data_36058 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 36058 _Entry.Title ; Refined solution structure of musashi1 RBD2 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2017-02-09 _Entry.Accession_date 2017-05-29 _Entry.Last_release_date 2017-05-29 _Entry.Original_release_date 2017-05-29 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.0.16 _Entry.Original_NMR_STAR_version 3.1.1.99 _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 . 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 R. Iwaoka R. . . . 36058 2 T. Nagata T. . . . 36058 3 K. Tsuda K. . . . 36058 4 T. Imai T. . . . 36058 5 H. Okano H. . . . 36058 6 N. Kobayashi N. . . . 36058 7 M. Katahira M. . . . 36058 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID RBD . 36058 'RNA-binding protein' . 36058 RRM . 36058 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 36058 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 404 36058 '15N chemical shifts' 93 36058 '1H chemical shifts' 598 36058 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 . . 2017-12-11 . original BMRB . 36058 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 36059 'Solution structure of musashi1 RBD2 in complex with RNA' 36058 PDB 5X3Y 'BMRB Entry Tracking System' 36058 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 36058 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title ; Refined solution structure of musashi1 RBD2 ; _Citation.Status 'in preparation' _Citation.Type journal _Citation.Journal_abbrev . _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD 0353 _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first . _Citation.Page_last . _Citation.Year . _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 R. Iwaoka R. . . . 36058 1 2 T. Nagata T. . . . 36058 1 3 K. Tsuda K. . . . 36058 1 4 T. Imai T. . . . 36058 1 5 H. Okano H. . . . 36058 1 6 N. Kobayashi N. . . . 36058 1 7 M. Katahira M. . . . 36058 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 36058 _Assembly.ID 1 _Assembly.Name 'RNA-binding protein Musashi homolog 1' _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _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 entity_1 1 $entity_1 A A yes . . . . . . 36058 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 36058 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity_1 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GSHMKKIFVGGLSVNTTVED VKHYFEQFGKVDDAMLMFDK TTNRHRGFGFVTFESEDIVE KVCEIHFHEINNKMVECKKA QPKEVMSPTGSARGRS ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer no _Entity.Nstd_chirality . _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 96 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method man _Entity.Parent_entity_ID 1 _Entity.Fragment 'UNP residues 109-200' _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 10945.506 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID Musashi-1 na 36058 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . GLY . 36058 1 2 . SER . 36058 1 3 . HIS . 36058 1 4 . MET . 36058 1 5 109 LYS . 36058 1 6 110 LYS . 36058 1 7 111 ILE . 36058 1 8 112 PHE . 36058 1 9 113 VAL . 36058 1 10 114 GLY . 36058 1 11 115 GLY . 36058 1 12 116 LEU . 36058 1 13 117 SER . 36058 1 14 118 VAL . 36058 1 15 119 ASN . 36058 1 16 120 THR . 36058 1 17 121 THR . 36058 1 18 122 VAL . 36058 1 19 123 GLU . 36058 1 20 124 ASP . 36058 1 21 125 VAL . 36058 1 22 126 LYS . 36058 1 23 127 HIS . 36058 1 24 128 TYR . 36058 1 25 129 PHE . 36058 1 26 130 GLU . 36058 1 27 131 GLN . 36058 1 28 132 PHE . 36058 1 29 133 GLY . 36058 1 30 134 LYS . 36058 1 31 135 VAL . 36058 1 32 136 ASP . 36058 1 33 137 ASP . 36058 1 34 138 ALA . 36058 1 35 139 MET . 36058 1 36 140 LEU . 36058 1 37 141 MET . 36058 1 38 142 PHE . 36058 1 39 143 ASP . 36058 1 40 144 LYS . 36058 1 41 145 THR . 36058 1 42 146 THR . 36058 1 43 147 ASN . 36058 1 44 148 ARG . 36058 1 45 149 HIS . 36058 1 46 150 ARG . 36058 1 47 151 GLY . 36058 1 48 152 PHE . 36058 1 49 153 GLY . 36058 1 50 154 PHE . 36058 1 51 155 VAL . 36058 1 52 156 THR . 36058 1 53 157 PHE . 36058 1 54 158 GLU . 36058 1 55 159 SER . 36058 1 56 160 GLU . 36058 1 57 161 ASP . 36058 1 58 162 ILE . 36058 1 59 163 VAL . 36058 1 60 164 GLU . 36058 1 61 165 LYS . 36058 1 62 166 VAL . 36058 1 63 167 CYS . 36058 1 64 168 GLU . 36058 1 65 169 ILE . 36058 1 66 170 HIS . 36058 1 67 171 PHE . 36058 1 68 172 HIS . 36058 1 69 173 GLU . 36058 1 70 174 ILE . 36058 1 71 175 ASN . 36058 1 72 176 ASN . 36058 1 73 177 LYS . 36058 1 74 178 MET . 36058 1 75 179 VAL . 36058 1 76 180 GLU . 36058 1 77 181 CYS . 36058 1 78 182 LYS . 36058 1 79 183 LYS . 36058 1 80 184 ALA . 36058 1 81 185 GLN . 36058 1 82 186 PRO . 36058 1 83 187 LYS . 36058 1 84 188 GLU . 36058 1 85 189 VAL . 36058 1 86 190 MET . 36058 1 87 191 SER . 36058 1 88 192 PRO . 36058 1 89 193 THR . 36058 1 90 194 GLY . 36058 1 91 195 SER . 36058 1 92 196 ALA . 36058 1 93 197 ARG . 36058 1 94 198 GLY . 36058 1 95 199 ARG . 36058 1 96 200 SER . 36058 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 36058 1 . SER 2 2 36058 1 . HIS 3 3 36058 1 . MET 4 4 36058 1 . LYS 5 5 36058 1 . LYS 6 6 36058 1 . ILE 7 7 36058 1 . PHE 8 8 36058 1 . VAL 9 9 36058 1 . GLY 10 10 36058 1 . GLY 11 11 36058 1 . LEU 12 12 36058 1 . SER 13 13 36058 1 . VAL 14 14 36058 1 . ASN 15 15 36058 1 . THR 16 16 36058 1 . THR 17 17 36058 1 . VAL 18 18 36058 1 . GLU 19 19 36058 1 . ASP 20 20 36058 1 . VAL 21 21 36058 1 . LYS 22 22 36058 1 . HIS 23 23 36058 1 . TYR 24 24 36058 1 . PHE 25 25 36058 1 . GLU 26 26 36058 1 . GLN 27 27 36058 1 . PHE 28 28 36058 1 . GLY 29 29 36058 1 . LYS 30 30 36058 1 . VAL 31 31 36058 1 . ASP 32 32 36058 1 . ASP 33 33 36058 1 . ALA 34 34 36058 1 . MET 35 35 36058 1 . LEU 36 36 36058 1 . MET 37 37 36058 1 . PHE 38 38 36058 1 . ASP 39 39 36058 1 . LYS 40 40 36058 1 . THR 41 41 36058 1 . THR 42 42 36058 1 . ASN 43 43 36058 1 . ARG 44 44 36058 1 . HIS 45 45 36058 1 . ARG 46 46 36058 1 . GLY 47 47 36058 1 . PHE 48 48 36058 1 . GLY 49 49 36058 1 . PHE 50 50 36058 1 . VAL 51 51 36058 1 . THR 52 52 36058 1 . PHE 53 53 36058 1 . GLU 54 54 36058 1 . SER 55 55 36058 1 . GLU 56 56 36058 1 . ASP 57 57 36058 1 . ILE 58 58 36058 1 . VAL 59 59 36058 1 . GLU 60 60 36058 1 . LYS 61 61 36058 1 . VAL 62 62 36058 1 . CYS 63 63 36058 1 . GLU 64 64 36058 1 . ILE 65 65 36058 1 . HIS 66 66 36058 1 . PHE 67 67 36058 1 . HIS 68 68 36058 1 . GLU 69 69 36058 1 . ILE 70 70 36058 1 . ASN 71 71 36058 1 . ASN 72 72 36058 1 . LYS 73 73 36058 1 . MET 74 74 36058 1 . VAL 75 75 36058 1 . GLU 76 76 36058 1 . CYS 77 77 36058 1 . LYS 78 78 36058 1 . LYS 79 79 36058 1 . ALA 80 80 36058 1 . GLN 81 81 36058 1 . PRO 82 82 36058 1 . LYS 83 83 36058 1 . GLU 84 84 36058 1 . VAL 85 85 36058 1 . MET 86 86 36058 1 . SER 87 87 36058 1 . PRO 88 88 36058 1 . THR 89 89 36058 1 . GLY 90 90 36058 1 . SER 91 91 36058 1 . ALA 92 92 36058 1 . ARG 93 93 36058 1 . GLY 94 94 36058 1 . ARG 95 95 36058 1 . SER 96 96 36058 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 36058 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity_1 . 10090 organism . 'Mus musculus' Mouse . . Eukaryota Metazoa Mus musculus . . . . . . . . . . . 'Msi1, Msi1h' . 36058 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 36058 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'recombinant technology' 'Escherichia coli' . . 562 Escherichia coli . . . VECTOR . . pET15B . . . 36058 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 36058 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details '250 uM [U-100% 13C; U-100% 15N] Msi1 RBD2, 95% H2O/5% D2O' _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% 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 'Msi1 RBD2' '[U-100% 13C; U-100% 15N]' . . 1 $entity_1 . protein 250 . . uM . . . . 36058 1 2 MES 'natural abundance' . . . . . buffer 20 . . mM . . . . 36058 1 3 'sodium chloride' 'natural abundance' . . . . . salt 100 . . mM . . . . 36058 1 4 H2O 'natural abundance' . . . . . solvent 95 . . % . . . . 36058 1 5 D2O [U-2H] . . . . . solvent 5 . . % . . . . 36058 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 36058 _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' 100 . mM 36058 1 pH 6.0 . pH 36058 1 pressure 1 . atm 36058 1 temperature 298 . K 36058 1 stop_ save_ ############################ # Computer software used # ############################ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 36058 _Software.ID 2 _Software.Type . _Software.Name CYANA _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . 36058 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure calculation' 36058 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 36058 _Software.ID 3 _Software.Type . _Software.Name MagRO _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Kobayashi . . 36058 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 36058 3 stop_ save_ save_software_4 _Software.Sf_category software _Software.Sf_framecode software_4 _Software.Entry_ID 36058 _Software.ID 4 _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' . . 36058 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 36058 4 stop_ save_ save_software_5 _Software.Sf_category software _Software.Sf_framecode software_5 _Software.Entry_ID 36058 _Software.ID 5 _Software.Type . _Software.Name NMRView _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Johnson, One Moon Scientific' . . 36058 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 36058 5 stop_ save_ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 36058 _Software.ID 1 _Software.Type . _Software.Name AMBER _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Case, Darden, Cheatham III, Simmerling, Wang, Duke, Luo, ... and Kollman' . . 36058 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 36058 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID 36058 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DRX _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 36058 _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 NMR_spectrometer_1 Bruker DRX . 600 . . . 36058 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 36058 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 36058 1 2 '2D 1H-13C HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 36058 1 3 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 36058 1 4 '3D 1H-13C NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 36058 1 5 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 36058 1 6 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 36058 1 7 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 36058 1 8 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 36058 1 9 '3D HBHA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 36058 1 10 '3D HCCH-TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 36058 1 11 '3D HCCH-COSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 36058 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chem_shift_reference_1 _Chem_shift_reference.Entry_ID 36058 _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 0.000 external indirect 0.25144953 . . . . . 36058 1 H 1 DSS 'methyl protons' . . . . ppm 0.000 external direct 1.0 . . . . . 36058 1 N 15 DSS 'methyl protons' . . . . ppm 0.000 external indirect 0.10132912 . . . . . 36058 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 36058 _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 $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' 1 $sample_1 isotropic 36058 1 2 '2D 1H-13C HSQC' 1 $sample_1 isotropic 36058 1 3 '3D 1H-15N NOESY' 1 $sample_1 isotropic 36058 1 4 '3D 1H-13C NOESY' 1 $sample_1 isotropic 36058 1 5 '3D HNCO' 1 $sample_1 isotropic 36058 1 6 '3D CBCA(CO)NH' 1 $sample_1 isotropic 36058 1 7 '3D HNCACB' 1 $sample_1 isotropic 36058 1 8 '3D HNCA' 1 $sample_1 isotropic 36058 1 9 '3D HBHA(CO)NH' 1 $sample_1 isotropic 36058 1 10 '3D HCCH-TOCSY' 1 $sample_1 isotropic 36058 1 11 '3D HCCH-COSY' 1 $sample_1 isotropic 36058 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 5 5 LYS H H 1 8.348 0.030 . 1 . . . . A 109 LYS H . 36058 1 2 . 1 1 5 5 LYS HA H 1 4.334 0.030 . 1 . . . . A 109 LYS HA . 36058 1 3 . 1 1 5 5 LYS HB2 H 1 2.486 0.030 . 1 . . . . A 109 LYS HB2 . 36058 1 4 . 1 1 5 5 LYS HB3 H 1 2.486 0.030 . 1 . . . . A 109 LYS HB3 . 36058 1 5 . 1 1 5 5 LYS HG2 H 1 1.380 0.030 . 2 . . . . A 109 LYS HG2 . 36058 1 6 . 1 1 5 5 LYS HG3 H 1 1.073 0.030 . 2 . . . . A 109 LYS HG3 . 36058 1 7 . 1 1 5 5 LYS HE2 H 1 3.009 0.030 . 2 . . . . A 109 LYS HE2 . 36058 1 8 . 1 1 5 5 LYS HE3 H 1 2.273 0.030 . 2 . . . . A 109 LYS HE3 . 36058 1 9 . 1 1 5 5 LYS C C 13 173.786 0.300 . 1 . . . . A 109 LYS C . 36058 1 10 . 1 1 5 5 LYS CA C 13 56.769 0.300 . 1 . . . . A 109 LYS CA . 36058 1 11 . 1 1 5 5 LYS CB C 13 32.697 0.300 . 1 . . . . A 109 LYS CB . 36058 1 12 . 1 1 5 5 LYS CG C 13 26.427 0.300 . 1 . . . . A 109 LYS CG . 36058 1 13 . 1 1 5 5 LYS CD C 13 29.336 0.300 . 1 . . . . A 109 LYS CD . 36058 1 14 . 1 1 5 5 LYS CE C 13 42.329 0.300 . 1 . . . . A 109 LYS CE . 36058 1 15 . 1 1 5 5 LYS N N 15 119.144 0.300 . 1 . . . . A 109 LYS N . 36058 1 16 . 1 1 6 6 LYS H H 1 7.402 0.030 . 1 . . . . A 110 LYS H . 36058 1 17 . 1 1 6 6 LYS HA H 1 5.449 0.030 . 1 . . . . A 110 LYS HA . 36058 1 18 . 1 1 6 6 LYS HB2 H 1 1.677 0.030 . 2 . . . . A 110 LYS HB2 . 36058 1 19 . 1 1 6 6 LYS HB3 H 1 1.610 0.030 . 2 . . . . A 110 LYS HB3 . 36058 1 20 . 1 1 6 6 LYS HG2 H 1 1.360 0.030 . 1 . . . . A 110 LYS HG2 . 36058 1 21 . 1 1 6 6 LYS HG3 H 1 1.360 0.030 . 1 . . . . A 110 LYS HG3 . 36058 1 22 . 1 1 6 6 LYS HE2 H 1 2.454 0.030 . 2 . . . . A 110 LYS HE2 . 36058 1 23 . 1 1 6 6 LYS HE3 H 1 2.578 0.030 . 2 . . . . A 110 LYS HE3 . 36058 1 24 . 1 1 6 6 LYS C C 13 175.808 0.300 . 1 . . . . A 110 LYS C . 36058 1 25 . 1 1 6 6 LYS CA C 13 54.775 0.300 . 1 . . . . A 110 LYS CA . 36058 1 26 . 1 1 6 6 LYS CB C 13 36.652 0.300 . 1 . . . . A 110 LYS CB . 36058 1 27 . 1 1 6 6 LYS CG C 13 24.708 0.300 . 1 . . . . A 110 LYS CG . 36058 1 28 . 1 1 6 6 LYS CD C 13 29.446 0.300 . 1 . . . . A 110 LYS CD . 36058 1 29 . 1 1 6 6 LYS CE C 13 41.462 0.300 . 1 . . . . A 110 LYS CE . 36058 1 30 . 1 1 6 6 LYS N N 15 119.660 0.300 . 1 . . . . A 110 LYS N . 36058 1 31 . 1 1 7 7 ILE H H 1 9.124 0.030 . 1 . . . . A 111 ILE H . 36058 1 32 . 1 1 7 7 ILE HA H 1 4.958 0.030 . 1 . . . . A 111 ILE HA . 36058 1 33 . 1 1 7 7 ILE HB H 1 1.804 0.030 . 1 . . . . A 111 ILE HB . 36058 1 34 . 1 1 7 7 ILE HG12 H 1 1.244 0.030 . 2 . . . . A 111 ILE HG12 . 36058 1 35 . 1 1 7 7 ILE HG13 H 1 0.947 0.030 . 2 . . . . A 111 ILE HG13 . 36058 1 36 . 1 1 7 7 ILE HG21 H 1 0.706 0.030 . 1 . . . . A 111 ILE HG21 . 36058 1 37 . 1 1 7 7 ILE HG22 H 1 0.706 0.030 . 1 . . . . A 111 ILE HG22 . 36058 1 38 . 1 1 7 7 ILE HG23 H 1 0.706 0.030 . 1 . . . . A 111 ILE HG23 . 36058 1 39 . 1 1 7 7 ILE HD11 H 1 0.191 0.030 . 1 . . . . A 111 ILE HD11 . 36058 1 40 . 1 1 7 7 ILE HD12 H 1 0.191 0.030 . 1 . . . . A 111 ILE HD12 . 36058 1 41 . 1 1 7 7 ILE HD13 H 1 0.191 0.030 . 1 . . . . A 111 ILE HD13 . 36058 1 42 . 1 1 7 7 ILE C C 13 174.793 0.300 . 1 . . . . A 111 ILE C . 36058 1 43 . 1 1 7 7 ILE CA C 13 59.114 0.300 . 1 . . . . A 111 ILE CA . 36058 1 44 . 1 1 7 7 ILE CB C 13 40.552 0.300 . 1 . . . . A 111 ILE CB . 36058 1 45 . 1 1 7 7 ILE CG1 C 13 26.261 0.300 . 1 . . . . A 111 ILE CG1 . 36058 1 46 . 1 1 7 7 ILE CG2 C 13 20.015 0.300 . 1 . . . . A 111 ILE CG2 . 36058 1 47 . 1 1 7 7 ILE CD1 C 13 14.604 0.300 . 1 . . . . A 111 ILE CD1 . 36058 1 48 . 1 1 7 7 ILE N N 15 116.486 0.300 . 1 . . . . A 111 ILE N . 36058 1 49 . 1 1 8 8 PHE H H 1 9.157 0.030 . 1 . . . . A 112 PHE H . 36058 1 50 . 1 1 8 8 PHE HA H 1 4.679 0.030 . 1 . . . . A 112 PHE HA . 36058 1 51 . 1 1 8 8 PHE HB2 H 1 2.744 0.030 . 2 . . . . A 112 PHE HB2 . 36058 1 52 . 1 1 8 8 PHE HB3 H 1 2.961 0.030 . 2 . . . . A 112 PHE HB3 . 36058 1 53 . 1 1 8 8 PHE HD1 H 1 6.875 0.030 . 1 . . . . A 112 PHE HD1 . 36058 1 54 . 1 1 8 8 PHE HD2 H 1 6.875 0.030 . 1 . . . . A 112 PHE HD2 . 36058 1 55 . 1 1 8 8 PHE HE1 H 1 6.932 0.030 . 1 . . . . A 112 PHE HE1 . 36058 1 56 . 1 1 8 8 PHE HE2 H 1 6.932 0.030 . 1 . . . . A 112 PHE HE2 . 36058 1 57 . 1 1 8 8 PHE C C 13 173.983 0.300 . 1 . . . . A 112 PHE C . 36058 1 58 . 1 1 8 8 PHE CA C 13 56.686 0.300 . 1 . . . . A 112 PHE CA . 36058 1 59 . 1 1 8 8 PHE CB C 13 41.173 0.300 . 1 . . . . A 112 PHE CB . 36058 1 60 . 1 1 8 8 PHE CD1 C 13 131.698 0.300 . 1 . . . . A 112 PHE CD1 . 36058 1 61 . 1 1 8 8 PHE CD2 C 13 131.698 0.300 . 1 . . . . A 112 PHE CD2 . 36058 1 62 . 1 1 8 8 PHE CE1 C 13 131.240 0.300 . 1 . . . . A 112 PHE CE1 . 36058 1 63 . 1 1 8 8 PHE CE2 C 13 131.240 0.300 . 1 . . . . A 112 PHE CE2 . 36058 1 64 . 1 1 8 8 PHE N N 15 124.107 0.300 . 1 . . . . A 112 PHE N . 36058 1 65 . 1 1 9 9 VAL H H 1 7.852 0.030 . 1 . . . . A 113 VAL H . 36058 1 66 . 1 1 9 9 VAL HA H 1 4.866 0.030 . 1 . . . . A 113 VAL HA . 36058 1 67 . 1 1 9 9 VAL HB H 1 1.474 0.030 . 1 . . . . A 113 VAL HB . 36058 1 68 . 1 1 9 9 VAL HG11 H 1 0.648 0.030 . 2 . . . . A 113 VAL HG11 . 36058 1 69 . 1 1 9 9 VAL HG12 H 1 0.648 0.030 . 2 . . . . A 113 VAL HG12 . 36058 1 70 . 1 1 9 9 VAL HG13 H 1 0.648 0.030 . 2 . . . . A 113 VAL HG13 . 36058 1 71 . 1 1 9 9 VAL HG21 H 1 0.598 0.030 . 2 . . . . A 113 VAL HG21 . 36058 1 72 . 1 1 9 9 VAL HG22 H 1 0.598 0.030 . 2 . . . . A 113 VAL HG22 . 36058 1 73 . 1 1 9 9 VAL HG23 H 1 0.598 0.030 . 2 . . . . A 113 VAL HG23 . 36058 1 74 . 1 1 9 9 VAL C C 13 173.251 0.300 . 1 . . . . A 113 VAL C . 36058 1 75 . 1 1 9 9 VAL CA C 13 59.154 0.300 . 1 . . . . A 113 VAL CA . 36058 1 76 . 1 1 9 9 VAL CB C 13 33.812 0.300 . 1 . . . . A 113 VAL CB . 36058 1 77 . 1 1 9 9 VAL CG1 C 13 20.996 0.300 . 2 . . . . A 113 VAL CG1 . 36058 1 78 . 1 1 9 9 VAL CG2 C 13 21.075 0.300 . 2 . . . . A 113 VAL CG2 . 36058 1 79 . 1 1 9 9 VAL N N 15 125.507 0.300 . 1 . . . . A 113 VAL N . 36058 1 80 . 1 1 10 10 GLY H H 1 8.763 0.030 . 1 . . . . A 114 GLY H . 36058 1 81 . 1 1 10 10 GLY HA2 H 1 3.792 0.030 . 2 . . . . A 114 GLY HA2 . 36058 1 82 . 1 1 10 10 GLY HA3 H 1 4.769 0.030 . 2 . . . . A 114 GLY HA3 . 36058 1 83 . 1 1 10 10 GLY C C 13 173.248 0.300 . 1 . . . . A 114 GLY C . 36058 1 84 . 1 1 10 10 GLY CA C 13 44.009 0.300 . 1 . . . . A 114 GLY CA . 36058 1 85 . 1 1 10 10 GLY N N 15 110.905 0.300 . 1 . . . . A 114 GLY N . 36058 1 86 . 1 1 11 11 GLY H H 1 8.069 0.030 . 1 . . . . A 115 GLY H . 36058 1 87 . 1 1 11 11 GLY HA2 H 1 3.803 0.030 . 2 . . . . A 115 GLY HA2 . 36058 1 88 . 1 1 11 11 GLY HA3 H 1 4.402 0.030 . 2 . . . . A 115 GLY HA3 . 36058 1 89 . 1 1 11 11 GLY C C 13 175.394 0.300 . 1 . . . . A 115 GLY C . 36058 1 90 . 1 1 11 11 GLY CA C 13 45.702 0.300 . 1 . . . . A 115 GLY CA . 36058 1 91 . 1 1 11 11 GLY N N 15 108.445 0.300 . 1 . . . . A 115 GLY N . 36058 1 92 . 1 1 12 12 LEU H H 1 7.966 0.030 . 1 . . . . A 116 LEU H . 36058 1 93 . 1 1 12 12 LEU HA H 1 4.120 0.030 . 1 . . . . A 116 LEU HA . 36058 1 94 . 1 1 12 12 LEU HB2 H 1 1.166 0.030 . 2 . . . . A 116 LEU HB2 . 36058 1 95 . 1 1 12 12 LEU HB3 H 1 1.050 0.030 . 2 . . . . A 116 LEU HB3 . 36058 1 96 . 1 1 12 12 LEU HG H 1 1.301 0.030 . 1 . . . . A 116 LEU HG . 36058 1 97 . 1 1 12 12 LEU HD11 H 1 0.623 0.030 . 2 . . . . A 116 LEU HD11 . 36058 1 98 . 1 1 12 12 LEU HD12 H 1 0.623 0.030 . 2 . . . . A 116 LEU HD12 . 36058 1 99 . 1 1 12 12 LEU HD13 H 1 0.623 0.030 . 2 . . . . A 116 LEU HD13 . 36058 1 100 . 1 1 12 12 LEU HD21 H 1 0.250 0.030 . 2 . . . . A 116 LEU HD21 . 36058 1 101 . 1 1 12 12 LEU HD22 H 1 0.250 0.030 . 2 . . . . A 116 LEU HD22 . 36058 1 102 . 1 1 12 12 LEU HD23 H 1 0.250 0.030 . 2 . . . . A 116 LEU HD23 . 36058 1 103 . 1 1 12 12 LEU C C 13 178.108 0.300 . 1 . . . . A 116 LEU C . 36058 1 104 . 1 1 12 12 LEU CA C 13 54.448 0.300 . 1 . . . . A 116 LEU CA . 36058 1 105 . 1 1 12 12 LEU CB C 13 43.272 0.300 . 1 . . . . A 116 LEU CB . 36058 1 106 . 1 1 12 12 LEU CG C 13 26.796 0.300 . 1 . . . . A 116 LEU CG . 36058 1 107 . 1 1 12 12 LEU CD1 C 13 24.643 0.300 . 2 . . . . A 116 LEU CD1 . 36058 1 108 . 1 1 12 12 LEU CD2 C 13 26.840 0.300 . 2 . . . . A 116 LEU CD2 . 36058 1 109 . 1 1 12 12 LEU N N 15 118.301 0.300 . 1 . . . . A 116 LEU N . 36058 1 110 . 1 1 13 13 SER H H 1 8.714 0.030 . 1 . . . . A 117 SER H . 36058 1 111 . 1 1 13 13 SER HA H 1 4.130 0.030 . 1 . . . . A 117 SER HA . 36058 1 112 . 1 1 13 13 SER HB2 H 1 3.892 0.030 . 2 . . . . A 117 SER HB2 . 36058 1 113 . 1 1 13 13 SER HB3 H 1 4.301 0.030 . 2 . . . . A 117 SER HB3 . 36058 1 114 . 1 1 13 13 SER C C 13 176.565 0.300 . 1 . . . . A 117 SER C . 36058 1 115 . 1 1 13 13 SER CA C 13 57.508 0.300 . 1 . . . . A 117 SER CA . 36058 1 116 . 1 1 13 13 SER CB C 13 64.502 0.300 . 1 . . . . A 117 SER CB . 36058 1 117 . 1 1 13 13 SER N N 15 117.947 0.300 . 1 . . . . A 117 SER N . 36058 1 118 . 1 1 14 14 VAL H H 1 8.691 0.030 . 1 . . . . A 118 VAL H . 36058 1 119 . 1 1 14 14 VAL HA H 1 3.526 0.030 . 1 . . . . A 118 VAL HA . 36058 1 120 . 1 1 14 14 VAL HB H 1 2.013 0.030 . 1 . . . . A 118 VAL HB . 36058 1 121 . 1 1 14 14 VAL HG11 H 1 0.888 0.030 . 2 . . . . A 118 VAL HG11 . 36058 1 122 . 1 1 14 14 VAL HG12 H 1 0.888 0.030 . 2 . . . . A 118 VAL HG12 . 36058 1 123 . 1 1 14 14 VAL HG13 H 1 0.888 0.030 . 2 . . . . A 118 VAL HG13 . 36058 1 124 . 1 1 14 14 VAL HG21 H 1 0.916 0.030 . 2 . . . . A 118 VAL HG21 . 36058 1 125 . 1 1 14 14 VAL HG22 H 1 0.916 0.030 . 2 . . . . A 118 VAL HG22 . 36058 1 126 . 1 1 14 14 VAL HG23 H 1 0.916 0.030 . 2 . . . . A 118 VAL HG23 . 36058 1 127 . 1 1 14 14 VAL C C 13 175.960 0.300 . 1 . . . . A 118 VAL C . 36058 1 128 . 1 1 14 14 VAL CA C 13 65.159 0.300 . 1 . . . . A 118 VAL CA . 36058 1 129 . 1 1 14 14 VAL CB C 13 31.714 0.300 . 1 . . . . A 118 VAL CB . 36058 1 130 . 1 1 14 14 VAL CG1 C 13 20.507 0.300 . 2 . . . . A 118 VAL CG1 . 36058 1 131 . 1 1 14 14 VAL CG2 C 13 20.876 0.300 . 2 . . . . A 118 VAL CG2 . 36058 1 132 . 1 1 14 14 VAL N N 15 121.485 0.300 . 1 . . . . A 118 VAL N . 36058 1 133 . 1 1 15 15 ASN H H 1 7.934 0.030 . 1 . . . . A 119 ASN H . 36058 1 134 . 1 1 15 15 ASN HA H 1 4.758 0.030 . 1 . . . . A 119 ASN HA . 36058 1 135 . 1 1 15 15 ASN HB2 H 1 2.858 0.030 . 2 . . . . A 119 ASN HB2 . 36058 1 136 . 1 1 15 15 ASN HB3 H 1 2.783 0.030 . 2 . . . . A 119 ASN HB3 . 36058 1 137 . 1 1 15 15 ASN HD21 H 1 7.651 0.030 . 2 . . . . A 119 ASN HD21 . 36058 1 138 . 1 1 15 15 ASN HD22 H 1 6.968 0.030 . 2 . . . . A 119 ASN HD22 . 36058 1 139 . 1 1 15 15 ASN C C 13 175.242 0.300 . 1 . . . . A 119 ASN C . 36058 1 140 . 1 1 15 15 ASN CA C 13 53.066 0.300 . 1 . . . . A 119 ASN CA . 36058 1 141 . 1 1 15 15 ASN CB C 13 38.050 0.300 . 1 . . . . A 119 ASN CB . 36058 1 142 . 1 1 15 15 ASN N N 15 114.659 0.300 . 1 . . . . A 119 ASN N . 36058 1 143 . 1 1 15 15 ASN ND2 N 15 113.450 0.300 . 1 . . . . A 119 ASN ND2 . 36058 1 144 . 1 1 16 16 THR H H 1 7.686 0.030 . 1 . . . . A 120 THR H . 36058 1 145 . 1 1 16 16 THR HA H 1 4.166 0.030 . 1 . . . . A 120 THR HA . 36058 1 146 . 1 1 16 16 THR HB H 1 4.180 0.030 . 1 . . . . A 120 THR HB . 36058 1 147 . 1 1 16 16 THR HG21 H 1 1.197 0.030 . 1 . . . . A 120 THR HG21 . 36058 1 148 . 1 1 16 16 THR HG22 H 1 1.197 0.030 . 1 . . . . A 120 THR HG22 . 36058 1 149 . 1 1 16 16 THR HG23 H 1 1.197 0.030 . 1 . . . . A 120 THR HG23 . 36058 1 150 . 1 1 16 16 THR C C 13 173.483 0.300 . 1 . . . . A 120 THR C . 36058 1 151 . 1 1 16 16 THR CA C 13 64.215 0.300 . 1 . . . . A 120 THR CA . 36058 1 152 . 1 1 16 16 THR CB C 13 69.275 0.300 . 1 . . . . A 120 THR CB . 36058 1 153 . 1 1 16 16 THR CG2 C 13 22.746 0.300 . 1 . . . . A 120 THR CG2 . 36058 1 154 . 1 1 16 16 THR N N 15 118.726 0.300 . 1 . . . . A 120 THR N . 36058 1 155 . 1 1 17 17 THR H H 1 8.713 0.030 . 1 . . . . A 121 THR H . 36058 1 156 . 1 1 17 17 THR HA H 1 4.753 0.030 . 1 . . . . A 121 THR HA . 36058 1 157 . 1 1 17 17 THR HB H 1 4.753 0.030 . 1 . . . . A 121 THR HB . 36058 1 158 . 1 1 17 17 THR HG21 H 1 1.308 0.030 . 1 . . . . A 121 THR HG21 . 36058 1 159 . 1 1 17 17 THR HG22 H 1 1.308 0.030 . 1 . . . . A 121 THR HG22 . 36058 1 160 . 1 1 17 17 THR HG23 H 1 1.308 0.030 . 1 . . . . A 121 THR HG23 . 36058 1 161 . 1 1 17 17 THR C C 13 176.055 0.300 . 1 . . . . A 121 THR C . 36058 1 162 . 1 1 17 17 THR CA C 13 60.022 0.300 . 1 . . . . A 121 THR CA . 36058 1 163 . 1 1 17 17 THR CB C 13 72.648 0.300 . 1 . . . . A 121 THR CB . 36058 1 164 . 1 1 17 17 THR CG2 C 13 21.595 0.300 . 1 . . . . A 121 THR CG2 . 36058 1 165 . 1 1 17 17 THR N N 15 117.673 0.300 . 1 . . . . A 121 THR N . 36058 1 166 . 1 1 18 18 VAL H H 1 9.179 0.030 . 1 . . . . A 122 VAL H . 36058 1 167 . 1 1 18 18 VAL HA H 1 3.487 0.030 . 1 . . . . A 122 VAL HA . 36058 1 168 . 1 1 18 18 VAL HB H 1 2.018 0.030 . 1 . . . . A 122 VAL HB . 36058 1 169 . 1 1 18 18 VAL HG11 H 1 0.923 0.030 . 2 . . . . A 122 VAL HG11 . 36058 1 170 . 1 1 18 18 VAL HG12 H 1 0.923 0.030 . 2 . . . . A 122 VAL HG12 . 36058 1 171 . 1 1 18 18 VAL HG13 H 1 0.923 0.030 . 2 . . . . A 122 VAL HG13 . 36058 1 172 . 1 1 18 18 VAL HG21 H 1 0.954 0.030 . 2 . . . . A 122 VAL HG21 . 36058 1 173 . 1 1 18 18 VAL HG22 H 1 0.954 0.030 . 2 . . . . A 122 VAL HG22 . 36058 1 174 . 1 1 18 18 VAL HG23 H 1 0.954 0.030 . 2 . . . . A 122 VAL HG23 . 36058 1 175 . 1 1 18 18 VAL C C 13 176.724 0.300 . 1 . . . . A 122 VAL C . 36058 1 176 . 1 1 18 18 VAL CA C 13 65.778 0.300 . 1 . . . . A 122 VAL CA . 36058 1 177 . 1 1 18 18 VAL CB C 13 31.524 0.300 . 1 . . . . A 122 VAL CB . 36058 1 178 . 1 1 18 18 VAL CG1 C 13 22.954 0.300 . 2 . . . . A 122 VAL CG1 . 36058 1 179 . 1 1 18 18 VAL CG2 C 13 20.391 0.300 . 2 . . . . A 122 VAL CG2 . 36058 1 180 . 1 1 18 18 VAL N N 15 120.897 0.300 . 1 . . . . A 122 VAL N . 36058 1 181 . 1 1 19 19 GLU H H 1 8.164 0.030 . 1 . . . . A 123 GLU H . 36058 1 182 . 1 1 19 19 GLU HA H 1 3.823 0.030 . 1 . . . . A 123 GLU HA . 36058 1 183 . 1 1 19 19 GLU HB2 H 1 1.999 0.030 . 2 . . . . A 123 GLU HB2 . 36058 1 184 . 1 1 19 19 GLU HB3 H 1 1.800 0.030 . 2 . . . . A 123 GLU HB3 . 36058 1 185 . 1 1 19 19 GLU HG2 H 1 2.194 0.030 . 2 . . . . A 123 GLU HG2 . 36058 1 186 . 1 1 19 19 GLU HG3 H 1 2.376 0.030 . 2 . . . . A 123 GLU HG3 . 36058 1 187 . 1 1 19 19 GLU C C 13 178.510 0.300 . 1 . . . . A 123 GLU C . 36058 1 188 . 1 1 19 19 GLU CA C 13 60.300 0.300 . 1 . . . . A 123 GLU CA . 36058 1 189 . 1 1 19 19 GLU CB C 13 28.464 0.300 . 1 . . . . A 123 GLU CB . 36058 1 190 . 1 1 19 19 GLU CG C 13 37.084 0.300 . 1 . . . . A 123 GLU CG . 36058 1 191 . 1 1 19 19 GLU N N 15 121.166 0.300 . 1 . . . . A 123 GLU N . 36058 1 192 . 1 1 20 20 ASP H H 1 7.704 0.030 . 1 . . . . A 124 ASP H . 36058 1 193 . 1 1 20 20 ASP HA H 1 4.342 0.030 . 1 . . . . A 124 ASP HA . 36058 1 194 . 1 1 20 20 ASP HB2 H 1 3.158 0.030 . 2 . . . . A 124 ASP HB2 . 36058 1 195 . 1 1 20 20 ASP HB3 H 1 2.487 0.030 . 2 . . . . A 124 ASP HB3 . 36058 1 196 . 1 1 20 20 ASP C C 13 179.627 0.300 . 1 . . . . A 124 ASP C . 36058 1 197 . 1 1 20 20 ASP CA C 13 57.374 0.300 . 1 . . . . A 124 ASP CA . 36058 1 198 . 1 1 20 20 ASP CB C 13 41.619 0.300 . 1 . . . . A 124 ASP CB . 36058 1 199 . 1 1 20 20 ASP N N 15 119.881 0.300 . 1 . . . . A 124 ASP N . 36058 1 200 . 1 1 21 21 VAL H H 1 7.475 0.030 . 1 . . . . A 125 VAL H . 36058 1 201 . 1 1 21 21 VAL HA H 1 3.497 0.030 . 1 . . . . A 125 VAL HA . 36058 1 202 . 1 1 21 21 VAL HB H 1 2.174 0.030 . 1 . . . . A 125 VAL HB . 36058 1 203 . 1 1 21 21 VAL HG11 H 1 0.866 0.030 . 2 . . . . A 125 VAL HG11 . 36058 1 204 . 1 1 21 21 VAL HG12 H 1 0.866 0.030 . 2 . . . . A 125 VAL HG12 . 36058 1 205 . 1 1 21 21 VAL HG13 H 1 0.866 0.030 . 2 . . . . A 125 VAL HG13 . 36058 1 206 . 1 1 21 21 VAL HG21 H 1 0.872 0.030 . 2 . . . . A 125 VAL HG21 . 36058 1 207 . 1 1 21 21 VAL HG22 H 1 0.872 0.030 . 2 . . . . A 125 VAL HG22 . 36058 1 208 . 1 1 21 21 VAL HG23 H 1 0.872 0.030 . 2 . . . . A 125 VAL HG23 . 36058 1 209 . 1 1 21 21 VAL C C 13 176.954 0.300 . 1 . . . . A 125 VAL C . 36058 1 210 . 1 1 21 21 VAL CA C 13 67.005 0.300 . 1 . . . . A 125 VAL CA . 36058 1 211 . 1 1 21 21 VAL CB C 13 31.736 0.300 . 1 . . . . A 125 VAL CB . 36058 1 212 . 1 1 21 21 VAL CG1 C 13 24.160 0.300 . 2 . . . . A 125 VAL CG1 . 36058 1 213 . 1 1 21 21 VAL CG2 C 13 21.855 0.300 . 2 . . . . A 125 VAL CG2 . 36058 1 214 . 1 1 21 21 VAL N N 15 119.838 0.300 . 1 . . . . A 125 VAL N . 36058 1 215 . 1 1 22 22 LYS H H 1 8.577 0.030 . 1 . . . . A 126 LYS H . 36058 1 216 . 1 1 22 22 LYS HA H 1 3.702 0.030 . 1 . . . . A 126 LYS HA . 36058 1 217 . 1 1 22 22 LYS HB2 H 1 1.829 0.030 . 2 . . . . A 126 LYS HB2 . 36058 1 218 . 1 1 22 22 LYS HB3 H 1 1.623 0.030 . 2 . . . . A 126 LYS HB3 . 36058 1 219 . 1 1 22 22 LYS HG2 H 1 1.227 0.030 . 2 . . . . A 126 LYS HG2 . 36058 1 220 . 1 1 22 22 LYS HG3 H 1 1.257 0.030 . 2 . . . . A 126 LYS HG3 . 36058 1 221 . 1 1 22 22 LYS HD2 H 1 1.598 0.030 . 1 . . . . A 126 LYS HD2 . 36058 1 222 . 1 1 22 22 LYS HD3 H 1 1.598 0.030 . 1 . . . . A 126 LYS HD3 . 36058 1 223 . 1 1 22 22 LYS HE2 H 1 2.822 0.030 . 1 . . . . A 126 LYS HE2 . 36058 1 224 . 1 1 22 22 LYS HE3 H 1 2.822 0.030 . 1 . . . . A 126 LYS HE3 . 36058 1 225 . 1 1 22 22 LYS C C 13 177.278 0.300 . 1 . . . . A 126 LYS C . 36058 1 226 . 1 1 22 22 LYS CA C 13 61.459 0.300 . 1 . . . . A 126 LYS CA . 36058 1 227 . 1 1 22 22 LYS CB C 13 32.777 0.300 . 1 . . . . A 126 LYS CB . 36058 1 228 . 1 1 22 22 LYS CG C 13 25.833 0.300 . 1 . . . . A 126 LYS CG . 36058 1 229 . 1 1 22 22 LYS CD C 13 29.735 0.300 . 1 . . . . A 126 LYS CD . 36058 1 230 . 1 1 22 22 LYS CE C 13 41.985 0.300 . 1 . . . . A 126 LYS CE . 36058 1 231 . 1 1 22 22 LYS N N 15 120.170 0.300 . 1 . . . . A 126 LYS N . 36058 1 232 . 1 1 23 23 HIS H H 1 8.536 0.030 . 1 . . . . A 127 HIS H . 36058 1 233 . 1 1 23 23 HIS HA H 1 4.506 0.030 . 1 . . . . A 127 HIS HA . 36058 1 234 . 1 1 23 23 HIS HB2 H 1 3.313 0.030 . 2 . . . . A 127 HIS HB2 . 36058 1 235 . 1 1 23 23 HIS HB3 H 1 3.240 0.030 . 2 . . . . A 127 HIS HB3 . 36058 1 236 . 1 1 23 23 HIS HD2 H 1 7.332 0.030 . 1 . . . . A 127 HIS HD2 . 36058 1 237 . 1 1 23 23 HIS C C 13 177.216 0.300 . 1 . . . . A 127 HIS C . 36058 1 238 . 1 1 23 23 HIS CA C 13 58.126 0.300 . 1 . . . . A 127 HIS CA . 36058 1 239 . 1 1 23 23 HIS CB C 13 28.464 0.300 . 1 . . . . A 127 HIS CB . 36058 1 240 . 1 1 23 23 HIS CD2 C 13 120.100 0.300 . 1 . . . . A 127 HIS CD2 . 36058 1 241 . 1 1 23 23 HIS N N 15 113.458 0.300 . 1 . . . . A 127 HIS N . 36058 1 242 . 1 1 24 24 TYR H H 1 7.823 0.030 . 1 . . . . A 128 TYR H . 36058 1 243 . 1 1 24 24 TYR HA H 1 4.069 0.030 . 1 . . . . A 128 TYR HA . 36058 1 244 . 1 1 24 24 TYR HB2 H 1 2.660 0.030 . 2 . . . . A 128 TYR HB2 . 36058 1 245 . 1 1 24 24 TYR HB3 H 1 3.049 0.030 . 2 . . . . A 128 TYR HB3 . 36058 1 246 . 1 1 24 24 TYR C C 13 178.127 0.300 . 1 . . . . A 128 TYR C . 36058 1 247 . 1 1 24 24 TYR CA C 13 62.145 0.300 . 1 . . . . A 128 TYR CA . 36058 1 248 . 1 1 24 24 TYR CB C 13 38.091 0.300 . 1 . . . . A 128 TYR CB . 36058 1 249 . 1 1 24 24 TYR N N 15 117.840 0.300 . 1 . . . . A 128 TYR N . 36058 1 250 . 1 1 25 25 PHE H H 1 8.100 0.030 . 1 . . . . A 129 PHE H . 36058 1 251 . 1 1 25 25 PHE HA H 1 4.414 0.030 . 1 . . . . A 129 PHE HA . 36058 1 252 . 1 1 25 25 PHE HB2 H 1 2.775 0.030 . 2 . . . . A 129 PHE HB2 . 36058 1 253 . 1 1 25 25 PHE HB3 H 1 3.550 0.030 . 2 . . . . A 129 PHE HB3 . 36058 1 254 . 1 1 25 25 PHE HD1 H 1 7.513 0.030 . 1 . . . . A 129 PHE HD1 . 36058 1 255 . 1 1 25 25 PHE HD2 H 1 7.513 0.030 . 1 . . . . A 129 PHE HD2 . 36058 1 256 . 1 1 25 25 PHE HE1 H 1 6.686 0.030 . 1 . . . . A 129 PHE HE1 . 36058 1 257 . 1 1 25 25 PHE HE2 H 1 6.686 0.030 . 1 . . . . A 129 PHE HE2 . 36058 1 258 . 1 1 25 25 PHE C C 13 177.521 0.300 . 1 . . . . A 129 PHE C . 36058 1 259 . 1 1 25 25 PHE CA C 13 63.606 0.300 . 1 . . . . A 129 PHE CA . 36058 1 260 . 1 1 25 25 PHE CB C 13 38.769 0.300 . 1 . . . . A 129 PHE CB . 36058 1 261 . 1 1 25 25 PHE CD1 C 13 132.024 0.300 . 1 . . . . A 129 PHE CD1 . 36058 1 262 . 1 1 25 25 PHE CD2 C 13 132.024 0.300 . 1 . . . . A 129 PHE CD2 . 36058 1 263 . 1 1 25 25 PHE CE1 C 13 131.070 0.300 . 1 . . . . A 129 PHE CE1 . 36058 1 264 . 1 1 25 25 PHE CE2 C 13 131.070 0.300 . 1 . . . . A 129 PHE CE2 . 36058 1 265 . 1 1 25 25 PHE N N 15 115.480 0.300 . 1 . . . . A 129 PHE N . 36058 1 266 . 1 1 26 26 GLU H H 1 8.415 0.030 . 1 . . . . A 130 GLU H . 36058 1 267 . 1 1 26 26 GLU HA H 1 5.069 0.030 . 1 . . . . A 130 GLU HA . 36058 1 268 . 1 1 26 26 GLU HB2 H 1 2.220 0.030 . 2 . . . . A 130 GLU HB2 . 36058 1 269 . 1 1 26 26 GLU HB3 H 1 2.003 0.030 . 2 . . . . A 130 GLU HB3 . 36058 1 270 . 1 1 26 26 GLU HG2 H 1 2.463 0.030 . 2 . . . . A 130 GLU HG2 . 36058 1 271 . 1 1 26 26 GLU HG3 H 1 2.584 0.030 . 2 . . . . A 130 GLU HG3 . 36058 1 272 . 1 1 26 26 GLU C C 13 177.923 0.300 . 1 . . . . A 130 GLU C . 36058 1 273 . 1 1 26 26 GLU CA C 13 57.715 0.300 . 1 . . . . A 130 GLU CA . 36058 1 274 . 1 1 26 26 GLU CB C 13 29.166 0.300 . 1 . . . . A 130 GLU CB . 36058 1 275 . 1 1 26 26 GLU CG C 13 37.616 0.300 . 1 . . . . A 130 GLU CG . 36058 1 276 . 1 1 26 26 GLU N N 15 120.266 0.300 . 1 . . . . A 130 GLU N . 36058 1 277 . 1 1 27 27 GLN H H 1 7.119 0.030 . 1 . . . . A 131 GLN H . 36058 1 278 . 1 1 27 27 GLN HA H 1 3.996 0.030 . 1 . . . . A 131 GLN HA . 36058 1 279 . 1 1 27 27 GLN HB2 H 1 1.600 0.030 . 1 . . . . A 131 GLN HB2 . 36058 1 280 . 1 1 27 27 GLN HB3 H 1 1.600 0.030 . 1 . . . . A 131 GLN HB3 . 36058 1 281 . 1 1 27 27 GLN HG2 H 1 1.322 0.030 . 2 . . . . A 131 GLN HG2 . 36058 1 282 . 1 1 27 27 GLN HG3 H 1 1.826 0.030 . 2 . . . . A 131 GLN HG3 . 36058 1 283 . 1 1 27 27 GLN HE21 H 1 6.611 0.030 . 2 . . . . A 131 GLN HE21 . 36058 1 284 . 1 1 27 27 GLN HE22 H 1 6.428 0.030 . 2 . . . . A 131 GLN HE22 . 36058 1 285 . 1 1 27 27 GLN C C 13 176.790 0.300 . 1 . . . . A 131 GLN C . 36058 1 286 . 1 1 27 27 GLN CA C 13 57.756 0.300 . 1 . . . . A 131 GLN CA . 36058 1 287 . 1 1 27 27 GLN CB C 13 29.122 0.300 . 1 . . . . A 131 GLN CB . 36058 1 288 . 1 1 27 27 GLN CG C 13 33.803 0.300 . 1 . . . . A 131 GLN CG . 36058 1 289 . 1 1 27 27 GLN N N 15 115.832 0.300 . 1 . . . . A 131 GLN N . 36058 1 290 . 1 1 27 27 GLN NE2 N 15 111.979 0.300 . 1 . . . . A 131 GLN NE2 . 36058 1 291 . 1 1 28 28 PHE H H 1 7.957 0.030 . 1 . . . . A 132 PHE H . 36058 1 292 . 1 1 28 28 PHE HA H 1 4.372 0.030 . 1 . . . . A 132 PHE HA . 36058 1 293 . 1 1 28 28 PHE HB2 H 1 2.966 0.030 . 1 . . . . A 132 PHE HB2 . 36058 1 294 . 1 1 28 28 PHE HB3 H 1 2.966 0.030 . 1 . . . . A 132 PHE HB3 . 36058 1 295 . 1 1 28 28 PHE HD1 H 1 7.367 0.030 . 1 . . . . A 132 PHE HD1 . 36058 1 296 . 1 1 28 28 PHE HD2 H 1 7.367 0.030 . 1 . . . . A 132 PHE HD2 . 36058 1 297 . 1 1 28 28 PHE HE1 H 1 7.186 0.030 . 1 . . . . A 132 PHE HE1 . 36058 1 298 . 1 1 28 28 PHE HE2 H 1 7.186 0.030 . 1 . . . . A 132 PHE HE2 . 36058 1 299 . 1 1 28 28 PHE C C 13 175.392 0.300 . 1 . . . . A 132 PHE C . 36058 1 300 . 1 1 28 28 PHE CA C 13 59.319 0.300 . 1 . . . . A 132 PHE CA . 36058 1 301 . 1 1 28 28 PHE CB C 13 39.983 0.300 . 1 . . . . A 132 PHE CB . 36058 1 302 . 1 1 28 28 PHE CD1 C 13 131.722 0.300 . 1 . . . . A 132 PHE CD1 . 36058 1 303 . 1 1 28 28 PHE CD2 C 13 131.722 0.300 . 1 . . . . A 132 PHE CD2 . 36058 1 304 . 1 1 28 28 PHE CE1 C 13 131.696 0.300 . 1 . . . . A 132 PHE CE1 . 36058 1 305 . 1 1 28 28 PHE CE2 C 13 131.696 0.300 . 1 . . . . A 132 PHE CE2 . 36058 1 306 . 1 1 28 28 PHE N N 15 116.654 0.300 . 1 . . . . A 132 PHE N . 36058 1 307 . 1 1 29 29 GLY H H 1 7.571 0.030 . 1 . . . . A 133 GLY H . 36058 1 308 . 1 1 29 29 GLY HA2 H 1 3.974 0.030 . 2 . . . . A 133 GLY HA2 . 36058 1 309 . 1 1 29 29 GLY HA3 H 1 4.081 0.030 . 2 . . . . A 133 GLY HA3 . 36058 1 310 . 1 1 29 29 GLY C C 13 169.958 0.300 . 1 . . . . A 133 GLY C . 36058 1 311 . 1 1 29 29 GLY CA C 13 44.811 0.300 . 1 . . . . A 133 GLY CA . 36058 1 312 . 1 1 29 29 GLY N N 15 105.444 0.300 . 1 . . . . A 133 GLY N . 36058 1 313 . 1 1 30 30 LYS H H 1 7.971 0.030 . 1 . . . . A 134 LYS H . 36058 1 314 . 1 1 30 30 LYS HA H 1 4.201 0.030 . 1 . . . . A 134 LYS HA . 36058 1 315 . 1 1 30 30 LYS HB2 H 1 1.738 0.030 . 1 . . . . A 134 LYS HB2 . 36058 1 316 . 1 1 30 30 LYS HB3 H 1 1.738 0.030 . 1 . . . . A 134 LYS HB3 . 36058 1 317 . 1 1 30 30 LYS HG2 H 1 1.315 0.030 . 2 . . . . A 134 LYS HG2 . 36058 1 318 . 1 1 30 30 LYS HG3 H 1 1.408 0.030 . 2 . . . . A 134 LYS HG3 . 36058 1 319 . 1 1 30 30 LYS HE2 H 1 2.423 0.030 . 2 . . . . A 134 LYS HE2 . 36058 1 320 . 1 1 30 30 LYS C C 13 176.822 0.300 . 1 . . . . A 134 LYS C . 36058 1 321 . 1 1 30 30 LYS CA C 13 57.974 0.300 . 1 . . . . A 134 LYS CA . 36058 1 322 . 1 1 30 30 LYS CB C 13 32.864 0.300 . 1 . . . . A 134 LYS CB . 36058 1 323 . 1 1 30 30 LYS CG C 13 24.814 0.300 . 1 . . . . A 134 LYS CG . 36058 1 324 . 1 1 30 30 LYS CE C 13 42.296 0.300 . 1 . . . . A 134 LYS CE . 36058 1 325 . 1 1 30 30 LYS N N 15 117.172 0.300 . 1 . . . . A 134 LYS N . 36058 1 326 . 1 1 31 31 VAL H H 1 8.847 0.030 . 1 . . . . A 135 VAL H . 36058 1 327 . 1 1 31 31 VAL HA H 1 3.941 0.030 . 1 . . . . A 135 VAL HA . 36058 1 328 . 1 1 31 31 VAL HB H 1 1.941 0.030 . 1 . . . . A 135 VAL HB . 36058 1 329 . 1 1 31 31 VAL HG11 H 1 0.606 0.030 . 2 . . . . A 135 VAL HG11 . 36058 1 330 . 1 1 31 31 VAL HG12 H 1 0.606 0.030 . 2 . . . . A 135 VAL HG12 . 36058 1 331 . 1 1 31 31 VAL HG13 H 1 0.606 0.030 . 2 . . . . A 135 VAL HG13 . 36058 1 332 . 1 1 31 31 VAL HG21 H 1 0.823 0.030 . 2 . . . . A 135 VAL HG21 . 36058 1 333 . 1 1 31 31 VAL HG22 H 1 0.823 0.030 . 2 . . . . A 135 VAL HG22 . 36058 1 334 . 1 1 31 31 VAL HG23 H 1 0.823 0.030 . 2 . . . . A 135 VAL HG23 . 36058 1 335 . 1 1 31 31 VAL C C 13 175.440 0.300 . 1 . . . . A 135 VAL C . 36058 1 336 . 1 1 31 31 VAL CA C 13 61.993 0.300 . 1 . . . . A 135 VAL CA . 36058 1 337 . 1 1 31 31 VAL CB C 13 33.359 0.300 . 1 . . . . A 135 VAL CB . 36058 1 338 . 1 1 31 31 VAL CG1 C 13 22.563 0.300 . 2 . . . . A 135 VAL CG1 . 36058 1 339 . 1 1 31 31 VAL CG2 C 13 22.042 0.300 . 2 . . . . A 135 VAL CG2 . 36058 1 340 . 1 1 31 31 VAL N N 15 128.829 0.300 . 1 . . . . A 135 VAL N . 36058 1 341 . 1 1 32 32 ASP H H 1 8.641 0.030 . 1 . . . . A 136 ASP H . 36058 1 342 . 1 1 32 32 ASP HA H 1 4.607 0.030 . 1 . . . . A 136 ASP HA . 36058 1 343 . 1 1 32 32 ASP HB2 H 1 2.449 0.030 . 2 . . . . A 136 ASP HB2 . 36058 1 344 . 1 1 32 32 ASP HB3 H 1 2.008 0.030 . 2 . . . . A 136 ASP HB3 . 36058 1 345 . 1 1 32 32 ASP C C 13 176.012 0.300 . 1 . . . . A 136 ASP C . 36058 1 346 . 1 1 32 32 ASP CA C 13 55.699 0.300 . 1 . . . . A 136 ASP CA . 36058 1 347 . 1 1 32 32 ASP CB C 13 41.899 0.300 . 1 . . . . A 136 ASP CB . 36058 1 348 . 1 1 32 32 ASP N N 15 129.127 0.300 . 1 . . . . A 136 ASP N . 36058 1 349 . 1 1 33 33 ASP H H 1 7.625 0.030 . 1 . . . . A 137 ASP H . 36058 1 350 . 1 1 33 33 ASP HA H 1 4.667 0.030 . 1 . . . . A 137 ASP HA . 36058 1 351 . 1 1 33 33 ASP HB2 H 1 2.285 0.030 . 2 . . . . A 137 ASP HB2 . 36058 1 352 . 1 1 33 33 ASP HB3 H 1 2.619 0.030 . 2 . . . . A 137 ASP HB3 . 36058 1 353 . 1 1 33 33 ASP C C 13 173.139 0.300 . 1 . . . . A 137 ASP C . 36058 1 354 . 1 1 33 33 ASP CA C 13 53.930 0.300 . 1 . . . . A 137 ASP CA . 36058 1 355 . 1 1 33 33 ASP CB C 13 44.285 0.300 . 1 . . . . A 137 ASP CB . 36058 1 356 . 1 1 33 33 ASP N N 15 115.546 0.300 . 1 . . . . A 137 ASP N . 36058 1 357 . 1 1 34 34 ALA H H 1 8.096 0.030 . 1 . . . . A 138 ALA H . 36058 1 358 . 1 1 34 34 ALA HA H 1 4.864 0.030 . 1 . . . . A 138 ALA HA . 36058 1 359 . 1 1 34 34 ALA HB1 H 1 1.098 0.030 . 1 . . . . A 138 ALA HB1 . 36058 1 360 . 1 1 34 34 ALA HB2 H 1 1.098 0.030 . 1 . . . . A 138 ALA HB2 . 36058 1 361 . 1 1 34 34 ALA HB3 H 1 1.098 0.030 . 1 . . . . A 138 ALA HB3 . 36058 1 362 . 1 1 34 34 ALA C C 13 174.154 0.300 . 1 . . . . A 138 ALA C . 36058 1 363 . 1 1 34 34 ALA CA C 13 51.831 0.300 . 1 . . . . A 138 ALA CA . 36058 1 364 . 1 1 34 34 ALA CB C 13 21.881 0.300 . 1 . . . . A 138 ALA CB . 36058 1 365 . 1 1 34 34 ALA N N 15 122.296 0.300 . 1 . . . . A 138 ALA N . 36058 1 366 . 1 1 35 35 MET H H 1 8.581 0.030 . 1 . . . . A 139 MET H . 36058 1 367 . 1 1 35 35 MET HA H 1 4.667 0.030 . 1 . . . . A 139 MET HA . 36058 1 368 . 1 1 35 35 MET HB2 H 1 2.049 0.030 . 1 . . . . A 139 MET HB2 . 36058 1 369 . 1 1 35 35 MET HB3 H 1 2.049 0.030 . 1 . . . . A 139 MET HB3 . 36058 1 370 . 1 1 35 35 MET HG2 H 1 2.525 0.030 . 1 . . . . A 139 MET HG2 . 36058 1 371 . 1 1 35 35 MET HG3 H 1 2.525 0.030 . 1 . . . . A 139 MET HG3 . 36058 1 372 . 1 1 35 35 MET HE1 H 1 2.098 0.030 . 1 . . . . A 139 MET HE1 . 36058 1 373 . 1 1 35 35 MET HE2 H 1 2.098 0.030 . 1 . . . . A 139 MET HE2 . 36058 1 374 . 1 1 35 35 MET HE3 H 1 2.098 0.030 . 1 . . . . A 139 MET HE3 . 36058 1 375 . 1 1 35 35 MET C C 13 173.594 0.300 . 1 . . . . A 139 MET C . 36058 1 376 . 1 1 35 35 MET CA C 13 54.547 0.300 . 1 . . . . A 139 MET CA . 36058 1 377 . 1 1 35 35 MET CB C 13 35.124 0.300 . 1 . . . . A 139 MET CB . 36058 1 378 . 1 1 35 35 MET CG C 13 30.880 0.300 . 1 . . . . A 139 MET CG . 36058 1 379 . 1 1 35 35 MET CE C 13 17.444 0.300 . 1 . . . . A 139 MET CE . 36058 1 380 . 1 1 35 35 MET N N 15 118.201 0.300 . 1 . . . . A 139 MET N . 36058 1 381 . 1 1 36 36 LEU H H 1 8.603 0.030 . 1 . . . . A 140 LEU H . 36058 1 382 . 1 1 36 36 LEU HA H 1 4.600 0.030 . 1 . . . . A 140 LEU HA . 36058 1 383 . 1 1 36 36 LEU HB2 H 1 1.465 0.030 . 2 . . . . A 140 LEU HB2 . 36058 1 384 . 1 1 36 36 LEU HB3 H 1 0.806 0.030 . 2 . . . . A 140 LEU HB3 . 36058 1 385 . 1 1 36 36 LEU HG H 1 1.288 0.030 . 1 . . . . A 140 LEU HG . 36058 1 386 . 1 1 36 36 LEU HD11 H 1 0.323 0.030 . 2 . . . . A 140 LEU HD11 . 36058 1 387 . 1 1 36 36 LEU HD12 H 1 0.323 0.030 . 2 . . . . A 140 LEU HD12 . 36058 1 388 . 1 1 36 36 LEU HD13 H 1 0.323 0.030 . 2 . . . . A 140 LEU HD13 . 36058 1 389 . 1 1 36 36 LEU HD21 H 1 0.258 0.030 . 2 . . . . A 140 LEU HD21 . 36058 1 390 . 1 1 36 36 LEU HD22 H 1 0.258 0.030 . 2 . . . . A 140 LEU HD22 . 36058 1 391 . 1 1 36 36 LEU HD23 H 1 0.258 0.030 . 2 . . . . A 140 LEU HD23 . 36058 1 392 . 1 1 36 36 LEU C C 13 175.645 0.300 . 1 . . . . A 140 LEU C . 36058 1 393 . 1 1 36 36 LEU CA C 13 53.271 0.300 . 1 . . . . A 140 LEU CA . 36058 1 394 . 1 1 36 36 LEU CB C 13 42.997 0.300 . 1 . . . . A 140 LEU CB . 36058 1 395 . 1 1 36 36 LEU CG C 13 27.195 0.300 . 1 . . . . A 140 LEU CG . 36058 1 396 . 1 1 36 36 LEU CD1 C 13 24.825 0.300 . 2 . . . . A 140 LEU CD1 . 36058 1 397 . 1 1 36 36 LEU CD2 C 13 22.821 0.300 . 2 . . . . A 140 LEU CD2 . 36058 1 398 . 1 1 36 36 LEU N N 15 121.476 0.300 . 1 . . . . A 140 LEU N . 36058 1 399 . 1 1 37 37 MET H H 1 7.772 0.030 . 1 . . . . A 141 MET H . 36058 1 400 . 1 1 37 37 MET HA H 1 4.695 0.030 . 1 . . . . A 141 MET HA . 36058 1 401 . 1 1 37 37 MET HB2 H 1 1.553 0.030 . 2 . . . . A 141 MET HB2 . 36058 1 402 . 1 1 37 37 MET HB3 H 1 1.055 0.030 . 2 . . . . A 141 MET HB3 . 36058 1 403 . 1 1 37 37 MET HG2 H 1 2.488 0.030 . 2 . . . . A 141 MET HG2 . 36058 1 404 . 1 1 37 37 MET HG3 H 1 2.303 0.030 . 2 . . . . A 141 MET HG3 . 36058 1 405 . 1 1 37 37 MET HE1 H 1 2.213 0.030 . 1 . . . . A 141 MET HE1 . 36058 1 406 . 1 1 37 37 MET HE2 H 1 2.213 0.030 . 1 . . . . A 141 MET HE2 . 36058 1 407 . 1 1 37 37 MET HE3 H 1 2.213 0.030 . 1 . . . . A 141 MET HE3 . 36058 1 408 . 1 1 37 37 MET C C 13 175.268 0.300 . 1 . . . . A 141 MET C . 36058 1 409 . 1 1 37 37 MET CA C 13 54.134 0.300 . 1 . . . . A 141 MET CA . 36058 1 410 . 1 1 37 37 MET CB C 13 31.235 0.300 . 1 . . . . A 141 MET CB . 36058 1 411 . 1 1 37 37 MET CG C 13 33.010 0.300 . 1 . . . . A 141 MET CG . 36058 1 412 . 1 1 37 37 MET CE C 13 17.366 0.300 . 1 . . . . A 141 MET CE . 36058 1 413 . 1 1 37 37 MET N N 15 119.683 0.300 . 1 . . . . A 141 MET N . 36058 1 414 . 1 1 38 38 PHE H H 1 8.899 0.030 . 1 . . . . A 142 PHE H . 36058 1 415 . 1 1 38 38 PHE HA H 1 4.639 0.030 . 1 . . . . A 142 PHE HA . 36058 1 416 . 1 1 38 38 PHE HB2 H 1 2.940 0.030 . 2 . . . . A 142 PHE HB2 . 36058 1 417 . 1 1 38 38 PHE HB3 H 1 2.789 0.030 . 2 . . . . A 142 PHE HB3 . 36058 1 418 . 1 1 38 38 PHE HD1 H 1 6.986 0.030 . 1 . . . . A 142 PHE HD1 . 36058 1 419 . 1 1 38 38 PHE HD2 H 1 6.986 0.030 . 1 . . . . A 142 PHE HD2 . 36058 1 420 . 1 1 38 38 PHE HE1 H 1 7.294 0.030 . 1 . . . . A 142 PHE HE1 . 36058 1 421 . 1 1 38 38 PHE HE2 H 1 7.294 0.030 . 1 . . . . A 142 PHE HE2 . 36058 1 422 . 1 1 38 38 PHE HZ H 1 7.078 0.030 . 1 . . . . A 142 PHE HZ . 36058 1 423 . 1 1 38 38 PHE C C 13 175.096 0.300 . 1 . . . . A 142 PHE C . 36058 1 424 . 1 1 38 38 PHE CA C 13 58.455 0.300 . 1 . . . . A 142 PHE CA . 36058 1 425 . 1 1 38 38 PHE CB C 13 42.200 0.300 . 1 . . . . A 142 PHE CB . 36058 1 426 . 1 1 38 38 PHE CD1 C 13 131.534 0.300 . 1 . . . . A 142 PHE CD1 . 36058 1 427 . 1 1 38 38 PHE CD2 C 13 131.534 0.300 . 1 . . . . A 142 PHE CD2 . 36058 1 428 . 1 1 38 38 PHE CE1 C 13 131.526 0.300 . 1 . . . . A 142 PHE CE1 . 36058 1 429 . 1 1 38 38 PHE CE2 C 13 131.526 0.300 . 1 . . . . A 142 PHE CE2 . 36058 1 430 . 1 1 38 38 PHE CZ C 13 129.395 0.300 . 1 . . . . A 142 PHE CZ . 36058 1 431 . 1 1 38 38 PHE N N 15 124.343 0.300 . 1 . . . . A 142 PHE N . 36058 1 432 . 1 1 39 39 ASP H H 1 8.254 0.030 . 1 . . . . A 143 ASP H . 36058 1 433 . 1 1 39 39 ASP HA H 1 4.794 0.030 . 1 . . . . A 143 ASP HA . 36058 1 434 . 1 1 39 39 ASP HB2 H 1 2.333 0.030 . 2 . . . . A 143 ASP HB2 . 36058 1 435 . 1 1 39 39 ASP HB3 H 1 3.178 0.030 . 2 . . . . A 143 ASP HB3 . 36058 1 436 . 1 1 39 39 ASP C C 13 176.382 0.300 . 1 . . . . A 143 ASP C . 36058 1 437 . 1 1 39 39 ASP CA C 13 53.107 0.300 . 1 . . . . A 143 ASP CA . 36058 1 438 . 1 1 39 39 ASP CB C 13 42.394 0.300 . 1 . . . . A 143 ASP CB . 36058 1 439 . 1 1 39 39 ASP N N 15 123.866 0.300 . 1 . . . . A 143 ASP N . 36058 1 440 . 1 1 40 40 LYS H H 1 8.897 0.030 . 1 . . . . A 144 LYS H . 36058 1 441 . 1 1 40 40 LYS HA H 1 4.168 0.030 . 1 . . . . A 144 LYS HA . 36058 1 442 . 1 1 40 40 LYS HB2 H 1 1.921 0.030 . 1 . . . . A 144 LYS HB2 . 36058 1 443 . 1 1 40 40 LYS HB3 H 1 1.921 0.030 . 1 . . . . A 144 LYS HB3 . 36058 1 444 . 1 1 40 40 LYS HG2 H 1 1.550 0.030 . 1 . . . . A 144 LYS HG2 . 36058 1 445 . 1 1 40 40 LYS HG3 H 1 1.550 0.030 . 1 . . . . A 144 LYS HG3 . 36058 1 446 . 1 1 40 40 LYS HD2 H 1 1.731 0.030 . 1 . . . . A 144 LYS HD2 . 36058 1 447 . 1 1 40 40 LYS HD3 H 1 1.731 0.030 . 1 . . . . A 144 LYS HD3 . 36058 1 448 . 1 1 40 40 LYS HE2 H 1 2.991 0.030 . 1 . . . . A 144 LYS HE2 . 36058 1 449 . 1 1 40 40 LYS HE3 H 1 2.991 0.030 . 1 . . . . A 144 LYS HE3 . 36058 1 450 . 1 1 40 40 LYS C C 13 177.620 0.300 . 1 . . . . A 144 LYS C . 36058 1 451 . 1 1 40 40 LYS CA C 13 58.373 0.300 . 1 . . . . A 144 LYS CA . 36058 1 452 . 1 1 40 40 LYS CB C 13 32.331 0.300 . 1 . . . . A 144 LYS CB . 36058 1 453 . 1 1 40 40 LYS CG C 13 25.025 0.300 . 1 . . . . A 144 LYS CG . 36058 1 454 . 1 1 40 40 LYS CD C 13 29.155 0.300 . 1 . . . . A 144 LYS CD . 36058 1 455 . 1 1 40 40 LYS CE C 13 42.054 0.300 . 1 . . . . A 144 LYS CE . 36058 1 456 . 1 1 40 40 LYS N N 15 125.456 0.300 . 1 . . . . A 144 LYS N . 36058 1 457 . 1 1 41 41 THR H H 1 8.635 0.030 . 1 . . . . A 145 THR H . 36058 1 458 . 1 1 41 41 THR HA H 1 4.191 0.030 . 1 . . . . A 145 THR HA . 36058 1 459 . 1 1 41 41 THR HB H 1 4.306 0.030 . 1 . . . . A 145 THR HB . 36058 1 460 . 1 1 41 41 THR HG21 H 1 1.233 0.030 . 1 . . . . A 145 THR HG21 . 36058 1 461 . 1 1 41 41 THR HG22 H 1 1.233 0.030 . 1 . . . . A 145 THR HG22 . 36058 1 462 . 1 1 41 41 THR HG23 H 1 1.233 0.030 . 1 . . . . A 145 THR HG23 . 36058 1 463 . 1 1 41 41 THR C C 13 176.019 0.300 . 1 . . . . A 145 THR C . 36058 1 464 . 1 1 41 41 THR CA C 13 64.873 0.300 . 1 . . . . A 145 THR CA . 36058 1 465 . 1 1 41 41 THR CB C 13 68.904 0.300 . 1 . . . . A 145 THR CB . 36058 1 466 . 1 1 41 41 THR CG2 C 13 21.996 0.300 . 1 . . . . A 145 THR CG2 . 36058 1 467 . 1 1 41 41 THR N N 15 113.214 0.300 . 1 . . . . A 145 THR N . 36058 1 468 . 1 1 42 42 THR H H 1 7.512 0.030 . 1 . . . . A 146 THR H . 36058 1 469 . 1 1 42 42 THR HA H 1 4.318 0.030 . 1 . . . . A 146 THR HA . 36058 1 470 . 1 1 42 42 THR HB H 1 4.215 0.030 . 1 . . . . A 146 THR HB . 36058 1 471 . 1 1 42 42 THR HG21 H 1 1.118 0.030 . 1 . . . . A 146 THR HG21 . 36058 1 472 . 1 1 42 42 THR HG22 H 1 1.118 0.030 . 1 . . . . A 146 THR HG22 . 36058 1 473 . 1 1 42 42 THR HG23 H 1 1.118 0.030 . 1 . . . . A 146 THR HG23 . 36058 1 474 . 1 1 42 42 THR C C 13 175.414 0.300 . 1 . . . . A 146 THR C . 36058 1 475 . 1 1 42 42 THR CA C 13 61.664 0.300 . 1 . . . . A 146 THR CA . 36058 1 476 . 1 1 42 42 THR CB C 13 70.400 0.300 . 1 . . . . A 146 THR CB . 36058 1 477 . 1 1 42 42 THR CG2 C 13 21.706 0.300 . 1 . . . . A 146 THR CG2 . 36058 1 478 . 1 1 42 42 THR N N 15 110.047 0.300 . 1 . . . . A 146 THR N . 36058 1 479 . 1 1 43 43 ASN H H 1 8.324 0.030 . 1 . . . . A 147 ASN H . 36058 1 480 . 1 1 43 43 ASN HA H 1 4.425 0.030 . 1 . . . . A 147 ASN HA . 36058 1 481 . 1 1 43 43 ASN HB2 H 1 3.130 0.030 . 2 . . . . A 147 ASN HB2 . 36058 1 482 . 1 1 43 43 ASN HB3 H 1 2.750 0.030 . 2 . . . . A 147 ASN HB3 . 36058 1 483 . 1 1 43 43 ASN HD21 H 1 7.481 0.030 . 2 . . . . A 147 ASN HD21 . 36058 1 484 . 1 1 43 43 ASN HD22 H 1 6.713 0.030 . 2 . . . . A 147 ASN HD22 . 36058 1 485 . 1 1 43 43 ASN C C 13 173.906 0.300 . 1 . . . . A 147 ASN C . 36058 1 486 . 1 1 43 43 ASN CA C 13 54.629 0.300 . 1 . . . . A 147 ASN CA . 36058 1 487 . 1 1 43 43 ASN CB C 13 37.844 0.300 . 1 . . . . A 147 ASN CB . 36058 1 488 . 1 1 43 43 ASN N N 15 117.905 0.300 . 1 . . . . A 147 ASN N . 36058 1 489 . 1 1 43 43 ASN ND2 N 15 111.989 0.300 . 1 . . . . A 147 ASN ND2 . 36058 1 490 . 1 1 44 44 ARG H H 1 7.615 0.030 . 1 . . . . A 148 ARG H . 36058 1 491 . 1 1 44 44 ARG HA H 1 4.681 0.030 . 1 . . . . A 148 ARG HA . 36058 1 492 . 1 1 44 44 ARG HB2 H 1 1.735 0.030 . 2 . . . . A 148 ARG HB2 . 36058 1 493 . 1 1 44 44 ARG HB3 H 1 1.551 0.030 . 2 . . . . A 148 ARG HB3 . 36058 1 494 . 1 1 44 44 ARG HG2 H 1 1.543 0.030 . 1 . . . . A 148 ARG HG2 . 36058 1 495 . 1 1 44 44 ARG HG3 H 1 1.543 0.030 . 1 . . . . A 148 ARG HG3 . 36058 1 496 . 1 1 44 44 ARG HD2 H 1 3.142 0.030 . 2 . . . . A 148 ARG HD2 . 36058 1 497 . 1 1 44 44 ARG HD3 H 1 3.059 0.030 . 2 . . . . A 148 ARG HD3 . 36058 1 498 . 1 1 44 44 ARG C C 13 175.796 0.300 . 1 . . . . A 148 ARG C . 36058 1 499 . 1 1 44 44 ARG CA C 13 54.547 0.300 . 1 . . . . A 148 ARG CA . 36058 1 500 . 1 1 44 44 ARG CB C 13 33.154 0.300 . 1 . . . . A 148 ARG CB . 36058 1 501 . 1 1 44 44 ARG CG C 13 26.889 0.300 . 1 . . . . A 148 ARG CG . 36058 1 502 . 1 1 44 44 ARG CD C 13 43.570 0.300 . 1 . . . . A 148 ARG CD . 36058 1 503 . 1 1 44 44 ARG N N 15 116.648 0.300 . 1 . . . . A 148 ARG N . 36058 1 504 . 1 1 45 45 HIS H H 1 8.266 0.030 . 1 . . . . A 149 HIS H . 36058 1 505 . 1 1 45 45 HIS HA H 1 4.623 0.030 . 1 . . . . A 149 HIS HA . 36058 1 506 . 1 1 45 45 HIS HB2 H 1 2.388 0.030 . 2 . . . . A 149 HIS HB2 . 36058 1 507 . 1 1 45 45 HIS HB3 H 1 2.874 0.030 . 2 . . . . A 149 HIS HB3 . 36058 1 508 . 1 1 45 45 HIS HD2 H 1 7.049 0.030 . 1 . . . . A 149 HIS HD2 . 36058 1 509 . 1 1 45 45 HIS HE1 H 1 7.177 0.030 . 1 . . . . A 149 HIS HE1 . 36058 1 510 . 1 1 45 45 HIS C C 13 176.369 0.300 . 1 . . . . A 149 HIS C . 36058 1 511 . 1 1 45 45 HIS CA C 13 56.110 0.300 . 1 . . . . A 149 HIS CA . 36058 1 512 . 1 1 45 45 HIS CB C 13 31.097 0.300 . 1 . . . . A 149 HIS CB . 36058 1 513 . 1 1 45 45 HIS CD2 C 13 119.526 0.300 . 1 . . . . A 149 HIS CD2 . 36058 1 514 . 1 1 45 45 HIS CE1 C 13 138.567 0.300 . 1 . . . . A 149 HIS CE1 . 36058 1 515 . 1 1 45 45 HIS N N 15 119.310 0.300 . 1 . . . . A 149 HIS N . 36058 1 516 . 1 1 46 46 ARG H H 1 8.552 0.030 . 1 . . . . A 150 ARG H . 36058 1 517 . 1 1 46 46 ARG HA H 1 4.329 0.030 . 1 . . . . A 150 ARG HA . 36058 1 518 . 1 1 46 46 ARG HB2 H 1 1.085 0.030 . 2 . . . . A 150 ARG HB2 . 36058 1 519 . 1 1 46 46 ARG HB3 H 1 2.418 0.030 . 2 . . . . A 150 ARG HB3 . 36058 1 520 . 1 1 46 46 ARG HG2 H 1 1.479 0.030 . 2 . . . . A 150 ARG HG2 . 36058 1 521 . 1 1 46 46 ARG HG3 H 1 1.665 0.030 . 2 . . . . A 150 ARG HG3 . 36058 1 522 . 1 1 46 46 ARG HD2 H 1 3.135 0.030 . 2 . . . . A 150 ARG HD2 . 36058 1 523 . 1 1 46 46 ARG HD3 H 1 3.010 0.030 . 2 . . . . A 150 ARG HD3 . 36058 1 524 . 1 1 46 46 ARG C C 13 177.281 0.300 . 1 . . . . A 150 ARG C . 36058 1 525 . 1 1 46 46 ARG CA C 13 56.190 0.300 . 1 . . . . A 150 ARG CA . 36058 1 526 . 1 1 46 46 ARG CB C 13 31.958 0.300 . 1 . . . . A 150 ARG CB . 36058 1 527 . 1 1 46 46 ARG CG C 13 28.036 0.300 . 1 . . . . A 150 ARG CG . 36058 1 528 . 1 1 46 46 ARG CD C 13 43.878 0.300 . 1 . . . . A 150 ARG CD . 36058 1 529 . 1 1 46 46 ARG N N 15 117.834 0.300 . 1 . . . . A 150 ARG N . 36058 1 530 . 1 1 47 47 GLY H H 1 10.854 0.030 . 1 . . . . A 151 GLY H . 36058 1 531 . 1 1 47 47 GLY HA2 H 1 3.778 0.030 . 2 . . . . A 151 GLY HA2 . 36058 1 532 . 1 1 47 47 GLY HA3 H 1 4.415 0.030 . 2 . . . . A 151 GLY HA3 . 36058 1 533 . 1 1 47 47 GLY C C 13 172.486 0.300 . 1 . . . . A 151 GLY C . 36058 1 534 . 1 1 47 47 GLY CA C 13 45.619 0.300 . 1 . . . . A 151 GLY CA . 36058 1 535 . 1 1 47 47 GLY N N 15 113.138 0.300 . 1 . . . . A 151 GLY N . 36058 1 536 . 1 1 48 48 PHE H H 1 7.145 0.030 . 1 . . . . A 152 PHE H . 36058 1 537 . 1 1 48 48 PHE HA H 1 5.447 0.030 . 1 . . . . A 152 PHE HA . 36058 1 538 . 1 1 48 48 PHE HB2 H 1 3.104 0.030 . 2 . . . . A 152 PHE HB2 . 36058 1 539 . 1 1 48 48 PHE HB3 H 1 2.786 0.030 . 2 . . . . A 152 PHE HB3 . 36058 1 540 . 1 1 48 48 PHE HD1 H 1 6.887 0.030 . 1 . . . . A 152 PHE HD1 . 36058 1 541 . 1 1 48 48 PHE HD2 H 1 6.887 0.030 . 1 . . . . A 152 PHE HD2 . 36058 1 542 . 1 1 48 48 PHE HE1 H 1 7.408 0.030 . 1 . . . . A 152 PHE HE1 . 36058 1 543 . 1 1 48 48 PHE HE2 H 1 7.408 0.030 . 1 . . . . A 152 PHE HE2 . 36058 1 544 . 1 1 48 48 PHE C C 13 172.709 0.300 . 1 . . . . A 152 PHE C . 36058 1 545 . 1 1 48 48 PHE CA C 13 54.495 0.300 . 1 . . . . A 152 PHE CA . 36058 1 546 . 1 1 48 48 PHE CB C 13 42.465 0.300 . 1 . . . . A 152 PHE CB . 36058 1 547 . 1 1 48 48 PHE CD1 C 13 132.946 0.300 . 1 . . . . A 152 PHE CD1 . 36058 1 548 . 1 1 48 48 PHE CD2 C 13 132.946 0.300 . 1 . . . . A 152 PHE CD2 . 36058 1 549 . 1 1 48 48 PHE CE1 C 13 130.780 0.300 . 1 . . . . A 152 PHE CE1 . 36058 1 550 . 1 1 48 48 PHE CE2 C 13 130.780 0.300 . 1 . . . . A 152 PHE CE2 . 36058 1 551 . 1 1 48 48 PHE N N 15 113.249 0.300 . 1 . . . . A 152 PHE N . 36058 1 552 . 1 1 49 49 GLY H H 1 8.342 0.030 . 1 . . . . A 153 GLY H . 36058 1 553 . 1 1 49 49 GLY HA2 H 1 4.130 0.030 . 2 . . . . A 153 GLY HA2 . 36058 1 554 . 1 1 49 49 GLY HA3 H 1 3.798 0.030 . 2 . . . . A 153 GLY HA3 . 36058 1 555 . 1 1 49 49 GLY C C 13 169.636 0.300 . 1 . . . . A 153 GLY C . 36058 1 556 . 1 1 49 49 GLY CA C 13 45.083 0.300 . 1 . . . . A 153 GLY CA . 36058 1 557 . 1 1 49 49 GLY N N 15 105.480 0.300 . 1 . . . . A 153 GLY N . 36058 1 558 . 1 1 50 50 PHE H H 1 8.596 0.030 . 1 . . . . A 154 PHE H . 36058 1 559 . 1 1 50 50 PHE HA H 1 5.839 0.030 . 1 . . . . A 154 PHE HA . 36058 1 560 . 1 1 50 50 PHE HB2 H 1 2.810 0.030 . 2 . . . . A 154 PHE HB2 . 36058 1 561 . 1 1 50 50 PHE HB3 H 1 2.607 0.030 . 2 . . . . A 154 PHE HB3 . 36058 1 562 . 1 1 50 50 PHE HD1 H 1 7.177 0.030 . 1 . . . . A 154 PHE HD1 . 36058 1 563 . 1 1 50 50 PHE HD2 H 1 7.177 0.030 . 1 . . . . A 154 PHE HD2 . 36058 1 564 . 1 1 50 50 PHE HE1 H 1 7.546 0.030 . 1 . . . . A 154 PHE HE1 . 36058 1 565 . 1 1 50 50 PHE HE2 H 1 7.546 0.030 . 1 . . . . A 154 PHE HE2 . 36058 1 566 . 1 1 50 50 PHE HZ H 1 7.484 0.030 . 1 . . . . A 154 PHE HZ . 36058 1 567 . 1 1 50 50 PHE C C 13 175.367 0.300 . 1 . . . . A 154 PHE C . 36058 1 568 . 1 1 50 50 PHE CA C 13 56.275 0.300 . 1 . . . . A 154 PHE CA . 36058 1 569 . 1 1 50 50 PHE CB C 13 44.218 0.300 . 1 . . . . A 154 PHE CB . 36058 1 570 . 1 1 50 50 PHE CD1 C 13 132.265 0.300 . 1 . . . . A 154 PHE CD1 . 36058 1 571 . 1 1 50 50 PHE CD2 C 13 132.265 0.300 . 1 . . . . A 154 PHE CD2 . 36058 1 572 . 1 1 50 50 PHE CE1 C 13 131.139 0.300 . 1 . . . . A 154 PHE CE1 . 36058 1 573 . 1 1 50 50 PHE CE2 C 13 131.139 0.300 . 1 . . . . A 154 PHE CE2 . 36058 1 574 . 1 1 50 50 PHE CZ C 13 129.989 0.300 . 1 . . . . A 154 PHE CZ . 36058 1 575 . 1 1 50 50 PHE N N 15 114.468 0.300 . 1 . . . . A 154 PHE N . 36058 1 576 . 1 1 51 51 VAL H H 1 8.538 0.030 . 1 . . . . A 155 VAL H . 36058 1 577 . 1 1 51 51 VAL HA H 1 4.325 0.030 . 1 . . . . A 155 VAL HA . 36058 1 578 . 1 1 51 51 VAL HB H 1 1.166 0.030 . 1 . . . . A 155 VAL HB . 36058 1 579 . 1 1 51 51 VAL HG11 H 1 0.427 0.030 . 2 . . . . A 155 VAL HG11 . 36058 1 580 . 1 1 51 51 VAL HG12 H 1 0.427 0.030 . 2 . . . . A 155 VAL HG12 . 36058 1 581 . 1 1 51 51 VAL HG13 H 1 0.427 0.030 . 2 . . . . A 155 VAL HG13 . 36058 1 582 . 1 1 51 51 VAL HG21 H 1 0.070 0.030 . 2 . . . . A 155 VAL HG21 . 36058 1 583 . 1 1 51 51 VAL HG22 H 1 0.070 0.030 . 2 . . . . A 155 VAL HG22 . 36058 1 584 . 1 1 51 51 VAL HG23 H 1 0.070 0.030 . 2 . . . . A 155 VAL HG23 . 36058 1 585 . 1 1 51 51 VAL C C 13 173.456 0.300 . 1 . . . . A 155 VAL C . 36058 1 586 . 1 1 51 51 VAL CA C 13 61.006 0.300 . 1 . . . . A 155 VAL CA . 36058 1 587 . 1 1 51 51 VAL CB C 13 34.758 0.300 . 1 . . . . A 155 VAL CB . 36058 1 588 . 1 1 51 51 VAL CG1 C 13 21.629 0.300 . 2 . . . . A 155 VAL CG1 . 36058 1 589 . 1 1 51 51 VAL CG2 C 13 21.666 0.300 . 2 . . . . A 155 VAL CG2 . 36058 1 590 . 1 1 51 51 VAL N N 15 122.214 0.300 . 1 . . . . A 155 VAL N . 36058 1 591 . 1 1 52 52 THR H H 1 8.819 0.030 . 1 . . . . A 156 THR H . 36058 1 592 . 1 1 52 52 THR HA H 1 4.897 0.030 . 1 . . . . A 156 THR HA . 36058 1 593 . 1 1 52 52 THR HB H 1 3.792 0.030 . 1 . . . . A 156 THR HB . 36058 1 594 . 1 1 52 52 THR HG21 H 1 1.137 0.030 . 1 . . . . A 156 THR HG21 . 36058 1 595 . 1 1 52 52 THR HG22 H 1 1.137 0.030 . 1 . . . . A 156 THR HG22 . 36058 1 596 . 1 1 52 52 THR HG23 H 1 1.137 0.030 . 1 . . . . A 156 THR HG23 . 36058 1 597 . 1 1 52 52 THR C C 13 173.833 0.300 . 1 . . . . A 156 THR C . 36058 1 598 . 1 1 52 52 THR CA C 13 61.171 0.300 . 1 . . . . A 156 THR CA . 36058 1 599 . 1 1 52 52 THR CB C 13 69.806 0.300 . 1 . . . . A 156 THR CB . 36058 1 600 . 1 1 52 52 THR CG2 C 13 21.838 0.300 . 1 . . . . A 156 THR CG2 . 36058 1 601 . 1 1 52 52 THR N N 15 122.308 0.300 . 1 . . . . A 156 THR N . 36058 1 602 . 1 1 53 53 PHE H H 1 8.960 0.030 . 1 . . . . A 157 PHE H . 36058 1 603 . 1 1 53 53 PHE HA H 1 4.971 0.030 . 1 . . . . A 157 PHE HA . 36058 1 604 . 1 1 53 53 PHE HB2 H 1 2.625 0.030 . 2 . . . . A 157 PHE HB2 . 36058 1 605 . 1 1 53 53 PHE HB3 H 1 3.529 0.030 . 2 . . . . A 157 PHE HB3 . 36058 1 606 . 1 1 53 53 PHE HD1 H 1 7.100 0.030 . 1 . . . . A 157 PHE HD1 . 36058 1 607 . 1 1 53 53 PHE HD2 H 1 7.100 0.030 . 1 . . . . A 157 PHE HD2 . 36058 1 608 . 1 1 53 53 PHE HE1 H 1 6.947 0.030 . 1 . . . . A 157 PHE HE1 . 36058 1 609 . 1 1 53 53 PHE HE2 H 1 6.947 0.030 . 1 . . . . A 157 PHE HE2 . 36058 1 610 . 1 1 53 53 PHE HZ H 1 6.839 0.030 . 1 . . . . A 157 PHE HZ . 36058 1 611 . 1 1 53 53 PHE C C 13 175.149 0.300 . 1 . . . . A 157 PHE C . 36058 1 612 . 1 1 53 53 PHE CA C 13 57.838 0.300 . 1 . . . . A 157 PHE CA . 36058 1 613 . 1 1 53 53 PHE CB C 13 41.874 0.300 . 1 . . . . A 157 PHE CB . 36058 1 614 . 1 1 53 53 PHE CD1 C 13 132.525 0.300 . 1 . . . . A 157 PHE CD1 . 36058 1 615 . 1 1 53 53 PHE CD2 C 13 132.525 0.300 . 1 . . . . A 157 PHE CD2 . 36058 1 616 . 1 1 53 53 PHE CE1 C 13 130.588 0.300 . 1 . . . . A 157 PHE CE1 . 36058 1 617 . 1 1 53 53 PHE CE2 C 13 130.588 0.300 . 1 . . . . A 157 PHE CE2 . 36058 1 618 . 1 1 53 53 PHE CZ C 13 128.270 0.300 . 1 . . . . A 157 PHE CZ . 36058 1 619 . 1 1 53 53 PHE N N 15 126.144 0.300 . 1 . . . . A 157 PHE N . 36058 1 620 . 1 1 54 54 GLU H H 1 8.036 0.030 . 1 . . . . A 158 GLU H . 36058 1 621 . 1 1 54 54 GLU HA H 1 4.201 0.030 . 1 . . . . A 158 GLU HA . 36058 1 622 . 1 1 54 54 GLU HB2 H 1 2.048 0.030 . 1 . . . . A 158 GLU HB2 . 36058 1 623 . 1 1 54 54 GLU HB3 H 1 2.048 0.030 . 1 . . . . A 158 GLU HB3 . 36058 1 624 . 1 1 54 54 GLU HG2 H 1 2.285 0.030 . 1 . . . . A 158 GLU HG2 . 36058 1 625 . 1 1 54 54 GLU HG3 H 1 2.285 0.030 . 1 . . . . A 158 GLU HG3 . 36058 1 626 . 1 1 54 54 GLU C C 13 176.428 0.300 . 1 . . . . A 158 GLU C . 36058 1 627 . 1 1 54 54 GLU CA C 13 58.578 0.300 . 1 . . . . A 158 GLU CA . 36058 1 628 . 1 1 54 54 GLU CB C 13 30.644 0.300 . 1 . . . . A 158 GLU CB . 36058 1 629 . 1 1 54 54 GLU CG C 13 36.603 0.300 . 1 . . . . A 158 GLU CG . 36058 1 630 . 1 1 54 54 GLU N N 15 117.961 0.300 . 1 . . . . A 158 GLU N . 36058 1 631 . 1 1 55 55 SER H H 1 8.064 0.030 . 1 . . . . A 159 SER H . 36058 1 632 . 1 1 55 55 SER HA H 1 4.804 0.030 . 1 . . . . A 159 SER HA . 36058 1 633 . 1 1 55 55 SER HB2 H 1 3.974 0.030 . 2 . . . . A 159 SER HB2 . 36058 1 634 . 1 1 55 55 SER HB3 H 1 3.832 0.030 . 2 . . . . A 159 SER HB3 . 36058 1 635 . 1 1 55 55 SER C C 13 175.308 0.300 . 1 . . . . A 159 SER C . 36058 1 636 . 1 1 55 55 SER CA C 13 56.398 0.300 . 1 . . . . A 159 SER CA . 36058 1 637 . 1 1 55 55 SER CB C 13 64.968 0.300 . 1 . . . . A 159 SER CB . 36058 1 638 . 1 1 55 55 SER N N 15 110.260 0.300 . 1 . . . . A 159 SER N . 36058 1 639 . 1 1 56 56 GLU H H 1 9.620 0.030 . 1 . . . . A 160 GLU H . 36058 1 640 . 1 1 56 56 GLU HA H 1 4.004 0.030 . 1 . . . . A 160 GLU HA . 36058 1 641 . 1 1 56 56 GLU HB2 H 1 2.021 0.030 . 1 . . . . A 160 GLU HB2 . 36058 1 642 . 1 1 56 56 GLU HB3 H 1 2.021 0.030 . 1 . . . . A 160 GLU HB3 . 36058 1 643 . 1 1 56 56 GLU HG2 H 1 2.275 0.030 . 1 . . . . A 160 GLU HG2 . 36058 1 644 . 1 1 56 56 GLU HG3 H 1 2.275 0.030 . 1 . . . . A 160 GLU HG3 . 36058 1 645 . 1 1 56 56 GLU C C 13 177.614 0.300 . 1 . . . . A 160 GLU C . 36058 1 646 . 1 1 56 56 GLU CA C 13 59.278 0.300 . 1 . . . . A 160 GLU CA . 36058 1 647 . 1 1 56 56 GLU CB C 13 29.575 0.300 . 1 . . . . A 160 GLU CB . 36058 1 648 . 1 1 56 56 GLU CG C 13 36.507 0.300 . 1 . . . . A 160 GLU CG . 36058 1 649 . 1 1 56 56 GLU N N 15 126.908 0.300 . 1 . . . . A 160 GLU N . 36058 1 650 . 1 1 57 57 ASP H H 1 8.328 0.030 . 1 . . . . A 161 ASP H . 36058 1 651 . 1 1 57 57 ASP HA H 1 4.336 0.030 . 1 . . . . A 161 ASP HA . 36058 1 652 . 1 1 57 57 ASP HB2 H 1 2.637 0.030 . 2 . . . . A 161 ASP HB2 . 36058 1 653 . 1 1 57 57 ASP HB3 H 1 2.519 0.030 . 2 . . . . A 161 ASP HB3 . 36058 1 654 . 1 1 57 57 ASP C C 13 178.523 0.300 . 1 . . . . A 161 ASP C . 36058 1 655 . 1 1 57 57 ASP CA C 13 56.933 0.300 . 1 . . . . A 161 ASP CA . 36058 1 656 . 1 1 57 57 ASP CB C 13 39.983 0.300 . 1 . . . . A 161 ASP CB . 36058 1 657 . 1 1 57 57 ASP N N 15 119.105 0.300 . 1 . . . . A 161 ASP N . 36058 1 658 . 1 1 58 58 ILE H H 1 7.217 0.030 . 1 . . . . A 162 ILE H . 36058 1 659 . 1 1 58 58 ILE HA H 1 3.602 0.030 . 1 . . . . A 162 ILE HA . 36058 1 660 . 1 1 58 58 ILE HB H 1 1.706 0.030 . 1 . . . . A 162 ILE HB . 36058 1 661 . 1 1 58 58 ILE HG12 H 1 1.458 0.030 . 1 . . . . A 162 ILE HG12 . 36058 1 662 . 1 1 58 58 ILE HG13 H 1 1.458 0.030 . 1 . . . . A 162 ILE HG13 . 36058 1 663 . 1 1 58 58 ILE HG21 H 1 0.062 0.030 . 1 . . . . A 162 ILE HG21 . 36058 1 664 . 1 1 58 58 ILE HG22 H 1 0.062 0.030 . 1 . . . . A 162 ILE HG22 . 36058 1 665 . 1 1 58 58 ILE HG23 H 1 0.062 0.030 . 1 . . . . A 162 ILE HG23 . 36058 1 666 . 1 1 58 58 ILE HD11 H 1 0.821 0.030 . 1 . . . . A 162 ILE HD11 . 36058 1 667 . 1 1 58 58 ILE HD12 H 1 0.821 0.030 . 1 . . . . A 162 ILE HD12 . 36058 1 668 . 1 1 58 58 ILE HD13 H 1 0.821 0.030 . 1 . . . . A 162 ILE HD13 . 36058 1 669 . 1 1 58 58 ILE C C 13 177.284 0.300 . 1 . . . . A 162 ILE C . 36058 1 670 . 1 1 58 58 ILE CA C 13 61.870 0.300 . 1 . . . . A 162 ILE CA . 36058 1 671 . 1 1 58 58 ILE CB C 13 35.746 0.300 . 1 . . . . A 162 ILE CB . 36058 1 672 . 1 1 58 58 ILE CG1 C 13 27.708 0.300 . 1 . . . . A 162 ILE CG1 . 36058 1 673 . 1 1 58 58 ILE CG2 C 13 18.622 0.300 . 1 . . . . A 162 ILE CG2 . 36058 1 674 . 1 1 58 58 ILE CD1 C 13 10.212 0.300 . 1 . . . . A 162 ILE CD1 . 36058 1 675 . 1 1 58 58 ILE N N 15 120.114 0.300 . 1 . . . . A 162 ILE N . 36058 1 676 . 1 1 59 59 VAL H H 1 6.777 0.030 . 1 . . . . A 163 VAL H . 36058 1 677 . 1 1 59 59 VAL HA H 1 2.920 0.030 . 1 . . . . A 163 VAL HA . 36058 1 678 . 1 1 59 59 VAL HB H 1 2.356 0.030 . 1 . . . . A 163 VAL HB . 36058 1 679 . 1 1 59 59 VAL HG11 H 1 1.021 0.030 . 2 . . . . A 163 VAL HG11 . 36058 1 680 . 1 1 59 59 VAL HG12 H 1 1.021 0.030 . 2 . . . . A 163 VAL HG12 . 36058 1 681 . 1 1 59 59 VAL HG13 H 1 1.021 0.030 . 2 . . . . A 163 VAL HG13 . 36058 1 682 . 1 1 59 59 VAL HG21 H 1 0.745 0.030 . 2 . . . . A 163 VAL HG21 . 36058 1 683 . 1 1 59 59 VAL HG22 H 1 0.745 0.030 . 2 . . . . A 163 VAL HG22 . 36058 1 684 . 1 1 59 59 VAL HG23 H 1 0.745 0.030 . 2 . . . . A 163 VAL HG23 . 36058 1 685 . 1 1 59 59 VAL C C 13 177.811 0.300 . 1 . . . . A 163 VAL C . 36058 1 686 . 1 1 59 59 VAL CA C 13 67.177 0.300 . 1 . . . . A 163 VAL CA . 36058 1 687 . 1 1 59 59 VAL CB C 13 31.427 0.300 . 1 . . . . A 163 VAL CB . 36058 1 688 . 1 1 59 59 VAL CG1 C 13 24.132 0.300 . 2 . . . . A 163 VAL CG1 . 36058 1 689 . 1 1 59 59 VAL CG2 C 13 21.452 0.300 . 2 . . . . A 163 VAL CG2 . 36058 1 690 . 1 1 59 59 VAL N N 15 119.604 0.300 . 1 . . . . A 163 VAL N . 36058 1 691 . 1 1 60 60 GLU H H 1 7.578 0.030 . 1 . . . . A 164 GLU H . 36058 1 692 . 1 1 60 60 GLU HA H 1 3.836 0.030 . 1 . . . . A 164 GLU HA . 36058 1 693 . 1 1 60 60 GLU HB2 H 1 2.036 0.030 . 1 . . . . A 164 GLU HB2 . 36058 1 694 . 1 1 60 60 GLU HB3 H 1 2.036 0.030 . 1 . . . . A 164 GLU HB3 . 36058 1 695 . 1 1 60 60 GLU HG2 H 1 2.330 0.030 . 1 . . . . A 164 GLU HG2 . 36058 1 696 . 1 1 60 60 GLU HG3 H 1 2.330 0.030 . 1 . . . . A 164 GLU HG3 . 36058 1 697 . 1 1 60 60 GLU C C 13 178.905 0.300 . 1 . . . . A 164 GLU C . 36058 1 698 . 1 1 60 60 GLU CA C 13 59.194 0.300 . 1 . . . . A 164 GLU CA . 36058 1 699 . 1 1 60 60 GLU CB C 13 28.951 0.300 . 1 . . . . A 164 GLU CB . 36058 1 700 . 1 1 60 60 GLU CG C 13 35.366 0.300 . 1 . . . . A 164 GLU CG . 36058 1 701 . 1 1 60 60 GLU N N 15 116.684 0.300 . 1 . . . . A 164 GLU N . 36058 1 702 . 1 1 61 61 LYS H H 1 7.375 0.030 . 1 . . . . A 165 LYS H . 36058 1 703 . 1 1 61 61 LYS HA H 1 4.092 0.030 . 1 . . . . A 165 LYS HA . 36058 1 704 . 1 1 61 61 LYS HB2 H 1 1.872 0.030 . 2 . . . . A 165 LYS HB2 . 36058 1 705 . 1 1 61 61 LYS HB3 H 1 1.949 0.030 . 2 . . . . A 165 LYS HB3 . 36058 1 706 . 1 1 61 61 LYS HG2 H 1 1.527 0.030 . 2 . . . . A 165 LYS HG2 . 36058 1 707 . 1 1 61 61 LYS HG3 H 1 1.412 0.030 . 2 . . . . A 165 LYS HG3 . 36058 1 708 . 1 1 61 61 LYS HD2 H 1 1.779 0.030 . 1 . . . . A 165 LYS HD2 . 36058 1 709 . 1 1 61 61 LYS HD3 H 1 1.779 0.030 . 1 . . . . A 165 LYS HD3 . 36058 1 710 . 1 1 61 61 LYS HE2 H 1 2.978 0.030 . 1 . . . . A 165 LYS HE2 . 36058 1 711 . 1 1 61 61 LYS HE3 H 1 2.978 0.030 . 1 . . . . A 165 LYS HE3 . 36058 1 712 . 1 1 61 61 LYS C C 13 179.281 0.300 . 1 . . . . A 165 LYS C . 36058 1 713 . 1 1 61 61 LYS CA C 13 59.088 0.300 . 1 . . . . A 165 LYS CA . 36058 1 714 . 1 1 61 61 LYS CB C 13 32.325 0.300 . 1 . . . . A 165 LYS CB . 36058 1 715 . 1 1 61 61 LYS CG C 13 24.507 0.300 . 1 . . . . A 165 LYS CG . 36058 1 716 . 1 1 61 61 LYS CD C 13 28.873 0.300 . 1 . . . . A 165 LYS CD . 36058 1 717 . 1 1 61 61 LYS CE C 13 42.120 0.300 . 1 . . . . A 165 LYS CE . 36058 1 718 . 1 1 61 61 LYS N N 15 119.189 0.300 . 1 . . . . A 165 LYS N . 36058 1 719 . 1 1 62 62 VAL H H 1 8.285 0.030 . 1 . . . . A 166 VAL H . 36058 1 720 . 1 1 62 62 VAL HA H 1 3.441 0.030 . 1 . . . . A 166 VAL HA . 36058 1 721 . 1 1 62 62 VAL HB H 1 1.927 0.030 . 1 . . . . A 166 VAL HB . 36058 1 722 . 1 1 62 62 VAL HG11 H 1 0.541 0.030 . 2 . . . . A 166 VAL HG11 . 36058 1 723 . 1 1 62 62 VAL HG12 H 1 0.541 0.030 . 2 . . . . A 166 VAL HG12 . 36058 1 724 . 1 1 62 62 VAL HG13 H 1 0.541 0.030 . 2 . . . . A 166 VAL HG13 . 36058 1 725 . 1 1 62 62 VAL HG21 H 1 0.597 0.030 . 2 . . . . A 166 VAL HG21 . 36058 1 726 . 1 1 62 62 VAL HG22 H 1 0.597 0.030 . 2 . . . . A 166 VAL HG22 . 36058 1 727 . 1 1 62 62 VAL HG23 H 1 0.597 0.030 . 2 . . . . A 166 VAL HG23 . 36058 1 728 . 1 1 62 62 VAL C C 13 180.139 0.300 . 1 . . . . A 166 VAL C . 36058 1 729 . 1 1 62 62 VAL CA C 13 66.485 0.300 . 1 . . . . A 166 VAL CA . 36058 1 730 . 1 1 62 62 VAL CB C 13 31.494 0.300 . 1 . . . . A 166 VAL CB . 36058 1 731 . 1 1 62 62 VAL CG1 C 13 22.403 0.300 . 2 . . . . A 166 VAL CG1 . 36058 1 732 . 1 1 62 62 VAL CG2 C 13 22.326 0.300 . 2 . . . . A 166 VAL CG2 . 36058 1 733 . 1 1 62 62 VAL N N 15 115.246 0.300 . 1 . . . . A 166 VAL N . 36058 1 734 . 1 1 63 63 CYS H H 1 8.180 0.030 . 1 . . . . A 167 CYS H . 36058 1 735 . 1 1 63 63 CYS HA H 1 4.124 0.030 . 1 . . . . A 167 CYS HA . 36058 1 736 . 1 1 63 63 CYS HB2 H 1 2.940 0.030 . 2 . . . . A 167 CYS HB2 . 36058 1 737 . 1 1 63 63 CYS HB3 H 1 2.855 0.030 . 2 . . . . A 167 CYS HB3 . 36058 1 738 . 1 1 63 63 CYS C C 13 175.647 0.300 . 1 . . . . A 167 CYS C . 36058 1 739 . 1 1 63 63 CYS CA C 13 64.203 0.300 . 1 . . . . A 167 CYS CA . 36058 1 740 . 1 1 63 63 CYS CB C 13 26.828 0.300 . 1 . . . . A 167 CYS CB . 36058 1 741 . 1 1 63 63 CYS N N 15 119.746 0.300 . 1 . . . . A 167 CYS N . 36058 1 742 . 1 1 64 64 GLU H H 1 8.003 0.030 . 1 . . . . A 168 GLU H . 36058 1 743 . 1 1 64 64 GLU HA H 1 4.046 0.030 . 1 . . . . A 168 GLU HA . 36058 1 744 . 1 1 64 64 GLU HB2 H 1 2.152 0.030 . 1 . . . . A 168 GLU HB2 . 36058 1 745 . 1 1 64 64 GLU HB3 H 1 2.152 0.030 . 1 . . . . A 168 GLU HB3 . 36058 1 746 . 1 1 64 64 GLU HG2 H 1 2.257 0.030 . 2 . . . . A 168 GLU HG2 . 36058 1 747 . 1 1 64 64 GLU HG3 H 1 2.328 0.030 . 2 . . . . A 168 GLU HG3 . 36058 1 748 . 1 1 64 64 GLU C C 13 177.069 0.300 . 1 . . . . A 168 GLU C . 36058 1 749 . 1 1 64 64 GLU CA C 13 58.854 0.300 . 1 . . . . A 168 GLU CA . 36058 1 750 . 1 1 64 64 GLU CB C 13 29.312 0.300 . 1 . . . . A 168 GLU CB . 36058 1 751 . 1 1 64 64 GLU CG C 13 36.083 0.300 . 1 . . . . A 168 GLU CG . 36058 1 752 . 1 1 64 64 GLU N N 15 122.585 0.300 . 1 . . . . A 168 GLU N . 36058 1 753 . 1 1 65 65 ILE H H 1 7.514 0.030 . 1 . . . . A 169 ILE H . 36058 1 754 . 1 1 65 65 ILE HA H 1 3.707 0.030 . 1 . . . . A 169 ILE HA . 36058 1 755 . 1 1 65 65 ILE HB H 1 1.500 0.030 . 1 . . . . A 169 ILE HB . 36058 1 756 . 1 1 65 65 ILE HG12 H 1 1.105 0.030 . 1 . . . . A 169 ILE HG12 . 36058 1 757 . 1 1 65 65 ILE HG13 H 1 1.105 0.030 . 1 . . . . A 169 ILE HG13 . 36058 1 758 . 1 1 65 65 ILE HG21 H 1 0.529 0.030 . 1 . . . . A 169 ILE HG21 . 36058 1 759 . 1 1 65 65 ILE HG22 H 1 0.529 0.030 . 1 . . . . A 169 ILE HG22 . 36058 1 760 . 1 1 65 65 ILE HG23 H 1 0.529 0.030 . 1 . . . . A 169 ILE HG23 . 36058 1 761 . 1 1 65 65 ILE HD11 H 1 0.940 0.030 . 1 . . . . A 169 ILE HD11 . 36058 1 762 . 1 1 65 65 ILE HD12 H 1 0.940 0.030 . 1 . . . . A 169 ILE HD12 . 36058 1 763 . 1 1 65 65 ILE HD13 H 1 0.940 0.030 . 1 . . . . A 169 ILE HD13 . 36058 1 764 . 1 1 65 65 ILE C C 13 178.592 0.300 . 1 . . . . A 169 ILE C . 36058 1 765 . 1 1 65 65 ILE CA C 13 64.544 0.300 . 1 . . . . A 169 ILE CA . 36058 1 766 . 1 1 65 65 ILE CB C 13 39.062 0.300 . 1 . . . . A 169 ILE CB . 36058 1 767 . 1 1 65 65 ILE CG1 C 13 29.106 0.300 . 1 . . . . A 169 ILE CG1 . 36058 1 768 . 1 1 65 65 ILE CG2 C 13 16.478 0.300 . 1 . . . . A 169 ILE CG2 . 36058 1 769 . 1 1 65 65 ILE CD1 C 13 14.800 0.300 . 1 . . . . A 169 ILE CD1 . 36058 1 770 . 1 1 65 65 ILE N N 15 120.660 0.300 . 1 . . . . A 169 ILE N . 36058 1 771 . 1 1 66 66 HIS H H 1 7.696 0.030 . 1 . . . . A 170 HIS H . 36058 1 772 . 1 1 66 66 HIS HA H 1 4.153 0.030 . 1 . . . . A 170 HIS HA . 36058 1 773 . 1 1 66 66 HIS HB2 H 1 3.014 0.030 . 2 . . . . A 170 HIS HB2 . 36058 1 774 . 1 1 66 66 HIS HB3 H 1 3.745 0.030 . 2 . . . . A 170 HIS HB3 . 36058 1 775 . 1 1 66 66 HIS HD2 H 1 6.958 0.030 . 1 . . . . A 170 HIS HD2 . 36058 1 776 . 1 1 66 66 HIS CA C 13 60.027 0.300 . 1 . . . . A 170 HIS CA . 36058 1 777 . 1 1 66 66 HIS CB C 13 28.153 0.300 . 1 . . . . A 170 HIS CB . 36058 1 778 . 1 1 66 66 HIS CD2 C 13 118.471 0.300 . 1 . . . . A 170 HIS CD2 . 36058 1 779 . 1 1 66 66 HIS N N 15 113.343 0.300 . 1 . . . . A 170 HIS N . 36058 1 780 . 1 1 67 67 PHE HA H 1 5.479 0.030 . 1 . . . . A 171 PHE HA . 36058 1 781 . 1 1 67 67 PHE HB2 H 1 2.984 0.030 . 2 . . . . A 171 PHE HB2 . 36058 1 782 . 1 1 67 67 PHE HB3 H 1 2.754 0.030 . 2 . . . . A 171 PHE HB3 . 36058 1 783 . 1 1 67 67 PHE HD1 H 1 7.117 0.030 . 1 . . . . A 171 PHE HD1 . 36058 1 784 . 1 1 67 67 PHE HD2 H 1 7.117 0.030 . 1 . . . . A 171 PHE HD2 . 36058 1 785 . 1 1 67 67 PHE C C 13 174.464 0.300 . 1 . . . . A 171 PHE C . 36058 1 786 . 1 1 67 67 PHE CA C 13 56.974 0.300 . 1 . . . . A 171 PHE CA . 36058 1 787 . 1 1 67 67 PHE CB C 13 40.905 0.300 . 1 . . . . A 171 PHE CB . 36058 1 788 . 1 1 67 67 PHE CD1 C 13 131.618 0.300 . 1 . . . . A 171 PHE CD1 . 36058 1 789 . 1 1 67 67 PHE CD2 C 13 131.618 0.300 . 1 . . . . A 171 PHE CD2 . 36058 1 790 . 1 1 68 68 HIS H H 1 8.899 0.030 . 1 . . . . A 172 HIS H . 36058 1 791 . 1 1 68 68 HIS HA H 1 4.534 0.030 . 1 . . . . A 172 HIS HA . 36058 1 792 . 1 1 68 68 HIS HB2 H 1 2.667 0.030 . 2 . . . . A 172 HIS HB2 . 36058 1 793 . 1 1 68 68 HIS HB3 H 1 2.467 0.030 . 2 . . . . A 172 HIS HB3 . 36058 1 794 . 1 1 68 68 HIS HD2 H 1 6.970 0.030 . 1 . . . . A 172 HIS HD2 . 36058 1 795 . 1 1 68 68 HIS HE1 H 1 7.240 0.030 . 1 . . . . A 172 HIS HE1 . 36058 1 796 . 1 1 68 68 HIS C C 13 172.916 0.300 . 1 . . . . A 172 HIS C . 36058 1 797 . 1 1 68 68 HIS CA C 13 55.205 0.300 . 1 . . . . A 172 HIS CA . 36058 1 798 . 1 1 68 68 HIS CB C 13 34.677 0.300 . 1 . . . . A 172 HIS CB . 36058 1 799 . 1 1 68 68 HIS CD2 C 13 118.290 0.300 . 1 . . . . A 172 HIS CD2 . 36058 1 800 . 1 1 68 68 HIS CE1 C 13 135.687 0.300 . 1 . . . . A 172 HIS CE1 . 36058 1 801 . 1 1 68 68 HIS N N 15 122.648 0.300 . 1 . . . . A 172 HIS N . 36058 1 802 . 1 1 69 69 GLU H H 1 8.649 0.030 . 1 . . . . A 173 GLU H . 36058 1 803 . 1 1 69 69 GLU HA H 1 3.715 0.030 . 1 . . . . A 173 GLU HA . 36058 1 804 . 1 1 69 69 GLU HB2 H 1 1.917 0.030 . 2 . . . . A 173 GLU HB2 . 36058 1 805 . 1 1 69 69 GLU HB3 H 1 1.737 0.030 . 2 . . . . A 173 GLU HB3 . 36058 1 806 . 1 1 69 69 GLU C C 13 174.360 0.300 . 1 . . . . A 173 GLU C . 36058 1 807 . 1 1 69 69 GLU CA C 13 55.444 0.300 . 1 . . . . A 173 GLU CA . 36058 1 808 . 1 1 69 69 GLU CB C 13 31.118 0.300 . 1 . . . . A 173 GLU CB . 36058 1 809 . 1 1 69 69 GLU CG C 13 36.925 0.300 . 1 . . . . A 173 GLU CG . 36058 1 810 . 1 1 69 69 GLU N N 15 124.809 0.300 . 1 . . . . A 173 GLU N . 36058 1 811 . 1 1 70 70 ILE H H 1 8.278 0.030 . 1 . . . . A 174 ILE H . 36058 1 812 . 1 1 70 70 ILE HA H 1 3.913 0.030 . 1 . . . . A 174 ILE HA . 36058 1 813 . 1 1 70 70 ILE HB H 1 1.349 0.030 . 1 . . . . A 174 ILE HB . 36058 1 814 . 1 1 70 70 ILE HG12 H 1 0.680 0.030 . 2 . . . . A 174 ILE HG12 . 36058 1 815 . 1 1 70 70 ILE HG13 H 1 -0.270 0.030 . 2 . . . . A 174 ILE HG13 . 36058 1 816 . 1 1 70 70 ILE HG21 H 1 0.503 0.030 . 1 . . . . A 174 ILE HG21 . 36058 1 817 . 1 1 70 70 ILE HG22 H 1 0.503 0.030 . 1 . . . . A 174 ILE HG22 . 36058 1 818 . 1 1 70 70 ILE HG23 H 1 0.503 0.030 . 1 . . . . A 174 ILE HG23 . 36058 1 819 . 1 1 70 70 ILE HD11 H 1 0.298 0.030 . 1 . . . . A 174 ILE HD11 . 36058 1 820 . 1 1 70 70 ILE HD12 H 1 0.298 0.030 . 1 . . . . A 174 ILE HD12 . 36058 1 821 . 1 1 70 70 ILE HD13 H 1 0.298 0.030 . 1 . . . . A 174 ILE HD13 . 36058 1 822 . 1 1 70 70 ILE C C 13 176.302 0.300 . 1 . . . . A 174 ILE C . 36058 1 823 . 1 1 70 70 ILE CA C 13 60.909 0.300 . 1 . . . . A 174 ILE CA . 36058 1 824 . 1 1 70 70 ILE CB C 13 39.781 0.300 . 1 . . . . A 174 ILE CB . 36058 1 825 . 1 1 70 70 ILE CG1 C 13 25.429 0.300 . 1 . . . . A 174 ILE CG1 . 36058 1 826 . 1 1 70 70 ILE CG2 C 13 16.379 0.300 . 1 . . . . A 174 ILE CG2 . 36058 1 827 . 1 1 70 70 ILE CD1 C 13 14.527 0.300 . 1 . . . . A 174 ILE CD1 . 36058 1 828 . 1 1 70 70 ILE N N 15 123.620 0.300 . 1 . . . . A 174 ILE N . 36058 1 829 . 1 1 71 71 ASN H H 1 9.458 0.030 . 1 . . . . A 175 ASN H . 36058 1 830 . 1 1 71 71 ASN HA H 1 4.224 0.030 . 1 . . . . A 175 ASN HA . 36058 1 831 . 1 1 71 71 ASN HB2 H 1 2.950 0.030 . 2 . . . . A 175 ASN HB2 . 36058 1 832 . 1 1 71 71 ASN HB3 H 1 2.525 0.030 . 2 . . . . A 175 ASN HB3 . 36058 1 833 . 1 1 71 71 ASN HD21 H 1 7.224 0.030 . 2 . . . . A 175 ASN HD21 . 36058 1 834 . 1 1 71 71 ASN HD22 H 1 6.963 0.030 . 2 . . . . A 175 ASN HD22 . 36058 1 835 . 1 1 71 71 ASN C C 13 174.511 0.300 . 1 . . . . A 175 ASN C . 36058 1 836 . 1 1 71 71 ASN CA C 13 54.506 0.300 . 1 . . . . A 175 ASN CA . 36058 1 837 . 1 1 71 71 ASN CB C 13 36.880 0.300 . 1 . . . . A 175 ASN CB . 36058 1 838 . 1 1 71 71 ASN N N 15 127.156 0.300 . 1 . . . . A 175 ASN N . 36058 1 839 . 1 1 71 71 ASN ND2 N 15 112.381 0.300 . 1 . . . . A 175 ASN ND2 . 36058 1 840 . 1 1 72 72 ASN H H 1 8.933 0.030 . 1 . . . . A 176 ASN H . 36058 1 841 . 1 1 72 72 ASN HA H 1 4.172 0.030 . 1 . . . . A 176 ASN HA . 36058 1 842 . 1 1 72 72 ASN HB2 H 1 3.009 0.030 . 2 . . . . A 176 ASN HB2 . 36058 1 843 . 1 1 72 72 ASN HB3 H 1 2.861 0.030 . 2 . . . . A 176 ASN HB3 . 36058 1 844 . 1 1 72 72 ASN HD21 H 1 7.463 0.030 . 2 . . . . A 176 ASN HD21 . 36058 1 845 . 1 1 72 72 ASN HD22 H 1 6.800 0.030 . 2 . . . . A 176 ASN HD22 . 36058 1 846 . 1 1 72 72 ASN C C 13 172.995 0.300 . 1 . . . . A 176 ASN C . 36058 1 847 . 1 1 72 72 ASN CA C 13 54.917 0.300 . 1 . . . . A 176 ASN CA . 36058 1 848 . 1 1 72 72 ASN CB C 13 37.556 0.300 . 1 . . . . A 176 ASN CB . 36058 1 849 . 1 1 72 72 ASN N N 15 107.992 0.300 . 1 . . . . A 176 ASN N . 36058 1 850 . 1 1 72 72 ASN ND2 N 15 112.317 0.300 . 1 . . . . A 176 ASN ND2 . 36058 1 851 . 1 1 73 73 LYS H H 1 7.459 0.030 . 1 . . . . A 177 LYS H . 36058 1 852 . 1 1 73 73 LYS HA H 1 4.583 0.030 . 1 . . . . A 177 LYS HA . 36058 1 853 . 1 1 73 73 LYS HB2 H 1 1.901 0.030 . 2 . . . . A 177 LYS HB2 . 36058 1 854 . 1 1 73 73 LYS HB3 H 1 1.622 0.030 . 2 . . . . A 177 LYS HB3 . 36058 1 855 . 1 1 73 73 LYS HG2 H 1 1.389 0.030 . 2 . . . . A 177 LYS HG2 . 36058 1 856 . 1 1 73 73 LYS HG3 H 1 1.538 0.030 . 2 . . . . A 177 LYS HG3 . 36058 1 857 . 1 1 73 73 LYS C C 13 174.082 0.300 . 1 . . . . A 177 LYS C . 36058 1 858 . 1 1 73 73 LYS CA C 13 54.136 0.300 . 1 . . . . A 177 LYS CA . 36058 1 859 . 1 1 73 73 LYS CB C 13 35.372 0.300 . 1 . . . . A 177 LYS CB . 36058 1 860 . 1 1 73 73 LYS CG C 13 24.476 0.300 . 1 . . . . A 177 LYS CG . 36058 1 861 . 1 1 73 73 LYS CD C 13 29.159 0.300 . 1 . . . . A 177 LYS CD . 36058 1 862 . 1 1 73 73 LYS CE C 13 42.657 0.300 . 1 . . . . A 177 LYS CE . 36058 1 863 . 1 1 73 73 LYS N N 15 120.312 0.300 . 1 . . . . A 177 LYS N . 36058 1 864 . 1 1 74 74 MET H H 1 8.426 0.030 . 1 . . . . A 178 MET H . 36058 1 865 . 1 1 74 74 MET HA H 1 4.853 0.030 . 1 . . . . A 178 MET HA . 36058 1 866 . 1 1 74 74 MET HB2 H 1 1.864 0.030 . 2 . . . . A 178 MET HB2 . 36058 1 867 . 1 1 74 74 MET HB3 H 1 2.002 0.030 . 2 . . . . A 178 MET HB3 . 36058 1 868 . 1 1 74 74 MET HG2 H 1 2.535 0.030 . 2 . . . . A 178 MET HG2 . 36058 1 869 . 1 1 74 74 MET HG3 H 1 2.488 0.030 . 2 . . . . A 178 MET HG3 . 36058 1 870 . 1 1 74 74 MET HE1 H 1 1.873 0.030 . 1 . . . . A 178 MET HE1 . 36058 1 871 . 1 1 74 74 MET HE2 H 1 1.873 0.030 . 1 . . . . A 178 MET HE2 . 36058 1 872 . 1 1 74 74 MET HE3 H 1 1.873 0.030 . 1 . . . . A 178 MET HE3 . 36058 1 873 . 1 1 74 74 MET C C 13 175.897 0.300 . 1 . . . . A 178 MET C . 36058 1 874 . 1 1 74 74 MET CA C 13 54.712 0.300 . 1 . . . . A 178 MET CA . 36058 1 875 . 1 1 74 74 MET CB C 13 31.385 0.300 . 1 . . . . A 178 MET CB . 36058 1 876 . 1 1 74 74 MET CG C 13 31.590 0.300 . 1 . . . . A 178 MET CG . 36058 1 877 . 1 1 74 74 MET CE C 13 16.251 0.300 . 1 . . . . A 178 MET CE . 36058 1 878 . 1 1 74 74 MET N N 15 123.702 0.300 . 1 . . . . A 178 MET N . 36058 1 879 . 1 1 75 75 VAL H H 1 9.442 0.030 . 1 . . . . A 179 VAL H . 36058 1 880 . 1 1 75 75 VAL HA H 1 4.868 0.030 . 1 . . . . A 179 VAL HA . 36058 1 881 . 1 1 75 75 VAL HB H 1 2.275 0.030 . 1 . . . . A 179 VAL HB . 36058 1 882 . 1 1 75 75 VAL HG11 H 1 0.747 0.030 . 2 . . . . A 179 VAL HG11 . 36058 1 883 . 1 1 75 75 VAL HG12 H 1 0.747 0.030 . 2 . . . . A 179 VAL HG12 . 36058 1 884 . 1 1 75 75 VAL HG13 H 1 0.747 0.030 . 2 . . . . A 179 VAL HG13 . 36058 1 885 . 1 1 75 75 VAL HG21 H 1 0.698 0.030 . 2 . . . . A 179 VAL HG21 . 36058 1 886 . 1 1 75 75 VAL HG22 H 1 0.698 0.030 . 2 . . . . A 179 VAL HG22 . 36058 1 887 . 1 1 75 75 VAL HG23 H 1 0.698 0.030 . 2 . . . . A 179 VAL HG23 . 36058 1 888 . 1 1 75 75 VAL C C 13 174.332 0.300 . 1 . . . . A 179 VAL C . 36058 1 889 . 1 1 75 75 VAL CA C 13 59.895 0.300 . 1 . . . . A 179 VAL CA . 36058 1 890 . 1 1 75 75 VAL CB C 13 32.784 0.300 . 1 . . . . A 179 VAL CB . 36058 1 891 . 1 1 75 75 VAL CG1 C 13 21.297 0.300 . 2 . . . . A 179 VAL CG1 . 36058 1 892 . 1 1 75 75 VAL CG2 C 13 21.231 0.300 . 2 . . . . A 179 VAL CG2 . 36058 1 893 . 1 1 75 75 VAL N N 15 124.593 0.300 . 1 . . . . A 179 VAL N . 36058 1 894 . 1 1 76 76 GLU H H 1 8.663 0.030 . 1 . . . . A 180 GLU H . 36058 1 895 . 1 1 76 76 GLU HA H 1 4.873 0.030 . 1 . . . . A 180 GLU HA . 36058 1 896 . 1 1 76 76 GLU HB2 H 1 2.027 0.030 . 2 . . . . A 180 GLU HB2 . 36058 1 897 . 1 1 76 76 GLU HB3 H 1 1.869 0.030 . 2 . . . . A 180 GLU HB3 . 36058 1 898 . 1 1 76 76 GLU HG2 H 1 2.026 0.030 . 2 . . . . A 180 GLU HG2 . 36058 1 899 . 1 1 76 76 GLU HG3 H 1 1.878 0.030 . 2 . . . . A 180 GLU HG3 . 36058 1 900 . 1 1 76 76 GLU C C 13 175.677 0.300 . 1 . . . . A 180 GLU C . 36058 1 901 . 1 1 76 76 GLU CA C 13 54.835 0.300 . 1 . . . . A 180 GLU CA . 36058 1 902 . 1 1 76 76 GLU CB C 13 32.788 0.300 . 1 . . . . A 180 GLU CB . 36058 1 903 . 1 1 76 76 GLU CG C 13 36.940 0.300 . 1 . . . . A 180 GLU CG . 36058 1 904 . 1 1 76 76 GLU N N 15 122.279 0.300 . 1 . . . . A 180 GLU N . 36058 1 905 . 1 1 77 77 CYS H H 1 8.859 0.030 . 1 . . . . A 181 CYS H . 36058 1 906 . 1 1 77 77 CYS HA H 1 5.853 0.030 . 1 . . . . A 181 CYS HA . 36058 1 907 . 1 1 77 77 CYS HB2 H 1 2.620 0.030 . 2 . . . . A 181 CYS HB2 . 36058 1 908 . 1 1 77 77 CYS HB3 H 1 2.820 0.030 . 2 . . . . A 181 CYS HB3 . 36058 1 909 . 1 1 77 77 CYS C C 13 173.779 0.300 . 1 . . . . A 181 CYS C . 36058 1 910 . 1 1 77 77 CYS CA C 13 56.974 0.300 . 1 . . . . A 181 CYS CA . 36058 1 911 . 1 1 77 77 CYS CB C 13 31.021 0.300 . 1 . . . . A 181 CYS CB . 36058 1 912 . 1 1 77 77 CYS N N 15 121.916 0.300 . 1 . . . . A 181 CYS N . 36058 1 913 . 1 1 78 78 LYS H H 1 8.960 0.030 . 1 . . . . A 182 LYS H . 36058 1 914 . 1 1 78 78 LYS HA H 1 4.695 0.030 . 1 . . . . A 182 LYS HA . 36058 1 915 . 1 1 78 78 LYS HB2 H 1 1.950 0.030 . 2 . . . . A 182 LYS HB2 . 36058 1 916 . 1 1 78 78 LYS HB3 H 1 1.687 0.030 . 2 . . . . A 182 LYS HB3 . 36058 1 917 . 1 1 78 78 LYS HG2 H 1 1.394 0.030 . 2 . . . . A 182 LYS HG2 . 36058 1 918 . 1 1 78 78 LYS HG3 H 1 1.267 0.030 . 2 . . . . A 182 LYS HG3 . 36058 1 919 . 1 1 78 78 LYS HD2 H 1 1.502 0.030 . 1 . . . . A 182 LYS HD2 . 36058 1 920 . 1 1 78 78 LYS HD3 H 1 1.502 0.030 . 1 . . . . A 182 LYS HD3 . 36058 1 921 . 1 1 78 78 LYS HE2 H 1 2.649 0.030 . 1 . . . . A 182 LYS HE2 . 36058 1 922 . 1 1 78 78 LYS HE3 H 1 2.649 0.030 . 1 . . . . A 182 LYS HE3 . 36058 1 923 . 1 1 78 78 LYS C C 13 174.721 0.300 . 1 . . . . A 182 LYS C . 36058 1 924 . 1 1 78 78 LYS CA C 13 54.876 0.300 . 1 . . . . A 182 LYS CA . 36058 1 925 . 1 1 78 78 LYS CB C 13 36.610 0.300 . 1 . . . . A 182 LYS CB . 36058 1 926 . 1 1 78 78 LYS CG C 13 24.375 0.300 . 1 . . . . A 182 LYS CG . 36058 1 927 . 1 1 78 78 LYS CD C 13 29.359 0.300 . 1 . . . . A 182 LYS CD . 36058 1 928 . 1 1 78 78 LYS CE C 13 41.844 0.300 . 1 . . . . A 182 LYS CE . 36058 1 929 . 1 1 78 78 LYS N N 15 119.847 0.300 . 1 . . . . A 182 LYS N . 36058 1 930 . 1 1 79 79 LYS H H 1 8.792 0.030 . 1 . . . . A 183 LYS H . 36058 1 931 . 1 1 79 79 LYS HA H 1 4.045 0.030 . 1 . . . . A 183 LYS HA . 36058 1 932 . 1 1 79 79 LYS HB2 H 1 1.873 0.030 . 2 . . . . A 183 LYS HB2 . 36058 1 933 . 1 1 79 79 LYS HB3 H 1 1.692 0.030 . 2 . . . . A 183 LYS HB3 . 36058 1 934 . 1 1 79 79 LYS C C 13 176.658 0.300 . 1 . . . . A 183 LYS C . 36058 1 935 . 1 1 79 79 LYS CA C 13 58.702 0.300 . 1 . . . . A 183 LYS CA . 36058 1 936 . 1 1 79 79 LYS CB C 13 32.742 0.300 . 1 . . . . A 183 LYS CB . 36058 1 937 . 1 1 79 79 LYS CG C 13 26.795 0.300 . 1 . . . . A 183 LYS CG . 36058 1 938 . 1 1 79 79 LYS CD C 13 29.688 0.300 . 1 . . . . A 183 LYS CD . 36058 1 939 . 1 1 79 79 LYS CE C 13 42.031 0.300 . 1 . . . . A 183 LYS CE . 36058 1 940 . 1 1 79 79 LYS N N 15 122.554 0.300 . 1 . . . . A 183 LYS N . 36058 1 941 . 1 1 80 80 ALA H H 1 8.047 0.030 . 1 . . . . A 184 ALA H . 36058 1 942 . 1 1 80 80 ALA HA H 1 4.428 0.030 . 1 . . . . A 184 ALA HA . 36058 1 943 . 1 1 80 80 ALA HB1 H 1 1.342 0.030 . 1 . . . . A 184 ALA HB1 . 36058 1 944 . 1 1 80 80 ALA HB2 H 1 1.342 0.030 . 1 . . . . A 184 ALA HB2 . 36058 1 945 . 1 1 80 80 ALA HB3 H 1 1.342 0.030 . 1 . . . . A 184 ALA HB3 . 36058 1 946 . 1 1 80 80 ALA C C 13 176.243 0.300 . 1 . . . . A 184 ALA C . 36058 1 947 . 1 1 80 80 ALA CA C 13 52.120 0.300 . 1 . . . . A 184 ALA CA . 36058 1 948 . 1 1 80 80 ALA CB C 13 19.503 0.300 . 1 . . . . A 184 ALA CB . 36058 1 949 . 1 1 80 80 ALA N N 15 125.116 0.300 . 1 . . . . A 184 ALA N . 36058 1 950 . 1 1 81 81 GLN H H 1 8.499 0.030 . 1 . . . . A 185 GLN H . 36058 1 951 . 1 1 81 81 GLN HA H 1 4.481 0.030 . 1 . . . . A 185 GLN HA . 36058 1 952 . 1 1 81 81 GLN HB2 H 1 1.806 0.030 . 1 . . . . A 185 GLN HB2 . 36058 1 953 . 1 1 81 81 GLN HB3 H 1 1.806 0.030 . 1 . . . . A 185 GLN HB3 . 36058 1 954 . 1 1 81 81 GLN HG2 H 1 2.301 0.030 . 1 . . . . A 185 GLN HG2 . 36058 1 955 . 1 1 81 81 GLN HG3 H 1 2.301 0.030 . 1 . . . . A 185 GLN HG3 . 36058 1 956 . 1 1 81 81 GLN HE21 H 1 7.479 0.030 . 2 . . . . A 185 GLN HE21 . 36058 1 957 . 1 1 81 81 GLN HE22 H 1 6.798 0.030 . 2 . . . . A 185 GLN HE22 . 36058 1 958 . 1 1 81 81 GLN C C 13 174.148 0.300 . 1 . . . . A 185 GLN C . 36058 1 959 . 1 1 81 81 GLN CA C 13 53.436 0.300 . 1 . . . . A 185 GLN CA . 36058 1 960 . 1 1 81 81 GLN CB C 13 29.081 0.300 . 1 . . . . A 185 GLN CB . 36058 1 961 . 1 1 81 81 GLN CG C 13 33.471 0.300 . 1 . . . . A 185 GLN CG . 36058 1 962 . 1 1 81 81 GLN N N 15 120.804 0.300 . 1 . . . . A 185 GLN N . 36058 1 963 . 1 1 81 81 GLN NE2 N 15 112.241 0.300 . 1 . . . . A 185 GLN NE2 . 36058 1 964 . 1 1 82 82 PRO HA H 1 4.235 0.030 . 1 . . . . A 186 PRO HA . 36058 1 965 . 1 1 82 82 PRO HB2 H 1 2.139 0.030 . 2 . . . . A 186 PRO HB2 . 36058 1 966 . 1 1 82 82 PRO HB3 H 1 1.839 0.030 . 2 . . . . A 186 PRO HB3 . 36058 1 967 . 1 1 82 82 PRO HG2 H 1 1.923 0.030 . 2 . . . . A 186 PRO HG2 . 36058 1 968 . 1 1 82 82 PRO HG3 H 1 1.796 0.030 . 2 . . . . A 186 PRO HG3 . 36058 1 969 . 1 1 82 82 PRO HD2 H 1 3.544 0.030 . 1 . . . . A 186 PRO HD2 . 36058 1 970 . 1 1 82 82 PRO HD3 H 1 3.544 0.030 . 1 . . . . A 186 PRO HD3 . 36058 1 971 . 1 1 82 82 PRO C C 13 176.773 0.300 . 1 . . . . A 186 PRO C . 36058 1 972 . 1 1 82 82 PRO CA C 13 63.470 0.300 . 1 . . . . A 186 PRO CA . 36058 1 973 . 1 1 82 82 PRO CB C 13 32.038 0.300 . 1 . . . . A 186 PRO CB . 36058 1 974 . 1 1 82 82 PRO CG C 13 27.292 0.300 . 1 . . . . A 186 PRO CG . 36058 1 975 . 1 1 82 82 PRO CD C 13 50.464 0.300 . 1 . . . . A 186 PRO CD . 36058 1 976 . 1 1 83 83 LYS H H 1 8.238 0.030 . 1 . . . . A 187 LYS H . 36058 1 977 . 1 1 83 83 LYS HA H 1 4.152 0.030 . 1 . . . . A 187 LYS HA . 36058 1 978 . 1 1 83 83 LYS HB2 H 1 1.735 0.030 . 1 . . . . A 187 LYS HB2 . 36058 1 979 . 1 1 83 83 LYS HB3 H 1 1.735 0.030 . 1 . . . . A 187 LYS HB3 . 36058 1 980 . 1 1 83 83 LYS C C 13 176.668 0.300 . 1 . . . . A 187 LYS C . 36058 1 981 . 1 1 83 83 LYS CA C 13 56.687 0.300 . 1 . . . . A 187 LYS CA . 36058 1 982 . 1 1 83 83 LYS CB C 13 32.701 0.300 . 1 . . . . A 187 LYS CB . 36058 1 983 . 1 1 83 83 LYS CG C 13 24.723 0.300 . 1 . . . . A 187 LYS CG . 36058 1 984 . 1 1 83 83 LYS CD C 13 29.249 0.300 . 1 . . . . A 187 LYS CD . 36058 1 985 . 1 1 83 83 LYS CE C 13 42.080 0.300 . 1 . . . . A 187 LYS CE . 36058 1 986 . 1 1 83 83 LYS N N 15 120.152 0.300 . 1 . . . . A 187 LYS N . 36058 1 987 . 1 1 84 84 GLU H H 1 8.296 0.030 . 1 . . . . A 188 GLU H . 36058 1 988 . 1 1 84 84 GLU HA H 1 4.218 0.030 . 1 . . . . A 188 GLU HA . 36058 1 989 . 1 1 84 84 GLU HB2 H 1 1.931 0.030 . 1 . . . . A 188 GLU HB2 . 36058 1 990 . 1 1 84 84 GLU HB3 H 1 1.931 0.030 . 1 . . . . A 188 GLU HB3 . 36058 1 991 . 1 1 84 84 GLU HG2 H 1 2.184 0.030 . 1 . . . . A 188 GLU HG2 . 36058 1 992 . 1 1 84 84 GLU HG3 H 1 2.184 0.030 . 1 . . . . A 188 GLU HG3 . 36058 1 993 . 1 1 84 84 GLU C C 13 176.257 0.300 . 1 . . . . A 188 GLU C . 36058 1 994 . 1 1 84 84 GLU CA C 13 56.645 0.300 . 1 . . . . A 188 GLU CA . 36058 1 995 . 1 1 84 84 GLU CB C 13 30.151 0.300 . 1 . . . . A 188 GLU CB . 36058 1 996 . 1 1 84 84 GLU CG C 13 36.291 0.300 . 1 . . . . A 188 GLU CG . 36058 1 997 . 1 1 84 84 GLU N N 15 121.526 0.300 . 1 . . . . A 188 GLU N . 36058 1 998 . 1 1 85 85 VAL H H 1 8.036 0.030 . 1 . . . . A 189 VAL H . 36058 1 999 . 1 1 85 85 VAL HA H 1 4.009 0.030 . 1 . . . . A 189 VAL HA . 36058 1 1000 . 1 1 85 85 VAL HB H 1 1.992 0.030 . 1 . . . . A 189 VAL HB . 36058 1 1001 . 1 1 85 85 VAL HG11 H 1 0.850 0.030 . 2 . . . . A 189 VAL HG11 . 36058 1 1002 . 1 1 85 85 VAL HG12 H 1 0.850 0.030 . 2 . . . . A 189 VAL HG12 . 36058 1 1003 . 1 1 85 85 VAL HG13 H 1 0.850 0.030 . 2 . . . . A 189 VAL HG13 . 36058 1 1004 . 1 1 85 85 VAL HG21 H 1 0.822 0.030 . 2 . . . . A 189 VAL HG21 . 36058 1 1005 . 1 1 85 85 VAL HG22 H 1 0.822 0.030 . 2 . . . . A 189 VAL HG22 . 36058 1 1006 . 1 1 85 85 VAL HG23 H 1 0.822 0.030 . 2 . . . . A 189 VAL HG23 . 36058 1 1007 . 1 1 85 85 VAL C C 13 175.913 0.300 . 1 . . . . A 189 VAL C . 36058 1 1008 . 1 1 85 85 VAL CA C 13 62.282 0.300 . 1 . . . . A 189 VAL CA . 36058 1 1009 . 1 1 85 85 VAL CB C 13 32.578 0.300 . 1 . . . . A 189 VAL CB . 36058 1 1010 . 1 1 85 85 VAL CG1 C 13 20.583 0.300 . 2 . . . . A 189 VAL CG1 . 36058 1 1011 . 1 1 85 85 VAL CG2 C 13 21.178 0.300 . 2 . . . . A 189 VAL CG2 . 36058 1 1012 . 1 1 85 85 VAL N N 15 120.740 0.300 . 1 . . . . A 189 VAL N . 36058 1 1013 . 1 1 86 86 MET H H 1 8.278 0.030 . 1 . . . . A 190 MET H . 36058 1 1014 . 1 1 86 86 MET HA H 1 4.462 0.030 . 1 . . . . A 190 MET HA . 36058 1 1015 . 1 1 86 86 MET HB2 H 1 2.007 0.030 . 1 . . . . A 190 MET HB2 . 36058 1 1016 . 1 1 86 86 MET HB3 H 1 2.007 0.030 . 1 . . . . A 190 MET HB3 . 36058 1 1017 . 1 1 86 86 MET C C 13 175.806 0.300 . 1 . . . . A 190 MET C . 36058 1 1018 . 1 1 86 86 MET CA C 13 55.285 0.300 . 1 . . . . A 190 MET CA . 36058 1 1019 . 1 1 86 86 MET CB C 13 32.907 0.300 . 1 . . . . A 190 MET CB . 36058 1 1020 . 1 1 86 86 MET CG C 13 30.110 0.300 . 1 . . . . A 190 MET CG . 36058 1 1021 . 1 1 86 86 MET CE C 13 17.090 0.300 . 1 . . . . A 190 MET CE . 36058 1 1022 . 1 1 86 86 MET N N 15 123.808 0.300 . 1 . . . . A 190 MET N . 36058 1 1023 . 1 1 87 87 SER H H 1 8.299 0.030 . 1 . . . . A 191 SER H . 36058 1 1024 . 1 1 87 87 SER HA H 1 4.741 0.030 . 1 . . . . A 191 SER HA . 36058 1 1025 . 1 1 87 87 SER HB2 H 1 3.810 0.030 . 1 . . . . A 191 SER HB2 . 36058 1 1026 . 1 1 87 87 SER HB3 H 1 3.810 0.030 . 1 . . . . A 191 SER HB3 . 36058 1 1027 . 1 1 87 87 SER CA C 13 56.316 0.300 . 1 . . . . A 191 SER CA . 36058 1 1028 . 1 1 87 87 SER CB C 13 63.474 0.300 . 1 . . . . A 191 SER CB . 36058 1 1029 . 1 1 87 87 SER N N 15 118.469 0.300 . 1 . . . . A 191 SER N . 36058 1 1030 . 1 1 88 88 PRO HA H 1 4.472 0.030 . 1 . . . . A 192 PRO HA . 36058 1 1031 . 1 1 88 88 PRO HB2 H 1 2.290 0.030 . 2 . . . . A 192 PRO HB2 . 36058 1 1032 . 1 1 88 88 PRO HB3 H 1 1.936 0.030 . 2 . . . . A 192 PRO HB3 . 36058 1 1033 . 1 1 88 88 PRO HG2 H 1 2.005 0.030 . 1 . . . . A 192 PRO HG2 . 36058 1 1034 . 1 1 88 88 PRO HG3 H 1 2.005 0.030 . 1 . . . . A 192 PRO HG3 . 36058 1 1035 . 1 1 88 88 PRO HD2 H 1 3.640 0.030 . 2 . . . . A 192 PRO HD2 . 36058 1 1036 . 1 1 88 88 PRO HD3 H 1 3.807 0.030 . 2 . . . . A 192 PRO HD3 . 36058 1 1037 . 1 1 88 88 PRO C C 13 177.300 0.300 . 1 . . . . A 192 PRO C . 36058 1 1038 . 1 1 88 88 PRO CA C 13 63.557 0.300 . 1 . . . . A 192 PRO CA . 36058 1 1039 . 1 1 88 88 PRO CB C 13 32.125 0.300 . 1 . . . . A 192 PRO CB . 36058 1 1040 . 1 1 88 88 PRO CG C 13 27.378 0.300 . 1 . . . . A 192 PRO CG . 36058 1 1041 . 1 1 88 88 PRO CD C 13 51.080 0.300 . 1 . . . . A 192 PRO CD . 36058 1 1042 . 1 1 89 89 THR H H 1 8.143 0.030 . 1 . . . . A 193 THR H . 36058 1 1043 . 1 1 89 89 THR HA H 1 4.320 0.030 . 1 . . . . A 193 THR HA . 36058 1 1044 . 1 1 89 89 THR HB H 1 4.238 0.030 . 1 . . . . A 193 THR HB . 36058 1 1045 . 1 1 89 89 THR HG21 H 1 1.186 0.030 . 1 . . . . A 193 THR HG21 . 36058 1 1046 . 1 1 89 89 THR HG22 H 1 1.186 0.030 . 1 . . . . A 193 THR HG22 . 36058 1 1047 . 1 1 89 89 THR HG23 H 1 1.186 0.030 . 1 . . . . A 193 THR HG23 . 36058 1 1048 . 1 1 89 89 THR C C 13 176.303 0.300 . 1 . . . . A 193 THR C . 36058 1 1049 . 1 1 89 89 THR CA C 13 61.952 0.300 . 1 . . . . A 193 THR CA . 36058 1 1050 . 1 1 89 89 THR CB C 13 69.810 0.300 . 1 . . . . A 193 THR CB . 36058 1 1051 . 1 1 89 89 THR CG2 C 13 21.584 0.300 . 1 . . . . A 193 THR CG2 . 36058 1 1052 . 1 1 89 89 THR N N 15 113.036 0.300 . 1 . . . . A 193 THR N . 36058 1 1053 . 1 1 90 90 GLY H H 1 8.307 0.030 . 1 . . . . A 194 GLY H . 36058 1 1054 . 1 1 90 90 GLY HA2 H 1 3.972 0.030 . 1 . . . . A 194 GLY HA2 . 36058 1 1055 . 1 1 90 90 GLY HA3 H 1 3.972 0.030 . 1 . . . . A 194 GLY HA3 . 36058 1 1056 . 1 1 90 90 GLY C C 13 174.246 0.300 . 1 . . . . A 194 GLY C . 36058 1 1057 . 1 1 90 90 GLY CA C 13 45.496 0.300 . 1 . . . . A 194 GLY CA . 36058 1 1058 . 1 1 90 90 GLY N N 15 111.128 0.300 . 1 . . . . A 194 GLY N . 36058 1 1059 . 1 1 91 91 SER H H 1 8.178 0.030 . 1 . . . . A 195 SER H . 36058 1 1060 . 1 1 91 91 SER HA H 1 4.424 0.030 . 1 . . . . A 195 SER HA . 36058 1 1061 . 1 1 91 91 SER HB2 H 1 3.831 0.030 . 1 . . . . A 195 SER HB2 . 36058 1 1062 . 1 1 91 91 SER HB3 H 1 3.831 0.030 . 1 . . . . A 195 SER HB3 . 36058 1 1063 . 1 1 91 91 SER C C 13 174.356 0.300 . 1 . . . . A 195 SER C . 36058 1 1064 . 1 1 91 91 SER CA C 13 58.373 0.300 . 1 . . . . A 195 SER CA . 36058 1 1065 . 1 1 91 91 SER CB C 13 64.174 0.300 . 1 . . . . A 195 SER CB . 36058 1 1066 . 1 1 91 91 SER N N 15 115.708 0.300 . 1 . . . . A 195 SER N . 36058 1 1067 . 1 1 92 92 ALA H H 1 8.343 0.030 . 1 . . . . A 196 ALA H . 36058 1 1068 . 1 1 92 92 ALA HA H 1 4.316 0.030 . 1 . . . . A 196 ALA HA . 36058 1 1069 . 1 1 92 92 ALA HB1 H 1 1.366 0.030 . 1 . . . . A 196 ALA HB1 . 36058 1 1070 . 1 1 92 92 ALA HB2 H 1 1.366 0.030 . 1 . . . . A 196 ALA HB2 . 36058 1 1071 . 1 1 92 92 ALA HB3 H 1 1.366 0.030 . 1 . . . . A 196 ALA HB3 . 36058 1 1072 . 1 1 92 92 ALA C C 13 177.698 0.300 . 1 . . . . A 196 ALA C . 36058 1 1073 . 1 1 92 92 ALA CA C 13 52.819 0.300 . 1 . . . . A 196 ALA CA . 36058 1 1074 . 1 1 92 92 ALA CB C 13 19.125 0.300 . 1 . . . . A 196 ALA CB . 36058 1 1075 . 1 1 92 92 ALA N N 15 125.968 0.300 . 1 . . . . A 196 ALA N . 36058 1 1076 . 1 1 93 93 ARG H H 1 8.238 0.030 . 1 . . . . A 197 ARG H . 36058 1 1077 . 1 1 93 93 ARG HA H 1 4.272 0.030 . 1 . . . . A 197 ARG HA . 36058 1 1078 . 1 1 93 93 ARG HB2 H 1 1.846 0.030 . 2 . . . . A 197 ARG HB2 . 36058 1 1079 . 1 1 93 93 ARG HB3 H 1 1.743 0.030 . 2 . . . . A 197 ARG HB3 . 36058 1 1080 . 1 1 93 93 ARG HG2 H 1 1.614 0.030 . 1 . . . . A 197 ARG HG2 . 36058 1 1081 . 1 1 93 93 ARG HG3 H 1 1.614 0.030 . 1 . . . . A 197 ARG HG3 . 36058 1 1082 . 1 1 93 93 ARG C C 13 176.849 0.300 . 1 . . . . A 197 ARG C . 36058 1 1083 . 1 1 93 93 ARG CA C 13 56.481 0.300 . 1 . . . . A 197 ARG CA . 36058 1 1084 . 1 1 93 93 ARG CB C 13 30.727 0.300 . 1 . . . . A 197 ARG CB . 36058 1 1085 . 1 1 93 93 ARG CG C 13 26.930 0.300 . 1 . . . . A 197 ARG CG . 36058 1 1086 . 1 1 93 93 ARG CD C 13 43.561 0.300 . 1 . . . . A 197 ARG CD . 36058 1 1087 . 1 1 93 93 ARG N N 15 120.189 0.300 . 1 . . . . A 197 ARG N . 36058 1 1088 . 1 1 94 94 GLY H H 1 8.356 0.030 . 1 . . . . A 198 GLY H . 36058 1 1089 . 1 1 94 94 GLY HA2 H 1 3.931 0.030 . 1 . . . . A 198 GLY HA2 . 36058 1 1090 . 1 1 94 94 GLY HA3 H 1 3.931 0.030 . 1 . . . . A 198 GLY HA3 . 36058 1 1091 . 1 1 94 94 GLY C C 13 173.844 0.300 . 1 . . . . A 198 GLY C . 36058 1 1092 . 1 1 94 94 GLY CA C 13 45.331 0.300 . 1 . . . . A 198 GLY CA . 36058 1 1093 . 1 1 94 94 GLY N N 15 110.047 0.300 . 1 . . . . A 198 GLY N . 36058 1 1094 . 1 1 95 95 ARG C C 13 175.583 0.300 . 1 . . . . A 199 ARG C . 36058 1 stop_ save_