data_51636 ####################### # Entry information # ####################### save_entry_information_1 _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information_1 _Entry.ID 51636 _Entry.Title ; Backbone 1H, 13C and 15N Assignments of MYC(151-255) ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2022-09-20 _Entry.Accession_date 2022-09-20 _Entry.Last_release_date 2022-09-20 _Entry.Original_release_date 2022-09-20 _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 . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 Stefan Schutz . . . 0000-0002-5148-9999 51636 2 Wolfgang Jahnke . . . 0000-0002-7003-3305 51636 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . 'Novartis Institutes for BioMedical Research, Chemical Biology and Therapeutics, Protein Sciences Basel' . 51636 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 3 51636 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 575 51636 '15N chemical shifts' 125 51636 '1H chemical shifts' 125 51636 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 . . 2024-08-09 . original BMRB . 51636 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 51635 'Backbone 1H, 13C and 15N Assignments of MYC(256-351)' 51636 stop_ save_ ############### # Citations # ############### save_citations_1 _Citation.Sf_category citations _Citation.Sf_framecode citations_1 _Citation.Entry_ID 51636 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 38264995 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; Intrinsically Disordered Regions in the Transcription Factor MYC:MAX Modulate DNA Binding via Intramolecular Interactions ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev Biochemistry _Citation.Journal_name_full Biochemistry _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN 1520-4995 _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first . _Citation.Page_last . _Citation.Year 2024 _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 Stefan Schutz S. . . . 51636 1 2 Christian Bergsdorf C. . . . 51636 1 3 Sandra Hanni-Holzinger S. . . . 51636 1 4 Andreas Lingel A. . . . 51636 1 5 Martin Renatus M. . . . 51636 1 6 Alvar Gossert A. D. . . 51636 1 7 Wolfgang Jahnke W. . . . 51636 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'intramolecular interaction, E-Box, bHLH-LZ, DNA binding domain, intrinsically disordered region' 51636 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly_1 _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly_1 _Assembly.Entry_ID 51636 _Assembly.ID 1 _Assembly.Name MYC(151-255) _Assembly.BMRB_code . _Assembly.Number_of_components 2 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states yes _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange no _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass 10884.5 _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 'MYC(151-255), trans- conformer' 1 $entity_1 . . yes native yes no . . . 51636 1 2 'MYC(151-255), cis- conformer' 1 $entity_1 . . yes native yes no . . . 51636 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 51636 _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 ; SYQAARKDSGSPNPARGHSV CSTSSLYLQDLSAAASECID PSVVFPYPLNDSSSPKSCAS QDSSAFSPSSDSLLSSTESS PQGSPEPLVLHEETPPTTSS DSEEE ; _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 105 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 10884.5 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID 'DNA binding' 51636 1 'Transcription factor' 51636 1 'tumor suppressor' 51636 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 1 151 SER . 51636 1 2 152 TYR . 51636 1 3 153 GLN . 51636 1 4 154 ALA . 51636 1 5 155 ALA . 51636 1 6 156 ARG . 51636 1 7 157 LYS . 51636 1 8 158 ASP . 51636 1 9 159 SER . 51636 1 10 160 GLY . 51636 1 11 161 SER . 51636 1 12 162 PRO . 51636 1 13 163 ASN . 51636 1 14 164 PRO . 51636 1 15 165 ALA . 51636 1 16 166 ARG . 51636 1 17 167 GLY . 51636 1 18 168 HIS . 51636 1 19 169 SER . 51636 1 20 170 VAL . 51636 1 21 171 CYS . 51636 1 22 172 SER . 51636 1 23 173 THR . 51636 1 24 174 SER . 51636 1 25 175 SER . 51636 1 26 176 LEU . 51636 1 27 177 TYR . 51636 1 28 178 LEU . 51636 1 29 179 GLN . 51636 1 30 180 ASP . 51636 1 31 181 LEU . 51636 1 32 182 SER . 51636 1 33 183 ALA . 51636 1 34 184 ALA . 51636 1 35 185 ALA . 51636 1 36 186 SER . 51636 1 37 187 GLU . 51636 1 38 188 CYS . 51636 1 39 189 ILE . 51636 1 40 190 ASP . 51636 1 41 191 PRO . 51636 1 42 192 SER . 51636 1 43 193 VAL . 51636 1 44 194 VAL . 51636 1 45 195 PHE . 51636 1 46 196 PRO . 51636 1 47 197 TYR . 51636 1 48 198 PRO . 51636 1 49 199 LEU . 51636 1 50 200 ASN . 51636 1 51 201 ASP . 51636 1 52 202 SER . 51636 1 53 203 SER . 51636 1 54 204 SER . 51636 1 55 205 PRO . 51636 1 56 206 LYS . 51636 1 57 207 SER . 51636 1 58 208 CYS . 51636 1 59 209 ALA . 51636 1 60 210 SER . 51636 1 61 211 GLN . 51636 1 62 212 ASP . 51636 1 63 213 SER . 51636 1 64 214 SER . 51636 1 65 215 ALA . 51636 1 66 216 PHE . 51636 1 67 217 SER . 51636 1 68 218 PRO . 51636 1 69 219 SER . 51636 1 70 220 SER . 51636 1 71 221 ASP . 51636 1 72 222 SER . 51636 1 73 223 LEU . 51636 1 74 224 LEU . 51636 1 75 225 SER . 51636 1 76 226 SER . 51636 1 77 227 THR . 51636 1 78 228 GLU . 51636 1 79 229 SER . 51636 1 80 230 SER . 51636 1 81 231 PRO . 51636 1 82 232 GLN . 51636 1 83 233 GLY . 51636 1 84 234 SER . 51636 1 85 235 PRO . 51636 1 86 236 GLU . 51636 1 87 237 PRO . 51636 1 88 238 LEU . 51636 1 89 239 VAL . 51636 1 90 240 LEU . 51636 1 91 241 HIS . 51636 1 92 242 GLU . 51636 1 93 243 GLU . 51636 1 94 244 THR . 51636 1 95 245 PRO . 51636 1 96 246 PRO . 51636 1 97 247 THR . 51636 1 98 248 THR . 51636 1 99 249 SER . 51636 1 100 250 SER . 51636 1 101 251 ASP . 51636 1 102 252 SER . 51636 1 103 253 GLU . 51636 1 104 254 GLU . 51636 1 105 255 GLU . 51636 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 . SER 1 1 51636 1 . TYR 2 2 51636 1 . GLN 3 3 51636 1 . ALA 4 4 51636 1 . ALA 5 5 51636 1 . ARG 6 6 51636 1 . LYS 7 7 51636 1 . ASP 8 8 51636 1 . SER 9 9 51636 1 . GLY 10 10 51636 1 . SER 11 11 51636 1 . PRO 12 12 51636 1 . ASN 13 13 51636 1 . PRO 14 14 51636 1 . ALA 15 15 51636 1 . ARG 16 16 51636 1 . GLY 17 17 51636 1 . HIS 18 18 51636 1 . SER 19 19 51636 1 . VAL 20 20 51636 1 . CYS 21 21 51636 1 . SER 22 22 51636 1 . THR 23 23 51636 1 . SER 24 24 51636 1 . SER 25 25 51636 1 . LEU 26 26 51636 1 . TYR 27 27 51636 1 . LEU 28 28 51636 1 . GLN 29 29 51636 1 . ASP 30 30 51636 1 . LEU 31 31 51636 1 . SER 32 32 51636 1 . ALA 33 33 51636 1 . ALA 34 34 51636 1 . ALA 35 35 51636 1 . SER 36 36 51636 1 . GLU 37 37 51636 1 . CYS 38 38 51636 1 . ILE 39 39 51636 1 . ASP 40 40 51636 1 . PRO 41 41 51636 1 . SER 42 42 51636 1 . VAL 43 43 51636 1 . VAL 44 44 51636 1 . PHE 45 45 51636 1 . PRO 46 46 51636 1 . TYR 47 47 51636 1 . PRO 48 48 51636 1 . LEU 49 49 51636 1 . ASN 50 50 51636 1 . ASP 51 51 51636 1 . SER 52 52 51636 1 . SER 53 53 51636 1 . SER 54 54 51636 1 . PRO 55 55 51636 1 . LYS 56 56 51636 1 . SER 57 57 51636 1 . CYS 58 58 51636 1 . ALA 59 59 51636 1 . SER 60 60 51636 1 . GLN 61 61 51636 1 . ASP 62 62 51636 1 . SER 63 63 51636 1 . SER 64 64 51636 1 . ALA 65 65 51636 1 . PHE 66 66 51636 1 . SER 67 67 51636 1 . PRO 68 68 51636 1 . SER 69 69 51636 1 . SER 70 70 51636 1 . ASP 71 71 51636 1 . SER 72 72 51636 1 . LEU 73 73 51636 1 . LEU 74 74 51636 1 . SER 75 75 51636 1 . SER 76 76 51636 1 . THR 77 77 51636 1 . GLU 78 78 51636 1 . SER 79 79 51636 1 . SER 80 80 51636 1 . PRO 81 81 51636 1 . GLN 82 82 51636 1 . GLY 83 83 51636 1 . SER 84 84 51636 1 . PRO 85 85 51636 1 . GLU 86 86 51636 1 . PRO 87 87 51636 1 . LEU 88 88 51636 1 . VAL 89 89 51636 1 . LEU 90 90 51636 1 . HIS 91 91 51636 1 . GLU 92 92 51636 1 . GLU 93 93 51636 1 . THR 94 94 51636 1 . PRO 95 95 51636 1 . PRO 96 96 51636 1 . THR 97 97 51636 1 . THR 98 98 51636 1 . SER 99 99 51636 1 . SER 100 100 51636 1 . ASP 101 101 51636 1 . SER 102 102 51636 1 . GLU 103 103 51636 1 . GLU 104 104 51636 1 . GLU 105 105 51636 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 51636 _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 . . . . . . . . . . . . . 51636 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 51636 _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 BL21(DE3) . . plasmid . . pET-like . . 'TEV protease cleavable ZZ tag' 51636 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 51636 _Sample.ID 1 _Sample.Name MYC(151-255) _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 MYC(256-351) '[U-99% 13C; U-99% 15N]' . . 1 $entity_1 . . 0.665 . . mM . . . . 51636 1 2 D2O '[U-99% 2H]' . . . . . . 5 . . v/v . . . . 51636 1 3 HEPES 'natural abundance' . . . . . . 20 . . mM . . . . 51636 1 4 'sodium chloride' 'natural abundance' . . . . . . 100 . . mM . . . . 51636 1 5 TCEP 'natural abundance' . . . . . . 2 . . mM . . . . 51636 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 51636 _Sample_condition_list.ID 1 _Sample_condition_list.Name 'Assignment 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 pH 7 . pH 51636 1 pressure 1 . atm 51636 1 temperature 283 . K 51636 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 51636 _Software.ID 1 _Software.Type . _Software.Name TOPSPIN _Software.Version 3.2 _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID collection . 51636 1 'data analysis' . 51636 1 processing . 51636 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 51636 _Software.ID 2 _Software.Type . _Software.Name CcpNMR _Software.Version 3.0 _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 51636 2 'data analysis' . 51636 2 'peak picking' . 51636 2 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 51636 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name av800 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE III' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 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 51636 _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 . . . . . . . . . . . . . . . . . 51636 1 2 '3D CBCA(CO)NH' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51636 1 3 '3D CBCANH' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51636 1 4 '3D HN(CA)CO' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51636 1 5 '3D HNCO' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51636 1 6 '3D C(CO)NH' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51636 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 51636 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name none _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 TMS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . 51636 1 H 1 TMS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . 51636 1 N 15 TMS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . 51636 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 51636 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name 'Assignment of MYC(151-255)' _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 2 '3D CBCA(CO)NH' . . . 51636 1 3 '3D CBCANH' . . . 51636 1 4 '3D HN(CA)CO' . . . 51636 1 5 '3D HNCO' . . . 51636 1 6 '3D C(CO)NH' . . . 51636 1 stop_ loop_ _Systematic_chem_shift_offset.Type _Systematic_chem_shift_offset.Atom_type _Systematic_chem_shift_offset.Atom_isotope_number _Systematic_chem_shift_offset.Val _Systematic_chem_shift_offset.Val_err _Systematic_chem_shift_offset.Entry_ID _Systematic_chem_shift_offset.Assigned_chem_shift_list_ID na 'all 13C' 13 2.66 . 51636 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 $software_2 . . 51636 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 TYR C C 13 175.207 0.00711537 . 1 . . . . . 152 TYR C . 51636 1 2 . 1 . 1 2 2 TYR CA C 13 57.9143 0 . 1 . . . . . 152 TYR CA . 51636 1 3 . 1 . 1 2 2 TYR CB C 13 38.3847 0 . 1 . . . . . 152 TYR CB . 51636 1 4 . 1 . 1 3 3 GLN H H 1 8.051672408 0.001005161 . 1 . . . . . 153 GLN H . 51636 1 5 . 1 . 1 3 3 GLN C C 13 174.5 0.013403101 . 1 . . . . . 153 GLN C . 51636 1 6 . 1 . 1 3 3 GLN CA C 13 54.7314 0.002546704 . 1 . . . . . 153 GLN CA . 51636 1 7 . 1 . 1 3 3 GLN CB C 13 29.3494 0.026842114 . 1 . . . . . 153 GLN CB . 51636 1 8 . 1 . 1 3 3 GLN CG C 13 33.2138 0 . 1 . . . . . 153 GLN CG . 51636 1 9 . 1 . 1 3 3 GLN N N 15 123.9146202 0.04459405 . 1 . . . . . 153 GLN N . 51636 1 10 . 1 . 1 4 4 ALA H H 1 8.064266613 0.000646496 . 1 . . . . . 154 ALA H . 51636 1 11 . 1 . 1 4 4 ALA C C 13 177.194 0.001784854 . 1 . . . . . 154 ALA C . 51636 1 12 . 1 . 1 4 4 ALA CA C 13 51.9756 0.006722748 . 1 . . . . . 154 ALA CA . 51636 1 13 . 1 . 1 4 4 ALA CB C 13 18.7091 0.022480157 . 1 . . . . . 154 ALA CB . 51636 1 14 . 1 . 1 4 4 ALA N N 15 125.8212225 0.034386327 . 1 . . . . . 154 ALA N . 51636 1 15 . 1 . 1 5 5 ALA H H 1 8.117697753 0.000237908 . 1 . . . . . 155 ALA H . 51636 1 16 . 1 . 1 5 5 ALA C C 13 177.5 0.021561271 . 1 . . . . . 155 ALA C . 51636 1 17 . 1 . 1 5 5 ALA CA C 13 51.9148 0.051861213 . 1 . . . . . 155 ALA CA . 51636 1 18 . 1 . 1 5 5 ALA CB C 13 18.6795 0.069198125 . 1 . . . . . 155 ALA CB . 51636 1 19 . 1 . 1 5 5 ALA N N 15 123.0794748 0.068646988 . 1 . . . . . 155 ALA N . 51636 1 20 . 1 . 1 6 6 ARG H H 1 8.148800655 0.000415845 . 1 . . . . . 156 ARG H . 51636 1 21 . 1 . 1 6 6 ARG C C 13 176.249 0.012968115 . 1 . . . . . 156 ARG C . 51636 1 22 . 1 . 1 6 6 ARG CA C 13 55.5314 0.024794394 . 1 . . . . . 156 ARG CA . 51636 1 23 . 1 . 1 6 6 ARG CB C 13 30.5485 0.017513831 . 1 . . . . . 156 ARG CB . 51636 1 24 . 1 . 1 6 6 ARG CD C 13 42.9528 0 . 1 . . . . . 156 ARG CD . 51636 1 25 . 1 . 1 6 6 ARG CG C 13 26.7443 0 . 1 . . . . . 156 ARG CG . 51636 1 26 . 1 . 1 6 6 ARG N N 15 120.6421018 0.044953083 . 1 . . . . . 156 ARG N . 51636 1 27 . 1 . 1 7 7 LYS H H 1 8.336571479 0.000801268 . 1 . . . . . 157 LYS H . 51636 1 28 . 1 . 1 7 7 LYS C C 13 176.024 0.006342023 . 1 . . . . . 157 LYS C . 51636 1 29 . 1 . 1 7 7 LYS CA C 13 55.9538 0.018437806 . 1 . . . . . 157 LYS CA . 51636 1 30 . 1 . 1 7 7 LYS CB C 13 32.5337 0.007856224 . 1 . . . . . 157 LYS CB . 51636 1 31 . 1 . 1 7 7 LYS CD C 13 28.6844 0 . 1 . . . . . 157 LYS CD . 51636 1 32 . 1 . 1 7 7 LYS CE C 13 41.7668 0 . 1 . . . . . 157 LYS CE . 51636 1 33 . 1 . 1 7 7 LYS CG C 13 24.2502 0 . 1 . . . . . 157 LYS CG . 51636 1 34 . 1 . 1 7 7 LYS N N 15 123.1293666 0.04322435 . 1 . . . . . 157 LYS N . 51636 1 35 . 1 . 1 8 8 ASP H H 1 8.254817451 0.000189869 . 1 . . . . . 158 ASP H . 51636 1 36 . 1 . 1 8 8 ASP C C 13 176.075 0.014904696 . 1 . . . . . 158 ASP C . 51636 1 37 . 1 . 1 8 8 ASP CA C 13 53.718 0.008501447 . 1 . . . . . 158 ASP CA . 51636 1 38 . 1 . 1 8 8 ASP CB C 13 40.7753 0.03196252 . 1 . . . . . 158 ASP CB . 51636 1 39 . 1 . 1 8 8 ASP N N 15 121.2747104 0.072808232 . 1 . . . . . 158 ASP N . 51636 1 40 . 1 . 1 9 9 SER H H 1 8.16373515 0.000217724 . 1 . . . . . 159 SER H . 51636 1 41 . 1 . 1 9 9 SER C C 13 174.868 0.004316665 . 1 . . . . . 159 SER C . 51636 1 42 . 1 . 1 9 9 SER CA C 13 58.3474 0.013347709 . 1 . . . . . 159 SER CA . 51636 1 43 . 1 . 1 9 9 SER CB C 13 63.3663 0.00746354 . 1 . . . . . 159 SER CB . 51636 1 44 . 1 . 1 9 9 SER N N 15 116.2486312 0.085895377 . 1 . . . . . 159 SER N . 51636 1 45 . 1 . 1 10 10 GLY H H 1 8.319494169 0.000247991 . 1 . . . . . 160 GLY H . 51636 1 46 . 1 . 1 10 10 GLY C C 13 173.62 0.005156934 . 1 . . . . . 160 GLY C . 51636 1 47 . 1 . 1 10 10 GLY CA C 13 44.6239 0.023402353 . 1 . . . . . 160 GLY CA . 51636 1 48 . 1 . 1 10 10 GLY N N 15 110.4594771 0.045712651 . 1 . . . . . 160 GLY N . 51636 1 49 . 1 . 1 11 11 SER H H 1 7.980490543 0.000369948 . 1 . . . . . 161 SER H . 51636 1 50 . 1 . 1 11 11 SER C C 13 172.432 0 . 1 . . . . . 161 SER C . 51636 1 51 . 1 . 1 11 11 SER CA C 13 55.9706 0 . 1 . . . . . 161 SER CA . 51636 1 52 . 1 . 1 11 11 SER CB C 13 62.8832 0 . 1 . . . . . 161 SER CB . 51636 1 53 . 1 . 1 11 11 SER N N 15 116.577968 0.051093389 . 1 . . . . . 161 SER N . 51636 1 54 . 1 . 1 12 12 PRO C C 13 176.154 0.003029509 . 1 . . . . . 162 PRO C . 51636 1 55 . 1 . 1 12 12 PRO CA C 13 62.7098 0 . 1 . . . . . 162 PRO CA . 51636 1 56 . 1 . 1 12 12 PRO CB C 13 31.6155 0.000000477 . 1 . . . . . 162 PRO CB . 51636 1 57 . 1 . 1 12 12 PRO CD C 13 50.4195 0 . 1 . . . . . 162 PRO CD . 51636 1 58 . 1 . 1 12 12 PRO CG C 13 26.8893 0 . 1 . . . . . 162 PRO CG . 51636 1 59 . 1 . 1 13 13 ASN H H 1 8.35112456 0.000428389 . 1 . . . . . 163 ASN H . 51636 1 60 . 1 . 1 13 13 ASN C C 13 173.202 0 . 1 . . . . . 163 ASN C . 51636 1 61 . 1 . 1 13 13 ASN CA C 13 50.734 0 . 1 . . . . . 163 ASN CA . 51636 1 62 . 1 . 1 13 13 ASN CB C 13 38.2208 0 . 1 . . . . . 163 ASN CB . 51636 1 63 . 1 . 1 13 13 ASN N N 15 119.687459 0.044371108 . 1 . . . . . 163 ASN N . 51636 1 64 . 1 . 1 14 14 PRO C C 13 176.431 0.000312281 . 1 . . . . . 164 PRO C . 51636 1 65 . 1 . 1 14 14 PRO CA C 13 62.9134 0.000000674 . 1 . . . . . 164 PRO CA . 51636 1 66 . 1 . 1 14 14 PRO CB C 13 31.6188 0 . 1 . . . . . 164 PRO CB . 51636 1 67 . 1 . 1 14 14 PRO CD C 13 50.3901 0 . 1 . . . . . 164 PRO CD . 51636 1 68 . 1 . 1 14 14 PRO CG C 13 26.7411 0 . 1 . . . . . 164 PRO CG . 51636 1 69 . 1 . 1 15 15 ALA H H 1 8.123506212 0.00156578 . 1 . . . . . 165 ALA H . 51636 1 70 . 1 . 1 15 15 ALA C C 13 177.606 0.013160421 . 1 . . . . . 165 ALA C . 51636 1 71 . 1 . 1 15 15 ALA CA C 13 52.0555 0.037341904 . 1 . . . . . 165 ALA CA . 51636 1 72 . 1 . 1 15 15 ALA CB C 13 18.5337 0.029061114 . 1 . . . . . 165 ALA CB . 51636 1 73 . 1 . 1 15 15 ALA N N 15 123.2468249 0.043981432 . 1 . . . . . 165 ALA N . 51636 1 74 . 1 . 1 16 16 ARG H H 1 8.015391773 0.000349586 . 1 . . . . . 166 ARG H . 51636 1 75 . 1 . 1 16 16 ARG C C 13 176.56 0.009741904 . 1 . . . . . 166 ARG C . 51636 1 76 . 1 . 1 16 16 ARG CA C 13 55.7259 0.008319528 . 1 . . . . . 166 ARG CA . 51636 1 77 . 1 . 1 16 16 ARG CB C 13 30.3197 0.018690896 . 1 . . . . . 166 ARG CB . 51636 1 78 . 1 . 1 16 16 ARG CD C 13 42.9692 0 . 1 . . . . . 166 ARG CD . 51636 1 79 . 1 . 1 16 16 ARG CG C 13 26.836 0 . 1 . . . . . 166 ARG CG . 51636 1 80 . 1 . 1 16 16 ARG N N 15 119.767067 0.04174991 . 1 . . . . . 166 ARG N . 51636 1 81 . 1 . 1 17 17 GLY H H 1 8.190048191 0.000423668 . 1 . . . . . 167 GLY H . 51636 1 82 . 1 . 1 17 17 GLY C C 13 173.529 0.001760211 . 1 . . . . . 167 GLY C . 51636 1 83 . 1 . 1 17 17 GLY CA C 13 44.7093 0.06174932 . 1 . . . . . 167 GLY CA . 51636 1 84 . 1 . 1 17 17 GLY N N 15 109.4619202 0.063403683 . 1 . . . . . 167 GLY N . 51636 1 85 . 1 . 1 18 18 HIS H H 1 8.029778196 0.000865456 . 1 . . . . . 168 HIS H . 51636 1 86 . 1 . 1 18 18 HIS C C 13 175.069 0.006879298 . 1 . . . . . 168 HIS C . 51636 1 87 . 1 . 1 18 18 HIS CA C 13 55.6975 0.001581442 . 1 . . . . . 168 HIS CA . 51636 1 88 . 1 . 1 18 18 HIS CB C 13 30.3212 0.023063417 . 1 . . . . . 168 HIS CB . 51636 1 89 . 1 . 1 18 18 HIS N N 15 118.9565842 0.048056312 . 1 . . . . . 168 HIS N . 51636 1 90 . 1 . 1 19 19 SER H H 1 8.157371687 0.000908262 . 1 . . . . . 169 SER H . 51636 1 91 . 1 . 1 19 19 SER C C 13 174.117 0.023448604 . 1 . . . . . 169 SER C . 51636 1 92 . 1 . 1 19 19 SER CA C 13 57.7597 0.012068725 . 1 . . . . . 169 SER CA . 51636 1 93 . 1 . 1 19 19 SER CB C 13 63.4087 0.000446582 . 1 . . . . . 169 SER CB . 51636 1 94 . 1 . 1 19 19 SER N N 15 117.1399491 0.028134501 . 1 . . . . . 169 SER N . 51636 1 95 . 1 . 1 20 20 VAL H H 1 8.120523158 0.00019046 . 1 . . . . . 170 VAL H . 51636 1 96 . 1 . 1 20 20 VAL C C 13 175.807 0.011415246 . 1 . . . . . 170 VAL C . 51636 1 97 . 1 . 1 20 20 VAL CA C 13 61.8414 0.004116655 . 1 . . . . . 170 VAL CA . 51636 1 98 . 1 . 1 20 20 VAL CB C 13 32.314 0.022252487 . 1 . . . . . 170 VAL CB . 51636 1 99 . 1 . 1 20 20 VAL CG1 C 13 20.067 0 . 2 . . . . . 170 VAL CG1 . 51636 1 100 . 1 . 1 20 20 VAL CG2 C 13 20.7902 0 . 2 . . . . . 170 VAL CG2 . 51636 1 101 . 1 . 1 20 20 VAL N N 15 121.4432729 0.046653885 . 1 . . . . . 170 VAL N . 51636 1 102 . 1 . 1 21 21 CYS H H 1 8.293845349 0.001179232 . 1 . . . . . 171 CYS H . 51636 1 103 . 1 . 1 21 21 CYS C C 13 174.555 0.006602365 . 1 . . . . . 171 CYS C . 51636 1 104 . 1 . 1 21 21 CYS CA C 13 58.1084 0.012865664 . 1 . . . . . 171 CYS CA . 51636 1 105 . 1 . 1 21 21 CYS CB C 13 27.614 0.041517221 . 1 . . . . . 171 CYS CB . 51636 1 106 . 1 . 1 21 21 CYS N N 15 122.819944 0.051871354 . 1 . . . . . 171 CYS N . 51636 1 107 . 1 . 1 22 22 SER H H 1 8.378056984 0.000499874 . 1 . . . . . 172 SER H . 51636 1 108 . 1 . 1 22 22 SER C C 13 174.804 0 . 1 . . . . . 172 SER C . 51636 1 109 . 1 . 1 22 22 SER CA C 13 58.1048 0.040147838 . 1 . . . . . 172 SER CA . 51636 1 110 . 1 . 1 22 22 SER CB C 13 63.3348 0.01870874 . 1 . . . . . 172 SER CB . 51636 1 111 . 1 . 1 22 22 SER N N 15 118.9767953 0.043484928 . 1 . . . . . 172 SER N . 51636 1 112 . 1 . 1 23 23 THR H H 1 8.051113858 0.001377868 . 1 . . . . . 173 THR H . 51636 1 113 . 1 . 1 23 23 THR C C 13 174.603 0.004220573 . 1 . . . . . 173 THR C . 51636 1 114 . 1 . 1 23 23 THR CA C 13 61.6507 0.010731772 . 1 . . . . . 173 THR CA . 51636 1 115 . 1 . 1 23 23 THR CB C 13 69.1173 0.093144056 . 1 . . . . . 173 THR CB . 51636 1 116 . 1 . 1 23 23 THR CG2 C 13 21.2472 0 . 1 . . . . . 173 THR CG2 . 51636 1 117 . 1 . 1 23 23 THR N N 15 115.4161673 0.027910019 . 1 . . . . . 173 THR N . 51636 1 118 . 1 . 1 24 24 SER H H 1 8.074533327 0.000319137 . 1 . . . . . 174 SER H . 51636 1 119 . 1 . 1 24 24 SER C C 13 174.664 0 . 1 . . . . . 174 SER C . 51636 1 120 . 1 . 1 24 24 SER CA C 13 58.118 0.011728218 . 1 . . . . . 174 SER CA . 51636 1 121 . 1 . 1 24 24 SER CB C 13 63.3706 0.013036853 . 1 . . . . . 174 SER CB . 51636 1 122 . 1 . 1 24 24 SER N N 15 117.4566433 0.04739338 . 1 . . . . . 174 SER N . 51636 1 123 . 1 . 1 25 25 SER H H 1 8.197986715 0.000687771 . 1 . . . . . 175 SER H . 51636 1 124 . 1 . 1 25 25 SER C C 13 174.405 0 . 1 . . . . . 175 SER C . 51636 1 125 . 1 . 1 25 25 SER CA C 13 58.3642 0.002590953 . 1 . . . . . 175 SER CA . 51636 1 126 . 1 . 1 25 25 SER CB C 13 63.1306 0.008196692 . 1 . . . . . 175 SER CB . 51636 1 127 . 1 . 1 25 25 SER N N 15 117.9928658 0.029738087 . 1 . . . . . 175 SER N . 51636 1 128 . 1 . 1 26 26 LEU H H 1 7.923684836 0.000295067 . 1 . . . . . 176 LEU H . 51636 1 129 . 1 . 1 26 26 LEU C C 13 176.923 0.002923594 . 1 . . . . . 176 LEU C . 51636 1 130 . 1 . 1 26 26 LEU CA C 13 55.2814 0.004887632 . 1 . . . . . 176 LEU CA . 51636 1 131 . 1 . 1 26 26 LEU CB C 13 41.6936 0.002838929 . 1 . . . . . 176 LEU CB . 51636 1 132 . 1 . 1 26 26 LEU CD1 C 13 23.0273 0 . 2 . . . . . 176 LEU CD1 . 51636 1 133 . 1 . 1 26 26 LEU CD2 C 13 24.3935 0 . 2 . . . . . 176 LEU CD2 . 51636 1 134 . 1 . 1 26 26 LEU CG C 13 26.4801 0 . 1 . . . . . 176 LEU CG . 51636 1 135 . 1 . 1 26 26 LEU N N 15 123.23157 0.038770045 . 1 . . . . . 176 LEU N . 51636 1 136 . 1 . 1 27 27 TYR H H 1 7.810541831 0.000454074 . 1 . . . . . 177 TYR H . 51636 1 137 . 1 . 1 27 27 TYR C C 13 175.489 0.005253099 . 1 . . . . . 177 TYR C . 51636 1 138 . 1 . 1 27 27 TYR CA C 13 57.5274 0.030451745 . 1 . . . . . 177 TYR CA . 51636 1 139 . 1 . 1 27 27 TYR CB C 13 38.0001 0.042398787 . 1 . . . . . 177 TYR CB . 51636 1 140 . 1 . 1 27 27 TYR N N 15 119.5647192 0.032222214 . 1 . . . . . 177 TYR N . 51636 1 141 . 1 . 1 28 28 LEU H H 1 7.788724757 0.000537511 . 1 . . . . . 178 LEU H . 51636 1 142 . 1 . 1 28 28 LEU C C 13 176.959 0.008305388 . 1 . . . . . 178 LEU C . 51636 1 143 . 1 . 1 28 28 LEU CA C 13 54.7852 0.02395053 . 1 . . . . . 178 LEU CA . 51636 1 144 . 1 . 1 28 28 LEU CB C 13 41.7347 0.014351053 . 1 . . . . . 178 LEU CB . 51636 1 145 . 1 . 1 28 28 LEU CD1 C 13 23.0511 0 . 2 . . . . . 178 LEU CD1 . 51636 1 146 . 1 . 1 28 28 LEU CD2 C 13 24.6311 0 . 2 . . . . . 178 LEU CD2 . 51636 1 147 . 1 . 1 28 28 LEU CG C 13 26.3451 0 . 1 . . . . . 178 LEU CG . 51636 1 148 . 1 . 1 28 28 LEU N N 15 122.8323079 0.037117986 . 1 . . . . . 178 LEU N . 51636 1 149 . 1 . 1 29 29 GLN H H 1 7.999147165 0.000524663 . 1 . . . . . 179 GLN H . 51636 1 150 . 1 . 1 29 29 GLN C C 13 175.404 0.002102423 . 1 . . . . . 179 GLN C . 51636 1 151 . 1 . 1 29 29 GLN CA C 13 55.7569 0.006049385 . 1 . . . . . 179 GLN CA . 51636 1 152 . 1 . 1 29 29 GLN CB C 13 29.0681 0.001143657 . 1 . . . . . 179 GLN CB . 51636 1 153 . 1 . 1 29 29 GLN CG C 13 33.4442 0 . 1 . . . . . 179 GLN CG . 51636 1 154 . 1 . 1 29 29 GLN N N 15 120.3573796 0.03566764 . 1 . . . . . 179 GLN N . 51636 1 155 . 1 . 1 30 30 ASP H H 1 8.140450952 0.001750225 . 1 . . . . . 180 ASP H . 51636 1 156 . 1 . 1 30 30 ASP C C 13 176.415 0.005279654 . 1 . . . . . 180 ASP C . 51636 1 157 . 1 . 1 30 30 ASP CA C 13 53.7636 0.024029956 . 1 . . . . . 180 ASP CA . 51636 1 158 . 1 . 1 30 30 ASP CB C 13 40.418 0.0000199 . 1 . . . . . 180 ASP CB . 51636 1 159 . 1 . 1 30 30 ASP N N 15 121.3080335 0.00000135 . 1 . . . . . 180 ASP N . 51636 1 160 . 1 . 1 31 31 LEU H H 1 8.156662123 0.000431711 . 1 . . . . . 181 LEU H . 51636 1 161 . 1 . 1 31 31 LEU C C 13 177.812 0.007296806 . 1 . . . . . 181 LEU C . 51636 1 162 . 1 . 1 31 31 LEU CA C 13 55.1304 0.002980949 . 1 . . . . . 181 LEU CA . 51636 1 163 . 1 . 1 31 31 LEU CB C 13 41.3241 0.007869221 . 1 . . . . . 181 LEU CB . 51636 1 164 . 1 . 1 31 31 LEU CD1 C 13 22.8258 0 . 2 . . . . . 181 LEU CD1 . 51636 1 165 . 1 . 1 31 31 LEU CD2 C 13 24.759 0 . 2 . . . . . 181 LEU CD2 . 51636 1 166 . 1 . 1 31 31 LEU CG C 13 26.6427 0 . 1 . . . . . 181 LEU CG . 51636 1 167 . 1 . 1 31 31 LEU N N 15 123.5327025 0.048486273 . 1 . . . . . 181 LEU N . 51636 1 168 . 1 . 1 32 32 SER H H 1 8.136020794 0.00029706 . 1 . . . . . 182 SER H . 51636 1 169 . 1 . 1 32 32 SER C C 13 174.531 0.026846196 . 1 . . . . . 182 SER C . 51636 1 170 . 1 . 1 32 32 SER CA C 13 58.7496 0.007392607 . 1 . . . . . 182 SER CA . 51636 1 171 . 1 . 1 32 32 SER CB C 13 63.2181 0.017701848 . 1 . . . . . 182 SER CB . 51636 1 172 . 1 . 1 32 32 SER N N 15 115.9791267 0.042987345 . 1 . . . . . 182 SER N . 51636 1 173 . 1 . 1 33 33 ALA H H 1 7.945053239 0.000338757 . 1 . . . . . 183 ALA H . 51636 1 174 . 1 . 1 33 33 ALA C C 13 177.587 0.000979102 . 1 . . . . . 183 ALA C . 51636 1 175 . 1 . 1 33 33 ALA CA C 13 52.2668 0.04199078 . 1 . . . . . 183 ALA CA . 51636 1 176 . 1 . 1 33 33 ALA CB C 13 18.5706 0.002558725 . 1 . . . . . 183 ALA CB . 51636 1 177 . 1 . 1 33 33 ALA N N 15 125.2982706 0.046322411 . 1 . . . . . 183 ALA N . 51636 1 178 . 1 . 1 34 34 ALA H H 1 7.923778416 0.000181125 . 1 . . . . . 184 ALA H . 51636 1 179 . 1 . 1 34 34 ALA C C 13 177.678 0.012332312 . 1 . . . . . 184 ALA C . 51636 1 180 . 1 . 1 34 34 ALA CA C 13 52.2393 0.014402622 . 1 . . . . . 184 ALA CA . 51636 1 181 . 1 . 1 34 34 ALA CB C 13 18.5608 0.015197688 . 1 . . . . . 184 ALA CB . 51636 1 182 . 1 . 1 34 34 ALA N N 15 122.3348268 0.044549938 . 1 . . . . . 184 ALA N . 51636 1 183 . 1 . 1 35 35 ALA H H 1 8.002557511 0.000168481 . 1 . . . . . 185 ALA H . 51636 1 184 . 1 . 1 35 35 ALA C C 13 177.868 0.020509813 . 1 . . . . . 185 ALA C . 51636 1 185 . 1 . 1 35 35 ALA CA C 13 52.2872 0.04094916 . 1 . . . . . 185 ALA CA . 51636 1 186 . 1 . 1 35 35 ALA CB C 13 18.5853 0.015538337 . 1 . . . . . 185 ALA CB . 51636 1 187 . 1 . 1 35 35 ALA N N 15 122.7972035 0.078015063 . 1 . . . . . 185 ALA N . 51636 1 188 . 1 . 1 36 36 SER H H 1 8.014885853 0.00057743 . 1 . . . . . 186 SER H . 51636 1 189 . 1 . 1 36 36 SER C C 13 174.355 0.010378019 . 1 . . . . . 186 SER C . 51636 1 190 . 1 . 1 36 36 SER CA C 13 58.2075 0.022490084 . 1 . . . . . 186 SER CA . 51636 1 191 . 1 . 1 36 36 SER CB C 13 63.3997 0.010450385 . 1 . . . . . 186 SER CB . 51636 1 192 . 1 . 1 36 36 SER N N 15 114.3537701 0.062700207 . 1 . . . . . 186 SER N . 51636 1 193 . 1 . 1 37 37 GLU H H 1 8.157948016 0.001866078 . 1 . . . . . 187 GLU H . 51636 1 194 . 1 . 1 37 37 GLU C C 13 175.905 0.008157068 . 1 . . . . . 187 GLU C . 51636 1 195 . 1 . 1 37 37 GLU CA C 13 56.1331 0.007686035 . 1 . . . . . 187 GLU CA . 51636 1 196 . 1 . 1 37 37 GLU CB C 13 29.7937 0.014501097 . 1 . . . . . 187 GLU CB . 51636 1 197 . 1 . 1 37 37 GLU CG C 13 35.8885 0 . 1 . . . . . 187 GLU CG . 51636 1 198 . 1 . 1 37 37 GLU N N 15 122.0136426 0.036227467 . 1 . . . . . 187 GLU N . 51636 1 199 . 1 . 1 38 38 CYS H H 1 8.147989101 0.000401809 . 1 . . . . . 188 CYS H . 51636 1 200 . 1 . 1 38 38 CYS C C 13 174.146 0.001268549 . 1 . . . . . 188 CYS C . 51636 1 201 . 1 . 1 38 38 CYS CA C 13 58.0439 0.005032161 . 1 . . . . . 188 CYS CA . 51636 1 202 . 1 . 1 38 38 CYS CB C 13 27.4067 0.042050186 . 1 . . . . . 188 CYS CB . 51636 1 203 . 1 . 1 38 38 CYS N N 15 120.3369726 0.040603625 . 1 . . . . . 188 CYS N . 51636 1 204 . 1 . 1 39 39 ILE H H 1 8.111956335 0.000412885 . 1 . . . . . 189 ILE H . 51636 1 205 . 1 . 1 39 39 ILE C C 13 175.336 0.003863425 . 1 . . . . . 189 ILE C . 51636 1 206 . 1 . 1 39 39 ILE CA C 13 60.4957 0.005076056 . 1 . . . . . 189 ILE CA . 51636 1 207 . 1 . 1 39 39 ILE CB C 13 38.2348 0.010504194 . 1 . . . . . 189 ILE CB . 51636 1 208 . 1 . 1 39 39 ILE CD1 C 13 12.5191 0 . 1 . . . . . 189 ILE CD1 . 51636 1 209 . 1 . 1 39 39 ILE CG1 C 13 26.8509 0 . 1 . . . . . 189 ILE CG1 . 51636 1 210 . 1 . 1 39 39 ILE CG2 C 13 17.1494 0 . 1 . . . . . 189 ILE CG2 . 51636 1 211 . 1 . 1 39 39 ILE N N 15 123.7396052 0.065479964 . 1 . . . . . 189 ILE N . 51636 1 212 . 1 . 1 40 40 ASP H H 1 8.241229689 0.002828683 . 1 . . . . . 190 ASP H . 51636 1 213 . 1 . 1 40 40 ASP C C 13 174.581 0 . 1 . . . . . 190 ASP C . 51636 1 214 . 1 . 1 40 40 ASP CA C 13 51.3014 0 . 1 . . . . . 190 ASP CA . 51636 1 215 . 1 . 1 40 40 ASP CB C 13 40.999 0 . 1 . . . . . 190 ASP CB . 51636 1 216 . 1 . 1 40 40 ASP N N 15 125.9370408 0.063875704 . 1 . . . . . 190 ASP N . 51636 1 217 . 1 . 1 41 41 PRO C C 13 176.856 0 . 1 . . . . . 191 PRO C . 51636 1 218 . 1 . 1 41 41 PRO CA C 13 63.1763 0 . 1 . . . . . 191 PRO CA . 51636 1 219 . 1 . 1 41 41 PRO CB C 13 31.6715 0.000000477 . 1 . . . . . 191 PRO CB . 51636 1 220 . 1 . 1 41 41 PRO CD C 13 50.6007 0 . 1 . . . . . 191 PRO CD . 51636 1 221 . 1 . 1 41 41 PRO CG C 13 26.605 0 . 1 . . . . . 191 PRO CG . 51636 1 222 . 1 . 1 42 42 SER H H 1 8.295674826 0.000486281 . 1 . . . . . 192 SER H . 51636 1 223 . 1 . 1 42 42 SER C C 13 174.361 0.014553613 . 1 . . . . . 192 SER C . 51636 1 224 . 1 . 1 42 42 SER CA C 13 58.939 0.039349876 . 1 . . . . . 192 SER CA . 51636 1 225 . 1 . 1 42 42 SER CB C 13 63.2744 0.044341755 . 1 . . . . . 192 SER CB . 51636 1 226 . 1 . 1 42 42 SER N N 15 114.9586331 0.064384966 . 1 . . . . . 192 SER N . 51636 1 227 . 1 . 1 43 43 VAL H H 1 7.500181862 0.001096909 . 1 . . . . . 193 VAL H . 51636 1 228 . 1 . 1 43 43 VAL C C 13 175.325 0.006735059 . 1 . . . . . 193 VAL C . 51636 1 229 . 1 . 1 43 43 VAL CA C 13 62.0146 0.019445709 . 1 . . . . . 193 VAL CA . 51636 1 230 . 1 . 1 43 43 VAL CB C 13 31.9295 0.018368636 . 1 . . . . . 193 VAL CB . 51636 1 231 . 1 . 1 43 43 VAL CG1 C 13 20.4786 0 . 2 . . . . . 193 VAL CG1 . 51636 1 232 . 1 . 1 43 43 VAL CG2 C 13 20.7418 0 . 2 . . . . . 193 VAL CG2 . 51636 1 233 . 1 . 1 43 43 VAL N N 15 121.3601138 0.042659541 . 1 . . . . . 193 VAL N . 51636 1 234 . 1 . 1 44 44 VAL H H 1 7.750122119 0.000808263 . 1 . . . . . 194 VAL H . 51636 1 235 . 1 . 1 44 44 VAL C C 13 175.214 0.013302554 . 1 . . . . . 194 VAL C . 51636 1 236 . 1 . 1 44 44 VAL CA C 13 61.5753 0.003904758 . 1 . . . . . 194 VAL CA . 51636 1 237 . 1 . 1 44 44 VAL CB C 13 32.3373 0.008903371 . 1 . . . . . 194 VAL CB . 51636 1 238 . 1 . 1 44 44 VAL CG1 C 13 20.1986 0 . 2 . . . . . 194 VAL CG1 . 51636 1 239 . 1 . 1 44 44 VAL CG2 C 13 20.7495 0 . 2 . . . . . 194 VAL CG2 . 51636 1 240 . 1 . 1 44 44 VAL N N 15 123.5256437 0.063356686 . 1 . . . . . 194 VAL N . 51636 1 241 . 1 . 1 45 45 PHE H H 1 8.190950462 0.000403372 . 1 . . . . . 195 PHE H . 51636 1 242 . 1 . 1 45 45 PHE C C 13 173.7 0 . 1 . . . . . 195 PHE C . 51636 1 243 . 1 . 1 45 45 PHE CA C 13 54.9751 0 . 1 . . . . . 195 PHE CA . 51636 1 244 . 1 . 1 45 45 PHE CB C 13 38.6718 0 . 1 . . . . . 195 PHE CB . 51636 1 245 . 1 . 1 45 45 PHE N N 15 125.4746094 0.037207266 . 1 . . . . . 195 PHE N . 51636 1 246 . 1 . 1 46 46 PRO C C 13 175.638 0 . 1 . . . . . 196 PRO C . 51636 1 247 . 1 . 1 46 46 PRO CA C 13 62.4742 0.008147438 . 1 . . . . . 196 PRO CA . 51636 1 248 . 1 . 1 46 46 PRO CB C 13 31.0962 0.056092465 . 1 . . . . . 196 PRO CB . 51636 1 249 . 1 . 1 46 46 PRO CD C 13 50.0957 0 . 1 . . . . . 196 PRO CD . 51636 1 250 . 1 . 1 46 46 PRO CG C 13 26.6173 0 . 1 . . . . . 196 PRO CG . 51636 1 251 . 1 . 1 47 47 TYR H H 1 7.722461347 0.000445605 . 1 . . . . . 197 TYR H . 51636 1 252 . 1 . 1 47 47 TYR C C 13 173.786 0 . 1 . . . . . 197 TYR C . 51636 1 253 . 1 . 1 47 47 TYR CA C 13 55.2993 0 . 1 . . . . . 197 TYR CA . 51636 1 254 . 1 . 1 47 47 TYR CB C 13 37.5613 0 . 1 . . . . . 197 TYR CB . 51636 1 255 . 1 . 1 47 47 TYR N N 15 120.8891984 0.041307396 . 1 . . . . . 197 TYR N . 51636 1 256 . 1 . 1 48 48 PRO C C 13 176.424 0.076553545 . 1 . . . . . 198 PRO C . 51636 1 257 . 1 . 1 48 48 PRO CA C 13 62.6514 0.007166868 . 1 . . . . . 198 PRO CA . 51636 1 258 . 1 . 1 48 48 PRO CB C 13 31.5647 0.0000936 . 1 . . . . . 198 PRO CB . 51636 1 259 . 1 . 1 48 48 PRO CD C 13 50.2703 0 . 1 . . . . . 198 PRO CD . 51636 1 260 . 1 . 1 48 48 PRO CG C 13 27.1336 0 . 1 . . . . . 198 PRO CG . 51636 1 261 . 1 . 1 49 49 LEU H H 1 8.139366416 0.000752157 . 1 . . . . . 199 LEU H . 51636 1 262 . 1 . 1 49 49 LEU C C 13 177.026 0.024499355 . 1 . . . . . 199 LEU C . 51636 1 263 . 1 . 1 49 49 LEU CA C 13 54.6362 0.001140927 . 1 . . . . . 199 LEU CA . 51636 1 264 . 1 . 1 49 49 LEU CB C 13 41.903 0.007923556 . 1 . . . . . 199 LEU CB . 51636 1 265 . 1 . 1 49 49 LEU CD1 C 13 23.1021 0 . 2 . . . . . 199 LEU CD1 . 51636 1 266 . 1 . 1 49 49 LEU CD2 C 13 24.4997 0 . 2 . . . . . 199 LEU CD2 . 51636 1 267 . 1 . 1 49 49 LEU CG C 13 26.606 0 . 1 . . . . . 199 LEU CG . 51636 1 268 . 1 . 1 49 49 LEU N N 15 122.1033437 0.036398512 . 1 . . . . . 199 LEU N . 51636 1 269 . 1 . 1 50 50 ASN H H 1 8.264071366 0.002341546 . 1 . . . . . 200 ASN H . 51636 1 270 . 1 . 1 50 50 ASN C C 13 174.572 0.006032659 . 1 . . . . . 200 ASN C . 51636 1 271 . 1 . 1 50 50 ASN CA C 13 52.6736 0.005556518 . 1 . . . . . 200 ASN CA . 51636 1 272 . 1 . 1 50 50 ASN CB C 13 38.5172 0.036206768 . 1 . . . . . 200 ASN CB . 51636 1 273 . 1 . 1 50 50 ASN N N 15 118.9457078 0.021794451 . 1 . . . . . 200 ASN N . 51636 1 274 . 1 . 1 51 51 ASP H H 1 8.169802448 0.000852486 . 1 . . . . . 201 ASP H . 51636 1 275 . 1 . 1 51 51 ASP C C 13 176.43 0.004488005 . 1 . . . . . 201 ASP C . 51636 1 276 . 1 . 1 51 51 ASP CA C 13 53.7531 0.004632743 . 1 . . . . . 201 ASP CA . 51636 1 277 . 1 . 1 51 51 ASP CB C 13 40.7679 0.050240288 . 1 . . . . . 201 ASP CB . 51636 1 278 . 1 . 1 51 51 ASP N N 15 120.8372306 0.036626947 . 1 . . . . . 201 ASP N . 51636 1 279 . 1 . 1 52 52 SER H H 1 8.239073119 0.000514383 . 1 . . . . . 202 SER H . 51636 1 280 . 1 . 1 52 52 SER C C 13 174.596 0 . 1 . . . . . 202 SER C . 51636 1 281 . 1 . 1 52 52 SER CA C 13 58.4806 0.010976149 . 1 . . . . . 202 SER CA . 51636 1 282 . 1 . 1 52 52 SER CB C 13 63.1589 0.020993382 . 1 . . . . . 202 SER CB . 51636 1 283 . 1 . 1 52 52 SER N N 15 116.5794941 0.045107835 . 1 . . . . . 202 SER N . 51636 1 284 . 1 . 1 53 53 SER H H 1 8.184036283 0.000598358 . 1 . . . . . 203 SER H . 51636 1 285 . 1 . 1 53 53 SER C C 13 174.05 0.007418416 . 1 . . . . . 203 SER C . 51636 1 286 . 1 . 1 53 53 SER CA C 13 58.348 0.042876386 . 1 . . . . . 203 SER CA . 51636 1 287 . 1 . 1 53 53 SER CB C 13 63.425 0.038566857 . 1 . . . . . 203 SER CB . 51636 1 288 . 1 . 1 53 53 SER N N 15 117.2110484 0.081804157 . 1 . . . . . 203 SER N . 51636 1 289 . 1 . 1 54 54 SER H H 1 7.978735487 0.000448661 . 1 . . . . . 204 SER H . 51636 1 290 . 1 . 1 54 54 SER C C 13 172.319 0 . 1 . . . . . 204 SER C . 51636 1 291 . 1 . 1 54 54 SER CA C 13 56.1114 0 . 1 . . . . . 204 SER CA . 51636 1 292 . 1 . 1 54 54 SER CB C 13 62.6805 0 . 1 . . . . . 204 SER CB . 51636 1 293 . 1 . 1 54 54 SER N N 15 118.4472715 0.042930368 . 1 . . . . . 204 SER N . 51636 1 294 . 1 . 1 55 55 PRO C C 13 176.86 0 . 1 . . . . . 205 PRO C . 51636 1 295 . 1 . 1 55 55 PRO CA C 13 62.9136 0 . 1 . . . . . 205 PRO CA . 51636 1 296 . 1 . 1 55 55 PRO CB C 13 31.6349 0.000000477 . 1 . . . . . 205 PRO CB . 51636 1 297 . 1 . 1 55 55 PRO CD C 13 50.3787 0 . 1 . . . . . 205 PRO CD . 51636 1 298 . 1 . 1 55 55 PRO CG C 13 26.9285 0 . 1 . . . . . 205 PRO CG . 51636 1 299 . 1 . 1 56 56 LYS H H 1 8.28385024 0.00047736 . 1 . . . . . 206 LYS H . 51636 1 300 . 1 . 1 56 56 LYS C C 13 176.629 0 . 1 . . . . . 206 LYS C . 51636 1 301 . 1 . 1 56 56 LYS CA C 13 55.9043 0.006036616 . 1 . . . . . 206 LYS CA . 51636 1 302 . 1 . 1 56 56 LYS CB C 13 32.492 0.020970037 . 1 . . . . . 206 LYS CB . 51636 1 303 . 1 . 1 56 56 LYS CD C 13 28.5826 0 . 1 . . . . . 206 LYS CD . 51636 1 304 . 1 . 1 56 56 LYS CE C 13 41.795 0 . 1 . . . . . 206 LYS CE . 51636 1 305 . 1 . 1 56 56 LYS CG C 13 24.3897 0 . 1 . . . . . 206 LYS CG . 51636 1 306 . 1 . 1 56 56 LYS N N 15 121.362833 0.034875423 . 1 . . . . . 206 LYS N . 51636 1 307 . 1 . 1 57 57 SER H H 1 8.188598164 0.00045449 . 1 . . . . . 207 SER H . 51636 1 308 . 1 . 1 57 57 SER C C 13 174.3 0.001198698 . 1 . . . . . 207 SER C . 51636 1 309 . 1 . 1 57 57 SER CA C 13 57.8577 0.022118254 . 1 . . . . . 207 SER CA . 51636 1 310 . 1 . 1 57 57 SER CB C 13 63.3599 0.02203862 . 1 . . . . . 207 SER CB . 51636 1 311 . 1 . 1 57 57 SER N N 15 116.7590711 0.041979784 . 1 . . . . . 207 SER N . 51636 1 312 . 1 . 1 58 58 CYS H H 1 8.255539879 0.000502113 . 1 . . . . . 208 CYS H . 51636 1 313 . 1 . 1 58 58 CYS C C 13 174.096 0.004409616 . 1 . . . . . 208 CYS C . 51636 1 314 . 1 . 1 58 58 CYS CA C 13 57.9211 0.001824274 . 1 . . . . . 208 CYS CA . 51636 1 315 . 1 . 1 58 58 CYS CB C 13 27.7352 0.003338371 . 1 . . . . . 208 CYS CB . 51636 1 316 . 1 . 1 58 58 CYS N N 15 120.9387786 0.095900684 . 1 . . . . . 208 CYS N . 51636 1 317 . 1 . 1 59 59 ALA H H 1 8.238340329 0.000792002 . 1 . . . . . 209 ALA H . 51636 1 318 . 1 . 1 59 59 ALA C C 13 177.626 0.006866396 . 1 . . . . . 209 ALA C . 51636 1 319 . 1 . 1 59 59 ALA CA C 13 52.3073 0.015936532 . 1 . . . . . 209 ALA CA . 51636 1 320 . 1 . 1 59 59 ALA CB C 13 18.7376 0.007772406 . 1 . . . . . 209 ALA CB . 51636 1 321 . 1 . 1 59 59 ALA N N 15 126.1405248 0.036102508 . 1 . . . . . 209 ALA N . 51636 1 322 . 1 . 1 60 60 SER H H 1 8.152476897 0.000411985 . 1 . . . . . 210 SER H . 51636 1 323 . 1 . 1 60 60 SER C C 13 174.499 0.015198826 . 1 . . . . . 210 SER C . 51636 1 324 . 1 . 1 60 60 SER CA C 13 58.0562 0.025990245 . 1 . . . . . 210 SER CA . 51636 1 325 . 1 . 1 60 60 SER CB C 13 63.2562 0.015036888 . 1 . . . . . 210 SER CB . 51636 1 326 . 1 . 1 60 60 SER N N 15 114.970086 0.045102864 . 1 . . . . . 210 SER N . 51636 1 327 . 1 . 1 61 61 GLN H H 1 8.260641619 0.000772731 . 1 . . . . . 211 GLN H . 51636 1 328 . 1 . 1 61 61 GLN C C 13 175.432 0.003686515 . 1 . . . . . 211 GLN C . 51636 1 329 . 1 . 1 61 61 GLN CA C 13 55.4896 0.014683208 . 1 . . . . . 211 GLN CA . 51636 1 330 . 1 . 1 61 61 GLN CB C 13 28.9925 0.008906579 . 1 . . . . . 211 GLN CB . 51636 1 331 . 1 . 1 61 61 GLN CG C 13 33.4707 0 . 1 . . . . . 211 GLN CG . 51636 1 332 . 1 . 1 61 61 GLN N N 15 121.8619959 0.04185409 . 1 . . . . . 211 GLN N . 51636 1 333 . 1 . 1 62 62 ASP H H 1 8.157910042 0.001026663 . 1 . . . . . 212 ASP H . 51636 1 334 . 1 . 1 62 62 ASP C C 13 176.344 0.009707497 . 1 . . . . . 212 ASP C . 51636 1 335 . 1 . 1 62 62 ASP CA C 13 53.8633 0.047341483 . 1 . . . . . 212 ASP CA . 51636 1 336 . 1 . 1 62 62 ASP CB C 13 40.6829 0.032982024 . 1 . . . . . 212 ASP CB . 51636 1 337 . 1 . 1 62 62 ASP N N 15 121.2432855 0.039169428 . 1 . . . . . 212 ASP N . 51636 1 338 . 1 . 1 63 63 SER H H 1 8.206548723 0.000665922 . 1 . . . . . 213 SER H . 51636 1 339 . 1 . 1 63 63 SER C C 13 174.793 0.014257377 . 1 . . . . . 213 SER C . 51636 1 340 . 1 . 1 63 63 SER CA C 13 58.3366 0.028031849 . 1 . . . . . 213 SER CA . 51636 1 341 . 1 . 1 63 63 SER CB C 13 63.1864 0.019105426 . 1 . . . . . 213 SER CB . 51636 1 342 . 1 . 1 63 63 SER N N 15 117.01085 0.041687567 . 1 . . . . . 213 SER N . 51636 1 343 . 1 . 1 64 64 SER H H 1 8.239652561 0.000318611 . 1 . . . . . 214 SER H . 51636 1 344 . 1 . 1 64 64 SER C C 13 174.145 0.014134247 . 1 . . . . . 214 SER C . 51636 1 345 . 1 . 1 64 64 SER CA C 13 58.4747 0.060677435 . 1 . . . . . 214 SER CA . 51636 1 346 . 1 . 1 64 64 SER CB C 13 63.336 0.037628174 . 1 . . . . . 214 SER CB . 51636 1 347 . 1 . 1 64 64 SER N N 15 117.8475627 0.046997037 . 1 . . . . . 214 SER N . 51636 1 348 . 1 . 1 65 65 ALA H H 1 7.927905148 0.000808785 . 1 . . . . . 215 ALA H . 51636 1 349 . 1 . 1 65 65 ALA C C 13 176.973 0.008863956 . 1 . . . . . 215 ALA C . 51636 1 350 . 1 . 1 65 65 ALA CA C 13 52.0914 0.01166336 . 1 . . . . . 215 ALA CA . 51636 1 351 . 1 . 1 65 65 ALA CB C 13 18.6178 0.059110439 . 1 . . . . . 215 ALA CB . 51636 1 352 . 1 . 1 65 65 ALA N N 15 124.9595407 0.040988837 . 1 . . . . . 215 ALA N . 51636 1 353 . 1 . 1 66 66 PHE H H 1 7.880604334 0.000211631 . 1 . . . . . 216 PHE H . 51636 1 354 . 1 . 1 66 66 PHE C C 13 175.158 0.004431978 . 1 . . . . . 216 PHE C . 51636 1 355 . 1 . 1 66 66 PHE CA C 13 57.0624 0.01479409 . 1 . . . . . 216 PHE CA . 51636 1 356 . 1 . 1 66 66 PHE CB C 13 39.2242 0.027831546 . 1 . . . . . 216 PHE CB . 51636 1 357 . 1 . 1 66 66 PHE N N 15 118.9696452 0.035518352 . 1 . . . . . 216 PHE N . 51636 1 358 . 1 . 1 67 67 SER H H 1 7.9580477 0.000455771 . 1 . . . . . 217 SER H . 51636 1 359 . 1 . 1 67 67 SER C C 13 171.899 0 . 1 . . . . . 217 SER C . 51636 1 360 . 1 . 1 67 67 SER CA C 13 55.3031 0 . 1 . . . . . 217 SER CA . 51636 1 361 . 1 . 1 67 67 SER CB C 13 63.0186 0 . 1 . . . . . 217 SER CB . 51636 1 362 . 1 . 1 67 67 SER N N 15 119.3968309 0.039758057 . 1 . . . . . 217 SER N . 51636 1 363 . 1 . 1 68 68 PRO C C 13 176.741 0 . 1 . . . . . 218 PRO C . 51636 1 364 . 1 . 1 68 68 PRO CA C 13 62.7551 0.03786067 . 1 . . . . . 218 PRO CA . 51636 1 365 . 1 . 1 68 68 PRO CB C 13 31.6824 0.006082369 . 1 . . . . . 218 PRO CB . 51636 1 366 . 1 . 1 68 68 PRO CD C 13 50.3428 0 . 1 . . . . . 218 PRO CD . 51636 1 367 . 1 . 1 68 68 PRO CG C 13 26.8475 0 . 1 . . . . . 218 PRO CG . 51636 1 368 . 1 . 1 69 69 SER H H 1 8.282362358 0.000393442 . 1 . . . . . 219 SER H . 51636 1 369 . 1 . 1 69 69 SER C C 13 174.788 0.011106971 . 1 . . . . . 219 SER C . 51636 1 370 . 1 . 1 69 69 SER CA C 13 57.8964 0.014306281 . 1 . . . . . 219 SER CA . 51636 1 371 . 1 . 1 69 69 SER CB C 13 63.373 0.006552296 . 1 . . . . . 219 SER CB . 51636 1 372 . 1 . 1 69 69 SER N N 15 115.791514 0.0616561 . 1 . . . . . 219 SER N . 51636 1 373 . 1 . 1 70 70 SER H H 1 8.272085297 0.000774661 . 1 . . . . . 220 SER H . 51636 1 374 . 1 . 1 70 70 SER C C 13 174.363 0.029212395 . 1 . . . . . 220 SER C . 51636 1 375 . 1 . 1 70 70 SER CA C 13 58.3569 0.003648603 . 1 . . . . . 220 SER CA . 51636 1 376 . 1 . 1 70 70 SER CB C 13 63.2762 0.036767677 . 1 . . . . . 220 SER CB . 51636 1 377 . 1 . 1 70 70 SER N N 15 117.7831345 0.065248502 . 1 . . . . . 220 SER N . 51636 1 378 . 1 . 1 71 71 ASP H H 1 8.170409882 0.001042922 . 1 . . . . . 221 ASP H . 51636 1 379 . 1 . 1 71 71 ASP C C 13 176.435 0.004250277 . 1 . . . . . 221 ASP C . 51636 1 380 . 1 . 1 71 71 ASP CA C 13 54.2519 0.003555174 . 1 . . . . . 221 ASP CA . 51636 1 381 . 1 . 1 71 71 ASP CB C 13 40.4948 0.007903101 . 1 . . . . . 221 ASP CB . 51636 1 382 . 1 . 1 71 71 ASP N N 15 121.8368396 0.04456343 . 1 . . . . . 221 ASP N . 51636 1 383 . 1 . 1 72 72 SER H H 1 8.013024801 0.000637526 . 1 . . . . . 222 SER H . 51636 1 384 . 1 . 1 72 72 SER C C 13 174.551 0.018097978 . 1 . . . . . 222 SER C . 51636 1 385 . 1 . 1 72 72 SER CA C 13 58.4833 0.03674801 . 1 . . . . . 222 SER CA . 51636 1 386 . 1 . 1 72 72 SER CB C 13 63.2156 0.036147807 . 1 . . . . . 222 SER CB . 51636 1 387 . 1 . 1 72 72 SER N N 15 115.9206317 0.036689865 . 1 . . . . . 222 SER N . 51636 1 388 . 1 . 1 73 73 LEU H H 1 8.022949862 0.000378616 . 1 . . . . . 223 LEU H . 51636 1 389 . 1 . 1 73 73 LEU C C 13 177.477 0.00130021 . 1 . . . . . 223 LEU C . 51636 1 390 . 1 . 1 73 73 LEU CA C 13 55.0455 0.004603186 . 1 . . . . . 223 LEU CA . 51636 1 391 . 1 . 1 73 73 LEU CB C 13 41.5282 0.01220901 . 1 . . . . . 223 LEU CB . 51636 1 392 . 1 . 1 73 73 LEU CD1 C 13 23.0172 0 . 2 . . . . . 223 LEU CD1 . 51636 1 393 . 1 . 1 73 73 LEU CD2 C 13 24.5082 0 . 2 . . . . . 223 LEU CD2 . 51636 1 394 . 1 . 1 73 73 LEU CG C 13 26.5559 0 . 1 . . . . . 223 LEU CG . 51636 1 395 . 1 . 1 73 73 LEU N N 15 123.3189531 0.042839013 . 1 . . . . . 223 LEU N . 51636 1 396 . 1 . 1 74 74 LEU H H 1 7.920127402 0.000258537 . 1 . . . . . 224 LEU H . 51636 1 397 . 1 . 1 74 74 LEU C C 13 177.352 0.010749908 . 1 . . . . . 224 LEU C . 51636 1 398 . 1 . 1 74 74 LEU CA C 13 54.8224 0.01504143 . 1 . . . . . 224 LEU CA . 51636 1 399 . 1 . 1 74 74 LEU CB C 13 41.7283 0.002438639 . 1 . . . . . 224 LEU CB . 51636 1 400 . 1 . 1 74 74 LEU CD1 C 13 22.9662 0 . 2 . . . . . 224 LEU CD1 . 51636 1 401 . 1 . 1 74 74 LEU CD2 C 13 24.5053 0 . 2 . . . . . 224 LEU CD2 . 51636 1 402 . 1 . 1 74 74 LEU CG C 13 26.5498 0 . 1 . . . . . 224 LEU CG . 51636 1 403 . 1 . 1 74 74 LEU N N 15 121.803237 0.031307665 . 1 . . . . . 224 LEU N . 51636 1 404 . 1 . 1 75 75 SER H H 1 8.074008154 0.000356413 . 1 . . . . . 225 SER H . 51636 1 405 . 1 . 1 75 75 SER C C 13 174.484 0.01377392 . 1 . . . . . 225 SER C . 51636 1 406 . 1 . 1 75 75 SER CA C 13 57.8892 0.005723666 . 1 . . . . . 225 SER CA . 51636 1 407 . 1 . 1 75 75 SER CB C 13 63.3369 0.020363206 . 1 . . . . . 225 SER CB . 51636 1 408 . 1 . 1 75 75 SER N N 15 116.0260602 0.045270964 . 1 . . . . . 225 SER N . 51636 1 409 . 1 . 1 76 76 SER H H 1 8.199613746 0.000428543 . 1 . . . . . 226 SER H . 51636 1 410 . 1 . 1 76 76 SER C C 13 174.755 0.001827862 . 1 . . . . . 226 SER C . 51636 1 411 . 1 . 1 76 76 SER CA C 13 58.0593 0.082187136 . 1 . . . . . 226 SER CA . 51636 1 412 . 1 . 1 76 76 SER CB C 13 63.3546 0.009394482 . 1 . . . . . 226 SER CB . 51636 1 413 . 1 . 1 76 76 SER N N 15 117.6247135 0.033273021 . 1 . . . . . 226 SER N . 51636 1 414 . 1 . 1 77 77 THR H H 1 8.049055153 0.0008166 . 1 . . . . . 227 THR H . 51636 1 415 . 1 . 1 77 77 THR C C 13 174.491 0.012085134 . 1 . . . . . 227 THR C . 51636 1 416 . 1 . 1 77 77 THR CA C 13 61.6703 0.019325633 . 1 . . . . . 227 THR CA . 51636 1 417 . 1 . 1 77 77 THR CB C 13 69.2277 0.037734957 . 1 . . . . . 227 THR CB . 51636 1 418 . 1 . 1 77 77 THR CG2 C 13 21.2212 0 . 1 . . . . . 227 THR CG2 . 51636 1 419 . 1 . 1 77 77 THR N N 15 115.3655281 0.061895828 . 1 . . . . . 227 THR N . 51636 1 420 . 1 . 1 78 78 GLU H H 1 8.169800398 0.000586363 . 1 . . . . . 228 GLU H . 51636 1 421 . 1 . 1 78 78 GLU C C 13 176.222 0.004956165 . 1 . . . . . 228 GLU C . 51636 1 422 . 1 . 1 78 78 GLU CA C 13 56.1364 0.005244828 . 1 . . . . . 228 GLU CA . 51636 1 423 . 1 . 1 78 78 GLU CB C 13 29.87 0.014087809 . 1 . . . . . 228 GLU CB . 51636 1 424 . 1 . 1 78 78 GLU CG C 13 35.932 0 . 1 . . . . . 228 GLU CG . 51636 1 425 . 1 . 1 78 78 GLU N N 15 122.7784078 0.034491884 . 1 . . . . . 228 GLU N . 51636 1 426 . 1 . 1 79 79 SER H H 1 8.176387654 0.00070321 . 1 . . . . . 229 SER H . 51636 1 427 . 1 . 1 79 79 SER C C 13 173.951 0.001084591 . 1 . . . . . 229 SER C . 51636 1 428 . 1 . 1 79 79 SER CA C 13 57.88 0.003905595 . 1 . . . . . 229 SER CA . 51636 1 429 . 1 . 1 79 79 SER CB C 13 63.4185 0.011031408 . 1 . . . . . 229 SER CB . 51636 1 430 . 1 . 1 79 79 SER N N 15 116.736617 0.037662624 . 1 . . . . . 229 SER N . 51636 1 431 . 1 . 1 80 80 SER H H 1 8.192030324 0.000308839 . 1 . . . . . 230 SER H . 51636 1 432 . 1 . 1 80 80 SER C C 13 172.493 0 . 1 . . . . . 230 SER C . 51636 1 433 . 1 . 1 80 80 SER CA C 13 56.1335 0 . 1 . . . . . 230 SER CA . 51636 1 434 . 1 . 1 80 80 SER CB C 13 62.7664 0 . 1 . . . . . 230 SER CB . 51636 1 435 . 1 . 1 80 80 SER N N 15 118.6391471 0.041208988 . 1 . . . . . 230 SER N . 51636 1 436 . 1 . 1 81 81 PRO C C 13 176.879 0 . 1 . . . . . 231 PRO C . 51636 1 437 . 1 . 1 81 81 PRO CA C 13 62.9649 0.0000122 . 1 . . . . . 231 PRO CA . 51636 1 438 . 1 . 1 81 81 PRO CB C 13 31.5319 0 . 1 . . . . . 231 PRO CB . 51636 1 439 . 1 . 1 81 81 PRO CD C 13 50.3736 0 . 1 . . . . . 231 PRO CD . 51636 1 440 . 1 . 1 81 81 PRO CG C 13 26.9576 0 . 1 . . . . . 231 PRO CG . 51636 1 441 . 1 . 1 82 82 GLN H H 1 8.387028928 0.00065231 . 1 . . . . . 232 GLN H . 51636 1 442 . 1 . 1 82 82 GLN C C 13 176.319 0.003580702 . 1 . . . . . 232 GLN C . 51636 1 443 . 1 . 1 82 82 GLN CA C 13 55.48 0.044055717 . 1 . . . . . 232 GLN CA . 51636 1 444 . 1 . 1 82 82 GLN CB C 13 29.0472 0.002065819 . 1 . . . . . 232 GLN CB . 51636 1 445 . 1 . 1 82 82 GLN CG C 13 33.4745 0 . 1 . . . . . 232 GLN CG . 51636 1 446 . 1 . 1 82 82 GLN N N 15 120.5004417 0.050087192 . 1 . . . . . 232 GLN N . 51636 1 447 . 1 . 1 83 83 GLY H H 1 8.235912509 0.000452862 . 1 . . . . . 233 GLY H . 51636 1 448 . 1 . 1 83 83 GLY C C 13 173.456 0.007161402 . 1 . . . . . 233 GLY C . 51636 1 449 . 1 . 1 83 83 GLY CA C 13 44.5323 0.013933508 . 1 . . . . . 233 GLY CA . 51636 1 450 . 1 . 1 83 83 GLY N N 15 110.0975308 0.045213436 . 1 . . . . . 233 GLY N . 51636 1 451 . 1 . 1 84 84 SER H H 1 8.102544687 0.000751622 . 1 . . . . . 234 SER H . 51636 1 452 . 1 . 1 84 84 SER C C 13 172.337 0 . 1 . . . . . 234 SER C . 51636 1 453 . 1 . 1 84 84 SER CA C 13 55.9985 0 . 1 . . . . . 234 SER CA . 51636 1 454 . 1 . 1 84 84 SER CB C 13 62.9401 0 . 1 . . . . . 234 SER CB . 51636 1 455 . 1 . 1 84 84 SER N N 15 116.7751781 0.04073183 . 1 . . . . . 234 SER N . 51636 1 456 . 1 . 1 85 85 PRO C C 13 176.491 0 . 1 . . . . . 235 PRO C . 51636 1 457 . 1 . 1 85 85 PRO CA C 13 62.5696 0 . 1 . . . . . 235 PRO CA . 51636 1 458 . 1 . 1 85 85 PRO CB C 13 31.5567 0 . 1 . . . . . 235 PRO CB . 51636 1 459 . 1 . 1 85 85 PRO CD C 13 50.3578 0 . 1 . . . . . 235 PRO CD . 51636 1 460 . 1 . 1 85 85 PRO CG C 13 26.8973 0 . 1 . . . . . 235 PRO CG . 51636 1 461 . 1 . 1 86 86 GLU H H 1 8.281150541 0.000403588 . 1 . . . . . 236 GLU H . 51636 1 462 . 1 . 1 86 86 GLU C C 13 174.296 0 . 1 . . . . . 236 GLU C . 51636 1 463 . 1 . 1 86 86 GLU CA C 13 53.9931 0 . 1 . . . . . 236 GLU CA . 51636 1 464 . 1 . 1 86 86 GLU CB C 13 29.0788 0 . 1 . . . . . 236 GLU CB . 51636 1 465 . 1 . 1 86 86 GLU N N 15 122.6325119 0.027700885 . 1 . . . . . 236 GLU N . 51636 1 466 . 1 . 1 87 87 PRO C C 13 176.32 0 . 1 . . . . . 237 PRO C . 51636 1 467 . 1 . 1 87 87 PRO CA C 13 62.4922 0 . 1 . . . . . 237 PRO CA . 51636 1 468 . 1 . 1 87 87 PRO CB C 13 31.632 0.000000337 . 1 . . . . . 237 PRO CB . 51636 1 469 . 1 . 1 87 87 PRO CD C 13 50.33 0 . 1 . . . . . 237 PRO CD . 51636 1 470 . 1 . 1 87 87 PRO CG C 13 26.9926 0 . 1 . . . . . 237 PRO CG . 51636 1 471 . 1 . 1 88 88 LEU H H 1 8.167531375 0.000424048 . 1 . . . . . 238 LEU H . 51636 1 472 . 1 . 1 88 88 LEU C C 13 176.866 0.010527688 . 1 . . . . . 238 LEU C . 51636 1 473 . 1 . 1 88 88 LEU CA C 13 54.6588 0.021825308 . 1 . . . . . 238 LEU CA . 51636 1 474 . 1 . 1 88 88 LEU CB C 13 41.8989 0.013781542 . 1 . . . . . 238 LEU CB . 51636 1 475 . 1 . 1 88 88 LEU CD1 C 13 23.4186 0 . 2 . . . . . 238 LEU CD1 . 51636 1 476 . 1 . 1 88 88 LEU CD2 C 13 24.3219 0 . 2 . . . . . 238 LEU CD2 . 51636 1 477 . 1 . 1 88 88 LEU CG C 13 26.6229 0 . 1 . . . . . 238 LEU CG . 51636 1 478 . 1 . 1 88 88 LEU N N 15 122.740295 0.044152775 . 1 . . . . . 238 LEU N . 51636 1 479 . 1 . 1 89 89 VAL H H 1 8.050897851 0.000354402 . 1 . . . . . 239 VAL H . 51636 1 480 . 1 . 1 89 89 VAL C C 13 175.323 0.005263845 . 1 . . . . . 239 VAL C . 51636 1 481 . 1 . 1 89 89 VAL CA C 13 61.6425 0.013852328 . 1 . . . . . 239 VAL CA . 51636 1 482 . 1 . 1 89 89 VAL CB C 13 32.2931 0.005160193 . 1 . . . . . 239 VAL CB . 51636 1 483 . 1 . 1 89 89 VAL CG1 C 13 20.3683 0 . 2 . . . . . 239 VAL CG1 . 51636 1 484 . 1 . 1 89 89 VAL CG2 C 13 20.6586 0 . 2 . . . . . 239 VAL CG2 . 51636 1 485 . 1 . 1 89 89 VAL N N 15 123.1223489 0.037654688 . 1 . . . . . 239 VAL N . 51636 1 486 . 1 . 1 90 90 LEU H H 1 8.220624306 0.000306327 . 1 . . . . . 240 LEU H . 51636 1 487 . 1 . 1 90 90 LEU C C 13 176.51 0.015791533 . 1 . . . . . 240 LEU C . 51636 1 488 . 1 . 1 90 90 LEU CA C 13 54.205 0.046304813 . 1 . . . . . 240 LEU CA . 51636 1 489 . 1 . 1 90 90 LEU CB C 13 41.9605 0.007826294 . 1 . . . . . 240 LEU CB . 51636 1 490 . 1 . 1 90 90 LEU CD1 C 13 23.1371 0 . 2 . . . . . 240 LEU CD1 . 51636 1 491 . 1 . 1 90 90 LEU CD2 C 13 24.4327 0 . 2 . . . . . 240 LEU CD2 . 51636 1 492 . 1 . 1 90 90 LEU CG C 13 26.5534 0 . 1 . . . . . 240 LEU CG . 51636 1 493 . 1 . 1 90 90 LEU N N 15 126.8975712 0.031359693 . 1 . . . . . 240 LEU N . 51636 1 494 . 1 . 1 91 91 HIS H H 1 8.291802019 0.001823817 . 1 . . . . . 241 HIS H . 51636 1 495 . 1 . 1 91 91 HIS C C 13 174.284 0.002631923 . 1 . . . . . 241 HIS C . 51636 1 496 . 1 . 1 91 91 HIS CA C 13 55.1116 0.025423507 . 1 . . . . . 241 HIS CA . 51636 1 497 . 1 . 1 91 91 HIS CB C 13 29.6967 0.001727037 . 1 . . . . . 241 HIS CB . 51636 1 498 . 1 . 1 91 91 HIS N N 15 120.6016227 0.039720015 . 1 . . . . . 241 HIS N . 51636 1 499 . 1 . 1 92 92 GLU H H 1 8.305881677 0.001952369 . 1 . . . . . 242 GLU H . 51636 1 500 . 1 . 1 92 92 GLU C C 13 175.771 0.005263843 . 1 . . . . . 242 GLU C . 51636 1 501 . 1 . 1 92 92 GLU CA C 13 55.7387 0.004548419 . 1 . . . . . 242 GLU CA . 51636 1 502 . 1 . 1 92 92 GLU CB C 13 30.1474 0.006317407 . 1 . . . . . 242 GLU CB . 51636 1 503 . 1 . 1 92 92 GLU CG C 13 35.8626 0 . 1 . . . . . 242 GLU CG . 51636 1 504 . 1 . 1 92 92 GLU N N 15 123.020033 0.029726146 . 1 . . . . . 242 GLU N . 51636 1 505 . 1 . 1 93 93 GLU H H 1 8.443907413 0.000993786 . 1 . . . . . 243 GLU H . 51636 1 506 . 1 . 1 93 93 GLU C C 13 176.158 0.007895766 . 1 . . . . . 243 GLU C . 51636 1 507 . 1 . 1 93 93 GLU CA C 13 55.8024 0.072448639 . 1 . . . . . 243 GLU CA . 51636 1 508 . 1 . 1 93 93 GLU CB C 13 29.9405 0.027513986 . 1 . . . . . 243 GLU CB . 51636 1 509 . 1 . 1 93 93 GLU CG C 13 35.7934 0 . 1 . . . . . 243 GLU CG . 51636 1 510 . 1 . 1 93 93 GLU N N 15 122.6567396 0.03583522 . 1 . . . . . 243 GLU N . 51636 1 511 . 1 . 1 94 94 THR H H 1 8.255218581 0.000745566 . 1 . . . . . 244 THR H . 51636 1 512 . 1 . 1 94 94 THR C C 13 172.027 0 . 1 . . . . . 244 THR C . 51636 1 513 . 1 . 1 94 94 THR CA C 13 59.4993 0 . 1 . . . . . 244 THR CA . 51636 1 514 . 1 . 1 94 94 THR CB C 13 69.2742 0 . 1 . . . . . 244 THR CB . 51636 1 515 . 1 . 1 94 94 THR N N 15 119.15418 0.032060009 . 1 . . . . . 244 THR N . 51636 1 516 . 1 . 1 96 96 PRO C C 13 176.895 0 . 1 . . . . . 246 PRO C . 51636 1 517 . 1 . 1 96 96 PRO CA C 13 62.4112 0.00000117 . 1 . . . . . 246 PRO CA . 51636 1 518 . 1 . 1 96 96 PRO CB C 13 31.6761 0 . 1 . . . . . 246 PRO CB . 51636 1 519 . 1 . 1 96 96 PRO CD C 13 50.193 0 . 1 . . . . . 246 PRO CD . 51636 1 520 . 1 . 1 96 96 PRO CG C 13 26.9019 0 . 1 . . . . . 246 PRO CG . 51636 1 521 . 1 . 1 97 97 THR H H 1 8.216263964 0.000933152 . 1 . . . . . 247 THR H . 51636 1 522 . 1 . 1 97 97 THR C C 13 174.539 0.000302596 . 1 . . . . . 247 THR C . 51636 1 523 . 1 . 1 97 97 THR CA C 13 61.3404 0.007057614 . 1 . . . . . 247 THR CA . 51636 1 524 . 1 . 1 97 97 THR CB C 13 69.4582 0.008844104 . 1 . . . . . 247 THR CB . 51636 1 525 . 1 . 1 97 97 THR CG2 C 13 21.2275 0 . 1 . . . . . 247 THR CG2 . 51636 1 526 . 1 . 1 97 97 THR N N 15 114.7050405 0.034075752 . 1 . . . . . 247 THR N . 51636 1 527 . 1 . 1 98 98 THR H H 1 8.07913232 0.0005933 . 1 . . . . . 248 THR H . 51636 1 528 . 1 . 1 98 98 THR C C 13 174.186 0 . 1 . . . . . 248 THR C . 51636 1 529 . 1 . 1 98 98 THR CA C 13 60.9997 0.00590634 . 1 . . . . . 248 THR CA . 51636 1 530 . 1 . 1 98 98 THR CB C 13 69.6984 0.018499065 . 1 . . . . . 248 THR CB . 51636 1 531 . 1 . 1 98 98 THR CG2 C 13 21.1634 0 . 1 . . . . . 248 THR CG2 . 51636 1 532 . 1 . 1 98 98 THR N N 15 116.1661522 0.061236536 . 1 . . . . . 248 THR N . 51636 1 533 . 1 . 1 99 99 SER H H 1 8.308315085 0.000388687 . 1 . . . . . 249 SER H . 51636 1 534 . 1 . 1 99 99 SER C C 13 174.361 0.002666736 . 1 . . . . . 249 SER C . 51636 1 535 . 1 . 1 99 99 SER CA C 13 57.7281 0.014327075 . 1 . . . . . 249 SER CA . 51636 1 536 . 1 . 1 99 99 SER CB C 13 63.5618 0.017481003 . 1 . . . . . 249 SER CB . 51636 1 537 . 1 . 1 99 99 SER N N 15 118.2141429 0.040670308 . 1 . . . . . 249 SER N . 51636 1 538 . 1 . 1 100 100 SER H H 1 8.345292524 0.000374828 . 1 . . . . . 250 SER H . 51636 1 539 . 1 . 1 100 100 SER C C 13 174.107 0.006139748 . 1 . . . . . 250 SER C . 51636 1 540 . 1 . 1 100 100 SER CA C 13 57.9133 0.009938206 . 1 . . . . . 250 SER CA . 51636 1 541 . 1 . 1 100 100 SER CB C 13 63.3849 0.011569519 . 1 . . . . . 250 SER CB . 51636 1 542 . 1 . 1 100 100 SER N N 15 117.9752438 0.039053663 . 1 . . . . . 250 SER N . 51636 1 543 . 1 . 1 101 101 ASP H H 1 8.215866829 0.000504712 . 1 . . . . . 251 ASP H . 51636 1 544 . 1 . 1 101 101 ASP C C 13 176.019 0.01147152 . 1 . . . . . 251 ASP C . 51636 1 545 . 1 . 1 101 101 ASP CA C 13 54.06 0.014679265 . 1 . . . . . 251 ASP CA . 51636 1 546 . 1 . 1 101 101 ASP CB C 13 40.6213 0.003406813 . 1 . . . . . 251 ASP CB . 51636 1 547 . 1 . 1 101 101 ASP N N 15 122.2480338 0.03732359 . 1 . . . . . 251 ASP N . 51636 1 548 . 1 . 1 102 102 SER H H 1 8.049455733 0.001260954 . 1 . . . . . 252 SER H . 51636 1 549 . 1 . 1 102 102 SER C C 13 174.261 0.011645344 . 1 . . . . . 252 SER C . 51636 1 550 . 1 . 1 102 102 SER CA C 13 57.9342 0.000284197 . 1 . . . . . 252 SER CA . 51636 1 551 . 1 . 1 102 102 SER CB C 13 63.4664 0.006799277 . 1 . . . . . 252 SER CB . 51636 1 552 . 1 . 1 102 102 SER N N 15 115.4219564 0.040560612 . 1 . . . . . 252 SER N . 51636 1 553 . 1 . 1 103 103 GLU H H 1 8.291335726 0.000897544 . 1 . . . . . 253 GLU H . 51636 1 554 . 1 . 1 103 103 GLU C C 13 176.14 0 . 1 . . . . . 253 GLU C . 51636 1 555 . 1 . 1 103 103 GLU CA C 13 55.9385 0.010937449 . 1 . . . . . 253 GLU CA . 51636 1 556 . 1 . 1 103 103 GLU CB C 13 29.8884 0.026311577 . 1 . . . . . 253 GLU CB . 51636 1 557 . 1 . 1 103 103 GLU CG C 13 35.9583 0 . 1 . . . . . 253 GLU CG . 51636 1 558 . 1 . 1 103 103 GLU N N 15 122.4653764 0.046199121 . 1 . . . . . 253 GLU N . 51636 1 559 . 1 . 1 104 104 GLU H H 1 8.1731203 0.001342771 . 1 . . . . . 254 GLU H . 51636 1 560 . 1 . 1 104 104 GLU C C 13 175.402 0.011369903 . 1 . . . . . 254 GLU C . 51636 1 561 . 1 . 1 104 104 GLU CA C 13 55.9522 0.000269614 . 1 . . . . . 254 GLU CA . 51636 1 562 . 1 . 1 104 104 GLU CB C 13 30.094 0.0347724 . 1 . . . . . 254 GLU CB . 51636 1 563 . 1 . 1 104 104 GLU CG C 13 35.8743 0 . 1 . . . . . 254 GLU CG . 51636 1 564 . 1 . 1 104 104 GLU N N 15 121.8626869 0.00000234 . 1 . . . . . 254 GLU N . 51636 1 565 . 1 . 1 105 105 GLU H H 1 7.923086115 0.000466241 . 1 . . . . . 255 GLU H . 51636 1 566 . 1 . 1 105 105 GLU C C 13 181.072 0 . 1 . . . . . 255 GLU C . 51636 1 567 . 1 . 1 105 105 GLU CA C 13 57.6873 0 . 1 . . . . . 255 GLU CA . 51636 1 568 . 1 . 1 105 105 GLU CB C 13 30.5787 0 . 1 . . . . . 255 GLU CB . 51636 1 569 . 1 . 1 105 105 GLU N N 15 127.1795298 0.045510503 . 1 . . . . . 255 GLU N . 51636 1 stop_ save_ save_assigned_chemical_shifts_2 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_2 _Assigned_chem_shift_list.Entry_ID 51636 _Assigned_chem_shift_list.ID 2 _Assigned_chem_shift_list.Name 'Assignment of MYC(151-255)' _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 2 '3D CBCA(CO)NH' . . . 51636 2 3 '3D CBCANH' . . . 51636 2 4 '3D HN(CA)CO' . . . 51636 2 5 '3D HNCO' . . . 51636 2 6 '3D C(CO)NH' . . . 51636 2 stop_ loop_ _Systematic_chem_shift_offset.Type _Systematic_chem_shift_offset.Atom_type _Systematic_chem_shift_offset.Atom_isotope_number _Systematic_chem_shift_offset.Val _Systematic_chem_shift_offset.Val_err _Systematic_chem_shift_offset.Entry_ID _Systematic_chem_shift_offset.Assigned_chem_shift_list_ID na 'all 13C' 13 2.66 . 51636 2 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 $software_2 . . 51636 2 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 . 2 . 1 10 10 GLY CA C 13 44.7381 0 . 1 . . . . . 160 GLY CA . 51636 2 2 . 2 . 1 11 11 SER H H 1 7.742946797 0.000523523 . 1 . . . . . 161 SER H . 51636 2 3 . 2 . 1 11 11 SER C C 13 172.775 0 . 1 . . . . . 161 SER C . 51636 2 4 . 2 . 1 11 11 SER CA C 13 55.3969 0 . 1 . . . . . 161 SER CA . 51636 2 5 . 2 . 1 11 11 SER CB C 13 63.6122 0 . 1 . . . . . 161 SER CB . 51636 2 6 . 2 . 1 11 11 SER N N 15 114.7697719 0.066308977 . 1 . . . . . 161 SER N . 51636 2 7 . 2 . 1 12 12 PRO C C 13 175.175 0 . 1 . . . . . 162 PRO C . 51636 2 8 . 2 . 1 12 12 PRO CA C 13 62.9798 0.000000674 . 1 . . . . . 162 PRO CA . 51636 2 9 . 2 . 1 12 12 PRO CB C 13 31.6224 0 . 1 . . . . . 162 PRO CB . 51636 2 10 . 2 . 1 12 12 PRO CD C 13 50.2878 0 . 1 . . . . . 162 PRO CD . 51636 2 11 . 2 . 1 12 12 PRO CG C 13 26.9603 0 . 1 . . . . . 162 PRO CG . 51636 2 12 . 2 . 1 13 13 ASN H H 1 8.044973717 0.000429034 . 1 . . . . . 163 ASN H . 51636 2 13 . 2 . 1 13 13 ASN C C 13 173.006 0 . 1 . . . . . 163 ASN C . 51636 2 14 . 2 . 1 13 13 ASN CA C 13 49.976 0 . 1 . . . . . 163 ASN CA . 51636 2 15 . 2 . 1 13 13 ASN CB C 13 40.0293 0 . 1 . . . . . 163 ASN CB . 51636 2 16 . 2 . 1 13 13 ASN N N 15 118.7612732 0.029617698 . 1 . . . . . 163 ASN N . 51636 2 17 . 2 . 1 14 14 PRO C C 13 175.424 0 . 1 . . . . . 164 PRO C . 51636 2 18 . 2 . 1 14 14 PRO CA C 13 62.4507 0.000000674 . 1 . . . . . 164 PRO CA . 51636 2 19 . 2 . 1 14 14 PRO CB C 13 34.0588 0 . 1 . . . . . 164 PRO CB . 51636 2 20 . 2 . 1 14 14 PRO CG C 13 24.5611 0 . 1 . . . . . 164 PRO CG . 51636 2 21 . 2 . 1 15 15 ALA H H 1 8.387310968 0.000512116 . 1 . . . . . 165 ALA H . 51636 2 22 . 2 . 1 15 15 ALA C C 13 177.666 0 . 1 . . . . . 165 ALA C . 51636 2 23 . 2 . 1 15 15 ALA CA C 13 52.2537 0.007449461 . 1 . . . . . 165 ALA CA . 51636 2 24 . 2 . 1 15 15 ALA CB C 13 18.6314 0.062572914 . 1 . . . . . 165 ALA CB . 51636 2 25 . 2 . 1 15 15 ALA N N 15 123.1371235 0.042585538 . 1 . . . . . 165 ALA N . 51636 2 26 . 2 . 1 16 16 ARG H H 1 8.257010653 0.000258497 . 1 . . . . . 166 ARG H . 51636 2 27 . 2 . 1 16 16 ARG C C 13 176.557 0.004871504 . 1 . . . . . 166 ARG C . 51636 2 28 . 2 . 1 16 16 ARG CA C 13 55.6388 0.015889607 . 1 . . . . . 166 ARG CA . 51636 2 29 . 2 . 1 16 16 ARG CB C 13 30.3822 0.003154601 . 1 . . . . . 166 ARG CB . 51636 2 30 . 2 . 1 16 16 ARG CD C 13 42.9278 0 . 1 . . . . . 166 ARG CD . 51636 2 31 . 2 . 1 16 16 ARG CG C 13 26.7158 0 . 1 . . . . . 166 ARG CG . 51636 2 32 . 2 . 1 16 16 ARG N N 15 119.866128 0.05288171 . 1 . . . . . 166 ARG N . 51636 2 33 . 2 . 1 17 17 GLY H H 1 8.240596962 0.000578945 . 1 . . . . . 167 GLY H . 51636 2 34 . 2 . 1 17 17 GLY C C 13 173.45 0 . 1 . . . . . 167 GLY C . 51636 2 35 . 2 . 1 17 17 GLY CA C 13 44.6592 0 . 1 . . . . . 167 GLY CA . 51636 2 36 . 2 . 1 17 17 GLY N N 15 109.6680428 0.062994081 . 1 . . . . . 167 GLY N . 51636 2 37 . 2 . 1 39 39 ILE C C 13 174.409 0 . 1 . . . . . 189 ILE C . 51636 2 38 . 2 . 1 39 39 ILE CA C 13 60.5603 0 . 1 . . . . . 189 ILE CA . 51636 2 39 . 2 . 1 39 39 ILE CB C 13 38.2594 0.000000477 . 1 . . . . . 189 ILE CB . 51636 2 40 . 2 . 1 39 39 ILE CG1 C 13 26.8014 0 . 1 . . . . . 189 ILE CG1 . 51636 2 41 . 2 . 1 39 39 ILE CG2 C 13 17.1224 0 . 1 . . . . . 189 ILE CG2 . 51636 2 42 . 2 . 1 40 40 ASP H H 1 7.906955126 0.00099858 . 1 . . . . . 190 ASP H . 51636 2 43 . 2 . 1 40 40 ASP C C 13 173.962 0 . 1 . . . . . 190 ASP C . 51636 2 44 . 2 . 1 40 40 ASP CA C 13 51.1472 0 . 1 . . . . . 190 ASP CA . 51636 2 45 . 2 . 1 40 40 ASP CB C 13 42.6545 0 . 1 . . . . . 190 ASP CB . 51636 2 46 . 2 . 1 40 40 ASP N N 15 124.44942 0.037569045 . 1 . . . . . 190 ASP N . 51636 2 47 . 2 . 1 42 42 SER C C 13 174.319 0 . 1 . . . . . 192 SER C . 51636 2 48 . 2 . 1 42 42 SER CA C 13 58.9786 0 . 1 . . . . . 192 SER CA . 51636 2 49 . 2 . 1 42 42 SER CB C 13 63.3121 0.000000674 . 1 . . . . . 192 SER CB . 51636 2 50 . 2 . 1 43 43 VAL H H 1 7.466936573 0.00078037 . 1 . . . . . 193 VAL H . 51636 2 51 . 2 . 1 43 43 VAL C C 13 175.238 0.005261224 . 1 . . . . . 193 VAL C . 51636 2 52 . 2 . 1 43 43 VAL CA C 13 61.585 0.017147667 . 1 . . . . . 193 VAL CA . 51636 2 53 . 2 . 1 43 43 VAL CB C 13 31.7825 0.047878203 . 1 . . . . . 193 VAL CB . 51636 2 54 . 2 . 1 43 43 VAL CG1 C 13 19.957 0 . 2 . . . . . 193 VAL CG1 . 51636 2 55 . 2 . 1 43 43 VAL CG2 C 13 20.9005 0 . 2 . . . . . 193 VAL CG2 . 51636 2 56 . 2 . 1 43 43 VAL N N 15 120.0318333 0.028874456 . 1 . . . . . 193 VAL N . 51636 2 57 . 2 . 1 44 44 VAL H H 1 7.68575266 0.000865451 . 1 . . . . . 194 VAL H . 51636 2 58 . 2 . 1 44 44 VAL C C 13 174.094 0.00156299 . 1 . . . . . 194 VAL C . 51636 2 59 . 2 . 1 44 44 VAL CA C 13 60.9519 0.015645778 . 1 . . . . . 194 VAL CA . 51636 2 60 . 2 . 1 44 44 VAL CB C 13 32.7627 0.036161072 . 1 . . . . . 194 VAL CB . 51636 2 61 . 2 . 1 44 44 VAL CG1 C 13 20.058 0 . 2 . . . . . 194 VAL CG1 . 51636 2 62 . 2 . 1 44 44 VAL CG2 C 13 20.9718 0 . 2 . . . . . 194 VAL CG2 . 51636 2 63 . 2 . 1 44 44 VAL N N 15 123.2666936 0.037037292 . 1 . . . . . 194 VAL N . 51636 2 64 . 2 . 1 45 45 PHE H H 1 8.108660014 0.000956325 . 1 . . . . . 195 PHE H . 51636 2 65 . 2 . 1 45 45 PHE CA C 13 55.9055 0.000000674 . 1 . . . . . 195 PHE CA . 51636 2 66 . 2 . 1 45 45 PHE CB C 13 40.2932 0.000000477 . 1 . . . . . 195 PHE CB . 51636 2 67 . 2 . 1 45 45 PHE N N 15 125.1173214 0.00000381 . 1 . . . . . 195 PHE N . 51636 2 68 . 2 . 1 46 46 PRO C C 13 174.869 0 . 1 . . . . . 196 PRO C . 51636 2 69 . 2 . 1 46 46 PRO CA C 13 61.9109 0.000000674 . 1 . . . . . 196 PRO CA . 51636 2 70 . 2 . 1 46 46 PRO CB C 13 33.2615 0 . 1 . . . . . 196 PRO CB . 51636 2 71 . 2 . 1 46 46 PRO CG C 13 24.3706 0 . 1 . . . . . 196 PRO CG . 51636 2 72 . 2 . 1 47 47 TYR H H 1 7.925671428 0.00055863 . 1 . . . . . 197 TYR H . 51636 2 73 . 2 . 1 47 47 TYR C C 13 174.148 0 . 1 . . . . . 197 TYR C . 51636 2 74 . 2 . 1 47 47 TYR CA C 13 55.4232 0 . 1 . . . . . 197 TYR CA . 51636 2 75 . 2 . 1 47 47 TYR CB C 13 36.6956 0 . 1 . . . . . 197 TYR CB . 51636 2 76 . 2 . 1 47 47 TYR N N 15 122.6401708 0.039028664 . 1 . . . . . 197 TYR N . 51636 2 77 . 2 . 1 48 48 PRO C C 13 175.537 0 . 1 . . . . . 198 PRO C . 51636 2 78 . 2 . 1 48 48 PRO CA C 13 62.2914 0 . 1 . . . . . 198 PRO CA . 51636 2 79 . 2 . 1 48 48 PRO CB C 13 33.4586 0 . 1 . . . . . 198 PRO CB . 51636 2 80 . 2 . 1 48 48 PRO CG C 13 24.2344 0 . 1 . . . . . 198 PRO CG . 51636 2 81 . 2 . 1 49 49 LEU H H 1 8.322102681 0.000383602 . 1 . . . . . 199 LEU H . 51636 2 82 . 2 . 1 49 49 LEU C C 13 176.81 0.016706119 . 1 . . . . . 199 LEU C . 51636 2 83 . 2 . 1 49 49 LEU CA C 13 55.1861 0.042113861 . 1 . . . . . 199 LEU CA . 51636 2 84 . 2 . 1 49 49 LEU CB C 13 41.6469 0.030263997 . 1 . . . . . 199 LEU CB . 51636 2 85 . 2 . 1 49 49 LEU CG C 13 26.8743 0 . 1 . . . . . 199 LEU CG . 51636 2 86 . 2 . 1 49 49 LEU N N 15 122.3858604 0.036053492 . 1 . . . . . 199 LEU N . 51636 2 87 . 2 . 1 50 50 ASN H H 1 8.220431017 0.00045864 . 1 . . . . . 200 ASN H . 51636 2 88 . 2 . 1 50 50 ASN C C 13 174.527 0.050118356 . 1 . . . . . 200 ASN C . 51636 2 89 . 2 . 1 50 50 ASN CA C 13 52.6541 0.02850391 . 1 . . . . . 200 ASN CA . 51636 2 90 . 2 . 1 50 50 ASN CB C 13 38.5519 0.011460213 . 1 . . . . . 200 ASN CB . 51636 2 91 . 2 . 1 50 50 ASN N N 15 118.4351333 0.062402531 . 1 . . . . . 200 ASN N . 51636 2 92 . 2 . 1 51 51 ASP H H 1 8.190144378 0.000374258 . 1 . . . . . 201 ASP H . 51636 2 93 . 2 . 1 51 51 ASP C C 13 176.414 0 . 1 . . . . . 201 ASP C . 51636 2 94 . 2 . 1 51 51 ASP CA C 13 53.7605 0 . 1 . . . . . 201 ASP CA . 51636 2 95 . 2 . 1 51 51 ASP CB C 13 40.7399 0 . 1 . . . . . 201 ASP CB . 51636 2 96 . 2 . 1 51 51 ASP N N 15 121.0742963 0.00000191 . 1 . . . . . 201 ASP N . 51636 2 97 . 2 . 1 53 53 SER C C 13 173.191 0 . 1 . . . . . 203 SER C . 51636 2 98 . 2 . 1 53 53 SER CA C 13 58.3309 0.000000954 . 1 . . . . . 203 SER CA . 51636 2 99 . 2 . 1 53 53 SER CB C 13 63.5616 0.000000674 . 1 . . . . . 203 SER CB . 51636 2 100 . 2 . 1 54 54 SER H H 1 7.866015395 0.000369742 . 1 . . . . . 204 SER H . 51636 2 101 . 2 . 1 54 54 SER C C 13 172.418 0 . 1 . . . . . 204 SER C . 51636 2 102 . 2 . 1 54 54 SER CA C 13 55.3006 0 . 1 . . . . . 204 SER CA . 51636 2 103 . 2 . 1 54 54 SER CB C 13 63.8096 0 . 1 . . . . . 204 SER CB . 51636 2 104 . 2 . 1 54 54 SER N N 15 116.7332251 0.036449437 . 1 . . . . . 204 SER N . 51636 2 105 . 2 . 1 55 55 PRO C C 13 176.033 0 . 1 . . . . . 205 PRO C . 51636 2 106 . 2 . 1 55 55 PRO CA C 13 62.2602 0.000000954 . 1 . . . . . 205 PRO CA . 51636 2 107 . 2 . 1 55 55 PRO CB C 13 33.9596 0 . 1 . . . . . 205 PRO CB . 51636 2 108 . 2 . 1 55 55 PRO CG C 13 24.4384 0 . 1 . . . . . 205 PRO CG . 51636 2 109 . 2 . 1 56 56 LYS H H 1 8.461828337 0.00042507 . 1 . . . . . 206 LYS H . 51636 2 110 . 2 . 1 56 56 LYS C C 13 176.63 0.009946391 . 1 . . . . . 206 LYS C . 51636 2 111 . 2 . 1 56 56 LYS CA C 13 56.1522 0.016252282 . 1 . . . . . 206 LYS CA . 51636 2 112 . 2 . 1 56 56 LYS CB C 13 32.6023 0.025676402 . 1 . . . . . 206 LYS CB . 51636 2 113 . 2 . 1 56 56 LYS CD C 13 28.7254 0 . 1 . . . . . 206 LYS CD . 51636 2 114 . 2 . 1 56 56 LYS CG C 13 24.5382 0 . 1 . . . . . 206 LYS CG . 51636 2 115 . 2 . 1 56 56 LYS N N 15 122.0591308 0.040864835 . 1 . . . . . 206 LYS N . 51636 2 116 . 2 . 1 57 57 SER H H 1 8.362081619 0.000795114 . 1 . . . . . 207 SER H . 51636 2 117 . 2 . 1 57 57 SER C C 13 174.269 0 . 1 . . . . . 207 SER C . 51636 2 118 . 2 . 1 57 57 SER CA C 13 57.8306 0.025050343 . 1 . . . . . 207 SER CA . 51636 2 119 . 2 . 1 57 57 SER CB C 13 63.4109 0.016343645 . 1 . . . . . 207 SER CB . 51636 2 120 . 2 . 1 57 57 SER N N 15 117.3472546 0.03021974 . 1 . . . . . 207 SER N . 51636 2 121 . 2 . 1 58 58 CYS H H 1 8.304616993 0.000956461 . 1 . . . . . 208 CYS H . 51636 2 122 . 2 . 1 58 58 CYS C C 13 174.025 0 . 1 . . . . . 208 CYS C . 51636 2 123 . 2 . 1 58 58 CYS CA C 13 57.9096 0 . 1 . . . . . 208 CYS CA . 51636 2 124 . 2 . 1 58 58 CYS CB C 13 27.7786 0 . 1 . . . . . 208 CYS CB . 51636 2 125 . 2 . 1 58 58 CYS N N 15 120.9885177 0.055033328 . 1 . . . . . 208 CYS N . 51636 2 126 . 2 . 1 65 65 ALA C C 13 176.942 0 . 1 . . . . . 215 ALA C . 51636 2 127 . 2 . 1 65 65 ALA CA C 13 52.0732 0 . 1 . . . . . 215 ALA CA . 51636 2 128 . 2 . 1 65 65 ALA CB C 13 18.6202 0 . 1 . . . . . 215 ALA CB . 51636 2 129 . 2 . 1 66 66 PHE H H 1 7.784117583 0.000493338 . 1 . . . . . 216 PHE H . 51636 2 130 . 2 . 1 66 66 PHE C C 13 174.573 0.010034622 . 1 . . . . . 216 PHE C . 51636 2 131 . 2 . 1 66 66 PHE CA C 13 56.9006 0.024286357 . 1 . . . . . 216 PHE CA . 51636 2 132 . 2 . 1 66 66 PHE CB C 13 39.2678 0.006965352 . 1 . . . . . 216 PHE CB . 51636 2 133 . 2 . 1 66 66 PHE N N 15 118.3893738 0.039457829 . 1 . . . . . 216 PHE N . 51636 2 134 . 2 . 1 67 67 SER H H 1 7.701230615 0.000202943 . 1 . . . . . 217 SER H . 51636 2 135 . 2 . 1 67 67 SER C C 13 172.348 0 . 1 . . . . . 217 SER C . 51636 2 136 . 2 . 1 67 67 SER CA C 13 54.9349 0 . 1 . . . . . 217 SER CA . 51636 2 137 . 2 . 1 67 67 SER CB C 13 63.9343 0 . 1 . . . . . 217 SER CB . 51636 2 138 . 2 . 1 67 67 SER N N 15 116.7790263 0.043674179 . 1 . . . . . 217 SER N . 51636 2 139 . 2 . 1 68 68 PRO C C 13 176.122 0 . 1 . . . . . 218 PRO C . 51636 2 140 . 2 . 1 68 68 PRO CA C 13 62.3384 0.005092078 . 1 . . . . . 218 PRO CA . 51636 2 141 . 2 . 1 68 68 PRO CB C 13 33.9603 0.026135011 . 1 . . . . . 218 PRO CB . 51636 2 142 . 2 . 1 68 68 PRO CG C 13 24.3632 0 . 1 . . . . . 218 PRO CG . 51636 2 143 . 2 . 1 69 69 SER H H 1 8.51589512 0.001082378 . 1 . . . . . 219 SER H . 51636 2 144 . 2 . 1 69 69 SER C C 13 174.932 0.010522449 . 1 . . . . . 219 SER C . 51636 2 145 . 2 . 1 69 69 SER CA C 13 58.0386 0.030962454 . 1 . . . . . 219 SER CA . 51636 2 146 . 2 . 1 69 69 SER CB C 13 63.5708 0.023795495 . 1 . . . . . 219 SER CB . 51636 2 147 . 2 . 1 69 69 SER N N 15 116.6237571 0.062556218 . 1 . . . . . 219 SER N . 51636 2 148 . 2 . 1 70 70 SER H H 1 8.408439701 0.000293811 . 1 . . . . . 220 SER H . 51636 2 149 . 2 . 1 70 70 SER CA C 13 58.3502 0 . 1 . . . . . 220 SER CA . 51636 2 150 . 2 . 1 70 70 SER CB C 13 63.1512 0 . 1 . . . . . 220 SER CB . 51636 2 151 . 2 . 1 70 70 SER N N 15 117.5836249 0.039609438 . 1 . . . . . 220 SER N . 51636 2 152 . 2 . 1 79 79 SER C C 13 173.119 0 . 1 . . . . . 229 SER C . 51636 2 153 . 2 . 1 79 79 SER CA C 13 57.8234 0.00000117 . 1 . . . . . 229 SER CA . 51636 2 154 . 2 . 1 79 79 SER CB C 13 63.6048 0.000000674 . 1 . . . . . 229 SER CB . 51636 2 155 . 2 . 1 80 80 SER H H 1 8.009055643 0.000230213 . 1 . . . . . 230 SER H . 51636 2 156 . 2 . 1 80 80 SER C C 13 172.65 0 . 1 . . . . . 230 SER C . 51636 2 157 . 2 . 1 80 80 SER CA C 13 55.195 0 . 1 . . . . . 230 SER CA . 51636 2 158 . 2 . 1 80 80 SER CB C 13 63.8114 0 . 1 . . . . . 230 SER CB . 51636 2 159 . 2 . 1 80 80 SER N N 15 117.0326372 0.048581015 . 1 . . . . . 230 SER N . 51636 2 160 . 2 . 1 81 81 PRO C C 13 176.158 0 . 1 . . . . . 231 PRO C . 51636 2 161 . 2 . 1 81 81 PRO CA C 13 62.3708 0 . 1 . . . . . 231 PRO CA . 51636 2 162 . 2 . 1 81 81 PRO CB C 13 33.9245 0 . 1 . . . . . 231 PRO CB . 51636 2 163 . 2 . 1 81 81 PRO CG C 13 24.3742 0 . 1 . . . . . 231 PRO CG . 51636 2 164 . 2 . 1 82 82 GLN H H 1 8.550319884 0.000588931 . 1 . . . . . 232 GLN H . 51636 2 165 . 2 . 1 82 82 GLN C C 13 176.322 0.009467307 . 1 . . . . . 232 GLN C . 51636 2 166 . 2 . 1 82 82 GLN CA C 13 56.045 0.001735251 . 1 . . . . . 232 GLN CA . 51636 2 167 . 2 . 1 82 82 GLN CB C 13 29.0092 0.023913898 . 1 . . . . . 232 GLN CB . 51636 2 168 . 2 . 1 82 82 GLN CG C 13 33.652 0 . 1 . . . . . 232 GLN CG . 51636 2 169 . 2 . 1 82 82 GLN N N 15 121.4464858 0.038472257 . 1 . . . . . 232 GLN N . 51636 2 170 . 2 . 1 83 83 GLY H H 1 8.365602455 0.001110999 . 1 . . . . . 233 GLY H . 51636 2 171 . 2 . 1 83 83 GLY C C 13 172.859 0.417652941 . 1 . . . . . 233 GLY C . 51636 2 172 . 2 . 1 83 83 GLY CA C 13 44.6799 0.083135336 . 1 . . . . . 233 GLY CA . 51636 2 173 . 2 . 1 83 83 GLY N N 15 110.4273059 0.035983115 . 1 . . . . . 233 GLY N . 51636 2 174 . 2 . 1 84 84 SER H H 1 7.705737397 0.000331932 . 1 . . . . . 234 SER H . 51636 2 175 . 2 . 1 84 84 SER C C 13 172.642 0 . 1 . . . . . 234 SER C . 51636 2 176 . 2 . 1 84 84 SER CA C 13 55.2407 0 . 1 . . . . . 234 SER CA . 51636 2 177 . 2 . 1 84 84 SER CB C 13 63.7996 0 . 1 . . . . . 234 SER CB . 51636 2 178 . 2 . 1 84 84 SER N N 15 114.5145163 0.038625765 . 1 . . . . . 234 SER N . 51636 2 179 . 2 . 1 85 85 PRO C C 13 175.792 0 . 1 . . . . . 235 PRO C . 51636 2 180 . 2 . 1 85 85 PRO CA C 13 62.2833 0.000000674 . 1 . . . . . 235 PRO CA . 51636 2 181 . 2 . 1 85 85 PRO CB C 13 33.8561 0 . 1 . . . . . 235 PRO CB . 51636 2 182 . 2 . 1 85 85 PRO CG C 13 24.3947 0 . 1 . . . . . 235 PRO CG . 51636 2 183 . 2 . 1 86 86 GLU H H 1 8.475213762 0.000460028 . 1 . . . . . 236 GLU H . 51636 2 184 . 2 . 1 86 86 GLU C C 13 174.298 0 . 1 . . . . . 236 GLU C . 51636 2 185 . 2 . 1 86 86 GLU CA C 13 54.3835 0 . 1 . . . . . 236 GLU CA . 51636 2 186 . 2 . 1 86 86 GLU CB C 13 28.8507 0 . 1 . . . . . 236 GLU CB . 51636 2 187 . 2 . 1 86 86 GLU N N 15 123.0564956 0.038500698 . 1 . . . . . 236 GLU N . 51636 2 188 . 2 . 1 87 87 PRO C C 13 175.373 0 . 1 . . . . . 237 PRO C . 51636 2 189 . 2 . 1 87 87 PRO CA C 13 61.8852 0 . 1 . . . . . 237 PRO CA . 51636 2 190 . 2 . 1 87 87 PRO CB C 13 33.8764 0 . 1 . . . . . 237 PRO CB . 51636 2 191 . 2 . 1 87 87 PRO CG C 13 24.3215 0 . 1 . . . . . 237 PRO CG . 51636 2 192 . 2 . 1 88 88 LEU H H 1 8.236038586 0.000713774 . 1 . . . . . 238 LEU H . 51636 2 193 . 2 . 1 88 88 LEU C C 13 176.898 0 . 1 . . . . . 238 LEU C . 51636 2 194 . 2 . 1 88 88 LEU CA C 13 55.1303 0 . 1 . . . . . 238 LEU CA . 51636 2 195 . 2 . 1 88 88 LEU CB C 13 41.6991 0 . 1 . . . . . 238 LEU CB . 51636 2 196 . 2 . 1 88 88 LEU N N 15 122.4622954 0.00021129 . 1 . . . . . 238 LEU N . 51636 2 197 . 2 . 1 89 89 VAL C C 13 175.236 0 . 1 . . . . . 239 VAL C . 51636 2 198 . 2 . 1 89 89 VAL CA C 13 61.4336 0 . 1 . . . . . 239 VAL CA . 51636 2 199 . 2 . 1 89 89 VAL CB C 13 32.4423 0 . 1 . . . . . 239 VAL CB . 51636 2 200 . 2 . 1 89 89 VAL CG1 C 13 20.2717 0 . 2 . . . . . 239 VAL CG1 . 51636 2 201 . 2 . 1 89 89 VAL CG2 C 13 20.8168 0 . 2 . . . . . 239 VAL CG2 . 51636 2 202 . 2 . 1 96 96 PRO C C 13 177.172 0 . 1 . . . . . 246 PRO C . 51636 2 203 . 2 . 1 96 96 PRO CA C 13 62.5886 0.000000674 . 1 . . . . . 246 PRO CA . 51636 2 204 . 2 . 1 96 96 PRO CB C 13 31.5228 0.000000477 . 1 . . . . . 246 PRO CB . 51636 2 205 . 2 . 1 96 96 PRO CD C 13 49.9787 0 . 1 . . . . . 246 PRO CD . 51636 2 206 . 2 . 1 96 96 PRO CG C 13 27.121 0 . 1 . . . . . 246 PRO CG . 51636 2 207 . 2 . 1 97 97 THR H H 1 8.33074824 0.000968196 . 1 . . . . . 247 THR H . 51636 2 208 . 2 . 1 97 97 THR C C 13 174.574 0 . 1 . . . . . 247 THR C . 51636 2 209 . 2 . 1 97 97 THR CA C 13 61.7534 0 . 1 . . . . . 247 THR CA . 51636 2 210 . 2 . 1 97 97 THR CB C 13 69.4088 0 . 1 . . . . . 247 THR CB . 51636 2 211 . 2 . 1 97 97 THR N N 15 115.1684044 0.040209523 . 1 . . . . . 247 THR N . 51636 2 stop_ save_ save_assigned_chemical_shifts_3 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_3 _Assigned_chem_shift_list.Entry_ID 51636 _Assigned_chem_shift_list.ID 3 _Assigned_chem_shift_list.Name 'Assignment of MYC(151-255)' _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 'It is from a minor trans conformation.' _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 2 '3D CBCA(CO)NH' . . . 51636 3 3 '3D CBCANH' . . . 51636 3 4 '3D HN(CA)CO' . . . 51636 3 5 '3D HNCO' . . . 51636 3 6 '3D C(CO)NH' . . . 51636 3 stop_ loop_ _Systematic_chem_shift_offset.Type _Systematic_chem_shift_offset.Atom_type _Systematic_chem_shift_offset.Atom_isotope_number _Systematic_chem_shift_offset.Val _Systematic_chem_shift_offset.Val_err _Systematic_chem_shift_offset.Entry_ID _Systematic_chem_shift_offset.Assigned_chem_shift_list_ID na 'all 13C' 13 2.66 . 51636 3 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 $software_2 . . 51636 3 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 41 41 PRO C C 13 176.907 0 . 1 . . . . . 191 PRO C . 51636 3 2 . 1 . 1 41 41 PRO CA C 13 63.1459 0 . 1 . . . . . 191 PRO CA . 51636 3 3 . 1 . 1 41 41 PRO CB C 13 31.6614 0 . 1 . . . . . 191 PRO CB . 51636 3 4 . 1 . 1 41 41 PRO CD C 13 50.6042 0 . 1 . . . . . 191 PRO CD . 51636 3 5 . 1 . 1 41 41 PRO CG C 13 26.6955 0 . 1 . . . . . 191 PRO CG . 51636 3 6 . 1 . 1 42 42 SER H H 1 8.306964771 0.000193627 . 1 . . . . . 192 SER H . 51636 3 7 . 1 . 1 42 42 SER C C 13 174.446 0 . 1 . . . . . 192 SER C . 51636 3 8 . 1 . 1 42 42 SER CA C 13 59.0065 0.017563955 . 1 . . . . . 192 SER CA . 51636 3 9 . 1 . 1 42 42 SER CB C 13 63.3564 0.004832749 . 1 . . . . . 192 SER CB . 51636 3 10 . 1 . 1 42 42 SER N N 15 114.8051499 0.00000234 . 1 . . . . . 192 SER N . 51636 3 11 . 1 . 1 43 43 VAL H H 1 7.50350917 0.001472758 . 1 . . . . . 193 VAL H . 51636 3 12 . 1 . 1 43 43 VAL C C 13 175.325 0.006665446 . 1 . . . . . 193 VAL C . 51636 3 13 . 1 . 1 43 43 VAL CA C 13 61.721 0.015460978 . 1 . . . . . 193 VAL CA . 51636 3 14 . 1 . 1 43 43 VAL CB C 13 31.9124 0.034060318 . 1 . . . . . 193 VAL CB . 51636 3 15 . 1 . 1 43 43 VAL CG1 C 13 20.1744 0 . 2 . . . . . 193 VAL CG1 . 51636 3 16 . 1 . 1 43 43 VAL CG2 C 13 20.9561 0 . 2 . . . . . 193 VAL CG2 . 51636 3 17 . 1 . 1 43 43 VAL N N 15 120.397206 0.021658878 . 1 . . . . . 193 VAL N . 51636 3 18 . 1 . 1 44 44 VAL H H 1 7.74293363 0.000291928 . 1 . . . . . 194 VAL H . 51636 3 19 . 1 . 1 44 44 VAL C C 13 173.69 0.001204409 . 1 . . . . . 194 VAL C . 51636 3 20 . 1 . 1 44 44 VAL CA C 13 61.5464 0.004043427 . 1 . . . . . 194 VAL CA . 51636 3 21 . 1 . 1 44 44 VAL CB C 13 32.5744 0.003983263 . 1 . . . . . 194 VAL CB . 51636 3 22 . 1 . 1 44 44 VAL CG1 C 13 20.2139 0 . 2 . . . . . 194 VAL CG1 . 51636 3 23 . 1 . 1 44 44 VAL CG2 C 13 20.7822 0 . 2 . . . . . 194 VAL CG2 . 51636 3 24 . 1 . 1 44 44 VAL N N 15 124.104994 0.00000191 . 1 . . . . . 194 VAL N . 51636 3 25 . 1 . 1 45 45 PHE H H 1 7.94926402 0.000461633 . 1 . . . . . 195 PHE H . 51636 3 26 . 1 . 1 45 45 PHE C C 13 174.033 0 . 1 . . . . . 195 PHE C . 51636 3 27 . 1 . 1 45 45 PHE CA C 13 55.3263 0 . 1 . . . . . 195 PHE CA . 51636 3 28 . 1 . 1 45 45 PHE CB C 13 41.1527 0 . 1 . . . . . 195 PHE CB . 51636 3 29 . 1 . 1 45 45 PHE N N 15 124.6491516 0.027035032 . 1 . . . . . 195 PHE N . 51636 3 30 . 1 . 1 46 46 PRO CA C 13 62.4803 0 . 1 . . . . . 196 PRO CA . 51636 3 31 . 1 . 1 46 46 PRO CB C 13 31.4467 0 . 1 . . . . . 196 PRO CB . 51636 3 32 . 1 . 1 46 46 PRO CD C 13 50.2599 0 . 1 . . . . . 196 PRO CD . 51636 3 33 . 1 . 1 46 46 PRO CG C 13 26.888 0 . 1 . . . . . 196 PRO CG . 51636 3 34 . 1 . 1 47 47 TYR H H 1 7.834269175 0.000443463 . 1 . . . . . 197 TYR H . 51636 3 35 . 1 . 1 47 47 TYR CA C 13 55.6996 0 . 1 . . . . . 197 TYR CA . 51636 3 36 . 1 . 1 47 47 TYR CB C 13 39.7697 0 . 1 . . . . . 197 TYR CB . 51636 3 37 . 1 . 1 47 47 TYR N N 15 120.2278594 0.043694364 . 1 . . . . . 197 TYR N . 51636 3 38 . 1 . 1 48 48 PRO CA C 13 62.5535 0.000000674 . 1 . . . . . 198 PRO CA . 51636 3 39 . 1 . 1 48 48 PRO CB C 13 31.4781 0 . 1 . . . . . 198 PRO CB . 51636 3 40 . 1 . 1 48 48 PRO CD C 13 50.3207 0 . 1 . . . . . 198 PRO CD . 51636 3 41 . 1 . 1 48 48 PRO CG C 13 26.9947 0 . 1 . . . . . 198 PRO CG . 51636 3 42 . 1 . 1 49 49 LEU H H 1 8.046223928 0.000389248 . 1 . . . . . 199 LEU H . 51636 3 43 . 1 . 1 49 49 LEU CA C 13 54.6146 0 . 1 . . . . . 199 LEU CA . 51636 3 44 . 1 . 1 49 49 LEU CB C 13 41.9927 0 . 1 . . . . . 199 LEU CB . 51636 3 45 . 1 . 1 49 49 LEU N N 15 122.0772037 0.041212075 . 1 . . . . . 199 LEU N . 51636 3 stop_ save_