data_16538 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 16538 _Entry.Title ; 15N, 13C and 1H Resonance Assignments of the Middle MA-3 Domain of the Tumour Suppressor Protein Pdcd4 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2009-10-05 _Entry.Accession_date 2009-10-05 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.0.9.13 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details . _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 Lorna Waters . C. . 16538 2 Ojore Oka . . . 16538 3 Frederick Muskett . W. . 16538 4 Sarah Strong . L. . 16538 5 Thore Schmedt . . . 16538 6 Karl-Heinz Klempnauer . . . 16538 7 Mark Carr . D. . 16538 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID . . 'Klempnauer group, Westf lische-Wilhelms-Universit t M nster' . 16538 1 . 'Carr group, University of Leicester' . 16538 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 16538 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 658 16538 '15N chemical shifts' 157 16538 '1H chemical shifts' 1092 16538 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 2 . . 2010-05-18 2009-10-05 update BMRB 'complete entry citation' 16538 1 . . 2010-01-11 2009-10-05 original author 'original release' 16538 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 16542 'Complete Tandem MA-3 Region' 16538 stop_ save_ ############### # Citations # ############### save_MA3M_Assignments _Citation.Sf_category citations _Citation.Sf_framecode MA3M_Assignments _Citation.Entry_ID 16538 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 20020227 _Citation.Full_citation . _Citation.Title 'Resonance Assignment and Secondary Structure of the Middle MA-3 Domain and Complete Tandem MA-3 Region of the Tumour Suppressor Protein Pdcd4.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assignments' _Citation.Journal_name_full 'Biomolecular NMR assignments' _Citation.Journal_volume 4 _Citation.Journal_issue 1 _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 49 _Citation.Page_last 53 _Citation.Year 2009 _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 Lorna Waters . C. . 16538 1 2 Ojore Oka . . . 16538 1 3 Frederick Muskett . W. . 16538 1 4 Sarah Strong . L. . 16538 1 5 Thore Schmedt . . . 16538 1 6 Karl-Heinz Klempnauer . . . 16538 1 7 Mark Carr . D. . 16538 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID MA-3 16538 1 Pdcd4 16538 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 16538 _Assembly.ID 1 _Assembly.Name 'Pdcd4 MA-3M' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 'Pdcd4 MA-3M' 1 $Pdcd4_MA-3M A . yes native no no . . . 16538 1 stop_ loop_ _Assembly_db_link.Author_supplied _Assembly_db_link.Database_code _Assembly_db_link.Accession_code _Assembly_db_link.Entry_mol_code _Assembly_db_link.Entry_mol_name _Assembly_db_link.Entry_experimental_method _Assembly_db_link.Entry_structure_resolution _Assembly_db_link.Entry_relation_type _Assembly_db_link.Entry_details _Assembly_db_link.Entry_ID _Assembly_db_link.Assembly_ID yes PDB 2RG8 . . X-ray 1.8 'Structure for th midde MA3 domain (MA-3M) of human Pdcd4 (residues 156-305)' . 16538 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_Pdcd4_MA-3M _Entity.Sf_category entity _Entity.Sf_framecode Pdcd4_MA-3M _Entity.Entry_ID 16538 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name Pdcd4_MA-3M _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GPLGSLPLDETAFEKTLTPI IQEYFEHGDTNEVAEMLRDL NLGEMKSGVPVLAVSLALEG KASHREMTSKLLSDLCGTVM STNDVEKSFDKLLKDLPELA LDTPRAPQLVGQFIARAVGD GILCNTYIDSYKGTVDCVQA RAALDKATVLLSMSKGGKRK DSVWGSG ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details 'Residues 152-156 are cloning artifacts and not part of the native sequence.' _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 167 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment 'Middle MA-3 Domain: Residues 157-318.' _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 2KZT . "Structure Of The Tandem Ma-3 Region Of Pdcd4" . . . . . 97.01 163 98.77 98.77 5.27e-111 . . . . 16538 1 2 no GB EAW49553 . "programmed cell death 4 (neoplastic transformation inhibitor), isoform CRA_b [Homo sapiens]" . . . . . 81.44 292 98.53 98.53 1.48e-89 . . . . 16538 1 3 no GB ELK04959 . "Programmed cell death protein 4 [Pteropus alecto]" . . . . . 97.01 396 100.00 100.00 1.29e-109 . . . . 16538 1 4 no GB ELW50500 . "Programmed cell death protein 4, partial [Tupaia chinensis]" . . . . . 97.01 320 99.38 99.38 4.78e-110 . . . . 16538 1 5 no GB ERE78070 . "programmed cell death protein 4 [Cricetulus griseus]" . . . . . 97.01 404 100.00 100.00 2.30e-109 . . . . 16538 1 6 no GB ERE78071 . "programmed cell death protein 4 [Cricetulus griseus]" . . . . . 97.01 488 100.00 100.00 4.38e-108 . . . . 16538 1 7 no REF XP_008053135 . "PREDICTED: programmed cell death protein 4 isoform X2 [Tarsius syrichta]" . . . . . 97.01 433 99.38 99.38 1.64e-108 . . . . 16538 1 8 no REF XP_008053136 . "PREDICTED: programmed cell death protein 4 isoform X3 [Tarsius syrichta]" . . . . . 97.01 380 99.38 99.38 7.75e-109 . . . . 16538 1 9 no REF XP_012028877 . "PREDICTED: programmed cell death protein 4 isoform X3, partial [Ovis aries musimon]" . . . . . 79.04 171 99.24 99.24 3.92e-88 . . . . 16538 1 stop_ loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID 'Transcriptional Regulator' 16538 1 'Translational Regulator' 16538 1 'Tumour Suppressor' 16538 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 1 152 GLY . 16538 1 2 153 PRO . 16538 1 3 154 LEU . 16538 1 4 155 GLY . 16538 1 5 156 SER . 16538 1 6 157 LEU . 16538 1 7 158 PRO . 16538 1 8 159 LEU . 16538 1 9 160 ASP . 16538 1 10 161 GLU . 16538 1 11 162 THR . 16538 1 12 163 ALA . 16538 1 13 164 PHE . 16538 1 14 165 GLU . 16538 1 15 166 LYS . 16538 1 16 167 THR . 16538 1 17 168 LEU . 16538 1 18 169 THR . 16538 1 19 170 PRO . 16538 1 20 171 ILE . 16538 1 21 172 ILE . 16538 1 22 173 GLN . 16538 1 23 174 GLU . 16538 1 24 175 TYR . 16538 1 25 176 PHE . 16538 1 26 177 GLU . 16538 1 27 178 HIS . 16538 1 28 179 GLY . 16538 1 29 180 ASP . 16538 1 30 181 THR . 16538 1 31 182 ASN . 16538 1 32 183 GLU . 16538 1 33 184 VAL . 16538 1 34 185 ALA . 16538 1 35 186 GLU . 16538 1 36 187 MET . 16538 1 37 188 LEU . 16538 1 38 189 ARG . 16538 1 39 190 ASP . 16538 1 40 191 LEU . 16538 1 41 192 ASN . 16538 1 42 193 LEU . 16538 1 43 194 GLY . 16538 1 44 195 GLU . 16538 1 45 196 MET . 16538 1 46 197 LYS . 16538 1 47 198 SER . 16538 1 48 199 GLY . 16538 1 49 200 VAL . 16538 1 50 201 PRO . 16538 1 51 202 VAL . 16538 1 52 203 LEU . 16538 1 53 204 ALA . 16538 1 54 205 VAL . 16538 1 55 206 SER . 16538 1 56 207 LEU . 16538 1 57 208 ALA . 16538 1 58 209 LEU . 16538 1 59 210 GLU . 16538 1 60 211 GLY . 16538 1 61 212 LYS . 16538 1 62 213 ALA . 16538 1 63 214 SER . 16538 1 64 215 HIS . 16538 1 65 216 ARG . 16538 1 66 217 GLU . 16538 1 67 218 MET . 16538 1 68 219 THR . 16538 1 69 220 SER . 16538 1 70 221 LYS . 16538 1 71 222 LEU . 16538 1 72 223 LEU . 16538 1 73 224 SER . 16538 1 74 225 ASP . 16538 1 75 226 LEU . 16538 1 76 227 CYS . 16538 1 77 228 GLY . 16538 1 78 229 THR . 16538 1 79 230 VAL . 16538 1 80 231 MET . 16538 1 81 232 SER . 16538 1 82 233 THR . 16538 1 83 234 ASN . 16538 1 84 235 ASP . 16538 1 85 236 VAL . 16538 1 86 237 GLU . 16538 1 87 238 LYS . 16538 1 88 239 SER . 16538 1 89 240 PHE . 16538 1 90 241 ASP . 16538 1 91 242 LYS . 16538 1 92 243 LEU . 16538 1 93 244 LEU . 16538 1 94 245 LYS . 16538 1 95 246 ASP . 16538 1 96 247 LEU . 16538 1 97 248 PRO . 16538 1 98 249 GLU . 16538 1 99 250 LEU . 16538 1 100 251 ALA . 16538 1 101 252 LEU . 16538 1 102 253 ASP . 16538 1 103 254 THR . 16538 1 104 255 PRO . 16538 1 105 256 ARG . 16538 1 106 257 ALA . 16538 1 107 258 PRO . 16538 1 108 259 GLN . 16538 1 109 260 LEU . 16538 1 110 261 VAL . 16538 1 111 262 GLY . 16538 1 112 263 GLN . 16538 1 113 264 PHE . 16538 1 114 265 ILE . 16538 1 115 266 ALA . 16538 1 116 267 ARG . 16538 1 117 268 ALA . 16538 1 118 269 VAL . 16538 1 119 270 GLY . 16538 1 120 271 ASP . 16538 1 121 272 GLY . 16538 1 122 273 ILE . 16538 1 123 274 LEU . 16538 1 124 275 CYS . 16538 1 125 276 ASN . 16538 1 126 277 THR . 16538 1 127 278 TYR . 16538 1 128 279 ILE . 16538 1 129 280 ASP . 16538 1 130 281 SER . 16538 1 131 282 TYR . 16538 1 132 283 LYS . 16538 1 133 284 GLY . 16538 1 134 285 THR . 16538 1 135 286 VAL . 16538 1 136 287 ASP . 16538 1 137 288 CYS . 16538 1 138 289 VAL . 16538 1 139 290 GLN . 16538 1 140 291 ALA . 16538 1 141 292 ARG . 16538 1 142 293 ALA . 16538 1 143 294 ALA . 16538 1 144 295 LEU . 16538 1 145 296 ASP . 16538 1 146 297 LYS . 16538 1 147 298 ALA . 16538 1 148 299 THR . 16538 1 149 300 VAL . 16538 1 150 301 LEU . 16538 1 151 302 LEU . 16538 1 152 303 SER . 16538 1 153 304 MET . 16538 1 154 305 SER . 16538 1 155 306 LYS . 16538 1 156 307 GLY . 16538 1 157 308 GLY . 16538 1 158 309 LYS . 16538 1 159 310 ARG . 16538 1 160 311 LYS . 16538 1 161 312 ASP . 16538 1 162 313 SER . 16538 1 163 314 VAL . 16538 1 164 315 TRP . 16538 1 165 316 GLY . 16538 1 166 317 SER . 16538 1 167 318 GLY . 16538 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 16538 1 . PRO 2 2 16538 1 . LEU 3 3 16538 1 . GLY 4 4 16538 1 . SER 5 5 16538 1 . LEU 6 6 16538 1 . PRO 7 7 16538 1 . LEU 8 8 16538 1 . ASP 9 9 16538 1 . GLU 10 10 16538 1 . THR 11 11 16538 1 . ALA 12 12 16538 1 . PHE 13 13 16538 1 . GLU 14 14 16538 1 . LYS 15 15 16538 1 . THR 16 16 16538 1 . LEU 17 17 16538 1 . THR 18 18 16538 1 . PRO 19 19 16538 1 . ILE 20 20 16538 1 . ILE 21 21 16538 1 . GLN 22 22 16538 1 . GLU 23 23 16538 1 . TYR 24 24 16538 1 . PHE 25 25 16538 1 . GLU 26 26 16538 1 . HIS 27 27 16538 1 . GLY 28 28 16538 1 . ASP 29 29 16538 1 . THR 30 30 16538 1 . ASN 31 31 16538 1 . GLU 32 32 16538 1 . VAL 33 33 16538 1 . ALA 34 34 16538 1 . GLU 35 35 16538 1 . MET 36 36 16538 1 . LEU 37 37 16538 1 . ARG 38 38 16538 1 . ASP 39 39 16538 1 . LEU 40 40 16538 1 . ASN 41 41 16538 1 . LEU 42 42 16538 1 . GLY 43 43 16538 1 . GLU 44 44 16538 1 . MET 45 45 16538 1 . LYS 46 46 16538 1 . SER 47 47 16538 1 . GLY 48 48 16538 1 . VAL 49 49 16538 1 . PRO 50 50 16538 1 . VAL 51 51 16538 1 . LEU 52 52 16538 1 . ALA 53 53 16538 1 . VAL 54 54 16538 1 . SER 55 55 16538 1 . LEU 56 56 16538 1 . ALA 57 57 16538 1 . LEU 58 58 16538 1 . GLU 59 59 16538 1 . GLY 60 60 16538 1 . LYS 61 61 16538 1 . ALA 62 62 16538 1 . SER 63 63 16538 1 . HIS 64 64 16538 1 . ARG 65 65 16538 1 . GLU 66 66 16538 1 . MET 67 67 16538 1 . THR 68 68 16538 1 . SER 69 69 16538 1 . LYS 70 70 16538 1 . LEU 71 71 16538 1 . LEU 72 72 16538 1 . SER 73 73 16538 1 . ASP 74 74 16538 1 . LEU 75 75 16538 1 . CYS 76 76 16538 1 . GLY 77 77 16538 1 . THR 78 78 16538 1 . VAL 79 79 16538 1 . MET 80 80 16538 1 . SER 81 81 16538 1 . THR 82 82 16538 1 . ASN 83 83 16538 1 . ASP 84 84 16538 1 . VAL 85 85 16538 1 . GLU 86 86 16538 1 . LYS 87 87 16538 1 . SER 88 88 16538 1 . PHE 89 89 16538 1 . ASP 90 90 16538 1 . LYS 91 91 16538 1 . LEU 92 92 16538 1 . LEU 93 93 16538 1 . LYS 94 94 16538 1 . ASP 95 95 16538 1 . LEU 96 96 16538 1 . PRO 97 97 16538 1 . GLU 98 98 16538 1 . LEU 99 99 16538 1 . ALA 100 100 16538 1 . LEU 101 101 16538 1 . ASP 102 102 16538 1 . THR 103 103 16538 1 . PRO 104 104 16538 1 . ARG 105 105 16538 1 . ALA 106 106 16538 1 . PRO 107 107 16538 1 . GLN 108 108 16538 1 . LEU 109 109 16538 1 . VAL 110 110 16538 1 . GLY 111 111 16538 1 . GLN 112 112 16538 1 . PHE 113 113 16538 1 . ILE 114 114 16538 1 . ALA 115 115 16538 1 . ARG 116 116 16538 1 . ALA 117 117 16538 1 . VAL 118 118 16538 1 . GLY 119 119 16538 1 . ASP 120 120 16538 1 . GLY 121 121 16538 1 . ILE 122 122 16538 1 . LEU 123 123 16538 1 . CYS 124 124 16538 1 . ASN 125 125 16538 1 . THR 126 126 16538 1 . TYR 127 127 16538 1 . ILE 128 128 16538 1 . ASP 129 129 16538 1 . SER 130 130 16538 1 . TYR 131 131 16538 1 . LYS 132 132 16538 1 . GLY 133 133 16538 1 . THR 134 134 16538 1 . VAL 135 135 16538 1 . ASP 136 136 16538 1 . CYS 137 137 16538 1 . VAL 138 138 16538 1 . GLN 139 139 16538 1 . ALA 140 140 16538 1 . ARG 141 141 16538 1 . ALA 142 142 16538 1 . ALA 143 143 16538 1 . LEU 144 144 16538 1 . ASP 145 145 16538 1 . LYS 146 146 16538 1 . ALA 147 147 16538 1 . THR 148 148 16538 1 . VAL 149 149 16538 1 . LEU 150 150 16538 1 . LEU 151 151 16538 1 . SER 152 152 16538 1 . MET 153 153 16538 1 . SER 154 154 16538 1 . LYS 155 155 16538 1 . GLY 156 156 16538 1 . GLY 157 157 16538 1 . LYS 158 158 16538 1 . ARG 159 159 16538 1 . LYS 160 160 16538 1 . ASP 161 161 16538 1 . SER 162 162 16538 1 . VAL 163 163 16538 1 . TRP 164 164 16538 1 . GLY 165 165 16538 1 . SER 166 166 16538 1 . GLY 167 167 16538 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 16538 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Subvariant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $Pdcd4_MA-3M . 10090 organism . 'Mus musculus' Mouse . . Eukaryota Metazoa Mus musculus . . . . . . . . . . . . . . . . . . 'Middle MA-3 domain. Residues 157-318' . . 16538 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 16538 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $Pdcd4_MA-3M . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli 'BL21 (DE3) Star' . . . . . . . . . . . . . . . pGex-6P-2 . . . . . . 16538 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_15N_13C _Sample.Sf_category sample _Sample.Sf_framecode 15N_13C _Sample.Entry_ID 16538 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'Pdcd4 MA-3M' '[U-99% 13C; U-99% 15N]' . . 1 $Pdcd4_MA-3M . . 0.5 . . mM . . . . 16538 1 2 'Sodium Phosphate' 'natural abundance' . . . . . . 25 . . mM . . . . 16538 1 3 'sodium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 16538 1 4 DTT 'natural abundance' . . . . . . 0.5 . . mM . . . . 16538 1 5 EDTA 'natural abundance' . . . . . . 10 . . uM . . . . 16538 1 6 'AEBSF protease inhibitor' 'natural abundance' . . . . . . 200 . . uM . . . . 16538 1 7 'Sodium Azide' 'natural abundance' . . . . . . 0.02 . . % . . . . 16538 1 stop_ save_ save_15N _Sample.Sf_category sample _Sample.Sf_framecode 15N _Sample.Entry_ID 16538 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number 2 _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'Pdcd4 MA-3M' '[U-99% 15N]' . . 1 $Pdcd4_MA-3M . . 0.5-1.4 . . mM . . . . 16538 2 2 'Sodium Phosphate' 'natural abundance' . . . . . . 25 . . mM . . . . 16538 2 3 'sodium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 16538 2 4 DTT 'natural abundance' . . . . . . 0.5 . . mM . . . . 16538 2 5 EDTA 'natural abundance' . . . . . . 10 . . uM . . . . 16538 2 6 'AEBSF protease inhibitor' 'natural abundance' . . . . . . 200 . . uM . . . . 16538 2 7 'Sodium Azide' 'natural abundance' . . . . . . 0.02 . . % . . . . 16538 2 stop_ save_ save_13C _Sample.Sf_category sample _Sample.Sf_framecode 13C _Sample.Entry_ID 16538 _Sample.ID 3 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'Pdcd4 MA-3M' '[U-99% 13C]' . . 1 $Pdcd4_MA-3M . . 0.5 . . mM . . . . 16538 3 2 'Sodium Phosphate' 'natural abundance' . . . . . . 25 . . mM . . . . 16538 3 3 'sodium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 16538 3 4 DTT 'natural abundance' . . . . . . 0.5 . . mM . . . . 16538 3 5 EDTA 'natural abundance' . . . . . . 10 . . uM . . . . 16538 3 6 'AEBSF protease inhibitor' 'natural abundance' . . . . . . 200 . . uM . . . . 16538 3 7 'Sodium Azide' 'natural abundance' . . . . . . 0.02 . . % . . . . 16538 3 stop_ save_ save_13C_unlabel_arom _Sample.Sf_category sample _Sample.Sf_framecode 13C_unlabel_arom _Sample.Entry_ID 16538 _Sample.ID 4 _Sample.Type solution _Sample.Sub_type . _Sample.Details '13C labelled with Unlabelled Aromatics' _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'Pdcd4 MA-3M' '[U-99% 13C]' . . 1 $Pdcd4_MA-3M . . 0.5 . . mM . . . . 16538 4 2 'Sodium Phosphate' 'natural abundance' . . . . . . 25 . . mM . . . . 16538 4 3 'sodium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 16538 4 4 DTT 'natural abundance' . . . . . . 0.5 . . mM . . . . 16538 4 5 EDTA 'natural abundance' . . . . . . 10 . . uM . . . . 16538 4 6 'AEBSF protease inhibitor' 'natural abundance' . . . . . . 200 . . uM . . . . 16538 4 7 'Sodium Azide' 'natural abundance' . . . . . . 0.02 . . % . . . . 16538 4 stop_ save_ save_Unlabelled _Sample.Sf_category sample _Sample.Sf_framecode Unlabelled _Sample.Entry_ID 16538 _Sample.ID 5 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'Pdcd4 MA-3M' 'natural abundance' . . 1 $Pdcd4_MA-3M . . 0.5 . . mM . . . . 16538 5 2 'Sodium Phosphate' 'natural abundance' . . . . . . 25 . . mM . . . . 16538 5 3 'sodium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 16538 5 4 DTT 'natural abundance' . . . . . . 0.5 . . mM . . . . 16538 5 5 EDTA 'natural abundance' . . . . . . 10 . . uM . . . . 16538 5 6 'AEBSF protease inhibitor' 'natural abundance' . . . . . . 200 . . uM . . . . 16538 5 7 'Sodium Azide' 'natural abundance' . . . . . . 0.02 . . % . . . . 16538 5 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 16538 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0.15 . M 16538 1 pH 6.5 . pH 16538 1 pressure 1 . atm 16538 1 temperature 298 . K 16538 1 stop_ save_ ############################ # Computer software used # ############################ save_TOPSPIN _Software.Sf_category software _Software.Sf_framecode TOPSPIN _Software.Entry_ID 16538 _Software.ID 1 _Software.Name TOPSPIN _Software.Version 2.1 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 16538 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 16538 1 processing 16538 1 stop_ save_ save_SPARKY _Software.Sf_category software _Software.Sf_framecode SPARKY _Software.Entry_ID 16538 _Software.ID 2 _Software.Name SPARKY _Software.Version 3.110 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . 16538 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 16538 2 'peak picking' 16538 2 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_800 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode 800 _NMR_spectrometer.Entry_ID 16538 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details 'With cryoprobe' _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_600-DRX _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode 600-DRX _NMR_spectrometer.Entry_ID 16538 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details 'With Cryoprobe' _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DRX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_600-Avance _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode 600-Avance _NMR_spectrometer.Entry_ID 16538 _NMR_spectrometer.ID 3 _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 16538 _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 1 800 Bruker Avance . 800 'With cryoprobe' . . 16538 1 2 600-DRX Bruker DRX . 600 'With Cryoprobe' . . 16538 1 3 600-Avance Bruker Avance . 600 . . . 16538 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 16538 _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 '3D HNCACB' no . . . . . . . . . . 1 $15N_13C isotropic . . 1 $sample_conditions_1 . . . 1 $800 . . . . . . . . . . . . . . . . 16538 1 2 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $15N_13C isotropic . . 1 $sample_conditions_1 . . . 3 $600-Avance . . . . . . . . . . . . . . . . 16538 1 3 '3D HNCO' no . . . . . . . . . . 1 $15N_13C isotropic . . 1 $sample_conditions_1 . . . 3 $600-Avance . . . . . . . . . . . . . . . . 16538 1 4 '2D 1H-15N HSQC' no . . . . . . . . . . 2 $15N isotropic . . 1 $sample_conditions_1 . . . 3 $600-Avance . . . . . . . . . . . . . . . . 16538 1 5 '2D 1H-1H TOCSY' no . . . . . . . . . . 5 $Unlabelled isotropic . . 1 $sample_conditions_1 . . . 2 $600-DRX . . . . . . . . . . . . . . . . 16538 1 6 '2D 1H-1H NOESY' no . . . . . . . . . . 5 $Unlabelled isotropic . . 1 $sample_conditions_1 . . . 2 $600-DRX . . . . . . . . . . . . . . . . 16538 1 7 '3D 1H-15N NOESY-HSQC' no . . . . . . . . . . 2 $15N isotropic . . 1 $sample_conditions_1 . . . 1 $800 . . . . . . . . . . . . . . . . 16538 1 8 '3D 1H-15N TOCSY-HSQC' no . . . . . . . . . . 2 $15N isotropic . . 1 $sample_conditions_1 . . . 2 $600-DRX . . . . . . . . . . . . . . . . 16538 1 9 '3D HCCH-TOCSY' no . . . . . . . . . . 3 $13C isotropic . . 1 $sample_conditions_1 . . . 2 $600-DRX . . . . . . . . . . . . . . . . 16538 1 10 '3D 1H-13C HSQC-NOESY' no . . . . . . . . . . 4 $13C_unlabel_arom isotropic . . 1 $sample_conditions_1 . . . 1 $800 . . . . . . . . . . . . . . . . 16538 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 16538 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 . indirect 0.251449530 . . . . . . . . . 16538 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 16538 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 . indirect 0.101329118 . . . . . . . . . 16538 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 16538 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '3D HNCACB' . . . 16538 1 2 '3D CBCA(CO)NH' . . . 16538 1 3 '3D HNCO' . . . 16538 1 4 '2D 1H-15N HSQC' . . . 16538 1 5 '2D 1H-1H TOCSY' . . . 16538 1 6 '2D 1H-1H NOESY' . . . 16538 1 7 '3D 1H-15N NOESY-HSQC' . . . 16538 1 8 '3D 1H-15N TOCSY-HSQC' . . . 16538 1 9 '3D HCCH-TOCSY' . . . 16538 1 10 '3D 1H-13C HSQC-NOESY' . . . 16538 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 2 $SPARKY . . 16538 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 2 2 PRO HA H 1 4.441 0.020 . 1 . . . . 153 PRO HA . 16538 1 2 . 1 1 2 2 PRO HB2 H 1 2.285 0.020 . 2 . . . . 153 PRO HB2 . 16538 1 3 . 1 1 2 2 PRO HB3 H 1 1.921 0.020 . 2 . . . . 153 PRO HB3 . 16538 1 4 . 1 1 2 2 PRO HD2 H 1 3.547 0.020 . 2 . . . . 153 PRO HD2 . 16538 1 5 . 1 1 2 2 PRO HD3 H 1 3.548 0.020 . 2 . . . . 153 PRO HD3 . 16538 1 6 . 1 1 2 2 PRO HG2 H 1 1.980 0.020 . 2 . . . . 153 PRO HG2 . 16538 1 7 . 1 1 2 2 PRO HG3 H 1 1.981 0.020 . 2 . . . . 153 PRO HG3 . 16538 1 8 . 1 1 2 2 PRO C C 13 177.041 0.400 . 1 . . . . 153 PRO C . 16538 1 9 . 1 1 2 2 PRO CA C 13 63.184 0.400 . 1 . . . . 153 PRO CA . 16538 1 10 . 1 1 2 2 PRO CB C 13 32.344 0.400 . 1 . . . . 153 PRO CB . 16538 1 11 . 1 1 2 2 PRO CD C 13 49.699 0.400 . 1 . . . . 153 PRO CD . 16538 1 12 . 1 1 2 2 PRO CG C 13 27.102 0.400 . 1 . . . . 153 PRO CG . 16538 1 13 . 1 1 3 3 LEU H H 1 8.521 0.020 . 1 . . . . 154 LEU H . 16538 1 14 . 1 1 3 3 LEU HA H 1 4.314 0.020 . 1 . . . . 154 LEU HA . 16538 1 15 . 1 1 3 3 LEU HB2 H 1 1.634 0.020 . 2 . . . . 154 LEU HB2 . 16538 1 16 . 1 1 3 3 LEU HB3 H 1 1.593 0.020 . 2 . . . . 154 LEU HB3 . 16538 1 17 . 1 1 3 3 LEU HD11 H 1 0.898 0.020 . 2 . . . . 154 LEU HD1 . 16538 1 18 . 1 1 3 3 LEU HD12 H 1 0.898 0.020 . 2 . . . . 154 LEU HD1 . 16538 1 19 . 1 1 3 3 LEU HD13 H 1 0.898 0.020 . 2 . . . . 154 LEU HD1 . 16538 1 20 . 1 1 3 3 LEU HD21 H 1 0.851 0.020 . 2 . . . . 154 LEU HD2 . 16538 1 21 . 1 1 3 3 LEU HD22 H 1 0.851 0.020 . 2 . . . . 154 LEU HD2 . 16538 1 22 . 1 1 3 3 LEU HD23 H 1 0.851 0.020 . 2 . . . . 154 LEU HD2 . 16538 1 23 . 1 1 3 3 LEU HG H 1 1.630 0.020 . 1 . . . . 154 LEU HG . 16538 1 24 . 1 1 3 3 LEU C C 13 177.901 0.400 . 1 . . . . 154 LEU C . 16538 1 25 . 1 1 3 3 LEU CA C 13 55.436 0.400 . 1 . . . . 154 LEU CA . 16538 1 26 . 1 1 3 3 LEU CB C 13 42.172 0.400 . 1 . . . . 154 LEU CB . 16538 1 27 . 1 1 3 3 LEU CD1 C 13 24.957 0.400 . 1 . . . . 154 LEU CD1 . 16538 1 28 . 1 1 3 3 LEU CD2 C 13 23.544 0.400 . 1 . . . . 154 LEU CD2 . 16538 1 29 . 1 1 3 3 LEU CG C 13 27.091 0.400 . 1 . . . . 154 LEU CG . 16538 1 30 . 1 1 3 3 LEU N N 15 122.219 0.400 . 1 . . . . 154 LEU N . 16538 1 31 . 1 1 4 4 GLY H H 1 8.368 0.020 . 1 . . . . 155 GLY H . 16538 1 32 . 1 1 4 4 GLY HA2 H 1 3.949 0.020 . 2 . . . . 155 GLY HA2 . 16538 1 33 . 1 1 4 4 GLY HA3 H 1 3.952 0.020 . 2 . . . . 155 GLY HA3 . 16538 1 34 . 1 1 4 4 GLY C C 13 173.680 0.400 . 1 . . . . 155 GLY C . 16538 1 35 . 1 1 4 4 GLY CA C 13 45.250 0.400 . 1 . . . . 155 GLY CA . 16538 1 36 . 1 1 4 4 GLY N N 15 109.763 0.400 . 1 . . . . 155 GLY N . 16538 1 37 . 1 1 5 5 SER H H 1 7.994 0.020 . 1 . . . . 156 SER H . 16538 1 38 . 1 1 5 5 SER HA H 1 4.405 0.020 . 1 . . . . 156 SER HA . 16538 1 39 . 1 1 5 5 SER HB2 H 1 3.776 0.020 . 2 . . . . 156 SER HB2 . 16538 1 40 . 1 1 5 5 SER C C 13 174.170 0.400 . 1 . . . . 156 SER C . 16538 1 41 . 1 1 5 5 SER CA C 13 58.118 0.400 . 1 . . . . 156 SER CA . 16538 1 42 . 1 1 5 5 SER CB C 13 64.031 0.400 . 1 . . . . 156 SER CB . 16538 1 43 . 1 1 5 5 SER N N 15 115.412 0.400 . 1 . . . . 156 SER N . 16538 1 44 . 1 1 6 6 LEU H H 1 8.233 0.020 . 1 . . . . 157 LEU H . 16538 1 45 . 1 1 6 6 LEU HA H 1 4.606 0.020 . 1 . . . . 157 LEU HA . 16538 1 46 . 1 1 6 6 LEU HB2 H 1 1.589 0.020 . 2 . . . . 157 LEU HB2 . 16538 1 47 . 1 1 6 6 LEU HB3 H 1 1.550 0.020 . 2 . . . . 157 LEU HB3 . 16538 1 48 . 1 1 6 6 LEU HD11 H 1 0.914 0.020 . 2 . . . . 157 LEU HD1 . 16538 1 49 . 1 1 6 6 LEU HD12 H 1 0.914 0.020 . 2 . . . . 157 LEU HD1 . 16538 1 50 . 1 1 6 6 LEU HD13 H 1 0.914 0.020 . 2 . . . . 157 LEU HD1 . 16538 1 51 . 1 1 6 6 LEU HD21 H 1 0.885 0.020 . 2 . . . . 157 LEU HD2 . 16538 1 52 . 1 1 6 6 LEU HD22 H 1 0.885 0.020 . 2 . . . . 157 LEU HD2 . 16538 1 53 . 1 1 6 6 LEU HD23 H 1 0.885 0.020 . 2 . . . . 157 LEU HD2 . 16538 1 54 . 1 1 6 6 LEU HG H 1 1.664 0.020 . 1 . . . . 157 LEU HG . 16538 1 55 . 1 1 6 6 LEU CA C 13 53.147 0.400 . 1 . . . . 157 LEU CA . 16538 1 56 . 1 1 6 6 LEU CB C 13 41.801 0.400 . 1 . . . . 157 LEU CB . 16538 1 57 . 1 1 6 6 LEU CD1 C 13 25.195 0.400 . 1 . . . . 157 LEU CD1 . 16538 1 58 . 1 1 6 6 LEU CD2 C 13 23.409 0.400 . 1 . . . . 157 LEU CD2 . 16538 1 59 . 1 1 6 6 LEU CG C 13 27.069 0.400 . 1 . . . . 157 LEU CG . 16538 1 60 . 1 1 6 6 LEU N N 15 125.034 0.400 . 1 . . . . 157 LEU N . 16538 1 61 . 1 1 7 7 PRO HA H 1 4.433 0.020 . 1 . . . . 158 PRO HA . 16538 1 62 . 1 1 7 7 PRO HB2 H 1 2.208 0.020 . 2 . . . . 158 PRO HB2 . 16538 1 63 . 1 1 7 7 PRO HB3 H 1 1.852 0.020 . 2 . . . . 158 PRO HB3 . 16538 1 64 . 1 1 7 7 PRO HD2 H 1 3.812 0.020 . 2 . . . . 158 PRO HD2 . 16538 1 65 . 1 1 7 7 PRO HD3 H 1 3.601 0.020 . 2 . . . . 158 PRO HD3 . 16538 1 66 . 1 1 7 7 PRO HG2 H 1 2.010 0.020 . 2 . . . . 158 PRO HG2 . 16538 1 67 . 1 1 7 7 PRO HG3 H 1 1.976 0.020 . 2 . . . . 158 PRO HG3 . 16538 1 68 . 1 1 7 7 PRO C C 13 176.738 0.400 . 1 . . . . 158 PRO C . 16538 1 69 . 1 1 7 7 PRO CA C 13 62.857 0.400 . 1 . . . . 158 PRO CA . 16538 1 70 . 1 1 7 7 PRO CB C 13 32.046 0.400 . 1 . . . . 158 PRO CB . 16538 1 71 . 1 1 7 7 PRO CD C 13 50.568 0.400 . 1 . . . . 158 PRO CD . 16538 1 72 . 1 1 7 7 PRO CG C 13 27.474 0.400 . 1 . . . . 158 PRO CG . 16538 1 73 . 1 1 8 8 LEU H H 1 8.151 0.020 . 1 . . . . 159 LEU H . 16538 1 74 . 1 1 8 8 LEU HA H 1 4.243 0.020 . 1 . . . . 159 LEU HA . 16538 1 75 . 1 1 8 8 LEU HB2 H 1 1.588 0.020 . 2 . . . . 159 LEU HB2 . 16538 1 76 . 1 1 8 8 LEU HB3 H 1 1.584 0.020 . 2 . . . . 159 LEU HB3 . 16538 1 77 . 1 1 8 8 LEU HD11 H 1 0.883 0.020 . 2 . . . . 159 LEU HD1 . 16538 1 78 . 1 1 8 8 LEU HD12 H 1 0.883 0.020 . 2 . . . . 159 LEU HD1 . 16538 1 79 . 1 1 8 8 LEU HD13 H 1 0.883 0.020 . 2 . . . . 159 LEU HD1 . 16538 1 80 . 1 1 8 8 LEU HD21 H 1 0.832 0.020 . 2 . . . . 159 LEU HD2 . 16538 1 81 . 1 1 8 8 LEU HD22 H 1 0.832 0.020 . 2 . . . . 159 LEU HD2 . 16538 1 82 . 1 1 8 8 LEU HD23 H 1 0.832 0.020 . 2 . . . . 159 LEU HD2 . 16538 1 83 . 1 1 8 8 LEU HG H 1 1.725 0.020 . 1 . . . . 159 LEU HG . 16538 1 84 . 1 1 8 8 LEU C C 13 176.243 0.400 . 1 . . . . 159 LEU C . 16538 1 85 . 1 1 8 8 LEU CA C 13 55.249 0.400 . 1 . . . . 159 LEU CA . 16538 1 86 . 1 1 8 8 LEU CB C 13 42.903 0.400 . 1 . . . . 159 LEU CB . 16538 1 87 . 1 1 8 8 LEU CD1 C 13 24.982 0.400 . 1 . . . . 159 LEU CD1 . 16538 1 88 . 1 1 8 8 LEU CD2 C 13 24.490 0.400 . 1 . . . . 159 LEU CD2 . 16538 1 89 . 1 1 8 8 LEU CG C 13 26.869 0.400 . 1 . . . . 159 LEU CG . 16538 1 90 . 1 1 8 8 LEU N N 15 122.546 0.400 . 1 . . . . 159 LEU N . 16538 1 91 . 1 1 9 9 ASP H H 1 7.930 0.020 . 1 . . . . 160 ASP H . 16538 1 92 . 1 1 9 9 ASP HA H 1 4.635 0.020 . 1 . . . . 160 ASP HA . 16538 1 93 . 1 1 9 9 ASP HB2 H 1 2.880 0.020 . 2 . . . . 160 ASP HB2 . 16538 1 94 . 1 1 9 9 ASP HB3 H 1 2.686 0.020 . 2 . . . . 160 ASP HB3 . 16538 1 95 . 1 1 9 9 ASP C C 13 176.546 0.400 . 1 . . . . 160 ASP C . 16538 1 96 . 1 1 9 9 ASP CA C 13 53.161 0.400 . 1 . . . . 160 ASP CA . 16538 1 97 . 1 1 9 9 ASP CB C 13 41.844 0.400 . 1 . . . . 160 ASP CB . 16538 1 98 . 1 1 9 9 ASP N N 15 121.895 0.400 . 1 . . . . 160 ASP N . 16538 1 99 . 1 1 10 10 GLU H H 1 8.900 0.020 . 1 . . . . 161 GLU H . 16538 1 100 . 1 1 10 10 GLU HA H 1 4.005 0.020 . 1 . . . . 161 GLU HA . 16538 1 101 . 1 1 10 10 GLU HB2 H 1 2.058 0.020 . 2 . . . . 161 GLU HB2 . 16538 1 102 . 1 1 10 10 GLU HB3 H 1 2.058 0.020 . 2 . . . . 161 GLU HB3 . 16538 1 103 . 1 1 10 10 GLU HG2 H 1 2.291 0.020 . 2 . . . . 161 GLU HG2 . 16538 1 104 . 1 1 10 10 GLU HG3 H 1 2.288 0.020 . 2 . . . . 161 GLU HG3 . 16538 1 105 . 1 1 10 10 GLU C C 13 178.623 0.400 . 1 . . . . 161 GLU C . 16538 1 106 . 1 1 10 10 GLU CA C 13 60.035 0.400 . 1 . . . . 161 GLU CA . 16538 1 107 . 1 1 10 10 GLU CB C 13 29.559 0.400 . 1 . . . . 161 GLU CB . 16538 1 108 . 1 1 10 10 GLU CG C 13 36.515 0.400 . 1 . . . . 161 GLU CG . 16538 1 109 . 1 1 10 10 GLU N N 15 121.446 0.400 . 1 . . . . 161 GLU N . 16538 1 110 . 1 1 11 11 THR H H 1 8.250 0.020 . 1 . . . . 162 THR H . 16538 1 111 . 1 1 11 11 THR HA H 1 4.192 0.020 . 1 . . . . 162 THR HA . 16538 1 112 . 1 1 11 11 THR HB H 1 4.252 0.020 . 1 . . . . 162 THR HB . 16538 1 113 . 1 1 11 11 THR HG21 H 1 1.251 0.020 . 1 . . . . 162 THR HG2 . 16538 1 114 . 1 1 11 11 THR HG22 H 1 1.251 0.020 . 1 . . . . 162 THR HG2 . 16538 1 115 . 1 1 11 11 THR HG23 H 1 1.251 0.020 . 1 . . . . 162 THR HG2 . 16538 1 116 . 1 1 11 11 THR C C 13 175.806 0.400 . 1 . . . . 162 THR C . 16538 1 117 . 1 1 11 11 THR CA C 13 64.868 0.400 . 1 . . . . 162 THR CA . 16538 1 118 . 1 1 11 11 THR CB C 13 68.885 0.400 . 1 . . . . 162 THR CB . 16538 1 119 . 1 1 11 11 THR CG2 C 13 21.825 0.400 . 1 . . . . 162 THR CG2 . 16538 1 120 . 1 1 11 11 THR N N 15 113.980 0.400 . 1 . . . . 162 THR N . 16538 1 121 . 1 1 12 12 ALA H H 1 8.172 0.020 . 1 . . . . 163 ALA H . 16538 1 122 . 1 1 12 12 ALA HA H 1 4.313 0.020 . 1 . . . . 163 ALA HA . 16538 1 123 . 1 1 12 12 ALA HB1 H 1 1.462 0.020 . 1 . . . . 163 ALA HB . 16538 1 124 . 1 1 12 12 ALA HB2 H 1 1.462 0.020 . 1 . . . . 163 ALA HB . 16538 1 125 . 1 1 12 12 ALA HB3 H 1 1.462 0.020 . 1 . . . . 163 ALA HB . 16538 1 126 . 1 1 12 12 ALA C C 13 179.740 0.400 . 1 . . . . 163 ALA C . 16538 1 127 . 1 1 12 12 ALA CA C 13 53.703 0.400 . 1 . . . . 163 ALA CA . 16538 1 128 . 1 1 12 12 ALA CB C 13 19.333 0.400 . 1 . . . . 163 ALA CB . 16538 1 129 . 1 1 12 12 ALA N N 15 124.467 0.400 . 1 . . . . 163 ALA N . 16538 1 130 . 1 1 13 13 PHE H H 1 8.432 0.020 . 1 . . . . 164 PHE H . 16538 1 131 . 1 1 13 13 PHE HA H 1 3.956 0.020 . 1 . . . . 164 PHE HA . 16538 1 132 . 1 1 13 13 PHE HB2 H 1 3.230 0.020 . 2 . . . . 164 PHE HB2 . 16538 1 133 . 1 1 13 13 PHE HB3 H 1 3.148 0.020 . 2 . . . . 164 PHE HB3 . 16538 1 134 . 1 1 13 13 PHE HD1 H 1 7.133 0.020 . 1 . . . . 164 PHE HD1 . 16538 1 135 . 1 1 13 13 PHE HD2 H 1 7.133 0.020 . 1 . . . . 164 PHE HD2 . 16538 1 136 . 1 1 13 13 PHE HE1 H 1 7.071 0.020 . 1 . . . . 164 PHE HE1 . 16538 1 137 . 1 1 13 13 PHE HE2 H 1 7.071 0.020 . 1 . . . . 164 PHE HE2 . 16538 1 138 . 1 1 13 13 PHE HZ H 1 6.780 0.020 . 1 . . . . 164 PHE HZ . 16538 1 139 . 1 1 13 13 PHE C C 13 176.224 0.400 . 1 . . . . 164 PHE C . 16538 1 140 . 1 1 13 13 PHE CA C 13 62.359 0.400 . 1 . . . . 164 PHE CA . 16538 1 141 . 1 1 13 13 PHE CB C 13 39.371 0.400 . 1 . . . . 164 PHE CB . 16538 1 142 . 1 1 13 13 PHE N N 15 121.438 0.400 . 1 . . . . 164 PHE N . 16538 1 143 . 1 1 14 14 GLU H H 1 8.584 0.020 . 1 . . . . 165 GLU H . 16538 1 144 . 1 1 14 14 GLU HA H 1 3.628 0.020 . 1 . . . . 165 GLU HA . 16538 1 145 . 1 1 14 14 GLU HB2 H 1 2.205 0.020 . 2 . . . . 165 GLU HB2 . 16538 1 146 . 1 1 14 14 GLU HB3 H 1 2.064 0.020 . 2 . . . . 165 GLU HB3 . 16538 1 147 . 1 1 14 14 GLU HG2 H 1 2.381 0.020 . 2 . . . . 165 GLU HG2 . 16538 1 148 . 1 1 14 14 GLU HG3 H 1 2.186 0.020 . 2 . . . . 165 GLU HG3 . 16538 1 149 . 1 1 14 14 GLU C C 13 179.919 0.400 . 1 . . . . 165 GLU C . 16538 1 150 . 1 1 14 14 GLU CA C 13 60.585 0.400 . 1 . . . . 165 GLU CA . 16538 1 151 . 1 1 14 14 GLU CB C 13 29.163 0.400 . 1 . . . . 165 GLU CB . 16538 1 152 . 1 1 14 14 GLU CG C 13 36.900 0.400 . 1 . . . . 165 GLU CG . 16538 1 153 . 1 1 14 14 GLU N N 15 120.248 0.400 . 1 . . . . 165 GLU N . 16538 1 154 . 1 1 15 15 LYS H H 1 8.425 0.020 . 1 . . . . 166 LYS H . 16538 1 155 . 1 1 15 15 LYS HA H 1 4.027 0.020 . 1 . . . . 166 LYS HA . 16538 1 156 . 1 1 15 15 LYS HB2 H 1 1.870 0.020 . 2 . . . . 166 LYS HB2 . 16538 1 157 . 1 1 15 15 LYS HB3 H 1 1.793 0.020 . 2 . . . . 166 LYS HB3 . 16538 1 158 . 1 1 15 15 LYS HD2 H 1 1.624 0.020 . 2 . . . . 166 LYS HD2 . 16538 1 159 . 1 1 15 15 LYS HD3 H 1 1.625 0.020 . 2 . . . . 166 LYS HD3 . 16538 1 160 . 1 1 15 15 LYS HE2 H 1 2.915 0.020 . 2 . . . . 166 LYS HE2 . 16538 1 161 . 1 1 15 15 LYS HE3 H 1 2.913 0.020 . 2 . . . . 166 LYS HE3 . 16538 1 162 . 1 1 15 15 LYS HG2 H 1 1.507 0.020 . 2 . . . . 166 LYS HG2 . 16538 1 163 . 1 1 15 15 LYS HG3 H 1 1.445 0.020 . 2 . . . . 166 LYS HG3 . 16538 1 164 . 1 1 15 15 LYS C C 13 178.016 0.400 . 1 . . . . 166 LYS C . 16538 1 165 . 1 1 15 15 LYS CA C 13 58.797 0.400 . 1 . . . . 166 LYS CA . 16538 1 166 . 1 1 15 15 LYS CB C 13 32.227 0.400 . 1 . . . . 166 LYS CB . 16538 1 167 . 1 1 15 15 LYS CD C 13 28.985 0.400 . 1 . . . . 166 LYS CD . 16538 1 168 . 1 1 15 15 LYS CE C 13 41.811 0.400 . 1 . . . . 166 LYS CE . 16538 1 169 . 1 1 15 15 LYS CG C 13 24.866 0.400 . 1 . . . . 166 LYS CG . 16538 1 170 . 1 1 15 15 LYS N N 15 119.887 0.400 . 1 . . . . 166 LYS N . 16538 1 171 . 1 1 16 16 THR H H 1 7.776 0.020 . 1 . . . . 167 THR H . 16538 1 172 . 1 1 16 16 THR HA H 1 3.953 0.020 . 1 . . . . 167 THR HA . 16538 1 173 . 1 1 16 16 THR HB H 1 3.943 0.020 . 1 . . . . 167 THR HB . 16538 1 174 . 1 1 16 16 THR HG21 H 1 1.086 0.020 . 1 . . . . 167 THR HG2 . 16538 1 175 . 1 1 16 16 THR HG22 H 1 1.086 0.020 . 1 . . . . 167 THR HG2 . 16538 1 176 . 1 1 16 16 THR HG23 H 1 1.086 0.020 . 1 . . . . 167 THR HG2 . 16538 1 177 . 1 1 16 16 THR C C 13 175.579 0.400 . 1 . . . . 167 THR C . 16538 1 178 . 1 1 16 16 THR CA C 13 65.437 0.400 . 1 . . . . 167 THR CA . 16538 1 179 . 1 1 16 16 THR CB C 13 68.709 0.400 . 1 . . . . 167 THR CB . 16538 1 180 . 1 1 16 16 THR CG2 C 13 21.315 0.400 . 1 . . . . 167 THR CG2 . 16538 1 181 . 1 1 16 16 THR N N 15 114.203 0.400 . 1 . . . . 167 THR N . 16538 1 182 . 1 1 17 17 LEU H H 1 8.057 0.020 . 1 . . . . 168 LEU H . 16538 1 183 . 1 1 17 17 LEU HA H 1 3.940 0.020 . 1 . . . . 168 LEU HA . 16538 1 184 . 1 1 17 17 LEU HB2 H 1 1.203 0.020 . 2 . . . . 168 LEU HB2 . 16538 1 185 . 1 1 17 17 LEU HB3 H 1 1.046 0.020 . 2 . . . . 168 LEU HB3 . 16538 1 186 . 1 1 17 17 LEU HD11 H 1 0.422 0.020 . 2 . . . . 168 LEU HD1 . 16538 1 187 . 1 1 17 17 LEU HD12 H 1 0.422 0.020 . 2 . . . . 168 LEU HD1 . 16538 1 188 . 1 1 17 17 LEU HD13 H 1 0.422 0.020 . 2 . . . . 168 LEU HD1 . 16538 1 189 . 1 1 17 17 LEU HD21 H 1 0.359 0.020 . 2 . . . . 168 LEU HD2 . 16538 1 190 . 1 1 17 17 LEU HD22 H 1 0.359 0.020 . 2 . . . . 168 LEU HD2 . 16538 1 191 . 1 1 17 17 LEU HD23 H 1 0.359 0.020 . 2 . . . . 168 LEU HD2 . 16538 1 192 . 1 1 17 17 LEU HG H 1 1.231 0.020 . 1 . . . . 168 LEU HG . 16538 1 193 . 1 1 17 17 LEU C C 13 178.249 0.400 . 1 . . . . 168 LEU C . 16538 1 194 . 1 1 17 17 LEU CA C 13 55.350 0.400 . 1 . . . . 168 LEU CA . 16538 1 195 . 1 1 17 17 LEU CB C 13 41.286 0.400 . 1 . . . . 168 LEU CB . 16538 1 196 . 1 1 17 17 LEU CD1 C 13 24.619 0.400 . 1 . . . . 168 LEU CD1 . 16538 1 197 . 1 1 17 17 LEU CD2 C 13 23.935 0.400 . 1 . . . . 168 LEU CD2 . 16538 1 198 . 1 1 17 17 LEU CG C 13 28.611 0.400 . 1 . . . . 168 LEU CG . 16538 1 199 . 1 1 17 17 LEU N N 15 120.428 0.400 . 1 . . . . 168 LEU N . 16538 1 200 . 1 1 18 18 THR H H 1 7.883 0.020 . 1 . . . . 169 THR H . 16538 1 201 . 1 1 18 18 THR HA H 1 3.727 0.020 . 1 . . . . 169 THR HA . 16538 1 202 . 1 1 18 18 THR HB H 1 4.351 0.020 . 1 . . . . 169 THR HB . 16538 1 203 . 1 1 18 18 THR HG21 H 1 1.093 0.020 . 1 . . . . 169 THR HG2 . 16538 1 204 . 1 1 18 18 THR HG22 H 1 1.093 0.020 . 1 . . . . 169 THR HG2 . 16538 1 205 . 1 1 18 18 THR HG23 H 1 1.093 0.020 . 1 . . . . 169 THR HG2 . 16538 1 206 . 1 1 18 18 THR CA C 13 70.580 0.400 . 1 . . . . 169 THR CA . 16538 1 207 . 1 1 18 18 THR CB C 13 66.511 0.400 . 1 . . . . 169 THR CB . 16538 1 208 . 1 1 18 18 THR CG2 C 13 20.929 0.400 . 1 . . . . 169 THR CG2 . 16538 1 209 . 1 1 18 18 THR N N 15 116.189 0.400 . 1 . . . . 169 THR N . 16538 1 210 . 1 1 19 19 PRO HA H 1 4.358 0.020 . 1 . . . . 170 PRO HA . 16538 1 211 . 1 1 19 19 PRO HB2 H 1 2.270 0.020 . 2 . . . . 170 PRO HB2 . 16538 1 212 . 1 1 19 19 PRO HB3 H 1 1.781 0.020 . 2 . . . . 170 PRO HB3 . 16538 1 213 . 1 1 19 19 PRO HD2 H 1 3.534 0.020 . 2 . . . . 170 PRO HD2 . 16538 1 214 . 1 1 19 19 PRO HD3 H 1 3.362 0.020 . 2 . . . . 170 PRO HD3 . 16538 1 215 . 1 1 19 19 PRO HG2 H 1 1.986 0.020 . 2 . . . . 170 PRO HG2 . 16538 1 216 . 1 1 19 19 PRO HG3 H 1 1.930 0.020 . 2 . . . . 170 PRO HG3 . 16538 1 217 . 1 1 19 19 PRO C C 13 178.692 0.400 . 1 . . . . 170 PRO C . 16538 1 218 . 1 1 19 19 PRO CA C 13 65.677 0.400 . 1 . . . . 170 PRO CA . 16538 1 219 . 1 1 19 19 PRO CB C 13 31.008 0.400 . 1 . . . . 170 PRO CB . 16538 1 220 . 1 1 19 19 PRO CD C 13 50.425 0.400 . 1 . . . . 170 PRO CD . 16538 1 221 . 1 1 19 19 PRO CG C 13 28.265 0.400 . 1 . . . . 170 PRO CG . 16538 1 222 . 1 1 20 20 ILE H H 1 6.360 0.020 . 1 . . . . 171 ILE H . 16538 1 223 . 1 1 20 20 ILE HA H 1 3.650 0.020 . 1 . . . . 171 ILE HA . 16538 1 224 . 1 1 20 20 ILE HB H 1 1.901 0.020 . 1 . . . . 171 ILE HB . 16538 1 225 . 1 1 20 20 ILE HD11 H 1 0.785 0.020 . 1 . . . . 171 ILE HD1 . 16538 1 226 . 1 1 20 20 ILE HD12 H 1 0.785 0.020 . 1 . . . . 171 ILE HD1 . 16538 1 227 . 1 1 20 20 ILE HD13 H 1 0.785 0.020 . 1 . . . . 171 ILE HD1 . 16538 1 228 . 1 1 20 20 ILE HG12 H 1 1.754 0.020 . 2 . . . . 171 ILE HG12 . 16538 1 229 . 1 1 20 20 ILE HG13 H 1 1.150 0.020 . 2 . . . . 171 ILE HG13 . 16538 1 230 . 1 1 20 20 ILE HG21 H 1 0.800 0.020 . 1 . . . . 171 ILE HG2 . 16538 1 231 . 1 1 20 20 ILE HG22 H 1 0.800 0.020 . 1 . . . . 171 ILE HG2 . 16538 1 232 . 1 1 20 20 ILE HG23 H 1 0.800 0.020 . 1 . . . . 171 ILE HG2 . 16538 1 233 . 1 1 20 20 ILE C C 13 178.507 0.400 . 1 . . . . 171 ILE C . 16538 1 234 . 1 1 20 20 ILE CA C 13 64.606 0.400 . 1 . . . . 171 ILE CA . 16538 1 235 . 1 1 20 20 ILE CB C 13 38.412 0.400 . 1 . . . . 171 ILE CB . 16538 1 236 . 1 1 20 20 ILE CD1 C 13 14.034 0.400 . 1 . . . . 171 ILE CD1 . 16538 1 237 . 1 1 20 20 ILE CG1 C 13 28.601 0.400 . 1 . . . . 171 ILE CG1 . 16538 1 238 . 1 1 20 20 ILE CG2 C 13 16.955 0.400 . 1 . . . . 171 ILE CG2 . 16538 1 239 . 1 1 20 20 ILE N N 15 116.455 0.400 . 1 . . . . 171 ILE N . 16538 1 240 . 1 1 21 21 ILE H H 1 7.655 0.020 . 1 . . . . 172 ILE H . 16538 1 241 . 1 1 21 21 ILE HA H 1 3.281 0.020 . 1 . . . . 172 ILE HA . 16538 1 242 . 1 1 21 21 ILE HB H 1 1.591 0.020 . 1 . . . . 172 ILE HB . 16538 1 243 . 1 1 21 21 ILE HD11 H 1 0.418 0.020 . 1 . . . . 172 ILE HD1 . 16538 1 244 . 1 1 21 21 ILE HD12 H 1 0.418 0.020 . 1 . . . . 172 ILE HD1 . 16538 1 245 . 1 1 21 21 ILE HD13 H 1 0.418 0.020 . 1 . . . . 172 ILE HD1 . 16538 1 246 . 1 1 21 21 ILE HG12 H 1 1.201 0.020 . 2 . . . . 172 ILE HG12 . 16538 1 247 . 1 1 21 21 ILE HG13 H 1 0.951 0.020 . 2 . . . . 172 ILE HG13 . 16538 1 248 . 1 1 21 21 ILE HG21 H 1 0.292 0.020 . 1 . . . . 172 ILE HG2 . 16538 1 249 . 1 1 21 21 ILE HG22 H 1 0.292 0.020 . 1 . . . . 172 ILE HG2 . 16538 1 250 . 1 1 21 21 ILE HG23 H 1 0.292 0.020 . 1 . . . . 172 ILE HG2 . 16538 1 251 . 1 1 21 21 ILE C C 13 176.380 0.400 . 1 . . . . 172 ILE C . 16538 1 252 . 1 1 21 21 ILE CA C 13 63.258 0.400 . 1 . . . . 172 ILE CA . 16538 1 253 . 1 1 21 21 ILE CB C 13 35.906 0.400 . 1 . . . . 172 ILE CB . 16538 1 254 . 1 1 21 21 ILE CD1 C 13 10.679 0.400 . 1 . . . . 172 ILE CD1 . 16538 1 255 . 1 1 21 21 ILE CG1 C 13 28.047 0.400 . 1 . . . . 172 ILE CG1 . 16538 1 256 . 1 1 21 21 ILE CG2 C 13 18.507 0.400 . 1 . . . . 172 ILE CG2 . 16538 1 257 . 1 1 21 21 ILE N N 15 119.792 0.400 . 1 . . . . 172 ILE N . 16538 1 258 . 1 1 22 22 GLN H H 1 8.373 0.020 . 1 . . . . 173 GLN H . 16538 1 259 . 1 1 22 22 GLN HA H 1 3.688 0.020 . 1 . . . . 173 GLN HA . 16538 1 260 . 1 1 22 22 GLN HB2 H 1 2.047 0.020 . 2 . . . . 173 GLN HB2 . 16538 1 261 . 1 1 22 22 GLN HB3 H 1 1.882 0.020 . 2 . . . . 173 GLN HB3 . 16538 1 262 . 1 1 22 22 GLN HG2 H 1 2.415 0.020 . 2 . . . . 173 GLN HG2 . 16538 1 263 . 1 1 22 22 GLN HG3 H 1 2.241 0.020 . 2 . . . . 173 GLN HG3 . 16538 1 264 . 1 1 22 22 GLN C C 13 179.781 0.400 . 1 . . . . 173 GLN C . 16538 1 265 . 1 1 22 22 GLN CA C 13 59.473 0.400 . 1 . . . . 173 GLN CA . 16538 1 266 . 1 1 22 22 GLN CB C 13 28.012 0.400 . 1 . . . . 173 GLN CB . 16538 1 267 . 1 1 22 22 GLN CG C 13 34.402 0.400 . 1 . . . . 173 GLN CG . 16538 1 268 . 1 1 22 22 GLN N N 15 116.480 0.400 . 1 . . . . 173 GLN N . 16538 1 269 . 1 1 23 23 GLU H H 1 8.108 0.020 . 1 . . . . 174 GLU H . 16538 1 270 . 1 1 23 23 GLU HA H 1 3.975 0.020 . 1 . . . . 174 GLU HA . 16538 1 271 . 1 1 23 23 GLU HB2 H 1 2.081 0.020 . 2 . . . . 174 GLU HB2 . 16538 1 272 . 1 1 23 23 GLU HB3 H 1 2.047 0.020 . 2 . . . . 174 GLU HB3 . 16538 1 273 . 1 1 23 23 GLU HG2 H 1 2.462 0.020 . 2 . . . . 174 GLU HG2 . 16538 1 274 . 1 1 23 23 GLU HG3 H 1 2.291 0.020 . 2 . . . . 174 GLU HG3 . 16538 1 275 . 1 1 23 23 GLU C C 13 178.756 0.400 . 1 . . . . 174 GLU C . 16538 1 276 . 1 1 23 23 GLU CA C 13 59.308 0.400 . 1 . . . . 174 GLU CA . 16538 1 277 . 1 1 23 23 GLU CB C 13 28.665 0.400 . 1 . . . . 174 GLU CB . 16538 1 278 . 1 1 23 23 GLU CG C 13 36.915 0.400 . 1 . . . . 174 GLU CG . 16538 1 279 . 1 1 23 23 GLU N N 15 118.411 0.400 . 1 . . . . 174 GLU N . 16538 1 280 . 1 1 24 24 TYR H H 1 7.414 0.020 . 1 . . . . 175 TYR H . 16538 1 281 . 1 1 24 24 TYR HA H 1 2.901 0.020 . 1 . . . . 175 TYR HA . 16538 1 282 . 1 1 24 24 TYR HB2 H 1 3.125 0.020 . 2 . . . . 175 TYR HB2 . 16538 1 283 . 1 1 24 24 TYR HB3 H 1 2.780 0.020 . 2 . . . . 175 TYR HB3 . 16538 1 284 . 1 1 24 24 TYR HD1 H 1 6.764 0.020 . 1 . . . . 175 TYR HD1 . 16538 1 285 . 1 1 24 24 TYR HD2 H 1 6.764 0.020 . 1 . . . . 175 TYR HD2 . 16538 1 286 . 1 1 24 24 TYR HE1 H 1 6.394 0.020 . 1 . . . . 175 TYR HE1 . 16538 1 287 . 1 1 24 24 TYR HE2 H 1 6.394 0.020 . 1 . . . . 175 TYR HE2 . 16538 1 288 . 1 1 24 24 TYR C C 13 176.585 0.400 . 1 . . . . 175 TYR C . 16538 1 289 . 1 1 24 24 TYR CA C 13 59.353 0.400 . 1 . . . . 175 TYR CA . 16538 1 290 . 1 1 24 24 TYR CB C 13 36.642 0.400 . 1 . . . . 175 TYR CB . 16538 1 291 . 1 1 24 24 TYR N N 15 122.223 0.400 . 1 . . . . 175 TYR N . 16538 1 292 . 1 1 25 25 PHE H H 1 7.469 0.020 . 1 . . . . 176 PHE H . 16538 1 293 . 1 1 25 25 PHE HA H 1 4.161 0.020 . 1 . . . . 176 PHE HA . 16538 1 294 . 1 1 25 25 PHE HB2 H 1 2.928 0.020 . 2 . . . . 176 PHE HB2 . 16538 1 295 . 1 1 25 25 PHE HB3 H 1 2.554 0.020 . 2 . . . . 176 PHE HB3 . 16538 1 296 . 1 1 25 25 PHE HD1 H 1 6.900 0.020 . 1 . . . . 176 PHE HD1 . 16538 1 297 . 1 1 25 25 PHE HD2 H 1 6.900 0.020 . 1 . . . . 176 PHE HD2 . 16538 1 298 . 1 1 25 25 PHE HE1 H 1 7.161 0.020 . 1 . . . . 176 PHE HE1 . 16538 1 299 . 1 1 25 25 PHE HE2 H 1 7.161 0.020 . 1 . . . . 176 PHE HE2 . 16538 1 300 . 1 1 25 25 PHE HZ H 1 7.074 0.020 . 1 . . . . 176 PHE HZ . 16538 1 301 . 1 1 25 25 PHE C C 13 176.514 0.400 . 1 . . . . 176 PHE C . 16538 1 302 . 1 1 25 25 PHE CA C 13 56.829 0.400 . 1 . . . . 176 PHE CA . 16538 1 303 . 1 1 25 25 PHE CB C 13 36.002 0.400 . 1 . . . . 176 PHE CB . 16538 1 304 . 1 1 25 25 PHE N N 15 116.978 0.400 . 1 . . . . 176 PHE N . 16538 1 305 . 1 1 26 26 GLU H H 1 7.192 0.020 . 1 . . . . 177 GLU H . 16538 1 306 . 1 1 26 26 GLU HA H 1 4.291 0.020 . 1 . . . . 177 GLU HA . 16538 1 307 . 1 1 26 26 GLU HB2 H 1 2.056 0.020 . 2 . . . . 177 GLU HB2 . 16538 1 308 . 1 1 26 26 GLU HB3 H 1 2.061 0.020 . 2 . . . . 177 GLU HB3 . 16538 1 309 . 1 1 26 26 GLU HG2 H 1 2.287 0.020 . 2 . . . . 177 GLU HG2 . 16538 1 310 . 1 1 26 26 GLU HG3 H 1 2.169 0.020 . 2 . . . . 177 GLU HG3 . 16538 1 311 . 1 1 26 26 GLU C C 13 177.510 0.400 . 1 . . . . 177 GLU C . 16538 1 312 . 1 1 26 26 GLU CA C 13 57.286 0.400 . 1 . . . . 177 GLU CA . 16538 1 313 . 1 1 26 26 GLU CB C 13 30.079 0.400 . 1 . . . . 177 GLU CB . 16538 1 314 . 1 1 26 26 GLU CG C 13 35.632 0.400 . 1 . . . . 177 GLU CG . 16538 1 315 . 1 1 26 26 GLU N N 15 114.926 0.400 . 1 . . . . 177 GLU N . 16538 1 316 . 1 1 27 27 HIS H H 1 8.009 0.020 . 1 . . . . 178 HIS H . 16538 1 317 . 1 1 27 27 HIS HA H 1 4.673 0.020 . 1 . . . . 178 HIS HA . 16538 1 318 . 1 1 27 27 HIS HB2 H 1 3.256 0.020 . 2 . . . . 178 HIS HB2 . 16538 1 319 . 1 1 27 27 HIS HB3 H 1 3.104 0.020 . 2 . . . . 178 HIS HB3 . 16538 1 320 . 1 1 27 27 HIS HD2 H 1 7.059 0.020 . 1 . . . . 178 HIS HD2 . 16538 1 321 . 1 1 27 27 HIS HE1 H 1 8.288 0.020 . 1 . . . . 178 HIS HE1 . 16538 1 322 . 1 1 27 27 HIS C C 13 178.078 0.400 . 1 . . . . 178 HIS C . 16538 1 323 . 1 1 27 27 HIS CA C 13 57.240 0.400 . 1 . . . . 178 HIS CA . 16538 1 324 . 1 1 27 27 HIS CB C 13 31.286 0.400 . 1 . . . . 178 HIS CB . 16538 1 325 . 1 1 27 27 HIS N N 15 115.960 0.400 . 1 . . . . 178 HIS N . 16538 1 326 . 1 1 28 28 GLY H H 1 9.136 0.020 . 1 . . . . 179 GLY H . 16538 1 327 . 1 1 28 28 GLY HA2 H 1 3.852 0.020 . 2 . . . . 179 GLY HA2 . 16538 1 328 . 1 1 28 28 GLY HA3 H 1 3.177 0.020 . 2 . . . . 179 GLY HA3 . 16538 1 329 . 1 1 28 28 GLY CA C 13 47.067 0.400 . 1 . . . . 179 GLY CA . 16538 1 330 . 1 1 28 28 GLY N N 15 110.700 0.400 . 1 . . . . 179 GLY N . 16538 1 331 . 1 1 29 29 ASP HA H 1 5.111 0.020 . 1 . . . . 180 ASP HA . 16538 1 332 . 1 1 29 29 ASP HB2 H 1 3.298 0.020 . 2 . . . . 180 ASP HB2 . 16538 1 333 . 1 1 29 29 ASP HB3 H 1 2.492 0.020 . 2 . . . . 180 ASP HB3 . 16538 1 334 . 1 1 29 29 ASP C C 13 177.656 0.400 . 1 . . . . 180 ASP C . 16538 1 335 . 1 1 29 29 ASP CA C 13 53.448 0.400 . 1 . . . . 180 ASP CA . 16538 1 336 . 1 1 29 29 ASP CB C 13 41.502 0.400 . 1 . . . . 180 ASP CB . 16538 1 337 . 1 1 30 30 THR H H 1 9.094 0.020 . 1 . . . . 181 THR H . 16538 1 338 . 1 1 30 30 THR HA H 1 3.692 0.020 . 1 . . . . 181 THR HA . 16538 1 339 . 1 1 30 30 THR HB H 1 4.148 0.020 . 1 . . . . 181 THR HB . 16538 1 340 . 1 1 30 30 THR HG21 H 1 1.406 0.020 . 1 . . . . 181 THR HG2 . 16538 1 341 . 1 1 30 30 THR HG22 H 1 1.406 0.020 . 1 . . . . 181 THR HG2 . 16538 1 342 . 1 1 30 30 THR HG23 H 1 1.406 0.020 . 1 . . . . 181 THR HG2 . 16538 1 343 . 1 1 30 30 THR C C 13 176.695 0.400 . 1 . . . . 181 THR C . 16538 1 344 . 1 1 30 30 THR CA C 13 64.547 0.400 . 1 . . . . 181 THR CA . 16538 1 345 . 1 1 30 30 THR CB C 13 68.268 0.400 . 1 . . . . 181 THR CB . 16538 1 346 . 1 1 30 30 THR CG2 C 13 23.654 0.400 . 1 . . . . 181 THR CG2 . 16538 1 347 . 1 1 30 30 THR N N 15 118.073 0.400 . 1 . . . . 181 THR N . 16538 1 348 . 1 1 31 31 ASN H H 1 8.338 0.020 . 1 . . . . 182 ASN H . 16538 1 349 . 1 1 31 31 ASN HA H 1 4.408 0.020 . 1 . . . . 182 ASN HA . 16538 1 350 . 1 1 31 31 ASN HB2 H 1 2.914 0.020 . 2 . . . . 182 ASN HB2 . 16538 1 351 . 1 1 31 31 ASN HB3 H 1 2.913 0.020 . 2 . . . . 182 ASN HB3 . 16538 1 352 . 1 1 31 31 ASN C C 13 177.235 0.400 . 1 . . . . 182 ASN C . 16538 1 353 . 1 1 31 31 ASN CA C 13 56.673 0.400 . 1 . . . . 182 ASN CA . 16538 1 354 . 1 1 31 31 ASN CB C 13 38.575 0.400 . 1 . . . . 182 ASN CB . 16538 1 355 . 1 1 31 31 ASN N N 15 122.009 0.400 . 1 . . . . 182 ASN N . 16538 1 356 . 1 1 32 32 GLU H H 1 7.562 0.020 . 1 . . . . 183 GLU H . 16538 1 357 . 1 1 32 32 GLU HA H 1 3.976 0.020 . 1 . . . . 183 GLU HA . 16538 1 358 . 1 1 32 32 GLU HB2 H 1 1.988 0.020 . 2 . . . . 183 GLU HB2 . 16538 1 359 . 1 1 32 32 GLU HB3 H 1 1.946 0.020 . 2 . . . . 183 GLU HB3 . 16538 1 360 . 1 1 32 32 GLU HG2 H 1 2.147 0.020 . 2 . . . . 183 GLU HG2 . 16538 1 361 . 1 1 32 32 GLU HG3 H 1 2.075 0.020 . 2 . . . . 183 GLU HG3 . 16538 1 362 . 1 1 32 32 GLU C C 13 178.910 0.400 . 1 . . . . 183 GLU C . 16538 1 363 . 1 1 32 32 GLU CA C 13 58.874 0.400 . 1 . . . . 183 GLU CA . 16538 1 364 . 1 1 32 32 GLU CB C 13 29.324 0.400 . 1 . . . . 183 GLU CB . 16538 1 365 . 1 1 32 32 GLU CG C 13 35.115 0.400 . 1 . . . . 183 GLU CG . 16538 1 366 . 1 1 32 32 GLU N N 15 119.967 0.400 . 1 . . . . 183 GLU N . 16538 1 367 . 1 1 33 33 VAL H H 1 6.872 0.020 . 1 . . . . 184 VAL H . 16538 1 368 . 1 1 33 33 VAL HA H 1 3.424 0.020 . 1 . . . . 184 VAL HA . 16538 1 369 . 1 1 33 33 VAL HB H 1 1.865 0.020 . 1 . . . . 184 VAL HB . 16538 1 370 . 1 1 33 33 VAL HG11 H 1 0.891 0.020 . 2 . . . . 184 VAL HG1 . 16538 1 371 . 1 1 33 33 VAL HG12 H 1 0.891 0.020 . 2 . . . . 184 VAL HG1 . 16538 1 372 . 1 1 33 33 VAL HG13 H 1 0.891 0.020 . 2 . . . . 184 VAL HG1 . 16538 1 373 . 1 1 33 33 VAL HG21 H 1 0.580 0.020 . 2 . . . . 184 VAL HG2 . 16538 1 374 . 1 1 33 33 VAL HG22 H 1 0.580 0.020 . 2 . . . . 184 VAL HG2 . 16538 1 375 . 1 1 33 33 VAL HG23 H 1 0.580 0.020 . 2 . . . . 184 VAL HG2 . 16538 1 376 . 1 1 33 33 VAL C C 13 177.084 0.400 . 1 . . . . 184 VAL C . 16538 1 377 . 1 1 33 33 VAL CA C 13 66.192 0.400 . 1 . . . . 184 VAL CA . 16538 1 378 . 1 1 33 33 VAL CB C 13 31.008 0.400 . 1 . . . . 184 VAL CB . 16538 1 379 . 1 1 33 33 VAL CG1 C 13 23.129 0.400 . 1 . . . . 184 VAL CG1 . 16538 1 380 . 1 1 33 33 VAL CG2 C 13 21.471 0.400 . 1 . . . . 184 VAL CG2 . 16538 1 381 . 1 1 33 33 VAL N N 15 116.258 0.400 . 1 . . . . 184 VAL N . 16538 1 382 . 1 1 34 34 ALA H H 1 8.107 0.020 . 1 . . . . 185 ALA H . 16538 1 383 . 1 1 34 34 ALA HA H 1 3.644 0.020 . 1 . . . . 185 ALA HA . 16538 1 384 . 1 1 34 34 ALA HB1 H 1 1.440 0.020 . 1 . . . . 185 ALA HB . 16538 1 385 . 1 1 34 34 ALA HB2 H 1 1.440 0.020 . 1 . . . . 185 ALA HB . 16538 1 386 . 1 1 34 34 ALA HB3 H 1 1.440 0.020 . 1 . . . . 185 ALA HB . 16538 1 387 . 1 1 34 34 ALA C C 13 179.268 0.400 . 1 . . . . 185 ALA C . 16538 1 388 . 1 1 34 34 ALA CA C 13 56.350 0.400 . 1 . . . . 185 ALA CA . 16538 1 389 . 1 1 34 34 ALA CB C 13 18.017 0.400 . 1 . . . . 185 ALA CB . 16538 1 390 . 1 1 34 34 ALA N N 15 121.546 0.400 . 1 . . . . 185 ALA N . 16538 1 391 . 1 1 35 35 GLU H H 1 8.103 0.020 . 1 . . . . 186 GLU H . 16538 1 392 . 1 1 35 35 GLU HA H 1 3.862 0.020 . 1 . . . . 186 GLU HA . 16538 1 393 . 1 1 35 35 GLU HB2 H 1 2.001 0.020 . 2 . . . . 186 GLU HB2 . 16538 1 394 . 1 1 35 35 GLU HB3 H 1 2.002 0.020 . 2 . . . . 186 GLU HB3 . 16538 1 395 . 1 1 35 35 GLU HG2 H 1 2.338 0.020 . 2 . . . . 186 GLU HG2 . 16538 1 396 . 1 1 35 35 GLU HG3 H 1 2.210 0.020 . 2 . . . . 186 GLU HG3 . 16538 1 397 . 1 1 35 35 GLU C C 13 178.934 0.400 . 1 . . . . 186 GLU C . 16538 1 398 . 1 1 35 35 GLU CA C 13 59.399 0.400 . 1 . . . . 186 GLU CA . 16538 1 399 . 1 1 35 35 GLU CB C 13 29.337 0.400 . 1 . . . . 186 GLU CB . 16538 1 400 . 1 1 35 35 GLU CG C 13 36.258 0.400 . 1 . . . . 186 GLU CG . 16538 1 401 . 1 1 35 35 GLU N N 15 115.882 0.400 . 1 . . . . 186 GLU N . 16538 1 402 . 1 1 36 36 MET H H 1 7.602 0.020 . 1 . . . . 187 MET H . 16538 1 403 . 1 1 36 36 MET HA H 1 4.229 0.020 . 1 . . . . 187 MET HA . 16538 1 404 . 1 1 36 36 MET HB2 H 1 2.201 0.020 . 2 . . . . 187 MET HB2 . 16538 1 405 . 1 1 36 36 MET HB3 H 1 1.924 0.020 . 2 . . . . 187 MET HB3 . 16538 1 406 . 1 1 36 36 MET HE1 H 1 2.050 0.020 . 1 . . . . 187 MET HE . 16538 1 407 . 1 1 36 36 MET HE2 H 1 2.050 0.020 . 1 . . . . 187 MET HE . 16538 1 408 . 1 1 36 36 MET HE3 H 1 2.050 0.020 . 1 . . . . 187 MET HE . 16538 1 409 . 1 1 36 36 MET HG2 H 1 2.762 0.020 . 2 . . . . 187 MET HG2 . 16538 1 410 . 1 1 36 36 MET HG3 H 1 2.596 0.020 . 2 . . . . 187 MET HG3 . 16538 1 411 . 1 1 36 36 MET C C 13 179.198 0.400 . 1 . . . . 187 MET C . 16538 1 412 . 1 1 36 36 MET CA C 13 58.312 0.400 . 1 . . . . 187 MET CA . 16538 1 413 . 1 1 36 36 MET CB C 13 32.641 0.400 . 1 . . . . 187 MET CB . 16538 1 414 . 1 1 36 36 MET CE C 13 17.614 0.400 . 1 . . . . 187 MET CE . 16538 1 415 . 1 1 36 36 MET CG C 13 32.684 0.400 . 1 . . . . 187 MET CG . 16538 1 416 . 1 1 36 36 MET N N 15 117.453 0.400 . 1 . . . . 187 MET N . 16538 1 417 . 1 1 37 37 LEU H H 1 8.423 0.020 . 1 . . . . 188 LEU H . 16538 1 418 . 1 1 37 37 LEU HA H 1 3.954 0.020 . 1 . . . . 188 LEU HA . 16538 1 419 . 1 1 37 37 LEU HB2 H 1 1.908 0.020 . 2 . . . . 188 LEU HB2 . 16538 1 420 . 1 1 37 37 LEU HB3 H 1 1.321 0.020 . 2 . . . . 188 LEU HB3 . 16538 1 421 . 1 1 37 37 LEU HD11 H 1 0.689 0.020 . 2 . . . . 188 LEU HD1 . 16538 1 422 . 1 1 37 37 LEU HD12 H 1 0.689 0.020 . 2 . . . . 188 LEU HD1 . 16538 1 423 . 1 1 37 37 LEU HD13 H 1 0.689 0.020 . 2 . . . . 188 LEU HD1 . 16538 1 424 . 1 1 37 37 LEU HG H 1 1.970 0.020 . 1 . . . . 188 LEU HG . 16538 1 425 . 1 1 37 37 LEU C C 13 180.130 0.400 . 1 . . . . 188 LEU C . 16538 1 426 . 1 1 37 37 LEU CA C 13 57.679 0.400 . 1 . . . . 188 LEU CA . 16538 1 427 . 1 1 37 37 LEU CB C 13 41.133 0.400 . 1 . . . . 188 LEU CB . 16538 1 428 . 1 1 37 37 LEU CD1 C 13 26.838 0.400 . 1 . . . . 188 LEU CD1 . 16538 1 429 . 1 1 37 37 LEU CD2 C 13 23.736 0.400 . 1 . . . . 188 LEU CD2 . 16538 1 430 . 1 1 37 37 LEU CG C 13 27.108 0.400 . 1 . . . . 188 LEU CG . 16538 1 431 . 1 1 37 37 LEU N N 15 116.850 0.400 . 1 . . . . 188 LEU N . 16538 1 432 . 1 1 38 38 ARG H H 1 8.300 0.020 . 1 . . . . 189 ARG H . 16538 1 433 . 1 1 38 38 ARG HA H 1 3.972 0.020 . 1 . . . . 189 ARG HA . 16538 1 434 . 1 1 38 38 ARG HB2 H 1 1.927 0.020 . 2 . . . . 189 ARG HB2 . 16538 1 435 . 1 1 38 38 ARG HB3 H 1 1.927 0.020 . 2 . . . . 189 ARG HB3 . 16538 1 436 . 1 1 38 38 ARG HD2 H 1 3.183 0.020 . 2 . . . . 189 ARG HD2 . 16538 1 437 . 1 1 38 38 ARG HD3 H 1 3.184 0.020 . 2 . . . . 189 ARG HD3 . 16538 1 438 . 1 1 38 38 ARG HG2 H 1 1.821 0.020 . 2 . . . . 189 ARG HG2 . 16538 1 439 . 1 1 38 38 ARG HG3 H 1 1.568 0.020 . 2 . . . . 189 ARG HG3 . 16538 1 440 . 1 1 38 38 ARG C C 13 178.512 0.400 . 1 . . . . 189 ARG C . 16538 1 441 . 1 1 38 38 ARG CA C 13 59.694 0.400 . 1 . . . . 189 ARG CA . 16538 1 442 . 1 1 38 38 ARG CB C 13 30.172 0.400 . 1 . . . . 189 ARG CB . 16538 1 443 . 1 1 38 38 ARG CD C 13 43.407 0.400 . 1 . . . . 189 ARG CD . 16538 1 444 . 1 1 38 38 ARG CG C 13 27.671 0.400 . 1 . . . . 189 ARG CG . 16538 1 445 . 1 1 38 38 ARG N N 15 120.797 0.400 . 1 . . . . 189 ARG N . 16538 1 446 . 1 1 39 39 ASP H H 1 7.522 0.020 . 1 . . . . 190 ASP H . 16538 1 447 . 1 1 39 39 ASP HA H 1 4.532 0.020 . 1 . . . . 190 ASP HA . 16538 1 448 . 1 1 39 39 ASP HB2 H 1 2.686 0.020 . 2 . . . . 190 ASP HB2 . 16538 1 449 . 1 1 39 39 ASP HB3 H 1 2.691 0.020 . 2 . . . . 190 ASP HB3 . 16538 1 450 . 1 1 39 39 ASP C C 13 176.820 0.400 . 1 . . . . 190 ASP C . 16538 1 451 . 1 1 39 39 ASP CA C 13 55.816 0.400 . 1 . . . . 190 ASP CA . 16538 1 452 . 1 1 39 39 ASP CB C 13 41.039 0.400 . 1 . . . . 190 ASP CB . 16538 1 453 . 1 1 39 39 ASP N N 15 117.779 0.400 . 1 . . . . 190 ASP N . 16538 1 454 . 1 1 40 40 LEU H H 1 7.432 0.020 . 1 . . . . 191 LEU H . 16538 1 455 . 1 1 40 40 LEU HA H 1 4.174 0.020 . 1 . . . . 191 LEU HA . 16538 1 456 . 1 1 40 40 LEU HB2 H 1 1.797 0.020 . 2 . . . . 191 LEU HB2 . 16538 1 457 . 1 1 40 40 LEU HB3 H 1 1.305 0.020 . 2 . . . . 191 LEU HB3 . 16538 1 458 . 1 1 40 40 LEU HD11 H 1 0.781 0.020 . 2 . . . . 191 LEU HD1 . 16538 1 459 . 1 1 40 40 LEU HD12 H 1 0.781 0.020 . 2 . . . . 191 LEU HD1 . 16538 1 460 . 1 1 40 40 LEU HD13 H 1 0.781 0.020 . 2 . . . . 191 LEU HD1 . 16538 1 461 . 1 1 40 40 LEU HD21 H 1 0.679 0.020 . 2 . . . . 191 LEU HD2 . 16538 1 462 . 1 1 40 40 LEU HD22 H 1 0.679 0.020 . 2 . . . . 191 LEU HD2 . 16538 1 463 . 1 1 40 40 LEU HD23 H 1 0.679 0.020 . 2 . . . . 191 LEU HD2 . 16538 1 464 . 1 1 40 40 LEU HG H 1 1.846 0.020 . 1 . . . . 191 LEU HG . 16538 1 465 . 1 1 40 40 LEU C C 13 176.762 0.400 . 1 . . . . 191 LEU C . 16538 1 466 . 1 1 40 40 LEU CA C 13 55.350 0.400 . 1 . . . . 191 LEU CA . 16538 1 467 . 1 1 40 40 LEU CB C 13 43.287 0.400 . 1 . . . . 191 LEU CB . 16538 1 468 . 1 1 40 40 LEU CD1 C 13 22.839 0.400 . 1 . . . . 191 LEU CD1 . 16538 1 469 . 1 1 40 40 LEU CD2 C 13 26.392 0.400 . 1 . . . . 191 LEU CD2 . 16538 1 470 . 1 1 40 40 LEU CG C 13 26.668 0.400 . 1 . . . . 191 LEU CG . 16538 1 471 . 1 1 40 40 LEU N N 15 118.175 0.400 . 1 . . . . 191 LEU N . 16538 1 472 . 1 1 41 41 ASN H H 1 7.931 0.020 . 1 . . . . 192 ASN H . 16538 1 473 . 1 1 41 41 ASN HA H 1 4.485 0.020 . 1 . . . . 192 ASN HA . 16538 1 474 . 1 1 41 41 ASN HB2 H 1 3.100 0.020 . 2 . . . . 192 ASN HB2 . 16538 1 475 . 1 1 41 41 ASN HB3 H 1 2.564 0.020 . 2 . . . . 192 ASN HB3 . 16538 1 476 . 1 1 41 41 ASN C C 13 174.888 0.400 . 1 . . . . 192 ASN C . 16538 1 477 . 1 1 41 41 ASN CA C 13 53.211 0.400 . 1 . . . . 192 ASN CA . 16538 1 478 . 1 1 41 41 ASN CB C 13 36.764 0.400 . 1 . . . . 192 ASN CB . 16538 1 479 . 1 1 41 41 ASN N N 15 116.373 0.400 . 1 . . . . 192 ASN N . 16538 1 480 . 1 1 42 42 LEU H H 1 8.894 0.020 . 1 . . . . 193 LEU H . 16538 1 481 . 1 1 42 42 LEU HA H 1 3.955 0.020 . 1 . . . . 193 LEU HA . 16538 1 482 . 1 1 42 42 LEU HB2 H 1 1.746 0.020 . 2 . . . . 193 LEU HB2 . 16538 1 483 . 1 1 42 42 LEU HB3 H 1 1.156 0.020 . 2 . . . . 193 LEU HB3 . 16538 1 484 . 1 1 42 42 LEU HD11 H 1 0.848 0.020 . 2 . . . . 193 LEU HD1 . 16538 1 485 . 1 1 42 42 LEU HD12 H 1 0.848 0.020 . 2 . . . . 193 LEU HD1 . 16538 1 486 . 1 1 42 42 LEU HD13 H 1 0.848 0.020 . 2 . . . . 193 LEU HD1 . 16538 1 487 . 1 1 42 42 LEU HD21 H 1 0.832 0.020 . 2 . . . . 193 LEU HD2 . 16538 1 488 . 1 1 42 42 LEU HD22 H 1 0.832 0.020 . 2 . . . . 193 LEU HD2 . 16538 1 489 . 1 1 42 42 LEU HD23 H 1 0.832 0.020 . 2 . . . . 193 LEU HD2 . 16538 1 490 . 1 1 42 42 LEU HG H 1 1.698 0.020 . 1 . . . . 193 LEU HG . 16538 1 491 . 1 1 42 42 LEU C C 13 178.920 0.400 . 1 . . . . 193 LEU C . 16538 1 492 . 1 1 42 42 LEU CA C 13 56.149 0.400 . 1 . . . . 193 LEU CA . 16538 1 493 . 1 1 42 42 LEU CB C 13 43.676 0.400 . 1 . . . . 193 LEU CB . 16538 1 494 . 1 1 42 42 LEU CD1 C 13 26.823 0.400 . 1 . . . . 193 LEU CD1 . 16538 1 495 . 1 1 42 42 LEU CD2 C 13 23.871 0.400 . 1 . . . . 193 LEU CD2 . 16538 1 496 . 1 1 42 42 LEU N N 15 118.844 0.400 . 1 . . . . 193 LEU N . 16538 1 497 . 1 1 43 43 GLY H H 1 8.629 0.020 . 1 . . . . 194 GLY H . 16538 1 498 . 1 1 43 43 GLY HA2 H 1 3.860 0.020 . 2 . . . . 194 GLY HA2 . 16538 1 499 . 1 1 43 43 GLY HA3 H 1 3.752 0.020 . 2 . . . . 194 GLY HA3 . 16538 1 500 . 1 1 43 43 GLY C C 13 176.530 0.400 . 1 . . . . 194 GLY C . 16538 1 501 . 1 1 43 43 GLY CA C 13 47.005 0.400 . 1 . . . . 194 GLY CA . 16538 1 502 . 1 1 43 43 GLY N N 15 108.525 0.400 . 1 . . . . 194 GLY N . 16538 1 503 . 1 1 44 44 GLU H H 1 9.225 0.020 . 1 . . . . 195 GLU H . 16538 1 504 . 1 1 44 44 GLU HA H 1 4.287 0.020 . 1 . . . . 195 GLU HA . 16538 1 505 . 1 1 44 44 GLU HB2 H 1 2.200 0.020 . 2 . . . . 195 GLU HB2 . 16538 1 506 . 1 1 44 44 GLU HB3 H 1 1.928 0.020 . 2 . . . . 195 GLU HB3 . 16538 1 507 . 1 1 44 44 GLU HG2 H 1 2.313 0.020 . 2 . . . . 195 GLU HG2 . 16538 1 508 . 1 1 44 44 GLU HG3 H 1 2.315 0.020 . 2 . . . . 195 GLU HG3 . 16538 1 509 . 1 1 44 44 GLU C C 13 177.642 0.400 . 1 . . . . 195 GLU C . 16538 1 510 . 1 1 44 44 GLU CA C 13 57.719 0.400 . 1 . . . . 195 GLU CA . 16538 1 511 . 1 1 44 44 GLU CB C 13 29.215 0.400 . 1 . . . . 195 GLU CB . 16538 1 512 . 1 1 44 44 GLU CG C 13 36.324 0.400 . 1 . . . . 195 GLU CG . 16538 1 513 . 1 1 44 44 GLU N N 15 126.402 0.400 . 1 . . . . 195 GLU N . 16538 1 514 . 1 1 45 45 MET H H 1 8.170 0.020 . 1 . . . . 196 MET H . 16538 1 515 . 1 1 45 45 MET HA H 1 4.376 0.020 . 1 . . . . 196 MET HA . 16538 1 516 . 1 1 45 45 MET HB2 H 1 2.080 0.020 . 2 . . . . 196 MET HB2 . 16538 1 517 . 1 1 45 45 MET HB3 H 1 1.914 0.020 . 2 . . . . 196 MET HB3 . 16538 1 518 . 1 1 45 45 MET HE1 H 1 1.769 0.020 . 1 . . . . 196 MET HE . 16538 1 519 . 1 1 45 45 MET HE2 H 1 1.769 0.020 . 1 . . . . 196 MET HE . 16538 1 520 . 1 1 45 45 MET HE3 H 1 1.769 0.020 . 1 . . . . 196 MET HE . 16538 1 521 . 1 1 45 45 MET HG2 H 1 2.510 0.020 . 2 . . . . 196 MET HG2 . 16538 1 522 . 1 1 45 45 MET HG3 H 1 2.306 0.020 . 2 . . . . 196 MET HG3 . 16538 1 523 . 1 1 45 45 MET C C 13 177.779 0.400 . 1 . . . . 196 MET C . 16538 1 524 . 1 1 45 45 MET CA C 13 55.788 0.400 . 1 . . . . 196 MET CA . 16538 1 525 . 1 1 45 45 MET CB C 13 31.939 0.400 . 1 . . . . 196 MET CB . 16538 1 526 . 1 1 45 45 MET CE C 13 16.886 0.400 . 1 . . . . 196 MET CE . 16538 1 527 . 1 1 45 45 MET CG C 13 32.744 0.400 . 1 . . . . 196 MET CG . 16538 1 528 . 1 1 45 45 MET N N 15 116.207 0.400 . 1 . . . . 196 MET N . 16538 1 529 . 1 1 46 46 LYS H H 1 7.833 0.020 . 1 . . . . 197 LYS H . 16538 1 530 . 1 1 46 46 LYS HA H 1 3.794 0.020 . 1 . . . . 197 LYS HA . 16538 1 531 . 1 1 46 46 LYS HB2 H 1 1.885 0.020 . 2 . . . . 197 LYS HB2 . 16538 1 532 . 1 1 46 46 LYS HB3 H 1 1.720 0.020 . 2 . . . . 197 LYS HB3 . 16538 1 533 . 1 1 46 46 LYS HD2 H 1 1.904 0.020 . 2 . . . . 197 LYS HD2 . 16538 1 534 . 1 1 46 46 LYS HD3 H 1 1.832 0.020 . 2 . . . . 197 LYS HD3 . 16538 1 535 . 1 1 46 46 LYS HE2 H 1 3.089 0.020 . 2 . . . . 197 LYS HE2 . 16538 1 536 . 1 1 46 46 LYS HG2 H 1 1.723 0.020 . 2 . . . . 197 LYS HG2 . 16538 1 537 . 1 1 46 46 LYS HG3 H 1 1.374 0.020 . 2 . . . . 197 LYS HG3 . 16538 1 538 . 1 1 46 46 LYS C C 13 178.378 0.400 . 1 . . . . 197 LYS C . 16538 1 539 . 1 1 46 46 LYS CA C 13 61.176 0.400 . 1 . . . . 197 LYS CA . 16538 1 540 . 1 1 46 46 LYS CB C 13 32.716 0.400 . 1 . . . . 197 LYS CB . 16538 1 541 . 1 1 46 46 LYS CD C 13 29.731 0.400 . 1 . . . . 197 LYS CD . 16538 1 542 . 1 1 46 46 LYS CE C 13 41.878 0.400 . 1 . . . . 197 LYS CE . 16538 1 543 . 1 1 46 46 LYS CG C 13 26.659 0.400 . 1 . . . . 197 LYS CG . 16538 1 544 . 1 1 46 46 LYS N N 15 120.808 0.400 . 1 . . . . 197 LYS N . 16538 1 545 . 1 1 47 47 SER H H 1 8.119 0.020 . 1 . . . . 198 SER H . 16538 1 546 . 1 1 47 47 SER HA H 1 3.882 0.020 . 1 . . . . 198 SER HA . 16538 1 547 . 1 1 47 47 SER HB2 H 1 3.986 0.020 . 2 . . . . 198 SER HB2 . 16538 1 548 . 1 1 47 47 SER HB3 H 1 4.000 0.020 . 2 . . . . 198 SER HB3 . 16538 1 549 . 1 1 47 47 SER C C 13 175.294 0.400 . 1 . . . . 198 SER C . 16538 1 550 . 1 1 47 47 SER CA C 13 60.593 0.400 . 1 . . . . 198 SER CA . 16538 1 551 . 1 1 47 47 SER CB C 13 63.229 0.400 . 1 . . . . 198 SER CB . 16538 1 552 . 1 1 47 47 SER N N 15 111.064 0.400 . 1 . . . . 198 SER N . 16538 1 553 . 1 1 48 48 GLY H H 1 8.022 0.020 . 1 . . . . 199 GLY H . 16538 1 554 . 1 1 48 48 GLY HA2 H 1 4.019 0.020 . 2 . . . . 199 GLY HA2 . 16538 1 555 . 1 1 48 48 GLY HA3 H 1 3.572 0.020 . 2 . . . . 199 GLY HA3 . 16538 1 556 . 1 1 48 48 GLY C C 13 176.379 0.400 . 1 . . . . 199 GLY C . 16538 1 557 . 1 1 48 48 GLY CA C 13 45.723 0.400 . 1 . . . . 199 GLY CA . 16538 1 558 . 1 1 48 48 GLY N N 15 108.446 0.400 . 1 . . . . 199 GLY N . 16538 1 559 . 1 1 49 49 VAL H H 1 8.038 0.020 . 1 . . . . 200 VAL H . 16538 1 560 . 1 1 49 49 VAL HA H 1 3.759 0.020 . 1 . . . . 200 VAL HA . 16538 1 561 . 1 1 49 49 VAL HB H 1 2.438 0.020 . 1 . . . . 200 VAL HB . 16538 1 562 . 1 1 49 49 VAL HG11 H 1 1.080 0.020 . 2 . . . . 200 VAL HG1 . 16538 1 563 . 1 1 49 49 VAL HG12 H 1 1.080 0.020 . 2 . . . . 200 VAL HG1 . 16538 1 564 . 1 1 49 49 VAL HG13 H 1 1.080 0.020 . 2 . . . . 200 VAL HG1 . 16538 1 565 . 1 1 49 49 VAL HG21 H 1 0.616 0.020 . 2 . . . . 200 VAL HG2 . 16538 1 566 . 1 1 49 49 VAL HG22 H 1 0.616 0.020 . 2 . . . . 200 VAL HG2 . 16538 1 567 . 1 1 49 49 VAL HG23 H 1 0.616 0.020 . 2 . . . . 200 VAL HG2 . 16538 1 568 . 1 1 49 49 VAL CA C 13 68.429 0.400 . 1 . . . . 200 VAL CA . 16538 1 569 . 1 1 49 49 VAL CB C 13 29.005 0.400 . 1 . . . . 200 VAL CB . 16538 1 570 . 1 1 49 49 VAL CG1 C 13 23.799 0.400 . 1 . . . . 200 VAL CG1 . 16538 1 571 . 1 1 49 49 VAL CG2 C 13 20.010 0.400 . 1 . . . . 200 VAL CG2 . 16538 1 572 . 1 1 49 49 VAL N N 15 120.558 0.400 . 1 . . . . 200 VAL N . 16538 1 573 . 1 1 50 50 PRO C C 13 176.995 0.400 . 1 . . . . 201 PRO C . 16538 1 574 . 1 1 50 50 PRO CA C 13 65.460 0.400 . 1 . . . . 201 PRO CA . 16538 1 575 . 1 1 50 50 PRO CB C 13 30.299 0.400 . 1 . . . . 201 PRO CB . 16538 1 576 . 1 1 51 51 VAL H H 1 6.232 0.020 . 1 . . . . 202 VAL H . 16538 1 577 . 1 1 51 51 VAL HA H 1 3.171 0.020 . 1 . . . . 202 VAL HA . 16538 1 578 . 1 1 51 51 VAL HB H 1 2.001 0.020 . 1 . . . . 202 VAL HB . 16538 1 579 . 1 1 51 51 VAL HG11 H 1 1.051 0.020 . 2 . . . . 202 VAL HG1 . 16538 1 580 . 1 1 51 51 VAL HG12 H 1 1.051 0.020 . 2 . . . . 202 VAL HG1 . 16538 1 581 . 1 1 51 51 VAL HG13 H 1 1.051 0.020 . 2 . . . . 202 VAL HG1 . 16538 1 582 . 1 1 51 51 VAL HG21 H 1 0.830 0.020 . 2 . . . . 202 VAL HG2 . 16538 1 583 . 1 1 51 51 VAL HG22 H 1 0.830 0.020 . 2 . . . . 202 VAL HG2 . 16538 1 584 . 1 1 51 51 VAL HG23 H 1 0.830 0.020 . 2 . . . . 202 VAL HG2 . 16538 1 585 . 1 1 51 51 VAL C C 13 177.542 0.400 . 1 . . . . 202 VAL C . 16538 1 586 . 1 1 51 51 VAL CA C 13 66.126 0.400 . 1 . . . . 202 VAL CA . 16538 1 587 . 1 1 51 51 VAL CB C 13 31.560 0.400 . 1 . . . . 202 VAL CB . 16538 1 588 . 1 1 51 51 VAL CG1 C 13 23.176 0.400 . 1 . . . . 202 VAL CG1 . 16538 1 589 . 1 1 51 51 VAL CG2 C 13 20.992 0.400 . 1 . . . . 202 VAL CG2 . 16538 1 590 . 1 1 51 51 VAL N N 15 111.348 0.400 . 1 . . . . 202 VAL N . 16538 1 591 . 1 1 52 52 LEU H H 1 7.594 0.020 . 1 . . . . 203 LEU H . 16538 1 592 . 1 1 52 52 LEU HA H 1 4.149 0.020 . 1 . . . . 203 LEU HA . 16538 1 593 . 1 1 52 52 LEU HB2 H 1 1.693 0.020 . 2 . . . . 203 LEU HB2 . 16538 1 594 . 1 1 52 52 LEU HB3 H 1 1.684 0.020 . 2 . . . . 203 LEU HB3 . 16538 1 595 . 1 1 52 52 LEU HD11 H 1 0.877 0.020 . 2 . . . . 203 LEU HD1 . 16538 1 596 . 1 1 52 52 LEU HD12 H 1 0.877 0.020 . 2 . . . . 203 LEU HD1 . 16538 1 597 . 1 1 52 52 LEU HD13 H 1 0.877 0.020 . 2 . . . . 203 LEU HD1 . 16538 1 598 . 1 1 52 52 LEU HD21 H 1 0.687 0.020 . 2 . . . . 203 LEU HD2 . 16538 1 599 . 1 1 52 52 LEU HD22 H 1 0.687 0.020 . 2 . . . . 203 LEU HD2 . 16538 1 600 . 1 1 52 52 LEU HD23 H 1 0.687 0.020 . 2 . . . . 203 LEU HD2 . 16538 1 601 . 1 1 52 52 LEU HG H 1 1.450 0.020 . 1 . . . . 203 LEU HG . 16538 1 602 . 1 1 52 52 LEU C C 13 177.933 0.400 . 1 . . . . 203 LEU C . 16538 1 603 . 1 1 52 52 LEU CA C 13 57.585 0.400 . 1 . . . . 203 LEU CA . 16538 1 604 . 1 1 52 52 LEU CB C 13 42.174 0.400 . 1 . . . . 203 LEU CB . 16538 1 605 . 1 1 52 52 LEU CD1 C 13 23.545 0.400 . 1 . . . . 203 LEU CD1 . 16538 1 606 . 1 1 52 52 LEU CD2 C 13 26.870 0.400 . 1 . . . . 203 LEU CD2 . 16538 1 607 . 1 1 52 52 LEU CG C 13 27.274 0.400 . 1 . . . . 203 LEU CG . 16538 1 608 . 1 1 52 52 LEU N N 15 121.790 0.400 . 1 . . . . 203 LEU N . 16538 1 609 . 1 1 53 53 ALA H H 1 8.215 0.020 . 1 . . . . 204 ALA H . 16538 1 610 . 1 1 53 53 ALA HA H 1 3.925 0.020 . 1 . . . . 204 ALA HA . 16538 1 611 . 1 1 53 53 ALA HB1 H 1 1.225 0.020 . 1 . . . . 204 ALA HB . 16538 1 612 . 1 1 53 53 ALA HB2 H 1 1.225 0.020 . 1 . . . . 204 ALA HB . 16538 1 613 . 1 1 53 53 ALA HB3 H 1 1.225 0.020 . 1 . . . . 204 ALA HB . 16538 1 614 . 1 1 53 53 ALA C C 13 178.197 0.400 . 1 . . . . 204 ALA C . 16538 1 615 . 1 1 53 53 ALA CA C 13 55.985 0.400 . 1 . . . . 204 ALA CA . 16538 1 616 . 1 1 53 53 ALA CB C 13 17.738 0.400 . 1 . . . . 204 ALA CB . 16538 1 617 . 1 1 53 53 ALA N N 15 118.878 0.400 . 1 . . . . 204 ALA N . 16538 1 618 . 1 1 54 54 VAL H H 1 8.174 0.020 . 1 . . . . 205 VAL H . 16538 1 619 . 1 1 54 54 VAL HA H 1 3.080 0.020 . 1 . . . . 205 VAL HA . 16538 1 620 . 1 1 54 54 VAL HB H 1 1.779 0.020 . 1 . . . . 205 VAL HB . 16538 1 621 . 1 1 54 54 VAL HG11 H 1 0.359 0.020 . 2 . . . . 205 VAL HG1 . 16538 1 622 . 1 1 54 54 VAL HG12 H 1 0.359 0.020 . 2 . . . . 205 VAL HG1 . 16538 1 623 . 1 1 54 54 VAL HG13 H 1 0.359 0.020 . 2 . . . . 205 VAL HG1 . 16538 1 624 . 1 1 54 54 VAL HG21 H 1 -0.025 0.020 . 2 . . . . 205 VAL HG2 . 16538 1 625 . 1 1 54 54 VAL HG22 H 1 -0.025 0.020 . 2 . . . . 205 VAL HG2 . 16538 1 626 . 1 1 54 54 VAL HG23 H 1 -0.025 0.020 . 2 . . . . 205 VAL HG2 . 16538 1 627 . 1 1 54 54 VAL C C 13 177.191 0.400 . 1 . . . . 205 VAL C . 16538 1 628 . 1 1 54 54 VAL CA C 13 66.595 0.400 . 1 . . . . 205 VAL CA . 16538 1 629 . 1 1 54 54 VAL CB C 13 30.617 0.400 . 1 . . . . 205 VAL CB . 16538 1 630 . 1 1 54 54 VAL CG1 C 13 21.569 0.400 . 1 . . . . 205 VAL CG1 . 16538 1 631 . 1 1 54 54 VAL CG2 C 13 21.631 0.400 . 1 . . . . 205 VAL CG2 . 16538 1 632 . 1 1 54 54 VAL N N 15 115.273 0.400 . 1 . . . . 205 VAL N . 16538 1 633 . 1 1 55 55 SER H H 1 8.088 0.020 . 1 . . . . 206 SER H . 16538 1 634 . 1 1 55 55 SER HA H 1 3.922 0.020 . 1 . . . . 206 SER HA . 16538 1 635 . 1 1 55 55 SER HB2 H 1 4.039 0.020 . 2 . . . . 206 SER HB2 . 16538 1 636 . 1 1 55 55 SER HB3 H 1 3.817 0.020 . 2 . . . . 206 SER HB3 . 16538 1 637 . 1 1 55 55 SER C C 13 177.024 0.400 . 1 . . . . 206 SER C . 16538 1 638 . 1 1 55 55 SER CA C 13 63.437 0.400 . 1 . . . . 206 SER CA . 16538 1 639 . 1 1 55 55 SER CB C 13 62.309 0.400 . 1 . . . . 206 SER CB . 16538 1 640 . 1 1 55 55 SER N N 15 114.422 0.400 . 1 . . . . 206 SER N . 16538 1 641 . 1 1 56 56 LEU H H 1 8.336 0.020 . 1 . . . . 207 LEU H . 16538 1 642 . 1 1 56 56 LEU HA H 1 4.169 0.020 . 1 . . . . 207 LEU HA . 16538 1 643 . 1 1 56 56 LEU HB2 H 1 2.018 0.020 . 2 . . . . 207 LEU HB2 . 16538 1 644 . 1 1 56 56 LEU HD11 H 1 0.835 0.020 . 2 . . . . 207 LEU HD1 . 16538 1 645 . 1 1 56 56 LEU HD12 H 1 0.835 0.020 . 2 . . . . 207 LEU HD1 . 16538 1 646 . 1 1 56 56 LEU HD13 H 1 0.835 0.020 . 2 . . . . 207 LEU HD1 . 16538 1 647 . 1 1 56 56 LEU HD21 H 1 0.794 0.020 . 2 . . . . 207 LEU HD2 . 16538 1 648 . 1 1 56 56 LEU HD22 H 1 0.794 0.020 . 2 . . . . 207 LEU HD2 . 16538 1 649 . 1 1 56 56 LEU HD23 H 1 0.794 0.020 . 2 . . . . 207 LEU HD2 . 16538 1 650 . 1 1 56 56 LEU C C 13 180.024 0.400 . 1 . . . . 207 LEU C . 16538 1 651 . 1 1 56 56 LEU CA C 13 57.499 0.400 . 1 . . . . 207 LEU CA . 16538 1 652 . 1 1 56 56 LEU CB C 13 42.041 0.400 . 1 . . . . 207 LEU CB . 16538 1 653 . 1 1 56 56 LEU CD1 C 13 22.484 0.400 . 1 . . . . 207 LEU CD1 . 16538 1 654 . 1 1 56 56 LEU CD2 C 13 26.453 0.400 . 1 . . . . 207 LEU CD2 . 16538 1 655 . 1 1 56 56 LEU N N 15 120.801 0.400 . 1 . . . . 207 LEU N . 16538 1 656 . 1 1 57 57 ALA H H 1 8.355 0.020 . 1 . . . . 208 ALA H . 16538 1 657 . 1 1 57 57 ALA HA H 1 3.932 0.020 . 1 . . . . 208 ALA HA . 16538 1 658 . 1 1 57 57 ALA HB1 H 1 1.603 0.020 . 1 . . . . 208 ALA HB . 16538 1 659 . 1 1 57 57 ALA HB2 H 1 1.603 0.020 . 1 . . . . 208 ALA HB . 16538 1 660 . 1 1 57 57 ALA HB3 H 1 1.603 0.020 . 1 . . . . 208 ALA HB . 16538 1 661 . 1 1 57 57 ALA C C 13 180.209 0.400 . 1 . . . . 208 ALA C . 16538 1 662 . 1 1 57 57 ALA CA C 13 54.488 0.400 . 1 . . . . 208 ALA CA . 16538 1 663 . 1 1 57 57 ALA CB C 13 18.801 0.400 . 1 . . . . 208 ALA CB . 16538 1 664 . 1 1 57 57 ALA N N 15 122.315 0.400 . 1 . . . . 208 ALA N . 16538 1 665 . 1 1 58 58 LEU H H 1 8.330 0.020 . 1 . . . . 209 LEU H . 16538 1 666 . 1 1 58 58 LEU HA H 1 3.896 0.020 . 1 . . . . 209 LEU HA . 16538 1 667 . 1 1 58 58 LEU HB2 H 1 2.134 0.020 . 2 . . . . 209 LEU HB2 . 16538 1 668 . 1 1 58 58 LEU HB3 H 1 1.509 0.020 . 2 . . . . 209 LEU HB3 . 16538 1 669 . 1 1 58 58 LEU HD11 H 1 0.900 0.020 . 2 . . . . 209 LEU HD1 . 16538 1 670 . 1 1 58 58 LEU HD12 H 1 0.900 0.020 . 2 . . . . 209 LEU HD1 . 16538 1 671 . 1 1 58 58 LEU HD13 H 1 0.900 0.020 . 2 . . . . 209 LEU HD1 . 16538 1 672 . 1 1 58 58 LEU HD21 H 1 0.905 0.020 . 2 . . . . 209 LEU HD2 . 16538 1 673 . 1 1 58 58 LEU HD22 H 1 0.905 0.020 . 2 . . . . 209 LEU HD2 . 16538 1 674 . 1 1 58 58 LEU HD23 H 1 0.905 0.020 . 2 . . . . 209 LEU HD2 . 16538 1 675 . 1 1 58 58 LEU HG H 1 2.324 0.020 . 1 . . . . 209 LEU HG . 16538 1 676 . 1 1 58 58 LEU C C 13 176.757 0.400 . 1 . . . . 209 LEU C . 16538 1 677 . 1 1 58 58 LEU CA C 13 58.379 0.400 . 1 . . . . 209 LEU CA . 16538 1 678 . 1 1 58 58 LEU CB C 13 41.615 0.400 . 1 . . . . 209 LEU CB . 16538 1 679 . 1 1 58 58 LEU CD1 C 13 26.284 0.400 . 1 . . . . 209 LEU CD1 . 16538 1 680 . 1 1 58 58 LEU CD2 C 13 24.717 0.400 . 1 . . . . 209 LEU CD2 . 16538 1 681 . 1 1 58 58 LEU CG C 13 26.329 0.400 . 1 . . . . 209 LEU CG . 16538 1 682 . 1 1 58 58 LEU N N 15 118.914 0.400 . 1 . . . . 209 LEU N . 16538 1 683 . 1 1 59 59 GLU H H 1 7.064 0.020 . 1 . . . . 210 GLU H . 16538 1 684 . 1 1 59 59 GLU HA H 1 4.390 0.020 . 1 . . . . 210 GLU HA . 16538 1 685 . 1 1 59 59 GLU HB2 H 1 2.215 0.020 . 2 . . . . 210 GLU HB2 . 16538 1 686 . 1 1 59 59 GLU HB3 H 1 1.902 0.020 . 2 . . . . 210 GLU HB3 . 16538 1 687 . 1 1 59 59 GLU HG2 H 1 2.320 0.020 . 2 . . . . 210 GLU HG2 . 16538 1 688 . 1 1 59 59 GLU HG3 H 1 2.189 0.020 . 2 . . . . 210 GLU HG3 . 16538 1 689 . 1 1 59 59 GLU C C 13 176.609 0.400 . 1 . . . . 210 GLU C . 16538 1 690 . 1 1 59 59 GLU CA C 13 55.816 0.400 . 1 . . . . 210 GLU CA . 16538 1 691 . 1 1 59 59 GLU CB C 13 30.284 0.400 . 1 . . . . 210 GLU CB . 16538 1 692 . 1 1 59 59 GLU CG C 13 36.233 0.400 . 1 . . . . 210 GLU CG . 16538 1 693 . 1 1 59 59 GLU N N 15 113.057 0.400 . 1 . . . . 210 GLU N . 16538 1 694 . 1 1 60 60 GLY H H 1 7.316 0.020 . 1 . . . . 211 GLY H . 16538 1 695 . 1 1 60 60 GLY HA2 H 1 4.370 0.020 . 2 . . . . 211 GLY HA2 . 16538 1 696 . 1 1 60 60 GLY HA3 H 1 3.622 0.020 . 2 . . . . 211 GLY HA3 . 16538 1 697 . 1 1 60 60 GLY C C 13 173.530 0.400 . 1 . . . . 211 GLY C . 16538 1 698 . 1 1 60 60 GLY CA C 13 44.177 0.400 . 1 . . . . 211 GLY CA . 16538 1 699 . 1 1 60 60 GLY N N 15 107.934 0.400 . 1 . . . . 211 GLY N . 16538 1 700 . 1 1 61 61 LYS H H 1 8.348 0.020 . 1 . . . . 212 LYS H . 16538 1 701 . 1 1 61 61 LYS HA H 1 4.355 0.020 . 1 . . . . 212 LYS HA . 16538 1 702 . 1 1 61 61 LYS HB2 H 1 1.812 0.020 . 2 . . . . 212 LYS HB2 . 16538 1 703 . 1 1 61 61 LYS HB3 H 1 0.987 0.020 . 2 . . . . 212 LYS HB3 . 16538 1 704 . 1 1 61 61 LYS HD2 H 1 1.543 0.020 . 2 . . . . 212 LYS HD2 . 16538 1 705 . 1 1 61 61 LYS HD3 H 1 1.459 0.020 . 2 . . . . 212 LYS HD3 . 16538 1 706 . 1 1 61 61 LYS HE2 H 1 2.897 0.020 . 2 . . . . 212 LYS HE2 . 16538 1 707 . 1 1 61 61 LYS HE3 H 1 2.898 0.020 . 2 . . . . 212 LYS HE3 . 16538 1 708 . 1 1 61 61 LYS HG2 H 1 1.313 0.020 . 2 . . . . 212 LYS HG2 . 16538 1 709 . 1 1 61 61 LYS HG3 H 1 1.190 0.020 . 2 . . . . 212 LYS HG3 . 16538 1 710 . 1 1 61 61 LYS C C 13 177.615 0.400 . 1 . . . . 212 LYS C . 16538 1 711 . 1 1 61 61 LYS CA C 13 55.108 0.400 . 1 . . . . 212 LYS CA . 16538 1 712 . 1 1 61 61 LYS CB C 13 34.057 0.400 . 1 . . . . 212 LYS CB . 16538 1 713 . 1 1 61 61 LYS CD C 13 28.974 0.400 . 1 . . . . 212 LYS CD . 16538 1 714 . 1 1 61 61 LYS CE C 13 41.810 0.400 . 1 . . . . 212 LYS CE . 16538 1 715 . 1 1 61 61 LYS CG C 13 24.925 0.400 . 1 . . . . 212 LYS CG . 16538 1 716 . 1 1 61 61 LYS N N 15 121.442 0.400 . 1 . . . . 212 LYS N . 16538 1 717 . 1 1 62 62 ALA H H 1 8.783 0.020 . 1 . . . . 213 ALA H . 16538 1 718 . 1 1 62 62 ALA HA H 1 3.784 0.020 . 1 . . . . 213 ALA HA . 16538 1 719 . 1 1 62 62 ALA HB1 H 1 1.407 0.020 . 1 . . . . 213 ALA HB . 16538 1 720 . 1 1 62 62 ALA HB2 H 1 1.407 0.020 . 1 . . . . 213 ALA HB . 16538 1 721 . 1 1 62 62 ALA HB3 H 1 1.407 0.020 . 1 . . . . 213 ALA HB . 16538 1 722 . 1 1 62 62 ALA CA C 13 56.022 0.400 . 1 . . . . 213 ALA CA . 16538 1 723 . 1 1 62 62 ALA CB C 13 17.729 0.400 . 1 . . . . 213 ALA CB . 16538 1 724 . 1 1 62 62 ALA N N 15 124.653 0.400 . 1 . . . . 213 ALA N . 16538 1 725 . 1 1 63 63 SER HA H 1 4.067 0.020 . 1 . . . . 214 SER HA . 16538 1 726 . 1 1 63 63 SER HB2 H 1 3.780 0.020 . 2 . . . . 214 SER HB2 . 16538 1 727 . 1 1 63 63 SER HB3 H 1 3.740 0.020 . 2 . . . . 214 SER HB3 . 16538 1 728 . 1 1 63 63 SER C C 13 176.700 0.400 . 1 . . . . 214 SER C . 16538 1 729 . 1 1 63 63 SER CA C 13 60.694 0.400 . 1 . . . . 214 SER CA . 16538 1 730 . 1 1 63 63 SER CB C 13 61.540 0.400 . 1 . . . . 214 SER CB . 16538 1 731 . 1 1 64 64 HIS H H 1 7.129 0.020 . 1 . . . . 215 HIS H . 16538 1 732 . 1 1 64 64 HIS HA H 1 3.931 0.020 . 1 . . . . 215 HIS HA . 16538 1 733 . 1 1 64 64 HIS HB2 H 1 3.087 0.020 . 2 . . . . 215 HIS HB2 . 16538 1 734 . 1 1 64 64 HIS HB3 H 1 3.078 0.020 . 2 . . . . 215 HIS HB3 . 16538 1 735 . 1 1 64 64 HIS HD2 H 1 6.449 0.020 . 1 . . . . 215 HIS HD2 . 16538 1 736 . 1 1 64 64 HIS HE1 H 1 7.740 0.020 . 1 . . . . 215 HIS HE1 . 16538 1 737 . 1 1 64 64 HIS C C 13 179.141 0.400 . 1 . . . . 215 HIS C . 16538 1 738 . 1 1 64 64 HIS CA C 13 58.038 0.400 . 1 . . . . 215 HIS CA . 16538 1 739 . 1 1 64 64 HIS CB C 13 30.007 0.400 . 1 . . . . 215 HIS CB . 16538 1 740 . 1 1 64 64 HIS N N 15 121.555 0.400 . 1 . . . . 215 HIS N . 16538 1 741 . 1 1 65 65 ARG H H 1 7.651 0.020 . 1 . . . . 216 ARG H . 16538 1 742 . 1 1 65 65 ARG C C 13 177.047 0.400 . 1 . . . . 216 ARG C . 16538 1 743 . 1 1 65 65 ARG CA C 13 61.414 0.400 . 1 . . . . 216 ARG CA . 16538 1 744 . 1 1 65 65 ARG CB C 13 28.166 0.400 . 1 . . . . 216 ARG CB . 16538 1 745 . 1 1 65 65 ARG N N 15 121.077 0.400 . 1 . . . . 216 ARG N . 16538 1 746 . 1 1 66 66 GLU H H 1 7.697 0.020 . 1 . . . . 217 GLU H . 16538 1 747 . 1 1 66 66 GLU HA H 1 4.010 0.020 . 1 . . . . 217 GLU HA . 16538 1 748 . 1 1 66 66 GLU HG2 H 1 2.377 0.020 . 2 . . . . 217 GLU HG2 . 16538 1 749 . 1 1 66 66 GLU HG3 H 1 2.119 0.020 . 2 . . . . 217 GLU HG3 . 16538 1 750 . 1 1 66 66 GLU C C 13 179.019 0.400 . 1 . . . . 217 GLU C . 16538 1 751 . 1 1 66 66 GLU CA C 13 59.560 0.400 . 1 . . . . 217 GLU CA . 16538 1 752 . 1 1 66 66 GLU CB C 13 28.663 0.400 . 1 . . . . 217 GLU CB . 16538 1 753 . 1 1 66 66 GLU CG C 13 34.953 0.400 . 1 . . . . 217 GLU CG . 16538 1 754 . 1 1 66 66 GLU N N 15 120.932 0.400 . 1 . . . . 217 GLU N . 16538 1 755 . 1 1 67 67 MET H H 1 8.353 0.020 . 1 . . . . 218 MET H . 16538 1 756 . 1 1 67 67 MET HA H 1 4.226 0.020 . 1 . . . . 218 MET HA . 16538 1 757 . 1 1 67 67 MET HB2 H 1 2.211 0.020 . 2 . . . . 218 MET HB2 . 16538 1 758 . 1 1 67 67 MET HE1 H 1 1.783 0.020 . 1 . . . . 218 MET HE . 16538 1 759 . 1 1 67 67 MET HE2 H 1 1.783 0.020 . 1 . . . . 218 MET HE . 16538 1 760 . 1 1 67 67 MET HE3 H 1 1.783 0.020 . 1 . . . . 218 MET HE . 16538 1 761 . 1 1 67 67 MET HG2 H 1 2.957 0.020 . 2 . . . . 218 MET HG2 . 16538 1 762 . 1 1 67 67 MET HG3 H 1 2.498 0.020 . 2 . . . . 218 MET HG3 . 16538 1 763 . 1 1 67 67 MET C C 13 181.099 0.400 . 1 . . . . 218 MET C . 16538 1 764 . 1 1 67 67 MET CA C 13 59.092 0.400 . 1 . . . . 218 MET CA . 16538 1 765 . 1 1 67 67 MET CE C 13 18.061 0.400 . 1 . . . . 218 MET CE . 16538 1 766 . 1 1 67 67 MET CG C 13 32.903 0.400 . 1 . . . . 218 MET CG . 16538 1 767 . 1 1 67 67 MET N N 15 115.073 0.400 . 1 . . . . 218 MET N . 16538 1 768 . 1 1 68 68 THR H H 1 8.549 0.020 . 1 . . . . 219 THR H . 16538 1 769 . 1 1 68 68 THR HA H 1 4.075 0.020 . 1 . . . . 219 THR HA . 16538 1 770 . 1 1 68 68 THR HB H 1 4.689 0.020 . 1 . . . . 219 THR HB . 16538 1 771 . 1 1 68 68 THR HG21 H 1 0.955 0.020 . 1 . . . . 219 THR HG2 . 16538 1 772 . 1 1 68 68 THR HG22 H 1 0.955 0.020 . 1 . . . . 219 THR HG2 . 16538 1 773 . 1 1 68 68 THR HG23 H 1 0.955 0.020 . 1 . . . . 219 THR HG2 . 16538 1 774 . 1 1 68 68 THR C C 13 175.272 0.400 . 1 . . . . 219 THR C . 16538 1 775 . 1 1 68 68 THR CA C 13 69.047 0.400 . 1 . . . . 219 THR CA . 16538 1 776 . 1 1 68 68 THR CB C 13 67.081 0.400 . 1 . . . . 219 THR CB . 16538 1 777 . 1 1 68 68 THR CG2 C 13 22.256 0.400 . 1 . . . . 219 THR CG2 . 16538 1 778 . 1 1 68 68 THR N N 15 124.066 0.400 . 1 . . . . 219 THR N . 16538 1 779 . 1 1 69 69 SER H H 1 8.596 0.020 . 1 . . . . 220 SER H . 16538 1 780 . 1 1 69 69 SER HA H 1 4.197 0.020 . 1 . . . . 220 SER HA . 16538 1 781 . 1 1 69 69 SER HB2 H 1 4.021 0.020 . 2 . . . . 220 SER HB2 . 16538 1 782 . 1 1 69 69 SER HB3 H 1 3.980 0.020 . 2 . . . . 220 SER HB3 . 16538 1 783 . 1 1 69 69 SER C C 13 176.246 0.400 . 1 . . . . 220 SER C . 16538 1 784 . 1 1 69 69 SER CA C 13 65.594 0.400 . 1 . . . . 220 SER CA . 16538 1 785 . 1 1 69 69 SER CB C 13 62.763 0.400 . 1 . . . . 220 SER CB . 16538 1 786 . 1 1 69 69 SER N N 15 121.786 0.400 . 1 . . . . 220 SER N . 16538 1 787 . 1 1 70 70 LYS H H 1 7.955 0.020 . 1 . . . . 221 LYS H . 16538 1 788 . 1 1 70 70 LYS HA H 1 4.257 0.020 . 1 . . . . 221 LYS HA . 16538 1 789 . 1 1 70 70 LYS HB2 H 1 1.881 0.020 . 2 . . . . 221 LYS HB2 . 16538 1 790 . 1 1 70 70 LYS HD2 H 1 1.827 0.020 . 2 . . . . 221 LYS HD2 . 16538 1 791 . 1 1 70 70 LYS HD3 H 1 1.686 0.020 . 2 . . . . 221 LYS HD3 . 16538 1 792 . 1 1 70 70 LYS HE2 H 1 3.093 0.020 . 2 . . . . 221 LYS HE2 . 16538 1 793 . 1 1 70 70 LYS HE3 H 1 3.091 0.020 . 2 . . . . 221 LYS HE3 . 16538 1 794 . 1 1 70 70 LYS HG2 H 1 1.530 0.020 . 2 . . . . 221 LYS HG2 . 16538 1 795 . 1 1 70 70 LYS HG3 H 1 1.450 0.020 . 2 . . . . 221 LYS HG3 . 16538 1 796 . 1 1 70 70 LYS C C 13 177.403 0.400 . 1 . . . . 221 LYS C . 16538 1 797 . 1 1 70 70 LYS CA C 13 58.733 0.400 . 1 . . . . 221 LYS CA . 16538 1 798 . 1 1 70 70 LYS CB C 13 32.493 0.400 . 1 . . . . 221 LYS CB . 16538 1 799 . 1 1 70 70 LYS CD C 13 28.759 0.400 . 1 . . . . 221 LYS CD . 16538 1 800 . 1 1 70 70 LYS CE C 13 42.167 0.400 . 1 . . . . 221 LYS CE . 16538 1 801 . 1 1 70 70 LYS CG C 13 25.029 0.400 . 1 . . . . 221 LYS CG . 16538 1 802 . 1 1 70 70 LYS N N 15 121.918 0.400 . 1 . . . . 221 LYS N . 16538 1 803 . 1 1 71 71 LEU H H 1 7.774 0.020 . 1 . . . . 222 LEU H . 16538 1 804 . 1 1 71 71 LEU HA H 1 3.866 0.020 . 1 . . . . 222 LEU HA . 16538 1 805 . 1 1 71 71 LEU HB2 H 1 2.173 0.020 . 2 . . . . 222 LEU HB2 . 16538 1 806 . 1 1 71 71 LEU HB3 H 1 1.385 0.020 . 2 . . . . 222 LEU HB3 . 16538 1 807 . 1 1 71 71 LEU HD11 H 1 0.373 0.020 . 2 . . . . 222 LEU HD1 . 16538 1 808 . 1 1 71 71 LEU HD12 H 1 0.373 0.020 . 2 . . . . 222 LEU HD1 . 16538 1 809 . 1 1 71 71 LEU HD13 H 1 0.373 0.020 . 2 . . . . 222 LEU HD1 . 16538 1 810 . 1 1 71 71 LEU HD21 H 1 0.179 0.020 . 2 . . . . 222 LEU HD2 . 16538 1 811 . 1 1 71 71 LEU HD22 H 1 0.179 0.020 . 2 . . . . 222 LEU HD2 . 16538 1 812 . 1 1 71 71 LEU HD23 H 1 0.179 0.020 . 2 . . . . 222 LEU HD2 . 16538 1 813 . 1 1 71 71 LEU HG H 1 1.175 0.020 . 1 . . . . 222 LEU HG . 16538 1 814 . 1 1 71 71 LEU C C 13 177.660 0.400 . 1 . . . . 222 LEU C . 16538 1 815 . 1 1 71 71 LEU CA C 13 58.289 0.400 . 1 . . . . 222 LEU CA . 16538 1 816 . 1 1 71 71 LEU CB C 13 41.078 0.400 . 1 . . . . 222 LEU CB . 16538 1 817 . 1 1 71 71 LEU CD1 C 13 24.433 0.400 . 1 . . . . 222 LEU CD1 . 16538 1 818 . 1 1 71 71 LEU CD2 C 13 22.579 0.400 . 1 . . . . 222 LEU CD2 . 16538 1 819 . 1 1 71 71 LEU CG C 13 26.526 0.400 . 1 . . . . 222 LEU CG . 16538 1 820 . 1 1 71 71 LEU N N 15 119.385 0.400 . 1 . . . . 222 LEU N . 16538 1 821 . 1 1 72 72 LEU H H 1 8.234 0.020 . 1 . . . . 223 LEU H . 16538 1 822 . 1 1 72 72 LEU HA H 1 3.676 0.020 . 1 . . . . 223 LEU HA . 16538 1 823 . 1 1 72 72 LEU HB2 H 1 1.907 0.020 . 2 . . . . 223 LEU HB2 . 16538 1 824 . 1 1 72 72 LEU HB3 H 1 1.319 0.020 . 2 . . . . 223 LEU HB3 . 16538 1 825 . 1 1 72 72 LEU HD11 H 1 0.789 0.020 . 2 . . . . 223 LEU HD1 . 16538 1 826 . 1 1 72 72 LEU HD12 H 1 0.789 0.020 . 2 . . . . 223 LEU HD1 . 16538 1 827 . 1 1 72 72 LEU HD13 H 1 0.789 0.020 . 2 . . . . 223 LEU HD1 . 16538 1 828 . 1 1 72 72 LEU HD21 H 1 0.625 0.020 . 2 . . . . 223 LEU HD2 . 16538 1 829 . 1 1 72 72 LEU HD22 H 1 0.625 0.020 . 2 . . . . 223 LEU HD2 . 16538 1 830 . 1 1 72 72 LEU HD23 H 1 0.625 0.020 . 2 . . . . 223 LEU HD2 . 16538 1 831 . 1 1 72 72 LEU HG H 1 2.055 0.020 . 1 . . . . 223 LEU HG . 16538 1 832 . 1 1 72 72 LEU C C 13 177.938 0.400 . 1 . . . . 223 LEU C . 16538 1 833 . 1 1 72 72 LEU CA C 13 58.324 0.400 . 1 . . . . 223 LEU CA . 16538 1 834 . 1 1 72 72 LEU CB C 13 41.127 0.400 . 1 . . . . 223 LEU CB . 16538 1 835 . 1 1 72 72 LEU CD1 C 13 24.063 0.400 . 1 . . . . 223 LEU CD1 . 16538 1 836 . 1 1 72 72 LEU CD2 C 13 22.201 0.400 . 1 . . . . 223 LEU CD2 . 16538 1 837 . 1 1 72 72 LEU CG C 13 26.984 0.400 . 1 . . . . 223 LEU CG . 16538 1 838 . 1 1 72 72 LEU N N 15 115.471 0.400 . 1 . . . . 223 LEU N . 16538 1 839 . 1 1 73 73 SER H H 1 7.587 0.020 . 1 . . . . 224 SER H . 16538 1 840 . 1 1 73 73 SER HA H 1 4.214 0.020 . 1 . . . . 224 SER HA . 16538 1 841 . 1 1 73 73 SER HB2 H 1 4.026 0.020 . 2 . . . . 224 SER HB2 . 16538 1 842 . 1 1 73 73 SER HB3 H 1 3.979 0.020 . 2 . . . . 224 SER HB3 . 16538 1 843 . 1 1 73 73 SER C C 13 176.938 0.400 . 1 . . . . 224 SER C . 16538 1 844 . 1 1 73 73 SER CA C 13 61.377 0.400 . 1 . . . . 224 SER CA . 16538 1 845 . 1 1 73 73 SER CB C 13 62.879 0.400 . 1 . . . . 224 SER CB . 16538 1 846 . 1 1 73 73 SER N N 15 110.243 0.400 . 1 . . . . 224 SER N . 16538 1 847 . 1 1 74 74 ASP H H 1 8.424 0.020 . 1 . . . . 225 ASP H . 16538 1 848 . 1 1 74 74 ASP HA H 1 4.508 0.020 . 1 . . . . 225 ASP HA . 16538 1 849 . 1 1 74 74 ASP HB2 H 1 2.609 0.020 . 2 . . . . 225 ASP HB2 . 16538 1 850 . 1 1 74 74 ASP HB3 H 1 2.620 0.020 . 2 . . . . 225 ASP HB3 . 16538 1 851 . 1 1 74 74 ASP C C 13 179.343 0.400 . 1 . . . . 225 ASP C . 16538 1 852 . 1 1 74 74 ASP CA C 13 56.609 0.400 . 1 . . . . 225 ASP CA . 16538 1 853 . 1 1 74 74 ASP CB C 13 39.677 0.400 . 1 . . . . 225 ASP CB . 16538 1 854 . 1 1 74 74 ASP N N 15 119.956 0.400 . 1 . . . . 225 ASP N . 16538 1 855 . 1 1 75 75 LEU H H 1 8.319 0.020 . 1 . . . . 226 LEU H . 16538 1 856 . 1 1 75 75 LEU HA H 1 4.173 0.020 . 1 . . . . 226 LEU HA . 16538 1 857 . 1 1 75 75 LEU HB2 H 1 1.831 0.020 . 2 . . . . 226 LEU HB2 . 16538 1 858 . 1 1 75 75 LEU HB3 H 1 1.259 0.020 . 2 . . . . 226 LEU HB3 . 16538 1 859 . 1 1 75 75 LEU HD11 H 1 0.630 0.020 . 2 . . . . 226 LEU HD1 . 16538 1 860 . 1 1 75 75 LEU HD12 H 1 0.630 0.020 . 2 . . . . 226 LEU HD1 . 16538 1 861 . 1 1 75 75 LEU HD13 H 1 0.630 0.020 . 2 . . . . 226 LEU HD1 . 16538 1 862 . 1 1 75 75 LEU HD21 H 1 0.513 0.020 . 2 . . . . 226 LEU HD2 . 16538 1 863 . 1 1 75 75 LEU HD22 H 1 0.513 0.020 . 2 . . . . 226 LEU HD2 . 16538 1 864 . 1 1 75 75 LEU HD23 H 1 0.513 0.020 . 2 . . . . 226 LEU HD2 . 16538 1 865 . 1 1 75 75 LEU HG H 1 1.992 0.020 . 1 . . . . 226 LEU HG . 16538 1 866 . 1 1 75 75 LEU C C 13 178.483 0.400 . 1 . . . . 226 LEU C . 16538 1 867 . 1 1 75 75 LEU CA C 13 56.283 0.400 . 1 . . . . 226 LEU CA . 16538 1 868 . 1 1 75 75 LEU CB C 13 42.334 0.400 . 1 . . . . 226 LEU CB . 16538 1 869 . 1 1 75 75 LEU CD1 C 13 21.975 0.400 . 1 . . . . 226 LEU CD1 . 16538 1 870 . 1 1 75 75 LEU CD2 C 13 25.168 0.400 . 1 . . . . 226 LEU CD2 . 16538 1 871 . 1 1 75 75 LEU CG C 13 26.529 0.400 . 1 . . . . 226 LEU CG . 16538 1 872 . 1 1 75 75 LEU N N 15 117.156 0.400 . 1 . . . . 226 LEU N . 16538 1 873 . 1 1 76 76 CYS H H 1 7.606 0.020 . 1 . . . . 227 CYS H . 16538 1 874 . 1 1 76 76 CYS HA H 1 4.308 0.020 . 1 . . . . 227 CYS HA . 16538 1 875 . 1 1 76 76 CYS HB2 H 1 3.054 0.020 . 2 . . . . 227 CYS HB2 . 16538 1 876 . 1 1 76 76 CYS HB3 H 1 2.707 0.020 . 2 . . . . 227 CYS HB3 . 16538 1 877 . 1 1 76 76 CYS C C 13 174.466 0.400 . 1 . . . . 227 CYS C . 16538 1 878 . 1 1 76 76 CYS CA C 13 61.475 0.400 . 1 . . . . 227 CYS CA . 16538 1 879 . 1 1 76 76 CYS CB C 13 26.004 0.400 . 1 . . . . 227 CYS CB . 16538 1 880 . 1 1 76 76 CYS N N 15 122.213 0.400 . 1 . . . . 227 CYS N . 16538 1 881 . 1 1 77 77 GLY H H 1 9.115 0.020 . 1 . . . . 228 GLY H . 16538 1 882 . 1 1 77 77 GLY HA2 H 1 4.571 0.020 . 2 . . . . 228 GLY HA2 . 16538 1 883 . 1 1 77 77 GLY HA3 H 1 3.808 0.020 . 2 . . . . 228 GLY HA3 . 16538 1 884 . 1 1 77 77 GLY C C 13 174.442 0.400 . 1 . . . . 228 GLY C . 16538 1 885 . 1 1 77 77 GLY CA C 13 45.131 0.400 . 1 . . . . 228 GLY CA . 16538 1 886 . 1 1 77 77 GLY N N 15 116.517 0.400 . 1 . . . . 228 GLY N . 16538 1 887 . 1 1 78 78 THR H H 1 7.639 0.020 . 1 . . . . 229 THR H . 16538 1 888 . 1 1 78 78 THR HA H 1 4.475 0.020 . 1 . . . . 229 THR HA . 16538 1 889 . 1 1 78 78 THR HB H 1 4.090 0.020 . 1 . . . . 229 THR HB . 16538 1 890 . 1 1 78 78 THR HG21 H 1 1.201 0.020 . 1 . . . . 229 THR HG2 . 16538 1 891 . 1 1 78 78 THR HG22 H 1 1.201 0.020 . 1 . . . . 229 THR HG2 . 16538 1 892 . 1 1 78 78 THR HG23 H 1 1.201 0.020 . 1 . . . . 229 THR HG2 . 16538 1 893 . 1 1 78 78 THR C C 13 175.162 0.400 . 1 . . . . 229 THR C . 16538 1 894 . 1 1 78 78 THR CA C 13 61.957 0.400 . 1 . . . . 229 THR CA . 16538 1 895 . 1 1 78 78 THR CB C 13 69.672 0.400 . 1 . . . . 229 THR CB . 16538 1 896 . 1 1 78 78 THR CG2 C 13 21.822 0.400 . 1 . . . . 229 THR CG2 . 16538 1 897 . 1 1 78 78 THR N N 15 110.964 0.400 . 1 . . . . 229 THR N . 16538 1 898 . 1 1 79 79 VAL H H 1 8.348 0.020 . 1 . . . . 230 VAL H . 16538 1 899 . 1 1 79 79 VAL HA H 1 4.240 0.020 . 1 . . . . 230 VAL HA . 16538 1 900 . 1 1 79 79 VAL HB H 1 2.087 0.020 . 1 . . . . 230 VAL HB . 16538 1 901 . 1 1 79 79 VAL HG11 H 1 1.002 0.020 . 2 . . . . 230 VAL HG1 . 16538 1 902 . 1 1 79 79 VAL HG12 H 1 1.002 0.020 . 2 . . . . 230 VAL HG1 . 16538 1 903 . 1 1 79 79 VAL HG13 H 1 1.002 0.020 . 2 . . . . 230 VAL HG1 . 16538 1 904 . 1 1 79 79 VAL HG21 H 1 0.940 0.020 . 2 . . . . 230 VAL HG2 . 16538 1 905 . 1 1 79 79 VAL HG22 H 1 0.940 0.020 . 2 . . . . 230 VAL HG2 . 16538 1 906 . 1 1 79 79 VAL HG23 H 1 0.940 0.020 . 2 . . . . 230 VAL HG2 . 16538 1 907 . 1 1 79 79 VAL C C 13 174.334 0.400 . 1 . . . . 230 VAL C . 16538 1 908 . 1 1 79 79 VAL CA C 13 62.810 0.400 . 1 . . . . 230 VAL CA . 16538 1 909 . 1 1 79 79 VAL CB C 13 34.002 0.400 . 1 . . . . 230 VAL CB . 16538 1 910 . 1 1 79 79 VAL CG1 C 13 22.458 0.400 . 1 . . . . 230 VAL CG1 . 16538 1 911 . 1 1 79 79 VAL CG2 C 13 21.474 0.400 . 1 . . . . 230 VAL CG2 . 16538 1 912 . 1 1 79 79 VAL N N 15 118.529 0.400 . 1 . . . . 230 VAL N . 16538 1 913 . 1 1 80 80 MET H H 1 7.953 0.020 . 1 . . . . 231 MET H . 16538 1 914 . 1 1 80 80 MET HA H 1 4.905 0.020 . 1 . . . . 231 MET HA . 16538 1 915 . 1 1 80 80 MET HB2 H 1 2.162 0.020 . 2 . . . . 231 MET HB2 . 16538 1 916 . 1 1 80 80 MET HB3 H 1 1.940 0.020 . 2 . . . . 231 MET HB3 . 16538 1 917 . 1 1 80 80 MET HE1 H 1 1.812 0.020 . 1 . . . . 231 MET HE . 16538 1 918 . 1 1 80 80 MET HE2 H 1 1.812 0.020 . 1 . . . . 231 MET HE . 16538 1 919 . 1 1 80 80 MET HE3 H 1 1.812 0.020 . 1 . . . . 231 MET HE . 16538 1 920 . 1 1 80 80 MET HG2 H 1 2.309 0.020 . 2 . . . . 231 MET HG2 . 16538 1 921 . 1 1 80 80 MET HG3 H 1 2.260 0.020 . 2 . . . . 231 MET HG3 . 16538 1 922 . 1 1 80 80 MET C C 13 173.571 0.400 . 1 . . . . 231 MET C . 16538 1 923 . 1 1 80 80 MET CA C 13 53.864 0.400 . 1 . . . . 231 MET CA . 16538 1 924 . 1 1 80 80 MET CB C 13 35.818 0.400 . 1 . . . . 231 MET CB . 16538 1 925 . 1 1 80 80 MET CE C 13 17.884 0.400 . 1 . . . . 231 MET CE . 16538 1 926 . 1 1 80 80 MET CG C 13 31.543 0.400 . 1 . . . . 231 MET CG . 16538 1 927 . 1 1 80 80 MET N N 15 116.173 0.400 . 1 . . . . 231 MET N . 16538 1 928 . 1 1 81 81 SER H H 1 9.835 0.020 . 1 . . . . 232 SER H . 16538 1 929 . 1 1 81 81 SER HA H 1 5.131 0.020 . 1 . . . . 232 SER HA . 16538 1 930 . 1 1 81 81 SER HB2 H 1 4.355 0.020 . 2 . . . . 232 SER HB2 . 16538 1 931 . 1 1 81 81 SER HB3 H 1 3.917 0.020 . 2 . . . . 232 SER HB3 . 16538 1 932 . 1 1 81 81 SER C C 13 176.431 0.400 . 1 . . . . 232 SER C . 16538 1 933 . 1 1 81 81 SER CA C 13 56.364 0.400 . 1 . . . . 232 SER CA . 16538 1 934 . 1 1 81 81 SER CB C 13 67.255 0.400 . 1 . . . . 232 SER CB . 16538 1 935 . 1 1 81 81 SER N N 15 118.905 0.400 . 1 . . . . 232 SER N . 16538 1 936 . 1 1 82 82 THR H H 1 8.923 0.020 . 1 . . . . 233 THR H . 16538 1 937 . 1 1 82 82 THR HA H 1 4.074 0.020 . 1 . . . . 233 THR HA . 16538 1 938 . 1 1 82 82 THR HB H 1 4.315 0.020 . 1 . . . . 233 THR HB . 16538 1 939 . 1 1 82 82 THR HG21 H 1 1.292 0.020 . 1 . . . . 233 THR HG2 . 16538 1 940 . 1 1 82 82 THR HG22 H 1 1.292 0.020 . 1 . . . . 233 THR HG2 . 16538 1 941 . 1 1 82 82 THR HG23 H 1 1.292 0.020 . 1 . . . . 233 THR HG2 . 16538 1 942 . 1 1 82 82 THR CA C 13 65.714 0.400 . 1 . . . . 233 THR CA . 16538 1 943 . 1 1 82 82 THR CB C 13 67.812 0.400 . 1 . . . . 233 THR CB . 16538 1 944 . 1 1 82 82 THR CG2 C 13 22.127 0.400 . 1 . . . . 233 THR CG2 . 16538 1 945 . 1 1 82 82 THR N N 15 113.600 0.400 . 1 . . . . 233 THR N . 16538 1 946 . 1 1 83 83 ASN H H 1 8.088 0.020 . 1 . . . . 234 ASN H . 16538 1 947 . 1 1 83 83 ASN HA H 1 4.540 0.020 . 1 . . . . 234 ASN HA . 16538 1 948 . 1 1 83 83 ASN HB2 H 1 2.705 0.020 . 2 . . . . 234 ASN HB2 . 16538 1 949 . 1 1 83 83 ASN HB3 H 1 2.708 0.020 . 2 . . . . 234 ASN HB3 . 16538 1 950 . 1 1 83 83 ASN C C 13 177.258 0.400 . 1 . . . . 234 ASN C . 16538 1 951 . 1 1 83 83 ASN CA C 13 56.780 0.400 . 1 . . . . 234 ASN CA . 16538 1 952 . 1 1 83 83 ASN CB C 13 38.760 0.400 . 1 . . . . 234 ASN CB . 16538 1 953 . 1 1 83 83 ASN N N 15 120.925 0.400 . 1 . . . . 234 ASN N . 16538 1 954 . 1 1 84 84 ASP H H 1 7.727 0.020 . 1 . . . . 235 ASP H . 16538 1 955 . 1 1 84 84 ASP HA H 1 4.301 0.020 . 1 . . . . 235 ASP HA . 16538 1 956 . 1 1 84 84 ASP HB2 H 1 3.091 0.020 . 2 . . . . 235 ASP HB2 . 16538 1 957 . 1 1 84 84 ASP HB3 H 1 2.243 0.020 . 2 . . . . 235 ASP HB3 . 16538 1 958 . 1 1 84 84 ASP C C 13 177.970 0.400 . 1 . . . . 235 ASP C . 16538 1 959 . 1 1 84 84 ASP CA C 13 57.945 0.400 . 1 . . . . 235 ASP CA . 16538 1 960 . 1 1 84 84 ASP CB C 13 41.644 0.400 . 1 . . . . 235 ASP CB . 16538 1 961 . 1 1 84 84 ASP N N 15 119.441 0.400 . 1 . . . . 235 ASP N . 16538 1 962 . 1 1 85 85 VAL H H 1 7.602 0.020 . 1 . . . . 236 VAL H . 16538 1 963 . 1 1 85 85 VAL HA H 1 3.461 0.020 . 1 . . . . 236 VAL HA . 16538 1 964 . 1 1 85 85 VAL HB H 1 2.373 0.020 . 1 . . . . 236 VAL HB . 16538 1 965 . 1 1 85 85 VAL HG11 H 1 0.992 0.020 . 2 . . . . 236 VAL HG1 . 16538 1 966 . 1 1 85 85 VAL HG12 H 1 0.992 0.020 . 2 . . . . 236 VAL HG1 . 16538 1 967 . 1 1 85 85 VAL HG13 H 1 0.992 0.020 . 2 . . . . 236 VAL HG1 . 16538 1 968 . 1 1 85 85 VAL HG21 H 1 0.914 0.020 . 2 . . . . 236 VAL HG2 . 16538 1 969 . 1 1 85 85 VAL HG22 H 1 0.914 0.020 . 2 . . . . 236 VAL HG2 . 16538 1 970 . 1 1 85 85 VAL HG23 H 1 0.914 0.020 . 2 . . . . 236 VAL HG2 . 16538 1 971 . 1 1 85 85 VAL C C 13 178.078 0.400 . 1 . . . . 236 VAL C . 16538 1 972 . 1 1 85 85 VAL CA C 13 66.767 0.400 . 1 . . . . 236 VAL CA . 16538 1 973 . 1 1 85 85 VAL CB C 13 31.410 0.400 . 1 . . . . 236 VAL CB . 16538 1 974 . 1 1 85 85 VAL CG1 C 13 23.734 0.400 . 1 . . . . 236 VAL CG1 . 16538 1 975 . 1 1 85 85 VAL CG2 C 13 22.276 0.400 . 1 . . . . 236 VAL CG2 . 16538 1 976 . 1 1 85 85 VAL N N 15 118.935 0.400 . 1 . . . . 236 VAL N . 16538 1 977 . 1 1 86 86 GLU H H 1 8.231 0.020 . 1 . . . . 237 GLU H . 16538 1 978 . 1 1 86 86 GLU HA H 1 3.673 0.020 . 1 . . . . 237 GLU HA . 16538 1 979 . 1 1 86 86 GLU HB2 H 1 2.259 0.020 . 2 . . . . 237 GLU HB2 . 16538 1 980 . 1 1 86 86 GLU HB3 H 1 2.234 0.020 . 2 . . . . 237 GLU HB3 . 16538 1 981 . 1 1 86 86 GLU HG2 H 1 2.497 0.020 . 2 . . . . 237 GLU HG2 . 16538 1 982 . 1 1 86 86 GLU HG3 H 1 2.254 0.020 . 2 . . . . 237 GLU HG3 . 16538 1 983 . 1 1 86 86 GLU C C 13 177.847 0.400 . 1 . . . . 237 GLU C . 16538 1 984 . 1 1 86 86 GLU CA C 13 60.839 0.400 . 1 . . . . 237 GLU CA . 16538 1 985 . 1 1 86 86 GLU CB C 13 29.664 0.400 . 1 . . . . 237 GLU CB . 16538 1 986 . 1 1 86 86 GLU CG C 13 37.287 0.400 . 1 . . . . 237 GLU CG . 16538 1 987 . 1 1 86 86 GLU N N 15 121.992 0.400 . 1 . . . . 237 GLU N . 16538 1 988 . 1 1 87 87 LYS H H 1 7.824 0.020 . 1 . . . . 238 LYS H . 16538 1 989 . 1 1 87 87 LYS HA H 1 4.165 0.020 . 1 . . . . 238 LYS HA . 16538 1 990 . 1 1 87 87 LYS HB2 H 1 2.060 0.020 . 2 . . . . 238 LYS HB2 . 16538 1 991 . 1 1 87 87 LYS HB3 H 1 1.896 0.020 . 2 . . . . 238 LYS HB3 . 16538 1 992 . 1 1 87 87 LYS HD2 H 1 1.729 0.020 . 2 . . . . 238 LYS HD2 . 16538 1 993 . 1 1 87 87 LYS HD3 H 1 1.730 0.020 . 2 . . . . 238 LYS HD3 . 16538 1 994 . 1 1 87 87 LYS HE2 H 1 2.985 0.020 . 2 . . . . 238 LYS HE2 . 16538 1 995 . 1 1 87 87 LYS HE3 H 1 2.984 0.020 . 2 . . . . 238 LYS HE3 . 16538 1 996 . 1 1 87 87 LYS HG2 H 1 1.731 0.020 . 2 . . . . 238 LYS HG2 . 16538 1 997 . 1 1 87 87 LYS HG3 H 1 1.563 0.020 . 2 . . . . 238 LYS HG3 . 16538 1 998 . 1 1 87 87 LYS C C 13 180.441 0.400 . 1 . . . . 238 LYS C . 16538 1 999 . 1 1 87 87 LYS CA C 13 59.189 0.400 . 1 . . . . 238 LYS CA . 16538 1 1000 . 1 1 87 87 LYS CB C 13 32.214 0.400 . 1 . . . . 238 LYS CB . 16538 1 1001 . 1 1 87 87 LYS CD C 13 29.206 0.400 . 1 . . . . 238 LYS CD . 16538 1 1002 . 1 1 87 87 LYS CE C 13 41.985 0.400 . 1 . . . . 238 LYS CE . 16538 1 1003 . 1 1 87 87 LYS CG C 13 25.545 0.400 . 1 . . . . 238 LYS CG . 16538 1 1004 . 1 1 87 87 LYS N N 15 116.363 0.400 . 1 . . . . 238 LYS N . 16538 1 1005 . 1 1 88 88 SER H H 1 8.215 0.020 . 1 . . . . 239 SER H . 16538 1 1006 . 1 1 88 88 SER HA H 1 4.052 0.020 . 1 . . . . 239 SER HA . 16538 1 1007 . 1 1 88 88 SER HB2 H 1 3.878 0.020 . 2 . . . . 239 SER HB2 . 16538 1 1008 . 1 1 88 88 SER HB3 H 1 3.558 0.020 . 2 . . . . 239 SER HB3 . 16538 1 1009 . 1 1 88 88 SER C C 13 175.707 0.400 . 1 . . . . 239 SER C . 16538 1 1010 . 1 1 88 88 SER CA C 13 62.209 0.400 . 1 . . . . 239 SER CA . 16538 1 1011 . 1 1 88 88 SER CB C 13 63.029 0.400 . 1 . . . . 239 SER CB . 16538 1 1012 . 1 1 88 88 SER N N 15 117.378 0.400 . 1 . . . . 239 SER N . 16538 1 1013 . 1 1 89 89 PHE H H 1 7.976 0.020 . 1 . . . . 240 PHE H . 16538 1 1014 . 1 1 89 89 PHE HA H 1 4.141 0.020 . 1 . . . . 240 PHE HA . 16538 1 1015 . 1 1 89 89 PHE HB2 H 1 2.987 0.020 . 2 . . . . 240 PHE HB2 . 16538 1 1016 . 1 1 89 89 PHE HB3 H 1 2.691 0.020 . 2 . . . . 240 PHE HB3 . 16538 1 1017 . 1 1 89 89 PHE HD1 H 1 7.058 0.020 . 1 . . . . 240 PHE HD1 . 16538 1 1018 . 1 1 89 89 PHE HD2 H 1 7.058 0.020 . 1 . . . . 240 PHE HD2 . 16538 1 1019 . 1 1 89 89 PHE HE1 H 1 6.781 0.020 . 1 . . . . 240 PHE HE1 . 16538 1 1020 . 1 1 89 89 PHE HE2 H 1 6.781 0.020 . 1 . . . . 240 PHE HE2 . 16538 1 1021 . 1 1 89 89 PHE HZ H 1 6.721 0.020 . 1 . . . . 240 PHE HZ . 16538 1 1022 . 1 1 89 89 PHE C C 13 177.340 0.400 . 1 . . . . 240 PHE C . 16538 1 1023 . 1 1 89 89 PHE CA C 13 63.798 0.400 . 1 . . . . 240 PHE CA . 16538 1 1024 . 1 1 89 89 PHE CB C 13 38.215 0.400 . 1 . . . . 240 PHE CB . 16538 1 1025 . 1 1 89 89 PHE N N 15 121.478 0.400 . 1 . . . . 240 PHE N . 16538 1 1026 . 1 1 90 90 ASP H H 1 8.498 0.020 . 1 . . . . 241 ASP H . 16538 1 1027 . 1 1 90 90 ASP HA H 1 4.442 0.020 . 1 . . . . 241 ASP HA . 16538 1 1028 . 1 1 90 90 ASP HB2 H 1 3.048 0.020 . 2 . . . . 241 ASP HB2 . 16538 1 1029 . 1 1 90 90 ASP HB3 H 1 2.746 0.020 . 2 . . . . 241 ASP HB3 . 16538 1 1030 . 1 1 90 90 ASP C C 13 179.146 0.400 . 1 . . . . 241 ASP C . 16538 1 1031 . 1 1 90 90 ASP CA C 13 57.738 0.400 . 1 . . . . 241 ASP CA . 16538 1 1032 . 1 1 90 90 ASP CB C 13 40.190 0.400 . 1 . . . . 241 ASP CB . 16538 1 1033 . 1 1 90 90 ASP N N 15 120.360 0.400 . 1 . . . . 241 ASP N . 16538 1 1034 . 1 1 91 91 LYS H H 1 7.650 0.020 . 1 . . . . 242 LYS H . 16538 1 1035 . 1 1 91 91 LYS HA H 1 4.025 0.020 . 1 . . . . 242 LYS HA . 16538 1 1036 . 1 1 91 91 LYS HB2 H 1 2.002 0.020 . 2 . . . . 242 LYS HB2 . 16538 1 1037 . 1 1 91 91 LYS HB3 H 1 1.810 0.020 . 2 . . . . 242 LYS HB3 . 16538 1 1038 . 1 1 91 91 LYS HD2 H 1 1.725 0.020 . 2 . . . . 242 LYS HD2 . 16538 1 1039 . 1 1 91 91 LYS HD3 H 1 1.509 0.020 . 2 . . . . 242 LYS HD3 . 16538 1 1040 . 1 1 91 91 LYS HE2 H 1 2.962 0.020 . 2 . . . . 242 LYS HE2 . 16538 1 1041 . 1 1 91 91 LYS HE3 H 1 2.872 0.020 . 2 . . . . 242 LYS HE3 . 16538 1 1042 . 1 1 91 91 LYS HG2 H 1 1.413 0.020 . 2 . . . . 242 LYS HG2 . 16538 1 1043 . 1 1 91 91 LYS HG3 H 1 1.413 0.020 . 2 . . . . 242 LYS HG3 . 16538 1 1044 . 1 1 91 91 LYS C C 13 177.720 0.400 . 1 . . . . 242 LYS C . 16538 1 1045 . 1 1 91 91 LYS CA C 13 59.135 0.400 . 1 . . . . 242 LYS CA . 16538 1 1046 . 1 1 91 91 LYS CB C 13 31.944 0.400 . 1 . . . . 242 LYS CB . 16538 1 1047 . 1 1 91 91 LYS CD C 13 28.821 0.400 . 1 . . . . 242 LYS CD . 16538 1 1048 . 1 1 91 91 LYS CE C 13 42.043 0.400 . 1 . . . . 242 LYS CE . 16538 1 1049 . 1 1 91 91 LYS CG C 13 25.264 0.400 . 1 . . . . 242 LYS CG . 16538 1 1050 . 1 1 91 91 LYS N N 15 120.920 0.400 . 1 . . . . 242 LYS N . 16538 1 1051 . 1 1 92 92 LEU H H 1 8.257 0.020 . 1 . . . . 243 LEU H . 16538 1 1052 . 1 1 92 92 LEU HA H 1 3.840 0.020 . 1 . . . . 243 LEU HA . 16538 1 1053 . 1 1 92 92 LEU HB2 H 1 1.838 0.020 . 2 . . . . 243 LEU HB2 . 16538 1 1054 . 1 1 92 92 LEU HB3 H 1 1.239 0.020 . 2 . . . . 243 LEU HB3 . 16538 1 1055 . 1 1 92 92 LEU HD11 H 1 0.743 0.020 . 2 . . . . 243 LEU HD1 . 16538 1 1056 . 1 1 92 92 LEU HD12 H 1 0.743 0.020 . 2 . . . . 243 LEU HD1 . 16538 1 1057 . 1 1 92 92 LEU HD13 H 1 0.743 0.020 . 2 . . . . 243 LEU HD1 . 16538 1 1058 . 1 1 92 92 LEU HD21 H 1 0.328 0.020 . 2 . . . . 243 LEU HD2 . 16538 1 1059 . 1 1 92 92 LEU HD22 H 1 0.328 0.020 . 2 . . . . 243 LEU HD2 . 16538 1 1060 . 1 1 92 92 LEU HD23 H 1 0.328 0.020 . 2 . . . . 243 LEU HD2 . 16538 1 1061 . 1 1 92 92 LEU HG H 1 1.535 0.020 . 1 . . . . 243 LEU HG . 16538 1 1062 . 1 1 92 92 LEU C C 13 178.288 0.400 . 1 . . . . 243 LEU C . 16538 1 1063 . 1 1 92 92 LEU CA C 13 58.324 0.400 . 1 . . . . 243 LEU CA . 16538 1 1064 . 1 1 92 92 LEU CB C 13 42.958 0.400 . 1 . . . . 243 LEU CB . 16538 1 1065 . 1 1 92 92 LEU CD1 C 13 24.196 0.400 . 1 . . . . 243 LEU CD1 . 16538 1 1066 . 1 1 92 92 LEU CD2 C 13 24.720 0.400 . 1 . . . . 243 LEU CD2 . 16538 1 1067 . 1 1 92 92 LEU CG C 13 27.299 0.400 . 1 . . . . 243 LEU CG . 16538 1 1068 . 1 1 92 92 LEU N N 15 119.801 0.400 . 1 . . . . 243 LEU N . 16538 1 1069 . 1 1 93 93 LEU H H 1 8.275 0.020 . 1 . . . . 244 LEU H . 16538 1 1070 . 1 1 93 93 LEU HA H 1 3.941 0.020 . 1 . . . . 244 LEU HA . 16538 1 1071 . 1 1 93 93 LEU HB2 H 1 2.013 0.020 . 2 . . . . 244 LEU HB2 . 16538 1 1072 . 1 1 93 93 LEU HB3 H 1 1.177 0.020 . 2 . . . . 244 LEU HB3 . 16538 1 1073 . 1 1 93 93 LEU HD11 H 1 0.675 0.020 . 2 . . . . 244 LEU HD1 . 16538 1 1074 . 1 1 93 93 LEU HD12 H 1 0.675 0.020 . 2 . . . . 244 LEU HD1 . 16538 1 1075 . 1 1 93 93 LEU HD13 H 1 0.675 0.020 . 2 . . . . 244 LEU HD1 . 16538 1 1076 . 1 1 93 93 LEU HD21 H 1 0.538 0.020 . 2 . . . . 244 LEU HD2 . 16538 1 1077 . 1 1 93 93 LEU HD22 H 1 0.538 0.020 . 2 . . . . 244 LEU HD2 . 16538 1 1078 . 1 1 93 93 LEU HD23 H 1 0.538 0.020 . 2 . . . . 244 LEU HD2 . 16538 1 1079 . 1 1 93 93 LEU HG H 1 1.841 0.020 . 1 . . . . 244 LEU HG . 16538 1 1080 . 1 1 93 93 LEU C C 13 179.912 0.400 . 1 . . . . 244 LEU C . 16538 1 1081 . 1 1 93 93 LEU CA C 13 58.378 0.400 . 1 . . . . 244 LEU CA . 16538 1 1082 . 1 1 93 93 LEU CB C 13 41.644 0.400 . 1 . . . . 244 LEU CB . 16538 1 1083 . 1 1 93 93 LEU CD1 C 13 23.714 0.400 . 1 . . . . 244 LEU CD1 . 16538 1 1084 . 1 1 93 93 LEU CD2 C 13 26.086 0.400 . 1 . . . . 244 LEU CD2 . 16538 1 1085 . 1 1 93 93 LEU CG C 13 27.544 0.400 . 1 . . . . 244 LEU CG . 16538 1 1086 . 1 1 93 93 LEU N N 15 115.123 0.400 . 1 . . . . 244 LEU N . 16538 1 1087 . 1 1 94 94 LYS H H 1 7.663 0.020 . 1 . . . . 245 LYS H . 16538 1 1088 . 1 1 94 94 LYS HA H 1 4.075 0.020 . 1 . . . . 245 LYS HA . 16538 1 1089 . 1 1 94 94 LYS HB2 H 1 2.037 0.020 . 2 . . . . 245 LYS HB2 . 16538 1 1090 . 1 1 94 94 LYS HB3 H 1 2.036 0.020 . 2 . . . . 245 LYS HB3 . 16538 1 1091 . 1 1 94 94 LYS HD2 H 1 1.708 0.020 . 2 . . . . 245 LYS HD2 . 16538 1 1092 . 1 1 94 94 LYS HD3 H 1 1.703 0.020 . 2 . . . . 245 LYS HD3 . 16538 1 1093 . 1 1 94 94 LYS HE2 H 1 3.006 0.020 . 2 . . . . 245 LYS HE2 . 16538 1 1094 . 1 1 94 94 LYS HE3 H 1 3.008 0.020 . 2 . . . . 245 LYS HE3 . 16538 1 1095 . 1 1 94 94 LYS HG2 H 1 1.619 0.020 . 2 . . . . 245 LYS HG2 . 16538 1 1096 . 1 1 94 94 LYS HG3 H 1 1.536 0.020 . 2 . . . . 245 LYS HG3 . 16538 1 1097 . 1 1 94 94 LYS C C 13 178.223 0.400 . 1 . . . . 245 LYS C . 16538 1 1098 . 1 1 94 94 LYS CA C 13 58.907 0.400 . 1 . . . . 245 LYS CA . 16538 1 1099 . 1 1 94 94 LYS CB C 13 32.371 0.400 . 1 . . . . 245 LYS CB . 16538 1 1100 . 1 1 94 94 LYS CD C 13 29.107 0.400 . 1 . . . . 245 LYS CD . 16538 1 1101 . 1 1 94 94 LYS CE C 13 41.996 0.400 . 1 . . . . 245 LYS CE . 16538 1 1102 . 1 1 94 94 LYS CG C 13 25.180 0.400 . 1 . . . . 245 LYS CG . 16538 1 1103 . 1 1 94 94 LYS N N 15 119.877 0.400 . 1 . . . . 245 LYS N . 16538 1 1104 . 1 1 95 95 ASP H H 1 8.306 0.020 . 1 . . . . 246 ASP H . 16538 1 1105 . 1 1 95 95 ASP HA H 1 4.704 0.020 . 1 . . . . 246 ASP HA . 16538 1 1106 . 1 1 95 95 ASP HB2 H 1 2.810 0.020 . 2 . . . . 246 ASP HB2 . 16538 1 1107 . 1 1 95 95 ASP HB3 H 1 2.610 0.020 . 2 . . . . 246 ASP HB3 . 16538 1 1108 . 1 1 95 95 ASP C C 13 177.460 0.400 . 1 . . . . 246 ASP C . 16538 1 1109 . 1 1 95 95 ASP CA C 13 54.709 0.400 . 1 . . . . 246 ASP CA . 16538 1 1110 . 1 1 95 95 ASP CB C 13 40.200 0.400 . 1 . . . . 246 ASP CB . 16538 1 1111 . 1 1 95 95 ASP N N 15 117.873 0.400 . 1 . . . . 246 ASP N . 16538 1 1112 . 1 1 96 96 LEU H H 1 7.490 0.020 . 1 . . . . 247 LEU H . 16538 1 1113 . 1 1 96 96 LEU HA H 1 4.048 0.020 . 1 . . . . 247 LEU HA . 16538 1 1114 . 1 1 96 96 LEU HB2 H 1 2.174 0.020 . 2 . . . . 247 LEU HB2 . 16538 1 1115 . 1 1 96 96 LEU HB3 H 1 1.297 0.020 . 2 . . . . 247 LEU HB3 . 16538 1 1116 . 1 1 96 96 LEU HD11 H 1 0.851 0.020 . 2 . . . . 247 LEU HD1 . 16538 1 1117 . 1 1 96 96 LEU HD12 H 1 0.851 0.020 . 2 . . . . 247 LEU HD1 . 16538 1 1118 . 1 1 96 96 LEU HD13 H 1 0.851 0.020 . 2 . . . . 247 LEU HD1 . 16538 1 1119 . 1 1 96 96 LEU HD21 H 1 0.737 0.020 . 2 . . . . 247 LEU HD2 . 16538 1 1120 . 1 1 96 96 LEU HD22 H 1 0.737 0.020 . 2 . . . . 247 LEU HD2 . 16538 1 1121 . 1 1 96 96 LEU HD23 H 1 0.737 0.020 . 2 . . . . 247 LEU HD2 . 16538 1 1122 . 1 1 96 96 LEU HG H 1 1.941 0.020 . 1 . . . . 247 LEU HG . 16538 1 1123 . 1 1 96 96 LEU CA C 13 59.393 0.400 . 1 . . . . 247 LEU CA . 16538 1 1124 . 1 1 96 96 LEU CB C 13 41.253 0.400 . 1 . . . . 247 LEU CB . 16538 1 1125 . 1 1 96 96 LEU CD1 C 13 26.459 0.400 . 1 . . . . 247 LEU CD1 . 16538 1 1126 . 1 1 96 96 LEU CD2 C 13 25.488 0.400 . 1 . . . . 247 LEU CD2 . 16538 1 1127 . 1 1 96 96 LEU CG C 13 27.717 0.400 . 1 . . . . 247 LEU CG . 16538 1 1128 . 1 1 96 96 LEU N N 15 123.251 0.400 . 1 . . . . 247 LEU N . 16538 1 1129 . 1 1 97 97 PRO HA H 1 4.099 0.020 . 1 . . . . 248 PRO HA . 16538 1 1130 . 1 1 97 97 PRO HB2 H 1 2.308 0.020 . 2 . . . . 248 PRO HB2 . 16538 1 1131 . 1 1 97 97 PRO HB3 H 1 1.886 0.020 . 2 . . . . 248 PRO HB3 . 16538 1 1132 . 1 1 97 97 PRO HD2 H 1 3.785 0.020 . 2 . . . . 248 PRO HD2 . 16538 1 1133 . 1 1 97 97 PRO HD3 H 1 3.522 0.020 . 2 . . . . 248 PRO HD3 . 16538 1 1134 . 1 1 97 97 PRO HG2 H 1 2.235 0.020 . 2 . . . . 248 PRO HG2 . 16538 1 1135 . 1 1 97 97 PRO HG3 H 1 2.002 0.020 . 2 . . . . 248 PRO HG3 . 16538 1 1136 . 1 1 97 97 PRO C C 13 178.588 0.400 . 1 . . . . 248 PRO C . 16538 1 1137 . 1 1 97 97 PRO CA C 13 66.555 0.400 . 1 . . . . 248 PRO CA . 16538 1 1138 . 1 1 97 97 PRO CB C 13 30.858 0.400 . 1 . . . . 248 PRO CB . 16538 1 1139 . 1 1 97 97 PRO CD C 13 50.373 0.400 . 1 . . . . 248 PRO CD . 16538 1 1140 . 1 1 98 98 GLU H H 1 7.428 0.020 . 1 . . . . 249 GLU H . 16538 1 1141 . 1 1 98 98 GLU HA H 1 4.157 0.020 . 1 . . . . 249 GLU HA . 16538 1 1142 . 1 1 98 98 GLU HB2 H 1 2.154 0.020 . 2 . . . . 249 GLU HB2 . 16538 1 1143 . 1 1 98 98 GLU HB3 H 1 2.078 0.020 . 2 . . . . 249 GLU HB3 . 16538 1 1144 . 1 1 98 98 GLU HG2 H 1 2.242 0.020 . 2 . . . . 249 GLU HG2 . 16538 1 1145 . 1 1 98 98 GLU HG3 H 1 2.242 0.020 . 2 . . . . 249 GLU HG3 . 16538 1 1146 . 1 1 98 98 GLU C C 13 179.839 0.400 . 1 . . . . 249 GLU C . 16538 1 1147 . 1 1 98 98 GLU CA C 13 58.813 0.400 . 1 . . . . 249 GLU CA . 16538 1 1148 . 1 1 98 98 GLU CB C 13 29.507 0.400 . 1 . . . . 249 GLU CB . 16538 1 1149 . 1 1 98 98 GLU CG C 13 36.740 0.400 . 1 . . . . 249 GLU CG . 16538 1 1150 . 1 1 98 98 GLU N N 15 115.281 0.400 . 1 . . . . 249 GLU N . 16538 1 1151 . 1 1 99 99 LEU H H 1 8.149 0.020 . 1 . . . . 250 LEU H . 16538 1 1152 . 1 1 99 99 LEU HA H 1 4.162 0.020 . 1 . . . . 250 LEU HA . 16538 1 1153 . 1 1 99 99 LEU HB2 H 1 1.806 0.020 . 2 . . . . 250 LEU HB2 . 16538 1 1154 . 1 1 99 99 LEU HB3 H 1 1.261 0.020 . 2 . . . . 250 LEU HB3 . 16538 1 1155 . 1 1 99 99 LEU HD11 H 1 0.854 0.020 . 2 . . . . 250 LEU HD1 . 16538 1 1156 . 1 1 99 99 LEU HD12 H 1 0.854 0.020 . 2 . . . . 250 LEU HD1 . 16538 1 1157 . 1 1 99 99 LEU HD13 H 1 0.854 0.020 . 2 . . . . 250 LEU HD1 . 16538 1 1158 . 1 1 99 99 LEU HD21 H 1 0.746 0.020 . 2 . . . . 250 LEU HD2 . 16538 1 1159 . 1 1 99 99 LEU HD22 H 1 0.746 0.020 . 2 . . . . 250 LEU HD2 . 16538 1 1160 . 1 1 99 99 LEU HD23 H 1 0.746 0.020 . 2 . . . . 250 LEU HD2 . 16538 1 1161 . 1 1 99 99 LEU HG H 1 1.715 0.020 . 1 . . . . 250 LEU HG . 16538 1 1162 . 1 1 99 99 LEU C C 13 179.498 0.400 . 1 . . . . 250 LEU C . 16538 1 1163 . 1 1 99 99 LEU CA C 13 57.672 0.400 . 1 . . . . 250 LEU CA . 16538 1 1164 . 1 1 99 99 LEU CB C 13 42.503 0.400 . 1 . . . . 250 LEU CB . 16538 1 1165 . 1 1 99 99 LEU CD1 C 13 22.460 0.400 . 1 . . . . 250 LEU CD1 . 16538 1 1166 . 1 1 99 99 LEU CD2 C 13 25.153 0.400 . 1 . . . . 250 LEU CD2 . 16538 1 1167 . 1 1 99 99 LEU CG C 13 26.796 0.400 . 1 . . . . 250 LEU CG . 16538 1 1168 . 1 1 99 99 LEU N N 15 121.557 0.400 . 1 . . . . 250 LEU N . 16538 1 1169 . 1 1 100 100 ALA H H 1 8.613 0.020 . 1 . . . . 251 ALA H . 16538 1 1170 . 1 1 100 100 ALA HA H 1 4.472 0.020 . 1 . . . . 251 ALA HA . 16538 1 1171 . 1 1 100 100 ALA HB1 H 1 1.341 0.020 . 1 . . . . 251 ALA HB . 16538 1 1172 . 1 1 100 100 ALA HB2 H 1 1.341 0.020 . 1 . . . . 251 ALA HB . 16538 1 1173 . 1 1 100 100 ALA HB3 H 1 1.341 0.020 . 1 . . . . 251 ALA HB . 16538 1 1174 . 1 1 100 100 ALA C C 13 177.922 0.400 . 1 . . . . 251 ALA C . 16538 1 1175 . 1 1 100 100 ALA CA C 13 52.213 0.400 . 1 . . . . 251 ALA CA . 16538 1 1176 . 1 1 100 100 ALA CB C 13 18.286 0.400 . 1 . . . . 251 ALA CB . 16538 1 1177 . 1 1 100 100 ALA N N 15 117.655 0.400 . 1 . . . . 251 ALA N . 16538 1 1178 . 1 1 101 101 LEU H H 1 7.177 0.020 . 1 . . . . 252 LEU H . 16538 1 1179 . 1 1 101 101 LEU HA H 1 4.045 0.020 . 1 . . . . 252 LEU HA . 16538 1 1180 . 1 1 101 101 LEU HB2 H 1 1.849 0.020 . 2 . . . . 252 LEU HB2 . 16538 1 1181 . 1 1 101 101 LEU HB3 H 1 1.484 0.020 . 2 . . . . 252 LEU HB3 . 16538 1 1182 . 1 1 101 101 LEU HD11 H 1 0.953 0.020 . 2 . . . . 252 LEU HD1 . 16538 1 1183 . 1 1 101 101 LEU HD12 H 1 0.953 0.020 . 2 . . . . 252 LEU HD1 . 16538 1 1184 . 1 1 101 101 LEU HD13 H 1 0.953 0.020 . 2 . . . . 252 LEU HD1 . 16538 1 1185 . 1 1 101 101 LEU HD21 H 1 0.853 0.020 . 2 . . . . 252 LEU HD2 . 16538 1 1186 . 1 1 101 101 LEU HD22 H 1 0.853 0.020 . 2 . . . . 252 LEU HD2 . 16538 1 1187 . 1 1 101 101 LEU HD23 H 1 0.853 0.020 . 2 . . . . 252 LEU HD2 . 16538 1 1188 . 1 1 101 101 LEU HG H 1 1.942 0.020 . 1 . . . . 252 LEU HG . 16538 1 1189 . 1 1 101 101 LEU C C 13 178.431 0.400 . 1 . . . . 252 LEU C . 16538 1 1190 . 1 1 101 101 LEU CA C 13 57.444 0.400 . 1 . . . . 252 LEU CA . 16538 1 1191 . 1 1 101 101 LEU CB C 13 41.466 0.400 . 1 . . . . 252 LEU CB . 16538 1 1192 . 1 1 101 101 LEU CD1 C 13 25.263 0.400 . 1 . . . . 252 LEU CD1 . 16538 1 1193 . 1 1 101 101 LEU CD2 C 13 22.686 0.400 . 1 . . . . 252 LEU CD2 . 16538 1 1194 . 1 1 101 101 LEU CG C 13 26.408 0.400 . 1 . . . . 252 LEU CG . 16538 1 1195 . 1 1 101 101 LEU N N 15 117.498 0.400 . 1 . . . . 252 LEU N . 16538 1 1196 . 1 1 102 102 ASP H H 1 7.263 0.020 . 1 . . . . 253 ASP H . 16538 1 1197 . 1 1 102 102 ASP HA H 1 4.784 0.020 . 1 . . . . 253 ASP HA . 16538 1 1198 . 1 1 102 102 ASP HB2 H 1 2.719 0.020 . 2 . . . . 253 ASP HB2 . 16538 1 1199 . 1 1 102 102 ASP HB3 H 1 2.645 0.020 . 2 . . . . 253 ASP HB3 . 16538 1 1200 . 1 1 102 102 ASP C C 13 176.502 0.400 . 1 . . . . 253 ASP C . 16538 1 1201 . 1 1 102 102 ASP CA C 13 55.265 0.400 . 1 . . . . 253 ASP CA . 16538 1 1202 . 1 1 102 102 ASP CB C 13 42.059 0.400 . 1 . . . . 253 ASP CB . 16538 1 1203 . 1 1 102 102 ASP N N 15 115.360 0.400 . 1 . . . . 253 ASP N . 16538 1 1204 . 1 1 103 103 THR H H 1 7.579 0.020 . 1 . . . . 254 THR H . 16538 1 1205 . 1 1 103 103 THR HA H 1 4.687 0.020 . 1 . . . . 254 THR HA . 16538 1 1206 . 1 1 103 103 THR HB H 1 3.988 0.020 . 1 . . . . 254 THR HB . 16538 1 1207 . 1 1 103 103 THR HG21 H 1 1.104 0.020 . 1 . . . . 254 THR HG2 . 16538 1 1208 . 1 1 103 103 THR HG22 H 1 1.104 0.020 . 1 . . . . 254 THR HG2 . 16538 1 1209 . 1 1 103 103 THR HG23 H 1 1.104 0.020 . 1 . . . . 254 THR HG2 . 16538 1 1210 . 1 1 103 103 THR CA C 13 58.928 0.400 . 1 . . . . 254 THR CA . 16538 1 1211 . 1 1 103 103 THR CB C 13 69.435 0.400 . 1 . . . . 254 THR CB . 16538 1 1212 . 1 1 103 103 THR CG2 C 13 21.784 0.400 . 1 . . . . 254 THR CG2 . 16538 1 1213 . 1 1 103 103 THR N N 15 115.256 0.400 . 1 . . . . 254 THR N . 16538 1 1214 . 1 1 104 104 PRO HA H 1 4.603 0.020 . 1 . . . . 255 PRO HA . 16538 1 1215 . 1 1 104 104 PRO HB2 H 1 2.441 0.020 . 2 . . . . 255 PRO HB2 . 16538 1 1216 . 1 1 104 104 PRO HB3 H 1 1.944 0.020 . 2 . . . . 255 PRO HB3 . 16538 1 1217 . 1 1 104 104 PRO HD2 H 1 3.845 0.020 . 2 . . . . 255 PRO HD2 . 16538 1 1218 . 1 1 104 104 PRO HD3 H 1 3.525 0.020 . 2 . . . . 255 PRO HD3 . 16538 1 1219 . 1 1 104 104 PRO HG2 H 1 2.076 0.020 . 2 . . . . 255 PRO HG2 . 16538 1 1220 . 1 1 104 104 PRO HG3 H 1 2.007 0.020 . 2 . . . . 255 PRO HG3 . 16538 1 1221 . 1 1 104 104 PRO C C 13 178.016 0.400 . 1 . . . . 255 PRO C . 16538 1 1222 . 1 1 104 104 PRO CA C 13 65.207 0.400 . 1 . . . . 255 PRO CA . 16538 1 1223 . 1 1 104 104 PRO CB C 13 32.155 0.400 . 1 . . . . 255 PRO CB . 16538 1 1224 . 1 1 104 104 PRO CD C 13 50.651 0.400 . 1 . . . . 255 PRO CD . 16538 1 1225 . 1 1 104 104 PRO CG C 13 27.315 0.400 . 1 . . . . 255 PRO CG . 16538 1 1226 . 1 1 105 105 ARG H H 1 8.214 0.020 . 1 . . . . 256 ARG H . 16538 1 1227 . 1 1 105 105 ARG HA H 1 4.674 0.020 . 1 . . . . 256 ARG HA . 16538 1 1228 . 1 1 105 105 ARG HB2 H 1 2.111 0.020 . 2 . . . . 256 ARG HB2 . 16538 1 1229 . 1 1 105 105 ARG HB3 H 1 1.699 0.020 . 2 . . . . 256 ARG HB3 . 16538 1 1230 . 1 1 105 105 ARG HD2 H 1 3.185 0.020 . 2 . . . . 256 ARG HD2 . 16538 1 1231 . 1 1 105 105 ARG HD3 H 1 3.184 0.020 . 2 . . . . 256 ARG HD3 . 16538 1 1232 . 1 1 105 105 ARG HG2 H 1 1.671 0.020 . 2 . . . . 256 ARG HG2 . 16538 1 1233 . 1 1 105 105 ARG HG3 H 1 1.673 0.020 . 2 . . . . 256 ARG HG3 . 16538 1 1234 . 1 1 105 105 ARG C C 13 176.168 0.400 . 1 . . . . 256 ARG C . 16538 1 1235 . 1 1 105 105 ARG CA C 13 55.540 0.400 . 1 . . . . 256 ARG CA . 16538 1 1236 . 1 1 105 105 ARG CB C 13 29.101 0.400 . 1 . . . . 256 ARG CB . 16538 1 1237 . 1 1 105 105 ARG CD C 13 43.253 0.400 . 1 . . . . 256 ARG CD . 16538 1 1238 . 1 1 105 105 ARG CG C 13 27.777 0.400 . 1 . . . . 256 ARG CG . 16538 1 1239 . 1 1 105 105 ARG N N 15 113.116 0.400 . 1 . . . . 256 ARG N . 16538 1 1240 . 1 1 106 106 ALA H H 1 8.725 0.020 . 1 . . . . 257 ALA H . 16538 1 1241 . 1 1 106 106 ALA HA H 1 4.080 0.020 . 1 . . . . 257 ALA HA . 16538 1 1242 . 1 1 106 106 ALA HB1 H 1 1.373 0.020 . 1 . . . . 257 ALA HB . 16538 1 1243 . 1 1 106 106 ALA HB2 H 1 1.373 0.020 . 1 . . . . 257 ALA HB . 16538 1 1244 . 1 1 106 106 ALA HB3 H 1 1.373 0.020 . 1 . . . . 257 ALA HB . 16538 1 1245 . 1 1 106 106 ALA CA C 13 57.037 0.400 . 1 . . . . 257 ALA CA . 16538 1 1246 . 1 1 106 106 ALA CB C 13 16.345 0.400 . 1 . . . . 257 ALA CB . 16538 1 1247 . 1 1 106 106 ALA N N 15 121.075 0.400 . 1 . . . . 257 ALA N . 16538 1 1248 . 1 1 107 107 PRO C C 13 178.100 0.400 . 1 . . . . 258 PRO C . 16538 1 1249 . 1 1 107 107 PRO CA C 13 67.155 0.400 . 1 . . . . 258 PRO CA . 16538 1 1250 . 1 1 107 107 PRO CB C 13 30.503 0.400 . 1 . . . . 258 PRO CB . 16538 1 1251 . 1 1 108 108 GLN H H 1 7.777 0.020 . 1 . . . . 259 GLN H . 16538 1 1252 . 1 1 108 108 GLN HA H 1 3.785 0.020 . 1 . . . . 259 GLN HA . 16538 1 1253 . 1 1 108 108 GLN HB2 H 1 2.309 0.020 . 2 . . . . 259 GLN HB2 . 16538 1 1254 . 1 1 108 108 GLN HB3 H 1 2.035 0.020 . 2 . . . . 259 GLN HB3 . 16538 1 1255 . 1 1 108 108 GLN HG2 H 1 2.650 0.020 . 2 . . . . 259 GLN HG2 . 16538 1 1256 . 1 1 108 108 GLN HG3 H 1 2.254 0.020 . 2 . . . . 259 GLN HG3 . 16538 1 1257 . 1 1 108 108 GLN C C 13 178.561 0.400 . 1 . . . . 259 GLN C . 16538 1 1258 . 1 1 108 108 GLN CA C 13 60.584 0.400 . 1 . . . . 259 GLN CA . 16538 1 1259 . 1 1 108 108 GLN CB C 13 27.505 0.400 . 1 . . . . 259 GLN CB . 16538 1 1260 . 1 1 108 108 GLN CG C 13 35.091 0.400 . 1 . . . . 259 GLN CG . 16538 1 1261 . 1 1 108 108 GLN N N 15 116.183 0.400 . 1 . . . . 259 GLN N . 16538 1 1262 . 1 1 109 109 LEU H H 1 8.157 0.020 . 1 . . . . 260 LEU H . 16538 1 1263 . 1 1 109 109 LEU C C 13 180.090 0.400 . 1 . . . . 260 LEU C . 16538 1 1264 . 1 1 109 109 LEU CA C 13 57.737 0.400 . 1 . . . . 260 LEU CA . 16538 1 1265 . 1 1 109 109 LEU CB C 13 42.675 0.400 . 1 . . . . 260 LEU CB . 16538 1 1266 . 1 1 109 109 LEU N N 15 119.703 0.400 . 1 . . . . 260 LEU N . 16538 1 1267 . 1 1 110 110 VAL H H 1 9.280 0.020 . 1 . . . . 261 VAL H . 16538 1 1268 . 1 1 110 110 VAL HA H 1 3.986 0.020 . 1 . . . . 261 VAL HA . 16538 1 1269 . 1 1 110 110 VAL HB H 1 2.243 0.020 . 1 . . . . 261 VAL HB . 16538 1 1270 . 1 1 110 110 VAL HG11 H 1 1.065 0.020 . 2 . . . . 261 VAL HG1 . 16538 1 1271 . 1 1 110 110 VAL HG12 H 1 1.065 0.020 . 2 . . . . 261 VAL HG1 . 16538 1 1272 . 1 1 110 110 VAL HG13 H 1 1.065 0.020 . 2 . . . . 261 VAL HG1 . 16538 1 1273 . 1 1 110 110 VAL HG21 H 1 0.963 0.020 . 2 . . . . 261 VAL HG2 . 16538 1 1274 . 1 1 110 110 VAL HG22 H 1 0.963 0.020 . 2 . . . . 261 VAL HG2 . 16538 1 1275 . 1 1 110 110 VAL HG23 H 1 0.963 0.020 . 2 . . . . 261 VAL HG2 . 16538 1 1276 . 1 1 110 110 VAL C C 13 177.995 0.400 . 1 . . . . 261 VAL C . 16538 1 1277 . 1 1 110 110 VAL CA C 13 68.329 0.400 . 1 . . . . 261 VAL CA . 16538 1 1278 . 1 1 110 110 VAL CB C 13 30.951 0.400 . 1 . . . . 261 VAL CB . 16538 1 1279 . 1 1 110 110 VAL CG1 C 13 24.763 0.400 . 1 . . . . 261 VAL CG1 . 16538 1 1280 . 1 1 110 110 VAL CG2 C 13 21.473 0.400 . 1 . . . . 261 VAL CG2 . 16538 1 1281 . 1 1 110 110 VAL N N 15 120.549 0.400 . 1 . . . . 261 VAL N . 16538 1 1282 . 1 1 111 111 GLY H H 1 8.567 0.020 . 1 . . . . 262 GLY H . 16538 1 1283 . 1 1 111 111 GLY HA2 H 1 3.868 0.020 . 2 . . . . 262 GLY HA2 . 16538 1 1284 . 1 1 111 111 GLY HA3 H 1 3.795 0.020 . 2 . . . . 262 GLY HA3 . 16538 1 1285 . 1 1 111 111 GLY C C 13 175.038 0.400 . 1 . . . . 262 GLY C . 16538 1 1286 . 1 1 111 111 GLY CA C 13 48.603 0.400 . 1 . . . . 262 GLY CA . 16538 1 1287 . 1 1 111 111 GLY N N 15 108.570 0.400 . 1 . . . . 262 GLY N . 16538 1 1288 . 1 1 112 112 GLN H H 1 7.861 0.020 . 1 . . . . 263 GLN H . 16538 1 1289 . 1 1 112 112 GLN HA H 1 3.788 0.020 . 1 . . . . 263 GLN HA . 16538 1 1290 . 1 1 112 112 GLN HB2 H 1 2.031 0.020 . 2 . . . . 263 GLN HB2 . 16538 1 1291 . 1 1 112 112 GLN HB3 H 1 2.039 0.020 . 2 . . . . 263 GLN HB3 . 16538 1 1292 . 1 1 112 112 GLN HG2 H 1 2.158 0.020 . 2 . . . . 263 GLN HG2 . 16538 1 1293 . 1 1 112 112 GLN HG3 H 1 1.828 0.020 . 2 . . . . 263 GLN HG3 . 16538 1 1294 . 1 1 112 112 GLN C C 13 178.201 0.400 . 1 . . . . 263 GLN C . 16538 1 1295 . 1 1 112 112 GLN CA C 13 59.382 0.400 . 1 . . . . 263 GLN CA . 16538 1 1296 . 1 1 112 112 GLN CB C 13 28.058 0.400 . 1 . . . . 263 GLN CB . 16538 1 1297 . 1 1 112 112 GLN CG C 13 34.177 0.400 . 1 . . . . 263 GLN CG . 16538 1 1298 . 1 1 112 112 GLN N N 15 121.053 0.400 . 1 . . . . 263 GLN N . 16538 1 1299 . 1 1 113 113 PHE H H 1 8.264 0.020 . 1 . . . . 264 PHE H . 16538 1 1300 . 1 1 113 113 PHE HA H 1 4.208 0.020 . 1 . . . . 264 PHE HA . 16538 1 1301 . 1 1 113 113 PHE HB2 H 1 3.517 0.020 . 2 . . . . 264 PHE HB2 . 16538 1 1302 . 1 1 113 113 PHE HB3 H 1 3.164 0.020 . 2 . . . . 264 PHE HB3 . 16538 1 1303 . 1 1 113 113 PHE HD1 H 1 7.508 0.020 . 1 . . . . 264 PHE HD1 . 16538 1 1304 . 1 1 113 113 PHE HD2 H 1 7.508 0.020 . 1 . . . . 264 PHE HD2 . 16538 1 1305 . 1 1 113 113 PHE HE1 H 1 7.280 0.020 . 1 . . . . 264 PHE HE1 . 16538 1 1306 . 1 1 113 113 PHE HE2 H 1 7.280 0.020 . 1 . . . . 264 PHE HE2 . 16538 1 1307 . 1 1 113 113 PHE HZ H 1 6.947 0.020 . 1 . . . . 264 PHE HZ . 16538 1 1308 . 1 1 113 113 PHE C C 13 179.329 0.400 . 1 . . . . 264 PHE C . 16538 1 1309 . 1 1 113 113 PHE CA C 13 64.060 0.400 . 1 . . . . 264 PHE CA . 16538 1 1310 . 1 1 113 113 PHE CB C 13 39.072 0.400 . 1 . . . . 264 PHE CB . 16538 1 1311 . 1 1 113 113 PHE N N 15 118.733 0.400 . 1 . . . . 264 PHE N . 16538 1 1312 . 1 1 114 114 ILE H H 1 8.621 0.020 . 1 . . . . 265 ILE H . 16538 1 1313 . 1 1 114 114 ILE HA H 1 2.969 0.020 . 1 . . . . 265 ILE HA . 16538 1 1314 . 1 1 114 114 ILE HB H 1 1.840 0.020 . 1 . . . . 265 ILE HB . 16538 1 1315 . 1 1 114 114 ILE HD11 H 1 0.735 0.020 . 1 . . . . 265 ILE HD1 . 16538 1 1316 . 1 1 114 114 ILE HD12 H 1 0.735 0.020 . 1 . . . . 265 ILE HD1 . 16538 1 1317 . 1 1 114 114 ILE HD13 H 1 0.735 0.020 . 1 . . . . 265 ILE HD1 . 16538 1 1318 . 1 1 114 114 ILE HG12 H 1 1.804 0.020 . 2 . . . . 265 ILE HG12 . 16538 1 1319 . 1 1 114 114 ILE HG13 H 1 1.802 0.020 . 2 . . . . 265 ILE HG13 . 16538 1 1320 . 1 1 114 114 ILE HG21 H 1 0.547 0.020 . 1 . . . . 265 ILE HG2 . 16538 1 1321 . 1 1 114 114 ILE HG22 H 1 0.547 0.020 . 1 . . . . 265 ILE HG2 . 16538 1 1322 . 1 1 114 114 ILE HG23 H 1 0.547 0.020 . 1 . . . . 265 ILE HG2 . 16538 1 1323 . 1 1 114 114 ILE C C 13 176.598 0.400 . 1 . . . . 265 ILE C . 16538 1 1324 . 1 1 114 114 ILE CA C 13 65.643 0.400 . 1 . . . . 265 ILE CA . 16538 1 1325 . 1 1 114 114 ILE CB C 13 37.875 0.400 . 1 . . . . 265 ILE CB . 16538 1 1326 . 1 1 114 114 ILE CD1 C 13 14.188 0.400 . 1 . . . . 265 ILE CD1 . 16538 1 1327 . 1 1 114 114 ILE CG1 C 13 30.290 0.400 . 1 . . . . 265 ILE CG1 . 16538 1 1328 . 1 1 114 114 ILE CG2 C 13 16.743 0.400 . 1 . . . . 265 ILE CG2 . 16538 1 1329 . 1 1 114 114 ILE N N 15 120.352 0.400 . 1 . . . . 265 ILE N . 16538 1 1330 . 1 1 115 115 ALA H H 1 8.242 0.020 . 1 . . . . 266 ALA H . 16538 1 1331 . 1 1 115 115 ALA HA H 1 3.838 0.020 . 1 . . . . 266 ALA HA . 16538 1 1332 . 1 1 115 115 ALA HB1 H 1 1.481 0.020 . 1 . . . . 266 ALA HB . 16538 1 1333 . 1 1 115 115 ALA HB2 H 1 1.481 0.020 . 1 . . . . 266 ALA HB . 16538 1 1334 . 1 1 115 115 ALA HB3 H 1 1.481 0.020 . 1 . . . . 266 ALA HB . 16538 1 1335 . 1 1 115 115 ALA C C 13 180.580 0.400 . 1 . . . . 266 ALA C . 16538 1 1336 . 1 1 115 115 ALA CA C 13 55.540 0.400 . 1 . . . . 266 ALA CA . 16538 1 1337 . 1 1 115 115 ALA CB C 13 19.253 0.400 . 1 . . . . 266 ALA CB . 16538 1 1338 . 1 1 115 115 ALA N N 15 120.878 0.400 . 1 . . . . 266 ALA N . 16538 1 1339 . 1 1 116 116 ARG H H 1 8.230 0.020 . 1 . . . . 267 ARG H . 16538 1 1340 . 1 1 116 116 ARG C C 13 176.696 0.400 . 1 . . . . 267 ARG C . 16538 1 1341 . 1 1 116 116 ARG CA C 13 57.685 0.400 . 1 . . . . 267 ARG CA . 16538 1 1342 . 1 1 116 116 ARG CB C 13 29.475 0.400 . 1 . . . . 267 ARG CB . 16538 1 1343 . 1 1 116 116 ARG N N 15 119.030 0.400 . 1 . . . . 267 ARG N . 16538 1 1344 . 1 1 117 117 ALA H H 1 8.058 0.020 . 1 . . . . 268 ALA H . 16538 1 1345 . 1 1 117 117 ALA HA H 1 4.163 0.020 . 1 . . . . 268 ALA HA . 16538 1 1346 . 1 1 117 117 ALA HB1 H 1 1.320 0.020 . 1 . . . . 268 ALA HB . 16538 1 1347 . 1 1 117 117 ALA HB2 H 1 1.320 0.020 . 1 . . . . 268 ALA HB . 16538 1 1348 . 1 1 117 117 ALA HB3 H 1 1.320 0.020 . 1 . . . . 268 ALA HB . 16538 1 1349 . 1 1 117 117 ALA C C 13 179.951 0.400 . 1 . . . . 268 ALA C . 16538 1 1350 . 1 1 117 117 ALA CA C 13 54.929 0.400 . 1 . . . . 268 ALA CA . 16538 1 1351 . 1 1 117 117 ALA CB C 13 18.041 0.400 . 1 . . . . 268 ALA CB . 16538 1 1352 . 1 1 117 117 ALA N N 15 122.043 0.400 . 1 . . . . 268 ALA N . 16538 1 1353 . 1 1 118 118 VAL H H 1 8.365 0.020 . 1 . . . . 269 VAL H . 16538 1 1354 . 1 1 118 118 VAL HA H 1 4.138 0.020 . 1 . . . . 269 VAL HA . 16538 1 1355 . 1 1 118 118 VAL HB H 1 2.132 0.020 . 1 . . . . 269 VAL HB . 16538 1 1356 . 1 1 118 118 VAL HG11 H 1 0.913 0.020 . 2 . . . . 269 VAL HG1 . 16538 1 1357 . 1 1 118 118 VAL HG12 H 1 0.913 0.020 . 2 . . . . 269 VAL HG1 . 16538 1 1358 . 1 1 118 118 VAL HG13 H 1 0.913 0.020 . 2 . . . . 269 VAL HG1 . 16538 1 1359 . 1 1 118 118 VAL HG21 H 1 0.864 0.020 . 2 . . . . 269 VAL HG2 . 16538 1 1360 . 1 1 118 118 VAL HG22 H 1 0.864 0.020 . 2 . . . . 269 VAL HG2 . 16538 1 1361 . 1 1 118 118 VAL HG23 H 1 0.864 0.020 . 2 . . . . 269 VAL HG2 . 16538 1 1362 . 1 1 118 118 VAL C C 13 181.568 0.400 . 1 . . . . 269 VAL C . 16538 1 1363 . 1 1 118 118 VAL CA C 13 65.225 0.400 . 1 . . . . 269 VAL CA . 16538 1 1364 . 1 1 118 118 VAL CB C 13 31.729 0.400 . 1 . . . . 269 VAL CB . 16538 1 1365 . 1 1 118 118 VAL CG2 C 13 22.165 0.400 . 1 . . . . 269 VAL CG2 . 16538 1 1366 . 1 1 118 118 VAL N N 15 119.632 0.400 . 1 . . . . 269 VAL N . 16538 1 1367 . 1 1 119 119 GLY H H 1 8.409 0.020 . 1 . . . . 270 GLY H . 16538 1 1368 . 1 1 119 119 GLY HA2 H 1 3.933 0.020 . 2 . . . . 270 GLY HA2 . 16538 1 1369 . 1 1 119 119 GLY HA3 H 1 3.789 0.020 . 2 . . . . 270 GLY HA3 . 16538 1 1370 . 1 1 119 119 GLY C C 13 175.823 0.400 . 1 . . . . 270 GLY C . 16538 1 1371 . 1 1 119 119 GLY CA C 13 47.468 0.400 . 1 . . . . 270 GLY CA . 16538 1 1372 . 1 1 119 119 GLY N N 15 110.417 0.400 . 1 . . . . 270 GLY N . 16538 1 1373 . 1 1 120 120 ASP H H 1 8.499 0.020 . 1 . . . . 271 ASP H . 16538 1 1374 . 1 1 120 120 ASP HA H 1 4.684 0.020 . 1 . . . . 271 ASP HA . 16538 1 1375 . 1 1 120 120 ASP HB2 H 1 2.898 0.020 . 2 . . . . 271 ASP HB2 . 16538 1 1376 . 1 1 120 120 ASP HB3 H 1 2.722 0.020 . 2 . . . . 271 ASP HB3 . 16538 1 1377 . 1 1 120 120 ASP C C 13 176.922 0.400 . 1 . . . . 271 ASP C . 16538 1 1378 . 1 1 120 120 ASP CA C 13 55.155 0.400 . 1 . . . . 271 ASP CA . 16538 1 1379 . 1 1 120 120 ASP CB C 13 41.351 0.400 . 1 . . . . 271 ASP CB . 16538 1 1380 . 1 1 120 120 ASP N N 15 119.234 0.400 . 1 . . . . 271 ASP N . 16538 1 1381 . 1 1 121 121 GLY H H 1 8.001 0.020 . 1 . . . . 272 GLY H . 16538 1 1382 . 1 1 121 121 GLY HA2 H 1 4.155 0.020 . 2 . . . . 272 GLY HA2 . 16538 1 1383 . 1 1 121 121 GLY HA3 H 1 4.025 0.020 . 2 . . . . 272 GLY HA3 . 16538 1 1384 . 1 1 121 121 GLY C C 13 175.065 0.400 . 1 . . . . 272 GLY C . 16538 1 1385 . 1 1 121 121 GLY CA C 13 45.696 0.400 . 1 . . . . 272 GLY CA . 16538 1 1386 . 1 1 121 121 GLY N N 15 108.177 0.400 . 1 . . . . 272 GLY N . 16538 1 1387 . 1 1 122 122 ILE H H 1 7.740 0.020 . 1 . . . . 273 ILE H . 16538 1 1388 . 1 1 122 122 ILE HA H 1 4.421 0.020 . 1 . . . . 273 ILE HA . 16538 1 1389 . 1 1 122 122 ILE HB H 1 2.349 0.020 . 1 . . . . 273 ILE HB . 16538 1 1390 . 1 1 122 122 ILE HD11 H 1 0.858 0.020 . 1 . . . . 273 ILE HD1 . 16538 1 1391 . 1 1 122 122 ILE HD12 H 1 0.858 0.020 . 1 . . . . 273 ILE HD1 . 16538 1 1392 . 1 1 122 122 ILE HD13 H 1 0.858 0.020 . 1 . . . . 273 ILE HD1 . 16538 1 1393 . 1 1 122 122 ILE HG12 H 1 1.332 0.020 . 2 . . . . 273 ILE HG12 . 16538 1 1394 . 1 1 122 122 ILE HG13 H 1 1.262 0.020 . 2 . . . . 273 ILE HG13 . 16538 1 1395 . 1 1 122 122 ILE HG21 H 1 0.943 0.020 . 1 . . . . 273 ILE HG2 . 16538 1 1396 . 1 1 122 122 ILE HG22 H 1 0.943 0.020 . 1 . . . . 273 ILE HG2 . 16538 1 1397 . 1 1 122 122 ILE HG23 H 1 0.943 0.020 . 1 . . . . 273 ILE HG2 . 16538 1 1398 . 1 1 122 122 ILE C C 13 173.166 0.400 . 1 . . . . 273 ILE C . 16538 1 1399 . 1 1 122 122 ILE CA C 13 61.879 0.400 . 1 . . . . 273 ILE CA . 16538 1 1400 . 1 1 122 122 ILE CB C 13 37.933 0.400 . 1 . . . . 273 ILE CB . 16538 1 1401 . 1 1 122 122 ILE CD1 C 13 14.802 0.400 . 1 . . . . 273 ILE CD1 . 16538 1 1402 . 1 1 122 122 ILE CG1 C 13 26.912 0.400 . 1 . . . . 273 ILE CG1 . 16538 1 1403 . 1 1 122 122 ILE CG2 C 13 18.981 0.400 . 1 . . . . 273 ILE CG2 . 16538 1 1404 . 1 1 122 122 ILE N N 15 112.496 0.400 . 1 . . . . 273 ILE N . 16538 1 1405 . 1 1 123 123 LEU H H 1 6.674 0.020 . 1 . . . . 274 LEU H . 16538 1 1406 . 1 1 123 123 LEU HA H 1 4.429 0.020 . 1 . . . . 274 LEU HA . 16538 1 1407 . 1 1 123 123 LEU HB2 H 1 1.107 0.020 . 2 . . . . 274 LEU HB2 . 16538 1 1408 . 1 1 123 123 LEU HB3 H 1 0.849 0.020 . 2 . . . . 274 LEU HB3 . 16538 1 1409 . 1 1 123 123 LEU HD11 H 1 0.161 0.020 . 2 . . . . 274 LEU HD1 . 16538 1 1410 . 1 1 123 123 LEU HD12 H 1 0.161 0.020 . 2 . . . . 274 LEU HD1 . 16538 1 1411 . 1 1 123 123 LEU HD13 H 1 0.161 0.020 . 2 . . . . 274 LEU HD1 . 16538 1 1412 . 1 1 123 123 LEU HD21 H 1 0.163 0.020 . 2 . . . . 274 LEU HD2 . 16538 1 1413 . 1 1 123 123 LEU HD22 H 1 0.163 0.020 . 2 . . . . 274 LEU HD2 . 16538 1 1414 . 1 1 123 123 LEU HD23 H 1 0.163 0.020 . 2 . . . . 274 LEU HD2 . 16538 1 1415 . 1 1 123 123 LEU HG H 1 1.141 0.020 . 1 . . . . 274 LEU HG . 16538 1 1416 . 1 1 123 123 LEU C C 13 175.286 0.400 . 1 . . . . 274 LEU C . 16538 1 1417 . 1 1 123 123 LEU CA C 13 52.480 0.400 . 1 . . . . 274 LEU CA . 16538 1 1418 . 1 1 123 123 LEU CB C 13 47.122 0.400 . 1 . . . . 274 LEU CB . 16538 1 1419 . 1 1 123 123 LEU CD1 C 13 24.179 0.400 . 1 . . . . 274 LEU CD1 . 16538 1 1420 . 1 1 123 123 LEU CD2 C 13 24.195 0.400 . 1 . . . . 274 LEU CD2 . 16538 1 1421 . 1 1 123 123 LEU CG C 13 26.631 0.400 . 1 . . . . 274 LEU CG . 16538 1 1422 . 1 1 123 123 LEU N N 15 119.782 0.400 . 1 . . . . 274 LEU N . 16538 1 1423 . 1 1 124 124 CYS H H 1 8.751 0.020 . 1 . . . . 275 CYS H . 16538 1 1424 . 1 1 124 124 CYS HA H 1 4.416 0.020 . 1 . . . . 275 CYS HA . 16538 1 1425 . 1 1 124 124 CYS HB2 H 1 3.118 0.020 . 2 . . . . 275 CYS HB2 . 16538 1 1426 . 1 1 124 124 CYS HB3 H 1 2.995 0.020 . 2 . . . . 275 CYS HB3 . 16538 1 1427 . 1 1 124 124 CYS C C 13 175.588 0.400 . 1 . . . . 275 CYS C . 16538 1 1428 . 1 1 124 124 CYS CA C 13 58.120 0.400 . 1 . . . . 275 CYS CA . 16538 1 1429 . 1 1 124 124 CYS CB C 13 28.094 0.400 . 1 . . . . 275 CYS CB . 16538 1 1430 . 1 1 124 124 CYS N N 15 121.975 0.400 . 1 . . . . 275 CYS N . 16538 1 1431 . 1 1 125 125 ASN H H 1 9.044 0.020 . 1 . . . . 276 ASN H . 16538 1 1432 . 1 1 125 125 ASN HA H 1 4.253 0.020 . 1 . . . . 276 ASN HA . 16538 1 1433 . 1 1 125 125 ASN HB2 H 1 2.933 0.020 . 2 . . . . 276 ASN HB2 . 16538 1 1434 . 1 1 125 125 ASN HB3 H 1 2.855 0.020 . 2 . . . . 276 ASN HB3 . 16538 1 1435 . 1 1 125 125 ASN C C 13 176.706 0.400 . 1 . . . . 276 ASN C . 16538 1 1436 . 1 1 125 125 ASN CA C 13 56.318 0.400 . 1 . . . . 276 ASN CA . 16538 1 1437 . 1 1 125 125 ASN CB C 13 37.662 0.400 . 1 . . . . 276 ASN CB . 16538 1 1438 . 1 1 125 125 ASN N N 15 121.464 0.400 . 1 . . . . 276 ASN N . 16538 1 1439 . 1 1 126 126 THR H H 1 7.647 0.020 . 1 . . . . 277 THR H . 16538 1 1440 . 1 1 126 126 THR HA H 1 4.379 0.020 . 1 . . . . 277 THR HA . 16538 1 1441 . 1 1 126 126 THR HB H 1 4.476 0.020 . 1 . . . . 277 THR HB . 16538 1 1442 . 1 1 126 126 THR HG21 H 1 1.215 0.020 . 1 . . . . 277 THR HG2 . 16538 1 1443 . 1 1 126 126 THR HG22 H 1 1.215 0.020 . 1 . . . . 277 THR HG2 . 16538 1 1444 . 1 1 126 126 THR HG23 H 1 1.215 0.020 . 1 . . . . 277 THR HG2 . 16538 1 1445 . 1 1 126 126 THR C C 13 175.100 0.400 . 1 . . . . 277 THR C . 16538 1 1446 . 1 1 126 126 THR CA C 13 62.278 0.400 . 1 . . . . 277 THR CA . 16538 1 1447 . 1 1 126 126 THR CB C 13 68.895 0.400 . 1 . . . . 277 THR CB . 16538 1 1448 . 1 1 126 126 THR CG2 C 13 21.668 0.400 . 1 . . . . 277 THR CG2 . 16538 1 1449 . 1 1 126 126 THR N N 15 109.072 0.400 . 1 . . . . 277 THR N . 16538 1 1450 . 1 1 127 127 TYR H H 1 7.877 0.020 . 1 . . . . 278 TYR H . 16538 1 1451 . 1 1 127 127 TYR HA H 1 3.949 0.020 . 1 . . . . 278 TYR HA . 16538 1 1452 . 1 1 127 127 TYR HB2 H 1 3.404 0.020 . 2 . . . . 278 TYR HB2 . 16538 1 1453 . 1 1 127 127 TYR HB3 H 1 2.626 0.020 . 2 . . . . 278 TYR HB3 . 16538 1 1454 . 1 1 127 127 TYR HD1 H 1 6.785 0.020 . 1 . . . . 278 TYR HD1 . 16538 1 1455 . 1 1 127 127 TYR HD2 H 1 6.785 0.020 . 1 . . . . 278 TYR HD2 . 16538 1 1456 . 1 1 127 127 TYR HE1 H 1 6.668 0.020 . 1 . . . . 278 TYR HE1 . 16538 1 1457 . 1 1 127 127 TYR HE2 H 1 6.668 0.020 . 1 . . . . 278 TYR HE2 . 16538 1 1458 . 1 1 127 127 TYR C C 13 177.625 0.400 . 1 . . . . 278 TYR C . 16538 1 1459 . 1 1 127 127 TYR CA C 13 62.396 0.400 . 1 . . . . 278 TYR CA . 16538 1 1460 . 1 1 127 127 TYR CB C 13 39.766 0.400 . 1 . . . . 278 TYR CB . 16538 1 1461 . 1 1 127 127 TYR N N 15 125.424 0.400 . 1 . . . . 278 TYR N . 16538 1 1462 . 1 1 128 128 ILE H H 1 7.803 0.020 . 1 . . . . 279 ILE H . 16538 1 1463 . 1 1 128 128 ILE HA H 1 3.421 0.020 . 1 . . . . 279 ILE HA . 16538 1 1464 . 1 1 128 128 ILE HB H 1 1.828 0.020 . 1 . . . . 279 ILE HB . 16538 1 1465 . 1 1 128 128 ILE HD11 H 1 0.860 0.020 . 1 . . . . 279 ILE HD1 . 16538 1 1466 . 1 1 128 128 ILE HD12 H 1 0.860 0.020 . 1 . . . . 279 ILE HD1 . 16538 1 1467 . 1 1 128 128 ILE HD13 H 1 0.860 0.020 . 1 . . . . 279 ILE HD1 . 16538 1 1468 . 1 1 128 128 ILE HG12 H 1 1.656 0.020 . 2 . . . . 279 ILE HG12 . 16538 1 1469 . 1 1 128 128 ILE HG13 H 1 0.938 0.020 . 2 . . . . 279 ILE HG13 . 16538 1 1470 . 1 1 128 128 ILE HG21 H 1 0.874 0.020 . 1 . . . . 279 ILE HG2 . 16538 1 1471 . 1 1 128 128 ILE HG22 H 1 0.874 0.020 . 1 . . . . 279 ILE HG2 . 16538 1 1472 . 1 1 128 128 ILE HG23 H 1 0.874 0.020 . 1 . . . . 279 ILE HG2 . 16538 1 1473 . 1 1 128 128 ILE C C 13 178.005 0.400 . 1 . . . . 279 ILE C . 16538 1 1474 . 1 1 128 128 ILE CA C 13 65.096 0.400 . 1 . . . . 279 ILE CA . 16538 1 1475 . 1 1 128 128 ILE CB C 13 38.141 0.400 . 1 . . . . 279 ILE CB . 16538 1 1476 . 1 1 128 128 ILE CD1 C 13 15.114 0.400 . 1 . . . . 279 ILE CD1 . 16538 1 1477 . 1 1 128 128 ILE CG1 C 13 29.461 0.400 . 1 . . . . 279 ILE CG1 . 16538 1 1478 . 1 1 128 128 ILE CG2 C 13 17.986 0.400 . 1 . . . . 279 ILE CG2 . 16538 1 1479 . 1 1 128 128 ILE N N 15 116.054 0.400 . 1 . . . . 279 ILE N . 16538 1 1480 . 1 1 129 129 ASP H H 1 7.781 0.020 . 1 . . . . 280 ASP H . 16538 1 1481 . 1 1 129 129 ASP HA H 1 4.319 0.020 . 1 . . . . 280 ASP HA . 16538 1 1482 . 1 1 129 129 ASP HB2 H 1 2.595 0.020 . 2 . . . . 280 ASP HB2 . 16538 1 1483 . 1 1 129 129 ASP HB3 H 1 2.525 0.020 . 2 . . . . 280 ASP HB3 . 16538 1 1484 . 1 1 129 129 ASP C C 13 178.188 0.400 . 1 . . . . 280 ASP C . 16538 1 1485 . 1 1 129 129 ASP CA C 13 56.641 0.400 . 1 . . . . 280 ASP CA . 16538 1 1486 . 1 1 129 129 ASP CB C 13 40.728 0.400 . 1 . . . . 280 ASP CB . 16538 1 1487 . 1 1 129 129 ASP N N 15 118.322 0.400 . 1 . . . . 280 ASP N . 16538 1 1488 . 1 1 130 130 SER H H 1 7.901 0.020 . 1 . . . . 281 SER H . 16538 1 1489 . 1 1 130 130 SER HA H 1 4.192 0.020 . 1 . . . . 281 SER HA . 16538 1 1490 . 1 1 130 130 SER HB2 H 1 3.745 0.020 . 2 . . . . 281 SER HB2 . 16538 1 1491 . 1 1 130 130 SER HB3 H 1 3.741 0.020 . 2 . . . . 281 SER HB3 . 16538 1 1492 . 1 1 130 130 SER C C 13 174.575 0.400 . 1 . . . . 281 SER C . 16538 1 1493 . 1 1 130 130 SER CA C 13 59.997 0.400 . 1 . . . . 281 SER CA . 16538 1 1494 . 1 1 130 130 SER CB C 13 63.145 0.400 . 1 . . . . 281 SER CB . 16538 1 1495 . 1 1 130 130 SER N N 15 114.332 0.400 . 1 . . . . 281 SER N . 16538 1 1496 . 1 1 131 131 TYR H H 1 7.351 0.020 . 1 . . . . 282 TYR H . 16538 1 1497 . 1 1 131 131 TYR HA H 1 4.036 0.020 . 1 . . . . 282 TYR HA . 16538 1 1498 . 1 1 131 131 TYR HB2 H 1 2.786 0.020 . 2 . . . . 282 TYR HB2 . 16538 1 1499 . 1 1 131 131 TYR HB3 H 1 2.600 0.020 . 2 . . . . 282 TYR HB3 . 16538 1 1500 . 1 1 131 131 TYR HD1 H 1 6.807 0.020 . 1 . . . . 282 TYR HD1 . 16538 1 1501 . 1 1 131 131 TYR HD2 H 1 6.807 0.020 . 1 . . . . 282 TYR HD2 . 16538 1 1502 . 1 1 131 131 TYR HE1 H 1 6.563 0.020 . 1 . . . . 282 TYR HE1 . 16538 1 1503 . 1 1 131 131 TYR HE2 H 1 6.563 0.020 . 1 . . . . 282 TYR HE2 . 16538 1 1504 . 1 1 131 131 TYR C C 13 176.948 0.400 . 1 . . . . 282 TYR C . 16538 1 1505 . 1 1 131 131 TYR CA C 13 60.068 0.400 . 1 . . . . 282 TYR CA . 16538 1 1506 . 1 1 131 131 TYR CB C 13 38.772 0.400 . 1 . . . . 282 TYR CB . 16538 1 1507 . 1 1 131 131 TYR N N 15 122.244 0.400 . 1 . . . . 282 TYR N . 16538 1 1508 . 1 1 132 132 LYS H H 1 7.905 0.020 . 1 . . . . 283 LYS H . 16538 1 1509 . 1 1 132 132 LYS HA H 1 4.027 0.020 . 1 . . . . 283 LYS HA . 16538 1 1510 . 1 1 132 132 LYS HB2 H 1 1.745 0.020 . 2 . . . . 283 LYS HB2 . 16538 1 1511 . 1 1 132 132 LYS HB3 H 1 1.703 0.020 . 2 . . . . 283 LYS HB3 . 16538 1 1512 . 1 1 132 132 LYS HD2 H 1 1.599 0.020 . 2 . . . . 283 LYS HD2 . 16538 1 1513 . 1 1 132 132 LYS HD3 H 1 1.603 0.020 . 2 . . . . 283 LYS HD3 . 16538 1 1514 . 1 1 132 132 LYS HE2 H 1 2.883 0.020 . 2 . . . . 283 LYS HE2 . 16538 1 1515 . 1 1 132 132 LYS HE3 H 1 2.881 0.020 . 2 . . . . 283 LYS HE3 . 16538 1 1516 . 1 1 132 132 LYS HG2 H 1 1.432 0.020 . 2 . . . . 283 LYS HG2 . 16538 1 1517 . 1 1 132 132 LYS HG3 H 1 1.333 0.020 . 2 . . . . 283 LYS HG3 . 16538 1 1518 . 1 1 132 132 LYS C C 13 176.812 0.400 . 1 . . . . 283 LYS C . 16538 1 1519 . 1 1 132 132 LYS CA C 13 57.556 0.400 . 1 . . . . 283 LYS CA . 16538 1 1520 . 1 1 132 132 LYS CB C 13 32.665 0.400 . 1 . . . . 283 LYS CB . 16538 1 1521 . 1 1 132 132 LYS CD C 13 29.035 0.400 . 1 . . . . 283 LYS CD . 16538 1 1522 . 1 1 132 132 LYS CE C 13 41.811 0.400 . 1 . . . . 283 LYS CE . 16538 1 1523 . 1 1 132 132 LYS CG C 13 24.912 0.400 . 1 . . . . 283 LYS CG . 16538 1 1524 . 1 1 132 132 LYS N N 15 124.440 0.400 . 1 . . . . 283 LYS N . 16538 1 1525 . 1 1 133 133 GLY H H 1 7.667 0.020 . 1 . . . . 284 GLY H . 16538 1 1526 . 1 1 133 133 GLY HA2 H 1 3.989 0.020 . 2 . . . . 284 GLY HA2 . 16538 1 1527 . 1 1 133 133 GLY HA3 H 1 3.835 0.020 . 2 . . . . 284 GLY HA3 . 16538 1 1528 . 1 1 133 133 GLY C C 13 174.470 0.400 . 1 . . . . 284 GLY C . 16538 1 1529 . 1 1 133 133 GLY CA C 13 45.434 0.400 . 1 . . . . 284 GLY CA . 16538 1 1530 . 1 1 133 133 GLY N N 15 108.579 0.400 . 1 . . . . 284 GLY N . 16538 1 1531 . 1 1 134 134 THR H H 1 7.833 0.020 . 1 . . . . 285 THR H . 16538 1 1532 . 1 1 134 134 THR HA H 1 4.384 0.020 . 1 . . . . 285 THR HA . 16538 1 1533 . 1 1 134 134 THR HB H 1 4.260 0.020 . 1 . . . . 285 THR HB . 16538 1 1534 . 1 1 134 134 THR HG21 H 1 1.143 0.020 . 1 . . . . 285 THR HG2 . 16538 1 1535 . 1 1 134 134 THR HG22 H 1 1.143 0.020 . 1 . . . . 285 THR HG2 . 16538 1 1536 . 1 1 134 134 THR HG23 H 1 1.143 0.020 . 1 . . . . 285 THR HG2 . 16538 1 1537 . 1 1 134 134 THR C C 13 175.127 0.400 . 1 . . . . 285 THR C . 16538 1 1538 . 1 1 134 134 THR CA C 13 61.951 0.400 . 1 . . . . 285 THR CA . 16538 1 1539 . 1 1 134 134 THR CB C 13 69.864 0.400 . 1 . . . . 285 THR CB . 16538 1 1540 . 1 1 134 134 THR CG2 C 13 21.629 0.400 . 1 . . . . 285 THR CG2 . 16538 1 1541 . 1 1 134 134 THR N N 15 111.536 0.400 . 1 . . . . 285 THR N . 16538 1 1542 . 1 1 135 135 VAL H H 1 7.929 0.020 . 1 . . . . 286 VAL H . 16538 1 1543 . 1 1 135 135 VAL HA H 1 4.136 0.020 . 1 . . . . 286 VAL HA . 16538 1 1544 . 1 1 135 135 VAL HB H 1 2.121 0.020 . 1 . . . . 286 VAL HB . 16538 1 1545 . 1 1 135 135 VAL HG11 H 1 0.956 0.020 . 2 . . . . 286 VAL HG1 . 16538 1 1546 . 1 1 135 135 VAL HG12 H 1 0.956 0.020 . 2 . . . . 286 VAL HG1 . 16538 1 1547 . 1 1 135 135 VAL HG13 H 1 0.956 0.020 . 2 . . . . 286 VAL HG1 . 16538 1 1548 . 1 1 135 135 VAL HG21 H 1 0.958 0.020 . 2 . . . . 286 VAL HG2 . 16538 1 1549 . 1 1 135 135 VAL HG22 H 1 0.958 0.020 . 2 . . . . 286 VAL HG2 . 16538 1 1550 . 1 1 135 135 VAL HG23 H 1 0.958 0.020 . 2 . . . . 286 VAL HG2 . 16538 1 1551 . 1 1 135 135 VAL C C 13 175.372 0.400 . 1 . . . . 286 VAL C . 16538 1 1552 . 1 1 135 135 VAL CA C 13 62.360 0.400 . 1 . . . . 286 VAL CA . 16538 1 1553 . 1 1 135 135 VAL CB C 13 32.937 0.400 . 1 . . . . 286 VAL CB . 16538 1 1554 . 1 1 135 135 VAL CG1 C 13 21.365 0.400 . 1 . . . . 286 VAL CG1 . 16538 1 1555 . 1 1 135 135 VAL CG2 C 13 21.365 0.400 . 1 . . . . 286 VAL CG2 . 16538 1 1556 . 1 1 135 135 VAL N N 15 120.502 0.400 . 1 . . . . 286 VAL N . 16538 1 1557 . 1 1 136 136 ASP H H 1 8.491 0.020 . 1 . . . . 287 ASP H . 16538 1 1558 . 1 1 136 136 ASP HA H 1 4.622 0.020 . 1 . . . . 287 ASP HA . 16538 1 1559 . 1 1 136 136 ASP HB2 H 1 2.670 0.020 . 2 . . . . 287 ASP HB2 . 16538 1 1560 . 1 1 136 136 ASP HB3 H 1 2.618 0.020 . 2 . . . . 287 ASP HB3 . 16538 1 1561 . 1 1 136 136 ASP C C 13 175.692 0.400 . 1 . . . . 287 ASP C . 16538 1 1562 . 1 1 136 136 ASP CA C 13 54.402 0.400 . 1 . . . . 287 ASP CA . 16538 1 1563 . 1 1 136 136 ASP CB C 13 41.170 0.400 . 1 . . . . 287 ASP CB . 16538 1 1564 . 1 1 136 136 ASP N N 15 122.916 0.400 . 1 . . . . 287 ASP N . 16538 1 1565 . 1 1 137 137 CYS H H 1 7.646 0.020 . 1 . . . . 288 CYS H . 16538 1 1566 . 1 1 137 137 CYS C C 13 176.090 0.400 . 1 . . . . 288 CYS C . 16538 1 1567 . 1 1 137 137 CYS N N 15 120.838 0.400 . 1 . . . . 288 CYS N . 16538 1 1568 . 1 1 138 138 VAL H H 1 8.629 0.020 . 1 . . . . 289 VAL H . 16538 1 1569 . 1 1 138 138 VAL HA H 1 3.792 0.020 . 1 . . . . 289 VAL HA . 16538 1 1570 . 1 1 138 138 VAL HB H 1 2.122 0.020 . 1 . . . . 289 VAL HB . 16538 1 1571 . 1 1 138 138 VAL HG11 H 1 1.016 0.020 . 2 . . . . 289 VAL HG1 . 16538 1 1572 . 1 1 138 138 VAL HG12 H 1 1.016 0.020 . 2 . . . . 289 VAL HG1 . 16538 1 1573 . 1 1 138 138 VAL HG13 H 1 1.016 0.020 . 2 . . . . 289 VAL HG1 . 16538 1 1574 . 1 1 138 138 VAL HG21 H 1 1.019 0.020 . 2 . . . . 289 VAL HG2 . 16538 1 1575 . 1 1 138 138 VAL HG22 H 1 1.019 0.020 . 2 . . . . 289 VAL HG2 . 16538 1 1576 . 1 1 138 138 VAL HG23 H 1 1.019 0.020 . 2 . . . . 289 VAL HG2 . 16538 1 1577 . 1 1 138 138 VAL C C 13 178.550 0.400 . 1 . . . . 289 VAL C . 16538 1 1578 . 1 1 138 138 VAL CA C 13 65.556 0.400 . 1 . . . . 289 VAL CA . 16538 1 1579 . 1 1 138 138 VAL CB C 13 31.931 0.400 . 1 . . . . 289 VAL CB . 16538 1 1580 . 1 1 138 138 VAL CG1 C 13 20.916 0.400 . 1 . . . . 289 VAL CG1 . 16538 1 1581 . 1 1 138 138 VAL CG2 C 13 20.916 0.400 . 1 . . . . 289 VAL CG2 . 16538 1 1582 . 1 1 138 138 VAL N N 15 125.290 0.400 . 1 . . . . 289 VAL N . 16538 1 1583 . 1 1 139 139 GLN H H 1 8.920 0.020 . 1 . . . . 290 GLN H . 16538 1 1584 . 1 1 139 139 GLN N N 15 121.601 0.400 . 1 . . . . 290 GLN N . 16538 1 1585 . 1 1 140 140 ALA HA H 1 3.946 0.020 . 1 . . . . 291 ALA HA . 16538 1 1586 . 1 1 140 140 ALA HB1 H 1 1.498 0.020 . 1 . . . . 291 ALA HB . 16538 1 1587 . 1 1 140 140 ALA HB2 H 1 1.498 0.020 . 1 . . . . 291 ALA HB . 16538 1 1588 . 1 1 140 140 ALA HB3 H 1 1.498 0.020 . 1 . . . . 291 ALA HB . 16538 1 1589 . 1 1 140 140 ALA C C 13 179.164 0.400 . 1 . . . . 291 ALA C . 16538 1 1590 . 1 1 140 140 ALA CA C 13 55.080 0.400 . 1 . . . . 291 ALA CA . 16538 1 1591 . 1 1 140 140 ALA CB C 13 18.308 0.400 . 1 . . . . 291 ALA CB . 16538 1 1592 . 1 1 141 141 ARG H H 1 8.014 0.020 . 1 . . . . 292 ARG H . 16538 1 1593 . 1 1 141 141 ARG HA H 1 3.841 0.020 . 1 . . . . 292 ARG HA . 16538 1 1594 . 1 1 141 141 ARG HB2 H 1 1.922 0.020 . 2 . . . . 292 ARG HB2 . 16538 1 1595 . 1 1 141 141 ARG HB3 H 1 1.911 0.020 . 2 . . . . 292 ARG HB3 . 16538 1 1596 . 1 1 141 141 ARG HD2 H 1 3.290 0.020 . 2 . . . . 292 ARG HD2 . 16538 1 1597 . 1 1 141 141 ARG HD3 H 1 3.170 0.020 . 2 . . . . 292 ARG HD3 . 16538 1 1598 . 1 1 141 141 ARG HG2 H 1 1.706 0.020 . 2 . . . . 292 ARG HG2 . 16538 1 1599 . 1 1 141 141 ARG HG3 H 1 1.672 0.020 . 2 . . . . 292 ARG HG3 . 16538 1 1600 . 1 1 141 141 ARG C C 13 177.781 0.400 . 1 . . . . 292 ARG C . 16538 1 1601 . 1 1 141 141 ARG CA C 13 59.053 0.400 . 1 . . . . 292 ARG CA . 16538 1 1602 . 1 1 141 141 ARG CB C 13 30.168 0.400 . 1 . . . . 292 ARG CB . 16538 1 1603 . 1 1 141 141 ARG CD C 13 43.343 0.400 . 1 . . . . 292 ARG CD . 16538 1 1604 . 1 1 141 141 ARG CG C 13 26.732 0.400 . 1 . . . . 292 ARG CG . 16538 1 1605 . 1 1 141 141 ARG N N 15 116.788 0.400 . 1 . . . . 292 ARG N . 16538 1 1606 . 1 1 142 142 ALA H H 1 7.837 0.020 . 1 . . . . 293 ALA H . 16538 1 1607 . 1 1 142 142 ALA HA H 1 4.204 0.020 . 1 . . . . 293 ALA HA . 16538 1 1608 . 1 1 142 142 ALA HB1 H 1 1.501 0.020 . 1 . . . . 293 ALA HB . 16538 1 1609 . 1 1 142 142 ALA HB2 H 1 1.501 0.020 . 1 . . . . 293 ALA HB . 16538 1 1610 . 1 1 142 142 ALA HB3 H 1 1.501 0.020 . 1 . . . . 293 ALA HB . 16538 1 1611 . 1 1 142 142 ALA C C 13 181.003 0.400 . 1 . . . . 293 ALA C . 16538 1 1612 . 1 1 142 142 ALA CA C 13 55.076 0.400 . 1 . . . . 293 ALA CA . 16538 1 1613 . 1 1 142 142 ALA CB C 13 17.753 0.400 . 1 . . . . 293 ALA CB . 16538 1 1614 . 1 1 142 142 ALA N N 15 120.760 0.400 . 1 . . . . 293 ALA N . 16538 1 1615 . 1 1 143 143 ALA H H 1 7.887 0.020 . 1 . . . . 294 ALA H . 16538 1 1616 . 1 1 143 143 ALA HA H 1 4.045 0.020 . 1 . . . . 294 ALA HA . 16538 1 1617 . 1 1 143 143 ALA HB1 H 1 1.387 0.020 . 1 . . . . 294 ALA HB . 16538 1 1618 . 1 1 143 143 ALA HB2 H 1 1.387 0.020 . 1 . . . . 294 ALA HB . 16538 1 1619 . 1 1 143 143 ALA HB3 H 1 1.387 0.020 . 1 . . . . 294 ALA HB . 16538 1 1620 . 1 1 143 143 ALA C C 13 179.439 0.400 . 1 . . . . 294 ALA C . 16538 1 1621 . 1 1 143 143 ALA CA C 13 55.174 0.400 . 1 . . . . 294 ALA CA . 16538 1 1622 . 1 1 143 143 ALA CB C 13 19.653 0.400 . 1 . . . . 294 ALA CB . 16538 1 1623 . 1 1 143 143 ALA N N 15 122.237 0.400 . 1 . . . . 294 ALA N . 16538 1 1624 . 1 1 144 144 LEU H H 1 8.126 0.020 . 1 . . . . 295 LEU H . 16538 1 1625 . 1 1 144 144 LEU HA H 1 3.921 0.020 . 1 . . . . 295 LEU HA . 16538 1 1626 . 1 1 144 144 LEU HB2 H 1 1.849 0.020 . 2 . . . . 295 LEU HB2 . 16538 1 1627 . 1 1 144 144 LEU HB3 H 1 1.388 0.020 . 2 . . . . 295 LEU HB3 . 16538 1 1628 . 1 1 144 144 LEU HD11 H 1 0.741 0.020 . 2 . . . . 295 LEU HD1 . 16538 1 1629 . 1 1 144 144 LEU HD12 H 1 0.741 0.020 . 2 . . . . 295 LEU HD1 . 16538 1 1630 . 1 1 144 144 LEU HD13 H 1 0.741 0.020 . 2 . . . . 295 LEU HD1 . 16538 1 1631 . 1 1 144 144 LEU HD21 H 1 0.643 0.020 . 2 . . . . 295 LEU HD2 . 16538 1 1632 . 1 1 144 144 LEU HD22 H 1 0.643 0.020 . 2 . . . . 295 LEU HD2 . 16538 1 1633 . 1 1 144 144 LEU HD23 H 1 0.643 0.020 . 2 . . . . 295 LEU HD2 . 16538 1 1634 . 1 1 144 144 LEU HG H 1 1.700 0.020 . 1 . . . . 295 LEU HG . 16538 1 1635 . 1 1 144 144 LEU C C 13 179.690 0.400 . 1 . . . . 295 LEU C . 16538 1 1636 . 1 1 144 144 LEU CA C 13 57.814 0.400 . 1 . . . . 295 LEU CA . 16538 1 1637 . 1 1 144 144 LEU CB C 13 41.359 0.400 . 1 . . . . 295 LEU CB . 16538 1 1638 . 1 1 144 144 LEU CD1 C 13 22.723 0.400 . 1 . . . . 295 LEU CD1 . 16538 1 1639 . 1 1 144 144 LEU CD2 C 13 26.105 0.400 . 1 . . . . 295 LEU CD2 . 16538 1 1640 . 1 1 144 144 LEU CG C 13 26.888 0.400 . 1 . . . . 295 LEU CG . 16538 1 1641 . 1 1 144 144 LEU N N 15 118.447 0.400 . 1 . . . . 295 LEU N . 16538 1 1642 . 1 1 145 145 ASP H H 1 8.935 0.020 . 1 . . . . 296 ASP H . 16538 1 1643 . 1 1 145 145 ASP HA H 1 4.355 0.020 . 1 . . . . 296 ASP HA . 16538 1 1644 . 1 1 145 145 ASP HB2 H 1 2.739 0.020 . 2 . . . . 296 ASP HB2 . 16538 1 1645 . 1 1 145 145 ASP HB3 H 1 2.623 0.020 . 2 . . . . 296 ASP HB3 . 16538 1 1646 . 1 1 145 145 ASP C C 13 178.659 0.400 . 1 . . . . 296 ASP C . 16538 1 1647 . 1 1 145 145 ASP CA C 13 57.526 0.400 . 1 . . . . 296 ASP CA . 16538 1 1648 . 1 1 145 145 ASP CB C 13 39.959 0.400 . 1 . . . . 296 ASP CB . 16538 1 1649 . 1 1 145 145 ASP N N 15 122.177 0.400 . 1 . . . . 296 ASP N . 16538 1 1650 . 1 1 146 146 LYS H H 1 7.895 0.020 . 1 . . . . 297 LYS H . 16538 1 1651 . 1 1 146 146 LYS HA H 1 4.204 0.020 . 1 . . . . 297 LYS HA . 16538 1 1652 . 1 1 146 146 LYS HB2 H 1 2.133 0.020 . 2 . . . . 297 LYS HB2 . 16538 1 1653 . 1 1 146 146 LYS HB3 H 1 1.972 0.020 . 2 . . . . 297 LYS HB3 . 16538 1 1654 . 1 1 146 146 LYS HD2 H 1 1.817 0.020 . 2 . . . . 297 LYS HD2 . 16538 1 1655 . 1 1 146 146 LYS HD3 H 1 1.683 0.020 . 2 . . . . 297 LYS HD3 . 16538 1 1656 . 1 1 146 146 LYS HE2 H 1 2.880 0.020 . 2 . . . . 297 LYS HE2 . 16538 1 1657 . 1 1 146 146 LYS HE3 H 1 2.741 0.020 . 2 . . . . 297 LYS HE3 . 16538 1 1658 . 1 1 146 146 LYS HG2 H 1 1.832 0.020 . 2 . . . . 297 LYS HG2 . 16538 1 1659 . 1 1 146 146 LYS HG3 H 1 1.204 0.020 . 2 . . . . 297 LYS HG3 . 16538 1 1660 . 1 1 146 146 LYS C C 13 177.773 0.400 . 1 . . . . 297 LYS C . 16538 1 1661 . 1 1 146 146 LYS CA C 13 57.628 0.400 . 1 . . . . 297 LYS CA . 16538 1 1662 . 1 1 146 146 LYS CB C 13 30.767 0.400 . 1 . . . . 297 LYS CB . 16538 1 1663 . 1 1 146 146 LYS CD C 13 27.944 0.400 . 1 . . . . 297 LYS CD . 16538 1 1664 . 1 1 146 146 LYS CE C 13 41.881 0.400 . 1 . . . . 297 LYS CE . 16538 1 1665 . 1 1 146 146 LYS CG C 13 23.794 0.400 . 1 . . . . 297 LYS CG . 16538 1 1666 . 1 1 146 146 LYS N N 15 120.859 0.400 . 1 . . . . 297 LYS N . 16538 1 1667 . 1 1 147 147 ALA H H 1 8.229 0.020 . 1 . . . . 298 ALA H . 16538 1 1668 . 1 1 147 147 ALA HA H 1 3.869 0.020 . 1 . . . . 298 ALA HA . 16538 1 1669 . 1 1 147 147 ALA HB1 H 1 1.559 0.020 . 1 . . . . 298 ALA HB . 16538 1 1670 . 1 1 147 147 ALA HB2 H 1 1.559 0.020 . 1 . . . . 298 ALA HB . 16538 1 1671 . 1 1 147 147 ALA HB3 H 1 1.559 0.020 . 1 . . . . 298 ALA HB . 16538 1 1672 . 1 1 147 147 ALA C C 13 178.740 0.400 . 1 . . . . 298 ALA C . 16538 1 1673 . 1 1 147 147 ALA CA C 13 55.522 0.400 . 1 . . . . 298 ALA CA . 16538 1 1674 . 1 1 147 147 ALA CB C 13 18.530 0.400 . 1 . . . . 298 ALA CB . 16538 1 1675 . 1 1 147 147 ALA N N 15 120.415 0.400 . 1 . . . . 298 ALA N . 16538 1 1676 . 1 1 148 148 THR H H 1 8.201 0.020 . 1 . . . . 299 THR H . 16538 1 1677 . 1 1 148 148 THR HA H 1 3.758 0.020 . 1 . . . . 299 THR HA . 16538 1 1678 . 1 1 148 148 THR HB H 1 4.425 0.020 . 1 . . . . 299 THR HB . 16538 1 1679 . 1 1 148 148 THR HG21 H 1 1.201 0.020 . 1 . . . . 299 THR HG2 . 16538 1 1680 . 1 1 148 148 THR HG22 H 1 1.201 0.020 . 1 . . . . 299 THR HG2 . 16538 1 1681 . 1 1 148 148 THR HG23 H 1 1.201 0.020 . 1 . . . . 299 THR HG2 . 16538 1 1682 . 1 1 148 148 THR C C 13 177.212 0.400 . 1 . . . . 299 THR C . 16538 1 1683 . 1 1 148 148 THR CA C 13 67.474 0.400 . 1 . . . . 299 THR CA . 16538 1 1684 . 1 1 148 148 THR CB C 13 68.761 0.400 . 1 . . . . 299 THR CB . 16538 1 1685 . 1 1 148 148 THR CG2 C 13 21.054 0.400 . 1 . . . . 299 THR CG2 . 16538 1 1686 . 1 1 148 148 THR N N 15 113.498 0.400 . 1 . . . . 299 THR N . 16538 1 1687 . 1 1 149 149 VAL H H 1 7.957 0.020 . 1 . . . . 300 VAL H . 16538 1 1688 . 1 1 149 149 VAL HA H 1 3.707 0.020 . 1 . . . . 300 VAL HA . 16538 1 1689 . 1 1 149 149 VAL HB H 1 2.185 0.020 . 1 . . . . 300 VAL HB . 16538 1 1690 . 1 1 149 149 VAL HG11 H 1 1.047 0.020 . 2 . . . . 300 VAL HG1 . 16538 1 1691 . 1 1 149 149 VAL HG12 H 1 1.047 0.020 . 2 . . . . 300 VAL HG1 . 16538 1 1692 . 1 1 149 149 VAL HG13 H 1 1.047 0.020 . 2 . . . . 300 VAL HG1 . 16538 1 1693 . 1 1 149 149 VAL HG21 H 1 0.940 0.020 . 2 . . . . 300 VAL HG2 . 16538 1 1694 . 1 1 149 149 VAL HG22 H 1 0.940 0.020 . 2 . . . . 300 VAL HG2 . 16538 1 1695 . 1 1 149 149 VAL HG23 H 1 0.940 0.020 . 2 . . . . 300 VAL HG2 . 16538 1 1696 . 1 1 149 149 VAL C C 13 179.325 0.400 . 1 . . . . 300 VAL C . 16538 1 1697 . 1 1 149 149 VAL CA C 13 66.444 0.400 . 1 . . . . 300 VAL CA . 16538 1 1698 . 1 1 149 149 VAL CB C 13 31.718 0.400 . 1 . . . . 300 VAL CB . 16538 1 1699 . 1 1 149 149 VAL CG1 C 13 22.650 0.400 . 1 . . . . 300 VAL CG1 . 16538 1 1700 . 1 1 149 149 VAL CG2 C 13 21.122 0.400 . 1 . . . . 300 VAL CG2 . 16538 1 1701 . 1 1 149 149 VAL N N 15 122.947 0.400 . 1 . . . . 300 VAL N . 16538 1 1702 . 1 1 150 150 LEU H H 1 8.211 0.020 . 1 . . . . 301 LEU H . 16538 1 1703 . 1 1 150 150 LEU HA H 1 4.018 0.020 . 1 . . . . 301 LEU HA . 16538 1 1704 . 1 1 150 150 LEU HB2 H 1 1.831 0.020 . 2 . . . . 301 LEU HB2 . 16538 1 1705 . 1 1 150 150 LEU HB3 H 1 1.255 0.020 . 2 . . . . 301 LEU HB3 . 16538 1 1706 . 1 1 150 150 LEU HD11 H 1 0.804 0.020 . 2 . . . . 301 LEU HD1 . 16538 1 1707 . 1 1 150 150 LEU HD12 H 1 0.804 0.020 . 2 . . . . 301 LEU HD1 . 16538 1 1708 . 1 1 150 150 LEU HD13 H 1 0.804 0.020 . 2 . . . . 301 LEU HD1 . 16538 1 1709 . 1 1 150 150 LEU HD21 H 1 0.711 0.020 . 2 . . . . 301 LEU HD2 . 16538 1 1710 . 1 1 150 150 LEU HD22 H 1 0.711 0.020 . 2 . . . . 301 LEU HD2 . 16538 1 1711 . 1 1 150 150 LEU HD23 H 1 0.711 0.020 . 2 . . . . 301 LEU HD2 . 16538 1 1712 . 1 1 150 150 LEU HG H 1 1.793 0.020 . 1 . . . . 301 LEU HG . 16538 1 1713 . 1 1 150 150 LEU C C 13 180.570 0.400 . 1 . . . . 301 LEU C . 16538 1 1714 . 1 1 150 150 LEU CA C 13 57.914 0.400 . 1 . . . . 301 LEU CA . 16538 1 1715 . 1 1 150 150 LEU CB C 13 41.418 0.400 . 1 . . . . 301 LEU CB . 16538 1 1716 . 1 1 150 150 LEU CD1 C 13 22.505 0.400 . 1 . . . . 301 LEU CD1 . 16538 1 1717 . 1 1 150 150 LEU CD2 C 13 26.749 0.400 . 1 . . . . 301 LEU CD2 . 16538 1 1718 . 1 1 150 150 LEU CG C 13 26.816 0.400 . 1 . . . . 301 LEU CG . 16538 1 1719 . 1 1 150 150 LEU N N 15 121.063 0.400 . 1 . . . . 301 LEU N . 16538 1 1720 . 1 1 151 151 LEU H H 1 8.356 0.020 . 1 . . . . 302 LEU H . 16538 1 1721 . 1 1 151 151 LEU HA H 1 4.134 0.020 . 1 . . . . 302 LEU HA . 16538 1 1722 . 1 1 151 151 LEU HB2 H 1 1.864 0.020 . 2 . . . . 302 LEU HB2 . 16538 1 1723 . 1 1 151 151 LEU HB3 H 1 1.511 0.020 . 2 . . . . 302 LEU HB3 . 16538 1 1724 . 1 1 151 151 LEU HD11 H 1 0.950 0.020 . 2 . . . . 302 LEU HD1 . 16538 1 1725 . 1 1 151 151 LEU HD12 H 1 0.950 0.020 . 2 . . . . 302 LEU HD1 . 16538 1 1726 . 1 1 151 151 LEU HD13 H 1 0.950 0.020 . 2 . . . . 302 LEU HD1 . 16538 1 1727 . 1 1 151 151 LEU HD21 H 1 0.840 0.020 . 2 . . . . 302 LEU HD2 . 16538 1 1728 . 1 1 151 151 LEU HD22 H 1 0.840 0.020 . 2 . . . . 302 LEU HD2 . 16538 1 1729 . 1 1 151 151 LEU HD23 H 1 0.840 0.020 . 2 . . . . 302 LEU HD2 . 16538 1 1730 . 1 1 151 151 LEU HG H 1 1.723 0.020 . 1 . . . . 302 LEU HG . 16538 1 1731 . 1 1 151 151 LEU C C 13 179.205 0.400 . 1 . . . . 302 LEU C . 16538 1 1732 . 1 1 151 151 LEU CA C 13 57.258 0.400 . 1 . . . . 302 LEU CA . 16538 1 1733 . 1 1 151 151 LEU CB C 13 41.888 0.400 . 1 . . . . 302 LEU CB . 16538 1 1734 . 1 1 151 151 LEU CD1 C 13 22.501 0.400 . 1 . . . . 302 LEU CD1 . 16538 1 1735 . 1 1 151 151 LEU CD2 C 13 25.669 0.400 . 1 . . . . 302 LEU CD2 . 16538 1 1736 . 1 1 151 151 LEU CG C 13 27.315 0.400 . 1 . . . . 302 LEU CG . 16538 1 1737 . 1 1 151 151 LEU N N 15 119.829 0.400 . 1 . . . . 302 LEU N . 16538 1 1738 . 1 1 152 152 SER H H 1 7.966 0.020 . 1 . . . . 303 SER H . 16538 1 1739 . 1 1 152 152 SER HA H 1 4.315 0.020 . 1 . . . . 303 SER HA . 16538 1 1740 . 1 1 152 152 SER HB2 H 1 4.001 0.020 . 2 . . . . 303 SER HB2 . 16538 1 1741 . 1 1 152 152 SER HB3 H 1 4.002 0.020 . 2 . . . . 303 SER HB3 . 16538 1 1742 . 1 1 152 152 SER C C 13 175.739 0.400 . 1 . . . . 303 SER C . 16538 1 1743 . 1 1 152 152 SER CA C 13 60.585 0.400 . 1 . . . . 303 SER CA . 16538 1 1744 . 1 1 152 152 SER CB C 13 63.218 0.400 . 1 . . . . 303 SER CB . 16538 1 1745 . 1 1 152 152 SER N N 15 115.503 0.400 . 1 . . . . 303 SER N . 16538 1 1746 . 1 1 153 153 MET H H 1 7.750 0.020 . 1 . . . . 304 MET H . 16538 1 1747 . 1 1 153 153 MET HA H 1 4.394 0.020 . 1 . . . . 304 MET HA . 16538 1 1748 . 1 1 153 153 MET HB2 H 1 2.149 0.020 . 2 . . . . 304 MET HB2 . 16538 1 1749 . 1 1 153 153 MET HB3 H 1 2.084 0.020 . 2 . . . . 304 MET HB3 . 16538 1 1750 . 1 1 153 153 MET HE1 H 1 2.027 0.020 . 1 . . . . 304 MET HE . 16538 1 1751 . 1 1 153 153 MET HE2 H 1 2.027 0.020 . 1 . . . . 304 MET HE . 16538 1 1752 . 1 1 153 153 MET HE3 H 1 2.027 0.020 . 1 . . . . 304 MET HE . 16538 1 1753 . 1 1 153 153 MET HG2 H 1 2.720 0.020 . 2 . . . . 304 MET HG2 . 16538 1 1754 . 1 1 153 153 MET HG3 H 1 2.566 0.020 . 2 . . . . 304 MET HG3 . 16538 1 1755 . 1 1 153 153 MET C C 13 176.871 0.400 . 1 . . . . 304 MET C . 16538 1 1756 . 1 1 153 153 MET CA C 13 56.596 0.400 . 1 . . . . 304 MET CA . 16538 1 1757 . 1 1 153 153 MET CB C 13 32.985 0.400 . 1 . . . . 304 MET CB . 16538 1 1758 . 1 1 153 153 MET CE C 13 16.937 0.400 . 1 . . . . 304 MET CE . 16538 1 1759 . 1 1 153 153 MET CG C 13 31.982 0.400 . 1 . . . . 304 MET CG . 16538 1 1760 . 1 1 153 153 MET N N 15 120.053 0.400 . 1 . . . . 304 MET N . 16538 1 1761 . 1 1 154 154 SER H H 1 7.881 0.020 . 1 . . . . 305 SER H . 16538 1 1762 . 1 1 154 154 SER HA H 1 4.424 0.020 . 1 . . . . 305 SER HA . 16538 1 1763 . 1 1 154 154 SER HB2 H 1 3.912 0.020 . 2 . . . . 305 SER HB2 . 16538 1 1764 . 1 1 154 154 SER HB3 H 1 3.913 0.020 . 2 . . . . 305 SER HB3 . 16538 1 1765 . 1 1 154 154 SER C C 13 174.927 0.400 . 1 . . . . 305 SER C . 16538 1 1766 . 1 1 154 154 SER CA C 13 58.873 0.400 . 1 . . . . 305 SER CA . 16538 1 1767 . 1 1 154 154 SER CB C 13 63.753 0.400 . 1 . . . . 305 SER CB . 16538 1 1768 . 1 1 154 154 SER N N 15 114.932 0.400 . 1 . . . . 305 SER N . 16538 1 1769 . 1 1 155 155 LYS H H 1 8.137 0.020 . 1 . . . . 306 LYS H . 16538 1 1770 . 1 1 155 155 LYS HA H 1 4.285 0.020 . 1 . . . . 306 LYS HA . 16538 1 1771 . 1 1 155 155 LYS HB2 H 1 1.879 0.020 . 2 . . . . 306 LYS HB2 . 16538 1 1772 . 1 1 155 155 LYS HB3 H 1 1.802 0.020 . 2 . . . . 306 LYS HB3 . 16538 1 1773 . 1 1 155 155 LYS HD2 H 1 1.655 0.020 . 2 . . . . 306 LYS HD2 . 16538 1 1774 . 1 1 155 155 LYS HD3 H 1 1.654 0.020 . 2 . . . . 306 LYS HD3 . 16538 1 1775 . 1 1 155 155 LYS HE2 H 1 2.946 0.020 . 2 . . . . 306 LYS HE2 . 16538 1 1776 . 1 1 155 155 LYS HE3 H 1 2.948 0.020 . 2 . . . . 306 LYS HE3 . 16538 1 1777 . 1 1 155 155 LYS HG2 H 1 1.460 0.020 . 2 . . . . 306 LYS HG2 . 16538 1 1778 . 1 1 155 155 LYS HG3 H 1 1.460 0.020 . 2 . . . . 306 LYS HG3 . 16538 1 1779 . 1 1 155 155 LYS C C 13 177.312 0.400 . 1 . . . . 306 LYS C . 16538 1 1780 . 1 1 155 155 LYS CA C 13 56.794 0.400 . 1 . . . . 306 LYS CA . 16538 1 1781 . 1 1 155 155 LYS CB C 13 32.498 0.400 . 1 . . . . 306 LYS CB . 16538 1 1782 . 1 1 155 155 LYS CD C 13 28.970 0.400 . 1 . . . . 306 LYS CD . 16538 1 1783 . 1 1 155 155 LYS CE C 13 41.905 0.400 . 1 . . . . 306 LYS CE . 16538 1 1784 . 1 1 155 155 LYS CG C 13 24.895 0.400 . 1 . . . . 306 LYS CG . 16538 1 1785 . 1 1 155 155 LYS N N 15 122.573 0.400 . 1 . . . . 306 LYS N . 16538 1 1786 . 1 1 156 156 GLY H H 1 8.364 0.020 . 1 . . . . 307 GLY H . 16538 1 1787 . 1 1 156 156 GLY HA2 H 1 3.937 0.020 . 2 . . . . 307 GLY HA2 . 16538 1 1788 . 1 1 156 156 GLY HA3 H 1 3.937 0.020 . 2 . . . . 307 GLY HA3 . 16538 1 1789 . 1 1 156 156 GLY C C 13 174.742 0.400 . 1 . . . . 307 GLY C . 16538 1 1790 . 1 1 156 156 GLY CA C 13 45.529 0.400 . 1 . . . . 307 GLY CA . 16538 1 1791 . 1 1 156 156 GLY N N 15 109.094 0.400 . 1 . . . . 307 GLY N . 16538 1 1792 . 1 1 157 157 GLY H H 1 8.149 0.020 . 1 . . . . 308 GLY H . 16538 1 1793 . 1 1 157 157 GLY HA2 H 1 3.939 0.020 . 2 . . . . 308 GLY HA2 . 16538 1 1794 . 1 1 157 157 GLY HA3 H 1 3.939 0.020 . 2 . . . . 308 GLY HA3 . 16538 1 1795 . 1 1 157 157 GLY C C 13 174.037 0.400 . 1 . . . . 308 GLY C . 16538 1 1796 . 1 1 157 157 GLY CA C 13 45.256 0.400 . 1 . . . . 308 GLY CA . 16538 1 1797 . 1 1 157 157 GLY N N 15 108.403 0.400 . 1 . . . . 308 GLY N . 16538 1 1798 . 1 1 158 158 LYS H H 1 8.117 0.020 . 1 . . . . 309 LYS H . 16538 1 1799 . 1 1 158 158 LYS HA H 1 4.283 0.020 . 1 . . . . 309 LYS HA . 16538 1 1800 . 1 1 158 158 LYS HB2 H 1 1.803 0.020 . 2 . . . . 309 LYS HB2 . 16538 1 1801 . 1 1 158 158 LYS HB3 H 1 1.721 0.020 . 2 . . . . 309 LYS HB3 . 16538 1 1802 . 1 1 158 158 LYS HD2 H 1 1.637 0.020 . 2 . . . . 309 LYS HD2 . 16538 1 1803 . 1 1 158 158 LYS HD3 H 1 1.647 0.020 . 2 . . . . 309 LYS HD3 . 16538 1 1804 . 1 1 158 158 LYS HE2 H 1 2.948 0.020 . 2 . . . . 309 LYS HE2 . 16538 1 1805 . 1 1 158 158 LYS HE3 H 1 2.948 0.020 . 2 . . . . 309 LYS HE3 . 16538 1 1806 . 1 1 158 158 LYS HG2 H 1 1.395 0.020 . 2 . . . . 309 LYS HG2 . 16538 1 1807 . 1 1 158 158 LYS HG3 H 1 1.405 0.020 . 2 . . . . 309 LYS HG3 . 16538 1 1808 . 1 1 158 158 LYS C C 13 176.660 0.400 . 1 . . . . 309 LYS C . 16538 1 1809 . 1 1 158 158 LYS CA C 13 56.369 0.400 . 1 . . . . 309 LYS CA . 16538 1 1810 . 1 1 158 158 LYS CB C 13 32.949 0.400 . 1 . . . . 309 LYS CB . 16538 1 1811 . 1 1 158 158 LYS CD C 13 28.968 0.400 . 1 . . . . 309 LYS CD . 16538 1 1812 . 1 1 158 158 LYS CE C 13 41.915 0.400 . 1 . . . . 309 LYS CE . 16538 1 1813 . 1 1 158 158 LYS CG C 13 24.796 0.400 . 1 . . . . 309 LYS CG . 16538 1 1814 . 1 1 158 158 LYS N N 15 120.528 0.400 . 1 . . . . 309 LYS N . 16538 1 1815 . 1 1 159 159 ARG H H 1 8.345 0.020 . 1 . . . . 310 ARG H . 16538 1 1816 . 1 1 159 159 ARG HA H 1 4.285 0.020 . 1 . . . . 310 ARG HA . 16538 1 1817 . 1 1 159 159 ARG HB2 H 1 1.819 0.020 . 2 . . . . 310 ARG HB2 . 16538 1 1818 . 1 1 159 159 ARG HB3 H 1 1.718 0.020 . 2 . . . . 310 ARG HB3 . 16538 1 1819 . 1 1 159 159 ARG HD2 H 1 3.141 0.020 . 2 . . . . 310 ARG HD2 . 16538 1 1820 . 1 1 159 159 ARG HD3 H 1 3.142 0.020 . 2 . . . . 310 ARG HD3 . 16538 1 1821 . 1 1 159 159 ARG HG2 H 1 1.583 0.020 . 2 . . . . 310 ARG HG2 . 16538 1 1822 . 1 1 159 159 ARG HG3 H 1 1.558 0.020 . 2 . . . . 310 ARG HG3 . 16538 1 1823 . 1 1 159 159 ARG C C 13 176.496 0.400 . 1 . . . . 310 ARG C . 16538 1 1824 . 1 1 159 159 ARG CA C 13 56.152 0.400 . 1 . . . . 310 ARG CA . 16538 1 1825 . 1 1 159 159 ARG CB C 13 30.934 0.400 . 1 . . . . 310 ARG CB . 16538 1 1826 . 1 1 159 159 ARG CD C 13 43.260 0.400 . 1 . . . . 310 ARG CD . 16538 1 1827 . 1 1 159 159 ARG CG C 13 27.142 0.400 . 1 . . . . 310 ARG CG . 16538 1 1828 . 1 1 159 159 ARG N N 15 122.161 0.400 . 1 . . . . 310 ARG N . 16538 1 1829 . 1 1 160 160 LYS H H 1 8.466 0.020 . 1 . . . . 311 LYS H . 16538 1 1830 . 1 1 160 160 LYS HA H 1 4.240 0.020 . 1 . . . . 311 LYS HA . 16538 1 1831 . 1 1 160 160 LYS HB2 H 1 1.793 0.020 . 2 . . . . 311 LYS HB2 . 16538 1 1832 . 1 1 160 160 LYS HB3 H 1 1.720 0.020 . 2 . . . . 311 LYS HB3 . 16538 1 1833 . 1 1 160 160 LYS HD2 H 1 1.638 0.020 . 2 . . . . 311 LYS HD2 . 16538 1 1834 . 1 1 160 160 LYS HD3 H 1 1.634 0.020 . 2 . . . . 311 LYS HD3 . 16538 1 1835 . 1 1 160 160 LYS HE2 H 1 2.945 0.020 . 2 . . . . 311 LYS HE2 . 16538 1 1836 . 1 1 160 160 LYS HE3 H 1 2.947 0.020 . 2 . . . . 311 LYS HE3 . 16538 1 1837 . 1 1 160 160 LYS HG2 H 1 1.391 0.020 . 2 . . . . 311 LYS HG2 . 16538 1 1838 . 1 1 160 160 LYS HG3 H 1 1.387 0.020 . 2 . . . . 311 LYS HG3 . 16538 1 1839 . 1 1 160 160 LYS C C 13 176.242 0.400 . 1 . . . . 311 LYS C . 16538 1 1840 . 1 1 160 160 LYS CA C 13 56.645 0.400 . 1 . . . . 311 LYS CA . 16538 1 1841 . 1 1 160 160 LYS CB C 13 32.808 0.400 . 1 . . . . 311 LYS CB . 16538 1 1842 . 1 1 160 160 LYS CD C 13 28.981 0.400 . 1 . . . . 311 LYS CD . 16538 1 1843 . 1 1 160 160 LYS CE C 13 41.904 0.400 . 1 . . . . 311 LYS CE . 16538 1 1844 . 1 1 160 160 LYS CG C 13 24.714 0.400 . 1 . . . . 311 LYS CG . 16538 1 1845 . 1 1 160 160 LYS N N 15 123.084 0.400 . 1 . . . . 311 LYS N . 16538 1 1846 . 1 1 161 161 ASP H H 1 8.309 0.020 . 1 . . . . 312 ASP H . 16538 1 1847 . 1 1 161 161 ASP HA H 1 4.544 0.020 . 1 . . . . 312 ASP HA . 16538 1 1848 . 1 1 161 161 ASP HB2 H 1 2.620 0.020 . 2 . . . . 312 ASP HB2 . 16538 1 1849 . 1 1 161 161 ASP HB3 H 1 2.618 0.020 . 2 . . . . 312 ASP HB3 . 16538 1 1850 . 1 1 161 161 ASP C C 13 176.136 0.400 . 1 . . . . 312 ASP C . 16538 1 1851 . 1 1 161 161 ASP CA C 13 54.320 0.400 . 1 . . . . 312 ASP CA . 16538 1 1852 . 1 1 161 161 ASP CB C 13 41.189 0.400 . 1 . . . . 312 ASP CB . 16538 1 1853 . 1 1 161 161 ASP N N 15 120.758 0.400 . 1 . . . . 312 ASP N . 16538 1 1854 . 1 1 162 162 SER H H 1 8.158 0.020 . 1 . . . . 313 SER H . 16538 1 1855 . 1 1 162 162 SER HA H 1 4.364 0.020 . 1 . . . . 313 SER HA . 16538 1 1856 . 1 1 162 162 SER HB2 H 1 3.823 0.020 . 2 . . . . 313 SER HB2 . 16538 1 1857 . 1 1 162 162 SER HB3 H 1 3.730 0.020 . 2 . . . . 313 SER HB3 . 16538 1 1858 . 1 1 162 162 SER C C 13 174.960 0.400 . 1 . . . . 313 SER C . 16538 1 1859 . 1 1 162 162 SER CA C 13 58.322 0.400 . 1 . . . . 313 SER CA . 16538 1 1860 . 1 1 162 162 SER CB C 13 63.756 0.400 . 1 . . . . 313 SER CB . 16538 1 1861 . 1 1 162 162 SER N N 15 115.520 0.400 . 1 . . . . 313 SER N . 16538 1 1862 . 1 1 163 163 VAL H H 1 8.085 0.020 . 1 . . . . 314 VAL H . 16538 1 1863 . 1 1 163 163 VAL HA H 1 3.874 0.020 . 1 . . . . 314 VAL HA . 16538 1 1864 . 1 1 163 163 VAL HB H 1 1.889 0.020 . 1 . . . . 314 VAL HB . 16538 1 1865 . 1 1 163 163 VAL HG11 H 1 0.635 0.020 . 2 . . . . 314 VAL HG1 . 16538 1 1866 . 1 1 163 163 VAL HG12 H 1 0.635 0.020 . 2 . . . . 314 VAL HG1 . 16538 1 1867 . 1 1 163 163 VAL HG13 H 1 0.635 0.020 . 2 . . . . 314 VAL HG1 . 16538 1 1868 . 1 1 163 163 VAL HG21 H 1 0.581 0.020 . 2 . . . . 314 VAL HG2 . 16538 1 1869 . 1 1 163 163 VAL HG22 H 1 0.581 0.020 . 2 . . . . 314 VAL HG2 . 16538 1 1870 . 1 1 163 163 VAL HG23 H 1 0.581 0.020 . 2 . . . . 314 VAL HG2 . 16538 1 1871 . 1 1 163 163 VAL C C 13 176.169 0.400 . 1 . . . . 314 VAL C . 16538 1 1872 . 1 1 163 163 VAL CA C 13 63.196 0.400 . 1 . . . . 314 VAL CA . 16538 1 1873 . 1 1 163 163 VAL CB C 13 32.165 0.400 . 1 . . . . 314 VAL CB . 16538 1 1874 . 1 1 163 163 VAL CG1 C 13 20.445 0.400 . 1 . . . . 314 VAL CG1 . 16538 1 1875 . 1 1 163 163 VAL CG2 C 13 20.890 0.400 . 1 . . . . 314 VAL CG2 . 16538 1 1876 . 1 1 163 163 VAL N N 15 121.295 0.400 . 1 . . . . 314 VAL N . 16538 1 1877 . 1 1 164 164 TRP H H 1 8.148 0.020 . 1 . . . . 315 TRP H . 16538 1 1878 . 1 1 164 164 TRP HA H 1 4.650 0.020 . 1 . . . . 315 TRP HA . 16538 1 1879 . 1 1 164 164 TRP HB2 H 1 3.328 0.020 . 2 . . . . 315 TRP HB2 . 16538 1 1880 . 1 1 164 164 TRP HB3 H 1 3.128 0.020 . 2 . . . . 315 TRP HB3 . 16538 1 1881 . 1 1 164 164 TRP HD1 H 1 7.281 0.020 . 1 . . . . 315 TRP HD1 . 16538 1 1882 . 1 1 164 164 TRP HE1 H 1 9.990 0.020 . 1 . . . . 315 TRP HE1 . 16538 1 1883 . 1 1 164 164 TRP HE3 H 1 7.578 0.020 . 1 . . . . 315 TRP HE3 . 16538 1 1884 . 1 1 164 164 TRP HZ3 H 1 6.906 0.020 . 1 . . . . 315 TRP HZ3 . 16538 1 1885 . 1 1 164 164 TRP C C 13 176.892 0.400 . 1 . . . . 315 TRP C . 16538 1 1886 . 1 1 164 164 TRP CA C 13 57.094 0.400 . 1 . . . . 315 TRP CA . 16538 1 1887 . 1 1 164 164 TRP CB C 13 29.758 0.400 . 1 . . . . 315 TRP CB . 16538 1 1888 . 1 1 164 164 TRP N N 15 122.915 0.400 . 1 . . . . 315 TRP N . 16538 1 1889 . 1 1 164 164 TRP NE1 N 15 128.434 0.400 . 1 . . . . 315 TRP NE1 . 16538 1 1890 . 1 1 165 165 GLY H H 1 8.065 0.020 . 1 . . . . 316 GLY H . 16538 1 1891 . 1 1 165 165 GLY HA2 H 1 3.898 0.020 . 2 . . . . 316 GLY HA2 . 16538 1 1892 . 1 1 165 165 GLY HA3 H 1 3.900 0.020 . 2 . . . . 316 GLY HA3 . 16538 1 1893 . 1 1 165 165 GLY C C 13 174.009 0.400 . 1 . . . . 316 GLY C . 16538 1 1894 . 1 1 165 165 GLY CA C 13 45.364 0.400 . 1 . . . . 316 GLY CA . 16538 1 1895 . 1 1 165 165 GLY N N 15 110.042 0.400 . 1 . . . . 316 GLY N . 16538 1 1896 . 1 1 166 166 SER H H 1 8.131 0.020 . 1 . . . . 317 SER H . 16538 1 1897 . 1 1 166 166 SER HA H 1 4.432 0.020 . 1 . . . . 317 SER HA . 16538 1 1898 . 1 1 166 166 SER HB2 H 1 3.825 0.020 . 2 . . . . 317 SER HB2 . 16538 1 1899 . 1 1 166 166 SER C C 13 174.036 0.400 . 1 . . . . 317 SER C . 16538 1 1900 . 1 1 166 166 SER CA C 13 58.210 0.400 . 1 . . . . 317 SER CA . 16538 1 1901 . 1 1 166 166 SER CB C 13 64.113 0.400 . 1 . . . . 317 SER CB . 16538 1 1902 . 1 1 166 166 SER N N 15 115.497 0.400 . 1 . . . . 317 SER N . 16538 1 1903 . 1 1 167 167 GLY H H 1 8.085 0.020 . 1 . . . . 318 GLY H . 16538 1 1904 . 1 1 167 167 GLY HA2 H 1 3.736 0.020 . 2 . . . . 318 GLY HA2 . 16538 1 1905 . 1 1 167 167 GLY HA3 H 1 3.740 0.020 . 2 . . . . 318 GLY HA3 . 16538 1 1906 . 1 1 167 167 GLY CA C 13 46.258 0.400 . 1 . . . . 318 GLY CA . 16538 1 1907 . 1 1 167 167 GLY N N 15 116.859 0.400 . 1 . . . . 318 GLY N . 16538 1 stop_ save_