data_17623 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 17623 _Entry.Title ; MODEL OF HUMAN U2AF65 TANDEM RRM1 AND RRM2 DOMAINS WITH EIGHT-SITE URIDINE BINDING ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2011-05-04 _Entry.Accession_date 2011-05-04 _Entry.Last_release_date 2011-08-03 _Entry.Original_release_date 2011-08-03 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 C. Mackereth . D. . 17623 2 T. Madl . . . 17623 3 B. Simon . . . 17623 4 K. Zanier . . . 17623 5 A. Gasch . . . 17623 6 Michael Sattler . . . 17623 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . SattlerGroup . 17623 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID human . 17623 model . 17623 NMR . 17623 'pre-mRNA splicing' . 17623 'protein structure' . 17623 'RNA-binding protein' . 17623 TRANSCRIPTION . 17623 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 17623 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 375 17623 '15N chemical shifts' 184 17623 '1H chemical shifts' 914 17623 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2011-08-03 2011-05-04 original author . 17623 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 17622 'human U2AF65 closed conformation' 17623 PDB 2YH1 'BMRB Entry Tracking System' 17623 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 17623 _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 'Multi-domain conformational selection underlies pre-mRNA splicing regulation by U2AF' _Citation.Status 'in preparation' _Citation.Type journal _Citation.Journal_abbrev Nature _Citation.Journal_name_full Nature _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 C. Mackereth . D. . 17623 1 2 T. Madl . . . 17623 1 3 S. Bonnal . . . 17623 1 4 B. Simon . . . 17623 1 5 K. Zanier . . . 17623 1 6 A. Gasch . . . 17623 1 7 V. Rybin . . . 17623 1 8 J. Valcarcel . . . 17623 1 9 Michael Sattler . . . 17623 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 17623 _Assembly.ID 1 _Assembly.Name 'Model of human U2AF65 tandem RRM1 and RRM2 domains with eight-site uridine binding' _Assembly.BMRB_code . _Assembly.Number_of_components 2 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state 'all free' _Assembly.Molecular_mass 24266.07144 _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 'HUMAN U2AF65' 1 $HUMAN_U2AF65 A . yes native no no . . 'STRUCTURE BASED ON DATA FROM TEN CYSTEINE MU (N155C, A164C, A171C, L187C, A188C, T209C, D273C, S281C, A A318C) COVALENTLY MODIFIED BY 3-(2-IODOACETAMIDO)-2,2,5,5, TETRAMETHYL-1-PYRROLIDINYLOXY RADICAL (IODOACETAMIDO-PROXY' 17623 1 2 5'-R(*UP*UP*UP*UP*UP*UP*UP*UP*UP)-3' 2 $5'-R(*UP*UP*UP*UP*UP*UP*UP*UP*UP)-3' B . no native no no . . . 17623 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_HUMAN_U2AF65 _Entity.Sf_category entity _Entity.Sf_framecode HUMAN_U2AF65 _Entity.Entry_ID 17623 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name HUMAN_U2AF65 _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 ; GAMARRLYVGNIPFGITEEA MMDFFNAQMRLGGLTQAPGN PVLAVQINQDKNFAFLEFRS VDETTQAMAFDGIIFQGQSL KIRRPHDYQPLPGMSENPSV YVPGVVSTVVPDSAHKLFIG GLPNYLNDDQVKELLTSFGP LKAFNLVKDSATGLSKGYAF CEYVDINVTDQAIAGLNGMQ LGDKKLLVQRASVGAKNA ; _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 198 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment 'tandem RRM1 and RRM2 domains joined by native linker' _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 21491.534 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details 'STRUCTURE BASED ON DATA FROM TEN CYSTEINE MU (N155C, A164C, A171C, L187C, A188C, T209C, D273C, S281C, A A318C) COVALENTLY MODIFIED BY 3-(2-IODOACETAMIDO)-2,2,5,5, TETRAMETHYL-1-PYRROLIDINYLOXY RADICAL (IODOACETAMIDO-PROXY' _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 yes UNP U2AF2_HUMAN . P26368 . . . . . . . . . . . . . . 17623 1 2 no BMRB 17622 . HUMAN_U2AF65 . . . . . 100.00 198 100.00 100.00 2.53e-141 . . . . 17623 1 3 no PDB 2YH0 . "Solution Structure Of The Closed Conformation Of Human U2af65 Tandem Rrm1 And Rrm2 Domains" . . . . . 100.00 198 100.00 100.00 2.53e-141 . . . . 17623 1 4 no PDB 2YH1 . "Model Of Human U2af65 Tandem Rrm1 And Rrm2 Domains With Eight-Site Uridine Binding" . . . . . 100.00 198 100.00 100.00 2.53e-141 . . . . 17623 1 5 no DBJ BAC37309 . "unnamed protein product [Mus musculus]" . . . . . 98.48 475 100.00 100.00 1.61e-136 . . . . 17623 1 6 no DBJ BAG70075 . "U2 small nuclear RNA auxiliary factor 2 isoform b [Homo sapiens]" . . . . . 98.48 471 99.49 99.49 5.92e-135 . . . . 17623 1 7 no DBJ BAG70201 . "U2 small nuclear RNA auxiliary factor 2 isoform b [Homo sapiens]" . . . . . 98.48 471 99.49 99.49 5.92e-135 . . . . 17623 1 8 no DBJ BAI45669 . "U2 small nuclear RNA auxiliary factor 2 [synthetic construct]" . . . . . 98.48 471 100.00 100.00 1.62e-136 . . . . 17623 1 9 no EMBL CAA45409 . "splicing factor U2AF [Homo sapiens]" . . . . . 98.48 475 100.00 100.00 1.82e-136 . . . . 17623 1 10 no EMBL CAA45874 . "splicing factor U2AF [Mus musculus]" . . . . . 98.48 475 100.00 100.00 1.61e-136 . . . . 17623 1 11 no EMBL CAA45875 . "unnamed protein product [Mus musculus]" . . . . . 98.48 492 100.00 100.00 2.20e-136 . . . . 17623 1 12 no EMBL CAF97922 . "unnamed protein product, partial [Tetraodon nigroviridis]" . . . . . 98.48 458 97.44 99.49 1.47e-134 . . . . 17623 1 13 no GB AAH07487 . "U2 small nuclear ribonucleoprotein auxiliary factor (U2AF) 2 [Mus musculus]" . . . . . 89.39 306 100.00 100.00 4.51e-123 . . . . 17623 1 14 no GB AAH08740 . "U2 small nuclear RNA auxiliary factor 2 [Homo sapiens]" . . . . . 98.48 471 100.00 100.00 1.62e-136 . . . . 17623 1 15 no GB AAH30574 . "U2 small nuclear RNA auxiliary factor 2 [Homo sapiens]" . . . . . 98.48 471 100.00 100.00 1.62e-136 . . . . 17623 1 16 no GB AAH43071 . "U2af2 protein [Mus musculus]" . . . . . 98.48 471 100.00 100.00 1.62e-136 . . . . 17623 1 17 no GB AAH44032 . "U2af2 protein [Xenopus laevis]" . . . . . 98.48 456 100.00 100.00 1.02e-136 . . . . 17623 1 18 no PRF 1805352A . "splicing factor U2AF:SUBUNIT=large" . . . . . 98.48 475 100.00 100.00 1.82e-136 . . . . 17623 1 19 no REF NP_001001217 . "splicing factor U2AF 65 kDa subunit isoform 2 [Xenopus (Silurana) tropicalis]" . . . . . 98.48 456 100.00 100.00 1.69e-136 . . . . 17623 1 20 no REF NP_001012496 . "splicing factor U2AF 65 kDa subunit isoform b [Homo sapiens]" . . . . . 98.48 471 100.00 100.00 1.62e-136 . . . . 17623 1 21 no REF NP_001025127 . "U2 small nuclear RNA auxiliary factor 2a [Danio rerio]" . . . . . 98.48 465 96.92 99.49 2.91e-134 . . . . 17623 1 22 no REF NP_001068804 . "splicing factor U2AF 65 kDa subunit [Bos taurus]" . . . . . 98.48 475 100.00 100.00 1.90e-136 . . . . 17623 1 23 no REF NP_001080595 . "U2 small nuclear RNA auxiliary factor 2 [Xenopus laevis]" . . . . . 98.48 456 100.00 100.00 1.02e-136 . . . . 17623 1 24 no SP P26368 . "RecName: Full=Splicing factor U2AF 65 kDa subunit; AltName: Full=U2 auxiliary factor 65 kDa subunit; Short=hU2AF(65); Short=hU2" . . . . . 98.48 475 100.00 100.00 1.82e-136 . . . . 17623 1 25 no SP P26369 . "RecName: Full=Splicing factor U2AF 65 kDa subunit; AltName: Full=U2 auxiliary factor 65 kDa subunit; AltName: Full=U2 snRNP aux" . . . . . 98.48 475 100.00 100.00 1.61e-136 . . . . 17623 1 26 no TPG DAA19368 . "TPA: U2 (RNU2) small nuclear RNA auxiliary factor 2 [Bos taurus]" . . . . . 98.48 475 100.00 100.00 1.90e-136 . . . . 17623 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 1 145 GLY . 17623 1 2 146 ALA . 17623 1 3 147 MET . 17623 1 4 148 ALA . 17623 1 5 149 ARG . 17623 1 6 150 ARG . 17623 1 7 151 LEU . 17623 1 8 152 TYR . 17623 1 9 153 VAL . 17623 1 10 154 GLY . 17623 1 11 155 ASN . 17623 1 12 156 ILE . 17623 1 13 157 PRO . 17623 1 14 158 PHE . 17623 1 15 159 GLY . 17623 1 16 160 ILE . 17623 1 17 161 THR . 17623 1 18 162 GLU . 17623 1 19 163 GLU . 17623 1 20 164 ALA . 17623 1 21 165 MET . 17623 1 22 166 MET . 17623 1 23 167 ASP . 17623 1 24 168 PHE . 17623 1 25 169 PHE . 17623 1 26 170 ASN . 17623 1 27 171 ALA . 17623 1 28 172 GLN . 17623 1 29 173 MET . 17623 1 30 174 ARG . 17623 1 31 175 LEU . 17623 1 32 176 GLY . 17623 1 33 177 GLY . 17623 1 34 178 LEU . 17623 1 35 179 THR . 17623 1 36 180 GLN . 17623 1 37 181 ALA . 17623 1 38 182 PRO . 17623 1 39 183 GLY . 17623 1 40 184 ASN . 17623 1 41 185 PRO . 17623 1 42 186 VAL . 17623 1 43 187 LEU . 17623 1 44 188 ALA . 17623 1 45 189 VAL . 17623 1 46 190 GLN . 17623 1 47 191 ILE . 17623 1 48 192 ASN . 17623 1 49 193 GLN . 17623 1 50 194 ASP . 17623 1 51 195 LYS . 17623 1 52 196 ASN . 17623 1 53 197 PHE . 17623 1 54 198 ALA . 17623 1 55 199 PHE . 17623 1 56 200 LEU . 17623 1 57 201 GLU . 17623 1 58 202 PHE . 17623 1 59 203 ARG . 17623 1 60 204 SER . 17623 1 61 205 VAL . 17623 1 62 206 ASP . 17623 1 63 207 GLU . 17623 1 64 208 THR . 17623 1 65 209 THR . 17623 1 66 210 GLN . 17623 1 67 211 ALA . 17623 1 68 212 MET . 17623 1 69 213 ALA . 17623 1 70 214 PHE . 17623 1 71 215 ASP . 17623 1 72 216 GLY . 17623 1 73 217 ILE . 17623 1 74 218 ILE . 17623 1 75 219 PHE . 17623 1 76 220 GLN . 17623 1 77 221 GLY . 17623 1 78 222 GLN . 17623 1 79 223 SER . 17623 1 80 224 LEU . 17623 1 81 225 LYS . 17623 1 82 226 ILE . 17623 1 83 227 ARG . 17623 1 84 228 ARG . 17623 1 85 229 PRO . 17623 1 86 230 HIS . 17623 1 87 231 ASP . 17623 1 88 232 TYR . 17623 1 89 233 GLN . 17623 1 90 234 PRO . 17623 1 91 235 LEU . 17623 1 92 236 PRO . 17623 1 93 237 GLY . 17623 1 94 238 MET . 17623 1 95 239 SER . 17623 1 96 240 GLU . 17623 1 97 241 ASN . 17623 1 98 242 PRO . 17623 1 99 243 SER . 17623 1 100 244 VAL . 17623 1 101 245 TYR . 17623 1 102 246 VAL . 17623 1 103 247 PRO . 17623 1 104 248 GLY . 17623 1 105 249 VAL . 17623 1 106 250 VAL . 17623 1 107 251 SER . 17623 1 108 252 THR . 17623 1 109 253 VAL . 17623 1 110 254 VAL . 17623 1 111 255 PRO . 17623 1 112 256 ASP . 17623 1 113 257 SER . 17623 1 114 258 ALA . 17623 1 115 259 HIS . 17623 1 116 260 LYS . 17623 1 117 261 LEU . 17623 1 118 262 PHE . 17623 1 119 263 ILE . 17623 1 120 264 GLY . 17623 1 121 265 GLY . 17623 1 122 266 LEU . 17623 1 123 267 PRO . 17623 1 124 268 ASN . 17623 1 125 269 TYR . 17623 1 126 270 LEU . 17623 1 127 271 ASN . 17623 1 128 272 ASP . 17623 1 129 273 ASP . 17623 1 130 274 GLN . 17623 1 131 275 VAL . 17623 1 132 276 LYS . 17623 1 133 277 GLU . 17623 1 134 278 LEU . 17623 1 135 279 LEU . 17623 1 136 280 THR . 17623 1 137 281 SER . 17623 1 138 282 PHE . 17623 1 139 283 GLY . 17623 1 140 284 PRO . 17623 1 141 285 LEU . 17623 1 142 286 LYS . 17623 1 143 287 ALA . 17623 1 144 288 PHE . 17623 1 145 289 ASN . 17623 1 146 290 LEU . 17623 1 147 291 VAL . 17623 1 148 292 LYS . 17623 1 149 293 ASP . 17623 1 150 294 SER . 17623 1 151 295 ALA . 17623 1 152 296 THR . 17623 1 153 297 GLY . 17623 1 154 298 LEU . 17623 1 155 299 SER . 17623 1 156 300 LYS . 17623 1 157 301 GLY . 17623 1 158 302 TYR . 17623 1 159 303 ALA . 17623 1 160 304 PHE . 17623 1 161 305 CYS . 17623 1 162 306 GLU . 17623 1 163 307 TYR . 17623 1 164 308 VAL . 17623 1 165 309 ASP . 17623 1 166 310 ILE . 17623 1 167 311 ASN . 17623 1 168 312 VAL . 17623 1 169 313 THR . 17623 1 170 314 ASP . 17623 1 171 315 GLN . 17623 1 172 316 ALA . 17623 1 173 317 ILE . 17623 1 174 318 ALA . 17623 1 175 319 GLY . 17623 1 176 320 LEU . 17623 1 177 321 ASN . 17623 1 178 322 GLY . 17623 1 179 323 MET . 17623 1 180 324 GLN . 17623 1 181 325 LEU . 17623 1 182 326 GLY . 17623 1 183 327 ASP . 17623 1 184 328 LYS . 17623 1 185 329 LYS . 17623 1 186 330 LEU . 17623 1 187 331 LEU . 17623 1 188 332 VAL . 17623 1 189 333 GLN . 17623 1 190 334 ARG . 17623 1 191 335 ALA . 17623 1 192 336 SER . 17623 1 193 337 VAL . 17623 1 194 338 GLY . 17623 1 195 339 ALA . 17623 1 196 340 LYS . 17623 1 197 341 ASN . 17623 1 198 342 ALA . 17623 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 17623 1 . ALA 2 2 17623 1 . MET 3 3 17623 1 . ALA 4 4 17623 1 . ARG 5 5 17623 1 . ARG 6 6 17623 1 . LEU 7 7 17623 1 . TYR 8 8 17623 1 . VAL 9 9 17623 1 . GLY 10 10 17623 1 . ASN 11 11 17623 1 . ILE 12 12 17623 1 . PRO 13 13 17623 1 . PHE 14 14 17623 1 . GLY 15 15 17623 1 . ILE 16 16 17623 1 . THR 17 17 17623 1 . GLU 18 18 17623 1 . GLU 19 19 17623 1 . ALA 20 20 17623 1 . MET 21 21 17623 1 . MET 22 22 17623 1 . ASP 23 23 17623 1 . PHE 24 24 17623 1 . PHE 25 25 17623 1 . ASN 26 26 17623 1 . ALA 27 27 17623 1 . GLN 28 28 17623 1 . MET 29 29 17623 1 . ARG 30 30 17623 1 . LEU 31 31 17623 1 . GLY 32 32 17623 1 . GLY 33 33 17623 1 . LEU 34 34 17623 1 . THR 35 35 17623 1 . GLN 36 36 17623 1 . ALA 37 37 17623 1 . PRO 38 38 17623 1 . GLY 39 39 17623 1 . ASN 40 40 17623 1 . PRO 41 41 17623 1 . VAL 42 42 17623 1 . LEU 43 43 17623 1 . ALA 44 44 17623 1 . VAL 45 45 17623 1 . GLN 46 46 17623 1 . ILE 47 47 17623 1 . ASN 48 48 17623 1 . GLN 49 49 17623 1 . ASP 50 50 17623 1 . LYS 51 51 17623 1 . ASN 52 52 17623 1 . PHE 53 53 17623 1 . ALA 54 54 17623 1 . PHE 55 55 17623 1 . LEU 56 56 17623 1 . GLU 57 57 17623 1 . PHE 58 58 17623 1 . ARG 59 59 17623 1 . SER 60 60 17623 1 . VAL 61 61 17623 1 . ASP 62 62 17623 1 . GLU 63 63 17623 1 . THR 64 64 17623 1 . THR 65 65 17623 1 . GLN 66 66 17623 1 . ALA 67 67 17623 1 . MET 68 68 17623 1 . ALA 69 69 17623 1 . PHE 70 70 17623 1 . ASP 71 71 17623 1 . GLY 72 72 17623 1 . ILE 73 73 17623 1 . ILE 74 74 17623 1 . PHE 75 75 17623 1 . GLN 76 76 17623 1 . GLY 77 77 17623 1 . GLN 78 78 17623 1 . SER 79 79 17623 1 . LEU 80 80 17623 1 . LYS 81 81 17623 1 . ILE 82 82 17623 1 . ARG 83 83 17623 1 . ARG 84 84 17623 1 . PRO 85 85 17623 1 . HIS 86 86 17623 1 . ASP 87 87 17623 1 . TYR 88 88 17623 1 . GLN 89 89 17623 1 . PRO 90 90 17623 1 . LEU 91 91 17623 1 . PRO 92 92 17623 1 . GLY 93 93 17623 1 . MET 94 94 17623 1 . SER 95 95 17623 1 . GLU 96 96 17623 1 . ASN 97 97 17623 1 . PRO 98 98 17623 1 . SER 99 99 17623 1 . VAL 100 100 17623 1 . TYR 101 101 17623 1 . VAL 102 102 17623 1 . PRO 103 103 17623 1 . GLY 104 104 17623 1 . VAL 105 105 17623 1 . VAL 106 106 17623 1 . SER 107 107 17623 1 . THR 108 108 17623 1 . VAL 109 109 17623 1 . VAL 110 110 17623 1 . PRO 111 111 17623 1 . ASP 112 112 17623 1 . SER 113 113 17623 1 . ALA 114 114 17623 1 . HIS 115 115 17623 1 . LYS 116 116 17623 1 . LEU 117 117 17623 1 . PHE 118 118 17623 1 . ILE 119 119 17623 1 . GLY 120 120 17623 1 . GLY 121 121 17623 1 . LEU 122 122 17623 1 . PRO 123 123 17623 1 . ASN 124 124 17623 1 . TYR 125 125 17623 1 . LEU 126 126 17623 1 . ASN 127 127 17623 1 . ASP 128 128 17623 1 . ASP 129 129 17623 1 . GLN 130 130 17623 1 . VAL 131 131 17623 1 . LYS 132 132 17623 1 . GLU 133 133 17623 1 . LEU 134 134 17623 1 . LEU 135 135 17623 1 . THR 136 136 17623 1 . SER 137 137 17623 1 . PHE 138 138 17623 1 . GLY 139 139 17623 1 . PRO 140 140 17623 1 . LEU 141 141 17623 1 . LYS 142 142 17623 1 . ALA 143 143 17623 1 . PHE 144 144 17623 1 . ASN 145 145 17623 1 . LEU 146 146 17623 1 . VAL 147 147 17623 1 . LYS 148 148 17623 1 . ASP 149 149 17623 1 . SER 150 150 17623 1 . ALA 151 151 17623 1 . THR 152 152 17623 1 . GLY 153 153 17623 1 . LEU 154 154 17623 1 . SER 155 155 17623 1 . LYS 156 156 17623 1 . GLY 157 157 17623 1 . TYR 158 158 17623 1 . ALA 159 159 17623 1 . PHE 160 160 17623 1 . CYS 161 161 17623 1 . GLU 162 162 17623 1 . TYR 163 163 17623 1 . VAL 164 164 17623 1 . ASP 165 165 17623 1 . ILE 166 166 17623 1 . ASN 167 167 17623 1 . VAL 168 168 17623 1 . THR 169 169 17623 1 . ASP 170 170 17623 1 . GLN 171 171 17623 1 . ALA 172 172 17623 1 . ILE 173 173 17623 1 . ALA 174 174 17623 1 . GLY 175 175 17623 1 . LEU 176 176 17623 1 . ASN 177 177 17623 1 . GLY 178 178 17623 1 . MET 179 179 17623 1 . GLN 180 180 17623 1 . LEU 181 181 17623 1 . GLY 182 182 17623 1 . ASP 183 183 17623 1 . LYS 184 184 17623 1 . LYS 185 185 17623 1 . LEU 186 186 17623 1 . LEU 187 187 17623 1 . VAL 188 188 17623 1 . GLN 189 189 17623 1 . ARG 190 190 17623 1 . ALA 191 191 17623 1 . SER 192 192 17623 1 . VAL 193 193 17623 1 . GLY 194 194 17623 1 . ALA 195 195 17623 1 . LYS 196 196 17623 1 . ASN 197 197 17623 1 . ALA 198 198 17623 1 stop_ save_ save_5'-R(*UP*UP*UP*UP*UP*UP*UP*UP*UP)-3' _Entity.Sf_category entity _Entity.Sf_framecode 5'-R(*UP*UP*UP*UP*UP*UP*UP*UP*UP)-3' _Entity.Entry_ID 17623 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name 5'-R(*UP*UP*UP*UP*UP*UP*UP*UP*UP)-3' _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polyribonucleotide _Entity.Polymer_type_details . _Entity.Polymer_strand_ID B _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code UUUUUUUUU _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 yes _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 9 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID 2 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 2774.53744 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID . yes PDB 2YH1 . 2YH1 . . . . . . . . . . . . . . 17623 2 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 . U . 17623 2 2 . U . 17623 2 3 . U . 17623 2 4 . U . 17623 2 5 . U . 17623 2 6 . U . 17623 2 7 . U . 17623 2 8 . U . 17623 2 9 . U . 17623 2 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . U 1 1 17623 2 . U 2 2 17623 2 . U 3 3 17623 2 . U 4 4 17623 2 . U 5 5 17623 2 . U 6 6 17623 2 . U 7 7 17623 2 . U 8 8 17623 2 . U 9 9 17623 2 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 17623 _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 2 $5'-R(*UP*UP*UP*UP*UP*UP*UP*UP*UP)-3' . 9606 organism . 'Homo sapiens' HUMAN . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 17623 1 2 1 $HUMAN_U2AF65 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 17623 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 17623 _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 2 $5'-R(*UP*UP*UP*UP*UP*UP*UP*UP*UP)-3' . 'chemical synthesis' unknown unknown . . . . . . . . . . . . . . . . . n/a . . . . . . . . . 17623 1 2 1 $HUMAN_U2AF65 . 'recombinant technology' 'Escherichia coli' 'Escherichia coli' . . Escherichia coli BL21 pLysS . . . . . . . . . . . n/a . . . . . . . . . 17623 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 17623 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details 'protein 0.2 mM RNA 0.24 mM' _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% water/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 HUMAN_U2AF65 '[U-13C; U-15N]' . . 1 $HUMAN_U2AF65 . . 0.2 . . mM . . . . 17623 1 2 RNA 'natural abundance' . . 2 $5'-R(*UP*UP*UP*UP*UP*UP*UP*UP*UP)-3' . . 0.24 . . mM . . . . 17623 1 3 H2O 'natural abundance' . . . . . . 90 . . % . . . . 17623 1 4 D2O 'natural abundance' . . . . . . 10 . . % . . . . 17623 1 5 'sodium phosphate' 'natural abundance' . . . . . . 20 . . mM . . . . 17623 1 6 NaCl 'natural abundance' . . . . . . 50 . . mM . . . . 17623 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 17623 _Sample_condition_list.ID 1 _Sample_condition_list.Details 'pH [6.5], temp [295], pressure [1], ionStrength [70.0]' loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 70.000 . mM 17623 1 pH 6.500 . pH 17623 1 pressure 1.000 . atm 17623 1 temperature 295.000 . K 17623 1 stop_ save_ ############################ # Computer software used # ############################ save_AutoDep _Software.Sf_category software _Software.Sf_framecode AutoDep _Software.Entry_ID 17623 _Software.ID 1 _Software.Name AutoDep _Software.Version 4.3 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID PDBe . . 17623 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 17623 1 stop_ save_ save_CNS _Software.Sf_category software _Software.Sf_framecode CNS _Software.Entry_ID 17623 _Software.ID 2 _Software.Name CNS _Software.Version any _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID BRUNGER,ADAMS,CLORE,DELANO,GROS,GROSSE- . . 17623 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 17623 2 stop_ save_ save_SPARKY _Software.Sf_category software _Software.Sf_framecode SPARKY _Software.Entry_ID 17623 _Software.ID 3 _Software.Name SPARKY _Software.Version any _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . 17623 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 17623 3 stop_ save_ save_modified_ARIA _Method.Sf_category method _Method.Sf_framecode modified_ARIA _Method.Entry_ID 17623 _Method.ID 1 _Method.Derivation_type . _Method.Details 'modified ARIA' _Method.Computer_ID . _Method.Computer_label . 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 17623 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _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 17623 _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 . 600 . . . 17623 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 17623 _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 1H no . . . . . . . . . . 1 $sample_1 solution . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17623 1 2 '15N HSQC (PRE)' no . . . . . . . . . . 1 $sample_1 solution . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17623 1 3 '15N TROSY (HN-N RDC)' no . . . . . . . . . . 1 $sample_1 solution . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17623 1 4 '3D HNCO (N-CO RDC)' no . . . . . . . . . . 1 $sample_1 solution . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17623 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 17623 _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 0.0 external indirect 0.25144953 . . . . . . . . . 17623 1 H 1 HDO 'water protons' . . . . ppm 4.8 internal direct 1 . . . . . . . . . 17623 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 external indirect 0.101329118 . . . . . . . . . 17623 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 17623 _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 2 '15N HSQC (PRE)' . . . 17623 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 4 4 ALA H H 1 8.168 0.02 . 1 . . . . 148 ALA H . 17623 1 2 . 1 1 4 4 ALA N N 15 120.008 0.2 . 1 . . . . 148 ALA N . 17623 1 3 . 1 1 5 5 ARG H H 1 7.811 0.02 . 1 . . . . 149 ARG H . 17623 1 4 . 1 1 5 5 ARG N N 15 115.713 0.2 . 1 . . . . 149 ARG N . 17623 1 5 . 1 1 6 6 ARG H H 1 6.834 0.02 . 1 . . . . 150 ARG H . 17623 1 6 . 1 1 6 6 ARG N N 15 117.215 0.2 . 1 . . . . 150 ARG N . 17623 1 7 . 1 1 7 7 LEU H H 1 8.499 0.02 . 1 . . . . 151 LEU H . 17623 1 8 . 1 1 7 7 LEU HB2 H 1 1.409 0.02 . 2 . . . . 151 LEU HB2 . 17623 1 9 . 1 1 7 7 LEU HB3 H 1 1.236 0.02 . 2 . . . . 151 LEU HB3 . 17623 1 10 . 1 1 7 7 LEU CB C 13 46.938 0.2 . 1 . . . . 151 LEU CB . 17623 1 11 . 1 1 7 7 LEU N N 15 114.372 0.2 . 1 . . . . 151 LEU N . 17623 1 12 . 1 1 8 8 TYR H H 1 9.349 0.02 . 1 . . . . 152 TYR H . 17623 1 13 . 1 1 8 8 TYR HD1 H 1 6.205 0.02 . 1 . . . . 152 TYR HD1 . 17623 1 14 . 1 1 8 8 TYR HD2 H 1 6.205 0.02 . 1 . . . . 152 TYR HD2 . 17623 1 15 . 1 1 8 8 TYR HE1 H 1 5.895 0.02 . 1 . . . . 152 TYR HE1 . 17623 1 16 . 1 1 8 8 TYR HE2 H 1 5.895 0.02 . 1 . . . . 152 TYR HE2 . 17623 1 17 . 1 1 8 8 TYR N N 15 123.358 0.2 . 1 . . . . 152 TYR N . 17623 1 18 . 1 1 9 9 VAL H H 1 8.202 0.02 . 1 . . . . 153 VAL H . 17623 1 19 . 1 1 9 9 VAL N N 15 127.090 0.2 . 1 . . . . 153 VAL N . 17623 1 20 . 1 1 10 10 GLY H H 1 9.521 0.02 . 1 . . . . 154 GLY H . 17623 1 21 . 1 1 10 10 GLY N N 15 113.895 0.2 . 1 . . . . 154 GLY N . 17623 1 22 . 1 1 11 11 ASN H H 1 9.403 0.02 . 1 . . . . 155 ASN H . 17623 1 23 . 1 1 11 11 ASN N N 15 123.139 0.2 . 1 . . . . 155 ASN N . 17623 1 24 . 1 1 12 12 ILE H H 1 6.266 0.02 . 1 . . . . 156 ILE H . 17623 1 25 . 1 1 14 14 PHE H H 1 8.470 0.02 . 1 . . . . 158 PHE H . 17623 1 26 . 1 1 14 14 PHE N N 15 123.392 0.2 . 1 . . . . 158 PHE N . 17623 1 27 . 1 1 15 15 GLY H H 1 8.075 0.02 . 1 . . . . 159 GLY H . 17623 1 28 . 1 1 15 15 GLY HA2 H 1 3.676 0.02 . 2 . . . . 159 GLY HA2 . 17623 1 29 . 1 1 15 15 GLY HA3 H 1 3.240 0.02 . 2 . . . . 159 GLY HA3 . 17623 1 30 . 1 1 15 15 GLY CA C 13 45.277 0.2 . 1 . . . . 159 GLY CA . 17623 1 31 . 1 1 15 15 GLY N N 15 114.530 0.2 . 1 . . . . 159 GLY N . 17623 1 32 . 1 1 16 16 ILE H H 1 6.934 0.02 . 1 . . . . 160 ILE H . 17623 1 33 . 1 1 16 16 ILE HA H 1 4.186 0.02 . 1 . . . . 160 ILE HA . 17623 1 34 . 1 1 16 16 ILE HB H 1 1.648 0.02 . 1 . . . . 160 ILE HB . 17623 1 35 . 1 1 16 16 ILE HG12 H 1 1.508 0.02 . 2 . . . . 160 ILE HG12 . 17623 1 36 . 1 1 16 16 ILE HG13 H 1 1.228 0.02 . 2 . . . . 160 ILE HG13 . 17623 1 37 . 1 1 16 16 ILE HG21 H 1 0.724 0.02 . 1 . . . . 160 ILE HG2 . 17623 1 38 . 1 1 16 16 ILE HG22 H 1 0.724 0.02 . 1 . . . . 160 ILE HG2 . 17623 1 39 . 1 1 16 16 ILE HG23 H 1 0.724 0.02 . 1 . . . . 160 ILE HG2 . 17623 1 40 . 1 1 16 16 ILE HD11 H 1 0.717 0.02 . 1 . . . . 160 ILE HD1 . 17623 1 41 . 1 1 16 16 ILE HD12 H 1 0.717 0.02 . 1 . . . . 160 ILE HD1 . 17623 1 42 . 1 1 16 16 ILE HD13 H 1 0.717 0.02 . 1 . . . . 160 ILE HD1 . 17623 1 43 . 1 1 16 16 ILE CA C 13 58.354 0.2 . 1 . . . . 160 ILE CA . 17623 1 44 . 1 1 16 16 ILE CB C 13 39.068 0.2 . 1 . . . . 160 ILE CB . 17623 1 45 . 1 1 16 16 ILE CG1 C 13 28.419 0.2 . 1 . . . . 160 ILE CG1 . 17623 1 46 . 1 1 16 16 ILE CG2 C 13 19.376 0.2 . 1 . . . . 160 ILE CG2 . 17623 1 47 . 1 1 16 16 ILE CD1 C 13 14.492 0.2 . 1 . . . . 160 ILE CD1 . 17623 1 48 . 1 1 16 16 ILE N N 15 119.791 0.2 . 1 . . . . 160 ILE N . 17623 1 49 . 1 1 17 17 THR H H 1 7.071 0.02 . 1 . . . . 161 THR H . 17623 1 50 . 1 1 17 17 THR HA H 1 4.468 0.02 . 1 . . . . 161 THR HA . 17623 1 51 . 1 1 17 17 THR HB H 1 4.649 0.02 . 1 . . . . 161 THR HB . 17623 1 52 . 1 1 17 17 THR HG21 H 1 1.209 0.02 . 1 . . . . 161 THR HG2 . 17623 1 53 . 1 1 17 17 THR HG22 H 1 1.209 0.02 . 1 . . . . 161 THR HG2 . 17623 1 54 . 1 1 17 17 THR HG23 H 1 1.209 0.02 . 1 . . . . 161 THR HG2 . 17623 1 55 . 1 1 17 17 THR CA C 13 59.454 0.2 . 1 . . . . 161 THR CA . 17623 1 56 . 1 1 17 17 THR CB C 13 71.887 0.2 . 1 . . . . 161 THR CB . 17623 1 57 . 1 1 17 17 THR CG2 C 13 21.896 0.2 . 1 . . . . 161 THR CG2 . 17623 1 58 . 1 1 17 17 THR N N 15 112.165 0.2 . 1 . . . . 161 THR N . 17623 1 59 . 1 1 18 18 GLU H H 1 9.160 0.02 . 1 . . . . 162 GLU H . 17623 1 60 . 1 1 18 18 GLU HA H 1 3.488 0.02 . 1 . . . . 162 GLU HA . 17623 1 61 . 1 1 18 18 GLU HB2 H 1 1.980 0.02 . 2 . . . . 162 GLU HB2 . 17623 1 62 . 1 1 18 18 GLU HB3 H 1 1.871 0.02 . 2 . . . . 162 GLU HB3 . 17623 1 63 . 1 1 18 18 GLU HG2 H 1 2.270 0.02 . 2 . . . . 162 GLU HG2 . 17623 1 64 . 1 1 18 18 GLU HG3 H 1 2.213 0.02 . 2 . . . . 162 GLU HG3 . 17623 1 65 . 1 1 18 18 GLU CA C 13 60.582 0.2 . 1 . . . . 162 GLU CA . 17623 1 66 . 1 1 18 18 GLU CB C 13 28.565 0.2 . 1 . . . . 162 GLU CB . 17623 1 67 . 1 1 18 18 GLU CG C 13 37.392 0.2 . 1 . . . . 162 GLU CG . 17623 1 68 . 1 1 18 18 GLU N N 15 121.753 0.2 . 1 . . . . 162 GLU N . 17623 1 69 . 1 1 19 19 GLU H H 1 8.747 0.02 . 1 . . . . 163 GLU H . 17623 1 70 . 1 1 19 19 GLU HA H 1 3.816 0.02 . 1 . . . . 163 GLU HA . 17623 1 71 . 1 1 19 19 GLU HB2 H 1 1.986 0.02 . 2 . . . . 163 GLU HB2 . 17623 1 72 . 1 1 19 19 GLU HB3 H 1 1.855 0.02 . 2 . . . . 163 GLU HB3 . 17623 1 73 . 1 1 19 19 GLU HG2 H 1 2.268 0.02 . 2 . . . . 163 GLU HG2 . 17623 1 74 . 1 1 19 19 GLU HG3 H 1 2.206 0.02 . 2 . . . . 163 GLU HG3 . 17623 1 75 . 1 1 19 19 GLU CA C 13 59.983 0.2 . 1 . . . . 163 GLU CA . 17623 1 76 . 1 1 19 19 GLU CB C 13 28.585 0.2 . 1 . . . . 163 GLU CB . 17623 1 77 . 1 1 19 19 GLU CG C 13 36.481 0.2 . 1 . . . . 163 GLU CG . 17623 1 78 . 1 1 19 19 GLU N N 15 118.020 0.2 . 1 . . . . 163 GLU N . 17623 1 79 . 1 1 20 20 ALA H H 1 7.760 0.02 . 1 . . . . 164 ALA H . 17623 1 80 . 1 1 20 20 ALA HA H 1 4.186 0.02 . 1 . . . . 164 ALA HA . 17623 1 81 . 1 1 20 20 ALA HB1 H 1 1.468 0.02 . 1 . . . . 164 ALA HB . 17623 1 82 . 1 1 20 20 ALA HB2 H 1 1.468 0.02 . 1 . . . . 164 ALA HB . 17623 1 83 . 1 1 20 20 ALA HB3 H 1 1.468 0.02 . 1 . . . . 164 ALA HB . 17623 1 84 . 1 1 20 20 ALA CA C 13 55.026 0.2 . 1 . . . . 164 ALA CA . 17623 1 85 . 1 1 20 20 ALA CB C 13 18.696 0.2 . 1 . . . . 164 ALA CB . 17623 1 86 . 1 1 20 20 ALA N N 15 120.834 0.2 . 1 . . . . 164 ALA N . 17623 1 87 . 1 1 21 21 MET H H 1 7.876 0.02 . 1 . . . . 165 MET H . 17623 1 88 . 1 1 21 21 MET HA H 1 4.095 0.02 . 1 . . . . 165 MET HA . 17623 1 89 . 1 1 21 21 MET HE1 H 1 1.723 0.02 . 1 . . . . 165 MET HE . 17623 1 90 . 1 1 21 21 MET HE2 H 1 1.723 0.02 . 1 . . . . 165 MET HE . 17623 1 91 . 1 1 21 21 MET HE3 H 1 1.723 0.02 . 1 . . . . 165 MET HE . 17623 1 92 . 1 1 21 21 MET CA C 13 58.647 0.2 . 1 . . . . 165 MET CA . 17623 1 93 . 1 1 21 21 MET CE C 13 17.755 0.2 . 1 . . . . 165 MET CE . 17623 1 94 . 1 1 21 21 MET N N 15 117.536 0.2 . 1 . . . . 165 MET N . 17623 1 95 . 1 1 22 22 MET H H 1 8.550 0.02 . 1 . . . . 166 MET H . 17623 1 96 . 1 1 22 22 MET HA H 1 3.512 0.02 . 1 . . . . 166 MET HA . 17623 1 97 . 1 1 22 22 MET HB2 H 1 2.087 0.02 . 2 . . . . 166 MET HB2 . 17623 1 98 . 1 1 22 22 MET HB3 H 1 1.966 0.02 . 2 . . . . 166 MET HB3 . 17623 1 99 . 1 1 22 22 MET HG2 H 1 2.199 0.02 . 2 . . . . 166 MET HG2 . 17623 1 100 . 1 1 22 22 MET HG3 H 1 2.148 0.02 . 2 . . . . 166 MET HG3 . 17623 1 101 . 1 1 22 22 MET HE1 H 1 1.868 0.02 . 1 . . . . 166 MET HE . 17623 1 102 . 1 1 22 22 MET HE2 H 1 1.868 0.02 . 1 . . . . 166 MET HE . 17623 1 103 . 1 1 22 22 MET HE3 H 1 1.868 0.02 . 1 . . . . 166 MET HE . 17623 1 104 . 1 1 22 22 MET CA C 13 60.461 0.2 . 1 . . . . 166 MET CA . 17623 1 105 . 1 1 22 22 MET CB C 13 33.633 0.2 . 1 . . . . 166 MET CB . 17623 1 106 . 1 1 22 22 MET CG C 13 31.691 0.2 . 1 . . . . 166 MET CG . 17623 1 107 . 1 1 22 22 MET CE C 13 16.598 0.2 . 1 . . . . 166 MET CE . 17623 1 108 . 1 1 22 22 MET N N 15 120.309 0.2 . 1 . . . . 166 MET N . 17623 1 109 . 1 1 23 23 ASP H H 1 8.613 0.02 . 1 . . . . 167 ASP H . 17623 1 110 . 1 1 23 23 ASP HA H 1 4.277 0.02 . 1 . . . . 167 ASP HA . 17623 1 111 . 1 1 23 23 ASP HB2 H 1 2.725 0.02 . 2 . . . . 167 ASP HB2 . 17623 1 112 . 1 1 23 23 ASP HB3 H 1 2.604 0.02 . 2 . . . . 167 ASP HB3 . 17623 1 113 . 1 1 23 23 ASP CA C 13 57.283 0.2 . 1 . . . . 167 ASP CA . 17623 1 114 . 1 1 23 23 ASP CB C 13 40.328 0.2 . 1 . . . . 167 ASP CB . 17623 1 115 . 1 1 23 23 ASP N N 15 118.406 0.2 . 1 . . . . 167 ASP N . 17623 1 116 . 1 1 24 24 PHE H H 1 7.667 0.02 . 1 . . . . 168 PHE H . 17623 1 117 . 1 1 24 24 PHE HA H 1 4.332 0.02 . 1 . . . . 168 PHE HA . 17623 1 118 . 1 1 24 24 PHE HB2 H 1 2.996 0.02 . 2 . . . . 168 PHE HB2 . 17623 1 119 . 1 1 24 24 PHE HB3 H 1 2.489 0.02 . 2 . . . . 168 PHE HB3 . 17623 1 120 . 1 1 24 24 PHE HD1 H 1 6.372 0.02 . 1 . . . . 168 PHE HD1 . 17623 1 121 . 1 1 24 24 PHE HD2 H 1 6.372 0.02 . 1 . . . . 168 PHE HD2 . 17623 1 122 . 1 1 24 24 PHE HE1 H 1 6.595 0.02 . 1 . . . . 168 PHE HE1 . 17623 1 123 . 1 1 24 24 PHE HE2 H 1 6.595 0.02 . 1 . . . . 168 PHE HE2 . 17623 1 124 . 1 1 24 24 PHE HZ H 1 6.780 0.02 . 1 . . . . 168 PHE HZ . 17623 1 125 . 1 1 24 24 PHE CA C 13 61.176 0.2 . 1 . . . . 168 PHE CA . 17623 1 126 . 1 1 24 24 PHE CB C 13 39.387 0.2 . 1 . . . . 168 PHE CB . 17623 1 127 . 1 1 24 24 PHE N N 15 119.510 0.2 . 1 . . . . 168 PHE N . 17623 1 128 . 1 1 25 25 PHE H H 1 8.032 0.02 . 1 . . . . 169 PHE H . 17623 1 129 . 1 1 25 25 PHE HA H 1 3.313 0.02 . 1 . . . . 169 PHE HA . 17623 1 130 . 1 1 25 25 PHE HB2 H 1 2.694 0.02 . 2 . . . . 169 PHE HB2 . 17623 1 131 . 1 1 25 25 PHE HB3 H 1 2.601 0.02 . 2 . . . . 169 PHE HB3 . 17623 1 132 . 1 1 25 25 PHE HD1 H 1 7.092 0.02 . 1 . . . . 169 PHE HD1 . 17623 1 133 . 1 1 25 25 PHE HD2 H 1 7.092 0.02 . 1 . . . . 169 PHE HD2 . 17623 1 134 . 1 1 25 25 PHE CA C 13 63.979 0.2 . 1 . . . . 169 PHE CA . 17623 1 135 . 1 1 25 25 PHE CB C 13 39.851 0.2 . 1 . . . . 169 PHE CB . 17623 1 136 . 1 1 25 25 PHE N N 15 116.891 0.2 . 1 . . . . 169 PHE N . 17623 1 137 . 1 1 26 26 ASN H H 1 8.670 0.02 . 1 . . . . 170 ASN H . 17623 1 138 . 1 1 26 26 ASN HA H 1 4.459 0.02 . 1 . . . . 170 ASN HA . 17623 1 139 . 1 1 26 26 ASN HB2 H 1 2.759 0.02 . 2 . . . . 170 ASN HB2 . 17623 1 140 . 1 1 26 26 ASN HB3 H 1 2.497 0.02 . 2 . . . . 170 ASN HB3 . 17623 1 141 . 1 1 26 26 ASN HD21 H 1 6.463 0.02 . 2 . . . . 170 ASN HD21 . 17623 1 142 . 1 1 26 26 ASN HD22 H 1 7.732 0.02 . 2 . . . . 170 ASN HD22 . 17623 1 143 . 1 1 26 26 ASN CA C 13 57.086 0.2 . 1 . . . . 170 ASN CA . 17623 1 144 . 1 1 26 26 ASN CB C 13 37.223 0.2 . 1 . . . . 170 ASN CB . 17623 1 145 . 1 1 26 26 ASN N N 15 117.439 0.2 . 1 . . . . 170 ASN N . 17623 1 146 . 1 1 26 26 ASN ND2 N 15 112.069 0.2 . 1 . . . . 170 ASN ND2 . 17623 1 147 . 1 1 27 27 ALA HA H 1 4.008 0.02 . 1 . . . . 171 ALA HA . 17623 1 148 . 1 1 27 27 ALA HB1 H 1 1.346 0.02 . 1 . . . . 171 ALA HB . 17623 1 149 . 1 1 27 27 ALA HB2 H 1 1.346 0.02 . 1 . . . . 171 ALA HB . 17623 1 150 . 1 1 27 27 ALA HB3 H 1 1.346 0.02 . 1 . . . . 171 ALA HB . 17623 1 151 . 1 1 27 27 ALA CA C 13 55.185 0.2 . 1 . . . . 171 ALA CA . 17623 1 152 . 1 1 27 27 ALA CB C 13 17.694 0.2 . 1 . . . . 171 ALA CB . 17623 1 153 . 1 1 27 27 ALA N N 15 121.470 0.2 . 1 . . . . 171 ALA N . 17623 1 154 . 1 1 28 28 GLN H H 1 8.066 0.02 . 1 . . . . 172 GLN H . 17623 1 155 . 1 1 28 28 GLN HA H 1 3.545 0.02 . 1 . . . . 172 GLN HA . 17623 1 156 . 1 1 28 28 GLN HB2 H 1 1.208 0.02 . 2 . . . . 172 GLN HB2 . 17623 1 157 . 1 1 28 28 GLN HB3 H 1 0.876 0.02 . 2 . . . . 172 GLN HB3 . 17623 1 158 . 1 1 28 28 GLN HG2 H 1 1.274 0.02 . 2 . . . . 172 GLN HG2 . 17623 1 159 . 1 1 28 28 GLN HG3 H 1 0.603 0.02 . 2 . . . . 172 GLN HG3 . 17623 1 160 . 1 1 28 28 GLN HE21 H 1 6.425 0.02 . 2 . . . . 172 GLN HE21 . 17623 1 161 . 1 1 28 28 GLN CA C 13 57.914 0.2 . 1 . . . . 172 GLN CA . 17623 1 162 . 1 1 28 28 GLN CB C 13 27.033 0.2 . 1 . . . . 172 GLN CB . 17623 1 163 . 1 1 28 28 GLN CG C 13 32.489 0.2 . 1 . . . . 172 GLN CG . 17623 1 164 . 1 1 28 28 GLN N N 15 116.007 0.2 . 1 . . . . 172 GLN N . 17623 1 165 . 1 1 28 28 GLN NE2 N 15 113.510 0.2 . 1 . . . . 172 GLN NE2 . 17623 1 166 . 1 1 29 29 MET H H 1 8.285 0.02 . 1 . . . . 173 MET H . 17623 1 167 . 1 1 29 29 MET HE1 H 1 1.961 0.02 . 1 . . . . 173 MET HE . 17623 1 168 . 1 1 29 29 MET HE2 H 1 1.961 0.02 . 1 . . . . 173 MET HE . 17623 1 169 . 1 1 29 29 MET HE3 H 1 1.961 0.02 . 1 . . . . 173 MET HE . 17623 1 170 . 1 1 29 29 MET CE C 13 17.342 0.2 . 1 . . . . 173 MET CE . 17623 1 171 . 1 1 29 29 MET N N 15 117.858 0.2 . 1 . . . . 173 MET N . 17623 1 172 . 1 1 30 30 ARG H H 1 7.561 0.02 . 1 . . . . 174 ARG H . 17623 1 173 . 1 1 30 30 ARG HA H 1 4.112 0.02 . 1 . . . . 174 ARG HA . 17623 1 174 . 1 1 30 30 ARG HB2 H 1 1.908 0.02 . 2 . . . . 174 ARG HB2 . 17623 1 175 . 1 1 30 30 ARG HB3 H 1 1.898 0.02 . 2 . . . . 174 ARG HB3 . 17623 1 176 . 1 1 30 30 ARG HG2 H 1 1.741 0.02 . 2 . . . . 174 ARG HG2 . 17623 1 177 . 1 1 30 30 ARG HG3 H 1 1.546 0.02 . 2 . . . . 174 ARG HG3 . 17623 1 178 . 1 1 30 30 ARG HD2 H 1 3.172 0.02 . 2 . . . . 174 ARG HD2 . 17623 1 179 . 1 1 30 30 ARG HD3 H 1 3.172 0.02 . 2 . . . . 174 ARG HD3 . 17623 1 180 . 1 1 30 30 ARG CA C 13 59.542 0.2 . 1 . . . . 174 ARG CA . 17623 1 181 . 1 1 30 30 ARG CB C 13 30.038 0.2 . 1 . . . . 174 ARG CB . 17623 1 182 . 1 1 30 30 ARG CG C 13 27.785 0.2 . 1 . . . . 174 ARG CG . 17623 1 183 . 1 1 30 30 ARG CD C 13 42.990 0.2 . 1 . . . . 174 ARG CD . 17623 1 184 . 1 1 30 30 ARG N N 15 119.179 0.2 . 1 . . . . 174 ARG N . 17623 1 185 . 1 1 31 31 LEU H H 1 8.636 0.02 . 1 . . . . 175 LEU H . 17623 1 186 . 1 1 31 31 LEU N N 15 122.016 0.2 . 1 . . . . 175 LEU N . 17623 1 187 . 1 1 32 32 GLY H H 1 7.918 0.02 . 1 . . . . 176 GLY H . 17623 1 188 . 1 1 32 32 GLY HA2 H 1 4.205 0.02 . 2 . . . . 176 GLY HA2 . 17623 1 189 . 1 1 32 32 GLY HA3 H 1 3.464 0.02 . 2 . . . . 176 GLY HA3 . 17623 1 190 . 1 1 32 32 GLY CA C 13 44.905 0.2 . 1 . . . . 176 GLY CA . 17623 1 191 . 1 1 32 32 GLY N N 15 103.323 0.2 . 1 . . . . 176 GLY N . 17623 1 192 . 1 1 33 33 GLY H H 1 7.605 0.02 . 1 . . . . 177 GLY H . 17623 1 193 . 1 1 33 33 GLY HA2 H 1 3.937 0.02 . 2 . . . . 177 GLY HA2 . 17623 1 194 . 1 1 33 33 GLY HA3 H 1 3.937 0.02 . 2 . . . . 177 GLY HA3 . 17623 1 195 . 1 1 33 33 GLY CA C 13 46.239 0.2 . 1 . . . . 177 GLY CA . 17623 1 196 . 1 1 33 33 GLY N N 15 107.745 0.2 . 1 . . . . 177 GLY N . 17623 1 197 . 1 1 34 34 LEU H H 1 8.064 0.02 . 1 . . . . 178 LEU H . 17623 1 198 . 1 1 34 34 LEU HA H 1 4.261 0.02 . 1 . . . . 178 LEU HA . 17623 1 199 . 1 1 34 34 LEU HB2 H 1 1.711 0.02 . 2 . . . . 178 LEU HB2 . 17623 1 200 . 1 1 34 34 LEU HB3 H 1 1.435 0.02 . 2 . . . . 178 LEU HB3 . 17623 1 201 . 1 1 34 34 LEU HG H 1 1.377 0.02 . 1 . . . . 178 LEU HG . 17623 1 202 . 1 1 34 34 LEU HD11 H 1 0.585 0.02 . 4 . . . . 178 LEU HD1 . 17623 1 203 . 1 1 34 34 LEU HD12 H 1 0.585 0.02 . 4 . . . . 178 LEU HD1 . 17623 1 204 . 1 1 34 34 LEU HD13 H 1 0.585 0.02 . 4 . . . . 178 LEU HD1 . 17623 1 205 . 1 1 34 34 LEU HD21 H 1 0.639 0.02 . 4 . . . . 178 LEU HD2 . 17623 1 206 . 1 1 34 34 LEU HD22 H 1 0.639 0.02 . 4 . . . . 178 LEU HD2 . 17623 1 207 . 1 1 34 34 LEU HD23 H 1 0.639 0.02 . 4 . . . . 178 LEU HD2 . 17623 1 208 . 1 1 34 34 LEU CA C 13 55.169 0.2 . 1 . . . . 178 LEU CA . 17623 1 209 . 1 1 34 34 LEU CB C 13 42.854 0.2 . 1 . . . . 178 LEU CB . 17623 1 210 . 1 1 34 34 LEU CG C 13 27.311 0.2 . 1 . . . . 178 LEU CG . 17623 1 211 . 1 1 34 34 LEU CD1 C 13 22.527 0.2 . 2 . . . . 178 LEU CD1 . 17623 1 212 . 1 1 34 34 LEU CD2 C 13 25.756 0.2 . 2 . . . . 178 LEU CD2 . 17623 1 213 . 1 1 34 34 LEU N N 15 117.511 0.2 . 1 . . . . 178 LEU N . 17623 1 214 . 1 1 35 35 THR H H 1 7.246 0.02 . 1 . . . . 179 THR H . 17623 1 215 . 1 1 35 35 THR HA H 1 4.428 0.02 . 1 . . . . 179 THR HA . 17623 1 216 . 1 1 35 35 THR HB H 1 4.074 0.02 . 1 . . . . 179 THR HB . 17623 1 217 . 1 1 35 35 THR HG21 H 1 1.109 0.02 . 1 . . . . 179 THR HG2 . 17623 1 218 . 1 1 35 35 THR HG22 H 1 1.109 0.02 . 1 . . . . 179 THR HG2 . 17623 1 219 . 1 1 35 35 THR HG23 H 1 1.109 0.02 . 1 . . . . 179 THR HG2 . 17623 1 220 . 1 1 35 35 THR CA C 13 60.902 0.2 . 1 . . . . 179 THR CA . 17623 1 221 . 1 1 35 35 THR CB C 13 69.572 0.2 . 1 . . . . 179 THR CB . 17623 1 222 . 1 1 35 35 THR CG2 C 13 22.765 0.2 . 1 . . . . 179 THR CG2 . 17623 1 223 . 1 1 35 35 THR N N 15 108.522 0.2 . 1 . . . . 179 THR N . 17623 1 224 . 1 1 36 36 GLN H H 1 9.171 0.02 . 1 . . . . 180 GLN H . 17623 1 225 . 1 1 36 36 GLN HA H 1 4.333 0.02 . 1 . . . . 180 GLN HA . 17623 1 226 . 1 1 36 36 GLN HB2 H 1 2.142 0.02 . 2 . . . . 180 GLN HB2 . 17623 1 227 . 1 1 36 36 GLN HB3 H 1 1.713 0.02 . 2 . . . . 180 GLN HB3 . 17623 1 228 . 1 1 36 36 GLN HG2 H 1 2.232 0.02 . 2 . . . . 180 GLN HG2 . 17623 1 229 . 1 1 36 36 GLN HG3 H 1 2.232 0.02 . 2 . . . . 180 GLN HG3 . 17623 1 230 . 1 1 36 36 GLN HE21 H 1 6.879 0.02 . 2 . . . . 180 GLN HE21 . 17623 1 231 . 1 1 36 36 GLN HE22 H 1 7.347 0.02 . 2 . . . . 180 GLN HE22 . 17623 1 232 . 1 1 36 36 GLN CA C 13 55.054 0.2 . 1 . . . . 180 GLN CA . 17623 1 233 . 1 1 36 36 GLN CB C 13 29.782 0.2 . 1 . . . . 180 GLN CB . 17623 1 234 . 1 1 36 36 GLN CG C 13 33.804 0.2 . 1 . . . . 180 GLN CG . 17623 1 235 . 1 1 36 36 GLN N N 15 122.652 0.2 . 1 . . . . 180 GLN N . 17623 1 236 . 1 1 36 36 GLN NE2 N 15 111.936 0.2 . 1 . . . . 180 GLN NE2 . 17623 1 237 . 1 1 37 37 ALA H H 1 7.522 0.02 . 1 . . . . 181 ALA H . 17623 1 238 . 1 1 37 37 ALA HA H 1 4.571 0.02 . 1 . . . . 181 ALA HA . 17623 1 239 . 1 1 37 37 ALA HB1 H 1 1.253 0.02 . 1 . . . . 181 ALA HB . 17623 1 240 . 1 1 37 37 ALA HB2 H 1 1.253 0.02 . 1 . . . . 181 ALA HB . 17623 1 241 . 1 1 37 37 ALA HB3 H 1 1.253 0.02 . 1 . . . . 181 ALA HB . 17623 1 242 . 1 1 37 37 ALA CA C 13 50.511 0.2 . 1 . . . . 181 ALA CA . 17623 1 243 . 1 1 37 37 ALA CB C 13 18.922 0.2 . 1 . . . . 181 ALA CB . 17623 1 244 . 1 1 37 37 ALA N N 15 122.359 0.2 . 1 . . . . 181 ALA N . 17623 1 245 . 1 1 39 39 GLY H H 1 8.604 0.02 . 1 . . . . 183 GLY H . 17623 1 246 . 1 1 39 39 GLY HA2 H 1 4.239 0.02 . 2 . . . . 183 GLY HA2 . 17623 1 247 . 1 1 39 39 GLY HA3 H 1 3.583 0.02 . 2 . . . . 183 GLY HA3 . 17623 1 248 . 1 1 39 39 GLY CA C 13 43.833 0.2 . 1 . . . . 183 GLY CA . 17623 1 249 . 1 1 39 39 GLY N N 15 111.584 0.2 . 1 . . . . 183 GLY N . 17623 1 250 . 1 1 40 40 ASN H H 1 8.218 0.02 . 1 . . . . 184 ASN H . 17623 1 251 . 1 1 40 40 ASN HA H 1 4.890 0.02 . 1 . . . . 184 ASN HA . 17623 1 252 . 1 1 40 40 ASN HB2 H 1 2.583 0.02 . 2 . . . . 184 ASN HB2 . 17623 1 253 . 1 1 40 40 ASN HB3 H 1 2.528 0.02 . 2 . . . . 184 ASN HB3 . 17623 1 254 . 1 1 40 40 ASN HD21 H 1 6.894 0.02 . 2 . . . . 184 ASN HD21 . 17623 1 255 . 1 1 40 40 ASN HD22 H 1 7.551 0.02 . 2 . . . . 184 ASN HD22 . 17623 1 256 . 1 1 40 40 ASN CA C 13 50.189 0.2 . 1 . . . . 184 ASN CA . 17623 1 257 . 1 1 40 40 ASN CB C 13 38.743 0.2 . 1 . . . . 184 ASN CB . 17623 1 258 . 1 1 40 40 ASN N N 15 117.814 0.2 . 1 . . . . 184 ASN N . 17623 1 259 . 1 1 40 40 ASN ND2 N 15 113.208 0.2 . 1 . . . . 184 ASN ND2 . 17623 1 260 . 1 1 41 41 PRO HA H 1 4.320 0.02 . 1 . . . . 185 PRO HA . 17623 1 261 . 1 1 41 41 PRO HB2 H 1 2.359 0.02 . 2 . . . . 185 PRO HB2 . 17623 1 262 . 1 1 41 41 PRO HB3 H 1 1.954 0.02 . 2 . . . . 185 PRO HB3 . 17623 1 263 . 1 1 41 41 PRO HG2 H 1 2.181 0.02 . 2 . . . . 185 PRO HG2 . 17623 1 264 . 1 1 41 41 PRO HG3 H 1 1.999 0.02 . 2 . . . . 185 PRO HG3 . 17623 1 265 . 1 1 41 41 PRO HD2 H 1 4.154 0.02 . 2 . . . . 185 PRO HD2 . 17623 1 266 . 1 1 41 41 PRO HD3 H 1 3.920 0.02 . 2 . . . . 185 PRO HD3 . 17623 1 267 . 1 1 41 41 PRO CA C 13 63.642 0.2 . 1 . . . . 185 PRO CA . 17623 1 268 . 1 1 41 41 PRO CB C 13 33.003 0.2 . 1 . . . . 185 PRO CB . 17623 1 269 . 1 1 41 41 PRO CG C 13 28.104 0.2 . 1 . . . . 185 PRO CG . 17623 1 270 . 1 1 41 41 PRO CD C 13 51.107 0.2 . 1 . . . . 185 PRO CD . 17623 1 271 . 1 1 42 42 VAL H H 1 8.810 0.02 . 1 . . . . 186 VAL H . 17623 1 272 . 1 1 42 42 VAL HA H 1 3.528 0.02 . 1 . . . . 186 VAL HA . 17623 1 273 . 1 1 42 42 VAL HB H 1 1.789 0.02 . 1 . . . . 186 VAL HB . 17623 1 274 . 1 1 42 42 VAL HG11 H 1 0.236 0.02 . 4 . . . . 186 VAL HG1 . 17623 1 275 . 1 1 42 42 VAL HG12 H 1 0.236 0.02 . 4 . . . . 186 VAL HG1 . 17623 1 276 . 1 1 42 42 VAL HG13 H 1 0.236 0.02 . 4 . . . . 186 VAL HG1 . 17623 1 277 . 1 1 42 42 VAL HG21 H 1 0.378 0.02 . 4 . . . . 186 VAL HG2 . 17623 1 278 . 1 1 42 42 VAL HG22 H 1 0.378 0.02 . 4 . . . . 186 VAL HG2 . 17623 1 279 . 1 1 42 42 VAL HG23 H 1 0.378 0.02 . 4 . . . . 186 VAL HG2 . 17623 1 280 . 1 1 42 42 VAL CA C 13 63.076 0.2 . 1 . . . . 186 VAL CA . 17623 1 281 . 1 1 42 42 VAL CB C 13 30.485 0.2 . 1 . . . . 186 VAL CB . 17623 1 282 . 1 1 42 42 VAL CG1 C 13 22.504 0.2 . 2 . . . . 186 VAL CG1 . 17623 1 283 . 1 1 42 42 VAL CG2 C 13 23.053 0.2 . 2 . . . . 186 VAL CG2 . 17623 1 284 . 1 1 42 42 VAL N N 15 118.303 0.2 . 1 . . . . 186 VAL N . 17623 1 285 . 1 1 43 43 LEU H H 1 8.833 0.02 . 1 . . . . 187 LEU H . 17623 1 286 . 1 1 43 43 LEU HA H 1 4.181 0.02 . 1 . . . . 187 LEU HA . 17623 1 287 . 1 1 43 43 LEU HB2 H 1 1.353 0.02 . 2 . . . . 187 LEU HB2 . 17623 1 288 . 1 1 43 43 LEU HB3 H 1 1.307 0.02 . 2 . . . . 187 LEU HB3 . 17623 1 289 . 1 1 43 43 LEU HG H 1 1.334 0.02 . 1 . . . . 187 LEU HG . 17623 1 290 . 1 1 43 43 LEU HD11 H 1 0.739 0.02 . 4 . . . . 187 LEU HD1 . 17623 1 291 . 1 1 43 43 LEU HD12 H 1 0.739 0.02 . 4 . . . . 187 LEU HD1 . 17623 1 292 . 1 1 43 43 LEU HD13 H 1 0.739 0.02 . 4 . . . . 187 LEU HD1 . 17623 1 293 . 1 1 43 43 LEU HD21 H 1 0.727 0.02 . 4 . . . . 187 LEU HD2 . 17623 1 294 . 1 1 43 43 LEU HD22 H 1 0.727 0.02 . 4 . . . . 187 LEU HD2 . 17623 1 295 . 1 1 43 43 LEU HD23 H 1 0.727 0.02 . 4 . . . . 187 LEU HD2 . 17623 1 296 . 1 1 43 43 LEU CA C 13 54.994 0.2 . 1 . . . . 187 LEU CA . 17623 1 297 . 1 1 43 43 LEU CB C 13 44.066 0.2 . 1 . . . . 187 LEU CB . 17623 1 298 . 1 1 43 43 LEU CG C 13 26.611 0.2 . 1 . . . . 187 LEU CG . 17623 1 299 . 1 1 43 43 LEU CD1 C 13 22.846 0.2 . 2 . . . . 187 LEU CD1 . 17623 1 300 . 1 1 43 43 LEU CD2 C 13 25.589 0.2 . 2 . . . . 187 LEU CD2 . 17623 1 301 . 1 1 43 43 LEU N N 15 125.618 0.2 . 1 . . . . 187 LEU N . 17623 1 302 . 1 1 44 44 ALA H H 1 7.529 0.02 . 1 . . . . 188 ALA H . 17623 1 303 . 1 1 44 44 ALA HA H 1 4.395 0.02 . 1 . . . . 188 ALA HA . 17623 1 304 . 1 1 44 44 ALA HB1 H 1 1.209 0.02 . 1 . . . . 188 ALA HB . 17623 1 305 . 1 1 44 44 ALA HB2 H 1 1.209 0.02 . 1 . . . . 188 ALA HB . 17623 1 306 . 1 1 44 44 ALA HB3 H 1 1.209 0.02 . 1 . . . . 188 ALA HB . 17623 1 307 . 1 1 44 44 ALA CA C 13 51.850 0.2 . 1 . . . . 188 ALA CA . 17623 1 308 . 1 1 44 44 ALA CB C 13 21.969 0.2 . 1 . . . . 188 ALA CB . 17623 1 309 . 1 1 44 44 ALA N N 15 119.038 0.2 . 1 . . . . 188 ALA N . 17623 1 310 . 1 1 45 45 VAL H H 1 8.564 0.02 . 1 . . . . 189 VAL H . 17623 1 311 . 1 1 45 45 VAL HA H 1 4.670 0.02 . 1 . . . . 189 VAL HA . 17623 1 312 . 1 1 45 45 VAL HB H 1 1.717 0.02 . 1 . . . . 189 VAL HB . 17623 1 313 . 1 1 45 45 VAL HG11 H 1 0.725 0.02 . 4 . . . . 189 VAL HG1 . 17623 1 314 . 1 1 45 45 VAL HG12 H 1 0.725 0.02 . 4 . . . . 189 VAL HG1 . 17623 1 315 . 1 1 45 45 VAL HG13 H 1 0.725 0.02 . 4 . . . . 189 VAL HG1 . 17623 1 316 . 1 1 45 45 VAL HG21 H 1 0.676 0.02 . 4 . . . . 189 VAL HG2 . 17623 1 317 . 1 1 45 45 VAL HG22 H 1 0.676 0.02 . 4 . . . . 189 VAL HG2 . 17623 1 318 . 1 1 45 45 VAL HG23 H 1 0.676 0.02 . 4 . . . . 189 VAL HG2 . 17623 1 319 . 1 1 45 45 VAL CA C 13 60.630 0.2 . 1 . . . . 189 VAL CA . 17623 1 320 . 1 1 45 45 VAL CB C 13 35.681 0.2 . 1 . . . . 189 VAL CB . 17623 1 321 . 1 1 45 45 VAL CG1 C 13 21.798 0.2 . 2 . . . . 189 VAL CG1 . 17623 1 322 . 1 1 45 45 VAL CG2 C 13 22.123 0.2 . 2 . . . . 189 VAL CG2 . 17623 1 323 . 1 1 45 45 VAL N N 15 119.034 0.2 . 1 . . . . 189 VAL N . 17623 1 324 . 1 1 46 46 GLN H H 1 8.599 0.02 . 1 . . . . 190 GLN H . 17623 1 325 . 1 1 46 46 GLN HA H 1 4.760 0.02 . 1 . . . . 190 GLN HA . 17623 1 326 . 1 1 46 46 GLN HB2 H 1 2.000 0.02 . 2 . . . . 190 GLN HB2 . 17623 1 327 . 1 1 46 46 GLN HB3 H 1 1.990 0.02 . 2 . . . . 190 GLN HB3 . 17623 1 328 . 1 1 46 46 GLN HG2 H 1 2.237 0.02 . 2 . . . . 190 GLN HG2 . 17623 1 329 . 1 1 46 46 GLN HG3 H 1 2.193 0.02 . 2 . . . . 190 GLN HG3 . 17623 1 330 . 1 1 46 46 GLN CA C 13 54.350 0.2 . 1 . . . . 190 GLN CA . 17623 1 331 . 1 1 46 46 GLN CB C 13 31.034 0.2 . 1 . . . . 190 GLN CB . 17623 1 332 . 1 1 46 46 GLN CG C 13 33.889 0.2 . 1 . . . . 190 GLN CG . 17623 1 333 . 1 1 46 46 GLN N N 15 125.093 0.2 . 1 . . . . 190 GLN N . 17623 1 334 . 1 1 47 47 ILE H H 1 9.435 0.02 . 1 . . . . 191 ILE H . 17623 1 335 . 1 1 47 47 ILE HA H 1 4.002 0.02 . 1 . . . . 191 ILE HA . 17623 1 336 . 1 1 47 47 ILE HB H 1 1.565 0.02 . 1 . . . . 191 ILE HB . 17623 1 337 . 1 1 47 47 ILE HG12 H 1 1.324 0.02 . 4 . . . . 191 ILE HG12 . 17623 1 338 . 1 1 47 47 ILE HG13 H 1 0.599 0.02 . 4 . . . . 191 ILE HG13 . 17623 1 339 . 1 1 47 47 ILE HG21 H 1 0.524 0.02 . 4 . . . . 191 ILE HG2 . 17623 1 340 . 1 1 47 47 ILE HG22 H 1 0.524 0.02 . 4 . . . . 191 ILE HG2 . 17623 1 341 . 1 1 47 47 ILE HG23 H 1 0.524 0.02 . 4 . . . . 191 ILE HG2 . 17623 1 342 . 1 1 47 47 ILE HD11 H 1 0.497 0.02 . 4 . . . . 191 ILE HD1 . 17623 1 343 . 1 1 47 47 ILE HD12 H 1 0.497 0.02 . 4 . . . . 191 ILE HD1 . 17623 1 344 . 1 1 47 47 ILE HD13 H 1 0.497 0.02 . 4 . . . . 191 ILE HD1 . 17623 1 345 . 1 1 47 47 ILE CA C 13 61.077 0.2 . 1 . . . . 191 ILE CA . 17623 1 346 . 1 1 47 47 ILE CB C 13 40.177 0.2 . 1 . . . . 191 ILE CB . 17623 1 347 . 1 1 47 47 ILE CG1 C 13 29.128 0.2 . 1 . . . . 191 ILE CG1 . 17623 1 348 . 1 1 47 47 ILE CG2 C 13 16.952 0.2 . 1 . . . . 191 ILE CG2 . 17623 1 349 . 1 1 47 47 ILE CD1 C 13 13.651 0.2 . 1 . . . . 191 ILE CD1 . 17623 1 350 . 1 1 47 47 ILE N N 15 127.046 0.2 . 1 . . . . 191 ILE N . 17623 1 351 . 1 1 48 48 ASN H H 1 8.660 0.02 . 1 . . . . 192 ASN H . 17623 1 352 . 1 1 48 48 ASN HA H 1 4.539 0.02 . 1 . . . . 192 ASN HA . 17623 1 353 . 1 1 48 48 ASN HB2 H 1 1.650 0.02 . 2 . . . . 192 ASN HB2 . 17623 1 354 . 1 1 48 48 ASN HB3 H 1 1.580 0.02 . 2 . . . . 192 ASN HB3 . 17623 1 355 . 1 1 48 48 ASN CA C 13 52.061 0.2 . 1 . . . . 192 ASN CA . 17623 1 356 . 1 1 48 48 ASN CB C 13 38.491 0.2 . 1 . . . . 192 ASN CB . 17623 1 357 . 1 1 48 48 ASN N N 15 127.609 0.2 . 1 . . . . 192 ASN N . 17623 1 358 . 1 1 49 49 GLN H H 1 8.621 0.02 . 1 . . . . 193 GLN H . 17623 1 359 . 1 1 49 49 GLN HA H 1 3.880 0.02 . 1 . . . . 193 GLN HA . 17623 1 360 . 1 1 49 49 GLN HB2 H 1 2.022 0.02 . 2 . . . . 193 GLN HB2 . 17623 1 361 . 1 1 49 49 GLN HB3 H 1 1.867 0.02 . 2 . . . . 193 GLN HB3 . 17623 1 362 . 1 1 49 49 GLN HG2 H 1 2.290 0.02 . 2 . . . . 193 GLN HG2 . 17623 1 363 . 1 1 49 49 GLN HG3 H 1 2.253 0.02 . 2 . . . . 193 GLN HG3 . 17623 1 364 . 1 1 49 49 GLN HE21 H 1 6.771 0.02 . 2 . . . . 193 GLN HE21 . 17623 1 365 . 1 1 49 49 GLN HE22 H 1 7.476 0.02 . 2 . . . . 193 GLN HE22 . 17623 1 366 . 1 1 49 49 GLN CA C 13 57.902 0.2 . 1 . . . . 193 GLN CA . 17623 1 367 . 1 1 49 49 GLN CB C 13 28.407 0.2 . 1 . . . . 193 GLN CB . 17623 1 368 . 1 1 49 49 GLN CG C 13 33.328 0.2 . 1 . . . . 193 GLN CG . 17623 1 369 . 1 1 49 49 GLN N N 15 123.183 0.2 . 1 . . . . 193 GLN N . 17623 1 370 . 1 1 49 49 GLN NE2 N 15 112.260 0.2 . 1 . . . . 193 GLN NE2 . 17623 1 371 . 1 1 52 52 ASN HA H 1 4.231 0.02 . 1 . . . . 196 ASN HA . 17623 1 372 . 1 1 52 52 ASN HB2 H 1 3.040 0.02 . 2 . . . . 196 ASN HB2 . 17623 1 373 . 1 1 52 52 ASN HB3 H 1 2.717 0.02 . 2 . . . . 196 ASN HB3 . 17623 1 374 . 1 1 52 52 ASN HD21 H 1 6.696 0.02 . 2 . . . . 196 ASN HD21 . 17623 1 375 . 1 1 52 52 ASN HD22 H 1 7.571 0.02 . 2 . . . . 196 ASN HD22 . 17623 1 376 . 1 1 52 52 ASN CA C 13 54.904 0.2 . 1 . . . . 196 ASN CA . 17623 1 377 . 1 1 52 52 ASN CB C 13 37.945 0.2 . 1 . . . . 196 ASN CB . 17623 1 378 . 1 1 52 52 ASN ND2 N 15 111.904 0.2 . 1 . . . . 196 ASN ND2 . 17623 1 379 . 1 1 53 53 PHE H H 1 7.580 0.02 . 1 . . . . 197 PHE H . 17623 1 380 . 1 1 53 53 PHE HA H 1 5.349 0.02 . 1 . . . . 197 PHE HA . 17623 1 381 . 1 1 53 53 PHE CA C 13 55.957 0.2 . 1 . . . . 197 PHE CA . 17623 1 382 . 1 1 53 53 PHE N N 15 113.216 0.2 . 1 . . . . 197 PHE N . 17623 1 383 . 1 1 54 54 ALA H H 1 9.306 0.02 . 1 . . . . 198 ALA H . 17623 1 384 . 1 1 54 54 ALA HB1 H 1 0.913 0.02 . 1 . . . . 198 ALA HB . 17623 1 385 . 1 1 54 54 ALA HB2 H 1 0.913 0.02 . 1 . . . . 198 ALA HB . 17623 1 386 . 1 1 54 54 ALA HB3 H 1 0.913 0.02 . 1 . . . . 198 ALA HB . 17623 1 387 . 1 1 54 54 ALA CB C 13 24.190 0.2 . 1 . . . . 198 ALA CB . 17623 1 388 . 1 1 54 54 ALA N N 15 121.817 0.2 . 1 . . . . 198 ALA N . 17623 1 389 . 1 1 55 55 PHE H H 1 8.672 0.02 . 1 . . . . 199 PHE H . 17623 1 390 . 1 1 55 55 PHE HA H 1 5.461 0.02 . 1 . . . . 199 PHE HA . 17623 1 391 . 1 1 55 55 PHE HB2 H 1 2.837 0.02 . 2 . . . . 199 PHE HB2 . 17623 1 392 . 1 1 55 55 PHE HB3 H 1 2.673 0.02 . 2 . . . . 199 PHE HB3 . 17623 1 393 . 1 1 55 55 PHE CA C 13 56.855 0.2 . 1 . . . . 199 PHE CA . 17623 1 394 . 1 1 55 55 PHE CB C 13 43.059 0.2 . 1 . . . . 199 PHE CB . 17623 1 395 . 1 1 55 55 PHE N N 15 116.307 0.2 . 1 . . . . 199 PHE N . 17623 1 396 . 1 1 56 56 LEU H H 1 8.817 0.02 . 1 . . . . 200 LEU H . 17623 1 397 . 1 1 56 56 LEU HA H 1 4.573 0.02 . 1 . . . . 200 LEU HA . 17623 1 398 . 1 1 56 56 LEU HB2 H 1 1.318 0.02 . 2 . . . . 200 LEU HB2 . 17623 1 399 . 1 1 56 56 LEU HB3 H 1 0.866 0.02 . 2 . . . . 200 LEU HB3 . 17623 1 400 . 1 1 56 56 LEU HG H 1 1.221 0.02 . 1 . . . . 200 LEU HG . 17623 1 401 . 1 1 56 56 LEU HD11 H 1 -0.055 0.02 . 4 . . . . 200 LEU HD1 . 17623 1 402 . 1 1 56 56 LEU HD12 H 1 -0.055 0.02 . 4 . . . . 200 LEU HD1 . 17623 1 403 . 1 1 56 56 LEU HD13 H 1 -0.055 0.02 . 4 . . . . 200 LEU HD1 . 17623 1 404 . 1 1 56 56 LEU HD21 H 1 0.125 0.02 . 4 . . . . 200 LEU HD2 . 17623 1 405 . 1 1 56 56 LEU HD22 H 1 0.125 0.02 . 4 . . . . 200 LEU HD2 . 17623 1 406 . 1 1 56 56 LEU HD23 H 1 0.125 0.02 . 4 . . . . 200 LEU HD2 . 17623 1 407 . 1 1 56 56 LEU CA C 13 53.616 0.2 . 1 . . . . 200 LEU CA . 17623 1 408 . 1 1 56 56 LEU CB C 13 45.766 0.2 . 1 . . . . 200 LEU CB . 17623 1 409 . 1 1 56 56 LEU CG C 13 28.345 0.2 . 1 . . . . 200 LEU CG . 17623 1 410 . 1 1 56 56 LEU CD1 C 13 24.132 0.2 . 2 . . . . 200 LEU CD1 . 17623 1 411 . 1 1 56 56 LEU CD2 C 13 24.056 0.2 . 2 . . . . 200 LEU CD2 . 17623 1 412 . 1 1 56 56 LEU N N 15 122.839 0.2 . 1 . . . . 200 LEU N . 17623 1 413 . 1 1 57 57 GLU H H 1 8.342 0.02 . 1 . . . . 201 GLU H . 17623 1 414 . 1 1 57 57 GLU HA H 1 5.263 0.02 . 1 . . . . 201 GLU HA . 17623 1 415 . 1 1 57 57 GLU HB2 H 1 1.831 0.02 . 2 . . . . 201 GLU HB2 . 17623 1 416 . 1 1 57 57 GLU HB3 H 1 1.760 0.02 . 2 . . . . 201 GLU HB3 . 17623 1 417 . 1 1 57 57 GLU HG2 H 1 2.170 0.02 . 2 . . . . 201 GLU HG2 . 17623 1 418 . 1 1 57 57 GLU HG3 H 1 1.968 0.02 . 2 . . . . 201 GLU HG3 . 17623 1 419 . 1 1 57 57 GLU CA C 13 54.890 0.2 . 1 . . . . 201 GLU CA . 17623 1 420 . 1 1 57 57 GLU CB C 13 32.175 0.2 . 1 . . . . 201 GLU CB . 17623 1 421 . 1 1 57 57 GLU CG C 13 36.492 0.2 . 1 . . . . 201 GLU CG . 17623 1 422 . 1 1 57 57 GLU N N 15 120.887 0.2 . 1 . . . . 201 GLU N . 17623 1 423 . 1 1 58 58 PHE H H 1 9.506 0.02 . 1 . . . . 202 PHE H . 17623 1 424 . 1 1 58 58 PHE HA H 1 5.330 0.02 . 1 . . . . 202 PHE HA . 17623 1 425 . 1 1 58 58 PHE HB2 H 1 3.440 0.02 . 2 . . . . 202 PHE HB2 . 17623 1 426 . 1 1 58 58 PHE HB3 H 1 2.748 0.02 . 2 . . . . 202 PHE HB3 . 17623 1 427 . 1 1 58 58 PHE HD1 H 1 6.891 0.02 . 1 . . . . 202 PHE HD1 . 17623 1 428 . 1 1 58 58 PHE HD2 H 1 6.891 0.02 . 1 . . . . 202 PHE HD2 . 17623 1 429 . 1 1 58 58 PHE HZ H 1 6.526 0.02 . 1 . . . . 202 PHE HZ . 17623 1 430 . 1 1 58 58 PHE CA C 13 56.373 0.2 . 1 . . . . 202 PHE CA . 17623 1 431 . 1 1 58 58 PHE CB C 13 44.058 0.2 . 1 . . . . 202 PHE CB . 17623 1 432 . 1 1 58 58 PHE N N 15 124.913 0.2 . 1 . . . . 202 PHE N . 17623 1 433 . 1 1 59 59 ARG H H 1 8.915 0.02 . 1 . . . . 203 ARG H . 17623 1 434 . 1 1 59 59 ARG N N 15 114.868 0.2 . 1 . . . . 203 ARG N . 17623 1 435 . 1 1 60 60 SER H H 1 7.266 0.02 . 1 . . . . 204 SER H . 17623 1 436 . 1 1 60 60 SER HA H 1 4.974 0.02 . 1 . . . . 204 SER HA . 17623 1 437 . 1 1 60 60 SER HB2 H 1 4.158 0.02 . 2 . . . . 204 SER HB2 . 17623 1 438 . 1 1 60 60 SER HB3 H 1 3.832 0.02 . 2 . . . . 204 SER HB3 . 17623 1 439 . 1 1 60 60 SER CA C 13 56.030 0.2 . 1 . . . . 204 SER CA . 17623 1 440 . 1 1 60 60 SER CB C 13 66.846 0.2 . 1 . . . . 204 SER CB . 17623 1 441 . 1 1 60 60 SER N N 15 110.419 0.2 . 1 . . . . 204 SER N . 17623 1 442 . 1 1 61 61 VAL HA H 1 3.752 0.02 . 1 . . . . 205 VAL HA . 17623 1 443 . 1 1 61 61 VAL HB H 1 2.008 0.02 . 1 . . . . 205 VAL HB . 17623 1 444 . 1 1 61 61 VAL HG11 H 1 1.005 0.02 . 4 . . . . 205 VAL HG1 . 17623 1 445 . 1 1 61 61 VAL HG12 H 1 1.005 0.02 . 4 . . . . 205 VAL HG1 . 17623 1 446 . 1 1 61 61 VAL HG13 H 1 1.005 0.02 . 4 . . . . 205 VAL HG1 . 17623 1 447 . 1 1 61 61 VAL HG21 H 1 0.996 0.02 . 4 . . . . 205 VAL HG2 . 17623 1 448 . 1 1 61 61 VAL HG22 H 1 0.996 0.02 . 4 . . . . 205 VAL HG2 . 17623 1 449 . 1 1 61 61 VAL HG23 H 1 0.996 0.02 . 4 . . . . 205 VAL HG2 . 17623 1 450 . 1 1 61 61 VAL CB C 13 32.367 0.2 . 1 . . . . 205 VAL CB . 17623 1 451 . 1 1 61 61 VAL CG1 C 13 21.286 0.2 . 2 . . . . 205 VAL CG1 . 17623 1 452 . 1 1 61 61 VAL CG2 C 13 22.259 0.2 . 2 . . . . 205 VAL CG2 . 17623 1 453 . 1 1 62 62 ASP H H 1 8.734 0.02 . 1 . . . . 206 ASP H . 17623 1 454 . 1 1 62 62 ASP N N 15 119.781 0.2 . 1 . . . . 206 ASP N . 17623 1 455 . 1 1 63 63 GLU H H 1 7.738 0.02 . 1 . . . . 207 GLU H . 17623 1 456 . 1 1 63 63 GLU HA H 1 3.649 0.02 . 1 . . . . 207 GLU HA . 17623 1 457 . 1 1 63 63 GLU HB2 H 1 2.059 0.02 . 2 . . . . 207 GLU HB2 . 17623 1 458 . 1 1 63 63 GLU HB3 H 1 1.793 0.02 . 2 . . . . 207 GLU HB3 . 17623 1 459 . 1 1 63 63 GLU HG2 H 1 2.226 0.02 . 2 . . . . 207 GLU HG2 . 17623 1 460 . 1 1 63 63 GLU HG3 H 1 2.225 0.02 . 2 . . . . 207 GLU HG3 . 17623 1 461 . 1 1 63 63 GLU CA C 13 59.625 0.2 . 1 . . . . 207 GLU CA . 17623 1 462 . 1 1 63 63 GLU CB C 13 29.753 0.2 . 1 . . . . 207 GLU CB . 17623 1 463 . 1 1 63 63 GLU CG C 13 38.968 0.2 . 1 . . . . 207 GLU CG . 17623 1 464 . 1 1 63 63 GLU N N 15 116.747 0.2 . 1 . . . . 207 GLU N . 17623 1 465 . 1 1 64 64 THR H H 1 6.652 0.02 . 1 . . . . 208 THR H . 17623 1 466 . 1 1 64 64 THR HA H 1 1.947 0.02 . 1 . . . . 208 THR HA . 17623 1 467 . 1 1 64 64 THR HB H 1 4.201 0.02 . 1 . . . . 208 THR HB . 17623 1 468 . 1 1 64 64 THR HG21 H 1 0.541 0.02 . 1 . . . . 208 THR HG2 . 17623 1 469 . 1 1 64 64 THR HG22 H 1 0.541 0.02 . 1 . . . . 208 THR HG2 . 17623 1 470 . 1 1 64 64 THR HG23 H 1 0.541 0.02 . 1 . . . . 208 THR HG2 . 17623 1 471 . 1 1 64 64 THR CA C 13 66.054 0.2 . 1 . . . . 208 THR CA . 17623 1 472 . 1 1 64 64 THR CB C 13 67.350 0.2 . 1 . . . . 208 THR CB . 17623 1 473 . 1 1 64 64 THR CG2 C 13 20.354 0.2 . 1 . . . . 208 THR CG2 . 17623 1 474 . 1 1 64 64 THR N N 15 115.766 0.2 . 1 . . . . 208 THR N . 17623 1 475 . 1 1 65 65 THR H H 1 7.261 0.02 . 1 . . . . 209 THR H . 17623 1 476 . 1 1 65 65 THR HA H 1 3.459 0.02 . 1 . . . . 209 THR HA . 17623 1 477 . 1 1 65 65 THR HB H 1 4.145 0.02 . 1 . . . . 209 THR HB . 17623 1 478 . 1 1 65 65 THR HG21 H 1 0.989 0.02 . 1 . . . . 209 THR HG2 . 17623 1 479 . 1 1 65 65 THR HG22 H 1 0.989 0.02 . 1 . . . . 209 THR HG2 . 17623 1 480 . 1 1 65 65 THR HG23 H 1 0.989 0.02 . 1 . . . . 209 THR HG2 . 17623 1 481 . 1 1 65 65 THR CA C 13 65.564 0.2 . 1 . . . . 209 THR CA . 17623 1 482 . 1 1 65 65 THR CB C 13 68.277 0.2 . 1 . . . . 209 THR CB . 17623 1 483 . 1 1 65 65 THR CG2 C 13 22.635 0.2 . 1 . . . . 209 THR CG2 . 17623 1 484 . 1 1 65 65 THR N N 15 115.699 0.2 . 1 . . . . 209 THR N . 17623 1 485 . 1 1 66 66 GLN H H 1 7.681 0.02 . 1 . . . . 210 GLN H . 17623 1 486 . 1 1 66 66 GLN N N 15 118.043 0.2 . 1 . . . . 210 GLN N . 17623 1 487 . 1 1 67 67 ALA H H 1 7.362 0.02 . 1 . . . . 211 ALA H . 17623 1 488 . 1 1 67 67 ALA HA H 1 3.640 0.02 . 1 . . . . 211 ALA HA . 17623 1 489 . 1 1 67 67 ALA HB1 H 1 1.308 0.02 . 1 . . . . 211 ALA HB . 17623 1 490 . 1 1 67 67 ALA HB2 H 1 1.308 0.02 . 1 . . . . 211 ALA HB . 17623 1 491 . 1 1 67 67 ALA HB3 H 1 1.308 0.02 . 1 . . . . 211 ALA HB . 17623 1 492 . 1 1 67 67 ALA CA C 13 53.958 0.2 . 1 . . . . 211 ALA CA . 17623 1 493 . 1 1 67 67 ALA CB C 13 19.276 0.2 . 1 . . . . 211 ALA CB . 17623 1 494 . 1 1 67 67 ALA N N 15 119.559 0.2 . 1 . . . . 211 ALA N . 17623 1 495 . 1 1 68 68 MET H H 1 7.184 0.02 . 1 . . . . 212 MET H . 17623 1 496 . 1 1 68 68 MET HA H 1 3.967 0.02 . 1 . . . . 212 MET HA . 17623 1 497 . 1 1 68 68 MET HB2 H 1 2.052 0.02 . 2 . . . . 212 MET HB2 . 17623 1 498 . 1 1 68 68 MET HB3 H 1 2.031 0.02 . 2 . . . . 212 MET HB3 . 17623 1 499 . 1 1 68 68 MET HG2 H 1 2.656 0.02 . 2 . . . . 212 MET HG2 . 17623 1 500 . 1 1 68 68 MET HG3 H 1 2.236 0.02 . 2 . . . . 212 MET HG3 . 17623 1 501 . 1 1 68 68 MET HE1 H 1 2.000 0.02 . 1 . . . . 212 MET HE . 17623 1 502 . 1 1 68 68 MET HE2 H 1 2.000 0.02 . 1 . . . . 212 MET HE . 17623 1 503 . 1 1 68 68 MET HE3 H 1 2.000 0.02 . 1 . . . . 212 MET HE . 17623 1 504 . 1 1 68 68 MET CA C 13 57.908 0.2 . 1 . . . . 212 MET CA . 17623 1 505 . 1 1 68 68 MET CB C 13 31.007 0.2 . 1 . . . . 212 MET CB . 17623 1 506 . 1 1 68 68 MET CG C 13 32.629 0.2 . 1 . . . . 212 MET CG . 17623 1 507 . 1 1 68 68 MET CE C 13 16.311 0.2 . 1 . . . . 212 MET CE . 17623 1 508 . 1 1 68 68 MET N N 15 115.798 0.2 . 1 . . . . 212 MET N . 17623 1 509 . 1 1 69 69 ALA H H 1 7.431 0.02 . 1 . . . . 213 ALA H . 17623 1 510 . 1 1 69 69 ALA HA H 1 4.119 0.02 . 1 . . . . 213 ALA HA . 17623 1 511 . 1 1 69 69 ALA HB1 H 1 1.186 0.02 . 1 . . . . 213 ALA HB . 17623 1 512 . 1 1 69 69 ALA HB2 H 1 1.186 0.02 . 1 . . . . 213 ALA HB . 17623 1 513 . 1 1 69 69 ALA HB3 H 1 1.186 0.02 . 1 . . . . 213 ALA HB . 17623 1 514 . 1 1 69 69 ALA CA C 13 53.640 0.2 . 1 . . . . 213 ALA CA . 17623 1 515 . 1 1 69 69 ALA CB C 13 18.584 0.2 . 1 . . . . 213 ALA CB . 17623 1 516 . 1 1 69 69 ALA N N 15 120.437 0.2 . 1 . . . . 213 ALA N . 17623 1 517 . 1 1 70 70 PHE H H 1 7.601 0.02 . 1 . . . . 214 PHE H . 17623 1 518 . 1 1 70 70 PHE HA H 1 4.801 0.02 . 1 . . . . 214 PHE HA . 17623 1 519 . 1 1 70 70 PHE HB2 H 1 3.436 0.02 . 2 . . . . 214 PHE HB2 . 17623 1 520 . 1 1 70 70 PHE HB3 H 1 3.161 0.02 . 2 . . . . 214 PHE HB3 . 17623 1 521 . 1 1 70 70 PHE HD1 H 1 7.107 0.02 . 1 . . . . 214 PHE HD1 . 17623 1 522 . 1 1 70 70 PHE HD2 H 1 7.107 0.02 . 1 . . . . 214 PHE HD2 . 17623 1 523 . 1 1 70 70 PHE HE1 H 1 6.808 0.02 . 1 . . . . 214 PHE HE1 . 17623 1 524 . 1 1 70 70 PHE HE2 H 1 6.808 0.02 . 1 . . . . 214 PHE HE2 . 17623 1 525 . 1 1 70 70 PHE CA C 13 55.848 0.2 . 1 . . . . 214 PHE CA . 17623 1 526 . 1 1 70 70 PHE CB C 13 37.801 0.2 . 1 . . . . 214 PHE CB . 17623 1 527 . 1 1 70 70 PHE N N 15 114.964 0.2 . 1 . . . . 214 PHE N . 17623 1 528 . 1 1 71 71 ASP H H 1 7.342 0.02 . 1 . . . . 215 ASP H . 17623 1 529 . 1 1 71 71 ASP HA H 1 4.227 0.02 . 1 . . . . 215 ASP HA . 17623 1 530 . 1 1 71 71 ASP HB2 H 1 2.922 0.02 . 2 . . . . 215 ASP HB2 . 17623 1 531 . 1 1 71 71 ASP HB3 H 1 2.621 0.02 . 2 . . . . 215 ASP HB3 . 17623 1 532 . 1 1 71 71 ASP CA C 13 58.069 0.2 . 1 . . . . 215 ASP CA . 17623 1 533 . 1 1 71 71 ASP CB C 13 41.219 0.2 . 1 . . . . 215 ASP CB . 17623 1 534 . 1 1 71 71 ASP N N 15 119.325 0.2 . 1 . . . . 215 ASP N . 17623 1 535 . 1 1 72 72 GLY H H 1 9.278 0.02 . 1 . . . . 216 GLY H . 17623 1 536 . 1 1 72 72 GLY N N 15 117.221 0.2 . 1 . . . . 216 GLY N . 17623 1 537 . 1 1 73 73 ILE H H 1 8.558 0.02 . 1 . . . . 217 ILE H . 17623 1 538 . 1 1 73 73 ILE HA H 1 3.972 0.02 . 1 . . . . 217 ILE HA . 17623 1 539 . 1 1 73 73 ILE HB H 1 2.096 0.02 . 1 . . . . 217 ILE HB . 17623 1 540 . 1 1 73 73 ILE HG12 H 1 1.596 0.02 . 2 . . . . 217 ILE HG12 . 17623 1 541 . 1 1 73 73 ILE HG13 H 1 1.223 0.02 . 2 . . . . 217 ILE HG13 . 17623 1 542 . 1 1 73 73 ILE HG21 H 1 0.960 0.02 . 1 . . . . 217 ILE HG21 . 17623 1 543 . 1 1 73 73 ILE HG22 H 1 0.960 0.02 . 1 . . . . 217 ILE HG21 . 17623 1 544 . 1 1 73 73 ILE HG23 H 1 0.960 0.02 . 1 . . . . 217 ILE HG21 . 17623 1 545 . 1 1 73 73 ILE HD11 H 1 0.430 0.02 . 1 . . . . 217 ILE HD11 . 17623 1 546 . 1 1 73 73 ILE HD12 H 1 0.430 0.02 . 1 . . . . 217 ILE HD11 . 17623 1 547 . 1 1 73 73 ILE HD13 H 1 0.430 0.02 . 1 . . . . 217 ILE HD11 . 17623 1 548 . 1 1 73 73 ILE CA C 13 62.513 0.2 . 1 . . . . 217 ILE CA . 17623 1 549 . 1 1 73 73 ILE CB C 13 37.923 0.2 . 1 . . . . 217 ILE CB . 17623 1 550 . 1 1 73 73 ILE CG1 C 13 29.572 0.2 . 1 . . . . 217 ILE CG1 . 17623 1 551 . 1 1 73 73 ILE CG2 C 13 17.162 0.2 . 1 . . . . 217 ILE CG2 . 17623 1 552 . 1 1 73 73 ILE CD1 C 13 14.367 0.2 . 1 . . . . 217 ILE CD1 . 17623 1 553 . 1 1 73 73 ILE N N 15 124.047 0.2 . 1 . . . . 217 ILE N . 17623 1 554 . 1 1 74 74 ILE H H 1 7.813 0.02 . 1 . . . . 218 ILE H . 17623 1 555 . 1 1 74 74 ILE HA H 1 4.474 0.02 . 1 . . . . 218 ILE HA . 17623 1 556 . 1 1 74 74 ILE HB H 1 1.775 0.02 . 1 . . . . 218 ILE HB . 17623 1 557 . 1 1 74 74 ILE HG12 H 1 1.489 0.02 . 2 . . . . 218 ILE HG12 . 17623 1 558 . 1 1 74 74 ILE HG13 H 1 1.124 0.02 . 2 . . . . 218 ILE HG13 . 17623 1 559 . 1 1 74 74 ILE HD11 H 1 0.640 0.02 . 1 . . . . 218 ILE HD1 . 17623 1 560 . 1 1 74 74 ILE HD12 H 1 0.640 0.02 . 1 . . . . 218 ILE HD1 . 17623 1 561 . 1 1 74 74 ILE HD13 H 1 0.640 0.02 . 1 . . . . 218 ILE HD1 . 17623 1 562 . 1 1 74 74 ILE CA C 13 59.298 0.2 . 1 . . . . 218 ILE CA . 17623 1 563 . 1 1 74 74 ILE CB C 13 36.232 0.2 . 1 . . . . 218 ILE CB . 17623 1 564 . 1 1 74 74 ILE CG1 C 13 27.457 0.2 . 1 . . . . 218 ILE CG1 . 17623 1 565 . 1 1 74 74 ILE CG2 C 13 20.582 0.2 . 1 . . . . 218 ILE CG2 . 17623 1 566 . 1 1 74 74 ILE CD1 C 13 11.020 0.2 . 1 . . . . 218 ILE CD1 . 17623 1 567 . 1 1 74 74 ILE N N 15 124.811 0.2 . 1 . . . . 218 ILE N . 17623 1 568 . 1 1 75 75 PHE H H 1 9.011 0.02 . 1 . . . . 219 PHE H . 17623 1 569 . 1 1 75 75 PHE HA H 1 4.532 0.02 . 1 . . . . 219 PHE HA . 17623 1 570 . 1 1 75 75 PHE HB2 H 1 2.407 0.02 . 2 . . . . 219 PHE HB2 . 17623 1 571 . 1 1 75 75 PHE HB3 H 1 2.222 0.02 . 2 . . . . 219 PHE HB3 . 17623 1 572 . 1 1 75 75 PHE HD1 H 1 6.266 0.02 . 1 . . . . 219 PHE HD1 . 17623 1 573 . 1 1 75 75 PHE HD2 H 1 6.266 0.02 . 1 . . . . 219 PHE HD2 . 17623 1 574 . 1 1 75 75 PHE HE1 H 1 6.845 0.02 . 1 . . . . 219 PHE HE1 . 17623 1 575 . 1 1 75 75 PHE HE2 H 1 6.845 0.02 . 1 . . . . 219 PHE HE2 . 17623 1 576 . 1 1 75 75 PHE HZ H 1 6.714 0.02 . 1 . . . . 219 PHE HZ . 17623 1 577 . 1 1 75 75 PHE CA C 13 54.192 0.2 . 1 . . . . 219 PHE CA . 17623 1 578 . 1 1 75 75 PHE CB C 13 41.427 0.2 . 1 . . . . 219 PHE CB . 17623 1 579 . 1 1 75 75 PHE N N 15 129.073 0.2 . 1 . . . . 219 PHE N . 17623 1 580 . 1 1 76 76 GLN H H 1 8.825 0.02 . 1 . . . . 220 GLN H . 17623 1 581 . 1 1 76 76 GLN HA H 1 3.423 0.02 . 1 . . . . 220 GLN HA . 17623 1 582 . 1 1 76 76 GLN HB2 H 1 1.770 0.02 . 2 . . . . 220 GLN HB2 . 17623 1 583 . 1 1 76 76 GLN HB3 H 1 1.185 0.02 . 2 . . . . 220 GLN HB3 . 17623 1 584 . 1 1 76 76 GLN HG2 H 1 1.433 0.02 . 2 . . . . 220 GLN HG2 . 17623 1 585 . 1 1 76 76 GLN HG3 H 1 1.138 0.02 . 2 . . . . 220 GLN HG3 . 17623 1 586 . 1 1 76 76 GLN HE21 H 1 6.441 0.02 . 2 . . . . 220 GLN HE21 . 17623 1 587 . 1 1 76 76 GLN HE22 H 1 6.597 0.02 . 2 . . . . 220 GLN HE22 . 17623 1 588 . 1 1 76 76 GLN CA C 13 56.065 0.2 . 1 . . . . 220 GLN CA . 17623 1 589 . 1 1 76 76 GLN CB C 13 25.703 0.2 . 1 . . . . 220 GLN CB . 17623 1 590 . 1 1 76 76 GLN CG C 13 32.940 0.2 . 1 . . . . 220 GLN CG . 17623 1 591 . 1 1 76 76 GLN N N 15 125.078 0.2 . 1 . . . . 220 GLN N . 17623 1 592 . 1 1 76 76 GLN NE2 N 15 109.731 0.2 . 1 . . . . 220 GLN NE2 . 17623 1 593 . 1 1 77 77 GLY H H 1 7.769 0.02 . 1 . . . . 221 GLY H . 17623 1 594 . 1 1 77 77 GLY HA2 H 1 4.028 0.02 . 2 . . . . 221 GLY HA2 . 17623 1 595 . 1 1 77 77 GLY HA3 H 1 3.349 0.02 . 2 . . . . 221 GLY HA3 . 17623 1 596 . 1 1 77 77 GLY CA C 13 45.376 0.2 . 1 . . . . 221 GLY CA . 17623 1 597 . 1 1 77 77 GLY N N 15 101.889 0.2 . 1 . . . . 221 GLY N . 17623 1 598 . 1 1 78 78 GLN H H 1 7.596 0.02 . 1 . . . . 222 GLN H . 17623 1 599 . 1 1 78 78 GLN HA H 1 4.479 0.02 . 1 . . . . 222 GLN HA . 17623 1 600 . 1 1 78 78 GLN HB2 H 1 2.155 0.02 . 2 . . . . 222 GLN HB2 . 17623 1 601 . 1 1 78 78 GLN HB3 H 1 1.886 0.02 . 2 . . . . 222 GLN HB3 . 17623 1 602 . 1 1 78 78 GLN HG2 H 1 2.074 0.02 . 2 . . . . 222 GLN HG2 . 17623 1 603 . 1 1 78 78 GLN HG3 H 1 2.000 0.02 . 2 . . . . 222 GLN HG3 . 17623 1 604 . 1 1 78 78 GLN CA C 13 53.554 0.2 . 1 . . . . 222 GLN CA . 17623 1 605 . 1 1 78 78 GLN CB C 13 31.363 0.2 . 1 . . . . 222 GLN CB . 17623 1 606 . 1 1 78 78 GLN CG C 13 33.832 0.2 . 1 . . . . 222 GLN CG . 17623 1 607 . 1 1 78 78 GLN N N 15 118.546 0.2 . 1 . . . . 222 GLN N . 17623 1 608 . 1 1 79 79 SER H H 1 8.462 0.02 . 1 . . . . 223 SER H . 17623 1 609 . 1 1 79 79 SER N N 15 116.798 0.2 . 1 . . . . 223 SER N . 17623 1 610 . 1 1 80 80 LEU H H 1 9.056 0.02 . 1 . . . . 224 LEU H . 17623 1 611 . 1 1 80 80 LEU N N 15 129.739 0.2 . 1 . . . . 224 LEU N . 17623 1 612 . 1 1 81 81 LYS H H 1 7.642 0.02 . 1 . . . . 225 LYS H . 17623 1 613 . 1 1 81 81 LYS N N 15 123.316 0.2 . 1 . . . . 225 LYS N . 17623 1 614 . 1 1 82 82 ILE H H 1 9.074 0.02 . 1 . . . . 226 ILE H . 17623 1 615 . 1 1 82 82 ILE HA H 1 5.248 0.02 . 1 . . . . 226 ILE HA . 17623 1 616 . 1 1 82 82 ILE HB H 1 1.567 0.02 . 1 . . . . 226 ILE HB . 17623 1 617 . 1 1 82 82 ILE HG12 H 1 1.637 0.02 . 2 . . . . 226 ILE HG12 . 17623 1 618 . 1 1 82 82 ILE HG13 H 1 1.191 0.02 . 2 . . . . 226 ILE HG13 . 17623 1 619 . 1 1 82 82 ILE HG21 H 1 1.326 0.02 . 1 . . . . 226 ILE HG2 . 17623 1 620 . 1 1 82 82 ILE HG22 H 1 1.326 0.02 . 1 . . . . 226 ILE HG2 . 17623 1 621 . 1 1 82 82 ILE HG23 H 1 1.326 0.02 . 1 . . . . 226 ILE HG2 . 17623 1 622 . 1 1 82 82 ILE HD11 H 1 0.955 0.02 . 1 . . . . 226 ILE HD1 . 17623 1 623 . 1 1 82 82 ILE HD12 H 1 0.955 0.02 . 1 . . . . 226 ILE HD1 . 17623 1 624 . 1 1 82 82 ILE HD13 H 1 0.955 0.02 . 1 . . . . 226 ILE HD1 . 17623 1 625 . 1 1 82 82 ILE CA C 13 60.417 0.2 . 1 . . . . 226 ILE CA . 17623 1 626 . 1 1 82 82 ILE CB C 13 39.382 0.2 . 1 . . . . 226 ILE CB . 17623 1 627 . 1 1 82 82 ILE CG1 C 13 28.371 0.2 . 1 . . . . 226 ILE CG1 . 17623 1 628 . 1 1 82 82 ILE CG2 C 13 19.371 0.2 . 1 . . . . 226 ILE CG2 . 17623 1 629 . 1 1 82 82 ILE CD1 C 13 13.897 0.2 . 1 . . . . 226 ILE CD1 . 17623 1 630 . 1 1 82 82 ILE N N 15 127.450 0.2 . 1 . . . . 226 ILE N . 17623 1 631 . 1 1 83 83 ARG H H 1 9.470 0.02 . 1 . . . . 227 ARG H . 17623 1 632 . 1 1 83 83 ARG N N 15 122.963 0.2 . 1 . . . . 227 ARG N . 17623 1 633 . 1 1 84 84 ARG H H 1 9.276 0.02 . 1 . . . . 228 ARG H . 17623 1 634 . 1 1 84 84 ARG N N 15 117.574 0.2 . 1 . . . . 228 ARG N . 17623 1 635 . 1 1 86 86 HIS HD2 H 1 7.113 0.02 . 1 . . . . 230 HIS HD2 . 17623 1 636 . 1 1 88 88 TYR H H 1 7.487 0.02 . 1 . . . . 232 TYR H . 17623 1 637 . 1 1 88 88 TYR N N 15 120.010 0.2 . 1 . . . . 232 TYR N . 17623 1 638 . 1 1 89 89 GLN H H 1 7.628 0.02 . 1 . . . . 233 GLN H . 17623 1 639 . 1 1 89 89 GLN HE21 H 1 6.288 0.02 . 2 . . . . 233 GLN HE21 . 17623 1 640 . 1 1 89 89 GLN HE22 H 1 8.010 0.02 . 2 . . . . 233 GLN HE22 . 17623 1 641 . 1 1 89 89 GLN N N 15 125.623 0.2 . 1 . . . . 233 GLN N . 17623 1 642 . 1 1 89 89 GLN NE2 N 15 112.262 0.2 . 1 . . . . 233 GLN NE2 . 17623 1 643 . 1 1 91 91 LEU H H 1 7.761 0.02 . 1 . . . . 235 LEU H . 17623 1 644 . 1 1 91 91 LEU N N 15 123.913 0.2 . 1 . . . . 235 LEU N . 17623 1 645 . 1 1 93 93 GLY H H 1 8.560 0.02 . 1 . . . . 237 GLY H . 17623 1 646 . 1 1 93 93 GLY N N 15 108.655 0.2 . 1 . . . . 237 GLY N . 17623 1 647 . 1 1 94 94 MET H H 1 8.026 0.02 . 1 . . . . 238 MET H . 17623 1 648 . 1 1 94 94 MET N N 15 119.712 0.2 . 1 . . . . 238 MET N . 17623 1 649 . 1 1 95 95 SER H H 1 8.278 0.02 . 1 . . . . 239 SER H . 17623 1 650 . 1 1 95 95 SER N N 15 116.807 0.2 . 1 . . . . 239 SER N . 17623 1 651 . 1 1 96 96 GLU H H 1 9.291 0.02 . 1 . . . . 240 GLU H . 17623 1 652 . 1 1 96 96 GLU N N 15 118.697 0.2 . 1 . . . . 240 GLU N . 17623 1 653 . 1 1 97 97 ASN H H 1 7.214 0.02 . 1 . . . . 241 ASN H . 17623 1 654 . 1 1 97 97 ASN N N 15 121.955 0.2 . 1 . . . . 241 ASN N . 17623 1 655 . 1 1 99 99 SER H H 1 8.287 0.02 . 1 . . . . 243 SER H . 17623 1 656 . 1 1 99 99 SER HA H 1 4.468 0.02 . 1 . . . . 243 SER HA . 17623 1 657 . 1 1 99 99 SER HB2 H 1 3.773 0.02 . 2 . . . . 243 SER HB2 . 17623 1 658 . 1 1 99 99 SER HB3 H 1 3.783 0.02 . 2 . . . . 243 SER HB3 . 17623 1 659 . 1 1 99 99 SER CA C 13 58.259 0.2 . 1 . . . . 243 SER CA . 17623 1 660 . 1 1 99 99 SER CB C 13 63.590 0.2 . 1 . . . . 243 SER CB . 17623 1 661 . 1 1 99 99 SER N N 15 115.933 0.2 . 1 . . . . 243 SER N . 17623 1 662 . 1 1 100 100 VAL H H 1 7.209 0.02 . 1 . . . . 244 VAL H . 17623 1 663 . 1 1 100 100 VAL N N 15 121.473 0.2 . 1 . . . . 244 VAL N . 17623 1 664 . 1 1 101 101 TYR H H 1 8.142 0.02 . 1 . . . . 245 TYR H . 17623 1 665 . 1 1 101 101 TYR HA H 1 4.556 0.02 . 1 . . . . 245 TYR HA . 17623 1 666 . 1 1 101 101 TYR HB2 H 1 2.963 0.02 . 2 . . . . 245 TYR HB2 . 17623 1 667 . 1 1 101 101 TYR HB3 H 1 2.763 0.02 . 2 . . . . 245 TYR HB3 . 17623 1 668 . 1 1 101 101 TYR HD1 H 1 7.019 0.02 . 1 . . . . 245 TYR HD1 . 17623 1 669 . 1 1 101 101 TYR HD2 H 1 7.019 0.02 . 1 . . . . 245 TYR HD2 . 17623 1 670 . 1 1 101 101 TYR HE1 H 1 6.732 0.02 . 1 . . . . 245 TYR HE1 . 17623 1 671 . 1 1 101 101 TYR HE2 H 1 6.732 0.02 . 1 . . . . 245 TYR HE2 . 17623 1 672 . 1 1 101 101 TYR CA C 13 58.085 0.2 . 1 . . . . 245 TYR CA . 17623 1 673 . 1 1 101 101 TYR CB C 13 38.868 0.2 . 1 . . . . 245 TYR CB . 17623 1 674 . 1 1 101 101 TYR N N 15 124.214 0.2 . 1 . . . . 245 TYR N . 17623 1 675 . 1 1 102 102 VAL H H 1 8.033 0.02 . 1 . . . . 246 VAL H . 17623 1 676 . 1 1 102 102 VAL N N 15 128.355 0.2 . 1 . . . . 246 VAL N . 17623 1 677 . 1 1 104 104 GLY H H 1 8.335 0.02 . 1 . . . . 248 GLY H . 17623 1 678 . 1 1 104 104 GLY N N 15 109.924 0.2 . 1 . . . . 248 GLY N . 17623 1 679 . 1 1 106 106 VAL H H 1 8.532 0.02 . 1 . . . . 250 VAL H . 17623 1 680 . 1 1 106 106 VAL N N 15 128.552 0.2 . 1 . . . . 250 VAL N . 17623 1 681 . 1 1 107 107 SER H H 1 7.756 0.02 . 1 . . . . 251 SER H . 17623 1 682 . 1 1 107 107 SER N N 15 123.621 0.2 . 1 . . . . 251 SER N . 17623 1 683 . 1 1 108 108 THR H H 1 7.949 0.02 . 1 . . . . 252 THR H . 17623 1 684 . 1 1 108 108 THR N N 15 113.533 0.2 . 1 . . . . 252 THR N . 17623 1 685 . 1 1 109 109 VAL H H 1 7.209 0.02 . 1 . . . . 253 VAL H . 17623 1 686 . 1 1 109 109 VAL N N 15 121.166 0.2 . 1 . . . . 253 VAL N . 17623 1 687 . 1 1 110 110 VAL H H 1 8.524 0.02 . 1 . . . . 254 VAL H . 17623 1 688 . 1 1 110 110 VAL N N 15 128.827 0.2 . 1 . . . . 254 VAL N . 17623 1 689 . 1 1 114 114 ALA HA H 1 4.093 0.02 . 1 . . . . 258 ALA HA . 17623 1 690 . 1 1 114 114 ALA HB1 H 1 1.031 0.02 . 1 . . . . 258 ALA HB . 17623 1 691 . 1 1 114 114 ALA HB2 H 1 1.031 0.02 . 1 . . . . 258 ALA HB . 17623 1 692 . 1 1 114 114 ALA HB3 H 1 1.031 0.02 . 1 . . . . 258 ALA HB . 17623 1 693 . 1 1 114 114 ALA CA C 13 53.867 0.2 . 1 . . . . 258 ALA CA . 17623 1 694 . 1 1 114 114 ALA CB C 13 18.168 0.2 . 1 . . . . 258 ALA CB . 17623 1 695 . 1 1 115 115 HIS HB2 H 1 3.545 0.02 . 2 . . . . 259 HIS HB2 . 17623 1 696 . 1 1 115 115 HIS HB3 H 1 2.766 0.02 . 2 . . . . 259 HIS HB3 . 17623 1 697 . 1 1 115 115 HIS HD2 H 1 7.021 0.02 . 1 . . . . 259 HIS HD2 . 17623 1 698 . 1 1 115 115 HIS CB C 13 31.098 0.2 . 1 . . . . 259 HIS CB . 17623 1 699 . 1 1 116 116 LYS H H 1 7.035 0.02 . 1 . . . . 260 LYS H . 17623 1 700 . 1 1 116 116 LYS N N 15 122.657 0.2 . 1 . . . . 260 LYS N . 17623 1 701 . 1 1 117 117 LEU H H 1 9.749 0.02 . 1 . . . . 261 LEU H . 17623 1 702 . 1 1 117 117 LEU HA H 1 4.844 0.02 . 1 . . . . 261 LEU HA . 17623 1 703 . 1 1 117 117 LEU HB2 H 1 2.122 0.02 . 2 . . . . 261 LEU HB2 . 17623 1 704 . 1 1 117 117 LEU HB3 H 1 1.149 0.02 . 2 . . . . 261 LEU HB3 . 17623 1 705 . 1 1 117 117 LEU HG H 1 1.886 0.02 . 1 . . . . 261 LEU HG . 17623 1 706 . 1 1 117 117 LEU HD11 H 1 0.632 0.02 . 4 . . . . 261 LEU HD1 . 17623 1 707 . 1 1 117 117 LEU HD12 H 1 0.632 0.02 . 4 . . . . 261 LEU HD1 . 17623 1 708 . 1 1 117 117 LEU HD13 H 1 0.632 0.02 . 4 . . . . 261 LEU HD1 . 17623 1 709 . 1 1 117 117 LEU HD21 H 1 0.857 0.02 . 4 . . . . 261 LEU HD2 . 17623 1 710 . 1 1 117 117 LEU HD22 H 1 0.857 0.02 . 4 . . . . 261 LEU HD2 . 17623 1 711 . 1 1 117 117 LEU HD23 H 1 0.857 0.02 . 4 . . . . 261 LEU HD2 . 17623 1 712 . 1 1 117 117 LEU CA C 13 54.463 0.2 . 1 . . . . 261 LEU CA . 17623 1 713 . 1 1 117 117 LEU CB C 13 44.880 0.2 . 1 . . . . 261 LEU CB . 17623 1 714 . 1 1 117 117 LEU CG C 13 26.346 0.2 . 1 . . . . 261 LEU CG . 17623 1 715 . 1 1 117 117 LEU CD1 C 13 24.441 0.2 . 2 . . . . 261 LEU CD1 . 17623 1 716 . 1 1 117 117 LEU CD2 C 13 25.697 0.2 . 2 . . . . 261 LEU CD2 . 17623 1 717 . 1 1 117 117 LEU N N 15 130.231 0.2 . 1 . . . . 261 LEU N . 17623 1 718 . 1 1 118 118 PHE H H 1 9.079 0.02 . 1 . . . . 262 PHE H . 17623 1 719 . 1 1 118 118 PHE HA H 1 4.334 0.02 . 1 . . . . 262 PHE HA . 17623 1 720 . 1 1 118 118 PHE CA C 13 56.560 0.2 . 1 . . . . 262 PHE CA . 17623 1 721 . 1 1 118 118 PHE N N 15 121.275 0.2 . 1 . . . . 262 PHE N . 17623 1 722 . 1 1 119 119 ILE H H 1 7.846 0.02 . 1 . . . . 263 ILE H . 17623 1 723 . 1 1 119 119 ILE HA H 1 4.496 0.02 . 1 . . . . 263 ILE HA . 17623 1 724 . 1 1 119 119 ILE HB H 1 1.389 0.02 . 1 . . . . 263 ILE HB . 17623 1 725 . 1 1 119 119 ILE HG12 H 1 1.223 0.02 . 2 . . . . 263 ILE HG12 . 17623 1 726 . 1 1 119 119 ILE HG13 H 1 0.949 0.02 . 2 . . . . 263 ILE HG13 . 17623 1 727 . 1 1 119 119 ILE HG21 H 1 0.518 0.02 . 1 . . . . 263 ILE HG2 . 17623 1 728 . 1 1 119 119 ILE HG22 H 1 0.518 0.02 . 1 . . . . 263 ILE HG2 . 17623 1 729 . 1 1 119 119 ILE HG23 H 1 0.518 0.02 . 1 . . . . 263 ILE HG2 . 17623 1 730 . 1 1 119 119 ILE HD11 H 1 0.610 0.02 . 1 . . . . 263 ILE HD1 . 17623 1 731 . 1 1 119 119 ILE HD12 H 1 0.610 0.02 . 1 . . . . 263 ILE HD1 . 17623 1 732 . 1 1 119 119 ILE HD13 H 1 0.610 0.02 . 1 . . . . 263 ILE HD1 . 17623 1 733 . 1 1 119 119 ILE CA C 13 59.201 0.2 . 1 . . . . 263 ILE CA . 17623 1 734 . 1 1 119 119 ILE CB C 13 39.293 0.2 . 1 . . . . 263 ILE CB . 17623 1 735 . 1 1 119 119 ILE CG1 C 13 28.318 0.2 . 1 . . . . 263 ILE CG1 . 17623 1 736 . 1 1 119 119 ILE CG2 C 13 19.322 0.2 . 1 . . . . 263 ILE CG2 . 17623 1 737 . 1 1 119 119 ILE CD1 C 13 16.043 0.2 . 1 . . . . 263 ILE CD1 . 17623 1 738 . 1 1 119 119 ILE N N 15 126.497 0.2 . 1 . . . . 263 ILE N . 17623 1 739 . 1 1 120 120 GLY H H 1 9.161 0.02 . 1 . . . . 264 GLY H . 17623 1 740 . 1 1 120 120 GLY HA2 H 1 4.443 0.02 . 2 . . . . 264 GLY HA2 . 17623 1 741 . 1 1 120 120 GLY HA3 H 1 3.342 0.02 . 2 . . . . 264 GLY HA3 . 17623 1 742 . 1 1 120 120 GLY CA C 13 43.431 0.2 . 1 . . . . 264 GLY CA . 17623 1 743 . 1 1 120 120 GLY N N 15 111.640 0.2 . 1 . . . . 264 GLY N . 17623 1 744 . 1 1 121 121 GLY H H 1 8.594 0.02 . 1 . . . . 265 GLY H . 17623 1 745 . 1 1 121 121 GLY N N 15 108.284 0.2 . 1 . . . . 265 GLY N . 17623 1 746 . 1 1 122 122 LEU H H 1 7.521 0.02 . 1 . . . . 266 LEU H . 17623 1 747 . 1 1 122 122 LEU HA H 1 3.821 0.02 . 1 . . . . 266 LEU HA . 17623 1 748 . 1 1 122 122 LEU HB2 H 1 0.929 0.02 . 2 . . . . 266 LEU HB2 . 17623 1 749 . 1 1 122 122 LEU HB3 H 1 0.846 0.02 . 2 . . . . 266 LEU HB3 . 17623 1 750 . 1 1 122 122 LEU HG H 1 1.089 0.02 . 1 . . . . 266 LEU HG . 17623 1 751 . 1 1 122 122 LEU HD11 H 1 0.386 0.02 . 4 . . . . 266 LEU HD1 . 17623 1 752 . 1 1 122 122 LEU HD12 H 1 0.386 0.02 . 4 . . . . 266 LEU HD1 . 17623 1 753 . 1 1 122 122 LEU HD13 H 1 0.386 0.02 . 4 . . . . 266 LEU HD1 . 17623 1 754 . 1 1 122 122 LEU HD21 H 1 0.492 0.02 . 4 . . . . 266 LEU HD2 . 17623 1 755 . 1 1 122 122 LEU HD22 H 1 0.492 0.02 . 4 . . . . 266 LEU HD2 . 17623 1 756 . 1 1 122 122 LEU HD23 H 1 0.492 0.02 . 4 . . . . 266 LEU HD2 . 17623 1 757 . 1 1 122 122 LEU CA C 13 52.337 0.2 . 1 . . . . 266 LEU CA . 17623 1 758 . 1 1 122 122 LEU CB C 13 42.262 0.2 . 1 . . . . 266 LEU CB . 17623 1 759 . 1 1 122 122 LEU CG C 13 26.322 0.2 . 1 . . . . 266 LEU CG . 17623 1 760 . 1 1 122 122 LEU CD1 C 13 26.641 0.2 . 2 . . . . 266 LEU CD1 . 17623 1 761 . 1 1 122 122 LEU CD2 C 13 24.124 0.2 . 2 . . . . 266 LEU CD2 . 17623 1 762 . 1 1 122 122 LEU N N 15 116.285 0.2 . 1 . . . . 266 LEU N . 17623 1 763 . 1 1 123 123 PRO HA H 1 4.125 0.02 . 1 . . . . 267 PRO HA . 17623 1 764 . 1 1 123 123 PRO HB2 H 1 0.759 0.02 . 2 . . . . 267 PRO HB2 . 17623 1 765 . 1 1 123 123 PRO HD2 H 1 3.781 0.02 . 2 . . . . 267 PRO HD2 . 17623 1 766 . 1 1 123 123 PRO HD3 H 1 3.111 0.02 . 2 . . . . 267 PRO HD3 . 17623 1 767 . 1 1 123 123 PRO CA C 13 62.495 0.2 . 1 . . . . 267 PRO CA . 17623 1 768 . 1 1 123 123 PRO CB C 13 31.792 0.2 . 1 . . . . 267 PRO CB . 17623 1 769 . 1 1 123 123 PRO CD C 13 49.982 0.2 . 1 . . . . 267 PRO CD . 17623 1 770 . 1 1 124 124 ASN HA H 1 3.913 0.02 . 1 . . . . 268 ASN HA . 17623 1 771 . 1 1 124 124 ASN HB2 H 1 3.002 0.02 . 2 . . . . 268 ASN HB2 . 17623 1 772 . 1 1 124 124 ASN HB3 H 1 2.747 0.02 . 2 . . . . 268 ASN HB3 . 17623 1 773 . 1 1 124 124 ASN HD21 H 1 7.471 0.02 . 2 . . . . 268 ASN HD21 . 17623 1 774 . 1 1 124 124 ASN HD22 H 1 6.818 0.02 . 2 . . . . 268 ASN HD22 . 17623 1 775 . 1 1 124 124 ASN CA C 13 55.254 0.2 . 1 . . . . 268 ASN CA . 17623 1 776 . 1 1 124 124 ASN CB C 13 37.355 0.2 . 1 . . . . 268 ASN CB . 17623 1 777 . 1 1 124 124 ASN ND2 N 15 110.181 0.2 . 1 . . . . 268 ASN ND2 . 17623 1 778 . 1 1 125 125 TYR H H 1 6.493 0.02 . 1 . . . . 269 TYR H . 17623 1 779 . 1 1 125 125 TYR HA H 1 4.513 0.02 . 1 . . . . 269 TYR HA . 17623 1 780 . 1 1 125 125 TYR HB2 H 1 3.347 0.02 . 2 . . . . 269 TYR HB2 . 17623 1 781 . 1 1 125 125 TYR HB3 H 1 2.759 0.02 . 2 . . . . 269 TYR HB3 . 17623 1 782 . 1 1 125 125 TYR HD1 H 1 6.976 0.02 . 1 . . . . 269 TYR HD1 . 17623 1 783 . 1 1 125 125 TYR HD2 H 1 6.976 0.02 . 1 . . . . 269 TYR HD2 . 17623 1 784 . 1 1 125 125 TYR HE1 H 1 6.768 0.02 . 1 . . . . 269 TYR HE1 . 17623 1 785 . 1 1 125 125 TYR HE2 H 1 6.768 0.02 . 1 . . . . 269 TYR HE2 . 17623 1 786 . 1 1 125 125 TYR CA C 13 55.416 0.2 . 1 . . . . 269 TYR CA . 17623 1 787 . 1 1 125 125 TYR CB C 13 37.024 0.2 . 1 . . . . 269 TYR CB . 17623 1 788 . 1 1 125 125 TYR N N 15 110.976 0.2 . 1 . . . . 269 TYR N . 17623 1 789 . 1 1 126 126 LEU H H 1 6.458 0.02 . 1 . . . . 270 LEU H . 17623 1 790 . 1 1 126 126 LEU HA H 1 4.537 0.02 . 1 . . . . 270 LEU HA . 17623 1 791 . 1 1 126 126 LEU HB2 H 1 1.400 0.02 . 2 . . . . 270 LEU HB2 . 17623 1 792 . 1 1 126 126 LEU HB3 H 1 1.128 0.02 . 2 . . . . 270 LEU HB3 . 17623 1 793 . 1 1 126 126 LEU HG H 1 1.046 0.02 . 1 . . . . 270 LEU HG . 17623 1 794 . 1 1 126 126 LEU HD11 H 1 0.677 0.02 . 4 . . . . 270 LEU HD1 . 17623 1 795 . 1 1 126 126 LEU HD12 H 1 0.677 0.02 . 4 . . . . 270 LEU HD1 . 17623 1 796 . 1 1 126 126 LEU HD13 H 1 0.677 0.02 . 4 . . . . 270 LEU HD1 . 17623 1 797 . 1 1 126 126 LEU HD21 H 1 0.608 0.02 . 4 . . . . 270 LEU HD2 . 17623 1 798 . 1 1 126 126 LEU HD22 H 1 0.608 0.02 . 4 . . . . 270 LEU HD2 . 17623 1 799 . 1 1 126 126 LEU HD23 H 1 0.608 0.02 . 4 . . . . 270 LEU HD2 . 17623 1 800 . 1 1 126 126 LEU CA C 13 54.343 0.2 . 1 . . . . 270 LEU CA . 17623 1 801 . 1 1 126 126 LEU CB C 13 42.350 0.2 . 1 . . . . 270 LEU CB . 17623 1 802 . 1 1 126 126 LEU CG C 13 26.917 0.2 . 1 . . . . 270 LEU CG . 17623 1 803 . 1 1 126 126 LEU CD1 C 13 22.959 0.2 . 2 . . . . 270 LEU CD1 . 17623 1 804 . 1 1 126 126 LEU CD2 C 13 26.331 0.2 . 2 . . . . 270 LEU CD2 . 17623 1 805 . 1 1 126 126 LEU N N 15 122.190 0.2 . 1 . . . . 270 LEU N . 17623 1 806 . 1 1 127 127 ASN H H 1 8.767 0.02 . 1 . . . . 271 ASN H . 17623 1 807 . 1 1 127 127 ASN HA H 1 4.661 0.02 . 1 . . . . 271 ASN HA . 17623 1 808 . 1 1 127 127 ASN HB2 H 1 3.285 0.02 . 2 . . . . 271 ASN HB2 . 17623 1 809 . 1 1 127 127 ASN HB3 H 1 2.882 0.02 . 2 . . . . 271 ASN HB3 . 17623 1 810 . 1 1 127 127 ASN HD21 H 1 7.168 0.02 . 2 . . . . 271 ASN HD21 . 17623 1 811 . 1 1 127 127 ASN CA C 13 50.931 0.2 . 1 . . . . 271 ASN CA . 17623 1 812 . 1 1 127 127 ASN CB C 13 39.351 0.2 . 1 . . . . 271 ASN CB . 17623 1 813 . 1 1 127 127 ASN N N 15 122.931 0.2 . 1 . . . . 271 ASN N . 17623 1 814 . 1 1 127 127 ASN ND2 N 15 110.868 0.2 . 1 . . . . 271 ASN ND2 . 17623 1 815 . 1 1 128 128 ASP H H 1 8.542 0.02 . 1 . . . . 272 ASP H . 17623 1 816 . 1 1 128 128 ASP HA H 1 3.966 0.02 . 1 . . . . 272 ASP HA . 17623 1 817 . 1 1 128 128 ASP HB2 H 1 2.673 0.02 . 2 . . . . 272 ASP HB2 . 17623 1 818 . 1 1 128 128 ASP HB3 H 1 2.527 0.02 . 2 . . . . 272 ASP HB3 . 17623 1 819 . 1 1 128 128 ASP CA C 13 58.577 0.2 . 1 . . . . 272 ASP CA . 17623 1 820 . 1 1 128 128 ASP CB C 13 41.062 0.2 . 1 . . . . 272 ASP CB . 17623 1 821 . 1 1 128 128 ASP N N 15 115.278 0.2 . 1 . . . . 272 ASP N . 17623 1 822 . 1 1 129 129 ASP H H 1 7.855 0.02 . 1 . . . . 273 ASP H . 17623 1 823 . 1 1 129 129 ASP HA H 1 4.074 0.02 . 1 . . . . 273 ASP HA . 17623 1 824 . 1 1 129 129 ASP HB2 H 1 2.585 0.02 . 2 . . . . 273 ASP HB2 . 17623 1 825 . 1 1 129 129 ASP HB3 H 1 2.519 0.02 . 2 . . . . 273 ASP HB3 . 17623 1 826 . 1 1 129 129 ASP CA C 13 57.512 0.2 . 1 . . . . 273 ASP CA . 17623 1 827 . 1 1 129 129 ASP CB C 13 40.377 0.2 . 1 . . . . 273 ASP CB . 17623 1 828 . 1 1 129 129 ASP N N 15 116.964 0.2 . 1 . . . . 273 ASP N . 17623 1 829 . 1 1 130 130 GLN H H 1 8.243 0.02 . 1 . . . . 274 GLN H . 17623 1 830 . 1 1 130 130 GLN N N 15 120.165 0.2 . 1 . . . . 274 GLN N . 17623 1 831 . 1 1 131 131 VAL H H 1 8.256 0.02 . 1 . . . . 275 VAL H . 17623 1 832 . 1 1 131 131 VAL HA H 1 3.411 0.02 . 1 . . . . 275 VAL HA . 17623 1 833 . 1 1 131 131 VAL HB H 1 2.014 0.02 . 1 . . . . 275 VAL HB . 17623 1 834 . 1 1 131 131 VAL HG11 H 1 0.809 0.02 . 4 . . . . 275 VAL HG1 . 17623 1 835 . 1 1 131 131 VAL HG12 H 1 0.809 0.02 . 4 . . . . 275 VAL HG1 . 17623 1 836 . 1 1 131 131 VAL HG13 H 1 0.809 0.02 . 4 . . . . 275 VAL HG1 . 17623 1 837 . 1 1 131 131 VAL HG21 H 1 0.909 0.02 . 4 . . . . 275 VAL HG2 . 17623 1 838 . 1 1 131 131 VAL HG22 H 1 0.909 0.02 . 4 . . . . 275 VAL HG2 . 17623 1 839 . 1 1 131 131 VAL HG23 H 1 0.909 0.02 . 4 . . . . 275 VAL HG2 . 17623 1 840 . 1 1 131 131 VAL CA C 13 66.865 0.2 . 1 . . . . 275 VAL CA . 17623 1 841 . 1 1 131 131 VAL CB C 13 31.744 0.2 . 1 . . . . 275 VAL CB . 17623 1 842 . 1 1 131 131 VAL CG1 C 13 22.540 0.2 . 2 . . . . 275 VAL CG1 . 17623 1 843 . 1 1 131 131 VAL CG2 C 13 24.563 0.2 . 2 . . . . 275 VAL CG2 . 17623 1 844 . 1 1 131 131 VAL N N 15 120.485 0.2 . 1 . . . . 275 VAL N . 17623 1 845 . 1 1 132 132 LYS H H 1 8.178 0.02 . 1 . . . . 276 LYS H . 17623 1 846 . 1 1 132 132 LYS HA H 1 3.076 0.02 . 1 . . . . 276 LYS HA . 17623 1 847 . 1 1 132 132 LYS HB2 H 1 1.403 0.02 . 2 . . . . 276 LYS HB2 . 17623 1 848 . 1 1 132 132 LYS HB3 H 1 1.367 0.02 . 2 . . . . 276 LYS HB3 . 17623 1 849 . 1 1 132 132 LYS HG2 H 1 0.429 0.02 . 2 . . . . 276 LYS HG2 . 17623 1 850 . 1 1 132 132 LYS HG3 H 1 0.149 0.02 . 2 . . . . 276 LYS HG3 . 17623 1 851 . 1 1 132 132 LYS HD2 H 1 1.256 0.02 . 2 . . . . 276 LYS HD2 . 17623 1 852 . 1 1 132 132 LYS HD3 H 1 1.256 0.02 . 2 . . . . 276 LYS HD3 . 17623 1 853 . 1 1 132 132 LYS HE2 H 1 2.529 0.02 . 2 . . . . 276 LYS HE2 . 17623 1 854 . 1 1 132 132 LYS HE3 H 1 2.489 0.02 . 2 . . . . 276 LYS HE3 . 17623 1 855 . 1 1 132 132 LYS CA C 13 61.152 0.2 . 1 . . . . 276 LYS CA . 17623 1 856 . 1 1 132 132 LYS CB C 13 31.491 0.2 . 1 . . . . 276 LYS CB . 17623 1 857 . 1 1 132 132 LYS CG C 13 25.213 0.2 . 1 . . . . 276 LYS CG . 17623 1 858 . 1 1 132 132 LYS CD C 13 29.360 0.2 . 1 . . . . 276 LYS CD . 17623 1 859 . 1 1 132 132 LYS CE C 13 41.491 0.2 . 1 . . . . 276 LYS CE . 17623 1 860 . 1 1 132 132 LYS N N 15 119.025 0.2 . 1 . . . . 276 LYS N . 17623 1 861 . 1 1 133 133 GLU H H 1 7.836 0.02 . 1 . . . . 277 GLU H . 17623 1 862 . 1 1 133 133 GLU HA H 1 3.786 0.02 . 1 . . . . 277 GLU HA . 17623 1 863 . 1 1 133 133 GLU HB2 H 1 1.986 0.02 . 2 . . . . 277 GLU HB2 . 17623 1 864 . 1 1 133 133 GLU HB3 H 1 1.900 0.02 . 2 . . . . 277 GLU HB3 . 17623 1 865 . 1 1 133 133 GLU HG2 H 1 2.187 0.02 . 2 . . . . 277 GLU HG2 . 17623 1 866 . 1 1 133 133 GLU HG3 H 1 2.069 0.02 . 2 . . . . 277 GLU HG3 . 17623 1 867 . 1 1 133 133 GLU CA C 13 59.373 0.2 . 1 . . . . 277 GLU CA . 17623 1 868 . 1 1 133 133 GLU CB C 13 29.343 0.2 . 1 . . . . 277 GLU CB . 17623 1 869 . 1 1 133 133 GLU CG C 13 36.279 0.2 . 1 . . . . 277 GLU CG . 17623 1 870 . 1 1 133 133 GLU N N 15 119.263 0.2 . 1 . . . . 277 GLU N . 17623 1 871 . 1 1 134 134 LEU H H 1 7.074 0.02 . 1 . . . . 278 LEU H . 17623 1 872 . 1 1 134 134 LEU N N 15 118.860 0.2 . 1 . . . . 278 LEU N . 17623 1 873 . 1 1 135 135 LEU H H 1 7.559 0.02 . 1 . . . . 279 LEU H . 17623 1 874 . 1 1 135 135 LEU HA H 1 4.024 0.02 . 1 . . . . 279 LEU HA . 17623 1 875 . 1 1 135 135 LEU HB2 H 1 1.505 0.02 . 2 . . . . 279 LEU HB2 . 17623 1 876 . 1 1 135 135 LEU HB3 H 1 1.456 0.02 . 2 . . . . 279 LEU HB3 . 17623 1 877 . 1 1 135 135 LEU CA C 13 57.520 0.2 . 1 . . . . 279 LEU CA . 17623 1 878 . 1 1 135 135 LEU CB C 13 41.643 0.2 . 1 . . . . 279 LEU CB . 17623 1 879 . 1 1 135 135 LEU N N 15 116.368 0.2 . 1 . . . . 279 LEU N . 17623 1 880 . 1 1 136 136 THR H H 1 8.933 0.02 . 1 . . . . 280 THR H . 17623 1 881 . 1 1 136 136 THR HA H 1 4.991 0.02 . 1 . . . . 280 THR HA . 17623 1 882 . 1 1 136 136 THR HB H 1 4.260 0.02 . 1 . . . . 280 THR HB . 17623 1 883 . 1 1 136 136 THR HG21 H 1 1.225 0.02 . 1 . . . . 280 THR HG2 . 17623 1 884 . 1 1 136 136 THR HG22 H 1 1.225 0.02 . 1 . . . . 280 THR HG2 . 17623 1 885 . 1 1 136 136 THR HG23 H 1 1.225 0.02 . 1 . . . . 280 THR HG2 . 17623 1 886 . 1 1 136 136 THR CA C 13 63.845 0.2 . 1 . . . . 280 THR CA . 17623 1 887 . 1 1 136 136 THR CB C 13 68.788 0.2 . 1 . . . . 280 THR CB . 17623 1 888 . 1 1 136 136 THR CG2 C 13 21.818 0.2 . 1 . . . . 280 THR CG2 . 17623 1 889 . 1 1 136 136 THR N N 15 113.267 0.2 . 1 . . . . 280 THR N . 17623 1 890 . 1 1 137 137 SER H H 1 7.217 0.02 . 1 . . . . 281 SER H . 17623 1 891 . 1 1 137 137 SER HA H 1 4.002 0.02 . 1 . . . . 281 SER HA . 17623 1 892 . 1 1 137 137 SER HB2 H 1 3.541 0.02 . 2 . . . . 281 SER HB2 . 17623 1 893 . 1 1 137 137 SER HB3 H 1 3.468 0.02 . 2 . . . . 281 SER HB3 . 17623 1 894 . 1 1 137 137 SER CA C 13 61.062 0.2 . 1 . . . . 281 SER CA . 17623 1 895 . 1 1 137 137 SER CB C 13 62.312 0.2 . 1 . . . . 281 SER CB . 17623 1 896 . 1 1 137 137 SER N N 15 117.789 0.2 . 1 . . . . 281 SER N . 17623 1 897 . 1 1 138 138 PHE H H 1 7.147 0.02 . 1 . . . . 282 PHE H . 17623 1 898 . 1 1 138 138 PHE HA H 1 4.126 0.02 . 1 . . . . 282 PHE HA . 17623 1 899 . 1 1 138 138 PHE HB2 H 1 2.876 0.02 . 2 . . . . 282 PHE HB2 . 17623 1 900 . 1 1 138 138 PHE HB3 H 1 2.587 0.02 . 2 . . . . 282 PHE HB3 . 17623 1 901 . 1 1 138 138 PHE HD1 H 1 7.171 0.02 . 1 . . . . 282 PHE HD1 . 17623 1 902 . 1 1 138 138 PHE HD2 H 1 7.171 0.02 . 1 . . . . 282 PHE HD2 . 17623 1 903 . 1 1 138 138 PHE CA C 13 59.647 0.2 . 1 . . . . 282 PHE CA . 17623 1 904 . 1 1 138 138 PHE CB C 13 39.216 0.2 . 1 . . . . 282 PHE CB . 17623 1 905 . 1 1 138 138 PHE N N 15 116.333 0.2 . 1 . . . . 282 PHE N . 17623 1 906 . 1 1 139 139 GLY H H 1 7.213 0.02 . 1 . . . . 283 GLY H . 17623 1 907 . 1 1 139 139 GLY HA2 H 1 4.348 0.02 . 2 . . . . 283 GLY HA2 . 17623 1 908 . 1 1 139 139 GLY HA3 H 1 3.918 0.02 . 2 . . . . 283 GLY HA3 . 17623 1 909 . 1 1 139 139 GLY CA C 13 44.468 0.2 . 1 . . . . 283 GLY CA . 17623 1 910 . 1 1 139 139 GLY N N 15 108.262 0.2 . 1 . . . . 283 GLY N . 17623 1 911 . 1 1 140 140 PRO HA H 1 4.443 0.02 . 1 . . . . 284 PRO HA . 17623 1 912 . 1 1 140 140 PRO HB2 H 1 2.260 0.02 . 2 . . . . 284 PRO HB2 . 17623 1 913 . 1 1 140 140 PRO HB3 H 1 1.785 0.02 . 2 . . . . 284 PRO HB3 . 17623 1 914 . 1 1 140 140 PRO HG2 H 1 1.986 0.02 . 2 . . . . 284 PRO HG2 . 17623 1 915 . 1 1 140 140 PRO HG3 H 1 1.909 0.02 . 2 . . . . 284 PRO HG3 . 17623 1 916 . 1 1 140 140 PRO HD2 H 1 3.739 0.02 . 2 . . . . 284 PRO HD2 . 17623 1 917 . 1 1 140 140 PRO HD3 H 1 3.540 0.02 . 2 . . . . 284 PRO HD3 . 17623 1 918 . 1 1 140 140 PRO CA C 13 62.826 0.2 . 1 . . . . 284 PRO CA . 17623 1 919 . 1 1 140 140 PRO CB C 13 32.565 0.2 . 1 . . . . 284 PRO CB . 17623 1 920 . 1 1 140 140 PRO CG C 13 27.722 0.2 . 1 . . . . 284 PRO CG . 17623 1 921 . 1 1 140 140 PRO CD C 13 49.634 0.2 . 1 . . . . 284 PRO CD . 17623 1 922 . 1 1 141 141 LEU H H 1 8.695 0.02 . 1 . . . . 285 LEU H . 17623 1 923 . 1 1 141 141 LEU HA H 1 4.279 0.02 . 1 . . . . 285 LEU HA . 17623 1 924 . 1 1 141 141 LEU HB2 H 1 1.553 0.02 . 2 . . . . 285 LEU HB2 . 17623 1 925 . 1 1 141 141 LEU HB3 H 1 1.051 0.02 . 2 . . . . 285 LEU HB3 . 17623 1 926 . 1 1 141 141 LEU HG H 1 1.504 0.02 . 1 . . . . 285 LEU HG . 17623 1 927 . 1 1 141 141 LEU HD11 H 1 0.095 0.02 . 4 . . . . 285 LEU HD1 . 17623 1 928 . 1 1 141 141 LEU HD12 H 1 0.095 0.02 . 4 . . . . 285 LEU HD1 . 17623 1 929 . 1 1 141 141 LEU HD13 H 1 0.095 0.02 . 4 . . . . 285 LEU HD1 . 17623 1 930 . 1 1 141 141 LEU HD21 H 1 0.581 0.02 . 4 . . . . 285 LEU HD2 . 17623 1 931 . 1 1 141 141 LEU HD22 H 1 0.581 0.02 . 4 . . . . 285 LEU HD2 . 17623 1 932 . 1 1 141 141 LEU HD23 H 1 0.581 0.02 . 4 . . . . 285 LEU HD2 . 17623 1 933 . 1 1 141 141 LEU CA C 13 54.058 0.2 . 1 . . . . 285 LEU CA . 17623 1 934 . 1 1 141 141 LEU CB C 13 44.227 0.2 . 1 . . . . 285 LEU CB . 17623 1 935 . 1 1 141 141 LEU CG C 13 25.608 0.2 . 1 . . . . 285 LEU CG . 17623 1 936 . 1 1 141 141 LEU CD1 C 13 23.047 0.2 . 2 . . . . 285 LEU CD1 . 17623 1 937 . 1 1 141 141 LEU CD2 C 13 26.683 0.2 . 2 . . . . 285 LEU CD2 . 17623 1 938 . 1 1 141 141 LEU N N 15 121.667 0.2 . 1 . . . . 285 LEU N . 17623 1 939 . 1 1 142 142 LYS H H 1 9.306 0.02 . 1 . . . . 286 LYS H . 17623 1 940 . 1 1 142 142 LYS N N 15 118.386 0.2 . 1 . . . . 286 LYS N . 17623 1 941 . 1 1 143 143 ALA H H 1 7.667 0.02 . 1 . . . . 287 ALA H . 17623 1 942 . 1 1 143 143 ALA HA H 1 4.537 0.02 . 1 . . . . 287 ALA HA . 17623 1 943 . 1 1 143 143 ALA HB1 H 1 1.268 0.02 . 1 . . . . 287 ALA HB . 17623 1 944 . 1 1 143 143 ALA HB2 H 1 1.268 0.02 . 1 . . . . 287 ALA HB . 17623 1 945 . 1 1 143 143 ALA HB3 H 1 1.268 0.02 . 1 . . . . 287 ALA HB . 17623 1 946 . 1 1 143 143 ALA CA C 13 51.828 0.2 . 1 . . . . 287 ALA CA . 17623 1 947 . 1 1 143 143 ALA CB C 13 23.548 0.2 . 1 . . . . 287 ALA CB . 17623 1 948 . 1 1 143 143 ALA N N 15 119.867 0.2 . 1 . . . . 287 ALA N . 17623 1 949 . 1 1 144 144 PHE H H 1 9.294 0.02 . 1 . . . . 288 PHE H . 17623 1 950 . 1 1 144 144 PHE HA H 1 5.071 0.02 . 1 . . . . 288 PHE HA . 17623 1 951 . 1 1 144 144 PHE HB2 H 1 2.540 0.02 . 2 . . . . 288 PHE HB2 . 17623 1 952 . 1 1 144 144 PHE CA C 13 58.084 0.2 . 1 . . . . 288 PHE CA . 17623 1 953 . 1 1 144 144 PHE CB C 13 42.993 0.2 . 1 . . . . 288 PHE CB . 17623 1 954 . 1 1 144 144 PHE N N 15 118.050 0.2 . 1 . . . . 288 PHE N . 17623 1 955 . 1 1 145 145 ASN H H 1 8.170 0.02 . 1 . . . . 289 ASN H . 17623 1 956 . 1 1 145 145 ASN N N 15 123.463 0.2 . 1 . . . . 289 ASN N . 17623 1 957 . 1 1 146 146 LEU H H 1 8.423 0.02 . 1 . . . . 290 LEU H . 17623 1 958 . 1 1 146 146 LEU HA H 1 4.228 0.02 . 1 . . . . 290 LEU HA . 17623 1 959 . 1 1 146 146 LEU HB2 H 1 1.862 0.02 . 2 . . . . 290 LEU HB2 . 17623 1 960 . 1 1 146 146 LEU HB3 H 1 1.145 0.02 . 2 . . . . 290 LEU HB3 . 17623 1 961 . 1 1 146 146 LEU HG H 1 1.152 0.02 . 1 . . . . 290 LEU HG . 17623 1 962 . 1 1 146 146 LEU HD11 H 1 0.726 0.02 . 4 . . . . 290 LEU HD1 . 17623 1 963 . 1 1 146 146 LEU HD12 H 1 0.726 0.02 . 4 . . . . 290 LEU HD1 . 17623 1 964 . 1 1 146 146 LEU HD13 H 1 0.726 0.02 . 4 . . . . 290 LEU HD1 . 17623 1 965 . 1 1 146 146 LEU HD21 H 1 0.761 0.02 . 4 . . . . 290 LEU HD2 . 17623 1 966 . 1 1 146 146 LEU HD22 H 1 0.761 0.02 . 4 . . . . 290 LEU HD2 . 17623 1 967 . 1 1 146 146 LEU HD23 H 1 0.761 0.02 . 4 . . . . 290 LEU HD2 . 17623 1 968 . 1 1 146 146 LEU CA C 13 53.286 0.2 . 1 . . . . 290 LEU CA . 17623 1 969 . 1 1 146 146 LEU CB C 13 44.250 0.2 . 1 . . . . 290 LEU CB . 17623 1 970 . 1 1 146 146 LEU CG C 13 27.324 0.2 . 1 . . . . 290 LEU CG . 17623 1 971 . 1 1 146 146 LEU CD1 C 13 24.046 0.2 . 2 . . . . 290 LEU CD1 . 17623 1 972 . 1 1 146 146 LEU CD2 C 13 26.042 0.2 . 2 . . . . 290 LEU CD2 . 17623 1 973 . 1 1 146 146 LEU N N 15 126.669 0.2 . 1 . . . . 290 LEU N . 17623 1 974 . 1 1 147 147 VAL H H 1 7.972 0.02 . 1 . . . . 291 VAL H . 17623 1 975 . 1 1 147 147 VAL HA H 1 3.731 0.02 . 1 . . . . 291 VAL HA . 17623 1 976 . 1 1 147 147 VAL HB H 1 1.091 0.02 . 1 . . . . 291 VAL HB . 17623 1 977 . 1 1 147 147 VAL HG11 H 1 0.811 0.02 . 4 . . . . 291 VAL HG1 . 17623 1 978 . 1 1 147 147 VAL HG12 H 1 0.811 0.02 . 4 . . . . 291 VAL HG1 . 17623 1 979 . 1 1 147 147 VAL HG13 H 1 0.811 0.02 . 4 . . . . 291 VAL HG1 . 17623 1 980 . 1 1 147 147 VAL HG21 H 1 1.007 0.02 . 4 . . . . 291 VAL HG2 . 17623 1 981 . 1 1 147 147 VAL HG22 H 1 1.007 0.02 . 4 . . . . 291 VAL HG2 . 17623 1 982 . 1 1 147 147 VAL HG23 H 1 1.007 0.02 . 4 . . . . 291 VAL HG2 . 17623 1 983 . 1 1 147 147 VAL CA C 13 64.647 0.2 . 1 . . . . 291 VAL CA . 17623 1 984 . 1 1 147 147 VAL CB C 13 30.584 0.2 . 1 . . . . 291 VAL CB . 17623 1 985 . 1 1 147 147 VAL CG1 C 13 21.596 0.2 . 2 . . . . 291 VAL CG1 . 17623 1 986 . 1 1 147 147 VAL CG2 C 13 22.911 0.2 . 2 . . . . 291 VAL CG2 . 17623 1 987 . 1 1 147 147 VAL N N 15 130.188 0.2 . 1 . . . . 291 VAL N . 17623 1 988 . 1 1 148 148 LYS H H 1 8.490 0.02 . 1 . . . . 292 LYS H . 17623 1 989 . 1 1 148 148 LYS N N 15 126.152 0.2 . 1 . . . . 292 LYS N . 17623 1 990 . 1 1 149 149 ASP H H 1 8.615 0.02 . 1 . . . . 293 ASP H . 17623 1 991 . 1 1 149 149 ASP HA H 1 4.523 0.02 . 1 . . . . 293 ASP HA . 17623 1 992 . 1 1 149 149 ASP HB2 H 1 3.079 0.02 . 2 . . . . 293 ASP HB2 . 17623 1 993 . 1 1 149 149 ASP HB3 H 1 2.266 0.02 . 2 . . . . 293 ASP HB3 . 17623 1 994 . 1 1 149 149 ASP CA C 13 53.596 0.2 . 1 . . . . 293 ASP CA . 17623 1 995 . 1 1 149 149 ASP CB C 13 42.520 0.2 . 1 . . . . 293 ASP CB . 17623 1 996 . 1 1 149 149 ASP N N 15 121.736 0.2 . 1 . . . . 293 ASP N . 17623 1 997 . 1 1 150 150 SER H H 1 9.013 0.02 . 1 . . . . 294 SER H . 17623 1 998 . 1 1 150 150 SER HA H 1 4.045 0.02 . 1 . . . . 294 SER HA . 17623 1 999 . 1 1 150 150 SER HB2 H 1 3.913 0.02 . 2 . . . . 294 SER HB2 . 17623 1 1000 . 1 1 150 150 SER HB3 H 1 3.886 0.02 . 2 . . . . 294 SER HB3 . 17623 1 1001 . 1 1 150 150 SER CA C 13 60.823 0.2 . 1 . . . . 294 SER CA . 17623 1 1002 . 1 1 150 150 SER CB C 13 62.850 0.2 . 1 . . . . 294 SER CB . 17623 1 1003 . 1 1 150 150 SER N N 15 123.949 0.2 . 1 . . . . 294 SER N . 17623 1 1004 . 1 1 151 151 ALA H H 1 8.491 0.02 . 1 . . . . 295 ALA H . 17623 1 1005 . 1 1 151 151 ALA HA H 1 4.323 0.02 . 1 . . . . 295 ALA HA . 17623 1 1006 . 1 1 151 151 ALA HB1 H 1 1.465 0.02 . 1 . . . . 295 ALA HB . 17623 1 1007 . 1 1 151 151 ALA HB2 H 1 1.465 0.02 . 1 . . . . 295 ALA HB . 17623 1 1008 . 1 1 151 151 ALA HB3 H 1 1.465 0.02 . 1 . . . . 295 ALA HB . 17623 1 1009 . 1 1 151 151 ALA CA C 13 54.068 0.2 . 1 . . . . 295 ALA CA . 17623 1 1010 . 1 1 151 151 ALA CB C 13 19.348 0.2 . 1 . . . . 295 ALA CB . 17623 1 1011 . 1 1 151 151 ALA N N 15 122.997 0.2 . 1 . . . . 295 ALA N . 17623 1 1012 . 1 1 152 152 THR HA H 1 4.353 0.02 . 1 . . . . 296 THR HA . 17623 1 1013 . 1 1 152 152 THR HB H 1 4.229 0.02 . 1 . . . . 296 THR HB . 17623 1 1014 . 1 1 152 152 THR HG21 H 1 1.122 0.02 . 1 . . . . 296 THR HG2 . 17623 1 1015 . 1 1 152 152 THR HG22 H 1 1.122 0.02 . 1 . . . . 296 THR HG2 . 17623 1 1016 . 1 1 152 152 THR HG23 H 1 1.122 0.02 . 1 . . . . 296 THR HG2 . 17623 1 1017 . 1 1 152 152 THR CA C 13 61.424 0.2 . 1 . . . . 296 THR CA . 17623 1 1018 . 1 1 152 152 THR CB C 13 71.143 0.2 . 1 . . . . 296 THR CB . 17623 1 1019 . 1 1 152 152 THR CG2 C 13 21.018 0.2 . 1 . . . . 296 THR CG2 . 17623 1 1020 . 1 1 152 152 THR N N 15 109.761 0.2 . 1 . . . . 296 THR N . 17623 1 1021 . 1 1 153 153 GLY H H 1 8.391 0.02 . 1 . . . . 297 GLY H . 17623 1 1022 . 1 1 153 153 GLY N N 15 111.312 0.2 . 1 . . . . 297 GLY N . 17623 1 1023 . 1 1 154 154 LEU H H 1 7.703 0.02 . 1 . . . . 298 LEU H . 17623 1 1024 . 1 1 154 154 LEU HB2 H 1 1.577 0.02 . 2 . . . . 298 LEU HB2 . 17623 1 1025 . 1 1 154 154 LEU HB3 H 1 1.467 0.02 . 2 . . . . 298 LEU HB3 . 17623 1 1026 . 1 1 154 154 LEU HG H 1 1.507 0.02 . 1 . . . . 298 LEU HG . 17623 1 1027 . 1 1 154 154 LEU HD11 H 1 0.780 0.02 . 4 . . . . 298 LEU HD1 . 17623 1 1028 . 1 1 154 154 LEU HD12 H 1 0.780 0.02 . 4 . . . . 298 LEU HD1 . 17623 1 1029 . 1 1 154 154 LEU HD13 H 1 0.780 0.02 . 4 . . . . 298 LEU HD1 . 17623 1 1030 . 1 1 154 154 LEU HD21 H 1 0.818 0.02 . 4 . . . . 298 LEU HD2 . 17623 1 1031 . 1 1 154 154 LEU HD22 H 1 0.818 0.02 . 4 . . . . 298 LEU HD2 . 17623 1 1032 . 1 1 154 154 LEU HD23 H 1 0.818 0.02 . 4 . . . . 298 LEU HD2 . 17623 1 1033 . 1 1 154 154 LEU CB C 13 42.710 0.2 . 1 . . . . 298 LEU CB . 17623 1 1034 . 1 1 154 154 LEU CG C 13 26.714 0.2 . 1 . . . . 298 LEU CG . 17623 1 1035 . 1 1 154 154 LEU CD1 C 13 23.208 0.2 . 2 . . . . 298 LEU CD1 . 17623 1 1036 . 1 1 154 154 LEU CD2 C 13 24.688 0.2 . 2 . . . . 298 LEU CD2 . 17623 1 1037 . 1 1 154 154 LEU N N 15 120.436 0.2 . 1 . . . . 298 LEU N . 17623 1 1038 . 1 1 155 155 SER H H 1 8.432 0.02 . 1 . . . . 299 SER H . 17623 1 1039 . 1 1 155 155 SER HA H 1 4.373 0.02 . 1 . . . . 299 SER HA . 17623 1 1040 . 1 1 155 155 SER HB2 H 1 3.958 0.02 . 2 . . . . 299 SER HB2 . 17623 1 1041 . 1 1 155 155 SER HB3 H 1 3.888 0.02 . 2 . . . . 299 SER HB3 . 17623 1 1042 . 1 1 155 155 SER CA C 13 57.652 0.2 . 1 . . . . 299 SER CA . 17623 1 1043 . 1 1 155 155 SER CB C 13 64.152 0.2 . 1 . . . . 299 SER CB . 17623 1 1044 . 1 1 155 155 SER N N 15 115.525 0.2 . 1 . . . . 299 SER N . 17623 1 1045 . 1 1 156 156 LYS H H 1 9.333 0.02 . 1 . . . . 300 LYS H . 17623 1 1046 . 1 1 156 156 LYS N N 15 123.672 0.2 . 1 . . . . 300 LYS N . 17623 1 1047 . 1 1 157 157 GLY H H 1 8.745 0.02 . 1 . . . . 301 GLY H . 17623 1 1048 . 1 1 157 157 GLY HA2 H 1 4.157 0.02 . 2 . . . . 301 GLY HA2 . 17623 1 1049 . 1 1 157 157 GLY HA3 H 1 3.291 0.02 . 2 . . . . 301 GLY HA3 . 17623 1 1050 . 1 1 157 157 GLY CA C 13 45.412 0.2 . 1 . . . . 301 GLY CA . 17623 1 1051 . 1 1 157 157 GLY N N 15 105.710 0.2 . 1 . . . . 301 GLY N . 17623 1 1052 . 1 1 158 158 TYR H H 1 6.654 0.02 . 1 . . . . 302 TYR H . 17623 1 1053 . 1 1 158 158 TYR HA H 1 5.306 0.02 . 1 . . . . 302 TYR HA . 17623 1 1054 . 1 1 158 158 TYR HB2 H 1 2.916 0.02 . 2 . . . . 302 TYR HB2 . 17623 1 1055 . 1 1 158 158 TYR HB3 H 1 2.577 0.02 . 2 . . . . 302 TYR HB3 . 17623 1 1056 . 1 1 158 158 TYR HD1 H 1 6.665 0.02 . 1 . . . . 302 TYR HD1 . 17623 1 1057 . 1 1 158 158 TYR HD2 H 1 6.665 0.02 . 1 . . . . 302 TYR HD2 . 17623 1 1058 . 1 1 158 158 TYR HE1 H 1 6.840 0.02 . 1 . . . . 302 TYR HE1 . 17623 1 1059 . 1 1 158 158 TYR HE2 H 1 6.840 0.02 . 1 . . . . 302 TYR HE2 . 17623 1 1060 . 1 1 158 158 TYR CA C 13 55.172 0.2 . 1 . . . . 302 TYR CA . 17623 1 1061 . 1 1 158 158 TYR CB C 13 41.023 0.2 . 1 . . . . 302 TYR CB . 17623 1 1062 . 1 1 158 158 TYR N N 15 112.310 0.2 . 1 . . . . 302 TYR N . 17623 1 1063 . 1 1 159 159 ALA H H 1 8.682 0.02 . 1 . . . . 303 ALA H . 17623 1 1064 . 1 1 159 159 ALA HA H 1 4.823 0.02 . 1 . . . . 303 ALA HA . 17623 1 1065 . 1 1 159 159 ALA HB1 H 1 0.942 0.02 . 1 . . . . 303 ALA HB . 17623 1 1066 . 1 1 159 159 ALA HB2 H 1 0.942 0.02 . 1 . . . . 303 ALA HB . 17623 1 1067 . 1 1 159 159 ALA HB3 H 1 0.942 0.02 . 1 . . . . 303 ALA HB . 17623 1 1068 . 1 1 159 159 ALA CA C 13 49.130 0.2 . 1 . . . . 303 ALA CA . 17623 1 1069 . 1 1 159 159 ALA CB C 13 25.267 0.2 . 1 . . . . 303 ALA CB . 17623 1 1070 . 1 1 159 159 ALA N N 15 120.886 0.2 . 1 . . . . 303 ALA N . 17623 1 1071 . 1 1 160 160 PHE H H 1 8.228 0.02 . 1 . . . . 304 PHE H . 17623 1 1072 . 1 1 160 160 PHE HA H 1 5.638 0.02 . 1 . . . . 304 PHE HA . 17623 1 1073 . 1 1 160 160 PHE HB2 H 1 2.952 0.02 . 2 . . . . 304 PHE HB2 . 17623 1 1074 . 1 1 160 160 PHE HB3 H 1 2.747 0.02 . 2 . . . . 304 PHE HB3 . 17623 1 1075 . 1 1 160 160 PHE HD1 H 1 6.994 0.02 . 1 . . . . 304 PHE HD1 . 17623 1 1076 . 1 1 160 160 PHE HD2 H 1 6.994 0.02 . 1 . . . . 304 PHE HD2 . 17623 1 1077 . 1 1 160 160 PHE CA C 13 55.086 0.2 . 1 . . . . 304 PHE CA . 17623 1 1078 . 1 1 160 160 PHE CB C 13 43.089 0.2 . 1 . . . . 304 PHE CB . 17623 1 1079 . 1 1 160 160 PHE N N 15 113.622 0.2 . 1 . . . . 304 PHE N . 17623 1 1080 . 1 1 161 161 CYS H H 1 8.660 0.02 . 1 . . . . 305 CYS H . 17623 1 1081 . 1 1 161 161 CYS HA H 1 5.186 0.02 . 1 . . . . 305 CYS HA . 17623 1 1082 . 1 1 161 161 CYS HB2 H 1 3.236 0.02 . 2 . . . . 305 CYS HB2 . 17623 1 1083 . 1 1 161 161 CYS HB3 H 1 2.733 0.02 . 2 . . . . 305 CYS HB3 . 17623 1 1084 . 1 1 161 161 CYS CA C 13 56.825 0.2 . 1 . . . . 305 CYS CA . 17623 1 1085 . 1 1 161 161 CYS CB C 13 32.440 0.2 . 1 . . . . 305 CYS CB . 17623 1 1086 . 1 1 161 161 CYS N N 15 112.677 0.2 . 1 . . . . 305 CYS N . 17623 1 1087 . 1 1 162 162 GLU H H 1 8.058 0.02 . 1 . . . . 306 GLU H . 17623 1 1088 . 1 1 162 162 GLU HA H 1 4.413 0.02 . 1 . . . . 306 GLU HA . 17623 1 1089 . 1 1 162 162 GLU HG2 H 1 2.143 0.02 . 2 . . . . 306 GLU HG2 . 17623 1 1090 . 1 1 162 162 GLU CA C 13 56.396 0.2 . 1 . . . . 306 GLU CA . 17623 1 1091 . 1 1 162 162 GLU CG C 13 36.281 0.2 . 1 . . . . 306 GLU CG . 17623 1 1092 . 1 1 162 162 GLU N N 15 118.566 0.2 . 1 . . . . 306 GLU N . 17623 1 1093 . 1 1 163 163 TYR H H 1 9.292 0.02 . 1 . . . . 307 TYR H . 17623 1 1094 . 1 1 163 163 TYR HA H 1 4.355 0.02 . 1 . . . . 307 TYR HA . 17623 1 1095 . 1 1 163 163 TYR HB2 H 1 3.176 0.02 . 2 . . . . 307 TYR HB2 . 17623 1 1096 . 1 1 163 163 TYR HB3 H 1 2.272 0.02 . 2 . . . . 307 TYR HB3 . 17623 1 1097 . 1 1 163 163 TYR HD1 H 1 6.882 0.02 . 1 . . . . 307 TYR HD1 . 17623 1 1098 . 1 1 163 163 TYR HD2 H 1 6.882 0.02 . 1 . . . . 307 TYR HD2 . 17623 1 1099 . 1 1 163 163 TYR CA C 13 61.288 0.2 . 1 . . . . 307 TYR CA . 17623 1 1100 . 1 1 163 163 TYR CB C 13 39.376 0.2 . 1 . . . . 307 TYR CB . 17623 1 1101 . 1 1 163 163 TYR N N 15 128.689 0.2 . 1 . . . . 307 TYR N . 17623 1 1102 . 1 1 164 164 VAL H H 1 8.026 0.02 . 1 . . . . 308 VAL H . 17623 1 1103 . 1 1 164 164 VAL HA H 1 3.311 0.02 . 1 . . . . 308 VAL HA . 17623 1 1104 . 1 1 164 164 VAL HB H 1 1.889 0.02 . 1 . . . . 308 VAL HB . 17623 1 1105 . 1 1 164 164 VAL HG11 H 1 0.850 0.02 . 4 . . . . 308 VAL HG1 . 17623 1 1106 . 1 1 164 164 VAL HG12 H 1 0.850 0.02 . 4 . . . . 308 VAL HG1 . 17623 1 1107 . 1 1 164 164 VAL HG13 H 1 0.850 0.02 . 4 . . . . 308 VAL HG1 . 17623 1 1108 . 1 1 164 164 VAL HG21 H 1 0.734 0.02 . 4 . . . . 308 VAL HG2 . 17623 1 1109 . 1 1 164 164 VAL HG22 H 1 0.734 0.02 . 4 . . . . 308 VAL HG2 . 17623 1 1110 . 1 1 164 164 VAL HG23 H 1 0.734 0.02 . 4 . . . . 308 VAL HG2 . 17623 1 1111 . 1 1 164 164 VAL CA C 13 66.856 0.2 . 1 . . . . 308 VAL CA . 17623 1 1112 . 1 1 164 164 VAL CB C 13 32.535 0.2 . 1 . . . . 308 VAL CB . 17623 1 1113 . 1 1 164 164 VAL CG1 C 13 21.125 0.2 . 2 . . . . 308 VAL CG1 . 17623 1 1114 . 1 1 164 164 VAL CG2 C 13 22.661 0.2 . 2 . . . . 308 VAL CG2 . 17623 1 1115 . 1 1 164 164 VAL N N 15 119.701 0.2 . 1 . . . . 308 VAL N . 17623 1 1116 . 1 1 165 165 ASP H H 1 8.629 0.02 . 1 . . . . 309 ASP H . 17623 1 1117 . 1 1 165 165 ASP HB2 H 1 2.911 0.02 . 2 . . . . 309 ASP HB2 . 17623 1 1118 . 1 1 165 165 ASP HB3 H 1 2.499 0.02 . 2 . . . . 309 ASP HB3 . 17623 1 1119 . 1 1 165 165 ASP CB C 13 41.305 0.2 . 1 . . . . 309 ASP CB . 17623 1 1120 . 1 1 165 165 ASP N N 15 117.674 0.2 . 1 . . . . 309 ASP N . 17623 1 1121 . 1 1 166 166 ILE H H 1 8.071 0.02 . 1 . . . . 310 ILE H . 17623 1 1122 . 1 1 166 166 ILE HA H 1 3.635 0.02 . 1 . . . . 310 ILE HA . 17623 1 1123 . 1 1 166 166 ILE HB H 1 1.289 0.02 . 1 . . . . 310 ILE HB . 17623 1 1124 . 1 1 166 166 ILE HG12 H 1 1.165 0.02 . 2 . . . . 310 ILE HG12 . 17623 1 1125 . 1 1 166 166 ILE HG13 H 1 0.938 0.02 . 2 . . . . 310 ILE HG13 . 17623 1 1126 . 1 1 166 166 ILE HG21 H 1 0.737 0.02 . 1 . . . . 310 ILE HG2 . 17623 1 1127 . 1 1 166 166 ILE HG22 H 1 0.737 0.02 . 1 . . . . 310 ILE HG2 . 17623 1 1128 . 1 1 166 166 ILE HG23 H 1 0.737 0.02 . 1 . . . . 310 ILE HG2 . 17623 1 1129 . 1 1 166 166 ILE HD11 H 1 0.575 0.02 . 1 . . . . 310 ILE HD1 . 17623 1 1130 . 1 1 166 166 ILE HD12 H 1 0.575 0.02 . 1 . . . . 310 ILE HD1 . 17623 1 1131 . 1 1 166 166 ILE HD13 H 1 0.575 0.02 . 1 . . . . 310 ILE HD1 . 17623 1 1132 . 1 1 166 166 ILE CA C 13 64.156 0.2 . 1 . . . . 310 ILE CA . 17623 1 1133 . 1 1 166 166 ILE CB C 13 37.833 0.2 . 1 . . . . 310 ILE CB . 17623 1 1134 . 1 1 166 166 ILE CG1 C 13 26.176 0.2 . 1 . . . . 310 ILE CG1 . 17623 1 1135 . 1 1 166 166 ILE CG2 C 13 18.749 0.2 . 1 . . . . 310 ILE CG2 . 17623 1 1136 . 1 1 166 166 ILE CD1 C 13 13.914 0.2 . 1 . . . . 310 ILE CD1 . 17623 1 1137 . 1 1 166 166 ILE N N 15 119.759 0.2 . 1 . . . . 310 ILE N . 17623 1 1138 . 1 1 167 167 ASN H H 1 8.599 0.02 . 1 . . . . 311 ASN H . 17623 1 1139 . 1 1 167 167 ASN HA H 1 4.433 0.02 . 1 . . . . 311 ASN HA . 17623 1 1140 . 1 1 167 167 ASN HB2 H 1 2.848 0.02 . 2 . . . . 311 ASN HB2 . 17623 1 1141 . 1 1 167 167 ASN HB3 H 1 2.660 0.02 . 2 . . . . 311 ASN HB3 . 17623 1 1142 . 1 1 167 167 ASN HD21 H 1 6.881 0.02 . 2 . . . . 311 ASN HD21 . 17623 1 1143 . 1 1 167 167 ASN HD22 H 1 7.939 0.02 . 2 . . . . 311 ASN HD22 . 17623 1 1144 . 1 1 167 167 ASN CA C 13 55.392 0.2 . 1 . . . . 311 ASN CA . 17623 1 1145 . 1 1 167 167 ASN CB C 13 37.848 0.2 . 1 . . . . 311 ASN CB . 17623 1 1146 . 1 1 167 167 ASN N N 15 119.845 0.2 . 1 . . . . 311 ASN N . 17623 1 1147 . 1 1 167 167 ASN ND2 N 15 115.091 0.2 . 1 . . . . 311 ASN ND2 . 17623 1 1148 . 1 1 168 168 VAL H H 1 7.763 0.02 . 1 . . . . 312 VAL H . 17623 1 1149 . 1 1 168 168 VAL HA H 1 3.829 0.02 . 1 . . . . 312 VAL HA . 17623 1 1150 . 1 1 168 168 VAL HB H 1 1.893 0.02 . 1 . . . . 312 VAL HB . 17623 1 1151 . 1 1 168 168 VAL HG11 H 1 0.253 0.02 . 4 . . . . 312 VAL HG1 . 17623 1 1152 . 1 1 168 168 VAL HG12 H 1 0.253 0.02 . 4 . . . . 312 VAL HG1 . 17623 1 1153 . 1 1 168 168 VAL HG13 H 1 0.253 0.02 . 4 . . . . 312 VAL HG1 . 17623 1 1154 . 1 1 168 168 VAL HG21 H 1 0.780 0.02 . 4 . . . . 312 VAL HG2 . 17623 1 1155 . 1 1 168 168 VAL HG22 H 1 0.780 0.02 . 4 . . . . 312 VAL HG2 . 17623 1 1156 . 1 1 168 168 VAL HG23 H 1 0.780 0.02 . 4 . . . . 312 VAL HG2 . 17623 1 1157 . 1 1 168 168 VAL CA C 13 63.586 0.2 . 1 . . . . 312 VAL CA . 17623 1 1158 . 1 1 168 168 VAL CB C 13 32.236 0.2 . 1 . . . . 312 VAL CB . 17623 1 1159 . 1 1 168 168 VAL CG1 C 13 21.536 0.2 . 2 . . . . 312 VAL CG1 . 17623 1 1160 . 1 1 168 168 VAL CG2 C 13 22.147 0.2 . 2 . . . . 312 VAL CG2 . 17623 1 1161 . 1 1 168 168 VAL N N 15 118.495 0.2 . 1 . . . . 312 VAL N . 17623 1 1162 . 1 1 169 169 THR H H 1 7.223 0.02 . 1 . . . . 313 THR H . 17623 1 1163 . 1 1 169 169 THR HA H 1 3.426 0.02 . 1 . . . . 313 THR HA . 17623 1 1164 . 1 1 169 169 THR HB H 1 4.208 0.02 . 1 . . . . 313 THR HB . 17623 1 1165 . 1 1 169 169 THR HG21 H 1 1.327 0.02 . 1 . . . . 313 THR HG2 . 17623 1 1166 . 1 1 169 169 THR HG22 H 1 1.327 0.02 . 1 . . . . 313 THR HG2 . 17623 1 1167 . 1 1 169 169 THR HG23 H 1 1.327 0.02 . 1 . . . . 313 THR HG2 . 17623 1 1168 . 1 1 169 169 THR CA C 13 67.720 0.2 . 1 . . . . 313 THR CA . 17623 1 1169 . 1 1 169 169 THR CB C 13 69.000 0.2 . 1 . . . . 313 THR CB . 17623 1 1170 . 1 1 169 169 THR CG2 C 13 22.228 0.2 . 1 . . . . 313 THR CG2 . 17623 1 1171 . 1 1 169 169 THR N N 15 116.603 0.2 . 1 . . . . 313 THR N . 17623 1 1172 . 1 1 170 170 ASP H H 1 8.219 0.02 . 1 . . . . 314 ASP H . 17623 1 1173 . 1 1 170 170 ASP HA H 1 4.370 0.02 . 1 . . . . 314 ASP HA . 17623 1 1174 . 1 1 170 170 ASP HB2 H 1 2.574 0.02 . 2 . . . . 314 ASP HB2 . 17623 1 1175 . 1 1 170 170 ASP HB3 H 1 2.518 0.02 . 2 . . . . 314 ASP HB3 . 17623 1 1176 . 1 1 170 170 ASP CA C 13 58.070 0.2 . 1 . . . . 314 ASP CA . 17623 1 1177 . 1 1 170 170 ASP CB C 13 40.380 0.2 . 1 . . . . 314 ASP CB . 17623 1 1178 . 1 1 170 170 ASP N N 15 116.946 0.2 . 1 . . . . 314 ASP N . 17623 1 1179 . 1 1 171 171 GLN H H 1 7.460 0.02 . 1 . . . . 315 GLN H . 17623 1 1180 . 1 1 171 171 GLN HA H 1 3.968 0.02 . 1 . . . . 315 GLN HA . 17623 1 1181 . 1 1 171 171 GLN HB2 H 1 2.153 0.02 . 2 . . . . 315 GLN HB2 . 17623 1 1182 . 1 1 171 171 GLN HB3 H 1 2.061 0.02 . 2 . . . . 315 GLN HB3 . 17623 1 1183 . 1 1 171 171 GLN HG2 H 1 2.374 0.02 . 2 . . . . 315 GLN HG2 . 17623 1 1184 . 1 1 171 171 GLN HG3 H 1 2.324 0.02 . 2 . . . . 315 GLN HG3 . 17623 1 1185 . 1 1 171 171 GLN CA C 13 58.412 0.2 . 1 . . . . 315 GLN CA . 17623 1 1186 . 1 1 171 171 GLN CB C 13 28.095 0.2 . 1 . . . . 315 GLN CB . 17623 1 1187 . 1 1 171 171 GLN CG C 13 33.971 0.2 . 1 . . . . 315 GLN CG . 17623 1 1188 . 1 1 171 171 GLN N N 15 121.388 0.2 . 1 . . . . 315 GLN N . 17623 1 1189 . 1 1 172 172 ALA H H 1 7.925 0.02 . 1 . . . . 316 ALA H . 17623 1 1190 . 1 1 172 172 ALA HA H 1 2.285 0.02 . 1 . . . . 316 ALA HA . 17623 1 1191 . 1 1 172 172 ALA HB1 H 1 0.887 0.02 . 1 . . . . 316 ALA HB1 . 17623 1 1192 . 1 1 172 172 ALA HB2 H 1 0.887 0.02 . 1 . . . . 316 ALA HB1 . 17623 1 1193 . 1 1 172 172 ALA HB3 H 1 0.887 0.02 . 1 . . . . 316 ALA HB1 . 17623 1 1194 . 1 1 172 172 ALA CA C 13 54.329 0.2 . 1 . . . . 316 ALA CA . 17623 1 1195 . 1 1 172 172 ALA CB C 13 18.042 0.2 . 1 . . . . 316 ALA CB . 17623 1 1196 . 1 1 172 172 ALA N N 15 124.891 0.2 . 1 . . . . 316 ALA N . 17623 1 1197 . 1 1 173 173 ILE H H 1 7.642 0.02 . 1 . . . . 317 ILE H . 17623 1 1198 . 1 1 173 173 ILE HA H 1 3.185 0.02 . 1 . . . . 317 ILE HA . 17623 1 1199 . 1 1 173 173 ILE HB H 1 1.644 0.02 . 1 . . . . 317 ILE HB . 17623 1 1200 . 1 1 173 173 ILE HG12 H 1 1.803 0.02 . 2 . . . . 317 ILE HG12 . 17623 1 1201 . 1 1 173 173 ILE HG13 H 1 0.542 0.02 . 2 . . . . 317 ILE HG13 . 17623 1 1202 . 1 1 173 173 ILE HG21 H 1 0.885 0.02 . 4 . . . . 317 ILE HG2 . 17623 1 1203 . 1 1 173 173 ILE HG22 H 1 0.885 0.02 . 4 . . . . 317 ILE HG2 . 17623 1 1204 . 1 1 173 173 ILE HG23 H 1 0.885 0.02 . 4 . . . . 317 ILE HG2 . 17623 1 1205 . 1 1 173 173 ILE HD11 H 1 0.874 0.02 . 4 . . . . 317 ILE HD1 . 17623 1 1206 . 1 1 173 173 ILE HD12 H 1 0.874 0.02 . 4 . . . . 317 ILE HD1 . 17623 1 1207 . 1 1 173 173 ILE HD13 H 1 0.874 0.02 . 4 . . . . 317 ILE HD1 . 17623 1 1208 . 1 1 173 173 ILE CA C 13 66.484 0.2 . 1 . . . . 317 ILE CA . 17623 1 1209 . 1 1 173 173 ILE CB C 13 38.444 0.2 . 1 . . . . 317 ILE CB . 17623 1 1210 . 1 1 173 173 ILE CG1 C 13 30.250 0.2 . 1 . . . . 317 ILE CG1 . 17623 1 1211 . 1 1 173 173 ILE CG2 C 13 17.120 0.2 . 1 . . . . 317 ILE CG2 . 17623 1 1212 . 1 1 173 173 ILE CD1 C 13 14.340 0.2 . 1 . . . . 317 ILE CD1 . 17623 1 1213 . 1 1 173 173 ILE N N 15 116.360 0.2 . 1 . . . . 317 ILE N . 17623 1 1214 . 1 1 174 174 ALA H H 1 7.448 0.02 . 1 . . . . 318 ALA H . 17623 1 1215 . 1 1 174 174 ALA HA H 1 3.988 0.02 . 1 . . . . 318 ALA HA . 17623 1 1216 . 1 1 174 174 ALA HB1 H 1 1.359 0.02 . 1 . . . . 318 ALA HB . 17623 1 1217 . 1 1 174 174 ALA HB2 H 1 1.359 0.02 . 1 . . . . 318 ALA HB . 17623 1 1218 . 1 1 174 174 ALA HB3 H 1 1.359 0.02 . 1 . . . . 318 ALA HB . 17623 1 1219 . 1 1 174 174 ALA CA C 13 54.730 0.2 . 1 . . . . 318 ALA CA . 17623 1 1220 . 1 1 174 174 ALA CB C 13 17.993 0.2 . 1 . . . . 318 ALA CB . 17623 1 1221 . 1 1 174 174 ALA N N 15 118.243 0.2 . 1 . . . . 318 ALA N . 17623 1 1222 . 1 1 175 175 GLY HA2 H 1 4.065 0.02 . 2 . . . . 319 GLY HA2 . 17623 1 1223 . 1 1 175 175 GLY HA3 H 1 3.637 0.02 . 2 . . . . 319 GLY HA3 . 17623 1 1224 . 1 1 175 175 GLY CA C 13 46.056 0.2 . 1 . . . . 319 GLY CA . 17623 1 1225 . 1 1 175 175 GLY N N 15 105.633 0.2 . 1 . . . . 319 GLY N . 17623 1 1226 . 1 1 176 176 LEU H H 1 7.948 0.02 . 1 . . . . 320 LEU H . 17623 1 1227 . 1 1 176 176 LEU HA H 1 4.535 0.02 . 1 . . . . 320 LEU HA . 17623 1 1228 . 1 1 176 176 LEU HB2 H 1 1.655 0.02 . 2 . . . . 320 LEU HB2 . 17623 1 1229 . 1 1 176 176 LEU HB3 H 1 1.243 0.02 . 2 . . . . 320 LEU HB3 . 17623 1 1230 . 1 1 176 176 LEU HG H 1 1.633 0.02 . 1 . . . . 320 LEU HG . 17623 1 1231 . 1 1 176 176 LEU HD11 H 1 0.882 0.02 . 4 . . . . 320 LEU HD1 . 17623 1 1232 . 1 1 176 176 LEU HD12 H 1 0.882 0.02 . 4 . . . . 320 LEU HD1 . 17623 1 1233 . 1 1 176 176 LEU HD13 H 1 0.882 0.02 . 4 . . . . 320 LEU HD1 . 17623 1 1234 . 1 1 176 176 LEU HD21 H 1 0.694 0.02 . 4 . . . . 320 LEU HD2 . 17623 1 1235 . 1 1 176 176 LEU HD22 H 1 0.694 0.02 . 4 . . . . 320 LEU HD2 . 17623 1 1236 . 1 1 176 176 LEU HD23 H 1 0.694 0.02 . 4 . . . . 320 LEU HD2 . 17623 1 1237 . 1 1 176 176 LEU CA C 13 55.624 0.2 . 1 . . . . 320 LEU CA . 17623 1 1238 . 1 1 176 176 LEU CB C 13 45.840 0.2 . 1 . . . . 320 LEU CB . 17623 1 1239 . 1 1 176 176 LEU CG C 13 26.574 0.2 . 1 . . . . 320 LEU CG . 17623 1 1240 . 1 1 176 176 LEU CD1 C 13 24.558 0.2 . 2 . . . . 320 LEU CD1 . 17623 1 1241 . 1 1 176 176 LEU N N 15 118.829 0.2 . 1 . . . . 320 LEU N . 17623 1 1242 . 1 1 177 177 ASN H H 1 8.478 0.02 . 1 . . . . 321 ASN H . 17623 1 1243 . 1 1 177 177 ASN HA H 1 4.146 0.02 . 1 . . . . 321 ASN HA . 17623 1 1244 . 1 1 177 177 ASN HB2 H 1 3.061 0.02 . 2 . . . . 321 ASN HB2 . 17623 1 1245 . 1 1 177 177 ASN HB3 H 1 2.865 0.02 . 2 . . . . 321 ASN HB3 . 17623 1 1246 . 1 1 177 177 ASN HD21 H 1 6.891 0.02 . 2 . . . . 321 ASN HD21 . 17623 1 1247 . 1 1 177 177 ASN HD22 H 1 7.543 0.02 . 2 . . . . 321 ASN HD22 . 17623 1 1248 . 1 1 177 177 ASN CA C 13 56.680 0.2 . 1 . . . . 321 ASN CA . 17623 1 1249 . 1 1 177 177 ASN CB C 13 38.808 0.2 . 1 . . . . 321 ASN CB . 17623 1 1250 . 1 1 177 177 ASN N N 15 116.201 0.2 . 1 . . . . 321 ASN N . 17623 1 1251 . 1 1 177 177 ASN ND2 N 15 113.728 0.2 . 1 . . . . 321 ASN ND2 . 17623 1 1252 . 1 1 178 178 GLY H H 1 8.845 0.02 . 1 . . . . 322 GLY H . 17623 1 1253 . 1 1 178 178 GLY HA2 H 1 4.155 0.02 . 2 . . . . 322 GLY HA2 . 17623 1 1254 . 1 1 178 178 GLY HA3 H 1 3.491 0.02 . 2 . . . . 322 GLY HA3 . 17623 1 1255 . 1 1 178 178 GLY CA C 13 45.506 0.2 . 1 . . . . 322 GLY CA . 17623 1 1256 . 1 1 178 178 GLY N N 15 117.159 0.2 . 1 . . . . 322 GLY N . 17623 1 1257 . 1 1 179 179 MET H H 1 7.881 0.02 . 1 . . . . 323 MET H . 17623 1 1258 . 1 1 179 179 MET HA H 1 3.999 0.02 . 1 . . . . 323 MET HA . 17623 1 1259 . 1 1 179 179 MET HB2 H 1 2.151 0.02 . 2 . . . . 323 MET HB2 . 17623 1 1260 . 1 1 179 179 MET HB3 H 1 1.952 0.02 . 2 . . . . 323 MET HB3 . 17623 1 1261 . 1 1 179 179 MET HG3 H 1 2.301 0.02 . 2 . . . . 323 MET HG3 . 17623 1 1262 . 1 1 179 179 MET CA C 13 56.572 0.2 . 1 . . . . 323 MET CA . 17623 1 1263 . 1 1 179 179 MET CB C 13 33.999 0.2 . 1 . . . . 323 MET CB . 17623 1 1264 . 1 1 179 179 MET CG C 13 31.884 0.2 . 1 . . . . 323 MET CG . 17623 1 1265 . 1 1 179 179 MET N N 15 122.062 0.2 . 1 . . . . 323 MET N . 17623 1 1266 . 1 1 180 180 GLN H H 1 8.571 0.02 . 1 . . . . 324 GLN H . 17623 1 1267 . 1 1 180 180 GLN HA H 1 4.601 0.02 . 1 . . . . 324 GLN HA . 17623 1 1268 . 1 1 180 180 GLN HB2 H 1 1.986 0.02 . 2 . . . . 324 GLN HB2 . 17623 1 1269 . 1 1 180 180 GLN HB3 H 1 1.898 0.02 . 2 . . . . 324 GLN HB3 . 17623 1 1270 . 1 1 180 180 GLN HG2 H 1 2.224 0.02 . 2 . . . . 324 GLN HG2 . 17623 1 1271 . 1 1 180 180 GLN CA C 13 55.390 0.2 . 1 . . . . 324 GLN CA . 17623 1 1272 . 1 1 180 180 GLN CB C 13 28.993 0.2 . 1 . . . . 324 GLN CB . 17623 1 1273 . 1 1 180 180 GLN CG C 13 33.765 0.2 . 1 . . . . 324 GLN CG . 17623 1 1274 . 1 1 180 180 GLN N N 15 126.451 0.2 . 1 . . . . 324 GLN N . 17623 1 1275 . 1 1 181 181 LEU H H 1 8.565 0.02 . 1 . . . . 325 LEU H . 17623 1 1276 . 1 1 181 181 LEU HA H 1 4.525 0.02 . 1 . . . . 325 LEU HA . 17623 1 1277 . 1 1 181 181 LEU HB2 H 1 1.452 0.02 . 2 . . . . 325 LEU HB2 . 17623 1 1278 . 1 1 181 181 LEU HB3 H 1 1.251 0.02 . 2 . . . . 325 LEU HB3 . 17623 1 1279 . 1 1 181 181 LEU HG H 1 1.349 0.02 . 1 . . . . 325 LEU HG . 17623 1 1280 . 1 1 181 181 LEU HD11 H 1 0.772 0.02 . 1 . . . . 325 LEU HD1 . 17623 1 1281 . 1 1 181 181 LEU HD12 H 1 0.772 0.02 . 1 . . . . 325 LEU HD1 . 17623 1 1282 . 1 1 181 181 LEU HD13 H 1 0.772 0.02 . 1 . . . . 325 LEU HD1 . 17623 1 1283 . 1 1 181 181 LEU HD21 H 1 0.771 0.02 . 1 . . . . 325 LEU HD2 . 17623 1 1284 . 1 1 181 181 LEU HD22 H 1 0.771 0.02 . 1 . . . . 325 LEU HD2 . 17623 1 1285 . 1 1 181 181 LEU HD23 H 1 0.771 0.02 . 1 . . . . 325 LEU HD2 . 17623 1 1286 . 1 1 181 181 LEU CA C 13 54.003 0.2 . 1 . . . . 325 LEU CA . 17623 1 1287 . 1 1 181 181 LEU CB C 13 43.475 0.2 . 1 . . . . 325 LEU CB . 17623 1 1288 . 1 1 181 181 LEU CG C 13 27.253 0.2 . 1 . . . . 325 LEU CG . 17623 1 1289 . 1 1 181 181 LEU CD1 C 13 25.104 0.2 . 2 . . . . 325 LEU CD1 . 17623 1 1290 . 1 1 181 181 LEU CD2 C 13 25.268 0.2 . 2 . . . . 325 LEU CD2 . 17623 1 1291 . 1 1 181 181 LEU N N 15 130.555 0.2 . 1 . . . . 325 LEU N . 17623 1 1292 . 1 1 182 182 GLY H H 1 8.756 0.02 . 1 . . . . 326 GLY H . 17623 1 1293 . 1 1 182 182 GLY HA2 H 1 3.957 0.02 . 2 . . . . 326 GLY HA2 . 17623 1 1294 . 1 1 182 182 GLY HA3 H 1 3.625 0.02 . 2 . . . . 326 GLY HA3 . 17623 1 1295 . 1 1 182 182 GLY CA C 13 46.935 0.2 . 1 . . . . 326 GLY CA . 17623 1 1296 . 1 1 182 182 GLY N N 15 114.269 0.2 . 1 . . . . 326 GLY N . 17623 1 1297 . 1 1 183 183 ASP H H 1 8.674 0.02 . 1 . . . . 327 ASP H . 17623 1 1298 . 1 1 183 183 ASP HA H 1 4.545 0.02 . 1 . . . . 327 ASP HA . 17623 1 1299 . 1 1 183 183 ASP HB2 H 1 2.713 0.02 . 2 . . . . 327 ASP HB2 . 17623 1 1300 . 1 1 183 183 ASP HB3 H 1 2.642 0.02 . 2 . . . . 327 ASP HB3 . 17623 1 1301 . 1 1 183 183 ASP CA C 13 54.342 0.2 . 1 . . . . 327 ASP CA . 17623 1 1302 . 1 1 183 183 ASP CB C 13 40.600 0.2 . 1 . . . . 327 ASP CB . 17623 1 1303 . 1 1 183 183 ASP N N 15 126.101 0.2 . 1 . . . . 327 ASP N . 17623 1 1304 . 1 1 184 184 LYS H H 1 7.820 0.02 . 1 . . . . 328 LYS H . 17623 1 1305 . 1 1 184 184 LYS HA H 1 4.506 0.02 . 1 . . . . 328 LYS HA . 17623 1 1306 . 1 1 184 184 LYS HB2 H 1 2.042 0.02 . 2 . . . . 328 LYS HB2 . 17623 1 1307 . 1 1 184 184 LYS HB3 H 1 1.859 0.02 . 2 . . . . 328 LYS HB3 . 17623 1 1308 . 1 1 184 184 LYS HG2 H 1 1.458 0.02 . 2 . . . . 328 LYS HG2 . 17623 1 1309 . 1 1 184 184 LYS HG3 H 1 1.364 0.02 . 2 . . . . 328 LYS HG3 . 17623 1 1310 . 1 1 184 184 LYS HD2 H 1 1.345 0.02 . 2 . . . . 328 LYS HD2 . 17623 1 1311 . 1 1 184 184 LYS HD3 H 1 1.182 0.02 . 2 . . . . 328 LYS HD3 . 17623 1 1312 . 1 1 184 184 LYS HE2 H 1 2.879 0.02 . 2 . . . . 328 LYS HE2 . 17623 1 1313 . 1 1 184 184 LYS HE3 H 1 2.819 0.02 . 2 . . . . 328 LYS HE3 . 17623 1 1314 . 1 1 184 184 LYS CA C 13 54.612 0.2 . 1 . . . . 328 LYS CA . 17623 1 1315 . 1 1 184 184 LYS CB C 13 34.703 0.2 . 1 . . . . 328 LYS CB . 17623 1 1316 . 1 1 184 184 LYS CG C 13 24.752 0.2 . 1 . . . . 328 LYS CG . 17623 1 1317 . 1 1 184 184 LYS CD C 13 28.394 0.2 . 1 . . . . 328 LYS CD . 17623 1 1318 . 1 1 184 184 LYS CE C 13 41.769 0.2 . 1 . . . . 328 LYS CE . 17623 1 1319 . 1 1 184 184 LYS N N 15 120.459 0.2 . 1 . . . . 328 LYS N . 17623 1 1320 . 1 1 185 185 LYS H H 1 7.890 0.02 . 1 . . . . 329 LYS H . 17623 1 1321 . 1 1 185 185 LYS HA H 1 4.792 0.02 . 1 . . . . 329 LYS HA . 17623 1 1322 . 1 1 185 185 LYS HB2 H 1 1.475 0.02 . 2 . . . . 329 LYS HB2 . 17623 1 1323 . 1 1 185 185 LYS HB3 H 1 1.389 0.02 . 2 . . . . 329 LYS HB3 . 17623 1 1324 . 1 1 185 185 LYS HG2 H 1 1.592 0.02 . 2 . . . . 329 LYS HG2 . 17623 1 1325 . 1 1 185 185 LYS HG3 H 1 1.539 0.02 . 2 . . . . 329 LYS HG3 . 17623 1 1326 . 1 1 185 185 LYS HD2 H 1 1.198 0.02 . 2 . . . . 329 LYS HD2 . 17623 1 1327 . 1 1 185 185 LYS HD3 H 1 1.078 0.02 . 2 . . . . 329 LYS HD3 . 17623 1 1328 . 1 1 185 185 LYS HE2 H 1 2.912 0.02 . 2 . . . . 329 LYS HE2 . 17623 1 1329 . 1 1 185 185 LYS HE3 H 1 2.874 0.02 . 2 . . . . 329 LYS HE3 . 17623 1 1330 . 1 1 185 185 LYS CA C 13 54.409 0.2 . 1 . . . . 329 LYS CA . 17623 1 1331 . 1 1 185 185 LYS CB C 13 34.767 0.2 . 1 . . . . 329 LYS CB . 17623 1 1332 . 1 1 185 185 LYS CG C 13 24.910 0.2 . 1 . . . . 329 LYS CG . 17623 1 1333 . 1 1 185 185 LYS CD C 13 29.471 0.2 . 1 . . . . 329 LYS CD . 17623 1 1334 . 1 1 185 185 LYS CE C 13 41.907 0.2 . 1 . . . . 329 LYS CE . 17623 1 1335 . 1 1 185 185 LYS N N 15 119.750 0.2 . 1 . . . . 329 LYS N . 17623 1 1336 . 1 1 186 186 LEU H H 1 8.648 0.02 . 1 . . . . 330 LEU H . 17623 1 1337 . 1 1 186 186 LEU HA H 1 4.519 0.02 . 1 . . . . 330 LEU HA . 17623 1 1338 . 1 1 186 186 LEU HB2 H 1 2.004 0.02 . 2 . . . . 330 LEU HB2 . 17623 1 1339 . 1 1 186 186 LEU HB3 H 1 1.115 0.02 . 2 . . . . 330 LEU HB3 . 17623 1 1340 . 1 1 186 186 LEU HG H 1 1.653 0.02 . 1 . . . . 330 LEU HG . 17623 1 1341 . 1 1 186 186 LEU HD11 H 1 0.534 0.02 . 4 . . . . 330 LEU HD1 . 17623 1 1342 . 1 1 186 186 LEU HD12 H 1 0.534 0.02 . 4 . . . . 330 LEU HD1 . 17623 1 1343 . 1 1 186 186 LEU HD13 H 1 0.534 0.02 . 4 . . . . 330 LEU HD1 . 17623 1 1344 . 1 1 186 186 LEU HD21 H 1 0.713 0.02 . 4 . . . . 330 LEU HD2 . 17623 1 1345 . 1 1 186 186 LEU HD22 H 1 0.713 0.02 . 4 . . . . 330 LEU HD2 . 17623 1 1346 . 1 1 186 186 LEU HD23 H 1 0.713 0.02 . 4 . . . . 330 LEU HD2 . 17623 1 1347 . 1 1 186 186 LEU CA C 13 55.220 0.2 . 1 . . . . 330 LEU CA . 17623 1 1348 . 1 1 186 186 LEU CB C 13 42.842 0.2 . 1 . . . . 330 LEU CB . 17623 1 1349 . 1 1 186 186 LEU CG C 13 26.714 0.2 . 1 . . . . 330 LEU CG . 17623 1 1350 . 1 1 186 186 LEU CD1 C 13 23.295 0.2 . 2 . . . . 330 LEU CD1 . 17623 1 1351 . 1 1 186 186 LEU CD2 C 13 25.590 0.2 . 2 . . . . 330 LEU CD2 . 17623 1 1352 . 1 1 186 186 LEU N N 15 123.373 0.2 . 1 . . . . 330 LEU N . 17623 1 1353 . 1 1 187 187 LEU H H 1 8.355 0.02 . 1 . . . . 331 LEU H . 17623 1 1354 . 1 1 187 187 LEU HA H 1 4.910 0.02 . 1 . . . . 331 LEU HA . 17623 1 1355 . 1 1 187 187 LEU HB2 H 1 1.553 0.02 . 2 . . . . 331 LEU HB2 . 17623 1 1356 . 1 1 187 187 LEU HB3 H 1 1.382 0.02 . 2 . . . . 331 LEU HB3 . 17623 1 1357 . 1 1 187 187 LEU HG H 1 1.269 0.02 . 1 . . . . 331 LEU HG . 17623 1 1358 . 1 1 187 187 LEU HD11 H 1 0.863 0.02 . 4 . . . . 331 LEU HD1 . 17623 1 1359 . 1 1 187 187 LEU HD12 H 1 0.863 0.02 . 4 . . . . 331 LEU HD1 . 17623 1 1360 . 1 1 187 187 LEU HD13 H 1 0.863 0.02 . 4 . . . . 331 LEU HD1 . 17623 1 1361 . 1 1 187 187 LEU HD21 H 1 0.852 0.02 . 4 . . . . 331 LEU HD2 . 17623 1 1362 . 1 1 187 187 LEU HD22 H 1 0.852 0.02 . 4 . . . . 331 LEU HD2 . 17623 1 1363 . 1 1 187 187 LEU HD23 H 1 0.852 0.02 . 4 . . . . 331 LEU HD2 . 17623 1 1364 . 1 1 187 187 LEU CA C 13 53.617 0.2 . 1 . . . . 331 LEU CA . 17623 1 1365 . 1 1 187 187 LEU CB C 13 44.243 0.2 . 1 . . . . 331 LEU CB . 17623 1 1366 . 1 1 187 187 LEU CG C 13 28.310 0.2 . 1 . . . . 331 LEU CG . 17623 1 1367 . 1 1 187 187 LEU CD1 C 13 23.292 0.2 . 2 . . . . 331 LEU CD1 . 17623 1 1368 . 1 1 187 187 LEU CD2 C 13 25.487 0.2 . 2 . . . . 331 LEU CD2 . 17623 1 1369 . 1 1 187 187 LEU N N 15 127.402 0.2 . 1 . . . . 331 LEU N . 17623 1 1370 . 1 1 188 188 VAL H H 1 8.507 0.02 . 1 . . . . 332 VAL H . 17623 1 1371 . 1 1 188 188 VAL HA H 1 5.224 0.02 . 1 . . . . 332 VAL HA . 17623 1 1372 . 1 1 188 188 VAL HB H 1 1.665 0.02 . 1 . . . . 332 VAL HB . 17623 1 1373 . 1 1 188 188 VAL HG11 H 1 0.752 0.02 . 4 . . . . 332 VAL HG1 . 17623 1 1374 . 1 1 188 188 VAL HG12 H 1 0.752 0.02 . 4 . . . . 332 VAL HG1 . 17623 1 1375 . 1 1 188 188 VAL HG13 H 1 0.752 0.02 . 4 . . . . 332 VAL HG1 . 17623 1 1376 . 1 1 188 188 VAL HG21 H 1 0.804 0.02 . 4 . . . . 332 VAL HG2 . 17623 1 1377 . 1 1 188 188 VAL HG22 H 1 0.804 0.02 . 4 . . . . 332 VAL HG2 . 17623 1 1378 . 1 1 188 188 VAL HG23 H 1 0.804 0.02 . 4 . . . . 332 VAL HG2 . 17623 1 1379 . 1 1 188 188 VAL CA C 13 60.735 0.2 . 1 . . . . 332 VAL CA . 17623 1 1380 . 1 1 188 188 VAL CB C 13 34.206 0.2 . 1 . . . . 332 VAL CB . 17623 1 1381 . 1 1 188 188 VAL CG1 C 13 21.977 0.2 . 2 . . . . 332 VAL CG1 . 17623 1 1382 . 1 1 188 188 VAL CG2 C 13 22.492 0.2 . 2 . . . . 332 VAL CG2 . 17623 1 1383 . 1 1 188 188 VAL N N 15 125.213 0.2 . 1 . . . . 332 VAL N . 17623 1 1384 . 1 1 189 189 GLN H H 1 8.639 0.02 . 1 . . . . 333 GLN H . 17623 1 1385 . 1 1 189 189 GLN HA H 1 4.372 0.02 . 1 . . . . 333 GLN HA . 17623 1 1386 . 1 1 189 189 GLN HB2 H 1 1.841 0.02 . 2 . . . . 333 GLN HB2 . 17623 1 1387 . 1 1 189 189 GLN HB3 H 1 1.602 0.02 . 2 . . . . 333 GLN HB3 . 17623 1 1388 . 1 1 189 189 GLN HG2 H 1 2.109 0.02 . 2 . . . . 333 GLN HG2 . 17623 1 1389 . 1 1 189 189 GLN HG3 H 1 2.109 0.02 . 2 . . . . 333 GLN HG3 . 17623 1 1390 . 1 1 189 189 GLN CA C 13 52.078 0.2 . 1 . . . . 333 GLN CA . 17623 1 1391 . 1 1 189 189 GLN CB C 13 30.371 0.2 . 1 . . . . 333 GLN CB . 17623 1 1392 . 1 1 189 189 GLN CG C 13 33.210 0.2 . 1 . . . . 333 GLN CG . 17623 1 1393 . 1 1 189 189 GLN N N 15 119.485 0.2 . 1 . . . . 333 GLN N . 17623 1 1394 . 1 1 190 190 ARG H H 1 9.042 0.02 . 1 . . . . 334 ARG H . 17623 1 1395 . 1 1 190 190 ARG HA H 1 4.431 0.02 . 1 . . . . 334 ARG HA . 17623 1 1396 . 1 1 190 190 ARG CA C 13 58.887 0.2 . 1 . . . . 334 ARG CA . 17623 1 1397 . 1 1 190 190 ARG N N 15 122.221 0.2 . 1 . . . . 334 ARG N . 17623 1 1398 . 1 1 191 191 ALA H H 1 9.217 0.02 . 1 . . . . 335 ALA H . 17623 1 1399 . 1 1 191 191 ALA HA H 1 4.371 0.02 . 1 . . . . 335 ALA HA . 17623 1 1400 . 1 1 191 191 ALA HB1 H 1 1.569 0.02 . 1 . . . . 335 ALA HB . 17623 1 1401 . 1 1 191 191 ALA HB2 H 1 1.569 0.02 . 1 . . . . 335 ALA HB . 17623 1 1402 . 1 1 191 191 ALA HB3 H 1 1.569 0.02 . 1 . . . . 335 ALA HB . 17623 1 1403 . 1 1 191 191 ALA CA C 13 53.354 0.2 . 1 . . . . 335 ALA CA . 17623 1 1404 . 1 1 191 191 ALA CB C 13 18.502 0.2 . 1 . . . . 335 ALA CB . 17623 1 1405 . 1 1 191 191 ALA N N 15 125.253 0.2 . 1 . . . . 335 ALA N . 17623 1 1406 . 1 1 192 192 SER H H 1 8.502 0.02 . 1 . . . . 336 SER H . 17623 1 1407 . 1 1 192 192 SER HA H 1 4.095 0.02 . 1 . . . . 336 SER HA . 17623 1 1408 . 1 1 192 192 SER HB2 H 1 3.857 0.02 . 2 . . . . 336 SER HB2 . 17623 1 1409 . 1 1 192 192 SER HB3 H 1 3.748 0.02 . 2 . . . . 336 SER HB3 . 17623 1 1410 . 1 1 192 192 SER CA C 13 59.427 0.2 . 1 . . . . 336 SER CA . 17623 1 1411 . 1 1 192 192 SER CB C 13 62.277 0.2 . 1 . . . . 336 SER CB . 17623 1 1412 . 1 1 192 192 SER N N 15 112.259 0.2 . 1 . . . . 336 SER N . 17623 1 1413 . 1 1 193 193 VAL H H 1 7.927 0.02 . 1 . . . . 337 VAL H . 17623 1 1414 . 1 1 193 193 VAL HA H 1 3.572 0.02 . 1 . . . . 337 VAL HA . 17623 1 1415 . 1 1 193 193 VAL HB H 1 1.981 0.02 . 1 . . . . 337 VAL HB . 17623 1 1416 . 1 1 193 193 VAL HG11 H 1 0.755 0.02 . 4 . . . . 337 VAL HG1 . 17623 1 1417 . 1 1 193 193 VAL HG12 H 1 0.755 0.02 . 4 . . . . 337 VAL HG1 . 17623 1 1418 . 1 1 193 193 VAL HG13 H 1 0.755 0.02 . 4 . . . . 337 VAL HG1 . 17623 1 1419 . 1 1 193 193 VAL HG21 H 1 0.984 0.02 . 4 . . . . 337 VAL HG2 . 17623 1 1420 . 1 1 193 193 VAL HG22 H 1 0.984 0.02 . 4 . . . . 337 VAL HG2 . 17623 1 1421 . 1 1 193 193 VAL HG23 H 1 0.984 0.02 . 4 . . . . 337 VAL HG2 . 17623 1 1422 . 1 1 193 193 VAL CA C 13 65.620 0.2 . 1 . . . . 337 VAL CA . 17623 1 1423 . 1 1 193 193 VAL CB C 13 31.840 0.2 . 1 . . . . 337 VAL CB . 17623 1 1424 . 1 1 193 193 VAL CG1 C 13 20.303 0.2 . 2 . . . . 337 VAL CG1 . 17623 1 1425 . 1 1 193 193 VAL CG2 C 13 22.920 0.2 . 2 . . . . 337 VAL CG2 . 17623 1 1426 . 1 1 193 193 VAL N N 15 122.859 0.2 . 1 . . . . 337 VAL N . 17623 1 1427 . 1 1 194 194 GLY H H 1 6.664 0.02 . 1 . . . . 338 GLY H . 17623 1 1428 . 1 1 194 194 GLY HA2 H 1 4.154 0.02 . 2 . . . . 338 GLY HA2 . 17623 1 1429 . 1 1 194 194 GLY HA3 H 1 2.966 0.02 . 2 . . . . 338 GLY HA3 . 17623 1 1430 . 1 1 194 194 GLY CA C 13 43.960 0.2 . 1 . . . . 338 GLY CA . 17623 1 1431 . 1 1 194 194 GLY N N 15 104.070 0.2 . 1 . . . . 338 GLY N . 17623 1 1432 . 1 1 195 195 ALA H H 1 6.769 0.02 . 1 . . . . 339 ALA H . 17623 1 1433 . 1 1 195 195 ALA HA H 1 3.891 0.02 . 1 . . . . 339 ALA HA . 17623 1 1434 . 1 1 195 195 ALA HB1 H 1 1.253 0.02 . 1 . . . . 339 ALA HB . 17623 1 1435 . 1 1 195 195 ALA HB2 H 1 1.253 0.02 . 1 . . . . 339 ALA HB . 17623 1 1436 . 1 1 195 195 ALA HB3 H 1 1.253 0.02 . 1 . . . . 339 ALA HB . 17623 1 1437 . 1 1 195 195 ALA CA C 13 52.251 0.2 . 1 . . . . 339 ALA CA . 17623 1 1438 . 1 1 195 195 ALA CB C 13 18.880 0.2 . 1 . . . . 339 ALA CB . 17623 1 1439 . 1 1 195 195 ALA N N 15 122.960 0.2 . 1 . . . . 339 ALA N . 17623 1 1440 . 1 1 196 196 LYS H H 1 8.013 0.02 . 1 . . . . 340 LYS H . 17623 1 1441 . 1 1 196 196 LYS HA H 1 4.064 0.02 . 1 . . . . 340 LYS HA . 17623 1 1442 . 1 1 196 196 LYS HB2 H 1 1.687 0.02 . 2 . . . . 340 LYS HB2 . 17623 1 1443 . 1 1 196 196 LYS HB3 H 1 1.610 0.02 . 2 . . . . 340 LYS HB3 . 17623 1 1444 . 1 1 196 196 LYS HG2 H 1 1.574 0.02 . 2 . . . . 340 LYS HG2 . 17623 1 1445 . 1 1 196 196 LYS HG3 H 1 1.570 0.02 . 2 . . . . 340 LYS HG3 . 17623 1 1446 . 1 1 196 196 LYS HD2 H 1 1.325 0.02 . 2 . . . . 340 LYS HD2 . 17623 1 1447 . 1 1 196 196 LYS HD3 H 1 1.253 0.02 . 2 . . . . 340 LYS HD3 . 17623 1 1448 . 1 1 196 196 LYS HE2 H 1 2.907 0.02 . 2 . . . . 340 LYS HE2 . 17623 1 1449 . 1 1 196 196 LYS HE3 H 1 2.857 0.02 . 2 . . . . 340 LYS HE3 . 17623 1 1450 . 1 1 196 196 LYS CA C 13 56.424 0.2 . 1 . . . . 340 LYS CA . 17623 1 1451 . 1 1 196 196 LYS CB C 13 32.859 0.2 . 1 . . . . 340 LYS CB . 17623 1 1452 . 1 1 196 196 LYS CG C 13 24.682 0.2 . 1 . . . . 340 LYS CG . 17623 1 1453 . 1 1 196 196 LYS CD C 13 29.032 0.2 . 1 . . . . 340 LYS CD . 17623 1 1454 . 1 1 196 196 LYS CE C 13 41.776 0.2 . 1 . . . . 340 LYS CE . 17623 1 1455 . 1 1 196 196 LYS N N 15 121.524 0.2 . 1 . . . . 340 LYS N . 17623 1 1456 . 1 1 197 197 ASN H H 1 8.275 0.02 . 1 . . . . 341 ASN H . 17623 1 1457 . 1 1 197 197 ASN HA H 1 4.570 0.02 . 1 . . . . 341 ASN HA . 17623 1 1458 . 1 1 197 197 ASN HB2 H 1 2.674 0.02 . 2 . . . . 341 ASN HB2 . 17623 1 1459 . 1 1 197 197 ASN HB3 H 1 2.581 0.02 . 2 . . . . 341 ASN HB3 . 17623 1 1460 . 1 1 197 197 ASN HD21 H 1 6.798 0.02 . 2 . . . . 341 ASN HD21 . 17623 1 1461 . 1 1 197 197 ASN HD22 H 1 7.492 0.02 . 2 . . . . 341 ASN HD22 . 17623 1 1462 . 1 1 197 197 ASN CA C 13 53.036 0.2 . 1 . . . . 341 ASN CA . 17623 1 1463 . 1 1 197 197 ASN CB C 13 39.187 0.2 . 1 . . . . 341 ASN CB . 17623 1 1464 . 1 1 197 197 ASN N N 15 119.828 0.2 . 1 . . . . 341 ASN N . 17623 1 1465 . 1 1 197 197 ASN ND2 N 15 113.551 0.2 . 1 . . . . 341 ASN ND2 . 17623 1 1466 . 1 1 198 198 ALA H H 1 7.688 0.02 . 1 . . . . 342 ALA H . 17623 1 1467 . 1 1 198 198 ALA HA H 1 3.984 0.02 . 1 . . . . 342 ALA HA . 17623 1 1468 . 1 1 198 198 ALA HB1 H 1 1.201 0.02 . 1 . . . . 342 ALA HB . 17623 1 1469 . 1 1 198 198 ALA HB2 H 1 1.201 0.02 . 1 . . . . 342 ALA HB . 17623 1 1470 . 1 1 198 198 ALA HB3 H 1 1.201 0.02 . 1 . . . . 342 ALA HB . 17623 1 1471 . 1 1 198 198 ALA CA C 13 53.727 0.2 . 1 . . . . 342 ALA CA . 17623 1 1472 . 1 1 198 198 ALA CB C 13 20.107 0.2 . 1 . . . . 342 ALA CB . 17623 1 1473 . 1 1 198 198 ALA N N 15 126.516 0.2 . 1 . . . . 342 ALA N . 17623 1 stop_ loop_ _Ambiguous_atom_chem_shift.Ambiguous_shift_set_ID _Ambiguous_atom_chem_shift.Atom_chem_shift_ID _Ambiguous_atom_chem_shift.Entry_ID _Ambiguous_atom_chem_shift.Assigned_chem_shift_list_ID 1 202 17623 1 1 203 17623 1 1 204 17623 1 1 205 17623 1 1 206 17623 1 1 207 17623 1 2 274 17623 1 2 275 17623 1 2 276 17623 1 2 277 17623 1 2 278 17623 1 2 279 17623 1 3 290 17623 1 3 291 17623 1 3 292 17623 1 3 293 17623 1 3 294 17623 1 3 295 17623 1 4 313 17623 1 4 314 17623 1 4 315 17623 1 4 316 17623 1 4 317 17623 1 4 318 17623 1 5 337 17623 1 5 338 17623 1 5 339 17623 1 5 340 17623 1 5 341 17623 1 5 342 17623 1 5 343 17623 1 5 344 17623 1 6 401 17623 1 6 402 17623 1 6 403 17623 1 6 404 17623 1 6 405 17623 1 6 406 17623 1 7 444 17623 1 7 445 17623 1 7 446 17623 1 7 447 17623 1 7 448 17623 1 7 449 17623 1 8 706 17623 1 8 707 17623 1 8 708 17623 1 8 709 17623 1 8 710 17623 1 8 711 17623 1 9 751 17623 1 9 752 17623 1 9 753 17623 1 9 754 17623 1 9 755 17623 1 9 756 17623 1 10 794 17623 1 10 795 17623 1 10 796 17623 1 10 797 17623 1 10 798 17623 1 10 799 17623 1 11 834 17623 1 11 835 17623 1 11 836 17623 1 11 837 17623 1 11 838 17623 1 11 839 17623 1 12 927 17623 1 12 928 17623 1 12 929 17623 1 12 930 17623 1 12 931 17623 1 12 932 17623 1 13 962 17623 1 13 963 17623 1 13 964 17623 1 13 965 17623 1 13 966 17623 1 13 967 17623 1 14 977 17623 1 14 978 17623 1 14 979 17623 1 14 980 17623 1 14 981 17623 1 14 982 17623 1 15 1027 17623 1 15 1028 17623 1 15 1029 17623 1 15 1030 17623 1 15 1031 17623 1 15 1032 17623 1 16 1105 17623 1 16 1106 17623 1 16 1107 17623 1 16 1108 17623 1 16 1109 17623 1 16 1110 17623 1 17 1151 17623 1 17 1152 17623 1 17 1153 17623 1 17 1154 17623 1 17 1155 17623 1 17 1156 17623 1 18 1202 17623 1 18 1203 17623 1 18 1204 17623 1 18 1205 17623 1 18 1206 17623 1 18 1207 17623 1 19 1231 17623 1 19 1232 17623 1 19 1233 17623 1 19 1234 17623 1 19 1235 17623 1 19 1236 17623 1 20 1341 17623 1 20 1342 17623 1 20 1343 17623 1 20 1344 17623 1 20 1345 17623 1 20 1346 17623 1 21 1358 17623 1 21 1359 17623 1 21 1360 17623 1 21 1361 17623 1 21 1362 17623 1 21 1363 17623 1 22 1373 17623 1 22 1374 17623 1 22 1375 17623 1 22 1376 17623 1 22 1377 17623 1 22 1378 17623 1 23 1416 17623 1 23 1417 17623 1 23 1418 17623 1 23 1419 17623 1 23 1420 17623 1 23 1421 17623 1 stop_ save_