data_16091 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 16091 _Entry.Title ; SOLUTION STRUCTURE OF 30S RIBOSOMAL PROTEIN S8E; FROM Methanothermobacter thermautotrophicus, NORTHEASTSTRUCTURAL GENOMICS CONSORTIUM (NESG) TARGET TR71D ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2008-12-24 _Entry.Accession_date 2008-12-24 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.0.9.13 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details 'Residues 1-20 residues and 44-57 are flexible and not defined.' _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Gaohua Liu . . . 16091 2 Paolo Rossi . . . 16091 3 Dongyan Wang . . . 16091 4 CHIOMA NWOSU . . . 16091 5 LEAH OWENS . . . 16091 6 Rong Xiao . . . 16091 7 Jinfeng Liu . . . 16091 8 MICHAEL BARAN . C. . 16091 9 G.V.T SWAPNA . . . 16091 10 THOMAS ACTON . B. . 16091 11 BURKHARD Rost . . . 16091 12 GAETANO MONTELIONE . T. . 16091 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID 1 'PSI, Protein Structure Initiative' 'Northeast Structural Genomics Consortium' . 16091 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 16091 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 303 16091 '15N chemical shifts' 97 16091 '1H chemical shifts' 662 16091 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 3 . . 2010-06-02 2008-12-24 update BMRB 'edit assembly name' 16091 2 . . 2009-06-02 2008-12-24 update BMRB 'added time domain data' 16091 1 . . 2009-02-17 2008-12-24 original author 'original release' 16091 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2KCP 'BMRB Entry Tracking System' 16091 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 16091 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title 'SOLUTION STRUCTURE OF 30S RIBOSOMAL PROTEIN S8E FROM Methanothermobacter thermautotrophicus, NORTHEASTSTRUCTURAL GENOMICS CONSORTIUM (NESG) TARGET' _Citation.Status 'in preparation' _Citation.Type journal _Citation.Journal_abbrev 'Not known' _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first . _Citation.Page_last . _Citation.Year . _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Gaohua Liu . . . 16091 1 2 Gaetano MONTELIONE . . . 16091 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID '30S RIBOSOMAL PROTEIN S8E' 16091 1 NESG 16091 1 rps8e 16091 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 16091 _Assembly.ID 1 _Assembly.Name rps8 _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 rps8e 1 $rps8e A . yes native no no . . . 16091 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_rps8e _Entity.Sf_category entity _Entity.Sf_framecode rps8e _Entity.Entry_ID 16091 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name rps8e _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GDRRVRLIRTRGGNTKVRLA SDTRINVVDPETGKVEIAEI RNVVENTANPHFVRRNIITR GAVVETNLGNVRVTSRPGQD GVINGVLIRELEHHHHHHGD RRVRLIRTRGGNTKVRLASD TRINVVDPETGKVEIAEIRN VVENTANPHFVRRNIITRGA VVETNLGNVRVTSRPGQDGV INGVLIRELEHHHHHHGDRR VRLIRTRGGNTKVRLASDTR INVVDPETGKVEIAEIRNVV ENTANPHFVRRNIITRGAVV ETNLGNVRVTSRPGQDGVIN GVLIRELEHHHHHH ; _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 294 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method man _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 33088.738 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no BMRB 16820 . S8E . . . . . 100.00 294 100.00 100.00 0.00e+00 . . . . 16091 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 . GLY . 16091 1 2 . ASP . 16091 1 3 . ARG . 16091 1 4 . ARG . 16091 1 5 . VAL . 16091 1 6 . ARG . 16091 1 7 . LEU . 16091 1 8 . ILE . 16091 1 9 . ARG . 16091 1 10 . THR . 16091 1 11 . ARG . 16091 1 12 . GLY . 16091 1 13 . GLY . 16091 1 14 . ASN . 16091 1 15 . THR . 16091 1 16 . LYS . 16091 1 17 . VAL . 16091 1 18 . ARG . 16091 1 19 . LEU . 16091 1 20 . ALA . 16091 1 21 . SER . 16091 1 22 . ASP . 16091 1 23 . THR . 16091 1 24 . ARG . 16091 1 25 . ILE . 16091 1 26 . ASN . 16091 1 27 . VAL . 16091 1 28 . VAL . 16091 1 29 . ASP . 16091 1 30 . PRO . 16091 1 31 . GLU . 16091 1 32 . THR . 16091 1 33 . GLY . 16091 1 34 . LYS . 16091 1 35 . VAL . 16091 1 36 . GLU . 16091 1 37 . ILE . 16091 1 38 . ALA . 16091 1 39 . GLU . 16091 1 40 . ILE . 16091 1 41 . ARG . 16091 1 42 . ASN . 16091 1 43 . VAL . 16091 1 44 . VAL . 16091 1 45 . GLU . 16091 1 46 . ASN . 16091 1 47 . THR . 16091 1 48 . ALA . 16091 1 49 . ASN . 16091 1 50 . PRO . 16091 1 51 . HIS . 16091 1 52 . PHE . 16091 1 53 . VAL . 16091 1 54 . ARG . 16091 1 55 . ARG . 16091 1 56 . ASN . 16091 1 57 . ILE . 16091 1 58 . ILE . 16091 1 59 . THR . 16091 1 60 . ARG . 16091 1 61 . GLY . 16091 1 62 . ALA . 16091 1 63 . VAL . 16091 1 64 . VAL . 16091 1 65 . GLU . 16091 1 66 . THR . 16091 1 67 . ASN . 16091 1 68 . LEU . 16091 1 69 . GLY . 16091 1 70 . ASN . 16091 1 71 . VAL . 16091 1 72 . ARG . 16091 1 73 . VAL . 16091 1 74 . THR . 16091 1 75 . SER . 16091 1 76 . ARG . 16091 1 77 . PRO . 16091 1 78 . GLY . 16091 1 79 . GLN . 16091 1 80 . ASP . 16091 1 81 . GLY . 16091 1 82 . VAL . 16091 1 83 . ILE . 16091 1 84 . ASN . 16091 1 85 . GLY . 16091 1 86 . VAL . 16091 1 87 . LEU . 16091 1 88 . ILE . 16091 1 89 . ARG . 16091 1 90 . GLU . 16091 1 91 . LEU . 16091 1 92 . GLU . 16091 1 93 . HIS . 16091 1 94 . HIS . 16091 1 95 . HIS . 16091 1 96 . HIS . 16091 1 97 . HIS . 16091 1 98 . HIS . 16091 1 99 . GLY . 16091 1 100 . ASP . 16091 1 101 . ARG . 16091 1 102 . ARG . 16091 1 103 . VAL . 16091 1 104 . ARG . 16091 1 105 . LEU . 16091 1 106 . ILE . 16091 1 107 . ARG . 16091 1 108 . THR . 16091 1 109 . ARG . 16091 1 110 . GLY . 16091 1 111 . GLY . 16091 1 112 . ASN . 16091 1 113 . THR . 16091 1 114 . LYS . 16091 1 115 . VAL . 16091 1 116 . ARG . 16091 1 117 . LEU . 16091 1 118 . ALA . 16091 1 119 . SER . 16091 1 120 . ASP . 16091 1 121 . THR . 16091 1 122 . ARG . 16091 1 123 . ILE . 16091 1 124 . ASN . 16091 1 125 . VAL . 16091 1 126 . VAL . 16091 1 127 . ASP . 16091 1 128 . PRO . 16091 1 129 . GLU . 16091 1 130 . THR . 16091 1 131 . GLY . 16091 1 132 . LYS . 16091 1 133 . VAL . 16091 1 134 . GLU . 16091 1 135 . ILE . 16091 1 136 . ALA . 16091 1 137 . GLU . 16091 1 138 . ILE . 16091 1 139 . ARG . 16091 1 140 . ASN . 16091 1 141 . VAL . 16091 1 142 . VAL . 16091 1 143 . GLU . 16091 1 144 . ASN . 16091 1 145 . THR . 16091 1 146 . ALA . 16091 1 147 . ASN . 16091 1 148 . PRO . 16091 1 149 . HIS . 16091 1 150 . PHE . 16091 1 151 . VAL . 16091 1 152 . ARG . 16091 1 153 . ARG . 16091 1 154 . ASN . 16091 1 155 . ILE . 16091 1 156 . ILE . 16091 1 157 . THR . 16091 1 158 . ARG . 16091 1 159 . GLY . 16091 1 160 . ALA . 16091 1 161 . VAL . 16091 1 162 . VAL . 16091 1 163 . GLU . 16091 1 164 . THR . 16091 1 165 . ASN . 16091 1 166 . LEU . 16091 1 167 . GLY . 16091 1 168 . ASN . 16091 1 169 . VAL . 16091 1 170 . ARG . 16091 1 171 . VAL . 16091 1 172 . THR . 16091 1 173 . SER . 16091 1 174 . ARG . 16091 1 175 . PRO . 16091 1 176 . GLY . 16091 1 177 . GLN . 16091 1 178 . ASP . 16091 1 179 . GLY . 16091 1 180 . VAL . 16091 1 181 . ILE . 16091 1 182 . ASN . 16091 1 183 . GLY . 16091 1 184 . VAL . 16091 1 185 . LEU . 16091 1 186 . ILE . 16091 1 187 . ARG . 16091 1 188 . GLU . 16091 1 189 . LEU . 16091 1 190 . GLU . 16091 1 191 . HIS . 16091 1 192 . HIS . 16091 1 193 . HIS . 16091 1 194 . HIS . 16091 1 195 . HIS . 16091 1 196 . HIS . 16091 1 197 . GLY . 16091 1 198 . ASP . 16091 1 199 . ARG . 16091 1 200 . ARG . 16091 1 201 . VAL . 16091 1 202 . ARG . 16091 1 203 . LEU . 16091 1 204 . ILE . 16091 1 205 . ARG . 16091 1 206 . THR . 16091 1 207 . ARG . 16091 1 208 . GLY . 16091 1 209 . GLY . 16091 1 210 . ASN . 16091 1 211 . THR . 16091 1 212 . LYS . 16091 1 213 . VAL . 16091 1 214 . ARG . 16091 1 215 . LEU . 16091 1 216 . ALA . 16091 1 217 . SER . 16091 1 218 . ASP . 16091 1 219 . THR . 16091 1 220 . ARG . 16091 1 221 . ILE . 16091 1 222 . ASN . 16091 1 223 . VAL . 16091 1 224 . VAL . 16091 1 225 . ASP . 16091 1 226 . PRO . 16091 1 227 . GLU . 16091 1 228 . THR . 16091 1 229 . GLY . 16091 1 230 . LYS . 16091 1 231 . VAL . 16091 1 232 . GLU . 16091 1 233 . ILE . 16091 1 234 . ALA . 16091 1 235 . GLU . 16091 1 236 . ILE . 16091 1 237 . ARG . 16091 1 238 . ASN . 16091 1 239 . VAL . 16091 1 240 . VAL . 16091 1 241 . GLU . 16091 1 242 . ASN . 16091 1 243 . THR . 16091 1 244 . ALA . 16091 1 245 . ASN . 16091 1 246 . PRO . 16091 1 247 . HIS . 16091 1 248 . PHE . 16091 1 249 . VAL . 16091 1 250 . ARG . 16091 1 251 . ARG . 16091 1 252 . ASN . 16091 1 253 . ILE . 16091 1 254 . ILE . 16091 1 255 . THR . 16091 1 256 . ARG . 16091 1 257 . GLY . 16091 1 258 . ALA . 16091 1 259 . VAL . 16091 1 260 . VAL . 16091 1 261 . GLU . 16091 1 262 . THR . 16091 1 263 . ASN . 16091 1 264 . LEU . 16091 1 265 . GLY . 16091 1 266 . ASN . 16091 1 267 . VAL . 16091 1 268 . ARG . 16091 1 269 . VAL . 16091 1 270 . THR . 16091 1 271 . SER . 16091 1 272 . ARG . 16091 1 273 . PRO . 16091 1 274 . GLY . 16091 1 275 . GLN . 16091 1 276 . ASP . 16091 1 277 . GLY . 16091 1 278 . VAL . 16091 1 279 . ILE . 16091 1 280 . ASN . 16091 1 281 . GLY . 16091 1 282 . VAL . 16091 1 283 . LEU . 16091 1 284 . ILE . 16091 1 285 . ARG . 16091 1 286 . GLU . 16091 1 287 . LEU . 16091 1 288 . GLU . 16091 1 289 . HIS . 16091 1 290 . HIS . 16091 1 291 . HIS . 16091 1 292 . HIS . 16091 1 293 . HIS . 16091 1 294 . HIS . 16091 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 . GLY 1 1 16091 1 . ASP 2 2 16091 1 . ARG 3 3 16091 1 . ARG 4 4 16091 1 . VAL 5 5 16091 1 . ARG 6 6 16091 1 . LEU 7 7 16091 1 . ILE 8 8 16091 1 . ARG 9 9 16091 1 . THR 10 10 16091 1 . ARG 11 11 16091 1 . GLY 12 12 16091 1 . GLY 13 13 16091 1 . ASN 14 14 16091 1 . THR 15 15 16091 1 . LYS 16 16 16091 1 . VAL 17 17 16091 1 . ARG 18 18 16091 1 . LEU 19 19 16091 1 . ALA 20 20 16091 1 . SER 21 21 16091 1 . ASP 22 22 16091 1 . THR 23 23 16091 1 . ARG 24 24 16091 1 . ILE 25 25 16091 1 . ASN 26 26 16091 1 . VAL 27 27 16091 1 . VAL 28 28 16091 1 . ASP 29 29 16091 1 . PRO 30 30 16091 1 . GLU 31 31 16091 1 . THR 32 32 16091 1 . GLY 33 33 16091 1 . LYS 34 34 16091 1 . VAL 35 35 16091 1 . GLU 36 36 16091 1 . ILE 37 37 16091 1 . ALA 38 38 16091 1 . GLU 39 39 16091 1 . ILE 40 40 16091 1 . ARG 41 41 16091 1 . ASN 42 42 16091 1 . VAL 43 43 16091 1 . VAL 44 44 16091 1 . GLU 45 45 16091 1 . ASN 46 46 16091 1 . THR 47 47 16091 1 . ALA 48 48 16091 1 . ASN 49 49 16091 1 . PRO 50 50 16091 1 . HIS 51 51 16091 1 . PHE 52 52 16091 1 . VAL 53 53 16091 1 . ARG 54 54 16091 1 . ARG 55 55 16091 1 . ASN 56 56 16091 1 . ILE 57 57 16091 1 . ILE 58 58 16091 1 . THR 59 59 16091 1 . ARG 60 60 16091 1 . GLY 61 61 16091 1 . ALA 62 62 16091 1 . VAL 63 63 16091 1 . VAL 64 64 16091 1 . GLU 65 65 16091 1 . THR 66 66 16091 1 . ASN 67 67 16091 1 . LEU 68 68 16091 1 . GLY 69 69 16091 1 . ASN 70 70 16091 1 . VAL 71 71 16091 1 . ARG 72 72 16091 1 . VAL 73 73 16091 1 . THR 74 74 16091 1 . SER 75 75 16091 1 . ARG 76 76 16091 1 . PRO 77 77 16091 1 . GLY 78 78 16091 1 . GLN 79 79 16091 1 . ASP 80 80 16091 1 . GLY 81 81 16091 1 . VAL 82 82 16091 1 . ILE 83 83 16091 1 . ASN 84 84 16091 1 . GLY 85 85 16091 1 . VAL 86 86 16091 1 . LEU 87 87 16091 1 . ILE 88 88 16091 1 . ARG 89 89 16091 1 . GLU 90 90 16091 1 . LEU 91 91 16091 1 . GLU 92 92 16091 1 . HIS 93 93 16091 1 . HIS 94 94 16091 1 . HIS 95 95 16091 1 . HIS 96 96 16091 1 . HIS 97 97 16091 1 . HIS 98 98 16091 1 . GLY 99 99 16091 1 . ASP 100 100 16091 1 . ARG 101 101 16091 1 . ARG 102 102 16091 1 . VAL 103 103 16091 1 . ARG 104 104 16091 1 . LEU 105 105 16091 1 . ILE 106 106 16091 1 . ARG 107 107 16091 1 . THR 108 108 16091 1 . ARG 109 109 16091 1 . GLY 110 110 16091 1 . GLY 111 111 16091 1 . ASN 112 112 16091 1 . THR 113 113 16091 1 . LYS 114 114 16091 1 . VAL 115 115 16091 1 . ARG 116 116 16091 1 . LEU 117 117 16091 1 . ALA 118 118 16091 1 . SER 119 119 16091 1 . ASP 120 120 16091 1 . THR 121 121 16091 1 . ARG 122 122 16091 1 . ILE 123 123 16091 1 . ASN 124 124 16091 1 . VAL 125 125 16091 1 . VAL 126 126 16091 1 . ASP 127 127 16091 1 . PRO 128 128 16091 1 . GLU 129 129 16091 1 . THR 130 130 16091 1 . GLY 131 131 16091 1 . LYS 132 132 16091 1 . VAL 133 133 16091 1 . GLU 134 134 16091 1 . ILE 135 135 16091 1 . ALA 136 136 16091 1 . GLU 137 137 16091 1 . ILE 138 138 16091 1 . ARG 139 139 16091 1 . ASN 140 140 16091 1 . VAL 141 141 16091 1 . VAL 142 142 16091 1 . GLU 143 143 16091 1 . ASN 144 144 16091 1 . THR 145 145 16091 1 . ALA 146 146 16091 1 . ASN 147 147 16091 1 . PRO 148 148 16091 1 . HIS 149 149 16091 1 . PHE 150 150 16091 1 . VAL 151 151 16091 1 . ARG 152 152 16091 1 . ARG 153 153 16091 1 . ASN 154 154 16091 1 . ILE 155 155 16091 1 . ILE 156 156 16091 1 . THR 157 157 16091 1 . ARG 158 158 16091 1 . GLY 159 159 16091 1 . ALA 160 160 16091 1 . VAL 161 161 16091 1 . VAL 162 162 16091 1 . GLU 163 163 16091 1 . THR 164 164 16091 1 . ASN 165 165 16091 1 . LEU 166 166 16091 1 . GLY 167 167 16091 1 . ASN 168 168 16091 1 . VAL 169 169 16091 1 . ARG 170 170 16091 1 . VAL 171 171 16091 1 . THR 172 172 16091 1 . SER 173 173 16091 1 . ARG 174 174 16091 1 . PRO 175 175 16091 1 . GLY 176 176 16091 1 . GLN 177 177 16091 1 . ASP 178 178 16091 1 . GLY 179 179 16091 1 . VAL 180 180 16091 1 . ILE 181 181 16091 1 . ASN 182 182 16091 1 . GLY 183 183 16091 1 . VAL 184 184 16091 1 . LEU 185 185 16091 1 . ILE 186 186 16091 1 . ARG 187 187 16091 1 . GLU 188 188 16091 1 . LEU 189 189 16091 1 . GLU 190 190 16091 1 . HIS 191 191 16091 1 . HIS 192 192 16091 1 . HIS 193 193 16091 1 . HIS 194 194 16091 1 . HIS 195 195 16091 1 . HIS 196 196 16091 1 . GLY 197 197 16091 1 . ASP 198 198 16091 1 . ARG 199 199 16091 1 . ARG 200 200 16091 1 . VAL 201 201 16091 1 . ARG 202 202 16091 1 . LEU 203 203 16091 1 . ILE 204 204 16091 1 . ARG 205 205 16091 1 . THR 206 206 16091 1 . ARG 207 207 16091 1 . GLY 208 208 16091 1 . GLY 209 209 16091 1 . ASN 210 210 16091 1 . THR 211 211 16091 1 . LYS 212 212 16091 1 . VAL 213 213 16091 1 . ARG 214 214 16091 1 . LEU 215 215 16091 1 . ALA 216 216 16091 1 . SER 217 217 16091 1 . ASP 218 218 16091 1 . THR 219 219 16091 1 . ARG 220 220 16091 1 . ILE 221 221 16091 1 . ASN 222 222 16091 1 . VAL 223 223 16091 1 . VAL 224 224 16091 1 . ASP 225 225 16091 1 . PRO 226 226 16091 1 . GLU 227 227 16091 1 . THR 228 228 16091 1 . GLY 229 229 16091 1 . LYS 230 230 16091 1 . VAL 231 231 16091 1 . GLU 232 232 16091 1 . ILE 233 233 16091 1 . ALA 234 234 16091 1 . GLU 235 235 16091 1 . ILE 236 236 16091 1 . ARG 237 237 16091 1 . ASN 238 238 16091 1 . VAL 239 239 16091 1 . VAL 240 240 16091 1 . GLU 241 241 16091 1 . ASN 242 242 16091 1 . THR 243 243 16091 1 . ALA 244 244 16091 1 . ASN 245 245 16091 1 . PRO 246 246 16091 1 . HIS 247 247 16091 1 . PHE 248 248 16091 1 . VAL 249 249 16091 1 . ARG 250 250 16091 1 . ARG 251 251 16091 1 . ASN 252 252 16091 1 . ILE 253 253 16091 1 . ILE 254 254 16091 1 . THR 255 255 16091 1 . ARG 256 256 16091 1 . GLY 257 257 16091 1 . ALA 258 258 16091 1 . VAL 259 259 16091 1 . VAL 260 260 16091 1 . GLU 261 261 16091 1 . THR 262 262 16091 1 . ASN 263 263 16091 1 . LEU 264 264 16091 1 . GLY 265 265 16091 1 . ASN 266 266 16091 1 . VAL 267 267 16091 1 . ARG 268 268 16091 1 . VAL 269 269 16091 1 . THR 270 270 16091 1 . SER 271 271 16091 1 . ARG 272 272 16091 1 . PRO 273 273 16091 1 . GLY 274 274 16091 1 . GLN 275 275 16091 1 . ASP 276 276 16091 1 . GLY 277 277 16091 1 . VAL 278 278 16091 1 . ILE 279 279 16091 1 . ASN 280 280 16091 1 . GLY 281 281 16091 1 . VAL 282 282 16091 1 . LEU 283 283 16091 1 . ILE 284 284 16091 1 . ARG 285 285 16091 1 . GLU 286 286 16091 1 . LEU 287 287 16091 1 . GLU 288 288 16091 1 . HIS 289 289 16091 1 . HIS 290 290 16091 1 . HIS 291 291 16091 1 . HIS 292 292 16091 1 . HIS 293 293 16091 1 . HIS 294 294 16091 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 16091 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Subvariant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $rps8e . 145262 organism . 'Methanobacterium thermoautotrophicum' 'Methanobacterium thermoautotrophicum' . . Archaea . Methanobacterium thermoautotrophicum . . . . . . . . . . . . . . . . . . . . . 16091 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 16091 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $rps8e . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . . . . . . . . . . . 'pET 21-23C' . . . . . . 16091 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 16091 _Sample.ID 1 _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 rps8e '[U-100% 13C; U-100% 15N]' . . 1 $rps8e . . 0.94 . . mM . . . . 16091 1 2 H2O 'natural abundance' . . . . . . 95 . . % . . . . 16091 1 3 D2O 'natural abundance' . . . . . . 5 . . % . . . . 16091 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 16091 _Sample.ID 2 _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 rps8e '[U-10% 13C; U-100% 15N]' . . 1 $rps8e . . 1 . . mM . . . . 16091 2 2 H2O 'natural abundance' . . . . . . 95 . . % . . . . 16091 2 3 D2O 'natural abundance' . . . . . . 5 . . % . . . . 16091 2 stop_ save_ save_sample_1d20 _Sample.Sf_category sample _Sample.Sf_framecode sample_1d20 _Sample.Entry_ID 16091 _Sample.ID 3 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% 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 rps8e '[U-100% 13C; U-100% 15N]' . . 1 $rps8e . . 0.94 . . mM . . . . 16091 3 2 D2O 'natural abundance' . . . . . . 100 . . % . . . . 16091 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 16091 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 6.5 . pH 16091 1 pressure 1 . atm 16091 1 temperature 298 . K 16091 1 stop_ save_ ############################ # Computer software used # ############################ save_CNS _Software.Sf_category software _Software.Sf_framecode CNS _Software.Entry_ID 16091 _Software.ID 1 _Software.Name CNS _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Brunger, Adams, Clore, Gros, Nilges and Read' . . 16091 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 16091 1 'structure solution' 16091 1 stop_ save_ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 16091 _Software.ID 2 _Software.Name CYANA _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . 16091 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'geometry optimization' 16091 2 refinement 16091 2 'structure solution' 16091 2 stop_ save_ save_AutoStructure _Software.Sf_category software _Software.Sf_framecode AutoStructure _Software.Entry_ID 16091 _Software.ID 3 _Software.Name AutoStruct _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Huang, Tejero, Powers and Montelione' . . 16091 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'geometry optimization' 16091 3 'peak picking' 16091 3 refinement 16091 3 stop_ save_ save_PSVS _Software.Sf_category software _Software.Sf_framecode PSVS _Software.Entry_ID 16091 _Software.ID 4 _Software.Name PSVS _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bhattacharya and Montelione' . . 16091 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'geometry optimization' 16091 4 stop_ save_ save_AutoAssign _Software.Sf_category software _Software.Sf_framecode AutoAssign _Software.Entry_ID 16091 _Software.ID 5 _Software.Name AutoAssign _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Zimmerman, Moseley, Kulikowski and Montelione' . . 16091 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 16091 5 stop_ save_ save_XEASY _Software.Sf_category software _Software.Sf_framecode XEASY _Software.Entry_ID 16091 _Software.ID 6 _Software.Name XEASY _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bartels et al.' . . 16091 6 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 16091 6 'data analysis' 16091 6 'peak picking' 16091 6 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 16091 _Software.ID 7 _Software.Name NMRPipe _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 16091 7 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 16091 7 stop_ save_ save_TOPSPIN _Software.Sf_category software _Software.Sf_framecode TOPSPIN _Software.Entry_ID 16091 _Software.ID 8 _Software.Name TOPSPIN _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 16091 8 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 16091 8 stop_ save_ save_VNMRJ _Software.Sf_category software _Software.Sf_framecode VNMRJ _Software.Entry_ID 16091 _Software.ID 9 _Software.Name VNMRJ _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Varian . . 16091 9 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 16091 9 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 16091 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details NYSBC _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 16091 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details CABM _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_spectrometer_3 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_3 _NMR_spectrometer.Entry_ID 16091 _NMR_spectrometer.ID 3 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 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 16091 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker Avance . 800 NYSBC . . 16091 1 2 spectrometer_2 Bruker Avance . 800 CABM . . 16091 1 3 spectrometer_3 Varian INOVA . 600 . . . 16091 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 16091 _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' yes . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16091 1 2 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16091 1 3 '2D 1H-15N HSQC' yes . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16091 1 4 '2D 1H-15N HSQC' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16091 1 5 '3D 1H-15N NOESY' yes . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16091 1 6 '3D 1H-13C NOESY' yes . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16091 1 7 '3D 1H-13C NOESY' yes . . . . . . . . . . 3 $sample_1d20 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 16091 1 8 '3D CBCA(CO)NH' yes . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 3 $spectrometer_3 . . . . . . . . . . . . . . . . 16091 1 9 '3D HNCACB' yes . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 3 $spectrometer_3 . . . . . . . . . . . . . . . . 16091 1 10 '3D HBHA(CO)NH' yes . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 3 $spectrometer_3 . . . . . . . . . . . . . . . . 16091 1 11 '3D HCCH-TOCSY' yes . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 3 $spectrometer_3 . . . . . . . . . . . . . . . . 16091 1 12 '2D 1H-13C HSQC' yes . . . . . . . . . . 3 $sample_1d20 isotropic . . 1 $sample_conditions_1 . . . 3 $spectrometer_3 . . . . . . . . . . . . . . . . 16091 1 13 '2D 1H-13C HSQC' yes . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 3 $spectrometer_3 . . . . . . . . . . . . . . . . 16091 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 16091 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 . indirect 0.251449530 . . . . . . . . . 16091 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 16091 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 . indirect 0.101329118 . . . . . . . . . 16091 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 16091 _Assigned_chem_shift_list.ID 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 $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' . . . 16091 1 5 '3D 1H-15N NOESY' . . . 16091 1 6 '3D 1H-13C NOESY' . . . 16091 1 7 '3D 1H-13C NOESY' . . . 16091 1 12 '2D 1H-13C HSQC' . . . 16091 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 5 $AutoAssign . . 16091 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 2 2 ASP HA H 1 4.63 . . 1 . . . . 2 ASP HA . 16091 1 2 . 1 1 2 2 ASP HB2 H 1 2.60 . . 2 . . . . 2 ASP HB2 . 16091 1 3 . 1 1 2 2 ASP HB3 H 1 2.69 . . 2 . . . . 2 ASP HB3 . 16091 1 4 . 1 1 2 2 ASP CA C 13 54.0 . . 1 . . . . 2 ASP CA . 16091 1 5 . 1 1 2 2 ASP CB C 13 41.5 . . 1 . . . . 2 ASP CB . 16091 1 6 . 1 1 3 3 ARG H H 1 8.51 . . 1 . . . . 3 ARG H . 16091 1 7 . 1 1 3 3 ARG HA H 1 4.28 . . 1 . . . . 3 ARG HA . 16091 1 8 . 1 1 3 3 ARG HB2 H 1 1.77 . . 2 . . . . 3 ARG HB2 . 16091 1 9 . 1 1 3 3 ARG HB3 H 1 1.77 . . 2 . . . . 3 ARG HB3 . 16091 1 10 . 1 1 3 3 ARG HD2 H 1 3.18 . . 2 . . . . 3 ARG HD2 . 16091 1 11 . 1 1 3 3 ARG HD3 H 1 3.18 . . 2 . . . . 3 ARG HD3 . 16091 1 12 . 1 1 3 3 ARG HG2 H 1 1.59 . . 2 . . . . 3 ARG HG2 . 16091 1 13 . 1 1 3 3 ARG HG3 H 1 1.59 . . 2 . . . . 3 ARG HG3 . 16091 1 14 . 1 1 3 3 ARG CA C 13 56.3 . . 1 . . . . 3 ARG CA . 16091 1 15 . 1 1 3 3 ARG CB C 13 30.3 . . 1 . . . . 3 ARG CB . 16091 1 16 . 1 1 3 3 ARG CD C 13 43.1 . . 1 . . . . 3 ARG CD . 16091 1 17 . 1 1 3 3 ARG CG C 13 27.0 . . 1 . . . . 3 ARG CG . 16091 1 18 . 1 1 3 3 ARG N N 15 122.3 . . 1 . . . . 3 ARG N . 16091 1 19 . 1 1 4 4 ARG H H 1 8.40 . . 1 . . . . 4 ARG H . 16091 1 20 . 1 1 4 4 ARG HA H 1 4.29 . . 1 . . . . 4 ARG HA . 16091 1 21 . 1 1 4 4 ARG HB2 H 1 1.78 . . 2 . . . . 4 ARG HB2 . 16091 1 22 . 1 1 4 4 ARG HB3 H 1 1.76 . . 2 . . . . 4 ARG HB3 . 16091 1 23 . 1 1 4 4 ARG HD2 H 1 3.16 . . 2 . . . . 4 ARG HD2 . 16091 1 24 . 1 1 4 4 ARG HD3 H 1 3.16 . . 2 . . . . 4 ARG HD3 . 16091 1 25 . 1 1 4 4 ARG HG2 H 1 1.60 . . 2 . . . . 4 ARG HG2 . 16091 1 26 . 1 1 4 4 ARG HG3 H 1 1.61 . . 2 . . . . 4 ARG HG3 . 16091 1 27 . 1 1 4 4 ARG CA C 13 56.1 . . 1 . . . . 4 ARG CA . 16091 1 28 . 1 1 4 4 ARG CB C 13 30.5 . . 1 . . . . 4 ARG CB . 16091 1 29 . 1 1 4 4 ARG CD C 13 43.2 . . 1 . . . . 4 ARG CD . 16091 1 30 . 1 1 4 4 ARG CG C 13 27.0 . . 1 . . . . 4 ARG CG . 16091 1 31 . 1 1 4 4 ARG N N 15 122.3 . . 1 . . . . 4 ARG N . 16091 1 32 . 1 1 5 5 VAL H H 1 8.12 . . 1 . . . . 5 VAL H . 16091 1 33 . 1 1 5 5 VAL HA H 1 4.08 . . 1 . . . . 5 VAL HA . 16091 1 34 . 1 1 5 5 VAL HB H 1 2.01 . . 1 . . . . 5 VAL HB . 16091 1 35 . 1 1 5 5 VAL HG11 H 1 0.90 . . 2 . . . . 5 VAL HG1 . 16091 1 36 . 1 1 5 5 VAL HG12 H 1 0.90 . . 2 . . . . 5 VAL HG1 . 16091 1 37 . 1 1 5 5 VAL HG13 H 1 0.90 . . 2 . . . . 5 VAL HG1 . 16091 1 38 . 1 1 5 5 VAL HG21 H 1 0.90 . . 2 . . . . 5 VAL HG2 . 16091 1 39 . 1 1 5 5 VAL HG22 H 1 0.90 . . 2 . . . . 5 VAL HG2 . 16091 1 40 . 1 1 5 5 VAL HG23 H 1 0.90 . . 2 . . . . 5 VAL HG2 . 16091 1 41 . 1 1 5 5 VAL CA C 13 62.2 . . 1 . . . . 5 VAL CA . 16091 1 42 . 1 1 5 5 VAL CB C 13 32.7 . . 1 . . . . 5 VAL CB . 16091 1 43 . 1 1 5 5 VAL CG1 C 13 20.8 . . 1 . . . . 5 VAL CG1 . 16091 1 44 . 1 1 5 5 VAL CG2 C 13 20.8 . . 1 . . . . 5 VAL CG2 . 16091 1 45 . 1 1 5 5 VAL N N 15 121.3 . . 1 . . . . 5 VAL N . 16091 1 46 . 1 1 6 6 ARG H H 1 8.38 . . 1 . . . . 6 ARG H . 16091 1 47 . 1 1 6 6 ARG HA H 1 4.35 . . 1 . . . . 6 ARG HA . 16091 1 48 . 1 1 6 6 ARG HB2 H 1 1.71 . . 2 . . . . 6 ARG HB2 . 16091 1 49 . 1 1 6 6 ARG HB3 H 1 1.77 . . 2 . . . . 6 ARG HB3 . 16091 1 50 . 1 1 6 6 ARG HD2 H 1 3.16 . . 2 . . . . 6 ARG HD2 . 16091 1 51 . 1 1 6 6 ARG HD3 H 1 3.16 . . 2 . . . . 6 ARG HD3 . 16091 1 52 . 1 1 6 6 ARG HG2 H 1 1.56 . . 2 . . . . 6 ARG HG2 . 16091 1 53 . 1 1 6 6 ARG HG3 H 1 1.60 . . 2 . . . . 6 ARG HG3 . 16091 1 54 . 1 1 6 6 ARG CA C 13 55.7 . . 1 . . . . 6 ARG CA . 16091 1 55 . 1 1 6 6 ARG CB C 13 31.1 . . 1 . . . . 6 ARG CB . 16091 1 56 . 1 1 6 6 ARG CD C 13 43.2 . . 1 . . . . 6 ARG CD . 16091 1 57 . 1 1 6 6 ARG CG C 13 27.1 . . 1 . . . . 6 ARG CG . 16091 1 58 . 1 1 6 6 ARG N N 15 125.2 . . 1 . . . . 6 ARG N . 16091 1 59 . 1 1 7 7 LEU H H 1 8.27 . . 1 . . . . 7 LEU H . 16091 1 60 . 1 1 7 7 LEU HA H 1 4.37 . . 1 . . . . 7 LEU HA . 16091 1 61 . 1 1 7 7 LEU HB2 H 1 1.57 . . 2 . . . . 7 LEU HB2 . 16091 1 62 . 1 1 7 7 LEU HB3 H 1 1.57 . . 2 . . . . 7 LEU HB3 . 16091 1 63 . 1 1 7 7 LEU HD11 H 1 0.86 . . 2 . . . . 7 LEU HD1 . 16091 1 64 . 1 1 7 7 LEU HD12 H 1 0.86 . . 2 . . . . 7 LEU HD1 . 16091 1 65 . 1 1 7 7 LEU HD13 H 1 0.86 . . 2 . . . . 7 LEU HD1 . 16091 1 66 . 1 1 7 7 LEU HD21 H 1 0.81 . . 2 . . . . 7 LEU HD2 . 16091 1 67 . 1 1 7 7 LEU HD22 H 1 0.81 . . 2 . . . . 7 LEU HD2 . 16091 1 68 . 1 1 7 7 LEU HD23 H 1 0.81 . . 2 . . . . 7 LEU HD2 . 16091 1 69 . 1 1 7 7 LEU HG H 1 1.57 . . 1 . . . . 7 LEU HG . 16091 1 70 . 1 1 7 7 LEU CA C 13 54.9 . . 1 . . . . 7 LEU CA . 16091 1 71 . 1 1 7 7 LEU CB C 13 42.5 . . 1 . . . . 7 LEU CB . 16091 1 72 . 1 1 7 7 LEU CD1 C 13 24.8 . . 1 . . . . 7 LEU CD1 . 16091 1 73 . 1 1 7 7 LEU CD2 C 13 23.7 . . 1 . . . . 7 LEU CD2 . 16091 1 74 . 1 1 7 7 LEU CG C 13 27.1 . . 1 . . . . 7 LEU CG . 16091 1 75 . 1 1 7 7 LEU N N 15 124.3 . . 1 . . . . 7 LEU N . 16091 1 76 . 1 1 8 8 ILE H H 1 8.22 . . 1 . . . . 8 ILE H . 16091 1 77 . 1 1 8 8 ILE HA H 1 4.16 . . 1 . . . . 8 ILE HA . 16091 1 78 . 1 1 8 8 ILE HB H 1 1.80 . . 1 . . . . 8 ILE HB . 16091 1 79 . 1 1 8 8 ILE HD11 H 1 0.79 . . 1 . . . . 8 ILE HD1 . 16091 1 80 . 1 1 8 8 ILE HD12 H 1 0.79 . . 1 . . . . 8 ILE HD1 . 16091 1 81 . 1 1 8 8 ILE HD13 H 1 0.79 . . 1 . . . . 8 ILE HD1 . 16091 1 82 . 1 1 8 8 ILE HG12 H 1 1.12 . . 2 . . . . 8 ILE HG12 . 16091 1 83 . 1 1 8 8 ILE HG13 H 1 1.43 . . 2 . . . . 8 ILE HG13 . 16091 1 84 . 1 1 8 8 ILE HG21 H 1 0.84 . . 1 . . . . 8 ILE HG2 . 16091 1 85 . 1 1 8 8 ILE HG22 H 1 0.84 . . 1 . . . . 8 ILE HG2 . 16091 1 86 . 1 1 8 8 ILE HG23 H 1 0.84 . . 1 . . . . 8 ILE HG2 . 16091 1 87 . 1 1 8 8 ILE CA C 13 60.8 . . 1 . . . . 8 ILE CA . 16091 1 88 . 1 1 8 8 ILE CB C 13 38.5 . . 1 . . . . 8 ILE CB . 16091 1 89 . 1 1 8 8 ILE CD1 C 13 12.8 . . 1 . . . . 8 ILE CD1 . 16091 1 90 . 1 1 8 8 ILE CG1 C 13 27.1 . . 1 . . . . 8 ILE CG1 . 16091 1 91 . 1 1 8 8 ILE CG2 C 13 17.4 . . 1 . . . . 8 ILE CG2 . 16091 1 92 . 1 1 8 8 ILE N N 15 122.8 . . 1 . . . . 8 ILE N . 16091 1 93 . 1 1 9 9 ARG H H 1 8.44 . . 1 . . . . 9 ARG H . 16091 1 94 . 1 1 9 9 ARG HA H 1 4.44 . . 1 . . . . 9 ARG HA . 16091 1 95 . 1 1 9 9 ARG HB2 H 1 1.81 . . 2 . . . . 9 ARG HB2 . 16091 1 96 . 1 1 9 9 ARG HB3 H 1 1.74 . . 2 . . . . 9 ARG HB3 . 16091 1 97 . 1 1 9 9 ARG HD2 H 1 3.16 . . 2 . . . . 9 ARG HD2 . 16091 1 98 . 1 1 9 9 ARG HD3 H 1 3.16 . . 2 . . . . 9 ARG HD3 . 16091 1 99 . 1 1 9 9 ARG HG2 H 1 1.57 . . 2 . . . . 9 ARG HG2 . 16091 1 100 . 1 1 9 9 ARG HG3 H 1 1.58 . . 2 . . . . 9 ARG HG3 . 16091 1 101 . 1 1 9 9 ARG CA C 13 55.7 . . 1 . . . . 9 ARG CA . 16091 1 102 . 1 1 9 9 ARG CB C 13 30.8 . . 1 . . . . 9 ARG CB . 16091 1 103 . 1 1 9 9 ARG CD C 13 43.3 . . 1 . . . . 9 ARG CD . 16091 1 104 . 1 1 9 9 ARG CG C 13 27.3 . . 1 . . . . 9 ARG CG . 16091 1 105 . 1 1 9 9 ARG N N 15 125.4 . . 1 . . . . 9 ARG N . 16091 1 106 . 1 1 10 10 THR H H 1 8.19 . . 1 . . . . 10 THR H . 16091 1 107 . 1 1 10 10 THR HA H 1 4.37 . . 1 . . . . 10 THR HA . 16091 1 108 . 1 1 10 10 THR HB H 1 4.20 . . 1 . . . . 10 THR HB . 16091 1 109 . 1 1 10 10 THR HG21 H 1 1.17 . . 1 . . . . 10 THR HG2 . 16091 1 110 . 1 1 10 10 THR HG22 H 1 1.17 . . 1 . . . . 10 THR HG2 . 16091 1 111 . 1 1 10 10 THR HG23 H 1 1.17 . . 1 . . . . 10 THR HG2 . 16091 1 112 . 1 1 10 10 THR CA C 13 61.6 . . 1 . . . . 10 THR CA . 16091 1 113 . 1 1 10 10 THR CB C 13 69.7 . . 1 . . . . 10 THR CB . 16091 1 114 . 1 1 10 10 THR CG2 C 13 21.8 . . 1 . . . . 10 THR CG2 . 16091 1 115 . 1 1 10 10 THR N N 15 116.0 . . 1 . . . . 10 THR N . 16091 1 116 . 1 1 11 11 ARG H H 1 8.45 . . 1 . . . . 11 ARG H . 16091 1 117 . 1 1 11 11 ARG HA H 1 4.36 . . 1 . . . . 11 ARG HA . 16091 1 118 . 1 1 11 11 ARG HB2 H 1 1.79 . . 2 . . . . 11 ARG HB2 . 16091 1 119 . 1 1 11 11 ARG HB3 H 1 1.88 . . 2 . . . . 11 ARG HB3 . 16091 1 120 . 1 1 11 11 ARG HD2 H 1 3.17 . . 2 . . . . 11 ARG HD2 . 16091 1 121 . 1 1 11 11 ARG HD3 H 1 3.16 . . 2 . . . . 11 ARG HD3 . 16091 1 122 . 1 1 11 11 ARG HG2 H 1 1.62 . . 2 . . . . 11 ARG HG2 . 16091 1 123 . 1 1 11 11 ARG HG3 H 1 1.63 . . 2 . . . . 11 ARG HG3 . 16091 1 124 . 1 1 11 11 ARG CA C 13 56.1 . . 1 . . . . 11 ARG CA . 16091 1 125 . 1 1 11 11 ARG CB C 13 30.7 . . 1 . . . . 11 ARG CB . 16091 1 126 . 1 1 11 11 ARG CD C 13 43.4 . . 1 . . . . 11 ARG CD . 16091 1 127 . 1 1 11 11 ARG CG C 13 27.1 . . 1 . . . . 11 ARG CG . 16091 1 128 . 1 1 11 11 ARG N N 15 123.5 . . 1 . . . . 11 ARG N . 16091 1 129 . 1 1 12 12 GLY H H 1 8.47 . . 1 . . . . 12 GLY H . 16091 1 130 . 1 1 12 12 GLY HA2 H 1 3.95 . . 2 . . . . 12 GLY HA2 . 16091 1 131 . 1 1 12 12 GLY HA3 H 1 3.95 . . 2 . . . . 12 GLY HA3 . 16091 1 132 . 1 1 12 12 GLY CA C 13 45.0 . . 1 . . . . 12 GLY CA . 16091 1 133 . 1 1 12 12 GLY N N 15 110.4 . . 1 . . . . 12 GLY N . 16091 1 134 . 1 1 13 13 GLY H H 1 8.28 . . 1 . . . . 13 GLY H . 16091 1 135 . 1 1 13 13 GLY HA2 H 1 3.96 . . 2 . . . . 13 GLY HA2 . 16091 1 136 . 1 1 13 13 GLY HA3 H 1 3.96 . . 2 . . . . 13 GLY HA3 . 16091 1 137 . 1 1 13 13 GLY CA C 13 45.1 . . 1 . . . . 13 GLY CA . 16091 1 138 . 1 1 13 13 GLY N N 15 108.8 . . 1 . . . . 13 GLY N . 16091 1 139 . 1 1 14 14 ASN H H 1 8.38 . . 1 . . . . 14 ASN H . 16091 1 140 . 1 1 14 14 ASN HA H 1 4.79 . . 1 . . . . 14 ASN HA . 16091 1 141 . 1 1 14 14 ASN HB2 H 1 2.75 . . 2 . . . . 14 ASN HB2 . 16091 1 142 . 1 1 14 14 ASN HB3 H 1 2.83 . . 2 . . . . 14 ASN HB3 . 16091 1 143 . 1 1 14 14 ASN HD21 H 1 7.59 . . 2 . . . . 14 ASN HD21 . 16091 1 144 . 1 1 14 14 ASN HD22 H 1 6.91 . . 2 . . . . 14 ASN HD22 . 16091 1 145 . 1 1 14 14 ASN CA C 13 53.0 . . 1 . . . . 14 ASN CA . 16091 1 146 . 1 1 14 14 ASN CB C 13 38.7 . . 1 . . . . 14 ASN CB . 16091 1 147 . 1 1 14 14 ASN N N 15 118.7 . . 1 . . . . 14 ASN N . 16091 1 148 . 1 1 14 14 ASN ND2 N 15 112.9 . . 1 . . . . 14 ASN ND2 . 16091 1 149 . 1 1 15 15 THR H H 1 8.15 . . 1 . . . . 15 THR H . 16091 1 150 . 1 1 15 15 THR HA H 1 4.31 . . 1 . . . . 15 THR HA . 16091 1 151 . 1 1 15 15 THR HB H 1 4.19 . . 1 . . . . 15 THR HB . 16091 1 152 . 1 1 15 15 THR HG21 H 1 1.16 . . 1 . . . . 15 THR HG2 . 16091 1 153 . 1 1 15 15 THR HG22 H 1 1.16 . . 1 . . . . 15 THR HG2 . 16091 1 154 . 1 1 15 15 THR HG23 H 1 1.16 . . 1 . . . . 15 THR HG2 . 16091 1 155 . 1 1 15 15 THR CA C 13 62.1 . . 1 . . . . 15 THR CA . 16091 1 156 . 1 1 15 15 THR CB C 13 69.7 . . 1 . . . . 15 THR CB . 16091 1 157 . 1 1 15 15 THR CG2 C 13 21.5 . . 1 . . . . 15 THR CG2 . 16091 1 158 . 1 1 15 15 THR N N 15 114.7 . . 1 . . . . 15 THR N . 16091 1 159 . 1 1 16 16 LYS H H 1 8.32 . . 1 . . . . 16 LYS H . 16091 1 160 . 1 1 16 16 LYS HA H 1 4.38 . . 1 . . . . 16 LYS HA . 16091 1 161 . 1 1 16 16 LYS HB2 H 1 1.73 . . 2 . . . . 16 LYS HB2 . 16091 1 162 . 1 1 16 16 LYS HB3 H 1 1.76 . . 2 . . . . 16 LYS HB3 . 16091 1 163 . 1 1 16 16 LYS HD2 H 1 1.64 . . 2 . . . . 16 LYS HD2 . 16091 1 164 . 1 1 16 16 LYS HD3 H 1 1.64 . . 2 . . . . 16 LYS HD3 . 16091 1 165 . 1 1 16 16 LYS HE2 H 1 2.96 . . 2 . . . . 16 LYS HE2 . 16091 1 166 . 1 1 16 16 LYS HE3 H 1 2.95 . . 2 . . . . 16 LYS HE3 . 16091 1 167 . 1 1 16 16 LYS HG2 H 1 1.35 . . 2 . . . . 16 LYS HG2 . 16091 1 168 . 1 1 16 16 LYS HG3 H 1 1.41 . . 2 . . . . 16 LYS HG3 . 16091 1 169 . 1 1 16 16 LYS CA C 13 56.1 . . 1 . . . . 16 LYS CA . 16091 1 170 . 1 1 16 16 LYS CB C 13 32.9 . . 1 . . . . 16 LYS CB . 16091 1 171 . 1 1 16 16 LYS CD C 13 28.9 . . 1 . . . . 16 LYS CD . 16091 1 172 . 1 1 16 16 LYS CE C 13 42.0 . . 1 . . . . 16 LYS CE . 16091 1 173 . 1 1 16 16 LYS CG C 13 24.7 . . 1 . . . . 16 LYS CG . 16091 1 174 . 1 1 16 16 LYS N N 15 123.7 . . 1 . . . . 16 LYS N . 16091 1 175 . 1 1 17 17 VAL H H 1 8.16 . . 1 . . . . 17 VAL H . 16091 1 176 . 1 1 17 17 VAL HA H 1 4.08 . . 1 . . . . 17 VAL HA . 16091 1 177 . 1 1 17 17 VAL HB H 1 1.97 . . 1 . . . . 17 VAL HB . 16091 1 178 . 1 1 17 17 VAL HG11 H 1 0.85 . . 2 . . . . 17 VAL HG1 . 16091 1 179 . 1 1 17 17 VAL HG12 H 1 0.85 . . 2 . . . . 17 VAL HG1 . 16091 1 180 . 1 1 17 17 VAL HG13 H 1 0.85 . . 2 . . . . 17 VAL HG1 . 16091 1 181 . 1 1 17 17 VAL HG21 H 1 0.87 . . 2 . . . . 17 VAL HG2 . 16091 1 182 . 1 1 17 17 VAL HG22 H 1 0.87 . . 2 . . . . 17 VAL HG2 . 16091 1 183 . 1 1 17 17 VAL HG23 H 1 0.87 . . 2 . . . . 17 VAL HG2 . 16091 1 184 . 1 1 17 17 VAL CA C 13 61.9 . . 1 . . . . 17 VAL CA . 16091 1 185 . 1 1 17 17 VAL CB C 13 32.8 . . 1 . . . . 17 VAL CB . 16091 1 186 . 1 1 17 17 VAL CG1 C 13 21.0 . . 1 . . . . 17 VAL CG1 . 16091 1 187 . 1 1 17 17 VAL CG2 C 13 20.9 . . 1 . . . . 17 VAL CG2 . 16091 1 188 . 1 1 17 17 VAL N N 15 121.7 . . 1 . . . . 17 VAL N . 16091 1 189 . 1 1 18 18 ARG H H 1 8.39 . . 1 . . . . 18 ARG H . 16091 1 190 . 1 1 18 18 ARG HA H 1 4.41 . . 1 . . . . 18 ARG HA . 16091 1 191 . 1 1 18 18 ARG HB2 H 1 1.72 . . 2 . . . . 18 ARG HB2 . 16091 1 192 . 1 1 18 18 ARG HB3 H 1 1.79 . . 2 . . . . 18 ARG HB3 . 16091 1 193 . 1 1 18 18 ARG HD2 H 1 3.16 . . 2 . . . . 18 ARG HD2 . 16091 1 194 . 1 1 18 18 ARG HD3 H 1 3.16 . . 2 . . . . 18 ARG HD3 . 16091 1 195 . 1 1 18 18 ARG HG2 H 1 1.57 . . 2 . . . . 18 ARG HG2 . 16091 1 196 . 1 1 18 18 ARG HG3 H 1 1.61 . . 2 . . . . 18 ARG HG3 . 16091 1 197 . 1 1 18 18 ARG CA C 13 55.5 . . 1 . . . . 18 ARG CA . 16091 1 198 . 1 1 18 18 ARG CB C 13 31.1 . . 1 . . . . 18 ARG CB . 16091 1 199 . 1 1 18 18 ARG CD C 13 43.2 . . 1 . . . . 18 ARG CD . 16091 1 200 . 1 1 18 18 ARG CG C 13 27.3 . . 1 . . . . 18 ARG CG . 16091 1 201 . 1 1 18 18 ARG N N 15 125.5 . . 1 . . . . 18 ARG N . 16091 1 202 . 1 1 19 19 LEU H H 1 8.38 . . 1 . . . . 19 LEU H . 16091 1 203 . 1 1 19 19 LEU HA H 1 4.32 . . 1 . . . . 19 LEU HA . 16091 1 204 . 1 1 19 19 LEU HB2 H 1 1.56 . . 2 . . . . 19 LEU HB2 . 16091 1 205 . 1 1 19 19 LEU HB3 H 1 1.56 . . 2 . . . . 19 LEU HB3 . 16091 1 206 . 1 1 19 19 LEU HD11 H 1 0.86 . . 2 . . . . 19 LEU HD1 . 16091 1 207 . 1 1 19 19 LEU HD12 H 1 0.86 . . 2 . . . . 19 LEU HD1 . 16091 1 208 . 1 1 19 19 LEU HD13 H 1 0.86 . . 2 . . . . 19 LEU HD1 . 16091 1 209 . 1 1 19 19 LEU HD21 H 1 0.80 . . 2 . . . . 19 LEU HD2 . 16091 1 210 . 1 1 19 19 LEU HD22 H 1 0.80 . . 2 . . . . 19 LEU HD2 . 16091 1 211 . 1 1 19 19 LEU HD23 H 1 0.80 . . 2 . . . . 19 LEU HD2 . 16091 1 212 . 1 1 19 19 LEU HG H 1 1.55 . . 1 . . . . 19 LEU HG . 16091 1 213 . 1 1 19 19 LEU CA C 13 54.9 . . 1 . . . . 19 LEU CA . 16091 1 214 . 1 1 19 19 LEU CB C 13 42.4 . . 1 . . . . 19 LEU CB . 16091 1 215 . 1 1 19 19 LEU CD1 C 13 24.9 . . 1 . . . . 19 LEU CD1 . 16091 1 216 . 1 1 19 19 LEU CD2 C 13 23.5 . . 1 . . . . 19 LEU CD2 . 16091 1 217 . 1 1 19 19 LEU CG C 13 27.1 . . 1 . . . . 19 LEU CG . 16091 1 218 . 1 1 19 19 LEU N N 15 124.2 . . 1 . . . . 19 LEU N . 16091 1 219 . 1 1 20 20 ALA H H 1 8.42 . . 1 . . . . 20 ALA H . 16091 1 220 . 1 1 20 20 ALA HA H 1 4.32 . . 1 . . . . 20 ALA HA . 16091 1 221 . 1 1 20 20 ALA HB1 H 1 1.38 . . 1 . . . . 20 ALA HB . 16091 1 222 . 1 1 20 20 ALA HB2 H 1 1.38 . . 1 . . . . 20 ALA HB . 16091 1 223 . 1 1 20 20 ALA HB3 H 1 1.38 . . 1 . . . . 20 ALA HB . 16091 1 224 . 1 1 20 20 ALA CA C 13 52.3 . . 1 . . . . 20 ALA CA . 16091 1 225 . 1 1 20 20 ALA CB C 13 19.2 . . 1 . . . . 20 ALA CB . 16091 1 226 . 1 1 20 20 ALA N N 15 125.4 . . 1 . . . . 20 ALA N . 16091 1 227 . 1 1 21 21 SER H H 1 8.21 . . 1 . . . . 21 SER H . 16091 1 228 . 1 1 21 21 SER HA H 1 4.34 . . 1 . . . . 21 SER HA . 16091 1 229 . 1 1 21 21 SER HB2 H 1 3.80 . . 2 . . . . 21 SER HB2 . 16091 1 230 . 1 1 21 21 SER HB3 H 1 3.89 . . 2 . . . . 21 SER HB3 . 16091 1 231 . 1 1 21 21 SER CA C 13 58.7 . . 1 . . . . 21 SER CA . 16091 1 232 . 1 1 21 21 SER CB C 13 63.5 . . 1 . . . . 21 SER CB . 16091 1 233 . 1 1 21 21 SER N N 15 114.0 . . 1 . . . . 21 SER N . 16091 1 234 . 1 1 22 22 ASP H H 1 8.24 . . 1 . . . . 22 ASP H . 16091 1 235 . 1 1 22 22 ASP HA H 1 4.66 . . 1 . . . . 22 ASP HA . 16091 1 236 . 1 1 22 22 ASP HB2 H 1 2.70 . . 2 . . . . 22 ASP HB2 . 16091 1 237 . 1 1 22 22 ASP HB3 H 1 2.70 . . 2 . . . . 22 ASP HB3 . 16091 1 238 . 1 1 22 22 ASP CA C 13 54.1 . . 1 . . . . 22 ASP CA . 16091 1 239 . 1 1 22 22 ASP CB C 13 41.0 . . 1 . . . . 22 ASP CB . 16091 1 240 . 1 1 22 22 ASP N N 15 121.1 . . 1 . . . . 22 ASP N . 16091 1 241 . 1 1 23 23 THR H H 1 8.12 . . 1 . . . . 23 THR H . 16091 1 242 . 1 1 23 23 THR HA H 1 4.30 . . 1 . . . . 23 THR HA . 16091 1 243 . 1 1 23 23 THR HB H 1 4.30 . . 1 . . . . 23 THR HB . 16091 1 244 . 1 1 23 23 THR HG21 H 1 1.15 . . 1 . . . . 23 THR HG2 . 16091 1 245 . 1 1 23 23 THR HG22 H 1 1.15 . . 1 . . . . 23 THR HG2 . 16091 1 246 . 1 1 23 23 THR HG23 H 1 1.15 . . 1 . . . . 23 THR HG2 . 16091 1 247 . 1 1 23 23 THR CA C 13 62.0 . . 1 . . . . 23 THR CA . 16091 1 248 . 1 1 23 23 THR CB C 13 69.2 . . 1 . . . . 23 THR CB . 16091 1 249 . 1 1 23 23 THR CG2 C 13 22.1 . . 1 . . . . 23 THR CG2 . 16091 1 250 . 1 1 23 23 THR N N 15 113.3 . . 1 . . . . 23 THR N . 16091 1 251 . 1 1 24 24 ARG H H 1 8.03 . . 1 . . . . 24 ARG H . 16091 1 252 . 1 1 24 24 ARG HA H 1 5.01 . . 1 . . . . 24 ARG HA . 16091 1 253 . 1 1 24 24 ARG HB2 H 1 1.71 . . 2 . . . . 24 ARG HB2 . 16091 1 254 . 1 1 24 24 ARG HB3 H 1 1.72 . . 2 . . . . 24 ARG HB3 . 16091 1 255 . 1 1 24 24 ARG HD2 H 1 3.04 . . 2 . . . . 24 ARG HD2 . 16091 1 256 . 1 1 24 24 ARG HD3 H 1 3.15 . . 2 . . . . 24 ARG HD3 . 16091 1 257 . 1 1 24 24 ARG HG2 H 1 1.54 . . 2 . . . . 24 ARG HG2 . 16091 1 258 . 1 1 24 24 ARG HG3 H 1 1.54 . . 2 . . . . 24 ARG HG3 . 16091 1 259 . 1 1 24 24 ARG CA C 13 55.0 . . 1 . . . . 24 ARG CA . 16091 1 260 . 1 1 24 24 ARG CB C 13 32.7 . . 1 . . . . 24 ARG CB . 16091 1 261 . 1 1 24 24 ARG CD C 13 43.4 . . 1 . . . . 24 ARG CD . 16091 1 262 . 1 1 24 24 ARG CG C 13 27.3 . . 1 . . . . 24 ARG CG . 16091 1 263 . 1 1 24 24 ARG N N 15 124.2 . . 1 . . . . 24 ARG N . 16091 1 264 . 1 1 25 25 ILE H H 1 8.65 . . 1 . . . . 25 ILE H . 16091 1 265 . 1 1 25 25 ILE HA H 1 4.66 . . 1 . . . . 25 ILE HA . 16091 1 266 . 1 1 25 25 ILE HB H 1 1.37 . . 1 . . . . 25 ILE HB . 16091 1 267 . 1 1 25 25 ILE HD11 H 1 0.50 . . 1 . . . . 25 ILE HD1 . 16091 1 268 . 1 1 25 25 ILE HD12 H 1 0.50 . . 1 . . . . 25 ILE HD1 . 16091 1 269 . 1 1 25 25 ILE HD13 H 1 0.50 . . 1 . . . . 25 ILE HD1 . 16091 1 270 . 1 1 25 25 ILE HG12 H 1 0.59 . . 2 . . . . 25 ILE HG12 . 16091 1 271 . 1 1 25 25 ILE HG13 H 1 1.29 . . 2 . . . . 25 ILE HG13 . 16091 1 272 . 1 1 25 25 ILE HG21 H 1 0.63 . . 1 . . . . 25 ILE HG2 . 16091 1 273 . 1 1 25 25 ILE HG22 H 1 0.63 . . 1 . . . . 25 ILE HG2 . 16091 1 274 . 1 1 25 25 ILE HG23 H 1 0.63 . . 1 . . . . 25 ILE HG2 . 16091 1 275 . 1 1 25 25 ILE CA C 13 58.1 . . 1 . . . . 25 ILE CA . 16091 1 276 . 1 1 25 25 ILE CB C 13 42.0 . . 1 . . . . 25 ILE CB . 16091 1 277 . 1 1 25 25 ILE CD1 C 13 16.0 . . 1 . . . . 25 ILE CD1 . 16091 1 278 . 1 1 25 25 ILE CG1 C 13 27.8 . . 1 . . . . 25 ILE CG1 . 16091 1 279 . 1 1 25 25 ILE CG2 C 13 15.7 . . 1 . . . . 25 ILE CG2 . 16091 1 280 . 1 1 25 25 ILE N N 15 118.3 . . 1 . . . . 25 ILE N . 16091 1 281 . 1 1 26 26 ASN H H 1 8.82 . . 1 . . . . 26 ASN H . 16091 1 282 . 1 1 26 26 ASN HA H 1 4.79 . . 1 . . . . 26 ASN HA . 16091 1 283 . 1 1 26 26 ASN HB2 H 1 2.34 . . 2 . . . . 26 ASN HB2 . 16091 1 284 . 1 1 26 26 ASN HB3 H 1 3.14 . . 2 . . . . 26 ASN HB3 . 16091 1 285 . 1 1 26 26 ASN HD21 H 1 6.56 . . 2 . . . . 26 ASN HD21 . 16091 1 286 . 1 1 26 26 ASN HD22 H 1 7.15 . . 2 . . . . 26 ASN HD22 . 16091 1 287 . 1 1 26 26 ASN CA C 13 52.5 . . 1 . . . . 26 ASN CA . 16091 1 288 . 1 1 26 26 ASN CB C 13 38.4 . . 1 . . . . 26 ASN CB . 16091 1 289 . 1 1 26 26 ASN N N 15 126.4 . . 1 . . . . 26 ASN N . 16091 1 290 . 1 1 26 26 ASN ND2 N 15 112.1 . . 1 . . . . 26 ASN ND2 . 16091 1 291 . 1 1 27 27 VAL H H 1 9.22 . . 1 . . . . 27 VAL H . 16091 1 292 . 1 1 27 27 VAL HA H 1 4.15 . . 1 . . . . 27 VAL HA . 16091 1 293 . 1 1 27 27 VAL HB H 1 2.05 . . 1 . . . . 27 VAL HB . 16091 1 294 . 1 1 27 27 VAL HG11 H 1 0.68 . . 2 . . . . 27 VAL HG1 . 16091 1 295 . 1 1 27 27 VAL HG12 H 1 0.68 . . 2 . . . . 27 VAL HG1 . 16091 1 296 . 1 1 27 27 VAL HG13 H 1 0.68 . . 2 . . . . 27 VAL HG1 . 16091 1 297 . 1 1 27 27 VAL HG21 H 1 0.79 . . 2 . . . . 27 VAL HG2 . 16091 1 298 . 1 1 27 27 VAL HG22 H 1 0.79 . . 2 . . . . 27 VAL HG2 . 16091 1 299 . 1 1 27 27 VAL HG23 H 1 0.79 . . 2 . . . . 27 VAL HG2 . 16091 1 300 . 1 1 27 27 VAL CA C 13 61.9 . . 1 . . . . 27 VAL CA . 16091 1 301 . 1 1 27 27 VAL CB C 13 32.7 . . 1 . . . . 27 VAL CB . 16091 1 302 . 1 1 27 27 VAL CG1 C 13 22.9 . . 1 . . . . 27 VAL CG1 . 16091 1 303 . 1 1 27 27 VAL CG2 C 13 24.3 . . 1 . . . . 27 VAL CG2 . 16091 1 304 . 1 1 27 27 VAL N N 15 126.6 . . 1 . . . . 27 VAL N . 16091 1 305 . 1 1 28 28 VAL H H 1 8.68 . . 1 . . . . 28 VAL H . 16091 1 306 . 1 1 28 28 VAL HA H 1 4.56 . . 1 . . . . 28 VAL HA . 16091 1 307 . 1 1 28 28 VAL HB H 1 1.94 . . 1 . . . . 28 VAL HB . 16091 1 308 . 1 1 28 28 VAL HG11 H 1 0.76 . . 2 . . . . 28 VAL HG1 . 16091 1 309 . 1 1 28 28 VAL HG12 H 1 0.76 . . 2 . . . . 28 VAL HG1 . 16091 1 310 . 1 1 28 28 VAL HG13 H 1 0.76 . . 2 . . . . 28 VAL HG1 . 16091 1 311 . 1 1 28 28 VAL HG21 H 1 0.86 . . 2 . . . . 28 VAL HG2 . 16091 1 312 . 1 1 28 28 VAL HG22 H 1 0.86 . . 2 . . . . 28 VAL HG2 . 16091 1 313 . 1 1 28 28 VAL HG23 H 1 0.86 . . 2 . . . . 28 VAL HG2 . 16091 1 314 . 1 1 28 28 VAL CA C 13 60.6 . . 1 . . . . 28 VAL CA . 16091 1 315 . 1 1 28 28 VAL CB C 13 33.8 . . 1 . . . . 28 VAL CB . 16091 1 316 . 1 1 28 28 VAL CG1 C 13 20.4 . . 1 . . . . 28 VAL CG1 . 16091 1 317 . 1 1 28 28 VAL CG2 C 13 21.6 . . 1 . . . . 28 VAL CG2 . 16091 1 318 . 1 1 28 28 VAL N N 15 128.7 . . 1 . . . . 28 VAL N . 16091 1 319 . 1 1 29 29 ASP H H 1 8.40 . . 1 . . . . 29 ASP H . 16091 1 320 . 1 1 29 29 ASP HA H 1 5.01 . . 1 . . . . 29 ASP HA . 16091 1 321 . 1 1 29 29 ASP HB2 H 1 3.15 . . 2 . . . . 29 ASP HB2 . 16091 1 322 . 1 1 29 29 ASP HB3 H 1 2.61 . . 2 . . . . 29 ASP HB3 . 16091 1 323 . 1 1 29 29 ASP CA C 13 50.5 . . 1 . . . . 29 ASP CA . 16091 1 324 . 1 1 29 29 ASP CB C 13 42.1 . . 1 . . . . 29 ASP CB . 16091 1 325 . 1 1 29 29 ASP N N 15 128.4 . . 1 . . . . 29 ASP N . 16091 1 326 . 1 1 30 30 PRO HA H 1 4.33 . . 1 . . . . 30 PRO HA . 16091 1 327 . 1 1 30 30 PRO HB2 H 1 2.04 . . 2 . . . . 30 PRO HB2 . 16091 1 328 . 1 1 30 30 PRO HB3 H 1 2.27 . . 2 . . . . 30 PRO HB3 . 16091 1 329 . 1 1 30 30 PRO HD2 H 1 4.00 . . 2 . . . . 30 PRO HD2 . 16091 1 330 . 1 1 30 30 PRO HD3 H 1 4.28 . . 2 . . . . 30 PRO HD3 . 16091 1 331 . 1 1 30 30 PRO HG2 H 1 2.08 . . 2 . . . . 30 PRO HG2 . 16091 1 332 . 1 1 30 30 PRO HG3 H 1 2.07 . . 2 . . . . 30 PRO HG3 . 16091 1 333 . 1 1 30 30 PRO CA C 13 64.1 . . 1 . . . . 30 PRO CA . 16091 1 334 . 1 1 30 30 PRO CB C 13 32.0 . . 1 . . . . 30 PRO CB . 16091 1 335 . 1 1 30 30 PRO CD C 13 51.5 . . 1 . . . . 30 PRO CD . 16091 1 336 . 1 1 30 30 PRO CG C 13 27.0 . . 1 . . . . 30 PRO CG . 16091 1 337 . 1 1 31 31 GLU H H 1 8.30 . . 1 . . . . 31 GLU H . 16091 1 338 . 1 1 31 31 GLU HA H 1 4.21 . . 1 . . . . 31 GLU HA . 16091 1 339 . 1 1 31 31 GLU HB2 H 1 2.09 . . 2 . . . . 31 GLU HB2 . 16091 1 340 . 1 1 31 31 GLU HB3 H 1 2.09 . . 2 . . . . 31 GLU HB3 . 16091 1 341 . 1 1 31 31 GLU HG2 H 1 2.20 . . 2 . . . . 31 GLU HG2 . 16091 1 342 . 1 1 31 31 GLU HG3 H 1 2.29 . . 2 . . . . 31 GLU HG3 . 16091 1 343 . 1 1 31 31 GLU CA C 13 58.1 . . 1 . . . . 31 GLU CA . 16091 1 344 . 1 1 31 31 GLU CB C 13 30.2 . . 1 . . . . 31 GLU CB . 16091 1 345 . 1 1 31 31 GLU CG C 13 36.6 . . 1 . . . . 31 GLU CG . 16091 1 346 . 1 1 31 31 GLU N N 15 116.8 . . 1 . . . . 31 GLU N . 16091 1 347 . 1 1 32 32 THR H H 1 7.36 . . 1 . . . . 32 THR H . 16091 1 348 . 1 1 32 32 THR HA H 1 4.46 . . 1 . . . . 32 THR HA . 16091 1 349 . 1 1 32 32 THR HB H 1 4.31 . . 1 . . . . 32 THR HB . 16091 1 350 . 1 1 32 32 THR HG21 H 1 1.17 . . 1 . . . . 32 THR HG2 . 16091 1 351 . 1 1 32 32 THR HG22 H 1 1.17 . . 1 . . . . 32 THR HG2 . 16091 1 352 . 1 1 32 32 THR HG23 H 1 1.17 . . 1 . . . . 32 THR HG2 . 16091 1 353 . 1 1 32 32 THR CA C 13 61.1 . . 1 . . . . 32 THR CA . 16091 1 354 . 1 1 32 32 THR CB C 13 71.2 . . 1 . . . . 32 THR CB . 16091 1 355 . 1 1 32 32 THR CG2 C 13 21.0 . . 1 . . . . 32 THR CG2 . 16091 1 356 . 1 1 32 32 THR N N 15 105.0 . . 1 . . . . 32 THR N . 16091 1 357 . 1 1 33 33 GLY H H 1 8.75 . . 1 . . . . 33 GLY H . 16091 1 358 . 1 1 33 33 GLY HA2 H 1 4.14 . . 2 . . . . 33 GLY HA2 . 16091 1 359 . 1 1 33 33 GLY HA3 H 1 3.56 . . 2 . . . . 33 GLY HA3 . 16091 1 360 . 1 1 33 33 GLY CA C 13 45.4 . . 1 . . . . 33 GLY CA . 16091 1 361 . 1 1 33 33 GLY N N 15 111.9 . . 1 . . . . 33 GLY N . 16091 1 362 . 1 1 34 34 LYS H H 1 7.82 . . 1 . . . . 34 LYS H . 16091 1 363 . 1 1 34 34 LYS HA H 1 4.18 . . 1 . . . . 34 LYS HA . 16091 1 364 . 1 1 34 34 LYS HB2 H 1 1.72 . . 2 . . . . 34 LYS HB2 . 16091 1 365 . 1 1 34 34 LYS HB3 H 1 1.76 . . 2 . . . . 34 LYS HB3 . 16091 1 366 . 1 1 34 34 LYS HD2 H 1 1.67 . . 2 . . . . 34 LYS HD2 . 16091 1 367 . 1 1 34 34 LYS HD3 H 1 1.67 . . 2 . . . . 34 LYS HD3 . 16091 1 368 . 1 1 34 34 LYS HE2 H 1 2.96 . . 2 . . . . 34 LYS HE2 . 16091 1 369 . 1 1 34 34 LYS HE3 H 1 2.96 . . 2 . . . . 34 LYS HE3 . 16091 1 370 . 1 1 34 34 LYS HG2 H 1 1.33 . . 2 . . . . 34 LYS HG2 . 16091 1 371 . 1 1 34 34 LYS HG3 H 1 1.40 . . 2 . . . . 34 LYS HG3 . 16091 1 372 . 1 1 34 34 LYS CA C 13 56.6 . . 1 . . . . 34 LYS CA . 16091 1 373 . 1 1 34 34 LYS CB C 13 33.3 . . 1 . . . . 34 LYS CB . 16091 1 374 . 1 1 34 34 LYS CD C 13 29.0 . . 1 . . . . 34 LYS CD . 16091 1 375 . 1 1 34 34 LYS CE C 13 42.0 . . 1 . . . . 34 LYS CE . 16091 1 376 . 1 1 34 34 LYS CG C 13 25.1 . . 1 . . . . 34 LYS CG . 16091 1 377 . 1 1 34 34 LYS N N 15 121.0 . . 1 . . . . 34 LYS N . 16091 1 378 . 1 1 35 35 VAL H H 1 8.38 . . 1 . . . . 35 VAL H . 16091 1 379 . 1 1 35 35 VAL HA H 1 4.86 . . 1 . . . . 35 VAL HA . 16091 1 380 . 1 1 35 35 VAL HB H 1 1.84 . . 1 . . . . 35 VAL HB . 16091 1 381 . 1 1 35 35 VAL HG11 H 1 0.71 . . 2 . . . . 35 VAL HG1 . 16091 1 382 . 1 1 35 35 VAL HG12 H 1 0.71 . . 2 . . . . 35 VAL HG1 . 16091 1 383 . 1 1 35 35 VAL HG13 H 1 0.71 . . 2 . . . . 35 VAL HG1 . 16091 1 384 . 1 1 35 35 VAL HG21 H 1 0.88 . . 2 . . . . 35 VAL HG2 . 16091 1 385 . 1 1 35 35 VAL HG22 H 1 0.88 . . 2 . . . . 35 VAL HG2 . 16091 1 386 . 1 1 35 35 VAL HG23 H 1 0.88 . . 2 . . . . 35 VAL HG2 . 16091 1 387 . 1 1 35 35 VAL CA C 13 60.6 . . 1 . . . . 35 VAL CA . 16091 1 388 . 1 1 35 35 VAL CB C 13 33.4 . . 1 . . . . 35 VAL CB . 16091 1 389 . 1 1 35 35 VAL CG1 C 13 21.2 . . 1 . . . . 35 VAL CG1 . 16091 1 390 . 1 1 35 35 VAL CG2 C 13 21.4 . . 1 . . . . 35 VAL CG2 . 16091 1 391 . 1 1 35 35 VAL N N 15 123.9 . . 1 . . . . 35 VAL N . 16091 1 392 . 1 1 36 36 GLU H H 1 8.81 . . 1 . . . . 36 GLU H . 16091 1 393 . 1 1 36 36 GLU HA H 1 4.64 . . 1 . . . . 36 GLU HA . 16091 1 394 . 1 1 36 36 GLU HB2 H 1 1.74 . . 2 . . . . 36 GLU HB2 . 16091 1 395 . 1 1 36 36 GLU HB3 H 1 1.87 . . 2 . . . . 36 GLU HB3 . 16091 1 396 . 1 1 36 36 GLU HG2 H 1 2.16 . . 2 . . . . 36 GLU HG2 . 16091 1 397 . 1 1 36 36 GLU HG3 H 1 2.16 . . 2 . . . . 36 GLU HG3 . 16091 1 398 . 1 1 36 36 GLU CA C 13 54.3 . . 1 . . . . 36 GLU CA . 16091 1 399 . 1 1 36 36 GLU CB C 13 33.6 . . 1 . . . . 36 GLU CB . 16091 1 400 . 1 1 36 36 GLU CG C 13 36.0 . . 1 . . . . 36 GLU CG . 16091 1 401 . 1 1 36 36 GLU N N 15 127.5 . . 1 . . . . 36 GLU N . 16091 1 402 . 1 1 37 37 ILE H H 1 8.57 . . 1 . . . . 37 ILE H . 16091 1 403 . 1 1 37 37 ILE HA H 1 4.58 . . 1 . . . . 37 ILE HA . 16091 1 404 . 1 1 37 37 ILE HB H 1 1.73 . . 1 . . . . 37 ILE HB . 16091 1 405 . 1 1 37 37 ILE HD11 H 1 0.81 . . 1 . . . . 37 ILE HD1 . 16091 1 406 . 1 1 37 37 ILE HD12 H 1 0.81 . . 1 . . . . 37 ILE HD1 . 16091 1 407 . 1 1 37 37 ILE HD13 H 1 0.81 . . 1 . . . . 37 ILE HD1 . 16091 1 408 . 1 1 37 37 ILE HG12 H 1 1.17 . . 2 . . . . 37 ILE HG12 . 16091 1 409 . 1 1 37 37 ILE HG13 H 1 1.53 . . 2 . . . . 37 ILE HG13 . 16091 1 410 . 1 1 37 37 ILE HG21 H 1 0.83 . . 1 . . . . 37 ILE HG2 . 16091 1 411 . 1 1 37 37 ILE HG22 H 1 0.83 . . 1 . . . . 37 ILE HG2 . 16091 1 412 . 1 1 37 37 ILE HG23 H 1 0.83 . . 1 . . . . 37 ILE HG2 . 16091 1 413 . 1 1 37 37 ILE CA C 13 61.2 . . 1 . . . . 37 ILE CA . 16091 1 414 . 1 1 37 37 ILE CB C 13 37.8 . . 1 . . . . 37 ILE CB . 16091 1 415 . 1 1 37 37 ILE CD1 C 13 13.0 . . 1 . . . . 37 ILE CD1 . 16091 1 416 . 1 1 37 37 ILE CG1 C 13 27.7 . . 1 . . . . 37 ILE CG1 . 16091 1 417 . 1 1 37 37 ILE CG2 C 13 17.8 . . 1 . . . . 37 ILE CG2 . 16091 1 418 . 1 1 37 37 ILE N N 15 123.8 . . 1 . . . . 37 ILE N . 16091 1 419 . 1 1 38 38 ALA H H 1 9.25 . . 1 . . . . 38 ALA H . 16091 1 420 . 1 1 38 38 ALA HA H 1 4.90 . . 1 . . . . 38 ALA HA . 16091 1 421 . 1 1 38 38 ALA HB1 H 1 1.36 . . 1 . . . . 38 ALA HB . 16091 1 422 . 1 1 38 38 ALA HB2 H 1 1.36 . . 1 . . . . 38 ALA HB . 16091 1 423 . 1 1 38 38 ALA HB3 H 1 1.36 . . 1 . . . . 38 ALA HB . 16091 1 424 . 1 1 38 38 ALA CA C 13 49.9 . . 1 . . . . 38 ALA CA . 16091 1 425 . 1 1 38 38 ALA CB C 13 22.8 . . 1 . . . . 38 ALA CB . 16091 1 426 . 1 1 38 38 ALA N N 15 131.9 . . 1 . . . . 38 ALA N . 16091 1 427 . 1 1 39 39 GLU H H 1 8.52 . . 1 . . . . 39 GLU H . 16091 1 428 . 1 1 39 39 GLU HA H 1 4.74 . . 1 . . . . 39 GLU HA . 16091 1 429 . 1 1 39 39 GLU HB2 H 1 1.78 . . 2 . . . . 39 GLU HB2 . 16091 1 430 . 1 1 39 39 GLU HB3 H 1 1.91 . . 2 . . . . 39 GLU HB3 . 16091 1 431 . 1 1 39 39 GLU HG2 H 1 2.08 . . 2 . . . . 39 GLU HG2 . 16091 1 432 . 1 1 39 39 GLU HG3 H 1 2.18 . . 2 . . . . 39 GLU HG3 . 16091 1 433 . 1 1 39 39 GLU CA C 13 54.4 . . 1 . . . . 39 GLU CA . 16091 1 434 . 1 1 39 39 GLU CB C 13 31.8 . . 1 . . . . 39 GLU CB . 16091 1 435 . 1 1 39 39 GLU CG C 13 36.0 . . 1 . . . . 39 GLU CG . 16091 1 436 . 1 1 39 39 GLU N N 15 118.9 . . 1 . . . . 39 GLU N . 16091 1 437 . 1 1 40 40 ILE H H 1 8.63 . . 1 . . . . 40 ILE H . 16091 1 438 . 1 1 40 40 ILE HA H 1 3.80 . . 1 . . . . 40 ILE HA . 16091 1 439 . 1 1 40 40 ILE HB H 1 1.59 . . 1 . . . . 40 ILE HB . 16091 1 440 . 1 1 40 40 ILE HD11 H 1 0.65 . . 1 . . . . 40 ILE HD1 . 16091 1 441 . 1 1 40 40 ILE HD12 H 1 0.65 . . 1 . . . . 40 ILE HD1 . 16091 1 442 . 1 1 40 40 ILE HD13 H 1 0.65 . . 1 . . . . 40 ILE HD1 . 16091 1 443 . 1 1 40 40 ILE HG12 H 1 0.53 . . 2 . . . . 40 ILE HG12 . 16091 1 444 . 1 1 40 40 ILE HG13 H 1 1.51 . . 2 . . . . 40 ILE HG13 . 16091 1 445 . 1 1 40 40 ILE HG21 H 1 0.72 . . 1 . . . . 40 ILE HG2 . 16091 1 446 . 1 1 40 40 ILE HG22 H 1 0.72 . . 1 . . . . 40 ILE HG2 . 16091 1 447 . 1 1 40 40 ILE HG23 H 1 0.72 . . 1 . . . . 40 ILE HG2 . 16091 1 448 . 1 1 40 40 ILE CA C 13 62.6 . . 1 . . . . 40 ILE CA . 16091 1 449 . 1 1 40 40 ILE CB C 13 38.4 . . 1 . . . . 40 ILE CB . 16091 1 450 . 1 1 40 40 ILE CD1 C 13 13.9 . . 1 . . . . 40 ILE CD1 . 16091 1 451 . 1 1 40 40 ILE CG1 C 13 28.6 . . 1 . . . . 40 ILE CG1 . 16091 1 452 . 1 1 40 40 ILE CG2 C 13 17.2 . . 1 . . . . 40 ILE CG2 . 16091 1 453 . 1 1 40 40 ILE N N 15 123.1 . . 1 . . . . 40 ILE N . 16091 1 454 . 1 1 41 41 ARG H H 1 8.90 . . 1 . . . . 41 ARG H . 16091 1 455 . 1 1 41 41 ARG HA H 1 4.38 . . 1 . . . . 41 ARG HA . 16091 1 456 . 1 1 41 41 ARG HB2 H 1 1.44 . . 2 . . . . 41 ARG HB2 . 16091 1 457 . 1 1 41 41 ARG HB3 H 1 1.75 . . 2 . . . . 41 ARG HB3 . 16091 1 458 . 1 1 41 41 ARG HD2 H 1 3.00 . . 2 . . . . 41 ARG HD2 . 16091 1 459 . 1 1 41 41 ARG HD3 H 1 3.00 . . 2 . . . . 41 ARG HD3 . 16091 1 460 . 1 1 41 41 ARG HG2 H 1 1.51 . . 2 . . . . 41 ARG HG2 . 16091 1 461 . 1 1 41 41 ARG HG3 H 1 1.51 . . 2 . . . . 41 ARG HG3 . 16091 1 462 . 1 1 41 41 ARG CA C 13 56.5 . . 1 . . . . 41 ARG CA . 16091 1 463 . 1 1 41 41 ARG CB C 13 31.4 . . 1 . . . . 41 ARG CB . 16091 1 464 . 1 1 41 41 ARG CD C 13 43.2 . . 1 . . . . 41 ARG CD . 16091 1 465 . 1 1 41 41 ARG CG C 13 27.3 . . 1 . . . . 41 ARG CG . 16091 1 466 . 1 1 41 41 ARG N N 15 127.0 . . 1 . . . . 41 ARG N . 16091 1 467 . 1 1 42 42 ASN H H 1 7.75 . . 1 . . . . 42 ASN H . 16091 1 468 . 1 1 42 42 ASN HA H 1 4.79 . . 1 . . . . 42 ASN HA . 16091 1 469 . 1 1 42 42 ASN HB2 H 1 2.68 . . 2 . . . . 42 ASN HB2 . 16091 1 470 . 1 1 42 42 ASN HB3 H 1 2.69 . . 2 . . . . 42 ASN HB3 . 16091 1 471 . 1 1 42 42 ASN HD21 H 1 6.86 . . 2 . . . . 42 ASN HD21 . 16091 1 472 . 1 1 42 42 ASN HD22 H 1 7.54 . . 2 . . . . 42 ASN HD22 . 16091 1 473 . 1 1 42 42 ASN CA C 13 52.7 . . 1 . . . . 42 ASN CA . 16091 1 474 . 1 1 42 42 ASN CB C 13 40.9 . . 1 . . . . 42 ASN CB . 16091 1 475 . 1 1 42 42 ASN N N 15 114.6 . . 1 . . . . 42 ASN N . 16091 1 476 . 1 1 42 42 ASN ND2 N 15 113.6 . . 1 . . . . 42 ASN ND2 . 16091 1 477 . 1 1 43 43 VAL H H 1 8.57 . . 1 . . . . 43 VAL H . 16091 1 478 . 1 1 43 43 VAL HA H 1 4.20 . . 1 . . . . 43 VAL HA . 16091 1 479 . 1 1 43 43 VAL HB H 1 2.06 . . 1 . . . . 43 VAL HB . 16091 1 480 . 1 1 43 43 VAL HG11 H 1 0.83 . . 2 . . . . 43 VAL HG1 . 16091 1 481 . 1 1 43 43 VAL HG12 H 1 0.83 . . 2 . . . . 43 VAL HG1 . 16091 1 482 . 1 1 43 43 VAL HG13 H 1 0.83 . . 2 . . . . 43 VAL HG1 . 16091 1 483 . 1 1 43 43 VAL HG21 H 1 0.91 . . 2 . . . . 43 VAL HG2 . 16091 1 484 . 1 1 43 43 VAL HG22 H 1 0.91 . . 2 . . . . 43 VAL HG2 . 16091 1 485 . 1 1 43 43 VAL HG23 H 1 0.91 . . 2 . . . . 43 VAL HG2 . 16091 1 486 . 1 1 43 43 VAL CA C 13 62.6 . . 1 . . . . 43 VAL CA . 16091 1 487 . 1 1 43 43 VAL CB C 13 32.5 . . 1 . . . . 43 VAL CB . 16091 1 488 . 1 1 43 43 VAL CG1 C 13 21.0 . . 1 . . . . 43 VAL CG1 . 16091 1 489 . 1 1 43 43 VAL CG2 C 13 21.4 . . 1 . . . . 43 VAL CG2 . 16091 1 490 . 1 1 43 43 VAL N N 15 121.9 . . 1 . . . . 43 VAL N . 16091 1 491 . 1 1 44 44 VAL H H 1 8.63 . . 1 . . . . 44 VAL H . 16091 1 492 . 1 1 44 44 VAL HA H 1 4.05 . . 1 . . . . 44 VAL HA . 16091 1 493 . 1 1 44 44 VAL HB H 1 1.90 . . 1 . . . . 44 VAL HB . 16091 1 494 . 1 1 44 44 VAL HG11 H 1 0.86 . . 2 . . . . 44 VAL HG1 . 16091 1 495 . 1 1 44 44 VAL HG12 H 1 0.86 . . 2 . . . . 44 VAL HG1 . 16091 1 496 . 1 1 44 44 VAL HG13 H 1 0.86 . . 2 . . . . 44 VAL HG1 . 16091 1 497 . 1 1 44 44 VAL HG21 H 1 0.85 . . 2 . . . . 44 VAL HG2 . 16091 1 498 . 1 1 44 44 VAL HG22 H 1 0.85 . . 2 . . . . 44 VAL HG2 . 16091 1 499 . 1 1 44 44 VAL HG23 H 1 0.85 . . 2 . . . . 44 VAL HG2 . 16091 1 500 . 1 1 44 44 VAL CA C 13 62.9 . . 1 . . . . 44 VAL CA . 16091 1 501 . 1 1 44 44 VAL CB C 13 32.5 . . 1 . . . . 44 VAL CB . 16091 1 502 . 1 1 44 44 VAL CG1 C 13 21.0 . . 1 . . . . 44 VAL CG1 . 16091 1 503 . 1 1 44 44 VAL CG2 C 13 21.0 . . 1 . . . . 44 VAL CG2 . 16091 1 504 . 1 1 44 44 VAL N N 15 125.8 . . 1 . . . . 44 VAL N . 16091 1 505 . 1 1 45 45 GLU H H 1 8.33 . . 1 . . . . 45 GLU H . 16091 1 506 . 1 1 45 45 GLU HA H 1 4.37 . . 1 . . . . 45 GLU HA . 16091 1 507 . 1 1 45 45 GLU HB2 H 1 1.89 . . 2 . . . . 45 GLU HB2 . 16091 1 508 . 1 1 45 45 GLU HB3 H 1 1.98 . . 2 . . . . 45 GLU HB3 . 16091 1 509 . 1 1 45 45 GLU HG2 H 1 2.19 . . 2 . . . . 45 GLU HG2 . 16091 1 510 . 1 1 45 45 GLU HG3 H 1 2.19 . . 2 . . . . 45 GLU HG3 . 16091 1 511 . 1 1 45 45 GLU CA C 13 55.8 . . 1 . . . . 45 GLU CA . 16091 1 512 . 1 1 45 45 GLU CB C 13 31.4 . . 1 . . . . 45 GLU CB . 16091 1 513 . 1 1 45 45 GLU CG C 13 36.0 . . 1 . . . . 45 GLU CG . 16091 1 514 . 1 1 45 45 GLU N N 15 123.3 . . 1 . . . . 45 GLU N . 16091 1 515 . 1 1 46 46 ASN H H 1 8.62 . . 1 . . . . 46 ASN H . 16091 1 516 . 1 1 46 46 ASN HA H 1 4.74 . . 1 . . . . 46 ASN HA . 16091 1 517 . 1 1 46 46 ASN HB2 H 1 2.66 . . 2 . . . . 46 ASN HB2 . 16091 1 518 . 1 1 46 46 ASN HB3 H 1 2.91 . . 2 . . . . 46 ASN HB3 . 16091 1 519 . 1 1 46 46 ASN HD21 H 1 7.03 . . 2 . . . . 46 ASN HD21 . 16091 1 520 . 1 1 46 46 ASN HD22 H 1 7.56 . . 2 . . . . 46 ASN HD22 . 16091 1 521 . 1 1 46 46 ASN CA C 13 52.9 . . 1 . . . . 46 ASN CA . 16091 1 522 . 1 1 46 46 ASN CB C 13 38.4 . . 1 . . . . 46 ASN CB . 16091 1 523 . 1 1 46 46 ASN N N 15 121.0 . . 1 . . . . 46 ASN N . 16091 1 524 . 1 1 46 46 ASN ND2 N 15 112.0 . . 1 . . . . 46 ASN ND2 . 16091 1 525 . 1 1 47 47 THR H H 1 8.28 . . 1 . . . . 47 THR H . 16091 1 526 . 1 1 47 47 THR HA H 1 4.09 . . 1 . . . . 47 THR HA . 16091 1 527 . 1 1 47 47 THR HB H 1 4.22 . . 1 . . . . 47 THR HB . 16091 1 528 . 1 1 47 47 THR HG21 H 1 1.14 . . 1 . . . . 47 THR HG2 . 16091 1 529 . 1 1 47 47 THR HG22 H 1 1.14 . . 1 . . . . 47 THR HG2 . 16091 1 530 . 1 1 47 47 THR HG23 H 1 1.14 . . 1 . . . . 47 THR HG2 . 16091 1 531 . 1 1 47 47 THR CA C 13 62.5 . . 1 . . . . 47 THR CA . 16091 1 532 . 1 1 47 47 THR CB C 13 69.0 . . 1 . . . . 47 THR CB . 16091 1 533 . 1 1 47 47 THR CG2 C 13 21.5 . . 1 . . . . 47 THR CG2 . 16091 1 534 . 1 1 47 47 THR N N 15 114.7 . . 1 . . . . 47 THR N . 16091 1 535 . 1 1 48 48 ALA H H 1 8.13 . . 1 . . . . 48 ALA H . 16091 1 536 . 1 1 48 48 ALA HA H 1 4.24 . . 1 . . . . 48 ALA HA . 16091 1 537 . 1 1 48 48 ALA HB1 H 1 1.36 . . 1 . . . . 48 ALA HB . 16091 1 538 . 1 1 48 48 ALA HB2 H 1 1.36 . . 1 . . . . 48 ALA HB . 16091 1 539 . 1 1 48 48 ALA HB3 H 1 1.36 . . 1 . . . . 48 ALA HB . 16091 1 540 . 1 1 48 48 ALA CA C 13 52.7 . . 1 . . . . 48 ALA CA . 16091 1 541 . 1 1 48 48 ALA CB C 13 19.0 . . 1 . . . . 48 ALA CB . 16091 1 542 . 1 1 48 48 ALA N N 15 124.0 . . 1 . . . . 48 ALA N . 16091 1 543 . 1 1 49 49 ASN HA H 1 4.87 . . 1 . . . . 49 ASN HA . 16091 1 544 . 1 1 49 49 ASN HB2 H 1 2.50 . . 2 . . . . 49 ASN HB2 . 16091 1 545 . 1 1 49 49 ASN HD21 H 1 6.99 . . 2 . . . . 49 ASN HD21 . 16091 1 546 . 1 1 49 49 ASN HD22 H 1 7.53 . . 2 . . . . 49 ASN HD22 . 16091 1 547 . 1 1 49 49 ASN CA C 13 50.7 . . 1 . . . . 49 ASN CA . 16091 1 548 . 1 1 49 49 ASN CB C 13 39.3 . . 1 . . . . 49 ASN CB . 16091 1 549 . 1 1 49 49 ASN ND2 N 15 113.5 . . 1 . . . . 49 ASN ND2 . 16091 1 550 . 1 1 50 50 PRO HA H 1 4.37 . . 1 . . . . 50 PRO HA . 16091 1 551 . 1 1 50 50 PRO HB2 H 1 1.71 . . 2 . . . . 50 PRO HB2 . 16091 1 552 . 1 1 50 50 PRO HB3 H 1 2.21 . . 2 . . . . 50 PRO HB3 . 16091 1 553 . 1 1 50 50 PRO HD2 H 1 3.66 . . 2 . . . . 50 PRO HD2 . 16091 1 554 . 1 1 50 50 PRO HD3 H 1 3.66 . . 2 . . . . 50 PRO HD3 . 16091 1 555 . 1 1 50 50 PRO HG2 H 1 1.74 . . 2 . . . . 50 PRO HG2 . 16091 1 556 . 1 1 50 50 PRO HG3 H 1 1.94 . . 2 . . . . 50 PRO HG3 . 16091 1 557 . 1 1 50 50 PRO CA C 13 64.1 . . 1 . . . . 50 PRO CA . 16091 1 558 . 1 1 50 50 PRO CB C 13 32.0 . . 1 . . . . 50 PRO CB . 16091 1 559 . 1 1 50 50 PRO CD C 13 50.5 . . 1 . . . . 50 PRO CD . 16091 1 560 . 1 1 50 50 PRO CG C 13 26.9 . . 1 . . . . 50 PRO CG . 16091 1 561 . 1 1 51 51 HIS H H 1 8.35 . . 1 . . . . 51 HIS H . 16091 1 562 . 1 1 51 51 HIS HA H 1 4.56 . . 1 . . . . 51 HIS HA . 16091 1 563 . 1 1 51 51 HIS HB2 H 1 3.10 . . 2 . . . . 51 HIS HB2 . 16091 1 564 . 1 1 51 51 HIS HB3 H 1 3.02 . . 2 . . . . 51 HIS HB3 . 16091 1 565 . 1 1 51 51 HIS HD2 H 1 7.00 . . 1 . . . . 51 HIS HD2 . 16091 1 566 . 1 1 51 51 HIS CA C 13 56.1 . . 1 . . . . 51 HIS CA . 16091 1 567 . 1 1 51 51 HIS CB C 13 29.7 . . 1 . . . . 51 HIS CB . 16091 1 568 . 1 1 51 51 HIS N N 15 117.0 . . 1 . . . . 51 HIS N . 16091 1 569 . 1 1 52 52 PHE H H 1 7.87 . . 1 . . . . 52 PHE H . 16091 1 570 . 1 1 52 52 PHE HA H 1 4.52 . . 1 . . . . 52 PHE HA . 16091 1 571 . 1 1 52 52 PHE HB2 H 1 3.12 . . 2 . . . . 52 PHE HB2 . 16091 1 572 . 1 1 52 52 PHE HB3 H 1 3.20 . . 2 . . . . 52 PHE HB3 . 16091 1 573 . 1 1 52 52 PHE HD1 H 1 7.08 . . 3 . . . . 52 PHE HD1 . 16091 1 574 . 1 1 52 52 PHE HD2 H 1 7.08 . . 3 . . . . 52 PHE HD2 . 16091 1 575 . 1 1 52 52 PHE CA C 13 57.5 . . 1 . . . . 52 PHE CA . 16091 1 576 . 1 1 52 52 PHE CB C 13 38.7 . . 1 . . . . 52 PHE CB . 16091 1 577 . 1 1 52 52 PHE N N 15 120.0 . . 1 . . . . 52 PHE N . 16091 1 578 . 1 1 53 53 VAL H H 1 7.89 . . 1 . . . . 53 VAL H . 16091 1 579 . 1 1 53 53 VAL HA H 1 3.88 . . 1 . . . . 53 VAL HA . 16091 1 580 . 1 1 53 53 VAL HB H 1 2.01 . . 1 . . . . 53 VAL HB . 16091 1 581 . 1 1 53 53 VAL HG11 H 1 0.85 . . 2 . . . . 53 VAL HG1 . 16091 1 582 . 1 1 53 53 VAL HG12 H 1 0.85 . . 2 . . . . 53 VAL HG1 . 16091 1 583 . 1 1 53 53 VAL HG13 H 1 0.85 . . 2 . . . . 53 VAL HG1 . 16091 1 584 . 1 1 53 53 VAL HG21 H 1 0.85 . . 2 . . . . 53 VAL HG2 . 16091 1 585 . 1 1 53 53 VAL HG22 H 1 0.85 . . 2 . . . . 53 VAL HG2 . 16091 1 586 . 1 1 53 53 VAL HG23 H 1 0.85 . . 2 . . . . 53 VAL HG2 . 16091 1 587 . 1 1 53 53 VAL CA C 13 63.3 . . 1 . . . . 53 VAL CA . 16091 1 588 . 1 1 53 53 VAL CB C 13 32.7 . . 1 . . . . 53 VAL CB . 16091 1 589 . 1 1 53 53 VAL CG1 C 13 20.9 . . 1 . . . . 53 VAL CG1 . 16091 1 590 . 1 1 53 53 VAL CG2 C 13 21.0 . . 1 . . . . 53 VAL CG2 . 16091 1 591 . 1 1 53 53 VAL N N 15 121.8 . . 1 . . . . 53 VAL N . 16091 1 592 . 1 1 54 54 ARG H H 1 8.20 . . 1 . . . . 54 ARG H . 16091 1 593 . 1 1 54 54 ARG HA H 1 4.22 . . 1 . . . . 54 ARG HA . 16091 1 594 . 1 1 54 54 ARG HB2 H 1 1.79 . . 2 . . . . 54 ARG HB2 . 16091 1 595 . 1 1 54 54 ARG HB3 H 1 1.85 . . 2 . . . . 54 ARG HB3 . 16091 1 596 . 1 1 54 54 ARG HD2 H 1 3.21 . . 2 . . . . 54 ARG HD2 . 16091 1 597 . 1 1 54 54 ARG HD3 H 1 3.21 . . 2 . . . . 54 ARG HD3 . 16091 1 598 . 1 1 54 54 ARG HG2 H 1 1.64 . . 2 . . . . 54 ARG HG2 . 16091 1 599 . 1 1 54 54 ARG HG3 H 1 1.64 . . 2 . . . . 54 ARG HG3 . 16091 1 600 . 1 1 54 54 ARG CA C 13 56.5 . . 1 . . . . 54 ARG CA . 16091 1 601 . 1 1 54 54 ARG CB C 13 30.4 . . 1 . . . . 54 ARG CB . 16091 1 602 . 1 1 54 54 ARG CD C 13 43.3 . . 1 . . . . 54 ARG CD . 16091 1 603 . 1 1 54 54 ARG CG C 13 27.3 . . 1 . . . . 54 ARG CG . 16091 1 604 . 1 1 54 54 ARG N N 15 123.1 . . 1 . . . . 54 ARG N . 16091 1 605 . 1 1 55 55 ARG H H 1 8.08 . . 1 . . . . 55 ARG H . 16091 1 606 . 1 1 55 55 ARG HA H 1 4.28 . . 1 . . . . 55 ARG HA . 16091 1 607 . 1 1 55 55 ARG HB2 H 1 1.79 . . 2 . . . . 55 ARG HB2 . 16091 1 608 . 1 1 55 55 ARG HB3 H 1 1.88 . . 2 . . . . 55 ARG HB3 . 16091 1 609 . 1 1 55 55 ARG HD2 H 1 3.15 . . 2 . . . . 55 ARG HD2 . 16091 1 610 . 1 1 55 55 ARG HD3 H 1 3.16 . . 2 . . . . 55 ARG HD3 . 16091 1 611 . 1 1 55 55 ARG HG2 H 1 1.59 . . 2 . . . . 55 ARG HG2 . 16091 1 612 . 1 1 55 55 ARG HG3 H 1 1.66 . . 2 . . . . 55 ARG HG3 . 16091 1 613 . 1 1 55 55 ARG CA C 13 56.0 . . 1 . . . . 55 ARG CA . 16091 1 614 . 1 1 55 55 ARG CB C 13 30.9 . . 1 . . . . 55 ARG CB . 16091 1 615 . 1 1 55 55 ARG CD C 13 43.4 . . 1 . . . . 55 ARG CD . 16091 1 616 . 1 1 55 55 ARG CG C 13 27.3 . . 1 . . . . 55 ARG CG . 16091 1 617 . 1 1 56 56 ASN H H 1 8.41 . . 1 . . . . 56 ASN H . 16091 1 618 . 1 1 56 56 ASN HA H 1 4.50 . . 1 . . . . 56 ASN HA . 16091 1 619 . 1 1 56 56 ASN HB2 H 1 2.75 . . 2 . . . . 56 ASN HB2 . 16091 1 620 . 1 1 56 56 ASN HB3 H 1 2.87 . . 2 . . . . 56 ASN HB3 . 16091 1 621 . 1 1 56 56 ASN HD21 H 1 6.86 . . 2 . . . . 56 ASN HD21 . 16091 1 622 . 1 1 56 56 ASN HD22 H 1 7.55 . . 2 . . . . 56 ASN HD22 . 16091 1 623 . 1 1 56 56 ASN CA C 13 53.3 . . 1 . . . . 56 ASN CA . 16091 1 624 . 1 1 56 56 ASN CB C 13 38.2 . . 1 . . . . 56 ASN CB . 16091 1 625 . 1 1 56 56 ASN N N 15 118.5 . . 1 . . . . 56 ASN N . 16091 1 626 . 1 1 56 56 ASN ND2 N 15 112.4 . . 1 . . . . 56 ASN ND2 . 16091 1 627 . 1 1 57 57 ILE H H 1 7.78 . . 1 . . . . 57 ILE H . 16091 1 628 . 1 1 57 57 ILE HA H 1 4.19 . . 1 . . . . 57 ILE HA . 16091 1 629 . 1 1 57 57 ILE HB H 1 1.65 . . 1 . . . . 57 ILE HB . 16091 1 630 . 1 1 57 57 ILE HD11 H 1 0.70 . . 1 . . . . 57 ILE HD1 . 16091 1 631 . 1 1 57 57 ILE HD12 H 1 0.70 . . 1 . . . . 57 ILE HD1 . 16091 1 632 . 1 1 57 57 ILE HD13 H 1 0.70 . . 1 . . . . 57 ILE HD1 . 16091 1 633 . 1 1 57 57 ILE HG12 H 1 0.99 . . 2 . . . . 57 ILE HG12 . 16091 1 634 . 1 1 57 57 ILE HG13 H 1 1.33 . . 2 . . . . 57 ILE HG13 . 16091 1 635 . 1 1 57 57 ILE HG21 H 1 0.67 . . 1 . . . . 57 ILE HG2 . 16091 1 636 . 1 1 57 57 ILE HG22 H 1 0.67 . . 1 . . . . 57 ILE HG2 . 16091 1 637 . 1 1 57 57 ILE HG23 H 1 0.67 . . 1 . . . . 57 ILE HG2 . 16091 1 638 . 1 1 57 57 ILE CA C 13 60.6 . . 1 . . . . 57 ILE CA . 16091 1 639 . 1 1 57 57 ILE CB C 13 38.7 . . 1 . . . . 57 ILE CB . 16091 1 640 . 1 1 57 57 ILE CD1 C 13 12.8 . . 1 . . . . 57 ILE CD1 . 16091 1 641 . 1 1 57 57 ILE CG1 C 13 27.2 . . 1 . . . . 57 ILE CG1 . 16091 1 642 . 1 1 57 57 ILE CG2 C 13 17.4 . . 1 . . . . 57 ILE CG2 . 16091 1 643 . 1 1 57 57 ILE N N 15 118.7 . . 1 . . . . 57 ILE N . 16091 1 644 . 1 1 58 58 ILE H H 1 8.41 . . 1 . . . . 58 ILE H . 16091 1 645 . 1 1 58 58 ILE HA H 1 3.86 . . 1 . . . . 58 ILE HA . 16091 1 646 . 1 1 58 58 ILE HB H 1 1.75 . . 1 . . . . 58 ILE HB . 16091 1 647 . 1 1 58 58 ILE HD11 H 1 0.73 . . 1 . . . . 58 ILE HD1 . 16091 1 648 . 1 1 58 58 ILE HD12 H 1 0.73 . . 1 . . . . 58 ILE HD1 . 16091 1 649 . 1 1 58 58 ILE HD13 H 1 0.73 . . 1 . . . . 58 ILE HD1 . 16091 1 650 . 1 1 58 58 ILE HG12 H 1 1.52 . . 2 . . . . 58 ILE HG12 . 16091 1 651 . 1 1 58 58 ILE HG13 H 1 0.90 . . 2 . . . . 58 ILE HG13 . 16091 1 652 . 1 1 58 58 ILE HG21 H 1 0.77 . . 1 . . . . 58 ILE HG2 . 16091 1 653 . 1 1 58 58 ILE HG22 H 1 0.77 . . 1 . . . . 58 ILE HG2 . 16091 1 654 . 1 1 58 58 ILE HG23 H 1 0.77 . . 1 . . . . 58 ILE HG2 . 16091 1 655 . 1 1 58 58 ILE CA C 13 61.5 . . 1 . . . . 58 ILE CA . 16091 1 656 . 1 1 58 58 ILE CB C 13 37.5 . . 1 . . . . 58 ILE CB . 16091 1 657 . 1 1 58 58 ILE CD1 C 13 13.1 . . 1 . . . . 58 ILE CD1 . 16091 1 658 . 1 1 58 58 ILE CG1 C 13 27.3 . . 1 . . . . 58 ILE CG1 . 16091 1 659 . 1 1 58 58 ILE CG2 C 13 18.9 . . 1 . . . . 58 ILE CG2 . 16091 1 660 . 1 1 58 58 ILE N N 15 125.1 . . 1 . . . . 58 ILE N . 16091 1 661 . 1 1 59 59 THR H H 1 7.02 . . 1 . . . . 59 THR H . 16091 1 662 . 1 1 59 59 THR HA H 1 4.49 . . 1 . . . . 59 THR HA . 16091 1 663 . 1 1 59 59 THR HB H 1 4.27 . . 1 . . . . 59 THR HB . 16091 1 664 . 1 1 59 59 THR HG21 H 1 1.11 . . 1 . . . . 59 THR HG2 . 16091 1 665 . 1 1 59 59 THR HG22 H 1 1.11 . . 1 . . . . 59 THR HG2 . 16091 1 666 . 1 1 59 59 THR HG23 H 1 1.11 . . 1 . . . . 59 THR HG2 . 16091 1 667 . 1 1 59 59 THR CA C 13 59.2 . . 1 . . . . 59 THR CA . 16091 1 668 . 1 1 59 59 THR CB C 13 71.3 . . 1 . . . . 59 THR CB . 16091 1 669 . 1 1 59 59 THR CG2 C 13 21.3 . . 1 . . . . 59 THR CG2 . 16091 1 670 . 1 1 59 59 THR N N 15 116.8 . . 1 . . . . 59 THR N . 16091 1 671 . 1 1 60 60 ARG H H 1 8.49 . . 1 . . . . 60 ARG H . 16091 1 672 . 1 1 60 60 ARG HA H 1 3.75 . . 1 . . . . 60 ARG HA . 16091 1 673 . 1 1 60 60 ARG HB2 H 1 1.75 . . 2 . . . . 60 ARG HB2 . 16091 1 674 . 1 1 60 60 ARG HB3 H 1 1.74 . . 2 . . . . 60 ARG HB3 . 16091 1 675 . 1 1 60 60 ARG HD2 H 1 3.10 . . 2 . . . . 60 ARG HD2 . 16091 1 676 . 1 1 60 60 ARG HD3 H 1 3.10 . . 2 . . . . 60 ARG HD3 . 16091 1 677 . 1 1 60 60 ARG HG2 H 1 1.47 . . 2 . . . . 60 ARG HG2 . 16091 1 678 . 1 1 60 60 ARG HG3 H 1 1.48 . . 2 . . . . 60 ARG HG3 . 16091 1 679 . 1 1 60 60 ARG CA C 13 58.9 . . 1 . . . . 60 ARG CA . 16091 1 680 . 1 1 60 60 ARG CB C 13 29.9 . . 1 . . . . 60 ARG CB . 16091 1 681 . 1 1 60 60 ARG CD C 13 43.4 . . 1 . . . . 60 ARG CD . 16091 1 682 . 1 1 60 60 ARG CG C 13 27.2 . . 1 . . . . 60 ARG CG . 16091 1 683 . 1 1 60 60 ARG N N 15 122.3 . . 1 . . . . 60 ARG N . 16091 1 684 . 1 1 61 61 GLY H H 1 8.87 . . 1 . . . . 61 GLY H . 16091 1 685 . 1 1 61 61 GLY HA2 H 1 3.52 . . 2 . . . . 61 GLY HA2 . 16091 1 686 . 1 1 61 61 GLY HA3 H 1 4.46 . . 2 . . . . 61 GLY HA3 . 16091 1 687 . 1 1 61 61 GLY CA C 13 44.9 . . 1 . . . . 61 GLY CA . 16091 1 688 . 1 1 61 61 GLY N N 15 115.8 . . 1 . . . . 61 GLY N . 16091 1 689 . 1 1 62 62 ALA H H 1 8.02 . . 1 . . . . 62 ALA H . 16091 1 690 . 1 1 62 62 ALA HA H 1 4.38 . . 1 . . . . 62 ALA HA . 16091 1 691 . 1 1 62 62 ALA HB1 H 1 1.53 . . 1 . . . . 62 ALA HB . 16091 1 692 . 1 1 62 62 ALA HB2 H 1 1.53 . . 1 . . . . 62 ALA HB . 16091 1 693 . 1 1 62 62 ALA HB3 H 1 1.53 . . 1 . . . . 62 ALA HB . 16091 1 694 . 1 1 62 62 ALA CA C 13 52.2 . . 1 . . . . 62 ALA CA . 16091 1 695 . 1 1 62 62 ALA CB C 13 19.4 . . 1 . . . . 62 ALA CB . 16091 1 696 . 1 1 62 62 ALA N N 15 123.3 . . 1 . . . . 62 ALA N . 16091 1 697 . 1 1 63 63 VAL H H 1 8.59 . . 1 . . . . 63 VAL H . 16091 1 698 . 1 1 63 63 VAL HA H 1 4.99 . . 1 . . . . 63 VAL HA . 16091 1 699 . 1 1 63 63 VAL HB H 1 1.85 . . 1 . . . . 63 VAL HB . 16091 1 700 . 1 1 63 63 VAL HG11 H 1 0.74 . . 2 . . . . 63 VAL HG1 . 16091 1 701 . 1 1 63 63 VAL HG12 H 1 0.74 . . 2 . . . . 63 VAL HG1 . 16091 1 702 . 1 1 63 63 VAL HG13 H 1 0.74 . . 2 . . . . 63 VAL HG1 . 16091 1 703 . 1 1 63 63 VAL HG21 H 1 0.90 . . 2 . . . . 63 VAL HG2 . 16091 1 704 . 1 1 63 63 VAL HG22 H 1 0.90 . . 2 . . . . 63 VAL HG2 . 16091 1 705 . 1 1 63 63 VAL HG23 H 1 0.90 . . 2 . . . . 63 VAL HG2 . 16091 1 706 . 1 1 63 63 VAL CA C 13 61.3 . . 1 . . . . 63 VAL CA . 16091 1 707 . 1 1 63 63 VAL CB C 13 32.8 . . 1 . . . . 63 VAL CB . 16091 1 708 . 1 1 63 63 VAL CG1 C 13 21.1 . . 1 . . . . 63 VAL CG1 . 16091 1 709 . 1 1 63 63 VAL CG2 C 13 21.4 . . 1 . . . . 63 VAL CG2 . 16091 1 710 . 1 1 63 63 VAL N N 15 120.3 . . 1 . . . . 63 VAL N . 16091 1 711 . 1 1 64 64 VAL H H 1 9.38 . . 1 . . . . 64 VAL H . 16091 1 712 . 1 1 64 64 VAL HA H 1 4.92 . . 1 . . . . 64 VAL HA . 16091 1 713 . 1 1 64 64 VAL HB H 1 2.09 . . 1 . . . . 64 VAL HB . 16091 1 714 . 1 1 64 64 VAL HG11 H 1 0.79 . . 2 . . . . 64 VAL HG1 . 16091 1 715 . 1 1 64 64 VAL HG12 H 1 0.79 . . 2 . . . . 64 VAL HG1 . 16091 1 716 . 1 1 64 64 VAL HG13 H 1 0.79 . . 2 . . . . 64 VAL HG1 . 16091 1 717 . 1 1 64 64 VAL HG21 H 1 0.68 . . 2 . . . . 64 VAL HG2 . 16091 1 718 . 1 1 64 64 VAL HG22 H 1 0.68 . . 2 . . . . 64 VAL HG2 . 16091 1 719 . 1 1 64 64 VAL HG23 H 1 0.68 . . 2 . . . . 64 VAL HG2 . 16091 1 720 . 1 1 64 64 VAL CA C 13 58.0 . . 1 . . . . 64 VAL CA . 16091 1 721 . 1 1 64 64 VAL CB C 13 34.0 . . 1 . . . . 64 VAL CB . 16091 1 722 . 1 1 64 64 VAL CG1 C 13 22.1 . . 1 . . . . 64 VAL CG1 . 16091 1 723 . 1 1 64 64 VAL CG2 C 13 18.8 . . 1 . . . . 64 VAL CG2 . 16091 1 724 . 1 1 64 64 VAL N N 15 119.9 . . 1 . . . . 64 VAL N . 16091 1 725 . 1 1 65 65 GLU H H 1 8.78 . . 1 . . . . 65 GLU H . 16091 1 726 . 1 1 65 65 GLU HA H 1 4.58 . . 1 . . . . 65 GLU HA . 16091 1 727 . 1 1 65 65 GLU HB2 H 1 1.91 . . 2 . . . . 65 GLU HB2 . 16091 1 728 . 1 1 65 65 GLU HB3 H 1 1.93 . . 2 . . . . 65 GLU HB3 . 16091 1 729 . 1 1 65 65 GLU HG2 H 1 2.08 . . 2 . . . . 65 GLU HG2 . 16091 1 730 . 1 1 65 65 GLU HG3 H 1 2.29 . . 2 . . . . 65 GLU HG3 . 16091 1 731 . 1 1 65 65 GLU CA C 13 56.2 . . 1 . . . . 65 GLU CA . 16091 1 732 . 1 1 65 65 GLU CB C 13 30.7 . . 1 . . . . 65 GLU CB . 16091 1 733 . 1 1 65 65 GLU CG C 13 36.3 . . 1 . . . . 65 GLU CG . 16091 1 734 . 1 1 65 65 GLU N N 15 123.8 . . 1 . . . . 65 GLU N . 16091 1 735 . 1 1 66 66 THR H H 1 7.90 . . 1 . . . . 66 THR H . 16091 1 736 . 1 1 66 66 THR HA H 1 5.65 . . 1 . . . . 66 THR HA . 16091 1 737 . 1 1 66 66 THR HB H 1 4.32 . . 1 . . . . 66 THR HB . 16091 1 738 . 1 1 66 66 THR HG1 H 1 4.96 . . 1 . . . . 66 THR HG1 . 16091 1 739 . 1 1 66 66 THR HG21 H 1 0.97 . . 1 . . . . 66 THR HG2 . 16091 1 740 . 1 1 66 66 THR HG22 H 1 0.97 . . 1 . . . . 66 THR HG2 . 16091 1 741 . 1 1 66 66 THR HG23 H 1 0.97 . . 1 . . . . 66 THR HG2 . 16091 1 742 . 1 1 66 66 THR CA C 13 59.6 . . 1 . . . . 66 THR CA . 16091 1 743 . 1 1 66 66 THR CB C 13 73.9 . . 1 . . . . 66 THR CB . 16091 1 744 . 1 1 66 66 THR CG2 C 13 21.9 . . 1 . . . . 66 THR CG2 . 16091 1 745 . 1 1 66 66 THR N N 15 115.6 . . 1 . . . . 66 THR N . 16091 1 746 . 1 1 67 67 ASN H H 1 9.22 . . 1 . . . . 67 ASN H . 16091 1 747 . 1 1 67 67 ASN HA H 1 4.45 . . 1 . . . . 67 ASN HA . 16091 1 748 . 1 1 67 67 ASN HB2 H 1 2.75 . . 2 . . . . 67 ASN HB2 . 16091 1 749 . 1 1 67 67 ASN HB3 H 1 2.97 . . 2 . . . . 67 ASN HB3 . 16091 1 750 . 1 1 67 67 ASN HD21 H 1 7.61 . . 2 . . . . 67 ASN HD21 . 16091 1 751 . 1 1 67 67 ASN HD22 H 1 7.75 . . 2 . . . . 67 ASN HD22 . 16091 1 752 . 1 1 67 67 ASN CA C 13 56.0 . . 1 . . . . 67 ASN CA . 16091 1 753 . 1 1 67 67 ASN CB C 13 36.7 . . 1 . . . . 67 ASN CB . 16091 1 754 . 1 1 67 67 ASN N N 15 117.2 . . 1 . . . . 67 ASN N . 16091 1 755 . 1 1 67 67 ASN ND2 N 15 115.9 . . 1 . . . . 67 ASN ND2 . 16091 1 756 . 1 1 68 68 LEU H H 1 8.03 . . 1 . . . . 68 LEU H . 16091 1 757 . 1 1 68 68 LEU HA H 1 4.43 . . 1 . . . . 68 LEU HA . 16091 1 758 . 1 1 68 68 LEU HB2 H 1 1.28 . . 2 . . . . 68 LEU HB2 . 16091 1 759 . 1 1 68 68 LEU HB3 H 1 1.53 . . 2 . . . . 68 LEU HB3 . 16091 1 760 . 1 1 68 68 LEU HD11 H 1 0.69 . . 2 . . . . 68 LEU HD1 . 16091 1 761 . 1 1 68 68 LEU HD12 H 1 0.69 . . 2 . . . . 68 LEU HD1 . 16091 1 762 . 1 1 68 68 LEU HD13 H 1 0.69 . . 2 . . . . 68 LEU HD1 . 16091 1 763 . 1 1 68 68 LEU HD21 H 1 0.76 . . 2 . . . . 68 LEU HD2 . 16091 1 764 . 1 1 68 68 LEU HD22 H 1 0.76 . . 2 . . . . 68 LEU HD2 . 16091 1 765 . 1 1 68 68 LEU HD23 H 1 0.76 . . 2 . . . . 68 LEU HD2 . 16091 1 766 . 1 1 68 68 LEU HG H 1 1.53 . . 1 . . . . 68 LEU HG . 16091 1 767 . 1 1 68 68 LEU CA C 13 54.4 . . 1 . . . . 68 LEU CA . 16091 1 768 . 1 1 68 68 LEU CB C 13 42.9 . . 1 . . . . 68 LEU CB . 16091 1 769 . 1 1 68 68 LEU CD1 C 13 25.4 . . 1 . . . . 68 LEU CD1 . 16091 1 770 . 1 1 68 68 LEU CD2 C 13 22.0 . . 1 . . . . 68 LEU CD2 . 16091 1 771 . 1 1 68 68 LEU CG C 13 26.6 . . 1 . . . . 68 LEU CG . 16091 1 772 . 1 1 68 68 LEU N N 15 117.6 . . 1 . . . . 68 LEU N . 16091 1 773 . 1 1 69 69 GLY H H 1 7.16 . . 1 . . . . 69 GLY H . 16091 1 774 . 1 1 69 69 GLY HA2 H 1 3.81 . . 2 . . . . 69 GLY HA2 . 16091 1 775 . 1 1 69 69 GLY HA3 H 1 4.56 . . 2 . . . . 69 GLY HA3 . 16091 1 776 . 1 1 69 69 GLY CA C 13 43.2 . . 1 . . . . 69 GLY CA . 16091 1 777 . 1 1 69 69 GLY N N 15 105.5 . . 1 . . . . 69 GLY N . 16091 1 778 . 1 1 70 70 ASN H H 1 9.07 . . 1 . . . . 70 ASN H . 16091 1 779 . 1 1 70 70 ASN HA H 1 5.31 . . 1 . . . . 70 ASN HA . 16091 1 780 . 1 1 70 70 ASN HB2 H 1 2.27 . . 2 . . . . 70 ASN HB2 . 16091 1 781 . 1 1 70 70 ASN HB3 H 1 2.75 . . 2 . . . . 70 ASN HB3 . 16091 1 782 . 1 1 70 70 ASN HD21 H 1 7.44 . . 2 . . . . 70 ASN HD21 . 16091 1 783 . 1 1 70 70 ASN HD22 H 1 6.82 . . 2 . . . . 70 ASN HD22 . 16091 1 784 . 1 1 70 70 ASN CA C 13 53.2 . . 1 . . . . 70 ASN CA . 16091 1 785 . 1 1 70 70 ASN CB C 13 38.0 . . 1 . . . . 70 ASN CB . 16091 1 786 . 1 1 70 70 ASN N N 15 122.7 . . 1 . . . . 70 ASN N . 16091 1 787 . 1 1 70 70 ASN ND2 N 15 110.0 . . 1 . . . . 70 ASN ND2 . 16091 1 788 . 1 1 71 71 VAL H H 1 9.14 . . 1 . . . . 71 VAL H . 16091 1 789 . 1 1 71 71 VAL HA H 1 4.62 . . 1 . . . . 71 VAL HA . 16091 1 790 . 1 1 71 71 VAL HB H 1 1.70 . . 1 . . . . 71 VAL HB . 16091 1 791 . 1 1 71 71 VAL HG11 H 1 0.61 . . 2 . . . . 71 VAL HG1 . 16091 1 792 . 1 1 71 71 VAL HG12 H 1 0.61 . . 2 . . . . 71 VAL HG1 . 16091 1 793 . 1 1 71 71 VAL HG13 H 1 0.61 . . 2 . . . . 71 VAL HG1 . 16091 1 794 . 1 1 71 71 VAL HG21 H 1 0.71 . . 2 . . . . 71 VAL HG2 . 16091 1 795 . 1 1 71 71 VAL HG22 H 1 0.71 . . 2 . . . . 71 VAL HG2 . 16091 1 796 . 1 1 71 71 VAL HG23 H 1 0.71 . . 2 . . . . 71 VAL HG2 . 16091 1 797 . 1 1 71 71 VAL CA C 13 60.0 . . 1 . . . . 71 VAL CA . 16091 1 798 . 1 1 71 71 VAL CB C 13 36.0 . . 1 . . . . 71 VAL CB . 16091 1 799 . 1 1 71 71 VAL CG1 C 13 22.1 . . 1 . . . . 71 VAL CG1 . 16091 1 800 . 1 1 71 71 VAL CG2 C 13 23.6 . . 1 . . . . 71 VAL CG2 . 16091 1 801 . 1 1 71 71 VAL N N 15 122.4 . . 1 . . . . 71 VAL N . 16091 1 802 . 1 1 72 72 ARG H H 1 8.96 . . 1 . . . . 72 ARG H . 16091 1 803 . 1 1 72 72 ARG HA H 1 5.08 . . 1 . . . . 72 ARG HA . 16091 1 804 . 1 1 72 72 ARG HB2 H 1 1.58 . . 2 . . . . 72 ARG HB2 . 16091 1 805 . 1 1 72 72 ARG HB3 H 1 1.79 . . 2 . . . . 72 ARG HB3 . 16091 1 806 . 1 1 72 72 ARG HD2 H 1 3.14 . . 2 . . . . 72 ARG HD2 . 16091 1 807 . 1 1 72 72 ARG HD3 H 1 3.18 . . 2 . . . . 72 ARG HD3 . 16091 1 808 . 1 1 72 72 ARG HG2 H 1 1.39 . . 2 . . . . 72 ARG HG2 . 16091 1 809 . 1 1 72 72 ARG HG3 H 1 1.39 . . 2 . . . . 72 ARG HG3 . 16091 1 810 . 1 1 72 72 ARG CA C 13 53.8 . . 1 . . . . 72 ARG CA . 16091 1 811 . 1 1 72 72 ARG CB C 13 31.2 . . 1 . . . . 72 ARG CB . 16091 1 812 . 1 1 72 72 ARG CD C 13 42.7 . . 1 . . . . 72 ARG CD . 16091 1 813 . 1 1 72 72 ARG CG C 13 27.2 . . 1 . . . . 72 ARG CG . 16091 1 814 . 1 1 72 72 ARG N N 15 127.1 . . 1 . . . . 72 ARG N . 16091 1 815 . 1 1 73 73 VAL H H 1 9.27 . . 1 . . . . 73 VAL H . 16091 1 816 . 1 1 73 73 VAL HA H 1 4.11 . . 1 . . . . 73 VAL HA . 16091 1 817 . 1 1 73 73 VAL HB H 1 2.30 . . 1 . . . . 73 VAL HB . 16091 1 818 . 1 1 73 73 VAL HG11 H 1 1.02 . . 2 . . . . 73 VAL HG1 . 16091 1 819 . 1 1 73 73 VAL HG12 H 1 1.02 . . 2 . . . . 73 VAL HG1 . 16091 1 820 . 1 1 73 73 VAL HG13 H 1 1.02 . . 2 . . . . 73 VAL HG1 . 16091 1 821 . 1 1 73 73 VAL HG21 H 1 0.85 . . 2 . . . . 73 VAL HG2 . 16091 1 822 . 1 1 73 73 VAL HG22 H 1 0.85 . . 2 . . . . 73 VAL HG2 . 16091 1 823 . 1 1 73 73 VAL HG23 H 1 0.85 . . 2 . . . . 73 VAL HG2 . 16091 1 824 . 1 1 73 73 VAL CA C 13 64.2 . . 1 . . . . 73 VAL CA . 16091 1 825 . 1 1 73 73 VAL CB C 13 31.8 . . 1 . . . . 73 VAL CB . 16091 1 826 . 1 1 73 73 VAL CG1 C 13 21.6 . . 1 . . . . 73 VAL CG1 . 16091 1 827 . 1 1 73 73 VAL CG2 C 13 22.4 . . 1 . . . . 73 VAL CG2 . 16091 1 828 . 1 1 73 73 VAL N N 15 129.1 . . 1 . . . . 73 VAL N . 16091 1 829 . 1 1 74 74 THR H H 1 9.52 . . 1 . . . . 74 THR H . 16091 1 830 . 1 1 74 74 THR HA H 1 4.54 . . 1 . . . . 74 THR HA . 16091 1 831 . 1 1 74 74 THR HB H 1 4.38 . . 1 . . . . 74 THR HB . 16091 1 832 . 1 1 74 74 THR HG21 H 1 1.20 . . 1 . . . . 74 THR HG2 . 16091 1 833 . 1 1 74 74 THR HG22 H 1 1.20 . . 1 . . . . 74 THR HG2 . 16091 1 834 . 1 1 74 74 THR HG23 H 1 1.20 . . 1 . . . . 74 THR HG2 . 16091 1 835 . 1 1 74 74 THR CA C 13 61.8 . . 1 . . . . 74 THR CA . 16091 1 836 . 1 1 74 74 THR CB C 13 69.4 . . 1 . . . . 74 THR CB . 16091 1 837 . 1 1 74 74 THR CG2 C 13 22.0 . . 1 . . . . 74 THR CG2 . 16091 1 838 . 1 1 74 74 THR N N 15 120.9 . . 1 . . . . 74 THR N . 16091 1 839 . 1 1 75 75 SER H H 1 7.49 . . 1 . . . . 75 SER H . 16091 1 840 . 1 1 75 75 SER HA H 1 4.70 . . 1 . . . . 75 SER HA . 16091 1 841 . 1 1 75 75 SER HB2 H 1 4.09 . . 2 . . . . 75 SER HB2 . 16091 1 842 . 1 1 75 75 SER HB3 H 1 3.88 . . 2 . . . . 75 SER HB3 . 16091 1 843 . 1 1 75 75 SER CA C 13 57.4 . . 1 . . . . 75 SER CA . 16091 1 844 . 1 1 75 75 SER CB C 13 65.2 . . 1 . . . . 75 SER CB . 16091 1 845 . 1 1 75 75 SER N N 15 116.7 . . 1 . . . . 75 SER N . 16091 1 846 . 1 1 76 76 ARG H H 1 8.53 . . 1 . . . . 76 ARG H . 16091 1 847 . 1 1 76 76 ARG HA H 1 4.82 . . 1 . . . . 76 ARG HA . 16091 1 848 . 1 1 76 76 ARG HB2 H 1 1.76 . . 2 . . . . 76 ARG HB2 . 16091 1 849 . 1 1 76 76 ARG HB3 H 1 1.86 . . 2 . . . . 76 ARG HB3 . 16091 1 850 . 1 1 76 76 ARG HD2 H 1 3.19 . . 2 . . . . 76 ARG HD2 . 16091 1 851 . 1 1 76 76 ARG HD3 H 1 3.19 . . 2 . . . . 76 ARG HD3 . 16091 1 852 . 1 1 76 76 ARG HG2 H 1 1.66 . . 2 . . . . 76 ARG HG2 . 16091 1 853 . 1 1 76 76 ARG HG3 H 1 1.67 . . 2 . . . . 76 ARG HG3 . 16091 1 854 . 1 1 76 76 ARG CA C 13 53.8 . . 1 . . . . 76 ARG CA . 16091 1 855 . 1 1 76 76 ARG CB C 13 30.1 . . 1 . . . . 76 ARG CB . 16091 1 856 . 1 1 76 76 ARG CD C 13 43.4 . . 1 . . . . 76 ARG CD . 16091 1 857 . 1 1 76 76 ARG CG C 13 27.0 . . 1 . . . . 76 ARG CG . 16091 1 858 . 1 1 76 76 ARG N N 15 118.8 . . 1 . . . . 76 ARG N . 16091 1 859 . 1 1 77 77 PRO HA H 1 4.26 . . 1 . . . . 77 PRO HA . 16091 1 860 . 1 1 77 77 PRO HB2 H 1 2.12 . . 2 . . . . 77 PRO HB2 . 16091 1 861 . 1 1 77 77 PRO HB3 H 1 1.90 . . 2 . . . . 77 PRO HB3 . 16091 1 862 . 1 1 77 77 PRO HD2 H 1 3.72 . . 2 . . . . 77 PRO HD2 . 16091 1 863 . 1 1 77 77 PRO HD3 H 1 3.98 . . 2 . . . . 77 PRO HD3 . 16091 1 864 . 1 1 77 77 PRO HG2 H 1 1.77 . . 2 . . . . 77 PRO HG2 . 16091 1 865 . 1 1 77 77 PRO HG3 H 1 1.99 . . 2 . . . . 77 PRO HG3 . 16091 1 866 . 1 1 77 77 PRO CA C 13 64.2 . . 1 . . . . 77 PRO CA . 16091 1 867 . 1 1 77 77 PRO CB C 13 31.8 . . 1 . . . . 77 PRO CB . 16091 1 868 . 1 1 77 77 PRO CD C 13 50.5 . . 1 . . . . 77 PRO CD . 16091 1 869 . 1 1 77 77 PRO CG C 13 27.7 . . 1 . . . . 77 PRO CG . 16091 1 870 . 1 1 78 78 GLY H H 1 8.66 . . 1 . . . . 78 GLY H . 16091 1 871 . 1 1 78 78 GLY HA2 H 1 3.96 . . 2 . . . . 78 GLY HA2 . 16091 1 872 . 1 1 78 78 GLY HA3 H 1 4.03 . . 2 . . . . 78 GLY HA3 . 16091 1 873 . 1 1 78 78 GLY CA C 13 45.1 . . 1 . . . . 78 GLY CA . 16091 1 874 . 1 1 78 78 GLY N N 15 109.2 . . 1 . . . . 78 GLY N . 16091 1 875 . 1 1 79 79 GLN H H 1 8.23 . . 1 . . . . 79 GLN H . 16091 1 876 . 1 1 79 79 GLN HA H 1 4.24 . . 1 . . . . 79 GLN HA . 16091 1 877 . 1 1 79 79 GLN HB2 H 1 2.00 . . 2 . . . . 79 GLN HB2 . 16091 1 878 . 1 1 79 79 GLN HB3 H 1 2.06 . . 2 . . . . 79 GLN HB3 . 16091 1 879 . 1 1 79 79 GLN HE21 H 1 6.84 . . 2 . . . . 79 GLN HE21 . 16091 1 880 . 1 1 79 79 GLN HE22 H 1 7.58 . . 2 . . . . 79 GLN HE22 . 16091 1 881 . 1 1 79 79 GLN HG2 H 1 2.36 . . 2 . . . . 79 GLN HG2 . 16091 1 882 . 1 1 79 79 GLN HG3 H 1 2.36 . . 2 . . . . 79 GLN HG3 . 16091 1 883 . 1 1 79 79 GLN CA C 13 57.1 . . 1 . . . . 79 GLN CA . 16091 1 884 . 1 1 79 79 GLN CB C 13 29.4 . . 1 . . . . 79 GLN CB . 16091 1 885 . 1 1 79 79 GLN CG C 13 33.7 . . 1 . . . . 79 GLN CG . 16091 1 886 . 1 1 79 79 GLN N N 15 120.3 . . 1 . . . . 79 GLN N . 16091 1 887 . 1 1 79 79 GLN NE2 N 15 112.5 . . 1 . . . . 79 GLN NE2 . 16091 1 888 . 1 1 80 80 ASP H H 1 8.48 . . 1 . . . . 80 ASP H . 16091 1 889 . 1 1 80 80 ASP HA H 1 4.57 . . 1 . . . . 80 ASP HA . 16091 1 890 . 1 1 80 80 ASP HB2 H 1 2.72 . . 2 . . . . 80 ASP HB2 . 16091 1 891 . 1 1 80 80 ASP HB3 H 1 2.72 . . 2 . . . . 80 ASP HB3 . 16091 1 892 . 1 1 80 80 ASP CA C 13 54.3 . . 1 . . . . 80 ASP CA . 16091 1 893 . 1 1 80 80 ASP CB C 13 41.1 . . 1 . . . . 80 ASP CB . 16091 1 894 . 1 1 80 80 ASP N N 15 117.8 . . 1 . . . . 80 ASP N . 16091 1 895 . 1 1 81 81 GLY H H 1 8.07 . . 1 . . . . 81 GLY H . 16091 1 896 . 1 1 81 81 GLY HA2 H 1 3.75 . . 2 . . . . 81 GLY HA2 . 16091 1 897 . 1 1 81 81 GLY HA3 H 1 4.04 . . 2 . . . . 81 GLY HA3 . 16091 1 898 . 1 1 81 81 GLY CA C 13 45.4 . . 1 . . . . 81 GLY CA . 16091 1 899 . 1 1 81 81 GLY N N 15 107.8 . . 1 . . . . 81 GLY N . 16091 1 900 . 1 1 82 82 VAL H H 1 7.54 . . 1 . . . . 82 VAL H . 16091 1 901 . 1 1 82 82 VAL HA H 1 4.12 . . 1 . . . . 82 VAL HA . 16091 1 902 . 1 1 82 82 VAL HB H 1 1.92 . . 1 . . . . 82 VAL HB . 16091 1 903 . 1 1 82 82 VAL HG11 H 1 0.81 . . 2 . . . . 82 VAL HG1 . 16091 1 904 . 1 1 82 82 VAL HG12 H 1 0.81 . . 2 . . . . 82 VAL HG1 . 16091 1 905 . 1 1 82 82 VAL HG13 H 1 0.81 . . 2 . . . . 82 VAL HG1 . 16091 1 906 . 1 1 82 82 VAL HG21 H 1 0.80 . . 2 . . . . 82 VAL HG2 . 16091 1 907 . 1 1 82 82 VAL HG22 H 1 0.80 . . 2 . . . . 82 VAL HG2 . 16091 1 908 . 1 1 82 82 VAL HG23 H 1 0.80 . . 2 . . . . 82 VAL HG2 . 16091 1 909 . 1 1 82 82 VAL CA C 13 61.7 . . 1 . . . . 82 VAL CA . 16091 1 910 . 1 1 82 82 VAL CB C 13 33.3 . . 1 . . . . 82 VAL CB . 16091 1 911 . 1 1 82 82 VAL CG1 C 13 21.0 . . 1 . . . . 82 VAL CG1 . 16091 1 912 . 1 1 82 82 VAL CG2 C 13 21.0 . . 1 . . . . 82 VAL CG2 . 16091 1 913 . 1 1 82 82 VAL N N 15 118.9 . . 1 . . . . 82 VAL N . 16091 1 914 . 1 1 83 83 ILE H H 1 8.48 . . 1 . . . . 83 ILE H . 16091 1 915 . 1 1 83 83 ILE HA H 1 4.02 . . 1 . . . . 83 ILE HA . 16091 1 916 . 1 1 83 83 ILE HB H 1 1.89 . . 1 . . . . 83 ILE HB . 16091 1 917 . 1 1 83 83 ILE HD11 H 1 0.78 . . 1 . . . . 83 ILE HD1 . 16091 1 918 . 1 1 83 83 ILE HD12 H 1 0.78 . . 1 . . . . 83 ILE HD1 . 16091 1 919 . 1 1 83 83 ILE HD13 H 1 0.78 . . 1 . . . . 83 ILE HD1 . 16091 1 920 . 1 1 83 83 ILE HG12 H 1 0.86 . . 2 . . . . 83 ILE HG12 . 16091 1 921 . 1 1 83 83 ILE HG13 H 1 1.59 . . 2 . . . . 83 ILE HG13 . 16091 1 922 . 1 1 83 83 ILE HG21 H 1 0.81 . . 1 . . . . 83 ILE HG2 . 16091 1 923 . 1 1 83 83 ILE HG22 H 1 0.81 . . 1 . . . . 83 ILE HG2 . 16091 1 924 . 1 1 83 83 ILE HG23 H 1 0.81 . . 1 . . . . 83 ILE HG2 . 16091 1 925 . 1 1 83 83 ILE CA C 13 61.2 . . 1 . . . . 83 ILE CA . 16091 1 926 . 1 1 83 83 ILE CB C 13 38.7 . . 1 . . . . 83 ILE CB . 16091 1 927 . 1 1 83 83 ILE CD1 C 13 13.7 . . 1 . . . . 83 ILE CD1 . 16091 1 928 . 1 1 83 83 ILE CG1 C 13 27.2 . . 1 . . . . 83 ILE CG1 . 16091 1 929 . 1 1 83 83 ILE CG2 C 13 18.7 . . 1 . . . . 83 ILE CG2 . 16091 1 930 . 1 1 83 83 ILE N N 15 125.9 . . 1 . . . . 83 ILE N . 16091 1 931 . 1 1 84 84 ASN H H 1 8.29 . . 1 . . . . 84 ASN H . 16091 1 932 . 1 1 84 84 ASN HA H 1 5.74 . . 1 . . . . 84 ASN HA . 16091 1 933 . 1 1 84 84 ASN HB2 H 1 2.73 . . 2 . . . . 84 ASN HB2 . 16091 1 934 . 1 1 84 84 ASN HB3 H 1 2.56 . . 2 . . . . 84 ASN HB3 . 16091 1 935 . 1 1 84 84 ASN HD21 H 1 6.71 . . 2 . . . . 84 ASN HD21 . 16091 1 936 . 1 1 84 84 ASN HD22 H 1 7.17 . . 2 . . . . 84 ASN HD22 . 16091 1 937 . 1 1 84 84 ASN CA C 13 51.4 . . 1 . . . . 84 ASN CA . 16091 1 938 . 1 1 84 84 ASN CB C 13 42.1 . . 1 . . . . 84 ASN CB . 16091 1 939 . 1 1 84 84 ASN N N 15 123.3 . . 1 . . . . 84 ASN N . 16091 1 940 . 1 1 84 84 ASN ND2 N 15 112.1 . . 1 . . . . 84 ASN ND2 . 16091 1 941 . 1 1 85 85 GLY H H 1 8.78 . . 1 . . . . 85 GLY H . 16091 1 942 . 1 1 85 85 GLY HA2 H 1 3.65 . . 2 . . . . 85 GLY HA2 . 16091 1 943 . 1 1 85 85 GLY HA3 H 1 5.06 . . 2 . . . . 85 GLY HA3 . 16091 1 944 . 1 1 85 85 GLY CA C 13 46.3 . . 1 . . . . 85 GLY CA . 16091 1 945 . 1 1 85 85 GLY N N 15 106.6 . . 1 . . . . 85 GLY N . 16091 1 946 . 1 1 86 86 VAL H H 1 8.78 . . 1 . . . . 86 VAL H . 16091 1 947 . 1 1 86 86 VAL HA H 1 4.96 . . 1 . . . . 86 VAL HA . 16091 1 948 . 1 1 86 86 VAL HB H 1 1.94 . . 1 . . . . 86 VAL HB . 16091 1 949 . 1 1 86 86 VAL HG11 H 1 0.99 . . 2 . . . . 86 VAL HG1 . 16091 1 950 . 1 1 86 86 VAL HG12 H 1 0.99 . . 2 . . . . 86 VAL HG1 . 16091 1 951 . 1 1 86 86 VAL HG13 H 1 0.99 . . 2 . . . . 86 VAL HG1 . 16091 1 952 . 1 1 86 86 VAL HG21 H 1 0.99 . . 2 . . . . 86 VAL HG2 . 16091 1 953 . 1 1 86 86 VAL HG22 H 1 0.99 . . 2 . . . . 86 VAL HG2 . 16091 1 954 . 1 1 86 86 VAL HG23 H 1 0.99 . . 2 . . . . 86 VAL HG2 . 16091 1 955 . 1 1 86 86 VAL CA C 13 59.1 . . 1 . . . . 86 VAL CA . 16091 1 956 . 1 1 86 86 VAL CB C 13 35.5 . . 1 . . . . 86 VAL CB . 16091 1 957 . 1 1 86 86 VAL CG1 C 13 20.5 . . 1 . . . . 86 VAL CG1 . 16091 1 958 . 1 1 86 86 VAL CG2 C 13 20.6 . . 1 . . . . 86 VAL CG2 . 16091 1 959 . 1 1 86 86 VAL N N 15 118.0 . . 1 . . . . 86 VAL N . 16091 1 960 . 1 1 87 87 LEU H H 1 8.49 . . 1 . . . . 87 LEU H . 16091 1 961 . 1 1 87 87 LEU HA H 1 4.17 . . 1 . . . . 87 LEU HA . 16091 1 962 . 1 1 87 87 LEU HB2 H 1 1.26 . . 2 . . . . 87 LEU HB2 . 16091 1 963 . 1 1 87 87 LEU HB3 H 1 1.69 . . 2 . . . . 87 LEU HB3 . 16091 1 964 . 1 1 87 87 LEU HD11 H 1 0.73 . . 2 . . . . 87 LEU HD1 . 16091 1 965 . 1 1 87 87 LEU HD12 H 1 0.73 . . 2 . . . . 87 LEU HD1 . 16091 1 966 . 1 1 87 87 LEU HD13 H 1 0.73 . . 2 . . . . 87 LEU HD1 . 16091 1 967 . 1 1 87 87 LEU HD21 H 1 0.75 . . 2 . . . . 87 LEU HD2 . 16091 1 968 . 1 1 87 87 LEU HD22 H 1 0.75 . . 2 . . . . 87 LEU HD2 . 16091 1 969 . 1 1 87 87 LEU HD23 H 1 0.75 . . 2 . . . . 87 LEU HD2 . 16091 1 970 . 1 1 87 87 LEU HG H 1 1.40 . . 1 . . . . 87 LEU HG . 16091 1 971 . 1 1 87 87 LEU CA C 13 56.0 . . 1 . . . . 87 LEU CA . 16091 1 972 . 1 1 87 87 LEU CB C 13 43.5 . . 1 . . . . 87 LEU CB . 16091 1 973 . 1 1 87 87 LEU CD1 C 13 23.7 . . 1 . . . . 87 LEU CD1 . 16091 1 974 . 1 1 87 87 LEU CD2 C 13 25.3 . . 1 . . . . 87 LEU CD2 . 16091 1 975 . 1 1 87 87 LEU CG C 13 27.0 . . 1 . . . . 87 LEU CG . 16091 1 976 . 1 1 87 87 LEU N N 15 128.1 . . 1 . . . . 87 LEU N . 16091 1 977 . 1 1 88 88 ILE H H 1 8.41 . . 1 . . . . 88 ILE H . 16091 1 978 . 1 1 88 88 ILE HA H 1 4.10 . . 1 . . . . 88 ILE HA . 16091 1 979 . 1 1 88 88 ILE HB H 1 1.69 . . 1 . . . . 88 ILE HB . 16091 1 980 . 1 1 88 88 ILE HD11 H 1 0.78 . . 1 . . . . 88 ILE HD1 . 16091 1 981 . 1 1 88 88 ILE HD12 H 1 0.78 . . 1 . . . . 88 ILE HD1 . 16091 1 982 . 1 1 88 88 ILE HD13 H 1 0.78 . . 1 . . . . 88 ILE HD1 . 16091 1 983 . 1 1 88 88 ILE HG12 H 1 0.97 . . 2 . . . . 88 ILE HG12 . 16091 1 984 . 1 1 88 88 ILE HG13 H 1 1.56 . . 2 . . . . 88 ILE HG13 . 16091 1 985 . 1 1 88 88 ILE HG21 H 1 0.86 . . 1 . . . . 88 ILE HG2 . 16091 1 986 . 1 1 88 88 ILE HG22 H 1 0.86 . . 1 . . . . 88 ILE HG2 . 16091 1 987 . 1 1 88 88 ILE HG23 H 1 0.86 . . 1 . . . . 88 ILE HG2 . 16091 1 988 . 1 1 88 88 ILE CA C 13 61.1 . . 1 . . . . 88 ILE CA . 16091 1 989 . 1 1 88 88 ILE CB C 13 38.4 . . 1 . . . . 88 ILE CB . 16091 1 990 . 1 1 88 88 ILE CD1 C 13 14.6 . . 1 . . . . 88 ILE CD1 . 16091 1 991 . 1 1 88 88 ILE CG1 C 13 27.3 . . 1 . . . . 88 ILE CG1 . 16091 1 992 . 1 1 88 88 ILE CG2 C 13 17.7 . . 1 . . . . 88 ILE CG2 . 16091 1 993 . 1 1 88 88 ILE N N 15 125.2 . . 1 . . . . 88 ILE N . 16091 1 994 . 1 1 89 89 ARG H H 1 8.39 . . 1 . . . . 89 ARG H . 16091 1 995 . 1 1 89 89 ARG HA H 1 4.41 . . 1 . . . . 89 ARG HA . 16091 1 996 . 1 1 89 89 ARG HB2 H 1 1.72 . . 2 . . . . 89 ARG HB2 . 16091 1 997 . 1 1 89 89 ARG HB3 H 1 1.80 . . 2 . . . . 89 ARG HB3 . 16091 1 998 . 1 1 89 89 ARG HD2 H 1 3.16 . . 2 . . . . 89 ARG HD2 . 16091 1 999 . 1 1 89 89 ARG HD3 H 1 3.15 . . 2 . . . . 89 ARG HD3 . 16091 1 1000 . 1 1 89 89 ARG HG2 H 1 1.54 . . 2 . . . . 89 ARG HG2 . 16091 1 1001 . 1 1 89 89 ARG HG3 H 1 1.60 . . 2 . . . . 89 ARG HG3 . 16091 1 1002 . 1 1 89 89 ARG CA C 13 55.5 . . 1 . . . . 89 ARG CA . 16091 1 1003 . 1 1 89 89 ARG CB C 13 31.2 . . 1 . . . . 89 ARG CB . 16091 1 1004 . 1 1 89 89 ARG CD C 13 43.4 . . 1 . . . . 89 ARG CD . 16091 1 1005 . 1 1 89 89 ARG CG C 13 27.3 . . 1 . . . . 89 ARG CG . 16091 1 1006 . 1 1 89 89 ARG N N 15 126.3 . . 1 . . . . 89 ARG N . 16091 1 1007 . 1 1 90 90 GLU H H 1 8.50 . . 1 . . . . 90 GLU H . 16091 1 1008 . 1 1 90 90 GLU HA H 1 4.29 . . 1 . . . . 90 GLU HA . 16091 1 1009 . 1 1 90 90 GLU HB2 H 1 1.89 . . 2 . . . . 90 GLU HB2 . 16091 1 1010 . 1 1 90 90 GLU HB3 H 1 2.01 . . 2 . . . . 90 GLU HB3 . 16091 1 1011 . 1 1 90 90 GLU HG2 H 1 2.23 . . 2 . . . . 90 GLU HG2 . 16091 1 1012 . 1 1 90 90 GLU HG3 H 1 2.23 . . 2 . . . . 90 GLU HG3 . 16091 1 1013 . 1 1 90 90 GLU CA C 13 56.2 . . 1 . . . . 90 GLU CA . 16091 1 1014 . 1 1 90 90 GLU CB C 13 30.3 . . 1 . . . . 90 GLU CB . 16091 1 1015 . 1 1 90 90 GLU CG C 13 36.0 . . 1 . . . . 90 GLU CG . 16091 1 1016 . 1 1 90 90 GLU N N 15 122.4 . . 1 . . . . 90 GLU N . 16091 1 1017 . 1 1 91 91 LEU H H 1 8.31 . . 1 . . . . 91 LEU H . 16091 1 1018 . 1 1 91 91 LEU HA H 1 4.25 . . 1 . . . . 91 LEU HA . 16091 1 1019 . 1 1 91 91 LEU HB2 H 1 1.48 . . 2 . . . . 91 LEU HB2 . 16091 1 1020 . 1 1 91 91 LEU HB3 H 1 1.55 . . 2 . . . . 91 LEU HB3 . 16091 1 1021 . 1 1 91 91 LEU HD11 H 1 0.85 . . 2 . . . . 91 LEU HD1 . 16091 1 1022 . 1 1 91 91 LEU HD12 H 1 0.85 . . 2 . . . . 91 LEU HD1 . 16091 1 1023 . 1 1 91 91 LEU HD13 H 1 0.85 . . 2 . . . . 91 LEU HD1 . 16091 1 1024 . 1 1 91 91 LEU HD21 H 1 0.80 . . 2 . . . . 91 LEU HD2 . 16091 1 1025 . 1 1 91 91 LEU HD22 H 1 0.80 . . 2 . . . . 91 LEU HD2 . 16091 1 1026 . 1 1 91 91 LEU HD23 H 1 0.80 . . 2 . . . . 91 LEU HD2 . 16091 1 1027 . 1 1 91 91 LEU HG H 1 1.57 . . 1 . . . . 91 LEU HG . 16091 1 1028 . 1 1 91 91 LEU CA C 13 55.2 . . 1 . . . . 91 LEU CA . 16091 1 1029 . 1 1 91 91 LEU CB C 13 42.3 . . 1 . . . . 91 LEU CB . 16091 1 1030 . 1 1 91 91 LEU CD1 C 13 24.8 . . 1 . . . . 91 LEU CD1 . 16091 1 1031 . 1 1 91 91 LEU CD2 C 13 23.4 . . 1 . . . . 91 LEU CD2 . 16091 1 1032 . 1 1 91 91 LEU CG C 13 27.0 . . 1 . . . . 91 LEU CG . 16091 1 1033 . 1 1 91 91 LEU N N 15 123.3 . . 1 . . . . 91 LEU N . 16091 1 1034 . 1 1 92 92 GLU H H 1 8.34 . . 1 . . . . 92 GLU H . 16091 1 1035 . 1 1 92 92 GLU HA H 1 4.13 . . 1 . . . . 92 GLU HA . 16091 1 1036 . 1 1 92 92 GLU HB2 H 1 1.86 . . 2 . . . . 92 GLU HB2 . 16091 1 1037 . 1 1 92 92 GLU HB3 H 1 1.86 . . 2 . . . . 92 GLU HB3 . 16091 1 1038 . 1 1 92 92 GLU HG2 H 1 2.10 . . 2 . . . . 92 GLU HG2 . 16091 1 1039 . 1 1 92 92 GLU HG3 H 1 2.10 . . 2 . . . . 92 GLU HG3 . 16091 1 1040 . 1 1 92 92 GLU CA C 13 56.3 . . 1 . . . . 92 GLU CA . 16091 1 1041 . 1 1 92 92 GLU CB C 13 30.1 . . 1 . . . . 92 GLU CB . 16091 1 1042 . 1 1 92 92 GLU CG C 13 36.0 . . 1 . . . . 92 GLU CG . 16091 1 1043 . 1 1 92 92 GLU N N 15 120.9 . . 1 . . . . 92 GLU N . 16091 1 1044 . 1 1 93 93 HIS H H 1 8.31 . . 1 . . . . 93 HIS H . 16091 1 1045 . 1 1 93 93 HIS HA H 1 4.54 . . 1 . . . . 93 HIS HA . 16091 1 1046 . 1 1 93 93 HIS HB2 H 1 3.02 . . 2 . . . . 93 HIS HB2 . 16091 1 1047 . 1 1 93 93 HIS HB3 H 1 2.99 . . 2 . . . . 93 HIS HB3 . 16091 1 1048 . 1 1 93 93 HIS CA C 13 55.7 . . 1 . . . . 93 HIS CA . 16091 1 1049 . 1 1 93 93 HIS CB C 13 29.8 . . 1 . . . . 93 HIS CB . 16091 1 1050 . 1 1 93 93 HIS N N 15 119.5 . . 1 . . . . 93 HIS N . 16091 1 1051 . 1 1 95 95 HIS HA H 1 4.57 . . 1 . . . . 95 HIS HA . 16091 1 1052 . 1 1 95 95 HIS HB2 H 1 3.10 . . 2 . . . . 95 HIS HB2 . 16091 1 1053 . 1 1 95 95 HIS HB3 H 1 3.08 . . 2 . . . . 95 HIS HB3 . 16091 1 1054 . 1 1 95 95 HIS CA C 13 55.6 . . 1 . . . . 95 HIS CA . 16091 1 1055 . 1 1 95 95 HIS CB C 13 30.0 . . 1 . . . . 95 HIS CB . 16091 1 1056 . 1 1 96 96 HIS H H 1 8.13 . . 1 . . . . 96 HIS H . 16091 1 1057 . 1 1 96 96 HIS HA H 1 4.40 . . 1 . . . . 96 HIS HA . 16091 1 1058 . 1 1 96 96 HIS HB2 H 1 3.06 . . 2 . . . . 96 HIS HB2 . 16091 1 1059 . 1 1 96 96 HIS HB3 H 1 3.18 . . 2 . . . . 96 HIS HB3 . 16091 1 1060 . 1 1 96 96 HIS CA C 13 57.0 . . 1 . . . . 96 HIS CA . 16091 1 1061 . 1 1 96 96 HIS CB C 13 30.2 . . 1 . . . . 96 HIS CB . 16091 1 1062 . 1 1 96 96 HIS N N 15 125.3 . . 1 . . . . 96 HIS N . 16091 1 stop_ save_