data_28088 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 28088 _Entry.Title ; dUnr CSD456 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2020-02-18 _Entry.Accession_date 2020-02-18 _Entry.Last_release_date 2020-02-18 _Entry.Original_release_date 2020-02-18 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.6.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 'Nele Merret' Hollmann . . . . 28088 2 Janosch Hennig . . . . 28088 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 28088 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 334 28088 '15N chemical shifts' 181 28088 '1H chemical shifts' 180 28088 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 2 . . 2020-08-15 2020-02-18 update BMRB 'update entry citation' 28088 1 . . 2020-07-13 2020-02-18 original author 'original release' 28088 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 28086 'Unr CSD789' 28088 BMRB 28087 'dUnr Cterminal Q-rich' 28088 BMRB 28089 'dUnr CSD6' 28088 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 28088 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 32697992 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; Pseudo-RNA binding domains mediate RNA structure specificity in Upstream of N-Ras ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Cell Rep.' _Citation.Journal_name_full 'Cell reports' _Citation.Journal_volume 32 _Citation.Journal_issue 3 _Citation.Journal_ASTM . _Citation.Journal_ISSN 2211-1247 _Citation.Journal_CSD 0353 _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 107930 _Citation.Page_last 107930 _Citation.Year 2020 _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 'Nele Merret' Hollmann . . . . 28088 1 2 'Pravin Kumar Ankush' Jagtap . . . . 28088 1 3 Pawel Masiewicz . . . . 28088 1 4 Tanit Guitart . . . . 28088 1 5 Bernd Simon . . . . 28088 1 6 Jan Provaznik . . . . 28088 1 7 Frank Stein . . . . 28088 1 8 Per Haberkant . . . . 28088 1 9 'Lara Jayne' Sweetapple . . . . 28088 1 10 Laura Villacorte . . . . 28088 1 11 Dylan Mooijman . . . . 28088 1 12 Valdimir Benes . . . . 28088 1 13 Mikhail Savitski . . . . 28088 1 14 Fatima Gebauer . . . . 28088 1 15 Janosch Hennig . . . . 28088 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 28088 _Assembly.ID 1 _Assembly.Name 'dUnr CSD456' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass 29461.36 _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 'dUnr CSD456' 1 $dUnr_CSD456 A . yes native no no . . . 28088 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_dUnr_CSD456 _Entity.Sf_category entity _Entity.Sf_framecode dUnr_CSD456 _Entity.Entry_ID 28088 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name dUnr_CSD456 _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 ; EDVDSTVYKGQVLKSLDRNN PVRQNNDPLPGRIRYRALDY SEVEVPFGDKDQKGDFTLRH GDWVQFLLATDRRDQLQRAT SIALLDETFKVSGEKREQGT IASLKEGFGFLRCVERQARL FFHFTEVLDTSREIDINDEV EFTVIQEPGLAYNNSRLQAI RIKHLPPNSVQFETLVASNI EGCVTREAPKSPIKSQDRVE GGVITYEHADVKKTIMYFLK DCEKPPRIGERVRFDIYMVK RNKECIAVNVQQVSLH ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 256 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment 'Unr E422-H677' _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 29461.36 _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 UNP Q9VSK3 . 'Upstream of N-ras, isoform A' . . . . . . . . . . . . . . 28088 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 . GLU . 28088 1 2 . ASP . 28088 1 3 . VAL . 28088 1 4 . ASP . 28088 1 5 . SER . 28088 1 6 . THR . 28088 1 7 . VAL . 28088 1 8 . TYR . 28088 1 9 . LYS . 28088 1 10 . GLY . 28088 1 11 . GLN . 28088 1 12 . VAL . 28088 1 13 . LEU . 28088 1 14 . LYS . 28088 1 15 . SER . 28088 1 16 . LEU . 28088 1 17 . ASP . 28088 1 18 . ARG . 28088 1 19 . ASN . 28088 1 20 . ASN . 28088 1 21 . PRO . 28088 1 22 . VAL . 28088 1 23 . ARG . 28088 1 24 . GLN . 28088 1 25 . ASN . 28088 1 26 . ASN . 28088 1 27 . ASP . 28088 1 28 . PRO . 28088 1 29 . LEU . 28088 1 30 . PRO . 28088 1 31 . GLY . 28088 1 32 . ARG . 28088 1 33 . ILE . 28088 1 34 . ARG . 28088 1 35 . TYR . 28088 1 36 . ARG . 28088 1 37 . ALA . 28088 1 38 . LEU . 28088 1 39 . ASP . 28088 1 40 . TYR . 28088 1 41 . SER . 28088 1 42 . GLU . 28088 1 43 . VAL . 28088 1 44 . GLU . 28088 1 45 . VAL . 28088 1 46 . PRO . 28088 1 47 . PHE . 28088 1 48 . GLY . 28088 1 49 . ASP . 28088 1 50 . LYS . 28088 1 51 . ASP . 28088 1 52 . GLN . 28088 1 53 . LYS . 28088 1 54 . GLY . 28088 1 55 . ASP . 28088 1 56 . PHE . 28088 1 57 . THR . 28088 1 58 . LEU . 28088 1 59 . ARG . 28088 1 60 . HIS . 28088 1 61 . GLY . 28088 1 62 . ASP . 28088 1 63 . TRP . 28088 1 64 . VAL . 28088 1 65 . GLN . 28088 1 66 . PHE . 28088 1 67 . LEU . 28088 1 68 . LEU . 28088 1 69 . ALA . 28088 1 70 . THR . 28088 1 71 . ASP . 28088 1 72 . ARG . 28088 1 73 . ARG . 28088 1 74 . ASP . 28088 1 75 . GLN . 28088 1 76 . LEU . 28088 1 77 . GLN . 28088 1 78 . ARG . 28088 1 79 . ALA . 28088 1 80 . THR . 28088 1 81 . SER . 28088 1 82 . ILE . 28088 1 83 . ALA . 28088 1 84 . LEU . 28088 1 85 . LEU . 28088 1 86 . ASP . 28088 1 87 . GLU . 28088 1 88 . THR . 28088 1 89 . PHE . 28088 1 90 . LYS . 28088 1 91 . VAL . 28088 1 92 . SER . 28088 1 93 . GLY . 28088 1 94 . GLU . 28088 1 95 . LYS . 28088 1 96 . ARG . 28088 1 97 . GLU . 28088 1 98 . GLN . 28088 1 99 . GLY . 28088 1 100 . THR . 28088 1 101 . ILE . 28088 1 102 . ALA . 28088 1 103 . SER . 28088 1 104 . LEU . 28088 1 105 . LYS . 28088 1 106 . GLU . 28088 1 107 . GLY . 28088 1 108 . PHE . 28088 1 109 . GLY . 28088 1 110 . PHE . 28088 1 111 . LEU . 28088 1 112 . ARG . 28088 1 113 . CYS . 28088 1 114 . VAL . 28088 1 115 . GLU . 28088 1 116 . ARG . 28088 1 117 . GLN . 28088 1 118 . ALA . 28088 1 119 . ARG . 28088 1 120 . LEU . 28088 1 121 . PHE . 28088 1 122 . PHE . 28088 1 123 . HIS . 28088 1 124 . PHE . 28088 1 125 . THR . 28088 1 126 . GLU . 28088 1 127 . VAL . 28088 1 128 . LEU . 28088 1 129 . ASP . 28088 1 130 . THR . 28088 1 131 . SER . 28088 1 132 . ARG . 28088 1 133 . GLU . 28088 1 134 . ILE . 28088 1 135 . ASP . 28088 1 136 . ILE . 28088 1 137 . ASN . 28088 1 138 . ASP . 28088 1 139 . GLU . 28088 1 140 . VAL . 28088 1 141 . GLU . 28088 1 142 . PHE . 28088 1 143 . THR . 28088 1 144 . VAL . 28088 1 145 . ILE . 28088 1 146 . GLN . 28088 1 147 . GLU . 28088 1 148 . PRO . 28088 1 149 . GLY . 28088 1 150 . LEU . 28088 1 151 . ALA . 28088 1 152 . TYR . 28088 1 153 . ASN . 28088 1 154 . ASN . 28088 1 155 . SER . 28088 1 156 . ARG . 28088 1 157 . LEU . 28088 1 158 . GLN . 28088 1 159 . ALA . 28088 1 160 . ILE . 28088 1 161 . ARG . 28088 1 162 . ILE . 28088 1 163 . LYS . 28088 1 164 . HIS . 28088 1 165 . LEU . 28088 1 166 . PRO . 28088 1 167 . PRO . 28088 1 168 . ASN . 28088 1 169 . SER . 28088 1 170 . VAL . 28088 1 171 . GLN . 28088 1 172 . PHE . 28088 1 173 . GLU . 28088 1 174 . THR . 28088 1 175 . LEU . 28088 1 176 . VAL . 28088 1 177 . ALA . 28088 1 178 . SER . 28088 1 179 . ASN . 28088 1 180 . ILE . 28088 1 181 . GLU . 28088 1 182 . GLY . 28088 1 183 . CYS . 28088 1 184 . VAL . 28088 1 185 . THR . 28088 1 186 . ARG . 28088 1 187 . GLU . 28088 1 188 . ALA . 28088 1 189 . PRO . 28088 1 190 . LYS . 28088 1 191 . SER . 28088 1 192 . PRO . 28088 1 193 . ILE . 28088 1 194 . LYS . 28088 1 195 . SER . 28088 1 196 . GLN . 28088 1 197 . ASP . 28088 1 198 . ARG . 28088 1 199 . VAL . 28088 1 200 . GLU . 28088 1 201 . GLY . 28088 1 202 . GLY . 28088 1 203 . VAL . 28088 1 204 . ILE . 28088 1 205 . THR . 28088 1 206 . TYR . 28088 1 207 . GLU . 28088 1 208 . HIS . 28088 1 209 . ALA . 28088 1 210 . ASP . 28088 1 211 . VAL . 28088 1 212 . LYS . 28088 1 213 . LYS . 28088 1 214 . THR . 28088 1 215 . ILE . 28088 1 216 . MET . 28088 1 217 . TYR . 28088 1 218 . PHE . 28088 1 219 . LEU . 28088 1 220 . LYS . 28088 1 221 . ASP . 28088 1 222 . CYS . 28088 1 223 . GLU . 28088 1 224 . LYS . 28088 1 225 . PRO . 28088 1 226 . PRO . 28088 1 227 . ARG . 28088 1 228 . ILE . 28088 1 229 . GLY . 28088 1 230 . GLU . 28088 1 231 . ARG . 28088 1 232 . VAL . 28088 1 233 . ARG . 28088 1 234 . PHE . 28088 1 235 . ASP . 28088 1 236 . ILE . 28088 1 237 . TYR . 28088 1 238 . MET . 28088 1 239 . VAL . 28088 1 240 . LYS . 28088 1 241 . ARG . 28088 1 242 . ASN . 28088 1 243 . LYS . 28088 1 244 . GLU . 28088 1 245 . CYS . 28088 1 246 . ILE . 28088 1 247 . ALA . 28088 1 248 . VAL . 28088 1 249 . ASN . 28088 1 250 . VAL . 28088 1 251 . GLN . 28088 1 252 . GLN . 28088 1 253 . VAL . 28088 1 254 . SER . 28088 1 255 . LEU . 28088 1 256 . HIS . 28088 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 . GLU 1 1 28088 1 . ASP 2 2 28088 1 . VAL 3 3 28088 1 . ASP 4 4 28088 1 . SER 5 5 28088 1 . THR 6 6 28088 1 . VAL 7 7 28088 1 . TYR 8 8 28088 1 . LYS 9 9 28088 1 . GLY 10 10 28088 1 . GLN 11 11 28088 1 . VAL 12 12 28088 1 . LEU 13 13 28088 1 . LYS 14 14 28088 1 . SER 15 15 28088 1 . LEU 16 16 28088 1 . ASP 17 17 28088 1 . ARG 18 18 28088 1 . ASN 19 19 28088 1 . ASN 20 20 28088 1 . PRO 21 21 28088 1 . VAL 22 22 28088 1 . ARG 23 23 28088 1 . GLN 24 24 28088 1 . ASN 25 25 28088 1 . ASN 26 26 28088 1 . ASP 27 27 28088 1 . PRO 28 28 28088 1 . LEU 29 29 28088 1 . PRO 30 30 28088 1 . GLY 31 31 28088 1 . ARG 32 32 28088 1 . ILE 33 33 28088 1 . ARG 34 34 28088 1 . TYR 35 35 28088 1 . ARG 36 36 28088 1 . ALA 37 37 28088 1 . LEU 38 38 28088 1 . ASP 39 39 28088 1 . TYR 40 40 28088 1 . SER 41 41 28088 1 . GLU 42 42 28088 1 . VAL 43 43 28088 1 . GLU 44 44 28088 1 . VAL 45 45 28088 1 . PRO 46 46 28088 1 . PHE 47 47 28088 1 . GLY 48 48 28088 1 . ASP 49 49 28088 1 . LYS 50 50 28088 1 . ASP 51 51 28088 1 . GLN 52 52 28088 1 . LYS 53 53 28088 1 . GLY 54 54 28088 1 . ASP 55 55 28088 1 . PHE 56 56 28088 1 . THR 57 57 28088 1 . LEU 58 58 28088 1 . ARG 59 59 28088 1 . HIS 60 60 28088 1 . GLY 61 61 28088 1 . ASP 62 62 28088 1 . TRP 63 63 28088 1 . VAL 64 64 28088 1 . GLN 65 65 28088 1 . PHE 66 66 28088 1 . LEU 67 67 28088 1 . LEU 68 68 28088 1 . ALA 69 69 28088 1 . THR 70 70 28088 1 . ASP 71 71 28088 1 . ARG 72 72 28088 1 . ARG 73 73 28088 1 . ASP 74 74 28088 1 . GLN 75 75 28088 1 . LEU 76 76 28088 1 . GLN 77 77 28088 1 . ARG 78 78 28088 1 . ALA 79 79 28088 1 . THR 80 80 28088 1 . SER 81 81 28088 1 . ILE 82 82 28088 1 . ALA 83 83 28088 1 . LEU 84 84 28088 1 . LEU 85 85 28088 1 . ASP 86 86 28088 1 . GLU 87 87 28088 1 . THR 88 88 28088 1 . PHE 89 89 28088 1 . LYS 90 90 28088 1 . VAL 91 91 28088 1 . SER 92 92 28088 1 . GLY 93 93 28088 1 . GLU 94 94 28088 1 . LYS 95 95 28088 1 . ARG 96 96 28088 1 . GLU 97 97 28088 1 . GLN 98 98 28088 1 . GLY 99 99 28088 1 . THR 100 100 28088 1 . ILE 101 101 28088 1 . ALA 102 102 28088 1 . SER 103 103 28088 1 . LEU 104 104 28088 1 . LYS 105 105 28088 1 . GLU 106 106 28088 1 . GLY 107 107 28088 1 . PHE 108 108 28088 1 . GLY 109 109 28088 1 . PHE 110 110 28088 1 . LEU 111 111 28088 1 . ARG 112 112 28088 1 . CYS 113 113 28088 1 . VAL 114 114 28088 1 . GLU 115 115 28088 1 . ARG 116 116 28088 1 . GLN 117 117 28088 1 . ALA 118 118 28088 1 . ARG 119 119 28088 1 . LEU 120 120 28088 1 . PHE 121 121 28088 1 . PHE 122 122 28088 1 . HIS 123 123 28088 1 . PHE 124 124 28088 1 . THR 125 125 28088 1 . GLU 126 126 28088 1 . VAL 127 127 28088 1 . LEU 128 128 28088 1 . ASP 129 129 28088 1 . THR 130 130 28088 1 . SER 131 131 28088 1 . ARG 132 132 28088 1 . GLU 133 133 28088 1 . ILE 134 134 28088 1 . ASP 135 135 28088 1 . ILE 136 136 28088 1 . ASN 137 137 28088 1 . ASP 138 138 28088 1 . GLU 139 139 28088 1 . VAL 140 140 28088 1 . GLU 141 141 28088 1 . PHE 142 142 28088 1 . THR 143 143 28088 1 . VAL 144 144 28088 1 . ILE 145 145 28088 1 . GLN 146 146 28088 1 . GLU 147 147 28088 1 . PRO 148 148 28088 1 . GLY 149 149 28088 1 . LEU 150 150 28088 1 . ALA 151 151 28088 1 . TYR 152 152 28088 1 . ASN 153 153 28088 1 . ASN 154 154 28088 1 . SER 155 155 28088 1 . ARG 156 156 28088 1 . LEU 157 157 28088 1 . GLN 158 158 28088 1 . ALA 159 159 28088 1 . ILE 160 160 28088 1 . ARG 161 161 28088 1 . ILE 162 162 28088 1 . LYS 163 163 28088 1 . HIS 164 164 28088 1 . LEU 165 165 28088 1 . PRO 166 166 28088 1 . PRO 167 167 28088 1 . ASN 168 168 28088 1 . SER 169 169 28088 1 . VAL 170 170 28088 1 . GLN 171 171 28088 1 . PHE 172 172 28088 1 . GLU 173 173 28088 1 . THR 174 174 28088 1 . LEU 175 175 28088 1 . VAL 176 176 28088 1 . ALA 177 177 28088 1 . SER 178 178 28088 1 . ASN 179 179 28088 1 . ILE 180 180 28088 1 . GLU 181 181 28088 1 . GLY 182 182 28088 1 . CYS 183 183 28088 1 . VAL 184 184 28088 1 . THR 185 185 28088 1 . ARG 186 186 28088 1 . GLU 187 187 28088 1 . ALA 188 188 28088 1 . PRO 189 189 28088 1 . LYS 190 190 28088 1 . SER 191 191 28088 1 . PRO 192 192 28088 1 . ILE 193 193 28088 1 . LYS 194 194 28088 1 . SER 195 195 28088 1 . GLN 196 196 28088 1 . ASP 197 197 28088 1 . ARG 198 198 28088 1 . VAL 199 199 28088 1 . GLU 200 200 28088 1 . GLY 201 201 28088 1 . GLY 202 202 28088 1 . VAL 203 203 28088 1 . ILE 204 204 28088 1 . THR 205 205 28088 1 . TYR 206 206 28088 1 . GLU 207 207 28088 1 . HIS 208 208 28088 1 . ALA 209 209 28088 1 . ASP 210 210 28088 1 . VAL 211 211 28088 1 . LYS 212 212 28088 1 . LYS 213 213 28088 1 . THR 214 214 28088 1 . ILE 215 215 28088 1 . MET 216 216 28088 1 . TYR 217 217 28088 1 . PHE 218 218 28088 1 . LEU 219 219 28088 1 . LYS 220 220 28088 1 . ASP 221 221 28088 1 . CYS 222 222 28088 1 . GLU 223 223 28088 1 . LYS 224 224 28088 1 . PRO 225 225 28088 1 . PRO 226 226 28088 1 . ARG 227 227 28088 1 . ILE 228 228 28088 1 . GLY 229 229 28088 1 . GLU 230 230 28088 1 . ARG 231 231 28088 1 . VAL 232 232 28088 1 . ARG 233 233 28088 1 . PHE 234 234 28088 1 . ASP 235 235 28088 1 . ILE 236 236 28088 1 . TYR 237 237 28088 1 . MET 238 238 28088 1 . VAL 239 239 28088 1 . LYS 240 240 28088 1 . ARG 241 241 28088 1 . ASN 242 242 28088 1 . LYS 243 243 28088 1 . GLU 244 244 28088 1 . CYS 245 245 28088 1 . ILE 246 246 28088 1 . ALA 247 247 28088 1 . VAL 248 248 28088 1 . ASN 249 249 28088 1 . VAL 250 250 28088 1 . GLN 251 251 28088 1 . GLN 252 252 28088 1 . VAL 253 253 28088 1 . SER 254 254 28088 1 . LEU 255 255 28088 1 . HIS 256 256 28088 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 28088 _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 $dUnr_CSD456 . 7227 organism . 'Drosophila melanogaster' 'fruit fly' . . Eukaryota Metazoa Drosophila melanogaster . . . . . . . . . . . . . 28088 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source _Entity_experimental_src_list.Entry_ID 28088 _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 $dUnr_CSD456 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . pETM-11 . . . 28088 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 28088 _Sample.ID 1 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'dUnr CSD456' '[U-99% 13C; U-99% 15N]' . . 1 $dUnr_CSD456 . . 0.3 . . mM . . . . 28088 1 2 'sodium chloride' 'natural abundance' . . . . . . 50 . . mM . . . . 28088 1 3 'sodium phosphate' 'natural abundance' . . . . . . 20 . . mM . . . . 28088 1 4 DTT 'natural abundance' . . . . . . 1 . . mM . . . . 28088 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 28088 _Sample_condition_list.ID 1 _Sample_condition_list.Name . _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 6.4 . pH 28088 1 pressure 1 . atm 28088 1 temperature 298 . K 28088 1 stop_ save_ ############################ # Computer software used # ############################ save_TOPSPIN _Software.Sf_category software _Software.Sf_framecode TOPSPIN _Software.Entry_ID 28088 _Software.ID 1 _Software.Type . _Software.Name TOPSPIN _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 28088 1 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . collection 28088 1 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 28088 _Software.ID 2 _Software.Type . _Software.Name NMRPipe _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 28088 2 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . processing 28088 2 stop_ save_ save_Cara _Software.Sf_category software _Software.Sf_framecode Cara _Software.Entry_ID 28088 _Software.ID 3 _Software.Type . _Software.Name Cara _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Keller and Wuthrich' . . 28088 3 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . 'chemical shift assignment' 28088 3 . 'peak picking' 28088 3 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 28088 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'Avance III' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 28088 _NMR_spectrometer_list.ID 1 _NMR_spectrometer_list.Name . loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker 'Avance III' . 800 . . . 28088 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 28088 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 28088 1 2 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 28088 1 3 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 28088 1 4 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 28088 1 5 '3D HN(CO)CA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 28088 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 28088 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name . _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 water protons . . . . ppm 4.821 internal indirect 0.251449530 . . . . . 28088 1 H 1 water protons . . . . ppm 4.821 internal direct 1 . . . . . 28088 1 N 15 water protons . . . . ppm 4.821 internal indirect 0.101329118 . . . . . 28088 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 28088 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 28088 1 2 '3D HNCA' . . . 28088 1 3 '3D HNCACB' . . . 28088 1 4 '3D CBCA(CO)NH' . . . 28088 1 5 '3D HN(CO)CA' . . . 28088 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 1 1 GLU H H 1 8.523 0.020 . 1 . . . . . 1 GLU H . 28088 1 2 . 1 . 1 1 1 GLU CA C 13 55.429 0.3 . 1 . . . . . 1 GLU CA . 28088 1 3 . 1 . 1 1 1 GLU CB C 13 29.648 0.3 . 1 . . . . . 1 GLU CB . 28088 1 4 . 1 . 1 1 1 GLU N N 15 118.412 0.3 . 1 . . . . . 1 GLU N . 28088 1 5 . 1 . 1 2 2 ASP H H 1 8.209 0.020 . 1 . . . . . 2 ASP H . 28088 1 6 . 1 . 1 2 2 ASP CA C 13 53.645 0.3 . 1 . . . . . 2 ASP CA . 28088 1 7 . 1 . 1 2 2 ASP CB C 13 41.053 0.3 . 1 . . . . . 2 ASP CB . 28088 1 8 . 1 . 1 2 2 ASP N N 15 121.176 0.3 . 1 . . . . . 2 ASP N . 28088 1 9 . 1 . 1 3 3 VAL H H 1 8.231 0.020 . 1 . . . . . 3 VAL H . 28088 1 10 . 1 . 1 3 3 VAL CA C 13 61.416 0.3 . 1 . . . . . 3 VAL CA . 28088 1 11 . 1 . 1 3 3 VAL CB C 13 32.296 0.3 . 1 . . . . . 3 VAL CB . 28088 1 12 . 1 . 1 3 3 VAL N N 15 121.978 0.3 . 1 . . . . . 3 VAL N . 28088 1 13 . 1 . 1 4 4 ASP H H 1 8.376 0.020 . 1 . . . . . 4 ASP H . 28088 1 14 . 1 . 1 4 4 ASP CA C 13 53.680 0.3 . 1 . . . . . 4 ASP CA . 28088 1 15 . 1 . 1 4 4 ASP CB C 13 40.849 0.3 . 1 . . . . . 4 ASP CB . 28088 1 16 . 1 . 1 4 4 ASP N N 15 126.885 0.3 . 1 . . . . . 4 ASP N . 28088 1 17 . 1 . 1 5 5 SER H H 1 8.353 0.020 . 1 . . . . . 5 SER H . 28088 1 18 . 1 . 1 5 5 SER CA C 13 58.171 0.3 . 1 . . . . . 5 SER CA . 28088 1 19 . 1 . 1 5 5 SER CB C 13 62.890 0.3 . 1 . . . . . 5 SER CB . 28088 1 20 . 1 . 1 5 5 SER N N 15 119.422 0.3 . 1 . . . . . 5 SER N . 28088 1 21 . 1 . 1 6 6 THR H H 1 8.001 0.020 . 1 . . . . . 6 THR H . 28088 1 22 . 1 . 1 6 6 THR CA C 13 63.454 0.3 . 1 . . . . . 6 THR CA . 28088 1 23 . 1 . 1 6 6 THR CB C 13 68.615 0.3 . 1 . . . . . 6 THR CB . 28088 1 24 . 1 . 1 6 6 THR N N 15 121.268 0.3 . 1 . . . . . 6 THR N . 28088 1 25 . 1 . 1 7 7 VAL H H 1 7.923 0.020 . 1 . . . . . 7 VAL H . 28088 1 26 . 1 . 1 7 7 VAL CA C 13 61.690 0.3 . 1 . . . . . 7 VAL CA . 28088 1 27 . 1 . 1 7 7 VAL CB C 13 30.938 0.3 . 1 . . . . . 7 VAL CB . 28088 1 28 . 1 . 1 7 7 VAL N N 15 125.887 0.3 . 1 . . . . . 7 VAL N . 28088 1 29 . 1 . 1 8 8 TYR H H 1 8.338 0.020 . 1 . . . . . 8 TYR H . 28088 1 30 . 1 . 1 8 8 TYR CA C 13 57.210 0.3 . 1 . . . . . 8 TYR CA . 28088 1 31 . 1 . 1 8 8 TYR CB C 13 40.781 0.3 . 1 . . . . . 8 TYR CB . 28088 1 32 . 1 . 1 8 8 TYR N N 15 128.575 0.3 . 1 . . . . . 8 TYR N . 28088 1 33 . 1 . 1 9 9 LYS H H 1 7.990 0.020 . 1 . . . . . 9 LYS H . 28088 1 34 . 1 . 1 9 9 LYS CA C 13 53.900 0.3 . 1 . . . . . 9 LYS CA . 28088 1 35 . 1 . 1 9 9 LYS CB C 13 34.468 0.3 . 1 . . . . . 9 LYS CB . 28088 1 36 . 1 . 1 9 9 LYS N N 15 117.587 0.3 . 1 . . . . . 9 LYS N . 28088 1 37 . 1 . 1 10 10 GLY H H 1 9.358 0.020 . 1 . . . . . 10 GLY H . 28088 1 38 . 1 . 1 10 10 GLY CA C 13 45.058 0.3 . 1 . . . . . 10 GLY CA . 28088 1 39 . 1 . 1 10 10 GLY N N 15 110.605 0.3 . 1 . . . . . 10 GLY N . 28088 1 40 . 1 . 1 11 11 GLN H H 1 8.601 0.020 . 1 . . . . . 11 GLN H . 28088 1 41 . 1 . 1 11 11 GLN CA C 13 52.117 0.3 . 1 . . . . . 11 GLN CA . 28088 1 42 . 1 . 1 11 11 GLN CB C 13 31.481 0.3 . 1 . . . . . 11 GLN CB . 28088 1 43 . 1 . 1 11 11 GLN N N 15 118.254 0.3 . 1 . . . . . 11 GLN N . 28088 1 44 . 1 . 1 25 25 ASN H H 1 9.401 0.020 . 1 . . . . . 25 ASN H . 28088 1 45 . 1 . 1 25 25 ASN CA C 13 53.390 0.3 . 1 . . . . . 25 ASN CA . 28088 1 46 . 1 . 1 25 25 ASN N N 15 120.623 0.3 . 1 . . . . . 25 ASN N . 28088 1 47 . 1 . 1 26 26 ASN H H 1 8.293 0.020 . 1 . . . . . 26 ASN H . 28088 1 48 . 1 . 1 26 26 ASN CA C 13 52.897 0.3 . 1 . . . . . 26 ASN CA . 28088 1 49 . 1 . 1 26 26 ASN CB C 13 37.862 0.3 . 1 . . . . . 26 ASN CB . 28088 1 50 . 1 . 1 26 26 ASN N N 15 117.940 0.3 . 1 . . . . . 26 ASN N . 28088 1 51 . 1 . 1 27 27 ASP H H 1 7.842 0.020 . 1 . . . . . 27 ASP H . 28088 1 52 . 1 . 1 27 27 ASP CA C 13 51.352 0.3 . 1 . . . . . 27 ASP CA . 28088 1 53 . 1 . 1 27 27 ASP CB C 13 40.578 0.3 . 1 . . . . . 27 ASP CB . 28088 1 54 . 1 . 1 27 27 ASP N N 15 121.436 0.3 . 1 . . . . . 27 ASP N . 28088 1 55 . 1 . 1 31 31 GLY H H 1 7.831 0.020 . 1 . . . . . 31 GLY H . 28088 1 56 . 1 . 1 31 31 GLY N N 15 108.338 0.3 . 1 . . . . . 31 GLY N . 28088 1 57 . 1 . 1 32 32 ARG H H 1 8.755 0.020 . 1 . . . . . 32 ARG H . 28088 1 58 . 1 . 1 32 32 ARG CA C 13 54.155 0.3 . 1 . . . . . 32 ARG CA . 28088 1 59 . 1 . 1 32 32 ARG CB C 13 34.672 0.3 . 1 . . . . . 32 ARG CB . 28088 1 60 . 1 . 1 32 32 ARG N N 15 120.906 0.3 . 1 . . . . . 32 ARG N . 28088 1 61 . 1 . 1 33 33 ILE H H 1 9.342 0.020 . 1 . . . . . 33 ILE H . 28088 1 62 . 1 . 1 33 33 ILE CA C 13 59.179 0.3 . 1 . . . . . 33 ILE CA . 28088 1 63 . 1 . 1 33 33 ILE CB C 13 41.800 0.3 . 1 . . . . . 33 ILE CB . 28088 1 64 . 1 . 1 33 33 ILE N N 15 127.967 0.3 . 1 . . . . . 33 ILE N . 28088 1 65 . 1 . 1 34 34 ARG H H 1 8.852 0.020 . 1 . . . . . 34 ARG H . 28088 1 66 . 1 . 1 34 34 ARG CA C 13 53.544 0.3 . 1 . . . . . 34 ARG CA . 28088 1 67 . 1 . 1 34 34 ARG CB C 13 32.296 0.3 . 1 . . . . . 34 ARG CB . 28088 1 68 . 1 . 1 34 34 ARG N N 15 126.622 0.3 . 1 . . . . . 34 ARG N . 28088 1 69 . 1 . 1 35 35 TYR H H 1 9.618 0.020 . 1 . . . . . 35 TYR H . 28088 1 70 . 1 . 1 35 35 TYR CA C 13 55.173 0.3 . 1 . . . . . 35 TYR CA . 28088 1 71 . 1 . 1 35 35 TYR CB C 13 42.614 0.3 . 1 . . . . . 35 TYR CB . 28088 1 72 . 1 . 1 35 35 TYR N N 15 127.292 0.3 . 1 . . . . . 35 TYR N . 28088 1 73 . 1 . 1 36 36 ARG H H 1 8.498 0.020 . 1 . . . . . 36 ARG H . 28088 1 74 . 1 . 1 36 36 ARG CA C 13 53.645 0.3 . 1 . . . . . 36 ARG CA . 28088 1 75 . 1 . 1 36 36 ARG CB C 13 29.852 0.3 . 1 . . . . . 36 ARG CB . 28088 1 76 . 1 . 1 36 36 ARG N N 15 120.100 0.3 . 1 . . . . . 36 ARG N . 28088 1 77 . 1 . 1 37 37 ALA H H 1 8.681 0.020 . 1 . . . . . 37 ALA H . 28088 1 78 . 1 . 1 37 37 ALA CA C 13 50.625 0.3 . 1 . . . . . 37 ALA CA . 28088 1 79 . 1 . 1 37 37 ALA CB C 13 18.990 0.3 . 1 . . . . . 37 ALA CB . 28088 1 80 . 1 . 1 37 37 ALA N N 15 128.977 0.3 . 1 . . . . . 37 ALA N . 28088 1 81 . 1 . 1 38 38 LEU H H 1 8.625 0.020 . 1 . . . . . 38 LEU H . 28088 1 82 . 1 . 1 38 38 LEU CA C 13 57.180 0.3 . 1 . . . . . 38 LEU CA . 28088 1 83 . 1 . 1 38 38 LEU CB C 13 40.238 0.3 . 1 . . . . . 38 LEU CB . 28088 1 84 . 1 . 1 38 38 LEU N N 15 121.313 0.3 . 1 . . . . . 38 LEU N . 28088 1 85 . 1 . 1 39 39 ASP H H 1 7.673 0.020 . 1 . . . . . 39 ASP H . 28088 1 86 . 1 . 1 39 39 ASP CA C 13 52.690 0.3 . 1 . . . . . 39 ASP CA . 28088 1 87 . 1 . 1 39 39 ASP CB C 13 38.881 0.3 . 1 . . . . . 39 ASP CB . 28088 1 88 . 1 . 1 39 39 ASP N N 15 116.053 0.3 . 1 . . . . . 39 ASP N . 28088 1 89 . 1 . 1 40 40 TYR H H 1 8.122 0.020 . 1 . . . . . 40 TYR H . 28088 1 90 . 1 . 1 40 40 TYR CA C 13 60.174 0.3 . 1 . . . . . 40 TYR CA . 28088 1 91 . 1 . 1 40 40 TYR CB C 13 35.486 0.3 . 1 . . . . . 40 TYR CB . 28088 1 92 . 1 . 1 40 40 TYR N N 15 114.715 0.3 . 1 . . . . . 40 TYR N . 28088 1 93 . 1 . 1 41 41 SER H H 1 8.105 0.020 . 1 . . . . . 41 SER H . 28088 1 94 . 1 . 1 41 41 SER CA C 13 58.645 0.3 . 1 . . . . . 41 SER CA . 28088 1 95 . 1 . 1 41 41 SER N N 15 117.790 0.3 . 1 . . . . . 41 SER N . 28088 1 96 . 1 . 1 42 42 GLU H H 1 8.467 0.020 . 1 . . . . . 42 GLU H . 28088 1 97 . 1 . 1 42 42 GLU CA C 13 55.397 0.3 . 1 . . . . . 42 GLU CA . 28088 1 98 . 1 . 1 42 42 GLU CB C 13 29.987 0.3 . 1 . . . . . 42 GLU CB . 28088 1 99 . 1 . 1 42 42 GLU N N 15 121.504 0.3 . 1 . . . . . 42 GLU N . 28088 1 100 . 1 . 1 43 43 VAL H H 1 8.725 0.020 . 1 . . . . . 43 VAL H . 28088 1 101 . 1 . 1 43 43 VAL CA C 13 60.174 0.3 . 1 . . . . . 43 VAL CA . 28088 1 102 . 1 . 1 43 43 VAL CB C 13 33.993 0.3 . 1 . . . . . 43 VAL CB . 28088 1 103 . 1 . 1 43 43 VAL N N 15 126.349 0.3 . 1 . . . . . 43 VAL N . 28088 1 104 . 1 . 1 44 44 GLU H H 1 8.187 0.020 . 1 . . . . . 44 GLU H . 28088 1 105 . 1 . 1 44 44 GLU CA C 13 53.677 0.3 . 1 . . . . . 44 GLU CA . 28088 1 106 . 1 . 1 44 44 GLU CB C 13 31.549 0.3 . 1 . . . . . 44 GLU CB . 28088 1 107 . 1 . 1 44 44 GLU N N 15 122.427 0.3 . 1 . . . . . 44 GLU N . 28088 1 108 . 1 . 1 45 45 VAL H H 1 9.304 0.020 . 1 . . . . . 45 VAL H . 28088 1 109 . 1 . 1 45 45 VAL CA C 13 56.192 0.3 . 1 . . . . . 45 VAL CA . 28088 1 110 . 1 . 1 45 45 VAL CB C 13 35.011 0.3 . 1 . . . . . 45 VAL CB . 28088 1 111 . 1 . 1 45 45 VAL N N 15 122.116 0.3 . 1 . . . . . 45 VAL N . 28088 1 112 . 1 . 1 47 47 PHE H H 1 7.039 0.020 . 1 . . . . . 47 PHE H . 28088 1 113 . 1 . 1 47 47 PHE CA C 13 57.148 0.3 . 1 . . . . . 47 PHE CA . 28088 1 114 . 1 . 1 47 47 PHE CB C 13 41.664 0.3 . 1 . . . . . 47 PHE CB . 28088 1 115 . 1 . 1 47 47 PHE N N 15 110.687 0.3 . 1 . . . . . 47 PHE N . 28088 1 116 . 1 . 1 48 48 GLY H H 1 10.560 0.020 . 1 . . . . . 48 GLY H . 28088 1 117 . 1 . 1 48 48 GLY CA C 13 43.582 0.3 . 1 . . . . . 48 GLY CA . 28088 1 118 . 1 . 1 48 48 GLY N N 15 111.010 0.3 . 1 . . . . . 48 GLY N . 28088 1 119 . 1 . 1 49 49 ASP H H 1 8.567 0.020 . 1 . . . . . 49 ASP H . 28088 1 120 . 1 . 1 49 49 ASP CA C 13 56.671 0.3 . 1 . . . . . 49 ASP CA . 28088 1 121 . 1 . 1 49 49 ASP CB C 13 39.967 0.3 . 1 . . . . . 49 ASP CB . 28088 1 122 . 1 . 1 49 49 ASP N N 15 119.556 0.3 . 1 . . . . . 49 ASP N . 28088 1 123 . 1 . 1 50 50 LYS H H 1 8.582 0.020 . 1 . . . . . 50 LYS H . 28088 1 124 . 1 . 1 50 50 LYS CA C 13 55.811 0.3 . 1 . . . . . 50 LYS CA . 28088 1 125 . 1 . 1 50 50 LYS CB C 13 29.852 0.3 . 1 . . . . . 50 LYS CB . 28088 1 126 . 1 . 1 50 50 LYS N N 15 117.374 0.3 . 1 . . . . . 50 LYS N . 28088 1 127 . 1 . 1 51 51 ASP H H 1 7.909 0.020 . 1 . . . . . 51 ASP H . 28088 1 128 . 1 . 1 51 51 ASP CA C 13 61.893 0.3 . 1 . . . . . 51 ASP CA . 28088 1 129 . 1 . 1 51 51 ASP N N 15 119.565 0.3 . 1 . . . . . 51 ASP N . 28088 1 130 . 1 . 1 52 52 GLN H H 1 8.119 0.020 . 1 . . . . . 52 GLN H . 28088 1 131 . 1 . 1 52 52 GLN CA C 13 55.142 0.3 . 1 . . . . . 52 GLN CA . 28088 1 132 . 1 . 1 52 52 GLN CB C 13 29.648 0.3 . 1 . . . . . 52 GLN CB . 28088 1 133 . 1 . 1 52 52 GLN N N 15 125.075 0.3 . 1 . . . . . 52 GLN N . 28088 1 134 . 1 . 1 53 53 LYS H H 1 9.361 0.020 . 1 . . . . . 53 LYS H . 28088 1 135 . 1 . 1 53 53 LYS CA C 13 56.938 0.3 . 1 . . . . . 53 LYS CA . 28088 1 136 . 1 . 1 53 53 LYS CB C 13 30.666 0.3 . 1 . . . . . 53 LYS CB . 28088 1 137 . 1 . 1 53 53 LYS N N 15 126.145 0.3 . 1 . . . . . 53 LYS N . 28088 1 138 . 1 . 1 54 54 GLY H H 1 7.315 0.020 . 1 . . . . . 54 GLY H . 28088 1 139 . 1 . 1 54 54 GLY CA C 13 43.136 0.3 . 1 . . . . . 54 GLY CA . 28088 1 140 . 1 . 1 54 54 GLY N N 15 108.123 0.3 . 1 . . . . . 54 GLY N . 28088 1 141 . 1 . 1 55 55 ASP H H 1 8.475 0.020 . 1 . . . . . 55 ASP H . 28088 1 142 . 1 . 1 55 55 ASP CA C 13 53.390 0.3 . 1 . . . . . 55 ASP CA . 28088 1 143 . 1 . 1 55 55 ASP CB C 13 39.899 0.3 . 1 . . . . . 55 ASP CB . 28088 1 144 . 1 . 1 55 55 ASP N N 15 120.542 0.3 . 1 . . . . . 55 ASP N . 28088 1 145 . 1 . 1 59 59 ARG H H 1 8.497 0.020 . 1 . . . . . 59 ARG H . 28088 1 146 . 1 . 1 59 59 ARG CA C 13 52.913 0.3 . 1 . . . . . 59 ARG CA . 28088 1 147 . 1 . 1 59 59 ARG CB C 13 31.820 0.3 . 1 . . . . . 59 ARG CB . 28088 1 148 . 1 . 1 59 59 ARG N N 15 120.405 0.3 . 1 . . . . . 59 ARG N . 28088 1 149 . 1 . 1 60 60 HIS H H 1 8.777 0.020 . 1 . . . . . 60 HIS H . 28088 1 150 . 1 . 1 60 60 HIS CA C 13 61.161 0.3 . 1 . . . . . 60 HIS CA . 28088 1 151 . 1 . 1 60 60 HIS CB C 13 37.523 0.3 . 1 . . . . . 60 HIS CB . 28088 1 152 . 1 . 1 60 60 HIS N N 15 120.022 0.3 . 1 . . . . . 60 HIS N . 28088 1 153 . 1 . 1 61 61 GLY H H 1 8.751 0.020 . 1 . . . . . 61 GLY H . 28088 1 154 . 1 . 1 61 61 GLY CA C 13 44.379 0.3 . 1 . . . . . 61 GLY CA . 28088 1 155 . 1 . 1 61 61 GLY N N 15 114.698 0.3 . 1 . . . . . 61 GLY N . 28088 1 156 . 1 . 1 64 64 VAL H H 1 8.856 0.020 . 1 . . . . . 64 VAL H . 28088 1 157 . 1 . 1 64 64 VAL CA C 13 57.753 0.3 . 1 . . . . . 64 VAL CA . 28088 1 158 . 1 . 1 64 64 VAL CB C 13 35.283 0.3 . 1 . . . . . 64 VAL CB . 28088 1 159 . 1 . 1 64 64 VAL N N 15 118.004 0.3 . 1 . . . . . 64 VAL N . 28088 1 160 . 1 . 1 65 65 GLN H H 1 8.979 0.020 . 1 . . . . . 65 GLN H . 28088 1 161 . 1 . 1 65 65 GLN CA C 13 52.339 0.3 . 1 . . . . . 65 GLN CA . 28088 1 162 . 1 . 1 65 65 GLN CB C 13 31.549 0.3 . 1 . . . . . 65 GLN CB . 28088 1 163 . 1 . 1 65 65 GLN N N 15 118.283 0.3 . 1 . . . . . 65 GLN N . 28088 1 164 . 1 . 1 66 66 PHE H H 1 8.387 0.020 . 1 . . . . . 66 PHE H . 28088 1 165 . 1 . 1 66 66 PHE CA C 13 55.912 0.3 . 1 . . . . . 66 PHE CA . 28088 1 166 . 1 . 1 66 66 PHE CB C 13 39.899 0.3 . 1 . . . . . 66 PHE CB . 28088 1 167 . 1 . 1 66 66 PHE N N 15 116.994 0.3 . 1 . . . . . 66 PHE N . 28088 1 168 . 1 . 1 67 67 LEU H H 1 8.661 0.020 . 1 . . . . . 67 LEU H . 28088 1 169 . 1 . 1 67 67 LEU CA C 13 52.394 0.3 . 1 . . . . . 67 LEU CA . 28088 1 170 . 1 . 1 67 67 LEU CB C 13 43.225 0.3 . 1 . . . . . 67 LEU CB . 28088 1 171 . 1 . 1 67 67 LEU N N 15 118.183 0.3 . 1 . . . . . 67 LEU N . 28088 1 172 . 1 . 1 68 68 LEU H H 1 9.649 0.020 . 1 . . . . . 68 LEU H . 28088 1 173 . 1 . 1 68 68 LEU CA C 13 53.340 0.3 . 1 . . . . . 68 LEU CA . 28088 1 174 . 1 . 1 68 68 LEU CB C 13 42.886 0.3 . 1 . . . . . 68 LEU CB . 28088 1 175 . 1 . 1 68 68 LEU N N 15 122.790 0.3 . 1 . . . . . 68 LEU N . 28088 1 176 . 1 . 1 69 69 ALA H H 1 9.075 0.020 . 1 . . . . . 69 ALA H . 28088 1 177 . 1 . 1 69 69 ALA CA C 13 50.082 0.3 . 1 . . . . . 69 ALA CA . 28088 1 178 . 1 . 1 69 69 ALA CB C 13 21.094 0.3 . 1 . . . . . 69 ALA CB . 28088 1 179 . 1 . 1 69 69 ALA N N 15 127.567 0.3 . 1 . . . . . 69 ALA N . 28088 1 180 . 1 . 1 70 70 THR H H 1 8.671 0.020 . 1 . . . . . 70 THR H . 28088 1 181 . 1 . 1 70 70 THR CA C 13 60.938 0.3 . 1 . . . . . 70 THR CA . 28088 1 182 . 1 . 1 70 70 THR CB C 13 69.565 0.3 . 1 . . . . . 70 THR CB . 28088 1 183 . 1 . 1 70 70 THR N N 15 116.796 0.3 . 1 . . . . . 70 THR N . 28088 1 184 . 1 . 1 71 71 ASP H H 1 8.499 0.020 . 1 . . . . . 71 ASP H . 28088 1 185 . 1 . 1 71 71 ASP CA C 13 53.680 0.3 . 1 . . . . . 71 ASP CA . 28088 1 186 . 1 . 1 71 71 ASP CB C 13 41.868 0.3 . 1 . . . . . 71 ASP CB . 28088 1 187 . 1 . 1 71 71 ASP N N 15 128.430 0.3 . 1 . . . . . 71 ASP N . 28088 1 188 . 1 . 1 72 72 ARG H H 1 8.571 0.020 . 1 . . . . . 72 ARG H . 28088 1 189 . 1 . 1 72 72 ARG CA C 13 57.371 0.3 . 1 . . . . . 72 ARG CA . 28088 1 190 . 1 . 1 72 72 ARG CB C 13 29.376 0.3 . 1 . . . . . 72 ARG CB . 28088 1 191 . 1 . 1 72 72 ARG N N 15 124.537 0.3 . 1 . . . . . 72 ARG N . 28088 1 192 . 1 . 1 73 73 ARG H H 1 8.726 0.020 . 1 . . . . . 73 ARG H . 28088 1 193 . 1 . 1 73 73 ARG CA C 13 57.753 0.3 . 1 . . . . . 73 ARG CA . 28088 1 194 . 1 . 1 73 73 ARG CB C 13 29.105 0.3 . 1 . . . . . 73 ARG CB . 28088 1 195 . 1 . 1 73 73 ARG N N 15 120.040 0.3 . 1 . . . . . 73 ARG N . 28088 1 196 . 1 . 1 74 74 ASP H H 1 9.232 0.020 . 1 . . . . . 74 ASP H . 28088 1 197 . 1 . 1 74 74 ASP CA C 13 59.314 0.3 . 1 . . . . . 74 ASP CA . 28088 1 198 . 1 . 1 74 74 ASP CB C 13 41.460 0.3 . 1 . . . . . 74 ASP CB . 28088 1 199 . 1 . 1 74 74 ASP N N 15 117.931 0.3 . 1 . . . . . 74 ASP N . 28088 1 200 . 1 . 1 75 75 GLN H H 1 8.027 0.020 . 1 . . . . . 75 GLN H . 28088 1 201 . 1 . 1 75 75 GLN CA C 13 56.384 0.3 . 1 . . . . . 75 GLN CA . 28088 1 202 . 1 . 1 75 75 GLN CB C 13 25.507 0.3 . 1 . . . . . 75 GLN CB . 28088 1 203 . 1 . 1 75 75 GLN N N 15 114.447 0.3 . 1 . . . . . 75 GLN N . 28088 1 204 . 1 . 1 76 76 LEU H H 1 7.734 0.020 . 1 . . . . . 76 LEU H . 28088 1 205 . 1 . 1 76 76 LEU CA C 13 54.630 0.3 . 1 . . . . . 76 LEU CA . 28088 1 206 . 1 . 1 76 76 LEU CB C 13 41.664 0.3 . 1 . . . . . 76 LEU CB . 28088 1 207 . 1 . 1 76 76 LEU N N 15 120.963 0.3 . 1 . . . . . 76 LEU N . 28088 1 208 . 1 . 1 77 77 GLN H H 1 8.344 0.020 . 1 . . . . . 77 GLN H . 28088 1 209 . 1 . 1 77 77 GLN CA C 13 54.664 0.3 . 1 . . . . . 77 GLN CA . 28088 1 210 . 1 . 1 77 77 GLN CB C 13 30.191 0.3 . 1 . . . . . 77 GLN CB . 28088 1 211 . 1 . 1 77 77 GLN N N 15 125.011 0.3 . 1 . . . . . 77 GLN N . 28088 1 212 . 1 . 1 78 78 ARG H H 1 8.920 0.020 . 1 . . . . . 78 ARG H . 28088 1 213 . 1 . 1 78 78 ARG CA C 13 53.104 0.3 . 1 . . . . . 78 ARG CA . 28088 1 214 . 1 . 1 78 78 ARG CB C 13 33.042 0.3 . 1 . . . . . 78 ARG CB . 28088 1 215 . 1 . 1 78 78 ARG N N 15 121.973 0.3 . 1 . . . . . 78 ARG N . 28088 1 216 . 1 . 1 79 79 ALA H H 1 8.093 0.020 . 1 . . . . . 79 ALA H . 28088 1 217 . 1 . 1 79 79 ALA CA C 13 49.887 0.3 . 1 . . . . . 79 ALA CA . 28088 1 218 . 1 . 1 79 79 ALA CB C 13 20.483 0.3 . 1 . . . . . 79 ALA CB . 28088 1 219 . 1 . 1 79 79 ALA N N 15 123.738 0.3 . 1 . . . . . 79 ALA N . 28088 1 220 . 1 . 1 80 80 THR H H 1 9.162 0.020 . 1 . . . . . 80 THR H . 28088 1 221 . 1 . 1 80 80 THR CA C 13 60.740 0.3 . 1 . . . . . 80 THR CA . 28088 1 222 . 1 . 1 80 80 THR CB C 13 71.194 0.3 . 1 . . . . . 80 THR CB . 28088 1 223 . 1 . 1 80 80 THR N N 15 111.817 0.3 . 1 . . . . . 80 THR N . 28088 1 224 . 1 . 1 81 81 SER H H 1 8.012 0.020 . 1 . . . . . 81 SER H . 28088 1 225 . 1 . 1 81 81 SER CA C 13 58.645 0.3 . 1 . . . . . 81 SER CA . 28088 1 226 . 1 . 1 81 81 SER N N 15 119.222 0.3 . 1 . . . . . 81 SER N . 28088 1 227 . 1 . 1 82 82 ILE H H 1 8.407 0.020 . 1 . . . . . 82 ILE H . 28088 1 228 . 1 . 1 82 82 ILE CA C 13 61.957 0.3 . 1 . . . . . 82 ILE CA . 28088 1 229 . 1 . 1 82 82 ILE CB C 13 38.813 0.3 . 1 . . . . . 82 ILE CB . 28088 1 230 . 1 . 1 82 82 ILE N N 15 117.409 0.3 . 1 . . . . . 82 ILE N . 28088 1 231 . 1 . 1 83 83 ALA H H 1 9.060 0.020 . 1 . . . . . 83 ALA H . 28088 1 232 . 1 . 1 83 83 ALA CA C 13 49.607 0.3 . 1 . . . . . 83 ALA CA . 28088 1 233 . 1 . 1 83 83 ALA CB C 13 21.909 0.3 . 1 . . . . . 83 ALA CB . 28088 1 234 . 1 . 1 83 83 ALA N N 15 130.318 0.3 . 1 . . . . . 83 ALA N . 28088 1 235 . 1 . 1 85 85 LEU H H 1 8.795 0.020 . 1 . . . . . 85 LEU H . 28088 1 236 . 1 . 1 85 85 LEU CA C 13 53.069 0.3 . 1 . . . . . 85 LEU CA . 28088 1 237 . 1 . 1 85 85 LEU CB C 13 41.324 0.3 . 1 . . . . . 85 LEU CB . 28088 1 238 . 1 . 1 85 85 LEU N N 15 126.213 0.3 . 1 . . . . . 85 LEU N . 28088 1 239 . 1 . 1 86 86 ASP H H 1 8.887 0.020 . 1 . . . . . 86 ASP H . 28088 1 240 . 1 . 1 86 86 ASP CA C 13 56.416 0.3 . 1 . . . . . 86 ASP CA . 28088 1 241 . 1 . 1 86 86 ASP CB C 13 40.102 0.3 . 1 . . . . . 86 ASP CB . 28088 1 242 . 1 . 1 86 86 ASP N N 15 124.937 0.3 . 1 . . . . . 86 ASP N . 28088 1 243 . 1 . 1 87 87 GLU H H 1 8.816 0.020 . 1 . . . . . 87 GLU H . 28088 1 244 . 1 . 1 87 87 GLU CA C 13 58.199 0.3 . 1 . . . . . 87 GLU CA . 28088 1 245 . 1 . 1 87 87 GLU CB C 13 28.019 0.3 . 1 . . . . . 87 GLU CB . 28088 1 246 . 1 . 1 87 87 GLU N N 15 119.892 0.3 . 1 . . . . . 87 GLU N . 28088 1 247 . 1 . 1 92 92 SER H H 1 8.611 0.020 . 1 . . . . . 92 SER H . 28088 1 248 . 1 . 1 92 92 SER CA C 13 59.409 0.3 . 1 . . . . . 92 SER CA . 28088 1 249 . 1 . 1 92 92 SER CB C 13 62.701 0.3 . 1 . . . . . 92 SER CB . 28088 1 250 . 1 . 1 92 92 SER N N 15 118.271 0.3 . 1 . . . . . 92 SER N . 28088 1 251 . 1 . 1 93 93 GLY H H 1 8.188 0.020 . 1 . . . . . 93 GLY H . 28088 1 252 . 1 . 1 93 93 GLY CA C 13 44.919 0.3 . 1 . . . . . 93 GLY CA . 28088 1 253 . 1 . 1 93 93 GLY N N 15 111.339 0.3 . 1 . . . . . 93 GLY N . 28088 1 254 . 1 . 1 94 94 GLU H H 1 8.259 0.020 . 1 . . . . . 94 GLU H . 28088 1 255 . 1 . 1 94 94 GLU CA C 13 54.951 0.3 . 1 . . . . . 94 GLU CA . 28088 1 256 . 1 . 1 94 94 GLU CB C 13 29.784 0.3 . 1 . . . . . 94 GLU CB . 28088 1 257 . 1 . 1 94 94 GLU N N 15 122.240 0.3 . 1 . . . . . 94 GLU N . 28088 1 258 . 1 . 1 95 95 LYS H H 1 8.834 0.020 . 1 . . . . . 95 LYS H . 28088 1 259 . 1 . 1 95 95 LYS CA C 13 55.445 0.3 . 1 . . . . . 95 LYS CA . 28088 1 260 . 1 . 1 95 95 LYS CB C 13 30.598 0.3 . 1 . . . . . 95 LYS CB . 28088 1 261 . 1 . 1 95 95 LYS N N 15 125.541 0.3 . 1 . . . . . 95 LYS N . 28088 1 262 . 1 . 1 96 96 ARG H H 1 8.408 0.020 . 1 . . . . . 96 ARG H . 28088 1 263 . 1 . 1 96 96 ARG CA C 13 51.236 0.3 . 1 . . . . . 96 ARG CA . 28088 1 264 . 1 . 1 96 96 ARG CB C 13 27.272 0.3 . 1 . . . . . 96 ARG CB . 28088 1 265 . 1 . 1 96 96 ARG N N 15 128.104 0.3 . 1 . . . . . 96 ARG N . 28088 1 266 . 1 . 1 97 97 GLU H H 1 8.700 0.020 . 1 . . . . . 97 GLU H . 28088 1 267 . 1 . 1 97 97 GLU CA C 13 53.390 0.3 . 1 . . . . . 97 GLU CA . 28088 1 268 . 1 . 1 97 97 GLU CB C 13 33.314 0.3 . 1 . . . . . 97 GLU CB . 28088 1 269 . 1 . 1 97 97 GLU N N 15 123.387 0.3 . 1 . . . . . 97 GLU N . 28088 1 270 . 1 . 1 99 99 GLY H H 1 8.639 0.020 . 1 . . . . . 99 GLY H . 28088 1 271 . 1 . 1 99 99 GLY CA C 13 46.098 0.3 . 1 . . . . . 99 GLY CA . 28088 1 272 . 1 . 1 99 99 GLY N N 15 107.801 0.3 . 1 . . . . . 99 GLY N . 28088 1 273 . 1 . 1 100 100 THR H H 1 9.436 0.020 . 1 . . . . . 100 THR H . 28088 1 274 . 1 . 1 100 100 THR CA C 13 57.957 0.3 . 1 . . . . . 100 THR CA . 28088 1 275 . 1 . 1 100 100 THR CB C 13 71.737 0.3 . 1 . . . . . 100 THR CB . 28088 1 276 . 1 . 1 100 100 THR N N 15 109.790 0.3 . 1 . . . . . 100 THR N . 28088 1 277 . 1 . 1 101 101 ILE H H 1 8.453 0.020 . 1 . . . . . 101 ILE H . 28088 1 278 . 1 . 1 101 101 ILE CA C 13 64.186 0.3 . 1 . . . . . 101 ILE CA . 28088 1 279 . 1 . 1 101 101 ILE CB C 13 35.554 0.3 . 1 . . . . . 101 ILE CB . 28088 1 280 . 1 . 1 101 101 ILE N N 15 120.970 0.3 . 1 . . . . . 101 ILE N . 28088 1 281 . 1 . 1 102 102 ALA H H 1 9.414 0.020 . 1 . . . . . 102 ALA H . 28088 1 282 . 1 . 1 102 102 ALA CA C 13 52.390 0.3 . 1 . . . . . 102 ALA CA . 28088 1 283 . 1 . 1 102 102 ALA CB C 13 20.415 0.3 . 1 . . . . . 102 ALA CB . 28088 1 284 . 1 . 1 102 102 ALA N N 15 134.294 0.3 . 1 . . . . . 102 ALA N . 28088 1 285 . 1 . 1 103 103 SER H H 1 7.958 0.020 . 1 . . . . . 103 SER H . 28088 1 286 . 1 . 1 103 103 SER CA C 13 57.148 0.3 . 1 . . . . . 103 SER CA . 28088 1 287 . 1 . 1 103 103 SER CB C 13 64.270 0.3 . 1 . . . . . 103 SER CB . 28088 1 288 . 1 . 1 103 103 SER N N 15 111.554 0.3 . 1 . . . . . 103 SER N . 28088 1 289 . 1 . 1 104 104 LEU H H 1 8.618 0.020 . 1 . . . . . 104 LEU H . 28088 1 290 . 1 . 1 104 104 LEU CA C 13 54.409 0.3 . 1 . . . . . 104 LEU CA . 28088 1 291 . 1 . 1 104 104 LEU CB C 13 43.768 0.3 . 1 . . . . . 104 LEU CB . 28088 1 292 . 1 . 1 104 104 LEU N N 15 123.933 0.3 . 1 . . . . . 104 LEU N . 28088 1 293 . 1 . 1 105 105 LYS H H 1 8.412 0.020 . 1 . . . . . 105 LYS H . 28088 1 294 . 1 . 1 105 105 LYS CA C 13 52.658 0.3 . 1 . . . . . 105 LYS CA . 28088 1 295 . 1 . 1 105 105 LYS CB C 13 29.241 0.3 . 1 . . . . . 105 LYS CB . 28088 1 296 . 1 . 1 105 105 LYS N N 15 124.786 0.3 . 1 . . . . . 105 LYS N . 28088 1 297 . 1 . 1 106 106 GLU H H 1 7.039 0.020 . 1 . . . . . 106 GLU H . 28088 1 298 . 1 . 1 106 106 GLU CA C 13 55.651 0.3 . 1 . . . . . 106 GLU CA . 28088 1 299 . 1 . 1 106 106 GLU CB C 13 26.661 0.3 . 1 . . . . . 106 GLU CB . 28088 1 300 . 1 . 1 106 106 GLU N N 15 120.631 0.3 . 1 . . . . . 106 GLU N . 28088 1 301 . 1 . 1 107 107 GLY H H 1 7.037 0.020 . 1 . . . . . 107 GLY H . 28088 1 302 . 1 . 1 107 107 GLY CA C 13 44.442 0.3 . 1 . . . . . 107 GLY CA . 28088 1 303 . 1 . 1 107 107 GLY N N 15 112.289 0.3 . 1 . . . . . 107 GLY N . 28088 1 304 . 1 . 1 109 109 GLY H H 1 7.416 0.020 . 1 . . . . . 109 GLY H . 28088 1 305 . 1 . 1 109 109 GLY CA C 13 44.155 0.3 . 1 . . . . . 109 GLY CA . 28088 1 306 . 1 . 1 109 109 GLY N N 15 106.633 0.3 . 1 . . . . . 109 GLY N . 28088 1 307 . 1 . 1 110 110 PHE H H 1 8.332 0.020 . 1 . . . . . 110 PHE H . 28088 1 308 . 1 . 1 110 110 PHE CA C 13 56.129 0.3 . 1 . . . . . 110 PHE CA . 28088 1 309 . 1 . 1 110 110 PHE CB C 13 43.361 0.3 . 1 . . . . . 110 PHE CB . 28088 1 310 . 1 . 1 110 110 PHE N N 15 112.970 0.3 . 1 . . . . . 110 PHE N . 28088 1 311 . 1 . 1 111 111 LEU H H 1 9.873 0.020 . 1 . . . . . 111 LEU H . 28088 1 312 . 1 . 1 111 111 LEU CA C 13 53.069 0.3 . 1 . . . . . 111 LEU CA . 28088 1 313 . 1 . 1 111 111 LEU CB C 13 42.682 0.3 . 1 . . . . . 111 LEU CB . 28088 1 314 . 1 . 1 111 111 LEU N N 15 122.984 0.3 . 1 . . . . . 111 LEU N . 28088 1 315 . 1 . 1 112 112 ARG H H 1 9.406 0.020 . 1 . . . . . 112 ARG H . 28088 1 316 . 1 . 1 112 112 ARG CA C 13 54.902 0.3 . 1 . . . . . 112 ARG CA . 28088 1 317 . 1 . 1 112 112 ARG CB C 13 29.648 0.3 . 1 . . . . . 112 ARG CB . 28088 1 318 . 1 . 1 112 112 ARG N N 15 124.055 0.3 . 1 . . . . . 112 ARG N . 28088 1 319 . 1 . 1 113 113 CYS H H 1 7.609 0.020 . 1 . . . . . 113 CYS H . 28088 1 320 . 1 . 1 113 113 CYS CA C 13 56.893 0.3 . 1 . . . . . 113 CYS CA . 28088 1 321 . 1 . 1 113 113 CYS CB C 13 28.765 0.3 . 1 . . . . . 113 CYS CB . 28088 1 322 . 1 . 1 113 113 CYS N N 15 115.835 0.3 . 1 . . . . . 113 CYS N . 28088 1 323 . 1 . 1 114 114 VAL H H 1 8.629 0.020 . 1 . . . . . 114 VAL H . 28088 1 324 . 1 . 1 114 114 VAL CA C 13 57.753 0.3 . 1 . . . . . 114 VAL CA . 28088 1 325 . 1 . 1 114 114 VAL N N 15 125.693 0.3 . 1 . . . . . 114 VAL N . 28088 1 326 . 1 . 1 116 116 ARG H H 1 9.508 0.020 . 1 . . . . . 116 ARG H . 28088 1 327 . 1 . 1 116 116 ARG CA C 13 53.748 0.3 . 1 . . . . . 116 ARG CA . 28088 1 328 . 1 . 1 116 116 ARG CB C 13 33.314 0.3 . 1 . . . . . 116 ARG CB . 28088 1 329 . 1 . 1 116 116 ARG N N 15 124.946 0.3 . 1 . . . . . 116 ARG N . 28088 1 330 . 1 . 1 117 117 GLN H H 1 8.651 0.020 . 1 . . . . . 117 GLN H . 28088 1 331 . 1 . 1 117 117 GLN CA C 13 57.403 0.3 . 1 . . . . . 117 GLN CA . 28088 1 332 . 1 . 1 117 117 GLN CB C 13 28.019 0.3 . 1 . . . . . 117 GLN CB . 28088 1 333 . 1 . 1 117 117 GLN N N 15 119.427 0.3 . 1 . . . . . 117 GLN N . 28088 1 334 . 1 . 1 118 118 ALA H H 1 8.096 0.020 . 1 . . . . . 118 ALA H . 28088 1 335 . 1 . 1 118 118 ALA CA C 13 51.384 0.3 . 1 . . . . . 118 ALA CA . 28088 1 336 . 1 . 1 118 118 ALA CB C 13 18.311 0.3 . 1 . . . . . 118 ALA CB . 28088 1 337 . 1 . 1 118 118 ALA N N 15 121.023 0.3 . 1 . . . . . 118 ALA N . 28088 1 338 . 1 . 1 119 119 ARG H H 1 8.799 0.020 . 1 . . . . . 119 ARG H . 28088 1 339 . 1 . 1 119 119 ARG CA C 13 55.431 0.3 . 1 . . . . . 119 ARG CA . 28088 1 340 . 1 . 1 119 119 ARG CB C 13 29.648 0.3 . 1 . . . . . 119 ARG CB . 28088 1 341 . 1 . 1 119 119 ARG N N 15 124.136 0.3 . 1 . . . . . 119 ARG N . 28088 1 342 . 1 . 1 120 120 LEU H H 1 8.724 0.020 . 1 . . . . . 120 LEU H . 28088 1 343 . 1 . 1 120 120 LEU CA C 13 53.422 0.3 . 1 . . . . . 120 LEU CA . 28088 1 344 . 1 . 1 120 120 LEU CB C 13 45.058 0.3 . 1 . . . . . 120 LEU CB . 28088 1 345 . 1 . 1 120 120 LEU N N 15 126.018 0.3 . 1 . . . . . 120 LEU N . 28088 1 346 . 1 . 1 121 121 PHE H H 1 8.929 0.020 . 1 . . . . . 121 PHE H . 28088 1 347 . 1 . 1 121 121 PHE CA C 13 58.364 0.3 . 1 . . . . . 121 PHE CA . 28088 1 348 . 1 . 1 121 121 PHE CB C 13 39.967 0.3 . 1 . . . . . 121 PHE CB . 28088 1 349 . 1 . 1 121 121 PHE N N 15 131.595 0.3 . 1 . . . . . 121 PHE N . 28088 1 350 . 1 . 1 122 122 PHE H H 1 7.488 0.020 . 1 . . . . . 122 PHE H . 28088 1 351 . 1 . 1 122 122 PHE CA C 13 55.662 0.3 . 1 . . . . . 122 PHE CA . 28088 1 352 . 1 . 1 122 122 PHE CB C 13 42.411 0.3 . 1 . . . . . 122 PHE CB . 28088 1 353 . 1 . 1 122 122 PHE N N 15 122.108 0.3 . 1 . . . . . 122 PHE N . 28088 1 354 . 1 . 1 123 123 HIS H H 1 9.592 0.020 . 1 . . . . . 123 HIS H . 28088 1 355 . 1 . 1 123 123 HIS CA C 13 55.174 0.3 . 1 . . . . . 123 HIS CA . 28088 1 356 . 1 . 1 123 123 HIS CB C 13 30.938 0.3 . 1 . . . . . 123 HIS CB . 28088 1 357 . 1 . 1 123 123 HIS N N 15 119.905 0.3 . 1 . . . . . 123 HIS N . 28088 1 358 . 1 . 1 124 124 PHE H H 1 8.160 0.020 . 1 . . . . . 124 PHE H . 28088 1 359 . 1 . 1 124 124 PHE CA C 13 56.893 0.3 . 1 . . . . . 124 PHE CA . 28088 1 360 . 1 . 1 124 124 PHE CB C 13 34.965 0.3 . 1 . . . . . 124 PHE CB . 28088 1 361 . 1 . 1 124 124 PHE N N 15 123.412 0.3 . 1 . . . . . 124 PHE N . 28088 1 362 . 1 . 1 125 125 THR H H 1 7.719 0.020 . 1 . . . . . 125 THR H . 28088 1 363 . 1 . 1 125 125 THR CA C 13 63.390 0.3 . 1 . . . . . 125 THR CA . 28088 1 364 . 1 . 1 125 125 THR CB C 13 67.664 0.3 . 1 . . . . . 125 THR CB . 28088 1 365 . 1 . 1 125 125 THR N N 15 108.659 0.3 . 1 . . . . . 125 THR N . 28088 1 366 . 1 . 1 126 126 GLU H H 1 7.599 0.020 . 1 . . . . . 126 GLU H . 28088 1 367 . 1 . 1 126 126 GLU CA C 13 56.002 0.3 . 1 . . . . . 126 GLU CA . 28088 1 368 . 1 . 1 126 126 GLU N N 15 117.269 0.3 . 1 . . . . . 126 GLU N . 28088 1 369 . 1 . 1 127 127 VAL H H 1 7.575 0.020 . 1 . . . . . 127 VAL H . 28088 1 370 . 1 . 1 127 127 VAL CA C 13 63.659 0.3 . 1 . . . . . 127 VAL CA . 28088 1 371 . 1 . 1 127 127 VAL CB C 13 30.259 0.3 . 1 . . . . . 127 VAL CB . 28088 1 372 . 1 . 1 127 127 VAL N N 15 121.301 0.3 . 1 . . . . . 127 VAL N . 28088 1 373 . 1 . 1 128 128 LEU H H 1 8.452 0.020 . 1 . . . . . 128 LEU H . 28088 1 374 . 1 . 1 128 128 LEU CA C 13 56.803 0.3 . 1 . . . . . 128 LEU CA . 28088 1 375 . 1 . 1 128 128 LEU CB C 13 41.053 0.3 . 1 . . . . . 128 LEU CB . 28088 1 376 . 1 . 1 128 128 LEU N N 15 128.028 0.3 . 1 . . . . . 128 LEU N . 28088 1 377 . 1 . 1 129 129 ASP H H 1 8.275 0.020 . 1 . . . . . 129 ASP H . 28088 1 378 . 1 . 1 129 129 ASP CA C 13 52.148 0.3 . 1 . . . . . 129 ASP CA . 28088 1 379 . 1 . 1 129 129 ASP CB C 13 38.948 0.3 . 1 . . . . . 129 ASP CB . 28088 1 380 . 1 . 1 129 129 ASP N N 15 116.126 0.3 . 1 . . . . . 129 ASP N . 28088 1 381 . 1 . 1 130 130 THR H H 1 7.926 0.020 . 1 . . . . . 130 THR H . 28088 1 382 . 1 . 1 130 130 THR CA C 13 62.435 0.3 . 1 . . . . . 130 THR CA . 28088 1 383 . 1 . 1 130 130 THR CB C 13 68.072 0.3 . 1 . . . . . 130 THR CB . 28088 1 384 . 1 . 1 130 130 THR N N 15 115.509 0.3 . 1 . . . . . 130 THR N . 28088 1 385 . 1 . 1 136 136 ILE H H 1 8.637 0.020 . 1 . . . . . 136 ILE H . 28088 1 386 . 1 . 1 136 136 ILE CA C 13 61.129 0.3 . 1 . . . . . 136 ILE CA . 28088 1 387 . 1 . 1 136 136 ILE CB C 13 35.758 0.3 . 1 . . . . . 136 ILE CB . 28088 1 388 . 1 . 1 136 136 ILE N N 15 120.670 0.3 . 1 . . . . . 136 ILE N . 28088 1 389 . 1 . 1 137 137 ASN H H 1 9.405 0.020 . 1 . . . . . 137 ASN H . 28088 1 390 . 1 . 1 137 137 ASN CA C 13 55.241 0.3 . 1 . . . . . 137 ASN CA . 28088 1 391 . 1 . 1 137 137 ASN CB C 13 36.097 0.3 . 1 . . . . . 137 ASN CB . 28088 1 392 . 1 . 1 137 137 ASN N N 15 118.879 0.3 . 1 . . . . . 137 ASN N . 28088 1 393 . 1 . 1 138 138 ASP H H 1 7.768 0.020 . 1 . . . . . 138 ASP H . 28088 1 394 . 1 . 1 138 138 ASP CA C 13 55.651 0.3 . 1 . . . . . 138 ASP CA . 28088 1 395 . 1 . 1 138 138 ASP CB C 13 40.238 0.3 . 1 . . . . . 138 ASP CB . 28088 1 396 . 1 . 1 138 138 ASP N N 15 121.376 0.3 . 1 . . . . . 138 ASP N . 28088 1 397 . 1 . 1 139 139 GLU H H 1 8.817 0.020 . 1 . . . . . 139 GLU H . 28088 1 398 . 1 . 1 139 139 GLU CA C 13 55.717 0.3 . 1 . . . . . 139 GLU CA . 28088 1 399 . 1 . 1 139 139 GLU CB C 13 29.580 0.3 . 1 . . . . . 139 GLU CB . 28088 1 400 . 1 . 1 139 139 GLU N N 15 124.055 0.3 . 1 . . . . . 139 GLU N . 28088 1 401 . 1 . 1 140 140 VAL H H 1 8.497 0.020 . 1 . . . . . 140 VAL H . 28088 1 402 . 1 . 1 140 140 VAL CA C 13 55.269 0.3 . 1 . . . . . 140 VAL CA . 28088 1 403 . 1 . 1 140 140 VAL N N 15 122.112 0.3 . 1 . . . . . 140 VAL N . 28088 1 404 . 1 . 1 142 142 PHE H H 1 10.175 0.020 . 1 . . . . . 142 PHE H . 28088 1 405 . 1 . 1 142 142 PHE CA C 13 54.123 0.3 . 1 . . . . . 142 PHE CA . 28088 1 406 . 1 . 1 142 142 PHE CB C 13 36.301 0.3 . 1 . . . . . 142 PHE CB . 28088 1 407 . 1 . 1 142 142 PHE N N 15 118.490 0.3 . 1 . . . . . 142 PHE N . 28088 1 408 . 1 . 1 143 143 THR H H 1 9.106 0.020 . 1 . . . . . 143 THR H . 28088 1 409 . 1 . 1 143 143 THR CA C 13 60.672 0.3 . 1 . . . . . 143 THR CA . 28088 1 410 . 1 . 1 143 143 THR N N 15 117.576 0.3 . 1 . . . . . 143 THR N . 28088 1 411 . 1 . 1 144 144 VAL H H 1 9.384 0.020 . 1 . . . . . 144 VAL H . 28088 1 412 . 1 . 1 144 144 VAL CA C 13 62.369 0.3 . 1 . . . . . 144 VAL CA . 28088 1 413 . 1 . 1 144 144 VAL CB C 13 31.685 0.3 . 1 . . . . . 144 VAL CB . 28088 1 414 . 1 . 1 144 144 VAL N N 15 128.950 0.3 . 1 . . . . . 144 VAL N . 28088 1 415 . 1 . 1 145 145 ILE H H 1 8.894 0.020 . 1 . . . . . 145 ILE H . 28088 1 416 . 1 . 1 145 145 ILE CA C 13 58.645 0.3 . 1 . . . . . 145 ILE CA . 28088 1 417 . 1 . 1 145 145 ILE CB C 13 41.596 0.3 . 1 . . . . . 145 ILE CB . 28088 1 418 . 1 . 1 145 145 ILE N N 15 122.179 0.3 . 1 . . . . . 145 ILE N . 28088 1 419 . 1 . 1 146 146 GLN H H 1 8.291 0.020 . 1 . . . . . 146 GLN H . 28088 1 420 . 1 . 1 146 146 GLN CA C 13 54.441 0.3 . 1 . . . . . 146 GLN CA . 28088 1 421 . 1 . 1 146 146 GLN CB C 13 29.376 0.3 . 1 . . . . . 146 GLN CB . 28088 1 422 . 1 . 1 146 146 GLN N N 15 120.159 0.3 . 1 . . . . . 146 GLN N . 28088 1 423 . 1 . 1 147 147 GLU H H 1 8.612 0.020 . 1 . . . . . 147 GLU H . 28088 1 424 . 1 . 1 147 147 GLU CA C 13 53.612 0.3 . 1 . . . . . 147 GLU CA . 28088 1 425 . 1 . 1 147 147 GLU CB C 13 29.784 0.3 . 1 . . . . . 147 GLU CB . 28088 1 426 . 1 . 1 147 147 GLU N N 15 127.301 0.3 . 1 . . . . . 147 GLU N . 28088 1 427 . 1 . 1 149 149 GLY H H 1 8.386 0.020 . 1 . . . . . 149 GLY H . 28088 1 428 . 1 . 1 149 149 GLY CA C 13 44.664 0.3 . 1 . . . . . 149 GLY CA . 28088 1 429 . 1 . 1 149 149 GLY N N 15 108.657 0.3 . 1 . . . . . 149 GLY N . 28088 1 430 . 1 . 1 150 150 LEU H H 1 7.988 0.020 . 1 . . . . . 150 LEU H . 28088 1 431 . 1 . 1 150 150 LEU CA C 13 54.378 0.3 . 1 . . . . . 150 LEU CA . 28088 1 432 . 1 . 1 150 150 LEU CB C 13 41.392 0.3 . 1 . . . . . 150 LEU CB . 28088 1 433 . 1 . 1 150 150 LEU N N 15 121.844 0.3 . 1 . . . . . 150 LEU N . 28088 1 434 . 1 . 1 151 151 ALA H H 1 8.219 0.020 . 1 . . . . . 151 ALA H . 28088 1 435 . 1 . 1 151 151 ALA CA C 13 51.894 0.3 . 1 . . . . . 151 ALA CA . 28088 1 436 . 1 . 1 151 151 ALA CB C 13 18.175 0.3 . 1 . . . . . 151 ALA CB . 28088 1 437 . 1 . 1 151 151 ALA N N 15 123.663 0.3 . 1 . . . . . 151 ALA N . 28088 1 438 . 1 . 1 152 152 TYR H H 1 7.946 0.020 . 1 . . . . . 152 TYR H . 28088 1 439 . 1 . 1 152 152 TYR CA C 13 57.913 0.3 . 1 . . . . . 152 TYR CA . 28088 1 440 . 1 . 1 152 152 TYR CB C 13 37.048 0.3 . 1 . . . . . 152 TYR CB . 28088 1 441 . 1 . 1 152 152 TYR N N 15 118.344 0.3 . 1 . . . . . 152 TYR N . 28088 1 442 . 1 . 1 153 153 ASN H H 1 8.112 0.020 . 1 . . . . . 153 ASN H . 28088 1 443 . 1 . 1 153 153 ASN CA C 13 52.935 0.3 . 1 . . . . . 153 ASN CA . 28088 1 444 . 1 . 1 153 153 ASN CB C 13 37.387 0.3 . 1 . . . . . 153 ASN CB . 28088 1 445 . 1 . 1 153 153 ASN N N 15 118.706 0.3 . 1 . . . . . 153 ASN N . 28088 1 446 . 1 . 1 154 154 ASN H H 1 8.130 0.020 . 1 . . . . . 154 ASN H . 28088 1 447 . 1 . 1 154 154 ASN CA C 13 52.817 0.3 . 1 . . . . . 154 ASN CA . 28088 1 448 . 1 . 1 154 154 ASN CB C 13 38.202 0.3 . 1 . . . . . 154 ASN CB . 28088 1 449 . 1 . 1 154 154 ASN N N 15 118.130 0.3 . 1 . . . . . 154 ASN N . 28088 1 450 . 1 . 1 155 155 SER H H 1 7.914 0.020 . 1 . . . . . 155 SER H . 28088 1 451 . 1 . 1 155 155 SER CA C 13 57.913 0.3 . 1 . . . . . 155 SER CA . 28088 1 452 . 1 . 1 155 155 SER CB C 13 63.116 0.3 . 1 . . . . . 155 SER CB . 28088 1 453 . 1 . 1 155 155 SER N N 15 115.184 0.3 . 1 . . . . . 155 SER N . 28088 1 454 . 1 . 1 156 156 ARG H H 1 8.227 0.020 . 1 . . . . . 156 ARG H . 28088 1 455 . 1 . 1 156 156 ARG CA C 13 55.429 0.3 . 1 . . . . . 156 ARG CA . 28088 1 456 . 1 . 1 156 156 ARG CB C 13 30.463 0.3 . 1 . . . . . 156 ARG CB . 28088 1 457 . 1 . 1 156 156 ARG N N 15 122.673 0.3 . 1 . . . . . 156 ARG N . 28088 1 458 . 1 . 1 157 157 LEU H H 1 8.087 0.020 . 1 . . . . . 157 LEU H . 28088 1 459 . 1 . 1 157 157 LEU CA C 13 53.645 0.3 . 1 . . . . . 157 LEU CA . 28088 1 460 . 1 . 1 157 157 LEU CB C 13 42.886 0.3 . 1 . . . . . 157 LEU CB . 28088 1 461 . 1 . 1 157 157 LEU N N 15 122.925 0.3 . 1 . . . . . 157 LEU N . 28088 1 462 . 1 . 1 158 158 GLN H H 1 8.934 0.020 . 1 . . . . . 158 GLN H . 28088 1 463 . 1 . 1 158 158 GLN CA C 13 53.773 0.3 . 1 . . . . . 158 GLN CA . 28088 1 464 . 1 . 1 158 158 GLN CB C 13 32.024 0.3 . 1 . . . . . 158 GLN CB . 28088 1 465 . 1 . 1 158 158 GLN N N 15 117.141 0.3 . 1 . . . . . 158 GLN N . 28088 1 466 . 1 . 1 159 159 ALA H H 1 8.286 0.020 . 1 . . . . . 159 ALA H . 28088 1 467 . 1 . 1 159 159 ALA CA C 13 49.410 0.3 . 1 . . . . . 159 ALA CA . 28088 1 468 . 1 . 1 159 159 ALA CB C 13 20.280 0.3 . 1 . . . . . 159 ALA CB . 28088 1 469 . 1 . 1 159 159 ALA N N 15 122.743 0.3 . 1 . . . . . 159 ALA N . 28088 1 470 . 1 . 1 160 160 ILE H H 1 9.467 0.020 . 1 . . . . . 160 ILE H . 28088 1 471 . 1 . 1 160 160 ILE CA C 13 58.432 0.3 . 1 . . . . . 160 ILE CA . 28088 1 472 . 1 . 1 160 160 ILE CB C 13 41.868 0.3 . 1 . . . . . 160 ILE CB . 28088 1 473 . 1 . 1 160 160 ILE N N 15 114.613 0.3 . 1 . . . . . 160 ILE N . 28088 1 474 . 1 . 1 161 161 ARG H H 1 9.684 0.020 . 1 . . . . . 161 ARG H . 28088 1 475 . 1 . 1 161 161 ARG CA C 13 57.403 0.3 . 1 . . . . . 161 ARG CA . 28088 1 476 . 1 . 1 161 161 ARG CB C 13 28.019 0.3 . 1 . . . . . 161 ARG CB . 28088 1 477 . 1 . 1 161 161 ARG N N 15 118.264 0.3 . 1 . . . . . 161 ARG N . 28088 1 478 . 1 . 1 162 162 ILE H H 1 8.732 0.020 . 1 . . . . . 162 ILE H . 28088 1 479 . 1 . 1 162 162 ILE CA C 13 62.116 0.3 . 1 . . . . . 162 ILE CA . 28088 1 480 . 1 . 1 162 162 ILE CB C 13 37.998 0.3 . 1 . . . . . 162 ILE CB . 28088 1 481 . 1 . 1 162 162 ILE N N 15 120.965 0.3 . 1 . . . . . 162 ILE N . 28088 1 482 . 1 . 1 163 163 LYS H H 1 8.259 0.020 . 1 . . . . . 163 LYS H . 28088 1 483 . 1 . 1 163 163 LYS CA C 13 55.874 0.3 . 1 . . . . . 163 LYS CA . 28088 1 484 . 1 . 1 163 163 LYS CB C 13 32.024 0.3 . 1 . . . . . 163 LYS CB . 28088 1 485 . 1 . 1 163 163 LYS N N 15 120.340 0.3 . 1 . . . . . 163 LYS N . 28088 1 486 . 1 . 1 164 164 HIS H H 1 7.593 0.020 . 1 . . . . . 164 HIS H . 28088 1 487 . 1 . 1 164 164 HIS CA C 13 55.110 0.3 . 1 . . . . . 164 HIS CA . 28088 1 488 . 1 . 1 164 164 HIS N N 15 117.600 0.3 . 1 . . . . . 164 HIS N . 28088 1 489 . 1 . 1 170 170 VAL H H 1 6.876 0.020 . 1 . . . . . 170 VAL H . 28088 1 490 . 1 . 1 170 170 VAL CA C 13 53.677 0.3 . 1 . . . . . 170 VAL CA . 28088 1 491 . 1 . 1 170 170 VAL CB C 13 30.395 0.3 . 1 . . . . . 170 VAL CB . 28088 1 492 . 1 . 1 170 170 VAL N N 15 121.910 0.3 . 1 . . . . . 170 VAL N . 28088 1 493 . 1 . 1 171 171 GLN H H 1 8.505 0.020 . 1 . . . . . 171 GLN H . 28088 1 494 . 1 . 1 171 171 GLN CA C 13 54.919 0.3 . 1 . . . . . 171 GLN CA . 28088 1 495 . 1 . 1 171 171 GLN CB C 13 28.290 0.3 . 1 . . . . . 171 GLN CB . 28088 1 496 . 1 . 1 171 171 GLN N N 15 125.268 0.3 . 1 . . . . . 171 GLN N . 28088 1 497 . 1 . 1 172 172 PHE H H 1 8.031 0.020 . 1 . . . . . 172 PHE H . 28088 1 498 . 1 . 1 172 172 PHE CA C 13 61.161 0.3 . 1 . . . . . 172 PHE CA . 28088 1 499 . 1 . 1 172 172 PHE CB C 13 37.726 0.3 . 1 . . . . . 172 PHE CB . 28088 1 500 . 1 . 1 172 172 PHE N N 15 122.181 0.3 . 1 . . . . . 172 PHE N . 28088 1 501 . 1 . 1 173 173 GLU H H 1 8.513 0.020 . 1 . . . . . 173 GLU H . 28088 1 502 . 1 . 1 173 173 GLU CA C 13 51.545 0.3 . 1 . . . . . 173 GLU CA . 28088 1 503 . 1 . 1 173 173 GLU CB C 13 28.290 0.3 . 1 . . . . . 173 GLU CB . 28088 1 504 . 1 . 1 173 173 GLU N N 15 122.123 0.3 . 1 . . . . . 173 GLU N . 28088 1 505 . 1 . 1 174 174 THR H H 1 8.115 0.020 . 1 . . . . . 174 THR H . 28088 1 506 . 1 . 1 174 174 THR CA C 13 65.365 0.3 . 1 . . . . . 174 THR CA . 28088 1 507 . 1 . 1 174 174 THR N N 15 114.045 0.3 . 1 . . . . . 174 THR N . 28088 1 508 . 1 . 1 175 175 LEU H H 1 8.761 0.020 . 1 . . . . . 175 LEU H . 28088 1 509 . 1 . 1 175 175 LEU CA C 13 55.852 0.3 . 1 . . . . . 175 LEU CA . 28088 1 510 . 1 . 1 175 175 LEU N N 15 118.342 0.3 . 1 . . . . . 175 LEU N . 28088 1 511 . 1 . 1 176 176 VAL H H 1 9.025 0.020 . 1 . . . . . 176 VAL H . 28088 1 512 . 1 . 1 176 176 VAL CA C 13 62.912 0.3 . 1 . . . . . 176 VAL CA . 28088 1 513 . 1 . 1 176 176 VAL CB C 13 32.635 0.3 . 1 . . . . . 176 VAL CB . 28088 1 514 . 1 . 1 176 176 VAL N N 15 128.098 0.3 . 1 . . . . . 176 VAL N . 28088 1 515 . 1 . 1 177 177 ALA H H 1 7.695 0.020 . 1 . . . . . 177 ALA H . 28088 1 516 . 1 . 1 177 177 ALA CA C 13 51.607 0.3 . 1 . . . . . 177 ALA CA . 28088 1 517 . 1 . 1 177 177 ALA CB C 13 21.094 0.3 . 1 . . . . . 177 ALA CB . 28088 1 518 . 1 . 1 177 177 ALA N N 15 120.478 0.3 . 1 . . . . . 177 ALA N . 28088 1 519 . 1 . 1 178 178 SER H H 1 8.435 0.020 . 1 . . . . . 178 SER H . 28088 1 520 . 1 . 1 178 178 SER CA C 13 55.970 0.3 . 1 . . . . . 178 SER CA . 28088 1 521 . 1 . 1 178 178 SER CB C 13 65.017 0.3 . 1 . . . . . 178 SER CB . 28088 1 522 . 1 . 1 178 178 SER N N 15 116.055 0.3 . 1 . . . . . 178 SER N . 28088 1 523 . 1 . 1 179 179 ASN H H 1 8.669 0.020 . 1 . . . . . 179 ASN H . 28088 1 524 . 1 . 1 179 179 ASN CA C 13 53.645 0.3 . 1 . . . . . 179 ASN CA . 28088 1 525 . 1 . 1 179 179 ASN CB C 13 36.029 0.3 . 1 . . . . . 179 ASN CB . 28088 1 526 . 1 . 1 179 179 ASN N N 15 119.025 0.3 . 1 . . . . . 179 ASN N . 28088 1 527 . 1 . 1 180 180 ILE H H 1 8.491 0.020 . 1 . . . . . 180 ILE H . 28088 1 528 . 1 . 1 180 180 ILE CA C 13 57.690 0.3 . 1 . . . . . 180 ILE CA . 28088 1 529 . 1 . 1 180 180 ILE CB C 13 34.943 0.3 . 1 . . . . . 180 ILE CB . 28088 1 530 . 1 . 1 180 180 ILE N N 15 123.619 0.3 . 1 . . . . . 180 ILE N . 28088 1 531 . 1 . 1 181 181 GLU H H 1 7.863 0.020 . 1 . . . . . 181 GLU H . 28088 1 532 . 1 . 1 181 181 GLU CA C 13 53.645 0.3 . 1 . . . . . 181 GLU CA . 28088 1 533 . 1 . 1 181 181 GLU CB C 13 31.820 0.3 . 1 . . . . . 181 GLU CB . 28088 1 534 . 1 . 1 181 181 GLU N N 15 121.420 0.3 . 1 . . . . . 181 GLU N . 28088 1 535 . 1 . 1 182 182 GLY H H 1 8.937 0.020 . 1 . . . . . 182 GLY H . 28088 1 536 . 1 . 1 182 182 GLY CA C 13 44.922 0.3 . 1 . . . . . 182 GLY CA . 28088 1 537 . 1 . 1 182 182 GLY N N 15 108.431 0.3 . 1 . . . . . 182 GLY N . 28088 1 538 . 1 . 1 183 183 CYS H H 1 8.902 0.020 . 1 . . . . . 183 CYS H . 28088 1 539 . 1 . 1 183 183 CYS CA C 13 55.784 0.3 . 1 . . . . . 183 CYS CA . 28088 1 540 . 1 . 1 183 183 CYS CB C 13 29.852 0.3 . 1 . . . . . 183 CYS CB . 28088 1 541 . 1 . 1 183 183 CYS N N 15 118.993 0.3 . 1 . . . . . 183 CYS N . 28088 1 542 . 1 . 1 184 184 VAL H H 1 8.331 0.020 . 1 . . . . . 184 VAL H . 28088 1 543 . 1 . 1 184 184 VAL CA C 13 63.931 0.3 . 1 . . . . . 184 VAL CA . 28088 1 544 . 1 . 1 184 184 VAL CB C 13 30.505 0.3 . 1 . . . . . 184 VAL CB . 28088 1 545 . 1 . 1 184 184 VAL N N 15 126.954 0.3 . 1 . . . . . 184 VAL N . 28088 1 546 . 1 . 1 186 186 ARG H H 1 7.591 0.020 . 1 . . . . . 186 ARG H . 28088 1 547 . 1 . 1 186 186 ARG CA C 13 57.148 0.3 . 1 . . . . . 186 ARG CA . 28088 1 548 . 1 . 1 186 186 ARG N N 15 117.750 0.3 . 1 . . . . . 186 ARG N . 28088 1 549 . 1 . 1 187 187 GLU H H 1 8.977 0.020 . 1 . . . . . 187 GLU H . 28088 1 550 . 1 . 1 187 187 GLU CA C 13 55.988 0.3 . 1 . . . . . 187 GLU CA . 28088 1 551 . 1 . 1 187 187 GLU CB C 13 29.648 0.3 . 1 . . . . . 187 GLU CB . 28088 1 552 . 1 . 1 187 187 GLU N N 15 127.515 0.3 . 1 . . . . . 187 GLU N . 28088 1 553 . 1 . 1 188 188 ALA H H 1 7.727 0.020 . 1 . . . . . 188 ALA H . 28088 1 554 . 1 . 1 188 188 ALA CA C 13 49.335 0.3 . 1 . . . . . 188 ALA CA . 28088 1 555 . 1 . 1 188 188 ALA CB C 13 16.478 0.3 . 1 . . . . . 188 ALA CB . 28088 1 556 . 1 . 1 188 188 ALA N N 15 127.037 0.3 . 1 . . . . . 188 ALA N . 28088 1 557 . 1 . 1 190 190 LYS H H 1 8.315 0.020 . 1 . . . . . 190 LYS H . 28088 1 558 . 1 . 1 190 190 LYS CA C 13 56.161 0.3 . 1 . . . . . 190 LYS CA . 28088 1 559 . 1 . 1 190 190 LYS CB C 13 31.481 0.3 . 1 . . . . . 190 LYS CB . 28088 1 560 . 1 . 1 190 190 LYS N N 15 121.237 0.3 . 1 . . . . . 190 LYS N . 28088 1 561 . 1 . 1 191 191 SER H H 1 8.106 0.020 . 1 . . . . . 191 SER H . 28088 1 562 . 1 . 1 191 191 SER CA C 13 55.110 0.3 . 1 . . . . . 191 SER CA . 28088 1 563 . 1 . 1 191 191 SER CB C 13 63.048 0.3 . 1 . . . . . 191 SER CB . 28088 1 564 . 1 . 1 191 191 SER N N 15 117.466 0.3 . 1 . . . . . 191 SER N . 28088 1 565 . 1 . 1 192 192 PRO CA C 13 65.560 0.3 . 1 . . . . . 192 PRO CA . 28088 1 566 . 1 . 1 192 192 PRO N N 15 119.740 0.3 . 1 . . . . . 192 PRO N . 28088 1 567 . 1 . 1 193 193 ILE H H 1 8.005 0.020 . 1 . . . . . 193 ILE H . 28088 1 568 . 1 . 1 193 193 ILE CA C 13 65.396 0.3 . 1 . . . . . 193 ILE CA . 28088 1 569 . 1 . 1 193 193 ILE N N 15 114.045 0.3 . 1 . . . . . 193 ILE N . 28088 1 570 . 1 . 1 197 197 ASP H H 1 8.121 0.020 . 1 . . . . . 197 ASP H . 28088 1 571 . 1 . 1 197 197 ASP CA C 13 53.645 0.3 . 1 . . . . . 197 ASP CA . 28088 1 572 . 1 . 1 197 197 ASP CB C 13 41.053 0.3 . 1 . . . . . 197 ASP CB . 28088 1 573 . 1 . 1 197 197 ASP N N 15 119.626 0.3 . 1 . . . . . 197 ASP N . 28088 1 574 . 1 . 1 198 198 ARG H H 1 8.131 0.020 . 1 . . . . . 198 ARG H . 28088 1 575 . 1 . 1 198 198 ARG CA C 13 55.397 0.3 . 1 . . . . . 198 ARG CA . 28088 1 576 . 1 . 1 198 198 ARG CB C 13 28.562 0.3 . 1 . . . . . 198 ARG CB . 28088 1 577 . 1 . 1 198 198 ARG N N 15 120.573 0.3 . 1 . . . . . 198 ARG N . 28088 1 578 . 1 . 1 199 199 VAL H H 1 8.080 0.020 . 1 . . . . . 199 VAL H . 28088 1 579 . 1 . 1 199 199 VAL CA C 13 61.670 0.3 . 1 . . . . . 199 VAL CA . 28088 1 580 . 1 . 1 199 199 VAL CB C 13 32.567 0.3 . 1 . . . . . 199 VAL CB . 28088 1 581 . 1 . 1 199 199 VAL N N 15 121.973 0.3 . 1 . . . . . 199 VAL N . 28088 1 582 . 1 . 1 200 200 GLU H H 1 8.458 0.020 . 1 . . . . . 200 GLU H . 28088 1 583 . 1 . 1 200 200 GLU CA C 13 55.620 0.3 . 1 . . . . . 200 GLU CA . 28088 1 584 . 1 . 1 200 200 GLU CB C 13 29.852 0.3 . 1 . . . . . 200 GLU CB . 28088 1 585 . 1 . 1 200 200 GLU N N 15 123.398 0.3 . 1 . . . . . 200 GLU N . 28088 1 586 . 1 . 1 201 201 GLY H H 1 8.261 0.020 . 1 . . . . . 201 GLY H . 28088 1 587 . 1 . 1 201 201 GLY CA C 13 43.868 0.3 . 1 . . . . . 201 GLY CA . 28088 1 588 . 1 . 1 201 201 GLY N N 15 111.008 0.3 . 1 . . . . . 201 GLY N . 28088 1 589 . 1 . 1 206 206 TYR H H 1 9.556 0.020 . 1 . . . . . 206 TYR H . 28088 1 590 . 1 . 1 206 206 TYR CA C 13 54.919 0.3 . 1 . . . . . 206 TYR CA . 28088 1 591 . 1 . 1 206 206 TYR CB C 13 41.596 0.3 . 1 . . . . . 206 TYR CB . 28088 1 592 . 1 . 1 206 206 TYR N N 15 128.831 0.3 . 1 . . . . . 206 TYR N . 28088 1 593 . 1 . 1 207 207 GLU H H 1 8.882 0.020 . 1 . . . . . 207 GLU H . 28088 1 594 . 1 . 1 207 207 GLU CA C 13 54.613 0.3 . 1 . . . . . 207 GLU CA . 28088 1 595 . 1 . 1 207 207 GLU CB C 13 31.006 0.3 . 1 . . . . . 207 GLU CB . 28088 1 596 . 1 . 1 207 207 GLU N N 15 120.488 0.3 . 1 . . . . . 207 GLU N . 28088 1 597 . 1 . 1 208 208 HIS H H 1 8.668 0.020 . 1 . . . . . 208 HIS H . 28088 1 598 . 1 . 1 208 208 HIS CA C 13 55.651 0.3 . 1 . . . . . 208 HIS CA . 28088 1 599 . 1 . 1 208 208 HIS CB C 13 32.296 0.3 . 1 . . . . . 208 HIS CB . 28088 1 600 . 1 . 1 208 208 HIS N N 15 124.264 0.3 . 1 . . . . . 208 HIS N . 28088 1 601 . 1 . 1 209 209 ALA H H 1 8.911 0.020 . 1 . . . . . 209 ALA H . 28088 1 602 . 1 . 1 209 209 ALA CA C 13 52.865 0.3 . 1 . . . . . 209 ALA CA . 28088 1 603 . 1 . 1 209 209 ALA CB C 13 15.528 0.3 . 1 . . . . . 209 ALA CB . 28088 1 604 . 1 . 1 209 209 ALA N N 15 131.538 0.3 . 1 . . . . . 209 ALA N . 28088 1 605 . 1 . 1 210 210 ASP H H 1 8.524 0.020 . 1 . . . . . 210 ASP H . 28088 1 606 . 1 . 1 210 210 ASP CA C 13 55.174 0.3 . 1 . . . . . 210 ASP CA . 28088 1 607 . 1 . 1 210 210 ASP CB C 13 39.152 0.3 . 1 . . . . . 210 ASP CB . 28088 1 608 . 1 . 1 210 210 ASP N N 15 111.950 0.3 . 1 . . . . . 210 ASP N . 28088 1 609 . 1 . 1 211 211 VAL H H 1 7.806 0.020 . 1 . . . . . 211 VAL H . 28088 1 610 . 1 . 1 211 211 VAL CA C 13 60.651 0.3 . 1 . . . . . 211 VAL CA . 28088 1 611 . 1 . 1 211 211 VAL CB C 13 33.585 0.3 . 1 . . . . . 211 VAL CB . 28088 1 612 . 1 . 1 211 211 VAL N N 15 119.557 0.3 . 1 . . . . . 211 VAL N . 28088 1 613 . 1 . 1 212 212 LYS H H 1 8.302 0.020 . 1 . . . . . 212 LYS H . 28088 1 614 . 1 . 1 212 212 LYS CA C 13 55.460 0.3 . 1 . . . . . 212 LYS CA . 28088 1 615 . 1 . 1 212 212 LYS CB C 13 31.657 0.3 . 1 . . . . . 212 LYS CB . 28088 1 616 . 1 . 1 212 212 LYS N N 15 125.086 0.3 . 1 . . . . . 212 LYS N . 28088 1 617 . 1 . 1 213 213 LYS H H 1 8.898 0.020 . 1 . . . . . 213 LYS H . 28088 1 618 . 1 . 1 213 213 LYS CA C 13 53.900 0.3 . 1 . . . . . 213 LYS CA . 28088 1 619 . 1 . 1 213 213 LYS CB C 13 34.807 0.3 . 1 . . . . . 213 LYS CB . 28088 1 620 . 1 . 1 213 213 LYS N N 15 126.349 0.3 . 1 . . . . . 213 LYS N . 28088 1 621 . 1 . 1 214 214 THR H H 1 7.852 0.020 . 1 . . . . . 214 THR H . 28088 1 622 . 1 . 1 214 214 THR CA C 13 58.645 0.3 . 1 . . . . . 214 THR CA . 28088 1 623 . 1 . 1 214 214 THR CB C 13 71.602 0.3 . 1 . . . . . 214 THR CB . 28088 1 624 . 1 . 1 214 214 THR N N 15 108.161 0.3 . 1 . . . . . 214 THR N . 28088 1 625 . 1 . 1 215 215 ILE H H 1 9.158 0.020 . 1 . . . . . 215 ILE H . 28088 1 626 . 1 . 1 215 215 ILE CA C 13 59.664 0.3 . 1 . . . . . 215 ILE CA . 28088 1 627 . 1 . 1 215 215 ILE CB C 13 41.528 0.3 . 1 . . . . . 215 ILE CB . 28088 1 628 . 1 . 1 215 215 ILE N N 15 122.789 0.3 . 1 . . . . . 215 ILE N . 28088 1 629 . 1 . 1 216 216 MET H H 1 8.202 0.020 . 1 . . . . . 216 MET H . 28088 1 630 . 1 . 1 216 216 MET CA C 13 54.426 0.3 . 1 . . . . . 216 MET CA . 28088 1 631 . 1 . 1 216 216 MET CB C 13 33.110 0.3 . 1 . . . . . 216 MET CB . 28088 1 632 . 1 . 1 216 216 MET N N 15 125.680 0.3 . 1 . . . . . 216 MET N . 28088 1 633 . 1 . 1 226 226 PRO CA C 13 57.881 0.3 . 1 . . . . . 226 PRO CA . 28088 1 634 . 1 . 1 226 226 PRO CB C 13 36.301 0.3 . 1 . . . . . 226 PRO CB . 28088 1 635 . 1 . 1 227 227 ARG H H 1 8.882 0.020 . 1 . . . . . 227 ARG H . 28088 1 636 . 1 . 1 227 227 ARG CA C 13 52.915 0.3 . 1 . . . . . 227 ARG CA . 28088 1 637 . 1 . 1 227 227 ARG CB C 13 34.196 0.3 . 1 . . . . . 227 ARG CB . 28088 1 638 . 1 . 1 227 227 ARG N N 15 120.371 0.3 . 1 . . . . . 227 ARG N . 28088 1 639 . 1 . 1 228 228 ILE H H 1 8.745 0.020 . 1 . . . . . 228 ILE H . 28088 1 640 . 1 . 1 228 228 ILE CA C 13 61.161 0.3 . 1 . . . . . 228 ILE CA . 28088 1 641 . 1 . 1 228 228 ILE N N 15 119.733 0.3 . 1 . . . . . 228 ILE N . 28088 1 642 . 1 . 1 229 229 GLY H H 1 8.648 0.020 . 1 . . . . . 229 GLY H . 28088 1 643 . 1 . 1 229 229 GLY CA C 13 44.378 0.3 . 1 . . . . . 229 GLY CA . 28088 1 644 . 1 . 1 229 229 GLY N N 15 114.045 0.3 . 1 . . . . . 229 GLY N . 28088 1 645 . 1 . 1 231 231 ARG H H 1 8.429 0.020 . 1 . . . . . 231 ARG H . 28088 1 646 . 1 . 1 231 231 ARG CA C 13 54.887 0.3 . 1 . . . . . 231 ARG CA . 28088 1 647 . 1 . 1 231 231 ARG CB C 13 29.716 0.3 . 1 . . . . . 231 ARG CB . 28088 1 648 . 1 . 1 231 231 ARG N N 15 123.466 0.3 . 1 . . . . . 231 ARG N . 28088 1 649 . 1 . 1 232 232 VAL H H 1 8.868 0.020 . 1 . . . . . 232 VAL H . 28088 1 650 . 1 . 1 232 232 VAL CA C 13 57.685 0.3 . 1 . . . . . 232 VAL CA . 28088 1 651 . 1 . 1 232 232 VAL CB C 13 35.350 0.3 . 1 . . . . . 232 VAL CB . 28088 1 652 . 1 . 1 232 232 VAL N N 15 118.474 0.3 . 1 . . . . . 232 VAL N . 28088 1 653 . 1 . 1 233 233 ARG H H 1 9.083 0.020 . 1 . . . . . 233 ARG H . 28088 1 654 . 1 . 1 233 233 ARG CA C 13 52.435 0.3 . 1 . . . . . 233 ARG CA . 28088 1 655 . 1 . 1 233 233 ARG CB C 13 31.820 0.3 . 1 . . . . . 233 ARG CB . 28088 1 656 . 1 . 1 233 233 ARG N N 15 120.770 0.3 . 1 . . . . . 233 ARG N . 28088 1 657 . 1 . 1 235 235 ASP H H 1 8.811 0.020 . 1 . . . . . 235 ASP H . 28088 1 658 . 1 . 1 235 235 ASP CA C 13 51.915 0.3 . 1 . . . . . 235 ASP CA . 28088 1 659 . 1 . 1 235 235 ASP CB C 13 43.429 0.3 . 1 . . . . . 235 ASP CB . 28088 1 660 . 1 . 1 235 235 ASP N N 15 116.628 0.3 . 1 . . . . . 235 ASP N . 28088 1 661 . 1 . 1 236 236 ILE H H 1 9.064 0.020 . 1 . . . . . 236 ILE H . 28088 1 662 . 1 . 1 236 236 ILE CA C 13 61.097 0.3 . 1 . . . . . 236 ILE CA . 28088 1 663 . 1 . 1 236 236 ILE CB C 13 38.473 0.3 . 1 . . . . . 236 ILE CB . 28088 1 664 . 1 . 1 236 236 ILE N N 15 120.629 0.3 . 1 . . . . . 236 ILE N . 28088 1 665 . 1 . 1 237 237 TYR H H 1 9.258 0.020 . 1 . . . . . 237 TYR H . 28088 1 666 . 1 . 1 237 237 TYR CA C 13 55.333 0.3 . 1 . . . . . 237 TYR CA . 28088 1 667 . 1 . 1 237 237 TYR N N 15 128.820 0.3 . 1 . . . . . 237 TYR N . 28088 1 668 . 1 . 1 250 250 VAL H H 1 7.655 0.020 . 1 . . . . . 250 VAL H . 28088 1 669 . 1 . 1 250 250 VAL CA C 13 62.658 0.3 . 1 . . . . . 250 VAL CA . 28088 1 670 . 1 . 1 250 250 VAL CB C 13 30.220 0.3 . 1 . . . . . 250 VAL CB . 28088 1 671 . 1 . 1 250 250 VAL N N 15 117.201 0.3 . 1 . . . . . 250 VAL N . 28088 1 672 . 1 . 1 251 251 GLN H H 1 9.251 0.020 . 1 . . . . . 251 GLN H . 28088 1 673 . 1 . 1 251 251 GLN CA C 13 53.816 0.3 . 1 . . . . . 251 GLN CA . 28088 1 674 . 1 . 1 251 251 GLN CB C 13 32.024 0.3 . 1 . . . . . 251 GLN CB . 28088 1 675 . 1 . 1 251 251 GLN N N 15 128.039 0.3 . 1 . . . . . 251 GLN N . 28088 1 676 . 1 . 1 252 252 GLN H H 1 8.955 0.020 . 1 . . . . . 252 GLN H . 28088 1 677 . 1 . 1 252 252 GLN CA C 13 56.702 0.3 . 1 . . . . . 252 GLN CA . 28088 1 678 . 1 . 1 252 252 GLN CB C 13 28.155 0.3 . 1 . . . . . 252 GLN CB . 28088 1 679 . 1 . 1 252 252 GLN N N 15 123.596 0.3 . 1 . . . . . 252 GLN N . 28088 1 680 . 1 . 1 253 253 VAL H H 1 8.116 0.020 . 1 . . . . . 253 VAL H . 28088 1 681 . 1 . 1 253 253 VAL CA C 13 62.180 0.3 . 1 . . . . . 253 VAL CA . 28088 1 682 . 1 . 1 253 253 VAL CB C 13 31.888 0.3 . 1 . . . . . 253 VAL CB . 28088 1 683 . 1 . 1 253 253 VAL N N 15 123.026 0.3 . 1 . . . . . 253 VAL N . 28088 1 684 . 1 . 1 254 254 SER H H 1 8.393 0.020 . 1 . . . . . 254 SER H . 28088 1 685 . 1 . 1 254 254 SER CA C 13 57.467 0.3 . 1 . . . . . 254 SER CA . 28088 1 686 . 1 . 1 254 254 SER CB C 13 62.980 0.3 . 1 . . . . . 254 SER CB . 28088 1 687 . 1 . 1 254 254 SER N N 15 119.283 0.3 . 1 . . . . . 254 SER N . 28088 1 688 . 1 . 1 255 255 LEU H H 1 8.311 0.020 . 1 . . . . . 255 LEU H . 28088 1 689 . 1 . 1 255 255 LEU CA C 13 54.887 0.3 . 1 . . . . . 255 LEU CA . 28088 1 690 . 1 . 1 255 255 LEU CB C 13 41.214 0.3 . 1 . . . . . 255 LEU CB . 28088 1 691 . 1 . 1 255 255 LEU N N 15 125.214 0.3 . 1 . . . . . 255 LEU N . 28088 1 692 . 1 . 1 256 256 HIS H H 1 7.881 0.020 . 1 . . . . . 256 HIS H . 28088 1 693 . 1 . 1 256 256 HIS CA C 13 56.161 0.3 . 1 . . . . . 256 HIS CA . 28088 1 694 . 1 . 1 256 256 HIS CB C 13 29.580 0.3 . 1 . . . . . 256 HIS CB . 28088 1 695 . 1 . 1 256 256 HIS N N 15 123.727 0.3 . 1 . . . . . 256 HIS N . 28088 1 stop_ save_