data_27467 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 27467 _Entry.Title ; Solution structure of FAT10 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2018-04-28 _Entry.Accession_date 2018-04-28 _Entry.Last_release_date 2018-04-30 _Entry.Original_release_date 2018-04-30 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.0.16 _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 Silke Wiesner . . . . 27467 2 Samira Anders . . . . 27467 3 Sophie Stotz . . . . 27467 4 Philip Roessler . . . . 27467 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . 'Institute for Biophysics' . 27467 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 27467 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 266 27467 '15N chemical shifts' 83 27467 '1H chemical shifts' 564 27467 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 2 . . 2018-11-07 2018-04-28 update BMRB 'update entry citation' 27467 1 . . 2018-07-31 2018-04-28 original author 'original release' 27467 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 27467 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI 10.1038/s41467-018-05776-3 _Citation.PubMed_ID 30127417 _Citation.Full_citation . _Citation.Title ; The structure of the ubiquitin-like modifier FAT10 reveals an alternative targeting mechanism for proteasomal degradation ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Nat. Commun.' _Citation.Journal_name_full 'Nature communications' _Citation.Journal_volume 9 _Citation.Journal_issue 1 _Citation.Journal_ASTM . _Citation.Journal_ISSN 2041-1723 _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 3321 _Citation.Page_last 3321 _Citation.Year 2018 _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 Annette Aichem A. . . . 27467 1 2 Samira Anders S. . . . 27467 1 3 Nicola Catone N. . . . 27467 1 4 Philip Rossler P. . . . 27467 1 5 Sophie Stotz S. . . . 27467 1 6 Andrej Berg A. . . . 27467 1 7 Ricarda Schwab R. . . . 27467 1 8 Sophia Scheuermann S. . . . 27467 1 9 Johanna Bialas J. . . . 27467 1 10 Mira Schutz-Stoffregen M. C. . . 27467 1 11 Gunter Schmidtke G. . . . 27467 1 12 Christine Peter C. . . . 27467 1 13 Marcus Groettrup M. . . . 27467 1 14 Silke Wiesner S. . . . 27467 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID FAT10 27467 1 VCP 27467 1 degradation 27467 1 proteasome 27467 1 'ubiquitin-like modifier' 27467 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 27467 _Assembly.ID 1 _Assembly.Name 'FAT10 C-terminal domain' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass 9251.70 _Assembly.Enzyme_commission_number . _Assembly.Details Monomer _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 'FAT10 C-terminal domain' 1 $fat10_c A . yes native no no 1 'not applicable' . 27467 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_fat10_c _Entity.Sf_category entity _Entity.Sf_framecode fat10_c _Entity.Entry_ID 27467 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name fat10_c _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 ; GAMGDEELPLFLVESGDEAK RHLLQVRRSSSVAQVKAMIE TKTGIIPETQIVTLNGKRLE DGKMMADYGIRKGNLLFLAS YSIGG ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details ; Residues 1-4 represent a non-native sequence resulting from the NcoI restriction site. The difference in amino acid numbers to the natural sequence is +80. ; _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 85 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation 'C134L, C162S' _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 yes GB AAD52982.1 . 'ubiquitin-like protein FAT10' . . . . . . . . . . . . . . 27467 1 stop_ loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID 'protein degradation' 27467 1 'protein modification' 27467 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . GLY . 27467 1 2 . ALA . 27467 1 3 . MET . 27467 1 4 . GLY . 27467 1 5 . ASP . 27467 1 6 . GLU . 27467 1 7 . GLU . 27467 1 8 . LEU . 27467 1 9 . PRO . 27467 1 10 . LEU . 27467 1 11 . PHE . 27467 1 12 . LEU . 27467 1 13 . VAL . 27467 1 14 . GLU . 27467 1 15 . SER . 27467 1 16 . GLY . 27467 1 17 . ASP . 27467 1 18 . GLU . 27467 1 19 . ALA . 27467 1 20 . LYS . 27467 1 21 . ARG . 27467 1 22 . HIS . 27467 1 23 . LEU . 27467 1 24 . LEU . 27467 1 25 . GLN . 27467 1 26 . VAL . 27467 1 27 . ARG . 27467 1 28 . ARG . 27467 1 29 . SER . 27467 1 30 . SER . 27467 1 31 . SER . 27467 1 32 . VAL . 27467 1 33 . ALA . 27467 1 34 . GLN . 27467 1 35 . VAL . 27467 1 36 . LYS . 27467 1 37 . ALA . 27467 1 38 . MET . 27467 1 39 . ILE . 27467 1 40 . GLU . 27467 1 41 . THR . 27467 1 42 . LYS . 27467 1 43 . THR . 27467 1 44 . GLY . 27467 1 45 . ILE . 27467 1 46 . ILE . 27467 1 47 . PRO . 27467 1 48 . GLU . 27467 1 49 . THR . 27467 1 50 . GLN . 27467 1 51 . ILE . 27467 1 52 . VAL . 27467 1 53 . THR . 27467 1 54 . LEU . 27467 1 55 . ASN . 27467 1 56 . GLY . 27467 1 57 . LYS . 27467 1 58 . ARG . 27467 1 59 . LEU . 27467 1 60 . GLU . 27467 1 61 . ASP . 27467 1 62 . GLY . 27467 1 63 . LYS . 27467 1 64 . MET . 27467 1 65 . MET . 27467 1 66 . ALA . 27467 1 67 . ASP . 27467 1 68 . TYR . 27467 1 69 . GLY . 27467 1 70 . ILE . 27467 1 71 . ARG . 27467 1 72 . LYS . 27467 1 73 . GLY . 27467 1 74 . ASN . 27467 1 75 . LEU . 27467 1 76 . LEU . 27467 1 77 . PHE . 27467 1 78 . LEU . 27467 1 79 . ALA . 27467 1 80 . SER . 27467 1 81 . TYR . 27467 1 82 . SER . 27467 1 83 . ILE . 27467 1 84 . GLY . 27467 1 85 . GLY . 27467 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 27467 1 . ALA 2 2 27467 1 . MET 3 3 27467 1 . GLY 4 4 27467 1 . ASP 5 5 27467 1 . GLU 6 6 27467 1 . GLU 7 7 27467 1 . LEU 8 8 27467 1 . PRO 9 9 27467 1 . LEU 10 10 27467 1 . PHE 11 11 27467 1 . LEU 12 12 27467 1 . VAL 13 13 27467 1 . GLU 14 14 27467 1 . SER 15 15 27467 1 . GLY 16 16 27467 1 . ASP 17 17 27467 1 . GLU 18 18 27467 1 . ALA 19 19 27467 1 . LYS 20 20 27467 1 . ARG 21 21 27467 1 . HIS 22 22 27467 1 . LEU 23 23 27467 1 . LEU 24 24 27467 1 . GLN 25 25 27467 1 . VAL 26 26 27467 1 . ARG 27 27 27467 1 . ARG 28 28 27467 1 . SER 29 29 27467 1 . SER 30 30 27467 1 . SER 31 31 27467 1 . VAL 32 32 27467 1 . ALA 33 33 27467 1 . GLN 34 34 27467 1 . VAL 35 35 27467 1 . LYS 36 36 27467 1 . ALA 37 37 27467 1 . MET 38 38 27467 1 . ILE 39 39 27467 1 . GLU 40 40 27467 1 . THR 41 41 27467 1 . LYS 42 42 27467 1 . THR 43 43 27467 1 . GLY 44 44 27467 1 . ILE 45 45 27467 1 . ILE 46 46 27467 1 . PRO 47 47 27467 1 . GLU 48 48 27467 1 . THR 49 49 27467 1 . GLN 50 50 27467 1 . ILE 51 51 27467 1 . VAL 52 52 27467 1 . THR 53 53 27467 1 . LEU 54 54 27467 1 . ASN 55 55 27467 1 . GLY 56 56 27467 1 . LYS 57 57 27467 1 . ARG 58 58 27467 1 . LEU 59 59 27467 1 . GLU 60 60 27467 1 . ASP 61 61 27467 1 . GLY 62 62 27467 1 . LYS 63 63 27467 1 . MET 64 64 27467 1 . MET 65 65 27467 1 . ALA 66 66 27467 1 . ASP 67 67 27467 1 . TYR 68 68 27467 1 . GLY 69 69 27467 1 . ILE 70 70 27467 1 . ARG 71 71 27467 1 . LYS 72 72 27467 1 . GLY 73 73 27467 1 . ASN 74 74 27467 1 . LEU 75 75 27467 1 . LEU 76 76 27467 1 . PHE 77 77 27467 1 . LEU 78 78 27467 1 . ALA 79 79 27467 1 . SER 80 80 27467 1 . TYR 81 81 27467 1 . SER 82 82 27467 1 . ILE 83 83 27467 1 . GLY 84 84 27467 1 . GLY 85 85 27467 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 27467 _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 $fat10_c . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . 27467 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source _Entity_experimental_src_list.Entry_ID 27467 _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 $fat10_c . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . pETM-41 . . . 27467 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 27467 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 fat10_c '[U-100% 13C; U-100% 15N]' . . 1 $fat10_c . . 2 . . mM . . . . 27467 1 2 'sodium phosphate' 'natural abundance' . . . . . . 20 . . mM . . . . 27467 1 3 'sodium chloride' 'natural abundance' . . . . . . 150 . . mM . . . . 27467 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 27467 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0.2 . M 27467 1 pH 7.5 . pH 27467 1 pressure 1 . atm 27467 1 temperature 298 . K 27467 1 stop_ save_ ############################ # Computer software used # ############################ save_XEASY _Software.Sf_category software _Software.Sf_framecode XEASY _Software.Entry_ID 27467 _Software.ID 1 _Software.Type . _Software.Name XEASY _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Keller and Wuthrich' . . 27467 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 27467 1 'peak picking' 27467 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 27467 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 27467 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 27467 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker Avance . 600 . . . 27467 1 2 spectrometer_2 Bruker Avance . 800 . . . 27467 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 27467 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27467 1 2 '2D 1H-13C HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27467 1 3 '2D 1H-1H NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 27467 1 4 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27467 1 5 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27467 1 6 '3D C(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27467 1 7 '3D HBHA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27467 1 8 '3D HNHA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 27467 1 9 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 27467 1 10 '3D 1H-13C NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 27467 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 27467 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 water protons . . . . ppm 0 na indirect . . . . . . 27467 1 H 1 water protons . . . . ppm 4.78 internal indirect 1 . . . . . 27467 1 N 15 water protons . . . . ppm 0 na indirect . . . . . . 27467 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 27467 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 3 '2D 1H-1H NOESY' . . . 27467 1 9 '3D 1H-15N NOESY' . . . 27467 1 10 '3D 1H-13C NOESY' . . . 27467 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $XEASY . . 27467 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.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 1 1 GLY HA2 H 1 3.832 0.000 . . . . . . . 1 GLY HA1 . 27467 1 2 . 1 1 1 1 GLY CA C 13 43.745 0.000 . . . . . . . 1 GLY CA . 27467 1 3 . 1 1 2 2 ALA HA H 1 4.432 0.000 . . . . . . . 2 ALA HA . 27467 1 4 . 1 1 2 2 ALA HB1 H 1 1.457 0.000 . . . . . . . 2 ALA QB . 27467 1 5 . 1 1 2 2 ALA HB2 H 1 1.457 0.000 . . . . . . . 2 ALA QB . 27467 1 6 . 1 1 2 2 ALA HB3 H 1 1.457 0.000 . . . . . . . 2 ALA QB . 27467 1 7 . 1 1 2 2 ALA CA C 13 52.566 0.000 . . . . . . . 2 ALA CA . 27467 1 8 . 1 1 2 2 ALA CB C 13 19.107 0.000 . . . . . . . 2 ALA CB . 27467 1 9 . 1 1 3 3 MET HA H 1 4.532 0.000 . . . . . . . 3 MET HA . 27467 1 10 . 1 1 3 3 MET HB2 H 1 2.142 0.000 . . . . . . . 3 MET HB2 . 27467 1 11 . 1 1 3 3 MET HG2 H 1 2.700 0.000 . . . . . . . 3 MET HG2 . 27467 1 12 . 1 1 3 3 MET HG3 H 1 2.627 0.000 . . . . . . . 3 MET HG3 . 27467 1 13 . 1 1 3 3 MET CA C 13 55.770 0.000 . . . . . . . 3 MET CA . 27467 1 14 . 1 1 3 3 MET CB C 13 32.546 0.000 . . . . . . . 3 MET CB . 27467 1 15 . 1 1 3 3 MET CG C 13 32.078 0.000 . . . . . . . 3 MET CG . 27467 1 16 . 1 1 4 4 GLY H H 1 8.545 0.000 . . . . . . . 4 GLY HN . 27467 1 17 . 1 1 4 4 GLY N N 15 110.530 0.000 . . . . . . . 4 GLY N . 27467 1 18 . 1 1 5 5 ASP HA H 1 4.886 0.000 . . . . . . . 5 ASP HA . 27467 1 19 . 1 1 5 5 ASP HB2 H 1 2.744 0.000 . . . . . . . 5 ASP HB2 . 27467 1 20 . 1 1 5 5 ASP HB3 H 1 2.527 0.000 . . . . . . . 5 ASP HB3 . 27467 1 21 . 1 1 5 5 ASP CA C 13 53.485 0.000 . . . . . . . 5 ASP CA . 27467 1 22 . 1 1 5 5 ASP CB C 13 41.464 0.000 . . . . . . . 5 ASP CB . 27467 1 23 . 1 1 6 6 GLU H H 1 8.264 0.000 . . . . . . . 6 GLU HN . 27467 1 24 . 1 1 6 6 GLU HA H 1 4.195 0.000 . . . . . . . 6 GLU HA . 27467 1 25 . 1 1 6 6 GLU HB2 H 1 2.008 0.000 . . . . . . . 6 GLU HB2 . 27467 1 26 . 1 1 6 6 GLU HG2 H 1 2.238 0.000 . . . . . . . 6 GLU HG2 . 27467 1 27 . 1 1 6 6 GLU CA C 13 56.957 0.000 . . . . . . . 6 GLU CA . 27467 1 28 . 1 1 6 6 GLU CB C 13 30.716 0.000 . . . . . . . 6 GLU CB . 27467 1 29 . 1 1 6 6 GLU CG C 13 36.147 0.000 . . . . . . . 6 GLU CG . 27467 1 30 . 1 1 6 6 GLU N N 15 120.681 0.000 . . . . . . . 6 GLU N . 27467 1 31 . 1 1 7 7 GLU H H 1 8.523 0.005 . . . . . . . 7 GLU HN . 27467 1 32 . 1 1 7 7 GLU HA H 1 4.156 0.010 . . . . . . . 7 GLU HA . 27467 1 33 . 1 1 7 7 GLU HB2 H 1 1.921 0.006 . . . . . . . 7 GLU HB2 . 27467 1 34 . 1 1 7 7 GLU HB3 H 1 1.792 0.001 . . . . . . . 7 GLU HB3 . 27467 1 35 . 1 1 7 7 GLU HG2 H 1 2.146 0.007 . . . . . . . 7 GLU HG2 . 27467 1 36 . 1 1 7 7 GLU HG3 H 1 1.999 0.000 . . . . . . . 7 GLU HG3 . 27467 1 37 . 1 1 7 7 GLU CA C 13 56.342 0.000 . . . . . . . 7 GLU CA . 27467 1 38 . 1 1 7 7 GLU CB C 13 31.117 0.000 . . . . . . . 7 GLU CB . 27467 1 39 . 1 1 7 7 GLU CG C 13 37.088 0.000 . . . . . . . 7 GLU CG . 27467 1 40 . 1 1 7 7 GLU N N 15 121.499 0.000 . . . . . . . 7 GLU N . 27467 1 41 . 1 1 8 8 LEU H H 1 9.087 0.001 . . . . . . . 8 LEU HN . 27467 1 42 . 1 1 8 8 LEU HA H 1 4.859 0.000 . . . . . . . 8 LEU HA . 27467 1 43 . 1 1 8 8 LEU HB2 H 1 1.698 0.000 . . . . . . . 8 LEU HB2 . 27467 1 44 . 1 1 8 8 LEU HB3 H 1 1.007 0.018 . . . . . . . 8 LEU HB3 . 27467 1 45 . 1 1 8 8 LEU HG H 1 1.707 0.000 . . . . . . . 8 LEU HG . 27467 1 46 . 1 1 8 8 LEU HD11 H 1 0.689 0.023 . . . . . . . 8 LEU QD1 . 27467 1 47 . 1 1 8 8 LEU HD12 H 1 0.689 0.023 . . . . . . . 8 LEU QD1 . 27467 1 48 . 1 1 8 8 LEU HD13 H 1 0.689 0.023 . . . . . . . 8 LEU QD1 . 27467 1 49 . 1 1 8 8 LEU HD21 H 1 0.815 0.026 . . . . . . . 8 LEU QD2 . 27467 1 50 . 1 1 8 8 LEU HD22 H 1 0.815 0.026 . . . . . . . 8 LEU QD2 . 27467 1 51 . 1 1 8 8 LEU HD23 H 1 0.815 0.026 . . . . . . . 8 LEU QD2 . 27467 1 52 . 1 1 8 8 LEU CA C 13 51.527 0.000 . . . . . . . 8 LEU CA . 27467 1 53 . 1 1 8 8 LEU CB C 13 43.911 0.000 . . . . . . . 8 LEU CB . 27467 1 54 . 1 1 8 8 LEU CG C 13 26.980 0.000 . . . . . . . 8 LEU CG . 27467 1 55 . 1 1 8 8 LEU CD1 C 13 25.996 0.000 . . . . . . . 8 LEU CD1 . 27467 1 56 . 1 1 8 8 LEU CD2 C 13 25.012 0.000 . . . . . . . 8 LEU CD2 . 27467 1 57 . 1 1 8 8 LEU N N 15 126.369 0.000 . . . . . . . 8 LEU N . 27467 1 58 . 1 1 9 9 PRO HA H 1 4.810 0.002 . . . . . . . 9 PRO HA . 27467 1 59 . 1 1 9 9 PRO HB2 H 1 2.041 0.043 . . . . . . . 9 PRO HB2 . 27467 1 60 . 1 1 9 9 PRO HB3 H 1 1.727 0.000 . . . . . . . 9 PRO HB3 . 27467 1 61 . 1 1 9 9 PRO HG2 H 1 2.325 0.026 . . . . . . . 9 PRO HG2 . 27467 1 62 . 1 1 9 9 PRO HG3 H 1 2.163 0.000 . . . . . . . 9 PRO HG3 . 27467 1 63 . 1 1 9 9 PRO HD2 H 1 3.913 0.000 . . . . . . . 9 PRO HD2 . 27467 1 64 . 1 1 9 9 PRO HD3 H 1 3.884 0.000 . . . . . . . 9 PRO HD3 . 27467 1 65 . 1 1 9 9 PRO CA C 13 61.656 0.000 . . . . . . . 9 PRO CA . 27467 1 66 . 1 1 9 9 PRO CB C 13 31.460 0.000 . . . . . . . 9 PRO CB . 27467 1 67 . 1 1 9 9 PRO CG C 13 27.762 0.000 . . . . . . . 9 PRO CG . 27467 1 68 . 1 1 9 9 PRO CD C 13 50.268 0.000 . . . . . . . 9 PRO CD . 27467 1 69 . 1 1 10 10 LEU H H 1 8.711 0.000 . . . . . . . 10 LEU HN . 27467 1 70 . 1 1 10 10 LEU HA H 1 4.612 0.009 . . . . . . . 10 LEU HA . 27467 1 71 . 1 1 10 10 LEU HB2 H 1 1.436 0.023 . . . . . . . 10 LEU HB2 . 27467 1 72 . 1 1 10 10 LEU HB3 H 1 1.312 0.002 . . . . . . . 10 LEU HB3 . 27467 1 73 . 1 1 10 10 LEU HG H 1 1.676 0.003 . . . . . . . 10 LEU HG . 27467 1 74 . 1 1 10 10 LEU HD11 H 1 0.817 0.000 . . . . . . . 10 LEU QD1 . 27467 1 75 . 1 1 10 10 LEU HD12 H 1 0.817 0.000 . . . . . . . 10 LEU QD1 . 27467 1 76 . 1 1 10 10 LEU HD13 H 1 0.817 0.000 . . . . . . . 10 LEU QD1 . 27467 1 77 . 1 1 10 10 LEU HD21 H 1 0.753 0.015 . . . . . . . 10 LEU QD2 . 27467 1 78 . 1 1 10 10 LEU HD22 H 1 0.753 0.015 . . . . . . . 10 LEU QD2 . 27467 1 79 . 1 1 10 10 LEU HD23 H 1 0.753 0.015 . . . . . . . 10 LEU QD2 . 27467 1 80 . 1 1 10 10 LEU CA C 13 53.450 0.000 . . . . . . . 10 LEU CA . 27467 1 81 . 1 1 10 10 LEU CB C 13 45.497 0.000 . . . . . . . 10 LEU CB . 27467 1 82 . 1 1 10 10 LEU CG C 13 28.064 0.000 . . . . . . . 10 LEU CG . 27467 1 83 . 1 1 10 10 LEU CD1 C 13 25.733 0.000 . . . . . . . 10 LEU CD1 . 27467 1 84 . 1 1 10 10 LEU CD2 C 13 25.733 0.000 . . . . . . . 10 LEU CD2 . 27467 1 85 . 1 1 10 10 LEU N N 15 126.775 0.000 . . . . . . . 10 LEU N . 27467 1 86 . 1 1 11 11 PHE H H 1 8.239 0.000 . . . . . . . 11 PHE HN . 27467 1 87 . 1 1 11 11 PHE HA H 1 5.360 0.008 . . . . . . . 11 PHE HA . 27467 1 88 . 1 1 11 11 PHE HB2 H 1 2.753 0.008 . . . . . . . 11 PHE HB2 . 27467 1 89 . 1 1 11 11 PHE HB3 H 1 2.543 0.021 . . . . . . . 11 PHE HB3 . 27467 1 90 . 1 1 11 11 PHE HD1 H 1 6.962 0.012 . . . . . . . 11 PHE QD . 27467 1 91 . 1 1 11 11 PHE HD2 H 1 6.962 0.012 . . . . . . . 11 PHE QD . 27467 1 92 . 1 1 11 11 PHE HE1 H 1 7.332 0.011 . . . . . . . 11 PHE QE . 27467 1 93 . 1 1 11 11 PHE HE2 H 1 7.332 0.011 . . . . . . . 11 PHE QE . 27467 1 94 . 1 1 11 11 PHE CA C 13 56.675 0.000 . . . . . . . 11 PHE CA . 27467 1 95 . 1 1 11 11 PHE CB C 13 41.212 0.000 . . . . . . . 11 PHE CB . 27467 1 96 . 1 1 11 11 PHE N N 15 116.117 0.000 . . . . . . . 11 PHE N . 27467 1 97 . 1 1 12 12 LEU H H 1 9.308 0.002 . . . . . . . 12 LEU HN . 27467 1 98 . 1 1 12 12 LEU HA H 1 5.057 0.027 . . . . . . . 12 LEU HA . 27467 1 99 . 1 1 12 12 LEU HB2 H 1 1.981 0.018 . . . . . . . 12 LEU HB2 . 27467 1 100 . 1 1 12 12 LEU HB3 H 1 1.280 0.022 . . . . . . . 12 LEU HB3 . 27467 1 101 . 1 1 12 12 LEU HG H 1 1.505 0.028 . . . . . . . 12 LEU HG . 27467 1 102 . 1 1 12 12 LEU HD11 H 1 0.900 0.007 . . . . . . . 12 LEU QD1 . 27467 1 103 . 1 1 12 12 LEU HD12 H 1 0.900 0.007 . . . . . . . 12 LEU QD1 . 27467 1 104 . 1 1 12 12 LEU HD13 H 1 0.900 0.007 . . . . . . . 12 LEU QD1 . 27467 1 105 . 1 1 12 12 LEU HD21 H 1 0.794 0.006 . . . . . . . 12 LEU QD2 . 27467 1 106 . 1 1 12 12 LEU HD22 H 1 0.794 0.006 . . . . . . . 12 LEU QD2 . 27467 1 107 . 1 1 12 12 LEU HD23 H 1 0.794 0.006 . . . . . . . 12 LEU QD2 . 27467 1 108 . 1 1 12 12 LEU CA C 13 53.211 0.000 . . . . . . . 12 LEU CA . 27467 1 109 . 1 1 12 12 LEU CB C 13 45.062 0.000 . . . . . . . 12 LEU CB . 27467 1 110 . 1 1 12 12 LEU CG C 13 27.343 0.000 . . . . . . . 12 LEU CG . 27467 1 111 . 1 1 12 12 LEU CD1 C 13 24.656 0.000 . . . . . . . 12 LEU CD1 . 27467 1 112 . 1 1 12 12 LEU CD2 C 13 27.008 0.000 . . . . . . . 12 LEU CD2 . 27467 1 113 . 1 1 12 12 LEU N N 15 125.150 0.000 . . . . . . . 12 LEU N . 27467 1 114 . 1 1 13 13 VAL H H 1 9.164 0.000 . . . . . . . 13 VAL HN . 27467 1 115 . 1 1 13 13 VAL HA H 1 4.528 0.001 . . . . . . . 13 VAL HA . 27467 1 116 . 1 1 13 13 VAL HB H 1 1.690 0.001 . . . . . . . 13 VAL HB . 27467 1 117 . 1 1 13 13 VAL HG11 H 1 0.915 0.025 . . . . . . . 13 VAL QG1 . 27467 1 118 . 1 1 13 13 VAL HG12 H 1 0.915 0.025 . . . . . . . 13 VAL QG1 . 27467 1 119 . 1 1 13 13 VAL HG13 H 1 0.915 0.025 . . . . . . . 13 VAL QG1 . 27467 1 120 . 1 1 13 13 VAL HG21 H 1 0.583 0.019 . . . . . . . 13 VAL QG2 . 27467 1 121 . 1 1 13 13 VAL HG22 H 1 0.583 0.019 . . . . . . . 13 VAL QG2 . 27467 1 122 . 1 1 13 13 VAL HG23 H 1 0.583 0.019 . . . . . . . 13 VAL QG2 . 27467 1 123 . 1 1 13 13 VAL CA C 13 61.484 0.000 . . . . . . . 13 VAL CA . 27467 1 124 . 1 1 13 13 VAL CB C 13 33.689 0.000 . . . . . . . 13 VAL CB . 27467 1 125 . 1 1 13 13 VAL CG1 C 13 21.398 0.000 . . . . . . . 13 VAL CG1 . 27467 1 126 . 1 1 13 13 VAL CG2 C 13 21.075 0.000 . . . . . . . 13 VAL CG2 . 27467 1 127 . 1 1 13 13 VAL N N 15 128.400 0.000 . . . . . . . 13 VAL N . 27467 1 128 . 1 1 14 14 GLU H H 1 8.734 0.002 . . . . . . . 14 GLU HN . 27467 1 129 . 1 1 14 14 GLU HA H 1 4.542 0.011 . . . . . . . 14 GLU HA . 27467 1 130 . 1 1 14 14 GLU HB2 H 1 2.326 0.000 . . . . . . . 14 GLU HB2 . 27467 1 131 . 1 1 14 14 GLU HB3 H 1 2.128 0.000 . . . . . . . 14 GLU HB3 . 27467 1 132 . 1 1 14 14 GLU HG2 H 1 2.385 0.000 . . . . . . . 14 GLU HG2 . 27467 1 133 . 1 1 14 14 GLU HG3 H 1 2.222 0.000 . . . . . . . 14 GLU HG3 . 27467 1 134 . 1 1 14 14 GLU CA C 13 56.648 0.000 . . . . . . . 14 GLU CA . 27467 1 135 . 1 1 14 14 GLU CB C 13 31.194 0.000 . . . . . . . 14 GLU CB . 27467 1 136 . 1 1 14 14 GLU CG C 13 37.748 0.000 . . . . . . . 14 GLU CG . 27467 1 137 . 1 1 14 14 GLU N N 15 126.775 0.000 . . . . . . . 14 GLU N . 27467 1 138 . 1 1 15 15 SER H H 1 8.628 0.000 . . . . . . . 15 SER HN . 27467 1 139 . 1 1 15 15 SER HA H 1 4.459 0.023 . . . . . . . 15 SER HA . 27467 1 140 . 1 1 15 15 SER HB2 H 1 3.974 0.028 . . . . . . . 15 SER HB2 . 27467 1 141 . 1 1 15 15 SER CA C 13 59.665 0.000 . . . . . . . 15 SER CA . 27467 1 142 . 1 1 15 15 SER CB C 13 63.931 0.000 . . . . . . . 15 SER CB . 27467 1 143 . 1 1 15 15 SER N N 15 117.838 0.000 . . . . . . . 15 SER N . 27467 1 144 . 1 1 16 16 GLY H H 1 8.583 0.001 . . . . . . . 16 GLY HN . 27467 1 145 . 1 1 16 16 GLY HA2 H 1 4.245 0.012 . . . . . . . 16 GLY HA1 . 27467 1 146 . 1 1 16 16 GLY HA3 H 1 3.947 0.004 . . . . . . . 16 GLY HA2 . 27467 1 147 . 1 1 16 16 GLY CA C 13 45.043 0.000 . . . . . . . 16 GLY CA . 27467 1 148 . 1 1 16 16 GLY N N 15 110.530 0.000 . . . . . . . 16 GLY N . 27467 1 149 . 1 1 17 17 ASP H H 1 8.197 0.008 . . . . . . . 17 ASP HN . 27467 1 150 . 1 1 17 17 ASP HA H 1 4.551 0.010 . . . . . . . 17 ASP HA . 27467 1 151 . 1 1 17 17 ASP HB2 H 1 2.784 0.008 . . . . . . . 17 ASP HB2 . 27467 1 152 . 1 1 17 17 ASP HB3 H 1 2.569 0.000 . . . . . . . 17 ASP HB3 . 27467 1 153 . 1 1 17 17 ASP CA C 13 55.085 0.000 . . . . . . . 17 ASP CA . 27467 1 154 . 1 1 17 17 ASP CB C 13 41.068 0.000 . . . . . . . 17 ASP CB . 27467 1 155 . 1 1 17 17 ASP N N 15 120.280 0.000 . . . . . . . 17 ASP N . 27467 1 156 . 1 1 18 18 GLU H H 1 8.560 0.010 . . . . . . . 18 GLU HN . 27467 1 157 . 1 1 18 18 GLU HA H 1 4.143 0.000 . . . . . . . 18 GLU HA . 27467 1 158 . 1 1 18 18 GLU HB2 H 1 2.090 0.016 . . . . . . . 18 GLU HB2 . 27467 1 159 . 1 1 18 18 GLU HB3 H 1 1.954 0.002 . . . . . . . 18 GLU HB3 . 27467 1 160 . 1 1 18 18 GLU HG2 H 1 2.295 0.007 . . . . . . . 18 GLU HG2 . 27467 1 161 . 1 1 18 18 GLU CA C 13 57.653 0.000 . . . . . . . 18 GLU CA . 27467 1 162 . 1 1 18 18 GLU CB C 13 29.744 0.000 . . . . . . . 18 GLU CB . 27467 1 163 . 1 1 18 18 GLU CG C 13 36.833 0.000 . . . . . . . 18 GLU CG . 27467 1 164 . 1 1 18 18 GLU N N 15 120.161 0.000 . . . . . . . 18 GLU N . 27467 1 165 . 1 1 19 19 ALA H H 1 7.989 0.000 . . . . . . . 19 ALA HN . 27467 1 166 . 1 1 19 19 ALA HA H 1 4.182 0.000 . . . . . . . 19 ALA HA . 27467 1 167 . 1 1 19 19 ALA HB1 H 1 1.370 0.002 . . . . . . . 19 ALA QB . 27467 1 168 . 1 1 19 19 ALA HB2 H 1 1.370 0.002 . . . . . . . 19 ALA QB . 27467 1 169 . 1 1 19 19 ALA HB3 H 1 1.370 0.002 . . . . . . . 19 ALA QB . 27467 1 170 . 1 1 19 19 ALA CA C 13 52.577 0.000 . . . . . . . 19 ALA CA . 27467 1 171 . 1 1 19 19 ALA CB C 13 18.940 0.000 . . . . . . . 19 ALA CB . 27467 1 172 . 1 1 19 19 ALA N N 15 121.905 0.000 . . . . . . . 19 ALA N . 27467 1 173 . 1 1 20 20 LYS H H 1 7.960 0.003 . . . . . . . 20 LYS HN . 27467 1 174 . 1 1 20 20 LYS HA H 1 4.183 0.010 . . . . . . . 20 LYS HA . 27467 1 175 . 1 1 20 20 LYS HB2 H 1 1.772 0.000 . . . . . . . 20 LYS HB2 . 27467 1 176 . 1 1 20 20 LYS HB3 H 1 1.689 0.000 . . . . . . . 20 LYS HB3 . 27467 1 177 . 1 1 20 20 LYS HG2 H 1 1.697 0.016 . . . . . . . 20 LYS HG2 . 27467 1 178 . 1 1 20 20 LYS HG3 H 1 1.255 0.008 . . . . . . . 20 LYS HG3 . 27467 1 179 . 1 1 20 20 LYS HD2 H 1 1.349 0.000 . . . . . . . 20 LYS HD2 . 27467 1 180 . 1 1 20 20 LYS HD3 H 1 1.249 0.000 . . . . . . . 20 LYS HD3 . 27467 1 181 . 1 1 20 20 LYS HE2 H 1 3.062 0.000 . . . . . . . 20 LYS HE2 . 27467 1 182 . 1 1 20 20 LYS HE3 H 1 3.002 0.000 . . . . . . . 20 LYS HE3 . 27467 1 183 . 1 1 20 20 LYS CA C 13 56.503 0.000 . . . . . . . 20 LYS CA . 27467 1 184 . 1 1 20 20 LYS CB C 13 33.117 0.000 . . . . . . . 20 LYS CB . 27467 1 185 . 1 1 20 20 LYS CG C 13 29.031 0.000 . . . . . . . 20 LYS CG . 27467 1 186 . 1 1 20 20 LYS CD C 13 24.847 0.000 . . . . . . . 20 LYS CD . 27467 1 187 . 1 1 20 20 LYS CE C 13 41.999 0.000 . . . . . . . 20 LYS CE . 27467 1 188 . 1 1 20 20 LYS N N 15 121.088 0.000 . . . . . . . 20 LYS N . 27467 1 189 . 1 1 21 21 ARG H H 1 7.873 0.002 . . . . . . . 21 ARG HN . 27467 1 190 . 1 1 21 21 ARG HA H 1 5.363 0.007 . . . . . . . 21 ARG HA . 27467 1 191 . 1 1 21 21 ARG HB2 H 1 1.635 0.021 . . . . . . . 21 ARG HB2 . 27467 1 192 . 1 1 21 21 ARG HG2 H 1 1.506 0.017 . . . . . . . 21 ARG HG2 . 27467 1 193 . 1 1 21 21 ARG HD2 H 1 2.882 0.000 . . . . . . . 21 ARG HD2 . 27467 1 194 . 1 1 21 21 ARG HD3 H 1 2.765 0.000 . . . . . . . 21 ARG HD3 . 27467 1 195 . 1 1 21 21 ARG CA C 13 54.227 0.000 . . . . . . . 21 ARG CA . 27467 1 196 . 1 1 21 21 ARG CB C 13 33.518 0.000 . . . . . . . 21 ARG CB . 27467 1 197 . 1 1 21 21 ARG CG C 13 27.401 0.000 . . . . . . . 21 ARG CG . 27467 1 198 . 1 1 21 21 ARG CD C 13 43.636 0.000 . . . . . . . 21 ARG CD . 27467 1 199 . 1 1 21 21 ARG N N 15 120.939 0.000 . . . . . . . 21 ARG N . 27467 1 200 . 1 1 22 22 HIS H H 1 9.189 0.009 . . . . . . . 22 HIS HN . 27467 1 201 . 1 1 22 22 HIS HA H 1 4.857 0.021 . . . . . . . 22 HIS HA . 27467 1 202 . 1 1 22 22 HIS HB2 H 1 2.904 0.012 . . . . . . . 22 HIS HB2 . 27467 1 203 . 1 1 22 22 HIS HD2 H 1 6.704 0.000 . . . . . . . 22 HIS HD2 . 27467 1 204 . 1 1 22 22 HIS HE1 H 1 7.702 0.024 . . . . . . . 22 HIS HE1 . 27467 1 205 . 1 1 22 22 HIS CA C 13 54.570 0.000 . . . . . . . 22 HIS CA . 27467 1 206 . 1 1 22 22 HIS CB C 13 34.489 0.000 . . . . . . . 22 HIS CB . 27467 1 207 . 1 1 22 22 HIS N N 15 121.900 0.000 . . . . . . . 22 HIS N . 27467 1 208 . 1 1 23 23 LEU H H 1 8.896 0.005 . . . . . . . 23 LEU HN . 27467 1 209 . 1 1 23 23 LEU HA H 1 4.443 0.008 . . . . . . . 23 LEU HA . 27467 1 210 . 1 1 23 23 LEU HB2 H 1 1.728 0.001 . . . . . . . 23 LEU HB2 . 27467 1 211 . 1 1 23 23 LEU HB3 H 1 1.497 0.000 . . . . . . . 23 LEU HB3 . 27467 1 212 . 1 1 23 23 LEU HG H 1 1.223 0.010 . . . . . . . 23 LEU HG . 27467 1 213 . 1 1 23 23 LEU HD11 H 1 0.751 0.000 . . . . . . . 23 LEU QD1 . 27467 1 214 . 1 1 23 23 LEU HD12 H 1 0.751 0.000 . . . . . . . 23 LEU QD1 . 27467 1 215 . 1 1 23 23 LEU HD13 H 1 0.751 0.000 . . . . . . . 23 LEU QD1 . 27467 1 216 . 1 1 23 23 LEU HD21 H 1 0.552 0.008 . . . . . . . 23 LEU QD2 . 27467 1 217 . 1 1 23 23 LEU HD22 H 1 0.552 0.008 . . . . . . . 23 LEU QD2 . 27467 1 218 . 1 1 23 23 LEU HD23 H 1 0.552 0.008 . . . . . . . 23 LEU QD2 . 27467 1 219 . 1 1 23 23 LEU CA C 13 55.432 0.000 . . . . . . . 23 LEU CA . 27467 1 220 . 1 1 23 23 LEU CB C 13 42.523 0.000 . . . . . . . 23 LEU CB . 27467 1 221 . 1 1 23 23 LEU CG C 13 27.744 0.000 . . . . . . . 23 LEU CG . 27467 1 222 . 1 1 23 23 LEU CD1 C 13 25.571 0.000 . . . . . . . 23 LEU CD1 . 27467 1 223 . 1 1 23 23 LEU CD2 C 13 23.399 0.000 . . . . . . . 23 LEU CD2 . 27467 1 224 . 1 1 23 23 LEU N N 15 126.775 0.000 . . . . . . . 23 LEU N . 27467 1 225 . 1 1 24 24 LEU H H 1 9.084 0.003 . . . . . . . 24 LEU HN . 27467 1 226 . 1 1 24 24 LEU HA H 1 4.618 0.012 . . . . . . . 24 LEU HA . 27467 1 227 . 1 1 24 24 LEU HB2 H 1 1.475 0.000 . . . . . . . 24 LEU HB2 . 27467 1 228 . 1 1 24 24 LEU HB3 H 1 1.339 0.000 . . . . . . . 24 LEU HB3 . 27467 1 229 . 1 1 24 24 LEU HG H 1 1.619 0.000 . . . . . . . 24 LEU HG . 27467 1 230 . 1 1 24 24 LEU HD11 H 1 0.730 0.005 . . . . . . . 24 LEU QD1 . 27467 1 231 . 1 1 24 24 LEU HD12 H 1 0.730 0.005 . . . . . . . 24 LEU QD1 . 27467 1 232 . 1 1 24 24 LEU HD13 H 1 0.730 0.005 . . . . . . . 24 LEU QD1 . 27467 1 233 . 1 1 24 24 LEU HD21 H 1 0.771 0.000 . . . . . . . 24 LEU QD2 . 27467 1 234 . 1 1 24 24 LEU HD22 H 1 0.771 0.000 . . . . . . . 24 LEU QD2 . 27467 1 235 . 1 1 24 24 LEU HD23 H 1 0.771 0.000 . . . . . . . 24 LEU QD2 . 27467 1 236 . 1 1 24 24 LEU CA C 13 53.427 0.000 . . . . . . . 24 LEU CA . 27467 1 237 . 1 1 24 24 LEU CB C 13 45.098 0.000 . . . . . . . 24 LEU CB . 27467 1 238 . 1 1 24 24 LEU CG C 13 27.686 0.000 . . . . . . . 24 LEU CG . 27467 1 239 . 1 1 24 24 LEU CD1 C 13 26.486 0.000 . . . . . . . 24 LEU CD1 . 27467 1 240 . 1 1 24 24 LEU N N 15 127.994 0.000 . . . . . . . 24 LEU N . 27467 1 241 . 1 1 25 25 GLN H H 1 8.210 0.000 . . . . . . . 25 GLN HN . 27467 1 242 . 1 1 25 25 GLN HA H 1 4.770 0.020 . . . . . . . 25 GLN HA . 27467 1 243 . 1 1 25 25 GLN HB2 H 1 1.843 0.000 . . . . . . . 25 GLN HB2 . 27467 1 244 . 1 1 25 25 GLN HB3 H 1 1.714 0.015 . . . . . . . 25 GLN HB3 . 27467 1 245 . 1 1 25 25 GLN HG2 H 1 2.163 0.047 . . . . . . . 25 GLN HG2 . 27467 1 246 . 1 1 25 25 GLN HG3 H 1 2.148 0.013 . . . . . . . 25 GLN HG3 . 27467 1 247 . 1 1 25 25 GLN HE21 H 1 7.237 0.007 . . . . . . . 25 GLN HE21 . 27467 1 248 . 1 1 25 25 GLN HE22 H 1 6.508 0.002 . . . . . . . 25 GLN HE22 . 27467 1 249 . 1 1 25 25 GLN CA C 13 54.570 0.000 . . . . . . . 25 GLN CA . 27467 1 250 . 1 1 25 25 GLN CB C 13 28.773 0.000 . . . . . . . 25 GLN CB . 27467 1 251 . 1 1 25 25 GLN CG C 13 33.175 0.000 . . . . . . . 25 GLN CG . 27467 1 252 . 1 1 25 25 GLN N N 15 121.494 0.000 . . . . . . . 25 GLN N . 27467 1 253 . 1 1 25 25 GLN NE2 N 15 109.306 0.000 . . . . . . . 25 GLN NE2 . 27467 1 254 . 1 1 26 26 VAL H H 1 8.603 0.005 . . . . . . . 26 VAL HN . 27467 1 255 . 1 1 26 26 VAL HA H 1 4.337 0.011 . . . . . . . 26 VAL HA . 27467 1 256 . 1 1 26 26 VAL HB H 1 1.940 0.008 . . . . . . . 26 VAL HB . 27467 1 257 . 1 1 26 26 VAL HG11 H 1 0.870 0.017 . . . . . . . 26 VAL QG1 . 27467 1 258 . 1 1 26 26 VAL HG12 H 1 0.870 0.017 . . . . . . . 26 VAL QG1 . 27467 1 259 . 1 1 26 26 VAL HG13 H 1 0.870 0.017 . . . . . . . 26 VAL QG1 . 27467 1 260 . 1 1 26 26 VAL HG21 H 1 0.761 0.017 . . . . . . . 26 VAL QG2 . 27467 1 261 . 1 1 26 26 VAL HG22 H 1 0.761 0.017 . . . . . . . 26 VAL QG2 . 27467 1 262 . 1 1 26 26 VAL HG23 H 1 0.761 0.017 . . . . . . . 26 VAL QG2 . 27467 1 263 . 1 1 26 26 VAL CA C 13 60.349 0.000 . . . . . . . 26 VAL CA . 27467 1 264 . 1 1 26 26 VAL CB C 13 35.290 0.000 . . . . . . . 26 VAL CB . 27467 1 265 . 1 1 26 26 VAL CG1 C 13 22.551 0.000 . . . . . . . 26 VAL CG1 . 27467 1 266 . 1 1 26 26 VAL CG2 C 13 21.567 0.000 . . . . . . . 26 VAL CG2 . 27467 1 267 . 1 1 26 26 VAL N N 15 122.713 0.000 . . . . . . . 26 VAL N . 27467 1 268 . 1 1 27 27 ARG H H 1 8.542 0.002 . . . . . . . 27 ARG HN . 27467 1 269 . 1 1 27 27 ARG HA H 1 4.916 0.014 . . . . . . . 27 ARG HA . 27467 1 270 . 1 1 27 27 ARG HB2 H 1 1.989 0.006 . . . . . . . 27 ARG HB2 . 27467 1 271 . 1 1 27 27 ARG HB3 H 1 1.677 0.001 . . . . . . . 27 ARG HB3 . 27467 1 272 . 1 1 27 27 ARG HG2 H 1 1.455 0.005 . . . . . . . 27 ARG HG2 . 27467 1 273 . 1 1 27 27 ARG HD2 H 1 3.240 0.000 . . . . . . . 27 ARG HD2 . 27467 1 274 . 1 1 27 27 ARG HD3 H 1 3.108 0.000 . . . . . . . 27 ARG HD3 . 27467 1 275 . 1 1 27 27 ARG CA C 13 54.970 0.000 . . . . . . . 27 ARG CA . 27467 1 276 . 1 1 27 27 ARG CB C 13 31.917 0.000 . . . . . . . 27 ARG CB . 27467 1 277 . 1 1 27 27 ARG CG C 13 28.544 0.000 . . . . . . . 27 ARG CG . 27467 1 278 . 1 1 27 27 ARG CD C 13 43.392 0.000 . . . . . . . 27 ARG CD . 27467 1 279 . 1 1 27 27 ARG N N 15 123.119 0.000 . . . . . . . 27 ARG N . 27467 1 280 . 1 1 28 28 ARG H H 1 9.261 0.002 . . . . . . . 28 ARG HN . 27467 1 281 . 1 1 28 28 ARG HA H 1 3.805 0.029 . . . . . . . 28 ARG HA . 27467 1 282 . 1 1 28 28 ARG HB2 H 1 1.959 0.011 . . . . . . . 28 ARG HB2 . 27467 1 283 . 1 1 28 28 ARG HB3 H 1 1.665 0.000 . . . . . . . 28 ARG HB3 . 27467 1 284 . 1 1 28 28 ARG HG2 H 1 1.834 0.009 . . . . . . . 28 ARG HG2 . 27467 1 285 . 1 1 28 28 ARG HG3 H 1 1.633 0.000 . . . . . . . 28 ARG HG3 . 27467 1 286 . 1 1 28 28 ARG HD2 H 1 3.300 0.000 . . . . . . . 28 ARG HD2 . 27467 1 287 . 1 1 28 28 ARG CA C 13 60.272 0.000 . . . . . . . 28 ARG CA . 27467 1 288 . 1 1 28 28 ARG CB C 13 29.496 0.000 . . . . . . . 28 ARG CB . 27467 1 289 . 1 1 28 28 ARG CG C 13 29.052 0.000 . . . . . . . 28 ARG CG . 27467 1 290 . 1 1 28 28 ARG CD C 13 43.211 0.000 . . . . . . . 28 ARG CD . 27467 1 291 . 1 1 28 28 ARG N N 15 123.525 0.000 . . . . . . . 28 ARG N . 27467 1 292 . 1 1 29 29 SER H H 1 7.859 0.002 . . . . . . . 29 SER HN . 27467 1 293 . 1 1 29 29 SER HA H 1 4.411 0.011 . . . . . . . 29 SER HA . 27467 1 294 . 1 1 29 29 SER HB2 H 1 4.173 0.004 . . . . . . . 29 SER HB2 . 27467 1 295 . 1 1 29 29 SER HB3 H 1 3.798 0.001 . . . . . . . 29 SER HB3 . 27467 1 296 . 1 1 29 29 SER CA C 13 57.891 0.000 . . . . . . . 29 SER CA . 27467 1 297 . 1 1 29 29 SER CB C 13 62.893 0.000 . . . . . . . 29 SER CB . 27467 1 298 . 1 1 29 29 SER N N 15 108.900 0.000 . . . . . . . 29 SER N . 27467 1 299 . 1 1 30 30 SER H H 1 7.764 0.005 . . . . . . . 30 SER HN . 27467 1 300 . 1 1 30 30 SER HA H 1 4.629 0.000 . . . . . . . 30 SER HA . 27467 1 301 . 1 1 30 30 SER HB2 H 1 4.005 0.000 . . . . . . . 30 SER HB2 . 27467 1 302 . 1 1 30 30 SER HB3 H 1 3.893 0.013 . . . . . . . 30 SER HB3 . 27467 1 303 . 1 1 30 30 SER CA C 13 60.387 0.000 . . . . . . . 30 SER CA . 27467 1 304 . 1 1 30 30 SER CB C 13 63.898 0.000 . . . . . . . 30 SER CB . 27467 1 305 . 1 1 30 30 SER N N 15 118.458 0.000 . . . . . . . 30 SER N . 27467 1 306 . 1 1 31 31 SER H H 1 9.261 0.001 . . . . . . . 31 SER HN . 27467 1 307 . 1 1 31 31 SER HA H 1 5.130 0.022 . . . . . . . 31 SER HA . 27467 1 308 . 1 1 31 31 SER HB2 H 1 4.598 0.010 . . . . . . . 31 SER HB2 . 27467 1 309 . 1 1 31 31 SER HB3 H 1 4.083 0.011 . . . . . . . 31 SER HB3 . 27467 1 310 . 1 1 31 31 SER CA C 13 56.851 0.000 . . . . . . . 31 SER CA . 27467 1 311 . 1 1 31 31 SER CB C 13 65.886 0.000 . . . . . . . 31 SER CB . 27467 1 312 . 1 1 31 31 SER N N 15 121.791 0.000 . . . . . . . 31 SER N . 27467 1 313 . 1 1 32 32 VAL H H 1 8.597 0.002 . . . . . . . 32 VAL HN . 27467 1 314 . 1 1 32 32 VAL HA H 1 3.551 0.011 . . . . . . . 32 VAL HA . 27467 1 315 . 1 1 32 32 VAL HB H 1 2.149 0.000 . . . . . . . 32 VAL HB . 27467 1 316 . 1 1 32 32 VAL HG11 H 1 1.052 0.009 . . . . . . . 32 VAL QG1 . 27467 1 317 . 1 1 32 32 VAL HG12 H 1 1.052 0.009 . . . . . . . 32 VAL QG1 . 27467 1 318 . 1 1 32 32 VAL HG13 H 1 1.052 0.009 . . . . . . . 32 VAL QG1 . 27467 1 319 . 1 1 32 32 VAL HG21 H 1 0.732 0.014 . . . . . . . 32 VAL QG2 . 27467 1 320 . 1 1 32 32 VAL HG22 H 1 0.732 0.014 . . . . . . . 32 VAL QG2 . 27467 1 321 . 1 1 32 32 VAL HG23 H 1 0.732 0.014 . . . . . . . 32 VAL QG2 . 27467 1 322 . 1 1 32 32 VAL CA C 13 67.598 0.000 . . . . . . . 32 VAL CA . 27467 1 323 . 1 1 32 32 VAL CB C 13 32.171 0.000 . . . . . . . 32 VAL CB . 27467 1 324 . 1 1 32 32 VAL CG1 C 13 24.771 0.000 . . . . . . . 32 VAL CG1 . 27467 1 325 . 1 1 32 32 VAL CG2 C 13 21.627 0.000 . . . . . . . 32 VAL CG2 . 27467 1 326 . 1 1 32 32 VAL N N 15 121.900 0.000 . . . . . . . 32 VAL N . 27467 1 327 . 1 1 33 33 ALA H H 1 8.535 0.015 . . . . . . . 33 ALA HN . 27467 1 328 . 1 1 33 33 ALA HA H 1 4.071 0.021 . . . . . . . 33 ALA HA . 27467 1 329 . 1 1 33 33 ALA HB1 H 1 1.499 0.010 . . . . . . . 33 ALA QB . 27467 1 330 . 1 1 33 33 ALA HB2 H 1 1.499 0.010 . . . . . . . 33 ALA QB . 27467 1 331 . 1 1 33 33 ALA HB3 H 1 1.499 0.010 . . . . . . . 33 ALA QB . 27467 1 332 . 1 1 33 33 ALA CA C 13 55.713 0.000 . . . . . . . 33 ALA CA . 27467 1 333 . 1 1 33 33 ALA CB C 13 18.000 0.000 . . . . . . . 33 ALA CB . 27467 1 334 . 1 1 33 33 ALA N N 15 121.384 0.000 . . . . . . . 33 ALA N . 27467 1 335 . 1 1 34 34 GLN H H 1 8.180 0.005 . . . . . . . 34 GLN HN . 27467 1 336 . 1 1 34 34 GLN HA H 1 4.071 0.008 . . . . . . . 34 GLN HA . 27467 1 337 . 1 1 34 34 GLN HB2 H 1 2.589 0.000 . . . . . . . 34 GLN HB2 . 27467 1 338 . 1 1 34 34 GLN HB3 H 1 2.062 0.009 . . . . . . . 34 GLN HB3 . 27467 1 339 . 1 1 34 34 GLN HG2 H 1 2.523 0.005 . . . . . . . 34 GLN HG2 . 27467 1 340 . 1 1 34 34 GLN HE21 H 1 7.400 0.296 . . . . . . . 34 GLN HE21 . 27467 1 341 . 1 1 34 34 GLN HE22 H 1 6.942 0.000 . . . . . . . 34 GLN HE22 . 27467 1 342 . 1 1 34 34 GLN CA C 13 58.874 0.000 . . . . . . . 34 GLN CA . 27467 1 343 . 1 1 34 34 GLN CB C 13 28.329 0.000 . . . . . . . 34 GLN CB . 27467 1 344 . 1 1 34 34 GLN CG C 13 34.890 0.000 . . . . . . . 34 GLN CG . 27467 1 345 . 1 1 34 34 GLN N N 15 118.656 0.000 . . . . . . . 34 GLN N . 27467 1 346 . 1 1 34 34 GLN NE2 N 15 112.150 0.000 . . . . . . . 34 GLN NE2 . 27467 1 347 . 1 1 35 35 VAL H H 1 7.966 0.002 . . . . . . . 35 VAL HN . 27467 1 348 . 1 1 35 35 VAL HA H 1 3.861 0.009 . . . . . . . 35 VAL HA . 27467 1 349 . 1 1 35 35 VAL HB H 1 2.214 0.025 . . . . . . . 35 VAL HB . 27467 1 350 . 1 1 35 35 VAL HG11 H 1 1.115 0.016 . . . . . . . 35 VAL QG1 . 27467 1 351 . 1 1 35 35 VAL HG12 H 1 1.115 0.016 . . . . . . . 35 VAL QG1 . 27467 1 352 . 1 1 35 35 VAL HG13 H 1 1.115 0.016 . . . . . . . 35 VAL QG1 . 27467 1 353 . 1 1 35 35 VAL HG21 H 1 0.749 0.018 . . . . . . . 35 VAL QG2 . 27467 1 354 . 1 1 35 35 VAL HG22 H 1 0.749 0.018 . . . . . . . 35 VAL QG2 . 27467 1 355 . 1 1 35 35 VAL HG23 H 1 0.749 0.018 . . . . . . . 35 VAL QG2 . 27467 1 356 . 1 1 35 35 VAL CA C 13 66.913 0.000 . . . . . . . 35 VAL CA . 27467 1 357 . 1 1 35 35 VAL CB C 13 31.657 0.000 . . . . . . . 35 VAL CB . 27467 1 358 . 1 1 35 35 VAL CG1 C 13 24.428 0.000 . . . . . . . 35 VAL CG1 . 27467 1 359 . 1 1 35 35 VAL CG2 C 13 20.769 0.000 . . . . . . . 35 VAL CG2 . 27467 1 360 . 1 1 35 35 VAL N N 15 123.119 0.000 . . . . . . . 35 VAL N . 27467 1 361 . 1 1 36 36 LYS H H 1 9.022 0.001 . . . . . . . 36 LYS HN . 27467 1 362 . 1 1 36 36 LYS HA H 1 4.384 0.010 . . . . . . . 36 LYS HA . 27467 1 363 . 1 1 36 36 LYS HB2 H 1 1.880 0.008 . . . . . . . 36 LYS HB2 . 27467 1 364 . 1 1 36 36 LYS HB3 H 1 1.593 0.000 . . . . . . . 36 LYS HB3 . 27467 1 365 . 1 1 36 36 LYS HG2 H 1 1.704 0.000 . . . . . . . 36 LYS HG2 . 27467 1 366 . 1 1 36 36 LYS HG3 H 1 1.573 0.000 . . . . . . . 36 LYS HG3 . 27467 1 367 . 1 1 36 36 LYS HD2 H 1 1.666 0.000 . . . . . . . 36 LYS HD2 . 27467 1 368 . 1 1 36 36 LYS HD3 H 1 1.436 0.010 . . . . . . . 36 LYS HD3 . 27467 1 369 . 1 1 36 36 LYS HE2 H 1 2.832 0.000 . . . . . . . 36 LYS HE2 . 27467 1 370 . 1 1 36 36 LYS HE3 H 1 2.573 0.000 . . . . . . . 36 LYS HE3 . 27467 1 371 . 1 1 36 36 LYS CA C 13 60.435 0.000 . . . . . . . 36 LYS CA . 27467 1 372 . 1 1 36 36 LYS CB C 13 32.900 0.000 . . . . . . . 36 LYS CB . 27467 1 373 . 1 1 36 36 LYS CG C 13 30.203 0.000 . . . . . . . 36 LYS CG . 27467 1 374 . 1 1 36 36 LYS CD C 13 26.314 0.000 . . . . . . . 36 LYS CD . 27467 1 375 . 1 1 36 36 LYS CE C 13 42.550 0.000 . . . . . . . 36 LYS CE . 27467 1 376 . 1 1 36 36 LYS N N 15 120.152 0.000 . . . . . . . 36 LYS N . 27467 1 377 . 1 1 37 37 ALA H H 1 8.005 0.002 . . . . . . . 37 ALA HN . 27467 1 378 . 1 1 37 37 ALA HA H 1 4.299 0.002 . . . . . . . 37 ALA HA . 27467 1 379 . 1 1 37 37 ALA HB1 H 1 1.565 0.009 . . . . . . . 37 ALA QB . 27467 1 380 . 1 1 37 37 ALA HB2 H 1 1.565 0.009 . . . . . . . 37 ALA QB . 27467 1 381 . 1 1 37 37 ALA HB3 H 1 1.565 0.009 . . . . . . . 37 ALA QB . 27467 1 382 . 1 1 37 37 ALA CA C 13 55.368 0.000 . . . . . . . 37 ALA CA . 27467 1 383 . 1 1 37 37 ALA CB C 13 17.682 0.000 . . . . . . . 37 ALA CB . 27467 1 384 . 1 1 37 37 ALA N N 15 123.512 0.000 . . . . . . . 37 ALA N . 27467 1 385 . 1 1 38 38 MET H H 1 7.761 0.004 . . . . . . . 38 MET HN . 27467 1 386 . 1 1 38 38 MET HA H 1 4.223 0.015 . . . . . . . 38 MET HA . 27467 1 387 . 1 1 38 38 MET HB2 H 1 2.500 0.019 . . . . . . . 38 MET HB2 . 27467 1 388 . 1 1 38 38 MET HB3 H 1 2.099 0.000 . . . . . . . 38 MET HB3 . 27467 1 389 . 1 1 38 38 MET HG2 H 1 2.939 0.014 . . . . . . . 38 MET HG2 . 27467 1 390 . 1 1 38 38 MET HG3 H 1 2.655 0.013 . . . . . . . 38 MET HG3 . 27467 1 391 . 1 1 38 38 MET HE1 H 1 2.241 0.000 . . . . . . . 38 MET QE . 27467 1 392 . 1 1 38 38 MET HE2 H 1 2.241 0.000 . . . . . . . 38 MET QE . 27467 1 393 . 1 1 38 38 MET HE3 H 1 2.241 0.000 . . . . . . . 38 MET QE . 27467 1 394 . 1 1 38 38 MET CA C 13 59.313 0.000 . . . . . . . 38 MET CA . 27467 1 395 . 1 1 38 38 MET CB C 13 33.371 0.000 . . . . . . . 38 MET CB . 27467 1 396 . 1 1 38 38 MET CG C 13 31.900 0.000 . . . . . . . 38 MET CG . 27467 1 397 . 1 1 38 38 MET CE C 13 9.752 0.000 . . . . . . . 38 MET CE . 27467 1 398 . 1 1 38 38 MET N N 15 119.869 0.000 . . . . . . . 38 MET N . 27467 1 399 . 1 1 39 39 ILE H H 1 8.643 0.004 . . . . . . . 39 ILE HN . 27467 1 400 . 1 1 39 39 ILE HA H 1 3.293 0.013 . . . . . . . 39 ILE HA . 27467 1 401 . 1 1 39 39 ILE HB H 1 2.230 0.008 . . . . . . . 39 ILE HB . 27467 1 402 . 1 1 39 39 ILE HG12 H 1 1.965 0.022 . . . . . . . 39 ILE HG12 . 27467 1 403 . 1 1 39 39 ILE HG13 H 1 0.851 0.026 . . . . . . . 39 ILE HG13 . 27467 1 404 . 1 1 39 39 ILE HG21 H 1 0.723 0.015 . . . . . . . 39 ILE QG2 . 27467 1 405 . 1 1 39 39 ILE HG22 H 1 0.723 0.015 . . . . . . . 39 ILE QG2 . 27467 1 406 . 1 1 39 39 ILE HG23 H 1 0.723 0.015 . . . . . . . 39 ILE QG2 . 27467 1 407 . 1 1 39 39 ILE HD11 H 1 0.758 0.000 . . . . . . . 39 ILE QD1 . 27467 1 408 . 1 1 39 39 ILE HD12 H 1 0.758 0.000 . . . . . . . 39 ILE QD1 . 27467 1 409 . 1 1 39 39 ILE HD13 H 1 0.758 0.000 . . . . . . . 39 ILE QD1 . 27467 1 410 . 1 1 39 39 ILE CA C 13 66.284 0.000 . . . . . . . 39 ILE CA . 27467 1 411 . 1 1 39 39 ILE CB C 13 37.176 0.000 . . . . . . . 39 ILE CB . 27467 1 412 . 1 1 39 39 ILE CG1 C 13 29.486 0.000 . . . . . . . 39 ILE CG1 . 27467 1 413 . 1 1 39 39 ILE CG2 C 13 17.886 0.000 . . . . . . . 39 ILE CG2 . 27467 1 414 . 1 1 39 39 ILE CD1 C 13 14.480 0.000 . . . . . . . 39 ILE CD1 . 27467 1 415 . 1 1 39 39 ILE N N 15 121.494 0.000 . . . . . . . 39 ILE N . 27467 1 416 . 1 1 40 40 GLU H H 1 8.471 0.005 . . . . . . . 40 GLU HN . 27467 1 417 . 1 1 40 40 GLU HA H 1 3.941 0.036 . . . . . . . 40 GLU HA . 27467 1 418 . 1 1 40 40 GLU HB2 H 1 2.350 0.017 . . . . . . . 40 GLU HB2 . 27467 1 419 . 1 1 40 40 GLU HB3 H 1 1.832 0.002 . . . . . . . 40 GLU HB3 . 27467 1 420 . 1 1 40 40 GLU HG2 H 1 2.023 0.000 . . . . . . . 40 GLU HG2 . 27467 1 421 . 1 1 40 40 GLU HG3 H 1 1.938 0.014 . . . . . . . 40 GLU HG3 . 27467 1 422 . 1 1 40 40 GLU CA C 13 59.827 0.000 . . . . . . . 40 GLU CA . 27467 1 423 . 1 1 40 40 GLU CB C 13 28.945 0.000 . . . . . . . 40 GLU CB . 27467 1 424 . 1 1 40 40 GLU CG C 13 35.667 0.000 . . . . . . . 40 GLU CG . 27467 1 425 . 1 1 40 40 GLU N N 15 126.372 0.000 . . . . . . . 40 GLU N . 27467 1 426 . 1 1 41 41 THR H H 1 7.912 0.004 . . . . . . . 41 THR HN . 27467 1 427 . 1 1 41 41 THR HA H 1 3.968 0.017 . . . . . . . 41 THR HA . 27467 1 428 . 1 1 41 41 THR HB H 1 4.284 0.000 . . . . . . . 41 THR HB . 27467 1 429 . 1 1 41 41 THR HG21 H 1 1.328 0.024 . . . . . . . 41 THR QG2 . 27467 1 430 . 1 1 41 41 THR HG22 H 1 1.328 0.024 . . . . . . . 41 THR QG2 . 27467 1 431 . 1 1 41 41 THR HG23 H 1 1.328 0.024 . . . . . . . 41 THR QG2 . 27467 1 432 . 1 1 41 41 THR CA C 13 66.341 0.000 . . . . . . . 41 THR CA . 27467 1 433 . 1 1 41 41 THR CB C 13 68.646 0.000 . . . . . . . 41 THR CB . 27467 1 434 . 1 1 41 41 THR CG2 C 13 22.115 0.000 . . . . . . . 41 THR CG2 . 27467 1 435 . 1 1 41 41 THR N N 15 116.218 0.000 . . . . . . . 41 THR N . 27467 1 436 . 1 1 42 42 LYS H H 1 7.222 0.003 . . . . . . . 42 LYS HN . 27467 1 437 . 1 1 42 42 LYS HA H 1 4.275 0.004 . . . . . . . 42 LYS HA . 27467 1 438 . 1 1 42 42 LYS HB2 H 1 1.544 0.037 . . . . . . . 42 LYS HB2 . 27467 1 439 . 1 1 42 42 LYS HB3 H 1 1.292 0.000 . . . . . . . 42 LYS HB3 . 27467 1 440 . 1 1 42 42 LYS HG2 H 1 1.605 0.000 . . . . . . . 42 LYS HG2 . 27467 1 441 . 1 1 42 42 LYS HD2 H 1 1.525 0.033 . . . . . . . 42 LYS HD2 . 27467 1 442 . 1 1 42 42 LYS HD3 H 1 1.096 0.015 . . . . . . . 42 LYS HD3 . 27467 1 443 . 1 1 42 42 LYS HE2 H 1 3.041 0.000 . . . . . . . 42 LYS HE2 . 27467 1 444 . 1 1 42 42 LYS HE3 H 1 2.946 0.000 . . . . . . . 42 LYS HE3 . 27467 1 445 . 1 1 42 42 LYS CA C 13 56.512 0.000 . . . . . . . 42 LYS CA . 27467 1 446 . 1 1 42 42 LYS CB C 13 33.042 0.000 . . . . . . . 42 LYS CB . 27467 1 447 . 1 1 42 42 LYS CG C 13 27.858 0.000 . . . . . . . 42 LYS CG . 27467 1 448 . 1 1 42 42 LYS CD C 13 24.599 0.000 . . . . . . . 42 LYS CD . 27467 1 449 . 1 1 42 42 LYS CE C 13 42.233 0.000 . . . . . . . 42 LYS CE . 27467 1 450 . 1 1 42 42 LYS N N 15 116.102 0.000 . . . . . . . 42 LYS N . 27467 1 451 . 1 1 43 43 THR H H 1 7.798 0.012 . . . . . . . 43 THR HN . 27467 1 452 . 1 1 43 43 THR HA H 1 4.534 0.012 . . . . . . . 43 THR HA . 27467 1 453 . 1 1 43 43 THR HB H 1 4.176 0.004 . . . . . . . 43 THR HB . 27467 1 454 . 1 1 43 43 THR HG21 H 1 0.856 0.002 . . . . . . . 43 THR QG2 . 27467 1 455 . 1 1 43 43 THR HG22 H 1 0.856 0.002 . . . . . . . 43 THR QG2 . 27467 1 456 . 1 1 43 43 THR HG23 H 1 0.856 0.002 . . . . . . . 43 THR QG2 . 27467 1 457 . 1 1 43 43 THR CA C 13 62.378 0.000 . . . . . . . 43 THR CA . 27467 1 458 . 1 1 43 43 THR CB C 13 73.193 0.000 . . . . . . . 43 THR CB . 27467 1 459 . 1 1 43 43 THR CG2 C 13 20.998 0.000 . . . . . . . 43 THR CG2 . 27467 1 460 . 1 1 43 43 THR N N 15 130.838 0.000 . . . . . . . 43 THR N . 27467 1 461 . 1 1 44 44 GLY H H 1 8.926 0.000 . . . . . . . 44 GLY HN . 27467 1 462 . 1 1 44 44 GLY HA2 H 1 4.238 0.006 . . . . . . . 44 GLY HA1 . 27467 1 463 . 1 1 44 44 GLY HA3 H 1 3.804 0.005 . . . . . . . 44 GLY HA2 . 27467 1 464 . 1 1 44 44 GLY CA C 13 45.364 0.000 . . . . . . . 44 GLY CA . 27467 1 465 . 1 1 44 44 GLY N N 15 113.369 0.000 . . . . . . . 44 GLY N . 27467 1 466 . 1 1 45 45 ILE H H 1 7.687 0.005 . . . . . . . 45 ILE HN . 27467 1 467 . 1 1 45 45 ILE HA H 1 4.045 0.006 . . . . . . . 45 ILE HA . 27467 1 468 . 1 1 45 45 ILE HB H 1 1.559 0.010 . . . . . . . 45 ILE HB . 27467 1 469 . 1 1 45 45 ILE HG12 H 1 1.345 0.014 . . . . . . . 45 ILE HG12 . 27467 1 470 . 1 1 45 45 ILE HG13 H 1 0.976 0.000 . . . . . . . 45 ILE HG13 . 27467 1 471 . 1 1 45 45 ILE HG21 H 1 0.861 0.016 . . . . . . . 45 ILE QG2 . 27467 1 472 . 1 1 45 45 ILE HG22 H 1 0.861 0.016 . . . . . . . 45 ILE QG2 . 27467 1 473 . 1 1 45 45 ILE HG23 H 1 0.861 0.016 . . . . . . . 45 ILE QG2 . 27467 1 474 . 1 1 45 45 ILE HD11 H 1 0.783 0.000 . . . . . . . 45 ILE QD1 . 27467 1 475 . 1 1 45 45 ILE HD12 H 1 0.783 0.000 . . . . . . . 45 ILE QD1 . 27467 1 476 . 1 1 45 45 ILE HD13 H 1 0.783 0.000 . . . . . . . 45 ILE QD1 . 27467 1 477 . 1 1 45 45 ILE CA C 13 60.913 0.000 . . . . . . . 45 ILE CA . 27467 1 478 . 1 1 45 45 ILE CB C 13 37.470 0.000 . . . . . . . 45 ILE CB . 27467 1 479 . 1 1 45 45 ILE CG1 C 13 27.320 0.000 . . . . . . . 45 ILE CG1 . 27467 1 480 . 1 1 45 45 ILE CG2 C 13 18.020 0.000 . . . . . . . 45 ILE CG2 . 27467 1 481 . 1 1 45 45 ILE CD1 C 13 12.382 0.000 . . . . . . . 45 ILE CD1 . 27467 1 482 . 1 1 45 45 ILE N N 15 123.119 0.000 . . . . . . . 45 ILE N . 27467 1 483 . 1 1 46 46 ILE H H 1 8.163 0.001 . . . . . . . 46 ILE HN . 27467 1 484 . 1 1 46 46 ILE HA H 1 4.340 0.020 . . . . . . . 46 ILE HA . 27467 1 485 . 1 1 46 46 ILE HB H 1 2.113 0.002 . . . . . . . 46 ILE HB . 27467 1 486 . 1 1 46 46 ILE HG12 H 1 1.518 0.000 . . . . . . . 46 ILE HG12 . 27467 1 487 . 1 1 46 46 ILE HG21 H 1 1.105 0.000 . . . . . . . 46 ILE QG2 . 27467 1 488 . 1 1 46 46 ILE HG22 H 1 1.105 0.000 . . . . . . . 46 ILE QG2 . 27467 1 489 . 1 1 46 46 ILE HG23 H 1 1.105 0.000 . . . . . . . 46 ILE QG2 . 27467 1 490 . 1 1 46 46 ILE HD11 H 1 0.929 0.000 . . . . . . . 46 ILE QD1 . 27467 1 491 . 1 1 46 46 ILE HD12 H 1 0.929 0.000 . . . . . . . 46 ILE QD1 . 27467 1 492 . 1 1 46 46 ILE HD13 H 1 0.929 0.000 . . . . . . . 46 ILE QD1 . 27467 1 493 . 1 1 46 46 ILE CA C 13 60.966 0.000 . . . . . . . 46 ILE CA . 27467 1 494 . 1 1 46 46 ILE CB C 13 36.551 0.000 . . . . . . . 46 ILE CB . 27467 1 495 . 1 1 46 46 ILE CG1 C 13 26.980 0.000 . . . . . . . 46 ILE CG1 . 27467 1 496 . 1 1 46 46 ILE CG2 C 13 17.547 0.000 . . . . . . . 46 ILE CG2 . 27467 1 497 . 1 1 46 46 ILE CD1 C 13 13.754 0.000 . . . . . . . 46 ILE CD1 . 27467 1 498 . 1 1 46 46 ILE N N 15 125.198 0.000 . . . . . . . 46 ILE N . 27467 1 499 . 1 1 47 47 PRO HA H 1 4.062 0.005 . . . . . . . 47 PRO HA . 27467 1 500 . 1 1 47 47 PRO HB2 H 1 2.309 0.000 . . . . . . . 47 PRO HB2 . 27467 1 501 . 1 1 47 47 PRO HB3 H 1 1.998 0.000 . . . . . . . 47 PRO HB3 . 27467 1 502 . 1 1 47 47 PRO HG2 H 1 2.243 0.000 . . . . . . . 47 PRO HG2 . 27467 1 503 . 1 1 47 47 PRO HG3 H 1 1.610 0.000 . . . . . . . 47 PRO HG3 . 27467 1 504 . 1 1 47 47 PRO HD2 H 1 3.961 0.000 . . . . . . . 47 PRO HD2 . 27467 1 505 . 1 1 47 47 PRO HD3 H 1 3.688 0.016 . . . . . . . 47 PRO HD3 . 27467 1 506 . 1 1 47 47 PRO CA C 13 66.913 0.000 . . . . . . . 47 PRO CA . 27467 1 507 . 1 1 47 47 PRO CB C 13 32.832 0.000 . . . . . . . 47 PRO CB . 27467 1 508 . 1 1 47 47 PRO CG C 13 27.744 0.000 . . . . . . . 47 PRO CG . 27467 1 509 . 1 1 47 47 PRO CD C 13 50.977 0.000 . . . . . . . 47 PRO CD . 27467 1 510 . 1 1 48 48 GLU H H 1 9.173 0.002 . . . . . . . 48 GLU HN . 27467 1 511 . 1 1 48 48 GLU HA H 1 4.177 0.006 . . . . . . . 48 GLU HA . 27467 1 512 . 1 1 48 48 GLU HB2 H 1 2.132 0.000 . . . . . . . 48 GLU HB2 . 27467 1 513 . 1 1 48 48 GLU HB3 H 1 2.052 0.007 . . . . . . . 48 GLU HB3 . 27467 1 514 . 1 1 48 48 GLU HG2 H 1 2.393 0.000 . . . . . . . 48 GLU HG2 . 27467 1 515 . 1 1 48 48 GLU HG3 H 1 2.290 0.002 . . . . . . . 48 GLU HG3 . 27467 1 516 . 1 1 48 48 GLU CA C 13 59.529 0.000 . . . . . . . 48 GLU CA . 27467 1 517 . 1 1 48 48 GLU CB C 13 29.230 0.000 . . . . . . . 48 GLU CB . 27467 1 518 . 1 1 48 48 GLU CG C 13 37.005 0.000 . . . . . . . 48 GLU CG . 27467 1 519 . 1 1 48 48 GLU N N 15 115.400 0.000 . . . . . . . 48 GLU N . 27467 1 520 . 1 1 49 49 THR H H 1 7.902 0.001 . . . . . . . 49 THR HN . 27467 1 521 . 1 1 49 49 THR HA H 1 4.401 0.009 . . . . . . . 49 THR HA . 27467 1 522 . 1 1 49 49 THR HB H 1 4.239 0.014 . . . . . . . 49 THR HB . 27467 1 523 . 1 1 49 49 THR HG21 H 1 1.194 0.007 . . . . . . . 49 THR QG2 . 27467 1 524 . 1 1 49 49 THR HG22 H 1 1.194 0.007 . . . . . . . 49 THR QG2 . 27467 1 525 . 1 1 49 49 THR HG23 H 1 1.194 0.007 . . . . . . . 49 THR QG2 . 27467 1 526 . 1 1 49 49 THR CA C 13 61.484 0.000 . . . . . . . 49 THR CA . 27467 1 527 . 1 1 49 49 THR CB C 13 69.808 0.000 . . . . . . . 49 THR CB . 27467 1 528 . 1 1 49 49 THR CG2 C 13 22.713 0.000 . . . . . . . 49 THR CG2 . 27467 1 529 . 1 1 49 49 THR N N 15 111.744 0.000 . . . . . . . 49 THR N . 27467 1 530 . 1 1 50 50 GLN H H 1 7.283 0.005 . . . . . . . 50 GLN HN . 27467 1 531 . 1 1 50 50 GLN HA H 1 4.010 0.015 . . . . . . . 50 GLN HA . 27467 1 532 . 1 1 50 50 GLN HB2 H 1 1.951 0.000 . . . . . . . 50 GLN HB2 . 27467 1 533 . 1 1 50 50 GLN HB3 H 1 1.875 0.007 . . . . . . . 50 GLN HB3 . 27467 1 534 . 1 1 50 50 GLN HG2 H 1 2.530 0.009 . . . . . . . 50 GLN HG2 . 27467 1 535 . 1 1 50 50 GLN HG3 H 1 1.728 0.023 . . . . . . . 50 GLN HG3 . 27467 1 536 . 1 1 50 50 GLN HE21 H 1 6.938 0.003 . . . . . . . 50 GLN HE21 . 27467 1 537 . 1 1 50 50 GLN HE22 H 1 6.765 0.006 . . . . . . . 50 GLN HE22 . 27467 1 538 . 1 1 50 50 GLN CA C 13 56.653 0.000 . . . . . . . 50 GLN CA . 27467 1 539 . 1 1 50 50 GLN CB C 13 30.831 0.000 . . . . . . . 50 GLN CB . 27467 1 540 . 1 1 50 50 GLN CG C 13 33.575 0.000 . . . . . . . 50 GLN CG . 27467 1 541 . 1 1 50 50 GLN N N 15 121.494 0.000 . . . . . . . 50 GLN N . 27467 1 542 . 1 1 50 50 GLN NE2 N 15 129.213 0.000 . . . . . . . 50 GLN NE2 . 27467 1 543 . 1 1 51 51 ILE H H 1 8.635 0.000 . . . . . . . 51 ILE HN . 27467 1 544 . 1 1 51 51 ILE HA H 1 4.112 0.000 . . . . . . . 51 ILE HA . 27467 1 545 . 1 1 51 51 ILE HB H 1 1.750 0.002 . . . . . . . 51 ILE HB . 27467 1 546 . 1 1 51 51 ILE HG12 H 1 0.880 0.009 . . . . . . . 51 ILE HG12 . 27467 1 547 . 1 1 51 51 ILE HG21 H 1 0.784 0.000 . . . . . . . 51 ILE QG2 . 27467 1 548 . 1 1 51 51 ILE HG22 H 1 0.784 0.000 . . . . . . . 51 ILE QG2 . 27467 1 549 . 1 1 51 51 ILE HG23 H 1 0.784 0.000 . . . . . . . 51 ILE QG2 . 27467 1 550 . 1 1 51 51 ILE HD11 H 1 0.699 0.024 . . . . . . . 51 ILE QD1 . 27467 1 551 . 1 1 51 51 ILE HD12 H 1 0.699 0.024 . . . . . . . 51 ILE QD1 . 27467 1 552 . 1 1 51 51 ILE HD13 H 1 0.699 0.024 . . . . . . . 51 ILE QD1 . 27467 1 553 . 1 1 51 51 ILE CA C 13 61.484 0.000 . . . . . . . 51 ILE CA . 27467 1 554 . 1 1 51 51 ILE CB C 13 38.313 0.000 . . . . . . . 51 ILE CB . 27467 1 555 . 1 1 51 51 ILE CG1 C 13 27.000 0.000 . . . . . . . 51 ILE CG1 . 27467 1 556 . 1 1 51 51 ILE CG2 C 13 16.996 0.000 . . . . . . . 51 ILE CG2 . 27467 1 557 . 1 1 51 51 ILE CD1 C 13 13.158 0.000 . . . . . . . 51 ILE CD1 . 27467 1 558 . 1 1 51 51 ILE N N 15 125.001 0.000 . . . . . . . 51 ILE N . 27467 1 559 . 1 1 52 52 VAL H H 1 8.892 0.000 . . . . . . . 52 VAL HN . 27467 1 560 . 1 1 52 52 VAL HA H 1 5.285 0.005 . . . . . . . 52 VAL HA . 27467 1 561 . 1 1 52 52 VAL HB H 1 1.728 0.000 . . . . . . . 52 VAL HB . 27467 1 562 . 1 1 52 52 VAL HG11 H 1 0.944 0.000 . . . . . . . 52 VAL QG1 . 27467 1 563 . 1 1 52 52 VAL HG12 H 1 0.944 0.000 . . . . . . . 52 VAL QG1 . 27467 1 564 . 1 1 52 52 VAL HG13 H 1 0.944 0.000 . . . . . . . 52 VAL QG1 . 27467 1 565 . 1 1 52 52 VAL HG21 H 1 0.734 0.010 . . . . . . . 52 VAL QG2 . 27467 1 566 . 1 1 52 52 VAL HG22 H 1 0.734 0.010 . . . . . . . 52 VAL QG2 . 27467 1 567 . 1 1 52 52 VAL HG23 H 1 0.734 0.010 . . . . . . . 52 VAL QG2 . 27467 1 568 . 1 1 52 52 VAL CA C 13 59.904 0.000 . . . . . . . 52 VAL CA . 27467 1 569 . 1 1 52 52 VAL CB C 13 34.146 0.000 . . . . . . . 52 VAL CB . 27467 1 570 . 1 1 52 52 VAL CG1 C 13 22.410 0.000 . . . . . . . 52 VAL CG1 . 27467 1 571 . 1 1 52 52 VAL CG2 C 13 23.043 0.000 . . . . . . . 52 VAL CG2 . 27467 1 572 . 1 1 52 52 VAL N N 15 128.811 0.000 . . . . . . . 52 VAL N . 27467 1 573 . 1 1 53 53 THR H H 1 9.104 0.003 . . . . . . . 53 THR HN . 27467 1 574 . 1 1 53 53 THR HA H 1 5.142 0.009 . . . . . . . 53 THR HA . 27467 1 575 . 1 1 53 53 THR HB H 1 3.827 0.006 . . . . . . . 53 THR HB . 27467 1 576 . 1 1 53 53 THR HG21 H 1 0.955 0.017 . . . . . . . 53 THR QG2 . 27467 1 577 . 1 1 53 53 THR HG22 H 1 0.955 0.017 . . . . . . . 53 THR QG2 . 27467 1 578 . 1 1 53 53 THR HG23 H 1 0.955 0.017 . . . . . . . 53 THR QG2 . 27467 1 579 . 1 1 53 53 THR CA C 13 60.155 0.000 . . . . . . . 53 THR CA . 27467 1 580 . 1 1 53 53 THR CB C 13 71.649 0.000 . . . . . . . 53 THR CB . 27467 1 581 . 1 1 53 53 THR CG2 C 13 21.283 0.000 . . . . . . . 53 THR CG2 . 27467 1 582 . 1 1 53 53 THR N N 15 119.869 0.000 . . . . . . . 53 THR N . 27467 1 583 . 1 1 54 54 LEU H H 1 8.838 0.002 . . . . . . . 54 LEU HN . 27467 1 584 . 1 1 54 54 LEU HA H 1 4.937 0.021 . . . . . . . 54 LEU HA . 27467 1 585 . 1 1 54 54 LEU HB2 H 1 1.691 0.000 . . . . . . . 54 LEU HB2 . 27467 1 586 . 1 1 54 54 LEU HB3 H 1 1.173 0.004 . . . . . . . 54 LEU HB3 . 27467 1 587 . 1 1 54 54 LEU HG H 1 1.588 0.030 . . . . . . . 54 LEU HG . 27467 1 588 . 1 1 54 54 LEU HD11 H 1 0.957 0.002 . . . . . . . 54 LEU QD1 . 27467 1 589 . 1 1 54 54 LEU HD12 H 1 0.957 0.002 . . . . . . . 54 LEU QD1 . 27467 1 590 . 1 1 54 54 LEU HD13 H 1 0.957 0.002 . . . . . . . 54 LEU QD1 . 27467 1 591 . 1 1 54 54 LEU HD21 H 1 0.727 0.010 . . . . . . . 54 LEU QD2 . 27467 1 592 . 1 1 54 54 LEU HD22 H 1 0.727 0.010 . . . . . . . 54 LEU QD2 . 27467 1 593 . 1 1 54 54 LEU HD23 H 1 0.727 0.010 . . . . . . . 54 LEU QD2 . 27467 1 594 . 1 1 54 54 LEU CA C 13 53.526 0.000 . . . . . . . 54 LEU CA . 27467 1 595 . 1 1 54 54 LEU CB C 13 45.229 0.000 . . . . . . . 54 LEU CB . 27467 1 596 . 1 1 54 54 LEU CG C 13 27.629 0.000 . . . . . . . 54 LEU CG . 27467 1 597 . 1 1 54 54 LEU CD1 C 13 23.375 0.000 . . . . . . . 54 LEU CD1 . 27467 1 598 . 1 1 54 54 LEU CD2 C 13 27.472 0.000 . . . . . . . 54 LEU CD2 . 27467 1 599 . 1 1 54 54 LEU N N 15 124.338 0.000 . . . . . . . 54 LEU N . 27467 1 600 . 1 1 55 55 ASN H H 1 10.239 0.005 . . . . . . . 55 ASN HN . 27467 1 601 . 1 1 55 55 ASN HA H 1 4.470 0.010 . . . . . . . 55 ASN HA . 27467 1 602 . 1 1 55 55 ASN HB2 H 1 3.092 0.023 . . . . . . . 55 ASN HB2 . 27467 1 603 . 1 1 55 55 ASN HD21 H 1 7.690 0.013 . . . . . . . 55 ASN HD21 . 27467 1 604 . 1 1 55 55 ASN HD22 H 1 6.943 0.008 . . . . . . . 55 ASN HD22 . 27467 1 605 . 1 1 55 55 ASN CA C 13 54.278 0.000 . . . . . . . 55 ASN CA . 27467 1 606 . 1 1 55 55 ASN CB C 13 37.097 0.000 . . . . . . . 55 ASN CB . 27467 1 607 . 1 1 55 55 ASN N N 15 127.186 0.000 . . . . . . . 55 ASN N . 27467 1 608 . 1 1 55 55 ASN ND2 N 15 114.181 0.000 . . . . . . . 55 ASN ND2 . 27467 1 609 . 1 1 56 56 GLY H H 1 8.837 0.001 . . . . . . . 56 GLY HN . 27467 1 610 . 1 1 56 56 GLY HA2 H 1 4.243 0.034 . . . . . . . 56 GLY HA1 . 27467 1 611 . 1 1 56 56 GLY HA3 H 1 3.589 0.005 . . . . . . . 56 GLY HA2 . 27467 1 612 . 1 1 56 56 GLY CA C 13 45.165 0.000 . . . . . . . 56 GLY CA . 27467 1 613 . 1 1 56 56 GLY N N 15 128.811 0.000 . . . . . . . 56 GLY N . 27467 1 614 . 1 1 57 57 LYS H H 1 7.923 0.001 . . . . . . . 57 LYS HN . 27467 1 615 . 1 1 57 57 LYS HA H 1 4.763 0.014 . . . . . . . 57 LYS HA . 27467 1 616 . 1 1 57 57 LYS HB2 H 1 2.056 0.008 . . . . . . . 57 LYS HB2 . 27467 1 617 . 1 1 57 57 LYS HG2 H 1 1.842 0.000 . . . . . . . 57 LYS HG2 . 27467 1 618 . 1 1 57 57 LYS HD2 H 1 1.661 0.000 . . . . . . . 57 LYS HD2 . 27467 1 619 . 1 1 57 57 LYS HD3 H 1 1.609 0.000 . . . . . . . 57 LYS HD3 . 27467 1 620 . 1 1 57 57 LYS HE2 H 1 3.069 0.000 . . . . . . . 57 LYS HE2 . 27467 1 621 . 1 1 57 57 LYS CA C 13 54.727 0.000 . . . . . . . 57 LYS CA . 27467 1 622 . 1 1 57 57 LYS CB C 13 34.837 0.000 . . . . . . . 57 LYS CB . 27467 1 623 . 1 1 57 57 LYS CG C 13 29.440 0.000 . . . . . . . 57 LYS CG . 27467 1 624 . 1 1 57 57 LYS CD C 13 24.926 0.000 . . . . . . . 57 LYS CD . 27467 1 625 . 1 1 57 57 LYS CE C 13 42.233 0.000 . . . . . . . 57 LYS CE . 27467 1 626 . 1 1 57 57 LYS N N 15 121.900 0.000 . . . . . . . 57 LYS N . 27467 1 627 . 1 1 58 58 ARG H H 1 8.654 0.000 . . . . . . . 58 ARG HN . 27467 1 628 . 1 1 58 58 ARG HA H 1 4.623 0.023 . . . . . . . 58 ARG HA . 27467 1 629 . 1 1 58 58 ARG HB2 H 1 1.752 0.000 . . . . . . . 58 ARG HB2 . 27467 1 630 . 1 1 58 58 ARG HG2 H 1 1.685 0.000 . . . . . . . 58 ARG HG2 . 27467 1 631 . 1 1 58 58 ARG HG3 H 1 1.597 0.000 . . . . . . . 58 ARG HG3 . 27467 1 632 . 1 1 58 58 ARG HD2 H 1 3.186 0.009 . . . . . . . 58 ARG HD2 . 27467 1 633 . 1 1 58 58 ARG CA C 13 55.985 0.000 . . . . . . . 58 ARG CA . 27467 1 634 . 1 1 58 58 ARG CB C 13 31.002 0.000 . . . . . . . 58 ARG CB . 27467 1 635 . 1 1 58 58 ARG CG C 13 27.472 0.000 . . . . . . . 58 ARG CG . 27467 1 636 . 1 1 58 58 ARG CD C 13 43.544 0.000 . . . . . . . 58 ARG CD . 27467 1 637 . 1 1 58 58 ARG N N 15 123.931 0.000 . . . . . . . 58 ARG N . 27467 1 638 . 1 1 59 59 LEU H H 1 8.685 0.002 . . . . . . . 59 LEU HN . 27467 1 639 . 1 1 59 59 LEU HA H 1 3.883 0.000 . . . . . . . 59 LEU HA . 27467 1 640 . 1 1 59 59 LEU HB2 H 1 1.422 0.012 . . . . . . . 59 LEU HB2 . 27467 1 641 . 1 1 59 59 LEU HB3 H 1 1.219 0.016 . . . . . . . 59 LEU HB3 . 27467 1 642 . 1 1 59 59 LEU HG H 1 1.275 0.000 . . . . . . . 59 LEU HG . 27467 1 643 . 1 1 59 59 LEU HD11 H 1 0.481 0.009 . . . . . . . 59 LEU QD1 . 27467 1 644 . 1 1 59 59 LEU HD12 H 1 0.481 0.009 . . . . . . . 59 LEU QD1 . 27467 1 645 . 1 1 59 59 LEU HD13 H 1 0.481 0.009 . . . . . . . 59 LEU QD1 . 27467 1 646 . 1 1 59 59 LEU HD21 H 1 0.079 0.004 . . . . . . . 59 LEU QD2 . 27467 1 647 . 1 1 59 59 LEU HD22 H 1 0.079 0.004 . . . . . . . 59 LEU QD2 . 27467 1 648 . 1 1 59 59 LEU HD23 H 1 0.079 0.004 . . . . . . . 59 LEU QD2 . 27467 1 649 . 1 1 59 59 LEU CA C 13 55.902 0.000 . . . . . . . 59 LEU CA . 27467 1 650 . 1 1 59 59 LEU CB C 13 41.226 0.000 . . . . . . . 59 LEU CB . 27467 1 651 . 1 1 59 59 LEU CG C 13 27.472 0.000 . . . . . . . 59 LEU CG . 27467 1 652 . 1 1 59 59 LEU CD1 C 13 25.248 0.000 . . . . . . . 59 LEU CD1 . 27467 1 653 . 1 1 59 59 LEU CD2 C 13 21.767 0.000 . . . . . . . 59 LEU CD2 . 27467 1 654 . 1 1 59 59 LEU N N 15 124.176 0.000 . . . . . . . 59 LEU N . 27467 1 655 . 1 1 60 60 GLU H H 1 8.048 0.007 . . . . . . . 60 GLU HN . 27467 1 656 . 1 1 60 60 GLU HA H 1 4.549 0.016 . . . . . . . 60 GLU HA . 27467 1 657 . 1 1 60 60 GLU HB2 H 1 2.153 0.018 . . . . . . . 60 GLU HB2 . 27467 1 658 . 1 1 60 60 GLU HB3 H 1 1.884 0.014 . . . . . . . 60 GLU HB3 . 27467 1 659 . 1 1 60 60 GLU HG2 H 1 2.473 0.000 . . . . . . . 60 GLU HG2 . 27467 1 660 . 1 1 60 60 GLU HG3 H 1 2.292 0.000 . . . . . . . 60 GLU HG3 . 27467 1 661 . 1 1 60 60 GLU CA C 13 55.027 0.000 . . . . . . . 60 GLU CA . 27467 1 662 . 1 1 60 60 GLU CB C 13 32.489 0.000 . . . . . . . 60 GLU CB . 27467 1 663 . 1 1 60 60 GLU CG C 13 36.122 0.000 . . . . . . . 60 GLU CG . 27467 1 664 . 1 1 60 60 GLU N N 15 124.714 0.000 . . . . . . . 60 GLU N . 27467 1 665 . 1 1 61 61 ASP H H 1 8.523 0.006 . . . . . . . 61 ASP HN . 27467 1 666 . 1 1 61 61 ASP HA H 1 4.310 0.013 . . . . . . . 61 ASP HA . 27467 1 667 . 1 1 61 61 ASP HB2 H 1 2.624 0.044 . . . . . . . 61 ASP HB2 . 27467 1 668 . 1 1 61 61 ASP HB3 H 1 2.604 0.000 . . . . . . . 61 ASP HB3 . 27467 1 669 . 1 1 61 61 ASP CA C 13 56.502 0.000 . . . . . . . 61 ASP CA . 27467 1 670 . 1 1 61 61 ASP CB C 13 40.580 0.000 . . . . . . . 61 ASP CB . 27467 1 671 . 1 1 61 61 ASP N N 15 122.581 0.000 . . . . . . . 61 ASP N . 27467 1 672 . 1 1 62 62 GLY H H 1 8.046 0.000 . . . . . . . 62 GLY HN . 27467 1 673 . 1 1 62 62 GLY HA2 H 1 4.398 0.000 . . . . . . . 62 GLY HA1 . 27467 1 674 . 1 1 62 62 GLY HA3 H 1 3.790 0.000 . . . . . . . 62 GLY HA2 . 27467 1 675 . 1 1 62 62 GLY CA C 13 45.002 0.000 . . . . . . . 62 GLY CA . 27467 1 676 . 1 1 63 63 LYS H H 1 7.482 0.005 . . . . . . . 63 LYS HN . 27467 1 677 . 1 1 63 63 LYS HA H 1 4.785 0.011 . . . . . . . 63 LYS HA . 27467 1 678 . 1 1 63 63 LYS HB2 H 1 2.455 0.029 . . . . . . . 63 LYS HB2 . 27467 1 679 . 1 1 63 63 LYS HB3 H 1 2.409 0.000 . . . . . . . 63 LYS HB3 . 27467 1 680 . 1 1 63 63 LYS HG2 H 1 1.683 0.003 . . . . . . . 63 LYS HG2 . 27467 1 681 . 1 1 63 63 LYS HD2 H 1 1.381 0.006 . . . . . . . 63 LYS HD2 . 27467 1 682 . 1 1 63 63 LYS HE2 H 1 2.977 0.015 . . . . . . . 63 LYS HE2 . 27467 1 683 . 1 1 63 63 LYS CA C 13 54.899 0.000 . . . . . . . 63 LYS CA . 27467 1 684 . 1 1 63 63 LYS CB C 13 33.765 0.000 . . . . . . . 63 LYS CB . 27467 1 685 . 1 1 63 63 LYS CG C 13 27.964 0.000 . . . . . . . 63 LYS CG . 27467 1 686 . 1 1 63 63 LYS CD C 13 25.872 0.000 . . . . . . . 63 LYS CD . 27467 1 687 . 1 1 63 63 LYS CE C 13 42.725 0.000 . . . . . . . 63 LYS CE . 27467 1 688 . 1 1 63 63 LYS N N 15 119.056 0.000 . . . . . . . 63 LYS N . 27467 1 689 . 1 1 64 64 MET H H 1 9.186 0.003 . . . . . . . 64 MET HN . 27467 1 690 . 1 1 64 64 MET HA H 1 5.259 0.008 . . . . . . . 64 MET HA . 27467 1 691 . 1 1 64 64 MET HB2 H 1 2.269 0.021 . . . . . . . 64 MET HB2 . 27467 1 692 . 1 1 64 64 MET HB3 H 1 2.031 0.006 . . . . . . . 64 MET HB3 . 27467 1 693 . 1 1 64 64 MET HG2 H 1 2.770 0.006 . . . . . . . 64 MET HG2 . 27467 1 694 . 1 1 64 64 MET HG3 H 1 2.616 0.007 . . . . . . . 64 MET HG3 . 27467 1 695 . 1 1 64 64 MET HE1 H 1 2.115 0.000 . . . . . . . 64 MET QE . 27467 1 696 . 1 1 64 64 MET HE2 H 1 2.115 0.000 . . . . . . . 64 MET QE . 27467 1 697 . 1 1 64 64 MET HE3 H 1 2.115 0.000 . . . . . . . 64 MET QE . 27467 1 698 . 1 1 64 64 MET CA C 13 53.085 0.000 . . . . . . . 64 MET CA . 27467 1 699 . 1 1 64 64 MET CB C 13 33.712 0.000 . . . . . . . 64 MET CB . 27467 1 700 . 1 1 64 64 MET CG C 13 32.392 0.000 . . . . . . . 64 MET CG . 27467 1 701 . 1 1 64 64 MET CE C 13 9.697 0.000 . . . . . . . 64 MET CE . 27467 1 702 . 1 1 64 64 MET N N 15 118.878 0.000 . . . . . . . 64 MET N . 27467 1 703 . 1 1 65 65 MET H H 1 8.797 0.006 . . . . . . . 65 MET HN . 27467 1 704 . 1 1 65 65 MET HA H 1 4.774 0.015 . . . . . . . 65 MET HA . 27467 1 705 . 1 1 65 65 MET HB2 H 1 2.432 0.016 . . . . . . . 65 MET HB2 . 27467 1 706 . 1 1 65 65 MET HB3 H 1 1.793 0.023 . . . . . . . 65 MET HB3 . 27467 1 707 . 1 1 65 65 MET HG2 H 1 2.508 0.000 . . . . . . . 65 MET HG2 . 27467 1 708 . 1 1 65 65 MET HG3 H 1 2.338 0.000 . . . . . . . 65 MET HG3 . 27467 1 709 . 1 1 65 65 MET HE1 H 1 1.801 0.015 . . . . . . . 65 MET QE . 27467 1 710 . 1 1 65 65 MET HE2 H 1 1.801 0.015 . . . . . . . 65 MET QE . 27467 1 711 . 1 1 65 65 MET HE3 H 1 1.801 0.015 . . . . . . . 65 MET QE . 27467 1 712 . 1 1 65 65 MET CA C 13 57.313 0.000 . . . . . . . 65 MET CA . 27467 1 713 . 1 1 65 65 MET CB C 13 29.561 0.000 . . . . . . . 65 MET CB . 27467 1 714 . 1 1 65 65 MET CG C 13 33.444 0.000 . . . . . . . 65 MET CG . 27467 1 715 . 1 1 65 65 MET CE C 13 9.787 0.000 . . . . . . . 65 MET CE . 27467 1 716 . 1 1 65 65 MET N N 15 119.463 0.000 . . . . . . . 65 MET N . 27467 1 717 . 1 1 66 66 ALA H H 1 8.877 0.000 . . . . . . . 66 ALA HN . 27467 1 718 . 1 1 66 66 ALA HA H 1 4.199 0.005 . . . . . . . 66 ALA HA . 27467 1 719 . 1 1 66 66 ALA HB1 H 1 1.470 0.002 . . . . . . . 66 ALA QB . 27467 1 720 . 1 1 66 66 ALA HB2 H 1 1.470 0.002 . . . . . . . 66 ALA QB . 27467 1 721 . 1 1 66 66 ALA HB3 H 1 1.470 0.002 . . . . . . . 66 ALA QB . 27467 1 722 . 1 1 66 66 ALA CA C 13 54.512 0.000 . . . . . . . 66 ALA CA . 27467 1 723 . 1 1 66 66 ALA CB C 13 18.940 0.000 . . . . . . . 66 ALA CB . 27467 1 724 . 1 1 66 66 ALA N N 15 120.807 0.000 . . . . . . . 66 ALA N . 27467 1 725 . 1 1 67 67 ASP H H 1 7.803 0.000 . . . . . . . 67 ASP HN . 27467 1 726 . 1 1 67 67 ASP HA H 1 4.386 0.000 . . . . . . . 67 ASP HA . 27467 1 727 . 1 1 67 67 ASP HB2 H 1 2.788 0.000 . . . . . . . 67 ASP HB2 . 27467 1 728 . 1 1 67 67 ASP HB3 H 1 2.406 0.011 . . . . . . . 67 ASP HB3 . 27467 1 729 . 1 1 67 67 ASP CA C 13 56.501 0.000 . . . . . . . 67 ASP CA . 27467 1 730 . 1 1 67 67 ASP CB C 13 40.378 0.000 . . . . . . . 67 ASP CB . 27467 1 731 . 1 1 67 67 ASP N N 15 117.025 0.000 . . . . . . . 67 ASP N . 27467 1 732 . 1 1 68 68 TYR H H 1 7.734 0.001 . . . . . . . 68 TYR HN . 27467 1 733 . 1 1 68 68 TYR HA H 1 4.411 0.003 . . . . . . . 68 TYR HA . 27467 1 734 . 1 1 68 68 TYR HB2 H 1 3.352 0.023 . . . . . . . 68 TYR HB2 . 27467 1 735 . 1 1 68 68 TYR HB3 H 1 2.731 0.014 . . . . . . . 68 TYR HB3 . 27467 1 736 . 1 1 68 68 TYR HD1 H 1 7.251 0.012 . . . . . . . 68 TYR QD . 27467 1 737 . 1 1 68 68 TYR HD2 H 1 7.251 0.012 . . . . . . . 68 TYR QD . 27467 1 738 . 1 1 68 68 TYR HE1 H 1 6.725 0.010 . . . . . . . 68 TYR QE . 27467 1 739 . 1 1 68 68 TYR HE2 H 1 6.725 0.010 . . . . . . . 68 TYR QE . 27467 1 740 . 1 1 68 68 TYR CA C 13 58.382 0.000 . . . . . . . 68 TYR CA . 27467 1 741 . 1 1 68 68 TYR CB C 13 39.444 0.000 . . . . . . . 68 TYR CB . 27467 1 742 . 1 1 68 68 TYR N N 15 116.619 0.000 . . . . . . . 68 TYR N . 27467 1 743 . 1 1 69 69 GLY H H 1 7.778 0.000 . . . . . . . 69 GLY HN . 27467 1 744 . 1 1 69 69 GLY HA2 H 1 4.000 0.026 . . . . . . . 69 GLY HA1 . 27467 1 745 . 1 1 69 69 GLY HA3 H 1 3.895 0.013 . . . . . . . 69 GLY HA2 . 27467 1 746 . 1 1 69 69 GLY CA C 13 47.170 0.000 . . . . . . . 69 GLY CA . 27467 1 747 . 1 1 69 69 GLY N N 15 108.412 0.000 . . . . . . . 69 GLY N . 27467 1 748 . 1 1 70 70 ILE H H 1 6.702 0.006 . . . . . . . 70 ILE HN . 27467 1 749 . 1 1 70 70 ILE HA H 1 4.181 0.016 . . . . . . . 70 ILE HA . 27467 1 750 . 1 1 70 70 ILE HB H 1 1.621 0.000 . . . . . . . 70 ILE HB . 27467 1 751 . 1 1 70 70 ILE HG12 H 1 1.482 0.000 . . . . . . . 70 ILE HG12 . 27467 1 752 . 1 1 70 70 ILE HG13 H 1 1.002 0.021 . . . . . . . 70 ILE HG13 . 27467 1 753 . 1 1 70 70 ILE HG21 H 1 0.893 0.017 . . . . . . . 70 ILE QG2 . 27467 1 754 . 1 1 70 70 ILE HG22 H 1 0.893 0.017 . . . . . . . 70 ILE QG2 . 27467 1 755 . 1 1 70 70 ILE HG23 H 1 0.893 0.017 . . . . . . . 70 ILE QG2 . 27467 1 756 . 1 1 70 70 ILE HD11 H 1 0.724 0.009 . . . . . . . 70 ILE QD1 . 27467 1 757 . 1 1 70 70 ILE HD12 H 1 0.724 0.009 . . . . . . . 70 ILE QD1 . 27467 1 758 . 1 1 70 70 ILE HD13 H 1 0.724 0.009 . . . . . . . 70 ILE QD1 . 27467 1 759 . 1 1 70 70 ILE CA C 13 61.599 0.000 . . . . . . . 70 ILE CA . 27467 1 760 . 1 1 70 70 ILE CB C 13 39.711 0.000 . . . . . . . 70 ILE CB . 27467 1 761 . 1 1 70 70 ILE CG1 C 13 26.980 0.000 . . . . . . . 70 ILE CG1 . 27467 1 762 . 1 1 70 70 ILE CG2 C 13 18.418 0.000 . . . . . . . 70 ILE CG2 . 27467 1 763 . 1 1 70 70 ILE CD1 C 13 15.171 0.000 . . . . . . . 70 ILE CD1 . 27467 1 764 . 1 1 70 70 ILE N N 15 112.871 0.000 . . . . . . . 70 ILE N . 27467 1 765 . 1 1 71 71 ARG H H 1 7.973 0.011 . . . . . . . 71 ARG HN . 27467 1 766 . 1 1 71 71 ARG HA H 1 4.497 0.000 . . . . . . . 71 ARG HA . 27467 1 767 . 1 1 71 71 ARG HB2 H 1 1.944 0.043 . . . . . . . 71 ARG HB2 . 27467 1 768 . 1 1 71 71 ARG HB3 H 1 1.696 0.000 . . . . . . . 71 ARG HB3 . 27467 1 769 . 1 1 71 71 ARG HG2 H 1 1.759 0.000 . . . . . . . 71 ARG HG2 . 27467 1 770 . 1 1 71 71 ARG HD2 H 1 3.282 0.016 . . . . . . . 71 ARG HD2 . 27467 1 771 . 1 1 71 71 ARG CA C 13 53.885 0.000 . . . . . . . 71 ARG CA . 27467 1 772 . 1 1 71 71 ARG CB C 13 34.060 0.000 . . . . . . . 71 ARG CB . 27467 1 773 . 1 1 71 71 ARG CG C 13 26.722 0.000 . . . . . . . 71 ARG CG . 27467 1 774 . 1 1 71 71 ARG CD C 13 43.495 0.000 . . . . . . . 71 ARG CD . 27467 1 775 . 1 1 71 71 ARG N N 15 122.718 0.000 . . . . . . . 71 ARG N . 27467 1 776 . 1 1 72 72 LYS H H 1 8.524 0.001 . . . . . . . 72 LYS HN . 27467 1 777 . 1 1 72 72 LYS HA H 1 3.851 0.004 . . . . . . . 72 LYS HA . 27467 1 778 . 1 1 72 72 LYS HB2 H 1 1.870 0.000 . . . . . . . 72 LYS HB2 . 27467 1 779 . 1 1 72 72 LYS HB3 H 1 1.881 0.000 . . . . . . . 72 LYS HB3 . 27467 1 780 . 1 1 72 72 LYS HG2 H 1 1.793 0.000 . . . . . . . 72 LYS HG2 . 27467 1 781 . 1 1 72 72 LYS HD2 H 1 1.597 0.000 . . . . . . . 72 LYS HD2 . 27467 1 782 . 1 1 72 72 LYS HD3 H 1 1.485 0.000 . . . . . . . 72 LYS HD3 . 27467 1 783 . 1 1 72 72 LYS HE2 H 1 3.058 0.000 . . . . . . . 72 LYS HE2 . 27467 1 784 . 1 1 72 72 LYS CA C 13 58.329 0.000 . . . . . . . 72 LYS CA . 27467 1 785 . 1 1 72 72 LYS CB C 13 32.660 0.000 . . . . . . . 72 LYS CB . 27467 1 786 . 1 1 72 72 LYS CG C 13 29.932 0.000 . . . . . . . 72 LYS CG . 27467 1 787 . 1 1 72 72 LYS CD C 13 24.926 0.000 . . . . . . . 72 LYS CD . 27467 1 788 . 1 1 72 72 LYS CE C 13 42.233 0.000 . . . . . . . 72 LYS CE . 27467 1 789 . 1 1 72 72 LYS N N 15 119.463 0.000 . . . . . . . 72 LYS N . 27467 1 790 . 1 1 73 73 GLY H H 1 9.210 0.000 . . . . . . . 73 GLY HN . 27467 1 791 . 1 1 73 73 GLY HA2 H 1 4.326 0.025 . . . . . . . 73 GLY HA1 . 27467 1 792 . 1 1 73 73 GLY HA3 H 1 3.639 0.010 . . . . . . . 73 GLY HA2 . 27467 1 793 . 1 1 73 73 GLY CA C 13 45.323 0.000 . . . . . . . 73 GLY CA . 27467 1 794 . 1 1 73 73 GLY N N 15 112.963 0.000 . . . . . . . 73 GLY N . 27467 1 795 . 1 1 74 74 ASN H H 1 7.722 0.003 . . . . . . . 74 ASN HN . 27467 1 796 . 1 1 74 74 ASN HA H 1 4.655 0.001 . . . . . . . 74 ASN HA . 27467 1 797 . 1 1 74 74 ASN HB2 H 1 2.824 0.030 . . . . . . . 74 ASN HB2 . 27467 1 798 . 1 1 74 74 ASN HB3 H 1 2.728 0.021 . . . . . . . 74 ASN HB3 . 27467 1 799 . 1 1 74 74 ASN HD21 H 1 7.537 0.008 . . . . . . . 74 ASN HD21 . 27467 1 800 . 1 1 74 74 ASN HD22 H 1 7.133 0.010 . . . . . . . 74 ASN HD22 . 27467 1 801 . 1 1 74 74 ASN CA C 13 54.270 0.000 . . . . . . . 74 ASN CA . 27467 1 802 . 1 1 74 74 ASN CB C 13 41.379 0.000 . . . . . . . 74 ASN CB . 27467 1 803 . 1 1 74 74 ASN N N 15 117.273 0.000 . . . . . . . 74 ASN N . 27467 1 804 . 1 1 74 74 ASN ND2 N 15 109.465 0.199 . . . . . . . 74 ASN ND2 . 27467 1 805 . 1 1 75 75 LEU H H 1 8.285 0.002 . . . . . . . 75 LEU HN . 27467 1 806 . 1 1 75 75 LEU HA H 1 5.035 0.005 . . . . . . . 75 LEU HA . 27467 1 807 . 1 1 75 75 LEU HB2 H 1 1.695 0.000 . . . . . . . 75 LEU HB2 . 27467 1 808 . 1 1 75 75 LEU HB3 H 1 0.929 0.044 . . . . . . . 75 LEU HB3 . 27467 1 809 . 1 1 75 75 LEU HG H 1 1.770 0.000 . . . . . . . 75 LEU HG . 27467 1 810 . 1 1 75 75 LEU HD11 H 1 1.050 0.000 . . . . . . . 75 LEU QD1 . 27467 1 811 . 1 1 75 75 LEU HD12 H 1 1.050 0.000 . . . . . . . 75 LEU QD1 . 27467 1 812 . 1 1 75 75 LEU HD13 H 1 1.050 0.000 . . . . . . . 75 LEU QD1 . 27467 1 813 . 1 1 75 75 LEU HD21 H 1 0.871 0.006 . . . . . . . 75 LEU QD2 . 27467 1 814 . 1 1 75 75 LEU HD22 H 1 0.871 0.006 . . . . . . . 75 LEU QD2 . 27467 1 815 . 1 1 75 75 LEU HD23 H 1 0.871 0.006 . . . . . . . 75 LEU QD2 . 27467 1 816 . 1 1 75 75 LEU CA C 13 53.618 0.000 . . . . . . . 75 LEU CA . 27467 1 817 . 1 1 75 75 LEU CB C 13 43.597 0.000 . . . . . . . 75 LEU CB . 27467 1 818 . 1 1 75 75 LEU CG C 13 27.599 0.000 . . . . . . . 75 LEU CG . 27467 1 819 . 1 1 75 75 LEU CD1 C 13 25.743 0.000 . . . . . . . 75 LEU CD1 . 27467 1 820 . 1 1 75 75 LEU CD2 C 13 24.885 0.000 . . . . . . . 75 LEU CD2 . 27467 1 821 . 1 1 75 75 LEU N N 15 118.584 0.000 . . . . . . . 75 LEU N . 27467 1 822 . 1 1 76 76 LEU H H 1 9.036 0.003 . . . . . . . 76 LEU HN . 27467 1 823 . 1 1 76 76 LEU HA H 1 5.030 0.000 . . . . . . . 76 LEU HA . 27467 1 824 . 1 1 76 76 LEU HB2 H 1 1.667 0.010 . . . . . . . 76 LEU HB2 . 27467 1 825 . 1 1 76 76 LEU HB3 H 1 1.133 0.015 . . . . . . . 76 LEU HB3 . 27467 1 826 . 1 1 76 76 LEU HG H 1 1.578 0.011 . . . . . . . 76 LEU HG . 27467 1 827 . 1 1 76 76 LEU HD11 H 1 0.668 0.025 . . . . . . . 76 LEU QD1 . 27467 1 828 . 1 1 76 76 LEU HD12 H 1 0.668 0.025 . . . . . . . 76 LEU QD1 . 27467 1 829 . 1 1 76 76 LEU HD13 H 1 0.668 0.025 . . . . . . . 76 LEU QD1 . 27467 1 830 . 1 1 76 76 LEU CA C 13 52.950 0.000 . . . . . . . 76 LEU CA . 27467 1 831 . 1 1 76 76 LEU CB C 13 43.889 0.000 . . . . . . . 76 LEU CB . 27467 1 832 . 1 1 76 76 LEU CG C 13 26.933 0.000 . . . . . . . 76 LEU CG . 27467 1 833 . 1 1 76 76 LEU CD1 C 13 26.028 0.000 . . . . . . . 76 LEU CD1 . 27467 1 834 . 1 1 76 76 LEU N N 15 123.525 0.000 . . . . . . . 76 LEU N . 27467 1 835 . 1 1 77 77 PHE H H 1 8.919 0.003 . . . . . . . 77 PHE HN . 27467 1 836 . 1 1 77 77 PHE HA H 1 5.038 0.000 . . . . . . . 77 PHE HA . 27467 1 837 . 1 1 77 77 PHE HB2 H 1 2.968 0.001 . . . . . . . 77 PHE HB2 . 27467 1 838 . 1 1 77 77 PHE HB3 H 1 3.006 0.000 . . . . . . . 77 PHE HB3 . 27467 1 839 . 1 1 77 77 PHE HD1 H 1 7.221 0.008 . . . . . . . 77 PHE QD . 27467 1 840 . 1 1 77 77 PHE HD2 H 1 7.221 0.008 . . . . . . . 77 PHE QD . 27467 1 841 . 1 1 77 77 PHE HE1 H 1 7.378 0.000 . . . . . . . 77 PHE QE . 27467 1 842 . 1 1 77 77 PHE HE2 H 1 7.378 0.000 . . . . . . . 77 PHE QE . 27467 1 843 . 1 1 77 77 PHE CA C 13 58.154 0.000 . . . . . . . 77 PHE CA . 27467 1 844 . 1 1 77 77 PHE CB C 13 40.476 0.000 . . . . . . . 77 PHE CB . 27467 1 845 . 1 1 77 77 PHE N N 15 122.306 0.000 . . . . . . . 77 PHE N . 27467 1 846 . 1 1 78 78 LEU H H 1 8.602 0.000 . . . . . . . 78 LEU HN . 27467 1 847 . 1 1 78 78 LEU HA H 1 5.104 0.021 . . . . . . . 78 LEU HA . 27467 1 848 . 1 1 78 78 LEU HB2 H 1 1.901 0.004 . . . . . . . 78 LEU HB2 . 27467 1 849 . 1 1 78 78 LEU HB3 H 1 1.272 0.019 . . . . . . . 78 LEU HB3 . 27467 1 850 . 1 1 78 78 LEU HG H 1 0.812 0.060 . . . . . . . 78 LEU HG . 27467 1 851 . 1 1 78 78 LEU HD11 H 1 0.884 0.028 . . . . . . . 78 LEU QD1 . 27467 1 852 . 1 1 78 78 LEU HD12 H 1 0.884 0.028 . . . . . . . 78 LEU QD1 . 27467 1 853 . 1 1 78 78 LEU HD13 H 1 0.884 0.028 . . . . . . . 78 LEU QD1 . 27467 1 854 . 1 1 78 78 LEU CA C 13 54.151 0.000 . . . . . . . 78 LEU CA . 27467 1 855 . 1 1 78 78 LEU CB C 13 45.255 0.000 . . . . . . . 78 LEU CB . 27467 1 856 . 1 1 78 78 LEU CG C 13 27.084 0.000 . . . . . . . 78 LEU CG . 27467 1 857 . 1 1 78 78 LEU CD1 C 13 24.771 0.000 . . . . . . . 78 LEU CD1 . 27467 1 858 . 1 1 78 78 LEU N N 15 125.556 0.000 . . . . . . . 78 LEU N . 27467 1 859 . 1 1 79 79 ALA H H 1 8.988 0.003 . . . . . . . 79 ALA HN . 27467 1 860 . 1 1 79 79 ALA HA H 1 4.617 0.035 . . . . . . . 79 ALA HA . 27467 1 861 . 1 1 79 79 ALA HB1 H 1 1.435 0.012 . . . . . . . 79 ALA QB . 27467 1 862 . 1 1 79 79 ALA HB2 H 1 1.435 0.012 . . . . . . . 79 ALA QB . 27467 1 863 . 1 1 79 79 ALA HB3 H 1 1.435 0.012 . . . . . . . 79 ALA QB . 27467 1 864 . 1 1 79 79 ALA CA C 13 51.142 0.000 . . . . . . . 79 ALA CA . 27467 1 865 . 1 1 79 79 ALA CB C 13 21.283 0.000 . . . . . . . 79 ALA CB . 27467 1 866 . 1 1 79 79 ALA N N 15 130.431 0.000 . . . . . . . 79 ALA N . 27467 1 867 . 1 1 80 80 SER H H 1 8.354 0.003 . . . . . . . 80 SER HN . 27467 1 868 . 1 1 80 80 SER HA H 1 4.815 0.021 . . . . . . . 80 SER HA . 27467 1 869 . 1 1 80 80 SER HB2 H 1 3.796 0.005 . . . . . . . 80 SER HB2 . 27467 1 870 . 1 1 80 80 SER HB3 H 1 3.820 0.000 . . . . . . . 80 SER HB3 . 27467 1 871 . 1 1 80 80 SER CA C 13 58.043 0.000 . . . . . . . 80 SER CA . 27467 1 872 . 1 1 80 80 SER CB C 13 64.675 0.000 . . . . . . . 80 SER CB . 27467 1 873 . 1 1 80 80 SER N N 15 113.775 0.000 . . . . . . . 80 SER N . 27467 1 874 . 1 1 81 81 TYR H H 1 8.434 0.000 . . . . . . . 81 TYR HN . 27467 1 875 . 1 1 81 81 TYR HA H 1 4.629 0.000 . . . . . . . 81 TYR HA . 27467 1 876 . 1 1 81 81 TYR HB2 H 1 3.011 0.019 . . . . . . . 81 TYR HB2 . 27467 1 877 . 1 1 81 81 TYR HD1 H 1 7.089 0.000 . . . . . . . 81 TYR QD . 27467 1 878 . 1 1 81 81 TYR HD2 H 1 7.089 0.000 . . . . . . . 81 TYR QD . 27467 1 879 . 1 1 81 81 TYR HE1 H 1 6.797 0.000 . . . . . . . 81 TYR QE . 27467 1 880 . 1 1 81 81 TYR HE2 H 1 6.797 0.000 . . . . . . . 81 TYR QE . 27467 1 881 . 1 1 81 81 TYR CA C 13 58.215 0.000 . . . . . . . 81 TYR CA . 27467 1 882 . 1 1 81 81 TYR CB C 13 39.406 0.000 . . . . . . . 81 TYR CB . 27467 1 883 . 1 1 81 81 TYR N N 15 122.617 0.000 . . . . . . . 81 TYR N . 27467 1 884 . 1 1 82 82 SER H H 1 8.202 0.000 . . . . . . . 82 SER HN . 27467 1 885 . 1 1 82 82 SER HA H 1 4.424 0.000 . . . . . . . 82 SER HA . 27467 1 886 . 1 1 82 82 SER HB2 H 1 3.793 0.000 . . . . . . . 82 SER HB2 . 27467 1 887 . 1 1 82 82 SER CA C 13 57.540 0.000 . . . . . . . 82 SER CA . 27467 1 888 . 1 1 82 82 SER CB C 13 64.046 0.000 . . . . . . . 82 SER CB . 27467 1 889 . 1 1 82 82 SER N N 15 118.650 0.000 . . . . . . . 82 SER N . 27467 1 890 . 1 1 83 83 ILE H H 1 8.216 0.000 . . . . . . . 83 ILE HN . 27467 1 891 . 1 1 83 83 ILE HA H 1 4.182 0.000 . . . . . . . 83 ILE HA . 27467 1 892 . 1 1 83 83 ILE HB H 1 1.880 0.000 . . . . . . . 83 ILE HB . 27467 1 893 . 1 1 83 83 ILE HG12 H 1 1.251 0.000 . . . . . . . 83 ILE QG1 . 27467 1 894 . 1 1 83 83 ILE HG13 H 1 1.251 0.000 . . . . . . . 83 ILE QG1 . 27467 1 895 . 1 1 83 83 ILE HG21 H 1 0.989 0.000 . . . . . . . 83 ILE QG2 . 27467 1 896 . 1 1 83 83 ILE HG22 H 1 0.989 0.000 . . . . . . . 83 ILE QG2 . 27467 1 897 . 1 1 83 83 ILE HG23 H 1 0.989 0.000 . . . . . . . 83 ILE QG2 . 27467 1 898 . 1 1 83 83 ILE HD11 H 1 0.943 0.000 . . . . . . . 83 ILE QD1 . 27467 1 899 . 1 1 83 83 ILE HD12 H 1 0.943 0.000 . . . . . . . 83 ILE QD1 . 27467 1 900 . 1 1 83 83 ILE HD13 H 1 0.943 0.000 . . . . . . . 83 ILE QD1 . 27467 1 901 . 1 1 83 83 ILE CA C 13 61.484 0.000 . . . . . . . 83 ILE CA . 27467 1 902 . 1 1 83 83 ILE CB C 13 38.720 0.000 . . . . . . . 83 ILE CB . 27467 1 903 . 1 1 83 83 ILE CG1 C 13 26.980 0.000 . . . . . . . 83 ILE CG1 . 27467 1 904 . 1 1 83 83 ILE CG2 C 13 17.434 0.000 . . . . . . . 83 ILE CG2 . 27467 1 905 . 1 1 83 83 ILE CD1 C 13 13.082 0.000 . . . . . . . 83 ILE CD1 . 27467 1 906 . 1 1 83 83 ILE N N 15 122.940 0.000 . . . . . . . 83 ILE N . 27467 1 907 . 1 1 84 84 GLY H H 1 8.441 0.004 . . . . . . . 84 GLY HN . 27467 1 908 . 1 1 84 84 GLY HA2 H 1 3.966 0.011 . . . . . . . 84 GLY HA1 . 27467 1 909 . 1 1 84 84 GLY CA C 13 45.445 0.000 . . . . . . . 84 GLY CA . 27467 1 910 . 1 1 84 84 GLY N N 15 113.369 0.000 . . . . . . . 84 GLY N . 27467 1 911 . 1 1 85 85 GLY H H 1 7.915 0.000 . . . . . . . 85 GLY HN . 27467 1 912 . 1 1 85 85 GLY HA2 H 1 3.785 0.000 . . . . . . . 85 GLY HA1 . 27467 1 913 . 1 1 85 85 GLY N N 15 115.405 0.000 . . . . . . . 85 GLY N . 27467 1 stop_ save_