 1 . 1 144 144 VAL N N 15 123.2500 0.2 . 1 . . . . . 144 VAL N . 50479 1 673 . 1 . 1 145 145 THR H H 1 8.7440 0.04 . 1 . . . . . 145 THR HN . 50479 1 674 . 1 . 1 145 145 THR C C 13 172.1900 0.3 . 1 . . . . . 145 THR C . 50479 1 675 . 1 . 1 145 145 THR CA C 13 59.2400 0.3 . 1 . . . . . 145 THR CA . 50479 1 676 . 1 . 1 145 145 THR CB C 13 71.5900 0.3 . 1 . . . . . 145 THR CB . 50479 1 677 . 1 . 1 145 145 THR N N 15 119.0300 0.2 . 1 . . . . . 145 THR N . 50479 1 678 . 1 . 1 146 146 ILE H H 1 8.3820 0.04 . 1 . . . . . 146 ILE HN . 50479 1 679 . 1 . 1 146 146 ILE C C 13 176.6500 0.3 . 1 . . . . . 146 ILE C . 50479 1 680 . 1 . 1 146 146 ILE CA C 13 58.7000 0.3 . 1 . . . . . 146 ILE CA . 50479 1 681 . 1 . 1 146 146 ILE CB C 13 35.2800 0.3 . 1 . . . . . 146 ILE CB . 50479 1 682 . 1 . 1 146 146 ILE N N 15 121.9400 0.2 . 1 . . . . . 146 ILE N . 50479 1 683 . 1 . 1 147 147 GLU H H 1 8.8360 0.04 . 1 . . . . . 147 GLU HN . 50479 1 684 . 1 . 1 147 147 GLU C C 13 174.7000 0.3 . 1 . . . . . 147 GLU C . 50479 1 685 . 1 . 1 147 147 GLU CA C 13 54.3200 0.3 . 1 . . . . . 147 GLU CA . 50479 1 686 . 1 . 1 147 147 GLU CB C 13 34.0100 0.3 . 1 . . . . . 147 GLU CB . 50479 1 687 . 1 . 1 147 147 GLU N N 15 125.1200 0.2 . 1 . . . . . 147 GLU N . 50479 1 688 . 1 . 1 148 148 ASN H H 1 8.8250 0.04 . 1 . . . . . 148 ASN HN . 50479 1 689 . 1 . 1 148 148 ASN C C 13 174.3700 0.3 . 1 . . . . . 148 ASN C . 50479 1 690 . 1 . 1 148 148 ASN CA C 13 53.7400 0.3 . 1 . . . . . 148 ASN CA . 50479 1 691 . 1 . 1 148 148 ASN CB C 13 37.8700 0.3 . 1 . . . . . 148 ASN CB . 50479 1 692 . 1 . 1 148 148 ASN N N 15 122.3000 0.2 . 1 . . . . . 148 ASN N . 50479 1 693 . 1 . 1 149 149 HIS H H 1 8.8740 0.04 . 1 . . . . . 149 HIS HN . 50479 1 694 . 1 . 1 149 149 HIS C C 13 175.7100 0.3 . 1 . . . . . 149 HIS C . 50479 1 695 . 1 . 1 149 149 HIS CA C 13 54.0700 0.3 . 1 . . . . . 149 HIS CA . 50479 1 696 . 1 . 1 149 149 HIS CB C 13 29.9600 0.3 . 1 . . . . . 149 HIS CB . 50479 1 697 . 1 . 1 149 149 HIS N N 15 127.8700 0.2 . 1 . . . . . 149 HIS N . 50479 1 698 . 1 . 1 150 150 PRO CB C 13 31.0900 0.3 . 1 . . . . . 150 PRO CB . 50479 1 699 . 1 . 1 151 151 HIS H H 1 9.7510 0.04 . 1 . . . . . 151 HIS HN . 50479 1 700 . 1 . 1 151 151 HIS C C 13 172.6400 0.3 . 1 . . . . . 151 HIS C . 50479 1 701 . 1 . 1 151 151 HIS CA C 13 54.6000 0.3 . 1 . . . . . 151 HIS CA . 50479 1 702 . 1 . 1 151 151 HIS CB C 13 32.0600 0.3 . 1 . . . . . 151 HIS CB . 50479 1 703 . 1 . 1 151 151 HIS N N 15 117.1800 0.2 . 1 . . . . . 151 HIS N . 50479 1 704 . 1 . 1 152 152 LEU H H 1 6.7310 0.04 . 1 . . . . . 152 LEU HN . 50479 1 705 . 1 . 1 152 152 LEU C C 13 173.4700 0.3 . 1 . . . . . 152 LEU C . 50479 1 706 . 1 . 1 152 152 LEU CA C 13 52.0200 0.3 . 1 . . . . . 152 LEU CA . 50479 1 707 . 1 . 1 152 152 LEU CB C 13 43.4600 0.3 . 1 . . . . . 152 LEU CB . 50479 1 708 . 1 . 1 152 152 LEU N N 15 120.9100 0.2 . 1 . . . . . 152 LEU N . 50479 1 709 . 1 . 1 156 156 PRO C C 13 173.8200 0.3 . 1 . . . . . 156 PRO C . 50479 1 710 . 1 . 1 156 156 PRO CA C 13 63.1200 0.3 . 1 . . . . . 156 PRO CA . 50479 1 711 . 1 . 1 156 156 PRO CB C 13 31.9400 0.3 . 1 . . . . . 156 PRO CB . 50479 1 712 . 1 . 1 157 157 MET H H 1 8.3100 0.04 . 1 . . . . . 157 MET HN . 50479 1 713 . 1 . 1 157 157 MET C C 13 174.3600 0.3 . 1 . . . . . 157 MET C . 50479 1 714 . 1 . 1 157 157 MET CA C 13 53.9600 0.3 . 1 . . . . . 157 MET CA . 50479 1 715 . 1 . 1 157 157 MET CB C 13 35.6700 0.3 . 1 . . . . . 157 MET CB . 50479 1 716 . 1 . 1 157 157 MET N N 15 116.2900 0.2 . 1 . . . . . 157 MET N . 50479 1 717 . 1 . 1 158 158 CYS H H 1 8.2990 0.04 . 1 . . . . . 158 CYS HN . 50479 1 718 . 1 . 1 158 158 CYS C C 13 174.3500 0.3 . 1 . . . . . 158 CYS C . 50479 1 719 . 1 . 1 158 158 CYS CA C 13 58.8200 0.3 . 1 . . . . . 158 CYS CA . 50479 1 720 . 1 . 1 158 158 CYS CB C 13 27.3300 0.3 . 1 . . . . . 158 CYS CB . 50479 1 721 . 1 . 1 158 158 CYS N N 15 116.3400 0.2 . 1 . . . . . 158 CYS N . 50479 1 722 . 1 . 1 159 159 SER H H 1 9.2640 0.04 . 1 . . . . . 159 SER HN . 50479 1 723 . 1 . 1 159 159 SER CA C 13 55.6900 0.3 . 1 . . . . . 159 SER CA . 50479 1 724 . 1 . 1 159 159 SER N N 15 121.3900 0.2 . 1 . . . . . 159 SER N . 50479 1 725 . 1 . 1 169 169 MET C C 13 178.5500 0.3 . 1 . . . . . 169 MET C . 50479 1 726 . 1 . 1 169 169 MET CA C 13 56.5400 0.3 . 1 . . . . . 169 MET CA . 50479 1 727 . 1 . 1 170 170 LYS H H 1 8.0270 0.04 . 1 . . . . . 170 LYS HN . 50479 1 728 . 1 . 1 170 170 LYS C C 13 178.4800 0.3 . 1 . . . . . 170 LYS C . 50479 1 729 . 1 . 1 170 170 LYS CA C 13 59.6100 0.3 . 1 . . . . . 170 LYS CA . 50479 1 730 . 1 . 1 170 170 LYS CB C 13 31.9500 0.3 . 1 . . . . . 170 LYS CB . 50479 1 731 . 1 . 1 170 170 LYS N N 15 118.5700 0.2 . 1 . . . . . 170 LYS N . 50479 1 732 . 1 . 1 171 171 LYS H H 1 7.2650 0.04 . 1 . . . . . 171 LYS HN . 50479 1 733 . 1 . 1 171 171 LYS C C 13 179.7100 0.3 . 1 . . . . . 171 LYS C . 50479 1 734 . 1 . 1 171 171 LYS CA C 13 58.0200 0.3 . 1 . . . . . 171 LYS CA . 50479 1 735 . 1 . 1 171 171 LYS CB C 13 31.1000 0.3 . 1 . . . . . 171 LYS CB . 50479 1 736 . 1 . 1 171 171 LYS N N 15 118.2100 0.2 . 1 . . . . . 171 LYS N . 50479 1 737 . 1 . 1 172 172 ILE H H 1 7.8900 0.04 . 1 . . . . . 172 ILE HN . 50479 1 738 . 1 . 1 172 172 ILE C C 13 178.1700 0.3 . 1 . . . . . 172 ILE C . 50479 1 739 . 1 . 1 172 172 ILE CA C 13 65.1200 0.3 . 1 . . . . . 172 ILE CA . 50479 1 740 . 1 . 1 172 172 ILE CB C 13 36.2600 0.3 . 1 . . . . . 172 ILE CB . 50479 1 741 . 1 . 1 172 172 ILE N N 15 122.7700 0.2 . 1 . . . . . 172 ILE N . 50479 1 742 . 1 . 1 173 173 ILE C C 13 178.0800 0.3 . 1 . . . . . 173 ILE C . 50479 1 743 . 1 . 1 173 173 ILE CA C 13 65.3400 0.3 . 1 . . . . . 173 ILE CA . 50479 1 744 . 1 . 1 173 173 ILE CB C 13 36.9900 0.3 . 1 . . . . . 173 ILE CB . 50479 1 745 . 1 . 1 174 174 GLU H H 1 7.9560 0.04 . 1 . . . . . 174 GLU HN . 50479 1 746 . 1 . 1 174 174 GLU C C 13 178.7700 0.3 . 1 . . . . . 174 GLU C . 50479 1 747 . 1 . 1 174 174 GLU CA C 13 58.7400 0.3 . 1 . . . . . 174 GLU CA . 50479 1 748 . 1 . 1 174 174 GLU CB C 13 29.1900 0.3 . 1 . . . . . 174 GLU CB . 50479 1 749 . 1 . 1 174 174 GLU N N 15 119.3500 0.2 . 1 . . . . . 174 GLU N . 50479 1 750 . 1 . 1 175 175 THR H H 1 7.8230 0.04 . 1 . . . . . 175 THR HN . 50479 1 751 . 1 . 1 175 175 THR C C 13 176.9000 0.3 . 1 . . . . . 175 THR C . 50479 1 752 . 1 . 1 175 175 THR CA C 13 65.8400 0.3 . 1 . . . . . 175 THR CA . 50479 1 753 . 1 . 1 175 175 THR CB C 13 68.3400 0.3 . 1 . . . . . 175 THR CB . 50479 1 754 . 1 . 1 175 175 THR N N 15 115.7500 0.2 . 1 . . . . . 175 THR N . 50479 1 755 . 1 . 1 176 176 VAL H H 1 8.0960 0.04 . 1 . . . . . 176 VAL HN . 50479 1 756 . 1 . 1 176 176 VAL C C 13 178.1900 0.3 . 1 . . . . . 176 VAL C . 50479 1 757 . 1 . 1 176 176 VAL CA C 13 64.9400 0.3 . 1 . . . . . 176 VAL CA . 50479 1 758 . 1 . 1 176 176 VAL CB C 13 30.7800 0.3 . 1 . . . . . 176 VAL CB . 50479 1 759 . 1 . 1 176 176 VAL N N 15 122.3000 0.2 . 1 . . . . . 176 VAL N . 50479 1 760 . 1 . 1 177 177 ALA H H 1 8.2200 0.04 . 1 . . . . . 177 ALA HN . 50479 1 761 . 1 . 1 177 177 ALA C C 13 179.7400 0.3 . 1 . . . . . 177 ALA C . 50479 1 762 . 1 . 1 177 177 ALA CA C 13 53.7000 0.3 . 1 . . . . . 177 ALA CA . 50479 1 763 . 1 . 1 177 177 ALA CB C 13 17.9600 0.3 . 1 . . . . . 177 ALA CB . 50479 1 764 . 1 . 1 177 177 ALA N N 15 123.6400 0.2 . 1 . . . . . 177 ALA N . 50479 1 765 . 1 . 1 178 178 GLU H H 1 7.8250 0.04 . 1 . . . . . 178 GLU HN . 50479 1 766 . 1 . 1 178 178 GLU C C 13 177.8600 0.3 . 1 . . . . . 178 GLU C . 50479 1 767 . 1 . 1 178 178 GLU CA C 13 57.5600 0.3 . 1 . . . . . 178 GLU CA . 50479 1 768 . 1 . 1 178 178 GLU CB C 13 28.7700 0.3 . 1 . . . . . 178 GLU CB . 50479 1 769 . 1 . 1 178 178 GLU N N 15 119.0400 0.2 . 1 . . . . . 178 GLU N . 50479 1 770 . 1 . 1 179 179 GLY H H 1 7.9230 0.04 . 1 . . . . . 179 GLY HN . 50479 1 771 . 1 . 1 179 179 GLY C C 13 175.1300 0.3 . 1 . . . . . 179 GLY C . 50479 1 772 . 1 . 1 179 179 GLY CA C 13 45.3500 0.3 . 1 . . . . . 179 GLY CA . 50479 1 773 . 1 . 1 179 179 GLY N N 15 107.7600 0.2 . 1 . . . . . 179 GLY N . 50479 1 774 . 1 . 1 180 180 GLY H H 1 7.8970 0.04 . 1 . . . . . 180 GLY HN . 50479 1 775 . 1 . 1 180 180 GLY C C 13 174.8500 0.3 . 1 . . . . . 180 GLY C . 50479 1 776 . 1 . 1 180 180 GLY CA C 13 45.0700 0.3 . 1 . . . . . 180 GLY CA . 50479 1 777 . 1 . 1 180 180 GLY N N 15 108.4500 0.2 . 1 . . . . . 180 GLY N . 50479 1 778 . 1 . 1 181 181 GLY H H 1 8.2140 0.04 . 1 . . . . . 181 GLY HN . 50479 1 779 . 1 . 1 181 181 GLY C C 13 173.9600 0.3 . 1 . . . . . 181 GLY C . 50479 1 780 . 1 . 1 181 181 GLY CA C 13 44.7500 0.3 . 1 . . . . . 181 GLY CA . 50479 1 781 . 1 . 1 181 181 GLY N N 15 109.1900 0.2 . 1 . . . . . 181 GLY N . 50479 1 782 . 1 . 1 182 182 GLU H H 1 8.2590 0.04 . 1 . . . . . 182 GLU HN . 50479 1 783 . 1 . 1 182 182 GLU C C 13 176.1200 0.3 . 1 . . . . . 182 GLU C . 50479 1 784 . 1 . 1 182 182 GLU CA C 13 56.2100 0.3 . 1 . . . . . 182 GLU CA . 50479 1 785 . 1 . 1 182 182 GLU CB C 13 29.2100 0.3 . 1 . . . . . 182 GLU CB . 50479 1 786 . 1 . 1 182 182 GLU N N 15 121.3100 0.2 . 1 . . . . . 182 GLU N . 50479 1 787 . 1 . 1 183 183 LEU C C 13 176.1500 0.3 . 1 . . . . . 183 LEU C . 50479 1 788 . 1 . 1 183 183 LEU CA C 13 54.3700 0.3 . 1 . . . . . 183 LEU CA . 50479 1 789 . 1 . 1 183 183 LEU CB C 13 41.9900 0.3 . 1 . . . . . 183 LEU CB . 50479 1 790 . 1 . 1 184 184 GLY H H 1 7.4890 0.04 . 1 . . . . . 184 GLY HN . 50479 1 791 . 1 . 1 184 184 GLY C C 13 174.6200 0.3 . 1 . . . . . 184 GLY C . 50479 1 792 . 1 . 1 184 184 GLY CA C 13 44.1200 0.3 . 1 . . . . . 184 GLY CA . 50479 1 793 . 1 . 1 184 184 GLY N N 15 109.6500 0.2 . 1 . . . . . 184 GLY N . 50479 1 794 . 1 . 1 185 185 VAL H H 1 8.6810 0.04 . 1 . . . . . 185 VAL HN . 50479 1 795 . 1 . 1 185 185 VAL C C 13 175.7500 0.3 . 1 . . . . . 185 VAL C . 50479 1 796 . 1 . 1 185 185 VAL CA C 13 64.1200 0.3 . 1 . . . . . 185 VAL CA . 50479 1 797 . 1 . 1 185 185 VAL CB C 13 30.4700 0.3 . 1 . . . . . 185 VAL CB . 50479 1 798 . 1 . 1 185 185 VAL N N 15 122.7800 0.2 . 1 . . . . . 185 VAL N . 50479 1 799 . 1 . 1 186 186 HIS H H 1 8.2150 0.04 . 1 . . . . . 186 HIS HN . 50479 1 800 . 1 . 1 186 186 HIS C C 13 175.4400 0.3 . 1 . . . . . 186 HIS C . 50479 1 801 . 1 . 1 186 186 HIS CA C 13 57.8500 0.3 . 1 . . . . . 186 HIS CA . 50479 1 802 . 1 . 1 186 186 HIS CB C 13 28.4100 0.3 . 1 . . . . . 186 HIS CB . 50479 1 803 . 1 . 1 186 186 HIS N N 15 117.6800 0.2 . 1 . . . . . 186 HIS N . 50479 1 804 . 1 . 1 187 187 MET H H 1 7.2470 0.04 . 1 . . . . . 187 MET HN . 50479 1 805 . 1 . 1 187 187 MET C C 13 177.7700 0.3 . 1 . . . . . 187 MET C . 50479 1 806 . 1 . 1 187 187 MET CA C 13 54.4100 0.3 . 1 . . . . . 187 MET CA . 50479 1 807 . 1 . 1 187 187 MET CB C 13 31.1600 0.3 . 1 . . . . . 187 MET CB . 50479 1 808 . 1 . 1 187 187 MET N N 15 116.6100 0.2 . 1 . . . . . 187 MET N . 50479 1 809 . 1 . 1 188 188 TYR H H 1 7.9290 0.04 . 1 . . . . . 188 TYR HN . 50479 1 810 . 1 . 1 188 188 TYR C C 13 177.8400 0.3 . 1 . . . . . 188 TYR C . 50479 1 811 . 1 . 1 188 188 TYR CA C 13 62.8100 0.3 . 1 . . . . . 188 TYR CA . 50479 1 812 . 1 . 1 188 188 TYR CB C 13 39.0900 0.3 . 1 . . . . . 188 TYR CB . 50479 1 813 . 1 . 1 188 188 TYR N N 15 119.5000 0.2 . 1 . . . . . 188 TYR N . 50479 1 814 . 1 . 1 189 189 LEU H H 1 8.0810 0.04 . 1 . . . . . 189 LEU HN . 50479 1 815 . 1 . 1 189 189 LEU C C 13 178.1900 0.3 . 1 . . . . . 189 LEU C . 50479 1 816 . 1 . 1 189 189 LEU CA C 13 56.7400 0.3 . 1 . . . . . 189 LEU CA . 50479 1 817 . 1 . 1 189 189 LEU CB C 13 39.9200 0.3 . 1 . . . . . 189 LEU CB . 50479 1 818 . 1 . 1 189 189 LEU N N 15 112.0600 0.2 . 1 . . . . . 189 LEU N . 50479 1 819 . 1 . 1 190 190 LEU H H 1 7.1610 0.04 . 1 . . . . . 190 LEU HN . 50479 1 820 . 1 . 1 190 190 LEU C C 13 179.0600 0.3 . 1 . . . . . 190 LEU C . 50479 1 821 . 1 . 1 190 190 LEU CA C 13 57.9500 0.3 . 1 . . . . . 190 LEU CA . 50479 1 822 . 1 . 1 190 190 LEU CB C 13 39.7900 0.3 . 1 . . . . . 190 LEU CB . 50479 1 823 . 1 . 1 190 190 LEU N N 15 120.4700 0.2 . 1 . . . . . 190 LEU N . 50479 1 824 . 1 . 1 191 191 ILE H H 1 7.3990 0.04 . 1 . . . . . 191 ILE HN . 50479 1 825 . 1 . 1 191 191 ILE C C 13 177.7000 0.3 . 1 . . . . . 191 ILE C . 50479 1 826 . 1 . 1 191 191 ILE CA C 13 64.2500 0.3 . 1 . . . . . 191 ILE CA . 50479 1 827 . 1 . 1 191 191 ILE CB C 13 36.8900 0.3 . 1 . . . . . 191 ILE CB . 50479 1 828 . 1 . 1 191 191 ILE N N 15 119.4900 0.2 . 1 . . . . . 191 ILE N . 50479 1 829 . 1 . 1 192 192 PHE H H 1 8.3790 0.04 . 1 . . . . . 192 PHE HN . 50479 1 830 . 1 . 1 192 192 PHE CA C 13 61.1200 0.3 . 1 . . . . . 192 PHE CA . 50479 1 831 . 1 . 1 192 192 PHE CB C 13 38.8900 0.3 . 1 . . . . . 192 PHE CB . 50479 1 832 . 1 . 1 192 192 PHE N N 15 120.9000 0.2 . 1 . . . . . 192 PHE N . 50479 1 833 . 1 . 1 193 193 LEU C C 13 178.5400 0.3 . 1 . . . . . 193 LEU C . 50479 1 834 . 1 . 1 193 193 LEU CA C 13 56.4500 0.3 . 1 . . . . . 193 LEU CA . 50479 1 835 . 1 . 1 193 193 LEU CB C 13 40.7100 0.3 . 1 . . . . . 193 LEU CB . 50479 1 836 . 1 . 1 194 194 LYS H H 1 7.3420 0.04 . 1 . . . . . 194 LYS HN . 50479 1 837 . 1 . 1 194 194 LYS C C 13 178.6400 0.3 . 1 . . . . . 194 LYS C . 50479 1 838 . 1 . 1 194 194 LYS CA C 13 58.5600 0.3 . 1 . . . . . 194 LYS CA . 50479 1 839 . 1 . 1 194 194 LYS CB C 13 31.3400 0.3 . 1 . . . . . 194 LYS CB . 50479 1 840 . 1 . 1 194 194 LYS N N 15 121.7100 0.2 . 1 . . . . . 194 LYS N . 50479 1 841 . 1 . 1 195 195 PHE H H 1 7.6710 0.04 . 1 . . . . . 195 PHE HN . 50479 1 842 . 1 . 1 195 195 PHE C C 13 178.3000 0.3 . 1 . . . . . 195 PHE C . 50479 1 843 . 1 . 1 195 195 PHE CA C 13 60.3000 0.3 . 1 . . . . . 195 PHE CA . 50479 1 844 . 1 . 1 195 195 PHE CB C 13 38.0900 0.3 . 1 . . . . . 195 PHE CB . 50479 1 845 . 1 . 1 195 195 PHE N N 15 119.9600 0.2 . 1 . . . . . 195 PHE N . 50479 1 846 . 1 . 1 196 196 VAL H H 1 8.0180 0.04 . 1 . . . . . 196 VAL HN . 50479 1 847 . 1 . 1 196 196 VAL C C 13 175.7400 0.3 . 1 . . . . . 196 VAL C . 50479 1 848 . 1 . 1 196 196 VAL CA C 13 63.5300 0.3 . 1 . . . . . 196 VAL CA . 50479 1 849 . 1 . 1 196 196 VAL CB C 13 30.4200 0.3 . 1 . . . . . 196 VAL CB . 50479 1 850 . 1 . 1 196 196 VAL N N 15 116.6700 0.2 . 1 . . . . . 196 VAL N . 50479 1 851 . 1 . 1 197 197 GLN H H 1 6.7940 0.04 . 1 . . . . . 197 GLN HN . 50479 1 852 . 1 . 1 197 197 GLN C C 13 177.0600 0.3 . 1 . . . . . 197 GLN C . 50479 1 853 . 1 . 1 197 197 GLN CA C 13 58.3800 0.3 . 1 . . . . . 197 GLN CA . 50479 1 854 . 1 . 1 197 197 GLN CB C 13 28.2400 0.3 . 1 . . . . . 197 GLN CB . 50479 1 855 . 1 . 1 197 197 GLN N N 15 123.2000 0.2 . 1 . . . . . 197 GLN N . 50479 1 856 . 1 . 1 198 198 ALA H H 1 6.7590 0.04 . 1 . . . . . 198 ALA HN . 50479 1 857 . 1 . 1 198 198 ALA C C 13 178.9500 0.3 . 1 . . . . . 198 ALA C . 50479 1 858 . 1 . 1 198 198 ALA CA C 13 53.3000 0.3 . 1 . . . . . 198 ALA CA . 50479 1 859 . 1 . 1 198 198 ALA CB C 13 17.9900 0.3 . 1 . . . . . 198 ALA CB . 50479 1 860 . 1 . 1 198 198 ALA N N 15 114.8300 0.2 . 1 . . . . . 198 ALA N . 50479 1 861 . 1 . 1 199 199 VAL H H 1 7.6030 0.04 . 1 . . . . . 199 VAL HN . 50479 1 862 . 1 . 1 199 199 VAL C C 13 174.8300 0.3 . 1 . . . . . 199 VAL C . 50479 1 863 . 1 . 1 199 199 VAL CA C 13 63.8000 0.3 . 1 . . . . . 199 VAL CA . 50479 1 864 . 1 . 1 199 199 VAL CB C 13 30.9700 0.3 . 1 . . . . . 199 VAL CB . 50479 1 865 . 1 . 1 199 199 VAL N N 15 117.1600 0.2 . 1 . . . . . 199 VAL N . 50479 1 866 . 1 . 1 200 200 ILE H H 1 6.7850 0.04 . 1 . . . . . 200 ILE HN . 50479 1 867 . 1 . 1 200 200 ILE C C 13 174.9100 0.3 . 1 . . . . . 200 ILE C . 50479 1 868 . 1 . 1 200 200 ILE CA C 13 57.2700 0.3 . 1 . . . . . 200 ILE CA . 50479 1 869 . 1 . 1 200 200 ILE CB C 13 37.3900 0.3 . 1 . . . . . 200 ILE CB . 50479 1 870 . 1 . 1 200 200 ILE N N 15 111.0600 0.2 . 1 . . . . . 200 ILE N . 50479 1 871 . 1 . 1 201 201 PRO C C 13 178.8900 0.3 . 1 . . . . . 201 PRO C . 50479 1 872 . 1 . 1 201 201 PRO CA C 13 65.0800 0.3 . 1 . . . . . 201 PRO CA . 50479 1 873 . 1 . 1 201 201 PRO CB C 13 32.0800 0.3 . 1 . . . . . 201 PRO CB . 50479 1 874 . 1 . 1 202 202 THR H H 1 9.2310 0.04 . 1 . . . . . 202 THR HN . 50479 1 875 . 1 . 1 202 202 THR C C 13 174.3900 0.3 . 1 . . . . . 202 THR C . 50479 1 876 . 1 . 1 202 202 THR CA C 13 59.8600 0.3 . 1 . . . . . 202 THR CA . 50479 1 877 . 1 . 1 202 202 THR CB C 13 68.8000 0.3 . 1 . . . . . 202 THR CB . 50479 1 878 . 1 . 1 202 202 THR N N 15 110.5800 0.2 . 1 . . . . . 202 THR N . 50479 1 879 . 1 . 1 203 203 ILE H H 1 7.3060 0.04 . 1 . . . . . 203 ILE HN . 50479 1 880 . 1 . 1 203 203 ILE C C 13 175.7400 0.3 . 1 . . . . . 203 ILE C . 50479 1 881 . 1 . 1 203 203 ILE CA C 13 62.7200 0.3 . 1 . . . . . 203 ILE CA . 50479 1 882 . 1 . 1 203 203 ILE CB C 13 36.5100 0.3 . 1 . . . . . 203 ILE CB . 50479 1 883 . 1 . 1 203 203 ILE N N 15 126.0700 0.2 . 1 . . . . . 203 ILE N . 50479 1 884 . 1 . 1 204 204 GLU H H 1 8.0820 0.04 . 1 . . . . . 204 GLU HN . 50479 1 885 . 1 . 1 204 204 GLU C C 13 175.7400 0.3 . 1 . . . . . 204 GLU C . 50479 1 886 . 1 . 1 204 204 GLU CA C 13 55.8800 0.3 . 1 . . . . . 204 GLU CA . 50479 1 887 . 1 . 1 204 204 GLU CB C 13 26.2900 0.3 . 1 . . . . . 204 GLU CB . 50479 1 888 . 1 . 1 204 204 GLU N N 15 129.8300 0.2 . 1 . . . . . 204 GLU N . 50479 1 889 . 1 . 1 205 205 TYR H H 1 7.3050 0.04 . 1 . . . . . 205 TYR HN . 50479 1 890 . 1 . 1 205 205 TYR C C 13 174.8100 0.3 . 1 . . . . . 205 TYR C . 50479 1 891 . 1 . 1 205 205 TYR CA C 13 55.6800 0.3 . 1 . . . . . 205 TYR CA . 50479 1 892 . 1 . 1 205 205 TYR CB C 13 38.8700 0.3 . 1 . . . . . 205 TYR CB . 50479 1 893 . 1 . 1 205 205 TYR N N 15 119.0400 0.2 . 1 . . . . . 205 TYR N . 50479 1 894 . 1 . 1 206 206 ASP H H 1 8.5310 0.04 . 1 . . . . . 206 ASP HN . 50479 1 895 . 1 . 1 206 206 ASP C C 13 175.9500 0.3 . 1 . . . . . 206 ASP C . 50479 1 896 . 1 . 1 206 206 ASP CA C 13 54.4100 0.3 . 1 . . . . . 206 ASP CA . 50479 1 897 . 1 . 1 206 206 ASP CB C 13 42.3200 0.3 . 1 . . . . . 206 ASP CB . 50479 1 898 . 1 . 1 206 206 ASP N N 15 121.3200 0.2 . 1 . . . . . 206 ASP N . 50479 1 899 . 1 . 1 207 207 TYR H H 1 7.8190 0.04 . 1 . . . . . 207 TYR HN . 50479 1 900 . 1 . 1 207 207 TYR C C 13 173.8500 0.3 . 1 . . . . . 207 TYR C . 50479 1 901 . 1 . 1 207 207 TYR CA C 13 57.5300 0.3 . 1 . . . . . 207 TYR CA . 50479 1 902 . 1 . 1 207 207 TYR CB C 13 37.3300 0.3 . 1 . . . . . 207 TYR CB . 50479 1 903 . 1 . 1 207 207 TYR N N 15 117.6400 0.2 . 1 . . . . . 207 TYR N . 50479 1 904 . 1 . 1 208 208 THR H H 1 7.0490 0.04 . 1 . . . . . 208 THR HN . 50479 1 905 . 1 . 1 208 208 THR C C 13 173.7500 0.3 . 1 . . . . . 208 THR C . 50479 1 906 . 1 . 1 208 208 THR CA C 13 61.3700 0.3 . 1 . . . . . 208 THR CA . 50479 1 907 . 1 . 1 208 208 THR CB C 13 69.2000 0.3 . 1 . . . . . 208 THR CB . 50479 1 908 . 1 . 1 208 208 THR N N 15 114.7900 0.2 . 1 . . . . . 208 THR N . 50479 1 909 . 1 . 1 209 209 ARG H H 1 8.1010 0.04 . 1 . . . . . 209 ARG HN . 50479 1 910 . 1 . 1 209 209 ARG C C 13 175.9900 0.3 . 1 . . . . . 209 ARG C . 50479 1 911 . 1 . 1 209 209 ARG CA C 13 56.1300 0.3 . 1 . . . . . 209 ARG CA . 50479 1 912 . 1 . 1 209 209 ARG CB C 13 29.2900 0.3 . 1 . . . . . 209 ARG CB . 50479 1 913 . 1 . 1 209 209 ARG N N 15 123.6100 0.2 . 1 . . . . . 209 ARG N . 50479 1 914 . 1 . 1 210 210 HIS H H 1 8.1330 0.04 . 1 . . . . . 210 HIS HN . 50479 1 915 . 1 . 1 210 210 HIS C C 13 174.3300 0.3 . 1 . . . . . 210 HIS C . 50479 1 916 . 1 . 1 210 210 HIS CA C 13 55.0500 0.3 . 1 . . . . . 210 HIS CA . 50479 1 917 . 1 . 1 210 210 HIS CB C 13 29.2900 0.3 . 1 . . . . . 210 HIS CB . 50479 1 918 . 1 . 1 210 210 HIS N N 15 119.9600 0.2 . 1 . . . . . 210 HIS N . 50479 1 919 . 1 . 1 211 211 PHE H H 1 8.1250 0.04 . 1 . . . . . 211 PHE HN . 50479 1 920 . 1 . 1 211 211 PHE C C 13 175.2900 0.3 . 1 . . . . . 211 PHE C . 50479 1 921 . 1 . 1 211 211 PHE CA C 13 56.8500 0.3 . 1 . . . . . 211 PHE CA . 50479 1 922 . 1 . 1 211 211 PHE CB C 13 38.9900 0.3 . 1 . . . . . 211 PHE CB . 50479 1 923 . 1 . 1 211 211 PHE N N 15 121.3800 0.2 . 1 . . . . . 211 PHE N . 50479 1 924 . 1 . 1 212 212 THR H H 1 7.9530 0.04 . 1 . . . . . 212 THR HN . 50479 1 925 . 1 . 1 212 212 THR C C 13 173.4200 0.3 . 1 . . . . . 212 THR C . 50479 1 926 . 1 . 1 212 212 THR CA C 13 61.2200 0.3 . 1 . . . . . 212 THR CA . 50479 1 927 . 1 . 1 212 212 THR CB C 13 69.6600 0.3 . 1 . . . . . 212 THR CB . 50479 1 928 . 1 . 1 212 212 THR N N 15 115.7800 0.2 . 1 . . . . . 212 THR N . 50479 1 929 . 1 . 1 213 213 MET H H 1 7.9070 0.04 . 1 . . . . . 213 MET HN . 50479 1 930 . 1 . 1 213 213 MET C C 13 180.6500 0.3 . 1 . . . . . 213 MET C . 50479 1 931 . 1 . 1 213 213 MET CA C 13 56.9000 0.3 . 1 . . . . . 213 MET CA . 50479 1 932 . 1 . 1 213 213 MET CB C 13 33.0800 0.3 . 1 . . . . . 213 MET CB . 50479 1 933 . 1 . 1 213 213 MET N N 15 127.9300 0.2 . 1 . . . . . 213 MET N . 50479 1 stop_ save_