data_50336 ####################### # Entry information # ####################### save_entry_information_1 _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information_1 _Entry.ID 50336 _Entry.Title ; yarp ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2020-06-22 _Entry.Accession_date 2020-06-22 _Entry.Last_release_date 2020-06-22 _Entry.Original_release_date 2020-06-22 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.6.0 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details 'fragment 2149-2209 of the YARP protein' _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 Katarzyna Bucholc . . . 0000-0002-6475-953X 50336 2 Aleksandra Skrajna . . . 0000-0002-4552-5981 50336 3 Kinga Adamska . . . 0000-0002-6643-6814 50336 4 Xiao-Cui Yang . . . . 50336 5 Krzysztof Krajewski . . . 0000-0001-7159-617X 50336 6 Jaroslaw Poznanski . . . 0000-0003-2684-1775 50336 7 Michal Dadlez . . . 0000-0001-8811-5176 50336 8 Zbigniew Dominski . . . 0000-0001-5100-7796 50336 9 Igor Zhukov . . . 0000-0002-9912-1018 50336 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . 'Institute of Biochemistry and Biophysics, Polish Academy of Sciences' . 50336 2 . 'Department of Biochemistry and Biophysics, University of North Carolina at Chapel Hill' . 50336 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 50336 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 273 50336 '15N chemical shifts' 69 50336 '1H chemical shifts' 458 50336 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2020-08-25 . original BMRB . 50336 stop_ save_ ############### # Citations # ############### save_citations_1 _Citation.Sf_category citations _Citation.Sf_framecode citations_1 _Citation.Entry_ID 50336 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 32722282 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; Structural Analysis of the SANT/Myb Domain of FLASH and YARP Proteins and Their Complex with the C-Terminal Fragment of NPAT by NMR Spectroscopy and Computer Simulations ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Int. J. Mol. Sci.' _Citation.Journal_name_full 'International journal of molecular sciences' _Citation.Journal_volume 21 _Citation.Journal_issue 15 _Citation.Journal_ASTM . _Citation.Journal_ISSN 1422-0067 _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 5268 _Citation.Page_last 5268 _Citation.Year 2020 _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 Katarzyna Bucholc . . . . 50336 1 2 Aleksandra Skrajna . . . . 50336 1 3 Kinga Adamska . . . . 50336 1 4 Xiao-Cui Yang . . . . 50336 1 5 Krzysztof Krajewski . . . . 50336 1 6 Jaroslaw Poznanski . . . . 50336 1 7 Michal Dadlez . . . . 50336 1 8 Zbigniew Dominski . . . . 50336 1 9 Igor Zhukov . . . . 50336 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'Histone locus body; SANT domain; Myb DNA binding; NMR spectroscopy' 50336 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly_1 _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly_1 _Assembly.Entry_ID 50336 _Assembly.ID 1 _Assembly.Name yarp _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states no _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange no _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 yarp 1 $entity_1 . . yes native no no . . . 50336 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 50336 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity_1 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GEKVVLWTREADRVILTMCQ EQGAQPQTFNIISQQLGNKT PAEVSHRFRELMQLFHTACE A ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 61 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment 'SANT domain' _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 yes UNP Q3T8J9 . 'GON-4-like protein' . . . . . . . . . . . . . . 50336 1 stop_ loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID 'Has transcriptional repressor activity' 50336 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 2149 GLY . 50336 1 2 2150 GLU . 50336 1 3 2151 LYS . 50336 1 4 2152 VAL . 50336 1 5 2153 VAL . 50336 1 6 2154 LEU . 50336 1 7 2155 TRP . 50336 1 8 2156 THR . 50336 1 9 2157 ARG . 50336 1 10 2158 GLU . 50336 1 11 2159 ALA . 50336 1 12 2160 ASP . 50336 1 13 2161 ARG . 50336 1 14 2162 VAL . 50336 1 15 2163 ILE . 50336 1 16 2164 LEU . 50336 1 17 2165 THR . 50336 1 18 2166 MET . 50336 1 19 2167 CYS . 50336 1 20 2168 GLN . 50336 1 21 2169 GLU . 50336 1 22 2170 GLN . 50336 1 23 2171 GLY . 50336 1 24 2172 ALA . 50336 1 25 2173 GLN . 50336 1 26 2174 PRO . 50336 1 27 2175 GLN . 50336 1 28 2176 THR . 50336 1 29 2177 PHE . 50336 1 30 2178 ASN . 50336 1 31 2179 ILE . 50336 1 32 2180 ILE . 50336 1 33 2181 SER . 50336 1 34 2182 GLN . 50336 1 35 2183 GLN . 50336 1 36 2184 LEU . 50336 1 37 2185 GLY . 50336 1 38 2186 ASN . 50336 1 39 2187 LYS . 50336 1 40 2188 THR . 50336 1 41 2189 PRO . 50336 1 42 2190 ALA . 50336 1 43 2191 GLU . 50336 1 44 2192 VAL . 50336 1 45 2193 SER . 50336 1 46 2194 HIS . 50336 1 47 2195 ARG . 50336 1 48 2196 PHE . 50336 1 49 2197 ARG . 50336 1 50 2198 GLU . 50336 1 51 2199 LEU . 50336 1 52 2200 MET . 50336 1 53 2201 GLN . 50336 1 54 2202 LEU . 50336 1 55 2203 PHE . 50336 1 56 2204 HIS . 50336 1 57 2205 THR . 50336 1 58 2206 ALA . 50336 1 59 2207 CYS . 50336 1 60 2208 GLU . 50336 1 61 2209 ALA . 50336 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 50336 1 . GLU 2 2 50336 1 . LYS 3 3 50336 1 . VAL 4 4 50336 1 . VAL 5 5 50336 1 . LEU 6 6 50336 1 . TRP 7 7 50336 1 . THR 8 8 50336 1 . ARG 9 9 50336 1 . GLU 10 10 50336 1 . ALA 11 11 50336 1 . ASP 12 12 50336 1 . ARG 13 13 50336 1 . VAL 14 14 50336 1 . ILE 15 15 50336 1 . LEU 16 16 50336 1 . THR 17 17 50336 1 . MET 18 18 50336 1 . CYS 19 19 50336 1 . GLN 20 20 50336 1 . GLU 21 21 50336 1 . GLN 22 22 50336 1 . GLY 23 23 50336 1 . ALA 24 24 50336 1 . GLN 25 25 50336 1 . PRO 26 26 50336 1 . GLN 27 27 50336 1 . THR 28 28 50336 1 . PHE 29 29 50336 1 . ASN 30 30 50336 1 . ILE 31 31 50336 1 . ILE 32 32 50336 1 . SER 33 33 50336 1 . GLN 34 34 50336 1 . GLN 35 35 50336 1 . LEU 36 36 50336 1 . GLY 37 37 50336 1 . ASN 38 38 50336 1 . LYS 39 39 50336 1 . THR 40 40 50336 1 . PRO 41 41 50336 1 . ALA 42 42 50336 1 . GLU 43 43 50336 1 . VAL 44 44 50336 1 . SER 45 45 50336 1 . HIS 46 46 50336 1 . ARG 47 47 50336 1 . PHE 48 48 50336 1 . ARG 49 49 50336 1 . GLU 50 50 50336 1 . LEU 51 51 50336 1 . MET 52 52 50336 1 . GLN 53 53 50336 1 . LEU 54 54 50336 1 . PHE 55 55 50336 1 . HIS 56 56 50336 1 . THR 57 57 50336 1 . ALA 58 58 50336 1 . CYS 59 59 50336 1 . GLU 60 60 50336 1 . ALA 61 61 50336 1 stop_ save_ #################### # Natural source # #################### save_natural_source_1 _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source_1 _Entity_natural_src_list.Entry_ID 50336 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity_1 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . 50336 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source_1 _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source_1 _Entity_experimental_src_list.Entry_ID 50336 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . plasmid . . pET28a . . . 50336 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 50336 _Sample.ID 1 _Sample.Name yarp_2149 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number 1 _Sample.Solvent_system '25 mM TRIS-d11, 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 YARP '[U-99% 13C; U-99% 15N]' . . 1 $entity_1 . . 0.3 . . mM 0.05 . . . 50336 1 2 YARP '[U-99% 15N]' . . 1 $entity_1 . . 0.3 . . mM 0.05 . . . 50336 1 3 TRIS-d11 'natural abundance' . . . . . . 25 . . mM . . . . 50336 1 4 KCl 'natural abundance' . . . . . . 250 . . mM . . . . 50336 1 5 Arg+Glu 'natural abundance' . . . . . . 50 . . mM . . . . 50336 1 6 TCEP 'natural abundance' . . . . . . 40 . . mM . . . . 50336 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 50336 _Sample_condition_list.ID 1 _Sample_condition_list.Name sample_condition_1 _Sample_condition_list.Details '25 mM TRIS-d11, 90%/10% H2O/D2O, 250 mM KCl, 50 mM Arg+Glu, 40 mM TCEP, pH 6.2' 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' 250 20 mM 50336 1 pH 6.2 0.1 pH 50336 1 pressure 1 . atm 50336 1 temperature 298 0.2 K 50336 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 50336 _Software.ID 1 _Software.Type . _Software.Name NMRPipe _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . processing 50336 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 50336 _Software.ID 2 _Software.Type . _Software.Name NMRFAM-SPARKY _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . 'chemical shift assignment' 50336 2 . 'peak picking' 50336 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 50336 _Software.ID 3 _Software.Type . _Software.Name CYANA _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . 'structure solution' 50336 3 stop_ save_ save_software_4 _Software.Sf_category software _Software.Sf_framecode software_4 _Software.Entry_ID 50336 _Software.ID 4 _Software.Type . _Software.Name YASARA _Software.Version . _Software.DOI . _Software.Details . loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . refinement 50336 4 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID 50336 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name 'Agilent 800' _NMR_spectrometer.Details '1H/13C/15N probehead, z-gradient Performa IV unit' _NMR_spectrometer.Manufacturer Agilent _NMR_spectrometer.Model 'Uniform NMR System' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ ############################# # NMR applied experiments # ############################# save_experiment_list_1 _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list_1 _Experiment_list.Entry_ID 50336 _Experiment_list.ID 1 _Experiment_list.Details ; computing_platform: Linux OpenSuSE 42.3; NanoBioMedical Centre, Adam Mickiewicz University. ; 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 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 50336 1 2 '2D 1H-13C HSQC aliphatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 50336 1 3 '2D 1H-13C HSQC aromatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 50336 1 4 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 50336 1 5 '3D HCACO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 50336 1 6 '3D HN(CO)CA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 50336 1 7 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 50336 1 8 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 50336 1 9 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 50336 1 10 '3D HBHA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 50336 1 11 '3D HCCH-TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 50336 1 12 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 50336 1 13 '3D 1H-13C NOESY aliphatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 50336 1 14 '3D 1H-13C NOESY aromatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 50336 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chem_shift_reference_1 _Chem_shift_reference.Entry_ID 50336 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name yarp_2149 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.0 external indirect 0.251449530 . . . . . 50336 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 external direct 1 . . . . . 50336 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 external indirect 0.101329118 . . . . . 50336 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 50336 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name yarp _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err 0.002 _Assigned_chem_shift_list.Chem_shift_13C_err 0.1 _Assigned_chem_shift_list.Chem_shift_15N_err 0.1 _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 50336 1 2 '2D 1H-13C HSQC aliphatic' . . . 50336 1 3 '2D 1H-13C HSQC aromatic' . . . 50336 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 2 $software_2 . . 50336 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 1 1 GLY H H 1 8.48 0.02 . 1 . . . . . 2149 GLY H . 50336 1 2 . 1 . 1 1 1 GLY HA2 H 1 3.96 0.02 . 2 . . . . . 2149 GLY HA2 . 50336 1 3 . 1 . 1 1 1 GLY HA3 H 1 3.96 0.02 . 2 . . . . . 2149 GLY HA3 . 50336 1 4 . 1 . 1 1 1 GLY C C 13 174.04 0.20 . 1 . . . . . 2149 GLY C . 50336 1 5 . 1 . 1 1 1 GLY CA C 13 45.36 0.20 . 1 . . . . . 2149 GLY CA . 50336 1 6 . 1 . 1 1 1 GLY N N 15 110.47 0.20 . 1 . . . . . 2149 GLY N . 50336 1 7 . 1 . 1 2 2 GLU H H 1 8.19 0.02 . 1 . . . . . 2150 GLU H . 50336 1 8 . 1 . 1 2 2 GLU HA H 1 4.29 0.02 . 1 . . . . . 2150 GLU HA . 50336 1 9 . 1 . 1 2 2 GLU HB2 H 1 2.00 0.02 . 2 . . . . . 2150 GLU HB2 . 50336 1 10 . 1 . 1 2 2 GLU HB3 H 1 2.02 0.02 . 2 . . . . . 2150 GLU HB3 . 50336 1 11 . 1 . 1 2 2 GLU HG2 H 1 2.25 0.02 . 2 . . . . . 2150 GLU HG2 . 50336 1 12 . 1 . 1 2 2 GLU HG3 H 1 2.25 0.02 . 2 . . . . . 2150 GLU HG3 . 50336 1 13 . 1 . 1 2 2 GLU C C 13 176.33 0.20 . 1 . . . . . 2150 GLU C . 50336 1 14 . 1 . 1 2 2 GLU CA C 13 56.41 0.20 . 1 . . . . . 2150 GLU CA . 50336 1 15 . 1 . 1 2 2 GLU CB C 13 30.46 0.20 . 1 . . . . . 2150 GLU CB . 50336 1 16 . 1 . 1 2 2 GLU CG C 13 36.23 0.20 . 1 . . . . . 2150 GLU CG . 50336 1 17 . 1 . 1 2 2 GLU N N 15 120.65 0.20 . 1 . . . . . 2150 GLU N . 50336 1 18 . 1 . 1 3 3 LYS H H 1 8.34 0.02 . 1 . . . . . 2151 LYS H . 50336 1 19 . 1 . 1 3 3 LYS HA H 1 4.30 0.02 . 1 . . . . . 2151 LYS HA . 50336 1 20 . 1 . 1 3 3 LYS HB2 H 1 1.74 0.02 . 2 . . . . . 2151 LYS HB2 . 50336 1 21 . 1 . 1 3 3 LYS HB3 H 1 1.75 0.02 . 2 . . . . . 2151 LYS HB3 . 50336 1 22 . 1 . 1 3 3 LYS HG2 H 1 1.36 0.02 . 2 . . . . . 2151 LYS HG2 . 50336 1 23 . 1 . 1 3 3 LYS HG3 H 1 1.41 0.02 . 2 . . . . . 2151 LYS HG3 . 50336 1 24 . 1 . 1 3 3 LYS HD2 H 1 1.65 0.02 . 2 . . . . . 2151 LYS HD2 . 50336 1 25 . 1 . 1 3 3 LYS HD3 H 1 1.65 0.02 . 2 . . . . . 2151 LYS HD3 . 50336 1 26 . 1 . 1 3 3 LYS HE2 H 1 2.96 0.02 . 2 . . . . . 2151 LYS HE2 . 50336 1 27 . 1 . 1 3 3 LYS HE3 H 1 2.96 0.02 . 2 . . . . . 2151 LYS HE3 . 50336 1 28 . 1 . 1 3 3 LYS C C 13 176.17 0.20 . 1 . . . . . 2151 LYS C . 50336 1 29 . 1 . 1 3 3 LYS CA C 13 56.35 0.20 . 1 . . . . . 2151 LYS CA . 50336 1 30 . 1 . 1 3 3 LYS CB C 13 33.02 0.20 . 1 . . . . . 2151 LYS CB . 50336 1 31 . 1 . 1 3 3 LYS CG C 13 24.81 0.20 . 1 . . . . . 2151 LYS CG . 50336 1 32 . 1 . 1 3 3 LYS CD C 13 29.08 0.20 . 1 . . . . . 2151 LYS CD . 50336 1 33 . 1 . 1 3 3 LYS CE C 13 42.14 0.20 . 1 . . . . . 2151 LYS CE . 50336 1 34 . 1 . 1 3 3 LYS N N 15 122.51 0.20 . 1 . . . . . 2151 LYS N . 50336 1 35 . 1 . 1 4 4 VAL H H 1 8.16 0.02 . 1 . . . . . 2152 VAL H . 50336 1 36 . 1 . 1 4 4 VAL HA H 1 4.06 0.02 . 1 . . . . . 2152 VAL HA . 50336 1 37 . 1 . 1 4 4 VAL HB H 1 1.96 0.02 . 1 . . . . . 2152 VAL HB . 50336 1 38 . 1 . 1 4 4 VAL HG11 H 1 0.84 0.02 . 2 . . . . . 2152 VAL QG1 . 50336 1 39 . 1 . 1 4 4 VAL HG12 H 1 0.84 0.02 . 2 . . . . . 2152 VAL QG1 . 50336 1 40 . 1 . 1 4 4 VAL HG13 H 1 0.84 0.02 . 2 . . . . . 2152 VAL QG1 . 50336 1 41 . 1 . 1 4 4 VAL HG21 H 1 0.86 0.02 . 2 . . . . . 2152 VAL QG2 . 50336 1 42 . 1 . 1 4 4 VAL HG22 H 1 0.86 0.02 . 2 . . . . . 2152 VAL QG2 . 50336 1 43 . 1 . 1 4 4 VAL HG23 H 1 0.86 0.02 . 2 . . . . . 2152 VAL QG2 . 50336 1 44 . 1 . 1 4 4 VAL C C 13 175.66 0.20 . 1 . . . . . 2152 VAL C . 50336 1 45 . 1 . 1 4 4 VAL CA C 13 62.13 0.20 . 1 . . . . . 2152 VAL CA . 50336 1 46 . 1 . 1 4 4 VAL CB C 13 32.83 0.20 . 1 . . . . . 2152 VAL CB . 50336 1 47 . 1 . 1 4 4 VAL CG1 C 13 20.94 0.20 . 1 . . . . . 2152 VAL CG1 . 50336 1 48 . 1 . 1 4 4 VAL CG2 C 13 21.02 0.20 . 1 . . . . . 2152 VAL CG2 . 50336 1 49 . 1 . 1 4 4 VAL N N 15 122.87 0.20 . 1 . . . . . 2152 VAL N . 50336 1 50 . 1 . 1 5 5 VAL H H 1 8.31 0.02 . 1 . . . . . 2153 VAL H . 50336 1 51 . 1 . 1 5 5 VAL HA H 1 4.02 0.02 . 1 . . . . . 2153 VAL HA . 50336 1 52 . 1 . 1 5 5 VAL HB H 1 1.96 0.02 . 1 . . . . . 2153 VAL HB . 50336 1 53 . 1 . 1 5 5 VAL HG11 H 1 0.74 0.02 . 2 . . . . . 2153 VAL QG1 . 50336 1 54 . 1 . 1 5 5 VAL HG12 H 1 0.74 0.02 . 2 . . . . . 2153 VAL QG1 . 50336 1 55 . 1 . 1 5 5 VAL HG13 H 1 0.74 0.02 . 2 . . . . . 2153 VAL QG1 . 50336 1 56 . 1 . 1 5 5 VAL HG21 H 1 0.86 0.02 . 2 . . . . . 2153 VAL QG2 . 50336 1 57 . 1 . 1 5 5 VAL HG22 H 1 0.86 0.02 . 2 . . . . . 2153 VAL QG2 . 50336 1 58 . 1 . 1 5 5 VAL HG23 H 1 0.86 0.02 . 2 . . . . . 2153 VAL QG2 . 50336 1 59 . 1 . 1 5 5 VAL C C 13 175.30 0.20 . 1 . . . . . 2153 VAL C . 50336 1 60 . 1 . 1 5 5 VAL CA C 13 61.96 0.20 . 1 . . . . . 2153 VAL CA . 50336 1 61 . 1 . 1 5 5 VAL CB C 13 32.78 0.20 . 1 . . . . . 2153 VAL CB . 50336 1 62 . 1 . 1 5 5 VAL CG1 C 13 20.91 0.20 . 1 . . . . . 2153 VAL CG1 . 50336 1 63 . 1 . 1 5 5 VAL CG2 C 13 21.35 0.20 . 1 . . . . . 2153 VAL CG2 . 50336 1 64 . 1 . 1 5 5 VAL N N 15 126.17 0.20 . 1 . . . . . 2153 VAL N . 50336 1 65 . 1 . 1 6 6 LEU H H 1 8.32 0.02 . 1 . . . . . 2154 LEU H . 50336 1 66 . 1 . 1 6 6 LEU HA H 1 4.25 0.02 . 1 . . . . . 2154 LEU HA . 50336 1 67 . 1 . 1 6 6 LEU HB2 H 1 1.35 0.02 . 2 . . . . . 2154 LEU HB2 . 50336 1 68 . 1 . 1 6 6 LEU HB3 H 1 1.57 0.02 . 2 . . . . . 2154 LEU HB3 . 50336 1 69 . 1 . 1 6 6 LEU HG H 1 0.86 0.02 . 1 . . . . . 2154 LEU HG . 50336 1 70 . 1 . 1 6 6 LEU HD11 H 1 0.81 0.02 . 2 . . . . . 2154 LEU QD1 . 50336 1 71 . 1 . 1 6 6 LEU HD12 H 1 0.81 0.02 . 2 . . . . . 2154 LEU QD1 . 50336 1 72 . 1 . 1 6 6 LEU HD13 H 1 0.81 0.02 . 2 . . . . . 2154 LEU QD1 . 50336 1 73 . 1 . 1 6 6 LEU HD21 H 1 0.84 0.02 . 2 . . . . . 2154 LEU QD2 . 50336 1 74 . 1 . 1 6 6 LEU HD22 H 1 0.84 0.02 . 2 . . . . . 2154 LEU QD2 . 50336 1 75 . 1 . 1 6 6 LEU HD23 H 1 0.84 0.02 . 2 . . . . . 2154 LEU QD2 . 50336 1 76 . 1 . 1 6 6 LEU C C 13 176.73 0.20 . 1 . . . . . 2154 LEU C . 50336 1 77 . 1 . 1 6 6 LEU CA C 13 55.38 0.20 . 1 . . . . . 2154 LEU CA . 50336 1 78 . 1 . 1 6 6 LEU CB C 13 43.00 0.20 . 1 . . . . . 2154 LEU CB . 50336 1 79 . 1 . 1 6 6 LEU CG C 13 24.78 0.20 . 1 . . . . . 2154 LEU CG . 50336 1 80 . 1 . 1 6 6 LEU CD1 C 13 23.67 0.20 . 1 . . . . . 2154 LEU CD1 . 50336 1 81 . 1 . 1 6 6 LEU CD2 C 13 24.65 0.20 . 1 . . . . . 2154 LEU CD2 . 50336 1 82 . 1 . 1 6 6 LEU N N 15 127.15 0.20 . 1 . . . . . 2154 LEU N . 50336 1 83 . 1 . 1 7 7 TRP H H 1 8.22 0.02 . 1 . . . . . 2155 TRP H . 50336 1 84 . 1 . 1 7 7 TRP HA H 1 4.77 0.02 . 1 . . . . . 2155 TRP HA . 50336 1 85 . 1 . 1 7 7 TRP HB2 H 1 2.89 0.02 . 2 . . . . . 2155 TRP HB2 . 50336 1 86 . 1 . 1 7 7 TRP HB3 H 1 3.44 0.02 . 2 . . . . . 2155 TRP HB3 . 50336 1 87 . 1 . 1 7 7 TRP HD1 H 1 7.22 0.02 . 1 . . . . . 2155 TRP HD1 . 50336 1 88 . 1 . 1 7 7 TRP HE1 H 1 10.09 0.02 . 1 . . . . . 2155 TRP HE1 . 50336 1 89 . 1 . 1 7 7 TRP HE3 H 1 7.14 0.02 . 1 . . . . . 2155 TRP HE3 . 50336 1 90 . 1 . 1 7 7 TRP HZ2 H 1 7.34 0.02 . 1 . . . . . 2155 TRP HZ2 . 50336 1 91 . 1 . 1 7 7 TRP HZ3 H 1 7.34 0.02 . 1 . . . . . 2155 TRP HZ3 . 50336 1 92 . 1 . 1 7 7 TRP HH2 H 1 6.62 0.02 . 1 . . . . . 2155 TRP HH2 . 50336 1 93 . 1 . 1 7 7 TRP C C 13 176.35 0.20 . 1 . . . . . 2155 TRP C . 50336 1 94 . 1 . 1 7 7 TRP CA C 13 55.85 0.20 . 1 . . . . . 2155 TRP CA . 50336 1 95 . 1 . 1 7 7 TRP CB C 13 31.03 0.20 . 1 . . . . . 2155 TRP CB . 50336 1 96 . 1 . 1 7 7 TRP CD1 C 13 127.39 0.20 . 1 . . . . . 2155 TRP CD1 . 50336 1 97 . 1 . 1 7 7 TRP CE3 C 13 119.92 0.20 . 1 . . . . . 2155 TRP CE3 . 50336 1 98 . 1 . 1 7 7 TRP CZ2 C 13 115.20 0.20 . 1 . . . . . 2155 TRP CZ2 . 50336 1 99 . 1 . 1 7 7 TRP CZ3 C 13 121.62 0.20 . 1 . . . . . 2155 TRP CZ3 . 50336 1 100 . 1 . 1 7 7 TRP CH2 C 13 122.12 0.20 . 1 . . . . . 2155 TRP CH2 . 50336 1 101 . 1 . 1 7 7 TRP N N 15 122.11 0.20 . 1 . . . . . 2155 TRP N . 50336 1 102 . 1 . 1 7 7 TRP NE1 N 15 128.68 0.20 . 1 . . . . . 2155 TRP NE1 . 50336 1 103 . 1 . 1 8 8 THR H H 1 8.10 0.02 . 1 . . . . . 2156 THR H . 50336 1 104 . 1 . 1 8 8 THR HA H 1 4.53 0.02 . 1 . . . . . 2156 THR HA . 50336 1 105 . 1 . 1 8 8 THR HB H 1 4.83 0.02 . 1 . . . . . 2156 THR HB . 50336 1 106 . 1 . 1 8 8 THR HG1 H 1 4.53 0.02 . 1 . . . . . 2156 THR HG1 . 50336 1 107 . 1 . 1 8 8 THR HG21 H 1 1.32 0.02 . 1 . . . . . 2156 THR QG2 . 50336 1 108 . 1 . 1 8 8 THR HG22 H 1 1.32 0.02 . 1 . . . . . 2156 THR QG2 . 50336 1 109 . 1 . 1 8 8 THR HG23 H 1 1.32 0.02 . 1 . . . . . 2156 THR QG2 . 50336 1 110 . 1 . 1 8 8 THR C C 13 174.78 0.20 . 1 . . . . . 2156 THR C . 50336 1 111 . 1 . 1 8 8 THR CA C 13 60.12 0.20 . 1 . . . . . 2156 THR CA . 50336 1 112 . 1 . 1 8 8 THR CB C 13 71.25 0.20 . 1 . . . . . 2156 THR CB . 50336 1 113 . 1 . 1 8 8 THR CG2 C 13 22.05 0.20 . 1 . . . . . 2156 THR CG2 . 50336 1 114 . 1 . 1 8 8 THR N N 15 114.80 0.20 . 1 . . . . . 2156 THR N . 50336 1 115 . 1 . 1 9 9 ARG H H 1 8.91 0.02 . 1 . . . . . 2157 ARG H . 50336 1 116 . 1 . 1 9 9 ARG HA H 1 4.14 0.02 . 1 . . . . . 2157 ARG HA . 50336 1 117 . 1 . 1 9 9 ARG HB2 H 1 1.90 0.02 . 2 . . . . . 2157 ARG HB2 . 50336 1 118 . 1 . 1 9 9 ARG HB3 H 1 1.94 0.02 . 2 . . . . . 2157 ARG HB3 . 50336 1 119 . 1 . 1 9 9 ARG HG2 H 1 1.78 0.02 . 2 . . . . . 2157 ARG HG2 . 50336 1 120 . 1 . 1 9 9 ARG HG3 H 1 1.78 0.02 . 2 . . . . . 2157 ARG HG3 . 50336 1 121 . 1 . 1 9 9 ARG HD2 H 1 3.27 0.02 . 2 . . . . . 2157 ARG HD2 . 50336 1 122 . 1 . 1 9 9 ARG HD3 H 1 3.29 0.02 . 2 . . . . . 2157 ARG HD3 . 50336 1 123 . 1 . 1 9 9 ARG HE H 1 3.26 0.02 . 1 . . . . . 2157 ARG HE . 50336 1 124 . 1 . 1 9 9 ARG C C 13 179.46 0.20 . 1 . . . . . 2157 ARG C . 50336 1 125 . 1 . 1 9 9 ARG CA C 13 59.17 0.20 . 1 . . . . . 2157 ARG CA . 50336 1 126 . 1 . 1 9 9 ARG CB C 13 30.00 0.20 . 1 . . . . . 2157 ARG CB . 50336 1 127 . 1 . 1 9 9 ARG CG C 13 27.30 0.20 . 1 . . . . . 2157 ARG CG . 50336 1 128 . 1 . 1 9 9 ARG CD C 13 43.38 0.20 . 1 . . . . . 2157 ARG CD . 50336 1 129 . 1 . 1 9 9 ARG N N 15 121.24 0.20 . 1 . . . . . 2157 ARG N . 50336 1 130 . 1 . 1 10 10 GLU H H 1 8.60 0.02 . 1 . . . . . 2158 GLU H . 50336 1 131 . 1 . 1 10 10 GLU HA H 1 4.11 0.02 . 1 . . . . . 2158 GLU HA . 50336 1 132 . 1 . 1 10 10 GLU HB2 H 1 2.10 0.02 . 2 . . . . . 2158 GLU HB2 . 50336 1 133 . 1 . 1 10 10 GLU HB3 H 1 2.39 0.02 . 2 . . . . . 2158 GLU HB3 . 50336 1 134 . 1 . 1 10 10 GLU HG2 H 1 2.25 0.02 . 2 . . . . . 2158 GLU HG2 . 50336 1 135 . 1 . 1 10 10 GLU HG3 H 1 2.42 0.02 . 2 . . . . . 2158 GLU HG3 . 50336 1 136 . 1 . 1 10 10 GLU C C 13 178.21 0.20 . 1 . . . . . 2158 GLU C . 50336 1 137 . 1 . 1 10 10 GLU CA C 13 59.71 0.20 . 1 . . . . . 2158 GLU CA . 50336 1 138 . 1 . 1 10 10 GLU CB C 13 29.31 0.20 . 1 . . . . . 2158 GLU CB . 50336 1 139 . 1 . 1 10 10 GLU CG C 13 36.41 0.20 . 1 . . . . . 2158 GLU CG . 50336 1 140 . 1 . 1 10 10 GLU N N 15 118.50 0.20 . 1 . . . . . 2158 GLU N . 50336 1 141 . 1 . 1 11 11 ALA H H 1 8.00 0.02 . 1 . . . . . 2159 ALA H . 50336 1 142 . 1 . 1 11 11 ALA HA H 1 4.13 0.02 . 1 . . . . . 2159 ALA HA . 50336 1 143 . 1 . 1 11 11 ALA HB1 H 1 1.81 0.02 . 1 . . . . . 2159 ALA HB . 50336 1 144 . 1 . 1 11 11 ALA HB2 H 1 1.81 0.02 . 1 . . . . . 2159 ALA HB . 50336 1 145 . 1 . 1 11 11 ALA HB3 H 1 1.81 0.02 . 1 . . . . . 2159 ALA HB . 50336 1 146 . 1 . 1 11 11 ALA C C 13 176.22 0.20 . 1 . . . . . 2159 ALA C . 50336 1 147 . 1 . 1 11 11 ALA CA C 13 55.55 0.20 . 1 . . . . . 2159 ALA CA . 50336 1 148 . 1 . 1 11 11 ALA CB C 13 19.24 0.20 . 1 . . . . . 2159 ALA CB . 50336 1 149 . 1 . 1 11 11 ALA N N 15 123.73 0.20 . 1 . . . . . 2159 ALA N . 50336 1 150 . 1 . 1 12 12 ASP H H 1 8.10 0.02 . 1 . . . . . 2160 ASP H . 50336 1 151 . 1 . 1 12 12 ASP HA H 1 4.32 0.02 . 1 . . . . . 2160 ASP HA . 50336 1 152 . 1 . 1 12 12 ASP HB2 H 1 2.38 0.02 . 2 . . . . . 2160 ASP HB2 . 50336 1 153 . 1 . 1 12 12 ASP HB3 H 1 2.75 0.02 . 2 . . . . . 2160 ASP HB3 . 50336 1 154 . 1 . 1 12 12 ASP C C 13 178.48 0.20 . 1 . . . . . 2160 ASP C . 50336 1 155 . 1 . 1 12 12 ASP CA C 13 57.45 0.20 . 1 . . . . . 2160 ASP CA . 50336 1 156 . 1 . 1 12 12 ASP CB C 13 40.50 0.20 . 1 . . . . . 2160 ASP CB . 50336 1 157 . 1 . 1 12 12 ASP N N 15 118.14 0.20 . 1 . . . . . 2160 ASP N . 50336 1 158 . 1 . 1 13 13 ARG H H 1 8.00 0.02 . 1 . . . . . 2161 ARG H . 50336 1 159 . 1 . 1 13 13 ARG HA H 1 4.08 0.02 . 1 . . . . . 2161 ARG HA . 50336 1 160 . 1 . 1 13 13 ARG HB2 H 1 1.96 0.02 . 2 . . . . . 2161 ARG HB2 . 50336 1 161 . 1 . 1 13 13 ARG HB3 H 1 2.04 0.02 . 2 . . . . . 2161 ARG HB3 . 50336 1 162 . 1 . 1 13 13 ARG HG2 H 1 1.64 0.02 . 2 . . . . . 2161 ARG HG2 . 50336 1 163 . 1 . 1 13 13 ARG HG3 H 1 1.68 0.02 . 2 . . . . . 2161 ARG HG3 . 50336 1 164 . 1 . 1 13 13 ARG HD2 H 1 3.20 0.02 . 2 . . . . . 2161 ARG HD2 . 50336 1 165 . 1 . 1 13 13 ARG HD3 H 1 3.21 0.02 . 2 . . . . . 2161 ARG HD3 . 50336 1 166 . 1 . 1 13 13 ARG HE H 1 4.07 0.02 . 1 . . . . . 2161 ARG HE . 50336 1 167 . 1 . 1 13 13 ARG C C 13 179.91 0.20 . 1 . . . . . 2161 ARG C . 50336 1 168 . 1 . 1 13 13 ARG CA C 13 59.59 0.20 . 1 . . . . . 2161 ARG CA . 50336 1 169 . 1 . 1 13 13 ARG CB C 13 29.84 0.20 . 1 . . . . . 2161 ARG CB . 50336 1 170 . 1 . 1 13 13 ARG CG C 13 27.13 0.20 . 1 . . . . . 2161 ARG CG . 50336 1 171 . 1 . 1 13 13 ARG CD C 13 43.39 0.20 . 1 . . . . . 2161 ARG CD . 50336 1 172 . 1 . 1 13 13 ARG N N 15 118.57 0.20 . 1 . . . . . 2161 ARG N . 50336 1 173 . 1 . 1 14 14 VAL H H 1 8.10 0.02 . 1 . . . . . 2162 VAL H . 50336 1 174 . 1 . 1 14 14 VAL HA H 1 3.61 0.02 . 1 . . . . . 2162 VAL HA . 50336 1 175 . 1 . 1 14 14 VAL HB H 1 2.43 0.02 . 1 . . . . . 2162 VAL HB . 50336 1 176 . 1 . 1 14 14 VAL HG11 H 1 0.96 0.02 . 2 . . . . . 2162 VAL QG1 . 50336 1 177 . 1 . 1 14 14 VAL HG12 H 1 0.96 0.02 . 2 . . . . . 2162 VAL QG1 . 50336 1 178 . 1 . 1 14 14 VAL HG13 H 1 0.96 0.02 . 2 . . . . . 2162 VAL QG1 . 50336 1 179 . 1 . 1 14 14 VAL HG21 H 1 1.12 0.02 . 2 . . . . . 2162 VAL QG2 . 50336 1 180 . 1 . 1 14 14 VAL HG22 H 1 1.12 0.02 . 2 . . . . . 2162 VAL QG2 . 50336 1 181 . 1 . 1 14 14 VAL HG23 H 1 1.12 0.02 . 2 . . . . . 2162 VAL QG2 . 50336 1 182 . 1 . 1 14 14 VAL C C 13 177.68 0.20 . 1 . . . . . 2162 VAL C . 50336 1 183 . 1 . 1 14 14 VAL CA C 13 67.21 0.20 . 1 . . . . . 2162 VAL CA . 50336 1 184 . 1 . 1 14 14 VAL CB C 13 31.65 0.20 . 1 . . . . . 2162 VAL CB . 50336 1 185 . 1 . 1 14 14 VAL CG1 C 13 21.85 0.20 . 1 . . . . . 2162 VAL CG1 . 50336 1 186 . 1 . 1 14 14 VAL CG2 C 13 22.91 0.20 . 1 . . . . . 2162 VAL CG2 . 50336 1 187 . 1 . 1 14 14 VAL N N 15 123.25 0.20 . 1 . . . . . 2162 VAL N . 50336 1 188 . 1 . 1 15 15 ILE H H 1 8.17 0.02 . 1 . . . . . 2163 ILE H . 50336 1 189 . 1 . 1 15 15 ILE HA H 1 3.62 0.02 . 1 . . . . . 2163 ILE HA . 50336 1 190 . 1 . 1 15 15 ILE HB H 1 2.11 0.02 . 1 . . . . . 2163 ILE HB . 50336 1 191 . 1 . 1 15 15 ILE HG12 H 1 0.98 0.02 . 2 . . . . . 2163 ILE HG12 . 50336 1 192 . 1 . 1 15 15 ILE HG13 H 1 2.22 0.02 . 2 . . . . . 2163 ILE HG13 . 50336 1 193 . 1 . 1 15 15 ILE HG21 H 1 0.77 0.02 . 1 . . . . . 2163 ILE QG2 . 50336 1 194 . 1 . 1 15 15 ILE HG22 H 1 0.77 0.02 . 1 . . . . . 2163 ILE QG2 . 50336 1 195 . 1 . 1 15 15 ILE HG23 H 1 0.77 0.02 . 1 . . . . . 2163 ILE QG2 . 50336 1 196 . 1 . 1 15 15 ILE HD11 H 1 0.77 0.02 . 1 . . . . . 2163 ILE QD1 . 50336 1 197 . 1 . 1 15 15 ILE HD12 H 1 0.77 0.02 . 1 . . . . . 2163 ILE QD1 . 50336 1 198 . 1 . 1 15 15 ILE HD13 H 1 0.77 0.02 . 1 . . . . . 2163 ILE QD1 . 50336 1 199 . 1 . 1 15 15 ILE C C 13 178.09 0.20 . 1 . . . . . 2163 ILE C . 50336 1 200 . 1 . 1 15 15 ILE CA C 13 66.15 0.20 . 1 . . . . . 2163 ILE CA . 50336 1 201 . 1 . 1 15 15 ILE CB C 13 38.44 0.20 . 1 . . . . . 2163 ILE CB . 50336 1 202 . 1 . 1 15 15 ILE CG1 C 13 29.98 0.20 . 1 . . . . . 2163 ILE CG1 . 50336 1 203 . 1 . 1 15 15 ILE CG2 C 13 14.74 0.20 . 1 . . . . . 2163 ILE CG2 . 50336 1 204 . 1 . 1 15 15 ILE CD1 C 13 14.74 0.20 . 1 . . . . . 2163 ILE CD1 . 50336 1 205 . 1 . 1 15 15 ILE N N 15 118.35 0.20 . 1 . . . . . 2163 ILE N . 50336 1 206 . 1 . 1 16 16 LEU H H 1 8.48 0.02 . 1 . . . . . 2164 LEU H . 50336 1 207 . 1 . 1 16 16 LEU HA H 1 4.05 0.02 . 1 . . . . . 2164 LEU HA . 50336 1 208 . 1 . 1 16 16 LEU HB2 H 1 1.86 0.02 . 2 . . . . . 2164 LEU HB2 . 50336 1 209 . 1 . 1 16 16 LEU HB3 H 1 1.51 0.02 . 2 . . . . . 2164 LEU HB3 . 50336 1 210 . 1 . 1 16 16 LEU HG H 1 1.86 0.02 . 1 . . . . . 2164 LEU HG . 50336 1 211 . 1 . 1 16 16 LEU HD11 H 1 0.84 0.02 . 2 . . . . . 2164 LEU QD1 . 50336 1 212 . 1 . 1 16 16 LEU HD12 H 1 0.84 0.02 . 2 . . . . . 2164 LEU QD1 . 50336 1 213 . 1 . 1 16 16 LEU HD13 H 1 0.84 0.02 . 2 . . . . . 2164 LEU QD1 . 50336 1 214 . 1 . 1 16 16 LEU HD21 H 1 0.85 0.02 . 2 . . . . . 2164 LEU QD2 . 50336 1 215 . 1 . 1 16 16 LEU HD22 H 1 0.85 0.02 . 2 . . . . . 2164 LEU QD2 . 50336 1 216 . 1 . 1 16 16 LEU HD23 H 1 0.85 0.02 . 2 . . . . . 2164 LEU QD2 . 50336 1 217 . 1 . 1 16 16 LEU C C 13 180.25 0.20 . 1 . . . . . 2164 LEU C . 50336 1 218 . 1 . 1 16 16 LEU CA C 13 58.53 0.20 . 1 . . . . . 2164 LEU CA . 50336 1 219 . 1 . 1 16 16 LEU CB C 13 41.96 0.20 . 1 . . . . . 2164 LEU CB . 50336 1 220 . 1 . 1 16 16 LEU CG C 13 26.71 0.20 . 1 . . . . . 2164 LEU CG . 50336 1 221 . 1 . 1 16 16 LEU CD1 C 13 22.97 0.20 . 1 . . . . . 2164 LEU CD1 . 50336 1 222 . 1 . 1 16 16 LEU CD2 C 13 25.39 0.20 . 1 . . . . . 2164 LEU CD2 . 50336 1 223 . 1 . 1 16 16 LEU N N 15 117.57 0.20 . 1 . . . . . 2164 LEU N . 50336 1 224 . 1 . 1 17 17 THR H H 1 8.58 0.02 . 1 . . . . . 2165 THR H . 50336 1 225 . 1 . 1 17 17 THR HA H 1 3.98 0.02 . 1 . . . . . 2165 THR HA . 50336 1 226 . 1 . 1 17 17 THR HB H 1 4.20 0.02 . 1 . . . . . 2165 THR HB . 50336 1 227 . 1 . 1 17 17 THR HG1 H 1 3.64 0.02 . 1 . . . . . 2165 THR HG1 . 50336 1 228 . 1 . 1 17 17 THR HG21 H 1 1.26 0.02 . 1 . . . . . 2165 THR QG2 . 50336 1 229 . 1 . 1 17 17 THR HG22 H 1 1.26 0.02 . 1 . . . . . 2165 THR QG2 . 50336 1 230 . 1 . 1 17 17 THR HG23 H 1 1.26 0.02 . 1 . . . . . 2165 THR QG2 . 50336 1 231 . 1 . 1 17 17 THR C C 13 174.49 0.20 . 1 . . . . . 2165 THR C . 50336 1 232 . 1 . 1 17 17 THR CA C 13 66.46 0.20 . 1 . . . . . 2165 THR CA . 50336 1 233 . 1 . 1 17 17 THR CB C 13 69.14 0.20 . 1 . . . . . 2165 THR CB . 50336 1 234 . 1 . 1 17 17 THR CG2 C 13 21.49 0.20 . 1 . . . . . 2165 THR CG2 . 50336 1 235 . 1 . 1 17 17 THR N N 15 114.21 0.20 . 1 . . . . . 2165 THR N . 50336 1 236 . 1 . 1 18 18 MET H H 1 8.59 0.02 . 1 . . . . . 2166 MET H . 50336 1 237 . 1 . 1 18 18 MET HA H 1 4.28 0.02 . 1 . . . . . 2166 MET HA . 50336 1 238 . 1 . 1 18 18 MET HB2 H 1 1.63 0.02 . 2 . . . . . 2166 MET HB2 . 50336 1 239 . 1 . 1 18 18 MET HB3 H 1 2.18 0.02 . 2 . . . . . 2166 MET HB3 . 50336 1 240 . 1 . 1 18 18 MET HG2 H 1 2.55 0.02 . 2 . . . . . 2166 MET HG2 . 50336 1 241 . 1 . 1 18 18 MET HG3 H 1 2.78 0.02 . 2 . . . . . 2166 MET HG3 . 50336 1 242 . 1 . 1 18 18 MET HE1 H 1 0.96 0.02 . 1 . . . . . 2166 MET HE . 50336 1 243 . 1 . 1 18 18 MET HE2 H 1 0.96 0.02 . 1 . . . . . 2166 MET HE . 50336 1 244 . 1 . 1 18 18 MET HE3 H 1 0.96 0.02 . 1 . . . . . 2166 MET HE . 50336 1 245 . 1 . 1 18 18 MET C C 13 179.31 0.20 . 1 . . . . . 2166 MET C . 50336 1 246 . 1 . 1 18 18 MET CA C 13 59.26 0.20 . 1 . . . . . 2166 MET CA . 50336 1 247 . 1 . 1 18 18 MET CB C 13 31.63 0.20 . 1 . . . . . 2166 MET CB . 50336 1 248 . 1 . 1 18 18 MET CG C 13 33.73 0.20 . 1 . . . . . 2166 MET CG . 50336 1 249 . 1 . 1 18 18 MET CE C 13 21.93 0.20 . 1 . . . . . 2166 MET CE . 50336 1 250 . 1 . 1 18 18 MET N N 15 120.41 0.20 . 1 . . . . . 2166 MET N . 50336 1 251 . 1 . 1 19 19 CYS H H 1 8.22 0.02 . 1 . . . . . 2167 CYS H . 50336 1 252 . 1 . 1 19 19 CYS HA H 1 3.91 0.02 . 1 . . . . . 2167 CYS HA . 50336 1 253 . 1 . 1 19 19 CYS HB2 H 1 2.08 0.02 . 2 . . . . . 2167 CYS HB2 . 50336 1 254 . 1 . 1 19 19 CYS HB3 H 1 2.87 0.02 . 2 . . . . . 2167 CYS HB3 . 50336 1 255 . 1 . 1 19 19 CYS HG H 1 2.87 0.02 . 1 . . . . . 2167 CYS HG . 50336 1 256 . 1 . 1 19 19 CYS C C 13 177.59 0.20 . 1 . . . . . 2167 CYS C . 50336 1 257 . 1 . 1 19 19 CYS CA C 13 63.78 0.20 . 1 . . . . . 2167 CYS CA . 50336 1 258 . 1 . 1 19 19 CYS CB C 13 27.25 0.20 . 1 . . . . . 2167 CYS CB . 50336 1 259 . 1 . 1 19 19 CYS N N 15 115.84 0.20 . 1 . . . . . 2167 CYS N . 50336 1 260 . 1 . 1 20 20 GLN H H 1 7.91 0.02 . 1 . . . . . 2168 GLN H . 50336 1 261 . 1 . 1 20 20 GLN HA H 1 4.09 0.02 . 1 . . . . . 2168 GLN HA . 50336 1 262 . 1 . 1 20 20 GLN HB2 H 1 2.23 0.02 . 2 . . . . . 2168 GLN HB2 . 50336 1 263 . 1 . 1 20 20 GLN HB3 H 1 2.25 0.02 . 2 . . . . . 2168 GLN HB3 . 50336 1 264 . 1 . 1 20 20 GLN HG2 H 1 2.41 0.02 . 2 . . . . . 2168 GLN HG2 . 50336 1 265 . 1 . 1 20 20 GLN HG3 H 1 2.50 0.02 . 2 . . . . . 2168 GLN HG3 . 50336 1 266 . 1 . 1 20 20 GLN HE21 H 1 7.29 0.02 . 2 . . . . . 2168 GLN HE21 . 50336 1 267 . 1 . 1 20 20 GLN HE22 H 1 7.29 0.02 . 2 . . . . . 2168 GLN HE22 . 50336 1 268 . 1 . 1 20 20 GLN C C 13 177.53 0.20 . 1 . . . . . 2168 GLN C . 50336 1 269 . 1 . 1 20 20 GLN CA C 13 59.04 0.20 . 1 . . . . . 2168 GLN CA . 50336 1 270 . 1 . 1 20 20 GLN CB C 13 28.48 0.20 . 1 . . . . . 2168 GLN CB . 50336 1 271 . 1 . 1 20 20 GLN CG C 13 34.04 0.20 . 1 . . . . . 2168 GLN CG . 50336 1 272 . 1 . 1 20 20 GLN N N 15 120.26 0.20 . 1 . . . . . 2168 GLN N . 50336 1 273 . 1 . 1 20 20 GLN NE2 N 15 119.00 0.20 . 1 . . . . . 2168 GLN NE2 . 50336 1 274 . 1 . 1 21 21 GLU H H 1 7.90 0.02 . 1 . . . . . 2169 GLU H . 50336 1 275 . 1 . 1 21 21 GLU HA H 1 4.12 0.02 . 1 . . . . . 2169 GLU HA . 50336 1 276 . 1 . 1 21 21 GLU HB2 H 1 2.11 0.02 . 2 . . . . . 2169 GLU HB2 . 50336 1 277 . 1 . 1 21 21 GLU HB3 H 1 2.12 0.02 . 2 . . . . . 2169 GLU HB3 . 50336 1 278 . 1 . 1 21 21 GLU HG2 H 1 2.50 0.02 . 2 . . . . . 2169 GLU HG2 . 50336 1 279 . 1 . 1 21 21 GLU HG3 H 1 2.50 0.02 . 2 . . . . . 2169 GLU HG3 . 50336 1 280 . 1 . 1 21 21 GLU C C 13 178.32 0.20 . 1 . . . . . 2169 GLU C . 50336 1 281 . 1 . 1 21 21 GLU CA C 13 58.99 0.20 . 1 . . . . . 2169 GLU CA . 50336 1 282 . 1 . 1 21 21 GLU CB C 13 30.82 0.20 . 1 . . . . . 2169 GLU CB . 50336 1 283 . 1 . 1 21 21 GLU CG C 13 36.36 0.20 . 1 . . . . . 2169 GLU CG . 50336 1 284 . 1 . 1 21 21 GLU N N 15 116.89 0.20 . 1 . . . . . 2169 GLU N . 50336 1 285 . 1 . 1 22 22 GLN H H 1 8.38 0.02 . 1 . . . . . 2170 GLN H . 50336 1 286 . 1 . 1 22 22 GLN HA H 1 4.49 0.02 . 1 . . . . . 2170 GLN HA . 50336 1 287 . 1 . 1 22 22 GLN HB2 H 1 1.88 0.02 . 2 . . . . . 2170 GLN HB2 . 50336 1 288 . 1 . 1 22 22 GLN HB3 H 1 2.34 0.02 . 2 . . . . . 2170 GLN HB3 . 50336 1 289 . 1 . 1 22 22 GLN HG2 H 1 2.34 0.02 . 2 . . . . . 2170 GLN HG2 . 50336 1 290 . 1 . 1 22 22 GLN HG3 H 1 2.34 0.02 . 2 . . . . . 2170 GLN HG3 . 50336 1 291 . 1 . 1 22 22 GLN HE21 H 1 7.34 0.02 . 2 . . . . . 2170 GLN HE21 . 50336 1 292 . 1 . 1 22 22 GLN HE22 H 1 7.34 0.02 . 2 . . . . . 2170 GLN HE22 . 50336 1 293 . 1 . 1 22 22 GLN C C 13 176.41 0.20 . 1 . . . . . 2170 GLN C . 50336 1 294 . 1 . 1 22 22 GLN CA C 13 55.91 0.20 . 1 . . . . . 2170 GLN CA . 50336 1 295 . 1 . 1 22 22 GLN CB C 13 30.42 0.20 . 1 . . . . . 2170 GLN CB . 50336 1 296 . 1 . 1 22 22 GLN CG C 13 34.04 0.20 . 1 . . . . . 2170 GLN CG . 50336 1 297 . 1 . 1 22 22 GLN N N 15 113.66 0.20 . 1 . . . . . 2170 GLN N . 50336 1 298 . 1 . 1 22 22 GLN NE2 N 15 109.36 0.20 . 1 . . . . . 2170 GLN NE2 . 50336 1 299 . 1 . 1 23 23 GLY H H 1 7.34 0.02 . 1 . . . . . 2171 GLY H . 50336 1 300 . 1 . 1 23 23 GLY HA2 H 1 4.27 0.02 . 2 . . . . . 2171 GLY HA2 . 50336 1 301 . 1 . 1 23 23 GLY HA3 H 1 3.68 0.02 . 2 . . . . . 2171 GLY HA3 . 50336 1 302 . 1 . 1 23 23 GLY C C 13 173.33 0.20 . 1 . . . . . 2171 GLY C . 50336 1 303 . 1 . 1 23 23 GLY CA C 13 44.43 0.20 . 1 . . . . . 2171 GLY CA . 50336 1 304 . 1 . 1 23 23 GLY N N 15 109.36 0.20 . 1 . . . . . 2171 GLY N . 50336 1 305 . 1 . 1 24 24 ALA H H 1 8.47 0.02 . 1 . . . . . 2172 ALA H . 50336 1 306 . 1 . 1 24 24 ALA HA H 1 3.88 0.02 . 1 . . . . . 2172 ALA HA . 50336 1 307 . 1 . 1 24 24 ALA HB1 H 1 0.90 0.02 . 1 . . . . . 2172 ALA HB . 50336 1 308 . 1 . 1 24 24 ALA HB2 H 1 0.90 0.02 . 1 . . . . . 2172 ALA HB . 50336 1 309 . 1 . 1 24 24 ALA HB3 H 1 0.90 0.02 . 1 . . . . . 2172 ALA HB . 50336 1 310 . 1 . 1 24 24 ALA C C 13 174.43 0.20 . 1 . . . . . 2172 ALA C . 50336 1 311 . 1 . 1 24 24 ALA CA C 13 50.82 0.20 . 1 . . . . . 2172 ALA CA . 50336 1 312 . 1 . 1 24 24 ALA CB C 13 17.64 0.20 . 1 . . . . . 2172 ALA CB . 50336 1 313 . 1 . 1 24 24 ALA N N 15 126.94 0.20 . 1 . . . . . 2172 ALA N . 50336 1 314 . 1 . 1 25 25 GLN H H 1 6.44 0.02 . 1 . . . . . 2173 GLN H . 50336 1 315 . 1 . 1 25 25 GLN HA H 1 4.65 0.02 . 1 . . . . . 2173 GLN HA . 50336 1 316 . 1 . 1 25 25 GLN HB2 H 1 1.80 0.02 . 2 . . . . . 2173 GLN HB2 . 50336 1 317 . 1 . 1 25 25 GLN HB3 H 1 2.20 0.02 . 2 . . . . . 2173 GLN HB3 . 50336 1 318 . 1 . 1 25 25 GLN HG2 H 1 2.10 0.02 . 2 . . . . . 2173 GLN HG2 . 50336 1 319 . 1 . 1 25 25 GLN HG3 H 1 2.11 0.02 . 2 . . . . . 2173 GLN HG3 . 50336 1 320 . 1 . 1 25 25 GLN HE21 H 1 7.48 0.02 . 2 . . . . . 2173 GLN HE21 . 50336 1 321 . 1 . 1 25 25 GLN HE22 H 1 7.48 0.02 . 2 . . . . . 2173 GLN HE22 . 50336 1 322 . 1 . 1 25 25 GLN CA C 13 52.50 0.20 . 1 . . . . . 2173 GLN CA . 50336 1 323 . 1 . 1 25 25 GLN CB C 13 28.74 0.20 . 1 . . . . . 2173 GLN CB . 50336 1 324 . 1 . 1 25 25 GLN CG C 13 32.39 0.20 . 1 . . . . . 2173 GLN CG . 50336 1 325 . 1 . 1 25 25 GLN N N 15 119.73 0.20 . 1 . . . . . 2173 GLN N . 50336 1 326 . 1 . 1 25 25 GLN NE2 N 15 116.47 0.20 . 1 . . . . . 2173 GLN NE2 . 50336 1 327 . 1 . 1 26 26 PRO HA H 1 4.27 0.02 . 1 . . . . . 2174 PRO HA . 50336 1 328 . 1 . 1 26 26 PRO HB2 H 1 1.96 0.02 . 2 . . . . . 2174 PRO HB2 . 50336 1 329 . 1 . 1 26 26 PRO HB3 H 1 2.26 0.02 . 2 . . . . . 2174 PRO HB3 . 50336 1 330 . 1 . 1 26 26 PRO HG2 H 1 2.01 0.02 . 2 . . . . . 2174 PRO HG2 . 50336 1 331 . 1 . 1 26 26 PRO HG3 H 1 2.02 0.02 . 2 . . . . . 2174 PRO HG3 . 50336 1 332 . 1 . 1 26 26 PRO HD2 H 1 3.85 0.02 . 2 . . . . . 2174 PRO HD2 . 50336 1 333 . 1 . 1 26 26 PRO HD3 H 1 3.63 0.02 . 2 . . . . . 2174 PRO HD3 . 50336 1 334 . 1 . 1 26 26 PRO C C 13 178.31 0.20 . 1 . . . . . 2174 PRO C . 50336 1 335 . 1 . 1 26 26 PRO CA C 13 66.93 0.20 . 1 . . . . . 2174 PRO CA . 50336 1 336 . 1 . 1 26 26 PRO CB C 13 32.13 0.20 . 1 . . . . . 2174 PRO CB . 50336 1 337 . 1 . 1 26 26 PRO CG C 13 27.59 0.20 . 1 . . . . . 2174 PRO CG . 50336 1 338 . 1 . 1 26 26 PRO CD C 13 51.09 0.20 . 1 . . . . . 2174 PRO CD . 50336 1 339 . 1 . 1 27 27 GLN H H 1 9.01 0.02 . 1 . . . . . 2175 GLN H . 50336 1 340 . 1 . 1 27 27 GLN HA H 1 4.15 0.02 . 1 . . . . . 2175 GLN HA . 50336 1 341 . 1 . 1 27 27 GLN HB2 H 1 2.08 0.02 . 2 . . . . . 2175 GLN HB2 . 50336 1 342 . 1 . 1 27 27 GLN HB3 H 1 2.10 0.02 . 2 . . . . . 2175 GLN HB3 . 50336 1 343 . 1 . 1 27 27 GLN HG2 H 1 2.40 0.02 . 2 . . . . . 2175 GLN HG2 . 50336 1 344 . 1 . 1 27 27 GLN HG3 H 1 2.41 0.02 . 2 . . . . . 2175 GLN HG3 . 50336 1 345 . 1 . 1 27 27 GLN HE21 H 1 7.57 0.02 . 2 . . . . . 2175 GLN HE21 . 50336 1 346 . 1 . 1 27 27 GLN HE22 H 1 8.21 0.02 . 2 . . . . . 2175 GLN HE22 . 50336 1 347 . 1 . 1 27 27 GLN C C 13 178.05 0.20 . 1 . . . . . 2175 GLN C . 50336 1 348 . 1 . 1 27 27 GLN CA C 13 59.17 0.20 . 1 . . . . . 2175 GLN CA . 50336 1 349 . 1 . 1 27 27 GLN CB C 13 30.80 0.20 . 1 . . . . . 2175 GLN CB . 50336 1 350 . 1 . 1 27 27 GLN CG C 13 33.76 0.20 . 1 . . . . . 2175 GLN CG . 50336 1 351 . 1 . 1 27 27 GLN N N 15 116.22 0.20 . 1 . . . . . 2175 GLN N . 50336 1 352 . 1 . 1 27 27 GLN NE2 N 15 118.29 0.20 . 1 . . . . . 2175 GLN NE2 . 50336 1 353 . 1 . 1 28 28 THR H H 1 7.29 0.02 . 1 . . . . . 2176 THR H . 50336 1 354 . 1 . 1 28 28 THR HA H 1 3.85 0.02 . 1 . . . . . 2176 THR HA . 50336 1 355 . 1 . 1 28 28 THR HB H 1 3.87 0.02 . 1 . . . . . 2176 THR HB . 50336 1 356 . 1 . 1 28 28 THR HG1 H 1 6.44 0.02 . 1 . . . . . 2176 THR HG1 . 50336 1 357 . 1 . 1 28 28 THR HG21 H 1 1.01 0.02 . 1 . . . . . 2176 THR QG2 . 50336 1 358 . 1 . 1 28 28 THR HG22 H 1 1.01 0.02 . 1 . . . . . 2176 THR QG2 . 50336 1 359 . 1 . 1 28 28 THR HG23 H 1 1.01 0.02 . 1 . . . . . 2176 THR QG2 . 50336 1 360 . 1 . 1 28 28 THR C C 13 176.31 0.20 . 1 . . . . . 2176 THR C . 50336 1 361 . 1 . 1 28 28 THR CA C 13 65.16 0.20 . 1 . . . . . 2176 THR CA . 50336 1 362 . 1 . 1 28 28 THR CB C 13 68.40 0.20 . 1 . . . . . 2176 THR CB . 50336 1 363 . 1 . 1 28 28 THR CG2 C 13 24.23 0.20 . 1 . . . . . 2176 THR CG2 . 50336 1 364 . 1 . 1 28 28 THR N N 15 116.64 0.20 . 1 . . . . . 2176 THR N . 50336 1 365 . 1 . 1 29 29 PHE H H 1 7.55 0.02 . 1 . . . . . 2177 PHE H . 50336 1 366 . 1 . 1 29 29 PHE HA H 1 3.87 0.02 . 1 . . . . . 2177 PHE HA . 50336 1 367 . 1 . 1 29 29 PHE HB2 H 1 3.13 0.02 . 2 . . . . . 2177 PHE HB2 . 50336 1 368 . 1 . 1 29 29 PHE HB3 H 1 3.34 0.02 . 2 . . . . . 2177 PHE HB3 . 50336 1 369 . 1 . 1 29 29 PHE HD1 H 1 6.95 0.02 . 1 . . . . . 2177 PHE HD1 . 50336 1 370 . 1 . 1 29 29 PHE HD2 H 1 6.96 0.02 . 1 . . . . . 2177 PHE HD2 . 50336 1 371 . 1 . 1 29 29 PHE HE1 H 1 6.95 0.02 . 1 . . . . . 2177 PHE HE1 . 50336 1 372 . 1 . 1 29 29 PHE HE2 H 1 6.96 0.02 . 1 . . . . . 2177 PHE HE2 . 50336 1 373 . 1 . 1 29 29 PHE HZ H 1 6.96 0.02 . 1 . . . . . 2177 PHE HZ . 50336 1 374 . 1 . 1 29 29 PHE C C 13 178.17 0.20 . 1 . . . . . 2177 PHE C . 50336 1 375 . 1 . 1 29 29 PHE CA C 13 59.23 0.20 . 1 . . . . . 2177 PHE CA . 50336 1 376 . 1 . 1 29 29 PHE CB C 13 36.48 0.20 . 1 . . . . . 2177 PHE CB . 50336 1 377 . 1 . 1 29 29 PHE CD1 C 13 130.76 0.20 . 1 . . . . . 2177 PHE CD1 . 50336 1 378 . 1 . 1 29 29 PHE CD2 C 13 130.86 0.20 . 1 . . . . . 2177 PHE CD2 . 50336 1 379 . 1 . 1 29 29 PHE CE1 C 13 130.75 0.20 . 1 . . . . . 2177 PHE CE1 . 50336 1 380 . 1 . 1 29 29 PHE CE2 C 13 130.85 0.20 . 1 . . . . . 2177 PHE CE2 . 50336 1 381 . 1 . 1 29 29 PHE CZ C 13 130.85 0.20 . 1 . . . . . 2177 PHE CZ . 50336 1 382 . 1 . 1 29 29 PHE N N 15 120.21 0.20 . 1 . . . . . 2177 PHE N . 50336 1 383 . 1 . 1 30 30 ASN H H 1 8.21 0.02 . 1 . . . . . 2178 ASN H . 50336 1 384 . 1 . 1 30 30 ASN HA H 1 4.44 0.02 . 1 . . . . . 2178 ASN HA . 50336 1 385 . 1 . 1 30 30 ASN HB2 H 1 3.01 0.02 . 2 . . . . . 2178 ASN HB2 . 50336 1 386 . 1 . 1 30 30 ASN HB3 H 1 2.94 0.02 . 2 . . . . . 2178 ASN HB3 . 50336 1 387 . 1 . 1 30 30 ASN HD21 H 1 7.29 0.02 . 2 . . . . . 2178 ASN HD21 . 50336 1 388 . 1 . 1 30 30 ASN HD22 H 1 6.97 0.02 . 2 . . . . . 2178 ASN HD22 . 50336 1 389 . 1 . 1 30 30 ASN C C 13 177.44 0.20 . 1 . . . . . 2178 ASN C . 50336 1 390 . 1 . 1 30 30 ASN CA C 13 56.97 0.20 . 1 . . . . . 2178 ASN CA . 50336 1 391 . 1 . 1 30 30 ASN CB C 13 38.25 0.20 . 1 . . . . . 2178 ASN CB . 50336 1 392 . 1 . 1 30 30 ASN N N 15 118.25 0.20 . 1 . . . . . 2178 ASN N . 50336 1 393 . 1 . 1 30 30 ASN ND2 N 15 116.36 0.20 . 1 . . . . . 2178 ASN ND2 . 50336 1 394 . 1 . 1 31 31 ILE H H 1 7.86 0.02 . 1 . . . . . 2179 ILE H . 50336 1 395 . 1 . 1 31 31 ILE HA H 1 3.82 0.02 . 1 . . . . . 2179 ILE HA . 50336 1 396 . 1 . 1 31 31 ILE HB H 1 1.98 0.02 . 1 . . . . . 2179 ILE HB . 50336 1 397 . 1 . 1 31 31 ILE HG12 H 1 1.26 0.02 . 2 . . . . . 2179 ILE HG12 . 50336 1 398 . 1 . 1 31 31 ILE HG13 H 1 1.77 0.02 . 2 . . . . . 2179 ILE HG13 . 50336 1 399 . 1 . 1 31 31 ILE HG21 H 1 0.96 0.02 . 1 . . . . . 2179 ILE QG2 . 50336 1 400 . 1 . 1 31 31 ILE HG22 H 1 0.96 0.02 . 1 . . . . . 2179 ILE QG2 . 50336 1 401 . 1 . 1 31 31 ILE HG23 H 1 0.96 0.02 . 1 . . . . . 2179 ILE QG2 . 50336 1 402 . 1 . 1 31 31 ILE HD11 H 1 0.88 0.02 . 1 . . . . . 2179 ILE QD1 . 50336 1 403 . 1 . 1 31 31 ILE HD12 H 1 0.88 0.02 . 1 . . . . . 2179 ILE QD1 . 50336 1 404 . 1 . 1 31 31 ILE HD13 H 1 0.88 0.02 . 1 . . . . . 2179 ILE QD1 . 50336 1 405 . 1 . 1 31 31 ILE C C 13 179.05 0.20 . 1 . . . . . 2179 ILE C . 50336 1 406 . 1 . 1 31 31 ILE CA C 13 65.14 0.20 . 1 . . . . . 2179 ILE CA . 50336 1 407 . 1 . 1 31 31 ILE CB C 13 38.18 0.20 . 1 . . . . . 2179 ILE CB . 50336 1 408 . 1 . 1 31 31 ILE CG1 C 13 28.87 0.20 . 1 . . . . . 2179 ILE CG1 . 50336 1 409 . 1 . 1 31 31 ILE CG2 C 13 17.86 0.20 . 1 . . . . . 2179 ILE CG2 . 50336 1 410 . 1 . 1 31 31 ILE CD1 C 13 13.34 0.20 . 1 . . . . . 2179 ILE CD1 . 50336 1 411 . 1 . 1 31 31 ILE N N 15 121.83 0.20 . 1 . . . . . 2179 ILE N . 50336 1 412 . 1 . 1 32 32 ILE H H 1 8.76 0.02 . 1 . . . . . 2180 ILE H . 50336 1 413 . 1 . 1 32 32 ILE HA H 1 3.57 0.02 . 1 . . . . . 2180 ILE HA . 50336 1 414 . 1 . 1 32 32 ILE HB H 1 1.88 0.02 . 1 . . . . . 2180 ILE HB . 50336 1 415 . 1 . 1 32 32 ILE HG12 H 1 1.94 0.02 . 2 . . . . . 2180 ILE HG12 . 50336 1 416 . 1 . 1 32 32 ILE HG13 H 1 0.98 0.02 . 2 . . . . . 2180 ILE HG13 . 50336 1 417 . 1 . 1 32 32 ILE HG21 H 1 0.98 0.02 . 1 . . . . . 2180 ILE QG2 . 50336 1 418 . 1 . 1 32 32 ILE HG22 H 1 0.98 0.02 . 1 . . . . . 2180 ILE QG2 . 50336 1 419 . 1 . 1 32 32 ILE HG23 H 1 0.98 0.02 . 1 . . . . . 2180 ILE QG2 . 50336 1 420 . 1 . 1 32 32 ILE HD11 H 1 0.96 0.02 . 1 . . . . . 2180 ILE QD1 . 50336 1 421 . 1 . 1 32 32 ILE HD12 H 1 0.96 0.02 . 1 . . . . . 2180 ILE QD1 . 50336 1 422 . 1 . 1 32 32 ILE HD13 H 1 0.96 0.02 . 1 . . . . . 2180 ILE QD1 . 50336 1 423 . 1 . 1 32 32 ILE C C 13 177.74 0.20 . 1 . . . . . 2180 ILE C . 50336 1 424 . 1 . 1 32 32 ILE CA C 13 65.73 0.20 . 1 . . . . . 2180 ILE CA . 50336 1 425 . 1 . 1 32 32 ILE CB C 13 38.29 0.20 . 1 . . . . . 2180 ILE CB . 50336 1 426 . 1 . 1 32 32 ILE CG1 C 13 29.17 0.20 . 1 . . . . . 2180 ILE CG1 . 50336 1 427 . 1 . 1 32 32 ILE CG2 C 13 19.91 0.20 . 1 . . . . . 2180 ILE CG2 . 50336 1 428 . 1 . 1 32 32 ILE CD1 C 13 17.27 0.20 . 1 . . . . . 2180 ILE CD1 . 50336 1 429 . 1 . 1 32 32 ILE N N 15 120.46 0.20 . 1 . . . . . 2180 ILE N . 50336 1 430 . 1 . 1 33 33 SER H H 1 8.09 0.02 . 1 . . . . . 2181 SER H . 50336 1 431 . 1 . 1 33 33 SER HA H 1 3.96 0.02 . 1 . . . . . 2181 SER HA . 50336 1 432 . 1 . 1 33 33 SER HB2 H 1 4.12 0.02 . 2 . . . . . 2181 SER HB2 . 50336 1 433 . 1 . 1 33 33 SER HB3 H 1 4.12 0.02 . 2 . . . . . 2181 SER HB3 . 50336 1 434 . 1 . 1 33 33 SER HG H 1 4.45 0.02 . 1 . . . . . 2181 SER HG . 50336 1 435 . 1 . 1 33 33 SER C C 13 177.14 0.20 . 1 . . . . . 2181 SER C . 50336 1 436 . 1 . 1 33 33 SER CA C 13 61.97 0.20 . 1 . . . . . 2181 SER CA . 50336 1 437 . 1 . 1 33 33 SER CB C 13 63.20 0.20 . 1 . . . . . 2181 SER CB . 50336 1 438 . 1 . 1 33 33 SER N N 15 112.81 0.20 . 1 . . . . . 2181 SER N . 50336 1 439 . 1 . 1 34 34 GLN H H 1 7.93 0.02 . 1 . . . . . 2182 GLN H . 50336 1 440 . 1 . 1 34 34 GLN HA H 1 4.09 0.02 . 1 . . . . . 2182 GLN HA . 50336 1 441 . 1 . 1 34 34 GLN HB2 H 1 2.25 0.02 . 2 . . . . . 2182 GLN HB2 . 50336 1 442 . 1 . 1 34 34 GLN HB3 H 1 2.25 0.02 . 2 . . . . . 2182 GLN HB3 . 50336 1 443 . 1 . 1 34 34 GLN HG2 H 1 2.42 0.02 . 2 . . . . . 2182 GLN HG2 . 50336 1 444 . 1 . 1 34 34 GLN HG3 H 1 2.59 0.02 . 2 . . . . . 2182 GLN HG3 . 50336 1 445 . 1 . 1 34 34 GLN HE21 H 1 7.94 0.02 . 2 . . . . . 2182 GLN HE21 . 50336 1 446 . 1 . 1 34 34 GLN HE22 H 1 7.93 0.02 . 2 . . . . . 2182 GLN HE22 . 50336 1 447 . 1 . 1 34 34 GLN C C 13 178.15 0.20 . 1 . . . . . 2182 GLN C . 50336 1 448 . 1 . 1 34 34 GLN CA C 13 58.85 0.20 . 1 . . . . . 2182 GLN CA . 50336 1 449 . 1 . 1 34 34 GLN CB C 13 28.48 0.20 . 1 . . . . . 2182 GLN CB . 50336 1 450 . 1 . 1 34 34 GLN CG C 13 34.12 0.20 . 1 . . . . . 2182 GLN CG . 50336 1 451 . 1 . 1 34 34 GLN N N 15 119.31 0.20 . 1 . . . . . 2182 GLN N . 50336 1 452 . 1 . 1 34 34 GLN NE2 N 15 119.28 0.20 . 1 . . . . . 2182 GLN NE2 . 50336 1 453 . 1 . 1 35 35 GLN H H 1 8.09 0.02 . 1 . . . . . 2183 GLN H . 50336 1 454 . 1 . 1 35 35 GLN HA H 1 4.07 0.02 . 1 . . . . . 2183 GLN HA . 50336 1 455 . 1 . 1 35 35 GLN HB2 H 1 2.21 0.02 . 2 . . . . . 2183 GLN HB2 . 50336 1 456 . 1 . 1 35 35 GLN HB3 H 1 2.12 0.02 . 2 . . . . . 2183 GLN HB3 . 50336 1 457 . 1 . 1 35 35 GLN HG2 H 1 2.42 0.02 . 2 . . . . . 2183 GLN HG2 . 50336 1 458 . 1 . 1 35 35 GLN HG3 H 1 2.43 0.02 . 2 . . . . . 2183 GLN HG3 . 50336 1 459 . 1 . 1 35 35 GLN HE21 H 1 7.30 0.02 . 2 . . . . . 2183 GLN HE21 . 50336 1 460 . 1 . 1 35 35 GLN HE22 H 1 7.30 0.02 . 2 . . . . . 2183 GLN HE22 . 50336 1 461 . 1 . 1 35 35 GLN C C 13 178.55 0.20 . 1 . . . . . 2183 GLN C . 50336 1 462 . 1 . 1 35 35 GLN CA C 13 58.66 0.20 . 1 . . . . . 2183 GLN CA . 50336 1 463 . 1 . 1 35 35 GLN CB C 13 28.52 0.20 . 1 . . . . . 2183 GLN CB . 50336 1 464 . 1 . 1 35 35 GLN CG C 13 33.97 0.20 . 1 . . . . . 2183 GLN CG . 50336 1 465 . 1 . 1 35 35 GLN N N 15 118.97 0.20 . 1 . . . . . 2183 GLN N . 50336 1 466 . 1 . 1 35 35 GLN NE2 N 15 116.67 0.20 . 1 . . . . . 2183 GLN NE2 . 50336 1 467 . 1 . 1 36 36 LEU H H 1 8.67 0.02 . 1 . . . . . 2184 LEU H . 50336 1 468 . 1 . 1 36 36 LEU HA H 1 4.26 0.02 . 1 . . . . . 2184 LEU HA . 50336 1 469 . 1 . 1 36 36 LEU HB2 H 1 1.69 0.02 . 2 . . . . . 2184 LEU HB2 . 50336 1 470 . 1 . 1 36 36 LEU HB3 H 1 1.13 0.02 . 2 . . . . . 2184 LEU HB3 . 50336 1 471 . 1 . 1 36 36 LEU HG H 1 2.10 0.02 . 1 . . . . . 2184 LEU HG . 50336 1 472 . 1 . 1 36 36 LEU HD11 H 1 1.04 0.02 . 2 . . . . . 2184 LEU QD1 . 50336 1 473 . 1 . 1 36 36 LEU HD12 H 1 1.04 0.02 . 2 . . . . . 2184 LEU QD1 . 50336 1 474 . 1 . 1 36 36 LEU HD13 H 1 1.04 0.02 . 2 . . . . . 2184 LEU QD1 . 50336 1 475 . 1 . 1 36 36 LEU HD21 H 1 1.04 0.02 . 2 . . . . . 2184 LEU QD2 . 50336 1 476 . 1 . 1 36 36 LEU HD22 H 1 1.04 0.02 . 2 . . . . . 2184 LEU QD2 . 50336 1 477 . 1 . 1 36 36 LEU HD23 H 1 1.04 0.02 . 2 . . . . . 2184 LEU QD2 . 50336 1 478 . 1 . 1 36 36 LEU C C 13 179.98 0.20 . 1 . . . . . 2184 LEU C . 50336 1 479 . 1 . 1 36 36 LEU CA C 13 56.76 0.20 . 1 . . . . . 2184 LEU CA . 50336 1 480 . 1 . 1 36 36 LEU CB C 13 41.81 0.20 . 1 . . . . . 2184 LEU CB . 50336 1 481 . 1 . 1 36 36 LEU CG C 13 26.19 0.20 . 1 . . . . . 2184 LEU CG . 50336 1 482 . 1 . 1 36 36 LEU CD1 C 13 21.43 0.20 . 1 . . . . . 2184 LEU CD1 . 50336 1 483 . 1 . 1 36 36 LEU CD2 C 13 26.61 0.20 . 1 . . . . . 2184 LEU CD2 . 50336 1 484 . 1 . 1 36 36 LEU N N 15 117.56 0.20 . 1 . . . . . 2184 LEU N . 50336 1 485 . 1 . 1 37 37 GLY H H 1 8.22 0.02 . 1 . . . . . 2185 GLY H . 50336 1 486 . 1 . 1 37 37 GLY HA2 H 1 3.79 0.02 . 2 . . . . . 2185 GLY HA2 . 50336 1 487 . 1 . 1 37 37 GLY HA3 H 1 4.19 0.02 . 2 . . . . . 2185 GLY HA3 . 50336 1 488 . 1 . 1 37 37 GLY C C 13 174.75 0.20 . 1 . . . . . 2185 GLY C . 50336 1 489 . 1 . 1 37 37 GLY CA C 13 46.73 0.20 . 1 . . . . . 2185 GLY CA . 50336 1 490 . 1 . 1 37 37 GLY N N 15 106.04 0.20 . 1 . . . . . 2185 GLY N . 50336 1 491 . 1 . 1 38 38 ASN H H 1 7.48 0.02 . 1 . . . . . 2186 ASN H . 50336 1 492 . 1 . 1 38 38 ASN HA H 1 4.77 0.02 . 1 . . . . . 2186 ASN HA . 50336 1 493 . 1 . 1 38 38 ASN HB2 H 1 2.67 0.02 . 2 . . . . . 2186 ASN HB2 . 50336 1 494 . 1 . 1 38 38 ASN HB3 H 1 3.13 0.02 . 2 . . . . . 2186 ASN HB3 . 50336 1 495 . 1 . 1 38 38 ASN HD21 H 1 8.22 0.02 . 2 . . . . . 2186 ASN HD21 . 50336 1 496 . 1 . 1 38 38 ASN HD22 H 1 6.98 0.02 . 2 . . . . . 2186 ASN HD22 . 50336 1 497 . 1 . 1 38 38 ASN C C 13 174.53 0.20 . 1 . . . . . 2186 ASN C . 50336 1 498 . 1 . 1 38 38 ASN CA C 13 51.84 0.20 . 1 . . . . . 2186 ASN CA . 50336 1 499 . 1 . 1 38 38 ASN CB C 13 37.93 0.20 . 1 . . . . . 2186 ASN CB . 50336 1 500 . 1 . 1 38 38 ASN N N 15 116.53 0.20 . 1 . . . . . 2186 ASN N . 50336 1 501 . 1 . 1 38 38 ASN ND2 N 15 115.79 0.20 . 1 . . . . . 2186 ASN ND2 . 50336 1 502 . 1 . 1 39 39 LYS H H 1 6.98 0.02 . 1 . . . . . 2187 LYS H . 50336 1 503 . 1 . 1 39 39 LYS HA H 1 5.04 0.02 . 1 . . . . . 2187 LYS HA . 50336 1 504 . 1 . 1 39 39 LYS HB2 H 1 1.58 0.02 . 2 . . . . . 2187 LYS HB2 . 50336 1 505 . 1 . 1 39 39 LYS HB3 H 1 1.73 0.02 . 2 . . . . . 2187 LYS HB3 . 50336 1 506 . 1 . 1 39 39 LYS HG2 H 1 0.81 0.02 . 2 . . . . . 2187 LYS HG2 . 50336 1 507 . 1 . 1 39 39 LYS HG3 H 1 0.81 0.02 . 2 . . . . . 2187 LYS HG3 . 50336 1 508 . 1 . 1 39 39 LYS HD2 H 1 1.40 0.02 . 2 . . . . . 2187 LYS HD2 . 50336 1 509 . 1 . 1 39 39 LYS HD3 H 1 1.40 0.02 . 2 . . . . . 2187 LYS HD3 . 50336 1 510 . 1 . 1 39 39 LYS HE2 H 1 3.20 0.02 . 2 . . . . . 2187 LYS HE2 . 50336 1 511 . 1 . 1 39 39 LYS HE3 H 1 3.91 0.02 . 2 . . . . . 2187 LYS HE3 . 50336 1 512 . 1 . 1 39 39 LYS C C 13 176.45 0.20 . 1 . . . . . 2187 LYS C . 50336 1 513 . 1 . 1 39 39 LYS CA C 13 52.41 0.20 . 1 . . . . . 2187 LYS CA . 50336 1 514 . 1 . 1 39 39 LYS CB C 13 38.09 0.20 . 1 . . . . . 2187 LYS CB . 50336 1 515 . 1 . 1 39 39 LYS CG C 13 23.62 0.20 . 1 . . . . . 2187 LYS CG . 50336 1 516 . 1 . 1 39 39 LYS CD C 13 27.00 0.20 . 1 . . . . . 2187 LYS CD . 50336 1 517 . 1 . 1 39 39 LYS CE C 13 43.41 0.20 . 1 . . . . . 2187 LYS CE . 50336 1 518 . 1 . 1 39 39 LYS N N 15 115.86 0.20 . 1 . . . . . 2187 LYS N . 50336 1 519 . 1 . 1 40 40 THR H H 1 9.73 0.02 . 1 . . . . . 2188 THR H . 50336 1 520 . 1 . 1 40 40 THR HA H 1 4.08 0.02 . 1 . . . . . 2188 THR HA . 50336 1 521 . 1 . 1 40 40 THR HB H 1 4.08 0.02 . 1 . . . . . 2188 THR HB . 50336 1 522 . 1 . 1 40 40 THR HG1 H 1 4.74 0.02 . 1 . . . . . 2188 THR HG1 . 50336 1 523 . 1 . 1 40 40 THR HG21 H 1 1.32 0.02 . 1 . . . . . 2188 THR QG2 . 50336 1 524 . 1 . 1 40 40 THR HG22 H 1 1.32 0.02 . 1 . . . . . 2188 THR QG2 . 50336 1 525 . 1 . 1 40 40 THR HG23 H 1 1.32 0.02 . 1 . . . . . 2188 THR QG2 . 50336 1 526 . 1 . 1 40 40 THR CA C 13 53.97 0.20 . 1 . . . . . 2188 THR CA . 50336 1 527 . 1 . 1 40 40 THR CB C 13 62.13 0.20 . 1 . . . . . 2188 THR CB . 50336 1 528 . 1 . 1 40 40 THR CG2 C 13 20.27 0.20 . 1 . . . . . 2188 THR CG2 . 50336 1 529 . 1 . 1 40 40 THR N N 15 116.29 0.20 . 1 . . . . . 2188 THR N . 50336 1 530 . 1 . 1 41 41 PRO HA H 1 4.12 0.02 . 1 . . . . . 2189 PRO HA . 50336 1 531 . 1 . 1 41 41 PRO HB2 H 1 2.40 0.02 . 2 . . . . . 2189 PRO HB2 . 50336 1 532 . 1 . 1 41 41 PRO HB3 H 1 2.40 0.02 . 2 . . . . . 2189 PRO HB3 . 50336 1 533 . 1 . 1 41 41 PRO HG2 H 1 2.10 0.02 . 2 . . . . . 2189 PRO HG2 . 50336 1 534 . 1 . 1 41 41 PRO HG3 H 1 2.12 0.02 . 2 . . . . . 2189 PRO HG3 . 50336 1 535 . 1 . 1 41 41 PRO HD2 H 1 4.07 0.02 . 2 . . . . . 2189 PRO HD2 . 50336 1 536 . 1 . 1 41 41 PRO HD3 H 1 4.08 0.02 . 2 . . . . . 2189 PRO HD3 . 50336 1 537 . 1 . 1 41 41 PRO C C 13 178.52 0.20 . 1 . . . . . 2189 PRO C . 50336 1 538 . 1 . 1 41 41 PRO CA C 13 66.30 0.20 . 1 . . . . . 2189 PRO CA . 50336 1 539 . 1 . 1 41 41 PRO CB C 13 33.86 0.20 . 1 . . . . . 2189 PRO CB . 50336 1 540 . 1 . 1 41 41 PRO CG C 13 28.44 0.20 . 1 . . . . . 2189 PRO CG . 50336 1 541 . 1 . 1 41 41 PRO CD C 13 50.50 0.20 . 1 . . . . . 2189 PRO CD . 50336 1 542 . 1 . 1 42 42 ALA H H 1 8.00 0.02 . 1 . . . . . 2190 ALA H . 50336 1 543 . 1 . 1 42 42 ALA HA H 1 4.09 0.02 . 1 . . . . . 2190 ALA HA . 50336 1 544 . 1 . 1 42 42 ALA HB1 H 1 1.40 0.02 . 1 . . . . . 2190 ALA HB . 50336 1 545 . 1 . 1 42 42 ALA HB2 H 1 1.40 0.02 . 1 . . . . . 2190 ALA HB . 50336 1 546 . 1 . 1 42 42 ALA HB3 H 1 1.40 0.02 . 1 . . . . . 2190 ALA HB . 50336 1 547 . 1 . 1 42 42 ALA C C 13 180.96 0.20 . 1 . . . . . 2190 ALA C . 50336 1 548 . 1 . 1 42 42 ALA CA C 13 54.90 0.20 . 1 . . . . . 2190 ALA CA . 50336 1 549 . 1 . 1 42 42 ALA CB C 13 18.53 0.20 . 1 . . . . . 2190 ALA CB . 50336 1 550 . 1 . 1 42 42 ALA N N 15 118.56 0.20 . 1 . . . . . 2190 ALA N . 50336 1 551 . 1 . 1 43 43 GLU H H 1 7.98 0.02 . 1 . . . . . 2191 GLU H . 50336 1 552 . 1 . 1 43 43 GLU HA H 1 4.10 0.02 . 1 . . . . . 2191 GLU HA . 50336 1 553 . 1 . 1 43 43 GLU HB2 H 1 2.48 0.02 . 2 . . . . . 2191 GLU HB2 . 50336 1 554 . 1 . 1 43 43 GLU HB3 H 1 2.62 0.02 . 2 . . . . . 2191 GLU HB3 . 50336 1 555 . 1 . 1 43 43 GLU HG2 H 1 2.48 0.02 . 2 . . . . . 2191 GLU HG2 . 50336 1 556 . 1 . 1 43 43 GLU HG3 H 1 2.49 0.02 . 2 . . . . . 2191 GLU HG3 . 50336 1 557 . 1 . 1 43 43 GLU C C 13 180.06 0.20 . 1 . . . . . 2191 GLU C . 50336 1 558 . 1 . 1 43 43 GLU CA C 13 59.45 0.20 . 1 . . . . . 2191 GLU CA . 50336 1 559 . 1 . 1 43 43 GLU CB C 13 34.08 0.20 . 1 . . . . . 2191 GLU CB . 50336 1 560 . 1 . 1 43 43 GLU CG C 13 34.10 0.20 . 1 . . . . . 2191 GLU CG . 50336 1 561 . 1 . 1 43 43 GLU N N 15 120.15 0.20 . 1 . . . . . 2191 GLU N . 50336 1 562 . 1 . 1 44 44 VAL H H 1 8.32 0.02 . 1 . . . . . 2192 VAL H . 50336 1 563 . 1 . 1 44 44 VAL HA H 1 3.59 0.02 . 1 . . . . . 2192 VAL HA . 50336 1 564 . 1 . 1 44 44 VAL HB H 1 2.31 0.02 . 1 . . . . . 2192 VAL HB . 50336 1 565 . 1 . 1 44 44 VAL HG11 H 1 1.10 0.02 . 2 . . . . . 2192 VAL QG1 . 50336 1 566 . 1 . 1 44 44 VAL HG12 H 1 1.10 0.02 . 2 . . . . . 2192 VAL QG1 . 50336 1 567 . 1 . 1 44 44 VAL HG13 H 1 1.10 0.02 . 2 . . . . . 2192 VAL QG1 . 50336 1 568 . 1 . 1 44 44 VAL HG21 H 1 1.09 0.02 . 2 . . . . . 2192 VAL QG2 . 50336 1 569 . 1 . 1 44 44 VAL HG22 H 1 1.09 0.02 . 2 . . . . . 2192 VAL QG2 . 50336 1 570 . 1 . 1 44 44 VAL HG23 H 1 1.09 0.02 . 2 . . . . . 2192 VAL QG2 . 50336 1 571 . 1 . 1 44 44 VAL C C 13 176.31 0.20 . 1 . . . . . 2192 VAL C . 50336 1 572 . 1 . 1 44 44 VAL CA C 13 66.91 0.20 . 1 . . . . . 2192 VAL CA . 50336 1 573 . 1 . 1 44 44 VAL CB C 13 31.56 0.20 . 1 . . . . . 2192 VAL CB . 50336 1 574 . 1 . 1 44 44 VAL CG1 C 13 22.92 0.20 . 1 . . . . . 2192 VAL CG1 . 50336 1 575 . 1 . 1 44 44 VAL CG2 C 13 22.84 0.20 . 1 . . . . . 2192 VAL CG2 . 50336 1 576 . 1 . 1 44 44 VAL N N 15 119.39 0.20 . 1 . . . . . 2192 VAL N . 50336 1 577 . 1 . 1 45 45 SER H H 1 8.12 0.02 . 1 . . . . . 2193 SER H . 50336 1 578 . 1 . 1 45 45 SER HA H 1 2.75 0.02 . 1 . . . . . 2193 SER HA . 50336 1 579 . 1 . 1 45 45 SER HB2 H 1 3.08 0.02 . 2 . . . . . 2193 SER HB2 . 50336 1 580 . 1 . 1 45 45 SER HB3 H 1 3.30 0.02 . 2 . . . . . 2193 SER HB3 . 50336 1 581 . 1 . 1 45 45 SER HG H 1 2.74 0.02 . 1 . . . . . 2193 SER HG . 50336 1 582 . 1 . 1 45 45 SER C C 13 176.91 0.20 . 1 . . . . . 2193 SER C . 50336 1 583 . 1 . 1 45 45 SER CA C 13 60.61 0.20 . 1 . . . . . 2193 SER CA . 50336 1 584 . 1 . 1 45 45 SER CB C 13 62.26 0.20 . 1 . . . . . 2193 SER CB . 50336 1 585 . 1 . 1 45 45 SER N N 15 114.65 0.20 . 1 . . . . . 2193 SER N . 50336 1 586 . 1 . 1 46 46 HIS H H 1 7.92 0.02 . 1 . . . . . 2194 HIS H . 50336 1 587 . 1 . 1 46 46 HIS HA H 1 4.13 0.02 . 1 . . . . . 2194 HIS HA . 50336 1 588 . 1 . 1 46 46 HIS HB2 H 1 3.30 0.02 . 2 . . . . . 2194 HIS HB2 . 50336 1 589 . 1 . 1 46 46 HIS HB3 H 1 3.30 0.02 . 2 . . . . . 2194 HIS HB3 . 50336 1 590 . 1 . 1 46 46 HIS HD2 H 1 7.34 0.02 . 1 . . . . . 2194 HIS HD2 . 50336 1 591 . 1 . 1 46 46 HIS HE1 H 1 6.94 0.02 . 1 . . . . . 2194 HIS HE1 . 50336 1 592 . 1 . 1 46 46 HIS C C 13 177.25 0.20 . 1 . . . . . 2194 HIS C . 50336 1 593 . 1 . 1 46 46 HIS CA C 13 59.19 0.20 . 1 . . . . . 2194 HIS CA . 50336 1 594 . 1 . 1 46 46 HIS CB C 13 28.66 0.20 . 1 . . . . . 2194 HIS CB . 50336 1 595 . 1 . 1 46 46 HIS CD2 C 13 115.23 0.20 . 1 . . . . . 2194 HIS CD2 . 50336 1 596 . 1 . 1 46 46 HIS CE1 C 13 130.71 0.20 . 1 . . . . . 2194 HIS CE1 . 50336 1 597 . 1 . 1 46 46 HIS N N 15 118.70 0.20 . 1 . . . . . 2194 HIS N . 50336 1 598 . 1 . 1 47 47 ARG H H 1 8.10 0.02 . 1 . . . . . 2195 ARG H . 50336 1 599 . 1 . 1 47 47 ARG HA H 1 3.83 0.02 . 1 . . . . . 2195 ARG HA . 50336 1 600 . 1 . 1 47 47 ARG HB2 H 1 2.43 0.02 . 2 . . . . . 2195 ARG HB2 . 50336 1 601 . 1 . 1 47 47 ARG HB3 H 1 2.43 0.02 . 2 . . . . . 2195 ARG HB3 . 50336 1 602 . 1 . 1 47 47 ARG HG2 H 1 1.12 0.02 . 2 . . . . . 2195 ARG HG2 . 50336 1 603 . 1 . 1 47 47 ARG HG3 H 1 0.97 0.02 . 2 . . . . . 2195 ARG HG3 . 50336 1 604 . 1 . 1 47 47 ARG HD2 H 1 3.69 0.02 . 2 . . . . . 2195 ARG HD2 . 50336 1 605 . 1 . 1 47 47 ARG HD3 H 1 3.69 0.02 . 2 . . . . . 2195 ARG HD3 . 50336 1 606 . 1 . 1 47 47 ARG HE H 1 4.27 0.02 . 1 . . . . . 2195 ARG HE . 50336 1 607 . 1 . 1 47 47 ARG C C 13 177.61 0.20 . 1 . . . . . 2195 ARG C . 50336 1 608 . 1 . 1 47 47 ARG CA C 13 56.74 0.20 . 1 . . . . . 2195 ARG CA . 50336 1 609 . 1 . 1 47 47 ARG CB C 13 31.61 0.20 . 1 . . . . . 2195 ARG CB . 50336 1 610 . 1 . 1 47 47 ARG CG C 13 22.91 0.20 . 1 . . . . . 2195 ARG CG . 50336 1 611 . 1 . 1 47 47 ARG CD C 13 44.45 0.20 . 1 . . . . . 2195 ARG CD . 50336 1 612 . 1 . 1 47 47 ARG N N 15 121.12 0.20 . 1 . . . . . 2195 ARG N . 50336 1 613 . 1 . 1 48 48 PHE H H 1 8.52 0.02 . 1 . . . . . 2196 PHE H . 50336 1 614 . 1 . 1 48 48 PHE HA H 1 3.87 0.02 . 1 . . . . . 2196 PHE HA . 50336 1 615 . 1 . 1 48 48 PHE HB2 H 1 2.98 0.02 . 2 . . . . . 2196 PHE HB2 . 50336 1 616 . 1 . 1 48 48 PHE HB3 H 1 3.01 0.02 . 2 . . . . . 2196 PHE HB3 . 50336 1 617 . 1 . 1 48 48 PHE HD1 H 1 7.07 0.02 . 1 . . . . . 2196 PHE HD1 . 50336 1 618 . 1 . 1 48 48 PHE HD2 H 1 7.07 0.02 . 1 . . . . . 2196 PHE HD2 . 50336 1 619 . 1 . 1 48 48 PHE HE1 H 1 7.30 0.02 . 1 . . . . . 2196 PHE HE1 . 50336 1 620 . 1 . 1 48 48 PHE HE2 H 1 7.32 0.02 . 1 . . . . . 2196 PHE HE2 . 50336 1 621 . 1 . 1 48 48 PHE HZ H 1 7.30 0.02 . 1 . . . . . 2196 PHE HZ . 50336 1 622 . 1 . 1 48 48 PHE C C 13 176.01 0.20 . 1 . . . . . 2196 PHE C . 50336 1 623 . 1 . 1 48 48 PHE CA C 13 62.37 0.20 . 1 . . . . . 2196 PHE CA . 50336 1 624 . 1 . 1 48 48 PHE CB C 13 38.73 0.20 . 1 . . . . . 2196 PHE CB . 50336 1 625 . 1 . 1 48 48 PHE CD1 C 13 131.61 0.20 . 1 . . . . . 2196 PHE CD1 . 50336 1 626 . 1 . 1 48 48 PHE CD2 C 13 131.60 0.20 . 1 . . . . . 2196 PHE CD2 . 50336 1 627 . 1 . 1 48 48 PHE CE1 C 13 131.50 0.20 . 1 . . . . . 2196 PHE CE1 . 50336 1 628 . 1 . 1 48 48 PHE CE2 C 13 131.55 0.20 . 1 . . . . . 2196 PHE CE2 . 50336 1 629 . 1 . 1 48 48 PHE CZ C 13 131.58 0.20 . 1 . . . . . 2196 PHE CZ . 50336 1 630 . 1 . 1 48 48 PHE N N 15 119.26 0.20 . 1 . . . . . 2196 PHE N . 50336 1 631 . 1 . 1 49 49 ARG H H 1 7.37 0.02 . 1 . . . . . 2197 ARG H . 50336 1 632 . 1 . 1 49 49 ARG HA H 1 3.55 0.02 . 1 . . . . . 2197 ARG HA . 50336 1 633 . 1 . 1 49 49 ARG HB2 H 1 1.61 0.02 . 2 . . . . . 2197 ARG HB2 . 50336 1 634 . 1 . 1 49 49 ARG HB3 H 1 1.85 0.02 . 2 . . . . . 2197 ARG HB3 . 50336 1 635 . 1 . 1 49 49 ARG HG2 H 1 1.61 0.02 . 2 . . . . . 2197 ARG HG2 . 50336 1 636 . 1 . 1 49 49 ARG HG3 H 1 1.85 0.02 . 2 . . . . . 2197 ARG HG3 . 50336 1 637 . 1 . 1 49 49 ARG HD2 H 1 3.14 0.02 . 2 . . . . . 2197 ARG HD2 . 50336 1 638 . 1 . 1 49 49 ARG HD3 H 1 3.20 0.02 . 2 . . . . . 2197 ARG HD3 . 50336 1 639 . 1 . 1 49 49 ARG HE H 1 10.27 0.02 . 1 . . . . . 2197 ARG HE . 50336 1 640 . 1 . 1 49 49 ARG C C 13 179.19 0.20 . 1 . . . . . 2197 ARG C . 50336 1 641 . 1 . 1 49 49 ARG CA C 13 59.45 0.20 . 1 . . . . . 2197 ARG CA . 50336 1 642 . 1 . 1 49 49 ARG CB C 13 27.53 0.20 . 1 . . . . . 2197 ARG CB . 50336 1 643 . 1 . 1 49 49 ARG CG C 13 27.50 0.20 . 1 . . . . . 2197 ARG CG . 50336 1 644 . 1 . 1 49 49 ARG CD C 13 43.35 0.20 . 1 . . . . . 2197 ARG CD . 50336 1 645 . 1 . 1 49 49 ARG N N 15 116.30 0.20 . 1 . . . . . 2197 ARG N . 50336 1 646 . 1 . 1 50 50 GLU H H 1 7.77 0.02 . 1 . . . . . 2198 GLU H . 50336 1 647 . 1 . 1 50 50 GLU HA H 1 3.83 0.02 . 1 . . . . . 2198 GLU HA . 50336 1 648 . 1 . 1 50 50 GLU HB2 H 1 2.06 0.02 . 2 . . . . . 2198 GLU HB2 . 50336 1 649 . 1 . 1 50 50 GLU HB3 H 1 2.07 0.02 . 2 . . . . . 2198 GLU HB3 . 50336 1 650 . 1 . 1 50 50 GLU HG2 H 1 2.02 0.02 . 2 . . . . . 2198 GLU HG2 . 50336 1 651 . 1 . 1 50 50 GLU HG3 H 1 2.02 0.02 . 2 . . . . . 2198 GLU HG3 . 50336 1 652 . 1 . 1 50 50 GLU C C 13 179.56 0.20 . 1 . . . . . 2198 GLU C . 50336 1 653 . 1 . 1 50 50 GLU CA C 13 59.38 0.20 . 1 . . . . . 2198 GLU CA . 50336 1 654 . 1 . 1 50 50 GLU CB C 13 30.42 0.20 . 1 . . . . . 2198 GLU CB . 50336 1 655 . 1 . 1 50 50 GLU CG C 13 36.27 0.20 . 1 . . . . . 2198 GLU CG . 50336 1 656 . 1 . 1 50 50 GLU N N 15 119.87 0.20 . 1 . . . . . 2198 GLU N . 50336 1 657 . 1 . 1 51 51 LEU H H 1 8.50 0.02 . 1 . . . . . 2199 LEU H . 50336 1 658 . 1 . 1 51 51 LEU HA H 1 3.79 0.02 . 1 . . . . . 2199 LEU HA . 50336 1 659 . 1 . 1 51 51 LEU HB2 H 1 1.78 0.02 . 2 . . . . . 2199 LEU HB2 . 50336 1 660 . 1 . 1 51 51 LEU HB3 H 1 1.10 0.02 . 2 . . . . . 2199 LEU HB3 . 50336 1 661 . 1 . 1 51 51 LEU HG H 1 1.42 0.02 . 1 . . . . . 2199 LEU HG . 50336 1 662 . 1 . 1 51 51 LEU HD11 H 1 0.63 0.02 . 2 . . . . . 2199 LEU QD1 . 50336 1 663 . 1 . 1 51 51 LEU HD12 H 1 0.63 0.02 . 2 . . . . . 2199 LEU QD1 . 50336 1 664 . 1 . 1 51 51 LEU HD13 H 1 0.63 0.02 . 2 . . . . . 2199 LEU QD1 . 50336 1 665 . 1 . 1 51 51 LEU HD21 H 1 0.70 0.02 . 2 . . . . . 2199 LEU QD2 . 50336 1 666 . 1 . 1 51 51 LEU HD22 H 1 0.70 0.02 . 2 . . . . . 2199 LEU QD2 . 50336 1 667 . 1 . 1 51 51 LEU HD23 H 1 0.70 0.02 . 2 . . . . . 2199 LEU QD2 . 50336 1 668 . 1 . 1 51 51 LEU C C 13 179.31 0.20 . 1 . . . . . 2199 LEU C . 50336 1 669 . 1 . 1 51 51 LEU CA C 13 57.40 0.20 . 1 . . . . . 2199 LEU CA . 50336 1 670 . 1 . 1 51 51 LEU CB C 13 42.04 0.20 . 1 . . . . . 2199 LEU CB . 50336 1 671 . 1 . 1 51 51 LEU CG C 13 26.75 0.20 . 1 . . . . . 2199 LEU CG . 50336 1 672 . 1 . 1 51 51 LEU CD1 C 13 21.64 0.20 . 1 . . . . . 2199 LEU CD1 . 50336 1 673 . 1 . 1 51 51 LEU CD2 C 13 25.70 0.20 . 1 . . . . . 2199 LEU CD2 . 50336 1 674 . 1 . 1 51 51 LEU N N 15 120.09 0.20 . 1 . . . . . 2199 LEU N . 50336 1 675 . 1 . 1 52 52 MET H H 1 7.81 0.02 . 1 . . . . . 2200 MET H . 50336 1 676 . 1 . 1 52 52 MET HA H 1 4.28 0.02 . 1 . . . . . 2200 MET HA . 50336 1 677 . 1 . 1 52 52 MET HB2 H 1 1.70 0.02 . 2 . . . . . 2200 MET HB2 . 50336 1 678 . 1 . 1 52 52 MET HB3 H 1 1.74 0.02 . 2 . . . . . 2200 MET HB3 . 50336 1 679 . 1 . 1 52 52 MET HG2 H 1 1.74 0.02 . 2 . . . . . 2200 MET HG2 . 50336 1 680 . 1 . 1 52 52 MET HG3 H 1 1.75 0.02 . 2 . . . . . 2200 MET HG3 . 50336 1 681 . 1 . 1 52 52 MET HE1 H 1 2.06 0.02 . 1 . . . . . 2200 MET HE . 50336 1 682 . 1 . 1 52 52 MET HE2 H 1 2.06 0.02 . 1 . . . . . 2200 MET HE . 50336 1 683 . 1 . 1 52 52 MET HE3 H 1 2.06 0.02 . 1 . . . . . 2200 MET HE . 50336 1 684 . 1 . 1 52 52 MET C C 13 178.65 0.20 . 1 . . . . . 2200 MET C . 50336 1 685 . 1 . 1 52 52 MET CA C 13 56.40 0.20 . 1 . . . . . 2200 MET CA . 50336 1 686 . 1 . 1 52 52 MET CB C 13 31.88 0.20 . 1 . . . . . 2200 MET CB . 50336 1 687 . 1 . 1 52 52 MET CG C 13 32.92 0.20 . 1 . . . . . 2200 MET CG . 50336 1 688 . 1 . 1 52 52 MET CE C 13 16.99 0.20 . 1 . . . . . 2200 MET CE . 50336 1 689 . 1 . 1 52 52 MET N N 15 116.51 0.20 . 1 . . . . . 2200 MET N . 50336 1 690 . 1 . 1 53 53 GLN H H 1 7.58 0.02 . 1 . . . . . 2201 GLN H . 50336 1 691 . 1 . 1 53 53 GLN HA H 1 4.06 0.02 . 1 . . . . . 2201 GLN HA . 50336 1 692 . 1 . 1 53 53 GLN HB2 H 1 2.08 0.02 . 2 . . . . . 2201 GLN HB2 . 50336 1 693 . 1 . 1 53 53 GLN HB3 H 1 2.08 0.02 . 2 . . . . . 2201 GLN HB3 . 50336 1 694 . 1 . 1 53 53 GLN HG2 H 1 2.39 0.02 . 2 . . . . . 2201 GLN HG2 . 50336 1 695 . 1 . 1 53 53 GLN HG3 H 1 2.40 0.02 . 2 . . . . . 2201 GLN HG3 . 50336 1 696 . 1 . 1 53 53 GLN HE21 H 1 7.71 0.02 . 2 . . . . . 2201 GLN HE21 . 50336 1 697 . 1 . 1 53 53 GLN HE22 H 1 7.71 0.02 . 2 . . . . . 2201 GLN HE22 . 50336 1 698 . 1 . 1 53 53 GLN C C 13 177.82 0.20 . 1 . . . . . 2201 GLN C . 50336 1 699 . 1 . 1 53 53 GLN CA C 13 57.86 0.20 . 1 . . . . . 2201 GLN CA . 50336 1 700 . 1 . 1 53 53 GLN CB C 13 28.30 0.20 . 1 . . . . . 2201 GLN CB . 50336 1 701 . 1 . 1 53 53 GLN CG C 13 33.91 0.20 . 1 . . . . . 2201 GLN CG . 50336 1 702 . 1 . 1 53 53 GLN N N 15 118.42 0.20 . 1 . . . . . 2201 GLN N . 50336 1 703 . 1 . 1 53 53 GLN NE2 N 15 118.42 0.20 . 1 . . . . . 2201 GLN NE2 . 50336 1 704 . 1 . 1 54 54 LEU H H 1 7.71 0.02 . 1 . . . . . 2202 LEU H . 50336 1 705 . 1 . 1 54 54 LEU HA H 1 4.06 0.02 . 1 . . . . . 2202 LEU HA . 50336 1 706 . 1 . 1 54 54 LEU HB2 H 1 1.28 0.02 . 2 . . . . . 2202 LEU HB2 . 50336 1 707 . 1 . 1 54 54 LEU HB3 H 1 1.54 0.02 . 2 . . . . . 2202 LEU HB3 . 50336 1 708 . 1 . 1 54 54 LEU HG H 1 1.53 0.02 . 1 . . . . . 2202 LEU HG . 50336 1 709 . 1 . 1 54 54 LEU HD11 H 1 0.74 0.02 . 2 . . . . . 2202 LEU QD1 . 50336 1 710 . 1 . 1 54 54 LEU HD12 H 1 0.74 0.02 . 2 . . . . . 2202 LEU QD1 . 50336 1 711 . 1 . 1 54 54 LEU HD13 H 1 0.74 0.02 . 2 . . . . . 2202 LEU QD1 . 50336 1 712 . 1 . 1 54 54 LEU HD21 H 1 0.75 0.02 . 2 . . . . . 2202 LEU QD2 . 50336 1 713 . 1 . 1 54 54 LEU HD22 H 1 0.75 0.02 . 2 . . . . . 2202 LEU QD2 . 50336 1 714 . 1 . 1 54 54 LEU HD23 H 1 0.75 0.02 . 2 . . . . . 2202 LEU QD2 . 50336 1 715 . 1 . 1 54 54 LEU C C 13 178.36 0.20 . 1 . . . . . 2202 LEU C . 50336 1 716 . 1 . 1 54 54 LEU CA C 13 56.57 0.20 . 1 . . . . . 2202 LEU CA . 50336 1 717 . 1 . 1 54 54 LEU CB C 13 42.18 0.20 . 1 . . . . . 2202 LEU CB . 50336 1 718 . 1 . 1 54 54 LEU CG C 13 26.80 0.20 . 1 . . . . . 2202 LEU CG . 50336 1 719 . 1 . 1 54 54 LEU CD1 C 13 23.30 0.20 . 1 . . . . . 2202 LEU CD1 . 50336 1 720 . 1 . 1 54 54 LEU CD2 C 13 24.84 0.20 . 1 . . . . . 2202 LEU CD2 . 50336 1 721 . 1 . 1 54 54 LEU N N 15 119.83 0.20 . 1 . . . . . 2202 LEU N . 50336 1 722 . 1 . 1 55 55 PHE H H 1 7.83 0.02 . 1 . . . . . 2203 PHE H . 50336 1 723 . 1 . 1 55 55 PHE HA H 1 4.53 0.02 . 1 . . . . . 2203 PHE HA . 50336 1 724 . 1 . 1 55 55 PHE HB2 H 1 2.93 0.02 . 2 . . . . . 2203 PHE HB2 . 50336 1 725 . 1 . 1 55 55 PHE HB3 H 1 3.15 0.02 . 2 . . . . . 2203 PHE HB3 . 50336 1 726 . 1 . 1 55 55 PHE HD1 H 1 7.17 0.02 . 1 . . . . . 2203 PHE HD1 . 50336 1 727 . 1 . 1 55 55 PHE HD2 H 1 7.18 0.02 . 1 . . . . . 2203 PHE HD2 . 50336 1 728 . 1 . 1 55 55 PHE HE1 H 1 7.19 0.02 . 1 . . . . . 2203 PHE HE1 . 50336 1 729 . 1 . 1 55 55 PHE HE2 H 1 7.21 0.02 . 1 . . . . . 2203 PHE HE2 . 50336 1 730 . 1 . 1 55 55 PHE HZ H 1 7.20 0.02 . 1 . . . . . 2203 PHE HZ . 50336 1 731 . 1 . 1 55 55 PHE C C 13 179.37 0.20 . 1 . . . . . 2203 PHE C . 50336 1 732 . 1 . 1 55 55 PHE CA C 13 58.32 0.20 . 1 . . . . . 2203 PHE CA . 50336 1 733 . 1 . 1 55 55 PHE CB C 13 39.09 0.20 . 1 . . . . . 2203 PHE CB . 50336 1 734 . 1 . 1 55 55 PHE CD1 C 13 131.48 0.20 . 1 . . . . . 2203 PHE CD1 . 50336 1 735 . 1 . 1 55 55 PHE CD2 C 13 131.46 0.20 . 1 . . . . . 2203 PHE CD2 . 50336 1 736 . 1 . 1 55 55 PHE CE1 C 13 127.41 0.20 . 1 . . . . . 2203 PHE CE1 . 50336 1 737 . 1 . 1 55 55 PHE CE2 C 13 129.65 0.20 . 1 . . . . . 2203 PHE CE2 . 50336 1 738 . 1 . 1 55 55 PHE CZ C 13 120.03 0.20 . 1 . . . . . 2203 PHE CZ . 50336 1 739 . 1 . 1 55 55 PHE N N 15 117.54 0.20 . 1 . . . . . 2203 PHE N . 50336 1 740 . 1 . 1 56 56 HIS H H 1 8.09 0.02 . 1 . . . . . 2204 HIS H . 50336 1 741 . 1 . 1 56 56 HIS HA H 1 4.77 0.02 . 1 . . . . . 2204 HIS HA . 50336 1 742 . 1 . 1 56 56 HIS HB2 H 1 1.80 0.02 . 2 . . . . . 2204 HIS HB2 . 50336 1 743 . 1 . 1 56 56 HIS HB3 H 1 2.59 0.02 . 2 . . . . . 2204 HIS HB3 . 50336 1 744 . 1 . 1 56 56 HIS HD2 H 1 7.56 0.02 . 1 . . . . . 2204 HIS HD2 . 50336 1 745 . 1 . 1 56 56 HIS HE1 H 1 8.43 0.02 . 1 . . . . . 2204 HIS HE1 . 50336 1 746 . 1 . 1 56 56 HIS C C 13 176.25 0.20 . 1 . . . . . 2204 HIS C . 50336 1 747 . 1 . 1 56 56 HIS CA C 13 56.31 0.20 . 1 . . . . . 2204 HIS CA . 50336 1 748 . 1 . 1 56 56 HIS CB C 13 33.05 0.20 . 1 . . . . . 2204 HIS CB . 50336 1 749 . 1 . 1 56 56 HIS CD2 C 13 120.80 0.20 . 1 . . . . . 2204 HIS CD2 . 50336 1 750 . 1 . 1 56 56 HIS CE1 C 13 136.81 0.20 . 1 . . . . . 2204 HIS CE1 . 50336 1 751 . 1 . 1 56 56 HIS N N 15 118.22 0.20 . 1 . . . . . 2204 HIS N . 50336 1 752 . 1 . 1 57 57 THR H H 1 8.13 0.02 . 1 . . . . . 2205 THR H . 50336 1 753 . 1 . 1 57 57 THR HA H 1 4.27 0.02 . 1 . . . . . 2205 THR HA . 50336 1 754 . 1 . 1 57 57 THR HB H 1 4.22 0.02 . 1 . . . . . 2205 THR HB . 50336 1 755 . 1 . 1 57 57 THR HG1 H 1 4.25 0.02 . 1 . . . . . 2205 THR HG1 . 50336 1 756 . 1 . 1 57 57 THR HG21 H 1 1.20 0.02 . 1 . . . . . 2205 THR QG2 . 50336 1 757 . 1 . 1 57 57 THR HG22 H 1 1.20 0.02 . 1 . . . . . 2205 THR QG2 . 50336 1 758 . 1 . 1 57 57 THR HG23 H 1 1.20 0.02 . 1 . . . . . 2205 THR QG2 . 50336 1 759 . 1 . 1 57 57 THR C C 13 174.40 0.20 . 1 . . . . . 2205 THR C . 50336 1 760 . 1 . 1 57 57 THR CA C 13 62.44 0.20 . 1 . . . . . 2205 THR CA . 50336 1 761 . 1 . 1 57 57 THR CB C 13 69.72 0.20 . 1 . . . . . 2205 THR CB . 50336 1 762 . 1 . 1 57 57 THR CG2 C 13 21.68 0.20 . 1 . . . . . 2205 THR CG2 . 50336 1 763 . 1 . 1 57 57 THR N N 15 122.88 0.20 . 1 . . . . . 2205 THR N . 50336 1 764 . 1 . 1 58 58 ALA H H 1 8.26 0.02 . 1 . . . . . 2206 ALA H . 50336 1 765 . 1 . 1 58 58 ALA HA H 1 4.33 0.02 . 1 . . . . . 2206 ALA HA . 50336 1 766 . 1 . 1 58 58 ALA HB1 H 1 1.41 0.02 . 1 . . . . . 2206 ALA HB . 50336 1 767 . 1 . 1 58 58 ALA HB2 H 1 1.41 0.02 . 1 . . . . . 2206 ALA HB . 50336 1 768 . 1 . 1 58 58 ALA HB3 H 1 1.41 0.02 . 1 . . . . . 2206 ALA HB . 50336 1 769 . 1 . 1 58 58 ALA C C 13 177.61 0.20 . 1 . . . . . 2206 ALA C . 50336 1 770 . 1 . 1 58 58 ALA CA C 13 52.83 0.20 . 1 . . . . . 2206 ALA CA . 50336 1 771 . 1 . 1 58 58 ALA CB C 13 19.21 0.20 . 1 . . . . . 2206 ALA CB . 50336 1 772 . 1 . 1 58 58 ALA N N 15 125.89 0.20 . 1 . . . . . 2206 ALA N . 50336 1 773 . 1 . 1 59 59 CYS H H 1 8.19 0.02 . 1 . . . . . 2207 CYS H . 50336 1 774 . 1 . 1 59 59 CYS HA H 1 4.46 0.02 . 1 . . . . . 2207 CYS HA . 50336 1 775 . 1 . 1 59 59 CYS HB2 H 1 2.90 0.02 . 2 . . . . . 2207 CYS HB2 . 50336 1 776 . 1 . 1 59 59 CYS HB3 H 1 2.90 0.02 . 2 . . . . . 2207 CYS HB3 . 50336 1 777 . 1 . 1 59 59 CYS HG H 1 4.76 0.02 . 1 . . . . . 2207 CYS HG . 50336 1 778 . 1 . 1 59 59 CYS C C 13 174.43 0.20 . 1 . . . . . 2207 CYS C . 50336 1 779 . 1 . 1 59 59 CYS CA C 13 58.75 0.20 . 1 . . . . . 2207 CYS CA . 50336 1 780 . 1 . 1 59 59 CYS CB C 13 28.13 0.20 . 1 . . . . . 2207 CYS CB . 50336 1 781 . 1 . 1 59 59 CYS N N 15 117.75 0.20 . 1 . . . . . 2207 CYS N . 50336 1 782 . 1 . 1 60 60 GLU H H 1 8.32 0.02 . 1 . . . . . 2208 GLU H . 50336 1 783 . 1 . 1 60 60 GLU HA H 1 4.29 0.02 . 1 . . . . . 2208 GLU HA . 50336 1 784 . 1 . 1 60 60 GLU HB2 H 1 1.92 0.02 . 2 . . . . . 2208 GLU HB2 . 50336 1 785 . 1 . 1 60 60 GLU HB3 H 1 2.08 0.02 . 2 . . . . . 2208 GLU HB3 . 50336 1 786 . 1 . 1 60 60 GLU HG2 H 1 2.25 0.02 . 2 . . . . . 2208 GLU HG2 . 50336 1 787 . 1 . 1 60 60 GLU HG3 H 1 2.50 0.02 . 2 . . . . . 2208 GLU HG3 . 50336 1 788 . 1 . 1 60 60 GLU C C 13 175.05 0.20 . 1 . . . . . 2208 GLU C . 50336 1 789 . 1 . 1 60 60 GLU CA C 13 56.49 0.20 . 1 . . . . . 2208 GLU CA . 50336 1 790 . 1 . 1 60 60 GLU CB C 13 30.33 0.20 . 1 . . . . . 2208 GLU CB . 50336 1 791 . 1 . 1 60 60 GLU CG C 13 36.28 0.20 . 1 . . . . . 2208 GLU CG . 50336 1 792 . 1 . 1 60 60 GLU N N 15 123.21 0.20 . 1 . . . . . 2208 GLU N . 50336 1 793 . 1 . 1 61 61 ALA H H 1 7.92 0.02 . 1 . . . . . 2209 ALA H . 50336 1 794 . 1 . 1 61 61 ALA HA H 1 4.28 0.02 . 1 . . . . . 2209 ALA HA . 50336 1 795 . 1 . 1 61 61 ALA HB1 H 1 1.38 0.02 . 1 . . . . . 2209 ALA HB . 50336 1 796 . 1 . 1 61 61 ALA HB2 H 1 1.38 0.02 . 1 . . . . . 2209 ALA HB . 50336 1 797 . 1 . 1 61 61 ALA HB3 H 1 1.38 0.02 . 1 . . . . . 2209 ALA HB . 50336 1 798 . 1 . 1 61 61 ALA CA C 13 53.91 0.20 . 1 . . . . . 2209 ALA CA . 50336 1 799 . 1 . 1 61 61 ALA CB C 13 19.23 0.20 . 1 . . . . . 2209 ALA CB . 50336 1 800 . 1 . 1 61 61 ALA N N 15 130.47 0.20 . 1 . . . . . 2209 ALA N . 50336 1 stop_ save_