data_51206 ####################### # Entry information # ####################### save_entry_information_1 _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information_1 _Entry.ID 51206 _Entry.Title ; Musashi-1 C terminal deltaSeq1 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2021-12-02 _Entry.Accession_date 2021-12-02 _Entry.Last_release_date 2021-12-02 _Entry.Original_release_date 2021-12-02 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.14.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID 1 _Entry.Generated_software_label $software_1 _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 Jie-rong Huang . . . . 51206 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 51206 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 261 51206 '15N chemical shifts' 83 51206 '1H chemical shifts' 83 51206 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2022-05-11 . original BMRB . 51206 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 51204 'Musashi-1 C terminal deltaSeq1, msi1_ds1' 51206 BMRB 51205 'Musashi-1 C terminal deltaSeq1, msi1_ds2' 51206 BMRB 51207 'Musashi-1 C terminal deltaSeq1, msi1' 51206 BMRB 51208 'Musashi-2 C terminal, msi2' 51206 stop_ save_ ############### # Citations # ############### save_citations_1 _Citation.Sf_category citations _Citation.Sf_framecode citations_1 _Citation.Entry_ID 51206 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 35487971 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; Phase separation driven by interchangeable properties in the intrinsically disordered regions of protein paralogs ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Commun. Biol.' _Citation.Journal_name_full 'Communications biology' _Citation.Journal_volume 5 _Citation.Journal_issue 1 _Citation.Journal_ASTM . _Citation.Journal_ISSN 2399-3642 _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 400 _Citation.Page_last 400 _Citation.Year 2022 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Shih-Hui Chiu S. H. . . 51206 1 2 Wen-Lin Ho W. L. . . 51206 1 3 Yung-Chen Sun Y. C. . . 51206 1 4 Jean-Cheng Kuo J. C. . . 51206 1 5 Jie-Rong Huang J. R. . . 51206 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly_1 _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly_1 _Assembly.Entry_ID 51206 _Assembly.ID 1 _Assembly.Name 'Musashi-1 C terminal deltaSeq1, msi1_ds1ds2' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states no _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange no _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _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 'Musashi-1 C terminal deltaSeq1, msi1_ds1ds2' 1 $entity_1 . . yes native no no . . . 51206 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 51206 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity_1 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MPGYTYQFPEFRVERTPLPS APVLPELTAIPLTAYGPMAA AAAAAAVVRGTGSHPWTMAP PPGSTPSRTGGFLGTTSPGP MAELYGAANQDSGVSSYISA ASPAPSTGFGHSLGGPLIAT AFTNGYH ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 127 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . 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 1 236 MET . 51206 1 2 237 PRO . 51206 1 3 238 GLY . 51206 1 4 239 TYR . 51206 1 5 240 THR . 51206 1 6 241 TYR . 51206 1 7 242 GLN . 51206 1 8 243 PHE . 51206 1 9 244 PRO . 51206 1 10 245 GLU . 51206 1 11 246 PHE . 51206 1 12 247 ARG . 51206 1 13 248 VAL . 51206 1 14 249 GLU . 51206 1 15 250 ARG . 51206 1 16 251 THR . 51206 1 17 252 PRO . 51206 1 18 253 LEU . 51206 1 19 254 PRO . 51206 1 20 255 SER . 51206 1 21 256 ALA . 51206 1 22 257 PRO . 51206 1 23 258 VAL . 51206 1 24 259 LEU . 51206 1 25 260 PRO . 51206 1 26 261 GLU . 51206 1 27 262 LEU . 51206 1 28 263 THR . 51206 1 29 264 ALA . 51206 1 30 265 ILE . 51206 1 31 266 PRO . 51206 1 32 267 LEU . 51206 1 33 268 THR . 51206 1 34 269 ALA . 51206 1 35 270 TYR . 51206 1 36 271 GLY . 51206 1 37 272 PRO . 51206 1 38 273 MET . 51206 1 39 274 ALA . 51206 1 40 275 ALA . 51206 1 41 276 ALA . 51206 1 42 277 ALA . 51206 1 43 278 ALA . 51206 1 44 279 ALA . 51206 1 45 280 ALA . 51206 1 46 281 ALA . 51206 1 47 282 VAL . 51206 1 48 283 VAL . 51206 1 49 284 ARG . 51206 1 50 285 GLY . 51206 1 51 286 THR . 51206 1 52 287 GLY . 51206 1 53 288 SER . 51206 1 54 289 HIS . 51206 1 55 290 PRO . 51206 1 56 291 TRP . 51206 1 57 292 THR . 51206 1 58 293 MET . 51206 1 59 294 ALA . 51206 1 60 295 PRO . 51206 1 61 296 PRO . 51206 1 62 297 PRO . 51206 1 63 298 GLY . 51206 1 64 299 SER . 51206 1 65 300 THR . 51206 1 66 301 PRO . 51206 1 67 302 SER . 51206 1 68 303 ARG . 51206 1 69 304 THR . 51206 1 70 305 GLY . 51206 1 71 306 GLY . 51206 1 72 307 PHE . 51206 1 73 308 LEU . 51206 1 74 309 GLY . 51206 1 75 310 THR . 51206 1 76 311 THR . 51206 1 77 312 SER . 51206 1 78 313 PRO . 51206 1 79 314 GLY . 51206 1 80 315 PRO . 51206 1 81 316 MET . 51206 1 82 317 ALA . 51206 1 83 318 GLU . 51206 1 84 319 LEU . 51206 1 85 320 TYR . 51206 1 86 321 GLY . 51206 1 87 322 ALA . 51206 1 88 323 ALA . 51206 1 89 324 ASN . 51206 1 90 325 GLN . 51206 1 91 326 ASP . 51206 1 92 327 SER . 51206 1 93 328 GLY . 51206 1 94 329 VAL . 51206 1 95 330 SER . 51206 1 96 331 SER . 51206 1 97 332 TYR . 51206 1 98 333 ILE . 51206 1 99 334 SER . 51206 1 100 335 ALA . 51206 1 101 336 ALA . 51206 1 102 337 SER . 51206 1 103 338 PRO . 51206 1 104 339 ALA . 51206 1 105 340 PRO . 51206 1 106 341 SER . 51206 1 107 342 THR . 51206 1 108 343 GLY . 51206 1 109 344 PHE . 51206 1 110 345 GLY . 51206 1 111 346 HIS . 51206 1 112 347 SER . 51206 1 113 348 LEU . 51206 1 114 349 GLY . 51206 1 115 350 GLY . 51206 1 116 351 PRO . 51206 1 117 352 LEU . 51206 1 118 353 ILE . 51206 1 119 354 ALA . 51206 1 120 355 THR . 51206 1 121 356 ALA . 51206 1 122 357 PHE . 51206 1 123 358 THR . 51206 1 124 359 ASN . 51206 1 125 360 GLY . 51206 1 126 361 TYR . 51206 1 127 362 HIS . 51206 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 . MET 1 1 51206 1 . PRO 2 2 51206 1 . GLY 3 3 51206 1 . TYR 4 4 51206 1 . THR 5 5 51206 1 . TYR 6 6 51206 1 . GLN 7 7 51206 1 . PHE 8 8 51206 1 . PRO 9 9 51206 1 . GLU 10 10 51206 1 . PHE 11 11 51206 1 . ARG 12 12 51206 1 . VAL 13 13 51206 1 . GLU 14 14 51206 1 . ARG 15 15 51206 1 . THR 16 16 51206 1 . PRO 17 17 51206 1 . LEU 18 18 51206 1 . PRO 19 19 51206 1 . SER 20 20 51206 1 . ALA 21 21 51206 1 . PRO 22 22 51206 1 . VAL 23 23 51206 1 . LEU 24 24 51206 1 . PRO 25 25 51206 1 . GLU 26 26 51206 1 . LEU 27 27 51206 1 . THR 28 28 51206 1 . ALA 29 29 51206 1 . ILE 30 30 51206 1 . PRO 31 31 51206 1 . LEU 32 32 51206 1 . THR 33 33 51206 1 . ALA 34 34 51206 1 . TYR 35 35 51206 1 . GLY 36 36 51206 1 . PRO 37 37 51206 1 . MET 38 38 51206 1 . ALA 39 39 51206 1 . ALA 40 40 51206 1 . ALA 41 41 51206 1 . ALA 42 42 51206 1 . ALA 43 43 51206 1 . ALA 44 44 51206 1 . ALA 45 45 51206 1 . ALA 46 46 51206 1 . VAL 47 47 51206 1 . VAL 48 48 51206 1 . ARG 49 49 51206 1 . GLY 50 50 51206 1 . THR 51 51 51206 1 . GLY 52 52 51206 1 . SER 53 53 51206 1 . HIS 54 54 51206 1 . PRO 55 55 51206 1 . TRP 56 56 51206 1 . THR 57 57 51206 1 . MET 58 58 51206 1 . ALA 59 59 51206 1 . PRO 60 60 51206 1 . PRO 61 61 51206 1 . PRO 62 62 51206 1 . GLY 63 63 51206 1 . SER 64 64 51206 1 . THR 65 65 51206 1 . PRO 66 66 51206 1 . SER 67 67 51206 1 . ARG 68 68 51206 1 . THR 69 69 51206 1 . GLY 70 70 51206 1 . GLY 71 71 51206 1 . PHE 72 72 51206 1 . LEU 73 73 51206 1 . GLY 74 74 51206 1 . THR 75 75 51206 1 . THR 76 76 51206 1 . SER 77 77 51206 1 . PRO 78 78 51206 1 . GLY 79 79 51206 1 . PRO 80 80 51206 1 . MET 81 81 51206 1 . ALA 82 82 51206 1 . GLU 83 83 51206 1 . LEU 84 84 51206 1 . TYR 85 85 51206 1 . GLY 86 86 51206 1 . ALA 87 87 51206 1 . ALA 88 88 51206 1 . ASN 89 89 51206 1 . GLN 90 90 51206 1 . ASP 91 91 51206 1 . SER 92 92 51206 1 . GLY 93 93 51206 1 . VAL 94 94 51206 1 . SER 95 95 51206 1 . SER 96 96 51206 1 . TYR 97 97 51206 1 . ILE 98 98 51206 1 . SER 99 99 51206 1 . ALA 100 100 51206 1 . ALA 101 101 51206 1 . SER 102 102 51206 1 . PRO 103 103 51206 1 . ALA 104 104 51206 1 . PRO 105 105 51206 1 . SER 106 106 51206 1 . THR 107 107 51206 1 . GLY 108 108 51206 1 . PHE 109 109 51206 1 . GLY 110 110 51206 1 . HIS 111 111 51206 1 . SER 112 112 51206 1 . LEU 113 113 51206 1 . GLY 114 114 51206 1 . GLY 115 115 51206 1 . PRO 116 116 51206 1 . LEU 117 117 51206 1 . ILE 118 118 51206 1 . ALA 119 119 51206 1 . THR 120 120 51206 1 . ALA 121 121 51206 1 . PHE 122 122 51206 1 . THR 123 123 51206 1 . ASN 124 124 51206 1 . GLY 125 125 51206 1 . TYR 126 126 51206 1 . HIS 127 127 51206 1 stop_ save_ #################### # Natural source # #################### save_natural_source_1 _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source_1 _Entity_natural_src_list.Entry_ID 51206 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity_1 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . 51206 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source_1 _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source_1 _Entity_experimental_src_list.Entry_ID 51206 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . plasmid . . pET21 . . . 51206 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 51206 _Sample.ID 1 _Sample.Name Protein _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number 1 _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'Musashi-1 C terminal domain delta-seq1' '[U-98% 13C; U-98% 15N]' . . 1 $entity_1 . . 100 . . uM . . . . 51206 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 51206 _Sample_condition_list.ID 1 _Sample_condition_list.Name 'normal buffer' _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' 0.02 . M 51206 1 pH 5.5 . pH 51206 1 pressure 1 . atm 51206 1 temperature 283 . K 51206 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 51206 _Software.ID 1 _Software.Type . _Software.Name SPARKY _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 51206 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID 51206 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name 'NMR AVIII 600' _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE III' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ ############################# # NMR applied experiments # ############################# save_experiment_list_1 _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list_1 _Experiment_list.Entry_ID 51206 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NUS_flag _Experiment.Interleaved_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Details _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51206 1 2 '3D HNCO' no yes no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51206 1 3 '3D HN(CA)CO' no yes no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51206 1 4 '3D HNCA' no yes no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51206 1 5 '3D HN(CO)CA' no yes no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51206 1 6 '3D CBCA(CO)NH' no yes no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51206 1 7 '3D HNCACB' no yes no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51206 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chem_shift_reference_1 _Chem_shift_reference.Entry_ID 51206 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name DSS _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . 51206 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . 51206 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . 51206 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 51206 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name 'Musashi-1 C terminal domain delta Seq1' _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 51206 1 2 '3D HNCO' . . . 51206 1 3 '3D HN(CA)CO' . . . 51206 1 4 '3D HNCA' . . . 51206 1 5 '3D HN(CO)CA' . . . 51206 1 6 '3D CBCA(CO)NH' . . . 51206 1 7 '3D HNCACB' . . . 51206 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $software_1 . . 51206 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 2 2 PRO C C 13 176.809 0.00 . . . . . . . 237 PRO C . 51206 1 2 . 1 . 1 2 2 PRO CA C 13 63.401 0.00 . . . . . . . 237 PRO CA . 51206 1 3 . 1 . 1 2 2 PRO CB C 13 32.090 0.00 . . . . . . . 237 PRO CB . 51206 1 4 . 1 . 1 3 3 GLY H H 1 8.627 0.00 . . . . . . . 238 GLY H . 51206 1 5 . 1 . 1 3 3 GLY C C 13 173.545 0.00 . . . . . . . 238 GLY C . 51206 1 6 . 1 . 1 3 3 GLY CA C 13 45.017 0.00 . . . . . . . 238 GLY CA . 51206 1 7 . 1 . 1 3 3 GLY N N 15 109.907 0.01 . . . . . . . 238 GLY N . 51206 1 8 . 1 . 1 4 4 TYR H H 1 8.132 0.00 . . . . . . . 239 TYR H . 51206 1 9 . 1 . 1 4 4 TYR C C 13 175.843 0.00 . . . . . . . 239 TYR C . 51206 1 10 . 1 . 1 4 4 TYR CA C 13 57.954 0.00 . . . . . . . 239 TYR CA . 51206 1 11 . 1 . 1 4 4 TYR CB C 13 39.199 0.00 . . . . . . . 239 TYR CB . 51206 1 12 . 1 . 1 4 4 TYR N N 15 120.243 0.01 . . . . . . . 239 TYR N . 51206 1 13 . 1 . 1 5 5 THR H H 1 8.142 0.00 . . . . . . . 240 THR H . 51206 1 14 . 1 . 1 5 5 THR C C 13 173.551 0.00 . . . . . . . 240 THR C . 51206 1 15 . 1 . 1 5 5 THR CA C 13 61.511 0.00 . . . . . . . 240 THR CA . 51206 1 16 . 1 . 1 5 5 THR CB C 13 70.136 0.00 . . . . . . . 240 THR CB . 51206 1 17 . 1 . 1 5 5 THR N N 15 117.190 0.03 . . . . . . . 240 THR N . 51206 1 18 . 1 . 1 6 6 TYR H H 1 8.220 0.00 . . . . . . . 241 TYR H . 51206 1 19 . 1 . 1 6 6 TYR C C 13 175.130 0.00 . . . . . . . 241 TYR C . 51206 1 20 . 1 . 1 6 6 TYR CA C 13 58.192 0.00 . . . . . . . 241 TYR CA . 51206 1 21 . 1 . 1 6 6 TYR CB C 13 38.736 0.00 . . . . . . . 241 TYR CB . 51206 1 22 . 1 . 1 6 6 TYR N N 15 123.023 0.03 . . . . . . . 241 TYR N . 51206 1 23 . 1 . 1 7 7 GLN H H 1 8.072 0.00 . . . . . . . 242 GLN H . 51206 1 24 . 1 . 1 7 7 GLN C C 13 174.536 0.00 . . . . . . . 242 GLN C . 51206 1 25 . 1 . 1 7 7 GLN CA C 13 55.259 0.00 . . . . . . . 242 GLN CA . 51206 1 26 . 1 . 1 7 7 GLN CB C 13 29.596 0.00 . . . . . . . 242 GLN CB . 51206 1 27 . 1 . 1 7 7 GLN N N 15 122.632 0.02 . . . . . . . 242 GLN N . 51206 1 28 . 1 . 1 31 31 PRO C C 13 176.937 0.00 . . . . . . . 266 PRO C . 51206 1 29 . 1 . 1 31 31 PRO CA C 13 63.034 0.00 . . . . . . . 266 PRO CA . 51206 1 30 . 1 . 1 31 31 PRO CB C 13 32.138 0.00 . . . . . . . 266 PRO CB . 51206 1 31 . 1 . 1 32 32 LEU H H 1 8.556 0.00 . . . . . . . 267 LEU H . 51206 1 32 . 1 . 1 32 32 LEU C C 13 177.878 0.00 . . . . . . . 267 LEU C . 51206 1 33 . 1 . 1 32 32 LEU CA C 13 55.616 0.00 . . . . . . . 267 LEU CA . 51206 1 34 . 1 . 1 32 32 LEU CB C 13 42.140 0.00 . . . . . . . 267 LEU CB . 51206 1 35 . 1 . 1 32 32 LEU N N 15 122.232 0.01 . . . . . . . 267 LEU N . 51206 1 36 . 1 . 1 33 33 THR H H 1 8.054 0.00 . . . . . . . 268 THR H . 51206 1 37 . 1 . 1 33 33 THR C C 13 174.101 0.00 . . . . . . . 268 THR C . 51206 1 38 . 1 . 1 33 33 THR CA C 13 61.741 0.00 . . . . . . . 268 THR CA . 51206 1 39 . 1 . 1 33 33 THR CB C 13 69.892 0.00 . . . . . . . 268 THR CB . 51206 1 40 . 1 . 1 33 33 THR N N 15 113.812 0.01 . . . . . . . 268 THR N . 51206 1 41 . 1 . 1 34 34 ALA H H 1 8.287 0.00 . . . . . . . 269 ALA H . 51206 1 42 . 1 . 1 34 34 ALA C C 13 176.989 0.00 . . . . . . . 269 ALA C . 51206 1 43 . 1 . 1 34 34 ALA CA C 13 52.437 0.00 . . . . . . . 269 ALA CA . 51206 1 44 . 1 . 1 34 34 ALA CB C 13 19.254 0.00 . . . . . . . 269 ALA CB . 51206 1 45 . 1 . 1 34 34 ALA N N 15 125.791 0.02 . . . . . . . 269 ALA N . 51206 1 46 . 1 . 1 35 35 TYR H H 1 8.153 0.00 . . . . . . . 270 TYR H . 51206 1 47 . 1 . 1 35 35 TYR C C 13 176.085 0.00 . . . . . . . 270 TYR C . 51206 1 48 . 1 . 1 35 35 TYR CA C 13 57.784 0.00 . . . . . . . 270 TYR CA . 51206 1 49 . 1 . 1 35 35 TYR CB C 13 39.179 0.00 . . . . . . . 270 TYR CB . 51206 1 50 . 1 . 1 35 35 TYR N N 15 118.966 0.01 . . . . . . . 270 TYR N . 51206 1 51 . 1 . 1 36 36 GLY H H 1 8.288 0.00 . . . . . . . 271 GLY H . 51206 1 52 . 1 . 1 36 36 GLY C C 13 172.371 0.00 . . . . . . . 271 GLY C . 51206 1 53 . 1 . 1 36 36 GLY CA C 13 44.933 0.00 . . . . . . . 271 GLY CA . 51206 1 54 . 1 . 1 36 36 GLY N N 15 110.404 0.01 . . . . . . . 271 GLY N . 51206 1 55 . 1 . 1 37 37 PRO C C 13 178.119 0.00 . . . . . . . 272 PRO C . 51206 1 56 . 1 . 1 37 37 PRO CA C 13 64.001 0.00 . . . . . . . 272 PRO CA . 51206 1 57 . 1 . 1 37 37 PRO CB C 13 32.056 0.00 . . . . . . . 272 PRO CB . 51206 1 58 . 1 . 1 38 38 MET H H 1 8.501 0.00 . . . . . . . 273 MET H . 51206 1 59 . 1 . 1 38 38 MET C C 13 177.065 0.00 . . . . . . . 273 MET C . 51206 1 60 . 1 . 1 38 38 MET CA C 13 56.437 0.00 . . . . . . . 273 MET CA . 51206 1 61 . 1 . 1 38 38 MET CB C 13 32.334 0.00 . . . . . . . 273 MET CB . 51206 1 62 . 1 . 1 38 38 MET N N 15 119.466 0.01 . . . . . . . 273 MET N . 51206 1 63 . 1 . 1 39 39 ALA H H 1 8.233 0.00 . . . . . . . 274 ALA H . 51206 1 64 . 1 . 1 39 39 ALA C C 13 178.743 0.00 . . . . . . . 274 ALA C . 51206 1 65 . 1 . 1 39 39 ALA CA C 13 53.462 0.00 . . . . . . . 274 ALA CA . 51206 1 66 . 1 . 1 39 39 ALA CB C 13 18.701 0.00 . . . . . . . 274 ALA CB . 51206 1 67 . 1 . 1 39 39 ALA N N 15 125.035 0.01 . . . . . . . 274 ALA N . 51206 1 68 . 1 . 1 40 40 ALA H H 1 8.356 0.00 . . . . . . . 275 ALA H . 51206 1 69 . 1 . 1 40 40 ALA C C 13 179.005 0.00 . . . . . . . 275 ALA C . 51206 1 70 . 1 . 1 40 40 ALA CA C 13 53.626 0.00 . . . . . . . 275 ALA CA . 51206 1 71 . 1 . 1 40 40 ALA CB C 13 18.574 0.00 . . . . . . . 275 ALA CB . 51206 1 72 . 1 . 1 40 40 ALA N N 15 122.908 0.01 . . . . . . . 275 ALA N . 51206 1 73 . 1 . 1 41 41 ALA H H 1 8.246 0.00 . . . . . . . 276 ALA H . 51206 1 74 . 1 . 1 41 41 ALA C C 13 179.004 0.00 . . . . . . . 276 ALA C . 51206 1 75 . 1 . 1 41 41 ALA CA C 13 53.532 0.00 . . . . . . . 276 ALA CA . 51206 1 76 . 1 . 1 41 41 ALA CB C 13 18.532 0.00 . . . . . . . 276 ALA CB . 51206 1 77 . 1 . 1 41 41 ALA N N 15 122.642 0.01 . . . . . . . 276 ALA N . 51206 1 78 . 1 . 1 42 42 ALA H H 1 8.144 0.00 . . . . . . . 277 ALA H . 51206 1 79 . 1 . 1 42 42 ALA C C 13 178.927 0.00 . . . . . . . 277 ALA C . 51206 1 80 . 1 . 1 42 42 ALA CA C 13 53.507 0.00 . . . . . . . 277 ALA CA . 51206 1 81 . 1 . 1 42 42 ALA CB C 13 18.550 0.00 . . . . . . . 277 ALA CB . 51206 1 82 . 1 . 1 42 42 ALA N N 15 122.746 0.01 . . . . . . . 277 ALA N . 51206 1 83 . 1 . 1 43 43 ALA H H 1 8.186 0.00 . . . . . . . 278 ALA H . 51206 1 84 . 1 . 1 43 43 ALA C C 13 178.764 0.00 . . . . . . . 278 ALA C . 51206 1 85 . 1 . 1 43 43 ALA CA C 13 53.471 0.00 . . . . . . . 278 ALA CA . 51206 1 86 . 1 . 1 43 43 ALA CB C 13 18.542 0.00 . . . . . . . 278 ALA CB . 51206 1 87 . 1 . 1 43 43 ALA N N 15 122.606 0.03 . . . . . . . 278 ALA N . 51206 1 88 . 1 . 1 44 44 ALA H H 1 8.107 0.00 . . . . . . . 279 ALA H . 51206 1 89 . 1 . 1 44 44 ALA C C 13 178.550 0.00 . . . . . . . 279 ALA C . 51206 1 90 . 1 . 1 44 44 ALA CA C 13 53.299 0.00 . . . . . . . 279 ALA CA . 51206 1 91 . 1 . 1 44 44 ALA CB C 13 18.605 0.00 . . . . . . . 279 ALA CB . 51206 1 92 . 1 . 1 44 44 ALA N N 15 122.052 0.01 . . . . . . . 279 ALA N . 51206 1 93 . 1 . 1 45 45 ALA H H 1 8.059 0.00 . . . . . . . 280 ALA H . 51206 1 94 . 1 . 1 45 45 ALA C C 13 178.077 0.00 . . . . . . . 280 ALA C . 51206 1 95 . 1 . 1 45 45 ALA CA C 13 52.948 0.00 . . . . . . . 280 ALA CA . 51206 1 96 . 1 . 1 45 45 ALA CB C 13 18.775 0.00 . . . . . . . 280 ALA CB . 51206 1 97 . 1 . 1 45 45 ALA N N 15 121.816 0.01 . . . . . . . 280 ALA N . 51206 1 98 . 1 . 1 46 46 ALA H H 1 8.022 0.00 . . . . . . . 281 ALA H . 51206 1 99 . 1 . 1 46 46 ALA C C 13 178.234 0.00 . . . . . . . 281 ALA C . 51206 1 100 . 1 . 1 46 46 ALA CA C 13 52.925 0.00 . . . . . . . 281 ALA CA . 51206 1 101 . 1 . 1 46 46 ALA CB C 13 18.868 0.00 . . . . . . . 281 ALA CB . 51206 1 102 . 1 . 1 46 46 ALA N N 15 122.172 0.01 . . . . . . . 281 ALA N . 51206 1 103 . 1 . 1 47 47 VAL H H 1 7.946 0.00 . . . . . . . 282 VAL H . 51206 1 104 . 1 . 1 47 47 VAL C C 13 176.697 0.00 . . . . . . . 282 VAL C . 51206 1 105 . 1 . 1 47 47 VAL CA C 13 63.110 0.00 . . . . . . . 282 VAL CA . 51206 1 106 . 1 . 1 47 47 VAL CB C 13 32.495 0.00 . . . . . . . 282 VAL CB . 51206 1 107 . 1 . 1 47 47 VAL N N 15 119.586 0.01 . . . . . . . 282 VAL N . 51206 1 108 . 1 . 1 48 48 VAL H H 1 8.200 0.00 . . . . . . . 283 VAL H . 51206 1 109 . 1 . 1 48 48 VAL C C 13 176.433 0.00 . . . . . . . 283 VAL C . 51206 1 110 . 1 . 1 48 48 VAL CA C 13 62.896 0.00 . . . . . . . 283 VAL CA . 51206 1 111 . 1 . 1 48 48 VAL CB C 13 32.389 0.00 . . . . . . . 283 VAL CB . 51206 1 112 . 1 . 1 48 48 VAL N N 15 124.385 0.00 . . . . . . . 283 VAL N . 51206 1 113 . 1 . 1 49 49 ARG H H 1 8.509 0.00 . . . . . . . 284 ARG H . 51206 1 114 . 1 . 1 49 49 ARG C C 13 176.861 0.00 . . . . . . . 284 ARG C . 51206 1 115 . 1 . 1 49 49 ARG CA C 13 56.451 0.00 . . . . . . . 284 ARG CA . 51206 1 116 . 1 . 1 49 49 ARG CB C 13 30.869 0.00 . . . . . . . 284 ARG CB . 51206 1 117 . 1 . 1 49 49 ARG N N 15 125.007 0.02 . . . . . . . 284 ARG N . 51206 1 118 . 1 . 1 50 50 GLY H H 1 8.470 0.00 . . . . . . . 285 GLY H . 51206 1 119 . 1 . 1 50 50 GLY C C 13 174.438 0.00 . . . . . . . 285 GLY C . 51206 1 120 . 1 . 1 50 50 GLY CA C 13 45.237 0.00 . . . . . . . 285 GLY CA . 51206 1 121 . 1 . 1 50 50 GLY N N 15 109.920 0.01 . . . . . . . 285 GLY N . 51206 1 122 . 1 . 1 51 51 THR H H 1 8.317 0.00 . . . . . . . 286 THR H . 51206 1 123 . 1 . 1 51 51 THR C C 13 175.395 0.00 . . . . . . . 286 THR C . 51206 1 124 . 1 . 1 51 51 THR CA C 13 62.093 0.00 . . . . . . . 286 THR CA . 51206 1 125 . 1 . 1 51 51 THR CB C 13 69.779 0.00 . . . . . . . 286 THR CB . 51206 1 126 . 1 . 1 51 51 THR N N 15 113.361 0.01 . . . . . . . 286 THR N . 51206 1 127 . 1 . 1 63 63 GLY H H 1 8.635 0.00 . . . . . . . 298 GLY H . 51206 1 128 . 1 . 1 63 63 GLY C C 13 174.090 0.00 . . . . . . . 298 GLY C . 51206 1 129 . 1 . 1 63 63 GLY CA C 13 45.296 0.00 . . . . . . . 298 GLY CA . 51206 1 130 . 1 . 1 63 63 GLY N N 15 111.507 0.01 . . . . . . . 298 GLY N . 51206 1 131 . 1 . 1 64 64 SER H H 1 8.347 0.00 . . . . . . . 299 SER H . 51206 1 132 . 1 . 1 64 64 SER C C 13 174.307 0.00 . . . . . . . 299 SER C . 51206 1 133 . 1 . 1 64 64 SER CA C 13 58.207 0.00 . . . . . . . 299 SER CA . 51206 1 134 . 1 . 1 64 64 SER CB C 13 63.951 0.00 . . . . . . . 299 SER CB . 51206 1 135 . 1 . 1 64 64 SER N N 15 115.753 0.02 . . . . . . . 299 SER N . 51206 1 136 . 1 . 1 65 65 THR H H 1 8.416 0.00 . . . . . . . 300 THR H . 51206 1 137 . 1 . 1 65 65 THR C C 13 172.755 0.00 . . . . . . . 300 THR C . 51206 1 138 . 1 . 1 65 65 THR CA C 13 59.952 0.00 . . . . . . . 300 THR CA . 51206 1 139 . 1 . 1 65 65 THR CB C 13 69.695 0.00 . . . . . . . 300 THR CB . 51206 1 140 . 1 . 1 65 65 THR N N 15 118.690 0.01 . . . . . . . 300 THR N . 51206 1 141 . 1 . 1 66 66 PRO C C 13 176.864 0.00 . . . . . . . 301 PRO C . 51206 1 142 . 1 . 1 66 66 PRO CA C 13 63.274 0.00 . . . . . . . 301 PRO CA . 51206 1 143 . 1 . 1 66 66 PRO CB C 13 32.165 0.00 . . . . . . . 301 PRO CB . 51206 1 144 . 1 . 1 67 67 SER H H 1 8.572 0.00 . . . . . . . 302 SER H . 51206 1 145 . 1 . 1 67 67 SER C C 13 174.770 0.00 . . . . . . . 302 SER C . 51206 1 146 . 1 . 1 67 67 SER CA C 13 58.354 0.00 . . . . . . . 302 SER CA . 51206 1 147 . 1 . 1 67 67 SER CB C 13 63.761 0.00 . . . . . . . 302 SER CB . 51206 1 148 . 1 . 1 67 67 SER N N 15 116.537 0.00 . . . . . . . 302 SER N . 51206 1 149 . 1 . 1 68 68 ARG H H 1 8.631 0.00 . . . . . . . 303 ARG H . 51206 1 150 . 1 . 1 68 68 ARG C C 13 176.532 0.00 . . . . . . . 303 ARG C . 51206 1 151 . 1 . 1 68 68 ARG CA C 13 56.188 0.00 . . . . . . . 303 ARG CA . 51206 1 152 . 1 . 1 68 68 ARG CB C 13 30.841 0.00 . . . . . . . 303 ARG CB . 51206 1 153 . 1 . 1 68 68 ARG N N 15 123.584 0.01 . . . . . . . 303 ARG N . 51206 1 154 . 1 . 1 69 69 THR H H 1 8.326 0.00 . . . . . . . 304 THR H . 51206 1 155 . 1 . 1 69 69 THR C C 13 175.071 0.00 . . . . . . . 304 THR C . 51206 1 156 . 1 . 1 69 69 THR CA C 13 61.848 0.00 . . . . . . . 304 THR CA . 51206 1 157 . 1 . 1 69 69 THR CB C 13 69.769 0.00 . . . . . . . 304 THR CB . 51206 1 158 . 1 . 1 69 69 THR N N 15 114.753 0.00 . . . . . . . 304 THR N . 51206 1 159 . 1 . 1 70 70 GLY H H 1 8.523 0.00 . . . . . . . 305 GLY H . 51206 1 160 . 1 . 1 70 70 GLY C C 13 174.429 0.00 . . . . . . . 305 GLY C . 51206 1 161 . 1 . 1 70 70 GLY CA C 13 45.317 0.00 . . . . . . . 305 GLY CA . 51206 1 162 . 1 . 1 70 70 GLY N N 15 111.294 0.01 . . . . . . . 305 GLY N . 51206 1 163 . 1 . 1 71 71 GLY H H 1 8.336 0.00 . . . . . . . 306 GLY H . 51206 1 164 . 1 . 1 71 71 GLY C C 13 173.754 0.00 . . . . . . . 306 GLY C . 51206 1 165 . 1 . 1 71 71 GLY CA C 13 45.005 0.00 . . . . . . . 306 GLY CA . 51206 1 166 . 1 . 1 71 71 GLY N N 15 108.624 0.00 . . . . . . . 306 GLY N . 51206 1 167 . 1 . 1 72 72 PHE H H 1 8.293 0.00 . . . . . . . 307 PHE H . 51206 1 168 . 1 . 1 72 72 PHE C C 13 175.916 0.00 . . . . . . . 307 PHE C . 51206 1 169 . 1 . 1 72 72 PHE CA C 13 57.924 0.00 . . . . . . . 307 PHE CA . 51206 1 170 . 1 . 1 72 72 PHE CB C 13 39.574 0.00 . . . . . . . 307 PHE CB . 51206 1 171 . 1 . 1 72 72 PHE N N 15 120.303 0.00 . . . . . . . 307 PHE N . 51206 1 172 . 1 . 1 73 73 LEU H H 1 8.439 0.00 . . . . . . . 308 LEU H . 51206 1 173 . 1 . 1 73 73 LEU C C 13 177.435 0.00 . . . . . . . 308 LEU C . 51206 1 174 . 1 . 1 73 73 LEU CA C 13 55.091 0.00 . . . . . . . 308 LEU CA . 51206 1 175 . 1 . 1 73 73 LEU CB C 13 42.354 0.00 . . . . . . . 308 LEU CB . 51206 1 176 . 1 . 1 73 73 LEU N N 15 124.767 0.01 . . . . . . . 308 LEU N . 51206 1 177 . 1 . 1 74 74 GLY H H 1 7.953 0.00 . . . . . . . 309 GLY H . 51206 1 178 . 1 . 1 74 74 GLY C C 13 174.056 0.00 . . . . . . . 309 GLY C . 51206 1 179 . 1 . 1 74 74 GLY CA C 13 45.281 0.00 . . . . . . . 309 GLY CA . 51206 1 180 . 1 . 1 74 74 GLY N N 15 109.162 0.00 . . . . . . . 309 GLY N . 51206 1 181 . 1 . 1 75 75 THR H H 1 8.187 0.00 . . . . . . . 310 THR H . 51206 1 182 . 1 . 1 75 75 THR C C 13 174.758 0.00 . . . . . . . 310 THR C . 51206 1 183 . 1 . 1 75 75 THR CA C 13 61.610 0.00 . . . . . . . 310 THR CA . 51206 1 184 . 1 . 1 75 75 THR CB C 13 69.920 0.00 . . . . . . . 310 THR CB . 51206 1 185 . 1 . 1 75 75 THR N N 15 113.439 0.00 . . . . . . . 310 THR N . 51206 1 186 . 1 . 1 76 76 THR H H 1 8.350 0.00 . . . . . . . 311 THR H . 51206 1 187 . 1 . 1 76 76 THR C C 13 174.235 0.00 . . . . . . . 311 THR C . 51206 1 188 . 1 . 1 76 76 THR CA C 13 61.717 0.00 . . . . . . . 311 THR CA . 51206 1 189 . 1 . 1 76 76 THR CB C 13 69.936 0.00 . . . . . . . 311 THR CB . 51206 1 190 . 1 . 1 76 76 THR N N 15 116.482 0.01 . . . . . . . 311 THR N . 51206 1 191 . 1 . 1 77 77 SER H H 1 8.514 0.00 . . . . . . . 312 SER H . 51206 1 192 . 1 . 1 77 77 SER C C 13 172.618 0.00 . . . . . . . 312 SER C . 51206 1 193 . 1 . 1 77 77 SER CA C 13 56.322 0.00 . . . . . . . 312 SER CA . 51206 1 194 . 1 . 1 77 77 SER CB C 13 63.278 0.00 . . . . . . . 312 SER CB . 51206 1 195 . 1 . 1 77 77 SER N N 15 119.990 0.01 . . . . . . . 312 SER N . 51206 1 196 . 1 . 1 78 78 PRO C C 13 177.040 0.00 . . . . . . . 313 PRO C . 51206 1 197 . 1 . 1 78 78 PRO CA C 13 63.358 0.00 . . . . . . . 313 PRO CA . 51206 1 198 . 1 . 1 78 78 PRO CB C 13 32.193 0.00 . . . . . . . 313 PRO CB . 51206 1 199 . 1 . 1 79 79 GLY H H 1 8.345 0.00 . . . . . . . 314 GLY H . 51206 1 200 . 1 . 1 79 79 GLY C C 13 171.741 0.00 . . . . . . . 314 GLY C . 51206 1 201 . 1 . 1 79 79 GLY CA C 13 44.398 0.00 . . . . . . . 314 GLY CA . 51206 1 202 . 1 . 1 79 79 GLY N N 15 109.321 0.01 . . . . . . . 314 GLY N . 51206 1 203 . 1 . 1 80 80 PRO C C 13 177.402 0.00 . . . . . . . 315 PRO C . 51206 1 204 . 1 . 1 80 80 PRO CA C 13 63.301 0.00 . . . . . . . 315 PRO CA . 51206 1 205 . 1 . 1 80 80 PRO CB C 13 32.121 0.00 . . . . . . . 315 PRO CB . 51206 1 206 . 1 . 1 81 81 MET H H 1 8.599 0.00 . . . . . . . 316 MET H . 51206 1 207 . 1 . 1 81 81 MET C C 13 176.193 0.00 . . . . . . . 316 MET C . 51206 1 208 . 1 . 1 81 81 MET CA C 13 55.531 0.00 . . . . . . . 316 MET CA . 51206 1 209 . 1 . 1 81 81 MET CB C 13 32.549 0.00 . . . . . . . 316 MET CB . 51206 1 210 . 1 . 1 81 81 MET N N 15 120.381 0.01 . . . . . . . 316 MET N . 51206 1 211 . 1 . 1 82 82 ALA H H 1 8.311 0.00 . . . . . . . 317 ALA H . 51206 1 212 . 1 . 1 82 82 ALA C C 13 177.891 0.00 . . . . . . . 317 ALA C . 51206 1 213 . 1 . 1 82 82 ALA CA C 13 52.895 0.00 . . . . . . . 317 ALA CA . 51206 1 214 . 1 . 1 82 82 ALA CB C 13 19.223 0.00 . . . . . . . 317 ALA CB . 51206 1 215 . 1 . 1 82 82 ALA N N 15 124.981 0.01 . . . . . . . 317 ALA N . 51206 1 216 . 1 . 1 83 83 GLU H H 1 8.447 0.00 . . . . . . . 318 GLU H . 51206 1 217 . 1 . 1 83 83 GLU C C 13 176.418 0.00 . . . . . . . 318 GLU C . 51206 1 218 . 1 . 1 83 83 GLU CA C 13 56.628 0.00 . . . . . . . 318 GLU CA . 51206 1 219 . 1 . 1 83 83 GLU CB C 13 30.029 0.00 . . . . . . . 318 GLU CB . 51206 1 220 . 1 . 1 83 83 GLU N N 15 119.806 0.00 . . . . . . . 318 GLU N . 51206 1 221 . 1 . 1 84 84 LEU H H 1 8.205 0.00 . . . . . . . 319 LEU H . 51206 1 222 . 1 . 1 84 84 LEU C C 13 177.212 0.00 . . . . . . . 319 LEU C . 51206 1 223 . 1 . 1 84 84 LEU CA C 13 55.297 0.00 . . . . . . . 319 LEU CA . 51206 1 224 . 1 . 1 84 84 LEU CB C 13 42.350 0.00 . . . . . . . 319 LEU CB . 51206 1 225 . 1 . 1 84 84 LEU N N 15 122.771 0.04 . . . . . . . 319 LEU N . 51206 1 226 . 1 . 1 85 85 TYR H H 1 8.271 0.00 . . . . . . . 320 TYR H . 51206 1 227 . 1 . 1 85 85 TYR C C 13 176.459 0.00 . . . . . . . 320 TYR C . 51206 1 228 . 1 . 1 85 85 TYR CA C 13 57.959 0.00 . . . . . . . 320 TYR CA . 51206 1 229 . 1 . 1 85 85 TYR CB C 13 38.570 0.00 . . . . . . . 320 TYR CB . 51206 1 230 . 1 . 1 85 85 TYR N N 15 120.273 0.01 . . . . . . . 320 TYR N . 51206 1 231 . 1 . 1 86 86 GLY H H 1 8.344 0.00 . . . . . . . 321 GLY H . 51206 1 232 . 1 . 1 86 86 GLY C C 13 173.835 0.00 . . . . . . . 321 GLY C . 51206 1 233 . 1 . 1 86 86 GLY CA C 13 45.271 0.00 . . . . . . . 321 GLY CA . 51206 1 234 . 1 . 1 86 86 GLY N N 15 110.590 0.01 . . . . . . . 321 GLY N . 51206 1 235 . 1 . 1 87 87 ALA H H 1 8.188 0.00 . . . . . . . 322 ALA H . 51206 1 236 . 1 . 1 87 87 ALA C C 13 177.670 0.00 . . . . . . . 322 ALA C . 51206 1 237 . 1 . 1 87 87 ALA CA C 13 52.601 0.00 . . . . . . . 322 ALA CA . 51206 1 238 . 1 . 1 87 87 ALA CB C 13 19.307 0.00 . . . . . . . 322 ALA CB . 51206 1 239 . 1 . 1 87 87 ALA N N 15 123.808 0.01 . . . . . . . 322 ALA N . 51206 1 240 . 1 . 1 88 88 ALA H H 1 8.408 0.00 . . . . . . . 323 ALA H . 51206 1 241 . 1 . 1 88 88 ALA C C 13 177.609 0.00 . . . . . . . 323 ALA C . 51206 1 242 . 1 . 1 88 88 ALA CA C 13 52.621 0.00 . . . . . . . 323 ALA CA . 51206 1 243 . 1 . 1 88 88 ALA CB C 13 19.086 0.00 . . . . . . . 323 ALA CB . 51206 1 244 . 1 . 1 88 88 ALA N N 15 122.710 0.01 . . . . . . . 323 ALA N . 51206 1 245 . 1 . 1 89 89 ASN H H 1 8.423 0.00 . . . . . . . 324 ASN H . 51206 1 246 . 1 . 1 89 89 ASN C C 13 175.302 0.00 . . . . . . . 324 ASN C . 51206 1 247 . 1 . 1 89 89 ASN CA C 13 53.318 0.00 . . . . . . . 324 ASN CA . 51206 1 248 . 1 . 1 89 89 ASN CB C 13 38.801 0.00 . . . . . . . 324 ASN CB . 51206 1 249 . 1 . 1 89 89 ASN N N 15 117.530 0.01 . . . . . . . 324 ASN N . 51206 1 250 . 1 . 1 90 90 GLN H H 1 8.462 0.00 . . . . . . . 325 GLN H . 51206 1 251 . 1 . 1 90 90 GLN C C 13 175.738 0.00 . . . . . . . 325 GLN C . 51206 1 252 . 1 . 1 90 90 GLN CA C 13 56.009 0.00 . . . . . . . 325 GLN CA . 51206 1 253 . 1 . 1 90 90 GLN CB C 13 29.404 0.00 . . . . . . . 325 GLN CB . 51206 1 254 . 1 . 1 90 90 GLN N N 15 120.649 0.00 . . . . . . . 325 GLN N . 51206 1 255 . 1 . 1 91 91 ASP H H 1 8.513 0.00 . . . . . . . 326 ASP H . 51206 1 256 . 1 . 1 91 91 ASP C C 13 176.442 0.00 . . . . . . . 326 ASP C . 51206 1 257 . 1 . 1 91 91 ASP CA C 13 54.441 0.00 . . . . . . . 326 ASP CA . 51206 1 258 . 1 . 1 91 91 ASP CB C 13 41.175 0.00 . . . . . . . 326 ASP CB . 51206 1 259 . 1 . 1 91 91 ASP N N 15 121.602 0.01 . . . . . . . 326 ASP N . 51206 1 260 . 1 . 1 92 92 SER H H 1 8.444 0.00 . . . . . . . 327 SER H . 51206 1 261 . 1 . 1 92 92 SER C C 13 175.210 0.00 . . . . . . . 327 SER C . 51206 1 262 . 1 . 1 92 92 SER CA C 13 58.856 0.00 . . . . . . . 327 SER CA . 51206 1 263 . 1 . 1 92 92 SER CB C 13 63.725 0.00 . . . . . . . 327 SER CB . 51206 1 264 . 1 . 1 92 92 SER N N 15 116.962 0.01 . . . . . . . 327 SER N . 51206 1 265 . 1 . 1 93 93 GLY H H 1 8.589 0.00 . . . . . . . 328 GLY H . 51206 1 266 . 1 . 1 93 93 GLY C C 13 174.236 0.00 . . . . . . . 328 GLY C . 51206 1 267 . 1 . 1 93 93 GLY CA C 13 45.387 0.00 . . . . . . . 328 GLY CA . 51206 1 268 . 1 . 1 93 93 GLY N N 15 110.918 0.01 . . . . . . . 328 GLY N . 51206 1 269 . 1 . 1 94 94 VAL H H 1 8.021 0.00 . . . . . . . 329 VAL H . 51206 1 270 . 1 . 1 94 94 VAL C C 13 176.456 0.00 . . . . . . . 329 VAL C . 51206 1 271 . 1 . 1 94 94 VAL CA C 13 62.391 0.00 . . . . . . . 329 VAL CA . 51206 1 272 . 1 . 1 94 94 VAL CB C 13 32.728 0.00 . . . . . . . 329 VAL CB . 51206 1 273 . 1 . 1 94 94 VAL N N 15 119.264 0.01 . . . . . . . 329 VAL N . 51206 1 274 . 1 . 1 95 95 SER H H 1 8.554 0.00 . . . . . . . 330 SER H . 51206 1 275 . 1 . 1 95 95 SER C C 13 174.603 0.00 . . . . . . . 330 SER C . 51206 1 276 . 1 . 1 95 95 SER CA C 13 58.486 0.00 . . . . . . . 330 SER CA . 51206 1 277 . 1 . 1 95 95 SER CB C 13 63.744 0.00 . . . . . . . 330 SER CB . 51206 1 278 . 1 . 1 95 95 SER N N 15 119.516 0.01 . . . . . . . 330 SER N . 51206 1 279 . 1 . 1 96 96 SER H H 1 8.387 0.00 . . . . . . . 331 SER H . 51206 1 280 . 1 . 1 96 96 SER C C 13 173.983 0.00 . . . . . . . 331 SER C . 51206 1 281 . 1 . 1 96 96 SER CA C 13 58.468 0.00 . . . . . . . 331 SER CA . 51206 1 282 . 1 . 1 96 96 SER CB C 13 63.735 0.00 . . . . . . . 331 SER CB . 51206 1 283 . 1 . 1 96 96 SER N N 15 118.072 0.01 . . . . . . . 331 SER N . 51206 1 284 . 1 . 1 97 97 TYR H H 1 8.219 0.00 . . . . . . . 332 TYR H . 51206 1 285 . 1 . 1 97 97 TYR C C 13 175.474 0.00 . . . . . . . 332 TYR C . 51206 1 286 . 1 . 1 97 97 TYR CA C 13 58.144 0.00 . . . . . . . 332 TYR CA . 51206 1 287 . 1 . 1 97 97 TYR CB C 13 38.658 0.00 . . . . . . . 332 TYR CB . 51206 1 288 . 1 . 1 97 97 TYR N N 15 122.270 0.01 . . . . . . . 332 TYR N . 51206 1 289 . 1 . 1 98 98 ILE H H 1 8.046 0.00 . . . . . . . 333 ILE H . 51206 1 290 . 1 . 1 98 98 ILE C C 13 175.792 0.00 . . . . . . . 333 ILE C . 51206 1 291 . 1 . 1 98 98 ILE CA C 13 60.830 0.00 . . . . . . . 333 ILE CA . 51206 1 292 . 1 . 1 98 98 ILE CB C 13 38.807 0.00 . . . . . . . 333 ILE CB . 51206 1 293 . 1 . 1 98 98 ILE N N 15 123.749 0.01 . . . . . . . 333 ILE N . 51206 1 294 . 1 . 1 99 99 SER H H 1 8.389 0.00 . . . . . . . 334 SER H . 51206 1 295 . 1 . 1 99 99 SER C C 13 174.334 0.00 . . . . . . . 334 SER C . 51206 1 296 . 1 . 1 99 99 SER CA C 13 58.210 0.00 . . . . . . . 334 SER CA . 51206 1 297 . 1 . 1 99 99 SER CB C 13 63.858 0.00 . . . . . . . 334 SER CB . 51206 1 298 . 1 . 1 99 99 SER N N 15 120.213 0.01 . . . . . . . 334 SER N . 51206 1 299 . 1 . 1 100 100 ALA H H 1 8.446 0.00 . . . . . . . 335 ALA H . 51206 1 300 . 1 . 1 100 100 ALA C C 13 177.243 0.00 . . . . . . . 335 ALA C . 51206 1 301 . 1 . 1 100 100 ALA CA C 13 52.529 0.00 . . . . . . . 335 ALA CA . 51206 1 302 . 1 . 1 100 100 ALA CB C 13 19.219 0.00 . . . . . . . 335 ALA CB . 51206 1 303 . 1 . 1 100 100 ALA N N 15 126.466 0.01 . . . . . . . 335 ALA N . 51206 1 304 . 1 . 1 101 101 ALA H H 1 8.289 0.00 . . . . . . . 336 ALA H . 51206 1 305 . 1 . 1 101 101 ALA C C 13 177.542 0.00 . . . . . . . 336 ALA C . 51206 1 306 . 1 . 1 101 101 ALA CA C 13 52.280 0.00 . . . . . . . 336 ALA CA . 51206 1 307 . 1 . 1 101 101 ALA CB C 13 19.250 0.00 . . . . . . . 336 ALA CB . 51206 1 308 . 1 . 1 101 101 ALA N N 15 122.898 0.01 . . . . . . . 336 ALA N . 51206 1 309 . 1 . 1 102 102 SER H H 1 8.320 0.00 . . . . . . . 337 SER H . 51206 1 310 . 1 . 1 102 102 SER C C 13 172.304 0.00 . . . . . . . 337 SER C . 51206 1 311 . 1 . 1 102 102 SER CA C 13 56.367 0.00 . . . . . . . 337 SER CA . 51206 1 312 . 1 . 1 102 102 SER CB C 13 63.133 0.00 . . . . . . . 337 SER CB . 51206 1 313 . 1 . 1 102 102 SER N N 15 116.847 0.01 . . . . . . . 337 SER N . 51206 1 314 . 1 . 1 103 103 PRO C C 13 176.277 0.00 . . . . . . . 338 PRO C . 51206 1 315 . 1 . 1 103 103 PRO CA C 13 62.880 0.00 . . . . . . . 338 PRO CA . 51206 1 316 . 1 . 1 103 103 PRO CB C 13 32.081 0.00 . . . . . . . 338 PRO CB . 51206 1 317 . 1 . 1 104 104 ALA H H 1 8.542 0.00 . . . . . . . 339 ALA H . 51206 1 318 . 1 . 1 104 104 ALA C C 13 175.566 0.00 . . . . . . . 339 ALA C . 51206 1 319 . 1 . 1 104 104 ALA CA C 13 50.406 0.00 . . . . . . . 339 ALA CA . 51206 1 320 . 1 . 1 104 104 ALA CB C 13 17.765 0.00 . . . . . . . 339 ALA CB . 51206 1 321 . 1 . 1 104 104 ALA N N 15 126.134 0.01 . . . . . . . 339 ALA N . 51206 1 322 . 1 . 1 105 105 PRO C C 13 177.069 0.00 . . . . . . . 340 PRO C . 51206 1 323 . 1 . 1 105 105 PRO CA C 13 63.035 0.00 . . . . . . . 340 PRO CA . 51206 1 324 . 1 . 1 105 105 PRO CB C 13 32.120 0.00 . . . . . . . 340 PRO CB . 51206 1 325 . 1 . 1 106 106 SER H H 1 8.632 0.00 . . . . . . . 341 SER H . 51206 1 326 . 1 . 1 106 106 SER C C 13 174.949 0.00 . . . . . . . 341 SER C . 51206 1 327 . 1 . 1 106 106 SER CA C 13 58.379 0.00 . . . . . . . 341 SER CA . 51206 1 328 . 1 . 1 106 106 SER CB C 13 63.644 0.00 . . . . . . . 341 SER CB . 51206 1 329 . 1 . 1 106 106 SER N N 15 116.442 0.01 . . . . . . . 341 SER N . 51206 1 330 . 1 . 1 107 107 THR H H 1 8.232 0.00 . . . . . . . 342 THR H . 51206 1 331 . 1 . 1 107 107 THR C C 13 174.999 0.00 . . . . . . . 342 THR C . 51206 1 332 . 1 . 1 107 107 THR CA C 13 61.770 0.00 . . . . . . . 342 THR CA . 51206 1 333 . 1 . 1 107 107 THR CB C 13 69.827 0.00 . . . . . . . 342 THR CB . 51206 1 334 . 1 . 1 107 107 THR N N 15 114.895 0.00 . . . . . . . 342 THR N . 51206 1 335 . 1 . 1 108 108 GLY H H 1 8.406 0.00 . . . . . . . 343 GLY H . 51206 1 336 . 1 . 1 108 108 GLY C C 13 173.824 0.00 . . . . . . . 343 GLY C . 51206 1 337 . 1 . 1 108 108 GLY CA C 13 45.097 0.00 . . . . . . . 343 GLY CA . 51206 1 338 . 1 . 1 108 108 GLY N N 15 110.460 0.00 . . . . . . . 343 GLY N . 51206 1 339 . 1 . 1 109 109 PHE H H 1 8.314 0.00 . . . . . . . 344 PHE H . 51206 1 340 . 1 . 1 109 109 PHE C C 13 176.494 0.00 . . . . . . . 344 PHE C . 51206 1 341 . 1 . 1 109 109 PHE CA C 13 58.086 0.00 . . . . . . . 344 PHE CA . 51206 1 342 . 1 . 1 109 109 PHE CB C 13 39.498 0.00 . . . . . . . 344 PHE CB . 51206 1 343 . 1 . 1 109 109 PHE N N 15 120.131 0.01 . . . . . . . 344 PHE N . 51206 1 344 . 1 . 1 110 110 GLY H H 1 8.542 0.00 . . . . . . . 345 GLY H . 51206 1 345 . 1 . 1 110 110 GLY C C 13 173.873 0.00 . . . . . . . 345 GLY C . 51206 1 346 . 1 . 1 110 110 GLY CA C 13 45.263 0.00 . . . . . . . 345 GLY CA . 51206 1 347 . 1 . 1 110 110 GLY N N 15 110.764 0.01 . . . . . . . 345 GLY N . 51206 1 348 . 1 . 1 111 111 HIS H H 1 8.352 0.00 . . . . . . . 346 HIS H . 51206 1 349 . 1 . 1 111 111 HIS C C 13 174.557 0.00 . . . . . . . 346 HIS C . 51206 1 350 . 1 . 1 111 111 HIS CA C 13 55.284 0.00 . . . . . . . 346 HIS CA . 51206 1 351 . 1 . 1 111 111 HIS CB C 13 29.471 0.00 . . . . . . . 346 HIS CB . 51206 1 352 . 1 . 1 111 111 HIS N N 15 118.327 0.00 . . . . . . . 346 HIS N . 51206 1 353 . 1 . 1 112 112 SER H H 1 8.525 0.00 . . . . . . . 347 SER H . 51206 1 354 . 1 . 1 112 112 SER C C 13 174.578 0.00 . . . . . . . 347 SER C . 51206 1 355 . 1 . 1 112 112 SER CA C 13 58.334 0.00 . . . . . . . 347 SER CA . 51206 1 356 . 1 . 1 112 112 SER CB C 13 63.768 0.00 . . . . . . . 347 SER CB . 51206 1 357 . 1 . 1 112 112 SER N N 15 117.328 0.01 . . . . . . . 347 SER N . 51206 1 358 . 1 . 1 113 113 LEU H H 1 8.614 0.00 . . . . . . . 348 LEU H . 51206 1 359 . 1 . 1 113 113 LEU C C 13 177.838 0.00 . . . . . . . 348 LEU C . 51206 1 360 . 1 . 1 113 113 LEU CA C 13 55.340 0.00 . . . . . . . 348 LEU CA . 51206 1 361 . 1 . 1 113 113 LEU CB C 13 42.208 0.00 . . . . . . . 348 LEU CB . 51206 1 362 . 1 . 1 113 113 LEU N N 15 124.558 0.00 . . . . . . . 348 LEU N . 51206 1 363 . 1 . 1 114 114 GLY H H 1 8.514 0.00 . . . . . . . 349 GLY H . 51206 1 364 . 1 . 1 114 114 GLY C C 13 174.152 0.00 . . . . . . . 349 GLY C . 51206 1 365 . 1 . 1 114 114 GLY CA C 13 45.083 0.00 . . . . . . . 349 GLY CA . 51206 1 366 . 1 . 1 114 114 GLY N N 15 109.624 0.01 . . . . . . . 349 GLY N . 51206 1 367 . 1 . 1 115 115 GLY H H 1 8.205 0.00 . . . . . . . 350 GLY H . 51206 1 368 . 1 . 1 115 115 GLY C C 13 171.697 0.00 . . . . . . . 350 GLY C . 51206 1 369 . 1 . 1 115 115 GLY CA C 13 44.405 0.00 . . . . . . . 350 GLY CA . 51206 1 370 . 1 . 1 115 115 GLY N N 15 109.019 0.01 . . . . . . . 350 GLY N . 51206 1 371 . 1 . 1 116 116 PRO C C 13 176.854 0.00 . . . . . . . 351 PRO C . 51206 1 372 . 1 . 1 116 116 PRO CA C 13 62.995 0.00 . . . . . . . 351 PRO CA . 51206 1 373 . 1 . 1 116 116 PRO CB C 13 32.206 0.00 . . . . . . . 351 PRO CB . 51206 1 374 . 1 . 1 117 117 LEU H H 1 8.469 0.00 . . . . . . . 352 LEU H . 51206 1 375 . 1 . 1 117 117 LEU C C 13 177.299 0.00 . . . . . . . 352 LEU C . 51206 1 376 . 1 . 1 117 117 LEU CA C 13 55.249 0.00 . . . . . . . 352 LEU CA . 51206 1 377 . 1 . 1 117 117 LEU CB C 13 42.037 0.00 . . . . . . . 352 LEU CB . 51206 1 378 . 1 . 1 117 117 LEU N N 15 122.279 0.01 . . . . . . . 352 LEU N . 51206 1 379 . 1 . 1 118 118 ILE H H 1 8.193 0.01 . . . . . . . 353 ILE H . 51206 1 380 . 1 . 1 118 118 ILE C C 13 175.835 0.00 . . . . . . . 353 ILE C . 51206 1 381 . 1 . 1 118 118 ILE CA C 13 60.642 0.00 . . . . . . . 353 ILE CA . 51206 1 382 . 1 . 1 118 118 ILE CB C 13 38.557 0.00 . . . . . . . 353 ILE CB . 51206 1 383 . 1 . 1 118 118 ILE N N 15 122.781 0.10 . . . . . . . 353 ILE N . 51206 1 384 . 1 . 1 119 119 ALA H H 1 8.541 0.00 . . . . . . . 354 ALA H . 51206 1 385 . 1 . 1 119 119 ALA C C 13 177.802 0.00 . . . . . . . 354 ALA C . 51206 1 386 . 1 . 1 119 119 ALA CA C 13 52.642 0.00 . . . . . . . 354 ALA CA . 51206 1 387 . 1 . 1 119 119 ALA CB C 13 19.226 0.00 . . . . . . . 354 ALA CB . 51206 1 388 . 1 . 1 119 119 ALA N N 15 128.778 0.01 . . . . . . . 354 ALA N . 51206 1 389 . 1 . 1 120 120 THR H H 1 8.174 0.00 . . . . . . . 355 THR H . 51206 1 390 . 1 . 1 120 120 THR C C 13 174.263 0.00 . . . . . . . 355 THR C . 51206 1 391 . 1 . 1 120 120 THR CA C 13 61.762 0.00 . . . . . . . 355 THR CA . 51206 1 392 . 1 . 1 120 120 THR CB C 13 69.937 0.00 . . . . . . . 355 THR CB . 51206 1 393 . 1 . 1 120 120 THR N N 15 113.719 0.01 . . . . . . . 355 THR N . 51206 1 394 . 1 . 1 121 121 ALA H H 1 8.337 0.00 . . . . . . . 356 ALA H . 51206 1 395 . 1 . 1 121 121 ALA C C 13 177.470 0.00 . . . . . . . 356 ALA C . 51206 1 396 . 1 . 1 121 121 ALA CA C 13 52.641 0.00 . . . . . . . 356 ALA CA . 51206 1 397 . 1 . 1 121 121 ALA CB C 13 19.130 0.00 . . . . . . . 356 ALA CB . 51206 1 398 . 1 . 1 121 121 ALA N N 15 125.812 0.01 . . . . . . . 356 ALA N . 51206 1 399 . 1 . 1 122 122 PHE H H 1 8.290 0.00 . . . . . . . 357 PHE H . 51206 1 400 . 1 . 1 122 122 PHE C C 13 176.243 0.00 . . . . . . . 357 PHE C . 51206 1 401 . 1 . 1 122 122 PHE CA C 13 57.760 0.00 . . . . . . . 357 PHE CA . 51206 1 402 . 1 . 1 122 122 PHE CB C 13 39.418 0.00 . . . . . . . 357 PHE CB . 51206 1 403 . 1 . 1 122 122 PHE N N 15 119.257 0.00 . . . . . . . 357 PHE N . 51206 1 404 . 1 . 1 123 123 THR H H 1 8.140 0.00 . . . . . . . 358 THR H . 51206 1 405 . 1 . 1 123 123 THR C C 13 174.318 0.00 . . . . . . . 358 THR C . 51206 1 406 . 1 . 1 123 123 THR CA C 13 61.826 0.00 . . . . . . . 358 THR CA . 51206 1 407 . 1 . 1 123 123 THR CB C 13 69.811 0.00 . . . . . . . 358 THR CB . 51206 1 408 . 1 . 1 123 123 THR N N 15 115.290 0.01 . . . . . . . 358 THR N . 51206 1 409 . 1 . 1 124 124 ASN H H 1 8.491 0.00 . . . . . . . 359 ASN H . 51206 1 410 . 1 . 1 124 124 ASN C C 13 175.698 0.00 . . . . . . . 359 ASN C . 51206 1 411 . 1 . 1 124 124 ASN CA C 13 53.531 0.00 . . . . . . . 359 ASN CA . 51206 1 412 . 1 . 1 124 124 ASN CB C 13 38.680 0.00 . . . . . . . 359 ASN CB . 51206 1 413 . 1 . 1 124 124 ASN N N 15 120.799 0.01 . . . . . . . 359 ASN N . 51206 1 414 . 1 . 1 125 125 GLY H H 1 8.403 0.00 . . . . . . . 360 GLY H . 51206 1 415 . 1 . 1 125 125 GLY C C 13 173.840 0.00 . . . . . . . 360 GLY C . 51206 1 416 . 1 . 1 125 125 GLY CA C 13 45.229 0.00 . . . . . . . 360 GLY CA . 51206 1 417 . 1 . 1 125 125 GLY N N 15 108.976 0.01 . . . . . . . 360 GLY N . 51206 1 418 . 1 . 1 126 126 TYR H H 1 8.101 0.00 . . . . . . . 361 TYR H . 51206 1 419 . 1 . 1 126 126 TYR C C 13 175.801 0.00 . . . . . . . 361 TYR C . 51206 1 420 . 1 . 1 126 126 TYR CA C 13 58.413 0.00 . . . . . . . 361 TYR CA . 51206 1 421 . 1 . 1 126 126 TYR CB C 13 38.616 0.00 . . . . . . . 361 TYR CB . 51206 1 422 . 1 . 1 126 126 TYR N N 15 120.355 0.01 . . . . . . . 361 TYR N . 51206 1 423 . 1 . 1 127 127 HIS H H 1 8.348 0.00 . . . . . . . 362 HIS H . 51206 1 424 . 1 . 1 127 127 HIS C C 13 174.203 0.00 . . . . . . . 362 HIS C . 51206 1 425 . 1 . 1 127 127 HIS CA C 13 55.373 0.00 . . . . . . . 362 HIS CA . 51206 1 426 . 1 . 1 127 127 HIS CB C 13 29.479 0.00 . . . . . . . 362 HIS CB . 51206 1 427 . 1 . 1 127 127 HIS N N 15 120.678 0.03 . . . . . . . 362 HIS N . 51206 1 stop_ save_