data_30518 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 30518 _Entry.Title ; Lim5 domain of PINCH1 protein ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2018-09-19 _Entry.Accession_date 2018-09-19 _Entry.Last_release_date 2018-10-01 _Entry.Original_release_date 2018-10-01 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.0.16 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype SOLUTION _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_experimental_methods.ID _Entry_experimental_methods.Method _Entry_experimental_methods.Subtype _Entry_experimental_methods.Entry_ID 1 'SOLUTION NMR' 'SOLUTION NMR' 30518 stop_ 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 J. Qin J. . . . 30518 2 J. Vaynberg J. . . . 30518 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'Lim domain' . 30518 'SIGNALING PROTEIN' . 30518 'Zn binding' . 30518 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 30518 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 240 30518 '15N chemical shifts' 76 30518 '1H chemical shifts' 481 30518 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 . . 2018-10-26 . original BMRB . 30518 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 6MIF . 30518 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 30518 _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 ; Lim5 domain of PINCH1 protein ; _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 J. Qin J. . . . 30518 1 2 J. Vaynberg J. . . . 30518 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 30518 _Assembly.ID 1 _Assembly.Name 'LIM and senescent cell antigen-like-containing domain protein 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 . . . . . . 30518 1 2 'entity_2, 1' 2 $entity_ZN B A no . . . . . . 30518 1 3 'entity_2, 2' 2 $entity_ZN C A no . . . . . . 30518 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 30518 _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 ; GSGDVCFHCNRVIEGDVVSA LNKAWCVNCFACSTCNTKLT LKNKFVEFDMKPVCKKCYEK FPLELKKRLKKLAETLGRK ; _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 79 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state . _Entity.Src_method man _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 8994.751 _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 PINCH-1 na 30518 1 'Particularly interesting new Cys-His protein 1' na 30518 1 'Renal carcinoma antigen NY-REN-48' na 30518 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 1 247 GLY . 30518 1 2 248 SER . 30518 1 3 249 GLY . 30518 1 4 250 ASP . 30518 1 5 251 VAL . 30518 1 6 252 CYS . 30518 1 7 253 PHE . 30518 1 8 254 HIS . 30518 1 9 255 CYS . 30518 1 10 256 ASN . 30518 1 11 257 ARG . 30518 1 12 258 VAL . 30518 1 13 259 ILE . 30518 1 14 260 GLU . 30518 1 15 261 GLY . 30518 1 16 262 ASP . 30518 1 17 263 VAL . 30518 1 18 264 VAL . 30518 1 19 265 SER . 30518 1 20 266 ALA . 30518 1 21 267 LEU . 30518 1 22 268 ASN . 30518 1 23 269 LYS . 30518 1 24 270 ALA . 30518 1 25 271 TRP . 30518 1 26 272 CYS . 30518 1 27 273 VAL . 30518 1 28 274 ASN . 30518 1 29 275 CYS . 30518 1 30 276 PHE . 30518 1 31 277 ALA . 30518 1 32 278 CYS . 30518 1 33 279 SER . 30518 1 34 280 THR . 30518 1 35 281 CYS . 30518 1 36 282 ASN . 30518 1 37 283 THR . 30518 1 38 284 LYS . 30518 1 39 285 LEU . 30518 1 40 286 THR . 30518 1 41 287 LEU . 30518 1 42 288 LYS . 30518 1 43 289 ASN . 30518 1 44 290 LYS . 30518 1 45 291 PHE . 30518 1 46 292 VAL . 30518 1 47 293 GLU . 30518 1 48 294 PHE . 30518 1 49 295 ASP . 30518 1 50 296 MET . 30518 1 51 297 LYS . 30518 1 52 298 PRO . 30518 1 53 299 VAL . 30518 1 54 300 CYS . 30518 1 55 301 LYS . 30518 1 56 302 LYS . 30518 1 57 303 CYS . 30518 1 58 304 TYR . 30518 1 59 305 GLU . 30518 1 60 306 LYS . 30518 1 61 307 PHE . 30518 1 62 308 PRO . 30518 1 63 309 LEU . 30518 1 64 310 GLU . 30518 1 65 311 LEU . 30518 1 66 312 LYS . 30518 1 67 313 LYS . 30518 1 68 314 ARG . 30518 1 69 315 LEU . 30518 1 70 316 LYS . 30518 1 71 317 LYS . 30518 1 72 318 LEU . 30518 1 73 319 ALA . 30518 1 74 320 GLU . 30518 1 75 321 THR . 30518 1 76 322 LEU . 30518 1 77 323 GLY . 30518 1 78 324 ARG . 30518 1 79 325 LYS . 30518 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 30518 1 . SER 2 2 30518 1 . GLY 3 3 30518 1 . ASP 4 4 30518 1 . VAL 5 5 30518 1 . CYS 6 6 30518 1 . PHE 7 7 30518 1 . HIS 8 8 30518 1 . CYS 9 9 30518 1 . ASN 10 10 30518 1 . ARG 11 11 30518 1 . VAL 12 12 30518 1 . ILE 13 13 30518 1 . GLU 14 14 30518 1 . GLY 15 15 30518 1 . ASP 16 16 30518 1 . VAL 17 17 30518 1 . VAL 18 18 30518 1 . SER 19 19 30518 1 . ALA 20 20 30518 1 . LEU 21 21 30518 1 . ASN 22 22 30518 1 . LYS 23 23 30518 1 . ALA 24 24 30518 1 . TRP 25 25 30518 1 . CYS 26 26 30518 1 . VAL 27 27 30518 1 . ASN 28 28 30518 1 . CYS 29 29 30518 1 . PHE 30 30 30518 1 . ALA 31 31 30518 1 . CYS 32 32 30518 1 . SER 33 33 30518 1 . THR 34 34 30518 1 . CYS 35 35 30518 1 . ASN 36 36 30518 1 . THR 37 37 30518 1 . LYS 38 38 30518 1 . LEU 39 39 30518 1 . THR 40 40 30518 1 . LEU 41 41 30518 1 . LYS 42 42 30518 1 . ASN 43 43 30518 1 . LYS 44 44 30518 1 . PHE 45 45 30518 1 . VAL 46 46 30518 1 . GLU 47 47 30518 1 . PHE 48 48 30518 1 . ASP 49 49 30518 1 . MET 50 50 30518 1 . LYS 51 51 30518 1 . PRO 52 52 30518 1 . VAL 53 53 30518 1 . CYS 54 54 30518 1 . LYS 55 55 30518 1 . LYS 56 56 30518 1 . CYS 57 57 30518 1 . TYR 58 58 30518 1 . GLU 59 59 30518 1 . LYS 60 60 30518 1 . PHE 61 61 30518 1 . PRO 62 62 30518 1 . LEU 63 63 30518 1 . GLU 64 64 30518 1 . LEU 65 65 30518 1 . LYS 66 66 30518 1 . LYS 67 67 30518 1 . ARG 68 68 30518 1 . LEU 69 69 30518 1 . LYS 70 70 30518 1 . LYS 71 71 30518 1 . LEU 72 72 30518 1 . ALA 73 73 30518 1 . GLU 74 74 30518 1 . THR 75 75 30518 1 . LEU 76 76 30518 1 . GLY 77 77 30518 1 . ARG 78 78 30518 1 . LYS 79 79 30518 1 stop_ save_ save_entity_ZN _Entity.Sf_category entity _Entity.Sf_framecode entity_ZN _Entity.Entry_ID 30518 _Entity.ID 2 _Entity.BMRB_code ZN _Entity.Name entity_ZN _Entity.Type non-polymer _Entity.Polymer_common_type . _Entity.Polymer_type . _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code . _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 . _Entity.Nstd_chirality . _Entity.Nstd_linkage . _Entity.Nonpolymer_comp_ID ZN _Entity.Nonpolymer_comp_label $chem_comp_ZN _Entity.Number_of_monomers . _Entity.Number_of_nonpolymer_components 1 _Entity.Paramagnetic . _Entity.Thiol_state . _Entity.Src_method . _Entity.Parent_entity_ID 2 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 65.409 _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 'ZINC ION' BMRB 30518 2 stop_ loop_ _Entity_systematic_name.Name _Entity_systematic_name.Naming_system _Entity_systematic_name.Entry_ID _Entity_systematic_name.Entity_ID 'ZINC ION' BMRB 30518 2 ZN 'Three letter code' 30518 2 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 1 ZN $chem_comp_ZN 30518 2 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 30518 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity_1 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . 'LIMS1, PINCH, PINCH1' . 30518 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 30518 _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 BL21(DE3) . . . . . . . . . 30518 1 stop_ save_ ################################# # Polymer residues and ligands # ################################# save_chem_comp_ZN _Chem_comp.Sf_category chem_comp _Chem_comp.Sf_framecode chem_comp_ZN _Chem_comp.Entry_ID 30518 _Chem_comp.ID ZN _Chem_comp.Provenance PDB _Chem_comp.Name 'ZINC ION' _Chem_comp.Type NON-POLYMER _Chem_comp.BMRB_code ZN _Chem_comp.PDB_code ZN _Chem_comp.Ambiguous_flag no _Chem_comp.Initial_date 2012-11-20 _Chem_comp.Modified_date 2012-11-20 _Chem_comp.Release_status REL _Chem_comp.Replaced_by . _Chem_comp.Replaces . _Chem_comp.One_letter_code . _Chem_comp.Three_letter_code ZN _Chem_comp.Number_atoms_all 1 _Chem_comp.Number_atoms_nh 1 _Chem_comp.Atom_nomenclature_source . _Chem_comp.PubChem_code . _Chem_comp.Subcomponent_list . _Chem_comp.InChI_code InChI=1S/Zn/q+2 _Chem_comp.Mon_nstd_flag . _Chem_comp.Mon_nstd_class . _Chem_comp.Mon_nstd_details . _Chem_comp.Mon_nstd_parent . _Chem_comp.Mon_nstd_parent_comp_ID . _Chem_comp.Std_deriv_one_letter_code . _Chem_comp.Std_deriv_three_letter_code . _Chem_comp.Std_deriv_BMRB_code . _Chem_comp.Std_deriv_PDB_code . _Chem_comp.Std_deriv_chem_comp_name . _Chem_comp.Synonyms . _Chem_comp.Formal_charge 2 _Chem_comp.Paramagnetic . _Chem_comp.Aromatic no _Chem_comp.Formula Zn _Chem_comp.Formula_weight 65.409 _Chem_comp.Formula_mono_iso_wt_nat . _Chem_comp.Formula_mono_iso_wt_13C . _Chem_comp.Formula_mono_iso_wt_15N . _Chem_comp.Formula_mono_iso_wt_13C_15N . _Chem_comp.Image_file_name . _Chem_comp.Image_file_format . _Chem_comp.Topo_file_name . _Chem_comp.Topo_file_format . _Chem_comp.Struct_file_name . _Chem_comp.Struct_file_format . _Chem_comp.Stereochem_param_file_name . _Chem_comp.Stereochem_param_file_format . _Chem_comp.Model_details . _Chem_comp.Model_erf . _Chem_comp.Model_source . _Chem_comp.Model_coordinates_details . _Chem_comp.Model_coordinates_missing_flag no _Chem_comp.Ideal_coordinates_details . _Chem_comp.Ideal_coordinates_missing_flag no _Chem_comp.Model_coordinates_db_code . _Chem_comp.Processing_site RCSB _Chem_comp.Vendor . _Chem_comp.Vendor_product_code . _Chem_comp.Details . _Chem_comp.DB_query_date . _Chem_comp.DB_last_query_revised_last_date . loop_ _Chem_comp_descriptor.Descriptor _Chem_comp_descriptor.Type _Chem_comp_descriptor.Program _Chem_comp_descriptor.Program_version _Chem_comp_descriptor.Entry_ID _Chem_comp_descriptor.Comp_ID InChI=1S/Zn/q+2 InChI InChI 1.03 30518 ZN PTFCDOFLOPIGGS-UHFFFAOYSA-N InChIKey InChI 1.03 30518 ZN [Zn++] SMILES CACTVS 3.341 30518 ZN [Zn++] SMILES_CANONICAL CACTVS 3.341 30518 ZN [Zn+2] SMILES ACDLabs 10.04 30518 ZN [Zn+2] SMILES 'OpenEye OEToolkits' 1.5.0 30518 ZN [Zn+2] SMILES_CANONICAL 'OpenEye OEToolkits' 1.5.0 30518 ZN stop_ loop_ _Chem_comp_identifier.Identifier _Chem_comp_identifier.Type _Chem_comp_identifier.Program _Chem_comp_identifier.Program_version _Chem_comp_identifier.Entry_ID _Chem_comp_identifier.Comp_ID zinc 'SYSTEMATIC NAME' ACDLabs 10.04 30518 ZN 'zinc(+2) cation' 'SYSTEMATIC NAME' 'OpenEye OEToolkits' 1.5.0 30518 ZN stop_ loop_ _Chem_comp_atom.Atom_ID _Chem_comp_atom.BMRB_code _Chem_comp_atom.PDB_atom_ID _Chem_comp_atom.Alt_atom_ID _Chem_comp_atom.Auth_atom_ID _Chem_comp_atom.Type_symbol _Chem_comp_atom.Isotope_number _Chem_comp_atom.Chirality _Chem_comp_atom.Stereo_config _Chem_comp_atom.Charge _Chem_comp_atom.Partial_charge _Chem_comp_atom.Oxidation_number _Chem_comp_atom.Unpaired_electron_number _Chem_comp_atom.Align _Chem_comp_atom.Aromatic_flag _Chem_comp_atom.Leaving_atom_flag _Chem_comp_atom.Substruct_code _Chem_comp_atom.Ionizable _Chem_comp_atom.Drawing_2D_coord_x _Chem_comp_atom.Drawing_2D_coord_y _Chem_comp_atom.Model_Cartn_x _Chem_comp_atom.Model_Cartn_x_esd _Chem_comp_atom.Model_Cartn_y _Chem_comp_atom.Model_Cartn_y_esd _Chem_comp_atom.Model_Cartn_z _Chem_comp_atom.Model_Cartn_z_esd _Chem_comp_atom.Model_Cartn_x_ideal _Chem_comp_atom.Model_Cartn_y_ideal _Chem_comp_atom.Model_Cartn_z_ideal _Chem_comp_atom.PDBX_ordinal _Chem_comp_atom.Details _Chem_comp_atom.Entry_ID _Chem_comp_atom.Comp_ID ZN ZN ZN ZN . ZN . . N 2 . . . 0 no no . . . . 0.000 . 0.000 . 0.000 . 0.000 0.000 0.000 1 . 30518 ZN stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 30518 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details '0.5 mM [U-15N] Lim5-T, 90% H2O/10% D2O' _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 Lim5-T [U-15N] . . 1 $entity_1 . . 0.5 . . mM . . . . 30518 1 2 NaCl 'natural abundance' . . . . . . 20 . . mM . . . . 30518 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 30518 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details '1.0 mM [U-13C; U-15N] 15N 13C Lim5-T, 90% H2O/10% D2O' _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 '15N 13C Lim5-T' '[U-13C; U-15N]' . . 1 $entity_1 . . 1.0 . . mM . . . . 30518 2 2 NaCl 'natural abundance' . . . . . . 20 . . mM . . . . 30518 2 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 30518 _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' 20 . mM 30518 1 pH 6.5 . pH 30518 1 pressure 1 . Pa 30518 1 temperature 298 . K 30518 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 30518 _Software.ID 1 _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' . . 30518 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 30518 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 30518 _Software.ID 2 _Software.Type . _Software.Name PIPP _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Garrett . . 30518 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'peak picking' 30518 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 30518 _Software.ID 3 _Software.Type . _Software.Name xwinnmr _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 30518 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 30518 3 stop_ save_ save_software_4 _Software.Sf_category software _Software.Sf_framecode software_4 _Software.Entry_ID 30518 _Software.ID 4 _Software.Type . _Software.Name 'X-PLOR NIH' _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Schwieters, Kuszewski, Tjandra and Clore' . . 30518 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 30518 4 'structure calculation' 30518 4 stop_ save_ save_software_5 _Software.Sf_category software _Software.Sf_framecode software_5 _Software.Entry_ID 30518 _Software.ID 5 _Software.Type . _Software.Name TALOS _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Cornilescu, Delaglio and Bax' . . 30518 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 30518 5 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 30518 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 30518 _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 Avance . 600 . . . 30518 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 30518 _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 . . . . . . . . . . . . . . . . 30518 1 2 '3D HNCO' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30518 1 3 '3D HNCA' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30518 1 4 '3D CBCA(CO)NH' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30518 1 5 '3D HCCH-TOCSY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30518 1 6 '3D HNCACB' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30518 1 7 '3D HNHA' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30518 1 8 '2D 1H-15N HSQC' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30518 1 9 '3D C(CO)NH' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30518 1 10 '3D 1H-15N NOESY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30518 1 11 '3D 1H-13C NOESY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 30518 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference_2 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chem_shift_reference_2 _Chem_shift_reference.Entry_ID 30518 _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 H 1 DSS 'methyl protons' . . . . ppm 0 internal direct 1 . . . . . 30518 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 30518 _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_2 _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' . . . 30518 1 2 '3D HNCO' . . . 30518 1 3 '3D HNCA' . . . 30518 1 4 '3D CBCA(CO)NH' . . . 30518 1 5 '3D HCCH-TOCSY' . . . 30518 1 6 '3D HNCACB' . . . 30518 1 7 '3D HNHA' . . . 30518 1 8 '2D 1H-15N HSQC' . . . 30518 1 9 '3D C(CO)NH' . . . 30518 1 10 '3D 1H-15N NOESY' . . . 30518 1 11 '3D 1H-13C NOESY' . . . 30518 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 2 2 SER HA H 1 4.410 0.03 . 1 . . . . A 248 SER HA . 30518 1 2 . 1 1 2 2 SER HB2 H 1 3.888 0.03 . 2 . . . . A 248 SER HB2 . 30518 1 3 . 1 1 2 2 SER HB3 H 1 3.888 0.03 . 2 . . . . A 248 SER HB3 . 30518 1 4 . 1 1 2 2 SER CA C 13 56.358 0.50 . 1 . . . . A 248 SER CA . 30518 1 5 . 1 1 2 2 SER CB C 13 60.766 0.50 . 1 . . . . A 248 SER CB . 30518 1 6 . 1 1 3 3 GLY H H 1 8.610 0.03 . 1 . . . . A 249 GLY H . 30518 1 7 . 1 1 3 3 GLY HA2 H 1 3.970 0.03 . 2 . . . . A 249 GLY HA2 . 30518 1 8 . 1 1 3 3 GLY HA3 H 1 3.860 0.03 . 2 . . . . A 249 GLY HA3 . 30518 1 9 . 1 1 3 3 GLY CA C 13 42.430 0.50 . 1 . . . . A 249 GLY CA . 30518 1 10 . 1 1 3 3 GLY N N 15 111.020 0.25 . 1 . . . . A 249 GLY N . 30518 1 11 . 1 1 4 4 ASP H H 1 7.960 0.03 . 1 . . . . A 250 ASP H . 30518 1 12 . 1 1 4 4 ASP HA H 1 4.543 0.03 . 1 . . . . A 250 ASP HA . 30518 1 13 . 1 1 4 4 ASP HB2 H 1 2.543 0.03 . 2 . . . . A 250 ASP HB2 . 30518 1 14 . 1 1 4 4 ASP HB3 H 1 2.299 0.03 . 2 . . . . A 250 ASP HB3 . 30518 1 15 . 1 1 4 4 ASP CA C 13 52.000 0.50 . 1 . . . . A 250 ASP CA . 30518 1 16 . 1 1 4 4 ASP CB C 13 39.860 0.50 . 1 . . . . A 250 ASP CB . 30518 1 17 . 1 1 4 4 ASP N N 15 120.180 0.25 . 1 . . . . A 250 ASP N . 30518 1 18 . 1 1 5 5 VAL H H 1 8.170 0.03 . 1 . . . . A 251 VAL H . 30518 1 19 . 1 1 5 5 VAL HA H 1 4.300 0.03 . 1 . . . . A 251 VAL HA . 30518 1 20 . 1 1 5 5 VAL HB H 1 1.680 0.03 . 1 . . . . A 251 VAL HB . 30518 1 21 . 1 1 5 5 VAL HG11 H 1 0.760 0.03 . 2 . . . . A 251 VAL HG11 . 30518 1 22 . 1 1 5 5 VAL HG12 H 1 0.760 0.03 . 2 . . . . A 251 VAL HG12 . 30518 1 23 . 1 1 5 5 VAL HG13 H 1 0.760 0.03 . 2 . . . . A 251 VAL HG13 . 30518 1 24 . 1 1 5 5 VAL HG21 H 1 0.610 0.03 . 2 . . . . A 251 VAL HG21 . 30518 1 25 . 1 1 5 5 VAL HG22 H 1 0.610 0.03 . 2 . . . . A 251 VAL HG22 . 30518 1 26 . 1 1 5 5 VAL HG23 H 1 0.610 0.03 . 2 . . . . A 251 VAL HG23 . 30518 1 27 . 1 1 5 5 VAL CA C 13 57.800 0.50 . 1 . . . . A 251 VAL CA . 30518 1 28 . 1 1 5 5 VAL CB C 13 31.390 0.50 . 1 . . . . A 251 VAL CB . 30518 1 29 . 1 1 5 5 VAL CG1 C 13 18.458 0.50 . 2 . . . . A 251 VAL CG1 . 30518 1 30 . 1 1 5 5 VAL N N 15 121.840 0.25 . 1 . . . . A 251 VAL N . 30518 1 31 . 1 1 6 6 CYS H H 1 8.320 0.03 . 1 . . . . A 252 CYS H . 30518 1 32 . 1 1 6 6 CYS HA H 1 4.290 0.03 . 1 . . . . A 252 CYS HA . 30518 1 33 . 1 1 6 6 CYS HB2 H 1 3.200 0.03 . 2 . . . . A 252 CYS HB2 . 30518 1 34 . 1 1 6 6 CYS HB3 H 1 3.450 0.03 . 2 . . . . A 252 CYS HB3 . 30518 1 35 . 1 1 6 6 CYS CA C 13 56.320 0.50 . 1 . . . . A 252 CYS CA . 30518 1 36 . 1 1 6 6 CYS CB C 13 29.720 0.50 . 1 . . . . A 252 CYS CB . 30518 1 37 . 1 1 6 6 CYS N N 15 128.010 0.25 . 1 . . . . A 252 CYS N . 30518 1 38 . 1 1 7 7 PHE H H 1 9.130 0.03 . 1 . . . . A 253 PHE H . 30518 1 39 . 1 1 7 7 PHE HA H 1 4.084 0.03 . 1 . . . . A 253 PHE HA . 30518 1 40 . 1 1 7 7 PHE HB2 H 1 2.897 0.03 . 2 . . . . A 253 PHE HB2 . 30518 1 41 . 1 1 7 7 PHE HB3 H 1 1.428 0.03 . 2 . . . . A 253 PHE HB3 . 30518 1 42 . 1 1 7 7 PHE CA C 13 57.490 0.50 . 1 . . . . A 253 PHE CA . 30518 1 43 . 1 1 7 7 PHE CB C 13 36.710 0.50 . 1 . . . . A 253 PHE CB . 30518 1 44 . 1 1 7 7 PHE N N 15 130.810 0.25 . 1 . . . . A 253 PHE N . 30518 1 45 . 1 1 8 8 HIS H H 1 9.230 0.03 . 1 . . . . A 254 HIS H . 30518 1 46 . 1 1 8 8 HIS HA H 1 4.573 0.03 . 1 . . . . A 254 HIS HA . 30518 1 47 . 1 1 8 8 HIS HB2 H 1 3.550 0.03 . 2 . . . . A 254 HIS HB2 . 30518 1 48 . 1 1 8 8 HIS HB3 H 1 3.752 0.03 . 2 . . . . A 254 HIS HB3 . 30518 1 49 . 1 1 8 8 HIS CA C 13 55.770 0.50 . 1 . . . . A 254 HIS CA . 30518 1 50 . 1 1 8 8 HIS CB C 13 28.840 0.50 . 1 . . . . A 254 HIS CB . 30518 1 51 . 1 1 8 8 HIS N N 15 118.330 0.25 . 1 . . . . A 254 HIS N . 30518 1 52 . 1 1 9 9 CYS H H 1 8.910 0.03 . 1 . . . . A 255 CYS H . 30518 1 53 . 1 1 9 9 CYS HA H 1 4.576 0.03 . 1 . . . . A 255 CYS HA . 30518 1 54 . 1 1 9 9 CYS HB2 H 1 3.162 0.03 . 2 . . . . A 255 CYS HB2 . 30518 1 55 . 1 1 9 9 CYS HB3 H 1 2.862 0.03 . 2 . . . . A 255 CYS HB3 . 30518 1 56 . 1 1 9 9 CYS CA C 13 56.550 0.50 . 1 . . . . A 255 CYS CA . 30518 1 57 . 1 1 9 9 CYS CB C 13 29.110 0.50 . 1 . . . . A 255 CYS CB . 30518 1 58 . 1 1 9 9 CYS N N 15 118.700 0.25 . 1 . . . . A 255 CYS N . 30518 1 59 . 1 1 10 10 ASN H H 1 7.960 0.03 . 1 . . . . A 256 ASN H . 30518 1 60 . 1 1 10 10 ASN HA H 1 4.356 0.03 . 1 . . . . A 256 ASN HA . 30518 1 61 . 1 1 10 10 ASN HB2 H 1 3.001 0.03 . 2 . . . . A 256 ASN HB2 . 30518 1 62 . 1 1 10 10 ASN HB3 H 1 2.625 0.03 . 2 . . . . A 256 ASN HB3 . 30518 1 63 . 1 1 10 10 ASN CA C 13 52.320 0.50 . 1 . . . . A 256 ASN CA . 30518 1 64 . 1 1 10 10 ASN CB C 13 35.330 0.50 . 1 . . . . A 256 ASN CB . 30518 1 65 . 1 1 10 10 ASN N N 15 117.850 0.25 . 1 . . . . A 256 ASN N . 30518 1 66 . 1 1 11 11 ARG H H 1 7.830 0.03 . 1 . . . . A 257 ARG H . 30518 1 67 . 1 1 11 11 ARG HA H 1 4.544 0.03 . 1 . . . . A 257 ARG HA . 30518 1 68 . 1 1 11 11 ARG HD2 H 1 3.220 0.03 . 2 . . . . A 257 ARG HD2 . 30518 1 69 . 1 1 11 11 ARG CA C 13 52.450 0.50 . 1 . . . . A 257 ARG CA . 30518 1 70 . 1 1 11 11 ARG CB C 13 29.450 0.50 . 1 . . . . A 257 ARG CB . 30518 1 71 . 1 1 11 11 ARG CG C 13 24.990 0.50 . 1 . . . . A 257 ARG CG . 30518 1 72 . 1 1 11 11 ARG CD C 13 40.890 0.50 . 1 . . . . A 257 ARG CD . 30518 1 73 . 1 1 11 11 ARG N N 15 118.320 0.25 . 1 . . . . A 257 ARG N . 30518 1 74 . 1 1 12 12 VAL H H 1 8.300 0.03 . 1 . . . . A 258 VAL H . 30518 1 75 . 1 1 12 12 VAL HA H 1 3.945 0.03 . 1 . . . . A 258 VAL HA . 30518 1 76 . 1 1 12 12 VAL HB H 1 1.849 0.03 . 1 . . . . A 258 VAL HB . 30518 1 77 . 1 1 12 12 VAL HG11 H 1 0.869 0.03 . 2 . . . . A 258 VAL HG11 . 30518 1 78 . 1 1 12 12 VAL HG12 H 1 0.869 0.03 . 2 . . . . A 258 VAL HG12 . 30518 1 79 . 1 1 12 12 VAL HG13 H 1 0.869 0.03 . 2 . . . . A 258 VAL HG13 . 30518 1 80 . 1 1 12 12 VAL HG21 H 1 0.765 0.03 . 2 . . . . A 258 VAL HG21 . 30518 1 81 . 1 1 12 12 VAL HG22 H 1 0.765 0.03 . 2 . . . . A 258 VAL HG22 . 30518 1 82 . 1 1 12 12 VAL HG23 H 1 0.765 0.03 . 2 . . . . A 258 VAL HG23 . 30518 1 83 . 1 1 12 12 VAL CA C 13 61.110 0.50 . 1 . . . . A 258 VAL CA . 30518 1 84 . 1 1 12 12 VAL CB C 13 28.850 0.50 . 1 . . . . A 258 VAL CB . 30518 1 85 . 1 1 12 12 VAL CG1 C 13 19.175 0.50 . 2 . . . . A 258 VAL CG1 . 30518 1 86 . 1 1 12 12 VAL N N 15 121.850 0.25 . 1 . . . . A 258 VAL N . 30518 1 87 . 1 1 13 13 ILE H H 1 8.420 0.03 . 1 . . . . A 259 ILE H . 30518 1 88 . 1 1 13 13 ILE HA H 1 3.701 0.03 . 1 . . . . A 259 ILE HA . 30518 1 89 . 1 1 13 13 ILE HB H 1 1.451 0.03 . 1 . . . . A 259 ILE HB . 30518 1 90 . 1 1 13 13 ILE HG12 H 1 1.619 0.03 . 2 . . . . A 259 ILE HG12 . 30518 1 91 . 1 1 13 13 ILE HG13 H 1 1.619 0.03 . 2 . . . . A 259 ILE HG13 . 30518 1 92 . 1 1 13 13 ILE HG21 H 1 0.798 0.03 . 1 . . . . A 259 ILE HG21 . 30518 1 93 . 1 1 13 13 ILE HG22 H 1 0.798 0.03 . 1 . . . . A 259 ILE HG22 . 30518 1 94 . 1 1 13 13 ILE HG23 H 1 0.798 0.03 . 1 . . . . A 259 ILE HG23 . 30518 1 95 . 1 1 13 13 ILE HD11 H 1 0.555 0.03 . 1 . . . . A 259 ILE HD11 . 30518 1 96 . 1 1 13 13 ILE HD12 H 1 0.555 0.03 . 1 . . . . A 259 ILE HD12 . 30518 1 97 . 1 1 13 13 ILE HD13 H 1 0.555 0.03 . 1 . . . . A 259 ILE HD13 . 30518 1 98 . 1 1 13 13 ILE CA C 13 60.460 0.50 . 1 . . . . A 259 ILE CA . 30518 1 99 . 1 1 13 13 ILE CB C 13 36.220 0.50 . 1 . . . . A 259 ILE CB . 30518 1 100 . 1 1 13 13 ILE CG1 C 13 26.181 0.50 . 1 . . . . A 259 ILE CG1 . 30518 1 101 . 1 1 13 13 ILE CG2 C 13 16.157 0.50 . 1 . . . . A 259 ILE CG2 . 30518 1 102 . 1 1 13 13 ILE CD1 C 13 12.812 0.50 . 1 . . . . A 259 ILE CD1 . 30518 1 103 . 1 1 13 13 ILE N N 15 130.650 0.25 . 1 . . . . A 259 ILE N . 30518 1 104 . 1 1 14 14 GLU H H 1 8.560 0.03 . 1 . . . . A 260 GLU H . 30518 1 105 . 1 1 14 14 GLU HA H 1 4.413 0.03 . 1 . . . . A 260 GLU HA . 30518 1 106 . 1 1 14 14 GLU HB2 H 1 1.895 0.03 . 2 . . . . A 260 GLU HB2 . 30518 1 107 . 1 1 14 14 GLU HB3 H 1 2.029 0.03 . 2 . . . . A 260 GLU HB3 . 30518 1 108 . 1 1 14 14 GLU HG2 H 1 2.270 0.03 . 2 . . . . A 260 GLU HG2 . 30518 1 109 . 1 1 14 14 GLU HG3 H 1 2.167 0.03 . 2 . . . . A 260 GLU HG3 . 30518 1 110 . 1 1 14 14 GLU CA C 13 53.270 0.50 . 1 . . . . A 260 GLU CA . 30518 1 111 . 1 1 14 14 GLU CB C 13 28.050 0.50 . 1 . . . . A 260 GLU CB . 30518 1 112 . 1 1 14 14 GLU CG C 13 33.570 0.50 . 1 . . . . A 260 GLU CG . 30518 1 113 . 1 1 14 14 GLU N N 15 129.570 0.25 . 1 . . . . A 260 GLU N . 30518 1 114 . 1 1 15 15 GLY H H 1 8.260 0.03 . 1 . . . . A 261 GLY H . 30518 1 115 . 1 1 15 15 GLY HA2 H 1 3.946 0.03 . 2 . . . . A 261 GLY HA2 . 30518 1 116 . 1 1 15 15 GLY HA3 H 1 3.946 0.03 . 2 . . . . A 261 GLY HA3 . 30518 1 117 . 1 1 15 15 GLY CA C 13 41.600 0.50 . 1 . . . . A 261 GLY CA . 30518 1 118 . 1 1 15 15 GLY N N 15 111.660 0.25 . 1 . . . . A 261 GLY N . 30518 1 119 . 1 1 16 16 ASP H H 1 8.300 0.03 . 1 . . . . A 262 ASP H . 30518 1 120 . 1 1 16 16 ASP HA H 1 4.423 0.03 . 1 . . . . A 262 ASP HA . 30518 1 121 . 1 1 16 16 ASP HB2 H 1 2.502 0.03 . 2 . . . . A 262 ASP HB2 . 30518 1 122 . 1 1 16 16 ASP HB3 H 1 2.461 0.03 . 2 . . . . A 262 ASP HB3 . 30518 1 123 . 1 1 16 16 ASP CA C 13 52.610 0.50 . 1 . . . . A 262 ASP CA . 30518 1 124 . 1 1 16 16 ASP CB C 13 38.450 0.50 . 1 . . . . A 262 ASP CB . 30518 1 125 . 1 1 16 16 ASP N N 15 122.780 0.25 . 1 . . . . A 262 ASP N . 30518 1 126 . 1 1 17 17 VAL H H 1 8.240 0.03 . 1 . . . . A 263 VAL H . 30518 1 127 . 1 1 17 17 VAL HA H 1 4.211 0.03 . 1 . . . . A 263 VAL HA . 30518 1 128 . 1 1 17 17 VAL HB H 1 1.911 0.03 . 1 . . . . A 263 VAL HB . 30518 1 129 . 1 1 17 17 VAL HG11 H 1 0.957 0.03 . 2 . . . . A 263 VAL HG11 . 30518 1 130 . 1 1 17 17 VAL HG12 H 1 0.957 0.03 . 2 . . . . A 263 VAL HG12 . 30518 1 131 . 1 1 17 17 VAL HG13 H 1 0.957 0.03 . 2 . . . . A 263 VAL HG13 . 30518 1 132 . 1 1 17 17 VAL HG21 H 1 0.824 0.03 . 2 . . . . A 263 VAL HG21 . 30518 1 133 . 1 1 17 17 VAL HG22 H 1 0.824 0.03 . 2 . . . . A 263 VAL HG22 . 30518 1 134 . 1 1 17 17 VAL HG23 H 1 0.824 0.03 . 2 . . . . A 263 VAL HG23 . 30518 1 135 . 1 1 17 17 VAL CA C 13 58.710 0.50 . 1 . . . . A 263 VAL CA . 30518 1 136 . 1 1 17 17 VAL CB C 13 31.690 0.50 . 1 . . . . A 263 VAL CB . 30518 1 137 . 1 1 17 17 VAL CG1 C 13 18.697 0.50 . 2 . . . . A 263 VAL CG1 . 30518 1 138 . 1 1 17 17 VAL N N 15 120.790 0.25 . 1 . . . . A 263 VAL N . 30518 1 139 . 1 1 18 18 VAL H H 1 9.170 0.03 . 1 . . . . A 264 VAL H . 30518 1 140 . 1 1 18 18 VAL HA H 1 3.973 0.03 . 1 . . . . A 264 VAL HA . 30518 1 141 . 1 1 18 18 VAL HB H 1 1.830 0.03 . 1 . . . . A 264 VAL HB . 30518 1 142 . 1 1 18 18 VAL HG11 H 1 0.815 0.03 . 2 . . . . A 264 VAL HG11 . 30518 1 143 . 1 1 18 18 VAL HG12 H 1 0.815 0.03 . 2 . . . . A 264 VAL HG12 . 30518 1 144 . 1 1 18 18 VAL HG13 H 1 0.815 0.03 . 2 . . . . A 264 VAL HG13 . 30518 1 145 . 1 1 18 18 VAL HG21 H 1 0.024 0.03 . 2 . . . . A 264 VAL HG21 . 30518 1 146 . 1 1 18 18 VAL HG22 H 1 0.024 0.03 . 2 . . . . A 264 VAL HG22 . 30518 1 147 . 1 1 18 18 VAL HG23 H 1 0.024 0.03 . 2 . . . . A 264 VAL HG23 . 30518 1 148 . 1 1 18 18 VAL CA C 13 59.520 0.50 . 1 . . . . A 264 VAL CA . 30518 1 149 . 1 1 18 18 VAL CB C 13 29.860 0.50 . 1 . . . . A 264 VAL CB . 30518 1 150 . 1 1 18 18 VAL CG1 C 13 18.846 0.50 . 2 . . . . A 264 VAL CG1 . 30518 1 151 . 1 1 18 18 VAL CG2 C 13 17.325 0.50 . 2 . . . . A 264 VAL CG2 . 30518 1 152 . 1 1 18 18 VAL N N 15 129.550 0.25 . 1 . . . . A 264 VAL N . 30518 1 153 . 1 1 19 19 SER H H 1 8.340 0.03 . 1 . . . . A 265 SER H . 30518 1 154 . 1 1 19 19 SER HA H 1 5.232 0.03 . 1 . . . . A 265 SER HA . 30518 1 155 . 1 1 19 19 SER HB2 H 1 3.799 0.03 . 2 . . . . A 265 SER HB2 . 30518 1 156 . 1 1 19 19 SER HB3 H 1 3.643 0.03 . 2 . . . . A 265 SER HB3 . 30518 1 157 . 1 1 19 19 SER CA C 13 53.660 0.50 . 1 . . . . A 265 SER CA . 30518 1 158 . 1 1 19 19 SER CB C 13 60.410 0.50 . 1 . . . . A 265 SER CB . 30518 1 159 . 1 1 19 19 SER N N 15 123.620 0.25 . 1 . . . . A 265 SER N . 30518 1 160 . 1 1 20 20 ALA H H 1 8.380 0.03 . 1 . . . . A 266 ALA H . 30518 1 161 . 1 1 20 20 ALA HA H 1 4.534 0.03 . 1 . . . . A 266 ALA HA . 30518 1 162 . 1 1 20 20 ALA HB1 H 1 0.810 0.03 . 1 . . . . A 266 ALA HB1 . 30518 1 163 . 1 1 20 20 ALA HB2 H 1 0.810 0.03 . 1 . . . . A 266 ALA HB2 . 30518 1 164 . 1 1 20 20 ALA HB3 H 1 0.810 0.03 . 1 . . . . A 266 ALA HB3 . 30518 1 165 . 1 1 20 20 ALA CA C 13 49.400 0.50 . 1 . . . . A 266 ALA CA . 30518 1 166 . 1 1 20 20 ALA CB C 13 19.500 0.50 . 1 . . . . A 266 ALA CB . 30518 1 167 . 1 1 20 20 ALA N N 15 125.970 0.25 . 1 . . . . A 266 ALA N . 30518 1 168 . 1 1 21 21 LEU H H 1 9.650 0.03 . 1 . . . . A 267 LEU H . 30518 1 169 . 1 1 21 21 LEU HA H 1 3.988 0.03 . 1 . . . . A 267 LEU HA . 30518 1 170 . 1 1 21 21 LEU HB2 H 1 2.165 0.03 . 2 . . . . A 267 LEU HB2 . 30518 1 171 . 1 1 21 21 LEU HB3 H 1 1.749 0.03 . 2 . . . . A 267 LEU HB3 . 30518 1 172 . 1 1 21 21 LEU HG H 1 1.615 0.03 . 1 . . . . A 267 LEU HG . 30518 1 173 . 1 1 21 21 LEU HD11 H 1 0.870 0.03 . 2 . . . . A 267 LEU HD11 . 30518 1 174 . 1 1 21 21 LEU HD12 H 1 0.870 0.03 . 2 . . . . A 267 LEU HD12 . 30518 1 175 . 1 1 21 21 LEU HD13 H 1 0.870 0.03 . 2 . . . . A 267 LEU HD13 . 30518 1 176 . 1 1 21 21 LEU HD21 H 1 0.946 0.03 . 2 . . . . A 267 LEU HD21 . 30518 1 177 . 1 1 21 21 LEU HD22 H 1 0.946 0.03 . 2 . . . . A 267 LEU HD22 . 30518 1 178 . 1 1 21 21 LEU HD23 H 1 0.946 0.03 . 2 . . . . A 267 LEU HD23 . 30518 1 179 . 1 1 21 21 LEU CA C 13 53.130 0.50 . 1 . . . . A 267 LEU CA . 30518 1 180 . 1 1 21 21 LEU CB C 13 35.690 0.50 . 1 . . . . A 267 LEU CB . 30518 1 181 . 1 1 21 21 LEU CG C 13 24.760 0.50 . 1 . . . . A 267 LEU CG . 30518 1 182 . 1 1 21 21 LEU CD1 C 13 23.060 0.50 . 2 . . . . A 267 LEU CD1 . 30518 1 183 . 1 1 21 21 LEU CD2 C 13 20.867 0.50 . 2 . . . . A 267 LEU CD2 . 30518 1 184 . 1 1 21 21 LEU N N 15 119.900 0.25 . 1 . . . . A 267 LEU N . 30518 1 185 . 1 1 22 22 ASN H H 1 8.750 0.03 . 1 . . . . A 268 ASN H . 30518 1 186 . 1 1 22 22 ASN HA H 1 4.209 0.03 . 1 . . . . A 268 ASN HA . 30518 1 187 . 1 1 22 22 ASN HB2 H 1 3.037 0.03 . 2 . . . . A 268 ASN HB2 . 30518 1 188 . 1 1 22 22 ASN HB3 H 1 2.934 0.03 . 2 . . . . A 268 ASN HB3 . 30518 1 189 . 1 1 22 22 ASN CA C 13 52.010 0.50 . 1 . . . . A 268 ASN CA . 30518 1 190 . 1 1 22 22 ASN CB C 13 35.080 0.50 . 1 . . . . A 268 ASN CB . 30518 1 191 . 1 1 22 22 ASN N N 15 110.140 0.25 . 1 . . . . A 268 ASN N . 30518 1 192 . 1 1 23 23 LYS H H 1 7.820 0.03 . 1 . . . . A 269 LYS H . 30518 1 193 . 1 1 23 23 LYS HA H 1 4.440 0.03 . 1 . . . . A 269 LYS HA . 30518 1 194 . 1 1 23 23 LYS HB2 H 1 1.313 0.03 . 2 . . . . A 269 LYS HB2 . 30518 1 195 . 1 1 23 23 LYS HB3 H 1 1.141 0.03 . 2 . . . . A 269 LYS HB3 . 30518 1 196 . 1 1 23 23 LYS HG2 H 1 0.905 0.03 . 2 . . . . A 269 LYS HG2 . 30518 1 197 . 1 1 23 23 LYS HG3 H 1 0.691 0.03 . 2 . . . . A 269 LYS HG3 . 30518 1 198 . 1 1 23 23 LYS HD2 H 1 0.833 0.03 . 2 . . . . A 269 LYS HD2 . 30518 1 199 . 1 1 23 23 LYS HD3 H 1 0.833 0.03 . 2 . . . . A 269 LYS HD3 . 30518 1 200 . 1 1 23 23 LYS HE2 H 1 2.407 0.03 . 2 . . . . A 269 LYS HE2 . 30518 1 201 . 1 1 23 23 LYS HE3 H 1 2.269 0.03 . 2 . . . . A 269 LYS HE3 . 30518 1 202 . 1 1 23 23 LYS CA C 13 51.410 0.50 . 1 . . . . A 269 LYS CA . 30518 1 203 . 1 1 23 23 LYS CB C 13 33.730 0.50 . 1 . . . . A 269 LYS CB . 30518 1 204 . 1 1 23 23 LYS CG C 13 21.230 0.50 . 1 . . . . A 269 LYS CG . 30518 1 205 . 1 1 23 23 LYS CD C 13 25.940 0.50 . 1 . . . . A 269 LYS CD . 30518 1 206 . 1 1 23 23 LYS CE C 13 39.470 0.50 . 1 . . . . A 269 LYS CE . 30518 1 207 . 1 1 23 23 LYS N N 15 119.550 0.25 . 1 . . . . A 269 LYS N . 30518 1 208 . 1 1 24 24 ALA H H 1 7.860 0.03 . 1 . . . . A 270 ALA H . 30518 1 209 . 1 1 24 24 ALA HA H 1 5.193 0.03 . 1 . . . . A 270 ALA HA . 30518 1 210 . 1 1 24 24 ALA HB1 H 1 1.130 0.03 . 1 . . . . A 270 ALA HB1 . 30518 1 211 . 1 1 24 24 ALA HB2 H 1 1.130 0.03 . 1 . . . . A 270 ALA HB2 . 30518 1 212 . 1 1 24 24 ALA HB3 H 1 1.130 0.03 . 1 . . . . A 270 ALA HB3 . 30518 1 213 . 1 1 24 24 ALA CA C 13 47.880 0.50 . 1 . . . . A 270 ALA CA . 30518 1 214 . 1 1 24 24 ALA CB C 13 18.390 0.50 . 1 . . . . A 270 ALA CB . 30518 1 215 . 1 1 24 24 ALA N N 15 123.860 0.25 . 1 . . . . A 270 ALA N . 30518 1 216 . 1 1 25 25 TRP H H 1 8.760 0.03 . 1 . . . . A 271 TRP H . 30518 1 217 . 1 1 25 25 TRP HA H 1 5.932 0.03 . 1 . . . . A 271 TRP HA . 30518 1 218 . 1 1 25 25 TRP HB2 H 1 3.439 0.03 . 2 . . . . A 271 TRP HB2 . 30518 1 219 . 1 1 25 25 TRP HB3 H 1 2.758 0.03 . 2 . . . . A 271 TRP HB3 . 30518 1 220 . 1 1 25 25 TRP CA C 13 52.330 0.50 . 1 . . . . A 271 TRP CA . 30518 1 221 . 1 1 25 25 TRP CB C 13 30.090 0.50 . 1 . . . . A 271 TRP CB . 30518 1 222 . 1 1 25 25 TRP N N 15 118.440 0.25 . 1 . . . . A 271 TRP N . 30518 1 223 . 1 1 26 26 CYS H H 1 9.250 0.03 . 1 . . . . A 272 CYS H . 30518 1 224 . 1 1 26 26 CYS HA H 1 4.753 0.03 . 1 . . . . A 272 CYS HA . 30518 1 225 . 1 1 26 26 CYS HB2 H 1 3.359 0.03 . 2 . . . . A 272 CYS HB2 . 30518 1 226 . 1 1 26 26 CYS HB3 H 1 3.359 0.03 . 2 . . . . A 272 CYS HB3 . 30518 1 227 . 1 1 26 26 CYS CA C 13 56.100 0.50 . 1 . . . . A 272 CYS CA . 30518 1 228 . 1 1 26 26 CYS CB C 13 28.430 0.50 . 1 . . . . A 272 CYS CB . 30518 1 229 . 1 1 26 26 CYS N N 15 123.730 0.25 . 1 . . . . A 272 CYS N . 30518 1 230 . 1 1 27 27 VAL H H 1 8.460 0.03 . 1 . . . . A 273 VAL H . 30518 1 231 . 1 1 27 27 VAL HA H 1 3.737 0.03 . 1 . . . . A 273 VAL HA . 30518 1 232 . 1 1 27 27 VAL HB H 1 2.028 0.03 . 1 . . . . A 273 VAL HB . 30518 1 233 . 1 1 27 27 VAL HG11 H 1 1.074 0.03 . 2 . . . . A 273 VAL HG11 . 30518 1 234 . 1 1 27 27 VAL HG12 H 1 1.074 0.03 . 2 . . . . A 273 VAL HG12 . 30518 1 235 . 1 1 27 27 VAL HG13 H 1 1.074 0.03 . 2 . . . . A 273 VAL HG13 . 30518 1 236 . 1 1 27 27 VAL HG21 H 1 0.989 0.03 . 2 . . . . A 273 VAL HG21 . 30518 1 237 . 1 1 27 27 VAL HG22 H 1 0.989 0.03 . 2 . . . . A 273 VAL HG22 . 30518 1 238 . 1 1 27 27 VAL HG23 H 1 0.989 0.03 . 2 . . . . A 273 VAL HG23 . 30518 1 239 . 1 1 27 27 VAL CA C 13 63.780 0.50 . 1 . . . . A 273 VAL CA . 30518 1 240 . 1 1 27 27 VAL CB C 13 28.710 0.50 . 1 . . . . A 273 VAL CB . 30518 1 241 . 1 1 27 27 VAL CG1 C 13 19.615 0.50 . 2 . . . . A 273 VAL CG1 . 30518 1 242 . 1 1 27 27 VAL CG2 C 13 18.472 0.50 . 2 . . . . A 273 VAL CG2 . 30518 1 243 . 1 1 27 27 VAL N N 15 121.140 0.25 . 1 . . . . A 273 VAL N . 30518 1 244 . 1 1 28 28 ASN H H 1 8.390 0.03 . 1 . . . . A 274 ASN H . 30518 1 245 . 1 1 28 28 ASN HA H 1 4.607 0.03 . 1 . . . . A 274 ASN HA . 30518 1 246 . 1 1 28 28 ASN HB2 H 1 2.920 0.03 . 2 . . . . A 274 ASN HB2 . 30518 1 247 . 1 1 28 28 ASN HD21 H 1 7.730 0.03 . 2 . . . . A 274 ASN HD21 . 30518 1 248 . 1 1 28 28 ASN HD22 H 1 6.995 0.03 . 2 . . . . A 274 ASN HD22 . 30518 1 249 . 1 1 28 28 ASN CA C 13 52.090 0.50 . 1 . . . . A 274 ASN CA . 30518 1 250 . 1 1 28 28 ASN CB C 13 35.840 0.50 . 1 . . . . A 274 ASN CB . 30518 1 251 . 1 1 28 28 ASN N N 15 113.830 0.25 . 1 . . . . A 274 ASN N . 30518 1 252 . 1 1 28 28 ASN ND2 N 15 113.500 0.25 . 1 . . . . A 274 ASN ND2 . 30518 1 253 . 1 1 29 29 CYS H H 1 7.770 0.03 . 1 . . . . A 275 CYS H . 30518 1 254 . 1 1 29 29 CYS HA H 1 4.232 0.03 . 1 . . . . A 275 CYS HA . 30518 1 255 . 1 1 29 29 CYS HB2 H 1 3.279 0.03 . 2 . . . . A 275 CYS HB2 . 30518 1 256 . 1 1 29 29 CYS HB3 H 1 3.279 0.03 . 2 . . . . A 275 CYS HB3 . 30518 1 257 . 1 1 29 29 CYS CA C 13 58.970 0.50 . 1 . . . . A 275 CYS CA . 30518 1 258 . 1 1 29 29 CYS CB C 13 29.930 0.50 . 1 . . . . A 275 CYS CB . 30518 1 259 . 1 1 29 29 CYS N N 15 117.730 0.25 . 1 . . . . A 275 CYS N . 30518 1 260 . 1 1 30 30 PHE H H 1 7.220 0.03 . 1 . . . . A 276 PHE H . 30518 1 261 . 1 1 30 30 PHE HA H 1 3.870 0.03 . 1 . . . . A 276 PHE HA . 30518 1 262 . 1 1 30 30 PHE HB2 H 1 3.001 0.03 . 2 . . . . A 276 PHE HB2 . 30518 1 263 . 1 1 30 30 PHE HB3 H 1 2.375 0.03 . 2 . . . . A 276 PHE HB3 . 30518 1 264 . 1 1 30 30 PHE CA C 13 55.550 0.50 . 1 . . . . A 276 PHE CA . 30518 1 265 . 1 1 30 30 PHE CB C 13 33.680 0.50 . 1 . . . . A 276 PHE CB . 30518 1 266 . 1 1 30 30 PHE N N 15 121.510 0.25 . 1 . . . . A 276 PHE N . 30518 1 267 . 1 1 31 31 ALA H H 1 6.570 0.03 . 1 . . . . A 277 ALA H . 30518 1 268 . 1 1 31 31 ALA HA H 1 4.361 0.03 . 1 . . . . A 277 ALA HA . 30518 1 269 . 1 1 31 31 ALA HB1 H 1 0.762 0.03 . 1 . . . . A 277 ALA HB1 . 30518 1 270 . 1 1 31 31 ALA HB2 H 1 0.762 0.03 . 1 . . . . A 277 ALA HB2 . 30518 1 271 . 1 1 31 31 ALA HB3 H 1 0.762 0.03 . 1 . . . . A 277 ALA HB3 . 30518 1 272 . 1 1 31 31 ALA CA C 13 46.890 0.50 . 1 . . . . A 277 ALA CA . 30518 1 273 . 1 1 31 31 ALA CB C 13 19.360 0.50 . 1 . . . . A 277 ALA CB . 30518 1 274 . 1 1 31 31 ALA N N 15 127.470 0.25 . 1 . . . . A 277 ALA N . 30518 1 275 . 1 1 32 32 CYS H H 1 8.380 0.03 . 1 . . . . A 278 CYS H . 30518 1 276 . 1 1 32 32 CYS HA H 1 3.751 0.03 . 1 . . . . A 278 CYS HA . 30518 1 277 . 1 1 32 32 CYS HB2 H 1 3.210 0.03 . 2 . . . . A 278 CYS HB2 . 30518 1 278 . 1 1 32 32 CYS HB3 H 1 2.526 0.03 . 2 . . . . A 278 CYS HB3 . 30518 1 279 . 1 1 32 32 CYS CA C 13 57.340 0.50 . 1 . . . . A 278 CYS CA . 30518 1 280 . 1 1 32 32 CYS CB C 13 28.390 0.50 . 1 . . . . A 278 CYS CB . 30518 1 281 . 1 1 32 32 CYS N N 15 121.210 0.25 . 1 . . . . A 278 CYS N . 30518 1 282 . 1 1 33 33 SER H H 1 9.100 0.03 . 1 . . . . A 279 SER H . 30518 1 283 . 1 1 33 33 SER HA H 1 4.288 0.03 . 1 . . . . A 279 SER HA . 30518 1 284 . 1 1 33 33 SER HB2 H 1 4.150 0.03 . 2 . . . . A 279 SER HB2 . 30518 1 285 . 1 1 33 33 SER HB3 H 1 4.100 0.03 . 2 . . . . A 279 SER HB3 . 30518 1 286 . 1 1 33 33 SER CA C 13 58.170 0.50 . 1 . . . . A 279 SER CA . 30518 1 287 . 1 1 33 33 SER CB C 13 61.700 0.50 . 1 . . . . A 279 SER CB . 30518 1 288 . 1 1 33 33 SER N N 15 125.980 0.25 . 1 . . . . A 279 SER N . 30518 1 289 . 1 1 34 34 THR H H 1 9.300 0.03 . 1 . . . . A 280 THR H . 30518 1 290 . 1 1 34 34 THR HA H 1 4.530 0.03 . 1 . . . . A 280 THR HA . 30518 1 291 . 1 1 34 34 THR HB H 1 4.505 0.03 . 1 . . . . A 280 THR HB . 30518 1 292 . 1 1 34 34 THR HG21 H 1 1.273 0.03 . 1 . . . . A 280 THR HG21 . 30518 1 293 . 1 1 34 34 THR HG22 H 1 1.273 0.03 . 1 . . . . A 280 THR HG22 . 30518 1 294 . 1 1 34 34 THR HG23 H 1 1.273 0.03 . 1 . . . . A 280 THR HG23 . 30518 1 295 . 1 1 34 34 THR CA C 13 62.430 0.50 . 1 . . . . A 280 THR CA . 30518 1 296 . 1 1 34 34 THR CB C 13 66.470 0.50 . 1 . . . . A 280 THR CB . 30518 1 297 . 1 1 34 34 THR CG2 C 13 19.685 0.50 . 1 . . . . A 280 THR CG2 . 30518 1 298 . 1 1 34 34 THR N N 15 119.400 0.25 . 1 . . . . A 280 THR N . 30518 1 299 . 1 1 35 35 CYS H H 1 8.410 0.03 . 1 . . . . A 281 CYS H . 30518 1 300 . 1 1 35 35 CYS HA H 1 4.930 0.03 . 1 . . . . A 281 CYS HA . 30518 1 301 . 1 1 35 35 CYS HB2 H 1 3.209 0.03 . 2 . . . . A 281 CYS HB2 . 30518 1 302 . 1 1 35 35 CYS HB3 H 1 2.505 0.03 . 2 . . . . A 281 CYS HB3 . 30518 1 303 . 1 1 35 35 CYS CA C 13 56.250 0.50 . 1 . . . . A 281 CYS CA . 30518 1 304 . 1 1 35 35 CYS CB C 13 29.800 0.50 . 1 . . . . A 281 CYS CB . 30518 1 305 . 1 1 35 35 CYS N N 15 120.640 0.25 . 1 . . . . A 281 CYS N . 30518 1 306 . 1 1 36 36 ASN H H 1 7.840 0.03 . 1 . . . . A 282 ASN H . 30518 1 307 . 1 1 36 36 ASN HA H 1 4.502 0.03 . 1 . . . . A 282 ASN HA . 30518 1 308 . 1 1 36 36 ASN HB2 H 1 3.001 0.03 . 2 . . . . A 282 ASN HB2 . 30518 1 309 . 1 1 36 36 ASN HB3 H 1 2.867 0.03 . 2 . . . . A 282 ASN HB3 . 30518 1 310 . 1 1 36 36 ASN CA C 13 52.470 0.50 . 1 . . . . A 282 ASN CA . 30518 1 311 . 1 1 36 36 ASN CB C 13 35.360 0.50 . 1 . . . . A 282 ASN CB . 30518 1 312 . 1 1 36 36 ASN N N 15 117.930 0.25 . 1 . . . . A 282 ASN N . 30518 1 313 . 1 1 37 37 THR H H 1 8.160 0.03 . 1 . . . . A 283 THR H . 30518 1 314 . 1 1 37 37 THR HA H 1 4.090 0.03 . 1 . . . . A 283 THR HA . 30518 1 315 . 1 1 37 37 THR HB H 1 3.984 0.03 . 1 . . . . A 283 THR HB . 30518 1 316 . 1 1 37 37 THR HG21 H 1 1.178 0.03 . 1 . . . . A 283 THR HG21 . 30518 1 317 . 1 1 37 37 THR HG22 H 1 1.178 0.03 . 1 . . . . A 283 THR HG22 . 30518 1 318 . 1 1 37 37 THR HG23 H 1 1.178 0.03 . 1 . . . . A 283 THR HG23 . 30518 1 319 . 1 1 37 37 THR CA C 13 61.380 0.50 . 1 . . . . A 283 THR CA . 30518 1 320 . 1 1 37 37 THR CB C 13 66.160 0.50 . 1 . . . . A 283 THR CB . 30518 1 321 . 1 1 37 37 THR CG2 C 13 18.316 0.50 . 1 . . . . A 283 THR CG2 . 30518 1 322 . 1 1 37 37 THR N N 15 118.840 0.25 . 1 . . . . A 283 THR N . 30518 1 323 . 1 1 38 38 LYS H H 1 8.560 0.03 . 1 . . . . A 284 LYS H . 30518 1 324 . 1 1 38 38 LYS HA H 1 3.887 0.03 . 1 . . . . A 284 LYS HA . 30518 1 325 . 1 1 38 38 LYS HB2 H 1 1.828 0.03 . 2 . . . . A 284 LYS HB2 . 30518 1 326 . 1 1 38 38 LYS HB3 H 1 1.775 0.03 . 2 . . . . A 284 LYS HB3 . 30518 1 327 . 1 1 38 38 LYS HG2 H 1 1.588 0.03 . 2 . . . . A 284 LYS HG2 . 30518 1 328 . 1 1 38 38 LYS HG3 H 1 1.376 0.03 . 2 . . . . A 284 LYS HG3 . 30518 1 329 . 1 1 38 38 LYS HD2 H 1 1.672 0.03 . 2 . . . . A 284 LYS HD2 . 30518 1 330 . 1 1 38 38 LYS HD3 H 1 1.602 0.03 . 2 . . . . A 284 LYS HD3 . 30518 1 331 . 1 1 38 38 LYS HE2 H 1 2.942 0.03 . 2 . . . . A 284 LYS HE2 . 30518 1 332 . 1 1 38 38 LYS HE3 H 1 2.942 0.03 . 2 . . . . A 284 LYS HE3 . 30518 1 333 . 1 1 38 38 LYS CA C 13 55.080 0.50 . 1 . . . . A 284 LYS CA . 30518 1 334 . 1 1 38 38 LYS CB C 13 29.270 0.50 . 1 . . . . A 284 LYS CB . 30518 1 335 . 1 1 38 38 LYS CG C 13 22.320 0.50 . 1 . . . . A 284 LYS CG . 30518 1 336 . 1 1 38 38 LYS CD C 13 26.267 0.50 . 1 . . . . A 284 LYS CD . 30518 1 337 . 1 1 38 38 LYS CE C 13 39.590 0.50 . 1 . . . . A 284 LYS CE . 30518 1 338 . 1 1 38 38 LYS N N 15 127.940 0.25 . 1 . . . . A 284 LYS N . 30518 1 339 . 1 1 39 39 LEU H H 1 8.120 0.03 . 1 . . . . A 285 LEU H . 30518 1 340 . 1 1 39 39 LEU HA H 1 4.635 0.03 . 1 . . . . A 285 LEU HA . 30518 1 341 . 1 1 39 39 LEU HB2 H 1 0.774 0.03 . 2 . . . . A 285 LEU HB2 . 30518 1 342 . 1 1 39 39 LEU HB3 H 1 0.658 0.03 . 2 . . . . A 285 LEU HB3 . 30518 1 343 . 1 1 39 39 LEU HG H 1 1.257 0.03 . 1 . . . . A 285 LEU HG . 30518 1 344 . 1 1 39 39 LEU HD11 H 1 -0.315 0.03 . 2 . . . . A 285 LEU HD11 . 30518 1 345 . 1 1 39 39 LEU HD12 H 1 -0.315 0.03 . 2 . . . . A 285 LEU HD12 . 30518 1 346 . 1 1 39 39 LEU HD13 H 1 -0.315 0.03 . 2 . . . . A 285 LEU HD13 . 30518 1 347 . 1 1 39 39 LEU HD21 H 1 0.627 0.03 . 2 . . . . A 285 LEU HD21 . 30518 1 348 . 1 1 39 39 LEU HD22 H 1 0.627 0.03 . 2 . . . . A 285 LEU HD22 . 30518 1 349 . 1 1 39 39 LEU HD23 H 1 0.627 0.03 . 2 . . . . A 285 LEU HD23 . 30518 1 350 . 1 1 39 39 LEU CA C 13 50.310 0.50 . 1 . . . . A 285 LEU CA . 30518 1 351 . 1 1 39 39 LEU CB C 13 42.730 0.50 . 1 . . . . A 285 LEU CB . 30518 1 352 . 1 1 39 39 LEU CG C 13 23.900 0.50 . 1 . . . . A 285 LEU CG . 30518 1 353 . 1 1 39 39 LEU CD1 C 13 22.536 0.50 . 2 . . . . A 285 LEU CD1 . 30518 1 354 . 1 1 39 39 LEU CD2 C 13 20.490 0.50 . 2 . . . . A 285 LEU CD2 . 30518 1 355 . 1 1 39 39 LEU N N 15 125.000 0.25 . 1 . . . . A 285 LEU N . 30518 1 356 . 1 1 40 40 THR H H 1 8.280 0.03 . 1 . . . . A 286 THR H . 30518 1 357 . 1 1 40 40 THR HA H 1 4.673 0.03 . 1 . . . . A 286 THR HA . 30518 1 358 . 1 1 40 40 THR HB H 1 4.592 0.03 . 1 . . . . A 286 THR HB . 30518 1 359 . 1 1 40 40 THR HG21 H 1 1.226 0.03 . 1 . . . . A 286 THR HG21 . 30518 1 360 . 1 1 40 40 THR HG22 H 1 1.226 0.03 . 1 . . . . A 286 THR HG22 . 30518 1 361 . 1 1 40 40 THR HG23 H 1 1.226 0.03 . 1 . . . . A 286 THR HG23 . 30518 1 362 . 1 1 40 40 THR CA C 13 56.870 0.50 . 1 . . . . A 286 THR CA . 30518 1 363 . 1 1 40 40 THR CB C 13 69.860 0.50 . 1 . . . . A 286 THR CB . 30518 1 364 . 1 1 40 40 THR CG2 C 13 18.310 0.50 . 1 . . . . A 286 THR CG2 . 30518 1 365 . 1 1 40 40 THR N N 15 109.080 0.25 . 1 . . . . A 286 THR N . 30518 1 366 . 1 1 41 41 LEU H H 1 8.690 0.03 . 1 . . . . A 287 LEU H . 30518 1 367 . 1 1 41 41 LEU HA H 1 4.434 0.03 . 1 . . . . A 287 LEU HA . 30518 1 368 . 1 1 41 41 LEU HB2 H 1 1.725 0.03 . 2 . . . . A 287 LEU HB2 . 30518 1 369 . 1 1 41 41 LEU HB3 H 1 1.725 0.03 . 2 . . . . A 287 LEU HB3 . 30518 1 370 . 1 1 41 41 LEU HG H 1 1.725 0.03 . 1 . . . . A 287 LEU HG . 30518 1 371 . 1 1 41 41 LEU HD11 H 1 1.010 0.03 . 2 . . . . A 287 LEU HD11 . 30518 1 372 . 1 1 41 41 LEU HD12 H 1 1.010 0.03 . 2 . . . . A 287 LEU HD12 . 30518 1 373 . 1 1 41 41 LEU HD13 H 1 1.010 0.03 . 2 . . . . A 287 LEU HD13 . 30518 1 374 . 1 1 41 41 LEU HD21 H 1 0.866 0.03 . 2 . . . . A 287 LEU HD21 . 30518 1 375 . 1 1 41 41 LEU HD22 H 1 0.866 0.03 . 2 . . . . A 287 LEU HD22 . 30518 1 376 . 1 1 41 41 LEU HD23 H 1 0.866 0.03 . 2 . . . . A 287 LEU HD23 . 30518 1 377 . 1 1 41 41 LEU CA C 13 54.010 0.50 . 1 . . . . A 287 LEU CA . 30518 1 378 . 1 1 41 41 LEU CB C 13 38.160 0.50 . 1 . . . . A 287 LEU CB . 30518 1 379 . 1 1 41 41 LEU CG C 13 24.450 0.50 . 1 . . . . A 287 LEU CG . 30518 1 380 . 1 1 41 41 LEU CD1 C 13 22.520 0.50 . 2 . . . . A 287 LEU CD1 . 30518 1 381 . 1 1 41 41 LEU CD2 C 13 20.030 0.50 . 2 . . . . A 287 LEU CD2 . 30518 1 382 . 1 1 41 41 LEU N N 15 117.610 0.25 . 1 . . . . A 287 LEU N . 30518 1 383 . 1 1 42 42 LYS H H 1 7.940 0.03 . 1 . . . . A 288 LYS H . 30518 1 384 . 1 1 42 42 LYS HA H 1 4.284 0.03 . 1 . . . . A 288 LYS HA . 30518 1 385 . 1 1 42 42 LYS HB2 H 1 1.810 0.03 . 2 . . . . A 288 LYS HB2 . 30518 1 386 . 1 1 42 42 LYS HB3 H 1 1.600 0.03 . 2 . . . . A 288 LYS HB3 . 30518 1 387 . 1 1 42 42 LYS HG2 H 1 1.378 0.03 . 2 . . . . A 288 LYS HG2 . 30518 1 388 . 1 1 42 42 LYS HG3 H 1 1.378 0.03 . 2 . . . . A 288 LYS HG3 . 30518 1 389 . 1 1 42 42 LYS HD2 H 1 1.644 0.03 . 2 . . . . A 288 LYS HD2 . 30518 1 390 . 1 1 42 42 LYS HD3 H 1 1.644 0.03 . 2 . . . . A 288 LYS HD3 . 30518 1 391 . 1 1 42 42 LYS HE2 H 1 2.977 0.03 . 2 . . . . A 288 LYS HE2 . 30518 1 392 . 1 1 42 42 LYS HE3 H 1 2.907 0.03 . 2 . . . . A 288 LYS HE3 . 30518 1 393 . 1 1 42 42 LYS CA C 13 53.910 0.50 . 1 . . . . A 288 LYS CA . 30518 1 394 . 1 1 42 42 LYS CB C 13 29.900 0.50 . 1 . . . . A 288 LYS CB . 30518 1 395 . 1 1 42 42 LYS CG C 13 22.350 0.50 . 1 . . . . A 288 LYS CG . 30518 1 396 . 1 1 42 42 LYS CD C 13 26.150 0.50 . 1 . . . . A 288 LYS CD . 30518 1 397 . 1 1 42 42 LYS CE C 13 39.410 0.50 . 1 . . . . A 288 LYS CE . 30518 1 398 . 1 1 42 42 LYS N N 15 116.150 0.25 . 1 . . . . A 288 LYS N . 30518 1 399 . 1 1 43 43 ASN H H 1 7.770 0.03 . 1 . . . . A 289 ASN H . 30518 1 400 . 1 1 43 43 ASN CA C 13 50.970 0.50 . 1 . . . . A 289 ASN CA . 30518 1 401 . 1 1 43 43 ASN CB C 13 38.890 0.50 . 1 . . . . A 289 ASN CB . 30518 1 402 . 1 1 43 43 ASN N N 15 117.730 0.25 . 1 . . . . A 289 ASN N . 30518 1 403 . 1 1 44 44 LYS H H 1 8.450 0.03 . 1 . . . . A 290 LYS H . 30518 1 404 . 1 1 44 44 LYS HA H 1 4.334 0.03 . 1 . . . . A 290 LYS HA . 30518 1 405 . 1 1 44 44 LYS HB2 H 1 1.679 0.03 . 2 . . . . A 290 LYS HB2 . 30518 1 406 . 1 1 44 44 LYS HB3 H 1 1.525 0.03 . 2 . . . . A 290 LYS HB3 . 30518 1 407 . 1 1 44 44 LYS HG2 H 1 1.358 0.03 . 2 . . . . A 290 LYS HG2 . 30518 1 408 . 1 1 44 44 LYS HE2 H 1 2.860 0.03 . 2 . . . . A 290 LYS HE2 . 30518 1 409 . 1 1 44 44 LYS CA C 13 52.770 0.50 . 1 . . . . A 290 LYS CA . 30518 1 410 . 1 1 44 44 LYS CB C 13 30.080 0.50 . 1 . . . . A 290 LYS CB . 30518 1 411 . 1 1 44 44 LYS CG C 13 22.120 0.50 . 1 . . . . A 290 LYS CG . 30518 1 412 . 1 1 44 44 LYS CD C 13 26.005 0.50 . 1 . . . . A 290 LYS CD . 30518 1 413 . 1 1 44 44 LYS CE C 13 39.520 0.50 . 1 . . . . A 290 LYS CE . 30518 1 414 . 1 1 44 44 LYS N N 15 118.570 0.25 . 1 . . . . A 290 LYS N . 30518 1 415 . 1 1 45 45 PHE H H 1 7.540 0.03 . 1 . . . . A 291 PHE H . 30518 1 416 . 1 1 45 45 PHE HA H 1 5.073 0.03 . 1 . . . . A 291 PHE HA . 30518 1 417 . 1 1 45 45 PHE HB2 H 1 2.768 0.03 . 2 . . . . A 291 PHE HB2 . 30518 1 418 . 1 1 45 45 PHE HB3 H 1 2.768 0.03 . 2 . . . . A 291 PHE HB3 . 30518 1 419 . 1 1 45 45 PHE CA C 13 53.030 0.50 . 1 . . . . A 291 PHE CA . 30518 1 420 . 1 1 45 45 PHE CB C 13 38.610 0.50 . 1 . . . . A 291 PHE CB . 30518 1 421 . 1 1 45 45 PHE N N 15 118.620 0.25 . 1 . . . . A 291 PHE N . 30518 1 422 . 1 1 46 46 VAL H H 1 9.120 0.03 . 1 . . . . A 292 VAL H . 30518 1 423 . 1 1 46 46 VAL HA H 1 4.412 0.03 . 1 . . . . A 292 VAL HA . 30518 1 424 . 1 1 46 46 VAL HB H 1 1.826 0.03 . 1 . . . . A 292 VAL HB . 30518 1 425 . 1 1 46 46 VAL HG11 H 1 0.389 0.03 . 2 . . . . A 292 VAL HG11 . 30518 1 426 . 1 1 46 46 VAL HG12 H 1 0.389 0.03 . 2 . . . . A 292 VAL HG12 . 30518 1 427 . 1 1 46 46 VAL HG13 H 1 0.389 0.03 . 2 . . . . A 292 VAL HG13 . 30518 1 428 . 1 1 46 46 VAL HG21 H 1 0.320 0.03 . 2 . . . . A 292 VAL HG21 . 30518 1 429 . 1 1 46 46 VAL HG22 H 1 0.320 0.03 . 2 . . . . A 292 VAL HG22 . 30518 1 430 . 1 1 46 46 VAL HG23 H 1 0.320 0.03 . 2 . . . . A 292 VAL HG23 . 30518 1 431 . 1 1 46 46 VAL CA C 13 56.600 0.50 . 1 . . . . A 292 VAL CA . 30518 1 432 . 1 1 46 46 VAL CB C 13 32.130 0.50 . 1 . . . . A 292 VAL CB . 30518 1 433 . 1 1 46 46 VAL CG1 C 13 18.230 0.50 . 2 . . . . A 292 VAL CG1 . 30518 1 434 . 1 1 46 46 VAL CG2 C 13 16.290 0.50 . 2 . . . . A 292 VAL CG2 . 30518 1 435 . 1 1 46 46 VAL N N 15 116.050 0.25 . 1 . . . . A 292 VAL N . 30518 1 436 . 1 1 47 47 GLU H H 1 8.310 0.03 . 1 . . . . A 293 GLU H . 30518 1 437 . 1 1 47 47 GLU HA H 1 4.774 0.03 . 1 . . . . A 293 GLU HA . 30518 1 438 . 1 1 47 47 GLU HB2 H 1 1.854 0.03 . 2 . . . . A 293 GLU HB2 . 30518 1 439 . 1 1 47 47 GLU HB3 H 1 1.854 0.03 . 2 . . . . A 293 GLU HB3 . 30518 1 440 . 1 1 47 47 GLU HG2 H 1 2.004 0.03 . 2 . . . . A 293 GLU HG2 . 30518 1 441 . 1 1 47 47 GLU HG3 H 1 2.004 0.03 . 2 . . . . A 293 GLU HG3 . 30518 1 442 . 1 1 47 47 GLU CA C 13 52.600 0.50 . 1 . . . . A 293 GLU CA . 30518 1 443 . 1 1 47 47 GLU CB C 13 28.670 0.50 . 1 . . . . A 293 GLU CB . 30518 1 444 . 1 1 47 47 GLU CG C 13 33.770 0.50 . 1 . . . . A 293 GLU CG . 30518 1 445 . 1 1 47 47 GLU N N 15 122.540 0.25 . 1 . . . . A 293 GLU N . 30518 1 446 . 1 1 48 48 PHE H H 1 9.350 0.03 . 1 . . . . A 294 PHE H . 30518 1 447 . 1 1 48 48 PHE HA H 1 4.782 0.03 . 1 . . . . A 294 PHE HA . 30518 1 448 . 1 1 48 48 PHE HB2 H 1 3.102 0.03 . 2 . . . . A 294 PHE HB2 . 30518 1 449 . 1 1 48 48 PHE HB3 H 1 2.932 0.03 . 2 . . . . A 294 PHE HB3 . 30518 1 450 . 1 1 48 48 PHE CA C 13 54.490 0.50 . 1 . . . . A 294 PHE CA . 30518 1 451 . 1 1 48 48 PHE CB C 13 39.020 0.50 . 1 . . . . A 294 PHE CB . 30518 1 452 . 1 1 48 48 PHE N N 15 126.600 0.25 . 1 . . . . A 294 PHE N . 30518 1 453 . 1 1 49 49 ASP H H 1 9.000 0.03 . 1 . . . . A 295 ASP H . 30518 1 454 . 1 1 49 49 ASP HA H 1 4.088 0.03 . 1 . . . . A 295 ASP HA . 30518 1 455 . 1 1 49 49 ASP HB2 H 1 2.818 0.03 . 2 . . . . A 295 ASP HB2 . 30518 1 456 . 1 1 49 49 ASP HB3 H 1 1.961 0.03 . 2 . . . . A 295 ASP HB3 . 30518 1 457 . 1 1 49 49 ASP CA C 13 52.720 0.50 . 1 . . . . A 295 ASP CA . 30518 1 458 . 1 1 49 49 ASP CB C 13 36.520 0.50 . 1 . . . . A 295 ASP CB . 30518 1 459 . 1 1 49 49 ASP N N 15 130.420 0.25 . 1 . . . . A 295 ASP N . 30518 1 460 . 1 1 50 50 MET H H 1 8.800 0.03 . 1 . . . . A 296 MET H . 30518 1 461 . 1 1 50 50 MET HA H 1 4.089 0.03 . 1 . . . . A 296 MET HA . 30518 1 462 . 1 1 50 50 MET HB2 H 1 2.570 0.03 . 2 . . . . A 296 MET HB2 . 30518 1 463 . 1 1 50 50 MET HB3 H 1 2.386 0.03 . 2 . . . . A 296 MET HB3 . 30518 1 464 . 1 1 50 50 MET HG2 H 1 2.602 0.03 . 2 . . . . A 296 MET HG2 . 30518 1 465 . 1 1 50 50 MET HG3 H 1 2.529 0.03 . 2 . . . . A 296 MET HG3 . 30518 1 466 . 1 1 50 50 MET HE1 H 1 2.080 0.03 . 1 . . . . A 296 MET HE1 . 30518 1 467 . 1 1 50 50 MET HE2 H 1 2.080 0.03 . 1 . . . . A 296 MET HE2 . 30518 1 468 . 1 1 50 50 MET HE3 H 1 2.080 0.03 . 1 . . . . A 296 MET HE3 . 30518 1 469 . 1 1 50 50 MET CA C 13 54.450 0.50 . 1 . . . . A 296 MET CA . 30518 1 470 . 1 1 50 50 MET CB C 13 27.520 0.50 . 1 . . . . A 296 MET CB . 30518 1 471 . 1 1 50 50 MET CG C 13 30.466 0.50 . 1 . . . . A 296 MET CG . 30518 1 472 . 1 1 50 50 MET CE C 13 14.400 0.50 . 1 . . . . A 296 MET CE . 30518 1 473 . 1 1 50 50 MET N N 15 107.300 0.25 . 1 . . . . A 296 MET N . 30518 1 474 . 1 1 51 51 LYS H H 1 7.740 0.03 . 1 . . . . A 297 LYS H . 30518 1 475 . 1 1 51 51 LYS HA H 1 5.090 0.03 . 1 . . . . A 297 LYS HA . 30518 1 476 . 1 1 51 51 LYS HB2 H 1 2.086 0.03 . 2 . . . . A 297 LYS HB2 . 30518 1 477 . 1 1 51 51 LYS HB3 H 1 1.929 0.03 . 2 . . . . A 297 LYS HB3 . 30518 1 478 . 1 1 51 51 LYS HG2 H 1 1.772 0.03 . 2 . . . . A 297 LYS HG2 . 30518 1 479 . 1 1 51 51 LYS HG3 H 1 1.772 0.03 . 2 . . . . A 297 LYS HG3 . 30518 1 480 . 1 1 51 51 LYS HD2 H 1 2.032 0.03 . 2 . . . . A 297 LYS HD2 . 30518 1 481 . 1 1 51 51 LYS HD3 H 1 1.861 0.03 . 2 . . . . A 297 LYS HD3 . 30518 1 482 . 1 1 51 51 LYS HE2 H 1 3.189 0.03 . 2 . . . . A 297 LYS HE2 . 30518 1 483 . 1 1 51 51 LYS HE3 H 1 3.189 0.03 . 2 . . . . A 297 LYS HE3 . 30518 1 484 . 1 1 51 51 LYS CA C 13 50.780 0.50 . 1 . . . . A 297 LYS CA . 30518 1 485 . 1 1 51 51 LYS CB C 13 31.800 0.50 . 1 . . . . A 297 LYS CB . 30518 1 486 . 1 1 51 51 LYS CG C 13 22.290 0.50 . 1 . . . . A 297 LYS CG . 30518 1 487 . 1 1 51 51 LYS CD C 13 26.650 0.50 . 1 . . . . A 297 LYS CD . 30518 1 488 . 1 1 51 51 LYS CE C 13 39.730 0.50 . 1 . . . . A 297 LYS CE . 30518 1 489 . 1 1 51 51 LYS N N 15 117.450 0.25 . 1 . . . . A 297 LYS N . 30518 1 490 . 1 1 52 52 PRO HA H 1 4.780 0.03 . 1 . . . . A 298 PRO HA . 30518 1 491 . 1 1 52 52 PRO HB2 H 1 1.118 0.03 . 2 . . . . A 298 PRO HB2 . 30518 1 492 . 1 1 52 52 PRO HB3 H 1 0.929 0.03 . 2 . . . . A 298 PRO HB3 . 30518 1 493 . 1 1 52 52 PRO HG2 H 1 1.651 0.03 . 2 . . . . A 298 PRO HG2 . 30518 1 494 . 1 1 52 52 PRO HG3 H 1 0.770 0.03 . 2 . . . . A 298 PRO HG3 . 30518 1 495 . 1 1 52 52 PRO HD2 H 1 3.723 0.03 . 2 . . . . A 298 PRO HD2 . 30518 1 496 . 1 1 52 52 PRO HD3 H 1 3.436 0.03 . 2 . . . . A 298 PRO HD3 . 30518 1 497 . 1 1 52 52 PRO CA C 13 59.299 0.50 . 1 . . . . A 298 PRO CA . 30518 1 498 . 1 1 52 52 PRO CB C 13 29.295 0.50 . 1 . . . . A 298 PRO CB . 30518 1 499 . 1 1 52 52 PRO CG C 13 24.005 0.50 . 1 . . . . A 298 PRO CG . 30518 1 500 . 1 1 52 52 PRO CD C 13 47.300 0.50 . 1 . . . . A 298 PRO CD . 30518 1 501 . 1 1 53 53 VAL H H 1 9.130 0.03 . 1 . . . . A 299 VAL H . 30518 1 502 . 1 1 53 53 VAL HA H 1 5.195 0.03 . 1 . . . . A 299 VAL HA . 30518 1 503 . 1 1 53 53 VAL HB H 1 1.892 0.03 . 1 . . . . A 299 VAL HB . 30518 1 504 . 1 1 53 53 VAL HG11 H 1 1.152 0.03 . 2 . . . . A 299 VAL HG11 . 30518 1 505 . 1 1 53 53 VAL HG12 H 1 1.152 0.03 . 2 . . . . A 299 VAL HG12 . 30518 1 506 . 1 1 53 53 VAL HG13 H 1 1.152 0.03 . 2 . . . . A 299 VAL HG13 . 30518 1 507 . 1 1 53 53 VAL HG21 H 1 1.063 0.03 . 2 . . . . A 299 VAL HG21 . 30518 1 508 . 1 1 53 53 VAL HG22 H 1 1.063 0.03 . 2 . . . . A 299 VAL HG22 . 30518 1 509 . 1 1 53 53 VAL HG23 H 1 1.063 0.03 . 2 . . . . A 299 VAL HG23 . 30518 1 510 . 1 1 53 53 VAL CA C 13 58.200 0.50 . 1 . . . . A 299 VAL CA . 30518 1 511 . 1 1 53 53 VAL CB C 13 32.700 0.50 . 1 . . . . A 299 VAL CB . 30518 1 512 . 1 1 53 53 VAL CG1 C 13 20.110 0.50 . 2 . . . . A 299 VAL CG1 . 30518 1 513 . 1 1 53 53 VAL CG2 C 13 19.630 0.50 . 2 . . . . A 299 VAL CG2 . 30518 1 514 . 1 1 53 53 VAL N N 15 123.870 0.25 . 1 . . . . A 299 VAL N . 30518 1 515 . 1 1 54 54 CYS H H 1 10.100 0.03 . 1 . . . . A 300 CYS H . 30518 1 516 . 1 1 54 54 CYS HA H 1 4.736 0.03 . 1 . . . . A 300 CYS HA . 30518 1 517 . 1 1 54 54 CYS HB2 H 1 3.515 0.03 . 2 . . . . A 300 CYS HB2 . 30518 1 518 . 1 1 54 54 CYS HB3 H 1 3.216 0.03 . 2 . . . . A 300 CYS HB3 . 30518 1 519 . 1 1 54 54 CYS CA C 13 55.630 0.50 . 1 . . . . A 300 CYS CA . 30518 1 520 . 1 1 54 54 CYS CB C 13 29.020 0.50 . 1 . . . . A 300 CYS CB . 30518 1 521 . 1 1 54 54 CYS N N 15 129.600 0.25 . 1 . . . . A 300 CYS N . 30518 1 522 . 1 1 55 55 LYS H H 1 7.820 0.03 . 1 . . . . A 301 LYS H . 30518 1 523 . 1 1 55 55 LYS HA H 1 3.525 0.03 . 1 . . . . A 301 LYS HA . 30518 1 524 . 1 1 55 55 LYS HB2 H 1 1.766 0.03 . 2 . . . . A 301 LYS HB2 . 30518 1 525 . 1 1 55 55 LYS HB3 H 1 1.615 0.03 . 2 . . . . A 301 LYS HB3 . 30518 1 526 . 1 1 55 55 LYS HG2 H 1 1.285 0.03 . 2 . . . . A 301 LYS HG2 . 30518 1 527 . 1 1 55 55 LYS HG3 H 1 1.285 0.03 . 2 . . . . A 301 LYS HG3 . 30518 1 528 . 1 1 55 55 LYS HD2 H 1 1.624 0.03 . 2 . . . . A 301 LYS HD2 . 30518 1 529 . 1 1 55 55 LYS HD3 H 1 1.624 0.03 . 2 . . . . A 301 LYS HD3 . 30518 1 530 . 1 1 55 55 LYS HE2 H 1 2.760 0.03 . 2 . . . . A 301 LYS HE2 . 30518 1 531 . 1 1 55 55 LYS HE3 H 1 2.760 0.03 . 2 . . . . A 301 LYS HE3 . 30518 1 532 . 1 1 55 55 LYS CA C 13 56.860 0.50 . 1 . . . . A 301 LYS CA . 30518 1 533 . 1 1 55 55 LYS CB C 13 30.340 0.50 . 1 . . . . A 301 LYS CB . 30518 1 534 . 1 1 55 55 LYS CG C 13 22.160 0.50 . 1 . . . . A 301 LYS CG . 30518 1 535 . 1 1 55 55 LYS CD C 13 26.860 0.50 . 1 . . . . A 301 LYS CD . 30518 1 536 . 1 1 55 55 LYS CE C 13 39.330 0.50 . 1 . . . . A 301 LYS CE . 30518 1 537 . 1 1 55 55 LYS N N 15 119.920 0.25 . 1 . . . . A 301 LYS N . 30518 1 538 . 1 1 56 56 LYS H H 1 7.900 0.03 . 1 . . . . A 302 LYS H . 30518 1 539 . 1 1 56 56 LYS HA H 1 3.942 0.03 . 1 . . . . A 302 LYS HA . 30518 1 540 . 1 1 56 56 LYS HB2 H 1 1.902 0.03 . 2 . . . . A 302 LYS HB2 . 30518 1 541 . 1 1 56 56 LYS HB3 H 1 1.902 0.03 . 2 . . . . A 302 LYS HB3 . 30518 1 542 . 1 1 56 56 LYS HG2 H 1 1.373 0.03 . 2 . . . . A 302 LYS HG2 . 30518 1 543 . 1 1 56 56 LYS HG3 H 1 1.481 0.03 . 2 . . . . A 302 LYS HG3 . 30518 1 544 . 1 1 56 56 LYS HD2 H 1 1.651 0.03 . 2 . . . . A 302 LYS HD2 . 30518 1 545 . 1 1 56 56 LYS HD3 H 1 1.651 0.03 . 2 . . . . A 302 LYS HD3 . 30518 1 546 . 1 1 56 56 LYS HE2 H 1 2.945 0.03 . 2 . . . . A 302 LYS HE2 . 30518 1 547 . 1 1 56 56 LYS HE3 H 1 2.945 0.03 . 2 . . . . A 302 LYS HE3 . 30518 1 548 . 1 1 56 56 LYS CA C 13 56.910 0.50 . 1 . . . . A 302 LYS CA . 30518 1 549 . 1 1 56 56 LYS CB C 13 29.680 0.50 . 1 . . . . A 302 LYS CB . 30518 1 550 . 1 1 56 56 LYS CG C 13 22.471 0.50 . 1 . . . . A 302 LYS CG . 30518 1 551 . 1 1 56 56 LYS CD C 13 26.500 0.50 . 1 . . . . A 302 LYS CD . 30518 1 552 . 1 1 56 56 LYS CE C 13 39.380 0.50 . 1 . . . . A 302 LYS CE . 30518 1 553 . 1 1 56 56 LYS N N 15 119.010 0.25 . 1 . . . . A 302 LYS N . 30518 1 554 . 1 1 57 57 CYS H H 1 8.500 0.03 . 1 . . . . A 303 CYS H . 30518 1 555 . 1 1 57 57 CYS HA H 1 3.722 0.03 . 1 . . . . A 303 CYS HA . 30518 1 556 . 1 1 57 57 CYS HB2 H 1 2.920 0.03 . 2 . . . . A 303 CYS HB2 . 30518 1 557 . 1 1 57 57 CYS HB3 H 1 2.583 0.03 . 2 . . . . A 303 CYS HB3 . 30518 1 558 . 1 1 57 57 CYS CA C 13 62.330 0.50 . 1 . . . . A 303 CYS CA . 30518 1 559 . 1 1 57 57 CYS CB C 13 26.060 0.50 . 1 . . . . A 303 CYS CB . 30518 1 560 . 1 1 57 57 CYS N N 15 121.790 0.25 . 1 . . . . A 303 CYS N . 30518 1 561 . 1 1 58 58 TYR H H 1 8.510 0.03 . 1 . . . . A 304 TYR H . 30518 1 562 . 1 1 58 58 TYR HA H 1 2.932 0.03 . 1 . . . . A 304 TYR HA . 30518 1 563 . 1 1 58 58 TYR HB2 H 1 2.625 0.03 . 2 . . . . A 304 TYR HB2 . 30518 1 564 . 1 1 58 58 TYR HB3 H 1 2.545 0.03 . 2 . . . . A 304 TYR HB3 . 30518 1 565 . 1 1 58 58 TYR CA C 13 57.120 0.50 . 1 . . . . A 304 TYR CA . 30518 1 566 . 1 1 58 58 TYR CB C 13 34.990 0.50 . 1 . . . . A 304 TYR CB . 30518 1 567 . 1 1 58 58 TYR N N 15 120.500 0.25 . 1 . . . . A 304 TYR N . 30518 1 568 . 1 1 59 59 GLU H H 1 7.950 0.03 . 1 . . . . A 305 GLU H . 30518 1 569 . 1 1 59 59 GLU HA H 1 3.686 0.03 . 1 . . . . A 305 GLU HA . 30518 1 570 . 1 1 59 59 GLU HB2 H 1 2.920 0.03 . 2 . . . . A 305 GLU HB2 . 30518 1 571 . 1 1 59 59 GLU HB3 H 1 2.583 0.03 . 2 . . . . A 305 GLU HB3 . 30518 1 572 . 1 1 59 59 GLU HG2 H 1 2.436 0.03 . 2 . . . . A 305 GLU HG2 . 30518 1 573 . 1 1 59 59 GLU HG3 H 1 2.323 0.03 . 2 . . . . A 305 GLU HG3 . 30518 1 574 . 1 1 59 59 GLU CA C 13 55.800 0.50 . 1 . . . . A 305 GLU CA . 30518 1 575 . 1 1 59 59 GLU CB C 13 26.650 0.50 . 1 . . . . A 305 GLU CB . 30518 1 576 . 1 1 59 59 GLU CG C 13 33.980 0.50 . 1 . . . . A 305 GLU CG . 30518 1 577 . 1 1 59 59 GLU N N 15 116.770 0.25 . 1 . . . . A 305 GLU N . 30518 1 578 . 1 1 60 60 LYS H H 1 7.090 0.03 . 1 . . . . A 306 LYS H . 30518 1 579 . 1 1 60 60 LYS HA H 1 4.239 0.03 . 1 . . . . A 306 LYS HA . 30518 1 580 . 1 1 60 60 LYS HB2 H 1 1.959 0.03 . 2 . . . . A 306 LYS HB2 . 30518 1 581 . 1 1 60 60 LYS HB3 H 1 1.786 0.03 . 2 . . . . A 306 LYS HB3 . 30518 1 582 . 1 1 60 60 LYS HG2 H 1 1.541 0.03 . 2 . . . . A 306 LYS HG2 . 30518 1 583 . 1 1 60 60 LYS HG3 H 1 1.376 0.03 . 2 . . . . A 306 LYS HG3 . 30518 1 584 . 1 1 60 60 LYS HD2 H 1 1.959 0.03 . 2 . . . . A 306 LYS HD2 . 30518 1 585 . 1 1 60 60 LYS HD3 H 1 1.959 0.03 . 2 . . . . A 306 LYS HD3 . 30518 1 586 . 1 1 60 60 LYS HE2 H 1 2.941 0.03 . 2 . . . . A 306 LYS HE2 . 30518 1 587 . 1 1 60 60 LYS HE3 H 1 2.941 0.03 . 2 . . . . A 306 LYS HE3 . 30518 1 588 . 1 1 60 60 LYS CA C 13 53.290 0.50 . 1 . . . . A 306 LYS CA . 30518 1 589 . 1 1 60 60 LYS CB C 13 30.140 0.50 . 1 . . . . A 306 LYS CB . 30518 1 590 . 1 1 60 60 LYS CG C 13 22.310 0.50 . 1 . . . . A 306 LYS CG . 30518 1 591 . 1 1 60 60 LYS CD C 13 26.590 0.50 . 1 . . . . A 306 LYS CD . 30518 1 592 . 1 1 60 60 LYS CE C 13 39.420 0.50 . 1 . . . . A 306 LYS CE . 30518 1 593 . 1 1 60 60 LYS N N 15 116.200 0.25 . 1 . . . . A 306 LYS N . 30518 1 594 . 1 1 61 61 PHE H H 1 7.620 0.03 . 1 . . . . A 307 PHE H . 30518 1 595 . 1 1 61 61 PHE HA H 1 4.723 0.03 . 1 . . . . A 307 PHE HA . 30518 1 596 . 1 1 61 61 PHE HB2 H 1 3.080 0.03 . 2 . . . . A 307 PHE HB2 . 30518 1 597 . 1 1 61 61 PHE HB3 H 1 2.756 0.03 . 2 . . . . A 307 PHE HB3 . 30518 1 598 . 1 1 61 61 PHE CA C 13 51.550 0.50 . 1 . . . . A 307 PHE CA . 30518 1 599 . 1 1 61 61 PHE CB C 13 34.090 0.50 . 1 . . . . A 307 PHE CB . 30518 1 600 . 1 1 61 61 PHE N N 15 121.940 0.25 . 1 . . . . A 307 PHE N . 30518 1 601 . 1 1 62 62 PRO HA H 1 4.459 0.03 . 1 . . . . A 308 PRO HA . 30518 1 602 . 1 1 62 62 PRO HB2 H 1 2.435 0.03 . 2 . . . . A 308 PRO HB2 . 30518 1 603 . 1 1 62 62 PRO HB3 H 1 1.935 0.03 . 2 . . . . A 308 PRO HB3 . 30518 1 604 . 1 1 62 62 PRO HG2 H 1 2.062 0.03 . 2 . . . . A 308 PRO HG2 . 30518 1 605 . 1 1 62 62 PRO HG3 H 1 2.000 0.03 . 2 . . . . A 308 PRO HG3 . 30518 1 606 . 1 1 62 62 PRO HD2 H 1 3.854 0.03 . 2 . . . . A 308 PRO HD2 . 30518 1 607 . 1 1 62 62 PRO HD3 H 1 3.336 0.03 . 2 . . . . A 308 PRO HD3 . 30518 1 608 . 1 1 62 62 PRO CA C 13 59.953 0.50 . 1 . . . . A 308 PRO CA . 30518 1 609 . 1 1 62 62 PRO CB C 13 29.605 0.50 . 1 . . . . A 308 PRO CB . 30518 1 610 . 1 1 62 62 PRO CG C 13 25.130 0.50 . 1 . . . . A 308 PRO CG . 30518 1 611 . 1 1 62 62 PRO CD C 13 47.828 0.50 . 1 . . . . A 308 PRO CD . 30518 1 612 . 1 1 63 63 LEU H H 1 8.650 0.03 . 1 . . . . A 309 LEU H . 30518 1 613 . 1 1 63 63 LEU HA H 1 3.865 0.03 . 1 . . . . A 309 LEU HA . 30518 1 614 . 1 1 63 63 LEU HB2 H 1 1.729 0.03 . 2 . . . . A 309 LEU HB2 . 30518 1 615 . 1 1 63 63 LEU HB3 H 1 1.641 0.03 . 2 . . . . A 309 LEU HB3 . 30518 1 616 . 1 1 63 63 LEU HG H 1 1.625 0.03 . 1 . . . . A 309 LEU HG . 30518 1 617 . 1 1 63 63 LEU HD11 H 1 0.907 0.03 . 2 . . . . A 309 LEU HD11 . 30518 1 618 . 1 1 63 63 LEU HD12 H 1 0.907 0.03 . 2 . . . . A 309 LEU HD12 . 30518 1 619 . 1 1 63 63 LEU HD13 H 1 0.907 0.03 . 2 . . . . A 309 LEU HD13 . 30518 1 620 . 1 1 63 63 LEU HD21 H 1 0.946 0.03 . 2 . . . . A 309 LEU HD21 . 30518 1 621 . 1 1 63 63 LEU HD22 H 1 0.946 0.03 . 2 . . . . A 309 LEU HD22 . 30518 1 622 . 1 1 63 63 LEU HD23 H 1 0.946 0.03 . 2 . . . . A 309 LEU HD23 . 30518 1 623 . 1 1 63 63 LEU CA C 13 55.930 0.50 . 1 . . . . A 309 LEU CA . 30518 1 624 . 1 1 63 63 LEU CB C 13 39.170 0.50 . 1 . . . . A 309 LEU CB . 30518 1 625 . 1 1 63 63 LEU CG C 13 24.190 0.50 . 1 . . . . A 309 LEU CG . 30518 1 626 . 1 1 63 63 LEU CD1 C 13 21.730 0.50 . 2 . . . . A 309 LEU CD1 . 30518 1 627 . 1 1 63 63 LEU CD2 C 13 21.090 0.50 . 2 . . . . A 309 LEU CD2 . 30518 1 628 . 1 1 63 63 LEU N N 15 124.530 0.25 . 1 . . . . A 309 LEU N . 30518 1 629 . 1 1 64 64 GLU H H 1 9.060 0.03 . 1 . . . . A 310 GLU H . 30518 1 630 . 1 1 64 64 GLU HA H 1 3.954 0.03 . 1 . . . . A 310 GLU HA . 30518 1 631 . 1 1 64 64 GLU HB2 H 1 1.986 0.03 . 2 . . . . A 310 GLU HB2 . 30518 1 632 . 1 1 64 64 GLU HB3 H 1 1.986 0.03 . 2 . . . . A 310 GLU HB3 . 30518 1 633 . 1 1 64 64 GLU HG2 H 1 2.296 0.03 . 2 . . . . A 310 GLU HG2 . 30518 1 634 . 1 1 64 64 GLU HG3 H 1 2.296 0.03 . 2 . . . . A 310 GLU HG3 . 30518 1 635 . 1 1 64 64 GLU CA C 13 56.680 0.50 . 1 . . . . A 310 GLU CA . 30518 1 636 . 1 1 64 64 GLU CB C 13 26.210 0.50 . 1 . . . . A 310 GLU CB . 30518 1 637 . 1 1 64 64 GLU CG C 13 33.430 0.50 . 1 . . . . A 310 GLU CG . 30518 1 638 . 1 1 64 64 GLU N N 15 116.100 0.25 . 1 . . . . A 310 GLU N . 30518 1 639 . 1 1 65 65 LEU H H 1 7.170 0.03 . 1 . . . . A 311 LEU H . 30518 1 640 . 1 1 65 65 LEU HA H 1 4.254 0.03 . 1 . . . . A 311 LEU HA . 30518 1 641 . 1 1 65 65 LEU HB2 H 1 1.625 0.03 . 2 . . . . A 311 LEU HB2 . 30518 1 642 . 1 1 65 65 LEU HB3 H 1 1.527 0.03 . 2 . . . . A 311 LEU HB3 . 30518 1 643 . 1 1 65 65 LEU HG H 1 1.390 0.03 . 1 . . . . A 311 LEU HG . 30518 1 644 . 1 1 65 65 LEU HD11 H 1 0.413 0.03 . 2 . . . . A 311 LEU HD11 . 30518 1 645 . 1 1 65 65 LEU HD12 H 1 0.413 0.03 . 2 . . . . A 311 LEU HD12 . 30518 1 646 . 1 1 65 65 LEU HD13 H 1 0.413 0.03 . 2 . . . . A 311 LEU HD13 . 30518 1 647 . 1 1 65 65 LEU HD21 H 1 0.751 0.03 . 2 . . . . A 311 LEU HD21 . 30518 1 648 . 1 1 65 65 LEU HD22 H 1 0.751 0.03 . 2 . . . . A 311 LEU HD22 . 30518 1 649 . 1 1 65 65 LEU HD23 H 1 0.751 0.03 . 2 . . . . A 311 LEU HD23 . 30518 1 650 . 1 1 65 65 LEU CA C 13 54.340 0.50 . 1 . . . . A 311 LEU CA . 30518 1 651 . 1 1 65 65 LEU CB C 13 39.360 0.50 . 1 . . . . A 311 LEU CB . 30518 1 652 . 1 1 65 65 LEU CG C 13 24.600 0.50 . 1 . . . . A 311 LEU CG . 30518 1 653 . 1 1 65 65 LEU CD1 C 13 21.800 0.50 . 2 . . . . A 311 LEU CD1 . 30518 1 654 . 1 1 65 65 LEU CD2 C 13 20.700 0.50 . 2 . . . . A 311 LEU CD2 . 30518 1 655 . 1 1 65 65 LEU N N 15 119.700 0.25 . 1 . . . . A 311 LEU N . 30518 1 656 . 1 1 66 66 LYS H H 1 8.010 0.03 . 1 . . . . A 312 LYS H . 30518 1 657 . 1 1 66 66 LYS HA H 1 3.960 0.03 . 1 . . . . A 312 LYS HA . 30518 1 658 . 1 1 66 66 LYS HB2 H 1 1.904 0.03 . 2 . . . . A 312 LYS HB2 . 30518 1 659 . 1 1 66 66 LYS HB3 H 1 1.858 0.03 . 2 . . . . A 312 LYS HB3 . 30518 1 660 . 1 1 66 66 LYS HG2 H 1 1.541 0.03 . 2 . . . . A 312 LYS HG2 . 30518 1 661 . 1 1 66 66 LYS HG3 H 1 1.454 0.03 . 2 . . . . A 312 LYS HG3 . 30518 1 662 . 1 1 66 66 LYS HD2 H 1 1.419 0.03 . 2 . . . . A 312 LYS HD2 . 30518 1 663 . 1 1 66 66 LYS HD3 H 1 1.034 0.03 . 2 . . . . A 312 LYS HD3 . 30518 1 664 . 1 1 66 66 LYS HE2 H 1 2.787 0.03 . 2 . . . . A 312 LYS HE2 . 30518 1 665 . 1 1 66 66 LYS HE3 H 1 2.643 0.03 . 2 . . . . A 312 LYS HE3 . 30518 1 666 . 1 1 66 66 LYS CA C 13 57.850 0.50 . 1 . . . . A 312 LYS CA . 30518 1 667 . 1 1 66 66 LYS CB C 13 29.840 0.50 . 1 . . . . A 312 LYS CB . 30518 1 668 . 1 1 66 66 LYS CG C 13 27.210 0.50 . 1 . . . . A 312 LYS CG . 30518 1 669 . 1 1 66 66 LYS CD C 13 23.580 0.50 . 1 . . . . A 312 LYS CD . 30518 1 670 . 1 1 66 66 LYS CE C 13 39.380 0.50 . 1 . . . . A 312 LYS CE . 30518 1 671 . 1 1 66 66 LYS N N 15 118.640 0.25 . 1 . . . . A 312 LYS N . 30518 1 672 . 1 1 67 67 LYS H H 1 8.200 0.03 . 1 . . . . A 313 LYS H . 30518 1 673 . 1 1 67 67 LYS HA H 1 4.000 0.03 . 1 . . . . A 313 LYS HA . 30518 1 674 . 1 1 67 67 LYS HB2 H 1 1.840 0.03 . 2 . . . . A 313 LYS HB2 . 30518 1 675 . 1 1 67 67 LYS HB3 H 1 1.840 0.03 . 2 . . . . A 313 LYS HB3 . 30518 1 676 . 1 1 67 67 LYS HG2 H 1 1.588 0.03 . 2 . . . . A 313 LYS HG2 . 30518 1 677 . 1 1 67 67 LYS HG3 H 1 1.376 0.03 . 2 . . . . A 313 LYS HG3 . 30518 1 678 . 1 1 67 67 LYS HD2 H 1 1.656 0.03 . 2 . . . . A 313 LYS HD2 . 30518 1 679 . 1 1 67 67 LYS HD3 H 1 1.656 0.03 . 2 . . . . A 313 LYS HD3 . 30518 1 680 . 1 1 67 67 LYS HE2 H 1 2.948 0.03 . 2 . . . . A 313 LYS HE2 . 30518 1 681 . 1 1 67 67 LYS HE3 H 1 2.948 0.03 . 2 . . . . A 313 LYS HE3 . 30518 1 682 . 1 1 67 67 LYS CA C 13 56.450 0.50 . 1 . . . . A 313 LYS CA . 30518 1 683 . 1 1 67 67 LYS CB C 13 29.910 0.50 . 1 . . . . A 313 LYS CB . 30518 1 684 . 1 1 67 67 LYS CG C 13 22.640 0.50 . 1 . . . . A 313 LYS CG . 30518 1 685 . 1 1 67 67 LYS CD C 13 26.880 0.50 . 1 . . . . A 313 LYS CD . 30518 1 686 . 1 1 67 67 LYS CE C 13 39.260 0.50 . 1 . . . . A 313 LYS CE . 30518 1 687 . 1 1 67 67 LYS N N 15 117.390 0.25 . 1 . . . . A 313 LYS N . 30518 1 688 . 1 1 68 68 ARG H H 1 7.670 0.03 . 1 . . . . A 314 ARG H . 30518 1 689 . 1 1 68 68 ARG HA H 1 4.234 0.03 . 1 . . . . A 314 ARG HA . 30518 1 690 . 1 1 68 68 ARG HB2 H 1 2.017 0.03 . 2 . . . . A 314 ARG HB2 . 30518 1 691 . 1 1 68 68 ARG HB3 H 1 2.017 0.03 . 2 . . . . A 314 ARG HB3 . 30518 1 692 . 1 1 68 68 ARG HG2 H 1 1.683 0.03 . 2 . . . . A 314 ARG HG2 . 30518 1 693 . 1 1 68 68 ARG HG3 H 1 1.683 0.03 . 2 . . . . A 314 ARG HG3 . 30518 1 694 . 1 1 68 68 ARG HD2 H 1 3.217 0.03 . 2 . . . . A 314 ARG HD2 . 30518 1 695 . 1 1 68 68 ARG HD3 H 1 3.217 0.03 . 2 . . . . A 314 ARG HD3 . 30518 1 696 . 1 1 68 68 ARG CA C 13 55.850 0.50 . 1 . . . . A 314 ARG CA . 30518 1 697 . 1 1 68 68 ARG CB C 13 27.770 0.50 . 1 . . . . A 314 ARG CB . 30518 1 698 . 1 1 68 68 ARG CG C 13 24.630 0.50 . 1 . . . . A 314 ARG CG . 30518 1 699 . 1 1 68 68 ARG CD C 13 41.130 0.50 . 1 . . . . A 314 ARG CD . 30518 1 700 . 1 1 68 68 ARG N N 15 119.670 0.25 . 1 . . . . A 314 ARG N . 30518 1 701 . 1 1 69 69 LEU H H 1 8.180 0.03 . 1 . . . . A 315 LEU H . 30518 1 702 . 1 1 69 69 LEU HA H 1 4.224 0.03 . 1 . . . . A 315 LEU HA . 30518 1 703 . 1 1 69 69 LEU HB2 H 1 1.892 0.03 . 2 . . . . A 315 LEU HB2 . 30518 1 704 . 1 1 69 69 LEU HB3 H 1 1.892 0.03 . 2 . . . . A 315 LEU HB3 . 30518 1 705 . 1 1 69 69 LEU HD11 H 1 0.925 0.03 . 2 . . . . A 315 LEU HD11 . 30518 1 706 . 1 1 69 69 LEU HD12 H 1 0.925 0.03 . 2 . . . . A 315 LEU HD12 . 30518 1 707 . 1 1 69 69 LEU HD13 H 1 0.925 0.03 . 2 . . . . A 315 LEU HD13 . 30518 1 708 . 1 1 69 69 LEU CA C 13 54.170 0.50 . 1 . . . . A 315 LEU CA . 30518 1 709 . 1 1 69 69 LEU CB C 13 38.930 0.50 . 1 . . . . A 315 LEU CB . 30518 1 710 . 1 1 69 69 LEU CG C 13 22.850 0.50 . 1 . . . . A 315 LEU CG . 30518 1 711 . 1 1 69 69 LEU CD1 C 13 20.176 0.50 . 2 . . . . A 315 LEU CD1 . 30518 1 712 . 1 1 69 69 LEU N N 15 119.780 0.25 . 1 . . . . A 315 LEU N . 30518 1 713 . 1 1 70 70 LYS H H 1 8.000 0.03 . 1 . . . . A 316 LYS H . 30518 1 714 . 1 1 70 70 LYS CA C 13 55.440 0.50 . 1 . . . . A 316 LYS CA . 30518 1 715 . 1 1 70 70 LYS CB C 13 29.970 0.50 . 1 . . . . A 316 LYS CB . 30518 1 716 . 1 1 70 70 LYS N N 15 120.970 0.25 . 1 . . . . A 316 LYS N . 30518 1 717 . 1 1 71 71 LYS H H 1 7.960 0.03 . 1 . . . . A 317 LYS H . 30518 1 718 . 1 1 71 71 LYS CA C 13 54.990 0.50 . 1 . . . . A 317 LYS CA . 30518 1 719 . 1 1 71 71 LYS CB C 13 29.680 0.50 . 1 . . . . A 317 LYS CB . 30518 1 720 . 1 1 71 71 LYS N N 15 120.180 0.25 . 1 . . . . A 317 LYS N . 30518 1 721 . 1 1 72 72 LEU H H 1 8.080 0.03 . 1 . . . . A 318 LEU H . 30518 1 722 . 1 1 72 72 LEU HA H 1 4.203 0.03 . 1 . . . . A 318 LEU HA . 30518 1 723 . 1 1 72 72 LEU HB2 H 1 1.728 0.03 . 2 . . . . A 318 LEU HB2 . 30518 1 724 . 1 1 72 72 LEU HB3 H 1 1.635 0.03 . 2 . . . . A 318 LEU HB3 . 30518 1 725 . 1 1 72 72 LEU HG H 1 1.683 0.03 . 1 . . . . A 318 LEU HG . 30518 1 726 . 1 1 72 72 LEU HD11 H 1 0.883 0.03 . 2 . . . . A 318 LEU HD11 . 30518 1 727 . 1 1 72 72 LEU HD12 H 1 0.883 0.03 . 2 . . . . A 318 LEU HD12 . 30518 1 728 . 1 1 72 72 LEU HD13 H 1 0.883 0.03 . 2 . . . . A 318 LEU HD13 . 30518 1 729 . 1 1 72 72 LEU HD21 H 1 0.883 0.03 . 2 . . . . A 318 LEU HD21 . 30518 1 730 . 1 1 72 72 LEU HD22 H 1 0.883 0.03 . 2 . . . . A 318 LEU HD22 . 30518 1 731 . 1 1 72 72 LEU HD23 H 1 0.883 0.03 . 2 . . . . A 318 LEU HD23 . 30518 1 732 . 1 1 72 72 LEU CA C 13 53.930 0.50 . 1 . . . . A 318 LEU CA . 30518 1 733 . 1 1 72 72 LEU CB C 13 39.370 0.50 . 1 . . . . A 318 LEU CB . 30518 1 734 . 1 1 72 72 LEU CG C 13 24.250 0.50 . 1 . . . . A 318 LEU CG . 30518 1 735 . 1 1 72 72 LEU CD1 C 13 21.170 0.50 . 2 . . . . A 318 LEU CD1 . 30518 1 736 . 1 1 72 72 LEU CD2 C 13 22.000 0.50 . 2 . . . . A 318 LEU CD2 . 30518 1 737 . 1 1 72 72 LEU N N 15 121.520 0.25 . 1 . . . . A 318 LEU N . 30518 1 738 . 1 1 73 73 ALA H H 1 8.020 0.03 . 1 . . . . A 319 ALA H . 30518 1 739 . 1 1 73 73 ALA HA H 1 4.192 0.03 . 1 . . . . A 319 ALA HA . 30518 1 740 . 1 1 73 73 ALA HB1 H 1 1.447 0.03 . 1 . . . . A 319 ALA HB1 . 30518 1 741 . 1 1 73 73 ALA HB2 H 1 1.447 0.03 . 1 . . . . A 319 ALA HB2 . 30518 1 742 . 1 1 73 73 ALA HB3 H 1 1.447 0.03 . 1 . . . . A 319 ALA HB3 . 30518 1 743 . 1 1 73 73 ALA CA C 13 51.010 0.50 . 1 . . . . A 319 ALA CA . 30518 1 744 . 1 1 73 73 ALA CB C 13 15.970 0.50 . 1 . . . . A 319 ALA CB . 30518 1 745 . 1 1 73 73 ALA N N 15 122.400 0.25 . 1 . . . . A 319 ALA N . 30518 1 746 . 1 1 74 74 GLU H H 1 8.050 0.03 . 1 . . . . A 320 GLU H . 30518 1 747 . 1 1 74 74 GLU HA H 1 4.215 0.03 . 1 . . . . A 320 GLU HA . 30518 1 748 . 1 1 74 74 GLU HB2 H 1 2.068 0.03 . 2 . . . . A 320 GLU HB2 . 30518 1 749 . 1 1 74 74 GLU HB3 H 1 2.068 0.03 . 2 . . . . A 320 GLU HB3 . 30518 1 750 . 1 1 74 74 GLU HG2 H 1 2.378 0.03 . 2 . . . . A 320 GLU HG2 . 30518 1 751 . 1 1 74 74 GLU HG3 H 1 2.378 0.03 . 2 . . . . A 320 GLU HG3 . 30518 1 752 . 1 1 74 74 GLU CA C 13 54.770 0.50 . 1 . . . . A 320 GLU CA . 30518 1 753 . 1 1 74 74 GLU CB C 13 27.470 0.50 . 1 . . . . A 320 GLU CB . 30518 1 754 . 1 1 74 74 GLU CG C 13 33.700 0.50 . 1 . . . . A 320 GLU CG . 30518 1 755 . 1 1 74 74 GLU N N 15 118.520 0.25 . 1 . . . . A 320 GLU N . 30518 1 756 . 1 1 75 75 THR H H 1 8.010 0.03 . 1 . . . . A 321 THR H . 30518 1 757 . 1 1 75 75 THR HA H 1 4.239 0.03 . 1 . . . . A 321 THR HA . 30518 1 758 . 1 1 75 75 THR HB H 1 4.239 0.03 . 1 . . . . A 321 THR HB . 30518 1 759 . 1 1 75 75 THR HG21 H 1 1.223 0.03 . 1 . . . . A 321 THR HG21 . 30518 1 760 . 1 1 75 75 THR HG22 H 1 1.223 0.03 . 1 . . . . A 321 THR HG22 . 30518 1 761 . 1 1 75 75 THR HG23 H 1 1.223 0.03 . 1 . . . . A 321 THR HG23 . 30518 1 762 . 1 1 75 75 THR CA C 13 60.230 0.50 . 1 . . . . A 321 THR CA . 30518 1 763 . 1 1 75 75 THR CB C 13 66.990 0.50 . 1 . . . . A 321 THR CB . 30518 1 764 . 1 1 75 75 THR CG2 C 13 18.892 0.50 . 1 . . . . A 321 THR CG2 . 30518 1 765 . 1 1 75 75 THR N N 15 113.770 0.25 . 1 . . . . A 321 THR N . 30518 1 766 . 1 1 76 76 LEU H H 1 8.080 0.03 . 1 . . . . A 322 LEU H . 30518 1 767 . 1 1 76 76 LEU HA H 1 4.285 0.03 . 1 . . . . A 322 LEU HA . 30518 1 768 . 1 1 76 76 LEU HB2 H 1 1.726 0.03 . 2 . . . . A 322 LEU HB2 . 30518 1 769 . 1 1 76 76 LEU HB3 H 1 1.639 0.03 . 2 . . . . A 322 LEU HB3 . 30518 1 770 . 1 1 76 76 LEU HG H 1 1.690 0.03 . 1 . . . . A 322 LEU HG . 30518 1 771 . 1 1 76 76 LEU HD11 H 1 0.880 0.03 . 2 . . . . A 322 LEU HD11 . 30518 1 772 . 1 1 76 76 LEU HD12 H 1 0.880 0.03 . 2 . . . . A 322 LEU HD12 . 30518 1 773 . 1 1 76 76 LEU HD13 H 1 0.880 0.03 . 2 . . . . A 322 LEU HD13 . 30518 1 774 . 1 1 76 76 LEU HD21 H 1 0.840 0.03 . 2 . . . . A 322 LEU HD21 . 30518 1 775 . 1 1 76 76 LEU HD22 H 1 0.840 0.03 . 2 . . . . A 322 LEU HD22 . 30518 1 776 . 1 1 76 76 LEU HD23 H 1 0.840 0.03 . 2 . . . . A 322 LEU HD23 . 30518 1 777 . 1 1 76 76 LEU CA C 13 52.980 0.50 . 1 . . . . A 322 LEU CA . 30518 1 778 . 1 1 76 76 LEU CB C 13 39.490 0.50 . 1 . . . . A 322 LEU CB . 30518 1 779 . 1 1 76 76 LEU CG C 13 24.130 0.50 . 1 . . . . A 322 LEU CG . 30518 1 780 . 1 1 76 76 LEU CD1 C 13 22.364 0.50 . 2 . . . . A 322 LEU CD1 . 30518 1 781 . 1 1 76 76 LEU CD2 C 13 20.520 0.50 . 2 . . . . A 322 LEU CD2 . 30518 1 782 . 1 1 76 76 LEU N N 15 123.460 0.25 . 1 . . . . A 322 LEU N . 30518 1 783 . 1 1 77 77 GLY H H 1 8.240 0.03 . 1 . . . . A 323 GLY H . 30518 1 784 . 1 1 77 77 GLY HA2 H 1 4.297 0.03 . 2 . . . . A 323 GLY HA2 . 30518 1 785 . 1 1 77 77 GLY HA3 H 1 3.924 0.03 . 2 . . . . A 323 GLY HA3 . 30518 1 786 . 1 1 77 77 GLY CA C 13 42.720 0.50 . 1 . . . . A 323 GLY CA . 30518 1 787 . 1 1 77 77 GLY N N 15 108.770 0.25 . 1 . . . . A 323 GLY N . 30518 1 788 . 1 1 78 78 ARG H H 1 7.960 0.03 . 1 . . . . A 324 ARG H . 30518 1 789 . 1 1 78 78 ARG HA H 1 4.524 0.03 . 1 . . . . A 324 ARG HA . 30518 1 790 . 1 1 78 78 ARG CA C 13 53.340 0.50 . 1 . . . . A 324 ARG CA . 30518 1 791 . 1 1 78 78 ARG CB C 13 28.190 0.50 . 1 . . . . A 324 ARG CB . 30518 1 792 . 1 1 78 78 ARG CD C 13 40.740 0.50 . 1 . . . . A 324 ARG CD . 30518 1 793 . 1 1 78 78 ARG N N 15 120.730 0.25 . 1 . . . . A 324 ARG N . 30518 1 794 . 1 1 79 79 LYS H H 1 7.990 0.03 . 1 . . . . A 325 LYS H . 30518 1 795 . 1 1 79 79 LYS CA C 13 54.980 0.50 . 1 . . . . A 325 LYS CA . 30518 1 796 . 1 1 79 79 LYS CB C 13 31.030 0.50 . 1 . . . . A 325 LYS CB . 30518 1 797 . 1 1 79 79 LYS N N 15 128.180 0.25 . 1 . . . . A 325 LYS N . 30518 1 stop_ save_