data_26870 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 26870 _Entry.Title ; NMR chemical shifts of the N-terminal SH3 domain from CT10-Regulator of Kinase (Crk)-II ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2016-08-08 _Entry.Accession_date 2016-08-08 _Entry.Last_release_date 2016-08-09 _Entry.Original_release_date 2016-08-09 _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 Danyun Zeng . . . . 26870 2 Jae-Hyun Cho . . . . 26870 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . 'Department of Biochemistry & Biophysics, Texas A&M University' . 26870 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 26870 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 391 26870 '15N chemical shifts' 91 26870 '1H chemical shifts' 577 26870 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 . . 2019-07-10 . original BMRB . 26870 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 26870 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI 10.1016/j.bpj.2016.09.029 _Citation.PubMed_ID 27806266 _Citation.Full_citation . _Citation.Title ; Kinetic Insights into the Binding between the nSH3 Domain of CrkII and Proline-Rich Motifs in cAbl. ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biophys. J.' _Citation.Journal_name_full 'Biophysical journal' _Citation.Journal_volume 111 _Citation.Journal_issue 9 _Citation.Journal_ASTM . _Citation.Journal_ISSN 1542-0086 _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 1843 _Citation.Page_last 1853 _Citation.Year 2016 _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 Danyun Zeng . . . . 26870 1 2 Veer Bhatt . S. . . 26870 1 3 Qingliang Shen . . . . 26870 1 4 Jae-Hyun Cho . . . . 26870 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 26870 _Assembly.ID 1 _Assembly.Name 'nSH3 of CrkII' _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 . _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 'N-terminal SH3' 1 $nSH3_of_CrkII A . yes native no no . . . 26870 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_nSH3_of_CrkII _Entity.Sf_category entity _Entity.Sf_framecode nSH3_of_CrkII _Entity.Entry_ID 26870 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name nSH3_of_CrkII _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 ; SGVILRQEEAEYVRALFDFN GNDEEDLPFKKGDILRIRDK PEEQWWNAEDSEGKRGMIPV PYVEKYRPASASVSALIGGN QEG ; _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 83 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID 'binding to proline-rich motifs' 26870 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 1 125 SER . 26870 1 2 126 GLY . 26870 1 3 127 VAL . 26870 1 4 128 ILE . 26870 1 5 129 LEU . 26870 1 6 130 ARG . 26870 1 7 131 GLN . 26870 1 8 132 GLU . 26870 1 9 133 GLU . 26870 1 10 134 ALA . 26870 1 11 135 GLU . 26870 1 12 136 TYR . 26870 1 13 137 VAL . 26870 1 14 138 ARG . 26870 1 15 139 ALA . 26870 1 16 140 LEU . 26870 1 17 141 PHE . 26870 1 18 142 ASP . 26870 1 19 143 PHE . 26870 1 20 144 ASN . 26870 1 21 145 GLY . 26870 1 22 146 ASN . 26870 1 23 147 ASP . 26870 1 24 148 GLU . 26870 1 25 149 GLU . 26870 1 26 150 ASP . 26870 1 27 151 LEU . 26870 1 28 152 PRO . 26870 1 29 153 PHE . 26870 1 30 154 LYS . 26870 1 31 155 LYS . 26870 1 32 156 GLY . 26870 1 33 157 ASP . 26870 1 34 158 ILE . 26870 1 35 159 LEU . 26870 1 36 160 ARG . 26870 1 37 161 ILE . 26870 1 38 162 ARG . 26870 1 39 163 ASP . 26870 1 40 164 LYS . 26870 1 41 165 PRO . 26870 1 42 166 GLU . 26870 1 43 167 GLU . 26870 1 44 168 GLN . 26870 1 45 169 TRP . 26870 1 46 170 TRP . 26870 1 47 171 ASN . 26870 1 48 172 ALA . 26870 1 49 173 GLU . 26870 1 50 174 ASP . 26870 1 51 175 SER . 26870 1 52 176 GLU . 26870 1 53 177 GLY . 26870 1 54 178 LYS . 26870 1 55 179 ARG . 26870 1 56 180 GLY . 26870 1 57 181 MET . 26870 1 58 182 ILE . 26870 1 59 183 PRO . 26870 1 60 184 VAL . 26870 1 61 185 PRO . 26870 1 62 186 TYR . 26870 1 63 187 VAL . 26870 1 64 188 GLU . 26870 1 65 189 LYS . 26870 1 66 190 TYR . 26870 1 67 191 ARG . 26870 1 68 192 PRO . 26870 1 69 193 ALA . 26870 1 70 194 SER . 26870 1 71 195 ALA . 26870 1 72 196 SER . 26870 1 73 197 VAL . 26870 1 74 198 SER . 26870 1 75 199 ALA . 26870 1 76 200 LEU . 26870 1 77 201 ILE . 26870 1 78 202 GLY . 26870 1 79 203 GLY . 26870 1 80 204 ASN . 26870 1 81 205 GLN . 26870 1 82 206 GLU . 26870 1 83 207 GLY . 26870 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . SER 1 1 26870 1 . GLY 2 2 26870 1 . VAL 3 3 26870 1 . ILE 4 4 26870 1 . LEU 5 5 26870 1 . ARG 6 6 26870 1 . GLN 7 7 26870 1 . GLU 8 8 26870 1 . GLU 9 9 26870 1 . ALA 10 10 26870 1 . GLU 11 11 26870 1 . TYR 12 12 26870 1 . VAL 13 13 26870 1 . ARG 14 14 26870 1 . ALA 15 15 26870 1 . LEU 16 16 26870 1 . PHE 17 17 26870 1 . ASP 18 18 26870 1 . PHE 19 19 26870 1 . ASN 20 20 26870 1 . GLY 21 21 26870 1 . ASN 22 22 26870 1 . ASP 23 23 26870 1 . GLU 24 24 26870 1 . GLU 25 25 26870 1 . ASP 26 26 26870 1 . LEU 27 27 26870 1 . PRO 28 28 26870 1 . PHE 29 29 26870 1 . LYS 30 30 26870 1 . LYS 31 31 26870 1 . GLY 32 32 26870 1 . ASP 33 33 26870 1 . ILE 34 34 26870 1 . LEU 35 35 26870 1 . ARG 36 36 26870 1 . ILE 37 37 26870 1 . ARG 38 38 26870 1 . ASP 39 39 26870 1 . LYS 40 40 26870 1 . PRO 41 41 26870 1 . GLU 42 42 26870 1 . GLU 43 43 26870 1 . GLN 44 44 26870 1 . TRP 45 45 26870 1 . TRP 46 46 26870 1 . ASN 47 47 26870 1 . ALA 48 48 26870 1 . GLU 49 49 26870 1 . ASP 50 50 26870 1 . SER 51 51 26870 1 . GLU 52 52 26870 1 . GLY 53 53 26870 1 . LYS 54 54 26870 1 . ARG 55 55 26870 1 . GLY 56 56 26870 1 . MET 57 57 26870 1 . ILE 58 58 26870 1 . PRO 59 59 26870 1 . VAL 60 60 26870 1 . PRO 61 61 26870 1 . TYR 62 62 26870 1 . VAL 63 63 26870 1 . GLU 64 64 26870 1 . LYS 65 65 26870 1 . TYR 66 66 26870 1 . ARG 67 67 26870 1 . PRO 68 68 26870 1 . ALA 69 69 26870 1 . SER 70 70 26870 1 . ALA 71 71 26870 1 . SER 72 72 26870 1 . VAL 73 73 26870 1 . SER 74 74 26870 1 . ALA 75 75 26870 1 . LEU 76 76 26870 1 . ILE 77 77 26870 1 . GLY 78 78 26870 1 . GLY 79 79 26870 1 . ASN 80 80 26870 1 . GLN 81 81 26870 1 . GLU 82 82 26870 1 . GLY 83 83 26870 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 26870 _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 $nSH3_of_CrkII . 10090 organism . 'Mus musculus' 'house mouse' . . Eukaryota Metazoa Mus musculus . . . . . . . . . . . . . 26870 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 26870 _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 $nSH3_of_CrkII . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . pTrcHisA . . . 26870 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 26870 _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 'nSH3 of CrkII' '[U-99% 13C; U-99% 15N]' . . 1 $nSH3_of_CrkII . . 300 . . uM . . . . 26870 1 2 H2O 'natural abundance' . . . . . . 90 . . % . . . . 26870 1 3 D2O 'natural abundance' . . . . . . 10 . . % . . . . 26870 1 4 'sodium phosphate' 'natural abundance' . . . . . . 20 . . mM . . . . 26870 1 5 NaCl 'natural abundance' . . . . . . 80 . . mM . . . . 26870 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 26870 _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' 80 . mM 26870 1 pH 6.1 . pH 26870 1 pressure 1 . atm 26870 1 temperature 298 . K 26870 1 stop_ save_ ############################ # Computer software used # ############################ save_CARA _Software.Sf_category software _Software.Sf_framecode CARA _Software.Entry_ID 26870 _Software.ID 1 _Software.Type . _Software.Name CARA _Software.Version 1.9.1.4 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Keller and Wuthrich' . . 26870 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 26870 1 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 26870 _Software.ID 2 _Software.Type . _Software.Name NMRPipe _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 26870 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 26870 2 stop_ save_ save_TOPSPIN _Software.Sf_category software _Software.Sf_framecode TOPSPIN _Software.Entry_ID 26870 _Software.ID 3 _Software.Type . _Software.Name TOPSPIN _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 26870 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 26870 3 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 26870 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 26870 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 26870 _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 . 800 . . . 26870 1 2 spectrometer_2 Bruker Avance . 600 . . . 26870 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 26870 _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 . . . . . . . . . . . . . . . . . . . . . 26870 1 2 '2D 1H-13C HSQC aliphatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 26870 1 3 '2D 1H-13C HSQC aromatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 26870 1 4 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 26870 1 5 '3D HNCACO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 26870 1 6 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 26870 1 7 '3D HN(CO)CA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 26870 1 8 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 26870 1 9 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 26870 1 10 '3D HBHA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 26870 1 11 '3D C(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 26870 1 12 '3D H(CCO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 26870 1 13 '3D HCCH-TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 26870 1 14 '3D 1H-13C NOESY aromatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 26870 1 15 '3D 1H-13C TOCSY aromatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 26870 1 16 '2D (HB)CB(CDCG)HG' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 26870 1 17 '2D (HB)CB(CDCGCE)HE' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 26870 1 18 '2D CO(side-chain carboxyl)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 26870 1 19 '2D H(C)CO(side-chain carboxyl)' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 26870 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 26870 _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 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . 26870 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . 26870 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . 26870 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 26870 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 26870 1 2 '2D 1H-13C HSQC aliphatic' . . . 26870 1 3 '2D 1H-13C HSQC aromatic' . . . 26870 1 4 '3D HNCO' . . . 26870 1 5 '3D HNCACO' . . . 26870 1 6 '3D HNCA' . . . 26870 1 7 '3D HN(CO)CA' . . . 26870 1 8 '3D HNCACB' . . . 26870 1 9 '3D CBCA(CO)NH' . . . 26870 1 10 '3D HBHA(CO)NH' . . . 26870 1 11 '3D C(CO)NH' . . . 26870 1 12 '3D H(CCO)NH' . . . 26870 1 13 '3D HCCH-TOCSY' . . . 26870 1 14 '3D 1H-13C NOESY aromatic' . . . 26870 1 15 '3D 1H-13C TOCSY aromatic' . . . 26870 1 16 '2D (HB)CB(CDCG)HG' . . . 26870 1 17 '2D (HB)CB(CDCGCE)HE' . . . 26870 1 18 '2D CO(side-chain carboxyl)NH' . . . 26870 1 19 '2D H(C)CO(side-chain carboxyl)' . . . 26870 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 SER HA H 1 4.496 0.02 . 1 . . . . . 125 SER HA . 26870 1 2 . 1 1 1 1 SER HB2 H 1 3.861 0.02 . 1 . . . . . 125 SER HB2 . 26870 1 3 . 1 1 1 1 SER HB3 H 1 3.861 0.02 . 1 . . . . . 125 SER HB3 . 26870 1 4 . 1 1 1 1 SER C C 13 174.909 0.3 . 1 . . . . . 125 SER C . 26870 1 5 . 1 1 1 1 SER CA C 13 58.241 0.3 . 1 . . . . . 125 SER CA . 26870 1 6 . 1 1 1 1 SER CB C 13 63.722 0.3 . 1 . . . . . 125 SER CB . 26870 1 7 . 1 1 2 2 GLY H H 1 8.593 0.02 . 1 . . . . . 126 GLY H . 26870 1 8 . 1 1 2 2 GLY HA2 H 1 3.965 0.02 . 1 . . . . . 126 GLY HA2 . 26870 1 9 . 1 1 2 2 GLY HA3 H 1 3.965 0.02 . 1 . . . . . 126 GLY HA3 . 26870 1 10 . 1 1 2 2 GLY C C 13 173.802 0.3 . 1 . . . . . 126 GLY C . 26870 1 11 . 1 1 2 2 GLY CA C 13 44.926 0.3 . 1 . . . . . 126 GLY CA . 26870 1 12 . 1 1 2 2 GLY N N 15 111.276 0.3 . 1 . . . . . 126 GLY N . 26870 1 13 . 1 1 3 3 VAL H H 1 7.998 0.02 . 1 . . . . . 127 VAL H . 26870 1 14 . 1 1 3 3 VAL HA H 1 4.069 0.02 . 1 . . . . . 127 VAL HA . 26870 1 15 . 1 1 3 3 VAL HB H 1 1.981 0.02 . 1 . . . . . 127 VAL HB . 26870 1 16 . 1 1 3 3 VAL HG11 H 1 0.852 0.02 . 2 . . . . . 127 VAL HG1 . 26870 1 17 . 1 1 3 3 VAL HG12 H 1 0.852 0.02 . 2 . . . . . 127 VAL HG1 . 26870 1 18 . 1 1 3 3 VAL HG13 H 1 0.852 0.02 . 2 . . . . . 127 VAL HG1 . 26870 1 19 . 1 1 3 3 VAL HG21 H 1 0.876 0.02 . 2 . . . . . 127 VAL HG2 . 26870 1 20 . 1 1 3 3 VAL HG22 H 1 0.876 0.02 . 2 . . . . . 127 VAL HG2 . 26870 1 21 . 1 1 3 3 VAL HG23 H 1 0.876 0.02 . 2 . . . . . 127 VAL HG2 . 26870 1 22 . 1 1 3 3 VAL C C 13 175.913 0.3 . 1 . . . . . 127 VAL C . 26870 1 23 . 1 1 3 3 VAL CA C 13 62.257 0.3 . 1 . . . . . 127 VAL CA . 26870 1 24 . 1 1 3 3 VAL CB C 13 32.672 0.3 . 1 . . . . . 127 VAL CB . 26870 1 25 . 1 1 3 3 VAL CG1 C 13 20.886 0.3 . 1 . . . . . 127 VAL CG1 . 26870 1 26 . 1 1 3 3 VAL CG2 C 13 20.474 0.3 . 1 . . . . . 127 VAL CG2 . 26870 1 27 . 1 1 3 3 VAL N N 15 119.842 0.3 . 1 . . . . . 127 VAL N . 26870 1 28 . 1 1 4 4 ILE H H 1 8.302 0.02 . 1 . . . . . 128 ILE H . 26870 1 29 . 1 1 4 4 ILE HA H 1 4.121 0.02 . 1 . . . . . 128 ILE HA . 26870 1 30 . 1 1 4 4 ILE HB H 1 1.777 0.02 . 1 . . . . . 128 ILE HB . 26870 1 31 . 1 1 4 4 ILE HG12 H 1 1.442 0.02 . 2 . . . . . 128 ILE HG12 . 26870 1 32 . 1 1 4 4 ILE HG13 H 1 1.121 0.02 . 2 . . . . . 128 ILE HG13 . 26870 1 33 . 1 1 4 4 ILE HG21 H 1 0.815 0.02 . 1 . . . . . 128 ILE HG2 . 26870 1 34 . 1 1 4 4 ILE HG22 H 1 0.815 0.02 . 1 . . . . . 128 ILE HG2 . 26870 1 35 . 1 1 4 4 ILE HG23 H 1 0.815 0.02 . 1 . . . . . 128 ILE HG2 . 26870 1 36 . 1 1 4 4 ILE HD11 H 1 0.782 0.02 . 1 . . . . . 128 ILE HD1 . 26870 1 37 . 1 1 4 4 ILE HD12 H 1 0.782 0.02 . 1 . . . . . 128 ILE HD1 . 26870 1 38 . 1 1 4 4 ILE HD13 H 1 0.782 0.02 . 1 . . . . . 128 ILE HD1 . 26870 1 39 . 1 1 4 4 ILE C C 13 175.875 0.3 . 1 . . . . . 128 ILE C . 26870 1 40 . 1 1 4 4 ILE CA C 13 60.723 0.3 . 1 . . . . . 128 ILE CA . 26870 1 41 . 1 1 4 4 ILE CB C 13 38.269 0.3 . 1 . . . . . 128 ILE CB . 26870 1 42 . 1 1 4 4 ILE CG1 C 13 26.982 0.3 . 1 . . . . . 128 ILE CG1 . 26870 1 43 . 1 1 4 4 ILE CG2 C 13 17.255 0.3 . 1 . . . . . 128 ILE CG2 . 26870 1 44 . 1 1 4 4 ILE CD1 C 13 12.443 0.3 . 1 . . . . . 128 ILE CD1 . 26870 1 45 . 1 1 4 4 ILE N N 15 125.941 0.3 . 1 . . . . . 128 ILE N . 26870 1 46 . 1 1 5 5 LEU H H 1 8.39 0.02 . 1 . . . . . 129 LEU H . 26870 1 47 . 1 1 5 5 LEU HA H 1 4.35 0.02 . 1 . . . . . 129 LEU HA . 26870 1 48 . 1 1 5 5 LEU HB2 H 1 1.564 0.02 . 1 . . . . . 129 LEU HB2 . 26870 1 49 . 1 1 5 5 LEU HB3 H 1 1.564 0.02 . 1 . . . . . 129 LEU HB3 . 26870 1 50 . 1 1 5 5 LEU HG H 1 1.512 0.02 . 1 . . . . . 129 LEU HG . 26870 1 51 . 1 1 5 5 LEU HD11 H 1 0.861 0.02 . 2 . . . . . 129 LEU HD1 . 26870 1 52 . 1 1 5 5 LEU HD12 H 1 0.861 0.02 . 2 . . . . . 129 LEU HD1 . 26870 1 53 . 1 1 5 5 LEU HD13 H 1 0.861 0.02 . 2 . . . . . 129 LEU HD1 . 26870 1 54 . 1 1 5 5 LEU HD21 H 1 0.798 0.02 . 2 . . . . . 129 LEU HD2 . 26870 1 55 . 1 1 5 5 LEU HD22 H 1 0.798 0.02 . 2 . . . . . 129 LEU HD2 . 26870 1 56 . 1 1 5 5 LEU HD23 H 1 0.798 0.02 . 2 . . . . . 129 LEU HD2 . 26870 1 57 . 1 1 5 5 LEU C C 13 176.859 0.3 . 1 . . . . . 129 LEU C . 26870 1 58 . 1 1 5 5 LEU CA C 13 54.492 0.3 . 1 . . . . . 129 LEU CA . 26870 1 59 . 1 1 5 5 LEU CB C 13 42.121 0.3 . 1 . . . . . 129 LEU CB . 26870 1 60 . 1 1 5 5 LEU CG C 13 26.879 0.3 . 1 . . . . . 129 LEU CG . 26870 1 61 . 1 1 5 5 LEU CD1 C 13 24.658 0.3 . 1 . . . . . 129 LEU CD1 . 26870 1 62 . 1 1 5 5 LEU CD2 C 13 23.408 0.3 . 1 . . . . . 129 LEU CD2 . 26870 1 63 . 1 1 5 5 LEU N N 15 127.713 0.3 . 1 . . . . . 129 LEU N . 26870 1 64 . 1 1 6 6 ARG H H 1 8.392 0.02 . 1 . . . . . 130 ARG H . 26870 1 65 . 1 1 6 6 ARG HA H 1 4.308 0.02 . 1 . . . . . 130 ARG HA . 26870 1 66 . 1 1 6 6 ARG HB2 H 1 1.798 0.02 . 2 . . . . . 130 ARG HB2 . 26870 1 67 . 1 1 6 6 ARG HB3 H 1 1.705 0.02 . 2 . . . . . 130 ARG HB3 . 26870 1 68 . 1 1 6 6 ARG HG2 H 1 1.58 0.02 . 2 . . . . . 130 ARG HG2 . 26870 1 69 . 1 1 6 6 ARG HG3 H 1 1.532 0.02 . 2 . . . . . 130 ARG HG3 . 26870 1 70 . 1 1 6 6 ARG HD2 H 1 3.137 0.02 . 1 . . . . . 130 ARG HD2 . 26870 1 71 . 1 1 6 6 ARG HD3 H 1 3.137 0.02 . 1 . . . . . 130 ARG HD3 . 26870 1 72 . 1 1 6 6 ARG HE H 1 7.268 0.02 . 1 . . . . . 130 ARG HE . 26870 1 73 . 1 1 6 6 ARG C C 13 176.058 0.3 . 1 . . . . . 130 ARG C . 26870 1 74 . 1 1 6 6 ARG CA C 13 55.853 0.3 . 1 . . . . . 130 ARG CA . 26870 1 75 . 1 1 6 6 ARG CB C 13 30.655 0.3 . 1 . . . . . 130 ARG CB . 26870 1 76 . 1 1 6 6 ARG CG C 13 26.892 0.3 . 1 . . . . . 130 ARG CG . 26870 1 77 . 1 1 6 6 ARG CD C 13 42.994 0.3 . 1 . . . . . 130 ARG CD . 26870 1 78 . 1 1 6 6 ARG N N 15 122.676 0.3 . 1 . . . . . 130 ARG N . 26870 1 79 . 1 1 6 6 ARG NE N 15 84.677 0.3 . 1 . . . . . 130 ARG NE . 26870 1 80 . 1 1 7 7 GLN H H 1 8.512 0.02 . 1 . . . . . 131 GLN H . 26870 1 81 . 1 1 7 7 GLN HA H 1 4.308 0.02 . 1 . . . . . 131 GLN HA . 26870 1 82 . 1 1 7 7 GLN HB2 H 1 2.05 0.02 . 2 . . . . . 131 GLN HB2 . 26870 1 83 . 1 1 7 7 GLN HB3 H 1 1.963 0.02 . 2 . . . . . 131 GLN HB3 . 26870 1 84 . 1 1 7 7 GLN HG2 H 1 2.322 0.02 . 1 . . . . . 131 GLN HG2 . 26870 1 85 . 1 1 7 7 GLN HG3 H 1 2.322 0.02 . 1 . . . . . 131 GLN HG3 . 26870 1 86 . 1 1 7 7 GLN HE21 H 1 7.559 0.02 . 1 . . . . . 131 GLN HE21 . 26870 1 87 . 1 1 7 7 GLN HE22 H 1 6.851 0.02 . 1 . . . . . 131 GLN HE22 . 26870 1 88 . 1 1 7 7 GLN C C 13 175.884 0.3 . 1 . . . . . 131 GLN C . 26870 1 89 . 1 1 7 7 GLN CA C 13 55.615 0.3 . 1 . . . . . 131 GLN CA . 26870 1 90 . 1 1 7 7 GLN CB C 13 29.245 0.3 . 1 . . . . . 131 GLN CB . 26870 1 91 . 1 1 7 7 GLN CG C 13 33.434 0.3 . 1 . . . . . 131 GLN CG . 26870 1 92 . 1 1 7 7 GLN CD C 13 180.425 0.3 . 1 . . . . . 131 GLN CD . 26870 1 93 . 1 1 7 7 GLN N N 15 122.386 0.3 . 1 . . . . . 131 GLN N . 26870 1 94 . 1 1 7 7 GLN NE2 N 15 112.373 0.3 . 1 . . . . . 131 GLN NE2 . 26870 1 95 . 1 1 8 8 GLU H H 1 8.613 0.02 . 1 . . . . . 132 GLU H . 26870 1 96 . 1 1 8 8 GLU HA H 1 4.259 0.02 . 1 . . . . . 132 GLU HA . 26870 1 97 . 1 1 8 8 GLU HB2 H 1 2.018 0.02 . 2 . . . . . 132 GLU HB2 . 26870 1 98 . 1 1 8 8 GLU HB3 H 1 1.914 0.02 . 2 . . . . . 132 GLU HB3 . 26870 1 99 . 1 1 8 8 GLU HG2 H 1 2.24 0.02 . 2 . . . . . 132 GLU HG2 . 26870 1 100 . 1 1 8 8 GLU HG3 H 1 2.212 0.02 . 2 . . . . . 132 GLU HG3 . 26870 1 101 . 1 1 8 8 GLU C C 13 176.291 0.3 . 1 . . . . . 132 GLU C . 26870 1 102 . 1 1 8 8 GLU CA C 13 56.562 0.3 . 1 . . . . . 132 GLU CA . 26870 1 103 . 1 1 8 8 GLU CB C 13 30.01 0.3 . 1 . . . . . 132 GLU CB . 26870 1 104 . 1 1 8 8 GLU CG C 13 35.918 0.3 . 1 . . . . . 132 GLU CG . 26870 1 105 . 1 1 8 8 GLU CD C 13 183.867 0.3 . 1 . . . . . 132 GLU CD . 26870 1 106 . 1 1 8 8 GLU N N 15 122.319 0.3 . 1 . . . . . 132 GLU N . 26870 1 107 . 1 1 9 9 GLU H H 1 8.435 0.02 . 1 . . . . . 133 GLU H . 26870 1 108 . 1 1 9 9 GLU HA H 1 4.26 0.02 . 1 . . . . . 133 GLU HA . 26870 1 109 . 1 1 9 9 GLU HB2 H 1 2.015 0.02 . 2 . . . . . 133 GLU HB2 . 26870 1 110 . 1 1 9 9 GLU HB3 H 1 1.915 0.02 . 2 . . . . . 133 GLU HB3 . 26870 1 111 . 1 1 9 9 GLU HG2 H 1 2.239 0.02 . 1 . . . . . 133 GLU HG2 . 26870 1 112 . 1 1 9 9 GLU HG3 H 1 2.239 0.02 . 1 . . . . . 133 GLU HG3 . 26870 1 113 . 1 1 9 9 GLU C C 13 175.802 0.3 . 1 . . . . . 133 GLU C . 26870 1 114 . 1 1 9 9 GLU CA C 13 56.313 0.3 . 1 . . . . . 133 GLU CA . 26870 1 115 . 1 1 9 9 GLU CB C 13 30.219 0.3 . 1 . . . . . 133 GLU CB . 26870 1 116 . 1 1 9 9 GLU CG C 13 35.857 0.3 . 1 . . . . . 133 GLU CG . 26870 1 117 . 1 1 9 9 GLU CD C 13 183.975 0.3 . 1 . . . . . 133 GLU CD . 26870 1 118 . 1 1 9 9 GLU N N 15 122.183 0.3 . 1 . . . . . 133 GLU N . 26870 1 119 . 1 1 10 10 ALA H H 1 8.27 0.02 . 1 . . . . . 134 ALA H . 26870 1 120 . 1 1 10 10 ALA HA H 1 4.169 0.02 . 1 . . . . . 134 ALA HA . 26870 1 121 . 1 1 10 10 ALA HB1 H 1 1.16 0.02 . 1 . . . . . 134 ALA HB . 26870 1 122 . 1 1 10 10 ALA HB2 H 1 1.16 0.02 . 1 . . . . . 134 ALA HB . 26870 1 123 . 1 1 10 10 ALA HB3 H 1 1.16 0.02 . 1 . . . . . 134 ALA HB . 26870 1 124 . 1 1 10 10 ALA C C 13 175.417 0.3 . 1 . . . . . 134 ALA C . 26870 1 125 . 1 1 10 10 ALA CA C 13 51.935 0.3 . 1 . . . . . 134 ALA CA . 26870 1 126 . 1 1 10 10 ALA CB C 13 19.811 0.3 . 1 . . . . . 134 ALA CB . 26870 1 127 . 1 1 10 10 ALA N N 15 125.646 0.3 . 1 . . . . . 134 ALA N . 26870 1 128 . 1 1 11 11 GLU H H 1 8.483 0.02 . 1 . . . . . 135 GLU H . 26870 1 129 . 1 1 11 11 GLU HA H 1 4.449 0.02 . 1 . . . . . 135 GLU HA . 26870 1 130 . 1 1 11 11 GLU HB2 H 1 1.848 0.02 . 2 . . . . . 135 GLU HB2 . 26870 1 131 . 1 1 11 11 GLU HB3 H 1 1.751 0.02 . 2 . . . . . 135 GLU HB3 . 26870 1 132 . 1 1 11 11 GLU HG2 H 1 2.2 0.02 . 2 . . . . . 135 GLU HG2 . 26870 1 133 . 1 1 11 11 GLU HG3 H 1 1.918 0.02 . 2 . . . . . 135 GLU HG3 . 26870 1 134 . 1 1 11 11 GLU C C 13 174.08 0.3 . 1 . . . . . 135 GLU C . 26870 1 135 . 1 1 11 11 GLU CA C 13 55.402 0.3 . 1 . . . . . 135 GLU CA . 26870 1 136 . 1 1 11 11 GLU CB C 13 31.638 0.3 . 1 . . . . . 135 GLU CB . 26870 1 137 . 1 1 11 11 GLU CG C 13 36.056 0.3 . 1 . . . . . 135 GLU CG . 26870 1 138 . 1 1 11 11 GLU CD C 13 183.124 0.3 . 1 . . . . . 135 GLU CD . 26870 1 139 . 1 1 11 11 GLU N N 15 123.01 0.3 . 1 . . . . . 135 GLU N . 26870 1 140 . 1 1 12 12 TYR H H 1 9.002 0.02 . 1 . . . . . 136 TYR H . 26870 1 141 . 1 1 12 12 TYR HA H 1 5.649 0.02 . 1 . . . . . 136 TYR HA . 26870 1 142 . 1 1 12 12 TYR HB2 H 1 3.137 0.02 . 2 . . . . . 136 TYR HB2 . 26870 1 143 . 1 1 12 12 TYR HB3 H 1 3.009 0.02 . 2 . . . . . 136 TYR HB3 . 26870 1 144 . 1 1 12 12 TYR HD1 H 1 7.031 0.02 . 1 . . . . . 136 TYR HD1 . 26870 1 145 . 1 1 12 12 TYR HD2 H 1 7.031 0.02 . 1 . . . . . 136 TYR HD2 . 26870 1 146 . 1 1 12 12 TYR HE1 H 1 6.77 0.02 . 1 . . . . . 136 TYR HE1 . 26870 1 147 . 1 1 12 12 TYR HE2 H 1 6.77 0.02 . 1 . . . . . 136 TYR HE2 . 26870 1 148 . 1 1 12 12 TYR C C 13 175.955 0.3 . 1 . . . . . 136 TYR C . 26870 1 149 . 1 1 12 12 TYR CA C 13 56.582 0.3 . 1 . . . . . 136 TYR CA . 26870 1 150 . 1 1 12 12 TYR CB C 13 42.132 0.3 . 1 . . . . . 136 TYR CB . 26870 1 151 . 1 1 12 12 TYR CD1 C 13 133.271 0.3 . 1 . . . . . 136 TYR CD1 . 26870 1 152 . 1 1 12 12 TYR CD2 C 13 133.271 0.3 . 1 . . . . . 136 TYR CD2 . 26870 1 153 . 1 1 12 12 TYR CE1 C 13 117.654 0.3 . 1 . . . . . 136 TYR CE1 . 26870 1 154 . 1 1 12 12 TYR CE2 C 13 117.654 0.3 . 1 . . . . . 136 TYR CE2 . 26870 1 155 . 1 1 12 12 TYR N N 15 122.546 0.3 . 1 . . . . . 136 TYR N . 26870 1 156 . 1 1 13 13 VAL H H 1 9.305 0.02 . 1 . . . . . 137 VAL H . 26870 1 157 . 1 1 13 13 VAL HA H 1 5.237 0.02 . 1 . . . . . 137 VAL HA . 26870 1 158 . 1 1 13 13 VAL HB H 1 2.05 0.02 . 1 . . . . . 137 VAL HB . 26870 1 159 . 1 1 13 13 VAL HG11 H 1 0.927 0.02 . 2 . . . . . 137 VAL HG1 . 26870 1 160 . 1 1 13 13 VAL HG12 H 1 0.927 0.02 . 2 . . . . . 137 VAL HG1 . 26870 1 161 . 1 1 13 13 VAL HG13 H 1 0.927 0.02 . 2 . . . . . 137 VAL HG1 . 26870 1 162 . 1 1 13 13 VAL HG21 H 1 0.605 0.02 . 2 . . . . . 137 VAL HG2 . 26870 1 163 . 1 1 13 13 VAL HG22 H 1 0.605 0.02 . 2 . . . . . 137 VAL HG2 . 26870 1 164 . 1 1 13 13 VAL HG23 H 1 0.605 0.02 . 2 . . . . . 137 VAL HG2 . 26870 1 165 . 1 1 13 13 VAL C C 13 173.046 0.3 . 1 . . . . . 137 VAL C . 26870 1 166 . 1 1 13 13 VAL CA C 13 58.484 0.3 . 1 . . . . . 137 VAL CA . 26870 1 167 . 1 1 13 13 VAL CB C 13 35.968 0.3 . 1 . . . . . 137 VAL CB . 26870 1 168 . 1 1 13 13 VAL CG1 C 13 21.705 0.3 . 1 . . . . . 137 VAL CG1 . 26870 1 169 . 1 1 13 13 VAL CG2 C 13 19.264 0.3 . 1 . . . . . 137 VAL CG2 . 26870 1 170 . 1 1 13 13 VAL N N 15 112.145 0.3 . 1 . . . . . 137 VAL N . 26870 1 171 . 1 1 14 14 ARG H H 1 9.322 0.02 . 1 . . . . . 138 ARG H . 26870 1 172 . 1 1 14 14 ARG HA H 1 5.22 0.02 . 1 . . . . . 138 ARG HA . 26870 1 173 . 1 1 14 14 ARG HB2 H 1 1.75 0.02 . 2 . . . . . 138 ARG HB2 . 26870 1 174 . 1 1 14 14 ARG HB3 H 1 1.087 0.02 . 2 . . . . . 138 ARG HB3 . 26870 1 175 . 1 1 14 14 ARG HG2 H 1 1.263 0.02 . 1 . . . . . 138 ARG HG2 . 26870 1 176 . 1 1 14 14 ARG HG3 H 1 1.263 0.02 . 1 . . . . . 138 ARG HG3 . 26870 1 177 . 1 1 14 14 ARG HD2 H 1 3.002 0.02 . 2 . . . . . 138 ARG HD2 . 26870 1 178 . 1 1 14 14 ARG HD3 H 1 2.772 0.02 . 2 . . . . . 138 ARG HD3 . 26870 1 179 . 1 1 14 14 ARG HE H 1 7.363 0.02 . 1 . . . . . 138 ARG HE . 26870 1 180 . 1 1 14 14 ARG C C 13 175.769 0.3 . 1 . . . . . 138 ARG C . 26870 1 181 . 1 1 14 14 ARG CA C 13 52.992 0.3 . 1 . . . . . 138 ARG CA . 26870 1 182 . 1 1 14 14 ARG CB C 13 33.926 0.3 . 1 . . . . . 138 ARG CB . 26870 1 183 . 1 1 14 14 ARG CG C 13 26.106 0.3 . 1 . . . . . 138 ARG CG . 26870 1 184 . 1 1 14 14 ARG CD C 13 43.691 0.3 . 1 . . . . . 138 ARG CD . 26870 1 185 . 1 1 14 14 ARG N N 15 120.895 0.3 . 1 . . . . . 138 ARG N . 26870 1 186 . 1 1 14 14 ARG NE N 15 83.213 0.3 . 1 . . . . . 138 ARG NE . 26870 1 187 . 1 1 15 15 ALA H H 1 8.952 0.02 . 1 . . . . . 139 ALA H . 26870 1 188 . 1 1 15 15 ALA HA H 1 4.332 0.02 . 1 . . . . . 139 ALA HA . 26870 1 189 . 1 1 15 15 ALA HB1 H 1 1.586 0.02 . 1 . . . . . 139 ALA HB . 26870 1 190 . 1 1 15 15 ALA HB2 H 1 1.586 0.02 . 1 . . . . . 139 ALA HB . 26870 1 191 . 1 1 15 15 ALA HB3 H 1 1.586 0.02 . 1 . . . . . 139 ALA HB . 26870 1 192 . 1 1 15 15 ALA C C 13 179.036 0.3 . 1 . . . . . 139 ALA C . 26870 1 193 . 1 1 15 15 ALA CA C 13 52.885 0.3 . 1 . . . . . 139 ALA CA . 26870 1 194 . 1 1 15 15 ALA CB C 13 21.804 0.3 . 1 . . . . . 139 ALA CB . 26870 1 195 . 1 1 15 15 ALA N N 15 127.949 0.3 . 1 . . . . . 139 ALA N . 26870 1 196 . 1 1 16 16 LEU H H 1 9.662 0.02 . 1 . . . . . 140 LEU H . 26870 1 197 . 1 1 16 16 LEU HA H 1 3.974 0.02 . 1 . . . . . 140 LEU HA . 26870 1 198 . 1 1 16 16 LEU HB2 H 1 1.131 0.02 . 2 . . . . . 140 LEU HB2 . 26870 1 199 . 1 1 16 16 LEU HB3 H 1 0.616 0.02 . 2 . . . . . 140 LEU HB3 . 26870 1 200 . 1 1 16 16 LEU HG H 1 1.28 0.02 . 1 . . . . . 140 LEU HG . 26870 1 201 . 1 1 16 16 LEU HD11 H 1 0.646 0.02 . 2 . . . . . 140 LEU HD1 . 26870 1 202 . 1 1 16 16 LEU HD12 H 1 0.646 0.02 . 2 . . . . . 140 LEU HD1 . 26870 1 203 . 1 1 16 16 LEU HD13 H 1 0.646 0.02 . 2 . . . . . 140 LEU HD1 . 26870 1 204 . 1 1 16 16 LEU HD21 H 1 0.575 0.02 . 2 . . . . . 140 LEU HD2 . 26870 1 205 . 1 1 16 16 LEU HD22 H 1 0.575 0.02 . 2 . . . . . 140 LEU HD2 . 26870 1 206 . 1 1 16 16 LEU HD23 H 1 0.575 0.02 . 2 . . . . . 140 LEU HD2 . 26870 1 207 . 1 1 16 16 LEU C C 13 175.091 0.3 . 1 . . . . . 140 LEU C . 26870 1 208 . 1 1 16 16 LEU CA C 13 55.466 0.3 . 1 . . . . . 140 LEU CA . 26870 1 209 . 1 1 16 16 LEU CB C 13 43.433 0.3 . 1 . . . . . 140 LEU CB . 26870 1 210 . 1 1 16 16 LEU CG C 13 26.638 0.3 . 1 . . . . . 140 LEU CG . 26870 1 211 . 1 1 16 16 LEU CD1 C 13 25.332 0.3 . 1 . . . . . 140 LEU CD1 . 26870 1 212 . 1 1 16 16 LEU CD2 C 13 21.957 0.3 . 1 . . . . . 140 LEU CD2 . 26870 1 213 . 1 1 16 16 LEU N N 15 125.917 0.3 . 1 . . . . . 140 LEU N . 26870 1 214 . 1 1 17 17 PHE H H 1 7.318 0.02 . 1 . . . . . 141 PHE H . 26870 1 215 . 1 1 17 17 PHE HA H 1 4.807 0.02 . 1 . . . . . 141 PHE HA . 26870 1 216 . 1 1 17 17 PHE HB2 H 1 3.289 0.02 . 2 . . . . . 141 PHE HB2 . 26870 1 217 . 1 1 17 17 PHE HB3 H 1 2.378 0.02 . 2 . . . . . 141 PHE HB3 . 26870 1 218 . 1 1 17 17 PHE HD1 H 1 6.941 0.02 . 1 . . . . . 141 PHE HD1 . 26870 1 219 . 1 1 17 17 PHE HD2 H 1 6.941 0.02 . 1 . . . . . 141 PHE HD2 . 26870 1 220 . 1 1 17 17 PHE HE1 H 1 7.151 0.02 . 1 . . . . . 141 PHE HE1 . 26870 1 221 . 1 1 17 17 PHE HE2 H 1 7.151 0.02 . 1 . . . . . 141 PHE HE2 . 26870 1 222 . 1 1 17 17 PHE C C 13 173.619 0.3 . 1 . . . . . 141 PHE C . 26870 1 223 . 1 1 17 17 PHE CA C 13 54.339 0.3 . 1 . . . . . 141 PHE CA . 26870 1 224 . 1 1 17 17 PHE CB C 13 43.765 0.3 . 1 . . . . . 141 PHE CB . 26870 1 225 . 1 1 17 17 PHE CD1 C 13 132.473 0.3 . 1 . . . . . 141 PHE CD1 . 26870 1 226 . 1 1 17 17 PHE CD2 C 13 132.473 0.3 . 1 . . . . . 141 PHE CD2 . 26870 1 227 . 1 1 17 17 PHE CE1 C 13 130.821 0.3 . 1 . . . . . 141 PHE CE1 . 26870 1 228 . 1 1 17 17 PHE CE2 C 13 130.821 0.3 . 1 . . . . . 141 PHE CE2 . 26870 1 229 . 1 1 17 17 PHE N N 15 112.832 0.3 . 1 . . . . . 141 PHE N . 26870 1 230 . 1 1 18 18 ASP H H 1 8.477 0.02 . 1 . . . . . 142 ASP H . 26870 1 231 . 1 1 18 18 ASP HA H 1 4.669 0.02 . 1 . . . . . 142 ASP HA . 26870 1 232 . 1 1 18 18 ASP HB2 H 1 2.75 0.02 . 2 . . . . . 142 ASP HB2 . 26870 1 233 . 1 1 18 18 ASP HB3 H 1 2.609 0.02 . 2 . . . . . 142 ASP HB3 . 26870 1 234 . 1 1 18 18 ASP C C 13 175.709 0.3 . 1 . . . . . 142 ASP C . 26870 1 235 . 1 1 18 18 ASP CA C 13 54.765 0.3 . 1 . . . . . 142 ASP CA . 26870 1 236 . 1 1 18 18 ASP CB C 13 41.432 0.3 . 1 . . . . . 142 ASP CB . 26870 1 237 . 1 1 18 18 ASP CG C 13 179.134 0.3 . 1 . . . . . 142 ASP CG . 26870 1 238 . 1 1 18 18 ASP N N 15 117.594 0.3 . 1 . . . . . 142 ASP N . 26870 1 239 . 1 1 19 19 PHE H H 1 8.423 0.02 . 1 . . . . . 143 PHE H . 26870 1 240 . 1 1 19 19 PHE HA H 1 4.879 0.02 . 1 . . . . . 143 PHE HA . 26870 1 241 . 1 1 19 19 PHE HB2 H 1 2.359 0.02 . 2 . . . . . 143 PHE HB2 . 26870 1 242 . 1 1 19 19 PHE HB3 H 1 0.928 0.02 . 2 . . . . . 143 PHE HB3 . 26870 1 243 . 1 1 19 19 PHE HD1 H 1 7.253 0.02 . 1 . . . . . 143 PHE HD1 . 26870 1 244 . 1 1 19 19 PHE HD2 H 1 7.253 0.02 . 1 . . . . . 143 PHE HD2 . 26870 1 245 . 1 1 19 19 PHE HE1 H 1 7.414 0.02 . 1 . . . . . 143 PHE HE1 . 26870 1 246 . 1 1 19 19 PHE HE2 H 1 7.414 0.02 . 1 . . . . . 143 PHE HE2 . 26870 1 247 . 1 1 19 19 PHE C C 13 173.892 0.3 . 1 . . . . . 143 PHE C . 26870 1 248 . 1 1 19 19 PHE CA C 13 55.702 0.3 . 1 . . . . . 143 PHE CA . 26870 1 249 . 1 1 19 19 PHE CB C 13 41.484 0.3 . 1 . . . . . 143 PHE CB . 26870 1 250 . 1 1 19 19 PHE CD1 C 13 133.271 0.3 . 1 . . . . . 143 PHE CD1 . 26870 1 251 . 1 1 19 19 PHE CD2 C 13 133.271 0.3 . 1 . . . . . 143 PHE CD2 . 26870 1 252 . 1 1 19 19 PHE CE1 C 13 131.281 0.3 . 1 . . . . . 143 PHE CE1 . 26870 1 253 . 1 1 19 19 PHE CE2 C 13 131.281 0.3 . 1 . . . . . 143 PHE CE2 . 26870 1 254 . 1 1 19 19 PHE N N 15 120.54 0.3 . 1 . . . . . 143 PHE N . 26870 1 255 . 1 1 20 20 ASN H H 1 8.562 0.02 . 1 . . . . . 144 ASN H . 26870 1 256 . 1 1 20 20 ASN HA H 1 4.466 0.02 . 1 . . . . . 144 ASN HA . 26870 1 257 . 1 1 20 20 ASN HB2 H 1 2.694 0.02 . 2 . . . . . 144 ASN HB2 . 26870 1 258 . 1 1 20 20 ASN HB3 H 1 2.493 0.02 . 2 . . . . . 144 ASN HB3 . 26870 1 259 . 1 1 20 20 ASN HD21 H 1 7.564 0.02 . 1 . . . . . 144 ASN HD21 . 26870 1 260 . 1 1 20 20 ASN HD22 H 1 6.958 0.02 . 1 . . . . . 144 ASN HD22 . 26870 1 261 . 1 1 20 20 ASN C C 13 175.224 0.3 . 1 . . . . . 144 ASN C . 26870 1 262 . 1 1 20 20 ASN CA C 13 52.908 0.3 . 1 . . . . . 144 ASN CA . 26870 1 263 . 1 1 20 20 ASN CB C 13 39.042 0.3 . 1 . . . . . 144 ASN CB . 26870 1 264 . 1 1 20 20 ASN CG C 13 176.87 0.3 . 1 . . . . . 144 ASN CG . 26870 1 265 . 1 1 20 20 ASN N N 15 124.642 0.3 . 1 . . . . . 144 ASN N . 26870 1 266 . 1 1 20 20 ASN ND2 N 15 113.149 0.3 . 1 . . . . . 144 ASN ND2 . 26870 1 267 . 1 1 21 21 GLY HA2 H 1 3.695 0.02 . 2 . . . . . 145 GLY HA2 . 26870 1 268 . 1 1 21 21 GLY HA3 H 1 2.971 0.02 . 2 . . . . . 145 GLY HA3 . 26870 1 269 . 1 1 21 21 GLY C C 13 171.937 0.3 . 1 . . . . . 145 GLY C . 26870 1 270 . 1 1 21 21 GLY CA C 13 45.256 0.3 . 1 . . . . . 145 GLY CA . 26870 1 271 . 1 1 22 22 ASN H H 1 9.442 0.02 . 1 . . . . . 146 ASN H . 26870 1 272 . 1 1 22 22 ASN HA H 1 4.735 0.02 . 1 . . . . . 146 ASN HA . 26870 1 273 . 1 1 22 22 ASN HB2 H 1 2.729 0.02 . 1 . . . . . 146 ASN HB2 . 26870 1 274 . 1 1 22 22 ASN HB3 H 1 2.729 0.02 . 1 . . . . . 146 ASN HB3 . 26870 1 275 . 1 1 22 22 ASN HD21 H 1 7.85 0.02 . 1 . . . . . 146 ASN HD21 . 26870 1 276 . 1 1 22 22 ASN HD22 H 1 7.021 0.02 . 1 . . . . . 146 ASN HD22 . 26870 1 277 . 1 1 22 22 ASN C C 13 174.566 0.3 . 1 . . . . . 146 ASN C . 26870 1 278 . 1 1 22 22 ASN CA C 13 53.642 0.3 . 1 . . . . . 146 ASN CA . 26870 1 279 . 1 1 22 22 ASN CB C 13 40.488 0.3 . 1 . . . . . 146 ASN CB . 26870 1 280 . 1 1 22 22 ASN CG C 13 177.306 0.3 . 1 . . . . . 146 ASN CG . 26870 1 281 . 1 1 22 22 ASN N N 15 119.361 0.3 . 1 . . . . . 146 ASN N . 26870 1 282 . 1 1 22 22 ASN ND2 N 15 113.754 0.3 . 1 . . . . . 146 ASN ND2 . 26870 1 283 . 1 1 23 23 ASP H H 1 8.165 0.02 . 1 . . . . . 147 ASP H . 26870 1 284 . 1 1 23 23 ASP HA H 1 4.705 0.02 . 1 . . . . . 147 ASP HA . 26870 1 285 . 1 1 23 23 ASP HB2 H 1 2.671 0.02 . 2 . . . . . 147 ASP HB2 . 26870 1 286 . 1 1 23 23 ASP HB3 H 1 2.588 0.02 . 2 . . . . . 147 ASP HB3 . 26870 1 287 . 1 1 23 23 ASP C C 13 177.138 0.3 . 1 . . . . . 147 ASP C . 26870 1 288 . 1 1 23 23 ASP CA C 13 53.454 0.3 . 1 . . . . . 147 ASP CA . 26870 1 289 . 1 1 23 23 ASP CB C 13 42.776 0.3 . 1 . . . . . 147 ASP CB . 26870 1 290 . 1 1 23 23 ASP CG C 13 179.927 0.3 . 1 . . . . . 147 ASP CG . 26870 1 291 . 1 1 23 23 ASP N N 15 120.253 0.3 . 1 . . . . . 147 ASP N . 26870 1 292 . 1 1 24 24 GLU H H 1 8.873 0.02 . 1 . . . . . 148 GLU H . 26870 1 293 . 1 1 24 24 GLU HA H 1 4.076 0.02 . 1 . . . . . 148 GLU HA . 26870 1 294 . 1 1 24 24 GLU HB2 H 1 2.036 0.02 . 1 . . . . . 148 GLU HB2 . 26870 1 295 . 1 1 24 24 GLU HB3 H 1 2.036 0.02 . 1 . . . . . 148 GLU HB3 . 26870 1 296 . 1 1 24 24 GLU HG2 H 1 2.302 0.02 . 1 . . . . . 148 GLU HG2 . 26870 1 297 . 1 1 24 24 GLU HG3 H 1 2.302 0.02 . 1 . . . . . 148 GLU HG3 . 26870 1 298 . 1 1 24 24 GLU C C 13 177.08 0.3 . 1 . . . . . 148 GLU C . 26870 1 299 . 1 1 24 24 GLU CA C 13 59.04 0.3 . 1 . . . . . 148 GLU CA . 26870 1 300 . 1 1 24 24 GLU CB C 13 29.453 0.3 . 1 . . . . . 148 GLU CB . 26870 1 301 . 1 1 24 24 GLU CG C 13 36.011 0.3 . 1 . . . . . 148 GLU CG . 26870 1 302 . 1 1 24 24 GLU CD C 13 183.878 0.3 . 1 . . . . . 148 GLU CD . 26870 1 303 . 1 1 24 24 GLU N N 15 121.62 0.3 . 1 . . . . . 148 GLU N . 26870 1 304 . 1 1 25 25 GLU H H 1 8.676 0.02 . 1 . . . . . 149 GLU H . 26870 1 305 . 1 1 25 25 GLU HA H 1 4.386 0.02 . 1 . . . . . 149 GLU HA . 26870 1 306 . 1 1 25 25 GLU HB2 H 1 2.13 0.02 . 2 . . . . . 149 GLU HB2 . 26870 1 307 . 1 1 25 25 GLU HB3 H 1 1.969 0.02 . 2 . . . . . 149 GLU HB3 . 26870 1 308 . 1 1 25 25 GLU HG2 H 1 2.228 0.02 . 1 . . . . . 149 GLU HG2 . 26870 1 309 . 1 1 25 25 GLU HG3 H 1 2.228 0.02 . 1 . . . . . 149 GLU HG3 . 26870 1 310 . 1 1 25 25 GLU C C 13 176.746 0.3 . 1 . . . . . 149 GLU C . 26870 1 311 . 1 1 25 25 GLU CA C 13 56.404 0.3 . 1 . . . . . 149 GLU CA . 26870 1 312 . 1 1 25 25 GLU CB C 13 29.069 0.3 . 1 . . . . . 149 GLU CB . 26870 1 313 . 1 1 25 25 GLU CG C 13 36.019 0.3 . 1 . . . . . 149 GLU CG . 26870 1 314 . 1 1 25 25 GLU CD C 13 183.796 0.3 . 1 . . . . . 149 GLU CD . 26870 1 315 . 1 1 25 25 GLU N N 15 116.249 0.3 . 1 . . . . . 149 GLU N . 26870 1 316 . 1 1 26 26 ASP H H 1 7.641 0.02 . 1 . . . . . 150 ASP H . 26870 1 317 . 1 1 26 26 ASP HA H 1 5.129 0.02 . 1 . . . . . 150 ASP HA . 26870 1 318 . 1 1 26 26 ASP HB2 H 1 2.831 0.02 . 2 . . . . . 150 ASP HB2 . 26870 1 319 . 1 1 26 26 ASP HB3 H 1 2.779 0.02 . 2 . . . . . 150 ASP HB3 . 26870 1 320 . 1 1 26 26 ASP C C 13 175.389 0.3 . 1 . . . . . 150 ASP C . 26870 1 321 . 1 1 26 26 ASP CA C 13 54.462 0.3 . 1 . . . . . 150 ASP CA . 26870 1 322 . 1 1 26 26 ASP CB C 13 41.622 0.3 . 1 . . . . . 150 ASP CB . 26870 1 323 . 1 1 26 26 ASP CG C 13 176.547 0.3 . 1 . . . . . 150 ASP CG . 26870 1 324 . 1 1 26 26 ASP N N 15 121.459 0.3 . 1 . . . . . 150 ASP N . 26870 1 325 . 1 1 27 27 LEU H H 1 9.285 0.02 . 1 . . . . . 151 LEU H . 26870 1 326 . 1 1 27 27 LEU HA H 1 4.919 0.02 . 1 . . . . . 151 LEU HA . 26870 1 327 . 1 1 27 27 LEU HB2 H 1 2.038 0.02 . 1 . . . . . 151 LEU HB2 . 26870 1 328 . 1 1 27 27 LEU HB3 H 1 2.038 0.02 . 1 . . . . . 151 LEU HB3 . 26870 1 329 . 1 1 27 27 LEU HG H 1 1.735 0.02 . 1 . . . . . 151 LEU HG . 26870 1 330 . 1 1 27 27 LEU HD11 H 1 0.795 0.02 . 2 . . . . . 151 LEU HD1 . 26870 1 331 . 1 1 27 27 LEU HD12 H 1 0.795 0.02 . 2 . . . . . 151 LEU HD1 . 26870 1 332 . 1 1 27 27 LEU HD13 H 1 0.795 0.02 . 2 . . . . . 151 LEU HD1 . 26870 1 333 . 1 1 27 27 LEU HD21 H 1 0.769 0.02 . 2 . . . . . 151 LEU HD2 . 26870 1 334 . 1 1 27 27 LEU HD22 H 1 0.769 0.02 . 2 . . . . . 151 LEU HD2 . 26870 1 335 . 1 1 27 27 LEU HD23 H 1 0.769 0.02 . 2 . . . . . 151 LEU HD2 . 26870 1 336 . 1 1 27 27 LEU C C 13 171.689 0.3 . 1 . . . . . 151 LEU C . 26870 1 337 . 1 1 27 27 LEU CA C 13 51.076 0.3 . 1 . . . . . 151 LEU CA . 26870 1 338 . 1 1 27 27 LEU CB C 13 43.782 0.3 . 1 . . . . . 151 LEU CB . 26870 1 339 . 1 1 27 27 LEU CG C 13 26.414 0.3 . 1 . . . . . 151 LEU CG . 26870 1 340 . 1 1 27 27 LEU CD1 C 13 26.753 0.3 . 1 . . . . . 151 LEU CD1 . 26870 1 341 . 1 1 27 27 LEU CD2 C 13 23.631 0.3 . 1 . . . . . 151 LEU CD2 . 26870 1 342 . 1 1 27 27 LEU N N 15 127.299 0.3 . 1 . . . . . 151 LEU N . 26870 1 343 . 1 1 28 28 PRO HA H 1 4.319 0.02 . 1 . . . . . 152 PRO HA . 26870 1 344 . 1 1 28 28 PRO HB2 H 1 2.14 0.02 . 2 . . . . . 152 PRO HB2 . 26870 1 345 . 1 1 28 28 PRO HB3 H 1 1.778 0.02 . 2 . . . . . 152 PRO HB3 . 26870 1 346 . 1 1 28 28 PRO HG2 H 1 1.937 0.02 . 2 . . . . . 152 PRO HG2 . 26870 1 347 . 1 1 28 28 PRO HG3 H 1 1.651 0.02 . 2 . . . . . 152 PRO HG3 . 26870 1 348 . 1 1 28 28 PRO HD2 H 1 3.603 0.02 . 1 . . . . . 152 PRO HD2 . 26870 1 349 . 1 1 28 28 PRO HD3 H 1 3.603 0.02 . 1 . . . . . 152 PRO HD3 . 26870 1 350 . 1 1 28 28 PRO C C 13 176.669 0.3 . 1 . . . . . 152 PRO C . 26870 1 351 . 1 1 28 28 PRO CA C 13 62.066 0.3 . 1 . . . . . 152 PRO CA . 26870 1 352 . 1 1 28 28 PRO CB C 13 32.675 0.3 . 1 . . . . . 152 PRO CB . 26870 1 353 . 1 1 28 28 PRO CG C 13 27.443 0.3 . 1 . . . . . 152 PRO CG . 26870 1 354 . 1 1 28 28 PRO CD C 13 50.544 0.3 . 1 . . . . . 152 PRO CD . 26870 1 355 . 1 1 29 29 PHE H H 1 8.532 0.02 . 1 . . . . . 153 PHE H . 26870 1 356 . 1 1 29 29 PHE HA H 1 4.87 0.02 . 1 . . . . . 153 PHE HA . 26870 1 357 . 1 1 29 29 PHE HB2 H 1 3.462 0.02 . 2 . . . . . 153 PHE HB2 . 26870 1 358 . 1 1 29 29 PHE HB3 H 1 3.372 0.02 . 2 . . . . . 153 PHE HB3 . 26870 1 359 . 1 1 29 29 PHE HD1 H 1 7.305 0.02 . 1 . . . . . 153 PHE HD1 . 26870 1 360 . 1 1 29 29 PHE HD2 H 1 7.305 0.02 . 1 . . . . . 153 PHE HD2 . 26870 1 361 . 1 1 29 29 PHE HE1 H 1 7.497 0.02 . 1 . . . . . 153 PHE HE1 . 26870 1 362 . 1 1 29 29 PHE HE2 H 1 7.497 0.02 . 1 . . . . . 153 PHE HE2 . 26870 1 363 . 1 1 29 29 PHE C C 13 174.291 0.3 . 1 . . . . . 153 PHE C . 26870 1 364 . 1 1 29 29 PHE CA C 13 56.62 0.3 . 1 . . . . . 153 PHE CA . 26870 1 365 . 1 1 29 29 PHE CB C 13 40.371 0.3 . 1 . . . . . 153 PHE CB . 26870 1 366 . 1 1 29 29 PHE CD1 C 13 134.239 0.3 . 1 . . . . . 153 PHE CD1 . 26870 1 367 . 1 1 29 29 PHE CD2 C 13 134.239 0.3 . 1 . . . . . 153 PHE CD2 . 26870 1 368 . 1 1 29 29 PHE CE1 C 13 131.541 0.3 . 1 . . . . . 153 PHE CE1 . 26870 1 369 . 1 1 29 29 PHE CE2 C 13 131.541 0.3 . 1 . . . . . 153 PHE CE2 . 26870 1 370 . 1 1 29 29 PHE N N 15 113.161 0.3 . 1 . . . . . 153 PHE N . 26870 1 371 . 1 1 30 30 LYS H H 1 9.141 0.02 . 1 . . . . . 154 LYS H . 26870 1 372 . 1 1 30 30 LYS HA H 1 5.04 0.02 . 1 . . . . . 154 LYS HA . 26870 1 373 . 1 1 30 30 LYS HB2 H 1 1.832 0.02 . 1 . . . . . 154 LYS HB2 . 26870 1 374 . 1 1 30 30 LYS HB3 H 1 1.832 0.02 . 1 . . . . . 154 LYS HB3 . 26870 1 375 . 1 1 30 30 LYS HG2 H 1 1.441 0.02 . 1 . . . . . 154 LYS HG2 . 26870 1 376 . 1 1 30 30 LYS HG3 H 1 1.441 0.02 . 1 . . . . . 154 LYS HG3 . 26870 1 377 . 1 1 30 30 LYS HD2 H 1 1.731 0.02 . 1 . . . . . 154 LYS HD2 . 26870 1 378 . 1 1 30 30 LYS HD3 H 1 1.731 0.02 . 1 . . . . . 154 LYS HD3 . 26870 1 379 . 1 1 30 30 LYS HE2 H 1 3.014 0.02 . 1 . . . . . 154 LYS HE2 . 26870 1 380 . 1 1 30 30 LYS HE3 H 1 3.014 0.02 . 1 . . . . . 154 LYS HE3 . 26870 1 381 . 1 1 30 30 LYS C C 13 175.74 0.3 . 1 . . . . . 154 LYS C . 26870 1 382 . 1 1 30 30 LYS CA C 13 53.259 0.3 . 1 . . . . . 154 LYS CA . 26870 1 383 . 1 1 30 30 LYS CB C 13 34.799 0.3 . 1 . . . . . 154 LYS CB . 26870 1 384 . 1 1 30 30 LYS CG C 13 24.365 0.3 . 1 . . . . . 154 LYS CG . 26870 1 385 . 1 1 30 30 LYS CD C 13 28.39 0.3 . 1 . . . . . 154 LYS CD . 26870 1 386 . 1 1 30 30 LYS CE C 13 41.845 0.3 . 1 . . . . . 154 LYS CE . 26870 1 387 . 1 1 30 30 LYS N N 15 121.219 0.3 . 1 . . . . . 154 LYS N . 26870 1 388 . 1 1 31 31 LYS H H 1 9.16 0.02 . 1 . . . . . 155 LYS H . 26870 1 389 . 1 1 31 31 LYS HA H 1 3.289 0.02 . 1 . . . . . 155 LYS HA . 26870 1 390 . 1 1 31 31 LYS HB2 H 1 1.624 0.02 . 2 . . . . . 155 LYS HB2 . 26870 1 391 . 1 1 31 31 LYS HB3 H 1 1.483 0.02 . 2 . . . . . 155 LYS HB3 . 26870 1 392 . 1 1 31 31 LYS HG2 H 1 1.079 0.02 . 1 . . . . . 155 LYS HG2 . 26870 1 393 . 1 1 31 31 LYS HG3 H 1 1.079 0.02 . 1 . . . . . 155 LYS HG3 . 26870 1 394 . 1 1 31 31 LYS HD2 H 1 1.616 0.02 . 1 . . . . . 155 LYS HD2 . 26870 1 395 . 1 1 31 31 LYS HD3 H 1 1.616 0.02 . 1 . . . . . 155 LYS HD3 . 26870 1 396 . 1 1 31 31 LYS HE2 H 1 2.911 0.02 . 1 . . . . . 155 LYS HE2 . 26870 1 397 . 1 1 31 31 LYS HE3 H 1 2.911 0.02 . 1 . . . . . 155 LYS HE3 . 26870 1 398 . 1 1 31 31 LYS C C 13 176.855 0.3 . 1 . . . . . 155 LYS C . 26870 1 399 . 1 1 31 31 LYS CA C 13 58.541 0.3 . 1 . . . . . 155 LYS CA . 26870 1 400 . 1 1 31 31 LYS CB C 13 32.304 0.3 . 1 . . . . . 155 LYS CB . 26870 1 401 . 1 1 31 31 LYS CG C 13 24.242 0.3 . 1 . . . . . 155 LYS CG . 26870 1 402 . 1 1 31 31 LYS CD C 13 29.462 0.3 . 1 . . . . . 155 LYS CD . 26870 1 403 . 1 1 31 31 LYS CE C 13 41.975 0.3 . 1 . . . . . 155 LYS CE . 26870 1 404 . 1 1 31 31 LYS N N 15 121.09 0.3 . 1 . . . . . 155 LYS N . 26870 1 405 . 1 1 32 32 GLY H H 1 8.825 0.02 . 1 . . . . . 156 GLY H . 26870 1 406 . 1 1 32 32 GLY HA2 H 1 4.443 0.02 . 2 . . . . . 156 GLY HA2 . 26870 1 407 . 1 1 32 32 GLY HA3 H 1 3.368 0.02 . 2 . . . . . 156 GLY HA3 . 26870 1 408 . 1 1 32 32 GLY C C 13 173.996 0.3 . 1 . . . . . 156 GLY C . 26870 1 409 . 1 1 32 32 GLY CA C 13 44.576 0.3 . 1 . . . . . 156 GLY CA . 26870 1 410 . 1 1 32 32 GLY N N 15 115.533 0.3 . 1 . . . . . 156 GLY N . 26870 1 411 . 1 1 33 33 ASP H H 1 8.465 0.02 . 1 . . . . . 157 ASP H . 26870 1 412 . 1 1 33 33 ASP HA H 1 4.463 0.02 . 1 . . . . . 157 ASP HA . 26870 1 413 . 1 1 33 33 ASP HB2 H 1 2.938 0.02 . 2 . . . . . 157 ASP HB2 . 26870 1 414 . 1 1 33 33 ASP HB3 H 1 2.549 0.02 . 2 . . . . . 157 ASP HB3 . 26870 1 415 . 1 1 33 33 ASP C C 13 174.704 0.3 . 1 . . . . . 157 ASP C . 26870 1 416 . 1 1 33 33 ASP CA C 13 55.532 0.3 . 1 . . . . . 157 ASP CA . 26870 1 417 . 1 1 33 33 ASP CB C 13 41.207 0.3 . 1 . . . . . 157 ASP CB . 26870 1 418 . 1 1 33 33 ASP CG C 13 179.84 0.3 . 1 . . . . . 157 ASP CG . 26870 1 419 . 1 1 33 33 ASP N N 15 122.727 0.3 . 1 . . . . . 157 ASP N . 26870 1 420 . 1 1 34 34 ILE H H 1 8.47 0.02 . 1 . . . . . 158 ILE H . 26870 1 421 . 1 1 34 34 ILE HA H 1 4.838 0.02 . 1 . . . . . 158 ILE HA . 26870 1 422 . 1 1 34 34 ILE HB H 1 1.746 0.02 . 1 . . . . . 158 ILE HB . 26870 1 423 . 1 1 34 34 ILE HG12 H 1 1.215 0.02 . 2 . . . . . 158 ILE HG12 . 26870 1 424 . 1 1 34 34 ILE HG13 H 1 0.876 0.02 . 2 . . . . . 158 ILE HG13 . 26870 1 425 . 1 1 34 34 ILE HG21 H 1 0.722 0.02 . 1 . . . . . 158 ILE HG2 . 26870 1 426 . 1 1 34 34 ILE HG22 H 1 0.722 0.02 . 1 . . . . . 158 ILE HG2 . 26870 1 427 . 1 1 34 34 ILE HG23 H 1 0.722 0.02 . 1 . . . . . 158 ILE HG2 . 26870 1 428 . 1 1 34 34 ILE HD11 H 1 0.203 0.02 . 1 . . . . . 158 ILE HD1 . 26870 1 429 . 1 1 34 34 ILE HD12 H 1 0.203 0.02 . 1 . . . . . 158 ILE HD1 . 26870 1 430 . 1 1 34 34 ILE HD13 H 1 0.203 0.02 . 1 . . . . . 158 ILE HD1 . 26870 1 431 . 1 1 34 34 ILE C C 13 176.782 0.3 . 1 . . . . . 158 ILE C . 26870 1 432 . 1 1 34 34 ILE CA C 13 58.701 0.3 . 1 . . . . . 158 ILE CA . 26870 1 433 . 1 1 34 34 ILE CB C 13 37.46 0.3 . 1 . . . . . 158 ILE CB . 26870 1 434 . 1 1 34 34 ILE CG1 C 13 27.066 0.3 . 1 . . . . . 158 ILE CG1 . 26870 1 435 . 1 1 34 34 ILE CG2 C 13 18.13 0.3 . 1 . . . . . 158 ILE CG2 . 26870 1 436 . 1 1 34 34 ILE CD1 C 13 10.876 0.3 . 1 . . . . . 158 ILE CD1 . 26870 1 437 . 1 1 34 34 ILE N N 15 119.928 0.3 . 1 . . . . . 158 ILE N . 26870 1 438 . 1 1 35 35 LEU H H 1 9.086 0.02 . 1 . . . . . 159 LEU H . 26870 1 439 . 1 1 35 35 LEU HA H 1 4.977 0.02 . 1 . . . . . 159 LEU HA . 26870 1 440 . 1 1 35 35 LEU HB2 H 1 1.344 0.02 . 2 . . . . . 159 LEU HB2 . 26870 1 441 . 1 1 35 35 LEU HB3 H 1 1.178 0.02 . 2 . . . . . 159 LEU HB3 . 26870 1 442 . 1 1 35 35 LEU HG H 1 1.28 0.02 . 1 . . . . . 159 LEU HG . 26870 1 443 . 1 1 35 35 LEU HD11 H 1 0.763 0.02 . 2 . . . . . 159 LEU HD1 . 26870 1 444 . 1 1 35 35 LEU HD12 H 1 0.763 0.02 . 2 . . . . . 159 LEU HD1 . 26870 1 445 . 1 1 35 35 LEU HD13 H 1 0.763 0.02 . 2 . . . . . 159 LEU HD1 . 26870 1 446 . 1 1 35 35 LEU HD21 H 1 0.206 0.02 . 2 . . . . . 159 LEU HD2 . 26870 1 447 . 1 1 35 35 LEU HD22 H 1 0.206 0.02 . 2 . . . . . 159 LEU HD2 . 26870 1 448 . 1 1 35 35 LEU HD23 H 1 0.206 0.02 . 2 . . . . . 159 LEU HD2 . 26870 1 449 . 1 1 35 35 LEU C C 13 174.618 0.3 . 1 . . . . . 159 LEU C . 26870 1 450 . 1 1 35 35 LEU CA C 13 53.058 0.3 . 1 . . . . . 159 LEU CA . 26870 1 451 . 1 1 35 35 LEU CB C 13 44.665 0.3 . 1 . . . . . 159 LEU CB . 26870 1 452 . 1 1 35 35 LEU CG C 13 27.253 0.3 . 1 . . . . . 159 LEU CG . 26870 1 453 . 1 1 35 35 LEU CD1 C 13 24.669 0.3 . 1 . . . . . 159 LEU CD1 . 26870 1 454 . 1 1 35 35 LEU CD2 C 13 25.353 0.3 . 1 . . . . . 159 LEU CD2 . 26870 1 455 . 1 1 35 35 LEU N N 15 128.53 0.3 . 1 . . . . . 159 LEU N . 26870 1 456 . 1 1 36 36 ARG H H 1 8.907 0.02 . 1 . . . . . 160 ARG H . 26870 1 457 . 1 1 36 36 ARG HA H 1 4.605 0.02 . 1 . . . . . 160 ARG HA . 26870 1 458 . 1 1 36 36 ARG HB2 H 1 1.747 0.02 . 2 . . . . . 160 ARG HB2 . 26870 1 459 . 1 1 36 36 ARG HB3 H 1 1.699 0.02 . 2 . . . . . 160 ARG HB3 . 26870 1 460 . 1 1 36 36 ARG HG2 H 1 1.106 0.02 . 2 . . . . . 160 ARG HG2 . 26870 1 461 . 1 1 36 36 ARG HG3 H 1 0.997 0.02 . 2 . . . . . 160 ARG HG3 . 26870 1 462 . 1 1 36 36 ARG HD2 H 1 2.958 0.02 . 2 . . . . . 160 ARG HD2 . 26870 1 463 . 1 1 36 36 ARG HD3 H 1 2.809 0.02 . 2 . . . . . 160 ARG HD3 . 26870 1 464 . 1 1 36 36 ARG HE H 1 7.206 0.02 . 1 . . . . . 160 ARG HE . 26870 1 465 . 1 1 36 36 ARG C C 13 175.993 0.3 . 1 . . . . . 160 ARG C . 26870 1 466 . 1 1 36 36 ARG CA C 13 54.476 0.3 . 1 . . . . . 160 ARG CA . 26870 1 467 . 1 1 36 36 ARG CB C 13 32.579 0.3 . 1 . . . . . 160 ARG CB . 26870 1 468 . 1 1 36 36 ARG CG C 13 27.34 0.3 . 1 . . . . . 160 ARG CG . 26870 1 469 . 1 1 36 36 ARG CD C 13 43.48 0.3 . 1 . . . . . 160 ARG CD . 26870 1 470 . 1 1 36 36 ARG N N 15 122.716 0.3 . 1 . . . . . 160 ARG N . 26870 1 471 . 1 1 36 36 ARG NE N 15 84.214 0.3 . 1 . . . . . 160 ARG NE . 26870 1 472 . 1 1 37 37 ILE H H 1 8.915 0.02 . 1 . . . . . 161 ILE H . 26870 1 473 . 1 1 37 37 ILE HA H 1 4.159 0.02 . 1 . . . . . 161 ILE HA . 26870 1 474 . 1 1 37 37 ILE HB H 1 1.87 0.02 . 1 . . . . . 161 ILE HB . 26870 1 475 . 1 1 37 37 ILE HG12 H 1 1.544 0.02 . 2 . . . . . 161 ILE HG12 . 26870 1 476 . 1 1 37 37 ILE HG13 H 1 1.316 0.02 . 2 . . . . . 161 ILE HG13 . 26870 1 477 . 1 1 37 37 ILE HG21 H 1 0.512 0.02 . 1 . . . . . 161 ILE HG2 . 26870 1 478 . 1 1 37 37 ILE HG22 H 1 0.512 0.02 . 1 . . . . . 161 ILE HG2 . 26870 1 479 . 1 1 37 37 ILE HG23 H 1 0.512 0.02 . 1 . . . . . 161 ILE HG2 . 26870 1 480 . 1 1 37 37 ILE HD11 H 1 0.818 0.02 . 1 . . . . . 161 ILE HD1 . 26870 1 481 . 1 1 37 37 ILE HD12 H 1 0.818 0.02 . 1 . . . . . 161 ILE HD1 . 26870 1 482 . 1 1 37 37 ILE HD13 H 1 0.818 0.02 . 1 . . . . . 161 ILE HD1 . 26870 1 483 . 1 1 37 37 ILE C C 13 176.182 0.3 . 1 . . . . . 161 ILE C . 26870 1 484 . 1 1 37 37 ILE CA C 13 59.177 0.3 . 1 . . . . . 161 ILE CA . 26870 1 485 . 1 1 37 37 ILE CB C 13 34.963 0.3 . 1 . . . . . 161 ILE CB . 26870 1 486 . 1 1 37 37 ILE CG1 C 13 26.266 0.3 . 1 . . . . . 161 ILE CG1 . 26870 1 487 . 1 1 37 37 ILE CG2 C 13 17.919 0.3 . 1 . . . . . 161 ILE CG2 . 26870 1 488 . 1 1 37 37 ILE CD1 C 13 10.542 0.3 . 1 . . . . . 161 ILE CD1 . 26870 1 489 . 1 1 37 37 ILE N N 15 125.391 0.3 . 1 . . . . . 161 ILE N . 26870 1 490 . 1 1 38 38 ARG H H 1 9.364 0.02 . 1 . . . . . 162 ARG H . 26870 1 491 . 1 1 38 38 ARG HA H 1 4.394 0.02 . 1 . . . . . 162 ARG HA . 26870 1 492 . 1 1 38 38 ARG HB2 H 1 1.809 0.02 . 2 . . . . . 162 ARG HB2 . 26870 1 493 . 1 1 38 38 ARG HB3 H 1 1.718 0.02 . 2 . . . . . 162 ARG HB3 . 26870 1 494 . 1 1 38 38 ARG HG2 H 1 1.452 0.02 . 1 . . . . . 162 ARG HG2 . 26870 1 495 . 1 1 38 38 ARG HG3 H 1 1.452 0.02 . 1 . . . . . 162 ARG HG3 . 26870 1 496 . 1 1 38 38 ARG HD2 H 1 3.086 0.02 . 1 . . . . . 162 ARG HD2 . 26870 1 497 . 1 1 38 38 ARG HD3 H 1 3.086 0.02 . 1 . . . . . 162 ARG HD3 . 26870 1 498 . 1 1 38 38 ARG HE H 1 7.216 0.02 . 1 . . . . . 162 ARG HE . 26870 1 499 . 1 1 38 38 ARG C C 13 175.642 0.3 . 1 . . . . . 162 ARG C . 26870 1 500 . 1 1 38 38 ARG CA C 13 55.606 0.3 . 1 . . . . . 162 ARG CA . 26870 1 501 . 1 1 38 38 ARG CB C 13 31.333 0.3 . 1 . . . . . 162 ARG CB . 26870 1 502 . 1 1 38 38 ARG CG C 13 26.546 0.3 . 1 . . . . . 162 ARG CG . 26870 1 503 . 1 1 38 38 ARG CD C 13 42.305 0.3 . 1 . . . . . 162 ARG CD . 26870 1 504 . 1 1 38 38 ARG N N 15 127.505 0.3 . 1 . . . . . 162 ARG N . 26870 1 505 . 1 1 38 38 ARG NE N 15 81.618 0.3 . 1 . . . . . 162 ARG NE . 26870 1 506 . 1 1 39 39 ASP H H 1 8.045 0.02 . 1 . . . . . 163 ASP H . 26870 1 507 . 1 1 39 39 ASP HA H 1 4.674 0.02 . 1 . . . . . 163 ASP HA . 26870 1 508 . 1 1 39 39 ASP HB2 H 1 2.681 0.02 . 2 . . . . . 163 ASP HB2 . 26870 1 509 . 1 1 39 39 ASP HB3 H 1 2.509 0.02 . 2 . . . . . 163 ASP HB3 . 26870 1 510 . 1 1 39 39 ASP C C 13 174.099 0.3 . 1 . . . . . 163 ASP C . 26870 1 511 . 1 1 39 39 ASP CA C 13 54.209 0.3 . 1 . . . . . 163 ASP CA . 26870 1 512 . 1 1 39 39 ASP CB C 13 43.777 0.3 . 1 . . . . . 163 ASP CB . 26870 1 513 . 1 1 39 39 ASP CG C 13 179.096 0.3 . 1 . . . . . 163 ASP CG . 26870 1 514 . 1 1 39 39 ASP N N 15 115.623 0.3 . 1 . . . . . 163 ASP N . 26870 1 515 . 1 1 40 40 LYS H H 1 8.24 0.02 . 1 . . . . . 164 LYS H . 26870 1 516 . 1 1 40 40 LYS HA H 1 4.868 0.02 . 1 . . . . . 164 LYS HA . 26870 1 517 . 1 1 40 40 LYS HB2 H 1 1.47 0.02 . 2 . . . . . 164 LYS HB2 . 26870 1 518 . 1 1 40 40 LYS HB3 H 1 1.237 0.02 . 2 . . . . . 164 LYS HB3 . 26870 1 519 . 1 1 40 40 LYS HG2 H 1 0.385 0.02 . 2 . . . . . 164 LYS HG2 . 26870 1 520 . 1 1 40 40 LYS HG3 H 1 -0.916 0.02 . 2 . . . . . 164 LYS HG3 . 26870 1 521 . 1 1 40 40 LYS HD2 H 1 0.98 0.02 . 2 . . . . . 164 LYS HD2 . 26870 1 522 . 1 1 40 40 LYS HD3 H 1 0.74 0.02 . 2 . . . . . 164 LYS HD3 . 26870 1 523 . 1 1 40 40 LYS HE2 H 1 1.944 0.02 . 2 . . . . . 164 LYS HE2 . 26870 1 524 . 1 1 40 40 LYS HE3 H 1 0.713 0.02 . 2 . . . . . 164 LYS HE3 . 26870 1 525 . 1 1 40 40 LYS C C 13 173.348 0.3 . 1 . . . . . 164 LYS C . 26870 1 526 . 1 1 40 40 LYS CA C 13 53.471 0.3 . 1 . . . . . 164 LYS CA . 26870 1 527 . 1 1 40 40 LYS CB C 13 33.07 0.3 . 1 . . . . . 164 LYS CB . 26870 1 528 . 1 1 40 40 LYS CG C 13 23.21 0.3 . 1 . . . . . 164 LYS CG . 26870 1 529 . 1 1 40 40 LYS CD C 13 30.06 0.3 . 1 . . . . . 164 LYS CD . 26870 1 530 . 1 1 40 40 LYS CE C 13 41.49 0.3 . 1 . . . . . 164 LYS CE . 26870 1 531 . 1 1 40 40 LYS N N 15 120.207 0.3 . 1 . . . . . 164 LYS N . 26870 1 532 . 1 1 41 41 PRO HA H 1 4.434 0.02 . 1 . . . . . 165 PRO HA . 26870 1 533 . 1 1 41 41 PRO HB2 H 1 2.382 0.02 . 2 . . . . . 165 PRO HB2 . 26870 1 534 . 1 1 41 41 PRO HB3 H 1 2.123 0.02 . 2 . . . . . 165 PRO HB3 . 26870 1 535 . 1 1 41 41 PRO HG2 H 1 2.114 0.02 . 1 . . . . . 165 PRO HG2 . 26870 1 536 . 1 1 41 41 PRO HG3 H 1 2.114 0.02 . 1 . . . . . 165 PRO HG3 . 26870 1 537 . 1 1 41 41 PRO HD2 H 1 3.613 0.02 . 1 . . . . . 165 PRO HD2 . 26870 1 538 . 1 1 41 41 PRO HD3 H 1 3.613 0.02 . 1 . . . . . 165 PRO HD3 . 26870 1 539 . 1 1 41 41 PRO C C 13 176.14 0.3 . 1 . . . . . 165 PRO C . 26870 1 540 . 1 1 41 41 PRO CA C 13 64.667 0.3 . 1 . . . . . 165 PRO CA . 26870 1 541 . 1 1 41 41 PRO CB C 13 32.414 0.3 . 1 . . . . . 165 PRO CB . 26870 1 542 . 1 1 41 41 PRO CG C 13 27.294 0.3 . 1 . . . . . 165 PRO CG . 26870 1 543 . 1 1 41 41 PRO CD C 13 50.031 0.3 . 1 . . . . . 165 PRO CD . 26870 1 544 . 1 1 42 42 GLU H H 1 7.629 0.02 . 1 . . . . . 166 GLU H . 26870 1 545 . 1 1 42 42 GLU HA H 1 4.819 0.02 . 1 . . . . . 166 GLU HA . 26870 1 546 . 1 1 42 42 GLU HB2 H 1 2.604 0.02 . 2 . . . . . 166 GLU HB2 . 26870 1 547 . 1 1 42 42 GLU HB3 H 1 2.355 0.02 . 2 . . . . . 166 GLU HB3 . 26870 1 548 . 1 1 42 42 GLU HG2 H 1 2.439 0.02 . 2 . . . . . 166 GLU HG2 . 26870 1 549 . 1 1 42 42 GLU HG3 H 1 2.347 0.02 . 2 . . . . . 166 GLU HG3 . 26870 1 550 . 1 1 42 42 GLU C C 13 175.09 0.3 . 1 . . . . . 166 GLU C . 26870 1 551 . 1 1 42 42 GLU CA C 13 54.012 0.3 . 1 . . . . . 166 GLU CA . 26870 1 552 . 1 1 42 42 GLU CB C 13 33.153 0.3 . 1 . . . . . 166 GLU CB . 26870 1 553 . 1 1 42 42 GLU CG C 13 36.293 0.3 . 1 . . . . . 166 GLU CG . 26870 1 554 . 1 1 42 42 GLU CD C 13 183.403 0.3 . 1 . . . . . 166 GLU CD . 26870 1 555 . 1 1 42 42 GLU N N 15 113.228 0.3 . 1 . . . . . 166 GLU N . 26870 1 556 . 1 1 43 43 GLU H H 1 8.735 0.02 . 1 . . . . . 167 GLU H . 26870 1 557 . 1 1 43 43 GLU HA H 1 4.31 0.02 . 1 . . . . . 167 GLU HA . 26870 1 558 . 1 1 43 43 GLU HB2 H 1 2.108 0.02 . 1 . . . . . 167 GLU HB2 . 26870 1 559 . 1 1 43 43 GLU HB3 H 1 2.108 0.02 . 1 . . . . . 167 GLU HB3 . 26870 1 560 . 1 1 43 43 GLU HG2 H 1 2.447 0.02 . 2 . . . . . 167 GLU HG2 . 26870 1 561 . 1 1 43 43 GLU HG3 H 1 2.346 0.02 . 2 . . . . . 167 GLU HG3 . 26870 1 562 . 1 1 43 43 GLU C C 13 178.617 0.3 . 1 . . . . . 167 GLU C . 26870 1 563 . 1 1 43 43 GLU CA C 13 59.524 0.3 . 1 . . . . . 167 GLU CA . 26870 1 564 . 1 1 43 43 GLU CB C 13 30.259 0.3 . 1 . . . . . 167 GLU CB . 26870 1 565 . 1 1 43 43 GLU CG C 13 36.65 0.3 . 1 . . . . . 167 GLU CG . 26870 1 566 . 1 1 43 43 GLU CD C 13 183.878 0.3 . 1 . . . . . 167 GLU CD . 26870 1 567 . 1 1 43 43 GLU N N 15 117.339 0.3 . 1 . . . . . 167 GLU N . 26870 1 568 . 1 1 44 44 GLN H H 1 8.528 0.02 . 1 . . . . . 168 GLN H . 26870 1 569 . 1 1 44 44 GLN HA H 1 4.141 0.02 . 1 . . . . . 168 GLN HA . 26870 1 570 . 1 1 44 44 GLN HB2 H 1 2.014 0.02 . 2 . . . . . 168 GLN HB2 . 26870 1 571 . 1 1 44 44 GLN HB3 H 1 1.812 0.02 . 2 . . . . . 168 GLN HB3 . 26870 1 572 . 1 1 44 44 GLN HG2 H 1 2.256 0.02 . 2 . . . . . 168 GLN HG2 . 26870 1 573 . 1 1 44 44 GLN HG3 H 1 2.097 0.02 . 2 . . . . . 168 GLN HG3 . 26870 1 574 . 1 1 44 44 GLN HE21 H 1 7.415 0.02 . 1 . . . . . 168 GLN HE21 . 26870 1 575 . 1 1 44 44 GLN HE22 H 1 6.643 0.02 . 1 . . . . . 168 GLN HE22 . 26870 1 576 . 1 1 44 44 GLN C C 13 175.561 0.3 . 1 . . . . . 168 GLN C . 26870 1 577 . 1 1 44 44 GLN CA C 13 55.169 0.3 . 1 . . . . . 168 GLN CA . 26870 1 578 . 1 1 44 44 GLN CB C 13 29.098 0.3 . 1 . . . . . 168 GLN CB . 26870 1 579 . 1 1 44 44 GLN CG C 13 33.234 0.3 . 1 . . . . . 168 GLN CG . 26870 1 580 . 1 1 44 44 GLN CD C 13 179.944 0.3 . 1 . . . . . 168 GLN CD . 26870 1 581 . 1 1 44 44 GLN N N 15 110.681 0.3 . 1 . . . . . 168 GLN N . 26870 1 582 . 1 1 44 44 GLN NE2 N 15 111.143 0.3 . 1 . . . . . 168 GLN NE2 . 26870 1 583 . 1 1 45 45 TRP H H 1 6.836 0.02 . 1 . . . . . 169 TRP H . 26870 1 584 . 1 1 45 45 TRP HA H 1 5.279 0.02 . 1 . . . . . 169 TRP HA . 26870 1 585 . 1 1 45 45 TRP HB2 H 1 3.039 0.02 . 2 . . . . . 169 TRP HB2 . 26870 1 586 . 1 1 45 45 TRP HB3 H 1 2.736 0.02 . 2 . . . . . 169 TRP HB3 . 26870 1 587 . 1 1 45 45 TRP HD1 H 1 7.118 0.02 . 1 . . . . . 169 TRP HD1 . 26870 1 588 . 1 1 45 45 TRP HE1 H 1 9.996 0.02 . 1 . . . . . 169 TRP HE1 . 26870 1 589 . 1 1 45 45 TRP HE3 H 1 7.222 0.02 . 1 . . . . . 169 TRP HE3 . 26870 1 590 . 1 1 45 45 TRP HZ2 H 1 7.391 0.02 . 1 . . . . . 169 TRP HZ2 . 26870 1 591 . 1 1 45 45 TRP HZ3 H 1 6.653 0.02 . 1 . . . . . 169 TRP HZ3 . 26870 1 592 . 1 1 45 45 TRP HH2 H 1 7.112 0.02 . 1 . . . . . 169 TRP HH2 . 26870 1 593 . 1 1 45 45 TRP C C 13 173.481 0.3 . 1 . . . . . 169 TRP C . 26870 1 594 . 1 1 45 45 TRP CA C 13 56.411 0.3 . 1 . . . . . 169 TRP CA . 26870 1 595 . 1 1 45 45 TRP CB C 13 32.318 0.3 . 1 . . . . . 169 TRP CB . 26870 1 596 . 1 1 45 45 TRP CD1 C 13 126.994 0.3 . 1 . . . . . 169 TRP CD1 . 26870 1 597 . 1 1 45 45 TRP CE3 C 13 120.794 0.3 . 1 . . . . . 169 TRP CE3 . 26870 1 598 . 1 1 45 45 TRP CZ2 C 13 114.346 0.3 . 1 . . . . . 169 TRP CZ2 . 26870 1 599 . 1 1 45 45 TRP CZ3 C 13 121.031 0.3 . 1 . . . . . 169 TRP CZ3 . 26870 1 600 . 1 1 45 45 TRP CH2 C 13 124.107 0.3 . 1 . . . . . 169 TRP CH2 . 26870 1 601 . 1 1 45 45 TRP N N 15 120.128 0.3 . 1 . . . . . 169 TRP N . 26870 1 602 . 1 1 45 45 TRP NE1 N 15 128.808 0.3 . 1 . . . . . 169 TRP NE1 . 26870 1 603 . 1 1 46 46 TRP H H 1 8.541 0.02 . 1 . . . . . 170 TRP H . 26870 1 604 . 1 1 46 46 TRP HA H 1 5.605 0.02 . 1 . . . . . 170 TRP HA . 26870 1 605 . 1 1 46 46 TRP HB2 H 1 3.379 0.02 . 2 . . . . . 170 TRP HB2 . 26870 1 606 . 1 1 46 46 TRP HB3 H 1 2.815 0.02 . 2 . . . . . 170 TRP HB3 . 26870 1 607 . 1 1 46 46 TRP HD1 H 1 7.59 0.02 . 1 . . . . . 170 TRP HD1 . 26870 1 608 . 1 1 46 46 TRP HE1 H 1 9.572 0.02 . 1 . . . . . 170 TRP HE1 . 26870 1 609 . 1 1 46 46 TRP HE3 H 1 7.149 0.02 . 1 . . . . . 170 TRP HE3 . 26870 1 610 . 1 1 46 46 TRP HZ2 H 1 7.524 0.02 . 1 . . . . . 170 TRP HZ2 . 26870 1 611 . 1 1 46 46 TRP HZ3 H 1 6.781 0.02 . 1 . . . . . 170 TRP HZ3 . 26870 1 612 . 1 1 46 46 TRP HH2 H 1 7.138 0.02 . 1 . . . . . 170 TRP HH2 . 26870 1 613 . 1 1 46 46 TRP C C 13 174.531 0.3 . 1 . . . . . 170 TRP C . 26870 1 614 . 1 1 46 46 TRP CA C 13 51.958 0.3 . 1 . . . . . 170 TRP CA . 26870 1 615 . 1 1 46 46 TRP CB C 13 32.801 0.3 . 1 . . . . . 170 TRP CB . 26870 1 616 . 1 1 46 46 TRP CD1 C 13 124.943 0.3 . 1 . . . . . 170 TRP CD1 . 26870 1 617 . 1 1 46 46 TRP CE3 C 13 119.216 0.3 . 1 . . . . . 170 TRP CE3 . 26870 1 618 . 1 1 46 46 TRP CZ2 C 13 114.961 0.3 . 1 . . . . . 170 TRP CZ2 . 26870 1 619 . 1 1 46 46 TRP CZ3 C 13 120.751 0.3 . 1 . . . . . 170 TRP CZ3 . 26870 1 620 . 1 1 46 46 TRP CH2 C 13 124.104 0.3 . 1 . . . . . 170 TRP CH2 . 26870 1 621 . 1 1 46 46 TRP N N 15 120.378 0.3 . 1 . . . . . 170 TRP N . 26870 1 622 . 1 1 46 46 TRP NE1 N 15 129.081 0.3 . 1 . . . . . 170 TRP NE1 . 26870 1 623 . 1 1 47 47 ASN H H 1 8.914 0.02 . 1 . . . . . 171 ASN H . 26870 1 624 . 1 1 47 47 ASN HA H 1 5.409 0.02 . 1 . . . . . 171 ASN HA . 26870 1 625 . 1 1 47 47 ASN HB2 H 1 2.716 0.02 . 2 . . . . . 171 ASN HB2 . 26870 1 626 . 1 1 47 47 ASN HB3 H 1 2.655 0.02 . 2 . . . . . 171 ASN HB3 . 26870 1 627 . 1 1 47 47 ASN HD21 H 1 7.472 0.02 . 1 . . . . . 171 ASN HD21 . 26870 1 628 . 1 1 47 47 ASN HD22 H 1 6.832 0.02 . 1 . . . . . 171 ASN HD22 . 26870 1 629 . 1 1 47 47 ASN C C 13 174.32 0.3 . 1 . . . . . 171 ASN C . 26870 1 630 . 1 1 47 47 ASN CA C 13 53.625 0.3 . 1 . . . . . 171 ASN CA . 26870 1 631 . 1 1 47 47 ASN CB C 13 41.833 0.3 . 1 . . . . . 171 ASN CB . 26870 1 632 . 1 1 47 47 ASN CG C 13 175.585 0.3 . 1 . . . . . 171 ASN CG . 26870 1 633 . 1 1 47 47 ASN N N 15 120.796 0.3 . 1 . . . . . 171 ASN N . 26870 1 634 . 1 1 47 47 ASN ND2 N 15 110.79 0.3 . 1 . . . . . 171 ASN ND2 . 26870 1 635 . 1 1 48 48 ALA H H 1 9.676 0.02 . 1 . . . . . 172 ALA H . 26870 1 636 . 1 1 48 48 ALA HA H 1 5.494 0.02 . 1 . . . . . 172 ALA HA . 26870 1 637 . 1 1 48 48 ALA HB1 H 1 1.334 0.02 . 1 . . . . . 172 ALA HB . 26870 1 638 . 1 1 48 48 ALA HB2 H 1 1.334 0.02 . 1 . . . . . 172 ALA HB . 26870 1 639 . 1 1 48 48 ALA HB3 H 1 1.334 0.02 . 1 . . . . . 172 ALA HB . 26870 1 640 . 1 1 48 48 ALA C C 13 173.697 0.3 . 1 . . . . . 172 ALA C . 26870 1 641 . 1 1 48 48 ALA CA C 13 50.143 0.3 . 1 . . . . . 172 ALA CA . 26870 1 642 . 1 1 48 48 ALA CB C 13 25.878 0.3 . 1 . . . . . 172 ALA CB . 26870 1 643 . 1 1 48 48 ALA N N 15 130.587 0.3 . 1 . . . . . 172 ALA N . 26870 1 644 . 1 1 49 49 GLU H H 1 9.086 0.02 . 1 . . . . . 173 GLU H . 26870 1 645 . 1 1 49 49 GLU HA H 1 5.669 0.02 . 1 . . . . . 173 GLU HA . 26870 1 646 . 1 1 49 49 GLU HB2 H 1 1.905 0.02 . 2 . . . . . 173 GLU HB2 . 26870 1 647 . 1 1 49 49 GLU HB3 H 1 1.767 0.02 . 2 . . . . . 173 GLU HB3 . 26870 1 648 . 1 1 49 49 GLU HG2 H 1 2.587 0.02 . 2 . . . . . 173 GLU HG2 . 26870 1 649 . 1 1 49 49 GLU HG3 H 1 2.034 0.02 . 2 . . . . . 173 GLU HG3 . 26870 1 650 . 1 1 49 49 GLU C C 13 176.099 0.3 . 1 . . . . . 173 GLU C . 26870 1 651 . 1 1 49 49 GLU CA C 13 53.491 0.3 . 1 . . . . . 173 GLU CA . 26870 1 652 . 1 1 49 49 GLU CB C 13 35.25 0.3 . 1 . . . . . 173 GLU CB . 26870 1 653 . 1 1 49 49 GLU CG C 13 35.874 0.3 . 1 . . . . . 173 GLU CG . 26870 1 654 . 1 1 49 49 GLU CD C 13 183.518 0.3 . 1 . . . . . 173 GLU CD . 26870 1 655 . 1 1 49 49 GLU N N 15 118.693 0.3 . 1 . . . . . 173 GLU N . 26870 1 656 . 1 1 50 50 ASP H H 1 9.031 0.02 . 1 . . . . . 174 ASP H . 26870 1 657 . 1 1 50 50 ASP HA H 1 5.007 0.02 . 1 . . . . . 174 ASP HA . 26870 1 658 . 1 1 50 50 ASP HB2 H 1 3.495 0.02 . 2 . . . . . 174 ASP HB2 . 26870 1 659 . 1 1 50 50 ASP HB3 H 1 2.731 0.02 . 2 . . . . . 174 ASP HB3 . 26870 1 660 . 1 1 50 50 ASP C C 13 178.825 0.3 . 1 . . . . . 174 ASP C . 26870 1 661 . 1 1 50 50 ASP CA C 13 52.216 0.3 . 1 . . . . . 174 ASP CA . 26870 1 662 . 1 1 50 50 ASP CB C 13 42.209 0.3 . 1 . . . . . 174 ASP CB . 26870 1 663 . 1 1 50 50 ASP CG C 13 177.948 0.3 . 1 . . . . . 174 ASP CG . 26870 1 664 . 1 1 50 50 ASP N N 15 126.038 0.3 . 1 . . . . . 174 ASP N . 26870 1 665 . 1 1 51 51 SER H H 1 9.143 0.02 . 1 . . . . . 175 SER H . 26870 1 666 . 1 1 51 51 SER HA H 1 4.202 0.02 . 1 . . . . . 175 SER HA . 26870 1 667 . 1 1 51 51 SER HB2 H 1 4.087 0.02 . 1 . . . . . 175 SER HB2 . 26870 1 668 . 1 1 51 51 SER HB3 H 1 4.087 0.02 . 1 . . . . . 175 SER HB3 . 26870 1 669 . 1 1 51 51 SER C C 13 175.472 0.3 . 1 . . . . . 175 SER C . 26870 1 670 . 1 1 51 51 SER CA C 13 61.333 0.3 . 1 . . . . . 175 SER CA . 26870 1 671 . 1 1 51 51 SER CB C 13 63.369 0.3 . 1 . . . . . 175 SER CB . 26870 1 672 . 1 1 51 51 SER N N 15 114.044 0.3 . 1 . . . . . 175 SER N . 26870 1 673 . 1 1 52 52 GLU H H 1 8.233 0.02 . 1 . . . . . 176 GLU H . 26870 1 674 . 1 1 52 52 GLU HA H 1 4.496 0.02 . 1 . . . . . 176 GLU HA . 26870 1 675 . 1 1 52 52 GLU HB2 H 1 2.313 0.02 . 2 . . . . . 176 GLU HB2 . 26870 1 676 . 1 1 52 52 GLU HB3 H 1 2.075 0.02 . 2 . . . . . 176 GLU HB3 . 26870 1 677 . 1 1 52 52 GLU HG2 H 1 2.322 0.02 . 2 . . . . . 176 GLU HG2 . 26870 1 678 . 1 1 52 52 GLU HG3 H 1 2.224 0.02 . 2 . . . . . 176 GLU HG3 . 26870 1 679 . 1 1 52 52 GLU C C 13 176.868 0.3 . 1 . . . . . 176 GLU C . 26870 1 680 . 1 1 52 52 GLU CA C 13 55.574 0.3 . 1 . . . . . 176 GLU CA . 26870 1 681 . 1 1 52 52 GLU CB C 13 30.199 0.3 . 1 . . . . . 176 GLU CB . 26870 1 682 . 1 1 52 52 GLU CG C 13 36.533 0.3 . 1 . . . . . 176 GLU CG . 26870 1 683 . 1 1 52 52 GLU CD C 13 184.304 0.3 . 1 . . . . . 176 GLU CD . 26870 1 684 . 1 1 52 52 GLU N N 15 120.866 0.3 . 1 . . . . . 176 GLU N . 26870 1 685 . 1 1 53 53 GLY H H 1 8.261 0.02 . 1 . . . . . 177 GLY H . 26870 1 686 . 1 1 53 53 GLY HA2 H 1 4.275 0.02 . 2 . . . . . 177 GLY HA2 . 26870 1 687 . 1 1 53 53 GLY HA3 H 1 3.806 0.02 . 2 . . . . . 177 GLY HA3 . 26870 1 688 . 1 1 53 53 GLY C C 13 174.811 0.3 . 1 . . . . . 177 GLY C . 26870 1 689 . 1 1 53 53 GLY CA C 13 44.965 0.3 . 1 . . . . . 177 GLY CA . 26870 1 690 . 1 1 53 53 GLY N N 15 109.062 0.3 . 1 . . . . . 177 GLY N . 26870 1 691 . 1 1 54 54 LYS H H 1 8.762 0.02 . 1 . . . . . 178 LYS H . 26870 1 692 . 1 1 54 54 LYS HA H 1 4.272 0.02 . 1 . . . . . 178 LYS HA . 26870 1 693 . 1 1 54 54 LYS HB2 H 1 2.057 0.02 . 2 . . . . . 178 LYS HB2 . 26870 1 694 . 1 1 54 54 LYS HB3 H 1 1.811 0.02 . 2 . . . . . 178 LYS HB3 . 26870 1 695 . 1 1 54 54 LYS HG2 H 1 1.514 0.02 . 2 . . . . . 178 LYS HG2 . 26870 1 696 . 1 1 54 54 LYS HG3 H 1 1.402 0.02 . 2 . . . . . 178 LYS HG3 . 26870 1 697 . 1 1 54 54 LYS HD2 H 1 1.757 0.02 . 1 . . . . . 178 LYS HD2 . 26870 1 698 . 1 1 54 54 LYS HD3 H 1 1.757 0.02 . 1 . . . . . 178 LYS HD3 . 26870 1 699 . 1 1 54 54 LYS HE2 H 1 3.03 0.02 . 1 . . . . . 178 LYS HE2 . 26870 1 700 . 1 1 54 54 LYS HE3 H 1 3.03 0.02 . 1 . . . . . 178 LYS HE3 . 26870 1 701 . 1 1 54 54 LYS C C 13 175.36 0.3 . 1 . . . . . 178 LYS C . 26870 1 702 . 1 1 54 54 LYS CA C 13 56.934 0.3 . 1 . . . . . 178 LYS CA . 26870 1 703 . 1 1 54 54 LYS CB C 13 31.263 0.3 . 1 . . . . . 178 LYS CB . 26870 1 704 . 1 1 54 54 LYS CG C 13 24.848 0.3 . 1 . . . . . 178 LYS CG . 26870 1 705 . 1 1 54 54 LYS CD C 13 28.867 0.3 . 1 . . . . . 178 LYS CD . 26870 1 706 . 1 1 54 54 LYS CE C 13 41.407 0.3 . 1 . . . . . 178 LYS CE . 26870 1 707 . 1 1 54 54 LYS N N 15 124.976 0.3 . 1 . . . . . 178 LYS N . 26870 1 708 . 1 1 55 55 ARG H H 1 8.307 0.02 . 1 . . . . . 179 ARG H . 26870 1 709 . 1 1 55 55 ARG HA H 1 5.908 0.02 . 1 . . . . . 179 ARG HA . 26870 1 710 . 1 1 55 55 ARG HB2 H 1 1.947 0.02 . 2 . . . . . 179 ARG HB2 . 26870 1 711 . 1 1 55 55 ARG HB3 H 1 1.701 0.02 . 2 . . . . . 179 ARG HB3 . 26870 1 712 . 1 1 55 55 ARG HG2 H 1 1.557 0.02 . 1 . . . . . 179 ARG HG2 . 26870 1 713 . 1 1 55 55 ARG HG3 H 1 1.557 0.02 . 1 . . . . . 179 ARG HG3 . 26870 1 714 . 1 1 55 55 ARG HD2 H 1 3.156 0.02 . 2 . . . . . 179 ARG HD2 . 26870 1 715 . 1 1 55 55 ARG HD3 H 1 3.096 0.02 . 2 . . . . . 179 ARG HD3 . 26870 1 716 . 1 1 55 55 ARG HE H 1 7.401 0.02 . 1 . . . . . 179 ARG HE . 26870 1 717 . 1 1 55 55 ARG C C 13 176.861 0.3 . 1 . . . . . 179 ARG C . 26870 1 718 . 1 1 55 55 ARG CA C 13 53.8 0.3 . 1 . . . . . 179 ARG CA . 26870 1 719 . 1 1 55 55 ARG CB C 13 34.445 0.3 . 1 . . . . . 179 ARG CB . 26870 1 720 . 1 1 55 55 ARG CG C 13 26.951 0.3 . 1 . . . . . 179 ARG CG . 26870 1 721 . 1 1 55 55 ARG CD C 13 43.637 0.3 . 1 . . . . . 179 ARG CD . 26870 1 722 . 1 1 55 55 ARG N N 15 119.372 0.3 . 1 . . . . . 179 ARG N . 26870 1 723 . 1 1 55 55 ARG NE N 15 84.304 0.3 . 1 . . . . . 179 ARG NE . 26870 1 724 . 1 1 56 56 GLY H H 1 8.661 0.02 . 1 . . . . . 180 GLY H . 26870 1 725 . 1 1 56 56 GLY HA2 H 1 4.15 0.02 . 1 . . . . . 180 GLY HA2 . 26870 1 726 . 1 1 56 56 GLY HA3 H 1 4.15 0.02 . 1 . . . . . 180 GLY HA3 . 26870 1 727 . 1 1 56 56 GLY C C 13 171.139 0.3 . 1 . . . . . 180 GLY C . 26870 1 728 . 1 1 56 56 GLY CA C 13 45.344 0.3 . 1 . . . . . 180 GLY CA . 26870 1 729 . 1 1 56 56 GLY N N 15 107.46 0.3 . 1 . . . . . 180 GLY N . 26870 1 730 . 1 1 57 57 MET H H 1 9.018 0.02 . 1 . . . . . 181 MET H . 26870 1 731 . 1 1 57 57 MET HA H 1 5.595 0.02 . 1 . . . . . 181 MET HA . 26870 1 732 . 1 1 57 57 MET HB2 H 1 2.387 0.02 . 2 . . . . . 181 MET HB2 . 26870 1 733 . 1 1 57 57 MET HB3 H 1 2.098 0.02 . 2 . . . . . 181 MET HB3 . 26870 1 734 . 1 1 57 57 MET HG2 H 1 2.686 0.02 . 2 . . . . . 181 MET HG2 . 26870 1 735 . 1 1 57 57 MET HG3 H 1 2.634 0.02 . 2 . . . . . 181 MET HG3 . 26870 1 736 . 1 1 57 57 MET C C 13 177.535 0.3 . 1 . . . . . 181 MET C . 26870 1 737 . 1 1 57 57 MET CA C 13 54.042 0.3 . 1 . . . . . 181 MET CA . 26870 1 738 . 1 1 57 57 MET CB C 13 31.777 0.3 . 1 . . . . . 181 MET CB . 26870 1 739 . 1 1 57 57 MET CG C 13 31.96 0.3 . 1 . . . . . 181 MET CG . 26870 1 740 . 1 1 57 57 MET N N 15 117.628 0.3 . 1 . . . . . 181 MET N . 26870 1 741 . 1 1 58 58 ILE H H 1 9.615 0.02 . 1 . . . . . 182 ILE H . 26870 1 742 . 1 1 58 58 ILE HA H 1 5.192 0.02 . 1 . . . . . 182 ILE HA . 26870 1 743 . 1 1 58 58 ILE HB H 1 1.599 0.02 . 1 . . . . . 182 ILE HB . 26870 1 744 . 1 1 58 58 ILE HG12 H 1 1.593 0.02 . 2 . . . . . 182 ILE HG12 . 26870 1 745 . 1 1 58 58 ILE HG13 H 1 0.979 0.02 . 2 . . . . . 182 ILE HG13 . 26870 1 746 . 1 1 58 58 ILE HG21 H 1 1.322 0.02 . 1 . . . . . 182 ILE HG2 . 26870 1 747 . 1 1 58 58 ILE HG22 H 1 1.322 0.02 . 1 . . . . . 182 ILE HG2 . 26870 1 748 . 1 1 58 58 ILE HG23 H 1 1.322 0.02 . 1 . . . . . 182 ILE HG2 . 26870 1 749 . 1 1 58 58 ILE HD11 H 1 0.53 0.02 . 1 . . . . . 182 ILE HD1 . 26870 1 750 . 1 1 58 58 ILE HD12 H 1 0.53 0.02 . 1 . . . . . 182 ILE HD1 . 26870 1 751 . 1 1 58 58 ILE HD13 H 1 0.53 0.02 . 1 . . . . . 182 ILE HD1 . 26870 1 752 . 1 1 58 58 ILE C C 13 172.272 0.3 . 1 . . . . . 182 ILE C . 26870 1 753 . 1 1 58 58 ILE CA C 13 56.446 0.3 . 1 . . . . . 182 ILE CA . 26870 1 754 . 1 1 58 58 ILE CB C 13 41.179 0.3 . 1 . . . . . 182 ILE CB . 26870 1 755 . 1 1 58 58 ILE CG1 C 13 25.115 0.3 . 1 . . . . . 182 ILE CG1 . 26870 1 756 . 1 1 58 58 ILE CG2 C 13 21.787 0.3 . 1 . . . . . 182 ILE CG2 . 26870 1 757 . 1 1 58 58 ILE CD1 C 13 15.515 0.3 . 1 . . . . . 182 ILE CD1 . 26870 1 758 . 1 1 58 58 ILE N N 15 112.935 0.3 . 1 . . . . . 182 ILE N . 26870 1 759 . 1 1 59 59 PRO HA H 1 3.642 0.02 . 1 . . . . . 183 PRO HA . 26870 1 760 . 1 1 59 59 PRO HB2 H 1 0.934 0.02 . 2 . . . . . 183 PRO HB2 . 26870 1 761 . 1 1 59 59 PRO HB3 H 1 0.517 0.02 . 2 . . . . . 183 PRO HB3 . 26870 1 762 . 1 1 59 59 PRO HG2 H 1 0.713 0.02 . 2 . . . . . 183 PRO HG2 . 26870 1 763 . 1 1 59 59 PRO HG3 H 1 0.142 0.02 . 2 . . . . . 183 PRO HG3 . 26870 1 764 . 1 1 59 59 PRO HD2 H 1 2.793 0.02 . 2 . . . . . 183 PRO HD2 . 26870 1 765 . 1 1 59 59 PRO HD3 H 1 2.612 0.02 . 2 . . . . . 183 PRO HD3 . 26870 1 766 . 1 1 59 59 PRO C C 13 176.468 0.3 . 1 . . . . . 183 PRO C . 26870 1 767 . 1 1 59 59 PRO CA C 13 59.665 0.3 . 1 . . . . . 183 PRO CA . 26870 1 768 . 1 1 59 59 PRO CB C 13 29.829 0.3 . 1 . . . . . 183 PRO CB . 26870 1 769 . 1 1 59 59 PRO CG C 13 25.719 0.3 . 1 . . . . . 183 PRO CG . 26870 1 770 . 1 1 59 59 PRO CD C 13 49.627 0.3 . 1 . . . . . 183 PRO CD . 26870 1 771 . 1 1 60 60 VAL H H 1 7.347 0.02 . 1 . . . . . 184 VAL H . 26870 1 772 . 1 1 60 60 VAL HA H 1 2.765 0.02 . 1 . . . . . 184 VAL HA . 26870 1 773 . 1 1 60 60 VAL HB H 1 1.216 0.02 . 1 . . . . . 184 VAL HB . 26870 1 774 . 1 1 60 60 VAL HG11 H 1 0.021 0.02 . 2 . . . . . 184 VAL HG1 . 26870 1 775 . 1 1 60 60 VAL HG12 H 1 0.021 0.02 . 2 . . . . . 184 VAL HG1 . 26870 1 776 . 1 1 60 60 VAL HG13 H 1 0.021 0.02 . 2 . . . . . 184 VAL HG1 . 26870 1 777 . 1 1 60 60 VAL HG21 H 1 -0.884 0.02 . 2 . . . . . 184 VAL HG2 . 26870 1 778 . 1 1 60 60 VAL HG22 H 1 -0.884 0.02 . 2 . . . . . 184 VAL HG2 . 26870 1 779 . 1 1 60 60 VAL HG23 H 1 -0.884 0.02 . 2 . . . . . 184 VAL HG2 . 26870 1 780 . 1 1 60 60 VAL C C 13 175.038 0.3 . 1 . . . . . 184 VAL C . 26870 1 781 . 1 1 60 60 VAL CA C 13 66.533 0.3 . 1 . . . . . 184 VAL CA . 26870 1 782 . 1 1 60 60 VAL CB C 13 29.23 0.3 . 1 . . . . . 184 VAL CB . 26870 1 783 . 1 1 60 60 VAL CG1 C 13 20.31 0.3 . 1 . . . . . 184 VAL CG1 . 26870 1 784 . 1 1 60 60 VAL CG2 C 13 20.807 0.3 . 1 . . . . . 184 VAL CG2 . 26870 1 785 . 1 1 60 60 VAL N N 15 127.927 0.3 . 1 . . . . . 184 VAL N . 26870 1 786 . 1 1 61 61 PRO HA H 1 4.421 0.02 . 1 . . . . . 185 PRO HA . 26870 1 787 . 1 1 61 61 PRO HB2 H 1 2.339 0.02 . 2 . . . . . 185 PRO HB2 . 26870 1 788 . 1 1 61 61 PRO HB3 H 1 1.558 0.02 . 2 . . . . . 185 PRO HB3 . 26870 1 789 . 1 1 61 61 PRO HG2 H 1 1.757 0.02 . 1 . . . . . 185 PRO HG2 . 26870 1 790 . 1 1 61 61 PRO HG3 H 1 1.757 0.02 . 1 . . . . . 185 PRO HG3 . 26870 1 791 . 1 1 61 61 PRO HD2 H 1 3.405 0.02 . 2 . . . . . 185 PRO HD2 . 26870 1 792 . 1 1 61 61 PRO HD3 H 1 2.994 0.02 . 2 . . . . . 185 PRO HD3 . 26870 1 793 . 1 1 61 61 PRO C C 13 176.49 0.3 . 1 . . . . . 185 PRO C . 26870 1 794 . 1 1 61 61 PRO CA C 13 64.756 0.3 . 1 . . . . . 185 PRO CA . 26870 1 795 . 1 1 61 61 PRO CB C 13 30.914 0.3 . 1 . . . . . 185 PRO CB . 26870 1 796 . 1 1 61 61 PRO CG C 13 27.711 0.3 . 1 . . . . . 185 PRO CG . 26870 1 797 . 1 1 61 61 PRO CD C 13 50.558 0.3 . 1 . . . . . 185 PRO CD . 26870 1 798 . 1 1 62 62 TYR H H 1 7.787 0.02 . 1 . . . . . 186 TYR H . 26870 1 799 . 1 1 62 62 TYR HA H 1 4.767 0.02 . 1 . . . . . 186 TYR HA . 26870 1 800 . 1 1 62 62 TYR HB2 H 1 3.611 0.02 . 2 . . . . . 186 TYR HB2 . 26870 1 801 . 1 1 62 62 TYR HB3 H 1 3.392 0.02 . 2 . . . . . 186 TYR HB3 . 26870 1 802 . 1 1 62 62 TYR HD1 H 1 6.905 0.02 . 1 . . . . . 186 TYR HD1 . 26870 1 803 . 1 1 62 62 TYR HD2 H 1 6.905 0.02 . 1 . . . . . 186 TYR HD2 . 26870 1 804 . 1 1 62 62 TYR HE1 H 1 6.92 0.02 . 1 . . . . . 186 TYR HE1 . 26870 1 805 . 1 1 62 62 TYR HE2 H 1 6.92 0.02 . 1 . . . . . 186 TYR HE2 . 26870 1 806 . 1 1 62 62 TYR C C 13 175.221 0.3 . 1 . . . . . 186 TYR C . 26870 1 807 . 1 1 62 62 TYR CA C 13 57.55 0.3 . 1 . . . . . 186 TYR CA . 26870 1 808 . 1 1 62 62 TYR CB C 13 38.309 0.3 . 1 . . . . . 186 TYR CB . 26870 1 809 . 1 1 62 62 TYR CD1 C 13 131.435 0.3 . 1 . . . . . 186 TYR CD1 . 26870 1 810 . 1 1 62 62 TYR CD2 C 13 131.435 0.3 . 1 . . . . . 186 TYR CD2 . 26870 1 811 . 1 1 62 62 TYR CE1 C 13 117.986 0.3 . 1 . . . . . 186 TYR CE1 . 26870 1 812 . 1 1 62 62 TYR CE2 C 13 117.986 0.3 . 1 . . . . . 186 TYR CE2 . 26870 1 813 . 1 1 62 62 TYR N N 15 115.954 0.3 . 1 . . . . . 186 TYR N . 26870 1 814 . 1 1 63 63 VAL H H 1 7.831 0.02 . 1 . . . . . 187 VAL H . 26870 1 815 . 1 1 63 63 VAL HA H 1 5.232 0.02 . 1 . . . . . 187 VAL HA . 26870 1 816 . 1 1 63 63 VAL HB H 1 1.778 0.02 . 1 . . . . . 187 VAL HB . 26870 1 817 . 1 1 63 63 VAL HG11 H 1 0.408 0.02 . 2 . . . . . 187 VAL HG1 . 26870 1 818 . 1 1 63 63 VAL HG12 H 1 0.408 0.02 . 2 . . . . . 187 VAL HG1 . 26870 1 819 . 1 1 63 63 VAL HG13 H 1 0.408 0.02 . 2 . . . . . 187 VAL HG1 . 26870 1 820 . 1 1 63 63 VAL HG21 H 1 0.64 0.02 . 2 . . . . . 187 VAL HG2 . 26870 1 821 . 1 1 63 63 VAL HG22 H 1 0.64 0.02 . 2 . . . . . 187 VAL HG2 . 26870 1 822 . 1 1 63 63 VAL HG23 H 1 0.64 0.02 . 2 . . . . . 187 VAL HG2 . 26870 1 823 . 1 1 63 63 VAL C C 13 173.27 0.3 . 1 . . . . . 187 VAL C . 26870 1 824 . 1 1 63 63 VAL CA C 13 58.709 0.3 . 1 . . . . . 187 VAL CA . 26870 1 825 . 1 1 63 63 VAL CB C 13 35.687 0.3 . 1 . . . . . 187 VAL CB . 26870 1 826 . 1 1 63 63 VAL CG1 C 13 20.596 0.3 . 1 . . . . . 187 VAL CG1 . 26870 1 827 . 1 1 63 63 VAL CG2 C 13 17.191 0.3 . 1 . . . . . 187 VAL CG2 . 26870 1 828 . 1 1 63 63 VAL N N 15 111.051 0.3 . 1 . . . . . 187 VAL N . 26870 1 829 . 1 1 64 64 GLU H H 1 8.707 0.02 . 1 . . . . . 188 GLU H . 26870 1 830 . 1 1 64 64 GLU HA H 1 4.977 0.02 . 1 . . . . . 188 GLU HA . 26870 1 831 . 1 1 64 64 GLU HB2 H 1 2.153 0.02 . 2 . . . . . 188 GLU HB2 . 26870 1 832 . 1 1 64 64 GLU HB3 H 1 1.878 0.02 . 2 . . . . . 188 GLU HB3 . 26870 1 833 . 1 1 64 64 GLU HG2 H 1 2.375 0.02 . 2 . . . . . 188 GLU HG2 . 26870 1 834 . 1 1 64 64 GLU HG3 H 1 2.222 0.02 . 2 . . . . . 188 GLU HG3 . 26870 1 835 . 1 1 64 64 GLU C C 13 175.182 0.3 . 1 . . . . . 188 GLU C . 26870 1 836 . 1 1 64 64 GLU CA C 13 52.664 0.3 . 1 . . . . . 188 GLU CA . 26870 1 837 . 1 1 64 64 GLU CB C 13 33.441 0.3 . 1 . . . . . 188 GLU CB . 26870 1 838 . 1 1 64 64 GLU CG C 13 34.712 0.3 . 1 . . . . . 188 GLU CG . 26870 1 839 . 1 1 64 64 GLU CD C 13 183.251 0.3 . 1 . . . . . 188 GLU CD . 26870 1 840 . 1 1 64 64 GLU N N 15 116.894 0.3 . 1 . . . . . 188 GLU N . 26870 1 841 . 1 1 65 65 LYS H H 1 8.793 0.02 . 1 . . . . . 189 LYS H . 26870 1 842 . 1 1 65 65 LYS HA H 1 4.269 0.02 . 1 . . . . . 189 LYS HA . 26870 1 843 . 1 1 65 65 LYS HB2 H 1 1.89 0.02 . 2 . . . . . 189 LYS HB2 . 26870 1 844 . 1 1 65 65 LYS HB3 H 1 1.852 0.02 . 2 . . . . . 189 LYS HB3 . 26870 1 845 . 1 1 65 65 LYS HG2 H 1 1.651 0.02 . 2 . . . . . 189 LYS HG2 . 26870 1 846 . 1 1 65 65 LYS HG3 H 1 1.503 0.02 . 2 . . . . . 189 LYS HG3 . 26870 1 847 . 1 1 65 65 LYS HD2 H 1 1.758 0.02 . 1 . . . . . 189 LYS HD2 . 26870 1 848 . 1 1 65 65 LYS HD3 H 1 1.758 0.02 . 1 . . . . . 189 LYS HD3 . 26870 1 849 . 1 1 65 65 LYS HE2 H 1 3.044 0.02 . 1 . . . . . 189 LYS HE2 . 26870 1 850 . 1 1 65 65 LYS HE3 H 1 3.044 0.02 . 1 . . . . . 189 LYS HE3 . 26870 1 851 . 1 1 65 65 LYS C C 13 175.678 0.3 . 1 . . . . . 189 LYS C . 26870 1 852 . 1 1 65 65 LYS CA C 13 58.401 0.3 . 1 . . . . . 189 LYS CA . 26870 1 853 . 1 1 65 65 LYS CB C 13 32.393 0.3 . 1 . . . . . 189 LYS CB . 26870 1 854 . 1 1 65 65 LYS CG C 13 24.648 0.3 . 1 . . . . . 189 LYS CG . 26870 1 855 . 1 1 65 65 LYS CD C 13 29.097 0.3 . 1 . . . . . 189 LYS CD . 26870 1 856 . 1 1 65 65 LYS CE C 13 41.672 0.3 . 1 . . . . . 189 LYS CE . 26870 1 857 . 1 1 65 65 LYS N N 15 122.647 0.3 . 1 . . . . . 189 LYS N . 26870 1 858 . 1 1 66 66 TYR H H 1 8.198 0.02 . 1 . . . . . 190 TYR H . 26870 1 859 . 1 1 66 66 TYR HA H 1 4.692 0.02 . 1 . . . . . 190 TYR HA . 26870 1 860 . 1 1 66 66 TYR HB2 H 1 2.786 0.02 . 2 . . . . . 190 TYR HB2 . 26870 1 861 . 1 1 66 66 TYR HB3 H 1 2.411 0.02 . 2 . . . . . 190 TYR HB3 . 26870 1 862 . 1 1 66 66 TYR HD1 H 1 6.835 0.02 . 1 . . . . . 190 TYR HD1 . 26870 1 863 . 1 1 66 66 TYR HD2 H 1 6.835 0.02 . 1 . . . . . 190 TYR HD2 . 26870 1 864 . 1 1 66 66 TYR HE1 H 1 6.639 0.02 . 1 . . . . . 190 TYR HE1 . 26870 1 865 . 1 1 66 66 TYR HE2 H 1 6.639 0.02 . 1 . . . . . 190 TYR HE2 . 26870 1 866 . 1 1 66 66 TYR C C 13 172.974 0.3 . 1 . . . . . 190 TYR C . 26870 1 867 . 1 1 66 66 TYR CA C 13 57.11 0.3 . 1 . . . . . 190 TYR CA . 26870 1 868 . 1 1 66 66 TYR CB C 13 41.367 0.3 . 1 . . . . . 190 TYR CB . 26870 1 869 . 1 1 66 66 TYR CD1 C 13 132.541 0.3 . 1 . . . . . 190 TYR CD1 . 26870 1 870 . 1 1 66 66 TYR CD2 C 13 132.541 0.3 . 1 . . . . . 190 TYR CD2 . 26870 1 871 . 1 1 66 66 TYR CE1 C 13 118.055 0.3 . 1 . . . . . 190 TYR CE1 . 26870 1 872 . 1 1 66 66 TYR CE2 C 13 118.055 0.3 . 1 . . . . . 190 TYR CE2 . 26870 1 873 . 1 1 66 66 TYR N N 15 125.146 0.3 . 1 . . . . . 190 TYR N . 26870 1 874 . 1 1 67 67 ARG H H 1 7.933 0.02 . 1 . . . . . 191 ARG H . 26870 1 875 . 1 1 67 67 ARG HA H 1 4.571 0.02 . 1 . . . . . 191 ARG HA . 26870 1 876 . 1 1 67 67 ARG HB2 H 1 1.622 0.02 . 2 . . . . . 191 ARG HB2 . 26870 1 877 . 1 1 67 67 ARG HB3 H 1 1.488 0.02 . 2 . . . . . 191 ARG HB3 . 26870 1 878 . 1 1 67 67 ARG HG2 H 1 1.457 0.02 . 1 . . . . . 191 ARG HG2 . 26870 1 879 . 1 1 67 67 ARG HG3 H 1 1.457 0.02 . 1 . . . . . 191 ARG HG3 . 26870 1 880 . 1 1 67 67 ARG HD2 H 1 3.113 0.02 . 1 . . . . . 191 ARG HD2 . 26870 1 881 . 1 1 67 67 ARG HD3 H 1 3.113 0.02 . 1 . . . . . 191 ARG HD3 . 26870 1 882 . 1 1 67 67 ARG HE H 1 7.251 0.02 . 1 . . . . . 191 ARG HE . 26870 1 883 . 1 1 67 67 ARG C C 13 172.534 0.3 . 1 . . . . . 191 ARG C . 26870 1 884 . 1 1 67 67 ARG CA C 13 52.328 0.3 . 1 . . . . . 191 ARG CA . 26870 1 885 . 1 1 67 67 ARG CB C 13 30.851 0.3 . 1 . . . . . 191 ARG CB . 26870 1 886 . 1 1 67 67 ARG CG C 13 26.824 0.3 . 1 . . . . . 191 ARG CG . 26870 1 887 . 1 1 67 67 ARG CD C 13 43.284 0.3 . 1 . . . . . 191 ARG CD . 26870 1 888 . 1 1 67 67 ARG N N 15 127.999 0.3 . 1 . . . . . 191 ARG N . 26870 1 889 . 1 1 67 67 ARG NE N 15 84.866 0.3 . 1 . . . . . 191 ARG NE . 26870 1 890 . 1 1 68 68 PRO HA H 1 4.037 0.02 . 1 . . . . . 192 PRO HA . 26870 1 891 . 1 1 68 68 PRO HB2 H 1 2.087 0.02 . 2 . . . . . 192 PRO HB2 . 26870 1 892 . 1 1 68 68 PRO HB3 H 1 1.798 0.02 . 2 . . . . . 192 PRO HB3 . 26870 1 893 . 1 1 68 68 PRO HG2 H 1 1.694 0.02 . 2 . . . . . 192 PRO HG2 . 26870 1 894 . 1 1 68 68 PRO HG3 H 1 1.538 0.02 . 2 . . . . . 192 PRO HG3 . 26870 1 895 . 1 1 68 68 PRO HD2 H 1 3.516 0.02 . 2 . . . . . 192 PRO HD2 . 26870 1 896 . 1 1 68 68 PRO HD3 H 1 3.206 0.02 . 2 . . . . . 192 PRO HD3 . 26870 1 897 . 1 1 68 68 PRO C C 13 176.489 0.3 . 1 . . . . . 192 PRO C . 26870 1 898 . 1 1 68 68 PRO CA C 13 62.56 0.3 . 1 . . . . . 192 PRO CA . 26870 1 899 . 1 1 68 68 PRO CB C 13 31.709 0.3 . 1 . . . . . 192 PRO CB . 26870 1 900 . 1 1 68 68 PRO CG C 13 26.666 0.3 . 1 . . . . . 192 PRO CG . 26870 1 901 . 1 1 68 68 PRO CD C 13 50.429 0.3 . 1 . . . . . 192 PRO CD . 26870 1 902 . 1 1 69 69 ALA H H 1 8.343 0.02 . 1 . . . . . 193 ALA H . 26870 1 903 . 1 1 69 69 ALA HA H 1 4.206 0.02 . 1 . . . . . 193 ALA HA . 26870 1 904 . 1 1 69 69 ALA HB1 H 1 1.346 0.02 . 1 . . . . . 193 ALA HB . 26870 1 905 . 1 1 69 69 ALA HB2 H 1 1.346 0.02 . 1 . . . . . 193 ALA HB . 26870 1 906 . 1 1 69 69 ALA HB3 H 1 1.346 0.02 . 1 . . . . . 193 ALA HB . 26870 1 907 . 1 1 69 69 ALA C C 13 177.948 0.3 . 1 . . . . . 193 ALA C . 26870 1 908 . 1 1 69 69 ALA CA C 13 52.614 0.3 . 1 . . . . . 193 ALA CA . 26870 1 909 . 1 1 69 69 ALA CB C 13 18.831 0.3 . 1 . . . . . 193 ALA CB . 26870 1 910 . 1 1 69 69 ALA N N 15 124.049 0.3 . 1 . . . . . 193 ALA N . 26870 1 911 . 1 1 70 70 SER H H 1 8.175 0.02 . 1 . . . . . 194 SER H . 26870 1 912 . 1 1 70 70 SER HA H 1 4.35 0.02 . 1 . . . . . 194 SER HA . 26870 1 913 . 1 1 70 70 SER HB2 H 1 3.845 0.02 . 2 . . . . . 194 SER HB2 . 26870 1 914 . 1 1 70 70 SER HB3 H 1 3.804 0.02 . 2 . . . . . 194 SER HB3 . 26870 1 915 . 1 1 70 70 SER C C 13 174.37 0.3 . 1 . . . . . 194 SER C . 26870 1 916 . 1 1 70 70 SER CA C 13 58.25 0.3 . 1 . . . . . 194 SER CA . 26870 1 917 . 1 1 70 70 SER CB C 13 63.504 0.3 . 1 . . . . . 194 SER CB . 26870 1 918 . 1 1 70 70 SER N N 15 114.454 0.3 . 1 . . . . . 194 SER N . 26870 1 919 . 1 1 71 71 ALA H H 1 8.422 0.02 . 1 . . . . . 195 ALA H . 26870 1 920 . 1 1 71 71 ALA HA H 1 4.33 0.02 . 1 . . . . . 195 ALA HA . 26870 1 921 . 1 1 71 71 ALA HB1 H 1 1.37 0.02 . 1 . . . . . 195 ALA HB . 26870 1 922 . 1 1 71 71 ALA HB2 H 1 1.37 0.02 . 1 . . . . . 195 ALA HB . 26870 1 923 . 1 1 71 71 ALA HB3 H 1 1.37 0.02 . 1 . . . . . 195 ALA HB . 26870 1 924 . 1 1 71 71 ALA C C 13 177.735 0.3 . 1 . . . . . 195 ALA C . 26870 1 925 . 1 1 71 71 ALA CA C 13 52.513 0.3 . 1 . . . . . 195 ALA CA . 26870 1 926 . 1 1 71 71 ALA CB C 13 19.141 0.3 . 1 . . . . . 195 ALA CB . 26870 1 927 . 1 1 71 71 ALA N N 15 125.879 0.3 . 1 . . . . . 195 ALA N . 26870 1 928 . 1 1 72 72 SER H H 1 8.221 0.02 . 1 . . . . . 196 SER H . 26870 1 929 . 1 1 72 72 SER HA H 1 4.433 0.02 . 1 . . . . . 196 SER HA . 26870 1 930 . 1 1 72 72 SER HB2 H 1 3.839 0.02 . 1 . . . . . 196 SER HB2 . 26870 1 931 . 1 1 72 72 SER HB3 H 1 3.839 0.02 . 1 . . . . . 196 SER HB3 . 26870 1 932 . 1 1 72 72 SER C C 13 174.726 0.3 . 1 . . . . . 196 SER C . 26870 1 933 . 1 1 72 72 SER CA C 13 58.192 0.3 . 1 . . . . . 196 SER CA . 26870 1 934 . 1 1 72 72 SER CB C 13 64.174 0.3 . 1 . . . . . 196 SER CB . 26870 1 935 . 1 1 72 72 SER N N 15 114.852 0.3 . 1 . . . . . 196 SER N . 26870 1 936 . 1 1 73 73 VAL H H 1 8.104 0.02 . 1 . . . . . 197 VAL H . 26870 1 937 . 1 1 73 73 VAL HA H 1 4.139 0.02 . 1 . . . . . 197 VAL HA . 26870 1 938 . 1 1 73 73 VAL HB H 1 2.097 0.02 . 1 . . . . . 197 VAL HB . 26870 1 939 . 1 1 73 73 VAL HG11 H 1 0.908 0.02 . 1 . . . . . 197 VAL HG1 . 26870 1 940 . 1 1 73 73 VAL HG12 H 1 0.908 0.02 . 1 . . . . . 197 VAL HG1 . 26870 1 941 . 1 1 73 73 VAL HG13 H 1 0.908 0.02 . 1 . . . . . 197 VAL HG1 . 26870 1 942 . 1 1 73 73 VAL HG21 H 1 0.908 0.02 . 1 . . . . . 197 VAL HG2 . 26870 1 943 . 1 1 73 73 VAL HG22 H 1 0.908 0.02 . 1 . . . . . 197 VAL HG2 . 26870 1 944 . 1 1 73 73 VAL HG23 H 1 0.908 0.02 . 1 . . . . . 197 VAL HG2 . 26870 1 945 . 1 1 73 73 VAL C C 13 176.338 0.3 . 1 . . . . . 197 VAL C . 26870 1 946 . 1 1 73 73 VAL CA C 13 62.381 0.3 . 1 . . . . . 197 VAL CA . 26870 1 947 . 1 1 73 73 VAL CB C 13 32.5 0.3 . 1 . . . . . 197 VAL CB . 26870 1 948 . 1 1 73 73 VAL CG1 C 13 20.991 0.3 . 1 . . . . . 197 VAL CG1 . 26870 1 949 . 1 1 73 73 VAL CG2 C 13 20.262 0.3 . 1 . . . . . 197 VAL CG2 . 26870 1 950 . 1 1 73 73 VAL N N 15 121.448 0.3 . 1 . . . . . 197 VAL N . 26870 1 951 . 1 1 74 74 SER H H 1 8.304 0.02 . 1 . . . . . 198 SER H . 26870 1 952 . 1 1 74 74 SER HA H 1 4.38 0.02 . 1 . . . . . 198 SER HA . 26870 1 953 . 1 1 74 74 SER HB2 H 1 3.843 0.02 . 2 . . . . . 198 SER HB2 . 26870 1 954 . 1 1 74 74 SER HB3 H 1 3.809 0.02 . 2 . . . . . 198 SER HB3 . 26870 1 955 . 1 1 74 74 SER C C 13 174.452 0.3 . 1 . . . . . 198 SER C . 26870 1 956 . 1 1 74 74 SER CA C 13 58.331 0.3 . 1 . . . . . 198 SER CA . 26870 1 957 . 1 1 74 74 SER CB C 13 63.453 0.3 . 1 . . . . . 198 SER CB . 26870 1 958 . 1 1 74 74 SER N N 15 118.723 0.3 . 1 . . . . . 198 SER N . 26870 1 959 . 1 1 75 75 ALA H H 1 8.286 0.02 . 1 . . . . . 199 ALA H . 26870 1 960 . 1 1 75 75 ALA HA H 1 4.288 0.02 . 1 . . . . . 199 ALA HA . 26870 1 961 . 1 1 75 75 ALA HB1 H 1 1.356 0.02 . 1 . . . . . 199 ALA HB . 26870 1 962 . 1 1 75 75 ALA HB2 H 1 1.356 0.02 . 1 . . . . . 199 ALA HB . 26870 1 963 . 1 1 75 75 ALA HB3 H 1 1.356 0.02 . 1 . . . . . 199 ALA HB . 26870 1 964 . 1 1 75 75 ALA C C 13 177.592 0.3 . 1 . . . . . 199 ALA C . 26870 1 965 . 1 1 75 75 ALA CA C 13 52.543 0.3 . 1 . . . . . 199 ALA CA . 26870 1 966 . 1 1 75 75 ALA CB C 13 19.076 0.3 . 1 . . . . . 199 ALA CB . 26870 1 967 . 1 1 75 75 ALA N N 15 125.873 0.3 . 1 . . . . . 199 ALA N . 26870 1 968 . 1 1 76 76 LEU H H 1 8.091 0.02 . 1 . . . . . 200 LEU H . 26870 1 969 . 1 1 76 76 LEU HA H 1 4.305 0.02 . 1 . . . . . 200 LEU HA . 26870 1 970 . 1 1 76 76 LEU HB2 H 1 1.59 0.02 . 1 . . . . . 200 LEU HB2 . 26870 1 971 . 1 1 76 76 LEU HB3 H 1 1.59 0.02 . 1 . . . . . 200 LEU HB3 . 26870 1 972 . 1 1 76 76 LEU HG H 1 1.562 0.02 . 1 . . . . . 200 LEU HG . 26870 1 973 . 1 1 76 76 LEU HD11 H 1 0.876 0.02 . 2 . . . . . 200 LEU HD1 . 26870 1 974 . 1 1 76 76 LEU HD12 H 1 0.876 0.02 . 2 . . . . . 200 LEU HD1 . 26870 1 975 . 1 1 76 76 LEU HD13 H 1 0.876 0.02 . 2 . . . . . 200 LEU HD1 . 26870 1 976 . 1 1 76 76 LEU HD21 H 1 0.822 0.02 . 2 . . . . . 200 LEU HD2 . 26870 1 977 . 1 1 76 76 LEU HD22 H 1 0.822 0.02 . 2 . . . . . 200 LEU HD2 . 26870 1 978 . 1 1 76 76 LEU HD23 H 1 0.822 0.02 . 2 . . . . . 200 LEU HD2 . 26870 1 979 . 1 1 76 76 LEU C C 13 177.436 0.3 . 1 . . . . . 200 LEU C . 26870 1 980 . 1 1 76 76 LEU CA C 13 55.22 0.3 . 1 . . . . . 200 LEU CA . 26870 1 981 . 1 1 76 76 LEU CB C 13 41.945 0.3 . 1 . . . . . 200 LEU CB . 26870 1 982 . 1 1 76 76 LEU CG C 13 26.792 0.3 . 1 . . . . . 200 LEU CG . 26870 1 983 . 1 1 76 76 LEU CD1 C 13 24.79 0.3 . 1 . . . . . 200 LEU CD1 . 26870 1 984 . 1 1 76 76 LEU CD2 C 13 23.269 0.3 . 1 . . . . . 200 LEU CD2 . 26870 1 985 . 1 1 76 76 LEU N N 15 120.591 0.3 . 1 . . . . . 200 LEU N . 26870 1 986 . 1 1 77 77 ILE H H 1 8.024 0.02 . 1 . . . . . 201 ILE H . 26870 1 987 . 1 1 77 77 ILE HA H 1 4.154 0.02 . 1 . . . . . 201 ILE HA . 26870 1 988 . 1 1 77 77 ILE HB H 1 1.859 0.02 . 1 . . . . . 201 ILE HB . 26870 1 989 . 1 1 77 77 ILE HG12 H 1 1.451 0.02 . 2 . . . . . 201 ILE HG12 . 26870 1 990 . 1 1 77 77 ILE HG13 H 1 1.17 0.02 . 2 . . . . . 201 ILE HG13 . 26870 1 991 . 1 1 77 77 ILE HG21 H 1 0.88 0.02 . 1 . . . . . 201 ILE HG2 . 26870 1 992 . 1 1 77 77 ILE HG22 H 1 0.88 0.02 . 1 . . . . . 201 ILE HG2 . 26870 1 993 . 1 1 77 77 ILE HG23 H 1 0.88 0.02 . 1 . . . . . 201 ILE HG2 . 26870 1 994 . 1 1 77 77 ILE HD11 H 1 0.824 0.02 . 1 . . . . . 201 ILE HD1 . 26870 1 995 . 1 1 77 77 ILE HD12 H 1 0.824 0.02 . 1 . . . . . 201 ILE HD1 . 26870 1 996 . 1 1 77 77 ILE HD13 H 1 0.824 0.02 . 1 . . . . . 201 ILE HD1 . 26870 1 997 . 1 1 77 77 ILE C C 13 176.767 0.3 . 1 . . . . . 201 ILE C . 26870 1 998 . 1 1 77 77 ILE CA C 13 61.094 0.3 . 1 . . . . . 201 ILE CA . 26870 1 999 . 1 1 77 77 ILE CB C 13 38.485 0.3 . 1 . . . . . 201 ILE CB . 26870 1 1000 . 1 1 77 77 ILE CG1 C 13 27.054 0.3 . 1 . . . . . 201 ILE CG1 . 26870 1 1001 . 1 1 77 77 ILE CG2 C 13 17.27 0.3 . 1 . . . . . 201 ILE CG2 . 26870 1 1002 . 1 1 77 77 ILE CD1 C 13 12.711 0.3 . 1 . . . . . 201 ILE CD1 . 26870 1 1003 . 1 1 77 77 ILE N N 15 121.327 0.3 . 1 . . . . . 201 ILE N . 26870 1 1004 . 1 1 78 78 GLY H H 1 8.464 0.02 . 1 . . . . . 202 GLY H . 26870 1 1005 . 1 1 78 78 GLY HA2 H 1 3.956 0.02 . 1 . . . . . 202 GLY HA2 . 26870 1 1006 . 1 1 78 78 GLY HA3 H 1 3.956 0.02 . 1 . . . . . 202 GLY HA3 . 26870 1 1007 . 1 1 78 78 GLY C C 13 174.601 0.3 . 1 . . . . . 202 GLY C . 26870 1 1008 . 1 1 78 78 GLY CA C 13 44.986 0.3 . 1 . . . . . 202 GLY CA . 26870 1 1009 . 1 1 78 78 GLY N N 15 112.783 0.3 . 1 . . . . . 202 GLY N . 26870 1 1010 . 1 1 79 79 GLY H H 1 8.248 0.02 . 1 . . . . . 203 GLY H . 26870 1 1011 . 1 1 79 79 GLY HA2 H 1 3.957 0.02 . 1 . . . . . 203 GLY HA2 . 26870 1 1012 . 1 1 79 79 GLY HA3 H 1 3.957 0.02 . 1 . . . . . 203 GLY HA3 . 26870 1 1013 . 1 1 79 79 GLY C C 13 173.94 0.3 . 1 . . . . . 203 GLY C . 26870 1 1014 . 1 1 79 79 GLY CA C 13 44.986 0.3 . 1 . . . . . 203 GLY CA . 26870 1 1015 . 1 1 79 79 GLY N N 15 108.439 0.3 . 1 . . . . . 203 GLY N . 26870 1 1016 . 1 1 80 80 ASN H H 1 8.419 0.02 . 1 . . . . . 204 ASN H . 26870 1 1017 . 1 1 80 80 ASN HA H 1 4.707 0.02 . 1 . . . . . 204 ASN HA . 26870 1 1018 . 1 1 80 80 ASN HB2 H 1 2.815 0.02 . 2 . . . . . 204 ASN HB2 . 26870 1 1019 . 1 1 80 80 ASN HB3 H 1 2.737 0.02 . 2 . . . . . 204 ASN HB3 . 26870 1 1020 . 1 1 80 80 ASN HD21 H 1 7.614 0.02 . 1 . . . . . 204 ASN HD21 . 26870 1 1021 . 1 1 80 80 ASN HD22 H 1 6.935 0.02 . 1 . . . . . 204 ASN HD22 . 26870 1 1022 . 1 1 80 80 ASN C C 13 175.269 0.3 . 1 . . . . . 204 ASN C . 26870 1 1023 . 1 1 80 80 ASN CA C 13 53.051 0.3 . 1 . . . . . 204 ASN CA . 26870 1 1024 . 1 1 80 80 ASN CB C 13 38.778 0.3 . 1 . . . . . 204 ASN CB . 26870 1 1025 . 1 1 80 80 ASN CG C 13 177.212 0.3 . 1 . . . . . 204 ASN CG . 26870 1 1026 . 1 1 80 80 ASN N N 15 118.511 0.3 . 1 . . . . . 204 ASN N . 26870 1 1027 . 1 1 80 80 ASN ND2 N 15 112.954 0.3 . 1 . . . . . 204 ASN ND2 . 26870 1 1028 . 1 1 81 81 GLN H H 1 8.498 0.02 . 1 . . . . . 205 GLN H . 26870 1 1029 . 1 1 81 81 GLN HA H 1 4.321 0.02 . 1 . . . . . 205 GLN HA . 26870 1 1030 . 1 1 81 81 GLN HB2 H 1 2.13 0.02 . 2 . . . . . 205 GLN HB2 . 26870 1 1031 . 1 1 81 81 GLN HB3 H 1 1.969 0.02 . 2 . . . . . 205 GLN HB3 . 26870 1 1032 . 1 1 81 81 GLN HG2 H 1 2.329 0.02 . 1 . . . . . 205 GLN HG2 . 26870 1 1033 . 1 1 81 81 GLN HG3 H 1 2.329 0.02 . 1 . . . . . 205 GLN HG3 . 26870 1 1034 . 1 1 81 81 GLN HE21 H 1 7.543 0.02 . 1 . . . . . 205 GLN HE21 . 26870 1 1035 . 1 1 81 81 GLN HE22 H 1 6.837 0.02 . 1 . . . . . 205 GLN HE22 . 26870 1 1036 . 1 1 81 81 GLN C C 13 175.844 0.3 . 1 . . . . . 205 GLN C . 26870 1 1037 . 1 1 81 81 GLN CA C 13 55.79 0.3 . 1 . . . . . 205 GLN CA . 26870 1 1038 . 1 1 81 81 GLN CB C 13 29.076 0.3 . 1 . . . . . 205 GLN CB . 26870 1 1039 . 1 1 81 81 GLN CG C 13 33.606 0.3 . 1 . . . . . 205 GLN CG . 26870 1 1040 . 1 1 81 81 GLN CD C 13 180.619 0.3 . 1 . . . . . 205 GLN CD . 26870 1 1041 . 1 1 81 81 GLN N N 15 120.816 0.3 . 1 . . . . . 205 GLN N . 26870 1 1042 . 1 1 81 81 GLN NE2 N 15 112.578 0.3 . 1 . . . . . 205 GLN NE2 . 26870 1 1043 . 1 1 82 82 GLU H H 1 8.45 0.02 . 1 . . . . . 206 GLU H . 26870 1 1044 . 1 1 82 82 GLU HA H 1 4.311 0.02 . 1 . . . . . 206 GLU HA . 26870 1 1045 . 1 1 82 82 GLU HB2 H 1 2.068 0.02 . 2 . . . . . 206 GLU HB2 . 26870 1 1046 . 1 1 82 82 GLU HB3 H 1 1.914 0.02 . 2 . . . . . 206 GLU HB3 . 26870 1 1047 . 1 1 82 82 GLU HG2 H 1 2.235 0.02 . 1 . . . . . 206 GLU HG2 . 26870 1 1048 . 1 1 82 82 GLU HG3 H 1 2.235 0.02 . 1 . . . . . 206 GLU HG3 . 26870 1 1049 . 1 1 82 82 GLU C C 13 175.881 0.3 . 1 . . . . . 206 GLU C . 26870 1 1050 . 1 1 82 82 GLU CA C 13 56.408 0.3 . 1 . . . . . 206 GLU CA . 26870 1 1051 . 1 1 82 82 GLU CB C 13 30.217 0.3 . 1 . . . . . 206 GLU CB . 26870 1 1052 . 1 1 82 82 GLU CG C 13 35.954 0.3 . 1 . . . . . 206 GLU CG . 26870 1 1053 . 1 1 82 82 GLU CD C 13 184.087 0.3 . 1 . . . . . 206 GLU CD . 26870 1 1054 . 1 1 82 82 GLU N N 15 122.109 0.3 . 1 . . . . . 206 GLU N . 26870 1 1055 . 1 1 83 83 GLY H H 1 8.026 0.02 . 1 . . . . . 207 GLY H . 26870 1 1056 . 1 1 83 83 GLY HA2 H 1 3.737 0.02 . 1 . . . . . 207 GLY HA2 . 26870 1 1057 . 1 1 83 83 GLY HA3 H 1 3.737 0.02 . 1 . . . . . 207 GLY HA3 . 26870 1 1058 . 1 1 83 83 GLY C C 13 178.972 0.3 . 1 . . . . . 207 GLY C . 26870 1 1059 . 1 1 83 83 GLY CA C 13 45.897 0.3 . 1 . . . . . 207 GLY CA . 26870 1 1060 . 1 1 83 83 GLY N N 15 116.154 0.3 . 1 . . . . . 207 GLY N . 26870 1 stop_ save_