data_50921 ####################### # Entry information # ####################### save_entry_information_1 _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information_1 _Entry.ID 50921 _Entry.Title ; Backbone resonance assignment of human HEBP2 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2021-05-05 _Entry.Accession_date 2021-05-05 _Entry.Last_release_date 2021-05-05 _Entry.Original_release_date 2021-05-05 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.14.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details 'Backbone resonance assignment of human HEBP2' _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 Filipe Freire . . . . 50921 2 Susana Aveiro . S. . . 50921 3 Leonildo Delgado . . . . 50921 4 Joao Rodrigues . E. . . 50921 5 Brian Goodfellow . J. . . 50921 6 Anjos Macedo . L. . . 50921 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . 'Departamento de Quimica, Universidade Nova de Lisboa, Portugal' . 50921 2 . 'Departamento de Quimica, Universidade de Aveiro, Portugal' . 50921 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 50921 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 460 50921 '15N chemical shifts' 169 50921 '1H chemical shifts' 169 50921 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2022-05-30 . original BMRB . 50921 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 50917 'human HEBP1' 50921 stop_ save_ ############### # Citations # ############### save_citations_2 _Citation.Sf_category citations _Citation.Sf_framecode citations_2 _Citation.Entry_ID 50921 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID . _Citation.DOI 10.1016/j.ccr.2021.214189 _Citation.Full_citation . _Citation.Title ; The SOUL family of heme-binding proteins: Structure and function 15 years later ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Coord. Chem. Rev.' _Citation.Journal_name_full . _Citation.Journal_volume 448 _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 214189 _Citation.Page_last 214189 _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 B. Goodfellow B. J. . . 50921 1 2 F. Freire F. . . . 50921 1 3 A. Carvalho A. L. . . 50921 1 4 S. Aveiro S. S. . . 50921 1 5 P. Charbonnier P. . . . 50921 1 6 J. Moulis J. M. . . 50921 1 7 L. Delgado L. . . . 50921 1 8 G. Ferreira G. C. . . 50921 1 9 J. Rodrigues J. E. . . 50921 1 10 P. Poussin-Courmontagne P. . . . 50921 1 11 C. Birck C. . . . 50921 1 12 A. McEwen A. . . . 50921 1 13 A. Macedo A. L. . . 50921 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly_1 _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly_1 _Assembly.Entry_ID 50921 _Assembly.ID 1 _Assembly.Name hHEBP2 _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 23141 _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 hHEBP2 1 $entity_1 . . yes native no no 1 . . 50921 1 stop_ loop_ _Assembly_bio_function.Biological_function _Assembly_bio_function.Entry_ID _Assembly_bio_function.Assembly_ID 'heme binding protein' 50921 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 50921 _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 ; AGHMAEPLQPDPGAAEDAAA QAVETPGWKAPEDAGPQPGS YEIRHYGPAKWVSTSVESMD WDSAIQTGFTKLNSYIQGKN EKEMKIKMTAPVTSYVEPGS GPFSESTITISLYIPSEQQF DPPRPLESDVFIEDRAEMTV FVRSFDGFSSAQKNQEQLLT LASILREDGKVFDEKVYYTA GYNSPVKLLNRNNEVWLIQK NEPTKENE ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq A(-2)G(-1)H(0)M(1)A(2)..... _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 208 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 23141 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 yes UniProt Q9Y5Z4 . 'heme-binding protein 2 [Homo spaiens]' . . . . . . . . . . . . . . 50921 1 stop_ loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID 'heme binding protein' 50921 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 -2 ALA . 50921 1 2 -1 GLY . 50921 1 3 0 HIS . 50921 1 4 1 MET . 50921 1 5 2 ALA . 50921 1 6 3 GLU . 50921 1 7 4 PRO . 50921 1 8 5 LEU . 50921 1 9 6 GLN . 50921 1 10 7 PRO . 50921 1 11 8 ASP . 50921 1 12 9 PRO . 50921 1 13 10 GLY . 50921 1 14 11 ALA . 50921 1 15 12 ALA . 50921 1 16 13 GLU . 50921 1 17 14 ASP . 50921 1 18 15 ALA . 50921 1 19 16 ALA . 50921 1 20 17 ALA . 50921 1 21 18 GLN . 50921 1 22 19 ALA . 50921 1 23 20 VAL . 50921 1 24 21 GLU . 50921 1 25 22 THR . 50921 1 26 23 PRO . 50921 1 27 24 GLY . 50921 1 28 25 TRP . 50921 1 29 26 LYS . 50921 1 30 27 ALA . 50921 1 31 28 PRO . 50921 1 32 29 GLU . 50921 1 33 30 ASP . 50921 1 34 31 ALA . 50921 1 35 32 GLY . 50921 1 36 33 PRO . 50921 1 37 34 GLN . 50921 1 38 35 PRO . 50921 1 39 36 GLY . 50921 1 40 37 SER . 50921 1 41 38 TYR . 50921 1 42 39 GLU . 50921 1 43 40 ILE . 50921 1 44 41 ARG . 50921 1 45 42 HIS . 50921 1 46 43 TYR . 50921 1 47 44 GLY . 50921 1 48 45 PRO . 50921 1 49 46 ALA . 50921 1 50 47 LYS . 50921 1 51 48 TRP . 50921 1 52 49 VAL . 50921 1 53 50 SER . 50921 1 54 51 THR . 50921 1 55 52 SER . 50921 1 56 53 VAL . 50921 1 57 54 GLU . 50921 1 58 55 SER . 50921 1 59 56 MET . 50921 1 60 57 ASP . 50921 1 61 58 TRP . 50921 1 62 59 ASP . 50921 1 63 60 SER . 50921 1 64 61 ALA . 50921 1 65 62 ILE . 50921 1 66 63 GLN . 50921 1 67 64 THR . 50921 1 68 65 GLY . 50921 1 69 66 PHE . 50921 1 70 67 THR . 50921 1 71 68 LYS . 50921 1 72 69 LEU . 50921 1 73 70 ASN . 50921 1 74 71 SER . 50921 1 75 72 TYR . 50921 1 76 73 ILE . 50921 1 77 74 GLN . 50921 1 78 75 GLY . 50921 1 79 76 LYS . 50921 1 80 77 ASN . 50921 1 81 78 GLU . 50921 1 82 79 LYS . 50921 1 83 80 GLU . 50921 1 84 81 MET . 50921 1 85 82 LYS . 50921 1 86 83 ILE . 50921 1 87 84 LYS . 50921 1 88 85 MET . 50921 1 89 86 THR . 50921 1 90 87 ALA . 50921 1 91 88 PRO . 50921 1 92 89 VAL . 50921 1 93 90 THR . 50921 1 94 91 SER . 50921 1 95 92 TYR . 50921 1 96 93 VAL . 50921 1 97 94 GLU . 50921 1 98 95 PRO . 50921 1 99 96 GLY . 50921 1 100 97 SER . 50921 1 101 98 GLY . 50921 1 102 99 PRO . 50921 1 103 100 PHE . 50921 1 104 101 SER . 50921 1 105 102 GLU . 50921 1 106 103 SER . 50921 1 107 104 THR . 50921 1 108 105 ILE . 50921 1 109 106 THR . 50921 1 110 107 ILE . 50921 1 111 108 SER . 50921 1 112 109 LEU . 50921 1 113 110 TYR . 50921 1 114 111 ILE . 50921 1 115 112 PRO . 50921 1 116 113 SER . 50921 1 117 114 GLU . 50921 1 118 115 GLN . 50921 1 119 116 GLN . 50921 1 120 117 PHE . 50921 1 121 118 ASP . 50921 1 122 119 PRO . 50921 1 123 120 PRO . 50921 1 124 121 ARG . 50921 1 125 122 PRO . 50921 1 126 123 LEU . 50921 1 127 124 GLU . 50921 1 128 125 SER . 50921 1 129 126 ASP . 50921 1 130 127 VAL . 50921 1 131 128 PHE . 50921 1 132 129 ILE . 50921 1 133 130 GLU . 50921 1 134 131 ASP . 50921 1 135 132 ARG . 50921 1 136 133 ALA . 50921 1 137 134 GLU . 50921 1 138 135 MET . 50921 1 139 136 THR . 50921 1 140 137 VAL . 50921 1 141 138 PHE . 50921 1 142 139 VAL . 50921 1 143 140 ARG . 50921 1 144 141 SER . 50921 1 145 142 PHE . 50921 1 146 143 ASP . 50921 1 147 144 GLY . 50921 1 148 145 PHE . 50921 1 149 146 SER . 50921 1 150 147 SER . 50921 1 151 148 ALA . 50921 1 152 149 GLN . 50921 1 153 150 LYS . 50921 1 154 151 ASN . 50921 1 155 152 GLN . 50921 1 156 153 GLU . 50921 1 157 154 GLN . 50921 1 158 155 LEU . 50921 1 159 156 LEU . 50921 1 160 157 THR . 50921 1 161 158 LEU . 50921 1 162 159 ALA . 50921 1 163 160 SER . 50921 1 164 161 ILE . 50921 1 165 162 LEU . 50921 1 166 163 ARG . 50921 1 167 164 GLU . 50921 1 168 165 ASP . 50921 1 169 166 GLY . 50921 1 170 167 LYS . 50921 1 171 168 VAL . 50921 1 172 169 PHE . 50921 1 173 170 ASP . 50921 1 174 171 GLU . 50921 1 175 172 LYS . 50921 1 176 173 VAL . 50921 1 177 174 TYR . 50921 1 178 175 TYR . 50921 1 179 176 THR . 50921 1 180 177 ALA . 50921 1 181 178 GLY . 50921 1 182 179 TYR . 50921 1 183 180 ASN . 50921 1 184 181 SER . 50921 1 185 182 PRO . 50921 1 186 183 VAL . 50921 1 187 184 LYS . 50921 1 188 185 LEU . 50921 1 189 186 LEU . 50921 1 190 187 ASN . 50921 1 191 188 ARG . 50921 1 192 189 ASN . 50921 1 193 190 ASN . 50921 1 194 191 GLU . 50921 1 195 192 VAL . 50921 1 196 193 TRP . 50921 1 197 194 LEU . 50921 1 198 195 ILE . 50921 1 199 196 GLN . 50921 1 200 197 LYS . 50921 1 201 198 ASN . 50921 1 202 199 GLU . 50921 1 203 200 PRO . 50921 1 204 201 THR . 50921 1 205 202 LYS . 50921 1 206 203 GLU . 50921 1 207 204 ASN . 50921 1 208 205 GLU . 50921 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . ALA 1 1 50921 1 . GLY 2 2 50921 1 . HIS 3 3 50921 1 . MET 4 4 50921 1 . ALA 5 5 50921 1 . GLU 6 6 50921 1 . PRO 7 7 50921 1 . LEU 8 8 50921 1 . GLN 9 9 50921 1 . PRO 10 10 50921 1 . ASP 11 11 50921 1 . PRO 12 12 50921 1 . GLY 13 13 50921 1 . ALA 14 14 50921 1 . ALA 15 15 50921 1 . GLU 16 16 50921 1 . ASP 17 17 50921 1 . ALA 18 18 50921 1 . ALA 19 19 50921 1 . ALA 20 20 50921 1 . GLN 21 21 50921 1 . ALA 22 22 50921 1 . VAL 23 23 50921 1 . GLU 24 24 50921 1 . THR 25 25 50921 1 . PRO 26 26 50921 1 . GLY 27 27 50921 1 . TRP 28 28 50921 1 . LYS 29 29 50921 1 . ALA 30 30 50921 1 . PRO 31 31 50921 1 . GLU 32 32 50921 1 . ASP 33 33 50921 1 . ALA 34 34 50921 1 . GLY 35 35 50921 1 . PRO 36 36 50921 1 . GLN 37 37 50921 1 . PRO 38 38 50921 1 . GLY 39 39 50921 1 . SER 40 40 50921 1 . TYR 41 41 50921 1 . GLU 42 42 50921 1 . ILE 43 43 50921 1 . ARG 44 44 50921 1 . HIS 45 45 50921 1 . TYR 46 46 50921 1 . GLY 47 47 50921 1 . PRO 48 48 50921 1 . ALA 49 49 50921 1 . LYS 50 50 50921 1 . TRP 51 51 50921 1 . VAL 52 52 50921 1 . SER 53 53 50921 1 . THR 54 54 50921 1 . SER 55 55 50921 1 . VAL 56 56 50921 1 . GLU 57 57 50921 1 . SER 58 58 50921 1 . MET 59 59 50921 1 . ASP 60 60 50921 1 . TRP 61 61 50921 1 . ASP 62 62 50921 1 . SER 63 63 50921 1 . ALA 64 64 50921 1 . ILE 65 65 50921 1 . GLN 66 66 50921 1 . THR 67 67 50921 1 . GLY 68 68 50921 1 . PHE 69 69 50921 1 . THR 70 70 50921 1 . LYS 71 71 50921 1 . LEU 72 72 50921 1 . ASN 73 73 50921 1 . SER 74 74 50921 1 . TYR 75 75 50921 1 . ILE 76 76 50921 1 . GLN 77 77 50921 1 . GLY 78 78 50921 1 . LYS 79 79 50921 1 . ASN 80 80 50921 1 . GLU 81 81 50921 1 . LYS 82 82 50921 1 . GLU 83 83 50921 1 . MET 84 84 50921 1 . LYS 85 85 50921 1 . ILE 86 86 50921 1 . LYS 87 87 50921 1 . MET 88 88 50921 1 . THR 89 89 50921 1 . ALA 90 90 50921 1 . PRO 91 91 50921 1 . VAL 92 92 50921 1 . THR 93 93 50921 1 . SER 94 94 50921 1 . TYR 95 95 50921 1 . VAL 96 96 50921 1 . GLU 97 97 50921 1 . PRO 98 98 50921 1 . GLY 99 99 50921 1 . SER 100 100 50921 1 . GLY 101 101 50921 1 . PRO 102 102 50921 1 . PHE 103 103 50921 1 . SER 104 104 50921 1 . GLU 105 105 50921 1 . SER 106 106 50921 1 . THR 107 107 50921 1 . ILE 108 108 50921 1 . THR 109 109 50921 1 . ILE 110 110 50921 1 . SER 111 111 50921 1 . LEU 112 112 50921 1 . TYR 113 113 50921 1 . ILE 114 114 50921 1 . PRO 115 115 50921 1 . SER 116 116 50921 1 . GLU 117 117 50921 1 . GLN 118 118 50921 1 . GLN 119 119 50921 1 . PHE 120 120 50921 1 . ASP 121 121 50921 1 . PRO 122 122 50921 1 . PRO 123 123 50921 1 . ARG 124 124 50921 1 . PRO 125 125 50921 1 . LEU 126 126 50921 1 . GLU 127 127 50921 1 . SER 128 128 50921 1 . ASP 129 129 50921 1 . VAL 130 130 50921 1 . PHE 131 131 50921 1 . ILE 132 132 50921 1 . GLU 133 133 50921 1 . ASP 134 134 50921 1 . ARG 135 135 50921 1 . ALA 136 136 50921 1 . GLU 137 137 50921 1 . MET 138 138 50921 1 . THR 139 139 50921 1 . VAL 140 140 50921 1 . PHE 141 141 50921 1 . VAL 142 142 50921 1 . ARG 143 143 50921 1 . SER 144 144 50921 1 . PHE 145 145 50921 1 . ASP 146 146 50921 1 . GLY 147 147 50921 1 . PHE 148 148 50921 1 . SER 149 149 50921 1 . SER 150 150 50921 1 . ALA 151 151 50921 1 . GLN 152 152 50921 1 . LYS 153 153 50921 1 . ASN 154 154 50921 1 . GLN 155 155 50921 1 . GLU 156 156 50921 1 . GLN 157 157 50921 1 . LEU 158 158 50921 1 . LEU 159 159 50921 1 . THR 160 160 50921 1 . LEU 161 161 50921 1 . ALA 162 162 50921 1 . SER 163 163 50921 1 . ILE 164 164 50921 1 . LEU 165 165 50921 1 . ARG 166 166 50921 1 . GLU 167 167 50921 1 . ASP 168 168 50921 1 . GLY 169 169 50921 1 . LYS 170 170 50921 1 . VAL 171 171 50921 1 . PHE 172 172 50921 1 . ASP 173 173 50921 1 . GLU 174 174 50921 1 . LYS 175 175 50921 1 . VAL 176 176 50921 1 . TYR 177 177 50921 1 . TYR 178 178 50921 1 . THR 179 179 50921 1 . ALA 180 180 50921 1 . GLY 181 181 50921 1 . TYR 182 182 50921 1 . ASN 183 183 50921 1 . SER 184 184 50921 1 . PRO 185 185 50921 1 . VAL 186 186 50921 1 . LYS 187 187 50921 1 . LEU 188 188 50921 1 . LEU 189 189 50921 1 . ASN 190 190 50921 1 . ARG 191 191 50921 1 . ASN 192 192 50921 1 . ASN 193 193 50921 1 . GLU 194 194 50921 1 . VAL 195 195 50921 1 . TRP 196 196 50921 1 . LEU 197 197 50921 1 . ILE 198 198 50921 1 . GLN 199 199 50921 1 . LYS 200 200 50921 1 . ASN 201 201 50921 1 . GLU 202 202 50921 1 . PRO 203 203 50921 1 . THR 204 204 50921 1 . LYS 205 205 50921 1 . GLU 206 206 50921 1 . ASN 207 207 50921 1 . GLU 208 208 50921 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 50921 _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 . . . . . . . . . . . . . 50921 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 50921 _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 BL21 . . plasmid . . hSOUL-pTYB12 . . . 50921 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 50921 _Sample.ID 1 _Sample.Name '15N 13C 99%' _Sample.Type solution _Sample.Sub_type . _Sample.Details '50mM phosphate buffer, pH 8.0' _Sample.Aggregate_sample_number 1 _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'phosphate buffer' 'natural abundance' . . . . . . 50 . . mM . . . . 50921 1 2 hHEBP2 '[U-99% 13C; U-99% 15N]' . . 1 $entity_1 . . 1 . . mM . . . . 50921 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 50921 _Sample.ID 2 _Sample.Name '15N 99%' _Sample.Type solution _Sample.Sub_type . _Sample.Details '50mM phosphate buffer, pH 8.0' _Sample.Aggregate_sample_number 2 _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'phosphate buffer' 'natural abundance' . . . . . . 50 . . mM . . . . 50921 2 2 hHEBP2 '[U-99% 15N]' . . 1 $entity_1 . . 1 . . mM . . . . 50921 2 stop_ save_ save_sample_3 _Sample.Sf_category sample _Sample.Sf_framecode sample_3 _Sample.Entry_ID 50921 _Sample.ID 3 _Sample.Name '15N 13C 2H 99%' _Sample.Type solution _Sample.Sub_type . _Sample.Details '50mM phosphate buffer, pH 8.0' _Sample.Aggregate_sample_number 3 _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'phosphate buffer' 'natural abundance' . . . . . . 50 . . mM . . . . 50921 3 2 hHEBP2 '[U-13C; U-15N; U-2H]' . . 1 $entity_1 . . 1 . . mM . . . . 50921 3 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 50921 _Sample_condition_list.ID 1 _Sample_condition_list.Name 'conditions 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' 0.1 0.05 M 50921 1 pH 8.0 0.01 pH 50921 1 temperature 303 0.1 K 50921 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 50921 _Software.ID 1 _Software.Type . _Software.Name NMRPipe _Software.Version . _Software.DOI . _Software.Details ; nmr data processing. F. Delaglio, S. Grzesiek, G.: J. Biomol. NMR, 6, (1995) 277-293. ; loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'nmr data processing' . 50921 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 50921 _Software.ID 2 _Software.Type . _Software.Name XEASY _Software.Version . _Software.DOI . _Software.Details ; resonance assignment. Bartels, C., Xia, T., Billeter, M., Guntert, P. & Wuthrich, K. (1995); J. Biomol. NMR,6, 1-10. ; loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'resonance assignment' . 50921 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 50921 _Software.ID 3 _Software.Type . _Software.Name TOPSPIN _Software.Version 3.7 _Software.DOI . _Software.Details 'nmr data acquisition and processing' loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'data acquisition and processing' . 50921 3 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID 50921 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name '600MHz spectrometer' _NMR_spectrometer.Details 'with cryoprobe' _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE III' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600MHz 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 50921 _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 1H15N HSQC' no . . . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50921 1 2 '2D 1H15N TROSY' no . . . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50921 1 3 '3D trHNCACB' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50921 1 4 '3D trHNCOCACB' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50921 1 5 '3D trHNCA' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50921 1 6 '3D trHNCOCA' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50921 1 7 '3D 15N HSQC-NOESY' no . . . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50921 1 8 '3D 15N HSQC-TOCSY' no . . . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50921 1 9 '3D trHNCO' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50921 1 10 '3D trHNCACO' no . . . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 50921 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 50921 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name 'chemical shift referencing' _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 0.0 internal indirect . . . . . . 50921 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 internal direct 1 . . . . . 50921 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 internal indirect . . . . . . 50921 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 50921 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name 'chem shift list 1' _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err 0.05 _Assigned_chem_shift_list.Chem_shift_13C_err 0.15 _Assigned_chem_shift_list.Chem_shift_15N_err 0.15 _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H15N HSQC' . . . 50921 1 2 '2D 1H15N TROSY' . . . 50921 1 3 '3D trHNCACB' . . . 50921 1 4 '3D trHNCOCACB' . . . 50921 1 5 '3D trHNCA' . . . 50921 1 6 '3D trHNCOCA' . . . 50921 1 7 '3D 15N HSQC-NOESY' . . . 50921 1 8 '3D 15N HSQC-TOCSY' . . . 50921 1 9 '3D trHNCO' . . . 50921 1 10 '3D trHNCACO' . . . 50921 1 stop_ loop_ _Systematic_chem_shift_offset.Type _Systematic_chem_shift_offset.Atom_type _Systematic_chem_shift_offset.Atom_isotope_number _Systematic_chem_shift_offset.Val _Systematic_chem_shift_offset.Val_err _Systematic_chem_shift_offset.Entry_ID _Systematic_chem_shift_offset.Assigned_chem_shift_list_ID 'TROSY effect' N . 0.714 . 50921 1 'TROSY effect' H . -0.066 . 50921 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 . . 50921 1 2 $software_2 . . 50921 1 3 $software_3 . . 50921 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 4 4 MET C C 13 173.434 0.20 . 1 . . . . . 1 MET C . 50921 1 2 . 1 . 1 5 5 ALA H H 1 8.158 0.02 . 1 . . . . . 2 ALA H . 50921 1 3 . 1 . 1 5 5 ALA C C 13 177.046 0.20 . 1 . . . . . 2 ALA C . 50921 1 4 . 1 . 1 5 5 ALA CA C 13 50.900 0.200 . 1 . . . . . 2 ALA CA . 50921 1 5 . 1 . 1 5 5 ALA CB C 13 17.800 0.200 . 1 . . . . . 2 ALA CB . 50921 1 6 . 1 . 1 5 5 ALA N N 15 125.151 0.20 . 1 . . . . . 2 ALA N . 50921 1 7 . 1 . 1 6 6 GLU H H 1 8.117 0.02 . 1 . . . . . 3 GLU H . 50921 1 8 . 1 . 1 6 6 GLU N N 15 122.221 0.20 . 1 . . . . . 3 GLU N . 50921 1 9 . 1 . 1 7 7 PRO C C 13 176.488 0.20 . 1 . . . . . 4 PRO C . 50921 1 10 . 1 . 1 7 7 PRO CA C 13 61.800 0.200 . 1 . . . . . 4 PRO CA . 50921 1 11 . 1 . 1 8 8 LEU H H 1 8.138 0.02 . 1 . . . . . 5 LEU H . 50921 1 12 . 1 . 1 8 8 LEU C C 13 176.979 0.20 . 1 . . . . . 5 LEU C . 50921 1 13 . 1 . 1 8 8 LEU CA C 13 54.000 0.200 . 1 . . . . . 5 LEU CA . 50921 1 14 . 1 . 1 8 8 LEU CB C 13 40.400 0.200 . 1 . . . . . 5 LEU CB . 50921 1 15 . 1 . 1 8 8 LEU N N 15 122.893 0.20 . 1 . . . . . 5 LEU N . 50921 1 16 . 1 . 1 9 9 GLN H H 1 8.178 0.02 . 1 . . . . . 6 GLN H . 50921 1 17 . 1 . 1 9 9 GLN N N 15 122.651 0.20 . 1 . . . . . 6 GLN N . 50921 1 18 . 1 . 1 12 12 PRO C C 13 177.402 0.20 . 1 . . . . . 9 PRO C . 50921 1 19 . 1 . 1 12 12 PRO CA C 13 61.500 0.200 . 1 . . . . . 9 PRO CA . 50921 1 20 . 1 . 1 13 13 GLY H H 1 8.411 0.02 . 1 . . . . . 10 GLY H . 50921 1 21 . 1 . 1 13 13 GLY C C 13 173.946 0.20 . 1 . . . . . 10 GLY C . 50921 1 22 . 1 . 1 13 13 GLY CA C 13 44.100 0.200 . 1 . . . . . 10 GLY CA . 50921 1 23 . 1 . 1 13 13 GLY N N 15 111.362 0.20 . 1 . . . . . 10 GLY N . 50921 1 24 . 1 . 1 14 14 ALA H H 1 7.767 0.02 . 1 . . . . . 11 ALA H . 50921 1 25 . 1 . 1 14 14 ALA C C 13 177.603 0.20 . 1 . . . . . 11 ALA C . 50921 1 26 . 1 . 1 14 14 ALA CA C 13 51.500 0.200 . 1 . . . . . 11 ALA CA . 50921 1 27 . 1 . 1 14 14 ALA CB C 13 17.800 0.200 . 1 . . . . . 11 ALA CB . 50921 1 28 . 1 . 1 14 14 ALA N N 15 124.291 0.20 . 1 . . . . . 11 ALA N . 50921 1 29 . 1 . 1 15 15 ALA H H 1 8.041 0.02 . 1 . . . . . 12 ALA H . 50921 1 30 . 1 . 1 15 15 ALA C C 13 178.004 0.20 . 1 . . . . . 12 ALA C . 50921 1 31 . 1 . 1 15 15 ALA CA C 13 51.600 0.200 . 1 . . . . . 12 ALA CA . 50921 1 32 . 1 . 1 15 15 ALA CB C 13 17.600 0.200 . 1 . . . . . 12 ALA CB . 50921 1 33 . 1 . 1 15 15 ALA N N 15 123.627 0.20 . 1 . . . . . 12 ALA N . 50921 1 34 . 1 . 1 16 16 GLU H H 1 8.210 0.02 . 1 . . . . . 13 GLU H . 50921 1 35 . 1 . 1 16 16 GLU C C 13 176.354 0.20 . 1 . . . . . 13 GLU C . 50921 1 36 . 1 . 1 16 16 GLU CA C 13 55.800 0.200 . 1 . . . . . 13 GLU CA . 50921 1 37 . 1 . 1 16 16 GLU CB C 13 28.500 0.200 . 1 . . . . . 13 GLU CB . 50921 1 38 . 1 . 1 16 16 GLU N N 15 120.517 0.20 . 1 . . . . . 13 GLU N . 50921 1 39 . 1 . 1 17 17 ASP H H 1 8.117 0.02 . 1 . . . . . 14 ASP H . 50921 1 40 . 1 . 1 17 17 ASP C C 13 176.421 0.20 . 1 . . . . . 14 ASP C . 50921 1 41 . 1 . 1 17 17 ASP CA C 13 53.300 0.200 . 1 . . . . . 14 ASP CA . 50921 1 42 . 1 . 1 17 17 ASP CB C 13 39.700 0.200 . 1 . . . . . 14 ASP CB . 50921 1 43 . 1 . 1 17 17 ASP N N 15 121.751 0.20 . 1 . . . . . 14 ASP N . 50921 1 44 . 1 . 1 18 18 ALA H H 1 8.048 0.02 . 1 . . . . . 15 ALA H . 50921 1 45 . 1 . 1 18 18 ALA C C 13 178.160 0.20 . 1 . . . . . 15 ALA C . 50921 1 46 . 1 . 1 18 18 ALA CA C 13 52.200 0.200 . 1 . . . . . 15 ALA CA . 50921 1 47 . 1 . 1 18 18 ALA CB C 13 17.400 0.200 . 1 . . . . . 15 ALA CB . 50921 1 48 . 1 . 1 18 18 ALA N N 15 125.190 0.20 . 1 . . . . . 15 ALA N . 50921 1 49 . 1 . 1 19 19 ALA H H 1 7.993 0.02 . 1 . . . . . 16 ALA H . 50921 1 50 . 1 . 1 19 19 ALA C C 13 178.004 0.20 . 1 . . . . . 16 ALA C . 50921 1 51 . 1 . 1 19 19 ALA CA C 13 51.800 0.200 . 1 . . . . . 16 ALA CA . 50921 1 52 . 1 . 1 19 19 ALA N N 15 122.182 0.20 . 1 . . . . . 16 ALA N . 50921 1 53 . 1 . 1 20 20 ALA H H 1 7.781 0.02 . 1 . . . . . 17 ALA H . 50921 1 54 . 1 . 1 20 20 ALA C C 13 177.781 0.20 . 1 . . . . . 17 ALA C . 50921 1 55 . 1 . 1 20 20 ALA CA C 13 52.000 0.200 . 1 . . . . . 17 ALA CA . 50921 1 56 . 1 . 1 20 20 ALA CB C 13 17.500 0.200 . 1 . . . . . 17 ALA CB . 50921 1 57 . 1 . 1 20 20 ALA N N 15 122.495 0.20 . 1 . . . . . 17 ALA N . 50921 1 58 . 1 . 1 21 21 GLN H H 1 7.870 0.02 . 1 . . . . . 18 GLN H . 50921 1 59 . 1 . 1 21 21 GLN CA C 13 54.500 0.200 . 1 . . . . . 18 GLN CA . 50921 1 60 . 1 . 1 21 21 GLN N N 15 118.627 0.20 . 1 . . . . . 18 GLN N . 50921 1 61 . 1 . 1 22 22 ALA C C 13 177.179 0.20 . 1 . . . . . 19 ALA C . 50921 1 62 . 1 . 1 22 22 ALA CA C 13 51.600 0.200 . 1 . . . . . 19 ALA CA . 50921 1 63 . 1 . 1 22 22 ALA CB C 13 17.600 0.200 . 1 . . . . . 19 ALA CB . 50921 1 64 . 1 . 1 23 23 VAL H H 1 7.740 0.02 . 1 . . . . . 20 VAL H . 50921 1 65 . 1 . 1 23 23 VAL C C 13 174.905 0.20 . 1 . . . . . 20 VAL C . 50921 1 66 . 1 . 1 23 23 VAL CA C 13 60.800 0.200 . 1 . . . . . 20 VAL CA . 50921 1 67 . 1 . 1 23 23 VAL CB C 13 31.700 0.200 . 1 . . . . . 20 VAL CB . 50921 1 68 . 1 . 1 23 23 VAL N N 15 121.088 0.20 . 1 . . . . . 20 VAL N . 50921 1 69 . 1 . 1 24 24 GLU H H 1 8.665 0.02 . 1 . . . . . 21 GLU H . 50921 1 70 . 1 . 1 24 24 GLU C C 13 174.058 0.20 . 1 . . . . . 21 GLU C . 50921 1 71 . 1 . 1 24 24 GLU CA C 13 55.900 0.200 . 1 . . . . . 21 GLU CA . 50921 1 72 . 1 . 1 24 24 GLU CB C 13 29.900 0.200 . 1 . . . . . 21 GLU CB . 50921 1 73 . 1 . 1 24 24 GLU N N 15 128.979 0.20 . 1 . . . . . 21 GLU N . 50921 1 74 . 1 . 1 25 25 THR H H 1 7.644 0.02 . 1 . . . . . 22 THR H . 50921 1 75 . 1 . 1 25 25 THR CB C 13 70.000 0.200 . 1 . . . . . 22 THR CB . 50921 1 76 . 1 . 1 25 25 THR N N 15 112.612 0.20 . 1 . . . . . 22 THR N . 50921 1 77 . 1 . 1 26 26 PRO C C 13 177.581 0.20 . 1 . . . . . 23 PRO C . 50921 1 78 . 1 . 1 26 26 PRO CA C 13 62.800 0.200 . 1 . . . . . 23 PRO CA . 50921 1 79 . 1 . 1 27 27 GLY H H 1 8.329 0.02 . 1 . . . . . 24 GLY H . 50921 1 80 . 1 . 1 27 27 GLY C C 13 172.408 0.20 . 1 . . . . . 24 GLY C . 50921 1 81 . 1 . 1 27 27 GLY CA C 13 44.100 0.200 . 1 . . . . . 24 GLY CA . 50921 1 82 . 1 . 1 27 27 GLY N N 15 109.018 0.20 . 1 . . . . . 24 GLY N . 50921 1 83 . 1 . 1 28 28 TRP H H 1 7.329 0.02 . 1 . . . . . 25 TRP H . 50921 1 84 . 1 . 1 28 28 TRP C C 13 174.058 0.20 . 1 . . . . . 25 TRP C . 50921 1 85 . 1 . 1 28 28 TRP CA C 13 54.000 0.200 . 1 . . . . . 25 TRP CA . 50921 1 86 . 1 . 1 28 28 TRP CB C 13 29.100 0.200 . 1 . . . . . 25 TRP CB . 50921 1 87 . 1 . 1 28 28 TRP N N 15 118.002 0.20 . 1 . . . . . 25 TRP N . 50921 1 88 . 1 . 1 29 29 LYS H H 1 8.546 0.02 . 1 . . . . . 26 LYS H . 50921 1 89 . 1 . 1 29 29 LYS C C 13 175.440 0.20 . 1 . . . . . 26 LYS C . 50921 1 90 . 1 . 1 29 29 LYS CA C 13 53.300 0.200 . 1 . . . . . 26 LYS CA . 50921 1 91 . 1 . 1 29 29 LYS CE C 13 42.100 0.200 . 1 . . . . . 26 LYS CE . 50921 1 92 . 1 . 1 29 29 LYS N N 15 118.751 0.20 . 1 . . . . . 26 LYS N . 50921 1 93 . 1 . 1 30 30 ALA H H 1 8.671 0.02 . 1 . . . . . 27 ALA H . 50921 1 94 . 1 . 1 30 30 ALA N N 15 128.159 0.20 . 1 . . . . . 27 ALA N . 50921 1 95 . 1 . 1 32 32 GLU C C 13 176.265 0.20 . 1 . . . . . 29 GLU C . 50921 1 96 . 1 . 1 32 32 GLU CA C 13 56.300 0.200 . 1 . . . . . 29 GLU CA . 50921 1 97 . 1 . 1 33 33 ASP H H 1 8.171 0.02 . 1 . . . . . 30 ASP H . 50921 1 98 . 1 . 1 33 33 ASP C C 13 175.529 0.20 . 1 . . . . . 30 ASP C . 50921 1 99 . 1 . 1 33 33 ASP CA C 13 52.800 0.200 . 1 . . . . . 30 ASP CA . 50921 1 100 . 1 . 1 33 33 ASP CB C 13 39.300 0.200 . 1 . . . . . 30 ASP CB . 50921 1 101 . 1 . 1 33 33 ASP N N 15 119.096 0.20 . 1 . . . . . 30 ASP N . 50921 1 102 . 1 . 1 34 34 ALA H H 1 7.781 0.02 . 1 . . . . . 31 ALA H . 50921 1 103 . 1 . 1 34 34 ALA C C 13 177.826 0.20 . 1 . . . . . 31 ALA C . 50921 1 104 . 1 . 1 34 34 ALA CA C 13 51.500 0.200 . 1 . . . . . 31 ALA CA . 50921 1 105 . 1 . 1 34 34 ALA CB C 13 18.000 0.200 . 1 . . . . . 31 ALA CB . 50921 1 106 . 1 . 1 34 34 ALA N N 15 123.393 0.20 . 1 . . . . . 31 ALA N . 50921 1 107 . 1 . 1 35 35 GLY H H 1 8.069 0.02 . 1 . . . . . 32 GLY H . 50921 1 108 . 1 . 1 35 35 GLY CA C 13 43.300 0.200 . 1 . . . . . 32 GLY CA . 50921 1 109 . 1 . 1 35 35 GLY N N 15 108.627 0.20 . 1 . . . . . 32 GLY N . 50921 1 110 . 1 . 1 36 36 PRO C C 13 176.912 0.20 . 1 . . . . . 33 PRO C . 50921 1 111 . 1 . 1 37 37 GLN H H 1 8.308 0.02 . 1 . . . . . 34 GLN H . 50921 1 112 . 1 . 1 37 37 GLN N N 15 122.503 0.20 . 1 . . . . . 34 GLN N . 50921 1 113 . 1 . 1 38 38 PRO C C 13 177.447 0.20 . 1 . . . . . 35 PRO C . 50921 1 114 . 1 . 1 38 38 PRO CA C 13 61.900 0.200 . 1 . . . . . 35 PRO CA . 50921 1 115 . 1 . 1 39 39 GLY H H 1 8.096 0.02 . 1 . . . . . 36 GLY H . 50921 1 116 . 1 . 1 39 39 GLY C C 13 176.800 0.20 . 1 . . . . . 36 GLY C . 50921 1 117 . 1 . 1 39 39 GLY CA C 13 43.700 0.200 . 1 . . . . . 36 GLY CA . 50921 1 118 . 1 . 1 39 39 GLY N N 15 109.838 0.20 . 1 . . . . . 36 GLY N . 50921 1 119 . 1 . 1 40 40 SER H H 1 9.021 0.02 . 1 . . . . . 37 SER H . 50921 1 120 . 1 . 1 40 40 SER N N 15 109.995 0.20 . 1 . . . . . 37 SER N . 50921 1 121 . 1 . 1 41 41 TYR C C 13 173.478 0.20 . 1 . . . . . 38 TYR C . 50921 1 122 . 1 . 1 42 42 GLU H H 1 7.384 0.02 . 1 . . . . . 39 GLU H . 50921 1 123 . 1 . 1 42 42 GLU C C 13 174.548 0.20 . 1 . . . . . 39 GLU C . 50921 1 124 . 1 . 1 42 42 GLU CA C 13 53.300 0.200 . 1 . . . . . 39 GLU CA . 50921 1 125 . 1 . 1 42 42 GLU N N 15 122.612 0.20 . 1 . . . . . 39 GLU N . 50921 1 126 . 1 . 1 43 43 ILE H H 1 8.555 0.02 . 1 . . . . . 40 ILE H . 50921 1 127 . 1 . 1 43 43 ILE C C 13 174.861 0.20 . 1 . . . . . 40 ILE C . 50921 1 128 . 1 . 1 43 43 ILE CA C 13 60.100 0.200 . 1 . . . . . 40 ILE CA . 50921 1 129 . 1 . 1 43 43 ILE CB C 13 37.500 0.200 . 1 . . . . . 40 ILE CB . 50921 1 130 . 1 . 1 43 43 ILE N N 15 124.291 0.20 . 1 . . . . . 40 ILE N . 50921 1 131 . 1 . 1 44 44 ARG H H 1 8.432 0.02 . 1 . . . . . 41 ARG H . 50921 1 132 . 1 . 1 44 44 ARG C C 13 173.411 0.20 . 1 . . . . . 41 ARG C . 50921 1 133 . 1 . 1 44 44 ARG CA C 13 53.300 0.200 . 1 . . . . . 41 ARG CA . 50921 1 134 . 1 . 1 44 44 ARG CD C 13 43.300 0.200 . 1 . . . . . 41 ARG CD . 50921 1 135 . 1 . 1 44 44 ARG N N 15 123.198 0.20 . 1 . . . . . 41 ARG N . 50921 1 136 . 1 . 1 45 45 HIS H H 1 8.665 0.02 . 1 . . . . . 42 HIS H . 50921 1 137 . 1 . 1 45 45 HIS C C 13 175.752 0.20 . 1 . . . . . 42 HIS C . 50921 1 138 . 1 . 1 45 45 HIS CA C 13 53.600 0.200 . 1 . . . . . 42 HIS CA . 50921 1 139 . 1 . 1 45 45 HIS CB C 13 29.300 0.200 . 1 . . . . . 42 HIS CB . 50921 1 140 . 1 . 1 45 45 HIS N N 15 122.299 0.20 . 1 . . . . . 42 HIS N . 50921 1 141 . 1 . 1 46 46 TYR H H 1 8.815 0.02 . 1 . . . . . 43 TYR H . 50921 1 142 . 1 . 1 46 46 TYR C C 13 175.842 0.20 . 1 . . . . . 43 TYR C . 50921 1 143 . 1 . 1 46 46 TYR CA C 13 57.900 0.200 . 1 . . . . . 43 TYR CA . 50921 1 144 . 1 . 1 46 46 TYR CB C 13 38.700 0.200 . 1 . . . . . 43 TYR CB . 50921 1 145 . 1 . 1 46 46 TYR N N 15 129.331 0.20 . 1 . . . . . 43 TYR N . 50921 1 146 . 1 . 1 47 47 GLY H H 1 7.843 0.02 . 1 . . . . . 44 GLY H . 50921 1 147 . 1 . 1 47 47 GLY CA C 13 43.200 0.200 . 1 . . . . . 44 GLY CA . 50921 1 148 . 1 . 1 47 47 GLY N N 15 108.549 0.20 . 1 . . . . . 44 GLY N . 50921 1 149 . 1 . 1 48 48 PRO C C 13 177.046 0.20 . 1 . . . . . 45 PRO C . 50921 1 150 . 1 . 1 48 48 PRO CA C 13 62.200 0.200 . 1 . . . . . 45 PRO CA . 50921 1 151 . 1 . 1 49 49 ALA H H 1 8.350 0.02 . 1 . . . . . 46 ALA H . 50921 1 152 . 1 . 1 49 49 ALA C C 13 175.529 0.20 . 1 . . . . . 46 ALA C . 50921 1 153 . 1 . 1 49 49 ALA CA C 13 51.600 0.200 . 1 . . . . . 46 ALA CA . 50921 1 154 . 1 . 1 49 49 ALA N N 15 123.510 0.20 . 1 . . . . . 46 ALA N . 50921 1 155 . 1 . 1 50 50 LYS H H 1 9.575 0.02 . 1 . . . . . 47 LYS H . 50921 1 156 . 1 . 1 50 50 LYS C C 13 176.444 0.20 . 1 . . . . . 47 LYS C . 50921 1 157 . 1 . 1 50 50 LYS CA C 13 55.000 0.200 . 1 . . . . . 47 LYS CA . 50921 1 158 . 1 . 1 50 50 LYS CB C 13 32.600 0.200 . 1 . . . . . 47 LYS CB . 50921 1 159 . 1 . 1 50 50 LYS CE C 13 42.100 0.200 . 1 . . . . . 47 LYS CE . 50921 1 160 . 1 . 1 50 50 LYS N N 15 119.956 0.20 . 1 . . . . . 47 LYS N . 50921 1 161 . 1 . 1 51 51 TRP H H 1 9.123 0.02 . 1 . . . . . 48 TRP H . 50921 1 162 . 1 . 1 51 51 TRP C C 13 173.701 0.20 . 1 . . . . . 48 TRP C . 50921 1 163 . 1 . 1 51 51 TRP CA C 13 54.900 0.200 . 1 . . . . . 48 TRP CA . 50921 1 164 . 1 . 1 51 51 TRP CB C 13 30.200 0.200 . 1 . . . . . 48 TRP CB . 50921 1 165 . 1 . 1 51 51 TRP N N 15 122.963 0.20 . 1 . . . . . 48 TRP N . 50921 1 166 . 1 . 1 52 52 VAL H H 1 9.569 0.02 . 1 . . . . . 49 VAL H . 50921 1 167 . 1 . 1 52 52 VAL C C 13 173.456 0.20 . 1 . . . . . 49 VAL C . 50921 1 168 . 1 . 1 52 52 VAL CA C 13 58.600 0.200 . 1 . . . . . 49 VAL CA . 50921 1 169 . 1 . 1 52 52 VAL CB C 13 31.700 0.200 . 1 . . . . . 49 VAL CB . 50921 1 170 . 1 . 1 52 52 VAL N N 15 122.690 0.20 . 1 . . . . . 49 VAL N . 50921 1 171 . 1 . 1 53 53 SER H H 1 8.521 0.02 . 1 . . . . . 50 SER H . 50921 1 172 . 1 . 1 53 53 SER C C 13 171.070 0.20 . 1 . . . . . 50 SER C . 50921 1 173 . 1 . 1 53 53 SER CA C 13 55.800 0.200 . 1 . . . . . 50 SER CA . 50921 1 174 . 1 . 1 53 53 SER N N 15 122.534 0.20 . 1 . . . . . 50 SER N . 50921 1 175 . 1 . 1 54 54 THR H H 1 8.432 0.02 . 1 . . . . . 51 THR H . 50921 1 176 . 1 . 1 54 54 THR CA C 13 60.400 0.200 . 1 . . . . . 51 THR CA . 50921 1 177 . 1 . 1 54 54 THR CB C 13 68.800 0.200 . 1 . . . . . 51 THR CB . 50921 1 178 . 1 . 1 54 54 THR N N 15 114.487 0.20 . 1 . . . . . 51 THR N . 50921 1 179 . 1 . 1 55 55 SER H H 1 9.110 0.02 . 1 . . . . . 52 SER H . 50921 1 180 . 1 . 1 55 55 SER C C 13 173.277 0.20 . 1 . . . . . 52 SER C . 50921 1 181 . 1 . 1 55 55 SER CA C 13 57.300 0.200 . 1 . . . . . 52 SER CA . 50921 1 182 . 1 . 1 55 55 SER CB C 13 64.200 0.200 . 1 . . . . . 52 SER CB . 50921 1 183 . 1 . 1 55 55 SER N N 15 125.112 0.20 . 1 . . . . . 52 SER N . 50921 1 184 . 1 . 1 56 56 VAL H H 1 9.185 0.02 . 1 . . . . . 53 VAL H . 50921 1 185 . 1 . 1 56 56 VAL C C 13 173.902 0.20 . 1 . . . . . 53 VAL C . 50921 1 186 . 1 . 1 56 56 VAL CA C 13 59.500 0.200 . 1 . . . . . 53 VAL CA . 50921 1 187 . 1 . 1 56 56 VAL CB C 13 34.000 0.200 . 1 . . . . . 53 VAL CB . 50921 1 188 . 1 . 1 56 56 VAL N N 15 124.643 0.20 . 1 . . . . . 53 VAL N . 50921 1 189 . 1 . 1 57 57 GLU H H 1 8.308 0.02 . 1 . . . . . 54 GLU H . 50921 1 190 . 1 . 1 57 57 GLU C C 13 175.886 0.20 . 1 . . . . . 54 GLU C . 50921 1 191 . 1 . 1 57 57 GLU CA C 13 59.500 0.200 . 1 . . . . . 54 GLU CA . 50921 1 192 . 1 . 1 57 57 GLU CB C 13 28.800 0.200 . 1 . . . . . 54 GLU CB . 50921 1 193 . 1 . 1 57 57 GLU N N 15 125.659 0.20 . 1 . . . . . 54 GLU N . 50921 1 194 . 1 . 1 58 58 SER H H 1 8.324 0.02 . 1 . . . . . 55 SER H . 50921 1 195 . 1 . 1 58 58 SER C C 13 173.277 0.20 . 1 . . . . . 55 SER C . 50921 1 196 . 1 . 1 58 58 SER CA C 13 56.900 0.200 . 1 . . . . . 55 SER CA . 50921 1 197 . 1 . 1 58 58 SER CB C 13 63.000 0.200 . 1 . . . . . 55 SER CB . 50921 1 198 . 1 . 1 58 58 SER N N 15 116.208 0.20 . 1 . . . . . 55 SER N . 50921 1 199 . 1 . 1 59 59 MET H H 1 7.144 0.02 . 1 . . . . . 56 MET H . 50921 1 200 . 1 . 1 59 59 MET CA C 13 57.800 0.200 . 1 . . . . . 56 MET CA . 50921 1 201 . 1 . 1 59 59 MET N N 15 116.713 0.20 . 1 . . . . . 56 MET N . 50921 1 202 . 1 . 1 61 61 TRP C C 13 175.730 0.20 . 1 . . . . . 58 TRP C . 50921 1 203 . 1 . 1 61 61 TRP CA C 13 61.900 0.200 . 1 . . . . . 58 TRP CA . 50921 1 204 . 1 . 1 62 62 ASP H H 1 8.082 0.02 . 1 . . . . . 59 ASP H . 50921 1 205 . 1 . 1 62 62 ASP C C 13 178.606 0.20 . 1 . . . . . 59 ASP C . 50921 1 206 . 1 . 1 62 62 ASP CA C 13 57.400 0.200 . 1 . . . . . 59 ASP CA . 50921 1 207 . 1 . 1 62 62 ASP CB C 13 39.400 0.200 . 1 . . . . . 59 ASP CB . 50921 1 208 . 1 . 1 62 62 ASP N N 15 114.487 0.20 . 1 . . . . . 59 ASP N . 50921 1 209 . 1 . 1 63 63 SER H H 1 7.480 0.02 . 1 . . . . . 60 SER H . 50921 1 210 . 1 . 1 63 63 SER C C 13 176.444 0.20 . 1 . . . . . 60 SER C . 50921 1 211 . 1 . 1 63 63 SER CA C 13 59.300 0.200 . 1 . . . . . 60 SER CA . 50921 1 212 . 1 . 1 63 63 SER N N 15 114.526 0.20 . 1 . . . . . 60 SER N . 50921 1 213 . 1 . 1 64 64 ALA H H 1 8.160 0.02 . 1 . . . . . 61 ALA H . 50921 1 214 . 1 . 1 64 64 ALA C C 13 179.208 0.20 . 1 . . . . . 61 ALA C . 50921 1 215 . 1 . 1 64 64 ALA CA C 13 54.000 0.200 . 1 . . . . . 61 ALA CA . 50921 1 216 . 1 . 1 64 64 ALA CB C 13 17.500 0.200 . 1 . . . . . 61 ALA CB . 50921 1 217 . 1 . 1 64 64 ALA N N 15 126.746 0.20 . 1 . . . . . 61 ALA N . 50921 1 218 . 1 . 1 65 65 ILE H H 1 7.767 0.02 . 1 . . . . . 62 ILE H . 50921 1 219 . 1 . 1 65 65 ILE C C 13 176.667 0.20 . 1 . . . . . 62 ILE C . 50921 1 220 . 1 . 1 65 65 ILE CA C 13 61.100 0.200 . 1 . . . . . 62 ILE CA . 50921 1 221 . 1 . 1 65 65 ILE N N 15 116.166 0.20 . 1 . . . . . 62 ILE N . 50921 1 222 . 1 . 1 66 66 GLN H H 1 6.473 0.02 . 1 . . . . . 63 GLN H . 50921 1 223 . 1 . 1 66 66 GLN C C 13 178.651 0.20 . 1 . . . . . 63 GLN C . 50921 1 224 . 1 . 1 66 66 GLN CA C 13 57.500 0.200 . 1 . . . . . 63 GLN CA . 50921 1 225 . 1 . 1 66 66 GLN N N 15 119.604 0.20 . 1 . . . . . 63 GLN N . 50921 1 226 . 1 . 1 67 67 THR H H 1 8.082 0.02 . 1 . . . . . 64 THR H . 50921 1 227 . 1 . 1 67 67 THR C C 13 177.358 0.20 . 1 . . . . . 64 THR C . 50921 1 228 . 1 . 1 67 67 THR CA C 13 65.100 0.200 . 1 . . . . . 64 THR CA . 50921 1 229 . 1 . 1 67 67 THR N N 15 117.299 0.20 . 1 . . . . . 64 THR N . 50921 1 230 . 1 . 1 68 68 GLY H H 1 8.774 0.02 . 1 . . . . . 65 GLY H . 50921 1 231 . 1 . 1 68 68 GLY C C 13 174.481 0.20 . 1 . . . . . 65 GLY C . 50921 1 232 . 1 . 1 68 68 GLY CA C 13 45.700 0.200 . 1 . . . . . 65 GLY CA . 50921 1 233 . 1 . 1 68 68 GLY N N 15 108.627 0.20 . 1 . . . . . 65 GLY N . 50921 1 234 . 1 . 1 69 69 PHE H H 1 8.466 0.02 . 1 . . . . . 66 PHE H . 50921 1 235 . 1 . 1 69 69 PHE C C 13 176.287 0.20 . 1 . . . . . 66 PHE C . 50921 1 236 . 1 . 1 69 69 PHE CA C 13 61.800 0.200 . 1 . . . . . 66 PHE CA . 50921 1 237 . 1 . 1 69 69 PHE N N 15 121.674 0.20 . 1 . . . . . 66 PHE N . 50921 1 238 . 1 . 1 70 70 THR H H 1 7.617 0.02 . 1 . . . . . 67 THR H . 50921 1 239 . 1 . 1 70 70 THR C C 13 176.265 0.20 . 1 . . . . . 67 THR C . 50921 1 240 . 1 . 1 70 70 THR CA C 13 66.000 0.200 . 1 . . . . . 67 THR CA . 50921 1 241 . 1 . 1 70 70 THR N N 15 114.252 0.20 . 1 . . . . . 67 THR N . 50921 1 242 . 1 . 1 71 71 LYS H H 1 6.829 0.02 . 1 . . . . . 68 LYS H . 50921 1 243 . 1 . 1 71 71 LYS C C 13 179.454 0.20 . 1 . . . . . 68 LYS C . 50921 1 244 . 1 . 1 71 71 LYS CA C 13 58.100 0.200 . 1 . . . . . 68 LYS CA . 50921 1 245 . 1 . 1 71 71 LYS CE C 13 42.100 0.200 . 1 . . . . . 68 LYS CE . 50921 1 246 . 1 . 1 71 71 LYS N N 15 120.346 0.20 . 1 . . . . . 68 LYS N . 50921 1 247 . 1 . 1 72 72 LEU H H 1 7.576 0.02 . 1 . . . . . 69 LEU H . 50921 1 248 . 1 . 1 72 72 LEU C C 13 178.450 0.20 . 1 . . . . . 69 LEU C . 50921 1 249 . 1 . 1 72 72 LEU CA C 13 56.000 0.200 . 1 . . . . . 69 LEU CA . 50921 1 250 . 1 . 1 72 72 LEU N N 15 120.541 0.20 . 1 . . . . . 69 LEU N . 50921 1 251 . 1 . 1 73 73 ASN H H 1 8.541 0.02 . 1 . . . . . 70 ASN H . 50921 1 252 . 1 . 1 73 73 ASN C C 13 177.068 0.20 . 1 . . . . . 70 ASN C . 50921 1 253 . 1 . 1 73 73 ASN CA C 13 54.400 0.200 . 1 . . . . . 70 ASN CA . 50921 1 254 . 1 . 1 73 73 ASN CB C 13 37.000 0.200 . 1 . . . . . 70 ASN CB . 50921 1 255 . 1 . 1 73 73 ASN N N 15 118.198 0.20 . 1 . . . . . 70 ASN N . 50921 1 256 . 1 . 1 74 74 SER H H 1 7.521 0.02 . 1 . . . . . 71 SER H . 50921 1 257 . 1 . 1 74 74 SER C C 13 176.399 0.20 . 1 . . . . . 71 SER C . 50921 1 258 . 1 . 1 74 74 SER CA C 13 61.300 0.200 . 1 . . . . . 71 SER CA . 50921 1 259 . 1 . 1 74 74 SER N N 15 113.510 0.20 . 1 . . . . . 71 SER N . 50921 1 260 . 1 . 1 75 75 TYR H H 1 7.151 0.02 . 1 . . . . . 72 TYR H . 50921 1 261 . 1 . 1 75 75 TYR C C 13 177.224 0.20 . 1 . . . . . 72 TYR C . 50921 1 262 . 1 . 1 75 75 TYR CA C 13 61.300 0.200 . 1 . . . . . 72 TYR CA . 50921 1 263 . 1 . 1 75 75 TYR N N 15 122.612 0.20 . 1 . . . . . 72 TYR N . 50921 1 264 . 1 . 1 76 76 ILE H H 1 7.870 0.02 . 1 . . . . . 73 ILE H . 50921 1 265 . 1 . 1 76 76 ILE C C 13 176.488 0.20 . 1 . . . . . 73 ILE C . 50921 1 266 . 1 . 1 76 76 ILE CA C 13 62.700 0.200 . 1 . . . . . 73 ILE CA . 50921 1 267 . 1 . 1 76 76 ILE N N 15 116.909 0.20 . 1 . . . . . 73 ILE N . 50921 1 268 . 1 . 1 77 77 GLN H H 1 7.507 0.02 . 1 . . . . . 74 GLN H . 50921 1 269 . 1 . 1 77 77 GLN C C 13 176.109 0.20 . 1 . . . . . 74 GLN C . 50921 1 270 . 1 . 1 77 77 GLN CA C 13 54.200 0.200 . 1 . . . . . 74 GLN CA . 50921 1 271 . 1 . 1 77 77 GLN N N 15 116.010 0.20 . 1 . . . . . 74 GLN N . 50921 1 272 . 1 . 1 78 78 GLY H H 1 6.904 0.02 . 1 . . . . . 75 GLY H . 50921 1 273 . 1 . 1 78 78 GLY C C 13 174.704 0.20 . 1 . . . . . 75 GLY C . 50921 1 274 . 1 . 1 78 78 GLY CA C 13 43.700 0.200 . 1 . . . . . 75 GLY CA . 50921 1 275 . 1 . 1 78 78 GLY N N 15 104.838 0.20 . 1 . . . . . 75 GLY N . 50921 1 276 . 1 . 1 79 79 LYS H H 1 8.173 0.02 . 1 . . . . . 76 LYS H . 50921 1 277 . 1 . 1 79 79 LYS C C 13 174.571 0.20 . 1 . . . . . 76 LYS C . 50921 1 278 . 1 . 1 79 79 LYS CA C 13 53.400 0.200 . 1 . . . . . 76 LYS CA . 50921 1 279 . 1 . 1 79 79 LYS CE C 13 42.100 0.200 . 1 . . . . . 76 LYS CE . 50921 1 280 . 1 . 1 79 79 LYS N N 15 126.086 0.20 . 1 . . . . . 76 LYS N . 50921 1 281 . 1 . 1 80 80 ASN H H 1 8.599 0.02 . 1 . . . . . 77 ASN H . 50921 1 282 . 1 . 1 80 80 ASN C C 13 175.908 0.20 . 1 . . . . . 77 ASN C . 50921 1 283 . 1 . 1 80 80 ASN CA C 13 51.300 0.200 . 1 . . . . . 77 ASN CA . 50921 1 284 . 1 . 1 80 80 ASN N N 15 119.713 0.20 . 1 . . . . . 77 ASN N . 50921 1 285 . 1 . 1 81 81 GLU H H 1 9.082 0.02 . 1 . . . . . 78 GLU H . 50921 1 286 . 1 . 1 81 81 GLU C C 13 175.886 0.20 . 1 . . . . . 78 GLU C . 50921 1 287 . 1 . 1 81 81 GLU CA C 13 58.400 0.200 . 1 . . . . . 78 GLU CA . 50921 1 288 . 1 . 1 81 81 GLU CB C 13 29.100 0.200 . 1 . . . . . 78 GLU CB . 50921 1 289 . 1 . 1 81 81 GLU N N 15 119.213 0.20 . 1 . . . . . 78 GLU N . 50921 1 290 . 1 . 1 82 82 LYS H H 1 6.979 0.02 . 1 . . . . . 79 LYS H . 50921 1 291 . 1 . 1 82 82 LYS C C 13 174.481 0.20 . 1 . . . . . 79 LYS C . 50921 1 292 . 1 . 1 82 82 LYS CA C 13 53.800 0.200 . 1 . . . . . 79 LYS CA . 50921 1 293 . 1 . 1 82 82 LYS CB C 13 31.600 0.200 . 1 . . . . . 79 LYS CB . 50921 1 294 . 1 . 1 82 82 LYS CE C 13 42.100 0.200 . 1 . . . . . 79 LYS CE . 50921 1 295 . 1 . 1 82 82 LYS N N 15 114.320 0.20 . 1 . . . . . 79 LYS N . 50921 1 296 . 1 . 1 83 83 GLU H H 1 7.781 0.02 . 1 . . . . . 80 GLU H . 50921 1 297 . 1 . 1 83 83 GLU C C 13 175.373 0.20 . 1 . . . . . 80 GLU C . 50921 1 298 . 1 . 1 83 83 GLU CA C 13 55.700 0.200 . 1 . . . . . 80 GLU CA . 50921 1 299 . 1 . 1 83 83 GLU N N 15 120.112 0.20 . 1 . . . . . 80 GLU N . 50921 1 300 . 1 . 1 84 84 MET H H 1 7.959 0.02 . 1 . . . . . 81 MET H . 50921 1 301 . 1 . 1 84 84 MET C C 13 175.195 0.20 . 1 . . . . . 81 MET C . 50921 1 302 . 1 . 1 84 84 MET CA C 13 53.900 0.200 . 1 . . . . . 81 MET CA . 50921 1 303 . 1 . 1 84 84 MET CB C 13 34.900 0.200 . 1 . . . . . 81 MET CB . 50921 1 304 . 1 . 1 84 84 MET N N 15 118.588 0.20 . 1 . . . . . 81 MET N . 50921 1 305 . 1 . 1 85 85 LYS H H 1 8.281 0.02 . 1 . . . . . 82 LYS H . 50921 1 306 . 1 . 1 85 85 LYS C C 13 175.552 0.20 . 1 . . . . . 82 LYS C . 50921 1 307 . 1 . 1 85 85 LYS CA C 13 54.500 0.200 . 1 . . . . . 82 LYS CA . 50921 1 308 . 1 . 1 85 85 LYS CE C 13 42.100 0.200 . 1 . . . . . 82 LYS CE . 50921 1 309 . 1 . 1 85 85 LYS N N 15 125.854 0.20 . 1 . . . . . 82 LYS N . 50921 1 310 . 1 . 1 86 86 ILE H H 1 8.986 0.02 . 1 . . . . . 83 ILE H . 50921 1 311 . 1 . 1 86 86 ILE C C 13 174.147 0.20 . 1 . . . . . 83 ILE C . 50921 1 312 . 1 . 1 86 86 ILE CA C 13 58.700 0.200 . 1 . . . . . 83 ILE CA . 50921 1 313 . 1 . 1 86 86 ILE CB C 13 38.600 0.200 . 1 . . . . . 83 ILE CB . 50921 1 314 . 1 . 1 86 86 ILE N N 15 129.487 0.20 . 1 . . . . . 83 ILE N . 50921 1 315 . 1 . 1 87 87 LYS H H 1 8.137 0.02 . 1 . . . . . 84 LYS H . 50921 1 316 . 1 . 1 87 87 LYS C C 13 174.727 0.20 . 1 . . . . . 84 LYS C . 50921 1 317 . 1 . 1 87 87 LYS CA C 13 56.300 0.200 . 1 . . . . . 84 LYS CA . 50921 1 318 . 1 . 1 87 87 LYS CB C 13 31.300 0.200 . 1 . . . . . 84 LYS CB . 50921 1 319 . 1 . 1 87 87 LYS CE C 13 42.100 0.200 . 1 . . . . . 84 LYS CE . 50921 1 320 . 1 . 1 87 87 LYS N N 15 126.401 0.20 . 1 . . . . . 84 LYS N . 50921 1 321 . 1 . 1 88 88 MET H H 1 7.808 0.02 . 1 . . . . . 85 MET H . 50921 1 322 . 1 . 1 88 88 MET C C 13 175.752 0.20 . 1 . . . . . 85 MET C . 50921 1 323 . 1 . 1 88 88 MET CA C 13 55.000 0.200 . 1 . . . . . 85 MET CA . 50921 1 324 . 1 . 1 88 88 MET N N 15 119.799 0.20 . 1 . . . . . 85 MET N . 50921 1 325 . 1 . 1 89 89 THR H H 1 7.350 0.02 . 1 . . . . . 86 THR H . 50921 1 326 . 1 . 1 89 89 THR C C 13 170.580 0.20 . 1 . . . . . 86 THR C . 50921 1 327 . 1 . 1 89 89 THR CA C 13 58.900 0.200 . 1 . . . . . 86 THR CA . 50921 1 328 . 1 . 1 89 89 THR CB C 13 70.100 0.200 . 1 . . . . . 86 THR CB . 50921 1 329 . 1 . 1 89 89 THR N N 15 116.909 0.20 . 1 . . . . . 86 THR N . 50921 1 330 . 1 . 1 90 90 ALA H H 1 8.048 0.02 . 1 . . . . . 87 ALA H . 50921 1 331 . 1 . 1 90 90 ALA N N 15 116.518 0.20 . 1 . . . . . 87 ALA N . 50921 1 332 . 1 . 1 91 91 PRO C C 13 176.733 0.20 . 1 . . . . . 88 PRO C . 50921 1 333 . 1 . 1 91 91 PRO CB C 13 32.300 0.200 . 1 . . . . . 88 PRO CB . 50921 1 334 . 1 . 1 92 92 VAL H H 1 8.192 0.02 . 1 . . . . . 89 VAL H . 50921 1 335 . 1 . 1 92 92 VAL C C 13 177.781 0.20 . 1 . . . . . 89 VAL C . 50921 1 336 . 1 . 1 92 92 VAL CA C 13 61.100 0.200 . 1 . . . . . 89 VAL CA . 50921 1 337 . 1 . 1 92 92 VAL CB C 13 31.100 0.200 . 1 . . . . . 89 VAL CB . 50921 1 338 . 1 . 1 92 92 VAL N N 15 119.877 0.20 . 1 . . . . . 89 VAL N . 50921 1 339 . 1 . 1 93 93 THR H H 1 8.870 0.02 . 1 . . . . . 90 THR H . 50921 1 340 . 1 . 1 93 93 THR C C 13 173.924 0.20 . 1 . . . . . 90 THR C . 50921 1 341 . 1 . 1 93 93 THR CA C 13 59.000 0.200 . 1 . . . . . 90 THR CA . 50921 1 342 . 1 . 1 93 93 THR CB C 13 71.400 0.200 . 1 . . . . . 90 THR CB . 50921 1 343 . 1 . 1 93 93 THR N N 15 123.432 0.20 . 1 . . . . . 90 THR N . 50921 1 344 . 1 . 1 94 94 SER H H 1 8.306 0.02 . 1 . . . . . 91 SER H . 50921 1 345 . 1 . 1 94 94 SER C C 13 170.379 0.20 . 1 . . . . . 91 SER C . 50921 1 346 . 1 . 1 94 94 SER CA C 13 55.700 0.200 . 1 . . . . . 91 SER CA . 50921 1 347 . 1 . 1 94 94 SER N N 15 116.528 0.20 . 1 . . . . . 91 SER N . 50921 1 348 . 1 . 1 95 95 TYR H H 1 8.815 0.02 . 1 . . . . . 92 TYR H . 50921 1 349 . 1 . 1 95 95 TYR C C 13 174.370 0.20 . 1 . . . . . 92 TYR C . 50921 1 350 . 1 . 1 95 95 TYR CA C 13 55.700 0.200 . 1 . . . . . 92 TYR CA . 50921 1 351 . 1 . 1 95 95 TYR CB C 13 39.800 0.200 . 1 . . . . . 92 TYR CB . 50921 1 352 . 1 . 1 95 95 TYR N N 15 123.549 0.20 . 1 . . . . . 92 TYR N . 50921 1 353 . 1 . 1 96 96 VAL H H 1 7.829 0.02 . 1 . . . . . 93 VAL H . 50921 1 354 . 1 . 1 96 96 VAL C C 13 176.956 0.20 . 1 . . . . . 93 VAL C . 50921 1 355 . 1 . 1 96 96 VAL CA C 13 60.700 0.200 . 1 . . . . . 93 VAL CA . 50921 1 356 . 1 . 1 96 96 VAL CB C 13 30.700 0.200 . 1 . . . . . 93 VAL CB . 50921 1 357 . 1 . 1 96 96 VAL N N 15 129.370 0.20 . 1 . . . . . 93 VAL N . 50921 1 358 . 1 . 1 97 97 GLU H H 1 9.302 0.02 . 1 . . . . . 94 GLU H . 50921 1 359 . 1 . 1 97 97 GLU CA C 13 54.400 0.200 . 1 . . . . . 94 GLU CA . 50921 1 360 . 1 . 1 97 97 GLU CB C 13 28.600 0.200 . 1 . . . . . 94 GLU CB . 50921 1 361 . 1 . 1 97 97 GLU N N 15 126.596 0.20 . 1 . . . . . 94 GLU N . 50921 1 362 . 1 . 1 99 99 GLY C C 13 176.800 0.20 . 1 . . . . . 96 GLY C . 50921 1 363 . 1 . 1 100 100 SER H H 1 9.021 0.02 . 1 . . . . . 97 SER H . 50921 1 364 . 1 . 1 100 100 SER N N 15 109.995 0.20 . 1 . . . . . 97 SER N . 50921 1 365 . 1 . 1 102 102 PRO C C 13 176.979 0.20 . 1 . . . . . 99 PRO C . 50921 1 366 . 1 . 1 103 103 PHE H H 1 9.528 0.02 . 1 . . . . . 100 PHE H . 50921 1 367 . 1 . 1 103 103 PHE C C 13 175.173 0.20 . 1 . . . . . 100 PHE C . 50921 1 368 . 1 . 1 103 103 PHE CA C 13 55.700 0.200 . 1 . . . . . 100 PHE CA . 50921 1 369 . 1 . 1 103 103 PHE N N 15 118.627 0.20 . 1 . . . . . 100 PHE N . 50921 1 370 . 1 . 1 104 104 SER H H 1 7.336 0.02 . 1 . . . . . 101 SER H . 50921 1 371 . 1 . 1 104 104 SER C C 13 174.147 0.20 . 1 . . . . . 101 SER C . 50921 1 372 . 1 . 1 104 104 SER CA C 13 57.000 0.200 . 1 . . . . . 101 SER CA . 50921 1 373 . 1 . 1 104 104 SER CB C 13 63.300 0.200 . 1 . . . . . 101 SER CB . 50921 1 374 . 1 . 1 104 104 SER N N 15 115.034 0.20 . 1 . . . . . 101 SER N . 50921 1 375 . 1 . 1 105 105 GLU H H 1 8.653 0.02 . 1 . . . . . 102 GLU H . 50921 1 376 . 1 . 1 105 105 GLU CA C 13 56.000 0.200 . 1 . . . . . 102 GLU CA . 50921 1 377 . 1 . 1 105 105 GLU CB C 13 28.600 0.200 . 1 . . . . . 102 GLU CB . 50921 1 378 . 1 . 1 105 105 GLU N N 15 123.570 0.20 . 1 . . . . . 102 GLU N . 50921 1 379 . 1 . 1 106 106 SER C C 13 173.010 0.20 . 1 . . . . . 103 SER C . 50921 1 380 . 1 . 1 106 106 SER CA C 13 57.500 0.200 . 1 . . . . . 103 SER CA . 50921 1 381 . 1 . 1 106 106 SER CB C 13 63.500 0.200 . 1 . . . . . 103 SER CB . 50921 1 382 . 1 . 1 107 107 THR H H 1 8.226 0.02 . 1 . . . . . 104 THR H . 50921 1 383 . 1 . 1 107 107 THR CA C 13 61.900 0.200 . 1 . . . . . 104 THR CA . 50921 1 384 . 1 . 1 107 107 THR CB C 13 68.700 0.200 . 1 . . . . . 104 THR CB . 50921 1 385 . 1 . 1 107 107 THR N N 15 119.760 0.20 . 1 . . . . . 104 THR N . 50921 1 386 . 1 . 1 108 108 ILE C C 13 174.838 0.20 . 1 . . . . . 105 ILE C . 50921 1 387 . 1 . 1 108 108 ILE CA C 13 59.300 0.200 . 1 . . . . . 105 ILE CA . 50921 1 388 . 1 . 1 108 108 ILE CB C 13 39.200 0.200 . 1 . . . . . 105 ILE CB . 50921 1 389 . 1 . 1 109 109 THR H H 1 9.120 0.02 . 1 . . . . . 106 THR H . 50921 1 390 . 1 . 1 109 109 THR C C 13 173.590 0.20 . 1 . . . . . 106 THR C . 50921 1 391 . 1 . 1 109 109 THR CA C 13 60.900 0.200 . 1 . . . . . 106 THR CA . 50921 1 392 . 1 . 1 109 109 THR CB C 13 68.800 0.200 . 1 . . . . . 106 THR CB . 50921 1 393 . 1 . 1 109 109 THR N N 15 125.567 0.20 . 1 . . . . . 106 THR N . 50921 1 394 . 1 . 1 110 110 ILE H H 1 9.425 0.02 . 1 . . . . . 107 ILE H . 50921 1 395 . 1 . 1 110 110 ILE C C 13 174.942 0.20 . 1 . . . . . 107 ILE C . 50921 1 396 . 1 . 1 110 110 ILE CA C 13 59.500 0.200 . 1 . . . . . 107 ILE CA . 50921 1 397 . 1 . 1 110 110 ILE CB C 13 37.900 0.200 . 1 . . . . . 107 ILE CB . 50921 1 398 . 1 . 1 110 110 ILE N N 15 133.159 0.20 . 1 . . . . . 107 ILE N . 50921 1 399 . 1 . 1 111 111 SER H H 1 8.804 0.02 . 1 . . . . . 108 SER H . 50921 1 400 . 1 . 1 111 111 SER C C 13 172.453 0.20 . 1 . . . . . 108 SER C . 50921 1 401 . 1 . 1 111 111 SER CA C 13 57.100 0.200 . 1 . . . . . 108 SER CA . 50921 1 402 . 1 . 1 111 111 SER CB C 13 66.100 0.200 . 1 . . . . . 108 SER CB . 50921 1 403 . 1 . 1 111 111 SER N N 15 119.755 0.20 . 1 . . . . . 108 SER N . 50921 1 404 . 1 . 1 112 112 LEU H H 1 8.980 0.02 . 1 . . . . . 109 LEU H . 50921 1 405 . 1 . 1 112 112 LEU C C 13 175.150 0.20 . 1 . . . . . 109 LEU C . 50921 1 406 . 1 . 1 112 112 LEU CA C 13 52.000 0.200 . 1 . . . . . 109 LEU CA . 50921 1 407 . 1 . 1 112 112 LEU CB C 13 44.100 0.200 . 1 . . . . . 109 LEU CB . 50921 1 408 . 1 . 1 112 112 LEU N N 15 121.401 0.20 . 1 . . . . . 109 LEU N . 50921 1 409 . 1 . 1 113 113 TYR H H 1 9.233 0.02 . 1 . . . . . 110 TYR H . 50921 1 410 . 1 . 1 113 113 TYR CA C 13 55.800 0.200 . 1 . . . . . 110 TYR CA . 50921 1 411 . 1 . 1 113 113 TYR N N 15 129.057 0.20 . 1 . . . . . 110 TYR N . 50921 1 412 . 1 . 1 116 116 SER C C 13 177.348 0.20 . 1 . . . . . 113 SER C . 50921 1 413 . 1 . 1 116 116 SER CA C 13 61.600 0.200 . 1 . . . . . 113 SER CA . 50921 1 414 . 1 . 1 117 117 GLU H H 1 8.827 0.02 . 1 . . . . . 114 GLU H . 50921 1 415 . 1 . 1 117 117 GLU C C 13 176.176 0.20 . 1 . . . . . 114 GLU C . 50921 1 416 . 1 . 1 117 117 GLU CA C 13 57.700 0.200 . 1 . . . . . 114 GLU CA . 50921 1 417 . 1 . 1 117 117 GLU N N 15 120.158 0.20 . 1 . . . . . 114 GLU N . 50921 1 418 . 1 . 1 118 118 GLN H H 1 7.706 0.02 . 1 . . . . . 115 GLN H . 50921 1 419 . 1 . 1 118 118 GLN C C 13 174.526 0.20 . 1 . . . . . 115 GLN C . 50921 1 420 . 1 . 1 118 118 GLN CA C 13 55.000 0.200 . 1 . . . . . 115 GLN CA . 50921 1 421 . 1 . 1 118 118 GLN CB C 13 28.000 0.200 . 1 . . . . . 115 GLN CB . 50921 1 422 . 1 . 1 118 118 GLN N N 15 116.940 0.20 . 1 . . . . . 115 GLN N . 50921 1 423 . 1 . 1 119 119 GLN H H 1 6.980 0.02 . 1 . . . . . 116 GLN H . 50921 1 424 . 1 . 1 119 119 GLN C C 13 176.421 0.20 . 1 . . . . . 116 GLN C . 50921 1 425 . 1 . 1 119 119 GLN CA C 13 58.100 0.200 . 1 . . . . . 116 GLN CA . 50921 1 426 . 1 . 1 119 119 GLN CB C 13 26.700 0.200 . 1 . . . . . 116 GLN CB . 50921 1 427 . 1 . 1 119 119 GLN N N 15 118.081 0.20 . 1 . . . . . 116 GLN N . 50921 1 428 . 1 . 1 120 120 PHE H H 1 7.850 0.02 . 1 . . . . . 117 PHE H . 50921 1 429 . 1 . 1 120 120 PHE C C 13 175.886 0.20 . 1 . . . . . 117 PHE C . 50921 1 430 . 1 . 1 120 120 PHE CA C 13 58.800 0.200 . 1 . . . . . 117 PHE CA . 50921 1 431 . 1 . 1 120 120 PHE CB C 13 37.300 0.200 . 1 . . . . . 117 PHE CB . 50921 1 432 . 1 . 1 120 120 PHE N N 15 115.502 0.20 . 1 . . . . . 117 PHE N . 50921 1 433 . 1 . 1 121 121 ASP H H 1 7.213 0.02 . 1 . . . . . 118 ASP H . 50921 1 434 . 1 . 1 121 121 ASP N N 15 115.971 0.20 . 1 . . . . . 118 ASP N . 50921 1 435 . 1 . 1 123 123 PRO C C 13 176.912 0.20 . 1 . . . . . 120 PRO C . 50921 1 436 . 1 . 1 124 124 ARG H H 1 8.308 0.02 . 1 . . . . . 121 ARG H . 50921 1 437 . 1 . 1 124 124 ARG CB C 13 30.400 0.200 . 1 . . . . . 121 ARG CB . 50921 1 438 . 1 . 1 124 124 ARG CD C 13 43.300 0.200 . 1 . . . . . 121 ARG CD . 50921 1 439 . 1 . 1 124 124 ARG N N 15 122.503 0.20 . 1 . . . . . 121 ARG N . 50921 1 440 . 1 . 1 125 125 PRO C C 13 176.154 0.20 . 1 . . . . . 122 PRO C . 50921 1 441 . 1 . 1 125 125 PRO CA C 13 62.300 0.200 . 1 . . . . . 122 PRO CA . 50921 1 442 . 1 . 1 125 125 PRO CB C 13 31.100 0.200 . 1 . . . . . 122 PRO CB . 50921 1 443 . 1 . 1 126 126 LEU H H 1 7.144 0.02 . 1 . . . . . 123 LEU H . 50921 1 444 . 1 . 1 126 126 LEU C C 13 177.670 0.20 . 1 . . . . . 123 LEU C . 50921 1 445 . 1 . 1 126 126 LEU CA C 13 54.400 0.200 . 1 . . . . . 123 LEU CA . 50921 1 446 . 1 . 1 126 126 LEU CB C 13 41.500 0.200 . 1 . . . . . 123 LEU CB . 50921 1 447 . 1 . 1 126 126 LEU N N 15 120.034 0.20 . 1 . . . . . 123 LEU N . 50921 1 448 . 1 . 1 127 127 GLU H H 1 7.993 0.02 . 1 . . . . . 124 GLU H . 50921 1 449 . 1 . 1 127 127 GLU CA C 13 55.600 0.200 . 1 . . . . . 124 GLU CA . 50921 1 450 . 1 . 1 127 127 GLU CB C 13 28.600 0.200 . 1 . . . . . 124 GLU CB . 50921 1 451 . 1 . 1 127 127 GLU N N 15 120.541 0.20 . 1 . . . . . 124 GLU N . 50921 1 452 . 1 . 1 128 128 SER C C 13 174.169 0.20 . 1 . . . . . 125 SER C . 50921 1 453 . 1 . 1 128 128 SER CA C 13 60.000 0.200 . 1 . . . . . 125 SER CA . 50921 1 454 . 1 . 1 129 129 ASP H H 1 8.247 0.02 . 1 . . . . . 126 ASP H . 50921 1 455 . 1 . 1 129 129 ASP C C 13 175.552 0.20 . 1 . . . . . 126 ASP C . 50921 1 456 . 1 . 1 129 129 ASP CA C 13 51.900 0.200 . 1 . . . . . 126 ASP CA . 50921 1 457 . 1 . 1 129 129 ASP N N 15 117.729 0.20 . 1 . . . . . 126 ASP N . 50921 1 458 . 1 . 1 130 130 VAL H H 1 7.761 0.02 . 1 . . . . . 127 VAL H . 50921 1 459 . 1 . 1 130 130 VAL C C 13 172.876 0.20 . 1 . . . . . 127 VAL C . 50921 1 460 . 1 . 1 130 130 VAL CA C 13 60.600 0.200 . 1 . . . . . 127 VAL CA . 50921 1 461 . 1 . 1 130 130 VAL CB C 13 31.400 0.200 . 1 . . . . . 127 VAL CB . 50921 1 462 . 1 . 1 130 130 VAL N N 15 127.612 0.20 . 1 . . . . . 127 VAL N . 50921 1 463 . 1 . 1 131 131 PHE H H 1 8.945 0.02 . 1 . . . . . 128 PHE H . 50921 1 464 . 1 . 1 131 131 PHE C C 13 172.051 0.20 . 1 . . . . . 128 PHE C . 50921 1 465 . 1 . 1 131 131 PHE CA C 13 60.500 0.200 . 1 . . . . . 128 PHE CA . 50921 1 466 . 1 . 1 131 131 PHE CB C 13 40.300 0.200 . 1 . . . . . 128 PHE CB . 50921 1 467 . 1 . 1 131 131 PHE N N 15 122.377 0.20 . 1 . . . . . 128 PHE N . 50921 1 468 . 1 . 1 132 132 ILE H H 1 8.555 0.02 . 1 . . . . . 129 ILE H . 50921 1 469 . 1 . 1 132 132 ILE C C 13 175.017 0.20 . 1 . . . . . 129 ILE C . 50921 1 470 . 1 . 1 132 132 ILE CA C 13 57.200 0.200 . 1 . . . . . 129 ILE CA . 50921 1 471 . 1 . 1 132 132 ILE N N 15 119.760 0.20 . 1 . . . . . 129 ILE N . 50921 1 472 . 1 . 1 133 133 GLU H H 1 9.562 0.02 . 1 . . . . . 130 GLU H . 50921 1 473 . 1 . 1 133 133 GLU C C 13 174.147 0.20 . 1 . . . . . 130 GLU C . 50921 1 474 . 1 . 1 133 133 GLU CA C 13 57.200 0.200 . 1 . . . . . 130 GLU CA . 50921 1 475 . 1 . 1 133 133 GLU N N 15 134.057 0.20 . 1 . . . . . 130 GLU N . 50921 1 476 . 1 . 1 134 134 ASP H H 1 8.589 0.02 . 1 . . . . . 131 ASP H . 50921 1 477 . 1 . 1 134 134 ASP CA C 13 52.800 0.200 . 1 . . . . . 131 ASP CA . 50921 1 478 . 1 . 1 134 134 ASP N N 15 128.784 0.20 . 1 . . . . . 131 ASP N . 50921 1 479 . 1 . 1 135 135 ARG C C 13 175.663 0.20 . 1 . . . . . 132 ARG C . 50921 1 480 . 1 . 1 135 135 ARG CA C 13 56.200 0.200 . 1 . . . . . 132 ARG CA . 50921 1 481 . 1 . 1 135 135 ARG CB C 13 29.800 0.200 . 1 . . . . . 132 ARG CB . 50921 1 482 . 1 . 1 135 135 ARG CD C 13 43.300 0.200 . 1 . . . . . 132 ARG CD . 50921 1 483 . 1 . 1 136 136 ALA H H 1 8.421 0.02 . 1 . . . . . 133 ALA H . 50921 1 484 . 1 . 1 136 136 ALA C C 13 177.648 0.20 . 1 . . . . . 133 ALA C . 50921 1 485 . 1 . 1 136 136 ALA CA C 13 50.400 0.200 . 1 . . . . . 133 ALA CA . 50921 1 486 . 1 . 1 136 136 ALA CB C 13 18.000 0.200 . 1 . . . . . 133 ALA CB . 50921 1 487 . 1 . 1 136 136 ALA N N 15 130.932 0.20 . 1 . . . . . 133 ALA N . 50921 1 488 . 1 . 1 137 137 GLU H H 1 8.411 0.02 . 1 . . . . . 134 GLU H . 50921 1 489 . 1 . 1 137 137 GLU C C 13 174.727 0.20 . 1 . . . . . 134 GLU C . 50921 1 490 . 1 . 1 137 137 GLU CA C 13 55.100 0.200 . 1 . . . . . 134 GLU CA . 50921 1 491 . 1 . 1 137 137 GLU CB C 13 28.500 0.200 . 1 . . . . . 134 GLU CB . 50921 1 492 . 1 . 1 137 137 GLU N N 15 120.034 0.20 . 1 . . . . . 134 GLU N . 50921 1 493 . 1 . 1 138 138 MET H H 1 8.151 0.02 . 1 . . . . . 135 MET H . 50921 1 494 . 1 . 1 138 138 MET C C 13 172.675 0.20 . 1 . . . . . 135 MET C . 50921 1 495 . 1 . 1 138 138 MET CA C 13 54.300 0.200 . 1 . . . . . 135 MET CA . 50921 1 496 . 1 . 1 138 138 MET CB C 13 32.600 0.200 . 1 . . . . . 135 MET CB . 50921 1 497 . 1 . 1 138 138 MET N N 15 117.299 0.20 . 1 . . . . . 135 MET N . 50921 1 498 . 1 . 1 139 139 THR H H 1 8.694 0.02 . 1 . . . . . 136 THR H . 50921 1 499 . 1 . 1 139 139 THR C C 13 172.987 0.20 . 1 . . . . . 136 THR C . 50921 1 500 . 1 . 1 139 139 THR CA C 13 60.600 0.200 . 1 . . . . . 136 THR CA . 50921 1 501 . 1 . 1 139 139 THR CB C 13 68.600 0.200 . 1 . . . . . 136 THR CB . 50921 1 502 . 1 . 1 139 139 THR N N 15 121.250 0.20 . 1 . . . . . 136 THR N . 50921 1 503 . 1 . 1 140 140 VAL H H 1 8.713 0.02 . 1 . . . . . 137 VAL H . 50921 1 504 . 1 . 1 140 140 VAL C C 13 172.497 0.20 . 1 . . . . . 137 VAL C . 50921 1 505 . 1 . 1 140 140 VAL CB C 13 33.500 0.200 . 1 . . . . . 137 VAL CB . 50921 1 506 . 1 . 1 140 140 VAL N N 15 117.612 0.20 . 1 . . . . . 137 VAL N . 50921 1 507 . 1 . 1 141 141 PHE H H 1 9.185 0.02 . 1 . . . . . 138 PHE H . 50921 1 508 . 1 . 1 141 141 PHE C C 13 175.240 0.20 . 1 . . . . . 138 PHE C . 50921 1 509 . 1 . 1 141 141 PHE CA C 13 56.400 0.200 . 1 . . . . . 138 PHE CA . 50921 1 510 . 1 . 1 141 141 PHE CB C 13 40.400 0.200 . 1 . . . . . 138 PHE CB . 50921 1 511 . 1 . 1 141 141 PHE N N 15 120.932 0.20 . 1 . . . . . 138 PHE N . 50921 1 512 . 1 . 1 142 142 VAL H H 1 9.219 0.02 . 1 . . . . . 139 VAL H . 50921 1 513 . 1 . 1 142 142 VAL C C 13 175.663 0.20 . 1 . . . . . 139 VAL C . 50921 1 514 . 1 . 1 142 142 VAL CA C 13 61.000 0.200 . 1 . . . . . 139 VAL CA . 50921 1 515 . 1 . 1 142 142 VAL CB C 13 33.500 0.200 . 1 . . . . . 139 VAL CB . 50921 1 516 . 1 . 1 142 142 VAL N N 15 121.870 0.20 . 1 . . . . . 139 VAL N . 50921 1 517 . 1 . 1 143 143 ARG H H 1 8.849 0.02 . 1 . . . . . 140 ARG H . 50921 1 518 . 1 . 1 143 143 ARG C C 13 173.924 0.20 . 1 . . . . . 140 ARG C . 50921 1 519 . 1 . 1 143 143 ARG CA C 13 53.300 0.200 . 1 . . . . . 140 ARG CA . 50921 1 520 . 1 . 1 143 143 ARG CD C 13 43.300 0.200 . 1 . . . . . 140 ARG CD . 50921 1 521 . 1 . 1 143 143 ARG N N 15 128.354 0.20 . 1 . . . . . 140 ARG N . 50921 1 522 . 1 . 1 144 144 SER H H 1 8.623 0.02 . 1 . . . . . 141 SER H . 50921 1 523 . 1 . 1 144 144 SER C C 13 173.500 0.20 . 1 . . . . . 141 SER C . 50921 1 524 . 1 . 1 144 144 SER CA C 13 55.400 0.200 . 1 . . . . . 141 SER CA . 50921 1 525 . 1 . 1 144 144 SER CB C 13 64.800 0.200 . 1 . . . . . 141 SER CB . 50921 1 526 . 1 . 1 144 144 SER N N 15 123.666 0.20 . 1 . . . . . 141 SER N . 50921 1 527 . 1 . 1 145 145 PHE H H 1 7.959 0.02 . 1 . . . . . 142 PHE H . 50921 1 528 . 1 . 1 145 145 PHE C C 13 172.631 0.20 . 1 . . . . . 142 PHE C . 50921 1 529 . 1 . 1 145 145 PHE CA C 13 55.500 0.200 . 1 . . . . . 142 PHE CA . 50921 1 530 . 1 . 1 145 145 PHE CB C 13 39.100 0.200 . 1 . . . . . 142 PHE CB . 50921 1 531 . 1 . 1 145 145 PHE N N 15 117.065 0.20 . 1 . . . . . 142 PHE N . 50921 1 532 . 1 . 1 146 146 ASP H H 1 8.356 0.02 . 1 . . . . . 143 ASP H . 50921 1 533 . 1 . 1 146 146 ASP C C 13 176.577 0.20 . 1 . . . . . 143 ASP C . 50921 1 534 . 1 . 1 146 146 ASP CA C 13 52.600 0.200 . 1 . . . . . 143 ASP CA . 50921 1 535 . 1 . 1 146 146 ASP CB C 13 41.000 0.200 . 1 . . . . . 143 ASP CB . 50921 1 536 . 1 . 1 146 146 ASP N N 15 120.073 0.20 . 1 . . . . . 143 ASP N . 50921 1 537 . 1 . 1 147 147 GLY H H 1 8.192 0.02 . 1 . . . . . 144 GLY H . 50921 1 538 . 1 . 1 147 147 GLY CA C 13 43.200 0.200 . 1 . . . . . 144 GLY CA . 50921 1 539 . 1 . 1 147 147 GLY N N 15 109.018 0.20 . 1 . . . . . 144 GLY N . 50921 1 540 . 1 . 1 148 148 PHE C C 13 176.265 0.20 . 1 . . . . . 145 PHE C . 50921 1 541 . 1 . 1 148 148 PHE CA C 13 56.300 0.200 . 1 . . . . . 145 PHE CA . 50921 1 542 . 1 . 1 149 149 SER H H 1 8.171 0.02 . 1 . . . . . 146 SER H . 50921 1 543 . 1 . 1 149 149 SER C C 13 172.586 0.20 . 1 . . . . . 146 SER C . 50921 1 544 . 1 . 1 149 149 SER CA C 13 57.500 0.200 . 1 . . . . . 146 SER CA . 50921 1 545 . 1 . 1 149 149 SER CB C 13 63.400 0.200 . 1 . . . . . 146 SER CB . 50921 1 546 . 1 . 1 149 149 SER N N 15 116.987 0.20 . 1 . . . . . 146 SER N . 50921 1 547 . 1 . 1 150 150 SER H H 1 7.089 0.02 . 1 . . . . . 147 SER H . 50921 1 548 . 1 . 1 150 150 SER C C 13 173.500 0.20 . 1 . . . . . 147 SER C . 50921 1 549 . 1 . 1 150 150 SER CA C 13 57.500 0.200 . 1 . . . . . 147 SER CA . 50921 1 550 . 1 . 1 150 150 SER CB C 13 65.300 0.200 . 1 . . . . . 147 SER CB . 50921 1 551 . 1 . 1 150 150 SER N N 15 116.088 0.20 . 1 . . . . . 147 SER N . 50921 1 552 . 1 . 1 151 151 ALA H H 1 10.295 0.02 . 1 . . . . . 148 ALA H . 50921 1 553 . 1 . 1 151 151 ALA C C 13 180.056 0.20 . 1 . . . . . 148 ALA C . 50921 1 554 . 1 . 1 151 151 ALA CA C 13 54.500 0.200 . 1 . . . . . 148 ALA CA . 50921 1 555 . 1 . 1 151 151 ALA CB C 13 17.400 0.200 . 1 . . . . . 148 ALA CB . 50921 1 556 . 1 . 1 151 151 ALA N N 15 127.221 0.20 . 1 . . . . . 148 ALA N . 50921 1 557 . 1 . 1 152 152 GLN H H 1 8.377 0.02 . 1 . . . . . 149 GLN H . 50921 1 558 . 1 . 1 152 152 GLN C C 13 178.116 0.20 . 1 . . . . . 149 GLN C . 50921 1 559 . 1 . 1 152 152 GLN CA C 13 57.900 0.200 . 1 . . . . . 149 GLN CA . 50921 1 560 . 1 . 1 152 152 GLN N N 15 116.938 0.20 . 1 . . . . . 149 GLN N . 50921 1 561 . 1 . 1 153 153 LYS H H 1 7.603 0.02 . 1 . . . . . 150 LYS H . 50921 1 562 . 1 . 1 153 153 LYS C C 13 178.071 0.20 . 1 . . . . . 150 LYS C . 50921 1 563 . 1 . 1 153 153 LYS CA C 13 56.800 0.200 . 1 . . . . . 150 LYS CA . 50921 1 564 . 1 . 1 153 153 LYS CE C 13 42.100 0.200 . 1 . . . . . 150 LYS CE . 50921 1 565 . 1 . 1 153 153 LYS N N 15 121.870 0.20 . 1 . . . . . 150 LYS N . 50921 1 566 . 1 . 1 154 154 ASN H H 1 8.350 0.02 . 1 . . . . . 151 ASN H . 50921 1 567 . 1 . 1 154 154 ASN CA C 13 54.500 0.200 . 1 . . . . . 151 ASN CA . 50921 1 568 . 1 . 1 154 154 ASN N N 15 117.221 0.20 . 1 . . . . . 151 ASN N . 50921 1 569 . 1 . 1 155 155 GLN C C 13 177.625 0.20 . 1 . . . . . 152 GLN C . 50921 1 570 . 1 . 1 155 155 GLN CA C 13 57.600 0.200 . 1 . . . . . 152 GLN CA . 50921 1 571 . 1 . 1 155 155 GLN CB C 13 28.500 0.200 . 1 . . . . . 152 GLN CB . 50921 1 572 . 1 . 1 156 156 GLU H H 1 7.480 0.02 . 1 . . . . . 153 GLU H . 50921 1 573 . 1 . 1 156 156 GLU C C 13 179.632 0.20 . 1 . . . . . 153 GLU C . 50921 1 574 . 1 . 1 156 156 GLU CA C 13 58.100 0.200 . 1 . . . . . 153 GLU CA . 50921 1 575 . 1 . 1 156 156 GLU CB C 13 28.500 0.200 . 1 . . . . . 153 GLU CB . 50921 1 576 . 1 . 1 156 156 GLU N N 15 119.721 0.20 . 1 . . . . . 153 GLU N . 50921 1 577 . 1 . 1 157 157 GLN H H 1 7.774 0.02 . 1 . . . . . 154 GLN H . 50921 1 578 . 1 . 1 157 157 GLN C C 13 177.826 0.20 . 1 . . . . . 154 GLN C . 50921 1 579 . 1 . 1 157 157 GLN CA C 13 56.600 0.200 . 1 . . . . . 154 GLN CA . 50921 1 580 . 1 . 1 157 157 GLN CB C 13 28.500 0.200 . 1 . . . . . 154 GLN CB . 50921 1 581 . 1 . 1 157 157 GLN N N 15 118.354 0.20 . 1 . . . . . 154 GLN N . 50921 1 582 . 1 . 1 158 158 LEU H H 1 8.334 0.02 . 1 . . . . . 155 LEU H . 50921 1 583 . 1 . 1 158 158 LEU C C 13 178.985 0.20 . 1 . . . . . 155 LEU C . 50921 1 584 . 1 . 1 158 158 LEU CA C 13 56.900 0.200 . 1 . . . . . 155 LEU CA . 50921 1 585 . 1 . 1 158 158 LEU CB C 13 40.600 0.200 . 1 . . . . . 155 LEU CB . 50921 1 586 . 1 . 1 158 158 LEU N N 15 122.939 0.20 . 1 . . . . . 155 LEU N . 50921 1 587 . 1 . 1 159 159 LEU H H 1 7.678 0.02 . 1 . . . . . 156 LEU H . 50921 1 588 . 1 . 1 159 159 LEU C C 13 177.090 0.20 . 1 . . . . . 156 LEU C . 50921 1 589 . 1 . 1 159 159 LEU CA C 13 56.900 0.200 . 1 . . . . . 156 LEU CA . 50921 1 590 . 1 . 1 159 159 LEU CB C 13 39.800 0.200 . 1 . . . . . 156 LEU CB . 50921 1 591 . 1 . 1 159 159 LEU N N 15 120.268 0.20 . 1 . . . . . 156 LEU N . 50921 1 592 . 1 . 1 160 160 THR H H 1 7.398 0.02 . 1 . . . . . 157 THR H . 50921 1 593 . 1 . 1 160 160 THR C C 13 175.842 0.20 . 1 . . . . . 157 THR C . 50921 1 594 . 1 . 1 160 160 THR CA C 13 65.700 0.200 . 1 . . . . . 157 THR CA . 50921 1 595 . 1 . 1 160 160 THR N N 15 117.612 0.20 . 1 . . . . . 157 THR N . 50921 1 596 . 1 . 1 161 161 LEU H H 1 8.114 0.02 . 1 . . . . . 158 LEU H . 50921 1 597 . 1 . 1 161 161 LEU C C 13 176.444 0.20 . 1 . . . . . 158 LEU C . 50921 1 598 . 1 . 1 161 161 LEU CA C 13 56.900 0.200 . 1 . . . . . 158 LEU CA . 50921 1 599 . 1 . 1 161 161 LEU N N 15 122.390 0.20 . 1 . . . . . 158 LEU N . 50921 1 600 . 1 . 1 162 162 ALA H H 1 8.329 0.02 . 1 . . . . . 159 ALA H . 50921 1 601 . 1 . 1 162 162 ALA C C 13 178.852 0.20 . 1 . . . . . 159 ALA C . 50921 1 602 . 1 . 1 162 162 ALA CA C 13 54.000 0.200 . 1 . . . . . 159 ALA CA . 50921 1 603 . 1 . 1 162 162 ALA N N 15 119.721 0.20 . 1 . . . . . 159 ALA N . 50921 1 604 . 1 . 1 163 163 SER H H 1 7.336 0.02 . 1 . . . . . 160 SER H . 50921 1 605 . 1 . 1 163 163 SER C C 13 176.867 0.20 . 1 . . . . . 160 SER C . 50921 1 606 . 1 . 1 163 163 SER CA C 13 60.900 0.200 . 1 . . . . . 160 SER CA . 50921 1 607 . 1 . 1 163 163 SER N N 15 111.518 0.20 . 1 . . . . . 160 SER N . 50921 1 608 . 1 . 1 164 164 ILE H H 1 7.480 0.02 . 1 . . . . . 161 ILE H . 50921 1 609 . 1 . 1 164 164 ILE C C 13 178.027 0.20 . 1 . . . . . 161 ILE C . 50921 1 610 . 1 . 1 164 164 ILE CA C 13 63.400 0.200 . 1 . . . . . 161 ILE CA . 50921 1 611 . 1 . 1 164 164 ILE CB C 13 36.900 0.200 . 1 . . . . . 161 ILE CB . 50921 1 612 . 1 . 1 164 164 ILE N N 15 124.252 0.20 . 1 . . . . . 161 ILE N . 50921 1 613 . 1 . 1 165 165 LEU H H 1 8.069 0.02 . 1 . . . . . 162 LEU H . 50921 1 614 . 1 . 1 165 165 LEU C C 13 179.610 0.20 . 1 . . . . . 162 LEU C . 50921 1 615 . 1 . 1 165 165 LEU CA C 13 56.300 0.200 . 1 . . . . . 162 LEU CA . 50921 1 616 . 1 . 1 165 165 LEU N N 15 120.112 0.20 . 1 . . . . . 162 LEU N . 50921 1 617 . 1 . 1 166 166 ARG H H 1 8.076 0.02 . 1 . . . . . 163 ARG H . 50921 1 618 . 1 . 1 166 166 ARG C C 13 180.925 0.20 . 1 . . . . . 163 ARG C . 50921 1 619 . 1 . 1 166 166 ARG CA C 13 58.600 0.200 . 1 . . . . . 163 ARG CA . 50921 1 620 . 1 . 1 166 166 ARG CD C 13 43.300 0.200 . 1 . . . . . 163 ARG CD . 50921 1 621 . 1 . 1 166 166 ARG N N 15 117.963 0.20 . 1 . . . . . 163 ARG N . 50921 1 622 . 1 . 1 167 167 GLU H H 1 7.548 0.02 . 1 . . . . . 164 GLU H . 50921 1 623 . 1 . 1 167 167 GLU C C 13 177.737 0.20 . 1 . . . . . 164 GLU C . 50921 1 624 . 1 . 1 167 167 GLU CA C 13 58.100 0.200 . 1 . . . . . 164 GLU CA . 50921 1 625 . 1 . 1 167 167 GLU N N 15 121.752 0.20 . 1 . . . . . 164 GLU N . 50921 1 626 . 1 . 1 168 168 ASP H H 1 7.726 0.02 . 1 . . . . . 165 ASP H . 50921 1 627 . 1 . 1 168 168 ASP C C 13 176.377 0.20 . 1 . . . . . 165 ASP C . 50921 1 628 . 1 . 1 168 168 ASP CA C 13 53.300 0.200 . 1 . . . . . 165 ASP CA . 50921 1 629 . 1 . 1 168 168 ASP CB C 13 40.200 0.200 . 1 . . . . . 165 ASP CB . 50921 1 630 . 1 . 1 168 168 ASP N N 15 118.627 0.20 . 1 . . . . . 165 ASP N . 50921 1 631 . 1 . 1 169 169 GLY H H 1 7.644 0.02 . 1 . . . . . 166 GLY H . 50921 1 632 . 1 . 1 169 169 GLY C C 13 174.794 0.20 . 1 . . . . . 166 GLY C . 50921 1 633 . 1 . 1 169 169 GLY CA C 13 45.100 0.200 . 1 . . . . . 166 GLY CA . 50921 1 634 . 1 . 1 169 169 GLY N N 15 109.174 0.20 . 1 . . . . . 166 GLY N . 50921 1 635 . 1 . 1 170 170 LYS H H 1 7.856 0.02 . 1 . . . . . 167 LYS H . 50921 1 636 . 1 . 1 170 170 LYS C C 13 175.240 0.20 . 1 . . . . . 167 LYS C . 50921 1 637 . 1 . 1 170 170 LYS CE C 13 42.100 0.200 . 1 . . . . . 167 LYS CE . 50921 1 638 . 1 . 1 170 170 LYS N N 15 118.979 0.20 . 1 . . . . . 167 LYS N . 50921 1 639 . 1 . 1 171 171 VAL H H 1 8.541 0.02 . 1 . . . . . 168 VAL H . 50921 1 640 . 1 . 1 171 171 VAL C C 13 174.727 0.20 . 1 . . . . . 168 VAL C . 50921 1 641 . 1 . 1 171 171 VAL CA C 13 61.500 0.200 . 1 . . . . . 168 VAL CA . 50921 1 642 . 1 . 1 171 171 VAL CB C 13 30.800 0.200 . 1 . . . . . 168 VAL CB . 50921 1 643 . 1 . 1 171 171 VAL N N 15 121.870 0.20 . 1 . . . . . 168 VAL N . 50921 1 644 . 1 . 1 172 172 PHE H H 1 7.240 0.02 . 1 . . . . . 169 PHE H . 50921 1 645 . 1 . 1 172 172 PHE C C 13 173.706 0.20 . 1 . . . . . 169 PHE C . 50921 1 646 . 1 . 1 172 172 PHE CB C 13 41.400 0.200 . 1 . . . . . 169 PHE CB . 50921 1 647 . 1 . 1 172 172 PHE N N 15 122.221 0.20 . 1 . . . . . 169 PHE N . 50921 1 648 . 1 . 1 173 173 ASP H H 1 8.668 0.02 . 1 . . . . . 170 ASP H . 50921 1 649 . 1 . 1 173 173 ASP C C 13 176.934 0.20 . 1 . . . . . 170 ASP C . 50921 1 650 . 1 . 1 173 173 ASP CA C 13 52.800 0.200 . 1 . . . . . 170 ASP CA . 50921 1 651 . 1 . 1 173 173 ASP CB C 13 40.700 0.200 . 1 . . . . . 170 ASP CB . 50921 1 652 . 1 . 1 173 173 ASP N N 15 120.826 0.20 . 1 . . . . . 170 ASP N . 50921 1 653 . 1 . 1 174 174 GLU H H 1 8.802 0.02 . 1 . . . . . 171 GLU H . 50921 1 654 . 1 . 1 174 174 GLU C C 13 177.258 0.20 . 1 . . . . . 171 GLU C . 50921 1 655 . 1 . 1 174 174 GLU CA C 13 56.300 0.200 . 1 . . . . . 171 GLU CA . 50921 1 656 . 1 . 1 174 174 GLU CB C 13 28.400 0.200 . 1 . . . . . 171 GLU CB . 50921 1 657 . 1 . 1 174 174 GLU N N 15 126.284 0.20 . 1 . . . . . 171 GLU N . 50921 1 658 . 1 . 1 175 175 LYS H H 1 8.897 0.02 . 1 . . . . . 172 LYS H . 50921 1 659 . 1 . 1 175 175 LYS C C 13 176.065 0.20 . 1 . . . . . 172 LYS C . 50921 1 660 . 1 . 1 175 175 LYS CA C 13 56.800 0.200 . 1 . . . . . 172 LYS CA . 50921 1 661 . 1 . 1 175 175 LYS CB C 13 32.700 0.200 . 1 . . . . . 172 LYS CB . 50921 1 662 . 1 . 1 175 175 LYS CE C 13 42.100 0.200 . 1 . . . . . 172 LYS CE . 50921 1 663 . 1 . 1 175 175 LYS N N 15 119.565 0.20 . 1 . . . . . 172 LYS N . 50921 1 664 . 1 . 1 176 176 VAL H H 1 6.959 0.02 . 1 . . . . . 173 VAL H . 50921 1 665 . 1 . 1 176 176 VAL C C 13 175.195 0.20 . 1 . . . . . 173 VAL C . 50921 1 666 . 1 . 1 176 176 VAL CA C 13 58.100 0.200 . 1 . . . . . 173 VAL CA . 50921 1 667 . 1 . 1 176 176 VAL N N 15 109.838 0.20 . 1 . . . . . 173 VAL N . 50921 1 668 . 1 . 1 177 177 TYR H H 1 7.261 0.02 . 1 . . . . . 174 TYR H . 50921 1 669 . 1 . 1 177 177 TYR C C 13 172.073 0.20 . 1 . . . . . 174 TYR C . 50921 1 670 . 1 . 1 177 177 TYR CA C 13 56.300 0.200 . 1 . . . . . 174 TYR CA . 50921 1 671 . 1 . 1 177 177 TYR CB C 13 38.900 0.200 . 1 . . . . . 174 TYR CB . 50921 1 672 . 1 . 1 177 177 TYR N N 15 114.721 0.20 . 1 . . . . . 174 TYR N . 50921 1 673 . 1 . 1 178 178 TYR H H 1 8.610 0.02 . 1 . . . . . 175 TYR H . 50921 1 674 . 1 . 1 178 178 TYR CA C 13 55.000 0.200 . 1 . . . . . 175 TYR CA . 50921 1 675 . 1 . 1 178 178 TYR N N 15 114.643 0.20 . 1 . . . . . 175 TYR N . 50921 1 676 . 1 . 1 179 179 THR C C 13 172.118 0.20 . 1 . . . . . 176 THR C . 50921 1 677 . 1 . 1 179 179 THR CA C 13 59.100 0.200 . 1 . . . . . 176 THR CA . 50921 1 678 . 1 . 1 179 179 THR CB C 13 69.100 0.200 . 1 . . . . . 176 THR CB . 50921 1 679 . 1 . 1 180 180 ALA H H 1 7.932 0.02 . 1 . . . . . 177 ALA H . 50921 1 680 . 1 . 1 180 180 ALA C C 13 174.325 0.20 . 1 . . . . . 177 ALA C . 50921 1 681 . 1 . 1 180 180 ALA CA C 13 50.200 0.200 . 1 . . . . . 177 ALA CA . 50921 1 682 . 1 . 1 180 180 ALA CB C 13 19.800 0.200 . 1 . . . . . 177 ALA CB . 50921 1 683 . 1 . 1 180 180 ALA N N 15 122.065 0.20 . 1 . . . . . 177 ALA N . 50921 1 684 . 1 . 1 181 181 GLY H H 1 8.808 0.02 . 1 . . . . . 178 GLY H . 50921 1 685 . 1 . 1 181 181 GLY CA C 13 44.600 0.200 . 1 . . . . . 178 GLY CA . 50921 1 686 . 1 . 1 181 181 GLY N N 15 111.909 0.20 . 1 . . . . . 178 GLY N . 50921 1 687 . 1 . 1 182 182 TYR H H 1 9.112 0.02 . 1 . . . . . 179 TYR H . 50921 1 688 . 1 . 1 182 182 TYR C C 13 174.794 0.20 . 1 . . . . . 179 TYR C . 50921 1 689 . 1 . 1 182 182 TYR CA C 13 58.800 0.200 . 1 . . . . . 179 TYR CA . 50921 1 690 . 1 . 1 182 182 TYR CB C 13 38.600 0.200 . 1 . . . . . 179 TYR CB . 50921 1 691 . 1 . 1 182 182 TYR N N 15 125.145 0.20 . 1 . . . . . 179 TYR N . 50921 1 692 . 1 . 1 183 183 ASN H H 1 8.315 0.02 . 1 . . . . . 180 ASN H . 50921 1 693 . 1 . 1 183 183 ASN C C 13 173.723 0.20 . 1 . . . . . 180 ASN C . 50921 1 694 . 1 . 1 183 183 ASN CA C 13 51.900 0.200 . 1 . . . . . 180 ASN CA . 50921 1 695 . 1 . 1 183 183 ASN CB C 13 38.600 0.200 . 1 . . . . . 180 ASN CB . 50921 1 696 . 1 . 1 183 183 ASN N N 15 114.799 0.20 . 1 . . . . . 180 ASN N . 50921 1 697 . 1 . 1 184 184 SER H H 1 7.021 0.02 . 1 . . . . . 181 SER H . 50921 1 698 . 1 . 1 184 184 SER CB C 13 63.400 0.200 . 1 . . . . . 181 SER CB . 50921 1 699 . 1 . 1 184 184 SER N N 15 114.370 0.20 . 1 . . . . . 181 SER N . 50921 1 700 . 1 . 1 185 185 PRO C C 13 176.979 0.20 . 1 . . . . . 182 PRO C . 50921 1 701 . 1 . 1 186 186 VAL H H 1 9.528 0.02 . 1 . . . . . 183 VAL H . 50921 1 702 . 1 . 1 186 186 VAL C C 13 174.883 0.20 . 1 . . . . . 183 VAL C . 50921 1 703 . 1 . 1 186 186 VAL CA C 13 62.200 0.200 . 1 . . . . . 183 VAL CA . 50921 1 704 . 1 . 1 186 186 VAL N N 15 118.627 0.20 . 1 . . . . . 183 VAL N . 50921 1 705 . 1 . 1 187 187 LYS H H 1 7.274 0.02 . 1 . . . . . 184 LYS H . 50921 1 706 . 1 . 1 187 187 LYS C C 13 174.169 0.20 . 1 . . . . . 184 LYS C . 50921 1 707 . 1 . 1 187 187 LYS CA C 13 58.900 0.200 . 1 . . . . . 184 LYS CA . 50921 1 708 . 1 . 1 187 187 LYS CB C 13 32.700 0.200 . 1 . . . . . 184 LYS CB . 50921 1 709 . 1 . 1 187 187 LYS CE C 13 42.100 0.200 . 1 . . . . . 184 LYS CE . 50921 1 710 . 1 . 1 187 187 LYS N N 15 120.424 0.20 . 1 . . . . . 184 LYS N . 50921 1 711 . 1 . 1 188 188 LEU H H 1 8.356 0.02 . 1 . . . . . 185 LEU H . 50921 1 712 . 1 . 1 188 188 LEU C C 13 175.061 0.20 . 1 . . . . . 185 LEU C . 50921 1 713 . 1 . 1 188 188 LEU CA C 13 55.700 0.200 . 1 . . . . . 185 LEU CA . 50921 1 714 . 1 . 1 188 188 LEU N N 15 126.206 0.20 . 1 . . . . . 185 LEU N . 50921 1 715 . 1 . 1 189 189 LEU H H 1 8.261 0.02 . 1 . . . . . 186 LEU H . 50921 1 716 . 1 . 1 189 189 LEU C C 13 176.756 0.20 . 1 . . . . . 186 LEU C . 50921 1 717 . 1 . 1 189 189 LEU CA C 13 55.400 0.200 . 1 . . . . . 186 LEU CA . 50921 1 718 . 1 . 1 189 189 LEU CB C 13 42.600 0.200 . 1 . . . . . 186 LEU CB . 50921 1 719 . 1 . 1 189 189 LEU N N 15 129.213 0.20 . 1 . . . . . 186 LEU N . 50921 1 720 . 1 . 1 190 190 ASN H H 1 7.675 0.02 . 1 . . . . . 187 ASN H . 50921 1 721 . 1 . 1 190 190 ASN C C 13 174.504 0.20 . 1 . . . . . 187 ASN C . 50921 1 722 . 1 . 1 190 190 ASN CA C 13 52.300 0.200 . 1 . . . . . 187 ASN CA . 50921 1 723 . 1 . 1 190 190 ASN CB C 13 37.900 0.200 . 1 . . . . . 187 ASN CB . 50921 1 724 . 1 . 1 190 190 ASN N N 15 117.088 0.20 . 1 . . . . . 187 ASN N . 50921 1 725 . 1 . 1 191 191 ARG H H 1 8.297 0.02 . 1 . . . . . 188 ARG H . 50921 1 726 . 1 . 1 191 191 ARG C C 13 173.879 0.20 . 1 . . . . . 188 ARG C . 50921 1 727 . 1 . 1 191 191 ARG CA C 13 53.100 0.200 . 1 . . . . . 188 ARG CA . 50921 1 728 . 1 . 1 191 191 ARG CD C 13 43.300 0.200 . 1 . . . . . 188 ARG CD . 50921 1 729 . 1 . 1 191 191 ARG N N 15 123.131 0.20 . 1 . . . . . 188 ARG N . 50921 1 730 . 1 . 1 192 192 ASN H H 1 8.185 0.02 . 1 . . . . . 189 ASN H . 50921 1 731 . 1 . 1 192 192 ASN C C 13 175.418 0.20 . 1 . . . . . 189 ASN C . 50921 1 732 . 1 . 1 192 192 ASN CA C 13 51.700 0.200 . 1 . . . . . 189 ASN CA . 50921 1 733 . 1 . 1 192 192 ASN CB C 13 37.200 0.200 . 1 . . . . . 189 ASN CB . 50921 1 734 . 1 . 1 192 192 ASN N N 15 120.659 0.20 . 1 . . . . . 189 ASN N . 50921 1 735 . 1 . 1 193 193 ASN H H 1 8.021 0.02 . 1 . . . . . 190 ASN H . 50921 1 736 . 1 . 1 193 193 ASN C C 13 172.497 0.20 . 1 . . . . . 190 ASN C . 50921 1 737 . 1 . 1 193 193 ASN CA C 13 52.600 0.200 . 1 . . . . . 190 ASN CA . 50921 1 738 . 1 . 1 193 193 ASN CB C 13 38.800 0.200 . 1 . . . . . 190 ASN CB . 50921 1 739 . 1 . 1 193 193 ASN N N 15 117.456 0.20 . 1 . . . . . 190 ASN N . 50921 1 740 . 1 . 1 194 194 GLU H H 1 8.603 0.02 . 1 . . . . . 191 GLU H . 50921 1 741 . 1 . 1 194 194 GLU C C 13 178.314 0.20 . 1 . . . . . 191 GLU C . 50921 1 742 . 1 . 1 194 194 GLU CA C 13 53.400 0.200 . 1 . . . . . 191 GLU CA . 50921 1 743 . 1 . 1 194 194 GLU N N 15 112.416 0.20 . 1 . . . . . 191 GLU N . 50921 1 744 . 1 . 1 195 195 VAL H H 1 8.808 0.02 . 1 . . . . . 192 VAL H . 50921 1 745 . 1 . 1 195 195 VAL C C 13 173.879 0.20 . 1 . . . . . 192 VAL C . 50921 1 746 . 1 . 1 195 195 VAL CA C 13 59.800 0.200 . 1 . . . . . 192 VAL CA . 50921 1 747 . 1 . 1 195 195 VAL CB C 13 33.500 0.200 . 1 . . . . . 192 VAL CB . 50921 1 748 . 1 . 1 195 195 VAL N N 15 115.581 0.20 . 1 . . . . . 192 VAL N . 50921 1 749 . 1 . 1 196 196 TRP H H 1 9.158 0.02 . 1 . . . . . 193 TRP H . 50921 1 750 . 1 . 1 196 196 TRP C C 13 176.362 0.20 . 1 . . . . . 193 TRP C . 50921 1 751 . 1 . 1 196 196 TRP N N 15 122.573 0.20 . 1 . . . . . 193 TRP N . 50921 1 752 . 1 . 1 197 197 LEU H H 1 8.674 0.02 . 1 . . . . . 194 LEU H . 50921 1 753 . 1 . 1 197 197 LEU C C 13 175.953 0.20 . 1 . . . . . 194 LEU C . 50921 1 754 . 1 . 1 197 197 LEU CA C 13 52.200 0.200 . 1 . . . . . 194 LEU CA . 50921 1 755 . 1 . 1 197 197 LEU CB C 13 43.600 0.200 . 1 . . . . . 194 LEU CB . 50921 1 756 . 1 . 1 197 197 LEU N N 15 120.917 0.20 . 1 . . . . . 194 LEU N . 50921 1 757 . 1 . 1 198 198 ILE H H 1 10.226 0.02 . 1 . . . . . 195 ILE H . 50921 1 758 . 1 . 1 198 198 ILE C C 13 176.065 0.20 . 1 . . . . . 195 ILE C . 50921 1 759 . 1 . 1 198 198 ILE CA C 13 60.800 0.200 . 1 . . . . . 195 ILE CA . 50921 1 760 . 1 . 1 198 198 ILE CB C 13 39.300 0.200 . 1 . . . . . 195 ILE CB . 50921 1 761 . 1 . 1 198 198 ILE N N 15 123.745 0.20 . 1 . . . . . 195 ILE N . 50921 1 762 . 1 . 1 199 199 GLN H H 1 8.425 0.02 . 1 . . . . . 196 GLN H . 50921 1 763 . 1 . 1 199 199 GLN C C 13 175.284 0.20 . 1 . . . . . 196 GLN C . 50921 1 764 . 1 . 1 199 199 GLN CA C 13 56.300 0.200 . 1 . . . . . 196 GLN CA . 50921 1 765 . 1 . 1 199 199 GLN CB C 13 28.400 0.200 . 1 . . . . . 196 GLN CB . 50921 1 766 . 1 . 1 199 199 GLN N N 15 127.182 0.20 . 1 . . . . . 196 GLN N . 50921 1 767 . 1 . 1 200 200 LYS H H 1 7.822 0.02 . 1 . . . . . 197 LYS H . 50921 1 768 . 1 . 1 200 200 LYS CA C 13 56.300 0.200 . 1 . . . . . 197 LYS CA . 50921 1 769 . 1 . 1 200 200 LYS CB C 13 32.700 0.200 . 1 . . . . . 197 LYS CB . 50921 1 770 . 1 . 1 200 200 LYS CE C 13 42.100 0.200 . 1 . . . . . 197 LYS CE . 50921 1 771 . 1 . 1 200 200 LYS N N 15 128.198 0.20 . 1 . . . . . 197 LYS N . 50921 1 772 . 1 . 1 201 201 ASN C C 13 173.902 0.20 . 1 . . . . . 198 ASN C . 50921 1 773 . 1 . 1 201 201 ASN CA C 13 52.400 0.200 . 1 . . . . . 198 ASN CA . 50921 1 774 . 1 . 1 202 202 GLU H H 1 7.754 0.02 . 1 . . . . . 199 GLU H . 50921 1 775 . 1 . 1 202 202 GLU CA C 13 57.100 0.200 . 1 . . . . . 199 GLU CA . 50921 1 776 . 1 . 1 202 202 GLU CB C 13 29.500 0.200 . 1 . . . . . 199 GLU CB . 50921 1 777 . 1 . 1 202 202 GLU N N 15 126.401 0.20 . 1 . . . . . 199 GLU N . 50921 1 778 . 1 . 1 203 203 PRO C C 13 176.823 0.20 . 1 . . . . . 200 PRO C . 50921 1 779 . 1 . 1 203 203 PRO CA C 13 62.200 0.200 . 1 . . . . . 200 PRO CA . 50921 1 780 . 1 . 1 204 204 THR H H 1 8.144 0.02 . 1 . . . . . 201 THR H . 50921 1 781 . 1 . 1 204 204 THR C C 13 174.348 0.20 . 1 . . . . . 201 THR C . 50921 1 782 . 1 . 1 204 204 THR CA C 13 61.000 0.200 . 1 . . . . . 201 THR CA . 50921 1 783 . 1 . 1 204 204 THR CB C 13 68.700 0.200 . 1 . . . . . 201 THR CB . 50921 1 784 . 1 . 1 204 204 THR N N 15 115.893 0.20 . 1 . . . . . 201 THR N . 50921 1 785 . 1 . 1 205 205 LYS H H 1 8.254 0.02 . 1 . . . . . 202 LYS H . 50921 1 786 . 1 . 1 205 205 LYS C C 13 176.243 0.20 . 1 . . . . . 202 LYS C . 50921 1 787 . 1 . 1 205 205 LYS CA C 13 55.100 0.200 . 1 . . . . . 202 LYS CA . 50921 1 788 . 1 . 1 205 205 LYS CE C 13 42.100 0.200 . 1 . . . . . 202 LYS CE . 50921 1 789 . 1 . 1 205 205 LYS N N 15 124.838 0.20 . 1 . . . . . 202 LYS N . 50921 1 790 . 1 . 1 206 206 GLU H H 1 8.367 0.02 . 1 . . . . . 203 GLU H . 50921 1 791 . 1 . 1 206 206 GLU C C 13 180.011 0.20 . 1 . . . . . 203 GLU C . 50921 1 792 . 1 . 1 206 206 GLU CA C 13 55.600 0.200 . 1 . . . . . 203 GLU CA . 50921 1 793 . 1 . 1 206 206 GLU N N 15 122.939 0.20 . 1 . . . . . 203 GLU N . 50921 1 794 . 1 . 1 207 207 ASN H H 1 7.459 0.02 . 1 . . . . . 204 ASN H . 50921 1 795 . 1 . 1 207 207 ASN C C 13 173.902 0.20 . 1 . . . . . 204 ASN C . 50921 1 796 . 1 . 1 207 207 ASN N N 15 113.588 0.20 . 1 . . . . . 204 ASN N . 50921 1 797 . 1 . 1 208 208 GLU H H 1 7.754 0.02 . 1 . . . . . 205 GLU H . 50921 1 798 . 1 . 1 208 208 GLU N N 15 126.401 0.20 . 1 . . . . . 205 GLU N . 50921 1 stop_ save_